USER MOD reduce.3.24.130724 H: found=0, std=0, add=1112, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1108 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 48 TYR OH : rot 180:sc= 0.397 USER MOD Set 1.2: A 68 ASN : amide:sc= 0.562 K(o=0.96,f=-2!) USER MOD Set 2.1: A 2 GLN : amide:sc= 0.933 K(o=2,f=-2.2) USER MOD Set 2.2: A 14 LYS NZ :NH3+ -179:sc= 1.09 (180deg=0) USER MOD Single : A 1 MET CE :methyl 163:sc= -0.248 (180deg=-1.03) USER MOD Single : A 1 MET N :NH3+ 180:sc= 1.17 (180deg=1.17) USER MOD Single : A 4 THR OG1 : rot 83:sc= 0.0541 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.284 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 GLN : amide:sc= 0.426 X(o=0.43,f=0) USER MOD Single : A 11 GLN : amide:sc= 0.823 K(o=0.82,f=-0.01) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -54:sc= 1.27 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 165:sc= 1.23 (180deg=1.17) USER MOD Single : A 29 LYS NZ :NH3+ -160:sc= 1.23 (180deg=1.08) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -107:sc= 1.36 (180deg=0.312) USER MOD Single : A 36 LYS NZ :NH3+ 166:sc= 0.895 (180deg=0.387) USER MOD Single : A 44 GLN : amide:sc= -0.0456 K(o=-0.046,f=-2.6!) USER MOD Single : A 45 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00456) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= -0.0275 X(o=-0.028,f=0) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 176:sc= 1.25 (180deg=1.22) USER MOD Single : A 62 TYR OH : rot 120:sc= 0.556 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl -176:sc= -0.448 (180deg=-0.484) USER MOD Single : A 75 THR OG1 : rot 160:sc= -0.125 USER MOD Single : A 76 LYS NZ :NH3+ -178:sc= 2.26 (180deg=2.26) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -80:sc= 0.867 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0.0022 USER MOD Single : A 90 HIS : no HD1:sc= -0.0525 X(o=-0.053,f=-0.086) USER MOD Single : A 91 HIS : no HE2:sc= 0.95 K(o=0.95,f=-2.9!) USER MOD Single : A 92 HIS : no HD1:sc= -1.22 X(o=-1.2,f=-1.5) USER MOD Single : A 93 HIS : no HD1:sc= -0.0304 X(o=-0.03,f=-0.03) USER MOD Single : A 94 HIS : no HE2:sc= 0.186 K(o=0.19,f=-2.7!) USER MOD Single : A 95 HIS : no HE2:sc= 1.1 K(o=1.1,f=-3.3!) USER MOD Single : B 261 SER OG : rot 180:sc= 0 USER MOD Single : B 262 HIS : no HE2:sc= 0.669 K(o=0.67,f=-2.3!) USER MOD Single : B 263 MET CE :methyl -179:sc= 0 (180deg=-0.0021) USER MOD Single : B 264 THR OG1 : rot 180:sc= 0 USER MOD Single : B 266 SER OG : rot 180:sc= 0 USER MOD Single : B 267 GLN : amide:sc= 0.462 K(o=0.46,f=-0.071) USER MOD Single : B 268 GLN : amide:sc= 0.617 K(o=0.62,f=0) USER MOD Single : B 273 THR OG1 : rot 180:sc= 0.0114 USER MOD Single : B 279 SER OG : rot 180:sc= 0 USER MOD Single : B 280 SER OG : rot 180:sc= 0 USER MOD Single : B 281 MET CE :methyl 180:sc= -0.0964 (180deg=-0.0964) USER MOD Single : B 282 THR OG1 : rot 180:sc= 0 USER MOD Single : B 286 GLN : amide:sc= -0.189 K(o=-0.19,f=-1.6) USER MOD Single : B 289 TYR OH : rot -162:sc= 0.628 USER MOD Single : B 291 MET CE :methyl 165:sc= -0.0586 (180deg=-0.515) USER MOD Single : B 292 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 293 MET CE :methyl 169:sc= -0.679 (180deg=-0.847) USER MOD Single : B 294 SER OG : rot -31:sc= 1.52 USER MOD Single : B 296 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 302 GLN : amide:sc= 0.885 K(o=0.88,f=-0.0053) USER MOD Single : B 305 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.482 6.079 5.575 1.00 0.00 N ATOM 2 CA MET A 1 4.134 6.122 4.243 1.00 0.00 C ATOM 3 C MET A 1 3.871 4.829 3.485 1.00 0.00 C ATOM 4 O MET A 1 4.064 3.739 4.015 1.00 0.00 O ATOM 5 CB MET A 1 5.643 6.443 4.295 1.00 0.00 C ATOM 6 CG MET A 1 6.525 5.444 5.051 1.00 0.00 C ATOM 7 SD MET A 1 8.273 5.931 5.145 1.00 0.00 S ATOM 8 CE MET A 1 8.987 4.959 3.793 1.00 0.00 C ATOM 0 H1 MET A 1 3.669 6.968 6.082 1.00 0.00 H new ATOM 0 H2 MET A 1 2.456 5.958 5.456 1.00 0.00 H new ATOM 0 H3 MET A 1 3.863 5.281 6.122 1.00 0.00 H new ATOM 0 HA MET A 1 3.681 6.955 3.705 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.012 6.519 3.272 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.768 7.424 4.753 1.00 0.00 H new ATOM 0 HG2 MET A 1 6.136 5.324 6.062 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.454 4.471 4.565 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.964 5.364 3.530 1.00 0.00 H new ATOM 0 HE2 MET A 1 9.098 3.922 4.110 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.329 5.005 2.925 1.00 0.00 H new ATOM 20 N GLN A 2 3.413 4.940 2.242 1.00 0.00 N ATOM 21 CA GLN A 2 3.048 3.806 1.390 1.00 0.00 C ATOM 22 C GLN A 2 4.248 3.370 0.537 1.00 0.00 C ATOM 23 O GLN A 2 4.422 3.806 -0.602 1.00 0.00 O ATOM 24 CB GLN A 2 1.793 4.105 0.553 1.00 0.00 C ATOM 25 CG GLN A 2 0.610 4.678 1.348 1.00 0.00 C ATOM 26 CD GLN A 2 -0.605 4.921 0.452 1.00 0.00 C ATOM 27 OE1 GLN A 2 -1.218 4.004 -0.083 1.00 0.00 O ATOM 28 NE2 GLN A 2 -1.010 6.157 0.246 1.00 0.00 N ATOM 0 H GLN A 2 3.281 5.842 1.785 1.00 0.00 H new ATOM 0 HA GLN A 2 2.784 2.963 2.028 1.00 0.00 H new ATOM 0 HB2 GLN A 2 2.058 4.810 -0.235 1.00 0.00 H new ATOM 0 HB3 GLN A 2 1.472 3.185 0.063 1.00 0.00 H new ATOM 0 HG2 GLN A 2 0.341 3.989 2.148 1.00 0.00 H new ATOM 0 HG3 GLN A 2 0.908 5.614 1.820 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -0.515 6.935 0.681 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -1.819 6.336 -0.349 1.00 0.00 H new ATOM 37 N VAL A 3 5.106 2.527 1.111 1.00 0.00 N ATOM 38 CA VAL A 3 6.253 1.911 0.424 1.00 0.00 C ATOM 39 C VAL A 3 5.747 0.930 -0.636 1.00 0.00 C ATOM 40 O VAL A 3 4.863 0.117 -0.358 1.00 0.00 O ATOM 41 CB VAL A 3 7.164 1.176 1.429 1.00 0.00 C ATOM 42 CG1 VAL A 3 8.404 0.578 0.756 1.00 0.00 C ATOM 43 CG2 VAL A 3 7.686 2.144 2.492 1.00 0.00 C ATOM 0 H VAL A 3 5.026 2.244 2.088 1.00 0.00 H new ATOM 0 HA VAL A 3 6.837 2.697 -0.055 1.00 0.00 H new ATOM 0 HB VAL A 3 6.550 0.387 1.863 1.00 0.00 H new ATOM 0 HG11 VAL A 3 9.015 0.071 1.503 1.00 0.00 H new ATOM 0 HG12 VAL A 3 8.095 -0.137 -0.006 1.00 0.00 H new ATOM 0 HG13 VAL A 3 8.986 1.374 0.292 1.00 0.00 H new ATOM 0 HG21 VAL A 3 8.326 1.606 3.191 1.00 0.00 H new ATOM 0 HG22 VAL A 3 8.259 2.937 2.012 1.00 0.00 H new ATOM 0 HG23 VAL A 3 6.845 2.580 3.032 1.00 0.00 H new ATOM 53 N THR A 4 6.297 0.980 -1.849 1.00 0.00 N ATOM 54 CA THR A 4 6.052 -0.054 -2.870 1.00 0.00 C ATOM 55 C THR A 4 6.960 -1.258 -2.609 1.00 0.00 C ATOM 56 O THR A 4 8.158 -1.098 -2.385 1.00 0.00 O ATOM 57 CB THR A 4 6.309 0.489 -4.279 1.00 0.00 C ATOM 58 OG1 THR A 4 5.402 1.533 -4.578 1.00 0.00 O ATOM 59 CG2 THR A 4 6.113 -0.593 -5.339 1.00 0.00 C ATOM 0 H THR A 4 6.920 1.728 -2.155 1.00 0.00 H new ATOM 0 HA THR A 4 5.007 -0.358 -2.806 1.00 0.00 H new ATOM 0 HB THR A 4 7.339 0.846 -4.295 1.00 0.00 H new ATOM 0 HG1 THR A 4 5.734 2.373 -4.198 1.00 0.00 H new ATOM 0 HG21 THR A 4 6.303 -0.173 -6.327 1.00 0.00 H new ATOM 0 HG22 THR A 4 6.806 -1.414 -5.154 1.00 0.00 H new ATOM 0 HG23 THR A 4 5.090 -0.965 -5.294 1.00 0.00 H new ATOM 67 N LEU A 5 6.415 -2.472 -2.652 1.00 0.00 N ATOM 68 CA LEU A 5 7.134 -3.733 -2.455 1.00 0.00 C ATOM 69 C LEU A 5 7.306 -4.470 -3.787 1.00 0.00 C ATOM 70 O LEU A 5 6.429 -4.421 -4.650 1.00 0.00 O ATOM 71 CB LEU A 5 6.334 -4.589 -1.454 1.00 0.00 C ATOM 72 CG LEU A 5 6.498 -4.221 0.036 1.00 0.00 C ATOM 73 CD1 LEU A 5 7.536 -5.141 0.665 1.00 0.00 C ATOM 74 CD2 LEU A 5 6.812 -2.763 0.370 1.00 0.00 C ATOM 0 H LEU A 5 5.421 -2.612 -2.832 1.00 0.00 H new ATOM 0 HA LEU A 5 8.131 -3.538 -2.061 1.00 0.00 H new ATOM 0 HB2 LEU A 5 5.277 -4.519 -1.711 1.00 0.00 H new ATOM 0 HB3 LEU A 5 6.625 -5.631 -1.584 1.00 0.00 H new ATOM 0 HG LEU A 5 5.504 -4.363 0.461 1.00 0.00 H new ATOM 0 HD11 LEU A 5 7.657 -4.887 1.718 1.00 0.00 H new ATOM 0 HD12 LEU A 5 7.206 -6.176 0.577 1.00 0.00 H new ATOM 0 HD13 LEU A 5 8.489 -5.020 0.150 1.00 0.00 H new ATOM 0 HD21 LEU A 5 6.900 -2.648 1.450 1.00 0.00 H new ATOM 0 HD22 LEU A 5 7.751 -2.475 -0.103 1.00 0.00 H new ATOM 0 HD23 LEU A 5 6.009 -2.124 0.002 1.00 0.00 H new ATOM 86 N LYS A 6 8.421 -5.193 -3.911 1.00 0.00 N ATOM 87 CA LYS A 6 8.837 -6.025 -5.055 1.00 0.00 C ATOM 88 C LYS A 6 9.378 -7.367 -4.549 1.00 0.00 C ATOM 89 O LYS A 6 10.299 -7.405 -3.733 1.00 0.00 O ATOM 90 CB LYS A 6 9.847 -5.235 -5.919 1.00 0.00 C ATOM 91 CG LYS A 6 10.764 -6.047 -6.858 1.00 0.00 C ATOM 92 CD LYS A 6 10.065 -6.793 -7.996 1.00 0.00 C ATOM 93 CE LYS A 6 9.420 -5.911 -9.070 1.00 0.00 C ATOM 94 NZ LYS A 6 10.423 -5.237 -9.940 1.00 0.00 N ATOM 0 H LYS A 6 9.112 -5.218 -3.161 1.00 0.00 H new ATOM 0 HA LYS A 6 7.988 -6.259 -5.697 1.00 0.00 H new ATOM 0 HB2 LYS A 6 9.287 -4.524 -6.527 1.00 0.00 H new ATOM 0 HB3 LYS A 6 10.480 -4.653 -5.250 1.00 0.00 H new ATOM 0 HG2 LYS A 6 11.499 -5.369 -7.292 1.00 0.00 H new ATOM 0 HG3 LYS A 6 11.314 -6.772 -6.259 1.00 0.00 H new ATOM 0 HD2 LYS A 6 10.792 -7.447 -8.477 1.00 0.00 H new ATOM 0 HD3 LYS A 6 9.294 -7.434 -7.567 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.761 -6.521 -9.688 1.00 0.00 H new ATOM 0 HE3 LYS A 6 8.797 -5.157 -8.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 9.933 -4.654 -10.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 11.037 -4.632 -9.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 11.001 -5.954 -10.423 1.00 0.00 H new ATOM 108 N THR A 7 8.783 -8.466 -5.003 1.00 0.00 N ATOM 109 CA THR A 7 9.167 -9.840 -4.637 1.00 0.00 C ATOM 110 C THR A 7 10.303 -10.370 -5.525 1.00 0.00 C ATOM 111 O THR A 7 10.568 -9.822 -6.599 1.00 0.00 O ATOM 112 CB THR A 7 7.953 -10.785 -4.712 1.00 0.00 C ATOM 113 OG1 THR A 7 7.666 -11.150 -6.046 1.00 0.00 O ATOM 114 CG2 THR A 7 6.671 -10.170 -4.139 1.00 0.00 C ATOM 0 H THR A 7 7.998 -8.433 -5.654 1.00 0.00 H new ATOM 0 HA THR A 7 9.530 -9.810 -3.610 1.00 0.00 H new ATOM 0 HB THR A 7 8.241 -11.650 -4.115 1.00 0.00 H new ATOM 0 HG1 THR A 7 6.892 -11.751 -6.061 1.00 0.00 H new ATOM 0 HG21 THR A 7 5.855 -10.887 -4.223 1.00 0.00 H new ATOM 0 HG22 THR A 7 6.826 -9.917 -3.090 1.00 0.00 H new ATOM 0 HG23 THR A 7 6.420 -9.268 -4.696 1.00 0.00 H new ATOM 122 N LEU A 8 10.951 -11.480 -5.142 1.00 0.00 N ATOM 123 CA LEU A 8 11.923 -12.170 -6.013 1.00 0.00 C ATOM 124 C LEU A 8 11.287 -12.821 -7.255 1.00 0.00 C ATOM 125 O LEU A 8 11.958 -13.004 -8.271 1.00 0.00 O ATOM 126 CB LEU A 8 12.725 -13.215 -5.229 1.00 0.00 C ATOM 127 CG LEU A 8 13.588 -12.684 -4.076 1.00 0.00 C ATOM 128 CD1 LEU A 8 14.486 -13.809 -3.561 1.00 0.00 C ATOM 129 CD2 LEU A 8 14.511 -11.545 -4.489 1.00 0.00 C ATOM 0 H LEU A 8 10.821 -11.923 -4.232 1.00 0.00 H new ATOM 0 HA LEU A 8 12.594 -11.390 -6.374 1.00 0.00 H new ATOM 0 HB2 LEU A 8 12.028 -13.949 -4.825 1.00 0.00 H new ATOM 0 HB3 LEU A 8 13.374 -13.743 -5.928 1.00 0.00 H new ATOM 0 HG LEU A 8 12.893 -12.316 -3.321 1.00 0.00 H new ATOM 0 HD11 LEU A 8 15.101 -13.437 -2.742 1.00 0.00 H new ATOM 0 HD12 LEU A 8 13.868 -14.634 -3.206 1.00 0.00 H new ATOM 0 HD13 LEU A 8 15.130 -14.159 -4.368 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.092 -11.217 -3.627 1.00 0.00 H new ATOM 0 HD22 LEU A 8 15.186 -11.890 -5.272 1.00 0.00 H new ATOM 0 HD23 LEU A 8 13.916 -10.712 -4.864 1.00 0.00 H new ATOM 141 N GLN A 9 9.985 -13.113 -7.205 1.00 0.00 N ATOM 142 CA GLN A 9 9.166 -13.528 -8.354 1.00 0.00 C ATOM 143 C GLN A 9 8.788 -12.325 -9.256 1.00 0.00 C ATOM 144 O GLN A 9 7.980 -12.455 -10.178 1.00 0.00 O ATOM 145 CB GLN A 9 7.922 -14.275 -7.839 1.00 0.00 C ATOM 146 CG GLN A 9 8.278 -15.594 -7.134 1.00 0.00 C ATOM 147 CD GLN A 9 7.027 -16.331 -6.657 1.00 0.00 C ATOM 148 OE1 GLN A 9 6.572 -16.179 -5.530 1.00 0.00 O ATOM 149 NE2 GLN A 9 6.417 -17.153 -7.487 1.00 0.00 N ATOM 0 H GLN A 9 9.452 -13.067 -6.337 1.00 0.00 H new ATOM 0 HA GLN A 9 9.748 -14.202 -8.982 1.00 0.00 H new ATOM 0 HB2 GLN A 9 7.377 -13.633 -7.147 1.00 0.00 H new ATOM 0 HB3 GLN A 9 7.254 -14.482 -8.675 1.00 0.00 H new ATOM 0 HG2 GLN A 9 8.839 -16.232 -7.816 1.00 0.00 H new ATOM 0 HG3 GLN A 9 8.927 -15.389 -6.283 1.00 0.00 H new ATOM 0 HE21 GLN A 9 6.783 -17.291 -8.429 1.00 0.00 H new ATOM 0 HE22 GLN A 9 5.579 -17.651 -7.187 1.00 0.00 H new ATOM 158 N GLN A 10 9.366 -11.147 -8.987 1.00 0.00 N ATOM 159 CA GLN A 10 9.177 -9.858 -9.661 1.00 0.00 C ATOM 160 C GLN A 10 7.721 -9.361 -9.677 1.00 0.00 C ATOM 161 O GLN A 10 7.321 -8.591 -10.553 1.00 0.00 O ATOM 162 CB GLN A 10 9.876 -9.843 -11.036 1.00 0.00 C ATOM 163 CG GLN A 10 11.356 -10.253 -10.937 1.00 0.00 C ATOM 164 CD GLN A 10 12.145 -9.910 -12.200 1.00 0.00 C ATOM 165 OE1 GLN A 10 11.766 -10.230 -13.321 1.00 0.00 O ATOM 166 NE2 GLN A 10 13.272 -9.239 -12.076 1.00 0.00 N ATOM 0 H GLN A 10 10.038 -11.066 -8.224 1.00 0.00 H new ATOM 0 HA GLN A 10 9.679 -9.106 -9.052 1.00 0.00 H new ATOM 0 HB2 GLN A 10 9.357 -10.521 -11.714 1.00 0.00 H new ATOM 0 HB3 GLN A 10 9.805 -8.845 -11.468 1.00 0.00 H new ATOM 0 HG2 GLN A 10 11.811 -9.754 -10.082 1.00 0.00 H new ATOM 0 HG3 GLN A 10 11.421 -11.325 -10.752 1.00 0.00 H new ATOM 0 HE21 GLN A 10 13.603 -8.964 -11.151 1.00 0.00 H new ATOM 0 HE22 GLN A 10 13.814 -8.994 -12.905 1.00 0.00 H new ATOM 175 N GLN A 11 6.941 -9.754 -8.667 1.00 0.00 N ATOM 176 CA GLN A 11 5.584 -9.259 -8.423 1.00 0.00 C ATOM 177 C GLN A 11 5.646 -8.017 -7.530 1.00 0.00 C ATOM 178 O GLN A 11 6.635 -7.819 -6.821 1.00 0.00 O ATOM 179 CB GLN A 11 4.726 -10.360 -7.778 1.00 0.00 C ATOM 180 CG GLN A 11 4.789 -11.702 -8.529 1.00 0.00 C ATOM 181 CD GLN A 11 4.351 -11.597 -9.990 1.00 0.00 C ATOM 182 OE1 GLN A 11 3.209 -11.288 -10.307 1.00 0.00 O ATOM 183 NE2 GLN A 11 5.230 -11.853 -10.936 1.00 0.00 N ATOM 0 H GLN A 11 7.244 -10.443 -7.979 1.00 0.00 H new ATOM 0 HA GLN A 11 5.121 -8.984 -9.371 1.00 0.00 H new ATOM 0 HB2 GLN A 11 5.055 -10.512 -6.750 1.00 0.00 H new ATOM 0 HB3 GLN A 11 3.690 -10.024 -7.735 1.00 0.00 H new ATOM 0 HG2 GLN A 11 5.808 -12.086 -8.489 1.00 0.00 H new ATOM 0 HG3 GLN A 11 4.155 -12.427 -8.018 1.00 0.00 H new ATOM 0 HE21 GLN A 11 6.185 -12.112 -10.688 1.00 0.00 H new ATOM 0 HE22 GLN A 11 4.956 -11.793 -11.917 1.00 0.00 H new ATOM 192 N THR A 12 4.616 -7.170 -7.553 1.00 0.00 N ATOM 193 CA THR A 12 4.603 -5.914 -6.788 1.00 0.00 C ATOM 194 C THR A 12 3.284 -5.649 -6.068 1.00 0.00 C ATOM 195 O THR A 12 2.199 -6.033 -6.515 1.00 0.00 O ATOM 196 CB THR A 12 4.979 -4.695 -7.648 1.00 0.00 C ATOM 197 OG1 THR A 12 4.193 -4.639 -8.823 1.00 0.00 O ATOM 198 CG2 THR A 12 6.451 -4.712 -8.065 1.00 0.00 C ATOM 0 H THR A 12 3.769 -7.330 -8.098 1.00 0.00 H new ATOM 0 HA THR A 12 5.370 -6.054 -6.026 1.00 0.00 H new ATOM 0 HB THR A 12 4.793 -3.820 -7.025 1.00 0.00 H new ATOM 0 HG1 THR A 12 4.450 -3.855 -9.351 1.00 0.00 H new ATOM 0 HG21 THR A 12 6.668 -3.832 -8.670 1.00 0.00 H new ATOM 0 HG22 THR A 12 7.081 -4.705 -7.176 1.00 0.00 H new ATOM 0 HG23 THR A 12 6.654 -5.611 -8.647 1.00 0.00 H new ATOM 206 N PHE A 13 3.411 -4.983 -4.921 1.00 0.00 N ATOM 207 CA PHE A 13 2.365 -4.651 -3.950 1.00 0.00 C ATOM 208 C PHE A 13 2.696 -3.295 -3.296 1.00 0.00 C ATOM 209 O PHE A 13 3.735 -2.699 -3.595 1.00 0.00 O ATOM 210 CB PHE A 13 2.294 -5.770 -2.888 1.00 0.00 C ATOM 211 CG PHE A 13 2.042 -7.166 -3.436 1.00 0.00 C ATOM 212 CD1 PHE A 13 3.123 -7.986 -3.821 1.00 0.00 C ATOM 213 CD2 PHE A 13 0.724 -7.632 -3.599 1.00 0.00 C ATOM 214 CE1 PHE A 13 2.884 -9.244 -4.406 1.00 0.00 C ATOM 215 CE2 PHE A 13 0.486 -8.899 -4.164 1.00 0.00 C ATOM 216 CZ PHE A 13 1.565 -9.699 -4.579 1.00 0.00 C ATOM 0 H PHE A 13 4.321 -4.633 -4.621 1.00 0.00 H new ATOM 0 HA PHE A 13 1.396 -4.573 -4.443 1.00 0.00 H new ATOM 0 HB2 PHE A 13 3.230 -5.779 -2.330 1.00 0.00 H new ATOM 0 HB3 PHE A 13 1.503 -5.527 -2.179 1.00 0.00 H new ATOM 0 HD1 PHE A 13 4.137 -7.648 -3.667 1.00 0.00 H new ATOM 0 HD2 PHE A 13 -0.107 -7.016 -3.290 1.00 0.00 H new ATOM 0 HE1 PHE A 13 3.714 -9.859 -4.722 1.00 0.00 H new ATOM 0 HE2 PHE A 13 -0.526 -9.257 -4.279 1.00 0.00 H new ATOM 0 HZ PHE A 13 1.381 -10.663 -5.030 1.00 0.00 H new ATOM 226 N LYS A 14 1.861 -2.809 -2.374 1.00 0.00 N ATOM 227 CA LYS A 14 2.184 -1.649 -1.523 1.00 0.00 C ATOM 228 C LYS A 14 1.943 -1.966 -0.046 1.00 0.00 C ATOM 229 O LYS A 14 1.097 -2.799 0.288 1.00 0.00 O ATOM 230 CB LYS A 14 1.447 -0.379 -1.989 1.00 0.00 C ATOM 231 CG LYS A 14 -0.071 -0.395 -1.743 1.00 0.00 C ATOM 232 CD LYS A 14 -0.688 0.969 -2.074 1.00 0.00 C ATOM 233 CE LYS A 14 -2.173 0.986 -1.696 1.00 0.00 C ATOM 234 NZ LYS A 14 -2.748 2.348 -1.834 1.00 0.00 N ATOM 0 H LYS A 14 0.939 -3.206 -2.192 1.00 0.00 H new ATOM 0 HA LYS A 14 3.248 -1.438 -1.630 1.00 0.00 H new ATOM 0 HB2 LYS A 14 1.876 0.483 -1.478 1.00 0.00 H new ATOM 0 HB3 LYS A 14 1.628 -0.240 -3.055 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -0.536 -1.168 -2.355 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -0.273 -0.648 -0.702 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -0.159 1.755 -1.535 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -0.574 1.179 -3.137 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -2.721 0.291 -2.333 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -2.293 0.640 -0.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -3.750 2.332 -1.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -2.228 3.008 -1.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -2.669 2.660 -2.823 1.00 0.00 H new ATOM 248 N ILE A 15 2.672 -1.282 0.830 1.00 0.00 N ATOM 249 CA ILE A 15 2.600 -1.395 2.289 1.00 0.00 C ATOM 250 C ILE A 15 2.586 0.005 2.892 1.00 0.00 C ATOM 251 O ILE A 15 3.570 0.739 2.831 1.00 0.00 O ATOM 252 CB ILE A 15 3.759 -2.258 2.838 1.00 0.00 C ATOM 253 CG1 ILE A 15 3.587 -3.745 2.467 1.00 0.00 C ATOM 254 CG2 ILE A 15 3.931 -2.107 4.355 1.00 0.00 C ATOM 255 CD1 ILE A 15 2.436 -4.505 3.145 1.00 0.00 C ATOM 0 H ILE A 15 3.366 -0.598 0.529 1.00 0.00 H new ATOM 0 HA ILE A 15 1.680 -1.905 2.575 1.00 0.00 H new ATOM 0 HB ILE A 15 4.666 -1.886 2.362 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.447 -3.811 1.388 1.00 0.00 H new ATOM 0 HG13 ILE A 15 4.518 -4.262 2.700 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.757 -2.733 4.692 1.00 0.00 H new ATOM 0 HG22 ILE A 15 4.144 -1.065 4.595 1.00 0.00 H new ATOM 0 HG23 ILE A 15 3.014 -2.415 4.858 1.00 0.00 H new ATOM 0 HD11 ILE A 15 2.427 -5.538 2.797 1.00 0.00 H new ATOM 0 HD12 ILE A 15 2.575 -4.487 4.226 1.00 0.00 H new ATOM 0 HD13 ILE A 15 1.488 -4.029 2.894 1.00 0.00 H new ATOM 267 N ASP A 16 1.441 0.379 3.455 1.00 0.00 N ATOM 268 CA ASP A 16 1.307 1.592 4.270 1.00 0.00 C ATOM 269 C ASP A 16 1.890 1.349 5.677 1.00 0.00 C ATOM 270 O ASP A 16 1.253 0.731 6.534 1.00 0.00 O ATOM 271 CB ASP A 16 -0.149 2.061 4.349 1.00 0.00 C ATOM 272 CG ASP A 16 -0.277 3.382 5.137 1.00 0.00 C ATOM 273 OD1 ASP A 16 0.639 4.238 5.059 1.00 0.00 O ATOM 274 OD2 ASP A 16 -1.307 3.572 5.827 1.00 0.00 O ATOM 0 H ASP A 16 0.574 -0.150 3.361 1.00 0.00 H new ATOM 0 HA ASP A 16 1.873 2.390 3.789 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -0.543 2.197 3.342 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -0.755 1.291 4.827 1.00 0.00 H new ATOM 279 N ILE A 17 3.122 1.802 5.899 1.00 0.00 N ATOM 280 CA ILE A 17 3.923 1.599 7.115 1.00 0.00 C ATOM 281 C ILE A 17 4.240 2.930 7.810 1.00 0.00 C ATOM 282 O ILE A 17 4.471 3.959 7.178 1.00 0.00 O ATOM 283 CB ILE A 17 5.189 0.767 6.787 1.00 0.00 C ATOM 284 CG1 ILE A 17 6.185 0.645 7.959 1.00 0.00 C ATOM 285 CG2 ILE A 17 5.942 1.292 5.543 1.00 0.00 C ATOM 286 CD1 ILE A 17 5.657 -0.028 9.235 1.00 0.00 C ATOM 0 H ILE A 17 3.620 2.352 5.199 1.00 0.00 H new ATOM 0 HA ILE A 17 3.337 1.025 7.833 1.00 0.00 H new ATOM 0 HB ILE A 17 4.795 -0.228 6.579 1.00 0.00 H new ATOM 0 HG12 ILE A 17 7.054 0.086 7.612 1.00 0.00 H new ATOM 0 HG13 ILE A 17 6.532 1.645 8.218 1.00 0.00 H new ATOM 0 HG21 ILE A 17 6.820 0.672 5.360 1.00 0.00 H new ATOM 0 HG22 ILE A 17 5.283 1.253 4.676 1.00 0.00 H new ATOM 0 HG23 ILE A 17 6.255 2.322 5.715 1.00 0.00 H new ATOM 0 HD11 ILE A 17 6.447 -0.055 9.986 1.00 0.00 H new ATOM 0 HD12 ILE A 17 4.809 0.538 9.621 1.00 0.00 H new ATOM 0 HD13 ILE A 17 5.340 -1.045 9.005 1.00 0.00 H new ATOM 298 N ASP A 18 4.255 2.909 9.139 1.00 0.00 N ATOM 299 CA ASP A 18 4.692 4.006 10.005 1.00 0.00 C ATOM 300 C ASP A 18 6.241 4.090 10.060 1.00 0.00 C ATOM 301 O ASP A 18 6.878 3.117 10.480 1.00 0.00 O ATOM 302 CB ASP A 18 4.131 3.747 11.407 1.00 0.00 C ATOM 303 CG ASP A 18 2.607 3.555 11.423 1.00 0.00 C ATOM 304 OD1 ASP A 18 1.867 4.568 11.449 1.00 0.00 O ATOM 305 OD2 ASP A 18 2.153 2.384 11.415 1.00 0.00 O ATOM 0 H ASP A 18 3.950 2.092 9.668 1.00 0.00 H new ATOM 0 HA ASP A 18 4.326 4.954 9.611 1.00 0.00 H new ATOM 0 HB2 ASP A 18 4.607 2.859 11.823 1.00 0.00 H new ATOM 0 HB3 ASP A 18 4.392 4.583 12.056 1.00 0.00 H new ATOM 310 N PRO A 19 6.885 5.215 9.678 1.00 0.00 N ATOM 311 CA PRO A 19 8.353 5.318 9.600 1.00 0.00 C ATOM 312 C PRO A 19 9.062 5.166 10.959 1.00 0.00 C ATOM 313 O PRO A 19 10.197 4.687 11.022 1.00 0.00 O ATOM 314 CB PRO A 19 8.635 6.690 8.976 1.00 0.00 C ATOM 315 CG PRO A 19 7.383 7.509 9.282 1.00 0.00 C ATOM 316 CD PRO A 19 6.268 6.466 9.262 1.00 0.00 C ATOM 0 HA PRO A 19 8.751 4.497 9.003 1.00 0.00 H new ATOM 0 HB2 PRO A 19 9.525 7.148 9.408 1.00 0.00 H new ATOM 0 HB3 PRO A 19 8.806 6.611 7.902 1.00 0.00 H new ATOM 0 HG2 PRO A 19 7.453 8.005 10.250 1.00 0.00 H new ATOM 0 HG3 PRO A 19 7.219 8.287 8.537 1.00 0.00 H new ATOM 0 HD2 PRO A 19 5.459 6.746 9.937 1.00 0.00 H new ATOM 0 HD3 PRO A 19 5.835 6.376 8.266 1.00 0.00 H new ATOM 324 N GLU A 20 8.400 5.564 12.050 1.00 0.00 N ATOM 325 CA GLU A 20 8.917 5.558 13.420 1.00 0.00 C ATOM 326 C GLU A 20 8.933 4.165 14.083 1.00 0.00 C ATOM 327 O GLU A 20 9.668 3.951 15.049 1.00 0.00 O ATOM 328 CB GLU A 20 8.025 6.484 14.266 1.00 0.00 C ATOM 329 CG GLU A 20 7.952 7.951 13.804 1.00 0.00 C ATOM 330 CD GLU A 20 9.309 8.682 13.778 1.00 0.00 C ATOM 331 OE1 GLU A 20 10.232 8.347 14.559 1.00 0.00 O ATOM 332 OE2 GLU A 20 9.467 9.632 12.975 1.00 0.00 O ATOM 0 H GLU A 20 7.444 5.916 11.998 1.00 0.00 H new ATOM 0 HA GLU A 20 9.953 5.892 13.371 1.00 0.00 H new ATOM 0 HB2 GLU A 20 7.015 6.075 14.275 1.00 0.00 H new ATOM 0 HB3 GLU A 20 8.386 6.464 15.294 1.00 0.00 H new ATOM 0 HG2 GLU A 20 7.518 7.983 12.805 1.00 0.00 H new ATOM 0 HG3 GLU A 20 7.274 8.493 14.464 1.00 0.00 H new ATOM 339 N GLU A 21 8.134 3.208 13.593 1.00 0.00 N ATOM 340 CA GLU A 21 7.899 1.915 14.266 1.00 0.00 C ATOM 341 C GLU A 21 8.977 0.843 14.014 1.00 0.00 C ATOM 342 O GLU A 21 8.965 -0.213 14.647 1.00 0.00 O ATOM 343 CB GLU A 21 6.510 1.376 13.893 1.00 0.00 C ATOM 344 CG GLU A 21 5.334 2.265 14.302 1.00 0.00 C ATOM 345 CD GLU A 21 5.176 2.368 15.832 1.00 0.00 C ATOM 346 OE1 GLU A 21 4.685 1.402 16.466 1.00 0.00 O ATOM 347 OE2 GLU A 21 5.533 3.421 16.416 1.00 0.00 O ATOM 0 H GLU A 21 7.627 3.306 12.713 1.00 0.00 H new ATOM 0 HA GLU A 21 7.956 2.127 15.334 1.00 0.00 H new ATOM 0 HB2 GLU A 21 6.474 1.227 12.814 1.00 0.00 H new ATOM 0 HB3 GLU A 21 6.382 0.397 14.355 1.00 0.00 H new ATOM 0 HG2 GLU A 21 5.475 3.263 13.887 1.00 0.00 H new ATOM 0 HG3 GLU A 21 4.415 1.868 13.871 1.00 0.00 H new ATOM 354 N THR A 22 9.923 1.157 13.128 1.00 0.00 N ATOM 355 CA THR A 22 11.167 0.459 12.712 1.00 0.00 C ATOM 356 C THR A 22 10.956 -0.561 11.584 1.00 0.00 C ATOM 357 O THR A 22 9.832 -0.838 11.163 1.00 0.00 O ATOM 358 CB THR A 22 11.981 -0.175 13.868 1.00 0.00 C ATOM 359 OG1 THR A 22 11.346 -1.312 14.403 1.00 0.00 O ATOM 360 CG2 THR A 22 12.275 0.814 14.995 1.00 0.00 C ATOM 0 H THR A 22 9.832 2.028 12.606 1.00 0.00 H new ATOM 0 HA THR A 22 11.774 1.274 12.318 1.00 0.00 H new ATOM 0 HB THR A 22 12.928 -0.476 13.419 1.00 0.00 H new ATOM 0 HG1 THR A 22 10.430 -1.082 14.666 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.847 0.315 15.777 1.00 0.00 H new ATOM 0 HG22 THR A 22 12.851 1.652 14.603 1.00 0.00 H new ATOM 0 HG23 THR A 22 11.337 1.181 15.411 1.00 0.00 H new ATOM 368 N VAL A 23 12.042 -1.145 11.069 1.00 0.00 N ATOM 369 CA VAL A 23 11.998 -2.205 10.040 1.00 0.00 C ATOM 370 C VAL A 23 11.231 -3.448 10.517 1.00 0.00 C ATOM 371 O VAL A 23 10.537 -4.083 9.722 1.00 0.00 O ATOM 372 CB VAL A 23 13.426 -2.563 9.595 1.00 0.00 C ATOM 373 CG1 VAL A 23 13.491 -3.788 8.674 1.00 0.00 C ATOM 374 CG2 VAL A 23 14.071 -1.385 8.852 1.00 0.00 C ATOM 0 H VAL A 23 12.990 -0.897 11.353 1.00 0.00 H new ATOM 0 HA VAL A 23 11.449 -1.817 9.182 1.00 0.00 H new ATOM 0 HB VAL A 23 13.964 -2.796 10.514 1.00 0.00 H new ATOM 0 HG11 VAL A 23 14.528 -3.982 8.400 1.00 0.00 H new ATOM 0 HG12 VAL A 23 13.084 -4.656 9.193 1.00 0.00 H new ATOM 0 HG13 VAL A 23 12.907 -3.598 7.774 1.00 0.00 H new ATOM 0 HG21 VAL A 23 15.081 -1.657 8.545 1.00 0.00 H new ATOM 0 HG22 VAL A 23 13.477 -1.142 7.971 1.00 0.00 H new ATOM 0 HG23 VAL A 23 14.114 -0.518 9.512 1.00 0.00 H new ATOM 384 N LYS A 24 11.261 -3.771 11.816 1.00 0.00 N ATOM 385 CA LYS A 24 10.415 -4.823 12.405 1.00 0.00 C ATOM 386 C LYS A 24 8.918 -4.573 12.163 1.00 0.00 C ATOM 387 O LYS A 24 8.180 -5.516 11.885 1.00 0.00 O ATOM 388 CB LYS A 24 10.753 -4.967 13.898 1.00 0.00 C ATOM 389 CG LYS A 24 10.044 -6.170 14.539 1.00 0.00 C ATOM 390 CD LYS A 24 10.512 -6.383 15.984 1.00 0.00 C ATOM 391 CE LYS A 24 9.762 -7.566 16.609 1.00 0.00 C ATOM 392 NZ LYS A 24 10.207 -7.822 18.004 1.00 0.00 N ATOM 0 H LYS A 24 11.872 -3.311 12.491 1.00 0.00 H new ATOM 0 HA LYS A 24 10.632 -5.768 11.906 1.00 0.00 H new ATOM 0 HB2 LYS A 24 11.831 -5.077 14.016 1.00 0.00 H new ATOM 0 HB3 LYS A 24 10.466 -4.056 14.423 1.00 0.00 H new ATOM 0 HG2 LYS A 24 8.966 -6.011 14.523 1.00 0.00 H new ATOM 0 HG3 LYS A 24 10.243 -7.067 13.953 1.00 0.00 H new ATOM 0 HD2 LYS A 24 11.585 -6.571 16.003 1.00 0.00 H new ATOM 0 HD3 LYS A 24 10.336 -5.480 16.569 1.00 0.00 H new ATOM 0 HE2 LYS A 24 8.691 -7.364 16.600 1.00 0.00 H new ATOM 0 HE3 LYS A 24 9.923 -8.459 16.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 9.679 -8.628 18.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 11.224 -8.039 18.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 10.030 -6.978 18.585 1.00 0.00 H new ATOM 406 N ALA A 25 8.469 -3.316 12.203 1.00 0.00 N ATOM 407 CA ALA A 25 7.091 -2.936 11.884 1.00 0.00 C ATOM 408 C ALA A 25 6.757 -3.028 10.380 1.00 0.00 C ATOM 409 O ALA A 25 5.637 -3.400 10.029 1.00 0.00 O ATOM 410 CB ALA A 25 6.823 -1.543 12.444 1.00 0.00 C ATOM 0 H ALA A 25 9.059 -2.525 12.461 1.00 0.00 H new ATOM 0 HA ALA A 25 6.425 -3.658 12.357 1.00 0.00 H new ATOM 0 HB1 ALA A 25 5.799 -1.249 12.213 1.00 0.00 H new ATOM 0 HB2 ALA A 25 6.962 -1.552 13.525 1.00 0.00 H new ATOM 0 HB3 ALA A 25 7.515 -0.831 11.995 1.00 0.00 H new ATOM 416 N LEU A 26 7.708 -2.750 9.478 1.00 0.00 N ATOM 417 CA LEU A 26 7.562 -3.012 8.039 1.00 0.00 C ATOM 418 C LEU A 26 7.249 -4.500 7.803 1.00 0.00 C ATOM 419 O LEU A 26 6.207 -4.849 7.244 1.00 0.00 O ATOM 420 CB LEU A 26 8.826 -2.508 7.305 1.00 0.00 C ATOM 421 CG LEU A 26 8.930 -2.868 5.814 1.00 0.00 C ATOM 422 CD1 LEU A 26 7.643 -2.527 5.079 1.00 0.00 C ATOM 423 CD2 LEU A 26 10.082 -2.097 5.170 1.00 0.00 C ATOM 0 H LEU A 26 8.606 -2.335 9.727 1.00 0.00 H new ATOM 0 HA LEU A 26 6.717 -2.464 7.623 1.00 0.00 H new ATOM 0 HB2 LEU A 26 8.868 -1.423 7.400 1.00 0.00 H new ATOM 0 HB3 LEU A 26 9.702 -2.907 7.816 1.00 0.00 H new ATOM 0 HG LEU A 26 9.109 -3.941 5.741 1.00 0.00 H new ATOM 0 HD11 LEU A 26 7.744 -2.792 4.026 1.00 0.00 H new ATOM 0 HD12 LEU A 26 6.815 -3.086 5.516 1.00 0.00 H new ATOM 0 HD13 LEU A 26 7.446 -1.459 5.167 1.00 0.00 H new ATOM 0 HD21 LEU A 26 10.149 -2.358 4.114 1.00 0.00 H new ATOM 0 HD22 LEU A 26 9.903 -1.026 5.269 1.00 0.00 H new ATOM 0 HD23 LEU A 26 11.016 -2.356 5.668 1.00 0.00 H new ATOM 435 N LYS A 27 8.117 -5.374 8.319 1.00 0.00 N ATOM 436 CA LYS A 27 7.912 -6.832 8.374 1.00 0.00 C ATOM 437 C LYS A 27 6.557 -7.240 8.967 1.00 0.00 C ATOM 438 O LYS A 27 5.897 -8.108 8.400 1.00 0.00 O ATOM 439 CB LYS A 27 9.058 -7.520 9.128 1.00 0.00 C ATOM 440 CG LYS A 27 10.412 -7.433 8.409 1.00 0.00 C ATOM 441 CD LYS A 27 11.425 -8.319 9.144 1.00 0.00 C ATOM 442 CE LYS A 27 12.736 -8.464 8.367 1.00 0.00 C ATOM 443 NZ LYS A 27 13.648 -9.394 9.075 1.00 0.00 N ATOM 0 H LYS A 27 9.008 -5.084 8.722 1.00 0.00 H new ATOM 0 HA LYS A 27 7.909 -7.171 7.338 1.00 0.00 H new ATOM 0 HB2 LYS A 27 9.152 -7.070 10.116 1.00 0.00 H new ATOM 0 HB3 LYS A 27 8.804 -8.569 9.278 1.00 0.00 H new ATOM 0 HG2 LYS A 27 10.310 -7.757 7.373 1.00 0.00 H new ATOM 0 HG3 LYS A 27 10.761 -6.401 8.387 1.00 0.00 H new ATOM 0 HD2 LYS A 27 11.632 -7.894 10.126 1.00 0.00 H new ATOM 0 HD3 LYS A 27 10.991 -9.305 9.308 1.00 0.00 H new ATOM 0 HE2 LYS A 27 12.533 -8.836 7.363 1.00 0.00 H new ATOM 0 HE3 LYS A 27 13.212 -7.490 8.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 14.414 -9.685 8.434 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 14.054 -8.917 9.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 13.117 -10.234 9.383 1.00 0.00 H new ATOM 457 N GLU A 28 6.120 -6.611 10.062 1.00 0.00 N ATOM 458 CA GLU A 28 4.793 -6.806 10.681 1.00 0.00 C ATOM 459 C GLU A 28 3.649 -6.624 9.671 1.00 0.00 C ATOM 460 O GLU A 28 2.781 -7.491 9.544 1.00 0.00 O ATOM 461 CB GLU A 28 4.640 -5.911 11.941 1.00 0.00 C ATOM 462 CG GLU A 28 3.489 -4.875 11.972 1.00 0.00 C ATOM 463 CD GLU A 28 3.436 -4.043 13.266 1.00 0.00 C ATOM 464 OE1 GLU A 28 3.695 -4.572 14.375 1.00 0.00 O ATOM 465 OE2 GLU A 28 3.086 -2.840 13.170 1.00 0.00 O ATOM 0 H GLU A 28 6.692 -5.930 10.562 1.00 0.00 H new ATOM 0 HA GLU A 28 4.724 -7.842 11.013 1.00 0.00 H new ATOM 0 HB2 GLU A 28 4.519 -6.568 12.802 1.00 0.00 H new ATOM 0 HB3 GLU A 28 5.577 -5.371 12.081 1.00 0.00 H new ATOM 0 HG2 GLU A 28 3.596 -4.201 11.122 1.00 0.00 H new ATOM 0 HG3 GLU A 28 2.540 -5.396 11.847 1.00 0.00 H new ATOM 472 N LYS A 29 3.654 -5.510 8.927 1.00 0.00 N ATOM 473 CA LYS A 29 2.626 -5.195 7.929 1.00 0.00 C ATOM 474 C LYS A 29 2.663 -6.163 6.744 1.00 0.00 C ATOM 475 O LYS A 29 1.610 -6.614 6.300 1.00 0.00 O ATOM 476 CB LYS A 29 2.760 -3.728 7.478 1.00 0.00 C ATOM 477 CG LYS A 29 1.551 -2.867 7.878 1.00 0.00 C ATOM 478 CD LYS A 29 1.438 -2.550 9.380 1.00 0.00 C ATOM 479 CE LYS A 29 2.480 -1.512 9.820 1.00 0.00 C ATOM 480 NZ LYS A 29 2.244 -1.039 11.210 1.00 0.00 N ATOM 0 H LYS A 29 4.379 -4.796 9.002 1.00 0.00 H new ATOM 0 HA LYS A 29 1.649 -5.321 8.394 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.664 -3.301 7.912 1.00 0.00 H new ATOM 0 HB3 LYS A 29 2.881 -3.696 6.395 1.00 0.00 H new ATOM 0 HG2 LYS A 29 1.597 -1.927 7.328 1.00 0.00 H new ATOM 0 HG3 LYS A 29 0.641 -3.378 7.562 1.00 0.00 H new ATOM 0 HD2 LYS A 29 0.438 -2.177 9.599 1.00 0.00 H new ATOM 0 HD3 LYS A 29 1.570 -3.466 9.956 1.00 0.00 H new ATOM 0 HE2 LYS A 29 3.477 -1.947 9.750 1.00 0.00 H new ATOM 0 HE3 LYS A 29 2.454 -0.662 9.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 2.727 -0.129 11.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 1.223 -0.918 11.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.617 -1.739 11.883 1.00 0.00 H new ATOM 494 N ILE A 30 3.856 -6.526 6.264 1.00 0.00 N ATOM 495 CA ILE A 30 4.049 -7.533 5.205 1.00 0.00 C ATOM 496 C ILE A 30 3.503 -8.901 5.645 1.00 0.00 C ATOM 497 O ILE A 30 2.728 -9.512 4.911 1.00 0.00 O ATOM 498 CB ILE A 30 5.537 -7.619 4.795 1.00 0.00 C ATOM 499 CG1 ILE A 30 6.022 -6.287 4.177 1.00 0.00 C ATOM 500 CG2 ILE A 30 5.765 -8.760 3.783 1.00 0.00 C ATOM 501 CD1 ILE A 30 7.546 -6.140 4.209 1.00 0.00 C ATOM 0 H ILE A 30 4.731 -6.125 6.602 1.00 0.00 H new ATOM 0 HA ILE A 30 3.483 -7.221 4.327 1.00 0.00 H new ATOM 0 HB ILE A 30 6.110 -7.822 5.700 1.00 0.00 H new ATOM 0 HG12 ILE A 30 5.677 -6.223 3.145 1.00 0.00 H new ATOM 0 HG13 ILE A 30 5.570 -5.455 4.717 1.00 0.00 H new ATOM 0 HG21 ILE A 30 6.820 -8.799 3.511 1.00 0.00 H new ATOM 0 HG22 ILE A 30 5.471 -9.709 4.232 1.00 0.00 H new ATOM 0 HG23 ILE A 30 5.166 -8.580 2.890 1.00 0.00 H new ATOM 0 HD11 ILE A 30 7.829 -5.187 3.762 1.00 0.00 H new ATOM 0 HD12 ILE A 30 7.893 -6.174 5.242 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.002 -6.954 3.646 1.00 0.00 H new ATOM 513 N GLU A 31 3.860 -9.373 6.844 1.00 0.00 N ATOM 514 CA GLU A 31 3.355 -10.634 7.406 1.00 0.00 C ATOM 515 C GLU A 31 1.820 -10.618 7.531 1.00 0.00 C ATOM 516 O GLU A 31 1.156 -11.582 7.151 1.00 0.00 O ATOM 517 CB GLU A 31 4.008 -10.900 8.776 1.00 0.00 C ATOM 518 CG GLU A 31 3.683 -12.307 9.299 1.00 0.00 C ATOM 519 CD GLU A 31 4.182 -12.534 10.733 1.00 0.00 C ATOM 520 OE1 GLU A 31 3.605 -11.960 11.684 1.00 0.00 O ATOM 521 OE2 GLU A 31 5.093 -13.373 10.935 1.00 0.00 O ATOM 0 H GLU A 31 4.513 -8.887 7.459 1.00 0.00 H new ATOM 0 HA GLU A 31 3.621 -11.441 6.724 1.00 0.00 H new ATOM 0 HB2 GLU A 31 5.089 -10.784 8.692 1.00 0.00 H new ATOM 0 HB3 GLU A 31 3.662 -10.156 9.494 1.00 0.00 H new ATOM 0 HG2 GLU A 31 2.605 -12.463 9.264 1.00 0.00 H new ATOM 0 HG3 GLU A 31 4.134 -13.049 8.640 1.00 0.00 H new ATOM 528 N SER A 32 1.247 -9.514 8.024 1.00 0.00 N ATOM 529 CA SER A 32 -0.203 -9.301 8.131 1.00 0.00 C ATOM 530 C SER A 32 -0.911 -9.360 6.767 1.00 0.00 C ATOM 531 O SER A 32 -1.902 -10.077 6.607 1.00 0.00 O ATOM 532 CB SER A 32 -0.470 -7.958 8.823 1.00 0.00 C ATOM 533 OG SER A 32 -1.855 -7.798 9.088 1.00 0.00 O ATOM 0 H SER A 32 1.792 -8.723 8.369 1.00 0.00 H new ATOM 0 HA SER A 32 -0.617 -10.114 8.728 1.00 0.00 H new ATOM 0 HB2 SER A 32 0.092 -7.905 9.755 1.00 0.00 H new ATOM 0 HB3 SER A 32 -0.118 -7.142 8.192 1.00 0.00 H new ATOM 0 HG SER A 32 -2.006 -6.937 9.531 1.00 0.00 H new ATOM 539 N GLU A 33 -0.401 -8.635 5.766 1.00 0.00 N ATOM 540 CA GLU A 33 -0.972 -8.551 4.415 1.00 0.00 C ATOM 541 C GLU A 33 -0.863 -9.877 3.641 1.00 0.00 C ATOM 542 O GLU A 33 -1.859 -10.371 3.104 1.00 0.00 O ATOM 543 CB GLU A 33 -0.267 -7.416 3.647 1.00 0.00 C ATOM 544 CG GLU A 33 -0.946 -7.032 2.324 1.00 0.00 C ATOM 545 CD GLU A 33 -2.359 -6.448 2.535 1.00 0.00 C ATOM 546 OE1 GLU A 33 -2.484 -5.307 3.044 1.00 0.00 O ATOM 547 OE2 GLU A 33 -3.358 -7.122 2.188 1.00 0.00 O ATOM 0 H GLU A 33 0.444 -8.074 5.875 1.00 0.00 H new ATOM 0 HA GLU A 33 -2.037 -8.339 4.510 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -0.220 -6.535 4.287 1.00 0.00 H new ATOM 0 HB3 GLU A 33 0.760 -7.716 3.441 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -0.329 -6.302 1.801 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -1.011 -7.912 1.684 1.00 0.00 H new ATOM 554 N LYS A 34 0.347 -10.449 3.556 1.00 0.00 N ATOM 555 CA LYS A 34 0.666 -11.607 2.699 1.00 0.00 C ATOM 556 C LYS A 34 0.471 -12.969 3.382 1.00 0.00 C ATOM 557 O LYS A 34 0.404 -13.994 2.702 1.00 0.00 O ATOM 558 CB LYS A 34 2.106 -11.473 2.163 1.00 0.00 C ATOM 559 CG LYS A 34 2.421 -10.137 1.458 1.00 0.00 C ATOM 560 CD LYS A 34 1.430 -9.737 0.349 1.00 0.00 C ATOM 561 CE LYS A 34 1.311 -10.756 -0.794 1.00 0.00 C ATOM 562 NZ LYS A 34 2.546 -10.825 -1.616 1.00 0.00 N ATOM 0 H LYS A 34 1.149 -10.115 4.090 1.00 0.00 H new ATOM 0 HA LYS A 34 -0.050 -11.589 1.877 1.00 0.00 H new ATOM 0 HB2 LYS A 34 2.800 -11.600 2.994 1.00 0.00 H new ATOM 0 HB3 LYS A 34 2.294 -12.288 1.464 1.00 0.00 H new ATOM 0 HG2 LYS A 34 2.444 -9.345 2.207 1.00 0.00 H new ATOM 0 HG3 LYS A 34 3.420 -10.198 1.027 1.00 0.00 H new ATOM 0 HD2 LYS A 34 0.445 -9.592 0.794 1.00 0.00 H new ATOM 0 HD3 LYS A 34 1.737 -8.777 -0.067 1.00 0.00 H new ATOM 0 HE2 LYS A 34 1.097 -11.741 -0.379 1.00 0.00 H new ATOM 0 HE3 LYS A 34 0.468 -10.488 -1.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 2.376 -10.371 -2.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 3.319 -10.332 -1.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 2.809 -11.820 -1.764 1.00 0.00 H new ATOM 576 N GLY A 35 0.353 -12.977 4.709 1.00 0.00 N ATOM 577 CA GLY A 35 0.216 -14.155 5.571 1.00 0.00 C ATOM 578 C GLY A 35 1.563 -14.704 6.062 1.00 0.00 C ATOM 579 O GLY A 35 2.580 -14.633 5.361 1.00 0.00 O ATOM 0 H GLY A 35 0.350 -12.110 5.246 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -0.400 -13.897 6.433 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -0.311 -14.938 5.025 1.00 0.00 H new ATOM 583 N LYS A 36 1.557 -15.324 7.252 1.00 0.00 N ATOM 584 CA LYS A 36 2.742 -15.943 7.882 1.00 0.00 C ATOM 585 C LYS A 36 3.320 -17.111 7.073 1.00 0.00 C ATOM 586 O LYS A 36 4.512 -17.390 7.165 1.00 0.00 O ATOM 587 CB LYS A 36 2.419 -16.433 9.307 1.00 0.00 C ATOM 588 CG LYS A 36 1.882 -15.357 10.261 1.00 0.00 C ATOM 589 CD LYS A 36 1.681 -15.868 11.698 1.00 0.00 C ATOM 590 CE LYS A 36 2.976 -16.261 12.434 1.00 0.00 C ATOM 591 NZ LYS A 36 3.839 -15.094 12.764 1.00 0.00 N ATOM 0 H LYS A 36 0.713 -15.413 7.818 1.00 0.00 H new ATOM 0 HA LYS A 36 3.497 -15.157 7.917 1.00 0.00 H new ATOM 0 HB2 LYS A 36 1.685 -17.236 9.240 1.00 0.00 H new ATOM 0 HB3 LYS A 36 3.323 -16.862 9.740 1.00 0.00 H new ATOM 0 HG2 LYS A 36 2.574 -14.515 10.275 1.00 0.00 H new ATOM 0 HG3 LYS A 36 0.932 -14.983 9.879 1.00 0.00 H new ATOM 0 HD2 LYS A 36 1.173 -15.095 12.275 1.00 0.00 H new ATOM 0 HD3 LYS A 36 1.019 -16.733 11.671 1.00 0.00 H new ATOM 0 HE2 LYS A 36 2.719 -16.786 13.354 1.00 0.00 H new ATOM 0 HE3 LYS A 36 3.540 -16.959 11.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 4.563 -15.381 13.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 4.302 -14.749 11.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 3.256 -14.335 13.171 1.00 0.00 H new ATOM 605 N ASP A 37 2.497 -17.786 6.270 1.00 0.00 N ATOM 606 CA ASP A 37 2.918 -18.871 5.372 1.00 0.00 C ATOM 607 C ASP A 37 3.835 -18.379 4.236 1.00 0.00 C ATOM 608 O ASP A 37 4.771 -19.080 3.844 1.00 0.00 O ATOM 609 CB ASP A 37 1.680 -19.548 4.766 1.00 0.00 C ATOM 610 CG ASP A 37 0.848 -20.286 5.826 1.00 0.00 C ATOM 611 OD1 ASP A 37 1.208 -21.432 6.190 1.00 0.00 O ATOM 612 OD2 ASP A 37 -0.172 -19.725 6.294 1.00 0.00 O ATOM 0 H ASP A 37 1.497 -17.592 6.222 1.00 0.00 H new ATOM 0 HA ASP A 37 3.490 -19.580 5.971 1.00 0.00 H new ATOM 0 HB2 ASP A 37 1.060 -18.797 4.277 1.00 0.00 H new ATOM 0 HB3 ASP A 37 1.993 -20.253 3.996 1.00 0.00 H new ATOM 617 N ALA A 38 3.572 -17.178 3.710 1.00 0.00 N ATOM 618 CA ALA A 38 4.345 -16.555 2.636 1.00 0.00 C ATOM 619 C ALA A 38 5.581 -15.809 3.172 1.00 0.00 C ATOM 620 O ALA A 38 6.702 -16.060 2.724 1.00 0.00 O ATOM 621 CB ALA A 38 3.418 -15.619 1.850 1.00 0.00 C ATOM 0 H ALA A 38 2.795 -16.599 4.029 1.00 0.00 H new ATOM 0 HA ALA A 38 4.728 -17.331 1.974 1.00 0.00 H new ATOM 0 HB1 ALA A 38 3.978 -15.145 1.044 1.00 0.00 H new ATOM 0 HB2 ALA A 38 2.593 -16.193 1.429 1.00 0.00 H new ATOM 0 HB3 ALA A 38 3.024 -14.853 2.517 1.00 0.00 H new ATOM 627 N PHE A 39 5.378 -14.892 4.127 1.00 0.00 N ATOM 628 CA PHE A 39 6.401 -13.974 4.643 1.00 0.00 C ATOM 629 C PHE A 39 6.303 -13.820 6.174 1.00 0.00 C ATOM 630 O PHE A 39 5.804 -12.801 6.658 1.00 0.00 O ATOM 631 CB PHE A 39 6.283 -12.623 3.911 1.00 0.00 C ATOM 632 CG PHE A 39 6.666 -12.684 2.441 1.00 0.00 C ATOM 633 CD1 PHE A 39 8.021 -12.697 2.058 1.00 0.00 C ATOM 634 CD2 PHE A 39 5.666 -12.769 1.454 1.00 0.00 C ATOM 635 CE1 PHE A 39 8.370 -12.799 0.698 1.00 0.00 C ATOM 636 CE2 PHE A 39 6.015 -12.872 0.095 1.00 0.00 C ATOM 637 CZ PHE A 39 7.368 -12.884 -0.284 1.00 0.00 C ATOM 0 H PHE A 39 4.470 -14.765 4.575 1.00 0.00 H new ATOM 0 HA PHE A 39 7.390 -14.389 4.446 1.00 0.00 H new ATOM 0 HB2 PHE A 39 5.257 -12.264 3.995 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.918 -11.893 4.412 1.00 0.00 H new ATOM 0 HD1 PHE A 39 8.794 -12.629 2.809 1.00 0.00 H new ATOM 0 HD2 PHE A 39 4.625 -12.755 1.742 1.00 0.00 H new ATOM 0 HE1 PHE A 39 9.410 -12.812 0.408 1.00 0.00 H new ATOM 0 HE2 PHE A 39 5.243 -12.942 -0.657 1.00 0.00 H new ATOM 0 HZ PHE A 39 7.637 -12.958 -1.327 1.00 0.00 H new ATOM 647 N PRO A 40 6.788 -14.796 6.967 1.00 0.00 N ATOM 648 CA PRO A 40 6.864 -14.658 8.421 1.00 0.00 C ATOM 649 C PRO A 40 7.950 -13.638 8.794 1.00 0.00 C ATOM 650 O PRO A 40 8.972 -13.564 8.113 1.00 0.00 O ATOM 651 CB PRO A 40 7.189 -16.062 8.938 1.00 0.00 C ATOM 652 CG PRO A 40 7.981 -16.695 7.793 1.00 0.00 C ATOM 653 CD PRO A 40 7.420 -16.036 6.531 1.00 0.00 C ATOM 0 HA PRO A 40 5.939 -14.288 8.862 1.00 0.00 H new ATOM 0 HB2 PRO A 40 7.774 -16.025 9.857 1.00 0.00 H new ATOM 0 HB3 PRO A 40 6.283 -16.627 9.159 1.00 0.00 H new ATOM 0 HG2 PRO A 40 9.050 -16.507 7.898 1.00 0.00 H new ATOM 0 HG3 PRO A 40 7.848 -17.777 7.769 1.00 0.00 H new ATOM 0 HD2 PRO A 40 8.213 -15.836 5.810 1.00 0.00 H new ATOM 0 HD3 PRO A 40 6.699 -16.688 6.039 1.00 0.00 H new ATOM 661 N VAL A 41 7.786 -12.866 9.874 1.00 0.00 N ATOM 662 CA VAL A 41 8.772 -11.843 10.320 1.00 0.00 C ATOM 663 C VAL A 41 10.188 -12.420 10.432 1.00 0.00 C ATOM 664 O VAL A 41 11.156 -11.823 9.958 1.00 0.00 O ATOM 665 CB VAL A 41 8.353 -11.206 11.663 1.00 0.00 C ATOM 666 CG1 VAL A 41 9.419 -10.271 12.254 1.00 0.00 C ATOM 667 CG2 VAL A 41 7.077 -10.384 11.478 1.00 0.00 C ATOM 0 H VAL A 41 6.964 -12.924 10.475 1.00 0.00 H new ATOM 0 HA VAL A 41 8.784 -11.068 9.554 1.00 0.00 H new ATOM 0 HB VAL A 41 8.205 -12.039 12.351 1.00 0.00 H new ATOM 0 HG11 VAL A 41 9.059 -9.858 13.196 1.00 0.00 H new ATOM 0 HG12 VAL A 41 10.337 -10.831 12.430 1.00 0.00 H new ATOM 0 HG13 VAL A 41 9.618 -9.459 11.555 1.00 0.00 H new ATOM 0 HG21 VAL A 41 6.790 -9.939 12.431 1.00 0.00 H new ATOM 0 HG22 VAL A 41 7.255 -9.595 10.748 1.00 0.00 H new ATOM 0 HG23 VAL A 41 6.275 -11.032 11.124 1.00 0.00 H new ATOM 677 N ALA A 42 10.297 -13.602 11.036 1.00 0.00 N ATOM 678 CA ALA A 42 11.566 -14.293 11.272 1.00 0.00 C ATOM 679 C ALA A 42 12.230 -14.911 10.015 1.00 0.00 C ATOM 680 O ALA A 42 13.414 -15.256 10.065 1.00 0.00 O ATOM 681 CB ALA A 42 11.321 -15.364 12.344 1.00 0.00 C ATOM 0 H ALA A 42 9.489 -14.118 11.383 1.00 0.00 H new ATOM 0 HA ALA A 42 12.285 -13.542 11.601 1.00 0.00 H new ATOM 0 HB1 ALA A 42 12.250 -15.898 12.543 1.00 0.00 H new ATOM 0 HB2 ALA A 42 10.972 -14.888 13.261 1.00 0.00 H new ATOM 0 HB3 ALA A 42 10.567 -16.067 11.990 1.00 0.00 H new ATOM 687 N GLY A 43 11.504 -15.051 8.896 1.00 0.00 N ATOM 688 CA GLY A 43 11.986 -15.666 7.644 1.00 0.00 C ATOM 689 C GLY A 43 12.063 -14.714 6.450 1.00 0.00 C ATOM 690 O GLY A 43 12.861 -14.945 5.538 1.00 0.00 O ATOM 0 H GLY A 43 10.537 -14.731 8.832 1.00 0.00 H new ATOM 0 HA2 GLY A 43 12.976 -16.086 7.820 1.00 0.00 H new ATOM 0 HA3 GLY A 43 11.328 -16.496 7.387 1.00 0.00 H new ATOM 694 N GLN A 44 11.270 -13.640 6.440 1.00 0.00 N ATOM 695 CA GLN A 44 11.377 -12.585 5.433 1.00 0.00 C ATOM 696 C GLN A 44 12.653 -11.748 5.645 1.00 0.00 C ATOM 697 O GLN A 44 13.047 -11.468 6.783 1.00 0.00 O ATOM 698 CB GLN A 44 10.097 -11.734 5.384 1.00 0.00 C ATOM 699 CG GLN A 44 9.924 -10.762 6.557 1.00 0.00 C ATOM 700 CD GLN A 44 8.619 -9.987 6.450 1.00 0.00 C ATOM 701 OE1 GLN A 44 8.524 -8.993 5.752 1.00 0.00 O ATOM 702 NE2 GLN A 44 7.578 -10.380 7.148 1.00 0.00 N ATOM 0 H GLN A 44 10.536 -13.479 7.130 1.00 0.00 H new ATOM 0 HA GLN A 44 11.473 -13.049 4.451 1.00 0.00 H new ATOM 0 HB2 GLN A 44 10.092 -11.164 4.455 1.00 0.00 H new ATOM 0 HB3 GLN A 44 9.235 -12.401 5.353 1.00 0.00 H new ATOM 0 HG2 GLN A 44 9.944 -11.316 7.496 1.00 0.00 H new ATOM 0 HG3 GLN A 44 10.762 -10.065 6.580 1.00 0.00 H new ATOM 0 HE21 GLN A 44 7.643 -11.210 7.737 1.00 0.00 H new ATOM 0 HE22 GLN A 44 6.705 -9.855 7.101 1.00 0.00 H new ATOM 711 N LYS A 45 13.271 -11.296 4.551 1.00 0.00 N ATOM 712 CA LYS A 45 14.384 -10.333 4.537 1.00 0.00 C ATOM 713 C LYS A 45 14.038 -9.157 3.626 1.00 0.00 C ATOM 714 O LYS A 45 13.365 -9.327 2.608 1.00 0.00 O ATOM 715 CB LYS A 45 15.714 -11.001 4.133 1.00 0.00 C ATOM 716 CG LYS A 45 16.039 -12.245 4.977 1.00 0.00 C ATOM 717 CD LYS A 45 17.505 -12.675 4.820 1.00 0.00 C ATOM 718 CE LYS A 45 17.823 -13.937 5.638 1.00 0.00 C ATOM 719 NZ LYS A 45 17.778 -13.703 7.106 1.00 0.00 N ATOM 0 H LYS A 45 13.003 -11.599 3.615 1.00 0.00 H new ATOM 0 HA LYS A 45 14.527 -9.955 5.549 1.00 0.00 H new ATOM 0 HB2 LYS A 45 15.668 -11.283 3.081 1.00 0.00 H new ATOM 0 HB3 LYS A 45 16.523 -10.278 4.234 1.00 0.00 H new ATOM 0 HG2 LYS A 45 15.832 -12.036 6.027 1.00 0.00 H new ATOM 0 HG3 LYS A 45 15.386 -13.066 4.681 1.00 0.00 H new ATOM 0 HD2 LYS A 45 17.718 -12.861 3.767 1.00 0.00 H new ATOM 0 HD3 LYS A 45 18.158 -11.862 5.138 1.00 0.00 H new ATOM 0 HE2 LYS A 45 17.111 -14.721 5.378 1.00 0.00 H new ATOM 0 HE3 LYS A 45 18.813 -14.302 5.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 18.033 -14.579 7.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 18.451 -12.952 7.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 16.818 -13.415 7.382 1.00 0.00 H new ATOM 733 N LEU A 46 14.498 -7.972 4.017 1.00 0.00 N ATOM 734 CA LEU A 46 14.147 -6.668 3.457 1.00 0.00 C ATOM 735 C LEU A 46 15.408 -5.963 2.955 1.00 0.00 C ATOM 736 O LEU A 46 16.371 -5.832 3.705 1.00 0.00 O ATOM 737 CB LEU A 46 13.463 -5.837 4.565 1.00 0.00 C ATOM 738 CG LEU A 46 11.934 -5.732 4.499 1.00 0.00 C ATOM 739 CD1 LEU A 46 11.520 -4.914 3.278 1.00 0.00 C ATOM 740 CD2 LEU A 46 11.260 -7.101 4.472 1.00 0.00 C ATOM 0 H LEU A 46 15.168 -7.890 4.782 1.00 0.00 H new ATOM 0 HA LEU A 46 13.467 -6.785 2.613 1.00 0.00 H new ATOM 0 HB2 LEU A 46 13.734 -6.267 5.529 1.00 0.00 H new ATOM 0 HB3 LEU A 46 13.875 -4.828 4.538 1.00 0.00 H new ATOM 0 HG LEU A 46 11.601 -5.228 5.407 1.00 0.00 H new ATOM 0 HD11 LEU A 46 10.433 -4.844 3.238 1.00 0.00 H new ATOM 0 HD12 LEU A 46 11.946 -3.913 3.349 1.00 0.00 H new ATOM 0 HD13 LEU A 46 11.886 -5.400 2.373 1.00 0.00 H new ATOM 0 HD21 LEU A 46 10.179 -6.973 4.425 1.00 0.00 H new ATOM 0 HD22 LEU A 46 11.598 -7.656 3.597 1.00 0.00 H new ATOM 0 HD23 LEU A 46 11.521 -7.653 5.375 1.00 0.00 H new ATOM 752 N ILE A 47 15.413 -5.512 1.702 1.00 0.00 N ATOM 753 CA ILE A 47 16.592 -4.982 1.001 1.00 0.00 C ATOM 754 C ILE A 47 16.246 -3.685 0.256 1.00 0.00 C ATOM 755 O ILE A 47 15.301 -3.645 -0.536 1.00 0.00 O ATOM 756 CB ILE A 47 17.165 -6.091 0.084 1.00 0.00 C ATOM 757 CG1 ILE A 47 17.797 -7.246 0.907 1.00 0.00 C ATOM 758 CG2 ILE A 47 18.245 -5.575 -0.865 1.00 0.00 C ATOM 759 CD1 ILE A 47 16.948 -8.512 0.891 1.00 0.00 C ATOM 0 H ILE A 47 14.572 -5.503 1.124 1.00 0.00 H new ATOM 0 HA ILE A 47 17.371 -4.708 1.713 1.00 0.00 H new ATOM 0 HB ILE A 47 16.310 -6.447 -0.491 1.00 0.00 H new ATOM 0 HG12 ILE A 47 18.786 -7.472 0.509 1.00 0.00 H new ATOM 0 HG13 ILE A 47 17.935 -6.919 1.938 1.00 0.00 H new ATOM 0 HG21 ILE A 47 18.609 -6.396 -1.483 1.00 0.00 H new ATOM 0 HG22 ILE A 47 17.826 -4.798 -1.505 1.00 0.00 H new ATOM 0 HG23 ILE A 47 19.071 -5.162 -0.286 1.00 0.00 H new ATOM 0 HD11 ILE A 47 17.438 -9.286 1.482 1.00 0.00 H new ATOM 0 HD12 ILE A 47 15.967 -8.298 1.315 1.00 0.00 H new ATOM 0 HD13 ILE A 47 16.831 -8.859 -0.136 1.00 0.00 H new ATOM 771 N TYR A 48 17.020 -2.622 0.504 1.00 0.00 N ATOM 772 CA TYR A 48 16.935 -1.341 -0.207 1.00 0.00 C ATOM 773 C TYR A 48 18.325 -0.861 -0.648 1.00 0.00 C ATOM 774 O TYR A 48 19.277 -0.941 0.128 1.00 0.00 O ATOM 775 CB TYR A 48 16.252 -0.284 0.670 1.00 0.00 C ATOM 776 CG TYR A 48 15.810 0.972 -0.065 1.00 0.00 C ATOM 777 CD1 TYR A 48 14.781 0.897 -1.024 1.00 0.00 C ATOM 778 CD2 TYR A 48 16.383 2.223 0.243 1.00 0.00 C ATOM 779 CE1 TYR A 48 14.300 2.065 -1.645 1.00 0.00 C ATOM 780 CE2 TYR A 48 15.913 3.393 -0.387 1.00 0.00 C ATOM 781 CZ TYR A 48 14.861 3.319 -1.327 1.00 0.00 C ATOM 782 OH TYR A 48 14.372 4.447 -1.914 1.00 0.00 O ATOM 0 H TYR A 48 17.742 -2.629 1.224 1.00 0.00 H new ATOM 0 HA TYR A 48 16.332 -1.491 -1.102 1.00 0.00 H new ATOM 0 HB2 TYR A 48 15.380 -0.735 1.144 1.00 0.00 H new ATOM 0 HB3 TYR A 48 16.937 0.002 1.468 1.00 0.00 H new ATOM 0 HD1 TYR A 48 14.359 -0.062 -1.284 1.00 0.00 H new ATOM 0 HD2 TYR A 48 17.185 2.285 0.964 1.00 0.00 H new ATOM 0 HE1 TYR A 48 13.499 2.001 -2.367 1.00 0.00 H new ATOM 0 HE2 TYR A 48 16.358 4.348 -0.151 1.00 0.00 H new ATOM 0 HH TYR A 48 14.867 5.227 -1.587 1.00 0.00 H new ATOM 792 N ALA A 49 18.452 -0.350 -1.878 1.00 0.00 N ATOM 793 CA ALA A 49 19.704 0.152 -2.466 1.00 0.00 C ATOM 794 C ALA A 49 20.940 -0.764 -2.234 1.00 0.00 C ATOM 795 O ALA A 49 22.047 -0.295 -1.959 1.00 0.00 O ATOM 796 CB ALA A 49 19.889 1.596 -1.977 1.00 0.00 C ATOM 0 H ALA A 49 17.660 -0.271 -2.515 1.00 0.00 H new ATOM 0 HA ALA A 49 19.624 0.139 -3.553 1.00 0.00 H new ATOM 0 HB1 ALA A 49 20.810 2.006 -2.392 1.00 0.00 H new ATOM 0 HB2 ALA A 49 19.043 2.202 -2.302 1.00 0.00 H new ATOM 0 HB3 ALA A 49 19.946 1.607 -0.889 1.00 0.00 H new ATOM 802 N GLY A 50 20.739 -2.084 -2.316 1.00 0.00 N ATOM 803 CA GLY A 50 21.734 -3.140 -2.095 1.00 0.00 C ATOM 804 C GLY A 50 22.269 -3.246 -0.658 1.00 0.00 C ATOM 805 O GLY A 50 23.402 -3.690 -0.459 1.00 0.00 O ATOM 0 H GLY A 50 19.823 -2.466 -2.552 1.00 0.00 H new ATOM 0 HA2 GLY A 50 21.292 -4.097 -2.372 1.00 0.00 H new ATOM 0 HA3 GLY A 50 22.575 -2.971 -2.767 1.00 0.00 H new ATOM 809 N LYS A 51 21.462 -2.856 0.339 1.00 0.00 N ATOM 810 CA LYS A 51 21.711 -2.990 1.786 1.00 0.00 C ATOM 811 C LYS A 51 20.496 -3.605 2.491 1.00 0.00 C ATOM 812 O LYS A 51 19.364 -3.156 2.298 1.00 0.00 O ATOM 813 CB LYS A 51 22.038 -1.613 2.385 1.00 0.00 C ATOM 814 CG LYS A 51 23.469 -1.164 2.036 1.00 0.00 C ATOM 815 CD LYS A 51 23.660 0.349 2.182 1.00 0.00 C ATOM 816 CE LYS A 51 22.956 1.067 1.024 1.00 0.00 C ATOM 817 NZ LYS A 51 23.181 2.535 1.071 1.00 0.00 N ATOM 0 H LYS A 51 20.564 -2.412 0.148 1.00 0.00 H new ATOM 0 HA LYS A 51 22.561 -3.655 1.936 1.00 0.00 H new ATOM 0 HB2 LYS A 51 21.325 -0.877 2.014 1.00 0.00 H new ATOM 0 HB3 LYS A 51 21.923 -1.651 3.468 1.00 0.00 H new ATOM 0 HG2 LYS A 51 24.177 -1.681 2.684 1.00 0.00 H new ATOM 0 HG3 LYS A 51 23.700 -1.459 1.012 1.00 0.00 H new ATOM 0 HD2 LYS A 51 23.253 0.687 3.135 1.00 0.00 H new ATOM 0 HD3 LYS A 51 24.722 0.594 2.184 1.00 0.00 H new ATOM 0 HE2 LYS A 51 23.321 0.673 0.076 1.00 0.00 H new ATOM 0 HE3 LYS A 51 21.886 0.861 1.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 22.690 2.987 0.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 22.810 2.915 1.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 24.200 2.732 1.007 1.00 0.00 H new ATOM 831 N ILE A 52 20.716 -4.641 3.304 1.00 0.00 N ATOM 832 CA ILE A 52 19.662 -5.301 4.087 1.00 0.00 C ATOM 833 C ILE A 52 19.221 -4.419 5.262 1.00 0.00 C ATOM 834 O ILE A 52 20.031 -4.011 6.100 1.00 0.00 O ATOM 835 CB ILE A 52 20.106 -6.704 4.550 1.00 0.00 C ATOM 836 CG1 ILE A 52 20.753 -7.432 3.349 1.00 0.00 C ATOM 837 CG2 ILE A 52 18.914 -7.474 5.140 1.00 0.00 C ATOM 838 CD1 ILE A 52 20.642 -8.946 3.298 1.00 0.00 C ATOM 0 H ILE A 52 21.640 -5.051 3.440 1.00 0.00 H new ATOM 0 HA ILE A 52 18.794 -5.440 3.442 1.00 0.00 H new ATOM 0 HB ILE A 52 20.847 -6.632 5.346 1.00 0.00 H new ATOM 0 HG12 ILE A 52 20.310 -7.032 2.437 1.00 0.00 H new ATOM 0 HG13 ILE A 52 21.811 -7.172 3.330 1.00 0.00 H new ATOM 0 HG21 ILE A 52 19.243 -8.462 5.462 1.00 0.00 H new ATOM 0 HG22 ILE A 52 18.515 -6.928 5.995 1.00 0.00 H new ATOM 0 HG23 ILE A 52 18.138 -7.579 4.382 1.00 0.00 H new ATOM 0 HD11 ILE A 52 21.140 -9.317 2.403 1.00 0.00 H new ATOM 0 HD12 ILE A 52 21.115 -9.375 4.181 1.00 0.00 H new ATOM 0 HD13 ILE A 52 19.591 -9.233 3.274 1.00 0.00 H new ATOM 850 N LEU A 53 17.925 -4.120 5.310 1.00 0.00 N ATOM 851 CA LEU A 53 17.273 -3.318 6.339 1.00 0.00 C ATOM 852 C LEU A 53 17.382 -4.004 7.711 1.00 0.00 C ATOM 853 O LEU A 53 16.824 -5.082 7.931 1.00 0.00 O ATOM 854 CB LEU A 53 15.810 -3.043 5.948 1.00 0.00 C ATOM 855 CG LEU A 53 15.577 -2.422 4.558 1.00 0.00 C ATOM 856 CD1 LEU A 53 14.142 -1.915 4.424 1.00 0.00 C ATOM 857 CD2 LEU A 53 16.463 -1.211 4.316 1.00 0.00 C ATOM 0 H LEU A 53 17.271 -4.446 4.598 1.00 0.00 H new ATOM 0 HA LEU A 53 17.782 -2.357 6.418 1.00 0.00 H new ATOM 0 HB2 LEU A 53 15.261 -3.983 5.998 1.00 0.00 H new ATOM 0 HB3 LEU A 53 15.376 -2.379 6.696 1.00 0.00 H new ATOM 0 HG LEU A 53 15.801 -3.213 3.843 1.00 0.00 H new ATOM 0 HD11 LEU A 53 14.001 -1.481 3.434 1.00 0.00 H new ATOM 0 HD12 LEU A 53 13.449 -2.745 4.558 1.00 0.00 H new ATOM 0 HD13 LEU A 53 13.952 -1.157 5.184 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.264 -0.807 3.324 1.00 0.00 H new ATOM 0 HD22 LEU A 53 16.252 -0.450 5.067 1.00 0.00 H new ATOM 0 HD23 LEU A 53 17.510 -1.507 4.384 1.00 0.00 H new ATOM 869 N ASN A 54 18.141 -3.399 8.622 1.00 0.00 N ATOM 870 CA ASN A 54 18.336 -3.881 9.992 1.00 0.00 C ATOM 871 C ASN A 54 17.057 -3.683 10.825 1.00 0.00 C ATOM 872 O ASN A 54 16.544 -2.571 10.931 1.00 0.00 O ATOM 873 CB ASN A 54 19.533 -3.150 10.618 1.00 0.00 C ATOM 874 CG ASN A 54 20.882 -3.767 10.272 1.00 0.00 C ATOM 875 OD1 ASN A 54 21.691 -4.059 11.143 1.00 0.00 O ATOM 876 ND2 ASN A 54 21.188 -3.999 9.013 1.00 0.00 N ATOM 0 H ASN A 54 18.651 -2.538 8.425 1.00 0.00 H new ATOM 0 HA ASN A 54 18.548 -4.950 9.976 1.00 0.00 H new ATOM 0 HB2 ASN A 54 19.524 -2.111 10.289 1.00 0.00 H new ATOM 0 HB3 ASN A 54 19.415 -3.142 11.702 1.00 0.00 H new ATOM 0 HD21 ASN A 54 22.088 -4.416 8.775 1.00 0.00 H new ATOM 0 HD22 ASN A 54 20.525 -3.762 8.275 1.00 0.00 H new ATOM 883 N ASP A 55 16.560 -4.764 11.428 1.00 0.00 N ATOM 884 CA ASP A 55 15.252 -4.879 12.096 1.00 0.00 C ATOM 885 C ASP A 55 14.953 -3.765 13.120 1.00 0.00 C ATOM 886 O ASP A 55 13.861 -3.195 13.118 1.00 0.00 O ATOM 887 CB ASP A 55 15.147 -6.253 12.777 1.00 0.00 C ATOM 888 CG ASP A 55 15.260 -7.415 11.780 1.00 0.00 C ATOM 889 OD1 ASP A 55 16.396 -7.762 11.377 1.00 0.00 O ATOM 890 OD2 ASP A 55 14.215 -7.989 11.395 1.00 0.00 O ATOM 0 H ASP A 55 17.086 -5.637 11.468 1.00 0.00 H new ATOM 0 HA ASP A 55 14.502 -4.767 11.313 1.00 0.00 H new ATOM 0 HB2 ASP A 55 15.933 -6.344 13.526 1.00 0.00 H new ATOM 0 HB3 ASP A 55 14.195 -6.322 13.304 1.00 0.00 H new ATOM 895 N ASP A 56 15.913 -3.456 13.996 1.00 0.00 N ATOM 896 CA ASP A 56 15.788 -2.448 15.060 1.00 0.00 C ATOM 897 C ASP A 56 15.953 -0.991 14.570 1.00 0.00 C ATOM 898 O ASP A 56 15.559 -0.050 15.263 1.00 0.00 O ATOM 899 CB ASP A 56 16.838 -2.775 16.135 1.00 0.00 C ATOM 900 CG ASP A 56 16.707 -1.898 17.393 1.00 0.00 C ATOM 901 OD1 ASP A 56 15.695 -2.032 18.124 1.00 0.00 O ATOM 902 OD2 ASP A 56 17.639 -1.109 17.685 1.00 0.00 O ATOM 0 H ASP A 56 16.826 -3.911 13.987 1.00 0.00 H new ATOM 0 HA ASP A 56 14.774 -2.500 15.456 1.00 0.00 H new ATOM 0 HB2 ASP A 56 16.745 -3.823 16.419 1.00 0.00 H new ATOM 0 HB3 ASP A 56 17.834 -2.647 15.712 1.00 0.00 H new ATOM 907 N THR A 57 16.525 -0.784 13.381 1.00 0.00 N ATOM 908 CA THR A 57 16.765 0.544 12.789 1.00 0.00 C ATOM 909 C THR A 57 15.462 1.133 12.226 1.00 0.00 C ATOM 910 O THR A 57 14.595 0.405 11.732 1.00 0.00 O ATOM 911 CB THR A 57 17.860 0.443 11.707 1.00 0.00 C ATOM 912 OG1 THR A 57 19.022 -0.142 12.265 1.00 0.00 O ATOM 913 CG2 THR A 57 18.305 1.790 11.151 1.00 0.00 C ATOM 0 H THR A 57 16.843 -1.549 12.786 1.00 0.00 H new ATOM 0 HA THR A 57 17.116 1.224 13.565 1.00 0.00 H new ATOM 0 HB THR A 57 17.417 -0.146 10.904 1.00 0.00 H new ATOM 0 HG1 THR A 57 19.717 -0.208 11.578 1.00 0.00 H new ATOM 0 HG21 THR A 57 19.076 1.635 10.396 1.00 0.00 H new ATOM 0 HG22 THR A 57 17.452 2.297 10.700 1.00 0.00 H new ATOM 0 HG23 THR A 57 18.706 2.403 11.959 1.00 0.00 H new ATOM 921 N ALA A 58 15.290 2.457 12.304 1.00 0.00 N ATOM 922 CA ALA A 58 14.117 3.140 11.752 1.00 0.00 C ATOM 923 C ALA A 58 14.182 3.313 10.221 1.00 0.00 C ATOM 924 O ALA A 58 15.256 3.356 9.620 1.00 0.00 O ATOM 925 CB ALA A 58 13.915 4.468 12.484 1.00 0.00 C ATOM 0 H ALA A 58 15.959 3.084 12.751 1.00 0.00 H new ATOM 0 HA ALA A 58 13.245 2.509 11.921 1.00 0.00 H new ATOM 0 HB1 ALA A 58 13.043 4.979 12.076 1.00 0.00 H new ATOM 0 HB2 ALA A 58 13.760 4.278 13.546 1.00 0.00 H new ATOM 0 HB3 ALA A 58 14.797 5.094 12.352 1.00 0.00 H new ATOM 931 N LEU A 59 13.018 3.451 9.579 1.00 0.00 N ATOM 932 CA LEU A 59 12.887 3.515 8.113 1.00 0.00 C ATOM 933 C LEU A 59 13.448 4.815 7.507 1.00 0.00 C ATOM 934 O LEU A 59 13.930 4.821 6.371 1.00 0.00 O ATOM 935 CB LEU A 59 11.402 3.305 7.760 1.00 0.00 C ATOM 936 CG LEU A 59 10.908 1.879 8.077 1.00 0.00 C ATOM 937 CD1 LEU A 59 9.401 1.792 7.880 1.00 0.00 C ATOM 938 CD2 LEU A 59 11.532 0.815 7.173 1.00 0.00 C ATOM 0 H LEU A 59 12.125 3.523 10.067 1.00 0.00 H new ATOM 0 HA LEU A 59 13.494 2.725 7.670 1.00 0.00 H new ATOM 0 HB2 LEU A 59 10.797 4.025 8.311 1.00 0.00 H new ATOM 0 HB3 LEU A 59 11.253 3.509 6.700 1.00 0.00 H new ATOM 0 HG LEU A 59 11.200 1.687 9.110 1.00 0.00 H new ATOM 0 HD11 LEU A 59 9.062 0.781 8.106 1.00 0.00 H new ATOM 0 HD12 LEU A 59 8.906 2.498 8.546 1.00 0.00 H new ATOM 0 HD13 LEU A 59 9.155 2.034 6.846 1.00 0.00 H new ATOM 0 HD21 LEU A 59 11.145 -0.167 7.446 1.00 0.00 H new ATOM 0 HD22 LEU A 59 11.282 1.028 6.134 1.00 0.00 H new ATOM 0 HD23 LEU A 59 12.615 0.824 7.294 1.00 0.00 H new ATOM 950 N LYS A 60 13.467 5.896 8.297 1.00 0.00 N ATOM 951 CA LYS A 60 14.080 7.195 7.962 1.00 0.00 C ATOM 952 C LYS A 60 15.586 7.092 7.691 1.00 0.00 C ATOM 953 O LYS A 60 16.110 7.812 6.845 1.00 0.00 O ATOM 954 CB LYS A 60 13.824 8.207 9.093 1.00 0.00 C ATOM 955 CG LYS A 60 12.326 8.427 9.369 1.00 0.00 C ATOM 956 CD LYS A 60 12.056 9.556 10.374 1.00 0.00 C ATOM 957 CE LYS A 60 12.661 9.261 11.754 1.00 0.00 C ATOM 958 NZ LYS A 60 12.181 10.229 12.770 1.00 0.00 N ATOM 0 H LYS A 60 13.040 5.893 9.223 1.00 0.00 H new ATOM 0 HA LYS A 60 13.610 7.536 7.040 1.00 0.00 H new ATOM 0 HB2 LYS A 60 14.309 7.857 10.004 1.00 0.00 H new ATOM 0 HB3 LYS A 60 14.285 9.160 8.833 1.00 0.00 H new ATOM 0 HG2 LYS A 60 11.820 8.656 8.431 1.00 0.00 H new ATOM 0 HG3 LYS A 60 11.893 7.501 9.747 1.00 0.00 H new ATOM 0 HD2 LYS A 60 12.469 10.489 9.990 1.00 0.00 H new ATOM 0 HD3 LYS A 60 10.980 9.701 10.474 1.00 0.00 H new ATOM 0 HE2 LYS A 60 12.398 8.249 12.060 1.00 0.00 H new ATOM 0 HE3 LYS A 60 13.748 9.303 11.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 12.553 9.964 13.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 12.512 11.184 12.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 11.141 10.219 12.795 1.00 0.00 H new ATOM 972 N GLU A 61 16.279 6.168 8.359 1.00 0.00 N ATOM 973 CA GLU A 61 17.733 5.971 8.270 1.00 0.00 C ATOM 974 C GLU A 61 18.195 5.441 6.899 1.00 0.00 C ATOM 975 O GLU A 61 19.353 5.625 6.516 1.00 0.00 O ATOM 976 CB GLU A 61 18.180 4.984 9.357 1.00 0.00 C ATOM 977 CG GLU A 61 17.794 5.388 10.786 1.00 0.00 C ATOM 978 CD GLU A 61 18.529 6.662 11.247 1.00 0.00 C ATOM 979 OE1 GLU A 61 19.706 6.571 11.672 1.00 0.00 O ATOM 980 OE2 GLU A 61 17.933 7.766 11.192 1.00 0.00 O ATOM 0 H GLU A 61 15.831 5.512 8.999 1.00 0.00 H new ATOM 0 HA GLU A 61 18.190 6.951 8.409 1.00 0.00 H new ATOM 0 HB2 GLU A 61 17.749 4.007 9.141 1.00 0.00 H new ATOM 0 HB3 GLU A 61 19.263 4.873 9.305 1.00 0.00 H new ATOM 0 HG2 GLU A 61 16.718 5.552 10.838 1.00 0.00 H new ATOM 0 HG3 GLU A 61 18.025 4.570 11.468 1.00 0.00 H new ATOM 987 N TYR A 62 17.283 4.817 6.145 1.00 0.00 N ATOM 988 CA TYR A 62 17.501 4.274 4.799 1.00 0.00 C ATOM 989 C TYR A 62 16.911 5.172 3.698 1.00 0.00 C ATOM 990 O TYR A 62 17.085 4.893 2.510 1.00 0.00 O ATOM 991 CB TYR A 62 16.906 2.860 4.744 1.00 0.00 C ATOM 992 CG TYR A 62 17.664 1.852 5.584 1.00 0.00 C ATOM 993 CD1 TYR A 62 18.855 1.293 5.082 1.00 0.00 C ATOM 994 CD2 TYR A 62 17.174 1.457 6.845 1.00 0.00 C ATOM 995 CE1 TYR A 62 19.559 0.335 5.834 1.00 0.00 C ATOM 996 CE2 TYR A 62 17.866 0.484 7.592 1.00 0.00 C ATOM 997 CZ TYR A 62 19.065 -0.070 7.094 1.00 0.00 C ATOM 998 OH TYR A 62 19.734 -1.006 7.820 1.00 0.00 O ATOM 0 H TYR A 62 16.328 4.670 6.472 1.00 0.00 H new ATOM 0 HA TYR A 62 18.573 4.236 4.606 1.00 0.00 H new ATOM 0 HB2 TYR A 62 15.870 2.897 5.082 1.00 0.00 H new ATOM 0 HB3 TYR A 62 16.892 2.520 3.708 1.00 0.00 H new ATOM 0 HD1 TYR A 62 19.229 1.601 4.117 1.00 0.00 H new ATOM 0 HD2 TYR A 62 16.270 1.899 7.237 1.00 0.00 H new ATOM 0 HE1 TYR A 62 20.474 -0.090 5.449 1.00 0.00 H new ATOM 0 HE2 TYR A 62 17.479 0.161 8.547 1.00 0.00 H new ATOM 0 HH TYR A 62 20.003 -0.622 8.680 1.00 0.00 H new ATOM 1008 N LYS A 63 16.233 6.260 4.093 1.00 0.00 N ATOM 1009 CA LYS A 63 15.548 7.255 3.249 1.00 0.00 C ATOM 1010 C LYS A 63 14.693 6.626 2.133 1.00 0.00 C ATOM 1011 O LYS A 63 14.710 7.073 0.983 1.00 0.00 O ATOM 1012 CB LYS A 63 16.566 8.299 2.741 1.00 0.00 C ATOM 1013 CG LYS A 63 17.262 9.050 3.889 1.00 0.00 C ATOM 1014 CD LYS A 63 18.252 10.094 3.358 1.00 0.00 C ATOM 1015 CE LYS A 63 18.916 10.818 4.536 1.00 0.00 C ATOM 1016 NZ LYS A 63 19.941 11.790 4.076 1.00 0.00 N ATOM 0 H LYS A 63 16.141 6.486 5.084 1.00 0.00 H new ATOM 0 HA LYS A 63 14.818 7.778 3.866 1.00 0.00 H new ATOM 0 HB2 LYS A 63 17.318 7.801 2.129 1.00 0.00 H new ATOM 0 HB3 LYS A 63 16.056 9.016 2.098 1.00 0.00 H new ATOM 0 HG2 LYS A 63 16.513 9.540 4.511 1.00 0.00 H new ATOM 0 HG3 LYS A 63 17.788 8.338 4.525 1.00 0.00 H new ATOM 0 HD2 LYS A 63 19.010 9.611 2.741 1.00 0.00 H new ATOM 0 HD3 LYS A 63 17.733 10.812 2.722 1.00 0.00 H new ATOM 0 HE2 LYS A 63 18.156 11.339 5.118 1.00 0.00 H new ATOM 0 HE3 LYS A 63 19.379 10.087 5.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 20.368 12.260 4.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 20.679 11.289 3.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 19.494 12.502 3.464 1.00 0.00 H new ATOM 1030 N ILE A 64 13.946 5.573 2.480 1.00 0.00 N ATOM 1031 CA ILE A 64 13.034 4.853 1.577 1.00 0.00 C ATOM 1032 C ILE A 64 11.946 5.808 1.071 1.00 0.00 C ATOM 1033 O ILE A 64 11.357 6.566 1.845 1.00 0.00 O ATOM 1034 CB ILE A 64 12.433 3.605 2.263 1.00 0.00 C ATOM 1035 CG1 ILE A 64 13.552 2.653 2.742 1.00 0.00 C ATOM 1036 CG2 ILE A 64 11.490 2.848 1.306 1.00 0.00 C ATOM 1037 CD1 ILE A 64 13.034 1.549 3.663 1.00 0.00 C ATOM 0 H ILE A 64 13.957 5.185 3.423 1.00 0.00 H new ATOM 0 HA ILE A 64 13.599 4.493 0.717 1.00 0.00 H new ATOM 0 HB ILE A 64 11.860 3.947 3.125 1.00 0.00 H new ATOM 0 HG12 ILE A 64 14.034 2.201 1.875 1.00 0.00 H new ATOM 0 HG13 ILE A 64 14.314 3.230 3.266 1.00 0.00 H new ATOM 0 HG21 ILE A 64 11.081 1.974 1.814 1.00 0.00 H new ATOM 0 HG22 ILE A 64 10.676 3.506 1.002 1.00 0.00 H new ATOM 0 HG23 ILE A 64 12.046 2.528 0.425 1.00 0.00 H new ATOM 0 HD11 ILE A 64 13.863 0.911 3.968 1.00 0.00 H new ATOM 0 HD12 ILE A 64 12.576 1.996 4.545 1.00 0.00 H new ATOM 0 HD13 ILE A 64 12.292 0.951 3.133 1.00 0.00 H new ATOM 1049 N ASP A 65 11.685 5.774 -0.234 1.00 0.00 N ATOM 1050 CA ASP A 65 10.680 6.611 -0.899 1.00 0.00 C ATOM 1051 C ASP A 65 9.397 5.816 -1.216 1.00 0.00 C ATOM 1052 O ASP A 65 9.414 4.589 -1.324 1.00 0.00 O ATOM 1053 CB ASP A 65 11.302 7.221 -2.163 1.00 0.00 C ATOM 1054 CG ASP A 65 10.441 8.361 -2.721 1.00 0.00 C ATOM 1055 OD1 ASP A 65 10.574 9.514 -2.245 1.00 0.00 O ATOM 1056 OD2 ASP A 65 9.604 8.090 -3.611 1.00 0.00 O ATOM 0 H ASP A 65 12.175 5.151 -0.876 1.00 0.00 H new ATOM 0 HA ASP A 65 10.379 7.415 -0.227 1.00 0.00 H new ATOM 0 HB2 ASP A 65 12.300 7.596 -1.934 1.00 0.00 H new ATOM 0 HB3 ASP A 65 11.419 6.447 -2.922 1.00 0.00 H new ATOM 1061 N GLU A 66 8.271 6.513 -1.374 1.00 0.00 N ATOM 1062 CA GLU A 66 6.971 5.902 -1.688 1.00 0.00 C ATOM 1063 C GLU A 66 6.843 5.484 -3.168 1.00 0.00 C ATOM 1064 O GLU A 66 6.181 4.488 -3.476 1.00 0.00 O ATOM 1065 CB GLU A 66 5.835 6.878 -1.332 1.00 0.00 C ATOM 1066 CG GLU A 66 5.797 7.216 0.166 1.00 0.00 C ATOM 1067 CD GLU A 66 4.565 8.067 0.528 1.00 0.00 C ATOM 1068 OE1 GLU A 66 4.448 9.221 0.050 1.00 0.00 O ATOM 1069 OE2 GLU A 66 3.717 7.587 1.320 1.00 0.00 O ATOM 0 H GLU A 66 8.232 7.529 -1.287 1.00 0.00 H new ATOM 0 HA GLU A 66 6.897 4.995 -1.089 1.00 0.00 H new ATOM 0 HB2 GLU A 66 5.957 7.797 -1.905 1.00 0.00 H new ATOM 0 HB3 GLU A 66 4.880 6.442 -1.627 1.00 0.00 H new ATOM 0 HG2 GLU A 66 5.785 6.294 0.747 1.00 0.00 H new ATOM 0 HG3 GLU A 66 6.704 7.754 0.441 1.00 0.00 H new ATOM 1076 N LYS A 67 7.469 6.233 -4.090 1.00 0.00 N ATOM 1077 CA LYS A 67 7.434 5.992 -5.546 1.00 0.00 C ATOM 1078 C LYS A 67 8.456 4.941 -5.990 1.00 0.00 C ATOM 1079 O LYS A 67 8.188 4.184 -6.926 1.00 0.00 O ATOM 1080 CB LYS A 67 7.676 7.306 -6.315 1.00 0.00 C ATOM 1081 CG LYS A 67 6.760 8.479 -5.917 1.00 0.00 C ATOM 1082 CD LYS A 67 5.267 8.195 -6.144 1.00 0.00 C ATOM 1083 CE LYS A 67 4.442 9.423 -5.740 1.00 0.00 C ATOM 1084 NZ LYS A 67 2.989 9.208 -5.970 1.00 0.00 N ATOM 0 H LYS A 67 8.030 7.047 -3.838 1.00 0.00 H new ATOM 0 HA LYS A 67 6.441 5.606 -5.777 1.00 0.00 H new ATOM 0 HB2 LYS A 67 8.712 7.609 -6.167 1.00 0.00 H new ATOM 0 HB3 LYS A 67 7.550 7.113 -7.380 1.00 0.00 H new ATOM 0 HG2 LYS A 67 6.921 8.715 -4.865 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.045 9.362 -6.489 1.00 0.00 H new ATOM 0 HD2 LYS A 67 5.088 7.953 -7.192 1.00 0.00 H new ATOM 0 HD3 LYS A 67 4.958 7.329 -5.559 1.00 0.00 H new ATOM 0 HE2 LYS A 67 4.615 9.647 -4.687 1.00 0.00 H new ATOM 0 HE3 LYS A 67 4.776 10.290 -6.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 2.463 10.059 -5.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 2.822 9.018 -6.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 2.665 8.396 -5.407 1.00 0.00 H new ATOM 1098 N ASN A 68 9.617 4.885 -5.329 1.00 0.00 N ATOM 1099 CA ASN A 68 10.587 3.798 -5.498 1.00 0.00 C ATOM 1100 C ASN A 68 10.081 2.516 -4.799 1.00 0.00 C ATOM 1101 O ASN A 68 9.114 2.558 -4.033 1.00 0.00 O ATOM 1102 CB ASN A 68 11.962 4.251 -4.963 1.00 0.00 C ATOM 1103 CG ASN A 68 13.118 3.359 -5.403 1.00 0.00 C ATOM 1104 OD1 ASN A 68 13.033 2.598 -6.357 1.00 0.00 O ATOM 1105 ND2 ASN A 68 14.231 3.406 -4.712 1.00 0.00 N ATOM 0 H ASN A 68 9.911 5.595 -4.659 1.00 0.00 H new ATOM 0 HA ASN A 68 10.700 3.561 -6.556 1.00 0.00 H new ATOM 0 HB2 ASN A 68 12.154 5.270 -5.298 1.00 0.00 H new ATOM 0 HB3 ASN A 68 11.928 4.275 -3.874 1.00 0.00 H new ATOM 0 HD21 ASN A 68 15.018 2.811 -4.971 1.00 0.00 H new ATOM 0 HD22 ASN A 68 14.310 4.038 -3.915 1.00 0.00 H new ATOM 1112 N PHE A 69 10.744 1.381 -5.026 1.00 0.00 N ATOM 1113 CA PHE A 69 10.377 0.088 -4.441 1.00 0.00 C ATOM 1114 C PHE A 69 11.449 -0.475 -3.495 1.00 0.00 C ATOM 1115 O PHE A 69 12.652 -0.287 -3.695 1.00 0.00 O ATOM 1116 CB PHE A 69 10.003 -0.914 -5.547 1.00 0.00 C ATOM 1117 CG PHE A 69 11.117 -1.309 -6.503 1.00 0.00 C ATOM 1118 CD1 PHE A 69 12.025 -2.329 -6.158 1.00 0.00 C ATOM 1119 CD2 PHE A 69 11.226 -0.680 -7.759 1.00 0.00 C ATOM 1120 CE1 PHE A 69 13.033 -2.717 -7.059 1.00 0.00 C ATOM 1121 CE2 PHE A 69 12.232 -1.070 -8.662 1.00 0.00 C ATOM 1122 CZ PHE A 69 13.135 -2.089 -8.312 1.00 0.00 C ATOM 0 H PHE A 69 11.564 1.332 -5.631 1.00 0.00 H new ATOM 0 HA PHE A 69 9.500 0.257 -3.816 1.00 0.00 H new ATOM 0 HB2 PHE A 69 9.621 -1.819 -5.074 1.00 0.00 H new ATOM 0 HB3 PHE A 69 9.186 -0.490 -6.131 1.00 0.00 H new ATOM 0 HD1 PHE A 69 11.947 -2.816 -5.197 1.00 0.00 H new ATOM 0 HD2 PHE A 69 10.535 0.104 -8.030 1.00 0.00 H new ATOM 0 HE1 PHE A 69 13.729 -3.497 -6.788 1.00 0.00 H new ATOM 0 HE2 PHE A 69 12.311 -0.586 -9.624 1.00 0.00 H new ATOM 0 HZ PHE A 69 13.907 -2.389 -9.006 1.00 0.00 H new ATOM 1132 N VAL A 70 10.996 -1.197 -2.470 1.00 0.00 N ATOM 1133 CA VAL A 70 11.806 -2.023 -1.564 1.00 0.00 C ATOM 1134 C VAL A 70 11.721 -3.470 -2.056 1.00 0.00 C ATOM 1135 O VAL A 70 10.684 -3.891 -2.578 1.00 0.00 O ATOM 1136 CB VAL A 70 11.328 -1.858 -0.097 1.00 0.00 C ATOM 1137 CG1 VAL A 70 10.556 -3.047 0.482 1.00 0.00 C ATOM 1138 CG2 VAL A 70 12.508 -1.583 0.839 1.00 0.00 C ATOM 0 H VAL A 70 10.004 -1.225 -2.234 1.00 0.00 H new ATOM 0 HA VAL A 70 12.849 -1.707 -1.572 1.00 0.00 H new ATOM 0 HB VAL A 70 10.639 -1.015 -0.150 1.00 0.00 H new ATOM 0 HG11 VAL A 70 10.269 -2.828 1.510 1.00 0.00 H new ATOM 0 HG12 VAL A 70 9.661 -3.225 -0.115 1.00 0.00 H new ATOM 0 HG13 VAL A 70 11.188 -3.935 0.463 1.00 0.00 H new ATOM 0 HG21 VAL A 70 12.144 -1.472 1.860 1.00 0.00 H new ATOM 0 HG22 VAL A 70 13.211 -2.415 0.793 1.00 0.00 H new ATOM 0 HG23 VAL A 70 13.011 -0.666 0.531 1.00 0.00 H new ATOM 1148 N VAL A 71 12.784 -4.250 -1.876 1.00 0.00 N ATOM 1149 CA VAL A 71 12.787 -5.677 -2.229 1.00 0.00 C ATOM 1150 C VAL A 71 12.546 -6.522 -0.982 1.00 0.00 C ATOM 1151 O VAL A 71 13.160 -6.294 0.063 1.00 0.00 O ATOM 1152 CB VAL A 71 14.084 -6.085 -2.949 1.00 0.00 C ATOM 1153 CG1 VAL A 71 14.095 -7.576 -3.310 1.00 0.00 C ATOM 1154 CG2 VAL A 71 14.234 -5.311 -4.263 1.00 0.00 C ATOM 0 H VAL A 71 13.665 -3.918 -1.484 1.00 0.00 H new ATOM 0 HA VAL A 71 11.973 -5.858 -2.931 1.00 0.00 H new ATOM 0 HB VAL A 71 14.898 -5.863 -2.259 1.00 0.00 H new ATOM 0 HG11 VAL A 71 15.029 -7.821 -3.817 1.00 0.00 H new ATOM 0 HG12 VAL A 71 14.009 -8.171 -2.401 1.00 0.00 H new ATOM 0 HG13 VAL A 71 13.256 -7.797 -3.969 1.00 0.00 H new ATOM 0 HG21 VAL A 71 15.157 -5.612 -4.759 1.00 0.00 H new ATOM 0 HG22 VAL A 71 13.386 -5.528 -4.912 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.267 -4.242 -4.054 1.00 0.00 H new ATOM 1164 N VAL A 72 11.664 -7.514 -1.101 1.00 0.00 N ATOM 1165 CA VAL A 72 11.366 -8.511 -0.065 1.00 0.00 C ATOM 1166 C VAL A 72 11.597 -9.929 -0.593 1.00 0.00 C ATOM 1167 O VAL A 72 11.236 -10.268 -1.723 1.00 0.00 O ATOM 1168 CB VAL A 72 9.957 -8.309 0.533 1.00 0.00 C ATOM 1169 CG1 VAL A 72 8.838 -8.311 -0.522 1.00 0.00 C ATOM 1170 CG2 VAL A 72 9.651 -9.356 1.617 1.00 0.00 C ATOM 0 H VAL A 72 11.116 -7.653 -1.950 1.00 0.00 H new ATOM 0 HA VAL A 72 12.062 -8.366 0.761 1.00 0.00 H new ATOM 0 HB VAL A 72 9.974 -7.316 0.983 1.00 0.00 H new ATOM 0 HG11 VAL A 72 7.876 -8.164 -0.032 1.00 0.00 H new ATOM 0 HG12 VAL A 72 9.009 -7.504 -1.235 1.00 0.00 H new ATOM 0 HG13 VAL A 72 8.836 -9.266 -1.048 1.00 0.00 H new ATOM 0 HG21 VAL A 72 8.651 -9.185 2.017 1.00 0.00 H new ATOM 0 HG22 VAL A 72 9.702 -10.355 1.183 1.00 0.00 H new ATOM 0 HG23 VAL A 72 10.382 -9.272 2.421 1.00 0.00 H new ATOM 1180 N MET A 73 12.212 -10.763 0.243 1.00 0.00 N ATOM 1181 CA MET A 73 12.483 -12.182 -0.001 1.00 0.00 C ATOM 1182 C MET A 73 12.207 -13.029 1.236 1.00 0.00 C ATOM 1183 O MET A 73 11.993 -12.489 2.318 1.00 0.00 O ATOM 1184 CB MET A 73 13.924 -12.350 -0.505 1.00 0.00 C ATOM 1185 CG MET A 73 15.006 -11.996 0.520 1.00 0.00 C ATOM 1186 SD MET A 73 16.710 -12.212 -0.065 1.00 0.00 S ATOM 1187 CE MET A 73 16.763 -14.014 -0.252 1.00 0.00 C ATOM 0 H MET A 73 12.552 -10.455 1.154 1.00 0.00 H new ATOM 0 HA MET A 73 11.803 -12.543 -0.773 1.00 0.00 H new ATOM 0 HB2 MET A 73 14.066 -13.384 -0.821 1.00 0.00 H new ATOM 0 HB3 MET A 73 14.061 -11.726 -1.388 1.00 0.00 H new ATOM 0 HG2 MET A 73 14.871 -10.959 0.826 1.00 0.00 H new ATOM 0 HG3 MET A 73 14.861 -12.612 1.408 1.00 0.00 H new ATOM 0 HE1 MET A 73 17.769 -14.321 -0.538 1.00 0.00 H new ATOM 0 HE2 MET A 73 16.495 -14.486 0.693 1.00 0.00 H new ATOM 0 HE3 MET A 73 16.057 -14.321 -1.024 1.00 0.00 H new ATOM 1197 N VAL A 74 12.229 -14.352 1.080 1.00 0.00 N ATOM 1198 CA VAL A 74 12.085 -15.332 2.163 1.00 0.00 C ATOM 1199 C VAL A 74 13.106 -16.460 1.971 1.00 0.00 C ATOM 1200 O VAL A 74 13.121 -17.126 0.932 1.00 0.00 O ATOM 1201 CB VAL A 74 10.620 -15.809 2.281 1.00 0.00 C ATOM 1202 CG1 VAL A 74 10.055 -16.473 1.017 1.00 0.00 C ATOM 1203 CG2 VAL A 74 10.421 -16.750 3.474 1.00 0.00 C ATOM 0 H VAL A 74 12.352 -14.789 0.166 1.00 0.00 H new ATOM 0 HA VAL A 74 12.310 -14.872 3.125 1.00 0.00 H new ATOM 0 HB VAL A 74 10.058 -14.888 2.432 1.00 0.00 H new ATOM 0 HG11 VAL A 74 9.023 -16.774 1.195 1.00 0.00 H new ATOM 0 HG12 VAL A 74 10.089 -15.766 0.188 1.00 0.00 H new ATOM 0 HG13 VAL A 74 10.652 -17.351 0.769 1.00 0.00 H new ATOM 0 HG21 VAL A 74 9.378 -17.062 3.521 1.00 0.00 H new ATOM 0 HG22 VAL A 74 11.057 -17.627 3.356 1.00 0.00 H new ATOM 0 HG23 VAL A 74 10.686 -16.231 4.395 1.00 0.00 H new ATOM 1213 N THR A 75 14.036 -16.622 2.915 1.00 0.00 N ATOM 1214 CA THR A 75 15.119 -17.620 2.810 1.00 0.00 C ATOM 1215 C THR A 75 14.640 -19.050 3.093 1.00 0.00 C ATOM 1216 O THR A 75 13.762 -19.282 3.930 1.00 0.00 O ATOM 1217 CB THR A 75 16.313 -17.273 3.719 1.00 0.00 C ATOM 1218 OG1 THR A 75 15.903 -16.818 4.995 1.00 0.00 O ATOM 1219 CG2 THR A 75 17.149 -16.158 3.089 1.00 0.00 C ATOM 0 H THR A 75 14.065 -16.071 3.773 1.00 0.00 H new ATOM 0 HA THR A 75 15.451 -17.582 1.772 1.00 0.00 H new ATOM 0 HB THR A 75 16.890 -18.191 3.831 1.00 0.00 H new ATOM 0 HG1 THR A 75 16.643 -16.915 5.630 1.00 0.00 H new ATOM 0 HG21 THR A 75 17.990 -15.921 3.741 1.00 0.00 H new ATOM 0 HG22 THR A 75 17.523 -16.487 2.119 1.00 0.00 H new ATOM 0 HG23 THR A 75 16.531 -15.270 2.957 1.00 0.00 H new ATOM 1227 N LYS A 76 15.229 -20.021 2.383 1.00 0.00 N ATOM 1228 CA LYS A 76 14.943 -21.465 2.491 1.00 0.00 C ATOM 1229 C LYS A 76 15.498 -22.071 3.802 1.00 0.00 C ATOM 1230 O LYS A 76 16.411 -21.482 4.395 1.00 0.00 O ATOM 1231 CB LYS A 76 15.550 -22.182 1.267 1.00 0.00 C ATOM 1232 CG LYS A 76 14.904 -21.730 -0.059 1.00 0.00 C ATOM 1233 CD LYS A 76 15.526 -22.394 -1.297 1.00 0.00 C ATOM 1234 CE LYS A 76 16.983 -21.957 -1.502 1.00 0.00 C ATOM 1235 NZ LYS A 76 17.524 -22.447 -2.791 1.00 0.00 N ATOM 0 H LYS A 76 15.948 -19.818 1.688 1.00 0.00 H new ATOM 0 HA LYS A 76 13.862 -21.604 2.513 1.00 0.00 H new ATOM 0 HB2 LYS A 76 16.622 -21.988 1.230 1.00 0.00 H new ATOM 0 HB3 LYS A 76 15.424 -23.259 1.381 1.00 0.00 H new ATOM 0 HG2 LYS A 76 13.838 -21.956 -0.031 1.00 0.00 H new ATOM 0 HG3 LYS A 76 14.998 -20.648 -0.150 1.00 0.00 H new ATOM 0 HD2 LYS A 76 15.483 -23.478 -1.189 1.00 0.00 H new ATOM 0 HD3 LYS A 76 14.941 -22.138 -2.180 1.00 0.00 H new ATOM 0 HE2 LYS A 76 17.045 -20.869 -1.471 1.00 0.00 H new ATOM 0 HE3 LYS A 76 17.595 -22.335 -0.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 18.520 -22.162 -2.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 17.456 -23.484 -2.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 16.976 -22.039 -3.575 1.00 0.00 H new ATOM 1249 N PRO A 77 15.003 -23.243 4.254 1.00 0.00 N ATOM 1250 CA PRO A 77 15.572 -23.985 5.386 1.00 0.00 C ATOM 1251 C PRO A 77 17.062 -24.334 5.259 1.00 0.00 C ATOM 1252 O PRO A 77 17.635 -24.358 4.165 1.00 0.00 O ATOM 1253 CB PRO A 77 14.750 -25.273 5.493 1.00 0.00 C ATOM 1254 CG PRO A 77 13.401 -24.881 4.897 1.00 0.00 C ATOM 1255 CD PRO A 77 13.799 -23.915 3.780 1.00 0.00 C ATOM 0 HA PRO A 77 15.520 -23.350 6.270 1.00 0.00 H new ATOM 0 HB2 PRO A 77 15.211 -26.091 4.940 1.00 0.00 H new ATOM 0 HB3 PRO A 77 14.652 -25.603 6.527 1.00 0.00 H new ATOM 0 HG2 PRO A 77 12.861 -25.746 4.512 1.00 0.00 H new ATOM 0 HG3 PRO A 77 12.755 -24.404 5.634 1.00 0.00 H new ATOM 0 HD2 PRO A 77 13.989 -24.449 2.849 1.00 0.00 H new ATOM 0 HD3 PRO A 77 13.003 -23.198 3.580 1.00 0.00 H new ATOM 1263 N LYS A 78 17.661 -24.703 6.399 1.00 0.00 N ATOM 1264 CA LYS A 78 19.035 -25.243 6.511 1.00 0.00 C ATOM 1265 C LYS A 78 19.127 -26.771 6.388 1.00 0.00 C ATOM 1266 O LYS A 78 20.224 -27.330 6.298 1.00 0.00 O ATOM 1267 CB LYS A 78 19.687 -24.723 7.807 1.00 0.00 C ATOM 1268 CG LYS A 78 19.038 -25.266 9.096 1.00 0.00 C ATOM 1269 CD LYS A 78 19.733 -24.766 10.372 1.00 0.00 C ATOM 1270 CE LYS A 78 19.530 -23.259 10.588 1.00 0.00 C ATOM 1271 NZ LYS A 78 20.146 -22.802 11.862 1.00 0.00 N ATOM 0 H LYS A 78 17.192 -24.634 7.302 1.00 0.00 H new ATOM 0 HA LYS A 78 19.594 -24.875 5.651 1.00 0.00 H new ATOM 0 HB2 LYS A 78 20.743 -24.991 7.803 1.00 0.00 H new ATOM 0 HB3 LYS A 78 19.635 -23.634 7.817 1.00 0.00 H new ATOM 0 HG2 LYS A 78 17.989 -24.971 9.120 1.00 0.00 H new ATOM 0 HG3 LYS A 78 19.063 -26.356 9.078 1.00 0.00 H new ATOM 0 HD2 LYS A 78 19.345 -25.311 11.233 1.00 0.00 H new ATOM 0 HD3 LYS A 78 20.800 -24.983 10.312 1.00 0.00 H new ATOM 0 HE2 LYS A 78 19.966 -22.709 9.754 1.00 0.00 H new ATOM 0 HE3 LYS A 78 18.464 -23.032 10.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 19.990 -21.780 11.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 19.712 -23.310 12.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 21.168 -22.996 11.843 1.00 0.00 H new ATOM 1285 N ALA A 79 17.972 -27.433 6.376 1.00 0.00 N ATOM 1286 CA ALA A 79 17.808 -28.885 6.307 1.00 0.00 C ATOM 1287 C ALA A 79 18.499 -29.483 5.067 1.00 0.00 C ATOM 1288 O ALA A 79 18.417 -28.916 3.975 1.00 0.00 O ATOM 1289 CB ALA A 79 16.308 -29.206 6.330 1.00 0.00 C ATOM 0 H ALA A 79 17.077 -26.946 6.416 1.00 0.00 H new ATOM 0 HA ALA A 79 18.292 -29.344 7.169 1.00 0.00 H new ATOM 0 HB1 ALA A 79 16.166 -30.286 6.279 1.00 0.00 H new ATOM 0 HB2 ALA A 79 15.869 -28.825 7.252 1.00 0.00 H new ATOM 0 HB3 ALA A 79 15.822 -28.736 5.475 1.00 0.00 H new ATOM 1295 N VAL A 80 19.195 -30.613 5.257 1.00 0.00 N ATOM 1296 CA VAL A 80 20.074 -31.378 4.334 1.00 0.00 C ATOM 1297 C VAL A 80 21.162 -30.607 3.556 1.00 0.00 C ATOM 1298 O VAL A 80 22.079 -31.236 3.025 1.00 0.00 O ATOM 1299 CB VAL A 80 19.286 -32.337 3.411 1.00 0.00 C ATOM 1300 CG1 VAL A 80 18.454 -33.330 4.232 1.00 0.00 C ATOM 1301 CG2 VAL A 80 18.370 -31.646 2.396 1.00 0.00 C ATOM 0 H VAL A 80 19.157 -31.074 6.166 1.00 0.00 H new ATOM 0 HA VAL A 80 20.660 -31.961 5.044 1.00 0.00 H new ATOM 0 HB VAL A 80 20.056 -32.854 2.838 1.00 0.00 H new ATOM 0 HG11 VAL A 80 17.910 -33.993 3.559 1.00 0.00 H new ATOM 0 HG12 VAL A 80 19.115 -33.920 4.867 1.00 0.00 H new ATOM 0 HG13 VAL A 80 17.745 -32.784 4.854 1.00 0.00 H new ATOM 0 HG21 VAL A 80 17.860 -32.399 1.795 1.00 0.00 H new ATOM 0 HG22 VAL A 80 17.632 -31.042 2.924 1.00 0.00 H new ATOM 0 HG23 VAL A 80 18.965 -31.005 1.746 1.00 0.00 H new ATOM 1311 N SER A 81 21.132 -29.272 3.525 1.00 0.00 N ATOM 1312 CA SER A 81 22.205 -28.406 3.007 1.00 0.00 C ATOM 1313 C SER A 81 23.382 -28.303 3.987 1.00 0.00 C ATOM 1314 O SER A 81 24.543 -28.292 3.570 1.00 0.00 O ATOM 1315 CB SER A 81 21.665 -26.997 2.729 1.00 0.00 C ATOM 1316 OG SER A 81 20.683 -27.021 1.703 1.00 0.00 O ATOM 0 H SER A 81 20.333 -28.741 3.871 1.00 0.00 H new ATOM 0 HA SER A 81 22.563 -28.860 2.083 1.00 0.00 H new ATOM 0 HB2 SER A 81 21.234 -26.583 3.640 1.00 0.00 H new ATOM 0 HB3 SER A 81 22.485 -26.341 2.437 1.00 0.00 H new ATOM 0 HG SER A 81 20.353 -26.112 1.545 1.00 0.00 H new ATOM 1322 N THR A 82 23.096 -28.246 5.292 1.00 0.00 N ATOM 1323 CA THR A 82 24.094 -28.335 6.377 1.00 0.00 C ATOM 1324 C THR A 82 24.632 -29.769 6.560 1.00 0.00 C ATOM 1325 O THR A 82 23.951 -30.733 6.183 1.00 0.00 O ATOM 1326 CB THR A 82 23.507 -27.837 7.714 1.00 0.00 C ATOM 1327 OG1 THR A 82 22.243 -28.405 7.997 1.00 0.00 O ATOM 1328 CG2 THR A 82 23.353 -26.317 7.712 1.00 0.00 C ATOM 0 H THR A 82 22.143 -28.134 5.637 1.00 0.00 H new ATOM 0 HA THR A 82 24.925 -27.693 6.083 1.00 0.00 H new ATOM 0 HB THR A 82 24.214 -28.148 8.483 1.00 0.00 H new ATOM 0 HG1 THR A 82 21.550 -27.929 7.493 1.00 0.00 H new ATOM 0 HG21 THR A 82 22.937 -25.992 8.666 1.00 0.00 H new ATOM 0 HG22 THR A 82 24.328 -25.853 7.564 1.00 0.00 H new ATOM 0 HG23 THR A 82 22.684 -26.020 6.905 1.00 0.00 H new ATOM 1336 N PRO A 83 25.836 -29.950 7.147 1.00 0.00 N ATOM 1337 CA PRO A 83 26.378 -31.275 7.465 1.00 0.00 C ATOM 1338 C PRO A 83 25.606 -31.957 8.611 1.00 0.00 C ATOM 1339 O PRO A 83 24.915 -31.303 9.399 1.00 0.00 O ATOM 1340 CB PRO A 83 27.849 -31.033 7.824 1.00 0.00 C ATOM 1341 CG PRO A 83 27.848 -29.611 8.381 1.00 0.00 C ATOM 1342 CD PRO A 83 26.787 -28.913 7.533 1.00 0.00 C ATOM 0 HA PRO A 83 26.280 -31.960 6.623 1.00 0.00 H new ATOM 0 HB2 PRO A 83 28.207 -31.753 8.560 1.00 0.00 H new ATOM 0 HB3 PRO A 83 28.496 -31.122 6.951 1.00 0.00 H new ATOM 0 HG2 PRO A 83 27.594 -29.593 9.441 1.00 0.00 H new ATOM 0 HG3 PRO A 83 28.824 -29.136 8.278 1.00 0.00 H new ATOM 0 HD2 PRO A 83 26.294 -28.122 8.098 1.00 0.00 H new ATOM 0 HD3 PRO A 83 27.234 -28.447 6.655 1.00 0.00 H new ATOM 1350 N ALA A 84 25.737 -33.283 8.713 1.00 0.00 N ATOM 1351 CA ALA A 84 24.981 -34.135 9.637 1.00 0.00 C ATOM 1352 C ALA A 84 25.782 -35.380 10.098 1.00 0.00 C ATOM 1353 O ALA A 84 26.773 -35.741 9.451 1.00 0.00 O ATOM 1354 CB ALA A 84 23.701 -34.555 8.898 1.00 0.00 C ATOM 0 H ALA A 84 26.393 -33.810 8.137 1.00 0.00 H new ATOM 0 HA ALA A 84 24.758 -33.580 10.548 1.00 0.00 H new ATOM 0 HB1 ALA A 84 23.100 -35.194 9.545 1.00 0.00 H new ATOM 0 HB2 ALA A 84 23.128 -33.668 8.630 1.00 0.00 H new ATOM 0 HB3 ALA A 84 23.966 -35.102 7.993 1.00 0.00 H new ATOM 1360 N PRO A 85 25.355 -36.074 11.177 1.00 0.00 N ATOM 1361 CA PRO A 85 25.922 -37.359 11.594 1.00 0.00 C ATOM 1362 C PRO A 85 25.580 -38.479 10.592 1.00 0.00 C ATOM 1363 O PRO A 85 24.493 -39.064 10.630 1.00 0.00 O ATOM 1364 CB PRO A 85 25.374 -37.615 13.005 1.00 0.00 C ATOM 1365 CG PRO A 85 24.046 -36.861 13.015 1.00 0.00 C ATOM 1366 CD PRO A 85 24.336 -35.648 12.133 1.00 0.00 C ATOM 0 HA PRO A 85 27.012 -37.341 11.612 1.00 0.00 H new ATOM 0 HB2 PRO A 85 25.233 -38.679 13.193 1.00 0.00 H new ATOM 0 HB3 PRO A 85 26.053 -37.243 13.773 1.00 0.00 H new ATOM 0 HG2 PRO A 85 23.234 -37.467 12.614 1.00 0.00 H new ATOM 0 HG3 PRO A 85 23.756 -36.567 14.024 1.00 0.00 H new ATOM 0 HD2 PRO A 85 23.434 -35.316 11.619 1.00 0.00 H new ATOM 0 HD3 PRO A 85 24.690 -34.808 12.731 1.00 0.00 H new ATOM 1374 N ALA A 86 26.528 -38.773 9.695 1.00 0.00 N ATOM 1375 CA ALA A 86 26.426 -39.713 8.571 1.00 0.00 C ATOM 1376 C ALA A 86 25.240 -39.447 7.607 1.00 0.00 C ATOM 1377 O ALA A 86 24.545 -38.430 7.681 1.00 0.00 O ATOM 1378 CB ALA A 86 26.479 -41.151 9.122 1.00 0.00 C ATOM 0 H ALA A 86 27.447 -38.332 9.737 1.00 0.00 H new ATOM 0 HA ALA A 86 27.285 -39.555 7.919 1.00 0.00 H new ATOM 0 HB1 ALA A 86 26.404 -41.860 8.297 1.00 0.00 H new ATOM 0 HB2 ALA A 86 27.421 -41.305 9.648 1.00 0.00 H new ATOM 0 HB3 ALA A 86 25.649 -41.307 9.811 1.00 0.00 H new ATOM 1384 N THR A 87 25.027 -40.359 6.653 1.00 0.00 N ATOM 1385 CA THR A 87 23.948 -40.316 5.644 1.00 0.00 C ATOM 1386 C THR A 87 22.538 -40.523 6.217 1.00 0.00 C ATOM 1387 O THR A 87 21.556 -40.279 5.513 1.00 0.00 O ATOM 1388 CB THR A 87 24.190 -41.370 4.549 1.00 0.00 C ATOM 1389 OG1 THR A 87 24.393 -42.642 5.134 1.00 0.00 O ATOM 1390 CG2 THR A 87 25.422 -41.041 3.705 1.00 0.00 C ATOM 0 H THR A 87 25.621 -41.182 6.553 1.00 0.00 H new ATOM 0 HA THR A 87 23.984 -39.306 5.235 1.00 0.00 H new ATOM 0 HB THR A 87 23.307 -41.371 3.910 1.00 0.00 H new ATOM 0 HG1 THR A 87 24.544 -43.306 4.429 1.00 0.00 H new ATOM 0 HG21 THR A 87 25.557 -41.809 2.944 1.00 0.00 H new ATOM 0 HG22 THR A 87 25.285 -40.073 3.223 1.00 0.00 H new ATOM 0 HG23 THR A 87 26.303 -41.006 4.346 1.00 0.00 H new ATOM 1398 N LEU A 88 22.413 -40.933 7.485 1.00 0.00 N ATOM 1399 CA LEU A 88 21.149 -41.212 8.177 1.00 0.00 C ATOM 1400 C LEU A 88 20.164 -40.033 8.115 1.00 0.00 C ATOM 1401 O LEU A 88 19.034 -40.198 7.661 1.00 0.00 O ATOM 1402 CB LEU A 88 21.468 -41.628 9.628 1.00 0.00 C ATOM 1403 CG LEU A 88 20.233 -41.964 10.489 1.00 0.00 C ATOM 1404 CD1 LEU A 88 19.467 -43.179 9.960 1.00 0.00 C ATOM 1405 CD2 LEU A 88 20.674 -42.267 11.922 1.00 0.00 C ATOM 0 H LEU A 88 23.225 -41.086 8.083 1.00 0.00 H new ATOM 0 HA LEU A 88 20.640 -42.030 7.667 1.00 0.00 H new ATOM 0 HB2 LEU A 88 22.126 -42.497 9.606 1.00 0.00 H new ATOM 0 HB3 LEU A 88 22.021 -40.821 10.109 1.00 0.00 H new ATOM 0 HG LEU A 88 19.574 -41.097 10.452 1.00 0.00 H new ATOM 0 HD11 LEU A 88 18.607 -43.374 10.601 1.00 0.00 H new ATOM 0 HD12 LEU A 88 19.125 -42.980 8.944 1.00 0.00 H new ATOM 0 HD13 LEU A 88 20.123 -44.050 9.958 1.00 0.00 H new ATOM 0 HD21 LEU A 88 19.800 -42.504 12.529 1.00 0.00 H new ATOM 0 HD22 LEU A 88 21.357 -43.117 11.921 1.00 0.00 H new ATOM 0 HD23 LEU A 88 21.180 -41.396 12.339 1.00 0.00 H new ATOM 1417 N GLU A 89 20.586 -38.840 8.545 1.00 0.00 N ATOM 1418 CA GLU A 89 19.739 -37.636 8.608 1.00 0.00 C ATOM 1419 C GLU A 89 19.152 -37.250 7.237 1.00 0.00 C ATOM 1420 O GLU A 89 17.982 -36.883 7.134 1.00 0.00 O ATOM 1421 CB GLU A 89 20.563 -36.480 9.197 1.00 0.00 C ATOM 1422 CG GLU A 89 19.738 -35.242 9.577 1.00 0.00 C ATOM 1423 CD GLU A 89 18.743 -35.528 10.720 1.00 0.00 C ATOM 1424 OE1 GLU A 89 19.165 -35.563 11.901 1.00 0.00 O ATOM 1425 OE2 GLU A 89 17.535 -35.713 10.439 1.00 0.00 O ATOM 0 H GLU A 89 21.541 -38.677 8.865 1.00 0.00 H new ATOM 0 HA GLU A 89 18.886 -37.853 9.250 1.00 0.00 H new ATOM 0 HB2 GLU A 89 21.087 -36.838 10.083 1.00 0.00 H new ATOM 0 HB3 GLU A 89 21.324 -36.187 8.473 1.00 0.00 H new ATOM 0 HG2 GLU A 89 20.411 -34.438 9.877 1.00 0.00 H new ATOM 0 HG3 GLU A 89 19.191 -34.890 8.702 1.00 0.00 H new ATOM 1432 N HIS A 90 19.933 -37.414 6.164 1.00 0.00 N ATOM 1433 CA HIS A 90 19.527 -37.161 4.774 1.00 0.00 C ATOM 1434 C HIS A 90 18.420 -38.111 4.259 1.00 0.00 C ATOM 1435 O HIS A 90 17.869 -37.888 3.179 1.00 0.00 O ATOM 1436 CB HIS A 90 20.771 -37.205 3.870 1.00 0.00 C ATOM 1437 CG HIS A 90 21.821 -36.176 4.226 1.00 0.00 C ATOM 1438 ND1 HIS A 90 21.942 -34.919 3.673 1.00 0.00 N ATOM 1439 CD2 HIS A 90 22.824 -36.317 5.149 1.00 0.00 C ATOM 1440 CE1 HIS A 90 22.990 -34.309 4.254 1.00 0.00 C ATOM 1441 NE2 HIS A 90 23.559 -35.125 5.158 1.00 0.00 N ATOM 0 H HIS A 90 20.897 -37.737 6.240 1.00 0.00 H new ATOM 0 HA HIS A 90 19.077 -36.169 4.743 1.00 0.00 H new ATOM 0 HB2 HIS A 90 21.215 -38.199 3.927 1.00 0.00 H new ATOM 0 HB3 HIS A 90 20.463 -37.053 2.836 1.00 0.00 H new ATOM 0 HD2 HIS A 90 23.013 -37.188 5.758 1.00 0.00 H new ATOM 0 HE1 HIS A 90 23.326 -33.308 4.027 1.00 0.00 H new ATOM 0 HE2 HIS A 90 24.371 -34.916 5.739 1.00 0.00 H new ATOM 1449 N HIS A 91 18.052 -39.132 5.042 1.00 0.00 N ATOM 1450 CA HIS A 91 16.977 -40.099 4.782 1.00 0.00 C ATOM 1451 C HIS A 91 15.963 -40.209 5.948 1.00 0.00 C ATOM 1452 O HIS A 91 15.031 -41.015 5.884 1.00 0.00 O ATOM 1453 CB HIS A 91 17.619 -41.463 4.471 1.00 0.00 C ATOM 1454 CG HIS A 91 18.566 -41.444 3.293 1.00 0.00 C ATOM 1455 ND1 HIS A 91 19.917 -41.175 3.341 1.00 0.00 N ATOM 1456 CD2 HIS A 91 18.237 -41.684 1.985 1.00 0.00 C ATOM 1457 CE1 HIS A 91 20.398 -41.248 2.089 1.00 0.00 C ATOM 1458 NE2 HIS A 91 19.411 -41.559 1.228 1.00 0.00 N ATOM 0 H HIS A 91 18.524 -39.317 5.927 1.00 0.00 H new ATOM 0 HA HIS A 91 16.397 -39.748 3.928 1.00 0.00 H new ATOM 0 HB2 HIS A 91 18.159 -41.808 5.353 1.00 0.00 H new ATOM 0 HB3 HIS A 91 16.829 -42.189 4.277 1.00 0.00 H new ATOM 0 HD1 HIS A 91 20.456 -40.959 4.179 1.00 0.00 H new ATOM 0 HD2 HIS A 91 17.255 -41.925 1.607 1.00 0.00 H new ATOM 0 HE1 HIS A 91 21.429 -41.081 1.813 1.00 0.00 H new ATOM 1466 N HIS A 92 16.136 -39.427 7.021 1.00 0.00 N ATOM 1467 CA HIS A 92 15.379 -39.532 8.275 1.00 0.00 C ATOM 1468 C HIS A 92 13.952 -38.941 8.191 1.00 0.00 C ATOM 1469 O HIS A 92 13.577 -38.269 7.227 1.00 0.00 O ATOM 1470 CB HIS A 92 16.218 -38.881 9.390 1.00 0.00 C ATOM 1471 CG HIS A 92 15.681 -39.068 10.788 1.00 0.00 C ATOM 1472 ND1 HIS A 92 15.446 -40.276 11.414 1.00 0.00 N ATOM 1473 CD2 HIS A 92 15.300 -38.072 11.648 1.00 0.00 C ATOM 1474 CE1 HIS A 92 14.928 -40.015 12.627 1.00 0.00 C ATOM 1475 NE2 HIS A 92 14.814 -38.687 12.809 1.00 0.00 N ATOM 0 H HIS A 92 16.829 -38.679 7.041 1.00 0.00 H new ATOM 0 HA HIS A 92 15.213 -40.586 8.496 1.00 0.00 H new ATOM 0 HB2 HIS A 92 17.228 -39.288 9.348 1.00 0.00 H new ATOM 0 HB3 HIS A 92 16.296 -37.813 9.188 1.00 0.00 H new ATOM 0 HD2 HIS A 92 15.363 -37.009 11.465 1.00 0.00 H new ATOM 0 HE1 HIS A 92 14.644 -40.764 13.351 1.00 0.00 H new ATOM 0 HE2 HIS A 92 14.444 -38.217 13.635 1.00 0.00 H new ATOM 1483 N HIS A 93 13.154 -39.175 9.236 1.00 0.00 N ATOM 1484 CA HIS A 93 11.731 -38.842 9.370 1.00 0.00 C ATOM 1485 C HIS A 93 11.392 -37.330 9.358 1.00 0.00 C ATOM 1486 O HIS A 93 10.214 -36.969 9.308 1.00 0.00 O ATOM 1487 CB HIS A 93 11.238 -39.520 10.662 1.00 0.00 C ATOM 1488 CG HIS A 93 9.738 -39.557 10.832 1.00 0.00 C ATOM 1489 ND1 HIS A 93 9.011 -38.876 11.785 1.00 0.00 N ATOM 1490 CD2 HIS A 93 8.857 -40.295 10.087 1.00 0.00 C ATOM 1491 CE1 HIS A 93 7.714 -39.188 11.616 1.00 0.00 C ATOM 1492 NE2 HIS A 93 7.573 -40.052 10.593 1.00 0.00 N ATOM 0 H HIS A 93 13.511 -39.636 10.073 1.00 0.00 H new ATOM 0 HA HIS A 93 11.215 -39.212 8.484 1.00 0.00 H new ATOM 0 HB2 HIS A 93 11.616 -40.542 10.685 1.00 0.00 H new ATOM 0 HB3 HIS A 93 11.672 -39.000 11.516 1.00 0.00 H new ATOM 0 HD2 HIS A 93 9.106 -40.945 9.261 1.00 0.00 H new ATOM 0 HE1 HIS A 93 6.902 -38.801 12.215 1.00 0.00 H new ATOM 0 HE2 HIS A 93 6.699 -40.453 10.252 1.00 0.00 H new ATOM 1500 N HIS A 94 12.383 -36.425 9.383 1.00 0.00 N ATOM 1501 CA HIS A 94 12.149 -34.971 9.372 1.00 0.00 C ATOM 1502 C HIS A 94 11.524 -34.434 8.060 1.00 0.00 C ATOM 1503 O HIS A 94 10.970 -33.330 8.053 1.00 0.00 O ATOM 1504 CB HIS A 94 13.446 -34.217 9.734 1.00 0.00 C ATOM 1505 CG HIS A 94 14.469 -34.065 8.627 1.00 0.00 C ATOM 1506 ND1 HIS A 94 15.729 -34.626 8.589 1.00 0.00 N ATOM 1507 CD2 HIS A 94 14.368 -33.222 7.550 1.00 0.00 C ATOM 1508 CE1 HIS A 94 16.358 -34.158 7.498 1.00 0.00 C ATOM 1509 NE2 HIS A 94 15.570 -33.294 6.837 1.00 0.00 N ATOM 0 H HIS A 94 13.370 -36.680 9.411 1.00 0.00 H new ATOM 0 HA HIS A 94 11.396 -34.779 10.136 1.00 0.00 H new ATOM 0 HB2 HIS A 94 13.175 -33.222 10.088 1.00 0.00 H new ATOM 0 HB3 HIS A 94 13.920 -34.734 10.568 1.00 0.00 H new ATOM 0 HD1 HIS A 94 16.115 -35.281 9.269 1.00 0.00 H new ATOM 0 HD2 HIS A 94 13.514 -32.612 7.297 1.00 0.00 H new ATOM 0 HE1 HIS A 94 17.356 -34.437 7.195 1.00 0.00 H new ATOM 1517 N HIS A 95 11.618 -35.193 6.959 1.00 0.00 N ATOM 1518 CA HIS A 95 11.087 -34.865 5.626 1.00 0.00 C ATOM 1519 C HIS A 95 9.545 -34.785 5.585 1.00 0.00 C ATOM 1520 O HIS A 95 8.866 -35.732 6.048 1.00 0.00 O ATOM 1521 CB HIS A 95 11.621 -35.884 4.604 1.00 0.00 C ATOM 1522 CG HIS A 95 13.113 -35.794 4.386 1.00 0.00 C ATOM 1523 ND1 HIS A 95 14.081 -36.471 5.092 1.00 0.00 N ATOM 1524 CD2 HIS A 95 13.749 -35.008 3.462 1.00 0.00 C ATOM 1525 CE1 HIS A 95 15.280 -36.092 4.618 1.00 0.00 C ATOM 1526 NE2 HIS A 95 15.128 -35.211 3.613 1.00 0.00 N ATOM 1527 OXT HIS A 95 9.017 -33.779 5.057 1.00 0.00 O ATOM 0 H HIS A 95 12.090 -36.097 6.974 1.00 0.00 H new ATOM 0 HA HIS A 95 11.436 -33.865 5.368 1.00 0.00 H new ATOM 0 HB2 HIS A 95 11.371 -36.890 4.941 1.00 0.00 H new ATOM 0 HB3 HIS A 95 11.113 -35.732 3.652 1.00 0.00 H new ATOM 0 HD1 HIS A 95 13.917 -37.142 5.843 1.00 0.00 H new ATOM 0 HD2 HIS A 95 13.275 -34.352 2.747 1.00 0.00 H new ATOM 0 HE1 HIS A 95 16.230 -36.445 4.991 1.00 0.00 H new TER 1535 HIS A 95 ATOM 1536 N GLY B 260 28.843 -45.499 -30.968 1.00 0.00 N ATOM 1537 CA GLY B 260 28.065 -45.167 -32.182 1.00 0.00 C ATOM 1538 C GLY B 260 27.744 -43.684 -32.238 1.00 0.00 C ATOM 1539 O GLY B 260 27.220 -43.129 -31.272 1.00 0.00 O ATOM 0 HA2 GLY B 260 28.630 -45.454 -33.069 1.00 0.00 H new ATOM 0 HA3 GLY B 260 27.140 -45.743 -32.193 1.00 0.00 H new ATOM 1545 N SER B 261 28.042 -43.023 -33.361 1.00 0.00 N ATOM 1546 CA SER B 261 27.971 -41.556 -33.532 1.00 0.00 C ATOM 1547 C SER B 261 26.584 -40.931 -33.299 1.00 0.00 C ATOM 1548 O SER B 261 26.493 -39.748 -32.973 1.00 0.00 O ATOM 1549 CB SER B 261 28.451 -41.176 -34.940 1.00 0.00 C ATOM 1550 OG SER B 261 29.738 -41.722 -35.206 1.00 0.00 O ATOM 0 H SER B 261 28.350 -43.503 -34.207 1.00 0.00 H new ATOM 0 HA SER B 261 28.618 -41.151 -32.754 1.00 0.00 H new ATOM 0 HB2 SER B 261 27.738 -41.538 -35.681 1.00 0.00 H new ATOM 0 HB3 SER B 261 28.486 -40.091 -35.035 1.00 0.00 H new ATOM 0 HG SER B 261 30.021 -41.468 -36.109 1.00 0.00 H new ATOM 1556 N HIS B 262 25.501 -41.710 -33.415 1.00 0.00 N ATOM 1557 CA HIS B 262 24.121 -41.272 -33.153 1.00 0.00 C ATOM 1558 C HIS B 262 23.853 -40.933 -31.665 1.00 0.00 C ATOM 1559 O HIS B 262 22.890 -40.229 -31.354 1.00 0.00 O ATOM 1560 CB HIS B 262 23.162 -42.363 -33.672 1.00 0.00 C ATOM 1561 CG HIS B 262 21.757 -41.897 -33.988 1.00 0.00 C ATOM 1562 ND1 HIS B 262 20.998 -41.009 -33.258 1.00 0.00 N ATOM 1563 CD2 HIS B 262 21.000 -42.296 -35.059 1.00 0.00 C ATOM 1564 CE1 HIS B 262 19.811 -40.866 -33.871 1.00 0.00 C ATOM 1565 NE2 HIS B 262 19.766 -41.633 -34.975 1.00 0.00 N ATOM 0 H HIS B 262 25.560 -42.687 -33.701 1.00 0.00 H new ATOM 0 HA HIS B 262 23.950 -40.336 -33.684 1.00 0.00 H new ATOM 0 HB2 HIS B 262 23.592 -42.802 -34.572 1.00 0.00 H new ATOM 0 HB3 HIS B 262 23.104 -43.156 -32.927 1.00 0.00 H new ATOM 0 HD1 HIS B 262 21.287 -40.540 -32.399 1.00 0.00 H new ATOM 0 HD2 HIS B 262 21.299 -42.994 -35.827 1.00 0.00 H new ATOM 0 HE1 HIS B 262 19.010 -40.228 -33.527 1.00 0.00 H new ATOM 1573 N MET B 263 24.708 -41.382 -30.733 1.00 0.00 N ATOM 1574 CA MET B 263 24.576 -41.171 -29.278 1.00 0.00 C ATOM 1575 C MET B 263 24.592 -39.685 -28.845 1.00 0.00 C ATOM 1576 O MET B 263 24.221 -39.359 -27.714 1.00 0.00 O ATOM 1577 CB MET B 263 25.665 -41.999 -28.569 1.00 0.00 C ATOM 1578 CG MET B 263 25.423 -42.166 -27.063 1.00 0.00 C ATOM 1579 SD MET B 263 26.617 -43.227 -26.201 1.00 0.00 S ATOM 1580 CE MET B 263 26.056 -44.866 -26.742 1.00 0.00 C ATOM 0 H MET B 263 25.539 -41.920 -30.977 1.00 0.00 H new ATOM 0 HA MET B 263 23.586 -41.514 -28.976 1.00 0.00 H new ATOM 0 HB2 MET B 263 25.720 -42.984 -29.032 1.00 0.00 H new ATOM 0 HB3 MET B 263 26.632 -41.520 -28.723 1.00 0.00 H new ATOM 0 HG2 MET B 263 25.435 -41.180 -26.598 1.00 0.00 H new ATOM 0 HG3 MET B 263 24.424 -42.576 -26.915 1.00 0.00 H new ATOM 0 HE1 MET B 263 26.679 -45.634 -26.283 1.00 0.00 H new ATOM 0 HE2 MET B 263 25.019 -45.013 -26.442 1.00 0.00 H new ATOM 0 HE3 MET B 263 26.133 -44.937 -27.827 1.00 0.00 H new ATOM 1590 N THR B 264 24.945 -38.763 -29.749 1.00 0.00 N ATOM 1591 CA THR B 264 24.810 -37.303 -29.579 1.00 0.00 C ATOM 1592 C THR B 264 23.377 -36.867 -29.241 1.00 0.00 C ATOM 1593 O THR B 264 23.191 -35.881 -28.525 1.00 0.00 O ATOM 1594 CB THR B 264 25.269 -36.549 -30.837 1.00 0.00 C ATOM 1595 OG1 THR B 264 24.605 -37.052 -31.979 1.00 0.00 O ATOM 1596 CG2 THR B 264 26.776 -36.683 -31.059 1.00 0.00 C ATOM 0 H THR B 264 25.347 -39.017 -30.651 1.00 0.00 H new ATOM 0 HA THR B 264 25.452 -37.049 -28.735 1.00 0.00 H new ATOM 0 HB THR B 264 25.025 -35.498 -30.686 1.00 0.00 H new ATOM 0 HG1 THR B 264 24.904 -36.563 -32.774 1.00 0.00 H new ATOM 0 HG21 THR B 264 27.061 -36.136 -31.958 1.00 0.00 H new ATOM 0 HG22 THR B 264 27.308 -36.273 -30.201 1.00 0.00 H new ATOM 0 HG23 THR B 264 27.034 -37.735 -31.177 1.00 0.00 H new ATOM 1604 N ILE B 265 22.361 -37.625 -29.679 1.00 0.00 N ATOM 1605 CA ILE B 265 20.934 -37.385 -29.398 1.00 0.00 C ATOM 1606 C ILE B 265 20.567 -37.483 -27.900 1.00 0.00 C ATOM 1607 O ILE B 265 19.562 -36.911 -27.473 1.00 0.00 O ATOM 1608 CB ILE B 265 20.079 -38.339 -30.274 1.00 0.00 C ATOM 1609 CG1 ILE B 265 18.613 -37.892 -30.467 1.00 0.00 C ATOM 1610 CG2 ILE B 265 20.074 -39.780 -29.730 1.00 0.00 C ATOM 1611 CD1 ILE B 265 18.463 -36.575 -31.239 1.00 0.00 C ATOM 0 H ILE B 265 22.513 -38.451 -30.258 1.00 0.00 H new ATOM 0 HA ILE B 265 20.713 -36.351 -29.662 1.00 0.00 H new ATOM 0 HB ILE B 265 20.571 -38.300 -31.246 1.00 0.00 H new ATOM 0 HG12 ILE B 265 18.071 -38.676 -30.996 1.00 0.00 H new ATOM 0 HG13 ILE B 265 18.144 -37.784 -29.489 1.00 0.00 H new ATOM 0 HG21 ILE B 265 19.463 -40.411 -30.376 1.00 0.00 H new ATOM 0 HG22 ILE B 265 21.094 -40.164 -29.708 1.00 0.00 H new ATOM 0 HG23 ILE B 265 19.662 -39.787 -28.721 1.00 0.00 H new ATOM 0 HD11 ILE B 265 17.406 -36.327 -31.334 1.00 0.00 H new ATOM 0 HD12 ILE B 265 18.976 -35.778 -30.701 1.00 0.00 H new ATOM 0 HD13 ILE B 265 18.901 -36.683 -32.231 1.00 0.00 H new ATOM 1623 N SER B 266 21.390 -38.165 -27.094 1.00 0.00 N ATOM 1624 CA SER B 266 21.120 -38.503 -25.683 1.00 0.00 C ATOM 1625 C SER B 266 22.007 -37.757 -24.671 1.00 0.00 C ATOM 1626 O SER B 266 21.886 -37.984 -23.464 1.00 0.00 O ATOM 1627 CB SER B 266 21.262 -40.019 -25.479 1.00 0.00 C ATOM 1628 OG SER B 266 20.350 -40.729 -26.305 1.00 0.00 O ATOM 0 H SER B 266 22.295 -38.511 -27.413 1.00 0.00 H new ATOM 0 HA SER B 266 20.099 -38.176 -25.485 1.00 0.00 H new ATOM 0 HB2 SER B 266 22.282 -40.327 -25.708 1.00 0.00 H new ATOM 0 HB3 SER B 266 21.081 -40.268 -24.433 1.00 0.00 H new ATOM 0 HG SER B 266 20.459 -41.692 -26.160 1.00 0.00 H new ATOM 1634 N GLN B 267 22.907 -36.879 -25.129 1.00 0.00 N ATOM 1635 CA GLN B 267 23.820 -36.115 -24.263 1.00 0.00 C ATOM 1636 C GLN B 267 23.111 -34.990 -23.480 1.00 0.00 C ATOM 1637 O GLN B 267 21.974 -34.610 -23.777 1.00 0.00 O ATOM 1638 CB GLN B 267 24.984 -35.541 -25.095 1.00 0.00 C ATOM 1639 CG GLN B 267 25.771 -36.606 -25.876 1.00 0.00 C ATOM 1640 CD GLN B 267 26.270 -37.751 -24.998 1.00 0.00 C ATOM 1641 OE1 GLN B 267 27.063 -37.578 -24.081 1.00 0.00 O ATOM 1642 NE2 GLN B 267 25.819 -38.963 -25.240 1.00 0.00 N ATOM 0 H GLN B 267 23.025 -36.675 -26.121 1.00 0.00 H new ATOM 0 HA GLN B 267 24.208 -36.812 -23.520 1.00 0.00 H new ATOM 0 HB2 GLN B 267 24.589 -34.807 -25.797 1.00 0.00 H new ATOM 0 HB3 GLN B 267 25.667 -35.012 -24.431 1.00 0.00 H new ATOM 0 HG2 GLN B 267 25.137 -37.011 -26.664 1.00 0.00 H new ATOM 0 HG3 GLN B 267 26.623 -36.133 -26.364 1.00 0.00 H new ATOM 0 HE21 GLN B 267 25.158 -39.119 -26.001 1.00 0.00 H new ATOM 0 HE22 GLN B 267 26.130 -39.747 -24.666 1.00 0.00 H new ATOM 1651 N GLN B 268 23.808 -34.434 -22.484 1.00 0.00 N ATOM 1652 CA GLN B 268 23.367 -33.289 -21.680 1.00 0.00 C ATOM 1653 C GLN B 268 23.137 -32.034 -22.545 1.00 0.00 C ATOM 1654 O GLN B 268 23.963 -31.685 -23.391 1.00 0.00 O ATOM 1655 CB GLN B 268 24.423 -33.037 -20.589 1.00 0.00 C ATOM 1656 CG GLN B 268 24.059 -31.889 -19.635 1.00 0.00 C ATOM 1657 CD GLN B 268 25.034 -31.797 -18.462 1.00 0.00 C ATOM 1658 OE1 GLN B 268 24.704 -32.075 -17.316 1.00 0.00 O ATOM 1659 NE2 GLN B 268 26.271 -31.409 -18.692 1.00 0.00 N ATOM 0 H GLN B 268 24.726 -34.780 -22.206 1.00 0.00 H new ATOM 0 HA GLN B 268 22.405 -33.516 -21.220 1.00 0.00 H new ATOM 0 HB2 GLN B 268 24.560 -33.950 -20.010 1.00 0.00 H new ATOM 0 HB3 GLN B 268 25.378 -32.814 -21.064 1.00 0.00 H new ATOM 0 HG2 GLN B 268 24.059 -30.947 -20.183 1.00 0.00 H new ATOM 0 HG3 GLN B 268 23.048 -32.037 -19.257 1.00 0.00 H new ATOM 0 HE21 GLN B 268 26.564 -31.173 -19.640 1.00 0.00 H new ATOM 0 HE22 GLN B 268 26.937 -31.344 -17.922 1.00 0.00 H new ATOM 1668 N GLU B 269 22.032 -31.322 -22.309 1.00 0.00 N ATOM 1669 CA GLU B 269 21.765 -30.003 -22.894 1.00 0.00 C ATOM 1670 C GLU B 269 22.520 -28.907 -22.113 1.00 0.00 C ATOM 1671 O GLU B 269 22.021 -28.360 -21.125 1.00 0.00 O ATOM 1672 CB GLU B 269 20.246 -29.761 -22.961 1.00 0.00 C ATOM 1673 CG GLU B 269 19.898 -28.519 -23.793 1.00 0.00 C ATOM 1674 CD GLU B 269 18.372 -28.336 -23.905 1.00 0.00 C ATOM 1675 OE1 GLU B 269 17.744 -28.954 -24.801 1.00 0.00 O ATOM 1676 OE2 GLU B 269 17.784 -27.567 -23.105 1.00 0.00 O ATOM 0 H GLU B 269 21.285 -31.650 -21.697 1.00 0.00 H new ATOM 0 HA GLU B 269 22.140 -29.966 -23.917 1.00 0.00 H new ATOM 0 HB2 GLU B 269 19.758 -30.635 -23.393 1.00 0.00 H new ATOM 0 HB3 GLU B 269 19.853 -29.643 -21.951 1.00 0.00 H new ATOM 0 HG2 GLU B 269 20.341 -27.635 -23.335 1.00 0.00 H new ATOM 0 HG3 GLU B 269 20.330 -28.612 -24.789 1.00 0.00 H new ATOM 1683 N PHE B 270 23.758 -28.618 -22.527 1.00 0.00 N ATOM 1684 CA PHE B 270 24.608 -27.563 -21.954 1.00 0.00 C ATOM 1685 C PHE B 270 24.016 -26.148 -22.148 1.00 0.00 C ATOM 1686 O PHE B 270 23.165 -25.919 -23.014 1.00 0.00 O ATOM 1687 CB PHE B 270 26.010 -27.650 -22.584 1.00 0.00 C ATOM 1688 CG PHE B 270 26.774 -28.928 -22.278 1.00 0.00 C ATOM 1689 CD1 PHE B 270 27.573 -29.013 -21.122 1.00 0.00 C ATOM 1690 CD2 PHE B 270 26.711 -30.025 -23.160 1.00 0.00 C ATOM 1691 CE1 PHE B 270 28.305 -30.183 -20.851 1.00 0.00 C ATOM 1692 CE2 PHE B 270 27.429 -31.202 -22.879 1.00 0.00 C ATOM 1693 CZ PHE B 270 28.228 -31.281 -21.726 1.00 0.00 C ATOM 0 H PHE B 270 24.210 -29.123 -23.289 1.00 0.00 H new ATOM 0 HA PHE B 270 24.666 -27.728 -20.878 1.00 0.00 H new ATOM 0 HB2 PHE B 270 25.913 -27.553 -23.665 1.00 0.00 H new ATOM 0 HB3 PHE B 270 26.600 -26.801 -22.240 1.00 0.00 H new ATOM 0 HD1 PHE B 270 27.624 -28.177 -20.441 1.00 0.00 H new ATOM 0 HD2 PHE B 270 26.110 -29.962 -24.055 1.00 0.00 H new ATOM 0 HE1 PHE B 270 28.927 -30.238 -19.970 1.00 0.00 H new ATOM 0 HE2 PHE B 270 27.366 -32.046 -23.550 1.00 0.00 H new ATOM 0 HZ PHE B 270 28.782 -32.183 -21.512 1.00 0.00 H new ATOM 1703 N GLY B 271 24.508 -25.176 -21.371 1.00 0.00 N ATOM 1704 CA GLY B 271 24.130 -23.759 -21.456 1.00 0.00 C ATOM 1705 C GLY B 271 25.185 -22.810 -20.870 1.00 0.00 C ATOM 1706 O GLY B 271 26.109 -23.238 -20.171 1.00 0.00 O ATOM 0 H GLY B 271 25.200 -25.358 -20.644 1.00 0.00 H new ATOM 0 HA2 GLY B 271 23.958 -23.499 -22.500 1.00 0.00 H new ATOM 0 HA3 GLY B 271 23.187 -23.610 -20.931 1.00 0.00 H new ATOM 1710 N ARG B 272 25.045 -21.508 -21.156 1.00 0.00 N ATOM 1711 CA ARG B 272 26.020 -20.452 -20.802 1.00 0.00 C ATOM 1712 C ARG B 272 25.893 -19.913 -19.368 1.00 0.00 C ATOM 1713 O ARG B 272 26.828 -19.278 -18.877 1.00 0.00 O ATOM 1714 CB ARG B 272 25.911 -19.289 -21.808 1.00 0.00 C ATOM 1715 CG ARG B 272 26.250 -19.719 -23.248 1.00 0.00 C ATOM 1716 CD ARG B 272 26.346 -18.527 -24.210 1.00 0.00 C ATOM 1717 NE ARG B 272 25.050 -17.840 -24.392 1.00 0.00 N ATOM 1718 CZ ARG B 272 24.830 -16.733 -25.080 1.00 0.00 C ATOM 1719 NH1 ARG B 272 25.785 -16.107 -25.709 1.00 0.00 N ATOM 1720 NH2 ARG B 272 23.631 -16.227 -25.153 1.00 0.00 N ATOM 0 H ARG B 272 24.232 -21.145 -21.653 1.00 0.00 H new ATOM 0 HA ARG B 272 27.001 -20.925 -20.852 1.00 0.00 H new ATOM 0 HB2 ARG B 272 24.899 -18.884 -21.782 1.00 0.00 H new ATOM 0 HB3 ARG B 272 26.583 -18.486 -21.504 1.00 0.00 H new ATOM 0 HG2 ARG B 272 27.196 -20.260 -23.249 1.00 0.00 H new ATOM 0 HG3 ARG B 272 25.487 -20.410 -23.606 1.00 0.00 H new ATOM 0 HD2 ARG B 272 27.080 -17.816 -23.830 1.00 0.00 H new ATOM 0 HD3 ARG B 272 26.709 -18.874 -25.178 1.00 0.00 H new ATOM 0 HE ARG B 272 24.241 -18.265 -23.939 1.00 0.00 H new ATOM 0 HH11 ARG B 272 26.738 -16.469 -25.680 1.00 0.00 H new ATOM 0 HH12 ARG B 272 25.579 -15.255 -26.230 1.00 0.00 H new ATOM 0 HH21 ARG B 272 22.854 -16.686 -24.677 1.00 0.00 H new ATOM 0 HH22 ARG B 272 23.470 -15.372 -25.686 1.00 0.00 H new ATOM 1734 N THR B 273 24.762 -20.153 -18.699 1.00 0.00 N ATOM 1735 CA THR B 273 24.397 -19.555 -17.397 1.00 0.00 C ATOM 1736 C THR B 273 23.937 -20.605 -16.378 1.00 0.00 C ATOM 1737 O THR B 273 24.611 -20.820 -15.369 1.00 0.00 O ATOM 1738 CB THR B 273 23.331 -18.454 -17.568 1.00 0.00 C ATOM 1739 OG1 THR B 273 22.211 -18.954 -18.272 1.00 0.00 O ATOM 1740 CG2 THR B 273 23.858 -17.248 -18.346 1.00 0.00 C ATOM 0 H THR B 273 24.047 -20.788 -19.054 1.00 0.00 H new ATOM 0 HA THR B 273 25.303 -19.098 -16.999 1.00 0.00 H new ATOM 0 HB THR B 273 23.057 -18.141 -16.561 1.00 0.00 H new ATOM 0 HG1 THR B 273 21.543 -18.244 -18.371 1.00 0.00 H new ATOM 0 HG21 THR B 273 23.069 -16.502 -18.439 1.00 0.00 H new ATOM 0 HG22 THR B 273 24.706 -16.815 -17.816 1.00 0.00 H new ATOM 0 HG23 THR B 273 24.175 -17.566 -19.339 1.00 0.00 H new ATOM 1748 N GLY B 274 22.799 -21.265 -16.621 1.00 0.00 N ATOM 1749 CA GLY B 274 22.209 -22.285 -15.740 1.00 0.00 C ATOM 1750 C GLY B 274 21.541 -21.740 -14.464 1.00 0.00 C ATOM 1751 O GLY B 274 21.238 -22.517 -13.555 1.00 0.00 O ATOM 0 H GLY B 274 22.245 -21.101 -17.461 1.00 0.00 H new ATOM 0 HA2 GLY B 274 21.468 -22.848 -16.307 1.00 0.00 H new ATOM 0 HA3 GLY B 274 22.990 -22.988 -15.450 1.00 0.00 H new ATOM 1755 N LEU B 275 21.328 -20.421 -14.369 1.00 0.00 N ATOM 1756 CA LEU B 275 20.759 -19.725 -13.206 1.00 0.00 C ATOM 1757 C LEU B 275 19.329 -20.231 -12.876 1.00 0.00 C ATOM 1758 O LEU B 275 18.453 -20.165 -13.747 1.00 0.00 O ATOM 1759 CB LEU B 275 20.776 -18.212 -13.491 1.00 0.00 C ATOM 1760 CG LEU B 275 20.414 -17.329 -12.282 1.00 0.00 C ATOM 1761 CD1 LEU B 275 21.573 -17.231 -11.287 1.00 0.00 C ATOM 1762 CD2 LEU B 275 20.084 -15.911 -12.752 1.00 0.00 C ATOM 0 H LEU B 275 21.557 -19.783 -15.131 1.00 0.00 H new ATOM 0 HA LEU B 275 21.363 -19.937 -12.324 1.00 0.00 H new ATOM 0 HB2 LEU B 275 21.769 -17.933 -13.844 1.00 0.00 H new ATOM 0 HB3 LEU B 275 20.078 -18.000 -14.301 1.00 0.00 H new ATOM 0 HG LEU B 275 19.556 -17.791 -11.793 1.00 0.00 H new ATOM 0 HD11 LEU B 275 21.280 -16.600 -10.448 1.00 0.00 H new ATOM 0 HD12 LEU B 275 21.824 -18.227 -10.922 1.00 0.00 H new ATOM 0 HD13 LEU B 275 22.442 -16.796 -11.782 1.00 0.00 H new ATOM 0 HD21 LEU B 275 19.829 -15.293 -11.891 1.00 0.00 H new ATOM 0 HD22 LEU B 275 20.949 -15.486 -13.261 1.00 0.00 H new ATOM 0 HD23 LEU B 275 19.238 -15.943 -13.439 1.00 0.00 H new ATOM 1774 N PRO B 276 19.071 -20.748 -11.658 1.00 0.00 N ATOM 1775 CA PRO B 276 17.788 -21.348 -11.291 1.00 0.00 C ATOM 1776 C PRO B 276 16.688 -20.327 -10.987 1.00 0.00 C ATOM 1777 O PRO B 276 16.942 -19.163 -10.672 1.00 0.00 O ATOM 1778 CB PRO B 276 18.067 -22.160 -10.020 1.00 0.00 C ATOM 1779 CG PRO B 276 19.244 -21.445 -9.381 1.00 0.00 C ATOM 1780 CD PRO B 276 20.017 -20.858 -10.561 1.00 0.00 C ATOM 0 HA PRO B 276 17.420 -21.939 -12.130 1.00 0.00 H new ATOM 0 HB2 PRO B 276 17.201 -22.175 -9.358 1.00 0.00 H new ATOM 0 HB3 PRO B 276 18.308 -23.197 -10.253 1.00 0.00 H new ATOM 0 HG2 PRO B 276 18.911 -20.665 -8.696 1.00 0.00 H new ATOM 0 HG3 PRO B 276 19.862 -22.133 -8.804 1.00 0.00 H new ATOM 0 HD2 PRO B 276 20.432 -19.883 -10.307 1.00 0.00 H new ATOM 0 HD3 PRO B 276 20.855 -21.499 -10.834 1.00 0.00 H new ATOM 1788 N ASP B 277 15.446 -20.812 -10.960 1.00 0.00 N ATOM 1789 CA ASP B 277 14.261 -20.096 -10.466 1.00 0.00 C ATOM 1790 C ASP B 277 14.203 -20.218 -8.924 1.00 0.00 C ATOM 1791 O ASP B 277 13.247 -20.718 -8.329 1.00 0.00 O ATOM 1792 CB ASP B 277 13.024 -20.670 -11.166 1.00 0.00 C ATOM 1793 CG ASP B 277 11.722 -19.923 -10.817 1.00 0.00 C ATOM 1794 OD1 ASP B 277 11.748 -18.677 -10.666 1.00 0.00 O ATOM 1795 OD2 ASP B 277 10.652 -20.576 -10.743 1.00 0.00 O ATOM 0 H ASP B 277 15.226 -21.750 -11.294 1.00 0.00 H new ATOM 0 HA ASP B 277 14.304 -19.031 -10.696 1.00 0.00 H new ATOM 0 HB2 ASP B 277 13.177 -20.634 -12.245 1.00 0.00 H new ATOM 0 HB3 ASP B 277 12.916 -21.720 -10.894 1.00 0.00 H new ATOM 1800 N LEU B 278 15.313 -19.830 -8.290 1.00 0.00 N ATOM 1801 CA LEU B 278 15.691 -19.922 -6.870 1.00 0.00 C ATOM 1802 C LEU B 278 15.822 -21.334 -6.273 1.00 0.00 C ATOM 1803 O LEU B 278 16.371 -21.473 -5.179 1.00 0.00 O ATOM 1804 CB LEU B 278 14.798 -19.034 -5.989 1.00 0.00 C ATOM 1805 CG LEU B 278 14.578 -17.597 -6.495 1.00 0.00 C ATOM 1806 CD1 LEU B 278 14.009 -16.741 -5.362 1.00 0.00 C ATOM 1807 CD2 LEU B 278 15.866 -16.940 -7.004 1.00 0.00 C ATOM 0 H LEU B 278 16.062 -19.389 -8.823 1.00 0.00 H new ATOM 0 HA LEU B 278 16.714 -19.545 -6.866 1.00 0.00 H new ATOM 0 HB2 LEU B 278 13.826 -19.516 -5.887 1.00 0.00 H new ATOM 0 HB3 LEU B 278 15.236 -18.985 -4.992 1.00 0.00 H new ATOM 0 HG LEU B 278 13.883 -17.659 -7.333 1.00 0.00 H new ATOM 0 HD11 LEU B 278 13.853 -15.723 -5.719 1.00 0.00 H new ATOM 0 HD12 LEU B 278 13.058 -17.160 -5.032 1.00 0.00 H new ATOM 0 HD13 LEU B 278 14.710 -16.729 -4.527 1.00 0.00 H new ATOM 0 HD21 LEU B 278 15.648 -15.929 -7.347 1.00 0.00 H new ATOM 0 HD22 LEU B 278 16.597 -16.899 -6.197 1.00 0.00 H new ATOM 0 HD23 LEU B 278 16.270 -17.524 -7.830 1.00 0.00 H new ATOM 1819 N SER B 279 15.386 -22.379 -6.975 1.00 0.00 N ATOM 1820 CA SER B 279 15.329 -23.769 -6.502 1.00 0.00 C ATOM 1821 C SER B 279 16.651 -24.280 -5.913 1.00 0.00 C ATOM 1822 O SER B 279 16.728 -24.591 -4.722 1.00 0.00 O ATOM 1823 CB SER B 279 14.818 -24.682 -7.627 1.00 0.00 C ATOM 1824 OG SER B 279 15.578 -24.500 -8.815 1.00 0.00 O ATOM 0 H SER B 279 15.047 -22.280 -7.932 1.00 0.00 H new ATOM 0 HA SER B 279 14.625 -23.792 -5.670 1.00 0.00 H new ATOM 0 HB2 SER B 279 14.876 -25.723 -7.310 1.00 0.00 H new ATOM 0 HB3 SER B 279 13.768 -24.467 -7.826 1.00 0.00 H new ATOM 0 HG SER B 279 15.236 -25.093 -9.516 1.00 0.00 H new ATOM 1830 N SER B 280 17.709 -24.306 -6.722 1.00 0.00 N ATOM 1831 CA SER B 280 19.069 -24.740 -6.347 1.00 0.00 C ATOM 1832 C SER B 280 20.012 -23.585 -5.960 1.00 0.00 C ATOM 1833 O SER B 280 21.185 -23.812 -5.655 1.00 0.00 O ATOM 1834 CB SER B 280 19.670 -25.593 -7.471 1.00 0.00 C ATOM 1835 OG SER B 280 19.765 -24.856 -8.679 1.00 0.00 O ATOM 0 H SER B 280 17.648 -24.015 -7.698 1.00 0.00 H new ATOM 0 HA SER B 280 18.967 -25.340 -5.442 1.00 0.00 H new ATOM 0 HB2 SER B 280 20.659 -25.943 -7.176 1.00 0.00 H new ATOM 0 HB3 SER B 280 19.053 -26.478 -7.629 1.00 0.00 H new ATOM 0 HG SER B 280 20.153 -25.423 -9.378 1.00 0.00 H new ATOM 1841 N MET B 281 19.508 -22.344 -5.943 1.00 0.00 N ATOM 1842 CA MET B 281 20.257 -21.120 -5.624 1.00 0.00 C ATOM 1843 C MET B 281 20.863 -21.156 -4.213 1.00 0.00 C ATOM 1844 O MET B 281 20.169 -21.488 -3.246 1.00 0.00 O ATOM 1845 CB MET B 281 19.318 -19.912 -5.750 1.00 0.00 C ATOM 1846 CG MET B 281 20.068 -18.596 -5.972 1.00 0.00 C ATOM 1847 SD MET B 281 20.588 -18.301 -7.686 1.00 0.00 S ATOM 1848 CE MET B 281 19.015 -17.738 -8.407 1.00 0.00 C ATOM 0 H MET B 281 18.529 -22.157 -6.160 1.00 0.00 H new ATOM 0 HA MET B 281 21.084 -21.041 -6.329 1.00 0.00 H new ATOM 0 HB2 MET B 281 18.631 -20.077 -6.580 1.00 0.00 H new ATOM 0 HB3 MET B 281 18.714 -19.832 -4.846 1.00 0.00 H new ATOM 0 HG2 MET B 281 19.430 -17.772 -5.653 1.00 0.00 H new ATOM 0 HG3 MET B 281 20.950 -18.583 -5.332 1.00 0.00 H new ATOM 0 HE1 MET B 281 19.159 -17.513 -9.464 1.00 0.00 H new ATOM 0 HE2 MET B 281 18.265 -18.522 -8.302 1.00 0.00 H new ATOM 0 HE3 MET B 281 18.677 -16.841 -7.888 1.00 0.00 H new ATOM 1858 N THR B 282 22.135 -20.780 -4.081 1.00 0.00 N ATOM 1859 CA THR B 282 22.793 -20.547 -2.783 1.00 0.00 C ATOM 1860 C THR B 282 22.187 -19.307 -2.113 1.00 0.00 C ATOM 1861 O THR B 282 21.796 -18.360 -2.796 1.00 0.00 O ATOM 1862 CB THR B 282 24.305 -20.343 -2.987 1.00 0.00 C ATOM 1863 OG1 THR B 282 24.840 -21.378 -3.792 1.00 0.00 O ATOM 1864 CG2 THR B 282 25.113 -20.328 -1.689 1.00 0.00 C ATOM 0 H THR B 282 22.751 -20.625 -4.879 1.00 0.00 H new ATOM 0 HA THR B 282 22.637 -21.416 -2.143 1.00 0.00 H new ATOM 0 HB THR B 282 24.392 -19.365 -3.460 1.00 0.00 H new ATOM 0 HG1 THR B 282 25.802 -21.234 -3.914 1.00 0.00 H new ATOM 0 HG21 THR B 282 26.168 -20.180 -1.919 1.00 0.00 H new ATOM 0 HG22 THR B 282 24.763 -19.516 -1.052 1.00 0.00 H new ATOM 0 HG23 THR B 282 24.985 -21.278 -1.170 1.00 0.00 H new ATOM 1872 N GLU B 283 22.129 -19.273 -0.780 1.00 0.00 N ATOM 1873 CA GLU B 283 21.542 -18.159 -0.013 1.00 0.00 C ATOM 1874 C GLU B 283 22.192 -16.802 -0.349 1.00 0.00 C ATOM 1875 O GLU B 283 21.494 -15.817 -0.582 1.00 0.00 O ATOM 1876 CB GLU B 283 21.643 -18.480 1.488 1.00 0.00 C ATOM 1877 CG GLU B 283 20.948 -17.442 2.376 1.00 0.00 C ATOM 1878 CD GLU B 283 21.021 -17.854 3.858 1.00 0.00 C ATOM 1879 OE1 GLU B 283 22.026 -17.529 4.536 1.00 0.00 O ATOM 1880 OE2 GLU B 283 20.074 -18.509 4.358 1.00 0.00 O ATOM 0 H GLU B 283 22.491 -20.023 -0.191 1.00 0.00 H new ATOM 0 HA GLU B 283 20.494 -18.059 -0.294 1.00 0.00 H new ATOM 0 HB2 GLU B 283 21.203 -19.460 1.674 1.00 0.00 H new ATOM 0 HB3 GLU B 283 22.694 -18.544 1.769 1.00 0.00 H new ATOM 0 HG2 GLU B 283 21.418 -16.468 2.241 1.00 0.00 H new ATOM 0 HG3 GLU B 283 19.906 -17.337 2.074 1.00 0.00 H new ATOM 1887 N GLU B 284 23.525 -16.754 -0.431 1.00 0.00 N ATOM 1888 CA GLU B 284 24.286 -15.551 -0.798 1.00 0.00 C ATOM 1889 C GLU B 284 23.967 -15.054 -2.222 1.00 0.00 C ATOM 1890 O GLU B 284 23.824 -13.851 -2.437 1.00 0.00 O ATOM 1891 CB GLU B 284 25.786 -15.840 -0.618 1.00 0.00 C ATOM 1892 CG GLU B 284 26.652 -14.580 -0.752 1.00 0.00 C ATOM 1893 CD GLU B 284 28.120 -14.873 -0.385 1.00 0.00 C ATOM 1894 OE1 GLU B 284 28.472 -14.817 0.820 1.00 0.00 O ATOM 1895 OE2 GLU B 284 28.942 -15.150 -1.293 1.00 0.00 O ATOM 0 H GLU B 284 24.118 -17.562 -0.241 1.00 0.00 H new ATOM 0 HA GLU B 284 23.988 -14.738 -0.136 1.00 0.00 H new ATOM 0 HB2 GLU B 284 25.951 -16.287 0.363 1.00 0.00 H new ATOM 0 HB3 GLU B 284 26.102 -16.574 -1.360 1.00 0.00 H new ATOM 0 HG2 GLU B 284 26.598 -14.205 -1.774 1.00 0.00 H new ATOM 0 HG3 GLU B 284 26.261 -13.796 -0.103 1.00 0.00 H new ATOM 1902 N GLU B 285 23.795 -15.959 -3.191 1.00 0.00 N ATOM 1903 CA GLU B 285 23.374 -15.635 -4.565 1.00 0.00 C ATOM 1904 C GLU B 285 21.914 -15.151 -4.629 1.00 0.00 C ATOM 1905 O GLU B 285 21.605 -14.201 -5.351 1.00 0.00 O ATOM 1906 CB GLU B 285 23.569 -16.863 -5.474 1.00 0.00 C ATOM 1907 CG GLU B 285 24.940 -16.914 -6.164 1.00 0.00 C ATOM 1908 CD GLU B 285 26.133 -16.774 -5.198 1.00 0.00 C ATOM 1909 OE1 GLU B 285 26.441 -17.740 -4.459 1.00 0.00 O ATOM 1910 OE2 GLU B 285 26.791 -15.705 -5.201 1.00 0.00 O ATOM 0 H GLU B 285 23.946 -16.957 -3.043 1.00 0.00 H new ATOM 0 HA GLU B 285 24.000 -14.815 -4.916 1.00 0.00 H new ATOM 0 HB2 GLU B 285 23.438 -17.767 -4.880 1.00 0.00 H new ATOM 0 HB3 GLU B 285 22.789 -16.867 -6.236 1.00 0.00 H new ATOM 0 HG2 GLU B 285 25.030 -17.858 -6.702 1.00 0.00 H new ATOM 0 HG3 GLU B 285 24.992 -16.118 -6.907 1.00 0.00 H new ATOM 1917 N GLN B 286 21.015 -15.763 -3.852 1.00 0.00 N ATOM 1918 CA GLN B 286 19.612 -15.354 -3.727 1.00 0.00 C ATOM 1919 C GLN B 286 19.487 -13.936 -3.129 1.00 0.00 C ATOM 1920 O GLN B 286 18.711 -13.114 -3.619 1.00 0.00 O ATOM 1921 CB GLN B 286 18.877 -16.407 -2.883 1.00 0.00 C ATOM 1922 CG GLN B 286 17.355 -16.360 -3.065 1.00 0.00 C ATOM 1923 CD GLN B 286 16.616 -17.387 -2.200 1.00 0.00 C ATOM 1924 OE1 GLN B 286 17.076 -18.491 -1.941 1.00 0.00 O ATOM 1925 NE2 GLN B 286 15.430 -17.071 -1.724 1.00 0.00 N ATOM 0 H GLN B 286 21.247 -16.575 -3.280 1.00 0.00 H new ATOM 0 HA GLN B 286 19.152 -15.301 -4.714 1.00 0.00 H new ATOM 0 HB2 GLN B 286 19.240 -17.399 -3.152 1.00 0.00 H new ATOM 0 HB3 GLN B 286 19.117 -16.254 -1.831 1.00 0.00 H new ATOM 0 HG2 GLN B 286 16.996 -15.361 -2.819 1.00 0.00 H new ATOM 0 HG3 GLN B 286 17.114 -16.536 -4.113 1.00 0.00 H new ATOM 0 HE21 GLN B 286 15.026 -16.157 -1.927 1.00 0.00 H new ATOM 0 HE22 GLN B 286 14.915 -17.741 -1.152 1.00 0.00 H new ATOM 1934 N ILE B 287 20.293 -13.625 -2.107 1.00 0.00 N ATOM 1935 CA ILE B 287 20.466 -12.272 -1.558 1.00 0.00 C ATOM 1936 C ILE B 287 21.056 -11.325 -2.615 1.00 0.00 C ATOM 1937 O ILE B 287 20.506 -10.248 -2.822 1.00 0.00 O ATOM 1938 CB ILE B 287 21.302 -12.315 -0.256 1.00 0.00 C ATOM 1939 CG1 ILE B 287 20.459 -12.954 0.875 1.00 0.00 C ATOM 1940 CG2 ILE B 287 21.767 -10.908 0.163 1.00 0.00 C ATOM 1941 CD1 ILE B 287 21.267 -13.330 2.124 1.00 0.00 C ATOM 0 H ILE B 287 20.858 -14.324 -1.625 1.00 0.00 H new ATOM 0 HA ILE B 287 19.489 -11.870 -1.291 1.00 0.00 H new ATOM 0 HB ILE B 287 22.192 -12.917 -0.439 1.00 0.00 H new ATOM 0 HG12 ILE B 287 19.670 -12.259 1.162 1.00 0.00 H new ATOM 0 HG13 ILE B 287 19.971 -13.849 0.488 1.00 0.00 H new ATOM 0 HG21 ILE B 287 22.351 -10.976 1.081 1.00 0.00 H new ATOM 0 HG22 ILE B 287 22.382 -10.478 -0.627 1.00 0.00 H new ATOM 0 HG23 ILE B 287 20.898 -10.273 0.333 1.00 0.00 H new ATOM 0 HD11 ILE B 287 20.603 -13.771 2.868 1.00 0.00 H new ATOM 0 HD12 ILE B 287 22.039 -14.050 1.854 1.00 0.00 H new ATOM 0 HD13 ILE B 287 21.733 -12.436 2.538 1.00 0.00 H new ATOM 1953 N ALA B 288 22.134 -11.694 -3.316 1.00 0.00 N ATOM 1954 CA ALA B 288 22.742 -10.858 -4.360 1.00 0.00 C ATOM 1955 C ALA B 288 21.753 -10.476 -5.484 1.00 0.00 C ATOM 1956 O ALA B 288 21.758 -9.334 -5.948 1.00 0.00 O ATOM 1957 CB ALA B 288 23.985 -11.564 -4.916 1.00 0.00 C ATOM 0 H ALA B 288 22.612 -12.584 -3.175 1.00 0.00 H new ATOM 0 HA ALA B 288 23.036 -9.914 -3.902 1.00 0.00 H new ATOM 0 HB1 ALA B 288 24.438 -10.946 -5.691 1.00 0.00 H new ATOM 0 HB2 ALA B 288 24.704 -11.723 -4.112 1.00 0.00 H new ATOM 0 HB3 ALA B 288 23.698 -12.526 -5.341 1.00 0.00 H new ATOM 1963 N TYR B 289 20.862 -11.392 -5.878 1.00 0.00 N ATOM 1964 CA TYR B 289 19.731 -11.118 -6.771 1.00 0.00 C ATOM 1965 C TYR B 289 18.790 -10.037 -6.195 1.00 0.00 C ATOM 1966 O TYR B 289 18.458 -9.070 -6.887 1.00 0.00 O ATOM 1967 CB TYR B 289 19.002 -12.441 -7.072 1.00 0.00 C ATOM 1968 CG TYR B 289 17.710 -12.320 -7.865 1.00 0.00 C ATOM 1969 CD1 TYR B 289 17.629 -11.490 -9.004 1.00 0.00 C ATOM 1970 CD2 TYR B 289 16.583 -13.066 -7.467 1.00 0.00 C ATOM 1971 CE1 TYR B 289 16.421 -11.388 -9.723 1.00 0.00 C ATOM 1972 CE2 TYR B 289 15.380 -12.978 -8.192 1.00 0.00 C ATOM 1973 CZ TYR B 289 15.291 -12.129 -9.316 1.00 0.00 C ATOM 1974 OH TYR B 289 14.124 -12.033 -10.009 1.00 0.00 O ATOM 0 H TYR B 289 20.908 -12.366 -5.578 1.00 0.00 H new ATOM 0 HA TYR B 289 20.103 -10.705 -7.709 1.00 0.00 H new ATOM 0 HB2 TYR B 289 19.683 -13.092 -7.620 1.00 0.00 H new ATOM 0 HB3 TYR B 289 18.780 -12.935 -6.126 1.00 0.00 H new ATOM 0 HD1 TYR B 289 18.496 -10.931 -9.326 1.00 0.00 H new ATOM 0 HD2 TYR B 289 16.643 -13.709 -6.601 1.00 0.00 H new ATOM 0 HE1 TYR B 289 16.360 -10.742 -10.586 1.00 0.00 H new ATOM 0 HE2 TYR B 289 14.523 -13.561 -7.888 1.00 0.00 H new ATOM 0 HH TYR B 289 13.387 -12.367 -9.456 1.00 0.00 H new ATOM 1984 N ALA B 290 18.414 -10.142 -4.914 1.00 0.00 N ATOM 1985 CA ALA B 290 17.652 -9.114 -4.201 1.00 0.00 C ATOM 1986 C ALA B 290 18.356 -7.737 -4.178 1.00 0.00 C ATOM 1987 O ALA B 290 17.728 -6.722 -4.493 1.00 0.00 O ATOM 1988 CB ALA B 290 17.345 -9.610 -2.782 1.00 0.00 C ATOM 0 H ALA B 290 18.634 -10.955 -4.338 1.00 0.00 H new ATOM 0 HA ALA B 290 16.721 -8.952 -4.745 1.00 0.00 H new ATOM 0 HB1 ALA B 290 16.778 -8.849 -2.245 1.00 0.00 H new ATOM 0 HB2 ALA B 290 16.760 -10.528 -2.836 1.00 0.00 H new ATOM 0 HB3 ALA B 290 18.279 -9.805 -2.255 1.00 0.00 H new ATOM 1994 N MET B 291 19.659 -7.696 -3.851 1.00 0.00 N ATOM 1995 CA MET B 291 20.497 -6.491 -3.891 1.00 0.00 C ATOM 1996 C MET B 291 20.429 -5.825 -5.268 1.00 0.00 C ATOM 1997 O MET B 291 20.051 -4.658 -5.361 1.00 0.00 O ATOM 1998 CB MET B 291 21.967 -6.790 -3.536 1.00 0.00 C ATOM 1999 CG MET B 291 22.230 -7.414 -2.161 1.00 0.00 C ATOM 2000 SD MET B 291 21.628 -6.494 -0.725 1.00 0.00 S ATOM 2001 CE MET B 291 22.820 -7.077 0.509 1.00 0.00 C ATOM 0 H MET B 291 20.170 -8.524 -3.544 1.00 0.00 H new ATOM 0 HA MET B 291 20.100 -5.811 -3.138 1.00 0.00 H new ATOM 0 HB2 MET B 291 22.371 -7.459 -4.296 1.00 0.00 H new ATOM 0 HB3 MET B 291 22.529 -5.858 -3.600 1.00 0.00 H new ATOM 0 HG2 MET B 291 21.777 -8.405 -2.145 1.00 0.00 H new ATOM 0 HG3 MET B 291 23.305 -7.553 -2.050 1.00 0.00 H new ATOM 0 HE1 MET B 291 22.782 -6.430 1.385 1.00 0.00 H new ATOM 0 HE2 MET B 291 22.572 -8.098 0.801 1.00 0.00 H new ATOM 0 HE3 MET B 291 23.824 -7.055 0.084 1.00 0.00 H new ATOM 2011 N GLN B 292 20.737 -6.570 -6.336 1.00 0.00 N ATOM 2012 CA GLN B 292 20.678 -6.115 -7.730 1.00 0.00 C ATOM 2013 C GLN B 292 19.361 -5.412 -8.066 1.00 0.00 C ATOM 2014 O GLN B 292 19.387 -4.328 -8.650 1.00 0.00 O ATOM 2015 CB GLN B 292 20.952 -7.305 -8.676 1.00 0.00 C ATOM 2016 CG GLN B 292 20.268 -7.205 -10.054 1.00 0.00 C ATOM 2017 CD GLN B 292 20.834 -8.222 -11.041 1.00 0.00 C ATOM 2018 OE1 GLN B 292 20.517 -9.405 -11.008 1.00 0.00 O ATOM 2019 NE2 GLN B 292 21.687 -7.816 -11.959 1.00 0.00 N ATOM 0 H GLN B 292 21.045 -7.539 -6.251 1.00 0.00 H new ATOM 0 HA GLN B 292 21.455 -5.364 -7.872 1.00 0.00 H new ATOM 0 HB2 GLN B 292 22.028 -7.392 -8.825 1.00 0.00 H new ATOM 0 HB3 GLN B 292 20.623 -8.222 -8.188 1.00 0.00 H new ATOM 0 HG2 GLN B 292 19.196 -7.366 -9.941 1.00 0.00 H new ATOM 0 HG3 GLN B 292 20.399 -6.199 -10.453 1.00 0.00 H new ATOM 0 HE21 GLN B 292 21.962 -6.835 -12.001 1.00 0.00 H new ATOM 0 HE22 GLN B 292 22.072 -8.483 -12.628 1.00 0.00 H new ATOM 2028 N MET B 293 18.213 -6.008 -7.732 1.00 0.00 N ATOM 2029 CA MET B 293 16.935 -5.399 -8.100 1.00 0.00 C ATOM 2030 C MET B 293 16.721 -4.051 -7.393 1.00 0.00 C ATOM 2031 O MET B 293 16.342 -3.077 -8.041 1.00 0.00 O ATOM 2032 CB MET B 293 15.761 -6.342 -7.820 1.00 0.00 C ATOM 2033 CG MET B 293 15.745 -7.543 -8.771 1.00 0.00 C ATOM 2034 SD MET B 293 14.159 -8.419 -8.815 1.00 0.00 S ATOM 2035 CE MET B 293 14.037 -8.954 -7.088 1.00 0.00 C ATOM 0 H MET B 293 18.142 -6.888 -7.221 1.00 0.00 H new ATOM 0 HA MET B 293 16.973 -5.213 -9.173 1.00 0.00 H new ATOM 0 HB2 MET B 293 15.819 -6.696 -6.791 1.00 0.00 H new ATOM 0 HB3 MET B 293 14.825 -5.792 -7.916 1.00 0.00 H new ATOM 0 HG2 MET B 293 15.989 -7.201 -9.777 1.00 0.00 H new ATOM 0 HG3 MET B 293 16.527 -8.241 -8.473 1.00 0.00 H new ATOM 0 HE1 MET B 293 13.035 -9.336 -6.895 1.00 0.00 H new ATOM 0 HE2 MET B 293 14.768 -9.740 -6.898 1.00 0.00 H new ATOM 0 HE3 MET B 293 14.235 -8.108 -6.430 1.00 0.00 H new ATOM 2045 N SER B 294 17.004 -3.957 -6.088 1.00 0.00 N ATOM 2046 CA SER B 294 16.925 -2.682 -5.352 1.00 0.00 C ATOM 2047 C SER B 294 17.941 -1.630 -5.838 1.00 0.00 C ATOM 2048 O SER B 294 17.622 -0.440 -5.881 1.00 0.00 O ATOM 2049 CB SER B 294 17.056 -2.915 -3.845 1.00 0.00 C ATOM 2050 OG SER B 294 18.385 -3.221 -3.480 1.00 0.00 O ATOM 0 H SER B 294 17.291 -4.750 -5.515 1.00 0.00 H new ATOM 0 HA SER B 294 15.938 -2.269 -5.562 1.00 0.00 H new ATOM 0 HB2 SER B 294 16.727 -2.025 -3.309 1.00 0.00 H new ATOM 0 HB3 SER B 294 16.398 -3.730 -3.544 1.00 0.00 H new ATOM 0 HG SER B 294 18.826 -3.693 -4.217 1.00 0.00 H new ATOM 2056 N LEU B 295 19.136 -2.050 -6.276 1.00 0.00 N ATOM 2057 CA LEU B 295 20.140 -1.200 -6.932 1.00 0.00 C ATOM 2058 C LEU B 295 19.655 -0.678 -8.295 1.00 0.00 C ATOM 2059 O LEU B 295 19.880 0.486 -8.624 1.00 0.00 O ATOM 2060 CB LEU B 295 21.456 -1.980 -7.102 1.00 0.00 C ATOM 2061 CG LEU B 295 22.215 -2.259 -5.794 1.00 0.00 C ATOM 2062 CD1 LEU B 295 23.268 -3.347 -6.012 1.00 0.00 C ATOM 2063 CD2 LEU B 295 22.934 -1.007 -5.296 1.00 0.00 C ATOM 0 H LEU B 295 19.440 -3.019 -6.181 1.00 0.00 H new ATOM 0 HA LEU B 295 20.307 -0.333 -6.292 1.00 0.00 H new ATOM 0 HB2 LEU B 295 21.238 -2.931 -7.589 1.00 0.00 H new ATOM 0 HB3 LEU B 295 22.109 -1.421 -7.772 1.00 0.00 H new ATOM 0 HG LEU B 295 21.479 -2.580 -5.057 1.00 0.00 H new ATOM 0 HD11 LEU B 295 23.797 -3.534 -5.078 1.00 0.00 H new ATOM 0 HD12 LEU B 295 22.780 -4.264 -6.342 1.00 0.00 H new ATOM 0 HD13 LEU B 295 23.978 -3.019 -6.772 1.00 0.00 H new ATOM 0 HD21 LEU B 295 23.462 -1.235 -4.370 1.00 0.00 H new ATOM 0 HD22 LEU B 295 23.649 -0.674 -6.049 1.00 0.00 H new ATOM 0 HD23 LEU B 295 22.205 -0.217 -5.114 1.00 0.00 H new ATOM 2075 N GLN B 296 18.943 -1.498 -9.072 1.00 0.00 N ATOM 2076 CA GLN B 296 18.274 -1.062 -10.301 1.00 0.00 C ATOM 2077 C GLN B 296 17.083 -0.127 -10.006 1.00 0.00 C ATOM 2078 O GLN B 296 16.819 0.788 -10.785 1.00 0.00 O ATOM 2079 CB GLN B 296 17.839 -2.300 -11.104 1.00 0.00 C ATOM 2080 CG GLN B 296 17.413 -1.962 -12.539 1.00 0.00 C ATOM 2081 CD GLN B 296 17.086 -3.226 -13.332 1.00 0.00 C ATOM 2082 OE1 GLN B 296 16.029 -3.829 -13.189 1.00 0.00 O ATOM 2083 NE2 GLN B 296 17.968 -3.684 -14.197 1.00 0.00 N ATOM 0 H GLN B 296 18.814 -2.488 -8.865 1.00 0.00 H new ATOM 0 HA GLN B 296 18.976 -0.480 -10.897 1.00 0.00 H new ATOM 0 HB2 GLN B 296 18.661 -3.015 -11.133 1.00 0.00 H new ATOM 0 HB3 GLN B 296 17.011 -2.788 -10.590 1.00 0.00 H new ATOM 0 HG2 GLN B 296 16.541 -1.308 -12.518 1.00 0.00 H new ATOM 0 HG3 GLN B 296 18.212 -1.413 -13.038 1.00 0.00 H new ATOM 0 HE21 GLN B 296 18.853 -3.195 -14.330 1.00 0.00 H new ATOM 0 HE22 GLN B 296 17.765 -4.527 -14.734 1.00 0.00 H new ATOM 2092 N GLY B 297 16.403 -0.290 -8.864 1.00 0.00 N ATOM 2093 CA GLY B 297 15.402 0.657 -8.347 1.00 0.00 C ATOM 2094 C GLY B 297 16.030 2.034 -8.082 1.00 0.00 C ATOM 2095 O GLY B 297 15.476 3.069 -8.454 1.00 0.00 O ATOM 0 H GLY B 297 16.535 -1.101 -8.259 1.00 0.00 H new ATOM 0 HA2 GLY B 297 14.587 0.757 -9.064 1.00 0.00 H new ATOM 0 HA3 GLY B 297 14.970 0.267 -7.425 1.00 0.00 H new ATOM 2099 N ALA B 298 17.243 2.037 -7.518 1.00 0.00 N ATOM 2100 CA ALA B 298 18.136 3.192 -7.371 1.00 0.00 C ATOM 2101 C ALA B 298 18.791 3.639 -8.711 1.00 0.00 C ATOM 2102 O ALA B 298 19.709 4.463 -8.720 1.00 0.00 O ATOM 2103 CB ALA B 298 19.189 2.834 -6.313 1.00 0.00 C ATOM 0 H ALA B 298 17.651 1.186 -7.130 1.00 0.00 H new ATOM 0 HA ALA B 298 17.550 4.054 -7.052 1.00 0.00 H new ATOM 0 HB1 ALA B 298 19.871 3.674 -6.179 1.00 0.00 H new ATOM 0 HB2 ALA B 298 18.694 2.614 -5.367 1.00 0.00 H new ATOM 0 HB3 ALA B 298 19.751 1.959 -6.640 1.00 0.00 H new ATOM 2109 N GLU B 299 18.334 3.095 -9.847 1.00 0.00 N ATOM 2110 CA GLU B 299 18.725 3.379 -11.238 1.00 0.00 C ATOM 2111 C GLU B 299 20.163 2.958 -11.602 1.00 0.00 C ATOM 2112 O GLU B 299 20.647 3.295 -12.686 1.00 0.00 O ATOM 2113 CB GLU B 299 18.416 4.844 -11.621 1.00 0.00 C ATOM 2114 CG GLU B 299 16.946 5.227 -11.391 1.00 0.00 C ATOM 2115 CD GLU B 299 16.654 6.642 -11.927 1.00 0.00 C ATOM 2116 OE1 GLU B 299 16.871 7.636 -11.191 1.00 0.00 O ATOM 2117 OE2 GLU B 299 16.197 6.774 -13.090 1.00 0.00 O ATOM 0 H GLU B 299 17.612 2.376 -9.814 1.00 0.00 H new ATOM 0 HA GLU B 299 18.100 2.734 -11.855 1.00 0.00 H new ATOM 0 HB2 GLU B 299 19.054 5.508 -11.039 1.00 0.00 H new ATOM 0 HB3 GLU B 299 18.667 5.000 -12.670 1.00 0.00 H new ATOM 0 HG2 GLU B 299 16.297 4.505 -11.886 1.00 0.00 H new ATOM 0 HG3 GLU B 299 16.717 5.183 -10.326 1.00 0.00 H new ATOM 2124 N PHE B 300 20.859 2.223 -10.720 1.00 0.00 N ATOM 2125 CA PHE B 300 22.289 1.890 -10.822 1.00 0.00 C ATOM 2126 C PHE B 300 23.226 3.108 -11.055 1.00 0.00 C ATOM 2127 O PHE B 300 24.374 2.958 -11.482 1.00 0.00 O ATOM 2128 CB PHE B 300 22.487 0.715 -11.810 1.00 0.00 C ATOM 2129 CG PHE B 300 22.507 -0.673 -11.192 1.00 0.00 C ATOM 2130 CD1 PHE B 300 23.584 -1.040 -10.361 1.00 0.00 C ATOM 2131 CD2 PHE B 300 21.530 -1.631 -11.522 1.00 0.00 C ATOM 2132 CE1 PHE B 300 23.677 -2.348 -9.852 1.00 0.00 C ATOM 2133 CE2 PHE B 300 21.618 -2.938 -11.003 1.00 0.00 C ATOM 2134 CZ PHE B 300 22.690 -3.296 -10.168 1.00 0.00 C ATOM 0 H PHE B 300 20.425 1.830 -9.885 1.00 0.00 H new ATOM 0 HA PHE B 300 22.618 1.548 -9.841 1.00 0.00 H new ATOM 0 HB2 PHE B 300 21.689 0.750 -12.552 1.00 0.00 H new ATOM 0 HB3 PHE B 300 23.425 0.868 -12.344 1.00 0.00 H new ATOM 0 HD1 PHE B 300 24.343 -0.313 -10.113 1.00 0.00 H new ATOM 0 HD2 PHE B 300 20.712 -1.364 -12.174 1.00 0.00 H new ATOM 0 HE1 PHE B 300 24.507 -2.623 -9.218 1.00 0.00 H new ATOM 0 HE2 PHE B 300 20.859 -3.667 -11.248 1.00 0.00 H new ATOM 0 HZ PHE B 300 22.755 -4.298 -9.770 1.00 0.00 H new ATOM 2144 N GLY B 301 22.759 4.326 -10.751 1.00 0.00 N ATOM 2145 CA GLY B 301 23.424 5.603 -11.043 1.00 0.00 C ATOM 2146 C GLY B 301 24.542 5.964 -10.060 1.00 0.00 C ATOM 2147 O GLY B 301 24.409 6.916 -9.289 1.00 0.00 O ATOM 0 H GLY B 301 21.867 4.454 -10.273 1.00 0.00 H new ATOM 0 HA2 GLY B 301 23.839 5.562 -12.050 1.00 0.00 H new ATOM 0 HA3 GLY B 301 22.679 6.398 -11.037 1.00 0.00 H new ATOM 2151 N GLN B 302 25.645 5.212 -10.088 1.00 0.00 N ATOM 2152 CA GLN B 302 26.876 5.438 -9.314 1.00 0.00 C ATOM 2153 C GLN B 302 28.132 5.292 -10.199 1.00 0.00 C ATOM 2154 O GLN B 302 28.080 4.731 -11.297 1.00 0.00 O ATOM 2155 CB GLN B 302 26.929 4.455 -8.125 1.00 0.00 C ATOM 2156 CG GLN B 302 25.852 4.681 -7.048 1.00 0.00 C ATOM 2157 CD GLN B 302 26.072 5.961 -6.240 1.00 0.00 C ATOM 2158 OE1 GLN B 302 26.746 5.976 -5.217 1.00 0.00 O ATOM 2159 NE2 GLN B 302 25.520 7.083 -6.652 1.00 0.00 N ATOM 0 H GLN B 302 25.711 4.385 -10.681 1.00 0.00 H new ATOM 0 HA GLN B 302 26.863 6.460 -8.934 1.00 0.00 H new ATOM 0 HB2 GLN B 302 26.832 3.439 -8.508 1.00 0.00 H new ATOM 0 HB3 GLN B 302 27.911 4.526 -7.657 1.00 0.00 H new ATOM 0 HG2 GLN B 302 24.873 4.723 -7.525 1.00 0.00 H new ATOM 0 HG3 GLN B 302 25.840 3.828 -6.370 1.00 0.00 H new ATOM 0 HE21 GLN B 302 24.955 7.092 -7.501 1.00 0.00 H new ATOM 0 HE22 GLN B 302 25.657 7.944 -6.122 1.00 0.00 H new ATOM 2168 N ALA B 303 29.275 5.788 -9.712 1.00 0.00 N ATOM 2169 CA ALA B 303 30.563 5.764 -10.418 1.00 0.00 C ATOM 2170 C ALA B 303 31.254 4.379 -10.453 1.00 0.00 C ATOM 2171 O ALA B 303 32.208 4.184 -11.210 1.00 0.00 O ATOM 2172 CB ALA B 303 31.474 6.806 -9.755 1.00 0.00 C ATOM 0 H ALA B 303 29.332 6.228 -8.794 1.00 0.00 H new ATOM 0 HA ALA B 303 30.371 5.998 -11.465 1.00 0.00 H new ATOM 0 HB1 ALA B 303 32.442 6.815 -10.256 1.00 0.00 H new ATOM 0 HB2 ALA B 303 31.016 7.792 -9.833 1.00 0.00 H new ATOM 0 HB3 ALA B 303 31.612 6.552 -8.704 1.00 0.00 H new ATOM 2178 N GLU B 304 30.805 3.418 -9.636 1.00 0.00 N ATOM 2179 CA GLU B 304 31.389 2.072 -9.528 1.00 0.00 C ATOM 2180 C GLU B 304 31.237 1.245 -10.826 1.00 0.00 C ATOM 2181 O GLU B 304 30.222 1.320 -11.525 1.00 0.00 O ATOM 2182 CB GLU B 304 30.750 1.358 -8.320 1.00 0.00 C ATOM 2183 CG GLU B 304 31.350 -0.014 -7.975 1.00 0.00 C ATOM 2184 CD GLU B 304 32.855 0.067 -7.651 1.00 0.00 C ATOM 2185 OE1 GLU B 304 33.675 0.002 -8.598 1.00 0.00 O ATOM 2186 OE2 GLU B 304 33.223 0.201 -6.458 1.00 0.00 O ATOM 0 H GLU B 304 30.007 3.556 -9.016 1.00 0.00 H new ATOM 0 HA GLU B 304 32.464 2.170 -9.375 1.00 0.00 H new ATOM 0 HB2 GLU B 304 30.840 2.005 -7.447 1.00 0.00 H new ATOM 0 HB3 GLU B 304 29.685 1.232 -8.515 1.00 0.00 H new ATOM 0 HG2 GLU B 304 30.819 -0.435 -7.121 1.00 0.00 H new ATOM 0 HG3 GLU B 304 31.198 -0.695 -8.812 1.00 0.00 H new ATOM 2193 N SER B 305 32.238 0.413 -11.128 1.00 0.00 N ATOM 2194 CA SER B 305 32.348 -0.410 -12.348 1.00 0.00 C ATOM 2195 C SER B 305 31.388 -1.616 -12.412 1.00 0.00 C ATOM 2196 O SER B 305 31.387 -2.351 -13.402 1.00 0.00 O ATOM 2197 CB SER B 305 33.791 -0.921 -12.487 1.00 0.00 C ATOM 2198 OG SER B 305 34.715 0.161 -12.508 1.00 0.00 O ATOM 0 H SER B 305 33.034 0.285 -10.503 1.00 0.00 H new ATOM 0 HA SER B 305 32.062 0.248 -13.169 1.00 0.00 H new ATOM 0 HB2 SER B 305 34.026 -1.588 -11.658 1.00 0.00 H new ATOM 0 HB3 SER B 305 33.887 -1.504 -13.403 1.00 0.00 H new ATOM 0 HG SER B 305 35.626 -0.189 -12.595 1.00 0.00 H new ATOM 2204 N ALA B 306 30.585 -1.850 -11.367 1.00 0.00 N ATOM 2205 CA ALA B 306 29.677 -2.994 -11.237 1.00 0.00 C ATOM 2206 C ALA B 306 28.481 -2.993 -12.223 1.00 0.00 C ATOM 2207 O ALA B 306 27.913 -4.055 -12.492 1.00 0.00 O ATOM 2208 CB ALA B 306 29.184 -3.035 -9.785 1.00 0.00 C ATOM 0 H ALA B 306 30.549 -1.226 -10.561 1.00 0.00 H new ATOM 0 HA ALA B 306 30.240 -3.890 -11.500 1.00 0.00 H new ATOM 0 HB1 ALA B 306 28.505 -3.877 -9.655 1.00 0.00 H new ATOM 0 HB2 ALA B 306 30.036 -3.149 -9.115 1.00 0.00 H new ATOM 0 HB3 ALA B 306 28.661 -2.108 -9.552 1.00 0.00 H new ATOM 2214 N ASP B 307 28.095 -1.828 -12.764 1.00 0.00 N ATOM 2215 CA ASP B 307 27.047 -1.665 -13.794 1.00 0.00 C ATOM 2216 C ASP B 307 27.456 -2.222 -15.179 1.00 0.00 C ATOM 2217 O ASP B 307 26.777 -3.150 -15.677 1.00 0.00 O ATOM 2218 CB ASP B 307 26.645 -0.178 -13.887 1.00 0.00 C ATOM 2219 CG ASP B 307 25.607 0.108 -14.997 1.00 0.00 C ATOM 2220 OD1 ASP B 307 24.497 -0.481 -14.969 1.00 0.00 O ATOM 2221 OD2 ASP B 307 25.883 0.947 -15.891 1.00 0.00 O ATOM 2222 OXT ASP B 307 28.447 -1.732 -15.768 1.00 0.00 O ATOM 0 H ASP B 307 28.516 -0.940 -12.490 1.00 0.00 H new ATOM 0 HA ASP B 307 26.188 -2.260 -13.483 1.00 0.00 H new ATOM 0 HB2 ASP B 307 26.238 0.142 -12.928 1.00 0.00 H new ATOM 0 HB3 ASP B 307 27.537 0.421 -14.070 1.00 0.00 H new TER 2227 ASP B 307