USER MOD reduce.3.24.130724 H: found=0, std=0, add=880, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 878 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 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 41 MET CE :methyl 154:sc= -0.0013 (180deg=-0.25) 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 -58:sc= 0.175 USER MOD Single : A 8 ASN : amide:sc= -0.244 K(o=-0.24,f=-1.7) USER MOD Single : A 13 HIS : no HD1:sc=-0.00373 X(o=-0.0037,f=0) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 MET CE :methyl -176:sc= -1.98 (180deg=-2.04) USER MOD Single : A 22 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0069) USER MOD Single : A 26 ASN : amide:sc= -0.128 K(o=-0.13,f=-1.6) USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -0.0325 X(o=-0.033,f=-0.002) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot -106:sc= 1.27 USER MOD Single : A 57 CYS SG : rot 57:sc= -0.515 USER MOD Single : A 62 ASN : amide:sc= -0.738 K(o=-0.74,f=-2!) USER MOD Single : A 66 GLN : amide:sc= -0.661 X(o=-0.66,f=-1) USER MOD Single : A 71 ASN :FLIP amide:sc= 0 F(o=-0.51,f=0) USER MOD Single : A 78 HIS : no HD1:sc= -0.905 X(o=-0.91,f=-0.59) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 HIS : no HE2:sc= 0.342 K(o=0.34,f=-2.7!) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 CYS SG : rot 180:sc= 0 USER MOD Single : A 94 HIS : no HD1:sc= -0.152 X(o=-0.15,f=-0.0078) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl 162:sc= 0 (180deg=-0.517) USER MOD Single : A 105 ASN : amide:sc= -0.0525 K(o=-0.053,f=-1.2!) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 12.106 -12.834 -53.259 1.00 0.00 N ATOM 2 CA GLY A 1 11.560 -13.883 -52.418 1.00 0.00 C ATOM 3 C GLY A 1 11.825 -13.641 -50.945 1.00 0.00 C ATOM 4 O GLY A 1 12.956 -13.782 -50.479 1.00 0.00 O ATOM 0 H1 GLY A 1 11.899 -13.045 -54.256 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.675 -11.923 -53.001 1.00 0.00 H new ATOM 0 H3 GLY A 1 13.136 -12.781 -53.123 1.00 0.00 H new ATOM 0 HA2 GLY A 1 10.485 -13.955 -52.584 1.00 0.00 H new ATOM 0 HA3 GLY A 1 11.992 -14.840 -52.709 1.00 0.00 H new ATOM 8 N SER A 2 10.780 -13.275 -50.210 1.00 0.00 N ATOM 9 CA SER A 2 10.906 -13.007 -48.782 1.00 0.00 C ATOM 10 C SER A 2 9.534 -12.955 -48.116 1.00 0.00 C ATOM 11 O SER A 2 8.575 -12.432 -48.685 1.00 0.00 O ATOM 12 CB SER A 2 11.648 -11.689 -48.552 1.00 0.00 C ATOM 13 OG SER A 2 11.027 -10.625 -49.252 1.00 0.00 O ATOM 0 H SER A 2 9.837 -13.157 -50.580 1.00 0.00 H new ATOM 0 HA SER A 2 11.478 -13.820 -48.334 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.671 -11.462 -47.486 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.683 -11.789 -48.879 1.00 0.00 H new ATOM 0 HG SER A 2 11.519 -9.794 -49.087 1.00 0.00 H new ATOM 19 N SER A 3 9.449 -13.500 -46.907 1.00 0.00 N ATOM 20 CA SER A 3 8.194 -13.519 -46.164 1.00 0.00 C ATOM 21 C SER A 3 8.160 -12.400 -45.127 1.00 0.00 C ATOM 22 O SER A 3 8.641 -12.563 -44.006 1.00 0.00 O ATOM 23 CB SER A 3 8.005 -14.873 -45.477 1.00 0.00 C ATOM 24 OG SER A 3 6.678 -15.022 -45.002 1.00 0.00 O ATOM 0 H SER A 3 10.234 -13.934 -46.421 1.00 0.00 H new ATOM 0 HA SER A 3 7.379 -13.361 -46.870 1.00 0.00 H new ATOM 0 HB2 SER A 3 8.236 -15.675 -46.178 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.705 -14.964 -44.646 1.00 0.00 H new ATOM 0 HG SER A 3 6.582 -15.896 -44.568 1.00 0.00 H new ATOM 30 N GLY A 4 7.587 -11.263 -45.510 1.00 0.00 N ATOM 31 CA GLY A 4 7.500 -10.134 -44.604 1.00 0.00 C ATOM 32 C GLY A 4 6.338 -9.217 -44.929 1.00 0.00 C ATOM 33 O GLY A 4 5.979 -9.048 -46.095 1.00 0.00 O ATOM 0 H GLY A 4 7.181 -11.104 -46.432 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.396 -10.499 -43.582 1.00 0.00 H new ATOM 0 HA3 GLY A 4 8.429 -9.566 -44.646 1.00 0.00 H new ATOM 37 N SER A 5 5.746 -8.625 -43.897 1.00 0.00 N ATOM 38 CA SER A 5 4.613 -7.724 -44.079 1.00 0.00 C ATOM 39 C SER A 5 4.812 -6.435 -43.288 1.00 0.00 C ATOM 40 O SER A 5 3.884 -5.933 -42.654 1.00 0.00 O ATOM 41 CB SER A 5 3.316 -8.408 -43.643 1.00 0.00 C ATOM 42 OG SER A 5 3.359 -8.754 -42.269 1.00 0.00 O ATOM 0 H SER A 5 6.032 -8.753 -42.926 1.00 0.00 H new ATOM 0 HA SER A 5 4.546 -7.474 -45.138 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.471 -7.744 -43.828 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.155 -9.304 -44.242 1.00 0.00 H new ATOM 0 HG SER A 5 2.518 -9.188 -42.014 1.00 0.00 H new ATOM 48 N SER A 6 6.030 -5.903 -43.332 1.00 0.00 N ATOM 49 CA SER A 6 6.353 -4.674 -42.617 1.00 0.00 C ATOM 50 C SER A 6 6.373 -4.911 -41.110 1.00 0.00 C ATOM 51 O SER A 6 5.882 -4.091 -40.335 1.00 0.00 O ATOM 52 CB SER A 6 5.341 -3.578 -42.960 1.00 0.00 C ATOM 53 OG SER A 6 5.808 -2.306 -42.546 1.00 0.00 O ATOM 0 H SER A 6 6.809 -6.304 -43.855 1.00 0.00 H new ATOM 0 HA SER A 6 7.346 -4.352 -42.929 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.159 -3.570 -44.035 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.388 -3.794 -42.477 1.00 0.00 H new ATOM 0 HG SER A 6 5.985 -2.320 -41.582 1.00 0.00 H new ATOM 59 N GLY A 7 6.945 -6.039 -40.702 1.00 0.00 N ATOM 60 CA GLY A 7 7.018 -6.366 -39.290 1.00 0.00 C ATOM 61 C GLY A 7 5.831 -7.182 -38.821 1.00 0.00 C ATOM 62 O GLY A 7 4.767 -7.153 -39.438 1.00 0.00 O ATOM 0 H GLY A 7 7.359 -6.733 -41.324 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.936 -6.921 -39.096 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.074 -5.445 -38.710 1.00 0.00 H new ATOM 66 N ASN A 8 6.012 -7.913 -37.726 1.00 0.00 N ATOM 67 CA ASN A 8 4.947 -8.743 -37.176 1.00 0.00 C ATOM 68 C ASN A 8 4.569 -8.283 -35.771 1.00 0.00 C ATOM 69 O ASN A 8 5.385 -8.326 -34.852 1.00 0.00 O ATOM 70 CB ASN A 8 5.380 -10.210 -37.144 1.00 0.00 C ATOM 71 CG ASN A 8 6.627 -10.427 -36.309 1.00 0.00 C ATOM 72 OD1 ASN A 8 7.707 -9.941 -36.647 1.00 0.00 O ATOM 73 ND2 ASN A 8 6.484 -11.160 -35.211 1.00 0.00 N ATOM 0 H ASN A 8 6.886 -7.947 -37.202 1.00 0.00 H new ATOM 0 HA ASN A 8 4.073 -8.642 -37.820 1.00 0.00 H new ATOM 0 HB2 ASN A 8 4.568 -10.817 -36.744 1.00 0.00 H new ATOM 0 HB3 ASN A 8 5.563 -10.554 -38.162 1.00 0.00 H new ATOM 0 HD21 ASN A 8 7.288 -11.340 -34.610 1.00 0.00 H new ATOM 0 HD22 ASN A 8 5.570 -11.543 -34.969 1.00 0.00 H new ATOM 80 N GLY A 9 3.324 -7.842 -35.614 1.00 0.00 N ATOM 81 CA GLY A 9 2.859 -7.380 -34.319 1.00 0.00 C ATOM 82 C GLY A 9 2.863 -8.479 -33.276 1.00 0.00 C ATOM 83 O GLY A 9 3.308 -9.595 -33.541 1.00 0.00 O ATOM 0 H GLY A 9 2.630 -7.797 -36.360 1.00 0.00 H new ATOM 0 HA2 GLY A 9 3.492 -6.560 -33.981 1.00 0.00 H new ATOM 0 HA3 GLY A 9 1.849 -6.983 -34.420 1.00 0.00 H new ATOM 87 N GLY A 10 2.368 -8.163 -32.083 1.00 0.00 N ATOM 88 CA GLY A 10 2.328 -9.143 -31.013 1.00 0.00 C ATOM 89 C GLY A 10 2.869 -8.597 -29.707 1.00 0.00 C ATOM 90 O GLY A 10 3.994 -8.909 -29.315 1.00 0.00 O ATOM 0 H GLY A 10 1.994 -7.246 -31.838 1.00 0.00 H new ATOM 0 HA2 GLY A 10 1.300 -9.475 -30.867 1.00 0.00 H new ATOM 0 HA3 GLY A 10 2.907 -10.019 -31.305 1.00 0.00 H new ATOM 94 N ILE A 11 2.068 -7.780 -29.031 1.00 0.00 N ATOM 95 CA ILE A 11 2.474 -7.190 -27.762 1.00 0.00 C ATOM 96 C ILE A 11 2.862 -8.266 -26.754 1.00 0.00 C ATOM 97 O ILE A 11 2.237 -9.323 -26.666 1.00 0.00 O ATOM 98 CB ILE A 11 1.354 -6.319 -27.162 1.00 0.00 C ATOM 99 CG1 ILE A 11 0.043 -7.106 -27.105 1.00 0.00 C ATOM 100 CG2 ILE A 11 1.180 -5.046 -27.975 1.00 0.00 C ATOM 101 CD1 ILE A 11 -1.111 -6.316 -26.526 1.00 0.00 C ATOM 0 H ILE A 11 1.134 -7.512 -29.341 1.00 0.00 H new ATOM 0 HA ILE A 11 3.340 -6.561 -27.969 1.00 0.00 H new ATOM 0 HB ILE A 11 1.634 -6.041 -26.146 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -0.219 -7.433 -28.111 1.00 0.00 H new ATOM 0 HG13 ILE A 11 0.194 -8.005 -26.507 1.00 0.00 H new ATOM 0 HG21 ILE A 11 0.385 -4.441 -27.538 1.00 0.00 H new ATOM 0 HG22 ILE A 11 2.112 -4.480 -27.969 1.00 0.00 H new ATOM 0 HG23 ILE A 11 0.918 -5.303 -29.002 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -2.008 -6.936 -26.516 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -0.869 -6.012 -25.508 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -1.289 -5.431 -27.137 1.00 0.00 H new ATOM 113 N PRO A 12 3.917 -7.993 -25.972 1.00 0.00 N ATOM 114 CA PRO A 12 4.410 -8.925 -24.954 1.00 0.00 C ATOM 115 C PRO A 12 3.450 -9.059 -23.777 1.00 0.00 C ATOM 116 O PRO A 12 3.529 -8.303 -22.809 1.00 0.00 O ATOM 117 CB PRO A 12 5.727 -8.289 -24.500 1.00 0.00 C ATOM 118 CG PRO A 12 5.566 -6.836 -24.789 1.00 0.00 C ATOM 119 CD PRO A 12 4.709 -6.752 -26.022 1.00 0.00 C ATOM 0 HA PRO A 12 4.521 -9.936 -25.346 1.00 0.00 H new ATOM 0 HB2 PRO A 12 5.906 -8.464 -23.439 1.00 0.00 H new ATOM 0 HB3 PRO A 12 6.576 -8.708 -25.040 1.00 0.00 H new ATOM 0 HG2 PRO A 12 5.096 -6.321 -23.951 1.00 0.00 H new ATOM 0 HG3 PRO A 12 6.533 -6.361 -24.953 1.00 0.00 H new ATOM 0 HD2 PRO A 12 4.072 -5.868 -26.009 1.00 0.00 H new ATOM 0 HD3 PRO A 12 5.313 -6.697 -26.928 1.00 0.00 H new ATOM 127 N HIS A 13 2.543 -10.027 -23.867 1.00 0.00 N ATOM 128 CA HIS A 13 1.568 -10.262 -22.809 1.00 0.00 C ATOM 129 C HIS A 13 2.211 -10.111 -21.434 1.00 0.00 C ATOM 130 O HIS A 13 3.000 -10.956 -21.011 1.00 0.00 O ATOM 131 CB HIS A 13 0.957 -11.657 -22.949 1.00 0.00 C ATOM 132 CG HIS A 13 0.002 -11.780 -24.096 1.00 0.00 C ATOM 133 ND1 HIS A 13 -1.368 -11.762 -23.941 1.00 0.00 N ATOM 134 CD2 HIS A 13 0.227 -11.922 -25.423 1.00 0.00 C ATOM 135 CE1 HIS A 13 -1.944 -11.890 -25.122 1.00 0.00 C ATOM 136 NE2 HIS A 13 -0.999 -11.988 -26.039 1.00 0.00 N ATOM 0 H HIS A 13 2.463 -10.661 -24.662 1.00 0.00 H new ATOM 0 HA HIS A 13 0.778 -9.517 -22.905 1.00 0.00 H new ATOM 0 HB2 HIS A 13 1.759 -12.385 -23.075 1.00 0.00 H new ATOM 0 HB3 HIS A 13 0.437 -11.911 -22.025 1.00 0.00 H new ATOM 0 HD2 HIS A 13 1.191 -11.974 -25.907 1.00 0.00 H new ATOM 0 HE1 HIS A 13 -3.008 -11.911 -25.307 1.00 0.00 H new ATOM 0 HE2 HIS A 13 -1.154 -12.095 -27.041 1.00 0.00 H new ATOM 145 N ASP A 14 1.869 -9.030 -20.741 1.00 0.00 N ATOM 146 CA ASP A 14 2.413 -8.768 -19.414 1.00 0.00 C ATOM 147 C ASP A 14 2.323 -10.012 -18.535 1.00 0.00 C ATOM 148 O ASP A 14 1.328 -10.735 -18.566 1.00 0.00 O ATOM 149 CB ASP A 14 1.669 -7.607 -18.754 1.00 0.00 C ATOM 150 CG ASP A 14 0.163 -7.759 -18.844 1.00 0.00 C ATOM 151 OD1 ASP A 14 -0.398 -8.572 -18.081 1.00 0.00 O ATOM 152 OD2 ASP A 14 -0.454 -7.065 -19.680 1.00 0.00 O ATOM 0 H ASP A 14 1.217 -8.321 -21.077 1.00 0.00 H new ATOM 0 HA ASP A 14 3.463 -8.499 -19.526 1.00 0.00 H new ATOM 0 HB2 ASP A 14 1.963 -7.540 -17.706 1.00 0.00 H new ATOM 0 HB3 ASP A 14 1.966 -6.672 -19.229 1.00 0.00 H new ATOM 157 N ASN A 15 3.370 -10.255 -17.753 1.00 0.00 N ATOM 158 CA ASN A 15 3.410 -11.413 -16.867 1.00 0.00 C ATOM 159 C ASN A 15 2.993 -11.028 -15.450 1.00 0.00 C ATOM 160 O ASN A 15 2.196 -11.720 -14.816 1.00 0.00 O ATOM 161 CB ASN A 15 4.814 -12.020 -16.850 1.00 0.00 C ATOM 162 CG ASN A 15 5.328 -12.326 -18.243 1.00 0.00 C ATOM 163 OD1 ASN A 15 5.028 -13.377 -18.811 1.00 0.00 O ATOM 164 ND2 ASN A 15 6.108 -11.408 -18.801 1.00 0.00 N ATOM 0 H ASN A 15 4.202 -9.666 -17.715 1.00 0.00 H new ATOM 0 HA ASN A 15 2.706 -12.154 -17.246 1.00 0.00 H new ATOM 0 HB2 ASN A 15 5.499 -11.331 -16.356 1.00 0.00 H new ATOM 0 HB3 ASN A 15 4.804 -12.936 -16.260 1.00 0.00 H new ATOM 0 HD21 ASN A 15 6.484 -11.559 -19.737 1.00 0.00 H new ATOM 0 HD22 ASN A 15 6.331 -10.551 -18.294 1.00 0.00 H new ATOM 171 N LEU A 16 3.537 -9.919 -14.960 1.00 0.00 N ATOM 172 CA LEU A 16 3.222 -9.441 -13.619 1.00 0.00 C ATOM 173 C LEU A 16 1.725 -9.192 -13.467 1.00 0.00 C ATOM 174 O LEU A 16 1.039 -8.858 -14.433 1.00 0.00 O ATOM 175 CB LEU A 16 3.997 -8.156 -13.319 1.00 0.00 C ATOM 176 CG LEU A 16 5.462 -8.333 -12.922 1.00 0.00 C ATOM 177 CD1 LEU A 16 5.572 -8.789 -11.475 1.00 0.00 C ATOM 178 CD2 LEU A 16 6.150 -9.325 -13.848 1.00 0.00 C ATOM 0 H LEU A 16 4.198 -9.335 -15.472 1.00 0.00 H new ATOM 0 HA LEU A 16 3.518 -10.211 -12.907 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.955 -7.516 -14.200 1.00 0.00 H new ATOM 0 HB3 LEU A 16 3.485 -7.626 -12.516 1.00 0.00 H new ATOM 0 HG LEU A 16 5.962 -7.369 -13.017 1.00 0.00 H new ATOM 0 HD11 LEU A 16 6.622 -8.910 -11.210 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.117 -8.043 -10.823 1.00 0.00 H new ATOM 0 HD13 LEU A 16 5.056 -9.741 -11.353 1.00 0.00 H new ATOM 0 HD21 LEU A 16 7.192 -9.438 -13.550 1.00 0.00 H new ATOM 0 HD22 LEU A 16 5.648 -10.290 -13.785 1.00 0.00 H new ATOM 0 HD23 LEU A 16 6.104 -8.958 -14.873 1.00 0.00 H new ATOM 190 N VAL A 17 1.224 -9.356 -12.247 1.00 0.00 N ATOM 191 CA VAL A 17 -0.192 -9.146 -11.967 1.00 0.00 C ATOM 192 C VAL A 17 -0.485 -7.677 -11.686 1.00 0.00 C ATOM 193 O VAL A 17 0.023 -7.104 -10.721 1.00 0.00 O ATOM 194 CB VAL A 17 -0.658 -9.990 -10.766 1.00 0.00 C ATOM 195 CG1 VAL A 17 -2.088 -9.636 -10.387 1.00 0.00 C ATOM 196 CG2 VAL A 17 -0.532 -11.474 -11.076 1.00 0.00 C ATOM 0 H VAL A 17 1.777 -9.634 -11.436 1.00 0.00 H new ATOM 0 HA VAL A 17 -0.740 -9.459 -12.856 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.015 -9.764 -9.915 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -2.400 -10.242 -9.537 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.143 -8.581 -10.120 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.747 -9.831 -11.233 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.866 -12.055 -10.216 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.149 -11.719 -11.941 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.509 -11.713 -11.294 1.00 0.00 H new ATOM 206 N LEU A 18 -1.307 -7.071 -12.535 1.00 0.00 N ATOM 207 CA LEU A 18 -1.670 -5.666 -12.379 1.00 0.00 C ATOM 208 C LEU A 18 -3.014 -5.526 -11.673 1.00 0.00 C ATOM 209 O LEU A 18 -4.032 -6.032 -12.148 1.00 0.00 O ATOM 210 CB LEU A 18 -1.723 -4.978 -13.744 1.00 0.00 C ATOM 211 CG LEU A 18 -2.248 -3.541 -13.751 1.00 0.00 C ATOM 212 CD1 LEU A 18 -1.124 -2.562 -13.451 1.00 0.00 C ATOM 213 CD2 LEU A 18 -2.898 -3.217 -15.088 1.00 0.00 C ATOM 0 H LEU A 18 -1.735 -7.530 -13.339 1.00 0.00 H new ATOM 0 HA LEU A 18 -0.907 -5.185 -11.766 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.719 -4.979 -14.168 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.349 -5.576 -14.406 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.003 -3.446 -12.971 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -1.515 -1.545 -13.460 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.704 -2.780 -12.469 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -0.346 -2.658 -14.208 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -3.266 -2.191 -15.075 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -2.164 -3.329 -15.886 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.731 -3.898 -15.262 1.00 0.00 H new ATOM 225 N ILE A 19 -3.012 -4.835 -10.538 1.00 0.00 N ATOM 226 CA ILE A 19 -4.232 -4.626 -9.768 1.00 0.00 C ATOM 227 C ILE A 19 -4.964 -3.370 -10.230 1.00 0.00 C ATOM 228 O ILE A 19 -4.345 -2.337 -10.485 1.00 0.00 O ATOM 229 CB ILE A 19 -3.934 -4.509 -8.262 1.00 0.00 C ATOM 230 CG1 ILE A 19 -3.104 -5.704 -7.790 1.00 0.00 C ATOM 231 CG2 ILE A 19 -5.231 -4.413 -7.472 1.00 0.00 C ATOM 232 CD1 ILE A 19 -3.825 -7.028 -7.913 1.00 0.00 C ATOM 0 H ILE A 19 -2.179 -4.410 -10.131 1.00 0.00 H new ATOM 0 HA ILE A 19 -4.866 -5.496 -9.937 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.358 -3.600 -8.090 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.182 -5.747 -8.369 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.820 -5.550 -6.749 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -5.004 -4.331 -6.409 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -5.788 -3.533 -7.793 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.831 -5.306 -7.647 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.176 -7.830 -7.560 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -4.733 -7.005 -7.311 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -4.086 -7.205 -8.957 1.00 0.00 H new ATOM 244 N ARG A 20 -6.285 -3.466 -10.332 1.00 0.00 N ATOM 245 CA ARG A 20 -7.103 -2.338 -10.761 1.00 0.00 C ATOM 246 C ARG A 20 -8.364 -2.224 -9.910 1.00 0.00 C ATOM 247 O ARG A 20 -9.151 -3.166 -9.821 1.00 0.00 O ATOM 248 CB ARG A 20 -7.482 -2.487 -12.236 1.00 0.00 C ATOM 249 CG ARG A 20 -6.285 -2.524 -13.172 1.00 0.00 C ATOM 250 CD ARG A 20 -6.706 -2.814 -14.604 1.00 0.00 C ATOM 251 NE ARG A 20 -7.467 -4.056 -14.710 1.00 0.00 N ATOM 252 CZ ARG A 20 -8.779 -4.133 -14.518 1.00 0.00 C ATOM 253 NH1 ARG A 20 -9.472 -3.045 -14.212 1.00 0.00 N ATOM 254 NH2 ARG A 20 -9.400 -5.300 -14.632 1.00 0.00 N ATOM 0 H ARG A 20 -6.812 -4.314 -10.123 1.00 0.00 H new ATOM 0 HA ARG A 20 -6.517 -1.428 -10.633 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -8.060 -3.402 -12.363 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -8.130 -1.658 -12.521 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -5.761 -1.569 -13.132 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -5.583 -3.287 -12.836 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -7.308 -1.987 -14.979 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -5.821 -2.876 -15.237 1.00 0.00 H new ATOM 0 HE ARG A 20 -6.963 -4.911 -14.944 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -8.998 -2.146 -14.124 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -10.479 -3.107 -14.065 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -8.870 -6.139 -14.867 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -10.408 -5.358 -14.484 1.00 0.00 H new ATOM 268 N MET A 21 -8.547 -1.066 -9.285 1.00 0.00 N ATOM 269 CA MET A 21 -9.713 -0.829 -8.441 1.00 0.00 C ATOM 270 C MET A 21 -9.949 0.665 -8.247 1.00 0.00 C ATOM 271 O MET A 21 -9.136 1.492 -8.661 1.00 0.00 O ATOM 272 CB MET A 21 -9.532 -1.510 -7.083 1.00 0.00 C ATOM 273 CG MET A 21 -8.544 -0.797 -6.173 1.00 0.00 C ATOM 274 SD MET A 21 -6.833 -1.252 -6.515 1.00 0.00 S ATOM 275 CE MET A 21 -6.461 -2.268 -5.087 1.00 0.00 C ATOM 0 H MET A 21 -7.903 -0.277 -9.347 1.00 0.00 H new ATOM 0 HA MET A 21 -10.584 -1.254 -8.939 1.00 0.00 H new ATOM 0 HB2 MET A 21 -10.499 -1.567 -6.583 1.00 0.00 H new ATOM 0 HB3 MET A 21 -9.194 -2.534 -7.241 1.00 0.00 H new ATOM 0 HG2 MET A 21 -8.660 0.280 -6.290 1.00 0.00 H new ATOM 0 HG3 MET A 21 -8.778 -1.031 -5.135 1.00 0.00 H new ATOM 0 HE1 MET A 21 -5.413 -2.568 -5.117 1.00 0.00 H new ATOM 0 HE2 MET A 21 -6.650 -1.699 -4.177 1.00 0.00 H new ATOM 0 HE3 MET A 21 -7.093 -3.156 -5.098 1.00 0.00 H new ATOM 285 N LYS A 22 -11.068 1.006 -7.616 1.00 0.00 N ATOM 286 CA LYS A 22 -11.412 2.400 -7.366 1.00 0.00 C ATOM 287 C LYS A 22 -11.618 2.651 -5.875 1.00 0.00 C ATOM 288 O LYS A 22 -11.985 1.754 -5.116 1.00 0.00 O ATOM 289 CB LYS A 22 -12.677 2.781 -8.138 1.00 0.00 C ATOM 290 CG LYS A 22 -13.868 1.890 -7.831 1.00 0.00 C ATOM 291 CD LYS A 22 -15.179 2.565 -8.200 1.00 0.00 C ATOM 292 CE LYS A 22 -16.336 1.578 -8.191 1.00 0.00 C ATOM 293 NZ LYS A 22 -16.599 1.044 -6.826 1.00 0.00 N ATOM 0 H LYS A 22 -11.753 0.335 -7.268 1.00 0.00 H new ATOM 0 HA LYS A 22 -10.584 3.020 -7.710 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -12.937 3.814 -7.906 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -12.467 2.738 -9.207 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -13.773 0.953 -8.379 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -13.872 1.640 -6.770 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -15.383 3.373 -7.498 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -15.092 3.016 -9.189 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -17.234 2.067 -8.569 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -16.114 0.753 -8.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -17.426 0.414 -6.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -15.769 0.511 -6.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -16.786 1.833 -6.175 1.00 0.00 H new ATOM 307 N PRO A 23 -11.378 3.898 -5.445 1.00 0.00 N ATOM 308 CA PRO A 23 -11.533 4.296 -4.043 1.00 0.00 C ATOM 309 C PRO A 23 -12.993 4.321 -3.606 1.00 0.00 C ATOM 310 O PRO A 23 -13.820 5.003 -4.211 1.00 0.00 O ATOM 311 CB PRO A 23 -10.939 5.706 -4.006 1.00 0.00 C ATOM 312 CG PRO A 23 -11.085 6.215 -5.399 1.00 0.00 C ATOM 313 CD PRO A 23 -10.937 5.017 -6.295 1.00 0.00 C ATOM 0 HA PRO A 23 -11.045 3.596 -3.364 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -11.469 6.340 -3.295 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -9.893 5.687 -3.699 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -12.055 6.691 -5.541 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -10.326 6.965 -5.622 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -11.551 5.107 -7.191 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -9.907 4.888 -6.626 1.00 0.00 H new ATOM 321 N ASP A 24 -13.303 3.576 -2.551 1.00 0.00 N ATOM 322 CA ASP A 24 -14.664 3.514 -2.032 1.00 0.00 C ATOM 323 C ASP A 24 -15.252 4.914 -1.881 1.00 0.00 C ATOM 324 O ASP A 24 -14.546 5.912 -2.018 1.00 0.00 O ATOM 325 CB ASP A 24 -14.687 2.790 -0.684 1.00 0.00 C ATOM 326 CG ASP A 24 -16.024 2.135 -0.401 1.00 0.00 C ATOM 327 OD1 ASP A 24 -16.229 0.988 -0.849 1.00 0.00 O ATOM 328 OD2 ASP A 24 -16.867 2.770 0.267 1.00 0.00 O ATOM 0 H ASP A 24 -12.630 3.006 -2.038 1.00 0.00 H new ATOM 0 HA ASP A 24 -15.273 2.958 -2.745 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -13.904 2.032 -0.669 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -14.458 3.500 0.110 1.00 0.00 H new ATOM 333 N GLU A 25 -16.550 4.978 -1.599 1.00 0.00 N ATOM 334 CA GLU A 25 -17.232 6.256 -1.432 1.00 0.00 C ATOM 335 C GLU A 25 -16.476 7.153 -0.456 1.00 0.00 C ATOM 336 O GLU A 25 -16.328 8.352 -0.687 1.00 0.00 O ATOM 337 CB GLU A 25 -18.662 6.035 -0.935 1.00 0.00 C ATOM 338 CG GLU A 25 -19.506 5.182 -1.867 1.00 0.00 C ATOM 339 CD GLU A 25 -20.025 5.961 -3.060 1.00 0.00 C ATOM 340 OE1 GLU A 25 -19.388 6.967 -3.435 1.00 0.00 O ATOM 341 OE2 GLU A 25 -21.069 5.563 -3.619 1.00 0.00 O ATOM 0 H GLU A 25 -17.149 4.161 -1.482 1.00 0.00 H new ATOM 0 HA GLU A 25 -17.264 6.751 -2.403 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -18.627 5.561 0.046 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -19.146 7.003 -0.804 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -18.912 4.338 -2.219 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -20.349 4.769 -1.313 1.00 0.00 H new ATOM 348 N ASN A 26 -16.000 6.562 0.635 1.00 0.00 N ATOM 349 CA ASN A 26 -15.260 7.307 1.647 1.00 0.00 C ATOM 350 C ASN A 26 -13.786 7.420 1.270 1.00 0.00 C ATOM 351 O ASN A 26 -12.934 7.667 2.122 1.00 0.00 O ATOM 352 CB ASN A 26 -15.399 6.630 3.012 1.00 0.00 C ATOM 353 CG ASN A 26 -16.826 6.649 3.524 1.00 0.00 C ATOM 354 OD1 ASN A 26 -17.751 6.219 2.834 1.00 0.00 O ATOM 355 ND2 ASN A 26 -17.012 7.150 4.740 1.00 0.00 N ATOM 0 H ASN A 26 -16.113 5.569 0.841 1.00 0.00 H new ATOM 0 HA ASN A 26 -15.680 8.311 1.703 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -15.056 5.598 2.939 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -14.751 7.132 3.731 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -17.951 7.190 5.137 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -16.216 7.495 5.277 1.00 0.00 H new ATOM 362 N GLY A 27 -13.493 7.236 -0.014 1.00 0.00 N ATOM 363 CA GLY A 27 -12.122 7.321 -0.482 1.00 0.00 C ATOM 364 C GLY A 27 -11.152 6.599 0.432 1.00 0.00 C ATOM 365 O GLY A 27 -10.205 7.199 0.941 1.00 0.00 O ATOM 0 H GLY A 27 -14.181 7.030 -0.738 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -12.056 6.897 -1.484 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -11.832 8.369 -0.560 1.00 0.00 H new ATOM 369 N ARG A 28 -11.388 5.309 0.642 1.00 0.00 N ATOM 370 CA ARG A 28 -10.530 4.505 1.504 1.00 0.00 C ATOM 371 C ARG A 28 -10.459 3.063 1.008 1.00 0.00 C ATOM 372 O ARG A 28 -11.486 2.425 0.774 1.00 0.00 O ATOM 373 CB ARG A 28 -11.044 4.536 2.944 1.00 0.00 C ATOM 374 CG ARG A 28 -10.507 5.703 3.757 1.00 0.00 C ATOM 375 CD ARG A 28 -11.064 5.699 5.172 1.00 0.00 C ATOM 376 NE ARG A 28 -11.003 7.021 5.788 1.00 0.00 N ATOM 377 CZ ARG A 28 -9.917 7.507 6.379 1.00 0.00 C ATOM 378 NH1 ARG A 28 -8.807 6.783 6.433 1.00 0.00 N ATOM 379 NH2 ARG A 28 -9.939 8.720 6.917 1.00 0.00 N ATOM 0 H ARG A 28 -12.167 4.797 0.227 1.00 0.00 H new ATOM 0 HA ARG A 28 -9.527 4.931 1.475 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -12.133 4.583 2.931 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -10.771 3.604 3.438 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -9.419 5.653 3.793 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -10.767 6.640 3.265 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -12.098 5.355 5.153 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -10.503 4.989 5.780 1.00 0.00 H new ATOM 0 HE ARG A 28 -11.840 7.603 5.763 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -8.786 5.851 6.020 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -7.975 7.159 6.887 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -10.790 9.280 6.877 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -9.105 9.092 7.370 1.00 0.00 H new ATOM 393 N PHE A 29 -9.241 2.556 0.850 1.00 0.00 N ATOM 394 CA PHE A 29 -9.036 1.191 0.382 1.00 0.00 C ATOM 395 C PHE A 29 -9.185 0.194 1.527 1.00 0.00 C ATOM 396 O PHE A 29 -9.500 0.571 2.655 1.00 0.00 O ATOM 397 CB PHE A 29 -7.652 1.050 -0.255 1.00 0.00 C ATOM 398 CG PHE A 29 -7.485 1.856 -1.511 1.00 0.00 C ATOM 399 CD1 PHE A 29 -7.873 1.340 -2.737 1.00 0.00 C ATOM 400 CD2 PHE A 29 -6.939 3.128 -1.466 1.00 0.00 C ATOM 401 CE1 PHE A 29 -7.721 2.079 -3.896 1.00 0.00 C ATOM 402 CE2 PHE A 29 -6.785 3.872 -2.621 1.00 0.00 C ATOM 403 CZ PHE A 29 -7.175 3.346 -3.837 1.00 0.00 C ATOM 0 H PHE A 29 -8.381 3.070 1.039 1.00 0.00 H new ATOM 0 HA PHE A 29 -9.797 0.973 -0.367 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -6.896 1.357 0.467 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -7.470 -0.001 -0.480 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -8.299 0.349 -2.788 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -6.630 3.543 -0.518 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -8.029 1.666 -4.845 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -6.360 4.864 -2.572 1.00 0.00 H new ATOM 0 HZ PHE A 29 -7.053 3.925 -4.741 1.00 0.00 H new ATOM 413 N GLY A 30 -8.957 -1.081 1.228 1.00 0.00 N ATOM 414 CA GLY A 30 -9.072 -2.113 2.242 1.00 0.00 C ATOM 415 C GLY A 30 -8.019 -3.193 2.092 1.00 0.00 C ATOM 416 O GLY A 30 -8.316 -4.301 1.645 1.00 0.00 O ATOM 0 H GLY A 30 -8.695 -1.418 0.302 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -8.985 -1.659 3.229 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -10.062 -2.565 2.185 1.00 0.00 H new ATOM 420 N PHE A 31 -6.785 -2.871 2.464 1.00 0.00 N ATOM 421 CA PHE A 31 -5.684 -3.821 2.366 1.00 0.00 C ATOM 422 C PHE A 31 -4.503 -3.377 3.224 1.00 0.00 C ATOM 423 O PHE A 31 -4.037 -2.244 3.119 1.00 0.00 O ATOM 424 CB PHE A 31 -5.241 -3.972 0.909 1.00 0.00 C ATOM 425 CG PHE A 31 -4.605 -2.734 0.344 1.00 0.00 C ATOM 426 CD1 PHE A 31 -5.377 -1.765 -0.277 1.00 0.00 C ATOM 427 CD2 PHE A 31 -3.237 -2.538 0.435 1.00 0.00 C ATOM 428 CE1 PHE A 31 -4.794 -0.625 -0.798 1.00 0.00 C ATOM 429 CE2 PHE A 31 -2.649 -1.400 -0.084 1.00 0.00 C ATOM 430 CZ PHE A 31 -3.429 -0.442 -0.700 1.00 0.00 C ATOM 0 H PHE A 31 -6.522 -1.958 2.836 1.00 0.00 H new ATOM 0 HA PHE A 31 -6.036 -4.785 2.734 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -4.535 -4.799 0.836 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -6.106 -4.237 0.300 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -6.445 -1.902 -0.355 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -2.622 -3.283 0.917 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -5.406 0.122 -1.281 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -1.581 -1.260 -0.008 1.00 0.00 H new ATOM 0 HZ PHE A 31 -2.972 0.449 -1.105 1.00 0.00 H new ATOM 440 N ASN A 32 -4.025 -4.280 4.075 1.00 0.00 N ATOM 441 CA ASN A 32 -2.900 -3.981 4.954 1.00 0.00 C ATOM 442 C ASN A 32 -1.591 -4.482 4.351 1.00 0.00 C ATOM 443 O ASN A 32 -1.510 -5.612 3.868 1.00 0.00 O ATOM 444 CB ASN A 32 -3.117 -4.616 6.329 1.00 0.00 C ATOM 445 CG ASN A 32 -4.021 -3.781 7.215 1.00 0.00 C ATOM 446 OD1 ASN A 32 -5.245 -3.896 7.157 1.00 0.00 O ATOM 447 ND2 ASN A 32 -3.419 -2.934 8.042 1.00 0.00 N ATOM 0 H ASN A 32 -4.399 -5.224 4.174 1.00 0.00 H new ATOM 0 HA ASN A 32 -2.837 -2.899 5.067 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -3.551 -5.608 6.204 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -2.153 -4.750 6.821 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -3.975 -2.346 8.663 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -2.401 -2.872 8.056 1.00 0.00 H new ATOM 454 N VAL A 33 -0.569 -3.634 4.383 1.00 0.00 N ATOM 455 CA VAL A 33 0.737 -3.990 3.841 1.00 0.00 C ATOM 456 C VAL A 33 1.796 -4.027 4.938 1.00 0.00 C ATOM 457 O VAL A 33 1.590 -3.503 6.033 1.00 0.00 O ATOM 458 CB VAL A 33 1.181 -3.000 2.748 1.00 0.00 C ATOM 459 CG1 VAL A 33 0.221 -3.041 1.569 1.00 0.00 C ATOM 460 CG2 VAL A 33 1.283 -1.592 3.314 1.00 0.00 C ATOM 0 H VAL A 33 -0.620 -2.695 4.779 1.00 0.00 H new ATOM 0 HA VAL A 33 0.637 -4.983 3.402 1.00 0.00 H new ATOM 0 HB VAL A 33 2.168 -3.296 2.393 1.00 0.00 H new ATOM 0 HG11 VAL A 33 0.551 -2.335 0.807 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.203 -4.047 1.149 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -0.780 -2.771 1.905 1.00 0.00 H new ATOM 0 HG21 VAL A 33 1.598 -0.906 2.528 1.00 0.00 H new ATOM 0 HG22 VAL A 33 0.311 -1.283 3.698 1.00 0.00 H new ATOM 0 HG23 VAL A 33 2.014 -1.577 4.123 1.00 0.00 H new ATOM 470 N LYS A 34 2.931 -4.649 4.637 1.00 0.00 N ATOM 471 CA LYS A 34 4.024 -4.753 5.596 1.00 0.00 C ATOM 472 C LYS A 34 5.375 -4.642 4.895 1.00 0.00 C ATOM 473 O LYS A 34 5.517 -5.031 3.736 1.00 0.00 O ATOM 474 CB LYS A 34 3.939 -6.079 6.355 1.00 0.00 C ATOM 475 CG LYS A 34 4.451 -7.268 5.562 1.00 0.00 C ATOM 476 CD LYS A 34 4.258 -8.570 6.322 1.00 0.00 C ATOM 477 CE LYS A 34 4.162 -9.758 5.377 1.00 0.00 C ATOM 478 NZ LYS A 34 5.500 -10.336 5.074 1.00 0.00 N ATOM 0 H LYS A 34 3.118 -5.089 3.736 1.00 0.00 H new ATOM 0 HA LYS A 34 3.933 -3.929 6.304 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.511 -5.996 7.279 1.00 0.00 H new ATOM 0 HB3 LYS A 34 2.902 -6.261 6.637 1.00 0.00 H new ATOM 0 HG2 LYS A 34 3.928 -7.322 4.607 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.509 -7.129 5.339 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.090 -8.718 7.010 1.00 0.00 H new ATOM 0 HD3 LYS A 34 3.352 -8.510 6.925 1.00 0.00 H new ATOM 0 HE2 LYS A 34 3.527 -10.525 5.821 1.00 0.00 H new ATOM 0 HE3 LYS A 34 3.683 -9.446 4.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 5.391 -11.143 4.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 6.098 -9.612 4.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 5.947 -10.657 5.956 1.00 0.00 H new ATOM 492 N GLY A 35 6.364 -4.111 5.607 1.00 0.00 N ATOM 493 CA GLY A 35 7.690 -3.960 5.037 1.00 0.00 C ATOM 494 C GLY A 35 7.953 -2.551 4.543 1.00 0.00 C ATOM 495 O GLY A 35 7.080 -1.687 4.617 1.00 0.00 O ATOM 0 H GLY A 35 6.271 -3.783 6.568 1.00 0.00 H new ATOM 0 HA2 GLY A 35 8.436 -4.224 5.786 1.00 0.00 H new ATOM 0 HA3 GLY A 35 7.808 -4.660 4.209 1.00 0.00 H new ATOM 499 N GLY A 36 9.161 -2.317 4.040 1.00 0.00 N ATOM 500 CA GLY A 36 9.515 -1.001 3.541 1.00 0.00 C ATOM 501 C GLY A 36 11.001 -0.723 3.643 1.00 0.00 C ATOM 502 O GLY A 36 11.730 -1.446 4.324 1.00 0.00 O ATOM 0 H GLY A 36 9.901 -3.015 3.969 1.00 0.00 H new ATOM 0 HA2 GLY A 36 9.203 -0.914 2.500 1.00 0.00 H new ATOM 0 HA3 GLY A 36 8.967 -0.244 4.102 1.00 0.00 H new ATOM 506 N TYR A 37 11.453 0.326 2.965 1.00 0.00 N ATOM 507 CA TYR A 37 12.863 0.695 2.979 1.00 0.00 C ATOM 508 C TYR A 37 13.422 0.661 4.398 1.00 0.00 C ATOM 509 O TYR A 37 14.589 0.332 4.611 1.00 0.00 O ATOM 510 CB TYR A 37 13.053 2.089 2.377 1.00 0.00 C ATOM 511 CG TYR A 37 14.410 2.692 2.664 1.00 0.00 C ATOM 512 CD1 TYR A 37 15.501 2.416 1.849 1.00 0.00 C ATOM 513 CD2 TYR A 37 14.600 3.539 3.749 1.00 0.00 C ATOM 514 CE1 TYR A 37 16.742 2.965 2.107 1.00 0.00 C ATOM 515 CE2 TYR A 37 15.837 4.093 4.014 1.00 0.00 C ATOM 516 CZ TYR A 37 16.905 3.803 3.191 1.00 0.00 C ATOM 517 OH TYR A 37 18.140 4.352 3.451 1.00 0.00 O ATOM 0 H TYR A 37 10.863 0.936 2.399 1.00 0.00 H new ATOM 0 HA TYR A 37 13.408 -0.031 2.376 1.00 0.00 H new ATOM 0 HB2 TYR A 37 12.911 2.032 1.298 1.00 0.00 H new ATOM 0 HB3 TYR A 37 12.280 2.752 2.766 1.00 0.00 H new ATOM 0 HD1 TYR A 37 15.377 1.761 0.999 1.00 0.00 H new ATOM 0 HD2 TYR A 37 13.766 3.768 4.396 1.00 0.00 H new ATOM 0 HE1 TYR A 37 17.580 2.740 1.464 1.00 0.00 H new ATOM 0 HE2 TYR A 37 15.967 4.750 4.861 1.00 0.00 H new ATOM 0 HH TYR A 37 18.085 4.919 4.248 1.00 0.00 H new ATOM 527 N ASP A 38 12.579 1.003 5.366 1.00 0.00 N ATOM 528 CA ASP A 38 12.985 1.011 6.767 1.00 0.00 C ATOM 529 C ASP A 38 13.564 -0.341 7.172 1.00 0.00 C ATOM 530 O ASP A 38 14.601 -0.410 7.832 1.00 0.00 O ATOM 531 CB ASP A 38 11.796 1.360 7.663 1.00 0.00 C ATOM 532 CG ASP A 38 11.906 0.734 9.040 1.00 0.00 C ATOM 533 OD1 ASP A 38 12.595 1.316 9.903 1.00 0.00 O ATOM 534 OD2 ASP A 38 11.302 -0.337 9.254 1.00 0.00 O ATOM 0 H ASP A 38 11.610 1.278 5.206 1.00 0.00 H new ATOM 0 HA ASP A 38 13.758 1.769 6.892 1.00 0.00 H new ATOM 0 HB2 ASP A 38 11.726 2.443 7.764 1.00 0.00 H new ATOM 0 HB3 ASP A 38 10.875 1.024 7.187 1.00 0.00 H new ATOM 539 N GLN A 39 12.887 -1.413 6.773 1.00 0.00 N ATOM 540 CA GLN A 39 13.334 -2.762 7.097 1.00 0.00 C ATOM 541 C GLN A 39 13.962 -3.434 5.880 1.00 0.00 C ATOM 542 O GLN A 39 13.938 -4.658 5.752 1.00 0.00 O ATOM 543 CB GLN A 39 12.162 -3.601 7.609 1.00 0.00 C ATOM 544 CG GLN A 39 11.963 -3.515 9.113 1.00 0.00 C ATOM 545 CD GLN A 39 12.942 -4.381 9.882 1.00 0.00 C ATOM 546 OE1 GLN A 39 12.703 -5.570 10.092 1.00 0.00 O ATOM 547 NE2 GLN A 39 14.052 -3.787 10.306 1.00 0.00 N ATOM 0 H GLN A 39 12.027 -1.373 6.225 1.00 0.00 H new ATOM 0 HA GLN A 39 14.089 -2.689 7.880 1.00 0.00 H new ATOM 0 HB2 GLN A 39 11.249 -3.276 7.111 1.00 0.00 H new ATOM 0 HB3 GLN A 39 12.323 -4.643 7.331 1.00 0.00 H new ATOM 0 HG2 GLN A 39 12.073 -2.478 9.431 1.00 0.00 H new ATOM 0 HG3 GLN A 39 10.945 -3.818 9.359 1.00 0.00 H new ATOM 0 HE21 GLN A 39 14.209 -2.799 10.109 1.00 0.00 H new ATOM 0 HE22 GLN A 39 14.748 -4.319 10.829 1.00 0.00 H new ATOM 556 N LYS A 40 14.524 -2.625 4.988 1.00 0.00 N ATOM 557 CA LYS A 40 15.160 -3.140 3.781 1.00 0.00 C ATOM 558 C LYS A 40 14.414 -4.361 3.252 1.00 0.00 C ATOM 559 O LYS A 40 15.028 -5.350 2.854 1.00 0.00 O ATOM 560 CB LYS A 40 16.619 -3.504 4.064 1.00 0.00 C ATOM 561 CG LYS A 40 17.554 -2.307 4.067 1.00 0.00 C ATOM 562 CD LYS A 40 17.403 -1.484 5.335 1.00 0.00 C ATOM 563 CE LYS A 40 18.424 -0.358 5.395 1.00 0.00 C ATOM 564 NZ LYS A 40 19.696 -0.797 6.032 1.00 0.00 N ATOM 0 H LYS A 40 14.552 -1.609 5.078 1.00 0.00 H new ATOM 0 HA LYS A 40 15.128 -2.359 3.022 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.679 -4.004 5.031 1.00 0.00 H new ATOM 0 HB3 LYS A 40 16.959 -4.218 3.314 1.00 0.00 H new ATOM 0 HG2 LYS A 40 18.585 -2.649 3.975 1.00 0.00 H new ATOM 0 HG3 LYS A 40 17.347 -1.681 3.199 1.00 0.00 H new ATOM 0 HD2 LYS A 40 16.397 -1.067 5.381 1.00 0.00 H new ATOM 0 HD3 LYS A 40 17.521 -2.130 6.205 1.00 0.00 H new ATOM 0 HE2 LYS A 40 18.628 0.002 4.386 1.00 0.00 H new ATOM 0 HE3 LYS A 40 18.008 0.480 5.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 20.366 -0.002 6.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 19.506 -1.116 7.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 20.106 -1.580 5.484 1.00 0.00 H new ATOM 578 N MET A 41 13.087 -4.283 3.248 1.00 0.00 N ATOM 579 CA MET A 41 12.259 -5.381 2.765 1.00 0.00 C ATOM 580 C MET A 41 11.147 -4.865 1.857 1.00 0.00 C ATOM 581 O MET A 41 10.698 -3.725 1.973 1.00 0.00 O ATOM 582 CB MET A 41 11.656 -6.150 3.942 1.00 0.00 C ATOM 583 CG MET A 41 10.418 -5.490 4.529 1.00 0.00 C ATOM 584 SD MET A 41 9.528 -6.571 5.665 1.00 0.00 S ATOM 585 CE MET A 41 8.527 -7.516 4.519 1.00 0.00 C ATOM 0 H MET A 41 12.563 -3.471 3.574 1.00 0.00 H new ATOM 0 HA MET A 41 12.893 -6.054 2.187 1.00 0.00 H new ATOM 0 HB2 MET A 41 11.400 -7.157 3.614 1.00 0.00 H new ATOM 0 HB3 MET A 41 12.409 -6.251 4.724 1.00 0.00 H new ATOM 0 HG2 MET A 41 10.710 -4.580 5.053 1.00 0.00 H new ATOM 0 HG3 MET A 41 9.751 -5.192 3.720 1.00 0.00 H new ATOM 0 HE1 MET A 41 8.287 -8.484 4.958 1.00 0.00 H new ATOM 0 HE2 MET A 41 7.605 -6.974 4.309 1.00 0.00 H new ATOM 0 HE3 MET A 41 9.079 -7.665 3.591 1.00 0.00 H new ATOM 595 N PRO A 42 10.693 -5.722 0.930 1.00 0.00 N ATOM 596 CA PRO A 42 9.628 -5.373 -0.016 1.00 0.00 C ATOM 597 C PRO A 42 8.271 -5.236 0.665 1.00 0.00 C ATOM 598 O PRO A 42 8.014 -5.863 1.693 1.00 0.00 O ATOM 599 CB PRO A 42 9.621 -6.553 -0.991 1.00 0.00 C ATOM 600 CG PRO A 42 10.178 -7.693 -0.211 1.00 0.00 C ATOM 601 CD PRO A 42 11.183 -7.096 0.734 1.00 0.00 C ATOM 0 HA PRO A 42 9.805 -4.409 -0.493 1.00 0.00 H new ATOM 0 HB2 PRO A 42 8.612 -6.770 -1.343 1.00 0.00 H new ATOM 0 HB3 PRO A 42 10.228 -6.342 -1.872 1.00 0.00 H new ATOM 0 HG2 PRO A 42 9.391 -8.214 0.334 1.00 0.00 H new ATOM 0 HG3 PRO A 42 10.647 -8.424 -0.869 1.00 0.00 H new ATOM 0 HD2 PRO A 42 11.226 -7.645 1.675 1.00 0.00 H new ATOM 0 HD3 PRO A 42 12.188 -7.108 0.312 1.00 0.00 H new ATOM 609 N VAL A 43 7.404 -4.412 0.085 1.00 0.00 N ATOM 610 CA VAL A 43 6.071 -4.194 0.634 1.00 0.00 C ATOM 611 C VAL A 43 5.095 -5.260 0.148 1.00 0.00 C ATOM 612 O VAL A 43 4.756 -5.312 -1.034 1.00 0.00 O ATOM 613 CB VAL A 43 5.528 -2.804 0.254 1.00 0.00 C ATOM 614 CG1 VAL A 43 4.214 -2.530 0.971 1.00 0.00 C ATOM 615 CG2 VAL A 43 6.553 -1.726 0.573 1.00 0.00 C ATOM 0 H VAL A 43 7.601 -3.884 -0.765 1.00 0.00 H new ATOM 0 HA VAL A 43 6.161 -4.256 1.718 1.00 0.00 H new ATOM 0 HB VAL A 43 5.339 -2.788 -0.819 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.845 -1.543 0.690 1.00 0.00 H new ATOM 0 HG12 VAL A 43 3.481 -3.285 0.688 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.373 -2.565 2.049 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.152 -0.750 0.298 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.775 -1.739 1.640 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.467 -1.915 0.010 1.00 0.00 H new ATOM 625 N ILE A 44 4.646 -6.107 1.068 1.00 0.00 N ATOM 626 CA ILE A 44 3.707 -7.170 0.733 1.00 0.00 C ATOM 627 C ILE A 44 2.430 -7.056 1.559 1.00 0.00 C ATOM 628 O ILE A 44 2.477 -6.807 2.764 1.00 0.00 O ATOM 629 CB ILE A 44 4.328 -8.561 0.959 1.00 0.00 C ATOM 630 CG1 ILE A 44 5.598 -8.719 0.120 1.00 0.00 C ATOM 631 CG2 ILE A 44 3.323 -9.652 0.618 1.00 0.00 C ATOM 632 CD1 ILE A 44 6.799 -8.007 0.702 1.00 0.00 C ATOM 0 H ILE A 44 4.917 -6.078 2.051 1.00 0.00 H new ATOM 0 HA ILE A 44 3.465 -7.056 -0.324 1.00 0.00 H new ATOM 0 HB ILE A 44 4.596 -8.656 2.011 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.828 -9.780 0.020 1.00 0.00 H new ATOM 0 HG13 ILE A 44 5.411 -8.337 -0.884 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.777 -10.629 0.783 1.00 0.00 H new ATOM 0 HG22 ILE A 44 2.444 -9.548 1.254 1.00 0.00 H new ATOM 0 HG23 ILE A 44 3.028 -9.561 -0.427 1.00 0.00 H new ATOM 0 HD11 ILE A 44 7.663 -8.162 0.055 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.589 -6.940 0.777 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.012 -8.405 1.694 1.00 0.00 H new ATOM 644 N VAL A 45 1.289 -7.242 0.903 1.00 0.00 N ATOM 645 CA VAL A 45 -0.002 -7.163 1.576 1.00 0.00 C ATOM 646 C VAL A 45 -0.085 -8.163 2.724 1.00 0.00 C ATOM 647 O VAL A 45 -0.135 -9.373 2.504 1.00 0.00 O ATOM 648 CB VAL A 45 -1.162 -7.424 0.598 1.00 0.00 C ATOM 649 CG1 VAL A 45 -2.435 -7.766 1.357 1.00 0.00 C ATOM 650 CG2 VAL A 45 -1.378 -6.219 -0.305 1.00 0.00 C ATOM 0 H VAL A 45 1.233 -7.449 -0.094 1.00 0.00 H new ATOM 0 HA VAL A 45 -0.091 -6.151 1.972 1.00 0.00 H new ATOM 0 HB VAL A 45 -0.901 -8.277 -0.028 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -3.243 -7.947 0.649 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -2.271 -8.661 1.957 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -2.704 -6.935 2.010 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -2.202 -6.421 -0.990 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.617 -5.347 0.303 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -0.470 -6.025 -0.876 1.00 0.00 H new ATOM 660 N SER A 46 -0.099 -7.649 3.950 1.00 0.00 N ATOM 661 CA SER A 46 -0.173 -8.497 5.133 1.00 0.00 C ATOM 662 C SER A 46 -1.490 -9.266 5.170 1.00 0.00 C ATOM 663 O SER A 46 -1.516 -10.484 4.989 1.00 0.00 O ATOM 664 CB SER A 46 -0.027 -7.653 6.401 1.00 0.00 C ATOM 665 OG SER A 46 0.321 -8.460 7.513 1.00 0.00 O ATOM 0 H SER A 46 -0.060 -6.649 4.149 1.00 0.00 H new ATOM 0 HA SER A 46 0.646 -9.215 5.086 1.00 0.00 H new ATOM 0 HB2 SER A 46 0.736 -6.890 6.248 1.00 0.00 H new ATOM 0 HB3 SER A 46 -0.962 -7.132 6.604 1.00 0.00 H new ATOM 0 HG SER A 46 0.410 -7.897 8.310 1.00 0.00 H new ATOM 671 N ARG A 47 -2.582 -8.546 5.405 1.00 0.00 N ATOM 672 CA ARG A 47 -3.903 -9.160 5.466 1.00 0.00 C ATOM 673 C ARG A 47 -4.895 -8.405 4.585 1.00 0.00 C ATOM 674 O ARG A 47 -4.687 -7.237 4.258 1.00 0.00 O ATOM 675 CB ARG A 47 -4.408 -9.190 6.910 1.00 0.00 C ATOM 676 CG ARG A 47 -5.361 -10.339 7.198 1.00 0.00 C ATOM 677 CD ARG A 47 -4.607 -11.622 7.512 1.00 0.00 C ATOM 678 NE ARG A 47 -5.497 -12.677 7.989 1.00 0.00 N ATOM 679 CZ ARG A 47 -5.076 -13.757 8.638 1.00 0.00 C ATOM 680 NH1 ARG A 47 -3.784 -13.923 8.885 1.00 0.00 N ATOM 681 NH2 ARG A 47 -5.947 -14.673 9.041 1.00 0.00 N ATOM 0 H ARG A 47 -2.578 -7.537 5.556 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.819 -10.182 5.096 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.554 -9.260 7.583 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -4.911 -8.248 7.130 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -6.004 -10.078 8.039 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -6.011 -10.499 6.338 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -4.086 -11.964 6.618 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -3.847 -11.420 8.267 1.00 0.00 H new ATOM 0 HE ARG A 47 -6.497 -12.579 7.814 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -3.111 -13.221 8.577 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -3.463 -14.753 9.383 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -6.942 -14.549 8.853 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -5.622 -15.502 9.539 1.00 0.00 H new ATOM 695 N VAL A 48 -5.973 -9.082 4.203 1.00 0.00 N ATOM 696 CA VAL A 48 -6.997 -8.476 3.360 1.00 0.00 C ATOM 697 C VAL A 48 -8.382 -8.638 3.976 1.00 0.00 C ATOM 698 O VAL A 48 -8.862 -9.755 4.165 1.00 0.00 O ATOM 699 CB VAL A 48 -7.000 -9.093 1.949 1.00 0.00 C ATOM 700 CG1 VAL A 48 -8.046 -8.420 1.074 1.00 0.00 C ATOM 701 CG2 VAL A 48 -5.619 -8.987 1.319 1.00 0.00 C ATOM 0 H VAL A 48 -6.160 -10.050 4.464 1.00 0.00 H new ATOM 0 HA VAL A 48 -6.758 -7.415 3.284 1.00 0.00 H new ATOM 0 HB VAL A 48 -7.256 -10.149 2.034 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -8.033 -8.869 0.081 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -9.032 -8.552 1.519 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -7.823 -7.356 0.994 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.639 -9.428 0.322 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -5.332 -7.938 1.246 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.896 -9.519 1.937 1.00 0.00 H new ATOM 711 N ALA A 49 -9.020 -7.514 4.287 1.00 0.00 N ATOM 712 CA ALA A 49 -10.352 -7.531 4.880 1.00 0.00 C ATOM 713 C ALA A 49 -11.426 -7.701 3.811 1.00 0.00 C ATOM 714 O ALA A 49 -11.299 -7.216 2.686 1.00 0.00 O ATOM 715 CB ALA A 49 -10.592 -6.256 5.674 1.00 0.00 C ATOM 0 H ALA A 49 -8.636 -6.581 4.138 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.411 -8.384 5.556 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -11.590 -6.282 6.111 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -9.850 -6.177 6.468 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -10.508 -5.394 5.012 1.00 0.00 H new ATOM 721 N PRO A 50 -12.510 -8.406 4.167 1.00 0.00 N ATOM 722 CA PRO A 50 -13.628 -8.656 3.252 1.00 0.00 C ATOM 723 C PRO A 50 -14.427 -7.392 2.954 1.00 0.00 C ATOM 724 O PRO A 50 -14.354 -6.411 3.692 1.00 0.00 O ATOM 725 CB PRO A 50 -14.490 -9.666 4.012 1.00 0.00 C ATOM 726 CG PRO A 50 -14.173 -9.429 5.449 1.00 0.00 C ATOM 727 CD PRO A 50 -12.729 -9.012 5.491 1.00 0.00 C ATOM 0 HA PRO A 50 -13.287 -9.012 2.280 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -15.550 -9.513 3.810 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -14.254 -10.689 3.718 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -14.815 -8.654 5.868 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -14.336 -10.331 6.039 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -12.539 -8.301 6.295 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -12.069 -9.864 5.657 1.00 0.00 H new ATOM 735 N GLY A 51 -15.191 -7.423 1.866 1.00 0.00 N ATOM 736 CA GLY A 51 -15.993 -6.273 1.490 1.00 0.00 C ATOM 737 C GLY A 51 -15.149 -5.050 1.190 1.00 0.00 C ATOM 738 O GLY A 51 -15.520 -3.929 1.539 1.00 0.00 O ATOM 0 H GLY A 51 -15.269 -8.223 1.239 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -16.591 -6.522 0.613 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -16.690 -6.041 2.295 1.00 0.00 H new ATOM 742 N THR A 52 -14.008 -5.265 0.542 1.00 0.00 N ATOM 743 CA THR A 52 -13.108 -4.172 0.198 1.00 0.00 C ATOM 744 C THR A 52 -12.866 -4.112 -1.306 1.00 0.00 C ATOM 745 O THR A 52 -12.941 -5.118 -2.012 1.00 0.00 O ATOM 746 CB THR A 52 -11.754 -4.311 0.919 1.00 0.00 C ATOM 747 OG1 THR A 52 -11.121 -5.539 0.541 1.00 0.00 O ATOM 748 CG2 THR A 52 -11.939 -4.275 2.429 1.00 0.00 C ATOM 0 H THR A 52 -13.686 -6.186 0.245 1.00 0.00 H new ATOM 0 HA THR A 52 -13.591 -3.251 0.523 1.00 0.00 H new ATOM 0 HB THR A 52 -11.123 -3.472 0.625 1.00 0.00 H new ATOM 0 HG1 THR A 52 -11.176 -6.177 1.283 1.00 0.00 H new ATOM 0 HG21 THR A 52 -10.969 -4.375 2.917 1.00 0.00 H new ATOM 0 HG22 THR A 52 -12.394 -3.328 2.717 1.00 0.00 H new ATOM 0 HG23 THR A 52 -12.586 -5.097 2.736 1.00 0.00 H new ATOM 756 N PRO A 53 -12.568 -2.905 -1.810 1.00 0.00 N ATOM 757 CA PRO A 53 -12.307 -2.685 -3.236 1.00 0.00 C ATOM 758 C PRO A 53 -10.990 -3.308 -3.687 1.00 0.00 C ATOM 759 O PRO A 53 -10.592 -3.170 -4.843 1.00 0.00 O ATOM 760 CB PRO A 53 -12.246 -1.161 -3.354 1.00 0.00 C ATOM 761 CG PRO A 53 -11.849 -0.691 -1.998 1.00 0.00 C ATOM 762 CD PRO A 53 -12.462 -1.662 -1.027 1.00 0.00 C ATOM 0 HA PRO A 53 -13.069 -3.145 -3.866 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -11.522 -0.851 -4.108 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -13.211 -0.748 -3.649 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -10.764 -0.669 -1.895 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.208 0.322 -1.816 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -11.838 -1.795 -0.144 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -13.437 -1.321 -0.679 1.00 0.00 H new ATOM 770 N ALA A 54 -10.319 -3.993 -2.767 1.00 0.00 N ATOM 771 CA ALA A 54 -9.048 -4.639 -3.072 1.00 0.00 C ATOM 772 C ALA A 54 -9.235 -6.133 -3.309 1.00 0.00 C ATOM 773 O ALA A 54 -8.375 -6.790 -3.897 1.00 0.00 O ATOM 774 CB ALA A 54 -8.053 -4.402 -1.946 1.00 0.00 C ATOM 0 H ALA A 54 -10.634 -4.115 -1.805 1.00 0.00 H new ATOM 0 HA ALA A 54 -8.655 -4.199 -3.988 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -7.108 -4.890 -2.187 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -7.888 -3.331 -1.825 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -8.449 -4.815 -1.018 1.00 0.00 H new ATOM 780 N ASP A 55 -10.362 -6.665 -2.848 1.00 0.00 N ATOM 781 CA ASP A 55 -10.661 -8.083 -3.011 1.00 0.00 C ATOM 782 C ASP A 55 -11.638 -8.303 -4.161 1.00 0.00 C ATOM 783 O ASP A 55 -11.303 -8.939 -5.162 1.00 0.00 O ATOM 784 CB ASP A 55 -11.241 -8.655 -1.716 1.00 0.00 C ATOM 785 CG ASP A 55 -10.919 -10.126 -1.539 1.00 0.00 C ATOM 786 OD1 ASP A 55 -9.720 -10.466 -1.468 1.00 0.00 O ATOM 787 OD2 ASP A 55 -11.866 -10.937 -1.472 1.00 0.00 O ATOM 0 H ASP A 55 -11.083 -6.136 -2.359 1.00 0.00 H new ATOM 0 HA ASP A 55 -9.731 -8.601 -3.244 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -10.849 -8.095 -0.867 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -12.323 -8.520 -1.715 1.00 0.00 H new ATOM 792 N LEU A 56 -12.848 -7.775 -4.013 1.00 0.00 N ATOM 793 CA LEU A 56 -13.875 -7.914 -5.039 1.00 0.00 C ATOM 794 C LEU A 56 -13.302 -7.635 -6.425 1.00 0.00 C ATOM 795 O LEU A 56 -13.731 -8.227 -7.416 1.00 0.00 O ATOM 796 CB LEU A 56 -15.040 -6.964 -4.755 1.00 0.00 C ATOM 797 CG LEU A 56 -15.707 -7.110 -3.387 1.00 0.00 C ATOM 798 CD1 LEU A 56 -16.475 -5.847 -3.031 1.00 0.00 C ATOM 799 CD2 LEU A 56 -16.629 -8.320 -3.369 1.00 0.00 C ATOM 0 H LEU A 56 -13.142 -7.246 -3.192 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.239 -8.941 -5.017 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.680 -5.940 -4.854 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.798 -7.111 -5.524 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.929 -7.261 -2.639 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -16.943 -5.969 -2.054 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -15.789 -5.000 -3.002 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -17.244 -5.665 -3.782 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -17.095 -8.408 -2.387 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -17.402 -8.200 -4.128 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -16.052 -9.220 -3.579 1.00 0.00 H new ATOM 811 N CYS A 57 -12.330 -6.731 -6.486 1.00 0.00 N ATOM 812 CA CYS A 57 -11.696 -6.374 -7.750 1.00 0.00 C ATOM 813 C CYS A 57 -11.026 -7.589 -8.385 1.00 0.00 C ATOM 814 O CYS A 57 -10.776 -8.592 -7.717 1.00 0.00 O ATOM 815 CB CYS A 57 -10.667 -5.264 -7.533 1.00 0.00 C ATOM 816 SG CYS A 57 -9.234 -5.768 -6.551 1.00 0.00 S ATOM 0 H CYS A 57 -11.964 -6.232 -5.675 1.00 0.00 H new ATOM 0 HA CYS A 57 -12.470 -6.014 -8.427 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -10.322 -4.908 -8.504 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -11.154 -4.423 -7.040 1.00 0.00 H new ATOM 0 HG CYS A 57 -8.663 -6.793 -7.111 1.00 0.00 H new ATOM 822 N VAL A 58 -10.739 -7.491 -9.679 1.00 0.00 N ATOM 823 CA VAL A 58 -10.098 -8.582 -10.404 1.00 0.00 C ATOM 824 C VAL A 58 -8.822 -8.109 -11.092 1.00 0.00 C ATOM 825 O VAL A 58 -8.825 -7.162 -11.878 1.00 0.00 O ATOM 826 CB VAL A 58 -11.044 -9.185 -11.460 1.00 0.00 C ATOM 827 CG1 VAL A 58 -10.319 -10.235 -12.289 1.00 0.00 C ATOM 828 CG2 VAL A 58 -12.277 -9.777 -10.794 1.00 0.00 C ATOM 0 H VAL A 58 -10.940 -6.668 -10.247 1.00 0.00 H new ATOM 0 HA VAL A 58 -9.849 -9.348 -9.670 1.00 0.00 H new ATOM 0 HB VAL A 58 -11.368 -8.389 -12.130 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -11.003 -10.650 -13.030 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -9.470 -9.776 -12.796 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -9.964 -11.032 -11.636 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -12.934 -10.198 -11.555 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -11.975 -10.562 -10.100 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -12.807 -8.996 -10.249 1.00 0.00 H new ATOM 838 N PRO A 59 -7.703 -8.785 -10.790 1.00 0.00 N ATOM 839 CA PRO A 59 -7.688 -9.914 -9.855 1.00 0.00 C ATOM 840 C PRO A 59 -7.929 -9.477 -8.414 1.00 0.00 C ATOM 841 O PRO A 59 -7.891 -8.287 -8.102 1.00 0.00 O ATOM 842 CB PRO A 59 -6.276 -10.485 -10.011 1.00 0.00 C ATOM 843 CG PRO A 59 -5.454 -9.337 -10.487 1.00 0.00 C ATOM 844 CD PRO A 59 -6.367 -8.498 -11.338 1.00 0.00 C ATOM 0 HA PRO A 59 -8.479 -10.632 -10.070 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -5.900 -10.876 -9.065 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -6.258 -11.308 -10.726 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -5.065 -8.761 -9.647 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -4.595 -9.684 -11.061 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -6.122 -7.438 -11.266 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -6.298 -8.770 -12.391 1.00 0.00 H new ATOM 852 N ARG A 60 -8.177 -10.447 -7.540 1.00 0.00 N ATOM 853 CA ARG A 60 -8.425 -10.161 -6.132 1.00 0.00 C ATOM 854 C ARG A 60 -7.116 -10.089 -5.353 1.00 0.00 C ATOM 855 O ARG A 60 -6.353 -11.055 -5.308 1.00 0.00 O ATOM 856 CB ARG A 60 -9.334 -11.232 -5.525 1.00 0.00 C ATOM 857 CG ARG A 60 -9.528 -11.087 -4.025 1.00 0.00 C ATOM 858 CD ARG A 60 -9.821 -12.428 -3.369 1.00 0.00 C ATOM 859 NE ARG A 60 -8.601 -13.105 -2.938 1.00 0.00 N ATOM 860 CZ ARG A 60 -8.531 -14.409 -2.696 1.00 0.00 C ATOM 861 NH1 ARG A 60 -9.604 -15.173 -2.843 1.00 0.00 N ATOM 862 NH2 ARG A 60 -7.384 -14.952 -2.306 1.00 0.00 N ATOM 0 H ARG A 60 -8.212 -11.437 -7.782 1.00 0.00 H new ATOM 0 HA ARG A 60 -8.921 -9.193 -6.066 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -10.307 -11.191 -6.014 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -8.913 -12.215 -5.735 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -8.632 -10.652 -3.582 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -10.349 -10.397 -3.828 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -10.474 -12.276 -2.510 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -10.360 -13.065 -4.071 1.00 0.00 H new ATOM 0 HE ARG A 60 -7.757 -12.546 -2.816 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -10.487 -14.760 -3.143 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -9.547 -16.174 -2.656 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -6.556 -14.368 -2.192 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -7.331 -15.954 -2.120 1.00 0.00 H new ATOM 876 N LEU A 61 -6.860 -8.938 -4.741 1.00 0.00 N ATOM 877 CA LEU A 61 -5.642 -8.738 -3.964 1.00 0.00 C ATOM 878 C LEU A 61 -5.609 -9.668 -2.755 1.00 0.00 C ATOM 879 O LEU A 61 -6.407 -9.527 -1.829 1.00 0.00 O ATOM 880 CB LEU A 61 -5.540 -7.283 -3.505 1.00 0.00 C ATOM 881 CG LEU A 61 -4.141 -6.796 -3.122 1.00 0.00 C ATOM 882 CD1 LEU A 61 -3.298 -6.564 -4.366 1.00 0.00 C ATOM 883 CD2 LEU A 61 -4.228 -5.526 -2.289 1.00 0.00 C ATOM 0 H LEU A 61 -7.480 -8.129 -4.768 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.790 -8.972 -4.603 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.920 -6.644 -4.302 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.198 -7.147 -2.647 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.660 -7.568 -2.521 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.306 -6.218 -4.074 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.208 -7.496 -4.923 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.775 -5.811 -4.993 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.224 -5.194 -2.026 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -4.728 -4.747 -2.864 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.794 -5.726 -1.379 1.00 0.00 H new ATOM 895 N ASN A 62 -4.679 -10.618 -2.771 1.00 0.00 N ATOM 896 CA ASN A 62 -4.541 -11.570 -1.675 1.00 0.00 C ATOM 897 C ASN A 62 -3.179 -11.431 -1.003 1.00 0.00 C ATOM 898 O ASN A 62 -2.282 -10.770 -1.526 1.00 0.00 O ATOM 899 CB ASN A 62 -4.726 -13.000 -2.188 1.00 0.00 C ATOM 900 CG ASN A 62 -3.454 -13.568 -2.788 1.00 0.00 C ATOM 901 OD1 ASN A 62 -2.655 -14.197 -2.094 1.00 0.00 O ATOM 902 ND2 ASN A 62 -3.260 -13.347 -4.083 1.00 0.00 N ATOM 0 H ASN A 62 -4.011 -10.749 -3.530 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.314 -11.353 -0.938 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -5.054 -13.638 -1.367 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -5.516 -13.015 -2.938 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -2.422 -13.704 -4.541 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -3.949 -12.820 -4.619 1.00 0.00 H new ATOM 909 N GLU A 63 -3.032 -12.060 0.159 1.00 0.00 N ATOM 910 CA GLU A 63 -1.778 -12.006 0.903 1.00 0.00 C ATOM 911 C GLU A 63 -0.636 -12.606 0.089 1.00 0.00 C ATOM 912 O GLU A 63 -0.771 -13.684 -0.490 1.00 0.00 O ATOM 913 CB GLU A 63 -1.917 -12.749 2.233 1.00 0.00 C ATOM 914 CG GLU A 63 -3.076 -12.261 3.086 1.00 0.00 C ATOM 915 CD GLU A 63 -3.325 -13.144 4.293 1.00 0.00 C ATOM 916 OE1 GLU A 63 -2.456 -13.183 5.189 1.00 0.00 O ATOM 917 OE2 GLU A 63 -4.388 -13.797 4.342 1.00 0.00 O ATOM 0 H GLU A 63 -3.764 -12.612 0.605 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.548 -10.959 1.102 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -2.047 -13.813 2.033 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -0.991 -12.642 2.798 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.873 -11.244 3.421 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -3.979 -12.222 2.477 1.00 0.00 H new ATOM 924 N GLY A 64 0.490 -11.900 0.049 1.00 0.00 N ATOM 925 CA GLY A 64 1.639 -12.378 -0.697 1.00 0.00 C ATOM 926 C GLY A 64 2.066 -11.412 -1.785 1.00 0.00 C ATOM 927 O GLY A 64 3.251 -11.312 -2.105 1.00 0.00 O ATOM 0 H GLY A 64 0.627 -11.006 0.520 1.00 0.00 H new ATOM 0 HA2 GLY A 64 2.471 -12.540 -0.012 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.402 -13.343 -1.145 1.00 0.00 H new ATOM 931 N ASP A 65 1.100 -10.701 -2.356 1.00 0.00 N ATOM 932 CA ASP A 65 1.382 -9.739 -3.415 1.00 0.00 C ATOM 933 C ASP A 65 2.502 -8.789 -3.001 1.00 0.00 C ATOM 934 O ASP A 65 2.464 -8.205 -1.919 1.00 0.00 O ATOM 935 CB ASP A 65 0.122 -8.944 -3.759 1.00 0.00 C ATOM 936 CG ASP A 65 -0.458 -8.229 -2.555 1.00 0.00 C ATOM 937 OD1 ASP A 65 0.227 -7.341 -2.004 1.00 0.00 O ATOM 938 OD2 ASP A 65 -1.598 -8.555 -2.164 1.00 0.00 O ATOM 0 H ASP A 65 0.114 -10.773 -2.103 1.00 0.00 H new ATOM 0 HA ASP A 65 1.706 -10.291 -4.298 1.00 0.00 H new ATOM 0 HB2 ASP A 65 0.357 -8.214 -4.533 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -0.628 -9.618 -4.173 1.00 0.00 H new ATOM 943 N GLN A 66 3.496 -8.640 -3.871 1.00 0.00 N ATOM 944 CA GLN A 66 4.627 -7.762 -3.595 1.00 0.00 C ATOM 945 C GLN A 66 4.560 -6.503 -4.453 1.00 0.00 C ATOM 946 O GLN A 66 4.853 -6.538 -5.648 1.00 0.00 O ATOM 947 CB GLN A 66 5.944 -8.497 -3.848 1.00 0.00 C ATOM 948 CG GLN A 66 7.174 -7.624 -3.660 1.00 0.00 C ATOM 949 CD GLN A 66 8.426 -8.431 -3.380 1.00 0.00 C ATOM 950 OE1 GLN A 66 8.499 -9.162 -2.391 1.00 0.00 O ATOM 951 NE2 GLN A 66 9.420 -8.305 -4.251 1.00 0.00 N ATOM 0 H GLN A 66 3.541 -9.116 -4.772 1.00 0.00 H new ATOM 0 HA GLN A 66 4.579 -7.468 -2.546 1.00 0.00 H new ATOM 0 HB2 GLN A 66 6.009 -9.351 -3.174 1.00 0.00 H new ATOM 0 HB3 GLN A 66 5.941 -8.892 -4.864 1.00 0.00 H new ATOM 0 HG2 GLN A 66 7.327 -7.022 -4.555 1.00 0.00 H new ATOM 0 HG3 GLN A 66 7.001 -6.932 -2.836 1.00 0.00 H new ATOM 0 HE21 GLN A 66 9.317 -7.688 -5.057 1.00 0.00 H new ATOM 0 HE22 GLN A 66 10.287 -8.825 -4.114 1.00 0.00 H new ATOM 960 N VAL A 67 4.173 -5.391 -3.835 1.00 0.00 N ATOM 961 CA VAL A 67 4.069 -4.120 -4.542 1.00 0.00 C ATOM 962 C VAL A 67 5.445 -3.602 -4.945 1.00 0.00 C ATOM 963 O VAL A 67 6.354 -3.513 -4.119 1.00 0.00 O ATOM 964 CB VAL A 67 3.363 -3.056 -3.682 1.00 0.00 C ATOM 965 CG1 VAL A 67 3.150 -1.779 -4.480 1.00 0.00 C ATOM 966 CG2 VAL A 67 2.041 -3.591 -3.152 1.00 0.00 C ATOM 0 H VAL A 67 3.926 -5.345 -2.846 1.00 0.00 H new ATOM 0 HA VAL A 67 3.476 -4.303 -5.438 1.00 0.00 H new ATOM 0 HB VAL A 67 4.001 -2.821 -2.830 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.650 -1.039 -3.855 1.00 0.00 H new ATOM 0 HG12 VAL A 67 4.114 -1.388 -4.805 1.00 0.00 H new ATOM 0 HG13 VAL A 67 2.533 -1.994 -5.353 1.00 0.00 H new ATOM 0 HG21 VAL A 67 1.555 -2.826 -2.546 1.00 0.00 H new ATOM 0 HG22 VAL A 67 1.394 -3.856 -3.988 1.00 0.00 H new ATOM 0 HG23 VAL A 67 2.225 -4.475 -2.541 1.00 0.00 H new ATOM 976 N VAL A 68 5.592 -3.259 -6.221 1.00 0.00 N ATOM 977 CA VAL A 68 6.856 -2.746 -6.735 1.00 0.00 C ATOM 978 C VAL A 68 6.731 -1.283 -7.143 1.00 0.00 C ATOM 979 O VAL A 68 7.586 -0.460 -6.814 1.00 0.00 O ATOM 980 CB VAL A 68 7.344 -3.566 -7.944 1.00 0.00 C ATOM 981 CG1 VAL A 68 8.729 -3.108 -8.376 1.00 0.00 C ATOM 982 CG2 VAL A 68 7.344 -5.051 -7.615 1.00 0.00 C ATOM 0 H VAL A 68 4.850 -3.327 -6.918 1.00 0.00 H new ATOM 0 HA VAL A 68 7.584 -2.833 -5.929 1.00 0.00 H new ATOM 0 HB VAL A 68 6.657 -3.401 -8.774 1.00 0.00 H new ATOM 0 HG11 VAL A 68 9.057 -3.699 -9.231 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.694 -2.055 -8.655 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.430 -3.242 -7.552 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.692 -5.615 -8.480 1.00 0.00 H new ATOM 0 HG22 VAL A 68 8.008 -5.237 -6.770 1.00 0.00 H new ATOM 0 HG23 VAL A 68 6.333 -5.367 -7.358 1.00 0.00 H new ATOM 992 N LEU A 69 5.661 -0.965 -7.863 1.00 0.00 N ATOM 993 CA LEU A 69 5.422 0.400 -8.317 1.00 0.00 C ATOM 994 C LEU A 69 3.946 0.765 -8.195 1.00 0.00 C ATOM 995 O LEU A 69 3.073 0.014 -8.631 1.00 0.00 O ATOM 996 CB LEU A 69 5.881 0.564 -9.767 1.00 0.00 C ATOM 997 CG LEU A 69 7.381 0.406 -10.018 1.00 0.00 C ATOM 998 CD1 LEU A 69 7.664 0.292 -11.508 1.00 0.00 C ATOM 999 CD2 LEU A 69 8.148 1.574 -9.416 1.00 0.00 C ATOM 0 H LEU A 69 4.945 -1.634 -8.145 1.00 0.00 H new ATOM 0 HA LEU A 69 5.997 1.073 -7.681 1.00 0.00 H new ATOM 0 HB2 LEU A 69 5.352 -0.166 -10.379 1.00 0.00 H new ATOM 0 HB3 LEU A 69 5.577 1.552 -10.114 1.00 0.00 H new ATOM 0 HG LEU A 69 7.716 -0.511 -9.534 1.00 0.00 H new ATOM 0 HD11 LEU A 69 8.737 0.180 -11.667 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.145 -0.577 -11.912 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.314 1.191 -12.015 1.00 0.00 H new ATOM 0 HD21 LEU A 69 9.214 1.445 -9.604 1.00 0.00 H new ATOM 0 HD22 LEU A 69 7.809 2.505 -9.871 1.00 0.00 H new ATOM 0 HD23 LEU A 69 7.971 1.610 -8.341 1.00 0.00 H new ATOM 1011 N ILE A 70 3.675 1.922 -7.600 1.00 0.00 N ATOM 1012 CA ILE A 70 2.305 2.387 -7.424 1.00 0.00 C ATOM 1013 C ILE A 70 1.958 3.473 -8.437 1.00 0.00 C ATOM 1014 O ILE A 70 2.411 4.611 -8.322 1.00 0.00 O ATOM 1015 CB ILE A 70 2.075 2.935 -6.003 1.00 0.00 C ATOM 1016 CG1 ILE A 70 2.152 1.802 -4.978 1.00 0.00 C ATOM 1017 CG2 ILE A 70 0.730 3.642 -5.919 1.00 0.00 C ATOM 1018 CD1 ILE A 70 2.259 2.286 -3.549 1.00 0.00 C ATOM 0 H ILE A 70 4.386 2.554 -7.232 1.00 0.00 H new ATOM 0 HA ILE A 70 1.657 1.525 -7.582 1.00 0.00 H new ATOM 0 HB ILE A 70 2.858 3.658 -5.777 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.266 1.174 -5.075 1.00 0.00 H new ATOM 0 HG13 ILE A 70 3.014 1.175 -5.206 1.00 0.00 H new ATOM 0 HG21 ILE A 70 0.582 4.024 -4.909 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.710 4.471 -6.627 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.067 2.939 -6.161 1.00 0.00 H new ATOM 0 HD11 ILE A 70 2.309 1.429 -2.877 1.00 0.00 H new ATOM 0 HD12 ILE A 70 3.160 2.889 -3.436 1.00 0.00 H new ATOM 0 HD13 ILE A 70 1.385 2.889 -3.303 1.00 0.00 H new ATOM 1030 N ASN A 71 1.150 3.113 -9.429 1.00 0.00 N ATOM 1031 CA ASN A 71 0.741 4.057 -10.463 1.00 0.00 C ATOM 1032 C ASN A 71 1.955 4.622 -11.194 1.00 0.00 C ATOM 1033 O ASN A 71 1.949 5.771 -11.633 1.00 0.00 O ATOM 1034 CB ASN A 71 -0.074 5.196 -9.848 1.00 0.00 C ATOM 1035 CG ASN A 71 -1.525 4.814 -9.624 1.00 0.00 C ATOM 1036 OD1 ASN A 71 -1.831 4.333 -8.425 1.00 0.00 O flip ATOM 1037 ND2 ASN A 71 -2.359 4.949 -10.519 1.00 0.00 N flip ATOM 0 H ASN A 71 0.766 2.175 -9.539 1.00 0.00 H new ATOM 0 HA ASN A 71 0.121 3.523 -11.184 1.00 0.00 H new ATOM 0 HB2 ASN A 71 0.373 5.487 -8.897 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -0.027 6.067 -10.502 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -2.078 5.323 -11.425 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -3.331 4.687 -10.354 1.00 0.00 H new ATOM 1044 N GLY A 72 2.995 3.804 -11.323 1.00 0.00 N ATOM 1045 CA GLY A 72 4.201 4.240 -12.003 1.00 0.00 C ATOM 1046 C GLY A 72 5.047 5.164 -11.148 1.00 0.00 C ATOM 1047 O GLY A 72 5.541 6.184 -11.628 1.00 0.00 O ATOM 0 H GLY A 72 3.024 2.848 -10.969 1.00 0.00 H new ATOM 0 HA2 GLY A 72 4.791 3.368 -12.284 1.00 0.00 H new ATOM 0 HA3 GLY A 72 3.929 4.752 -12.926 1.00 0.00 H new ATOM 1051 N ARG A 73 5.211 4.808 -9.879 1.00 0.00 N ATOM 1052 CA ARG A 73 6.000 5.614 -8.955 1.00 0.00 C ATOM 1053 C ARG A 73 6.871 4.729 -8.069 1.00 0.00 C ATOM 1054 O ARG A 73 6.407 3.725 -7.529 1.00 0.00 O ATOM 1055 CB ARG A 73 5.082 6.477 -8.087 1.00 0.00 C ATOM 1056 CG ARG A 73 4.758 7.829 -8.701 1.00 0.00 C ATOM 1057 CD ARG A 73 5.856 8.844 -8.426 1.00 0.00 C ATOM 1058 NE ARG A 73 6.996 8.674 -9.323 1.00 0.00 N ATOM 1059 CZ ARG A 73 8.169 9.271 -9.143 1.00 0.00 C ATOM 1060 NH1 ARG A 73 8.356 10.073 -8.103 1.00 0.00 N ATOM 1061 NH2 ARG A 73 9.158 9.067 -10.003 1.00 0.00 N ATOM 0 H ARG A 73 4.808 3.967 -9.467 1.00 0.00 H new ATOM 0 HA ARG A 73 6.650 6.263 -9.542 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.152 5.937 -7.907 1.00 0.00 H new ATOM 0 HB3 ARG A 73 5.553 6.632 -7.116 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.625 7.718 -9.777 1.00 0.00 H new ATOM 0 HG3 ARG A 73 3.813 8.195 -8.299 1.00 0.00 H new ATOM 0 HD2 ARG A 73 5.455 9.851 -8.537 1.00 0.00 H new ATOM 0 HD3 ARG A 73 6.190 8.746 -7.393 1.00 0.00 H new ATOM 0 HE ARG A 73 6.885 8.063 -10.132 1.00 0.00 H new ATOM 0 HH11 ARG A 73 7.598 10.232 -7.439 1.00 0.00 H new ATOM 0 HH12 ARG A 73 9.258 10.530 -7.967 1.00 0.00 H new ATOM 0 HH21 ARG A 73 9.018 8.451 -10.804 1.00 0.00 H new ATOM 0 HH22 ARG A 73 10.058 9.526 -9.863 1.00 0.00 H new ATOM 1075 N ASP A 74 8.136 5.109 -7.924 1.00 0.00 N ATOM 1076 CA ASP A 74 9.073 4.351 -7.103 1.00 0.00 C ATOM 1077 C ASP A 74 8.759 4.523 -5.620 1.00 0.00 C ATOM 1078 O ASP A 74 9.243 5.455 -4.978 1.00 0.00 O ATOM 1079 CB ASP A 74 10.509 4.795 -7.388 1.00 0.00 C ATOM 1080 CG ASP A 74 10.642 6.302 -7.478 1.00 0.00 C ATOM 1081 OD1 ASP A 74 10.059 7.002 -6.622 1.00 0.00 O ATOM 1082 OD2 ASP A 74 11.329 6.783 -8.402 1.00 0.00 O ATOM 0 H ASP A 74 8.536 5.938 -8.364 1.00 0.00 H new ATOM 0 HA ASP A 74 8.970 3.296 -7.358 1.00 0.00 H new ATOM 0 HB2 ASP A 74 11.164 4.422 -6.601 1.00 0.00 H new ATOM 0 HB3 ASP A 74 10.846 4.347 -8.323 1.00 0.00 H new ATOM 1087 N ILE A 75 7.946 3.619 -5.084 1.00 0.00 N ATOM 1088 CA ILE A 75 7.568 3.672 -3.678 1.00 0.00 C ATOM 1089 C ILE A 75 8.492 2.807 -2.827 1.00 0.00 C ATOM 1090 O ILE A 75 8.283 2.655 -1.624 1.00 0.00 O ATOM 1091 CB ILE A 75 6.113 3.210 -3.468 1.00 0.00 C ATOM 1092 CG1 ILE A 75 5.978 1.719 -3.784 1.00 0.00 C ATOM 1093 CG2 ILE A 75 5.168 4.029 -4.334 1.00 0.00 C ATOM 1094 CD1 ILE A 75 6.228 0.823 -2.591 1.00 0.00 C ATOM 0 H ILE A 75 7.537 2.842 -5.602 1.00 0.00 H new ATOM 0 HA ILE A 75 7.659 4.712 -3.366 1.00 0.00 H new ATOM 0 HB ILE A 75 5.844 3.366 -2.423 1.00 0.00 H new ATOM 0 HG12 ILE A 75 4.977 1.527 -4.169 1.00 0.00 H new ATOM 0 HG13 ILE A 75 6.679 1.459 -4.577 1.00 0.00 H new ATOM 0 HG21 ILE A 75 4.144 3.691 -4.175 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.249 5.082 -4.065 1.00 0.00 H new ATOM 0 HG23 ILE A 75 5.433 3.901 -5.383 1.00 0.00 H new ATOM 0 HD11 ILE A 75 6.115 -0.219 -2.889 1.00 0.00 H new ATOM 0 HD12 ILE A 75 7.239 0.987 -2.219 1.00 0.00 H new ATOM 0 HD13 ILE A 75 5.510 1.055 -1.805 1.00 0.00 H new ATOM 1106 N ALA A 76 9.515 2.244 -3.461 1.00 0.00 N ATOM 1107 CA ALA A 76 10.474 1.397 -2.762 1.00 0.00 C ATOM 1108 C ALA A 76 11.358 2.221 -1.832 1.00 0.00 C ATOM 1109 O ALA A 76 11.577 1.849 -0.679 1.00 0.00 O ATOM 1110 CB ALA A 76 11.327 0.629 -3.761 1.00 0.00 C ATOM 0 H ALA A 76 9.701 2.359 -4.457 1.00 0.00 H new ATOM 0 HA ALA A 76 9.916 0.685 -2.154 1.00 0.00 H new ATOM 0 HB1 ALA A 76 12.038 0.001 -3.225 1.00 0.00 H new ATOM 0 HB2 ALA A 76 10.686 0.003 -4.381 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.869 1.332 -4.393 1.00 0.00 H new ATOM 1116 N GLU A 77 11.863 3.340 -2.341 1.00 0.00 N ATOM 1117 CA GLU A 77 12.725 4.215 -1.554 1.00 0.00 C ATOM 1118 C GLU A 77 11.967 4.799 -0.365 1.00 0.00 C ATOM 1119 O GLU A 77 12.551 5.066 0.686 1.00 0.00 O ATOM 1120 CB GLU A 77 13.275 5.345 -2.427 1.00 0.00 C ATOM 1121 CG GLU A 77 14.023 6.410 -1.644 1.00 0.00 C ATOM 1122 CD GLU A 77 15.432 5.985 -1.280 1.00 0.00 C ATOM 1123 OE1 GLU A 77 15.578 5.041 -0.476 1.00 0.00 O ATOM 1124 OE2 GLU A 77 16.389 6.597 -1.799 1.00 0.00 O ATOM 0 H GLU A 77 11.691 3.662 -3.293 1.00 0.00 H new ATOM 0 HA GLU A 77 13.556 3.620 -1.176 1.00 0.00 H new ATOM 0 HB2 GLU A 77 13.943 4.921 -3.177 1.00 0.00 H new ATOM 0 HB3 GLU A 77 12.450 5.813 -2.963 1.00 0.00 H new ATOM 0 HG2 GLU A 77 14.065 7.326 -2.233 1.00 0.00 H new ATOM 0 HG3 GLU A 77 13.471 6.641 -0.733 1.00 0.00 H new ATOM 1131 N HIS A 78 10.664 4.995 -0.539 1.00 0.00 N ATOM 1132 CA HIS A 78 9.826 5.548 0.519 1.00 0.00 C ATOM 1133 C HIS A 78 9.638 4.537 1.646 1.00 0.00 C ATOM 1134 O HIS A 78 9.527 3.334 1.405 1.00 0.00 O ATOM 1135 CB HIS A 78 8.466 5.962 -0.043 1.00 0.00 C ATOM 1136 CG HIS A 78 8.515 7.206 -0.874 1.00 0.00 C ATOM 1137 ND1 HIS A 78 7.964 7.291 -2.136 1.00 0.00 N ATOM 1138 CD2 HIS A 78 9.051 8.422 -0.617 1.00 0.00 C ATOM 1139 CE1 HIS A 78 8.162 8.504 -2.620 1.00 0.00 C ATOM 1140 NE2 HIS A 78 8.819 9.211 -1.717 1.00 0.00 N ATOM 0 H HIS A 78 10.166 4.779 -1.402 1.00 0.00 H new ATOM 0 HA HIS A 78 10.326 6.428 0.923 1.00 0.00 H new ATOM 0 HB2 HIS A 78 8.068 5.147 -0.647 1.00 0.00 H new ATOM 0 HB3 HIS A 78 7.772 6.114 0.783 1.00 0.00 H new ATOM 0 HD2 HIS A 78 9.566 8.717 0.286 1.00 0.00 H new ATOM 0 HE1 HIS A 78 7.842 8.858 -3.589 1.00 0.00 H new ATOM 0 HE2 HIS A 78 9.107 10.184 -1.820 1.00 0.00 H new ATOM 1149 N THR A 79 9.603 5.033 2.879 1.00 0.00 N ATOM 1150 CA THR A 79 9.431 4.174 4.044 1.00 0.00 C ATOM 1151 C THR A 79 7.983 3.717 4.181 1.00 0.00 C ATOM 1152 O THR A 79 7.099 4.203 3.475 1.00 0.00 O ATOM 1153 CB THR A 79 9.855 4.891 5.339 1.00 0.00 C ATOM 1154 OG1 THR A 79 9.148 6.130 5.467 1.00 0.00 O ATOM 1155 CG2 THR A 79 11.354 5.153 5.346 1.00 0.00 C ATOM 0 H THR A 79 9.692 6.026 3.096 1.00 0.00 H new ATOM 0 HA THR A 79 10.071 3.305 3.893 1.00 0.00 H new ATOM 0 HB THR A 79 9.611 4.245 6.183 1.00 0.00 H new ATOM 0 HG1 THR A 79 9.422 6.579 6.294 1.00 0.00 H new ATOM 0 HG21 THR A 79 11.630 5.660 6.270 1.00 0.00 H new ATOM 0 HG22 THR A 79 11.889 4.206 5.278 1.00 0.00 H new ATOM 0 HG23 THR A 79 11.618 5.781 4.495 1.00 0.00 H new ATOM 1163 N HIS A 80 7.746 2.780 5.094 1.00 0.00 N ATOM 1164 CA HIS A 80 6.404 2.259 5.324 1.00 0.00 C ATOM 1165 C HIS A 80 5.412 3.395 5.556 1.00 0.00 C ATOM 1166 O HIS A 80 4.391 3.490 4.874 1.00 0.00 O ATOM 1167 CB HIS A 80 6.401 1.310 6.523 1.00 0.00 C ATOM 1168 CG HIS A 80 5.113 0.564 6.693 1.00 0.00 C ATOM 1169 ND1 HIS A 80 4.908 -0.706 6.197 1.00 0.00 N ATOM 1170 CD2 HIS A 80 3.961 0.916 7.311 1.00 0.00 C ATOM 1171 CE1 HIS A 80 3.685 -1.102 6.501 1.00 0.00 C ATOM 1172 NE2 HIS A 80 3.090 -0.137 7.177 1.00 0.00 N ATOM 0 H HIS A 80 8.466 2.366 5.686 1.00 0.00 H new ATOM 0 HA HIS A 80 6.097 1.709 4.434 1.00 0.00 H new ATOM 0 HB2 HIS A 80 7.214 0.593 6.411 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.603 1.882 7.429 1.00 0.00 H new ATOM 0 HD1 HIS A 80 5.593 -1.254 5.677 1.00 0.00 H new ATOM 0 HD2 HIS A 80 3.764 1.851 7.815 1.00 0.00 H new ATOM 0 HE1 HIS A 80 3.246 -2.054 6.241 1.00 0.00 H new ATOM 1181 N ASP A 81 5.719 4.253 6.522 1.00 0.00 N ATOM 1182 CA ASP A 81 4.855 5.383 6.844 1.00 0.00 C ATOM 1183 C ASP A 81 4.546 6.204 5.596 1.00 0.00 C ATOM 1184 O ASP A 81 3.394 6.557 5.345 1.00 0.00 O ATOM 1185 CB ASP A 81 5.512 6.269 7.903 1.00 0.00 C ATOM 1186 CG ASP A 81 5.187 5.823 9.315 1.00 0.00 C ATOM 1187 OD1 ASP A 81 4.164 5.130 9.497 1.00 0.00 O ATOM 1188 OD2 ASP A 81 5.955 6.167 10.238 1.00 0.00 O ATOM 0 H ASP A 81 6.560 4.188 7.096 1.00 0.00 H new ATOM 0 HA ASP A 81 3.918 4.991 7.240 1.00 0.00 H new ATOM 0 HB2 ASP A 81 6.593 6.258 7.762 1.00 0.00 H new ATOM 0 HB3 ASP A 81 5.183 7.299 7.766 1.00 0.00 H new ATOM 1193 N GLN A 82 5.582 6.504 4.820 1.00 0.00 N ATOM 1194 CA GLN A 82 5.421 7.284 3.599 1.00 0.00 C ATOM 1195 C GLN A 82 4.479 6.584 2.625 1.00 0.00 C ATOM 1196 O GLN A 82 3.424 7.113 2.277 1.00 0.00 O ATOM 1197 CB GLN A 82 6.778 7.519 2.935 1.00 0.00 C ATOM 1198 CG GLN A 82 7.645 8.533 3.664 1.00 0.00 C ATOM 1199 CD GLN A 82 7.270 9.965 3.335 1.00 0.00 C ATOM 1200 OE1 GLN A 82 6.405 10.556 3.982 1.00 0.00 O ATOM 1201 NE2 GLN A 82 7.921 10.530 2.325 1.00 0.00 N ATOM 0 H GLN A 82 6.542 6.219 5.015 1.00 0.00 H new ATOM 0 HA GLN A 82 4.985 8.246 3.868 1.00 0.00 H new ATOM 0 HB2 GLN A 82 7.313 6.571 2.876 1.00 0.00 H new ATOM 0 HB3 GLN A 82 6.618 7.859 1.912 1.00 0.00 H new ATOM 0 HG2 GLN A 82 7.556 8.376 4.739 1.00 0.00 H new ATOM 0 HG3 GLN A 82 8.690 8.366 3.403 1.00 0.00 H new ATOM 0 HE21 GLN A 82 8.631 10.002 1.817 1.00 0.00 H new ATOM 0 HE22 GLN A 82 7.712 11.492 2.058 1.00 0.00 H new ATOM 1210 N VAL A 83 4.869 5.390 2.189 1.00 0.00 N ATOM 1211 CA VAL A 83 4.059 4.616 1.255 1.00 0.00 C ATOM 1212 C VAL A 83 2.572 4.786 1.545 1.00 0.00 C ATOM 1213 O VAL A 83 1.830 5.344 0.736 1.00 0.00 O ATOM 1214 CB VAL A 83 4.414 3.119 1.312 1.00 0.00 C ATOM 1215 CG1 VAL A 83 3.453 2.309 0.455 1.00 0.00 C ATOM 1216 CG2 VAL A 83 5.853 2.895 0.871 1.00 0.00 C ATOM 0 H VAL A 83 5.740 4.938 2.467 1.00 0.00 H new ATOM 0 HA VAL A 83 4.277 4.996 0.257 1.00 0.00 H new ATOM 0 HB VAL A 83 4.317 2.780 2.343 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.720 1.253 0.508 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.436 2.445 0.822 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.514 2.647 -0.579 1.00 0.00 H new ATOM 0 HG21 VAL A 83 6.086 1.831 0.918 1.00 0.00 H new ATOM 0 HG22 VAL A 83 5.979 3.250 -0.152 1.00 0.00 H new ATOM 0 HG23 VAL A 83 6.525 3.443 1.531 1.00 0.00 H new ATOM 1226 N VAL A 84 2.142 4.301 2.706 1.00 0.00 N ATOM 1227 CA VAL A 84 0.743 4.401 3.105 1.00 0.00 C ATOM 1228 C VAL A 84 0.131 5.717 2.639 1.00 0.00 C ATOM 1229 O VAL A 84 -0.879 5.729 1.935 1.00 0.00 O ATOM 1230 CB VAL A 84 0.586 4.286 4.633 1.00 0.00 C ATOM 1231 CG1 VAL A 84 -0.866 4.491 5.037 1.00 0.00 C ATOM 1232 CG2 VAL A 84 1.099 2.940 5.121 1.00 0.00 C ATOM 0 H VAL A 84 2.742 3.835 3.386 1.00 0.00 H new ATOM 0 HA VAL A 84 0.218 3.572 2.630 1.00 0.00 H new ATOM 0 HB VAL A 84 1.183 5.068 5.102 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.958 4.406 6.120 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -1.195 5.481 4.721 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.487 3.733 4.560 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.980 2.876 6.203 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.531 2.140 4.646 1.00 0.00 H new ATOM 0 HG23 VAL A 84 2.154 2.838 4.865 1.00 0.00 H new ATOM 1242 N LEU A 85 0.749 6.823 3.036 1.00 0.00 N ATOM 1243 CA LEU A 85 0.266 8.147 2.658 1.00 0.00 C ATOM 1244 C LEU A 85 0.309 8.332 1.145 1.00 0.00 C ATOM 1245 O LEU A 85 -0.659 8.788 0.537 1.00 0.00 O ATOM 1246 CB LEU A 85 1.103 9.231 3.340 1.00 0.00 C ATOM 1247 CG LEU A 85 0.623 9.682 4.720 1.00 0.00 C ATOM 1248 CD1 LEU A 85 0.853 8.587 5.750 1.00 0.00 C ATOM 1249 CD2 LEU A 85 1.326 10.965 5.136 1.00 0.00 C ATOM 0 H LEU A 85 1.586 6.830 3.620 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.770 8.236 2.986 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.126 8.866 3.435 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.135 10.102 2.686 1.00 0.00 H new ATOM 0 HG LEU A 85 -0.447 9.880 4.664 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.505 8.926 6.726 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.302 7.693 5.459 1.00 0.00 H new ATOM 0 HD13 LEU A 85 1.917 8.356 5.804 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.972 11.271 6.120 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.402 10.794 5.174 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.109 11.750 4.412 1.00 0.00 H new ATOM 1261 N PHE A 86 1.438 7.972 0.542 1.00 0.00 N ATOM 1262 CA PHE A 86 1.607 8.097 -0.901 1.00 0.00 C ATOM 1263 C PHE A 86 0.347 7.651 -1.637 1.00 0.00 C ATOM 1264 O PHE A 86 -0.136 8.340 -2.536 1.00 0.00 O ATOM 1265 CB PHE A 86 2.805 7.267 -1.369 1.00 0.00 C ATOM 1266 CG PHE A 86 3.477 7.822 -2.592 1.00 0.00 C ATOM 1267 CD1 PHE A 86 3.005 7.516 -3.858 1.00 0.00 C ATOM 1268 CD2 PHE A 86 4.582 8.650 -2.475 1.00 0.00 C ATOM 1269 CE1 PHE A 86 3.622 8.025 -4.984 1.00 0.00 C ATOM 1270 CE2 PHE A 86 5.203 9.163 -3.599 1.00 0.00 C ATOM 1271 CZ PHE A 86 4.722 8.850 -4.855 1.00 0.00 C ATOM 0 H PHE A 86 2.249 7.592 1.030 1.00 0.00 H new ATOM 0 HA PHE A 86 1.788 9.147 -1.131 1.00 0.00 H new ATOM 0 HB2 PHE A 86 3.533 7.206 -0.560 1.00 0.00 H new ATOM 0 HB3 PHE A 86 2.473 6.250 -1.576 1.00 0.00 H new ATOM 0 HD1 PHE A 86 2.145 6.872 -3.966 1.00 0.00 H new ATOM 0 HD2 PHE A 86 4.962 8.897 -1.495 1.00 0.00 H new ATOM 0 HE1 PHE A 86 3.244 7.778 -5.965 1.00 0.00 H new ATOM 0 HE2 PHE A 86 6.063 9.808 -3.495 1.00 0.00 H new ATOM 0 HZ PHE A 86 5.205 9.249 -5.735 1.00 0.00 H new ATOM 1281 N ILE A 87 -0.180 6.495 -1.249 1.00 0.00 N ATOM 1282 CA ILE A 87 -1.384 5.957 -1.871 1.00 0.00 C ATOM 1283 C ILE A 87 -2.540 6.947 -1.777 1.00 0.00 C ATOM 1284 O ILE A 87 -3.181 7.267 -2.778 1.00 0.00 O ATOM 1285 CB ILE A 87 -1.808 4.627 -1.221 1.00 0.00 C ATOM 1286 CG1 ILE A 87 -0.651 3.626 -1.256 1.00 0.00 C ATOM 1287 CG2 ILE A 87 -3.030 4.059 -1.926 1.00 0.00 C ATOM 1288 CD1 ILE A 87 -0.720 2.584 -0.161 1.00 0.00 C ATOM 0 H ILE A 87 0.208 5.913 -0.507 1.00 0.00 H new ATOM 0 HA ILE A 87 -1.145 5.779 -2.919 1.00 0.00 H new ATOM 0 HB ILE A 87 -2.069 4.815 -0.180 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -0.644 3.124 -2.224 1.00 0.00 H new ATOM 0 HG13 ILE A 87 0.291 4.168 -1.172 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.318 3.119 -1.455 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -3.854 4.768 -1.853 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -2.795 3.882 -2.976 1.00 0.00 H new ATOM 0 HD11 ILE A 87 0.131 1.909 -0.247 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -0.696 3.076 0.811 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -1.645 2.016 -0.257 1.00 0.00 H new ATOM 1300 N LYS A 88 -2.800 7.431 -0.567 1.00 0.00 N ATOM 1301 CA LYS A 88 -3.877 8.388 -0.341 1.00 0.00 C ATOM 1302 C LYS A 88 -3.855 9.491 -1.394 1.00 0.00 C ATOM 1303 O LYS A 88 -4.898 9.886 -1.914 1.00 0.00 O ATOM 1304 CB LYS A 88 -3.757 9.001 1.057 1.00 0.00 C ATOM 1305 CG LYS A 88 -4.192 8.064 2.170 1.00 0.00 C ATOM 1306 CD LYS A 88 -3.794 8.599 3.536 1.00 0.00 C ATOM 1307 CE LYS A 88 -4.424 7.787 4.658 1.00 0.00 C ATOM 1308 NZ LYS A 88 -4.472 8.551 5.935 1.00 0.00 N ATOM 0 H LYS A 88 -2.279 7.176 0.272 1.00 0.00 H new ATOM 0 HA LYS A 88 -4.825 7.855 -0.418 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -2.722 9.298 1.227 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -4.360 9.908 1.100 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -5.273 7.929 2.132 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -3.743 7.083 2.017 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -2.709 8.577 3.635 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -4.101 9.641 3.623 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -5.434 7.494 4.372 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -3.856 6.869 4.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -4.908 7.964 6.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -3.506 8.809 6.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -5.036 9.415 5.802 1.00 0.00 H new ATOM 1322 N ALA A 89 -2.660 9.983 -1.705 1.00 0.00 N ATOM 1323 CA ALA A 89 -2.503 11.037 -2.699 1.00 0.00 C ATOM 1324 C ALA A 89 -3.385 10.780 -3.916 1.00 0.00 C ATOM 1325 O ALA A 89 -4.194 11.625 -4.298 1.00 0.00 O ATOM 1326 CB ALA A 89 -1.045 11.156 -3.117 1.00 0.00 C ATOM 0 H ALA A 89 -1.787 9.668 -1.283 1.00 0.00 H new ATOM 0 HA ALA A 89 -2.818 11.978 -2.247 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -0.943 11.947 -3.860 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -0.435 11.395 -2.246 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -0.711 10.211 -3.545 1.00 0.00 H new ATOM 1332 N SER A 90 -3.222 9.608 -4.522 1.00 0.00 N ATOM 1333 CA SER A 90 -4.000 9.242 -5.700 1.00 0.00 C ATOM 1334 C SER A 90 -5.474 9.584 -5.505 1.00 0.00 C ATOM 1335 O SER A 90 -6.104 10.184 -6.377 1.00 0.00 O ATOM 1336 CB SER A 90 -3.846 7.749 -5.994 1.00 0.00 C ATOM 1337 OG SER A 90 -2.752 7.510 -6.863 1.00 0.00 O ATOM 0 H SER A 90 -2.558 8.896 -4.217 1.00 0.00 H new ATOM 0 HA SER A 90 -3.621 9.813 -6.548 1.00 0.00 H new ATOM 0 HB2 SER A 90 -3.699 7.205 -5.061 1.00 0.00 H new ATOM 0 HB3 SER A 90 -4.762 7.368 -6.444 1.00 0.00 H new ATOM 0 HG SER A 90 -2.674 6.548 -7.034 1.00 0.00 H new ATOM 1343 N CYS A 91 -6.017 9.199 -4.356 1.00 0.00 N ATOM 1344 CA CYS A 91 -7.418 9.463 -4.045 1.00 0.00 C ATOM 1345 C CYS A 91 -7.741 10.945 -4.210 1.00 0.00 C ATOM 1346 O CYS A 91 -8.686 11.309 -4.909 1.00 0.00 O ATOM 1347 CB CYS A 91 -7.739 9.015 -2.618 1.00 0.00 C ATOM 1348 SG CYS A 91 -9.440 9.349 -2.105 1.00 0.00 S ATOM 0 H CYS A 91 -5.509 8.703 -3.624 1.00 0.00 H new ATOM 0 HA CYS A 91 -8.033 8.895 -4.743 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -7.549 7.945 -2.533 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -7.058 9.516 -1.930 1.00 0.00 H new ATOM 0 HG CYS A 91 -9.615 8.933 -0.886 1.00 0.00 H new ATOM 1354 N GLU A 92 -6.950 11.793 -3.561 1.00 0.00 N ATOM 1355 CA GLU A 92 -7.154 13.235 -3.635 1.00 0.00 C ATOM 1356 C GLU A 92 -7.565 13.655 -5.043 1.00 0.00 C ATOM 1357 O GLU A 92 -8.644 14.211 -5.247 1.00 0.00 O ATOM 1358 CB GLU A 92 -5.880 13.975 -3.221 1.00 0.00 C ATOM 1359 CG GLU A 92 -6.044 15.485 -3.166 1.00 0.00 C ATOM 1360 CD GLU A 92 -6.994 15.930 -2.071 1.00 0.00 C ATOM 1361 OE1 GLU A 92 -6.828 15.475 -0.920 1.00 0.00 O ATOM 1362 OE2 GLU A 92 -7.903 16.734 -2.366 1.00 0.00 O ATOM 0 H GLU A 92 -6.163 11.507 -2.979 1.00 0.00 H new ATOM 0 HA GLU A 92 -7.958 13.498 -2.947 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -5.564 13.616 -2.242 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -5.083 13.730 -3.923 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -5.070 15.947 -3.006 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -6.412 15.842 -4.128 1.00 0.00 H new ATOM 1369 N ARG A 93 -6.695 13.387 -6.011 1.00 0.00 N ATOM 1370 CA ARG A 93 -6.965 13.738 -7.400 1.00 0.00 C ATOM 1371 C ARG A 93 -8.316 13.186 -7.848 1.00 0.00 C ATOM 1372 O ARG A 93 -9.176 13.929 -8.321 1.00 0.00 O ATOM 1373 CB ARG A 93 -5.857 13.203 -8.309 1.00 0.00 C ATOM 1374 CG ARG A 93 -4.496 13.823 -8.040 1.00 0.00 C ATOM 1375 CD ARG A 93 -3.426 13.236 -8.947 1.00 0.00 C ATOM 1376 NE ARG A 93 -3.584 13.672 -10.332 1.00 0.00 N ATOM 1377 CZ ARG A 93 -3.030 13.049 -11.366 1.00 0.00 C ATOM 1378 NH1 ARG A 93 -2.286 11.968 -11.172 1.00 0.00 N ATOM 1379 NH2 ARG A 93 -3.219 13.506 -12.597 1.00 0.00 N ATOM 0 H ARG A 93 -5.797 12.928 -5.859 1.00 0.00 H new ATOM 0 HA ARG A 93 -6.993 14.825 -7.474 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -5.786 12.123 -8.184 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -6.131 13.386 -9.348 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -4.550 14.901 -8.190 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -4.220 13.660 -6.998 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -2.441 13.531 -8.584 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -3.470 12.148 -8.902 1.00 0.00 H new ATOM 0 HE ARG A 93 -4.151 14.500 -10.515 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -2.138 11.613 -10.227 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -1.862 11.491 -11.968 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -3.790 14.337 -12.750 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -2.793 13.027 -13.390 1.00 0.00 H new ATOM 1393 N HIS A 94 -8.494 11.878 -7.695 1.00 0.00 N ATOM 1394 CA HIS A 94 -9.740 11.226 -8.084 1.00 0.00 C ATOM 1395 C HIS A 94 -10.019 11.428 -9.570 1.00 0.00 C ATOM 1396 O HIS A 94 -11.156 11.677 -9.970 1.00 0.00 O ATOM 1397 CB HIS A 94 -10.905 11.770 -7.256 1.00 0.00 C ATOM 1398 CG HIS A 94 -12.036 10.800 -7.103 1.00 0.00 C ATOM 1399 ND1 HIS A 94 -13.361 11.176 -7.151 1.00 0.00 N ATOM 1400 CD2 HIS A 94 -12.033 9.461 -6.904 1.00 0.00 C ATOM 1401 CE1 HIS A 94 -14.125 10.111 -6.987 1.00 0.00 C ATOM 1402 NE2 HIS A 94 -13.344 9.057 -6.835 1.00 0.00 N ATOM 0 H HIS A 94 -7.792 11.249 -7.305 1.00 0.00 H new ATOM 0 HA HIS A 94 -9.636 10.158 -7.894 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -10.539 12.047 -6.267 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -11.279 12.680 -7.724 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -11.162 8.828 -6.816 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -15.205 10.103 -6.979 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -13.662 8.099 -6.690 1.00 0.00 H new ATOM 1411 N SER A 95 -8.973 11.320 -10.383 1.00 0.00 N ATOM 1412 CA SER A 95 -9.104 11.496 -11.825 1.00 0.00 C ATOM 1413 C SER A 95 -9.332 10.156 -12.517 1.00 0.00 C ATOM 1414 O SER A 95 -10.231 10.017 -13.346 1.00 0.00 O ATOM 1415 CB SER A 95 -7.854 12.170 -12.394 1.00 0.00 C ATOM 1416 OG SER A 95 -7.889 13.571 -12.181 1.00 0.00 O ATOM 0 H SER A 95 -8.026 11.112 -10.068 1.00 0.00 H new ATOM 0 HA SER A 95 -9.968 12.134 -12.011 1.00 0.00 H new ATOM 0 HB2 SER A 95 -6.965 11.750 -11.925 1.00 0.00 H new ATOM 0 HB3 SER A 95 -7.779 11.963 -13.462 1.00 0.00 H new ATOM 0 HG SER A 95 -7.079 13.979 -12.552 1.00 0.00 H new ATOM 1422 N GLY A 96 -8.510 9.170 -12.170 1.00 0.00 N ATOM 1423 CA GLY A 96 -8.638 7.853 -12.766 1.00 0.00 C ATOM 1424 C GLY A 96 -8.695 6.749 -11.729 1.00 0.00 C ATOM 1425 O GLY A 96 -9.086 6.984 -10.586 1.00 0.00 O ATOM 0 H GLY A 96 -7.758 9.260 -11.487 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -9.540 7.820 -13.377 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -7.795 7.677 -13.434 1.00 0.00 H new ATOM 1429 N GLU A 97 -8.307 5.543 -12.128 1.00 0.00 N ATOM 1430 CA GLU A 97 -8.319 4.399 -11.224 1.00 0.00 C ATOM 1431 C GLU A 97 -6.928 4.143 -10.651 1.00 0.00 C ATOM 1432 O GLU A 97 -5.955 4.790 -11.041 1.00 0.00 O ATOM 1433 CB GLU A 97 -8.820 3.150 -11.952 1.00 0.00 C ATOM 1434 CG GLU A 97 -10.329 2.975 -11.891 1.00 0.00 C ATOM 1435 CD GLU A 97 -10.786 1.650 -12.470 1.00 0.00 C ATOM 1436 OE1 GLU A 97 -10.052 1.082 -13.306 1.00 0.00 O ATOM 1437 OE2 GLU A 97 -11.877 1.180 -12.086 1.00 0.00 O ATOM 0 H GLU A 97 -7.980 5.332 -13.071 1.00 0.00 H new ATOM 0 HA GLU A 97 -8.996 4.627 -10.401 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.510 3.199 -12.996 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -8.343 2.271 -11.519 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.658 3.047 -10.854 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -10.808 3.789 -12.435 1.00 0.00 H new ATOM 1444 N LEU A 98 -6.841 3.196 -9.724 1.00 0.00 N ATOM 1445 CA LEU A 98 -5.570 2.853 -9.096 1.00 0.00 C ATOM 1446 C LEU A 98 -4.898 1.693 -9.824 1.00 0.00 C ATOM 1447 O LEU A 98 -5.569 0.802 -10.344 1.00 0.00 O ATOM 1448 CB LEU A 98 -5.785 2.491 -7.626 1.00 0.00 C ATOM 1449 CG LEU A 98 -4.594 2.724 -6.696 1.00 0.00 C ATOM 1450 CD1 LEU A 98 -4.617 4.140 -6.143 1.00 0.00 C ATOM 1451 CD2 LEU A 98 -4.596 1.707 -5.563 1.00 0.00 C ATOM 0 H LEU A 98 -7.636 2.651 -9.390 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.917 3.724 -9.157 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.631 3.067 -7.251 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.065 1.439 -7.569 1.00 0.00 H new ATOM 0 HG LEU A 98 -3.677 2.596 -7.272 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -3.762 4.287 -5.483 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.567 4.853 -6.966 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.539 4.297 -5.583 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.742 1.887 -4.911 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -5.518 1.804 -4.989 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -4.530 0.701 -5.977 1.00 0.00 H new ATOM 1463 N MET A 99 -3.569 1.711 -9.856 1.00 0.00 N ATOM 1464 CA MET A 99 -2.807 0.658 -10.517 1.00 0.00 C ATOM 1465 C MET A 99 -1.613 0.235 -9.666 1.00 0.00 C ATOM 1466 O MET A 99 -0.635 0.973 -9.540 1.00 0.00 O ATOM 1467 CB MET A 99 -2.327 1.132 -11.890 1.00 0.00 C ATOM 1468 CG MET A 99 -3.405 1.082 -12.961 1.00 0.00 C ATOM 1469 SD MET A 99 -2.918 1.929 -14.476 1.00 0.00 S ATOM 1470 CE MET A 99 -3.303 0.681 -15.701 1.00 0.00 C ATOM 0 H MET A 99 -2.998 2.443 -9.432 1.00 0.00 H new ATOM 0 HA MET A 99 -3.462 -0.204 -10.646 1.00 0.00 H new ATOM 0 HB2 MET A 99 -1.959 2.154 -11.804 1.00 0.00 H new ATOM 0 HB3 MET A 99 -1.485 0.515 -12.204 1.00 0.00 H new ATOM 0 HG2 MET A 99 -3.637 0.042 -13.189 1.00 0.00 H new ATOM 0 HG3 MET A 99 -4.318 1.534 -12.574 1.00 0.00 H new ATOM 0 HE1 MET A 99 -3.365 1.145 -16.686 1.00 0.00 H new ATOM 0 HE2 MET A 99 -2.520 -0.078 -15.706 1.00 0.00 H new ATOM 0 HE3 MET A 99 -4.258 0.215 -15.458 1.00 0.00 H new ATOM 1480 N LEU A 100 -1.700 -0.956 -9.085 1.00 0.00 N ATOM 1481 CA LEU A 100 -0.627 -1.477 -8.245 1.00 0.00 C ATOM 1482 C LEU A 100 0.034 -2.689 -8.896 1.00 0.00 C ATOM 1483 O LEU A 100 -0.589 -3.740 -9.051 1.00 0.00 O ATOM 1484 CB LEU A 100 -1.169 -1.857 -6.867 1.00 0.00 C ATOM 1485 CG LEU A 100 -2.152 -0.869 -6.237 1.00 0.00 C ATOM 1486 CD1 LEU A 100 -3.023 -1.568 -5.204 1.00 0.00 C ATOM 1487 CD2 LEU A 100 -1.406 0.297 -5.607 1.00 0.00 C ATOM 0 H LEU A 100 -2.502 -1.579 -9.180 1.00 0.00 H new ATOM 0 HA LEU A 100 0.123 -0.694 -8.130 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.660 -2.827 -6.947 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.325 -1.982 -6.188 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.799 -0.478 -7.023 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.716 -0.850 -4.766 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.586 -2.369 -5.684 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -2.392 -1.987 -4.420 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -2.121 0.990 -5.164 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.735 -0.076 -4.833 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.826 0.814 -6.372 1.00 0.00 H new ATOM 1499 N LEU A 101 1.298 -2.535 -9.272 1.00 0.00 N ATOM 1500 CA LEU A 101 2.045 -3.618 -9.904 1.00 0.00 C ATOM 1501 C LEU A 101 2.619 -4.567 -8.857 1.00 0.00 C ATOM 1502 O LEU A 101 3.635 -4.272 -8.227 1.00 0.00 O ATOM 1503 CB LEU A 101 3.173 -3.050 -10.767 1.00 0.00 C ATOM 1504 CG LEU A 101 3.861 -4.039 -11.708 1.00 0.00 C ATOM 1505 CD1 LEU A 101 2.891 -4.527 -12.772 1.00 0.00 C ATOM 1506 CD2 LEU A 101 5.084 -3.400 -12.352 1.00 0.00 C ATOM 0 H LEU A 101 1.828 -1.672 -9.151 1.00 0.00 H new ATOM 0 HA LEU A 101 1.358 -4.179 -10.538 1.00 0.00 H new ATOM 0 HB2 LEU A 101 2.770 -2.232 -11.364 1.00 0.00 H new ATOM 0 HB3 LEU A 101 3.928 -2.622 -10.107 1.00 0.00 H new ATOM 0 HG LEU A 101 4.189 -4.898 -11.123 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.399 -5.230 -13.432 1.00 0.00 H new ATOM 0 HD12 LEU A 101 2.046 -5.023 -12.294 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.531 -3.678 -13.353 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.561 -4.118 -13.019 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.778 -2.523 -12.923 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.789 -3.101 -11.576 1.00 0.00 H new ATOM 1518 N VAL A 102 1.963 -5.709 -8.678 1.00 0.00 N ATOM 1519 CA VAL A 102 2.410 -6.703 -7.710 1.00 0.00 C ATOM 1520 C VAL A 102 3.029 -7.910 -8.407 1.00 0.00 C ATOM 1521 O VAL A 102 2.749 -8.174 -9.576 1.00 0.00 O ATOM 1522 CB VAL A 102 1.249 -7.179 -6.817 1.00 0.00 C ATOM 1523 CG1 VAL A 102 0.654 -6.011 -6.046 1.00 0.00 C ATOM 1524 CG2 VAL A 102 0.184 -7.873 -7.653 1.00 0.00 C ATOM 0 H VAL A 102 1.120 -5.969 -9.191 1.00 0.00 H new ATOM 0 HA VAL A 102 3.163 -6.221 -7.087 1.00 0.00 H new ATOM 0 HB VAL A 102 1.640 -7.898 -6.097 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -0.165 -6.367 -5.421 1.00 0.00 H new ATOM 0 HG12 VAL A 102 1.422 -5.561 -5.417 1.00 0.00 H new ATOM 0 HG13 VAL A 102 0.278 -5.266 -6.747 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.629 -8.203 -7.006 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -0.204 -7.178 -8.398 1.00 0.00 H new ATOM 0 HG23 VAL A 102 0.621 -8.736 -8.155 1.00 0.00 H new ATOM 1534 N ARG A 103 3.869 -8.639 -7.681 1.00 0.00 N ATOM 1535 CA ARG A 103 4.528 -9.818 -8.230 1.00 0.00 C ATOM 1536 C ARG A 103 3.815 -11.094 -7.790 1.00 0.00 C ATOM 1537 O ARG A 103 3.544 -11.307 -6.608 1.00 0.00 O ATOM 1538 CB ARG A 103 5.992 -9.862 -7.789 1.00 0.00 C ATOM 1539 CG ARG A 103 6.800 -10.958 -8.466 1.00 0.00 C ATOM 1540 CD ARG A 103 8.294 -10.733 -8.298 1.00 0.00 C ATOM 1541 NE ARG A 103 9.077 -11.535 -9.234 1.00 0.00 N ATOM 1542 CZ ARG A 103 9.429 -12.796 -9.007 1.00 0.00 C ATOM 1543 NH1 ARG A 103 9.070 -13.395 -7.880 1.00 0.00 N ATOM 1544 NH2 ARG A 103 10.142 -13.460 -9.908 1.00 0.00 N ATOM 0 H ARG A 103 4.110 -8.434 -6.711 1.00 0.00 H new ATOM 0 HA ARG A 103 4.485 -9.754 -9.317 1.00 0.00 H new ATOM 0 HB2 ARG A 103 6.455 -8.898 -8.000 1.00 0.00 H new ATOM 0 HB3 ARG A 103 6.033 -10.006 -6.709 1.00 0.00 H new ATOM 0 HG2 ARG A 103 6.527 -11.926 -8.045 1.00 0.00 H new ATOM 0 HG3 ARG A 103 6.553 -10.991 -9.527 1.00 0.00 H new ATOM 0 HD2 ARG A 103 8.521 -9.677 -8.447 1.00 0.00 H new ATOM 0 HD3 ARG A 103 8.585 -10.980 -7.277 1.00 0.00 H new ATOM 0 HE ARG A 103 9.370 -11.103 -10.111 1.00 0.00 H new ATOM 0 HH11 ARG A 103 8.522 -12.888 -7.185 1.00 0.00 H new ATOM 0 HH12 ARG A 103 9.341 -14.363 -7.708 1.00 0.00 H new ATOM 0 HH21 ARG A 103 10.420 -13.002 -10.776 1.00 0.00 H new ATOM 0 HH22 ARG A 103 10.412 -14.428 -9.732 1.00 0.00 H new ATOM 1558 N PRO A 104 3.502 -11.963 -8.763 1.00 0.00 N ATOM 1559 CA PRO A 104 2.817 -13.231 -8.501 1.00 0.00 C ATOM 1560 C PRO A 104 3.703 -14.228 -7.762 1.00 0.00 C ATOM 1561 O PRO A 104 4.849 -14.458 -8.147 1.00 0.00 O ATOM 1562 CB PRO A 104 2.483 -13.750 -9.902 1.00 0.00 C ATOM 1563 CG PRO A 104 3.499 -13.121 -10.791 1.00 0.00 C ATOM 1564 CD PRO A 104 3.795 -11.773 -10.194 1.00 0.00 C ATOM 0 HA PRO A 104 1.945 -13.097 -7.861 1.00 0.00 H new ATOM 0 HB2 PRO A 104 2.539 -14.838 -9.945 1.00 0.00 H new ATOM 0 HB3 PRO A 104 1.472 -13.471 -10.197 1.00 0.00 H new ATOM 0 HG2 PRO A 104 4.401 -13.730 -10.845 1.00 0.00 H new ATOM 0 HG3 PRO A 104 3.120 -13.022 -11.808 1.00 0.00 H new ATOM 0 HD2 PRO A 104 4.832 -11.480 -10.357 1.00 0.00 H new ATOM 0 HD3 PRO A 104 3.171 -10.994 -10.632 1.00 0.00 H new ATOM 1572 N ASN A 105 3.165 -14.816 -6.698 1.00 0.00 N ATOM 1573 CA ASN A 105 3.909 -15.788 -5.905 1.00 0.00 C ATOM 1574 C ASN A 105 3.271 -17.171 -6.002 1.00 0.00 C ATOM 1575 O ASN A 105 2.459 -17.551 -5.160 1.00 0.00 O ATOM 1576 CB ASN A 105 3.969 -15.344 -4.442 1.00 0.00 C ATOM 1577 CG ASN A 105 5.075 -16.039 -3.672 1.00 0.00 C ATOM 1578 OD1 ASN A 105 6.118 -16.378 -4.232 1.00 0.00 O ATOM 1579 ND2 ASN A 105 4.851 -16.256 -2.381 1.00 0.00 N ATOM 0 H ASN A 105 2.218 -14.637 -6.365 1.00 0.00 H new ATOM 0 HA ASN A 105 4.922 -15.845 -6.303 1.00 0.00 H new ATOM 0 HB2 ASN A 105 4.122 -14.266 -4.398 1.00 0.00 H new ATOM 0 HB3 ASN A 105 3.012 -15.550 -3.963 1.00 0.00 H new ATOM 0 HD21 ASN A 105 5.558 -16.721 -1.812 1.00 0.00 H new ATOM 0 HD22 ASN A 105 3.972 -15.958 -1.959 1.00 0.00 H new ATOM 1586 N ALA A 106 3.647 -17.918 -7.035 1.00 0.00 N ATOM 1587 CA ALA A 106 3.114 -19.259 -7.241 1.00 0.00 C ATOM 1588 C ALA A 106 2.889 -19.971 -5.911 1.00 0.00 C ATOM 1589 O ALA A 106 3.819 -20.148 -5.125 1.00 0.00 O ATOM 1590 CB ALA A 106 4.053 -20.070 -8.123 1.00 0.00 C ATOM 0 H ALA A 106 4.318 -17.617 -7.742 1.00 0.00 H new ATOM 0 HA ALA A 106 2.150 -19.167 -7.742 1.00 0.00 H new ATOM 0 HB1 ALA A 106 3.643 -21.069 -8.269 1.00 0.00 H new ATOM 0 HB2 ALA A 106 4.161 -19.577 -9.089 1.00 0.00 H new ATOM 0 HB3 ALA A 106 5.029 -20.145 -7.643 1.00 0.00 H new ATOM 1596 N VAL A 107 1.647 -20.376 -5.665 1.00 0.00 N ATOM 1597 CA VAL A 107 1.299 -21.068 -4.430 1.00 0.00 C ATOM 1598 C VAL A 107 0.597 -22.390 -4.720 1.00 0.00 C ATOM 1599 O VAL A 107 -0.531 -22.411 -5.212 1.00 0.00 O ATOM 1600 CB VAL A 107 0.391 -20.202 -3.537 1.00 0.00 C ATOM 1601 CG1 VAL A 107 0.004 -20.959 -2.276 1.00 0.00 C ATOM 1602 CG2 VAL A 107 1.078 -18.890 -3.193 1.00 0.00 C ATOM 0 H VAL A 107 0.865 -20.237 -6.305 1.00 0.00 H new ATOM 0 HA VAL A 107 2.233 -21.264 -3.903 1.00 0.00 H new ATOM 0 HB VAL A 107 -0.521 -19.974 -4.088 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -0.638 -20.331 -1.657 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -0.531 -21.869 -2.548 1.00 0.00 H new ATOM 0 HG13 VAL A 107 0.903 -21.220 -1.718 1.00 0.00 H new ATOM 0 HG21 VAL A 107 0.422 -18.291 -2.562 1.00 0.00 H new ATOM 0 HG22 VAL A 107 2.007 -19.094 -2.661 1.00 0.00 H new ATOM 0 HG23 VAL A 107 1.298 -18.343 -4.110 1.00 0.00 H new ATOM 1612 N TYR A 108 1.272 -23.492 -4.412 1.00 0.00 N ATOM 1613 CA TYR A 108 0.714 -24.819 -4.641 1.00 0.00 C ATOM 1614 C TYR A 108 0.326 -25.482 -3.323 1.00 0.00 C ATOM 1615 O TYR A 108 0.940 -25.234 -2.285 1.00 0.00 O ATOM 1616 CB TYR A 108 1.720 -25.696 -5.389 1.00 0.00 C ATOM 1617 CG TYR A 108 2.973 -25.992 -4.596 1.00 0.00 C ATOM 1618 CD1 TYR A 108 2.975 -26.958 -3.597 1.00 0.00 C ATOM 1619 CD2 TYR A 108 4.155 -25.306 -4.846 1.00 0.00 C ATOM 1620 CE1 TYR A 108 4.117 -27.231 -2.870 1.00 0.00 C ATOM 1621 CE2 TYR A 108 5.302 -25.574 -4.125 1.00 0.00 C ATOM 1622 CZ TYR A 108 5.278 -26.536 -3.137 1.00 0.00 C ATOM 1623 OH TYR A 108 6.418 -26.806 -2.416 1.00 0.00 O ATOM 0 H TYR A 108 2.206 -23.492 -4.003 1.00 0.00 H new ATOM 0 HA TYR A 108 -0.184 -24.708 -5.249 1.00 0.00 H new ATOM 0 HB2 TYR A 108 1.240 -26.637 -5.658 1.00 0.00 H new ATOM 0 HB3 TYR A 108 1.998 -25.202 -6.320 1.00 0.00 H new ATOM 0 HD1 TYR A 108 2.068 -27.505 -3.386 1.00 0.00 H new ATOM 0 HD2 TYR A 108 4.177 -24.550 -5.617 1.00 0.00 H new ATOM 0 HE1 TYR A 108 4.101 -27.985 -2.097 1.00 0.00 H new ATOM 0 HE2 TYR A 108 6.213 -25.033 -4.334 1.00 0.00 H new ATOM 0 HH TYR A 108 7.147 -26.231 -2.729 1.00 0.00 H new ATOM 1633 N ASP A 109 -0.698 -26.328 -3.373 1.00 0.00 N ATOM 1634 CA ASP A 109 -1.168 -27.029 -2.184 1.00 0.00 C ATOM 1635 C ASP A 109 -2.089 -28.185 -2.564 1.00 0.00 C ATOM 1636 O ASP A 109 -2.386 -28.395 -3.740 1.00 0.00 O ATOM 1637 CB ASP A 109 -1.900 -26.063 -1.252 1.00 0.00 C ATOM 1638 CG ASP A 109 -0.947 -25.198 -0.450 1.00 0.00 C ATOM 1639 OD1 ASP A 109 0.090 -25.723 0.005 1.00 0.00 O ATOM 1640 OD2 ASP A 109 -1.239 -23.995 -0.278 1.00 0.00 O ATOM 0 H ASP A 109 -1.218 -26.544 -4.224 1.00 0.00 H new ATOM 0 HA ASP A 109 -0.300 -27.435 -1.664 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -2.558 -25.424 -1.840 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -2.533 -26.630 -0.570 1.00 0.00 H new ATOM 1645 N VAL A 110 -2.538 -28.932 -1.560 1.00 0.00 N ATOM 1646 CA VAL A 110 -3.425 -30.066 -1.788 1.00 0.00 C ATOM 1647 C VAL A 110 -4.649 -29.998 -0.882 1.00 0.00 C ATOM 1648 O VAL A 110 -4.560 -29.568 0.268 1.00 0.00 O ATOM 1649 CB VAL A 110 -2.698 -31.403 -1.551 1.00 0.00 C ATOM 1650 CG1 VAL A 110 -3.653 -32.572 -1.746 1.00 0.00 C ATOM 1651 CG2 VAL A 110 -1.496 -31.527 -2.475 1.00 0.00 C ATOM 0 H VAL A 110 -2.302 -28.772 -0.581 1.00 0.00 H new ATOM 0 HA VAL A 110 -3.744 -30.014 -2.829 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.340 -31.424 -0.522 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -3.122 -33.508 -1.574 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -4.479 -32.489 -1.040 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -4.043 -32.557 -2.764 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.994 -32.478 -2.294 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.828 -31.484 -3.512 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -0.803 -30.708 -2.282 1.00 0.00 H new ATOM 1661 N VAL A 111 -5.792 -30.425 -1.408 1.00 0.00 N ATOM 1662 CA VAL A 111 -7.035 -30.415 -0.646 1.00 0.00 C ATOM 1663 C VAL A 111 -7.370 -31.806 -0.121 1.00 0.00 C ATOM 1664 O VAL A 111 -7.231 -32.799 -0.835 1.00 0.00 O ATOM 1665 CB VAL A 111 -8.212 -29.902 -1.498 1.00 0.00 C ATOM 1666 CG1 VAL A 111 -9.501 -29.916 -0.691 1.00 0.00 C ATOM 1667 CG2 VAL A 111 -7.918 -28.506 -2.026 1.00 0.00 C ATOM 0 H VAL A 111 -5.883 -30.782 -2.359 1.00 0.00 H new ATOM 0 HA VAL A 111 -6.884 -29.739 0.196 1.00 0.00 H new ATOM 0 HB VAL A 111 -8.339 -30.569 -2.351 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -10.321 -29.550 -1.309 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.717 -30.934 -0.367 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -9.390 -29.273 0.182 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -8.760 -28.159 -2.626 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -7.764 -27.825 -1.189 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -7.020 -28.532 -2.643 1.00 0.00 H new ATOM 1677 N GLU A 112 -7.813 -31.870 1.131 1.00 0.00 N ATOM 1678 CA GLU A 112 -8.168 -33.141 1.751 1.00 0.00 C ATOM 1679 C GLU A 112 -9.661 -33.198 2.058 1.00 0.00 C ATOM 1680 O GLU A 112 -10.143 -32.532 2.974 1.00 0.00 O ATOM 1681 CB GLU A 112 -7.363 -33.349 3.036 1.00 0.00 C ATOM 1682 CG GLU A 112 -5.955 -33.868 2.795 1.00 0.00 C ATOM 1683 CD GLU A 112 -5.298 -34.379 4.062 1.00 0.00 C ATOM 1684 OE1 GLU A 112 -5.553 -35.544 4.434 1.00 0.00 O ATOM 1685 OE2 GLU A 112 -4.528 -33.616 4.682 1.00 0.00 O ATOM 0 H GLU A 112 -7.934 -31.057 1.735 1.00 0.00 H new ATOM 0 HA GLU A 112 -7.929 -33.939 1.048 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -7.305 -32.404 3.576 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -7.895 -34.051 3.678 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -5.989 -34.671 2.058 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -5.345 -33.071 2.370 1.00 0.00 H new ATOM 1692 N GLU A 113 -10.389 -33.999 1.285 1.00 0.00 N ATOM 1693 CA GLU A 113 -11.827 -34.142 1.474 1.00 0.00 C ATOM 1694 C GLU A 113 -12.394 -35.215 0.548 1.00 0.00 C ATOM 1695 O GLU A 113 -12.404 -35.054 -0.672 1.00 0.00 O ATOM 1696 CB GLU A 113 -12.533 -32.808 1.219 1.00 0.00 C ATOM 1697 CG GLU A 113 -14.026 -32.846 1.499 1.00 0.00 C ATOM 1698 CD GLU A 113 -14.339 -32.954 2.979 1.00 0.00 C ATOM 1699 OE1 GLU A 113 -13.779 -32.162 3.764 1.00 0.00 O ATOM 1700 OE2 GLU A 113 -15.146 -33.832 3.351 1.00 0.00 O ATOM 0 H GLU A 113 -10.006 -34.558 0.523 1.00 0.00 H new ATOM 0 HA GLU A 113 -12.003 -34.447 2.506 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -12.075 -32.039 1.841 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -12.374 -32.515 0.181 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -14.490 -31.945 1.098 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -14.469 -33.693 0.975 1.00 0.00 H new ATOM 1707 N SER A 114 -12.863 -36.309 1.138 1.00 0.00 N ATOM 1708 CA SER A 114 -13.428 -37.411 0.367 1.00 0.00 C ATOM 1709 C SER A 114 -14.950 -37.421 0.467 1.00 0.00 C ATOM 1710 O SER A 114 -15.512 -37.653 1.537 1.00 0.00 O ATOM 1711 CB SER A 114 -12.864 -38.746 0.858 1.00 0.00 C ATOM 1712 OG SER A 114 -11.471 -38.832 0.614 1.00 0.00 O ATOM 0 H SER A 114 -12.863 -36.457 2.147 1.00 0.00 H new ATOM 0 HA SER A 114 -13.152 -37.270 -0.678 1.00 0.00 H new ATOM 0 HB2 SER A 114 -13.057 -38.855 1.925 1.00 0.00 H new ATOM 0 HB3 SER A 114 -13.376 -39.567 0.356 1.00 0.00 H new ATOM 0 HG SER A 114 -11.135 -39.693 0.938 1.00 0.00 H new ATOM 1718 N GLY A 115 -15.612 -37.166 -0.658 1.00 0.00 N ATOM 1719 CA GLY A 115 -17.063 -37.150 -0.676 1.00 0.00 C ATOM 1720 C GLY A 115 -17.638 -37.982 -1.806 1.00 0.00 C ATOM 1721 O GLY A 115 -16.922 -38.432 -2.700 1.00 0.00 O ATOM 0 H GLY A 115 -15.170 -36.970 -1.556 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -17.439 -37.526 0.276 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -17.411 -36.122 -0.773 1.00 0.00 H new ATOM 1725 N PRO A 116 -18.961 -38.198 -1.772 1.00 0.00 N ATOM 1726 CA PRO A 116 -19.661 -38.984 -2.793 1.00 0.00 C ATOM 1727 C PRO A 116 -19.713 -38.270 -4.139 1.00 0.00 C ATOM 1728 O PRO A 116 -19.917 -37.058 -4.202 1.00 0.00 O ATOM 1729 CB PRO A 116 -21.070 -39.141 -2.216 1.00 0.00 C ATOM 1730 CG PRO A 116 -21.239 -37.973 -1.307 1.00 0.00 C ATOM 1731 CD PRO A 116 -19.877 -37.693 -0.735 1.00 0.00 C ATOM 0 HA PRO A 116 -19.160 -39.931 -2.993 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -21.823 -39.141 -3.004 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -21.174 -40.082 -1.675 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -21.620 -37.108 -1.850 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -21.956 -38.194 -0.517 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -19.729 -36.629 -0.552 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -19.728 -38.204 0.216 1.00 0.00 H new ATOM 1739 N SER A 117 -19.527 -39.030 -5.214 1.00 0.00 N ATOM 1740 CA SER A 117 -19.550 -38.468 -6.560 1.00 0.00 C ATOM 1741 C SER A 117 -20.983 -38.221 -7.022 1.00 0.00 C ATOM 1742 O SER A 117 -21.325 -37.122 -7.457 1.00 0.00 O ATOM 1743 CB SER A 117 -18.841 -39.407 -7.539 1.00 0.00 C ATOM 1744 OG SER A 117 -18.780 -38.839 -8.836 1.00 0.00 O ATOM 0 H SER A 117 -19.359 -40.035 -5.179 1.00 0.00 H new ATOM 0 HA SER A 117 -19.025 -37.513 -6.537 1.00 0.00 H new ATOM 0 HB2 SER A 117 -17.832 -39.616 -7.182 1.00 0.00 H new ATOM 0 HB3 SER A 117 -19.368 -40.360 -7.580 1.00 0.00 H new ATOM 0 HG SER A 117 -18.321 -39.457 -9.443 1.00 0.00 H new ATOM 1750 N SER A 118 -21.816 -39.252 -6.923 1.00 0.00 N ATOM 1751 CA SER A 118 -23.211 -39.150 -7.333 1.00 0.00 C ATOM 1752 C SER A 118 -24.067 -38.572 -6.210 1.00 0.00 C ATOM 1753 O SER A 118 -23.899 -38.924 -5.043 1.00 0.00 O ATOM 1754 CB SER A 118 -23.746 -40.523 -7.743 1.00 0.00 C ATOM 1755 OG SER A 118 -23.490 -40.782 -9.113 1.00 0.00 O ATOM 0 H SER A 118 -21.549 -40.168 -6.562 1.00 0.00 H new ATOM 0 HA SER A 118 -23.264 -38.477 -8.189 1.00 0.00 H new ATOM 0 HB2 SER A 118 -23.281 -41.296 -7.131 1.00 0.00 H new ATOM 0 HB3 SER A 118 -24.819 -40.570 -7.555 1.00 0.00 H new ATOM 0 HG SER A 118 -23.840 -41.666 -9.350 1.00 0.00 H new ATOM 1761 N GLY A 119 -24.986 -37.682 -6.572 1.00 0.00 N ATOM 1762 CA GLY A 119 -25.855 -37.070 -5.584 1.00 0.00 C ATOM 1763 C GLY A 119 -25.262 -35.805 -4.995 1.00 0.00 C ATOM 1764 O GLY A 119 -24.227 -35.848 -4.331 1.00 0.00 O ATOM 0 H GLY A 119 -25.144 -37.374 -7.531 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -26.816 -36.838 -6.044 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -26.049 -37.784 -4.783 1.00 0.00 H new TER 1768 GLY A 119