USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 958 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 129 SER OG : rot 167:sc= -0.818 USER MOD Set 1.2: A 132 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 55 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 99 HIS : no HD1:sc= -4.02! C(o=-4!,f=-4.1!) USER MOD Set 3.1: A 58 TYR OH : rot 120:sc= 0.201 USER MOD Set 3.2: A 69 HIS : no HD1:sc= 0.0363 X(o=0.24,f=0.0056) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.00954 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0.00098 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 42:sc= 0.0895 USER MOD Single : A 13 THR OG1 : rot 43:sc= 1.11 USER MOD Single : A 15 GLN : amide:sc= -0.652! C(o=-0.65!,f=-0.74!) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 CYS SG : rot 170:sc= -2.1 USER MOD Single : A 29 SER OG : rot 8:sc= 0.575 USER MOD Single : A 30 MET CE :methyl 149:sc= -0.976 (180deg=-3.14!) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 46:sc= 0.624 USER MOD Single : A 48 ASN : amide:sc= -1.02 K(o=-1,f=-2.6!) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 78 HIS :FLIP no HD1:sc= -0.276 F(o=-1.2,f=-0.28) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ -140:sc= 0.0602 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 68:sc= 0.182 USER MOD Single : A 92 TYR OH : rot 180:sc= -0.814 USER MOD Single : A 100 THR OG1 : rot 41:sc= 0.912 USER MOD Single : A 108 SER OG : rot -98:sc= -0.775 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 179:sc= 0.583 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 26:sc= 0.605 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.085 15.104 -29.631 1.00 0.00 N ATOM 2 CA GLY A 1 6.439 13.871 -30.042 1.00 0.00 C ATOM 3 C GLY A 1 6.576 12.771 -29.008 1.00 0.00 C ATOM 4 O GLY A 1 7.631 12.147 -28.892 1.00 0.00 O ATOM 0 H1 GLY A 1 6.963 15.824 -30.372 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.657 15.442 -28.746 1.00 0.00 H new ATOM 0 H3 GLY A 1 8.099 14.931 -29.481 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.382 14.062 -30.226 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.871 13.535 -30.985 1.00 0.00 H new ATOM 8 N SER A 2 5.508 12.535 -28.253 1.00 0.00 N ATOM 9 CA SER A 2 5.516 11.507 -27.219 1.00 0.00 C ATOM 10 C SER A 2 4.888 10.215 -27.733 1.00 0.00 C ATOM 11 O SER A 2 4.416 10.149 -28.868 1.00 0.00 O ATOM 12 CB SER A 2 4.764 11.995 -25.979 1.00 0.00 C ATOM 13 OG SER A 2 5.175 11.288 -24.822 1.00 0.00 O ATOM 0 H SER A 2 4.627 13.041 -28.338 1.00 0.00 H new ATOM 0 HA SER A 2 6.553 11.305 -26.950 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.941 13.061 -25.839 1.00 0.00 H new ATOM 0 HB3 SER A 2 3.692 11.866 -26.126 1.00 0.00 H new ATOM 0 HG SER A 2 4.681 11.620 -24.043 1.00 0.00 H new ATOM 19 N SER A 3 4.885 9.189 -26.888 1.00 0.00 N ATOM 20 CA SER A 3 4.319 7.896 -27.256 1.00 0.00 C ATOM 21 C SER A 3 3.102 8.074 -28.158 1.00 0.00 C ATOM 22 O SER A 3 2.385 9.069 -28.063 1.00 0.00 O ATOM 23 CB SER A 3 3.929 7.110 -26.003 1.00 0.00 C ATOM 24 OG SER A 3 3.024 7.848 -25.200 1.00 0.00 O ATOM 0 H SER A 3 5.268 9.228 -25.944 1.00 0.00 H new ATOM 0 HA SER A 3 5.078 7.337 -27.804 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.475 6.162 -26.291 1.00 0.00 H new ATOM 0 HB3 SER A 3 4.823 6.873 -25.426 1.00 0.00 H new ATOM 0 HG SER A 3 2.789 7.324 -24.406 1.00 0.00 H new ATOM 30 N GLY A 4 2.874 7.100 -29.034 1.00 0.00 N ATOM 31 CA GLY A 4 1.743 7.167 -29.941 1.00 0.00 C ATOM 32 C GLY A 4 1.797 6.098 -31.015 1.00 0.00 C ATOM 33 O GLY A 4 1.530 6.370 -32.185 1.00 0.00 O ATOM 0 H GLY A 4 3.453 6.266 -29.132 1.00 0.00 H new ATOM 0 HA2 GLY A 4 0.819 7.061 -29.373 1.00 0.00 H new ATOM 0 HA3 GLY A 4 1.716 8.150 -30.412 1.00 0.00 H new ATOM 37 N SER A 5 2.145 4.878 -30.617 1.00 0.00 N ATOM 38 CA SER A 5 2.238 3.766 -31.554 1.00 0.00 C ATOM 39 C SER A 5 2.378 2.440 -30.813 1.00 0.00 C ATOM 40 O SER A 5 2.420 2.406 -29.583 1.00 0.00 O ATOM 41 CB SER A 5 3.427 3.964 -32.497 1.00 0.00 C ATOM 42 OG SER A 5 3.221 3.292 -33.727 1.00 0.00 O ATOM 0 H SER A 5 2.367 4.635 -29.651 1.00 0.00 H new ATOM 0 HA SER A 5 1.319 3.739 -32.139 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.576 5.028 -32.681 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.336 3.592 -32.024 1.00 0.00 H new ATOM 0 HG SER A 5 3.994 3.436 -34.312 1.00 0.00 H new ATOM 48 N SER A 6 2.451 1.350 -31.570 1.00 0.00 N ATOM 49 CA SER A 6 2.582 0.021 -30.985 1.00 0.00 C ATOM 50 C SER A 6 3.463 0.059 -29.740 1.00 0.00 C ATOM 51 O SER A 6 4.634 0.430 -29.806 1.00 0.00 O ATOM 52 CB SER A 6 3.169 -0.954 -32.009 1.00 0.00 C ATOM 53 OG SER A 6 3.223 -2.270 -31.487 1.00 0.00 O ATOM 0 H SER A 6 2.422 1.361 -32.590 1.00 0.00 H new ATOM 0 HA SER A 6 1.588 -0.321 -30.695 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.563 -0.943 -32.915 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.171 -0.630 -32.292 1.00 0.00 H new ATOM 0 HG SER A 6 3.600 -2.874 -32.161 1.00 0.00 H new ATOM 59 N GLY A 7 2.890 -0.327 -28.605 1.00 0.00 N ATOM 60 CA GLY A 7 3.636 -0.330 -27.360 1.00 0.00 C ATOM 61 C GLY A 7 4.024 -1.727 -26.919 1.00 0.00 C ATOM 62 O GLY A 7 5.208 -2.047 -26.811 1.00 0.00 O ATOM 0 H GLY A 7 1.922 -0.638 -28.525 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.536 0.273 -27.478 1.00 0.00 H new ATOM 0 HA3 GLY A 7 3.037 0.140 -26.580 1.00 0.00 H new ATOM 66 N THR A 8 3.023 -2.564 -26.661 1.00 0.00 N ATOM 67 CA THR A 8 3.265 -3.934 -26.227 1.00 0.00 C ATOM 68 C THR A 8 4.335 -3.986 -25.143 1.00 0.00 C ATOM 69 O THR A 8 5.072 -4.966 -25.032 1.00 0.00 O ATOM 70 CB THR A 8 3.698 -4.828 -27.404 1.00 0.00 C ATOM 71 OG1 THR A 8 4.516 -4.082 -28.311 1.00 0.00 O ATOM 72 CG2 THR A 8 2.485 -5.378 -28.140 1.00 0.00 C ATOM 0 H THR A 8 2.037 -2.316 -26.745 1.00 0.00 H new ATOM 0 HA THR A 8 2.324 -4.309 -25.823 1.00 0.00 H new ATOM 0 HB THR A 8 4.271 -5.665 -27.005 1.00 0.00 H new ATOM 0 HG1 THR A 8 5.148 -3.530 -27.804 1.00 0.00 H new ATOM 0 HG21 THR A 8 2.815 -6.006 -28.967 1.00 0.00 H new ATOM 0 HG22 THR A 8 1.880 -5.970 -27.453 1.00 0.00 H new ATOM 0 HG23 THR A 8 1.889 -4.552 -28.528 1.00 0.00 H new ATOM 80 N ILE A 9 4.416 -2.926 -24.346 1.00 0.00 N ATOM 81 CA ILE A 9 5.396 -2.853 -23.269 1.00 0.00 C ATOM 82 C ILE A 9 5.583 -4.212 -22.603 1.00 0.00 C ATOM 83 O ILE A 9 4.650 -5.010 -22.528 1.00 0.00 O ATOM 84 CB ILE A 9 4.983 -1.823 -22.202 1.00 0.00 C ATOM 85 CG1 ILE A 9 4.820 -0.439 -22.833 1.00 0.00 C ATOM 86 CG2 ILE A 9 6.011 -1.781 -21.081 1.00 0.00 C ATOM 87 CD1 ILE A 9 3.420 -0.167 -23.338 1.00 0.00 C ATOM 0 H ILE A 9 3.815 -2.106 -24.426 1.00 0.00 H new ATOM 0 HA ILE A 9 6.338 -2.540 -23.719 1.00 0.00 H new ATOM 0 HB ILE A 9 4.024 -2.124 -21.780 1.00 0.00 H new ATOM 0 HG12 ILE A 9 5.086 0.320 -22.098 1.00 0.00 H new ATOM 0 HG13 ILE A 9 5.522 -0.341 -23.661 1.00 0.00 H new ATOM 0 HG21 ILE A 9 5.705 -1.048 -20.334 1.00 0.00 H new ATOM 0 HG22 ILE A 9 6.083 -2.764 -20.616 1.00 0.00 H new ATOM 0 HG23 ILE A 9 6.982 -1.500 -21.488 1.00 0.00 H new ATOM 0 HD11 ILE A 9 3.378 0.832 -23.772 1.00 0.00 H new ATOM 0 HD12 ILE A 9 3.157 -0.904 -24.097 1.00 0.00 H new ATOM 0 HD13 ILE A 9 2.715 -0.232 -22.509 1.00 0.00 H new ATOM 99 N GLU A 10 6.795 -4.466 -22.120 1.00 0.00 N ATOM 100 CA GLU A 10 7.104 -5.728 -21.459 1.00 0.00 C ATOM 101 C GLU A 10 7.968 -5.497 -20.222 1.00 0.00 C ATOM 102 O GLU A 10 8.735 -4.537 -20.158 1.00 0.00 O ATOM 103 CB GLU A 10 7.820 -6.674 -22.425 1.00 0.00 C ATOM 104 CG GLU A 10 7.745 -8.135 -22.015 1.00 0.00 C ATOM 105 CD GLU A 10 8.824 -8.979 -22.663 1.00 0.00 C ATOM 106 OE1 GLU A 10 9.966 -8.489 -22.786 1.00 0.00 O ATOM 107 OE2 GLU A 10 8.528 -10.130 -23.048 1.00 0.00 O ATOM 0 H GLU A 10 7.578 -3.815 -22.174 1.00 0.00 H new ATOM 0 HA GLU A 10 6.165 -6.184 -21.145 1.00 0.00 H new ATOM 0 HB2 GLU A 10 7.386 -6.562 -23.419 1.00 0.00 H new ATOM 0 HB3 GLU A 10 8.867 -6.380 -22.499 1.00 0.00 H new ATOM 0 HG2 GLU A 10 7.833 -8.209 -20.931 1.00 0.00 H new ATOM 0 HG3 GLU A 10 6.767 -8.534 -22.283 1.00 0.00 H new ATOM 114 N ALA A 11 7.836 -6.385 -19.242 1.00 0.00 N ATOM 115 CA ALA A 11 8.605 -6.280 -18.008 1.00 0.00 C ATOM 116 C ALA A 11 9.557 -7.461 -17.851 1.00 0.00 C ATOM 117 O ALA A 11 9.194 -8.604 -18.131 1.00 0.00 O ATOM 118 CB ALA A 11 7.671 -6.190 -16.810 1.00 0.00 C ATOM 0 H ALA A 11 7.204 -7.185 -19.279 1.00 0.00 H new ATOM 0 HA ALA A 11 9.203 -5.370 -18.059 1.00 0.00 H new ATOM 0 HB1 ALA A 11 8.259 -6.112 -15.895 1.00 0.00 H new ATOM 0 HB2 ALA A 11 7.036 -5.310 -16.909 1.00 0.00 H new ATOM 0 HB3 ALA A 11 7.048 -7.084 -16.766 1.00 0.00 H new ATOM 124 N ARG A 12 10.776 -7.178 -17.404 1.00 0.00 N ATOM 125 CA ARG A 12 11.780 -8.217 -17.213 1.00 0.00 C ATOM 126 C ARG A 12 11.165 -9.455 -16.566 1.00 0.00 C ATOM 127 O ARG A 12 10.291 -9.350 -15.706 1.00 0.00 O ATOM 128 CB ARG A 12 12.928 -7.693 -16.348 1.00 0.00 C ATOM 129 CG ARG A 12 13.975 -6.918 -17.130 1.00 0.00 C ATOM 130 CD ARG A 12 15.090 -6.418 -16.224 1.00 0.00 C ATOM 131 NE ARG A 12 16.106 -7.441 -15.992 1.00 0.00 N ATOM 132 CZ ARG A 12 17.308 -7.182 -15.489 1.00 0.00 C ATOM 133 NH1 ARG A 12 17.643 -5.939 -15.168 1.00 0.00 N ATOM 134 NH2 ARG A 12 18.179 -8.166 -15.307 1.00 0.00 N ATOM 0 H ARG A 12 11.092 -6.238 -17.167 1.00 0.00 H new ATOM 0 HA ARG A 12 12.170 -8.496 -18.192 1.00 0.00 H new ATOM 0 HB2 ARG A 12 12.520 -7.050 -15.568 1.00 0.00 H new ATOM 0 HB3 ARG A 12 13.409 -8.534 -15.849 1.00 0.00 H new ATOM 0 HG2 ARG A 12 14.395 -7.555 -17.908 1.00 0.00 H new ATOM 0 HG3 ARG A 12 13.504 -6.072 -17.631 1.00 0.00 H new ATOM 0 HD2 ARG A 12 15.555 -5.540 -16.672 1.00 0.00 H new ATOM 0 HD3 ARG A 12 14.668 -6.103 -15.270 1.00 0.00 H new ATOM 0 HE ARG A 12 15.880 -8.407 -16.229 1.00 0.00 H new ATOM 0 HH11 ARG A 12 16.977 -5.179 -15.307 1.00 0.00 H new ATOM 0 HH12 ARG A 12 18.567 -5.743 -14.782 1.00 0.00 H new ATOM 0 HH21 ARG A 12 17.926 -9.123 -15.553 1.00 0.00 H new ATOM 0 HH22 ARG A 12 19.102 -7.966 -14.921 1.00 0.00 H new ATOM 148 N THR A 13 11.628 -10.628 -16.988 1.00 0.00 N ATOM 149 CA THR A 13 11.123 -11.886 -16.452 1.00 0.00 C ATOM 150 C THR A 13 11.837 -12.258 -15.158 1.00 0.00 C ATOM 151 O THR A 13 12.821 -12.996 -15.171 1.00 0.00 O ATOM 152 CB THR A 13 11.288 -13.034 -17.465 1.00 0.00 C ATOM 153 OG1 THR A 13 12.677 -13.242 -17.747 1.00 0.00 O ATOM 154 CG2 THR A 13 10.543 -12.729 -18.755 1.00 0.00 C ATOM 0 H THR A 13 12.352 -10.733 -17.699 1.00 0.00 H new ATOM 0 HA THR A 13 10.062 -11.740 -16.249 1.00 0.00 H new ATOM 0 HB THR A 13 10.867 -13.939 -17.027 1.00 0.00 H new ATOM 0 HG1 THR A 13 13.189 -13.204 -16.913 1.00 0.00 H new ATOM 0 HG21 THR A 13 10.674 -13.554 -19.455 1.00 0.00 H new ATOM 0 HG22 THR A 13 9.482 -12.600 -18.541 1.00 0.00 H new ATOM 0 HG23 THR A 13 10.938 -11.813 -19.195 1.00 0.00 H new ATOM 162 N ALA A 14 11.334 -11.742 -14.041 1.00 0.00 N ATOM 163 CA ALA A 14 11.923 -12.023 -12.737 1.00 0.00 C ATOM 164 C ALA A 14 12.002 -13.525 -12.483 1.00 0.00 C ATOM 165 O ALA A 14 11.136 -14.283 -12.918 1.00 0.00 O ATOM 166 CB ALA A 14 11.121 -11.341 -11.638 1.00 0.00 C ATOM 0 H ALA A 14 10.520 -11.127 -14.013 1.00 0.00 H new ATOM 0 HA ALA A 14 12.938 -11.626 -12.731 1.00 0.00 H new ATOM 0 HB1 ALA A 14 11.572 -11.559 -10.670 1.00 0.00 H new ATOM 0 HB2 ALA A 14 11.120 -10.264 -11.803 1.00 0.00 H new ATOM 0 HB3 ALA A 14 10.096 -11.711 -11.653 1.00 0.00 H new ATOM 172 N GLN A 15 13.046 -13.946 -11.776 1.00 0.00 N ATOM 173 CA GLN A 15 13.238 -15.358 -11.466 1.00 0.00 C ATOM 174 C GLN A 15 12.204 -15.838 -10.453 1.00 0.00 C ATOM 175 O GLN A 15 11.590 -16.890 -10.629 1.00 0.00 O ATOM 176 CB GLN A 15 14.649 -15.595 -10.924 1.00 0.00 C ATOM 177 CG GLN A 15 15.695 -15.778 -12.011 1.00 0.00 C ATOM 178 CD GLN A 15 15.209 -16.657 -13.147 1.00 0.00 C ATOM 179 OE1 GLN A 15 14.705 -17.758 -12.923 1.00 0.00 O ATOM 180 NE2 GLN A 15 15.359 -16.175 -14.375 1.00 0.00 N ATOM 0 H GLN A 15 13.771 -13.330 -11.407 1.00 0.00 H new ATOM 0 HA GLN A 15 13.109 -15.927 -12.386 1.00 0.00 H new ATOM 0 HB2 GLN A 15 14.934 -14.752 -10.295 1.00 0.00 H new ATOM 0 HB3 GLN A 15 14.641 -16.479 -10.287 1.00 0.00 H new ATOM 0 HG2 GLN A 15 15.977 -14.802 -12.407 1.00 0.00 H new ATOM 0 HG3 GLN A 15 16.593 -16.217 -11.576 1.00 0.00 H new ATOM 0 HE21 GLN A 15 15.782 -15.257 -14.515 1.00 0.00 H new ATOM 0 HE22 GLN A 15 15.051 -16.722 -15.179 1.00 0.00 H new ATOM 189 N SER A 16 12.017 -15.060 -9.391 1.00 0.00 N ATOM 190 CA SER A 16 11.060 -15.408 -8.348 1.00 0.00 C ATOM 191 C SER A 16 10.447 -14.154 -7.733 1.00 0.00 C ATOM 192 O SER A 16 11.141 -13.349 -7.111 1.00 0.00 O ATOM 193 CB SER A 16 11.740 -16.243 -7.260 1.00 0.00 C ATOM 194 OG SER A 16 10.784 -16.932 -6.474 1.00 0.00 O ATOM 0 H SER A 16 12.516 -14.185 -9.231 1.00 0.00 H new ATOM 0 HA SER A 16 10.263 -15.996 -8.803 1.00 0.00 H new ATOM 0 HB2 SER A 16 12.422 -16.959 -7.719 1.00 0.00 H new ATOM 0 HB3 SER A 16 12.341 -15.595 -6.622 1.00 0.00 H new ATOM 0 HG SER A 16 11.244 -17.459 -5.788 1.00 0.00 H new ATOM 200 N THR A 17 9.139 -13.994 -7.910 1.00 0.00 N ATOM 201 CA THR A 17 8.431 -12.839 -7.375 1.00 0.00 C ATOM 202 C THR A 17 7.230 -13.268 -6.540 1.00 0.00 C ATOM 203 O THR A 17 6.625 -14.315 -6.771 1.00 0.00 O ATOM 204 CB THR A 17 7.950 -11.903 -8.501 1.00 0.00 C ATOM 205 OG1 THR A 17 7.496 -12.675 -9.618 1.00 0.00 O ATOM 206 CG2 THR A 17 9.068 -10.971 -8.943 1.00 0.00 C ATOM 0 H THR A 17 8.549 -14.651 -8.420 1.00 0.00 H new ATOM 0 HA THR A 17 9.137 -12.302 -6.742 1.00 0.00 H new ATOM 0 HB THR A 17 7.127 -11.301 -8.117 1.00 0.00 H new ATOM 0 HG1 THR A 17 7.190 -12.074 -10.329 1.00 0.00 H new ATOM 0 HG21 THR A 17 8.706 -10.320 -9.738 1.00 0.00 H new ATOM 0 HG22 THR A 17 9.392 -10.365 -8.097 1.00 0.00 H new ATOM 0 HG23 THR A 17 9.908 -11.560 -9.311 1.00 0.00 H new ATOM 214 N PRO A 18 6.874 -12.442 -5.544 1.00 0.00 N ATOM 215 CA PRO A 18 5.742 -12.716 -4.655 1.00 0.00 C ATOM 216 C PRO A 18 4.400 -12.590 -5.370 1.00 0.00 C ATOM 217 O PRO A 18 4.268 -11.836 -6.333 1.00 0.00 O ATOM 218 CB PRO A 18 5.873 -11.641 -3.573 1.00 0.00 C ATOM 219 CG PRO A 18 6.613 -10.528 -4.231 1.00 0.00 C ATOM 220 CD PRO A 18 7.551 -11.177 -5.211 1.00 0.00 C ATOM 0 HA PRO A 18 5.764 -13.735 -4.269 1.00 0.00 H new ATOM 0 HB2 PRO A 18 4.895 -11.312 -3.221 1.00 0.00 H new ATOM 0 HB3 PRO A 18 6.414 -12.017 -2.705 1.00 0.00 H new ATOM 0 HG2 PRO A 18 5.927 -9.849 -4.738 1.00 0.00 H new ATOM 0 HG3 PRO A 18 7.162 -9.937 -3.498 1.00 0.00 H new ATOM 0 HD2 PRO A 18 7.701 -10.557 -6.095 1.00 0.00 H new ATOM 0 HD3 PRO A 18 8.534 -11.350 -4.772 1.00 0.00 H new ATOM 228 N SER A 19 3.408 -13.335 -4.891 1.00 0.00 N ATOM 229 CA SER A 19 2.078 -13.309 -5.487 1.00 0.00 C ATOM 230 C SER A 19 1.098 -12.553 -4.595 1.00 0.00 C ATOM 231 O SER A 19 0.541 -11.530 -4.993 1.00 0.00 O ATOM 232 CB SER A 19 1.574 -14.734 -5.723 1.00 0.00 C ATOM 233 OG SER A 19 0.678 -14.783 -6.820 1.00 0.00 O ATOM 0 H SER A 19 3.501 -13.963 -4.093 1.00 0.00 H new ATOM 0 HA SER A 19 2.146 -12.792 -6.444 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.420 -15.396 -5.910 1.00 0.00 H new ATOM 0 HB3 SER A 19 1.075 -15.100 -4.826 1.00 0.00 H new ATOM 0 HG SER A 19 0.372 -15.705 -6.951 1.00 0.00 H new ATOM 239 N ALA A 20 0.892 -13.065 -3.385 1.00 0.00 N ATOM 240 CA ALA A 20 -0.018 -12.438 -2.435 1.00 0.00 C ATOM 241 C ALA A 20 0.561 -11.134 -1.898 1.00 0.00 C ATOM 242 O ALA A 20 -0.007 -10.056 -2.071 1.00 0.00 O ATOM 243 CB ALA A 20 -0.326 -13.392 -1.291 1.00 0.00 C ATOM 0 H ALA A 20 1.343 -13.912 -3.040 1.00 0.00 H new ATOM 0 HA ALA A 20 -0.945 -12.204 -2.958 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -1.007 -12.911 -0.589 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -0.791 -14.295 -1.686 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.599 -13.655 -0.777 1.00 0.00 H new ATOM 249 N PRO A 21 1.720 -11.232 -1.229 1.00 0.00 N ATOM 250 CA PRO A 21 2.402 -10.069 -0.652 1.00 0.00 C ATOM 251 C PRO A 21 2.983 -9.149 -1.720 1.00 0.00 C ATOM 252 O PRO A 21 3.479 -9.595 -2.754 1.00 0.00 O ATOM 253 CB PRO A 21 3.522 -10.694 0.184 1.00 0.00 C ATOM 254 CG PRO A 21 3.780 -12.014 -0.456 1.00 0.00 C ATOM 255 CD PRO A 21 2.454 -12.485 -0.985 1.00 0.00 C ATOM 0 HA PRO A 21 1.722 -9.441 -0.077 1.00 0.00 H new ATOM 0 HB2 PRO A 21 4.416 -10.070 0.179 1.00 0.00 H new ATOM 0 HB3 PRO A 21 3.221 -10.811 1.225 1.00 0.00 H new ATOM 0 HG2 PRO A 21 4.510 -11.922 -1.260 1.00 0.00 H new ATOM 0 HG3 PRO A 21 4.187 -12.724 0.264 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.570 -13.067 -1.899 1.00 0.00 H new ATOM 0 HD3 PRO A 21 1.937 -13.120 -0.266 1.00 0.00 H new ATOM 263 N PRO A 22 2.922 -7.834 -1.466 1.00 0.00 N ATOM 264 CA PRO A 22 2.332 -7.291 -0.238 1.00 0.00 C ATOM 265 C PRO A 22 0.819 -7.470 -0.193 1.00 0.00 C ATOM 266 O PRO A 22 0.116 -7.125 -1.143 1.00 0.00 O ATOM 267 CB PRO A 22 2.694 -5.805 -0.298 1.00 0.00 C ATOM 268 CG PRO A 22 2.869 -5.516 -1.749 1.00 0.00 C ATOM 269 CD PRO A 22 3.422 -6.774 -2.358 1.00 0.00 C ATOM 0 HA PRO A 22 2.704 -7.799 0.652 1.00 0.00 H new ATOM 0 HB2 PRO A 22 1.907 -5.188 0.136 1.00 0.00 H new ATOM 0 HB3 PRO A 22 3.607 -5.597 0.260 1.00 0.00 H new ATOM 0 HG2 PRO A 22 1.919 -5.244 -2.210 1.00 0.00 H new ATOM 0 HG3 PRO A 22 3.549 -4.678 -1.901 1.00 0.00 H new ATOM 0 HD2 PRO A 22 3.073 -6.912 -3.381 1.00 0.00 H new ATOM 0 HD3 PRO A 22 4.511 -6.759 -2.392 1.00 0.00 H new ATOM 277 N GLN A 23 0.324 -8.010 0.915 1.00 0.00 N ATOM 278 CA GLN A 23 -1.107 -8.234 1.082 1.00 0.00 C ATOM 279 C GLN A 23 -1.644 -7.459 2.281 1.00 0.00 C ATOM 280 O GLN A 23 -0.922 -6.679 2.903 1.00 0.00 O ATOM 281 CB GLN A 23 -1.394 -9.727 1.256 1.00 0.00 C ATOM 282 CG GLN A 23 -0.332 -10.461 2.058 1.00 0.00 C ATOM 283 CD GLN A 23 -0.725 -11.891 2.375 1.00 0.00 C ATOM 284 OE1 GLN A 23 -1.821 -12.149 2.874 1.00 0.00 O ATOM 285 NE2 GLN A 23 0.169 -12.829 2.087 1.00 0.00 N ATOM 0 H GLN A 23 0.892 -8.301 1.711 1.00 0.00 H new ATOM 0 HA GLN A 23 -1.612 -7.875 0.185 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -2.358 -9.848 1.749 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -1.479 -10.189 0.273 1.00 0.00 H new ATOM 0 HG2 GLN A 23 0.604 -10.461 1.500 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -0.149 -9.924 2.988 1.00 0.00 H new ATOM 0 HE21 GLN A 23 1.065 -12.570 1.674 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -0.040 -13.809 2.279 1.00 0.00 H new ATOM 294 N LYS A 24 -2.915 -7.676 2.599 1.00 0.00 N ATOM 295 CA LYS A 24 -3.549 -6.999 3.724 1.00 0.00 C ATOM 296 C LYS A 24 -3.071 -5.555 3.829 1.00 0.00 C ATOM 297 O LYS A 24 -2.899 -5.025 4.928 1.00 0.00 O ATOM 298 CB LYS A 24 -3.251 -7.743 5.028 1.00 0.00 C ATOM 299 CG LYS A 24 -3.479 -9.242 4.939 1.00 0.00 C ATOM 300 CD LYS A 24 -3.062 -9.946 6.219 1.00 0.00 C ATOM 301 CE LYS A 24 -4.012 -9.633 7.364 1.00 0.00 C ATOM 302 NZ LYS A 24 -5.247 -10.463 7.303 1.00 0.00 N ATOM 0 H LYS A 24 -3.527 -8.316 2.093 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.626 -6.995 3.554 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -2.216 -7.558 5.314 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.878 -7.335 5.821 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.532 -9.440 4.741 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -2.915 -9.648 4.099 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -3.036 -11.023 6.051 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -2.051 -9.641 6.490 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -3.505 -9.805 8.314 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -4.282 -8.577 7.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -5.869 -10.220 8.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -5.744 -10.280 6.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -4.992 -11.470 7.358 1.00 0.00 H new ATOM 316 N VAL A 25 -2.858 -4.921 2.680 1.00 0.00 N ATOM 317 CA VAL A 25 -2.401 -3.537 2.644 1.00 0.00 C ATOM 318 C VAL A 25 -3.450 -2.597 3.227 1.00 0.00 C ATOM 319 O VAL A 25 -4.528 -2.424 2.660 1.00 0.00 O ATOM 320 CB VAL A 25 -2.072 -3.092 1.206 1.00 0.00 C ATOM 321 CG1 VAL A 25 -1.657 -1.629 1.181 1.00 0.00 C ATOM 322 CG2 VAL A 25 -0.985 -3.974 0.612 1.00 0.00 C ATOM 0 H VAL A 25 -2.995 -5.344 1.762 1.00 0.00 H new ATOM 0 HA VAL A 25 -1.495 -3.487 3.249 1.00 0.00 H new ATOM 0 HB VAL A 25 -2.969 -3.200 0.596 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -1.429 -1.333 0.157 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.471 -1.013 1.564 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -0.774 -1.491 1.804 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -0.765 -3.646 -0.404 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -0.084 -3.900 1.220 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -1.326 -5.009 0.593 1.00 0.00 H new ATOM 332 N MET A 26 -3.126 -1.991 4.365 1.00 0.00 N ATOM 333 CA MET A 26 -4.040 -1.066 5.025 1.00 0.00 C ATOM 334 C MET A 26 -3.427 0.328 5.122 1.00 0.00 C ATOM 335 O MET A 26 -2.374 0.512 5.733 1.00 0.00 O ATOM 336 CB MET A 26 -4.396 -1.577 6.422 1.00 0.00 C ATOM 337 CG MET A 26 -5.372 -2.743 6.412 1.00 0.00 C ATOM 338 SD MET A 26 -6.884 -2.375 5.503 1.00 0.00 S ATOM 339 CE MET A 26 -7.307 -3.999 4.878 1.00 0.00 C ATOM 0 H MET A 26 -2.238 -2.124 4.849 1.00 0.00 H new ATOM 0 HA MET A 26 -4.949 -1.003 4.426 1.00 0.00 H new ATOM 0 HB2 MET A 26 -3.482 -1.883 6.932 1.00 0.00 H new ATOM 0 HB3 MET A 26 -4.825 -0.759 7.001 1.00 0.00 H new ATOM 0 HG2 MET A 26 -4.888 -3.613 5.968 1.00 0.00 H new ATOM 0 HG3 MET A 26 -5.625 -3.009 7.438 1.00 0.00 H new ATOM 0 HE1 MET A 26 -8.224 -3.936 4.292 1.00 0.00 H new ATOM 0 HE2 MET A 26 -6.498 -4.368 4.247 1.00 0.00 H new ATOM 0 HE3 MET A 26 -7.456 -4.683 5.714 1.00 0.00 H new ATOM 349 N CYS A 27 -4.093 1.305 4.516 1.00 0.00 N ATOM 350 CA CYS A 27 -3.613 2.682 4.533 1.00 0.00 C ATOM 351 C CYS A 27 -4.448 3.537 5.480 1.00 0.00 C ATOM 352 O CYS A 27 -5.660 3.351 5.595 1.00 0.00 O ATOM 353 CB CYS A 27 -3.650 3.275 3.124 1.00 0.00 C ATOM 354 SG CYS A 27 -2.747 2.306 1.892 1.00 0.00 S ATOM 0 H CYS A 27 -4.966 1.169 4.007 1.00 0.00 H new ATOM 0 HA CYS A 27 -2.583 2.677 4.890 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -4.689 3.368 2.807 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -3.235 4.282 3.154 1.00 0.00 H new ATOM 0 HG CYS A 27 -3.010 2.762 0.703 1.00 0.00 H new ATOM 360 N VAL A 28 -3.793 4.475 6.157 1.00 0.00 N ATOM 361 CA VAL A 28 -4.475 5.359 7.094 1.00 0.00 C ATOM 362 C VAL A 28 -3.857 6.752 7.085 1.00 0.00 C ATOM 363 O VAL A 28 -2.636 6.902 7.144 1.00 0.00 O ATOM 364 CB VAL A 28 -4.429 4.799 8.528 1.00 0.00 C ATOM 365 CG1 VAL A 28 -5.195 3.487 8.614 1.00 0.00 C ATOM 366 CG2 VAL A 28 -2.989 4.616 8.983 1.00 0.00 C ATOM 0 H VAL A 28 -2.790 4.642 6.074 1.00 0.00 H new ATOM 0 HA VAL A 28 -5.514 5.423 6.769 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.908 5.516 9.195 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -5.151 3.106 9.634 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -6.235 3.654 8.333 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -4.748 2.760 7.936 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -2.976 4.220 9.998 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.482 3.920 8.315 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -2.476 5.577 8.962 1.00 0.00 H new ATOM 376 N SER A 29 -4.708 7.771 7.010 1.00 0.00 N ATOM 377 CA SER A 29 -4.245 9.153 6.989 1.00 0.00 C ATOM 378 C SER A 29 -3.675 9.556 8.346 1.00 0.00 C ATOM 379 O SER A 29 -4.368 9.505 9.362 1.00 0.00 O ATOM 380 CB SER A 29 -5.391 10.091 6.606 1.00 0.00 C ATOM 381 OG SER A 29 -6.314 10.232 7.672 1.00 0.00 O ATOM 0 H SER A 29 -5.721 7.665 6.963 1.00 0.00 H new ATOM 0 HA SER A 29 -3.454 9.234 6.244 1.00 0.00 H new ATOM 0 HB2 SER A 29 -4.990 11.068 6.336 1.00 0.00 H new ATOM 0 HB3 SER A 29 -5.904 9.703 5.726 1.00 0.00 H new ATOM 0 HG SER A 29 -5.958 9.794 8.473 1.00 0.00 H new ATOM 387 N MET A 30 -2.408 9.956 8.353 1.00 0.00 N ATOM 388 CA MET A 30 -1.745 10.369 9.585 1.00 0.00 C ATOM 389 C MET A 30 -2.246 11.736 10.040 1.00 0.00 C ATOM 390 O MET A 30 -2.508 11.949 11.223 1.00 0.00 O ATOM 391 CB MET A 30 -0.229 10.410 9.384 1.00 0.00 C ATOM 392 CG MET A 30 0.441 9.053 9.532 1.00 0.00 C ATOM 393 SD MET A 30 0.885 8.680 11.239 1.00 0.00 S ATOM 394 CE MET A 30 -0.381 7.487 11.666 1.00 0.00 C ATOM 0 H MET A 30 -1.820 10.003 7.521 1.00 0.00 H new ATOM 0 HA MET A 30 -1.982 9.639 10.358 1.00 0.00 H new ATOM 0 HB2 MET A 30 -0.013 10.806 8.392 1.00 0.00 H new ATOM 0 HB3 MET A 30 0.206 11.102 10.105 1.00 0.00 H new ATOM 0 HG2 MET A 30 -0.229 8.279 9.157 1.00 0.00 H new ATOM 0 HG3 MET A 30 1.338 9.026 8.913 1.00 0.00 H new ATOM 0 HE1 MET A 30 0.016 6.780 12.394 1.00 0.00 H new ATOM 0 HE2 MET A 30 -1.239 8.005 12.094 1.00 0.00 H new ATOM 0 HE3 MET A 30 -0.691 6.949 10.770 1.00 0.00 H new ATOM 404 N GLY A 31 -2.376 12.659 9.093 1.00 0.00 N ATOM 405 CA GLY A 31 -2.845 13.994 9.418 1.00 0.00 C ATOM 406 C GLY A 31 -3.642 14.619 8.290 1.00 0.00 C ATOM 407 O GLY A 31 -4.723 14.140 7.945 1.00 0.00 O ATOM 0 H GLY A 31 -2.165 12.507 8.107 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -3.463 13.950 10.315 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -1.990 14.629 9.651 1.00 0.00 H new ATOM 411 N SER A 32 -3.110 15.692 7.714 1.00 0.00 N ATOM 412 CA SER A 32 -3.781 16.387 6.623 1.00 0.00 C ATOM 413 C SER A 32 -2.989 16.254 5.325 1.00 0.00 C ATOM 414 O SER A 32 -3.561 16.075 4.250 1.00 0.00 O ATOM 415 CB SER A 32 -3.970 17.865 6.970 1.00 0.00 C ATOM 416 OG SER A 32 -2.721 18.502 7.182 1.00 0.00 O ATOM 0 H SER A 32 -2.215 16.099 7.985 1.00 0.00 H new ATOM 0 HA SER A 32 -4.759 15.928 6.480 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.505 18.366 6.163 1.00 0.00 H new ATOM 0 HB3 SER A 32 -4.585 17.956 7.865 1.00 0.00 H new ATOM 0 HG SER A 32 -2.868 19.446 7.401 1.00 0.00 H new ATOM 422 N THR A 33 -1.667 16.344 5.435 1.00 0.00 N ATOM 423 CA THR A 33 -0.795 16.235 4.272 1.00 0.00 C ATOM 424 C THR A 33 0.178 15.071 4.421 1.00 0.00 C ATOM 425 O THR A 33 1.191 15.002 3.725 1.00 0.00 O ATOM 426 CB THR A 33 0.004 17.532 4.047 1.00 0.00 C ATOM 427 OG1 THR A 33 0.943 17.721 5.111 1.00 0.00 O ATOM 428 CG2 THR A 33 -0.925 18.734 3.965 1.00 0.00 C ATOM 0 H THR A 33 -1.177 16.492 6.317 1.00 0.00 H new ATOM 0 HA THR A 33 -1.438 16.058 3.410 1.00 0.00 H new ATOM 0 HB THR A 33 0.540 17.442 3.102 1.00 0.00 H new ATOM 0 HG1 THR A 33 1.448 18.547 4.959 1.00 0.00 H new ATOM 0 HG21 THR A 33 -0.337 19.638 3.806 1.00 0.00 H new ATOM 0 HG22 THR A 33 -1.619 18.602 3.135 1.00 0.00 H new ATOM 0 HG23 THR A 33 -1.485 18.825 4.895 1.00 0.00 H new ATOM 436 N THR A 34 -0.136 14.157 5.333 1.00 0.00 N ATOM 437 CA THR A 34 0.711 12.995 5.574 1.00 0.00 C ATOM 438 C THR A 34 -0.121 11.723 5.689 1.00 0.00 C ATOM 439 O THR A 34 -1.189 11.720 6.301 1.00 0.00 O ATOM 440 CB THR A 34 1.547 13.166 6.857 1.00 0.00 C ATOM 441 OG1 THR A 34 2.380 14.325 6.748 1.00 0.00 O ATOM 442 CG2 THR A 34 2.408 11.938 7.109 1.00 0.00 C ATOM 0 H THR A 34 -0.971 14.199 5.917 1.00 0.00 H new ATOM 0 HA THR A 34 1.383 12.911 4.720 1.00 0.00 H new ATOM 0 HB THR A 34 0.863 13.289 7.697 1.00 0.00 H new ATOM 0 HG1 THR A 34 2.907 14.428 7.568 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.989 12.082 8.020 1.00 0.00 H new ATOM 0 HG22 THR A 34 1.769 11.062 7.221 1.00 0.00 H new ATOM 0 HG23 THR A 34 3.084 11.789 6.267 1.00 0.00 H new ATOM 450 N VAL A 35 0.376 10.642 5.096 1.00 0.00 N ATOM 451 CA VAL A 35 -0.320 9.361 5.133 1.00 0.00 C ATOM 452 C VAL A 35 0.613 8.240 5.577 1.00 0.00 C ATOM 453 O VAL A 35 1.809 8.262 5.285 1.00 0.00 O ATOM 454 CB VAL A 35 -0.914 9.005 3.758 1.00 0.00 C ATOM 455 CG1 VAL A 35 -1.572 7.634 3.798 1.00 0.00 C ATOM 456 CG2 VAL A 35 -1.907 10.069 3.315 1.00 0.00 C ATOM 0 H VAL A 35 1.258 10.628 4.584 1.00 0.00 H new ATOM 0 HA VAL A 35 -1.130 9.462 5.855 1.00 0.00 H new ATOM 0 HB VAL A 35 -0.103 8.971 3.030 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -1.986 7.400 2.817 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -0.830 6.882 4.067 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -2.372 7.636 4.538 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.317 9.801 2.341 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.716 10.138 4.043 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -1.401 11.032 3.243 1.00 0.00 H new ATOM 466 N ARG A 36 0.059 7.261 6.284 1.00 0.00 N ATOM 467 CA ARG A 36 0.842 6.131 6.770 1.00 0.00 C ATOM 468 C ARG A 36 0.290 4.815 6.229 1.00 0.00 C ATOM 469 O ARG A 36 -0.789 4.373 6.623 1.00 0.00 O ATOM 470 CB ARG A 36 0.845 6.105 8.299 1.00 0.00 C ATOM 471 CG ARG A 36 1.500 4.865 8.886 1.00 0.00 C ATOM 472 CD ARG A 36 1.769 5.028 10.373 1.00 0.00 C ATOM 473 NE ARG A 36 2.848 5.978 10.633 1.00 0.00 N ATOM 474 CZ ARG A 36 4.136 5.658 10.583 1.00 0.00 C ATOM 475 NH1 ARG A 36 4.505 4.420 10.284 1.00 0.00 N ATOM 476 NH2 ARG A 36 5.060 6.578 10.832 1.00 0.00 N ATOM 0 H ARG A 36 -0.929 7.227 6.533 1.00 0.00 H new ATOM 0 HA ARG A 36 1.865 6.250 6.414 1.00 0.00 H new ATOM 0 HB2 ARG A 36 1.365 6.989 8.668 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -0.183 6.167 8.657 1.00 0.00 H new ATOM 0 HG2 ARG A 36 0.856 4.001 8.724 1.00 0.00 H new ATOM 0 HG3 ARG A 36 2.437 4.666 8.365 1.00 0.00 H new ATOM 0 HD2 ARG A 36 0.860 5.366 10.871 1.00 0.00 H new ATOM 0 HD3 ARG A 36 2.027 4.060 10.803 1.00 0.00 H new ATOM 0 HE ARG A 36 2.599 6.939 10.866 1.00 0.00 H new ATOM 0 HH11 ARG A 36 3.799 3.710 10.091 1.00 0.00 H new ATOM 0 HH12 ARG A 36 5.495 4.178 10.247 1.00 0.00 H new ATOM 0 HH21 ARG A 36 4.781 7.532 11.062 1.00 0.00 H new ATOM 0 HH22 ARG A 36 6.049 6.331 10.793 1.00 0.00 H new ATOM 490 N VAL A 37 1.038 4.194 5.322 1.00 0.00 N ATOM 491 CA VAL A 37 0.625 2.929 4.727 1.00 0.00 C ATOM 492 C VAL A 37 1.499 1.780 5.217 1.00 0.00 C ATOM 493 O VAL A 37 2.724 1.895 5.264 1.00 0.00 O ATOM 494 CB VAL A 37 0.686 2.986 3.189 1.00 0.00 C ATOM 495 CG1 VAL A 37 2.008 3.580 2.728 1.00 0.00 C ATOM 496 CG2 VAL A 37 0.479 1.600 2.597 1.00 0.00 C ATOM 0 H VAL A 37 1.933 4.547 4.983 1.00 0.00 H new ATOM 0 HA VAL A 37 -0.406 2.755 5.036 1.00 0.00 H new ATOM 0 HB VAL A 37 -0.117 3.632 2.834 1.00 0.00 H new ATOM 0 HG11 VAL A 37 2.032 3.612 1.639 1.00 0.00 H new ATOM 0 HG12 VAL A 37 2.110 4.591 3.123 1.00 0.00 H new ATOM 0 HG13 VAL A 37 2.830 2.964 3.091 1.00 0.00 H new ATOM 0 HG21 VAL A 37 0.525 1.658 1.510 1.00 0.00 H new ATOM 0 HG22 VAL A 37 1.259 0.930 2.958 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -0.496 1.217 2.899 1.00 0.00 H new ATOM 506 N SER A 38 0.862 0.672 5.580 1.00 0.00 N ATOM 507 CA SER A 38 1.581 -0.498 6.070 1.00 0.00 C ATOM 508 C SER A 38 1.067 -1.771 5.404 1.00 0.00 C ATOM 509 O SER A 38 -0.073 -1.824 4.940 1.00 0.00 O ATOM 510 CB SER A 38 1.439 -0.612 7.589 1.00 0.00 C ATOM 511 OG SER A 38 0.077 -0.702 7.969 1.00 0.00 O ATOM 0 H SER A 38 -0.151 0.560 5.544 1.00 0.00 H new ATOM 0 HA SER A 38 2.635 -0.377 5.818 1.00 0.00 H new ATOM 0 HB2 SER A 38 1.977 -1.491 7.943 1.00 0.00 H new ATOM 0 HB3 SER A 38 1.896 0.255 8.066 1.00 0.00 H new ATOM 0 HG SER A 38 0.014 -0.776 8.944 1.00 0.00 H new ATOM 517 N TRP A 39 1.915 -2.791 5.359 1.00 0.00 N ATOM 518 CA TRP A 39 1.547 -4.064 4.749 1.00 0.00 C ATOM 519 C TRP A 39 2.101 -5.234 5.554 1.00 0.00 C ATOM 520 O TRP A 39 3.087 -5.091 6.277 1.00 0.00 O ATOM 521 CB TRP A 39 2.060 -4.131 3.310 1.00 0.00 C ATOM 522 CG TRP A 39 3.478 -3.667 3.162 1.00 0.00 C ATOM 523 CD1 TRP A 39 4.582 -4.451 2.984 1.00 0.00 C ATOM 524 CD2 TRP A 39 3.943 -2.313 3.183 1.00 0.00 C ATOM 525 NE1 TRP A 39 5.706 -3.665 2.893 1.00 0.00 N ATOM 526 CE2 TRP A 39 5.341 -2.350 3.011 1.00 0.00 C ATOM 527 CE3 TRP A 39 3.315 -1.073 3.328 1.00 0.00 C ATOM 528 CZ2 TRP A 39 6.118 -1.195 2.981 1.00 0.00 C ATOM 529 CZ3 TRP A 39 4.088 0.072 3.298 1.00 0.00 C ATOM 530 CH2 TRP A 39 5.477 0.005 3.126 1.00 0.00 C ATOM 0 H TRP A 39 2.862 -2.762 5.737 1.00 0.00 H new ATOM 0 HA TRP A 39 0.459 -4.134 4.743 1.00 0.00 H new ATOM 0 HB2 TRP A 39 1.982 -5.157 2.952 1.00 0.00 H new ATOM 0 HB3 TRP A 39 1.418 -3.522 2.674 1.00 0.00 H new ATOM 0 HD1 TRP A 39 4.573 -5.529 2.924 1.00 0.00 H new ATOM 0 HE1 TRP A 39 6.658 -4.006 2.759 1.00 0.00 H new ATOM 0 HE3 TRP A 39 2.245 -1.011 3.461 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 7.189 -1.245 2.848 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 3.613 1.036 3.409 1.00 0.00 H new ATOM 0 HH2 TRP A 39 6.053 0.918 3.108 1.00 0.00 H new ATOM 541 N VAL A 40 1.462 -6.392 5.424 1.00 0.00 N ATOM 542 CA VAL A 40 1.893 -7.588 6.139 1.00 0.00 C ATOM 543 C VAL A 40 3.414 -7.684 6.182 1.00 0.00 C ATOM 544 O VAL A 40 4.104 -7.442 5.192 1.00 0.00 O ATOM 545 CB VAL A 40 1.327 -8.865 5.490 1.00 0.00 C ATOM 546 CG1 VAL A 40 1.681 -10.089 6.321 1.00 0.00 C ATOM 547 CG2 VAL A 40 -0.180 -8.749 5.312 1.00 0.00 C ATOM 0 H VAL A 40 0.644 -6.528 4.830 1.00 0.00 H new ATOM 0 HA VAL A 40 1.508 -7.505 7.155 1.00 0.00 H new ATOM 0 HB VAL A 40 1.779 -8.982 4.505 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.273 -10.981 5.847 1.00 0.00 H new ATOM 0 HG12 VAL A 40 2.765 -10.180 6.392 1.00 0.00 H new ATOM 0 HG13 VAL A 40 1.259 -9.984 7.321 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -0.563 -9.660 4.852 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -0.651 -8.607 6.285 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -0.406 -7.896 4.672 1.00 0.00 H new ATOM 557 N PRO A 41 3.951 -8.047 7.357 1.00 0.00 N ATOM 558 CA PRO A 41 5.396 -8.185 7.557 1.00 0.00 C ATOM 559 C PRO A 41 5.973 -9.384 6.812 1.00 0.00 C ATOM 560 O PRO A 41 5.246 -10.239 6.306 1.00 0.00 O ATOM 561 CB PRO A 41 5.527 -8.382 9.070 1.00 0.00 C ATOM 562 CG PRO A 41 4.218 -8.955 9.492 1.00 0.00 C ATOM 563 CD PRO A 41 3.188 -8.350 8.579 1.00 0.00 C ATOM 0 HA PRO A 41 5.944 -7.323 7.176 1.00 0.00 H new ATOM 0 HB2 PRO A 41 6.350 -9.055 9.312 1.00 0.00 H new ATOM 0 HB3 PRO A 41 5.728 -7.438 9.576 1.00 0.00 H new ATOM 0 HG2 PRO A 41 4.223 -10.042 9.409 1.00 0.00 H new ATOM 0 HG3 PRO A 41 4.005 -8.716 10.534 1.00 0.00 H new ATOM 0 HD2 PRO A 41 2.370 -9.043 8.381 1.00 0.00 H new ATOM 0 HD3 PRO A 41 2.747 -7.451 9.010 1.00 0.00 H new ATOM 571 N PRO A 42 7.311 -9.450 6.743 1.00 0.00 N ATOM 572 CA PRO A 42 8.015 -10.541 6.062 1.00 0.00 C ATOM 573 C PRO A 42 7.889 -11.866 6.807 1.00 0.00 C ATOM 574 O PRO A 42 8.451 -12.054 7.887 1.00 0.00 O ATOM 575 CB PRO A 42 9.471 -10.070 6.049 1.00 0.00 C ATOM 576 CG PRO A 42 9.578 -9.140 7.208 1.00 0.00 C ATOM 577 CD PRO A 42 8.239 -8.466 7.323 1.00 0.00 C ATOM 0 HA PRO A 42 7.607 -10.733 5.070 1.00 0.00 H new ATOM 0 HB2 PRO A 42 10.160 -10.909 6.150 1.00 0.00 H new ATOM 0 HB3 PRO A 42 9.716 -9.567 5.114 1.00 0.00 H new ATOM 0 HG2 PRO A 42 9.822 -9.682 8.122 1.00 0.00 H new ATOM 0 HG3 PRO A 42 10.371 -8.409 7.050 1.00 0.00 H new ATOM 0 HD2 PRO A 42 7.990 -8.241 8.360 1.00 0.00 H new ATOM 0 HD3 PRO A 42 8.216 -7.522 6.778 1.00 0.00 H new ATOM 585 N PRO A 43 7.137 -12.808 6.219 1.00 0.00 N ATOM 586 CA PRO A 43 6.922 -14.132 6.810 1.00 0.00 C ATOM 587 C PRO A 43 8.183 -14.988 6.789 1.00 0.00 C ATOM 588 O PRO A 43 8.853 -15.098 5.763 1.00 0.00 O ATOM 589 CB PRO A 43 5.843 -14.748 5.916 1.00 0.00 C ATOM 590 CG PRO A 43 5.991 -14.051 4.608 1.00 0.00 C ATOM 591 CD PRO A 43 6.438 -12.653 4.932 1.00 0.00 C ATOM 0 HA PRO A 43 6.640 -14.068 7.861 1.00 0.00 H new ATOM 0 HB2 PRO A 43 5.984 -15.824 5.809 1.00 0.00 H new ATOM 0 HB3 PRO A 43 4.848 -14.597 6.335 1.00 0.00 H new ATOM 0 HG2 PRO A 43 6.721 -14.557 3.976 1.00 0.00 H new ATOM 0 HG3 PRO A 43 5.048 -14.042 4.062 1.00 0.00 H new ATOM 0 HD2 PRO A 43 7.098 -12.253 4.162 1.00 0.00 H new ATOM 0 HD3 PRO A 43 5.593 -11.970 5.014 1.00 0.00 H new ATOM 599 N ALA A 44 8.501 -15.593 7.929 1.00 0.00 N ATOM 600 CA ALA A 44 9.681 -16.441 8.040 1.00 0.00 C ATOM 601 C ALA A 44 9.346 -17.893 7.716 1.00 0.00 C ATOM 602 O ALA A 44 10.192 -18.641 7.225 1.00 0.00 O ATOM 603 CB ALA A 44 10.279 -16.334 9.435 1.00 0.00 C ATOM 0 H ALA A 44 7.958 -15.511 8.788 1.00 0.00 H new ATOM 0 HA ALA A 44 10.416 -16.094 7.314 1.00 0.00 H new ATOM 0 HB1 ALA A 44 11.160 -16.973 9.503 1.00 0.00 H new ATOM 0 HB2 ALA A 44 10.564 -15.300 9.630 1.00 0.00 H new ATOM 0 HB3 ALA A 44 9.542 -16.652 10.172 1.00 0.00 H new ATOM 609 N ASP A 45 8.108 -18.286 7.996 1.00 0.00 N ATOM 610 CA ASP A 45 7.661 -19.649 7.734 1.00 0.00 C ATOM 611 C ASP A 45 7.302 -19.830 6.262 1.00 0.00 C ATOM 612 O ASP A 45 7.832 -20.713 5.588 1.00 0.00 O ATOM 613 CB ASP A 45 6.455 -19.991 8.611 1.00 0.00 C ATOM 614 CG ASP A 45 5.766 -21.268 8.175 1.00 0.00 C ATOM 615 OD1 ASP A 45 6.382 -22.347 8.300 1.00 0.00 O ATOM 616 OD2 ASP A 45 4.610 -21.190 7.708 1.00 0.00 O ATOM 0 H ASP A 45 7.396 -17.680 8.404 1.00 0.00 H new ATOM 0 HA ASP A 45 8.480 -20.326 7.976 1.00 0.00 H new ATOM 0 HB2 ASP A 45 6.780 -20.092 9.647 1.00 0.00 H new ATOM 0 HB3 ASP A 45 5.741 -19.168 8.580 1.00 0.00 H new ATOM 621 N SER A 46 6.398 -18.989 5.771 1.00 0.00 N ATOM 622 CA SER A 46 5.965 -19.059 4.380 1.00 0.00 C ATOM 623 C SER A 46 6.492 -17.868 3.586 1.00 0.00 C ATOM 624 O SER A 46 5.835 -16.831 3.490 1.00 0.00 O ATOM 625 CB SER A 46 4.438 -19.102 4.301 1.00 0.00 C ATOM 626 OG SER A 46 3.861 -17.988 4.959 1.00 0.00 O ATOM 0 H SER A 46 5.951 -18.251 6.315 1.00 0.00 H new ATOM 0 HA SER A 46 6.371 -19.972 3.945 1.00 0.00 H new ATOM 0 HB2 SER A 46 4.125 -19.114 3.257 1.00 0.00 H new ATOM 0 HB3 SER A 46 4.073 -20.024 4.753 1.00 0.00 H new ATOM 0 HG SER A 46 4.333 -17.171 4.695 1.00 0.00 H new ATOM 632 N ARG A 47 7.684 -18.024 3.018 1.00 0.00 N ATOM 633 CA ARG A 47 8.302 -16.962 2.233 1.00 0.00 C ATOM 634 C ARG A 47 8.586 -17.433 0.810 1.00 0.00 C ATOM 635 O ARG A 47 9.323 -18.395 0.600 1.00 0.00 O ATOM 636 CB ARG A 47 9.599 -16.498 2.897 1.00 0.00 C ATOM 637 CG ARG A 47 10.262 -15.329 2.186 1.00 0.00 C ATOM 638 CD ARG A 47 9.581 -14.012 2.524 1.00 0.00 C ATOM 639 NE ARG A 47 10.511 -12.887 2.477 1.00 0.00 N ATOM 640 CZ ARG A 47 11.318 -12.559 3.480 1.00 0.00 C ATOM 641 NH1 ARG A 47 11.309 -13.266 4.601 1.00 0.00 N ATOM 642 NH2 ARG A 47 12.136 -11.521 3.362 1.00 0.00 N ATOM 0 H ARG A 47 8.241 -18.876 3.087 1.00 0.00 H new ATOM 0 HA ARG A 47 7.605 -16.125 2.188 1.00 0.00 H new ATOM 0 HB2 ARG A 47 9.388 -16.213 3.928 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.298 -17.334 2.934 1.00 0.00 H new ATOM 0 HG2 ARG A 47 11.314 -15.279 2.469 1.00 0.00 H new ATOM 0 HG3 ARG A 47 10.229 -15.491 1.109 1.00 0.00 H new ATOM 0 HD2 ARG A 47 8.764 -13.836 1.824 1.00 0.00 H new ATOM 0 HD3 ARG A 47 9.140 -14.077 3.519 1.00 0.00 H new ATOM 0 HE ARG A 47 10.543 -12.322 1.628 1.00 0.00 H new ATOM 0 HH11 ARG A 47 10.681 -14.064 4.695 1.00 0.00 H new ATOM 0 HH12 ARG A 47 11.930 -13.012 5.369 1.00 0.00 H new ATOM 0 HH21 ARG A 47 12.145 -10.974 2.501 1.00 0.00 H new ATOM 0 HH22 ARG A 47 12.755 -11.270 4.132 1.00 0.00 H new ATOM 656 N ASN A 48 7.995 -16.748 -0.164 1.00 0.00 N ATOM 657 CA ASN A 48 8.183 -17.097 -1.567 1.00 0.00 C ATOM 658 C ASN A 48 9.635 -16.893 -1.988 1.00 0.00 C ATOM 659 O ASN A 48 10.256 -17.784 -2.567 1.00 0.00 O ATOM 660 CB ASN A 48 7.261 -16.255 -2.452 1.00 0.00 C ATOM 661 CG ASN A 48 5.794 -16.493 -2.149 1.00 0.00 C ATOM 662 OD1 ASN A 48 5.450 -17.141 -1.160 1.00 0.00 O ATOM 663 ND2 ASN A 48 4.922 -15.968 -3.001 1.00 0.00 N ATOM 0 H ASN A 48 7.382 -15.948 -0.007 1.00 0.00 H new ATOM 0 HA ASN A 48 7.932 -18.150 -1.690 1.00 0.00 H new ATOM 0 HB2 ASN A 48 7.492 -15.199 -2.311 1.00 0.00 H new ATOM 0 HB3 ASN A 48 7.455 -16.487 -3.499 1.00 0.00 H new ATOM 0 HD21 ASN A 48 3.921 -16.094 -2.849 1.00 0.00 H new ATOM 0 HD22 ASN A 48 5.253 -15.438 -3.807 1.00 0.00 H new ATOM 670 N GLY A 49 10.171 -15.712 -1.692 1.00 0.00 N ATOM 671 CA GLY A 49 11.546 -15.412 -2.047 1.00 0.00 C ATOM 672 C GLY A 49 12.237 -14.548 -1.010 1.00 0.00 C ATOM 673 O GLY A 49 12.080 -14.762 0.192 1.00 0.00 O ATOM 0 H GLY A 49 9.678 -14.959 -1.213 1.00 0.00 H new ATOM 0 HA2 GLY A 49 12.099 -16.344 -2.166 1.00 0.00 H new ATOM 0 HA3 GLY A 49 11.567 -14.904 -3.011 1.00 0.00 H new ATOM 677 N VAL A 50 13.005 -13.568 -1.476 1.00 0.00 N ATOM 678 CA VAL A 50 13.723 -12.668 -0.581 1.00 0.00 C ATOM 679 C VAL A 50 13.502 -11.211 -0.974 1.00 0.00 C ATOM 680 O VAL A 50 13.868 -10.792 -2.073 1.00 0.00 O ATOM 681 CB VAL A 50 15.234 -12.965 -0.580 1.00 0.00 C ATOM 682 CG1 VAL A 50 15.827 -12.720 -1.959 1.00 0.00 C ATOM 683 CG2 VAL A 50 15.941 -12.123 0.471 1.00 0.00 C ATOM 0 H VAL A 50 13.146 -13.377 -2.468 1.00 0.00 H new ATOM 0 HA VAL A 50 13.327 -12.835 0.421 1.00 0.00 H new ATOM 0 HB VAL A 50 15.380 -14.016 -0.330 1.00 0.00 H new ATOM 0 HG11 VAL A 50 16.895 -12.935 -1.939 1.00 0.00 H new ATOM 0 HG12 VAL A 50 15.339 -13.370 -2.685 1.00 0.00 H new ATOM 0 HG13 VAL A 50 15.672 -11.679 -2.242 1.00 0.00 H new ATOM 0 HG21 VAL A 50 17.008 -12.346 0.458 1.00 0.00 H new ATOM 0 HG22 VAL A 50 15.788 -11.066 0.254 1.00 0.00 H new ATOM 0 HG23 VAL A 50 15.534 -12.353 1.456 1.00 0.00 H new ATOM 693 N ILE A 51 12.903 -10.445 -0.070 1.00 0.00 N ATOM 694 CA ILE A 51 12.636 -9.034 -0.321 1.00 0.00 C ATOM 695 C ILE A 51 13.915 -8.208 -0.237 1.00 0.00 C ATOM 696 O ILE A 51 14.674 -8.314 0.728 1.00 0.00 O ATOM 697 CB ILE A 51 11.607 -8.469 0.676 1.00 0.00 C ATOM 698 CG1 ILE A 51 10.377 -9.378 0.743 1.00 0.00 C ATOM 699 CG2 ILE A 51 11.207 -7.056 0.281 1.00 0.00 C ATOM 700 CD1 ILE A 51 9.587 -9.421 -0.546 1.00 0.00 C ATOM 0 H ILE A 51 12.593 -10.777 0.843 1.00 0.00 H new ATOM 0 HA ILE A 51 12.228 -8.966 -1.329 1.00 0.00 H new ATOM 0 HB ILE A 51 12.063 -8.433 1.665 1.00 0.00 H new ATOM 0 HG12 ILE A 51 10.696 -10.389 0.998 1.00 0.00 H new ATOM 0 HG13 ILE A 51 9.726 -9.036 1.548 1.00 0.00 H new ATOM 0 HG21 ILE A 51 10.479 -6.671 0.995 1.00 0.00 H new ATOM 0 HG22 ILE A 51 12.089 -6.415 0.280 1.00 0.00 H new ATOM 0 HG23 ILE A 51 10.766 -7.068 -0.716 1.00 0.00 H new ATOM 0 HD11 ILE A 51 8.730 -10.084 -0.426 1.00 0.00 H new ATOM 0 HD12 ILE A 51 9.238 -8.418 -0.792 1.00 0.00 H new ATOM 0 HD13 ILE A 51 10.223 -9.792 -1.350 1.00 0.00 H new ATOM 712 N THR A 52 14.149 -7.384 -1.253 1.00 0.00 N ATOM 713 CA THR A 52 15.336 -6.539 -1.294 1.00 0.00 C ATOM 714 C THR A 52 14.987 -5.086 -0.990 1.00 0.00 C ATOM 715 O THR A 52 15.797 -4.349 -0.429 1.00 0.00 O ATOM 716 CB THR A 52 16.031 -6.612 -2.666 1.00 0.00 C ATOM 717 OG1 THR A 52 17.171 -5.747 -2.685 1.00 0.00 O ATOM 718 CG2 THR A 52 15.071 -6.220 -3.780 1.00 0.00 C ATOM 0 H THR A 52 13.532 -7.284 -2.059 1.00 0.00 H new ATOM 0 HA THR A 52 16.017 -6.914 -0.530 1.00 0.00 H new ATOM 0 HB THR A 52 16.354 -7.640 -2.831 1.00 0.00 H new ATOM 0 HG1 THR A 52 17.608 -5.801 -3.561 1.00 0.00 H new ATOM 0 HG21 THR A 52 15.584 -6.279 -4.740 1.00 0.00 H new ATOM 0 HG22 THR A 52 14.219 -6.899 -3.782 1.00 0.00 H new ATOM 0 HG23 THR A 52 14.722 -5.200 -3.617 1.00 0.00 H new ATOM 726 N GLN A 53 13.778 -4.682 -1.365 1.00 0.00 N ATOM 727 CA GLN A 53 13.323 -3.316 -1.132 1.00 0.00 C ATOM 728 C GLN A 53 11.838 -3.176 -1.447 1.00 0.00 C ATOM 729 O GLN A 53 11.280 -3.956 -2.219 1.00 0.00 O ATOM 730 CB GLN A 53 14.132 -2.335 -1.982 1.00 0.00 C ATOM 731 CG GLN A 53 13.859 -2.452 -3.472 1.00 0.00 C ATOM 732 CD GLN A 53 14.790 -1.595 -4.306 1.00 0.00 C ATOM 733 OE1 GLN A 53 15.543 -2.104 -5.138 1.00 0.00 O ATOM 734 NE2 GLN A 53 14.745 -0.286 -4.088 1.00 0.00 N ATOM 0 H GLN A 53 13.096 -5.280 -1.831 1.00 0.00 H new ATOM 0 HA GLN A 53 13.475 -3.084 -0.078 1.00 0.00 H new ATOM 0 HB2 GLN A 53 13.909 -1.318 -1.659 1.00 0.00 H new ATOM 0 HB3 GLN A 53 15.194 -2.501 -1.802 1.00 0.00 H new ATOM 0 HG2 GLN A 53 13.962 -3.494 -3.775 1.00 0.00 H new ATOM 0 HG3 GLN A 53 12.828 -2.162 -3.672 1.00 0.00 H new ATOM 0 HE21 GLN A 53 14.106 0.093 -3.389 1.00 0.00 H new ATOM 0 HE22 GLN A 53 15.349 0.341 -4.620 1.00 0.00 H new ATOM 743 N TYR A 54 11.202 -2.177 -0.845 1.00 0.00 N ATOM 744 CA TYR A 54 9.780 -1.936 -1.059 1.00 0.00 C ATOM 745 C TYR A 54 9.557 -0.631 -1.816 1.00 0.00 C ATOM 746 O TYR A 54 10.250 0.360 -1.586 1.00 0.00 O ATOM 747 CB TYR A 54 9.041 -1.895 0.279 1.00 0.00 C ATOM 748 CG TYR A 54 8.708 -3.263 0.830 1.00 0.00 C ATOM 749 CD1 TYR A 54 7.544 -3.922 0.451 1.00 0.00 C ATOM 750 CD2 TYR A 54 9.556 -3.898 1.729 1.00 0.00 C ATOM 751 CE1 TYR A 54 7.235 -5.172 0.951 1.00 0.00 C ATOM 752 CE2 TYR A 54 9.256 -5.148 2.233 1.00 0.00 C ATOM 753 CZ TYR A 54 8.095 -5.781 1.842 1.00 0.00 C ATOM 754 OH TYR A 54 7.792 -7.026 2.343 1.00 0.00 O ATOM 0 H TYR A 54 11.649 -1.521 -0.205 1.00 0.00 H new ATOM 0 HA TYR A 54 9.385 -2.756 -1.659 1.00 0.00 H new ATOM 0 HB2 TYR A 54 9.652 -1.359 1.005 1.00 0.00 H new ATOM 0 HB3 TYR A 54 8.119 -1.327 0.158 1.00 0.00 H new ATOM 0 HD1 TYR A 54 6.869 -3.448 -0.247 1.00 0.00 H new ATOM 0 HD2 TYR A 54 10.466 -3.405 2.039 1.00 0.00 H new ATOM 0 HE1 TYR A 54 6.326 -5.670 0.647 1.00 0.00 H new ATOM 0 HE2 TYR A 54 9.927 -5.628 2.930 1.00 0.00 H new ATOM 0 HH TYR A 54 8.501 -7.313 2.956 1.00 0.00 H new ATOM 764 N SER A 55 8.583 -0.638 -2.721 1.00 0.00 N ATOM 765 CA SER A 55 8.269 0.544 -3.516 1.00 0.00 C ATOM 766 C SER A 55 6.880 1.075 -3.174 1.00 0.00 C ATOM 767 O SER A 55 5.923 0.311 -3.052 1.00 0.00 O ATOM 768 CB SER A 55 8.349 0.216 -5.008 1.00 0.00 C ATOM 769 OG SER A 55 9.679 0.327 -5.484 1.00 0.00 O ATOM 0 H SER A 55 7.998 -1.449 -2.922 1.00 0.00 H new ATOM 0 HA SER A 55 9.002 1.316 -3.281 1.00 0.00 H new ATOM 0 HB2 SER A 55 7.981 -0.795 -5.182 1.00 0.00 H new ATOM 0 HB3 SER A 55 7.702 0.892 -5.567 1.00 0.00 H new ATOM 0 HG SER A 55 9.704 0.111 -6.440 1.00 0.00 H new ATOM 775 N VAL A 56 6.779 2.391 -3.019 1.00 0.00 N ATOM 776 CA VAL A 56 5.508 3.027 -2.692 1.00 0.00 C ATOM 777 C VAL A 56 5.177 4.135 -3.684 1.00 0.00 C ATOM 778 O VAL A 56 6.070 4.781 -4.231 1.00 0.00 O ATOM 779 CB VAL A 56 5.526 3.616 -1.269 1.00 0.00 C ATOM 780 CG1 VAL A 56 4.152 4.152 -0.896 1.00 0.00 C ATOM 781 CG2 VAL A 56 5.989 2.570 -0.265 1.00 0.00 C ATOM 0 H VAL A 56 7.562 3.038 -3.115 1.00 0.00 H new ATOM 0 HA VAL A 56 4.743 2.253 -2.748 1.00 0.00 H new ATOM 0 HB VAL A 56 6.232 4.446 -1.247 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.184 4.564 0.113 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.863 4.934 -1.599 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.423 3.343 -0.934 1.00 0.00 H new ATOM 0 HG21 VAL A 56 5.996 3.003 0.735 1.00 0.00 H new ATOM 0 HG22 VAL A 56 5.309 1.718 -0.287 1.00 0.00 H new ATOM 0 HG23 VAL A 56 6.995 2.238 -0.523 1.00 0.00 H new ATOM 791 N ALA A 57 3.885 4.351 -3.913 1.00 0.00 N ATOM 792 CA ALA A 57 3.435 5.383 -4.838 1.00 0.00 C ATOM 793 C ALA A 57 2.098 5.970 -4.397 1.00 0.00 C ATOM 794 O ALA A 57 1.319 5.314 -3.704 1.00 0.00 O ATOM 795 CB ALA A 57 3.327 4.819 -6.247 1.00 0.00 C ATOM 0 H ALA A 57 3.132 3.824 -3.470 1.00 0.00 H new ATOM 0 HA ALA A 57 4.173 6.185 -4.836 1.00 0.00 H new ATOM 0 HB1 ALA A 57 2.990 5.601 -6.927 1.00 0.00 H new ATOM 0 HB2 ALA A 57 4.302 4.454 -6.569 1.00 0.00 H new ATOM 0 HB3 ALA A 57 2.611 3.997 -6.256 1.00 0.00 H new ATOM 801 N TYR A 58 1.838 7.207 -4.803 1.00 0.00 N ATOM 802 CA TYR A 58 0.596 7.883 -4.447 1.00 0.00 C ATOM 803 C TYR A 58 0.171 8.855 -5.543 1.00 0.00 C ATOM 804 O TYR A 58 1.001 9.558 -6.120 1.00 0.00 O ATOM 805 CB TYR A 58 0.759 8.631 -3.122 1.00 0.00 C ATOM 806 CG TYR A 58 1.906 9.617 -3.121 1.00 0.00 C ATOM 807 CD1 TYR A 58 3.209 9.196 -2.886 1.00 0.00 C ATOM 808 CD2 TYR A 58 1.686 10.969 -3.353 1.00 0.00 C ATOM 809 CE1 TYR A 58 4.260 10.093 -2.882 1.00 0.00 C ATOM 810 CE2 TYR A 58 2.731 11.872 -3.353 1.00 0.00 C ATOM 811 CZ TYR A 58 4.016 11.430 -3.117 1.00 0.00 C ATOM 812 OH TYR A 58 5.059 12.327 -3.115 1.00 0.00 O ATOM 0 H TYR A 58 2.470 7.763 -5.379 1.00 0.00 H new ATOM 0 HA TYR A 58 -0.181 7.126 -4.336 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -0.166 9.162 -2.898 1.00 0.00 H new ATOM 0 HB3 TYR A 58 0.913 7.907 -2.322 1.00 0.00 H new ATOM 0 HD1 TYR A 58 3.404 8.150 -2.703 1.00 0.00 H new ATOM 0 HD2 TYR A 58 0.681 11.320 -3.536 1.00 0.00 H new ATOM 0 HE1 TYR A 58 5.267 9.749 -2.696 1.00 0.00 H new ATOM 0 HE2 TYR A 58 2.543 12.919 -3.537 1.00 0.00 H new ATOM 0 HH TYR A 58 5.121 12.759 -3.992 1.00 0.00 H new ATOM 822 N GLU A 59 -1.128 8.889 -5.824 1.00 0.00 N ATOM 823 CA GLU A 59 -1.664 9.775 -6.852 1.00 0.00 C ATOM 824 C GLU A 59 -3.087 10.205 -6.510 1.00 0.00 C ATOM 825 O GLU A 59 -3.923 9.383 -6.136 1.00 0.00 O ATOM 826 CB GLU A 59 -1.641 9.082 -8.216 1.00 0.00 C ATOM 827 CG GLU A 59 -1.979 10.006 -9.373 1.00 0.00 C ATOM 828 CD GLU A 59 -2.648 9.280 -10.524 1.00 0.00 C ATOM 829 OE1 GLU A 59 -3.853 8.972 -10.410 1.00 0.00 O ATOM 830 OE2 GLU A 59 -1.967 9.019 -11.538 1.00 0.00 O ATOM 0 H GLU A 59 -1.828 8.314 -5.355 1.00 0.00 H new ATOM 0 HA GLU A 59 -1.035 10.664 -6.895 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -0.652 8.654 -8.380 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -2.349 8.253 -8.205 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -2.636 10.800 -9.019 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -1.066 10.483 -9.731 1.00 0.00 H new ATOM 837 N ALA A 60 -3.356 11.500 -6.643 1.00 0.00 N ATOM 838 CA ALA A 60 -4.677 12.040 -6.350 1.00 0.00 C ATOM 839 C ALA A 60 -5.691 11.614 -7.407 1.00 0.00 C ATOM 840 O ALA A 60 -5.440 11.736 -8.606 1.00 0.00 O ATOM 841 CB ALA A 60 -4.618 13.557 -6.255 1.00 0.00 C ATOM 0 H ALA A 60 -2.676 12.194 -6.952 1.00 0.00 H new ATOM 0 HA ALA A 60 -5.001 11.639 -5.390 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.612 13.947 -6.036 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.931 13.845 -5.459 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -4.268 13.968 -7.202 1.00 0.00 H new ATOM 847 N VAL A 61 -6.836 11.113 -6.955 1.00 0.00 N ATOM 848 CA VAL A 61 -7.887 10.668 -7.862 1.00 0.00 C ATOM 849 C VAL A 61 -8.977 11.726 -8.000 1.00 0.00 C ATOM 850 O VAL A 61 -9.601 11.855 -9.053 1.00 0.00 O ATOM 851 CB VAL A 61 -8.524 9.351 -7.381 1.00 0.00 C ATOM 852 CG1 VAL A 61 -9.029 9.492 -5.953 1.00 0.00 C ATOM 853 CG2 VAL A 61 -9.650 8.932 -8.314 1.00 0.00 C ATOM 0 H VAL A 61 -7.059 11.005 -5.966 1.00 0.00 H new ATOM 0 HA VAL A 61 -7.419 10.503 -8.832 1.00 0.00 H new ATOM 0 HB VAL A 61 -7.761 8.572 -7.396 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -9.476 8.552 -5.631 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -8.196 9.742 -5.296 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -9.777 10.283 -5.908 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -10.089 7.999 -7.959 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.415 9.709 -8.333 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -9.255 8.787 -9.319 1.00 0.00 H new ATOM 863 N ASP A 62 -9.200 12.480 -6.930 1.00 0.00 N ATOM 864 CA ASP A 62 -10.214 13.529 -6.931 1.00 0.00 C ATOM 865 C ASP A 62 -9.629 14.850 -6.443 1.00 0.00 C ATOM 866 O ASP A 62 -10.311 15.639 -5.790 1.00 0.00 O ATOM 867 CB ASP A 62 -11.398 13.124 -6.052 1.00 0.00 C ATOM 868 CG ASP A 62 -12.393 12.249 -6.788 1.00 0.00 C ATOM 869 OD1 ASP A 62 -12.723 12.572 -7.949 1.00 0.00 O ATOM 870 OD2 ASP A 62 -12.842 11.241 -6.204 1.00 0.00 O ATOM 0 H ASP A 62 -8.693 12.385 -6.050 1.00 0.00 H new ATOM 0 HA ASP A 62 -10.562 13.663 -7.955 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -11.030 12.592 -5.175 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -11.903 14.020 -5.693 1.00 0.00 H new ATOM 875 N GLY A 63 -8.360 15.085 -6.763 1.00 0.00 N ATOM 876 CA GLY A 63 -7.705 16.312 -6.347 1.00 0.00 C ATOM 877 C GLY A 63 -7.430 17.245 -7.510 1.00 0.00 C ATOM 878 O GLY A 63 -8.089 17.167 -8.546 1.00 0.00 O ATOM 0 H GLY A 63 -7.774 14.448 -7.303 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -8.330 16.823 -5.615 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.766 16.069 -5.850 1.00 0.00 H new ATOM 882 N GLU A 64 -6.453 18.130 -7.338 1.00 0.00 N ATOM 883 CA GLU A 64 -6.095 19.084 -8.381 1.00 0.00 C ATOM 884 C GLU A 64 -5.026 18.504 -9.304 1.00 0.00 C ATOM 885 O GLU A 64 -5.162 18.538 -10.527 1.00 0.00 O ATOM 886 CB GLU A 64 -5.594 20.389 -7.760 1.00 0.00 C ATOM 887 CG GLU A 64 -6.669 21.158 -7.011 1.00 0.00 C ATOM 888 CD GLU A 64 -6.104 22.301 -6.190 1.00 0.00 C ATOM 889 OE1 GLU A 64 -5.790 23.356 -6.779 1.00 0.00 O ATOM 890 OE2 GLU A 64 -5.978 22.140 -4.958 1.00 0.00 O ATOM 0 H GLU A 64 -5.896 18.206 -6.487 1.00 0.00 H new ATOM 0 HA GLU A 64 -6.988 19.291 -8.971 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -4.776 20.165 -7.076 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -5.187 21.023 -8.547 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.393 21.551 -7.725 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -7.208 20.475 -6.354 1.00 0.00 H new ATOM 897 N ASP A 65 -3.964 17.974 -8.709 1.00 0.00 N ATOM 898 CA ASP A 65 -2.872 17.386 -9.476 1.00 0.00 C ATOM 899 C ASP A 65 -2.975 15.864 -9.490 1.00 0.00 C ATOM 900 O ASP A 65 -2.918 15.219 -8.443 1.00 0.00 O ATOM 901 CB ASP A 65 -1.523 17.813 -8.893 1.00 0.00 C ATOM 902 CG ASP A 65 -0.352 17.298 -9.706 1.00 0.00 C ATOM 903 OD1 ASP A 65 -0.123 17.823 -10.816 1.00 0.00 O ATOM 904 OD2 ASP A 65 0.336 16.370 -9.232 1.00 0.00 O ATOM 0 H ASP A 65 -3.836 17.939 -7.698 1.00 0.00 H new ATOM 0 HA ASP A 65 -2.946 17.746 -10.502 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -1.479 18.901 -8.846 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -1.440 17.447 -7.870 1.00 0.00 H new ATOM 909 N ARG A 66 -3.127 15.297 -10.682 1.00 0.00 N ATOM 910 CA ARG A 66 -3.240 13.852 -10.832 1.00 0.00 C ATOM 911 C ARG A 66 -1.875 13.224 -11.096 1.00 0.00 C ATOM 912 O ARG A 66 -1.775 12.169 -11.721 1.00 0.00 O ATOM 913 CB ARG A 66 -4.200 13.509 -11.973 1.00 0.00 C ATOM 914 CG ARG A 66 -5.662 13.504 -11.558 1.00 0.00 C ATOM 915 CD ARG A 66 -6.164 14.910 -11.271 1.00 0.00 C ATOM 916 NE ARG A 66 -6.471 15.643 -12.497 1.00 0.00 N ATOM 917 CZ ARG A 66 -7.608 15.506 -13.170 1.00 0.00 C ATOM 918 NH1 ARG A 66 -8.541 14.668 -12.739 1.00 0.00 N ATOM 919 NH2 ARG A 66 -7.813 16.208 -14.277 1.00 0.00 N ATOM 0 H ARG A 66 -3.175 15.817 -11.558 1.00 0.00 H new ATOM 0 HA ARG A 66 -3.634 13.446 -9.900 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -4.063 14.228 -12.781 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -3.941 12.528 -12.372 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -6.264 13.056 -12.348 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -5.787 12.883 -10.671 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -7.057 14.856 -10.648 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -5.411 15.455 -10.702 1.00 0.00 H new ATOM 0 HE ARG A 66 -5.774 16.296 -12.856 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -8.387 14.126 -11.889 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -9.413 14.565 -13.258 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -7.097 16.853 -14.612 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -8.686 16.102 -14.793 1.00 0.00 H new ATOM 933 N GLY A 67 -0.824 13.881 -10.614 1.00 0.00 N ATOM 934 CA GLY A 67 0.522 13.372 -10.809 1.00 0.00 C ATOM 935 C GLY A 67 0.862 12.250 -9.848 1.00 0.00 C ATOM 936 O GLY A 67 0.816 12.430 -8.631 1.00 0.00 O ATOM 0 H GLY A 67 -0.880 14.756 -10.092 1.00 0.00 H new ATOM 0 HA2 GLY A 67 0.627 13.014 -11.833 1.00 0.00 H new ATOM 0 HA3 GLY A 67 1.237 14.185 -10.681 1.00 0.00 H new ATOM 940 N ARG A 68 1.203 11.088 -10.396 1.00 0.00 N ATOM 941 CA ARG A 68 1.549 9.931 -9.579 1.00 0.00 C ATOM 942 C ARG A 68 2.994 10.019 -9.095 1.00 0.00 C ATOM 943 O ARG A 68 3.923 10.111 -9.898 1.00 0.00 O ATOM 944 CB ARG A 68 1.344 8.640 -10.373 1.00 0.00 C ATOM 945 CG ARG A 68 1.625 7.380 -9.570 1.00 0.00 C ATOM 946 CD ARG A 68 3.081 6.958 -9.687 1.00 0.00 C ATOM 947 NE ARG A 68 3.387 6.405 -11.003 1.00 0.00 N ATOM 948 CZ ARG A 68 3.087 5.163 -11.367 1.00 0.00 C ATOM 949 NH1 ARG A 68 2.476 4.350 -10.518 1.00 0.00 N ATOM 950 NH2 ARG A 68 3.398 4.734 -12.583 1.00 0.00 N ATOM 0 H ARG A 68 1.247 10.923 -11.402 1.00 0.00 H new ATOM 0 HA ARG A 68 0.892 9.923 -8.709 1.00 0.00 H new ATOM 0 HB2 ARG A 68 0.317 8.607 -10.738 1.00 0.00 H new ATOM 0 HB3 ARG A 68 1.993 8.655 -11.249 1.00 0.00 H new ATOM 0 HG2 ARG A 68 1.378 7.552 -8.522 1.00 0.00 H new ATOM 0 HG3 ARG A 68 0.982 6.573 -9.921 1.00 0.00 H new ATOM 0 HD2 ARG A 68 3.724 7.817 -9.497 1.00 0.00 H new ATOM 0 HD3 ARG A 68 3.306 6.216 -8.921 1.00 0.00 H new ATOM 0 HE ARG A 68 3.857 7.005 -11.680 1.00 0.00 H new ATOM 0 HH11 ARG A 68 2.235 4.677 -9.582 1.00 0.00 H new ATOM 0 HH12 ARG A 68 2.247 3.397 -10.800 1.00 0.00 H new ATOM 0 HH21 ARG A 68 3.868 5.358 -13.239 1.00 0.00 H new ATOM 0 HH22 ARG A 68 3.167 3.780 -12.862 1.00 0.00 H new ATOM 964 N HIS A 69 3.174 9.992 -7.779 1.00 0.00 N ATOM 965 CA HIS A 69 4.506 10.069 -7.188 1.00 0.00 C ATOM 966 C HIS A 69 4.991 8.687 -6.760 1.00 0.00 C ATOM 967 O HIS A 69 4.195 7.764 -6.587 1.00 0.00 O ATOM 968 CB HIS A 69 4.500 11.015 -5.987 1.00 0.00 C ATOM 969 CG HIS A 69 4.537 12.463 -6.366 1.00 0.00 C ATOM 970 ND1 HIS A 69 5.564 13.310 -6.004 1.00 0.00 N ATOM 971 CD2 HIS A 69 3.666 13.214 -7.080 1.00 0.00 C ATOM 972 CE1 HIS A 69 5.323 14.519 -6.478 1.00 0.00 C ATOM 973 NE2 HIS A 69 4.177 14.488 -7.135 1.00 0.00 N ATOM 0 H HIS A 69 2.415 9.917 -7.101 1.00 0.00 H new ATOM 0 HA HIS A 69 5.190 10.457 -7.943 1.00 0.00 H new ATOM 0 HB2 HIS A 69 3.607 10.827 -5.391 1.00 0.00 H new ATOM 0 HB3 HIS A 69 5.359 10.791 -5.354 1.00 0.00 H new ATOM 0 HD2 HIS A 69 2.742 12.875 -7.524 1.00 0.00 H new ATOM 0 HE1 HIS A 69 5.955 15.385 -6.350 1.00 0.00 H new ATOM 0 HE2 HIS A 69 3.742 15.281 -7.606 1.00 0.00 H new ATOM 982 N VAL A 70 6.303 8.551 -6.591 1.00 0.00 N ATOM 983 CA VAL A 70 6.894 7.283 -6.183 1.00 0.00 C ATOM 984 C VAL A 70 8.035 7.501 -5.196 1.00 0.00 C ATOM 985 O VAL A 70 8.902 8.348 -5.410 1.00 0.00 O ATOM 986 CB VAL A 70 7.422 6.494 -7.395 1.00 0.00 C ATOM 987 CG1 VAL A 70 8.093 5.206 -6.943 1.00 0.00 C ATOM 988 CG2 VAL A 70 6.294 6.202 -8.373 1.00 0.00 C ATOM 0 H VAL A 70 6.976 9.304 -6.731 1.00 0.00 H new ATOM 0 HA VAL A 70 6.105 6.707 -5.700 1.00 0.00 H new ATOM 0 HB VAL A 70 8.167 7.104 -7.906 1.00 0.00 H new ATOM 0 HG11 VAL A 70 8.460 4.662 -7.813 1.00 0.00 H new ATOM 0 HG12 VAL A 70 8.929 5.443 -6.284 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.372 4.589 -6.407 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.685 5.644 -9.224 1.00 0.00 H new ATOM 0 HG22 VAL A 70 5.524 5.612 -7.875 1.00 0.00 H new ATOM 0 HG23 VAL A 70 5.863 7.140 -8.722 1.00 0.00 H new ATOM 998 N VAL A 71 8.029 6.730 -4.113 1.00 0.00 N ATOM 999 CA VAL A 71 9.065 6.837 -3.092 1.00 0.00 C ATOM 1000 C VAL A 71 10.241 5.919 -3.404 1.00 0.00 C ATOM 1001 O VAL A 71 10.055 4.762 -3.782 1.00 0.00 O ATOM 1002 CB VAL A 71 8.514 6.492 -1.696 1.00 0.00 C ATOM 1003 CG1 VAL A 71 9.586 6.690 -0.635 1.00 0.00 C ATOM 1004 CG2 VAL A 71 7.284 7.331 -1.386 1.00 0.00 C ATOM 0 H VAL A 71 7.318 6.024 -3.920 1.00 0.00 H new ATOM 0 HA VAL A 71 9.406 7.872 -3.094 1.00 0.00 H new ATOM 0 HB VAL A 71 8.220 5.442 -1.690 1.00 0.00 H new ATOM 0 HG11 VAL A 71 9.178 6.441 0.345 1.00 0.00 H new ATOM 0 HG12 VAL A 71 10.435 6.041 -0.850 1.00 0.00 H new ATOM 0 HG13 VAL A 71 9.914 7.730 -0.639 1.00 0.00 H new ATOM 0 HG21 VAL A 71 6.908 7.074 -0.396 1.00 0.00 H new ATOM 0 HG22 VAL A 71 7.549 8.388 -1.410 1.00 0.00 H new ATOM 0 HG23 VAL A 71 6.512 7.133 -2.130 1.00 0.00 H new ATOM 1014 N ASP A 72 11.451 6.442 -3.243 1.00 0.00 N ATOM 1015 CA ASP A 72 12.659 5.669 -3.507 1.00 0.00 C ATOM 1016 C ASP A 72 13.573 5.656 -2.285 1.00 0.00 C ATOM 1017 O ASP A 72 13.587 6.601 -1.498 1.00 0.00 O ATOM 1018 CB ASP A 72 13.406 6.243 -4.711 1.00 0.00 C ATOM 1019 CG ASP A 72 13.963 7.627 -4.441 1.00 0.00 C ATOM 1020 OD1 ASP A 72 13.200 8.491 -3.962 1.00 0.00 O ATOM 1021 OD2 ASP A 72 15.163 7.845 -4.709 1.00 0.00 O ATOM 0 H ASP A 72 11.622 7.398 -2.931 1.00 0.00 H new ATOM 0 HA ASP A 72 12.363 4.644 -3.729 1.00 0.00 H new ATOM 0 HB2 ASP A 72 14.222 5.573 -4.982 1.00 0.00 H new ATOM 0 HB3 ASP A 72 12.732 6.286 -5.566 1.00 0.00 H new ATOM 1026 N GLY A 73 14.335 4.577 -2.133 1.00 0.00 N ATOM 1027 CA GLY A 73 15.240 4.460 -1.005 1.00 0.00 C ATOM 1028 C GLY A 73 14.542 3.980 0.252 1.00 0.00 C ATOM 1029 O GLY A 73 14.626 4.621 1.300 1.00 0.00 O ATOM 0 H GLY A 73 14.341 3.782 -2.771 1.00 0.00 H new ATOM 0 HA2 GLY A 73 16.043 3.767 -1.258 1.00 0.00 H new ATOM 0 HA3 GLY A 73 15.703 5.428 -0.813 1.00 0.00 H new ATOM 1033 N ILE A 74 13.849 2.851 0.147 1.00 0.00 N ATOM 1034 CA ILE A 74 13.133 2.286 1.284 1.00 0.00 C ATOM 1035 C ILE A 74 13.782 0.989 1.754 1.00 0.00 C ATOM 1036 O ILE A 74 14.034 0.085 0.958 1.00 0.00 O ATOM 1037 CB ILE A 74 11.657 2.013 0.940 1.00 0.00 C ATOM 1038 CG1 ILE A 74 10.955 3.311 0.536 1.00 0.00 C ATOM 1039 CG2 ILE A 74 10.948 1.367 2.121 1.00 0.00 C ATOM 1040 CD1 ILE A 74 9.526 3.110 0.082 1.00 0.00 C ATOM 0 H ILE A 74 13.768 2.310 -0.714 1.00 0.00 H new ATOM 0 HA ILE A 74 13.181 3.024 2.085 1.00 0.00 H new ATOM 0 HB ILE A 74 11.618 1.324 0.096 1.00 0.00 H new ATOM 0 HG12 ILE A 74 10.966 3.999 1.382 1.00 0.00 H new ATOM 0 HG13 ILE A 74 11.519 3.785 -0.267 1.00 0.00 H new ATOM 0 HG21 ILE A 74 9.906 1.180 1.862 1.00 0.00 H new ATOM 0 HG22 ILE A 74 11.435 0.423 2.366 1.00 0.00 H new ATOM 0 HG23 ILE A 74 10.994 2.034 2.982 1.00 0.00 H new ATOM 0 HD11 ILE A 74 9.091 4.072 -0.189 1.00 0.00 H new ATOM 0 HD12 ILE A 74 9.509 2.448 -0.784 1.00 0.00 H new ATOM 0 HD13 ILE A 74 8.946 2.665 0.891 1.00 0.00 H new ATOM 1052 N SER A 75 14.050 0.905 3.053 1.00 0.00 N ATOM 1053 CA SER A 75 14.672 -0.281 3.630 1.00 0.00 C ATOM 1054 C SER A 75 13.732 -1.480 3.554 1.00 0.00 C ATOM 1055 O SER A 75 12.563 -1.391 3.930 1.00 0.00 O ATOM 1056 CB SER A 75 15.066 -0.019 5.085 1.00 0.00 C ATOM 1057 OG SER A 75 16.386 0.490 5.172 1.00 0.00 O ATOM 0 H SER A 75 13.846 1.644 3.726 1.00 0.00 H new ATOM 0 HA SER A 75 15.568 -0.508 3.053 1.00 0.00 H new ATOM 0 HB2 SER A 75 14.369 0.690 5.532 1.00 0.00 H new ATOM 0 HB3 SER A 75 14.991 -0.943 5.658 1.00 0.00 H new ATOM 0 HG SER A 75 16.613 0.651 6.112 1.00 0.00 H new ATOM 1063 N ARG A 76 14.251 -2.600 3.063 1.00 0.00 N ATOM 1064 CA ARG A 76 13.458 -3.817 2.935 1.00 0.00 C ATOM 1065 C ARG A 76 12.836 -4.204 4.274 1.00 0.00 C ATOM 1066 O ARG A 76 11.890 -4.989 4.325 1.00 0.00 O ATOM 1067 CB ARG A 76 14.326 -4.964 2.414 1.00 0.00 C ATOM 1068 CG ARG A 76 15.550 -5.240 3.271 1.00 0.00 C ATOM 1069 CD ARG A 76 16.245 -6.526 2.852 1.00 0.00 C ATOM 1070 NE ARG A 76 17.681 -6.484 3.116 1.00 0.00 N ATOM 1071 CZ ARG A 76 18.565 -5.946 2.283 1.00 0.00 C ATOM 1072 NH1 ARG A 76 18.163 -5.408 1.140 1.00 0.00 N ATOM 1073 NH2 ARG A 76 19.855 -5.945 2.593 1.00 0.00 N ATOM 0 H ARG A 76 15.217 -2.690 2.747 1.00 0.00 H new ATOM 0 HA ARG A 76 12.656 -3.625 2.223 1.00 0.00 H new ATOM 0 HB2 ARG A 76 13.721 -5.869 2.357 1.00 0.00 H new ATOM 0 HB3 ARG A 76 14.649 -4.732 1.399 1.00 0.00 H new ATOM 0 HG2 ARG A 76 16.247 -4.406 3.191 1.00 0.00 H new ATOM 0 HG3 ARG A 76 15.254 -5.309 4.318 1.00 0.00 H new ATOM 0 HD2 ARG A 76 15.803 -7.367 3.386 1.00 0.00 H new ATOM 0 HD3 ARG A 76 16.077 -6.699 1.789 1.00 0.00 H new ATOM 0 HE ARG A 76 18.024 -6.890 3.987 1.00 0.00 H new ATOM 0 HH11 ARG A 76 17.172 -5.406 0.898 1.00 0.00 H new ATOM 0 HH12 ARG A 76 18.845 -4.996 0.503 1.00 0.00 H new ATOM 0 HH21 ARG A 76 20.169 -6.358 3.472 1.00 0.00 H new ATOM 0 HH22 ARG A 76 20.533 -5.532 1.953 1.00 0.00 H new ATOM 1087 N GLU A 77 13.376 -3.648 5.354 1.00 0.00 N ATOM 1088 CA GLU A 77 12.874 -3.937 6.693 1.00 0.00 C ATOM 1089 C GLU A 77 11.825 -2.911 7.113 1.00 0.00 C ATOM 1090 O GLU A 77 11.642 -2.646 8.301 1.00 0.00 O ATOM 1091 CB GLU A 77 14.025 -3.948 7.701 1.00 0.00 C ATOM 1092 CG GLU A 77 15.152 -4.896 7.327 1.00 0.00 C ATOM 1093 CD GLU A 77 16.216 -4.230 6.476 1.00 0.00 C ATOM 1094 OE1 GLU A 77 16.300 -2.985 6.497 1.00 0.00 O ATOM 1095 OE2 GLU A 77 16.964 -4.956 5.788 1.00 0.00 O ATOM 0 H GLU A 77 14.160 -2.996 5.328 1.00 0.00 H new ATOM 0 HA GLU A 77 12.407 -4.922 6.675 1.00 0.00 H new ATOM 0 HB2 GLU A 77 14.426 -2.939 7.793 1.00 0.00 H new ATOM 0 HB3 GLU A 77 13.637 -4.227 8.680 1.00 0.00 H new ATOM 0 HG2 GLU A 77 15.610 -5.286 8.236 1.00 0.00 H new ATOM 0 HG3 GLU A 77 14.741 -5.748 6.786 1.00 0.00 H new ATOM 1102 N HIS A 78 11.139 -2.338 6.129 1.00 0.00 N ATOM 1103 CA HIS A 78 10.108 -1.341 6.396 1.00 0.00 C ATOM 1104 C HIS A 78 8.801 -1.714 5.704 1.00 0.00 C ATOM 1105 O HIS A 78 8.584 -1.374 4.541 1.00 0.00 O ATOM 1106 CB HIS A 78 10.571 0.040 5.930 1.00 0.00 C ATOM 1107 CG HIS A 78 11.348 0.792 6.965 1.00 0.00 C ATOM 1108 ND1 HIS A 78 12.626 0.651 7.390 1.00 0.00 N flip ATOM 1109 CD2 HIS A 78 10.815 1.831 7.699 1.00 0.00 C flip ATOM 1110 CE1 HIS A 78 12.840 1.597 8.361 1.00 0.00 C flip ATOM 1111 NE2 HIS A 78 11.732 2.297 8.529 1.00 0.00 N flip ATOM 0 H HIS A 78 11.278 -2.547 5.140 1.00 0.00 H new ATOM 0 HA HIS A 78 9.934 -1.313 7.472 1.00 0.00 H new ATOM 0 HB2 HIS A 78 11.186 -0.074 5.038 1.00 0.00 H new ATOM 0 HB3 HIS A 78 9.700 0.629 5.643 1.00 0.00 H new ATOM 0 HD2 HIS A 78 9.806 2.205 7.610 1.00 0.00 H new ATOM 0 HE1 HIS A 78 13.764 1.745 8.900 1.00 0.00 H new ATOM 0 HE2 HIS A 78 11.606 3.066 9.187 1.00 0.00 H new ATOM 1120 N SER A 79 7.933 -2.414 6.427 1.00 0.00 N ATOM 1121 CA SER A 79 6.648 -2.837 5.880 1.00 0.00 C ATOM 1122 C SER A 79 5.637 -1.695 5.924 1.00 0.00 C ATOM 1123 O SER A 79 4.441 -1.902 5.719 1.00 0.00 O ATOM 1124 CB SER A 79 6.110 -4.040 6.657 1.00 0.00 C ATOM 1125 OG SER A 79 5.705 -3.664 7.962 1.00 0.00 O ATOM 0 H SER A 79 8.095 -2.700 7.392 1.00 0.00 H new ATOM 0 HA SER A 79 6.801 -3.125 4.840 1.00 0.00 H new ATOM 0 HB2 SER A 79 5.266 -4.475 6.122 1.00 0.00 H new ATOM 0 HB3 SER A 79 6.879 -4.810 6.719 1.00 0.00 H new ATOM 0 HG SER A 79 5.363 -4.450 8.438 1.00 0.00 H new ATOM 1131 N SER A 80 6.127 -0.489 6.194 1.00 0.00 N ATOM 1132 CA SER A 80 5.267 0.686 6.269 1.00 0.00 C ATOM 1133 C SER A 80 6.026 1.942 5.851 1.00 0.00 C ATOM 1134 O SER A 80 7.255 1.979 5.889 1.00 0.00 O ATOM 1135 CB SER A 80 4.721 0.855 7.688 1.00 0.00 C ATOM 1136 OG SER A 80 5.774 0.939 8.633 1.00 0.00 O ATOM 0 H SER A 80 7.115 -0.300 6.364 1.00 0.00 H new ATOM 0 HA SER A 80 4.434 0.540 5.582 1.00 0.00 H new ATOM 0 HB2 SER A 80 4.108 1.755 7.741 1.00 0.00 H new ATOM 0 HB3 SER A 80 4.073 0.014 7.934 1.00 0.00 H new ATOM 0 HG SER A 80 5.399 1.048 9.532 1.00 0.00 H new ATOM 1142 N TRP A 81 5.283 2.968 5.452 1.00 0.00 N ATOM 1143 CA TRP A 81 5.885 4.227 5.026 1.00 0.00 C ATOM 1144 C TRP A 81 4.966 5.403 5.340 1.00 0.00 C ATOM 1145 O TRP A 81 3.744 5.256 5.373 1.00 0.00 O ATOM 1146 CB TRP A 81 6.191 4.189 3.528 1.00 0.00 C ATOM 1147 CG TRP A 81 7.042 5.333 3.066 1.00 0.00 C ATOM 1148 CD1 TRP A 81 6.629 6.432 2.370 1.00 0.00 C ATOM 1149 CD2 TRP A 81 8.451 5.488 3.267 1.00 0.00 C ATOM 1150 NE1 TRP A 81 7.697 7.262 2.125 1.00 0.00 N ATOM 1151 CE2 TRP A 81 8.826 6.706 2.666 1.00 0.00 C ATOM 1152 CE3 TRP A 81 9.432 4.718 3.897 1.00 0.00 C ATOM 1153 CZ2 TRP A 81 10.139 7.168 2.677 1.00 0.00 C ATOM 1154 CZ3 TRP A 81 10.735 5.179 3.907 1.00 0.00 C ATOM 1155 CH2 TRP A 81 11.079 6.394 3.301 1.00 0.00 C ATOM 0 H TRP A 81 4.264 2.953 5.414 1.00 0.00 H new ATOM 0 HA TRP A 81 6.816 4.360 5.576 1.00 0.00 H new ATOM 0 HB2 TRP A 81 6.695 3.252 3.291 1.00 0.00 H new ATOM 0 HB3 TRP A 81 5.253 4.196 2.973 1.00 0.00 H new ATOM 0 HD1 TRP A 81 5.613 6.622 2.058 1.00 0.00 H new ATOM 0 HE1 TRP A 81 7.656 8.148 1.622 1.00 0.00 H new ATOM 0 HE3 TRP A 81 9.177 3.780 4.367 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 10.406 8.104 2.210 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 11.502 4.592 4.391 1.00 0.00 H new ATOM 0 HH2 TRP A 81 12.106 6.726 3.327 1.00 0.00 H new ATOM 1166 N ASP A 82 5.561 6.568 5.568 1.00 0.00 N ATOM 1167 CA ASP A 82 4.796 7.770 5.878 1.00 0.00 C ATOM 1168 C ASP A 82 4.939 8.807 4.768 1.00 0.00 C ATOM 1169 O ASP A 82 5.915 9.558 4.728 1.00 0.00 O ATOM 1170 CB ASP A 82 5.255 8.364 7.210 1.00 0.00 C ATOM 1171 CG ASP A 82 6.763 8.344 7.364 1.00 0.00 C ATOM 1172 OD1 ASP A 82 7.466 8.423 6.335 1.00 0.00 O ATOM 1173 OD2 ASP A 82 7.240 8.251 8.514 1.00 0.00 O ATOM 0 H ASP A 82 6.571 6.706 5.544 1.00 0.00 H new ATOM 0 HA ASP A 82 3.745 7.491 5.957 1.00 0.00 H new ATOM 0 HB2 ASP A 82 4.898 9.391 7.289 1.00 0.00 H new ATOM 0 HB3 ASP A 82 4.802 7.806 8.029 1.00 0.00 H new ATOM 1178 N LEU A 83 3.963 8.842 3.868 1.00 0.00 N ATOM 1179 CA LEU A 83 3.981 9.786 2.756 1.00 0.00 C ATOM 1180 C LEU A 83 3.777 11.215 3.252 1.00 0.00 C ATOM 1181 O LEU A 83 2.937 11.470 4.115 1.00 0.00 O ATOM 1182 CB LEU A 83 2.896 9.427 1.739 1.00 0.00 C ATOM 1183 CG LEU A 83 2.911 7.989 1.221 1.00 0.00 C ATOM 1184 CD1 LEU A 83 1.527 7.579 0.742 1.00 0.00 C ATOM 1185 CD2 LEU A 83 3.932 7.835 0.103 1.00 0.00 C ATOM 0 H LEU A 83 3.149 8.228 3.886 1.00 0.00 H new ATOM 0 HA LEU A 83 4.957 9.724 2.274 1.00 0.00 H new ATOM 0 HB2 LEU A 83 1.923 9.618 2.193 1.00 0.00 H new ATOM 0 HB3 LEU A 83 2.988 10.100 0.887 1.00 0.00 H new ATOM 0 HG LEU A 83 3.198 7.331 2.041 1.00 0.00 H new ATOM 0 HD11 LEU A 83 1.558 6.552 0.377 1.00 0.00 H new ATOM 0 HD12 LEU A 83 0.820 7.649 1.569 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.210 8.241 -0.064 1.00 0.00 H new ATOM 0 HD21 LEU A 83 3.929 6.805 -0.253 1.00 0.00 H new ATOM 0 HD22 LEU A 83 3.676 8.504 -0.718 1.00 0.00 H new ATOM 0 HD23 LEU A 83 4.924 8.086 0.479 1.00 0.00 H new ATOM 1197 N VAL A 84 4.549 12.144 2.697 1.00 0.00 N ATOM 1198 CA VAL A 84 4.452 13.547 3.080 1.00 0.00 C ATOM 1199 C VAL A 84 4.486 14.454 1.855 1.00 0.00 C ATOM 1200 O VAL A 84 5.361 14.326 0.999 1.00 0.00 O ATOM 1201 CB VAL A 84 5.591 13.949 4.035 1.00 0.00 C ATOM 1202 CG1 VAL A 84 5.534 13.123 5.311 1.00 0.00 C ATOM 1203 CG2 VAL A 84 6.940 13.795 3.350 1.00 0.00 C ATOM 0 H VAL A 84 5.249 11.950 1.981 1.00 0.00 H new ATOM 0 HA VAL A 84 3.498 13.670 3.593 1.00 0.00 H new ATOM 0 HB VAL A 84 5.464 14.998 4.303 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.346 13.421 5.974 1.00 0.00 H new ATOM 0 HG12 VAL A 84 4.579 13.289 5.810 1.00 0.00 H new ATOM 0 HG13 VAL A 84 5.635 12.066 5.065 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.733 14.084 4.040 1.00 0.00 H new ATOM 0 HG22 VAL A 84 7.080 12.756 3.051 1.00 0.00 H new ATOM 0 HG23 VAL A 84 6.975 14.435 2.468 1.00 0.00 H new ATOM 1213 N GLY A 85 3.528 15.373 1.778 1.00 0.00 N ATOM 1214 CA GLY A 85 3.467 16.289 0.654 1.00 0.00 C ATOM 1215 C GLY A 85 2.234 16.075 -0.202 1.00 0.00 C ATOM 1216 O GLY A 85 2.308 16.113 -1.431 1.00 0.00 O ATOM 0 H GLY A 85 2.793 15.499 2.474 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.475 17.314 1.024 1.00 0.00 H new ATOM 0 HA3 GLY A 85 4.358 16.165 0.039 1.00 0.00 H new ATOM 1220 N LEU A 86 1.097 15.848 0.447 1.00 0.00 N ATOM 1221 CA LEU A 86 -0.157 15.625 -0.263 1.00 0.00 C ATOM 1222 C LEU A 86 -1.154 16.742 0.030 1.00 0.00 C ATOM 1223 O LEU A 86 -0.872 17.649 0.812 1.00 0.00 O ATOM 1224 CB LEU A 86 -0.757 14.275 0.133 1.00 0.00 C ATOM 1225 CG LEU A 86 0.198 13.082 0.103 1.00 0.00 C ATOM 1226 CD1 LEU A 86 -0.420 11.885 0.810 1.00 0.00 C ATOM 1227 CD2 LEU A 86 0.564 12.726 -1.330 1.00 0.00 C ATOM 0 H LEU A 86 1.018 15.814 1.463 1.00 0.00 H new ATOM 0 HA LEU A 86 0.055 15.622 -1.332 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -1.165 14.363 1.140 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.593 14.062 -0.533 1.00 0.00 H new ATOM 0 HG LEU A 86 1.110 13.359 0.631 1.00 0.00 H new ATOM 0 HD11 LEU A 86 0.274 11.045 0.778 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -0.630 12.144 1.848 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -1.348 11.607 0.311 1.00 0.00 H new ATOM 0 HD21 LEU A 86 1.244 11.875 -1.331 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -0.339 12.469 -1.883 1.00 0.00 H new ATOM 0 HD23 LEU A 86 1.050 13.579 -1.804 1.00 0.00 H new ATOM 1239 N GLU A 87 -2.321 16.668 -0.603 1.00 0.00 N ATOM 1240 CA GLU A 87 -3.360 17.673 -0.409 1.00 0.00 C ATOM 1241 C GLU A 87 -4.141 17.407 0.875 1.00 0.00 C ATOM 1242 O GLU A 87 -4.079 16.314 1.438 1.00 0.00 O ATOM 1243 CB GLU A 87 -4.314 17.690 -1.605 1.00 0.00 C ATOM 1244 CG GLU A 87 -5.082 18.993 -1.752 1.00 0.00 C ATOM 1245 CD GLU A 87 -4.169 20.194 -1.908 1.00 0.00 C ATOM 1246 OE1 GLU A 87 -3.777 20.779 -0.877 1.00 0.00 O ATOM 1247 OE2 GLU A 87 -3.847 20.547 -3.062 1.00 0.00 O ATOM 0 H GLU A 87 -2.570 15.923 -1.254 1.00 0.00 H new ATOM 0 HA GLU A 87 -2.877 18.647 -0.325 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -3.744 17.509 -2.516 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -5.024 16.869 -1.505 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -5.740 18.927 -2.618 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -5.718 19.136 -0.879 1.00 0.00 H new ATOM 1254 N LYS A 88 -4.876 18.415 1.333 1.00 0.00 N ATOM 1255 CA LYS A 88 -5.670 18.292 2.549 1.00 0.00 C ATOM 1256 C LYS A 88 -7.125 17.973 2.219 1.00 0.00 C ATOM 1257 O LYS A 88 -7.693 18.526 1.277 1.00 0.00 O ATOM 1258 CB LYS A 88 -5.594 19.584 3.366 1.00 0.00 C ATOM 1259 CG LYS A 88 -4.174 20.011 3.696 1.00 0.00 C ATOM 1260 CD LYS A 88 -4.130 21.431 4.234 1.00 0.00 C ATOM 1261 CE LYS A 88 -2.735 22.028 4.121 1.00 0.00 C ATOM 1262 NZ LYS A 88 -2.512 23.110 5.119 1.00 0.00 N ATOM 0 H LYS A 88 -4.938 19.327 0.880 1.00 0.00 H new ATOM 0 HA LYS A 88 -5.260 17.472 3.138 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -6.086 20.384 2.812 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -6.150 19.451 4.294 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -3.750 19.329 4.432 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -3.555 19.940 2.802 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -4.838 22.051 3.684 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -4.445 21.436 5.277 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -1.992 21.244 4.264 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -2.590 22.425 3.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -1.979 23.886 4.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -3.429 23.468 5.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -1.972 22.734 5.924 1.00 0.00 H new ATOM 1276 N TRP A 89 -7.722 17.079 2.999 1.00 0.00 N ATOM 1277 CA TRP A 89 -9.111 16.688 2.790 1.00 0.00 C ATOM 1278 C TRP A 89 -9.332 16.208 1.360 1.00 0.00 C ATOM 1279 O TRP A 89 -10.263 16.645 0.683 1.00 0.00 O ATOM 1280 CB TRP A 89 -10.044 17.860 3.097 1.00 0.00 C ATOM 1281 CG TRP A 89 -11.381 17.434 3.624 1.00 0.00 C ATOM 1282 CD1 TRP A 89 -11.622 16.475 4.567 1.00 0.00 C ATOM 1283 CD2 TRP A 89 -12.659 17.950 3.238 1.00 0.00 C ATOM 1284 NE1 TRP A 89 -12.973 16.364 4.789 1.00 0.00 N ATOM 1285 CE2 TRP A 89 -13.631 17.258 3.987 1.00 0.00 C ATOM 1286 CE3 TRP A 89 -13.077 18.930 2.334 1.00 0.00 C ATOM 1287 CZ2 TRP A 89 -14.993 17.516 3.857 1.00 0.00 C ATOM 1288 CZ3 TRP A 89 -14.429 19.184 2.206 1.00 0.00 C ATOM 1289 CH2 TRP A 89 -15.374 18.481 2.964 1.00 0.00 C ATOM 0 H TRP A 89 -7.266 16.611 3.782 1.00 0.00 H new ATOM 0 HA TRP A 89 -9.337 15.865 3.469 1.00 0.00 H new ATOM 0 HB2 TRP A 89 -9.566 18.514 3.826 1.00 0.00 H new ATOM 0 HB3 TRP A 89 -10.189 18.446 2.190 1.00 0.00 H new ATOM 0 HD1 TRP A 89 -10.862 15.890 5.064 1.00 0.00 H new ATOM 0 HE1 TRP A 89 -13.415 15.720 5.445 1.00 0.00 H new ATOM 0 HE3 TRP A 89 -12.356 19.479 1.746 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 -15.723 16.974 4.440 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 -14.763 19.938 1.509 1.00 0.00 H new ATOM 0 HH2 TRP A 89 -16.423 18.705 2.842 1.00 0.00 H new ATOM 1300 N THR A 90 -8.469 15.304 0.904 1.00 0.00 N ATOM 1301 CA THR A 90 -8.570 14.765 -0.446 1.00 0.00 C ATOM 1302 C THR A 90 -8.158 13.298 -0.485 1.00 0.00 C ATOM 1303 O THR A 90 -7.210 12.893 0.187 1.00 0.00 O ATOM 1304 CB THR A 90 -7.694 15.558 -1.435 1.00 0.00 C ATOM 1305 OG1 THR A 90 -8.035 16.948 -1.384 1.00 0.00 O ATOM 1306 CG2 THR A 90 -7.872 15.038 -2.853 1.00 0.00 C ATOM 0 H THR A 90 -7.693 14.931 1.450 1.00 0.00 H new ATOM 0 HA THR A 90 -9.615 14.855 -0.744 1.00 0.00 H new ATOM 0 HB THR A 90 -6.651 15.429 -1.147 1.00 0.00 H new ATOM 0 HG1 THR A 90 -7.768 17.319 -0.517 1.00 0.00 H new ATOM 0 HG21 THR A 90 -7.244 15.613 -3.533 1.00 0.00 H new ATOM 0 HG22 THR A 90 -7.584 13.987 -2.894 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.916 15.140 -3.150 1.00 0.00 H new ATOM 1314 N GLU A 91 -8.876 12.507 -1.276 1.00 0.00 N ATOM 1315 CA GLU A 91 -8.584 11.084 -1.400 1.00 0.00 C ATOM 1316 C GLU A 91 -7.321 10.858 -2.226 1.00 0.00 C ATOM 1317 O GLU A 91 -7.032 11.610 -3.157 1.00 0.00 O ATOM 1318 CB GLU A 91 -9.764 10.352 -2.043 1.00 0.00 C ATOM 1319 CG GLU A 91 -9.698 8.842 -1.896 1.00 0.00 C ATOM 1320 CD GLU A 91 -11.011 8.164 -2.236 1.00 0.00 C ATOM 1321 OE1 GLU A 91 -11.926 8.184 -1.388 1.00 0.00 O ATOM 1322 OE2 GLU A 91 -11.122 7.613 -3.352 1.00 0.00 O ATOM 0 H GLU A 91 -9.663 12.827 -1.840 1.00 0.00 H new ATOM 0 HA GLU A 91 -8.420 10.685 -0.399 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -10.691 10.712 -1.596 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -9.803 10.604 -3.103 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -8.913 8.452 -2.544 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -9.419 8.592 -0.872 1.00 0.00 H new ATOM 1329 N TYR A 92 -6.572 9.818 -1.878 1.00 0.00 N ATOM 1330 CA TYR A 92 -5.338 9.494 -2.584 1.00 0.00 C ATOM 1331 C TYR A 92 -5.167 7.984 -2.718 1.00 0.00 C ATOM 1332 O TYR A 92 -5.324 7.242 -1.749 1.00 0.00 O ATOM 1333 CB TYR A 92 -4.135 10.092 -1.852 1.00 0.00 C ATOM 1334 CG TYR A 92 -3.860 11.534 -2.216 1.00 0.00 C ATOM 1335 CD1 TYR A 92 -4.495 12.573 -1.547 1.00 0.00 C ATOM 1336 CD2 TYR A 92 -2.966 11.857 -3.230 1.00 0.00 C ATOM 1337 CE1 TYR A 92 -4.248 13.891 -1.877 1.00 0.00 C ATOM 1338 CE2 TYR A 92 -2.711 13.173 -3.565 1.00 0.00 C ATOM 1339 CZ TYR A 92 -3.355 14.186 -2.886 1.00 0.00 C ATOM 1340 OH TYR A 92 -3.105 15.498 -3.217 1.00 0.00 O ATOM 0 H TYR A 92 -6.798 9.185 -1.111 1.00 0.00 H new ATOM 0 HA TYR A 92 -5.398 9.924 -3.584 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -4.303 10.023 -0.777 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -3.251 9.495 -2.075 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -5.194 12.346 -0.755 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -2.462 11.066 -3.765 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -4.751 14.687 -1.348 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -2.012 13.407 -4.354 1.00 0.00 H new ATOM 0 HH TYR A 92 -2.451 15.533 -3.946 1.00 0.00 H new ATOM 1350 N ARG A 93 -4.844 7.537 -3.927 1.00 0.00 N ATOM 1351 CA ARG A 93 -4.651 6.116 -4.190 1.00 0.00 C ATOM 1352 C ARG A 93 -3.182 5.731 -4.048 1.00 0.00 C ATOM 1353 O ARG A 93 -2.351 6.093 -4.882 1.00 0.00 O ATOM 1354 CB ARG A 93 -5.149 5.763 -5.593 1.00 0.00 C ATOM 1355 CG ARG A 93 -6.659 5.859 -5.745 1.00 0.00 C ATOM 1356 CD ARG A 93 -7.114 5.354 -7.105 1.00 0.00 C ATOM 1357 NE ARG A 93 -6.515 6.114 -8.200 1.00 0.00 N ATOM 1358 CZ ARG A 93 -6.971 6.089 -9.447 1.00 0.00 C ATOM 1359 NH1 ARG A 93 -8.026 5.348 -9.756 1.00 0.00 N ATOM 1360 NH2 ARG A 93 -6.372 6.808 -10.388 1.00 0.00 N ATOM 0 H ARG A 93 -4.710 8.138 -4.740 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.228 5.555 -3.455 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -4.676 6.429 -6.315 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -4.831 4.750 -5.838 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -7.143 5.278 -4.959 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -6.974 6.895 -5.616 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -6.850 4.301 -7.208 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -8.200 5.418 -7.171 1.00 0.00 H new ATOM 0 HE ARG A 93 -5.702 6.695 -7.995 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -8.490 4.795 -9.035 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -8.374 5.331 -10.715 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -5.561 7.380 -10.154 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -6.723 6.788 -11.346 1.00 0.00 H new ATOM 1374 N VAL A 94 -2.867 4.995 -2.987 1.00 0.00 N ATOM 1375 CA VAL A 94 -1.499 4.560 -2.736 1.00 0.00 C ATOM 1376 C VAL A 94 -1.279 3.130 -3.218 1.00 0.00 C ATOM 1377 O VAL A 94 -2.101 2.248 -2.970 1.00 0.00 O ATOM 1378 CB VAL A 94 -1.148 4.645 -1.239 1.00 0.00 C ATOM 1379 CG1 VAL A 94 0.261 4.128 -0.990 1.00 0.00 C ATOM 1380 CG2 VAL A 94 -1.298 6.073 -0.737 1.00 0.00 C ATOM 0 H VAL A 94 -3.542 4.687 -2.287 1.00 0.00 H new ATOM 0 HA VAL A 94 -0.847 5.232 -3.293 1.00 0.00 H new ATOM 0 HB VAL A 94 -1.843 4.015 -0.684 1.00 0.00 H new ATOM 0 HG11 VAL A 94 0.491 4.196 0.073 1.00 0.00 H new ATOM 0 HG12 VAL A 94 0.329 3.088 -1.310 1.00 0.00 H new ATOM 0 HG13 VAL A 94 0.974 4.729 -1.555 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -1.046 6.115 0.323 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -0.628 6.727 -1.295 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -2.327 6.402 -0.878 1.00 0.00 H new ATOM 1390 N TRP A 95 -0.166 2.909 -3.908 1.00 0.00 N ATOM 1391 CA TRP A 95 0.162 1.585 -4.425 1.00 0.00 C ATOM 1392 C TRP A 95 1.532 1.133 -3.933 1.00 0.00 C ATOM 1393 O TRP A 95 2.559 1.685 -4.329 1.00 0.00 O ATOM 1394 CB TRP A 95 0.132 1.590 -5.954 1.00 0.00 C ATOM 1395 CG TRP A 95 -1.214 1.926 -6.521 1.00 0.00 C ATOM 1396 CD1 TRP A 95 -2.234 1.055 -6.780 1.00 0.00 C ATOM 1397 CD2 TRP A 95 -1.685 3.223 -6.900 1.00 0.00 C ATOM 1398 NE1 TRP A 95 -3.311 1.734 -7.297 1.00 0.00 N ATOM 1399 CE2 TRP A 95 -3.000 3.065 -7.380 1.00 0.00 C ATOM 1400 CE3 TRP A 95 -1.125 4.504 -6.879 1.00 0.00 C ATOM 1401 CZ2 TRP A 95 -3.760 4.139 -7.836 1.00 0.00 C ATOM 1402 CZ3 TRP A 95 -1.881 5.569 -7.332 1.00 0.00 C ATOM 1403 CH2 TRP A 95 -3.187 5.382 -7.804 1.00 0.00 C ATOM 0 H TRP A 95 0.524 3.629 -4.122 1.00 0.00 H new ATOM 0 HA TRP A 95 -0.586 0.883 -4.056 1.00 0.00 H new ATOM 0 HB2 TRP A 95 0.863 2.310 -6.322 1.00 0.00 H new ATOM 0 HB3 TRP A 95 0.438 0.610 -6.319 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -2.199 -0.010 -6.604 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -4.198 1.314 -7.574 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -0.120 4.659 -6.515 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -4.766 3.996 -8.202 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -1.458 6.563 -7.322 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -3.753 6.235 -8.149 1.00 0.00 H new ATOM 1414 N VAL A 96 1.542 0.125 -3.066 1.00 0.00 N ATOM 1415 CA VAL A 96 2.787 -0.402 -2.520 1.00 0.00 C ATOM 1416 C VAL A 96 3.068 -1.805 -3.048 1.00 0.00 C ATOM 1417 O VAL A 96 2.183 -2.662 -3.064 1.00 0.00 O ATOM 1418 CB VAL A 96 2.753 -0.442 -0.981 1.00 0.00 C ATOM 1419 CG1 VAL A 96 1.521 -1.189 -0.493 1.00 0.00 C ATOM 1420 CG2 VAL A 96 4.023 -1.079 -0.437 1.00 0.00 C ATOM 0 H VAL A 96 0.702 -0.343 -2.727 1.00 0.00 H new ATOM 0 HA VAL A 96 3.583 0.270 -2.841 1.00 0.00 H new ATOM 0 HB VAL A 96 2.699 0.581 -0.609 1.00 0.00 H new ATOM 0 HG11 VAL A 96 1.514 -1.207 0.597 1.00 0.00 H new ATOM 0 HG12 VAL A 96 0.624 -0.686 -0.853 1.00 0.00 H new ATOM 0 HG13 VAL A 96 1.541 -2.211 -0.873 1.00 0.00 H new ATOM 0 HG21 VAL A 96 3.982 -1.099 0.652 1.00 0.00 H new ATOM 0 HG22 VAL A 96 4.110 -2.097 -0.816 1.00 0.00 H new ATOM 0 HG23 VAL A 96 4.888 -0.497 -0.757 1.00 0.00 H new ATOM 1430 N ARG A 97 4.304 -2.033 -3.478 1.00 0.00 N ATOM 1431 CA ARG A 97 4.702 -3.332 -4.007 1.00 0.00 C ATOM 1432 C ARG A 97 6.025 -3.786 -3.397 1.00 0.00 C ATOM 1433 O ARG A 97 6.751 -2.990 -2.803 1.00 0.00 O ATOM 1434 CB ARG A 97 4.825 -3.270 -5.531 1.00 0.00 C ATOM 1435 CG ARG A 97 5.760 -2.177 -6.022 1.00 0.00 C ATOM 1436 CD ARG A 97 5.402 -1.728 -7.430 1.00 0.00 C ATOM 1437 NE ARG A 97 4.330 -0.735 -7.432 1.00 0.00 N ATOM 1438 CZ ARG A 97 4.126 0.123 -8.424 1.00 0.00 C ATOM 1439 NH1 ARG A 97 4.915 0.111 -9.490 1.00 0.00 N ATOM 1440 NH2 ARG A 97 3.129 0.997 -8.352 1.00 0.00 N ATOM 0 H ARG A 97 5.048 -1.335 -3.471 1.00 0.00 H new ATOM 0 HA ARG A 97 3.932 -4.056 -3.741 1.00 0.00 H new ATOM 0 HB2 ARG A 97 5.181 -4.233 -5.898 1.00 0.00 H new ATOM 0 HB3 ARG A 97 3.836 -3.111 -5.961 1.00 0.00 H new ATOM 0 HG2 ARG A 97 5.713 -1.325 -5.344 1.00 0.00 H new ATOM 0 HG3 ARG A 97 6.787 -2.541 -6.005 1.00 0.00 H new ATOM 0 HD2 ARG A 97 6.285 -1.309 -7.912 1.00 0.00 H new ATOM 0 HD3 ARG A 97 5.097 -2.592 -8.020 1.00 0.00 H new ATOM 0 HE ARG A 97 3.704 -0.699 -6.627 1.00 0.00 H new ATOM 0 HH11 ARG A 97 5.682 -0.559 -9.550 1.00 0.00 H new ATOM 0 HH12 ARG A 97 4.755 0.772 -10.250 1.00 0.00 H new ATOM 0 HH21 ARG A 97 2.520 1.009 -7.534 1.00 0.00 H new ATOM 0 HH22 ARG A 97 2.973 1.656 -9.115 1.00 0.00 H new ATOM 1454 N ALA A 98 6.330 -5.070 -3.548 1.00 0.00 N ATOM 1455 CA ALA A 98 7.566 -5.630 -3.014 1.00 0.00 C ATOM 1456 C ALA A 98 8.507 -6.053 -4.137 1.00 0.00 C ATOM 1457 O ALA A 98 8.172 -6.913 -4.951 1.00 0.00 O ATOM 1458 CB ALA A 98 7.260 -6.811 -2.105 1.00 0.00 C ATOM 0 H ALA A 98 5.738 -5.743 -4.036 1.00 0.00 H new ATOM 0 HA ALA A 98 8.065 -4.856 -2.430 1.00 0.00 H new ATOM 0 HB1 ALA A 98 8.192 -7.220 -1.713 1.00 0.00 H new ATOM 0 HB2 ALA A 98 6.632 -6.480 -1.277 1.00 0.00 H new ATOM 0 HB3 ALA A 98 6.736 -7.581 -2.672 1.00 0.00 H new ATOM 1464 N HIS A 99 9.687 -5.441 -4.175 1.00 0.00 N ATOM 1465 CA HIS A 99 10.678 -5.755 -5.198 1.00 0.00 C ATOM 1466 C HIS A 99 11.634 -6.842 -4.714 1.00 0.00 C ATOM 1467 O HIS A 99 12.067 -6.835 -3.562 1.00 0.00 O ATOM 1468 CB HIS A 99 11.464 -4.500 -5.578 1.00 0.00 C ATOM 1469 CG HIS A 99 10.752 -3.621 -6.560 1.00 0.00 C ATOM 1470 ND1 HIS A 99 9.412 -3.312 -6.459 1.00 0.00 N ATOM 1471 CD2 HIS A 99 11.202 -2.983 -7.665 1.00 0.00 C ATOM 1472 CE1 HIS A 99 9.068 -2.523 -7.461 1.00 0.00 C ATOM 1473 NE2 HIS A 99 10.136 -2.308 -8.208 1.00 0.00 N ATOM 0 H HIS A 99 9.980 -4.725 -3.510 1.00 0.00 H new ATOM 0 HA HIS A 99 10.151 -6.125 -6.078 1.00 0.00 H new ATOM 0 HB2 HIS A 99 11.675 -3.926 -4.676 1.00 0.00 H new ATOM 0 HB3 HIS A 99 12.425 -4.797 -5.999 1.00 0.00 H new ATOM 0 HD2 HIS A 99 12.211 -3.001 -8.049 1.00 0.00 H new ATOM 0 HE1 HIS A 99 8.081 -2.122 -7.639 1.00 0.00 H new ATOM 0 HE2 HIS A 99 10.164 -1.734 -9.051 1.00 0.00 H new ATOM 1482 N THR A 100 11.959 -7.776 -5.603 1.00 0.00 N ATOM 1483 CA THR A 100 12.861 -8.870 -5.266 1.00 0.00 C ATOM 1484 C THR A 100 14.210 -8.701 -5.954 1.00 0.00 C ATOM 1485 O THR A 100 14.293 -8.156 -7.055 1.00 0.00 O ATOM 1486 CB THR A 100 12.263 -10.233 -5.661 1.00 0.00 C ATOM 1487 OG1 THR A 100 11.440 -10.088 -6.824 1.00 0.00 O ATOM 1488 CG2 THR A 100 11.441 -10.814 -4.521 1.00 0.00 C ATOM 0 H THR A 100 11.611 -7.796 -6.562 1.00 0.00 H new ATOM 0 HA THR A 100 13.001 -8.843 -4.185 1.00 0.00 H new ATOM 0 HB THR A 100 13.084 -10.916 -5.880 1.00 0.00 H new ATOM 0 HG1 THR A 100 11.877 -9.485 -7.461 1.00 0.00 H new ATOM 0 HG21 THR A 100 11.029 -11.777 -4.823 1.00 0.00 H new ATOM 0 HG22 THR A 100 12.077 -10.950 -3.646 1.00 0.00 H new ATOM 0 HG23 THR A 100 10.627 -10.132 -4.275 1.00 0.00 H new ATOM 1496 N ASP A 101 15.266 -9.172 -5.300 1.00 0.00 N ATOM 1497 CA ASP A 101 16.613 -9.075 -5.850 1.00 0.00 C ATOM 1498 C ASP A 101 16.643 -9.548 -7.300 1.00 0.00 C ATOM 1499 O ASP A 101 17.487 -9.119 -8.087 1.00 0.00 O ATOM 1500 CB ASP A 101 17.591 -9.899 -5.011 1.00 0.00 C ATOM 1501 CG ASP A 101 18.933 -10.076 -5.694 1.00 0.00 C ATOM 1502 OD1 ASP A 101 18.954 -10.577 -6.837 1.00 0.00 O ATOM 1503 OD2 ASP A 101 19.961 -9.716 -5.084 1.00 0.00 O ATOM 0 H ASP A 101 15.215 -9.625 -4.388 1.00 0.00 H new ATOM 0 HA ASP A 101 16.916 -8.028 -5.822 1.00 0.00 H new ATOM 0 HB2 ASP A 101 17.739 -9.412 -4.047 1.00 0.00 H new ATOM 0 HB3 ASP A 101 17.157 -10.878 -4.810 1.00 0.00 H new ATOM 1508 N VAL A 102 15.717 -10.437 -7.646 1.00 0.00 N ATOM 1509 CA VAL A 102 15.638 -10.969 -9.001 1.00 0.00 C ATOM 1510 C VAL A 102 14.913 -10.002 -9.930 1.00 0.00 C ATOM 1511 O VAL A 102 15.264 -9.869 -11.102 1.00 0.00 O ATOM 1512 CB VAL A 102 14.914 -12.329 -9.029 1.00 0.00 C ATOM 1513 CG1 VAL A 102 15.700 -13.368 -8.243 1.00 0.00 C ATOM 1514 CG2 VAL A 102 13.502 -12.191 -8.481 1.00 0.00 C ATOM 0 H VAL A 102 15.012 -10.804 -7.007 1.00 0.00 H new ATOM 0 HA VAL A 102 16.663 -11.103 -9.348 1.00 0.00 H new ATOM 0 HB VAL A 102 14.847 -12.665 -10.064 1.00 0.00 H new ATOM 0 HG11 VAL A 102 15.174 -14.322 -8.274 1.00 0.00 H new ATOM 0 HG12 VAL A 102 16.690 -13.485 -8.684 1.00 0.00 H new ATOM 0 HG13 VAL A 102 15.800 -13.042 -7.208 1.00 0.00 H new ATOM 0 HG21 VAL A 102 13.005 -13.161 -8.508 1.00 0.00 H new ATOM 0 HG22 VAL A 102 13.544 -11.833 -7.452 1.00 0.00 H new ATOM 0 HG23 VAL A 102 12.943 -11.480 -9.090 1.00 0.00 H new ATOM 1524 N GLY A 103 13.898 -9.327 -9.398 1.00 0.00 N ATOM 1525 CA GLY A 103 13.139 -8.380 -10.194 1.00 0.00 C ATOM 1526 C GLY A 103 12.043 -7.700 -9.397 1.00 0.00 C ATOM 1527 O GLY A 103 11.703 -8.117 -8.289 1.00 0.00 O ATOM 0 H GLY A 103 13.588 -9.419 -8.431 1.00 0.00 H new ATOM 0 HA2 GLY A 103 13.814 -7.624 -10.596 1.00 0.00 H new ATOM 0 HA3 GLY A 103 12.697 -8.898 -11.045 1.00 0.00 H new ATOM 1531 N PRO A 104 11.472 -6.627 -9.963 1.00 0.00 N ATOM 1532 CA PRO A 104 10.401 -5.865 -9.315 1.00 0.00 C ATOM 1533 C PRO A 104 9.093 -6.647 -9.247 1.00 0.00 C ATOM 1534 O PRO A 104 9.003 -7.769 -9.744 1.00 0.00 O ATOM 1535 CB PRO A 104 10.244 -4.637 -10.216 1.00 0.00 C ATOM 1536 CG PRO A 104 10.732 -5.082 -11.551 1.00 0.00 C ATOM 1537 CD PRO A 104 11.829 -6.075 -11.281 1.00 0.00 C ATOM 0 HA PRO A 104 10.642 -5.623 -8.280 1.00 0.00 H new ATOM 0 HB2 PRO A 104 9.205 -4.311 -10.263 1.00 0.00 H new ATOM 0 HB3 PRO A 104 10.826 -3.795 -9.842 1.00 0.00 H new ATOM 0 HG2 PRO A 104 9.927 -5.537 -12.129 1.00 0.00 H new ATOM 0 HG3 PRO A 104 11.104 -4.238 -12.132 1.00 0.00 H new ATOM 0 HD2 PRO A 104 11.866 -6.851 -12.045 1.00 0.00 H new ATOM 0 HD3 PRO A 104 12.809 -5.597 -11.265 1.00 0.00 H new ATOM 1545 N GLY A 105 8.082 -6.046 -8.628 1.00 0.00 N ATOM 1546 CA GLY A 105 6.792 -6.701 -8.507 1.00 0.00 C ATOM 1547 C GLY A 105 5.637 -5.765 -8.801 1.00 0.00 C ATOM 1548 O GLY A 105 5.787 -4.543 -8.811 1.00 0.00 O ATOM 0 H GLY A 105 8.133 -5.118 -8.208 1.00 0.00 H new ATOM 0 HA2 GLY A 105 6.752 -7.548 -9.192 1.00 0.00 H new ATOM 0 HA3 GLY A 105 6.684 -7.101 -7.499 1.00 0.00 H new ATOM 1552 N PRO A 106 4.451 -6.341 -9.049 1.00 0.00 N ATOM 1553 CA PRO A 106 3.243 -5.568 -9.350 1.00 0.00 C ATOM 1554 C PRO A 106 2.727 -4.803 -8.137 1.00 0.00 C ATOM 1555 O PRO A 106 3.185 -5.018 -7.015 1.00 0.00 O ATOM 1556 CB PRO A 106 2.234 -6.638 -9.776 1.00 0.00 C ATOM 1557 CG PRO A 106 2.700 -7.885 -9.106 1.00 0.00 C ATOM 1558 CD PRO A 106 4.199 -7.792 -9.054 1.00 0.00 C ATOM 0 HA PRO A 106 3.425 -4.807 -10.109 1.00 0.00 H new ATOM 0 HB2 PRO A 106 1.223 -6.375 -9.465 1.00 0.00 H new ATOM 0 HB3 PRO A 106 2.214 -6.754 -10.860 1.00 0.00 H new ATOM 0 HG2 PRO A 106 2.279 -7.970 -8.104 1.00 0.00 H new ATOM 0 HG3 PRO A 106 2.383 -8.768 -9.661 1.00 0.00 H new ATOM 0 HD2 PRO A 106 4.601 -8.273 -8.162 1.00 0.00 H new ATOM 0 HD3 PRO A 106 4.662 -8.277 -9.913 1.00 0.00 H new ATOM 1566 N GLU A 107 1.770 -3.909 -8.369 1.00 0.00 N ATOM 1567 CA GLU A 107 1.193 -3.112 -7.294 1.00 0.00 C ATOM 1568 C GLU A 107 0.177 -3.926 -6.497 1.00 0.00 C ATOM 1569 O GLU A 107 -0.199 -5.029 -6.895 1.00 0.00 O ATOM 1570 CB GLU A 107 0.525 -1.857 -7.861 1.00 0.00 C ATOM 1571 CG GLU A 107 -0.678 -2.153 -8.741 1.00 0.00 C ATOM 1572 CD GLU A 107 -1.382 -0.894 -9.209 1.00 0.00 C ATOM 1573 OE1 GLU A 107 -0.712 -0.023 -9.800 1.00 0.00 O ATOM 1574 OE2 GLU A 107 -2.606 -0.782 -8.983 1.00 0.00 O ATOM 0 H GLU A 107 1.379 -3.719 -9.292 1.00 0.00 H new ATOM 0 HA GLU A 107 2.000 -2.815 -6.624 1.00 0.00 H new ATOM 0 HB2 GLU A 107 0.212 -1.218 -7.036 1.00 0.00 H new ATOM 0 HB3 GLU A 107 1.258 -1.295 -8.439 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -0.356 -2.729 -9.609 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -1.383 -2.775 -8.189 1.00 0.00 H new ATOM 1581 N SER A 108 -0.262 -3.375 -5.371 1.00 0.00 N ATOM 1582 CA SER A 108 -1.230 -4.051 -4.515 1.00 0.00 C ATOM 1583 C SER A 108 -2.575 -3.329 -4.540 1.00 0.00 C ATOM 1584 O SER A 108 -2.730 -2.306 -5.207 1.00 0.00 O ATOM 1585 CB SER A 108 -0.708 -4.129 -3.080 1.00 0.00 C ATOM 1586 OG SER A 108 -0.724 -2.854 -2.461 1.00 0.00 O ATOM 0 H SER A 108 0.037 -2.462 -5.029 1.00 0.00 H new ATOM 0 HA SER A 108 -1.372 -5.062 -4.898 1.00 0.00 H new ATOM 0 HB2 SER A 108 -1.320 -4.824 -2.505 1.00 0.00 H new ATOM 0 HB3 SER A 108 0.308 -4.524 -3.080 1.00 0.00 H new ATOM 0 HG SER A 108 0.168 -2.453 -2.516 1.00 0.00 H new ATOM 1592 N SER A 109 -3.544 -3.871 -3.810 1.00 0.00 N ATOM 1593 CA SER A 109 -4.876 -3.282 -3.750 1.00 0.00 C ATOM 1594 C SER A 109 -4.815 -1.852 -3.223 1.00 0.00 C ATOM 1595 O SER A 109 -4.396 -1.596 -2.094 1.00 0.00 O ATOM 1596 CB SER A 109 -5.791 -4.127 -2.861 1.00 0.00 C ATOM 1597 OG SER A 109 -7.037 -3.485 -2.655 1.00 0.00 O ATOM 0 H SER A 109 -3.432 -4.717 -3.252 1.00 0.00 H new ATOM 0 HA SER A 109 -5.282 -3.261 -4.761 1.00 0.00 H new ATOM 0 HB2 SER A 109 -5.952 -5.101 -3.322 1.00 0.00 H new ATOM 0 HB3 SER A 109 -5.307 -4.305 -1.901 1.00 0.00 H new ATOM 0 HG SER A 109 -7.604 -4.046 -2.085 1.00 0.00 H new ATOM 1603 N PRO A 110 -5.244 -0.895 -4.060 1.00 0.00 N ATOM 1604 CA PRO A 110 -5.249 0.526 -3.701 1.00 0.00 C ATOM 1605 C PRO A 110 -6.292 0.852 -2.638 1.00 0.00 C ATOM 1606 O PRO A 110 -7.479 0.574 -2.812 1.00 0.00 O ATOM 1607 CB PRO A 110 -5.594 1.223 -5.020 1.00 0.00 C ATOM 1608 CG PRO A 110 -6.346 0.202 -5.803 1.00 0.00 C ATOM 1609 CD PRO A 110 -5.758 -1.128 -5.420 1.00 0.00 C ATOM 0 HA PRO A 110 -4.298 0.841 -3.272 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -6.197 2.115 -4.850 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -4.694 1.542 -5.546 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -7.411 0.239 -5.572 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -6.246 0.379 -6.874 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -6.508 -1.919 -5.436 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -4.964 -1.428 -6.104 1.00 0.00 H new ATOM 1617 N VAL A 111 -5.842 1.443 -1.535 1.00 0.00 N ATOM 1618 CA VAL A 111 -6.737 1.808 -0.444 1.00 0.00 C ATOM 1619 C VAL A 111 -7.061 3.297 -0.474 1.00 0.00 C ATOM 1620 O VAL A 111 -6.162 4.139 -0.495 1.00 0.00 O ATOM 1621 CB VAL A 111 -6.126 1.454 0.925 1.00 0.00 C ATOM 1622 CG1 VAL A 111 -7.070 1.851 2.050 1.00 0.00 C ATOM 1623 CG2 VAL A 111 -5.796 -0.029 0.993 1.00 0.00 C ATOM 0 H VAL A 111 -4.863 1.679 -1.374 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.655 1.237 -0.583 1.00 0.00 H new ATOM 0 HB VAL A 111 -5.199 2.015 1.046 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -6.621 1.593 3.009 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -7.251 2.925 2.011 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -8.015 1.319 1.937 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -5.365 -0.262 1.967 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -6.706 -0.611 0.850 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.079 -0.279 0.210 1.00 0.00 H new ATOM 1633 N LEU A 112 -8.350 3.617 -0.474 1.00 0.00 N ATOM 1634 CA LEU A 112 -8.795 5.006 -0.501 1.00 0.00 C ATOM 1635 C LEU A 112 -8.775 5.611 0.899 1.00 0.00 C ATOM 1636 O LEU A 112 -9.512 5.177 1.785 1.00 0.00 O ATOM 1637 CB LEU A 112 -10.203 5.101 -1.090 1.00 0.00 C ATOM 1638 CG LEU A 112 -10.401 4.456 -2.462 1.00 0.00 C ATOM 1639 CD1 LEU A 112 -11.848 4.591 -2.912 1.00 0.00 C ATOM 1640 CD2 LEU A 112 -9.462 5.079 -3.485 1.00 0.00 C ATOM 0 H LEU A 112 -9.106 2.933 -0.456 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.107 5.570 -1.131 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -10.900 4.640 -0.390 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.474 6.154 -1.163 1.00 0.00 H new ATOM 0 HG LEU A 112 -10.165 3.395 -2.381 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -11.970 4.126 -3.890 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -12.501 4.097 -2.192 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -12.112 5.647 -2.976 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -9.617 4.608 -4.456 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.666 6.147 -3.563 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.429 4.929 -3.170 1.00 0.00 H new ATOM 1652 N VAL A 113 -7.928 6.617 1.092 1.00 0.00 N ATOM 1653 CA VAL A 113 -7.815 7.284 2.384 1.00 0.00 C ATOM 1654 C VAL A 113 -8.028 8.787 2.246 1.00 0.00 C ATOM 1655 O VAL A 113 -7.417 9.436 1.396 1.00 0.00 O ATOM 1656 CB VAL A 113 -6.440 7.028 3.029 1.00 0.00 C ATOM 1657 CG1 VAL A 113 -6.256 5.548 3.326 1.00 0.00 C ATOM 1658 CG2 VAL A 113 -5.326 7.542 2.129 1.00 0.00 C ATOM 0 H VAL A 113 -7.310 6.988 0.370 1.00 0.00 H new ATOM 0 HA VAL A 113 -8.592 6.867 3.025 1.00 0.00 H new ATOM 0 HB VAL A 113 -6.394 7.571 3.973 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -5.279 5.387 3.781 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -7.035 5.215 4.012 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -6.322 4.980 2.398 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -4.361 7.353 2.600 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -5.368 7.028 1.169 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -5.450 8.614 1.973 1.00 0.00 H new ATOM 1668 N ARG A 114 -8.897 9.336 3.089 1.00 0.00 N ATOM 1669 CA ARG A 114 -9.191 10.763 3.061 1.00 0.00 C ATOM 1670 C ARG A 114 -8.423 11.498 4.155 1.00 0.00 C ATOM 1671 O ARG A 114 -8.683 11.313 5.344 1.00 0.00 O ATOM 1672 CB ARG A 114 -10.693 11.000 3.231 1.00 0.00 C ATOM 1673 CG ARG A 114 -11.071 12.468 3.331 1.00 0.00 C ATOM 1674 CD ARG A 114 -12.445 12.649 3.958 1.00 0.00 C ATOM 1675 NE ARG A 114 -13.516 12.537 2.971 1.00 0.00 N ATOM 1676 CZ ARG A 114 -14.045 11.380 2.590 1.00 0.00 C ATOM 1677 NH1 ARG A 114 -13.606 10.242 3.110 1.00 0.00 N ATOM 1678 NH2 ARG A 114 -15.017 11.359 1.687 1.00 0.00 N ATOM 0 H ARG A 114 -9.409 8.814 3.800 1.00 0.00 H new ATOM 0 HA ARG A 114 -8.875 11.154 2.094 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -11.220 10.555 2.387 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -11.034 10.484 4.128 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -10.326 12.997 3.926 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -11.062 12.916 2.337 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -12.590 11.900 4.737 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -12.497 13.625 4.441 1.00 0.00 H new ATOM 0 HE ARG A 114 -13.877 13.394 2.552 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -12.860 10.253 3.805 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -14.015 9.355 2.815 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -15.358 12.232 1.285 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -15.423 10.470 1.395 1.00 0.00 H new ATOM 1692 N THR A 115 -7.472 12.333 3.745 1.00 0.00 N ATOM 1693 CA THR A 115 -6.664 13.094 4.689 1.00 0.00 C ATOM 1694 C THR A 115 -7.527 14.050 5.506 1.00 0.00 C ATOM 1695 O THR A 115 -8.558 14.528 5.033 1.00 0.00 O ATOM 1696 CB THR A 115 -5.568 13.900 3.968 1.00 0.00 C ATOM 1697 OG1 THR A 115 -6.143 14.666 2.903 1.00 0.00 O ATOM 1698 CG2 THR A 115 -4.494 12.976 3.412 1.00 0.00 C ATOM 0 H THR A 115 -7.243 12.499 2.765 1.00 0.00 H new ATOM 0 HA THR A 115 -6.194 12.372 5.357 1.00 0.00 H new ATOM 0 HB THR A 115 -5.108 14.573 4.691 1.00 0.00 H new ATOM 0 HG1 THR A 115 -5.441 15.185 2.457 1.00 0.00 H new ATOM 0 HG21 THR A 115 -3.731 13.568 2.907 1.00 0.00 H new ATOM 0 HG22 THR A 115 -4.038 12.416 4.228 1.00 0.00 H new ATOM 0 HG23 THR A 115 -4.943 12.282 2.702 1.00 0.00 H new ATOM 1706 N ASP A 116 -7.099 14.323 6.733 1.00 0.00 N ATOM 1707 CA ASP A 116 -7.832 15.224 7.615 1.00 0.00 C ATOM 1708 C ASP A 116 -8.064 16.573 6.943 1.00 0.00 C ATOM 1709 O ASP A 116 -7.360 16.937 6.002 1.00 0.00 O ATOM 1710 CB ASP A 116 -7.071 15.418 8.928 1.00 0.00 C ATOM 1711 CG ASP A 116 -7.030 14.156 9.766 1.00 0.00 C ATOM 1712 OD1 ASP A 116 -8.106 13.567 10.005 1.00 0.00 O ATOM 1713 OD2 ASP A 116 -5.923 13.755 10.182 1.00 0.00 O ATOM 0 H ASP A 116 -6.249 13.934 7.140 1.00 0.00 H new ATOM 0 HA ASP A 116 -8.801 14.774 7.829 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -6.052 15.739 8.710 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -7.541 16.217 9.502 1.00 0.00 H new ATOM 1718 N GLU A 117 -9.057 17.309 7.433 1.00 0.00 N ATOM 1719 CA GLU A 117 -9.383 18.618 6.877 1.00 0.00 C ATOM 1720 C GLU A 117 -8.426 19.685 7.401 1.00 0.00 C ATOM 1721 O GLU A 117 -7.874 19.556 8.494 1.00 0.00 O ATOM 1722 CB GLU A 117 -10.825 18.998 7.221 1.00 0.00 C ATOM 1723 CG GLU A 117 -11.485 19.886 6.179 1.00 0.00 C ATOM 1724 CD GLU A 117 -12.699 20.615 6.720 1.00 0.00 C ATOM 1725 OE1 GLU A 117 -12.605 21.183 7.829 1.00 0.00 O ATOM 1726 OE2 GLU A 117 -13.744 20.619 6.036 1.00 0.00 O ATOM 0 H GLU A 117 -9.649 17.022 8.213 1.00 0.00 H new ATOM 0 HA GLU A 117 -9.278 18.561 5.794 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -11.414 18.088 7.337 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -10.837 19.510 8.183 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -10.760 20.615 5.816 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -11.782 19.278 5.324 1.00 0.00 H new ATOM 1733 N ASP A 118 -8.234 20.737 6.613 1.00 0.00 N ATOM 1734 CA ASP A 118 -7.345 21.827 6.996 1.00 0.00 C ATOM 1735 C ASP A 118 -7.385 22.057 8.503 1.00 0.00 C ATOM 1736 O ASP A 118 -6.352 22.278 9.136 1.00 0.00 O ATOM 1737 CB ASP A 118 -7.731 23.111 6.261 1.00 0.00 C ATOM 1738 CG ASP A 118 -6.712 24.217 6.453 1.00 0.00 C ATOM 1739 OD1 ASP A 118 -5.555 24.041 6.016 1.00 0.00 O ATOM 1740 OD2 ASP A 118 -7.072 25.260 7.039 1.00 0.00 O ATOM 0 H ASP A 118 -8.682 20.858 5.705 1.00 0.00 H new ATOM 0 HA ASP A 118 -6.329 21.549 6.716 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -7.837 22.899 5.197 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -8.704 23.451 6.617 1.00 0.00 H new ATOM 1745 N VAL A 119 -8.584 22.005 9.073 1.00 0.00 N ATOM 1746 CA VAL A 119 -8.760 22.207 10.506 1.00 0.00 C ATOM 1747 C VAL A 119 -8.367 20.960 11.290 1.00 0.00 C ATOM 1748 O VAL A 119 -8.479 19.832 10.807 1.00 0.00 O ATOM 1749 CB VAL A 119 -10.215 22.577 10.847 1.00 0.00 C ATOM 1750 CG1 VAL A 119 -10.596 23.899 10.198 1.00 0.00 C ATOM 1751 CG2 VAL A 119 -11.162 21.468 10.413 1.00 0.00 C ATOM 0 H VAL A 119 -9.449 21.824 8.564 1.00 0.00 H new ATOM 0 HA VAL A 119 -8.107 23.032 10.791 1.00 0.00 H new ATOM 0 HB VAL A 119 -10.299 22.693 11.928 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -11.628 24.144 10.450 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -9.936 24.687 10.562 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -10.497 23.815 9.116 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -12.186 21.746 10.662 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -11.078 21.318 9.337 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -10.901 20.544 10.929 1.00 0.00 H new ATOM 1761 N PRO A 120 -7.896 21.163 12.529 1.00 0.00 N ATOM 1762 CA PRO A 120 -7.478 20.066 13.407 1.00 0.00 C ATOM 1763 C PRO A 120 -8.657 19.226 13.887 1.00 0.00 C ATOM 1764 O PRO A 120 -8.491 18.306 14.687 1.00 0.00 O ATOM 1765 CB PRO A 120 -6.820 20.786 14.586 1.00 0.00 C ATOM 1766 CG PRO A 120 -7.449 22.136 14.605 1.00 0.00 C ATOM 1767 CD PRO A 120 -7.736 22.479 13.169 1.00 0.00 C ATOM 0 HA PRO A 120 -6.818 19.364 12.896 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -6.995 20.255 15.522 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -5.740 20.854 14.455 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -8.365 22.132 15.196 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -6.782 22.871 15.056 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -8.637 23.085 13.073 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -6.921 23.047 12.721 1.00 0.00 H new ATOM 1775 N SER A 121 -9.848 19.549 13.393 1.00 0.00 N ATOM 1776 CA SER A 121 -11.056 18.826 13.774 1.00 0.00 C ATOM 1777 C SER A 121 -11.201 17.544 12.960 1.00 0.00 C ATOM 1778 O SER A 121 -10.408 17.274 12.059 1.00 0.00 O ATOM 1779 CB SER A 121 -12.288 19.711 13.578 1.00 0.00 C ATOM 1780 OG SER A 121 -12.510 20.535 14.709 1.00 0.00 O ATOM 0 H SER A 121 -10.002 20.307 12.728 1.00 0.00 H new ATOM 0 HA SER A 121 -10.974 18.559 14.828 1.00 0.00 H new ATOM 0 HB2 SER A 121 -12.156 20.332 12.692 1.00 0.00 H new ATOM 0 HB3 SER A 121 -13.164 19.086 13.402 1.00 0.00 H new ATOM 0 HG SER A 121 -13.302 21.092 14.558 1.00 0.00 H new ATOM 1786 N GLY A 122 -12.222 16.757 13.286 1.00 0.00 N ATOM 1787 CA GLY A 122 -12.454 15.512 12.577 1.00 0.00 C ATOM 1788 C GLY A 122 -13.920 15.130 12.541 1.00 0.00 C ATOM 1789 O GLY A 122 -14.694 15.627 11.722 1.00 0.00 O ATOM 0 H GLY A 122 -12.892 16.959 14.028 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -12.080 15.603 11.557 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -11.885 14.714 13.055 1.00 0.00 H new ATOM 1793 N PRO A 123 -14.322 14.224 13.446 1.00 0.00 N ATOM 1794 CA PRO A 123 -15.708 13.755 13.534 1.00 0.00 C ATOM 1795 C PRO A 123 -16.654 14.834 14.049 1.00 0.00 C ATOM 1796 O PRO A 123 -16.608 15.229 15.214 1.00 0.00 O ATOM 1797 CB PRO A 123 -15.627 12.595 14.530 1.00 0.00 C ATOM 1798 CG PRO A 123 -14.429 12.894 15.363 1.00 0.00 C ATOM 1799 CD PRO A 123 -13.455 13.590 14.452 1.00 0.00 C ATOM 0 HA PRO A 123 -16.105 13.471 12.559 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -16.528 12.533 15.140 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -15.524 11.639 14.017 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -14.691 13.527 16.211 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -13.998 11.979 15.769 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -12.858 14.327 14.990 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -12.758 12.887 13.996 1.00 0.00 H new ATOM 1807 N PRO A 124 -17.534 15.323 13.162 1.00 0.00 N ATOM 1808 CA PRO A 124 -18.508 16.363 13.505 1.00 0.00 C ATOM 1809 C PRO A 124 -19.593 15.853 14.447 1.00 0.00 C ATOM 1810 O PRO A 124 -19.924 14.667 14.443 1.00 0.00 O ATOM 1811 CB PRO A 124 -19.112 16.744 12.151 1.00 0.00 C ATOM 1812 CG PRO A 124 -18.929 15.535 11.301 1.00 0.00 C ATOM 1813 CD PRO A 124 -17.645 14.899 11.757 1.00 0.00 C ATOM 0 HA PRO A 124 -18.044 17.198 14.031 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -20.166 17.005 12.247 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -18.607 17.610 11.722 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -19.767 14.847 11.415 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -18.878 15.804 10.246 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -17.680 13.813 11.667 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -16.795 15.241 11.166 1.00 0.00 H new ATOM 1821 N ARG A 125 -20.144 16.755 15.253 1.00 0.00 N ATOM 1822 CA ARG A 125 -21.191 16.395 16.201 1.00 0.00 C ATOM 1823 C ARG A 125 -22.374 15.750 15.485 1.00 0.00 C ATOM 1824 O ARG A 125 -23.291 16.437 15.033 1.00 0.00 O ATOM 1825 CB ARG A 125 -21.659 17.632 16.970 1.00 0.00 C ATOM 1826 CG ARG A 125 -22.449 17.304 18.227 1.00 0.00 C ATOM 1827 CD ARG A 125 -23.937 17.186 17.936 1.00 0.00 C ATOM 1828 NE ARG A 125 -24.692 16.756 19.109 1.00 0.00 N ATOM 1829 CZ ARG A 125 -25.062 17.576 20.087 1.00 0.00 C ATOM 1830 NH1 ARG A 125 -24.748 18.863 20.031 1.00 0.00 N ATOM 1831 NH2 ARG A 125 -25.747 17.108 21.122 1.00 0.00 N ATOM 0 H ARG A 125 -19.882 17.741 15.268 1.00 0.00 H new ATOM 0 HA ARG A 125 -20.777 15.673 16.905 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -20.790 18.230 17.243 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -22.275 18.246 16.313 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -22.085 16.369 18.653 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -22.284 18.080 18.974 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -24.317 18.149 17.594 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -24.092 16.475 17.124 1.00 0.00 H new ATOM 0 HE ARG A 125 -24.950 15.772 19.182 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -24.221 19.225 19.236 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -25.033 19.491 20.783 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -25.990 16.118 21.167 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -26.031 17.738 21.873 1.00 0.00 H new ATOM 1845 N LYS A 126 -22.347 14.425 15.384 1.00 0.00 N ATOM 1846 CA LYS A 126 -23.417 13.686 14.724 1.00 0.00 C ATOM 1847 C LYS A 126 -24.730 13.832 15.486 1.00 0.00 C ATOM 1848 O LYS A 126 -24.759 13.752 16.714 1.00 0.00 O ATOM 1849 CB LYS A 126 -23.045 12.206 14.607 1.00 0.00 C ATOM 1850 CG LYS A 126 -22.278 11.870 13.340 1.00 0.00 C ATOM 1851 CD LYS A 126 -22.005 10.379 13.232 1.00 0.00 C ATOM 1852 CE LYS A 126 -21.336 10.029 11.912 1.00 0.00 C ATOM 1853 NZ LYS A 126 -19.862 10.239 11.964 1.00 0.00 N ATOM 0 H LYS A 126 -21.596 13.841 15.751 1.00 0.00 H new ATOM 0 HA LYS A 126 -23.549 14.102 13.725 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -22.445 11.921 15.471 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -23.955 11.607 14.640 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -22.847 12.201 12.471 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -21.334 12.415 13.330 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -21.368 10.064 14.059 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -22.942 9.829 13.323 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -21.546 8.989 11.663 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -21.762 10.640 11.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -19.443 9.989 11.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -19.661 11.237 12.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -19.452 9.637 12.707 1.00 0.00 H new ATOM 1867 N VAL A 127 -25.816 14.046 14.749 1.00 0.00 N ATOM 1868 CA VAL A 127 -27.133 14.200 15.356 1.00 0.00 C ATOM 1869 C VAL A 127 -28.210 13.531 14.509 1.00 0.00 C ATOM 1870 O VAL A 127 -28.326 13.796 13.313 1.00 0.00 O ATOM 1871 CB VAL A 127 -27.493 15.686 15.544 1.00 0.00 C ATOM 1872 CG1 VAL A 127 -27.438 16.422 14.214 1.00 0.00 C ATOM 1873 CG2 VAL A 127 -28.867 15.824 16.183 1.00 0.00 C ATOM 0 H VAL A 127 -25.810 14.117 13.731 1.00 0.00 H new ATOM 0 HA VAL A 127 -27.091 13.717 16.332 1.00 0.00 H new ATOM 0 HB VAL A 127 -26.760 16.138 16.212 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -27.695 17.470 14.367 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -26.432 16.352 13.801 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -28.147 15.972 13.520 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -29.105 16.880 16.309 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -29.615 15.357 15.542 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -28.866 15.334 17.157 1.00 0.00 H new ATOM 1883 N GLU A 128 -28.995 12.663 15.139 1.00 0.00 N ATOM 1884 CA GLU A 128 -30.063 11.955 14.442 1.00 0.00 C ATOM 1885 C GLU A 128 -29.661 11.643 13.004 1.00 0.00 C ATOM 1886 O GLU A 128 -30.472 11.748 12.084 1.00 0.00 O ATOM 1887 CB GLU A 128 -31.348 12.786 14.455 1.00 0.00 C ATOM 1888 CG GLU A 128 -31.246 14.078 13.663 1.00 0.00 C ATOM 1889 CD GLU A 128 -32.598 14.717 13.412 1.00 0.00 C ATOM 1890 OE1 GLU A 128 -33.340 14.937 14.392 1.00 0.00 O ATOM 1891 OE2 GLU A 128 -32.913 14.997 12.237 1.00 0.00 O ATOM 0 H GLU A 128 -28.912 12.433 16.129 1.00 0.00 H new ATOM 0 HA GLU A 128 -30.241 11.014 14.963 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -32.163 12.185 14.051 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -31.607 13.022 15.487 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -30.611 14.781 14.202 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -30.760 13.877 12.708 1.00 0.00 H new ATOM 1898 N SER A 129 -28.402 11.259 12.818 1.00 0.00 N ATOM 1899 CA SER A 129 -27.889 10.935 11.492 1.00 0.00 C ATOM 1900 C SER A 129 -26.466 10.391 11.577 1.00 0.00 C ATOM 1901 O SER A 129 -25.902 10.265 12.663 1.00 0.00 O ATOM 1902 CB SER A 129 -27.922 12.173 10.593 1.00 0.00 C ATOM 1903 OG SER A 129 -28.099 11.812 9.234 1.00 0.00 O ATOM 0 H SER A 129 -27.718 11.165 13.569 1.00 0.00 H new ATOM 0 HA SER A 129 -28.528 10.164 11.061 1.00 0.00 H new ATOM 0 HB2 SER A 129 -28.732 12.832 10.906 1.00 0.00 H new ATOM 0 HB3 SER A 129 -26.994 12.733 10.706 1.00 0.00 H new ATOM 0 HG SER A 129 -28.325 12.609 8.711 1.00 0.00 H new ATOM 1909 N GLY A 130 -25.892 10.070 10.421 1.00 0.00 N ATOM 1910 CA GLY A 130 -24.540 9.544 10.386 1.00 0.00 C ATOM 1911 C GLY A 130 -23.914 9.646 9.010 1.00 0.00 C ATOM 1912 O GLY A 130 -23.160 10.573 8.714 1.00 0.00 O ATOM 0 H GLY A 130 -26.339 10.165 9.509 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -23.924 10.086 11.103 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -24.551 8.500 10.700 1.00 0.00 H new ATOM 1916 N PRO A 131 -24.225 8.673 8.140 1.00 0.00 N ATOM 1917 CA PRO A 131 -23.697 8.634 6.773 1.00 0.00 C ATOM 1918 C PRO A 131 -24.277 9.739 5.896 1.00 0.00 C ATOM 1919 O PRO A 131 -23.967 9.828 4.708 1.00 0.00 O ATOM 1920 CB PRO A 131 -24.135 7.260 6.262 1.00 0.00 C ATOM 1921 CG PRO A 131 -25.341 6.922 7.070 1.00 0.00 C ATOM 1922 CD PRO A 131 -25.117 7.536 8.424 1.00 0.00 C ATOM 0 HA PRO A 131 -22.618 8.788 6.748 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -24.367 7.289 5.197 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -23.348 6.518 6.396 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -26.245 7.318 6.607 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -25.469 5.842 7.147 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -26.053 7.863 8.877 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -24.659 6.829 9.115 1.00 0.00 H new ATOM 1930 N SER A 132 -25.120 10.578 6.489 1.00 0.00 N ATOM 1931 CA SER A 132 -25.747 11.674 5.761 1.00 0.00 C ATOM 1932 C SER A 132 -24.766 12.300 4.773 1.00 0.00 C ATOM 1933 O SER A 132 -23.718 12.815 5.164 1.00 0.00 O ATOM 1934 CB SER A 132 -26.255 12.738 6.736 1.00 0.00 C ATOM 1935 OG SER A 132 -27.390 13.407 6.214 1.00 0.00 O ATOM 0 H SER A 132 -25.385 10.519 7.472 1.00 0.00 H new ATOM 0 HA SER A 132 -26.592 11.271 5.203 1.00 0.00 H new ATOM 0 HB2 SER A 132 -26.509 12.272 7.688 1.00 0.00 H new ATOM 0 HB3 SER A 132 -25.463 13.460 6.936 1.00 0.00 H new ATOM 0 HG SER A 132 -27.697 14.081 6.856 1.00 0.00 H new ATOM 1941 N SER A 133 -25.115 12.252 3.492 1.00 0.00 N ATOM 1942 CA SER A 133 -24.265 12.811 2.447 1.00 0.00 C ATOM 1943 C SER A 133 -25.106 13.365 1.301 1.00 0.00 C ATOM 1944 O SER A 133 -25.781 12.619 0.594 1.00 0.00 O ATOM 1945 CB SER A 133 -23.302 11.745 1.919 1.00 0.00 C ATOM 1946 OG SER A 133 -24.010 10.649 1.364 1.00 0.00 O ATOM 0 H SER A 133 -25.980 11.832 3.152 1.00 0.00 H new ATOM 0 HA SER A 133 -23.689 13.629 2.880 1.00 0.00 H new ATOM 0 HB2 SER A 133 -22.650 12.182 1.162 1.00 0.00 H new ATOM 0 HB3 SER A 133 -22.661 11.396 2.729 1.00 0.00 H new ATOM 0 HG SER A 133 -24.892 10.949 1.061 1.00 0.00 H new ATOM 1952 N GLY A 134 -25.059 14.682 1.124 1.00 0.00 N ATOM 1953 CA GLY A 134 -25.820 15.316 0.064 1.00 0.00 C ATOM 1954 C GLY A 134 -27.269 15.542 0.446 1.00 0.00 C ATOM 1955 O GLY A 134 -27.576 15.827 1.604 1.00 0.00 O ATOM 0 H GLY A 134 -24.507 15.321 1.696 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -25.360 16.272 -0.187 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -25.776 14.696 -0.831 1.00 0.00 H new TER 1959 GLY A 134