USER MOD reduce.3.24.130724 H: found=0, std=0, add=923, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 920 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 27 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 120 SER OG : rot -42:sc= 0.842 USER MOD Single : A 1 MET CE :methyl -128:sc= 0 (180deg=-0.00525) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 120:sc= 1.3 USER MOD Single : A 11 SER OG : rot 180:sc= -0.588 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 165:sc= -0.62 (180deg=-0.796) USER MOD Single : A 19 HIS :FLIP no HD1:sc= -0.111 F(o=-1.3,f=-0.11) USER MOD Single : A 21 THR OG1 : rot 79:sc= 0.88 USER MOD Single : A 24 GLN : amide:sc=-0.00523 X(o=-0.0052,f=0.23) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot -150:sc= -0.0507 USER MOD Single : A 54 GLN : amide:sc= -0.714 K(o=-0.71,f=-2.1) USER MOD Single : A 55 ASN : amide:sc= -0.118 X(o=-0.12,f=0) USER MOD Single : A 56 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ -154:sc= -0.141 (180deg=-0.65) USER MOD Single : A 60 SER OG : rot 130:sc= 1.07 USER MOD Single : A 70 GLN : amide:sc= -0.113 X(o=-0.11,f=0) USER MOD Single : A 72 SER OG : rot -55:sc= 0.708 USER MOD Single : A 74 TYR OH : rot -173:sc= 0.0794 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 92:sc= 0.437 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -162:sc= -0.132 (180deg=-0.652) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc= -0.124 X(o=-0.12,f=-0.12) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.157 -0.683 0.249 1.00 23.44 N ATOM 2 CA MET A 1 1.990 -0.049 -0.766 1.00 71.43 C ATOM 3 C MET A 1 3.451 -0.455 -0.602 1.00 3.41 C ATOM 4 O MET A 1 3.982 -0.458 0.509 1.00 65.50 O ATOM 5 CB MET A 1 1.858 1.473 -0.687 1.00 25.33 C ATOM 6 CG MET A 1 2.537 2.202 -1.835 1.00 4.14 C ATOM 7 SD MET A 1 2.299 3.988 -1.760 1.00 63.14 S ATOM 8 CE MET A 1 0.639 4.136 -2.417 1.00 24.22 C ATOM 0 H1 MET A 1 0.167 -0.392 0.117 1.00 23.44 H new ATOM 0 H2 MET A 1 1.229 -1.717 0.161 1.00 23.44 H new ATOM 0 H3 MET A 1 1.480 -0.393 1.194 1.00 23.44 H new ATOM 0 HA MET A 1 1.646 -0.385 -1.744 1.00 71.43 H new ATOM 0 HB2 MET A 1 0.801 1.738 -0.674 1.00 25.33 H new ATOM 0 HB3 MET A 1 2.285 1.818 0.255 1.00 25.33 H new ATOM 0 HG2 MET A 1 3.604 1.981 -1.821 1.00 4.14 H new ATOM 0 HG3 MET A 1 2.146 1.827 -2.781 1.00 4.14 H new ATOM 0 HE1 MET A 1 0.632 4.866 -3.227 1.00 24.22 H new ATOM 0 HE2 MET A 1 0.311 3.169 -2.797 1.00 24.22 H new ATOM 0 HE3 MET A 1 -0.037 4.464 -1.627 1.00 24.22 H new ATOM 18 N ILE A 2 4.095 -0.795 -1.713 1.00 52.04 N ATOM 19 CA ILE A 2 5.495 -1.201 -1.691 1.00 54.23 C ATOM 20 C ILE A 2 6.363 -0.142 -1.020 1.00 22.41 C ATOM 21 O ILE A 2 6.706 0.871 -1.629 1.00 2.23 O ATOM 22 CB ILE A 2 6.028 -1.461 -3.112 1.00 41.55 C ATOM 23 CG1 ILE A 2 5.196 -2.543 -3.803 1.00 23.41 C ATOM 24 CG2 ILE A 2 7.494 -1.863 -3.063 1.00 5.35 C ATOM 25 CD1 ILE A 2 5.272 -3.891 -3.120 1.00 14.24 C ATOM 0 H ILE A 2 3.670 -0.797 -2.640 1.00 52.04 H new ATOM 0 HA ILE A 2 5.547 -2.127 -1.118 1.00 54.23 H new ATOM 0 HB ILE A 2 5.943 -0.540 -3.689 1.00 41.55 H new ATOM 0 HG12 ILE A 2 4.155 -2.222 -3.840 1.00 23.41 H new ATOM 0 HG13 ILE A 2 5.534 -2.647 -4.834 1.00 23.41 H new ATOM 0 HG21 ILE A 2 7.856 -2.043 -4.075 1.00 5.35 H new ATOM 0 HG22 ILE A 2 8.076 -1.062 -2.607 1.00 5.35 H new ATOM 0 HG23 ILE A 2 7.602 -2.772 -2.472 1.00 5.35 H new ATOM 0 HD11 ILE A 2 4.658 -4.609 -3.664 1.00 14.24 H new ATOM 0 HD12 ILE A 2 6.306 -4.234 -3.106 1.00 14.24 H new ATOM 0 HD13 ILE A 2 4.906 -3.802 -2.097 1.00 14.24 H new ATOM 37 N ARG A 3 6.717 -0.386 0.238 1.00 40.22 N ATOM 38 CA ARG A 3 7.547 0.546 0.992 1.00 14.01 C ATOM 39 C ARG A 3 9.028 0.290 0.730 1.00 51.44 C ATOM 40 O ARG A 3 9.823 1.226 0.630 1.00 31.40 O ATOM 41 CB ARG A 3 7.255 0.425 2.489 1.00 53.31 C ATOM 42 CG ARG A 3 7.451 1.724 3.254 1.00 34.23 C ATOM 43 CD ARG A 3 6.472 2.794 2.796 1.00 35.54 C ATOM 44 NE ARG A 3 6.493 3.965 3.668 1.00 24.14 N ATOM 45 CZ ARG A 3 5.641 4.978 3.560 1.00 70.21 C ATOM 46 NH1 ARG A 3 4.704 4.963 2.622 1.00 60.41 N ATOM 47 NH2 ARG A 3 5.725 6.009 4.391 1.00 35.21 N ATOM 0 H ARG A 3 6.442 -1.221 0.756 1.00 40.22 H new ATOM 0 HA ARG A 3 7.307 1.557 0.662 1.00 14.01 H new ATOM 0 HB2 ARG A 3 6.228 0.085 2.624 1.00 53.31 H new ATOM 0 HB3 ARG A 3 7.903 -0.340 2.916 1.00 53.31 H new ATOM 0 HG2 ARG A 3 7.320 1.542 4.321 1.00 34.23 H new ATOM 0 HG3 ARG A 3 8.472 2.079 3.114 1.00 34.23 H new ATOM 0 HD2 ARG A 3 6.716 3.096 1.778 1.00 35.54 H new ATOM 0 HD3 ARG A 3 5.465 2.378 2.773 1.00 35.54 H new ATOM 0 HE ARG A 3 7.201 4.007 4.401 1.00 24.14 H new ATOM 0 HH11 ARG A 3 4.636 4.172 1.981 1.00 60.41 H new ATOM 0 HH12 ARG A 3 4.051 5.742 2.541 1.00 60.41 H new ATOM 0 HH21 ARG A 3 6.445 6.024 5.114 1.00 35.21 H new ATOM 0 HH22 ARG A 3 5.070 6.786 4.307 1.00 35.21 H new ATOM 61 N THR A 4 9.393 -0.983 0.619 1.00 71.20 N ATOM 62 CA THR A 4 10.778 -1.362 0.370 1.00 31.40 C ATOM 63 C THR A 4 10.859 -2.675 -0.400 1.00 74.33 C ATOM 64 O THR A 4 9.837 -3.299 -0.690 1.00 23.52 O ATOM 65 CB THR A 4 11.567 -1.503 1.685 1.00 0.14 C ATOM 66 OG1 THR A 4 10.916 -2.441 2.549 1.00 21.05 O ATOM 67 CG2 THR A 4 11.691 -0.159 2.388 1.00 33.54 C ATOM 0 H THR A 4 8.748 -1.769 0.698 1.00 71.20 H new ATOM 0 HA THR A 4 11.221 -0.565 -0.228 1.00 31.40 H new ATOM 0 HB THR A 4 12.567 -1.864 1.446 1.00 0.14 H new ATOM 0 HG1 THR A 4 11.522 -3.188 2.737 1.00 21.05 H new ATOM 0 HG21 THR A 4 12.252 -0.283 3.314 1.00 33.54 H new ATOM 0 HG22 THR A 4 12.213 0.544 1.739 1.00 33.54 H new ATOM 0 HG23 THR A 4 10.697 0.226 2.615 1.00 33.54 H new ATOM 75 N ILE A 5 12.078 -3.089 -0.729 1.00 33.22 N ATOM 76 CA ILE A 5 12.290 -4.330 -1.464 1.00 44.42 C ATOM 77 C ILE A 5 13.599 -4.995 -1.053 1.00 5.10 C ATOM 78 O ILE A 5 14.583 -4.319 -0.747 1.00 33.14 O ATOM 79 CB ILE A 5 12.307 -4.087 -2.985 1.00 14.30 C ATOM 80 CG1 ILE A 5 11.016 -3.393 -3.426 1.00 44.14 C ATOM 81 CG2 ILE A 5 12.489 -5.401 -3.729 1.00 61.03 C ATOM 82 CD1 ILE A 5 10.970 -3.089 -4.907 1.00 41.44 C ATOM 0 H ILE A 5 12.933 -2.584 -0.498 1.00 33.22 H new ATOM 0 HA ILE A 5 11.457 -4.989 -1.218 1.00 44.42 H new ATOM 0 HB ILE A 5 13.148 -3.437 -3.225 1.00 14.30 H new ATOM 0 HG12 ILE A 5 10.166 -4.025 -3.166 1.00 44.14 H new ATOM 0 HG13 ILE A 5 10.904 -2.463 -2.869 1.00 44.14 H new ATOM 0 HG21 ILE A 5 12.499 -5.213 -4.803 1.00 61.03 H new ATOM 0 HG22 ILE A 5 13.432 -5.860 -3.432 1.00 61.03 H new ATOM 0 HG23 ILE A 5 11.666 -6.074 -3.486 1.00 61.03 H new ATOM 0 HD11 ILE A 5 10.027 -2.598 -5.148 1.00 41.44 H new ATOM 0 HD12 ILE A 5 11.799 -2.432 -5.170 1.00 41.44 H new ATOM 0 HD13 ILE A 5 11.050 -4.018 -5.472 1.00 41.44 H new ATOM 94 N LEU A 6 13.606 -6.323 -1.050 1.00 20.31 N ATOM 95 CA LEU A 6 14.795 -7.082 -0.678 1.00 45.33 C ATOM 96 C LEU A 6 15.131 -8.124 -1.740 1.00 54.03 C ATOM 97 O LEU A 6 14.276 -8.914 -2.140 1.00 20.10 O ATOM 98 CB LEU A 6 14.587 -7.764 0.675 1.00 61.33 C ATOM 99 CG LEU A 6 15.846 -7.993 1.512 1.00 12.43 C ATOM 100 CD1 LEU A 6 16.862 -8.815 0.735 1.00 1.12 C ATOM 101 CD2 LEU A 6 16.449 -6.663 1.942 1.00 60.22 C ATOM 0 H LEU A 6 12.801 -6.897 -1.301 1.00 20.31 H new ATOM 0 HA LEU A 6 15.630 -6.386 -0.602 1.00 45.33 H new ATOM 0 HB2 LEU A 6 13.891 -7.162 1.259 1.00 61.33 H new ATOM 0 HB3 LEU A 6 14.109 -8.728 0.504 1.00 61.33 H new ATOM 0 HG LEU A 6 15.568 -8.550 2.407 1.00 12.43 H new ATOM 0 HD11 LEU A 6 17.751 -8.968 1.347 1.00 1.12 H new ATOM 0 HD12 LEU A 6 16.428 -9.781 0.478 1.00 1.12 H new ATOM 0 HD13 LEU A 6 17.136 -8.286 -0.178 1.00 1.12 H new ATOM 0 HD21 LEU A 6 17.344 -6.845 2.537 1.00 60.22 H new ATOM 0 HD22 LEU A 6 16.712 -6.080 1.059 1.00 60.22 H new ATOM 0 HD23 LEU A 6 15.723 -6.110 2.538 1.00 60.22 H new ATOM 113 N ALA A 7 16.381 -8.121 -2.192 1.00 14.34 N ATOM 114 CA ALA A 7 16.830 -9.069 -3.204 1.00 11.53 C ATOM 115 C ALA A 7 18.158 -9.705 -2.809 1.00 21.13 C ATOM 116 O ALA A 7 19.046 -9.034 -2.281 1.00 72.32 O ATOM 117 CB ALA A 7 16.954 -8.379 -4.554 1.00 71.04 C ATOM 0 H ALA A 7 17.101 -7.472 -1.873 1.00 14.34 H new ATOM 0 HA ALA A 7 16.086 -9.862 -3.280 1.00 11.53 H new ATOM 0 HB1 ALA A 7 17.290 -9.098 -5.301 1.00 71.04 H new ATOM 0 HB2 ALA A 7 15.984 -7.977 -4.848 1.00 71.04 H new ATOM 0 HB3 ALA A 7 17.677 -7.566 -4.482 1.00 71.04 H new ATOM 123 N ILE A 8 18.287 -11.002 -3.066 1.00 70.24 N ATOM 124 CA ILE A 8 19.507 -11.728 -2.738 1.00 24.23 C ATOM 125 C ILE A 8 19.897 -12.685 -3.859 1.00 50.15 C ATOM 126 O ILE A 8 19.048 -13.375 -4.423 1.00 72.24 O ATOM 127 CB ILE A 8 19.353 -12.525 -1.429 1.00 21.30 C ATOM 128 CG1 ILE A 8 18.745 -11.642 -0.337 1.00 73.54 C ATOM 129 CG2 ILE A 8 20.699 -13.077 -0.983 1.00 0.31 C ATOM 130 CD1 ILE A 8 17.261 -11.863 -0.139 1.00 4.11 C ATOM 0 H ILE A 8 17.561 -11.572 -3.501 1.00 70.24 H new ATOM 0 HA ILE A 8 20.292 -10.983 -2.611 1.00 24.23 H new ATOM 0 HB ILE A 8 18.680 -13.363 -1.609 1.00 21.30 H new ATOM 0 HG12 ILE A 8 19.262 -11.833 0.604 1.00 73.54 H new ATOM 0 HG13 ILE A 8 18.918 -10.596 -0.588 1.00 73.54 H new ATOM 0 HG21 ILE A 8 20.573 -13.638 -0.057 1.00 0.31 H new ATOM 0 HG22 ILE A 8 21.096 -13.736 -1.755 1.00 0.31 H new ATOM 0 HG23 ILE A 8 21.393 -12.253 -0.817 1.00 0.31 H new ATOM 0 HD11 ILE A 8 16.897 -11.204 0.650 1.00 4.11 H new ATOM 0 HD12 ILE A 8 16.733 -11.644 -1.067 1.00 4.11 H new ATOM 0 HD13 ILE A 8 17.082 -12.900 0.143 1.00 4.11 H new ATOM 142 N ASP A 9 21.186 -12.722 -4.177 1.00 4.41 N ATOM 143 CA ASP A 9 21.690 -13.596 -5.230 1.00 20.14 C ATOM 144 C ASP A 9 23.202 -13.763 -5.120 1.00 23.52 C ATOM 145 O ASP A 9 23.862 -13.055 -4.359 1.00 53.43 O ATOM 146 CB ASP A 9 21.325 -13.036 -6.605 1.00 71.34 C ATOM 147 CG ASP A 9 21.549 -11.540 -6.700 1.00 3.14 C ATOM 148 OD1 ASP A 9 20.669 -10.778 -6.247 1.00 1.11 O ATOM 149 OD2 ASP A 9 22.605 -11.131 -7.225 1.00 44.31 O ATOM 0 H ASP A 9 21.902 -12.156 -3.720 1.00 4.41 H new ATOM 0 HA ASP A 9 21.225 -14.574 -5.110 1.00 20.14 H new ATOM 0 HB2 ASP A 9 21.920 -13.538 -7.368 1.00 71.34 H new ATOM 0 HB3 ASP A 9 20.279 -13.258 -6.818 1.00 71.34 H new ATOM 154 N ASP A 10 23.745 -14.706 -5.883 1.00 10.30 N ATOM 155 CA ASP A 10 25.180 -14.967 -5.872 1.00 13.43 C ATOM 156 C ASP A 10 25.828 -14.495 -7.169 1.00 41.43 C ATOM 157 O ASP A 10 26.666 -15.189 -7.745 1.00 32.12 O ATOM 158 CB ASP A 10 25.447 -16.459 -5.667 1.00 12.42 C ATOM 159 CG ASP A 10 25.270 -16.886 -4.223 1.00 12.51 C ATOM 160 OD1 ASP A 10 25.093 -16.000 -3.359 1.00 64.45 O ATOM 161 OD2 ASP A 10 25.307 -18.105 -3.956 1.00 51.25 O ATOM 0 H ASP A 10 23.213 -15.302 -6.517 1.00 10.30 H new ATOM 0 HA ASP A 10 25.619 -14.410 -5.044 1.00 13.43 H new ATOM 0 HB2 ASP A 10 24.772 -17.036 -6.299 1.00 12.42 H new ATOM 0 HB3 ASP A 10 26.462 -16.691 -5.990 1.00 12.42 H new ATOM 166 N SER A 11 25.434 -13.310 -7.625 1.00 0.30 N ATOM 167 CA SER A 11 25.973 -12.747 -8.857 1.00 41.14 C ATOM 168 C SER A 11 25.955 -11.222 -8.812 1.00 33.01 C ATOM 169 O SER A 11 24.892 -10.602 -8.837 1.00 71.22 O ATOM 170 CB SER A 11 25.171 -13.242 -10.063 1.00 24.14 C ATOM 171 OG SER A 11 23.784 -13.271 -9.775 1.00 61.41 O ATOM 0 H SER A 11 24.743 -12.721 -7.159 1.00 0.30 H new ATOM 0 HA SER A 11 27.007 -13.078 -8.956 1.00 41.14 H new ATOM 0 HB2 SER A 11 25.355 -12.591 -10.918 1.00 24.14 H new ATOM 0 HB3 SER A 11 25.508 -14.240 -10.344 1.00 24.14 H new ATOM 0 HG SER A 11 23.293 -13.589 -10.561 1.00 61.41 H new ATOM 177 N ALA A 12 27.140 -10.624 -8.744 1.00 54.04 N ATOM 178 CA ALA A 12 27.261 -9.172 -8.697 1.00 60.22 C ATOM 179 C ALA A 12 26.482 -8.519 -9.834 1.00 0.02 C ATOM 180 O ALA A 12 25.907 -7.443 -9.669 1.00 13.35 O ATOM 181 CB ALA A 12 28.725 -8.763 -8.755 1.00 3.11 C ATOM 0 H ALA A 12 28.030 -11.123 -8.720 1.00 54.04 H new ATOM 0 HA ALA A 12 26.835 -8.827 -7.755 1.00 60.22 H new ATOM 0 HB1 ALA A 12 28.801 -7.676 -8.719 1.00 3.11 H new ATOM 0 HB2 ALA A 12 29.257 -9.192 -7.906 1.00 3.11 H new ATOM 0 HB3 ALA A 12 29.168 -9.127 -9.682 1.00 3.11 H new ATOM 187 N THR A 13 26.468 -9.176 -10.990 1.00 14.05 N ATOM 188 CA THR A 13 25.761 -8.658 -12.154 1.00 70.23 C ATOM 189 C THR A 13 24.259 -8.589 -11.900 1.00 45.24 C ATOM 190 O THR A 13 23.635 -7.547 -12.099 1.00 33.25 O ATOM 191 CB THR A 13 26.020 -9.526 -13.400 1.00 71.31 C ATOM 192 OG1 THR A 13 27.426 -9.606 -13.658 1.00 21.21 O ATOM 193 CG2 THR A 13 25.308 -8.953 -14.616 1.00 70.33 C ATOM 0 H THR A 13 26.938 -10.068 -11.144 1.00 14.05 H new ATOM 0 HA THR A 13 26.142 -7.653 -12.334 1.00 70.23 H new ATOM 0 HB THR A 13 25.629 -10.525 -13.207 1.00 71.31 H new ATOM 0 HG1 THR A 13 27.582 -10.161 -14.451 1.00 21.21 H new ATOM 0 HG21 THR A 13 25.506 -9.583 -15.484 1.00 70.33 H new ATOM 0 HG22 THR A 13 24.235 -8.921 -14.428 1.00 70.33 H new ATOM 0 HG23 THR A 13 25.673 -7.944 -14.809 1.00 70.33 H new ATOM 201 N MET A 14 23.686 -9.704 -11.460 1.00 62.13 N ATOM 202 CA MET A 14 22.257 -9.768 -11.177 1.00 60.15 C ATOM 203 C MET A 14 21.892 -8.855 -10.011 1.00 63.02 C ATOM 204 O MET A 14 20.934 -8.086 -10.089 1.00 42.22 O ATOM 205 CB MET A 14 21.841 -11.207 -10.864 1.00 4.45 C ATOM 206 CG MET A 14 20.336 -11.399 -10.779 1.00 20.51 C ATOM 207 SD MET A 14 19.828 -13.082 -11.182 1.00 54.32 S ATOM 208 CE MET A 14 19.201 -13.635 -9.598 1.00 24.11 C ATOM 0 H MET A 14 24.189 -10.575 -11.292 1.00 62.13 H new ATOM 0 HA MET A 14 21.721 -9.427 -12.063 1.00 60.15 H new ATOM 0 HB2 MET A 14 22.241 -11.868 -11.633 1.00 4.45 H new ATOM 0 HB3 MET A 14 22.292 -11.509 -9.919 1.00 4.45 H new ATOM 0 HG2 MET A 14 19.998 -11.153 -9.772 1.00 20.51 H new ATOM 0 HG3 MET A 14 19.846 -10.703 -11.459 1.00 20.51 H new ATOM 0 HE1 MET A 14 18.614 -14.543 -9.736 1.00 24.11 H new ATOM 0 HE2 MET A 14 20.036 -13.841 -8.928 1.00 24.11 H new ATOM 0 HE3 MET A 14 18.571 -12.858 -9.165 1.00 24.11 H new ATOM 218 N ARG A 15 22.662 -8.946 -8.931 1.00 54.24 N ATOM 219 CA ARG A 15 22.418 -8.129 -7.749 1.00 12.22 C ATOM 220 C ARG A 15 22.318 -6.652 -8.119 1.00 43.13 C ATOM 221 O ARG A 15 21.526 -5.909 -7.541 1.00 5.43 O ATOM 222 CB ARG A 15 23.533 -8.334 -6.722 1.00 43.02 C ATOM 223 CG ARG A 15 23.027 -8.706 -5.338 1.00 75.14 C ATOM 224 CD ARG A 15 24.148 -8.692 -4.312 1.00 4.12 C ATOM 225 NE ARG A 15 24.564 -7.333 -3.974 1.00 32.22 N ATOM 226 CZ ARG A 15 25.502 -7.054 -3.076 1.00 40.50 C ATOM 227 NH1 ARG A 15 26.119 -8.033 -2.430 1.00 63.21 N ATOM 228 NH2 ARG A 15 25.825 -5.792 -2.823 1.00 51.42 N ATOM 0 H ARG A 15 23.459 -9.577 -8.851 1.00 54.24 H new ATOM 0 HA ARG A 15 21.469 -8.441 -7.313 1.00 12.22 H new ATOM 0 HB2 ARG A 15 24.203 -9.117 -7.077 1.00 43.02 H new ATOM 0 HB3 ARG A 15 24.122 -7.419 -6.650 1.00 43.02 H new ATOM 0 HG2 ARG A 15 22.247 -8.008 -5.035 1.00 75.14 H new ATOM 0 HG3 ARG A 15 22.574 -9.697 -5.369 1.00 75.14 H new ATOM 0 HD2 ARG A 15 23.819 -9.206 -3.409 1.00 4.12 H new ATOM 0 HD3 ARG A 15 25.002 -9.246 -4.701 1.00 4.12 H new ATOM 0 HE ARG A 15 24.109 -6.556 -4.454 1.00 32.22 H new ATOM 0 HH11 ARG A 15 25.874 -9.004 -2.622 1.00 63.21 H new ATOM 0 HH12 ARG A 15 26.839 -7.815 -1.741 1.00 63.21 H new ATOM 0 HH21 ARG A 15 25.353 -5.036 -3.318 1.00 51.42 H new ATOM 0 HH22 ARG A 15 26.545 -5.578 -2.133 1.00 51.42 H new ATOM 242 N ALA A 16 23.128 -6.234 -9.087 1.00 73.21 N ATOM 243 CA ALA A 16 23.130 -4.847 -9.536 1.00 32.32 C ATOM 244 C ALA A 16 22.024 -4.598 -10.555 1.00 75.53 C ATOM 245 O ALA A 16 21.346 -3.571 -10.513 1.00 51.31 O ATOM 246 CB ALA A 16 24.485 -4.485 -10.126 1.00 31.54 C ATOM 0 H ALA A 16 23.791 -6.836 -9.575 1.00 73.21 H new ATOM 0 HA ALA A 16 22.941 -4.211 -8.671 1.00 32.32 H new ATOM 0 HB1 ALA A 16 24.472 -3.447 -10.457 1.00 31.54 H new ATOM 0 HB2 ALA A 16 25.258 -4.615 -9.369 1.00 31.54 H new ATOM 0 HB3 ALA A 16 24.697 -5.134 -10.976 1.00 31.54 H new ATOM 252 N LEU A 17 21.846 -5.544 -11.471 1.00 71.31 N ATOM 253 CA LEU A 17 20.821 -5.427 -12.503 1.00 23.30 C ATOM 254 C LEU A 17 19.442 -5.236 -11.881 1.00 54.12 C ATOM 255 O LEU A 17 18.793 -4.210 -12.088 1.00 14.40 O ATOM 256 CB LEU A 17 20.823 -6.670 -13.395 1.00 24.23 C ATOM 257 CG LEU A 17 19.920 -6.614 -14.627 1.00 14.22 C ATOM 258 CD1 LEU A 17 18.473 -6.880 -14.240 1.00 50.43 C ATOM 259 CD2 LEU A 17 20.049 -5.266 -15.322 1.00 31.22 C ATOM 0 H LEU A 17 22.398 -6.400 -11.520 1.00 71.31 H new ATOM 0 HA LEU A 17 21.050 -4.551 -13.110 1.00 23.30 H new ATOM 0 HB2 LEU A 17 21.845 -6.853 -13.727 1.00 24.23 H new ATOM 0 HB3 LEU A 17 20.526 -7.527 -12.790 1.00 24.23 H new ATOM 0 HG LEU A 17 20.238 -7.391 -15.323 1.00 14.22 H new ATOM 0 HD11 LEU A 17 17.845 -6.836 -15.129 1.00 50.43 H new ATOM 0 HD12 LEU A 17 18.393 -7.868 -13.788 1.00 50.43 H new ATOM 0 HD13 LEU A 17 18.143 -6.126 -13.525 1.00 50.43 H new ATOM 0 HD21 LEU A 17 19.399 -5.244 -16.197 1.00 31.22 H new ATOM 0 HD22 LEU A 17 19.758 -4.472 -14.634 1.00 31.22 H new ATOM 0 HD23 LEU A 17 21.082 -5.115 -15.634 1.00 31.22 H new ATOM 271 N LEU A 18 19.000 -6.229 -11.117 1.00 51.24 N ATOM 272 CA LEU A 18 17.698 -6.169 -10.463 1.00 34.34 C ATOM 273 C LEU A 18 17.580 -4.919 -9.597 1.00 21.13 C ATOM 274 O LEU A 18 16.619 -4.158 -9.714 1.00 1.01 O ATOM 275 CB LEU A 18 17.477 -7.418 -9.607 1.00 62.45 C ATOM 276 CG LEU A 18 17.664 -8.760 -10.318 1.00 3.44 C ATOM 277 CD1 LEU A 18 17.485 -9.911 -9.340 1.00 50.31 C ATOM 278 CD2 LEU A 18 16.691 -8.888 -11.480 1.00 53.10 C ATOM 0 H LEU A 18 19.524 -7.085 -10.935 1.00 51.24 H new ATOM 0 HA LEU A 18 16.932 -6.126 -11.237 1.00 34.34 H new ATOM 0 HB2 LEU A 18 18.162 -7.380 -8.760 1.00 62.45 H new ATOM 0 HB3 LEU A 18 16.466 -7.382 -9.201 1.00 62.45 H new ATOM 0 HG LEU A 18 18.679 -8.802 -10.714 1.00 3.44 H new ATOM 0 HD11 LEU A 18 17.621 -10.857 -9.863 1.00 50.31 H new ATOM 0 HD12 LEU A 18 18.222 -9.828 -8.542 1.00 50.31 H new ATOM 0 HD13 LEU A 18 16.483 -9.873 -8.913 1.00 50.31 H new ATOM 0 HD21 LEU A 18 16.838 -9.848 -11.974 1.00 53.10 H new ATOM 0 HD22 LEU A 18 15.669 -8.825 -11.107 1.00 53.10 H new ATOM 0 HD23 LEU A 18 16.868 -8.083 -12.193 1.00 53.10 H new ATOM 290 N HIS A 19 18.565 -4.712 -8.729 1.00 2.05 N ATOM 291 CA HIS A 19 18.574 -3.552 -7.844 1.00 52.14 C ATOM 292 C HIS A 19 18.372 -2.264 -8.637 1.00 2.44 C ATOM 293 O HIS A 19 17.613 -1.385 -8.229 1.00 22.15 O ATOM 294 CB HIS A 19 19.889 -3.486 -7.067 1.00 71.14 C ATOM 295 CG HIS A 19 20.026 -2.256 -6.224 1.00 55.22 C ATOM 296 ND1 HIS A 19 19.090 -1.408 -5.737 1.00 54.11 N flip ATOM 297 CD2 HIS A 19 21.242 -1.773 -5.789 1.00 54.24 C flip ATOM 298 CE1 HIS A 19 19.750 -0.439 -5.023 1.00 33.04 C flip ATOM 299 NE2 HIS A 19 21.048 -0.682 -5.070 1.00 43.43 N flip ATOM 0 H HIS A 19 19.367 -5.332 -8.619 1.00 2.05 H new ATOM 0 HA HIS A 19 17.750 -3.657 -7.138 1.00 52.14 H new ATOM 0 HB2 HIS A 19 19.968 -4.365 -6.428 1.00 71.14 H new ATOM 0 HB3 HIS A 19 20.720 -3.528 -7.771 1.00 71.14 H new ATOM 0 HD2 HIS A 19 22.203 -2.217 -6.003 1.00 54.24 H new ATOM 0 HE1 HIS A 19 19.284 0.387 -4.507 1.00 33.04 H new ATOM 0 HE2 HIS A 19 21.776 -0.122 -4.626 1.00 43.43 H new ATOM 307 N ALA A 20 19.058 -2.158 -9.770 1.00 74.54 N ATOM 308 CA ALA A 20 18.953 -0.979 -10.620 1.00 14.42 C ATOM 309 C ALA A 20 17.583 -0.901 -11.285 1.00 15.13 C ATOM 310 O ALA A 20 16.957 0.159 -11.320 1.00 54.11 O ATOM 311 CB ALA A 20 20.052 -0.986 -11.671 1.00 42.15 C ATOM 0 H ALA A 20 19.693 -2.875 -10.121 1.00 74.54 H new ATOM 0 HA ALA A 20 19.073 -0.097 -9.991 1.00 14.42 H new ATOM 0 HB1 ALA A 20 19.961 -0.099 -12.299 1.00 42.15 H new ATOM 0 HB2 ALA A 20 21.025 -0.985 -11.180 1.00 42.15 H new ATOM 0 HB3 ALA A 20 19.959 -1.879 -12.289 1.00 42.15 H new ATOM 317 N THR A 21 17.121 -2.031 -11.812 1.00 51.44 N ATOM 318 CA THR A 21 15.826 -2.090 -12.478 1.00 52.10 C ATOM 319 C THR A 21 14.731 -1.486 -11.606 1.00 2.31 C ATOM 320 O THR A 21 13.868 -0.754 -12.093 1.00 2.01 O ATOM 321 CB THR A 21 15.442 -3.539 -12.833 1.00 4.11 C ATOM 322 OG1 THR A 21 16.564 -4.214 -13.414 1.00 34.12 O ATOM 323 CG2 THR A 21 14.270 -3.567 -13.802 1.00 12.34 C ATOM 0 H THR A 21 17.625 -2.918 -11.790 1.00 51.44 H new ATOM 0 HA THR A 21 15.917 -1.510 -13.397 1.00 52.10 H new ATOM 0 HB THR A 21 15.146 -4.048 -11.916 1.00 4.11 H new ATOM 0 HG1 THR A 21 17.183 -4.488 -12.706 1.00 34.12 H new ATOM 0 HG21 THR A 21 14.017 -4.601 -14.038 1.00 12.34 H new ATOM 0 HG22 THR A 21 13.409 -3.078 -13.346 1.00 12.34 H new ATOM 0 HG23 THR A 21 14.542 -3.042 -14.718 1.00 12.34 H new ATOM 331 N LEU A 22 14.772 -1.795 -10.315 1.00 31.23 N ATOM 332 CA LEU A 22 13.783 -1.281 -9.373 1.00 71.53 C ATOM 333 C LEU A 22 14.175 0.106 -8.875 1.00 32.22 C ATOM 334 O LEU A 22 13.317 0.956 -8.638 1.00 44.34 O ATOM 335 CB LEU A 22 13.632 -2.238 -8.189 1.00 3.20 C ATOM 336 CG LEU A 22 12.648 -3.392 -8.379 1.00 73.13 C ATOM 337 CD1 LEU A 22 13.021 -4.565 -7.486 1.00 61.02 C ATOM 338 CD2 LEU A 22 11.226 -2.933 -8.093 1.00 15.23 C ATOM 0 H LEU A 22 15.479 -2.399 -9.896 1.00 31.23 H new ATOM 0 HA LEU A 22 12.828 -1.203 -9.893 1.00 71.53 H new ATOM 0 HB2 LEU A 22 14.612 -2.657 -7.959 1.00 3.20 H new ATOM 0 HB3 LEU A 22 13.320 -1.661 -7.319 1.00 3.20 H new ATOM 0 HG LEU A 22 12.701 -3.721 -9.417 1.00 73.13 H new ATOM 0 HD11 LEU A 22 12.309 -5.377 -7.635 1.00 61.02 H new ATOM 0 HD12 LEU A 22 14.023 -4.910 -7.739 1.00 61.02 H new ATOM 0 HD13 LEU A 22 12.998 -4.250 -6.443 1.00 61.02 H new ATOM 0 HD21 LEU A 22 10.539 -3.768 -8.233 1.00 15.23 H new ATOM 0 HD22 LEU A 22 11.159 -2.576 -7.065 1.00 15.23 H new ATOM 0 HD23 LEU A 22 10.960 -2.126 -8.775 1.00 15.23 H new ATOM 350 N ALA A 23 15.476 0.327 -8.719 1.00 51.32 N ATOM 351 CA ALA A 23 15.982 1.612 -8.253 1.00 53.52 C ATOM 352 C ALA A 23 15.505 2.748 -9.152 1.00 43.51 C ATOM 353 O ALA A 23 14.927 3.726 -8.678 1.00 33.53 O ATOM 354 CB ALA A 23 17.502 1.590 -8.189 1.00 73.40 C ATOM 0 H ALA A 23 16.199 -0.367 -8.909 1.00 51.32 H new ATOM 0 HA ALA A 23 15.590 1.787 -7.251 1.00 53.52 H new ATOM 0 HB1 ALA A 23 17.865 2.556 -7.839 1.00 73.40 H new ATOM 0 HB2 ALA A 23 17.826 0.810 -7.500 1.00 73.40 H new ATOM 0 HB3 ALA A 23 17.905 1.388 -9.181 1.00 73.40 H new ATOM 360 N GLN A 24 15.753 2.613 -10.451 1.00 3.02 N ATOM 361 CA GLN A 24 15.350 3.630 -11.415 1.00 63.10 C ATOM 362 C GLN A 24 13.857 3.919 -11.309 1.00 13.54 C ATOM 363 O GLN A 24 13.422 5.059 -11.476 1.00 21.53 O ATOM 364 CB GLN A 24 15.695 3.180 -12.836 1.00 52.40 C ATOM 365 CG GLN A 24 15.320 1.736 -13.125 1.00 23.43 C ATOM 366 CD GLN A 24 14.483 1.589 -14.380 1.00 41.40 C ATOM 367 OE1 GLN A 24 13.388 1.027 -14.348 1.00 1.11 O ATOM 368 NE2 GLN A 24 14.995 2.096 -15.496 1.00 12.44 N ATOM 0 H GLN A 24 16.231 1.810 -10.860 1.00 3.02 H new ATOM 0 HA GLN A 24 15.895 4.546 -11.189 1.00 63.10 H new ATOM 0 HB2 GLN A 24 15.184 3.829 -13.548 1.00 52.40 H new ATOM 0 HB3 GLN A 24 16.765 3.308 -12.999 1.00 52.40 H new ATOM 0 HG2 GLN A 24 16.229 1.143 -13.228 1.00 23.43 H new ATOM 0 HG3 GLN A 24 14.769 1.331 -12.276 1.00 23.43 H new ATOM 0 HE21 GLN A 24 15.906 2.554 -15.477 1.00 12.44 H new ATOM 0 HE22 GLN A 24 14.477 2.028 -16.372 1.00 12.44 H new ATOM 377 N ALA A 25 13.076 2.881 -11.030 1.00 20.30 N ATOM 378 CA ALA A 25 11.631 3.024 -10.900 1.00 3.13 C ATOM 379 C ALA A 25 11.271 3.875 -9.687 1.00 3.23 C ATOM 380 O ALA A 25 10.176 4.430 -9.608 1.00 60.14 O ATOM 381 CB ALA A 25 10.972 1.656 -10.802 1.00 11.42 C ATOM 0 H ALA A 25 13.420 1.931 -10.890 1.00 20.30 H new ATOM 0 HA ALA A 25 11.259 3.531 -11.790 1.00 3.13 H new ATOM 0 HB1 ALA A 25 9.893 1.778 -10.705 1.00 11.42 H new ATOM 0 HB2 ALA A 25 11.193 1.080 -11.701 1.00 11.42 H new ATOM 0 HB3 ALA A 25 11.357 1.128 -9.929 1.00 11.42 H new ATOM 387 N GLY A 26 12.201 3.973 -8.741 1.00 41.42 N ATOM 388 CA GLY A 26 11.962 4.758 -7.544 1.00 53.11 C ATOM 389 C GLY A 26 11.912 3.905 -6.292 1.00 52.11 C ATOM 390 O GLY A 26 12.296 4.353 -5.212 1.00 0.14 O ATOM 0 H GLY A 26 13.115 3.523 -8.783 1.00 41.42 H new ATOM 0 HA2 GLY A 26 12.749 5.505 -7.440 1.00 53.11 H new ATOM 0 HA3 GLY A 26 11.021 5.299 -7.649 1.00 53.11 H new ATOM 394 N TYR A 27 11.436 2.673 -6.436 1.00 51.32 N ATOM 395 CA TYR A 27 11.333 1.757 -5.307 1.00 20.22 C ATOM 396 C TYR A 27 12.647 1.694 -4.535 1.00 24.12 C ATOM 397 O TYR A 27 13.718 1.935 -5.091 1.00 61.52 O ATOM 398 CB TYR A 27 10.946 0.359 -5.791 1.00 71.44 C ATOM 399 CG TYR A 27 9.743 0.347 -6.707 1.00 72.42 C ATOM 400 CD1 TYR A 27 9.875 0.044 -8.057 1.00 10.33 C ATOM 401 CD2 TYR A 27 8.473 0.637 -6.222 1.00 64.22 C ATOM 402 CE1 TYR A 27 8.779 0.033 -8.897 1.00 14.01 C ATOM 403 CE2 TYR A 27 7.371 0.626 -7.055 1.00 0.52 C ATOM 404 CZ TYR A 27 7.529 0.325 -8.391 1.00 72.53 C ATOM 405 OH TYR A 27 6.434 0.313 -9.225 1.00 31.12 O ATOM 0 H TYR A 27 11.115 2.286 -7.324 1.00 51.32 H new ATOM 0 HA TYR A 27 10.557 2.131 -4.639 1.00 20.22 H new ATOM 0 HB2 TYR A 27 11.794 -0.083 -6.313 1.00 71.44 H new ATOM 0 HB3 TYR A 27 10.740 -0.272 -4.926 1.00 71.44 H new ATOM 0 HD1 TYR A 27 10.852 -0.187 -8.456 1.00 10.33 H new ATOM 0 HD2 TYR A 27 8.346 0.875 -5.176 1.00 64.22 H new ATOM 0 HE1 TYR A 27 8.900 -0.203 -9.944 1.00 14.01 H new ATOM 0 HE2 TYR A 27 6.391 0.852 -6.662 1.00 0.52 H new ATOM 0 HH TYR A 27 5.630 0.539 -8.712 1.00 31.12 H new ATOM 415 N GLU A 28 12.556 1.368 -3.249 1.00 60.12 N ATOM 416 CA GLU A 28 13.738 1.273 -2.400 1.00 54.30 C ATOM 417 C GLU A 28 14.124 -0.184 -2.166 1.00 64.34 C ATOM 418 O GLU A 28 13.568 -0.854 -1.296 1.00 24.01 O ATOM 419 CB GLU A 28 13.486 1.967 -1.059 1.00 64.15 C ATOM 420 CG GLU A 28 14.749 2.192 -0.245 1.00 30.14 C ATOM 421 CD GLU A 28 15.853 2.850 -1.049 1.00 11.30 C ATOM 422 OE1 GLU A 28 15.638 3.980 -1.536 1.00 3.44 O ATOM 423 OE2 GLU A 28 16.931 2.236 -1.192 1.00 54.22 O ATOM 0 H GLU A 28 11.677 1.165 -2.773 1.00 60.12 H new ATOM 0 HA GLU A 28 14.562 1.771 -2.910 1.00 54.30 H new ATOM 0 HB2 GLU A 28 13.005 2.928 -1.241 1.00 64.15 H new ATOM 0 HB3 GLU A 28 12.789 1.367 -0.474 1.00 64.15 H new ATOM 0 HG2 GLU A 28 14.514 2.814 0.619 1.00 30.14 H new ATOM 0 HG3 GLU A 28 15.105 1.236 0.138 1.00 30.14 H new ATOM 430 N VAL A 29 15.081 -0.670 -2.951 1.00 45.51 N ATOM 431 CA VAL A 29 15.544 -2.047 -2.830 1.00 51.04 C ATOM 432 C VAL A 29 16.794 -2.133 -1.963 1.00 4.24 C ATOM 433 O VAL A 29 17.511 -1.147 -1.787 1.00 1.04 O ATOM 434 CB VAL A 29 15.847 -2.660 -4.210 1.00 71.24 C ATOM 435 CG1 VAL A 29 15.927 -4.176 -4.115 1.00 74.24 C ATOM 436 CG2 VAL A 29 14.795 -2.236 -5.224 1.00 41.11 C ATOM 0 H VAL A 29 15.551 -0.130 -3.678 1.00 45.51 H new ATOM 0 HA VAL A 29 14.739 -2.611 -2.358 1.00 51.04 H new ATOM 0 HB VAL A 29 16.815 -2.289 -4.548 1.00 71.24 H new ATOM 0 HG11 VAL A 29 16.142 -4.591 -5.100 1.00 74.24 H new ATOM 0 HG12 VAL A 29 16.721 -4.456 -3.422 1.00 74.24 H new ATOM 0 HG13 VAL A 29 14.976 -4.569 -3.755 1.00 74.24 H new ATOM 0 HG21 VAL A 29 15.025 -2.678 -6.193 1.00 41.11 H new ATOM 0 HG22 VAL A 29 13.813 -2.576 -4.894 1.00 41.11 H new ATOM 0 HG23 VAL A 29 14.792 -1.150 -5.312 1.00 41.11 H new ATOM 446 N THR A 30 17.052 -3.319 -1.421 1.00 61.52 N ATOM 447 CA THR A 30 18.216 -3.535 -0.571 1.00 11.03 C ATOM 448 C THR A 30 18.814 -4.919 -0.797 1.00 51.35 C ATOM 449 O THR A 30 18.214 -5.932 -0.438 1.00 1.11 O ATOM 450 CB THR A 30 17.859 -3.380 0.920 1.00 72.53 C ATOM 451 OG1 THR A 30 17.364 -2.061 1.171 1.00 55.55 O ATOM 452 CG2 THR A 30 19.072 -3.648 1.797 1.00 3.54 C ATOM 0 H THR A 30 16.470 -4.145 -1.556 1.00 61.52 H new ATOM 0 HA THR A 30 18.950 -2.777 -0.843 1.00 11.03 H new ATOM 0 HB THR A 30 17.086 -4.109 1.164 1.00 72.53 H new ATOM 0 HG1 THR A 30 17.138 -1.972 2.120 1.00 55.55 H new ATOM 0 HG21 THR A 30 18.796 -3.533 2.845 1.00 3.54 H new ATOM 0 HG22 THR A 30 19.428 -4.664 1.625 1.00 3.54 H new ATOM 0 HG23 THR A 30 19.863 -2.940 1.550 1.00 3.54 H new ATOM 460 N VAL A 31 20.000 -4.955 -1.396 1.00 4.22 N ATOM 461 CA VAL A 31 20.681 -6.215 -1.669 1.00 11.01 C ATOM 462 C VAL A 31 21.686 -6.546 -0.571 1.00 51.03 C ATOM 463 O VAL A 31 22.400 -5.670 -0.085 1.00 12.35 O ATOM 464 CB VAL A 31 21.412 -6.176 -3.024 1.00 74.12 C ATOM 465 CG1 VAL A 31 20.415 -6.038 -4.165 1.00 13.03 C ATOM 466 CG2 VAL A 31 22.425 -5.042 -3.050 1.00 53.44 C ATOM 0 H VAL A 31 20.509 -4.126 -1.702 1.00 4.22 H new ATOM 0 HA VAL A 31 19.914 -6.989 -1.701 1.00 11.01 H new ATOM 0 HB VAL A 31 21.949 -7.115 -3.155 1.00 74.12 H new ATOM 0 HG11 VAL A 31 20.950 -6.012 -5.114 1.00 13.03 H new ATOM 0 HG12 VAL A 31 19.732 -6.888 -4.156 1.00 13.03 H new ATOM 0 HG13 VAL A 31 19.848 -5.115 -4.043 1.00 13.03 H new ATOM 0 HG21 VAL A 31 22.932 -5.029 -4.015 1.00 53.44 H new ATOM 0 HG22 VAL A 31 21.912 -4.092 -2.897 1.00 53.44 H new ATOM 0 HG23 VAL A 31 23.158 -5.190 -2.257 1.00 53.44 H new ATOM 476 N ALA A 32 21.736 -7.817 -0.187 1.00 23.05 N ATOM 477 CA ALA A 32 22.656 -8.265 0.852 1.00 51.10 C ATOM 478 C ALA A 32 23.801 -9.079 0.258 1.00 14.30 C ATOM 479 O ALA A 32 23.906 -9.222 -0.960 1.00 21.24 O ATOM 480 CB ALA A 32 21.913 -9.082 1.899 1.00 53.43 C ATOM 0 H ALA A 32 21.151 -8.555 -0.579 1.00 23.05 H new ATOM 0 HA ALA A 32 23.082 -7.383 1.330 1.00 51.10 H new ATOM 0 HB1 ALA A 32 22.612 -9.410 2.668 1.00 53.43 H new ATOM 0 HB2 ALA A 32 21.135 -8.469 2.354 1.00 53.43 H new ATOM 0 HB3 ALA A 32 21.459 -9.953 1.426 1.00 53.43 H new ATOM 486 N ALA A 33 24.656 -9.609 1.126 1.00 42.21 N ATOM 487 CA ALA A 33 25.792 -10.409 0.687 1.00 64.24 C ATOM 488 C ALA A 33 25.378 -11.853 0.422 1.00 15.42 C ATOM 489 O ALA A 33 25.889 -12.498 -0.493 1.00 5.12 O ATOM 490 CB ALA A 33 26.905 -10.359 1.723 1.00 62.30 C ATOM 0 H ALA A 33 24.583 -9.499 2.137 1.00 42.21 H new ATOM 0 HA ALA A 33 26.161 -9.987 -0.248 1.00 64.24 H new ATOM 0 HB1 ALA A 33 27.747 -10.961 1.382 1.00 62.30 H new ATOM 0 HB2 ALA A 33 27.229 -9.327 1.860 1.00 62.30 H new ATOM 0 HB3 ALA A 33 26.538 -10.753 2.671 1.00 62.30 H new ATOM 496 N ASP A 34 24.448 -12.353 1.229 1.00 64.32 N ATOM 497 CA ASP A 34 23.965 -13.721 1.081 1.00 35.14 C ATOM 498 C ASP A 34 22.503 -13.829 1.507 1.00 64.45 C ATOM 499 O ASP A 34 21.946 -12.901 2.090 1.00 54.24 O ATOM 500 CB ASP A 34 24.822 -14.680 1.909 1.00 12.01 C ATOM 501 CG ASP A 34 26.127 -15.030 1.222 1.00 41.41 C ATOM 502 OD1 ASP A 34 27.145 -14.366 1.509 1.00 13.43 O ATOM 503 OD2 ASP A 34 26.131 -15.967 0.396 1.00 10.41 O ATOM 0 H ASP A 34 24.014 -11.832 1.991 1.00 64.32 H new ATOM 0 HA ASP A 34 24.041 -13.995 0.029 1.00 35.14 H new ATOM 0 HB2 ASP A 34 25.035 -14.228 2.878 1.00 12.01 H new ATOM 0 HB3 ASP A 34 24.259 -15.593 2.100 1.00 12.01 H new ATOM 508 N GLY A 35 21.889 -14.970 1.209 1.00 74.21 N ATOM 509 CA GLY A 35 20.498 -15.178 1.566 1.00 34.44 C ATOM 510 C GLY A 35 20.271 -15.132 3.064 1.00 32.25 C ATOM 511 O GLY A 35 19.214 -14.703 3.525 1.00 13.41 O ATOM 0 H GLY A 35 22.330 -15.753 0.727 1.00 74.21 H new ATOM 0 HA2 GLY A 35 19.885 -14.416 1.085 1.00 34.44 H new ATOM 0 HA3 GLY A 35 20.168 -16.143 1.181 1.00 34.44 H new ATOM 515 N GLU A 36 21.265 -15.577 3.826 1.00 23.31 N ATOM 516 CA GLU A 36 21.167 -15.587 5.281 1.00 41.20 C ATOM 517 C GLU A 36 21.157 -14.165 5.835 1.00 54.12 C ATOM 518 O GLU A 36 20.359 -13.835 6.712 1.00 54.14 O ATOM 519 CB GLU A 36 22.331 -16.374 5.888 1.00 53.33 C ATOM 520 CG GLU A 36 22.409 -16.274 7.402 1.00 51.11 C ATOM 521 CD GLU A 36 23.460 -17.193 7.993 1.00 3.45 C ATOM 522 OE1 GLU A 36 23.734 -17.076 9.206 1.00 4.04 O ATOM 523 OE2 GLU A 36 24.009 -18.028 7.244 1.00 12.54 O ATOM 0 H GLU A 36 22.147 -15.935 3.460 1.00 23.31 H new ATOM 0 HA GLU A 36 20.229 -16.072 5.553 1.00 41.20 H new ATOM 0 HB2 GLU A 36 22.236 -17.423 5.606 1.00 53.33 H new ATOM 0 HB3 GLU A 36 23.266 -16.012 5.460 1.00 53.33 H new ATOM 0 HG2 GLU A 36 22.632 -15.245 7.684 1.00 51.11 H new ATOM 0 HG3 GLU A 36 21.436 -16.518 7.829 1.00 51.11 H new ATOM 530 N ALA A 37 22.049 -13.328 5.317 1.00 42.24 N ATOM 531 CA ALA A 37 22.142 -11.942 5.757 1.00 4.54 C ATOM 532 C ALA A 37 20.904 -11.151 5.348 1.00 2.03 C ATOM 533 O ALA A 37 20.455 -10.263 6.072 1.00 23.32 O ATOM 534 CB ALA A 37 23.397 -11.291 5.193 1.00 74.35 C ATOM 0 H ALA A 37 22.718 -13.586 4.592 1.00 42.24 H new ATOM 0 HA ALA A 37 22.201 -11.936 6.845 1.00 4.54 H new ATOM 0 HB1 ALA A 37 23.453 -10.256 5.530 1.00 74.35 H new ATOM 0 HB2 ALA A 37 24.276 -11.834 5.540 1.00 74.35 H new ATOM 0 HB3 ALA A 37 23.362 -11.316 4.104 1.00 74.35 H new ATOM 540 N GLY A 38 20.357 -11.479 4.182 1.00 74.21 N ATOM 541 CA GLY A 38 19.176 -10.789 3.697 1.00 73.34 C ATOM 542 C GLY A 38 17.922 -11.186 4.450 1.00 33.11 C ATOM 543 O GLY A 38 17.141 -10.329 4.865 1.00 20.44 O ATOM 0 H GLY A 38 20.710 -12.210 3.565 1.00 74.21 H new ATOM 0 HA2 GLY A 38 19.325 -9.713 3.787 1.00 73.34 H new ATOM 0 HA3 GLY A 38 19.043 -11.004 2.637 1.00 73.34 H new ATOM 547 N PHE A 39 17.726 -12.489 4.626 1.00 2.31 N ATOM 548 CA PHE A 39 16.556 -12.998 5.332 1.00 4.34 C ATOM 549 C PHE A 39 16.576 -12.568 6.796 1.00 35.15 C ATOM 550 O PHE A 39 15.548 -12.185 7.356 1.00 73.13 O ATOM 551 CB PHE A 39 16.501 -14.524 5.238 1.00 41.23 C ATOM 552 CG PHE A 39 15.586 -15.025 4.157 1.00 12.42 C ATOM 553 CD1 PHE A 39 14.238 -14.704 4.169 1.00 31.31 C ATOM 554 CD2 PHE A 39 16.073 -15.816 3.130 1.00 64.13 C ATOM 555 CE1 PHE A 39 13.393 -15.163 3.176 1.00 31.11 C ATOM 556 CE2 PHE A 39 15.233 -16.277 2.134 1.00 64.41 C ATOM 557 CZ PHE A 39 13.891 -15.952 2.158 1.00 44.42 C ATOM 0 H PHE A 39 18.363 -13.211 4.289 1.00 2.31 H new ATOM 0 HA PHE A 39 15.667 -12.580 4.860 1.00 4.34 H new ATOM 0 HB2 PHE A 39 17.506 -14.905 5.058 1.00 41.23 H new ATOM 0 HB3 PHE A 39 16.174 -14.928 6.196 1.00 41.23 H new ATOM 0 HD1 PHE A 39 13.843 -14.088 4.963 1.00 31.31 H new ATOM 0 HD2 PHE A 39 17.121 -16.076 3.107 1.00 64.13 H new ATOM 0 HE1 PHE A 39 12.345 -14.905 3.196 1.00 31.11 H new ATOM 0 HE2 PHE A 39 15.626 -16.891 1.337 1.00 64.41 H new ATOM 0 HZ PHE A 39 13.232 -16.314 1.382 1.00 44.42 H new ATOM 567 N ASP A 40 17.751 -12.635 7.411 1.00 23.40 N ATOM 568 CA ASP A 40 17.906 -12.253 8.810 1.00 71.31 C ATOM 569 C ASP A 40 17.450 -10.815 9.034 1.00 52.11 C ATOM 570 O ASP A 40 16.844 -10.497 10.058 1.00 55.21 O ATOM 571 CB ASP A 40 19.363 -12.413 9.246 1.00 30.34 C ATOM 572 CG ASP A 40 19.662 -11.686 10.543 1.00 63.05 C ATOM 573 OD1 ASP A 40 18.983 -11.969 11.551 1.00 2.34 O ATOM 574 OD2 ASP A 40 20.575 -10.833 10.548 1.00 60.43 O ATOM 0 H ASP A 40 18.611 -12.951 6.963 1.00 23.40 H new ATOM 0 HA ASP A 40 17.280 -12.912 9.412 1.00 71.31 H new ATOM 0 HB2 ASP A 40 19.589 -13.473 9.366 1.00 30.34 H new ATOM 0 HB3 ASP A 40 20.018 -12.034 8.461 1.00 30.34 H new ATOM 579 N LEU A 41 17.746 -9.949 8.071 1.00 61.10 N ATOM 580 CA LEU A 41 17.368 -8.543 8.163 1.00 35.30 C ATOM 581 C LEU A 41 15.928 -8.336 7.704 1.00 13.13 C ATOM 582 O LEU A 41 15.216 -7.480 8.229 1.00 40.34 O ATOM 583 CB LEU A 41 18.312 -7.684 7.320 1.00 30.24 C ATOM 584 CG LEU A 41 19.798 -7.780 7.669 1.00 14.15 C ATOM 585 CD1 LEU A 41 20.649 -7.236 6.533 1.00 61.53 C ATOM 586 CD2 LEU A 41 20.091 -7.033 8.962 1.00 11.23 C ATOM 0 H LEU A 41 18.247 -10.196 7.217 1.00 61.10 H new ATOM 0 HA LEU A 41 17.445 -8.239 9.207 1.00 35.30 H new ATOM 0 HB2 LEU A 41 18.186 -7.961 6.273 1.00 30.24 H new ATOM 0 HB3 LEU A 41 18.004 -6.643 7.413 1.00 30.24 H new ATOM 0 HG LEU A 41 20.051 -8.830 7.814 1.00 14.15 H new ATOM 0 HD11 LEU A 41 21.703 -7.312 6.799 1.00 61.53 H new ATOM 0 HD12 LEU A 41 20.460 -7.814 5.628 1.00 61.53 H new ATOM 0 HD13 LEU A 41 20.394 -6.191 6.356 1.00 61.53 H new ATOM 0 HD21 LEU A 41 21.153 -7.112 9.195 1.00 11.23 H new ATOM 0 HD22 LEU A 41 19.822 -5.983 8.845 1.00 11.23 H new ATOM 0 HD23 LEU A 41 19.508 -7.468 9.774 1.00 11.23 H new ATOM 598 N ALA A 42 15.505 -9.127 6.724 1.00 73.11 N ATOM 599 CA ALA A 42 14.149 -9.033 6.198 1.00 74.23 C ATOM 600 C ALA A 42 13.117 -9.153 7.314 1.00 30.52 C ATOM 601 O ALA A 42 12.003 -8.644 7.200 1.00 54.00 O ATOM 602 CB ALA A 42 13.916 -10.106 5.144 1.00 50.43 C ATOM 0 H ALA A 42 16.082 -9.840 6.278 1.00 73.11 H new ATOM 0 HA ALA A 42 14.033 -8.053 5.735 1.00 74.23 H new ATOM 0 HB1 ALA A 42 12.899 -10.024 4.760 1.00 50.43 H new ATOM 0 HB2 ALA A 42 14.625 -9.973 4.327 1.00 50.43 H new ATOM 0 HB3 ALA A 42 14.057 -11.091 5.590 1.00 50.43 H new ATOM 608 N ALA A 43 13.496 -9.831 8.393 1.00 74.11 N ATOM 609 CA ALA A 43 12.603 -10.017 9.530 1.00 4.05 C ATOM 610 C ALA A 43 12.673 -8.828 10.483 1.00 61.12 C ATOM 611 O ALA A 43 11.707 -8.521 11.182 1.00 53.24 O ATOM 612 CB ALA A 43 12.946 -11.305 10.265 1.00 51.21 C ATOM 0 H ALA A 43 14.415 -10.260 8.503 1.00 74.11 H new ATOM 0 HA ALA A 43 11.583 -10.087 9.152 1.00 4.05 H new ATOM 0 HB1 ALA A 43 12.271 -11.431 11.112 1.00 51.21 H new ATOM 0 HB2 ALA A 43 12.839 -12.151 9.586 1.00 51.21 H new ATOM 0 HB3 ALA A 43 13.974 -11.256 10.624 1.00 51.21 H new ATOM 618 N THR A 44 13.823 -8.161 10.507 1.00 62.51 N ATOM 619 CA THR A 44 14.020 -7.007 11.375 1.00 73.41 C ATOM 620 C THR A 44 13.504 -5.732 10.719 1.00 52.22 C ATOM 621 O THR A 44 13.109 -4.786 11.401 1.00 14.31 O ATOM 622 CB THR A 44 15.506 -6.821 11.734 1.00 31.45 C ATOM 623 OG1 THR A 44 15.632 -6.422 13.104 1.00 44.33 O ATOM 624 CG2 THR A 44 16.154 -5.780 10.835 1.00 40.21 C ATOM 0 H THR A 44 14.632 -8.401 9.935 1.00 62.51 H new ATOM 0 HA THR A 44 13.455 -7.198 12.287 1.00 73.41 H new ATOM 0 HB THR A 44 16.015 -7.773 11.585 1.00 31.45 H new ATOM 0 HG1 THR A 44 16.580 -6.307 13.325 1.00 44.33 H new ATOM 0 HG21 THR A 44 17.203 -5.666 11.108 1.00 40.21 H new ATOM 0 HG22 THR A 44 16.082 -6.101 9.796 1.00 40.21 H new ATOM 0 HG23 THR A 44 15.642 -4.825 10.956 1.00 40.21 H new ATOM 632 N THR A 45 13.509 -5.712 9.389 1.00 1.55 N ATOM 633 CA THR A 45 13.042 -4.552 8.641 1.00 41.41 C ATOM 634 C THR A 45 11.645 -4.787 8.078 1.00 0.51 C ATOM 635 O THR A 45 10.826 -3.870 8.021 1.00 3.43 O ATOM 636 CB THR A 45 13.998 -4.208 7.483 1.00 4.34 C ATOM 637 OG1 THR A 45 15.181 -3.583 7.994 1.00 3.03 O ATOM 638 CG2 THR A 45 13.324 -3.284 6.480 1.00 32.14 C ATOM 0 H THR A 45 13.831 -6.486 8.809 1.00 1.55 H new ATOM 0 HA THR A 45 13.014 -3.716 9.340 1.00 41.41 H new ATOM 0 HB THR A 45 14.266 -5.135 6.976 1.00 4.34 H new ATOM 0 HG1 THR A 45 15.784 -3.369 7.252 1.00 3.03 H new ATOM 0 HG21 THR A 45 14.019 -3.055 5.672 1.00 32.14 H new ATOM 0 HG22 THR A 45 12.440 -3.774 6.071 1.00 32.14 H new ATOM 0 HG23 THR A 45 13.029 -2.360 6.977 1.00 32.14 H new ATOM 646 N ALA A 46 11.379 -6.021 7.664 1.00 50.14 N ATOM 647 CA ALA A 46 10.079 -6.377 7.108 1.00 43.43 C ATOM 648 C ALA A 46 9.815 -5.626 5.807 1.00 54.00 C ATOM 649 O ALA A 46 9.239 -4.538 5.813 1.00 1.51 O ATOM 650 CB ALA A 46 8.977 -6.092 8.117 1.00 5.45 C ATOM 0 H ALA A 46 12.046 -6.791 7.703 1.00 50.14 H new ATOM 0 HA ALA A 46 10.086 -7.444 6.887 1.00 43.43 H new ATOM 0 HB1 ALA A 46 8.012 -6.363 7.688 1.00 5.45 H new ATOM 0 HB2 ALA A 46 9.150 -6.678 9.020 1.00 5.45 H new ATOM 0 HB3 ALA A 46 8.978 -5.031 8.367 1.00 5.45 H new ATOM 656 N TYR A 47 10.238 -6.214 4.694 1.00 45.53 N ATOM 657 CA TYR A 47 10.050 -5.598 3.385 1.00 32.43 C ATOM 658 C TYR A 47 8.730 -6.040 2.761 1.00 15.31 C ATOM 659 O TYR A 47 8.015 -6.873 3.318 1.00 73.33 O ATOM 660 CB TYR A 47 11.211 -5.958 2.457 1.00 21.20 C ATOM 661 CG TYR A 47 12.551 -5.451 2.939 1.00 24.04 C ATOM 662 CD1 TYR A 47 13.213 -6.072 3.992 1.00 41.13 C ATOM 663 CD2 TYR A 47 13.155 -4.351 2.344 1.00 45.22 C ATOM 664 CE1 TYR A 47 14.438 -5.612 4.436 1.00 15.34 C ATOM 665 CE2 TYR A 47 14.380 -3.885 2.781 1.00 42.32 C ATOM 666 CZ TYR A 47 15.017 -4.518 3.827 1.00 21.35 C ATOM 667 OH TYR A 47 16.237 -4.056 4.267 1.00 74.13 O ATOM 0 H TYR A 47 10.713 -7.116 4.671 1.00 45.53 H new ATOM 0 HA TYR A 47 10.024 -4.517 3.520 1.00 32.43 H new ATOM 0 HB2 TYR A 47 11.258 -7.042 2.352 1.00 21.20 H new ATOM 0 HB3 TYR A 47 11.013 -5.550 1.466 1.00 21.20 H new ATOM 0 HD1 TYR A 47 12.762 -6.928 4.471 1.00 41.13 H new ATOM 0 HD2 TYR A 47 12.658 -3.851 1.525 1.00 45.22 H new ATOM 0 HE1 TYR A 47 14.939 -6.106 5.255 1.00 15.34 H new ATOM 0 HE2 TYR A 47 14.836 -3.029 2.306 1.00 42.32 H new ATOM 0 HH TYR A 47 16.505 -3.280 3.732 1.00 74.13 H new ATOM 677 N ASP A 48 8.413 -5.475 1.601 1.00 2.32 N ATOM 678 CA ASP A 48 7.180 -5.810 0.898 1.00 1.15 C ATOM 679 C ASP A 48 7.403 -6.968 -0.069 1.00 25.23 C ATOM 680 O ASP A 48 6.521 -7.804 -0.267 1.00 70.42 O ATOM 681 CB ASP A 48 6.652 -4.591 0.140 1.00 4.25 C ATOM 682 CG ASP A 48 5.897 -3.632 1.040 1.00 71.22 C ATOM 683 OD1 ASP A 48 4.656 -3.561 0.921 1.00 20.21 O ATOM 684 OD2 ASP A 48 6.547 -2.952 1.862 1.00 73.41 O ATOM 0 H ASP A 48 8.993 -4.783 1.127 1.00 2.32 H new ATOM 0 HA ASP A 48 6.441 -6.116 1.638 1.00 1.15 H new ATOM 0 HB2 ASP A 48 7.487 -4.067 -0.326 1.00 4.25 H new ATOM 0 HB3 ASP A 48 5.995 -4.923 -0.664 1.00 4.25 H new ATOM 689 N LEU A 49 8.588 -7.011 -0.669 1.00 12.01 N ATOM 690 CA LEU A 49 8.927 -8.066 -1.617 1.00 25.51 C ATOM 691 C LEU A 49 10.336 -8.594 -1.362 1.00 73.44 C ATOM 692 O LEU A 49 11.295 -7.826 -1.293 1.00 61.01 O ATOM 693 CB LEU A 49 8.817 -7.546 -3.051 1.00 40.10 C ATOM 694 CG LEU A 49 8.130 -8.476 -4.052 1.00 24.23 C ATOM 695 CD1 LEU A 49 8.001 -7.799 -5.407 1.00 74.44 C ATOM 696 CD2 LEU A 49 8.898 -9.784 -4.178 1.00 1.03 C ATOM 0 H LEU A 49 9.330 -6.328 -0.516 1.00 12.01 H new ATOM 0 HA LEU A 49 8.221 -8.885 -1.479 1.00 25.51 H new ATOM 0 HB2 LEU A 49 8.275 -6.601 -3.033 1.00 40.10 H new ATOM 0 HB3 LEU A 49 9.821 -7.330 -3.416 1.00 40.10 H new ATOM 0 HG LEU A 49 7.129 -8.700 -3.684 1.00 24.23 H new ATOM 0 HD11 LEU A 49 7.510 -8.476 -6.106 1.00 74.44 H new ATOM 0 HD12 LEU A 49 7.408 -6.890 -5.305 1.00 74.44 H new ATOM 0 HD13 LEU A 49 8.992 -7.545 -5.783 1.00 74.44 H new ATOM 0 HD21 LEU A 49 8.395 -10.434 -4.894 1.00 1.03 H new ATOM 0 HD22 LEU A 49 9.911 -9.579 -4.523 1.00 1.03 H new ATOM 0 HD23 LEU A 49 8.938 -10.277 -3.207 1.00 1.03 H new ATOM 708 N VAL A 50 10.453 -9.912 -1.226 1.00 52.51 N ATOM 709 CA VAL A 50 11.744 -10.543 -0.983 1.00 22.11 C ATOM 710 C VAL A 50 12.085 -11.539 -2.086 1.00 22.14 C ATOM 711 O VAL A 50 11.227 -12.296 -2.541 1.00 53.33 O ATOM 712 CB VAL A 50 11.767 -11.270 0.375 1.00 52.30 C ATOM 713 CG1 VAL A 50 13.172 -11.756 0.697 1.00 14.24 C ATOM 714 CG2 VAL A 50 11.243 -10.359 1.475 1.00 4.40 C ATOM 0 H VAL A 50 9.669 -10.562 -1.280 1.00 52.51 H new ATOM 0 HA VAL A 50 12.488 -9.747 -0.973 1.00 22.11 H new ATOM 0 HB VAL A 50 11.113 -12.140 0.313 1.00 52.30 H new ATOM 0 HG11 VAL A 50 13.169 -12.267 1.660 1.00 14.24 H new ATOM 0 HG12 VAL A 50 13.505 -12.446 -0.079 1.00 14.24 H new ATOM 0 HG13 VAL A 50 13.851 -10.904 0.741 1.00 14.24 H new ATOM 0 HG21 VAL A 50 11.266 -10.888 2.428 1.00 4.40 H new ATOM 0 HG22 VAL A 50 11.869 -9.469 1.539 1.00 4.40 H new ATOM 0 HG23 VAL A 50 10.218 -10.066 1.247 1.00 4.40 H new ATOM 724 N LEU A 51 13.344 -11.535 -2.511 1.00 12.54 N ATOM 725 CA LEU A 51 13.800 -12.439 -3.561 1.00 10.43 C ATOM 726 C LEU A 51 14.974 -13.285 -3.079 1.00 0.23 C ATOM 727 O LEU A 51 16.078 -12.778 -2.876 1.00 51.44 O ATOM 728 CB LEU A 51 14.205 -11.645 -4.804 1.00 2.21 C ATOM 729 CG LEU A 51 13.112 -10.783 -5.436 1.00 13.33 C ATOM 730 CD1 LEU A 51 11.796 -11.544 -5.489 1.00 42.15 C ATOM 731 CD2 LEU A 51 12.946 -9.482 -4.664 1.00 51.41 C ATOM 0 H LEU A 51 14.067 -10.916 -2.145 1.00 12.54 H new ATOM 0 HA LEU A 51 12.976 -13.106 -3.816 1.00 10.43 H new ATOM 0 HB2 LEU A 51 15.042 -10.999 -4.541 1.00 2.21 H new ATOM 0 HB3 LEU A 51 14.567 -12.346 -5.556 1.00 2.21 H new ATOM 0 HG LEU A 51 13.411 -10.542 -6.456 1.00 13.33 H new ATOM 0 HD11 LEU A 51 11.030 -10.915 -5.942 1.00 42.15 H new ATOM 0 HD12 LEU A 51 11.922 -12.448 -6.085 1.00 42.15 H new ATOM 0 HD13 LEU A 51 11.492 -11.815 -4.478 1.00 42.15 H new ATOM 0 HD21 LEU A 51 12.164 -8.881 -5.128 1.00 51.41 H new ATOM 0 HD22 LEU A 51 12.670 -9.703 -3.633 1.00 51.41 H new ATOM 0 HD23 LEU A 51 13.885 -8.929 -4.677 1.00 51.41 H new ATOM 743 N THR A 52 14.729 -14.579 -2.898 1.00 64.00 N ATOM 744 CA THR A 52 15.766 -15.496 -2.441 1.00 72.21 C ATOM 745 C THR A 52 16.139 -16.492 -3.533 1.00 43.12 C ATOM 746 O THR A 52 15.278 -16.970 -4.272 1.00 0.32 O ATOM 747 CB THR A 52 15.318 -16.271 -1.187 1.00 55.24 C ATOM 748 OG1 THR A 52 16.294 -17.262 -0.848 1.00 42.45 O ATOM 749 CG2 THR A 52 13.970 -16.938 -1.417 1.00 14.45 C ATOM 0 H THR A 52 13.822 -15.016 -3.061 1.00 64.00 H new ATOM 0 HA THR A 52 16.637 -14.890 -2.193 1.00 72.21 H new ATOM 0 HB THR A 52 15.220 -15.562 -0.365 1.00 55.24 H new ATOM 0 HG1 THR A 52 15.852 -18.021 -0.413 1.00 42.45 H new ATOM 0 HG21 THR A 52 13.674 -17.479 -0.518 1.00 14.45 H new ATOM 0 HG22 THR A 52 13.223 -16.178 -1.646 1.00 14.45 H new ATOM 0 HG23 THR A 52 14.047 -17.635 -2.252 1.00 14.45 H new ATOM 757 N ASP A 53 17.428 -16.801 -3.630 1.00 34.23 N ATOM 758 CA ASP A 53 17.915 -17.742 -4.631 1.00 60.43 C ATOM 759 C ASP A 53 18.421 -19.022 -3.973 1.00 71.55 C ATOM 760 O ASP A 53 18.260 -20.115 -4.516 1.00 72.21 O ATOM 761 CB ASP A 53 19.031 -17.105 -5.461 1.00 31.14 C ATOM 762 CG ASP A 53 20.301 -16.896 -4.659 1.00 72.22 C ATOM 763 OD1 ASP A 53 20.261 -16.130 -3.674 1.00 73.10 O ATOM 764 OD2 ASP A 53 21.335 -17.498 -5.018 1.00 31.13 O ATOM 0 H ASP A 53 18.154 -16.413 -3.027 1.00 34.23 H new ATOM 0 HA ASP A 53 17.084 -17.997 -5.289 1.00 60.43 H new ATOM 0 HB2 ASP A 53 19.248 -17.739 -6.321 1.00 31.14 H new ATOM 0 HB3 ASP A 53 18.688 -16.146 -5.850 1.00 31.14 H new ATOM 769 N GLN A 54 19.033 -18.878 -2.803 1.00 4.02 N ATOM 770 CA GLN A 54 19.564 -20.023 -2.073 1.00 3.04 C ATOM 771 C GLN A 54 18.505 -21.109 -1.919 1.00 61.51 C ATOM 772 O GLN A 54 17.315 -20.860 -2.104 1.00 12.34 O ATOM 773 CB GLN A 54 20.068 -19.587 -0.696 1.00 23.34 C ATOM 774 CG GLN A 54 21.144 -20.498 -0.125 1.00 50.44 C ATOM 775 CD GLN A 54 22.317 -20.677 -1.069 1.00 31.11 C ATOM 776 OE1 GLN A 54 22.529 -19.870 -1.974 1.00 64.13 O ATOM 777 NE2 GLN A 54 23.087 -21.739 -0.862 1.00 34.15 N ATOM 0 H GLN A 54 19.174 -17.980 -2.340 1.00 4.02 H new ATOM 0 HA GLN A 54 20.397 -20.432 -2.645 1.00 3.04 H new ATOM 0 HB2 GLN A 54 20.462 -18.573 -0.767 1.00 23.34 H new ATOM 0 HB3 GLN A 54 19.227 -19.554 -0.004 1.00 23.34 H new ATOM 0 HG2 GLN A 54 21.501 -20.085 0.818 1.00 50.44 H new ATOM 0 HG3 GLN A 54 20.709 -21.473 0.098 1.00 50.44 H new ATOM 0 HE21 GLN A 54 22.874 -22.382 -0.100 1.00 34.15 H new ATOM 0 HE22 GLN A 54 23.891 -21.911 -1.465 1.00 34.15 H new ATOM 786 N ASN A 55 18.947 -22.316 -1.581 1.00 22.43 N ATOM 787 CA ASN A 55 18.037 -23.442 -1.403 1.00 52.24 C ATOM 788 C ASN A 55 18.579 -24.423 -0.368 1.00 44.35 C ATOM 789 O ASN A 55 19.690 -24.258 0.135 1.00 64.14 O ATOM 790 CB ASN A 55 17.815 -24.160 -2.736 1.00 71.01 C ATOM 791 CG ASN A 55 19.118 -24.527 -3.419 1.00 42.11 C ATOM 792 OD1 ASN A 55 19.607 -25.649 -3.287 1.00 72.10 O ATOM 793 ND2 ASN A 55 19.688 -23.579 -4.154 1.00 40.02 N ATOM 0 H ASN A 55 19.930 -22.540 -1.425 1.00 22.43 H new ATOM 0 HA ASN A 55 17.084 -23.053 -1.044 1.00 52.24 H new ATOM 0 HB2 ASN A 55 17.230 -25.064 -2.566 1.00 71.01 H new ATOM 0 HB3 ASN A 55 17.229 -23.521 -3.397 1.00 71.01 H new ATOM 0 HD21 ASN A 55 20.566 -23.767 -4.637 1.00 40.02 H new ATOM 0 HD22 ASN A 55 19.247 -22.663 -4.236 1.00 40.02 H new ATOM 800 N MET A 56 17.787 -25.443 -0.056 1.00 64.22 N ATOM 801 CA MET A 56 18.189 -26.452 0.917 1.00 3.24 C ATOM 802 C MET A 56 18.534 -25.808 2.257 1.00 53.14 C ATOM 803 O MET A 56 19.699 -25.701 2.640 1.00 51.44 O ATOM 804 CB MET A 56 19.389 -27.245 0.396 1.00 21.12 C ATOM 805 CG MET A 56 19.001 -28.471 -0.415 1.00 2.12 C ATOM 806 SD MET A 56 20.202 -28.860 -1.702 1.00 72.25 S ATOM 807 CE MET A 56 20.826 -30.434 -1.119 1.00 20.33 C ATOM 0 H MET A 56 16.864 -25.593 -0.462 1.00 64.22 H new ATOM 0 HA MET A 56 17.350 -27.132 1.065 1.00 3.24 H new ATOM 0 HB2 MET A 56 20.006 -26.592 -0.221 1.00 21.12 H new ATOM 0 HB3 MET A 56 20.002 -27.558 1.241 1.00 21.12 H new ATOM 0 HG2 MET A 56 18.900 -29.327 0.253 1.00 2.12 H new ATOM 0 HG3 MET A 56 18.025 -28.306 -0.872 1.00 2.12 H new ATOM 0 HE1 MET A 56 21.581 -30.805 -1.812 1.00 20.33 H new ATOM 0 HE2 MET A 56 21.271 -30.306 -0.132 1.00 20.33 H new ATOM 0 HE3 MET A 56 20.006 -31.150 -1.057 1.00 20.33 H new ATOM 817 N PRO A 57 17.498 -25.368 2.987 1.00 70.23 N ATOM 818 CA PRO A 57 17.667 -24.728 4.294 1.00 14.54 C ATOM 819 C PRO A 57 18.131 -25.709 5.365 1.00 1.21 C ATOM 820 O PRO A 57 17.321 -26.411 5.970 1.00 20.21 O ATOM 821 CB PRO A 57 16.264 -24.207 4.618 1.00 33.51 C ATOM 822 CG PRO A 57 15.345 -25.093 3.849 1.00 52.51 C ATOM 823 CD PRO A 57 16.082 -25.463 2.592 1.00 25.11 C ATOM 0 HA PRO A 57 18.431 -23.951 4.271 1.00 14.54 H new ATOM 0 HB2 PRO A 57 16.060 -24.257 5.688 1.00 33.51 H new ATOM 0 HB3 PRO A 57 16.150 -23.165 4.321 1.00 33.51 H new ATOM 0 HG2 PRO A 57 15.086 -25.981 4.425 1.00 52.51 H new ATOM 0 HG3 PRO A 57 14.411 -24.580 3.617 1.00 52.51 H new ATOM 0 HD2 PRO A 57 15.825 -26.468 2.256 1.00 25.11 H new ATOM 0 HD3 PRO A 57 15.847 -24.783 1.773 1.00 25.11 H new ATOM 831 N ARG A 58 19.439 -25.752 5.594 1.00 5.44 N ATOM 832 CA ARG A 58 20.011 -26.648 6.592 1.00 4.21 C ATOM 833 C ARG A 58 20.418 -25.878 7.845 1.00 11.21 C ATOM 834 O ARG A 58 20.292 -26.378 8.963 1.00 63.40 O ATOM 835 CB ARG A 58 21.224 -27.381 6.015 1.00 11.40 C ATOM 836 CG ARG A 58 22.382 -26.460 5.666 1.00 62.42 C ATOM 837 CD ARG A 58 23.547 -27.234 5.069 1.00 45.34 C ATOM 838 NE ARG A 58 24.775 -26.443 5.047 1.00 23.21 N ATOM 839 CZ ARG A 58 24.971 -25.412 4.233 1.00 1.22 C ATOM 840 NH1 ARG A 58 24.024 -25.048 3.379 1.00 5.12 N ATOM 841 NH2 ARG A 58 26.116 -24.742 4.273 1.00 13.30 N ATOM 0 H ARG A 58 20.123 -25.177 5.102 1.00 5.44 H new ATOM 0 HA ARG A 58 19.250 -27.378 6.866 1.00 4.21 H new ATOM 0 HB2 ARG A 58 21.566 -28.124 6.736 1.00 11.40 H new ATOM 0 HB3 ARG A 58 20.919 -27.923 5.120 1.00 11.40 H new ATOM 0 HG2 ARG A 58 22.046 -25.703 4.958 1.00 62.42 H new ATOM 0 HG3 ARG A 58 22.713 -25.934 6.562 1.00 62.42 H new ATOM 0 HD2 ARG A 58 23.712 -28.144 5.646 1.00 45.34 H new ATOM 0 HD3 ARG A 58 23.296 -27.542 4.054 1.00 45.34 H new ATOM 0 HE ARG A 58 25.523 -26.696 5.692 1.00 23.21 H new ATOM 0 HH11 ARG A 58 23.143 -25.560 3.346 1.00 5.12 H new ATOM 0 HH12 ARG A 58 24.177 -24.256 2.755 1.00 5.12 H new ATOM 0 HH21 ARG A 58 26.846 -25.019 4.929 1.00 13.30 H new ATOM 0 HH22 ARG A 58 26.266 -23.950 3.648 1.00 13.30 H new ATOM 855 N LYS A 59 20.906 -24.657 7.651 1.00 62.40 N ATOM 856 CA LYS A 59 21.331 -23.817 8.764 1.00 50.30 C ATOM 857 C LYS A 59 20.564 -22.498 8.774 1.00 70.34 C ATOM 858 O LYS A 59 19.595 -22.327 8.033 1.00 24.44 O ATOM 859 CB LYS A 59 22.834 -23.544 8.679 1.00 4.30 C ATOM 860 CG LYS A 59 23.558 -23.706 10.005 1.00 71.04 C ATOM 861 CD LYS A 59 25.025 -24.046 9.801 1.00 32.52 C ATOM 862 CE LYS A 59 25.233 -25.546 9.652 1.00 45.31 C ATOM 863 NZ LYS A 59 24.851 -26.285 10.887 1.00 51.32 N ATOM 0 H LYS A 59 21.017 -24.227 6.733 1.00 62.40 H new ATOM 0 HA LYS A 59 21.116 -24.349 9.691 1.00 50.30 H new ATOM 0 HB2 LYS A 59 23.277 -24.220 7.948 1.00 4.30 H new ATOM 0 HB3 LYS A 59 22.990 -22.530 8.311 1.00 4.30 H new ATOM 0 HG2 LYS A 59 23.474 -22.785 10.582 1.00 71.04 H new ATOM 0 HG3 LYS A 59 23.079 -24.492 10.589 1.00 71.04 H new ATOM 0 HD2 LYS A 59 25.398 -23.536 8.913 1.00 32.52 H new ATOM 0 HD3 LYS A 59 25.606 -23.679 10.647 1.00 32.52 H new ATOM 0 HE2 LYS A 59 24.643 -25.913 8.812 1.00 45.31 H new ATOM 0 HE3 LYS A 59 26.279 -25.746 9.418 1.00 45.31 H new ATOM 0 HZ1 LYS A 59 25.384 -27.177 10.937 1.00 51.32 H new ATOM 0 HZ2 LYS A 59 25.070 -25.704 11.721 1.00 51.32 H new ATOM 0 HZ3 LYS A 59 23.832 -26.491 10.867 1.00 51.32 H new ATOM 877 N SER A 60 21.004 -21.569 9.615 1.00 4.35 N ATOM 878 CA SER A 60 20.358 -20.266 9.723 1.00 75.34 C ATOM 879 C SER A 60 20.216 -19.615 8.350 1.00 25.20 C ATOM 880 O SER A 60 20.925 -19.967 7.408 1.00 41.11 O ATOM 881 CB SER A 60 21.156 -19.352 10.654 1.00 51.23 C ATOM 882 OG SER A 60 22.483 -19.183 10.187 1.00 3.35 O ATOM 0 H SER A 60 21.806 -21.694 10.233 1.00 4.35 H new ATOM 0 HA SER A 60 19.362 -20.415 10.140 1.00 75.34 H new ATOM 0 HB2 SER A 60 20.665 -18.381 10.724 1.00 51.23 H new ATOM 0 HB3 SER A 60 21.172 -19.775 11.659 1.00 51.23 H new ATOM 0 HG SER A 60 22.701 -18.228 10.161 1.00 3.35 H new ATOM 888 N GLY A 61 19.295 -18.663 8.246 1.00 54.44 N ATOM 889 CA GLY A 61 19.076 -17.977 6.985 1.00 0.14 C ATOM 890 C GLY A 61 17.724 -18.295 6.379 1.00 15.13 C ATOM 891 O GLY A 61 16.691 -17.838 6.872 1.00 41.55 O ATOM 0 H GLY A 61 18.696 -18.354 9.012 1.00 54.44 H new ATOM 0 HA2 GLY A 61 19.157 -16.901 7.141 1.00 0.14 H new ATOM 0 HA3 GLY A 61 19.861 -18.257 6.282 1.00 0.14 H new ATOM 895 N LEU A 62 17.727 -19.079 5.307 1.00 23.43 N ATOM 896 CA LEU A 62 16.491 -19.457 4.631 1.00 31.24 C ATOM 897 C LEU A 62 15.481 -20.026 5.622 1.00 34.33 C ATOM 898 O LEU A 62 14.276 -19.819 5.482 1.00 32.22 O ATOM 899 CB LEU A 62 16.779 -20.483 3.534 1.00 44.11 C ATOM 900 CG LEU A 62 16.937 -19.925 2.119 1.00 73.43 C ATOM 901 CD1 LEU A 62 17.915 -18.761 2.109 1.00 24.53 C ATOM 902 CD2 LEU A 62 17.395 -21.018 1.163 1.00 12.42 C ATOM 0 H LEU A 62 18.572 -19.466 4.887 1.00 23.43 H new ATOM 0 HA LEU A 62 16.065 -18.561 4.179 1.00 31.24 H new ATOM 0 HB2 LEU A 62 17.691 -21.019 3.796 1.00 44.11 H new ATOM 0 HB3 LEU A 62 15.971 -21.214 3.527 1.00 44.11 H new ATOM 0 HG LEU A 62 15.967 -19.559 1.783 1.00 73.43 H new ATOM 0 HD11 LEU A 62 18.014 -18.378 1.093 1.00 24.53 H new ATOM 0 HD12 LEU A 62 17.545 -17.970 2.761 1.00 24.53 H new ATOM 0 HD13 LEU A 62 18.888 -19.100 2.465 1.00 24.53 H new ATOM 0 HD21 LEU A 62 17.502 -20.603 0.161 1.00 12.42 H new ATOM 0 HD22 LEU A 62 18.354 -21.414 1.496 1.00 12.42 H new ATOM 0 HD23 LEU A 62 16.657 -21.820 1.147 1.00 12.42 H new ATOM 914 N GLU A 63 15.981 -20.742 6.624 1.00 30.44 N ATOM 915 CA GLU A 63 15.121 -21.340 7.639 1.00 2.23 C ATOM 916 C GLU A 63 14.172 -20.300 8.229 1.00 23.30 C ATOM 917 O GLU A 63 13.056 -20.623 8.637 1.00 12.14 O ATOM 918 CB GLU A 63 15.966 -21.965 8.752 1.00 51.53 C ATOM 919 CG GLU A 63 15.272 -23.107 9.474 1.00 20.02 C ATOM 920 CD GLU A 63 15.940 -23.457 10.790 1.00 64.15 C ATOM 921 OE1 GLU A 63 16.505 -22.544 11.429 1.00 72.52 O ATOM 922 OE2 GLU A 63 15.900 -24.643 11.179 1.00 13.54 O ATOM 0 H GLU A 63 16.976 -20.922 6.755 1.00 30.44 H new ATOM 0 HA GLU A 63 14.527 -22.120 7.162 1.00 2.23 H new ATOM 0 HB2 GLU A 63 16.900 -22.330 8.326 1.00 51.53 H new ATOM 0 HB3 GLU A 63 16.226 -21.193 9.476 1.00 51.53 H new ATOM 0 HG2 GLU A 63 14.232 -22.836 9.659 1.00 20.02 H new ATOM 0 HG3 GLU A 63 15.263 -23.987 8.830 1.00 20.02 H new ATOM 929 N LEU A 64 14.624 -19.052 8.271 1.00 43.11 N ATOM 930 CA LEU A 64 13.817 -17.964 8.811 1.00 51.50 C ATOM 931 C LEU A 64 12.426 -17.955 8.186 1.00 74.43 C ATOM 932 O LEU A 64 11.441 -17.616 8.843 1.00 42.33 O ATOM 933 CB LEU A 64 14.506 -16.620 8.566 1.00 65.32 C ATOM 934 CG LEU A 64 15.728 -16.324 9.437 1.00 53.11 C ATOM 935 CD1 LEU A 64 16.653 -15.338 8.741 1.00 11.42 C ATOM 936 CD2 LEU A 64 15.297 -15.788 10.794 1.00 0.43 C ATOM 0 H LEU A 64 15.545 -18.768 7.938 1.00 43.11 H new ATOM 0 HA LEU A 64 13.712 -18.122 9.884 1.00 51.50 H new ATOM 0 HB2 LEU A 64 14.811 -16.576 7.520 1.00 65.32 H new ATOM 0 HB3 LEU A 64 13.775 -15.826 8.719 1.00 65.32 H new ATOM 0 HG LEU A 64 16.274 -17.254 9.593 1.00 53.11 H new ATOM 0 HD11 LEU A 64 17.517 -15.139 9.375 1.00 11.42 H new ATOM 0 HD12 LEU A 64 16.988 -15.760 7.794 1.00 11.42 H new ATOM 0 HD13 LEU A 64 16.118 -14.407 8.554 1.00 11.42 H new ATOM 0 HD21 LEU A 64 16.179 -15.583 11.401 1.00 0.43 H new ATOM 0 HD22 LEU A 64 14.728 -14.868 10.658 1.00 0.43 H new ATOM 0 HD23 LEU A 64 14.675 -16.528 11.297 1.00 0.43 H new ATOM 948 N ILE A 65 12.352 -18.333 6.914 1.00 20.50 N ATOM 949 CA ILE A 65 11.081 -18.373 6.202 1.00 40.24 C ATOM 950 C ILE A 65 10.027 -19.132 7.000 1.00 14.20 C ATOM 951 O ILE A 65 8.866 -18.727 7.057 1.00 71.13 O ATOM 952 CB ILE A 65 11.232 -19.030 4.817 1.00 72.00 C ATOM 953 CG1 ILE A 65 12.246 -18.259 3.970 1.00 3.10 C ATOM 954 CG2 ILE A 65 9.885 -19.095 4.112 1.00 43.42 C ATOM 955 CD1 ILE A 65 12.687 -19.003 2.729 1.00 55.45 C ATOM 0 H ILE A 65 13.157 -18.616 6.356 1.00 20.50 H new ATOM 0 HA ILE A 65 10.760 -17.340 6.072 1.00 40.24 H new ATOM 0 HB ILE A 65 11.599 -20.047 4.952 1.00 72.00 H new ATOM 0 HG12 ILE A 65 11.810 -17.304 3.676 1.00 3.10 H new ATOM 0 HG13 ILE A 65 13.121 -18.035 4.580 1.00 3.10 H new ATOM 0 HG21 ILE A 65 10.008 -19.562 3.135 1.00 43.42 H new ATOM 0 HG22 ILE A 65 9.189 -19.683 4.710 1.00 43.42 H new ATOM 0 HG23 ILE A 65 9.492 -18.086 3.985 1.00 43.42 H new ATOM 0 HD11 ILE A 65 13.405 -18.397 2.177 1.00 55.45 H new ATOM 0 HD12 ILE A 65 13.153 -19.946 3.016 1.00 55.45 H new ATOM 0 HD13 ILE A 65 11.821 -19.203 2.098 1.00 55.45 H new ATOM 967 N ALA A 66 10.440 -20.234 7.617 1.00 35.02 N ATOM 968 CA ALA A 66 9.532 -21.048 8.416 1.00 13.11 C ATOM 969 C ALA A 66 9.012 -20.270 9.620 1.00 3.33 C ATOM 970 O ALA A 66 7.862 -20.432 10.027 1.00 24.32 O ATOM 971 CB ALA A 66 10.227 -22.323 8.869 1.00 34.42 C ATOM 0 H ALA A 66 11.397 -20.584 7.579 1.00 35.02 H new ATOM 0 HA ALA A 66 8.678 -21.314 7.793 1.00 13.11 H new ATOM 0 HB1 ALA A 66 9.538 -22.921 9.465 1.00 34.42 H new ATOM 0 HB2 ALA A 66 10.543 -22.895 7.996 1.00 34.42 H new ATOM 0 HB3 ALA A 66 11.099 -22.068 9.471 1.00 34.42 H new ATOM 977 N ALA A 67 9.868 -19.425 10.187 1.00 54.34 N ATOM 978 CA ALA A 67 9.494 -18.621 11.344 1.00 40.45 C ATOM 979 C ALA A 67 8.631 -17.433 10.931 1.00 10.01 C ATOM 980 O ALA A 67 7.748 -17.005 11.676 1.00 24.13 O ATOM 981 CB ALA A 67 10.738 -18.142 12.077 1.00 10.13 C ATOM 0 H ALA A 67 10.824 -19.280 9.864 1.00 54.34 H new ATOM 0 HA ALA A 67 8.907 -19.247 12.016 1.00 40.45 H new ATOM 0 HB1 ALA A 67 10.444 -17.543 12.939 1.00 10.13 H new ATOM 0 HB2 ALA A 67 11.316 -19.003 12.413 1.00 10.13 H new ATOM 0 HB3 ALA A 67 11.346 -17.537 11.405 1.00 10.13 H new ATOM 987 N LEU A 68 8.891 -16.904 9.741 1.00 41.33 N ATOM 988 CA LEU A 68 8.138 -15.764 9.229 1.00 10.00 C ATOM 989 C LEU A 68 6.774 -16.203 8.707 1.00 53.10 C ATOM 990 O LEU A 68 5.792 -15.466 8.810 1.00 65.44 O ATOM 991 CB LEU A 68 8.923 -15.067 8.116 1.00 74.30 C ATOM 992 CG LEU A 68 9.946 -14.024 8.567 1.00 34.35 C ATOM 993 CD1 LEU A 68 11.071 -14.684 9.350 1.00 53.12 C ATOM 994 CD2 LEU A 68 10.499 -13.267 7.369 1.00 3.24 C ATOM 0 H LEU A 68 9.618 -17.246 9.112 1.00 41.33 H new ATOM 0 HA LEU A 68 7.984 -15.063 10.050 1.00 10.00 H new ATOM 0 HB2 LEU A 68 9.443 -15.828 7.534 1.00 74.30 H new ATOM 0 HB3 LEU A 68 8.212 -14.583 7.446 1.00 74.30 H new ATOM 0 HG LEU A 68 9.445 -13.311 9.222 1.00 34.35 H new ATOM 0 HD11 LEU A 68 11.790 -13.927 9.663 1.00 53.12 H new ATOM 0 HD12 LEU A 68 10.660 -15.180 10.230 1.00 53.12 H new ATOM 0 HD13 LEU A 68 11.570 -15.419 8.719 1.00 53.12 H new ATOM 0 HD21 LEU A 68 11.226 -12.529 7.709 1.00 3.24 H new ATOM 0 HD22 LEU A 68 10.984 -13.967 6.689 1.00 3.24 H new ATOM 0 HD23 LEU A 68 9.684 -12.762 6.850 1.00 3.24 H new ATOM 1006 N ARG A 69 6.719 -17.408 8.149 1.00 41.21 N ATOM 1007 CA ARG A 69 5.475 -17.945 7.612 1.00 72.41 C ATOM 1008 C ARG A 69 4.429 -18.100 8.713 1.00 44.34 C ATOM 1009 O ARG A 69 3.301 -17.626 8.580 1.00 23.02 O ATOM 1010 CB ARG A 69 5.726 -19.296 6.940 1.00 62.35 C ATOM 1011 CG ARG A 69 4.526 -19.828 6.174 1.00 32.40 C ATOM 1012 CD ARG A 69 4.401 -21.338 6.313 1.00 15.53 C ATOM 1013 NE ARG A 69 3.009 -21.778 6.268 1.00 12.32 N ATOM 1014 CZ ARG A 69 2.282 -21.805 5.156 1.00 23.04 C ATOM 1015 NH1 ARG A 69 2.813 -21.420 4.004 1.00 22.10 N ATOM 1016 NH2 ARG A 69 1.022 -22.219 5.196 1.00 41.42 N ATOM 0 H ARG A 69 7.522 -18.031 8.057 1.00 41.21 H new ATOM 0 HA ARG A 69 5.096 -17.242 6.870 1.00 72.41 H new ATOM 0 HB2 ARG A 69 6.570 -19.201 6.256 1.00 62.35 H new ATOM 0 HB3 ARG A 69 6.012 -20.023 7.700 1.00 62.35 H new ATOM 0 HG2 ARG A 69 3.618 -19.351 6.542 1.00 32.40 H new ATOM 0 HG3 ARG A 69 4.620 -19.565 5.120 1.00 32.40 H new ATOM 0 HD2 ARG A 69 4.961 -21.823 5.513 1.00 15.53 H new ATOM 0 HD3 ARG A 69 4.851 -21.654 7.254 1.00 15.53 H new ATOM 0 HE ARG A 69 2.571 -22.081 7.138 1.00 12.32 H new ATOM 0 HH11 ARG A 69 3.782 -21.102 3.970 1.00 22.10 H new ATOM 0 HH12 ARG A 69 2.253 -21.442 3.152 1.00 22.10 H new ATOM 0 HH21 ARG A 69 0.611 -22.517 6.081 1.00 41.42 H new ATOM 0 HH22 ARG A 69 0.465 -22.239 4.342 1.00 41.42 H new ATOM 1030 N GLN A 70 4.813 -18.765 9.797 1.00 61.50 N ATOM 1031 CA GLN A 70 3.908 -18.983 10.919 1.00 1.14 C ATOM 1032 C GLN A 70 3.362 -17.659 11.443 1.00 43.50 C ATOM 1033 O GLN A 70 2.213 -17.578 11.879 1.00 3.45 O ATOM 1034 CB GLN A 70 4.626 -19.732 12.043 1.00 23.11 C ATOM 1035 CG GLN A 70 5.874 -19.024 12.545 1.00 24.54 C ATOM 1036 CD GLN A 70 6.495 -19.716 13.743 1.00 1.23 C ATOM 1037 OE1 GLN A 70 6.228 -19.356 14.890 1.00 14.40 O ATOM 1038 NE2 GLN A 70 7.329 -20.716 13.484 1.00 45.44 N ATOM 0 H GLN A 70 5.744 -19.162 9.922 1.00 61.50 H new ATOM 0 HA GLN A 70 3.072 -19.586 10.566 1.00 1.14 H new ATOM 0 HB2 GLN A 70 3.936 -19.869 12.876 1.00 23.11 H new ATOM 0 HB3 GLN A 70 4.900 -20.726 11.689 1.00 23.11 H new ATOM 0 HG2 GLN A 70 6.607 -18.972 11.740 1.00 24.54 H new ATOM 0 HG3 GLN A 70 5.622 -17.998 12.813 1.00 24.54 H new ATOM 0 HE21 GLN A 70 7.522 -20.982 12.518 1.00 45.44 H new ATOM 0 HE22 GLN A 70 7.776 -21.219 14.251 1.00 45.44 H new ATOM 1047 N LEU A 71 4.193 -16.623 11.397 1.00 13.31 N ATOM 1048 CA LEU A 71 3.794 -15.301 11.867 1.00 14.34 C ATOM 1049 C LEU A 71 2.786 -14.665 10.915 1.00 43.05 C ATOM 1050 O LEU A 71 2.771 -14.966 9.721 1.00 53.41 O ATOM 1051 CB LEU A 71 5.019 -14.397 12.009 1.00 3.34 C ATOM 1052 CG LEU A 71 5.581 -14.244 13.423 1.00 31.44 C ATOM 1053 CD1 LEU A 71 5.829 -15.608 14.049 1.00 65.23 C ATOM 1054 CD2 LEU A 71 6.862 -13.423 13.403 1.00 60.50 C ATOM 0 H LEU A 71 5.147 -16.673 11.039 1.00 13.31 H new ATOM 0 HA LEU A 71 3.321 -15.417 12.842 1.00 14.34 H new ATOM 0 HB2 LEU A 71 5.809 -14.786 11.366 1.00 3.34 H new ATOM 0 HB3 LEU A 71 4.760 -13.407 11.633 1.00 3.34 H new ATOM 0 HG LEU A 71 4.845 -13.716 14.030 1.00 31.44 H new ATOM 0 HD11 LEU A 71 6.229 -15.479 15.055 1.00 65.23 H new ATOM 0 HD12 LEU A 71 4.891 -16.161 14.099 1.00 65.23 H new ATOM 0 HD13 LEU A 71 6.545 -16.162 13.442 1.00 65.23 H new ATOM 0 HD21 LEU A 71 7.247 -13.325 14.418 1.00 60.50 H new ATOM 0 HD22 LEU A 71 7.604 -13.922 12.780 1.00 60.50 H new ATOM 0 HD23 LEU A 71 6.654 -12.433 12.997 1.00 60.50 H new ATOM 1066 N SER A 72 1.948 -13.783 11.450 1.00 61.22 N ATOM 1067 CA SER A 72 0.936 -13.106 10.647 1.00 3.34 C ATOM 1068 C SER A 72 1.441 -11.747 10.172 1.00 54.43 C ATOM 1069 O SER A 72 0.677 -10.786 10.081 1.00 31.00 O ATOM 1070 CB SER A 72 -0.352 -12.931 11.454 1.00 3.42 C ATOM 1071 OG SER A 72 -1.386 -12.388 10.652 1.00 73.51 O ATOM 0 H SER A 72 1.950 -13.520 12.436 1.00 61.22 H new ATOM 0 HA SER A 72 0.727 -13.723 9.773 1.00 3.34 H new ATOM 0 HB2 SER A 72 -0.667 -13.894 11.856 1.00 3.42 H new ATOM 0 HB3 SER A 72 -0.166 -12.276 12.305 1.00 3.42 H new ATOM 0 HG SER A 72 -1.082 -11.547 10.252 1.00 73.51 H new ATOM 1077 N ALA A 73 2.733 -11.675 9.869 1.00 12.24 N ATOM 1078 CA ALA A 73 3.340 -10.435 9.401 1.00 30.21 C ATOM 1079 C ALA A 73 3.980 -10.621 8.030 1.00 62.33 C ATOM 1080 O ALA A 73 4.013 -9.696 7.218 1.00 14.23 O ATOM 1081 CB ALA A 73 4.371 -9.941 10.405 1.00 44.25 C ATOM 0 H ALA A 73 3.379 -12.461 9.939 1.00 12.24 H new ATOM 0 HA ALA A 73 2.553 -9.686 9.307 1.00 30.21 H new ATOM 0 HB1 ALA A 73 4.816 -9.014 10.043 1.00 44.25 H new ATOM 0 HB2 ALA A 73 3.887 -9.760 11.365 1.00 44.25 H new ATOM 0 HB3 ALA A 73 5.149 -10.694 10.528 1.00 44.25 H new ATOM 1087 N TYR A 74 4.489 -11.822 7.778 1.00 72.24 N ATOM 1088 CA TYR A 74 5.131 -12.128 6.505 1.00 23.30 C ATOM 1089 C TYR A 74 4.300 -13.124 5.701 1.00 45.31 C ATOM 1090 O TYR A 74 4.373 -13.161 4.473 1.00 2.20 O ATOM 1091 CB TYR A 74 6.534 -12.691 6.740 1.00 2.43 C ATOM 1092 CG TYR A 74 7.332 -11.918 7.767 1.00 73.51 C ATOM 1093 CD1 TYR A 74 7.145 -12.136 9.127 1.00 44.44 C ATOM 1094 CD2 TYR A 74 8.271 -10.971 7.377 1.00 34.35 C ATOM 1095 CE1 TYR A 74 7.871 -11.432 10.068 1.00 22.14 C ATOM 1096 CE2 TYR A 74 9.002 -10.264 8.312 1.00 31.20 C ATOM 1097 CZ TYR A 74 8.799 -10.498 9.656 1.00 15.11 C ATOM 1098 OH TYR A 74 9.524 -9.795 10.590 1.00 0.42 O ATOM 0 H TYR A 74 4.469 -12.599 8.438 1.00 72.24 H new ATOM 0 HA TYR A 74 5.208 -11.202 5.934 1.00 23.30 H new ATOM 0 HB2 TYR A 74 6.451 -13.729 7.063 1.00 2.43 H new ATOM 0 HB3 TYR A 74 7.078 -12.694 5.796 1.00 2.43 H new ATOM 0 HD1 TYR A 74 6.420 -12.867 9.453 1.00 44.44 H new ATOM 0 HD2 TYR A 74 8.432 -10.785 6.325 1.00 34.35 H new ATOM 0 HE1 TYR A 74 7.713 -11.612 11.121 1.00 22.14 H new ATOM 0 HE2 TYR A 74 9.729 -9.532 7.992 1.00 31.20 H new ATOM 0 HH TYR A 74 10.050 -9.101 10.141 1.00 0.42 H new ATOM 1108 N ALA A 75 3.510 -13.929 6.404 1.00 44.24 N ATOM 1109 CA ALA A 75 2.663 -14.923 5.757 1.00 62.02 C ATOM 1110 C ALA A 75 1.888 -14.311 4.595 1.00 63.45 C ATOM 1111 O ALA A 75 1.659 -14.965 3.577 1.00 40.13 O ATOM 1112 CB ALA A 75 1.706 -15.538 6.767 1.00 54.13 C ATOM 0 H ALA A 75 3.439 -13.912 7.421 1.00 44.24 H new ATOM 0 HA ALA A 75 3.306 -15.708 5.357 1.00 62.02 H new ATOM 0 HB1 ALA A 75 1.079 -16.279 6.270 1.00 54.13 H new ATOM 0 HB2 ALA A 75 2.276 -16.019 7.562 1.00 54.13 H new ATOM 0 HB3 ALA A 75 1.076 -14.757 7.194 1.00 54.13 H new ATOM 1118 N ASP A 76 1.487 -13.055 4.753 1.00 20.13 N ATOM 1119 CA ASP A 76 0.738 -12.355 3.716 1.00 13.15 C ATOM 1120 C ASP A 76 1.679 -11.761 2.673 1.00 32.00 C ATOM 1121 O ASP A 76 1.350 -11.699 1.488 1.00 64.43 O ATOM 1122 CB ASP A 76 -0.120 -11.250 4.335 1.00 32.22 C ATOM 1123 CG ASP A 76 -0.682 -11.642 5.688 1.00 62.32 C ATOM 1124 OD1 ASP A 76 -0.028 -11.347 6.710 1.00 21.13 O ATOM 1125 OD2 ASP A 76 -1.775 -12.243 5.724 1.00 75.51 O ATOM 0 H ASP A 76 1.668 -12.500 5.590 1.00 20.13 H new ATOM 0 HA ASP A 76 0.087 -13.077 3.223 1.00 13.15 H new ATOM 0 HB2 ASP A 76 0.479 -10.346 4.442 1.00 32.22 H new ATOM 0 HB3 ASP A 76 -0.941 -11.010 3.659 1.00 32.22 H new ATOM 1130 N THR A 77 2.851 -11.323 3.122 1.00 63.43 N ATOM 1131 CA THR A 77 3.839 -10.732 2.228 1.00 22.20 C ATOM 1132 C THR A 77 4.210 -11.694 1.105 1.00 22.12 C ATOM 1133 O THR A 77 4.472 -12.876 1.329 1.00 61.11 O ATOM 1134 CB THR A 77 5.117 -10.332 2.989 1.00 22.33 C ATOM 1135 OG1 THR A 77 4.797 -9.400 4.028 1.00 43.01 O ATOM 1136 CG2 THR A 77 6.139 -9.717 2.045 1.00 0.33 C ATOM 0 H THR A 77 3.139 -11.366 4.099 1.00 63.43 H new ATOM 0 HA THR A 77 3.384 -9.838 1.801 1.00 22.20 H new ATOM 0 HB THR A 77 5.548 -11.231 3.429 1.00 22.33 H new ATOM 0 HG1 THR A 77 5.615 -9.152 4.508 1.00 43.01 H new ATOM 0 HG21 THR A 77 7.033 -9.443 2.605 1.00 0.33 H new ATOM 0 HG22 THR A 77 6.402 -10.440 1.273 1.00 0.33 H new ATOM 0 HG23 THR A 77 5.715 -8.827 1.579 1.00 0.33 H new ATOM 1144 N PRO A 78 4.235 -11.179 -0.133 1.00 14.42 N ATOM 1145 CA PRO A 78 4.574 -11.975 -1.316 1.00 31.34 C ATOM 1146 C PRO A 78 6.046 -12.371 -1.345 1.00 43.44 C ATOM 1147 O PRO A 78 6.926 -11.516 -1.455 1.00 52.32 O ATOM 1148 CB PRO A 78 4.248 -11.037 -2.481 1.00 23.25 C ATOM 1149 CG PRO A 78 4.368 -9.667 -1.908 1.00 43.04 C ATOM 1150 CD PRO A 78 3.933 -9.778 -0.473 1.00 44.12 C ATOM 0 HA PRO A 78 4.026 -12.917 -1.344 1.00 31.34 H new ATOM 0 HB2 PRO A 78 4.940 -11.181 -3.311 1.00 23.25 H new ATOM 0 HB3 PRO A 78 3.245 -11.218 -2.867 1.00 23.25 H new ATOM 0 HG2 PRO A 78 5.393 -9.303 -1.978 1.00 43.04 H new ATOM 0 HG3 PRO A 78 3.741 -8.960 -2.452 1.00 43.04 H new ATOM 0 HD2 PRO A 78 4.477 -9.083 0.167 1.00 44.12 H new ATOM 0 HD3 PRO A 78 2.872 -9.556 -0.356 1.00 44.12 H new ATOM 1158 N ILE A 79 6.308 -13.670 -1.248 1.00 15.34 N ATOM 1159 CA ILE A 79 7.674 -14.177 -1.265 1.00 72.12 C ATOM 1160 C ILE A 79 7.951 -14.965 -2.541 1.00 44.20 C ATOM 1161 O ILE A 79 7.339 -16.005 -2.787 1.00 51.35 O ATOM 1162 CB ILE A 79 7.956 -15.077 -0.048 1.00 33.42 C ATOM 1163 CG1 ILE A 79 7.794 -14.283 1.250 1.00 73.12 C ATOM 1164 CG2 ILE A 79 9.353 -15.672 -0.141 1.00 2.43 C ATOM 1165 CD1 ILE A 79 8.734 -13.103 1.357 1.00 13.21 C ATOM 0 H ILE A 79 5.592 -14.391 -1.157 1.00 15.34 H new ATOM 0 HA ILE A 79 8.333 -13.310 -1.225 1.00 72.12 H new ATOM 0 HB ILE A 79 7.234 -15.894 -0.044 1.00 33.42 H new ATOM 0 HG12 ILE A 79 6.766 -13.927 1.323 1.00 73.12 H new ATOM 0 HG13 ILE A 79 7.961 -14.948 2.097 1.00 73.12 H new ATOM 0 HG21 ILE A 79 9.537 -16.306 0.727 1.00 2.43 H new ATOM 0 HG22 ILE A 79 9.435 -16.268 -1.050 1.00 2.43 H new ATOM 0 HG23 ILE A 79 10.090 -14.869 -0.167 1.00 2.43 H new ATOM 0 HD11 ILE A 79 8.564 -12.587 2.302 1.00 13.21 H new ATOM 0 HD12 ILE A 79 9.765 -13.454 1.316 1.00 13.21 H new ATOM 0 HD13 ILE A 79 8.552 -12.417 0.530 1.00 13.21 H new ATOM 1177 N LEU A 80 8.880 -14.464 -3.349 1.00 15.13 N ATOM 1178 CA LEU A 80 9.241 -15.122 -4.600 1.00 11.43 C ATOM 1179 C LEU A 80 10.611 -15.782 -4.491 1.00 63.44 C ATOM 1180 O LEU A 80 11.623 -15.110 -4.291 1.00 53.42 O ATOM 1181 CB LEU A 80 9.238 -14.112 -5.749 1.00 3.11 C ATOM 1182 CG LEU A 80 8.074 -13.121 -5.769 1.00 74.33 C ATOM 1183 CD1 LEU A 80 8.094 -12.300 -7.049 1.00 73.23 C ATOM 1184 CD2 LEU A 80 6.748 -13.854 -5.624 1.00 53.21 C ATOM 0 H LEU A 80 9.396 -13.605 -3.160 1.00 15.13 H new ATOM 0 HA LEU A 80 8.501 -15.896 -4.803 1.00 11.43 H new ATOM 0 HB2 LEU A 80 10.169 -13.547 -5.712 1.00 3.11 H new ATOM 0 HB3 LEU A 80 9.237 -14.662 -6.690 1.00 3.11 H new ATOM 0 HG LEU A 80 8.185 -12.441 -4.924 1.00 74.33 H new ATOM 0 HD11 LEU A 80 7.258 -11.600 -7.046 1.00 73.23 H new ATOM 0 HD12 LEU A 80 9.031 -11.746 -7.111 1.00 73.23 H new ATOM 0 HD13 LEU A 80 8.007 -12.964 -7.909 1.00 73.23 H new ATOM 0 HD21 LEU A 80 5.930 -13.133 -5.640 1.00 53.21 H new ATOM 0 HD22 LEU A 80 6.629 -14.557 -6.449 1.00 53.21 H new ATOM 0 HD23 LEU A 80 6.734 -14.397 -4.679 1.00 53.21 H new ATOM 1196 N VAL A 81 10.638 -17.105 -4.627 1.00 55.52 N ATOM 1197 CA VAL A 81 11.884 -17.857 -4.548 1.00 41.41 C ATOM 1198 C VAL A 81 12.347 -18.301 -5.931 1.00 54.22 C ATOM 1199 O VAL A 81 11.559 -18.817 -6.725 1.00 62.32 O ATOM 1200 CB VAL A 81 11.735 -19.096 -3.646 1.00 24.11 C ATOM 1201 CG1 VAL A 81 10.685 -20.042 -4.207 1.00 31.21 C ATOM 1202 CG2 VAL A 81 13.073 -19.804 -3.489 1.00 52.20 C ATOM 0 H VAL A 81 9.810 -17.677 -4.792 1.00 55.52 H new ATOM 0 HA VAL A 81 12.630 -17.190 -4.116 1.00 41.41 H new ATOM 0 HB VAL A 81 11.405 -18.769 -2.660 1.00 24.11 H new ATOM 0 HG11 VAL A 81 10.594 -20.912 -3.556 1.00 31.21 H new ATOM 0 HG12 VAL A 81 9.725 -19.528 -4.263 1.00 31.21 H new ATOM 0 HG13 VAL A 81 10.982 -20.365 -5.205 1.00 31.21 H new ATOM 0 HG21 VAL A 81 12.950 -20.677 -2.849 1.00 52.20 H new ATOM 0 HG22 VAL A 81 13.435 -20.120 -4.468 1.00 52.20 H new ATOM 0 HG23 VAL A 81 13.795 -19.123 -3.038 1.00 52.20 H new ATOM 1212 N LEU A 82 13.629 -18.097 -6.214 1.00 34.23 N ATOM 1213 CA LEU A 82 14.198 -18.477 -7.502 1.00 31.40 C ATOM 1214 C LEU A 82 14.592 -19.951 -7.509 1.00 45.24 C ATOM 1215 O LEU A 82 15.070 -20.482 -6.506 1.00 61.44 O ATOM 1216 CB LEU A 82 15.417 -17.610 -7.819 1.00 51.51 C ATOM 1217 CG LEU A 82 15.139 -16.126 -8.062 1.00 44.45 C ATOM 1218 CD1 LEU A 82 14.965 -15.392 -6.742 1.00 52.30 C ATOM 1219 CD2 LEU A 82 16.261 -15.500 -8.878 1.00 65.02 C ATOM 0 H LEU A 82 14.294 -17.671 -5.569 1.00 34.23 H new ATOM 0 HA LEU A 82 13.439 -18.319 -8.268 1.00 31.40 H new ATOM 0 HB2 LEU A 82 16.124 -17.697 -6.994 1.00 51.51 H new ATOM 0 HB3 LEU A 82 15.908 -18.017 -8.703 1.00 51.51 H new ATOM 0 HG LEU A 82 14.212 -16.038 -8.628 1.00 44.45 H new ATOM 0 HD11 LEU A 82 14.768 -14.338 -6.935 1.00 52.30 H new ATOM 0 HD12 LEU A 82 14.127 -15.823 -6.194 1.00 52.30 H new ATOM 0 HD13 LEU A 82 15.875 -15.488 -6.149 1.00 52.30 H new ATOM 0 HD21 LEU A 82 16.047 -14.444 -9.041 1.00 65.02 H new ATOM 0 HD22 LEU A 82 17.203 -15.600 -8.338 1.00 65.02 H new ATOM 0 HD23 LEU A 82 16.338 -16.007 -9.840 1.00 65.02 H new ATOM 1231 N THR A 83 14.392 -20.606 -8.649 1.00 32.35 N ATOM 1232 CA THR A 83 14.727 -22.018 -8.787 1.00 43.35 C ATOM 1233 C THR A 83 15.621 -22.254 -10.000 1.00 55.30 C ATOM 1234 O THR A 83 15.733 -21.398 -10.878 1.00 53.32 O ATOM 1235 CB THR A 83 13.462 -22.886 -8.920 1.00 14.43 C ATOM 1236 OG1 THR A 83 13.826 -24.261 -9.084 1.00 54.32 O ATOM 1237 CG2 THR A 83 12.617 -22.434 -10.102 1.00 22.42 C ATOM 0 H THR A 83 14.000 -20.181 -9.489 1.00 32.35 H new ATOM 0 HA THR A 83 15.262 -22.306 -7.882 1.00 43.35 H new ATOM 0 HB THR A 83 12.873 -22.773 -8.010 1.00 14.43 H new ATOM 0 HG1 THR A 83 13.858 -24.698 -8.207 1.00 54.32 H new ATOM 0 HG21 THR A 83 11.729 -23.062 -10.176 1.00 22.42 H new ATOM 0 HG22 THR A 83 12.317 -21.396 -9.959 1.00 22.42 H new ATOM 0 HG23 THR A 83 13.199 -22.520 -11.019 1.00 22.42 H new ATOM 1245 N THR A 84 16.255 -23.421 -10.044 1.00 22.14 N ATOM 1246 CA THR A 84 17.139 -23.770 -11.149 1.00 2.34 C ATOM 1247 C THR A 84 16.631 -24.999 -11.893 1.00 33.13 C ATOM 1248 O THR A 84 16.775 -25.102 -13.110 1.00 64.23 O ATOM 1249 CB THR A 84 18.574 -24.038 -10.657 1.00 61.10 C ATOM 1250 OG1 THR A 84 19.388 -24.491 -11.745 1.00 10.32 O ATOM 1251 CG2 THR A 84 18.580 -25.077 -9.546 1.00 71.30 C ATOM 0 H THR A 84 16.173 -24.141 -9.326 1.00 22.14 H new ATOM 0 HA THR A 84 17.149 -22.917 -11.827 1.00 2.34 H new ATOM 0 HB THR A 84 18.980 -23.106 -10.263 1.00 61.10 H new ATOM 0 HG1 THR A 84 20.299 -24.658 -11.425 1.00 10.32 H new ATOM 0 HG21 THR A 84 19.604 -25.250 -9.215 1.00 71.30 H new ATOM 0 HG22 THR A 84 17.983 -24.717 -8.708 1.00 71.30 H new ATOM 0 HG23 THR A 84 18.157 -26.010 -9.918 1.00 71.30 H new ATOM 1259 N GLU A 85 16.034 -25.929 -11.153 1.00 4.44 N ATOM 1260 CA GLU A 85 15.505 -27.151 -11.744 1.00 73.53 C ATOM 1261 C GLU A 85 14.187 -26.881 -12.465 1.00 11.14 C ATOM 1262 O GLU A 85 13.988 -27.309 -13.601 1.00 24.33 O ATOM 1263 CB GLU A 85 15.300 -28.219 -10.667 1.00 11.40 C ATOM 1264 CG GLU A 85 16.578 -28.942 -10.277 1.00 35.45 C ATOM 1265 CD GLU A 85 16.503 -29.551 -8.890 1.00 12.24 C ATOM 1266 OE1 GLU A 85 17.426 -29.309 -8.084 1.00 52.43 O ATOM 1267 OE2 GLU A 85 15.520 -30.269 -8.610 1.00 22.31 O ATOM 0 H GLU A 85 15.905 -25.858 -10.144 1.00 4.44 H new ATOM 0 HA GLU A 85 16.230 -27.514 -12.472 1.00 73.53 H new ATOM 0 HB2 GLU A 85 14.872 -27.752 -9.780 1.00 11.40 H new ATOM 0 HB3 GLU A 85 14.574 -28.949 -11.025 1.00 11.40 H new ATOM 0 HG2 GLU A 85 16.783 -29.728 -11.004 1.00 35.45 H new ATOM 0 HG3 GLU A 85 17.414 -28.243 -10.318 1.00 35.45 H new ATOM 1274 N GLY A 86 13.288 -26.166 -11.794 1.00 22.42 N ATOM 1275 CA GLY A 86 12.001 -25.851 -12.384 1.00 75.22 C ATOM 1276 C GLY A 86 11.091 -27.061 -12.472 1.00 44.13 C ATOM 1277 O GLY A 86 10.558 -27.369 -13.538 1.00 42.22 O ATOM 0 H GLY A 86 13.429 -25.800 -10.853 1.00 22.42 H new ATOM 0 HA2 GLY A 86 11.514 -25.076 -11.792 1.00 75.22 H new ATOM 0 HA3 GLY A 86 12.153 -25.441 -13.383 1.00 75.22 H new ATOM 1281 N SER A 87 10.915 -27.750 -11.349 1.00 50.23 N ATOM 1282 CA SER A 87 10.068 -28.936 -11.305 1.00 64.24 C ATOM 1283 C SER A 87 8.984 -28.791 -10.242 1.00 53.44 C ATOM 1284 O SER A 87 9.156 -28.070 -9.259 1.00 55.11 O ATOM 1285 CB SER A 87 10.912 -30.181 -11.022 1.00 42.51 C ATOM 1286 OG SER A 87 10.150 -31.363 -11.192 1.00 61.12 O ATOM 0 H SER A 87 11.348 -27.507 -10.458 1.00 50.23 H new ATOM 0 HA SER A 87 9.587 -29.044 -12.277 1.00 64.24 H new ATOM 0 HB2 SER A 87 11.773 -30.200 -11.690 1.00 42.51 H new ATOM 0 HB3 SER A 87 11.300 -30.138 -10.004 1.00 42.51 H new ATOM 0 HG SER A 87 10.712 -32.144 -11.007 1.00 61.12 H new ATOM 1292 N ASP A 88 7.867 -29.480 -10.448 1.00 11.13 N ATOM 1293 CA ASP A 88 6.753 -29.429 -9.507 1.00 63.34 C ATOM 1294 C ASP A 88 7.227 -29.727 -8.088 1.00 54.10 C ATOM 1295 O ASP A 88 6.981 -28.950 -7.166 1.00 32.34 O ATOM 1296 CB ASP A 88 5.667 -30.426 -9.916 1.00 5.03 C ATOM 1297 CG ASP A 88 6.243 -31.736 -10.417 1.00 31.14 C ATOM 1298 OD1 ASP A 88 6.737 -31.767 -11.563 1.00 2.12 O ATOM 1299 OD2 ASP A 88 6.198 -32.731 -9.663 1.00 2.03 O ATOM 0 H ASP A 88 7.708 -30.080 -11.257 1.00 11.13 H new ATOM 0 HA ASP A 88 6.337 -28.422 -9.528 1.00 63.34 H new ATOM 0 HB2 ASP A 88 5.017 -30.621 -9.063 1.00 5.03 H new ATOM 0 HB3 ASP A 88 5.046 -29.984 -10.695 1.00 5.03 H new ATOM 1304 N ALA A 89 7.906 -30.857 -7.921 1.00 11.10 N ATOM 1305 CA ALA A 89 8.414 -31.257 -6.615 1.00 2.44 C ATOM 1306 C ALA A 89 9.213 -30.130 -5.968 1.00 41.03 C ATOM 1307 O ALA A 89 9.177 -29.949 -4.751 1.00 10.00 O ATOM 1308 CB ALA A 89 9.271 -32.508 -6.742 1.00 15.22 C ATOM 0 H ALA A 89 8.117 -31.512 -8.674 1.00 11.10 H new ATOM 0 HA ALA A 89 7.561 -31.478 -5.973 1.00 2.44 H new ATOM 0 HB1 ALA A 89 9.644 -32.795 -5.759 1.00 15.22 H new ATOM 0 HB2 ALA A 89 8.671 -33.320 -7.154 1.00 15.22 H new ATOM 0 HB3 ALA A 89 10.113 -32.307 -7.404 1.00 15.22 H new ATOM 1314 N PHE A 90 9.935 -29.375 -6.790 1.00 74.34 N ATOM 1315 CA PHE A 90 10.744 -28.267 -6.298 1.00 42.21 C ATOM 1316 C PHE A 90 9.869 -27.207 -5.635 1.00 43.45 C ATOM 1317 O PHE A 90 10.264 -26.589 -4.646 1.00 51.45 O ATOM 1318 CB PHE A 90 11.542 -27.642 -7.444 1.00 63.03 C ATOM 1319 CG PHE A 90 12.770 -26.906 -6.989 1.00 20.44 C ATOM 1320 CD1 PHE A 90 12.660 -25.735 -6.258 1.00 1.55 C ATOM 1321 CD2 PHE A 90 14.034 -27.387 -7.291 1.00 31.02 C ATOM 1322 CE1 PHE A 90 13.788 -25.055 -5.838 1.00 22.42 C ATOM 1323 CE2 PHE A 90 15.166 -26.712 -6.873 1.00 72.43 C ATOM 1324 CZ PHE A 90 15.043 -25.545 -6.145 1.00 34.51 C ATOM 0 H PHE A 90 9.976 -29.511 -7.800 1.00 74.34 H new ATOM 0 HA PHE A 90 11.437 -28.659 -5.553 1.00 42.21 H new ATOM 0 HB2 PHE A 90 11.836 -28.426 -8.141 1.00 63.03 H new ATOM 0 HB3 PHE A 90 10.898 -26.954 -7.991 1.00 63.03 H new ATOM 0 HD1 PHE A 90 11.682 -25.349 -6.013 1.00 1.55 H new ATOM 0 HD2 PHE A 90 14.136 -28.300 -7.859 1.00 31.02 H new ATOM 0 HE1 PHE A 90 13.688 -24.142 -5.270 1.00 22.42 H new ATOM 0 HE2 PHE A 90 16.145 -27.097 -7.116 1.00 72.43 H new ATOM 0 HZ PHE A 90 15.926 -25.017 -5.816 1.00 34.51 H new ATOM 1334 N LYS A 91 8.679 -27.001 -6.188 1.00 53.12 N ATOM 1335 CA LYS A 91 7.746 -26.017 -5.652 1.00 53.35 C ATOM 1336 C LYS A 91 7.309 -26.393 -4.240 1.00 45.11 C ATOM 1337 O LYS A 91 7.133 -25.527 -3.384 1.00 30.03 O ATOM 1338 CB LYS A 91 6.520 -25.898 -6.561 1.00 43.45 C ATOM 1339 CG LYS A 91 6.832 -25.315 -7.929 1.00 71.33 C ATOM 1340 CD LYS A 91 5.769 -25.687 -8.949 1.00 74.10 C ATOM 1341 CE LYS A 91 4.507 -24.858 -8.766 1.00 52.42 C ATOM 1342 NZ LYS A 91 3.573 -25.008 -9.916 1.00 74.10 N ATOM 0 H LYS A 91 8.337 -27.503 -7.008 1.00 53.12 H new ATOM 0 HA LYS A 91 8.256 -25.055 -5.611 1.00 53.35 H new ATOM 0 HB2 LYS A 91 6.075 -26.885 -6.689 1.00 43.45 H new ATOM 0 HB3 LYS A 91 5.774 -25.273 -6.071 1.00 43.45 H new ATOM 0 HG2 LYS A 91 6.903 -24.230 -7.855 1.00 71.33 H new ATOM 0 HG3 LYS A 91 7.804 -25.676 -8.266 1.00 71.33 H new ATOM 0 HD2 LYS A 91 6.161 -25.538 -9.955 1.00 74.10 H new ATOM 0 HD3 LYS A 91 5.527 -26.746 -8.855 1.00 74.10 H new ATOM 0 HE2 LYS A 91 4.004 -25.161 -7.848 1.00 52.42 H new ATOM 0 HE3 LYS A 91 4.776 -23.808 -8.651 1.00 52.42 H new ATOM 0 HZ1 LYS A 91 2.726 -24.428 -9.753 1.00 74.10 H new ATOM 0 HZ2 LYS A 91 4.044 -24.695 -10.789 1.00 74.10 H new ATOM 0 HZ3 LYS A 91 3.296 -26.006 -10.010 1.00 74.10 H new ATOM 1356 N ALA A 92 7.139 -27.690 -4.004 1.00 53.40 N ATOM 1357 CA ALA A 92 6.727 -28.180 -2.695 1.00 11.14 C ATOM 1358 C ALA A 92 7.704 -27.739 -1.611 1.00 5.53 C ATOM 1359 O ALA A 92 7.305 -27.441 -0.485 1.00 42.04 O ATOM 1360 CB ALA A 92 6.606 -29.696 -2.713 1.00 72.51 C ATOM 0 H ALA A 92 7.280 -28.420 -4.702 1.00 53.40 H new ATOM 0 HA ALA A 92 5.752 -27.751 -2.465 1.00 11.14 H new ATOM 0 HB1 ALA A 92 6.298 -30.048 -1.729 1.00 72.51 H new ATOM 0 HB2 ALA A 92 5.864 -29.993 -3.454 1.00 72.51 H new ATOM 0 HB3 ALA A 92 7.570 -30.135 -2.970 1.00 72.51 H new ATOM 1366 N ALA A 93 8.987 -27.699 -1.957 1.00 71.24 N ATOM 1367 CA ALA A 93 10.021 -27.293 -1.014 1.00 41.10 C ATOM 1368 C ALA A 93 9.844 -25.836 -0.599 1.00 61.21 C ATOM 1369 O ALA A 93 9.636 -25.537 0.576 1.00 2.32 O ATOM 1370 CB ALA A 93 11.401 -27.508 -1.619 1.00 13.44 C ATOM 0 H ALA A 93 9.335 -27.943 -2.884 1.00 71.24 H new ATOM 0 HA ALA A 93 9.927 -27.912 -0.121 1.00 41.10 H new ATOM 0 HB1 ALA A 93 12.164 -27.200 -0.904 1.00 13.44 H new ATOM 0 HB2 ALA A 93 11.533 -28.563 -1.859 1.00 13.44 H new ATOM 0 HB3 ALA A 93 11.496 -26.915 -2.528 1.00 13.44 H new ATOM 1376 N ALA A 94 9.929 -24.934 -1.572 1.00 34.44 N ATOM 1377 CA ALA A 94 9.776 -23.509 -1.307 1.00 64.10 C ATOM 1378 C ALA A 94 8.489 -23.228 -0.540 1.00 2.45 C ATOM 1379 O ALA A 94 8.486 -22.466 0.428 1.00 60.21 O ATOM 1380 CB ALA A 94 9.798 -22.725 -2.611 1.00 1.02 C ATOM 0 H ALA A 94 10.103 -25.165 -2.550 1.00 34.44 H new ATOM 0 HA ALA A 94 10.614 -23.188 -0.688 1.00 64.10 H new ATOM 0 HB1 ALA A 94 9.683 -21.662 -2.399 1.00 1.02 H new ATOM 0 HB2 ALA A 94 10.747 -22.892 -3.120 1.00 1.02 H new ATOM 0 HB3 ALA A 94 8.980 -23.058 -3.250 1.00 1.02 H new ATOM 1386 N ARG A 95 7.397 -23.846 -0.978 1.00 3.15 N ATOM 1387 CA ARG A 95 6.103 -23.660 -0.332 1.00 42.24 C ATOM 1388 C ARG A 95 6.107 -24.250 1.075 1.00 62.45 C ATOM 1389 O ARG A 95 5.478 -23.712 1.986 1.00 25.41 O ATOM 1390 CB ARG A 95 4.996 -24.308 -1.166 1.00 1.21 C ATOM 1391 CG ARG A 95 3.596 -23.889 -0.749 1.00 73.11 C ATOM 1392 CD ARG A 95 2.533 -24.618 -1.556 1.00 71.12 C ATOM 1393 NE ARG A 95 1.183 -24.291 -1.105 1.00 71.30 N ATOM 1394 CZ ARG A 95 0.085 -24.834 -1.619 1.00 53.11 C ATOM 1395 NH1 ARG A 95 0.177 -25.725 -2.596 1.00 74.23 N ATOM 1396 NH2 ARG A 95 -1.109 -24.485 -1.155 1.00 64.32 N ATOM 0 H ARG A 95 7.382 -24.480 -1.777 1.00 3.15 H new ATOM 0 HA ARG A 95 5.913 -22.589 -0.257 1.00 42.24 H new ATOM 0 HB2 ARG A 95 5.146 -24.052 -2.215 1.00 1.21 H new ATOM 0 HB3 ARG A 95 5.080 -25.392 -1.087 1.00 1.21 H new ATOM 0 HG2 ARG A 95 3.454 -24.095 0.312 1.00 73.11 H new ATOM 0 HG3 ARG A 95 3.482 -22.813 -0.883 1.00 73.11 H new ATOM 0 HD2 ARG A 95 2.636 -24.358 -2.610 1.00 71.12 H new ATOM 0 HD3 ARG A 95 2.691 -25.693 -1.476 1.00 71.12 H new ATOM 0 HE ARG A 95 1.077 -23.608 -0.354 1.00 71.30 H new ATOM 0 HH11 ARG A 95 1.093 -25.995 -2.955 1.00 74.23 H new ATOM 0 HH12 ARG A 95 -0.668 -26.140 -2.989 1.00 74.23 H new ATOM 0 HH21 ARG A 95 -1.184 -23.800 -0.403 1.00 64.32 H new ATOM 0 HH22 ARG A 95 -1.952 -24.902 -1.550 1.00 64.32 H new ATOM 1410 N ASP A 96 6.819 -25.359 1.243 1.00 70.30 N ATOM 1411 CA ASP A 96 6.905 -26.023 2.539 1.00 45.14 C ATOM 1412 C ASP A 96 7.655 -25.155 3.545 1.00 64.34 C ATOM 1413 O ASP A 96 7.311 -25.118 4.725 1.00 21.55 O ATOM 1414 CB ASP A 96 7.601 -27.378 2.396 1.00 1.42 C ATOM 1415 CG ASP A 96 7.820 -28.059 3.733 1.00 61.34 C ATOM 1416 OD1 ASP A 96 8.961 -28.490 3.998 1.00 5.04 O ATOM 1417 OD2 ASP A 96 6.850 -28.163 4.512 1.00 13.23 O ATOM 0 H ASP A 96 7.345 -25.817 0.499 1.00 70.30 H new ATOM 0 HA ASP A 96 5.891 -26.181 2.907 1.00 45.14 H new ATOM 0 HB2 ASP A 96 7.002 -28.025 1.755 1.00 1.42 H new ATOM 0 HB3 ASP A 96 8.562 -27.239 1.900 1.00 1.42 H new ATOM 1422 N ALA A 97 8.683 -24.459 3.068 1.00 34.53 N ATOM 1423 CA ALA A 97 9.481 -23.592 3.926 1.00 54.34 C ATOM 1424 C ALA A 97 8.669 -22.391 4.399 1.00 13.20 C ATOM 1425 O ALA A 97 8.807 -21.945 5.537 1.00 22.44 O ATOM 1426 CB ALA A 97 10.731 -23.130 3.192 1.00 52.23 C ATOM 0 H ALA A 97 8.982 -24.479 2.093 1.00 34.53 H new ATOM 0 HA ALA A 97 9.779 -24.165 4.804 1.00 54.34 H new ATOM 0 HB1 ALA A 97 11.318 -22.483 3.844 1.00 52.23 H new ATOM 0 HB2 ALA A 97 11.328 -23.997 2.908 1.00 52.23 H new ATOM 0 HB3 ALA A 97 10.444 -22.578 2.297 1.00 52.23 H new ATOM 1432 N GLY A 98 7.821 -21.870 3.517 1.00 61.03 N ATOM 1433 CA GLY A 98 7.000 -20.725 3.863 1.00 3.44 C ATOM 1434 C GLY A 98 7.061 -19.630 2.817 1.00 5.52 C ATOM 1435 O GLY A 98 7.218 -18.454 3.147 1.00 23.54 O ATOM 0 H GLY A 98 7.688 -22.221 2.569 1.00 61.03 H new ATOM 0 HA2 GLY A 98 5.966 -21.047 3.987 1.00 3.44 H new ATOM 0 HA3 GLY A 98 7.326 -20.325 4.823 1.00 3.44 H new ATOM 1439 N ALA A 99 6.939 -20.015 1.551 1.00 20.23 N ATOM 1440 CA ALA A 99 6.981 -19.057 0.453 1.00 30.34 C ATOM 1441 C ALA A 99 5.637 -18.984 -0.263 1.00 33.11 C ATOM 1442 O ALA A 99 4.841 -19.922 -0.210 1.00 34.22 O ATOM 1443 CB ALA A 99 8.084 -19.426 -0.527 1.00 63.42 C ATOM 0 H ALA A 99 6.810 -20.984 1.260 1.00 20.23 H new ATOM 0 HA ALA A 99 7.195 -18.073 0.870 1.00 30.34 H new ATOM 0 HB1 ALA A 99 8.104 -18.702 -1.342 1.00 63.42 H new ATOM 0 HB2 ALA A 99 9.045 -19.420 -0.013 1.00 63.42 H new ATOM 0 HB3 ALA A 99 7.895 -20.421 -0.930 1.00 63.42 H new ATOM 1449 N THR A 100 5.389 -17.863 -0.933 1.00 14.22 N ATOM 1450 CA THR A 100 4.140 -17.666 -1.658 1.00 71.32 C ATOM 1451 C THR A 100 4.255 -18.161 -3.096 1.00 3.44 C ATOM 1452 O THR A 100 3.452 -18.975 -3.549 1.00 24.14 O ATOM 1453 CB THR A 100 3.724 -16.183 -1.669 1.00 71.31 C ATOM 1454 OG1 THR A 100 3.549 -15.714 -0.328 1.00 2.43 O ATOM 1455 CG2 THR A 100 2.434 -15.989 -2.452 1.00 1.31 C ATOM 0 H THR A 100 6.037 -17.077 -0.989 1.00 14.22 H new ATOM 0 HA THR A 100 3.378 -18.245 -1.137 1.00 71.32 H new ATOM 0 HB THR A 100 4.514 -15.610 -2.154 1.00 71.31 H new ATOM 0 HG1 THR A 100 3.286 -14.770 -0.343 1.00 2.43 H new ATOM 0 HG21 THR A 100 2.160 -14.934 -2.446 1.00 1.31 H new ATOM 0 HG22 THR A 100 2.579 -16.320 -3.480 1.00 1.31 H new ATOM 0 HG23 THR A 100 1.637 -16.573 -1.991 1.00 1.31 H new ATOM 1463 N GLY A 101 5.261 -17.663 -3.809 1.00 52.50 N ATOM 1464 CA GLY A 101 5.463 -18.066 -5.188 1.00 50.13 C ATOM 1465 C GLY A 101 6.923 -18.311 -5.513 1.00 3.53 C ATOM 1466 O GLY A 101 7.799 -18.067 -4.683 1.00 45.41 O ATOM 0 H GLY A 101 5.939 -16.988 -3.456 1.00 52.50 H new ATOM 0 HA2 GLY A 101 4.893 -18.974 -5.385 1.00 50.13 H new ATOM 0 HA3 GLY A 101 5.071 -17.294 -5.850 1.00 50.13 H new ATOM 1470 N TRP A 102 7.186 -18.795 -6.721 1.00 51.00 N ATOM 1471 CA TRP A 102 8.551 -19.075 -7.152 1.00 51.51 C ATOM 1472 C TRP A 102 8.776 -18.606 -8.586 1.00 33.53 C ATOM 1473 O TRP A 102 7.823 -18.322 -9.312 1.00 13.34 O ATOM 1474 CB TRP A 102 8.847 -20.571 -7.039 1.00 1.23 C ATOM 1475 CG TRP A 102 8.307 -21.372 -8.185 1.00 11.25 C ATOM 1476 CD1 TRP A 102 7.171 -21.117 -8.899 1.00 62.40 C ATOM 1477 CD2 TRP A 102 8.879 -22.558 -8.746 1.00 43.01 C ATOM 1478 NE1 TRP A 102 7.003 -22.074 -9.871 1.00 1.00 N ATOM 1479 CE2 TRP A 102 8.038 -22.968 -9.799 1.00 31.53 C ATOM 1480 CE3 TRP A 102 10.021 -23.312 -8.464 1.00 5.12 C ATOM 1481 CZ2 TRP A 102 8.304 -24.099 -10.566 1.00 60.31 C ATOM 1482 CZ3 TRP A 102 10.284 -24.434 -9.226 1.00 70.22 C ATOM 1483 CH2 TRP A 102 9.429 -24.819 -10.268 1.00 0.14 C ATOM 0 H TRP A 102 6.472 -19.002 -7.420 1.00 51.00 H new ATOM 0 HA TRP A 102 9.231 -18.527 -6.499 1.00 51.51 H new ATOM 0 HB2 TRP A 102 9.926 -20.717 -6.979 1.00 1.23 H new ATOM 0 HB3 TRP A 102 8.422 -20.949 -6.109 1.00 1.23 H new ATOM 0 HD1 TRP A 102 6.503 -20.286 -8.725 1.00 62.40 H new ATOM 0 HE1 TRP A 102 6.232 -22.112 -10.538 1.00 1.00 H new ATOM 0 HE3 TRP A 102 10.687 -23.023 -7.664 1.00 5.12 H new ATOM 0 HZ2 TRP A 102 7.645 -24.398 -11.368 1.00 60.31 H new ATOM 0 HZ3 TRP A 102 11.163 -25.025 -9.015 1.00 70.22 H new ATOM 0 HH2 TRP A 102 9.663 -25.701 -10.847 1.00 0.14 H new ATOM 1494 N ILE A 103 10.040 -18.530 -8.987 1.00 50.50 N ATOM 1495 CA ILE A 103 10.388 -18.097 -10.335 1.00 21.12 C ATOM 1496 C ILE A 103 11.690 -18.740 -10.799 1.00 62.44 C ATOM 1497 O ILE A 103 12.402 -19.362 -10.011 1.00 42.33 O ATOM 1498 CB ILE A 103 10.528 -16.566 -10.416 1.00 54.52 C ATOM 1499 CG1 ILE A 103 10.888 -15.991 -9.045 1.00 13.33 C ATOM 1500 CG2 ILE A 103 9.240 -15.943 -10.936 1.00 22.31 C ATOM 1501 CD1 ILE A 103 10.975 -14.481 -9.026 1.00 41.34 C ATOM 0 H ILE A 103 10.840 -18.762 -8.398 1.00 50.50 H new ATOM 0 HA ILE A 103 9.575 -18.414 -10.988 1.00 21.12 H new ATOM 0 HB ILE A 103 11.332 -16.326 -11.112 1.00 54.52 H new ATOM 0 HG12 ILE A 103 10.142 -16.313 -8.318 1.00 13.33 H new ATOM 0 HG13 ILE A 103 11.844 -16.406 -8.726 1.00 13.33 H new ATOM 0 HG21 ILE A 103 9.355 -14.860 -10.988 1.00 22.31 H new ATOM 0 HG22 ILE A 103 9.023 -16.333 -11.931 1.00 22.31 H new ATOM 0 HG23 ILE A 103 8.419 -16.189 -10.263 1.00 22.31 H new ATOM 0 HD11 ILE A 103 11.234 -14.144 -8.022 1.00 41.34 H new ATOM 0 HD12 ILE A 103 11.741 -14.152 -9.728 1.00 41.34 H new ATOM 0 HD13 ILE A 103 10.013 -14.057 -9.314 1.00 41.34 H new ATOM 1513 N GLU A 104 11.995 -18.585 -12.084 1.00 4.01 N ATOM 1514 CA GLU A 104 13.213 -19.150 -12.653 1.00 22.32 C ATOM 1515 C GLU A 104 14.254 -18.062 -12.902 1.00 35.01 C ATOM 1516 O GLU A 104 13.982 -17.071 -13.580 1.00 63.14 O ATOM 1517 CB GLU A 104 12.900 -19.881 -13.960 1.00 44.03 C ATOM 1518 CG GLU A 104 12.238 -21.233 -13.758 1.00 75.24 C ATOM 1519 CD GLU A 104 12.351 -22.127 -14.978 1.00 51.54 C ATOM 1520 OE1 GLU A 104 11.392 -22.162 -15.778 1.00 44.33 O ATOM 1521 OE2 GLU A 104 13.397 -22.790 -15.133 1.00 61.33 O ATOM 0 H GLU A 104 11.416 -18.073 -12.750 1.00 4.01 H new ATOM 0 HA GLU A 104 13.622 -19.862 -11.936 1.00 22.32 H new ATOM 0 HB2 GLU A 104 12.249 -19.255 -14.570 1.00 44.03 H new ATOM 0 HB3 GLU A 104 13.825 -20.019 -14.520 1.00 44.03 H new ATOM 0 HG2 GLU A 104 12.694 -21.732 -12.903 1.00 75.24 H new ATOM 0 HG3 GLU A 104 11.185 -21.085 -13.517 1.00 75.24 H new ATOM 1528 N LYS A 105 15.446 -18.254 -12.348 1.00 12.44 N ATOM 1529 CA LYS A 105 16.529 -17.291 -12.509 1.00 14.44 C ATOM 1530 C LYS A 105 17.356 -17.605 -13.751 1.00 52.41 C ATOM 1531 O LYS A 105 17.374 -18.732 -14.245 1.00 63.23 O ATOM 1532 CB LYS A 105 17.428 -17.292 -11.270 1.00 41.35 C ATOM 1533 CG LYS A 105 18.562 -18.300 -11.343 1.00 50.33 C ATOM 1534 CD LYS A 105 18.038 -19.724 -11.421 1.00 10.13 C ATOM 1535 CE LYS A 105 19.166 -20.722 -11.634 1.00 53.13 C ATOM 1536 NZ LYS A 105 19.999 -20.372 -12.818 1.00 4.15 N ATOM 0 H LYS A 105 15.687 -19.068 -11.783 1.00 12.44 H new ATOM 0 HA LYS A 105 16.088 -16.302 -12.629 1.00 14.44 H new ATOM 0 HB2 LYS A 105 17.847 -16.295 -11.135 1.00 41.35 H new ATOM 0 HB3 LYS A 105 16.820 -17.504 -10.390 1.00 41.35 H new ATOM 0 HG2 LYS A 105 19.180 -18.091 -12.216 1.00 50.33 H new ATOM 0 HG3 LYS A 105 19.201 -18.194 -10.466 1.00 50.33 H new ATOM 0 HD2 LYS A 105 17.504 -19.967 -10.502 1.00 10.13 H new ATOM 0 HD3 LYS A 105 17.320 -19.805 -12.237 1.00 10.13 H new ATOM 0 HE2 LYS A 105 19.795 -20.755 -10.744 1.00 53.13 H new ATOM 0 HE3 LYS A 105 18.748 -21.720 -11.766 1.00 53.13 H new ATOM 0 HZ1 LYS A 105 20.548 -21.204 -13.114 1.00 4.15 H new ATOM 0 HZ2 LYS A 105 19.383 -20.068 -13.599 1.00 4.15 H new ATOM 0 HZ3 LYS A 105 20.649 -19.599 -12.569 1.00 4.15 H new ATOM 1550 N PRO A 106 18.058 -16.586 -14.269 1.00 2.24 N ATOM 1551 CA PRO A 106 18.043 -15.239 -13.689 1.00 65.34 C ATOM 1552 C PRO A 106 16.702 -14.540 -13.881 1.00 71.32 C ATOM 1553 O PRO A 106 15.801 -15.073 -14.531 1.00 4.14 O ATOM 1554 CB PRO A 106 19.143 -14.508 -14.464 1.00 31.13 C ATOM 1555 CG PRO A 106 19.237 -15.231 -15.763 1.00 35.43 C ATOM 1556 CD PRO A 106 18.920 -16.670 -15.459 1.00 43.24 C ATOM 0 HA PRO A 106 18.202 -15.257 -12.611 1.00 65.34 H new ATOM 0 HB2 PRO A 106 18.891 -13.458 -14.613 1.00 31.13 H new ATOM 0 HB3 PRO A 106 20.091 -14.535 -13.926 1.00 31.13 H new ATOM 0 HG2 PRO A 106 18.535 -14.822 -16.489 1.00 35.43 H new ATOM 0 HG3 PRO A 106 20.234 -15.133 -16.193 1.00 35.43 H new ATOM 0 HD2 PRO A 106 18.409 -17.153 -16.292 1.00 43.24 H new ATOM 0 HD3 PRO A 106 19.823 -17.247 -15.261 1.00 43.24 H new ATOM 1564 N ILE A 107 16.576 -13.346 -13.313 1.00 52.21 N ATOM 1565 CA ILE A 107 15.344 -12.574 -13.424 1.00 22.14 C ATOM 1566 C ILE A 107 15.499 -11.431 -14.421 1.00 62.33 C ATOM 1567 O ILE A 107 16.558 -10.809 -14.508 1.00 14.51 O ATOM 1568 CB ILE A 107 14.917 -11.997 -12.061 1.00 44.21 C ATOM 1569 CG1 ILE A 107 14.800 -13.115 -11.023 1.00 54.22 C ATOM 1570 CG2 ILE A 107 13.600 -11.248 -12.193 1.00 12.35 C ATOM 1571 CD1 ILE A 107 13.796 -14.183 -11.397 1.00 60.11 C ATOM 0 H ILE A 107 17.311 -12.892 -12.771 1.00 52.21 H new ATOM 0 HA ILE A 107 14.573 -13.259 -13.777 1.00 22.14 H new ATOM 0 HB ILE A 107 15.680 -11.295 -11.725 1.00 44.21 H new ATOM 0 HG12 ILE A 107 15.777 -13.578 -10.888 1.00 54.22 H new ATOM 0 HG13 ILE A 107 14.517 -12.681 -10.064 1.00 54.22 H new ATOM 0 HG21 ILE A 107 13.311 -10.846 -11.222 1.00 12.35 H new ATOM 0 HG22 ILE A 107 13.716 -10.430 -12.904 1.00 12.35 H new ATOM 0 HG23 ILE A 107 12.827 -11.930 -12.548 1.00 12.35 H new ATOM 0 HD11 ILE A 107 13.765 -14.943 -10.616 1.00 60.11 H new ATOM 0 HD12 ILE A 107 12.809 -13.733 -11.504 1.00 60.11 H new ATOM 0 HD13 ILE A 107 14.089 -14.644 -12.340 1.00 60.11 H new ATOM 1583 N ASP A 108 14.437 -11.160 -15.171 1.00 71.24 N ATOM 1584 CA ASP A 108 14.453 -10.090 -16.162 1.00 2.23 C ATOM 1585 C ASP A 108 14.034 -8.763 -15.535 1.00 62.52 C ATOM 1586 O ASP A 108 13.380 -8.720 -14.493 1.00 23.31 O ATOM 1587 CB ASP A 108 13.526 -10.432 -17.329 1.00 64.02 C ATOM 1588 CG ASP A 108 14.289 -10.862 -18.567 1.00 51.20 C ATOM 1589 OD1 ASP A 108 15.430 -10.390 -18.754 1.00 31.31 O ATOM 1590 OD2 ASP A 108 13.744 -11.669 -19.349 1.00 44.03 O ATOM 0 H ASP A 108 13.554 -11.667 -15.112 1.00 71.24 H new ATOM 0 HA ASP A 108 15.472 -9.990 -16.536 1.00 2.23 H new ATOM 0 HB2 ASP A 108 12.847 -11.230 -17.028 1.00 64.02 H new ATOM 0 HB3 ASP A 108 12.911 -9.564 -17.568 1.00 64.02 H new ATOM 1595 N PRO A 109 14.420 -7.654 -16.184 1.00 34.43 N ATOM 1596 CA PRO A 109 14.095 -6.306 -15.708 1.00 64.30 C ATOM 1597 C PRO A 109 12.611 -5.986 -15.841 1.00 75.00 C ATOM 1598 O PRO A 109 12.035 -5.303 -14.995 1.00 74.12 O ATOM 1599 CB PRO A 109 14.922 -5.399 -16.623 1.00 21.03 C ATOM 1600 CG PRO A 109 15.119 -6.194 -17.867 1.00 64.20 C ATOM 1601 CD PRO A 109 15.201 -7.631 -17.432 1.00 21.14 C ATOM 0 HA PRO A 109 14.317 -6.183 -14.648 1.00 64.30 H new ATOM 0 HB2 PRO A 109 14.401 -4.464 -16.829 1.00 21.03 H new ATOM 0 HB3 PRO A 109 15.876 -5.138 -16.165 1.00 21.03 H new ATOM 0 HG2 PRO A 109 14.292 -6.043 -18.561 1.00 64.20 H new ATOM 0 HG3 PRO A 109 16.029 -5.890 -18.384 1.00 64.20 H new ATOM 0 HD2 PRO A 109 14.781 -8.302 -18.181 1.00 21.14 H new ATOM 0 HD3 PRO A 109 16.232 -7.943 -17.267 1.00 21.14 H new ATOM 1609 N GLY A 110 11.995 -6.485 -16.909 1.00 44.22 N ATOM 1610 CA GLY A 110 10.582 -6.241 -17.133 1.00 4.12 C ATOM 1611 C GLY A 110 9.699 -7.159 -16.311 1.00 53.44 C ATOM 1612 O GLY A 110 8.607 -6.771 -15.894 1.00 21.40 O ATOM 0 H GLY A 110 12.450 -7.054 -17.623 1.00 44.22 H new ATOM 0 HA2 GLY A 110 10.352 -5.204 -16.887 1.00 4.12 H new ATOM 0 HA3 GLY A 110 10.356 -6.376 -18.191 1.00 4.12 H new ATOM 1616 N VAL A 111 10.170 -8.380 -16.080 1.00 13.23 N ATOM 1617 CA VAL A 111 9.414 -9.356 -15.303 1.00 44.14 C ATOM 1618 C VAL A 111 9.459 -9.028 -13.815 1.00 51.23 C ATOM 1619 O VAL A 111 8.498 -9.274 -13.085 1.00 1.11 O ATOM 1620 CB VAL A 111 9.953 -10.783 -15.520 1.00 13.24 C ATOM 1621 CG1 VAL A 111 9.064 -11.801 -14.821 1.00 52.44 C ATOM 1622 CG2 VAL A 111 10.064 -11.090 -17.005 1.00 62.33 C ATOM 0 H VAL A 111 11.071 -8.717 -16.419 1.00 13.23 H new ATOM 0 HA VAL A 111 8.382 -9.308 -15.651 1.00 44.14 H new ATOM 0 HB VAL A 111 10.950 -10.847 -15.084 1.00 13.24 H new ATOM 0 HG11 VAL A 111 9.460 -12.803 -14.985 1.00 52.44 H new ATOM 0 HG12 VAL A 111 9.041 -11.590 -13.752 1.00 52.44 H new ATOM 0 HG13 VAL A 111 8.053 -11.740 -15.225 1.00 52.44 H new ATOM 0 HG21 VAL A 111 10.446 -12.102 -17.140 1.00 62.33 H new ATOM 0 HG22 VAL A 111 9.080 -11.009 -17.468 1.00 62.33 H new ATOM 0 HG23 VAL A 111 10.745 -10.379 -17.474 1.00 62.33 H new ATOM 1632 N LEU A 112 10.580 -8.470 -13.371 1.00 61.45 N ATOM 1633 CA LEU A 112 10.751 -8.107 -11.969 1.00 32.00 C ATOM 1634 C LEU A 112 9.957 -6.849 -11.632 1.00 11.10 C ATOM 1635 O LEU A 112 9.423 -6.716 -10.531 1.00 15.40 O ATOM 1636 CB LEU A 112 12.232 -7.889 -11.655 1.00 11.31 C ATOM 1637 CG LEU A 112 12.558 -7.452 -10.226 1.00 73.21 C ATOM 1638 CD1 LEU A 112 12.821 -8.663 -9.345 1.00 34.33 C ATOM 1639 CD2 LEU A 112 13.755 -6.513 -10.215 1.00 53.45 C ATOM 0 H LEU A 112 11.384 -8.259 -13.962 1.00 61.45 H new ATOM 0 HA LEU A 112 10.374 -8.927 -11.358 1.00 32.00 H new ATOM 0 HB2 LEU A 112 12.767 -8.816 -11.861 1.00 11.31 H new ATOM 0 HB3 LEU A 112 12.622 -7.137 -12.341 1.00 11.31 H new ATOM 0 HG LEU A 112 11.698 -6.916 -9.825 1.00 73.21 H new ATOM 0 HD11 LEU A 112 13.051 -8.333 -8.332 1.00 34.33 H new ATOM 0 HD12 LEU A 112 11.936 -9.299 -9.327 1.00 34.33 H new ATOM 0 HD13 LEU A 112 13.665 -9.227 -9.744 1.00 34.33 H new ATOM 0 HD21 LEU A 112 13.972 -6.212 -9.190 1.00 53.45 H new ATOM 0 HD22 LEU A 112 14.622 -7.023 -10.635 1.00 53.45 H new ATOM 0 HD23 LEU A 112 13.530 -5.629 -10.812 1.00 53.45 H new ATOM 1651 N VAL A 113 9.882 -5.929 -12.588 1.00 42.42 N ATOM 1652 CA VAL A 113 9.151 -4.682 -12.394 1.00 73.44 C ATOM 1653 C VAL A 113 7.652 -4.891 -12.577 1.00 35.15 C ATOM 1654 O VAL A 113 6.843 -4.321 -11.845 1.00 53.13 O ATOM 1655 CB VAL A 113 9.629 -3.593 -13.373 1.00 12.14 C ATOM 1656 CG1 VAL A 113 8.785 -2.336 -13.226 1.00 50.11 C ATOM 1657 CG2 VAL A 113 11.102 -3.285 -13.149 1.00 34.54 C ATOM 0 H VAL A 113 10.319 -6.023 -13.505 1.00 42.42 H new ATOM 0 HA VAL A 113 9.348 -4.354 -11.373 1.00 73.44 H new ATOM 0 HB VAL A 113 9.510 -3.965 -14.390 1.00 12.14 H new ATOM 0 HG11 VAL A 113 9.137 -1.578 -13.925 1.00 50.11 H new ATOM 0 HG12 VAL A 113 7.742 -2.571 -13.440 1.00 50.11 H new ATOM 0 HG13 VAL A 113 8.870 -1.958 -12.207 1.00 50.11 H new ATOM 0 HG21 VAL A 113 11.423 -2.514 -13.849 1.00 34.54 H new ATOM 0 HG22 VAL A 113 11.249 -2.932 -12.128 1.00 34.54 H new ATOM 0 HG23 VAL A 113 11.691 -4.188 -13.309 1.00 34.54 H new ATOM 1667 N GLU A 114 7.289 -5.713 -13.557 1.00 14.34 N ATOM 1668 CA GLU A 114 5.886 -5.996 -13.835 1.00 34.34 C ATOM 1669 C GLU A 114 5.275 -6.855 -12.730 1.00 52.45 C ATOM 1670 O GLU A 114 4.090 -6.731 -12.415 1.00 45.45 O ATOM 1671 CB GLU A 114 5.743 -6.704 -15.184 1.00 31.13 C ATOM 1672 CG GLU A 114 6.118 -8.176 -15.141 1.00 51.15 C ATOM 1673 CD GLU A 114 4.937 -9.070 -14.815 1.00 40.44 C ATOM 1674 OE1 GLU A 114 5.114 -10.306 -14.808 1.00 73.05 O ATOM 1675 OE2 GLU A 114 3.837 -8.533 -14.568 1.00 30.44 O ATOM 0 H GLU A 114 7.946 -6.194 -14.171 1.00 14.34 H new ATOM 0 HA GLU A 114 5.351 -5.047 -13.872 1.00 34.34 H new ATOM 0 HB2 GLU A 114 4.713 -6.610 -15.527 1.00 31.13 H new ATOM 0 HB3 GLU A 114 6.371 -6.199 -15.918 1.00 31.13 H new ATOM 0 HG2 GLU A 114 6.536 -8.469 -16.104 1.00 51.15 H new ATOM 0 HG3 GLU A 114 6.899 -8.326 -14.396 1.00 51.15 H new ATOM 1682 N LEU A 115 6.091 -7.725 -12.147 1.00 33.24 N ATOM 1683 CA LEU A 115 5.632 -8.605 -11.078 1.00 21.55 C ATOM 1684 C LEU A 115 5.383 -7.820 -9.794 1.00 44.41 C ATOM 1685 O LEU A 115 4.436 -8.096 -9.058 1.00 53.44 O ATOM 1686 CB LEU A 115 6.660 -9.709 -10.822 1.00 42.13 C ATOM 1687 CG LEU A 115 6.560 -10.941 -11.723 1.00 4.32 C ATOM 1688 CD1 LEU A 115 7.718 -11.891 -11.458 1.00 41.31 C ATOM 1689 CD2 LEU A 115 5.229 -11.648 -11.514 1.00 3.25 C ATOM 0 H LEU A 115 7.073 -7.840 -12.396 1.00 33.24 H new ATOM 0 HA LEU A 115 4.692 -9.058 -11.393 1.00 21.55 H new ATOM 0 HB2 LEU A 115 7.657 -9.282 -10.933 1.00 42.13 H new ATOM 0 HB3 LEU A 115 6.565 -10.033 -9.786 1.00 42.13 H new ATOM 0 HG LEU A 115 6.615 -10.614 -12.761 1.00 4.32 H new ATOM 0 HD11 LEU A 115 7.630 -12.762 -12.108 1.00 41.31 H new ATOM 0 HD12 LEU A 115 8.660 -11.381 -11.659 1.00 41.31 H new ATOM 0 HD13 LEU A 115 7.694 -12.212 -10.417 1.00 41.31 H new ATOM 0 HD21 LEU A 115 5.175 -12.522 -12.163 1.00 3.25 H new ATOM 0 HD22 LEU A 115 5.144 -11.963 -10.474 1.00 3.25 H new ATOM 0 HD23 LEU A 115 4.413 -10.966 -11.755 1.00 3.25 H new ATOM 1701 N VAL A 116 6.240 -6.837 -9.532 1.00 70.42 N ATOM 1702 CA VAL A 116 6.112 -6.009 -8.340 1.00 15.35 C ATOM 1703 C VAL A 116 5.098 -4.890 -8.554 1.00 43.01 C ATOM 1704 O VAL A 116 4.391 -4.493 -7.628 1.00 60.44 O ATOM 1705 CB VAL A 116 7.464 -5.391 -7.937 1.00 31.43 C ATOM 1706 CG1 VAL A 116 7.982 -4.477 -9.036 1.00 40.40 C ATOM 1707 CG2 VAL A 116 7.335 -4.638 -6.622 1.00 14.14 C ATOM 0 H VAL A 116 7.030 -6.596 -10.130 1.00 70.42 H new ATOM 0 HA VAL A 116 5.766 -6.661 -7.538 1.00 15.35 H new ATOM 0 HB VAL A 116 8.185 -6.197 -7.798 1.00 31.43 H new ATOM 0 HG11 VAL A 116 8.938 -4.050 -8.733 1.00 40.40 H new ATOM 0 HG12 VAL A 116 8.115 -5.050 -9.953 1.00 40.40 H new ATOM 0 HG13 VAL A 116 7.265 -3.675 -9.210 1.00 40.40 H new ATOM 0 HG21 VAL A 116 8.300 -4.208 -6.353 1.00 14.14 H new ATOM 0 HG22 VAL A 116 6.600 -3.841 -6.730 1.00 14.14 H new ATOM 0 HG23 VAL A 116 7.013 -5.325 -5.839 1.00 14.14 H new ATOM 1717 N ALA A 117 5.034 -4.385 -9.782 1.00 34.32 N ATOM 1718 CA ALA A 117 4.105 -3.314 -10.119 1.00 50.41 C ATOM 1719 C ALA A 117 2.686 -3.659 -9.682 1.00 34.05 C ATOM 1720 O ALA A 117 2.048 -2.901 -8.949 1.00 62.24 O ATOM 1721 CB ALA A 117 4.145 -3.032 -11.614 1.00 13.12 C ATOM 0 H ALA A 117 5.614 -4.701 -10.559 1.00 34.32 H new ATOM 0 HA ALA A 117 4.414 -2.417 -9.582 1.00 50.41 H new ATOM 0 HB1 ALA A 117 3.446 -2.230 -11.852 1.00 13.12 H new ATOM 0 HB2 ALA A 117 5.153 -2.732 -11.901 1.00 13.12 H new ATOM 0 HB3 ALA A 117 3.864 -3.932 -12.162 1.00 13.12 H new ATOM 1727 N THR A 118 2.194 -4.808 -10.135 1.00 25.20 N ATOM 1728 CA THR A 118 0.850 -5.253 -9.792 1.00 33.12 C ATOM 1729 C THR A 118 0.627 -5.218 -8.284 1.00 51.23 C ATOM 1730 O THR A 118 -0.484 -4.964 -7.816 1.00 42.32 O ATOM 1731 CB THR A 118 0.582 -6.680 -10.306 1.00 31.33 C ATOM 1732 OG1 THR A 118 -0.786 -7.036 -10.074 1.00 43.21 O ATOM 1733 CG2 THR A 118 1.495 -7.683 -9.618 1.00 24.53 C ATOM 0 H THR A 118 2.708 -5.448 -10.741 1.00 25.20 H new ATOM 0 HA THR A 118 0.157 -4.565 -10.275 1.00 33.12 H new ATOM 0 HB THR A 118 0.786 -6.701 -11.377 1.00 31.33 H new ATOM 0 HG1 THR A 118 -0.948 -7.944 -10.405 1.00 43.21 H new ATOM 0 HG21 THR A 118 1.287 -8.684 -9.997 1.00 24.53 H new ATOM 0 HG22 THR A 118 2.535 -7.427 -9.820 1.00 24.53 H new ATOM 0 HG23 THR A 118 1.318 -7.658 -8.543 1.00 24.53 H new ATOM 1741 N LEU A 119 1.689 -5.473 -7.528 1.00 34.41 N ATOM 1742 CA LEU A 119 1.609 -5.470 -6.071 1.00 61.13 C ATOM 1743 C LEU A 119 1.536 -4.045 -5.533 1.00 51.32 C ATOM 1744 O LEU A 119 0.850 -3.778 -4.546 1.00 44.53 O ATOM 1745 CB LEU A 119 2.818 -6.192 -5.473 1.00 50.22 C ATOM 1746 CG LEU A 119 3.128 -7.573 -6.050 1.00 71.52 C ATOM 1747 CD1 LEU A 119 4.278 -8.222 -5.295 1.00 51.41 C ATOM 1748 CD2 LEU A 119 1.892 -8.460 -6.006 1.00 14.43 C ATOM 0 H LEU A 119 2.615 -5.684 -7.899 1.00 34.41 H new ATOM 0 HA LEU A 119 0.699 -5.995 -5.780 1.00 61.13 H new ATOM 0 HB2 LEU A 119 3.696 -5.560 -5.606 1.00 50.22 H new ATOM 0 HB3 LEU A 119 2.659 -6.296 -4.400 1.00 50.22 H new ATOM 0 HG LEU A 119 3.427 -7.451 -7.091 1.00 71.52 H new ATOM 0 HD11 LEU A 119 4.484 -9.204 -5.720 1.00 51.41 H new ATOM 0 HD12 LEU A 119 5.167 -7.597 -5.378 1.00 51.41 H new ATOM 0 HD13 LEU A 119 4.008 -8.331 -4.245 1.00 51.41 H new ATOM 0 HD21 LEU A 119 2.132 -9.439 -6.421 1.00 14.43 H new ATOM 0 HD22 LEU A 119 1.563 -8.574 -4.973 1.00 14.43 H new ATOM 0 HD23 LEU A 119 1.095 -8.003 -6.592 1.00 14.43 H new ATOM 1760 N SER A 120 2.245 -3.133 -6.190 1.00 5.40 N ATOM 1761 CA SER A 120 2.262 -1.734 -5.777 1.00 24.33 C ATOM 1762 C SER A 120 0.954 -1.042 -6.148 1.00 64.22 C ATOM 1763 O SER A 120 0.309 -0.419 -5.306 1.00 20.31 O ATOM 1764 CB SER A 120 3.441 -1.004 -6.423 1.00 53.44 C ATOM 1765 OG SER A 120 3.275 -0.911 -7.828 1.00 11.04 O ATOM 0 H SER A 120 2.815 -3.337 -7.011 1.00 5.40 H new ATOM 0 HA SER A 120 2.374 -1.702 -4.693 1.00 24.33 H new ATOM 0 HB2 SER A 120 3.531 -0.005 -5.997 1.00 53.44 H new ATOM 0 HB3 SER A 120 4.368 -1.532 -6.197 1.00 53.44 H new ATOM 0 HG SER A 120 2.937 -1.763 -8.175 1.00 11.04 H new ATOM 1771 N GLU A 121 0.571 -1.157 -7.416 1.00 13.11 N ATOM 1772 CA GLU A 121 -0.660 -0.542 -7.900 1.00 4.44 C ATOM 1773 C GLU A 121 -1.641 -1.601 -8.392 1.00 63.43 C ATOM 1774 O GLU A 121 -1.256 -2.695 -8.807 1.00 41.35 O ATOM 1775 CB GLU A 121 -0.353 0.448 -9.026 1.00 23.04 C ATOM 1776 CG GLU A 121 0.286 -0.196 -10.244 1.00 64.04 C ATOM 1777 CD GLU A 121 -0.722 -0.517 -11.331 1.00 3.22 C ATOM 1778 OE1 GLU A 121 -0.732 -1.670 -11.810 1.00 44.32 O ATOM 1779 OE2 GLU A 121 -1.501 0.386 -11.701 1.00 53.01 O ATOM 0 H GLU A 121 1.094 -1.670 -8.126 1.00 13.11 H new ATOM 0 HA GLU A 121 -1.119 -0.006 -7.069 1.00 4.44 H new ATOM 0 HB2 GLU A 121 -1.278 0.940 -9.328 1.00 23.04 H new ATOM 0 HB3 GLU A 121 0.311 1.224 -8.645 1.00 23.04 H new ATOM 0 HG2 GLU A 121 1.048 0.472 -10.646 1.00 64.04 H new ATOM 0 HG3 GLU A 121 0.793 -1.112 -9.942 1.00 64.04 H new ATOM 1786 N PRO A 122 -2.940 -1.272 -8.345 1.00 50.44 N ATOM 1787 CA PRO A 122 -4.004 -2.181 -8.783 1.00 3.43 C ATOM 1788 C PRO A 122 -4.009 -2.382 -10.294 1.00 63.42 C ATOM 1789 O PRO A 122 -3.256 -1.733 -11.019 1.00 50.41 O ATOM 1790 CB PRO A 122 -5.284 -1.471 -8.334 1.00 5.03 C ATOM 1791 CG PRO A 122 -4.916 -0.028 -8.275 1.00 31.41 C ATOM 1792 CD PRO A 122 -3.471 0.014 -7.862 1.00 43.24 C ATOM 0 HA PRO A 122 -3.885 -3.180 -8.364 1.00 3.43 H new ATOM 0 HB2 PRO A 122 -6.099 -1.643 -9.036 1.00 5.03 H new ATOM 0 HB3 PRO A 122 -5.618 -1.834 -7.362 1.00 5.03 H new ATOM 0 HG2 PRO A 122 -5.059 0.451 -9.243 1.00 31.41 H new ATOM 0 HG3 PRO A 122 -5.542 0.506 -7.560 1.00 31.41 H new ATOM 0 HD2 PRO A 122 -2.949 0.859 -8.312 1.00 43.24 H new ATOM 0 HD3 PRO A 122 -3.365 0.112 -6.782 1.00 43.24 H new ATOM 1800 N ALA A 123 -4.862 -3.287 -10.763 1.00 13.21 N ATOM 1801 CA ALA A 123 -4.967 -3.572 -12.189 1.00 3.15 C ATOM 1802 C ALA A 123 -5.165 -2.291 -12.992 1.00 11.15 C ATOM 1803 O ALA A 123 -5.734 -1.318 -12.496 1.00 64.40 O ATOM 1804 CB ALA A 123 -6.108 -4.543 -12.450 1.00 71.43 C ATOM 0 H ALA A 123 -5.490 -3.835 -10.176 1.00 13.21 H new ATOM 0 HA ALA A 123 -4.033 -4.031 -12.512 1.00 3.15 H new ATOM 0 HB1 ALA A 123 -6.175 -4.747 -13.519 1.00 71.43 H new ATOM 0 HB2 ALA A 123 -5.923 -5.474 -11.914 1.00 71.43 H new ATOM 0 HB3 ALA A 123 -7.045 -4.105 -12.105 1.00 71.43 H new ATOM 1810 N ALA A 124 -4.692 -2.297 -14.234 1.00 33.35 N ATOM 1811 CA ALA A 124 -4.819 -1.136 -15.105 1.00 52.03 C ATOM 1812 C ALA A 124 -4.304 -1.443 -16.507 1.00 73.14 C ATOM 1813 O ALA A 124 -3.632 -0.619 -17.126 1.00 72.21 O ATOM 1814 CB ALA A 124 -4.073 0.051 -14.515 1.00 44.20 C ATOM 0 H ALA A 124 -4.217 -3.093 -14.659 1.00 33.35 H new ATOM 0 HA ALA A 124 -5.877 -0.884 -15.182 1.00 52.03 H new ATOM 0 HB1 ALA A 124 -4.177 0.911 -15.176 1.00 44.20 H new ATOM 0 HB2 ALA A 124 -4.489 0.293 -13.537 1.00 44.20 H new ATOM 0 HB3 ALA A 124 -3.018 -0.199 -14.408 1.00 44.20 H new ATOM 1820 N ASN A 125 -4.624 -2.634 -17.002 1.00 61.53 N ATOM 1821 CA ASN A 125 -4.192 -3.051 -18.332 1.00 0.33 C ATOM 1822 C ASN A 125 -4.581 -2.013 -19.380 1.00 13.21 C ATOM 1823 O ASN A 125 -4.007 -1.970 -20.468 1.00 13.12 O ATOM 1824 CB ASN A 125 -4.804 -4.407 -18.688 1.00 54.33 C ATOM 1825 CG ASN A 125 -4.531 -5.460 -17.632 1.00 73.22 C ATOM 1826 OD1 ASN A 125 -3.403 -5.931 -17.486 1.00 51.31 O ATOM 1827 ND2 ASN A 125 -5.566 -5.836 -16.890 1.00 13.32 N ATOM 0 H ASN A 125 -5.181 -3.328 -16.503 1.00 61.53 H new ATOM 0 HA ASN A 125 -3.106 -3.142 -18.323 1.00 0.33 H new ATOM 0 HB2 ASN A 125 -5.881 -4.294 -18.815 1.00 54.33 H new ATOM 0 HB3 ASN A 125 -4.404 -4.743 -19.644 1.00 54.33 H new ATOM 0 HD21 ASN A 125 -5.443 -6.542 -16.164 1.00 13.32 H new ATOM 0 HD22 ASN A 125 -6.484 -5.419 -17.046 1.00 13.32 H new TER 1834 ASN A 125