USER MOD reduce.3.24.130724 H: found=0, std=0, add=1220, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1218 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 90 ASN : amide:sc= -3! C(o=-3!,f=-2.8!) USER MOD Set 1.2: A 167 MET CE :methyl -179:sc= 0 (180deg=-0.00111) USER MOD Set 2.1: A 151 GLN : amide:sc= 0 X(o=0.45,f=0.18) USER MOD Set 2.2: A 153 ASN : amide:sc= 0.451 K(o=0.45,f=-4.5!) USER MOD Set 3.1: A 110 MET CE :methyl -126:sc= -1.11 (180deg=-6.8!) USER MOD Set 3.2: A 111 CYS SG : rot 177:sc= -4.77! USER MOD Set 4.1: A 102 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 103 ASN : amide:sc= -0.475 X(o=-0.48,f=-0.67) USER MOD Set 5.1: A 28 TYR OH : rot 117:sc= 0.0147 USER MOD Set 5.2: A 61 TYR OH : rot 41:sc= 0.0112 USER MOD Set 5.3: A 63 HIS :FLIP no HD1:sc= -0.644 F(o=-1.5,f=-0.58) USER MOD Set 5.4: A 74 CYS SG : rot 76:sc= 0.0433 USER MOD Single : A 19 GLN : amide:sc= -0.829 K(o=-0.83,f=-2!) USER MOD Single : A 21 THR OG1 : rot -13:sc= 0.458 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 31 CYS SG : rot 180:sc= 0 USER MOD Single : A 32 HIS : no HE2:sc= -0.183 K(o=-0.18,f=-6.1!) USER MOD Single : A 39 SER OG : rot 180:sc= 0.156 USER MOD Single : A 45 GLN : amide:sc= -0.872 K(o=-0.87,f=-2.7!) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 165:sc=-0.00597 (180deg=-0.317) USER MOD Single : A 56 LYS NZ :NH3+ -121:sc= 0.453 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -2.54! C(o=-2.5!,f=-3.2!) USER MOD Single : A 67 SER OG : rot -145:sc= 1.11 USER MOD Single : A 70 THR OG1 : rot -152:sc= 1.17 USER MOD Single : A 71 ASN : amide:sc= -2.9! C(o=-2.9!,f=-4.5!) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= -0.679 K(o=-0.68,f=-2.8!) USER MOD Single : A 77 MET CE :methyl -163:sc= -0.022 (180deg=-0.358) USER MOD Single : A 79 CYS SG : rot 180:sc= -1.64! USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot -101:sc= 0.775 USER MOD Single : A 86 TYR OH : rot 85:sc=-0.00315 USER MOD Single : A 88 SER OG : rot -170:sc= 0 USER MOD Single : A 89 GLN :FLIP amide:sc= 0 F(o=-0.76,f=0) USER MOD Single : A 93 THR OG1 : rot 150:sc= 0 USER MOD Single : A 99 THR OG1 : rot 169:sc= 1.34 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 THR OG1 : rot 71:sc= 0.624 USER MOD Single : A 112 ASN : amide:sc= -2.05 K(o=-2,f=-4.8!) USER MOD Single : A 114 HIS : no HE2:sc= -0.501 X(o=-0.5,f=-0.12) USER MOD Single : A 117 SER OG : rot 180:sc= -0.0228 USER MOD Single : A 121 GLN :FLIP amide:sc= 0.0888 F(o=-1.9,f=0.089) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot -10:sc= 1.06 USER MOD Single : A 126 GLN : amide:sc= -0.0202 K(o=-0.02,f=-1.8) USER MOD Single : A 127 LYS NZ :NH3+ -112:sc= -1.78! (180deg=-4.46!) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc= -0.147 X(o=-0.15,f=-0.15) USER MOD Single : A 138 MET CE :methyl -122:sc= 0 (180deg=-0.0111) USER MOD Single : A 144 ASN : amide:sc= -0.49 X(o=-0.49,f=-0.88!) USER MOD Single : A 148 ASN : amide:sc= -0.078 X(o=-0.078,f=-0.078) USER MOD Single : A 154 THR OG1 : rot 160:sc= -0.93 USER MOD Single : A 155 THR OG1 : rot 180:sc= -0.846 USER MOD Single : A 160 MET CE :methyl -168:sc= -0.634 (180deg=-0.887) USER MOD Single : A 161 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 164 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 171 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 69 N GLU A 13 1.389 -12.436 5.646 1.00 0.00 N ATOM 70 CA GLU A 13 2.427 -11.578 5.085 1.00 0.00 C ATOM 71 C GLU A 13 3.110 -10.763 6.179 1.00 0.00 C ATOM 72 O GLU A 13 4.333 -10.635 6.201 1.00 0.00 O ATOM 73 CB GLU A 13 1.831 -10.641 4.032 1.00 0.00 C ATOM 74 CG GLU A 13 1.827 -11.226 2.630 1.00 0.00 C ATOM 75 CD GLU A 13 1.552 -10.183 1.564 1.00 0.00 C ATOM 76 OE1 GLU A 13 2.497 -9.457 1.187 1.00 0.00 O ATOM 77 OE2 GLU A 13 0.394 -10.091 1.107 1.00 0.00 O ATOM 0 HA GLU A 13 3.174 -12.216 4.612 1.00 0.00 H new ATOM 0 HB2 GLU A 13 0.808 -10.393 4.316 1.00 0.00 H new ATOM 0 HB3 GLU A 13 2.396 -9.709 4.026 1.00 0.00 H new ATOM 0 HG2 GLU A 13 2.791 -11.696 2.433 1.00 0.00 H new ATOM 0 HG3 GLU A 13 1.072 -12.010 2.569 1.00 0.00 H new ATOM 84 N GLY A 14 2.309 -10.213 7.087 1.00 0.00 N ATOM 85 CA GLY A 14 2.853 -9.416 8.171 1.00 0.00 C ATOM 86 C GLY A 14 4.135 -9.999 8.732 1.00 0.00 C ATOM 87 O GLY A 14 5.216 -9.445 8.531 1.00 0.00 O ATOM 0 H GLY A 14 1.293 -10.305 7.091 1.00 0.00 H new ATOM 0 HA2 GLY A 14 3.043 -8.404 7.814 1.00 0.00 H new ATOM 0 HA3 GLY A 14 2.113 -9.339 8.968 1.00 0.00 H new ATOM 91 N ASP A 15 4.015 -11.118 9.438 1.00 0.00 N ATOM 92 CA ASP A 15 5.173 -11.776 10.031 1.00 0.00 C ATOM 93 C ASP A 15 6.396 -11.638 9.130 1.00 0.00 C ATOM 94 O ASP A 15 7.458 -11.200 9.571 1.00 0.00 O ATOM 95 CB ASP A 15 4.873 -13.254 10.282 1.00 0.00 C ATOM 96 CG ASP A 15 3.441 -13.488 10.722 1.00 0.00 C ATOM 97 OD1 ASP A 15 2.977 -12.774 11.636 1.00 0.00 O ATOM 98 OD2 ASP A 15 2.784 -14.383 10.152 1.00 0.00 O ATOM 0 H ASP A 15 3.127 -11.588 9.614 1.00 0.00 H new ATOM 0 HA ASP A 15 5.389 -11.291 10.983 1.00 0.00 H new ATOM 0 HB2 ASP A 15 5.067 -13.821 9.371 1.00 0.00 H new ATOM 0 HB3 ASP A 15 5.551 -13.635 11.045 1.00 0.00 H new ATOM 103 N ALA A 16 6.239 -12.017 7.865 1.00 0.00 N ATOM 104 CA ALA A 16 7.330 -11.935 6.902 1.00 0.00 C ATOM 105 C ALA A 16 7.921 -10.530 6.860 1.00 0.00 C ATOM 106 O ALA A 16 9.120 -10.343 7.074 1.00 0.00 O ATOM 107 CB ALA A 16 6.846 -12.348 5.520 1.00 0.00 C ATOM 0 H ALA A 16 5.367 -12.384 7.484 1.00 0.00 H new ATOM 0 HA ALA A 16 8.115 -12.621 7.220 1.00 0.00 H new ATOM 0 HB1 ALA A 16 7.671 -12.282 4.811 1.00 0.00 H new ATOM 0 HB2 ALA A 16 6.478 -13.374 5.555 1.00 0.00 H new ATOM 0 HB3 ALA A 16 6.041 -11.685 5.203 1.00 0.00 H new ATOM 113 N LEU A 17 7.074 -9.545 6.583 1.00 0.00 N ATOM 114 CA LEU A 17 7.513 -8.156 6.512 1.00 0.00 C ATOM 115 C LEU A 17 8.208 -7.738 7.804 1.00 0.00 C ATOM 116 O LEU A 17 9.246 -7.075 7.777 1.00 0.00 O ATOM 117 CB LEU A 17 6.320 -7.237 6.240 1.00 0.00 C ATOM 118 CG LEU A 17 5.800 -7.220 4.803 1.00 0.00 C ATOM 119 CD1 LEU A 17 4.631 -6.257 4.669 1.00 0.00 C ATOM 120 CD2 LEU A 17 6.914 -6.847 3.836 1.00 0.00 C ATOM 0 H LEU A 17 6.079 -9.682 6.404 1.00 0.00 H new ATOM 0 HA LEU A 17 8.226 -8.067 5.693 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.502 -7.532 6.898 1.00 0.00 H new ATOM 0 HB3 LEU A 17 6.600 -6.220 6.516 1.00 0.00 H new ATOM 0 HG LEU A 17 5.450 -8.221 4.553 1.00 0.00 H new ATOM 0 HD11 LEU A 17 4.274 -6.259 3.639 1.00 0.00 H new ATOM 0 HD12 LEU A 17 3.825 -6.569 5.333 1.00 0.00 H new ATOM 0 HD13 LEU A 17 4.955 -5.252 4.939 1.00 0.00 H new ATOM 0 HD21 LEU A 17 6.525 -6.840 2.818 1.00 0.00 H new ATOM 0 HD22 LEU A 17 7.296 -5.857 4.085 1.00 0.00 H new ATOM 0 HD23 LEU A 17 7.720 -7.576 3.911 1.00 0.00 H new ATOM 132 N LEU A 18 7.630 -8.130 8.934 1.00 0.00 N ATOM 133 CA LEU A 18 8.195 -7.798 10.237 1.00 0.00 C ATOM 134 C LEU A 18 9.680 -8.143 10.291 1.00 0.00 C ATOM 135 O LEU A 18 10.491 -7.358 10.781 1.00 0.00 O ATOM 136 CB LEU A 18 7.446 -8.543 11.344 1.00 0.00 C ATOM 137 CG LEU A 18 6.173 -7.873 11.862 1.00 0.00 C ATOM 138 CD1 LEU A 18 5.396 -8.823 12.759 1.00 0.00 C ATOM 139 CD2 LEU A 18 6.511 -6.590 12.607 1.00 0.00 C ATOM 0 H LEU A 18 6.771 -8.678 8.974 1.00 0.00 H new ATOM 0 HA LEU A 18 8.085 -6.725 10.391 1.00 0.00 H new ATOM 0 HB2 LEU A 18 7.186 -9.535 10.975 1.00 0.00 H new ATOM 0 HB3 LEU A 18 8.126 -8.684 12.184 1.00 0.00 H new ATOM 0 HG LEU A 18 5.546 -7.619 11.007 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.493 -8.328 13.118 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.121 -9.714 12.194 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.015 -9.109 13.609 1.00 0.00 H new ATOM 0 HD21 LEU A 18 5.593 -6.127 12.969 1.00 0.00 H new ATOM 0 HD22 LEU A 18 7.159 -6.820 13.453 1.00 0.00 H new ATOM 0 HD23 LEU A 18 7.024 -5.903 11.934 1.00 0.00 H new ATOM 151 N GLN A 19 10.027 -9.321 9.782 1.00 0.00 N ATOM 152 CA GLN A 19 11.415 -9.768 9.771 1.00 0.00 C ATOM 153 C GLN A 19 12.283 -8.830 8.939 1.00 0.00 C ATOM 154 O GLN A 19 13.352 -8.404 9.378 1.00 0.00 O ATOM 155 CB GLN A 19 11.510 -11.192 9.221 1.00 0.00 C ATOM 156 CG GLN A 19 11.228 -12.266 10.259 1.00 0.00 C ATOM 157 CD GLN A 19 12.214 -12.238 11.410 1.00 0.00 C ATOM 158 OE1 GLN A 19 12.121 -11.394 12.302 1.00 0.00 O ATOM 159 NE2 GLN A 19 13.167 -13.163 11.397 1.00 0.00 N ATOM 0 H GLN A 19 9.367 -9.982 9.372 1.00 0.00 H new ATOM 0 HA GLN A 19 11.782 -9.757 10.797 1.00 0.00 H new ATOM 0 HB2 GLN A 19 10.806 -11.302 8.396 1.00 0.00 H new ATOM 0 HB3 GLN A 19 12.508 -11.348 8.811 1.00 0.00 H new ATOM 0 HG2 GLN A 19 10.218 -12.134 10.647 1.00 0.00 H new ATOM 0 HG3 GLN A 19 11.261 -13.245 9.781 1.00 0.00 H new ATOM 0 HE21 GLN A 19 13.207 -13.843 10.638 1.00 0.00 H new ATOM 0 HE22 GLN A 19 13.859 -13.193 12.146 1.00 0.00 H new ATOM 168 N PHE A 20 11.817 -8.512 7.736 1.00 0.00 N ATOM 169 CA PHE A 20 12.551 -7.625 6.842 1.00 0.00 C ATOM 170 C PHE A 20 12.721 -6.243 7.465 1.00 0.00 C ATOM 171 O PHE A 20 13.805 -5.660 7.426 1.00 0.00 O ATOM 172 CB PHE A 20 11.827 -7.506 5.499 1.00 0.00 C ATOM 173 CG PHE A 20 12.274 -6.329 4.680 1.00 0.00 C ATOM 174 CD1 PHE A 20 13.355 -6.437 3.820 1.00 0.00 C ATOM 175 CD2 PHE A 20 11.612 -5.115 4.769 1.00 0.00 C ATOM 176 CE1 PHE A 20 13.768 -5.356 3.064 1.00 0.00 C ATOM 177 CE2 PHE A 20 12.020 -4.031 4.015 1.00 0.00 C ATOM 178 CZ PHE A 20 13.101 -4.151 3.163 1.00 0.00 C ATOM 0 H PHE A 20 10.934 -8.856 7.358 1.00 0.00 H new ATOM 0 HA PHE A 20 13.540 -8.054 6.677 1.00 0.00 H new ATOM 0 HB2 PHE A 20 11.988 -8.419 4.926 1.00 0.00 H new ATOM 0 HB3 PHE A 20 10.755 -7.427 5.679 1.00 0.00 H new ATOM 0 HD1 PHE A 20 13.881 -7.377 3.739 1.00 0.00 H new ATOM 0 HD2 PHE A 20 10.768 -5.015 5.435 1.00 0.00 H new ATOM 0 HE1 PHE A 20 14.611 -5.454 2.397 1.00 0.00 H new ATOM 0 HE2 PHE A 20 11.494 -3.091 4.092 1.00 0.00 H new ATOM 0 HZ PHE A 20 13.424 -3.304 2.576 1.00 0.00 H new ATOM 188 N THR A 21 11.641 -5.723 8.040 1.00 0.00 N ATOM 189 CA THR A 21 11.669 -4.409 8.671 1.00 0.00 C ATOM 190 C THR A 21 12.619 -4.391 9.862 1.00 0.00 C ATOM 191 O THR A 21 13.371 -3.436 10.053 1.00 0.00 O ATOM 192 CB THR A 21 10.265 -3.983 9.141 1.00 0.00 C ATOM 193 OG1 THR A 21 9.709 -4.987 9.997 1.00 0.00 O ATOM 194 CG2 THR A 21 9.342 -3.754 7.954 1.00 0.00 C ATOM 0 H THR A 21 10.736 -6.192 8.082 1.00 0.00 H new ATOM 0 HA THR A 21 12.022 -3.704 7.919 1.00 0.00 H new ATOM 0 HB THR A 21 10.360 -3.048 9.692 1.00 0.00 H new ATOM 0 HG1 THR A 21 10.241 -5.807 9.928 1.00 0.00 H new ATOM 0 HG21 THR A 21 8.357 -3.454 8.312 1.00 0.00 H new ATOM 0 HG22 THR A 21 9.753 -2.968 7.320 1.00 0.00 H new ATOM 0 HG23 THR A 21 9.254 -4.675 7.378 1.00 0.00 H new ATOM 202 N ALA A 22 12.580 -5.452 10.661 1.00 0.00 N ATOM 203 CA ALA A 22 13.440 -5.559 11.833 1.00 0.00 C ATOM 204 C ALA A 22 14.909 -5.641 11.430 1.00 0.00 C ATOM 205 O ALA A 22 15.741 -4.884 11.928 1.00 0.00 O ATOM 206 CB ALA A 22 13.051 -6.772 12.665 1.00 0.00 C ATOM 0 H ALA A 22 11.961 -6.250 10.518 1.00 0.00 H new ATOM 0 HA ALA A 22 13.304 -4.661 12.435 1.00 0.00 H new ATOM 0 HB1 ALA A 22 13.702 -6.839 13.537 1.00 0.00 H new ATOM 0 HB2 ALA A 22 12.016 -6.672 12.992 1.00 0.00 H new ATOM 0 HB3 ALA A 22 13.156 -7.675 12.063 1.00 0.00 H new ATOM 212 N GLU A 23 15.219 -6.565 10.526 1.00 0.00 N ATOM 213 CA GLU A 23 16.588 -6.746 10.058 1.00 0.00 C ATOM 214 C GLU A 23 17.079 -5.505 9.317 1.00 0.00 C ATOM 215 O GLU A 23 18.182 -5.017 9.563 1.00 0.00 O ATOM 216 CB GLU A 23 16.681 -7.969 9.144 1.00 0.00 C ATOM 217 CG GLU A 23 16.842 -9.280 9.895 1.00 0.00 C ATOM 218 CD GLU A 23 18.100 -9.317 10.741 1.00 0.00 C ATOM 219 OE1 GLU A 23 19.179 -8.969 10.216 1.00 0.00 O ATOM 220 OE2 GLU A 23 18.006 -9.694 11.927 1.00 0.00 O ATOM 0 H GLU A 23 14.541 -7.199 10.103 1.00 0.00 H new ATOM 0 HA GLU A 23 17.224 -6.903 10.929 1.00 0.00 H new ATOM 0 HB2 GLU A 23 15.783 -8.021 8.528 1.00 0.00 H new ATOM 0 HB3 GLU A 23 17.525 -7.842 8.466 1.00 0.00 H new ATOM 0 HG2 GLU A 23 15.974 -9.437 10.535 1.00 0.00 H new ATOM 0 HG3 GLU A 23 16.865 -10.103 9.181 1.00 0.00 H new ATOM 227 N PHE A 24 16.251 -5.000 8.408 1.00 0.00 N ATOM 228 CA PHE A 24 16.600 -3.817 7.630 1.00 0.00 C ATOM 229 C PHE A 24 16.903 -2.634 8.544 1.00 0.00 C ATOM 230 O PHE A 24 17.896 -1.930 8.358 1.00 0.00 O ATOM 231 CB PHE A 24 15.462 -3.457 6.672 1.00 0.00 C ATOM 232 CG PHE A 24 15.526 -2.043 6.171 1.00 0.00 C ATOM 233 CD1 PHE A 24 15.080 -0.994 6.958 1.00 0.00 C ATOM 234 CD2 PHE A 24 16.031 -1.763 4.911 1.00 0.00 C ATOM 235 CE1 PHE A 24 15.137 0.309 6.500 1.00 0.00 C ATOM 236 CE2 PHE A 24 16.091 -0.462 4.448 1.00 0.00 C ATOM 237 CZ PHE A 24 15.643 0.575 5.242 1.00 0.00 C ATOM 0 H PHE A 24 15.334 -5.391 8.192 1.00 0.00 H new ATOM 0 HA PHE A 24 17.495 -4.045 7.051 1.00 0.00 H new ATOM 0 HB2 PHE A 24 15.485 -4.137 5.821 1.00 0.00 H new ATOM 0 HB3 PHE A 24 14.509 -3.612 7.178 1.00 0.00 H new ATOM 0 HD1 PHE A 24 14.683 -1.197 7.942 1.00 0.00 H new ATOM 0 HD2 PHE A 24 16.381 -2.570 4.284 1.00 0.00 H new ATOM 0 HE1 PHE A 24 14.787 1.118 7.124 1.00 0.00 H new ATOM 0 HE2 PHE A 24 16.488 -0.257 3.465 1.00 0.00 H new ATOM 0 HZ PHE A 24 15.688 1.592 4.881 1.00 0.00 H new ATOM 247 N SER A 25 16.041 -2.422 9.533 1.00 0.00 N ATOM 248 CA SER A 25 16.213 -1.322 10.475 1.00 0.00 C ATOM 249 C SER A 25 17.668 -1.210 10.919 1.00 0.00 C ATOM 250 O SER A 25 18.298 -0.164 10.762 1.00 0.00 O ATOM 251 CB SER A 25 15.310 -1.519 11.693 1.00 0.00 C ATOM 252 OG SER A 25 15.310 -0.369 12.521 1.00 0.00 O ATOM 0 H SER A 25 15.216 -2.998 9.703 1.00 0.00 H new ATOM 0 HA SER A 25 15.933 -0.397 9.970 1.00 0.00 H new ATOM 0 HB2 SER A 25 14.293 -1.734 11.364 1.00 0.00 H new ATOM 0 HB3 SER A 25 15.649 -2.382 12.265 1.00 0.00 H new ATOM 0 HG SER A 25 14.724 -0.521 13.291 1.00 0.00 H new ATOM 258 N SER A 26 18.196 -2.296 11.474 1.00 0.00 N ATOM 259 CA SER A 26 19.576 -2.320 11.945 1.00 0.00 C ATOM 260 C SER A 26 20.551 -2.330 10.771 1.00 0.00 C ATOM 261 O SER A 26 21.494 -1.541 10.727 1.00 0.00 O ATOM 262 CB SER A 26 19.814 -3.545 12.830 1.00 0.00 C ATOM 263 OG SER A 26 18.833 -3.636 13.849 1.00 0.00 O ATOM 0 H SER A 26 17.689 -3.171 11.609 1.00 0.00 H new ATOM 0 HA SER A 26 19.749 -1.418 12.531 1.00 0.00 H new ATOM 0 HB2 SER A 26 19.794 -4.448 12.220 1.00 0.00 H new ATOM 0 HB3 SER A 26 20.805 -3.486 13.279 1.00 0.00 H new ATOM 0 HG SER A 26 19.006 -4.428 14.400 1.00 0.00 H new ATOM 269 N ARG A 27 20.315 -3.230 9.822 1.00 0.00 N ATOM 270 CA ARG A 27 21.171 -3.345 8.648 1.00 0.00 C ATOM 271 C ARG A 27 21.537 -1.966 8.105 1.00 0.00 C ATOM 272 O ARG A 27 22.714 -1.622 7.998 1.00 0.00 O ATOM 273 CB ARG A 27 20.475 -4.165 7.560 1.00 0.00 C ATOM 274 CG ARG A 27 20.772 -5.653 7.636 1.00 0.00 C ATOM 275 CD ARG A 27 20.773 -6.292 6.256 1.00 0.00 C ATOM 276 NE ARG A 27 21.005 -7.733 6.321 1.00 0.00 N ATOM 277 CZ ARG A 27 20.036 -8.627 6.482 1.00 0.00 C ATOM 278 NH1 ARG A 27 18.775 -8.230 6.595 1.00 0.00 N ATOM 279 NH2 ARG A 27 20.326 -9.921 6.531 1.00 0.00 N ATOM 0 H ARG A 27 19.538 -3.890 9.843 1.00 0.00 H new ATOM 0 HA ARG A 27 22.087 -3.854 8.946 1.00 0.00 H new ATOM 0 HB2 ARG A 27 19.398 -4.014 7.636 1.00 0.00 H new ATOM 0 HB3 ARG A 27 20.782 -3.791 6.583 1.00 0.00 H new ATOM 0 HG2 ARG A 27 21.741 -5.808 8.111 1.00 0.00 H new ATOM 0 HG3 ARG A 27 20.027 -6.142 8.264 1.00 0.00 H new ATOM 0 HD2 ARG A 27 19.818 -6.100 5.767 1.00 0.00 H new ATOM 0 HD3 ARG A 27 21.545 -5.828 5.642 1.00 0.00 H new ATOM 0 HE ARG A 27 21.964 -8.071 6.238 1.00 0.00 H new ATOM 0 HH11 ARG A 27 18.548 -7.236 6.558 1.00 0.00 H new ATOM 0 HH12 ARG A 27 18.033 -8.919 6.719 1.00 0.00 H new ATOM 0 HH21 ARG A 27 21.294 -10.230 6.445 1.00 0.00 H new ATOM 0 HH22 ARG A 27 19.581 -10.606 6.655 1.00 0.00 H new ATOM 293 N TYR A 28 20.521 -1.182 7.763 1.00 0.00 N ATOM 294 CA TYR A 28 20.735 0.157 7.229 1.00 0.00 C ATOM 295 C TYR A 28 20.723 1.198 8.345 1.00 0.00 C ATOM 296 O TYR A 28 21.738 1.833 8.628 1.00 0.00 O ATOM 297 CB TYR A 28 19.661 0.493 6.192 1.00 0.00 C ATOM 298 CG TYR A 28 19.586 -0.500 5.055 1.00 0.00 C ATOM 299 CD1 TYR A 28 18.973 -1.736 5.225 1.00 0.00 C ATOM 300 CD2 TYR A 28 20.128 -0.205 3.810 1.00 0.00 C ATOM 301 CE1 TYR A 28 18.903 -2.647 4.190 1.00 0.00 C ATOM 302 CE2 TYR A 28 20.061 -1.109 2.769 1.00 0.00 C ATOM 303 CZ TYR A 28 19.447 -2.329 2.963 1.00 0.00 C ATOM 304 OH TYR A 28 19.380 -3.233 1.928 1.00 0.00 O ATOM 0 H TYR A 28 19.541 -1.451 7.846 1.00 0.00 H new ATOM 0 HA TYR A 28 21.714 0.177 6.749 1.00 0.00 H new ATOM 0 HB2 TYR A 28 18.691 0.539 6.687 1.00 0.00 H new ATOM 0 HB3 TYR A 28 19.859 1.485 5.785 1.00 0.00 H new ATOM 0 HD1 TYR A 28 18.544 -1.988 6.184 1.00 0.00 H new ATOM 0 HD2 TYR A 28 20.610 0.749 3.654 1.00 0.00 H new ATOM 0 HE1 TYR A 28 18.425 -3.604 4.340 1.00 0.00 H new ATOM 0 HE2 TYR A 28 20.487 -0.862 1.808 1.00 0.00 H new ATOM 0 HH TYR A 28 18.848 -2.854 1.197 1.00 0.00 H new ATOM 314 N GLY A 29 19.565 1.366 8.976 1.00 0.00 N ATOM 315 CA GLY A 29 19.441 2.329 10.054 1.00 0.00 C ATOM 316 C GLY A 29 18.017 2.458 10.556 1.00 0.00 C ATOM 317 O GLY A 29 17.078 1.997 9.906 1.00 0.00 O ATOM 0 H GLY A 29 18.711 0.852 8.760 1.00 0.00 H new ATOM 0 HA2 GLY A 29 20.088 2.031 10.879 1.00 0.00 H new ATOM 0 HA3 GLY A 29 19.791 3.302 9.710 1.00 0.00 H new ATOM 321 N ASP A 30 17.854 3.085 11.716 1.00 0.00 N ATOM 322 CA ASP A 30 16.533 3.272 12.305 1.00 0.00 C ATOM 323 C ASP A 30 15.673 4.180 11.432 1.00 0.00 C ATOM 324 O ASP A 30 14.463 3.978 11.313 1.00 0.00 O ATOM 325 CB ASP A 30 16.658 3.864 13.710 1.00 0.00 C ATOM 326 CG ASP A 30 15.409 3.647 14.542 1.00 0.00 C ATOM 327 OD1 ASP A 30 14.311 4.005 14.068 1.00 0.00 O ATOM 328 OD2 ASP A 30 15.530 3.119 15.668 1.00 0.00 O ATOM 0 H ASP A 30 18.620 3.472 12.267 1.00 0.00 H new ATOM 0 HA ASP A 30 16.050 2.297 12.371 1.00 0.00 H new ATOM 0 HB2 ASP A 30 17.511 3.413 14.217 1.00 0.00 H new ATOM 0 HB3 ASP A 30 16.860 4.932 13.634 1.00 0.00 H new ATOM 333 N CYS A 31 16.303 5.179 10.825 1.00 0.00 N ATOM 334 CA CYS A 31 15.594 6.119 9.964 1.00 0.00 C ATOM 335 C CYS A 31 15.004 5.407 8.752 1.00 0.00 C ATOM 336 O CYS A 31 15.727 5.012 7.837 1.00 0.00 O ATOM 337 CB CYS A 31 16.536 7.234 9.507 1.00 0.00 C ATOM 338 SG CYS A 31 16.899 8.463 10.784 1.00 0.00 S ATOM 0 H CYS A 31 17.303 5.359 10.913 1.00 0.00 H new ATOM 0 HA CYS A 31 14.778 6.556 10.539 1.00 0.00 H new ATOM 0 HB2 CYS A 31 17.472 6.789 9.170 1.00 0.00 H new ATOM 0 HB3 CYS A 31 16.095 7.738 8.647 1.00 0.00 H new ATOM 0 HG CYS A 31 17.705 9.363 10.304 1.00 0.00 H new ATOM 344 N HIS A 32 13.684 5.245 8.751 1.00 0.00 N ATOM 345 CA HIS A 32 12.996 4.579 7.651 1.00 0.00 C ATOM 346 C HIS A 32 11.488 4.798 7.742 1.00 0.00 C ATOM 347 O HIS A 32 10.935 5.041 8.815 1.00 0.00 O ATOM 348 CB HIS A 32 13.308 3.083 7.658 1.00 0.00 C ATOM 349 CG HIS A 32 12.399 2.286 8.543 1.00 0.00 C ATOM 350 ND1 HIS A 32 11.096 1.985 8.208 1.00 0.00 N ATOM 351 CD2 HIS A 32 12.614 1.725 9.756 1.00 0.00 C ATOM 352 CE1 HIS A 32 10.547 1.275 9.178 1.00 0.00 C ATOM 353 NE2 HIS A 32 11.447 1.103 10.129 1.00 0.00 N ATOM 0 H HIS A 32 13.070 5.566 9.500 1.00 0.00 H new ATOM 0 HA HIS A 32 13.352 5.012 6.716 1.00 0.00 H new ATOM 0 HB2 HIS A 32 13.237 2.701 6.640 1.00 0.00 H new ATOM 0 HB3 HIS A 32 14.338 2.936 7.983 1.00 0.00 H new ATOM 0 HD1 HIS A 32 10.629 2.266 7.346 1.00 0.00 H new ATOM 0 HD2 HIS A 32 13.532 1.760 10.325 1.00 0.00 H new ATOM 0 HE1 HIS A 32 9.535 0.899 9.191 1.00 0.00 H new ATOM 361 N PRO A 33 10.807 4.709 6.590 1.00 0.00 N ATOM 362 CA PRO A 33 9.355 4.894 6.514 1.00 0.00 C ATOM 363 C PRO A 33 8.589 3.749 7.168 1.00 0.00 C ATOM 364 O PRO A 33 8.875 2.577 6.922 1.00 0.00 O ATOM 365 CB PRO A 33 9.080 4.929 5.008 1.00 0.00 C ATOM 366 CG PRO A 33 10.205 4.164 4.400 1.00 0.00 C ATOM 367 CD PRO A 33 11.401 4.422 5.274 1.00 0.00 C ATOM 0 HA PRO A 33 9.031 5.791 7.042 1.00 0.00 H new ATOM 0 HB2 PRO A 33 8.118 4.475 4.770 1.00 0.00 H new ATOM 0 HB3 PRO A 33 9.050 5.953 4.635 1.00 0.00 H new ATOM 0 HG2 PRO A 33 9.975 3.099 4.358 1.00 0.00 H new ATOM 0 HG3 PRO A 33 10.391 4.491 3.377 1.00 0.00 H new ATOM 0 HD2 PRO A 33 12.064 3.558 5.312 1.00 0.00 H new ATOM 0 HD3 PRO A 33 11.992 5.262 4.908 1.00 0.00 H new ATOM 375 N VAL A 34 7.615 4.095 8.003 1.00 0.00 N ATOM 376 CA VAL A 34 6.807 3.096 8.692 1.00 0.00 C ATOM 377 C VAL A 34 6.110 2.173 7.698 1.00 0.00 C ATOM 378 O VAL A 34 5.106 2.544 7.089 1.00 0.00 O ATOM 379 CB VAL A 34 5.747 3.756 9.594 1.00 0.00 C ATOM 380 CG1 VAL A 34 4.879 2.699 10.259 1.00 0.00 C ATOM 381 CG2 VAL A 34 6.412 4.644 10.635 1.00 0.00 C ATOM 0 H VAL A 34 7.366 5.060 8.219 1.00 0.00 H new ATOM 0 HA VAL A 34 7.487 2.511 9.312 1.00 0.00 H new ATOM 0 HB VAL A 34 5.105 4.381 8.973 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.136 3.184 10.892 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.374 2.109 9.494 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.504 2.046 10.868 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.648 5.102 11.264 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.079 4.043 11.254 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.986 5.424 10.135 1.00 0.00 H new ATOM 391 N PHE A 35 6.648 0.969 7.539 1.00 0.00 N ATOM 392 CA PHE A 35 6.078 -0.008 6.619 1.00 0.00 C ATOM 393 C PHE A 35 4.849 -0.677 7.228 1.00 0.00 C ATOM 394 O PHE A 35 4.918 -1.261 8.310 1.00 0.00 O ATOM 395 CB PHE A 35 7.121 -1.067 6.256 1.00 0.00 C ATOM 396 CG PHE A 35 8.330 -0.506 5.563 1.00 0.00 C ATOM 397 CD1 PHE A 35 8.244 -0.042 4.260 1.00 0.00 C ATOM 398 CD2 PHE A 35 9.551 -0.441 6.215 1.00 0.00 C ATOM 399 CE1 PHE A 35 9.355 0.475 3.620 1.00 0.00 C ATOM 400 CE2 PHE A 35 10.665 0.075 5.580 1.00 0.00 C ATOM 401 CZ PHE A 35 10.567 0.535 4.281 1.00 0.00 C ATOM 0 H PHE A 35 7.478 0.646 8.036 1.00 0.00 H new ATOM 0 HA PHE A 35 5.773 0.518 5.714 1.00 0.00 H new ATOM 0 HB2 PHE A 35 7.438 -1.579 7.164 1.00 0.00 H new ATOM 0 HB3 PHE A 35 6.658 -1.816 5.613 1.00 0.00 H new ATOM 0 HD1 PHE A 35 7.299 -0.085 3.739 1.00 0.00 H new ATOM 0 HD2 PHE A 35 9.633 -0.798 7.231 1.00 0.00 H new ATOM 0 HE1 PHE A 35 9.276 0.832 2.604 1.00 0.00 H new ATOM 0 HE2 PHE A 35 11.611 0.119 6.099 1.00 0.00 H new ATOM 0 HZ PHE A 35 11.436 0.940 3.783 1.00 0.00 H new ATOM 411 N PHE A 36 3.725 -0.586 6.526 1.00 0.00 N ATOM 412 CA PHE A 36 2.479 -1.180 6.997 1.00 0.00 C ATOM 413 C PHE A 36 2.608 -2.696 7.108 1.00 0.00 C ATOM 414 O PHE A 36 2.702 -3.397 6.100 1.00 0.00 O ATOM 415 CB PHE A 36 1.330 -0.822 6.053 1.00 0.00 C ATOM 416 CG PHE A 36 0.004 -1.380 6.484 1.00 0.00 C ATOM 417 CD1 PHE A 36 -0.258 -2.737 6.382 1.00 0.00 C ATOM 418 CD2 PHE A 36 -0.981 -0.548 6.992 1.00 0.00 C ATOM 419 CE1 PHE A 36 -1.477 -3.254 6.778 1.00 0.00 C ATOM 420 CE2 PHE A 36 -2.202 -1.059 7.390 1.00 0.00 C ATOM 421 CZ PHE A 36 -2.451 -2.414 7.282 1.00 0.00 C ATOM 0 H PHE A 36 3.651 -0.107 5.629 1.00 0.00 H new ATOM 0 HA PHE A 36 2.265 -0.778 7.987 1.00 0.00 H new ATOM 0 HB2 PHE A 36 1.253 0.263 5.983 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.563 -1.191 5.054 1.00 0.00 H new ATOM 0 HD1 PHE A 36 0.500 -3.398 5.988 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -0.792 0.512 7.078 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -1.668 -4.314 6.694 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -2.961 -0.400 7.785 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.405 -2.815 7.591 1.00 0.00 H new ATOM 431 N ILE A 37 2.611 -3.195 8.340 1.00 0.00 N ATOM 432 CA ILE A 37 2.727 -4.628 8.583 1.00 0.00 C ATOM 433 C ILE A 37 1.446 -5.357 8.194 1.00 0.00 C ATOM 434 O ILE A 37 0.458 -5.333 8.927 1.00 0.00 O ATOM 435 CB ILE A 37 3.045 -4.924 10.060 1.00 0.00 C ATOM 436 CG1 ILE A 37 4.376 -4.283 10.457 1.00 0.00 C ATOM 437 CG2 ILE A 37 3.080 -6.425 10.304 1.00 0.00 C ATOM 438 CD1 ILE A 37 5.550 -4.770 9.636 1.00 0.00 C ATOM 0 H ILE A 37 2.534 -2.629 9.185 1.00 0.00 H new ATOM 0 HA ILE A 37 3.549 -4.988 7.964 1.00 0.00 H new ATOM 0 HB ILE A 37 2.258 -4.493 10.679 1.00 0.00 H new ATOM 0 HG12 ILE A 37 4.294 -3.201 10.353 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.569 -4.488 11.510 1.00 0.00 H new ATOM 0 HG21 ILE A 37 3.306 -6.618 11.353 1.00 0.00 H new ATOM 0 HG22 ILE A 37 2.110 -6.857 10.056 1.00 0.00 H new ATOM 0 HG23 ILE A 37 3.849 -6.878 9.678 1.00 0.00 H new ATOM 0 HD11 ILE A 37 6.460 -4.273 9.972 1.00 0.00 H new ATOM 0 HD12 ILE A 37 5.658 -5.848 9.759 1.00 0.00 H new ATOM 0 HD13 ILE A 37 5.379 -4.540 8.584 1.00 0.00 H new ATOM 450 N GLY A 38 1.470 -6.007 7.034 1.00 0.00 N ATOM 451 CA GLY A 38 0.305 -6.736 6.568 1.00 0.00 C ATOM 452 C GLY A 38 0.451 -7.207 5.135 1.00 0.00 C ATOM 453 O GLY A 38 1.553 -7.223 4.588 1.00 0.00 O ATOM 0 H GLY A 38 2.275 -6.042 6.409 1.00 0.00 H new ATOM 0 HA2 GLY A 38 0.136 -7.597 7.215 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -0.575 -6.099 6.650 1.00 0.00 H new ATOM 457 N SER A 39 -0.665 -7.593 4.524 1.00 0.00 N ATOM 458 CA SER A 39 -0.656 -8.072 3.147 1.00 0.00 C ATOM 459 C SER A 39 -0.936 -6.931 2.173 1.00 0.00 C ATOM 460 O SER A 39 -1.437 -5.876 2.563 1.00 0.00 O ATOM 461 CB SER A 39 -1.694 -9.181 2.963 1.00 0.00 C ATOM 462 OG SER A 39 -3.001 -8.708 3.243 1.00 0.00 O ATOM 0 H SER A 39 -1.587 -7.583 4.961 1.00 0.00 H new ATOM 0 HA SER A 39 0.335 -8.473 2.935 1.00 0.00 H new ATOM 0 HB2 SER A 39 -1.651 -9.557 1.941 1.00 0.00 H new ATOM 0 HB3 SER A 39 -1.458 -10.017 3.621 1.00 0.00 H new ATOM 0 HG SER A 39 -3.646 -9.435 3.117 1.00 0.00 H new ATOM 468 N LEU A 40 -0.608 -7.151 0.905 1.00 0.00 N ATOM 469 CA LEU A 40 -0.823 -6.142 -0.127 1.00 0.00 C ATOM 470 C LEU A 40 -2.254 -5.616 -0.084 1.00 0.00 C ATOM 471 O LEU A 40 -2.488 -4.416 -0.222 1.00 0.00 O ATOM 472 CB LEU A 40 -0.523 -6.725 -1.509 1.00 0.00 C ATOM 473 CG LEU A 40 -1.014 -5.907 -2.704 1.00 0.00 C ATOM 474 CD1 LEU A 40 -0.262 -4.588 -2.793 1.00 0.00 C ATOM 475 CD2 LEU A 40 -0.860 -6.700 -3.993 1.00 0.00 C ATOM 0 H LEU A 40 -0.192 -8.019 0.566 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.144 -5.311 0.065 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.556 -6.853 -1.601 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.968 -7.718 -1.567 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.072 -5.689 -2.560 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.625 -4.019 -3.649 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.425 -4.014 -1.881 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.804 -4.784 -2.913 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.214 -6.102 -4.833 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.190 -6.950 -4.143 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.445 -7.617 -3.928 1.00 0.00 H new ATOM 487 N GLU A 41 -3.207 -6.522 0.111 1.00 0.00 N ATOM 488 CA GLU A 41 -4.615 -6.148 0.173 1.00 0.00 C ATOM 489 C GLU A 41 -4.924 -5.408 1.471 1.00 0.00 C ATOM 490 O GLU A 41 -5.545 -4.345 1.459 1.00 0.00 O ATOM 491 CB GLU A 41 -5.501 -7.391 0.059 1.00 0.00 C ATOM 492 CG GLU A 41 -6.921 -7.173 0.554 1.00 0.00 C ATOM 493 CD GLU A 41 -7.704 -6.215 -0.322 1.00 0.00 C ATOM 494 OE1 GLU A 41 -7.574 -4.989 -0.124 1.00 0.00 O ATOM 495 OE2 GLU A 41 -8.447 -6.691 -1.206 1.00 0.00 O ATOM 0 H GLU A 41 -3.030 -7.520 0.229 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.825 -5.482 -0.664 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -5.533 -7.710 -0.983 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -5.048 -8.203 0.627 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -7.440 -8.131 0.592 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -6.891 -6.786 1.573 1.00 0.00 H new ATOM 502 N ALA A 42 -4.486 -5.978 2.589 1.00 0.00 N ATOM 503 CA ALA A 42 -4.714 -5.372 3.895 1.00 0.00 C ATOM 504 C ALA A 42 -4.360 -3.889 3.882 1.00 0.00 C ATOM 505 O ALA A 42 -5.139 -3.051 4.336 1.00 0.00 O ATOM 506 CB ALA A 42 -3.909 -6.099 4.962 1.00 0.00 C ATOM 0 H ALA A 42 -3.971 -6.858 2.616 1.00 0.00 H new ATOM 0 HA ALA A 42 -5.774 -5.463 4.130 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -4.089 -5.636 5.932 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -4.213 -7.145 4.997 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -2.848 -6.038 4.722 1.00 0.00 H new ATOM 512 N ALA A 43 -3.181 -3.571 3.359 1.00 0.00 N ATOM 513 CA ALA A 43 -2.724 -2.189 3.285 1.00 0.00 C ATOM 514 C ALA A 43 -3.715 -1.324 2.513 1.00 0.00 C ATOM 515 O ALA A 43 -4.105 -0.250 2.971 1.00 0.00 O ATOM 516 CB ALA A 43 -1.348 -2.121 2.641 1.00 0.00 C ATOM 0 H ALA A 43 -2.524 -4.253 2.980 1.00 0.00 H new ATOM 0 HA ALA A 43 -2.656 -1.800 4.301 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -1.020 -1.083 2.593 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -0.639 -2.698 3.235 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -1.397 -2.533 1.633 1.00 0.00 H new ATOM 522 N PHE A 44 -4.118 -1.799 1.339 1.00 0.00 N ATOM 523 CA PHE A 44 -5.063 -1.068 0.502 1.00 0.00 C ATOM 524 C PHE A 44 -6.249 -0.574 1.325 1.00 0.00 C ATOM 525 O PHE A 44 -6.801 0.492 1.057 1.00 0.00 O ATOM 526 CB PHE A 44 -5.555 -1.956 -0.642 1.00 0.00 C ATOM 527 CG PHE A 44 -4.682 -1.899 -1.863 1.00 0.00 C ATOM 528 CD1 PHE A 44 -4.469 -0.700 -2.524 1.00 0.00 C ATOM 529 CD2 PHE A 44 -4.075 -3.045 -2.351 1.00 0.00 C ATOM 530 CE1 PHE A 44 -3.666 -0.644 -3.647 1.00 0.00 C ATOM 531 CE2 PHE A 44 -3.271 -2.996 -3.474 1.00 0.00 C ATOM 532 CZ PHE A 44 -3.067 -1.794 -4.123 1.00 0.00 C ATOM 0 H PHE A 44 -3.805 -2.687 0.946 1.00 0.00 H new ATOM 0 HA PHE A 44 -4.548 -0.203 0.085 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -5.611 -2.987 -0.293 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -6.567 -1.657 -0.914 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -4.936 0.202 -2.157 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -4.232 -3.988 -1.848 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -3.507 0.297 -4.152 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -2.803 -3.896 -3.844 1.00 0.00 H new ATOM 0 HZ PHE A 44 -2.440 -1.753 -5.001 1.00 0.00 H new ATOM 542 N GLN A 45 -6.635 -1.359 2.326 1.00 0.00 N ATOM 543 CA GLN A 45 -7.757 -1.002 3.187 1.00 0.00 C ATOM 544 C GLN A 45 -7.449 0.259 3.988 1.00 0.00 C ATOM 545 O GLN A 45 -8.161 1.257 3.889 1.00 0.00 O ATOM 546 CB GLN A 45 -8.086 -2.156 4.136 1.00 0.00 C ATOM 547 CG GLN A 45 -8.471 -3.441 3.421 1.00 0.00 C ATOM 548 CD GLN A 45 -8.493 -4.640 4.347 1.00 0.00 C ATOM 549 OE1 GLN A 45 -7.591 -4.824 5.165 1.00 0.00 O ATOM 550 NE2 GLN A 45 -9.526 -5.466 4.224 1.00 0.00 N ATOM 0 H GLN A 45 -6.188 -2.245 2.561 1.00 0.00 H new ATOM 0 HA GLN A 45 -8.621 -0.805 2.552 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -7.223 -2.349 4.773 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.904 -1.855 4.791 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -9.455 -3.319 2.967 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -7.767 -3.626 2.610 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -10.252 -5.276 3.533 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -9.594 -6.290 4.821 1.00 0.00 H new ATOM 559 N GLU A 46 -6.383 0.204 4.781 1.00 0.00 N ATOM 560 CA GLU A 46 -5.983 1.342 5.600 1.00 0.00 C ATOM 561 C GLU A 46 -5.926 2.619 4.767 1.00 0.00 C ATOM 562 O GLU A 46 -5.915 3.725 5.306 1.00 0.00 O ATOM 563 CB GLU A 46 -4.620 1.081 6.245 1.00 0.00 C ATOM 564 CG GLU A 46 -4.320 1.989 7.425 1.00 0.00 C ATOM 565 CD GLU A 46 -5.255 1.752 8.596 1.00 0.00 C ATOM 566 OE1 GLU A 46 -5.323 0.602 9.078 1.00 0.00 O ATOM 567 OE2 GLU A 46 -5.918 2.717 9.029 1.00 0.00 O ATOM 0 H GLU A 46 -5.782 -0.615 4.873 1.00 0.00 H new ATOM 0 HA GLU A 46 -6.729 1.472 6.384 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -4.577 0.043 6.576 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.841 1.208 5.493 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -3.291 1.830 7.748 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -4.398 3.029 7.108 1.00 0.00 H new ATOM 574 N ALA A 47 -5.891 2.457 3.448 1.00 0.00 N ATOM 575 CA ALA A 47 -5.837 3.596 2.539 1.00 0.00 C ATOM 576 C ALA A 47 -7.228 3.954 2.026 1.00 0.00 C ATOM 577 O ALA A 47 -7.640 5.113 2.078 1.00 0.00 O ATOM 578 CB ALA A 47 -4.903 3.299 1.376 1.00 0.00 C ATOM 0 H ALA A 47 -5.899 1.548 2.985 1.00 0.00 H new ATOM 0 HA ALA A 47 -5.450 4.453 3.091 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -4.872 4.158 0.705 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -3.901 3.099 1.756 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -5.265 2.427 0.832 1.00 0.00 H new ATOM 584 N PHE A 48 -7.946 2.952 1.528 1.00 0.00 N ATOM 585 CA PHE A 48 -9.290 3.163 1.003 1.00 0.00 C ATOM 586 C PHE A 48 -10.344 2.799 2.045 1.00 0.00 C ATOM 587 O PHE A 48 -11.088 3.659 2.517 1.00 0.00 O ATOM 588 CB PHE A 48 -9.501 2.331 -0.264 1.00 0.00 C ATOM 589 CG PHE A 48 -8.364 2.427 -1.240 1.00 0.00 C ATOM 590 CD1 PHE A 48 -7.739 3.640 -1.479 1.00 0.00 C ATOM 591 CD2 PHE A 48 -7.920 1.304 -1.919 1.00 0.00 C ATOM 592 CE1 PHE A 48 -6.693 3.731 -2.377 1.00 0.00 C ATOM 593 CE2 PHE A 48 -6.874 1.389 -2.819 1.00 0.00 C ATOM 594 CZ PHE A 48 -6.259 2.604 -3.047 1.00 0.00 C ATOM 0 H PHE A 48 -7.620 1.987 1.477 1.00 0.00 H new ATOM 0 HA PHE A 48 -9.396 4.220 0.758 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -9.642 1.287 0.016 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -10.419 2.656 -0.754 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -8.073 4.525 -0.957 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -8.397 0.351 -1.743 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -6.215 4.683 -2.555 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -6.538 0.506 -3.343 1.00 0.00 H new ATOM 0 HZ PHE A 48 -5.440 2.673 -3.748 1.00 0.00 H new ATOM 604 N TYR A 49 -10.402 1.520 2.398 1.00 0.00 N ATOM 605 CA TYR A 49 -11.366 1.042 3.381 1.00 0.00 C ATOM 606 C TYR A 49 -11.638 2.106 4.440 1.00 0.00 C ATOM 607 O TYR A 49 -12.771 2.271 4.894 1.00 0.00 O ATOM 608 CB TYR A 49 -10.855 -0.237 4.047 1.00 0.00 C ATOM 609 CG TYR A 49 -11.189 -1.495 3.278 1.00 0.00 C ATOM 610 CD1 TYR A 49 -10.914 -1.597 1.920 1.00 0.00 C ATOM 611 CD2 TYR A 49 -11.779 -2.583 3.910 1.00 0.00 C ATOM 612 CE1 TYR A 49 -11.218 -2.745 1.214 1.00 0.00 C ATOM 613 CE2 TYR A 49 -12.086 -3.735 3.212 1.00 0.00 C ATOM 614 CZ TYR A 49 -11.804 -3.811 1.864 1.00 0.00 C ATOM 615 OH TYR A 49 -12.107 -4.956 1.164 1.00 0.00 O ATOM 0 H TYR A 49 -9.793 0.796 2.018 1.00 0.00 H new ATOM 0 HA TYR A 49 -12.299 0.826 2.861 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -9.773 -0.169 4.163 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -11.279 -0.310 5.048 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -10.455 -0.765 1.407 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -12.001 -2.527 4.965 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -10.998 -2.807 0.159 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -12.544 -4.571 3.719 1.00 0.00 H new ATOM 0 HH TYR A 49 -12.514 -5.611 1.769 1.00 0.00 H new ATOM 625 N VAL A 50 -10.591 2.826 4.828 1.00 0.00 N ATOM 626 CA VAL A 50 -10.716 3.876 5.832 1.00 0.00 C ATOM 627 C VAL A 50 -11.830 4.852 5.471 1.00 0.00 C ATOM 628 O VAL A 50 -12.481 4.714 4.435 1.00 0.00 O ATOM 629 CB VAL A 50 -9.398 4.657 5.995 1.00 0.00 C ATOM 630 CG1 VAL A 50 -8.349 3.796 6.683 1.00 0.00 C ATOM 631 CG2 VAL A 50 -8.897 5.143 4.643 1.00 0.00 C ATOM 0 H VAL A 50 -9.647 2.702 4.463 1.00 0.00 H new ATOM 0 HA VAL A 50 -10.958 3.385 6.775 1.00 0.00 H new ATOM 0 HB VAL A 50 -9.587 5.528 6.622 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -7.425 4.364 6.790 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -8.710 3.501 7.669 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -8.160 2.905 6.084 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -7.965 5.693 4.776 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -8.723 4.287 3.990 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -9.643 5.798 4.192 1.00 0.00 H new ATOM 641 N LYS A 51 -12.045 5.841 6.332 1.00 0.00 N ATOM 642 CA LYS A 51 -13.079 6.843 6.105 1.00 0.00 C ATOM 643 C LYS A 51 -12.620 7.876 5.081 1.00 0.00 C ATOM 644 O LYS A 51 -11.431 8.178 4.979 1.00 0.00 O ATOM 645 CB LYS A 51 -13.442 7.539 7.419 1.00 0.00 C ATOM 646 CG LYS A 51 -14.005 8.937 7.232 1.00 0.00 C ATOM 647 CD LYS A 51 -15.014 9.282 8.314 1.00 0.00 C ATOM 648 CE LYS A 51 -16.431 8.931 7.887 1.00 0.00 C ATOM 649 NZ LYS A 51 -16.786 7.528 8.240 1.00 0.00 N ATOM 0 H LYS A 51 -11.516 5.970 7.194 1.00 0.00 H new ATOM 0 HA LYS A 51 -13.961 6.336 5.714 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -14.172 6.931 7.953 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -12.554 7.595 8.048 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -13.192 9.663 7.247 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -14.480 9.011 6.254 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -14.765 8.745 9.229 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -14.955 10.346 8.542 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -17.134 9.614 8.364 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -16.531 9.071 6.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -17.816 7.403 8.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -16.313 6.875 7.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -16.478 7.326 9.212 1.00 0.00 H new ATOM 663 N ALA A 52 -13.571 8.416 4.325 1.00 0.00 N ATOM 664 CA ALA A 52 -13.264 9.418 3.311 1.00 0.00 C ATOM 665 C ALA A 52 -12.199 10.391 3.806 1.00 0.00 C ATOM 666 O ALA A 52 -11.282 10.750 3.067 1.00 0.00 O ATOM 667 CB ALA A 52 -14.525 10.170 2.914 1.00 0.00 C ATOM 0 H ALA A 52 -14.560 8.176 4.396 1.00 0.00 H new ATOM 0 HA ALA A 52 -12.870 8.904 2.435 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -14.281 10.915 2.156 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -15.255 9.468 2.511 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -14.943 10.666 3.790 1.00 0.00 H new ATOM 673 N ARG A 53 -12.327 10.814 5.059 1.00 0.00 N ATOM 674 CA ARG A 53 -11.376 11.748 5.651 1.00 0.00 C ATOM 675 C ARG A 53 -10.018 11.083 5.855 1.00 0.00 C ATOM 676 O ARG A 53 -8.976 11.729 5.739 1.00 0.00 O ATOM 677 CB ARG A 53 -11.907 12.270 6.987 1.00 0.00 C ATOM 678 CG ARG A 53 -13.162 13.116 6.855 1.00 0.00 C ATOM 679 CD ARG A 53 -12.831 14.547 6.463 1.00 0.00 C ATOM 680 NE ARG A 53 -12.803 14.726 5.014 1.00 0.00 N ATOM 681 CZ ARG A 53 -11.988 15.570 4.393 1.00 0.00 C ATOM 682 NH1 ARG A 53 -11.137 16.310 5.091 1.00 0.00 N ATOM 683 NH2 ARG A 53 -12.022 15.676 3.071 1.00 0.00 N ATOM 0 H ARG A 53 -13.080 10.525 5.684 1.00 0.00 H new ATOM 0 HA ARG A 53 -11.251 12.586 4.965 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -12.117 11.423 7.641 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -11.130 12.861 7.471 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -13.821 12.676 6.107 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -13.705 13.113 7.800 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -13.569 15.222 6.897 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -11.863 14.822 6.881 1.00 0.00 H new ATOM 0 HE ARG A 53 -13.445 14.172 4.448 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -11.108 16.231 6.108 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -10.512 16.958 4.611 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -12.675 15.109 2.531 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -11.395 16.325 2.595 1.00 0.00 H new ATOM 697 N ASP A 54 -10.037 9.791 6.161 1.00 0.00 N ATOM 698 CA ASP A 54 -8.807 9.039 6.381 1.00 0.00 C ATOM 699 C ASP A 54 -8.378 8.315 5.108 1.00 0.00 C ATOM 700 O ASP A 54 -7.577 7.381 5.154 1.00 0.00 O ATOM 701 CB ASP A 54 -8.997 8.031 7.516 1.00 0.00 C ATOM 702 CG ASP A 54 -8.988 8.689 8.882 1.00 0.00 C ATOM 703 OD1 ASP A 54 -9.864 9.543 9.135 1.00 0.00 O ATOM 704 OD2 ASP A 54 -8.107 8.350 9.698 1.00 0.00 O ATOM 0 H ASP A 54 -10.891 9.242 6.262 1.00 0.00 H new ATOM 0 HA ASP A 54 -8.023 9.744 6.659 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -9.941 7.504 7.376 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -8.205 7.284 7.471 1.00 0.00 H new ATOM 709 N ARG A 55 -8.916 8.752 3.975 1.00 0.00 N ATOM 710 CA ARG A 55 -8.591 8.145 2.690 1.00 0.00 C ATOM 711 C ARG A 55 -7.135 8.410 2.317 1.00 0.00 C ATOM 712 O ARG A 55 -6.566 9.438 2.684 1.00 0.00 O ATOM 713 CB ARG A 55 -9.515 8.685 1.597 1.00 0.00 C ATOM 714 CG ARG A 55 -10.773 7.855 1.399 1.00 0.00 C ATOM 715 CD ARG A 55 -11.719 8.506 0.402 1.00 0.00 C ATOM 716 NE ARG A 55 -11.284 8.301 -0.978 1.00 0.00 N ATOM 717 CZ ARG A 55 -11.572 7.215 -1.685 1.00 0.00 C ATOM 718 NH1 ARG A 55 -12.291 6.240 -1.147 1.00 0.00 N ATOM 719 NH2 ARG A 55 -11.141 7.102 -2.935 1.00 0.00 N ATOM 0 H ARG A 55 -9.579 9.525 3.920 1.00 0.00 H new ATOM 0 HA ARG A 55 -8.736 7.068 2.778 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -9.800 9.707 1.846 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -8.966 8.727 0.656 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -10.502 6.859 1.048 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -11.281 7.729 2.355 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -12.721 8.096 0.531 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -11.783 9.575 0.607 1.00 0.00 H new ATOM 0 HE ARG A 55 -10.729 9.032 -1.422 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -12.625 6.323 -0.187 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -12.510 5.407 -1.693 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -10.588 7.850 -3.353 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -11.363 6.267 -3.477 1.00 0.00 H new ATOM 733 N LYS A 56 -6.538 7.477 1.584 1.00 0.00 N ATOM 734 CA LYS A 56 -5.149 7.609 1.159 1.00 0.00 C ATOM 735 C LYS A 56 -4.843 6.667 0.000 1.00 0.00 C ATOM 736 O LYS A 56 -5.688 5.866 -0.404 1.00 0.00 O ATOM 737 CB LYS A 56 -4.207 7.317 2.329 1.00 0.00 C ATOM 738 CG LYS A 56 -4.220 8.391 3.403 1.00 0.00 C ATOM 739 CD LYS A 56 -3.013 8.279 4.319 1.00 0.00 C ATOM 740 CE LYS A 56 -3.311 7.408 5.530 1.00 0.00 C ATOM 741 NZ LYS A 56 -2.476 7.786 6.704 1.00 0.00 N ATOM 0 H LYS A 56 -6.995 6.620 1.271 1.00 0.00 H new ATOM 0 HA LYS A 56 -4.994 8.634 0.822 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -4.483 6.363 2.778 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -3.191 7.208 1.948 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -4.232 9.375 2.934 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -5.134 8.307 3.992 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -2.173 7.859 3.766 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.712 9.273 4.650 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -4.366 7.497 5.791 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -3.132 6.363 5.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -1.910 6.967 7.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -1.842 8.568 6.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -3.092 8.087 7.486 1.00 0.00 H new ATOM 755 N LEU A 57 -3.630 6.765 -0.532 1.00 0.00 N ATOM 756 CA LEU A 57 -3.211 5.921 -1.646 1.00 0.00 C ATOM 757 C LEU A 57 -2.093 4.974 -1.221 1.00 0.00 C ATOM 758 O LEU A 57 -1.340 5.264 -0.289 1.00 0.00 O ATOM 759 CB LEU A 57 -2.746 6.784 -2.820 1.00 0.00 C ATOM 760 CG LEU A 57 -3.758 7.801 -3.348 1.00 0.00 C ATOM 761 CD1 LEU A 57 -3.146 8.633 -4.464 1.00 0.00 C ATOM 762 CD2 LEU A 57 -5.017 7.097 -3.833 1.00 0.00 C ATOM 0 H LEU A 57 -2.918 7.421 -0.210 1.00 0.00 H new ATOM 0 HA LEU A 57 -4.068 5.325 -1.960 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.847 7.320 -2.517 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -2.463 6.124 -3.640 1.00 0.00 H new ATOM 0 HG LEU A 57 -4.031 8.471 -2.533 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.881 9.351 -4.827 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.274 9.166 -4.084 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -2.843 7.979 -5.282 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -5.727 7.836 -4.205 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -4.761 6.404 -4.634 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -5.467 6.546 -3.007 1.00 0.00 H new ATOM 774 N LEU A 58 -1.988 3.844 -1.910 1.00 0.00 N ATOM 775 CA LEU A 58 -0.959 2.855 -1.606 1.00 0.00 C ATOM 776 C LEU A 58 0.136 2.864 -2.667 1.00 0.00 C ATOM 777 O LEU A 58 -0.104 3.230 -3.817 1.00 0.00 O ATOM 778 CB LEU A 58 -1.578 1.460 -1.508 1.00 0.00 C ATOM 779 CG LEU A 58 -0.600 0.305 -1.285 1.00 0.00 C ATOM 780 CD1 LEU A 58 -0.246 0.183 0.188 1.00 0.00 C ATOM 781 CD2 LEU A 58 -1.187 -0.999 -1.805 1.00 0.00 C ATOM 0 H LEU A 58 -2.602 3.589 -2.683 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.512 3.116 -0.647 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -2.300 1.461 -0.691 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -2.135 1.266 -2.425 1.00 0.00 H new ATOM 0 HG LEU A 58 0.314 0.515 -1.841 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.451 -0.644 0.328 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.217 1.109 0.529 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -1.151 -0.004 0.766 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.478 -1.810 -1.638 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.116 -1.216 -1.278 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.388 -0.907 -2.872 1.00 0.00 H new ATOM 793 N ALA A 59 1.338 2.458 -2.273 1.00 0.00 N ATOM 794 CA ALA A 59 2.470 2.416 -3.191 1.00 0.00 C ATOM 795 C ALA A 59 3.427 1.284 -2.831 1.00 0.00 C ATOM 796 O ALA A 59 4.075 1.317 -1.785 1.00 0.00 O ATOM 797 CB ALA A 59 3.201 3.749 -3.189 1.00 0.00 C ATOM 0 H ALA A 59 1.553 2.153 -1.324 1.00 0.00 H new ATOM 0 HA ALA A 59 2.086 2.227 -4.194 1.00 0.00 H new ATOM 0 HB1 ALA A 59 4.044 3.703 -3.879 1.00 0.00 H new ATOM 0 HB2 ALA A 59 2.518 4.539 -3.502 1.00 0.00 H new ATOM 0 HB3 ALA A 59 3.566 3.962 -2.184 1.00 0.00 H new ATOM 803 N ILE A 60 3.510 0.286 -3.704 1.00 0.00 N ATOM 804 CA ILE A 60 4.389 -0.855 -3.477 1.00 0.00 C ATOM 805 C ILE A 60 5.811 -0.553 -3.936 1.00 0.00 C ATOM 806 O ILE A 60 6.038 -0.183 -5.089 1.00 0.00 O ATOM 807 CB ILE A 60 3.881 -2.111 -4.210 1.00 0.00 C ATOM 808 CG1 ILE A 60 2.490 -2.496 -3.703 1.00 0.00 C ATOM 809 CG2 ILE A 60 4.856 -3.263 -4.023 1.00 0.00 C ATOM 810 CD1 ILE A 60 1.363 -1.870 -4.495 1.00 0.00 C ATOM 0 H ILE A 60 2.980 0.244 -4.574 1.00 0.00 H new ATOM 0 HA ILE A 60 4.389 -1.045 -2.404 1.00 0.00 H new ATOM 0 HB ILE A 60 3.810 -1.889 -5.275 1.00 0.00 H new ATOM 0 HG12 ILE A 60 2.388 -3.581 -3.736 1.00 0.00 H new ATOM 0 HG13 ILE A 60 2.398 -2.199 -2.658 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.484 -4.144 -4.547 1.00 0.00 H new ATOM 0 HG22 ILE A 60 5.829 -2.985 -4.427 1.00 0.00 H new ATOM 0 HG23 ILE A 60 4.955 -3.487 -2.961 1.00 0.00 H new ATOM 0 HD11 ILE A 60 0.406 -2.187 -4.079 1.00 0.00 H new ATOM 0 HD12 ILE A 60 1.440 -0.784 -4.441 1.00 0.00 H new ATOM 0 HD13 ILE A 60 1.430 -2.187 -5.536 1.00 0.00 H new ATOM 822 N TYR A 61 6.767 -0.715 -3.028 1.00 0.00 N ATOM 823 CA TYR A 61 8.168 -0.459 -3.339 1.00 0.00 C ATOM 824 C TYR A 61 8.949 -1.765 -3.448 1.00 0.00 C ATOM 825 O TYR A 61 9.303 -2.377 -2.439 1.00 0.00 O ATOM 826 CB TYR A 61 8.795 0.435 -2.268 1.00 0.00 C ATOM 827 CG TYR A 61 10.297 0.297 -2.167 1.00 0.00 C ATOM 828 CD1 TYR A 61 11.136 0.930 -3.075 1.00 0.00 C ATOM 829 CD2 TYR A 61 10.878 -0.467 -1.161 1.00 0.00 C ATOM 830 CE1 TYR A 61 12.509 0.805 -2.987 1.00 0.00 C ATOM 831 CE2 TYR A 61 12.250 -0.596 -1.064 1.00 0.00 C ATOM 832 CZ TYR A 61 13.061 0.041 -1.979 1.00 0.00 C ATOM 833 OH TYR A 61 14.428 -0.084 -1.887 1.00 0.00 O ATOM 0 H TYR A 61 6.597 -1.023 -2.070 1.00 0.00 H new ATOM 0 HA TYR A 61 8.213 0.052 -4.301 1.00 0.00 H new ATOM 0 HB2 TYR A 61 8.548 1.474 -2.484 1.00 0.00 H new ATOM 0 HB3 TYR A 61 8.351 0.196 -1.302 1.00 0.00 H new ATOM 0 HD1 TYR A 61 10.707 1.531 -3.864 1.00 0.00 H new ATOM 0 HD2 TYR A 61 10.246 -0.968 -0.443 1.00 0.00 H new ATOM 0 HE1 TYR A 61 13.147 1.302 -3.703 1.00 0.00 H new ATOM 0 HE2 TYR A 61 12.685 -1.193 -0.276 1.00 0.00 H new ATOM 0 HH TYR A 61 14.849 0.781 -2.072 1.00 0.00 H new ATOM 843 N LEU A 62 9.215 -2.186 -4.680 1.00 0.00 N ATOM 844 CA LEU A 62 9.955 -3.419 -4.923 1.00 0.00 C ATOM 845 C LEU A 62 11.403 -3.286 -4.460 1.00 0.00 C ATOM 846 O LEU A 62 12.059 -2.278 -4.723 1.00 0.00 O ATOM 847 CB LEU A 62 9.914 -3.777 -6.410 1.00 0.00 C ATOM 848 CG LEU A 62 8.528 -4.042 -6.998 1.00 0.00 C ATOM 849 CD1 LEU A 62 8.608 -4.181 -8.511 1.00 0.00 C ATOM 850 CD2 LEU A 62 7.916 -5.290 -6.378 1.00 0.00 C ATOM 0 H LEU A 62 8.929 -1.692 -5.525 1.00 0.00 H new ATOM 0 HA LEU A 62 9.482 -4.216 -4.350 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.376 -2.965 -6.972 1.00 0.00 H new ATOM 0 HB3 LEU A 62 10.529 -4.663 -6.567 1.00 0.00 H new ATOM 0 HG LEU A 62 7.886 -3.192 -6.765 1.00 0.00 H new ATOM 0 HD11 LEU A 62 7.612 -4.369 -8.912 1.00 0.00 H new ATOM 0 HD12 LEU A 62 9.004 -3.261 -8.940 1.00 0.00 H new ATOM 0 HD13 LEU A 62 9.265 -5.013 -8.766 1.00 0.00 H new ATOM 0 HD21 LEU A 62 6.930 -5.464 -6.808 1.00 0.00 H new ATOM 0 HD22 LEU A 62 8.556 -6.148 -6.581 1.00 0.00 H new ATOM 0 HD23 LEU A 62 7.823 -5.153 -5.301 1.00 0.00 H new ATOM 862 N HIS A 63 11.895 -4.311 -3.772 1.00 0.00 N ATOM 863 CA HIS A 63 13.266 -4.310 -3.275 1.00 0.00 C ATOM 864 C HIS A 63 14.017 -5.551 -3.748 1.00 0.00 C ATOM 865 O HIS A 63 13.671 -6.675 -3.382 1.00 0.00 O ATOM 866 CB HIS A 63 13.277 -4.244 -1.747 1.00 0.00 C ATOM 867 CG HIS A 63 14.654 -4.213 -1.159 1.00 0.00 C ATOM 868 ND1 HIS A 63 15.294 -5.094 -0.356 1.00 0.00 N flip ATOM 869 CD2 HIS A 63 15.542 -3.180 -1.376 1.00 0.00 C flip ATOM 870 CE1 HIS A 63 16.544 -4.584 -0.105 1.00 0.00 C flip ATOM 871 NE2 HIS A 63 16.669 -3.428 -0.733 1.00 0.00 N flip ATOM 0 H HIS A 63 11.365 -5.153 -3.546 1.00 0.00 H new ATOM 0 HA HIS A 63 13.770 -3.429 -3.673 1.00 0.00 H new ATOM 0 HB2 HIS A 63 12.734 -3.355 -1.426 1.00 0.00 H new ATOM 0 HB3 HIS A 63 12.741 -5.106 -1.350 1.00 0.00 H new ATOM 0 HD2 HIS A 63 15.346 -2.305 -1.978 1.00 0.00 H new ATOM 0 HE1 HIS A 63 17.302 -5.052 0.506 1.00 0.00 H new ATOM 0 HE2 HIS A 63 17.495 -2.829 -0.723 1.00 0.00 H new ATOM 879 N HIS A 64 15.045 -5.341 -4.564 1.00 0.00 N ATOM 880 CA HIS A 64 15.844 -6.443 -5.087 1.00 0.00 C ATOM 881 C HIS A 64 17.294 -6.328 -4.628 1.00 0.00 C ATOM 882 O HIS A 64 18.062 -5.526 -5.160 1.00 0.00 O ATOM 883 CB HIS A 64 15.780 -6.466 -6.614 1.00 0.00 C ATOM 884 CG HIS A 64 15.911 -7.840 -7.198 1.00 0.00 C ATOM 885 ND1 HIS A 64 17.060 -8.595 -7.096 1.00 0.00 N ATOM 886 CD2 HIS A 64 15.027 -8.594 -7.892 1.00 0.00 C ATOM 887 CE1 HIS A 64 16.878 -9.754 -7.703 1.00 0.00 C ATOM 888 NE2 HIS A 64 15.652 -9.779 -8.195 1.00 0.00 N ATOM 0 H HIS A 64 15.344 -4.418 -4.877 1.00 0.00 H new ATOM 0 HA HIS A 64 15.432 -7.375 -4.699 1.00 0.00 H new ATOM 0 HB2 HIS A 64 14.834 -6.032 -6.936 1.00 0.00 H new ATOM 0 HB3 HIS A 64 16.573 -5.833 -7.012 1.00 0.00 H new ATOM 0 HD2 HIS A 64 14.018 -8.316 -8.158 1.00 0.00 H new ATOM 0 HE1 HIS A 64 17.607 -10.546 -7.783 1.00 0.00 H new ATOM 0 HE2 HIS A 64 15.237 -10.552 -8.715 1.00 0.00 H new ATOM 896 N ASP A 65 17.662 -7.133 -3.637 1.00 0.00 N ATOM 897 CA ASP A 65 19.020 -7.122 -3.107 1.00 0.00 C ATOM 898 C ASP A 65 20.044 -7.245 -4.231 1.00 0.00 C ATOM 899 O ASP A 65 20.928 -6.402 -4.373 1.00 0.00 O ATOM 900 CB ASP A 65 19.208 -8.260 -2.102 1.00 0.00 C ATOM 901 CG ASP A 65 18.514 -7.987 -0.782 1.00 0.00 C ATOM 902 OD1 ASP A 65 19.021 -7.148 -0.007 1.00 0.00 O ATOM 903 OD2 ASP A 65 17.464 -8.611 -0.524 1.00 0.00 O ATOM 0 H ASP A 65 17.038 -7.801 -3.185 1.00 0.00 H new ATOM 0 HA ASP A 65 19.177 -6.170 -2.600 1.00 0.00 H new ATOM 0 HB2 ASP A 65 18.820 -9.185 -2.528 1.00 0.00 H new ATOM 0 HB3 ASP A 65 20.273 -8.412 -1.925 1.00 0.00 H new ATOM 908 N GLU A 66 19.917 -8.303 -5.027 1.00 0.00 N ATOM 909 CA GLU A 66 20.832 -8.537 -6.137 1.00 0.00 C ATOM 910 C GLU A 66 21.202 -7.225 -6.823 1.00 0.00 C ATOM 911 O GLU A 66 22.340 -7.036 -7.253 1.00 0.00 O ATOM 912 CB GLU A 66 20.205 -9.496 -7.151 1.00 0.00 C ATOM 913 CG GLU A 66 19.944 -10.885 -6.594 1.00 0.00 C ATOM 914 CD GLU A 66 20.034 -11.966 -7.654 1.00 0.00 C ATOM 915 OE1 GLU A 66 19.019 -12.210 -8.339 1.00 0.00 O ATOM 916 OE2 GLU A 66 21.119 -12.567 -7.798 1.00 0.00 O ATOM 0 H GLU A 66 19.190 -9.011 -4.923 1.00 0.00 H new ATOM 0 HA GLU A 66 21.741 -8.987 -5.736 1.00 0.00 H new ATOM 0 HB2 GLU A 66 19.265 -9.073 -7.505 1.00 0.00 H new ATOM 0 HB3 GLU A 66 20.863 -9.578 -8.016 1.00 0.00 H new ATOM 0 HG2 GLU A 66 20.664 -11.096 -5.803 1.00 0.00 H new ATOM 0 HG3 GLU A 66 18.954 -10.910 -6.139 1.00 0.00 H new ATOM 923 N SER A 67 20.232 -6.321 -6.922 1.00 0.00 N ATOM 924 CA SER A 67 20.454 -5.029 -7.559 1.00 0.00 C ATOM 925 C SER A 67 21.450 -4.193 -6.761 1.00 0.00 C ATOM 926 O SER A 67 21.653 -4.420 -5.568 1.00 0.00 O ATOM 927 CB SER A 67 19.131 -4.271 -7.698 1.00 0.00 C ATOM 928 OG SER A 67 19.325 -3.019 -8.332 1.00 0.00 O ATOM 0 H SER A 67 19.285 -6.460 -6.569 1.00 0.00 H new ATOM 0 HA SER A 67 20.869 -5.208 -8.551 1.00 0.00 H new ATOM 0 HB2 SER A 67 18.425 -4.869 -8.274 1.00 0.00 H new ATOM 0 HB3 SER A 67 18.690 -4.119 -6.713 1.00 0.00 H new ATOM 0 HG SER A 67 18.706 -2.361 -7.952 1.00 0.00 H new ATOM 934 N VAL A 68 22.070 -3.226 -7.429 1.00 0.00 N ATOM 935 CA VAL A 68 23.045 -2.355 -6.784 1.00 0.00 C ATOM 936 C VAL A 68 22.411 -1.032 -6.370 1.00 0.00 C ATOM 937 O VAL A 68 22.907 -0.346 -5.474 1.00 0.00 O ATOM 938 CB VAL A 68 24.242 -2.069 -7.710 1.00 0.00 C ATOM 939 CG1 VAL A 68 24.972 -3.359 -8.052 1.00 0.00 C ATOM 940 CG2 VAL A 68 23.781 -1.357 -8.972 1.00 0.00 C ATOM 0 H VAL A 68 21.914 -3.026 -8.417 1.00 0.00 H new ATOM 0 HA VAL A 68 23.399 -2.879 -5.896 1.00 0.00 H new ATOM 0 HB VAL A 68 24.937 -1.414 -7.185 1.00 0.00 H new ATOM 0 HG11 VAL A 68 25.815 -3.138 -8.707 1.00 0.00 H new ATOM 0 HG12 VAL A 68 25.337 -3.824 -7.136 1.00 0.00 H new ATOM 0 HG13 VAL A 68 24.288 -4.041 -8.558 1.00 0.00 H new ATOM 0 HG21 VAL A 68 24.640 -1.163 -9.615 1.00 0.00 H new ATOM 0 HG22 VAL A 68 23.065 -1.984 -9.503 1.00 0.00 H new ATOM 0 HG23 VAL A 68 23.307 -0.413 -8.704 1.00 0.00 H new ATOM 950 N LEU A 69 21.311 -0.678 -7.026 1.00 0.00 N ATOM 951 CA LEU A 69 20.607 0.564 -6.726 1.00 0.00 C ATOM 952 C LEU A 69 19.774 0.424 -5.456 1.00 0.00 C ATOM 953 O LEU A 69 19.261 1.410 -4.924 1.00 0.00 O ATOM 954 CB LEU A 69 19.708 0.959 -7.898 1.00 0.00 C ATOM 955 CG LEU A 69 20.402 1.647 -9.074 1.00 0.00 C ATOM 956 CD1 LEU A 69 19.477 1.704 -10.281 1.00 0.00 C ATOM 957 CD2 LEU A 69 20.857 3.045 -8.682 1.00 0.00 C ATOM 0 H LEU A 69 20.887 -1.234 -7.769 1.00 0.00 H new ATOM 0 HA LEU A 69 21.350 1.345 -6.567 1.00 0.00 H new ATOM 0 HB2 LEU A 69 19.213 0.061 -8.269 1.00 0.00 H new ATOM 0 HB3 LEU A 69 18.928 1.622 -7.524 1.00 0.00 H new ATOM 0 HG LEU A 69 21.282 1.063 -9.343 1.00 0.00 H new ATOM 0 HD11 LEU A 69 19.988 2.197 -11.108 1.00 0.00 H new ATOM 0 HD12 LEU A 69 19.201 0.692 -10.576 1.00 0.00 H new ATOM 0 HD13 LEU A 69 18.578 2.264 -10.024 1.00 0.00 H new ATOM 0 HD21 LEU A 69 21.349 3.519 -9.531 1.00 0.00 H new ATOM 0 HD22 LEU A 69 19.993 3.639 -8.385 1.00 0.00 H new ATOM 0 HD23 LEU A 69 21.556 2.980 -7.848 1.00 0.00 H new ATOM 969 N THR A 70 19.644 -0.808 -4.972 1.00 0.00 N ATOM 970 CA THR A 70 18.874 -1.077 -3.764 1.00 0.00 C ATOM 971 C THR A 70 19.631 -0.629 -2.519 1.00 0.00 C ATOM 972 O THR A 70 19.187 0.265 -1.799 1.00 0.00 O ATOM 973 CB THR A 70 18.537 -2.574 -3.635 1.00 0.00 C ATOM 974 OG1 THR A 70 19.530 -3.360 -4.303 1.00 0.00 O ATOM 975 CG2 THR A 70 17.166 -2.873 -4.223 1.00 0.00 C ATOM 0 H THR A 70 20.062 -1.635 -5.398 1.00 0.00 H new ATOM 0 HA THR A 70 17.947 -0.509 -3.846 1.00 0.00 H new ATOM 0 HB THR A 70 18.524 -2.830 -2.576 1.00 0.00 H new ATOM 0 HG1 THR A 70 19.129 -4.198 -4.615 1.00 0.00 H new ATOM 0 HG21 THR A 70 16.950 -3.936 -4.120 1.00 0.00 H new ATOM 0 HG22 THR A 70 16.409 -2.296 -3.692 1.00 0.00 H new ATOM 0 HG23 THR A 70 17.156 -2.601 -5.278 1.00 0.00 H new ATOM 983 N ASN A 71 20.776 -1.255 -2.270 1.00 0.00 N ATOM 984 CA ASN A 71 21.595 -0.920 -1.111 1.00 0.00 C ATOM 985 C ASN A 71 21.709 0.592 -0.944 1.00 0.00 C ATOM 986 O ASN A 71 21.519 1.123 0.150 1.00 0.00 O ATOM 987 CB ASN A 71 22.989 -1.535 -1.250 1.00 0.00 C ATOM 988 CG ASN A 71 23.526 -1.437 -2.665 1.00 0.00 C ATOM 989 OD1 ASN A 71 23.276 -2.309 -3.498 1.00 0.00 O ATOM 990 ND2 ASN A 71 24.269 -0.372 -2.943 1.00 0.00 N ATOM 0 H ASN A 71 21.158 -1.998 -2.856 1.00 0.00 H new ATOM 0 HA ASN A 71 21.111 -1.330 -0.225 1.00 0.00 H new ATOM 0 HB2 ASN A 71 23.675 -1.032 -0.568 1.00 0.00 H new ATOM 0 HB3 ASN A 71 22.953 -2.582 -0.950 1.00 0.00 H new ATOM 0 HD21 ASN A 71 24.658 -0.252 -3.878 1.00 0.00 H new ATOM 0 HD22 ASN A 71 24.450 0.326 -2.221 1.00 0.00 H new ATOM 997 N VAL A 72 22.020 1.281 -2.038 1.00 0.00 N ATOM 998 CA VAL A 72 22.158 2.732 -2.014 1.00 0.00 C ATOM 999 C VAL A 72 20.805 3.409 -1.828 1.00 0.00 C ATOM 1000 O VAL A 72 20.608 4.181 -0.889 1.00 0.00 O ATOM 1001 CB VAL A 72 22.808 3.256 -3.308 1.00 0.00 C ATOM 1002 CG1 VAL A 72 24.283 2.887 -3.352 1.00 0.00 C ATOM 1003 CG2 VAL A 72 22.078 2.714 -4.528 1.00 0.00 C ATOM 0 H VAL A 72 22.181 0.857 -2.952 1.00 0.00 H new ATOM 0 HA VAL A 72 22.802 2.975 -1.169 1.00 0.00 H new ATOM 0 HB VAL A 72 22.729 4.343 -3.319 1.00 0.00 H new ATOM 0 HG11 VAL A 72 24.725 3.266 -4.273 1.00 0.00 H new ATOM 0 HG12 VAL A 72 24.794 3.328 -2.496 1.00 0.00 H new ATOM 0 HG13 VAL A 72 24.388 1.803 -3.318 1.00 0.00 H new ATOM 0 HG21 VAL A 72 22.551 3.094 -5.434 1.00 0.00 H new ATOM 0 HG22 VAL A 72 22.123 1.625 -4.525 1.00 0.00 H new ATOM 0 HG23 VAL A 72 21.036 3.034 -4.501 1.00 0.00 H new ATOM 1013 N PHE A 73 19.873 3.115 -2.729 1.00 0.00 N ATOM 1014 CA PHE A 73 18.537 3.696 -2.665 1.00 0.00 C ATOM 1015 C PHE A 73 17.909 3.466 -1.293 1.00 0.00 C ATOM 1016 O PHE A 73 16.920 4.107 -0.936 1.00 0.00 O ATOM 1017 CB PHE A 73 17.645 3.097 -3.754 1.00 0.00 C ATOM 1018 CG PHE A 73 16.254 3.666 -3.770 1.00 0.00 C ATOM 1019 CD1 PHE A 73 15.345 3.333 -2.779 1.00 0.00 C ATOM 1020 CD2 PHE A 73 15.857 4.533 -4.775 1.00 0.00 C ATOM 1021 CE1 PHE A 73 14.065 3.855 -2.791 1.00 0.00 C ATOM 1022 CE2 PHE A 73 14.579 5.057 -4.793 1.00 0.00 C ATOM 1023 CZ PHE A 73 13.682 4.718 -3.799 1.00 0.00 C ATOM 0 H PHE A 73 20.019 2.478 -3.512 1.00 0.00 H new ATOM 0 HA PHE A 73 18.626 4.770 -2.828 1.00 0.00 H new ATOM 0 HB2 PHE A 73 18.109 3.265 -4.726 1.00 0.00 H new ATOM 0 HB3 PHE A 73 17.586 2.018 -3.611 1.00 0.00 H new ATOM 0 HD1 PHE A 73 15.639 2.658 -1.989 1.00 0.00 H new ATOM 0 HD2 PHE A 73 16.555 4.802 -5.554 1.00 0.00 H new ATOM 0 HE1 PHE A 73 13.365 3.588 -2.013 1.00 0.00 H new ATOM 0 HE2 PHE A 73 14.282 5.731 -5.583 1.00 0.00 H new ATOM 0 HZ PHE A 73 12.683 5.127 -3.810 1.00 0.00 H new ATOM 1033 N CYS A 74 18.490 2.547 -0.531 1.00 0.00 N ATOM 1034 CA CYS A 74 17.987 2.230 0.802 1.00 0.00 C ATOM 1035 C CYS A 74 18.408 3.294 1.809 1.00 0.00 C ATOM 1036 O CYS A 74 17.573 3.863 2.512 1.00 0.00 O ATOM 1037 CB CYS A 74 18.495 0.858 1.248 1.00 0.00 C ATOM 1038 SG CYS A 74 17.534 -0.531 0.603 1.00 0.00 S ATOM 0 H CYS A 74 19.309 2.008 -0.812 1.00 0.00 H new ATOM 0 HA CYS A 74 16.898 2.209 0.757 1.00 0.00 H new ATOM 0 HB2 CYS A 74 19.532 0.746 0.932 1.00 0.00 H new ATOM 0 HB3 CYS A 74 18.488 0.816 2.337 1.00 0.00 H new ATOM 0 HG CYS A 74 17.832 -0.721 -0.648 1.00 0.00 H new ATOM 1044 N SER A 75 19.710 3.557 1.875 1.00 0.00 N ATOM 1045 CA SER A 75 20.243 4.549 2.801 1.00 0.00 C ATOM 1046 C SER A 75 20.421 5.897 2.109 1.00 0.00 C ATOM 1047 O SER A 75 20.798 6.885 2.740 1.00 0.00 O ATOM 1048 CB SER A 75 21.581 4.076 3.374 1.00 0.00 C ATOM 1049 OG SER A 75 22.609 4.159 2.402 1.00 0.00 O ATOM 0 H SER A 75 20.414 3.097 1.298 1.00 0.00 H new ATOM 0 HA SER A 75 19.529 4.670 3.616 1.00 0.00 H new ATOM 0 HB2 SER A 75 21.845 4.683 4.240 1.00 0.00 H new ATOM 0 HB3 SER A 75 21.488 3.047 3.723 1.00 0.00 H new ATOM 0 HG SER A 75 23.454 3.853 2.793 1.00 0.00 H new ATOM 1055 N GLN A 76 20.146 5.929 0.809 1.00 0.00 N ATOM 1056 CA GLN A 76 20.277 7.155 0.031 1.00 0.00 C ATOM 1057 C GLN A 76 18.915 7.804 -0.194 1.00 0.00 C ATOM 1058 O GLN A 76 18.742 9.001 0.032 1.00 0.00 O ATOM 1059 CB GLN A 76 20.945 6.862 -1.313 1.00 0.00 C ATOM 1060 CG GLN A 76 22.366 6.339 -1.186 1.00 0.00 C ATOM 1061 CD GLN A 76 23.306 7.348 -0.556 1.00 0.00 C ATOM 1062 OE1 GLN A 76 22.919 8.484 -0.279 1.00 0.00 O ATOM 1063 NE2 GLN A 76 24.547 6.938 -0.327 1.00 0.00 N ATOM 0 H GLN A 76 19.831 5.120 0.273 1.00 0.00 H new ATOM 0 HA GLN A 76 20.901 7.849 0.594 1.00 0.00 H new ATOM 0 HB2 GLN A 76 20.345 6.131 -1.856 1.00 0.00 H new ATOM 0 HB3 GLN A 76 20.954 7.773 -1.911 1.00 0.00 H new ATOM 0 HG2 GLN A 76 22.362 5.429 -0.586 1.00 0.00 H new ATOM 0 HG3 GLN A 76 22.739 6.068 -2.174 1.00 0.00 H new ATOM 0 HE21 GLN A 76 24.824 5.988 -0.573 1.00 0.00 H new ATOM 0 HE22 GLN A 76 25.224 7.573 0.095 1.00 0.00 H new ATOM 1072 N MET A 77 17.952 7.006 -0.642 1.00 0.00 N ATOM 1073 CA MET A 77 16.605 7.503 -0.897 1.00 0.00 C ATOM 1074 C MET A 77 15.685 7.213 0.285 1.00 0.00 C ATOM 1075 O MET A 77 15.263 8.127 0.995 1.00 0.00 O ATOM 1076 CB MET A 77 16.036 6.869 -2.168 1.00 0.00 C ATOM 1077 CG MET A 77 16.641 7.425 -3.447 1.00 0.00 C ATOM 1078 SD MET A 77 18.399 7.791 -3.283 1.00 0.00 S ATOM 1079 CE MET A 77 19.057 6.935 -4.712 1.00 0.00 C ATOM 0 H MET A 77 18.079 6.013 -0.836 1.00 0.00 H new ATOM 0 HA MET A 77 16.663 8.583 -1.033 1.00 0.00 H new ATOM 0 HB2 MET A 77 16.204 5.793 -2.134 1.00 0.00 H new ATOM 0 HB3 MET A 77 14.957 7.023 -2.189 1.00 0.00 H new ATOM 0 HG2 MET A 77 16.497 6.707 -4.254 1.00 0.00 H new ATOM 0 HG3 MET A 77 16.110 8.334 -3.730 1.00 0.00 H new ATOM 0 HE1 MET A 77 20.133 6.806 -4.595 1.00 0.00 H new ATOM 0 HE2 MET A 77 18.582 5.958 -4.801 1.00 0.00 H new ATOM 0 HE3 MET A 77 18.857 7.519 -5.610 1.00 0.00 H new ATOM 1089 N LEU A 78 15.378 5.937 0.490 1.00 0.00 N ATOM 1090 CA LEU A 78 14.507 5.527 1.586 1.00 0.00 C ATOM 1091 C LEU A 78 14.830 6.304 2.859 1.00 0.00 C ATOM 1092 O LEU A 78 13.987 6.440 3.746 1.00 0.00 O ATOM 1093 CB LEU A 78 14.649 4.025 1.842 1.00 0.00 C ATOM 1094 CG LEU A 78 13.653 3.123 1.114 1.00 0.00 C ATOM 1095 CD1 LEU A 78 14.014 1.659 1.313 1.00 0.00 C ATOM 1096 CD2 LEU A 78 12.235 3.395 1.597 1.00 0.00 C ATOM 0 H LEU A 78 15.719 5.169 -0.088 1.00 0.00 H new ATOM 0 HA LEU A 78 13.478 5.745 1.300 1.00 0.00 H new ATOM 0 HB2 LEU A 78 15.657 3.722 1.559 1.00 0.00 H new ATOM 0 HB3 LEU A 78 14.552 3.849 2.913 1.00 0.00 H new ATOM 0 HG LEU A 78 13.702 3.346 0.048 1.00 0.00 H new ATOM 0 HD11 LEU A 78 13.294 1.032 0.787 1.00 0.00 H new ATOM 0 HD12 LEU A 78 15.013 1.474 0.918 1.00 0.00 H new ATOM 0 HD13 LEU A 78 13.995 1.421 2.376 1.00 0.00 H new ATOM 0 HD21 LEU A 78 11.539 2.744 1.068 1.00 0.00 H new ATOM 0 HD22 LEU A 78 12.172 3.200 2.668 1.00 0.00 H new ATOM 0 HD23 LEU A 78 11.978 4.436 1.402 1.00 0.00 H new ATOM 1108 N CYS A 79 16.054 6.813 2.939 1.00 0.00 N ATOM 1109 CA CYS A 79 16.489 7.578 4.103 1.00 0.00 C ATOM 1110 C CYS A 79 16.017 9.025 4.009 1.00 0.00 C ATOM 1111 O CYS A 79 16.538 9.904 4.695 1.00 0.00 O ATOM 1112 CB CYS A 79 18.012 7.533 4.229 1.00 0.00 C ATOM 1113 SG CYS A 79 18.621 6.277 5.379 1.00 0.00 S ATOM 0 H CYS A 79 16.763 6.710 2.213 1.00 0.00 H new ATOM 0 HA CYS A 79 16.045 7.127 4.990 1.00 0.00 H new ATOM 0 HB2 CYS A 79 18.442 7.348 3.245 1.00 0.00 H new ATOM 0 HB3 CYS A 79 18.368 8.511 4.554 1.00 0.00 H new ATOM 0 HG CYS A 79 19.920 6.315 5.415 1.00 0.00 H new ATOM 1119 N ALA A 80 15.029 9.266 3.153 1.00 0.00 N ATOM 1120 CA ALA A 80 14.487 10.606 2.969 1.00 0.00 C ATOM 1121 C ALA A 80 13.471 10.941 4.056 1.00 0.00 C ATOM 1122 O ALA A 80 12.327 10.492 4.008 1.00 0.00 O ATOM 1123 CB ALA A 80 13.851 10.734 1.593 1.00 0.00 C ATOM 0 H ALA A 80 14.588 8.550 2.576 1.00 0.00 H new ATOM 0 HA ALA A 80 15.310 11.317 3.045 1.00 0.00 H new ATOM 0 HB1 ALA A 80 13.450 11.740 1.470 1.00 0.00 H new ATOM 0 HB2 ALA A 80 14.602 10.546 0.826 1.00 0.00 H new ATOM 0 HB3 ALA A 80 13.044 10.008 1.496 1.00 0.00 H new ATOM 1129 N GLU A 81 13.899 11.732 5.035 1.00 0.00 N ATOM 1130 CA GLU A 81 13.026 12.126 6.135 1.00 0.00 C ATOM 1131 C GLU A 81 11.822 12.910 5.620 1.00 0.00 C ATOM 1132 O GLU A 81 10.711 12.768 6.130 1.00 0.00 O ATOM 1133 CB GLU A 81 13.798 12.967 7.153 1.00 0.00 C ATOM 1134 CG GLU A 81 14.469 14.189 6.550 1.00 0.00 C ATOM 1135 CD GLU A 81 15.696 14.625 7.327 1.00 0.00 C ATOM 1136 OE1 GLU A 81 16.777 14.044 7.101 1.00 0.00 O ATOM 1137 OE2 GLU A 81 15.574 15.547 8.160 1.00 0.00 O ATOM 0 H GLU A 81 14.844 12.112 5.089 1.00 0.00 H new ATOM 0 HA GLU A 81 12.667 11.219 6.622 1.00 0.00 H new ATOM 0 HB2 GLU A 81 13.114 13.289 7.938 1.00 0.00 H new ATOM 0 HB3 GLU A 81 14.556 12.343 7.626 1.00 0.00 H new ATOM 0 HG2 GLU A 81 14.754 13.971 5.521 1.00 0.00 H new ATOM 0 HG3 GLU A 81 13.754 15.011 6.516 1.00 0.00 H new ATOM 1144 N SER A 82 12.052 13.738 4.606 1.00 0.00 N ATOM 1145 CA SER A 82 10.989 14.549 4.025 1.00 0.00 C ATOM 1146 C SER A 82 9.976 13.672 3.294 1.00 0.00 C ATOM 1147 O SER A 82 8.788 13.992 3.240 1.00 0.00 O ATOM 1148 CB SER A 82 11.575 15.582 3.061 1.00 0.00 C ATOM 1149 OG SER A 82 12.378 16.525 3.750 1.00 0.00 O ATOM 0 H SER A 82 12.965 13.865 4.170 1.00 0.00 H new ATOM 0 HA SER A 82 10.477 15.068 4.835 1.00 0.00 H new ATOM 0 HB2 SER A 82 12.172 15.077 2.301 1.00 0.00 H new ATOM 0 HB3 SER A 82 10.768 16.098 2.541 1.00 0.00 H new ATOM 0 HG SER A 82 12.742 17.173 3.111 1.00 0.00 H new ATOM 1155 N ILE A 83 10.455 12.567 2.734 1.00 0.00 N ATOM 1156 CA ILE A 83 9.592 11.644 2.007 1.00 0.00 C ATOM 1157 C ILE A 83 8.866 10.703 2.962 1.00 0.00 C ATOM 1158 O ILE A 83 7.647 10.779 3.120 1.00 0.00 O ATOM 1159 CB ILE A 83 10.391 10.809 0.990 1.00 0.00 C ATOM 1160 CG1 ILE A 83 10.966 11.711 -0.104 1.00 0.00 C ATOM 1161 CG2 ILE A 83 9.509 9.727 0.383 1.00 0.00 C ATOM 1162 CD1 ILE A 83 11.848 10.978 -1.091 1.00 0.00 C ATOM 0 H ILE A 83 11.436 12.289 2.770 1.00 0.00 H new ATOM 0 HA ILE A 83 8.861 12.250 1.472 1.00 0.00 H new ATOM 0 HB ILE A 83 11.219 10.326 1.509 1.00 0.00 H new ATOM 0 HG12 ILE A 83 10.145 12.182 -0.644 1.00 0.00 H new ATOM 0 HG13 ILE A 83 11.542 12.511 0.361 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.088 9.145 -0.334 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.144 9.070 1.172 1.00 0.00 H new ATOM 0 HG23 ILE A 83 8.663 10.190 -0.125 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.220 11.680 -1.837 1.00 0.00 H new ATOM 0 HD12 ILE A 83 12.690 10.529 -0.563 1.00 0.00 H new ATOM 0 HD13 ILE A 83 11.270 10.196 -1.584 1.00 0.00 H new ATOM 1174 N VAL A 84 9.624 9.816 3.601 1.00 0.00 N ATOM 1175 CA VAL A 84 9.053 8.861 4.544 1.00 0.00 C ATOM 1176 C VAL A 84 7.927 9.494 5.352 1.00 0.00 C ATOM 1177 O VAL A 84 6.889 8.873 5.581 1.00 0.00 O ATOM 1178 CB VAL A 84 10.123 8.320 5.510 1.00 0.00 C ATOM 1179 CG1 VAL A 84 11.245 7.641 4.740 1.00 0.00 C ATOM 1180 CG2 VAL A 84 10.668 9.441 6.383 1.00 0.00 C ATOM 0 H VAL A 84 10.634 9.739 3.483 1.00 0.00 H new ATOM 0 HA VAL A 84 8.654 8.034 3.956 1.00 0.00 H new ATOM 0 HB VAL A 84 9.659 7.577 6.159 1.00 0.00 H new ATOM 0 HG11 VAL A 84 11.991 7.265 5.440 1.00 0.00 H new ATOM 0 HG12 VAL A 84 10.839 6.811 4.162 1.00 0.00 H new ATOM 0 HG13 VAL A 84 11.710 8.360 4.065 1.00 0.00 H new ATOM 0 HG21 VAL A 84 11.423 9.041 7.060 1.00 0.00 H new ATOM 0 HG22 VAL A 84 11.116 10.208 5.752 1.00 0.00 H new ATOM 0 HG23 VAL A 84 9.855 9.878 6.964 1.00 0.00 H new ATOM 1190 N SER A 85 8.138 10.734 5.783 1.00 0.00 N ATOM 1191 CA SER A 85 7.141 11.450 6.570 1.00 0.00 C ATOM 1192 C SER A 85 5.841 11.605 5.788 1.00 0.00 C ATOM 1193 O SER A 85 4.772 11.208 6.253 1.00 0.00 O ATOM 1194 CB SER A 85 7.673 12.826 6.975 1.00 0.00 C ATOM 1195 OG SER A 85 8.082 13.569 5.839 1.00 0.00 O ATOM 0 H SER A 85 8.991 11.263 5.600 1.00 0.00 H new ATOM 0 HA SER A 85 6.937 10.868 7.469 1.00 0.00 H new ATOM 0 HB2 SER A 85 6.900 13.374 7.513 1.00 0.00 H new ATOM 0 HB3 SER A 85 8.514 12.708 7.658 1.00 0.00 H new ATOM 0 HG SER A 85 9.058 13.533 5.759 1.00 0.00 H new ATOM 1201 N TYR A 86 5.940 12.184 4.597 1.00 0.00 N ATOM 1202 CA TYR A 86 4.771 12.395 3.750 1.00 0.00 C ATOM 1203 C TYR A 86 4.277 11.075 3.166 1.00 0.00 C ATOM 1204 O TYR A 86 3.134 10.672 3.391 1.00 0.00 O ATOM 1205 CB TYR A 86 5.104 13.371 2.620 1.00 0.00 C ATOM 1206 CG TYR A 86 4.003 13.506 1.593 1.00 0.00 C ATOM 1207 CD1 TYR A 86 2.910 14.333 1.820 1.00 0.00 C ATOM 1208 CD2 TYR A 86 4.056 12.806 0.393 1.00 0.00 C ATOM 1209 CE1 TYR A 86 1.902 14.459 0.885 1.00 0.00 C ATOM 1210 CE2 TYR A 86 3.052 12.926 -0.549 1.00 0.00 C ATOM 1211 CZ TYR A 86 1.977 13.753 -0.298 1.00 0.00 C ATOM 1212 OH TYR A 86 0.975 13.876 -1.234 1.00 0.00 O ATOM 0 H TYR A 86 6.817 12.516 4.196 1.00 0.00 H new ATOM 0 HA TYR A 86 3.978 12.819 4.367 1.00 0.00 H new ATOM 0 HB2 TYR A 86 5.313 14.352 3.048 1.00 0.00 H new ATOM 0 HB3 TYR A 86 6.015 13.040 2.122 1.00 0.00 H new ATOM 0 HD1 TYR A 86 2.848 14.887 2.745 1.00 0.00 H new ATOM 0 HD2 TYR A 86 4.896 12.157 0.194 1.00 0.00 H new ATOM 0 HE1 TYR A 86 1.060 15.107 1.079 1.00 0.00 H new ATOM 0 HE2 TYR A 86 3.109 12.375 -1.476 1.00 0.00 H new ATOM 0 HH TYR A 86 1.146 14.661 -1.795 1.00 0.00 H new ATOM 1222 N LEU A 87 5.145 10.404 2.417 1.00 0.00 N ATOM 1223 CA LEU A 87 4.799 9.128 1.801 1.00 0.00 C ATOM 1224 C LEU A 87 4.022 8.246 2.774 1.00 0.00 C ATOM 1225 O LEU A 87 3.163 7.463 2.368 1.00 0.00 O ATOM 1226 CB LEU A 87 6.063 8.403 1.337 1.00 0.00 C ATOM 1227 CG LEU A 87 5.918 6.905 1.067 1.00 0.00 C ATOM 1228 CD1 LEU A 87 5.073 6.666 -0.174 1.00 0.00 C ATOM 1229 CD2 LEU A 87 7.286 6.255 0.917 1.00 0.00 C ATOM 0 H LEU A 87 6.094 10.723 2.222 1.00 0.00 H new ATOM 0 HA LEU A 87 4.166 9.330 0.937 1.00 0.00 H new ATOM 0 HB2 LEU A 87 6.419 8.883 0.425 1.00 0.00 H new ATOM 0 HB3 LEU A 87 6.836 8.542 2.093 1.00 0.00 H new ATOM 0 HG LEU A 87 5.413 6.449 1.919 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.981 5.594 -0.351 1.00 0.00 H new ATOM 0 HD12 LEU A 87 4.082 7.096 -0.028 1.00 0.00 H new ATOM 0 HD13 LEU A 87 5.549 7.136 -1.035 1.00 0.00 H new ATOM 0 HD21 LEU A 87 7.163 5.189 0.725 1.00 0.00 H new ATOM 0 HD22 LEU A 87 7.818 6.715 0.084 1.00 0.00 H new ATOM 0 HD23 LEU A 87 7.858 6.395 1.834 1.00 0.00 H new ATOM 1241 N SER A 88 4.328 8.381 4.061 1.00 0.00 N ATOM 1242 CA SER A 88 3.660 7.596 5.092 1.00 0.00 C ATOM 1243 C SER A 88 2.423 8.322 5.611 1.00 0.00 C ATOM 1244 O SER A 88 1.413 7.695 5.932 1.00 0.00 O ATOM 1245 CB SER A 88 4.621 7.311 6.248 1.00 0.00 C ATOM 1246 OG SER A 88 4.088 6.334 7.125 1.00 0.00 O ATOM 0 H SER A 88 5.034 9.027 4.414 1.00 0.00 H new ATOM 0 HA SER A 88 3.346 6.651 4.649 1.00 0.00 H new ATOM 0 HB2 SER A 88 5.577 6.967 5.854 1.00 0.00 H new ATOM 0 HB3 SER A 88 4.815 8.231 6.799 1.00 0.00 H new ATOM 0 HG SER A 88 4.640 6.283 7.933 1.00 0.00 H new ATOM 1252 N GLN A 89 2.510 9.645 5.689 1.00 0.00 N ATOM 1253 CA GLN A 89 1.398 10.457 6.170 1.00 0.00 C ATOM 1254 C GLN A 89 0.251 10.458 5.165 1.00 0.00 C ATOM 1255 O GLN A 89 -0.872 10.075 5.490 1.00 0.00 O ATOM 1256 CB GLN A 89 1.861 11.890 6.434 1.00 0.00 C ATOM 1257 CG GLN A 89 2.360 12.117 7.852 1.00 0.00 C ATOM 1258 CD GLN A 89 2.923 13.509 8.057 1.00 0.00 C ATOM 1259 OE1 GLN A 89 3.947 13.854 7.286 1.00 0.00 O flip ATOM 1260 NE2 GLN A 89 2.442 14.268 8.900 1.00 0.00 N flip ATOM 0 H GLN A 89 3.339 10.178 5.425 1.00 0.00 H new ATOM 0 HA GLN A 89 1.040 10.021 7.103 1.00 0.00 H new ATOM 0 HB2 GLN A 89 2.657 12.141 5.733 1.00 0.00 H new ATOM 0 HB3 GLN A 89 1.035 12.572 6.235 1.00 0.00 H new ATOM 0 HG2 GLN A 89 1.540 11.954 8.552 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.129 11.380 8.085 1.00 0.00 H new ATOM 0 HE21 GLN A 89 1.655 13.962 9.472 1.00 0.00 H new ATOM 0 HE22 GLN A 89 2.831 15.202 9.026 1.00 0.00 H new ATOM 1269 N ASN A 90 0.542 10.891 3.942 1.00 0.00 N ATOM 1270 CA ASN A 90 -0.466 10.943 2.889 1.00 0.00 C ATOM 1271 C ASN A 90 -0.646 9.573 2.241 1.00 0.00 C ATOM 1272 O ASN A 90 -1.770 9.117 2.031 1.00 0.00 O ATOM 1273 CB ASN A 90 -0.073 11.973 1.829 1.00 0.00 C ATOM 1274 CG ASN A 90 -0.540 13.372 2.182 1.00 0.00 C ATOM 1275 OD1 ASN A 90 -1.248 14.016 1.407 1.00 0.00 O ATOM 1276 ND2 ASN A 90 -0.145 13.849 3.356 1.00 0.00 N ATOM 0 H ASN A 90 1.467 11.211 3.656 1.00 0.00 H new ATOM 0 HA ASN A 90 -1.413 11.239 3.340 1.00 0.00 H new ATOM 0 HB2 ASN A 90 1.011 11.974 1.711 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -0.498 11.682 0.868 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -0.428 14.785 3.648 1.00 0.00 H new ATOM 0 HD22 ASN A 90 0.441 13.280 3.966 1.00 0.00 H new ATOM 1283 N PHE A 91 0.469 8.922 1.926 1.00 0.00 N ATOM 1284 CA PHE A 91 0.435 7.605 1.302 1.00 0.00 C ATOM 1285 C PHE A 91 0.795 6.516 2.308 1.00 0.00 C ATOM 1286 O PHE A 91 1.138 6.805 3.455 1.00 0.00 O ATOM 1287 CB PHE A 91 1.397 7.555 0.114 1.00 0.00 C ATOM 1288 CG PHE A 91 0.901 8.302 -1.092 1.00 0.00 C ATOM 1289 CD1 PHE A 91 0.444 9.605 -0.976 1.00 0.00 C ATOM 1290 CD2 PHE A 91 0.891 7.700 -2.340 1.00 0.00 C ATOM 1291 CE1 PHE A 91 -0.013 10.295 -2.083 1.00 0.00 C ATOM 1292 CE2 PHE A 91 0.436 8.385 -3.450 1.00 0.00 C ATOM 1293 CZ PHE A 91 -0.018 9.684 -3.322 1.00 0.00 C ATOM 0 H PHE A 91 1.407 9.285 2.093 1.00 0.00 H new ATOM 0 HA PHE A 91 -0.580 7.426 0.947 1.00 0.00 H new ATOM 0 HB2 PHE A 91 2.358 7.969 0.418 1.00 0.00 H new ATOM 0 HB3 PHE A 91 1.570 6.514 -0.159 1.00 0.00 H new ATOM 0 HD1 PHE A 91 0.445 10.087 -0.009 1.00 0.00 H new ATOM 0 HD2 PHE A 91 1.243 6.684 -2.446 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -0.366 11.311 -1.980 1.00 0.00 H new ATOM 0 HE2 PHE A 91 0.435 7.905 -4.418 1.00 0.00 H new ATOM 0 HZ PHE A 91 -0.376 10.220 -4.189 1.00 0.00 H new ATOM 1303 N ILE A 92 0.713 5.264 1.871 1.00 0.00 N ATOM 1304 CA ILE A 92 1.031 4.132 2.733 1.00 0.00 C ATOM 1305 C ILE A 92 2.332 3.463 2.304 1.00 0.00 C ATOM 1306 O ILE A 92 2.478 3.040 1.156 1.00 0.00 O ATOM 1307 CB ILE A 92 -0.098 3.085 2.726 1.00 0.00 C ATOM 1308 CG1 ILE A 92 -1.417 3.722 3.168 1.00 0.00 C ATOM 1309 CG2 ILE A 92 0.259 1.914 3.628 1.00 0.00 C ATOM 1310 CD1 ILE A 92 -1.366 4.313 4.560 1.00 0.00 C ATOM 0 H ILE A 92 0.429 5.008 0.925 1.00 0.00 H new ATOM 0 HA ILE A 92 1.144 4.526 3.743 1.00 0.00 H new ATOM 0 HB ILE A 92 -0.219 2.711 1.709 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -1.689 4.505 2.460 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -2.205 2.970 3.130 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -0.549 1.183 3.612 1.00 0.00 H new ATOM 0 HG22 ILE A 92 1.178 1.447 3.272 1.00 0.00 H new ATOM 0 HG23 ILE A 92 0.405 2.271 4.647 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -2.335 4.747 4.807 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -1.125 3.530 5.279 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -0.601 5.088 4.598 1.00 0.00 H new ATOM 1322 N THR A 93 3.277 3.368 3.234 1.00 0.00 N ATOM 1323 CA THR A 93 4.567 2.750 2.954 1.00 0.00 C ATOM 1324 C THR A 93 4.464 1.229 2.977 1.00 0.00 C ATOM 1325 O THR A 93 4.142 0.635 4.006 1.00 0.00 O ATOM 1326 CB THR A 93 5.636 3.196 3.968 1.00 0.00 C ATOM 1327 OG1 THR A 93 5.622 4.622 4.100 1.00 0.00 O ATOM 1328 CG2 THR A 93 7.020 2.736 3.534 1.00 0.00 C ATOM 0 H THR A 93 3.173 3.712 4.189 1.00 0.00 H new ATOM 0 HA THR A 93 4.864 3.077 1.957 1.00 0.00 H new ATOM 0 HB THR A 93 5.404 2.740 4.930 1.00 0.00 H new ATOM 0 HG1 THR A 93 5.902 4.869 5.006 1.00 0.00 H new ATOM 0 HG21 THR A 93 7.758 3.063 4.266 1.00 0.00 H new ATOM 0 HG22 THR A 93 7.036 1.648 3.463 1.00 0.00 H new ATOM 0 HG23 THR A 93 7.258 3.167 2.561 1.00 0.00 H new ATOM 1336 N TRP A 94 4.739 0.605 1.838 1.00 0.00 N ATOM 1337 CA TRP A 94 4.678 -0.848 1.729 1.00 0.00 C ATOM 1338 C TRP A 94 5.790 -1.374 0.828 1.00 0.00 C ATOM 1339 O TRP A 94 5.830 -1.073 -0.365 1.00 0.00 O ATOM 1340 CB TRP A 94 3.316 -1.283 1.184 1.00 0.00 C ATOM 1341 CG TRP A 94 3.005 -2.725 1.445 1.00 0.00 C ATOM 1342 CD1 TRP A 94 2.595 -3.275 2.626 1.00 0.00 C ATOM 1343 CD2 TRP A 94 3.080 -3.802 0.504 1.00 0.00 C ATOM 1344 NE1 TRP A 94 2.411 -4.628 2.476 1.00 0.00 N ATOM 1345 CE2 TRP A 94 2.701 -4.976 1.184 1.00 0.00 C ATOM 1346 CE3 TRP A 94 3.429 -3.888 -0.846 1.00 0.00 C ATOM 1347 CZ2 TRP A 94 2.663 -6.219 0.557 1.00 0.00 C ATOM 1348 CZ3 TRP A 94 3.391 -5.122 -1.466 1.00 0.00 C ATOM 1349 CH2 TRP A 94 3.010 -6.274 -0.765 1.00 0.00 C ATOM 0 H TRP A 94 5.006 1.082 0.977 1.00 0.00 H new ATOM 0 HA TRP A 94 4.814 -1.267 2.726 1.00 0.00 H new ATOM 0 HB2 TRP A 94 2.539 -0.664 1.632 1.00 0.00 H new ATOM 0 HB3 TRP A 94 3.288 -1.101 0.110 1.00 0.00 H new ATOM 0 HD1 TRP A 94 2.438 -2.727 3.543 1.00 0.00 H new ATOM 0 HE1 TRP A 94 2.107 -5.270 3.209 1.00 0.00 H new ATOM 0 HE3 TRP A 94 3.723 -3.006 -1.395 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 2.370 -7.108 1.096 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 3.660 -5.200 -2.509 1.00 0.00 H new ATOM 0 HH2 TRP A 94 2.990 -7.224 -1.279 1.00 0.00 H new ATOM 1360 N ALA A 95 6.692 -2.161 1.406 1.00 0.00 N ATOM 1361 CA ALA A 95 7.803 -2.730 0.654 1.00 0.00 C ATOM 1362 C ALA A 95 7.708 -4.251 0.600 1.00 0.00 C ATOM 1363 O ALA A 95 7.080 -4.874 1.456 1.00 0.00 O ATOM 1364 CB ALA A 95 9.129 -2.304 1.268 1.00 0.00 C ATOM 0 H ALA A 95 6.675 -2.419 2.393 1.00 0.00 H new ATOM 0 HA ALA A 95 7.749 -2.352 -0.367 1.00 0.00 H new ATOM 0 HB1 ALA A 95 9.950 -2.736 0.696 1.00 0.00 H new ATOM 0 HB2 ALA A 95 9.206 -1.217 1.249 1.00 0.00 H new ATOM 0 HB3 ALA A 95 9.181 -2.653 2.299 1.00 0.00 H new ATOM 1370 N TRP A 96 8.334 -4.842 -0.411 1.00 0.00 N ATOM 1371 CA TRP A 96 8.319 -6.291 -0.576 1.00 0.00 C ATOM 1372 C TRP A 96 9.649 -6.790 -1.131 1.00 0.00 C ATOM 1373 O TRP A 96 10.235 -6.168 -2.017 1.00 0.00 O ATOM 1374 CB TRP A 96 7.177 -6.707 -1.505 1.00 0.00 C ATOM 1375 CG TRP A 96 7.047 -8.192 -1.659 1.00 0.00 C ATOM 1376 CD1 TRP A 96 7.521 -8.954 -2.689 1.00 0.00 C ATOM 1377 CD2 TRP A 96 6.399 -9.094 -0.755 1.00 0.00 C ATOM 1378 NE1 TRP A 96 7.206 -10.275 -2.479 1.00 0.00 N ATOM 1379 CE2 TRP A 96 6.519 -10.388 -1.300 1.00 0.00 C ATOM 1380 CE3 TRP A 96 5.731 -8.935 0.462 1.00 0.00 C ATOM 1381 CZ2 TRP A 96 5.995 -11.512 -0.668 1.00 0.00 C ATOM 1382 CZ3 TRP A 96 5.211 -10.053 1.087 1.00 0.00 C ATOM 1383 CH2 TRP A 96 5.346 -11.328 0.522 1.00 0.00 C ATOM 0 H TRP A 96 8.858 -4.341 -1.128 1.00 0.00 H new ATOM 0 HA TRP A 96 8.164 -6.742 0.404 1.00 0.00 H new ATOM 0 HB2 TRP A 96 6.240 -6.306 -1.119 1.00 0.00 H new ATOM 0 HB3 TRP A 96 7.335 -6.260 -2.486 1.00 0.00 H new ATOM 0 HD1 TRP A 96 8.063 -8.574 -3.542 1.00 0.00 H new ATOM 0 HE1 TRP A 96 7.445 -11.047 -3.101 1.00 0.00 H new ATOM 0 HE3 TRP A 96 5.623 -7.957 0.906 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 6.097 -12.496 -1.102 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 4.692 -9.942 2.027 1.00 0.00 H new ATOM 0 HH2 TRP A 96 4.930 -12.182 1.036 1.00 0.00 H new ATOM 1394 N ASP A 97 10.120 -7.915 -0.605 1.00 0.00 N ATOM 1395 CA ASP A 97 11.381 -8.498 -1.049 1.00 0.00 C ATOM 1396 C ASP A 97 11.141 -9.566 -2.111 1.00 0.00 C ATOM 1397 O ASP A 97 10.419 -10.537 -1.879 1.00 0.00 O ATOM 1398 CB ASP A 97 12.134 -9.100 0.137 1.00 0.00 C ATOM 1399 CG ASP A 97 12.841 -8.048 0.969 1.00 0.00 C ATOM 1400 OD1 ASP A 97 12.320 -6.917 1.062 1.00 0.00 O ATOM 1401 OD2 ASP A 97 13.915 -8.355 1.527 1.00 0.00 O ATOM 0 H ASP A 97 9.648 -8.442 0.130 1.00 0.00 H new ATOM 0 HA ASP A 97 11.986 -7.704 -1.488 1.00 0.00 H new ATOM 0 HB2 ASP A 97 11.434 -9.648 0.768 1.00 0.00 H new ATOM 0 HB3 ASP A 97 12.865 -9.821 -0.229 1.00 0.00 H new ATOM 1406 N LEU A 98 11.750 -9.381 -3.277 1.00 0.00 N ATOM 1407 CA LEU A 98 11.603 -10.329 -4.376 1.00 0.00 C ATOM 1408 C LEU A 98 12.819 -11.245 -4.472 1.00 0.00 C ATOM 1409 O LEU A 98 12.744 -12.338 -5.036 1.00 0.00 O ATOM 1410 CB LEU A 98 11.407 -9.582 -5.697 1.00 0.00 C ATOM 1411 CG LEU A 98 10.152 -8.714 -5.797 1.00 0.00 C ATOM 1412 CD1 LEU A 98 10.430 -7.312 -5.277 1.00 0.00 C ATOM 1413 CD2 LEU A 98 9.653 -8.663 -7.234 1.00 0.00 C ATOM 0 H LEU A 98 12.350 -8.583 -3.486 1.00 0.00 H new ATOM 0 HA LEU A 98 10.724 -10.943 -4.179 1.00 0.00 H new ATOM 0 HB2 LEU A 98 12.277 -8.948 -5.865 1.00 0.00 H new ATOM 0 HB3 LEU A 98 11.384 -10.313 -6.505 1.00 0.00 H new ATOM 0 HG LEU A 98 9.374 -9.161 -5.178 1.00 0.00 H new ATOM 0 HD11 LEU A 98 9.526 -6.709 -5.356 1.00 0.00 H new ATOM 0 HD12 LEU A 98 10.740 -7.366 -4.233 1.00 0.00 H new ATOM 0 HD13 LEU A 98 11.224 -6.855 -5.868 1.00 0.00 H new ATOM 0 HD21 LEU A 98 8.759 -8.041 -7.287 1.00 0.00 H new ATOM 0 HD22 LEU A 98 10.428 -8.240 -7.873 1.00 0.00 H new ATOM 0 HD23 LEU A 98 9.414 -9.671 -7.572 1.00 0.00 H new ATOM 1425 N THR A 99 13.939 -10.793 -3.917 1.00 0.00 N ATOM 1426 CA THR A 99 15.171 -11.572 -3.939 1.00 0.00 C ATOM 1427 C THR A 99 14.878 -13.066 -3.871 1.00 0.00 C ATOM 1428 O THR A 99 15.469 -13.860 -4.604 1.00 0.00 O ATOM 1429 CB THR A 99 16.099 -11.188 -2.771 1.00 0.00 C ATOM 1430 OG1 THR A 99 16.225 -9.764 -2.693 1.00 0.00 O ATOM 1431 CG2 THR A 99 17.474 -11.816 -2.943 1.00 0.00 C ATOM 0 H THR A 99 14.018 -9.891 -3.447 1.00 0.00 H new ATOM 0 HA THR A 99 15.672 -11.346 -4.880 1.00 0.00 H new ATOM 0 HB THR A 99 15.659 -11.564 -1.847 1.00 0.00 H new ATOM 0 HG1 THR A 99 16.671 -9.520 -1.855 1.00 0.00 H new ATOM 0 HG21 THR A 99 18.112 -11.531 -2.106 1.00 0.00 H new ATOM 0 HG22 THR A 99 17.377 -12.901 -2.972 1.00 0.00 H new ATOM 0 HG23 THR A 99 17.920 -11.467 -3.874 1.00 0.00 H new ATOM 1439 N LYS A 100 13.962 -13.445 -2.986 1.00 0.00 N ATOM 1440 CA LYS A 100 13.588 -14.845 -2.823 1.00 0.00 C ATOM 1441 C LYS A 100 12.809 -15.345 -4.035 1.00 0.00 C ATOM 1442 O LYS A 100 11.734 -14.833 -4.348 1.00 0.00 O ATOM 1443 CB LYS A 100 12.751 -15.026 -1.554 1.00 0.00 C ATOM 1444 CG LYS A 100 13.577 -15.067 -0.281 1.00 0.00 C ATOM 1445 CD LYS A 100 14.354 -16.368 -0.162 1.00 0.00 C ATOM 1446 CE LYS A 100 15.654 -16.172 0.603 1.00 0.00 C ATOM 1447 NZ LYS A 100 16.702 -15.532 -0.240 1.00 0.00 N ATOM 0 H LYS A 100 13.465 -12.802 -2.370 1.00 0.00 H new ATOM 0 HA LYS A 100 14.502 -15.432 -2.734 1.00 0.00 H new ATOM 0 HB2 LYS A 100 12.032 -14.210 -1.484 1.00 0.00 H new ATOM 0 HB3 LYS A 100 12.178 -15.950 -1.635 1.00 0.00 H new ATOM 0 HG2 LYS A 100 14.270 -14.226 -0.269 1.00 0.00 H new ATOM 0 HG3 LYS A 100 12.922 -14.953 0.583 1.00 0.00 H new ATOM 0 HD2 LYS A 100 13.741 -17.114 0.344 1.00 0.00 H new ATOM 0 HD3 LYS A 100 14.571 -16.756 -1.157 1.00 0.00 H new ATOM 0 HE2 LYS A 100 15.469 -15.555 1.482 1.00 0.00 H new ATOM 0 HE3 LYS A 100 16.014 -17.137 0.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 17.572 -15.416 0.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 16.897 -16.133 -1.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 16.369 -14.600 -0.560 1.00 0.00 H new ATOM 1461 N ASP A 101 13.357 -16.348 -4.711 1.00 0.00 N ATOM 1462 CA ASP A 101 12.711 -16.920 -5.888 1.00 0.00 C ATOM 1463 C ASP A 101 11.260 -17.282 -5.589 1.00 0.00 C ATOM 1464 O ASP A 101 10.340 -16.793 -6.245 1.00 0.00 O ATOM 1465 CB ASP A 101 13.472 -18.158 -6.363 1.00 0.00 C ATOM 1466 CG ASP A 101 12.963 -18.676 -7.694 1.00 0.00 C ATOM 1467 OD1 ASP A 101 12.955 -17.896 -8.670 1.00 0.00 O ATOM 1468 OD2 ASP A 101 12.575 -19.860 -7.760 1.00 0.00 O ATOM 0 H ASP A 101 14.247 -16.782 -4.465 1.00 0.00 H new ATOM 0 HA ASP A 101 12.724 -16.171 -6.679 1.00 0.00 H new ATOM 0 HB2 ASP A 101 14.532 -17.918 -6.451 1.00 0.00 H new ATOM 0 HB3 ASP A 101 13.385 -18.944 -5.613 1.00 0.00 H new ATOM 1473 N SER A 102 11.063 -18.143 -4.596 1.00 0.00 N ATOM 1474 CA SER A 102 9.724 -18.576 -4.213 1.00 0.00 C ATOM 1475 C SER A 102 8.778 -17.383 -4.104 1.00 0.00 C ATOM 1476 O SER A 102 7.590 -17.490 -4.405 1.00 0.00 O ATOM 1477 CB SER A 102 9.769 -19.329 -2.883 1.00 0.00 C ATOM 1478 OG SER A 102 10.579 -18.650 -1.939 1.00 0.00 O ATOM 0 H SER A 102 11.814 -18.555 -4.042 1.00 0.00 H new ATOM 0 HA SER A 102 9.350 -19.245 -4.988 1.00 0.00 H new ATOM 0 HB2 SER A 102 8.759 -19.437 -2.489 1.00 0.00 H new ATOM 0 HB3 SER A 102 10.158 -20.334 -3.044 1.00 0.00 H new ATOM 0 HG SER A 102 10.590 -19.151 -1.097 1.00 0.00 H new ATOM 1484 N ASN A 103 9.316 -16.248 -3.671 1.00 0.00 N ATOM 1485 CA ASN A 103 8.521 -15.034 -3.521 1.00 0.00 C ATOM 1486 C ASN A 103 8.283 -14.369 -4.874 1.00 0.00 C ATOM 1487 O ASN A 103 7.150 -14.042 -5.225 1.00 0.00 O ATOM 1488 CB ASN A 103 9.220 -14.056 -2.575 1.00 0.00 C ATOM 1489 CG ASN A 103 8.805 -14.254 -1.130 1.00 0.00 C ATOM 1490 OD1 ASN A 103 8.319 -13.328 -0.479 1.00 0.00 O ATOM 1491 ND2 ASN A 103 8.997 -15.465 -0.620 1.00 0.00 N ATOM 0 H ASN A 103 10.298 -16.143 -3.418 1.00 0.00 H new ATOM 0 HA ASN A 103 7.556 -15.311 -3.098 1.00 0.00 H new ATOM 0 HB2 ASN A 103 10.299 -14.181 -2.661 1.00 0.00 H new ATOM 0 HB3 ASN A 103 8.992 -13.034 -2.879 1.00 0.00 H new ATOM 0 HD21 ASN A 103 8.739 -15.658 0.348 1.00 0.00 H new ATOM 0 HD22 ASN A 103 9.403 -16.203 -1.196 1.00 0.00 H new ATOM 1498 N ARG A 104 9.360 -14.172 -5.627 1.00 0.00 N ATOM 1499 CA ARG A 104 9.269 -13.545 -6.941 1.00 0.00 C ATOM 1500 C ARG A 104 7.961 -13.920 -7.632 1.00 0.00 C ATOM 1501 O ARG A 104 7.209 -13.050 -8.072 1.00 0.00 O ATOM 1502 CB ARG A 104 10.456 -13.962 -7.811 1.00 0.00 C ATOM 1503 CG ARG A 104 10.870 -12.905 -8.822 1.00 0.00 C ATOM 1504 CD ARG A 104 12.231 -13.215 -9.426 1.00 0.00 C ATOM 1505 NE ARG A 104 12.124 -14.068 -10.607 1.00 0.00 N ATOM 1506 CZ ARG A 104 13.103 -14.859 -11.033 1.00 0.00 C ATOM 1507 NH1 ARG A 104 14.254 -14.905 -10.378 1.00 0.00 N ATOM 1508 NH2 ARG A 104 12.930 -15.605 -12.116 1.00 0.00 N ATOM 0 H ARG A 104 10.305 -14.437 -5.350 1.00 0.00 H new ATOM 0 HA ARG A 104 9.290 -12.464 -6.803 1.00 0.00 H new ATOM 0 HB2 ARG A 104 11.306 -14.190 -7.167 1.00 0.00 H new ATOM 0 HB3 ARG A 104 10.203 -14.880 -8.341 1.00 0.00 H new ATOM 0 HG2 ARG A 104 10.124 -12.846 -9.614 1.00 0.00 H new ATOM 0 HG3 ARG A 104 10.899 -11.929 -8.338 1.00 0.00 H new ATOM 0 HD2 ARG A 104 12.729 -12.283 -9.695 1.00 0.00 H new ATOM 0 HD3 ARG A 104 12.856 -13.706 -8.680 1.00 0.00 H new ATOM 0 HE ARG A 104 11.250 -14.056 -11.133 1.00 0.00 H new ATOM 0 HH11 ARG A 104 14.390 -14.332 -9.545 1.00 0.00 H new ATOM 0 HH12 ARG A 104 15.004 -15.513 -10.707 1.00 0.00 H new ATOM 0 HH21 ARG A 104 12.045 -15.572 -12.622 1.00 0.00 H new ATOM 0 HH22 ARG A 104 13.682 -16.212 -12.443 1.00 0.00 H new ATOM 1522 N ALA A 105 7.698 -15.219 -7.724 1.00 0.00 N ATOM 1523 CA ALA A 105 6.481 -15.708 -8.361 1.00 0.00 C ATOM 1524 C ALA A 105 5.239 -15.165 -7.661 1.00 0.00 C ATOM 1525 O ALA A 105 4.295 -14.717 -8.312 1.00 0.00 O ATOM 1526 CB ALA A 105 6.463 -17.229 -8.366 1.00 0.00 C ATOM 0 H ALA A 105 8.311 -15.952 -7.366 1.00 0.00 H new ATOM 0 HA ALA A 105 6.471 -15.352 -9.391 1.00 0.00 H new ATOM 0 HB1 ALA A 105 5.549 -17.580 -8.844 1.00 0.00 H new ATOM 0 HB2 ALA A 105 7.327 -17.601 -8.916 1.00 0.00 H new ATOM 0 HB3 ALA A 105 6.500 -17.597 -7.341 1.00 0.00 H new ATOM 1532 N ARG A 106 5.247 -15.208 -6.333 1.00 0.00 N ATOM 1533 CA ARG A 106 4.121 -14.722 -5.546 1.00 0.00 C ATOM 1534 C ARG A 106 3.666 -13.350 -6.036 1.00 0.00 C ATOM 1535 O ARG A 106 2.578 -13.208 -6.593 1.00 0.00 O ATOM 1536 CB ARG A 106 4.500 -14.647 -4.066 1.00 0.00 C ATOM 1537 CG ARG A 106 4.865 -15.993 -3.461 1.00 0.00 C ATOM 1538 CD ARG A 106 5.065 -15.892 -1.957 1.00 0.00 C ATOM 1539 NE ARG A 106 3.795 -15.791 -1.242 1.00 0.00 N ATOM 1540 CZ ARG A 106 2.903 -16.773 -1.188 1.00 0.00 C ATOM 1541 NH1 ARG A 106 3.140 -17.924 -1.803 1.00 0.00 N ATOM 1542 NH2 ARG A 106 1.770 -16.606 -0.517 1.00 0.00 N ATOM 0 H ARG A 106 6.021 -15.575 -5.779 1.00 0.00 H new ATOM 0 HA ARG A 106 3.296 -15.424 -5.668 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.343 -13.966 -3.950 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.666 -14.221 -3.507 1.00 0.00 H new ATOM 0 HG2 ARG A 106 4.078 -16.716 -3.677 1.00 0.00 H new ATOM 0 HG3 ARG A 106 5.777 -16.367 -3.926 1.00 0.00 H new ATOM 0 HD2 ARG A 106 5.611 -16.767 -1.604 1.00 0.00 H new ATOM 0 HD3 ARG A 106 5.679 -15.020 -1.731 1.00 0.00 H new ATOM 0 HE ARG A 106 3.582 -14.919 -0.758 1.00 0.00 H new ATOM 0 HH11 ARG A 106 4.010 -18.057 -2.319 1.00 0.00 H new ATOM 0 HH12 ARG A 106 2.453 -18.676 -1.760 1.00 0.00 H new ATOM 0 HH21 ARG A 106 1.584 -15.723 -0.042 1.00 0.00 H new ATOM 0 HH22 ARG A 106 1.085 -17.361 -0.476 1.00 0.00 H new ATOM 1556 N PHE A 107 4.508 -12.344 -5.825 1.00 0.00 N ATOM 1557 CA PHE A 107 4.192 -10.983 -6.244 1.00 0.00 C ATOM 1558 C PHE A 107 3.529 -10.977 -7.618 1.00 0.00 C ATOM 1559 O PHE A 107 2.443 -10.423 -7.793 1.00 0.00 O ATOM 1560 CB PHE A 107 5.462 -10.129 -6.274 1.00 0.00 C ATOM 1561 CG PHE A 107 5.224 -8.719 -6.734 1.00 0.00 C ATOM 1562 CD1 PHE A 107 4.628 -7.793 -5.893 1.00 0.00 C ATOM 1563 CD2 PHE A 107 5.599 -8.319 -8.006 1.00 0.00 C ATOM 1564 CE1 PHE A 107 4.408 -6.495 -6.314 1.00 0.00 C ATOM 1565 CE2 PHE A 107 5.382 -7.023 -8.433 1.00 0.00 C ATOM 1566 CZ PHE A 107 4.786 -6.109 -7.585 1.00 0.00 C ATOM 0 H PHE A 107 5.414 -12.445 -5.367 1.00 0.00 H new ATOM 0 HA PHE A 107 3.494 -10.559 -5.522 1.00 0.00 H new ATOM 0 HB2 PHE A 107 5.900 -10.108 -5.276 1.00 0.00 H new ATOM 0 HB3 PHE A 107 6.192 -10.600 -6.933 1.00 0.00 H new ATOM 0 HD1 PHE A 107 4.332 -8.089 -4.897 1.00 0.00 H new ATOM 0 HD2 PHE A 107 6.067 -9.029 -8.672 1.00 0.00 H new ATOM 0 HE1 PHE A 107 3.941 -5.783 -5.650 1.00 0.00 H new ATOM 0 HE2 PHE A 107 5.678 -6.725 -9.428 1.00 0.00 H new ATOM 0 HZ PHE A 107 4.616 -5.095 -7.916 1.00 0.00 H new ATOM 1576 N LEU A 108 4.190 -11.596 -8.589 1.00 0.00 N ATOM 1577 CA LEU A 108 3.665 -11.663 -9.949 1.00 0.00 C ATOM 1578 C LEU A 108 2.266 -12.270 -9.964 1.00 0.00 C ATOM 1579 O LEU A 108 1.381 -11.801 -10.681 1.00 0.00 O ATOM 1580 CB LEU A 108 4.600 -12.485 -10.838 1.00 0.00 C ATOM 1581 CG LEU A 108 5.875 -11.781 -11.305 1.00 0.00 C ATOM 1582 CD1 LEU A 108 6.765 -12.743 -12.075 1.00 0.00 C ATOM 1583 CD2 LEU A 108 5.532 -10.569 -12.158 1.00 0.00 C ATOM 0 H LEU A 108 5.090 -12.059 -8.461 1.00 0.00 H new ATOM 0 HA LEU A 108 3.604 -10.647 -10.339 1.00 0.00 H new ATOM 0 HB2 LEU A 108 4.885 -13.386 -10.295 1.00 0.00 H new ATOM 0 HB3 LEU A 108 4.043 -12.805 -11.718 1.00 0.00 H new ATOM 0 HG LEU A 108 6.421 -11.439 -10.426 1.00 0.00 H new ATOM 0 HD11 LEU A 108 7.667 -12.224 -12.399 1.00 0.00 H new ATOM 0 HD12 LEU A 108 7.039 -13.579 -11.432 1.00 0.00 H new ATOM 0 HD13 LEU A 108 6.228 -13.116 -12.947 1.00 0.00 H new ATOM 0 HD21 LEU A 108 6.451 -10.080 -12.482 1.00 0.00 H new ATOM 0 HD22 LEU A 108 4.964 -10.888 -13.032 1.00 0.00 H new ATOM 0 HD23 LEU A 108 4.935 -9.869 -11.573 1.00 0.00 H new ATOM 1595 N THR A 109 2.072 -13.316 -9.167 1.00 0.00 N ATOM 1596 CA THR A 109 0.780 -13.987 -9.087 1.00 0.00 C ATOM 1597 C THR A 109 -0.248 -13.117 -8.374 1.00 0.00 C ATOM 1598 O THR A 109 -1.231 -12.683 -8.974 1.00 0.00 O ATOM 1599 CB THR A 109 0.893 -15.336 -8.353 1.00 0.00 C ATOM 1600 OG1 THR A 109 1.853 -16.172 -9.008 1.00 0.00 O ATOM 1601 CG2 THR A 109 -0.455 -16.041 -8.308 1.00 0.00 C ATOM 0 H THR A 109 2.793 -13.717 -8.568 1.00 0.00 H new ATOM 0 HA THR A 109 0.452 -14.166 -10.111 1.00 0.00 H new ATOM 0 HB THR A 109 1.219 -15.143 -7.331 1.00 0.00 H new ATOM 0 HG1 THR A 109 2.754 -15.818 -8.854 1.00 0.00 H new ATOM 0 HG21 THR A 109 -0.351 -16.992 -7.785 1.00 0.00 H new ATOM 0 HG22 THR A 109 -1.176 -15.415 -7.783 1.00 0.00 H new ATOM 0 HG23 THR A 109 -0.805 -16.222 -9.324 1.00 0.00 H new ATOM 1609 N MET A 110 -0.015 -12.865 -7.090 1.00 0.00 N ATOM 1610 CA MET A 110 -0.922 -12.045 -6.295 1.00 0.00 C ATOM 1611 C MET A 110 -1.254 -10.744 -7.019 1.00 0.00 C ATOM 1612 O MET A 110 -2.408 -10.315 -7.046 1.00 0.00 O ATOM 1613 CB MET A 110 -0.303 -11.739 -4.930 1.00 0.00 C ATOM 1614 CG MET A 110 0.934 -10.858 -5.007 1.00 0.00 C ATOM 1615 SD MET A 110 1.641 -10.509 -3.386 1.00 0.00 S ATOM 1616 CE MET A 110 2.352 -8.890 -3.668 1.00 0.00 C ATOM 0 H MET A 110 0.794 -13.217 -6.578 1.00 0.00 H new ATOM 0 HA MET A 110 -1.846 -12.605 -6.150 1.00 0.00 H new ATOM 0 HB2 MET A 110 -1.049 -11.250 -4.303 1.00 0.00 H new ATOM 0 HB3 MET A 110 -0.041 -12.677 -4.441 1.00 0.00 H new ATOM 0 HG2 MET A 110 1.685 -11.346 -5.629 1.00 0.00 H new ATOM 0 HG3 MET A 110 0.676 -9.919 -5.496 1.00 0.00 H new ATOM 0 HE1 MET A 110 3.406 -8.902 -3.389 1.00 0.00 H new ATOM 0 HE2 MET A 110 2.259 -8.630 -4.722 1.00 0.00 H new ATOM 0 HE3 MET A 110 1.825 -8.151 -3.064 1.00 0.00 H new ATOM 1626 N CYS A 111 -0.236 -10.122 -7.604 1.00 0.00 N ATOM 1627 CA CYS A 111 -0.421 -8.869 -8.328 1.00 0.00 C ATOM 1628 C CYS A 111 -1.534 -8.997 -9.362 1.00 0.00 C ATOM 1629 O CYS A 111 -2.532 -8.280 -9.306 1.00 0.00 O ATOM 1630 CB CYS A 111 0.883 -8.455 -9.012 1.00 0.00 C ATOM 1631 SG CYS A 111 2.054 -7.613 -7.922 1.00 0.00 S ATOM 0 H CYS A 111 0.725 -10.464 -7.591 1.00 0.00 H new ATOM 0 HA CYS A 111 -0.706 -8.101 -7.609 1.00 0.00 H new ATOM 0 HB2 CYS A 111 1.362 -9.343 -9.425 1.00 0.00 H new ATOM 0 HB3 CYS A 111 0.648 -7.800 -9.851 1.00 0.00 H new ATOM 0 HG CYS A 111 3.153 -7.369 -8.572 1.00 0.00 H new ATOM 1637 N ASN A 112 -1.355 -9.914 -10.306 1.00 0.00 N ATOM 1638 CA ASN A 112 -2.344 -10.135 -11.355 1.00 0.00 C ATOM 1639 C ASN A 112 -3.760 -10.031 -10.798 1.00 0.00 C ATOM 1640 O ASN A 112 -4.651 -9.472 -11.439 1.00 0.00 O ATOM 1641 CB ASN A 112 -2.137 -11.507 -11.999 1.00 0.00 C ATOM 1642 CG ASN A 112 -3.193 -11.822 -13.041 1.00 0.00 C ATOM 1643 OD1 ASN A 112 -2.948 -11.715 -14.242 1.00 0.00 O ATOM 1644 ND2 ASN A 112 -4.377 -12.214 -12.583 1.00 0.00 N ATOM 0 H ASN A 112 -0.534 -10.517 -10.367 1.00 0.00 H new ATOM 0 HA ASN A 112 -2.213 -9.362 -12.112 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -1.151 -11.543 -12.463 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -2.153 -12.275 -11.225 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -5.127 -12.440 -13.236 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -4.536 -12.289 -11.578 1.00 0.00 H new ATOM 1651 N ARG A 113 -3.960 -10.571 -9.601 1.00 0.00 N ATOM 1652 CA ARG A 113 -5.268 -10.540 -8.957 1.00 0.00 C ATOM 1653 C ARG A 113 -5.813 -9.115 -8.902 1.00 0.00 C ATOM 1654 O ARG A 113 -6.989 -8.878 -9.179 1.00 0.00 O ATOM 1655 CB ARG A 113 -5.179 -11.118 -7.544 1.00 0.00 C ATOM 1656 CG ARG A 113 -6.451 -11.816 -7.090 1.00 0.00 C ATOM 1657 CD ARG A 113 -7.557 -10.817 -6.788 1.00 0.00 C ATOM 1658 NE ARG A 113 -8.771 -11.472 -6.310 1.00 0.00 N ATOM 1659 CZ ARG A 113 -9.000 -11.755 -5.032 1.00 0.00 C ATOM 1660 NH1 ARG A 113 -8.102 -11.441 -4.109 1.00 0.00 N ATOM 1661 NH2 ARG A 113 -10.130 -12.353 -4.676 1.00 0.00 N ATOM 0 H ARG A 113 -3.233 -11.036 -9.057 1.00 0.00 H new ATOM 0 HA ARG A 113 -5.951 -11.150 -9.549 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -4.351 -11.826 -7.502 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -4.947 -10.314 -6.846 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -6.785 -12.507 -7.864 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -6.243 -12.411 -6.200 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -7.209 -10.107 -6.038 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -7.784 -10.245 -7.688 1.00 0.00 H new ATOM 0 HE ARG A 113 -9.483 -11.726 -6.995 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -7.233 -10.981 -4.379 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -8.280 -11.659 -3.129 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -10.823 -12.596 -5.384 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -10.305 -12.570 -3.695 1.00 0.00 H new ATOM 1675 N HIS A 114 -4.949 -8.171 -8.542 1.00 0.00 N ATOM 1676 CA HIS A 114 -5.344 -6.770 -8.450 1.00 0.00 C ATOM 1677 C HIS A 114 -4.996 -6.022 -9.734 1.00 0.00 C ATOM 1678 O HIS A 114 -5.882 -5.599 -10.477 1.00 0.00 O ATOM 1679 CB HIS A 114 -4.659 -6.103 -7.256 1.00 0.00 C ATOM 1680 CG HIS A 114 -5.167 -6.580 -5.931 1.00 0.00 C ATOM 1681 ND1 HIS A 114 -5.122 -5.812 -4.787 1.00 0.00 N ATOM 1682 CD2 HIS A 114 -5.734 -7.756 -5.572 1.00 0.00 C ATOM 1683 CE1 HIS A 114 -5.638 -6.495 -3.780 1.00 0.00 C ATOM 1684 NE2 HIS A 114 -6.017 -7.678 -4.230 1.00 0.00 N ATOM 0 H HIS A 114 -3.972 -8.350 -8.310 1.00 0.00 H new ATOM 0 HA HIS A 114 -6.424 -6.731 -8.309 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -3.586 -6.289 -7.313 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -4.800 -5.024 -7.323 1.00 0.00 H new ATOM 0 HD1 HIS A 114 -4.749 -4.865 -4.727 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -5.928 -8.598 -6.220 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -5.734 -6.146 -2.763 1.00 0.00 H new ATOM 1692 N PHE A 115 -3.701 -5.863 -9.988 1.00 0.00 N ATOM 1693 CA PHE A 115 -3.237 -5.166 -11.181 1.00 0.00 C ATOM 1694 C PHE A 115 -3.605 -5.941 -12.443 1.00 0.00 C ATOM 1695 O PHE A 115 -4.441 -5.504 -13.232 1.00 0.00 O ATOM 1696 CB PHE A 115 -1.722 -4.959 -11.120 1.00 0.00 C ATOM 1697 CG PHE A 115 -1.215 -4.646 -9.741 1.00 0.00 C ATOM 1698 CD1 PHE A 115 -0.896 -5.665 -8.858 1.00 0.00 C ATOM 1699 CD2 PHE A 115 -1.058 -3.333 -9.328 1.00 0.00 C ATOM 1700 CE1 PHE A 115 -0.429 -5.380 -7.588 1.00 0.00 C ATOM 1701 CE2 PHE A 115 -0.591 -3.042 -8.060 1.00 0.00 C ATOM 1702 CZ PHE A 115 -0.278 -4.067 -7.188 1.00 0.00 C ATOM 0 H PHE A 115 -2.955 -6.207 -9.384 1.00 0.00 H new ATOM 0 HA PHE A 115 -3.729 -4.194 -11.217 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -1.225 -5.858 -11.486 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -1.447 -4.147 -11.793 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -1.013 -6.694 -9.165 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -1.303 -2.528 -10.004 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -0.183 -6.183 -6.910 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -0.471 -2.014 -7.751 1.00 0.00 H new ATOM 0 HZ PHE A 115 0.084 -3.842 -6.196 1.00 0.00 H new ATOM 1712 N GLY A 116 -2.972 -7.096 -12.626 1.00 0.00 N ATOM 1713 CA GLY A 116 -3.245 -7.915 -13.793 1.00 0.00 C ATOM 1714 C GLY A 116 -2.002 -8.599 -14.325 1.00 0.00 C ATOM 1715 O GLY A 116 -0.924 -8.487 -13.740 1.00 0.00 O ATOM 0 H GLY A 116 -2.275 -7.479 -11.987 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -3.990 -8.669 -13.538 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -3.677 -7.293 -14.577 1.00 0.00 H new ATOM 1719 N SER A 117 -2.150 -9.313 -15.436 1.00 0.00 N ATOM 1720 CA SER A 117 -1.031 -10.024 -16.043 1.00 0.00 C ATOM 1721 C SER A 117 -0.152 -9.069 -16.844 1.00 0.00 C ATOM 1722 O SER A 117 1.071 -9.063 -16.699 1.00 0.00 O ATOM 1723 CB SER A 117 -1.543 -11.145 -16.950 1.00 0.00 C ATOM 1724 OG SER A 117 -2.431 -10.641 -17.932 1.00 0.00 O ATOM 0 H SER A 117 -3.034 -9.415 -15.934 1.00 0.00 H new ATOM 0 HA SER A 117 -0.432 -10.459 -15.243 1.00 0.00 H new ATOM 0 HB2 SER A 117 -0.701 -11.638 -17.436 1.00 0.00 H new ATOM 0 HB3 SER A 117 -2.051 -11.900 -16.349 1.00 0.00 H new ATOM 0 HG SER A 117 -2.743 -11.377 -18.500 1.00 0.00 H new ATOM 1730 N VAL A 118 -0.783 -8.262 -17.691 1.00 0.00 N ATOM 1731 CA VAL A 118 -0.060 -7.301 -18.515 1.00 0.00 C ATOM 1732 C VAL A 118 0.922 -6.488 -17.678 1.00 0.00 C ATOM 1733 O VAL A 118 2.114 -6.432 -17.980 1.00 0.00 O ATOM 1734 CB VAL A 118 -1.025 -6.339 -19.233 1.00 0.00 C ATOM 1735 CG1 VAL A 118 -0.251 -5.347 -20.088 1.00 0.00 C ATOM 1736 CG2 VAL A 118 -2.023 -7.118 -20.077 1.00 0.00 C ATOM 0 H VAL A 118 -1.794 -8.255 -17.824 1.00 0.00 H new ATOM 0 HA VAL A 118 0.491 -7.875 -19.261 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.580 -5.779 -18.480 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.949 -4.675 -20.588 1.00 0.00 H new ATOM 0 HG12 VAL A 118 0.420 -4.767 -19.455 1.00 0.00 H new ATOM 0 HG13 VAL A 118 0.331 -5.887 -20.835 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -2.697 -6.423 -20.577 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -1.488 -7.705 -20.823 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -2.600 -7.785 -19.436 1.00 0.00 H new ATOM 1746 N VAL A 119 0.412 -5.859 -16.624 1.00 0.00 N ATOM 1747 CA VAL A 119 1.244 -5.050 -15.741 1.00 0.00 C ATOM 1748 C VAL A 119 2.350 -5.887 -15.108 1.00 0.00 C ATOM 1749 O VAL A 119 3.515 -5.492 -15.101 1.00 0.00 O ATOM 1750 CB VAL A 119 0.408 -4.396 -14.626 1.00 0.00 C ATOM 1751 CG1 VAL A 119 -0.394 -5.446 -13.873 1.00 0.00 C ATOM 1752 CG2 VAL A 119 1.304 -3.616 -13.676 1.00 0.00 C ATOM 0 H VAL A 119 -0.573 -5.894 -16.361 1.00 0.00 H new ATOM 0 HA VAL A 119 1.691 -4.269 -16.356 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.293 -3.698 -15.084 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -0.978 -4.964 -13.089 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -1.065 -5.956 -14.564 1.00 0.00 H new ATOM 0 HG13 VAL A 119 0.286 -6.171 -13.425 1.00 0.00 H new ATOM 0 HG21 VAL A 119 0.696 -3.160 -12.894 1.00 0.00 H new ATOM 0 HG22 VAL A 119 2.030 -4.291 -13.224 1.00 0.00 H new ATOM 0 HG23 VAL A 119 1.829 -2.836 -14.228 1.00 0.00 H new ATOM 1762 N ALA A 120 1.976 -7.046 -14.576 1.00 0.00 N ATOM 1763 CA ALA A 120 2.936 -7.941 -13.942 1.00 0.00 C ATOM 1764 C ALA A 120 4.091 -8.263 -14.884 1.00 0.00 C ATOM 1765 O ALA A 120 5.253 -8.023 -14.559 1.00 0.00 O ATOM 1766 CB ALA A 120 2.247 -9.221 -13.492 1.00 0.00 C ATOM 0 H ALA A 120 1.015 -7.387 -14.572 1.00 0.00 H new ATOM 0 HA ALA A 120 3.345 -7.435 -13.068 1.00 0.00 H new ATOM 0 HB1 ALA A 120 2.976 -9.880 -13.020 1.00 0.00 H new ATOM 0 HB2 ALA A 120 1.461 -8.979 -12.777 1.00 0.00 H new ATOM 0 HB3 ALA A 120 1.810 -9.722 -14.356 1.00 0.00 H new ATOM 1772 N GLN A 121 3.763 -8.809 -16.051 1.00 0.00 N ATOM 1773 CA GLN A 121 4.774 -9.165 -17.039 1.00 0.00 C ATOM 1774 C GLN A 121 5.884 -8.119 -17.083 1.00 0.00 C ATOM 1775 O GLN A 121 7.057 -8.433 -16.880 1.00 0.00 O ATOM 1776 CB GLN A 121 4.138 -9.309 -18.422 1.00 0.00 C ATOM 1777 CG GLN A 121 5.151 -9.473 -19.544 1.00 0.00 C ATOM 1778 CD GLN A 121 5.529 -10.922 -19.781 1.00 0.00 C ATOM 1779 OE1 GLN A 121 6.549 -11.392 -19.073 1.00 0.00 O flip ATOM 1780 NE2 GLN A 121 4.910 -11.612 -20.592 1.00 0.00 N flip ATOM 0 H GLN A 121 2.805 -9.014 -16.335 1.00 0.00 H new ATOM 0 HA GLN A 121 5.211 -10.120 -16.747 1.00 0.00 H new ATOM 0 HB2 GLN A 121 3.470 -10.171 -18.418 1.00 0.00 H new ATOM 0 HB3 GLN A 121 3.524 -8.431 -18.624 1.00 0.00 H new ATOM 0 HG2 GLN A 121 4.741 -9.053 -20.463 1.00 0.00 H new ATOM 0 HG3 GLN A 121 6.048 -8.902 -19.305 1.00 0.00 H new ATOM 0 HE21 GLN A 121 4.132 -11.210 -21.115 1.00 0.00 H new ATOM 0 HE22 GLN A 121 5.175 -12.586 -20.741 1.00 0.00 H new ATOM 1789 N THR A 122 5.505 -6.873 -17.350 1.00 0.00 N ATOM 1790 CA THR A 122 6.468 -5.781 -17.423 1.00 0.00 C ATOM 1791 C THR A 122 7.435 -5.821 -16.245 1.00 0.00 C ATOM 1792 O THR A 122 8.636 -5.605 -16.409 1.00 0.00 O ATOM 1793 CB THR A 122 5.763 -4.411 -17.448 1.00 0.00 C ATOM 1794 OG1 THR A 122 4.930 -4.310 -18.608 1.00 0.00 O ATOM 1795 CG2 THR A 122 6.779 -3.280 -17.447 1.00 0.00 C ATOM 0 H THR A 122 4.538 -6.595 -17.519 1.00 0.00 H new ATOM 0 HA THR A 122 7.025 -5.912 -18.351 1.00 0.00 H new ATOM 0 HB THR A 122 5.148 -4.327 -16.552 1.00 0.00 H new ATOM 0 HG1 THR A 122 4.484 -3.437 -18.616 1.00 0.00 H new ATOM 0 HG21 THR A 122 6.258 -2.323 -17.465 1.00 0.00 H new ATOM 0 HG22 THR A 122 7.392 -3.343 -16.548 1.00 0.00 H new ATOM 0 HG23 THR A 122 7.416 -3.363 -18.327 1.00 0.00 H new ATOM 1803 N ILE A 123 6.904 -6.099 -15.059 1.00 0.00 N ATOM 1804 CA ILE A 123 7.722 -6.169 -13.855 1.00 0.00 C ATOM 1805 C ILE A 123 8.736 -7.304 -13.944 1.00 0.00 C ATOM 1806 O ILE A 123 9.887 -7.155 -13.534 1.00 0.00 O ATOM 1807 CB ILE A 123 6.855 -6.367 -12.597 1.00 0.00 C ATOM 1808 CG1 ILE A 123 5.814 -5.252 -12.488 1.00 0.00 C ATOM 1809 CG2 ILE A 123 7.729 -6.407 -11.352 1.00 0.00 C ATOM 1810 CD1 ILE A 123 6.416 -3.883 -12.256 1.00 0.00 C ATOM 0 H ILE A 123 5.912 -6.279 -14.906 1.00 0.00 H new ATOM 0 HA ILE A 123 8.251 -5.219 -13.777 1.00 0.00 H new ATOM 0 HB ILE A 123 6.332 -7.320 -12.681 1.00 0.00 H new ATOM 0 HG12 ILE A 123 5.221 -5.229 -13.402 1.00 0.00 H new ATOM 0 HG13 ILE A 123 5.131 -5.483 -11.671 1.00 0.00 H new ATOM 0 HG21 ILE A 123 7.102 -6.547 -10.472 1.00 0.00 H new ATOM 0 HG22 ILE A 123 8.435 -7.233 -11.430 1.00 0.00 H new ATOM 0 HG23 ILE A 123 8.277 -5.469 -11.262 1.00 0.00 H new ATOM 0 HD11 ILE A 123 5.620 -3.142 -12.189 1.00 0.00 H new ATOM 0 HD12 ILE A 123 6.985 -3.889 -11.327 1.00 0.00 H new ATOM 0 HD13 ILE A 123 7.077 -3.631 -13.085 1.00 0.00 H new ATOM 1822 N ARG A 124 8.301 -8.438 -14.484 1.00 0.00 N ATOM 1823 CA ARG A 124 9.171 -9.599 -14.628 1.00 0.00 C ATOM 1824 C ARG A 124 10.291 -9.319 -15.625 1.00 0.00 C ATOM 1825 O ARG A 124 11.385 -9.874 -15.520 1.00 0.00 O ATOM 1826 CB ARG A 124 8.362 -10.816 -15.081 1.00 0.00 C ATOM 1827 CG ARG A 124 9.217 -12.034 -15.390 1.00 0.00 C ATOM 1828 CD ARG A 124 9.637 -12.065 -16.851 1.00 0.00 C ATOM 1829 NE ARG A 124 8.679 -12.791 -17.681 1.00 0.00 N ATOM 1830 CZ ARG A 124 9.027 -13.721 -18.562 1.00 0.00 C ATOM 1831 NH1 ARG A 124 10.304 -14.037 -18.728 1.00 0.00 N ATOM 1832 NH2 ARG A 124 8.098 -14.338 -19.280 1.00 0.00 N ATOM 0 H ARG A 124 7.351 -8.577 -14.829 1.00 0.00 H new ATOM 0 HA ARG A 124 9.618 -9.810 -13.656 1.00 0.00 H new ATOM 0 HB2 ARG A 124 7.644 -11.075 -14.303 1.00 0.00 H new ATOM 0 HB3 ARG A 124 7.788 -10.550 -15.969 1.00 0.00 H new ATOM 0 HG2 ARG A 124 10.103 -12.028 -14.756 1.00 0.00 H new ATOM 0 HG3 ARG A 124 8.661 -12.940 -15.151 1.00 0.00 H new ATOM 0 HD2 ARG A 124 9.737 -11.045 -17.221 1.00 0.00 H new ATOM 0 HD3 ARG A 124 10.618 -12.533 -16.936 1.00 0.00 H new ATOM 0 HE ARG A 124 7.688 -12.571 -17.578 1.00 0.00 H new ATOM 0 HH11 ARG A 124 11.022 -13.565 -18.178 1.00 0.00 H new ATOM 0 HH12 ARG A 124 10.569 -14.752 -19.406 1.00 0.00 H new ATOM 0 HH21 ARG A 124 7.114 -14.098 -19.156 1.00 0.00 H new ATOM 0 HH22 ARG A 124 8.367 -15.052 -19.957 1.00 0.00 H new ATOM 1846 N THR A 125 10.010 -8.453 -16.595 1.00 0.00 N ATOM 1847 CA THR A 125 10.992 -8.100 -17.612 1.00 0.00 C ATOM 1848 C THR A 125 11.962 -7.042 -17.097 1.00 0.00 C ATOM 1849 O THR A 125 12.810 -6.551 -17.841 1.00 0.00 O ATOM 1850 CB THR A 125 10.313 -7.577 -18.892 1.00 0.00 C ATOM 1851 OG1 THR A 125 9.549 -6.403 -18.596 1.00 0.00 O ATOM 1852 CG2 THR A 125 9.406 -8.639 -19.495 1.00 0.00 C ATOM 0 H THR A 125 9.110 -7.984 -16.697 1.00 0.00 H new ATOM 0 HA THR A 125 11.543 -9.011 -17.848 1.00 0.00 H new ATOM 0 HB THR A 125 11.090 -7.332 -19.615 1.00 0.00 H new ATOM 0 HG1 THR A 125 9.493 -6.285 -17.625 1.00 0.00 H new ATOM 0 HG21 THR A 125 8.937 -8.247 -20.398 1.00 0.00 H new ATOM 0 HG22 THR A 125 9.995 -9.521 -19.746 1.00 0.00 H new ATOM 0 HG23 THR A 125 8.635 -8.911 -18.774 1.00 0.00 H new ATOM 1860 N GLN A 126 11.831 -6.698 -15.820 1.00 0.00 N ATOM 1861 CA GLN A 126 12.696 -5.698 -15.206 1.00 0.00 C ATOM 1862 C GLN A 126 14.000 -6.327 -14.726 1.00 0.00 C ATOM 1863 O GLN A 126 14.015 -7.087 -13.756 1.00 0.00 O ATOM 1864 CB GLN A 126 11.980 -5.022 -14.036 1.00 0.00 C ATOM 1865 CG GLN A 126 10.801 -4.161 -14.459 1.00 0.00 C ATOM 1866 CD GLN A 126 11.231 -2.834 -15.052 1.00 0.00 C ATOM 1867 OE1 GLN A 126 12.421 -2.584 -15.246 1.00 0.00 O ATOM 1868 NE2 GLN A 126 10.262 -1.974 -15.342 1.00 0.00 N ATOM 0 H GLN A 126 11.134 -7.097 -15.191 1.00 0.00 H new ATOM 0 HA GLN A 126 12.932 -4.947 -15.960 1.00 0.00 H new ATOM 0 HB2 GLN A 126 11.630 -5.788 -13.344 1.00 0.00 H new ATOM 0 HB3 GLN A 126 12.694 -4.404 -13.492 1.00 0.00 H new ATOM 0 HG2 GLN A 126 10.203 -4.705 -15.190 1.00 0.00 H new ATOM 0 HG3 GLN A 126 10.161 -3.979 -13.596 1.00 0.00 H new ATOM 0 HE21 GLN A 126 9.289 -2.223 -15.165 1.00 0.00 H new ATOM 0 HE22 GLN A 126 10.491 -1.064 -15.742 1.00 0.00 H new ATOM 1877 N LYS A 127 15.093 -6.008 -15.410 1.00 0.00 N ATOM 1878 CA LYS A 127 16.403 -6.541 -15.053 1.00 0.00 C ATOM 1879 C LYS A 127 16.713 -6.283 -13.582 1.00 0.00 C ATOM 1880 O LYS A 127 15.998 -5.542 -12.906 1.00 0.00 O ATOM 1881 CB LYS A 127 17.488 -5.914 -15.932 1.00 0.00 C ATOM 1882 CG LYS A 127 17.523 -6.471 -17.344 1.00 0.00 C ATOM 1883 CD LYS A 127 18.469 -7.655 -17.453 1.00 0.00 C ATOM 1884 CE LYS A 127 17.758 -8.965 -17.153 1.00 0.00 C ATOM 1885 NZ LYS A 127 17.835 -9.319 -15.708 1.00 0.00 N ATOM 0 H LYS A 127 15.098 -5.382 -16.216 1.00 0.00 H new ATOM 0 HA LYS A 127 16.387 -7.618 -15.219 1.00 0.00 H new ATOM 0 HB2 LYS A 127 17.328 -4.837 -15.979 1.00 0.00 H new ATOM 0 HB3 LYS A 127 18.460 -6.072 -15.464 1.00 0.00 H new ATOM 0 HG2 LYS A 127 16.520 -6.777 -17.640 1.00 0.00 H new ATOM 0 HG3 LYS A 127 17.835 -5.690 -18.037 1.00 0.00 H new ATOM 0 HD2 LYS A 127 18.894 -7.692 -18.456 1.00 0.00 H new ATOM 0 HD3 LYS A 127 19.300 -7.523 -16.760 1.00 0.00 H new ATOM 0 HE2 LYS A 127 16.713 -8.888 -17.453 1.00 0.00 H new ATOM 0 HE3 LYS A 127 18.202 -9.764 -17.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 18.433 -10.162 -15.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 18.246 -8.525 -15.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 16.880 -9.518 -15.348 1.00 0.00 H new ATOM 1899 N THR A 128 17.784 -6.898 -13.091 1.00 0.00 N ATOM 1900 CA THR A 128 18.189 -6.734 -11.700 1.00 0.00 C ATOM 1901 C THR A 128 18.513 -5.277 -11.390 1.00 0.00 C ATOM 1902 O THR A 128 17.813 -4.628 -10.611 1.00 0.00 O ATOM 1903 CB THR A 128 19.416 -7.603 -11.367 1.00 0.00 C ATOM 1904 OG1 THR A 128 19.161 -8.967 -11.720 1.00 0.00 O ATOM 1905 CG2 THR A 128 19.757 -7.512 -9.887 1.00 0.00 C ATOM 0 H THR A 128 18.387 -7.514 -13.636 1.00 0.00 H new ATOM 0 HA THR A 128 17.348 -7.055 -11.085 1.00 0.00 H new ATOM 0 HB THR A 128 20.264 -7.232 -11.943 1.00 0.00 H new ATOM 0 HG1 THR A 128 19.947 -9.512 -11.507 1.00 0.00 H new ATOM 0 HG21 THR A 128 20.627 -8.134 -9.675 1.00 0.00 H new ATOM 0 HG22 THR A 128 19.979 -6.477 -9.628 1.00 0.00 H new ATOM 0 HG23 THR A 128 18.910 -7.860 -9.296 1.00 0.00 H new ATOM 1913 N ASP A 129 19.576 -4.769 -12.003 1.00 0.00 N ATOM 1914 CA ASP A 129 19.991 -3.387 -11.793 1.00 0.00 C ATOM 1915 C ASP A 129 18.780 -2.469 -11.664 1.00 0.00 C ATOM 1916 O ASP A 129 18.683 -1.682 -10.723 1.00 0.00 O ATOM 1917 CB ASP A 129 20.882 -2.919 -12.945 1.00 0.00 C ATOM 1918 CG ASP A 129 21.677 -4.053 -13.560 1.00 0.00 C ATOM 1919 OD1 ASP A 129 22.313 -4.812 -12.799 1.00 0.00 O ATOM 1920 OD2 ASP A 129 21.664 -4.183 -14.802 1.00 0.00 O ATOM 0 H ASP A 129 20.166 -5.293 -12.649 1.00 0.00 H new ATOM 0 HA ASP A 129 20.559 -3.341 -10.864 1.00 0.00 H new ATOM 0 HB2 ASP A 129 20.264 -2.455 -13.713 1.00 0.00 H new ATOM 0 HB3 ASP A 129 21.568 -2.154 -12.582 1.00 0.00 H new ATOM 1925 N GLN A 130 17.860 -2.575 -12.618 1.00 0.00 N ATOM 1926 CA GLN A 130 16.656 -1.752 -12.611 1.00 0.00 C ATOM 1927 C GLN A 130 16.149 -1.540 -11.189 1.00 0.00 C ATOM 1928 O GLN A 130 15.960 -0.405 -10.749 1.00 0.00 O ATOM 1929 CB GLN A 130 15.564 -2.403 -13.462 1.00 0.00 C ATOM 1930 CG GLN A 130 15.933 -2.532 -14.931 1.00 0.00 C ATOM 1931 CD GLN A 130 16.265 -1.198 -15.569 1.00 0.00 C ATOM 1932 OE1 GLN A 130 17.406 -0.949 -15.957 1.00 0.00 O ATOM 1933 NE2 GLN A 130 15.266 -0.330 -15.681 1.00 0.00 N ATOM 0 H GLN A 130 17.925 -3.222 -13.404 1.00 0.00 H new ATOM 0 HA GLN A 130 16.908 -0.780 -13.036 1.00 0.00 H new ATOM 0 HB2 GLN A 130 15.346 -3.393 -13.063 1.00 0.00 H new ATOM 0 HB3 GLN A 130 14.650 -1.816 -13.376 1.00 0.00 H new ATOM 0 HG2 GLN A 130 16.788 -3.200 -15.029 1.00 0.00 H new ATOM 0 HG3 GLN A 130 15.105 -2.992 -15.470 1.00 0.00 H new ATOM 0 HE21 GLN A 130 14.335 -0.578 -15.346 1.00 0.00 H new ATOM 0 HE22 GLN A 130 15.430 0.584 -16.102 1.00 0.00 H new ATOM 1942 N PHE A 131 15.930 -2.638 -10.473 1.00 0.00 N ATOM 1943 CA PHE A 131 15.444 -2.572 -9.100 1.00 0.00 C ATOM 1944 C PHE A 131 16.315 -1.643 -8.259 1.00 0.00 C ATOM 1945 O PHE A 131 17.490 -1.420 -8.550 1.00 0.00 O ATOM 1946 CB PHE A 131 15.419 -3.969 -8.477 1.00 0.00 C ATOM 1947 CG PHE A 131 14.332 -4.850 -9.024 1.00 0.00 C ATOM 1948 CD1 PHE A 131 14.561 -5.646 -10.134 1.00 0.00 C ATOM 1949 CD2 PHE A 131 13.083 -4.882 -8.427 1.00 0.00 C ATOM 1950 CE1 PHE A 131 13.562 -6.457 -10.640 1.00 0.00 C ATOM 1951 CE2 PHE A 131 12.080 -5.691 -8.927 1.00 0.00 C ATOM 1952 CZ PHE A 131 12.320 -6.480 -10.035 1.00 0.00 C ATOM 0 H PHE A 131 16.082 -3.585 -10.821 1.00 0.00 H new ATOM 0 HA PHE A 131 14.430 -2.173 -9.119 1.00 0.00 H new ATOM 0 HB2 PHE A 131 16.383 -4.449 -8.643 1.00 0.00 H new ATOM 0 HB3 PHE A 131 15.291 -3.875 -7.399 1.00 0.00 H new ATOM 0 HD1 PHE A 131 15.531 -5.633 -10.610 1.00 0.00 H new ATOM 0 HD2 PHE A 131 12.890 -4.267 -7.560 1.00 0.00 H new ATOM 0 HE1 PHE A 131 13.752 -7.072 -11.507 1.00 0.00 H new ATOM 0 HE2 PHE A 131 11.110 -5.706 -8.452 1.00 0.00 H new ATOM 0 HZ PHE A 131 11.538 -7.114 -10.428 1.00 0.00 H new ATOM 1962 N PRO A 132 15.726 -1.087 -7.190 1.00 0.00 N ATOM 1963 CA PRO A 132 14.327 -1.345 -6.834 1.00 0.00 C ATOM 1964 C PRO A 132 13.352 -0.714 -7.822 1.00 0.00 C ATOM 1965 O PRO A 132 13.761 -0.116 -8.818 1.00 0.00 O ATOM 1966 CB PRO A 132 14.187 -0.695 -5.455 1.00 0.00 C ATOM 1967 CG PRO A 132 15.234 0.364 -5.427 1.00 0.00 C ATOM 1968 CD PRO A 132 16.379 -0.164 -6.247 1.00 0.00 C ATOM 0 HA PRO A 132 14.093 -2.410 -6.845 1.00 0.00 H new ATOM 0 HB2 PRO A 132 13.192 -0.272 -5.316 1.00 0.00 H new ATOM 0 HB3 PRO A 132 14.338 -1.422 -4.657 1.00 0.00 H new ATOM 0 HG2 PRO A 132 14.855 1.298 -5.842 1.00 0.00 H new ATOM 0 HG3 PRO A 132 15.550 0.574 -4.405 1.00 0.00 H new ATOM 0 HD2 PRO A 132 16.904 0.637 -6.767 1.00 0.00 H new ATOM 0 HD3 PRO A 132 17.114 -0.677 -5.627 1.00 0.00 H new ATOM 1976 N LEU A 133 12.061 -0.851 -7.541 1.00 0.00 N ATOM 1977 CA LEU A 133 11.026 -0.293 -8.405 1.00 0.00 C ATOM 1978 C LEU A 133 9.858 0.239 -7.582 1.00 0.00 C ATOM 1979 O LEU A 133 9.047 -0.530 -7.065 1.00 0.00 O ATOM 1980 CB LEU A 133 10.530 -1.354 -9.389 1.00 0.00 C ATOM 1981 CG LEU A 133 11.555 -1.859 -10.405 1.00 0.00 C ATOM 1982 CD1 LEU A 133 11.037 -3.100 -11.115 1.00 0.00 C ATOM 1983 CD2 LEU A 133 11.892 -0.767 -11.411 1.00 0.00 C ATOM 0 H LEU A 133 11.706 -1.344 -6.722 1.00 0.00 H new ATOM 0 HA LEU A 133 11.461 0.537 -8.963 1.00 0.00 H new ATOM 0 HB2 LEU A 133 10.163 -2.207 -8.818 1.00 0.00 H new ATOM 0 HB3 LEU A 133 9.679 -0.946 -9.934 1.00 0.00 H new ATOM 0 HG LEU A 133 12.467 -2.126 -9.870 1.00 0.00 H new ATOM 0 HD11 LEU A 133 11.780 -3.445 -11.834 1.00 0.00 H new ATOM 0 HD12 LEU A 133 10.848 -3.886 -10.383 1.00 0.00 H new ATOM 0 HD13 LEU A 133 10.111 -2.860 -11.637 1.00 0.00 H new ATOM 0 HD21 LEU A 133 12.623 -1.144 -12.126 1.00 0.00 H new ATOM 0 HD22 LEU A 133 10.987 -0.468 -11.940 1.00 0.00 H new ATOM 0 HD23 LEU A 133 12.308 0.094 -10.888 1.00 0.00 H new ATOM 1995 N PHE A 134 9.776 1.560 -7.466 1.00 0.00 N ATOM 1996 CA PHE A 134 8.706 2.196 -6.707 1.00 0.00 C ATOM 1997 C PHE A 134 7.512 2.508 -7.605 1.00 0.00 C ATOM 1998 O PHE A 134 7.628 3.265 -8.570 1.00 0.00 O ATOM 1999 CB PHE A 134 9.212 3.482 -6.048 1.00 0.00 C ATOM 2000 CG PHE A 134 8.457 3.856 -4.805 1.00 0.00 C ATOM 2001 CD1 PHE A 134 7.153 4.316 -4.883 1.00 0.00 C ATOM 2002 CD2 PHE A 134 9.052 3.748 -3.559 1.00 0.00 C ATOM 2003 CE1 PHE A 134 6.456 4.663 -3.741 1.00 0.00 C ATOM 2004 CE2 PHE A 134 8.360 4.092 -2.412 1.00 0.00 C ATOM 2005 CZ PHE A 134 7.060 4.549 -2.504 1.00 0.00 C ATOM 0 H PHE A 134 10.438 2.211 -7.888 1.00 0.00 H new ATOM 0 HA PHE A 134 8.384 1.501 -5.932 1.00 0.00 H new ATOM 0 HB2 PHE A 134 10.267 3.363 -5.801 1.00 0.00 H new ATOM 0 HB3 PHE A 134 9.143 4.300 -6.765 1.00 0.00 H new ATOM 0 HD1 PHE A 134 6.675 4.405 -5.847 1.00 0.00 H new ATOM 0 HD2 PHE A 134 10.068 3.391 -3.482 1.00 0.00 H new ATOM 0 HE1 PHE A 134 5.440 5.023 -3.816 1.00 0.00 H new ATOM 0 HE2 PHE A 134 8.835 4.003 -1.446 1.00 0.00 H new ATOM 0 HZ PHE A 134 6.516 4.817 -1.610 1.00 0.00 H new ATOM 2015 N LEU A 135 6.366 1.919 -7.282 1.00 0.00 N ATOM 2016 CA LEU A 135 5.151 2.132 -8.059 1.00 0.00 C ATOM 2017 C LEU A 135 4.100 2.870 -7.236 1.00 0.00 C ATOM 2018 O LEU A 135 4.010 2.689 -6.021 1.00 0.00 O ATOM 2019 CB LEU A 135 4.589 0.794 -8.542 1.00 0.00 C ATOM 2020 CG LEU A 135 5.486 -0.009 -9.485 1.00 0.00 C ATOM 2021 CD1 LEU A 135 6.391 -0.942 -8.696 1.00 0.00 C ATOM 2022 CD2 LEU A 135 4.645 -0.795 -10.481 1.00 0.00 C ATOM 0 H LEU A 135 6.253 1.290 -6.487 1.00 0.00 H new ATOM 0 HA LEU A 135 5.406 2.745 -8.923 1.00 0.00 H new ATOM 0 HB2 LEU A 135 4.370 0.179 -7.670 1.00 0.00 H new ATOM 0 HB3 LEU A 135 3.641 0.982 -9.046 1.00 0.00 H new ATOM 0 HG LEU A 135 6.113 0.689 -10.040 1.00 0.00 H new ATOM 0 HD11 LEU A 135 7.022 -1.505 -9.384 1.00 0.00 H new ATOM 0 HD12 LEU A 135 7.019 -0.357 -8.024 1.00 0.00 H new ATOM 0 HD13 LEU A 135 5.782 -1.634 -8.114 1.00 0.00 H new ATOM 0 HD21 LEU A 135 5.300 -1.360 -11.144 1.00 0.00 H new ATOM 0 HD22 LEU A 135 3.992 -1.482 -9.943 1.00 0.00 H new ATOM 0 HD23 LEU A 135 4.040 -0.106 -11.070 1.00 0.00 H new ATOM 2034 N ILE A 136 3.307 3.700 -7.904 1.00 0.00 N ATOM 2035 CA ILE A 136 2.260 4.462 -7.234 1.00 0.00 C ATOM 2036 C ILE A 136 0.877 4.034 -7.713 1.00 0.00 C ATOM 2037 O ILE A 136 0.605 4.006 -8.914 1.00 0.00 O ATOM 2038 CB ILE A 136 2.427 5.975 -7.469 1.00 0.00 C ATOM 2039 CG1 ILE A 136 3.775 6.452 -6.925 1.00 0.00 C ATOM 2040 CG2 ILE A 136 1.285 6.741 -6.818 1.00 0.00 C ATOM 2041 CD1 ILE A 136 4.225 7.776 -7.502 1.00 0.00 C ATOM 0 H ILE A 136 3.369 3.862 -8.909 1.00 0.00 H new ATOM 0 HA ILE A 136 2.353 4.256 -6.168 1.00 0.00 H new ATOM 0 HB ILE A 136 2.402 6.166 -8.542 1.00 0.00 H new ATOM 0 HG12 ILE A 136 3.709 6.541 -5.841 1.00 0.00 H new ATOM 0 HG13 ILE A 136 4.531 5.696 -7.137 1.00 0.00 H new ATOM 0 HG21 ILE A 136 1.417 7.809 -6.993 1.00 0.00 H new ATOM 0 HG22 ILE A 136 0.338 6.417 -7.249 1.00 0.00 H new ATOM 0 HG23 ILE A 136 1.281 6.547 -5.745 1.00 0.00 H new ATOM 0 HD11 ILE A 136 5.188 8.052 -7.072 1.00 0.00 H new ATOM 0 HD12 ILE A 136 4.324 7.687 -8.584 1.00 0.00 H new ATOM 0 HD13 ILE A 136 3.489 8.544 -7.267 1.00 0.00 H new ATOM 2053 N ILE A 137 0.005 3.703 -6.766 1.00 0.00 N ATOM 2054 CA ILE A 137 -1.351 3.280 -7.090 1.00 0.00 C ATOM 2055 C ILE A 137 -2.383 4.179 -6.419 1.00 0.00 C ATOM 2056 O ILE A 137 -2.264 4.502 -5.237 1.00 0.00 O ATOM 2057 CB ILE A 137 -1.603 1.821 -6.665 1.00 0.00 C ATOM 2058 CG1 ILE A 137 -0.607 0.886 -7.354 1.00 0.00 C ATOM 2059 CG2 ILE A 137 -3.032 1.413 -6.989 1.00 0.00 C ATOM 2060 CD1 ILE A 137 0.718 0.775 -6.632 1.00 0.00 C ATOM 0 H ILE A 137 0.214 3.720 -5.768 1.00 0.00 H new ATOM 0 HA ILE A 137 -1.455 3.357 -8.172 1.00 0.00 H new ATOM 0 HB ILE A 137 -1.460 1.743 -5.587 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -1.050 -0.106 -7.437 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -0.430 1.242 -8.369 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -3.194 0.380 -6.683 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -3.726 2.063 -6.455 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -3.202 1.504 -8.062 1.00 0.00 H new ATOM 0 HD11 ILE A 137 1.374 0.096 -7.177 1.00 0.00 H new ATOM 0 HD12 ILE A 137 1.183 1.759 -6.572 1.00 0.00 H new ATOM 0 HD13 ILE A 137 0.553 0.390 -5.626 1.00 0.00 H new ATOM 2072 N MET A 138 -3.397 4.577 -7.180 1.00 0.00 N ATOM 2073 CA MET A 138 -4.453 5.437 -6.657 1.00 0.00 C ATOM 2074 C MET A 138 -5.801 4.723 -6.688 1.00 0.00 C ATOM 2075 O MET A 138 -6.655 4.951 -5.832 1.00 0.00 O ATOM 2076 CB MET A 138 -4.530 6.734 -7.464 1.00 0.00 C ATOM 2077 CG MET A 138 -5.551 6.690 -8.589 1.00 0.00 C ATOM 2078 SD MET A 138 -5.752 8.283 -9.408 1.00 0.00 S ATOM 2079 CE MET A 138 -6.644 7.796 -10.883 1.00 0.00 C ATOM 0 H MET A 138 -3.510 4.318 -8.160 1.00 0.00 H new ATOM 0 HA MET A 138 -4.213 5.676 -5.621 1.00 0.00 H new ATOM 0 HB2 MET A 138 -4.777 7.556 -6.792 1.00 0.00 H new ATOM 0 HB3 MET A 138 -3.548 6.950 -7.884 1.00 0.00 H new ATOM 0 HG2 MET A 138 -5.245 5.945 -9.323 1.00 0.00 H new ATOM 0 HG3 MET A 138 -6.512 6.368 -8.189 1.00 0.00 H new ATOM 0 HE1 MET A 138 -6.079 8.096 -11.766 1.00 0.00 H new ATOM 0 HE2 MET A 138 -6.776 6.714 -10.888 1.00 0.00 H new ATOM 0 HE3 MET A 138 -7.620 8.281 -10.895 1.00 0.00 H new ATOM 2164 N ASN A 144 -7.547 -1.037 -9.823 1.00 0.00 N ATOM 2165 CA ASN A 144 -6.207 -0.640 -9.407 1.00 0.00 C ATOM 2166 C ASN A 144 -5.290 -0.470 -10.615 1.00 0.00 C ATOM 2167 O ASN A 144 -5.289 -1.298 -11.526 1.00 0.00 O ATOM 2168 CB ASN A 144 -5.620 -1.677 -8.448 1.00 0.00 C ATOM 2169 CG ASN A 144 -6.655 -2.226 -7.485 1.00 0.00 C ATOM 2170 OD1 ASN A 144 -7.629 -2.857 -7.897 1.00 0.00 O ATOM 2171 ND2 ASN A 144 -6.449 -1.987 -6.196 1.00 0.00 N ATOM 0 HA ASN A 144 -6.282 0.318 -8.893 1.00 0.00 H new ATOM 0 HB2 ASN A 144 -5.191 -2.498 -9.023 1.00 0.00 H new ATOM 0 HB3 ASN A 144 -4.805 -1.225 -7.882 1.00 0.00 H new ATOM 0 HD21 ASN A 144 -7.112 -2.331 -5.501 1.00 0.00 H new ATOM 0 HD22 ASN A 144 -5.628 -1.459 -5.900 1.00 0.00 H new ATOM 2178 N GLU A 145 -4.511 0.607 -10.613 1.00 0.00 N ATOM 2179 CA GLU A 145 -3.590 0.884 -11.708 1.00 0.00 C ATOM 2180 C GLU A 145 -2.446 1.781 -11.244 1.00 0.00 C ATOM 2181 O GLU A 145 -2.638 2.672 -10.416 1.00 0.00 O ATOM 2182 CB GLU A 145 -4.331 1.545 -12.873 1.00 0.00 C ATOM 2183 CG GLU A 145 -4.839 2.942 -12.556 1.00 0.00 C ATOM 2184 CD GLU A 145 -5.958 3.379 -13.481 1.00 0.00 C ATOM 2185 OE1 GLU A 145 -5.658 3.970 -14.539 1.00 0.00 O ATOM 2186 OE2 GLU A 145 -7.135 3.130 -13.146 1.00 0.00 O ATOM 0 H GLU A 145 -4.500 1.301 -9.866 1.00 0.00 H new ATOM 0 HA GLU A 145 -3.171 -0.064 -12.045 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -3.665 1.596 -13.734 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -5.175 0.917 -13.159 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -5.192 2.971 -11.525 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -4.014 3.650 -12.630 1.00 0.00 H new ATOM 2193 N VAL A 146 -1.255 1.539 -11.782 1.00 0.00 N ATOM 2194 CA VAL A 146 -0.080 2.324 -11.424 1.00 0.00 C ATOM 2195 C VAL A 146 -0.064 3.657 -12.162 1.00 0.00 C ATOM 2196 O VAL A 146 -0.048 3.698 -13.394 1.00 0.00 O ATOM 2197 CB VAL A 146 1.221 1.561 -11.736 1.00 0.00 C ATOM 2198 CG1 VAL A 146 1.109 0.110 -11.292 1.00 0.00 C ATOM 2199 CG2 VAL A 146 1.547 1.650 -13.219 1.00 0.00 C ATOM 0 H VAL A 146 -1.078 0.805 -12.468 1.00 0.00 H new ATOM 0 HA VAL A 146 -0.137 2.507 -10.351 1.00 0.00 H new ATOM 0 HB VAL A 146 2.036 2.024 -11.180 1.00 0.00 H new ATOM 0 HG11 VAL A 146 2.038 -0.413 -11.521 1.00 0.00 H new ATOM 0 HG12 VAL A 146 0.925 0.071 -10.218 1.00 0.00 H new ATOM 0 HG13 VAL A 146 0.284 -0.369 -11.819 1.00 0.00 H new ATOM 0 HG21 VAL A 146 2.469 1.106 -13.422 1.00 0.00 H new ATOM 0 HG22 VAL A 146 0.733 1.213 -13.797 1.00 0.00 H new ATOM 0 HG23 VAL A 146 1.673 2.695 -13.502 1.00 0.00 H new ATOM 2209 N LEU A 147 -0.069 4.748 -11.404 1.00 0.00 N ATOM 2210 CA LEU A 147 -0.054 6.085 -11.986 1.00 0.00 C ATOM 2211 C LEU A 147 1.317 6.409 -12.571 1.00 0.00 C ATOM 2212 O LEU A 147 1.422 7.077 -13.599 1.00 0.00 O ATOM 2213 CB LEU A 147 -0.430 7.126 -10.930 1.00 0.00 C ATOM 2214 CG LEU A 147 -1.896 7.143 -10.496 1.00 0.00 C ATOM 2215 CD1 LEU A 147 -2.781 7.656 -11.622 1.00 0.00 C ATOM 2216 CD2 LEU A 147 -2.338 5.754 -10.059 1.00 0.00 C ATOM 0 H LEU A 147 -0.083 4.733 -10.384 1.00 0.00 H new ATOM 0 HA LEU A 147 -0.788 6.112 -12.792 1.00 0.00 H new ATOM 0 HB2 LEU A 147 0.187 6.958 -10.047 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.174 8.113 -11.315 1.00 0.00 H new ATOM 0 HG LEU A 147 -1.996 7.819 -9.647 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -3.821 7.661 -11.294 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -2.480 8.669 -11.889 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -2.678 7.006 -12.491 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -3.384 5.784 -9.753 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -2.223 5.057 -10.889 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.724 5.424 -9.221 1.00 0.00 H new ATOM 2228 N ASN A 148 2.365 5.930 -11.909 1.00 0.00 N ATOM 2229 CA ASN A 148 3.730 6.168 -12.365 1.00 0.00 C ATOM 2230 C ASN A 148 4.628 4.979 -12.035 1.00 0.00 C ATOM 2231 O ASN A 148 4.384 4.250 -11.074 1.00 0.00 O ATOM 2232 CB ASN A 148 4.290 7.438 -11.722 1.00 0.00 C ATOM 2233 CG ASN A 148 4.017 8.676 -12.555 1.00 0.00 C ATOM 2234 OD1 ASN A 148 3.083 9.428 -12.280 1.00 0.00 O ATOM 2235 ND2 ASN A 148 4.834 8.892 -13.580 1.00 0.00 N ATOM 0 H ASN A 148 2.296 5.375 -11.056 1.00 0.00 H new ATOM 0 HA ASN A 148 3.709 6.296 -13.447 1.00 0.00 H new ATOM 0 HB2 ASN A 148 3.851 7.565 -10.732 1.00 0.00 H new ATOM 0 HB3 ASN A 148 5.365 7.327 -11.582 1.00 0.00 H new ATOM 0 HD21 ASN A 148 4.699 9.709 -14.176 1.00 0.00 H new ATOM 0 HD22 ASN A 148 5.596 8.241 -13.771 1.00 0.00 H new ATOM 2242 N VAL A 149 5.670 4.790 -12.840 1.00 0.00 N ATOM 2243 CA VAL A 149 6.606 3.692 -12.633 1.00 0.00 C ATOM 2244 C VAL A 149 8.048 4.184 -12.675 1.00 0.00 C ATOM 2245 O VAL A 149 8.576 4.500 -13.741 1.00 0.00 O ATOM 2246 CB VAL A 149 6.420 2.589 -13.693 1.00 0.00 C ATOM 2247 CG1 VAL A 149 7.454 1.489 -13.505 1.00 0.00 C ATOM 2248 CG2 VAL A 149 5.010 2.024 -13.631 1.00 0.00 C ATOM 0 H VAL A 149 5.886 5.383 -13.641 1.00 0.00 H new ATOM 0 HA VAL A 149 6.395 3.278 -11.647 1.00 0.00 H new ATOM 0 HB VAL A 149 6.567 3.028 -14.680 1.00 0.00 H new ATOM 0 HG11 VAL A 149 7.308 0.719 -14.262 1.00 0.00 H new ATOM 0 HG12 VAL A 149 8.455 1.910 -13.604 1.00 0.00 H new ATOM 0 HG13 VAL A 149 7.342 1.050 -12.514 1.00 0.00 H new ATOM 0 HG21 VAL A 149 4.896 1.246 -14.386 1.00 0.00 H new ATOM 0 HG22 VAL A 149 4.831 1.599 -12.643 1.00 0.00 H new ATOM 0 HG23 VAL A 149 4.290 2.821 -13.819 1.00 0.00 H new ATOM 2258 N ILE A 150 8.680 4.246 -11.508 1.00 0.00 N ATOM 2259 CA ILE A 150 10.063 4.698 -11.411 1.00 0.00 C ATOM 2260 C ILE A 150 11.032 3.524 -11.495 1.00 0.00 C ATOM 2261 O ILE A 150 10.785 2.461 -10.926 1.00 0.00 O ATOM 2262 CB ILE A 150 10.314 5.464 -10.099 1.00 0.00 C ATOM 2263 CG1 ILE A 150 9.337 6.634 -9.971 1.00 0.00 C ATOM 2264 CG2 ILE A 150 11.752 5.958 -10.042 1.00 0.00 C ATOM 2265 CD1 ILE A 150 9.048 7.026 -8.539 1.00 0.00 C ATOM 0 H ILE A 150 8.257 3.989 -10.616 1.00 0.00 H new ATOM 0 HA ILE A 150 10.236 5.369 -12.252 1.00 0.00 H new ATOM 0 HB ILE A 150 10.150 4.786 -9.262 1.00 0.00 H new ATOM 0 HG12 ILE A 150 9.744 7.496 -10.500 1.00 0.00 H new ATOM 0 HG13 ILE A 150 8.401 6.371 -10.463 1.00 0.00 H new ATOM 0 HG21 ILE A 150 11.915 6.498 -9.109 1.00 0.00 H new ATOM 0 HG22 ILE A 150 12.431 5.107 -10.092 1.00 0.00 H new ATOM 0 HG23 ILE A 150 11.942 6.624 -10.884 1.00 0.00 H new ATOM 0 HD11 ILE A 150 8.348 7.862 -8.525 1.00 0.00 H new ATOM 0 HD12 ILE A 150 8.612 6.178 -8.011 1.00 0.00 H new ATOM 0 HD13 ILE A 150 9.975 7.321 -8.048 1.00 0.00 H new ATOM 2277 N GLN A 151 12.136 3.725 -12.207 1.00 0.00 N ATOM 2278 CA GLN A 151 13.144 2.683 -12.364 1.00 0.00 C ATOM 2279 C GLN A 151 14.006 2.565 -11.111 1.00 0.00 C ATOM 2280 O GLN A 151 14.175 1.478 -10.562 1.00 0.00 O ATOM 2281 CB GLN A 151 14.026 2.976 -13.579 1.00 0.00 C ATOM 2282 CG GLN A 151 13.354 2.669 -14.907 1.00 0.00 C ATOM 2283 CD GLN A 151 14.209 3.055 -16.097 1.00 0.00 C ATOM 2284 OE1 GLN A 151 15.114 3.883 -15.984 1.00 0.00 O ATOM 2285 NE2 GLN A 151 13.928 2.456 -17.249 1.00 0.00 N ATOM 0 H GLN A 151 12.355 4.599 -12.684 1.00 0.00 H new ATOM 0 HA GLN A 151 12.629 1.735 -12.518 1.00 0.00 H new ATOM 0 HB2 GLN A 151 14.316 4.027 -13.562 1.00 0.00 H new ATOM 0 HB3 GLN A 151 14.943 2.391 -13.501 1.00 0.00 H new ATOM 0 HG2 GLN A 151 13.128 1.604 -14.957 1.00 0.00 H new ATOM 0 HG3 GLN A 151 12.403 3.200 -14.960 1.00 0.00 H new ATOM 0 HE21 GLN A 151 13.169 1.776 -17.298 1.00 0.00 H new ATOM 0 HE22 GLN A 151 14.471 2.676 -18.084 1.00 0.00 H new ATOM 2294 N GLY A 152 14.549 3.694 -10.665 1.00 0.00 N ATOM 2295 CA GLY A 152 15.387 3.695 -9.480 1.00 0.00 C ATOM 2296 C GLY A 152 16.603 4.589 -9.631 1.00 0.00 C ATOM 2297 O GLY A 152 17.151 5.074 -8.643 1.00 0.00 O ATOM 0 H GLY A 152 14.424 4.607 -11.103 1.00 0.00 H new ATOM 0 HA2 GLY A 152 14.800 4.027 -8.624 1.00 0.00 H new ATOM 0 HA3 GLY A 152 15.713 2.677 -9.268 1.00 0.00 H new ATOM 2301 N ASN A 153 17.025 4.806 -10.873 1.00 0.00 N ATOM 2302 CA ASN A 153 18.185 5.645 -11.149 1.00 0.00 C ATOM 2303 C ASN A 153 17.840 7.122 -10.985 1.00 0.00 C ATOM 2304 O ASN A 153 18.684 7.996 -11.187 1.00 0.00 O ATOM 2305 CB ASN A 153 18.702 5.386 -12.566 1.00 0.00 C ATOM 2306 CG ASN A 153 17.619 5.546 -13.615 1.00 0.00 C ATOM 2307 OD1 ASN A 153 16.592 4.869 -13.571 1.00 0.00 O ATOM 2308 ND2 ASN A 153 17.844 6.446 -14.566 1.00 0.00 N ATOM 0 H ASN A 153 16.581 4.413 -11.703 1.00 0.00 H new ATOM 0 HA ASN A 153 18.965 5.390 -10.432 1.00 0.00 H new ATOM 0 HB2 ASN A 153 19.519 6.074 -12.783 1.00 0.00 H new ATOM 0 HB3 ASN A 153 19.112 4.377 -12.622 1.00 0.00 H new ATOM 0 HD21 ASN A 153 17.151 6.598 -15.299 1.00 0.00 H new ATOM 0 HD22 ASN A 153 18.710 6.985 -14.563 1.00 0.00 H new ATOM 2315 N THR A 154 16.592 7.395 -10.615 1.00 0.00 N ATOM 2316 CA THR A 154 16.134 8.765 -10.423 1.00 0.00 C ATOM 2317 C THR A 154 16.696 9.358 -9.136 1.00 0.00 C ATOM 2318 O THR A 154 17.302 8.653 -8.328 1.00 0.00 O ATOM 2319 CB THR A 154 14.596 8.842 -10.381 1.00 0.00 C ATOM 2320 OG1 THR A 154 14.172 10.208 -10.457 1.00 0.00 O ATOM 2321 CG2 THR A 154 14.057 8.208 -9.108 1.00 0.00 C ATOM 0 H THR A 154 15.881 6.685 -10.442 1.00 0.00 H new ATOM 0 HA THR A 154 16.497 9.341 -11.274 1.00 0.00 H new ATOM 0 HB THR A 154 14.203 8.292 -11.236 1.00 0.00 H new ATOM 0 HG1 THR A 154 13.237 10.245 -10.749 1.00 0.00 H new ATOM 0 HG21 THR A 154 12.969 8.274 -9.101 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.357 7.161 -9.068 1.00 0.00 H new ATOM 0 HG23 THR A 154 14.458 8.734 -8.242 1.00 0.00 H new ATOM 2329 N THR A 155 16.492 10.658 -8.950 1.00 0.00 N ATOM 2330 CA THR A 155 16.979 11.346 -7.761 1.00 0.00 C ATOM 2331 C THR A 155 15.963 11.271 -6.627 1.00 0.00 C ATOM 2332 O THR A 155 14.764 11.448 -6.842 1.00 0.00 O ATOM 2333 CB THR A 155 17.293 12.824 -8.056 1.00 0.00 C ATOM 2334 OG1 THR A 155 16.115 13.492 -8.522 1.00 0.00 O ATOM 2335 CG2 THR A 155 18.396 12.946 -9.097 1.00 0.00 C ATOM 0 H THR A 155 15.992 11.256 -9.608 1.00 0.00 H new ATOM 0 HA THR A 155 17.896 10.841 -7.458 1.00 0.00 H new ATOM 0 HB THR A 155 17.634 13.291 -7.132 1.00 0.00 H new ATOM 0 HG1 THR A 155 16.323 14.432 -8.706 1.00 0.00 H new ATOM 0 HG21 THR A 155 18.600 13.999 -9.289 1.00 0.00 H new ATOM 0 HG22 THR A 155 19.300 12.462 -8.727 1.00 0.00 H new ATOM 0 HG23 THR A 155 18.079 12.464 -10.022 1.00 0.00 H new ATOM 2343 N VAL A 156 16.450 11.007 -5.419 1.00 0.00 N ATOM 2344 CA VAL A 156 15.583 10.910 -4.250 1.00 0.00 C ATOM 2345 C VAL A 156 14.532 12.013 -4.253 1.00 0.00 C ATOM 2346 O VAL A 156 13.408 11.815 -3.790 1.00 0.00 O ATOM 2347 CB VAL A 156 16.394 10.991 -2.943 1.00 0.00 C ATOM 2348 CG1 VAL A 156 17.096 12.336 -2.832 1.00 0.00 C ATOM 2349 CG2 VAL A 156 15.491 10.751 -1.741 1.00 0.00 C ATOM 0 H VAL A 156 17.440 10.856 -5.224 1.00 0.00 H new ATOM 0 HA VAL A 156 15.087 9.941 -4.302 1.00 0.00 H new ATOM 0 HB VAL A 156 17.156 10.211 -2.959 1.00 0.00 H new ATOM 0 HG11 VAL A 156 17.664 12.374 -1.902 1.00 0.00 H new ATOM 0 HG12 VAL A 156 17.773 12.464 -3.676 1.00 0.00 H new ATOM 0 HG13 VAL A 156 16.355 13.135 -2.838 1.00 0.00 H new ATOM 0 HG21 VAL A 156 16.080 10.812 -0.826 1.00 0.00 H new ATOM 0 HG22 VAL A 156 14.706 11.507 -1.719 1.00 0.00 H new ATOM 0 HG23 VAL A 156 15.039 9.762 -1.817 1.00 0.00 H new ATOM 2359 N ASP A 157 14.903 13.176 -4.777 1.00 0.00 N ATOM 2360 CA ASP A 157 13.991 14.312 -4.842 1.00 0.00 C ATOM 2361 C ASP A 157 12.858 14.044 -5.827 1.00 0.00 C ATOM 2362 O ASP A 157 11.697 14.341 -5.548 1.00 0.00 O ATOM 2363 CB ASP A 157 14.747 15.578 -5.248 1.00 0.00 C ATOM 2364 CG ASP A 157 16.072 15.718 -4.524 1.00 0.00 C ATOM 2365 OD1 ASP A 157 16.977 14.894 -4.776 1.00 0.00 O ATOM 2366 OD2 ASP A 157 16.204 16.652 -3.705 1.00 0.00 O ATOM 0 H ASP A 157 15.830 13.357 -5.163 1.00 0.00 H new ATOM 0 HA ASP A 157 13.560 14.457 -3.851 1.00 0.00 H new ATOM 0 HB2 ASP A 157 14.924 15.563 -6.323 1.00 0.00 H new ATOM 0 HB3 ASP A 157 14.128 16.450 -5.039 1.00 0.00 H new ATOM 2371 N GLU A 158 13.205 13.481 -6.981 1.00 0.00 N ATOM 2372 CA GLU A 158 12.216 13.175 -8.008 1.00 0.00 C ATOM 2373 C GLU A 158 11.090 12.315 -7.441 1.00 0.00 C ATOM 2374 O GLU A 158 9.911 12.569 -7.693 1.00 0.00 O ATOM 2375 CB GLU A 158 12.877 12.456 -9.186 1.00 0.00 C ATOM 2376 CG GLU A 158 13.479 13.398 -10.214 1.00 0.00 C ATOM 2377 CD GLU A 158 12.456 14.353 -10.799 1.00 0.00 C ATOM 2378 OE1 GLU A 158 11.562 13.887 -11.535 1.00 0.00 O ATOM 2379 OE2 GLU A 158 12.550 15.567 -10.520 1.00 0.00 O ATOM 0 H GLU A 158 14.162 13.228 -7.227 1.00 0.00 H new ATOM 0 HA GLU A 158 11.791 14.116 -8.358 1.00 0.00 H new ATOM 0 HB2 GLU A 158 13.659 11.798 -8.807 1.00 0.00 H new ATOM 0 HB3 GLU A 158 12.137 11.823 -9.675 1.00 0.00 H new ATOM 0 HG2 GLU A 158 14.282 13.971 -9.750 1.00 0.00 H new ATOM 0 HG3 GLU A 158 13.927 12.814 -11.018 1.00 0.00 H new ATOM 2386 N LEU A 159 11.461 11.296 -6.673 1.00 0.00 N ATOM 2387 CA LEU A 159 10.483 10.397 -6.070 1.00 0.00 C ATOM 2388 C LEU A 159 9.358 11.184 -5.405 1.00 0.00 C ATOM 2389 O LEU A 159 8.181 10.877 -5.588 1.00 0.00 O ATOM 2390 CB LEU A 159 11.162 9.489 -5.043 1.00 0.00 C ATOM 2391 CG LEU A 159 12.245 8.555 -5.584 1.00 0.00 C ATOM 2392 CD1 LEU A 159 13.166 8.099 -4.464 1.00 0.00 C ATOM 2393 CD2 LEU A 159 11.616 7.357 -6.281 1.00 0.00 C ATOM 0 H LEU A 159 12.432 11.072 -6.453 1.00 0.00 H new ATOM 0 HA LEU A 159 10.053 9.783 -6.861 1.00 0.00 H new ATOM 0 HB2 LEU A 159 11.605 10.117 -4.270 1.00 0.00 H new ATOM 0 HB3 LEU A 159 10.395 8.883 -4.561 1.00 0.00 H new ATOM 0 HG LEU A 159 12.840 9.104 -6.314 1.00 0.00 H new ATOM 0 HD11 LEU A 159 13.930 7.435 -4.869 1.00 0.00 H new ATOM 0 HD12 LEU A 159 13.643 8.967 -4.009 1.00 0.00 H new ATOM 0 HD13 LEU A 159 12.586 7.567 -3.710 1.00 0.00 H new ATOM 0 HD21 LEU A 159 12.401 6.703 -6.660 1.00 0.00 H new ATOM 0 HD22 LEU A 159 10.997 6.808 -5.572 1.00 0.00 H new ATOM 0 HD23 LEU A 159 10.999 7.702 -7.111 1.00 0.00 H new ATOM 2405 N MET A 160 9.730 12.200 -4.633 1.00 0.00 N ATOM 2406 CA MET A 160 8.751 13.033 -3.944 1.00 0.00 C ATOM 2407 C MET A 160 7.652 13.485 -4.900 1.00 0.00 C ATOM 2408 O MET A 160 6.472 13.221 -4.674 1.00 0.00 O ATOM 2409 CB MET A 160 9.435 14.252 -3.322 1.00 0.00 C ATOM 2410 CG MET A 160 8.461 15.264 -2.739 1.00 0.00 C ATOM 2411 SD MET A 160 7.232 14.503 -1.661 1.00 0.00 S ATOM 2412 CE MET A 160 8.137 14.427 -0.117 1.00 0.00 C ATOM 0 H MET A 160 10.701 12.466 -4.469 1.00 0.00 H new ATOM 0 HA MET A 160 8.297 12.437 -3.153 1.00 0.00 H new ATOM 0 HB2 MET A 160 10.112 13.917 -2.536 1.00 0.00 H new ATOM 0 HB3 MET A 160 10.045 14.742 -4.080 1.00 0.00 H new ATOM 0 HG2 MET A 160 9.016 16.015 -2.177 1.00 0.00 H new ATOM 0 HG3 MET A 160 7.954 15.784 -3.552 1.00 0.00 H new ATOM 0 HE1 MET A 160 7.599 13.794 0.589 1.00 0.00 H new ATOM 0 HE2 MET A 160 9.128 14.010 -0.296 1.00 0.00 H new ATOM 0 HE3 MET A 160 8.235 15.431 0.297 1.00 0.00 H new ATOM 2422 N MET A 161 8.048 14.169 -5.969 1.00 0.00 N ATOM 2423 CA MET A 161 7.096 14.656 -6.960 1.00 0.00 C ATOM 2424 C MET A 161 6.175 13.534 -7.428 1.00 0.00 C ATOM 2425 O MET A 161 4.953 13.640 -7.332 1.00 0.00 O ATOM 2426 CB MET A 161 7.835 15.258 -8.157 1.00 0.00 C ATOM 2427 CG MET A 161 8.738 16.424 -7.789 1.00 0.00 C ATOM 2428 SD MET A 161 9.365 17.300 -9.235 1.00 0.00 S ATOM 2429 CE MET A 161 9.212 19.000 -8.693 1.00 0.00 C ATOM 0 H MET A 161 9.021 14.398 -6.171 1.00 0.00 H new ATOM 0 HA MET A 161 6.487 15.430 -6.492 1.00 0.00 H new ATOM 0 HB2 MET A 161 8.434 14.481 -8.632 1.00 0.00 H new ATOM 0 HB3 MET A 161 7.105 15.593 -8.894 1.00 0.00 H new ATOM 0 HG2 MET A 161 8.186 17.121 -7.158 1.00 0.00 H new ATOM 0 HG3 MET A 161 9.578 16.056 -7.199 1.00 0.00 H new ATOM 0 HE1 MET A 161 9.562 19.666 -9.482 1.00 0.00 H new ATOM 0 HE2 MET A 161 8.168 19.218 -8.470 1.00 0.00 H new ATOM 0 HE3 MET A 161 9.814 19.152 -7.797 1.00 0.00 H new ATOM 2439 N ARG A 162 6.771 12.459 -7.935 1.00 0.00 N ATOM 2440 CA ARG A 162 6.004 11.318 -8.419 1.00 0.00 C ATOM 2441 C ARG A 162 4.775 11.079 -7.547 1.00 0.00 C ATOM 2442 O ARG A 162 3.655 10.977 -8.049 1.00 0.00 O ATOM 2443 CB ARG A 162 6.878 10.062 -8.443 1.00 0.00 C ATOM 2444 CG ARG A 162 7.743 9.946 -9.687 1.00 0.00 C ATOM 2445 CD ARG A 162 6.899 9.762 -10.938 1.00 0.00 C ATOM 2446 NE ARG A 162 6.438 11.038 -11.479 1.00 0.00 N ATOM 2447 CZ ARG A 162 7.213 11.865 -12.172 1.00 0.00 C ATOM 2448 NH1 ARG A 162 8.480 11.552 -12.407 1.00 0.00 N ATOM 2449 NH2 ARG A 162 6.721 13.009 -12.632 1.00 0.00 N ATOM 0 H ARG A 162 7.782 12.355 -8.021 1.00 0.00 H new ATOM 0 HA ARG A 162 5.671 11.540 -9.433 1.00 0.00 H new ATOM 0 HB2 ARG A 162 7.520 10.060 -7.562 1.00 0.00 H new ATOM 0 HB3 ARG A 162 6.238 9.183 -8.373 1.00 0.00 H new ATOM 0 HG2 ARG A 162 8.357 10.841 -9.789 1.00 0.00 H new ATOM 0 HG3 ARG A 162 8.425 9.103 -9.580 1.00 0.00 H new ATOM 0 HD2 ARG A 162 7.482 9.237 -11.695 1.00 0.00 H new ATOM 0 HD3 ARG A 162 6.039 9.134 -10.706 1.00 0.00 H new ATOM 0 HE ARG A 162 5.468 11.309 -11.316 1.00 0.00 H new ATOM 0 HH11 ARG A 162 8.862 10.674 -12.055 1.00 0.00 H new ATOM 0 HH12 ARG A 162 9.072 12.189 -12.939 1.00 0.00 H new ATOM 0 HH21 ARG A 162 5.747 13.254 -12.453 1.00 0.00 H new ATOM 0 HH22 ARG A 162 7.317 13.643 -13.164 1.00 0.00 H new ATOM 2463 N LEU A 163 4.992 10.990 -6.240 1.00 0.00 N ATOM 2464 CA LEU A 163 3.903 10.763 -5.297 1.00 0.00 C ATOM 2465 C LEU A 163 2.841 11.852 -5.418 1.00 0.00 C ATOM 2466 O LEU A 163 1.665 11.564 -5.636 1.00 0.00 O ATOM 2467 CB LEU A 163 4.441 10.716 -3.866 1.00 0.00 C ATOM 2468 CG LEU A 163 5.106 9.406 -3.441 1.00 0.00 C ATOM 2469 CD1 LEU A 163 5.994 9.628 -2.226 1.00 0.00 C ATOM 2470 CD2 LEU A 163 4.055 8.345 -3.149 1.00 0.00 C ATOM 0 H LEU A 163 5.913 11.072 -5.809 1.00 0.00 H new ATOM 0 HA LEU A 163 3.443 9.804 -5.537 1.00 0.00 H new ATOM 0 HB2 LEU A 163 5.163 11.523 -3.744 1.00 0.00 H new ATOM 0 HB3 LEU A 163 3.617 10.920 -3.183 1.00 0.00 H new ATOM 0 HG LEU A 163 5.730 9.054 -4.262 1.00 0.00 H new ATOM 0 HD11 LEU A 163 6.459 8.685 -1.938 1.00 0.00 H new ATOM 0 HD12 LEU A 163 6.769 10.355 -2.470 1.00 0.00 H new ATOM 0 HD13 LEU A 163 5.392 10.003 -1.399 1.00 0.00 H new ATOM 0 HD21 LEU A 163 4.546 7.420 -2.848 1.00 0.00 H new ATOM 0 HD22 LEU A 163 3.405 8.689 -2.345 1.00 0.00 H new ATOM 0 HD23 LEU A 163 3.460 8.166 -4.045 1.00 0.00 H new ATOM 2482 N MET A 164 3.266 13.103 -5.277 1.00 0.00 N ATOM 2483 CA MET A 164 2.353 14.235 -5.374 1.00 0.00 C ATOM 2484 C MET A 164 1.519 14.154 -6.649 1.00 0.00 C ATOM 2485 O MET A 164 0.294 14.265 -6.609 1.00 0.00 O ATOM 2486 CB MET A 164 3.133 15.551 -5.344 1.00 0.00 C ATOM 2487 CG MET A 164 3.648 15.921 -3.963 1.00 0.00 C ATOM 2488 SD MET A 164 2.430 16.825 -2.986 1.00 0.00 S ATOM 2489 CE MET A 164 3.346 18.315 -2.599 1.00 0.00 C ATOM 0 H MET A 164 4.237 13.358 -5.095 1.00 0.00 H new ATOM 0 HA MET A 164 1.679 14.200 -4.518 1.00 0.00 H new ATOM 0 HB2 MET A 164 3.977 15.479 -6.030 1.00 0.00 H new ATOM 0 HB3 MET A 164 2.491 16.352 -5.710 1.00 0.00 H new ATOM 0 HG2 MET A 164 3.934 15.014 -3.431 1.00 0.00 H new ATOM 0 HG3 MET A 164 4.548 16.527 -4.066 1.00 0.00 H new ATOM 0 HE1 MET A 164 2.725 18.978 -1.996 1.00 0.00 H new ATOM 0 HE2 MET A 164 4.246 18.055 -2.042 1.00 0.00 H new ATOM 0 HE3 MET A 164 3.626 18.821 -3.523 1.00 0.00 H new ATOM 2499 N ALA A 165 2.191 13.958 -7.778 1.00 0.00 N ATOM 2500 CA ALA A 165 1.512 13.860 -9.064 1.00 0.00 C ATOM 2501 C ALA A 165 0.255 13.004 -8.957 1.00 0.00 C ATOM 2502 O ALA A 165 -0.819 13.403 -9.405 1.00 0.00 O ATOM 2503 CB ALA A 165 2.453 13.291 -10.116 1.00 0.00 C ATOM 0 H ALA A 165 3.205 13.864 -7.828 1.00 0.00 H new ATOM 0 HA ALA A 165 1.212 14.863 -9.366 1.00 0.00 H new ATOM 0 HB1 ALA A 165 1.933 13.223 -11.071 1.00 0.00 H new ATOM 0 HB2 ALA A 165 3.320 13.944 -10.220 1.00 0.00 H new ATOM 0 HB3 ALA A 165 2.782 12.298 -9.811 1.00 0.00 H new ATOM 2509 N ALA A 166 0.397 11.824 -8.361 1.00 0.00 N ATOM 2510 CA ALA A 166 -0.728 10.913 -8.194 1.00 0.00 C ATOM 2511 C ALA A 166 -1.879 11.590 -7.457 1.00 0.00 C ATOM 2512 O ALA A 166 -3.048 11.343 -7.753 1.00 0.00 O ATOM 2513 CB ALA A 166 -0.287 9.661 -7.450 1.00 0.00 C ATOM 0 H ALA A 166 1.280 11.477 -7.986 1.00 0.00 H new ATOM 0 HA ALA A 166 -1.083 10.629 -9.185 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -1.137 8.989 -7.332 1.00 0.00 H new ATOM 0 HB2 ALA A 166 0.497 9.158 -8.016 1.00 0.00 H new ATOM 0 HB3 ALA A 166 0.096 9.937 -6.468 1.00 0.00 H new ATOM 2519 N MET A 167 -1.540 12.444 -6.497 1.00 0.00 N ATOM 2520 CA MET A 167 -2.546 13.156 -5.719 1.00 0.00 C ATOM 2521 C MET A 167 -3.228 14.228 -6.564 1.00 0.00 C ATOM 2522 O MET A 167 -4.451 14.234 -6.704 1.00 0.00 O ATOM 2523 CB MET A 167 -1.909 13.794 -4.483 1.00 0.00 C ATOM 2524 CG MET A 167 -1.781 12.842 -3.305 1.00 0.00 C ATOM 2525 SD MET A 167 -3.371 12.459 -2.546 1.00 0.00 S ATOM 2526 CE MET A 167 -3.622 13.914 -1.533 1.00 0.00 C ATOM 0 H MET A 167 -0.577 12.659 -6.240 1.00 0.00 H new ATOM 0 HA MET A 167 -3.299 12.436 -5.400 1.00 0.00 H new ATOM 0 HB2 MET A 167 -0.920 14.168 -4.746 1.00 0.00 H new ATOM 0 HB3 MET A 167 -2.505 14.655 -4.181 1.00 0.00 H new ATOM 0 HG2 MET A 167 -1.310 11.918 -3.639 1.00 0.00 H new ATOM 0 HG3 MET A 167 -1.122 13.283 -2.557 1.00 0.00 H new ATOM 0 HE1 MET A 167 -4.559 13.819 -0.985 1.00 0.00 H new ATOM 0 HE2 MET A 167 -2.797 14.013 -0.827 1.00 0.00 H new ATOM 0 HE3 MET A 167 -3.662 14.798 -2.169 1.00 0.00 H new ATOM 2536 N GLU A 168 -2.430 15.132 -7.123 1.00 0.00 N ATOM 2537 CA GLU A 168 -2.959 16.208 -7.952 1.00 0.00 C ATOM 2538 C GLU A 168 -3.956 15.668 -8.973 1.00 0.00 C ATOM 2539 O GLU A 168 -4.995 16.280 -9.225 1.00 0.00 O ATOM 2540 CB GLU A 168 -1.820 16.935 -8.671 1.00 0.00 C ATOM 2541 CG GLU A 168 -0.819 17.581 -7.727 1.00 0.00 C ATOM 2542 CD GLU A 168 -1.212 18.993 -7.339 1.00 0.00 C ATOM 2543 OE1 GLU A 168 -2.426 19.257 -7.211 1.00 0.00 O ATOM 2544 OE2 GLU A 168 -0.305 19.834 -7.163 1.00 0.00 O ATOM 0 H GLU A 168 -1.416 15.141 -7.017 1.00 0.00 H new ATOM 0 HA GLU A 168 -3.477 16.912 -7.301 1.00 0.00 H new ATOM 0 HB2 GLU A 168 -1.296 16.227 -9.313 1.00 0.00 H new ATOM 0 HB3 GLU A 168 -2.242 17.702 -9.320 1.00 0.00 H new ATOM 0 HG2 GLU A 168 -0.729 16.973 -6.827 1.00 0.00 H new ATOM 0 HG3 GLU A 168 0.163 17.598 -8.200 1.00 0.00 H new ATOM 2551 N ILE A 169 -3.632 14.520 -9.558 1.00 0.00 N ATOM 2552 CA ILE A 169 -4.499 13.897 -10.551 1.00 0.00 C ATOM 2553 C ILE A 169 -5.683 13.202 -9.888 1.00 0.00 C ATOM 2554 O ILE A 169 -6.835 13.418 -10.265 1.00 0.00 O ATOM 2555 CB ILE A 169 -3.730 12.873 -11.407 1.00 0.00 C ATOM 2556 CG1 ILE A 169 -2.550 13.547 -12.110 1.00 0.00 C ATOM 2557 CG2 ILE A 169 -4.660 12.227 -12.422 1.00 0.00 C ATOM 2558 CD1 ILE A 169 -1.559 12.568 -12.700 1.00 0.00 C ATOM 0 H ILE A 169 -2.775 14.002 -9.362 1.00 0.00 H new ATOM 0 HA ILE A 169 -4.865 14.696 -11.196 1.00 0.00 H new ATOM 0 HB ILE A 169 -3.341 12.093 -10.752 1.00 0.00 H new ATOM 0 HG12 ILE A 169 -2.930 14.190 -12.904 1.00 0.00 H new ATOM 0 HG13 ILE A 169 -2.033 14.191 -11.398 1.00 0.00 H new ATOM 0 HG21 ILE A 169 -4.102 11.506 -13.019 1.00 0.00 H new ATOM 0 HG22 ILE A 169 -5.470 11.717 -11.900 1.00 0.00 H new ATOM 0 HG23 ILE A 169 -5.076 12.995 -13.075 1.00 0.00 H new ATOM 0 HD11 ILE A 169 -0.749 13.116 -13.182 1.00 0.00 H new ATOM 0 HD12 ILE A 169 -1.151 11.941 -11.907 1.00 0.00 H new ATOM 0 HD13 ILE A 169 -2.062 11.941 -13.436 1.00 0.00 H new ATOM 2570 N PHE A 170 -5.392 12.367 -8.896 1.00 0.00 N ATOM 2571 CA PHE A 170 -6.433 11.639 -8.179 1.00 0.00 C ATOM 2572 C PHE A 170 -7.605 12.557 -7.842 1.00 0.00 C ATOM 2573 O PHE A 170 -8.757 12.252 -8.151 1.00 0.00 O ATOM 2574 CB PHE A 170 -5.866 11.027 -6.896 1.00 0.00 C ATOM 2575 CG PHE A 170 -6.919 10.668 -5.887 1.00 0.00 C ATOM 2576 CD1 PHE A 170 -7.495 11.644 -5.090 1.00 0.00 C ATOM 2577 CD2 PHE A 170 -7.333 9.354 -5.736 1.00 0.00 C ATOM 2578 CE1 PHE A 170 -8.463 11.315 -4.160 1.00 0.00 C ATOM 2579 CE2 PHE A 170 -8.301 9.020 -4.808 1.00 0.00 C ATOM 2580 CZ PHE A 170 -8.867 10.002 -4.020 1.00 0.00 C ATOM 0 H PHE A 170 -4.444 12.178 -8.570 1.00 0.00 H new ATOM 0 HA PHE A 170 -6.794 10.840 -8.826 1.00 0.00 H new ATOM 0 HB2 PHE A 170 -5.298 10.132 -7.150 1.00 0.00 H new ATOM 0 HB3 PHE A 170 -5.167 11.731 -6.445 1.00 0.00 H new ATOM 0 HD1 PHE A 170 -7.184 12.673 -5.197 1.00 0.00 H new ATOM 0 HD2 PHE A 170 -6.894 8.582 -6.351 1.00 0.00 H new ATOM 0 HE1 PHE A 170 -8.903 12.084 -3.543 1.00 0.00 H new ATOM 0 HE2 PHE A 170 -8.614 7.992 -4.699 1.00 0.00 H new ATOM 0 HZ PHE A 170 -9.625 9.744 -3.295 1.00 0.00 H new ATOM 2590 N THR A 171 -7.302 13.685 -7.206 1.00 0.00 N ATOM 2591 CA THR A 171 -8.328 14.647 -6.826 1.00 0.00 C ATOM 2592 C THR A 171 -9.209 15.011 -8.015 1.00 0.00 C ATOM 2593 O THR A 171 -10.377 15.362 -7.850 1.00 0.00 O ATOM 2594 CB THR A 171 -7.706 15.933 -6.249 1.00 0.00 C ATOM 2595 OG1 THR A 171 -8.686 16.655 -5.494 1.00 0.00 O ATOM 2596 CG2 THR A 171 -7.163 16.817 -7.362 1.00 0.00 C ATOM 0 H THR A 171 -6.354 13.954 -6.944 1.00 0.00 H new ATOM 0 HA THR A 171 -8.938 14.171 -6.058 1.00 0.00 H new ATOM 0 HB THR A 171 -6.881 15.650 -5.595 1.00 0.00 H new ATOM 0 HG1 THR A 171 -8.283 17.470 -5.129 1.00 0.00 H new ATOM 0 HG21 THR A 171 -6.729 17.719 -6.931 1.00 0.00 H new ATOM 0 HG22 THR A 171 -6.397 16.275 -7.916 1.00 0.00 H new ATOM 0 HG23 THR A 171 -7.974 17.091 -8.037 1.00 0.00 H new