USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 794 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 10 THR OG1 : rot 180:sc= 0.491 USER MOD Set 1.2: A 12 ASN :FLIP amide:sc= -0.625 F(o=-4.6!,f=-0.13) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot -160:sc= 0 USER MOD Single : A 18 GLN :FLIP amide:sc= -1.56 F(o=-4.8!,f=-1.6) USER MOD Single : A 20 SER OG : rot -27:sc= 0.428! USER MOD Single : A 23 GLN : amide:sc= -2.46 K(o=-2.5,f=-4.2!) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot -17:sc= 0.714 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 CYS SG : rot 59:sc= 0.2 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot -58:sc= 0.339 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 CYS SG : rot 17:sc= 0.0817 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 158:sc= -0.974 (180deg=-1.87!) USER MOD Single : A 67 SER OG : rot 180:sc= -0.174 USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.786 USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 83 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0644) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.521 14.227 7.081 1.00 0.00 N ATOM 2 CA GLY A 1 -15.398 14.970 7.622 1.00 0.00 C ATOM 3 C GLY A 1 -14.229 14.076 7.982 1.00 0.00 C ATOM 4 O GLY A 1 -13.969 13.827 9.160 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.294 14.884 6.851 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.224 13.727 6.219 1.00 0.00 H new ATOM 0 H3 GLY A 1 -16.852 13.536 7.785 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.073 15.712 6.893 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -15.721 15.515 8.509 1.00 0.00 H new ATOM 8 N SER A 2 -13.524 13.588 6.966 1.00 0.00 N ATOM 9 CA SER A 2 -12.380 12.711 7.183 1.00 0.00 C ATOM 10 C SER A 2 -11.086 13.383 6.732 1.00 0.00 C ATOM 11 O SER A 2 -11.044 14.036 5.688 1.00 0.00 O ATOM 12 CB SER A 2 -12.572 11.393 6.429 1.00 0.00 C ATOM 13 OG SER A 2 -12.144 10.291 7.211 1.00 0.00 O ATOM 0 H SER A 2 -13.725 13.785 5.986 1.00 0.00 H new ATOM 0 HA SER A 2 -12.309 12.505 8.251 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.623 11.270 6.166 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.011 11.420 5.495 1.00 0.00 H new ATOM 0 HG SER A 2 -12.279 9.461 6.708 1.00 0.00 H new ATOM 19 N SER A 3 -10.034 13.220 7.526 1.00 0.00 N ATOM 20 CA SER A 3 -8.740 13.814 7.212 1.00 0.00 C ATOM 21 C SER A 3 -8.770 15.325 7.423 1.00 0.00 C ATOM 22 O SER A 3 -9.837 15.937 7.457 1.00 0.00 O ATOM 23 CB SER A 3 -8.345 13.497 5.769 1.00 0.00 C ATOM 24 OG SER A 3 -6.967 13.184 5.672 1.00 0.00 O ATOM 0 H SER A 3 -10.052 12.681 8.392 1.00 0.00 H new ATOM 0 HA SER A 3 -7.999 13.385 7.886 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.938 12.659 5.403 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.572 14.351 5.131 1.00 0.00 H new ATOM 0 HG SER A 3 -6.742 12.984 4.739 1.00 0.00 H new ATOM 30 N GLY A 4 -7.589 15.919 7.567 1.00 0.00 N ATOM 31 CA GLY A 4 -7.501 17.353 7.773 1.00 0.00 C ATOM 32 C GLY A 4 -6.249 17.951 7.165 1.00 0.00 C ATOM 33 O GLY A 4 -5.809 17.532 6.094 1.00 0.00 O ATOM 0 H GLY A 4 -6.692 15.433 7.545 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -8.377 17.834 7.338 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -7.519 17.565 8.842 1.00 0.00 H new ATOM 37 N SER A 5 -5.672 18.934 7.849 1.00 0.00 N ATOM 38 CA SER A 5 -4.465 19.596 7.367 1.00 0.00 C ATOM 39 C SER A 5 -3.685 20.214 8.523 1.00 0.00 C ATOM 40 O SER A 5 -4.158 21.143 9.178 1.00 0.00 O ATOM 41 CB SER A 5 -4.823 20.674 6.342 1.00 0.00 C ATOM 42 OG SER A 5 -3.860 20.730 5.304 1.00 0.00 O ATOM 0 H SER A 5 -6.021 19.290 8.739 1.00 0.00 H new ATOM 0 HA SER A 5 -3.836 18.846 6.888 1.00 0.00 H new ATOM 0 HB2 SER A 5 -5.806 20.466 5.920 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.887 21.643 6.836 1.00 0.00 H new ATOM 0 HG SER A 5 -4.112 21.425 4.661 1.00 0.00 H new ATOM 48 N SER A 6 -2.487 19.692 8.768 1.00 0.00 N ATOM 49 CA SER A 6 -1.644 20.190 9.847 1.00 0.00 C ATOM 50 C SER A 6 -0.318 19.435 9.892 1.00 0.00 C ATOM 51 O SER A 6 -0.198 18.337 9.352 1.00 0.00 O ATOM 52 CB SER A 6 -2.364 20.057 11.190 1.00 0.00 C ATOM 53 OG SER A 6 -1.952 21.068 12.093 1.00 0.00 O ATOM 0 H SER A 6 -2.079 18.925 8.234 1.00 0.00 H new ATOM 0 HA SER A 6 -1.438 21.243 9.657 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.441 20.120 11.036 1.00 0.00 H new ATOM 0 HB3 SER A 6 -2.160 19.076 11.620 1.00 0.00 H new ATOM 0 HG SER A 6 -2.428 20.961 12.943 1.00 0.00 H new ATOM 59 N GLY A 7 0.675 20.035 10.542 1.00 0.00 N ATOM 60 CA GLY A 7 1.979 19.406 10.646 1.00 0.00 C ATOM 61 C GLY A 7 3.110 20.416 10.656 1.00 0.00 C ATOM 62 O GLY A 7 2.924 21.570 10.271 1.00 0.00 O ATOM 0 H GLY A 7 0.600 20.944 10.998 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.020 18.810 11.558 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.116 18.720 9.810 1.00 0.00 H new ATOM 66 N ILE A 8 4.285 19.980 11.101 1.00 0.00 N ATOM 67 CA ILE A 8 5.449 20.856 11.160 1.00 0.00 C ATOM 68 C ILE A 8 6.392 20.598 9.990 1.00 0.00 C ATOM 69 O ILE A 8 6.931 19.499 9.843 1.00 0.00 O ATOM 70 CB ILE A 8 6.225 20.672 12.478 1.00 0.00 C ATOM 71 CG1 ILE A 8 5.295 20.144 13.573 1.00 0.00 C ATOM 72 CG2 ILE A 8 6.862 21.985 12.906 1.00 0.00 C ATOM 73 CD1 ILE A 8 6.007 19.825 14.868 1.00 0.00 C ATOM 0 H ILE A 8 4.455 19.028 11.425 1.00 0.00 H new ATOM 0 HA ILE A 8 5.077 21.879 11.105 1.00 0.00 H new ATOM 0 HB ILE A 8 7.018 19.942 12.316 1.00 0.00 H new ATOM 0 HG12 ILE A 8 4.519 20.884 13.767 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.795 19.245 13.212 1.00 0.00 H new ATOM 0 HG21 ILE A 8 7.407 21.838 13.839 1.00 0.00 H new ATOM 0 HG22 ILE A 8 7.551 22.324 12.133 1.00 0.00 H new ATOM 0 HG23 ILE A 8 6.085 22.735 13.054 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.287 19.456 15.598 1.00 0.00 H new ATOM 0 HD12 ILE A 8 6.765 19.062 14.688 1.00 0.00 H new ATOM 0 HD13 ILE A 8 6.484 20.726 15.253 1.00 0.00 H new ATOM 85 N LEU A 9 6.587 21.615 9.160 1.00 0.00 N ATOM 86 CA LEU A 9 7.466 21.500 8.001 1.00 0.00 C ATOM 87 C LEU A 9 7.409 22.762 7.146 1.00 0.00 C ATOM 88 O LEU A 9 6.781 23.753 7.521 1.00 0.00 O ATOM 89 CB LEU A 9 7.078 20.283 7.160 1.00 0.00 C ATOM 90 CG LEU A 9 5.588 19.939 7.125 1.00 0.00 C ATOM 91 CD1 LEU A 9 5.129 19.702 5.694 1.00 0.00 C ATOM 92 CD2 LEU A 9 5.303 18.718 7.987 1.00 0.00 C ATOM 0 H LEU A 9 6.148 22.530 9.267 1.00 0.00 H new ATOM 0 HA LEU A 9 8.487 21.374 8.362 1.00 0.00 H new ATOM 0 HB2 LEU A 9 7.416 20.450 6.137 1.00 0.00 H new ATOM 0 HB3 LEU A 9 7.622 19.417 7.538 1.00 0.00 H new ATOM 0 HG LEU A 9 5.030 20.783 7.529 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.067 19.458 5.688 1.00 0.00 H new ATOM 0 HD12 LEU A 9 5.298 20.603 5.104 1.00 0.00 H new ATOM 0 HD13 LEU A 9 5.693 18.875 5.263 1.00 0.00 H new ATOM 0 HD21 LEU A 9 4.238 18.487 7.951 1.00 0.00 H new ATOM 0 HD22 LEU A 9 5.872 17.867 7.612 1.00 0.00 H new ATOM 0 HD23 LEU A 9 5.595 18.924 9.017 1.00 0.00 H new ATOM 104 N THR A 10 8.066 22.718 5.991 1.00 0.00 N ATOM 105 CA THR A 10 8.089 23.856 5.081 1.00 0.00 C ATOM 106 C THR A 10 7.668 23.444 3.674 1.00 0.00 C ATOM 107 O THR A 10 6.503 23.578 3.302 1.00 0.00 O ATOM 108 CB THR A 10 9.487 24.498 5.018 1.00 0.00 C ATOM 109 OG1 THR A 10 10.465 23.511 4.671 1.00 0.00 O ATOM 110 CG2 THR A 10 9.852 25.132 6.353 1.00 0.00 C ATOM 0 H THR A 10 8.589 21.906 5.664 1.00 0.00 H new ATOM 0 HA THR A 10 7.380 24.586 5.471 1.00 0.00 H new ATOM 0 HB THR A 10 9.470 25.277 4.255 1.00 0.00 H new ATOM 0 HG1 THR A 10 11.351 23.928 4.631 1.00 0.00 H new ATOM 0 HG21 THR A 10 10.844 25.579 6.284 1.00 0.00 H new ATOM 0 HG22 THR A 10 9.123 25.903 6.601 1.00 0.00 H new ATOM 0 HG23 THR A 10 9.851 24.368 7.131 1.00 0.00 H new ATOM 118 N GLU A 11 8.624 22.943 2.898 1.00 0.00 N ATOM 119 CA GLU A 11 8.350 22.513 1.532 1.00 0.00 C ATOM 120 C GLU A 11 9.355 21.455 1.084 1.00 0.00 C ATOM 121 O GLU A 11 9.803 21.457 -0.062 1.00 0.00 O ATOM 122 CB GLU A 11 8.391 23.708 0.579 1.00 0.00 C ATOM 123 CG GLU A 11 9.558 24.649 0.832 1.00 0.00 C ATOM 124 CD GLU A 11 9.233 26.089 0.485 1.00 0.00 C ATOM 125 OE1 GLU A 11 8.217 26.606 0.994 1.00 0.00 O ATOM 126 OE2 GLU A 11 9.994 26.698 -0.295 1.00 0.00 O ATOM 0 H GLU A 11 9.594 22.825 3.192 1.00 0.00 H new ATOM 0 HA GLU A 11 7.352 22.075 1.509 1.00 0.00 H new ATOM 0 HB2 GLU A 11 8.446 23.342 -0.446 1.00 0.00 H new ATOM 0 HB3 GLU A 11 7.459 24.266 0.669 1.00 0.00 H new ATOM 0 HG2 GLU A 11 9.848 24.589 1.881 1.00 0.00 H new ATOM 0 HG3 GLU A 11 10.417 24.323 0.245 1.00 0.00 H new ATOM 133 N ASN A 12 9.705 20.555 1.997 1.00 0.00 N ATOM 134 CA ASN A 12 10.658 19.492 1.697 1.00 0.00 C ATOM 135 C ASN A 12 10.868 18.592 2.910 1.00 0.00 C ATOM 136 O ASN A 12 11.185 17.409 2.771 1.00 0.00 O ATOM 137 CB ASN A 12 11.996 20.089 1.252 1.00 0.00 C ATOM 138 CG ASN A 12 12.712 20.804 2.381 1.00 0.00 C ATOM 139 OD1 ASN A 12 11.948 21.471 3.239 1.00 0.00 O flip ATOM 140 ND2 ASN A 12 13.939 20.760 2.480 1.00 0.00 N flip ATOM 0 H ASN A 12 9.343 20.540 2.951 1.00 0.00 H new ATOM 0 HA ASN A 12 10.249 18.889 0.886 1.00 0.00 H new ATOM 0 HB2 ASN A 12 12.635 19.295 0.865 1.00 0.00 H new ATOM 0 HB3 ASN A 12 11.825 20.788 0.433 1.00 0.00 H new ATOM 0 HD21 ASN A 12 14.487 20.235 1.798 1.00 0.00 H new ATOM 0 HD22 ASN A 12 14.407 21.248 3.244 1.00 0.00 H new ATOM 147 N THR A 13 10.690 19.158 4.099 1.00 0.00 N ATOM 148 CA THR A 13 10.859 18.407 5.337 1.00 0.00 C ATOM 149 C THR A 13 10.416 16.959 5.166 1.00 0.00 C ATOM 150 O THR A 13 9.323 16.672 4.678 1.00 0.00 O ATOM 151 CB THR A 13 10.065 19.043 6.493 1.00 0.00 C ATOM 152 OG1 THR A 13 10.756 20.196 6.986 1.00 0.00 O ATOM 153 CG2 THR A 13 9.863 18.045 7.623 1.00 0.00 C ATOM 0 H THR A 13 10.429 20.135 4.231 1.00 0.00 H new ATOM 0 HA THR A 13 11.921 18.432 5.580 1.00 0.00 H new ATOM 0 HB THR A 13 9.088 19.341 6.113 1.00 0.00 H new ATOM 0 HG1 THR A 13 10.439 20.406 7.889 1.00 0.00 H new ATOM 0 HG21 THR A 13 9.300 18.516 8.428 1.00 0.00 H new ATOM 0 HG22 THR A 13 9.311 17.181 7.251 1.00 0.00 H new ATOM 0 HG23 THR A 13 10.833 17.721 8.000 1.00 0.00 H new ATOM 161 N PRO A 14 11.283 16.021 5.578 1.00 0.00 N ATOM 162 CA PRO A 14 11.001 14.586 5.482 1.00 0.00 C ATOM 163 C PRO A 14 9.909 14.143 6.451 1.00 0.00 C ATOM 164 O PRO A 14 9.582 14.855 7.400 1.00 0.00 O ATOM 165 CB PRO A 14 12.338 13.937 5.849 1.00 0.00 C ATOM 166 CG PRO A 14 13.030 14.948 6.696 1.00 0.00 C ATOM 167 CD PRO A 14 12.603 16.290 6.170 1.00 0.00 C ATOM 0 HA PRO A 14 10.633 14.308 4.494 1.00 0.00 H new ATOM 0 HB2 PRO A 14 12.189 13.003 6.390 1.00 0.00 H new ATOM 0 HB3 PRO A 14 12.921 13.701 4.959 1.00 0.00 H new ATOM 0 HG2 PRO A 14 12.754 14.834 7.744 1.00 0.00 H new ATOM 0 HG3 PRO A 14 14.112 14.832 6.637 1.00 0.00 H new ATOM 0 HD2 PRO A 14 12.543 17.033 6.966 1.00 0.00 H new ATOM 0 HD3 PRO A 14 13.305 16.673 5.429 1.00 0.00 H new ATOM 175 N VAL A 15 9.350 12.963 6.206 1.00 0.00 N ATOM 176 CA VAL A 15 8.296 12.424 7.059 1.00 0.00 C ATOM 177 C VAL A 15 8.385 10.905 7.147 1.00 0.00 C ATOM 178 O VAL A 15 8.865 10.244 6.226 1.00 0.00 O ATOM 179 CB VAL A 15 6.900 12.817 6.540 1.00 0.00 C ATOM 180 CG1 VAL A 15 5.904 12.882 7.688 1.00 0.00 C ATOM 181 CG2 VAL A 15 6.961 14.144 5.800 1.00 0.00 C ATOM 0 H VAL A 15 9.609 12.361 5.424 1.00 0.00 H new ATOM 0 HA VAL A 15 8.440 12.851 8.051 1.00 0.00 H new ATOM 0 HB VAL A 15 6.562 12.053 5.840 1.00 0.00 H new ATOM 0 HG11 VAL A 15 4.923 13.161 7.303 1.00 0.00 H new ATOM 0 HG12 VAL A 15 5.841 11.907 8.170 1.00 0.00 H new ATOM 0 HG13 VAL A 15 6.234 13.625 8.414 1.00 0.00 H new ATOM 0 HG21 VAL A 15 5.966 14.406 5.440 1.00 0.00 H new ATOM 0 HG22 VAL A 15 7.319 14.921 6.475 1.00 0.00 H new ATOM 0 HG23 VAL A 15 7.642 14.057 4.953 1.00 0.00 H new ATOM 191 N PHE A 16 7.917 10.355 8.264 1.00 0.00 N ATOM 192 CA PHE A 16 7.943 8.912 8.474 1.00 0.00 C ATOM 193 C PHE A 16 6.595 8.413 8.986 1.00 0.00 C ATOM 194 O PHE A 16 6.077 8.909 9.986 1.00 0.00 O ATOM 195 CB PHE A 16 9.048 8.540 9.465 1.00 0.00 C ATOM 196 CG PHE A 16 9.667 7.198 9.196 1.00 0.00 C ATOM 197 CD1 PHE A 16 9.147 6.052 9.776 1.00 0.00 C ATOM 198 CD2 PHE A 16 10.769 7.084 8.364 1.00 0.00 C ATOM 199 CE1 PHE A 16 9.716 4.816 9.531 1.00 0.00 C ATOM 200 CE2 PHE A 16 11.341 5.851 8.115 1.00 0.00 C ATOM 201 CZ PHE A 16 10.813 4.715 8.699 1.00 0.00 C ATOM 0 H PHE A 16 7.516 10.887 9.036 1.00 0.00 H new ATOM 0 HA PHE A 16 8.147 8.433 7.516 1.00 0.00 H new ATOM 0 HB2 PHE A 16 9.826 9.303 9.433 1.00 0.00 H new ATOM 0 HB3 PHE A 16 8.637 8.546 10.474 1.00 0.00 H new ATOM 0 HD1 PHE A 16 8.288 6.125 10.426 1.00 0.00 H new ATOM 0 HD2 PHE A 16 11.186 7.968 7.905 1.00 0.00 H new ATOM 0 HE1 PHE A 16 9.303 3.930 9.990 1.00 0.00 H new ATOM 0 HE2 PHE A 16 12.200 5.775 7.465 1.00 0.00 H new ATOM 0 HZ PHE A 16 11.258 3.750 8.505 1.00 0.00 H new ATOM 211 N GLU A 17 6.032 7.430 8.291 1.00 0.00 N ATOM 212 CA GLU A 17 4.744 6.864 8.675 1.00 0.00 C ATOM 213 C GLU A 17 4.737 5.350 8.486 1.00 0.00 C ATOM 214 O GLU A 17 5.347 4.828 7.553 1.00 0.00 O ATOM 215 CB GLU A 17 3.619 7.498 7.854 1.00 0.00 C ATOM 216 CG GLU A 17 2.386 7.841 8.672 1.00 0.00 C ATOM 217 CD GLU A 17 2.441 9.243 9.248 1.00 0.00 C ATOM 218 OE1 GLU A 17 2.015 10.187 8.553 1.00 0.00 O ATOM 219 OE2 GLU A 17 2.911 9.394 10.396 1.00 0.00 O ATOM 0 H GLU A 17 6.447 7.009 7.460 1.00 0.00 H new ATOM 0 HA GLU A 17 4.580 7.081 9.731 1.00 0.00 H new ATOM 0 HB2 GLU A 17 3.994 8.405 7.380 1.00 0.00 H new ATOM 0 HB3 GLU A 17 3.335 6.814 7.054 1.00 0.00 H new ATOM 0 HG2 GLU A 17 1.500 7.744 8.045 1.00 0.00 H new ATOM 0 HG3 GLU A 17 2.282 7.122 9.485 1.00 0.00 H new ATOM 226 N GLN A 18 4.041 4.651 9.378 1.00 0.00 N ATOM 227 CA GLN A 18 3.955 3.197 9.310 1.00 0.00 C ATOM 228 C GLN A 18 2.522 2.749 9.040 1.00 0.00 C ATOM 229 O GLN A 18 1.574 3.293 9.605 1.00 0.00 O ATOM 230 CB GLN A 18 4.460 2.574 10.613 1.00 0.00 C ATOM 231 CG GLN A 18 5.893 2.072 10.531 1.00 0.00 C ATOM 232 CD GLN A 18 6.137 0.860 11.409 1.00 0.00 C ATOM 233 OE1 GLN A 18 6.570 -0.237 10.798 1.00 0.00 O flip ATOM 234 NE2 GLN A 18 5.940 0.909 12.624 1.00 0.00 N flip ATOM 0 H GLN A 18 3.529 5.068 10.155 1.00 0.00 H new ATOM 0 HA GLN A 18 4.584 2.859 8.486 1.00 0.00 H new ATOM 0 HB2 GLN A 18 4.387 3.313 11.411 1.00 0.00 H new ATOM 0 HB3 GLN A 18 3.808 1.744 10.886 1.00 0.00 H new ATOM 0 HG2 GLN A 18 6.127 1.820 9.497 1.00 0.00 H new ATOM 0 HG3 GLN A 18 6.572 2.872 10.826 1.00 0.00 H new ATOM 0 HE21 GLN A 18 5.607 1.773 13.052 1.00 0.00 H new ATOM 0 HE22 GLN A 18 6.110 0.086 13.202 1.00 0.00 H new ATOM 243 N LEU A 19 2.373 1.754 8.172 1.00 0.00 N ATOM 244 CA LEU A 19 1.057 1.232 7.827 1.00 0.00 C ATOM 245 C LEU A 19 1.032 -0.290 7.920 1.00 0.00 C ATOM 246 O LEU A 19 1.771 -0.977 7.215 1.00 0.00 O ATOM 247 CB LEU A 19 0.665 1.673 6.416 1.00 0.00 C ATOM 248 CG LEU A 19 -0.484 2.679 6.322 1.00 0.00 C ATOM 249 CD1 LEU A 19 -0.146 3.948 7.089 1.00 0.00 C ATOM 250 CD2 LEU A 19 -0.794 3.000 4.868 1.00 0.00 C ATOM 0 H LEU A 19 3.148 1.293 7.695 1.00 0.00 H new ATOM 0 HA LEU A 19 0.337 1.633 8.540 1.00 0.00 H new ATOM 0 HB2 LEU A 19 1.542 2.107 5.936 1.00 0.00 H new ATOM 0 HB3 LEU A 19 0.393 0.787 5.842 1.00 0.00 H new ATOM 0 HG LEU A 19 -1.371 2.232 6.772 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -0.975 4.652 7.011 1.00 0.00 H new ATOM 0 HD12 LEU A 19 0.026 3.705 8.137 1.00 0.00 H new ATOM 0 HD13 LEU A 19 0.753 4.398 6.669 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -1.614 3.717 4.820 1.00 0.00 H new ATOM 0 HD22 LEU A 19 0.089 3.427 4.393 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -1.080 2.087 4.347 1.00 0.00 H new ATOM 262 N SER A 20 0.176 -0.812 8.793 1.00 0.00 N ATOM 263 CA SER A 20 0.057 -2.253 8.980 1.00 0.00 C ATOM 264 C SER A 20 -0.981 -2.840 8.028 1.00 0.00 C ATOM 265 O SER A 20 -2.159 -2.483 8.079 1.00 0.00 O ATOM 266 CB SER A 20 -0.323 -2.572 10.427 1.00 0.00 C ATOM 267 OG SER A 20 -1.699 -2.895 10.534 1.00 0.00 O ATOM 0 H SER A 20 -0.446 -0.258 9.382 1.00 0.00 H new ATOM 0 HA SER A 20 1.024 -2.704 8.759 1.00 0.00 H new ATOM 0 HB2 SER A 20 0.279 -3.406 10.789 1.00 0.00 H new ATOM 0 HB3 SER A 20 -0.097 -1.716 11.063 1.00 0.00 H new ATOM 0 HG SER A 20 -2.195 -2.458 9.810 1.00 0.00 H new ATOM 273 N VAL A 21 -0.537 -3.743 7.160 1.00 0.00 N ATOM 274 CA VAL A 21 -1.426 -4.381 6.198 1.00 0.00 C ATOM 275 C VAL A 21 -1.489 -5.888 6.422 1.00 0.00 C ATOM 276 O VAL A 21 -0.542 -6.509 6.906 1.00 0.00 O ATOM 277 CB VAL A 21 -0.976 -4.108 4.751 1.00 0.00 C ATOM 278 CG1 VAL A 21 -0.603 -2.644 4.575 1.00 0.00 C ATOM 279 CG2 VAL A 21 0.189 -5.012 4.375 1.00 0.00 C ATOM 0 H VAL A 21 0.434 -4.049 7.104 1.00 0.00 H new ATOM 0 HA VAL A 21 -2.416 -3.952 6.350 1.00 0.00 H new ATOM 0 HB VAL A 21 -1.808 -4.329 4.083 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -0.288 -2.470 3.546 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -1.467 -2.019 4.800 1.00 0.00 H new ATOM 0 HG13 VAL A 21 0.213 -2.393 5.252 1.00 0.00 H new ATOM 0 HG21 VAL A 21 0.494 -4.805 3.349 1.00 0.00 H new ATOM 0 HG22 VAL A 21 1.026 -4.825 5.047 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -0.118 -6.055 4.459 1.00 0.00 H new ATOM 289 N PRO A 22 -2.631 -6.493 6.063 1.00 0.00 N ATOM 290 CA PRO A 22 -2.845 -7.935 6.214 1.00 0.00 C ATOM 291 C PRO A 22 -1.993 -8.753 5.249 1.00 0.00 C ATOM 292 O PRO A 22 -1.569 -8.252 4.207 1.00 0.00 O ATOM 293 CB PRO A 22 -4.332 -8.109 5.894 1.00 0.00 C ATOM 294 CG PRO A 22 -4.668 -6.953 5.015 1.00 0.00 C ATOM 295 CD PRO A 22 -3.801 -5.815 5.479 1.00 0.00 C ATOM 0 HA PRO A 22 -2.565 -8.286 7.207 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -4.520 -9.057 5.390 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -4.935 -8.105 6.802 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -4.475 -7.189 3.969 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -5.724 -6.696 5.094 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -3.517 -5.164 4.653 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -4.313 -5.193 6.213 1.00 0.00 H new ATOM 303 N GLN A 23 -1.749 -10.010 5.602 1.00 0.00 N ATOM 304 CA GLN A 23 -0.947 -10.896 4.766 1.00 0.00 C ATOM 305 C GLN A 23 -1.772 -11.444 3.606 1.00 0.00 C ATOM 306 O GLN A 23 -1.240 -12.089 2.702 1.00 0.00 O ATOM 307 CB GLN A 23 -0.386 -12.050 5.599 1.00 0.00 C ATOM 308 CG GLN A 23 -1.425 -13.097 5.963 1.00 0.00 C ATOM 309 CD GLN A 23 -0.920 -14.084 6.997 1.00 0.00 C ATOM 310 OE1 GLN A 23 -1.595 -14.359 7.991 1.00 0.00 O ATOM 311 NE2 GLN A 23 0.272 -14.623 6.770 1.00 0.00 N ATOM 0 H GLN A 23 -2.095 -10.438 6.461 1.00 0.00 H new ATOM 0 HA GLN A 23 -0.119 -10.317 4.357 1.00 0.00 H new ATOM 0 HB2 GLN A 23 0.421 -12.528 5.045 1.00 0.00 H new ATOM 0 HB3 GLN A 23 0.050 -11.649 6.514 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -2.317 -12.601 6.345 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -1.721 -13.638 5.064 1.00 0.00 H new ATOM 0 HE21 GLN A 23 0.797 -14.367 5.934 1.00 0.00 H new ATOM 0 HE22 GLN A 23 0.663 -15.293 7.432 1.00 0.00 H new ATOM 320 N ARG A 24 -3.075 -11.183 3.638 1.00 0.00 N ATOM 321 CA ARG A 24 -3.974 -11.653 2.591 1.00 0.00 C ATOM 322 C ARG A 24 -4.055 -10.642 1.451 1.00 0.00 C ATOM 323 O ARG A 24 -4.496 -10.968 0.349 1.00 0.00 O ATOM 324 CB ARG A 24 -5.370 -11.905 3.163 1.00 0.00 C ATOM 325 CG ARG A 24 -6.200 -10.642 3.325 1.00 0.00 C ATOM 326 CD ARG A 24 -7.162 -10.753 4.497 1.00 0.00 C ATOM 327 NE ARG A 24 -8.193 -9.720 4.459 1.00 0.00 N ATOM 328 CZ ARG A 24 -9.005 -9.454 5.476 1.00 0.00 C ATOM 329 NH1 ARG A 24 -8.907 -10.142 6.604 1.00 0.00 N ATOM 330 NH2 ARG A 24 -9.919 -8.498 5.364 1.00 0.00 N ATOM 0 H ARG A 24 -3.531 -10.649 4.377 1.00 0.00 H new ATOM 0 HA ARG A 24 -3.576 -12.588 2.198 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -5.901 -12.597 2.510 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -5.273 -12.393 4.133 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -5.539 -9.788 3.475 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -6.761 -10.454 2.409 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -7.633 -11.736 4.487 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -6.606 -10.676 5.431 1.00 0.00 H new ATOM 0 HE ARG A 24 -8.295 -9.172 3.605 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -8.207 -10.878 6.693 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -9.532 -9.935 7.383 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -9.998 -7.967 4.497 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -10.542 -8.294 6.145 1.00 0.00 H new ATOM 344 N SER A 25 -3.626 -9.414 1.724 1.00 0.00 N ATOM 345 CA SER A 25 -3.654 -8.354 0.723 1.00 0.00 C ATOM 346 C SER A 25 -2.244 -7.851 0.426 1.00 0.00 C ATOM 347 O SER A 25 -2.037 -7.059 -0.493 1.00 0.00 O ATOM 348 CB SER A 25 -4.531 -7.195 1.200 1.00 0.00 C ATOM 349 OG SER A 25 -5.787 -7.663 1.660 1.00 0.00 O ATOM 0 H SER A 25 -3.255 -9.128 2.630 1.00 0.00 H new ATOM 0 HA SER A 25 -4.076 -8.765 -0.194 1.00 0.00 H new ATOM 0 HB2 SER A 25 -4.024 -6.657 2.001 1.00 0.00 H new ATOM 0 HB3 SER A 25 -4.679 -6.487 0.384 1.00 0.00 H new ATOM 0 HG SER A 25 -6.329 -6.904 1.961 1.00 0.00 H new ATOM 355 N VAL A 26 -1.279 -8.315 1.212 1.00 0.00 N ATOM 356 CA VAL A 26 0.112 -7.914 1.035 1.00 0.00 C ATOM 357 C VAL A 26 0.658 -8.405 -0.301 1.00 0.00 C ATOM 358 O VAL A 26 1.590 -7.823 -0.855 1.00 0.00 O ATOM 359 CB VAL A 26 1.001 -8.452 2.171 1.00 0.00 C ATOM 360 CG1 VAL A 26 1.417 -9.889 1.888 1.00 0.00 C ATOM 361 CG2 VAL A 26 2.220 -7.564 2.360 1.00 0.00 C ATOM 0 H VAL A 26 -1.434 -8.970 1.979 1.00 0.00 H new ATOM 0 HA VAL A 26 0.133 -6.824 1.055 1.00 0.00 H new ATOM 0 HB VAL A 26 0.425 -8.440 3.096 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.045 -10.253 2.701 1.00 0.00 H new ATOM 0 HG12 VAL A 26 0.529 -10.516 1.807 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.976 -9.929 0.953 1.00 0.00 H new ATOM 0 HG21 VAL A 26 2.837 -7.960 3.167 1.00 0.00 H new ATOM 0 HG22 VAL A 26 2.800 -7.541 1.438 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.898 -6.553 2.611 1.00 0.00 H new ATOM 371 N GLY A 27 0.072 -9.483 -0.815 1.00 0.00 N ATOM 372 CA GLY A 27 0.513 -10.034 -2.082 1.00 0.00 C ATOM 373 C GLY A 27 0.105 -9.175 -3.262 1.00 0.00 C ATOM 374 O GLY A 27 0.674 -9.287 -4.347 1.00 0.00 O ATOM 0 H GLY A 27 -0.700 -9.984 -0.376 1.00 0.00 H new ATOM 0 HA2 GLY A 27 1.598 -10.139 -2.071 1.00 0.00 H new ATOM 0 HA3 GLY A 27 0.097 -11.034 -2.204 1.00 0.00 H new ATOM 378 N ARG A 28 -0.888 -8.317 -3.051 1.00 0.00 N ATOM 379 CA ARG A 28 -1.376 -7.438 -4.108 1.00 0.00 C ATOM 380 C ARG A 28 -0.734 -6.057 -4.005 1.00 0.00 C ATOM 381 O ARG A 28 -0.578 -5.359 -5.007 1.00 0.00 O ATOM 382 CB ARG A 28 -2.898 -7.312 -4.034 1.00 0.00 C ATOM 383 CG ARG A 28 -3.518 -6.683 -5.270 1.00 0.00 C ATOM 384 CD ARG A 28 -4.121 -7.734 -6.189 1.00 0.00 C ATOM 385 NE ARG A 28 -3.125 -8.315 -7.085 1.00 0.00 N ATOM 386 CZ ARG A 28 -3.409 -9.225 -8.009 1.00 0.00 C ATOM 387 NH1 ARG A 28 -4.654 -9.657 -8.158 1.00 0.00 N ATOM 388 NH2 ARG A 28 -2.448 -9.706 -8.787 1.00 0.00 N ATOM 0 H ARG A 28 -1.370 -8.212 -2.158 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.102 -7.877 -5.067 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -3.329 -8.302 -3.885 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -3.163 -6.715 -3.161 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -4.290 -5.974 -4.970 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -2.759 -6.118 -5.811 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -4.573 -8.524 -5.589 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -4.920 -7.284 -6.778 1.00 0.00 H new ATOM 0 HE ARG A 28 -2.158 -8.004 -6.996 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -5.396 -9.290 -7.562 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -4.870 -10.356 -8.869 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -1.489 -9.377 -8.676 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -2.668 -10.405 -9.496 1.00 0.00 H new ATOM 402 N ILE A 29 -0.366 -5.671 -2.789 1.00 0.00 N ATOM 403 CA ILE A 29 0.258 -4.374 -2.556 1.00 0.00 C ATOM 404 C ILE A 29 1.740 -4.405 -2.915 1.00 0.00 C ATOM 405 O ILE A 29 2.215 -3.586 -3.701 1.00 0.00 O ATOM 406 CB ILE A 29 0.106 -3.932 -1.088 1.00 0.00 C ATOM 407 CG1 ILE A 29 -1.362 -3.992 -0.664 1.00 0.00 C ATOM 408 CG2 ILE A 29 0.661 -2.528 -0.898 1.00 0.00 C ATOM 409 CD1 ILE A 29 -1.555 -4.272 0.810 1.00 0.00 C ATOM 0 H ILE A 29 -0.489 -6.237 -1.950 1.00 0.00 H new ATOM 0 HA ILE A 29 -0.254 -3.657 -3.198 1.00 0.00 H new ATOM 0 HB ILE A 29 0.675 -4.615 -0.457 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.842 -3.045 -0.911 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -1.867 -4.766 -1.242 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.547 -2.229 0.144 1.00 0.00 H new ATOM 0 HG22 ILE A 29 1.718 -2.515 -1.165 1.00 0.00 H new ATOM 0 HG23 ILE A 29 0.117 -1.832 -1.537 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -2.620 -4.300 1.039 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.105 -5.233 1.060 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -1.079 -3.485 1.395 1.00 0.00 H new ATOM 421 N ILE A 30 2.464 -5.356 -2.335 1.00 0.00 N ATOM 422 CA ILE A 30 3.891 -5.495 -2.596 1.00 0.00 C ATOM 423 C ILE A 30 4.144 -5.999 -4.014 1.00 0.00 C ATOM 424 O ILE A 30 5.025 -5.502 -4.713 1.00 0.00 O ATOM 425 CB ILE A 30 4.555 -6.459 -1.595 1.00 0.00 C ATOM 426 CG1 ILE A 30 4.704 -5.787 -0.229 1.00 0.00 C ATOM 427 CG2 ILE A 30 5.909 -6.914 -2.118 1.00 0.00 C ATOM 428 CD1 ILE A 30 5.690 -6.483 0.682 1.00 0.00 C ATOM 0 H ILE A 30 2.086 -6.042 -1.681 1.00 0.00 H new ATOM 0 HA ILE A 30 4.331 -4.504 -2.481 1.00 0.00 H new ATOM 0 HB ILE A 30 3.918 -7.336 -1.480 1.00 0.00 H new ATOM 0 HG12 ILE A 30 5.022 -4.754 -0.374 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.730 -5.755 0.260 1.00 0.00 H new ATOM 0 HG21 ILE A 30 6.366 -7.595 -1.400 1.00 0.00 H new ATOM 0 HG22 ILE A 30 5.777 -7.426 -3.071 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.555 -6.047 -2.258 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.745 -5.952 1.632 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.363 -7.508 0.857 1.00 0.00 H new ATOM 0 HD13 ILE A 30 6.674 -6.491 0.214 1.00 0.00 H new ATOM 440 N GLY A 31 3.362 -6.989 -4.432 1.00 0.00 N ATOM 441 CA GLY A 31 3.514 -7.543 -5.764 1.00 0.00 C ATOM 442 C GLY A 31 4.574 -8.626 -5.824 1.00 0.00 C ATOM 443 O GLY A 31 5.205 -8.941 -4.816 1.00 0.00 O ATOM 0 H GLY A 31 2.625 -7.417 -3.871 1.00 0.00 H new ATOM 0 HA2 GLY A 31 2.560 -7.954 -6.094 1.00 0.00 H new ATOM 0 HA3 GLY A 31 3.775 -6.745 -6.459 1.00 0.00 H new ATOM 447 N ARG A 32 4.770 -9.196 -7.009 1.00 0.00 N ATOM 448 CA ARG A 32 5.758 -10.251 -7.195 1.00 0.00 C ATOM 449 C ARG A 32 7.151 -9.767 -6.803 1.00 0.00 C ATOM 450 O ARG A 32 7.768 -8.977 -7.516 1.00 0.00 O ATOM 451 CB ARG A 32 5.762 -10.725 -8.650 1.00 0.00 C ATOM 452 CG ARG A 32 5.556 -12.223 -8.803 1.00 0.00 C ATOM 453 CD ARG A 32 6.347 -12.776 -9.978 1.00 0.00 C ATOM 454 NE ARG A 32 5.475 -13.309 -11.022 1.00 0.00 N ATOM 455 CZ ARG A 32 5.846 -13.447 -12.290 1.00 0.00 C ATOM 456 NH1 ARG A 32 7.066 -13.093 -12.669 1.00 0.00 N ATOM 457 NH2 ARG A 32 4.996 -13.940 -13.182 1.00 0.00 N ATOM 0 H ARG A 32 4.257 -8.944 -7.854 1.00 0.00 H new ATOM 0 HA ARG A 32 5.487 -11.086 -6.549 1.00 0.00 H new ATOM 0 HB2 ARG A 32 4.977 -10.201 -9.196 1.00 0.00 H new ATOM 0 HB3 ARG A 32 6.710 -10.448 -9.111 1.00 0.00 H new ATOM 0 HG2 ARG A 32 5.861 -12.729 -7.887 1.00 0.00 H new ATOM 0 HG3 ARG A 32 4.496 -12.433 -8.945 1.00 0.00 H new ATOM 0 HD2 ARG A 32 6.974 -11.988 -10.396 1.00 0.00 H new ATOM 0 HD3 ARG A 32 7.015 -13.562 -9.627 1.00 0.00 H new ATOM 0 HE ARG A 32 4.529 -13.591 -10.763 1.00 0.00 H new ATOM 0 HH11 ARG A 32 7.722 -12.714 -11.986 1.00 0.00 H new ATOM 0 HH12 ARG A 32 7.349 -13.200 -13.643 1.00 0.00 H new ATOM 0 HH21 ARG A 32 4.056 -14.213 -12.894 1.00 0.00 H new ATOM 0 HH22 ARG A 32 5.282 -14.045 -14.155 1.00 0.00 H new ATOM 471 N GLY A 33 7.639 -10.246 -5.663 1.00 0.00 N ATOM 472 CA GLY A 33 8.955 -9.850 -5.196 1.00 0.00 C ATOM 473 C GLY A 33 9.078 -8.351 -5.010 1.00 0.00 C ATOM 474 O GLY A 33 10.171 -7.833 -4.786 1.00 0.00 O ATOM 0 H GLY A 33 7.147 -10.901 -5.055 1.00 0.00 H new ATOM 0 HA2 GLY A 33 9.167 -10.349 -4.250 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.707 -10.187 -5.909 1.00 0.00 H new ATOM 478 N GLY A 34 7.952 -7.651 -5.103 1.00 0.00 N ATOM 479 CA GLY A 34 7.959 -6.208 -4.943 1.00 0.00 C ATOM 480 C GLY A 34 7.660 -5.479 -6.238 1.00 0.00 C ATOM 481 O GLY A 34 7.578 -4.252 -6.262 1.00 0.00 O ATOM 0 H GLY A 34 7.034 -8.057 -5.286 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.221 -5.925 -4.192 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.933 -5.892 -4.568 1.00 0.00 H new ATOM 485 N GLU A 35 7.498 -6.237 -7.318 1.00 0.00 N ATOM 486 CA GLU A 35 7.210 -5.654 -8.623 1.00 0.00 C ATOM 487 C GLU A 35 6.178 -4.536 -8.504 1.00 0.00 C ATOM 488 O GLU A 35 6.168 -3.597 -9.300 1.00 0.00 O ATOM 489 CB GLU A 35 6.703 -6.730 -9.586 1.00 0.00 C ATOM 490 CG GLU A 35 5.269 -7.157 -9.319 1.00 0.00 C ATOM 491 CD GLU A 35 4.314 -6.710 -10.408 1.00 0.00 C ATOM 492 OE1 GLU A 35 4.574 -7.022 -11.590 1.00 0.00 O ATOM 493 OE2 GLU A 35 3.309 -6.046 -10.081 1.00 0.00 O ATOM 0 H GLU A 35 7.561 -7.255 -7.315 1.00 0.00 H new ATOM 0 HA GLU A 35 8.135 -5.231 -9.016 1.00 0.00 H new ATOM 0 HB2 GLU A 35 6.778 -6.357 -10.607 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.352 -7.603 -9.517 1.00 0.00 H new ATOM 0 HG2 GLU A 35 5.228 -8.242 -9.228 1.00 0.00 H new ATOM 0 HG3 GLU A 35 4.943 -6.745 -8.364 1.00 0.00 H new ATOM 500 N THR A 36 5.312 -4.643 -7.502 1.00 0.00 N ATOM 501 CA THR A 36 4.275 -3.643 -7.278 1.00 0.00 C ATOM 502 C THR A 36 4.725 -2.604 -6.256 1.00 0.00 C ATOM 503 O THR A 36 4.350 -1.435 -6.341 1.00 0.00 O ATOM 504 CB THR A 36 2.965 -4.291 -6.791 1.00 0.00 C ATOM 505 OG1 THR A 36 2.528 -5.278 -7.732 1.00 0.00 O ATOM 506 CG2 THR A 36 1.879 -3.243 -6.606 1.00 0.00 C ATOM 0 H THR A 36 5.308 -5.412 -6.832 1.00 0.00 H new ATOM 0 HA THR A 36 4.096 -3.154 -8.235 1.00 0.00 H new ATOM 0 HB THR A 36 3.156 -4.766 -5.829 1.00 0.00 H new ATOM 0 HG1 THR A 36 2.984 -5.138 -8.588 1.00 0.00 H new ATOM 0 HG21 THR A 36 0.964 -3.724 -6.262 1.00 0.00 H new ATOM 0 HG22 THR A 36 2.203 -2.510 -5.868 1.00 0.00 H new ATOM 0 HG23 THR A 36 1.691 -2.743 -7.556 1.00 0.00 H new ATOM 514 N ILE A 37 5.530 -3.039 -5.293 1.00 0.00 N ATOM 515 CA ILE A 37 6.033 -2.146 -4.257 1.00 0.00 C ATOM 516 C ILE A 37 7.058 -1.169 -4.822 1.00 0.00 C ATOM 517 O ILE A 37 7.323 -0.121 -4.233 1.00 0.00 O ATOM 518 CB ILE A 37 6.673 -2.931 -3.097 1.00 0.00 C ATOM 519 CG1 ILE A 37 6.536 -2.153 -1.788 1.00 0.00 C ATOM 520 CG2 ILE A 37 8.137 -3.219 -3.398 1.00 0.00 C ATOM 521 CD1 ILE A 37 5.108 -1.786 -1.449 1.00 0.00 C ATOM 0 H ILE A 37 5.848 -4.005 -5.209 1.00 0.00 H new ATOM 0 HA ILE A 37 5.176 -1.590 -3.878 1.00 0.00 H new ATOM 0 HB ILE A 37 6.150 -3.881 -2.988 1.00 0.00 H new ATOM 0 HG12 ILE A 37 6.952 -2.749 -0.976 1.00 0.00 H new ATOM 0 HG13 ILE A 37 7.131 -1.242 -1.852 1.00 0.00 H new ATOM 0 HG21 ILE A 37 8.576 -3.774 -2.569 1.00 0.00 H new ATOM 0 HG22 ILE A 37 8.211 -3.810 -4.311 1.00 0.00 H new ATOM 0 HG23 ILE A 37 8.673 -2.279 -3.530 1.00 0.00 H new ATOM 0 HD11 ILE A 37 5.087 -1.236 -0.508 1.00 0.00 H new ATOM 0 HD12 ILE A 37 4.694 -1.164 -2.242 1.00 0.00 H new ATOM 0 HD13 ILE A 37 4.512 -2.694 -1.352 1.00 0.00 H new ATOM 533 N ARG A 38 7.631 -1.520 -5.969 1.00 0.00 N ATOM 534 CA ARG A 38 8.628 -0.674 -6.615 1.00 0.00 C ATOM 535 C ARG A 38 7.962 0.353 -7.525 1.00 0.00 C ATOM 536 O ARG A 38 8.414 1.493 -7.628 1.00 0.00 O ATOM 537 CB ARG A 38 9.606 -1.529 -7.423 1.00 0.00 C ATOM 538 CG ARG A 38 10.282 -2.618 -6.607 1.00 0.00 C ATOM 539 CD ARG A 38 11.627 -3.006 -7.201 1.00 0.00 C ATOM 540 NE ARG A 38 12.621 -1.946 -7.045 1.00 0.00 N ATOM 541 CZ ARG A 38 13.725 -1.861 -7.777 1.00 0.00 C ATOM 542 NH1 ARG A 38 13.978 -2.768 -8.710 1.00 0.00 N ATOM 543 NH2 ARG A 38 14.582 -0.867 -7.576 1.00 0.00 N ATOM 0 H ARG A 38 7.422 -2.384 -6.470 1.00 0.00 H new ATOM 0 HA ARG A 38 9.177 -0.143 -5.837 1.00 0.00 H new ATOM 0 HB2 ARG A 38 9.072 -1.989 -8.255 1.00 0.00 H new ATOM 0 HB3 ARG A 38 10.370 -0.882 -7.854 1.00 0.00 H new ATOM 0 HG2 ARG A 38 10.422 -2.273 -5.583 1.00 0.00 H new ATOM 0 HG3 ARG A 38 9.636 -3.495 -6.563 1.00 0.00 H new ATOM 0 HD2 ARG A 38 11.988 -3.915 -6.719 1.00 0.00 H new ATOM 0 HD3 ARG A 38 11.503 -3.234 -8.260 1.00 0.00 H new ATOM 0 HE ARG A 38 12.457 -1.232 -6.335 1.00 0.00 H new ATOM 0 HH11 ARG A 38 13.323 -3.534 -8.867 1.00 0.00 H new ATOM 0 HH12 ARG A 38 14.827 -2.700 -9.271 1.00 0.00 H new ATOM 0 HH21 ARG A 38 14.392 -0.167 -6.858 1.00 0.00 H new ATOM 0 HH22 ARG A 38 15.430 -0.803 -8.139 1.00 0.00 H new ATOM 557 N SER A 39 6.882 -0.058 -8.184 1.00 0.00 N ATOM 558 CA SER A 39 6.155 0.824 -9.088 1.00 0.00 C ATOM 559 C SER A 39 5.501 1.970 -8.322 1.00 0.00 C ATOM 560 O SER A 39 5.265 3.044 -8.873 1.00 0.00 O ATOM 561 CB SER A 39 5.093 0.038 -9.858 1.00 0.00 C ATOM 562 OG SER A 39 5.225 0.234 -11.256 1.00 0.00 O ATOM 0 H SER A 39 6.492 -0.997 -8.108 1.00 0.00 H new ATOM 0 HA SER A 39 6.869 1.245 -9.796 1.00 0.00 H new ATOM 0 HB2 SER A 39 5.183 -1.023 -9.627 1.00 0.00 H new ATOM 0 HB3 SER A 39 4.100 0.351 -9.536 1.00 0.00 H new ATOM 0 HG SER A 39 4.535 -0.281 -11.725 1.00 0.00 H new ATOM 568 N ILE A 40 5.212 1.730 -7.047 1.00 0.00 N ATOM 569 CA ILE A 40 4.587 2.741 -6.203 1.00 0.00 C ATOM 570 C ILE A 40 5.596 3.798 -5.771 1.00 0.00 C ATOM 571 O ILE A 40 5.417 4.987 -6.040 1.00 0.00 O ATOM 572 CB ILE A 40 3.950 2.112 -4.950 1.00 0.00 C ATOM 573 CG1 ILE A 40 2.908 1.065 -5.349 1.00 0.00 C ATOM 574 CG2 ILE A 40 3.320 3.189 -4.078 1.00 0.00 C ATOM 575 CD1 ILE A 40 2.550 0.111 -4.232 1.00 0.00 C ATOM 0 H ILE A 40 5.401 0.845 -6.576 1.00 0.00 H new ATOM 0 HA ILE A 40 3.806 3.212 -6.800 1.00 0.00 H new ATOM 0 HB ILE A 40 4.732 1.617 -4.374 1.00 0.00 H new ATOM 0 HG12 ILE A 40 2.004 1.574 -5.685 1.00 0.00 H new ATOM 0 HG13 ILE A 40 3.286 0.493 -6.197 1.00 0.00 H new ATOM 0 HG21 ILE A 40 2.874 2.729 -3.196 1.00 0.00 H new ATOM 0 HG22 ILE A 40 4.086 3.900 -3.768 1.00 0.00 H new ATOM 0 HG23 ILE A 40 2.549 3.711 -4.644 1.00 0.00 H new ATOM 0 HD11 ILE A 40 1.807 -0.603 -4.587 1.00 0.00 H new ATOM 0 HD12 ILE A 40 3.443 -0.425 -3.911 1.00 0.00 H new ATOM 0 HD13 ILE A 40 2.142 0.672 -3.391 1.00 0.00 H new ATOM 587 N CYS A 41 6.657 3.358 -5.104 1.00 0.00 N ATOM 588 CA CYS A 41 7.696 4.267 -4.636 1.00 0.00 C ATOM 589 C CYS A 41 8.102 5.242 -5.736 1.00 0.00 C ATOM 590 O CYS A 41 8.464 6.387 -5.465 1.00 0.00 O ATOM 591 CB CYS A 41 8.917 3.478 -4.162 1.00 0.00 C ATOM 592 SG CYS A 41 10.392 4.489 -3.896 1.00 0.00 S ATOM 0 H CYS A 41 6.820 2.377 -4.875 1.00 0.00 H new ATOM 0 HA CYS A 41 7.294 4.838 -3.799 1.00 0.00 H new ATOM 0 HB2 CYS A 41 8.667 2.967 -3.232 1.00 0.00 H new ATOM 0 HB3 CYS A 41 9.146 2.707 -4.898 1.00 0.00 H new ATOM 0 HG CYS A 41 10.135 5.407 -3.012 1.00 0.00 H new ATOM 598 N LYS A 42 8.041 4.780 -6.981 1.00 0.00 N ATOM 599 CA LYS A 42 8.402 5.611 -8.124 1.00 0.00 C ATOM 600 C LYS A 42 7.221 6.469 -8.568 1.00 0.00 C ATOM 601 O LYS A 42 7.402 7.571 -9.084 1.00 0.00 O ATOM 602 CB LYS A 42 8.876 4.735 -9.286 1.00 0.00 C ATOM 603 CG LYS A 42 7.743 4.069 -10.047 1.00 0.00 C ATOM 604 CD LYS A 42 8.200 3.575 -11.409 1.00 0.00 C ATOM 605 CE LYS A 42 8.949 2.256 -11.301 1.00 0.00 C ATOM 606 NZ LYS A 42 10.002 2.128 -12.347 1.00 0.00 N ATOM 0 H LYS A 42 7.745 3.835 -7.224 1.00 0.00 H new ATOM 0 HA LYS A 42 9.214 6.272 -7.820 1.00 0.00 H new ATOM 0 HB2 LYS A 42 9.457 5.346 -9.977 1.00 0.00 H new ATOM 0 HB3 LYS A 42 9.545 3.966 -8.901 1.00 0.00 H new ATOM 0 HG2 LYS A 42 7.357 3.231 -9.466 1.00 0.00 H new ATOM 0 HG3 LYS A 42 6.923 4.776 -10.172 1.00 0.00 H new ATOM 0 HD2 LYS A 42 7.335 3.451 -12.061 1.00 0.00 H new ATOM 0 HD3 LYS A 42 8.844 4.323 -11.871 1.00 0.00 H new ATOM 0 HE2 LYS A 42 9.406 2.178 -10.314 1.00 0.00 H new ATOM 0 HE3 LYS A 42 8.244 1.430 -11.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 10.489 1.216 -12.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 9.564 2.177 -13.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 10.689 2.902 -12.244 1.00 0.00 H new ATOM 620 N ALA A 43 6.013 5.955 -8.362 1.00 0.00 N ATOM 621 CA ALA A 43 4.803 6.675 -8.738 1.00 0.00 C ATOM 622 C ALA A 43 4.475 7.766 -7.723 1.00 0.00 C ATOM 623 O ALA A 43 3.821 8.755 -8.051 1.00 0.00 O ATOM 624 CB ALA A 43 3.635 5.711 -8.874 1.00 0.00 C ATOM 0 H ALA A 43 5.846 5.043 -7.937 1.00 0.00 H new ATOM 0 HA ALA A 43 4.980 7.152 -9.702 1.00 0.00 H new ATOM 0 HB1 ALA A 43 2.738 6.263 -9.155 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.861 4.971 -9.642 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.467 5.206 -7.923 1.00 0.00 H new ATOM 630 N SER A 44 4.934 7.577 -6.490 1.00 0.00 N ATOM 631 CA SER A 44 4.686 8.543 -5.427 1.00 0.00 C ATOM 632 C SER A 44 5.954 9.323 -5.095 1.00 0.00 C ATOM 633 O SER A 44 5.902 10.516 -4.793 1.00 0.00 O ATOM 634 CB SER A 44 4.169 7.832 -4.174 1.00 0.00 C ATOM 635 OG SER A 44 4.764 6.553 -4.031 1.00 0.00 O ATOM 0 H SER A 44 5.479 6.764 -6.203 1.00 0.00 H new ATOM 0 HA SER A 44 3.929 9.245 -5.777 1.00 0.00 H new ATOM 0 HB2 SER A 44 4.385 8.437 -3.294 1.00 0.00 H new ATOM 0 HB3 SER A 44 3.086 7.728 -4.232 1.00 0.00 H new ATOM 0 HG SER A 44 4.571 6.012 -4.825 1.00 0.00 H new ATOM 641 N GLY A 45 7.093 8.641 -5.153 1.00 0.00 N ATOM 642 CA GLY A 45 8.360 9.286 -4.856 1.00 0.00 C ATOM 643 C GLY A 45 8.821 9.031 -3.434 1.00 0.00 C ATOM 644 O GLY A 45 9.944 9.375 -3.068 1.00 0.00 O ATOM 0 H GLY A 45 7.162 7.654 -5.400 1.00 0.00 H new ATOM 0 HA2 GLY A 45 9.119 8.926 -5.551 1.00 0.00 H new ATOM 0 HA3 GLY A 45 8.264 10.360 -5.017 1.00 0.00 H new ATOM 648 N ALA A 46 7.951 8.428 -2.631 1.00 0.00 N ATOM 649 CA ALA A 46 8.275 8.128 -1.241 1.00 0.00 C ATOM 650 C ALA A 46 8.810 6.707 -1.098 1.00 0.00 C ATOM 651 O ALA A 46 8.399 5.801 -1.823 1.00 0.00 O ATOM 652 CB ALA A 46 7.051 8.325 -0.360 1.00 0.00 C ATOM 0 H ALA A 46 7.016 8.137 -2.919 1.00 0.00 H new ATOM 0 HA ALA A 46 9.056 8.817 -0.918 1.00 0.00 H new ATOM 0 HB1 ALA A 46 7.307 8.098 0.675 1.00 0.00 H new ATOM 0 HB2 ALA A 46 6.714 9.359 -0.432 1.00 0.00 H new ATOM 0 HB3 ALA A 46 6.254 7.660 -0.691 1.00 0.00 H new ATOM 658 N LYS A 47 9.730 6.519 -0.158 1.00 0.00 N ATOM 659 CA LYS A 47 10.322 5.208 0.083 1.00 0.00 C ATOM 660 C LYS A 47 9.385 4.330 0.907 1.00 0.00 C ATOM 661 O LYS A 47 9.060 4.657 2.049 1.00 0.00 O ATOM 662 CB LYS A 47 11.664 5.356 0.802 1.00 0.00 C ATOM 663 CG LYS A 47 12.128 4.085 1.493 1.00 0.00 C ATOM 664 CD LYS A 47 12.575 3.036 0.490 1.00 0.00 C ATOM 665 CE LYS A 47 13.963 2.507 0.816 1.00 0.00 C ATOM 666 NZ LYS A 47 14.537 1.721 -0.311 1.00 0.00 N ATOM 0 H LYS A 47 10.082 7.258 0.450 1.00 0.00 H new ATOM 0 HA LYS A 47 10.485 4.728 -0.882 1.00 0.00 H new ATOM 0 HB2 LYS A 47 12.421 5.664 0.081 1.00 0.00 H new ATOM 0 HB3 LYS A 47 11.585 6.153 1.541 1.00 0.00 H new ATOM 0 HG2 LYS A 47 12.951 4.317 2.169 1.00 0.00 H new ATOM 0 HG3 LYS A 47 11.318 3.685 2.103 1.00 0.00 H new ATOM 0 HD2 LYS A 47 11.863 2.211 0.483 1.00 0.00 H new ATOM 0 HD3 LYS A 47 12.575 3.466 -0.512 1.00 0.00 H new ATOM 0 HE2 LYS A 47 14.624 3.342 1.050 1.00 0.00 H new ATOM 0 HE3 LYS A 47 13.913 1.881 1.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 15.483 1.378 -0.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 13.920 0.910 -0.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 14.609 2.325 -1.154 1.00 0.00 H new ATOM 680 N ILE A 48 8.957 3.218 0.321 1.00 0.00 N ATOM 681 CA ILE A 48 8.060 2.293 1.004 1.00 0.00 C ATOM 682 C ILE A 48 8.727 0.940 1.221 1.00 0.00 C ATOM 683 O ILE A 48 9.135 0.276 0.268 1.00 0.00 O ATOM 684 CB ILE A 48 6.754 2.089 0.213 1.00 0.00 C ATOM 685 CG1 ILE A 48 6.200 3.436 -0.257 1.00 0.00 C ATOM 686 CG2 ILE A 48 5.728 1.355 1.064 1.00 0.00 C ATOM 687 CD1 ILE A 48 6.255 3.622 -1.757 1.00 0.00 C ATOM 0 H ILE A 48 9.216 2.935 -0.624 1.00 0.00 H new ATOM 0 HA ILE A 48 7.824 2.738 1.971 1.00 0.00 H new ATOM 0 HB ILE A 48 6.970 1.481 -0.665 1.00 0.00 H new ATOM 0 HG12 ILE A 48 5.166 3.530 0.075 1.00 0.00 H new ATOM 0 HG13 ILE A 48 6.763 4.238 0.221 1.00 0.00 H new ATOM 0 HG21 ILE A 48 4.811 1.219 0.491 1.00 0.00 H new ATOM 0 HG22 ILE A 48 6.124 0.381 1.352 1.00 0.00 H new ATOM 0 HG23 ILE A 48 5.513 1.939 1.959 1.00 0.00 H new ATOM 0 HD11 ILE A 48 5.846 4.598 -2.018 1.00 0.00 H new ATOM 0 HD12 ILE A 48 7.290 3.560 -2.094 1.00 0.00 H new ATOM 0 HD13 ILE A 48 5.669 2.842 -2.242 1.00 0.00 H new ATOM 699 N THR A 49 8.832 0.533 2.482 1.00 0.00 N ATOM 700 CA THR A 49 9.449 -0.742 2.825 1.00 0.00 C ATOM 701 C THR A 49 8.640 -1.475 3.889 1.00 0.00 C ATOM 702 O THR A 49 8.096 -0.856 4.804 1.00 0.00 O ATOM 703 CB THR A 49 10.890 -0.550 3.334 1.00 0.00 C ATOM 704 OG1 THR A 49 11.619 -1.776 3.214 1.00 0.00 O ATOM 705 CG2 THR A 49 10.895 -0.091 4.785 1.00 0.00 C ATOM 0 H THR A 49 8.497 1.068 3.283 1.00 0.00 H new ATOM 0 HA THR A 49 9.470 -1.338 1.913 1.00 0.00 H new ATOM 0 HB THR A 49 11.368 0.218 2.725 1.00 0.00 H new ATOM 0 HG1 THR A 49 12.535 -1.645 3.538 1.00 0.00 H new ATOM 0 HG21 THR A 49 11.923 0.038 5.122 1.00 0.00 H new ATOM 0 HG22 THR A 49 10.364 0.857 4.868 1.00 0.00 H new ATOM 0 HG23 THR A 49 10.401 -0.839 5.405 1.00 0.00 H new ATOM 713 N CYS A 50 8.566 -2.795 3.763 1.00 0.00 N ATOM 714 CA CYS A 50 7.822 -3.613 4.715 1.00 0.00 C ATOM 715 C CYS A 50 8.708 -4.023 5.887 1.00 0.00 C ATOM 716 O CYS A 50 9.913 -4.217 5.730 1.00 0.00 O ATOM 717 CB CYS A 50 7.263 -4.856 4.023 1.00 0.00 C ATOM 718 SG CYS A 50 8.521 -6.064 3.544 1.00 0.00 S ATOM 0 H CYS A 50 9.012 -3.322 3.012 1.00 0.00 H new ATOM 0 HA CYS A 50 6.994 -3.018 5.100 1.00 0.00 H new ATOM 0 HB2 CYS A 50 6.547 -5.338 4.689 1.00 0.00 H new ATOM 0 HB3 CYS A 50 6.714 -4.547 3.133 1.00 0.00 H new ATOM 0 HG CYS A 50 9.627 -5.814 4.180 1.00 0.00 H new ATOM 724 N ASP A 51 8.101 -4.154 7.062 1.00 0.00 N ATOM 725 CA ASP A 51 8.835 -4.542 8.262 1.00 0.00 C ATOM 726 C ASP A 51 9.879 -5.607 7.940 1.00 0.00 C ATOM 727 O ASP A 51 9.789 -6.293 6.923 1.00 0.00 O ATOM 728 CB ASP A 51 7.871 -5.061 9.329 1.00 0.00 C ATOM 729 CG ASP A 51 7.691 -4.082 10.472 1.00 0.00 C ATOM 730 OD1 ASP A 51 7.975 -2.881 10.277 1.00 0.00 O ATOM 731 OD2 ASP A 51 7.262 -4.515 11.563 1.00 0.00 O ATOM 0 H ASP A 51 7.104 -3.997 7.209 1.00 0.00 H new ATOM 0 HA ASP A 51 9.348 -3.660 8.645 1.00 0.00 H new ATOM 0 HB2 ASP A 51 6.902 -5.263 8.872 1.00 0.00 H new ATOM 0 HB3 ASP A 51 8.243 -6.008 9.721 1.00 0.00 H new ATOM 736 N LYS A 52 10.871 -5.737 8.815 1.00 0.00 N ATOM 737 CA LYS A 52 11.934 -6.718 8.625 1.00 0.00 C ATOM 738 C LYS A 52 12.191 -7.496 9.912 1.00 0.00 C ATOM 739 O LYS A 52 12.214 -8.726 9.910 1.00 0.00 O ATOM 740 CB LYS A 52 13.220 -6.025 8.170 1.00 0.00 C ATOM 741 CG LYS A 52 13.480 -4.702 8.870 1.00 0.00 C ATOM 742 CD LYS A 52 14.400 -4.877 10.066 1.00 0.00 C ATOM 743 CE LYS A 52 15.800 -4.359 9.772 1.00 0.00 C ATOM 744 NZ LYS A 52 16.075 -3.074 10.472 1.00 0.00 N ATOM 0 H LYS A 52 10.961 -5.176 9.662 1.00 0.00 H new ATOM 0 HA LYS A 52 11.615 -7.419 7.854 1.00 0.00 H new ATOM 0 HB2 LYS A 52 14.064 -6.692 8.347 1.00 0.00 H new ATOM 0 HB3 LYS A 52 13.169 -5.853 7.095 1.00 0.00 H new ATOM 0 HG2 LYS A 52 13.925 -3.998 8.167 1.00 0.00 H new ATOM 0 HG3 LYS A 52 12.534 -4.270 9.197 1.00 0.00 H new ATOM 0 HD2 LYS A 52 13.987 -4.347 10.924 1.00 0.00 H new ATOM 0 HD3 LYS A 52 14.450 -5.932 10.337 1.00 0.00 H new ATOM 0 HE2 LYS A 52 16.534 -5.104 10.079 1.00 0.00 H new ATOM 0 HE3 LYS A 52 15.917 -4.219 8.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 17.039 -2.755 10.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 15.390 -2.356 10.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 15.988 -3.213 11.499 1.00 0.00 H new ATOM 758 N GLU A 53 12.384 -6.769 11.009 1.00 0.00 N ATOM 759 CA GLU A 53 12.639 -7.392 12.302 1.00 0.00 C ATOM 760 C GLU A 53 11.840 -8.685 12.450 1.00 0.00 C ATOM 761 O GLU A 53 12.278 -9.625 13.113 1.00 0.00 O ATOM 762 CB GLU A 53 12.285 -6.429 13.437 1.00 0.00 C ATOM 763 CG GLU A 53 13.139 -5.172 13.456 1.00 0.00 C ATOM 764 CD GLU A 53 12.912 -4.331 14.697 1.00 0.00 C ATOM 765 OE1 GLU A 53 13.301 -4.780 15.796 1.00 0.00 O ATOM 766 OE2 GLU A 53 12.345 -3.226 14.571 1.00 0.00 O ATOM 0 H GLU A 53 12.369 -5.749 11.027 1.00 0.00 H new ATOM 0 HA GLU A 53 13.701 -7.632 12.357 1.00 0.00 H new ATOM 0 HB2 GLU A 53 11.237 -6.145 13.348 1.00 0.00 H new ATOM 0 HB3 GLU A 53 12.395 -6.947 14.390 1.00 0.00 H new ATOM 0 HG2 GLU A 53 14.191 -5.451 13.398 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.919 -4.574 12.571 1.00 0.00 H new ATOM 773 N SER A 54 10.666 -8.722 11.829 1.00 0.00 N ATOM 774 CA SER A 54 9.803 -9.895 11.896 1.00 0.00 C ATOM 775 C SER A 54 9.679 -10.557 10.526 1.00 0.00 C ATOM 776 O SER A 54 8.861 -10.149 9.701 1.00 0.00 O ATOM 777 CB SER A 54 8.418 -9.509 12.415 1.00 0.00 C ATOM 778 OG SER A 54 8.438 -9.301 13.817 1.00 0.00 O ATOM 0 H SER A 54 10.291 -7.953 11.274 1.00 0.00 H new ATOM 0 HA SER A 54 10.255 -10.608 12.586 1.00 0.00 H new ATOM 0 HB2 SER A 54 8.078 -8.602 11.915 1.00 0.00 H new ATOM 0 HB3 SER A 54 7.703 -10.295 12.171 1.00 0.00 H new ATOM 0 HG SER A 54 7.541 -9.054 14.124 1.00 0.00 H new ATOM 784 N GLU A 55 10.497 -11.578 10.292 1.00 0.00 N ATOM 785 CA GLU A 55 10.480 -12.294 9.022 1.00 0.00 C ATOM 786 C GLU A 55 9.063 -12.738 8.667 1.00 0.00 C ATOM 787 O GLU A 55 8.141 -12.612 9.472 1.00 0.00 O ATOM 788 CB GLU A 55 11.406 -13.510 9.084 1.00 0.00 C ATOM 789 CG GLU A 55 12.864 -13.153 9.316 1.00 0.00 C ATOM 790 CD GLU A 55 13.611 -12.882 8.025 1.00 0.00 C ATOM 791 OE1 GLU A 55 13.155 -12.019 7.246 1.00 0.00 O ATOM 792 OE2 GLU A 55 14.651 -13.534 7.792 1.00 0.00 O ATOM 0 H GLU A 55 11.179 -11.928 10.965 1.00 0.00 H new ATOM 0 HA GLU A 55 10.835 -11.615 8.247 1.00 0.00 H new ATOM 0 HB2 GLU A 55 11.071 -14.171 9.883 1.00 0.00 H new ATOM 0 HB3 GLU A 55 11.321 -14.069 8.152 1.00 0.00 H new ATOM 0 HG2 GLU A 55 12.921 -12.273 9.956 1.00 0.00 H new ATOM 0 HG3 GLU A 55 13.353 -13.968 9.850 1.00 0.00 H new ATOM 799 N GLY A 56 8.898 -13.257 7.455 1.00 0.00 N ATOM 800 CA GLY A 56 7.592 -13.710 7.013 1.00 0.00 C ATOM 801 C GLY A 56 7.411 -15.206 7.182 1.00 0.00 C ATOM 802 O GLY A 56 7.038 -15.905 6.238 1.00 0.00 O ATOM 0 H GLY A 56 9.646 -13.372 6.771 1.00 0.00 H new ATOM 0 HA2 GLY A 56 6.819 -13.187 7.577 1.00 0.00 H new ATOM 0 HA3 GLY A 56 7.455 -13.446 5.964 1.00 0.00 H new ATOM 806 N THR A 57 7.676 -15.701 8.387 1.00 0.00 N ATOM 807 CA THR A 57 7.542 -17.123 8.675 1.00 0.00 C ATOM 808 C THR A 57 6.095 -17.581 8.525 1.00 0.00 C ATOM 809 O THR A 57 5.776 -18.386 7.650 1.00 0.00 O ATOM 810 CB THR A 57 8.028 -17.456 10.099 1.00 0.00 C ATOM 811 OG1 THR A 57 9.417 -17.131 10.230 1.00 0.00 O ATOM 812 CG2 THR A 57 7.815 -18.929 10.413 1.00 0.00 C ATOM 0 H THR A 57 7.985 -15.138 9.179 1.00 0.00 H new ATOM 0 HA THR A 57 8.165 -17.651 7.953 1.00 0.00 H new ATOM 0 HB THR A 57 7.448 -16.863 10.806 1.00 0.00 H new ATOM 0 HG1 THR A 57 9.718 -17.344 11.138 1.00 0.00 H new ATOM 0 HG21 THR A 57 8.166 -19.140 11.423 1.00 0.00 H new ATOM 0 HG22 THR A 57 6.754 -19.167 10.340 1.00 0.00 H new ATOM 0 HG23 THR A 57 8.373 -19.537 9.701 1.00 0.00 H new ATOM 820 N LEU A 58 5.224 -17.063 9.384 1.00 0.00 N ATOM 821 CA LEU A 58 3.809 -17.419 9.347 1.00 0.00 C ATOM 822 C LEU A 58 2.968 -16.385 10.089 1.00 0.00 C ATOM 823 O LEU A 58 1.885 -16.692 10.588 1.00 0.00 O ATOM 824 CB LEU A 58 3.595 -18.803 9.961 1.00 0.00 C ATOM 825 CG LEU A 58 2.369 -19.573 9.468 1.00 0.00 C ATOM 826 CD1 LEU A 58 2.792 -20.839 8.740 1.00 0.00 C ATOM 827 CD2 LEU A 58 1.447 -19.907 10.631 1.00 0.00 C ATOM 0 H LEU A 58 5.472 -16.396 10.114 1.00 0.00 H new ATOM 0 HA LEU A 58 3.491 -17.438 8.304 1.00 0.00 H new ATOM 0 HB2 LEU A 58 4.481 -19.406 9.765 1.00 0.00 H new ATOM 0 HB3 LEU A 58 3.518 -18.691 11.043 1.00 0.00 H new ATOM 0 HG LEU A 58 1.823 -18.941 8.768 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.907 -21.374 8.396 1.00 0.00 H new ATOM 0 HD12 LEU A 58 3.412 -20.576 7.883 1.00 0.00 H new ATOM 0 HD13 LEU A 58 3.360 -21.476 9.418 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.580 -20.455 10.262 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.983 -20.521 11.355 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.117 -18.985 11.110 1.00 0.00 H new ATOM 839 N LEU A 59 3.472 -15.157 10.155 1.00 0.00 N ATOM 840 CA LEU A 59 2.767 -14.076 10.834 1.00 0.00 C ATOM 841 C LEU A 59 1.318 -13.991 10.363 1.00 0.00 C ATOM 842 O LEU A 59 0.880 -14.779 9.524 1.00 0.00 O ATOM 843 CB LEU A 59 3.474 -12.744 10.586 1.00 0.00 C ATOM 844 CG LEU A 59 4.152 -12.587 9.223 1.00 0.00 C ATOM 845 CD1 LEU A 59 3.222 -13.042 8.109 1.00 0.00 C ATOM 846 CD2 LEU A 59 4.582 -11.144 9.005 1.00 0.00 C ATOM 0 H LEU A 59 4.366 -14.886 9.746 1.00 0.00 H new ATOM 0 HA LEU A 59 2.771 -14.288 11.903 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.745 -11.942 10.701 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.227 -12.605 11.362 1.00 0.00 H new ATOM 0 HG LEU A 59 5.041 -13.217 9.206 1.00 0.00 H new ATOM 0 HD11 LEU A 59 3.721 -12.923 7.147 1.00 0.00 H new ATOM 0 HD12 LEU A 59 2.963 -14.091 8.256 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.314 -12.439 8.124 1.00 0.00 H new ATOM 0 HD21 LEU A 59 5.062 -11.051 8.031 1.00 0.00 H new ATOM 0 HD22 LEU A 59 3.708 -10.494 9.042 1.00 0.00 H new ATOM 0 HD23 LEU A 59 5.285 -10.852 9.785 1.00 0.00 H new ATOM 858 N LEU A 60 0.580 -13.031 10.908 1.00 0.00 N ATOM 859 CA LEU A 60 -0.820 -12.841 10.543 1.00 0.00 C ATOM 860 C LEU A 60 -0.969 -11.715 9.524 1.00 0.00 C ATOM 861 O LEU A 60 -1.646 -11.868 8.508 1.00 0.00 O ATOM 862 CB LEU A 60 -1.655 -12.533 11.787 1.00 0.00 C ATOM 863 CG LEU A 60 -2.530 -13.674 12.307 1.00 0.00 C ATOM 864 CD1 LEU A 60 -2.683 -13.584 13.817 1.00 0.00 C ATOM 865 CD2 LEU A 60 -3.892 -13.653 11.629 1.00 0.00 C ATOM 0 H LEU A 60 0.927 -12.372 11.604 1.00 0.00 H new ATOM 0 HA LEU A 60 -1.181 -13.765 10.091 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.980 -12.226 12.586 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -2.297 -11.680 11.567 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.042 -14.619 12.068 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -3.309 -14.404 14.169 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.702 -13.649 14.287 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -3.148 -12.634 14.080 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.501 -14.472 12.011 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -4.387 -12.705 11.837 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.764 -13.767 10.553 1.00 0.00 H new ATOM 877 N SER A 61 -0.329 -10.583 9.804 1.00 0.00 N ATOM 878 CA SER A 61 -0.392 -9.430 8.913 1.00 0.00 C ATOM 879 C SER A 61 0.992 -8.816 8.721 1.00 0.00 C ATOM 880 O SER A 61 1.878 -8.980 9.561 1.00 0.00 O ATOM 881 CB SER A 61 -1.356 -8.381 9.470 1.00 0.00 C ATOM 882 OG SER A 61 -1.214 -8.254 10.874 1.00 0.00 O ATOM 0 H SER A 61 0.238 -10.440 10.640 1.00 0.00 H new ATOM 0 HA SER A 61 -0.757 -9.770 7.944 1.00 0.00 H new ATOM 0 HB2 SER A 61 -1.167 -7.419 8.994 1.00 0.00 H new ATOM 0 HB3 SER A 61 -2.382 -8.660 9.229 1.00 0.00 H new ATOM 0 HG SER A 61 -1.839 -7.577 11.206 1.00 0.00 H new ATOM 888 N ARG A 62 1.169 -8.109 7.610 1.00 0.00 N ATOM 889 CA ARG A 62 2.444 -7.472 7.306 1.00 0.00 C ATOM 890 C ARG A 62 2.409 -5.988 7.660 1.00 0.00 C ATOM 891 O ARG A 62 1.350 -5.436 7.962 1.00 0.00 O ATOM 892 CB ARG A 62 2.785 -7.645 5.825 1.00 0.00 C ATOM 893 CG ARG A 62 3.469 -8.964 5.507 1.00 0.00 C ATOM 894 CD ARG A 62 4.979 -8.804 5.424 1.00 0.00 C ATOM 895 NE ARG A 62 5.624 -9.985 4.856 1.00 0.00 N ATOM 896 CZ ARG A 62 6.941 -10.154 4.813 1.00 0.00 C ATOM 897 NH1 ARG A 62 7.748 -9.223 5.303 1.00 0.00 N ATOM 898 NH2 ARG A 62 7.453 -11.255 4.279 1.00 0.00 N ATOM 0 H ARG A 62 0.446 -7.963 6.906 1.00 0.00 H new ATOM 0 HA ARG A 62 3.214 -7.954 7.908 1.00 0.00 H new ATOM 0 HB2 ARG A 62 1.869 -7.570 5.239 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.432 -6.825 5.512 1.00 0.00 H new ATOM 0 HG2 ARG A 62 3.222 -9.697 6.274 1.00 0.00 H new ATOM 0 HG3 ARG A 62 3.091 -9.352 4.561 1.00 0.00 H new ATOM 0 HD2 ARG A 62 5.218 -7.932 4.815 1.00 0.00 H new ATOM 0 HD3 ARG A 62 5.379 -8.616 6.420 1.00 0.00 H new ATOM 0 HE ARG A 62 5.031 -10.720 4.471 1.00 0.00 H new ATOM 0 HH11 ARG A 62 7.358 -8.375 5.714 1.00 0.00 H new ATOM 0 HH12 ARG A 62 8.759 -9.355 5.269 1.00 0.00 H new ATOM 0 HH21 ARG A 62 6.835 -11.973 3.901 1.00 0.00 H new ATOM 0 HH22 ARG A 62 8.464 -11.383 4.247 1.00 0.00 H new ATOM 912 N LEU A 63 3.572 -5.348 7.624 1.00 0.00 N ATOM 913 CA LEU A 63 3.675 -3.928 7.941 1.00 0.00 C ATOM 914 C LEU A 63 4.404 -3.173 6.834 1.00 0.00 C ATOM 915 O LEU A 63 5.198 -3.753 6.094 1.00 0.00 O ATOM 916 CB LEU A 63 4.405 -3.734 9.272 1.00 0.00 C ATOM 917 CG LEU A 63 3.852 -2.641 10.187 1.00 0.00 C ATOM 918 CD1 LEU A 63 4.505 -2.713 11.559 1.00 0.00 C ATOM 919 CD2 LEU A 63 4.062 -1.268 9.566 1.00 0.00 C ATOM 0 H LEU A 63 4.458 -5.790 7.378 1.00 0.00 H new ATOM 0 HA LEU A 63 2.665 -3.526 8.025 1.00 0.00 H new ATOM 0 HB2 LEU A 63 4.386 -4.679 9.815 1.00 0.00 H new ATOM 0 HB3 LEU A 63 5.450 -3.509 9.061 1.00 0.00 H new ATOM 0 HG LEU A 63 2.781 -2.803 10.308 1.00 0.00 H new ATOM 0 HD11 LEU A 63 4.099 -1.928 12.197 1.00 0.00 H new ATOM 0 HD12 LEU A 63 4.303 -3.686 12.008 1.00 0.00 H new ATOM 0 HD13 LEU A 63 5.582 -2.577 11.457 1.00 0.00 H new ATOM 0 HD21 LEU A 63 3.662 -0.503 10.231 1.00 0.00 H new ATOM 0 HD22 LEU A 63 5.128 -1.096 9.414 1.00 0.00 H new ATOM 0 HD23 LEU A 63 3.547 -1.220 8.607 1.00 0.00 H new ATOM 931 N ILE A 64 4.130 -1.877 6.728 1.00 0.00 N ATOM 932 CA ILE A 64 4.762 -1.043 5.714 1.00 0.00 C ATOM 933 C ILE A 64 5.375 0.208 6.335 1.00 0.00 C ATOM 934 O ILE A 64 4.914 0.690 7.371 1.00 0.00 O ATOM 935 CB ILE A 64 3.758 -0.624 4.625 1.00 0.00 C ATOM 936 CG1 ILE A 64 3.233 -1.854 3.883 1.00 0.00 C ATOM 937 CG2 ILE A 64 4.407 0.350 3.653 1.00 0.00 C ATOM 938 CD1 ILE A 64 4.195 -2.393 2.849 1.00 0.00 C ATOM 0 H ILE A 64 3.474 -1.382 7.332 1.00 0.00 H new ATOM 0 HA ILE A 64 5.550 -1.642 5.258 1.00 0.00 H new ATOM 0 HB ILE A 64 2.915 -0.124 5.102 1.00 0.00 H new ATOM 0 HG12 ILE A 64 3.014 -2.639 4.607 1.00 0.00 H new ATOM 0 HG13 ILE A 64 2.293 -1.599 3.394 1.00 0.00 H new ATOM 0 HG21 ILE A 64 3.685 0.637 2.889 1.00 0.00 H new ATOM 0 HG22 ILE A 64 4.736 1.238 4.193 1.00 0.00 H new ATOM 0 HG23 ILE A 64 5.266 -0.126 3.180 1.00 0.00 H new ATOM 0 HD11 ILE A 64 3.756 -3.264 2.363 1.00 0.00 H new ATOM 0 HD12 ILE A 64 4.396 -1.624 2.103 1.00 0.00 H new ATOM 0 HD13 ILE A 64 5.128 -2.680 3.334 1.00 0.00 H new ATOM 950 N LYS A 65 6.414 0.731 5.695 1.00 0.00 N ATOM 951 CA LYS A 65 7.089 1.928 6.180 1.00 0.00 C ATOM 952 C LYS A 65 7.224 2.966 5.070 1.00 0.00 C ATOM 953 O LYS A 65 8.024 2.802 4.149 1.00 0.00 O ATOM 954 CB LYS A 65 8.472 1.571 6.729 1.00 0.00 C ATOM 955 CG LYS A 65 8.506 1.416 8.240 1.00 0.00 C ATOM 956 CD LYS A 65 9.722 0.626 8.692 1.00 0.00 C ATOM 957 CE LYS A 65 9.334 -0.755 9.197 1.00 0.00 C ATOM 958 NZ LYS A 65 10.510 -1.665 9.285 1.00 0.00 N ATOM 0 H LYS A 65 6.808 0.344 4.837 1.00 0.00 H new ATOM 0 HA LYS A 65 6.485 2.355 6.981 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.807 0.641 6.269 1.00 0.00 H new ATOM 0 HB3 LYS A 65 9.181 2.345 6.436 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.516 2.401 8.708 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.599 0.913 8.576 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.422 0.528 7.862 1.00 0.00 H new ATOM 0 HD3 LYS A 65 10.238 1.171 9.482 1.00 0.00 H new ATOM 0 HE2 LYS A 65 8.870 -0.665 10.179 1.00 0.00 H new ATOM 0 HE3 LYS A 65 8.588 -1.189 8.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 10.305 -2.434 9.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 10.709 -2.067 8.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 11.339 -1.130 9.615 1.00 0.00 H new ATOM 972 N ILE A 66 6.438 4.033 5.165 1.00 0.00 N ATOM 973 CA ILE A 66 6.472 5.097 4.169 1.00 0.00 C ATOM 974 C ILE A 66 7.287 6.287 4.665 1.00 0.00 C ATOM 975 O ILE A 66 7.041 6.811 5.751 1.00 0.00 O ATOM 976 CB ILE A 66 5.052 5.575 3.809 1.00 0.00 C ATOM 977 CG1 ILE A 66 4.169 4.383 3.436 1.00 0.00 C ATOM 978 CG2 ILE A 66 5.107 6.579 2.666 1.00 0.00 C ATOM 979 CD1 ILE A 66 2.793 4.433 4.063 1.00 0.00 C ATOM 0 H ILE A 66 5.770 4.184 5.921 1.00 0.00 H new ATOM 0 HA ILE A 66 6.944 4.682 3.278 1.00 0.00 H new ATOM 0 HB ILE A 66 4.617 6.067 4.679 1.00 0.00 H new ATOM 0 HG12 ILE A 66 4.065 4.343 2.352 1.00 0.00 H new ATOM 0 HG13 ILE A 66 4.666 3.463 3.742 1.00 0.00 H new ATOM 0 HG21 ILE A 66 4.097 6.908 2.422 1.00 0.00 H new ATOM 0 HG22 ILE A 66 5.707 7.439 2.965 1.00 0.00 H new ATOM 0 HG23 ILE A 66 5.557 6.110 1.791 1.00 0.00 H new ATOM 0 HD11 ILE A 66 2.221 3.557 3.756 1.00 0.00 H new ATOM 0 HD12 ILE A 66 2.888 4.442 5.149 1.00 0.00 H new ATOM 0 HD13 ILE A 66 2.277 5.336 3.737 1.00 0.00 H new ATOM 991 N SER A 67 8.256 6.709 3.859 1.00 0.00 N ATOM 992 CA SER A 67 9.109 7.837 4.216 1.00 0.00 C ATOM 993 C SER A 67 9.312 8.764 3.022 1.00 0.00 C ATOM 994 O SER A 67 9.302 8.326 1.873 1.00 0.00 O ATOM 995 CB SER A 67 10.462 7.339 4.726 1.00 0.00 C ATOM 996 OG SER A 67 10.979 6.320 3.887 1.00 0.00 O ATOM 0 H SER A 67 8.470 6.287 2.955 1.00 0.00 H new ATOM 0 HA SER A 67 8.614 8.398 5.009 1.00 0.00 H new ATOM 0 HB2 SER A 67 11.166 8.170 4.770 1.00 0.00 H new ATOM 0 HB3 SER A 67 10.354 6.958 5.742 1.00 0.00 H new ATOM 0 HG SER A 67 11.845 6.019 4.233 1.00 0.00 H new ATOM 1002 N GLY A 68 9.495 10.052 3.304 1.00 0.00 N ATOM 1003 CA GLY A 68 9.697 11.020 2.243 1.00 0.00 C ATOM 1004 C GLY A 68 9.099 12.374 2.574 1.00 0.00 C ATOM 1005 O GLY A 68 8.868 12.692 3.741 1.00 0.00 O ATOM 0 H GLY A 68 9.507 10.440 4.247 1.00 0.00 H new ATOM 0 HA2 GLY A 68 10.765 11.133 2.057 1.00 0.00 H new ATOM 0 HA3 GLY A 68 9.251 10.644 1.322 1.00 0.00 H new ATOM 1009 N THR A 69 8.847 13.176 1.543 1.00 0.00 N ATOM 1010 CA THR A 69 8.276 14.503 1.729 1.00 0.00 C ATOM 1011 C THR A 69 6.767 14.429 1.932 1.00 0.00 C ATOM 1012 O THR A 69 6.104 13.539 1.399 1.00 0.00 O ATOM 1013 CB THR A 69 8.577 15.419 0.528 1.00 0.00 C ATOM 1014 OG1 THR A 69 8.823 14.628 -0.640 1.00 0.00 O ATOM 1015 CG2 THR A 69 9.781 16.304 0.810 1.00 0.00 C ATOM 0 H THR A 69 9.030 12.928 0.571 1.00 0.00 H new ATOM 0 HA THR A 69 8.740 14.923 2.621 1.00 0.00 H new ATOM 0 HB THR A 69 7.710 16.057 0.359 1.00 0.00 H new ATOM 0 HG1 THR A 69 9.012 15.217 -1.400 1.00 0.00 H new ATOM 0 HG21 THR A 69 9.974 16.942 -0.053 1.00 0.00 H new ATOM 0 HG22 THR A 69 9.580 16.925 1.683 1.00 0.00 H new ATOM 0 HG23 THR A 69 10.654 15.680 1.002 1.00 0.00 H new ATOM 1023 N GLN A 70 6.230 15.368 2.703 1.00 0.00 N ATOM 1024 CA GLN A 70 4.798 15.407 2.974 1.00 0.00 C ATOM 1025 C GLN A 70 3.995 15.208 1.693 1.00 0.00 C ATOM 1026 O GLN A 70 2.839 14.787 1.731 1.00 0.00 O ATOM 1027 CB GLN A 70 4.417 16.738 3.627 1.00 0.00 C ATOM 1028 CG GLN A 70 2.997 16.764 4.171 1.00 0.00 C ATOM 1029 CD GLN A 70 2.866 16.036 5.493 1.00 0.00 C ATOM 1030 OE1 GLN A 70 3.653 16.251 6.416 1.00 0.00 O ATOM 1031 NE2 GLN A 70 1.867 15.167 5.593 1.00 0.00 N ATOM 0 H GLN A 70 6.765 16.112 3.151 1.00 0.00 H new ATOM 0 HA GLN A 70 4.562 14.593 3.659 1.00 0.00 H new ATOM 0 HB2 GLN A 70 5.113 16.947 4.440 1.00 0.00 H new ATOM 0 HB3 GLN A 70 4.532 17.538 2.896 1.00 0.00 H new ATOM 0 HG2 GLN A 70 2.679 17.799 4.297 1.00 0.00 H new ATOM 0 HG3 GLN A 70 2.325 16.311 3.443 1.00 0.00 H new ATOM 0 HE21 GLN A 70 1.238 15.020 4.803 1.00 0.00 H new ATOM 0 HE22 GLN A 70 1.728 14.647 6.459 1.00 0.00 H new ATOM 1040 N LYS A 71 4.616 15.513 0.559 1.00 0.00 N ATOM 1041 CA LYS A 71 3.961 15.366 -0.736 1.00 0.00 C ATOM 1042 C LYS A 71 3.888 13.899 -1.145 1.00 0.00 C ATOM 1043 O LYS A 71 2.887 13.450 -1.704 1.00 0.00 O ATOM 1044 CB LYS A 71 4.710 16.168 -1.803 1.00 0.00 C ATOM 1045 CG LYS A 71 4.412 17.657 -1.765 1.00 0.00 C ATOM 1046 CD LYS A 71 5.633 18.479 -2.143 1.00 0.00 C ATOM 1047 CE LYS A 71 5.402 19.963 -1.900 1.00 0.00 C ATOM 1048 NZ LYS A 71 5.790 20.786 -3.079 1.00 0.00 N ATOM 0 H LYS A 71 5.573 15.864 0.510 1.00 0.00 H new ATOM 0 HA LYS A 71 2.945 15.751 -0.648 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.782 16.017 -1.673 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.450 15.779 -2.787 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.594 17.883 -2.449 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.079 17.937 -0.766 1.00 0.00 H new ATOM 0 HD2 LYS A 71 6.493 18.144 -1.563 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.873 18.314 -3.193 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.351 20.134 -1.668 1.00 0.00 H new ATOM 0 HE3 LYS A 71 5.976 20.282 -1.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 5.617 21.791 -2.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 6.799 20.643 -3.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 5.225 20.500 -3.904 1.00 0.00 H new ATOM 1062 N GLU A 72 4.955 13.156 -0.864 1.00 0.00 N ATOM 1063 CA GLU A 72 5.009 11.739 -1.203 1.00 0.00 C ATOM 1064 C GLU A 72 4.365 10.892 -0.109 1.00 0.00 C ATOM 1065 O GLU A 72 3.312 10.290 -0.314 1.00 0.00 O ATOM 1066 CB GLU A 72 6.458 11.299 -1.419 1.00 0.00 C ATOM 1067 CG GLU A 72 7.285 12.293 -2.216 1.00 0.00 C ATOM 1068 CD GLU A 72 6.678 12.601 -3.572 1.00 0.00 C ATOM 1069 OE1 GLU A 72 5.495 12.996 -3.617 1.00 0.00 O ATOM 1070 OE2 GLU A 72 7.389 12.447 -4.587 1.00 0.00 O ATOM 0 H GLU A 72 5.792 13.512 -0.403 1.00 0.00 H new ATOM 0 HA GLU A 72 4.451 11.591 -2.127 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.930 11.143 -0.449 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.464 10.339 -1.935 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.383 13.218 -1.647 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.291 11.896 -2.354 1.00 0.00 H new ATOM 1077 N VAL A 73 5.008 10.852 1.054 1.00 0.00 N ATOM 1078 CA VAL A 73 4.500 10.080 2.181 1.00 0.00 C ATOM 1079 C VAL A 73 2.978 10.149 2.253 1.00 0.00 C ATOM 1080 O VAL A 73 2.324 9.209 2.704 1.00 0.00 O ATOM 1081 CB VAL A 73 5.089 10.578 3.514 1.00 0.00 C ATOM 1082 CG1 VAL A 73 4.552 9.756 4.676 1.00 0.00 C ATOM 1083 CG2 VAL A 73 6.609 10.531 3.474 1.00 0.00 C ATOM 0 H VAL A 73 5.881 11.345 1.240 1.00 0.00 H new ATOM 0 HA VAL A 73 4.807 9.047 2.021 1.00 0.00 H new ATOM 0 HB VAL A 73 4.784 11.614 3.662 1.00 0.00 H new ATOM 0 HG11 VAL A 73 4.979 10.123 5.609 1.00 0.00 H new ATOM 0 HG12 VAL A 73 3.466 9.846 4.714 1.00 0.00 H new ATOM 0 HG13 VAL A 73 4.825 8.710 4.538 1.00 0.00 H new ATOM 0 HG21 VAL A 73 7.009 10.886 4.424 1.00 0.00 H new ATOM 0 HG22 VAL A 73 6.937 9.506 3.303 1.00 0.00 H new ATOM 0 HG23 VAL A 73 6.972 11.167 2.667 1.00 0.00 H new ATOM 1093 N ALA A 74 2.421 11.271 1.806 1.00 0.00 N ATOM 1094 CA ALA A 74 0.976 11.462 1.819 1.00 0.00 C ATOM 1095 C ALA A 74 0.333 10.867 0.570 1.00 0.00 C ATOM 1096 O ALA A 74 -0.732 10.257 0.641 1.00 0.00 O ATOM 1097 CB ALA A 74 0.641 12.942 1.933 1.00 0.00 C ATOM 0 H ALA A 74 2.948 12.060 1.431 1.00 0.00 H new ATOM 0 HA ALA A 74 0.573 10.941 2.687 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -0.441 13.070 1.942 1.00 0.00 H new ATOM 0 HB2 ALA A 74 1.061 13.340 2.857 1.00 0.00 H new ATOM 0 HB3 ALA A 74 1.063 13.477 1.082 1.00 0.00 H new ATOM 1103 N ALA A 75 0.988 11.052 -0.572 1.00 0.00 N ATOM 1104 CA ALA A 75 0.480 10.532 -1.836 1.00 0.00 C ATOM 1105 C ALA A 75 0.637 9.017 -1.909 1.00 0.00 C ATOM 1106 O ALA A 75 -0.332 8.294 -2.140 1.00 0.00 O ATOM 1107 CB ALA A 75 1.194 11.195 -3.004 1.00 0.00 C ATOM 0 H ALA A 75 1.871 11.558 -0.648 1.00 0.00 H new ATOM 0 HA ALA A 75 -0.583 10.764 -1.895 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.805 10.797 -3.941 1.00 0.00 H new ATOM 0 HB2 ALA A 75 1.027 12.271 -2.969 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.263 10.992 -2.940 1.00 0.00 H new ATOM 1113 N ALA A 76 1.863 8.543 -1.711 1.00 0.00 N ATOM 1114 CA ALA A 76 2.145 7.114 -1.754 1.00 0.00 C ATOM 1115 C ALA A 76 1.159 6.333 -0.893 1.00 0.00 C ATOM 1116 O ALA A 76 0.657 5.285 -1.300 1.00 0.00 O ATOM 1117 CB ALA A 76 3.572 6.844 -1.300 1.00 0.00 C ATOM 0 H ALA A 76 2.676 9.128 -1.519 1.00 0.00 H new ATOM 0 HA ALA A 76 2.032 6.778 -2.785 1.00 0.00 H new ATOM 0 HB1 ALA A 76 3.769 5.773 -1.337 1.00 0.00 H new ATOM 0 HB2 ALA A 76 4.268 7.364 -1.958 1.00 0.00 H new ATOM 0 HB3 ALA A 76 3.703 7.202 -0.279 1.00 0.00 H new ATOM 1123 N LYS A 77 0.882 6.850 0.300 1.00 0.00 N ATOM 1124 CA LYS A 77 -0.046 6.202 1.219 1.00 0.00 C ATOM 1125 C LYS A 77 -1.366 5.884 0.525 1.00 0.00 C ATOM 1126 O LYS A 77 -2.036 4.907 0.861 1.00 0.00 O ATOM 1127 CB LYS A 77 -0.300 7.097 2.435 1.00 0.00 C ATOM 1128 CG LYS A 77 -0.675 6.326 3.689 1.00 0.00 C ATOM 1129 CD LYS A 77 0.083 6.837 4.904 1.00 0.00 C ATOM 1130 CE LYS A 77 -0.834 7.588 5.857 1.00 0.00 C ATOM 1131 NZ LYS A 77 -1.305 8.875 5.275 1.00 0.00 N ATOM 0 H LYS A 77 1.288 7.717 0.653 1.00 0.00 H new ATOM 0 HA LYS A 77 0.404 5.267 1.551 1.00 0.00 H new ATOM 0 HB2 LYS A 77 0.595 7.687 2.635 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -1.099 7.800 2.198 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -1.747 6.414 3.864 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -0.461 5.267 3.544 1.00 0.00 H new ATOM 0 HD2 LYS A 77 0.544 5.998 5.426 1.00 0.00 H new ATOM 0 HD3 LYS A 77 0.890 7.494 4.581 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -1.694 6.964 6.101 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -0.306 7.783 6.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -1.927 9.356 5.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -0.486 9.481 5.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -1.831 8.687 4.398 1.00 0.00 H new ATOM 1145 N HIS A 78 -1.735 6.715 -0.446 1.00 0.00 N ATOM 1146 CA HIS A 78 -2.974 6.520 -1.189 1.00 0.00 C ATOM 1147 C HIS A 78 -2.824 5.397 -2.210 1.00 0.00 C ATOM 1148 O HIS A 78 -3.683 4.518 -2.314 1.00 0.00 O ATOM 1149 CB HIS A 78 -3.381 7.815 -1.894 1.00 0.00 C ATOM 1150 CG HIS A 78 -4.844 7.895 -2.204 1.00 0.00 C ATOM 1151 ND1 HIS A 78 -5.770 8.430 -1.334 1.00 0.00 N ATOM 1152 CD2 HIS A 78 -5.539 7.504 -3.297 1.00 0.00 C ATOM 1153 CE1 HIS A 78 -6.971 8.364 -1.877 1.00 0.00 C ATOM 1154 NE2 HIS A 78 -6.859 7.806 -3.070 1.00 0.00 N ATOM 0 H HIS A 78 -1.193 7.529 -0.736 1.00 0.00 H new ATOM 0 HA HIS A 78 -3.753 6.241 -0.480 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -3.104 8.663 -1.267 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -2.816 7.907 -2.822 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -5.131 7.041 -4.183 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -7.889 8.707 -1.424 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -7.628 7.629 -3.716 1.00 0.00 H new ATOM 1162 N LEU A 79 -1.731 5.430 -2.964 1.00 0.00 N ATOM 1163 CA LEU A 79 -1.469 4.415 -3.978 1.00 0.00 C ATOM 1164 C LEU A 79 -1.364 3.030 -3.349 1.00 0.00 C ATOM 1165 O LEU A 79 -1.783 2.035 -3.941 1.00 0.00 O ATOM 1166 CB LEU A 79 -0.180 4.743 -4.735 1.00 0.00 C ATOM 1167 CG LEU A 79 -0.028 6.189 -5.207 1.00 0.00 C ATOM 1168 CD1 LEU A 79 1.352 6.412 -5.807 1.00 0.00 C ATOM 1169 CD2 LEU A 79 -1.112 6.537 -6.216 1.00 0.00 C ATOM 0 H LEU A 79 -1.011 6.149 -2.892 1.00 0.00 H new ATOM 0 HA LEU A 79 -2.304 4.413 -4.678 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.667 4.501 -4.092 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.117 4.089 -5.605 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.138 6.846 -4.344 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.442 7.447 -6.138 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.114 6.203 -5.056 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.491 5.746 -6.658 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.988 7.570 -6.541 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.034 5.874 -7.077 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.092 6.417 -5.753 1.00 0.00 H new ATOM 1181 N ILE A 80 -0.805 2.974 -2.144 1.00 0.00 N ATOM 1182 CA ILE A 80 -0.650 1.711 -1.433 1.00 0.00 C ATOM 1183 C ILE A 80 -2.005 1.087 -1.117 1.00 0.00 C ATOM 1184 O ILE A 80 -2.266 -0.066 -1.461 1.00 0.00 O ATOM 1185 CB ILE A 80 0.136 1.897 -0.122 1.00 0.00 C ATOM 1186 CG1 ILE A 80 1.488 2.553 -0.400 1.00 0.00 C ATOM 1187 CG2 ILE A 80 0.323 0.559 0.578 1.00 0.00 C ATOM 1188 CD1 ILE A 80 2.001 3.395 0.747 1.00 0.00 C ATOM 0 H ILE A 80 -0.452 3.788 -1.641 1.00 0.00 H new ATOM 0 HA ILE A 80 -0.092 1.045 -2.091 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.435 2.552 0.536 1.00 0.00 H new ATOM 0 HG12 ILE A 80 2.219 1.777 -0.625 1.00 0.00 H new ATOM 0 HG13 ILE A 80 1.403 3.178 -1.289 1.00 0.00 H new ATOM 0 HG21 ILE A 80 0.880 0.707 1.503 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -0.652 0.129 0.807 1.00 0.00 H new ATOM 0 HG23 ILE A 80 0.875 -0.119 -0.074 1.00 0.00 H new ATOM 0 HD11 ILE A 80 2.964 3.829 0.478 1.00 0.00 H new ATOM 0 HD12 ILE A 80 1.290 4.194 0.959 1.00 0.00 H new ATOM 0 HD13 ILE A 80 2.119 2.770 1.632 1.00 0.00 H new ATOM 1200 N LEU A 81 -2.866 1.857 -0.462 1.00 0.00 N ATOM 1201 CA LEU A 81 -4.198 1.381 -0.100 1.00 0.00 C ATOM 1202 C LEU A 81 -4.968 0.931 -1.336 1.00 0.00 C ATOM 1203 O LEU A 81 -5.752 -0.016 -1.278 1.00 0.00 O ATOM 1204 CB LEU A 81 -4.974 2.481 0.627 1.00 0.00 C ATOM 1205 CG LEU A 81 -5.014 2.379 2.152 1.00 0.00 C ATOM 1206 CD1 LEU A 81 -5.008 3.764 2.780 1.00 0.00 C ATOM 1207 CD2 LEU A 81 -6.238 1.593 2.601 1.00 0.00 C ATOM 0 H LEU A 81 -2.667 2.814 -0.170 1.00 0.00 H new ATOM 0 HA LEU A 81 -4.084 0.526 0.566 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -4.538 3.443 0.359 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -5.999 2.481 0.256 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.123 1.848 2.486 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.037 3.671 3.866 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.102 4.293 2.485 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.881 4.321 2.440 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -6.251 1.530 3.689 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.141 2.097 2.256 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.200 0.588 2.180 1.00 0.00 H new ATOM 1219 N GLU A 82 -4.738 1.614 -2.453 1.00 0.00 N ATOM 1220 CA GLU A 82 -5.411 1.281 -3.704 1.00 0.00 C ATOM 1221 C GLU A 82 -5.254 -0.201 -4.028 1.00 0.00 C ATOM 1222 O GLU A 82 -6.117 -0.804 -4.668 1.00 0.00 O ATOM 1223 CB GLU A 82 -4.851 2.126 -4.850 1.00 0.00 C ATOM 1224 CG GLU A 82 -5.181 3.605 -4.732 1.00 0.00 C ATOM 1225 CD GLU A 82 -5.742 4.182 -6.018 1.00 0.00 C ATOM 1226 OE1 GLU A 82 -6.840 3.752 -6.430 1.00 0.00 O ATOM 1227 OE2 GLU A 82 -5.084 5.062 -6.610 1.00 0.00 O ATOM 0 H GLU A 82 -4.092 2.400 -2.518 1.00 0.00 H new ATOM 0 HA GLU A 82 -6.472 1.499 -3.585 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -3.768 2.005 -4.884 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -5.244 1.749 -5.794 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -5.903 3.749 -3.928 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -4.281 4.153 -4.454 1.00 0.00 H new ATOM 1234 N LYS A 83 -4.147 -0.785 -3.582 1.00 0.00 N ATOM 1235 CA LYS A 83 -3.875 -2.197 -3.823 1.00 0.00 C ATOM 1236 C LYS A 83 -4.620 -3.074 -2.821 1.00 0.00 C ATOM 1237 O LYS A 83 -5.027 -4.191 -3.141 1.00 0.00 O ATOM 1238 CB LYS A 83 -2.372 -2.471 -3.737 1.00 0.00 C ATOM 1239 CG LYS A 83 -1.626 -2.187 -5.029 1.00 0.00 C ATOM 1240 CD LYS A 83 -1.374 -0.701 -5.213 1.00 0.00 C ATOM 1241 CE LYS A 83 -0.793 -0.399 -6.586 1.00 0.00 C ATOM 1242 NZ LYS A 83 -1.808 -0.551 -7.664 1.00 0.00 N ATOM 0 H LYS A 83 -3.423 -0.301 -3.051 1.00 0.00 H new ATOM 0 HA LYS A 83 -4.226 -2.442 -4.825 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -1.945 -1.862 -2.940 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.217 -3.514 -3.460 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -0.675 -2.720 -5.026 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -2.202 -2.566 -5.873 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -2.308 -0.154 -5.084 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -0.689 -0.349 -4.442 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -0.400 0.618 -6.598 1.00 0.00 H new ATOM 0 HE3 LYS A 83 0.046 -1.067 -6.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -1.426 -0.177 -8.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -2.040 -1.558 -7.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -2.668 -0.025 -7.408 1.00 0.00 H new ATOM 1256 N VAL A 84 -4.797 -2.559 -1.609 1.00 0.00 N ATOM 1257 CA VAL A 84 -5.496 -3.294 -0.561 1.00 0.00 C ATOM 1258 C VAL A 84 -6.962 -3.508 -0.924 1.00 0.00 C ATOM 1259 O VAL A 84 -7.527 -4.569 -0.664 1.00 0.00 O ATOM 1260 CB VAL A 84 -5.415 -2.558 0.790 1.00 0.00 C ATOM 1261 CG1 VAL A 84 -6.134 -3.348 1.872 1.00 0.00 C ATOM 1262 CG2 VAL A 84 -3.965 -2.309 1.174 1.00 0.00 C ATOM 0 H VAL A 84 -4.466 -1.636 -1.328 1.00 0.00 H new ATOM 0 HA VAL A 84 -5.002 -4.262 -0.469 1.00 0.00 H new ATOM 0 HB VAL A 84 -5.911 -1.593 0.689 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -6.066 -2.813 2.819 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -7.182 -3.470 1.598 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -5.670 -4.329 1.976 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -3.926 -1.788 2.131 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -3.442 -3.262 1.258 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -3.486 -1.698 0.409 1.00 0.00 H new ATOM 1272 N SER A 85 -7.571 -2.492 -1.526 1.00 0.00 N ATOM 1273 CA SER A 85 -8.972 -2.567 -1.922 1.00 0.00 C ATOM 1274 C SER A 85 -9.149 -3.495 -3.119 1.00 0.00 C ATOM 1275 O SER A 85 -10.166 -4.178 -3.243 1.00 0.00 O ATOM 1276 CB SER A 85 -9.504 -1.173 -2.260 1.00 0.00 C ATOM 1277 OG SER A 85 -10.533 -1.242 -3.233 1.00 0.00 O ATOM 0 H SER A 85 -7.116 -1.607 -1.750 1.00 0.00 H new ATOM 0 HA SER A 85 -9.540 -2.971 -1.084 1.00 0.00 H new ATOM 0 HB2 SER A 85 -9.885 -0.697 -1.357 1.00 0.00 H new ATOM 0 HB3 SER A 85 -8.690 -0.550 -2.630 1.00 0.00 H new ATOM 0 HG SER A 85 -10.857 -0.339 -3.431 1.00 0.00 H new ATOM 1283 N GLU A 86 -8.152 -3.513 -3.999 1.00 0.00 N ATOM 1284 CA GLU A 86 -8.198 -4.358 -5.187 1.00 0.00 C ATOM 1285 C GLU A 86 -8.397 -5.822 -4.807 1.00 0.00 C ATOM 1286 O GLU A 86 -9.370 -6.454 -5.217 1.00 0.00 O ATOM 1287 CB GLU A 86 -6.912 -4.201 -6.001 1.00 0.00 C ATOM 1288 CG GLU A 86 -6.962 -3.060 -7.004 1.00 0.00 C ATOM 1289 CD GLU A 86 -5.701 -2.962 -7.841 1.00 0.00 C ATOM 1290 OE1 GLU A 86 -4.749 -2.285 -7.401 1.00 0.00 O ATOM 1291 OE2 GLU A 86 -5.667 -3.563 -8.934 1.00 0.00 O ATOM 0 H GLU A 86 -7.304 -2.953 -3.912 1.00 0.00 H new ATOM 0 HA GLU A 86 -9.046 -4.041 -5.795 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -6.078 -4.038 -5.319 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -6.712 -5.132 -6.532 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -7.820 -3.197 -7.662 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -7.115 -2.121 -6.473 1.00 0.00 H new ATOM 1298 N ASP A 87 -7.467 -6.354 -4.022 1.00 0.00 N ATOM 1299 CA ASP A 87 -7.539 -7.744 -3.586 1.00 0.00 C ATOM 1300 C ASP A 87 -8.740 -7.965 -2.671 1.00 0.00 C ATOM 1301 O ASP A 87 -9.537 -8.877 -2.887 1.00 0.00 O ATOM 1302 CB ASP A 87 -6.251 -8.142 -2.863 1.00 0.00 C ATOM 1303 CG ASP A 87 -6.005 -9.637 -2.898 1.00 0.00 C ATOM 1304 OD1 ASP A 87 -6.967 -10.402 -2.682 1.00 0.00 O ATOM 1305 OD2 ASP A 87 -4.849 -10.042 -3.143 1.00 0.00 O ATOM 0 H ASP A 87 -6.655 -5.844 -3.675 1.00 0.00 H new ATOM 0 HA ASP A 87 -7.658 -8.370 -4.470 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.407 -7.627 -3.321 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -6.302 -7.809 -1.826 1.00 0.00 H new ATOM 1310 N GLU A 88 -8.861 -7.125 -1.648 1.00 0.00 N ATOM 1311 CA GLU A 88 -9.963 -7.230 -0.699 1.00 0.00 C ATOM 1312 C GLU A 88 -11.273 -7.533 -1.420 1.00 0.00 C ATOM 1313 O GLU A 88 -12.131 -8.243 -0.896 1.00 0.00 O ATOM 1314 CB GLU A 88 -10.099 -5.936 0.105 1.00 0.00 C ATOM 1315 CG GLU A 88 -11.517 -5.655 0.574 1.00 0.00 C ATOM 1316 CD GLU A 88 -11.629 -4.357 1.347 1.00 0.00 C ATOM 1317 OE1 GLU A 88 -11.018 -3.356 0.921 1.00 0.00 O ATOM 1318 OE2 GLU A 88 -12.330 -4.343 2.381 1.00 0.00 O ATOM 0 H GLU A 88 -8.209 -6.364 -1.455 1.00 0.00 H new ATOM 0 HA GLU A 88 -9.744 -8.051 -0.017 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -9.442 -5.987 0.973 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -9.756 -5.101 -0.506 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -12.181 -5.617 -0.290 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -11.858 -6.478 1.202 1.00 0.00 H new ATOM 1325 N GLU A 89 -11.420 -6.990 -2.625 1.00 0.00 N ATOM 1326 CA GLU A 89 -12.625 -7.201 -3.416 1.00 0.00 C ATOM 1327 C GLU A 89 -12.449 -8.377 -4.373 1.00 0.00 C ATOM 1328 O GLU A 89 -13.264 -9.300 -4.397 1.00 0.00 O ATOM 1329 CB GLU A 89 -12.974 -5.937 -4.203 1.00 0.00 C ATOM 1330 CG GLU A 89 -14.343 -5.369 -3.870 1.00 0.00 C ATOM 1331 CD GLU A 89 -14.982 -4.658 -5.046 1.00 0.00 C ATOM 1332 OE1 GLU A 89 -14.292 -3.840 -5.691 1.00 0.00 O ATOM 1333 OE2 GLU A 89 -16.171 -4.918 -5.322 1.00 0.00 O ATOM 0 H GLU A 89 -10.719 -6.401 -3.074 1.00 0.00 H new ATOM 0 HA GLU A 89 -13.442 -7.431 -2.732 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -12.218 -5.177 -4.007 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -12.933 -6.160 -5.269 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -14.997 -6.176 -3.540 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -14.250 -4.673 -3.036 1.00 0.00 H new ATOM 1340 N LEU A 90 -11.380 -8.337 -5.159 1.00 0.00 N ATOM 1341 CA LEU A 90 -11.096 -9.398 -6.119 1.00 0.00 C ATOM 1342 C LEU A 90 -11.418 -10.767 -5.529 1.00 0.00 C ATOM 1343 O LEU A 90 -11.965 -11.634 -6.211 1.00 0.00 O ATOM 1344 CB LEU A 90 -9.626 -9.347 -6.545 1.00 0.00 C ATOM 1345 CG LEU A 90 -8.745 -10.496 -6.053 1.00 0.00 C ATOM 1346 CD1 LEU A 90 -9.091 -11.784 -6.782 1.00 0.00 C ATOM 1347 CD2 LEU A 90 -7.273 -10.156 -6.237 1.00 0.00 C ATOM 0 H LEU A 90 -10.695 -7.581 -5.151 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.728 -9.242 -6.993 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.585 -9.324 -7.634 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -9.198 -8.410 -6.190 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.933 -10.643 -4.990 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.454 -12.590 -6.419 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -10.135 -12.036 -6.599 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.932 -11.650 -7.852 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -6.661 -10.985 -5.882 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -7.069 -9.981 -7.293 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -7.033 -9.258 -5.668 1.00 0.00 H new ATOM 1359 N ARG A 91 -11.079 -10.953 -4.258 1.00 0.00 N ATOM 1360 CA ARG A 91 -11.334 -12.215 -3.575 1.00 0.00 C ATOM 1361 C ARG A 91 -12.829 -12.423 -3.357 1.00 0.00 C ATOM 1362 O ARG A 91 -13.332 -13.543 -3.447 1.00 0.00 O ATOM 1363 CB ARG A 91 -10.602 -12.251 -2.233 1.00 0.00 C ATOM 1364 CG ARG A 91 -9.099 -12.437 -2.362 1.00 0.00 C ATOM 1365 CD ARG A 91 -8.706 -13.901 -2.231 1.00 0.00 C ATOM 1366 NE ARG A 91 -7.257 -14.077 -2.187 1.00 0.00 N ATOM 1367 CZ ARG A 91 -6.661 -15.144 -1.666 1.00 0.00 C ATOM 1368 NH1 ARG A 91 -7.387 -16.126 -1.149 1.00 0.00 N ATOM 1369 NH2 ARG A 91 -5.337 -15.230 -1.662 1.00 0.00 N ATOM 0 H ARG A 91 -10.627 -10.245 -3.680 1.00 0.00 H new ATOM 0 HA ARG A 91 -10.961 -13.022 -4.206 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -10.800 -11.323 -1.696 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -11.009 -13.062 -1.629 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -8.765 -12.054 -3.327 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -8.592 -11.853 -1.594 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -9.149 -14.316 -1.326 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -9.114 -14.462 -3.072 1.00 0.00 H new ATOM 0 HE ARG A 91 -6.670 -13.340 -2.578 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -8.405 -16.063 -1.151 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -6.927 -16.944 -0.750 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -4.776 -14.477 -2.059 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -4.880 -16.050 -1.262 1.00 0.00 H new ATOM 1383 N LYS A 92 -13.537 -11.335 -3.070 1.00 0.00 N ATOM 1384 CA LYS A 92 -14.976 -11.396 -2.839 1.00 0.00 C ATOM 1385 C LYS A 92 -15.727 -11.627 -4.146 1.00 0.00 C ATOM 1386 O LYS A 92 -16.733 -12.335 -4.178 1.00 0.00 O ATOM 1387 CB LYS A 92 -15.462 -10.104 -2.180 1.00 0.00 C ATOM 1388 CG LYS A 92 -14.953 -9.915 -0.761 1.00 0.00 C ATOM 1389 CD LYS A 92 -16.097 -9.766 0.227 1.00 0.00 C ATOM 1390 CE LYS A 92 -16.354 -8.306 0.567 1.00 0.00 C ATOM 1391 NZ LYS A 92 -15.961 -7.985 1.967 1.00 0.00 N ATOM 0 H LYS A 92 -13.137 -10.400 -2.992 1.00 0.00 H new ATOM 0 HA LYS A 92 -15.177 -12.234 -2.172 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -15.145 -9.255 -2.786 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -16.552 -10.099 -2.170 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -14.336 -10.768 -0.478 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -14.316 -9.032 -0.717 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -17.001 -10.207 -0.192 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -15.866 -10.318 1.138 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -15.798 -7.670 -0.121 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -17.411 -8.081 0.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -16.152 -6.981 2.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -16.510 -8.574 2.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -14.947 -8.175 2.095 1.00 0.00 H new ATOM 1405 N ARG A 93 -15.230 -11.026 -5.223 1.00 0.00 N ATOM 1406 CA ARG A 93 -15.855 -11.166 -6.533 1.00 0.00 C ATOM 1407 C ARG A 93 -15.937 -12.634 -6.941 1.00 0.00 C ATOM 1408 O ARG A 93 -16.829 -13.031 -7.691 1.00 0.00 O ATOM 1409 CB ARG A 93 -15.072 -10.377 -7.582 1.00 0.00 C ATOM 1410 CG ARG A 93 -15.026 -8.882 -7.311 1.00 0.00 C ATOM 1411 CD ARG A 93 -14.373 -8.128 -8.459 1.00 0.00 C ATOM 1412 NE ARG A 93 -13.460 -7.091 -7.984 1.00 0.00 N ATOM 1413 CZ ARG A 93 -12.955 -6.142 -8.764 1.00 0.00 C ATOM 1414 NH1 ARG A 93 -13.273 -6.099 -10.051 1.00 0.00 N ATOM 1415 NH2 ARG A 93 -12.131 -5.234 -8.259 1.00 0.00 N ATOM 0 H ARG A 93 -14.397 -10.438 -5.214 1.00 0.00 H new ATOM 0 HA ARG A 93 -16.867 -10.767 -6.470 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -14.053 -10.761 -7.627 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -15.520 -10.547 -8.561 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -16.038 -8.508 -7.157 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -14.474 -8.695 -6.390 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -13.828 -8.830 -9.090 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -15.145 -7.674 -9.080 1.00 0.00 H new ATOM 0 HE ARG A 93 -13.196 -7.096 -6.999 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -13.906 -6.796 -10.443 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -12.884 -5.369 -10.648 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -11.884 -5.264 -7.270 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -11.744 -4.506 -8.860 1.00 0.00 H new ATOM 1429 N ILE A 94 -15.001 -13.434 -6.443 1.00 0.00 N ATOM 1430 CA ILE A 94 -14.968 -14.858 -6.756 1.00 0.00 C ATOM 1431 C ILE A 94 -15.778 -15.662 -5.744 1.00 0.00 C ATOM 1432 O ILE A 94 -16.532 -16.563 -6.113 1.00 0.00 O ATOM 1433 CB ILE A 94 -13.524 -15.395 -6.784 1.00 0.00 C ATOM 1434 CG1 ILE A 94 -12.624 -14.458 -7.592 1.00 0.00 C ATOM 1435 CG2 ILE A 94 -13.493 -16.800 -7.366 1.00 0.00 C ATOM 1436 CD1 ILE A 94 -11.155 -14.809 -7.506 1.00 0.00 C ATOM 0 H ILE A 94 -14.255 -13.121 -5.821 1.00 0.00 H new ATOM 0 HA ILE A 94 -15.409 -14.974 -7.746 1.00 0.00 H new ATOM 0 HB ILE A 94 -13.148 -15.438 -5.762 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -12.934 -14.481 -8.637 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -12.767 -13.437 -7.239 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -12.466 -17.166 -7.379 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -14.106 -17.461 -6.753 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -13.885 -16.781 -8.383 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -10.577 -14.103 -8.103 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -10.829 -14.758 -6.467 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -10.999 -15.819 -7.886 1.00 0.00 H new ATOM 1448 N ALA A 95 -15.618 -15.329 -4.469 1.00 0.00 N ATOM 1449 CA ALA A 95 -16.338 -16.017 -3.403 1.00 0.00 C ATOM 1450 C ALA A 95 -17.836 -15.740 -3.485 1.00 0.00 C ATOM 1451 O ALA A 95 -18.641 -16.442 -2.874 1.00 0.00 O ATOM 1452 CB ALA A 95 -15.795 -15.600 -2.044 1.00 0.00 C ATOM 0 H ALA A 95 -14.996 -14.587 -4.147 1.00 0.00 H new ATOM 0 HA ALA A 95 -16.186 -17.089 -3.529 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -16.342 -16.121 -1.258 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -14.737 -15.855 -1.981 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -15.917 -14.524 -1.918 1.00 0.00 H new ATOM 1458 N HIS A 96 -18.202 -14.711 -4.243 1.00 0.00 N ATOM 1459 CA HIS A 96 -19.604 -14.341 -4.404 1.00 0.00 C ATOM 1460 C HIS A 96 -20.109 -14.717 -5.793 1.00 0.00 C ATOM 1461 O HIS A 96 -20.638 -13.877 -6.520 1.00 0.00 O ATOM 1462 CB HIS A 96 -19.787 -12.841 -4.170 1.00 0.00 C ATOM 1463 CG HIS A 96 -20.987 -12.507 -3.339 1.00 0.00 C ATOM 1464 ND1 HIS A 96 -22.238 -12.289 -3.876 1.00 0.00 N ATOM 1465 CD2 HIS A 96 -21.123 -12.355 -2.000 1.00 0.00 C ATOM 1466 CE1 HIS A 96 -23.091 -12.016 -2.904 1.00 0.00 C ATOM 1467 NE2 HIS A 96 -22.439 -12.050 -1.756 1.00 0.00 N ATOM 0 H HIS A 96 -17.548 -14.119 -4.755 1.00 0.00 H new ATOM 0 HA HIS A 96 -20.187 -14.890 -3.664 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -18.896 -12.446 -3.682 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -19.871 -12.339 -5.134 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -20.341 -12.455 -1.262 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -24.142 -11.802 -3.028 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -22.847 -11.878 -0.837 1.00 0.00 H new ATOM 1475 N SER A 97 -19.940 -15.984 -6.156 1.00 0.00 N ATOM 1476 CA SER A 97 -20.375 -16.471 -7.460 1.00 0.00 C ATOM 1477 C SER A 97 -19.437 -15.986 -8.562 1.00 0.00 C ATOM 1478 O SER A 97 -18.690 -16.770 -9.145 1.00 0.00 O ATOM 1479 CB SER A 97 -21.804 -16.006 -7.751 1.00 0.00 C ATOM 1480 OG SER A 97 -22.586 -17.062 -8.279 1.00 0.00 O ATOM 0 H SER A 97 -19.505 -16.692 -5.565 1.00 0.00 H new ATOM 0 HA SER A 97 -20.351 -17.561 -7.439 1.00 0.00 H new ATOM 0 HB2 SER A 97 -22.262 -15.633 -6.835 1.00 0.00 H new ATOM 0 HB3 SER A 97 -21.783 -15.176 -8.458 1.00 0.00 H new ATOM 0 HG SER A 97 -23.495 -16.740 -8.455 1.00 0.00 H new ATOM 1486 N ALA A 98 -19.481 -14.687 -8.839 1.00 0.00 N ATOM 1487 CA ALA A 98 -18.635 -14.095 -9.868 1.00 0.00 C ATOM 1488 C ALA A 98 -18.734 -12.574 -9.852 1.00 0.00 C ATOM 1489 O ALA A 98 -17.721 -11.876 -9.914 1.00 0.00 O ATOM 1490 CB ALA A 98 -19.013 -14.638 -11.238 1.00 0.00 C ATOM 0 H ALA A 98 -20.094 -14.024 -8.365 1.00 0.00 H new ATOM 0 HA ALA A 98 -17.601 -14.367 -9.655 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -18.373 -14.188 -11.997 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -18.883 -15.720 -11.249 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -20.054 -14.396 -11.451 1.00 0.00 H new ATOM 1496 N SER A 99 -19.959 -12.065 -9.771 1.00 0.00 N ATOM 1497 CA SER A 99 -20.190 -10.626 -9.752 1.00 0.00 C ATOM 1498 C SER A 99 -19.541 -9.956 -10.960 1.00 0.00 C ATOM 1499 O SER A 99 -18.777 -10.581 -11.695 1.00 0.00 O ATOM 1500 CB SER A 99 -19.642 -10.017 -8.461 1.00 0.00 C ATOM 1501 OG SER A 99 -20.667 -9.370 -7.727 1.00 0.00 O ATOM 0 H SER A 99 -20.807 -12.629 -9.717 1.00 0.00 H new ATOM 0 HA SER A 99 -21.266 -10.455 -9.797 1.00 0.00 H new ATOM 0 HB2 SER A 99 -19.190 -10.798 -7.850 1.00 0.00 H new ATOM 0 HB3 SER A 99 -18.854 -9.302 -8.698 1.00 0.00 H new ATOM 0 HG SER A 99 -20.291 -8.990 -6.905 1.00 0.00 H new ATOM 1507 N GLY A 100 -19.852 -8.679 -11.157 1.00 0.00 N ATOM 1508 CA GLY A 100 -19.291 -7.944 -12.276 1.00 0.00 C ATOM 1509 C GLY A 100 -20.029 -6.648 -12.547 1.00 0.00 C ATOM 1510 O GLY A 100 -20.597 -6.444 -13.619 1.00 0.00 O ATOM 0 H GLY A 100 -20.482 -8.140 -10.562 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -18.242 -7.726 -12.074 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -19.321 -8.569 -13.169 1.00 0.00 H new ATOM 1514 N PRO A 101 -20.025 -5.744 -11.557 1.00 0.00 N ATOM 1515 CA PRO A 101 -20.696 -4.445 -11.669 1.00 0.00 C ATOM 1516 C PRO A 101 -19.997 -3.514 -12.652 1.00 0.00 C ATOM 1517 O PRO A 101 -20.646 -2.779 -13.396 1.00 0.00 O ATOM 1518 CB PRO A 101 -20.616 -3.880 -10.247 1.00 0.00 C ATOM 1519 CG PRO A 101 -19.427 -4.545 -9.643 1.00 0.00 C ATOM 1520 CD PRO A 101 -19.367 -5.919 -10.250 1.00 0.00 C ATOM 0 HA PRO A 101 -21.714 -4.544 -12.047 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -20.501 -2.796 -10.257 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -21.522 -4.099 -9.682 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -18.517 -3.985 -9.856 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -19.521 -4.601 -8.558 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -18.339 -6.265 -10.361 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -19.886 -6.653 -9.634 1.00 0.00 H new ATOM 1528 N SER A 102 -18.667 -3.550 -12.651 1.00 0.00 N ATOM 1529 CA SER A 102 -17.879 -2.706 -13.541 1.00 0.00 C ATOM 1530 C SER A 102 -16.412 -3.127 -13.530 1.00 0.00 C ATOM 1531 O SER A 102 -15.923 -3.685 -12.549 1.00 0.00 O ATOM 1532 CB SER A 102 -18.003 -1.237 -13.131 1.00 0.00 C ATOM 1533 OG SER A 102 -17.930 -0.384 -14.260 1.00 0.00 O ATOM 0 H SER A 102 -18.114 -4.155 -12.044 1.00 0.00 H new ATOM 0 HA SER A 102 -18.267 -2.826 -14.553 1.00 0.00 H new ATOM 0 HB2 SER A 102 -18.949 -1.080 -12.613 1.00 0.00 H new ATOM 0 HB3 SER A 102 -17.209 -0.984 -12.428 1.00 0.00 H new ATOM 0 HG SER A 102 -18.014 0.549 -13.971 1.00 0.00 H new ATOM 1539 N SER A 103 -15.717 -2.853 -14.630 1.00 0.00 N ATOM 1540 CA SER A 103 -14.307 -3.206 -14.749 1.00 0.00 C ATOM 1541 C SER A 103 -13.552 -2.159 -15.561 1.00 0.00 C ATOM 1542 O SER A 103 -13.764 -2.018 -16.765 1.00 0.00 O ATOM 1543 CB SER A 103 -14.157 -4.581 -15.405 1.00 0.00 C ATOM 1544 OG SER A 103 -13.014 -5.259 -14.913 1.00 0.00 O ATOM 0 H SER A 103 -16.107 -2.388 -15.450 1.00 0.00 H new ATOM 0 HA SER A 103 -13.881 -3.241 -13.746 1.00 0.00 H new ATOM 0 HB2 SER A 103 -15.048 -5.178 -15.213 1.00 0.00 H new ATOM 0 HB3 SER A 103 -14.078 -4.465 -16.486 1.00 0.00 H new ATOM 0 HG SER A 103 -12.942 -6.135 -15.346 1.00 0.00 H new ATOM 1550 N GLY A 104 -12.667 -1.424 -14.892 1.00 0.00 N ATOM 1551 CA GLY A 104 -11.894 -0.398 -15.566 1.00 0.00 C ATOM 1552 C GLY A 104 -10.456 -0.818 -15.803 1.00 0.00 C ATOM 1553 O GLY A 104 -9.682 -0.962 -14.857 1.00 0.00 O ATOM 0 H GLY A 104 -12.472 -1.522 -13.895 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -12.363 -0.163 -16.521 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -11.909 0.515 -14.970 1.00 0.00 H new TER 1557 GLY A 104