USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 780 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 2 SER OG : rot 180:sc= 0.737 USER MOD Set 1.2: A 97 LYS NZ :NH3+ 165:sc= 0.852 (180deg=0) USER MOD Set 2.1: A 38 GLN : amide:sc= 0.973 K(o=0.91,f=-0.11) USER MOD Set 2.2: A 77 MET CE :methyl -146:sc= -0.0648 (180deg=-1.73!) USER MOD Set 3.1: A 47 MET CE :methyl 168:sc= -0.103 (180deg=-0.167) USER MOD Set 3.2: A 56 HIS : no HD1:sc= 1.1 K(o=0.99,f=-6.7!) USER MOD Set 4.1: A 5 SER OG : rot 180:sc= 0.617 USER MOD Set 4.2: A 96 ASN : amide:sc= 1.81 K(o=2.4,f=0.11) USER MOD Single : A 1 GLY N :NH3+ -130:sc= 0.0385 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -172:sc= 0.837 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 GLN : amide:sc= 0.505 K(o=0.5,f=-7.5!) USER MOD Single : A 17 THR OG1 : rot 69:sc= 0.985 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -158:sc= 1.24 (180deg=1.17) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= 0.889 K(o=0.89,f=-0.34) USER MOD Single : A 45 THR OG1 : rot 178:sc= 0.26 USER MOD Single : A 46 HIS : no HD1:sc= 0.804 K(o=0.8,f=-3.3!) USER MOD Single : A 49 LYS NZ :NH3+ -154:sc= 2.45 (180deg=1.69) USER MOD Single : A 53 THR OG1 : rot -58:sc= 0.542 USER MOD Single : A 55 GLN : amide:sc= -0.0363 X(o=-0.036,f=-0.036) USER MOD Single : A 57 GLN : amide:sc= 0.923 K(o=0.92,f=-0.017) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -147:sc= 0.0179 (180deg=-0.156!) USER MOD Single : A 79 MET CE :methyl -170:sc= 0 (180deg=-0.116) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 30:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ -172:sc= 1.25 (180deg=1.14) USER MOD Single : A 90 ASN : amide:sc= 0.683 K(o=0.68,f=0) USER MOD Single : A 91 LYS NZ :NH3+ -147:sc= 1.23 (180deg=0.963) USER MOD Single : A 93 SER OG : rot 159:sc= 1.3 USER MOD Single : A 95 HIS : no HD1:sc= -0.132 X(o=-0.13,f=-0.19) USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -10.987 -7.662 18.517 1.00 0.00 N ATOM 2 CA GLY A 1 -9.934 -7.602 17.479 1.00 0.00 C ATOM 3 C GLY A 1 -8.581 -8.036 18.023 1.00 0.00 C ATOM 4 O GLY A 1 -8.509 -8.844 18.952 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.809 -8.182 18.148 1.00 0.00 H new ATOM 0 H2 GLY A 1 -10.618 -8.149 19.358 1.00 0.00 H new ATOM 0 H3 GLY A 1 -11.276 -6.697 18.775 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -10.212 -8.242 16.642 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.862 -6.585 17.093 1.00 0.00 H new ATOM 10 N SER A 2 -7.493 -7.513 17.447 1.00 0.00 N ATOM 11 CA SER A 2 -6.105 -7.815 17.847 1.00 0.00 C ATOM 12 C SER A 2 -5.785 -7.361 19.280 1.00 0.00 C ATOM 13 O SER A 2 -6.199 -6.279 19.706 1.00 0.00 O ATOM 14 CB SER A 2 -5.126 -7.141 16.878 1.00 0.00 C ATOM 15 OG SER A 2 -5.363 -7.585 15.550 1.00 0.00 O ATOM 0 H SER A 2 -7.549 -6.853 16.672 1.00 0.00 H new ATOM 0 HA SER A 2 -5.997 -8.899 17.813 1.00 0.00 H new ATOM 0 HB2 SER A 2 -5.238 -6.058 16.932 1.00 0.00 H new ATOM 0 HB3 SER A 2 -4.101 -7.371 17.168 1.00 0.00 H new ATOM 0 HG SER A 2 -4.733 -7.146 14.941 1.00 0.00 H new ATOM 21 N SER A 3 -5.003 -8.160 20.015 1.00 0.00 N ATOM 22 CA SER A 3 -4.622 -7.882 21.414 1.00 0.00 C ATOM 23 C SER A 3 -3.611 -6.732 21.559 1.00 0.00 C ATOM 24 O SER A 3 -3.585 -6.057 22.591 1.00 0.00 O ATOM 25 CB SER A 3 -4.037 -9.145 22.061 1.00 0.00 C ATOM 26 OG SER A 3 -4.940 -10.236 21.943 1.00 0.00 O ATOM 0 H SER A 3 -4.610 -9.030 19.655 1.00 0.00 H new ATOM 0 HA SER A 3 -5.537 -7.573 21.920 1.00 0.00 H new ATOM 0 HB2 SER A 3 -3.090 -9.398 21.585 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.824 -8.955 23.113 1.00 0.00 H new ATOM 0 HG SER A 3 -4.548 -11.032 22.360 1.00 0.00 H new ATOM 32 N GLY A 4 -2.787 -6.497 20.531 1.00 0.00 N ATOM 33 CA GLY A 4 -1.785 -5.425 20.474 1.00 0.00 C ATOM 34 C GLY A 4 -0.616 -5.739 19.530 1.00 0.00 C ATOM 35 O GLY A 4 -0.606 -6.772 18.855 1.00 0.00 O ATOM 0 H GLY A 4 -2.800 -7.068 19.686 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -2.267 -4.503 20.150 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.396 -5.246 21.476 1.00 0.00 H new ATOM 39 N SER A 5 0.377 -4.849 19.497 1.00 0.00 N ATOM 40 CA SER A 5 1.643 -5.004 18.761 1.00 0.00 C ATOM 41 C SER A 5 2.753 -4.196 19.452 1.00 0.00 C ATOM 42 O SER A 5 2.529 -3.039 19.820 1.00 0.00 O ATOM 43 CB SER A 5 1.460 -4.530 17.313 1.00 0.00 C ATOM 44 OG SER A 5 2.605 -4.817 16.525 1.00 0.00 O ATOM 0 H SER A 5 0.324 -3.964 20.001 1.00 0.00 H new ATOM 0 HA SER A 5 1.930 -6.055 18.755 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.586 -5.015 16.878 1.00 0.00 H new ATOM 0 HB3 SER A 5 1.268 -3.457 17.301 1.00 0.00 H new ATOM 0 HG SER A 5 2.458 -4.505 15.608 1.00 0.00 H new ATOM 50 N SER A 6 3.938 -4.783 19.651 1.00 0.00 N ATOM 51 CA SER A 6 5.065 -4.166 20.378 1.00 0.00 C ATOM 52 C SER A 6 6.407 -4.262 19.640 1.00 0.00 C ATOM 53 O SER A 6 6.652 -5.196 18.874 1.00 0.00 O ATOM 54 CB SER A 6 5.186 -4.763 21.786 1.00 0.00 C ATOM 55 OG SER A 6 5.479 -6.149 21.740 1.00 0.00 O ATOM 0 H SER A 6 4.150 -5.719 19.306 1.00 0.00 H new ATOM 0 HA SER A 6 4.833 -3.103 20.446 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.970 -4.243 22.337 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.255 -4.605 22.330 1.00 0.00 H new ATOM 0 HG SER A 6 5.423 -6.525 22.643 1.00 0.00 H new ATOM 61 N GLY A 7 7.289 -3.283 19.877 1.00 0.00 N ATOM 62 CA GLY A 7 8.617 -3.179 19.256 1.00 0.00 C ATOM 63 C GLY A 7 8.578 -2.709 17.790 1.00 0.00 C ATOM 64 O GLY A 7 8.457 -3.548 16.891 1.00 0.00 O ATOM 0 H GLY A 7 7.094 -2.519 20.524 1.00 0.00 H new ATOM 0 HA2 GLY A 7 9.226 -2.485 19.835 1.00 0.00 H new ATOM 0 HA3 GLY A 7 9.108 -4.151 19.304 1.00 0.00 H new ATOM 68 N PRO A 8 8.706 -1.392 17.520 1.00 0.00 N ATOM 69 CA PRO A 8 8.797 -0.842 16.163 1.00 0.00 C ATOM 70 C PRO A 8 9.971 -1.418 15.354 1.00 0.00 C ATOM 71 O PRO A 8 11.007 -1.794 15.914 1.00 0.00 O ATOM 72 CB PRO A 8 8.925 0.676 16.334 1.00 0.00 C ATOM 73 CG PRO A 8 8.271 0.933 17.691 1.00 0.00 C ATOM 74 CD PRO A 8 8.666 -0.307 18.490 1.00 0.00 C ATOM 0 HA PRO A 8 7.912 -1.113 15.588 1.00 0.00 H new ATOM 0 HB2 PRO A 8 9.967 0.996 16.323 1.00 0.00 H new ATOM 0 HB3 PRO A 8 8.417 1.215 15.534 1.00 0.00 H new ATOM 0 HG2 PRO A 8 8.641 1.848 18.153 1.00 0.00 H new ATOM 0 HG3 PRO A 8 7.189 1.034 17.607 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.635 -0.173 18.971 1.00 0.00 H new ATOM 0 HD3 PRO A 8 7.944 -0.512 19.280 1.00 0.00 H new ATOM 82 N ILE A 9 9.819 -1.490 14.029 1.00 0.00 N ATOM 83 CA ILE A 9 10.763 -2.183 13.138 1.00 0.00 C ATOM 84 C ILE A 9 12.098 -1.430 12.950 1.00 0.00 C ATOM 85 O ILE A 9 12.159 -0.200 13.025 1.00 0.00 O ATOM 86 CB ILE A 9 10.065 -2.526 11.801 1.00 0.00 C ATOM 87 CG1 ILE A 9 10.734 -3.754 11.144 1.00 0.00 C ATOM 88 CG2 ILE A 9 10.002 -1.299 10.873 1.00 0.00 C ATOM 89 CD1 ILE A 9 10.032 -4.246 9.877 1.00 0.00 C ATOM 0 H ILE A 9 9.032 -1.067 13.537 1.00 0.00 H new ATOM 0 HA ILE A 9 11.052 -3.117 13.620 1.00 0.00 H new ATOM 0 HB ILE A 9 9.030 -2.801 12.002 1.00 0.00 H new ATOM 0 HG12 ILE A 9 11.767 -3.504 10.900 1.00 0.00 H new ATOM 0 HG13 ILE A 9 10.765 -4.568 11.868 1.00 0.00 H new ATOM 0 HG21 ILE A 9 9.506 -1.572 9.942 1.00 0.00 H new ATOM 0 HG22 ILE A 9 9.442 -0.501 11.362 1.00 0.00 H new ATOM 0 HG23 ILE A 9 11.013 -0.953 10.658 1.00 0.00 H new ATOM 0 HD11 ILE A 9 10.564 -5.110 9.478 1.00 0.00 H new ATOM 0 HD12 ILE A 9 9.007 -4.530 10.116 1.00 0.00 H new ATOM 0 HD13 ILE A 9 10.024 -3.450 9.133 1.00 0.00 H new ATOM 101 N SER A 10 13.168 -2.179 12.664 1.00 0.00 N ATOM 102 CA SER A 10 14.524 -1.677 12.372 1.00 0.00 C ATOM 103 C SER A 10 14.870 -1.596 10.872 1.00 0.00 C ATOM 104 O SER A 10 15.970 -1.162 10.519 1.00 0.00 O ATOM 105 CB SER A 10 15.545 -2.545 13.120 1.00 0.00 C ATOM 106 OG SER A 10 15.400 -3.912 12.760 1.00 0.00 O ATOM 0 H SER A 10 13.115 -3.197 12.627 1.00 0.00 H new ATOM 0 HA SER A 10 14.560 -0.645 12.720 1.00 0.00 H new ATOM 0 HB2 SER A 10 16.555 -2.208 12.889 1.00 0.00 H new ATOM 0 HB3 SER A 10 15.409 -2.430 14.195 1.00 0.00 H new ATOM 0 HG SER A 10 16.060 -4.450 13.245 1.00 0.00 H new ATOM 112 N GLU A 11 13.956 -1.991 9.975 1.00 0.00 N ATOM 113 CA GLU A 11 14.160 -2.048 8.515 1.00 0.00 C ATOM 114 C GLU A 11 13.078 -1.267 7.748 1.00 0.00 C ATOM 115 O GLU A 11 11.882 -1.408 8.024 1.00 0.00 O ATOM 116 CB GLU A 11 14.205 -3.509 8.031 1.00 0.00 C ATOM 117 CG GLU A 11 15.403 -4.287 8.592 1.00 0.00 C ATOM 118 CD GLU A 11 15.489 -5.693 7.969 1.00 0.00 C ATOM 119 OE1 GLU A 11 16.193 -5.865 6.942 1.00 0.00 O ATOM 120 OE2 GLU A 11 14.862 -6.642 8.502 1.00 0.00 O ATOM 0 H GLU A 11 13.021 -2.291 10.252 1.00 0.00 H new ATOM 0 HA GLU A 11 15.118 -1.573 8.306 1.00 0.00 H new ATOM 0 HB2 GLU A 11 13.283 -4.012 8.323 1.00 0.00 H new ATOM 0 HB3 GLU A 11 14.246 -3.525 6.942 1.00 0.00 H new ATOM 0 HG2 GLU A 11 16.324 -3.739 8.390 1.00 0.00 H new ATOM 0 HG3 GLU A 11 15.312 -4.370 9.675 1.00 0.00 H new ATOM 127 N ARG A 12 13.502 -0.451 6.769 1.00 0.00 N ATOM 128 CA ARG A 12 12.667 0.520 6.027 1.00 0.00 C ATOM 129 C ARG A 12 11.758 1.336 6.972 1.00 0.00 C ATOM 130 O ARG A 12 12.207 1.784 8.029 1.00 0.00 O ATOM 131 CB ARG A 12 11.931 -0.163 4.847 1.00 0.00 C ATOM 132 CG ARG A 12 12.847 -0.995 3.934 1.00 0.00 C ATOM 133 CD ARG A 12 12.295 -1.160 2.508 1.00 0.00 C ATOM 134 NE ARG A 12 10.922 -1.707 2.464 1.00 0.00 N ATOM 135 CZ ARG A 12 10.261 -2.090 1.386 1.00 0.00 C ATOM 136 NH1 ARG A 12 10.798 -2.082 0.200 1.00 0.00 N ATOM 137 NH2 ARG A 12 9.028 -2.484 1.500 1.00 0.00 N ATOM 0 H ARG A 12 14.473 -0.446 6.457 1.00 0.00 H new ATOM 0 HA ARG A 12 13.319 1.263 5.568 1.00 0.00 H new ATOM 0 HB2 ARG A 12 11.149 -0.809 5.246 1.00 0.00 H new ATOM 0 HB3 ARG A 12 11.437 0.603 4.248 1.00 0.00 H new ATOM 0 HG2 ARG A 12 13.827 -0.521 3.884 1.00 0.00 H new ATOM 0 HG3 ARG A 12 12.992 -1.980 4.377 1.00 0.00 H new ATOM 0 HD2 ARG A 12 12.307 -0.191 2.008 1.00 0.00 H new ATOM 0 HD3 ARG A 12 12.957 -1.818 1.945 1.00 0.00 H new ATOM 0 HE ARG A 12 10.436 -1.798 3.356 1.00 0.00 H new ATOM 0 HH11 ARG A 12 11.762 -1.772 0.079 1.00 0.00 H new ATOM 0 HH12 ARG A 12 10.254 -2.385 -0.608 1.00 0.00 H new ATOM 0 HH21 ARG A 12 8.579 -2.496 2.416 1.00 0.00 H new ATOM 0 HH22 ARG A 12 8.509 -2.782 0.674 1.00 0.00 H new ATOM 151 N ASN A 13 10.491 1.530 6.599 1.00 0.00 N ATOM 152 CA ASN A 13 9.455 2.221 7.374 1.00 0.00 C ATOM 153 C ASN A 13 8.162 1.379 7.416 1.00 0.00 C ATOM 154 O ASN A 13 7.061 1.909 7.264 1.00 0.00 O ATOM 155 CB ASN A 13 9.256 3.635 6.787 1.00 0.00 C ATOM 156 CG ASN A 13 10.474 4.526 6.982 1.00 0.00 C ATOM 157 OD1 ASN A 13 11.378 4.581 6.160 1.00 0.00 O ATOM 158 ND2 ASN A 13 10.555 5.230 8.090 1.00 0.00 N ATOM 0 H ASN A 13 10.141 1.192 5.702 1.00 0.00 H new ATOM 0 HA ASN A 13 9.762 2.340 8.413 1.00 0.00 H new ATOM 0 HB2 ASN A 13 9.036 3.555 5.723 1.00 0.00 H new ATOM 0 HB3 ASN A 13 8.390 4.101 7.257 1.00 0.00 H new ATOM 0 HD21 ASN A 13 11.370 5.819 8.261 1.00 0.00 H new ATOM 0 HD22 ASN A 13 9.803 5.187 8.778 1.00 0.00 H new ATOM 165 N GLN A 14 8.282 0.053 7.580 1.00 0.00 N ATOM 166 CA GLN A 14 7.173 -0.904 7.407 1.00 0.00 C ATOM 167 C GLN A 14 5.953 -0.652 8.324 1.00 0.00 C ATOM 168 O GLN A 14 4.842 -1.036 7.967 1.00 0.00 O ATOM 169 CB GLN A 14 7.672 -2.350 7.586 1.00 0.00 C ATOM 170 CG GLN A 14 8.825 -2.794 6.666 1.00 0.00 C ATOM 171 CD GLN A 14 8.429 -3.008 5.210 1.00 0.00 C ATOM 172 OE1 GLN A 14 8.731 -2.215 4.328 1.00 0.00 O ATOM 173 NE2 GLN A 14 7.772 -4.099 4.886 1.00 0.00 N ATOM 0 H GLN A 14 9.162 -0.393 7.840 1.00 0.00 H new ATOM 0 HA GLN A 14 6.819 -0.747 6.388 1.00 0.00 H new ATOM 0 HB2 GLN A 14 7.992 -2.476 8.620 1.00 0.00 H new ATOM 0 HB3 GLN A 14 6.830 -3.024 7.429 1.00 0.00 H new ATOM 0 HG2 GLN A 14 9.615 -2.044 6.707 1.00 0.00 H new ATOM 0 HG3 GLN A 14 9.246 -3.722 7.054 1.00 0.00 H new ATOM 0 HE21 GLN A 14 7.512 -4.771 5.608 1.00 0.00 H new ATOM 0 HE22 GLN A 14 7.522 -4.274 3.913 1.00 0.00 H new ATOM 182 N ASP A 15 6.123 0.034 9.462 1.00 0.00 N ATOM 183 CA ASP A 15 5.021 0.418 10.367 1.00 0.00 C ATOM 184 C ASP A 15 4.166 1.598 9.852 1.00 0.00 C ATOM 185 O ASP A 15 3.024 1.763 10.279 1.00 0.00 O ATOM 186 CB ASP A 15 5.583 0.738 11.762 1.00 0.00 C ATOM 187 CG ASP A 15 6.184 -0.489 12.468 1.00 0.00 C ATOM 188 OD1 ASP A 15 7.326 -0.393 12.975 1.00 0.00 O ATOM 189 OD2 ASP A 15 5.505 -1.541 12.529 1.00 0.00 O ATOM 0 H ASP A 15 7.039 0.344 9.788 1.00 0.00 H new ATOM 0 HA ASP A 15 4.349 -0.439 10.414 1.00 0.00 H new ATOM 0 HB2 ASP A 15 6.349 1.508 11.670 1.00 0.00 H new ATOM 0 HB3 ASP A 15 4.787 1.152 12.381 1.00 0.00 H new ATOM 194 N ALA A 16 4.683 2.394 8.910 1.00 0.00 N ATOM 195 CA ALA A 16 3.974 3.464 8.197 1.00 0.00 C ATOM 196 C ALA A 16 3.894 3.195 6.678 1.00 0.00 C ATOM 197 O ALA A 16 3.521 4.070 5.899 1.00 0.00 O ATOM 198 CB ALA A 16 4.630 4.807 8.545 1.00 0.00 C ATOM 0 H ALA A 16 5.654 2.306 8.609 1.00 0.00 H new ATOM 0 HA ALA A 16 2.935 3.498 8.525 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.113 5.611 8.022 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.567 4.975 9.620 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.677 4.790 8.241 1.00 0.00 H new ATOM 204 N THR A 17 4.220 1.972 6.252 1.00 0.00 N ATOM 205 CA THR A 17 4.076 1.491 4.873 1.00 0.00 C ATOM 206 C THR A 17 2.941 0.474 4.827 1.00 0.00 C ATOM 207 O THR A 17 2.835 -0.384 5.704 1.00 0.00 O ATOM 208 CB THR A 17 5.395 0.895 4.349 1.00 0.00 C ATOM 209 OG1 THR A 17 6.443 1.820 4.518 1.00 0.00 O ATOM 210 CG2 THR A 17 5.400 0.536 2.863 1.00 0.00 C ATOM 0 H THR A 17 4.605 1.264 6.878 1.00 0.00 H new ATOM 0 HA THR A 17 3.834 2.328 4.218 1.00 0.00 H new ATOM 0 HB THR A 17 5.519 -0.020 4.928 1.00 0.00 H new ATOM 0 HG1 THR A 17 6.638 1.923 5.473 1.00 0.00 H new ATOM 0 HG21 THR A 17 6.372 0.124 2.591 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.624 -0.204 2.665 1.00 0.00 H new ATOM 0 HG23 THR A 17 5.207 1.431 2.272 1.00 0.00 H new ATOM 218 N VAL A 18 2.087 0.547 3.810 1.00 0.00 N ATOM 219 CA VAL A 18 1.067 -0.476 3.536 1.00 0.00 C ATOM 220 C VAL A 18 1.557 -1.431 2.453 1.00 0.00 C ATOM 221 O VAL A 18 2.268 -1.018 1.539 1.00 0.00 O ATOM 222 CB VAL A 18 -0.312 0.120 3.190 1.00 0.00 C ATOM 223 CG1 VAL A 18 -0.773 1.080 4.289 1.00 0.00 C ATOM 224 CG2 VAL A 18 -0.350 0.889 1.869 1.00 0.00 C ATOM 0 H VAL A 18 2.078 1.320 3.145 1.00 0.00 H new ATOM 0 HA VAL A 18 0.918 -1.038 4.458 1.00 0.00 H new ATOM 0 HB VAL A 18 -0.972 -0.743 3.099 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.748 1.491 4.028 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.847 0.542 5.234 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.052 1.892 4.389 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -1.356 1.275 1.701 1.00 0.00 H new ATOM 0 HG22 VAL A 18 0.355 1.719 1.911 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.077 0.222 1.052 1.00 0.00 H new ATOM 234 N TYR A 19 1.163 -2.694 2.550 1.00 0.00 N ATOM 235 CA TYR A 19 1.321 -3.716 1.516 1.00 0.00 C ATOM 236 C TYR A 19 0.026 -3.781 0.697 1.00 0.00 C ATOM 237 O TYR A 19 -1.063 -3.677 1.263 1.00 0.00 O ATOM 238 CB TYR A 19 1.628 -5.063 2.190 1.00 0.00 C ATOM 239 CG TYR A 19 1.432 -6.285 1.305 1.00 0.00 C ATOM 240 CD1 TYR A 19 2.511 -6.825 0.579 1.00 0.00 C ATOM 241 CD2 TYR A 19 0.157 -6.881 1.208 1.00 0.00 C ATOM 242 CE1 TYR A 19 2.320 -7.962 -0.231 1.00 0.00 C ATOM 243 CE2 TYR A 19 -0.042 -8.004 0.383 1.00 0.00 C ATOM 244 CZ TYR A 19 1.039 -8.549 -0.339 1.00 0.00 C ATOM 245 OH TYR A 19 0.841 -9.640 -1.129 1.00 0.00 O ATOM 0 H TYR A 19 0.704 -3.053 3.387 1.00 0.00 H new ATOM 0 HA TYR A 19 2.146 -3.475 0.846 1.00 0.00 H new ATOM 0 HB2 TYR A 19 2.660 -5.049 2.541 1.00 0.00 H new ATOM 0 HB3 TYR A 19 0.993 -5.165 3.070 1.00 0.00 H new ATOM 0 HD1 TYR A 19 3.487 -6.367 0.643 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -0.671 -6.474 1.770 1.00 0.00 H new ATOM 0 HE1 TYR A 19 3.154 -8.386 -0.770 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -1.023 -8.448 0.303 1.00 0.00 H new ATOM 0 HH TYR A 19 -0.100 -9.911 -1.083 1.00 0.00 H new ATOM 255 N VAL A 20 0.143 -3.974 -0.617 1.00 0.00 N ATOM 256 CA VAL A 20 -0.976 -4.115 -1.559 1.00 0.00 C ATOM 257 C VAL A 20 -0.744 -5.350 -2.428 1.00 0.00 C ATOM 258 O VAL A 20 0.171 -5.363 -3.251 1.00 0.00 O ATOM 259 CB VAL A 20 -1.137 -2.862 -2.446 1.00 0.00 C ATOM 260 CG1 VAL A 20 -2.429 -2.972 -3.266 1.00 0.00 C ATOM 261 CG2 VAL A 20 -1.184 -1.555 -1.643 1.00 0.00 C ATOM 0 H VAL A 20 1.052 -4.039 -1.075 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.897 -4.228 -0.987 1.00 0.00 H new ATOM 0 HB VAL A 20 -0.258 -2.826 -3.090 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.540 -2.086 -3.891 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -2.384 -3.859 -3.898 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -3.282 -3.050 -2.592 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.298 -0.713 -2.325 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -2.028 -1.581 -0.954 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -0.259 -1.441 -1.078 1.00 0.00 H new ATOM 271 N GLY A 21 -1.567 -6.387 -2.263 1.00 0.00 N ATOM 272 CA GLY A 21 -1.510 -7.623 -3.051 1.00 0.00 C ATOM 273 C GLY A 21 -2.665 -7.741 -4.048 1.00 0.00 C ATOM 274 O GLY A 21 -3.781 -7.314 -3.752 1.00 0.00 O ATOM 0 H GLY A 21 -2.309 -6.393 -1.563 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -0.564 -7.662 -3.591 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -1.528 -8.480 -2.377 1.00 0.00 H new ATOM 278 N GLY A 22 -2.405 -8.343 -5.213 1.00 0.00 N ATOM 279 CA GLY A 22 -3.403 -8.624 -6.260 1.00 0.00 C ATOM 280 C GLY A 22 -3.408 -7.614 -7.418 1.00 0.00 C ATOM 281 O GLY A 22 -4.459 -7.341 -7.999 1.00 0.00 O ATOM 0 H GLY A 22 -1.468 -8.659 -5.465 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -3.219 -9.620 -6.663 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.394 -8.642 -5.805 1.00 0.00 H new ATOM 285 N LEU A 23 -2.250 -7.022 -7.724 1.00 0.00 N ATOM 286 CA LEU A 23 -2.084 -5.931 -8.681 1.00 0.00 C ATOM 287 C LEU A 23 -2.124 -6.435 -10.127 1.00 0.00 C ATOM 288 O LEU A 23 -1.607 -7.509 -10.444 1.00 0.00 O ATOM 289 CB LEU A 23 -0.754 -5.205 -8.409 1.00 0.00 C ATOM 290 CG LEU A 23 -0.629 -4.557 -7.020 1.00 0.00 C ATOM 291 CD1 LEU A 23 0.726 -3.863 -6.918 1.00 0.00 C ATOM 292 CD2 LEU A 23 -1.729 -3.528 -6.767 1.00 0.00 C ATOM 0 H LEU A 23 -1.369 -7.303 -7.293 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.915 -5.238 -8.552 1.00 0.00 H new ATOM 0 HB2 LEU A 23 0.061 -5.917 -8.534 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.620 -4.432 -9.165 1.00 0.00 H new ATOM 0 HG LEU A 23 -0.725 -5.345 -6.273 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.825 -3.400 -5.936 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.521 -4.596 -7.055 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.801 -3.097 -7.690 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -1.602 -3.096 -5.774 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.669 -2.739 -7.517 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.703 -4.014 -6.829 1.00 0.00 H new ATOM 304 N ASP A 24 -2.694 -5.625 -11.017 1.00 0.00 N ATOM 305 CA ASP A 24 -2.747 -5.904 -12.452 1.00 0.00 C ATOM 306 C ASP A 24 -1.471 -5.446 -13.191 1.00 0.00 C ATOM 307 O ASP A 24 -0.753 -4.557 -12.731 1.00 0.00 O ATOM 308 CB ASP A 24 -4.008 -5.249 -13.035 1.00 0.00 C ATOM 309 CG ASP A 24 -4.150 -5.532 -14.531 1.00 0.00 C ATOM 310 OD1 ASP A 24 -3.872 -4.619 -15.340 1.00 0.00 O ATOM 311 OD2 ASP A 24 -4.480 -6.682 -14.896 1.00 0.00 O ATOM 0 H ASP A 24 -3.138 -4.744 -10.759 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.796 -6.983 -12.597 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -4.888 -5.620 -12.509 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.969 -4.172 -12.870 1.00 0.00 H new ATOM 316 N GLU A 25 -1.196 -6.002 -14.374 1.00 0.00 N ATOM 317 CA GLU A 25 -0.043 -5.629 -15.213 1.00 0.00 C ATOM 318 C GLU A 25 -0.002 -4.138 -15.622 1.00 0.00 C ATOM 319 O GLU A 25 1.079 -3.622 -15.919 1.00 0.00 O ATOM 320 CB GLU A 25 0.024 -6.549 -16.445 1.00 0.00 C ATOM 321 CG GLU A 25 -1.162 -6.402 -17.410 1.00 0.00 C ATOM 322 CD GLU A 25 -1.017 -7.362 -18.607 1.00 0.00 C ATOM 323 OE1 GLU A 25 -1.487 -8.524 -18.521 1.00 0.00 O ATOM 324 OE2 GLU A 25 -0.437 -6.962 -19.646 1.00 0.00 O ATOM 0 H GLU A 25 -1.774 -6.735 -14.786 1.00 0.00 H new ATOM 0 HA GLU A 25 0.844 -5.770 -14.596 1.00 0.00 H new ATOM 0 HB2 GLU A 25 0.946 -6.343 -16.988 1.00 0.00 H new ATOM 0 HB3 GLU A 25 0.077 -7.584 -16.108 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -2.093 -6.609 -16.883 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -1.220 -5.374 -17.768 1.00 0.00 H new ATOM 331 N LYS A 26 -1.141 -3.426 -15.598 1.00 0.00 N ATOM 332 CA LYS A 26 -1.223 -1.973 -15.850 1.00 0.00 C ATOM 333 C LYS A 26 -0.836 -1.099 -14.644 1.00 0.00 C ATOM 334 O LYS A 26 -0.630 0.104 -14.813 1.00 0.00 O ATOM 335 CB LYS A 26 -2.631 -1.620 -16.359 1.00 0.00 C ATOM 336 CG LYS A 26 -2.918 -2.261 -17.730 1.00 0.00 C ATOM 337 CD LYS A 26 -4.281 -1.858 -18.309 1.00 0.00 C ATOM 338 CE LYS A 26 -5.493 -2.278 -17.462 1.00 0.00 C ATOM 339 NZ LYS A 26 -5.587 -3.752 -17.305 1.00 0.00 N ATOM 0 H LYS A 26 -2.048 -3.849 -15.400 1.00 0.00 H new ATOM 0 HA LYS A 26 -0.479 -1.745 -16.613 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -3.374 -1.957 -15.637 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.729 -0.537 -16.436 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -2.133 -1.974 -18.430 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.878 -3.346 -17.633 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -4.301 -0.775 -18.434 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -4.381 -2.295 -19.302 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.424 -1.814 -16.478 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -6.405 -1.905 -17.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -6.566 -4.014 -17.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -5.308 -4.214 -18.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -4.953 -4.061 -16.541 1.00 0.00 H new ATOM 353 N VAL A 27 -0.719 -1.669 -13.439 1.00 0.00 N ATOM 354 CA VAL A 27 -0.320 -0.944 -12.217 1.00 0.00 C ATOM 355 C VAL A 27 1.166 -0.565 -12.256 1.00 0.00 C ATOM 356 O VAL A 27 2.008 -1.364 -12.672 1.00 0.00 O ATOM 357 CB VAL A 27 -0.653 -1.754 -10.946 1.00 0.00 C ATOM 358 CG1 VAL A 27 -0.238 -1.023 -9.665 1.00 0.00 C ATOM 359 CG2 VAL A 27 -2.159 -2.037 -10.847 1.00 0.00 C ATOM 0 H VAL A 27 -0.900 -2.660 -13.278 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.899 -0.021 -12.181 1.00 0.00 H new ATOM 0 HB VAL A 27 -0.091 -2.684 -11.034 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -0.493 -1.633 -8.799 1.00 0.00 H new ATOM 0 HG12 VAL A 27 0.837 -0.845 -9.680 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.762 -0.069 -9.604 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.363 -2.609 -9.942 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.705 -1.094 -10.811 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.480 -2.609 -11.718 1.00 0.00 H new ATOM 369 N SER A 28 1.493 0.642 -11.784 1.00 0.00 N ATOM 370 CA SER A 28 2.865 1.155 -11.652 1.00 0.00 C ATOM 371 C SER A 28 3.101 1.833 -10.295 1.00 0.00 C ATOM 372 O SER A 28 2.156 2.235 -9.615 1.00 0.00 O ATOM 373 CB SER A 28 3.157 2.127 -12.802 1.00 0.00 C ATOM 374 OG SER A 28 2.364 3.300 -12.684 1.00 0.00 O ATOM 0 H SER A 28 0.790 1.312 -11.473 1.00 0.00 H new ATOM 0 HA SER A 28 3.550 0.309 -11.704 1.00 0.00 H new ATOM 0 HB2 SER A 28 4.214 2.395 -12.798 1.00 0.00 H new ATOM 0 HB3 SER A 28 2.955 1.640 -13.756 1.00 0.00 H new ATOM 0 HG SER A 28 2.566 3.908 -13.426 1.00 0.00 H new ATOM 380 N GLU A 29 4.361 2.003 -9.886 1.00 0.00 N ATOM 381 CA GLU A 29 4.693 2.690 -8.627 1.00 0.00 C ATOM 382 C GLU A 29 4.183 4.148 -8.567 1.00 0.00 C ATOM 383 O GLU A 29 3.657 4.534 -7.520 1.00 0.00 O ATOM 384 CB GLU A 29 6.216 2.629 -8.385 1.00 0.00 C ATOM 385 CG GLU A 29 6.631 1.379 -7.598 1.00 0.00 C ATOM 386 CD GLU A 29 7.952 0.757 -8.094 1.00 0.00 C ATOM 387 OE1 GLU A 29 8.084 0.476 -9.311 1.00 0.00 O ATOM 388 OE2 GLU A 29 8.841 0.461 -7.263 1.00 0.00 O ATOM 0 H GLU A 29 5.173 1.674 -10.408 1.00 0.00 H new ATOM 0 HA GLU A 29 4.171 2.161 -7.829 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.735 2.641 -9.344 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.531 3.519 -7.841 1.00 0.00 H new ATOM 0 HG2 GLU A 29 6.733 1.639 -6.544 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.838 0.634 -7.668 1.00 0.00 H new ATOM 395 N PRO A 30 4.239 4.956 -9.651 1.00 0.00 N ATOM 396 CA PRO A 30 3.583 6.265 -9.694 1.00 0.00 C ATOM 397 C PRO A 30 2.055 6.203 -9.553 1.00 0.00 C ATOM 398 O PRO A 30 1.470 7.118 -8.967 1.00 0.00 O ATOM 399 CB PRO A 30 3.988 6.890 -11.033 1.00 0.00 C ATOM 400 CG PRO A 30 5.330 6.229 -11.333 1.00 0.00 C ATOM 401 CD PRO A 30 5.110 4.813 -10.810 1.00 0.00 C ATOM 0 HA PRO A 30 3.904 6.862 -8.840 1.00 0.00 H new ATOM 0 HB2 PRO A 30 3.254 6.684 -11.812 1.00 0.00 H new ATOM 0 HB3 PRO A 30 4.080 7.974 -10.960 1.00 0.00 H new ATOM 0 HG2 PRO A 30 5.561 6.239 -12.398 1.00 0.00 H new ATOM 0 HG3 PRO A 30 6.154 6.729 -10.824 1.00 0.00 H new ATOM 0 HD2 PRO A 30 4.651 4.181 -11.570 1.00 0.00 H new ATOM 0 HD3 PRO A 30 6.055 4.345 -10.535 1.00 0.00 H new ATOM 409 N LEU A 31 1.397 5.131 -10.022 1.00 0.00 N ATOM 410 CA LEU A 31 -0.042 4.942 -9.806 1.00 0.00 C ATOM 411 C LEU A 31 -0.317 4.702 -8.323 1.00 0.00 C ATOM 412 O LEU A 31 -1.142 5.394 -7.735 1.00 0.00 O ATOM 413 CB LEU A 31 -0.577 3.772 -10.652 1.00 0.00 C ATOM 414 CG LEU A 31 -2.098 3.563 -10.515 1.00 0.00 C ATOM 415 CD1 LEU A 31 -2.868 4.658 -11.242 1.00 0.00 C ATOM 416 CD2 LEU A 31 -2.469 2.216 -11.128 1.00 0.00 C ATOM 0 H LEU A 31 1.841 4.382 -10.554 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.562 5.847 -10.121 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.335 3.951 -11.700 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -0.064 2.856 -10.358 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.358 3.594 -9.457 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.938 4.486 -11.129 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -2.609 5.628 -10.817 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.608 4.644 -12.300 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.544 2.058 -11.036 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.189 2.206 -12.181 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.939 1.420 -10.605 1.00 0.00 H new ATOM 428 N LEU A 32 0.410 3.765 -7.706 1.00 0.00 N ATOM 429 CA LEU A 32 0.262 3.462 -6.281 1.00 0.00 C ATOM 430 C LEU A 32 0.581 4.653 -5.378 1.00 0.00 C ATOM 431 O LEU A 32 0.106 4.709 -4.251 1.00 0.00 O ATOM 432 CB LEU A 32 1.166 2.290 -5.879 1.00 0.00 C ATOM 433 CG LEU A 32 0.890 0.960 -6.580 1.00 0.00 C ATOM 434 CD1 LEU A 32 1.623 -0.141 -5.826 1.00 0.00 C ATOM 435 CD2 LEU A 32 -0.593 0.611 -6.589 1.00 0.00 C ATOM 0 H LEU A 32 1.114 3.198 -8.179 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.787 3.203 -6.141 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.201 2.572 -6.073 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.073 2.137 -4.804 1.00 0.00 H new ATOM 0 HG LEU A 32 1.229 1.049 -7.612 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.438 -1.099 -6.311 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.693 0.067 -5.828 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.263 -0.180 -4.798 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.739 -0.342 -7.098 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.955 0.534 -5.564 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.147 1.390 -7.112 1.00 0.00 H new ATOM 447 N TRP A 33 1.358 5.615 -5.863 1.00 0.00 N ATOM 448 CA TRP A 33 1.584 6.880 -5.175 1.00 0.00 C ATOM 449 C TRP A 33 0.351 7.782 -5.274 1.00 0.00 C ATOM 450 O TRP A 33 -0.323 8.038 -4.277 1.00 0.00 O ATOM 451 CB TRP A 33 2.849 7.534 -5.737 1.00 0.00 C ATOM 452 CG TRP A 33 3.486 8.607 -4.915 1.00 0.00 C ATOM 453 CD1 TRP A 33 2.881 9.632 -4.270 1.00 0.00 C ATOM 454 CD2 TRP A 33 4.911 8.772 -4.671 1.00 0.00 C ATOM 455 NE1 TRP A 33 3.837 10.405 -3.633 1.00 0.00 N ATOM 456 CE2 TRP A 33 5.110 9.930 -3.865 1.00 0.00 C ATOM 457 CE3 TRP A 33 6.051 8.050 -5.072 1.00 0.00 C ATOM 458 CZ2 TRP A 33 6.389 10.358 -3.482 1.00 0.00 C ATOM 459 CZ3 TRP A 33 7.342 8.472 -4.701 1.00 0.00 C ATOM 460 CH2 TRP A 33 7.511 9.626 -3.912 1.00 0.00 C ATOM 0 H TRP A 33 1.853 5.538 -6.752 1.00 0.00 H new ATOM 0 HA TRP A 33 1.742 6.705 -4.111 1.00 0.00 H new ATOM 0 HB2 TRP A 33 3.589 6.751 -5.902 1.00 0.00 H new ATOM 0 HB3 TRP A 33 2.607 7.955 -6.713 1.00 0.00 H new ATOM 0 HD1 TRP A 33 1.817 9.818 -4.255 1.00 0.00 H new ATOM 0 HE1 TRP A 33 3.626 11.224 -3.063 1.00 0.00 H new ATOM 0 HE3 TRP A 33 5.934 7.160 -5.673 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 6.511 11.237 -2.866 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 8.206 7.909 -5.023 1.00 0.00 H new ATOM 0 HH2 TRP A 33 8.504 9.950 -3.636 1.00 0.00 H new ATOM 471 N GLU A 34 0.026 8.243 -6.482 1.00 0.00 N ATOM 472 CA GLU A 34 -1.032 9.241 -6.716 1.00 0.00 C ATOM 473 C GLU A 34 -2.444 8.754 -6.354 1.00 0.00 C ATOM 474 O GLU A 34 -3.273 9.549 -5.909 1.00 0.00 O ATOM 475 CB GLU A 34 -1.000 9.704 -8.180 1.00 0.00 C ATOM 476 CG GLU A 34 0.288 10.470 -8.497 1.00 0.00 C ATOM 477 CD GLU A 34 0.196 11.176 -9.863 1.00 0.00 C ATOM 478 OE1 GLU A 34 -0.211 12.365 -9.908 1.00 0.00 O ATOM 479 OE2 GLU A 34 0.533 10.560 -10.903 1.00 0.00 O ATOM 0 H GLU A 34 0.490 7.935 -7.336 1.00 0.00 H new ATOM 0 HA GLU A 34 -0.816 10.073 -6.045 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -1.082 8.839 -8.838 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.862 10.340 -8.381 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.477 11.207 -7.716 1.00 0.00 H new ATOM 0 HG3 GLU A 34 1.133 9.781 -8.497 1.00 0.00 H new ATOM 486 N LEU A 35 -2.715 7.452 -6.484 1.00 0.00 N ATOM 487 CA LEU A 35 -3.991 6.843 -6.091 1.00 0.00 C ATOM 488 C LEU A 35 -4.184 6.834 -4.562 1.00 0.00 C ATOM 489 O LEU A 35 -5.310 6.943 -4.080 1.00 0.00 O ATOM 490 CB LEU A 35 -4.053 5.409 -6.655 1.00 0.00 C ATOM 491 CG LEU A 35 -5.471 4.828 -6.742 1.00 0.00 C ATOM 492 CD1 LEU A 35 -6.223 5.341 -7.970 1.00 0.00 C ATOM 493 CD2 LEU A 35 -5.411 3.304 -6.785 1.00 0.00 C ATOM 0 H LEU A 35 -2.048 6.783 -6.869 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.802 7.443 -6.504 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -3.608 5.402 -7.650 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -3.443 4.758 -6.029 1.00 0.00 H new ATOM 0 HG LEU A 35 -6.011 5.154 -5.853 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.222 4.905 -7.993 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.302 6.427 -7.921 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.682 5.057 -8.873 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.422 2.902 -6.847 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.840 2.987 -7.658 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -4.928 2.933 -5.881 1.00 0.00 H new ATOM 505 N PHE A 36 -3.097 6.719 -3.793 1.00 0.00 N ATOM 506 CA PHE A 36 -3.104 6.591 -2.331 1.00 0.00 C ATOM 507 C PHE A 36 -2.982 7.937 -1.598 1.00 0.00 C ATOM 508 O PHE A 36 -3.264 8.001 -0.400 1.00 0.00 O ATOM 509 CB PHE A 36 -2.013 5.598 -1.917 1.00 0.00 C ATOM 510 CG PHE A 36 -2.409 4.131 -2.030 1.00 0.00 C ATOM 511 CD1 PHE A 36 -2.607 3.365 -0.865 1.00 0.00 C ATOM 512 CD2 PHE A 36 -2.574 3.518 -3.287 1.00 0.00 C ATOM 513 CE1 PHE A 36 -2.993 2.014 -0.954 1.00 0.00 C ATOM 514 CE2 PHE A 36 -2.947 2.165 -3.381 1.00 0.00 C ATOM 515 CZ PHE A 36 -3.175 1.418 -2.214 1.00 0.00 C ATOM 0 H PHE A 36 -2.155 6.712 -4.184 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.077 6.206 -2.026 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -1.131 5.770 -2.534 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -1.726 5.804 -0.886 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -2.462 3.818 0.105 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -2.413 4.092 -4.187 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -3.149 1.436 -0.055 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.058 1.701 -4.350 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.490 0.387 -2.284 1.00 0.00 H new ATOM 525 N LEU A 37 -2.672 9.032 -2.308 1.00 0.00 N ATOM 526 CA LEU A 37 -2.743 10.409 -1.788 1.00 0.00 C ATOM 527 C LEU A 37 -4.128 10.791 -1.217 1.00 0.00 C ATOM 528 O LEU A 37 -4.246 11.736 -0.435 1.00 0.00 O ATOM 529 CB LEU A 37 -2.341 11.391 -2.905 1.00 0.00 C ATOM 530 CG LEU A 37 -0.845 11.420 -3.261 1.00 0.00 C ATOM 531 CD1 LEU A 37 -0.599 12.439 -4.373 1.00 0.00 C ATOM 532 CD2 LEU A 37 0.020 11.814 -2.065 1.00 0.00 C ATOM 0 H LEU A 37 -2.359 8.986 -3.278 1.00 0.00 H new ATOM 0 HA LEU A 37 -2.049 10.468 -0.950 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.905 11.141 -3.804 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.644 12.395 -2.608 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.572 10.414 -3.579 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.462 12.457 -4.622 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.175 12.160 -5.256 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.909 13.428 -4.035 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.069 11.822 -2.361 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.267 12.807 -1.720 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.124 11.094 -1.259 1.00 0.00 H new ATOM 544 N GLN A 38 -5.169 10.034 -1.573 1.00 0.00 N ATOM 545 CA GLN A 38 -6.529 10.138 -1.020 1.00 0.00 C ATOM 546 C GLN A 38 -6.591 9.790 0.477 1.00 0.00 C ATOM 547 O GLN A 38 -7.394 10.368 1.212 1.00 0.00 O ATOM 548 CB GLN A 38 -7.479 9.195 -1.782 1.00 0.00 C ATOM 549 CG GLN A 38 -7.446 9.425 -3.296 1.00 0.00 C ATOM 550 CD GLN A 38 -8.476 8.567 -4.026 1.00 0.00 C ATOM 551 OE1 GLN A 38 -9.630 8.938 -4.202 1.00 0.00 O ATOM 552 NE2 GLN A 38 -8.105 7.385 -4.468 1.00 0.00 N ATOM 0 H GLN A 38 -5.089 9.304 -2.280 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.834 11.178 -1.138 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -7.207 8.161 -1.569 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -8.496 9.338 -1.418 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -7.635 10.477 -3.507 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -6.450 9.198 -3.676 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -7.147 7.066 -4.327 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -8.776 6.788 -4.952 1.00 0.00 H new ATOM 561 N ALA A 39 -5.747 8.856 0.932 1.00 0.00 N ATOM 562 CA ALA A 39 -5.662 8.461 2.340 1.00 0.00 C ATOM 563 C ALA A 39 -4.850 9.455 3.186 1.00 0.00 C ATOM 564 O ALA A 39 -5.275 9.849 4.273 1.00 0.00 O ATOM 565 CB ALA A 39 -5.046 7.064 2.420 1.00 0.00 C ATOM 0 H ALA A 39 -5.100 8.350 0.327 1.00 0.00 H new ATOM 0 HA ALA A 39 -6.670 8.458 2.754 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.976 6.756 3.463 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.673 6.358 1.875 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.049 7.080 1.979 1.00 0.00 H new ATOM 571 N GLY A 40 -3.688 9.868 2.675 1.00 0.00 N ATOM 572 CA GLY A 40 -2.785 10.810 3.336 1.00 0.00 C ATOM 573 C GLY A 40 -1.519 11.105 2.519 1.00 0.00 C ATOM 574 O GLY A 40 -1.419 10.684 1.365 1.00 0.00 O ATOM 0 H GLY A 40 -3.342 9.549 1.770 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.316 11.744 3.522 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.498 10.408 4.308 1.00 0.00 H new ATOM 578 N PRO A 41 -0.536 11.819 3.094 1.00 0.00 N ATOM 579 CA PRO A 41 0.711 12.172 2.419 1.00 0.00 C ATOM 580 C PRO A 41 1.580 10.931 2.159 1.00 0.00 C ATOM 581 O PRO A 41 2.180 10.361 3.076 1.00 0.00 O ATOM 582 CB PRO A 41 1.390 13.199 3.335 1.00 0.00 C ATOM 583 CG PRO A 41 0.848 12.852 4.721 1.00 0.00 C ATOM 584 CD PRO A 41 -0.576 12.385 4.431 1.00 0.00 C ATOM 0 HA PRO A 41 0.539 12.594 1.429 1.00 0.00 H new ATOM 0 HB2 PRO A 41 2.476 13.116 3.296 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.138 14.220 3.049 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.438 12.071 5.200 1.00 0.00 H new ATOM 0 HG3 PRO A 41 0.861 13.715 5.386 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -0.902 11.644 5.161 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -1.280 13.216 4.484 1.00 0.00 H new ATOM 592 N VAL A 42 1.658 10.529 0.888 1.00 0.00 N ATOM 593 CA VAL A 42 2.549 9.467 0.399 1.00 0.00 C ATOM 594 C VAL A 42 3.947 10.041 0.156 1.00 0.00 C ATOM 595 O VAL A 42 4.106 11.103 -0.452 1.00 0.00 O ATOM 596 CB VAL A 42 2.006 8.786 -0.871 1.00 0.00 C ATOM 597 CG1 VAL A 42 2.957 7.687 -1.359 1.00 0.00 C ATOM 598 CG2 VAL A 42 0.631 8.148 -0.637 1.00 0.00 C ATOM 0 H VAL A 42 1.089 10.942 0.149 1.00 0.00 H new ATOM 0 HA VAL A 42 2.603 8.695 1.166 1.00 0.00 H new ATOM 0 HB VAL A 42 1.919 9.572 -1.621 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.548 7.224 -2.257 1.00 0.00 H new ATOM 0 HG12 VAL A 42 3.930 8.122 -1.587 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.070 6.932 -0.581 1.00 0.00 H new ATOM 0 HG21 VAL A 42 0.286 7.679 -1.559 1.00 0.00 H new ATOM 0 HG22 VAL A 42 0.708 7.394 0.147 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -0.080 8.916 -0.333 1.00 0.00 H new ATOM 608 N VAL A 43 4.958 9.320 0.637 1.00 0.00 N ATOM 609 CA VAL A 43 6.371 9.728 0.687 1.00 0.00 C ATOM 610 C VAL A 43 7.224 8.943 -0.317 1.00 0.00 C ATOM 611 O VAL A 43 8.205 9.471 -0.841 1.00 0.00 O ATOM 612 CB VAL A 43 6.916 9.517 2.118 1.00 0.00 C ATOM 613 CG1 VAL A 43 8.269 10.200 2.343 1.00 0.00 C ATOM 614 CG2 VAL A 43 5.968 10.066 3.189 1.00 0.00 C ATOM 0 H VAL A 43 4.812 8.387 1.023 1.00 0.00 H new ATOM 0 HA VAL A 43 6.430 10.782 0.417 1.00 0.00 H new ATOM 0 HB VAL A 43 7.018 8.436 2.210 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.603 10.018 3.365 1.00 0.00 H new ATOM 0 HG12 VAL A 43 9.001 9.795 1.644 1.00 0.00 H new ATOM 0 HG13 VAL A 43 8.166 11.273 2.180 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.396 9.893 4.177 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.827 11.136 3.036 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.005 9.560 3.117 1.00 0.00 H new ATOM 624 N ASN A 44 6.869 7.675 -0.558 1.00 0.00 N ATOM 625 CA ASN A 44 7.597 6.719 -1.398 1.00 0.00 C ATOM 626 C ASN A 44 6.682 5.536 -1.812 1.00 0.00 C ATOM 627 O ASN A 44 5.673 5.263 -1.157 1.00 0.00 O ATOM 628 CB ASN A 44 8.838 6.287 -0.584 1.00 0.00 C ATOM 629 CG ASN A 44 9.652 5.159 -1.185 1.00 0.00 C ATOM 630 OD1 ASN A 44 9.981 5.159 -2.362 1.00 0.00 O ATOM 631 ND2 ASN A 44 10.010 4.176 -0.390 1.00 0.00 N ATOM 0 H ASN A 44 6.026 7.269 -0.153 1.00 0.00 H new ATOM 0 HA ASN A 44 7.918 7.161 -2.341 1.00 0.00 H new ATOM 0 HB2 ASN A 44 9.488 7.153 -0.458 1.00 0.00 H new ATOM 0 HB3 ASN A 44 8.511 5.986 0.411 1.00 0.00 H new ATOM 0 HD21 ASN A 44 10.568 3.403 -0.754 1.00 0.00 H new ATOM 0 HD22 ASN A 44 9.730 4.186 0.591 1.00 0.00 H new ATOM 638 N THR A 45 7.046 4.798 -2.864 1.00 0.00 N ATOM 639 CA THR A 45 6.399 3.541 -3.303 1.00 0.00 C ATOM 640 C THR A 45 7.428 2.475 -3.688 1.00 0.00 C ATOM 641 O THR A 45 8.553 2.793 -4.082 1.00 0.00 O ATOM 642 CB THR A 45 5.444 3.740 -4.495 1.00 0.00 C ATOM 643 OG1 THR A 45 5.952 4.625 -5.465 1.00 0.00 O ATOM 644 CG2 THR A 45 4.083 4.259 -4.065 1.00 0.00 C ATOM 0 H THR A 45 7.829 5.063 -3.462 1.00 0.00 H new ATOM 0 HA THR A 45 5.821 3.208 -2.441 1.00 0.00 H new ATOM 0 HB THR A 45 5.344 2.746 -4.930 1.00 0.00 H new ATOM 0 HG1 THR A 45 5.322 4.688 -6.213 1.00 0.00 H new ATOM 0 HG21 THR A 45 3.447 4.382 -4.942 1.00 0.00 H new ATOM 0 HG22 THR A 45 3.622 3.548 -3.380 1.00 0.00 H new ATOM 0 HG23 THR A 45 4.202 5.220 -3.565 1.00 0.00 H new ATOM 652 N HIS A 46 7.048 1.195 -3.581 1.00 0.00 N ATOM 653 CA HIS A 46 7.898 0.059 -3.957 1.00 0.00 C ATOM 654 C HIS A 46 7.077 -1.059 -4.608 1.00 0.00 C ATOM 655 O HIS A 46 6.053 -1.456 -4.064 1.00 0.00 O ATOM 656 CB HIS A 46 8.622 -0.463 -2.703 1.00 0.00 C ATOM 657 CG HIS A 46 9.727 -1.439 -3.018 1.00 0.00 C ATOM 658 ND1 HIS A 46 9.808 -2.748 -2.537 1.00 0.00 N ATOM 659 CD2 HIS A 46 10.807 -1.191 -3.813 1.00 0.00 C ATOM 660 CE1 HIS A 46 10.936 -3.261 -3.060 1.00 0.00 C ATOM 661 NE2 HIS A 46 11.554 -2.348 -3.828 1.00 0.00 N ATOM 0 H HIS A 46 6.133 0.917 -3.227 1.00 0.00 H new ATOM 0 HA HIS A 46 8.631 0.394 -4.691 1.00 0.00 H new ATOM 0 HB2 HIS A 46 9.038 0.382 -2.153 1.00 0.00 H new ATOM 0 HB3 HIS A 46 7.897 -0.944 -2.047 1.00 0.00 H new ATOM 0 HD2 HIS A 46 11.032 -0.269 -4.329 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.294 -4.265 -2.887 1.00 0.00 H new ATOM 0 HE2 HIS A 46 12.428 -2.488 -4.336 1.00 0.00 H new ATOM 669 N MET A 47 7.516 -1.602 -5.742 1.00 0.00 N ATOM 670 CA MET A 47 6.925 -2.796 -6.370 1.00 0.00 C ATOM 671 C MET A 47 8.043 -3.756 -6.799 1.00 0.00 C ATOM 672 O MET A 47 8.707 -3.483 -7.803 1.00 0.00 O ATOM 673 CB MET A 47 6.038 -2.405 -7.565 1.00 0.00 C ATOM 674 CG MET A 47 4.703 -1.800 -7.114 1.00 0.00 C ATOM 675 SD MET A 47 3.692 -1.066 -8.427 1.00 0.00 S ATOM 676 CE MET A 47 3.348 -2.537 -9.408 1.00 0.00 C ATOM 0 H MET A 47 8.306 -1.223 -6.264 1.00 0.00 H new ATOM 0 HA MET A 47 6.288 -3.302 -5.645 1.00 0.00 H new ATOM 0 HB2 MET A 47 6.568 -1.687 -8.191 1.00 0.00 H new ATOM 0 HB3 MET A 47 5.848 -3.285 -8.179 1.00 0.00 H new ATOM 0 HG2 MET A 47 4.119 -2.579 -6.623 1.00 0.00 H new ATOM 0 HG3 MET A 47 4.906 -1.034 -6.365 1.00 0.00 H new ATOM 0 HE1 MET A 47 2.567 -2.315 -10.135 1.00 0.00 H new ATOM 0 HE2 MET A 47 4.253 -2.845 -9.931 1.00 0.00 H new ATOM 0 HE3 MET A 47 3.016 -3.342 -8.753 1.00 0.00 H new ATOM 686 N PRO A 48 8.279 -4.864 -6.069 1.00 0.00 N ATOM 687 CA PRO A 48 9.329 -5.832 -6.393 1.00 0.00 C ATOM 688 C PRO A 48 9.227 -6.395 -7.818 1.00 0.00 C ATOM 689 O PRO A 48 8.163 -6.852 -8.252 1.00 0.00 O ATOM 690 CB PRO A 48 9.226 -6.924 -5.325 1.00 0.00 C ATOM 691 CG PRO A 48 8.705 -6.145 -4.119 1.00 0.00 C ATOM 692 CD PRO A 48 7.721 -5.165 -4.756 1.00 0.00 C ATOM 0 HA PRO A 48 10.307 -5.350 -6.383 1.00 0.00 H new ATOM 0 HB2 PRO A 48 8.544 -7.721 -5.621 1.00 0.00 H new ATOM 0 HB3 PRO A 48 10.191 -7.389 -5.124 1.00 0.00 H new ATOM 0 HG2 PRO A 48 8.216 -6.797 -3.395 1.00 0.00 H new ATOM 0 HG3 PRO A 48 9.508 -5.629 -3.592 1.00 0.00 H new ATOM 0 HD2 PRO A 48 6.727 -5.604 -4.842 1.00 0.00 H new ATOM 0 HD3 PRO A 48 7.620 -4.262 -4.155 1.00 0.00 H new ATOM 700 N LYS A 49 10.350 -6.354 -8.546 1.00 0.00 N ATOM 701 CA LYS A 49 10.461 -6.784 -9.950 1.00 0.00 C ATOM 702 C LYS A 49 10.935 -8.234 -10.074 1.00 0.00 C ATOM 703 O LYS A 49 11.696 -8.739 -9.247 1.00 0.00 O ATOM 704 CB LYS A 49 11.363 -5.830 -10.758 1.00 0.00 C ATOM 705 CG LYS A 49 10.979 -4.339 -10.695 1.00 0.00 C ATOM 706 CD LYS A 49 9.526 -4.048 -11.112 1.00 0.00 C ATOM 707 CE LYS A 49 9.217 -2.545 -11.211 1.00 0.00 C ATOM 708 NZ LYS A 49 9.476 -1.826 -9.937 1.00 0.00 N ATOM 0 H LYS A 49 11.232 -6.012 -8.166 1.00 0.00 H new ATOM 0 HA LYS A 49 9.459 -6.739 -10.376 1.00 0.00 H new ATOM 0 HB2 LYS A 49 12.387 -5.938 -10.402 1.00 0.00 H new ATOM 0 HB3 LYS A 49 11.353 -6.146 -11.801 1.00 0.00 H new ATOM 0 HG2 LYS A 49 11.134 -3.977 -9.678 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.651 -3.774 -11.340 1.00 0.00 H new ATOM 0 HD2 LYS A 49 9.330 -4.518 -12.076 1.00 0.00 H new ATOM 0 HD3 LYS A 49 8.849 -4.505 -10.391 1.00 0.00 H new ATOM 0 HE2 LYS A 49 9.823 -2.104 -12.003 1.00 0.00 H new ATOM 0 HE3 LYS A 49 8.173 -2.410 -11.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.877 -0.977 -9.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 9.256 -2.451 -9.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.477 -1.546 -9.894 1.00 0.00 H new ATOM 722 N ASP A 50 10.474 -8.897 -11.125 1.00 0.00 N ATOM 723 CA ASP A 50 10.699 -10.310 -11.412 1.00 0.00 C ATOM 724 C ASP A 50 12.070 -10.597 -12.057 1.00 0.00 C ATOM 725 O ASP A 50 12.581 -9.796 -12.843 1.00 0.00 O ATOM 726 CB ASP A 50 9.544 -10.790 -12.298 1.00 0.00 C ATOM 727 CG ASP A 50 9.660 -12.285 -12.565 1.00 0.00 C ATOM 728 OD1 ASP A 50 10.101 -12.633 -13.683 1.00 0.00 O ATOM 729 OD2 ASP A 50 9.399 -13.074 -11.627 1.00 0.00 O ATOM 0 H ASP A 50 9.904 -8.442 -11.838 1.00 0.00 H new ATOM 0 HA ASP A 50 10.721 -10.861 -10.472 1.00 0.00 H new ATOM 0 HB2 ASP A 50 8.592 -10.574 -11.813 1.00 0.00 H new ATOM 0 HB3 ASP A 50 9.551 -10.245 -13.242 1.00 0.00 H new ATOM 734 N ARG A 51 12.655 -11.767 -11.764 1.00 0.00 N ATOM 735 CA ARG A 51 14.001 -12.172 -12.221 1.00 0.00 C ATOM 736 C ARG A 51 14.056 -12.898 -13.579 1.00 0.00 C ATOM 737 O ARG A 51 15.126 -13.372 -13.965 1.00 0.00 O ATOM 738 CB ARG A 51 14.731 -12.923 -11.090 1.00 0.00 C ATOM 739 CG ARG A 51 14.131 -14.304 -10.775 1.00 0.00 C ATOM 740 CD ARG A 51 14.902 -15.025 -9.665 1.00 0.00 C ATOM 741 NE ARG A 51 14.749 -14.369 -8.349 1.00 0.00 N ATOM 742 CZ ARG A 51 15.303 -14.751 -7.211 1.00 0.00 C ATOM 743 NH1 ARG A 51 16.078 -15.797 -7.132 1.00 0.00 N ATOM 744 NH2 ARG A 51 15.086 -14.082 -6.114 1.00 0.00 N ATOM 0 H ARG A 51 12.199 -12.477 -11.190 1.00 0.00 H new ATOM 0 HA ARG A 51 14.541 -11.251 -12.439 1.00 0.00 H new ATOM 0 HB2 ARG A 51 15.778 -13.046 -11.365 1.00 0.00 H new ATOM 0 HB3 ARG A 51 14.708 -12.313 -10.187 1.00 0.00 H new ATOM 0 HG2 ARG A 51 13.089 -14.187 -10.476 1.00 0.00 H new ATOM 0 HG3 ARG A 51 14.137 -14.916 -11.677 1.00 0.00 H new ATOM 0 HD2 ARG A 51 14.554 -16.056 -9.596 1.00 0.00 H new ATOM 0 HD3 ARG A 51 15.959 -15.063 -9.927 1.00 0.00 H new ATOM 0 HE ARG A 51 14.157 -13.539 -8.316 1.00 0.00 H new ATOM 0 HH11 ARG A 51 16.274 -16.351 -7.966 1.00 0.00 H new ATOM 0 HH12 ARG A 51 16.488 -16.061 -6.236 1.00 0.00 H new ATOM 0 HH21 ARG A 51 14.485 -13.258 -6.130 1.00 0.00 H new ATOM 0 HH22 ARG A 51 15.517 -14.383 -5.240 1.00 0.00 H new ATOM 758 N VAL A 52 12.934 -12.998 -14.302 1.00 0.00 N ATOM 759 CA VAL A 52 12.808 -13.746 -15.574 1.00 0.00 C ATOM 760 C VAL A 52 12.121 -12.899 -16.651 1.00 0.00 C ATOM 761 O VAL A 52 12.526 -12.927 -17.814 1.00 0.00 O ATOM 762 CB VAL A 52 12.031 -15.068 -15.367 1.00 0.00 C ATOM 763 CG1 VAL A 52 12.030 -15.930 -16.637 1.00 0.00 C ATOM 764 CG2 VAL A 52 12.622 -15.925 -14.238 1.00 0.00 C ATOM 0 H VAL A 52 12.062 -12.552 -14.017 1.00 0.00 H new ATOM 0 HA VAL A 52 13.817 -13.983 -15.912 1.00 0.00 H new ATOM 0 HB VAL A 52 11.017 -14.764 -15.108 1.00 0.00 H new ATOM 0 HG11 VAL A 52 11.475 -16.850 -16.452 1.00 0.00 H new ATOM 0 HG12 VAL A 52 11.558 -15.379 -17.451 1.00 0.00 H new ATOM 0 HG13 VAL A 52 13.056 -16.175 -16.911 1.00 0.00 H new ATOM 0 HG21 VAL A 52 12.040 -16.841 -14.134 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.656 -16.177 -14.475 1.00 0.00 H new ATOM 0 HG23 VAL A 52 12.590 -15.367 -13.302 1.00 0.00 H new ATOM 774 N THR A 53 11.110 -12.115 -16.265 1.00 0.00 N ATOM 775 CA THR A 53 10.284 -11.282 -17.155 1.00 0.00 C ATOM 776 C THR A 53 10.487 -9.786 -16.919 1.00 0.00 C ATOM 777 O THR A 53 10.183 -8.971 -17.791 1.00 0.00 O ATOM 778 CB THR A 53 8.789 -11.605 -16.993 1.00 0.00 C ATOM 779 OG1 THR A 53 8.356 -11.303 -15.683 1.00 0.00 O ATOM 780 CG2 THR A 53 8.455 -13.069 -17.280 1.00 0.00 C ATOM 0 H THR A 53 10.831 -12.038 -15.287 1.00 0.00 H new ATOM 0 HA THR A 53 10.610 -11.520 -18.167 1.00 0.00 H new ATOM 0 HB THR A 53 8.272 -10.987 -17.727 1.00 0.00 H new ATOM 0 HG1 THR A 53 8.889 -11.812 -15.037 1.00 0.00 H new ATOM 0 HG21 THR A 53 7.385 -13.231 -17.148 1.00 0.00 H new ATOM 0 HG22 THR A 53 8.735 -13.312 -18.305 1.00 0.00 H new ATOM 0 HG23 THR A 53 9.006 -13.710 -16.592 1.00 0.00 H new ATOM 788 N GLY A 54 10.996 -9.414 -15.739 1.00 0.00 N ATOM 789 CA GLY A 54 11.260 -8.033 -15.338 1.00 0.00 C ATOM 790 C GLY A 54 10.019 -7.191 -14.990 1.00 0.00 C ATOM 791 O GLY A 54 10.158 -6.019 -14.630 1.00 0.00 O ATOM 0 H GLY A 54 11.242 -10.090 -15.016 1.00 0.00 H new ATOM 0 HA2 GLY A 54 11.922 -8.046 -14.472 1.00 0.00 H new ATOM 0 HA3 GLY A 54 11.799 -7.536 -16.145 1.00 0.00 H new ATOM 795 N GLN A 55 8.816 -7.769 -15.065 1.00 0.00 N ATOM 796 CA GLN A 55 7.555 -7.151 -14.625 1.00 0.00 C ATOM 797 C GLN A 55 7.449 -7.143 -13.087 1.00 0.00 C ATOM 798 O GLN A 55 8.254 -7.777 -12.404 1.00 0.00 O ATOM 799 CB GLN A 55 6.370 -7.911 -15.256 1.00 0.00 C ATOM 800 CG GLN A 55 6.367 -7.911 -16.795 1.00 0.00 C ATOM 801 CD GLN A 55 6.274 -6.505 -17.389 1.00 0.00 C ATOM 802 OE1 GLN A 55 7.249 -5.922 -17.848 1.00 0.00 O ATOM 803 NE2 GLN A 55 5.107 -5.893 -17.391 1.00 0.00 N ATOM 0 H GLN A 55 8.686 -8.707 -15.444 1.00 0.00 H new ATOM 0 HA GLN A 55 7.532 -6.113 -14.956 1.00 0.00 H new ATOM 0 HB2 GLN A 55 6.386 -8.942 -14.904 1.00 0.00 H new ATOM 0 HB3 GLN A 55 5.439 -7.468 -14.902 1.00 0.00 H new ATOM 0 HG2 GLN A 55 7.276 -8.393 -17.155 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.527 -8.507 -17.152 1.00 0.00 H new ATOM 0 HE21 GLN A 55 4.284 -6.363 -17.013 1.00 0.00 H new ATOM 0 HE22 GLN A 55 5.026 -4.950 -17.771 1.00 0.00 H new ATOM 812 N HIS A 56 6.457 -6.458 -12.507 1.00 0.00 N ATOM 813 CA HIS A 56 6.174 -6.594 -11.068 1.00 0.00 C ATOM 814 C HIS A 56 5.572 -7.974 -10.740 1.00 0.00 C ATOM 815 O HIS A 56 4.910 -8.591 -11.580 1.00 0.00 O ATOM 816 CB HIS A 56 5.312 -5.430 -10.557 1.00 0.00 C ATOM 817 CG HIS A 56 3.856 -5.487 -10.954 1.00 0.00 C ATOM 818 ND1 HIS A 56 2.892 -6.287 -10.337 1.00 0.00 N ATOM 819 CD2 HIS A 56 3.249 -4.719 -11.907 1.00 0.00 C ATOM 820 CE1 HIS A 56 1.730 -5.995 -10.942 1.00 0.00 C ATOM 821 NE2 HIS A 56 1.912 -5.049 -11.875 1.00 0.00 N ATOM 0 H HIS A 56 5.842 -5.811 -13.001 1.00 0.00 H new ATOM 0 HA HIS A 56 7.121 -6.537 -10.530 1.00 0.00 H new ATOM 0 HB2 HIS A 56 5.375 -5.402 -9.469 1.00 0.00 H new ATOM 0 HB3 HIS A 56 5.736 -4.496 -10.925 1.00 0.00 H new ATOM 0 HD2 HIS A 56 3.723 -3.997 -12.556 1.00 0.00 H new ATOM 0 HE1 HIS A 56 0.782 -6.457 -10.710 1.00 0.00 H new ATOM 0 HE2 HIS A 56 1.183 -4.642 -12.462 1.00 0.00 H new ATOM 829 N GLN A 57 5.796 -8.471 -9.519 1.00 0.00 N ATOM 830 CA GLN A 57 5.380 -9.821 -9.091 1.00 0.00 C ATOM 831 C GLN A 57 3.947 -9.897 -8.509 1.00 0.00 C ATOM 832 O GLN A 57 3.633 -10.793 -7.723 1.00 0.00 O ATOM 833 CB GLN A 57 6.464 -10.444 -8.188 1.00 0.00 C ATOM 834 CG GLN A 57 7.741 -10.771 -8.984 1.00 0.00 C ATOM 835 CD GLN A 57 8.742 -11.608 -8.185 1.00 0.00 C ATOM 836 OE1 GLN A 57 8.946 -11.427 -6.990 1.00 0.00 O ATOM 837 NE2 GLN A 57 9.408 -12.562 -8.803 1.00 0.00 N ATOM 0 H GLN A 57 6.276 -7.946 -8.788 1.00 0.00 H new ATOM 0 HA GLN A 57 5.301 -10.437 -9.987 1.00 0.00 H new ATOM 0 HB2 GLN A 57 6.705 -9.755 -7.378 1.00 0.00 H new ATOM 0 HB3 GLN A 57 6.078 -11.354 -7.728 1.00 0.00 H new ATOM 0 HG2 GLN A 57 7.469 -11.308 -9.893 1.00 0.00 H new ATOM 0 HG3 GLN A 57 8.218 -9.841 -9.294 1.00 0.00 H new ATOM 0 HE21 GLN A 57 9.254 -12.730 -9.797 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.078 -13.133 -8.287 1.00 0.00 H new ATOM 846 N GLY A 58 3.055 -8.975 -8.891 1.00 0.00 N ATOM 847 CA GLY A 58 1.635 -8.968 -8.501 1.00 0.00 C ATOM 848 C GLY A 58 1.327 -8.290 -7.159 1.00 0.00 C ATOM 849 O GLY A 58 0.174 -8.306 -6.718 1.00 0.00 O ATOM 0 H GLY A 58 3.305 -8.192 -9.495 1.00 0.00 H new ATOM 0 HA2 GLY A 58 1.063 -8.467 -9.282 1.00 0.00 H new ATOM 0 HA3 GLY A 58 1.282 -9.998 -8.458 1.00 0.00 H new ATOM 853 N TYR A 59 2.324 -7.683 -6.510 1.00 0.00 N ATOM 854 CA TYR A 59 2.170 -6.936 -5.258 1.00 0.00 C ATOM 855 C TYR A 59 3.099 -5.712 -5.187 1.00 0.00 C ATOM 856 O TYR A 59 4.085 -5.606 -5.922 1.00 0.00 O ATOM 857 CB TYR A 59 2.377 -7.867 -4.054 1.00 0.00 C ATOM 858 CG TYR A 59 3.801 -8.352 -3.854 1.00 0.00 C ATOM 859 CD1 TYR A 59 4.273 -9.466 -4.574 1.00 0.00 C ATOM 860 CD2 TYR A 59 4.648 -7.697 -2.939 1.00 0.00 C ATOM 861 CE1 TYR A 59 5.594 -9.920 -4.394 1.00 0.00 C ATOM 862 CE2 TYR A 59 5.957 -8.170 -2.729 1.00 0.00 C ATOM 863 CZ TYR A 59 6.440 -9.274 -3.465 1.00 0.00 C ATOM 864 OH TYR A 59 7.714 -9.712 -3.271 1.00 0.00 O ATOM 0 H TYR A 59 3.286 -7.698 -6.849 1.00 0.00 H new ATOM 0 HA TYR A 59 1.151 -6.550 -5.229 1.00 0.00 H new ATOM 0 HB2 TYR A 59 2.057 -7.346 -3.152 1.00 0.00 H new ATOM 0 HB3 TYR A 59 1.727 -8.734 -4.169 1.00 0.00 H new ATOM 0 HD1 TYR A 59 3.619 -9.975 -5.267 1.00 0.00 H new ATOM 0 HD2 TYR A 59 4.293 -6.832 -2.399 1.00 0.00 H new ATOM 0 HE1 TYR A 59 5.960 -10.761 -4.965 1.00 0.00 H new ATOM 0 HE2 TYR A 59 6.594 -7.687 -2.003 1.00 0.00 H new ATOM 0 HH TYR A 59 8.154 -9.152 -2.598 1.00 0.00 H new ATOM 874 N GLY A 60 2.763 -4.779 -4.297 1.00 0.00 N ATOM 875 CA GLY A 60 3.461 -3.514 -4.088 1.00 0.00 C ATOM 876 C GLY A 60 3.318 -2.977 -2.663 1.00 0.00 C ATOM 877 O GLY A 60 2.694 -3.598 -1.801 1.00 0.00 O ATOM 0 H GLY A 60 1.962 -4.890 -3.676 1.00 0.00 H new ATOM 0 HA2 GLY A 60 4.519 -3.648 -4.315 1.00 0.00 H new ATOM 0 HA3 GLY A 60 3.076 -2.774 -4.789 1.00 0.00 H new ATOM 881 N PHE A 61 3.888 -1.797 -2.431 1.00 0.00 N ATOM 882 CA PHE A 61 3.910 -1.089 -1.157 1.00 0.00 C ATOM 883 C PHE A 61 3.761 0.427 -1.347 1.00 0.00 C ATOM 884 O PHE A 61 4.262 0.986 -2.329 1.00 0.00 O ATOM 885 CB PHE A 61 5.231 -1.352 -0.421 1.00 0.00 C ATOM 886 CG PHE A 61 5.590 -2.794 -0.123 1.00 0.00 C ATOM 887 CD1 PHE A 61 6.416 -3.517 -1.005 1.00 0.00 C ATOM 888 CD2 PHE A 61 5.154 -3.394 1.074 1.00 0.00 C ATOM 889 CE1 PHE A 61 6.810 -4.829 -0.689 1.00 0.00 C ATOM 890 CE2 PHE A 61 5.551 -4.706 1.391 1.00 0.00 C ATOM 891 CZ PHE A 61 6.378 -5.424 0.509 1.00 0.00 C ATOM 0 H PHE A 61 4.372 -1.283 -3.167 1.00 0.00 H new ATOM 0 HA PHE A 61 3.068 -1.461 -0.574 1.00 0.00 H new ATOM 0 HB2 PHE A 61 6.038 -0.920 -1.013 1.00 0.00 H new ATOM 0 HB3 PHE A 61 5.203 -0.810 0.524 1.00 0.00 H new ATOM 0 HD1 PHE A 61 6.748 -3.062 -1.927 1.00 0.00 H new ATOM 0 HD2 PHE A 61 4.514 -2.846 1.750 1.00 0.00 H new ATOM 0 HE1 PHE A 61 7.445 -5.380 -1.367 1.00 0.00 H new ATOM 0 HE2 PHE A 61 5.220 -5.162 2.312 1.00 0.00 H new ATOM 0 HZ PHE A 61 6.681 -6.432 0.752 1.00 0.00 H new ATOM 901 N VAL A 62 3.148 1.101 -0.368 1.00 0.00 N ATOM 902 CA VAL A 62 2.998 2.569 -0.332 1.00 0.00 C ATOM 903 C VAL A 62 3.390 3.106 1.043 1.00 0.00 C ATOM 904 O VAL A 62 2.830 2.692 2.056 1.00 0.00 O ATOM 905 CB VAL A 62 1.565 3.014 -0.696 1.00 0.00 C ATOM 906 CG1 VAL A 62 1.524 4.528 -0.902 1.00 0.00 C ATOM 907 CG2 VAL A 62 1.046 2.329 -1.964 1.00 0.00 C ATOM 0 H VAL A 62 2.732 0.637 0.440 1.00 0.00 H new ATOM 0 HA VAL A 62 3.668 2.986 -1.084 1.00 0.00 H new ATOM 0 HB VAL A 62 0.922 2.722 0.135 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.509 4.833 -1.158 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.832 5.029 0.016 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.201 4.804 -1.711 1.00 0.00 H new ATOM 0 HG21 VAL A 62 0.035 2.676 -2.177 1.00 0.00 H new ATOM 0 HG22 VAL A 62 1.698 2.574 -2.803 1.00 0.00 H new ATOM 0 HG23 VAL A 62 1.036 1.249 -1.816 1.00 0.00 H new ATOM 917 N GLU A 63 4.364 4.012 1.088 1.00 0.00 N ATOM 918 CA GLU A 63 4.943 4.567 2.316 1.00 0.00 C ATOM 919 C GLU A 63 4.298 5.917 2.648 1.00 0.00 C ATOM 920 O GLU A 63 4.385 6.862 1.861 1.00 0.00 O ATOM 921 CB GLU A 63 6.458 4.701 2.115 1.00 0.00 C ATOM 922 CG GLU A 63 7.228 5.129 3.371 1.00 0.00 C ATOM 923 CD GLU A 63 8.734 5.302 3.073 1.00 0.00 C ATOM 924 OE1 GLU A 63 9.335 4.444 2.380 1.00 0.00 O ATOM 925 OE2 GLU A 63 9.320 6.319 3.516 1.00 0.00 O ATOM 0 H GLU A 63 4.789 4.395 0.243 1.00 0.00 H new ATOM 0 HA GLU A 63 4.750 3.905 3.160 1.00 0.00 H new ATOM 0 HB2 GLU A 63 6.852 3.745 1.770 1.00 0.00 H new ATOM 0 HB3 GLU A 63 6.645 5.427 1.324 1.00 0.00 H new ATOM 0 HG2 GLU A 63 6.820 6.066 3.749 1.00 0.00 H new ATOM 0 HG3 GLU A 63 7.093 4.384 4.155 1.00 0.00 H new ATOM 932 N PHE A 64 3.679 6.022 3.820 1.00 0.00 N ATOM 933 CA PHE A 64 3.067 7.247 4.331 1.00 0.00 C ATOM 934 C PHE A 64 3.972 7.977 5.325 1.00 0.00 C ATOM 935 O PHE A 64 4.874 7.391 5.931 1.00 0.00 O ATOM 936 CB PHE A 64 1.707 6.924 4.959 1.00 0.00 C ATOM 937 CG PHE A 64 0.654 6.595 3.928 1.00 0.00 C ATOM 938 CD1 PHE A 64 0.440 5.266 3.520 1.00 0.00 C ATOM 939 CD2 PHE A 64 -0.076 7.642 3.339 1.00 0.00 C ATOM 940 CE1 PHE A 64 -0.519 4.985 2.528 1.00 0.00 C ATOM 941 CE2 PHE A 64 -1.037 7.359 2.355 1.00 0.00 C ATOM 942 CZ PHE A 64 -1.259 6.034 1.953 1.00 0.00 C ATOM 0 H PHE A 64 3.586 5.234 4.461 1.00 0.00 H new ATOM 0 HA PHE A 64 2.921 7.924 3.490 1.00 0.00 H new ATOM 0 HB2 PHE A 64 1.817 6.081 5.642 1.00 0.00 H new ATOM 0 HB3 PHE A 64 1.374 7.775 5.554 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.009 4.464 3.966 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.102 8.663 3.643 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.686 3.967 2.209 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.605 8.162 1.908 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.001 5.818 1.199 1.00 0.00 H new ATOM 952 N LEU A 65 3.703 9.271 5.518 1.00 0.00 N ATOM 953 CA LEU A 65 4.438 10.113 6.466 1.00 0.00 C ATOM 954 C LEU A 65 4.298 9.620 7.920 1.00 0.00 C ATOM 955 O LEU A 65 5.257 9.708 8.691 1.00 0.00 O ATOM 956 CB LEU A 65 3.929 11.556 6.314 1.00 0.00 C ATOM 957 CG LEU A 65 4.844 12.607 6.963 1.00 0.00 C ATOM 958 CD1 LEU A 65 6.110 12.840 6.135 1.00 0.00 C ATOM 959 CD2 LEU A 65 4.103 13.941 7.069 1.00 0.00 C ATOM 0 H LEU A 65 2.965 9.767 5.018 1.00 0.00 H new ATOM 0 HA LEU A 65 5.503 10.062 6.238 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.824 11.785 5.253 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.935 11.630 6.756 1.00 0.00 H new ATOM 0 HG LEU A 65 5.122 12.232 7.948 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.732 13.589 6.625 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.666 11.906 6.049 1.00 0.00 H new ATOM 0 HD13 LEU A 65 5.835 13.191 5.140 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.755 14.684 7.530 1.00 0.00 H new ATOM 0 HD22 LEU A 65 3.816 14.278 6.073 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.210 13.813 7.680 1.00 0.00 H new ATOM 971 N SER A 66 3.129 9.071 8.271 1.00 0.00 N ATOM 972 CA SER A 66 2.800 8.600 9.624 1.00 0.00 C ATOM 973 C SER A 66 1.940 7.330 9.599 1.00 0.00 C ATOM 974 O SER A 66 1.200 7.071 8.650 1.00 0.00 O ATOM 975 CB SER A 66 2.069 9.697 10.415 1.00 0.00 C ATOM 976 OG SER A 66 2.791 10.923 10.430 1.00 0.00 O ATOM 0 H SER A 66 2.366 8.938 7.607 1.00 0.00 H new ATOM 0 HA SER A 66 3.744 8.361 10.114 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.085 9.863 9.977 1.00 0.00 H new ATOM 0 HB3 SER A 66 1.910 9.359 11.439 1.00 0.00 H new ATOM 0 HG SER A 66 2.290 11.592 10.942 1.00 0.00 H new ATOM 982 N GLU A 67 1.998 6.544 10.675 1.00 0.00 N ATOM 983 CA GLU A 67 1.249 5.285 10.830 1.00 0.00 C ATOM 984 C GLU A 67 -0.278 5.478 10.772 1.00 0.00 C ATOM 985 O GLU A 67 -0.988 4.638 10.217 1.00 0.00 O ATOM 986 CB GLU A 67 1.686 4.645 12.155 1.00 0.00 C ATOM 987 CG GLU A 67 0.927 3.359 12.513 1.00 0.00 C ATOM 988 CD GLU A 67 1.548 2.621 13.715 1.00 0.00 C ATOM 989 OE1 GLU A 67 1.632 1.370 13.665 1.00 0.00 O ATOM 990 OE2 GLU A 67 1.906 3.267 14.730 1.00 0.00 O ATOM 0 H GLU A 67 2.578 6.765 11.484 1.00 0.00 H new ATOM 0 HA GLU A 67 1.480 4.629 9.991 1.00 0.00 H new ATOM 0 HB2 GLU A 67 2.752 4.422 12.104 1.00 0.00 H new ATOM 0 HB3 GLU A 67 1.550 5.369 12.958 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.111 3.605 12.738 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.917 2.695 11.649 1.00 0.00 H new ATOM 997 N GLU A 68 -0.796 6.603 11.272 1.00 0.00 N ATOM 998 CA GLU A 68 -2.232 6.924 11.214 1.00 0.00 C ATOM 999 C GLU A 68 -2.742 7.208 9.787 1.00 0.00 C ATOM 1000 O GLU A 68 -3.926 7.021 9.505 1.00 0.00 O ATOM 1001 CB GLU A 68 -2.553 8.082 12.176 1.00 0.00 C ATOM 1002 CG GLU A 68 -1.891 9.417 11.800 1.00 0.00 C ATOM 1003 CD GLU A 68 -2.212 10.499 12.849 1.00 0.00 C ATOM 1004 OE1 GLU A 68 -3.271 11.166 12.740 1.00 0.00 O ATOM 1005 OE2 GLU A 68 -1.406 10.695 13.792 1.00 0.00 O ATOM 0 H GLU A 68 -0.234 7.321 11.730 1.00 0.00 H new ATOM 0 HA GLU A 68 -2.772 6.034 11.538 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -3.633 8.222 12.210 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -2.236 7.803 13.181 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.812 9.285 11.725 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.241 9.739 10.819 1.00 0.00 H new ATOM 1012 N ASP A 69 -1.854 7.598 8.866 1.00 0.00 N ATOM 1013 CA ASP A 69 -2.168 7.758 7.442 1.00 0.00 C ATOM 1014 C ASP A 69 -2.107 6.415 6.695 1.00 0.00 C ATOM 1015 O ASP A 69 -2.908 6.178 5.788 1.00 0.00 O ATOM 1016 CB ASP A 69 -1.224 8.801 6.827 1.00 0.00 C ATOM 1017 CG ASP A 69 -1.473 10.207 7.394 1.00 0.00 C ATOM 1018 OD1 ASP A 69 -0.546 10.780 8.011 1.00 0.00 O ATOM 1019 OD2 ASP A 69 -2.585 10.753 7.196 1.00 0.00 O ATOM 0 H ASP A 69 -0.883 7.814 9.092 1.00 0.00 H new ATOM 0 HA ASP A 69 -3.193 8.115 7.342 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -0.190 8.511 7.017 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -1.357 8.817 5.745 1.00 0.00 H new ATOM 1024 N ALA A 70 -1.241 5.488 7.129 1.00 0.00 N ATOM 1025 CA ALA A 70 -1.232 4.114 6.627 1.00 0.00 C ATOM 1026 C ALA A 70 -2.491 3.347 7.085 1.00 0.00 C ATOM 1027 O ALA A 70 -3.146 2.692 6.276 1.00 0.00 O ATOM 1028 CB ALA A 70 0.075 3.439 7.075 1.00 0.00 C ATOM 0 H ALA A 70 -0.530 5.673 7.837 1.00 0.00 H new ATOM 0 HA ALA A 70 -1.265 4.110 5.538 1.00 0.00 H new ATOM 0 HB1 ALA A 70 0.098 2.413 6.709 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.925 3.988 6.670 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.129 3.437 8.164 1.00 0.00 H new ATOM 1034 N ASP A 71 -2.902 3.504 8.349 1.00 0.00 N ATOM 1035 CA ASP A 71 -4.159 2.955 8.888 1.00 0.00 C ATOM 1036 C ASP A 71 -5.408 3.478 8.151 1.00 0.00 C ATOM 1037 O ASP A 71 -6.415 2.773 8.049 1.00 0.00 O ATOM 1038 CB ASP A 71 -4.240 3.280 10.387 1.00 0.00 C ATOM 1039 CG ASP A 71 -5.455 2.613 11.054 1.00 0.00 C ATOM 1040 OD1 ASP A 71 -6.507 3.280 11.210 1.00 0.00 O ATOM 1041 OD2 ASP A 71 -5.360 1.418 11.421 1.00 0.00 O ATOM 0 H ASP A 71 -2.363 4.025 9.041 1.00 0.00 H new ATOM 0 HA ASP A 71 -4.147 1.876 8.734 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -3.327 2.947 10.880 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -4.299 4.360 10.522 1.00 0.00 H new ATOM 1046 N TYR A 72 -5.347 4.685 7.582 1.00 0.00 N ATOM 1047 CA TYR A 72 -6.406 5.217 6.724 1.00 0.00 C ATOM 1048 C TYR A 72 -6.415 4.536 5.347 1.00 0.00 C ATOM 1049 O TYR A 72 -7.479 4.172 4.852 1.00 0.00 O ATOM 1050 CB TYR A 72 -6.275 6.743 6.612 1.00 0.00 C ATOM 1051 CG TYR A 72 -7.553 7.438 6.170 1.00 0.00 C ATOM 1052 CD1 TYR A 72 -7.998 7.333 4.838 1.00 0.00 C ATOM 1053 CD2 TYR A 72 -8.301 8.192 7.097 1.00 0.00 C ATOM 1054 CE1 TYR A 72 -9.170 7.994 4.425 1.00 0.00 C ATOM 1055 CE2 TYR A 72 -9.480 8.847 6.692 1.00 0.00 C ATOM 1056 CZ TYR A 72 -9.916 8.753 5.350 1.00 0.00 C ATOM 1057 OH TYR A 72 -11.051 9.387 4.945 1.00 0.00 O ATOM 0 H TYR A 72 -4.559 5.321 7.704 1.00 0.00 H new ATOM 0 HA TYR A 72 -7.369 4.993 7.183 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -5.970 7.144 7.579 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -5.481 6.979 5.904 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -7.437 6.742 4.129 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -7.969 8.268 8.122 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -9.498 7.920 3.399 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -10.051 9.421 7.406 1.00 0.00 H new ATOM 0 HH TYR A 72 -11.447 9.865 5.703 1.00 0.00 H new ATOM 1067 N ALA A 73 -5.254 4.287 4.736 1.00 0.00 N ATOM 1068 CA ALA A 73 -5.179 3.668 3.411 1.00 0.00 C ATOM 1069 C ALA A 73 -5.632 2.201 3.432 1.00 0.00 C ATOM 1070 O ALA A 73 -6.351 1.767 2.535 1.00 0.00 O ATOM 1071 CB ALA A 73 -3.751 3.824 2.892 1.00 0.00 C ATOM 0 H ALA A 73 -4.345 4.507 5.143 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.868 4.172 2.733 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -3.671 3.369 1.905 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -3.502 4.883 2.825 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -3.060 3.331 3.575 1.00 0.00 H new ATOM 1077 N ILE A 74 -5.308 1.468 4.501 1.00 0.00 N ATOM 1078 CA ILE A 74 -5.819 0.110 4.756 1.00 0.00 C ATOM 1079 C ILE A 74 -7.355 0.112 4.844 1.00 0.00 C ATOM 1080 O ILE A 74 -8.016 -0.799 4.346 1.00 0.00 O ATOM 1081 CB ILE A 74 -5.183 -0.446 6.054 1.00 0.00 C ATOM 1082 CG1 ILE A 74 -3.651 -0.551 5.891 1.00 0.00 C ATOM 1083 CG2 ILE A 74 -5.767 -1.825 6.412 1.00 0.00 C ATOM 1084 CD1 ILE A 74 -2.887 -0.722 7.204 1.00 0.00 C ATOM 0 H ILE A 74 -4.674 1.803 5.227 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.542 -0.539 3.925 1.00 0.00 H new ATOM 0 HB ILE A 74 -5.414 0.244 6.866 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -3.424 -1.395 5.240 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.289 0.346 5.388 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -5.302 -2.191 7.328 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -6.843 -1.737 6.562 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -5.570 -2.525 5.600 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.819 -0.787 6.998 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -3.080 0.134 7.851 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -3.217 -1.634 7.701 1.00 0.00 H new ATOM 1096 N LYS A 75 -7.927 1.166 5.436 1.00 0.00 N ATOM 1097 CA LYS A 75 -9.368 1.323 5.664 1.00 0.00 C ATOM 1098 C LYS A 75 -10.163 1.558 4.375 1.00 0.00 C ATOM 1099 O LYS A 75 -11.259 1.014 4.237 1.00 0.00 O ATOM 1100 CB LYS A 75 -9.536 2.445 6.697 1.00 0.00 C ATOM 1101 CG LYS A 75 -10.936 2.521 7.298 1.00 0.00 C ATOM 1102 CD LYS A 75 -11.022 3.456 8.522 1.00 0.00 C ATOM 1103 CE LYS A 75 -10.128 3.076 9.723 1.00 0.00 C ATOM 1104 NZ LYS A 75 -8.758 3.657 9.647 1.00 0.00 N ATOM 0 H LYS A 75 -7.384 1.958 5.780 1.00 0.00 H new ATOM 0 HA LYS A 75 -9.790 0.395 6.050 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.813 2.299 7.500 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.300 3.399 6.226 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -11.634 2.867 6.535 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -11.254 1.520 7.590 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -10.760 4.465 8.204 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -12.058 3.487 8.860 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -10.606 3.411 10.643 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -10.052 1.990 9.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -8.078 3.001 10.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -8.502 3.813 8.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -8.737 4.564 10.156 1.00 0.00 H new ATOM 1118 N ILE A 76 -9.606 2.318 3.426 1.00 0.00 N ATOM 1119 CA ILE A 76 -10.261 2.636 2.144 1.00 0.00 C ATOM 1120 C ILE A 76 -9.890 1.715 0.965 1.00 0.00 C ATOM 1121 O ILE A 76 -10.765 1.426 0.150 1.00 0.00 O ATOM 1122 CB ILE A 76 -10.077 4.122 1.769 1.00 0.00 C ATOM 1123 CG1 ILE A 76 -8.604 4.553 1.622 1.00 0.00 C ATOM 1124 CG2 ILE A 76 -10.776 5.018 2.804 1.00 0.00 C ATOM 1125 CD1 ILE A 76 -8.450 5.826 0.792 1.00 0.00 C ATOM 0 H ILE A 76 -8.680 2.735 3.523 1.00 0.00 H new ATOM 0 HA ILE A 76 -11.318 2.440 2.326 1.00 0.00 H new ATOM 0 HB ILE A 76 -10.533 4.242 0.786 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.175 4.713 2.611 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -8.037 3.747 1.155 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -10.640 6.064 2.530 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.840 4.784 2.828 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -10.344 4.842 3.789 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -7.394 6.087 0.719 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -8.853 5.660 -0.207 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -8.993 6.641 1.271 1.00 0.00 H new ATOM 1137 N MET A 77 -8.641 1.243 0.847 1.00 0.00 N ATOM 1138 CA MET A 77 -8.139 0.535 -0.353 1.00 0.00 C ATOM 1139 C MET A 77 -8.238 -0.995 -0.290 1.00 0.00 C ATOM 1140 O MET A 77 -7.885 -1.688 -1.242 1.00 0.00 O ATOM 1141 CB MET A 77 -6.721 0.999 -0.713 1.00 0.00 C ATOM 1142 CG MET A 77 -6.665 2.440 -1.225 1.00 0.00 C ATOM 1143 SD MET A 77 -7.136 2.627 -2.963 1.00 0.00 S ATOM 1144 CE MET A 77 -6.595 4.334 -3.213 1.00 0.00 C ATOM 0 H MET A 77 -7.941 1.339 1.583 1.00 0.00 H new ATOM 0 HA MET A 77 -8.818 0.818 -1.158 1.00 0.00 H new ATOM 0 HB2 MET A 77 -6.083 0.908 0.166 1.00 0.00 H new ATOM 0 HB3 MET A 77 -6.311 0.335 -1.474 1.00 0.00 H new ATOM 0 HG2 MET A 77 -7.323 3.057 -0.613 1.00 0.00 H new ATOM 0 HG3 MET A 77 -5.653 2.823 -1.091 1.00 0.00 H new ATOM 0 HE1 MET A 77 -7.268 4.830 -3.912 1.00 0.00 H new ATOM 0 HE2 MET A 77 -6.607 4.863 -2.260 1.00 0.00 H new ATOM 0 HE3 MET A 77 -5.583 4.339 -3.618 1.00 0.00 H new ATOM 1154 N ASP A 78 -8.747 -1.542 0.808 1.00 0.00 N ATOM 1155 CA ASP A 78 -8.948 -2.986 0.965 1.00 0.00 C ATOM 1156 C ASP A 78 -10.263 -3.454 0.316 1.00 0.00 C ATOM 1157 O ASP A 78 -11.287 -2.771 0.397 1.00 0.00 O ATOM 1158 CB ASP A 78 -8.849 -3.386 2.442 1.00 0.00 C ATOM 1159 CG ASP A 78 -8.858 -4.911 2.604 1.00 0.00 C ATOM 1160 OD1 ASP A 78 -7.975 -5.566 2.004 1.00 0.00 O ATOM 1161 OD2 ASP A 78 -9.751 -5.447 3.303 1.00 0.00 O ATOM 0 H ASP A 78 -9.035 -0.997 1.621 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.148 -3.501 0.432 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.935 -2.977 2.872 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -9.683 -2.954 2.995 1.00 0.00 H new ATOM 1166 N MET A 79 -10.232 -4.618 -0.345 1.00 0.00 N ATOM 1167 CA MET A 79 -11.339 -5.182 -1.143 1.00 0.00 C ATOM 1168 C MET A 79 -11.800 -4.305 -2.335 1.00 0.00 C ATOM 1169 O MET A 79 -12.825 -4.576 -2.964 1.00 0.00 O ATOM 1170 CB MET A 79 -12.469 -5.660 -0.206 1.00 0.00 C ATOM 1171 CG MET A 79 -13.297 -6.811 -0.794 1.00 0.00 C ATOM 1172 SD MET A 79 -14.538 -7.517 0.327 1.00 0.00 S ATOM 1173 CE MET A 79 -13.468 -8.367 1.523 1.00 0.00 C ATOM 0 H MET A 79 -9.407 -5.218 -0.342 1.00 0.00 H new ATOM 0 HA MET A 79 -10.954 -6.059 -1.663 1.00 0.00 H new ATOM 0 HB2 MET A 79 -12.035 -5.980 0.741 1.00 0.00 H new ATOM 0 HB3 MET A 79 -13.130 -4.821 0.013 1.00 0.00 H new ATOM 0 HG2 MET A 79 -13.802 -6.453 -1.691 1.00 0.00 H new ATOM 0 HG3 MET A 79 -12.618 -7.605 -1.105 1.00 0.00 H new ATOM 0 HE1 MET A 79 -14.076 -8.996 2.173 1.00 0.00 H new ATOM 0 HE2 MET A 79 -12.747 -8.986 0.990 1.00 0.00 H new ATOM 0 HE3 MET A 79 -12.938 -7.629 2.125 1.00 0.00 H new ATOM 1183 N ILE A 80 -11.022 -3.276 -2.687 1.00 0.00 N ATOM 1184 CA ILE A 80 -11.162 -2.476 -3.913 1.00 0.00 C ATOM 1185 C ILE A 80 -10.720 -3.296 -5.140 1.00 0.00 C ATOM 1186 O ILE A 80 -9.981 -4.271 -5.014 1.00 0.00 O ATOM 1187 CB ILE A 80 -10.415 -1.126 -3.716 1.00 0.00 C ATOM 1188 CG1 ILE A 80 -11.391 -0.098 -3.098 1.00 0.00 C ATOM 1189 CG2 ILE A 80 -9.689 -0.576 -4.952 1.00 0.00 C ATOM 1190 CD1 ILE A 80 -10.888 1.352 -3.060 1.00 0.00 C ATOM 0 H ILE A 80 -10.246 -2.963 -2.104 1.00 0.00 H new ATOM 0 HA ILE A 80 -12.204 -2.224 -4.111 1.00 0.00 H new ATOM 0 HB ILE A 80 -9.592 -1.326 -3.030 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -12.324 -0.126 -3.661 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -11.623 -0.410 -2.080 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -9.204 0.367 -4.700 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -8.938 -1.293 -5.282 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -10.409 -0.410 -5.753 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -11.648 1.989 -2.608 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -9.973 1.404 -2.470 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -10.685 1.693 -4.075 1.00 0.00 H new ATOM 1202 N LYS A 81 -11.178 -2.910 -6.339 1.00 0.00 N ATOM 1203 CA LYS A 81 -10.909 -3.594 -7.615 1.00 0.00 C ATOM 1204 C LYS A 81 -10.143 -2.699 -8.601 1.00 0.00 C ATOM 1205 O LYS A 81 -10.697 -2.248 -9.606 1.00 0.00 O ATOM 1206 CB LYS A 81 -12.237 -4.115 -8.187 1.00 0.00 C ATOM 1207 CG LYS A 81 -12.889 -5.189 -7.298 1.00 0.00 C ATOM 1208 CD LYS A 81 -14.136 -5.819 -7.935 1.00 0.00 C ATOM 1209 CE LYS A 81 -13.770 -6.782 -9.071 1.00 0.00 C ATOM 1210 NZ LYS A 81 -14.978 -7.285 -9.777 1.00 0.00 N ATOM 0 H LYS A 81 -11.766 -2.085 -6.453 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.251 -4.445 -7.438 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.928 -3.281 -8.307 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.062 -4.529 -9.180 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.160 -5.972 -7.089 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.162 -4.744 -6.341 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.702 -6.354 -7.173 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -14.784 -5.032 -8.320 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.118 -6.275 -9.782 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.208 -7.624 -8.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -14.691 -7.933 -10.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -15.588 -7.791 -9.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -15.501 -6.484 -10.184 1.00 0.00 H new ATOM 1224 N LEU A 82 -8.860 -2.448 -8.328 1.00 0.00 N ATOM 1225 CA LEU A 82 -7.965 -1.692 -9.220 1.00 0.00 C ATOM 1226 C LEU A 82 -7.884 -2.385 -10.595 1.00 0.00 C ATOM 1227 O LEU A 82 -7.651 -3.595 -10.657 1.00 0.00 O ATOM 1228 CB LEU A 82 -6.590 -1.544 -8.535 1.00 0.00 C ATOM 1229 CG LEU A 82 -5.584 -0.625 -9.255 1.00 0.00 C ATOM 1230 CD1 LEU A 82 -6.148 0.774 -9.511 1.00 0.00 C ATOM 1231 CD2 LEU A 82 -4.333 -0.479 -8.387 1.00 0.00 C ATOM 0 H LEU A 82 -8.404 -2.766 -7.473 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.353 -0.690 -9.402 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -6.746 -1.163 -7.526 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.145 -2.534 -8.436 1.00 0.00 H new ATOM 0 HG LEU A 82 -5.358 -1.084 -10.218 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -5.399 1.381 -10.020 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.039 0.699 -10.134 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.408 1.241 -8.561 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.615 0.170 -8.889 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -4.606 -0.043 -7.426 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -3.885 -1.460 -8.227 1.00 0.00 H new ATOM 1243 N TYR A 83 -8.138 -1.654 -11.692 1.00 0.00 N ATOM 1244 CA TYR A 83 -8.332 -2.239 -13.037 1.00 0.00 C ATOM 1245 C TYR A 83 -9.272 -3.483 -13.116 1.00 0.00 C ATOM 1246 O TYR A 83 -9.095 -4.341 -13.986 1.00 0.00 O ATOM 1247 CB TYR A 83 -6.970 -2.471 -13.719 1.00 0.00 C ATOM 1248 CG TYR A 83 -6.132 -1.224 -13.917 1.00 0.00 C ATOM 1249 CD1 TYR A 83 -6.561 -0.221 -14.810 1.00 0.00 C ATOM 1250 CD2 TYR A 83 -4.905 -1.082 -13.241 1.00 0.00 C ATOM 1251 CE1 TYR A 83 -5.765 0.920 -15.031 1.00 0.00 C ATOM 1252 CE2 TYR A 83 -4.106 0.055 -13.462 1.00 0.00 C ATOM 1253 CZ TYR A 83 -4.532 1.061 -14.356 1.00 0.00 C ATOM 1254 OH TYR A 83 -3.753 2.157 -14.566 1.00 0.00 O ATOM 0 H TYR A 83 -8.216 -0.637 -11.676 1.00 0.00 H new ATOM 0 HA TYR A 83 -8.891 -1.492 -13.600 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -6.399 -3.183 -13.123 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -7.141 -2.933 -14.691 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.503 -0.328 -15.327 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -4.577 -1.846 -12.552 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -6.097 1.686 -15.716 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -3.163 0.158 -12.946 1.00 0.00 H new ATOM 0 HH TYR A 83 -4.321 2.924 -14.787 1.00 0.00 H new ATOM 1264 N GLY A 84 -10.278 -3.609 -12.236 1.00 0.00 N ATOM 1265 CA GLY A 84 -11.291 -4.680 -12.286 1.00 0.00 C ATOM 1266 C GLY A 84 -10.867 -6.048 -11.718 1.00 0.00 C ATOM 1267 O GLY A 84 -11.499 -7.058 -12.032 1.00 0.00 O ATOM 0 H GLY A 84 -10.414 -2.962 -11.459 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -12.173 -4.342 -11.742 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -11.591 -4.819 -13.325 1.00 0.00 H new ATOM 1271 N LYS A 85 -9.826 -6.095 -10.876 1.00 0.00 N ATOM 1272 CA LYS A 85 -9.251 -7.268 -10.210 1.00 0.00 C ATOM 1273 C LYS A 85 -9.063 -6.926 -8.720 1.00 0.00 C ATOM 1274 O LYS A 85 -8.457 -5.897 -8.414 1.00 0.00 O ATOM 1275 CB LYS A 85 -7.909 -7.650 -10.858 1.00 0.00 C ATOM 1276 CG LYS A 85 -8.105 -8.267 -12.249 1.00 0.00 C ATOM 1277 CD LYS A 85 -6.756 -8.524 -12.930 1.00 0.00 C ATOM 1278 CE LYS A 85 -6.972 -9.051 -14.354 1.00 0.00 C ATOM 1279 NZ LYS A 85 -5.684 -9.168 -15.082 1.00 0.00 N ATOM 0 H LYS A 85 -9.325 -5.243 -10.624 1.00 0.00 H new ATOM 0 HA LYS A 85 -9.918 -8.124 -10.312 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.279 -6.764 -10.938 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -7.384 -8.358 -10.217 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -8.656 -9.203 -12.161 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -8.707 -7.599 -12.866 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -6.174 -7.603 -12.960 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.180 -9.246 -12.351 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -7.461 -10.025 -14.314 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -7.640 -8.381 -14.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -5.869 -9.395 -16.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -5.168 -8.267 -15.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -5.111 -9.924 -14.655 1.00 0.00 H new ATOM 1293 N PRO A 86 -9.623 -7.717 -7.791 1.00 0.00 N ATOM 1294 CA PRO A 86 -9.690 -7.369 -6.375 1.00 0.00 C ATOM 1295 C PRO A 86 -8.321 -7.415 -5.678 1.00 0.00 C ATOM 1296 O PRO A 86 -7.593 -8.406 -5.776 1.00 0.00 O ATOM 1297 CB PRO A 86 -10.723 -8.322 -5.762 1.00 0.00 C ATOM 1298 CG PRO A 86 -10.758 -9.510 -6.722 1.00 0.00 C ATOM 1299 CD PRO A 86 -10.447 -8.873 -8.074 1.00 0.00 C ATOM 0 HA PRO A 86 -9.996 -6.332 -6.239 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -10.433 -8.631 -4.758 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -11.701 -7.848 -5.680 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -10.021 -10.267 -6.454 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -11.732 -10.000 -6.722 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -9.925 -9.574 -8.725 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -11.363 -8.583 -8.588 1.00 0.00 H new ATOM 1307 N ILE A 87 -8.002 -6.348 -4.940 1.00 0.00 N ATOM 1308 CA ILE A 87 -6.783 -6.200 -4.130 1.00 0.00 C ATOM 1309 C ILE A 87 -7.048 -6.431 -2.633 1.00 0.00 C ATOM 1310 O ILE A 87 -8.192 -6.390 -2.166 1.00 0.00 O ATOM 1311 CB ILE A 87 -6.065 -4.848 -4.389 1.00 0.00 C ATOM 1312 CG1 ILE A 87 -6.959 -3.611 -4.151 1.00 0.00 C ATOM 1313 CG2 ILE A 87 -5.492 -4.830 -5.815 1.00 0.00 C ATOM 1314 CD1 ILE A 87 -6.168 -2.310 -3.959 1.00 0.00 C ATOM 0 H ILE A 87 -8.608 -5.529 -4.886 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.101 -6.986 -4.454 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.260 -4.778 -3.658 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.636 -3.494 -4.998 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -7.577 -3.784 -3.270 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -4.989 -3.880 -5.993 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -4.778 -5.646 -5.931 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -6.302 -4.952 -6.534 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.860 -1.484 -3.797 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.511 -2.408 -3.095 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -5.570 -2.113 -4.849 1.00 0.00 H new ATOM 1326 N ARG A 88 -5.977 -6.671 -1.871 1.00 0.00 N ATOM 1327 CA ARG A 88 -5.973 -6.723 -0.398 1.00 0.00 C ATOM 1328 C ARG A 88 -4.875 -5.832 0.179 1.00 0.00 C ATOM 1329 O ARG A 88 -3.778 -5.777 -0.383 1.00 0.00 O ATOM 1330 CB ARG A 88 -5.828 -8.172 0.102 1.00 0.00 C ATOM 1331 CG ARG A 88 -7.018 -9.083 -0.245 1.00 0.00 C ATOM 1332 CD ARG A 88 -8.325 -8.638 0.429 1.00 0.00 C ATOM 1333 NE ARG A 88 -9.438 -9.545 0.094 1.00 0.00 N ATOM 1334 CZ ARG A 88 -10.202 -9.502 -0.982 1.00 0.00 C ATOM 1335 NH1 ARG A 88 -10.054 -8.601 -1.914 1.00 0.00 N ATOM 1336 NH2 ARG A 88 -11.150 -10.381 -1.145 1.00 0.00 N ATOM 0 H ARG A 88 -5.055 -6.841 -2.272 1.00 0.00 H new ATOM 0 HA ARG A 88 -6.932 -6.342 -0.047 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.921 -8.602 -0.323 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -5.698 -8.159 1.184 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -7.158 -9.095 -1.326 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -6.788 -10.105 0.058 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -8.188 -8.611 1.510 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -8.572 -7.624 0.114 1.00 0.00 H new ATOM 0 HE ARG A 88 -9.640 -10.286 0.766 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -9.325 -7.893 -1.827 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -10.667 -8.605 -2.729 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -11.302 -11.103 -0.441 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -11.740 -10.347 -1.977 1.00 0.00 H new ATOM 1350 N VAL A 89 -5.176 -5.137 1.277 1.00 0.00 N ATOM 1351 CA VAL A 89 -4.308 -4.110 1.882 1.00 0.00 C ATOM 1352 C VAL A 89 -4.175 -4.308 3.396 1.00 0.00 C ATOM 1353 O VAL A 89 -5.162 -4.571 4.086 1.00 0.00 O ATOM 1354 CB VAL A 89 -4.799 -2.686 1.540 1.00 0.00 C ATOM 1355 CG1 VAL A 89 -3.801 -1.607 1.978 1.00 0.00 C ATOM 1356 CG2 VAL A 89 -4.983 -2.504 0.029 1.00 0.00 C ATOM 0 H VAL A 89 -6.049 -5.271 1.787 1.00 0.00 H new ATOM 0 HA VAL A 89 -3.314 -4.227 1.450 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.743 -2.575 2.073 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -4.191 -0.623 1.716 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -3.654 -1.664 3.057 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -2.848 -1.766 1.473 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.329 -1.491 -0.176 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -4.032 -2.672 -0.476 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.719 -3.220 -0.337 1.00 0.00 H new ATOM 1366 N ASN A 90 -2.951 -4.174 3.915 1.00 0.00 N ATOM 1367 CA ASN A 90 -2.591 -4.301 5.337 1.00 0.00 C ATOM 1368 C ASN A 90 -1.269 -3.574 5.640 1.00 0.00 C ATOM 1369 O ASN A 90 -0.589 -3.107 4.728 1.00 0.00 O ATOM 1370 CB ASN A 90 -2.520 -5.801 5.711 1.00 0.00 C ATOM 1371 CG ASN A 90 -1.617 -6.636 4.812 1.00 0.00 C ATOM 1372 OD1 ASN A 90 -2.072 -7.292 3.887 1.00 0.00 O ATOM 1373 ND2 ASN A 90 -0.322 -6.656 5.035 1.00 0.00 N ATOM 0 H ASN A 90 -2.143 -3.964 3.330 1.00 0.00 H new ATOM 0 HA ASN A 90 -3.357 -3.825 5.949 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -2.169 -5.890 6.739 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -3.527 -6.218 5.681 1.00 0.00 H new ATOM 0 HD21 ASN A 90 0.290 -7.214 4.439 1.00 0.00 H new ATOM 0 HD22 ASN A 90 0.072 -6.113 5.804 1.00 0.00 H new ATOM 1380 N LYS A 91 -0.878 -3.503 6.919 1.00 0.00 N ATOM 1381 CA LYS A 91 0.441 -2.994 7.344 1.00 0.00 C ATOM 1382 C LYS A 91 1.549 -3.836 6.711 1.00 0.00 C ATOM 1383 O LYS A 91 1.447 -5.064 6.693 1.00 0.00 O ATOM 1384 CB LYS A 91 0.578 -3.048 8.882 1.00 0.00 C ATOM 1385 CG LYS A 91 -0.525 -2.318 9.664 1.00 0.00 C ATOM 1386 CD LYS A 91 -0.435 -0.785 9.588 1.00 0.00 C ATOM 1387 CE LYS A 91 0.648 -0.172 10.489 1.00 0.00 C ATOM 1388 NZ LYS A 91 0.374 -0.374 11.936 1.00 0.00 N ATOM 0 H LYS A 91 -1.469 -3.798 7.696 1.00 0.00 H new ATOM 0 HA LYS A 91 0.530 -1.958 7.017 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.591 -4.093 9.193 1.00 0.00 H new ATOM 0 HB3 LYS A 91 1.542 -2.621 9.160 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -1.496 -2.634 9.283 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -0.478 -2.623 10.709 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -0.240 -0.494 8.556 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.402 -0.362 9.861 1.00 0.00 H new ATOM 0 HE2 LYS A 91 1.613 -0.614 10.241 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.724 0.896 10.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 0.731 0.441 12.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -0.651 -0.466 12.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 0.850 -1.239 12.262 1.00 0.00 H new ATOM 1402 N ALA A 92 2.631 -3.211 6.257 1.00 0.00 N ATOM 1403 CA ALA A 92 3.795 -3.928 5.727 1.00 0.00 C ATOM 1404 C ALA A 92 4.645 -4.608 6.835 1.00 0.00 C ATOM 1405 O ALA A 92 5.581 -5.351 6.534 1.00 0.00 O ATOM 1406 CB ALA A 92 4.583 -2.959 4.841 1.00 0.00 C ATOM 0 H ALA A 92 2.730 -2.196 6.244 1.00 0.00 H new ATOM 0 HA ALA A 92 3.466 -4.769 5.117 1.00 0.00 H new ATOM 0 HB1 ALA A 92 5.456 -3.468 4.433 1.00 0.00 H new ATOM 0 HB2 ALA A 92 3.949 -2.615 4.024 1.00 0.00 H new ATOM 0 HB3 ALA A 92 4.906 -2.104 5.435 1.00 0.00 H new ATOM 1412 N SER A 93 4.300 -4.378 8.110 1.00 0.00 N ATOM 1413 CA SER A 93 4.843 -5.026 9.316 1.00 0.00 C ATOM 1414 C SER A 93 3.833 -5.929 10.056 1.00 0.00 C ATOM 1415 O SER A 93 4.084 -6.320 11.198 1.00 0.00 O ATOM 1416 CB SER A 93 5.386 -3.952 10.269 1.00 0.00 C ATOM 1417 OG SER A 93 4.347 -3.083 10.682 1.00 0.00 O ATOM 0 H SER A 93 3.586 -3.688 8.343 1.00 0.00 H new ATOM 0 HA SER A 93 5.641 -5.688 8.980 1.00 0.00 H new ATOM 0 HB2 SER A 93 5.839 -4.426 11.140 1.00 0.00 H new ATOM 0 HB3 SER A 93 6.170 -3.380 9.773 1.00 0.00 H new ATOM 0 HG SER A 93 4.609 -2.631 11.511 1.00 0.00 H new ATOM 1423 N ALA A 94 2.689 -6.278 9.441 1.00 0.00 N ATOM 1424 CA ALA A 94 1.553 -6.950 10.101 1.00 0.00 C ATOM 1425 C ALA A 94 1.901 -8.258 10.849 1.00 0.00 C ATOM 1426 O ALA A 94 1.232 -8.618 11.821 1.00 0.00 O ATOM 1427 CB ALA A 94 0.477 -7.223 9.041 1.00 0.00 C ATOM 0 H ALA A 94 2.524 -6.097 8.451 1.00 0.00 H new ATOM 0 HA ALA A 94 1.203 -6.273 10.880 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -0.374 -7.720 9.506 1.00 0.00 H new ATOM 0 HB2 ALA A 94 0.151 -6.280 8.602 1.00 0.00 H new ATOM 0 HB3 ALA A 94 0.889 -7.863 8.261 1.00 0.00 H new ATOM 1433 N HIS A 95 2.972 -8.948 10.443 1.00 0.00 N ATOM 1434 CA HIS A 95 3.488 -10.171 11.077 1.00 0.00 C ATOM 1435 C HIS A 95 3.966 -9.966 12.530 1.00 0.00 C ATOM 1436 O HIS A 95 4.073 -10.932 13.287 1.00 0.00 O ATOM 1437 CB HIS A 95 4.634 -10.723 10.212 1.00 0.00 C ATOM 1438 CG HIS A 95 4.319 -10.753 8.733 1.00 0.00 C ATOM 1439 ND1 HIS A 95 4.830 -9.862 7.784 1.00 0.00 N ATOM 1440 CD2 HIS A 95 3.427 -11.585 8.122 1.00 0.00 C ATOM 1441 CE1 HIS A 95 4.248 -10.192 6.617 1.00 0.00 C ATOM 1442 NE2 HIS A 95 3.403 -11.222 6.791 1.00 0.00 N ATOM 0 H HIS A 95 3.525 -8.662 9.635 1.00 0.00 H new ATOM 0 HA HIS A 95 2.663 -10.881 11.138 1.00 0.00 H new ATOM 0 HB2 HIS A 95 5.524 -10.115 10.373 1.00 0.00 H new ATOM 0 HB3 HIS A 95 4.874 -11.733 10.544 1.00 0.00 H new ATOM 0 HD2 HIS A 95 2.853 -12.372 8.588 1.00 0.00 H new ATOM 0 HE1 HIS A 95 4.434 -9.699 5.674 1.00 0.00 H new ATOM 0 HE2 HIS A 95 2.840 -11.661 6.063 1.00 0.00 H new ATOM 1450 N ASN A 96 4.217 -8.717 12.944 1.00 0.00 N ATOM 1451 CA ASN A 96 4.689 -8.359 14.287 1.00 0.00 C ATOM 1452 C ASN A 96 3.660 -8.624 15.410 1.00 0.00 C ATOM 1453 O ASN A 96 4.042 -8.694 16.578 1.00 0.00 O ATOM 1454 CB ASN A 96 5.142 -6.889 14.255 1.00 0.00 C ATOM 1455 CG ASN A 96 5.951 -6.521 15.488 1.00 0.00 C ATOM 1456 OD1 ASN A 96 7.110 -6.893 15.621 1.00 0.00 O ATOM 1457 ND2 ASN A 96 5.382 -5.805 16.426 1.00 0.00 N ATOM 0 H ASN A 96 4.094 -7.906 12.337 1.00 0.00 H new ATOM 0 HA ASN A 96 5.525 -9.011 14.540 1.00 0.00 H new ATOM 0 HB2 ASN A 96 5.741 -6.712 13.361 1.00 0.00 H new ATOM 0 HB3 ASN A 96 4.268 -6.241 14.187 1.00 0.00 H new ATOM 0 HD21 ASN A 96 5.904 -5.558 17.266 1.00 0.00 H new ATOM 0 HD22 ASN A 96 4.417 -5.495 16.316 1.00 0.00 H new ATOM 1464 N LYS A 97 2.379 -8.847 15.069 1.00 0.00 N ATOM 1465 CA LYS A 97 1.269 -9.184 15.989 1.00 0.00 C ATOM 1466 C LYS A 97 1.566 -10.362 16.941 1.00 0.00 C ATOM 1467 O LYS A 97 0.978 -10.441 18.020 1.00 0.00 O ATOM 1468 CB LYS A 97 0.019 -9.436 15.121 1.00 0.00 C ATOM 1469 CG LYS A 97 -1.237 -9.844 15.910 1.00 0.00 C ATOM 1470 CD LYS A 97 -2.479 -9.867 15.010 1.00 0.00 C ATOM 1471 CE LYS A 97 -3.658 -10.511 15.752 1.00 0.00 C ATOM 1472 NZ LYS A 97 -4.923 -10.384 14.980 1.00 0.00 N ATOM 0 H LYS A 97 2.070 -8.796 14.098 1.00 0.00 H new ATOM 0 HA LYS A 97 1.111 -8.347 16.669 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -0.202 -8.532 14.554 1.00 0.00 H new ATOM 0 HB3 LYS A 97 0.247 -10.218 14.397 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -1.087 -10.829 16.352 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -1.395 -9.147 16.733 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -2.739 -8.852 14.710 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -2.266 -10.424 14.098 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -3.444 -11.565 15.932 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -3.777 -10.039 16.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -5.635 -11.034 15.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -5.273 -9.407 15.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -4.747 -10.622 13.983 1.00 0.00 H new ATOM 1486 N ASN A 98 2.510 -11.240 16.586 1.00 0.00 N ATOM 1487 CA ASN A 98 3.030 -12.308 17.451 1.00 0.00 C ATOM 1488 C ASN A 98 3.601 -11.797 18.798 1.00 0.00 C ATOM 1489 O ASN A 98 3.538 -12.515 19.799 1.00 0.00 O ATOM 1490 CB ASN A 98 4.091 -13.074 16.639 1.00 0.00 C ATOM 1491 CG ASN A 98 4.681 -14.246 17.405 1.00 0.00 C ATOM 1492 OD1 ASN A 98 5.788 -14.187 17.923 1.00 0.00 O ATOM 1493 ND2 ASN A 98 3.968 -15.347 17.502 1.00 0.00 N ATOM 0 H ASN A 98 2.946 -11.228 15.664 1.00 0.00 H new ATOM 0 HA ASN A 98 2.207 -12.962 17.740 1.00 0.00 H new ATOM 0 HB2 ASN A 98 3.642 -13.438 15.715 1.00 0.00 H new ATOM 0 HB3 ASN A 98 4.891 -12.390 16.357 1.00 0.00 H new ATOM 0 HD21 ASN A 98 4.338 -16.151 18.009 1.00 0.00 H new ATOM 0 HD22 ASN A 98 3.045 -15.397 17.070 1.00 0.00 H new ATOM 1500 N LEU A 99 4.109 -10.558 18.845 1.00 0.00 N ATOM 1501 CA LEU A 99 4.504 -9.840 20.063 1.00 0.00 C ATOM 1502 C LEU A 99 3.482 -8.722 20.332 1.00 0.00 C ATOM 1503 O LEU A 99 3.462 -7.708 19.632 1.00 0.00 O ATOM 1504 CB LEU A 99 5.935 -9.286 19.898 1.00 0.00 C ATOM 1505 CG LEU A 99 7.025 -10.349 19.656 1.00 0.00 C ATOM 1506 CD1 LEU A 99 8.374 -9.659 19.444 1.00 0.00 C ATOM 1507 CD2 LEU A 99 7.173 -11.326 20.825 1.00 0.00 C ATOM 0 H LEU A 99 4.262 -10.007 18.001 1.00 0.00 H new ATOM 0 HA LEU A 99 4.511 -10.512 20.921 1.00 0.00 H new ATOM 0 HB2 LEU A 99 5.942 -8.585 19.064 1.00 0.00 H new ATOM 0 HB3 LEU A 99 6.194 -8.720 20.793 1.00 0.00 H new ATOM 0 HG LEU A 99 6.720 -10.914 18.776 1.00 0.00 H new ATOM 0 HD11 LEU A 99 9.144 -10.411 19.273 1.00 0.00 H new ATOM 0 HD12 LEU A 99 8.313 -8.999 18.579 1.00 0.00 H new ATOM 0 HD13 LEU A 99 8.627 -9.075 20.329 1.00 0.00 H new ATOM 0 HD21 LEU A 99 7.955 -12.051 20.597 1.00 0.00 H new ATOM 0 HD22 LEU A 99 7.440 -10.776 21.727 1.00 0.00 H new ATOM 0 HD23 LEU A 99 6.230 -11.848 20.984 1.00 0.00 H new ATOM 1519 N SER A 100 2.605 -8.920 21.319 1.00 0.00 N ATOM 1520 CA SER A 100 1.432 -8.060 21.558 1.00 0.00 C ATOM 1521 C SER A 100 1.619 -6.969 22.625 1.00 0.00 C ATOM 1522 O SER A 100 0.790 -6.061 22.719 1.00 0.00 O ATOM 1523 CB SER A 100 0.217 -8.933 21.886 1.00 0.00 C ATOM 1524 OG SER A 100 0.467 -9.708 23.050 1.00 0.00 O ATOM 0 H SER A 100 2.686 -9.689 21.985 1.00 0.00 H new ATOM 0 HA SER A 100 1.278 -7.508 20.631 1.00 0.00 H new ATOM 0 HB2 SER A 100 -0.660 -8.304 22.041 1.00 0.00 H new ATOM 0 HB3 SER A 100 -0.006 -9.589 21.045 1.00 0.00 H new ATOM 0 HG SER A 100 -0.318 -10.260 23.250 1.00 0.00 H new ATOM 1530 N GLY A 101 2.697 -7.019 23.412 1.00 0.00 N ATOM 1531 CA GLY A 101 2.993 -6.057 24.483 1.00 0.00 C ATOM 1532 C GLY A 101 4.457 -6.091 24.950 1.00 0.00 C ATOM 1533 O GLY A 101 5.230 -6.932 24.475 1.00 0.00 O ATOM 0 H GLY A 101 3.407 -7.746 23.322 1.00 0.00 H new ATOM 0 HA2 GLY A 101 2.754 -5.052 24.134 1.00 0.00 H new ATOM 0 HA3 GLY A 101 2.344 -6.262 25.334 1.00 0.00 H new ATOM 1537 N PRO A 102 4.874 -5.181 25.853 1.00 0.00 N ATOM 1538 CA PRO A 102 6.254 -5.106 26.337 1.00 0.00 C ATOM 1539 C PRO A 102 6.733 -6.417 26.979 1.00 0.00 C ATOM 1540 O PRO A 102 6.020 -7.024 27.784 1.00 0.00 O ATOM 1541 CB PRO A 102 6.287 -3.934 27.327 1.00 0.00 C ATOM 1542 CG PRO A 102 5.134 -3.049 26.858 1.00 0.00 C ATOM 1543 CD PRO A 102 4.099 -4.069 26.387 1.00 0.00 C ATOM 0 HA PRO A 102 6.943 -4.947 25.508 1.00 0.00 H new ATOM 0 HB2 PRO A 102 6.145 -4.270 28.354 1.00 0.00 H new ATOM 0 HB3 PRO A 102 7.240 -3.405 27.294 1.00 0.00 H new ATOM 0 HG2 PRO A 102 4.749 -2.424 27.664 1.00 0.00 H new ATOM 0 HG3 PRO A 102 5.438 -2.380 26.053 1.00 0.00 H new ATOM 0 HD2 PRO A 102 3.462 -4.392 27.210 1.00 0.00 H new ATOM 0 HD3 PRO A 102 3.445 -3.644 25.626 1.00 0.00 H new ATOM 1551 N SER A 103 7.948 -6.849 26.625 1.00 0.00 N ATOM 1552 CA SER A 103 8.588 -8.091 27.105 1.00 0.00 C ATOM 1553 C SER A 103 7.739 -9.369 26.925 1.00 0.00 C ATOM 1554 O SER A 103 7.819 -10.297 27.735 1.00 0.00 O ATOM 1555 CB SER A 103 9.111 -7.921 28.542 1.00 0.00 C ATOM 1556 OG SER A 103 9.987 -6.803 28.631 1.00 0.00 O ATOM 0 H SER A 103 8.538 -6.330 25.974 1.00 0.00 H new ATOM 0 HA SER A 103 9.443 -8.256 26.450 1.00 0.00 H new ATOM 0 HB2 SER A 103 8.273 -7.787 29.226 1.00 0.00 H new ATOM 0 HB3 SER A 103 9.635 -8.825 28.853 1.00 0.00 H new ATOM 0 HG SER A 103 10.307 -6.711 29.553 1.00 0.00 H new ATOM 1562 N SER A 104 6.919 -9.433 25.866 1.00 0.00 N ATOM 1563 CA SER A 104 6.085 -10.602 25.532 1.00 0.00 C ATOM 1564 C SER A 104 6.929 -11.865 25.278 1.00 0.00 C ATOM 1565 O SER A 104 7.989 -11.800 24.645 1.00 0.00 O ATOM 1566 CB SER A 104 5.202 -10.282 24.318 1.00 0.00 C ATOM 1567 OG SER A 104 4.260 -11.312 24.060 1.00 0.00 O ATOM 0 H SER A 104 6.813 -8.663 25.206 1.00 0.00 H new ATOM 0 HA SER A 104 5.450 -10.816 26.392 1.00 0.00 H new ATOM 0 HB2 SER A 104 4.675 -9.343 24.490 1.00 0.00 H new ATOM 0 HB3 SER A 104 5.831 -10.138 23.440 1.00 0.00 H new ATOM 0 HG SER A 104 3.716 -11.070 23.281 1.00 0.00 H new ATOM 1573 N GLY A 105 6.455 -13.016 25.775 1.00 0.00 N ATOM 1574 CA GLY A 105 7.112 -14.332 25.667 1.00 0.00 C ATOM 1575 C GLY A 105 7.034 -14.952 24.268 1.00 0.00 C ATOM 1576 O GLY A 105 5.912 -15.060 23.727 1.00 0.00 O ATOM 1577 OXT GLY A 105 8.092 -15.363 23.743 1.00 0.00 O ATOM 0 H GLY A 105 5.571 -13.061 26.282 1.00 0.00 H new ATOM 0 HA2 GLY A 105 8.160 -14.228 25.950 1.00 0.00 H new ATOM 0 HA3 GLY A 105 6.655 -15.015 26.383 1.00 0.00 H new TER 1581 GLY A 105