USER MOD reduce.3.24.130724 H: found=0, std=0, add=943, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 943 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 69 ASN : amide:sc= -0.733 K(o=-0.73,f=-2.9) USER MOD Set 1.2: A 112 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 105 ASN : amide:sc= -0.39 K(o=0.88,f=-11!) USER MOD Set 2.2: A 109 THR OG1 : rot -156:sc= 1.27 USER MOD Set 3.1: A 96 TYR OH : rot 180:sc= 0.0481 USER MOD Set 3.2: A 114 LYS NZ :NH3+ 170:sc= 2.06 (180deg=1.85) USER MOD Set 4.1: A 63 THR OG1 : rot -28:sc= 1.16 USER MOD Set 4.2: A 65 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 15 GLN : amide:sc= 0.272 K(o=0.46,f=-2.9!) USER MOD Set 5.2: A 17 GLN : amide:sc= 0.184 K(o=0.46,f=-3.4) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 46:sc= 0.321 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot -150:sc= 0.67 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 133 HIS : no HD1:sc= -0.074 X(o=-0.074,f=-0.074) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 23:sc= 0.694 USER MOD Single : A 141 ASN : amide:sc= -1.36 X(o=-1.4,f=-1.6) USER MOD ----------------------------------------------------------------- ATOM 31 N GLY A 4 -21.455 8.691 0.861 1.00 0.00 N ATOM 32 CA GLY A 4 -20.069 8.926 0.513 1.00 0.00 C ATOM 33 C GLY A 4 -19.866 10.428 0.349 1.00 0.00 C ATOM 34 O GLY A 4 -20.757 11.153 -0.102 1.00 0.00 O ATOM 0 HA2 GLY A 4 -19.411 8.536 1.290 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -19.816 8.405 -0.410 1.00 0.00 H new ATOM 38 N GLU A 5 -18.673 10.906 0.672 1.00 0.00 N ATOM 39 CA GLU A 5 -18.305 12.313 0.581 1.00 0.00 C ATOM 40 C GLU A 5 -16.807 12.371 0.281 1.00 0.00 C ATOM 41 O GLU A 5 -16.048 11.744 1.021 1.00 0.00 O ATOM 42 CB GLU A 5 -18.667 13.015 1.903 1.00 0.00 C ATOM 43 CG GLU A 5 -18.123 14.454 2.012 1.00 0.00 C ATOM 44 CD GLU A 5 -19.167 15.483 2.447 1.00 0.00 C ATOM 45 OE1 GLU A 5 -20.109 15.172 3.217 1.00 0.00 O ATOM 46 OE2 GLU A 5 -19.136 16.615 1.918 1.00 0.00 O ATOM 0 H GLU A 5 -17.916 10.313 1.013 1.00 0.00 H new ATOM 0 HA GLU A 5 -18.844 12.830 -0.213 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -19.752 13.038 2.006 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -18.280 12.426 2.734 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -17.297 14.466 2.724 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -17.715 14.751 1.046 1.00 0.00 H new ATOM 53 N PRO A 6 -16.366 13.043 -0.797 1.00 0.00 N ATOM 54 CA PRO A 6 -14.954 13.143 -1.129 1.00 0.00 C ATOM 55 C PRO A 6 -14.261 14.242 -0.307 1.00 0.00 C ATOM 56 O PRO A 6 -14.896 15.213 0.118 1.00 0.00 O ATOM 57 CB PRO A 6 -14.947 13.491 -2.619 1.00 0.00 C ATOM 58 CG PRO A 6 -16.171 14.397 -2.754 1.00 0.00 C ATOM 59 CD PRO A 6 -17.162 13.801 -1.753 1.00 0.00 C ATOM 0 HA PRO A 6 -14.411 12.224 -0.907 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -14.030 14.002 -2.912 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -15.030 12.602 -3.244 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -15.933 15.433 -2.515 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -16.569 14.387 -3.769 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -17.729 14.586 -1.252 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -17.884 13.157 -2.256 1.00 0.00 H new ATOM 67 N LEU A 7 -12.946 14.120 -0.115 1.00 0.00 N ATOM 68 CA LEU A 7 -12.102 15.051 0.612 1.00 0.00 C ATOM 69 C LEU A 7 -10.964 15.420 -0.333 1.00 0.00 C ATOM 70 O LEU A 7 -10.202 14.550 -0.755 1.00 0.00 O ATOM 71 CB LEU A 7 -11.626 14.413 1.927 1.00 0.00 C ATOM 72 CG LEU A 7 -11.133 15.429 2.975 1.00 0.00 C ATOM 73 CD1 LEU A 7 -10.796 14.667 4.260 1.00 0.00 C ATOM 74 CD2 LEU A 7 -9.915 16.245 2.524 1.00 0.00 C ATOM 0 H LEU A 7 -12.421 13.327 -0.484 1.00 0.00 H new ATOM 0 HA LEU A 7 -12.630 15.957 0.907 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -12.444 13.834 2.355 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -10.820 13.713 1.708 1.00 0.00 H new ATOM 0 HG LEU A 7 -11.935 16.151 3.131 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -10.444 15.368 5.017 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -11.687 14.156 4.625 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -10.016 13.934 4.054 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -9.628 16.938 3.315 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -9.084 15.572 2.312 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -10.166 16.806 1.624 1.00 0.00 H new ATOM 86 N VAL A 8 -10.915 16.675 -0.748 1.00 0.00 N ATOM 87 CA VAL A 8 -9.909 17.241 -1.637 1.00 0.00 C ATOM 88 C VAL A 8 -8.942 17.983 -0.703 1.00 0.00 C ATOM 89 O VAL A 8 -9.363 18.906 0.001 1.00 0.00 O ATOM 90 CB VAL A 8 -10.595 18.165 -2.671 1.00 0.00 C ATOM 91 CG1 VAL A 8 -9.603 18.721 -3.700 1.00 0.00 C ATOM 92 CG2 VAL A 8 -11.711 17.431 -3.440 1.00 0.00 C ATOM 0 H VAL A 8 -11.611 17.363 -0.460 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.369 16.500 -2.226 1.00 0.00 H new ATOM 0 HB VAL A 8 -11.018 18.986 -2.092 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.131 19.364 -4.404 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -8.834 19.299 -3.188 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.138 17.896 -4.240 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -12.168 18.113 -4.156 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -11.287 16.578 -3.970 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -12.468 17.082 -2.738 1.00 0.00 H new ATOM 102 N GLY A 9 -7.683 17.555 -0.659 1.00 0.00 N ATOM 103 CA GLY A 9 -6.613 18.104 0.167 1.00 0.00 C ATOM 104 C GLY A 9 -6.176 19.512 -0.237 1.00 0.00 C ATOM 105 O GLY A 9 -6.611 20.065 -1.257 1.00 0.00 O ATOM 0 H GLY A 9 -7.365 16.772 -1.231 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -6.942 18.121 1.206 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -5.751 17.439 0.117 1.00 0.00 H new ATOM 109 N GLY A 10 -5.319 20.092 0.600 1.00 0.00 N ATOM 110 CA GLY A 10 -4.769 21.428 0.482 1.00 0.00 C ATOM 111 C GLY A 10 -3.666 21.588 -0.557 1.00 0.00 C ATOM 112 O GLY A 10 -3.964 21.643 -1.751 1.00 0.00 O ATOM 0 H GLY A 10 -4.973 19.607 1.428 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -5.578 22.116 0.238 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -4.377 21.729 1.454 1.00 0.00 H new ATOM 116 N ASP A 11 -2.415 21.712 -0.102 1.00 0.00 N ATOM 117 CA ASP A 11 -1.206 21.912 -0.930 1.00 0.00 C ATOM 118 C ASP A 11 0.135 21.776 -0.199 1.00 0.00 C ATOM 119 O ASP A 11 1.213 21.964 -0.767 1.00 0.00 O ATOM 120 CB ASP A 11 -1.238 23.325 -1.499 1.00 0.00 C ATOM 121 CG ASP A 11 -1.214 24.494 -0.495 1.00 0.00 C ATOM 122 OD1 ASP A 11 -2.294 24.889 0.002 1.00 0.00 O ATOM 123 OD2 ASP A 11 -0.166 25.150 -0.291 1.00 0.00 O ATOM 0 H ASP A 11 -2.201 21.675 0.895 1.00 0.00 H new ATOM 0 HA ASP A 11 -1.247 21.119 -1.677 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -0.385 23.438 -2.168 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -2.136 23.423 -2.108 1.00 0.00 H new ATOM 128 N THR A 12 0.043 21.496 1.084 1.00 0.00 N ATOM 129 CA THR A 12 1.101 21.304 2.053 1.00 0.00 C ATOM 130 C THR A 12 0.784 20.082 2.911 1.00 0.00 C ATOM 131 O THR A 12 -0.374 19.668 3.003 1.00 0.00 O ATOM 132 CB THR A 12 1.223 22.559 2.928 1.00 0.00 C ATOM 133 OG1 THR A 12 -0.040 22.990 3.413 1.00 0.00 O ATOM 134 CG2 THR A 12 1.885 23.714 2.179 1.00 0.00 C ATOM 0 H THR A 12 -0.873 21.386 1.519 1.00 0.00 H new ATOM 0 HA THR A 12 2.050 21.139 1.542 1.00 0.00 H new ATOM 0 HB THR A 12 1.852 22.275 3.772 1.00 0.00 H new ATOM 0 HG1 THR A 12 0.078 23.790 3.967 1.00 0.00 H new ATOM 0 HG21 THR A 12 1.952 24.582 2.835 1.00 0.00 H new ATOM 0 HG22 THR A 12 2.886 23.418 1.866 1.00 0.00 H new ATOM 0 HG23 THR A 12 1.290 23.967 1.301 1.00 0.00 H new ATOM 142 N ASP A 13 1.807 19.611 3.621 1.00 0.00 N ATOM 143 CA ASP A 13 1.785 18.456 4.505 1.00 0.00 C ATOM 144 C ASP A 13 0.656 18.556 5.493 1.00 0.00 C ATOM 145 O ASP A 13 0.520 19.536 6.228 1.00 0.00 O ATOM 146 CB ASP A 13 3.111 18.172 5.206 1.00 0.00 C ATOM 147 CG ASP A 13 3.375 19.021 6.448 1.00 0.00 C ATOM 148 OD1 ASP A 13 3.891 20.155 6.294 1.00 0.00 O ATOM 149 OD2 ASP A 13 3.110 18.568 7.587 1.00 0.00 O ATOM 0 H ASP A 13 2.725 20.054 3.590 1.00 0.00 H new ATOM 0 HA ASP A 13 1.616 17.596 3.857 1.00 0.00 H new ATOM 0 HB2 ASP A 13 3.137 17.120 5.490 1.00 0.00 H new ATOM 0 HB3 ASP A 13 3.922 18.331 4.496 1.00 0.00 H new ATOM 154 N ASP A 14 -0.144 17.507 5.449 1.00 0.00 N ATOM 155 CA ASP A 14 -1.332 17.261 6.236 1.00 0.00 C ATOM 156 C ASP A 14 -1.522 15.747 6.249 1.00 0.00 C ATOM 157 O ASP A 14 -0.683 14.986 5.737 1.00 0.00 O ATOM 158 CB ASP A 14 -2.556 17.929 5.569 1.00 0.00 C ATOM 159 CG ASP A 14 -2.718 19.411 5.890 1.00 0.00 C ATOM 160 OD1 ASP A 14 -2.607 19.790 7.081 1.00 0.00 O ATOM 161 OD2 ASP A 14 -3.062 20.199 4.985 1.00 0.00 O ATOM 0 H ASP A 14 0.040 16.739 4.803 1.00 0.00 H new ATOM 0 HA ASP A 14 -1.233 17.667 7.243 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -2.475 17.811 4.488 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -3.457 17.402 5.881 1.00 0.00 H new ATOM 166 N GLN A 15 -2.584 15.300 6.915 1.00 0.00 N ATOM 167 CA GLN A 15 -2.951 13.907 6.997 1.00 0.00 C ATOM 168 C GLN A 15 -4.414 13.802 6.603 1.00 0.00 C ATOM 169 O GLN A 15 -5.245 14.600 7.058 1.00 0.00 O ATOM 170 CB GLN A 15 -2.674 13.312 8.380 1.00 0.00 C ATOM 171 CG GLN A 15 -2.834 11.778 8.352 1.00 0.00 C ATOM 172 CD GLN A 15 -4.131 11.247 8.979 1.00 0.00 C ATOM 173 OE1 GLN A 15 -5.224 11.755 8.744 1.00 0.00 O ATOM 174 NE2 GLN A 15 -4.063 10.200 9.783 1.00 0.00 N ATOM 0 H GLN A 15 -3.220 15.917 7.420 1.00 0.00 H new ATOM 0 HA GLN A 15 -2.338 13.318 6.315 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -1.665 13.572 8.698 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -3.359 13.741 9.111 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -2.785 11.442 7.316 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -1.987 11.330 8.872 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -3.160 9.770 9.985 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -4.913 9.822 10.201 1.00 0.00 H new ATOM 183 N LEU A 16 -4.725 12.803 5.786 1.00 0.00 N ATOM 184 CA LEU A 16 -6.053 12.495 5.301 1.00 0.00 C ATOM 185 C LEU A 16 -6.353 11.069 5.733 1.00 0.00 C ATOM 186 O LEU A 16 -5.518 10.172 5.612 1.00 0.00 O ATOM 187 CB LEU A 16 -6.140 12.630 3.777 1.00 0.00 C ATOM 188 CG LEU A 16 -5.857 14.046 3.243 1.00 0.00 C ATOM 189 CD1 LEU A 16 -6.059 14.019 1.731 1.00 0.00 C ATOM 190 CD2 LEU A 16 -6.776 15.108 3.857 1.00 0.00 C ATOM 0 H LEU A 16 -4.020 12.158 5.430 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.781 13.194 5.712 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.433 11.936 3.323 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.136 12.326 3.455 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.837 14.318 3.514 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -5.866 15.010 1.320 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -5.371 13.301 1.285 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -7.085 13.727 1.506 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.530 16.086 3.443 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -7.814 14.868 3.627 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -6.639 15.127 4.938 1.00 0.00 H new ATOM 202 N GLN A 17 -7.553 10.862 6.250 1.00 0.00 N ATOM 203 CA GLN A 17 -8.043 9.579 6.718 1.00 0.00 C ATOM 204 C GLN A 17 -9.518 9.549 6.358 1.00 0.00 C ATOM 205 O GLN A 17 -10.174 10.593 6.407 1.00 0.00 O ATOM 206 CB GLN A 17 -7.742 9.478 8.216 1.00 0.00 C ATOM 207 CG GLN A 17 -8.255 8.219 8.921 1.00 0.00 C ATOM 208 CD GLN A 17 -7.297 7.690 9.997 1.00 0.00 C ATOM 209 OE1 GLN A 17 -6.428 8.386 10.528 1.00 0.00 O ATOM 210 NE2 GLN A 17 -7.404 6.419 10.330 1.00 0.00 N ATOM 0 H GLN A 17 -8.236 11.611 6.359 1.00 0.00 H new ATOM 0 HA GLN A 17 -7.568 8.710 6.263 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -6.662 9.533 8.354 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -8.171 10.348 8.712 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -9.220 8.436 9.379 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -8.423 7.439 8.179 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -8.120 5.837 9.896 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -6.771 6.018 11.022 1.00 0.00 H new ATOM 219 N GLY A 18 -10.020 8.366 6.029 1.00 0.00 N ATOM 220 CA GLY A 18 -11.400 8.139 5.629 1.00 0.00 C ATOM 221 C GLY A 18 -12.395 8.471 6.735 1.00 0.00 C ATOM 222 O GLY A 18 -12.897 9.593 6.834 1.00 0.00 O ATOM 0 H GLY A 18 -9.460 7.513 6.034 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -11.624 8.745 4.751 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -11.522 7.096 5.337 1.00 0.00 H new ATOM 226 N GLY A 19 -12.627 7.526 7.642 1.00 0.00 N ATOM 227 CA GLY A 19 -13.552 7.675 8.761 1.00 0.00 C ATOM 228 C GLY A 19 -14.848 6.924 8.488 1.00 0.00 C ATOM 229 O GLY A 19 -15.929 7.497 8.639 1.00 0.00 O ATOM 0 H GLY A 19 -12.167 6.616 7.619 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -13.091 7.297 9.674 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -13.765 8.731 8.926 1.00 0.00 H new ATOM 233 N SER A 20 -14.689 5.655 8.134 1.00 0.00 N ATOM 234 CA SER A 20 -15.612 4.592 7.785 1.00 0.00 C ATOM 235 C SER A 20 -16.854 4.992 6.996 1.00 0.00 C ATOM 236 O SER A 20 -17.826 5.543 7.511 1.00 0.00 O ATOM 237 CB SER A 20 -15.941 3.715 8.988 1.00 0.00 C ATOM 238 OG SER A 20 -16.389 4.459 10.111 1.00 0.00 O ATOM 0 H SER A 20 -13.737 5.293 8.078 1.00 0.00 H new ATOM 0 HA SER A 20 -15.055 3.998 7.061 1.00 0.00 H new ATOM 0 HB2 SER A 20 -16.709 2.995 8.706 1.00 0.00 H new ATOM 0 HB3 SER A 20 -15.056 3.144 9.267 1.00 0.00 H new ATOM 0 HG SER A 20 -16.587 3.847 10.851 1.00 0.00 H new ATOM 244 N GLY A 21 -16.890 4.502 5.769 1.00 0.00 N ATOM 245 CA GLY A 21 -17.888 4.676 4.742 1.00 0.00 C ATOM 246 C GLY A 21 -17.144 4.820 3.418 1.00 0.00 C ATOM 247 O GLY A 21 -15.944 5.071 3.443 1.00 0.00 O ATOM 0 H GLY A 21 -16.132 3.906 5.437 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -18.565 3.822 4.713 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -18.496 5.558 4.941 1.00 0.00 H new ATOM 251 N ALA A 22 -17.806 4.628 2.269 1.00 0.00 N ATOM 252 CA ALA A 22 -17.079 4.761 1.015 1.00 0.00 C ATOM 253 C ALA A 22 -16.916 6.235 0.680 1.00 0.00 C ATOM 254 O ALA A 22 -17.730 6.846 -0.020 1.00 0.00 O ATOM 255 CB ALA A 22 -17.747 3.970 -0.102 1.00 0.00 C ATOM 0 H ALA A 22 -18.795 4.392 2.187 1.00 0.00 H new ATOM 0 HA ALA A 22 -16.083 4.331 1.126 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -17.178 4.091 -1.024 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -17.779 2.915 0.168 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -18.762 4.337 -0.251 1.00 0.00 H new ATOM 261 N ASP A 23 -15.774 6.741 1.110 1.00 0.00 N ATOM 262 CA ASP A 23 -15.302 8.095 0.948 1.00 0.00 C ATOM 263 C ASP A 23 -14.231 8.081 -0.145 1.00 0.00 C ATOM 264 O ASP A 23 -13.869 7.013 -0.668 1.00 0.00 O ATOM 265 CB ASP A 23 -14.835 8.637 2.303 1.00 0.00 C ATOM 266 CG ASP A 23 -13.407 8.251 2.663 1.00 0.00 C ATOM 267 OD1 ASP A 23 -12.500 8.993 2.208 1.00 0.00 O ATOM 268 OD2 ASP A 23 -13.253 7.268 3.420 1.00 0.00 O ATOM 0 H ASP A 23 -15.104 6.166 1.621 1.00 0.00 H new ATOM 0 HA ASP A 23 -16.084 8.780 0.622 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -14.916 9.724 2.296 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -15.506 8.272 3.080 1.00 0.00 H new ATOM 273 N ARG A 24 -13.856 9.262 -0.648 1.00 0.00 N ATOM 274 CA ARG A 24 -12.847 9.346 -1.695 1.00 0.00 C ATOM 275 C ARG A 24 -11.937 10.504 -1.329 1.00 0.00 C ATOM 276 O ARG A 24 -12.235 11.653 -1.673 1.00 0.00 O ATOM 277 CB ARG A 24 -13.455 9.499 -3.105 1.00 0.00 C ATOM 278 CG ARG A 24 -14.539 8.480 -3.496 1.00 0.00 C ATOM 279 CD ARG A 24 -15.925 8.868 -2.972 1.00 0.00 C ATOM 280 NE ARG A 24 -16.979 8.037 -3.572 1.00 0.00 N ATOM 281 CZ ARG A 24 -18.299 8.195 -3.453 1.00 0.00 C ATOM 282 NH1 ARG A 24 -18.815 9.283 -2.889 1.00 0.00 N ATOM 283 NH2 ARG A 24 -19.090 7.243 -3.935 1.00 0.00 N ATOM 0 H ARG A 24 -14.234 10.160 -0.348 1.00 0.00 H new ATOM 0 HA ARG A 24 -12.283 8.415 -1.749 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -13.881 10.499 -3.187 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -12.647 9.436 -3.834 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -14.576 8.392 -4.582 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -14.268 7.499 -3.106 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -15.948 8.761 -1.888 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -16.118 9.918 -3.193 1.00 0.00 H new ATOM 0 HE ARG A 24 -16.667 7.252 -4.143 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -18.199 10.016 -2.538 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -19.827 9.384 -2.808 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -18.684 6.420 -4.381 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -20.103 7.335 -3.859 1.00 0.00 H new ATOM 297 N LEU A 25 -10.790 10.207 -0.731 1.00 0.00 N ATOM 298 CA LEU A 25 -9.841 11.229 -0.315 1.00 0.00 C ATOM 299 C LEU A 25 -8.737 11.362 -1.353 1.00 0.00 C ATOM 300 O LEU A 25 -8.373 10.395 -2.031 1.00 0.00 O ATOM 301 CB LEU A 25 -9.382 11.018 1.137 1.00 0.00 C ATOM 302 CG LEU A 25 -8.884 9.616 1.541 1.00 0.00 C ATOM 303 CD1 LEU A 25 -7.431 9.375 1.136 1.00 0.00 C ATOM 304 CD2 LEU A 25 -8.969 9.493 3.061 1.00 0.00 C ATOM 0 H LEU A 25 -10.493 9.254 -0.522 1.00 0.00 H new ATOM 0 HA LEU A 25 -10.324 12.205 -0.284 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -8.581 11.729 1.341 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -10.214 11.279 1.792 1.00 0.00 H new ATOM 0 HG LEU A 25 -9.509 8.883 1.030 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -7.129 8.374 1.443 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -7.335 9.467 0.054 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -6.791 10.112 1.621 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -8.620 8.506 3.366 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -8.345 10.258 3.523 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -10.003 9.627 3.380 1.00 0.00 H new ATOM 316 N ASP A 26 -8.221 12.582 -1.470 1.00 0.00 N ATOM 317 CA ASP A 26 -7.181 12.968 -2.413 1.00 0.00 C ATOM 318 C ASP A 26 -6.294 14.015 -1.782 1.00 0.00 C ATOM 319 O ASP A 26 -6.817 14.958 -1.192 1.00 0.00 O ATOM 320 CB ASP A 26 -7.900 13.548 -3.648 1.00 0.00 C ATOM 321 CG ASP A 26 -7.022 13.835 -4.864 1.00 0.00 C ATOM 322 OD1 ASP A 26 -6.486 14.958 -4.985 1.00 0.00 O ATOM 323 OD2 ASP A 26 -7.068 13.032 -5.827 1.00 0.00 O ATOM 0 H ASP A 26 -8.530 13.359 -0.886 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.556 12.120 -2.692 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -8.683 12.852 -3.947 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -8.393 14.475 -3.354 1.00 0.00 H new ATOM 328 N GLY A 27 -4.977 13.834 -1.862 1.00 0.00 N ATOM 329 CA GLY A 27 -4.020 14.772 -1.300 1.00 0.00 C ATOM 330 C GLY A 27 -3.924 15.972 -2.222 1.00 0.00 C ATOM 331 O GLY A 27 -4.295 17.084 -1.842 1.00 0.00 O ATOM 0 H GLY A 27 -4.548 13.030 -2.320 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -4.335 15.084 -0.304 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -3.044 14.298 -1.192 1.00 0.00 H new ATOM 335 N GLY A 28 -3.531 15.732 -3.469 1.00 0.00 N ATOM 336 CA GLY A 28 -3.373 16.757 -4.494 1.00 0.00 C ATOM 337 C GLY A 28 -1.910 16.903 -4.907 1.00 0.00 C ATOM 338 O GLY A 28 -1.558 16.429 -5.991 1.00 0.00 O ATOM 0 H GLY A 28 -3.308 14.794 -3.803 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -3.976 16.500 -5.365 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -3.745 17.711 -4.119 1.00 0.00 H new ATOM 342 N ALA A 29 -1.090 17.629 -4.136 1.00 0.00 N ATOM 343 CA ALA A 29 0.327 17.845 -4.392 1.00 0.00 C ATOM 344 C ALA A 29 1.043 18.209 -3.091 1.00 0.00 C ATOM 345 O ALA A 29 0.719 19.232 -2.484 1.00 0.00 O ATOM 346 CB ALA A 29 0.525 18.997 -5.384 1.00 0.00 C ATOM 0 H ALA A 29 -1.413 18.096 -3.289 1.00 0.00 H new ATOM 0 HA ALA A 29 0.738 16.925 -4.807 1.00 0.00 H new ATOM 0 HB1 ALA A 29 1.590 19.144 -5.563 1.00 0.00 H new ATOM 0 HB2 ALA A 29 0.029 18.757 -6.324 1.00 0.00 H new ATOM 0 HB3 ALA A 29 0.097 19.910 -4.971 1.00 0.00 H new ATOM 352 N GLY A 30 2.045 17.420 -2.711 1.00 0.00 N ATOM 353 CA GLY A 30 2.852 17.623 -1.515 1.00 0.00 C ATOM 354 C GLY A 30 2.994 16.319 -0.762 1.00 0.00 C ATOM 355 O GLY A 30 2.124 15.456 -0.839 1.00 0.00 O ATOM 0 H GLY A 30 2.325 16.597 -3.245 1.00 0.00 H new ATOM 0 HA2 GLY A 30 3.836 18.003 -1.790 1.00 0.00 H new ATOM 0 HA3 GLY A 30 2.388 18.374 -0.875 1.00 0.00 H new ATOM 359 N ASP A 31 4.154 16.121 -0.138 1.00 0.00 N ATOM 360 CA ASP A 31 4.505 14.949 0.658 1.00 0.00 C ATOM 361 C ASP A 31 3.589 14.971 1.879 1.00 0.00 C ATOM 362 O ASP A 31 3.939 15.504 2.941 1.00 0.00 O ATOM 363 CB ASP A 31 5.995 14.964 1.020 1.00 0.00 C ATOM 364 CG ASP A 31 6.522 13.615 1.530 1.00 0.00 C ATOM 365 OD1 ASP A 31 5.939 12.986 2.447 1.00 0.00 O ATOM 366 OD2 ASP A 31 7.606 13.211 1.042 1.00 0.00 O ATOM 0 H ASP A 31 4.909 16.806 -0.176 1.00 0.00 H new ATOM 0 HA ASP A 31 4.358 14.020 0.107 1.00 0.00 H new ATOM 0 HB2 ASP A 31 6.570 15.260 0.142 1.00 0.00 H new ATOM 0 HB3 ASP A 31 6.166 15.723 1.784 1.00 0.00 H new ATOM 371 N ASP A 32 2.393 14.437 1.680 1.00 0.00 N ATOM 372 CA ASP A 32 1.284 14.337 2.608 1.00 0.00 C ATOM 373 C ASP A 32 1.009 12.850 2.841 1.00 0.00 C ATOM 374 O ASP A 32 1.552 11.980 2.142 1.00 0.00 O ATOM 375 CB ASP A 32 0.016 15.054 2.081 1.00 0.00 C ATOM 376 CG ASP A 32 0.185 16.423 1.381 1.00 0.00 C ATOM 377 OD1 ASP A 32 1.179 17.141 1.647 1.00 0.00 O ATOM 378 OD2 ASP A 32 -0.731 16.798 0.607 1.00 0.00 O ATOM 0 H ASP A 32 2.156 14.025 0.778 1.00 0.00 H new ATOM 0 HA ASP A 32 1.547 14.833 3.542 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -0.479 14.381 1.381 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -0.662 15.193 2.923 1.00 0.00 H new ATOM 383 N ILE A 33 0.244 12.533 3.891 1.00 0.00 N ATOM 384 CA ILE A 33 -0.088 11.146 4.204 1.00 0.00 C ATOM 385 C ILE A 33 -1.586 10.902 4.098 1.00 0.00 C ATOM 386 O ILE A 33 -2.393 11.697 4.581 1.00 0.00 O ATOM 387 CB ILE A 33 0.555 10.647 5.506 1.00 0.00 C ATOM 388 CG1 ILE A 33 -0.151 10.825 6.848 1.00 0.00 C ATOM 389 CG2 ILE A 33 2.035 11.040 5.629 1.00 0.00 C ATOM 390 CD1 ILE A 33 -0.972 9.547 7.170 1.00 0.00 C ATOM 0 H ILE A 33 -0.154 13.218 4.534 1.00 0.00 H new ATOM 0 HA ILE A 33 0.370 10.517 3.441 1.00 0.00 H new ATOM 0 HB ILE A 33 0.429 9.578 5.336 1.00 0.00 H new ATOM 0 HG12 ILE A 33 0.580 11.009 7.635 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.808 11.694 6.814 1.00 0.00 H new ATOM 0 HG21 ILE A 33 2.435 10.660 6.569 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.595 10.613 4.797 1.00 0.00 H new ATOM 0 HG23 ILE A 33 2.126 12.126 5.609 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -1.477 9.671 8.128 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -1.713 9.384 6.387 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -0.303 8.688 7.221 1.00 0.00 H new ATOM 402 N LEU A 34 -1.952 9.775 3.487 1.00 0.00 N ATOM 403 CA LEU A 34 -3.333 9.377 3.267 1.00 0.00 C ATOM 404 C LEU A 34 -3.531 7.952 3.785 1.00 0.00 C ATOM 405 O LEU A 34 -2.606 7.143 3.750 1.00 0.00 O ATOM 406 CB LEU A 34 -3.702 9.504 1.767 1.00 0.00 C ATOM 407 CG LEU A 34 -3.320 10.828 1.074 1.00 0.00 C ATOM 408 CD1 LEU A 34 -1.884 10.845 0.533 1.00 0.00 C ATOM 409 CD2 LEU A 34 -4.244 10.993 -0.128 1.00 0.00 C ATOM 0 H LEU A 34 -1.277 9.101 3.125 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.002 10.039 3.816 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.224 8.686 1.228 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.779 9.365 1.668 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.408 11.621 1.816 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.685 11.806 0.059 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.184 10.694 1.355 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.762 10.047 -0.199 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -4.004 11.921 -0.646 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -4.109 10.152 -0.809 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -5.280 11.023 0.211 1.00 0.00 H new ATOM 421 N ASP A 35 -4.731 7.626 4.258 1.00 0.00 N ATOM 422 CA ASP A 35 -5.121 6.306 4.773 1.00 0.00 C ATOM 423 C ASP A 35 -6.502 6.028 4.200 1.00 0.00 C ATOM 424 O ASP A 35 -7.461 6.714 4.549 1.00 0.00 O ATOM 425 CB ASP A 35 -5.049 6.195 6.306 1.00 0.00 C ATOM 426 CG ASP A 35 -6.020 5.152 6.896 1.00 0.00 C ATOM 427 OD1 ASP A 35 -5.793 3.930 6.740 1.00 0.00 O ATOM 428 OD2 ASP A 35 -6.966 5.527 7.619 1.00 0.00 O ATOM 0 H ASP A 35 -5.495 8.300 4.297 1.00 0.00 H new ATOM 0 HA ASP A 35 -4.413 5.542 4.453 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -4.031 5.936 6.596 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.266 7.170 6.743 1.00 0.00 H new ATOM 433 N GLY A 36 -6.531 5.098 3.242 1.00 0.00 N ATOM 434 CA GLY A 36 -7.639 4.585 2.452 1.00 0.00 C ATOM 435 C GLY A 36 -8.993 4.690 3.110 1.00 0.00 C ATOM 436 O GLY A 36 -9.872 5.366 2.579 1.00 0.00 O ATOM 0 H GLY A 36 -5.664 4.632 2.973 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.670 5.123 1.504 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.445 3.538 2.219 1.00 0.00 H new ATOM 440 N GLY A 37 -9.154 4.020 4.247 1.00 0.00 N ATOM 441 CA GLY A 37 -10.396 4.024 4.982 1.00 0.00 C ATOM 442 C GLY A 37 -10.676 2.664 5.595 1.00 0.00 C ATOM 443 O GLY A 37 -9.795 2.069 6.213 1.00 0.00 O ATOM 0 H GLY A 37 -8.419 3.460 4.679 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -10.354 4.778 5.768 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -11.214 4.301 4.317 1.00 0.00 H new ATOM 447 N ALA A 38 -11.960 2.307 5.680 1.00 0.00 N ATOM 448 CA ALA A 38 -12.420 1.028 6.199 1.00 0.00 C ATOM 449 C ALA A 38 -13.224 0.335 5.099 1.00 0.00 C ATOM 450 O ALA A 38 -14.430 0.584 4.960 1.00 0.00 O ATOM 451 CB ALA A 38 -13.281 1.264 7.452 1.00 0.00 C ATOM 0 H ALA A 38 -12.721 2.917 5.382 1.00 0.00 H new ATOM 0 HA ALA A 38 -11.580 0.395 6.485 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -13.626 0.306 7.842 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -12.687 1.772 8.211 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -14.141 1.881 7.192 1.00 0.00 H new ATOM 457 N GLY A 39 -12.653 -0.694 4.479 1.00 0.00 N ATOM 458 CA GLY A 39 -13.330 -1.411 3.416 1.00 0.00 C ATOM 459 C GLY A 39 -12.939 -0.873 2.055 1.00 0.00 C ATOM 460 O GLY A 39 -11.842 -0.356 1.863 1.00 0.00 O ATOM 0 H GLY A 39 -11.721 -1.046 4.699 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -13.084 -2.471 3.475 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -14.409 -1.327 3.547 1.00 0.00 H new ATOM 464 N ARG A 40 -13.805 -1.127 1.070 1.00 0.00 N ATOM 465 CA ARG A 40 -13.551 -0.682 -0.279 1.00 0.00 C ATOM 466 C ARG A 40 -13.983 0.776 -0.377 1.00 0.00 C ATOM 467 O ARG A 40 -15.139 1.083 -0.688 1.00 0.00 O ATOM 468 CB ARG A 40 -14.149 -1.657 -1.299 1.00 0.00 C ATOM 469 CG ARG A 40 -15.660 -1.913 -1.346 1.00 0.00 C ATOM 470 CD ARG A 40 -16.179 -2.760 -0.181 1.00 0.00 C ATOM 471 NE ARG A 40 -17.580 -3.117 -0.404 1.00 0.00 N ATOM 472 CZ ARG A 40 -18.437 -3.625 0.480 1.00 0.00 C ATOM 473 NH1 ARG A 40 -18.102 -3.801 1.755 1.00 0.00 N ATOM 474 NH2 ARG A 40 -19.650 -3.950 0.054 1.00 0.00 N ATOM 0 H ARG A 40 -14.680 -1.637 1.193 1.00 0.00 H new ATOM 0 HA ARG A 40 -12.491 -0.697 -0.535 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -13.852 -1.308 -2.288 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -13.665 -2.621 -1.143 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -16.181 -0.956 -1.348 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -15.906 -2.412 -2.284 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -15.577 -3.663 -0.081 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -16.081 -2.207 0.753 1.00 0.00 H new ATOM 0 HE ARG A 40 -17.942 -2.959 -1.344 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -17.169 -3.545 2.077 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -18.778 -4.192 2.411 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -19.902 -3.808 -0.924 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -20.331 -4.342 0.705 1.00 0.00 H new ATOM 488 N ASP A 41 -12.972 1.611 -0.218 1.00 0.00 N ATOM 489 CA ASP A 41 -12.898 3.067 -0.206 1.00 0.00 C ATOM 490 C ASP A 41 -11.907 3.426 -1.329 1.00 0.00 C ATOM 491 O ASP A 41 -11.298 2.513 -1.907 1.00 0.00 O ATOM 492 CB ASP A 41 -12.560 3.559 1.217 1.00 0.00 C ATOM 493 CG ASP A 41 -13.621 3.147 2.264 1.00 0.00 C ATOM 494 OD1 ASP A 41 -14.699 2.627 1.884 1.00 0.00 O ATOM 495 OD2 ASP A 41 -13.379 3.282 3.484 1.00 0.00 O ATOM 0 H ASP A 41 -12.040 1.224 -0.072 1.00 0.00 H new ATOM 0 HA ASP A 41 -13.834 3.582 -0.419 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -11.590 3.159 1.513 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -12.468 4.645 1.208 1.00 0.00 H new ATOM 500 N ARG A 42 -11.861 4.678 -1.809 1.00 0.00 N ATOM 501 CA ARG A 42 -10.957 5.036 -2.914 1.00 0.00 C ATOM 502 C ARG A 42 -9.992 6.191 -2.660 1.00 0.00 C ATOM 503 O ARG A 42 -10.384 7.355 -2.794 1.00 0.00 O ATOM 504 CB ARG A 42 -11.823 5.329 -4.141 1.00 0.00 C ATOM 505 CG ARG A 42 -10.977 5.298 -5.420 1.00 0.00 C ATOM 506 CD ARG A 42 -11.789 5.824 -6.597 1.00 0.00 C ATOM 507 NE ARG A 42 -11.922 7.287 -6.550 1.00 0.00 N ATOM 508 CZ ARG A 42 -13.020 7.977 -6.857 1.00 0.00 C ATOM 509 NH1 ARG A 42 -14.078 7.336 -7.347 1.00 0.00 N ATOM 510 NH2 ARG A 42 -13.054 9.285 -6.643 1.00 0.00 N ATOM 0 H ARG A 42 -12.429 5.449 -1.457 1.00 0.00 H new ATOM 0 HA ARG A 42 -10.294 4.182 -3.054 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -12.624 4.594 -4.211 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -12.295 6.306 -4.035 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -10.080 5.903 -5.287 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -10.647 4.279 -5.622 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -11.309 5.531 -7.531 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -12.779 5.367 -6.590 1.00 0.00 H new ATOM 0 HE ARG A 42 -11.103 7.820 -6.257 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -14.044 6.326 -7.484 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -14.923 7.855 -7.585 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -12.242 9.758 -6.245 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -13.892 9.818 -6.876 1.00 0.00 H new ATOM 524 N LEU A 43 -8.719 5.897 -2.410 1.00 0.00 N ATOM 525 CA LEU A 43 -7.713 6.917 -2.185 1.00 0.00 C ATOM 526 C LEU A 43 -7.025 7.307 -3.499 1.00 0.00 C ATOM 527 O LEU A 43 -7.034 6.559 -4.478 1.00 0.00 O ATOM 528 CB LEU A 43 -6.740 6.395 -1.122 1.00 0.00 C ATOM 529 CG LEU A 43 -5.700 5.330 -1.527 1.00 0.00 C ATOM 530 CD1 LEU A 43 -4.463 5.969 -2.181 1.00 0.00 C ATOM 531 CD2 LEU A 43 -5.203 4.604 -0.270 1.00 0.00 C ATOM 0 H LEU A 43 -8.361 4.943 -2.359 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.167 7.836 -1.814 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.197 7.251 -0.722 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.333 5.984 -0.305 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.186 4.653 -2.230 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.752 5.189 -2.453 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -4.765 6.513 -3.076 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.995 6.658 -1.478 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.468 3.850 -0.552 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.744 5.323 0.408 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -6.044 4.122 0.228 1.00 0.00 H new ATOM 543 N SER A 44 -6.400 8.479 -3.503 1.00 0.00 N ATOM 544 CA SER A 44 -5.656 9.095 -4.595 1.00 0.00 C ATOM 545 C SER A 44 -4.579 9.927 -3.927 1.00 0.00 C ATOM 546 O SER A 44 -4.918 10.702 -3.040 1.00 0.00 O ATOM 547 CB SER A 44 -6.592 10.030 -5.371 1.00 0.00 C ATOM 548 OG SER A 44 -7.629 9.347 -6.053 1.00 0.00 O ATOM 0 H SER A 44 -6.401 9.072 -2.673 1.00 0.00 H new ATOM 0 HA SER A 44 -5.244 8.356 -5.282 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.033 10.747 -4.679 1.00 0.00 H new ATOM 0 HB3 SER A 44 -6.007 10.601 -6.092 1.00 0.00 H new ATOM 0 HG SER A 44 -8.192 9.995 -6.526 1.00 0.00 H new ATOM 554 N GLY A 45 -3.298 9.744 -4.232 1.00 0.00 N ATOM 555 CA GLY A 45 -2.297 10.591 -3.597 1.00 0.00 C ATOM 556 C GLY A 45 -2.378 11.942 -4.280 1.00 0.00 C ATOM 557 O GLY A 45 -2.767 12.933 -3.664 1.00 0.00 O ATOM 0 H GLY A 45 -2.940 9.048 -4.886 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -2.490 10.685 -2.528 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -1.301 10.161 -3.705 1.00 0.00 H new ATOM 561 N GLY A 46 -2.195 11.921 -5.596 1.00 0.00 N ATOM 562 CA GLY A 46 -2.189 13.106 -6.439 1.00 0.00 C ATOM 563 C GLY A 46 -0.849 13.131 -7.156 1.00 0.00 C ATOM 564 O GLY A 46 -0.225 12.080 -7.318 1.00 0.00 O ATOM 0 H GLY A 46 -2.043 11.057 -6.116 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -3.010 13.074 -7.156 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -2.323 14.007 -5.840 1.00 0.00 H new ATOM 568 N ALA A 47 -0.471 14.289 -7.689 1.00 0.00 N ATOM 569 CA ALA A 47 0.802 14.456 -8.374 1.00 0.00 C ATOM 570 C ALA A 47 1.828 14.574 -7.253 1.00 0.00 C ATOM 571 O ALA A 47 1.925 15.652 -6.658 1.00 0.00 O ATOM 572 CB ALA A 47 0.787 15.714 -9.256 1.00 0.00 C ATOM 0 H ALA A 47 -1.039 15.136 -7.657 1.00 0.00 H new ATOM 0 HA ALA A 47 1.026 13.627 -9.045 1.00 0.00 H new ATOM 0 HB1 ALA A 47 1.749 15.818 -9.758 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -0.004 15.626 -10.001 1.00 0.00 H new ATOM 0 HB3 ALA A 47 0.605 16.591 -8.635 1.00 0.00 H new ATOM 578 N GLY A 48 2.630 13.544 -6.970 1.00 0.00 N ATOM 579 CA GLY A 48 3.565 13.681 -5.873 1.00 0.00 C ATOM 580 C GLY A 48 4.366 12.438 -5.525 1.00 0.00 C ATOM 581 O GLY A 48 4.731 11.635 -6.382 1.00 0.00 O ATOM 0 H GLY A 48 2.647 12.651 -7.463 1.00 0.00 H new ATOM 0 HA2 GLY A 48 4.262 14.484 -6.113 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.012 13.994 -4.987 1.00 0.00 H new ATOM 585 N ALA A 49 4.739 12.404 -4.247 1.00 0.00 N ATOM 586 CA ALA A 49 5.515 11.434 -3.493 1.00 0.00 C ATOM 587 C ALA A 49 4.781 11.231 -2.161 1.00 0.00 C ATOM 588 O ALA A 49 5.319 11.473 -1.077 1.00 0.00 O ATOM 589 CB ALA A 49 6.909 12.044 -3.286 1.00 0.00 C ATOM 0 H ALA A 49 4.460 13.170 -3.634 1.00 0.00 H new ATOM 0 HA ALA A 49 5.623 10.471 -3.993 1.00 0.00 H new ATOM 0 HB1 ALA A 49 7.530 11.349 -2.722 1.00 0.00 H new ATOM 0 HB2 ALA A 49 7.369 12.238 -4.255 1.00 0.00 H new ATOM 0 HB3 ALA A 49 6.818 12.980 -2.734 1.00 0.00 H new ATOM 595 N ASP A 50 3.525 10.830 -2.263 1.00 0.00 N ATOM 596 CA ASP A 50 2.585 10.619 -1.158 1.00 0.00 C ATOM 597 C ASP A 50 2.839 9.321 -0.408 1.00 0.00 C ATOM 598 O ASP A 50 3.636 8.491 -0.840 1.00 0.00 O ATOM 599 CB ASP A 50 1.133 10.720 -1.630 1.00 0.00 C ATOM 600 CG ASP A 50 0.818 12.131 -2.130 1.00 0.00 C ATOM 601 OD1 ASP A 50 1.262 12.472 -3.250 1.00 0.00 O ATOM 602 OD2 ASP A 50 0.232 12.912 -1.353 1.00 0.00 O ATOM 0 H ASP A 50 3.103 10.629 -3.169 1.00 0.00 H new ATOM 0 HA ASP A 50 2.761 11.425 -0.446 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.955 9.999 -2.428 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.461 10.462 -0.811 1.00 0.00 H new ATOM 607 N THR A 51 2.235 9.165 0.772 1.00 0.00 N ATOM 608 CA THR A 51 2.396 7.976 1.611 1.00 0.00 C ATOM 609 C THR A 51 1.029 7.391 1.976 1.00 0.00 C ATOM 610 O THR A 51 0.243 8.045 2.661 1.00 0.00 O ATOM 611 CB THR A 51 3.216 8.345 2.855 1.00 0.00 C ATOM 612 OG1 THR A 51 4.441 8.951 2.486 1.00 0.00 O ATOM 613 CG2 THR A 51 3.566 7.128 3.720 1.00 0.00 C ATOM 0 H THR A 51 1.615 9.867 1.176 1.00 0.00 H new ATOM 0 HA THR A 51 2.936 7.204 1.063 1.00 0.00 H new ATOM 0 HB THR A 51 2.586 9.027 3.426 1.00 0.00 H new ATOM 0 HG1 THR A 51 4.948 9.180 3.292 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.146 7.451 4.585 1.00 0.00 H new ATOM 0 HG22 THR A 51 2.649 6.646 4.058 1.00 0.00 H new ATOM 0 HG23 THR A 51 4.153 6.421 3.133 1.00 0.00 H new ATOM 621 N PHE A 52 0.752 6.156 1.546 1.00 0.00 N ATOM 622 CA PHE A 52 -0.495 5.445 1.804 1.00 0.00 C ATOM 623 C PHE A 52 -0.254 4.558 3.026 1.00 0.00 C ATOM 624 O PHE A 52 0.582 3.646 2.985 1.00 0.00 O ATOM 625 CB PHE A 52 -0.920 4.667 0.553 1.00 0.00 C ATOM 626 CG PHE A 52 -0.859 5.470 -0.737 1.00 0.00 C ATOM 627 CD1 PHE A 52 -1.401 6.769 -0.787 1.00 0.00 C ATOM 628 CD2 PHE A 52 -0.197 4.953 -1.869 1.00 0.00 C ATOM 629 CE1 PHE A 52 -1.265 7.550 -1.945 1.00 0.00 C ATOM 630 CE2 PHE A 52 -0.070 5.738 -3.029 1.00 0.00 C ATOM 631 CZ PHE A 52 -0.594 7.037 -3.065 1.00 0.00 C ATOM 0 H PHE A 52 1.413 5.611 0.992 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.323 6.120 2.022 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.281 3.790 0.451 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -1.939 4.305 0.694 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -1.924 7.166 0.070 1.00 0.00 H new ATOM 0 HD2 PHE A 52 0.213 3.954 -1.846 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -1.678 8.548 -1.974 1.00 0.00 H new ATOM 0 HE2 PHE A 52 0.434 5.338 -3.896 1.00 0.00 H new ATOM 0 HZ PHE A 52 -0.482 7.642 -3.953 1.00 0.00 H new ATOM 641 N VAL A 53 -0.933 4.848 4.132 1.00 0.00 N ATOM 642 CA VAL A 53 -0.808 4.148 5.403 1.00 0.00 C ATOM 643 C VAL A 53 -1.884 3.083 5.617 1.00 0.00 C ATOM 644 O VAL A 53 -3.035 3.423 5.857 1.00 0.00 O ATOM 645 CB VAL A 53 -0.809 5.216 6.523 1.00 0.00 C ATOM 646 CG1 VAL A 53 -0.796 4.579 7.919 1.00 0.00 C ATOM 647 CG2 VAL A 53 0.458 6.086 6.391 1.00 0.00 C ATOM 0 H VAL A 53 -1.612 5.608 4.167 1.00 0.00 H new ATOM 0 HA VAL A 53 0.127 3.587 5.414 1.00 0.00 H new ATOM 0 HB VAL A 53 -1.718 5.808 6.413 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -0.797 5.363 8.677 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -1.681 3.954 8.042 1.00 0.00 H new ATOM 0 HG13 VAL A 53 0.099 3.967 8.031 1.00 0.00 H new ATOM 0 HG21 VAL A 53 0.464 6.841 7.177 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.343 5.457 6.485 1.00 0.00 H new ATOM 0 HG23 VAL A 53 0.463 6.576 5.417 1.00 0.00 H new ATOM 657 N PHE A 54 -1.504 1.799 5.626 1.00 0.00 N ATOM 658 CA PHE A 54 -2.426 0.690 5.850 1.00 0.00 C ATOM 659 C PHE A 54 -2.029 0.025 7.169 1.00 0.00 C ATOM 660 O PHE A 54 -1.100 -0.785 7.225 1.00 0.00 O ATOM 661 CB PHE A 54 -2.381 -0.303 4.684 1.00 0.00 C ATOM 662 CG PHE A 54 -2.955 0.214 3.380 1.00 0.00 C ATOM 663 CD1 PHE A 54 -2.156 0.959 2.495 1.00 0.00 C ATOM 664 CD2 PHE A 54 -4.290 -0.060 3.040 1.00 0.00 C ATOM 665 CE1 PHE A 54 -2.659 1.350 1.241 1.00 0.00 C ATOM 666 CE2 PHE A 54 -4.806 0.362 1.805 1.00 0.00 C ATOM 667 CZ PHE A 54 -3.986 1.046 0.894 1.00 0.00 C ATOM 0 H PHE A 54 -0.539 1.504 5.476 1.00 0.00 H new ATOM 0 HA PHE A 54 -3.453 1.050 5.908 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -1.345 -0.597 4.516 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -2.925 -1.203 4.972 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -1.151 1.233 2.780 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -4.922 -0.597 3.732 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -2.026 1.883 0.546 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -5.837 0.160 1.555 1.00 0.00 H new ATOM 0 HZ PHE A 54 -4.374 1.338 -0.071 1.00 0.00 H new ATOM 677 N SER A 55 -2.722 0.364 8.259 1.00 0.00 N ATOM 678 CA SER A 55 -2.456 -0.188 9.591 1.00 0.00 C ATOM 679 C SER A 55 -3.407 -1.338 9.958 1.00 0.00 C ATOM 680 O SER A 55 -3.244 -1.969 11.007 1.00 0.00 O ATOM 681 CB SER A 55 -2.519 0.944 10.620 1.00 0.00 C ATOM 682 OG SER A 55 -1.596 1.966 10.275 1.00 0.00 O ATOM 0 H SER A 55 -3.490 1.035 8.242 1.00 0.00 H new ATOM 0 HA SER A 55 -1.457 -0.624 9.588 1.00 0.00 H new ATOM 0 HB2 SER A 55 -3.528 1.353 10.661 1.00 0.00 H new ATOM 0 HB3 SER A 55 -2.291 0.557 11.613 1.00 0.00 H new ATOM 0 HG SER A 55 -1.644 2.687 10.937 1.00 0.00 H new ATOM 688 N ALA A 56 -4.371 -1.644 9.083 1.00 0.00 N ATOM 689 CA ALA A 56 -5.390 -2.681 9.222 1.00 0.00 C ATOM 690 C ALA A 56 -6.263 -2.619 10.450 1.00 0.00 C ATOM 691 O ALA A 56 -6.905 -3.604 10.836 1.00 0.00 O ATOM 692 CB ALA A 56 -4.867 -4.064 8.974 1.00 0.00 C ATOM 0 H ALA A 56 -4.463 -1.138 8.202 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.074 -2.430 8.412 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.675 -4.786 9.094 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -4.471 -4.127 7.960 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -4.074 -4.286 9.688 1.00 0.00 H new ATOM 698 N ARG A 57 -6.305 -1.462 11.088 1.00 0.00 N ATOM 699 CA ARG A 57 -7.170 -1.344 12.234 1.00 0.00 C ATOM 700 C ARG A 57 -8.586 -1.530 11.682 1.00 0.00 C ATOM 701 O ARG A 57 -9.458 -2.022 12.398 1.00 0.00 O ATOM 702 CB ARG A 57 -6.963 0.009 12.923 1.00 0.00 C ATOM 703 CG ARG A 57 -5.495 0.280 13.293 1.00 0.00 C ATOM 704 CD ARG A 57 -4.910 -0.762 14.255 1.00 0.00 C ATOM 705 NE ARG A 57 -3.710 -0.207 14.898 1.00 0.00 N ATOM 706 CZ ARG A 57 -3.656 0.301 16.129 1.00 0.00 C ATOM 707 NH1 ARG A 57 -4.442 -0.179 17.089 1.00 0.00 N ATOM 708 NH2 ARG A 57 -2.800 1.286 16.387 1.00 0.00 N ATOM 0 H ARG A 57 -5.773 -0.627 10.842 1.00 0.00 H new ATOM 0 HA ARG A 57 -6.963 -2.086 13.005 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.318 0.803 12.266 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.572 0.047 13.826 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -4.896 0.301 12.383 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -5.418 1.268 13.748 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -5.649 -1.033 15.009 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.658 -1.674 13.713 1.00 0.00 H new ATOM 0 HE ARG A 57 -2.846 -0.211 14.356 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -5.090 -0.940 16.885 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.396 0.214 18.029 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -2.195 1.643 15.647 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -2.748 1.684 17.325 1.00 0.00 H new ATOM 722 N GLU A 58 -8.830 -0.942 10.508 1.00 0.00 N ATOM 723 CA GLU A 58 -10.047 -0.961 9.734 1.00 0.00 C ATOM 724 C GLU A 58 -9.957 -1.805 8.473 1.00 0.00 C ATOM 725 O GLU A 58 -10.902 -2.530 8.161 1.00 0.00 O ATOM 726 CB GLU A 58 -10.392 0.486 9.424 1.00 0.00 C ATOM 727 CG GLU A 58 -10.853 1.332 10.628 1.00 0.00 C ATOM 728 CD GLU A 58 -11.800 0.622 11.609 1.00 0.00 C ATOM 729 OE1 GLU A 58 -12.790 -0.037 11.202 1.00 0.00 O ATOM 730 OE2 GLU A 58 -11.542 0.707 12.837 1.00 0.00 O ATOM 0 H GLU A 58 -8.106 -0.394 10.044 1.00 0.00 H new ATOM 0 HA GLU A 58 -10.836 -1.440 10.314 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.518 0.963 8.981 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -11.179 0.500 8.670 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -9.971 1.664 11.176 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -11.350 2.227 10.253 1.00 0.00 H new ATOM 737 N ASP A 59 -8.802 -1.751 7.787 1.00 0.00 N ATOM 738 CA ASP A 59 -8.550 -2.469 6.559 1.00 0.00 C ATOM 739 C ASP A 59 -8.550 -3.945 6.920 1.00 0.00 C ATOM 740 O ASP A 59 -7.553 -4.510 7.386 1.00 0.00 O ATOM 741 CB ASP A 59 -7.226 -2.034 5.935 1.00 0.00 C ATOM 742 CG ASP A 59 -7.297 -0.711 5.207 1.00 0.00 C ATOM 743 OD1 ASP A 59 -7.795 -0.718 4.066 1.00 0.00 O ATOM 744 OD2 ASP A 59 -6.787 0.264 5.804 1.00 0.00 O ATOM 0 H ASP A 59 -8.008 -1.188 8.092 1.00 0.00 H new ATOM 0 HA ASP A 59 -9.314 -2.260 5.810 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -6.471 -1.966 6.719 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -6.894 -2.804 5.238 1.00 0.00 H new ATOM 749 N SER A 60 -9.706 -4.570 6.732 1.00 0.00 N ATOM 750 CA SER A 60 -9.932 -5.948 7.061 1.00 0.00 C ATOM 751 C SER A 60 -9.242 -6.922 6.110 1.00 0.00 C ATOM 752 O SER A 60 -8.027 -7.115 6.148 1.00 0.00 O ATOM 753 CB SER A 60 -11.444 -6.172 7.197 1.00 0.00 C ATOM 754 OG SER A 60 -12.025 -5.251 8.116 1.00 0.00 O ATOM 0 H SER A 60 -10.525 -4.109 6.336 1.00 0.00 H new ATOM 0 HA SER A 60 -9.461 -6.169 8.019 1.00 0.00 H new ATOM 0 HB2 SER A 60 -11.919 -6.064 6.222 1.00 0.00 H new ATOM 0 HB3 SER A 60 -11.634 -7.192 7.532 1.00 0.00 H new ATOM 0 HG SER A 60 -11.686 -4.350 7.934 1.00 0.00 H new ATOM 760 N TYR A 61 -10.005 -7.588 5.258 1.00 0.00 N ATOM 761 CA TYR A 61 -9.486 -8.596 4.365 1.00 0.00 C ATOM 762 C TYR A 61 -10.497 -8.922 3.299 1.00 0.00 C ATOM 763 O TYR A 61 -11.572 -8.327 3.251 1.00 0.00 O ATOM 764 CB TYR A 61 -9.254 -9.842 5.261 1.00 0.00 C ATOM 765 CG TYR A 61 -10.251 -9.988 6.420 1.00 0.00 C ATOM 766 CD1 TYR A 61 -11.644 -9.965 6.188 1.00 0.00 C ATOM 767 CD2 TYR A 61 -9.782 -9.982 7.748 1.00 0.00 C ATOM 768 CE1 TYR A 61 -12.546 -9.881 7.263 1.00 0.00 C ATOM 769 CE2 TYR A 61 -10.683 -9.950 8.829 1.00 0.00 C ATOM 770 CZ TYR A 61 -12.074 -9.887 8.591 1.00 0.00 C ATOM 771 OH TYR A 61 -12.968 -9.824 9.616 1.00 0.00 O ATOM 0 H TYR A 61 -11.010 -7.438 5.171 1.00 0.00 H new ATOM 0 HA TYR A 61 -8.577 -8.265 3.862 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -9.306 -10.736 4.639 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -8.245 -9.797 5.670 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -12.019 -10.012 5.176 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -8.719 -10.002 7.939 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -13.606 -9.811 7.070 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -10.310 -9.974 9.842 1.00 0.00 H new ATOM 0 HH TYR A 61 -12.488 -9.838 10.470 1.00 0.00 H new ATOM 781 N ARG A 62 -10.148 -9.850 2.419 1.00 0.00 N ATOM 782 CA ARG A 62 -11.048 -10.287 1.381 1.00 0.00 C ATOM 783 C ARG A 62 -11.368 -11.745 1.582 1.00 0.00 C ATOM 784 O ARG A 62 -10.627 -12.496 2.220 1.00 0.00 O ATOM 785 CB ARG A 62 -10.446 -10.112 -0.015 1.00 0.00 C ATOM 786 CG ARG A 62 -9.368 -11.148 -0.424 1.00 0.00 C ATOM 787 CD ARG A 62 -9.277 -11.247 -1.944 1.00 0.00 C ATOM 788 NE ARG A 62 -10.477 -11.867 -2.512 1.00 0.00 N ATOM 789 CZ ARG A 62 -11.001 -11.656 -3.716 1.00 0.00 C ATOM 790 NH1 ARG A 62 -10.371 -10.898 -4.611 1.00 0.00 N ATOM 791 NH2 ARG A 62 -12.175 -12.217 -3.975 1.00 0.00 N ATOM 0 H ARG A 62 -9.239 -10.313 2.410 1.00 0.00 H new ATOM 0 HA ARG A 62 -11.946 -9.673 1.447 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -11.254 -10.151 -0.745 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -10.007 -9.116 -0.078 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -8.401 -10.858 -0.013 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -9.613 -12.123 -0.003 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -9.145 -10.251 -2.368 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -8.399 -11.830 -2.220 1.00 0.00 H new ATOM 0 HE ARG A 62 -10.966 -12.536 -1.917 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -9.475 -10.471 -4.377 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -10.784 -10.745 -5.531 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -12.638 -12.783 -3.264 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -12.615 -12.082 -4.885 1.00 0.00 H new ATOM 805 N THR A 63 -12.434 -12.128 0.922 1.00 0.00 N ATOM 806 CA THR A 63 -12.923 -13.497 0.884 1.00 0.00 C ATOM 807 C THR A 63 -13.311 -13.715 -0.591 1.00 0.00 C ATOM 808 O THR A 63 -13.231 -12.781 -1.403 1.00 0.00 O ATOM 809 CB THR A 63 -14.143 -13.699 1.803 1.00 0.00 C ATOM 810 OG1 THR A 63 -15.147 -12.736 1.567 1.00 0.00 O ATOM 811 CG2 THR A 63 -13.795 -13.701 3.286 1.00 0.00 C ATOM 0 H THR A 63 -13.006 -11.482 0.379 1.00 0.00 H new ATOM 0 HA THR A 63 -12.174 -14.205 1.238 1.00 0.00 H new ATOM 0 HB THR A 63 -14.519 -14.689 1.547 1.00 0.00 H new ATOM 0 HG1 THR A 63 -14.737 -11.912 1.229 1.00 0.00 H new ATOM 0 HG21 THR A 63 -14.702 -13.848 3.872 1.00 0.00 H new ATOM 0 HG22 THR A 63 -13.094 -14.509 3.494 1.00 0.00 H new ATOM 0 HG23 THR A 63 -13.340 -12.748 3.554 1.00 0.00 H new ATOM 819 N ASP A 64 -13.768 -14.902 -0.981 1.00 0.00 N ATOM 820 CA ASP A 64 -14.180 -15.121 -2.368 1.00 0.00 C ATOM 821 C ASP A 64 -15.571 -14.509 -2.627 1.00 0.00 C ATOM 822 O ASP A 64 -15.922 -14.245 -3.784 1.00 0.00 O ATOM 823 CB ASP A 64 -14.147 -16.614 -2.682 1.00 0.00 C ATOM 824 CG ASP A 64 -14.535 -16.893 -4.128 1.00 0.00 C ATOM 825 OD1 ASP A 64 -13.856 -16.374 -5.043 1.00 0.00 O ATOM 826 OD2 ASP A 64 -15.499 -17.660 -4.358 1.00 0.00 O ATOM 0 H ASP A 64 -13.862 -15.714 -0.371 1.00 0.00 H new ATOM 0 HA ASP A 64 -13.482 -14.618 -3.037 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -13.147 -17.004 -2.492 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -14.828 -17.142 -2.014 1.00 0.00 H new ATOM 831 N THR A 65 -16.343 -14.234 -1.561 1.00 0.00 N ATOM 832 CA THR A 65 -17.683 -13.657 -1.654 1.00 0.00 C ATOM 833 C THR A 65 -17.733 -12.143 -1.386 1.00 0.00 C ATOM 834 O THR A 65 -18.704 -11.501 -1.804 1.00 0.00 O ATOM 835 CB THR A 65 -18.683 -14.412 -0.760 1.00 0.00 C ATOM 836 OG1 THR A 65 -18.408 -14.240 0.614 1.00 0.00 O ATOM 837 CG2 THR A 65 -18.759 -15.910 -1.064 1.00 0.00 C ATOM 0 H THR A 65 -16.044 -14.411 -0.602 1.00 0.00 H new ATOM 0 HA THR A 65 -17.981 -13.783 -2.695 1.00 0.00 H new ATOM 0 HB THR A 65 -19.649 -13.966 -0.996 1.00 0.00 H new ATOM 0 HG1 THR A 65 -19.068 -14.734 1.144 1.00 0.00 H new ATOM 0 HG21 THR A 65 -19.482 -16.380 -0.398 1.00 0.00 H new ATOM 0 HG22 THR A 65 -19.070 -16.056 -2.098 1.00 0.00 H new ATOM 0 HG23 THR A 65 -17.779 -16.362 -0.913 1.00 0.00 H new ATOM 845 N ALA A 66 -16.746 -11.573 -0.686 1.00 0.00 N ATOM 846 CA ALA A 66 -16.661 -10.156 -0.371 1.00 0.00 C ATOM 847 C ALA A 66 -15.195 -9.753 -0.317 1.00 0.00 C ATOM 848 O ALA A 66 -14.396 -10.439 0.302 1.00 0.00 O ATOM 849 CB ALA A 66 -17.328 -9.853 0.978 1.00 0.00 C ATOM 0 H ALA A 66 -15.962 -12.109 -0.314 1.00 0.00 H new ATOM 0 HA ALA A 66 -17.182 -9.589 -1.143 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -17.251 -8.787 1.191 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -18.379 -10.140 0.937 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -16.828 -10.417 1.766 1.00 0.00 H new ATOM 855 N VAL A 67 -14.845 -8.611 -0.884 1.00 0.00 N ATOM 856 CA VAL A 67 -13.516 -8.022 -0.953 1.00 0.00 C ATOM 857 C VAL A 67 -13.606 -6.612 -0.357 1.00 0.00 C ATOM 858 O VAL A 67 -14.307 -5.750 -0.891 1.00 0.00 O ATOM 859 CB VAL A 67 -12.992 -7.990 -2.413 1.00 0.00 C ATOM 860 CG1 VAL A 67 -11.461 -7.966 -2.489 1.00 0.00 C ATOM 861 CG2 VAL A 67 -13.477 -9.158 -3.280 1.00 0.00 C ATOM 0 H VAL A 67 -15.539 -8.023 -1.346 1.00 0.00 H new ATOM 0 HA VAL A 67 -12.804 -8.623 -0.386 1.00 0.00 H new ATOM 0 HB VAL A 67 -13.409 -7.063 -2.807 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -11.149 -7.944 -3.533 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -11.085 -7.079 -1.979 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -11.059 -8.858 -2.009 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -13.066 -9.061 -4.285 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -13.145 -10.099 -2.842 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -14.566 -9.146 -3.331 1.00 0.00 H new ATOM 871 N PHE A 68 -12.932 -6.381 0.768 1.00 0.00 N ATOM 872 CA PHE A 68 -12.893 -5.070 1.458 1.00 0.00 C ATOM 873 C PHE A 68 -11.628 -4.307 1.025 1.00 0.00 C ATOM 874 O PHE A 68 -11.006 -3.619 1.827 1.00 0.00 O ATOM 875 CB PHE A 68 -12.982 -5.245 2.997 1.00 0.00 C ATOM 876 CG PHE A 68 -14.371 -5.329 3.606 1.00 0.00 C ATOM 877 CD1 PHE A 68 -15.419 -5.953 2.900 1.00 0.00 C ATOM 878 CD2 PHE A 68 -14.613 -4.812 4.902 1.00 0.00 C ATOM 879 CE1 PHE A 68 -16.688 -6.087 3.475 1.00 0.00 C ATOM 880 CE2 PHE A 68 -15.895 -4.938 5.469 1.00 0.00 C ATOM 881 CZ PHE A 68 -16.926 -5.580 4.758 1.00 0.00 C ATOM 0 H PHE A 68 -12.387 -7.101 1.241 1.00 0.00 H new ATOM 0 HA PHE A 68 -13.762 -4.479 1.169 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -12.440 -6.151 3.266 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -12.459 -4.410 3.463 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -15.241 -6.332 1.904 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -13.820 -4.325 5.451 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -17.480 -6.580 2.931 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -16.088 -4.540 6.454 1.00 0.00 H new ATOM 0 HZ PHE A 68 -17.904 -5.682 5.204 1.00 0.00 H new ATOM 891 N ASN A 69 -11.223 -4.463 -0.234 1.00 0.00 N ATOM 892 CA ASN A 69 -10.053 -3.852 -0.814 1.00 0.00 C ATOM 893 C ASN A 69 -10.208 -2.399 -1.270 1.00 0.00 C ATOM 894 O ASN A 69 -11.152 -2.066 -1.993 1.00 0.00 O ATOM 895 CB ASN A 69 -9.595 -4.683 -2.021 1.00 0.00 C ATOM 896 CG ASN A 69 -10.500 -4.551 -3.234 1.00 0.00 C ATOM 897 OD1 ASN A 69 -11.633 -5.022 -3.228 1.00 0.00 O ATOM 898 ND2 ASN A 69 -10.075 -3.852 -4.269 1.00 0.00 N ATOM 0 H ASN A 69 -11.732 -5.047 -0.898 1.00 0.00 H new ATOM 0 HA ASN A 69 -9.323 -3.833 -0.004 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -8.585 -4.379 -2.298 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -9.544 -5.732 -1.730 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -10.689 -3.701 -5.069 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -9.132 -3.463 -4.269 1.00 0.00 H new ATOM 905 N ASP A 70 -9.242 -1.570 -0.879 1.00 0.00 N ATOM 906 CA ASP A 70 -9.121 -0.151 -1.239 1.00 0.00 C ATOM 907 C ASP A 70 -8.687 -0.098 -2.712 1.00 0.00 C ATOM 908 O ASP A 70 -8.220 -1.115 -3.257 1.00 0.00 O ATOM 909 CB ASP A 70 -8.079 0.558 -0.355 1.00 0.00 C ATOM 910 CG ASP A 70 -7.463 1.784 -1.047 1.00 0.00 C ATOM 911 OD1 ASP A 70 -8.167 2.806 -1.223 1.00 0.00 O ATOM 912 OD2 ASP A 70 -6.318 1.636 -1.521 1.00 0.00 O ATOM 0 H ASP A 70 -8.483 -1.881 -0.273 1.00 0.00 H new ATOM 0 HA ASP A 70 -10.072 0.360 -1.088 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -8.549 0.868 0.578 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -7.288 -0.145 -0.095 1.00 0.00 H new ATOM 917 N LEU A 71 -8.976 1.016 -3.393 1.00 0.00 N ATOM 918 CA LEU A 71 -8.635 1.258 -4.785 1.00 0.00 C ATOM 919 C LEU A 71 -7.758 2.501 -4.841 1.00 0.00 C ATOM 920 O LEU A 71 -8.278 3.608 -4.702 1.00 0.00 O ATOM 921 CB LEU A 71 -9.883 1.475 -5.664 1.00 0.00 C ATOM 922 CG LEU A 71 -10.429 0.241 -6.384 1.00 0.00 C ATOM 923 CD1 LEU A 71 -10.909 -0.811 -5.396 1.00 0.00 C ATOM 924 CD2 LEU A 71 -11.605 0.640 -7.284 1.00 0.00 C ATOM 0 H LEU A 71 -9.473 1.799 -2.967 1.00 0.00 H new ATOM 0 HA LEU A 71 -8.116 0.382 -5.174 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.676 1.884 -5.037 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -9.647 2.231 -6.413 1.00 0.00 H new ATOM 0 HG LEU A 71 -9.619 -0.178 -6.980 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -11.291 -1.674 -5.941 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -10.078 -1.120 -4.762 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -11.703 -0.393 -4.776 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -11.989 -0.244 -7.794 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -12.395 1.080 -6.676 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -11.268 1.367 -8.023 1.00 0.00 H new ATOM 936 N ILE A 72 -6.458 2.321 -5.066 1.00 0.00 N ATOM 937 CA ILE A 72 -5.535 3.458 -5.174 1.00 0.00 C ATOM 938 C ILE A 72 -5.681 3.953 -6.608 1.00 0.00 C ATOM 939 O ILE A 72 -5.532 3.140 -7.524 1.00 0.00 O ATOM 940 CB ILE A 72 -4.056 3.080 -4.910 1.00 0.00 C ATOM 941 CG1 ILE A 72 -3.796 2.601 -3.469 1.00 0.00 C ATOM 942 CG2 ILE A 72 -3.128 4.276 -5.196 1.00 0.00 C ATOM 943 CD1 ILE A 72 -3.839 1.083 -3.343 1.00 0.00 C ATOM 0 H ILE A 72 -6.019 1.407 -5.177 1.00 0.00 H new ATOM 0 HA ILE A 72 -5.784 4.207 -4.422 1.00 0.00 H new ATOM 0 HB ILE A 72 -3.842 2.252 -5.586 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.822 2.962 -3.139 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -4.540 3.039 -2.804 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.094 3.988 -5.004 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.233 4.577 -6.238 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.399 5.110 -4.548 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.650 0.798 -2.308 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -4.822 0.721 -3.645 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -3.077 0.643 -3.986 1.00 0.00 H new ATOM 955 N LEU A 73 -5.980 5.232 -6.827 1.00 0.00 N ATOM 956 CA LEU A 73 -6.131 5.829 -8.154 1.00 0.00 C ATOM 957 C LEU A 73 -4.925 6.723 -8.446 1.00 0.00 C ATOM 958 O LEU A 73 -4.354 7.290 -7.517 1.00 0.00 O ATOM 959 CB LEU A 73 -7.448 6.623 -8.231 1.00 0.00 C ATOM 960 CG LEU A 73 -8.679 5.836 -8.711 1.00 0.00 C ATOM 961 CD1 LEU A 73 -8.685 5.640 -10.227 1.00 0.00 C ATOM 962 CD2 LEU A 73 -8.843 4.468 -8.042 1.00 0.00 C ATOM 0 H LEU A 73 -6.128 5.898 -6.069 1.00 0.00 H new ATOM 0 HA LEU A 73 -6.172 5.044 -8.909 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -7.663 7.029 -7.243 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -7.300 7.471 -8.899 1.00 0.00 H new ATOM 0 HG LEU A 73 -9.522 6.459 -8.414 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -9.573 5.079 -10.518 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -8.692 6.612 -10.720 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -7.794 5.089 -10.526 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -9.733 3.976 -8.434 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -7.967 3.854 -8.251 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -8.946 4.600 -6.965 1.00 0.00 H new ATOM 974 N ASP A 74 -4.597 6.865 -9.737 1.00 0.00 N ATOM 975 CA ASP A 74 -3.494 7.654 -10.300 1.00 0.00 C ATOM 976 C ASP A 74 -2.209 7.393 -9.507 1.00 0.00 C ATOM 977 O ASP A 74 -1.699 8.260 -8.801 1.00 0.00 O ATOM 978 CB ASP A 74 -3.864 9.143 -10.383 1.00 0.00 C ATOM 979 CG ASP A 74 -5.063 9.443 -11.285 1.00 0.00 C ATOM 980 OD1 ASP A 74 -6.225 9.202 -10.873 1.00 0.00 O ATOM 981 OD2 ASP A 74 -4.893 9.994 -12.397 1.00 0.00 O ATOM 0 H ASP A 74 -5.134 6.398 -10.467 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.308 7.337 -11.326 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -4.079 9.509 -9.379 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -3.001 9.700 -10.748 1.00 0.00 H new ATOM 986 N PHE A 75 -1.709 6.160 -9.607 1.00 0.00 N ATOM 987 CA PHE A 75 -0.518 5.699 -8.910 1.00 0.00 C ATOM 988 C PHE A 75 0.792 5.949 -9.664 1.00 0.00 C ATOM 989 O PHE A 75 0.935 5.541 -10.826 1.00 0.00 O ATOM 990 CB PHE A 75 -0.686 4.193 -8.692 1.00 0.00 C ATOM 991 CG PHE A 75 0.349 3.586 -7.774 1.00 0.00 C ATOM 992 CD1 PHE A 75 0.287 3.853 -6.399 1.00 0.00 C ATOM 993 CD2 PHE A 75 1.351 2.740 -8.277 1.00 0.00 C ATOM 994 CE1 PHE A 75 1.159 3.201 -5.515 1.00 0.00 C ATOM 995 CE2 PHE A 75 2.242 2.107 -7.393 1.00 0.00 C ATOM 996 CZ PHE A 75 2.135 2.323 -6.011 1.00 0.00 C ATOM 0 H PHE A 75 -2.135 5.440 -10.191 1.00 0.00 H new ATOM 0 HA PHE A 75 -0.436 6.263 -7.981 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -1.677 4.004 -8.280 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -0.641 3.689 -9.658 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -0.434 4.562 -6.020 1.00 0.00 H new ATOM 0 HD2 PHE A 75 1.437 2.576 -9.341 1.00 0.00 H new ATOM 0 HE1 PHE A 75 1.079 3.375 -4.452 1.00 0.00 H new ATOM 0 HE2 PHE A 75 3.010 1.453 -7.778 1.00 0.00 H new ATOM 0 HZ PHE A 75 2.802 1.815 -5.330 1.00 0.00 H new ATOM 1006 N GLU A 76 1.784 6.520 -8.976 1.00 0.00 N ATOM 1007 CA GLU A 76 3.101 6.792 -9.517 1.00 0.00 C ATOM 1008 C GLU A 76 4.160 6.243 -8.564 1.00 0.00 C ATOM 1009 O GLU A 76 4.697 6.973 -7.729 1.00 0.00 O ATOM 1010 CB GLU A 76 3.303 8.278 -9.868 1.00 0.00 C ATOM 1011 CG GLU A 76 4.653 8.466 -10.596 1.00 0.00 C ATOM 1012 CD GLU A 76 5.010 9.895 -11.026 1.00 0.00 C ATOM 1013 OE1 GLU A 76 4.199 10.835 -10.901 1.00 0.00 O ATOM 1014 OE2 GLU A 76 6.167 10.107 -11.462 1.00 0.00 O ATOM 0 H GLU A 76 1.682 6.810 -8.003 1.00 0.00 H new ATOM 0 HA GLU A 76 3.205 6.274 -10.471 1.00 0.00 H new ATOM 0 HB2 GLU A 76 2.487 8.626 -10.501 1.00 0.00 H new ATOM 0 HB3 GLU A 76 3.282 8.881 -8.961 1.00 0.00 H new ATOM 0 HG2 GLU A 76 5.445 8.099 -9.944 1.00 0.00 H new ATOM 0 HG3 GLU A 76 4.652 7.834 -11.484 1.00 0.00 H new ATOM 1021 N ALA A 77 4.544 4.967 -8.738 1.00 0.00 N ATOM 1022 CA ALA A 77 5.566 4.326 -7.904 1.00 0.00 C ATOM 1023 C ALA A 77 6.918 5.055 -7.958 1.00 0.00 C ATOM 1024 O ALA A 77 7.840 4.661 -7.234 1.00 0.00 O ATOM 1025 CB ALA A 77 5.774 2.858 -8.294 1.00 0.00 C ATOM 0 H ALA A 77 4.155 4.357 -9.457 1.00 0.00 H new ATOM 0 HA ALA A 77 5.187 4.381 -6.883 1.00 0.00 H new ATOM 0 HB1 ALA A 77 6.538 2.416 -7.655 1.00 0.00 H new ATOM 0 HB2 ALA A 77 4.838 2.313 -8.171 1.00 0.00 H new ATOM 0 HB3 ALA A 77 6.094 2.800 -9.334 1.00 0.00 H new ATOM 1031 N SER A 78 7.091 6.034 -8.861 1.00 0.00 N ATOM 1032 CA SER A 78 8.319 6.804 -8.953 1.00 0.00 C ATOM 1033 C SER A 78 8.572 7.471 -7.591 1.00 0.00 C ATOM 1034 O SER A 78 9.703 7.416 -7.101 1.00 0.00 O ATOM 1035 CB SER A 78 8.213 7.859 -10.067 1.00 0.00 C ATOM 1036 OG SER A 78 9.503 8.226 -10.513 1.00 0.00 O ATOM 0 H SER A 78 6.380 6.305 -9.540 1.00 0.00 H new ATOM 0 HA SER A 78 9.153 6.148 -9.203 1.00 0.00 H new ATOM 0 HB2 SER A 78 7.631 7.463 -10.899 1.00 0.00 H new ATOM 0 HB3 SER A 78 7.684 8.737 -9.697 1.00 0.00 H new ATOM 0 HG SER A 78 9.425 8.897 -11.223 1.00 0.00 H new ATOM 1042 N GLU A 79 7.535 8.042 -6.958 1.00 0.00 N ATOM 1043 CA GLU A 79 7.658 8.721 -5.667 1.00 0.00 C ATOM 1044 C GLU A 79 6.580 8.319 -4.645 1.00 0.00 C ATOM 1045 O GLU A 79 6.821 8.505 -3.445 1.00 0.00 O ATOM 1046 CB GLU A 79 7.845 10.245 -5.857 1.00 0.00 C ATOM 1047 CG GLU A 79 8.557 10.697 -7.148 1.00 0.00 C ATOM 1048 CD GLU A 79 9.085 12.140 -7.146 1.00 0.00 C ATOM 1049 OE1 GLU A 79 8.575 13.039 -6.441 1.00 0.00 O ATOM 1050 OE2 GLU A 79 10.100 12.387 -7.846 1.00 0.00 O ATOM 0 H GLU A 79 6.586 8.043 -7.332 1.00 0.00 H new ATOM 0 HA GLU A 79 8.574 8.362 -5.197 1.00 0.00 H new ATOM 0 HB2 GLU A 79 6.862 10.715 -5.827 1.00 0.00 H new ATOM 0 HB3 GLU A 79 8.407 10.628 -5.006 1.00 0.00 H new ATOM 0 HG2 GLU A 79 9.393 10.024 -7.335 1.00 0.00 H new ATOM 0 HG3 GLU A 79 7.864 10.584 -7.982 1.00 0.00 H new ATOM 1057 N ASP A 80 5.444 7.741 -5.063 1.00 0.00 N ATOM 1058 CA ASP A 80 4.369 7.317 -4.157 1.00 0.00 C ATOM 1059 C ASP A 80 4.898 6.209 -3.249 1.00 0.00 C ATOM 1060 O ASP A 80 5.631 5.318 -3.698 1.00 0.00 O ATOM 1061 CB ASP A 80 3.143 6.738 -4.897 1.00 0.00 C ATOM 1062 CG ASP A 80 2.149 7.747 -5.480 1.00 0.00 C ATOM 1063 OD1 ASP A 80 2.267 8.957 -5.191 1.00 0.00 O ATOM 1064 OD2 ASP A 80 1.212 7.279 -6.166 1.00 0.00 O ATOM 0 H ASP A 80 5.245 7.554 -6.046 1.00 0.00 H new ATOM 0 HA ASP A 80 4.057 8.206 -3.608 1.00 0.00 H new ATOM 0 HB2 ASP A 80 3.503 6.107 -5.710 1.00 0.00 H new ATOM 0 HB3 ASP A 80 2.604 6.090 -4.206 1.00 0.00 H new ATOM 1069 N ARG A 81 4.435 6.160 -1.996 1.00 0.00 N ATOM 1070 CA ARG A 81 4.870 5.153 -1.016 1.00 0.00 C ATOM 1071 C ARG A 81 3.726 4.398 -0.363 1.00 0.00 C ATOM 1072 O ARG A 81 2.600 4.892 -0.309 1.00 0.00 O ATOM 1073 CB ARG A 81 5.812 5.766 0.021 1.00 0.00 C ATOM 1074 CG ARG A 81 7.021 6.325 -0.727 1.00 0.00 C ATOM 1075 CD ARG A 81 8.183 6.598 0.205 1.00 0.00 C ATOM 1076 NE ARG A 81 9.352 7.035 -0.569 1.00 0.00 N ATOM 1077 CZ ARG A 81 10.603 6.582 -0.441 1.00 0.00 C ATOM 1078 NH1 ARG A 81 10.952 5.784 0.565 1.00 0.00 N ATOM 1079 NH2 ARG A 81 11.522 6.924 -1.335 1.00 0.00 N ATOM 0 H ARG A 81 3.747 6.818 -1.630 1.00 0.00 H new ATOM 0 HA ARG A 81 5.423 4.402 -1.580 1.00 0.00 H new ATOM 0 HB2 ARG A 81 5.307 6.556 0.577 1.00 0.00 H new ATOM 0 HB3 ARG A 81 6.124 5.015 0.746 1.00 0.00 H new ATOM 0 HG2 ARG A 81 7.331 5.618 -1.497 1.00 0.00 H new ATOM 0 HG3 ARG A 81 6.739 7.247 -1.236 1.00 0.00 H new ATOM 0 HD2 ARG A 81 7.908 7.365 0.929 1.00 0.00 H new ATOM 0 HD3 ARG A 81 8.426 5.699 0.771 1.00 0.00 H new ATOM 0 HE ARG A 81 9.194 7.755 -1.274 1.00 0.00 H new ATOM 0 HH11 ARG A 81 10.259 5.505 1.259 1.00 0.00 H new ATOM 0 HH12 ARG A 81 11.913 5.451 0.642 1.00 0.00 H new ATOM 0 HH21 ARG A 81 11.273 7.530 -2.116 1.00 0.00 H new ATOM 0 HH22 ARG A 81 12.478 6.580 -1.241 1.00 0.00 H new ATOM 1093 N ILE A 82 4.020 3.210 0.175 1.00 0.00 N ATOM 1094 CA ILE A 82 3.031 2.349 0.812 1.00 0.00 C ATOM 1095 C ILE A 82 3.578 1.741 2.108 1.00 0.00 C ATOM 1096 O ILE A 82 4.625 1.087 2.111 1.00 0.00 O ATOM 1097 CB ILE A 82 2.528 1.316 -0.239 1.00 0.00 C ATOM 1098 CG1 ILE A 82 1.048 0.930 -0.062 1.00 0.00 C ATOM 1099 CG2 ILE A 82 3.349 0.041 -0.424 1.00 0.00 C ATOM 1100 CD1 ILE A 82 0.770 0.102 1.195 1.00 0.00 C ATOM 0 H ILE A 82 4.962 2.819 0.178 1.00 0.00 H new ATOM 0 HA ILE A 82 2.162 2.922 1.137 1.00 0.00 H new ATOM 0 HB ILE A 82 2.666 1.893 -1.154 1.00 0.00 H new ATOM 0 HG12 ILE A 82 0.447 1.839 -0.027 1.00 0.00 H new ATOM 0 HG13 ILE A 82 0.722 0.366 -0.936 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.883 -0.585 -1.185 1.00 0.00 H new ATOM 0 HG22 ILE A 82 4.360 0.301 -0.738 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.391 -0.505 0.519 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -0.293 -0.131 1.250 1.00 0.00 H new ATOM 0 HD12 ILE A 82 1.342 -0.825 1.154 1.00 0.00 H new ATOM 0 HD13 ILE A 82 1.063 0.671 2.078 1.00 0.00 H new ATOM 1112 N ASP A 83 2.897 1.988 3.223 1.00 0.00 N ATOM 1113 CA ASP A 83 3.234 1.469 4.548 1.00 0.00 C ATOM 1114 C ASP A 83 2.305 0.298 4.839 1.00 0.00 C ATOM 1115 O ASP A 83 1.142 0.504 5.180 1.00 0.00 O ATOM 1116 CB ASP A 83 3.154 2.516 5.666 1.00 0.00 C ATOM 1117 CG ASP A 83 3.606 1.935 7.022 1.00 0.00 C ATOM 1118 OD1 ASP A 83 4.098 0.781 7.088 1.00 0.00 O ATOM 1119 OD2 ASP A 83 3.517 2.646 8.054 1.00 0.00 O ATOM 0 H ASP A 83 2.064 2.577 3.231 1.00 0.00 H new ATOM 0 HA ASP A 83 4.278 1.155 4.532 1.00 0.00 H new ATOM 0 HB2 ASP A 83 3.779 3.371 5.410 1.00 0.00 H new ATOM 0 HB3 ASP A 83 2.131 2.882 5.749 1.00 0.00 H new ATOM 1124 N LEU A 84 2.825 -0.924 4.690 1.00 0.00 N ATOM 1125 CA LEU A 84 2.094 -2.177 4.908 1.00 0.00 C ATOM 1126 C LEU A 84 2.861 -3.183 5.779 1.00 0.00 C ATOM 1127 O LEU A 84 2.524 -4.359 5.797 1.00 0.00 O ATOM 1128 CB LEU A 84 1.692 -2.789 3.544 1.00 0.00 C ATOM 1129 CG LEU A 84 2.813 -3.041 2.509 1.00 0.00 C ATOM 1130 CD1 LEU A 84 3.934 -3.977 2.978 1.00 0.00 C ATOM 1131 CD2 LEU A 84 2.212 -3.646 1.234 1.00 0.00 C ATOM 0 H LEU A 84 3.793 -1.074 4.406 1.00 0.00 H new ATOM 0 HA LEU A 84 1.193 -1.938 5.473 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.194 -3.739 3.737 1.00 0.00 H new ATOM 0 HB3 LEU A 84 0.955 -2.130 3.085 1.00 0.00 H new ATOM 0 HG LEU A 84 3.262 -2.062 2.342 1.00 0.00 H new ATOM 0 HD11 LEU A 84 4.670 -4.090 2.182 1.00 0.00 H new ATOM 0 HD12 LEU A 84 4.415 -3.555 3.860 1.00 0.00 H new ATOM 0 HD13 LEU A 84 3.514 -4.952 3.225 1.00 0.00 H new ATOM 0 HD21 LEU A 84 3.004 -3.822 0.507 1.00 0.00 H new ATOM 0 HD22 LEU A 84 1.723 -4.590 1.475 1.00 0.00 H new ATOM 0 HD23 LEU A 84 1.481 -2.956 0.814 1.00 0.00 H new ATOM 1143 N SER A 85 3.879 -2.771 6.540 1.00 0.00 N ATOM 1144 CA SER A 85 4.679 -3.696 7.351 1.00 0.00 C ATOM 1145 C SER A 85 3.884 -4.652 8.256 1.00 0.00 C ATOM 1146 O SER A 85 4.355 -5.767 8.512 1.00 0.00 O ATOM 1147 CB SER A 85 5.700 -2.894 8.159 1.00 0.00 C ATOM 1148 OG SER A 85 6.632 -3.751 8.786 1.00 0.00 O ATOM 0 H SER A 85 4.171 -1.796 6.612 1.00 0.00 H new ATOM 0 HA SER A 85 5.173 -4.363 6.645 1.00 0.00 H new ATOM 0 HB2 SER A 85 6.224 -2.199 7.503 1.00 0.00 H new ATOM 0 HB3 SER A 85 5.186 -2.296 8.912 1.00 0.00 H new ATOM 0 HG SER A 85 7.276 -3.217 9.296 1.00 0.00 H new ATOM 1154 N ALA A 86 2.715 -4.246 8.761 1.00 0.00 N ATOM 1155 CA ALA A 86 1.928 -5.104 9.636 1.00 0.00 C ATOM 1156 C ALA A 86 1.231 -6.249 8.891 1.00 0.00 C ATOM 1157 O ALA A 86 1.098 -7.334 9.461 1.00 0.00 O ATOM 1158 CB ALA A 86 0.907 -4.277 10.417 1.00 0.00 C ATOM 0 H ALA A 86 2.299 -3.333 8.577 1.00 0.00 H new ATOM 0 HA ALA A 86 2.630 -5.566 10.330 1.00 0.00 H new ATOM 0 HB1 ALA A 86 0.327 -4.933 11.066 1.00 0.00 H new ATOM 0 HB2 ALA A 86 1.427 -3.535 11.023 1.00 0.00 H new ATOM 0 HB3 ALA A 86 0.238 -3.772 9.720 1.00 0.00 H new ATOM 1164 N LEU A 87 0.814 -6.019 7.643 1.00 0.00 N ATOM 1165 CA LEU A 87 0.121 -6.952 6.771 1.00 0.00 C ATOM 1166 C LEU A 87 0.916 -7.017 5.466 1.00 0.00 C ATOM 1167 O LEU A 87 0.746 -6.180 4.587 1.00 0.00 O ATOM 1168 CB LEU A 87 -1.381 -6.585 6.607 1.00 0.00 C ATOM 1169 CG LEU A 87 -1.909 -5.125 6.469 1.00 0.00 C ATOM 1170 CD1 LEU A 87 -1.745 -4.257 7.724 1.00 0.00 C ATOM 1171 CD2 LEU A 87 -1.366 -4.303 5.298 1.00 0.00 C ATOM 0 H LEU A 87 0.964 -5.116 7.192 1.00 0.00 H new ATOM 0 HA LEU A 87 0.084 -7.953 7.201 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.731 -7.121 5.725 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -1.896 -7.015 7.466 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.961 -5.343 6.284 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.141 -3.260 7.531 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.289 -4.709 8.553 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -0.688 -4.184 7.981 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -1.811 -3.308 5.315 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -0.283 -4.218 5.385 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -1.617 -4.797 4.359 1.00 0.00 H new ATOM 1183 N GLY A 88 1.796 -8.005 5.295 1.00 0.00 N ATOM 1184 CA GLY A 88 2.626 -8.130 4.115 1.00 0.00 C ATOM 1185 C GLY A 88 4.030 -8.549 4.539 1.00 0.00 C ATOM 1186 O GLY A 88 4.724 -7.842 5.281 1.00 0.00 O ATOM 0 H GLY A 88 1.947 -8.743 5.983 1.00 0.00 H new ATOM 0 HA2 GLY A 88 2.203 -8.867 3.433 1.00 0.00 H new ATOM 0 HA3 GLY A 88 2.662 -7.182 3.578 1.00 0.00 H new ATOM 1190 N PHE A 89 4.418 -9.753 4.144 1.00 0.00 N ATOM 1191 CA PHE A 89 5.725 -10.354 4.397 1.00 0.00 C ATOM 1192 C PHE A 89 6.582 -10.192 3.132 1.00 0.00 C ATOM 1193 O PHE A 89 6.051 -9.864 2.067 1.00 0.00 O ATOM 1194 CB PHE A 89 5.556 -11.845 4.687 1.00 0.00 C ATOM 1195 CG PHE A 89 4.581 -12.209 5.785 1.00 0.00 C ATOM 1196 CD1 PHE A 89 4.977 -12.197 7.134 1.00 0.00 C ATOM 1197 CD2 PHE A 89 3.286 -12.632 5.444 1.00 0.00 C ATOM 1198 CE1 PHE A 89 4.075 -12.614 8.129 1.00 0.00 C ATOM 1199 CE2 PHE A 89 2.395 -13.073 6.436 1.00 0.00 C ATOM 1200 CZ PHE A 89 2.790 -13.063 7.783 1.00 0.00 C ATOM 0 H PHE A 89 3.802 -10.369 3.613 1.00 0.00 H new ATOM 0 HA PHE A 89 6.199 -9.869 5.250 1.00 0.00 H new ATOM 0 HB2 PHE A 89 5.236 -12.338 3.769 1.00 0.00 H new ATOM 0 HB3 PHE A 89 6.532 -12.256 4.946 1.00 0.00 H new ATOM 0 HD1 PHE A 89 5.970 -11.869 7.405 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.973 -12.618 4.411 1.00 0.00 H new ATOM 0 HE1 PHE A 89 4.373 -12.589 9.167 1.00 0.00 H new ATOM 0 HE2 PHE A 89 1.409 -13.419 6.163 1.00 0.00 H new ATOM 0 HZ PHE A 89 2.108 -13.399 8.550 1.00 0.00 H new ATOM 1210 N SER A 90 7.889 -10.465 3.206 1.00 0.00 N ATOM 1211 CA SER A 90 8.791 -10.351 2.061 1.00 0.00 C ATOM 1212 C SER A 90 8.858 -11.660 1.255 1.00 0.00 C ATOM 1213 O SER A 90 9.350 -11.657 0.125 1.00 0.00 O ATOM 1214 CB SER A 90 10.155 -9.841 2.542 1.00 0.00 C ATOM 1215 OG SER A 90 10.945 -9.283 1.507 1.00 0.00 O ATOM 0 H SER A 90 8.349 -10.771 4.063 1.00 0.00 H new ATOM 0 HA SER A 90 8.402 -9.617 1.355 1.00 0.00 H new ATOM 0 HB2 SER A 90 10.001 -9.090 3.316 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.701 -10.665 3.001 1.00 0.00 H new ATOM 0 HG SER A 90 11.799 -8.976 1.877 1.00 0.00 H new ATOM 1221 N GLY A 91 8.368 -12.787 1.791 1.00 0.00 N ATOM 1222 CA GLY A 91 8.364 -14.055 1.086 1.00 0.00 C ATOM 1223 C GLY A 91 7.197 -14.007 0.107 1.00 0.00 C ATOM 1224 O GLY A 91 6.131 -13.476 0.445 1.00 0.00 O ATOM 0 H GLY A 91 7.965 -12.834 2.727 1.00 0.00 H new ATOM 0 HA2 GLY A 91 9.306 -14.208 0.559 1.00 0.00 H new ATOM 0 HA3 GLY A 91 8.251 -14.885 1.783 1.00 0.00 H new ATOM 1228 N LEU A 92 7.396 -14.537 -1.093 1.00 0.00 N ATOM 1229 CA LEU A 92 6.449 -14.588 -2.186 1.00 0.00 C ATOM 1230 C LEU A 92 6.238 -16.015 -2.675 1.00 0.00 C ATOM 1231 O LEU A 92 6.854 -16.966 -2.192 1.00 0.00 O ATOM 1232 CB LEU A 92 6.935 -13.638 -3.294 1.00 0.00 C ATOM 1233 CG LEU A 92 8.367 -13.826 -3.848 1.00 0.00 C ATOM 1234 CD1 LEU A 92 8.580 -15.147 -4.597 1.00 0.00 C ATOM 1235 CD2 LEU A 92 8.677 -12.675 -4.812 1.00 0.00 C ATOM 0 H LEU A 92 8.286 -14.971 -1.339 1.00 0.00 H new ATOM 0 HA LEU A 92 5.468 -14.253 -1.849 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.242 -13.722 -4.131 1.00 0.00 H new ATOM 0 HB3 LEU A 92 6.856 -12.619 -2.916 1.00 0.00 H new ATOM 0 HG LEU A 92 9.032 -13.838 -2.984 1.00 0.00 H new ATOM 0 HD11 LEU A 92 9.609 -15.201 -4.953 1.00 0.00 H new ATOM 0 HD12 LEU A 92 8.384 -15.982 -3.925 1.00 0.00 H new ATOM 0 HD13 LEU A 92 7.899 -15.198 -5.446 1.00 0.00 H new ATOM 0 HD21 LEU A 92 9.684 -12.795 -5.210 1.00 0.00 H new ATOM 0 HD22 LEU A 92 7.959 -12.684 -5.632 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.608 -11.726 -4.280 1.00 0.00 H new ATOM 1247 N GLY A 93 5.332 -16.154 -3.636 1.00 0.00 N ATOM 1248 CA GLY A 93 4.996 -17.432 -4.233 1.00 0.00 C ATOM 1249 C GLY A 93 3.735 -17.283 -5.054 1.00 0.00 C ATOM 1250 O GLY A 93 3.835 -16.806 -6.182 1.00 0.00 O ATOM 0 H GLY A 93 4.806 -15.371 -4.024 1.00 0.00 H new ATOM 0 HA2 GLY A 93 5.815 -17.779 -4.863 1.00 0.00 H new ATOM 0 HA3 GLY A 93 4.851 -18.183 -3.456 1.00 0.00 H new ATOM 1254 N ASP A 94 2.566 -17.566 -4.465 1.00 0.00 N ATOM 1255 CA ASP A 94 1.286 -17.485 -5.189 1.00 0.00 C ATOM 1256 C ASP A 94 0.129 -16.869 -4.404 1.00 0.00 C ATOM 1257 O ASP A 94 -0.934 -16.602 -4.972 1.00 0.00 O ATOM 1258 CB ASP A 94 0.891 -18.870 -5.721 1.00 0.00 C ATOM 1259 CG ASP A 94 1.741 -19.277 -6.924 1.00 0.00 C ATOM 1260 OD1 ASP A 94 1.469 -18.801 -8.049 1.00 0.00 O ATOM 1261 OD2 ASP A 94 2.652 -20.117 -6.746 1.00 0.00 O ATOM 0 H ASP A 94 2.478 -17.853 -3.490 1.00 0.00 H new ATOM 0 HA ASP A 94 1.468 -16.793 -6.012 1.00 0.00 H new ATOM 0 HB2 ASP A 94 1.004 -19.610 -4.929 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -0.162 -18.864 -6.004 1.00 0.00 H new ATOM 1266 N GLY A 95 0.337 -16.540 -3.130 1.00 0.00 N ATOM 1267 CA GLY A 95 -0.708 -15.968 -2.281 1.00 0.00 C ATOM 1268 C GLY A 95 -1.769 -17.022 -1.990 1.00 0.00 C ATOM 1269 O GLY A 95 -2.953 -16.703 -2.059 1.00 0.00 O ATOM 0 H GLY A 95 1.233 -16.662 -2.658 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -0.275 -15.607 -1.348 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -1.161 -15.109 -2.775 1.00 0.00 H new ATOM 1273 N TYR A 96 -1.343 -18.263 -1.705 1.00 0.00 N ATOM 1274 CA TYR A 96 -2.247 -19.374 -1.424 1.00 0.00 C ATOM 1275 C TYR A 96 -1.806 -20.253 -0.273 1.00 0.00 C ATOM 1276 O TYR A 96 -2.486 -20.425 0.738 1.00 0.00 O ATOM 1277 CB TYR A 96 -2.469 -20.196 -2.704 1.00 0.00 C ATOM 1278 CG TYR A 96 -3.628 -19.723 -3.560 1.00 0.00 C ATOM 1279 CD1 TYR A 96 -4.907 -19.607 -2.985 1.00 0.00 C ATOM 1280 CD2 TYR A 96 -3.449 -19.432 -4.927 1.00 0.00 C ATOM 1281 CE1 TYR A 96 -5.999 -19.180 -3.752 1.00 0.00 C ATOM 1282 CE2 TYR A 96 -4.545 -19.015 -5.706 1.00 0.00 C ATOM 1283 CZ TYR A 96 -5.826 -18.889 -5.121 1.00 0.00 C ATOM 1284 OH TYR A 96 -6.872 -18.442 -5.866 1.00 0.00 O ATOM 0 H TYR A 96 -0.356 -18.518 -1.665 1.00 0.00 H new ATOM 0 HA TYR A 96 -3.191 -18.938 -1.098 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -1.558 -20.169 -3.301 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -2.638 -21.237 -2.428 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -5.048 -19.850 -1.942 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -2.472 -19.529 -5.377 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -6.972 -19.074 -3.295 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -4.407 -18.791 -6.753 1.00 0.00 H new ATOM 0 HH TYR A 96 -6.576 -18.290 -6.788 1.00 0.00 H new ATOM 1294 N GLY A 97 -0.615 -20.765 -0.457 1.00 0.00 N ATOM 1295 CA GLY A 97 0.102 -21.668 0.438 1.00 0.00 C ATOM 1296 C GLY A 97 1.014 -20.964 1.442 1.00 0.00 C ATOM 1297 O GLY A 97 2.037 -21.540 1.817 1.00 0.00 O ATOM 0 H GLY A 97 -0.073 -20.552 -1.295 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -0.623 -22.271 0.984 1.00 0.00 H new ATOM 0 HA3 GLY A 97 0.701 -22.354 -0.161 1.00 0.00 H new ATOM 1301 N GLY A 98 0.671 -19.749 1.871 1.00 0.00 N ATOM 1302 CA GLY A 98 1.454 -18.948 2.802 1.00 0.00 C ATOM 1303 C GLY A 98 2.490 -18.187 1.983 1.00 0.00 C ATOM 1304 O GLY A 98 3.692 -18.274 2.251 1.00 0.00 O ATOM 0 H GLY A 98 -0.185 -19.285 1.569 1.00 0.00 H new ATOM 0 HA2 GLY A 98 0.812 -18.257 3.348 1.00 0.00 H new ATOM 0 HA3 GLY A 98 1.940 -19.584 3.542 1.00 0.00 H new ATOM 1308 N THR A 99 2.024 -17.473 0.955 1.00 0.00 N ATOM 1309 CA THR A 99 2.839 -16.703 0.020 1.00 0.00 C ATOM 1310 C THR A 99 2.161 -15.383 -0.385 1.00 0.00 C ATOM 1311 O THR A 99 1.185 -14.965 0.237 1.00 0.00 O ATOM 1312 CB THR A 99 3.213 -17.629 -1.150 1.00 0.00 C ATOM 1313 OG1 THR A 99 2.100 -18.374 -1.620 1.00 0.00 O ATOM 1314 CG2 THR A 99 4.356 -18.564 -0.747 1.00 0.00 C ATOM 0 H THR A 99 1.027 -17.415 0.745 1.00 0.00 H new ATOM 0 HA THR A 99 3.765 -16.371 0.490 1.00 0.00 H new ATOM 0 HB THR A 99 3.546 -16.996 -1.972 1.00 0.00 H new ATOM 0 HG1 THR A 99 2.409 -19.232 -1.980 1.00 0.00 H new ATOM 0 HG21 THR A 99 4.609 -19.213 -1.586 1.00 0.00 H new ATOM 0 HG22 THR A 99 5.229 -17.973 -0.470 1.00 0.00 H new ATOM 0 HG23 THR A 99 4.046 -19.173 0.102 1.00 0.00 H new ATOM 1322 N LEU A 100 2.681 -14.690 -1.406 1.00 0.00 N ATOM 1323 CA LEU A 100 2.175 -13.415 -1.913 1.00 0.00 C ATOM 1324 C LEU A 100 2.431 -13.343 -3.415 1.00 0.00 C ATOM 1325 O LEU A 100 3.552 -13.626 -3.849 1.00 0.00 O ATOM 1326 CB LEU A 100 2.923 -12.288 -1.164 1.00 0.00 C ATOM 1327 CG LEU A 100 2.826 -10.821 -1.649 1.00 0.00 C ATOM 1328 CD1 LEU A 100 3.635 -10.514 -2.917 1.00 0.00 C ATOM 1329 CD2 LEU A 100 1.391 -10.315 -1.810 1.00 0.00 C ATOM 0 H LEU A 100 3.499 -15.018 -1.920 1.00 0.00 H new ATOM 0 HA LEU A 100 1.103 -13.312 -1.748 1.00 0.00 H new ATOM 0 HB2 LEU A 100 2.581 -12.308 -0.129 1.00 0.00 H new ATOM 0 HB3 LEU A 100 3.980 -12.554 -1.155 1.00 0.00 H new ATOM 0 HG LEU A 100 3.287 -10.269 -0.830 1.00 0.00 H new ATOM 0 HD11 LEU A 100 3.509 -9.465 -3.184 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.690 -10.717 -2.734 1.00 0.00 H new ATOM 0 HD13 LEU A 100 3.281 -11.142 -3.735 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.406 -9.280 -2.152 1.00 0.00 H new ATOM 0 HD22 LEU A 100 0.868 -10.931 -2.541 1.00 0.00 H new ATOM 0 HD23 LEU A 100 0.875 -10.372 -0.851 1.00 0.00 H new ATOM 1341 N LEU A 101 1.405 -12.996 -4.199 1.00 0.00 N ATOM 1342 CA LEU A 101 1.447 -12.824 -5.647 1.00 0.00 C ATOM 1343 C LEU A 101 0.495 -11.700 -6.057 1.00 0.00 C ATOM 1344 O LEU A 101 -0.438 -11.380 -5.316 1.00 0.00 O ATOM 1345 CB LEU A 101 1.118 -14.156 -6.311 1.00 0.00 C ATOM 1346 CG LEU A 101 1.048 -14.150 -7.854 1.00 0.00 C ATOM 1347 CD1 LEU A 101 1.550 -15.468 -8.435 1.00 0.00 C ATOM 1348 CD2 LEU A 101 -0.390 -13.963 -8.355 1.00 0.00 C ATOM 0 H LEU A 101 0.476 -12.819 -3.816 1.00 0.00 H new ATOM 0 HA LEU A 101 2.443 -12.529 -5.979 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.868 -14.886 -6.005 1.00 0.00 H new ATOM 0 HB3 LEU A 101 0.159 -14.503 -5.926 1.00 0.00 H new ATOM 0 HG LEU A 101 1.675 -13.319 -8.179 1.00 0.00 H new ATOM 0 HD11 LEU A 101 1.488 -15.433 -9.523 1.00 0.00 H new ATOM 0 HD12 LEU A 101 2.586 -15.627 -8.135 1.00 0.00 H new ATOM 0 HD13 LEU A 101 0.935 -16.287 -8.063 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -0.399 -13.964 -9.445 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -1.013 -14.778 -7.986 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -0.782 -13.014 -7.990 1.00 0.00 H new ATOM 1360 N LEU A 102 0.764 -11.068 -7.203 1.00 0.00 N ATOM 1361 CA LEU A 102 -0.028 -10.000 -7.784 1.00 0.00 C ATOM 1362 C LEU A 102 -0.453 -10.396 -9.193 1.00 0.00 C ATOM 1363 O LEU A 102 0.250 -11.151 -9.862 1.00 0.00 O ATOM 1364 CB LEU A 102 0.724 -8.672 -7.676 1.00 0.00 C ATOM 1365 CG LEU A 102 1.865 -8.404 -8.672 1.00 0.00 C ATOM 1366 CD1 LEU A 102 1.351 -7.803 -9.983 1.00 0.00 C ATOM 1367 CD2 LEU A 102 2.819 -7.387 -8.033 1.00 0.00 C ATOM 0 H LEU A 102 1.578 -11.304 -7.770 1.00 0.00 H new ATOM 0 HA LEU A 102 -0.954 -9.844 -7.230 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -0.004 -7.867 -7.778 1.00 0.00 H new ATOM 0 HB3 LEU A 102 1.137 -8.603 -6.669 1.00 0.00 H new ATOM 0 HG LEU A 102 2.355 -9.352 -8.896 1.00 0.00 H new ATOM 0 HD11 LEU A 102 2.190 -7.630 -10.657 1.00 0.00 H new ATOM 0 HD12 LEU A 102 0.648 -8.493 -10.449 1.00 0.00 H new ATOM 0 HD13 LEU A 102 0.849 -6.857 -9.778 1.00 0.00 H new ATOM 0 HD21 LEU A 102 3.640 -7.178 -8.719 1.00 0.00 H new ATOM 0 HD22 LEU A 102 2.279 -6.464 -7.821 1.00 0.00 H new ATOM 0 HD23 LEU A 102 3.217 -7.795 -7.104 1.00 0.00 H new ATOM 1379 N LYS A 103 -1.606 -9.891 -9.628 1.00 0.00 N ATOM 1380 CA LYS A 103 -2.242 -10.120 -10.916 1.00 0.00 C ATOM 1381 C LYS A 103 -2.833 -8.808 -11.428 1.00 0.00 C ATOM 1382 O LYS A 103 -2.956 -7.837 -10.685 1.00 0.00 O ATOM 1383 CB LYS A 103 -3.397 -11.137 -10.731 1.00 0.00 C ATOM 1384 CG LYS A 103 -3.102 -12.612 -11.014 1.00 0.00 C ATOM 1385 CD LYS A 103 -2.836 -12.832 -12.504 1.00 0.00 C ATOM 1386 CE LYS A 103 -4.023 -12.558 -13.445 1.00 0.00 C ATOM 1387 NZ LYS A 103 -3.578 -12.304 -14.833 1.00 0.00 N ATOM 0 H LYS A 103 -2.158 -9.265 -9.042 1.00 0.00 H new ATOM 0 HA LYS A 103 -1.507 -10.501 -11.625 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -3.752 -11.058 -9.703 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -4.220 -10.830 -11.377 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -2.237 -12.933 -10.433 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -3.945 -13.225 -10.695 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -2.005 -12.194 -12.803 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -2.514 -13.863 -12.648 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -4.702 -13.411 -13.431 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -4.585 -11.698 -13.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -4.406 -12.124 -15.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -2.950 -11.475 -14.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -3.064 -13.135 -15.190 1.00 0.00 H new ATOM 1401 N THR A 104 -3.275 -8.792 -12.679 1.00 0.00 N ATOM 1402 CA THR A 104 -3.893 -7.639 -13.313 1.00 0.00 C ATOM 1403 C THR A 104 -5.254 -8.074 -13.857 1.00 0.00 C ATOM 1404 O THR A 104 -5.441 -9.244 -14.215 1.00 0.00 O ATOM 1405 CB THR A 104 -2.958 -7.040 -14.378 1.00 0.00 C ATOM 1406 OG1 THR A 104 -2.501 -8.019 -15.299 1.00 0.00 O ATOM 1407 CG2 THR A 104 -1.734 -6.401 -13.720 1.00 0.00 C ATOM 0 H THR A 104 -3.211 -9.602 -13.295 1.00 0.00 H new ATOM 0 HA THR A 104 -4.060 -6.834 -12.597 1.00 0.00 H new ATOM 0 HB THR A 104 -3.541 -6.291 -14.914 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.912 -7.597 -15.959 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.084 -5.983 -14.489 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.056 -5.607 -13.046 1.00 0.00 H new ATOM 0 HG23 THR A 104 -1.188 -7.157 -13.156 1.00 0.00 H new ATOM 1415 N ASN A 105 -6.213 -7.149 -13.873 1.00 0.00 N ATOM 1416 CA ASN A 105 -7.584 -7.338 -14.356 1.00 0.00 C ATOM 1417 C ASN A 105 -7.595 -7.655 -15.859 1.00 0.00 C ATOM 1418 O ASN A 105 -6.556 -7.638 -16.517 1.00 0.00 O ATOM 1419 CB ASN A 105 -8.436 -6.088 -14.080 1.00 0.00 C ATOM 1420 CG ASN A 105 -8.067 -4.955 -15.022 1.00 0.00 C ATOM 1421 OD1 ASN A 105 -6.906 -4.620 -15.143 1.00 0.00 O ATOM 1422 ND2 ASN A 105 -8.989 -4.360 -15.747 1.00 0.00 N ATOM 0 H ASN A 105 -6.049 -6.201 -13.534 1.00 0.00 H new ATOM 0 HA ASN A 105 -8.014 -8.182 -13.817 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -9.492 -6.331 -14.195 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -8.294 -5.768 -13.048 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -8.726 -3.625 -16.403 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -9.967 -4.634 -15.653 1.00 0.00 H new ATOM 1429 N ALA A 106 -8.786 -7.867 -16.429 1.00 0.00 N ATOM 1430 CA ALA A 106 -8.963 -8.193 -17.840 1.00 0.00 C ATOM 1431 C ALA A 106 -8.314 -7.203 -18.811 1.00 0.00 C ATOM 1432 O ALA A 106 -7.860 -7.614 -19.878 1.00 0.00 O ATOM 1433 CB ALA A 106 -10.458 -8.281 -18.152 1.00 0.00 C ATOM 0 H ALA A 106 -9.664 -7.815 -15.912 1.00 0.00 H new ATOM 0 HA ALA A 106 -8.456 -9.146 -17.991 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -10.596 -8.524 -19.205 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -10.913 -9.058 -17.537 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -10.932 -7.323 -17.936 1.00 0.00 H new ATOM 1439 N GLU A 107 -8.313 -5.910 -18.496 1.00 0.00 N ATOM 1440 CA GLU A 107 -7.736 -4.862 -19.337 1.00 0.00 C ATOM 1441 C GLU A 107 -6.293 -4.511 -18.933 1.00 0.00 C ATOM 1442 O GLU A 107 -5.588 -3.844 -19.692 1.00 0.00 O ATOM 1443 CB GLU A 107 -8.686 -3.660 -19.240 1.00 0.00 C ATOM 1444 CG GLU A 107 -8.300 -2.421 -20.054 1.00 0.00 C ATOM 1445 CD GLU A 107 -9.242 -1.245 -19.798 1.00 0.00 C ATOM 1446 OE1 GLU A 107 -9.710 -1.050 -18.649 1.00 0.00 O ATOM 1447 OE2 GLU A 107 -9.484 -0.462 -20.743 1.00 0.00 O ATOM 0 H GLU A 107 -8.721 -5.553 -17.632 1.00 0.00 H new ATOM 0 HA GLU A 107 -7.649 -5.200 -20.370 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -9.678 -3.982 -19.557 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -8.765 -3.370 -18.192 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -7.280 -2.128 -19.805 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -8.310 -2.668 -21.116 1.00 0.00 H new ATOM 1454 N GLY A 108 -5.815 -4.981 -17.782 1.00 0.00 N ATOM 1455 CA GLY A 108 -4.476 -4.698 -17.286 1.00 0.00 C ATOM 1456 C GLY A 108 -4.329 -3.248 -16.823 1.00 0.00 C ATOM 1457 O GLY A 108 -3.257 -2.663 -16.942 1.00 0.00 O ATOM 0 H GLY A 108 -6.359 -5.579 -17.160 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -4.248 -5.368 -16.457 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -3.748 -4.903 -18.071 1.00 0.00 H new ATOM 1461 N THR A 109 -5.418 -2.656 -16.350 1.00 0.00 N ATOM 1462 CA THR A 109 -5.539 -1.299 -15.848 1.00 0.00 C ATOM 1463 C THR A 109 -5.639 -1.263 -14.311 1.00 0.00 C ATOM 1464 O THR A 109 -5.424 -0.220 -13.692 1.00 0.00 O ATOM 1465 CB THR A 109 -6.770 -0.676 -16.524 1.00 0.00 C ATOM 1466 OG1 THR A 109 -7.870 -1.582 -16.651 1.00 0.00 O ATOM 1467 CG2 THR A 109 -6.398 -0.110 -17.893 1.00 0.00 C ATOM 0 H THR A 109 -6.307 -3.154 -16.305 1.00 0.00 H new ATOM 0 HA THR A 109 -4.646 -0.722 -16.090 1.00 0.00 H new ATOM 0 HB THR A 109 -7.102 0.128 -15.868 1.00 0.00 H new ATOM 0 HG1 THR A 109 -8.450 -1.291 -17.386 1.00 0.00 H new ATOM 0 HG21 THR A 109 -7.281 0.327 -18.358 1.00 0.00 H new ATOM 0 HG22 THR A 109 -5.633 0.657 -17.774 1.00 0.00 H new ATOM 0 HG23 THR A 109 -6.014 -0.910 -18.525 1.00 0.00 H new ATOM 1475 N ARG A 110 -5.983 -2.385 -13.679 1.00 0.00 N ATOM 1476 CA ARG A 110 -6.113 -2.571 -12.244 1.00 0.00 C ATOM 1477 C ARG A 110 -5.301 -3.788 -11.841 1.00 0.00 C ATOM 1478 O ARG A 110 -5.506 -4.886 -12.361 1.00 0.00 O ATOM 1479 CB ARG A 110 -7.568 -2.786 -11.839 1.00 0.00 C ATOM 1480 CG ARG A 110 -8.336 -1.468 -11.694 1.00 0.00 C ATOM 1481 CD ARG A 110 -9.736 -1.757 -11.152 1.00 0.00 C ATOM 1482 NE ARG A 110 -10.566 -0.544 -11.063 1.00 0.00 N ATOM 1483 CZ ARG A 110 -11.716 -0.305 -11.703 1.00 0.00 C ATOM 1484 NH1 ARG A 110 -12.129 -1.124 -12.665 1.00 0.00 N ATOM 1485 NH2 ARG A 110 -12.464 0.737 -11.359 1.00 0.00 N ATOM 0 H ARG A 110 -6.191 -3.240 -14.194 1.00 0.00 H new ATOM 0 HA ARG A 110 -5.751 -1.674 -11.741 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -8.061 -3.410 -12.584 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -7.603 -3.329 -10.895 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -7.804 -0.796 -11.020 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -8.403 -0.965 -12.659 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -10.229 -2.485 -11.797 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -9.654 -2.211 -10.164 1.00 0.00 H new ATOM 0 HE ARG A 110 -10.227 0.194 -10.446 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -11.568 -1.938 -12.917 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -13.006 -0.939 -13.151 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -12.162 1.356 -10.606 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -13.341 0.919 -11.847 1.00 0.00 H new ATOM 1499 N THR A 111 -4.454 -3.612 -10.844 1.00 0.00 N ATOM 1500 CA THR A 111 -3.572 -4.608 -10.289 1.00 0.00 C ATOM 1501 C THR A 111 -4.090 -5.041 -8.919 1.00 0.00 C ATOM 1502 O THR A 111 -4.245 -4.216 -8.023 1.00 0.00 O ATOM 1503 CB THR A 111 -2.175 -3.990 -10.193 1.00 0.00 C ATOM 1504 OG1 THR A 111 -1.759 -3.505 -11.457 1.00 0.00 O ATOM 1505 CG2 THR A 111 -1.148 -5.009 -9.715 1.00 0.00 C ATOM 0 H THR A 111 -4.362 -2.711 -10.374 1.00 0.00 H new ATOM 0 HA THR A 111 -3.530 -5.497 -10.919 1.00 0.00 H new ATOM 0 HB THR A 111 -2.237 -3.172 -9.475 1.00 0.00 H new ATOM 0 HG1 THR A 111 -0.865 -3.112 -11.378 1.00 0.00 H new ATOM 0 HG21 THR A 111 -0.167 -4.538 -9.658 1.00 0.00 H new ATOM 0 HG22 THR A 111 -1.432 -5.377 -8.729 1.00 0.00 H new ATOM 0 HG23 THR A 111 -1.110 -5.843 -10.416 1.00 0.00 H new ATOM 1513 N TYR A 112 -4.435 -6.315 -8.776 1.00 0.00 N ATOM 1514 CA TYR A 112 -4.915 -6.934 -7.542 1.00 0.00 C ATOM 1515 C TYR A 112 -3.734 -7.752 -7.013 1.00 0.00 C ATOM 1516 O TYR A 112 -2.879 -8.195 -7.784 1.00 0.00 O ATOM 1517 CB TYR A 112 -6.147 -7.801 -7.846 1.00 0.00 C ATOM 1518 CG TYR A 112 -7.466 -7.040 -7.810 1.00 0.00 C ATOM 1519 CD1 TYR A 112 -7.760 -6.039 -8.760 1.00 0.00 C ATOM 1520 CD2 TYR A 112 -8.416 -7.349 -6.819 1.00 0.00 C ATOM 1521 CE1 TYR A 112 -8.985 -5.345 -8.704 1.00 0.00 C ATOM 1522 CE2 TYR A 112 -9.628 -6.643 -6.738 1.00 0.00 C ATOM 1523 CZ TYR A 112 -9.917 -5.637 -7.681 1.00 0.00 C ATOM 1524 OH TYR A 112 -11.092 -4.953 -7.586 1.00 0.00 O ATOM 0 H TYR A 112 -4.386 -6.976 -9.551 1.00 0.00 H new ATOM 0 HA TYR A 112 -5.235 -6.209 -6.794 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -6.027 -8.252 -8.831 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -6.191 -8.617 -7.125 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -7.043 -5.804 -9.533 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -8.211 -8.139 -6.112 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -9.212 -4.590 -9.442 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -10.336 -6.871 -5.955 1.00 0.00 H new ATOM 0 HH TYR A 112 -11.606 -5.290 -6.823 1.00 0.00 H new ATOM 1534 N LEU A 113 -3.633 -7.943 -5.703 1.00 0.00 N ATOM 1535 CA LEU A 113 -2.532 -8.696 -5.104 1.00 0.00 C ATOM 1536 C LEU A 113 -3.020 -9.418 -3.869 1.00 0.00 C ATOM 1537 O LEU A 113 -3.433 -8.742 -2.926 1.00 0.00 O ATOM 1538 CB LEU A 113 -1.308 -7.801 -4.809 1.00 0.00 C ATOM 1539 CG LEU A 113 -1.513 -6.406 -4.170 1.00 0.00 C ATOM 1540 CD1 LEU A 113 -0.174 -5.958 -3.570 1.00 0.00 C ATOM 1541 CD2 LEU A 113 -1.935 -5.323 -5.181 1.00 0.00 C ATOM 0 H LEU A 113 -4.307 -7.583 -5.027 1.00 0.00 H new ATOM 0 HA LEU A 113 -2.191 -9.439 -5.825 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -0.643 -8.364 -4.154 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -0.778 -7.653 -5.750 1.00 0.00 H new ATOM 0 HG LEU A 113 -2.309 -6.508 -3.432 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.291 -4.976 -3.112 1.00 0.00 H new ATOM 0 HD12 LEU A 113 0.144 -6.675 -2.813 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.578 -5.904 -4.357 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -2.061 -4.372 -4.664 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -1.166 -5.221 -5.947 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -2.877 -5.609 -5.649 1.00 0.00 H new ATOM 1553 N LYS A 114 -2.970 -10.764 -3.844 1.00 0.00 N ATOM 1554 CA LYS A 114 -3.457 -11.492 -2.678 1.00 0.00 C ATOM 1555 C LYS A 114 -2.259 -11.857 -1.848 1.00 0.00 C ATOM 1556 O LYS A 114 -1.326 -12.533 -2.301 1.00 0.00 O ATOM 1557 CB LYS A 114 -4.297 -12.756 -2.970 1.00 0.00 C ATOM 1558 CG LYS A 114 -5.381 -12.647 -4.055 1.00 0.00 C ATOM 1559 CD LYS A 114 -5.005 -13.311 -5.388 1.00 0.00 C ATOM 1560 CE LYS A 114 -4.801 -14.838 -5.331 1.00 0.00 C ATOM 1561 NZ LYS A 114 -6.026 -15.594 -4.999 1.00 0.00 N ATOM 0 H LYS A 114 -2.607 -11.347 -4.598 1.00 0.00 H new ATOM 0 HA LYS A 114 -4.152 -10.828 -2.163 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.614 -13.557 -3.255 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -4.779 -13.063 -2.042 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -6.299 -13.100 -3.682 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -5.595 -11.593 -4.234 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.786 -13.093 -6.116 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.088 -12.852 -5.757 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -4.425 -15.181 -6.295 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -4.034 -15.065 -4.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -5.857 -16.610 -5.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -6.281 -15.424 -4.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -6.804 -15.282 -5.614 1.00 0.00 H new ATOM 1575 N SER A 115 -2.322 -11.377 -0.619 1.00 0.00 N ATOM 1576 CA SER A 115 -1.346 -11.577 0.410 1.00 0.00 C ATOM 1577 C SER A 115 -1.972 -12.625 1.299 1.00 0.00 C ATOM 1578 O SER A 115 -3.151 -12.538 1.624 1.00 0.00 O ATOM 1579 CB SER A 115 -1.154 -10.255 1.150 1.00 0.00 C ATOM 1580 OG SER A 115 -0.142 -10.314 2.133 1.00 0.00 O ATOM 0 H SER A 115 -3.106 -10.805 -0.305 1.00 0.00 H new ATOM 0 HA SER A 115 -0.366 -11.892 0.052 1.00 0.00 H new ATOM 0 HB2 SER A 115 -0.908 -9.474 0.430 1.00 0.00 H new ATOM 0 HB3 SER A 115 -2.094 -9.969 1.621 1.00 0.00 H new ATOM 0 HG SER A 115 -0.062 -9.442 2.573 1.00 0.00 H new ATOM 1586 N PHE A 116 -1.208 -13.672 1.562 1.00 0.00 N ATOM 1587 CA PHE A 116 -1.403 -14.827 2.365 1.00 0.00 C ATOM 1588 C PHE A 116 -2.810 -15.473 2.497 1.00 0.00 C ATOM 1589 O PHE A 116 -2.981 -16.303 3.391 1.00 0.00 O ATOM 1590 CB PHE A 116 -0.685 -14.405 3.660 1.00 0.00 C ATOM 1591 CG PHE A 116 0.688 -14.997 3.846 1.00 0.00 C ATOM 1592 CD1 PHE A 116 1.745 -14.504 3.069 1.00 0.00 C ATOM 1593 CD2 PHE A 116 0.926 -16.003 4.801 1.00 0.00 C ATOM 1594 CE1 PHE A 116 3.031 -15.036 3.211 1.00 0.00 C ATOM 1595 CE2 PHE A 116 2.226 -16.503 4.982 1.00 0.00 C ATOM 1596 CZ PHE A 116 3.275 -16.017 4.183 1.00 0.00 C ATOM 0 H PHE A 116 -0.284 -13.716 1.132 1.00 0.00 H new ATOM 0 HA PHE A 116 -1.002 -15.720 1.886 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -0.601 -13.318 3.674 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -1.305 -14.688 4.511 1.00 0.00 H new ATOM 0 HD1 PHE A 116 1.566 -13.711 2.358 1.00 0.00 H new ATOM 0 HD2 PHE A 116 0.110 -16.390 5.394 1.00 0.00 H new ATOM 0 HE1 PHE A 116 3.833 -14.692 2.574 1.00 0.00 H new ATOM 0 HE2 PHE A 116 2.418 -17.257 5.731 1.00 0.00 H new ATOM 0 HZ PHE A 116 4.275 -16.401 4.318 1.00 0.00 H new ATOM 1606 N GLU A 117 -3.776 -15.181 1.616 1.00 0.00 N ATOM 1607 CA GLU A 117 -5.165 -15.665 1.499 1.00 0.00 C ATOM 1608 C GLU A 117 -5.249 -17.145 1.911 1.00 0.00 C ATOM 1609 O GLU A 117 -4.964 -18.076 1.153 1.00 0.00 O ATOM 1610 CB GLU A 117 -5.576 -15.399 0.046 1.00 0.00 C ATOM 1611 CG GLU A 117 -6.913 -16.022 -0.360 1.00 0.00 C ATOM 1612 CD GLU A 117 -7.579 -15.157 -1.424 1.00 0.00 C ATOM 1613 OE1 GLU A 117 -8.295 -14.206 -1.029 1.00 0.00 O ATOM 1614 OE2 GLU A 117 -7.403 -15.405 -2.642 1.00 0.00 O ATOM 0 H GLU A 117 -3.579 -14.513 0.871 1.00 0.00 H new ATOM 0 HA GLU A 117 -5.855 -15.152 2.169 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -5.629 -14.322 -0.112 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -4.797 -15.780 -0.614 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -6.754 -17.030 -0.743 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -7.563 -16.111 0.510 1.00 0.00 H new ATOM 1621 N ALA A 118 -5.658 -17.291 3.167 1.00 0.00 N ATOM 1622 CA ALA A 118 -5.886 -18.437 4.033 1.00 0.00 C ATOM 1623 C ALA A 118 -5.367 -18.038 5.401 1.00 0.00 C ATOM 1624 O ALA A 118 -4.393 -18.559 5.946 1.00 0.00 O ATOM 1625 CB ALA A 118 -5.325 -19.771 3.563 1.00 0.00 C ATOM 0 H ALA A 118 -5.876 -16.444 3.691 1.00 0.00 H new ATOM 0 HA ALA A 118 -6.955 -18.652 4.036 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -5.562 -20.543 4.295 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -5.768 -20.034 2.602 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -4.243 -19.693 3.455 1.00 0.00 H new ATOM 1631 N ASP A 119 -5.993 -16.980 5.892 1.00 0.00 N ATOM 1632 CA ASP A 119 -5.749 -16.392 7.190 1.00 0.00 C ATOM 1633 C ASP A 119 -6.162 -17.374 8.252 1.00 0.00 C ATOM 1634 O ASP A 119 -6.835 -18.364 7.953 1.00 0.00 O ATOM 1635 CB ASP A 119 -6.589 -15.149 7.432 1.00 0.00 C ATOM 1636 CG ASP A 119 -6.306 -14.521 8.796 1.00 0.00 C ATOM 1637 OD1 ASP A 119 -5.135 -14.235 9.142 1.00 0.00 O ATOM 1638 OD2 ASP A 119 -7.255 -14.477 9.593 1.00 0.00 O ATOM 0 H ASP A 119 -6.718 -16.489 5.368 1.00 0.00 H new ATOM 0 HA ASP A 119 -4.690 -16.135 7.225 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -6.389 -14.418 6.648 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -7.646 -15.407 7.364 1.00 0.00 H new ATOM 1643 N ALA A 120 -5.647 -17.172 9.453 1.00 0.00 N ATOM 1644 CA ALA A 120 -6.053 -18.005 10.580 1.00 0.00 C ATOM 1645 C ALA A 120 -7.607 -18.124 10.597 1.00 0.00 C ATOM 1646 O ALA A 120 -8.130 -19.180 10.935 1.00 0.00 O ATOM 1647 CB ALA A 120 -5.524 -17.391 11.874 1.00 0.00 C ATOM 0 H ALA A 120 -4.959 -16.453 9.674 1.00 0.00 H new ATOM 0 HA ALA A 120 -5.637 -19.008 10.484 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -5.825 -18.010 12.720 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -4.436 -17.337 11.833 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -5.933 -16.388 11.995 1.00 0.00 H new ATOM 1653 N GLU A 121 -8.335 -17.099 10.122 1.00 0.00 N ATOM 1654 CA GLU A 121 -9.796 -17.005 10.017 1.00 0.00 C ATOM 1655 C GLU A 121 -10.307 -17.148 8.561 1.00 0.00 C ATOM 1656 O GLU A 121 -11.452 -16.840 8.247 1.00 0.00 O ATOM 1657 CB GLU A 121 -10.206 -15.672 10.650 1.00 0.00 C ATOM 1658 CG GLU A 121 -11.624 -15.618 11.231 1.00 0.00 C ATOM 1659 CD GLU A 121 -11.927 -16.796 12.154 1.00 0.00 C ATOM 1660 OE1 GLU A 121 -11.348 -16.889 13.260 1.00 0.00 O ATOM 1661 OE2 GLU A 121 -12.778 -17.634 11.788 1.00 0.00 O ATOM 0 H GLU A 121 -7.881 -16.253 9.777 1.00 0.00 H new ATOM 0 HA GLU A 121 -10.260 -17.837 10.547 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -9.499 -15.436 11.445 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -10.112 -14.890 9.897 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -11.751 -14.687 11.783 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -12.347 -15.606 10.415 1.00 0.00 H new ATOM 1668 N GLY A 122 -9.427 -17.528 7.639 1.00 0.00 N ATOM 1669 CA GLY A 122 -9.673 -17.777 6.210 1.00 0.00 C ATOM 1670 C GLY A 122 -9.789 -16.581 5.261 1.00 0.00 C ATOM 1671 O GLY A 122 -10.203 -16.773 4.119 1.00 0.00 O ATOM 0 H GLY A 122 -8.449 -17.683 7.883 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -8.867 -18.413 5.843 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -10.595 -18.353 6.129 1.00 0.00 H new ATOM 1675 N ARG A 123 -9.372 -15.379 5.669 1.00 0.00 N ATOM 1676 CA ARG A 123 -9.423 -14.128 4.900 1.00 0.00 C ATOM 1677 C ARG A 123 -8.277 -13.186 5.285 1.00 0.00 C ATOM 1678 O ARG A 123 -8.186 -12.788 6.450 1.00 0.00 O ATOM 1679 CB ARG A 123 -10.747 -13.438 5.193 1.00 0.00 C ATOM 1680 CG ARG A 123 -11.242 -13.422 6.661 1.00 0.00 C ATOM 1681 CD ARG A 123 -12.746 -13.177 6.716 1.00 0.00 C ATOM 1682 NE ARG A 123 -13.228 -13.012 8.095 1.00 0.00 N ATOM 1683 CZ ARG A 123 -14.493 -12.735 8.421 1.00 0.00 C ATOM 1684 NH1 ARG A 123 -15.384 -12.492 7.467 1.00 0.00 N ATOM 1685 NH2 ARG A 123 -14.848 -12.679 9.699 1.00 0.00 N ATOM 0 H ARG A 123 -8.967 -15.243 6.595 1.00 0.00 H new ATOM 0 HA ARG A 123 -9.327 -14.365 3.841 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -10.669 -12.405 4.854 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -11.516 -13.915 4.585 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -11.005 -14.371 7.141 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -10.720 -12.644 7.218 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -12.989 -12.285 6.138 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -13.267 -14.012 6.248 1.00 0.00 H new ATOM 0 HE ARG A 123 -12.552 -13.116 8.852 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -15.102 -12.517 6.487 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -16.351 -12.280 7.714 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -14.155 -12.847 10.429 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -15.813 -12.468 9.951 1.00 0.00 H new ATOM 1699 N ARG A 124 -7.371 -12.867 4.360 1.00 0.00 N ATOM 1700 CA ARG A 124 -6.214 -11.995 4.486 1.00 0.00 C ATOM 1701 C ARG A 124 -6.470 -10.724 3.671 1.00 0.00 C ATOM 1702 O ARG A 124 -7.426 -10.670 2.892 1.00 0.00 O ATOM 1703 CB ARG A 124 -4.946 -12.718 4.050 1.00 0.00 C ATOM 1704 CG ARG A 124 -4.360 -13.766 5.013 1.00 0.00 C ATOM 1705 CD ARG A 124 -4.115 -13.351 6.479 1.00 0.00 C ATOM 1706 NE ARG A 124 -3.011 -12.397 6.643 1.00 0.00 N ATOM 1707 CZ ARG A 124 -2.721 -11.761 7.784 1.00 0.00 C ATOM 1708 NH1 ARG A 124 -3.397 -12.008 8.905 1.00 0.00 N ATOM 1709 NH2 ARG A 124 -1.749 -10.863 7.782 1.00 0.00 N ATOM 0 H ARG A 124 -7.440 -13.251 3.418 1.00 0.00 H new ATOM 0 HA ARG A 124 -6.064 -11.714 5.528 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -5.150 -13.211 3.099 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -4.178 -11.967 3.862 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -5.030 -14.626 5.018 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -3.410 -14.104 4.599 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -5.028 -12.910 6.880 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -3.905 -14.242 7.070 1.00 0.00 H new ATOM 0 HE ARG A 124 -2.424 -12.206 5.831 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -4.152 -12.693 8.905 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -3.159 -11.512 9.764 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -1.237 -10.667 6.922 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -1.512 -10.367 8.641 1.00 0.00 H new ATOM 1723 N PHE A 125 -5.640 -9.695 3.844 1.00 0.00 N ATOM 1724 CA PHE A 125 -5.851 -8.428 3.163 1.00 0.00 C ATOM 1725 C PHE A 125 -5.428 -8.426 1.696 1.00 0.00 C ATOM 1726 O PHE A 125 -4.495 -9.104 1.262 1.00 0.00 O ATOM 1727 CB PHE A 125 -5.133 -7.332 3.962 1.00 0.00 C ATOM 1728 CG PHE A 125 -5.448 -5.907 3.548 1.00 0.00 C ATOM 1729 CD1 PHE A 125 -6.783 -5.468 3.420 1.00 0.00 C ATOM 1730 CD2 PHE A 125 -4.397 -4.997 3.342 1.00 0.00 C ATOM 1731 CE1 PHE A 125 -7.057 -4.144 3.044 1.00 0.00 C ATOM 1732 CE2 PHE A 125 -4.671 -3.655 3.030 1.00 0.00 C ATOM 1733 CZ PHE A 125 -6.002 -3.236 2.861 1.00 0.00 C ATOM 0 H PHE A 125 -4.819 -9.719 4.449 1.00 0.00 H new ATOM 0 HA PHE A 125 -6.924 -8.240 3.129 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -5.387 -7.450 5.015 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -4.058 -7.488 3.874 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -7.596 -6.153 3.612 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -3.373 -5.331 3.424 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -8.078 -3.824 2.896 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -3.862 -2.948 2.920 1.00 0.00 H new ATOM 0 HZ PHE A 125 -6.214 -2.212 2.590 1.00 0.00 H new ATOM 1743 N GLU A 126 -6.243 -7.699 0.927 1.00 0.00 N ATOM 1744 CA GLU A 126 -6.152 -7.467 -0.509 1.00 0.00 C ATOM 1745 C GLU A 126 -6.432 -5.984 -0.745 1.00 0.00 C ATOM 1746 O GLU A 126 -7.202 -5.368 -0.010 1.00 0.00 O ATOM 1747 CB GLU A 126 -7.186 -8.333 -1.267 1.00 0.00 C ATOM 1748 CG GLU A 126 -6.552 -9.397 -2.181 1.00 0.00 C ATOM 1749 CD GLU A 126 -6.870 -9.232 -3.679 1.00 0.00 C ATOM 1750 OE1 GLU A 126 -6.264 -8.352 -4.328 1.00 0.00 O ATOM 1751 OE2 GLU A 126 -7.728 -9.978 -4.218 1.00 0.00 O ATOM 0 H GLU A 126 -7.048 -7.220 1.330 1.00 0.00 H new ATOM 0 HA GLU A 126 -5.163 -7.740 -0.878 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -7.833 -8.828 -0.543 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -7.821 -7.682 -1.868 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -5.470 -9.372 -2.048 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -6.890 -10.382 -1.858 1.00 0.00 H new ATOM 1758 N VAL A 127 -5.786 -5.433 -1.765 1.00 0.00 N ATOM 1759 CA VAL A 127 -5.851 -4.043 -2.224 1.00 0.00 C ATOM 1760 C VAL A 127 -5.816 -4.050 -3.753 1.00 0.00 C ATOM 1761 O VAL A 127 -5.335 -5.013 -4.362 1.00 0.00 O ATOM 1762 CB VAL A 127 -4.685 -3.236 -1.615 1.00 0.00 C ATOM 1763 CG1 VAL A 127 -4.447 -1.872 -2.269 1.00 0.00 C ATOM 1764 CG2 VAL A 127 -4.971 -2.967 -0.140 1.00 0.00 C ATOM 0 H VAL A 127 -5.152 -5.987 -2.341 1.00 0.00 H new ATOM 0 HA VAL A 127 -6.772 -3.561 -1.897 1.00 0.00 H new ATOM 0 HB VAL A 127 -3.798 -3.849 -1.778 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -3.610 -1.375 -1.779 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -4.219 -2.010 -3.326 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -5.343 -1.259 -2.169 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -4.148 -2.397 0.292 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -5.896 -2.397 -0.047 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -5.073 -3.914 0.389 1.00 0.00 H new ATOM 1774 N ALA A 128 -6.379 -3.022 -4.386 1.00 0.00 N ATOM 1775 CA ALA A 128 -6.404 -2.860 -5.828 1.00 0.00 C ATOM 1776 C ALA A 128 -5.689 -1.557 -6.140 1.00 0.00 C ATOM 1777 O ALA A 128 -5.980 -0.522 -5.556 1.00 0.00 O ATOM 1778 CB ALA A 128 -7.827 -2.818 -6.381 1.00 0.00 C ATOM 0 H ALA A 128 -6.842 -2.260 -3.890 1.00 0.00 H new ATOM 0 HA ALA A 128 -5.915 -3.713 -6.298 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -7.793 -2.696 -7.464 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -8.340 -3.748 -6.137 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -8.365 -1.980 -5.938 1.00 0.00 H new ATOM 1784 N LEU A 129 -4.746 -1.614 -7.062 1.00 0.00 N ATOM 1785 CA LEU A 129 -3.969 -0.469 -7.505 1.00 0.00 C ATOM 1786 C LEU A 129 -4.394 -0.168 -8.933 1.00 0.00 C ATOM 1787 O LEU A 129 -4.489 -1.094 -9.737 1.00 0.00 O ATOM 1788 CB LEU A 129 -2.474 -0.838 -7.393 1.00 0.00 C ATOM 1789 CG LEU A 129 -1.474 -0.018 -8.244 1.00 0.00 C ATOM 1790 CD1 LEU A 129 -0.112 -0.101 -7.553 1.00 0.00 C ATOM 1791 CD2 LEU A 129 -1.215 -0.555 -9.661 1.00 0.00 C ATOM 0 H LEU A 129 -4.492 -2.480 -7.537 1.00 0.00 H new ATOM 0 HA LEU A 129 -4.135 0.423 -6.900 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -2.181 -0.746 -6.347 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -2.365 -1.888 -7.663 1.00 0.00 H new ATOM 0 HG LEU A 129 -1.914 0.976 -8.329 1.00 0.00 H new ATOM 0 HD11 LEU A 129 0.622 0.467 -8.125 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -0.188 0.314 -6.548 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.202 -1.143 -7.493 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -0.501 0.092 -10.170 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -0.810 -1.565 -9.599 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -2.151 -0.573 -10.220 1.00 0.00 H new ATOM 1803 N ASP A 130 -4.728 1.078 -9.237 1.00 0.00 N ATOM 1804 CA ASP A 130 -5.108 1.521 -10.571 1.00 0.00 C ATOM 1805 C ASP A 130 -3.756 1.911 -11.153 1.00 0.00 C ATOM 1806 O ASP A 130 -3.121 2.847 -10.663 1.00 0.00 O ATOM 1807 CB ASP A 130 -6.084 2.695 -10.491 1.00 0.00 C ATOM 1808 CG ASP A 130 -6.932 2.809 -11.743 1.00 0.00 C ATOM 1809 OD1 ASP A 130 -6.487 3.376 -12.755 1.00 0.00 O ATOM 1810 OD2 ASP A 130 -8.091 2.317 -11.720 1.00 0.00 O ATOM 0 H ASP A 130 -4.743 1.828 -8.546 1.00 0.00 H new ATOM 0 HA ASP A 130 -5.633 0.780 -11.174 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -6.732 2.571 -9.623 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -5.528 3.621 -10.343 1.00 0.00 H new ATOM 1815 N GLY A 131 -3.245 1.108 -12.081 1.00 0.00 N ATOM 1816 CA GLY A 131 -1.943 1.362 -12.666 1.00 0.00 C ATOM 1817 C GLY A 131 -1.981 2.527 -13.634 1.00 0.00 C ATOM 1818 O GLY A 131 -2.847 2.549 -14.512 1.00 0.00 O ATOM 0 H GLY A 131 -3.716 0.278 -12.441 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -1.223 1.570 -11.875 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -1.597 0.468 -13.185 1.00 0.00 H new ATOM 1822 N ASP A 132 -1.029 3.453 -13.511 1.00 0.00 N ATOM 1823 CA ASP A 132 -0.912 4.610 -14.380 1.00 0.00 C ATOM 1824 C ASP A 132 0.518 4.783 -14.888 1.00 0.00 C ATOM 1825 O ASP A 132 0.730 4.601 -16.091 1.00 0.00 O ATOM 1826 CB ASP A 132 -1.467 5.885 -13.757 1.00 0.00 C ATOM 1827 CG ASP A 132 -1.612 6.894 -14.895 1.00 0.00 C ATOM 1828 OD1 ASP A 132 -2.542 6.739 -15.725 1.00 0.00 O ATOM 1829 OD2 ASP A 132 -0.744 7.773 -15.057 1.00 0.00 O ATOM 0 H ASP A 132 -0.308 3.413 -12.790 1.00 0.00 H new ATOM 0 HA ASP A 132 -1.543 4.413 -15.247 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -2.429 5.697 -13.280 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -0.797 6.264 -12.985 1.00 0.00 H new ATOM 1834 N HIS A 133 1.474 5.120 -14.011 1.00 0.00 N ATOM 1835 CA HIS A 133 2.881 5.298 -14.378 1.00 0.00 C ATOM 1836 C HIS A 133 3.582 3.939 -14.289 1.00 0.00 C ATOM 1837 O HIS A 133 3.634 3.192 -15.268 1.00 0.00 O ATOM 1838 CB HIS A 133 3.568 6.365 -13.496 1.00 0.00 C ATOM 1839 CG HIS A 133 3.295 7.790 -13.915 1.00 0.00 C ATOM 1840 ND1 HIS A 133 4.217 8.665 -14.452 1.00 0.00 N ATOM 1841 CD2 HIS A 133 2.103 8.456 -13.817 1.00 0.00 C ATOM 1842 CE1 HIS A 133 3.586 9.822 -14.702 1.00 0.00 C ATOM 1843 NE2 HIS A 133 2.284 9.727 -14.379 1.00 0.00 N ATOM 0 H HIS A 133 1.289 5.277 -13.020 1.00 0.00 H new ATOM 0 HA HIS A 133 2.949 5.668 -15.401 1.00 0.00 H new ATOM 0 HB2 HIS A 133 3.240 6.233 -12.465 1.00 0.00 H new ATOM 0 HB3 HIS A 133 4.644 6.194 -13.512 1.00 0.00 H new ATOM 0 HD2 HIS A 133 1.190 8.072 -13.386 1.00 0.00 H new ATOM 0 HE1 HIS A 133 4.057 10.706 -15.106 1.00 0.00 H new ATOM 0 HE2 HIS A 133 1.568 10.441 -14.516 1.00 0.00 H new ATOM 1851 N THR A 134 4.100 3.595 -13.110 1.00 0.00 N ATOM 1852 CA THR A 134 4.809 2.360 -12.825 1.00 0.00 C ATOM 1853 C THR A 134 4.160 1.678 -11.627 1.00 0.00 C ATOM 1854 O THR A 134 3.703 2.351 -10.703 1.00 0.00 O ATOM 1855 CB THR A 134 6.304 2.601 -12.584 1.00 0.00 C ATOM 1856 OG1 THR A 134 6.718 3.959 -12.690 1.00 0.00 O ATOM 1857 CG2 THR A 134 7.196 1.753 -13.487 1.00 0.00 C ATOM 0 H THR A 134 4.030 4.202 -12.293 1.00 0.00 H new ATOM 0 HA THR A 134 4.738 1.708 -13.695 1.00 0.00 H new ATOM 0 HB THR A 134 6.430 2.297 -11.545 1.00 0.00 H new ATOM 0 HG1 THR A 134 7.681 4.022 -12.521 1.00 0.00 H new ATOM 0 HG21 THR A 134 8.242 1.968 -13.270 1.00 0.00 H new ATOM 0 HG22 THR A 134 6.997 0.697 -13.306 1.00 0.00 H new ATOM 0 HG23 THR A 134 6.986 1.988 -14.530 1.00 0.00 H new ATOM 1865 N GLY A 135 4.145 0.347 -11.635 1.00 0.00 N ATOM 1866 CA GLY A 135 3.602 -0.501 -10.579 1.00 0.00 C ATOM 1867 C GLY A 135 4.735 -1.304 -9.931 1.00 0.00 C ATOM 1868 O GLY A 135 4.490 -2.316 -9.263 1.00 0.00 O ATOM 0 H GLY A 135 4.528 -0.192 -12.412 1.00 0.00 H new ATOM 0 HA2 GLY A 135 3.101 0.111 -9.829 1.00 0.00 H new ATOM 0 HA3 GLY A 135 2.853 -1.177 -10.991 1.00 0.00 H new ATOM 1872 N ASP A 136 5.983 -0.889 -10.170 1.00 0.00 N ATOM 1873 CA ASP A 136 7.193 -1.523 -9.670 1.00 0.00 C ATOM 1874 C ASP A 136 7.360 -1.212 -8.188 1.00 0.00 C ATOM 1875 O ASP A 136 7.723 -0.102 -7.793 1.00 0.00 O ATOM 1876 CB ASP A 136 8.409 -1.089 -10.511 1.00 0.00 C ATOM 1877 CG ASP A 136 8.924 -2.265 -11.335 1.00 0.00 C ATOM 1878 OD1 ASP A 136 8.171 -2.761 -12.202 1.00 0.00 O ATOM 1879 OD2 ASP A 136 10.044 -2.756 -11.068 1.00 0.00 O ATOM 0 H ASP A 136 6.179 -0.067 -10.742 1.00 0.00 H new ATOM 0 HA ASP A 136 7.114 -2.606 -9.768 1.00 0.00 H new ATOM 0 HB2 ASP A 136 8.130 -0.267 -11.171 1.00 0.00 H new ATOM 0 HB3 ASP A 136 9.199 -0.719 -9.858 1.00 0.00 H new ATOM 1884 N LEU A 137 7.079 -2.208 -7.353 1.00 0.00 N ATOM 1885 CA LEU A 137 7.172 -2.132 -5.907 1.00 0.00 C ATOM 1886 C LEU A 137 8.472 -2.810 -5.491 1.00 0.00 C ATOM 1887 O LEU A 137 8.824 -3.887 -5.982 1.00 0.00 O ATOM 1888 CB LEU A 137 5.963 -2.830 -5.257 1.00 0.00 C ATOM 1889 CG LEU A 137 4.839 -1.858 -4.854 1.00 0.00 C ATOM 1890 CD1 LEU A 137 4.170 -1.163 -6.045 1.00 0.00 C ATOM 1891 CD2 LEU A 137 3.769 -2.603 -4.047 1.00 0.00 C ATOM 0 H LEU A 137 6.769 -3.122 -7.682 1.00 0.00 H new ATOM 0 HA LEU A 137 7.168 -1.093 -5.577 1.00 0.00 H new ATOM 0 HB2 LEU A 137 5.563 -3.569 -5.952 1.00 0.00 H new ATOM 0 HB3 LEU A 137 6.298 -3.373 -4.373 1.00 0.00 H new ATOM 0 HG LEU A 137 5.312 -1.081 -4.254 1.00 0.00 H new ATOM 0 HD11 LEU A 137 3.389 -0.494 -5.684 1.00 0.00 H new ATOM 0 HD12 LEU A 137 4.914 -0.588 -6.596 1.00 0.00 H new ATOM 0 HD13 LEU A 137 3.730 -1.912 -6.703 1.00 0.00 H new ATOM 0 HD21 LEU A 137 2.977 -1.909 -3.765 1.00 0.00 H new ATOM 0 HD22 LEU A 137 3.349 -3.406 -4.653 1.00 0.00 H new ATOM 0 HD23 LEU A 137 4.219 -3.024 -3.148 1.00 0.00 H new ATOM 1903 N SER A 138 9.201 -2.167 -4.595 1.00 0.00 N ATOM 1904 CA SER A 138 10.447 -2.534 -3.981 1.00 0.00 C ATOM 1905 C SER A 138 10.533 -1.621 -2.752 1.00 0.00 C ATOM 1906 O SER A 138 9.650 -0.788 -2.521 1.00 0.00 O ATOM 1907 CB SER A 138 11.617 -2.335 -4.945 1.00 0.00 C ATOM 1908 OG SER A 138 11.557 -3.310 -5.968 1.00 0.00 O ATOM 0 H SER A 138 8.885 -1.263 -4.244 1.00 0.00 H new ATOM 0 HA SER A 138 10.496 -3.588 -3.706 1.00 0.00 H new ATOM 0 HB2 SER A 138 11.579 -1.335 -5.378 1.00 0.00 H new ATOM 0 HB3 SER A 138 12.562 -2.414 -4.408 1.00 0.00 H new ATOM 0 HG SER A 138 10.639 -3.644 -6.048 1.00 0.00 H new ATOM 1914 N ALA A 139 11.625 -1.722 -2.012 1.00 0.00 N ATOM 1915 CA ALA A 139 11.931 -0.969 -0.787 1.00 0.00 C ATOM 1916 C ALA A 139 11.912 0.564 -0.930 1.00 0.00 C ATOM 1917 O ALA A 139 12.115 1.281 0.053 1.00 0.00 O ATOM 1918 CB ALA A 139 13.286 -1.428 -0.259 1.00 0.00 C ATOM 0 H ALA A 139 12.373 -2.370 -2.258 1.00 0.00 H new ATOM 0 HA ALA A 139 11.125 -1.189 -0.087 1.00 0.00 H new ATOM 0 HB1 ALA A 139 13.527 -0.878 0.651 1.00 0.00 H new ATOM 0 HB2 ALA A 139 13.248 -2.495 -0.039 1.00 0.00 H new ATOM 0 HB3 ALA A 139 14.052 -1.240 -1.011 1.00 0.00 H new ATOM 1924 N ALA A 140 11.794 1.079 -2.154 1.00 0.00 N ATOM 1925 CA ALA A 140 11.716 2.496 -2.433 1.00 0.00 C ATOM 1926 C ALA A 140 10.252 2.894 -2.235 1.00 0.00 C ATOM 1927 O ALA A 140 9.937 3.744 -1.410 1.00 0.00 O ATOM 1928 CB ALA A 140 12.212 2.782 -3.853 1.00 0.00 C ATOM 0 H ALA A 140 11.750 0.501 -2.993 1.00 0.00 H new ATOM 0 HA ALA A 140 12.352 3.081 -1.768 1.00 0.00 H new ATOM 0 HB1 ALA A 140 12.149 3.852 -4.052 1.00 0.00 H new ATOM 0 HB2 ALA A 140 13.248 2.456 -3.949 1.00 0.00 H new ATOM 0 HB3 ALA A 140 11.593 2.242 -4.570 1.00 0.00 H new ATOM 1934 N ASN A 141 9.362 2.255 -2.998 1.00 0.00 N ATOM 1935 CA ASN A 141 7.925 2.491 -2.949 1.00 0.00 C ATOM 1936 C ASN A 141 7.365 1.986 -1.626 1.00 0.00 C ATOM 1937 O ASN A 141 6.698 2.677 -0.864 1.00 0.00 O ATOM 1938 CB ASN A 141 7.263 1.819 -4.171 1.00 0.00 C ATOM 1939 CG ASN A 141 5.755 1.990 -4.226 1.00 0.00 C ATOM 1940 OD1 ASN A 141 5.217 2.612 -5.122 1.00 0.00 O ATOM 1941 ND2 ASN A 141 5.012 1.389 -3.320 1.00 0.00 N ATOM 0 H ASN A 141 9.630 1.545 -3.680 1.00 0.00 H new ATOM 0 HA ASN A 141 7.707 3.558 -2.999 1.00 0.00 H new ATOM 0 HB2 ASN A 141 7.699 2.232 -5.081 1.00 0.00 H new ATOM 0 HB3 ASN A 141 7.498 0.755 -4.160 1.00 0.00 H new ATOM 0 HD21 ASN A 141 3.995 1.448 -3.374 1.00 0.00 H new ATOM 0 HD22 ASN A 141 5.453 0.865 -2.565 1.00 0.00 H new ATOM 1948 N VAL A 142 7.522 0.697 -1.413 1.00 0.00 N ATOM 1949 CA VAL A 142 7.053 0.020 -0.217 1.00 0.00 C ATOM 1950 C VAL A 142 7.953 0.429 0.945 1.00 0.00 C ATOM 1951 O VAL A 142 9.142 0.699 0.771 1.00 0.00 O ATOM 1952 CB VAL A 142 7.077 -1.515 -0.417 1.00 0.00 C ATOM 1953 CG1 VAL A 142 6.336 -2.253 0.710 1.00 0.00 C ATOM 1954 CG2 VAL A 142 6.422 -1.936 -1.742 1.00 0.00 C ATOM 0 H VAL A 142 7.987 0.077 -2.076 1.00 0.00 H new ATOM 0 HA VAL A 142 6.023 0.305 -0.005 1.00 0.00 H new ATOM 0 HB VAL A 142 8.133 -1.787 -0.417 1.00 0.00 H new ATOM 0 HG11 VAL A 142 6.377 -3.327 0.530 1.00 0.00 H new ATOM 0 HG12 VAL A 142 6.809 -2.027 1.666 1.00 0.00 H new ATOM 0 HG13 VAL A 142 5.296 -1.929 0.734 1.00 0.00 H new ATOM 0 HG21 VAL A 142 6.462 -3.021 -1.839 1.00 0.00 H new ATOM 0 HG22 VAL A 142 5.382 -1.609 -1.754 1.00 0.00 H new ATOM 0 HG23 VAL A 142 6.956 -1.477 -2.574 1.00 0.00 H new ATOM 1964 N VAL A 143 7.374 0.470 2.140 1.00 0.00 N ATOM 1965 CA VAL A 143 8.079 0.806 3.357 1.00 0.00 C ATOM 1966 C VAL A 143 9.187 -0.236 3.562 1.00 0.00 C ATOM 1967 O VAL A 143 9.047 -1.400 3.168 1.00 0.00 O ATOM 1968 CB VAL A 143 7.038 0.851 4.497 1.00 0.00 C ATOM 1969 CG1 VAL A 143 6.362 -0.511 4.753 1.00 0.00 C ATOM 1970 CG2 VAL A 143 7.590 1.398 5.813 1.00 0.00 C ATOM 0 H VAL A 143 6.385 0.266 2.285 1.00 0.00 H new ATOM 0 HA VAL A 143 8.565 1.781 3.324 1.00 0.00 H new ATOM 0 HB VAL A 143 6.285 1.550 4.133 1.00 0.00 H new ATOM 0 HG11 VAL A 143 5.642 -0.413 5.565 1.00 0.00 H new ATOM 0 HG12 VAL A 143 5.848 -0.837 3.849 1.00 0.00 H new ATOM 0 HG13 VAL A 143 7.118 -1.247 5.026 1.00 0.00 H new ATOM 0 HG21 VAL A 143 6.802 1.399 6.566 1.00 0.00 H new ATOM 0 HG22 VAL A 143 8.414 0.769 6.151 1.00 0.00 H new ATOM 0 HG23 VAL A 143 7.949 2.416 5.662 1.00 0.00 H new ATOM 1980 N PHE A 144 10.278 0.151 4.225 1.00 0.00 N ATOM 1981 CA PHE A 144 11.388 -0.757 4.514 1.00 0.00 C ATOM 1982 C PHE A 144 10.898 -1.953 5.342 1.00 0.00 C ATOM 1983 O PHE A 144 11.442 -3.053 5.234 1.00 0.00 O ATOM 1984 CB PHE A 144 12.487 0.004 5.268 1.00 0.00 C ATOM 1985 CG PHE A 144 13.743 0.221 4.450 1.00 0.00 C ATOM 1986 CD1 PHE A 144 13.658 0.862 3.198 1.00 0.00 C ATOM 1987 CD2 PHE A 144 14.988 -0.251 4.908 1.00 0.00 C ATOM 1988 CE1 PHE A 144 14.802 1.003 2.396 1.00 0.00 C ATOM 1989 CE2 PHE A 144 16.130 -0.106 4.104 1.00 0.00 C ATOM 1990 CZ PHE A 144 16.034 0.506 2.846 1.00 0.00 C ATOM 0 H PHE A 144 10.416 1.099 4.575 1.00 0.00 H new ATOM 0 HA PHE A 144 11.795 -1.136 3.577 1.00 0.00 H new ATOM 0 HB2 PHE A 144 12.097 0.972 5.583 1.00 0.00 H new ATOM 0 HB3 PHE A 144 12.743 -0.547 6.173 1.00 0.00 H new ATOM 0 HD1 PHE A 144 12.709 1.246 2.854 1.00 0.00 H new ATOM 0 HD2 PHE A 144 15.064 -0.724 5.876 1.00 0.00 H new ATOM 0 HE1 PHE A 144 14.733 1.493 1.436 1.00 0.00 H new ATOM 0 HE2 PHE A 144 17.085 -0.467 4.456 1.00 0.00 H new ATOM 0 HZ PHE A 144 16.911 0.595 2.222 1.00 0.00 H new