USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=27 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 38 GLN : amide:sc= 0.968 K(o=0.9,f=-0.085) USER MOD Set 1.2: A 77 MET CE :methyl -148:sc= -0.0679 (180deg=-1.66!) USER MOD Set 2.1: A 47 MET CE :methyl 163:sc= -0.0831 (180deg=-0.426) USER MOD Set 2.2: A 56 HIS : no HD1:sc= 1.3 K(o=1.2,f=-7.7!) USER MOD Single : A 1 GLY N :NH3+ -99:sc= 0.0442 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 1.16 K(o=1.2,f=-0.055) USER MOD Single : A 14 GLN : amide:sc= 0.563 K(o=0.56,f=-0.46) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -148:sc= 1.31 (180deg=1.08) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= 0.868 K(o=0.87,f=-0.3) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.147 USER MOD Single : A 46 HIS : no HD1:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 49 LYS NZ :NH3+ -157:sc= 2.47 (180deg=1.68) USER MOD Single : A 53 THR OG1 : rot -56:sc= 0.737 USER MOD Single : A 55 GLN : amide:sc= 0.792 K(o=0.79,f=-0.014) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=-0.31) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 MET CE :methyl -174:sc= 0 (180deg=-0.0321) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 178:sc= 1.14 (180deg=1.13) USER MOD Single : A 90 ASN : amide:sc= 0.29 K(o=0.29,f=-3.3!) USER MOD Single : A 91 LYS NZ :NH3+ -179:sc= 2.21 (180deg=2.13) USER MOD Single : A 93 SER OG : rot 167:sc= 1.22 USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 LYS NZ :NH3+ -163:sc= 1.28 (180deg=0.887) USER MOD Single : A 98 ASN : amide:sc= 0.164 K(o=0.16,f=-2.2) 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= 0.00408 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 35.423 16.996 -5.680 1.00 0.00 N ATOM 2 CA GLY A 1 34.009 16.564 -5.709 1.00 0.00 C ATOM 3 C GLY A 1 33.621 15.818 -4.439 1.00 0.00 C ATOM 4 O GLY A 1 34.473 15.219 -3.776 1.00 0.00 O ATOM 0 H1 GLY A 1 35.475 17.997 -5.401 1.00 0.00 H new ATOM 0 H2 GLY A 1 35.949 16.418 -4.994 1.00 0.00 H new ATOM 0 H3 GLY A 1 35.842 16.878 -6.625 1.00 0.00 H new ATOM 0 HA2 GLY A 1 33.365 17.435 -5.830 1.00 0.00 H new ATOM 0 HA3 GLY A 1 33.843 15.921 -6.574 1.00 0.00 H new ATOM 10 N SER A 2 32.334 15.846 -4.086 1.00 0.00 N ATOM 11 CA SER A 2 31.782 15.199 -2.880 1.00 0.00 C ATOM 12 C SER A 2 31.799 13.663 -2.951 1.00 0.00 C ATOM 13 O SER A 2 31.730 13.074 -4.035 1.00 0.00 O ATOM 14 CB SER A 2 30.343 15.676 -2.633 1.00 0.00 C ATOM 15 OG SER A 2 30.296 17.092 -2.524 1.00 0.00 O ATOM 0 H SER A 2 31.626 16.328 -4.639 1.00 0.00 H new ATOM 0 HA SER A 2 32.430 15.493 -2.054 1.00 0.00 H new ATOM 0 HB2 SER A 2 29.700 15.347 -3.450 1.00 0.00 H new ATOM 0 HB3 SER A 2 29.956 15.223 -1.720 1.00 0.00 H new ATOM 0 HG SER A 2 29.372 17.378 -2.369 1.00 0.00 H new ATOM 21 N SER A 3 31.852 13.006 -1.786 1.00 0.00 N ATOM 22 CA SER A 3 31.746 11.542 -1.657 1.00 0.00 C ATOM 23 C SER A 3 30.310 11.034 -1.892 1.00 0.00 C ATOM 24 O SER A 3 29.344 11.802 -1.826 1.00 0.00 O ATOM 25 CB SER A 3 32.277 11.106 -0.285 1.00 0.00 C ATOM 26 OG SER A 3 32.483 9.703 -0.252 1.00 0.00 O ATOM 0 H SER A 3 31.971 13.481 -0.891 1.00 0.00 H new ATOM 0 HA SER A 3 32.358 11.089 -2.437 1.00 0.00 H new ATOM 0 HB2 SER A 3 33.213 11.622 -0.071 1.00 0.00 H new ATOM 0 HB3 SER A 3 31.570 11.393 0.493 1.00 0.00 H new ATOM 0 HG SER A 3 32.823 9.443 0.629 1.00 0.00 H new ATOM 32 N GLY A 4 30.158 9.736 -2.165 1.00 0.00 N ATOM 33 CA GLY A 4 28.874 9.083 -2.450 1.00 0.00 C ATOM 34 C GLY A 4 28.962 7.553 -2.521 1.00 0.00 C ATOM 35 O GLY A 4 30.027 6.966 -2.307 1.00 0.00 O ATOM 0 H GLY A 4 30.947 9.090 -2.195 1.00 0.00 H new ATOM 0 HA2 GLY A 4 28.156 9.361 -1.679 1.00 0.00 H new ATOM 0 HA3 GLY A 4 28.487 9.460 -3.397 1.00 0.00 H new ATOM 39 N SER A 5 27.829 6.907 -2.817 1.00 0.00 N ATOM 40 CA SER A 5 27.678 5.441 -2.949 1.00 0.00 C ATOM 41 C SER A 5 28.133 4.625 -1.720 1.00 0.00 C ATOM 42 O SER A 5 28.546 3.468 -1.848 1.00 0.00 O ATOM 43 CB SER A 5 28.311 4.937 -4.258 1.00 0.00 C ATOM 44 OG SER A 5 27.777 5.634 -5.379 1.00 0.00 O ATOM 0 H SER A 5 26.953 7.404 -2.979 1.00 0.00 H new ATOM 0 HA SER A 5 26.604 5.262 -2.995 1.00 0.00 H new ATOM 0 HB2 SER A 5 29.392 5.073 -4.221 1.00 0.00 H new ATOM 0 HB3 SER A 5 28.128 3.868 -4.368 1.00 0.00 H new ATOM 0 HG SER A 5 28.194 5.300 -6.201 1.00 0.00 H new ATOM 50 N SER A 6 28.068 5.218 -0.522 1.00 0.00 N ATOM 51 CA SER A 6 28.476 4.607 0.753 1.00 0.00 C ATOM 52 C SER A 6 27.680 5.172 1.942 1.00 0.00 C ATOM 53 O SER A 6 27.209 6.314 1.903 1.00 0.00 O ATOM 54 CB SER A 6 29.979 4.828 0.967 1.00 0.00 C ATOM 55 OG SER A 6 30.446 4.047 2.057 1.00 0.00 O ATOM 0 H SER A 6 27.718 6.169 -0.407 1.00 0.00 H new ATOM 0 HA SER A 6 28.263 3.539 0.700 1.00 0.00 H new ATOM 0 HB2 SER A 6 30.524 4.562 0.061 1.00 0.00 H new ATOM 0 HB3 SER A 6 30.174 5.883 1.158 1.00 0.00 H new ATOM 0 HG SER A 6 31.407 4.198 2.180 1.00 0.00 H new ATOM 61 N GLY A 7 27.546 4.373 3.006 1.00 0.00 N ATOM 62 CA GLY A 7 26.816 4.696 4.241 1.00 0.00 C ATOM 63 C GLY A 7 25.297 4.427 4.159 1.00 0.00 C ATOM 64 O GLY A 7 24.661 4.815 3.172 1.00 0.00 O ATOM 0 H GLY A 7 27.961 3.442 3.033 1.00 0.00 H new ATOM 0 HA2 GLY A 7 27.234 4.113 5.062 1.00 0.00 H new ATOM 0 HA3 GLY A 7 26.976 5.747 4.482 1.00 0.00 H new ATOM 68 N PRO A 8 24.686 3.776 5.171 1.00 0.00 N ATOM 69 CA PRO A 8 23.245 3.508 5.219 1.00 0.00 C ATOM 70 C PRO A 8 22.428 4.732 5.676 1.00 0.00 C ATOM 71 O PRO A 8 22.969 5.711 6.202 1.00 0.00 O ATOM 72 CB PRO A 8 23.102 2.335 6.196 1.00 0.00 C ATOM 73 CG PRO A 8 24.217 2.602 7.205 1.00 0.00 C ATOM 74 CD PRO A 8 25.334 3.180 6.336 1.00 0.00 C ATOM 0 HA PRO A 8 22.851 3.275 4.230 1.00 0.00 H new ATOM 0 HB2 PRO A 8 22.121 2.321 6.671 1.00 0.00 H new ATOM 0 HB3 PRO A 8 23.229 1.374 5.697 1.00 0.00 H new ATOM 0 HG2 PRO A 8 23.903 3.303 7.978 1.00 0.00 H new ATOM 0 HG3 PRO A 8 24.531 1.689 7.711 1.00 0.00 H new ATOM 0 HD2 PRO A 8 25.906 3.927 6.886 1.00 0.00 H new ATOM 0 HD3 PRO A 8 26.034 2.401 6.034 1.00 0.00 H new ATOM 82 N ILE A 9 21.102 4.655 5.521 1.00 0.00 N ATOM 83 CA ILE A 9 20.149 5.628 6.083 1.00 0.00 C ATOM 84 C ILE A 9 20.069 5.545 7.618 1.00 0.00 C ATOM 85 O ILE A 9 20.208 4.467 8.202 1.00 0.00 O ATOM 86 CB ILE A 9 18.755 5.547 5.427 1.00 0.00 C ATOM 87 CG1 ILE A 9 17.913 4.307 5.790 1.00 0.00 C ATOM 88 CG2 ILE A 9 18.845 5.747 3.903 1.00 0.00 C ATOM 89 CD1 ILE A 9 18.421 2.933 5.331 1.00 0.00 C ATOM 0 H ILE A 9 20.651 3.906 4.995 1.00 0.00 H new ATOM 0 HA ILE A 9 20.546 6.613 5.838 1.00 0.00 H new ATOM 0 HB ILE A 9 18.200 6.376 5.866 1.00 0.00 H new ATOM 0 HG12 ILE A 9 17.809 4.280 6.875 1.00 0.00 H new ATOM 0 HG13 ILE A 9 16.914 4.449 5.377 1.00 0.00 H new ATOM 0 HG21 ILE A 9 17.847 5.685 3.468 1.00 0.00 H new ATOM 0 HG22 ILE A 9 19.273 6.726 3.689 1.00 0.00 H new ATOM 0 HG23 ILE A 9 19.478 4.972 3.471 1.00 0.00 H new ATOM 0 HD11 ILE A 9 17.726 2.160 5.659 1.00 0.00 H new ATOM 0 HD12 ILE A 9 18.495 2.917 4.244 1.00 0.00 H new ATOM 0 HD13 ILE A 9 19.403 2.745 5.764 1.00 0.00 H new ATOM 101 N SER A 10 19.817 6.680 8.279 1.00 0.00 N ATOM 102 CA SER A 10 19.727 6.771 9.749 1.00 0.00 C ATOM 103 C SER A 10 18.425 6.187 10.321 1.00 0.00 C ATOM 104 O SER A 10 18.397 5.742 11.470 1.00 0.00 O ATOM 105 CB SER A 10 19.853 8.235 10.195 1.00 0.00 C ATOM 106 OG SER A 10 21.030 8.838 9.672 1.00 0.00 O ATOM 0 H SER A 10 19.668 7.573 7.808 1.00 0.00 H new ATOM 0 HA SER A 10 20.550 6.172 10.139 1.00 0.00 H new ATOM 0 HB2 SER A 10 18.978 8.794 9.864 1.00 0.00 H new ATOM 0 HB3 SER A 10 19.870 8.285 11.284 1.00 0.00 H new ATOM 0 HG SER A 10 21.081 9.770 9.972 1.00 0.00 H new ATOM 112 N GLU A 11 17.345 6.179 9.533 1.00 0.00 N ATOM 113 CA GLU A 11 16.025 5.638 9.889 1.00 0.00 C ATOM 114 C GLU A 11 15.276 5.161 8.628 1.00 0.00 C ATOM 115 O GLU A 11 15.413 5.758 7.554 1.00 0.00 O ATOM 116 CB GLU A 11 15.226 6.720 10.642 1.00 0.00 C ATOM 117 CG GLU A 11 13.887 6.217 11.198 1.00 0.00 C ATOM 118 CD GLU A 11 13.241 7.275 12.115 1.00 0.00 C ATOM 119 OE1 GLU A 11 12.605 8.228 11.599 1.00 0.00 O ATOM 120 OE2 GLU A 11 13.360 7.161 13.360 1.00 0.00 O ATOM 0 H GLU A 11 17.366 6.565 8.589 1.00 0.00 H new ATOM 0 HA GLU A 11 16.146 4.772 10.540 1.00 0.00 H new ATOM 0 HB2 GLU A 11 15.832 7.101 11.464 1.00 0.00 H new ATOM 0 HB3 GLU A 11 15.039 7.557 9.969 1.00 0.00 H new ATOM 0 HG2 GLU A 11 13.212 5.982 10.375 1.00 0.00 H new ATOM 0 HG3 GLU A 11 14.044 5.293 11.755 1.00 0.00 H new ATOM 127 N ARG A 12 14.474 4.093 8.754 1.00 0.00 N ATOM 128 CA ARG A 12 13.667 3.509 7.666 1.00 0.00 C ATOM 129 C ARG A 12 12.269 3.119 8.166 1.00 0.00 C ATOM 130 O ARG A 12 12.129 2.603 9.276 1.00 0.00 O ATOM 131 CB ARG A 12 14.435 2.309 7.072 1.00 0.00 C ATOM 132 CG ARG A 12 13.895 1.747 5.743 1.00 0.00 C ATOM 133 CD ARG A 12 14.318 2.537 4.492 1.00 0.00 C ATOM 134 NE ARG A 12 13.727 3.890 4.416 1.00 0.00 N ATOM 135 CZ ARG A 12 12.502 4.206 4.035 1.00 0.00 C ATOM 136 NH1 ARG A 12 11.628 3.314 3.679 1.00 0.00 N ATOM 137 NH2 ARG A 12 12.106 5.441 4.041 1.00 0.00 N ATOM 0 H ARG A 12 14.364 3.597 9.638 1.00 0.00 H new ATOM 0 HA ARG A 12 13.512 4.247 6.879 1.00 0.00 H new ATOM 0 HB2 ARG A 12 15.473 2.607 6.922 1.00 0.00 H new ATOM 0 HB3 ARG A 12 14.437 1.505 7.808 1.00 0.00 H new ATOM 0 HG2 ARG A 12 14.232 0.716 5.636 1.00 0.00 H new ATOM 0 HG3 ARG A 12 12.806 1.723 5.790 1.00 0.00 H new ATOM 0 HD2 ARG A 12 15.404 2.623 4.478 1.00 0.00 H new ATOM 0 HD3 ARG A 12 14.031 1.974 3.604 1.00 0.00 H new ATOM 0 HE ARG A 12 14.332 4.665 4.688 1.00 0.00 H new ATOM 0 HH11 ARG A 12 11.877 2.325 3.687 1.00 0.00 H new ATOM 0 HH12 ARG A 12 10.693 3.603 3.392 1.00 0.00 H new ATOM 0 HH21 ARG A 12 12.742 6.179 4.342 1.00 0.00 H new ATOM 0 HH22 ARG A 12 11.158 5.674 3.745 1.00 0.00 H new ATOM 151 N ASN A 13 11.241 3.368 7.354 1.00 0.00 N ATOM 152 CA ASN A 13 9.836 3.110 7.697 1.00 0.00 C ATOM 153 C ASN A 13 9.392 1.675 7.353 1.00 0.00 C ATOM 154 O ASN A 13 9.817 1.106 6.345 1.00 0.00 O ATOM 155 CB ASN A 13 8.945 4.152 6.996 1.00 0.00 C ATOM 156 CG ASN A 13 9.160 5.566 7.513 1.00 0.00 C ATOM 157 OD1 ASN A 13 9.178 5.818 8.710 1.00 0.00 O ATOM 158 ND2 ASN A 13 9.328 6.533 6.642 1.00 0.00 N ATOM 0 H ASN A 13 11.361 3.762 6.421 1.00 0.00 H new ATOM 0 HA ASN A 13 9.730 3.203 8.778 1.00 0.00 H new ATOM 0 HB2 ASN A 13 9.144 4.129 5.925 1.00 0.00 H new ATOM 0 HB3 ASN A 13 7.899 3.877 7.132 1.00 0.00 H new ATOM 0 HD21 ASN A 13 9.473 7.490 6.964 1.00 0.00 H new ATOM 0 HD22 ASN A 13 9.314 6.328 5.643 1.00 0.00 H new ATOM 165 N GLN A 14 8.491 1.124 8.175 1.00 0.00 N ATOM 166 CA GLN A 14 7.769 -0.135 7.920 1.00 0.00 C ATOM 167 C GLN A 14 6.340 -0.087 8.489 1.00 0.00 C ATOM 168 O GLN A 14 5.400 -0.509 7.823 1.00 0.00 O ATOM 169 CB GLN A 14 8.559 -1.320 8.514 1.00 0.00 C ATOM 170 CG GLN A 14 8.054 -2.699 8.040 1.00 0.00 C ATOM 171 CD GLN A 14 8.392 -3.042 6.583 1.00 0.00 C ATOM 172 OE1 GLN A 14 9.164 -2.383 5.901 1.00 0.00 O ATOM 173 NE2 GLN A 14 7.841 -4.108 6.044 1.00 0.00 N ATOM 0 H GLN A 14 8.234 1.553 9.064 1.00 0.00 H new ATOM 0 HA GLN A 14 7.684 -0.272 6.842 1.00 0.00 H new ATOM 0 HB2 GLN A 14 9.610 -1.216 8.246 1.00 0.00 H new ATOM 0 HB3 GLN A 14 8.501 -1.275 9.602 1.00 0.00 H new ATOM 0 HG2 GLN A 14 8.477 -3.467 8.687 1.00 0.00 H new ATOM 0 HG3 GLN A 14 6.972 -2.737 8.166 1.00 0.00 H new ATOM 0 HE21 GLN A 14 7.193 -4.678 6.588 1.00 0.00 H new ATOM 0 HE22 GLN A 14 8.062 -4.365 5.082 1.00 0.00 H new ATOM 182 N ASP A 15 6.146 0.479 9.688 1.00 0.00 N ATOM 183 CA ASP A 15 4.818 0.619 10.311 1.00 0.00 C ATOM 184 C ASP A 15 3.910 1.633 9.596 1.00 0.00 C ATOM 185 O ASP A 15 2.699 1.419 9.517 1.00 0.00 O ATOM 186 CB ASP A 15 4.974 1.002 11.790 1.00 0.00 C ATOM 187 CG ASP A 15 5.295 -0.218 12.661 1.00 0.00 C ATOM 188 OD1 ASP A 15 4.415 -1.104 12.777 1.00 0.00 O ATOM 189 OD2 ASP A 15 6.418 -0.296 13.213 1.00 0.00 O ATOM 0 H ASP A 15 6.906 0.854 10.256 1.00 0.00 H new ATOM 0 HA ASP A 15 4.327 -0.350 10.221 1.00 0.00 H new ATOM 0 HB2 ASP A 15 5.768 1.741 11.893 1.00 0.00 H new ATOM 0 HB3 ASP A 15 4.055 1.470 12.144 1.00 0.00 H new ATOM 194 N ALA A 16 4.488 2.699 9.035 1.00 0.00 N ATOM 195 CA ALA A 16 3.805 3.659 8.165 1.00 0.00 C ATOM 196 C ALA A 16 3.788 3.226 6.682 1.00 0.00 C ATOM 197 O ALA A 16 3.328 3.975 5.821 1.00 0.00 O ATOM 198 CB ALA A 16 4.432 5.042 8.379 1.00 0.00 C ATOM 0 H ALA A 16 5.473 2.924 9.178 1.00 0.00 H new ATOM 0 HA ALA A 16 2.751 3.700 8.441 1.00 0.00 H new ATOM 0 HB1 ALA A 16 3.935 5.770 7.738 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.315 5.337 9.422 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.492 5.003 8.129 1.00 0.00 H new ATOM 204 N THR A 17 4.270 2.021 6.366 1.00 0.00 N ATOM 205 CA THR A 17 4.182 1.419 5.029 1.00 0.00 C ATOM 206 C THR A 17 3.018 0.427 5.000 1.00 0.00 C ATOM 207 O THR A 17 2.820 -0.342 5.942 1.00 0.00 O ATOM 208 CB THR A 17 5.518 0.776 4.603 1.00 0.00 C ATOM 209 OG1 THR A 17 6.575 1.687 4.816 1.00 0.00 O ATOM 210 CG2 THR A 17 5.570 0.395 3.118 1.00 0.00 C ATOM 0 H THR A 17 4.742 1.423 7.044 1.00 0.00 H new ATOM 0 HA THR A 17 3.985 2.201 4.295 1.00 0.00 H new ATOM 0 HB THR A 17 5.611 -0.128 5.204 1.00 0.00 H new ATOM 0 HG1 THR A 17 7.422 1.274 4.546 1.00 0.00 H new ATOM 0 HG21 THR A 17 6.538 -0.051 2.891 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.779 -0.322 2.899 1.00 0.00 H new ATOM 0 HG23 THR A 17 5.430 1.288 2.508 1.00 0.00 H new ATOM 218 N VAL A 18 2.235 0.432 3.922 1.00 0.00 N ATOM 219 CA VAL A 18 1.163 -0.542 3.661 1.00 0.00 C ATOM 220 C VAL A 18 1.594 -1.527 2.578 1.00 0.00 C ATOM 221 O VAL A 18 2.343 -1.169 1.670 1.00 0.00 O ATOM 222 CB VAL A 18 -0.191 0.122 3.324 1.00 0.00 C ATOM 223 CG1 VAL A 18 -0.594 1.127 4.407 1.00 0.00 C ATOM 224 CG2 VAL A 18 -0.217 0.864 1.988 1.00 0.00 C ATOM 0 H VAL A 18 2.327 1.130 3.184 1.00 0.00 H new ATOM 0 HA VAL A 18 0.997 -1.092 4.587 1.00 0.00 H new ATOM 0 HB VAL A 18 -0.890 -0.713 3.264 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.550 1.580 4.145 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.685 0.613 5.364 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.167 1.904 4.483 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -1.204 1.299 1.832 1.00 0.00 H new ATOM 0 HG22 VAL A 18 0.531 1.657 1.997 1.00 0.00 H new ATOM 0 HG23 VAL A 18 0.004 0.166 1.180 1.00 0.00 H new ATOM 234 N TYR A 19 1.102 -2.758 2.667 1.00 0.00 N ATOM 235 CA TYR A 19 1.198 -3.802 1.650 1.00 0.00 C ATOM 236 C TYR A 19 -0.076 -3.799 0.795 1.00 0.00 C ATOM 237 O TYR A 19 -1.173 -3.627 1.329 1.00 0.00 O ATOM 238 CB TYR A 19 1.390 -5.155 2.353 1.00 0.00 C ATOM 239 CG TYR A 19 1.174 -6.371 1.467 1.00 0.00 C ATOM 240 CD1 TYR A 19 2.242 -6.910 0.726 1.00 0.00 C ATOM 241 CD2 TYR A 19 -0.108 -6.951 1.373 1.00 0.00 C ATOM 242 CE1 TYR A 19 2.036 -8.033 -0.099 1.00 0.00 C ATOM 243 CE2 TYR A 19 -0.322 -8.065 0.538 1.00 0.00 C ATOM 244 CZ TYR A 19 0.751 -8.611 -0.201 1.00 0.00 C ATOM 245 OH TYR A 19 0.540 -9.692 -0.999 1.00 0.00 O ATOM 0 H TYR A 19 0.598 -3.073 3.496 1.00 0.00 H new ATOM 0 HA TYR A 19 2.048 -3.621 0.992 1.00 0.00 H new ATOM 0 HB2 TYR A 19 2.400 -5.196 2.762 1.00 0.00 H new ATOM 0 HB3 TYR A 19 0.702 -5.211 3.197 1.00 0.00 H new ATOM 0 HD1 TYR A 19 3.222 -6.461 0.790 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -0.928 -6.540 1.943 1.00 0.00 H new ATOM 0 HE1 TYR A 19 2.862 -8.453 -0.654 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -1.307 -8.502 0.463 1.00 0.00 H new ATOM 0 HH TYR A 19 -0.402 -9.958 -0.947 1.00 0.00 H new ATOM 255 N VAL A 20 0.062 -4.026 -0.513 1.00 0.00 N ATOM 256 CA VAL A 20 -1.037 -4.147 -1.482 1.00 0.00 C ATOM 257 C VAL A 20 -0.819 -5.398 -2.335 1.00 0.00 C ATOM 258 O VAL A 20 0.088 -5.432 -3.164 1.00 0.00 O ATOM 259 CB VAL A 20 -1.140 -2.902 -2.389 1.00 0.00 C ATOM 260 CG1 VAL A 20 -2.409 -2.992 -3.248 1.00 0.00 C ATOM 261 CG2 VAL A 20 -1.174 -1.582 -1.606 1.00 0.00 C ATOM 0 H VAL A 20 0.979 -4.135 -0.947 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.973 -4.228 -0.929 1.00 0.00 H new ATOM 0 HB VAL A 20 -0.242 -2.896 -3.007 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.479 -2.112 -3.887 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -2.366 -3.888 -3.868 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -3.284 -3.040 -2.600 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.247 -0.747 -2.303 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -2.037 -1.576 -0.941 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -0.262 -1.485 -1.017 1.00 0.00 H new ATOM 271 N GLY A 21 -1.647 -6.426 -2.152 1.00 0.00 N ATOM 272 CA GLY A 21 -1.611 -7.669 -2.930 1.00 0.00 C ATOM 273 C GLY A 21 -2.753 -7.765 -3.943 1.00 0.00 C ATOM 274 O GLY A 21 -3.853 -7.279 -3.682 1.00 0.00 O ATOM 0 H GLY A 21 -2.380 -6.420 -1.442 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -0.658 -7.736 -3.455 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -1.661 -8.520 -2.250 1.00 0.00 H new ATOM 278 N GLY A 22 -2.504 -8.417 -5.081 1.00 0.00 N ATOM 279 CA GLY A 22 -3.511 -8.722 -6.112 1.00 0.00 C ATOM 280 C GLY A 22 -3.553 -7.715 -7.269 1.00 0.00 C ATOM 281 O GLY A 22 -4.617 -7.458 -7.831 1.00 0.00 O ATOM 0 H GLY A 22 -1.573 -8.758 -5.322 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -3.311 -9.714 -6.516 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.494 -8.761 -5.643 1.00 0.00 H new ATOM 285 N LEU A 23 -2.409 -7.118 -7.608 1.00 0.00 N ATOM 286 CA LEU A 23 -2.275 -6.021 -8.563 1.00 0.00 C ATOM 287 C LEU A 23 -2.441 -6.506 -10.005 1.00 0.00 C ATOM 288 O LEU A 23 -2.097 -7.641 -10.342 1.00 0.00 O ATOM 289 CB LEU A 23 -0.905 -5.343 -8.376 1.00 0.00 C ATOM 290 CG LEU A 23 -0.675 -4.694 -7.002 1.00 0.00 C ATOM 291 CD1 LEU A 23 0.712 -4.062 -6.977 1.00 0.00 C ATOM 292 CD2 LEU A 23 -1.713 -3.616 -6.695 1.00 0.00 C ATOM 0 H LEU A 23 -1.514 -7.399 -7.207 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.068 -5.299 -8.371 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -0.125 -6.085 -8.544 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.788 -4.579 -9.144 1.00 0.00 H new ATOM 0 HG LEU A 23 -0.765 -5.474 -6.246 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.883 -3.599 -6.005 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.465 -4.831 -7.151 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.781 -3.304 -7.757 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -1.511 -3.185 -5.714 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.661 -2.834 -7.453 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.709 -4.058 -6.699 1.00 0.00 H new ATOM 304 N ASP A 24 -2.941 -5.627 -10.868 1.00 0.00 N ATOM 305 CA ASP A 24 -3.082 -5.884 -12.301 1.00 0.00 C ATOM 306 C ASP A 24 -1.824 -5.465 -13.089 1.00 0.00 C ATOM 307 O ASP A 24 -1.066 -4.598 -12.655 1.00 0.00 O ATOM 308 CB ASP A 24 -4.350 -5.175 -12.801 1.00 0.00 C ATOM 309 CG ASP A 24 -4.583 -5.389 -14.298 1.00 0.00 C ATOM 310 OD1 ASP A 24 -5.176 -6.422 -14.680 1.00 0.00 O ATOM 311 OD2 ASP A 24 -4.145 -4.530 -15.097 1.00 0.00 O ATOM 0 H ASP A 24 -3.265 -4.701 -10.589 1.00 0.00 H new ATOM 0 HA ASP A 24 -3.184 -6.956 -12.470 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -5.212 -5.543 -12.245 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.271 -4.107 -12.597 1.00 0.00 H new ATOM 316 N GLU A 25 -1.591 -6.045 -14.270 1.00 0.00 N ATOM 317 CA GLU A 25 -0.426 -5.740 -15.121 1.00 0.00 C ATOM 318 C GLU A 25 -0.303 -4.259 -15.546 1.00 0.00 C ATOM 319 O GLU A 25 0.799 -3.812 -15.877 1.00 0.00 O ATOM 320 CB GLU A 25 -0.419 -6.674 -16.345 1.00 0.00 C ATOM 321 CG GLU A 25 -1.599 -6.462 -17.308 1.00 0.00 C ATOM 322 CD GLU A 25 -1.514 -7.437 -18.499 1.00 0.00 C ATOM 323 OE1 GLU A 25 -0.933 -7.071 -19.551 1.00 0.00 O ATOM 324 OE2 GLU A 25 -2.032 -8.576 -18.398 1.00 0.00 O ATOM 0 H GLU A 25 -2.211 -6.749 -14.671 1.00 0.00 H new ATOM 0 HA GLU A 25 0.455 -5.921 -14.506 1.00 0.00 H new ATOM 0 HB2 GLU A 25 0.512 -6.530 -16.893 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -0.428 -7.708 -15.999 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -2.539 -6.610 -16.777 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -1.597 -5.435 -17.672 1.00 0.00 H new ATOM 331 N LYS A 26 -1.395 -3.480 -15.497 1.00 0.00 N ATOM 332 CA LYS A 26 -1.405 -2.030 -15.773 1.00 0.00 C ATOM 333 C LYS A 26 -0.953 -1.159 -14.585 1.00 0.00 C ATOM 334 O LYS A 26 -0.712 0.035 -14.768 1.00 0.00 O ATOM 335 CB LYS A 26 -2.801 -1.616 -16.271 1.00 0.00 C ATOM 336 CG LYS A 26 -3.137 -2.271 -17.623 1.00 0.00 C ATOM 337 CD LYS A 26 -4.503 -1.841 -18.180 1.00 0.00 C ATOM 338 CE LYS A 26 -5.708 -2.226 -17.308 1.00 0.00 C ATOM 339 NZ LYS A 26 -5.823 -3.695 -17.117 1.00 0.00 N ATOM 0 H LYS A 26 -2.317 -3.846 -15.259 1.00 0.00 H new ATOM 0 HA LYS A 26 -0.662 -1.849 -16.550 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -3.551 -1.900 -15.532 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.846 -0.531 -16.370 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -2.361 -2.017 -18.345 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -3.123 -3.355 -17.508 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -4.500 -0.759 -18.313 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -4.632 -2.283 -19.168 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.619 -1.742 -16.336 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -6.621 -1.850 -17.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -6.826 -3.956 -17.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -5.406 -4.185 -17.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -5.317 -3.973 -16.252 1.00 0.00 H new ATOM 353 N VAL A 27 -0.819 -1.725 -13.381 1.00 0.00 N ATOM 354 CA VAL A 27 -0.378 -1.009 -12.167 1.00 0.00 C ATOM 355 C VAL A 27 1.119 -0.672 -12.221 1.00 0.00 C ATOM 356 O VAL A 27 1.932 -1.491 -12.654 1.00 0.00 O ATOM 357 CB VAL A 27 -0.718 -1.812 -10.892 1.00 0.00 C ATOM 358 CG1 VAL A 27 -0.258 -1.106 -9.612 1.00 0.00 C ATOM 359 CG2 VAL A 27 -2.233 -2.035 -10.772 1.00 0.00 C ATOM 0 H VAL A 27 -1.016 -2.712 -13.214 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.925 -0.067 -12.129 1.00 0.00 H new ATOM 0 HB VAL A 27 -0.189 -2.760 -10.992 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -0.522 -1.714 -8.746 1.00 0.00 H new ATOM 0 HG12 VAL A 27 0.823 -0.967 -9.642 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -0.747 -0.135 -9.536 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.447 -2.603 -9.866 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.740 -1.071 -10.724 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.589 -2.590 -11.640 1.00 0.00 H new ATOM 369 N SER A 28 1.485 0.520 -11.738 1.00 0.00 N ATOM 370 CA SER A 28 2.873 0.991 -11.604 1.00 0.00 C ATOM 371 C SER A 28 3.128 1.664 -10.247 1.00 0.00 C ATOM 372 O SER A 28 2.194 2.086 -9.564 1.00 0.00 O ATOM 373 CB SER A 28 3.195 1.952 -12.755 1.00 0.00 C ATOM 374 OG SER A 28 2.435 3.147 -12.639 1.00 0.00 O ATOM 0 H SER A 28 0.803 1.208 -11.418 1.00 0.00 H new ATOM 0 HA SER A 28 3.533 0.125 -11.653 1.00 0.00 H new ATOM 0 HB2 SER A 28 4.259 2.190 -12.750 1.00 0.00 H new ATOM 0 HB3 SER A 28 2.981 1.470 -13.709 1.00 0.00 H new ATOM 0 HG SER A 28 2.655 3.748 -13.381 1.00 0.00 H new ATOM 380 N GLU A 29 4.392 1.808 -9.841 1.00 0.00 N ATOM 381 CA GLU A 29 4.742 2.489 -8.583 1.00 0.00 C ATOM 382 C GLU A 29 4.268 3.960 -8.524 1.00 0.00 C ATOM 383 O GLU A 29 3.749 4.356 -7.477 1.00 0.00 O ATOM 384 CB GLU A 29 6.264 2.397 -8.342 1.00 0.00 C ATOM 385 CG GLU A 29 6.653 1.139 -7.558 1.00 0.00 C ATOM 386 CD GLU A 29 7.962 0.495 -8.059 1.00 0.00 C ATOM 387 OE1 GLU A 29 8.066 0.172 -9.267 1.00 0.00 O ATOM 388 OE2 GLU A 29 8.871 0.236 -7.236 1.00 0.00 O ATOM 0 H GLU A 29 5.196 1.462 -10.365 1.00 0.00 H new ATOM 0 HA GLU A 29 4.209 1.971 -7.786 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.782 2.400 -9.301 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.597 3.280 -7.797 1.00 0.00 H new ATOM 0 HG2 GLU A 29 6.761 1.394 -6.504 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.846 0.410 -7.629 1.00 0.00 H new ATOM 395 N PRO A 30 4.347 4.766 -9.607 1.00 0.00 N ATOM 396 CA PRO A 30 3.725 6.089 -9.650 1.00 0.00 C ATOM 397 C PRO A 30 2.196 6.064 -9.504 1.00 0.00 C ATOM 398 O PRO A 30 1.633 6.994 -8.922 1.00 0.00 O ATOM 399 CB PRO A 30 4.140 6.703 -10.992 1.00 0.00 C ATOM 400 CG PRO A 30 5.465 6.008 -11.294 1.00 0.00 C ATOM 401 CD PRO A 30 5.213 4.600 -10.767 1.00 0.00 C ATOM 0 HA PRO A 30 4.064 6.679 -8.799 1.00 0.00 H new ATOM 0 HB2 PRO A 30 3.399 6.514 -11.769 1.00 0.00 H new ATOM 0 HB3 PRO A 30 4.259 7.784 -10.921 1.00 0.00 H new ATOM 0 HG2 PRO A 30 5.693 6.010 -12.360 1.00 0.00 H new ATOM 0 HG3 PRO A 30 6.302 6.489 -10.788 1.00 0.00 H new ATOM 0 HD2 PRO A 30 4.738 3.977 -11.525 1.00 0.00 H new ATOM 0 HD3 PRO A 30 6.148 4.111 -10.492 1.00 0.00 H new ATOM 409 N LEU A 31 1.513 5.004 -9.965 1.00 0.00 N ATOM 410 CA LEU A 31 0.071 4.852 -9.746 1.00 0.00 C ATOM 411 C LEU A 31 -0.207 4.613 -8.264 1.00 0.00 C ATOM 412 O LEU A 31 -1.016 5.322 -7.674 1.00 0.00 O ATOM 413 CB LEU A 31 -0.494 3.699 -10.596 1.00 0.00 C ATOM 414 CG LEU A 31 -2.019 3.528 -10.451 1.00 0.00 C ATOM 415 CD1 LEU A 31 -2.766 4.642 -11.173 1.00 0.00 C ATOM 416 CD2 LEU A 31 -2.423 2.191 -11.059 1.00 0.00 C ATOM 0 H LEU A 31 1.939 4.241 -10.491 1.00 0.00 H new ATOM 0 HA LEU A 31 -0.427 5.771 -10.055 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.253 3.877 -11.644 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -0.002 2.770 -10.309 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.275 3.567 -9.392 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.840 4.496 -11.054 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -2.481 5.605 -10.749 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.512 4.623 -12.233 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.501 2.058 -10.963 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.148 2.173 -12.114 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.910 1.384 -10.536 1.00 0.00 H new ATOM 428 N LEU A 32 0.495 3.657 -7.648 1.00 0.00 N ATOM 429 CA LEU A 32 0.337 3.358 -6.222 1.00 0.00 C ATOM 430 C LEU A 32 0.682 4.545 -5.321 1.00 0.00 C ATOM 431 O LEU A 32 0.197 4.620 -4.199 1.00 0.00 O ATOM 432 CB LEU A 32 1.210 2.164 -5.817 1.00 0.00 C ATOM 433 CG LEU A 32 0.908 0.842 -6.520 1.00 0.00 C ATOM 434 CD1 LEU A 32 1.607 -0.281 -5.763 1.00 0.00 C ATOM 435 CD2 LEU A 32 -0.584 0.528 -6.536 1.00 0.00 C ATOM 0 H LEU A 32 1.184 3.072 -8.120 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.718 3.123 -6.082 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.252 2.422 -6.004 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.107 2.013 -4.742 1.00 0.00 H new ATOM 0 HG LEU A 32 1.258 0.926 -7.549 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.401 -1.233 -6.253 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.682 -0.101 -5.756 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.238 -0.313 -4.738 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.751 -0.421 -7.046 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.952 0.460 -5.512 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.117 1.321 -7.061 1.00 0.00 H new ATOM 447 N TRP A 33 1.489 5.483 -5.805 1.00 0.00 N ATOM 448 CA TRP A 33 1.736 6.750 -5.127 1.00 0.00 C ATOM 449 C TRP A 33 0.524 7.679 -5.241 1.00 0.00 C ATOM 450 O TRP A 33 -0.149 7.961 -4.250 1.00 0.00 O ATOM 451 CB TRP A 33 3.017 7.372 -5.689 1.00 0.00 C ATOM 452 CG TRP A 33 3.673 8.439 -4.874 1.00 0.00 C ATOM 453 CD1 TRP A 33 3.085 9.486 -4.247 1.00 0.00 C ATOM 454 CD2 TRP A 33 5.098 8.571 -4.615 1.00 0.00 C ATOM 455 NE1 TRP A 33 4.053 10.243 -3.609 1.00 0.00 N ATOM 456 CE2 TRP A 33 5.317 9.732 -3.820 1.00 0.00 C ATOM 457 CE3 TRP A 33 6.224 7.815 -4.996 1.00 0.00 C ATOM 458 CZ2 TRP A 33 6.602 10.133 -3.427 1.00 0.00 C ATOM 459 CZ3 TRP A 33 7.521 8.210 -4.614 1.00 0.00 C ATOM 460 CH2 TRP A 33 7.711 9.367 -3.835 1.00 0.00 C ATOM 0 H TRP A 33 1.994 5.384 -6.686 1.00 0.00 H new ATOM 0 HA TRP A 33 1.882 6.581 -4.060 1.00 0.00 H new ATOM 0 HB2 TRP A 33 3.741 6.572 -5.844 1.00 0.00 H new ATOM 0 HB3 TRP A 33 2.788 7.789 -6.670 1.00 0.00 H new ATOM 0 HD1 TRP A 33 2.026 9.697 -4.245 1.00 0.00 H new ATOM 0 HE1 TRP A 33 3.856 11.075 -3.052 1.00 0.00 H new ATOM 0 HE3 TRP A 33 6.091 6.922 -5.588 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 6.739 11.016 -2.821 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 8.374 7.622 -4.920 1.00 0.00 H new ATOM 0 HH2 TRP A 33 8.708 9.668 -3.550 1.00 0.00 H new ATOM 471 N GLU A 34 0.216 8.136 -6.456 1.00 0.00 N ATOM 472 CA GLU A 34 -0.813 9.159 -6.706 1.00 0.00 C ATOM 473 C GLU A 34 -2.241 8.716 -6.353 1.00 0.00 C ATOM 474 O GLU A 34 -3.053 9.539 -5.927 1.00 0.00 O ATOM 475 CB GLU A 34 -0.755 9.613 -8.172 1.00 0.00 C ATOM 476 CG GLU A 34 0.550 10.352 -8.476 1.00 0.00 C ATOM 477 CD GLU A 34 0.488 11.054 -9.848 1.00 0.00 C ATOM 478 OE1 GLU A 34 0.834 10.427 -10.879 1.00 0.00 O ATOM 479 OE2 GLU A 34 0.098 12.246 -9.906 1.00 0.00 O ATOM 0 H GLU A 34 0.675 7.806 -7.305 1.00 0.00 H new ATOM 0 HA GLU A 34 -0.581 9.988 -6.037 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -0.845 8.746 -8.827 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.602 10.264 -8.387 1.00 0.00 H new ATOM 0 HG2 GLU A 34 0.744 11.089 -7.696 1.00 0.00 H new ATOM 0 HG3 GLU A 34 1.381 9.647 -8.463 1.00 0.00 H new ATOM 486 N LEU A 35 -2.546 7.421 -6.466 1.00 0.00 N ATOM 487 CA LEU A 35 -3.841 6.851 -6.076 1.00 0.00 C ATOM 488 C LEU A 35 -4.038 6.863 -4.547 1.00 0.00 C ATOM 489 O LEU A 35 -5.162 7.024 -4.071 1.00 0.00 O ATOM 490 CB LEU A 35 -3.939 5.411 -6.623 1.00 0.00 C ATOM 491 CG LEU A 35 -5.372 4.871 -6.718 1.00 0.00 C ATOM 492 CD1 LEU A 35 -6.096 5.391 -7.960 1.00 0.00 C ATOM 493 CD2 LEU A 35 -5.356 3.345 -6.749 1.00 0.00 C ATOM 0 H LEU A 35 -1.894 6.729 -6.835 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.633 7.466 -6.502 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -3.484 5.379 -7.613 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -3.355 4.750 -5.982 1.00 0.00 H new ATOM 0 HG LEU A 35 -5.910 5.222 -5.837 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.107 4.985 -7.989 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.143 6.479 -7.925 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.555 5.080 -8.854 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.378 2.972 -6.816 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.787 3.005 -7.614 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -4.891 2.967 -5.838 1.00 0.00 H new ATOM 505 N PHE A 36 -2.961 6.712 -3.773 1.00 0.00 N ATOM 506 CA PHE A 36 -2.980 6.599 -2.309 1.00 0.00 C ATOM 507 C PHE A 36 -2.841 7.953 -1.592 1.00 0.00 C ATOM 508 O PHE A 36 -3.144 8.039 -0.401 1.00 0.00 O ATOM 509 CB PHE A 36 -1.906 5.595 -1.876 1.00 0.00 C ATOM 510 CG PHE A 36 -2.321 4.130 -1.972 1.00 0.00 C ATOM 511 CD1 PHE A 36 -2.507 3.509 -3.223 1.00 0.00 C ATOM 512 CD2 PHE A 36 -2.510 3.372 -0.799 1.00 0.00 C ATOM 513 CE1 PHE A 36 -2.893 2.158 -3.304 1.00 0.00 C ATOM 514 CE2 PHE A 36 -2.910 2.024 -0.875 1.00 0.00 C ATOM 515 CZ PHE A 36 -3.112 1.420 -2.128 1.00 0.00 C ATOM 0 H PHE A 36 -2.018 6.663 -4.159 1.00 0.00 H new ATOM 0 HA PHE A 36 -3.960 6.231 -2.006 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -1.018 5.747 -2.490 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -1.622 5.810 -0.846 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -2.352 4.076 -4.129 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -2.347 3.829 0.166 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -3.021 1.689 -4.268 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.062 1.454 0.030 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.435 0.391 -2.187 1.00 0.00 H new ATOM 525 N LEU A 37 -2.502 9.031 -2.312 1.00 0.00 N ATOM 526 CA LEU A 37 -2.550 10.418 -1.812 1.00 0.00 C ATOM 527 C LEU A 37 -3.930 10.837 -1.256 1.00 0.00 C ATOM 528 O LEU A 37 -4.030 11.791 -0.483 1.00 0.00 O ATOM 529 CB LEU A 37 -2.123 11.376 -2.940 1.00 0.00 C ATOM 530 CG LEU A 37 -0.626 11.371 -3.290 1.00 0.00 C ATOM 531 CD1 LEU A 37 -0.354 12.370 -4.414 1.00 0.00 C ATOM 532 CD2 LEU A 37 0.242 11.763 -2.095 1.00 0.00 C ATOM 0 H LEU A 37 -2.180 8.966 -3.278 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.860 10.474 -0.970 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.688 11.125 -3.838 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.408 12.390 -2.658 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.373 10.356 -3.595 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.708 12.363 -4.658 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.931 12.092 -5.296 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.645 13.369 -4.091 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.292 11.746 -2.387 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.027 12.766 -1.764 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.081 11.057 -1.281 1.00 0.00 H new ATOM 544 N GLN A 38 -4.987 10.104 -1.616 1.00 0.00 N ATOM 545 CA GLN A 38 -6.351 10.257 -1.084 1.00 0.00 C ATOM 546 C GLN A 38 -6.445 9.926 0.415 1.00 0.00 C ATOM 547 O GLN A 38 -7.241 10.535 1.135 1.00 0.00 O ATOM 548 CB GLN A 38 -7.318 9.338 -1.851 1.00 0.00 C ATOM 549 CG GLN A 38 -7.259 9.559 -3.365 1.00 0.00 C ATOM 550 CD GLN A 38 -8.293 8.716 -4.107 1.00 0.00 C ATOM 551 OE1 GLN A 38 -9.436 9.109 -4.309 1.00 0.00 O ATOM 552 NE2 GLN A 38 -7.938 7.523 -4.529 1.00 0.00 N ATOM 0 H GLN A 38 -4.918 9.360 -2.310 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.622 11.305 -1.215 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -7.079 8.298 -1.629 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -8.335 9.513 -1.501 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -7.426 10.614 -3.584 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -6.262 9.312 -3.729 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -6.989 7.186 -4.366 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -8.611 6.934 -5.019 1.00 0.00 H new ATOM 561 N ALA A 39 -5.635 8.973 0.890 1.00 0.00 N ATOM 562 CA ALA A 39 -5.578 8.589 2.303 1.00 0.00 C ATOM 563 C ALA A 39 -4.747 9.568 3.149 1.00 0.00 C ATOM 564 O ALA A 39 -5.169 9.973 4.234 1.00 0.00 O ATOM 565 CB ALA A 39 -5.004 7.176 2.400 1.00 0.00 C ATOM 0 H ALA A 39 -4.995 8.443 0.298 1.00 0.00 H new ATOM 0 HA ALA A 39 -6.590 8.619 2.707 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.955 6.874 3.446 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.645 6.485 1.853 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.002 7.160 1.970 1.00 0.00 H new ATOM 571 N GLY A 40 -3.575 9.956 2.642 1.00 0.00 N ATOM 572 CA GLY A 40 -2.655 10.891 3.292 1.00 0.00 C ATOM 573 C GLY A 40 -1.378 11.139 2.478 1.00 0.00 C ATOM 574 O GLY A 40 -1.272 10.673 1.341 1.00 0.00 O ATOM 0 H GLY A 40 -3.230 9.619 1.743 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.165 11.840 3.455 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.384 10.502 4.274 1.00 0.00 H new ATOM 578 N PRO A 41 -0.389 11.862 3.033 1.00 0.00 N ATOM 579 CA PRO A 41 0.864 12.178 2.351 1.00 0.00 C ATOM 580 C PRO A 41 1.718 10.921 2.124 1.00 0.00 C ATOM 581 O PRO A 41 2.259 10.332 3.067 1.00 0.00 O ATOM 582 CB PRO A 41 1.558 13.218 3.241 1.00 0.00 C ATOM 583 CG PRO A 41 1.003 12.923 4.633 1.00 0.00 C ATOM 584 CD PRO A 41 -0.428 12.474 4.349 1.00 0.00 C ATOM 0 HA PRO A 41 0.696 12.575 1.350 1.00 0.00 H new ATOM 0 HB2 PRO A 41 2.642 13.113 3.211 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.328 14.235 2.924 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.576 12.146 5.139 1.00 0.00 H new ATOM 0 HG3 PRO A 41 1.029 13.805 5.272 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -0.773 11.765 5.101 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -1.116 13.319 4.368 1.00 0.00 H new ATOM 592 N VAL A 42 1.852 10.524 0.855 1.00 0.00 N ATOM 593 CA VAL A 42 2.720 9.425 0.405 1.00 0.00 C ATOM 594 C VAL A 42 4.137 9.949 0.159 1.00 0.00 C ATOM 595 O VAL A 42 4.335 10.993 -0.468 1.00 0.00 O ATOM 596 CB VAL A 42 2.161 8.720 -0.848 1.00 0.00 C ATOM 597 CG1 VAL A 42 3.084 7.584 -1.308 1.00 0.00 C ATOM 598 CG2 VAL A 42 0.774 8.116 -0.595 1.00 0.00 C ATOM 0 H VAL A 42 1.347 10.969 0.089 1.00 0.00 H new ATOM 0 HA VAL A 42 2.752 8.675 1.196 1.00 0.00 H new ATOM 0 HB VAL A 42 2.093 9.489 -1.617 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.662 7.108 -2.193 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.067 7.989 -1.548 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.180 6.847 -0.510 1.00 0.00 H new ATOM 0 HG21 VAL A 42 0.418 7.629 -1.503 1.00 0.00 H new ATOM 0 HG22 VAL A 42 0.838 7.382 0.209 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.079 8.906 -0.311 1.00 0.00 H new ATOM 608 N VAL A 43 5.119 9.205 0.660 1.00 0.00 N ATOM 609 CA VAL A 43 6.547 9.561 0.723 1.00 0.00 C ATOM 610 C VAL A 43 7.389 8.729 -0.252 1.00 0.00 C ATOM 611 O VAL A 43 8.396 9.214 -0.768 1.00 0.00 O ATOM 612 CB VAL A 43 7.065 9.357 2.166 1.00 0.00 C ATOM 613 CG1 VAL A 43 8.436 9.998 2.403 1.00 0.00 C ATOM 614 CG2 VAL A 43 6.122 9.957 3.215 1.00 0.00 C ATOM 0 H VAL A 43 4.937 8.283 1.057 1.00 0.00 H new ATOM 0 HA VAL A 43 6.645 10.607 0.432 1.00 0.00 H new ATOM 0 HB VAL A 43 7.128 8.274 2.274 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.747 9.822 3.433 1.00 0.00 H new ATOM 0 HG12 VAL A 43 9.166 9.558 1.723 1.00 0.00 H new ATOM 0 HG13 VAL A 43 8.372 11.071 2.222 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.531 9.787 4.211 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.020 11.028 3.042 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.144 9.483 3.139 1.00 0.00 H new ATOM 624 N ASN A 44 6.998 7.468 -0.477 1.00 0.00 N ATOM 625 CA ASN A 44 7.712 6.477 -1.292 1.00 0.00 C ATOM 626 C ASN A 44 6.769 5.319 -1.723 1.00 0.00 C ATOM 627 O ASN A 44 5.730 5.092 -1.100 1.00 0.00 O ATOM 628 CB ASN A 44 8.923 6.013 -0.449 1.00 0.00 C ATOM 629 CG ASN A 44 9.689 4.832 -1.010 1.00 0.00 C ATOM 630 OD1 ASN A 44 10.083 4.814 -2.167 1.00 0.00 O ATOM 631 ND2 ASN A 44 9.925 3.820 -0.207 1.00 0.00 N ATOM 0 H ASN A 44 6.137 7.094 -0.078 1.00 0.00 H new ATOM 0 HA ASN A 44 8.066 6.900 -2.232 1.00 0.00 H new ATOM 0 HB2 ASN A 44 9.611 6.852 -0.339 1.00 0.00 H new ATOM 0 HB3 ASN A 44 8.572 5.755 0.550 1.00 0.00 H new ATOM 0 HD21 ASN A 44 10.442 3.009 -0.547 1.00 0.00 H new ATOM 0 HD22 ASN A 44 9.592 3.845 0.757 1.00 0.00 H new ATOM 638 N THR A 45 7.142 4.556 -2.754 1.00 0.00 N ATOM 639 CA THR A 45 6.476 3.311 -3.199 1.00 0.00 C ATOM 640 C THR A 45 7.489 2.223 -3.569 1.00 0.00 C ATOM 641 O THR A 45 8.629 2.519 -3.934 1.00 0.00 O ATOM 642 CB THR A 45 5.545 3.522 -4.407 1.00 0.00 C ATOM 643 OG1 THR A 45 6.095 4.380 -5.379 1.00 0.00 O ATOM 644 CG2 THR A 45 4.190 4.084 -4.011 1.00 0.00 C ATOM 0 H THR A 45 7.949 4.792 -3.331 1.00 0.00 H new ATOM 0 HA THR A 45 5.879 2.995 -2.344 1.00 0.00 H new ATOM 0 HB THR A 45 5.422 2.524 -4.828 1.00 0.00 H new ATOM 0 HG1 THR A 45 5.465 4.477 -6.124 1.00 0.00 H new ATOM 0 HG21 THR A 45 3.575 4.212 -4.902 1.00 0.00 H new ATOM 0 HG22 THR A 45 3.697 3.395 -3.326 1.00 0.00 H new ATOM 0 HG23 THR A 45 4.325 5.048 -3.521 1.00 0.00 H new ATOM 652 N HIS A 46 7.081 0.949 -3.490 1.00 0.00 N ATOM 653 CA HIS A 46 7.900 -0.198 -3.897 1.00 0.00 C ATOM 654 C HIS A 46 7.046 -1.278 -4.568 1.00 0.00 C ATOM 655 O HIS A 46 5.996 -1.636 -4.043 1.00 0.00 O ATOM 656 CB HIS A 46 8.626 -0.774 -2.668 1.00 0.00 C ATOM 657 CG HIS A 46 9.811 -1.623 -3.052 1.00 0.00 C ATOM 658 ND1 HIS A 46 9.750 -2.950 -3.487 1.00 0.00 N ATOM 659 CD2 HIS A 46 11.109 -1.206 -3.086 1.00 0.00 C ATOM 660 CE1 HIS A 46 11.016 -3.305 -3.765 1.00 0.00 C ATOM 661 NE2 HIS A 46 11.853 -2.278 -3.533 1.00 0.00 N ATOM 0 H HIS A 46 6.161 0.684 -3.137 1.00 0.00 H new ATOM 0 HA HIS A 46 8.636 0.142 -4.626 1.00 0.00 H new ATOM 0 HB2 HIS A 46 8.959 0.044 -2.029 1.00 0.00 H new ATOM 0 HB3 HIS A 46 7.927 -1.372 -2.083 1.00 0.00 H new ATOM 0 HD2 HIS A 46 11.481 -0.229 -2.816 1.00 0.00 H new ATOM 0 HE1 HIS A 46 11.319 -4.278 -4.124 1.00 0.00 H new ATOM 0 HE2 HIS A 46 12.864 -2.290 -3.665 1.00 0.00 H new ATOM 669 N MET A 47 7.476 -1.827 -5.703 1.00 0.00 N ATOM 670 CA MET A 47 6.866 -3.011 -6.328 1.00 0.00 C ATOM 671 C MET A 47 7.966 -3.993 -6.756 1.00 0.00 C ATOM 672 O MET A 47 8.664 -3.714 -7.735 1.00 0.00 O ATOM 673 CB MET A 47 5.981 -2.612 -7.522 1.00 0.00 C ATOM 674 CG MET A 47 4.658 -1.985 -7.067 1.00 0.00 C ATOM 675 SD MET A 47 3.649 -1.239 -8.375 1.00 0.00 S ATOM 676 CE MET A 47 3.308 -2.704 -9.366 1.00 0.00 C ATOM 0 H MET A 47 8.271 -1.459 -6.227 1.00 0.00 H new ATOM 0 HA MET A 47 6.222 -3.503 -5.599 1.00 0.00 H new ATOM 0 HB2 MET A 47 6.520 -1.905 -8.153 1.00 0.00 H new ATOM 0 HB3 MET A 47 5.775 -3.492 -8.132 1.00 0.00 H new ATOM 0 HG2 MET A 47 4.065 -2.753 -6.570 1.00 0.00 H new ATOM 0 HG3 MET A 47 4.877 -1.220 -6.322 1.00 0.00 H new ATOM 0 HE1 MET A 47 2.468 -2.505 -10.032 1.00 0.00 H new ATOM 0 HE2 MET A 47 4.188 -2.956 -9.957 1.00 0.00 H new ATOM 0 HE3 MET A 47 3.061 -3.538 -8.709 1.00 0.00 H new ATOM 686 N PRO A 48 8.142 -5.133 -6.062 1.00 0.00 N ATOM 687 CA PRO A 48 9.126 -6.153 -6.428 1.00 0.00 C ATOM 688 C PRO A 48 8.930 -6.700 -7.853 1.00 0.00 C ATOM 689 O PRO A 48 7.796 -6.890 -8.305 1.00 0.00 O ATOM 690 CB PRO A 48 9.001 -7.240 -5.355 1.00 0.00 C ATOM 691 CG PRO A 48 8.530 -6.449 -4.134 1.00 0.00 C ATOM 692 CD PRO A 48 7.569 -5.439 -4.757 1.00 0.00 C ATOM 0 HA PRO A 48 10.132 -5.733 -6.456 1.00 0.00 H new ATOM 0 HB2 PRO A 48 8.285 -8.011 -5.640 1.00 0.00 H new ATOM 0 HB3 PRO A 48 9.952 -7.740 -5.172 1.00 0.00 H new ATOM 0 HG2 PRO A 48 8.033 -7.086 -3.402 1.00 0.00 H new ATOM 0 HG3 PRO A 48 9.358 -5.960 -3.621 1.00 0.00 H new ATOM 0 HD2 PRO A 48 6.566 -5.855 -4.853 1.00 0.00 H new ATOM 0 HD3 PRO A 48 7.484 -4.543 -4.142 1.00 0.00 H new ATOM 700 N LYS A 49 10.040 -6.930 -8.572 1.00 0.00 N ATOM 701 CA LYS A 49 10.068 -7.304 -10.000 1.00 0.00 C ATOM 702 C LYS A 49 10.580 -8.730 -10.238 1.00 0.00 C ATOM 703 O LYS A 49 11.477 -9.214 -9.546 1.00 0.00 O ATOM 704 CB LYS A 49 10.913 -6.308 -10.821 1.00 0.00 C ATOM 705 CG LYS A 49 10.555 -4.816 -10.692 1.00 0.00 C ATOM 706 CD LYS A 49 9.090 -4.486 -11.023 1.00 0.00 C ATOM 707 CE LYS A 49 8.830 -2.977 -11.178 1.00 0.00 C ATOM 708 NZ LYS A 49 9.280 -2.195 -9.997 1.00 0.00 N ATOM 0 H LYS A 49 10.973 -6.859 -8.166 1.00 0.00 H new ATOM 0 HA LYS A 49 9.032 -7.267 -10.336 1.00 0.00 H new ATOM 0 HB2 LYS A 49 11.957 -6.432 -10.534 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.837 -6.585 -11.872 1.00 0.00 H new ATOM 0 HG2 LYS A 49 10.768 -4.490 -9.674 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.203 -4.240 -11.353 1.00 0.00 H new ATOM 0 HD2 LYS A 49 8.809 -4.993 -11.946 1.00 0.00 H new ATOM 0 HD3 LYS A 49 8.448 -4.880 -10.235 1.00 0.00 H new ATOM 0 HE2 LYS A 49 9.344 -2.613 -12.067 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.764 -2.810 -11.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.761 -1.295 -9.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 9.095 -2.739 -9.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.299 -2.004 -10.075 1.00 0.00 H new ATOM 722 N ASP A 50 10.041 -9.377 -11.266 1.00 0.00 N ATOM 723 CA ASP A 50 10.474 -10.678 -11.783 1.00 0.00 C ATOM 724 C ASP A 50 11.880 -10.621 -12.421 1.00 0.00 C ATOM 725 O ASP A 50 12.230 -9.650 -13.095 1.00 0.00 O ATOM 726 CB ASP A 50 9.432 -11.156 -12.803 1.00 0.00 C ATOM 727 CG ASP A 50 9.835 -12.495 -13.421 1.00 0.00 C ATOM 728 OD1 ASP A 50 9.646 -13.550 -12.774 1.00 0.00 O ATOM 729 OD2 ASP A 50 10.402 -12.459 -14.535 1.00 0.00 O ATOM 0 H ASP A 50 9.253 -8.994 -11.788 1.00 0.00 H new ATOM 0 HA ASP A 50 10.548 -11.380 -10.953 1.00 0.00 H new ATOM 0 HB2 ASP A 50 8.462 -11.255 -12.316 1.00 0.00 H new ATOM 0 HB3 ASP A 50 9.320 -10.409 -13.589 1.00 0.00 H new ATOM 734 N ARG A 51 12.678 -11.683 -12.250 1.00 0.00 N ATOM 735 CA ARG A 51 14.092 -11.749 -12.680 1.00 0.00 C ATOM 736 C ARG A 51 14.335 -12.181 -14.140 1.00 0.00 C ATOM 737 O ARG A 51 15.489 -12.385 -14.521 1.00 0.00 O ATOM 738 CB ARG A 51 14.909 -12.560 -11.658 1.00 0.00 C ATOM 739 CG ARG A 51 14.580 -14.063 -11.659 1.00 0.00 C ATOM 740 CD ARG A 51 15.369 -14.819 -10.583 1.00 0.00 C ATOM 741 NE ARG A 51 16.824 -14.823 -10.843 1.00 0.00 N ATOM 742 CZ ARG A 51 17.497 -15.635 -11.642 1.00 0.00 C ATOM 743 NH1 ARG A 51 16.918 -16.581 -12.328 1.00 0.00 N ATOM 744 NH2 ARG A 51 18.787 -15.511 -11.769 1.00 0.00 N ATOM 0 H ARG A 51 12.358 -12.541 -11.800 1.00 0.00 H new ATOM 0 HA ARG A 51 14.453 -10.720 -12.690 1.00 0.00 H new ATOM 0 HB2 ARG A 51 15.971 -12.429 -11.868 1.00 0.00 H new ATOM 0 HB3 ARG A 51 14.729 -12.158 -10.661 1.00 0.00 H new ATOM 0 HG2 ARG A 51 13.512 -14.201 -11.491 1.00 0.00 H new ATOM 0 HG3 ARG A 51 14.806 -14.484 -12.639 1.00 0.00 H new ATOM 0 HD2 ARG A 51 15.179 -14.364 -9.611 1.00 0.00 H new ATOM 0 HD3 ARG A 51 15.010 -15.847 -10.530 1.00 0.00 H new ATOM 0 HE ARG A 51 17.372 -14.119 -10.350 1.00 0.00 H new ATOM 0 HH11 ARG A 51 15.909 -16.716 -12.260 1.00 0.00 H new ATOM 0 HH12 ARG A 51 17.474 -17.186 -12.933 1.00 0.00 H new ATOM 0 HH21 ARG A 51 19.283 -14.786 -11.251 1.00 0.00 H new ATOM 0 HH22 ARG A 51 19.301 -16.139 -12.386 1.00 0.00 H new ATOM 758 N VAL A 52 13.284 -12.334 -14.954 1.00 0.00 N ATOM 759 CA VAL A 52 13.352 -12.857 -16.338 1.00 0.00 C ATOM 760 C VAL A 52 12.585 -11.958 -17.314 1.00 0.00 C ATOM 761 O VAL A 52 13.038 -11.731 -18.438 1.00 0.00 O ATOM 762 CB VAL A 52 12.802 -14.303 -16.408 1.00 0.00 C ATOM 763 CG1 VAL A 52 12.991 -14.918 -17.802 1.00 0.00 C ATOM 764 CG2 VAL A 52 13.487 -15.238 -15.402 1.00 0.00 C ATOM 0 H VAL A 52 12.335 -12.093 -14.668 1.00 0.00 H new ATOM 0 HA VAL A 52 14.402 -12.864 -16.632 1.00 0.00 H new ATOM 0 HB VAL A 52 11.742 -14.216 -16.170 1.00 0.00 H new ATOM 0 HG11 VAL A 52 12.592 -15.932 -17.809 1.00 0.00 H new ATOM 0 HG12 VAL A 52 12.463 -14.315 -18.540 1.00 0.00 H new ATOM 0 HG13 VAL A 52 14.053 -14.944 -18.047 1.00 0.00 H new ATOM 0 HG21 VAL A 52 13.066 -16.239 -15.491 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.557 -15.274 -15.609 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.326 -14.865 -14.391 1.00 0.00 H new ATOM 774 N THR A 53 11.447 -11.409 -16.880 1.00 0.00 N ATOM 775 CA THR A 53 10.532 -10.579 -17.678 1.00 0.00 C ATOM 776 C THR A 53 10.469 -9.134 -17.183 1.00 0.00 C ATOM 777 O THR A 53 9.958 -8.255 -17.882 1.00 0.00 O ATOM 778 CB THR A 53 9.111 -11.168 -17.682 1.00 0.00 C ATOM 779 OG1 THR A 53 8.574 -11.168 -16.376 1.00 0.00 O ATOM 780 CG2 THR A 53 9.054 -12.598 -18.221 1.00 0.00 C ATOM 0 H THR A 53 11.122 -11.535 -15.922 1.00 0.00 H new ATOM 0 HA THR A 53 10.934 -10.577 -18.691 1.00 0.00 H new ATOM 0 HB THR A 53 8.527 -10.531 -18.346 1.00 0.00 H new ATOM 0 HG1 THR A 53 9.170 -11.664 -15.777 1.00 0.00 H new ATOM 0 HG21 THR A 53 8.024 -12.955 -18.197 1.00 0.00 H new ATOM 0 HG22 THR A 53 9.420 -12.615 -19.247 1.00 0.00 H new ATOM 0 HG23 THR A 53 9.677 -13.245 -17.603 1.00 0.00 H new ATOM 788 N GLY A 54 10.972 -8.877 -15.970 1.00 0.00 N ATOM 789 CA GLY A 54 11.062 -7.552 -15.360 1.00 0.00 C ATOM 790 C GLY A 54 9.721 -6.926 -14.942 1.00 0.00 C ATOM 791 O GLY A 54 9.694 -5.775 -14.503 1.00 0.00 O ATOM 0 H GLY A 54 11.339 -9.614 -15.368 1.00 0.00 H new ATOM 0 HA2 GLY A 54 11.703 -7.618 -14.481 1.00 0.00 H new ATOM 0 HA3 GLY A 54 11.554 -6.880 -16.063 1.00 0.00 H new ATOM 795 N GLN A 55 8.611 -7.663 -15.069 1.00 0.00 N ATOM 796 CA GLN A 55 7.270 -7.228 -14.660 1.00 0.00 C ATOM 797 C GLN A 55 7.102 -7.336 -13.134 1.00 0.00 C ATOM 798 O GLN A 55 7.869 -8.038 -12.473 1.00 0.00 O ATOM 799 CB GLN A 55 6.200 -8.053 -15.402 1.00 0.00 C ATOM 800 CG GLN A 55 6.376 -8.116 -16.930 1.00 0.00 C ATOM 801 CD GLN A 55 6.532 -6.744 -17.585 1.00 0.00 C ATOM 802 OE1 GLN A 55 5.615 -5.933 -17.618 1.00 0.00 O ATOM 803 NE2 GLN A 55 7.692 -6.420 -18.119 1.00 0.00 N ATOM 0 H GLN A 55 8.621 -8.601 -15.469 1.00 0.00 H new ATOM 0 HA GLN A 55 7.142 -6.180 -14.929 1.00 0.00 H new ATOM 0 HB2 GLN A 55 6.207 -9.069 -15.008 1.00 0.00 H new ATOM 0 HB3 GLN A 55 5.219 -7.632 -15.181 1.00 0.00 H new ATOM 0 HG2 GLN A 55 7.252 -8.722 -17.162 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.514 -8.622 -17.366 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.466 -7.084 -18.100 1.00 0.00 H new ATOM 0 HE22 GLN A 55 7.816 -5.505 -18.552 1.00 0.00 H new ATOM 812 N HIS A 56 6.108 -6.661 -12.546 1.00 0.00 N ATOM 813 CA HIS A 56 5.860 -6.763 -11.098 1.00 0.00 C ATOM 814 C HIS A 56 5.328 -8.149 -10.688 1.00 0.00 C ATOM 815 O HIS A 56 4.706 -8.860 -11.482 1.00 0.00 O ATOM 816 CB HIS A 56 4.982 -5.608 -10.600 1.00 0.00 C ATOM 817 CG HIS A 56 3.522 -5.699 -10.968 1.00 0.00 C ATOM 818 ND1 HIS A 56 2.601 -6.574 -10.385 1.00 0.00 N ATOM 819 CD2 HIS A 56 2.864 -4.889 -11.848 1.00 0.00 C ATOM 820 CE1 HIS A 56 1.415 -6.286 -10.944 1.00 0.00 C ATOM 821 NE2 HIS A 56 1.542 -5.271 -11.811 1.00 0.00 N ATOM 0 H HIS A 56 5.466 -6.043 -13.042 1.00 0.00 H new ATOM 0 HA HIS A 56 6.822 -6.663 -10.594 1.00 0.00 H new ATOM 0 HB2 HIS A 56 5.063 -5.555 -9.514 1.00 0.00 H new ATOM 0 HB3 HIS A 56 5.381 -4.674 -10.995 1.00 0.00 H new ATOM 0 HD2 HIS A 56 3.295 -4.105 -12.453 1.00 0.00 H new ATOM 0 HE1 HIS A 56 0.490 -6.799 -10.726 1.00 0.00 H new ATOM 0 HE2 HIS A 56 0.786 -4.852 -12.352 1.00 0.00 H new ATOM 829 N GLN A 57 5.578 -8.540 -9.435 1.00 0.00 N ATOM 830 CA GLN A 57 5.273 -9.879 -8.904 1.00 0.00 C ATOM 831 C GLN A 57 3.821 -10.047 -8.391 1.00 0.00 C ATOM 832 O GLN A 57 3.526 -10.982 -7.644 1.00 0.00 O ATOM 833 CB GLN A 57 6.337 -10.267 -7.858 1.00 0.00 C ATOM 834 CG GLN A 57 7.733 -10.427 -8.486 1.00 0.00 C ATOM 835 CD GLN A 57 8.774 -10.854 -7.455 1.00 0.00 C ATOM 836 OE1 GLN A 57 9.542 -10.056 -6.936 1.00 0.00 O ATOM 837 NE2 GLN A 57 8.843 -12.123 -7.109 1.00 0.00 N ATOM 0 H GLN A 57 6.007 -7.924 -8.744 1.00 0.00 H new ATOM 0 HA GLN A 57 5.324 -10.582 -9.735 1.00 0.00 H new ATOM 0 HB2 GLN A 57 6.375 -9.505 -7.080 1.00 0.00 H new ATOM 0 HB3 GLN A 57 6.047 -11.201 -7.376 1.00 0.00 H new ATOM 0 HG2 GLN A 57 7.689 -11.167 -9.286 1.00 0.00 H new ATOM 0 HG3 GLN A 57 8.037 -9.484 -8.940 1.00 0.00 H new ATOM 0 HE21 GLN A 57 8.210 -12.802 -7.532 1.00 0.00 H new ATOM 0 HE22 GLN A 57 9.529 -12.427 -6.418 1.00 0.00 H new ATOM 846 N GLY A 58 2.900 -9.155 -8.775 1.00 0.00 N ATOM 847 CA GLY A 58 1.483 -9.175 -8.373 1.00 0.00 C ATOM 848 C GLY A 58 1.174 -8.454 -7.054 1.00 0.00 C ATOM 849 O GLY A 58 0.018 -8.432 -6.629 1.00 0.00 O ATOM 0 H GLY A 58 3.124 -8.375 -9.393 1.00 0.00 H new ATOM 0 HA2 GLY A 58 0.889 -8.720 -9.166 1.00 0.00 H new ATOM 0 HA3 GLY A 58 1.160 -10.212 -8.287 1.00 0.00 H new ATOM 853 N TYR A 59 2.177 -7.851 -6.408 1.00 0.00 N ATOM 854 CA TYR A 59 2.035 -7.085 -5.167 1.00 0.00 C ATOM 855 C TYR A 59 2.991 -5.880 -5.108 1.00 0.00 C ATOM 856 O TYR A 59 3.983 -5.805 -5.839 1.00 0.00 O ATOM 857 CB TYR A 59 2.213 -8.006 -3.949 1.00 0.00 C ATOM 858 CG TYR A 59 3.606 -8.583 -3.767 1.00 0.00 C ATOM 859 CD1 TYR A 59 4.510 -7.982 -2.869 1.00 0.00 C ATOM 860 CD2 TYR A 59 3.983 -9.740 -4.475 1.00 0.00 C ATOM 861 CE1 TYR A 59 5.786 -8.547 -2.671 1.00 0.00 C ATOM 862 CE2 TYR A 59 5.268 -10.289 -4.302 1.00 0.00 C ATOM 863 CZ TYR A 59 6.173 -9.696 -3.395 1.00 0.00 C ATOM 864 OH TYR A 59 7.407 -10.244 -3.219 1.00 0.00 O ATOM 0 H TYR A 59 3.139 -7.884 -6.745 1.00 0.00 H new ATOM 0 HA TYR A 59 1.025 -6.674 -5.147 1.00 0.00 H new ATOM 0 HB2 TYR A 59 1.949 -7.448 -3.051 1.00 0.00 H new ATOM 0 HB3 TYR A 59 1.505 -8.830 -4.031 1.00 0.00 H new ATOM 0 HD1 TYR A 59 4.225 -7.089 -2.333 1.00 0.00 H new ATOM 0 HD2 TYR A 59 3.284 -10.208 -5.153 1.00 0.00 H new ATOM 0 HE1 TYR A 59 6.469 -8.100 -1.964 1.00 0.00 H new ATOM 0 HE2 TYR A 59 5.561 -11.164 -4.863 1.00 0.00 H new ATOM 0 HH TYR A 59 7.501 -11.030 -3.797 1.00 0.00 H new ATOM 874 N GLY A 60 2.670 -4.928 -4.234 1.00 0.00 N ATOM 875 CA GLY A 60 3.387 -3.672 -4.032 1.00 0.00 C ATOM 876 C GLY A 60 3.245 -3.124 -2.609 1.00 0.00 C ATOM 877 O GLY A 60 2.600 -3.726 -1.749 1.00 0.00 O ATOM 0 H GLY A 60 1.862 -5.017 -3.617 1.00 0.00 H new ATOM 0 HA2 GLY A 60 4.443 -3.824 -4.253 1.00 0.00 H new ATOM 0 HA3 GLY A 60 3.016 -2.930 -4.740 1.00 0.00 H new ATOM 881 N PHE A 61 3.846 -1.961 -2.377 1.00 0.00 N ATOM 882 CA PHE A 61 3.882 -1.252 -1.100 1.00 0.00 C ATOM 883 C PHE A 61 3.786 0.266 -1.295 1.00 0.00 C ATOM 884 O PHE A 61 4.300 0.808 -2.281 1.00 0.00 O ATOM 885 CB PHE A 61 5.184 -1.567 -0.346 1.00 0.00 C ATOM 886 CG PHE A 61 5.444 -3.028 -0.031 1.00 0.00 C ATOM 887 CD1 PHE A 61 6.151 -3.835 -0.944 1.00 0.00 C ATOM 888 CD2 PHE A 61 5.023 -3.569 1.198 1.00 0.00 C ATOM 889 CE1 PHE A 61 6.431 -5.177 -0.631 1.00 0.00 C ATOM 890 CE2 PHE A 61 5.314 -4.908 1.518 1.00 0.00 C ATOM 891 CZ PHE A 61 6.015 -5.713 0.600 1.00 0.00 C ATOM 0 H PHE A 61 4.347 -1.461 -3.112 1.00 0.00 H new ATOM 0 HA PHE A 61 3.022 -1.591 -0.522 1.00 0.00 H new ATOM 0 HB2 PHE A 61 6.020 -1.191 -0.936 1.00 0.00 H new ATOM 0 HB3 PHE A 61 5.179 -1.011 0.591 1.00 0.00 H new ATOM 0 HD1 PHE A 61 6.479 -3.422 -1.887 1.00 0.00 H new ATOM 0 HD2 PHE A 61 4.475 -2.955 1.897 1.00 0.00 H new ATOM 0 HE1 PHE A 61 6.966 -5.796 -1.336 1.00 0.00 H new ATOM 0 HE2 PHE A 61 5.000 -5.318 2.467 1.00 0.00 H new ATOM 0 HZ PHE A 61 6.233 -6.743 0.842 1.00 0.00 H new ATOM 901 N VAL A 62 3.188 0.958 -0.320 1.00 0.00 N ATOM 902 CA VAL A 62 3.065 2.427 -0.289 1.00 0.00 C ATOM 903 C VAL A 62 3.461 2.954 1.088 1.00 0.00 C ATOM 904 O VAL A 62 2.958 2.482 2.103 1.00 0.00 O ATOM 905 CB VAL A 62 1.641 2.899 -0.656 1.00 0.00 C ATOM 906 CG1 VAL A 62 1.624 4.413 -0.872 1.00 0.00 C ATOM 907 CG2 VAL A 62 1.109 2.217 -1.920 1.00 0.00 C ATOM 0 H VAL A 62 2.765 0.506 0.490 1.00 0.00 H new ATOM 0 HA VAL A 62 3.742 2.831 -1.041 1.00 0.00 H new ATOM 0 HB VAL A 62 0.996 2.625 0.179 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.614 4.732 -1.130 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.941 4.915 0.042 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.305 4.673 -1.683 1.00 0.00 H new ATOM 0 HG21 VAL A 62 0.105 2.583 -2.136 1.00 0.00 H new ATOM 0 HG22 VAL A 62 1.766 2.444 -2.760 1.00 0.00 H new ATOM 0 HG23 VAL A 62 1.077 1.138 -1.765 1.00 0.00 H new ATOM 917 N GLU A 63 4.371 3.921 1.136 1.00 0.00 N ATOM 918 CA GLU A 63 4.930 4.482 2.368 1.00 0.00 C ATOM 919 C GLU A 63 4.317 5.851 2.670 1.00 0.00 C ATOM 920 O GLU A 63 4.460 6.787 1.883 1.00 0.00 O ATOM 921 CB GLU A 63 6.450 4.571 2.209 1.00 0.00 C ATOM 922 CG GLU A 63 7.178 5.007 3.484 1.00 0.00 C ATOM 923 CD GLU A 63 8.701 5.034 3.289 1.00 0.00 C ATOM 924 OE1 GLU A 63 9.267 4.198 2.545 1.00 0.00 O ATOM 925 OE2 GLU A 63 9.377 5.880 3.917 1.00 0.00 O ATOM 0 H GLU A 63 4.754 4.352 0.294 1.00 0.00 H new ATOM 0 HA GLU A 63 4.692 3.837 3.214 1.00 0.00 H new ATOM 0 HB2 GLU A 63 6.831 3.598 1.898 1.00 0.00 H new ATOM 0 HB3 GLU A 63 6.682 5.275 1.410 1.00 0.00 H new ATOM 0 HG2 GLU A 63 6.832 5.997 3.780 1.00 0.00 H new ATOM 0 HG3 GLU A 63 6.927 4.326 4.297 1.00 0.00 H new ATOM 932 N PHE A 64 3.667 5.984 3.822 1.00 0.00 N ATOM 933 CA PHE A 64 3.093 7.235 4.312 1.00 0.00 C ATOM 934 C PHE A 64 4.019 7.956 5.293 1.00 0.00 C ATOM 935 O PHE A 64 4.928 7.363 5.880 1.00 0.00 O ATOM 936 CB PHE A 64 1.726 6.958 4.944 1.00 0.00 C ATOM 937 CG PHE A 64 0.672 6.619 3.917 1.00 0.00 C ATOM 938 CD1 PHE A 64 0.443 5.283 3.536 1.00 0.00 C ATOM 939 CD2 PHE A 64 -0.044 7.661 3.305 1.00 0.00 C ATOM 940 CE1 PHE A 64 -0.525 4.991 2.560 1.00 0.00 C ATOM 941 CE2 PHE A 64 -1.013 7.368 2.334 1.00 0.00 C ATOM 942 CZ PHE A 64 -1.258 6.036 1.969 1.00 0.00 C ATOM 0 H PHE A 64 3.520 5.202 4.460 1.00 0.00 H new ATOM 0 HA PHE A 64 2.968 7.905 3.461 1.00 0.00 H new ATOM 0 HB2 PHE A 64 1.817 6.134 5.652 1.00 0.00 H new ATOM 0 HB3 PHE A 64 1.408 7.833 5.511 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.010 4.485 3.993 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.151 8.687 3.582 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.705 3.968 2.265 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -1.570 8.167 1.868 1.00 0.00 H new ATOM 0 HZ PHE A 64 -2.013 5.812 1.230 1.00 0.00 H new ATOM 952 N LEU A 65 3.759 9.250 5.496 1.00 0.00 N ATOM 953 CA LEU A 65 4.500 10.077 6.450 1.00 0.00 C ATOM 954 C LEU A 65 4.330 9.594 7.904 1.00 0.00 C ATOM 955 O LEU A 65 5.282 9.661 8.686 1.00 0.00 O ATOM 956 CB LEU A 65 4.033 11.532 6.286 1.00 0.00 C ATOM 957 CG LEU A 65 4.973 12.563 6.933 1.00 0.00 C ATOM 958 CD1 LEU A 65 6.245 12.760 6.104 1.00 0.00 C ATOM 959 CD2 LEU A 65 4.267 13.916 7.035 1.00 0.00 C ATOM 0 H LEU A 65 3.025 9.755 5.000 1.00 0.00 H new ATOM 0 HA LEU A 65 5.566 9.998 6.236 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.940 11.756 5.223 1.00 0.00 H new ATOM 0 HB3 LEU A 65 3.040 11.636 6.722 1.00 0.00 H new ATOM 0 HG LEU A 65 5.240 12.185 7.920 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.886 13.495 6.591 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.777 11.812 6.023 1.00 0.00 H new ATOM 0 HD13 LEU A 65 5.979 13.113 5.108 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.937 14.643 7.494 1.00 0.00 H new ATOM 0 HD22 LEU A 65 3.990 14.258 6.038 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.370 13.813 7.646 1.00 0.00 H new ATOM 971 N SER A 66 3.143 9.074 8.244 1.00 0.00 N ATOM 972 CA SER A 66 2.793 8.617 9.598 1.00 0.00 C ATOM 973 C SER A 66 1.898 7.373 9.571 1.00 0.00 C ATOM 974 O SER A 66 1.172 7.120 8.609 1.00 0.00 O ATOM 975 CB SER A 66 2.087 9.733 10.386 1.00 0.00 C ATOM 976 OG SER A 66 2.807 10.958 10.361 1.00 0.00 O ATOM 0 H SER A 66 2.384 8.956 7.573 1.00 0.00 H new ATOM 0 HA SER A 66 3.729 8.356 10.092 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.092 9.892 9.971 1.00 0.00 H new ATOM 0 HB3 SER A 66 1.954 9.415 11.420 1.00 0.00 H new ATOM 0 HG SER A 66 2.318 11.635 10.873 1.00 0.00 H new ATOM 982 N GLU A 67 1.913 6.597 10.656 1.00 0.00 N ATOM 983 CA GLU A 67 1.143 5.349 10.782 1.00 0.00 C ATOM 984 C GLU A 67 -0.381 5.568 10.745 1.00 0.00 C ATOM 985 O GLU A 67 -1.111 4.728 10.223 1.00 0.00 O ATOM 986 CB GLU A 67 1.585 4.643 12.072 1.00 0.00 C ATOM 987 CG GLU A 67 0.896 3.288 12.289 1.00 0.00 C ATOM 988 CD GLU A 67 1.483 2.505 13.476 1.00 0.00 C ATOM 989 OE1 GLU A 67 1.803 3.101 14.530 1.00 0.00 O ATOM 990 OE2 GLU A 67 1.591 1.260 13.380 1.00 0.00 O ATOM 0 H GLU A 67 2.466 6.816 11.485 1.00 0.00 H new ATOM 0 HA GLU A 67 1.354 4.721 9.917 1.00 0.00 H new ATOM 0 HB2 GLU A 67 2.664 4.494 12.045 1.00 0.00 H new ATOM 0 HB3 GLU A 67 1.374 5.291 12.923 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.169 3.450 12.457 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.988 2.689 11.383 1.00 0.00 H new ATOM 997 N GLU A 68 -0.876 6.713 11.223 1.00 0.00 N ATOM 998 CA GLU A 68 -2.308 7.055 11.159 1.00 0.00 C ATOM 999 C GLU A 68 -2.806 7.342 9.727 1.00 0.00 C ATOM 1000 O GLU A 68 -3.984 7.141 9.428 1.00 0.00 O ATOM 1001 CB GLU A 68 -2.618 8.216 12.118 1.00 0.00 C ATOM 1002 CG GLU A 68 -1.934 9.542 11.750 1.00 0.00 C ATOM 1003 CD GLU A 68 -2.245 10.628 12.797 1.00 0.00 C ATOM 1004 OE1 GLU A 68 -3.291 11.313 12.680 1.00 0.00 O ATOM 1005 OE2 GLU A 68 -1.447 10.807 13.749 1.00 0.00 O ATOM 0 H GLU A 68 -0.301 7.430 11.665 1.00 0.00 H new ATOM 0 HA GLU A 68 -2.863 6.175 11.483 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -3.696 8.372 12.144 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -2.313 7.931 13.125 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.856 9.394 11.683 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.273 9.870 10.767 1.00 0.00 H new ATOM 1012 N ASP A 69 -1.912 7.748 8.820 1.00 0.00 N ATOM 1013 CA ASP A 69 -2.207 7.901 7.391 1.00 0.00 C ATOM 1014 C ASP A 69 -2.175 6.544 6.664 1.00 0.00 C ATOM 1015 O ASP A 69 -2.993 6.295 5.776 1.00 0.00 O ATOM 1016 CB ASP A 69 -1.217 8.898 6.775 1.00 0.00 C ATOM 1017 CG ASP A 69 -1.418 10.320 7.324 1.00 0.00 C ATOM 1018 OD1 ASP A 69 -0.477 10.861 7.951 1.00 0.00 O ATOM 1019 OD2 ASP A 69 -2.503 10.909 7.106 1.00 0.00 O ATOM 0 H ASP A 69 -0.949 7.983 9.061 1.00 0.00 H new ATOM 0 HA ASP A 69 -3.218 8.292 7.274 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -0.198 8.571 6.980 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -1.338 8.907 5.692 1.00 0.00 H new ATOM 1024 N ALA A 70 -1.300 5.628 7.101 1.00 0.00 N ATOM 1025 CA ALA A 70 -1.261 4.251 6.614 1.00 0.00 C ATOM 1026 C ALA A 70 -2.516 3.466 7.040 1.00 0.00 C ATOM 1027 O ALA A 70 -3.157 2.824 6.212 1.00 0.00 O ATOM 1028 CB ALA A 70 0.035 3.597 7.120 1.00 0.00 C ATOM 0 H ALA A 70 -0.594 5.829 7.810 1.00 0.00 H new ATOM 0 HA ALA A 70 -1.263 4.242 5.524 1.00 0.00 H new ATOM 0 HB1 ALA A 70 0.084 2.567 6.767 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.894 4.152 6.742 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.047 3.608 8.210 1.00 0.00 H new ATOM 1034 N ASP A 71 -2.932 3.583 8.306 1.00 0.00 N ATOM 1035 CA ASP A 71 -4.159 2.974 8.838 1.00 0.00 C ATOM 1036 C ASP A 71 -5.420 3.403 8.062 1.00 0.00 C ATOM 1037 O ASP A 71 -6.308 2.585 7.811 1.00 0.00 O ATOM 1038 CB ASP A 71 -4.279 3.338 10.323 1.00 0.00 C ATOM 1039 CG ASP A 71 -5.499 2.671 10.981 1.00 0.00 C ATOM 1040 OD1 ASP A 71 -5.454 1.443 11.228 1.00 0.00 O ATOM 1041 OD2 ASP A 71 -6.492 3.379 11.277 1.00 0.00 O ATOM 0 H ASP A 71 -2.414 4.115 9.006 1.00 0.00 H new ATOM 0 HA ASP A 71 -4.088 1.893 8.718 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -3.373 3.033 10.846 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -4.357 4.420 10.426 1.00 0.00 H new ATOM 1046 N TYR A 72 -5.470 4.658 7.603 1.00 0.00 N ATOM 1047 CA TYR A 72 -6.567 5.162 6.777 1.00 0.00 C ATOM 1048 C TYR A 72 -6.534 4.575 5.356 1.00 0.00 C ATOM 1049 O TYR A 72 -7.580 4.224 4.816 1.00 0.00 O ATOM 1050 CB TYR A 72 -6.544 6.696 6.757 1.00 0.00 C ATOM 1051 CG TYR A 72 -7.836 7.313 6.251 1.00 0.00 C ATOM 1052 CD1 TYR A 72 -8.075 7.427 4.868 1.00 0.00 C ATOM 1053 CD2 TYR A 72 -8.809 7.760 7.167 1.00 0.00 C ATOM 1054 CE1 TYR A 72 -9.269 8.003 4.396 1.00 0.00 C ATOM 1055 CE2 TYR A 72 -10.010 8.330 6.700 1.00 0.00 C ATOM 1056 CZ TYR A 72 -10.243 8.457 5.314 1.00 0.00 C ATOM 1057 OH TYR A 72 -11.405 9.014 4.873 1.00 0.00 O ATOM 0 H TYR A 72 -4.748 5.353 7.795 1.00 0.00 H new ATOM 0 HA TYR A 72 -7.507 4.835 7.222 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -6.346 7.062 7.764 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -5.719 7.031 6.128 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -7.337 7.070 4.165 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -8.634 7.666 8.229 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -9.441 8.098 3.334 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -10.754 8.671 7.405 1.00 0.00 H new ATOM 0 HH TYR A 72 -11.958 9.268 5.641 1.00 0.00 H new ATOM 1067 N ALA A 73 -5.354 4.386 4.756 1.00 0.00 N ATOM 1068 CA ALA A 73 -5.235 3.765 3.435 1.00 0.00 C ATOM 1069 C ALA A 73 -5.669 2.291 3.459 1.00 0.00 C ATOM 1070 O ALA A 73 -6.350 1.835 2.540 1.00 0.00 O ATOM 1071 CB ALA A 73 -3.795 3.933 2.949 1.00 0.00 C ATOM 0 H ALA A 73 -4.462 4.657 5.169 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.909 4.261 2.736 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -3.687 3.476 1.965 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -3.554 4.994 2.884 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -3.115 3.449 3.650 1.00 0.00 H new ATOM 1077 N ILE A 74 -5.368 1.568 4.543 1.00 0.00 N ATOM 1078 CA ILE A 74 -5.849 0.197 4.779 1.00 0.00 C ATOM 1079 C ILE A 74 -7.382 0.172 4.916 1.00 0.00 C ATOM 1080 O ILE A 74 -8.026 -0.764 4.440 1.00 0.00 O ATOM 1081 CB ILE A 74 -5.143 -0.408 6.018 1.00 0.00 C ATOM 1082 CG1 ILE A 74 -3.608 -0.422 5.829 1.00 0.00 C ATOM 1083 CG2 ILE A 74 -5.627 -1.847 6.285 1.00 0.00 C ATOM 1084 CD1 ILE A 74 -2.835 -0.581 7.137 1.00 0.00 C ATOM 0 H ILE A 74 -4.775 1.921 5.294 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.597 -0.423 3.918 1.00 0.00 H new ATOM 0 HB ILE A 74 -5.397 0.221 6.871 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -3.340 -1.237 5.156 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.301 0.505 5.345 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -5.115 -2.247 7.160 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -6.702 -1.842 6.465 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -5.407 -2.471 5.419 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.765 -0.583 6.929 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -3.074 0.247 7.804 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -3.114 -1.521 7.612 1.00 0.00 H new ATOM 1096 N LYS A 75 -7.987 1.223 5.489 1.00 0.00 N ATOM 1097 CA LYS A 75 -9.447 1.370 5.597 1.00 0.00 C ATOM 1098 C LYS A 75 -10.125 1.573 4.234 1.00 0.00 C ATOM 1099 O LYS A 75 -11.150 0.935 3.984 1.00 0.00 O ATOM 1100 CB LYS A 75 -9.776 2.490 6.604 1.00 0.00 C ATOM 1101 CG LYS A 75 -11.284 2.667 6.827 1.00 0.00 C ATOM 1102 CD LYS A 75 -11.559 3.692 7.935 1.00 0.00 C ATOM 1103 CE LYS A 75 -13.071 3.860 8.133 1.00 0.00 C ATOM 1104 NZ LYS A 75 -13.377 4.842 9.206 1.00 0.00 N ATOM 0 H LYS A 75 -7.471 2.004 5.895 1.00 0.00 H new ATOM 0 HA LYS A 75 -9.862 0.436 5.976 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -9.296 2.267 7.557 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.354 3.429 6.246 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -11.757 2.992 5.900 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -11.731 1.709 7.094 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -11.096 3.366 8.866 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -11.110 4.650 7.675 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -13.527 4.188 7.199 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -13.515 2.897 8.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -14.408 4.930 9.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -12.963 4.516 10.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -12.975 5.767 8.955 1.00 0.00 H new ATOM 1118 N ILE A 76 -9.575 2.413 3.346 1.00 0.00 N ATOM 1119 CA ILE A 76 -10.222 2.745 2.063 1.00 0.00 C ATOM 1120 C ILE A 76 -9.837 1.841 0.880 1.00 0.00 C ATOM 1121 O ILE A 76 -10.693 1.584 0.035 1.00 0.00 O ATOM 1122 CB ILE A 76 -10.050 4.235 1.698 1.00 0.00 C ATOM 1123 CG1 ILE A 76 -8.583 4.691 1.583 1.00 0.00 C ATOM 1124 CG2 ILE A 76 -10.793 5.113 2.720 1.00 0.00 C ATOM 1125 CD1 ILE A 76 -8.435 5.965 0.752 1.00 0.00 C ATOM 0 H ILE A 76 -8.679 2.878 3.491 1.00 0.00 H new ATOM 0 HA ILE A 76 -11.278 2.544 2.242 1.00 0.00 H new ATOM 0 HB ILE A 76 -10.481 4.354 0.704 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -8.179 4.862 2.581 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -7.992 3.895 1.131 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -10.668 6.163 2.457 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.854 4.861 2.713 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -10.385 4.937 3.715 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -7.383 6.246 0.700 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -8.813 5.789 -0.255 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.003 6.771 1.217 1.00 0.00 H new ATOM 1137 N MET A 77 -8.594 1.346 0.794 1.00 0.00 N ATOM 1138 CA MET A 77 -8.079 0.627 -0.392 1.00 0.00 C ATOM 1139 C MET A 77 -8.190 -0.901 -0.311 1.00 0.00 C ATOM 1140 O MET A 77 -7.850 -1.608 -1.257 1.00 0.00 O ATOM 1141 CB MET A 77 -6.654 1.081 -0.731 1.00 0.00 C ATOM 1142 CG MET A 77 -6.584 2.530 -1.218 1.00 0.00 C ATOM 1143 SD MET A 77 -7.054 2.756 -2.952 1.00 0.00 S ATOM 1144 CE MET A 77 -6.499 4.464 -3.164 1.00 0.00 C ATOM 0 H MET A 77 -7.910 1.431 1.546 1.00 0.00 H new ATOM 0 HA MET A 77 -8.739 0.905 -1.214 1.00 0.00 H new ATOM 0 HB2 MET A 77 -6.024 0.970 0.152 1.00 0.00 H new ATOM 0 HB3 MET A 77 -6.244 0.426 -1.499 1.00 0.00 H new ATOM 0 HG2 MET A 77 -7.235 3.143 -0.594 1.00 0.00 H new ATOM 0 HG3 MET A 77 -5.568 2.900 -1.078 1.00 0.00 H new ATOM 0 HE1 MET A 77 -7.147 4.971 -3.879 1.00 0.00 H new ATOM 0 HE2 MET A 77 -6.541 4.982 -2.206 1.00 0.00 H new ATOM 0 HE3 MET A 77 -5.474 4.470 -3.535 1.00 0.00 H new ATOM 1154 N ASP A 78 -8.702 -1.426 0.796 1.00 0.00 N ATOM 1155 CA ASP A 78 -8.981 -2.856 0.961 1.00 0.00 C ATOM 1156 C ASP A 78 -10.340 -3.233 0.344 1.00 0.00 C ATOM 1157 O ASP A 78 -11.275 -2.428 0.345 1.00 0.00 O ATOM 1158 CB ASP A 78 -8.875 -3.251 2.441 1.00 0.00 C ATOM 1159 CG ASP A 78 -8.880 -4.774 2.633 1.00 0.00 C ATOM 1160 OD1 ASP A 78 -9.606 -5.271 3.525 1.00 0.00 O ATOM 1161 OD2 ASP A 78 -8.148 -5.464 1.885 1.00 0.00 O ATOM 0 H ASP A 78 -8.939 -0.868 1.616 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.228 -3.427 0.417 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.959 -2.836 2.862 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -9.707 -2.814 2.993 1.00 0.00 H new ATOM 1166 N MET A 79 -10.455 -4.449 -0.208 1.00 0.00 N ATOM 1167 CA MET A 79 -11.613 -4.944 -0.984 1.00 0.00 C ATOM 1168 C MET A 79 -11.948 -4.141 -2.267 1.00 0.00 C ATOM 1169 O MET A 79 -12.942 -4.432 -2.937 1.00 0.00 O ATOM 1170 CB MET A 79 -12.855 -5.137 -0.085 1.00 0.00 C ATOM 1171 CG MET A 79 -12.602 -5.958 1.188 1.00 0.00 C ATOM 1172 SD MET A 79 -12.015 -7.661 0.948 1.00 0.00 S ATOM 1173 CE MET A 79 -13.479 -8.414 0.186 1.00 0.00 C ATOM 0 H MET A 79 -9.716 -5.147 -0.126 1.00 0.00 H new ATOM 0 HA MET A 79 -11.296 -5.918 -1.357 1.00 0.00 H new ATOM 0 HB2 MET A 79 -13.236 -4.157 0.201 1.00 0.00 H new ATOM 0 HB3 MET A 79 -13.636 -5.626 -0.667 1.00 0.00 H new ATOM 0 HG2 MET A 79 -11.870 -5.427 1.797 1.00 0.00 H new ATOM 0 HG3 MET A 79 -13.528 -5.994 1.761 1.00 0.00 H new ATOM 0 HE1 MET A 79 -13.320 -9.486 0.074 1.00 0.00 H new ATOM 0 HE2 MET A 79 -14.349 -8.241 0.820 1.00 0.00 H new ATOM 0 HE3 MET A 79 -13.649 -7.968 -0.794 1.00 0.00 H new ATOM 1183 N ILE A 80 -11.119 -3.161 -2.642 1.00 0.00 N ATOM 1184 CA ILE A 80 -11.195 -2.402 -3.900 1.00 0.00 C ATOM 1185 C ILE A 80 -10.773 -3.269 -5.101 1.00 0.00 C ATOM 1186 O ILE A 80 -10.055 -4.257 -4.948 1.00 0.00 O ATOM 1187 CB ILE A 80 -10.398 -1.076 -3.735 1.00 0.00 C ATOM 1188 CG1 ILE A 80 -11.331 0.006 -3.137 1.00 0.00 C ATOM 1189 CG2 ILE A 80 -9.664 -0.576 -4.988 1.00 0.00 C ATOM 1190 CD1 ILE A 80 -10.781 1.441 -3.152 1.00 0.00 C ATOM 0 H ILE A 80 -10.342 -2.860 -2.053 1.00 0.00 H new ATOM 0 HA ILE A 80 -12.225 -2.124 -4.123 1.00 0.00 H new ATOM 0 HB ILE A 80 -9.581 -1.297 -3.048 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -12.273 -0.009 -3.686 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -11.559 -0.266 -2.106 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -9.143 0.353 -4.758 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -8.942 -1.326 -5.311 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -10.385 -0.400 -5.786 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -11.514 2.116 -2.711 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -9.857 1.482 -2.576 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -10.582 1.744 -4.180 1.00 0.00 H new ATOM 1202 N LYS A 81 -11.219 -2.896 -6.309 1.00 0.00 N ATOM 1203 CA LYS A 81 -10.937 -3.581 -7.580 1.00 0.00 C ATOM 1204 C LYS A 81 -10.188 -2.675 -8.569 1.00 0.00 C ATOM 1205 O LYS A 81 -10.750 -2.239 -9.575 1.00 0.00 O ATOM 1206 CB LYS A 81 -12.256 -4.124 -8.152 1.00 0.00 C ATOM 1207 CG LYS A 81 -12.897 -5.205 -7.263 1.00 0.00 C ATOM 1208 CD LYS A 81 -14.127 -5.862 -7.907 1.00 0.00 C ATOM 1209 CE LYS A 81 -13.745 -6.791 -9.066 1.00 0.00 C ATOM 1210 NZ LYS A 81 -14.948 -7.343 -9.745 1.00 0.00 N ATOM 0 H LYS A 81 -11.811 -2.075 -6.433 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.265 -4.420 -7.398 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.958 -3.300 -8.276 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.073 -4.538 -9.143 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.155 -5.973 -7.043 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.187 -4.760 -6.311 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.671 -6.430 -7.152 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -14.802 -5.088 -8.271 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.139 -6.243 -9.787 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.131 -7.609 -8.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -14.652 -7.966 -10.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -15.514 -7.886 -9.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -15.521 -6.563 -10.125 1.00 0.00 H new ATOM 1224 N LEU A 82 -8.912 -2.393 -8.293 1.00 0.00 N ATOM 1225 CA LEU A 82 -8.034 -1.601 -9.171 1.00 0.00 C ATOM 1226 C LEU A 82 -7.946 -2.251 -10.567 1.00 0.00 C ATOM 1227 O LEU A 82 -7.685 -3.452 -10.665 1.00 0.00 O ATOM 1228 CB LEU A 82 -6.659 -1.459 -8.483 1.00 0.00 C ATOM 1229 CG LEU A 82 -5.642 -0.554 -9.204 1.00 0.00 C ATOM 1230 CD1 LEU A 82 -6.190 0.849 -9.470 1.00 0.00 C ATOM 1231 CD2 LEU A 82 -4.390 -0.417 -8.333 1.00 0.00 C ATOM 0 H LEU A 82 -8.449 -2.711 -7.442 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.439 -0.601 -9.329 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -6.815 -1.070 -7.477 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.222 -2.452 -8.376 1.00 0.00 H new ATOM 0 HG LEU A 82 -5.419 -1.020 -10.164 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -5.433 1.445 -9.980 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.079 0.780 -10.096 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.449 1.324 -8.524 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.665 0.222 -8.836 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -4.660 0.026 -7.374 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -3.952 -1.401 -8.167 1.00 0.00 H new ATOM 1243 N TYR A 83 -8.220 -1.494 -11.640 1.00 0.00 N ATOM 1244 CA TYR A 83 -8.403 -2.038 -13.005 1.00 0.00 C ATOM 1245 C TYR A 83 -9.319 -3.293 -13.134 1.00 0.00 C ATOM 1246 O TYR A 83 -9.148 -4.091 -14.061 1.00 0.00 O ATOM 1247 CB TYR A 83 -7.036 -2.239 -13.685 1.00 0.00 C ATOM 1248 CG TYR A 83 -6.190 -0.991 -13.838 1.00 0.00 C ATOM 1249 CD1 TYR A 83 -4.934 -0.911 -13.210 1.00 0.00 C ATOM 1250 CD2 TYR A 83 -6.630 0.062 -14.666 1.00 0.00 C ATOM 1251 CE1 TYR A 83 -4.116 0.214 -13.414 1.00 0.00 C ATOM 1252 CE2 TYR A 83 -5.816 1.195 -14.863 1.00 0.00 C ATOM 1253 CZ TYR A 83 -4.553 1.273 -14.238 1.00 0.00 C ATOM 1254 OH TYR A 83 -3.754 2.357 -14.432 1.00 0.00 O ATOM 0 H TYR A 83 -8.323 -0.480 -11.591 1.00 0.00 H new ATOM 0 HA TYR A 83 -8.971 -1.276 -13.538 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -6.469 -2.972 -13.111 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -7.202 -2.667 -14.674 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -4.598 -1.714 -12.571 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.593 -0.000 -15.150 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -3.148 0.268 -12.938 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -6.158 2.003 -15.492 1.00 0.00 H new ATOM 0 HH TYR A 83 -4.204 2.993 -15.026 1.00 0.00 H new ATOM 1264 N GLY A 84 -10.299 -3.500 -12.239 1.00 0.00 N ATOM 1265 CA GLY A 84 -11.247 -4.628 -12.309 1.00 0.00 C ATOM 1266 C GLY A 84 -10.709 -5.986 -11.814 1.00 0.00 C ATOM 1267 O GLY A 84 -11.180 -7.034 -12.260 1.00 0.00 O ATOM 0 H GLY A 84 -10.458 -2.886 -11.440 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -12.130 -4.373 -11.724 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -11.572 -4.742 -13.343 1.00 0.00 H new ATOM 1271 N LYS A 85 -9.740 -5.975 -10.889 1.00 0.00 N ATOM 1272 CA LYS A 85 -9.084 -7.117 -10.247 1.00 0.00 C ATOM 1273 C LYS A 85 -8.986 -6.812 -8.739 1.00 0.00 C ATOM 1274 O LYS A 85 -8.429 -5.772 -8.379 1.00 0.00 O ATOM 1275 CB LYS A 85 -7.696 -7.321 -10.880 1.00 0.00 C ATOM 1276 CG LYS A 85 -6.976 -8.553 -10.311 1.00 0.00 C ATOM 1277 CD LYS A 85 -5.576 -8.703 -10.921 1.00 0.00 C ATOM 1278 CE LYS A 85 -4.860 -9.908 -10.298 1.00 0.00 C ATOM 1279 NZ LYS A 85 -3.488 -10.077 -10.846 1.00 0.00 N ATOM 0 H LYS A 85 -9.365 -5.092 -10.543 1.00 0.00 H new ATOM 0 HA LYS A 85 -9.649 -8.039 -10.387 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.803 -7.431 -11.959 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -7.086 -6.434 -10.709 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -6.897 -8.464 -9.228 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -7.563 -9.448 -10.515 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.652 -8.833 -12.001 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -4.996 -7.796 -10.749 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -4.807 -9.780 -9.217 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -5.440 -10.812 -10.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -3.023 -10.881 -10.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -3.542 -10.257 -11.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -2.937 -9.211 -10.676 1.00 0.00 H new ATOM 1293 N PRO A 86 -9.564 -7.640 -7.852 1.00 0.00 N ATOM 1294 CA PRO A 86 -9.666 -7.334 -6.427 1.00 0.00 C ATOM 1295 C PRO A 86 -8.304 -7.347 -5.718 1.00 0.00 C ATOM 1296 O PRO A 86 -7.563 -8.330 -5.789 1.00 0.00 O ATOM 1297 CB PRO A 86 -10.663 -8.348 -5.852 1.00 0.00 C ATOM 1298 CG PRO A 86 -10.640 -9.504 -6.848 1.00 0.00 C ATOM 1299 CD PRO A 86 -10.350 -8.815 -8.177 1.00 0.00 C ATOM 0 HA PRO A 86 -10.021 -6.316 -6.266 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -10.367 -8.675 -4.855 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -11.661 -7.919 -5.764 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -9.872 -10.235 -6.598 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -11.591 -10.036 -6.869 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -9.804 -9.477 -8.849 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -11.275 -8.539 -8.684 1.00 0.00 H new ATOM 1307 N ILE A 87 -8.007 -6.259 -5.000 1.00 0.00 N ATOM 1308 CA ILE A 87 -6.804 -6.086 -4.174 1.00 0.00 C ATOM 1309 C ILE A 87 -7.094 -6.300 -2.681 1.00 0.00 C ATOM 1310 O ILE A 87 -8.240 -6.207 -2.225 1.00 0.00 O ATOM 1311 CB ILE A 87 -6.088 -4.735 -4.437 1.00 0.00 C ATOM 1312 CG1 ILE A 87 -6.989 -3.502 -4.203 1.00 0.00 C ATOM 1313 CG2 ILE A 87 -5.509 -4.722 -5.861 1.00 0.00 C ATOM 1314 CD1 ILE A 87 -6.205 -2.189 -4.061 1.00 0.00 C ATOM 0 H ILE A 87 -8.619 -5.444 -4.976 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.109 -6.868 -4.480 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.282 -4.658 -3.707 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.689 -3.410 -5.034 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -7.582 -3.661 -3.303 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -5.007 -3.771 -6.041 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -4.793 -5.537 -5.970 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -6.316 -4.849 -6.583 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.901 -1.366 -3.899 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.525 -2.261 -3.213 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -5.633 -2.007 -4.971 1.00 0.00 H new ATOM 1326 N ARG A 88 -6.042 -6.590 -1.914 1.00 0.00 N ATOM 1327 CA ARG A 88 -6.055 -6.713 -0.447 1.00 0.00 C ATOM 1328 C ARG A 88 -4.972 -5.831 0.164 1.00 0.00 C ATOM 1329 O ARG A 88 -3.846 -5.818 -0.336 1.00 0.00 O ATOM 1330 CB ARG A 88 -5.881 -8.184 -0.025 1.00 0.00 C ATOM 1331 CG ARG A 88 -6.993 -9.122 -0.524 1.00 0.00 C ATOM 1332 CD ARG A 88 -8.367 -8.792 0.073 1.00 0.00 C ATOM 1333 NE ARG A 88 -9.410 -9.678 -0.477 1.00 0.00 N ATOM 1334 CZ ARG A 88 -10.234 -9.417 -1.476 1.00 0.00 C ATOM 1335 NH1 ARG A 88 -10.190 -8.304 -2.154 1.00 0.00 N ATOM 1336 NH2 ARG A 88 -11.135 -10.290 -1.820 1.00 0.00 N ATOM 0 H ARG A 88 -5.116 -6.753 -2.310 1.00 0.00 H new ATOM 0 HA ARG A 88 -7.021 -6.373 -0.074 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.923 -8.546 -0.398 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -5.840 -8.235 1.063 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -7.051 -9.062 -1.611 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -6.732 -10.151 -0.275 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -8.331 -8.897 1.157 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -8.619 -7.753 -0.139 1.00 0.00 H new ATOM 0 HE ARG A 88 -9.506 -10.593 -0.037 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -9.499 -7.591 -1.920 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -10.847 -8.146 -2.918 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -11.205 -11.175 -1.318 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -11.772 -10.089 -2.591 1.00 0.00 H new ATOM 1350 N VAL A 89 -5.308 -5.093 1.224 1.00 0.00 N ATOM 1351 CA VAL A 89 -4.435 -4.075 1.837 1.00 0.00 C ATOM 1352 C VAL A 89 -4.333 -4.267 3.351 1.00 0.00 C ATOM 1353 O VAL A 89 -5.328 -4.563 4.014 1.00 0.00 O ATOM 1354 CB VAL A 89 -4.892 -2.647 1.467 1.00 0.00 C ATOM 1355 CG1 VAL A 89 -3.923 -1.566 1.962 1.00 0.00 C ATOM 1356 CG2 VAL A 89 -4.979 -2.472 -0.053 1.00 0.00 C ATOM 0 H VAL A 89 -6.209 -5.183 1.693 1.00 0.00 H new ATOM 0 HA VAL A 89 -3.433 -4.208 1.429 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.864 -2.529 1.946 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -4.296 -0.583 1.673 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -3.843 -1.619 3.048 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -2.941 -1.727 1.517 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.303 -1.457 -0.284 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -3.999 -2.650 -0.496 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.697 -3.184 -0.461 1.00 0.00 H new ATOM 1366 N ASN A 90 -3.122 -4.108 3.897 1.00 0.00 N ATOM 1367 CA ASN A 90 -2.800 -4.204 5.330 1.00 0.00 C ATOM 1368 C ASN A 90 -1.473 -3.466 5.631 1.00 0.00 C ATOM 1369 O ASN A 90 -0.814 -2.972 4.717 1.00 0.00 O ATOM 1370 CB ASN A 90 -2.727 -5.703 5.701 1.00 0.00 C ATOM 1371 CG ASN A 90 -2.756 -6.004 7.193 1.00 0.00 C ATOM 1372 OD1 ASN A 90 -2.960 -5.143 8.036 1.00 0.00 O ATOM 1373 ND2 ASN A 90 -2.553 -7.245 7.570 1.00 0.00 N ATOM 0 H ASN A 90 -2.301 -3.899 3.329 1.00 0.00 H new ATOM 0 HA ASN A 90 -3.569 -3.724 5.935 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -3.561 -6.219 5.226 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -1.812 -6.121 5.280 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -2.566 -7.486 8.561 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -2.382 -7.969 6.872 1.00 0.00 H new ATOM 1380 N LYS A 91 -1.052 -3.403 6.898 1.00 0.00 N ATOM 1381 CA LYS A 91 0.279 -2.927 7.318 1.00 0.00 C ATOM 1382 C LYS A 91 1.389 -3.764 6.658 1.00 0.00 C ATOM 1383 O LYS A 91 1.235 -4.975 6.497 1.00 0.00 O ATOM 1384 CB LYS A 91 0.422 -3.055 8.850 1.00 0.00 C ATOM 1385 CG LYS A 91 -0.690 -2.448 9.722 1.00 0.00 C ATOM 1386 CD LYS A 91 -0.723 -0.911 9.759 1.00 0.00 C ATOM 1387 CE LYS A 91 -0.167 -0.301 11.055 1.00 0.00 C ATOM 1388 NZ LYS A 91 1.308 -0.402 11.181 1.00 0.00 N ATOM 0 H LYS A 91 -1.638 -3.688 7.683 1.00 0.00 H new ATOM 0 HA LYS A 91 0.376 -1.885 7.012 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.499 -4.115 9.093 1.00 0.00 H new ATOM 0 HB3 LYS A 91 1.366 -2.593 9.139 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -1.653 -2.808 9.359 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -0.575 -2.818 10.741 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -0.151 -0.526 8.915 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -1.752 -0.577 9.626 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -0.455 0.749 11.104 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -0.630 -0.799 11.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 1.608 0.014 12.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 1.591 -1.402 11.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 1.759 0.111 10.397 1.00 0.00 H new ATOM 1402 N ALA A 92 2.534 -3.153 6.353 1.00 0.00 N ATOM 1403 CA ALA A 92 3.740 -3.877 5.932 1.00 0.00 C ATOM 1404 C ALA A 92 4.516 -4.483 7.129 1.00 0.00 C ATOM 1405 O ALA A 92 5.358 -5.361 6.939 1.00 0.00 O ATOM 1406 CB ALA A 92 4.610 -2.931 5.098 1.00 0.00 C ATOM 0 H ALA A 92 2.655 -2.141 6.390 1.00 0.00 H new ATOM 0 HA ALA A 92 3.447 -4.731 5.321 1.00 0.00 H new ATOM 0 HB1 ALA A 92 5.511 -3.454 4.777 1.00 0.00 H new ATOM 0 HB2 ALA A 92 4.051 -2.600 4.223 1.00 0.00 H new ATOM 0 HB3 ALA A 92 4.887 -2.066 5.700 1.00 0.00 H new ATOM 1412 N SER A 93 4.234 -4.033 8.360 1.00 0.00 N ATOM 1413 CA SER A 93 4.723 -4.626 9.616 1.00 0.00 C ATOM 1414 C SER A 93 3.787 -5.726 10.146 1.00 0.00 C ATOM 1415 O SER A 93 4.208 -6.866 10.339 1.00 0.00 O ATOM 1416 CB SER A 93 4.907 -3.522 10.663 1.00 0.00 C ATOM 1417 OG SER A 93 3.705 -2.790 10.860 1.00 0.00 O ATOM 0 H SER A 93 3.639 -3.219 8.515 1.00 0.00 H new ATOM 0 HA SER A 93 5.682 -5.103 9.412 1.00 0.00 H new ATOM 0 HB2 SER A 93 5.225 -3.963 11.608 1.00 0.00 H new ATOM 0 HB3 SER A 93 5.699 -2.845 10.345 1.00 0.00 H new ATOM 0 HG SER A 93 3.782 -2.246 11.672 1.00 0.00 H new ATOM 1423 N ALA A 94 2.507 -5.385 10.333 1.00 0.00 N ATOM 1424 CA ALA A 94 1.404 -6.257 10.760 1.00 0.00 C ATOM 1425 C ALA A 94 1.617 -6.990 12.108 1.00 0.00 C ATOM 1426 O ALA A 94 1.239 -8.154 12.269 1.00 0.00 O ATOM 1427 CB ALA A 94 0.965 -7.142 9.584 1.00 0.00 C ATOM 0 H ALA A 94 2.192 -4.427 10.180 1.00 0.00 H new ATOM 0 HA ALA A 94 0.560 -5.618 11.021 1.00 0.00 H new ATOM 0 HB1 ALA A 94 0.147 -7.789 9.901 1.00 0.00 H new ATOM 0 HB2 ALA A 94 0.631 -6.512 8.759 1.00 0.00 H new ATOM 0 HB3 ALA A 94 1.805 -7.754 9.256 1.00 0.00 H new ATOM 1433 N HIS A 95 2.190 -6.285 13.092 1.00 0.00 N ATOM 1434 CA HIS A 95 2.277 -6.708 14.501 1.00 0.00 C ATOM 1435 C HIS A 95 1.458 -5.778 15.410 1.00 0.00 C ATOM 1436 O HIS A 95 1.361 -4.574 15.159 1.00 0.00 O ATOM 1437 CB HIS A 95 3.743 -6.789 14.951 1.00 0.00 C ATOM 1438 CG HIS A 95 4.470 -7.987 14.393 1.00 0.00 C ATOM 1439 ND1 HIS A 95 4.475 -9.266 14.960 1.00 0.00 N ATOM 1440 CD2 HIS A 95 5.216 -8.010 13.251 1.00 0.00 C ATOM 1441 CE1 HIS A 95 5.224 -10.029 14.144 1.00 0.00 C ATOM 1442 NE2 HIS A 95 5.681 -9.300 13.111 1.00 0.00 N ATOM 0 H HIS A 95 2.620 -5.375 12.927 1.00 0.00 H new ATOM 0 HA HIS A 95 1.846 -7.706 14.586 1.00 0.00 H new ATOM 0 HB2 HIS A 95 4.262 -5.881 14.643 1.00 0.00 H new ATOM 0 HB3 HIS A 95 3.781 -6.824 16.040 1.00 0.00 H new ATOM 0 HD2 HIS A 95 5.405 -7.180 12.587 1.00 0.00 H new ATOM 0 HE1 HIS A 95 5.429 -11.078 14.297 1.00 0.00 H new ATOM 0 HE2 HIS A 95 6.271 -9.643 12.353 1.00 0.00 H new ATOM 1450 N ASN A 96 0.863 -6.333 16.470 1.00 0.00 N ATOM 1451 CA ASN A 96 -0.002 -5.603 17.406 1.00 0.00 C ATOM 1452 C ASN A 96 0.804 -4.850 18.484 1.00 0.00 C ATOM 1453 O ASN A 96 1.885 -5.286 18.891 1.00 0.00 O ATOM 1454 CB ASN A 96 -1.009 -6.586 18.035 1.00 0.00 C ATOM 1455 CG ASN A 96 -1.921 -7.237 17.007 1.00 0.00 C ATOM 1456 OD1 ASN A 96 -1.695 -8.352 16.558 1.00 0.00 O ATOM 1457 ND2 ASN A 96 -2.970 -6.563 16.586 1.00 0.00 N ATOM 0 H ASN A 96 0.970 -7.319 16.707 1.00 0.00 H new ATOM 0 HA ASN A 96 -0.544 -4.838 16.850 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -0.464 -7.362 18.573 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -1.617 -6.056 18.769 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -3.591 -6.971 15.887 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -3.162 -5.633 16.958 1.00 0.00 H new ATOM 1464 N LYS A 97 0.239 -3.755 19.012 1.00 0.00 N ATOM 1465 CA LYS A 97 0.815 -2.918 20.090 1.00 0.00 C ATOM 1466 C LYS A 97 0.554 -3.508 21.492 1.00 0.00 C ATOM 1467 O LYS A 97 0.118 -2.811 22.412 1.00 0.00 O ATOM 1468 CB LYS A 97 0.329 -1.460 19.943 1.00 0.00 C ATOM 1469 CG LYS A 97 0.679 -0.831 18.582 1.00 0.00 C ATOM 1470 CD LYS A 97 0.251 0.644 18.545 1.00 0.00 C ATOM 1471 CE LYS A 97 0.405 1.282 17.155 1.00 0.00 C ATOM 1472 NZ LYS A 97 1.821 1.391 16.722 1.00 0.00 N ATOM 0 H LYS A 97 -0.666 -3.410 18.692 1.00 0.00 H new ATOM 0 HA LYS A 97 1.900 -2.914 19.984 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -0.752 -1.430 20.081 1.00 0.00 H new ATOM 0 HB3 LYS A 97 0.769 -0.857 20.737 1.00 0.00 H new ATOM 0 HG2 LYS A 97 1.751 -0.909 18.404 1.00 0.00 H new ATOM 0 HG3 LYS A 97 0.182 -1.380 17.782 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -0.789 0.722 18.861 1.00 0.00 H new ATOM 0 HD3 LYS A 97 0.846 1.207 19.264 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -0.148 0.690 16.426 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -0.044 2.275 17.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 1.893 2.069 15.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 2.403 1.720 17.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 2.160 0.460 16.407 1.00 0.00 H new ATOM 1486 N ASN A 98 0.754 -4.818 21.635 1.00 0.00 N ATOM 1487 CA ASN A 98 0.411 -5.603 22.826 1.00 0.00 C ATOM 1488 C ASN A 98 1.414 -5.396 23.989 1.00 0.00 C ATOM 1489 O ASN A 98 2.563 -5.000 23.774 1.00 0.00 O ATOM 1490 CB ASN A 98 0.284 -7.081 22.396 1.00 0.00 C ATOM 1491 CG ASN A 98 -0.410 -7.973 23.418 1.00 0.00 C ATOM 1492 OD1 ASN A 98 -1.096 -7.523 24.325 1.00 0.00 O ATOM 1493 ND2 ASN A 98 -0.271 -9.273 23.293 1.00 0.00 N ATOM 0 H ASN A 98 1.175 -5.385 20.899 1.00 0.00 H new ATOM 0 HA ASN A 98 -0.541 -5.259 23.231 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -0.267 -7.128 21.456 1.00 0.00 H new ATOM 0 HB3 ASN A 98 1.280 -7.478 22.202 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -0.734 -9.901 23.950 1.00 0.00 H new ATOM 0 HD22 ASN A 98 0.300 -9.655 22.539 1.00 0.00 H new ATOM 1500 N LEU A 99 0.982 -5.692 25.219 1.00 0.00 N ATOM 1501 CA LEU A 99 1.772 -5.619 26.456 1.00 0.00 C ATOM 1502 C LEU A 99 1.421 -6.796 27.388 1.00 0.00 C ATOM 1503 O LEU A 99 0.244 -7.102 27.595 1.00 0.00 O ATOM 1504 CB LEU A 99 1.511 -4.252 27.121 1.00 0.00 C ATOM 1505 CG LEU A 99 2.258 -4.008 28.447 1.00 0.00 C ATOM 1506 CD1 LEU A 99 3.779 -4.000 28.272 1.00 0.00 C ATOM 1507 CD2 LEU A 99 1.841 -2.662 29.039 1.00 0.00 C ATOM 0 H LEU A 99 0.026 -6.004 25.389 1.00 0.00 H new ATOM 0 HA LEU A 99 2.836 -5.702 26.235 1.00 0.00 H new ATOM 0 HB2 LEU A 99 1.788 -3.466 26.418 1.00 0.00 H new ATOM 0 HB3 LEU A 99 0.441 -4.154 27.303 1.00 0.00 H new ATOM 0 HG LEU A 99 1.991 -4.830 29.111 1.00 0.00 H new ATOM 0 HD11 LEU A 99 4.255 -3.824 29.237 1.00 0.00 H new ATOM 0 HD12 LEU A 99 4.105 -4.962 27.876 1.00 0.00 H new ATOM 0 HD13 LEU A 99 4.061 -3.208 27.578 1.00 0.00 H new ATOM 0 HD21 LEU A 99 2.373 -2.496 29.976 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.085 -1.865 28.337 1.00 0.00 H new ATOM 0 HD23 LEU A 99 0.767 -2.664 29.227 1.00 0.00 H new ATOM 1519 N SER A 100 2.435 -7.442 27.971 1.00 0.00 N ATOM 1520 CA SER A 100 2.278 -8.657 28.795 1.00 0.00 C ATOM 1521 C SER A 100 1.584 -8.417 30.147 1.00 0.00 C ATOM 1522 O SER A 100 0.949 -9.330 30.683 1.00 0.00 O ATOM 1523 CB SER A 100 3.654 -9.291 29.049 1.00 0.00 C ATOM 1524 OG SER A 100 4.356 -9.502 27.830 1.00 0.00 O ATOM 0 H SER A 100 3.404 -7.136 27.886 1.00 0.00 H new ATOM 0 HA SER A 100 1.631 -9.322 28.224 1.00 0.00 H new ATOM 0 HB2 SER A 100 4.240 -8.645 29.702 1.00 0.00 H new ATOM 0 HB3 SER A 100 3.529 -10.241 29.569 1.00 0.00 H new ATOM 0 HG SER A 100 5.229 -9.905 28.021 1.00 0.00 H new ATOM 1530 N GLY A 101 1.689 -7.205 30.700 1.00 0.00 N ATOM 1531 CA GLY A 101 1.059 -6.793 31.961 1.00 0.00 C ATOM 1532 C GLY A 101 1.716 -5.553 32.595 1.00 0.00 C ATOM 1533 O GLY A 101 2.600 -4.946 31.979 1.00 0.00 O ATOM 0 H GLY A 101 2.233 -6.458 30.269 1.00 0.00 H new ATOM 0 HA2 GLY A 101 0.004 -6.584 31.781 1.00 0.00 H new ATOM 0 HA3 GLY A 101 1.104 -7.621 32.669 1.00 0.00 H new ATOM 1537 N PRO A 102 1.319 -5.174 33.827 1.00 0.00 N ATOM 1538 CA PRO A 102 1.886 -4.024 34.546 1.00 0.00 C ATOM 1539 C PRO A 102 3.354 -4.197 34.978 1.00 0.00 C ATOM 1540 O PRO A 102 4.051 -3.202 35.194 1.00 0.00 O ATOM 1541 CB PRO A 102 0.985 -3.829 35.775 1.00 0.00 C ATOM 1542 CG PRO A 102 -0.328 -4.503 35.386 1.00 0.00 C ATOM 1543 CD PRO A 102 0.152 -5.678 34.538 1.00 0.00 C ATOM 0 HA PRO A 102 1.907 -3.161 33.881 1.00 0.00 H new ATOM 0 HB2 PRO A 102 1.419 -4.286 36.664 1.00 0.00 H new ATOM 0 HB3 PRO A 102 0.839 -2.772 35.999 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -0.890 -4.834 36.259 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -0.978 -3.833 34.823 1.00 0.00 H new ATOM 0 HD2 PRO A 102 0.408 -6.536 35.160 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -0.622 -6.007 33.844 1.00 0.00 H new ATOM 1551 N SER A 103 3.824 -5.445 35.120 1.00 0.00 N ATOM 1552 CA SER A 103 5.190 -5.821 35.546 1.00 0.00 C ATOM 1553 C SER A 103 5.647 -5.202 36.885 1.00 0.00 C ATOM 1554 O SER A 103 6.840 -4.990 37.113 1.00 0.00 O ATOM 1555 CB SER A 103 6.202 -5.603 34.409 1.00 0.00 C ATOM 1556 OG SER A 103 5.826 -6.347 33.257 1.00 0.00 O ATOM 0 H SER A 103 3.240 -6.260 34.934 1.00 0.00 H new ATOM 0 HA SER A 103 5.149 -6.889 35.761 1.00 0.00 H new ATOM 0 HB2 SER A 103 6.257 -4.543 34.162 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.196 -5.906 34.736 1.00 0.00 H new ATOM 0 HG SER A 103 6.479 -6.196 32.542 1.00 0.00 H new ATOM 1562 N SER A 104 4.697 -4.910 37.783 1.00 0.00 N ATOM 1563 CA SER A 104 4.923 -4.270 39.091 1.00 0.00 C ATOM 1564 C SER A 104 5.212 -5.253 40.243 1.00 0.00 C ATOM 1565 O SER A 104 5.663 -4.828 41.311 1.00 0.00 O ATOM 1566 CB SER A 104 3.713 -3.392 39.432 1.00 0.00 C ATOM 1567 OG SER A 104 2.513 -4.155 39.402 1.00 0.00 O ATOM 0 H SER A 104 3.713 -5.120 37.615 1.00 0.00 H new ATOM 0 HA SER A 104 5.828 -3.671 38.993 1.00 0.00 H new ATOM 0 HB2 SER A 104 3.845 -2.951 40.420 1.00 0.00 H new ATOM 0 HB3 SER A 104 3.644 -2.568 38.722 1.00 0.00 H new ATOM 0 HG SER A 104 1.753 -3.578 39.624 1.00 0.00 H new ATOM 1573 N GLY A 105 4.971 -6.557 40.038 1.00 0.00 N ATOM 1574 CA GLY A 105 5.223 -7.641 41.005 1.00 0.00 C ATOM 1575 C GLY A 105 6.710 -7.956 41.202 1.00 0.00 C ATOM 1576 O GLY A 105 7.177 -7.923 42.363 1.00 0.00 O ATOM 1577 OXT GLY A 105 7.392 -8.261 40.198 1.00 0.00 O ATOM 0 H GLY A 105 4.580 -6.900 39.161 1.00 0.00 H new ATOM 0 HA2 GLY A 105 4.788 -7.367 41.966 1.00 0.00 H new ATOM 0 HA3 GLY A 105 4.711 -8.543 40.669 1.00 0.00 H new TER 1581 GLY A 105