USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1050 hydrogens (6 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 NoAdj-H: A 15 TPO H2 : A 15 TPO N : A 14 THR C :(H bumps) USER MOD NoAdj-H: A 15 TPO H : A 15 TPO N : A 14 THR C :(H bumps) USER MOD Set 1.1: A 89 HIS : no HE2:sc= -1.33 K(o=-0.25,f=-5!) USER MOD Set 1.2: A 110 THR OG1 : rot 65:sc= 1.08 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -173:sc= -0.0032 (180deg=-0.0939) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 5 ASN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.0101 K(o=-0.01,f=-0.63) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl 160:sc= -0.0906 (180deg=-0.57) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 31:sc= -0.614! USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= -0.241 K(o=-0.24,f=-1.5!) USER MOD Single : A 46 SER OG : rot 180:sc= -0.0239 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 1.02 K(o=1,f=-2.2!) USER MOD Single : A 65 GLN : amide:sc= -0.737 X(o=-0.74,f=-0.75) USER MOD Single : A 67 THR OG1 : rot 180:sc=-0.00716 USER MOD Single : A 68 THR OG1 : rot -140:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 HIS : no HD1:sc= -0.346 X(o=-0.35,f=-0.0042) USER MOD Single : A 76 SER OG : rot -163:sc= -3.31! USER MOD Single : A 84 THR OG1 : rot 91:sc= 1.22 USER MOD Single : A 86 SER OG : rot -99:sc= 0.408 USER MOD Single : A 95 ASN :FLIP amide:sc= -0.231 F(o=-1.5,f=-0.23) USER MOD Single : A 106 SER OG : rot -17:sc= 1.19 USER MOD Single : A 108 ASN : amide:sc=-0.00272 K(o=-0.0027,f=-1.5) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -0.77! C(o=-0.77!,f=-6.8!) USER MOD Single : A 118 ASN : amide:sc= 0.135 K(o=0.13,f=-6.1!) USER MOD Single : A 120 GLN : amide:sc= -0.806 K(o=-0.81,f=-5.2!) USER MOD Single : A 122 MET CE :methyl -156:sc= -0.865 (180deg=-1.57) USER MOD Single : A 123 GLN : amide:sc= 1.16 K(o=1.2,f=-0.1) USER MOD Single : A 124 THR OG1 : rot -170:sc= 0.837 USER MOD Single : A 129 GLN : amide:sc= 0.573 K(o=0.57,f=-0.78) USER MOD Single : A 132 LYS NZ :NH3+ -167:sc= 1.3 (180deg=1.02) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.108 -20.131 29.064 1.00 11.00 N ATOM 2 CA MET A 1 14.369 -19.617 27.731 1.00 43.05 C ATOM 3 C MET A 1 13.511 -18.405 27.500 1.00 14.14 C ATOM 4 O MET A 1 12.295 -18.483 27.572 1.00 34.23 O ATOM 5 CB MET A 1 14.060 -20.678 26.665 1.00 1.45 C ATOM 6 CG MET A 1 14.887 -21.944 26.792 1.00 53.32 C ATOM 7 SD MET A 1 16.651 -21.630 26.675 1.00 65.50 S ATOM 8 CE MET A 1 17.288 -23.290 26.899 1.00 60.43 C ATOM 0 H1 MET A 1 14.779 -20.896 29.279 1.00 11.00 H new ATOM 0 H2 MET A 1 14.221 -19.366 29.759 1.00 11.00 H new ATOM 0 H3 MET A 1 13.137 -20.500 29.110 1.00 11.00 H new ATOM 0 HA MET A 1 15.424 -19.353 27.654 1.00 43.05 H new ATOM 0 HB2 MET A 1 13.004 -20.940 26.724 1.00 1.45 H new ATOM 0 HB3 MET A 1 14.227 -20.246 25.678 1.00 1.45 H new ATOM 0 HG2 MET A 1 14.669 -22.422 27.747 1.00 53.32 H new ATOM 0 HG3 MET A 1 14.594 -22.645 26.011 1.00 53.32 H new ATOM 0 HE1 MET A 1 18.377 -23.271 26.853 1.00 60.43 H new ATOM 0 HE2 MET A 1 16.972 -23.673 27.869 1.00 60.43 H new ATOM 0 HE3 MET A 1 16.903 -23.937 26.111 1.00 60.43 H new ATOM 20 N SER A 2 14.125 -17.292 27.275 1.00 55.04 N ATOM 21 CA SER A 2 13.416 -16.078 27.016 1.00 14.22 C ATOM 22 C SER A 2 13.735 -15.615 25.612 1.00 31.42 C ATOM 23 O SER A 2 14.908 -15.630 25.210 1.00 31.52 O ATOM 24 CB SER A 2 13.853 -15.026 28.026 1.00 21.10 C ATOM 25 OG SER A 2 13.690 -15.518 29.350 1.00 0.40 O ATOM 0 H SER A 2 15.140 -17.195 27.265 1.00 55.04 H new ATOM 0 HA SER A 2 12.342 -16.238 27.107 1.00 14.22 H new ATOM 0 HB2 SER A 2 14.896 -14.759 27.855 1.00 21.10 H new ATOM 0 HB3 SER A 2 13.265 -14.118 27.893 1.00 21.10 H new ATOM 0 HG SER A 2 13.976 -14.834 29.991 1.00 0.40 H new ATOM 31 N ASP A 3 12.719 -15.252 24.853 1.00 63.24 N ATOM 32 CA ASP A 3 12.931 -14.745 23.511 1.00 22.32 C ATOM 33 C ASP A 3 13.414 -13.317 23.618 1.00 63.15 C ATOM 34 O ASP A 3 12.626 -12.367 23.721 1.00 55.10 O ATOM 35 CB ASP A 3 11.663 -14.823 22.649 1.00 14.34 C ATOM 36 CG ASP A 3 11.925 -14.490 21.183 1.00 75.33 C ATOM 37 OD1 ASP A 3 12.237 -15.414 20.406 1.00 60.44 O ATOM 38 OD2 ASP A 3 11.815 -13.313 20.771 1.00 34.43 O ATOM 0 H ASP A 3 11.742 -15.298 25.141 1.00 63.24 H new ATOM 0 HA ASP A 3 13.676 -15.367 23.015 1.00 22.32 H new ATOM 0 HB2 ASP A 3 11.242 -15.826 22.720 1.00 14.34 H new ATOM 0 HB3 ASP A 3 10.916 -14.135 23.046 1.00 14.34 H new ATOM 43 N ASN A 4 14.696 -13.188 23.719 1.00 21.14 N ATOM 44 CA ASN A 4 15.339 -11.918 23.872 1.00 72.34 C ATOM 45 C ASN A 4 15.609 -11.333 22.502 1.00 14.32 C ATOM 46 O ASN A 4 16.687 -11.527 21.916 1.00 12.24 O ATOM 47 CB ASN A 4 16.636 -12.081 24.680 1.00 60.14 C ATOM 48 CG ASN A 4 17.338 -10.776 24.975 1.00 60.25 C ATOM 49 OD1 ASN A 4 16.710 -9.726 25.123 1.00 64.32 O ATOM 50 ND2 ASN A 4 18.634 -10.828 25.078 1.00 53.51 N ATOM 0 H ASN A 4 15.342 -13.977 23.697 1.00 21.14 H new ATOM 0 HA ASN A 4 14.692 -11.233 24.420 1.00 72.34 H new ATOM 0 HB2 ASN A 4 16.406 -12.580 25.621 1.00 60.14 H new ATOM 0 HB3 ASN A 4 17.316 -12.733 24.131 1.00 60.14 H new ATOM 0 HD21 ASN A 4 19.163 -9.982 25.288 1.00 53.51 H new ATOM 0 HD22 ASN A 4 19.121 -11.715 24.949 1.00 53.51 H new ATOM 57 N ASN A 5 14.594 -10.704 21.962 1.00 60.12 N ATOM 58 CA ASN A 5 14.645 -10.116 20.633 1.00 21.32 C ATOM 59 C ASN A 5 15.536 -8.880 20.641 1.00 53.43 C ATOM 60 O ASN A 5 15.559 -8.134 21.632 1.00 40.11 O ATOM 61 CB ASN A 5 13.224 -9.742 20.167 1.00 30.35 C ATOM 62 CG ASN A 5 13.164 -9.357 18.695 1.00 34.13 C ATOM 63 OD1 ASN A 5 13.943 -9.854 17.887 1.00 74.23 O ATOM 64 ND2 ASN A 5 12.240 -8.510 18.336 1.00 13.45 N ATOM 0 H ASN A 5 13.697 -10.581 22.432 1.00 60.12 H new ATOM 0 HA ASN A 5 15.063 -10.846 19.940 1.00 21.32 H new ATOM 0 HB2 ASN A 5 12.556 -10.585 20.344 1.00 30.35 H new ATOM 0 HB3 ASN A 5 12.857 -8.911 20.770 1.00 30.35 H new ATOM 0 HD21 ASN A 5 12.148 -8.241 17.356 1.00 13.45 H new ATOM 0 HD22 ASN A 5 11.610 -8.117 19.035 1.00 13.45 H new ATOM 71 N GLY A 6 16.293 -8.694 19.577 1.00 12.25 N ATOM 72 CA GLY A 6 17.166 -7.542 19.461 1.00 72.44 C ATOM 73 C GLY A 6 16.373 -6.265 19.316 1.00 52.44 C ATOM 74 O GLY A 6 15.606 -6.116 18.364 1.00 1.41 O ATOM 0 H GLY A 6 16.321 -9.328 18.778 1.00 12.25 H new ATOM 0 HA2 GLY A 6 17.805 -7.478 20.341 1.00 72.44 H new ATOM 0 HA3 GLY A 6 17.822 -7.665 18.599 1.00 72.44 H new ATOM 78 N THR A 7 16.560 -5.357 20.242 1.00 4.13 N ATOM 79 CA THR A 7 15.815 -4.123 20.282 1.00 20.41 C ATOM 80 C THR A 7 16.500 -2.993 19.461 1.00 70.45 C ATOM 81 O THR A 7 17.620 -2.557 19.785 1.00 33.25 O ATOM 82 CB THR A 7 15.556 -3.680 21.770 1.00 44.42 C ATOM 83 OG1 THR A 7 14.865 -2.427 21.834 1.00 53.21 O ATOM 84 CG2 THR A 7 16.847 -3.605 22.593 1.00 73.40 C ATOM 0 H THR A 7 17.240 -5.455 20.996 1.00 4.13 H new ATOM 0 HA THR A 7 14.851 -4.308 19.808 1.00 20.41 H new ATOM 0 HB THR A 7 14.925 -4.453 22.208 1.00 44.42 H new ATOM 0 HG1 THR A 7 14.718 -2.182 22.771 1.00 53.21 H new ATOM 0 HG21 THR A 7 16.612 -3.295 23.611 1.00 73.40 H new ATOM 0 HG22 THR A 7 17.323 -4.585 22.613 1.00 73.40 H new ATOM 0 HG23 THR A 7 17.525 -2.881 22.141 1.00 73.40 H new ATOM 92 N PRO A 8 15.866 -2.561 18.344 1.00 44.15 N ATOM 93 CA PRO A 8 16.339 -1.421 17.561 1.00 21.24 C ATOM 94 C PRO A 8 15.925 -0.103 18.232 1.00 11.11 C ATOM 95 O PRO A 8 14.894 -0.052 18.926 1.00 62.44 O ATOM 96 CB PRO A 8 15.611 -1.569 16.206 1.00 62.43 C ATOM 97 CG PRO A 8 14.815 -2.836 16.298 1.00 23.21 C ATOM 98 CD PRO A 8 14.653 -3.139 17.755 1.00 5.33 C ATOM 0 HA PRO A 8 17.424 -1.403 17.463 1.00 21.24 H new ATOM 0 HB2 PRO A 8 14.962 -0.714 16.017 1.00 62.43 H new ATOM 0 HB3 PRO A 8 16.324 -1.616 15.383 1.00 62.43 H new ATOM 0 HG2 PRO A 8 13.844 -2.718 15.817 1.00 23.21 H new ATOM 0 HG3 PRO A 8 15.327 -3.652 15.788 1.00 23.21 H new ATOM 0 HD2 PRO A 8 13.750 -2.687 18.164 1.00 5.33 H new ATOM 0 HD3 PRO A 8 14.585 -4.211 17.940 1.00 5.33 H new ATOM 106 N GLU A 9 16.705 0.938 18.069 1.00 23.52 N ATOM 107 CA GLU A 9 16.349 2.221 18.634 1.00 73.21 C ATOM 108 C GLU A 9 15.866 3.155 17.515 1.00 2.13 C ATOM 109 O GLU A 9 16.549 3.325 16.509 1.00 14.33 O ATOM 110 CB GLU A 9 17.520 2.816 19.434 1.00 33.14 C ATOM 111 CG GLU A 9 18.008 1.888 20.544 1.00 33.43 C ATOM 112 CD GLU A 9 19.082 2.486 21.416 1.00 65.31 C ATOM 113 OE1 GLU A 9 20.291 2.374 21.088 1.00 12.23 O ATOM 114 OE2 GLU A 9 18.747 3.047 22.481 1.00 51.53 O ATOM 0 H GLU A 9 17.585 0.925 17.554 1.00 23.52 H new ATOM 0 HA GLU A 9 15.530 2.093 19.342 1.00 73.21 H new ATOM 0 HB2 GLU A 9 18.346 3.030 18.756 1.00 33.14 H new ATOM 0 HB3 GLU A 9 17.211 3.766 19.870 1.00 33.14 H new ATOM 0 HG2 GLU A 9 17.160 1.609 21.170 1.00 33.43 H new ATOM 0 HG3 GLU A 9 18.388 0.970 20.095 1.00 33.43 H new ATOM 121 N PRO A 10 14.663 3.732 17.659 1.00 54.31 N ATOM 122 CA PRO A 10 14.047 4.567 16.620 1.00 12.31 C ATOM 123 C PRO A 10 14.776 5.898 16.371 1.00 53.51 C ATOM 124 O PRO A 10 15.432 6.463 17.262 1.00 3.04 O ATOM 125 CB PRO A 10 12.631 4.819 17.147 1.00 12.13 C ATOM 126 CG PRO A 10 12.744 4.660 18.620 1.00 64.13 C ATOM 127 CD PRO A 10 13.799 3.617 18.848 1.00 22.01 C ATOM 0 HA PRO A 10 14.081 4.065 15.653 1.00 12.31 H new ATOM 0 HB2 PRO A 10 12.281 5.817 16.882 1.00 12.13 H new ATOM 0 HB3 PRO A 10 11.919 4.109 16.725 1.00 12.13 H new ATOM 0 HG2 PRO A 10 13.019 5.602 19.093 1.00 64.13 H new ATOM 0 HG3 PRO A 10 11.792 4.352 19.053 1.00 64.13 H new ATOM 0 HD2 PRO A 10 14.355 3.803 19.767 1.00 22.01 H new ATOM 0 HD3 PRO A 10 13.366 2.621 18.934 1.00 22.01 H new ATOM 135 N GLN A 11 14.646 6.377 15.159 1.00 31.33 N ATOM 136 CA GLN A 11 15.239 7.623 14.717 1.00 43.52 C ATOM 137 C GLN A 11 14.117 8.603 14.420 1.00 24.23 C ATOM 138 O GLN A 11 12.957 8.193 14.270 1.00 44.04 O ATOM 139 CB GLN A 11 16.061 7.383 13.446 1.00 74.33 C ATOM 140 CG GLN A 11 17.220 6.414 13.625 1.00 62.01 C ATOM 141 CD GLN A 11 18.304 6.945 14.539 1.00 3.21 C ATOM 142 OE1 GLN A 11 18.538 8.154 14.623 1.00 50.34 O ATOM 143 NE2 GLN A 11 18.975 6.067 15.216 1.00 41.50 N ATOM 0 H GLN A 11 14.112 5.902 14.431 1.00 31.33 H new ATOM 0 HA GLN A 11 15.896 8.022 15.490 1.00 43.52 H new ATOM 0 HB2 GLN A 11 15.401 7.002 12.667 1.00 74.33 H new ATOM 0 HB3 GLN A 11 16.452 8.338 13.094 1.00 74.33 H new ATOM 0 HG2 GLN A 11 16.841 5.475 14.028 1.00 62.01 H new ATOM 0 HG3 GLN A 11 17.653 6.191 12.650 1.00 62.01 H new ATOM 0 HE21 GLN A 11 18.756 5.075 15.123 1.00 41.50 H new ATOM 0 HE22 GLN A 11 19.722 6.368 15.842 1.00 41.50 H new ATOM 152 N VAL A 12 14.432 9.868 14.327 1.00 64.12 N ATOM 153 CA VAL A 12 13.434 10.882 14.042 1.00 35.11 C ATOM 154 C VAL A 12 13.914 11.711 12.863 1.00 25.51 C ATOM 155 O VAL A 12 15.104 12.038 12.769 1.00 2.00 O ATOM 156 CB VAL A 12 13.159 11.814 15.274 1.00 12.25 C ATOM 157 CG1 VAL A 12 12.070 12.839 14.960 1.00 22.32 C ATOM 158 CG2 VAL A 12 12.764 10.999 16.503 1.00 60.13 C ATOM 0 H VAL A 12 15.379 10.229 14.445 1.00 64.12 H new ATOM 0 HA VAL A 12 12.494 10.382 13.809 1.00 35.11 H new ATOM 0 HB VAL A 12 14.086 12.346 15.490 1.00 12.25 H new ATOM 0 HG11 VAL A 12 11.902 13.470 15.833 1.00 22.32 H new ATOM 0 HG12 VAL A 12 12.384 13.458 14.120 1.00 22.32 H new ATOM 0 HG13 VAL A 12 11.146 12.321 14.703 1.00 22.32 H new ATOM 0 HG21 VAL A 12 12.580 11.671 17.341 1.00 60.13 H new ATOM 0 HG22 VAL A 12 11.859 10.431 16.287 1.00 60.13 H new ATOM 0 HG23 VAL A 12 13.571 10.313 16.759 1.00 60.13 H new ATOM 168 N GLU A 13 13.023 12.016 11.964 1.00 52.12 N ATOM 169 CA GLU A 13 13.357 12.773 10.803 1.00 14.44 C ATOM 170 C GLU A 13 12.570 14.061 10.742 1.00 44.40 C ATOM 171 O GLU A 13 11.617 14.261 11.506 1.00 30.41 O ATOM 172 CB GLU A 13 13.168 11.942 9.540 1.00 24.52 C ATOM 173 CG GLU A 13 14.479 11.576 8.845 1.00 42.33 C ATOM 174 CD GLU A 13 15.188 12.783 8.253 1.00 63.10 C ATOM 175 OE1 GLU A 13 15.473 13.752 8.987 1.00 53.31 O ATOM 176 OE2 GLU A 13 15.437 12.800 7.034 1.00 72.43 O ATOM 0 H GLU A 13 12.042 11.743 12.020 1.00 52.12 H new ATOM 0 HA GLU A 13 14.411 13.041 10.869 1.00 14.44 H new ATOM 0 HB2 GLU A 13 12.634 11.027 9.794 1.00 24.52 H new ATOM 0 HB3 GLU A 13 12.539 12.495 8.842 1.00 24.52 H new ATOM 0 HG2 GLU A 13 15.140 11.087 9.560 1.00 42.33 H new ATOM 0 HG3 GLU A 13 14.276 10.855 8.053 1.00 42.33 H new ATOM 183 N THR A 14 12.972 14.931 9.850 1.00 74.43 N ATOM 184 CA THR A 14 12.327 16.202 9.696 1.00 43.52 C ATOM 185 C THR A 14 10.932 16.037 9.091 1.00 73.13 C ATOM 186 O THR A 14 10.764 15.626 7.950 1.00 31.43 O ATOM 187 CB THR A 14 13.180 17.168 8.850 1.00 64.24 C ATOM 188 OG1 THR A 14 14.473 17.314 9.465 1.00 64.21 O ATOM 189 CG2 THR A 14 12.523 18.542 8.752 1.00 12.03 C ATOM 0 H THR A 14 13.754 14.775 9.214 1.00 74.43 H new ATOM 0 HA THR A 14 12.219 16.638 10.689 1.00 43.52 H new ATOM 0 HB THR A 14 13.274 16.755 7.846 1.00 64.24 H new ATOM 0 HG1 THR A 14 15.022 17.926 8.931 1.00 64.21 H new ATOM 0 HG21 THR A 14 13.147 19.202 8.150 1.00 12.03 H new ATOM 0 HG22 THR A 14 11.543 18.444 8.285 1.00 12.03 H new ATOM 0 HG23 THR A 14 12.409 18.963 9.751 1.00 12.03 H new HETATM 197 N TPO A 15 9.960 16.326 9.879 1.00 33.10 N HETATM 198 CA TPO A 15 8.596 16.234 9.482 1.00 71.01 C HETATM 199 CB TPO A 15 7.855 15.132 10.282 1.00 21.12 C HETATM 200 CG2 TPO A 15 6.503 14.821 9.653 1.00 24.03 C HETATM 201 OG1 TPO A 15 8.604 13.887 10.270 1.00 13.21 O HETATM 202 P TPO A 15 8.553 12.784 11.467 1.00 74.34 P HETATM 203 O1P TPO A 15 8.639 13.485 12.825 1.00 23.13 O HETATM 204 O2P TPO A 15 9.735 11.818 11.379 1.00 54.12 O HETATM 205 O3P TPO A 15 7.223 11.996 11.372 1.00 71.15 O HETATM 206 C TPO A 15 7.947 17.568 9.802 1.00 34.14 C HETATM 207 O TPO A 15 8.216 18.139 10.855 1.00 13.45 O HETATM 0 HG23 TPO A 15 5.889 15.722 9.646 1.00 24.03 H new HETATM 0 HG22 TPO A 15 6.649 14.473 8.630 1.00 24.03 H new HETATM 0 HG21 TPO A 15 6.002 14.045 10.232 1.00 24.03 H new HETATM 0 HB TPO A 15 7.740 15.511 11.297 1.00 21.12 H new HETATM 0 HA TPO A 15 8.541 15.989 8.421 1.00 71.01 H new ATOM 214 N SER A 16 7.145 18.079 8.911 1.00 4.34 N ATOM 215 CA SER A 16 6.430 19.293 9.185 1.00 74.42 C ATOM 216 C SER A 16 5.117 18.887 9.843 1.00 24.10 C ATOM 217 O SER A 16 4.621 17.774 9.602 1.00 45.40 O ATOM 218 CB SER A 16 6.181 20.071 7.874 1.00 14.24 C ATOM 219 OG SER A 16 5.574 21.332 8.110 1.00 21.55 O ATOM 0 H SER A 16 6.970 17.675 7.991 1.00 4.34 H new ATOM 0 HA SER A 16 6.998 19.951 9.843 1.00 74.42 H new ATOM 0 HB2 SER A 16 7.128 20.216 7.354 1.00 14.24 H new ATOM 0 HB3 SER A 16 5.544 19.479 7.217 1.00 14.24 H new ATOM 0 HG SER A 16 5.435 21.793 7.256 1.00 21.55 H new ATOM 225 N VAL A 17 4.589 19.719 10.698 1.00 70.34 N ATOM 226 CA VAL A 17 3.352 19.401 11.349 1.00 11.32 C ATOM 227 C VAL A 17 2.228 19.797 10.418 1.00 41.34 C ATOM 228 O VAL A 17 2.069 20.974 10.074 1.00 3.23 O ATOM 229 CB VAL A 17 3.202 20.109 12.718 1.00 3.13 C ATOM 230 CG1 VAL A 17 1.940 19.640 13.421 1.00 23.24 C ATOM 231 CG2 VAL A 17 4.418 19.851 13.593 1.00 32.13 C ATOM 0 H VAL A 17 4.995 20.618 10.958 1.00 70.34 H new ATOM 0 HA VAL A 17 3.326 18.332 11.560 1.00 11.32 H new ATOM 0 HB VAL A 17 3.126 21.182 12.541 1.00 3.13 H new ATOM 0 HG11 VAL A 17 1.849 20.147 14.382 1.00 23.24 H new ATOM 0 HG12 VAL A 17 1.072 19.873 12.804 1.00 23.24 H new ATOM 0 HG13 VAL A 17 1.992 18.563 13.582 1.00 23.24 H new ATOM 0 HG21 VAL A 17 4.292 20.357 14.550 1.00 32.13 H new ATOM 0 HG22 VAL A 17 4.525 18.779 13.761 1.00 32.13 H new ATOM 0 HG23 VAL A 17 5.311 20.231 13.096 1.00 32.13 H new ATOM 241 N PHE A 18 1.497 18.824 9.986 1.00 34.24 N ATOM 242 CA PHE A 18 0.460 19.014 9.014 1.00 61.13 C ATOM 243 C PHE A 18 -0.848 19.342 9.710 1.00 21.35 C ATOM 244 O PHE A 18 -1.155 18.780 10.772 1.00 62.34 O ATOM 245 CB PHE A 18 0.342 17.730 8.203 1.00 34.33 C ATOM 246 CG PHE A 18 -0.571 17.771 7.012 1.00 3.33 C ATOM 247 CD1 PHE A 18 -0.202 18.449 5.862 1.00 61.31 C ATOM 248 CD2 PHE A 18 -1.774 17.085 7.023 1.00 30.50 C ATOM 249 CE1 PHE A 18 -1.017 18.445 4.749 1.00 32.10 C ATOM 250 CE2 PHE A 18 -2.595 17.084 5.916 1.00 33.31 C ATOM 251 CZ PHE A 18 -2.215 17.764 4.776 1.00 55.12 C ATOM 0 H PHE A 18 1.601 17.859 10.300 1.00 34.24 H new ATOM 0 HA PHE A 18 0.697 19.847 8.352 1.00 61.13 H new ATOM 0 HB2 PHE A 18 1.338 17.451 7.860 1.00 34.33 H new ATOM 0 HB3 PHE A 18 -0.000 16.937 8.868 1.00 34.33 H new ATOM 0 HD1 PHE A 18 0.734 18.987 5.836 1.00 61.31 H new ATOM 0 HD2 PHE A 18 -2.072 16.545 7.909 1.00 30.50 H new ATOM 0 HE1 PHE A 18 -0.717 18.975 3.857 1.00 32.10 H new ATOM 0 HE2 PHE A 18 -3.535 16.552 5.940 1.00 33.31 H new ATOM 0 HZ PHE A 18 -2.856 17.762 3.907 1.00 55.12 H new ATOM 261 N ARG A 19 -1.596 20.260 9.153 1.00 1.30 N ATOM 262 CA ARG A 19 -2.882 20.603 9.710 1.00 53.23 C ATOM 263 C ARG A 19 -3.894 19.590 9.241 1.00 22.44 C ATOM 264 O ARG A 19 -3.956 19.263 8.051 1.00 14.34 O ATOM 265 CB ARG A 19 -3.312 22.015 9.314 1.00 21.23 C ATOM 266 CG ARG A 19 -2.382 23.115 9.795 1.00 73.15 C ATOM 267 CD ARG A 19 -2.154 23.070 11.304 1.00 41.20 C ATOM 268 NE ARG A 19 -3.395 23.172 12.085 1.00 64.13 N ATOM 269 CZ ARG A 19 -3.477 23.662 13.328 1.00 20.10 C ATOM 270 NH1 ARG A 19 -2.402 24.164 13.928 1.00 70.14 N ATOM 271 NH2 ARG A 19 -4.634 23.645 13.977 1.00 73.33 N ATOM 0 H ARG A 19 -1.339 20.783 8.316 1.00 1.30 H new ATOM 0 HA ARG A 19 -2.812 20.587 10.798 1.00 53.23 H new ATOM 0 HB2 ARG A 19 -3.385 22.068 8.228 1.00 21.23 H new ATOM 0 HB3 ARG A 19 -4.310 22.202 9.710 1.00 21.23 H new ATOM 0 HG2 ARG A 19 -1.424 23.026 9.283 1.00 73.15 H new ATOM 0 HG3 ARG A 19 -2.800 24.084 9.523 1.00 73.15 H new ATOM 0 HD2 ARG A 19 -1.648 22.139 11.560 1.00 41.20 H new ATOM 0 HD3 ARG A 19 -1.487 23.884 11.588 1.00 41.20 H new ATOM 0 HE ARG A 19 -4.257 22.846 11.648 1.00 64.13 H new ATOM 0 HH11 ARG A 19 -1.506 24.178 13.441 1.00 70.14 H new ATOM 0 HH12 ARG A 19 -2.473 24.535 14.875 1.00 70.14 H new ATOM 0 HH21 ARG A 19 -5.464 23.258 13.529 1.00 73.33 H new ATOM 0 HH22 ARG A 19 -4.693 24.019 14.924 1.00 73.33 H new ATOM 285 N ALA A 20 -4.670 19.082 10.150 1.00 41.12 N ATOM 286 CA ALA A 20 -5.600 18.043 9.834 1.00 64.13 C ATOM 287 C ALA A 20 -6.918 18.584 9.309 1.00 3.42 C ATOM 288 O ALA A 20 -7.957 18.481 9.962 1.00 3.14 O ATOM 289 CB ALA A 20 -5.807 17.097 11.009 1.00 3.13 C ATOM 0 H ALA A 20 -4.676 19.375 11.127 1.00 41.12 H new ATOM 0 HA ALA A 20 -5.157 17.464 9.023 1.00 64.13 H new ATOM 0 HB1 ALA A 20 -6.520 16.321 10.730 1.00 3.13 H new ATOM 0 HB2 ALA A 20 -4.856 16.636 11.277 1.00 3.13 H new ATOM 0 HB3 ALA A 20 -6.193 17.655 11.862 1.00 3.13 H new ATOM 295 N ASP A 21 -6.866 19.190 8.140 1.00 63.21 N ATOM 296 CA ASP A 21 -8.075 19.648 7.456 1.00 52.25 C ATOM 297 C ASP A 21 -8.744 18.439 6.837 1.00 44.21 C ATOM 298 O ASP A 21 -9.927 18.423 6.574 1.00 64.35 O ATOM 299 CB ASP A 21 -7.743 20.717 6.397 1.00 11.10 C ATOM 300 CG ASP A 21 -8.920 21.123 5.527 1.00 53.53 C ATOM 301 OD1 ASP A 21 -9.724 21.982 5.951 1.00 23.42 O ATOM 302 OD2 ASP A 21 -9.016 20.625 4.375 1.00 31.54 O ATOM 0 H ASP A 21 -6.000 19.381 7.636 1.00 63.21 H new ATOM 0 HA ASP A 21 -8.753 20.120 8.166 1.00 52.25 H new ATOM 0 HB2 ASP A 21 -7.356 21.603 6.901 1.00 11.10 H new ATOM 0 HB3 ASP A 21 -6.945 20.341 5.756 1.00 11.10 H new ATOM 307 N LEU A 22 -7.960 17.374 6.704 1.00 13.24 N ATOM 308 CA LEU A 22 -8.429 16.101 6.192 1.00 21.12 C ATOM 309 C LEU A 22 -9.525 15.468 7.073 1.00 73.13 C ATOM 310 O LEU A 22 -10.189 14.547 6.651 1.00 4.43 O ATOM 311 CB LEU A 22 -7.244 15.129 5.918 1.00 71.23 C ATOM 312 CG LEU A 22 -6.199 14.893 7.049 1.00 74.23 C ATOM 313 CD1 LEU A 22 -6.789 14.172 8.256 1.00 61.21 C ATOM 314 CD2 LEU A 22 -5.005 14.120 6.511 1.00 22.02 C ATOM 0 H LEU A 22 -6.971 17.376 6.953 1.00 13.24 H new ATOM 0 HA LEU A 22 -8.908 16.302 5.234 1.00 21.12 H new ATOM 0 HB2 LEU A 22 -7.665 14.160 5.649 1.00 71.23 H new ATOM 0 HB3 LEU A 22 -6.708 15.498 5.043 1.00 71.23 H new ATOM 0 HG LEU A 22 -5.876 15.876 7.391 1.00 74.23 H new ATOM 0 HD11 LEU A 22 -6.016 14.035 9.012 1.00 61.21 H new ATOM 0 HD12 LEU A 22 -7.602 14.766 8.673 1.00 61.21 H new ATOM 0 HD13 LEU A 22 -7.171 13.199 7.948 1.00 61.21 H new ATOM 0 HD21 LEU A 22 -4.283 13.962 7.312 1.00 22.02 H new ATOM 0 HD22 LEU A 22 -5.339 13.156 6.128 1.00 22.02 H new ATOM 0 HD23 LEU A 22 -4.537 14.687 5.707 1.00 22.02 H new ATOM 326 N LEU A 23 -9.719 15.993 8.294 1.00 71.34 N ATOM 327 CA LEU A 23 -10.769 15.513 9.189 1.00 52.44 C ATOM 328 C LEU A 23 -12.131 15.872 8.614 1.00 53.42 C ATOM 329 O LEU A 23 -13.104 15.143 8.775 1.00 73.53 O ATOM 330 CB LEU A 23 -10.614 16.127 10.579 1.00 31.12 C ATOM 331 CG LEU A 23 -9.340 15.776 11.350 1.00 54.24 C ATOM 332 CD1 LEU A 23 -9.318 16.499 12.687 1.00 33.44 C ATOM 333 CD2 LEU A 23 -9.226 14.268 11.558 1.00 41.03 C ATOM 0 H LEU A 23 -9.157 16.752 8.679 1.00 71.34 H new ATOM 0 HA LEU A 23 -10.685 14.430 9.279 1.00 52.44 H new ATOM 0 HB2 LEU A 23 -10.663 17.211 10.479 1.00 31.12 H new ATOM 0 HB3 LEU A 23 -11.470 15.824 11.182 1.00 31.12 H new ATOM 0 HG LEU A 23 -8.483 16.102 10.760 1.00 54.24 H new ATOM 0 HD11 LEU A 23 -8.406 16.240 13.225 1.00 33.44 H new ATOM 0 HD12 LEU A 23 -9.347 17.576 12.519 1.00 33.44 H new ATOM 0 HD13 LEU A 23 -10.185 16.200 13.277 1.00 33.44 H new ATOM 0 HD21 LEU A 23 -8.312 14.045 12.108 1.00 41.03 H new ATOM 0 HD22 LEU A 23 -10.087 13.913 12.125 1.00 41.03 H new ATOM 0 HD23 LEU A 23 -9.198 13.768 10.590 1.00 41.03 H new ATOM 345 N LYS A 24 -12.149 16.973 7.900 1.00 72.15 N ATOM 346 CA LYS A 24 -13.317 17.507 7.221 1.00 60.21 C ATOM 347 C LYS A 24 -13.753 16.522 6.128 1.00 25.32 C ATOM 348 O LYS A 24 -14.939 16.343 5.858 1.00 23.41 O ATOM 349 CB LYS A 24 -12.881 18.844 6.632 1.00 65.25 C ATOM 350 CG LYS A 24 -13.892 19.677 5.895 1.00 42.14 C ATOM 351 CD LYS A 24 -13.193 20.959 5.459 1.00 64.44 C ATOM 352 CE LYS A 24 -14.079 21.894 4.684 1.00 35.15 C ATOM 353 NZ LYS A 24 -13.345 23.118 4.311 1.00 21.41 N ATOM 0 H LYS A 24 -11.317 17.549 7.768 1.00 72.15 H new ATOM 0 HA LYS A 24 -14.168 17.647 7.888 1.00 60.21 H new ATOM 0 HB2 LYS A 24 -12.486 19.450 7.447 1.00 65.25 H new ATOM 0 HB3 LYS A 24 -12.054 18.649 5.949 1.00 65.25 H new ATOM 0 HG2 LYS A 24 -14.278 19.137 5.030 1.00 42.14 H new ATOM 0 HG3 LYS A 24 -14.744 19.903 6.536 1.00 42.14 H new ATOM 0 HD2 LYS A 24 -12.817 21.476 6.342 1.00 64.44 H new ATOM 0 HD3 LYS A 24 -12.328 20.701 4.848 1.00 64.44 H new ATOM 0 HE2 LYS A 24 -14.445 21.396 3.786 1.00 35.15 H new ATOM 0 HE3 LYS A 24 -14.952 22.155 5.282 1.00 35.15 H new ATOM 0 HZ1 LYS A 24 -13.974 23.751 3.777 1.00 21.41 H new ATOM 0 HZ2 LYS A 24 -13.017 23.602 5.171 1.00 21.41 H new ATOM 0 HZ3 LYS A 24 -12.526 22.866 3.722 1.00 21.41 H new ATOM 367 N GLU A 25 -12.776 15.866 5.541 1.00 21.21 N ATOM 368 CA GLU A 25 -13.005 14.857 4.529 1.00 60.01 C ATOM 369 C GLU A 25 -13.326 13.516 5.218 1.00 5.53 C ATOM 370 O GLU A 25 -14.339 12.874 4.932 1.00 55.42 O ATOM 371 CB GLU A 25 -11.732 14.709 3.679 1.00 21.34 C ATOM 372 CG GLU A 25 -11.828 13.693 2.554 1.00 21.31 C ATOM 373 CD GLU A 25 -12.730 14.130 1.430 1.00 73.13 C ATOM 374 OE1 GLU A 25 -13.969 14.100 1.584 1.00 22.05 O ATOM 375 OE2 GLU A 25 -12.205 14.494 0.355 1.00 74.53 O ATOM 0 H GLU A 25 -11.790 16.019 5.755 1.00 21.21 H new ATOM 0 HA GLU A 25 -13.841 15.146 3.891 1.00 60.01 H new ATOM 0 HB2 GLU A 25 -11.483 15.680 3.251 1.00 21.34 H new ATOM 0 HB3 GLU A 25 -10.907 14.428 4.333 1.00 21.34 H new ATOM 0 HG2 GLU A 25 -10.830 13.505 2.157 1.00 21.31 H new ATOM 0 HG3 GLU A 25 -12.193 12.749 2.957 1.00 21.31 H new ATOM 382 N MET A 26 -12.479 13.165 6.186 1.00 55.23 N ATOM 383 CA MET A 26 -12.533 11.897 6.931 1.00 4.33 C ATOM 384 C MET A 26 -13.882 11.691 7.613 1.00 11.43 C ATOM 385 O MET A 26 -14.348 10.560 7.743 1.00 41.13 O ATOM 386 CB MET A 26 -11.417 11.872 7.993 1.00 70.05 C ATOM 387 CG MET A 26 -11.271 10.546 8.741 1.00 71.41 C ATOM 388 SD MET A 26 -10.714 9.190 7.681 1.00 3.41 S ATOM 389 CE MET A 26 -9.069 9.759 7.227 1.00 41.50 C ATOM 0 H MET A 26 -11.713 13.769 6.485 1.00 55.23 H new ATOM 0 HA MET A 26 -12.393 11.088 6.214 1.00 4.33 H new ATOM 0 HB2 MET A 26 -10.469 12.106 7.509 1.00 70.05 H new ATOM 0 HB3 MET A 26 -11.608 12.663 8.718 1.00 70.05 H new ATOM 0 HG2 MET A 26 -10.563 10.674 9.560 1.00 71.41 H new ATOM 0 HG3 MET A 26 -12.229 10.280 9.187 1.00 71.41 H new ATOM 0 HE1 MET A 26 -8.472 8.913 6.887 1.00 41.50 H new ATOM 0 HE2 MET A 26 -9.146 10.494 6.426 1.00 41.50 H new ATOM 0 HE3 MET A 26 -8.590 10.216 8.093 1.00 41.50 H new ATOM 399 N GLU A 27 -14.506 12.780 8.036 1.00 23.52 N ATOM 400 CA GLU A 27 -15.788 12.723 8.722 1.00 40.43 C ATOM 401 C GLU A 27 -16.879 12.142 7.825 1.00 43.03 C ATOM 402 O GLU A 27 -17.757 11.419 8.291 1.00 35.44 O ATOM 403 CB GLU A 27 -16.177 14.097 9.255 1.00 4.22 C ATOM 404 CG GLU A 27 -17.420 14.095 10.121 1.00 73.12 C ATOM 405 CD GLU A 27 -17.607 15.390 10.843 1.00 70.41 C ATOM 406 OE1 GLU A 27 -16.939 15.594 11.871 1.00 71.41 O ATOM 407 OE2 GLU A 27 -18.416 16.231 10.407 1.00 35.31 O ATOM 0 H GLU A 27 -14.140 13.724 7.914 1.00 23.52 H new ATOM 0 HA GLU A 27 -15.682 12.051 9.573 1.00 40.43 H new ATOM 0 HB2 GLU A 27 -15.345 14.500 9.833 1.00 4.22 H new ATOM 0 HB3 GLU A 27 -16.335 14.770 8.413 1.00 4.22 H new ATOM 0 HG2 GLU A 27 -18.293 13.898 9.499 1.00 73.12 H new ATOM 0 HG3 GLU A 27 -17.355 13.283 10.845 1.00 73.12 H new ATOM 414 N SER A 28 -16.773 12.385 6.536 1.00 72.34 N ATOM 415 CA SER A 28 -17.736 11.873 5.592 1.00 73.23 C ATOM 416 C SER A 28 -17.578 10.343 5.490 1.00 54.12 C ATOM 417 O SER A 28 -18.551 9.607 5.326 1.00 41.21 O ATOM 418 CB SER A 28 -17.529 12.562 4.225 1.00 40.55 C ATOM 419 OG SER A 28 -18.496 12.156 3.264 1.00 53.21 O ATOM 0 H SER A 28 -16.024 12.938 6.119 1.00 72.34 H new ATOM 0 HA SER A 28 -18.751 12.088 5.925 1.00 73.23 H new ATOM 0 HB2 SER A 28 -17.580 13.643 4.354 1.00 40.55 H new ATOM 0 HB3 SER A 28 -16.531 12.332 3.852 1.00 40.55 H new ATOM 0 HG SER A 28 -18.328 12.617 2.416 1.00 53.21 H new ATOM 425 N SER A 29 -16.358 9.890 5.657 1.00 71.33 N ATOM 426 CA SER A 29 -15.997 8.489 5.589 1.00 62.44 C ATOM 427 C SER A 29 -16.234 7.775 6.943 1.00 35.25 C ATOM 428 O SER A 29 -16.252 6.539 7.015 1.00 60.35 O ATOM 429 CB SER A 29 -14.524 8.412 5.223 1.00 3.11 C ATOM 430 OG SER A 29 -14.241 9.274 4.131 1.00 43.21 O ATOM 0 H SER A 29 -15.565 10.501 5.850 1.00 71.33 H new ATOM 0 HA SER A 29 -16.618 7.990 4.844 1.00 62.44 H new ATOM 0 HB2 SER A 29 -13.914 8.690 6.082 1.00 3.11 H new ATOM 0 HB3 SER A 29 -14.260 7.387 4.964 1.00 3.11 H new ATOM 0 HG SER A 29 -13.289 9.216 3.907 1.00 43.21 H new ATOM 436 N THR A 30 -16.380 8.563 8.002 1.00 54.43 N ATOM 437 CA THR A 30 -16.506 8.048 9.357 1.00 43.45 C ATOM 438 C THR A 30 -17.727 7.113 9.527 1.00 23.14 C ATOM 439 O THR A 30 -18.873 7.474 9.187 1.00 54.11 O ATOM 440 CB THR A 30 -16.546 9.211 10.374 1.00 65.32 C ATOM 441 OG1 THR A 30 -15.367 10.016 10.200 1.00 31.22 O ATOM 442 CG2 THR A 30 -16.585 8.698 11.811 1.00 10.45 C ATOM 0 H THR A 30 -16.414 9.581 7.943 1.00 54.43 H new ATOM 0 HA THR A 30 -15.623 7.440 9.555 1.00 43.45 H new ATOM 0 HB THR A 30 -17.450 9.794 10.195 1.00 65.32 H new ATOM 0 HG1 THR A 30 -15.088 9.989 9.261 1.00 31.22 H new ATOM 0 HG21 THR A 30 -16.612 9.543 12.499 1.00 10.45 H new ATOM 0 HG22 THR A 30 -17.475 8.085 11.954 1.00 10.45 H new ATOM 0 HG23 THR A 30 -15.696 8.099 12.008 1.00 10.45 H new ATOM 450 N GLY A 31 -17.451 5.921 10.004 1.00 24.12 N ATOM 451 CA GLY A 31 -18.438 4.908 10.238 1.00 22.34 C ATOM 452 C GLY A 31 -17.743 3.605 10.541 1.00 1.13 C ATOM 453 O GLY A 31 -16.694 3.602 11.190 1.00 64.04 O ATOM 0 H GLY A 31 -16.504 5.627 10.245 1.00 24.12 H new ATOM 0 HA2 GLY A 31 -19.081 5.194 11.070 1.00 22.34 H new ATOM 0 HA3 GLY A 31 -19.079 4.798 9.363 1.00 22.34 H new ATOM 457 N THR A 32 -18.294 2.520 10.104 1.00 0.44 N ATOM 458 CA THR A 32 -17.646 1.247 10.251 1.00 62.44 C ATOM 459 C THR A 32 -17.309 0.685 8.877 1.00 53.33 C ATOM 460 O THR A 32 -18.087 0.850 7.924 1.00 2.04 O ATOM 461 CB THR A 32 -18.525 0.256 11.045 1.00 4.10 C ATOM 462 OG1 THR A 32 -19.875 0.303 10.559 1.00 22.42 O ATOM 463 CG2 THR A 32 -18.494 0.563 12.534 1.00 73.10 C ATOM 0 H THR A 32 -19.200 2.485 9.637 1.00 0.44 H new ATOM 0 HA THR A 32 -16.725 1.390 10.817 1.00 62.44 H new ATOM 0 HB THR A 32 -18.123 -0.747 10.900 1.00 4.10 H new ATOM 0 HG1 THR A 32 -20.427 -0.329 11.065 1.00 22.42 H new ATOM 0 HG21 THR A 32 -19.122 -0.152 13.066 1.00 73.10 H new ATOM 0 HG22 THR A 32 -17.470 0.488 12.900 1.00 73.10 H new ATOM 0 HG23 THR A 32 -18.868 1.573 12.705 1.00 73.10 H new ATOM 471 N ALA A 33 -16.156 0.090 8.746 1.00 11.33 N ATOM 472 CA ALA A 33 -15.779 -0.507 7.495 1.00 1.55 C ATOM 473 C ALA A 33 -15.364 -1.946 7.717 1.00 11.31 C ATOM 474 O ALA A 33 -14.467 -2.221 8.538 1.00 1.50 O ATOM 475 CB ALA A 33 -14.677 0.276 6.822 1.00 44.22 C ATOM 0 H ALA A 33 -15.462 0.006 9.489 1.00 11.33 H new ATOM 0 HA ALA A 33 -16.642 -0.488 6.829 1.00 1.55 H new ATOM 0 HB1 ALA A 33 -14.415 -0.202 5.878 1.00 44.22 H new ATOM 0 HB2 ALA A 33 -15.018 1.294 6.631 1.00 44.22 H new ATOM 0 HB3 ALA A 33 -13.801 0.303 7.470 1.00 44.22 H new ATOM 481 N PRO A 34 -16.034 -2.884 7.039 1.00 43.43 N ATOM 482 CA PRO A 34 -15.743 -4.313 7.151 1.00 71.33 C ATOM 483 C PRO A 34 -14.358 -4.671 6.618 1.00 53.13 C ATOM 484 O PRO A 34 -13.794 -3.950 5.782 1.00 71.12 O ATOM 485 CB PRO A 34 -16.834 -4.979 6.307 1.00 25.14 C ATOM 486 CG PRO A 34 -17.340 -3.916 5.399 1.00 30.53 C ATOM 487 CD PRO A 34 -17.154 -2.617 6.112 1.00 53.21 C ATOM 0 HA PRO A 34 -15.739 -4.641 8.191 1.00 71.33 H new ATOM 0 HB2 PRO A 34 -16.433 -5.820 5.741 1.00 25.14 H new ATOM 0 HB3 PRO A 34 -17.633 -5.370 6.937 1.00 25.14 H new ATOM 0 HG2 PRO A 34 -16.794 -3.921 4.456 1.00 30.53 H new ATOM 0 HG3 PRO A 34 -18.391 -4.079 5.160 1.00 30.53 H new ATOM 0 HD2 PRO A 34 -16.916 -1.810 5.419 1.00 53.21 H new ATOM 0 HD3 PRO A 34 -18.056 -2.322 6.648 1.00 53.21 H new ATOM 495 N ALA A 35 -13.833 -5.773 7.081 1.00 31.53 N ATOM 496 CA ALA A 35 -12.518 -6.217 6.700 1.00 14.22 C ATOM 497 C ALA A 35 -12.617 -7.631 6.197 1.00 23.01 C ATOM 498 O ALA A 35 -13.584 -8.339 6.516 1.00 73.35 O ATOM 499 CB ALA A 35 -11.576 -6.145 7.891 1.00 62.13 C ATOM 0 H ALA A 35 -14.308 -6.393 7.737 1.00 31.53 H new ATOM 0 HA ALA A 35 -12.122 -5.574 5.914 1.00 14.22 H new ATOM 0 HB1 ALA A 35 -10.584 -6.483 7.591 1.00 62.13 H new ATOM 0 HB2 ALA A 35 -11.517 -5.116 8.246 1.00 62.13 H new ATOM 0 HB3 ALA A 35 -11.951 -6.784 8.691 1.00 62.13 H new ATOM 505 N SER A 36 -11.659 -8.055 5.432 1.00 44.12 N ATOM 506 CA SER A 36 -11.684 -9.375 4.900 1.00 23.10 C ATOM 507 C SER A 36 -11.178 -10.333 5.969 1.00 51.55 C ATOM 508 O SER A 36 -9.994 -10.342 6.310 1.00 32.33 O ATOM 509 CB SER A 36 -10.866 -9.428 3.616 1.00 33.21 C ATOM 510 OG SER A 36 -11.359 -8.449 2.696 1.00 62.43 O ATOM 0 H SER A 36 -10.847 -7.500 5.163 1.00 44.12 H new ATOM 0 HA SER A 36 -12.697 -9.676 4.634 1.00 23.10 H new ATOM 0 HB2 SER A 36 -9.815 -9.241 3.834 1.00 33.21 H new ATOM 0 HB3 SER A 36 -10.928 -10.422 3.173 1.00 33.21 H new ATOM 0 HG SER A 36 -10.832 -8.481 1.870 1.00 62.43 H new ATOM 516 N THR A 37 -12.099 -11.064 6.545 1.00 22.13 N ATOM 517 CA THR A 37 -11.831 -11.962 7.625 1.00 64.40 C ATOM 518 C THR A 37 -11.018 -13.192 7.156 1.00 70.41 C ATOM 519 O THR A 37 -11.557 -14.256 6.851 1.00 31.21 O ATOM 520 CB THR A 37 -13.158 -12.355 8.308 1.00 42.12 C ATOM 521 OG1 THR A 37 -13.882 -11.138 8.619 1.00 73.02 O ATOM 522 CG2 THR A 37 -12.919 -13.128 9.597 1.00 13.40 C ATOM 0 H THR A 37 -13.079 -11.046 6.264 1.00 22.13 H new ATOM 0 HA THR A 37 -11.206 -11.457 8.362 1.00 64.40 H new ATOM 0 HB THR A 37 -13.724 -12.996 7.631 1.00 42.12 H new ATOM 0 HG1 THR A 37 -14.731 -11.364 9.053 1.00 73.02 H new ATOM 0 HG21 THR A 37 -13.877 -13.387 10.049 1.00 13.40 H new ATOM 0 HG22 THR A 37 -12.363 -14.039 9.377 1.00 13.40 H new ATOM 0 HG23 THR A 37 -12.346 -12.512 10.290 1.00 13.40 H new ATOM 530 N GLY A 38 -9.738 -12.960 6.994 1.00 12.01 N ATOM 531 CA GLY A 38 -8.789 -13.970 6.627 1.00 12.13 C ATOM 532 C GLY A 38 -7.391 -13.445 6.820 1.00 32.20 C ATOM 533 O GLY A 38 -6.435 -13.906 6.189 1.00 70.40 O ATOM 0 H GLY A 38 -9.322 -12.037 7.118 1.00 12.01 H new ATOM 0 HA2 GLY A 38 -8.940 -14.863 7.234 1.00 12.13 H new ATOM 0 HA3 GLY A 38 -8.938 -14.263 5.588 1.00 12.13 H new ATOM 537 N ALA A 39 -7.269 -12.489 7.727 1.00 74.10 N ATOM 538 CA ALA A 39 -6.008 -11.832 8.012 1.00 23.45 C ATOM 539 C ALA A 39 -5.086 -12.773 8.728 1.00 42.54 C ATOM 540 O ALA A 39 -3.896 -12.795 8.482 1.00 20.11 O ATOM 541 CB ALA A 39 -6.242 -10.579 8.839 1.00 34.15 C ATOM 0 H ALA A 39 -8.049 -12.146 8.289 1.00 74.10 H new ATOM 0 HA ALA A 39 -5.542 -11.540 7.071 1.00 23.45 H new ATOM 0 HB1 ALA A 39 -5.287 -10.096 9.046 1.00 34.15 H new ATOM 0 HB2 ALA A 39 -6.884 -9.893 8.286 1.00 34.15 H new ATOM 0 HB3 ALA A 39 -6.723 -10.848 9.779 1.00 34.15 H new ATOM 547 N GLU A 40 -5.657 -13.592 9.578 1.00 52.23 N ATOM 548 CA GLU A 40 -4.883 -14.553 10.333 1.00 21.15 C ATOM 549 C GLU A 40 -4.768 -15.883 9.578 1.00 13.45 C ATOM 550 O GLU A 40 -4.201 -16.845 10.076 1.00 20.01 O ATOM 551 CB GLU A 40 -5.482 -14.739 11.729 1.00 4.51 C ATOM 552 CG GLU A 40 -6.931 -15.186 11.731 1.00 62.20 C ATOM 553 CD GLU A 40 -7.509 -15.262 13.116 1.00 63.03 C ATOM 554 OE1 GLU A 40 -7.305 -16.280 13.814 1.00 65.02 O ATOM 555 OE2 GLU A 40 -8.200 -14.308 13.524 1.00 52.32 O ATOM 0 H GLU A 40 -6.659 -13.614 9.766 1.00 52.23 H new ATOM 0 HA GLU A 40 -3.871 -14.167 10.454 1.00 21.15 H new ATOM 0 HB2 GLU A 40 -4.887 -15.473 12.272 1.00 4.51 H new ATOM 0 HB3 GLU A 40 -5.403 -13.798 12.274 1.00 4.51 H new ATOM 0 HG2 GLU A 40 -7.522 -14.493 11.132 1.00 62.20 H new ATOM 0 HG3 GLU A 40 -7.007 -16.164 11.255 1.00 62.20 H new ATOM 562 N ASN A 41 -5.296 -15.917 8.367 1.00 72.24 N ATOM 563 CA ASN A 41 -5.230 -17.118 7.536 1.00 2.31 C ATOM 564 C ASN A 41 -3.900 -17.114 6.815 1.00 2.04 C ATOM 565 O ASN A 41 -3.205 -18.135 6.759 1.00 53.52 O ATOM 566 CB ASN A 41 -6.390 -17.116 6.506 1.00 75.33 C ATOM 567 CG ASN A 41 -6.505 -18.375 5.629 1.00 35.21 C ATOM 568 OD1 ASN A 41 -5.532 -19.051 5.317 1.00 54.24 O ATOM 569 ND2 ASN A 41 -7.704 -18.681 5.219 1.00 52.21 N ATOM 0 H ASN A 41 -5.776 -15.129 7.932 1.00 72.24 H new ATOM 0 HA ASN A 41 -5.323 -18.011 8.155 1.00 2.31 H new ATOM 0 HB2 ASN A 41 -7.329 -16.983 7.044 1.00 75.33 H new ATOM 0 HB3 ASN A 41 -6.271 -16.251 5.854 1.00 75.33 H new ATOM 0 HD21 ASN A 41 -7.847 -19.498 4.626 1.00 52.21 H new ATOM 0 HD22 ASN A 41 -8.499 -18.103 5.492 1.00 52.21 H new ATOM 576 N LEU A 42 -3.532 -15.925 6.327 1.00 50.10 N ATOM 577 CA LEU A 42 -2.315 -15.702 5.546 1.00 3.22 C ATOM 578 C LEU A 42 -2.207 -16.705 4.385 1.00 44.44 C ATOM 579 O LEU A 42 -1.362 -17.601 4.404 1.00 43.31 O ATOM 580 CB LEU A 42 -1.070 -15.747 6.441 1.00 64.30 C ATOM 581 CG LEU A 42 -1.005 -14.696 7.550 1.00 41.22 C ATOM 582 CD1 LEU A 42 0.218 -14.923 8.419 1.00 34.44 C ATOM 583 CD2 LEU A 42 -0.984 -13.292 6.956 1.00 31.53 C ATOM 0 H LEU A 42 -4.082 -15.077 6.467 1.00 50.10 H new ATOM 0 HA LEU A 42 -2.375 -14.704 5.112 1.00 3.22 H new ATOM 0 HB2 LEU A 42 -1.011 -16.734 6.899 1.00 64.30 H new ATOM 0 HB3 LEU A 42 -0.188 -15.636 5.810 1.00 64.30 H new ATOM 0 HG LEU A 42 -1.896 -14.792 8.171 1.00 41.22 H new ATOM 0 HD11 LEU A 42 0.252 -14.168 9.204 1.00 34.44 H new ATOM 0 HD12 LEU A 42 0.165 -15.914 8.870 1.00 34.44 H new ATOM 0 HD13 LEU A 42 1.117 -14.851 7.807 1.00 34.44 H new ATOM 0 HD21 LEU A 42 -0.938 -12.557 7.760 1.00 31.53 H new ATOM 0 HD22 LEU A 42 -0.111 -13.182 6.313 1.00 31.53 H new ATOM 0 HD23 LEU A 42 -1.889 -13.131 6.370 1.00 31.53 H new ATOM 595 N PRO A 43 -3.096 -16.585 3.371 1.00 21.42 N ATOM 596 CA PRO A 43 -3.151 -17.538 2.258 1.00 61.02 C ATOM 597 C PRO A 43 -1.895 -17.523 1.378 1.00 11.55 C ATOM 598 O PRO A 43 -1.138 -18.485 1.345 1.00 23.32 O ATOM 599 CB PRO A 43 -4.390 -17.104 1.463 1.00 21.40 C ATOM 600 CG PRO A 43 -4.624 -15.682 1.845 1.00 73.24 C ATOM 601 CD PRO A 43 -4.131 -15.530 3.246 1.00 33.22 C ATOM 0 HA PRO A 43 -3.205 -18.565 2.620 1.00 61.02 H new ATOM 0 HB2 PRO A 43 -4.223 -17.201 0.390 1.00 21.40 H new ATOM 0 HB3 PRO A 43 -5.252 -17.724 1.708 1.00 21.40 H new ATOM 0 HG2 PRO A 43 -4.094 -15.008 1.172 1.00 73.24 H new ATOM 0 HG3 PRO A 43 -5.683 -15.432 1.778 1.00 73.24 H new ATOM 0 HD2 PRO A 43 -3.714 -14.538 3.418 1.00 33.22 H new ATOM 0 HD3 PRO A 43 -4.934 -15.669 3.970 1.00 33.22 H new ATOM 609 N ALA A 44 -1.657 -16.416 0.704 1.00 0.54 N ATOM 610 CA ALA A 44 -0.525 -16.304 -0.205 1.00 24.22 C ATOM 611 C ALA A 44 0.792 -16.164 0.546 1.00 54.15 C ATOM 612 O ALA A 44 1.858 -16.320 -0.031 1.00 0.11 O ATOM 613 CB ALA A 44 -0.722 -15.126 -1.139 1.00 13.11 C ATOM 0 H ALA A 44 -2.232 -15.576 0.766 1.00 0.54 H new ATOM 0 HA ALA A 44 -0.476 -17.224 -0.788 1.00 24.22 H new ATOM 0 HB1 ALA A 44 0.130 -15.051 -1.815 1.00 13.11 H new ATOM 0 HB2 ALA A 44 -1.634 -15.270 -1.719 1.00 13.11 H new ATOM 0 HB3 ALA A 44 -0.804 -14.209 -0.556 1.00 13.11 H new ATOM 619 N GLY A 45 0.707 -15.840 1.830 1.00 54.14 N ATOM 620 CA GLY A 45 1.904 -15.645 2.643 1.00 23.32 C ATOM 621 C GLY A 45 2.517 -14.276 2.421 1.00 43.43 C ATOM 622 O GLY A 45 3.518 -13.913 3.033 1.00 40.34 O ATOM 0 H GLY A 45 -0.172 -15.707 2.330 1.00 54.14 H new ATOM 0 HA2 GLY A 45 1.651 -15.764 3.697 1.00 23.32 H new ATOM 0 HA3 GLY A 45 2.637 -16.415 2.402 1.00 23.32 H new ATOM 626 N SER A 46 1.925 -13.544 1.523 1.00 23.25 N ATOM 627 CA SER A 46 2.309 -12.219 1.164 1.00 54.44 C ATOM 628 C SER A 46 1.038 -11.505 0.704 1.00 24.31 C ATOM 629 O SER A 46 -0.011 -12.166 0.540 1.00 73.41 O ATOM 630 CB SER A 46 3.394 -12.262 0.074 1.00 62.13 C ATOM 631 OG SER A 46 4.542 -12.976 0.553 1.00 64.32 O ATOM 0 H SER A 46 1.118 -13.878 0.996 1.00 23.25 H new ATOM 0 HA SER A 46 2.747 -11.677 2.002 1.00 54.44 H new ATOM 0 HB2 SER A 46 3.003 -12.745 -0.821 1.00 62.13 H new ATOM 0 HB3 SER A 46 3.678 -11.248 -0.209 1.00 62.13 H new ATOM 0 HG SER A 46 5.228 -13.000 -0.147 1.00 64.32 H new ATOM 637 N ALA A 47 1.092 -10.211 0.518 1.00 31.33 N ATOM 638 CA ALA A 47 -0.103 -9.446 0.221 1.00 51.43 C ATOM 639 C ALA A 47 0.186 -8.355 -0.765 1.00 61.54 C ATOM 640 O ALA A 47 1.344 -7.955 -0.922 1.00 21.00 O ATOM 641 CB ALA A 47 -0.648 -8.849 1.488 1.00 74.53 C ATOM 0 H ALA A 47 1.949 -9.660 0.566 1.00 31.33 H new ATOM 0 HA ALA A 47 -0.840 -10.119 -0.218 1.00 51.43 H new ATOM 0 HB1 ALA A 47 -1.546 -8.274 1.262 1.00 74.53 H new ATOM 0 HB2 ALA A 47 -0.894 -9.646 2.189 1.00 74.53 H new ATOM 0 HB3 ALA A 47 0.100 -8.193 1.932 1.00 74.53 H new ATOM 647 N LEU A 48 -0.833 -7.899 -1.449 1.00 41.43 N ATOM 648 CA LEU A 48 -0.679 -6.818 -2.385 1.00 24.21 C ATOM 649 C LEU A 48 -1.653 -5.688 -2.069 1.00 65.35 C ATOM 650 O LEU A 48 -2.659 -5.894 -1.394 1.00 13.14 O ATOM 651 CB LEU A 48 -0.742 -7.293 -3.889 1.00 24.42 C ATOM 652 CG LEU A 48 -2.054 -7.902 -4.496 1.00 51.55 C ATOM 653 CD1 LEU A 48 -2.606 -9.081 -3.715 1.00 35.00 C ATOM 654 CD2 LEU A 48 -3.122 -6.848 -4.771 1.00 45.54 C ATOM 0 H LEU A 48 -1.783 -8.263 -1.373 1.00 41.43 H new ATOM 0 HA LEU A 48 0.328 -6.419 -2.264 1.00 24.21 H new ATOM 0 HB2 LEU A 48 -0.475 -6.434 -4.505 1.00 24.42 H new ATOM 0 HB3 LEU A 48 0.044 -8.036 -4.021 1.00 24.42 H new ATOM 0 HG LEU A 48 -1.750 -8.307 -5.461 1.00 51.55 H new ATOM 0 HD11 LEU A 48 -3.513 -9.445 -4.198 1.00 35.00 H new ATOM 0 HD12 LEU A 48 -1.864 -9.879 -3.688 1.00 35.00 H new ATOM 0 HD13 LEU A 48 -2.838 -8.767 -2.697 1.00 35.00 H new ATOM 0 HD21 LEU A 48 -4.007 -7.327 -5.190 1.00 45.54 H new ATOM 0 HD22 LEU A 48 -3.387 -6.347 -3.840 1.00 45.54 H new ATOM 0 HD23 LEU A 48 -2.736 -6.115 -5.480 1.00 45.54 H new ATOM 666 N LEU A 49 -1.341 -4.517 -2.516 1.00 1.24 N ATOM 667 CA LEU A 49 -2.184 -3.374 -2.311 1.00 43.35 C ATOM 668 C LEU A 49 -2.302 -2.611 -3.602 1.00 61.34 C ATOM 669 O LEU A 49 -1.400 -2.660 -4.442 1.00 63.31 O ATOM 670 CB LEU A 49 -1.683 -2.437 -1.166 1.00 20.31 C ATOM 671 CG LEU A 49 -0.359 -1.650 -1.366 1.00 54.23 C ATOM 672 CD1 LEU A 49 -0.199 -0.633 -0.253 1.00 71.34 C ATOM 673 CD2 LEU A 49 0.850 -2.568 -1.367 1.00 14.44 C ATOM 0 H LEU A 49 -0.488 -4.319 -3.039 1.00 1.24 H new ATOM 0 HA LEU A 49 -3.161 -3.740 -1.995 1.00 43.35 H new ATOM 0 HB2 LEU A 49 -2.471 -1.711 -0.966 1.00 20.31 H new ATOM 0 HB3 LEU A 49 -1.573 -3.044 -0.267 1.00 20.31 H new ATOM 0 HG LEU A 49 -0.415 -1.155 -2.335 1.00 54.23 H new ATOM 0 HD11 LEU A 49 0.731 -0.082 -0.395 1.00 71.34 H new ATOM 0 HD12 LEU A 49 -1.039 0.061 -0.271 1.00 71.34 H new ATOM 0 HD13 LEU A 49 -0.173 -1.146 0.708 1.00 71.34 H new ATOM 0 HD21 LEU A 49 1.755 -1.978 -1.510 1.00 14.44 H new ATOM 0 HD22 LEU A 49 0.907 -3.096 -0.415 1.00 14.44 H new ATOM 0 HD23 LEU A 49 0.757 -3.291 -2.177 1.00 14.44 H new ATOM 685 N VAL A 50 -3.395 -1.946 -3.782 1.00 32.11 N ATOM 686 CA VAL A 50 -3.620 -1.175 -4.975 1.00 63.52 C ATOM 687 C VAL A 50 -3.946 0.268 -4.610 1.00 51.13 C ATOM 688 O VAL A 50 -4.709 0.525 -3.662 1.00 20.44 O ATOM 689 CB VAL A 50 -4.742 -1.811 -5.873 1.00 25.54 C ATOM 690 CG1 VAL A 50 -6.079 -1.915 -5.139 1.00 2.23 C ATOM 691 CG2 VAL A 50 -4.902 -1.056 -7.192 1.00 62.31 C ATOM 0 H VAL A 50 -4.162 -1.917 -3.110 1.00 32.11 H new ATOM 0 HA VAL A 50 -2.704 -1.182 -5.566 1.00 63.52 H new ATOM 0 HB VAL A 50 -4.418 -2.826 -6.103 1.00 25.54 H new ATOM 0 HG11 VAL A 50 -6.823 -2.360 -5.800 1.00 2.23 H new ATOM 0 HG12 VAL A 50 -5.960 -2.539 -4.253 1.00 2.23 H new ATOM 0 HG13 VAL A 50 -6.408 -0.920 -4.840 1.00 2.23 H new ATOM 0 HG21 VAL A 50 -5.686 -1.524 -7.786 1.00 62.31 H new ATOM 0 HG22 VAL A 50 -5.171 -0.020 -6.988 1.00 62.31 H new ATOM 0 HG23 VAL A 50 -3.962 -1.085 -7.744 1.00 62.31 H new ATOM 701 N VAL A 51 -3.331 1.200 -5.302 1.00 53.44 N ATOM 702 CA VAL A 51 -3.603 2.602 -5.079 1.00 34.23 C ATOM 703 C VAL A 51 -4.885 2.928 -5.805 1.00 12.12 C ATOM 704 O VAL A 51 -4.962 2.786 -7.016 1.00 70.14 O ATOM 705 CB VAL A 51 -2.453 3.504 -5.617 1.00 45.14 C ATOM 706 CG1 VAL A 51 -2.702 4.971 -5.285 1.00 22.24 C ATOM 707 CG2 VAL A 51 -1.105 3.056 -5.070 1.00 33.43 C ATOM 0 H VAL A 51 -2.637 1.012 -6.026 1.00 53.44 H new ATOM 0 HA VAL A 51 -3.687 2.793 -4.009 1.00 34.23 H new ATOM 0 HB VAL A 51 -2.434 3.400 -6.702 1.00 45.14 H new ATOM 0 HG11 VAL A 51 -1.883 5.576 -5.673 1.00 22.24 H new ATOM 0 HG12 VAL A 51 -3.638 5.293 -5.740 1.00 22.24 H new ATOM 0 HG13 VAL A 51 -2.763 5.094 -4.204 1.00 22.24 H new ATOM 0 HG21 VAL A 51 -0.320 3.703 -5.462 1.00 33.43 H new ATOM 0 HG22 VAL A 51 -1.116 3.117 -3.982 1.00 33.43 H new ATOM 0 HG23 VAL A 51 -0.913 2.027 -5.374 1.00 33.43 H new ATOM 717 N LYS A 52 -5.884 3.339 -5.074 1.00 62.42 N ATOM 718 CA LYS A 52 -7.166 3.617 -5.663 1.00 21.11 C ATOM 719 C LYS A 52 -7.247 5.077 -6.076 1.00 50.14 C ATOM 720 O LYS A 52 -7.849 5.413 -7.091 1.00 2.04 O ATOM 721 CB LYS A 52 -8.300 3.240 -4.687 1.00 13.33 C ATOM 722 CG LYS A 52 -9.713 3.443 -5.227 1.00 45.52 C ATOM 723 CD LYS A 52 -9.950 2.645 -6.501 1.00 64.50 C ATOM 724 CE LYS A 52 -11.366 2.828 -7.011 1.00 70.13 C ATOM 725 NZ LYS A 52 -11.579 2.128 -8.288 1.00 43.55 N ATOM 0 H LYS A 52 -5.835 3.489 -4.066 1.00 62.42 H new ATOM 0 HA LYS A 52 -7.286 3.008 -6.559 1.00 21.11 H new ATOM 0 HB2 LYS A 52 -8.182 2.194 -4.405 1.00 13.33 H new ATOM 0 HB3 LYS A 52 -8.187 3.830 -3.778 1.00 13.33 H new ATOM 0 HG2 LYS A 52 -10.438 3.144 -4.470 1.00 45.52 H new ATOM 0 HG3 LYS A 52 -9.878 4.502 -5.425 1.00 45.52 H new ATOM 0 HD2 LYS A 52 -9.242 2.960 -7.267 1.00 64.50 H new ATOM 0 HD3 LYS A 52 -9.764 1.588 -6.310 1.00 64.50 H new ATOM 0 HE2 LYS A 52 -12.071 2.454 -6.269 1.00 70.13 H new ATOM 0 HE3 LYS A 52 -11.572 3.891 -7.140 1.00 70.13 H new ATOM 0 HZ1 LYS A 52 -12.558 2.276 -8.606 1.00 43.55 H new ATOM 0 HZ2 LYS A 52 -10.923 2.502 -9.003 1.00 43.55 H new ATOM 0 HZ3 LYS A 52 -11.407 1.111 -8.159 1.00 43.55 H new ATOM 739 N ARG A 53 -6.595 5.931 -5.329 1.00 42.24 N ATOM 740 CA ARG A 53 -6.625 7.352 -5.630 1.00 2.02 C ATOM 741 C ARG A 53 -5.249 7.945 -5.466 1.00 40.01 C ATOM 742 O ARG A 53 -4.586 7.698 -4.463 1.00 23.54 O ATOM 743 CB ARG A 53 -7.617 8.094 -4.730 1.00 12.12 C ATOM 744 CG ARG A 53 -7.761 9.596 -5.037 1.00 73.51 C ATOM 745 CD ARG A 53 -8.616 9.897 -6.285 1.00 21.23 C ATOM 746 NE ARG A 53 -8.160 9.223 -7.516 1.00 60.33 N ATOM 747 CZ ARG A 53 -7.344 9.746 -8.448 1.00 32.02 C ATOM 748 NH1 ARG A 53 -6.795 10.949 -8.273 1.00 72.53 N ATOM 749 NH2 ARG A 53 -7.088 9.060 -9.551 1.00 32.44 N ATOM 0 H ARG A 53 -6.039 5.677 -4.513 1.00 42.24 H new ATOM 0 HA ARG A 53 -6.952 7.466 -6.664 1.00 2.02 H new ATOM 0 HB2 ARG A 53 -8.595 7.622 -4.823 1.00 12.12 H new ATOM 0 HB3 ARG A 53 -7.304 7.977 -3.692 1.00 12.12 H new ATOM 0 HG2 ARG A 53 -8.206 10.093 -4.175 1.00 73.51 H new ATOM 0 HG3 ARG A 53 -6.769 10.026 -5.175 1.00 73.51 H new ATOM 0 HD2 ARG A 53 -9.646 9.602 -6.084 1.00 21.23 H new ATOM 0 HD3 ARG A 53 -8.621 10.974 -6.456 1.00 21.23 H new ATOM 0 HE ARG A 53 -8.495 8.273 -7.675 1.00 60.33 H new ATOM 0 HH11 ARG A 53 -6.993 11.481 -7.426 1.00 72.53 H new ATOM 0 HH12 ARG A 53 -6.177 11.336 -8.986 1.00 72.53 H new ATOM 0 HH21 ARG A 53 -7.509 8.141 -9.689 1.00 32.44 H new ATOM 0 HH22 ARG A 53 -6.470 9.450 -10.262 1.00 32.44 H new ATOM 763 N GLY A 54 -4.844 8.712 -6.446 1.00 55.24 N ATOM 764 CA GLY A 54 -3.556 9.343 -6.465 1.00 55.40 C ATOM 765 C GLY A 54 -3.075 9.437 -7.896 1.00 54.22 C ATOM 766 O GLY A 54 -3.741 8.906 -8.781 1.00 23.34 O ATOM 0 H GLY A 54 -5.414 8.917 -7.267 1.00 55.24 H new ATOM 0 HA2 GLY A 54 -3.617 10.337 -6.022 1.00 55.40 H new ATOM 0 HA3 GLY A 54 -2.847 8.771 -5.866 1.00 55.40 H new ATOM 770 N PRO A 55 -1.958 10.116 -8.177 1.00 12.30 N ATOM 771 CA PRO A 55 -1.403 10.201 -9.538 1.00 15.22 C ATOM 772 C PRO A 55 -1.056 8.827 -10.123 1.00 63.52 C ATOM 773 O PRO A 55 -1.222 8.589 -11.326 1.00 33.14 O ATOM 774 CB PRO A 55 -0.145 11.047 -9.354 1.00 1.25 C ATOM 775 CG PRO A 55 -0.448 11.860 -8.158 1.00 72.35 C ATOM 776 CD PRO A 55 -1.182 10.933 -7.236 1.00 74.13 C ATOM 0 HA PRO A 55 -2.118 10.626 -10.243 1.00 15.22 H new ATOM 0 HB2 PRO A 55 0.738 10.426 -9.204 1.00 1.25 H new ATOM 0 HB3 PRO A 55 0.049 11.672 -10.226 1.00 1.25 H new ATOM 0 HG2 PRO A 55 0.464 12.237 -7.695 1.00 72.35 H new ATOM 0 HG3 PRO A 55 -1.057 12.727 -8.414 1.00 72.35 H new ATOM 0 HD2 PRO A 55 -0.500 10.329 -6.638 1.00 74.13 H new ATOM 0 HD3 PRO A 55 -1.824 11.474 -6.540 1.00 74.13 H new ATOM 784 N ASN A 56 -0.591 7.914 -9.284 1.00 53.00 N ATOM 785 CA ASN A 56 -0.279 6.565 -9.751 1.00 63.52 C ATOM 786 C ASN A 56 -1.384 5.567 -9.411 1.00 24.04 C ATOM 787 O ASN A 56 -1.163 4.353 -9.410 1.00 15.51 O ATOM 788 CB ASN A 56 1.082 6.081 -9.236 1.00 14.03 C ATOM 789 CG ASN A 56 1.261 6.199 -7.739 1.00 13.11 C ATOM 790 OD1 ASN A 56 0.311 6.171 -6.963 1.00 2.34 O ATOM 791 ND2 ASN A 56 2.482 6.347 -7.333 1.00 60.45 N ATOM 0 H ASN A 56 -0.422 8.075 -8.291 1.00 53.00 H new ATOM 0 HA ASN A 56 -0.218 6.622 -10.838 1.00 63.52 H new ATOM 0 HB2 ASN A 56 1.216 5.039 -9.525 1.00 14.03 H new ATOM 0 HB3 ASN A 56 1.868 6.652 -9.730 1.00 14.03 H new ATOM 0 HD21 ASN A 56 2.680 6.445 -6.337 1.00 60.45 H new ATOM 0 HD22 ASN A 56 3.246 6.365 -8.009 1.00 60.45 H new ATOM 798 N ALA A 57 -2.590 6.079 -9.191 1.00 41.40 N ATOM 799 CA ALA A 57 -3.745 5.246 -8.878 1.00 51.42 C ATOM 800 C ALA A 57 -4.015 4.264 -9.994 1.00 55.44 C ATOM 801 O ALA A 57 -3.934 4.614 -11.178 1.00 65.41 O ATOM 802 CB ALA A 57 -4.968 6.091 -8.651 1.00 24.44 C ATOM 0 H ALA A 57 -2.794 7.078 -9.224 1.00 41.40 H new ATOM 0 HA ALA A 57 -3.518 4.696 -7.965 1.00 51.42 H new ATOM 0 HB1 ALA A 57 -5.817 5.448 -8.419 1.00 24.44 H new ATOM 0 HB2 ALA A 57 -4.790 6.772 -7.818 1.00 24.44 H new ATOM 0 HB3 ALA A 57 -5.184 6.667 -9.551 1.00 24.44 H new ATOM 808 N GLY A 58 -4.336 3.067 -9.626 1.00 74.21 N ATOM 809 CA GLY A 58 -4.565 2.029 -10.580 1.00 54.20 C ATOM 810 C GLY A 58 -3.447 1.025 -10.572 1.00 65.45 C ATOM 811 O GLY A 58 -3.612 -0.113 -11.030 1.00 63.32 O ATOM 0 H GLY A 58 -4.447 2.779 -8.654 1.00 74.21 H new ATOM 0 HA2 GLY A 58 -5.508 1.529 -10.357 1.00 54.20 H new ATOM 0 HA3 GLY A 58 -4.661 2.462 -11.576 1.00 54.20 H new ATOM 815 N ALA A 59 -2.311 1.425 -10.037 1.00 50.52 N ATOM 816 CA ALA A 59 -1.164 0.550 -9.963 1.00 4.42 C ATOM 817 C ALA A 59 -1.212 -0.267 -8.686 1.00 14.42 C ATOM 818 O ALA A 59 -1.682 0.218 -7.638 1.00 41.21 O ATOM 819 CB ALA A 59 0.130 1.347 -10.038 1.00 11.11 C ATOM 0 H ALA A 59 -2.160 2.355 -9.646 1.00 50.52 H new ATOM 0 HA ALA A 59 -1.192 -0.129 -10.815 1.00 4.42 H new ATOM 0 HB1 ALA A 59 0.980 0.667 -9.980 1.00 11.11 H new ATOM 0 HB2 ALA A 59 0.166 1.894 -10.980 1.00 11.11 H new ATOM 0 HB3 ALA A 59 0.172 2.052 -9.207 1.00 11.11 H new ATOM 825 N ARG A 60 -0.768 -1.500 -8.773 1.00 41.44 N ATOM 826 CA ARG A 60 -0.721 -2.367 -7.622 1.00 15.12 C ATOM 827 C ARG A 60 0.721 -2.546 -7.202 1.00 31.14 C ATOM 828 O ARG A 60 1.637 -2.348 -8.008 1.00 21.22 O ATOM 829 CB ARG A 60 -1.335 -3.754 -7.916 1.00 73.03 C ATOM 830 CG ARG A 60 -0.555 -4.576 -8.938 1.00 10.41 C ATOM 831 CD ARG A 60 -1.080 -5.993 -9.064 1.00 2.25 C ATOM 832 NE ARG A 60 -2.467 -6.054 -9.544 1.00 33.11 N ATOM 833 CZ ARG A 60 -3.272 -7.113 -9.387 1.00 41.31 C ATOM 834 NH1 ARG A 60 -2.826 -8.213 -8.780 1.00 40.02 N ATOM 835 NH2 ARG A 60 -4.508 -7.084 -9.864 1.00 73.10 N ATOM 0 H ARG A 60 -0.432 -1.926 -9.637 1.00 41.44 H new ATOM 0 HA ARG A 60 -1.306 -1.904 -6.828 1.00 15.12 H new ATOM 0 HB2 ARG A 60 -1.398 -4.317 -6.985 1.00 73.03 H new ATOM 0 HB3 ARG A 60 -2.355 -3.619 -8.276 1.00 73.03 H new ATOM 0 HG2 ARG A 60 -0.606 -4.085 -9.910 1.00 10.41 H new ATOM 0 HG3 ARG A 60 0.496 -4.605 -8.650 1.00 10.41 H new ATOM 0 HD2 ARG A 60 -0.441 -6.551 -9.748 1.00 2.25 H new ATOM 0 HD3 ARG A 60 -1.016 -6.485 -8.094 1.00 2.25 H new ATOM 0 HE ARG A 60 -2.841 -5.238 -10.028 1.00 33.11 H new ATOM 0 HH11 ARG A 60 -1.868 -8.251 -8.433 1.00 40.02 H new ATOM 0 HH12 ARG A 60 -3.443 -9.017 -8.663 1.00 40.02 H new ATOM 0 HH21 ARG A 60 -4.847 -6.255 -10.351 1.00 73.10 H new ATOM 0 HH22 ARG A 60 -5.120 -7.891 -9.744 1.00 73.10 H new ATOM 849 N PHE A 61 0.911 -2.884 -5.968 1.00 74.34 N ATOM 850 CA PHE A 61 2.211 -3.180 -5.424 1.00 62.53 C ATOM 851 C PHE A 61 2.061 -4.395 -4.532 1.00 75.02 C ATOM 852 O PHE A 61 1.020 -4.568 -3.912 1.00 22.03 O ATOM 853 CB PHE A 61 2.755 -1.995 -4.611 1.00 13.12 C ATOM 854 CG PHE A 61 2.961 -0.723 -5.402 1.00 32.33 C ATOM 855 CD1 PHE A 61 4.122 -0.526 -6.129 1.00 74.42 C ATOM 856 CD2 PHE A 61 1.996 0.277 -5.406 1.00 4.31 C ATOM 857 CE1 PHE A 61 4.321 0.639 -6.847 1.00 34.22 C ATOM 858 CE2 PHE A 61 2.188 1.443 -6.122 1.00 4.55 C ATOM 859 CZ PHE A 61 3.352 1.624 -6.843 1.00 1.41 C ATOM 0 H PHE A 61 0.154 -2.966 -5.289 1.00 74.34 H new ATOM 0 HA PHE A 61 2.918 -3.371 -6.232 1.00 62.53 H new ATOM 0 HB2 PHE A 61 2.067 -1.789 -3.791 1.00 13.12 H new ATOM 0 HB3 PHE A 61 3.705 -2.286 -4.164 1.00 13.12 H new ATOM 0 HD1 PHE A 61 4.883 -1.292 -6.136 1.00 74.42 H new ATOM 0 HD2 PHE A 61 1.085 0.141 -4.843 1.00 4.31 H new ATOM 0 HE1 PHE A 61 5.232 0.779 -7.410 1.00 34.22 H new ATOM 0 HE2 PHE A 61 1.429 2.212 -6.118 1.00 4.55 H new ATOM 0 HZ PHE A 61 3.505 2.535 -7.403 1.00 1.41 H new ATOM 869 N LEU A 62 3.040 -5.240 -4.502 1.00 53.33 N ATOM 870 CA LEU A 62 2.982 -6.445 -3.704 1.00 24.40 C ATOM 871 C LEU A 62 4.118 -6.426 -2.685 1.00 32.35 C ATOM 872 O LEU A 62 5.252 -6.068 -3.027 1.00 52.14 O ATOM 873 CB LEU A 62 3.031 -7.688 -4.651 1.00 12.30 C ATOM 874 CG LEU A 62 2.775 -9.100 -4.057 1.00 40.22 C ATOM 875 CD1 LEU A 62 2.410 -10.060 -5.177 1.00 71.31 C ATOM 876 CD2 LEU A 62 4.008 -9.641 -3.345 1.00 74.23 C ATOM 0 H LEU A 62 3.907 -5.124 -5.026 1.00 53.33 H new ATOM 0 HA LEU A 62 2.049 -6.503 -3.144 1.00 24.40 H new ATOM 0 HB2 LEU A 62 2.299 -7.527 -5.443 1.00 12.30 H new ATOM 0 HB3 LEU A 62 4.013 -7.703 -5.123 1.00 12.30 H new ATOM 0 HG LEU A 62 1.963 -9.014 -3.335 1.00 40.22 H new ATOM 0 HD11 LEU A 62 2.230 -11.052 -4.762 1.00 71.31 H new ATOM 0 HD12 LEU A 62 1.509 -9.708 -5.679 1.00 71.31 H new ATOM 0 HD13 LEU A 62 3.229 -10.110 -5.895 1.00 71.31 H new ATOM 0 HD21 LEU A 62 3.791 -10.630 -2.942 1.00 74.23 H new ATOM 0 HD22 LEU A 62 4.835 -9.710 -4.052 1.00 74.23 H new ATOM 0 HD23 LEU A 62 4.282 -8.970 -2.531 1.00 74.23 H new ATOM 888 N LEU A 63 3.812 -6.775 -1.442 1.00 1.34 N ATOM 889 CA LEU A 63 4.816 -6.812 -0.382 1.00 22.43 C ATOM 890 C LEU A 63 5.613 -8.093 -0.507 1.00 21.41 C ATOM 891 O LEU A 63 5.124 -9.180 -0.178 1.00 52.01 O ATOM 892 CB LEU A 63 4.185 -6.739 1.040 1.00 61.30 C ATOM 893 CG LEU A 63 3.445 -5.443 1.464 1.00 4.04 C ATOM 894 CD1 LEU A 63 4.320 -4.216 1.296 1.00 52.31 C ATOM 895 CD2 LEU A 63 2.120 -5.270 0.745 1.00 10.13 C ATOM 0 H LEU A 63 2.874 -7.038 -1.141 1.00 1.34 H new ATOM 0 HA LEU A 63 5.456 -5.937 -0.500 1.00 22.43 H new ATOM 0 HB2 LEU A 63 3.481 -7.566 1.131 1.00 61.30 H new ATOM 0 HB3 LEU A 63 4.981 -6.916 1.764 1.00 61.30 H new ATOM 0 HG LEU A 63 3.221 -5.552 2.525 1.00 4.04 H new ATOM 0 HD11 LEU A 63 3.766 -3.329 1.603 1.00 52.31 H new ATOM 0 HD12 LEU A 63 5.213 -4.318 1.913 1.00 52.31 H new ATOM 0 HD13 LEU A 63 4.611 -4.117 0.250 1.00 52.31 H new ATOM 0 HD21 LEU A 63 1.643 -4.348 1.078 1.00 10.13 H new ATOM 0 HD22 LEU A 63 2.293 -5.221 -0.330 1.00 10.13 H new ATOM 0 HD23 LEU A 63 1.471 -6.116 0.970 1.00 10.13 H new ATOM 907 N ASP A 64 6.811 -7.970 -1.005 1.00 13.23 N ATOM 908 CA ASP A 64 7.674 -9.115 -1.239 1.00 52.21 C ATOM 909 C ASP A 64 8.866 -9.107 -0.305 1.00 1.12 C ATOM 910 O ASP A 64 9.449 -10.149 -0.007 1.00 60.22 O ATOM 911 CB ASP A 64 8.146 -9.103 -2.697 1.00 72.43 C ATOM 912 CG ASP A 64 9.213 -10.127 -2.997 1.00 23.42 C ATOM 913 OD1 ASP A 64 8.884 -11.315 -3.168 1.00 5.52 O ATOM 914 OD2 ASP A 64 10.400 -9.750 -3.095 1.00 21.14 O ATOM 0 H ASP A 64 7.226 -7.075 -1.264 1.00 13.23 H new ATOM 0 HA ASP A 64 7.106 -10.024 -1.042 1.00 52.21 H new ATOM 0 HB2 ASP A 64 7.290 -9.281 -3.348 1.00 72.43 H new ATOM 0 HB3 ASP A 64 8.529 -8.111 -2.938 1.00 72.43 H new ATOM 919 N GLN A 65 9.176 -7.960 0.210 1.00 22.13 N ATOM 920 CA GLN A 65 10.362 -7.793 1.004 1.00 11.13 C ATOM 921 C GLN A 65 10.014 -7.626 2.473 1.00 72.13 C ATOM 922 O GLN A 65 8.989 -7.034 2.794 1.00 72.43 O ATOM 923 CB GLN A 65 11.173 -6.603 0.476 1.00 70.21 C ATOM 924 CG GLN A 65 10.402 -5.291 0.384 1.00 0.11 C ATOM 925 CD GLN A 65 11.157 -4.200 -0.362 1.00 51.00 C ATOM 926 OE1 GLN A 65 10.560 -3.315 -0.968 1.00 73.21 O ATOM 927 NE2 GLN A 65 12.457 -4.270 -0.361 1.00 74.22 N ATOM 0 H GLN A 65 8.620 -7.113 0.096 1.00 22.13 H new ATOM 0 HA GLN A 65 10.975 -8.690 0.922 1.00 11.13 H new ATOM 0 HB2 GLN A 65 12.037 -6.455 1.124 1.00 70.21 H new ATOM 0 HB3 GLN A 65 11.555 -6.853 -0.514 1.00 70.21 H new ATOM 0 HG2 GLN A 65 9.450 -5.471 -0.116 1.00 0.11 H new ATOM 0 HG3 GLN A 65 10.172 -4.941 1.390 1.00 0.11 H new ATOM 0 HE21 GLN A 65 12.927 -5.016 0.151 1.00 74.22 H new ATOM 0 HE22 GLN A 65 13.005 -3.579 -0.872 1.00 74.22 H new ATOM 936 N PRO A 66 10.868 -8.164 3.386 1.00 23.52 N ATOM 937 CA PRO A 66 10.657 -8.095 4.851 1.00 73.13 C ATOM 938 C PRO A 66 10.524 -6.664 5.394 1.00 10.31 C ATOM 939 O PRO A 66 10.035 -6.449 6.506 1.00 12.40 O ATOM 940 CB PRO A 66 11.908 -8.763 5.429 1.00 2.14 C ATOM 941 CG PRO A 66 12.382 -9.657 4.344 1.00 24.41 C ATOM 942 CD PRO A 66 12.094 -8.931 3.066 1.00 12.13 C ATOM 0 HA PRO A 66 9.719 -8.577 5.128 1.00 73.13 H new ATOM 0 HB2 PRO A 66 12.665 -8.026 5.696 1.00 2.14 H new ATOM 0 HB3 PRO A 66 11.677 -9.324 6.334 1.00 2.14 H new ATOM 0 HG2 PRO A 66 13.447 -9.864 4.445 1.00 24.41 H new ATOM 0 HG3 PRO A 66 11.866 -10.617 4.374 1.00 24.41 H new ATOM 0 HD2 PRO A 66 12.917 -8.276 2.780 1.00 12.13 H new ATOM 0 HD3 PRO A 66 11.933 -9.621 2.238 1.00 12.13 H new ATOM 950 N THR A 67 10.990 -5.696 4.652 1.00 45.32 N ATOM 951 CA THR A 67 10.828 -4.326 5.045 1.00 41.31 C ATOM 952 C THR A 67 10.543 -3.484 3.805 1.00 71.31 C ATOM 953 O THR A 67 11.336 -3.451 2.865 1.00 23.20 O ATOM 954 CB THR A 67 12.093 -3.816 5.777 1.00 13.45 C ATOM 955 OG1 THR A 67 12.371 -4.703 6.882 1.00 12.02 O ATOM 956 CG2 THR A 67 11.883 -2.403 6.312 1.00 43.04 C ATOM 0 H THR A 67 11.485 -5.833 3.771 1.00 45.32 H new ATOM 0 HA THR A 67 9.990 -4.243 5.737 1.00 41.31 H new ATOM 0 HB THR A 67 12.926 -3.797 5.074 1.00 13.45 H new ATOM 0 HG1 THR A 67 13.171 -4.394 7.356 1.00 12.02 H new ATOM 0 HG21 THR A 67 12.787 -2.069 6.822 1.00 43.04 H new ATOM 0 HG22 THR A 67 11.663 -1.729 5.484 1.00 43.04 H new ATOM 0 HG23 THR A 67 11.049 -2.400 7.013 1.00 43.04 H new ATOM 964 N THR A 68 9.423 -2.825 3.812 1.00 15.50 N ATOM 965 CA THR A 68 8.981 -2.031 2.698 1.00 55.21 C ATOM 966 C THR A 68 8.816 -0.578 3.148 1.00 41.31 C ATOM 967 O THR A 68 8.247 -0.324 4.191 1.00 32.02 O ATOM 968 CB THR A 68 7.631 -2.579 2.205 1.00 54.11 C ATOM 969 OG1 THR A 68 7.759 -3.984 1.951 1.00 3.14 O ATOM 970 CG2 THR A 68 7.187 -1.882 0.937 1.00 53.03 C ATOM 0 H THR A 68 8.779 -2.822 4.603 1.00 15.50 H new ATOM 0 HA THR A 68 9.712 -2.075 1.891 1.00 55.21 H new ATOM 0 HB THR A 68 6.883 -2.398 2.976 1.00 54.11 H new ATOM 0 HG1 THR A 68 7.265 -4.216 1.137 1.00 3.14 H new ATOM 0 HG21 THR A 68 6.230 -2.291 0.613 1.00 53.03 H new ATOM 0 HG22 THR A 68 7.080 -0.814 1.127 1.00 53.03 H new ATOM 0 HG23 THR A 68 7.931 -2.038 0.156 1.00 53.03 H new ATOM 978 N THR A 69 9.323 0.349 2.393 1.00 73.30 N ATOM 979 CA THR A 69 9.219 1.736 2.759 1.00 32.03 C ATOM 980 C THR A 69 8.170 2.435 1.873 1.00 13.21 C ATOM 981 O THR A 69 8.026 2.100 0.681 1.00 32.03 O ATOM 982 CB THR A 69 10.600 2.411 2.625 1.00 2.22 C ATOM 983 OG1 THR A 69 11.574 1.574 3.275 1.00 1.23 O ATOM 984 CG2 THR A 69 10.613 3.782 3.299 1.00 23.34 C ATOM 0 H THR A 69 9.815 0.173 1.517 1.00 73.30 H new ATOM 0 HA THR A 69 8.895 1.819 3.796 1.00 32.03 H new ATOM 0 HB THR A 69 10.827 2.542 1.567 1.00 2.22 H new ATOM 0 HG1 THR A 69 12.461 1.985 3.200 1.00 1.23 H new ATOM 0 HG21 THR A 69 11.599 4.233 3.188 1.00 23.34 H new ATOM 0 HG22 THR A 69 9.866 4.424 2.832 1.00 23.34 H new ATOM 0 HG23 THR A 69 10.383 3.669 4.358 1.00 23.34 H new ATOM 992 N ALA A 70 7.434 3.366 2.458 1.00 70.04 N ATOM 993 CA ALA A 70 6.413 4.113 1.759 1.00 73.13 C ATOM 994 C ALA A 70 6.778 5.571 1.770 1.00 22.13 C ATOM 995 O ALA A 70 7.167 6.107 2.822 1.00 24.14 O ATOM 996 CB ALA A 70 5.081 3.941 2.465 1.00 23.32 C ATOM 0 H ALA A 70 7.533 3.623 3.440 1.00 70.04 H new ATOM 0 HA ALA A 70 6.337 3.749 0.734 1.00 73.13 H new ATOM 0 HB1 ALA A 70 4.313 4.505 1.936 1.00 23.32 H new ATOM 0 HB2 ALA A 70 4.810 2.885 2.479 1.00 23.32 H new ATOM 0 HB3 ALA A 70 5.161 4.309 3.488 1.00 23.32 H new ATOM 1002 N GLY A 71 6.645 6.208 0.634 1.00 10.04 N ATOM 1003 CA GLY A 71 6.977 7.603 0.499 1.00 70.51 C ATOM 1004 C GLY A 71 7.786 7.795 -0.740 1.00 20.01 C ATOM 1005 O GLY A 71 7.553 7.086 -1.725 1.00 13.22 O ATOM 0 H GLY A 71 6.303 5.774 -0.223 1.00 10.04 H new ATOM 0 HA2 GLY A 71 6.068 8.203 0.451 1.00 70.51 H new ATOM 0 HA3 GLY A 71 7.537 7.942 1.370 1.00 70.51 H new ATOM 1009 N ARG A 72 8.713 8.730 -0.741 1.00 53.22 N ATOM 1010 CA ARG A 72 9.567 8.847 -1.883 1.00 52.13 C ATOM 1011 C ARG A 72 11.017 8.643 -1.513 1.00 22.23 C ATOM 1012 O ARG A 72 11.615 9.416 -0.764 1.00 20.44 O ATOM 1013 CB ARG A 72 9.353 10.143 -2.664 1.00 31.14 C ATOM 1014 CG ARG A 72 9.584 11.414 -1.892 1.00 40.01 C ATOM 1015 CD ARG A 72 9.391 12.620 -2.799 1.00 1.31 C ATOM 1016 NE ARG A 72 10.344 12.590 -3.923 1.00 43.31 N ATOM 1017 CZ ARG A 72 10.070 12.938 -5.192 1.00 53.15 C ATOM 1018 NH1 ARG A 72 8.867 13.409 -5.523 1.00 14.12 N ATOM 1019 NH2 ARG A 72 11.017 12.826 -6.122 1.00 20.13 N ATOM 0 H ARG A 72 8.885 9.395 0.013 1.00 53.22 H new ATOM 0 HA ARG A 72 9.283 8.042 -2.561 1.00 52.13 H new ATOM 0 HB2 ARG A 72 10.017 10.139 -3.529 1.00 31.14 H new ATOM 0 HB3 ARG A 72 8.332 10.152 -3.046 1.00 31.14 H new ATOM 0 HG2 ARG A 72 8.893 11.468 -1.051 1.00 40.01 H new ATOM 0 HG3 ARG A 72 10.592 11.419 -1.478 1.00 40.01 H new ATOM 0 HD2 ARG A 72 8.371 12.632 -3.182 1.00 1.31 H new ATOM 0 HD3 ARG A 72 9.527 13.537 -2.226 1.00 1.31 H new ATOM 0 HE ARG A 72 11.294 12.278 -3.720 1.00 43.31 H new ATOM 0 HH11 ARG A 72 8.144 13.508 -4.810 1.00 14.12 H new ATOM 0 HH12 ARG A 72 8.670 13.670 -6.489 1.00 14.12 H new ATOM 0 HH21 ARG A 72 11.942 12.478 -5.869 1.00 20.13 H new ATOM 0 HH22 ARG A 72 10.817 13.088 -7.087 1.00 20.13 H new ATOM 1033 N HIS A 73 11.555 7.645 -2.101 1.00 13.05 N ATOM 1034 CA HIS A 73 12.926 7.185 -1.958 1.00 34.11 C ATOM 1035 C HIS A 73 13.140 6.190 -3.080 1.00 41.22 C ATOM 1036 O HIS A 73 12.217 5.415 -3.384 1.00 51.51 O ATOM 1037 CB HIS A 73 13.197 6.463 -0.612 1.00 65.11 C ATOM 1038 CG HIS A 73 13.456 7.303 0.616 1.00 51.42 C ATOM 1039 ND1 HIS A 73 14.716 7.703 1.012 1.00 21.42 N ATOM 1040 CD2 HIS A 73 12.609 7.749 1.578 1.00 61.51 C ATOM 1041 CE1 HIS A 73 14.607 8.357 2.165 1.00 73.43 C ATOM 1042 NE2 HIS A 73 13.341 8.419 2.563 1.00 53.21 N ATOM 0 H HIS A 73 11.025 7.066 -2.753 1.00 13.05 H new ATOM 0 HA HIS A 73 13.595 8.045 -1.989 1.00 34.11 H new ATOM 0 HB2 HIS A 73 12.341 5.822 -0.401 1.00 65.11 H new ATOM 0 HB3 HIS A 73 14.057 5.809 -0.754 1.00 65.11 H new ATOM 0 HD2 HIS A 73 11.538 7.609 1.582 1.00 61.51 H new ATOM 0 HE1 HIS A 73 15.439 8.782 2.707 1.00 73.43 H new ATOM 0 HE2 HIS A 73 12.980 8.862 3.408 1.00 53.21 H new ATOM 1050 N PRO A 74 14.325 6.157 -3.709 1.00 14.31 N ATOM 1051 CA PRO A 74 14.581 5.294 -4.877 1.00 62.21 C ATOM 1052 C PRO A 74 14.465 3.789 -4.601 1.00 20.02 C ATOM 1053 O PRO A 74 14.244 2.999 -5.524 1.00 44.21 O ATOM 1054 CB PRO A 74 16.004 5.658 -5.303 1.00 44.41 C ATOM 1055 CG PRO A 74 16.278 6.970 -4.656 1.00 44.41 C ATOM 1056 CD PRO A 74 15.507 6.969 -3.372 1.00 71.44 C ATOM 0 HA PRO A 74 13.827 5.468 -5.644 1.00 62.21 H new ATOM 0 HB2 PRO A 74 16.718 4.901 -4.979 1.00 44.41 H new ATOM 0 HB3 PRO A 74 16.085 5.729 -6.388 1.00 44.41 H new ATOM 0 HG2 PRO A 74 17.344 7.098 -4.470 1.00 44.41 H new ATOM 0 HG3 PRO A 74 15.965 7.794 -5.298 1.00 44.41 H new ATOM 0 HD2 PRO A 74 16.080 6.531 -2.555 1.00 71.44 H new ATOM 0 HD3 PRO A 74 15.232 7.978 -3.063 1.00 71.44 H new ATOM 1064 N GLU A 75 14.598 3.392 -3.359 1.00 10.12 N ATOM 1065 CA GLU A 75 14.488 1.989 -3.017 1.00 20.42 C ATOM 1066 C GLU A 75 13.171 1.666 -2.320 1.00 14.53 C ATOM 1067 O GLU A 75 12.946 0.533 -1.880 1.00 2.11 O ATOM 1068 CB GLU A 75 15.719 1.485 -2.223 1.00 4.03 C ATOM 1069 CG GLU A 75 16.215 2.399 -1.099 1.00 10.12 C ATOM 1070 CD GLU A 75 15.159 2.740 -0.087 1.00 32.22 C ATOM 1071 OE1 GLU A 75 14.917 1.941 0.841 1.00 12.20 O ATOM 1072 OE2 GLU A 75 14.556 3.804 -0.219 1.00 22.24 O ATOM 0 H GLU A 75 14.781 4.013 -2.571 1.00 10.12 H new ATOM 0 HA GLU A 75 14.479 1.436 -3.956 1.00 20.42 H new ATOM 0 HB2 GLU A 75 15.476 0.513 -1.793 1.00 4.03 H new ATOM 0 HB3 GLU A 75 16.539 1.327 -2.924 1.00 4.03 H new ATOM 0 HG2 GLU A 75 17.049 1.915 -0.591 1.00 10.12 H new ATOM 0 HG3 GLU A 75 16.599 3.321 -1.535 1.00 10.12 H new ATOM 1079 N SER A 76 12.300 2.649 -2.226 1.00 4.13 N ATOM 1080 CA SER A 76 11.015 2.431 -1.612 1.00 51.32 C ATOM 1081 C SER A 76 10.076 1.785 -2.604 1.00 50.43 C ATOM 1082 O SER A 76 10.083 2.130 -3.787 1.00 53.22 O ATOM 1083 CB SER A 76 10.453 3.723 -1.058 1.00 12.14 C ATOM 1084 OG SER A 76 11.279 4.194 -0.011 1.00 71.22 O ATOM 0 H SER A 76 12.460 3.598 -2.565 1.00 4.13 H new ATOM 0 HA SER A 76 11.134 1.751 -0.768 1.00 51.32 H new ATOM 0 HB2 SER A 76 10.389 4.471 -1.848 1.00 12.14 H new ATOM 0 HB3 SER A 76 9.440 3.561 -0.690 1.00 12.14 H new ATOM 0 HG SER A 76 10.790 4.859 0.517 1.00 71.22 H new ATOM 1090 N ASP A 77 9.286 0.851 -2.129 1.00 21.23 N ATOM 1091 CA ASP A 77 8.440 0.057 -3.004 1.00 33.03 C ATOM 1092 C ASP A 77 7.225 0.840 -3.444 1.00 72.40 C ATOM 1093 O ASP A 77 6.947 0.946 -4.638 1.00 24.32 O ATOM 1094 CB ASP A 77 8.013 -1.224 -2.305 1.00 4.01 C ATOM 1095 CG ASP A 77 7.340 -2.207 -3.231 1.00 41.23 C ATOM 1096 OD1 ASP A 77 6.127 -2.162 -3.413 1.00 53.02 O ATOM 1097 OD2 ASP A 77 8.048 -3.059 -3.808 1.00 71.52 O ATOM 0 H ASP A 77 9.208 0.618 -1.139 1.00 21.23 H new ATOM 0 HA ASP A 77 9.019 -0.199 -3.891 1.00 33.03 H new ATOM 0 HB2 ASP A 77 8.888 -1.696 -1.858 1.00 4.01 H new ATOM 0 HB3 ASP A 77 7.332 -0.977 -1.490 1.00 4.01 H new ATOM 1102 N ILE A 78 6.529 1.441 -2.499 1.00 54.54 N ATOM 1103 CA ILE A 78 5.364 2.194 -2.858 1.00 45.44 C ATOM 1104 C ILE A 78 5.668 3.682 -2.898 1.00 75.03 C ATOM 1105 O ILE A 78 5.855 4.351 -1.864 1.00 51.31 O ATOM 1106 CB ILE A 78 4.079 1.867 -2.012 1.00 21.50 C ATOM 1107 CG1 ILE A 78 4.226 2.222 -0.533 1.00 72.52 C ATOM 1108 CG2 ILE A 78 3.731 0.393 -2.147 1.00 72.33 C ATOM 1109 CD1 ILE A 78 2.938 2.053 0.255 1.00 12.30 C ATOM 0 H ILE A 78 6.749 1.420 -1.503 1.00 54.54 H new ATOM 0 HA ILE A 78 5.105 1.869 -3.866 1.00 45.44 H new ATOM 0 HB ILE A 78 3.277 2.487 -2.412 1.00 21.50 H new ATOM 0 HG12 ILE A 78 5.000 1.594 -0.091 1.00 72.52 H new ATOM 0 HG13 ILE A 78 4.565 3.254 -0.446 1.00 72.52 H new ATOM 0 HG21 ILE A 78 2.840 0.174 -1.558 1.00 72.33 H new ATOM 0 HG22 ILE A 78 3.541 0.159 -3.194 1.00 72.33 H new ATOM 0 HG23 ILE A 78 4.563 -0.212 -1.785 1.00 72.33 H new ATOM 0 HD11 ILE A 78 3.111 2.321 1.297 1.00 12.30 H new ATOM 0 HD12 ILE A 78 2.168 2.701 -0.163 1.00 12.30 H new ATOM 0 HD13 ILE A 78 2.610 1.015 0.197 1.00 12.30 H new ATOM 1121 N PHE A 79 5.799 4.169 -4.091 1.00 43.13 N ATOM 1122 CA PHE A 79 6.054 5.557 -4.338 1.00 72.34 C ATOM 1123 C PHE A 79 4.732 6.292 -4.429 1.00 25.41 C ATOM 1124 O PHE A 79 3.814 5.832 -5.081 1.00 5.33 O ATOM 1125 CB PHE A 79 6.861 5.712 -5.647 1.00 62.34 C ATOM 1126 CG PHE A 79 7.085 7.135 -6.101 1.00 71.05 C ATOM 1127 CD1 PHE A 79 8.018 7.943 -5.476 1.00 62.23 C ATOM 1128 CD2 PHE A 79 6.362 7.656 -7.167 1.00 4.30 C ATOM 1129 CE1 PHE A 79 8.226 9.244 -5.902 1.00 42.14 C ATOM 1130 CE2 PHE A 79 6.565 8.952 -7.595 1.00 64.41 C ATOM 1131 CZ PHE A 79 7.499 9.747 -6.960 1.00 12.41 C ATOM 0 H PHE A 79 5.731 3.605 -4.938 1.00 43.13 H new ATOM 0 HA PHE A 79 6.640 5.982 -3.523 1.00 72.34 H new ATOM 0 HB2 PHE A 79 7.831 5.233 -5.516 1.00 62.34 H new ATOM 0 HB3 PHE A 79 6.344 5.172 -6.440 1.00 62.34 H new ATOM 0 HD1 PHE A 79 8.590 7.555 -4.647 1.00 62.23 H new ATOM 0 HD2 PHE A 79 5.631 7.038 -7.667 1.00 4.30 H new ATOM 0 HE1 PHE A 79 8.957 9.865 -5.406 1.00 42.14 H new ATOM 0 HE2 PHE A 79 5.995 9.344 -8.424 1.00 64.41 H new ATOM 0 HZ PHE A 79 7.660 10.762 -7.292 1.00 12.41 H new ATOM 1141 N LEU A 80 4.629 7.389 -3.749 1.00 1.23 N ATOM 1142 CA LEU A 80 3.449 8.226 -3.798 1.00 34.34 C ATOM 1143 C LEU A 80 3.909 9.614 -4.120 1.00 22.34 C ATOM 1144 O LEU A 80 4.919 10.071 -3.578 1.00 21.43 O ATOM 1145 CB LEU A 80 2.719 8.226 -2.445 1.00 21.41 C ATOM 1146 CG LEU A 80 2.190 6.876 -1.944 1.00 23.55 C ATOM 1147 CD1 LEU A 80 1.592 7.033 -0.559 1.00 54.43 C ATOM 1148 CD2 LEU A 80 1.147 6.311 -2.903 1.00 1.53 C ATOM 0 H LEU A 80 5.363 7.742 -3.135 1.00 1.23 H new ATOM 0 HA LEU A 80 2.753 7.851 -4.549 1.00 34.34 H new ATOM 0 HB2 LEU A 80 3.399 8.625 -1.692 1.00 21.41 H new ATOM 0 HB3 LEU A 80 1.878 8.916 -2.513 1.00 21.41 H new ATOM 0 HG LEU A 80 3.025 6.177 -1.896 1.00 23.55 H new ATOM 0 HD11 LEU A 80 1.219 6.069 -0.212 1.00 54.43 H new ATOM 0 HD12 LEU A 80 2.356 7.395 0.128 1.00 54.43 H new ATOM 0 HD13 LEU A 80 0.770 7.748 -0.597 1.00 54.43 H new ATOM 0 HD21 LEU A 80 0.787 5.354 -2.526 1.00 1.53 H new ATOM 0 HD22 LEU A 80 0.312 7.007 -2.983 1.00 1.53 H new ATOM 0 HD23 LEU A 80 1.596 6.168 -3.886 1.00 1.53 H new ATOM 1160 N ASP A 81 3.215 10.263 -4.999 1.00 11.03 N ATOM 1161 CA ASP A 81 3.573 11.599 -5.410 1.00 70.42 C ATOM 1162 C ASP A 81 2.365 12.478 -5.335 1.00 20.05 C ATOM 1163 O ASP A 81 1.276 12.039 -5.655 1.00 24.20 O ATOM 1164 CB ASP A 81 4.141 11.598 -6.835 1.00 64.53 C ATOM 1165 CG ASP A 81 4.454 12.991 -7.336 1.00 72.40 C ATOM 1166 OD1 ASP A 81 5.406 13.619 -6.843 1.00 62.14 O ATOM 1167 OD2 ASP A 81 3.764 13.482 -8.234 1.00 75.31 O ATOM 0 H ASP A 81 2.383 9.890 -5.457 1.00 11.03 H new ATOM 0 HA ASP A 81 4.345 11.981 -4.741 1.00 70.42 H new ATOM 0 HB2 ASP A 81 5.048 10.994 -6.860 1.00 64.53 H new ATOM 0 HB3 ASP A 81 3.425 11.126 -7.508 1.00 64.53 H new ATOM 1172 N ASP A 82 2.553 13.678 -4.870 1.00 73.24 N ATOM 1173 CA ASP A 82 1.503 14.677 -4.766 1.00 1.53 C ATOM 1174 C ASP A 82 2.224 15.980 -4.512 1.00 21.11 C ATOM 1175 O ASP A 82 3.465 16.003 -4.550 1.00 51.03 O ATOM 1176 CB ASP A 82 0.537 14.346 -3.580 1.00 51.10 C ATOM 1177 CG ASP A 82 -0.739 15.193 -3.547 1.00 4.41 C ATOM 1178 OD1 ASP A 82 -0.738 16.291 -2.926 1.00 45.11 O ATOM 1179 OD2 ASP A 82 -1.760 14.779 -4.133 1.00 64.10 O ATOM 0 H ASP A 82 3.460 14.008 -4.541 1.00 73.24 H new ATOM 0 HA ASP A 82 0.889 14.715 -5.666 1.00 1.53 H new ATOM 0 HB2 ASP A 82 0.259 13.294 -3.637 1.00 51.10 H new ATOM 0 HB3 ASP A 82 1.074 14.483 -2.641 1.00 51.10 H new ATOM 1184 N VAL A 83 1.505 17.038 -4.269 1.00 21.01 N ATOM 1185 CA VAL A 83 2.099 18.302 -3.912 1.00 34.22 C ATOM 1186 C VAL A 83 2.392 18.245 -2.411 1.00 72.23 C ATOM 1187 O VAL A 83 3.296 18.915 -1.899 1.00 73.21 O ATOM 1188 CB VAL A 83 1.142 19.485 -4.236 1.00 42.00 C ATOM 1189 CG1 VAL A 83 1.785 20.832 -3.928 1.00 62.13 C ATOM 1190 CG2 VAL A 83 0.701 19.429 -5.690 1.00 34.33 C ATOM 0 H VAL A 83 0.486 17.052 -4.312 1.00 21.01 H new ATOM 0 HA VAL A 83 3.011 18.470 -4.485 1.00 34.22 H new ATOM 0 HB VAL A 83 0.266 19.383 -3.596 1.00 42.00 H new ATOM 0 HG11 VAL A 83 1.085 21.633 -4.168 1.00 62.13 H new ATOM 0 HG12 VAL A 83 2.042 20.879 -2.870 1.00 62.13 H new ATOM 0 HG13 VAL A 83 2.689 20.949 -4.526 1.00 62.13 H new ATOM 0 HG21 VAL A 83 0.032 20.264 -5.900 1.00 34.33 H new ATOM 0 HG22 VAL A 83 1.575 19.493 -6.338 1.00 34.33 H new ATOM 0 HG23 VAL A 83 0.179 18.490 -5.876 1.00 34.33 H new ATOM 1200 N THR A 84 1.644 17.398 -1.735 1.00 23.34 N ATOM 1201 CA THR A 84 1.818 17.148 -0.334 1.00 72.32 C ATOM 1202 C THR A 84 3.017 16.187 -0.179 1.00 71.23 C ATOM 1203 O THR A 84 2.886 14.970 -0.354 1.00 52.41 O ATOM 1204 CB THR A 84 0.544 16.487 0.233 1.00 61.13 C ATOM 1205 OG1 THR A 84 -0.623 17.089 -0.391 1.00 21.52 O ATOM 1206 CG2 THR A 84 0.458 16.713 1.733 1.00 50.42 C ATOM 0 H THR A 84 0.888 16.859 -2.158 1.00 23.34 H new ATOM 0 HA THR A 84 1.999 18.077 0.206 1.00 72.32 H new ATOM 0 HB THR A 84 0.580 15.417 0.027 1.00 61.13 H new ATOM 0 HG1 THR A 84 -0.864 16.581 -1.193 1.00 21.52 H new ATOM 0 HG21 THR A 84 -0.445 16.242 2.121 1.00 50.42 H new ATOM 0 HG22 THR A 84 1.332 16.277 2.217 1.00 50.42 H new ATOM 0 HG23 THR A 84 0.426 17.783 1.938 1.00 50.42 H new ATOM 1214 N VAL A 85 4.180 16.739 0.079 1.00 23.21 N ATOM 1215 CA VAL A 85 5.399 15.954 0.097 1.00 13.41 C ATOM 1216 C VAL A 85 5.840 15.603 1.512 1.00 20.30 C ATOM 1217 O VAL A 85 5.807 16.442 2.419 1.00 40.14 O ATOM 1218 CB VAL A 85 6.558 16.687 -0.659 1.00 31.22 C ATOM 1219 CG1 VAL A 85 7.847 15.868 -0.660 1.00 20.15 C ATOM 1220 CG2 VAL A 85 6.147 17.002 -2.087 1.00 31.52 C ATOM 0 H VAL A 85 4.311 17.730 0.280 1.00 23.21 H new ATOM 0 HA VAL A 85 5.173 15.022 -0.422 1.00 13.41 H new ATOM 0 HB VAL A 85 6.752 17.617 -0.125 1.00 31.22 H new ATOM 0 HG11 VAL A 85 8.624 16.414 -1.195 1.00 20.15 H new ATOM 0 HG12 VAL A 85 8.168 15.693 0.367 1.00 20.15 H new ATOM 0 HG13 VAL A 85 7.670 14.912 -1.153 1.00 20.15 H new ATOM 0 HG21 VAL A 85 6.965 17.511 -2.597 1.00 31.52 H new ATOM 0 HG22 VAL A 85 5.913 16.075 -2.611 1.00 31.52 H new ATOM 0 HG23 VAL A 85 5.267 17.646 -2.079 1.00 31.52 H new ATOM 1230 N SER A 86 6.220 14.363 1.679 1.00 31.22 N ATOM 1231 CA SER A 86 6.793 13.854 2.882 1.00 70.12 C ATOM 1232 C SER A 86 7.982 13.032 2.422 1.00 62.13 C ATOM 1233 O SER A 86 7.895 12.398 1.360 1.00 60.01 O ATOM 1234 CB SER A 86 5.777 12.964 3.635 1.00 52.44 C ATOM 1235 OG SER A 86 6.257 12.581 4.928 1.00 1.43 O ATOM 0 H SER A 86 6.132 13.658 0.947 1.00 31.22 H new ATOM 0 HA SER A 86 7.080 14.648 3.571 1.00 70.12 H new ATOM 0 HB2 SER A 86 4.834 13.500 3.742 1.00 52.44 H new ATOM 0 HB3 SER A 86 5.570 12.071 3.045 1.00 52.44 H new ATOM 0 HG SER A 86 6.622 11.673 4.886 1.00 1.43 H new ATOM 1241 N ARG A 87 9.082 13.065 3.164 1.00 52.32 N ATOM 1242 CA ARG A 87 10.284 12.333 2.770 1.00 34.13 C ATOM 1243 C ARG A 87 9.988 10.831 2.739 1.00 2.51 C ATOM 1244 O ARG A 87 10.284 10.144 1.769 1.00 35.15 O ATOM 1245 CB ARG A 87 11.475 12.704 3.678 1.00 62.33 C ATOM 1246 CG ARG A 87 11.308 12.382 5.156 1.00 20.43 C ATOM 1247 CD ARG A 87 12.405 13.027 5.975 1.00 45.25 C ATOM 1248 NE ARG A 87 12.289 14.498 5.981 1.00 13.32 N ATOM 1249 CZ ARG A 87 13.272 15.359 5.689 1.00 44.53 C ATOM 1250 NH1 ARG A 87 14.540 14.961 5.691 1.00 15.53 N ATOM 1251 NH2 ARG A 87 12.991 16.645 5.514 1.00 71.34 N ATOM 0 H ARG A 87 9.169 13.586 4.036 1.00 52.32 H new ATOM 0 HA ARG A 87 10.578 12.622 1.761 1.00 34.13 H new ATOM 0 HB2 ARG A 87 12.362 12.187 3.311 1.00 62.33 H new ATOM 0 HB3 ARG A 87 11.665 13.773 3.578 1.00 62.33 H new ATOM 0 HG2 ARG A 87 10.336 12.733 5.502 1.00 20.43 H new ATOM 0 HG3 ARG A 87 11.327 11.302 5.302 1.00 20.43 H new ATOM 0 HD2 ARG A 87 12.362 12.654 6.998 1.00 45.25 H new ATOM 0 HD3 ARG A 87 13.376 12.740 5.572 1.00 45.25 H new ATOM 0 HE ARG A 87 11.382 14.893 6.229 1.00 13.32 H new ATOM 0 HH11 ARG A 87 14.770 13.993 5.916 1.00 15.53 H new ATOM 0 HH12 ARG A 87 15.283 15.623 5.467 1.00 15.53 H new ATOM 0 HH21 ARG A 87 12.029 16.973 5.602 1.00 71.34 H new ATOM 0 HH22 ARG A 87 13.737 17.304 5.291 1.00 71.34 H new ATOM 1265 N ARG A 88 9.339 10.358 3.765 1.00 54.22 N ATOM 1266 CA ARG A 88 8.810 9.040 3.796 1.00 11.53 C ATOM 1267 C ARG A 88 7.616 9.060 4.695 1.00 24.02 C ATOM 1268 O ARG A 88 7.505 9.944 5.545 1.00 22.40 O ATOM 1269 CB ARG A 88 9.829 7.922 4.149 1.00 41.33 C ATOM 1270 CG ARG A 88 10.462 7.938 5.533 1.00 33.15 C ATOM 1271 CD ARG A 88 11.333 6.685 5.693 1.00 51.23 C ATOM 1272 NE ARG A 88 11.892 6.516 7.041 1.00 1.44 N ATOM 1273 CZ ARG A 88 11.821 5.371 7.758 1.00 5.42 C ATOM 1274 NH1 ARG A 88 11.293 4.276 7.234 1.00 22.15 N ATOM 1275 NH2 ARG A 88 12.297 5.309 8.980 1.00 61.23 N ATOM 0 H ARG A 88 9.164 10.894 4.615 1.00 54.22 H new ATOM 0 HA ARG A 88 8.522 8.762 2.782 1.00 11.53 H new ATOM 0 HB2 ARG A 88 9.328 6.962 4.023 1.00 41.33 H new ATOM 0 HB3 ARG A 88 10.633 7.960 3.414 1.00 41.33 H new ATOM 0 HG2 ARG A 88 11.066 8.836 5.661 1.00 33.15 H new ATOM 0 HG3 ARG A 88 9.689 7.961 6.301 1.00 33.15 H new ATOM 0 HD2 ARG A 88 10.737 5.807 5.445 1.00 51.23 H new ATOM 0 HD3 ARG A 88 12.151 6.729 4.974 1.00 51.23 H new ATOM 0 HE ARG A 88 12.365 7.315 7.464 1.00 1.44 H new ATOM 0 HH11 ARG A 88 10.934 4.289 6.279 1.00 22.15 H new ATOM 0 HH12 ARG A 88 11.245 3.419 7.785 1.00 22.15 H new ATOM 0 HH21 ARG A 88 12.728 6.132 9.402 1.00 61.23 H new ATOM 0 HH22 ARG A 88 12.236 4.438 9.508 1.00 61.23 H new ATOM 1289 N HIS A 89 6.692 8.202 4.434 1.00 64.31 N ATOM 1290 CA HIS A 89 5.452 8.156 5.170 1.00 71.45 C ATOM 1291 C HIS A 89 5.446 7.045 6.224 1.00 42.32 C ATOM 1292 O HIS A 89 5.205 7.290 7.405 1.00 44.34 O ATOM 1293 CB HIS A 89 4.289 7.987 4.175 1.00 44.11 C ATOM 1294 CG HIS A 89 2.954 7.758 4.806 1.00 3.13 C ATOM 1295 ND1 HIS A 89 2.350 6.535 4.732 1.00 42.32 N ATOM 1296 CD2 HIS A 89 2.170 8.604 5.505 1.00 51.50 C ATOM 1297 CE1 HIS A 89 1.219 6.656 5.390 1.00 74.52 C ATOM 1298 NE2 HIS A 89 1.068 7.888 5.869 1.00 31.33 N ATOM 0 H HIS A 89 6.765 7.500 3.698 1.00 64.31 H new ATOM 0 HA HIS A 89 5.335 9.092 5.716 1.00 71.45 H new ATOM 0 HB2 HIS A 89 4.232 8.878 3.550 1.00 44.11 H new ATOM 0 HB3 HIS A 89 4.512 7.148 3.515 1.00 44.11 H new ATOM 0 HD1 HIS A 89 2.704 5.701 4.263 1.00 42.32 H new ATOM 0 HD2 HIS A 89 2.374 9.640 5.731 1.00 51.50 H new ATOM 0 HE1 HIS A 89 0.504 5.858 5.525 1.00 74.52 H new ATOM 1306 N ALA A 90 5.758 5.850 5.805 1.00 23.42 N ATOM 1307 CA ALA A 90 5.634 4.715 6.685 1.00 50.32 C ATOM 1308 C ALA A 90 6.616 3.646 6.304 1.00 1.32 C ATOM 1309 O ALA A 90 7.227 3.697 5.219 1.00 55.45 O ATOM 1310 CB ALA A 90 4.214 4.153 6.607 1.00 63.14 C ATOM 0 H ALA A 90 6.098 5.635 4.868 1.00 23.42 H new ATOM 0 HA ALA A 90 5.844 5.041 7.704 1.00 50.32 H new ATOM 0 HB1 ALA A 90 4.125 3.295 7.274 1.00 63.14 H new ATOM 0 HB2 ALA A 90 3.502 4.921 6.907 1.00 63.14 H new ATOM 0 HB3 ALA A 90 4.002 3.841 5.584 1.00 63.14 H new ATOM 1316 N GLU A 91 6.811 2.724 7.191 1.00 2.34 N ATOM 1317 CA GLU A 91 7.617 1.560 6.939 1.00 2.14 C ATOM 1318 C GLU A 91 6.843 0.315 7.350 1.00 31.23 C ATOM 1319 O GLU A 91 6.229 0.272 8.413 1.00 32.53 O ATOM 1320 CB GLU A 91 8.989 1.640 7.640 1.00 1.20 C ATOM 1321 CG GLU A 91 8.929 1.896 9.137 1.00 65.04 C ATOM 1322 CD GLU A 91 10.291 1.914 9.780 1.00 30.10 C ATOM 1323 OE1 GLU A 91 11.114 2.774 9.432 1.00 54.13 O ATOM 1324 OE2 GLU A 91 10.556 1.073 10.656 1.00 54.13 O ATOM 0 H GLU A 91 6.410 2.754 8.129 1.00 2.34 H new ATOM 0 HA GLU A 91 7.830 1.508 5.871 1.00 2.14 H new ATOM 0 HB2 GLU A 91 9.524 0.706 7.467 1.00 1.20 H new ATOM 0 HB3 GLU A 91 9.573 2.433 7.174 1.00 1.20 H new ATOM 0 HG2 GLU A 91 8.434 2.850 9.319 1.00 65.04 H new ATOM 0 HG3 GLU A 91 8.319 1.125 9.609 1.00 65.04 H new ATOM 1331 N PHE A 92 6.824 -0.650 6.489 1.00 62.44 N ATOM 1332 CA PHE A 92 6.122 -1.880 6.726 1.00 63.40 C ATOM 1333 C PHE A 92 7.123 -2.953 7.022 1.00 3.30 C ATOM 1334 O PHE A 92 8.043 -3.186 6.225 1.00 45.44 O ATOM 1335 CB PHE A 92 5.340 -2.324 5.484 1.00 2.35 C ATOM 1336 CG PHE A 92 4.387 -1.321 4.916 1.00 55.23 C ATOM 1337 CD1 PHE A 92 3.110 -1.217 5.406 1.00 50.35 C ATOM 1338 CD2 PHE A 92 4.770 -0.498 3.874 1.00 21.01 C ATOM 1339 CE1 PHE A 92 2.218 -0.308 4.873 1.00 21.31 C ATOM 1340 CE2 PHE A 92 3.892 0.410 3.338 1.00 42.43 C ATOM 1341 CZ PHE A 92 2.611 0.509 3.836 1.00 14.45 C ATOM 0 H PHE A 92 7.300 -0.611 5.588 1.00 62.44 H new ATOM 0 HA PHE A 92 5.432 -1.720 7.554 1.00 63.40 H new ATOM 0 HB2 PHE A 92 6.055 -2.597 4.708 1.00 2.35 H new ATOM 0 HB3 PHE A 92 4.781 -3.226 5.734 1.00 2.35 H new ATOM 0 HD1 PHE A 92 2.798 -1.855 6.220 1.00 50.35 H new ATOM 0 HD2 PHE A 92 5.772 -0.570 3.477 1.00 21.01 H new ATOM 0 HE1 PHE A 92 1.215 -0.238 5.268 1.00 21.31 H new ATOM 0 HE2 PHE A 92 4.205 1.048 2.525 1.00 42.43 H new ATOM 0 HZ PHE A 92 1.919 1.223 3.415 1.00 14.45 H new ATOM 1351 N ARG A 93 6.987 -3.583 8.135 1.00 2.32 N ATOM 1352 CA ARG A 93 7.812 -4.717 8.434 1.00 25.31 C ATOM 1353 C ARG A 93 7.007 -5.975 8.310 1.00 54.13 C ATOM 1354 O ARG A 93 5.917 -6.087 8.870 1.00 55.53 O ATOM 1355 CB ARG A 93 8.498 -4.650 9.801 1.00 15.51 C ATOM 1356 CG ARG A 93 9.682 -3.701 9.866 1.00 54.25 C ATOM 1357 CD ARG A 93 10.451 -3.870 11.173 1.00 41.21 C ATOM 1358 NE ARG A 93 10.936 -5.266 11.363 1.00 32.44 N ATOM 1359 CZ ARG A 93 12.059 -5.624 12.017 1.00 71.31 C ATOM 1360 NH1 ARG A 93 12.958 -4.712 12.364 1.00 4.51 N ATOM 1361 NH2 ARG A 93 12.308 -6.915 12.252 1.00 14.33 N ATOM 0 H ARG A 93 6.313 -3.338 8.860 1.00 2.32 H new ATOM 0 HA ARG A 93 8.620 -4.711 7.702 1.00 25.31 H new ATOM 0 HB2 ARG A 93 7.764 -4.346 10.547 1.00 15.51 H new ATOM 0 HB3 ARG A 93 8.835 -5.650 10.074 1.00 15.51 H new ATOM 0 HG2 ARG A 93 10.347 -3.886 9.023 1.00 54.25 H new ATOM 0 HG3 ARG A 93 9.333 -2.672 9.776 1.00 54.25 H new ATOM 0 HD2 ARG A 93 11.301 -3.187 11.184 1.00 41.21 H new ATOM 0 HD3 ARG A 93 9.809 -3.593 12.009 1.00 41.21 H new ATOM 0 HE ARG A 93 10.370 -6.015 10.964 1.00 32.44 H new ATOM 0 HH11 ARG A 93 12.802 -3.730 12.136 1.00 4.51 H new ATOM 0 HH12 ARG A 93 13.805 -4.993 12.859 1.00 4.51 H new ATOM 0 HH21 ARG A 93 11.649 -7.627 11.937 1.00 14.33 H new ATOM 0 HH22 ARG A 93 13.157 -7.189 12.747 1.00 14.33 H new ATOM 1375 N ILE A 94 7.514 -6.880 7.544 1.00 42.54 N ATOM 1376 CA ILE A 94 6.902 -8.148 7.328 1.00 63.50 C ATOM 1377 C ILE A 94 7.748 -9.164 8.057 1.00 54.23 C ATOM 1378 O ILE A 94 8.930 -9.342 7.739 1.00 11.04 O ATOM 1379 CB ILE A 94 6.801 -8.530 5.799 1.00 31.23 C ATOM 1380 CG1 ILE A 94 5.910 -7.548 4.993 1.00 61.44 C ATOM 1381 CG2 ILE A 94 6.284 -9.956 5.616 1.00 30.13 C ATOM 1382 CD1 ILE A 94 6.499 -6.171 4.724 1.00 72.44 C ATOM 0 H ILE A 94 8.390 -6.755 7.036 1.00 42.54 H new ATOM 0 HA ILE A 94 5.877 -8.121 7.697 1.00 63.50 H new ATOM 0 HB ILE A 94 7.815 -8.460 5.406 1.00 31.23 H new ATOM 0 HG12 ILE A 94 5.670 -8.011 4.036 1.00 61.44 H new ATOM 0 HG13 ILE A 94 4.970 -7.419 5.530 1.00 61.44 H new ATOM 0 HG21 ILE A 94 6.226 -10.188 4.553 1.00 30.13 H new ATOM 0 HG22 ILE A 94 6.964 -10.655 6.104 1.00 30.13 H new ATOM 0 HG23 ILE A 94 5.293 -10.044 6.061 1.00 30.13 H new ATOM 0 HD11 ILE A 94 5.786 -5.575 4.154 1.00 72.44 H new ATOM 0 HD12 ILE A 94 6.711 -5.675 5.671 1.00 72.44 H new ATOM 0 HD13 ILE A 94 7.422 -6.275 4.154 1.00 72.44 H new ATOM 1394 N ASN A 95 7.194 -9.768 9.059 1.00 1.43 N ATOM 1395 CA ASN A 95 7.931 -10.728 9.836 1.00 72.21 C ATOM 1396 C ASN A 95 7.075 -11.930 10.124 1.00 52.45 C ATOM 1397 O ASN A 95 6.009 -11.809 10.736 1.00 1.24 O ATOM 1398 CB ASN A 95 8.422 -10.118 11.150 1.00 74.50 C ATOM 1399 CG ASN A 95 9.303 -11.067 11.964 1.00 54.24 C ATOM 1400 OD1 ASN A 95 10.124 -11.863 11.308 1.00 43.11 O flip ATOM 1401 ND2 ASN A 95 9.270 -11.048 13.184 1.00 1.04 N flip ATOM 0 H ASN A 95 6.232 -9.617 9.364 1.00 1.43 H new ATOM 0 HA ASN A 95 8.800 -11.033 9.253 1.00 72.21 H new ATOM 0 HB2 ASN A 95 8.982 -9.209 10.934 1.00 74.50 H new ATOM 0 HB3 ASN A 95 7.561 -9.826 11.752 1.00 74.50 H new ATOM 0 HD21 ASN A 95 8.625 -10.422 13.667 1.00 1.04 H new ATOM 0 HD22 ASN A 95 9.887 -11.658 13.720 1.00 1.04 H new ATOM 1408 N GLU A 96 7.536 -13.075 9.640 1.00 70.42 N ATOM 1409 CA GLU A 96 6.902 -14.376 9.841 1.00 53.45 C ATOM 1410 C GLU A 96 5.454 -14.367 9.370 1.00 22.31 C ATOM 1411 O GLU A 96 4.571 -14.952 9.989 1.00 71.25 O ATOM 1412 CB GLU A 96 7.041 -14.828 11.300 1.00 31.34 C ATOM 1413 CG GLU A 96 8.490 -14.915 11.744 1.00 11.12 C ATOM 1414 CD GLU A 96 8.665 -15.480 13.124 1.00 50.11 C ATOM 1415 OE1 GLU A 96 8.376 -14.783 14.108 1.00 41.14 O ATOM 1416 OE2 GLU A 96 9.129 -16.640 13.249 1.00 51.03 O ATOM 0 H GLU A 96 8.387 -13.129 9.080 1.00 70.42 H new ATOM 0 HA GLU A 96 7.422 -15.110 9.226 1.00 53.45 H new ATOM 0 HB2 GLU A 96 6.507 -14.131 11.946 1.00 31.34 H new ATOM 0 HB3 GLU A 96 6.567 -15.802 11.422 1.00 31.34 H new ATOM 0 HG2 GLU A 96 9.042 -15.533 11.035 1.00 11.12 H new ATOM 0 HG3 GLU A 96 8.932 -13.919 11.710 1.00 11.12 H new ATOM 1423 N GLY A 97 5.250 -13.712 8.241 1.00 33.31 N ATOM 1424 CA GLY A 97 3.945 -13.638 7.630 1.00 3.22 C ATOM 1425 C GLY A 97 3.081 -12.502 8.148 1.00 35.45 C ATOM 1426 O GLY A 97 2.048 -12.211 7.570 1.00 13.12 O ATOM 0 H GLY A 97 5.982 -13.221 7.728 1.00 33.31 H new ATOM 0 HA2 GLY A 97 4.066 -13.526 6.553 1.00 3.22 H new ATOM 0 HA3 GLY A 97 3.424 -14.581 7.796 1.00 3.22 H new ATOM 1430 N GLU A 98 3.515 -11.824 9.191 1.00 53.22 N ATOM 1431 CA GLU A 98 2.721 -10.746 9.732 1.00 62.25 C ATOM 1432 C GLU A 98 3.269 -9.418 9.277 1.00 0.11 C ATOM 1433 O GLU A 98 4.486 -9.193 9.279 1.00 75.02 O ATOM 1434 CB GLU A 98 2.659 -10.798 11.255 1.00 63.41 C ATOM 1435 CG GLU A 98 2.137 -12.110 11.792 1.00 2.32 C ATOM 1436 CD GLU A 98 1.898 -12.081 13.281 1.00 11.12 C ATOM 1437 OE1 GLU A 98 2.863 -11.889 14.040 1.00 12.11 O ATOM 1438 OE2 GLU A 98 0.749 -12.315 13.717 1.00 55.13 O ATOM 0 H GLU A 98 4.397 -11.997 9.672 1.00 53.22 H new ATOM 0 HA GLU A 98 1.704 -10.863 9.357 1.00 62.25 H new ATOM 0 HB2 GLU A 98 3.656 -10.621 11.658 1.00 63.41 H new ATOM 0 HB3 GLU A 98 2.022 -9.989 11.613 1.00 63.41 H new ATOM 0 HG2 GLU A 98 1.205 -12.360 11.284 1.00 2.32 H new ATOM 0 HG3 GLU A 98 2.849 -12.901 11.559 1.00 2.32 H new ATOM 1445 N PHE A 99 2.369 -8.563 8.880 1.00 12.05 N ATOM 1446 CA PHE A 99 2.685 -7.267 8.338 1.00 54.52 C ATOM 1447 C PHE A 99 2.381 -6.224 9.397 1.00 52.43 C ATOM 1448 O PHE A 99 1.297 -6.238 9.972 1.00 4.45 O ATOM 1449 CB PHE A 99 1.770 -6.979 7.127 1.00 61.54 C ATOM 1450 CG PHE A 99 1.720 -8.048 6.063 1.00 54.45 C ATOM 1451 CD1 PHE A 99 0.862 -9.134 6.197 1.00 54.23 C ATOM 1452 CD2 PHE A 99 2.503 -7.963 4.931 1.00 0.13 C ATOM 1453 CE1 PHE A 99 0.797 -10.109 5.228 1.00 1.11 C ATOM 1454 CE2 PHE A 99 2.443 -8.941 3.956 1.00 65.13 C ATOM 1455 CZ PHE A 99 1.589 -10.014 4.108 1.00 65.31 C ATOM 0 H PHE A 99 1.368 -8.751 8.925 1.00 12.05 H new ATOM 0 HA PHE A 99 3.732 -7.240 8.037 1.00 54.52 H new ATOM 0 HB2 PHE A 99 0.757 -6.813 7.494 1.00 61.54 H new ATOM 0 HB3 PHE A 99 2.098 -6.049 6.663 1.00 61.54 H new ATOM 0 HD1 PHE A 99 0.237 -9.213 7.074 1.00 54.23 H new ATOM 0 HD2 PHE A 99 3.170 -7.123 4.805 1.00 0.13 H new ATOM 0 HE1 PHE A 99 0.126 -10.947 5.347 1.00 1.11 H new ATOM 0 HE2 PHE A 99 3.064 -8.865 3.076 1.00 65.13 H new ATOM 0 HZ PHE A 99 1.543 -10.779 3.347 1.00 65.31 H new ATOM 1465 N GLU A 100 3.311 -5.370 9.686 1.00 72.43 N ATOM 1466 CA GLU A 100 3.062 -4.285 10.603 1.00 65.32 C ATOM 1467 C GLU A 100 3.522 -2.968 10.002 1.00 61.05 C ATOM 1468 O GLU A 100 4.581 -2.890 9.367 1.00 75.10 O ATOM 1469 CB GLU A 100 3.661 -4.546 11.994 1.00 14.10 C ATOM 1470 CG GLU A 100 5.159 -4.779 12.025 1.00 10.04 C ATOM 1471 CD GLU A 100 5.647 -5.103 13.410 1.00 71.02 C ATOM 1472 OE1 GLU A 100 5.966 -4.175 14.181 1.00 53.25 O ATOM 1473 OE2 GLU A 100 5.724 -6.300 13.763 1.00 54.42 O ATOM 0 H GLU A 100 4.256 -5.397 9.303 1.00 72.43 H new ATOM 0 HA GLU A 100 1.986 -4.216 10.760 1.00 65.32 H new ATOM 0 HB2 GLU A 100 3.430 -3.696 12.636 1.00 14.10 H new ATOM 0 HB3 GLU A 100 3.166 -5.416 12.426 1.00 14.10 H new ATOM 0 HG2 GLU A 100 5.413 -5.596 11.350 1.00 10.04 H new ATOM 0 HG3 GLU A 100 5.672 -3.890 11.658 1.00 10.04 H new ATOM 1480 N VAL A 101 2.715 -1.964 10.168 1.00 43.53 N ATOM 1481 CA VAL A 101 2.963 -0.658 9.622 1.00 62.11 C ATOM 1482 C VAL A 101 3.446 0.247 10.730 1.00 71.50 C ATOM 1483 O VAL A 101 2.796 0.356 11.771 1.00 62.10 O ATOM 1484 CB VAL A 101 1.657 -0.018 9.069 1.00 44.12 C ATOM 1485 CG1 VAL A 101 1.945 1.243 8.266 1.00 13.11 C ATOM 1486 CG2 VAL A 101 0.823 -1.008 8.275 1.00 45.02 C ATOM 0 H VAL A 101 1.846 -2.028 10.698 1.00 43.53 H new ATOM 0 HA VAL A 101 3.694 -0.766 8.821 1.00 62.11 H new ATOM 0 HB VAL A 101 1.061 0.274 9.933 1.00 44.12 H new ATOM 0 HG11 VAL A 101 1.009 1.661 7.897 1.00 13.11 H new ATOM 0 HG12 VAL A 101 2.442 1.974 8.903 1.00 13.11 H new ATOM 0 HG13 VAL A 101 2.591 0.998 7.423 1.00 13.11 H new ATOM 0 HG21 VAL A 101 -0.078 -0.515 7.910 1.00 45.02 H new ATOM 0 HG22 VAL A 101 1.403 -1.376 7.429 1.00 45.02 H new ATOM 0 HG23 VAL A 101 0.544 -1.845 8.915 1.00 45.02 H new ATOM 1496 N VAL A 102 4.563 0.860 10.535 1.00 64.00 N ATOM 1497 CA VAL A 102 5.066 1.823 11.467 1.00 73.13 C ATOM 1498 C VAL A 102 5.125 3.179 10.755 1.00 32.33 C ATOM 1499 O VAL A 102 5.693 3.283 9.664 1.00 53.00 O ATOM 1500 CB VAL A 102 6.481 1.434 11.989 1.00 23.22 C ATOM 1501 CG1 VAL A 102 7.011 2.467 12.976 1.00 2.22 C ATOM 1502 CG2 VAL A 102 6.469 0.048 12.624 1.00 72.41 C ATOM 0 H VAL A 102 5.160 0.710 9.722 1.00 64.00 H new ATOM 0 HA VAL A 102 4.405 1.865 12.333 1.00 73.13 H new ATOM 0 HB VAL A 102 7.151 1.412 11.130 1.00 23.22 H new ATOM 0 HG11 VAL A 102 8.000 2.166 13.321 1.00 2.22 H new ATOM 0 HG12 VAL A 102 7.078 3.438 12.486 1.00 2.22 H new ATOM 0 HG13 VAL A 102 6.335 2.537 13.828 1.00 2.22 H new ATOM 0 HG21 VAL A 102 7.470 -0.198 12.980 1.00 72.41 H new ATOM 0 HG22 VAL A 102 5.773 0.038 13.463 1.00 72.41 H new ATOM 0 HG23 VAL A 102 6.156 -0.689 11.884 1.00 72.41 H new ATOM 1512 N ASP A 103 4.525 4.181 11.342 1.00 2.41 N ATOM 1513 CA ASP A 103 4.487 5.535 10.758 1.00 44.53 C ATOM 1514 C ASP A 103 5.790 6.238 11.066 1.00 54.45 C ATOM 1515 O ASP A 103 6.269 6.201 12.208 1.00 14.33 O ATOM 1516 CB ASP A 103 3.309 6.343 11.364 1.00 30.43 C ATOM 1517 CG ASP A 103 3.145 7.791 10.844 1.00 21.43 C ATOM 1518 OD1 ASP A 103 4.047 8.645 11.065 1.00 12.44 O ATOM 1519 OD2 ASP A 103 2.079 8.101 10.267 1.00 72.23 O ATOM 0 H ASP A 103 4.044 4.102 12.238 1.00 2.41 H new ATOM 0 HA ASP A 103 4.347 5.461 9.680 1.00 44.53 H new ATOM 0 HB2 ASP A 103 2.384 5.801 11.170 1.00 30.43 H new ATOM 0 HB3 ASP A 103 3.436 6.378 12.446 1.00 30.43 H new ATOM 1524 N VAL A 104 6.354 6.868 10.073 1.00 13.25 N ATOM 1525 CA VAL A 104 7.604 7.608 10.216 1.00 74.32 C ATOM 1526 C VAL A 104 7.508 8.921 9.451 1.00 71.12 C ATOM 1527 O VAL A 104 8.503 9.606 9.207 1.00 34.21 O ATOM 1528 CB VAL A 104 8.818 6.791 9.686 1.00 14.23 C ATOM 1529 CG1 VAL A 104 9.129 5.609 10.601 1.00 45.52 C ATOM 1530 CG2 VAL A 104 8.538 6.293 8.278 1.00 63.53 C ATOM 0 H VAL A 104 5.966 6.890 9.130 1.00 13.25 H new ATOM 0 HA VAL A 104 7.761 7.799 11.277 1.00 74.32 H new ATOM 0 HB VAL A 104 9.686 7.450 9.671 1.00 14.23 H new ATOM 0 HG11 VAL A 104 9.982 5.057 10.205 1.00 45.52 H new ATOM 0 HG12 VAL A 104 9.366 5.975 11.600 1.00 45.52 H new ATOM 0 HG13 VAL A 104 8.262 4.950 10.652 1.00 45.52 H new ATOM 0 HG21 VAL A 104 9.394 5.723 7.917 1.00 63.53 H new ATOM 0 HG22 VAL A 104 7.654 5.655 8.287 1.00 63.53 H new ATOM 0 HG23 VAL A 104 8.365 7.144 7.619 1.00 63.53 H new ATOM 1540 N GLY A 105 6.306 9.275 9.110 1.00 50.11 N ATOM 1541 CA GLY A 105 6.077 10.431 8.329 1.00 11.11 C ATOM 1542 C GLY A 105 4.709 10.947 8.557 1.00 62.54 C ATOM 1543 O GLY A 105 3.846 10.898 7.666 1.00 1.22 O ATOM 0 H GLY A 105 5.463 8.764 9.370 1.00 50.11 H new ATOM 0 HA2 GLY A 105 6.808 11.199 8.582 1.00 11.11 H new ATOM 0 HA3 GLY A 105 6.213 10.197 7.273 1.00 11.11 H new ATOM 1547 N SER A 106 4.507 11.490 9.734 1.00 64.43 N ATOM 1548 CA SER A 106 3.225 12.032 10.163 1.00 24.25 C ATOM 1549 C SER A 106 2.877 13.367 9.452 1.00 11.35 C ATOM 1550 O SER A 106 2.137 14.191 9.976 1.00 30.20 O ATOM 1551 CB SER A 106 3.269 12.210 11.667 1.00 11.02 C ATOM 1552 OG SER A 106 3.615 10.979 12.289 1.00 4.24 O ATOM 0 H SER A 106 5.239 11.572 10.439 1.00 64.43 H new ATOM 0 HA SER A 106 2.435 11.334 9.886 1.00 24.25 H new ATOM 0 HB2 SER A 106 3.997 12.978 11.930 1.00 11.02 H new ATOM 0 HB3 SER A 106 2.300 12.551 12.030 1.00 11.02 H new ATOM 0 HG SER A 106 3.480 10.243 11.656 1.00 4.24 H new ATOM 1558 N LEU A 107 3.401 13.534 8.254 1.00 53.13 N ATOM 1559 CA LEU A 107 3.098 14.659 7.417 1.00 22.34 C ATOM 1560 C LEU A 107 1.799 14.313 6.719 1.00 53.13 C ATOM 1561 O LEU A 107 0.882 15.090 6.686 1.00 22.05 O ATOM 1562 CB LEU A 107 4.261 14.880 6.405 1.00 62.41 C ATOM 1563 CG LEU A 107 4.263 16.159 5.510 1.00 43.21 C ATOM 1564 CD1 LEU A 107 3.147 16.172 4.473 1.00 2.21 C ATOM 1565 CD2 LEU A 107 4.208 17.408 6.361 1.00 53.01 C ATOM 0 H LEU A 107 4.059 12.877 7.836 1.00 53.13 H new ATOM 0 HA LEU A 107 2.991 15.587 7.979 1.00 22.34 H new ATOM 0 HB2 LEU A 107 5.193 14.875 6.971 1.00 62.41 H new ATOM 0 HB3 LEU A 107 4.286 14.016 5.741 1.00 62.41 H new ATOM 0 HG LEU A 107 5.201 16.141 4.955 1.00 43.21 H new ATOM 0 HD11 LEU A 107 3.207 17.088 3.886 1.00 2.21 H new ATOM 0 HD12 LEU A 107 3.253 15.311 3.814 1.00 2.21 H new ATOM 0 HD13 LEU A 107 2.182 16.126 4.977 1.00 2.21 H new ATOM 0 HD21 LEU A 107 4.210 18.287 5.717 1.00 53.01 H new ATOM 0 HD22 LEU A 107 3.298 17.400 6.961 1.00 53.01 H new ATOM 0 HD23 LEU A 107 5.076 17.438 7.019 1.00 53.01 H new ATOM 1577 N ASN A 108 1.725 13.111 6.186 1.00 53.05 N ATOM 1578 CA ASN A 108 0.484 12.685 5.564 1.00 62.43 C ATOM 1579 C ASN A 108 -0.327 11.885 6.552 1.00 34.11 C ATOM 1580 O ASN A 108 -1.541 11.773 6.410 1.00 24.33 O ATOM 1581 CB ASN A 108 0.725 11.858 4.286 1.00 33.04 C ATOM 1582 CG ASN A 108 1.304 12.660 3.131 1.00 23.00 C ATOM 1583 OD1 ASN A 108 1.077 13.842 3.012 1.00 2.01 O ATOM 1584 ND2 ASN A 108 2.044 12.007 2.262 1.00 4.33 N ATOM 0 H ASN A 108 2.483 12.428 6.168 1.00 53.05 H new ATOM 0 HA ASN A 108 -0.064 13.580 5.270 1.00 62.43 H new ATOM 0 HB2 ASN A 108 1.402 11.036 4.520 1.00 33.04 H new ATOM 0 HB3 ASN A 108 -0.219 11.414 3.970 1.00 33.04 H new ATOM 0 HD21 ASN A 108 2.443 12.498 1.462 1.00 4.33 H new ATOM 0 HD22 ASN A 108 2.219 11.010 2.388 1.00 4.33 H new ATOM 1591 N GLY A 109 0.358 11.370 7.586 1.00 44.10 N ATOM 1592 CA GLY A 109 -0.287 10.597 8.627 1.00 14.35 C ATOM 1593 C GLY A 109 -0.695 9.220 8.152 1.00 52.35 C ATOM 1594 O GLY A 109 -1.263 9.066 7.069 1.00 53.43 O ATOM 0 H GLY A 109 1.364 11.483 7.712 1.00 44.10 H new ATOM 0 HA2 GLY A 109 0.389 10.500 9.476 1.00 14.35 H new ATOM 0 HA3 GLY A 109 -1.168 11.132 8.981 1.00 14.35 H new ATOM 1598 N THR A 110 -0.345 8.212 8.875 1.00 5.11 N ATOM 1599 CA THR A 110 -0.824 6.914 8.513 1.00 24.32 C ATOM 1600 C THR A 110 -2.234 6.724 9.079 1.00 72.02 C ATOM 1601 O THR A 110 -2.471 6.928 10.285 1.00 3.23 O ATOM 1602 CB THR A 110 0.112 5.817 9.069 1.00 44.22 C ATOM 1603 OG1 THR A 110 1.447 6.081 8.640 1.00 73.32 O ATOM 1604 CG2 THR A 110 -0.304 4.436 8.574 1.00 54.13 C ATOM 0 H THR A 110 0.254 8.252 9.699 1.00 5.11 H new ATOM 0 HA THR A 110 -0.846 6.832 7.426 1.00 24.32 H new ATOM 0 HB THR A 110 0.049 5.829 10.157 1.00 44.22 H new ATOM 0 HG1 THR A 110 1.756 6.924 9.033 1.00 73.32 H new ATOM 0 HG21 THR A 110 0.372 3.685 8.981 1.00 54.13 H new ATOM 0 HG22 THR A 110 -1.322 4.224 8.901 1.00 54.13 H new ATOM 0 HG23 THR A 110 -0.260 4.411 7.485 1.00 54.13 H new ATOM 1612 N TYR A 111 -3.156 6.342 8.230 1.00 4.43 N ATOM 1613 CA TYR A 111 -4.490 6.033 8.652 1.00 15.21 C ATOM 1614 C TYR A 111 -4.853 4.693 8.067 1.00 23.34 C ATOM 1615 O TYR A 111 -4.744 4.483 6.863 1.00 31.44 O ATOM 1616 CB TYR A 111 -5.497 7.104 8.171 1.00 30.14 C ATOM 1617 CG TYR A 111 -5.217 8.509 8.674 1.00 63.21 C ATOM 1618 CD1 TYR A 111 -5.681 8.927 9.906 1.00 51.01 C ATOM 1619 CD2 TYR A 111 -4.472 9.409 7.916 1.00 73.01 C ATOM 1620 CE1 TYR A 111 -5.420 10.200 10.375 1.00 4.42 C ATOM 1621 CE2 TYR A 111 -4.199 10.683 8.381 1.00 1.32 C ATOM 1622 CZ TYR A 111 -4.677 11.073 9.610 1.00 40.34 C ATOM 1623 OH TYR A 111 -4.396 12.337 10.096 1.00 72.42 O ATOM 0 H TYR A 111 -2.998 6.238 7.228 1.00 4.43 H new ATOM 0 HA TYR A 111 -4.533 6.013 9.741 1.00 15.21 H new ATOM 0 HB2 TYR A 111 -5.500 7.117 7.081 1.00 30.14 H new ATOM 0 HB3 TYR A 111 -6.498 6.811 8.489 1.00 30.14 H new ATOM 0 HD1 TYR A 111 -6.258 8.246 10.514 1.00 51.01 H new ATOM 0 HD2 TYR A 111 -4.101 9.107 6.948 1.00 73.01 H new ATOM 0 HE1 TYR A 111 -5.797 10.510 11.338 1.00 4.42 H new ATOM 0 HE2 TYR A 111 -3.615 11.367 7.783 1.00 1.32 H new ATOM 0 HH TYR A 111 -3.863 12.829 9.438 1.00 72.42 H new ATOM 1633 N VAL A 112 -5.270 3.794 8.894 1.00 72.14 N ATOM 1634 CA VAL A 112 -5.644 2.474 8.445 1.00 61.20 C ATOM 1635 C VAL A 112 -7.086 2.279 8.803 1.00 31.12 C ATOM 1636 O VAL A 112 -7.441 2.398 9.972 1.00 31.33 O ATOM 1637 CB VAL A 112 -4.782 1.353 9.105 1.00 42.22 C ATOM 1638 CG1 VAL A 112 -5.180 -0.023 8.576 1.00 52.20 C ATOM 1639 CG2 VAL A 112 -3.294 1.595 8.872 1.00 61.13 C ATOM 0 H VAL A 112 -5.365 3.942 9.899 1.00 72.14 H new ATOM 0 HA VAL A 112 -5.477 2.401 7.370 1.00 61.20 H new ATOM 0 HB VAL A 112 -4.971 1.381 10.178 1.00 42.22 H new ATOM 0 HG11 VAL A 112 -4.565 -0.787 9.051 1.00 52.20 H new ATOM 0 HG12 VAL A 112 -6.230 -0.210 8.802 1.00 52.20 H new ATOM 0 HG13 VAL A 112 -5.030 -0.055 7.497 1.00 52.20 H new ATOM 0 HG21 VAL A 112 -2.718 0.799 9.343 1.00 61.13 H new ATOM 0 HG22 VAL A 112 -3.090 1.606 7.801 1.00 61.13 H new ATOM 0 HG23 VAL A 112 -3.009 2.554 9.305 1.00 61.13 H new ATOM 1649 N ASN A 113 -7.920 2.062 7.793 1.00 21.51 N ATOM 1650 CA ASN A 113 -9.365 1.889 7.953 1.00 35.45 C ATOM 1651 C ASN A 113 -9.935 3.099 8.717 1.00 71.03 C ATOM 1652 O ASN A 113 -10.776 2.974 9.609 1.00 32.23 O ATOM 1653 CB ASN A 113 -9.684 0.530 8.639 1.00 11.24 C ATOM 1654 CG ASN A 113 -11.153 0.081 8.515 1.00 2.15 C ATOM 1655 OD1 ASN A 113 -12.085 0.888 8.483 1.00 12.53 O ATOM 1656 ND2 ASN A 113 -11.362 -1.210 8.437 1.00 51.03 N ATOM 0 H ASN A 113 -7.610 2.000 6.823 1.00 21.51 H new ATOM 0 HA ASN A 113 -9.850 1.854 6.978 1.00 35.45 H new ATOM 0 HB2 ASN A 113 -9.044 -0.240 8.207 1.00 11.24 H new ATOM 0 HB3 ASN A 113 -9.427 0.602 9.696 1.00 11.24 H new ATOM 0 HD21 ASN A 113 -12.313 -1.568 8.347 1.00 51.03 H new ATOM 0 HD22 ASN A 113 -10.574 -1.857 8.466 1.00 51.03 H new ATOM 1663 N ARG A 114 -9.405 4.291 8.342 1.00 2.34 N ATOM 1664 CA ARG A 114 -9.840 5.620 8.851 1.00 43.44 C ATOM 1665 C ARG A 114 -9.426 5.870 10.304 1.00 62.42 C ATOM 1666 O ARG A 114 -9.859 6.845 10.921 1.00 10.54 O ATOM 1667 CB ARG A 114 -11.347 5.797 8.660 1.00 32.35 C ATOM 1668 CG ARG A 114 -11.751 5.646 7.216 1.00 23.33 C ATOM 1669 CD ARG A 114 -13.216 5.341 7.079 1.00 55.10 C ATOM 1670 NE ARG A 114 -13.513 4.785 5.762 1.00 62.33 N ATOM 1671 CZ ARG A 114 -13.122 3.565 5.354 1.00 52.13 C ATOM 1672 NH1 ARG A 114 -12.497 2.727 6.201 1.00 24.00 N ATOM 1673 NH2 ARG A 114 -13.391 3.170 4.131 1.00 73.55 N ATOM 0 H ARG A 114 -8.647 4.358 7.663 1.00 2.34 H new ATOM 0 HA ARG A 114 -9.321 6.374 8.259 1.00 43.44 H new ATOM 0 HB2 ARG A 114 -11.879 5.062 9.265 1.00 32.35 H new ATOM 0 HB3 ARG A 114 -11.646 6.782 9.020 1.00 32.35 H new ATOM 0 HG2 ARG A 114 -11.518 6.563 6.675 1.00 23.33 H new ATOM 0 HG3 ARG A 114 -11.168 4.848 6.756 1.00 23.33 H new ATOM 0 HD2 ARG A 114 -13.518 4.635 7.852 1.00 55.10 H new ATOM 0 HD3 ARG A 114 -13.797 6.251 7.233 1.00 55.10 H new ATOM 0 HE ARG A 114 -14.050 5.358 5.111 1.00 62.33 H new ATOM 0 HH11 ARG A 114 -12.316 3.015 7.163 1.00 24.00 H new ATOM 0 HH12 ARG A 114 -12.204 1.804 5.882 1.00 24.00 H new ATOM 0 HH21 ARG A 114 -13.895 3.788 3.495 1.00 73.55 H new ATOM 0 HH22 ARG A 114 -13.096 2.245 3.817 1.00 73.55 H new ATOM 1687 N GLU A 115 -8.576 5.016 10.831 1.00 44.51 N ATOM 1688 CA GLU A 115 -8.071 5.181 12.176 1.00 15.25 C ATOM 1689 C GLU A 115 -6.636 5.697 12.125 1.00 71.13 C ATOM 1690 O GLU A 115 -5.802 5.138 11.390 1.00 4.24 O ATOM 1691 CB GLU A 115 -8.115 3.857 12.935 1.00 53.54 C ATOM 1692 CG GLU A 115 -9.502 3.259 13.055 1.00 44.24 C ATOM 1693 CD GLU A 115 -9.501 1.959 13.809 1.00 24.12 C ATOM 1694 OE1 GLU A 115 -9.619 1.976 15.051 1.00 14.41 O ATOM 1695 OE2 GLU A 115 -9.392 0.882 13.172 1.00 42.42 O ATOM 0 H GLU A 115 -8.218 4.194 10.344 1.00 44.51 H new ATOM 0 HA GLU A 115 -8.701 5.901 12.698 1.00 15.25 H new ATOM 0 HB2 GLU A 115 -7.464 3.141 12.433 1.00 53.54 H new ATOM 0 HB3 GLU A 115 -7.709 4.010 13.935 1.00 53.54 H new ATOM 0 HG2 GLU A 115 -10.158 3.968 13.559 1.00 44.24 H new ATOM 0 HG3 GLU A 115 -9.913 3.098 12.058 1.00 44.24 H new ATOM 1702 N PRO A 116 -6.329 6.774 12.872 1.00 3.24 N ATOM 1703 CA PRO A 116 -4.976 7.342 12.935 1.00 61.23 C ATOM 1704 C PRO A 116 -4.007 6.359 13.576 1.00 1.11 C ATOM 1705 O PRO A 116 -4.256 5.838 14.677 1.00 10.53 O ATOM 1706 CB PRO A 116 -5.140 8.590 13.816 1.00 22.22 C ATOM 1707 CG PRO A 116 -6.391 8.359 14.592 1.00 61.42 C ATOM 1708 CD PRO A 116 -7.280 7.525 13.717 1.00 41.13 C ATOM 0 HA PRO A 116 -4.571 7.570 11.949 1.00 61.23 H new ATOM 0 HB2 PRO A 116 -4.284 8.720 14.478 1.00 22.22 H new ATOM 0 HB3 PRO A 116 -5.214 9.493 13.210 1.00 22.22 H new ATOM 0 HG2 PRO A 116 -6.178 7.847 15.530 1.00 61.42 H new ATOM 0 HG3 PRO A 116 -6.871 9.304 14.846 1.00 61.42 H new ATOM 0 HD2 PRO A 116 -7.908 6.856 14.305 1.00 41.13 H new ATOM 0 HD3 PRO A 116 -7.947 8.144 13.117 1.00 41.13 H new ATOM 1716 N ARG A 117 -2.927 6.078 12.904 1.00 53.42 N ATOM 1717 CA ARG A 117 -2.002 5.101 13.393 1.00 52.43 C ATOM 1718 C ARG A 117 -0.601 5.623 13.518 1.00 34.34 C ATOM 1719 O ARG A 117 -0.240 6.658 12.961 1.00 2.01 O ATOM 1720 CB ARG A 117 -2.028 3.837 12.534 1.00 30.02 C ATOM 1721 CG ARG A 117 -3.338 3.081 12.600 1.00 65.21 C ATOM 1722 CD ARG A 117 -3.594 2.514 13.995 1.00 13.32 C ATOM 1723 NE ARG A 117 -4.895 1.833 14.088 1.00 3.33 N ATOM 1724 CZ ARG A 117 -5.431 1.348 15.219 1.00 0.31 C ATOM 1725 NH1 ARG A 117 -4.757 1.396 16.360 1.00 0.31 N ATOM 1726 NH2 ARG A 117 -6.628 0.792 15.191 1.00 55.32 N ATOM 0 H ARG A 117 -2.667 6.512 12.018 1.00 53.42 H new ATOM 0 HA ARG A 117 -2.334 4.851 14.401 1.00 52.43 H new ATOM 0 HB2 ARG A 117 -1.828 4.109 11.498 1.00 30.02 H new ATOM 0 HB3 ARG A 117 -1.221 3.176 12.852 1.00 30.02 H new ATOM 0 HG2 ARG A 117 -4.156 3.746 12.322 1.00 65.21 H new ATOM 0 HG3 ARG A 117 -3.326 2.268 11.874 1.00 65.21 H new ATOM 0 HD2 ARG A 117 -2.800 1.813 14.252 1.00 13.32 H new ATOM 0 HD3 ARG A 117 -3.555 3.321 14.726 1.00 13.32 H new ATOM 0 HE ARG A 117 -5.431 1.721 13.227 1.00 3.33 H new ATOM 0 HH11 ARG A 117 -3.823 1.804 16.384 1.00 0.31 H new ATOM 0 HH12 ARG A 117 -5.173 1.025 17.214 1.00 0.31 H new ATOM 0 HH21 ARG A 117 -7.142 0.732 14.312 1.00 55.32 H new ATOM 0 HH22 ARG A 117 -7.039 0.422 16.048 1.00 55.32 H new ATOM 1740 N ASN A 118 0.146 4.884 14.274 1.00 43.03 N ATOM 1741 CA ASN A 118 1.563 5.120 14.548 1.00 11.34 C ATOM 1742 C ASN A 118 2.284 3.796 14.370 1.00 54.40 C ATOM 1743 O ASN A 118 3.408 3.720 13.877 1.00 34.00 O ATOM 1744 CB ASN A 118 1.777 5.675 15.986 1.00 10.32 C ATOM 1745 CG ASN A 118 1.319 4.742 17.122 1.00 54.02 C ATOM 1746 OD1 ASN A 118 0.370 3.968 16.975 1.00 60.32 O ATOM 1747 ND2 ASN A 118 1.978 4.808 18.240 1.00 42.51 N ATOM 0 H ASN A 118 -0.214 4.056 14.748 1.00 43.03 H new ATOM 0 HA ASN A 118 1.958 5.870 13.862 1.00 11.34 H new ATOM 0 HB2 ASN A 118 2.837 5.893 16.121 1.00 10.32 H new ATOM 0 HB3 ASN A 118 1.243 6.621 16.077 1.00 10.32 H new ATOM 0 HD21 ASN A 118 1.714 4.210 19.023 1.00 42.51 H new ATOM 0 HD22 ASN A 118 2.759 5.457 18.334 1.00 42.51 H new ATOM 1754 N ALA A 119 1.616 2.770 14.802 1.00 24.03 N ATOM 1755 CA ALA A 119 1.993 1.406 14.604 1.00 64.21 C ATOM 1756 C ALA A 119 0.701 0.674 14.405 1.00 50.25 C ATOM 1757 O ALA A 119 -0.282 1.010 15.069 1.00 43.41 O ATOM 1758 CB ALA A 119 2.724 0.867 15.826 1.00 62.41 C ATOM 0 H ALA A 119 0.748 2.868 15.329 1.00 24.03 H new ATOM 0 HA ALA A 119 2.670 1.289 13.757 1.00 64.21 H new ATOM 0 HB1 ALA A 119 3.002 -0.173 15.654 1.00 62.41 H new ATOM 0 HB2 ALA A 119 3.622 1.458 16.003 1.00 62.41 H new ATOM 0 HB3 ALA A 119 2.072 0.929 16.697 1.00 62.41 H new ATOM 1764 N GLN A 120 0.645 -0.214 13.456 1.00 71.22 N ATOM 1765 CA GLN A 120 -0.587 -0.966 13.227 1.00 61.33 C ATOM 1766 C GLN A 120 -0.268 -2.318 12.604 1.00 50.52 C ATOM 1767 O GLN A 120 0.437 -2.378 11.610 1.00 51.30 O ATOM 1768 CB GLN A 120 -1.536 -0.126 12.322 1.00 72.24 C ATOM 1769 CG GLN A 120 -3.022 -0.538 12.320 1.00 64.12 C ATOM 1770 CD GLN A 120 -3.348 -1.756 11.502 1.00 63.31 C ATOM 1771 OE1 GLN A 120 -2.716 -2.030 10.494 1.00 73.11 O ATOM 1772 NE2 GLN A 120 -4.348 -2.486 11.921 1.00 52.25 N ATOM 0 H GLN A 120 1.416 -0.444 12.829 1.00 71.22 H new ATOM 0 HA GLN A 120 -1.091 -1.155 14.175 1.00 61.33 H new ATOM 0 HB2 GLN A 120 -1.471 0.917 12.633 1.00 72.24 H new ATOM 0 HB3 GLN A 120 -1.166 -0.177 11.298 1.00 72.24 H new ATOM 0 HG2 GLN A 120 -3.334 -0.717 13.349 1.00 64.12 H new ATOM 0 HG3 GLN A 120 -3.614 0.299 11.948 1.00 64.12 H new ATOM 0 HE21 GLN A 120 -4.851 -2.223 12.768 1.00 52.25 H new ATOM 0 HE22 GLN A 120 -4.625 -3.318 11.400 1.00 52.25 H new ATOM 1781 N VAL A 121 -0.739 -3.389 13.206 1.00 55.32 N ATOM 1782 CA VAL A 121 -0.575 -4.712 12.621 1.00 11.22 C ATOM 1783 C VAL A 121 -1.614 -4.843 11.520 1.00 62.01 C ATOM 1784 O VAL A 121 -2.820 -4.846 11.787 1.00 53.42 O ATOM 1785 CB VAL A 121 -0.730 -5.839 13.671 1.00 1.31 C ATOM 1786 CG1 VAL A 121 -0.533 -7.212 13.032 1.00 20.53 C ATOM 1787 CG2 VAL A 121 0.271 -5.636 14.793 1.00 43.14 C ATOM 0 H VAL A 121 -1.237 -3.375 14.096 1.00 55.32 H new ATOM 0 HA VAL A 121 0.433 -4.818 12.221 1.00 11.22 H new ATOM 0 HB VAL A 121 -1.741 -5.797 14.077 1.00 1.31 H new ATOM 0 HG11 VAL A 121 -0.647 -7.986 13.791 1.00 20.53 H new ATOM 0 HG12 VAL A 121 -1.277 -7.359 12.249 1.00 20.53 H new ATOM 0 HG13 VAL A 121 0.466 -7.272 12.600 1.00 20.53 H new ATOM 0 HG21 VAL A 121 0.158 -6.431 15.530 1.00 43.14 H new ATOM 0 HG22 VAL A 121 1.282 -5.658 14.387 1.00 43.14 H new ATOM 0 HG23 VAL A 121 0.093 -4.672 15.270 1.00 43.14 H new ATOM 1797 N MET A 122 -1.155 -5.047 10.332 1.00 51.14 N ATOM 1798 CA MET A 122 -1.927 -4.836 9.159 1.00 32.15 C ATOM 1799 C MET A 122 -2.740 -6.059 8.786 1.00 0.33 C ATOM 1800 O MET A 122 -2.282 -7.192 8.892 1.00 72.53 O ATOM 1801 CB MET A 122 -0.933 -4.530 8.077 1.00 30.03 C ATOM 1802 CG MET A 122 -1.453 -3.790 6.911 1.00 1.00 C ATOM 1803 SD MET A 122 -0.135 -3.457 5.755 1.00 52.31 S ATOM 1804 CE MET A 122 -0.935 -2.217 4.815 1.00 33.14 C ATOM 0 H MET A 122 -0.207 -5.374 10.147 1.00 51.14 H new ATOM 0 HA MET A 122 -2.645 -4.030 9.310 1.00 32.15 H new ATOM 0 HB2 MET A 122 -0.117 -3.954 8.513 1.00 30.03 H new ATOM 0 HB3 MET A 122 -0.508 -5.470 7.725 1.00 30.03 H new ATOM 0 HG2 MET A 122 -2.237 -4.370 6.423 1.00 1.00 H new ATOM 0 HG3 MET A 122 -1.905 -2.854 7.238 1.00 1.00 H new ATOM 0 HE1 MET A 122 -0.491 -2.171 3.821 1.00 33.14 H new ATOM 0 HE2 MET A 122 -1.995 -2.454 4.728 1.00 33.14 H new ATOM 0 HE3 MET A 122 -0.818 -1.253 5.310 1.00 33.14 H new ATOM 1814 N GLN A 123 -3.952 -5.798 8.356 1.00 32.21 N ATOM 1815 CA GLN A 123 -4.915 -6.813 8.025 1.00 24.51 C ATOM 1816 C GLN A 123 -5.517 -6.586 6.639 1.00 64.15 C ATOM 1817 O GLN A 123 -5.530 -5.468 6.129 1.00 42.12 O ATOM 1818 CB GLN A 123 -5.984 -6.904 9.112 1.00 3.50 C ATOM 1819 CG GLN A 123 -6.458 -5.558 9.627 1.00 62.14 C ATOM 1820 CD GLN A 123 -7.578 -5.687 10.618 1.00 61.30 C ATOM 1821 OE1 GLN A 123 -7.352 -5.819 11.816 1.00 31.30 O ATOM 1822 NE2 GLN A 123 -8.774 -5.593 10.144 1.00 10.33 N ATOM 0 H GLN A 123 -4.301 -4.849 8.225 1.00 32.21 H new ATOM 0 HA GLN A 123 -4.402 -7.774 7.983 1.00 24.51 H new ATOM 0 HB2 GLN A 123 -6.840 -7.453 8.720 1.00 3.50 H new ATOM 0 HB3 GLN A 123 -5.590 -7.482 9.947 1.00 3.50 H new ATOM 0 HG2 GLN A 123 -5.623 -5.036 10.093 1.00 62.14 H new ATOM 0 HG3 GLN A 123 -6.788 -4.946 8.787 1.00 62.14 H new ATOM 0 HE21 GLN A 123 -8.918 -5.484 9.140 1.00 10.33 H new ATOM 0 HE22 GLN A 123 -9.576 -5.628 10.773 1.00 10.33 H new ATOM 1831 N THR A 124 -5.996 -7.656 6.060 1.00 30.32 N ATOM 1832 CA THR A 124 -6.494 -7.699 4.698 1.00 53.33 C ATOM 1833 C THR A 124 -7.931 -7.154 4.553 1.00 24.15 C ATOM 1834 O THR A 124 -8.815 -7.453 5.362 1.00 43.11 O ATOM 1835 CB THR A 124 -6.372 -9.145 4.122 1.00 71.25 C ATOM 1836 OG1 THR A 124 -6.879 -9.226 2.788 1.00 11.24 O ATOM 1837 CG2 THR A 124 -7.073 -10.165 4.998 1.00 24.45 C ATOM 0 H THR A 124 -6.055 -8.556 6.536 1.00 30.32 H new ATOM 0 HA THR A 124 -5.866 -7.029 4.111 1.00 53.33 H new ATOM 0 HB THR A 124 -5.308 -9.379 4.106 1.00 71.25 H new ATOM 0 HG1 THR A 124 -6.934 -10.166 2.516 1.00 11.24 H new ATOM 0 HG21 THR A 124 -6.963 -11.157 4.560 1.00 24.45 H new ATOM 0 HG22 THR A 124 -6.629 -10.156 5.993 1.00 24.45 H new ATOM 0 HG23 THR A 124 -8.132 -9.916 5.071 1.00 24.45 H new ATOM 1845 N GLY A 125 -8.138 -6.340 3.534 1.00 32.03 N ATOM 1846 CA GLY A 125 -9.441 -5.785 3.239 1.00 54.14 C ATOM 1847 C GLY A 125 -9.579 -4.373 3.723 1.00 54.32 C ATOM 1848 O GLY A 125 -10.432 -3.617 3.237 1.00 42.11 O ATOM 0 H GLY A 125 -7.405 -6.046 2.888 1.00 32.03 H new ATOM 0 HA2 GLY A 125 -9.612 -5.817 2.163 1.00 54.14 H new ATOM 0 HA3 GLY A 125 -10.210 -6.403 3.702 1.00 54.14 H new ATOM 1852 N ASP A 126 -8.742 -4.014 4.652 1.00 15.12 N ATOM 1853 CA ASP A 126 -8.698 -2.676 5.194 1.00 43.40 C ATOM 1854 C ASP A 126 -8.024 -1.743 4.203 1.00 74.32 C ATOM 1855 O ASP A 126 -7.174 -2.170 3.392 1.00 32.15 O ATOM 1856 CB ASP A 126 -7.951 -2.648 6.541 1.00 10.34 C ATOM 1857 CG ASP A 126 -8.652 -3.417 7.649 1.00 23.32 C ATOM 1858 OD1 ASP A 126 -8.665 -4.657 7.614 1.00 43.53 O ATOM 1859 OD2 ASP A 126 -9.193 -2.777 8.597 1.00 40.40 O ATOM 0 H ASP A 126 -8.058 -4.648 5.065 1.00 15.12 H new ATOM 0 HA ASP A 126 -9.721 -2.341 5.369 1.00 43.40 H new ATOM 0 HB2 ASP A 126 -6.952 -3.062 6.400 1.00 10.34 H new ATOM 0 HB3 ASP A 126 -7.825 -1.612 6.854 1.00 10.34 H new ATOM 1864 N GLU A 127 -8.384 -0.497 4.249 1.00 24.03 N ATOM 1865 CA GLU A 127 -7.839 0.476 3.346 1.00 22.21 C ATOM 1866 C GLU A 127 -6.958 1.456 4.079 1.00 13.30 C ATOM 1867 O GLU A 127 -7.182 1.772 5.246 1.00 44.02 O ATOM 1868 CB GLU A 127 -8.914 1.211 2.520 1.00 54.14 C ATOM 1869 CG GLU A 127 -9.934 2.022 3.314 1.00 15.42 C ATOM 1870 CD GLU A 127 -10.927 1.175 4.062 1.00 41.24 C ATOM 1871 OE1 GLU A 127 -10.684 0.835 5.218 1.00 20.34 O ATOM 1872 OE2 GLU A 127 -12.014 0.886 3.504 1.00 33.21 O ATOM 0 H GLU A 127 -9.063 -0.124 4.912 1.00 24.03 H new ATOM 0 HA GLU A 127 -7.231 -0.078 2.630 1.00 22.21 H new ATOM 0 HB2 GLU A 127 -8.412 1.881 1.822 1.00 54.14 H new ATOM 0 HB3 GLU A 127 -9.451 0.474 1.923 1.00 54.14 H new ATOM 0 HG2 GLU A 127 -9.406 2.660 4.023 1.00 15.42 H new ATOM 0 HG3 GLU A 127 -10.472 2.681 2.632 1.00 15.42 H new ATOM 1879 N ILE A 128 -5.962 1.916 3.404 1.00 61.20 N ATOM 1880 CA ILE A 128 -4.994 2.803 3.967 1.00 23.02 C ATOM 1881 C ILE A 128 -5.282 4.166 3.403 1.00 62.21 C ATOM 1882 O ILE A 128 -5.353 4.341 2.179 1.00 12.35 O ATOM 1883 CB ILE A 128 -3.564 2.429 3.507 1.00 72.11 C ATOM 1884 CG1 ILE A 128 -3.319 0.926 3.619 1.00 72.13 C ATOM 1885 CG2 ILE A 128 -2.533 3.189 4.344 1.00 31.11 C ATOM 1886 CD1 ILE A 128 -2.025 0.488 2.970 1.00 14.22 C ATOM 0 H ILE A 128 -5.791 1.684 2.426 1.00 61.20 H new ATOM 0 HA ILE A 128 -5.050 2.758 5.055 1.00 23.02 H new ATOM 0 HB ILE A 128 -3.462 2.710 2.459 1.00 72.11 H new ATOM 0 HG12 ILE A 128 -3.305 0.643 4.672 1.00 72.13 H new ATOM 0 HG13 ILE A 128 -4.150 0.393 3.157 1.00 72.13 H new ATOM 0 HG21 ILE A 128 -1.529 2.921 4.015 1.00 31.11 H new ATOM 0 HG22 ILE A 128 -2.682 4.261 4.219 1.00 31.11 H new ATOM 0 HG23 ILE A 128 -2.653 2.926 5.395 1.00 31.11 H new ATOM 0 HD11 ILE A 128 -1.908 -0.590 3.083 1.00 14.22 H new ATOM 0 HD12 ILE A 128 -2.045 0.742 1.910 1.00 14.22 H new ATOM 0 HD13 ILE A 128 -1.188 0.996 3.449 1.00 14.22 H new ATOM 1898 N GLN A 129 -5.470 5.103 4.264 1.00 3.11 N ATOM 1899 CA GLN A 129 -5.749 6.435 3.866 1.00 54.53 C ATOM 1900 C GLN A 129 -4.516 7.234 4.224 1.00 50.34 C ATOM 1901 O GLN A 129 -4.007 7.142 5.350 1.00 75.12 O ATOM 1902 CB GLN A 129 -7.028 6.935 4.581 1.00 31.21 C ATOM 1903 CG GLN A 129 -7.711 8.160 3.949 1.00 64.14 C ATOM 1904 CD GLN A 129 -6.950 9.465 4.089 1.00 70.52 C ATOM 1905 OE1 GLN A 129 -6.231 9.689 5.045 1.00 72.55 O ATOM 1906 NE2 GLN A 129 -7.109 10.330 3.130 1.00 31.41 N ATOM 0 H GLN A 129 -5.434 4.964 5.274 1.00 3.11 H new ATOM 0 HA GLN A 129 -5.952 6.531 2.799 1.00 54.53 H new ATOM 0 HB2 GLN A 129 -7.748 6.117 4.612 1.00 31.21 H new ATOM 0 HB3 GLN A 129 -6.774 7.176 5.613 1.00 31.21 H new ATOM 0 HG2 GLN A 129 -7.869 7.962 2.889 1.00 64.14 H new ATOM 0 HG3 GLN A 129 -8.695 8.281 4.401 1.00 64.14 H new ATOM 0 HE21 GLN A 129 -7.719 10.112 2.342 1.00 31.41 H new ATOM 0 HE22 GLN A 129 -6.624 11.226 3.166 1.00 31.41 H new ATOM 1915 N ILE A 130 -3.990 7.930 3.262 1.00 12.31 N ATOM 1916 CA ILE A 130 -2.777 8.683 3.448 1.00 14.52 C ATOM 1917 C ILE A 130 -3.002 10.079 2.911 1.00 63.13 C ATOM 1918 O ILE A 130 -2.973 10.276 1.698 1.00 20.01 O ATOM 1919 CB ILE A 130 -1.608 8.014 2.644 1.00 32.15 C ATOM 1920 CG1 ILE A 130 -1.424 6.546 3.067 1.00 33.12 C ATOM 1921 CG2 ILE A 130 -0.307 8.794 2.801 1.00 24.04 C ATOM 1922 CD1 ILE A 130 -0.387 5.783 2.263 1.00 3.04 C ATOM 0 H ILE A 130 -4.386 7.995 2.324 1.00 12.31 H new ATOM 0 HA ILE A 130 -2.516 8.711 4.506 1.00 14.52 H new ATOM 0 HB ILE A 130 -1.878 8.033 1.588 1.00 32.15 H new ATOM 0 HG12 ILE A 130 -1.142 6.517 4.120 1.00 33.12 H new ATOM 0 HG13 ILE A 130 -2.382 6.033 2.980 1.00 33.12 H new ATOM 0 HG21 ILE A 130 0.482 8.303 2.231 1.00 24.04 H new ATOM 0 HG22 ILE A 130 -0.445 9.810 2.430 1.00 24.04 H new ATOM 0 HG23 ILE A 130 -0.027 8.827 3.854 1.00 24.04 H new ATOM 0 HD11 ILE A 130 -0.324 4.758 2.630 1.00 3.04 H new ATOM 0 HD12 ILE A 130 -0.675 5.775 1.212 1.00 3.04 H new ATOM 0 HD13 ILE A 130 0.584 6.267 2.370 1.00 3.04 H new ATOM 1934 N GLY A 131 -3.222 11.035 3.798 1.00 44.32 N ATOM 1935 CA GLY A 131 -3.478 12.419 3.399 1.00 23.11 C ATOM 1936 C GLY A 131 -4.738 12.573 2.534 1.00 4.11 C ATOM 1937 O GLY A 131 -5.828 12.851 3.033 1.00 53.25 O ATOM 0 H GLY A 131 -3.229 10.882 4.806 1.00 44.32 H new ATOM 0 HA2 GLY A 131 -3.580 13.035 4.292 1.00 23.11 H new ATOM 0 HA3 GLY A 131 -2.617 12.797 2.847 1.00 23.11 H new ATOM 1941 N LYS A 132 -4.580 12.352 1.248 1.00 31.51 N ATOM 1942 CA LYS A 132 -5.659 12.455 0.277 1.00 45.31 C ATOM 1943 C LYS A 132 -5.676 11.217 -0.630 1.00 74.20 C ATOM 1944 O LYS A 132 -6.406 11.153 -1.623 1.00 75.41 O ATOM 1945 CB LYS A 132 -5.500 13.748 -0.538 1.00 60.50 C ATOM 1946 CG LYS A 132 -4.124 13.916 -1.184 1.00 31.02 C ATOM 1947 CD LYS A 132 -3.967 15.282 -1.846 1.00 75.24 C ATOM 1948 CE LYS A 132 -4.827 15.441 -3.099 1.00 11.24 C ATOM 1949 NZ LYS A 132 -4.423 14.507 -4.179 1.00 53.55 N ATOM 0 H LYS A 132 -3.685 12.091 0.835 1.00 31.51 H new ATOM 0 HA LYS A 132 -6.616 12.496 0.798 1.00 45.31 H new ATOM 0 HB2 LYS A 132 -6.260 13.768 -1.319 1.00 60.50 H new ATOM 0 HB3 LYS A 132 -5.690 14.601 0.114 1.00 60.50 H new ATOM 0 HG2 LYS A 132 -3.350 13.789 -0.427 1.00 31.02 H new ATOM 0 HG3 LYS A 132 -3.974 13.133 -1.928 1.00 31.02 H new ATOM 0 HD2 LYS A 132 -4.232 16.059 -1.129 1.00 75.24 H new ATOM 0 HD3 LYS A 132 -2.920 15.434 -2.109 1.00 75.24 H new ATOM 0 HE2 LYS A 132 -5.873 15.268 -2.844 1.00 11.24 H new ATOM 0 HE3 LYS A 132 -4.752 16.466 -3.461 1.00 11.24 H new ATOM 0 HZ1 LYS A 132 -4.874 14.792 -5.071 1.00 53.55 H new ATOM 0 HZ2 LYS A 132 -3.389 14.531 -4.290 1.00 53.55 H new ATOM 0 HZ3 LYS A 132 -4.722 13.542 -3.933 1.00 53.55 H new ATOM 1963 N PHE A 133 -4.879 10.245 -0.271 1.00 43.12 N ATOM 1964 CA PHE A 133 -4.762 8.998 -1.000 1.00 43.53 C ATOM 1965 C PHE A 133 -5.531 7.915 -0.280 1.00 0.42 C ATOM 1966 O PHE A 133 -5.702 7.970 0.939 1.00 3.05 O ATOM 1967 CB PHE A 133 -3.300 8.522 -1.058 1.00 45.14 C ATOM 1968 CG PHE A 133 -2.339 9.336 -1.872 1.00 4.10 C ATOM 1969 CD1 PHE A 133 -1.823 10.530 -1.395 1.00 23.22 C ATOM 1970 CD2 PHE A 133 -1.912 8.870 -3.099 1.00 4.44 C ATOM 1971 CE1 PHE A 133 -0.904 11.241 -2.136 1.00 31.01 C ATOM 1972 CE2 PHE A 133 -1.002 9.576 -3.843 1.00 30.43 C ATOM 1973 CZ PHE A 133 -0.495 10.759 -3.365 1.00 11.45 C ATOM 0 H PHE A 133 -4.279 10.294 0.552 1.00 43.12 H new ATOM 0 HA PHE A 133 -5.146 9.175 -2.005 1.00 43.53 H new ATOM 0 HB2 PHE A 133 -2.921 8.475 -0.037 1.00 45.14 H new ATOM 0 HB3 PHE A 133 -3.293 7.504 -1.448 1.00 45.14 H new ATOM 0 HD1 PHE A 133 -2.144 10.907 -0.435 1.00 23.22 H new ATOM 0 HD2 PHE A 133 -2.300 7.936 -3.478 1.00 4.44 H new ATOM 0 HE1 PHE A 133 -0.505 12.171 -1.758 1.00 31.01 H new ATOM 0 HE2 PHE A 133 -0.684 9.202 -4.805 1.00 30.43 H new ATOM 0 HZ PHE A 133 0.224 11.313 -3.950 1.00 11.45 H new ATOM 1983 N ARG A 134 -5.997 6.953 -1.028 1.00 2.33 N ATOM 1984 CA ARG A 134 -6.572 5.750 -0.474 1.00 12.13 C ATOM 1985 C ARG A 134 -6.084 4.546 -1.243 1.00 13.04 C ATOM 1986 O ARG A 134 -6.163 4.502 -2.479 1.00 30.10 O ATOM 1987 CB ARG A 134 -8.122 5.751 -0.283 1.00 41.23 C ATOM 1988 CG ARG A 134 -8.980 6.287 -1.426 1.00 73.21 C ATOM 1989 CD ARG A 134 -9.088 7.805 -1.363 1.00 0.42 C ATOM 1990 NE ARG A 134 -9.975 8.350 -2.399 1.00 31.11 N ATOM 1991 CZ ARG A 134 -10.564 9.557 -2.350 1.00 23.32 C ATOM 1992 NH1 ARG A 134 -10.476 10.303 -1.261 1.00 14.23 N ATOM 1993 NH2 ARG A 134 -11.267 9.990 -3.381 1.00 24.23 N ATOM 0 H ARG A 134 -5.990 6.978 -2.048 1.00 2.33 H new ATOM 0 HA ARG A 134 -6.211 5.702 0.553 1.00 12.13 H new ATOM 0 HB2 ARG A 134 -8.435 4.727 -0.081 1.00 41.23 H new ATOM 0 HB3 ARG A 134 -8.349 6.335 0.609 1.00 41.23 H new ATOM 0 HG2 ARG A 134 -8.547 5.989 -2.381 1.00 73.21 H new ATOM 0 HG3 ARG A 134 -9.975 5.846 -1.376 1.00 73.21 H new ATOM 0 HD2 ARG A 134 -9.458 8.099 -0.381 1.00 0.42 H new ATOM 0 HD3 ARG A 134 -8.095 8.241 -1.473 1.00 0.42 H new ATOM 0 HE ARG A 134 -10.158 7.769 -3.217 1.00 31.11 H new ATOM 0 HH11 ARG A 134 -9.958 9.963 -0.451 1.00 14.23 H new ATOM 0 HH12 ARG A 134 -10.926 11.218 -1.232 1.00 14.23 H new ATOM 0 HH21 ARG A 134 -11.363 9.408 -4.213 1.00 24.23 H new ATOM 0 HH22 ARG A 134 -11.714 10.906 -3.345 1.00 24.23 H new ATOM 2007 N LEU A 135 -5.511 3.626 -0.520 1.00 70.23 N ATOM 2008 CA LEU A 135 -4.939 2.411 -1.054 1.00 31.34 C ATOM 2009 C LEU A 135 -5.652 1.242 -0.416 1.00 35.33 C ATOM 2010 O LEU A 135 -5.963 1.294 0.756 1.00 51.54 O ATOM 2011 CB LEU A 135 -3.411 2.301 -0.756 1.00 12.24 C ATOM 2012 CG LEU A 135 -2.452 3.365 -1.360 1.00 73.43 C ATOM 2013 CD1 LEU A 135 -2.622 4.738 -0.721 1.00 71.42 C ATOM 2014 CD2 LEU A 135 -1.009 2.907 -1.237 1.00 73.14 C ATOM 0 H LEU A 135 -5.424 3.699 0.494 1.00 70.23 H new ATOM 0 HA LEU A 135 -5.062 2.415 -2.137 1.00 31.34 H new ATOM 0 HB2 LEU A 135 -3.284 2.318 0.326 1.00 12.24 H new ATOM 0 HB3 LEU A 135 -3.077 1.322 -1.100 1.00 12.24 H new ATOM 0 HG LEU A 135 -2.715 3.466 -2.413 1.00 73.43 H new ATOM 0 HD11 LEU A 135 -1.928 5.442 -1.181 1.00 71.42 H new ATOM 0 HD12 LEU A 135 -3.644 5.085 -0.872 1.00 71.42 H new ATOM 0 HD13 LEU A 135 -2.416 4.670 0.347 1.00 71.42 H new ATOM 0 HD21 LEU A 135 -0.350 3.663 -1.664 1.00 73.14 H new ATOM 0 HD22 LEU A 135 -0.762 2.762 -0.185 1.00 73.14 H new ATOM 0 HD23 LEU A 135 -0.879 1.967 -1.773 1.00 73.14 H new ATOM 2026 N VAL A 136 -5.915 0.212 -1.156 1.00 74.22 N ATOM 2027 CA VAL A 136 -6.628 -0.931 -0.608 1.00 0.33 C ATOM 2028 C VAL A 136 -5.666 -2.099 -0.507 1.00 72.30 C ATOM 2029 O VAL A 136 -5.028 -2.467 -1.495 1.00 71.52 O ATOM 2030 CB VAL A 136 -7.848 -1.329 -1.494 1.00 24.43 C ATOM 2031 CG1 VAL A 136 -8.616 -2.499 -0.880 1.00 42.32 C ATOM 2032 CG2 VAL A 136 -8.780 -0.138 -1.705 1.00 53.05 C ATOM 0 H VAL A 136 -5.654 0.125 -2.138 1.00 74.22 H new ATOM 0 HA VAL A 136 -7.012 -0.663 0.376 1.00 0.33 H new ATOM 0 HB VAL A 136 -7.463 -1.643 -2.464 1.00 24.43 H new ATOM 0 HG11 VAL A 136 -9.461 -2.755 -1.519 1.00 42.32 H new ATOM 0 HG12 VAL A 136 -7.955 -3.361 -0.790 1.00 42.32 H new ATOM 0 HG13 VAL A 136 -8.980 -2.217 0.108 1.00 42.32 H new ATOM 0 HG21 VAL A 136 -9.623 -0.441 -2.326 1.00 53.05 H new ATOM 0 HG22 VAL A 136 -9.147 0.212 -0.740 1.00 53.05 H new ATOM 0 HG23 VAL A 136 -8.236 0.667 -2.200 1.00 53.05 H new ATOM 2042 N PHE A 137 -5.533 -2.632 0.689 1.00 22.32 N ATOM 2043 CA PHE A 137 -4.607 -3.708 0.977 1.00 35.52 C ATOM 2044 C PHE A 137 -5.354 -5.027 1.063 1.00 12.41 C ATOM 2045 O PHE A 137 -6.330 -5.147 1.804 1.00 32.14 O ATOM 2046 CB PHE A 137 -3.891 -3.400 2.305 1.00 15.32 C ATOM 2047 CG PHE A 137 -2.972 -4.479 2.823 1.00 2.12 C ATOM 2048 CD1 PHE A 137 -1.681 -4.604 2.348 1.00 30.05 C ATOM 2049 CD2 PHE A 137 -3.403 -5.354 3.808 1.00 74.14 C ATOM 2050 CE1 PHE A 137 -0.842 -5.581 2.843 1.00 63.13 C ATOM 2051 CE2 PHE A 137 -2.569 -6.329 4.307 1.00 70.22 C ATOM 2052 CZ PHE A 137 -1.289 -6.443 3.827 1.00 32.30 C ATOM 0 H PHE A 137 -6.072 -2.327 1.499 1.00 22.32 H new ATOM 0 HA PHE A 137 -3.869 -3.790 0.179 1.00 35.52 H new ATOM 0 HB2 PHE A 137 -3.312 -2.485 2.180 1.00 15.32 H new ATOM 0 HB3 PHE A 137 -4.646 -3.197 3.064 1.00 15.32 H new ATOM 0 HD1 PHE A 137 -1.325 -3.931 1.582 1.00 30.05 H new ATOM 0 HD2 PHE A 137 -4.410 -5.269 4.190 1.00 74.14 H new ATOM 0 HE1 PHE A 137 0.164 -5.672 2.462 1.00 63.13 H new ATOM 0 HE2 PHE A 137 -2.922 -7.002 5.074 1.00 70.22 H new ATOM 0 HZ PHE A 137 -0.631 -7.205 4.217 1.00 32.30 H new ATOM 2062 N LEU A 138 -4.912 -6.007 0.316 1.00 34.21 N ATOM 2063 CA LEU A 138 -5.546 -7.298 0.334 1.00 43.23 C ATOM 2064 C LEU A 138 -4.530 -8.430 0.283 1.00 63.34 C ATOM 2065 O LEU A 138 -3.604 -8.440 -0.536 1.00 31.34 O ATOM 2066 CB LEU A 138 -6.624 -7.467 -0.780 1.00 35.43 C ATOM 2067 CG LEU A 138 -6.192 -7.289 -2.259 1.00 73.14 C ATOM 2068 CD1 LEU A 138 -7.269 -7.843 -3.179 1.00 32.31 C ATOM 2069 CD2 LEU A 138 -5.971 -5.815 -2.601 1.00 42.33 C ATOM 0 H LEU A 138 -4.113 -5.934 -0.314 1.00 34.21 H new ATOM 0 HA LEU A 138 -6.069 -7.355 1.288 1.00 43.23 H new ATOM 0 HB2 LEU A 138 -7.054 -8.464 -0.677 1.00 35.43 H new ATOM 0 HB3 LEU A 138 -7.423 -6.753 -0.580 1.00 35.43 H new ATOM 0 HG LEU A 138 -5.255 -7.828 -2.398 1.00 73.14 H new ATOM 0 HD11 LEU A 138 -6.962 -7.716 -4.217 1.00 32.31 H new ATOM 0 HD12 LEU A 138 -7.415 -8.903 -2.971 1.00 32.31 H new ATOM 0 HD13 LEU A 138 -8.203 -7.308 -3.009 1.00 32.31 H new ATOM 0 HD21 LEU A 138 -5.669 -5.725 -3.644 1.00 42.33 H new ATOM 0 HD22 LEU A 138 -6.897 -5.262 -2.442 1.00 42.33 H new ATOM 0 HD23 LEU A 138 -5.189 -5.406 -1.961 1.00 42.33 H new ATOM 2081 N ALA A 139 -4.692 -9.366 1.168 1.00 61.22 N ATOM 2082 CA ALA A 139 -3.870 -10.533 1.200 1.00 63.52 C ATOM 2083 C ALA A 139 -4.724 -11.679 0.776 1.00 24.21 C ATOM 2084 O ALA A 139 -5.708 -12.000 1.450 1.00 14.44 O ATOM 2085 CB ALA A 139 -3.340 -10.779 2.612 1.00 5.24 C ATOM 0 H ALA A 139 -5.407 -9.339 1.895 1.00 61.22 H new ATOM 0 HA ALA A 139 -3.012 -10.413 0.539 1.00 63.52 H new ATOM 0 HB1 ALA A 139 -2.716 -11.673 2.616 1.00 5.24 H new ATOM 0 HB2 ALA A 139 -2.748 -9.922 2.933 1.00 5.24 H new ATOM 0 HB3 ALA A 139 -4.177 -10.918 3.296 1.00 5.24 H new ATOM 2091 N GLY A 140 -4.372 -12.310 -0.299 1.00 22.50 N ATOM 2092 CA GLY A 140 -5.211 -13.372 -0.768 1.00 34.41 C ATOM 2093 C GLY A 140 -4.690 -14.094 -1.981 1.00 40.23 C ATOM 2094 O GLY A 140 -4.256 -15.246 -1.855 1.00 65.34 O ATOM 0 H GLY A 140 -3.538 -12.120 -0.855 1.00 22.50 H new ATOM 0 HA2 GLY A 140 -5.346 -14.094 0.038 1.00 34.41 H new ATOM 0 HA3 GLY A 140 -6.195 -12.965 -0.999 1.00 34.41 H new ATOM 2098 N PRO A 141 -4.699 -13.451 -3.176 1.00 51.21 N ATOM 2099 CA PRO A 141 -4.325 -14.114 -4.424 1.00 55.35 C ATOM 2100 C PRO A 141 -2.895 -14.628 -4.423 1.00 33.12 C ATOM 2101 O PRO A 141 -1.967 -13.972 -3.930 1.00 2.41 O ATOM 2102 CB PRO A 141 -4.497 -13.042 -5.501 1.00 62.33 C ATOM 2103 CG PRO A 141 -5.348 -11.988 -4.876 1.00 71.54 C ATOM 2104 CD PRO A 141 -5.068 -12.040 -3.404 1.00 34.24 C ATOM 0 HA PRO A 141 -4.944 -14.996 -4.586 1.00 55.35 H new ATOM 0 HB2 PRO A 141 -3.533 -12.637 -5.810 1.00 62.33 H new ATOM 0 HB3 PRO A 141 -4.971 -13.453 -6.392 1.00 62.33 H new ATOM 0 HG2 PRO A 141 -5.111 -11.005 -5.283 1.00 71.54 H new ATOM 0 HG3 PRO A 141 -6.404 -12.170 -5.078 1.00 71.54 H new ATOM 0 HD2 PRO A 141 -4.261 -11.363 -3.124 1.00 34.24 H new ATOM 0 HD3 PRO A 141 -5.941 -11.753 -2.818 1.00 34.24 H new ATOM 2112 N ALA A 142 -2.729 -15.767 -5.023 1.00 62.35 N ATOM 2113 CA ALA A 142 -1.470 -16.438 -5.099 1.00 12.34 C ATOM 2114 C ALA A 142 -1.235 -16.832 -6.529 1.00 44.23 C ATOM 2115 O ALA A 142 -1.491 -17.978 -6.947 1.00 5.21 O ATOM 2116 CB ALA A 142 -1.433 -17.650 -4.178 1.00 53.43 C ATOM 0 H ALA A 142 -3.487 -16.268 -5.486 1.00 62.35 H new ATOM 0 HA ALA A 142 -0.676 -15.770 -4.765 1.00 12.34 H new ATOM 0 HB1 ALA A 142 -0.462 -18.139 -4.259 1.00 53.43 H new ATOM 0 HB2 ALA A 142 -1.593 -17.330 -3.149 1.00 53.43 H new ATOM 0 HB3 ALA A 142 -2.217 -18.350 -4.466 1.00 53.43 H new ATOM 2122 N GLU A 143 -0.872 -15.858 -7.288 1.00 2.41 N ATOM 2123 CA GLU A 143 -0.628 -16.012 -8.678 1.00 34.11 C ATOM 2124 C GLU A 143 0.867 -16.205 -8.877 1.00 63.40 C ATOM 2125 O GLU A 143 1.606 -15.204 -8.985 1.00 38.34 O ATOM 2126 CB GLU A 143 -1.133 -14.768 -9.402 1.00 10.51 C ATOM 2127 CG GLU A 143 -1.168 -14.875 -10.905 1.00 12.22 C ATOM 2128 CD GLU A 143 -1.621 -13.593 -11.535 1.00 31.20 C ATOM 2129 OE1 GLU A 143 -2.807 -13.214 -11.379 1.00 64.20 O ATOM 2130 OE2 GLU A 143 -0.810 -12.915 -12.170 1.00 42.03 O ATOM 2131 OXT GLU A 143 1.323 -17.365 -8.843 1.00 38.34 O ATOM 0 H GLU A 143 -0.733 -14.906 -6.949 1.00 2.41 H new ATOM 0 HA GLU A 143 -1.150 -16.878 -9.084 1.00 34.11 H new ATOM 0 HB2 GLU A 143 -2.138 -14.542 -9.046 1.00 10.51 H new ATOM 0 HB3 GLU A 143 -0.500 -13.924 -9.128 1.00 10.51 H new ATOM 0 HG2 GLU A 143 -0.176 -15.134 -11.276 1.00 12.22 H new ATOM 0 HG3 GLU A 143 -1.839 -15.683 -11.198 1.00 12.22 H new TER 2138 GLU A 143