USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 950 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 100 LYS NZ :NH3+ 150:sc= 0.878 (180deg=0) USER MOD Set 1.2: A 101 ASN : amide:sc= -2.1 K(o=-1.2,f=-11!) USER MOD Set 2.1: A 85 ASN : amide:sc= -6.97! C(o=-12!,f=-16!) USER MOD Set 2.2: A 97 MET CE :methyl 153:sc= -5.04! (180deg=-5.03!) USER MOD Set 3.1: A 38 THR OG1 : rot -62:sc= -0.865 USER MOD Set 3.2: A 42 ASN : amide:sc= -3.69! C(o=-4.6!,f=-3.7!) USER MOD Set 4.1: A 30 HIS : no HE2:sc= -1.09 K(o=-0.67,f=-6.6!) USER MOD Set 4.2: A 124 SER OG : rot -170:sc= 0.422 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -0.333 X(o=-0.33,f=-0.11) USER MOD Single : A 11 ASN : amide:sc= -2.25 K(o=-2.3,f=-1.1) USER MOD Single : A 12 GLN : amide:sc= -0.836 X(o=-0.84,f=-0.47) USER MOD Single : A 14 LYS NZ :NH3+ 160:sc= -2.01! (180deg=-3.91!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 101:sc= -6.64! USER MOD Single : A 25 ASN : amide:sc= -1.48 K(o=-1.5,f=-5.3!) USER MOD Single : A 29 TYR OH : rot 121:sc= -5! USER MOD Single : A 31 LYS NZ :NH3+ 163:sc= -0.0323 (180deg=-0.254) USER MOD Single : A 34 LYS NZ :NH3+ -116:sc= 2.2 (180deg=-1.37) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= 0.843 K(o=0.84,f=-0.45) USER MOD Single : A 50 LYS NZ :NH3+ 135:sc= 0.397 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.25! USER MOD Single : A 59 ASN : amide:sc= -0.761 K(o=-0.76,f=-8.4!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot -97:sc= 0.927 USER MOD Single : A 73 ASN : amide:sc= -6.59! C(o=-6.6!,f=-6.2!) USER MOD Single : A 74 SER OG : rot -78:sc= -3.34 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 80:sc= -3.5! USER MOD Single : A 87 ASN : amide:sc= -7.79! C(o=-7.8!,f=-7.5!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot -100:sc= 0.919 USER MOD Single : A 105 THR OG1 : rot 180:sc= -0.877 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= -0.693 K(o=-0.69,f=-0.042) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.0439 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -12.3! C(o=-12!,f=-11!) USER MOD Single : A 114 LYS NZ :NH3+ -179:sc= 0.682 (180deg=0.681) USER MOD Single : A 117 SER OG : rot 36:sc= 1.24 USER MOD Single : A 121 TYR OH : rot 74:sc= 0.0152 USER MOD Single : A 127 ASN : amide:sc= -2.75! K(o=-2.8!,f=-1.2) USER MOD Single : A 128 HIS : no HD1:sc= -0.207 X(o=-0.21,f=-0.12) USER MOD ----------------------------------------------------------------- ATOM 32 N LYS A 3 -13.291 21.063 -0.679 1.00 0.00 N ATOM 33 CA LYS A 3 -14.385 20.356 -0.013 1.00 0.00 C ATOM 34 C LYS A 3 -14.753 19.088 -0.774 1.00 0.00 C ATOM 35 O LYS A 3 -14.653 17.982 -0.243 1.00 0.00 O ATOM 36 CB LYS A 3 -15.613 21.261 0.120 1.00 0.00 C ATOM 37 CG LYS A 3 -16.559 20.844 1.234 1.00 0.00 C ATOM 38 CD LYS A 3 -17.542 21.952 1.574 1.00 0.00 C ATOM 39 CE LYS A 3 -16.839 23.148 2.197 1.00 0.00 C ATOM 40 NZ LYS A 3 -17.807 24.134 2.752 1.00 0.00 N ATOM 0 HA LYS A 3 -14.045 20.078 0.985 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -15.282 22.284 0.300 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -16.156 21.263 -0.825 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -17.106 19.951 0.933 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -15.984 20.581 2.122 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -18.065 22.266 0.671 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -18.296 21.572 2.263 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -16.174 22.806 2.990 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -16.216 23.634 1.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -17.288 24.934 3.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -18.425 24.480 1.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -18.385 23.678 3.486 1.00 0.00 H new ATOM 54 N THR A 4 -15.175 19.255 -2.025 1.00 0.00 N ATOM 55 CA THR A 4 -15.552 18.124 -2.864 1.00 0.00 C ATOM 56 C THR A 4 -14.457 17.061 -2.864 1.00 0.00 C ATOM 57 O THR A 4 -14.734 15.868 -2.985 1.00 0.00 O ATOM 58 CB THR A 4 -15.825 18.596 -4.295 1.00 0.00 C ATOM 59 OG1 THR A 4 -16.949 19.457 -4.332 1.00 0.00 O ATOM 60 CG2 THR A 4 -16.086 17.462 -5.265 1.00 0.00 C ATOM 0 H THR A 4 -15.264 20.164 -2.479 1.00 0.00 H new ATOM 0 HA THR A 4 -16.461 17.683 -2.455 1.00 0.00 H new ATOM 0 HB THR A 4 -14.917 19.114 -4.604 1.00 0.00 H new ATOM 0 HG1 THR A 4 -17.107 19.750 -5.254 1.00 0.00 H new ATOM 0 HG21 THR A 4 -16.272 17.869 -6.259 1.00 0.00 H new ATOM 0 HG22 THR A 4 -15.217 16.805 -5.298 1.00 0.00 H new ATOM 0 HG23 THR A 4 -16.957 16.895 -4.936 1.00 0.00 H new ATOM 68 N ASN A 5 -13.212 17.506 -2.723 1.00 0.00 N ATOM 69 CA ASN A 5 -12.072 16.598 -2.704 1.00 0.00 C ATOM 70 C ASN A 5 -12.237 15.543 -1.613 1.00 0.00 C ATOM 71 O ASN A 5 -11.715 14.434 -1.727 1.00 0.00 O ATOM 72 CB ASN A 5 -10.776 17.381 -2.489 1.00 0.00 C ATOM 73 CG ASN A 5 -9.728 17.062 -3.536 1.00 0.00 C ATOM 74 OD1 ASN A 5 -8.565 16.814 -3.214 1.00 0.00 O ATOM 75 ND2 ASN A 5 -10.134 17.068 -4.800 1.00 0.00 N ATOM 0 H ASN A 5 -12.968 18.491 -2.620 1.00 0.00 H new ATOM 0 HA ASN A 5 -12.023 16.090 -3.667 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -10.992 18.449 -2.509 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -10.378 17.155 -1.500 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -9.473 16.862 -5.549 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -11.107 17.279 -5.022 1.00 0.00 H new ATOM 82 N LEU A 6 -12.970 15.892 -0.562 1.00 0.00 N ATOM 83 CA LEU A 6 -13.207 14.974 0.539 1.00 0.00 C ATOM 84 C LEU A 6 -14.367 14.048 0.215 1.00 0.00 C ATOM 85 O LEU A 6 -14.204 12.835 0.170 1.00 0.00 O ATOM 86 CB LEU A 6 -13.500 15.748 1.818 1.00 0.00 C ATOM 87 CG LEU A 6 -12.280 16.039 2.683 1.00 0.00 C ATOM 88 CD1 LEU A 6 -11.659 17.372 2.293 1.00 0.00 C ATOM 89 CD2 LEU A 6 -12.666 16.023 4.151 1.00 0.00 C ATOM 0 H LEU A 6 -13.410 16.806 -0.452 1.00 0.00 H new ATOM 0 HA LEU A 6 -12.310 14.374 0.688 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -13.974 16.693 1.553 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -14.221 15.184 2.410 1.00 0.00 H new ATOM 0 HG LEU A 6 -11.534 15.261 2.518 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -10.789 17.565 2.920 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -11.353 17.339 1.247 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -12.390 18.168 2.432 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -11.787 16.232 4.761 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -13.425 16.783 4.336 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -13.064 15.042 4.412 1.00 0.00 H new ATOM 101 N GLY A 7 -15.540 14.629 -0.025 1.00 0.00 N ATOM 102 CA GLY A 7 -16.705 13.829 -0.356 1.00 0.00 C ATOM 103 C GLY A 7 -16.421 12.826 -1.457 1.00 0.00 C ATOM 104 O GLY A 7 -17.092 11.801 -1.561 1.00 0.00 O ATOM 0 H GLY A 7 -15.703 15.635 0.004 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -17.045 13.301 0.535 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -17.518 14.486 -0.667 1.00 0.00 H new ATOM 108 N GLU A 8 -15.421 13.123 -2.278 1.00 0.00 N ATOM 109 CA GLU A 8 -15.043 12.240 -3.374 1.00 0.00 C ATOM 110 C GLU A 8 -13.906 11.309 -2.963 1.00 0.00 C ATOM 111 O GLU A 8 -13.670 10.286 -3.606 1.00 0.00 O ATOM 112 CB GLU A 8 -14.632 13.056 -4.602 1.00 0.00 C ATOM 113 CG GLU A 8 -13.365 13.870 -4.398 1.00 0.00 C ATOM 114 CD GLU A 8 -12.221 13.402 -5.277 1.00 0.00 C ATOM 115 OE1 GLU A 8 -12.495 12.845 -6.362 1.00 0.00 O ATOM 116 OE2 GLU A 8 -11.051 13.592 -4.882 1.00 0.00 O ATOM 0 H GLU A 8 -14.857 13.970 -2.205 1.00 0.00 H new ATOM 0 HA GLU A 8 -15.911 11.631 -3.626 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -14.487 12.380 -5.445 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -15.447 13.729 -4.869 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -13.574 14.919 -4.609 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -13.063 13.809 -3.352 1.00 0.00 H new ATOM 123 N LEU A 9 -13.205 11.660 -1.885 1.00 0.00 N ATOM 124 CA LEU A 9 -12.105 10.842 -1.398 1.00 0.00 C ATOM 125 C LEU A 9 -12.565 9.985 -0.226 1.00 0.00 C ATOM 126 O LEU A 9 -12.008 8.919 0.037 1.00 0.00 O ATOM 127 CB LEU A 9 -10.928 11.721 -0.972 1.00 0.00 C ATOM 128 CG LEU A 9 -10.070 12.269 -2.114 1.00 0.00 C ATOM 129 CD1 LEU A 9 -9.060 13.276 -1.584 1.00 0.00 C ATOM 130 CD2 LEU A 9 -9.361 11.136 -2.842 1.00 0.00 C ATOM 0 H LEU A 9 -13.382 12.502 -1.337 1.00 0.00 H new ATOM 0 HA LEU A 9 -11.777 10.190 -2.208 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -11.314 12.561 -0.395 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -10.288 11.144 -0.305 1.00 0.00 H new ATOM 0 HG LEU A 9 -10.724 12.776 -2.823 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -8.458 13.656 -2.409 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -9.586 14.103 -1.108 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -8.411 12.791 -0.855 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -8.756 11.546 -3.651 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -8.718 10.600 -2.143 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.100 10.449 -3.254 1.00 0.00 H new ATOM 142 N ILE A 10 -13.590 10.462 0.474 1.00 0.00 N ATOM 143 CA ILE A 10 -14.132 9.749 1.614 1.00 0.00 C ATOM 144 C ILE A 10 -15.193 8.750 1.174 1.00 0.00 C ATOM 145 O ILE A 10 -15.360 7.697 1.790 1.00 0.00 O ATOM 146 CB ILE A 10 -14.725 10.708 2.662 1.00 0.00 C ATOM 147 CG1 ILE A 10 -15.984 11.432 2.144 1.00 0.00 C ATOM 148 CG2 ILE A 10 -13.693 11.718 3.090 1.00 0.00 C ATOM 149 CD1 ILE A 10 -16.422 12.614 3.009 1.00 0.00 C ATOM 0 H ILE A 10 -14.060 11.343 0.266 1.00 0.00 H new ATOM 0 HA ILE A 10 -13.303 9.212 2.076 1.00 0.00 H new ATOM 0 HB ILE A 10 -15.022 10.103 3.519 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -15.795 11.787 1.131 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -16.803 10.716 2.084 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -14.127 12.389 3.831 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -12.837 11.202 3.525 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.368 12.295 2.224 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -17.314 13.070 2.578 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -16.644 12.264 4.017 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -15.621 13.352 3.049 1.00 0.00 H new ATOM 161 N ASN A 11 -15.899 9.072 0.092 1.00 0.00 N ATOM 162 CA ASN A 11 -16.929 8.183 -0.435 1.00 0.00 C ATOM 163 C ASN A 11 -16.368 6.777 -0.592 1.00 0.00 C ATOM 164 O ASN A 11 -17.060 5.784 -0.370 1.00 0.00 O ATOM 165 CB ASN A 11 -17.442 8.697 -1.782 1.00 0.00 C ATOM 166 CG ASN A 11 -18.738 9.470 -1.647 1.00 0.00 C ATOM 167 OD1 ASN A 11 -19.624 9.372 -2.496 1.00 0.00 O ATOM 168 ND2 ASN A 11 -18.856 10.245 -0.575 1.00 0.00 N ATOM 0 H ASN A 11 -15.777 9.938 -0.434 1.00 0.00 H new ATOM 0 HA ASN A 11 -17.763 8.159 0.267 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -16.685 9.337 -2.236 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -17.593 7.854 -2.456 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -19.706 10.789 -0.430 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -18.096 10.296 0.104 1.00 0.00 H new ATOM 175 N GLN A 12 -15.094 6.714 -0.956 1.00 0.00 N ATOM 176 CA GLN A 12 -14.404 5.443 -1.126 1.00 0.00 C ATOM 177 C GLN A 12 -13.766 5.020 0.191 1.00 0.00 C ATOM 178 O GLN A 12 -13.685 3.831 0.502 1.00 0.00 O ATOM 179 CB GLN A 12 -13.338 5.553 -2.217 1.00 0.00 C ATOM 180 CG GLN A 12 -12.212 6.512 -1.870 1.00 0.00 C ATOM 181 CD GLN A 12 -11.360 6.871 -3.069 1.00 0.00 C ATOM 182 OE1 GLN A 12 -11.336 6.152 -4.068 1.00 0.00 O ATOM 183 NE2 GLN A 12 -10.653 7.992 -2.976 1.00 0.00 N ATOM 0 H GLN A 12 -14.515 7.533 -1.140 1.00 0.00 H new ATOM 0 HA GLN A 12 -15.130 4.689 -1.429 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -12.918 4.565 -2.404 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -13.810 5.880 -3.144 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -12.634 7.422 -1.444 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -11.581 6.063 -1.103 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -10.703 8.558 -2.129 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -10.060 8.287 -3.752 1.00 0.00 H new ATOM 192 N GLY A 13 -13.328 6.007 0.972 1.00 0.00 N ATOM 193 CA GLY A 13 -12.720 5.721 2.256 1.00 0.00 C ATOM 194 C GLY A 13 -13.704 5.068 3.201 1.00 0.00 C ATOM 195 O GLY A 13 -13.415 4.028 3.795 1.00 0.00 O ATOM 0 H GLY A 13 -13.385 6.998 0.736 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.860 5.066 2.115 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -12.348 6.645 2.698 1.00 0.00 H new ATOM 199 N LYS A 14 -14.885 5.668 3.318 1.00 0.00 N ATOM 200 CA LYS A 14 -15.938 5.133 4.170 1.00 0.00 C ATOM 201 C LYS A 14 -16.208 3.679 3.802 1.00 0.00 C ATOM 202 O LYS A 14 -16.635 2.879 4.635 1.00 0.00 O ATOM 203 CB LYS A 14 -17.218 5.962 4.009 1.00 0.00 C ATOM 204 CG LYS A 14 -17.405 7.017 5.088 1.00 0.00 C ATOM 205 CD LYS A 14 -16.406 8.158 4.940 1.00 0.00 C ATOM 206 CE LYS A 14 -16.938 9.284 4.062 1.00 0.00 C ATOM 207 NZ LYS A 14 -18.392 9.533 4.278 1.00 0.00 N ATOM 0 H LYS A 14 -15.136 6.528 2.831 1.00 0.00 H new ATOM 0 HA LYS A 14 -15.616 5.185 5.210 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -17.203 6.451 3.035 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -18.077 5.292 4.016 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -18.419 7.413 5.038 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -17.290 6.558 6.070 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -16.162 8.554 5.926 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -15.480 7.774 4.512 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -16.381 10.197 4.270 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -16.766 9.037 3.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -18.635 10.486 3.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -18.947 8.827 3.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -18.610 9.460 5.292 1.00 0.00 H new ATOM 221 N SER A 15 -15.940 3.349 2.541 1.00 0.00 N ATOM 222 CA SER A 15 -16.134 1.993 2.041 1.00 0.00 C ATOM 223 C SER A 15 -14.924 1.126 2.376 1.00 0.00 C ATOM 224 O SER A 15 -15.063 -0.051 2.704 1.00 0.00 O ATOM 225 CB SER A 15 -16.362 2.010 0.528 1.00 0.00 C ATOM 226 OG SER A 15 -17.291 1.011 0.142 1.00 0.00 O ATOM 0 H SER A 15 -15.587 4.006 1.845 1.00 0.00 H new ATOM 0 HA SER A 15 -17.015 1.570 2.524 1.00 0.00 H new ATOM 0 HB2 SER A 15 -16.729 2.990 0.223 1.00 0.00 H new ATOM 0 HB3 SER A 15 -15.415 1.850 0.012 1.00 0.00 H new ATOM 0 HG SER A 15 -17.421 1.043 -0.829 1.00 0.00 H new ATOM 232 N LEU A 16 -13.738 1.724 2.304 1.00 0.00 N ATOM 233 CA LEU A 16 -12.501 1.020 2.614 1.00 0.00 C ATOM 234 C LEU A 16 -12.485 0.629 4.086 1.00 0.00 C ATOM 235 O LEU A 16 -12.574 -0.547 4.435 1.00 0.00 O ATOM 236 CB LEU A 16 -11.298 1.913 2.297 1.00 0.00 C ATOM 237 CG LEU A 16 -10.094 1.207 1.668 1.00 0.00 C ATOM 238 CD1 LEU A 16 -9.184 2.219 0.985 1.00 0.00 C ATOM 239 CD2 LEU A 16 -9.323 0.420 2.720 1.00 0.00 C ATOM 0 H LEU A 16 -13.609 2.699 2.032 1.00 0.00 H new ATOM 0 HA LEU A 16 -12.442 0.118 2.005 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -11.624 2.705 1.623 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.973 2.394 3.220 1.00 0.00 H new ATOM 0 HG LEU A 16 -10.459 0.506 0.917 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.332 1.702 0.543 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -9.739 2.738 0.204 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.828 2.942 1.719 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -8.471 -0.074 2.253 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -8.968 1.099 3.495 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -9.977 -0.329 3.166 1.00 0.00 H new ATOM 251 N LEU A 17 -12.385 1.640 4.943 1.00 0.00 N ATOM 252 CA LEU A 17 -12.370 1.448 6.386 1.00 0.00 C ATOM 253 C LEU A 17 -13.455 0.465 6.828 1.00 0.00 C ATOM 254 O LEU A 17 -13.307 -0.225 7.836 1.00 0.00 O ATOM 255 CB LEU A 17 -12.577 2.801 7.072 1.00 0.00 C ATOM 256 CG LEU A 17 -11.500 3.203 8.079 1.00 0.00 C ATOM 257 CD1 LEU A 17 -11.604 2.353 9.335 1.00 0.00 C ATOM 258 CD2 LEU A 17 -10.110 3.093 7.460 1.00 0.00 C ATOM 0 H LEU A 17 -12.312 2.616 4.655 1.00 0.00 H new ATOM 0 HA LEU A 17 -11.406 1.028 6.673 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -12.637 3.572 6.304 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -13.539 2.785 7.583 1.00 0.00 H new ATOM 0 HG LEU A 17 -11.661 4.245 8.357 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -10.830 2.652 10.042 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -12.585 2.494 9.790 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -11.472 1.303 9.075 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -9.360 3.384 8.195 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -9.931 2.064 7.147 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -10.044 3.752 6.594 1.00 0.00 H new ATOM 270 N ASP A 18 -14.551 0.416 6.072 1.00 0.00 N ATOM 271 CA ASP A 18 -15.663 -0.474 6.397 1.00 0.00 C ATOM 272 C ASP A 18 -15.539 -1.823 5.691 1.00 0.00 C ATOM 273 O ASP A 18 -15.990 -2.845 6.210 1.00 0.00 O ATOM 274 CB ASP A 18 -16.991 0.186 6.021 1.00 0.00 C ATOM 275 CG ASP A 18 -18.189 -0.634 6.456 1.00 0.00 C ATOM 276 OD1 ASP A 18 -18.421 -0.743 7.679 1.00 0.00 O ATOM 277 OD2 ASP A 18 -18.895 -1.169 5.575 1.00 0.00 O ATOM 0 H ASP A 18 -14.692 0.980 5.234 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.633 -0.656 7.471 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -17.045 1.174 6.479 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -17.028 0.333 4.942 1.00 0.00 H new ATOM 282 N GLU A 19 -14.936 -1.826 4.506 1.00 0.00 N ATOM 283 CA GLU A 19 -14.769 -3.057 3.737 1.00 0.00 C ATOM 284 C GLU A 19 -13.474 -3.768 4.112 1.00 0.00 C ATOM 285 O GLU A 19 -13.495 -4.867 4.664 1.00 0.00 O ATOM 286 CB GLU A 19 -14.781 -2.754 2.237 1.00 0.00 C ATOM 287 CG GLU A 19 -16.150 -2.357 1.708 1.00 0.00 C ATOM 288 CD GLU A 19 -16.937 -3.543 1.184 1.00 0.00 C ATOM 289 OE1 GLU A 19 -16.528 -4.118 0.153 1.00 0.00 O ATOM 290 OE2 GLU A 19 -17.961 -3.897 1.806 1.00 0.00 O ATOM 0 H GLU A 19 -14.555 -0.993 4.057 1.00 0.00 H new ATOM 0 HA GLU A 19 -15.604 -3.716 3.975 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -14.074 -1.950 2.031 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -14.432 -3.632 1.694 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -16.716 -1.872 2.503 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -16.029 -1.624 0.910 1.00 0.00 H new ATOM 297 N SER A 20 -12.346 -3.130 3.812 1.00 0.00 N ATOM 298 CA SER A 20 -11.042 -3.689 4.118 1.00 0.00 C ATOM 299 C SER A 20 -10.978 -4.121 5.569 1.00 0.00 C ATOM 300 O SER A 20 -10.736 -3.310 6.461 1.00 0.00 O ATOM 301 CB SER A 20 -9.951 -2.663 3.845 1.00 0.00 C ATOM 302 OG SER A 20 -10.289 -1.410 4.414 1.00 0.00 O ATOM 0 H SER A 20 -12.314 -2.219 3.354 1.00 0.00 H new ATOM 0 HA SER A 20 -10.885 -4.559 3.480 1.00 0.00 H new ATOM 0 HB2 SER A 20 -9.005 -3.012 4.258 1.00 0.00 H new ATOM 0 HB3 SER A 20 -9.809 -2.553 2.770 1.00 0.00 H new ATOM 0 HG SER A 20 -9.800 -1.290 5.255 1.00 0.00 H new ATOM 308 N VAL A 21 -11.206 -5.398 5.797 1.00 0.00 N ATOM 309 CA VAL A 21 -11.185 -5.945 7.138 1.00 0.00 C ATOM 310 C VAL A 21 -9.811 -6.490 7.482 1.00 0.00 C ATOM 311 O VAL A 21 -9.122 -7.039 6.631 1.00 0.00 O ATOM 312 CB VAL A 21 -12.226 -7.065 7.283 1.00 0.00 C ATOM 313 CG1 VAL A 21 -12.084 -8.071 6.152 1.00 0.00 C ATOM 314 CG2 VAL A 21 -12.118 -7.746 8.640 1.00 0.00 C ATOM 0 H VAL A 21 -11.409 -6.080 5.066 1.00 0.00 H new ATOM 0 HA VAL A 21 -11.428 -5.136 7.827 1.00 0.00 H new ATOM 0 HB VAL A 21 -13.218 -6.618 7.220 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -12.829 -8.858 6.269 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -12.235 -7.568 5.197 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -11.086 -8.509 6.178 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -12.868 -8.534 8.712 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -11.124 -8.179 8.752 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -12.285 -7.013 9.429 1.00 0.00 H new ATOM 324 N GLU A 22 -9.424 -6.344 8.736 1.00 0.00 N ATOM 325 CA GLU A 22 -8.133 -6.838 9.182 1.00 0.00 C ATOM 326 C GLU A 22 -8.200 -8.349 9.408 1.00 0.00 C ATOM 327 O GLU A 22 -8.835 -8.815 10.353 1.00 0.00 O ATOM 328 CB GLU A 22 -7.714 -6.146 10.481 1.00 0.00 C ATOM 329 CG GLU A 22 -8.820 -6.084 11.523 1.00 0.00 C ATOM 330 CD GLU A 22 -8.336 -6.458 12.911 1.00 0.00 C ATOM 331 OE1 GLU A 22 -7.394 -7.272 13.012 1.00 0.00 O ATOM 332 OE2 GLU A 22 -8.899 -5.936 13.896 1.00 0.00 O ATOM 0 H GLU A 22 -9.981 -5.890 9.460 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.395 -6.619 8.410 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.858 -6.672 10.903 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -7.384 -5.132 10.253 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -9.236 -5.077 11.547 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -9.627 -6.755 11.231 1.00 0.00 H new ATOM 339 N GLY A 23 -7.540 -9.108 8.539 1.00 0.00 N ATOM 340 CA GLY A 23 -7.538 -10.553 8.667 1.00 0.00 C ATOM 341 C GLY A 23 -6.137 -11.125 8.683 1.00 0.00 C ATOM 342 O GLY A 23 -5.482 -11.152 9.726 1.00 0.00 O ATOM 0 H GLY A 23 -7.006 -8.747 7.748 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.054 -10.835 9.585 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -8.097 -10.990 7.840 1.00 0.00 H new ATOM 346 N PHE A 24 -5.671 -11.582 7.524 1.00 0.00 N ATOM 347 CA PHE A 24 -4.334 -12.155 7.408 1.00 0.00 C ATOM 348 C PHE A 24 -4.103 -12.723 6.011 1.00 0.00 C ATOM 349 O PHE A 24 -3.504 -13.788 5.855 1.00 0.00 O ATOM 350 CB PHE A 24 -4.125 -13.252 8.456 1.00 0.00 C ATOM 351 CG PHE A 24 -5.319 -14.147 8.639 1.00 0.00 C ATOM 352 CD1 PHE A 24 -5.818 -14.883 7.577 1.00 0.00 C ATOM 353 CD2 PHE A 24 -5.938 -14.253 9.874 1.00 0.00 C ATOM 354 CE1 PHE A 24 -6.916 -15.707 7.743 1.00 0.00 C ATOM 355 CE2 PHE A 24 -7.035 -15.075 10.046 1.00 0.00 C ATOM 356 CZ PHE A 24 -7.525 -15.803 8.979 1.00 0.00 C ATOM 0 H PHE A 24 -6.200 -11.567 6.652 1.00 0.00 H new ATOM 0 HA PHE A 24 -3.613 -11.356 7.582 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.267 -13.860 8.167 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.880 -12.788 9.411 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -5.344 -14.813 6.609 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -5.559 -13.687 10.712 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -7.297 -16.275 6.907 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -7.509 -15.148 11.014 1.00 0.00 H new ATOM 0 HZ PHE A 24 -8.383 -16.446 9.111 1.00 0.00 H new ATOM 366 N ASN A 25 -4.580 -12.009 4.994 1.00 0.00 N ATOM 367 CA ASN A 25 -4.417 -12.455 3.613 1.00 0.00 C ATOM 368 C ASN A 25 -4.962 -11.423 2.632 1.00 0.00 C ATOM 369 O ASN A 25 -5.538 -10.414 3.035 1.00 0.00 O ATOM 370 CB ASN A 25 -5.124 -13.796 3.403 1.00 0.00 C ATOM 371 CG ASN A 25 -6.572 -13.761 3.849 1.00 0.00 C ATOM 372 OD1 ASN A 25 -6.882 -13.334 4.961 1.00 0.00 O ATOM 373 ND2 ASN A 25 -7.469 -14.213 2.980 1.00 0.00 N ATOM 0 H ASN A 25 -5.079 -11.126 5.099 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.350 -12.577 3.424 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -5.078 -14.067 2.348 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -4.595 -14.573 3.955 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -8.459 -14.215 3.224 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -7.167 -14.558 2.069 1.00 0.00 H new ATOM 380 N VAL A 26 -4.776 -11.684 1.338 1.00 0.00 N ATOM 381 CA VAL A 26 -5.254 -10.776 0.299 1.00 0.00 C ATOM 382 C VAL A 26 -6.727 -10.440 0.511 1.00 0.00 C ATOM 383 O VAL A 26 -7.584 -11.323 0.506 1.00 0.00 O ATOM 384 CB VAL A 26 -5.060 -11.372 -1.109 1.00 0.00 C ATOM 385 CG1 VAL A 26 -5.924 -12.611 -1.298 1.00 0.00 C ATOM 386 CG2 VAL A 26 -5.367 -10.330 -2.177 1.00 0.00 C ATOM 0 H VAL A 26 -4.299 -12.514 0.986 1.00 0.00 H new ATOM 0 HA VAL A 26 -4.661 -9.864 0.372 1.00 0.00 H new ATOM 0 HB VAL A 26 -4.017 -11.671 -1.212 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.769 -13.013 -2.299 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.649 -13.363 -0.558 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.974 -12.345 -1.172 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.225 -10.768 -3.165 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -6.399 -9.996 -2.074 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -4.697 -9.479 -2.058 1.00 0.00 H new ATOM 396 N GLY A 27 -7.009 -9.160 0.718 1.00 0.00 N ATOM 397 CA GLY A 27 -8.374 -8.729 0.953 1.00 0.00 C ATOM 398 C GLY A 27 -8.572 -8.252 2.378 1.00 0.00 C ATOM 399 O GLY A 27 -9.462 -7.449 2.657 1.00 0.00 O ATOM 0 H GLY A 27 -6.316 -8.412 0.727 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -8.626 -7.925 0.261 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -9.057 -9.553 0.747 1.00 0.00 H new ATOM 403 N GLU A 28 -7.725 -8.744 3.279 1.00 0.00 N ATOM 404 CA GLU A 28 -7.783 -8.368 4.679 1.00 0.00 C ATOM 405 C GLU A 28 -6.390 -8.021 5.174 1.00 0.00 C ATOM 406 O GLU A 28 -5.409 -8.616 4.740 1.00 0.00 O ATOM 407 CB GLU A 28 -8.383 -9.501 5.513 1.00 0.00 C ATOM 408 CG GLU A 28 -9.654 -10.086 4.919 1.00 0.00 C ATOM 409 CD GLU A 28 -9.373 -11.168 3.893 1.00 0.00 C ATOM 410 OE1 GLU A 28 -9.125 -12.322 4.301 1.00 0.00 O ATOM 411 OE2 GLU A 28 -9.400 -10.860 2.684 1.00 0.00 O ATOM 0 H GLU A 28 -6.985 -9.410 3.056 1.00 0.00 H new ATOM 0 HA GLU A 28 -8.424 -7.493 4.785 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -7.643 -10.294 5.619 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -8.598 -9.129 6.515 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -10.268 -10.500 5.719 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -10.233 -9.289 4.452 1.00 0.00 H new ATOM 418 N TYR A 29 -6.302 -7.044 6.064 1.00 0.00 N ATOM 419 CA TYR A 29 -5.002 -6.615 6.584 1.00 0.00 C ATOM 420 C TYR A 29 -4.788 -7.077 8.020 1.00 0.00 C ATOM 421 O TYR A 29 -5.654 -7.705 8.616 1.00 0.00 O ATOM 422 CB TYR A 29 -4.875 -5.096 6.496 1.00 0.00 C ATOM 423 CG TYR A 29 -5.792 -4.368 7.438 1.00 0.00 C ATOM 424 CD1 TYR A 29 -7.144 -4.237 7.149 1.00 0.00 C ATOM 425 CD2 TYR A 29 -5.309 -3.823 8.619 1.00 0.00 C ATOM 426 CE1 TYR A 29 -7.991 -3.582 8.010 1.00 0.00 C ATOM 427 CE2 TYR A 29 -6.158 -3.161 9.486 1.00 0.00 C ATOM 428 CZ TYR A 29 -7.496 -3.045 9.175 1.00 0.00 C ATOM 429 OH TYR A 29 -8.345 -2.395 10.035 1.00 0.00 O ATOM 0 H TYR A 29 -7.102 -6.535 6.441 1.00 0.00 H new ATOM 0 HA TYR A 29 -4.231 -7.078 5.969 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -3.845 -4.811 6.710 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -5.088 -4.779 5.475 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -7.535 -4.656 6.234 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -4.261 -3.917 8.863 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -9.041 -3.489 7.773 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -5.775 -2.737 10.402 1.00 0.00 H new ATOM 0 HH TYR A 29 -8.327 -2.837 10.909 1.00 0.00 H new ATOM 439 N HIS A 30 -3.622 -6.773 8.572 1.00 0.00 N ATOM 440 CA HIS A 30 -3.316 -7.177 9.942 1.00 0.00 C ATOM 441 C HIS A 30 -3.274 -5.976 10.885 1.00 0.00 C ATOM 442 O HIS A 30 -2.222 -5.626 11.418 1.00 0.00 O ATOM 443 CB HIS A 30 -1.992 -7.931 9.993 1.00 0.00 C ATOM 444 CG HIS A 30 -1.983 -9.056 10.981 1.00 0.00 C ATOM 445 ND1 HIS A 30 -2.849 -10.127 10.911 1.00 0.00 N ATOM 446 CD2 HIS A 30 -1.204 -9.276 12.068 1.00 0.00 C ATOM 447 CE1 HIS A 30 -2.605 -10.955 11.912 1.00 0.00 C ATOM 448 NE2 HIS A 30 -1.611 -10.461 12.627 1.00 0.00 N ATOM 0 H HIS A 30 -2.879 -6.255 8.102 1.00 0.00 H new ATOM 0 HA HIS A 30 -4.115 -7.839 10.276 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -1.770 -8.327 9.002 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -1.194 -7.232 10.243 1.00 0.00 H new ATOM 0 HD1 HIS A 30 -3.566 -10.260 10.198 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -0.411 -8.637 12.427 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -3.129 -11.878 12.111 1.00 0.00 H new ATOM 457 N LYS A 31 -4.430 -5.358 11.093 1.00 0.00 N ATOM 458 CA LYS A 31 -4.532 -4.204 11.983 1.00 0.00 C ATOM 459 C LYS A 31 -3.617 -3.071 11.529 1.00 0.00 C ATOM 460 O LYS A 31 -2.692 -3.280 10.746 1.00 0.00 O ATOM 461 CB LYS A 31 -4.183 -4.611 13.416 1.00 0.00 C ATOM 462 CG LYS A 31 -5.380 -5.092 14.220 1.00 0.00 C ATOM 463 CD LYS A 31 -5.965 -3.977 15.071 1.00 0.00 C ATOM 464 CE LYS A 31 -6.944 -4.516 16.101 1.00 0.00 C ATOM 465 NZ LYS A 31 -6.258 -5.311 17.156 1.00 0.00 N ATOM 0 H LYS A 31 -5.310 -5.635 10.659 1.00 0.00 H new ATOM 0 HA LYS A 31 -5.561 -3.845 11.949 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.433 -5.402 13.388 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.731 -3.761 13.927 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -6.144 -5.474 13.543 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -5.080 -5.921 14.861 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -5.160 -3.444 15.577 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -6.471 -3.256 14.429 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -7.479 -3.686 16.562 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -7.688 -5.138 15.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -6.888 -5.416 17.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -6.018 -6.251 16.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -5.388 -4.822 17.448 1.00 0.00 H new ATOM 479 N GLY A 32 -3.884 -1.869 12.032 1.00 0.00 N ATOM 480 CA GLY A 32 -3.078 -0.718 11.673 1.00 0.00 C ATOM 481 C GLY A 32 -3.725 0.138 10.601 1.00 0.00 C ATOM 482 O GLY A 32 -3.601 1.363 10.618 1.00 0.00 O ATOM 0 H GLY A 32 -4.645 -1.673 12.682 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -2.903 -0.111 12.561 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.103 -1.057 11.322 1.00 0.00 H new ATOM 486 N ALA A 33 -4.410 -0.508 9.664 1.00 0.00 N ATOM 487 CA ALA A 33 -5.071 0.202 8.575 1.00 0.00 C ATOM 488 C ALA A 33 -6.303 0.959 9.064 1.00 0.00 C ATOM 489 O ALA A 33 -6.435 2.160 8.829 1.00 0.00 O ATOM 490 CB ALA A 33 -5.459 -0.770 7.474 1.00 0.00 C ATOM 0 H ALA A 33 -4.522 -1.521 9.636 1.00 0.00 H new ATOM 0 HA ALA A 33 -4.366 0.932 8.179 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -5.952 -0.228 6.667 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -4.564 -1.260 7.089 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -6.140 -1.521 7.875 1.00 0.00 H new ATOM 496 N LYS A 34 -7.211 0.239 9.723 1.00 0.00 N ATOM 497 CA LYS A 34 -8.457 0.823 10.232 1.00 0.00 C ATOM 498 C LYS A 34 -8.292 2.280 10.688 1.00 0.00 C ATOM 499 O LYS A 34 -8.812 3.196 10.058 1.00 0.00 O ATOM 500 CB LYS A 34 -8.977 -0.005 11.415 1.00 0.00 C ATOM 501 CG LYS A 34 -10.491 -0.137 11.466 1.00 0.00 C ATOM 502 CD LYS A 34 -10.972 -1.379 10.737 1.00 0.00 C ATOM 503 CE LYS A 34 -10.937 -1.191 9.229 1.00 0.00 C ATOM 504 NZ LYS A 34 -11.778 -2.199 8.525 1.00 0.00 N ATOM 0 H LYS A 34 -7.108 -0.757 9.919 1.00 0.00 H new ATOM 0 HA LYS A 34 -9.166 0.810 9.404 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -8.538 -1.002 11.367 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -8.632 0.451 12.343 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -10.818 -0.176 12.505 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -10.948 0.746 11.020 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -10.347 -2.229 11.013 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -11.989 -1.615 11.051 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -11.286 -0.189 8.980 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -9.908 -1.267 8.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -11.173 -2.802 7.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -12.274 -2.787 9.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -12.475 -1.712 7.926 1.00 0.00 H new ATOM 518 N ASP A 35 -7.587 2.483 11.797 1.00 0.00 N ATOM 519 CA ASP A 35 -7.386 3.820 12.358 1.00 0.00 C ATOM 520 C ASP A 35 -6.944 4.851 11.316 1.00 0.00 C ATOM 521 O ASP A 35 -7.705 5.744 10.971 1.00 0.00 O ATOM 522 CB ASP A 35 -6.359 3.765 13.484 1.00 0.00 C ATOM 523 CG ASP A 35 -6.662 2.677 14.495 1.00 0.00 C ATOM 524 OD1 ASP A 35 -6.560 1.486 14.133 1.00 0.00 O ATOM 525 OD2 ASP A 35 -7.000 3.016 15.648 1.00 0.00 O ATOM 0 H ASP A 35 -7.142 1.735 12.329 1.00 0.00 H new ATOM 0 HA ASP A 35 -8.354 4.144 12.740 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -5.369 3.597 13.060 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -6.329 4.729 13.991 1.00 0.00 H new ATOM 530 N GLY A 36 -5.709 4.730 10.835 1.00 0.00 N ATOM 531 CA GLY A 36 -5.168 5.664 9.853 1.00 0.00 C ATOM 532 C GLY A 36 -6.230 6.271 8.963 1.00 0.00 C ATOM 533 O GLY A 36 -6.788 7.321 9.281 1.00 0.00 O ATOM 0 H GLY A 36 -5.062 3.991 11.111 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -4.639 6.462 10.373 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.436 5.147 9.233 1.00 0.00 H new ATOM 537 N LEU A 37 -6.516 5.602 7.855 1.00 0.00 N ATOM 538 CA LEU A 37 -7.520 6.060 6.916 1.00 0.00 C ATOM 539 C LEU A 37 -8.770 6.586 7.638 1.00 0.00 C ATOM 540 O LEU A 37 -9.308 7.626 7.277 1.00 0.00 O ATOM 541 CB LEU A 37 -7.876 4.906 5.982 1.00 0.00 C ATOM 542 CG LEU A 37 -9.161 5.073 5.182 1.00 0.00 C ATOM 543 CD1 LEU A 37 -9.149 6.400 4.454 1.00 0.00 C ATOM 544 CD2 LEU A 37 -9.324 3.916 4.213 1.00 0.00 C ATOM 0 H LEU A 37 -6.059 4.731 7.586 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.116 6.892 6.339 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.052 4.761 5.284 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -7.955 3.995 6.575 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.013 5.067 5.862 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -10.072 6.511 3.884 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.069 7.211 5.178 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.297 6.435 3.775 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.246 4.044 3.645 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -8.476 3.893 3.528 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.367 2.979 4.769 1.00 0.00 H new ATOM 556 N THR A 38 -9.228 5.873 8.660 1.00 0.00 N ATOM 557 CA THR A 38 -10.410 6.306 9.401 1.00 0.00 C ATOM 558 C THR A 38 -10.154 7.633 10.109 1.00 0.00 C ATOM 559 O THR A 38 -10.932 8.572 9.994 1.00 0.00 O ATOM 560 CB THR A 38 -10.848 5.230 10.403 1.00 0.00 C ATOM 561 OG1 THR A 38 -12.251 5.045 10.345 1.00 0.00 O ATOM 562 CG2 THR A 38 -10.494 5.521 11.844 1.00 0.00 C ATOM 0 H THR A 38 -8.808 5.005 8.992 1.00 0.00 H new ATOM 0 HA THR A 38 -11.220 6.456 8.687 1.00 0.00 H new ATOM 0 HB THR A 38 -10.298 4.339 10.101 1.00 0.00 H new ATOM 0 HG1 THR A 38 -12.701 5.878 10.598 1.00 0.00 H new ATOM 0 HG21 THR A 38 -10.844 4.705 12.476 1.00 0.00 H new ATOM 0 HG22 THR A 38 -9.413 5.617 11.941 1.00 0.00 H new ATOM 0 HG23 THR A 38 -10.970 6.451 12.155 1.00 0.00 H new ATOM 570 N VAL A 39 -9.058 7.692 10.842 1.00 0.00 N ATOM 571 CA VAL A 39 -8.676 8.883 11.581 1.00 0.00 C ATOM 572 C VAL A 39 -8.738 10.117 10.696 1.00 0.00 C ATOM 573 O VAL A 39 -9.007 11.221 11.170 1.00 0.00 O ATOM 574 CB VAL A 39 -7.268 8.689 12.170 1.00 0.00 C ATOM 575 CG1 VAL A 39 -6.649 9.991 12.649 1.00 0.00 C ATOM 576 CG2 VAL A 39 -7.345 7.678 13.295 1.00 0.00 C ATOM 0 H VAL A 39 -8.406 6.914 10.943 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.381 9.038 12.398 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.614 8.320 11.380 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -5.657 9.794 13.055 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.568 10.685 11.812 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -7.278 10.429 13.424 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -6.352 7.532 13.721 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -8.021 8.044 14.068 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.717 6.730 12.907 1.00 0.00 H new ATOM 586 N GLU A 40 -8.537 9.916 9.404 1.00 0.00 N ATOM 587 CA GLU A 40 -8.625 11.009 8.459 1.00 0.00 C ATOM 588 C GLU A 40 -10.024 11.024 7.861 1.00 0.00 C ATOM 589 O GLU A 40 -10.532 12.077 7.499 1.00 0.00 O ATOM 590 CB GLU A 40 -7.558 10.910 7.372 1.00 0.00 C ATOM 591 CG GLU A 40 -7.366 9.515 6.821 1.00 0.00 C ATOM 592 CD GLU A 40 -8.195 9.275 5.576 1.00 0.00 C ATOM 593 OE1 GLU A 40 -9.382 9.660 5.574 1.00 0.00 O ATOM 594 OE2 GLU A 40 -7.661 8.699 4.606 1.00 0.00 O ATOM 0 H GLU A 40 -8.313 9.011 8.991 1.00 0.00 H new ATOM 0 HA GLU A 40 -8.440 11.947 8.983 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -7.825 11.579 6.554 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.609 11.263 7.776 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.312 9.359 6.590 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.637 8.784 7.583 1.00 0.00 H new ATOM 601 N ILE A 41 -10.667 9.848 7.815 1.00 0.00 N ATOM 602 CA ILE A 41 -12.036 9.755 7.324 1.00 0.00 C ATOM 603 C ILE A 41 -12.940 10.413 8.351 1.00 0.00 C ATOM 604 O ILE A 41 -13.622 11.394 8.055 1.00 0.00 O ATOM 605 CB ILE A 41 -12.493 8.296 7.097 1.00 0.00 C ATOM 606 CG1 ILE A 41 -11.795 7.696 5.877 1.00 0.00 C ATOM 607 CG2 ILE A 41 -14.003 8.225 6.922 1.00 0.00 C ATOM 608 CD1 ILE A 41 -12.062 8.447 4.593 1.00 0.00 C ATOM 0 H ILE A 41 -10.260 8.960 8.110 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.090 10.254 6.356 1.00 0.00 H new ATOM 0 HB ILE A 41 -12.217 7.716 7.978 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -10.720 7.675 6.058 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -12.118 6.662 5.757 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -14.303 7.189 6.764 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -14.492 8.611 7.817 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -14.298 8.824 6.060 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -11.534 7.963 3.772 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -13.132 8.446 4.387 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -11.713 9.475 4.693 1.00 0.00 H new ATOM 620 N ASN A 42 -12.903 9.890 9.584 1.00 0.00 N ATOM 621 CA ASN A 42 -13.680 10.457 10.675 1.00 0.00 C ATOM 622 C ASN A 42 -13.523 11.971 10.660 1.00 0.00 C ATOM 623 O ASN A 42 -14.501 12.716 10.734 1.00 0.00 O ATOM 624 CB ASN A 42 -13.193 9.903 12.017 1.00 0.00 C ATOM 625 CG ASN A 42 -13.148 8.390 12.045 1.00 0.00 C ATOM 626 OD1 ASN A 42 -13.821 7.720 11.261 1.00 0.00 O ATOM 627 ND2 ASN A 42 -12.350 7.844 12.955 1.00 0.00 N ATOM 0 H ASN A 42 -12.343 9.078 9.842 1.00 0.00 H new ATOM 0 HA ASN A 42 -14.729 10.190 10.547 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -12.198 10.296 12.228 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -13.850 10.257 12.811 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -12.276 6.829 13.025 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -11.811 8.439 13.584 1.00 0.00 H new ATOM 634 N LYS A 43 -12.272 12.411 10.549 1.00 0.00 N ATOM 635 CA LYS A 43 -11.963 13.837 10.508 1.00 0.00 C ATOM 636 C LYS A 43 -12.282 14.449 9.136 1.00 0.00 C ATOM 637 O LYS A 43 -12.518 15.653 9.030 1.00 0.00 O ATOM 638 CB LYS A 43 -10.488 14.067 10.845 1.00 0.00 C ATOM 639 CG LYS A 43 -10.124 15.532 11.017 1.00 0.00 C ATOM 640 CD LYS A 43 -10.285 15.981 12.460 1.00 0.00 C ATOM 641 CE LYS A 43 -11.641 16.625 12.694 1.00 0.00 C ATOM 642 NZ LYS A 43 -12.098 16.460 14.102 1.00 0.00 N ATOM 0 H LYS A 43 -11.457 11.801 10.486 1.00 0.00 H new ATOM 0 HA LYS A 43 -12.590 14.330 11.251 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -10.246 13.531 11.763 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -9.872 13.639 10.054 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.094 15.692 10.698 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -10.756 16.143 10.372 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -10.168 15.124 13.124 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -9.496 16.690 12.712 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -11.586 17.686 12.452 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -12.374 16.182 12.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -13.027 16.913 14.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -12.176 15.447 14.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -11.411 16.905 14.744 1.00 0.00 H new ATOM 656 N ALA A 44 -12.279 13.623 8.087 1.00 0.00 N ATOM 657 CA ALA A 44 -12.559 14.102 6.730 1.00 0.00 C ATOM 658 C ALA A 44 -14.035 14.429 6.548 1.00 0.00 C ATOM 659 O ALA A 44 -14.386 15.565 6.242 1.00 0.00 O ATOM 660 CB ALA A 44 -12.118 13.079 5.692 1.00 0.00 C ATOM 0 H ALA A 44 -12.087 12.623 8.150 1.00 0.00 H new ATOM 0 HA ALA A 44 -11.987 15.019 6.585 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -12.336 13.457 4.693 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -11.047 12.903 5.787 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -12.655 12.144 5.851 1.00 0.00 H new ATOM 666 N GLU A 45 -14.898 13.432 6.735 1.00 0.00 N ATOM 667 CA GLU A 45 -16.339 13.633 6.596 1.00 0.00 C ATOM 668 C GLU A 45 -16.756 14.916 7.291 1.00 0.00 C ATOM 669 O GLU A 45 -17.490 15.730 6.734 1.00 0.00 O ATOM 670 CB GLU A 45 -17.103 12.455 7.190 1.00 0.00 C ATOM 671 CG GLU A 45 -16.684 11.115 6.619 1.00 0.00 C ATOM 672 CD GLU A 45 -16.577 10.043 7.686 1.00 0.00 C ATOM 673 OE1 GLU A 45 -15.657 10.130 8.525 1.00 0.00 O ATOM 674 OE2 GLU A 45 -17.415 9.118 7.684 1.00 0.00 O ATOM 0 H GLU A 45 -14.626 12.481 6.982 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.575 13.706 5.534 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -16.955 12.443 8.270 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.169 12.598 7.016 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -17.406 10.803 5.864 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.723 11.221 6.116 1.00 0.00 H new ATOM 681 N GLU A 46 -16.253 15.103 8.508 1.00 0.00 N ATOM 682 CA GLU A 46 -16.546 16.306 9.266 1.00 0.00 C ATOM 683 C GLU A 46 -16.207 17.520 8.420 1.00 0.00 C ATOM 684 O GLU A 46 -16.921 18.516 8.437 1.00 0.00 O ATOM 685 CB GLU A 46 -15.746 16.329 10.571 1.00 0.00 C ATOM 686 CG GLU A 46 -16.251 15.344 11.612 1.00 0.00 C ATOM 687 CD GLU A 46 -16.240 15.920 13.014 1.00 0.00 C ATOM 688 OE1 GLU A 46 -16.690 17.073 13.186 1.00 0.00 O ATOM 689 OE2 GLU A 46 -15.780 15.220 13.940 1.00 0.00 O ATOM 0 H GLU A 46 -15.644 14.438 8.985 1.00 0.00 H new ATOM 0 HA GLU A 46 -17.606 16.322 9.520 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -14.701 16.108 10.351 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -15.778 17.335 10.989 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -17.266 15.040 11.356 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -15.633 14.446 11.587 1.00 0.00 H new ATOM 696 N VAL A 47 -15.119 17.401 7.658 1.00 0.00 N ATOM 697 CA VAL A 47 -14.670 18.463 6.769 1.00 0.00 C ATOM 698 C VAL A 47 -15.520 18.494 5.508 1.00 0.00 C ATOM 699 O VAL A 47 -15.969 19.556 5.080 1.00 0.00 O ATOM 700 CB VAL A 47 -13.172 18.296 6.410 1.00 0.00 C ATOM 701 CG1 VAL A 47 -12.811 18.999 5.104 1.00 0.00 C ATOM 702 CG2 VAL A 47 -12.327 18.842 7.538 1.00 0.00 C ATOM 0 H VAL A 47 -14.530 16.569 7.642 1.00 0.00 H new ATOM 0 HA VAL A 47 -14.786 19.412 7.292 1.00 0.00 H new ATOM 0 HB VAL A 47 -12.976 17.233 6.270 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -11.751 18.854 4.894 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -13.403 18.581 4.290 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -13.021 20.065 5.194 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.272 18.727 7.291 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -12.553 19.898 7.683 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -12.546 18.295 8.455 1.00 0.00 H new ATOM 712 N PHE A 48 -15.760 17.324 4.924 1.00 0.00 N ATOM 713 CA PHE A 48 -16.584 17.238 3.722 1.00 0.00 C ATOM 714 C PHE A 48 -17.877 18.019 3.925 1.00 0.00 C ATOM 715 O PHE A 48 -18.412 18.618 2.993 1.00 0.00 O ATOM 716 CB PHE A 48 -16.907 15.778 3.386 1.00 0.00 C ATOM 717 CG PHE A 48 -17.993 15.627 2.355 1.00 0.00 C ATOM 718 CD1 PHE A 48 -17.957 16.366 1.183 1.00 0.00 C ATOM 719 CD2 PHE A 48 -19.050 14.756 2.562 1.00 0.00 C ATOM 720 CE1 PHE A 48 -18.955 16.238 0.236 1.00 0.00 C ATOM 721 CE2 PHE A 48 -20.051 14.624 1.619 1.00 0.00 C ATOM 722 CZ PHE A 48 -20.004 15.365 0.454 1.00 0.00 C ATOM 0 H PHE A 48 -15.400 16.430 5.259 1.00 0.00 H new ATOM 0 HA PHE A 48 -16.026 17.668 2.890 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -16.003 15.288 3.025 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -17.207 15.261 4.297 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -17.140 17.050 1.008 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -19.092 14.174 3.471 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -18.915 16.819 -0.673 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -20.870 13.942 1.793 1.00 0.00 H new ATOM 0 HZ PHE A 48 -20.785 15.262 -0.285 1.00 0.00 H new ATOM 732 N ASN A 49 -18.368 18.003 5.159 1.00 0.00 N ATOM 733 CA ASN A 49 -19.599 18.705 5.502 1.00 0.00 C ATOM 734 C ASN A 49 -19.331 19.901 6.417 1.00 0.00 C ATOM 735 O ASN A 49 -20.246 20.662 6.731 1.00 0.00 O ATOM 736 CB ASN A 49 -20.583 17.748 6.176 1.00 0.00 C ATOM 737 CG ASN A 49 -20.719 16.435 5.429 1.00 0.00 C ATOM 738 OD1 ASN A 49 -21.561 16.296 4.542 1.00 0.00 O ATOM 739 ND2 ASN A 49 -19.886 15.464 5.784 1.00 0.00 N ATOM 0 H ASN A 49 -17.932 17.511 5.939 1.00 0.00 H new ATOM 0 HA ASN A 49 -20.033 19.080 4.575 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -20.252 17.550 7.195 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -21.560 18.226 6.245 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -19.929 14.559 5.316 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -19.203 15.623 6.525 1.00 0.00 H new ATOM 746 N LYS A 50 -18.081 20.066 6.854 1.00 0.00 N ATOM 747 CA LYS A 50 -17.733 21.180 7.745 1.00 0.00 C ATOM 748 C LYS A 50 -17.992 22.530 7.084 1.00 0.00 C ATOM 749 O LYS A 50 -18.041 22.636 5.859 1.00 0.00 O ATOM 750 CB LYS A 50 -16.264 21.107 8.162 1.00 0.00 C ATOM 751 CG LYS A 50 -15.873 22.138 9.203 1.00 0.00 C ATOM 752 CD LYS A 50 -14.759 21.622 10.096 1.00 0.00 C ATOM 753 CE LYS A 50 -13.956 22.764 10.696 1.00 0.00 C ATOM 754 NZ LYS A 50 -14.640 23.366 11.874 1.00 0.00 N ATOM 0 H LYS A 50 -17.302 19.454 6.612 1.00 0.00 H new ATOM 0 HA LYS A 50 -18.369 21.090 8.626 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -16.056 20.111 8.554 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -15.638 21.240 7.279 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -15.551 23.054 8.708 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -16.741 22.392 9.811 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -15.183 21.014 10.895 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -14.099 20.974 9.519 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -12.973 22.399 10.994 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -13.795 23.531 9.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -13.951 23.507 12.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -15.052 24.282 11.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -15.395 22.729 12.200 1.00 0.00 H new ATOM 768 N GLU A 51 -18.137 23.565 7.910 1.00 0.00 N ATOM 769 CA GLU A 51 -18.366 24.917 7.411 1.00 0.00 C ATOM 770 C GLU A 51 -17.043 25.593 7.129 1.00 0.00 C ATOM 771 O GLU A 51 -16.881 26.247 6.099 1.00 0.00 O ATOM 772 CB GLU A 51 -19.188 25.737 8.406 1.00 0.00 C ATOM 773 CG GLU A 51 -20.130 26.729 7.745 1.00 0.00 C ATOM 774 CD GLU A 51 -21.476 26.806 8.437 1.00 0.00 C ATOM 775 OE1 GLU A 51 -21.500 27.027 9.666 1.00 0.00 O ATOM 776 OE2 GLU A 51 -22.507 26.646 7.750 1.00 0.00 O ATOM 0 H GLU A 51 -18.100 23.492 8.927 1.00 0.00 H new ATOM 0 HA GLU A 51 -18.935 24.852 6.483 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -19.769 25.059 9.031 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -18.510 26.277 9.067 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -19.669 27.717 7.744 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -20.277 26.445 6.703 1.00 0.00 H new ATOM 783 N ASP A 52 -16.075 25.399 8.015 1.00 0.00 N ATOM 784 CA ASP A 52 -14.762 25.967 7.790 1.00 0.00 C ATOM 785 C ASP A 52 -13.952 25.039 6.907 1.00 0.00 C ATOM 786 O ASP A 52 -12.733 25.174 6.801 1.00 0.00 O ATOM 787 CB ASP A 52 -14.008 26.244 9.088 1.00 0.00 C ATOM 788 CG ASP A 52 -14.912 26.740 10.199 1.00 0.00 C ATOM 789 OD1 ASP A 52 -15.770 25.959 10.660 1.00 0.00 O ATOM 790 OD2 ASP A 52 -14.762 27.911 10.609 1.00 0.00 O ATOM 0 H ASP A 52 -16.174 24.864 8.877 1.00 0.00 H new ATOM 0 HA ASP A 52 -14.904 26.928 7.296 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -13.507 25.332 9.413 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -13.231 26.985 8.900 1.00 0.00 H new ATOM 795 N ALA A 53 -14.645 24.126 6.225 1.00 0.00 N ATOM 796 CA ALA A 53 -14.002 23.222 5.302 1.00 0.00 C ATOM 797 C ALA A 53 -13.734 23.998 4.037 1.00 0.00 C ATOM 798 O ALA A 53 -14.092 23.587 2.938 1.00 0.00 O ATOM 799 CB ALA A 53 -14.868 22.002 5.032 1.00 0.00 C ATOM 0 H ALA A 53 -15.654 24.002 6.303 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.069 22.845 5.722 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -14.356 21.340 4.333 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -15.051 21.472 5.967 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -15.818 22.318 4.602 1.00 0.00 H new ATOM 805 N THR A 54 -13.133 25.156 4.243 1.00 0.00 N ATOM 806 CA THR A 54 -12.804 26.083 3.183 1.00 0.00 C ATOM 807 C THR A 54 -11.343 25.933 2.775 1.00 0.00 C ATOM 808 O THR A 54 -10.857 24.827 2.545 1.00 0.00 O ATOM 809 CB THR A 54 -13.114 27.510 3.657 1.00 0.00 C ATOM 810 OG1 THR A 54 -12.083 27.998 4.498 1.00 0.00 O ATOM 811 CG2 THR A 54 -14.415 27.610 4.430 1.00 0.00 C ATOM 0 H THR A 54 -12.856 25.481 5.169 1.00 0.00 H new ATOM 0 HA THR A 54 -13.407 25.866 2.301 1.00 0.00 H new ATOM 0 HB THR A 54 -13.196 28.105 2.747 1.00 0.00 H new ATOM 0 HG1 THR A 54 -12.300 28.909 4.787 1.00 0.00 H new ATOM 0 HG21 THR A 54 -14.577 28.643 4.737 1.00 0.00 H new ATOM 0 HG22 THR A 54 -15.241 27.286 3.796 1.00 0.00 H new ATOM 0 HG23 THR A 54 -14.364 26.973 5.313 1.00 0.00 H new ATOM 819 N GLU A 55 -10.657 27.046 2.682 1.00 0.00 N ATOM 820 CA GLU A 55 -9.251 27.053 2.293 1.00 0.00 C ATOM 821 C GLU A 55 -8.344 26.604 3.438 1.00 0.00 C ATOM 822 O GLU A 55 -7.147 26.405 3.241 1.00 0.00 O ATOM 823 CB GLU A 55 -8.841 28.450 1.823 1.00 0.00 C ATOM 824 CG GLU A 55 -7.620 28.452 0.918 1.00 0.00 C ATOM 825 CD GLU A 55 -7.507 29.721 0.096 1.00 0.00 C ATOM 826 OE1 GLU A 55 -7.460 30.816 0.697 1.00 0.00 O ATOM 827 OE2 GLU A 55 -7.465 29.621 -1.149 1.00 0.00 O ATOM 0 H GLU A 55 -11.045 27.970 2.870 1.00 0.00 H new ATOM 0 HA GLU A 55 -9.133 26.343 1.474 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -9.677 28.906 1.293 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -8.638 29.073 2.694 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.722 28.335 1.525 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -7.667 27.593 0.249 1.00 0.00 H new ATOM 834 N GLU A 56 -8.906 26.468 4.635 1.00 0.00 N ATOM 835 CA GLU A 56 -8.123 26.061 5.799 1.00 0.00 C ATOM 836 C GLU A 56 -8.218 24.561 6.088 1.00 0.00 C ATOM 837 O GLU A 56 -7.249 23.822 5.917 1.00 0.00 O ATOM 838 CB GLU A 56 -8.564 26.850 7.033 1.00 0.00 C ATOM 839 CG GLU A 56 -7.488 27.773 7.580 1.00 0.00 C ATOM 840 CD GLU A 56 -6.973 28.748 6.539 1.00 0.00 C ATOM 841 OE1 GLU A 56 -6.142 28.338 5.701 1.00 0.00 O ATOM 842 OE2 GLU A 56 -7.402 29.921 6.561 1.00 0.00 O ATOM 0 H GLU A 56 -9.895 26.632 4.825 1.00 0.00 H new ATOM 0 HA GLU A 56 -7.081 26.279 5.565 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -9.444 27.441 6.781 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -8.863 26.151 7.814 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -7.888 28.330 8.427 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -6.657 27.175 7.955 1.00 0.00 H new ATOM 849 N GLU A 57 -9.377 24.135 6.581 1.00 0.00 N ATOM 850 CA GLU A 57 -9.600 22.738 6.965 1.00 0.00 C ATOM 851 C GLU A 57 -9.431 21.742 5.818 1.00 0.00 C ATOM 852 O GLU A 57 -8.904 20.650 6.023 1.00 0.00 O ATOM 853 CB GLU A 57 -10.991 22.584 7.576 1.00 0.00 C ATOM 854 CG GLU A 57 -11.033 22.871 9.068 1.00 0.00 C ATOM 855 CD GLU A 57 -10.893 21.616 9.907 1.00 0.00 C ATOM 856 OE1 GLU A 57 -11.200 20.519 9.392 1.00 0.00 O ATOM 857 OE2 GLU A 57 -10.479 21.729 11.079 1.00 0.00 O ATOM 0 H GLU A 57 -10.185 24.740 6.726 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.827 22.499 7.695 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -11.680 23.257 7.065 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -11.347 21.569 7.399 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -10.233 23.566 9.323 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -11.974 23.364 9.313 1.00 0.00 H new ATOM 864 N ILE A 58 -9.892 22.092 4.625 1.00 0.00 N ATOM 865 CA ILE A 58 -9.797 21.184 3.484 1.00 0.00 C ATOM 866 C ILE A 58 -8.365 20.728 3.245 1.00 0.00 C ATOM 867 O ILE A 58 -8.062 19.544 3.350 1.00 0.00 O ATOM 868 CB ILE A 58 -10.351 21.827 2.203 1.00 0.00 C ATOM 869 CG1 ILE A 58 -11.785 22.283 2.445 1.00 0.00 C ATOM 870 CG2 ILE A 58 -10.290 20.851 1.034 1.00 0.00 C ATOM 871 CD1 ILE A 58 -12.426 22.960 1.256 1.00 0.00 C ATOM 0 H ILE A 58 -10.332 22.989 4.420 1.00 0.00 H new ATOM 0 HA ILE A 58 -10.404 20.313 3.731 1.00 0.00 H new ATOM 0 HB ILE A 58 -9.737 22.690 1.947 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -12.387 21.419 2.726 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -11.799 22.970 3.291 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -10.688 21.330 0.139 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -9.255 20.557 0.859 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -10.884 19.967 1.267 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -13.444 23.254 1.510 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -11.849 23.845 0.987 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -12.447 22.270 0.412 1.00 0.00 H new ATOM 883 N ASN A 59 -7.487 21.670 2.924 1.00 0.00 N ATOM 884 CA ASN A 59 -6.081 21.338 2.673 1.00 0.00 C ATOM 885 C ASN A 59 -5.545 20.443 3.785 1.00 0.00 C ATOM 886 O ASN A 59 -4.769 19.520 3.538 1.00 0.00 O ATOM 887 CB ASN A 59 -5.205 22.598 2.558 1.00 0.00 C ATOM 888 CG ASN A 59 -5.938 23.880 2.906 1.00 0.00 C ATOM 889 OD1 ASN A 59 -7.012 24.156 2.372 1.00 0.00 O ATOM 890 ND2 ASN A 59 -5.357 24.666 3.805 1.00 0.00 N ATOM 0 H ASN A 59 -7.715 22.660 2.831 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.037 20.810 1.721 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -4.342 22.492 3.216 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -4.822 22.673 1.540 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -5.802 25.542 4.080 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -4.466 24.394 4.220 1.00 0.00 H new ATOM 897 N LEU A 60 -5.977 20.723 5.007 1.00 0.00 N ATOM 898 CA LEU A 60 -5.558 19.944 6.162 1.00 0.00 C ATOM 899 C LEU A 60 -6.257 18.587 6.176 1.00 0.00 C ATOM 900 O LEU A 60 -5.697 17.595 6.642 1.00 0.00 O ATOM 901 CB LEU A 60 -5.863 20.706 7.456 1.00 0.00 C ATOM 902 CG LEU A 60 -5.388 22.160 7.480 1.00 0.00 C ATOM 903 CD1 LEU A 60 -6.231 22.987 8.443 1.00 0.00 C ATOM 904 CD2 LEU A 60 -3.916 22.231 7.862 1.00 0.00 C ATOM 0 H LEU A 60 -6.619 21.486 5.223 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.482 19.780 6.094 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -6.940 20.689 7.624 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -5.402 20.176 8.289 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.507 22.576 6.480 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -5.876 24.018 8.444 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -7.274 22.963 8.127 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -6.147 22.573 9.448 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.593 23.272 7.875 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.775 21.795 8.851 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -3.324 21.676 7.134 1.00 0.00 H new ATOM 916 N ALA A 61 -7.488 18.553 5.666 1.00 0.00 N ATOM 917 CA ALA A 61 -8.265 17.320 5.625 1.00 0.00 C ATOM 918 C ALA A 61 -7.966 16.496 4.371 1.00 0.00 C ATOM 919 O ALA A 61 -8.257 15.301 4.321 1.00 0.00 O ATOM 920 CB ALA A 61 -9.749 17.644 5.693 1.00 0.00 C ATOM 0 H ALA A 61 -7.966 19.366 5.277 1.00 0.00 H new ATOM 0 HA ALA A 61 -7.979 16.719 6.488 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.325 16.719 5.662 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -9.964 18.174 6.621 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.024 18.271 4.845 1.00 0.00 H new ATOM 926 N LYS A 62 -7.403 17.143 3.354 1.00 0.00 N ATOM 927 CA LYS A 62 -7.089 16.470 2.096 1.00 0.00 C ATOM 928 C LYS A 62 -5.770 15.696 2.180 1.00 0.00 C ATOM 929 O LYS A 62 -5.704 14.525 1.809 1.00 0.00 O ATOM 930 CB LYS A 62 -7.046 17.495 0.949 1.00 0.00 C ATOM 931 CG LYS A 62 -5.677 18.115 0.704 1.00 0.00 C ATOM 932 CD LYS A 62 -5.704 19.076 -0.473 1.00 0.00 C ATOM 933 CE LYS A 62 -5.225 18.406 -1.750 1.00 0.00 C ATOM 934 NZ LYS A 62 -4.746 19.398 -2.752 1.00 0.00 N ATOM 0 H LYS A 62 -7.155 18.132 3.376 1.00 0.00 H new ATOM 0 HA LYS A 62 -7.877 15.744 1.897 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -7.379 17.009 0.032 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -7.758 18.292 1.164 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -5.350 18.644 1.599 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -4.948 17.327 0.515 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -6.718 19.450 -0.615 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -5.074 19.938 -0.255 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -4.420 17.710 -1.515 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -6.038 17.820 -2.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -4.428 18.901 -3.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -5.521 20.047 -2.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -3.954 19.940 -2.352 1.00 0.00 H new ATOM 948 N GLU A 63 -4.724 16.362 2.658 1.00 0.00 N ATOM 949 CA GLU A 63 -3.405 15.744 2.777 1.00 0.00 C ATOM 950 C GLU A 63 -3.428 14.541 3.716 1.00 0.00 C ATOM 951 O GLU A 63 -2.528 13.702 3.686 1.00 0.00 O ATOM 952 CB GLU A 63 -2.394 16.770 3.285 1.00 0.00 C ATOM 953 CG GLU A 63 -0.947 16.341 3.102 1.00 0.00 C ATOM 954 CD GLU A 63 -0.010 17.019 4.082 1.00 0.00 C ATOM 955 OE1 GLU A 63 0.195 16.469 5.185 1.00 0.00 O ATOM 956 OE2 GLU A 63 0.520 18.099 3.748 1.00 0.00 O ATOM 0 H GLU A 63 -4.763 17.332 2.970 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.113 15.394 1.787 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -2.553 17.714 2.763 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.578 16.956 4.343 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -0.874 15.260 3.224 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -0.630 16.569 2.084 1.00 0.00 H new ATOM 963 N SER A 64 -4.454 14.465 4.555 1.00 0.00 N ATOM 964 CA SER A 64 -4.587 13.373 5.504 1.00 0.00 C ATOM 965 C SER A 64 -5.477 12.267 4.959 1.00 0.00 C ATOM 966 O SER A 64 -5.543 11.186 5.534 1.00 0.00 O ATOM 967 CB SER A 64 -5.145 13.888 6.833 1.00 0.00 C ATOM 968 OG SER A 64 -6.196 14.813 6.621 1.00 0.00 O ATOM 0 H SER A 64 -5.208 15.151 4.595 1.00 0.00 H new ATOM 0 HA SER A 64 -3.594 12.956 5.670 1.00 0.00 H new ATOM 0 HB2 SER A 64 -5.509 13.050 7.427 1.00 0.00 H new ATOM 0 HB3 SER A 64 -4.348 14.363 7.406 1.00 0.00 H new ATOM 0 HG SER A 64 -5.845 15.726 6.679 1.00 0.00 H new ATOM 974 N LEU A 65 -6.174 12.544 3.863 1.00 0.00 N ATOM 975 CA LEU A 65 -7.064 11.564 3.260 1.00 0.00 C ATOM 976 C LEU A 65 -6.407 10.875 2.062 1.00 0.00 C ATOM 977 O LEU A 65 -6.340 9.649 1.999 1.00 0.00 O ATOM 978 CB LEU A 65 -8.370 12.244 2.837 1.00 0.00 C ATOM 979 CG LEU A 65 -9.330 11.390 2.004 1.00 0.00 C ATOM 980 CD1 LEU A 65 -9.432 9.979 2.562 1.00 0.00 C ATOM 981 CD2 LEU A 65 -10.702 12.044 1.956 1.00 0.00 C ATOM 0 H LEU A 65 -6.139 13.439 3.375 1.00 0.00 H new ATOM 0 HA LEU A 65 -7.281 10.796 4.002 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.893 12.573 3.735 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.123 13.139 2.266 1.00 0.00 H new ATOM 0 HG LEU A 65 -8.935 11.321 0.990 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.120 9.395 1.951 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -8.448 9.510 2.549 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -9.801 10.019 3.587 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -11.378 11.429 1.361 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -11.095 12.140 2.968 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.618 13.032 1.504 1.00 0.00 H new ATOM 993 N GLU A 66 -5.927 11.675 1.116 1.00 0.00 N ATOM 994 CA GLU A 66 -5.280 11.163 -0.093 1.00 0.00 C ATOM 995 C GLU A 66 -4.182 10.162 0.242 1.00 0.00 C ATOM 996 O GLU A 66 -4.307 8.971 -0.041 1.00 0.00 O ATOM 997 CB GLU A 66 -4.696 12.318 -0.908 1.00 0.00 C ATOM 998 CG GLU A 66 -5.672 12.910 -1.912 1.00 0.00 C ATOM 999 CD GLU A 66 -5.640 14.424 -1.934 1.00 0.00 C ATOM 1000 OE1 GLU A 66 -4.827 14.990 -2.694 1.00 0.00 O ATOM 1001 OE2 GLU A 66 -6.431 15.046 -1.193 1.00 0.00 O ATOM 0 H GLU A 66 -5.974 12.693 1.162 1.00 0.00 H new ATOM 0 HA GLU A 66 -6.039 10.649 -0.682 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -4.368 13.103 -0.227 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -3.811 11.966 -1.438 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -5.438 12.531 -2.907 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -6.681 12.575 -1.672 1.00 0.00 H new ATOM 1008 N GLY A 67 -3.108 10.652 0.851 1.00 0.00 N ATOM 1009 CA GLY A 67 -2.007 9.782 1.218 1.00 0.00 C ATOM 1010 C GLY A 67 -2.366 8.829 2.343 1.00 0.00 C ATOM 1011 O GLY A 67 -1.524 8.056 2.800 1.00 0.00 O ATOM 0 H GLY A 67 -2.980 11.634 1.097 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.696 9.207 0.345 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.154 10.390 1.520 1.00 0.00 H new ATOM 1015 N ALA A 68 -3.618 8.882 2.795 1.00 0.00 N ATOM 1016 CA ALA A 68 -4.079 8.021 3.868 1.00 0.00 C ATOM 1017 C ALA A 68 -4.772 6.783 3.318 1.00 0.00 C ATOM 1018 O ALA A 68 -4.382 5.661 3.632 1.00 0.00 O ATOM 1019 CB ALA A 68 -5.002 8.788 4.783 1.00 0.00 C ATOM 0 H ALA A 68 -4.328 9.516 2.430 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.213 7.688 4.440 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -5.344 8.135 5.586 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -4.469 9.638 5.209 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.861 9.146 4.216 1.00 0.00 H new ATOM 1025 N ILE A 69 -5.777 6.974 2.463 1.00 0.00 N ATOM 1026 CA ILE A 69 -6.456 5.835 1.860 1.00 0.00 C ATOM 1027 C ILE A 69 -5.412 5.009 1.166 1.00 0.00 C ATOM 1028 O ILE A 69 -5.396 3.779 1.231 1.00 0.00 O ATOM 1029 CB ILE A 69 -7.500 6.225 0.787 1.00 0.00 C ATOM 1030 CG1 ILE A 69 -7.202 7.604 0.193 1.00 0.00 C ATOM 1031 CG2 ILE A 69 -8.906 6.163 1.344 1.00 0.00 C ATOM 1032 CD1 ILE A 69 -7.976 7.896 -1.074 1.00 0.00 C ATOM 0 H ILE A 69 -6.131 7.888 2.179 1.00 0.00 H new ATOM 0 HA ILE A 69 -6.981 5.313 2.660 1.00 0.00 H new ATOM 0 HB ILE A 69 -7.429 5.496 -0.020 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -7.434 8.368 0.935 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.135 7.677 -0.018 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -9.618 6.442 0.567 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -9.118 5.149 1.683 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -8.996 6.853 2.183 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.715 8.889 -1.439 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -7.726 7.154 -1.832 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -9.045 7.855 -0.865 1.00 0.00 H new ATOM 1044 N ALA A 70 -4.526 5.735 0.503 1.00 0.00 N ATOM 1045 CA ALA A 70 -3.434 5.140 -0.223 1.00 0.00 C ATOM 1046 C ALA A 70 -2.691 4.136 0.653 1.00 0.00 C ATOM 1047 O ALA A 70 -2.104 3.175 0.157 1.00 0.00 O ATOM 1048 CB ALA A 70 -2.514 6.235 -0.717 1.00 0.00 C ATOM 0 H ALA A 70 -4.551 6.754 0.458 1.00 0.00 H new ATOM 0 HA ALA A 70 -3.819 4.592 -1.083 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -1.684 5.792 -1.268 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -3.068 6.907 -1.373 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -2.126 6.796 0.133 1.00 0.00 H new ATOM 1054 N ARG A 71 -2.746 4.358 1.965 1.00 0.00 N ATOM 1055 CA ARG A 71 -2.105 3.467 2.918 1.00 0.00 C ATOM 1056 C ARG A 71 -2.952 2.210 3.102 1.00 0.00 C ATOM 1057 O ARG A 71 -2.520 1.111 2.754 1.00 0.00 O ATOM 1058 CB ARG A 71 -1.884 4.183 4.258 1.00 0.00 C ATOM 1059 CG ARG A 71 -1.619 3.249 5.428 1.00 0.00 C ATOM 1060 CD ARG A 71 -2.820 3.174 6.357 1.00 0.00 C ATOM 1061 NE ARG A 71 -2.454 2.701 7.691 1.00 0.00 N ATOM 1062 CZ ARG A 71 -1.944 3.483 8.641 1.00 0.00 C ATOM 1063 NH1 ARG A 71 -1.730 4.771 8.408 1.00 0.00 N ATOM 1064 NH2 ARG A 71 -1.645 2.971 9.828 1.00 0.00 N ATOM 0 H ARG A 71 -3.230 5.150 2.388 1.00 0.00 H new ATOM 0 HA ARG A 71 -1.129 3.174 2.531 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -1.042 4.868 4.157 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -2.762 4.788 4.483 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -1.382 2.253 5.055 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -0.748 3.596 5.983 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -3.279 4.159 6.435 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -3.568 2.507 5.929 1.00 0.00 H new ATOM 0 HE ARG A 71 -2.598 1.714 7.907 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -1.956 5.169 7.496 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -1.339 5.364 9.140 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -1.806 1.981 10.011 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -1.254 3.568 10.557 1.00 0.00 H new ATOM 1078 N PHE A 72 -4.168 2.370 3.637 1.00 0.00 N ATOM 1079 CA PHE A 72 -5.061 1.239 3.844 1.00 0.00 C ATOM 1080 C PHE A 72 -5.138 0.357 2.598 1.00 0.00 C ATOM 1081 O PHE A 72 -5.002 -0.864 2.679 1.00 0.00 O ATOM 1082 CB PHE A 72 -6.460 1.741 4.210 1.00 0.00 C ATOM 1083 CG PHE A 72 -7.262 0.762 5.024 1.00 0.00 C ATOM 1084 CD1 PHE A 72 -7.096 -0.604 4.865 1.00 0.00 C ATOM 1085 CD2 PHE A 72 -8.183 1.213 5.950 1.00 0.00 C ATOM 1086 CE1 PHE A 72 -7.832 -1.495 5.614 1.00 0.00 C ATOM 1087 CE2 PHE A 72 -8.924 0.322 6.703 1.00 0.00 C ATOM 1088 CZ PHE A 72 -8.746 -1.033 6.534 1.00 0.00 C ATOM 0 H PHE A 72 -4.549 3.269 3.931 1.00 0.00 H new ATOM 0 HA PHE A 72 -4.662 0.638 4.661 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -6.367 2.673 4.768 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -7.005 1.970 3.294 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -6.381 -0.975 4.145 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -8.326 2.275 6.087 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -7.692 -2.557 5.479 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -9.641 0.688 7.423 1.00 0.00 H new ATOM 0 HZ PHE A 72 -9.322 -1.732 7.122 1.00 0.00 H new ATOM 1098 N ASN A 73 -5.363 0.982 1.446 1.00 0.00 N ATOM 1099 CA ASN A 73 -5.470 0.253 0.185 1.00 0.00 C ATOM 1100 C ASN A 73 -4.383 -0.814 0.050 1.00 0.00 C ATOM 1101 O ASN A 73 -4.610 -1.868 -0.546 1.00 0.00 O ATOM 1102 CB ASN A 73 -5.398 1.227 -0.993 1.00 0.00 C ATOM 1103 CG ASN A 73 -6.668 2.044 -1.141 1.00 0.00 C ATOM 1104 OD1 ASN A 73 -7.757 1.494 -1.315 1.00 0.00 O ATOM 1105 ND2 ASN A 73 -6.535 3.364 -1.073 1.00 0.00 N ATOM 0 H ASN A 73 -5.475 1.992 1.359 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.434 -0.255 0.179 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -4.550 1.898 -0.856 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -5.218 0.670 -1.912 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -7.354 3.965 -1.166 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -5.614 3.777 -0.928 1.00 0.00 H new ATOM 1112 N SER A 74 -3.205 -0.537 0.598 1.00 0.00 N ATOM 1113 CA SER A 74 -2.090 -1.478 0.524 1.00 0.00 C ATOM 1114 C SER A 74 -1.797 -2.127 1.877 1.00 0.00 C ATOM 1115 O SER A 74 -0.648 -2.449 2.176 1.00 0.00 O ATOM 1116 CB SER A 74 -0.837 -0.770 0.007 1.00 0.00 C ATOM 1117 OG SER A 74 -0.631 0.459 0.682 1.00 0.00 O ATOM 0 H SER A 74 -2.996 0.328 1.097 1.00 0.00 H new ATOM 0 HA SER A 74 -2.377 -2.269 -0.169 1.00 0.00 H new ATOM 0 HB2 SER A 74 0.031 -1.414 0.145 1.00 0.00 H new ATOM 0 HB3 SER A 74 -0.933 -0.589 -1.064 1.00 0.00 H new ATOM 0 HG SER A 74 -1.240 1.137 0.321 1.00 0.00 H new ATOM 1123 N LEU A 75 -2.828 -2.317 2.696 1.00 0.00 N ATOM 1124 CA LEU A 75 -2.645 -2.928 4.014 1.00 0.00 C ATOM 1125 C LEU A 75 -3.238 -4.336 4.067 1.00 0.00 C ATOM 1126 O LEU A 75 -2.772 -5.187 4.824 1.00 0.00 O ATOM 1127 CB LEU A 75 -3.277 -2.052 5.099 1.00 0.00 C ATOM 1128 CG LEU A 75 -2.278 -1.263 5.953 1.00 0.00 C ATOM 1129 CD1 LEU A 75 -2.569 0.226 5.888 1.00 0.00 C ATOM 1130 CD2 LEU A 75 -2.302 -1.741 7.396 1.00 0.00 C ATOM 0 H LEU A 75 -3.790 -2.061 2.476 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.573 -3.007 4.196 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -3.962 -1.349 4.625 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.874 -2.685 5.755 1.00 0.00 H new ATOM 0 HG LEU A 75 -1.281 -1.439 5.548 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.847 0.765 6.502 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.493 0.567 4.855 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.576 0.417 6.260 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.585 -1.166 7.982 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.301 -1.603 7.809 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -2.037 -2.798 7.434 1.00 0.00 H new ATOM 1142 N LEU A 76 -4.263 -4.572 3.257 1.00 0.00 N ATOM 1143 CA LEU A 76 -4.935 -5.870 3.197 1.00 0.00 C ATOM 1144 C LEU A 76 -4.076 -6.900 2.475 1.00 0.00 C ATOM 1145 O LEU A 76 -4.530 -7.545 1.528 1.00 0.00 O ATOM 1146 CB LEU A 76 -6.274 -5.728 2.468 1.00 0.00 C ATOM 1147 CG LEU A 76 -6.254 -4.869 1.190 1.00 0.00 C ATOM 1148 CD1 LEU A 76 -6.566 -3.416 1.521 1.00 0.00 C ATOM 1149 CD2 LEU A 76 -4.915 -4.983 0.453 1.00 0.00 C ATOM 0 H LEU A 76 -4.653 -3.873 2.624 1.00 0.00 H new ATOM 0 HA LEU A 76 -5.102 -6.211 4.219 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -6.632 -6.724 2.208 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -6.999 -5.299 3.160 1.00 0.00 H new ATOM 0 HG LEU A 76 -7.027 -5.249 0.522 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -6.548 -2.823 0.607 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -7.554 -3.351 1.976 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -5.820 -3.033 2.217 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -4.939 -4.363 -0.443 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -4.110 -4.645 1.106 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.742 -6.022 0.171 1.00 0.00 H new ATOM 1161 N ILE A 77 -2.827 -7.031 2.895 1.00 0.00 N ATOM 1162 CA ILE A 77 -1.914 -7.962 2.246 1.00 0.00 C ATOM 1163 C ILE A 77 -1.899 -7.665 0.768 1.00 0.00 C ATOM 1164 O ILE A 77 -2.194 -8.532 -0.054 1.00 0.00 O ATOM 1165 CB ILE A 77 -2.327 -9.430 2.477 1.00 0.00 C ATOM 1166 CG1 ILE A 77 -2.679 -9.670 3.951 1.00 0.00 C ATOM 1167 CG2 ILE A 77 -1.219 -10.369 2.028 1.00 0.00 C ATOM 1168 CD1 ILE A 77 -1.682 -9.086 4.928 1.00 0.00 C ATOM 0 H ILE A 77 -2.424 -6.511 3.674 1.00 0.00 H new ATOM 0 HA ILE A 77 -0.922 -7.832 2.678 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.215 -9.636 1.880 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.662 -9.243 4.153 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -2.756 -10.743 4.125 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.526 -11.401 2.198 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.022 -10.219 0.966 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.313 -10.162 2.598 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.004 -9.299 5.947 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -0.702 -9.530 4.757 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.621 -8.007 4.785 1.00 0.00 H new ATOM 1180 N GLU A 78 -1.579 -6.405 0.458 1.00 0.00 N ATOM 1181 CA GLU A 78 -1.538 -5.913 -0.912 1.00 0.00 C ATOM 1182 C GLU A 78 -1.681 -7.045 -1.909 1.00 0.00 C ATOM 1183 O GLU A 78 -0.906 -8.001 -1.901 1.00 0.00 O ATOM 1184 CB GLU A 78 -0.252 -5.129 -1.168 1.00 0.00 C ATOM 1185 CG GLU A 78 -0.508 -3.690 -1.580 1.00 0.00 C ATOM 1186 CD GLU A 78 -0.118 -3.414 -3.019 1.00 0.00 C ATOM 1187 OE1 GLU A 78 -0.864 -3.838 -3.928 1.00 0.00 O ATOM 1188 OE2 GLU A 78 0.933 -2.775 -3.238 1.00 0.00 O ATOM 0 H GLU A 78 -1.341 -5.700 1.156 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.385 -5.240 -1.048 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.360 -5.140 -0.266 1.00 0.00 H new ATOM 0 HB3 GLU A 78 0.322 -5.628 -1.948 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.565 -3.460 -1.444 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.050 -3.024 -0.923 1.00 0.00 H new ATOM 1195 N GLU A 79 -2.694 -6.929 -2.752 1.00 0.00 N ATOM 1196 CA GLU A 79 -2.992 -7.934 -3.763 1.00 0.00 C ATOM 1197 C GLU A 79 -1.720 -8.514 -4.390 1.00 0.00 C ATOM 1198 O GLU A 79 -1.728 -9.636 -4.897 1.00 0.00 O ATOM 1199 CB GLU A 79 -3.903 -7.328 -4.832 1.00 0.00 C ATOM 1200 CG GLU A 79 -5.004 -6.445 -4.251 1.00 0.00 C ATOM 1201 CD GLU A 79 -6.351 -6.685 -4.905 1.00 0.00 C ATOM 1202 OE1 GLU A 79 -6.814 -7.845 -4.901 1.00 0.00 O ATOM 1203 OE2 GLU A 79 -6.941 -5.714 -5.422 1.00 0.00 O ATOM 0 H GLU A 79 -3.334 -6.135 -2.756 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.507 -8.763 -3.278 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -3.300 -6.739 -5.523 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -4.358 -8.132 -5.411 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.086 -6.631 -3.180 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -4.727 -5.398 -4.373 1.00 0.00 H new ATOM 1210 N SER A 80 -0.623 -7.756 -4.341 1.00 0.00 N ATOM 1211 CA SER A 80 0.643 -8.219 -4.890 1.00 0.00 C ATOM 1212 C SER A 80 1.811 -7.958 -3.930 1.00 0.00 C ATOM 1213 O SER A 80 2.933 -7.720 -4.375 1.00 0.00 O ATOM 1214 CB SER A 80 0.915 -7.536 -6.232 1.00 0.00 C ATOM 1215 OG SER A 80 -0.290 -7.304 -6.940 1.00 0.00 O ATOM 0 H SER A 80 -0.590 -6.824 -3.928 1.00 0.00 H new ATOM 0 HA SER A 80 0.563 -9.296 -5.035 1.00 0.00 H new ATOM 0 HB2 SER A 80 1.430 -6.590 -6.064 1.00 0.00 H new ATOM 0 HB3 SER A 80 1.579 -8.158 -6.832 1.00 0.00 H new ATOM 0 HG SER A 80 -0.089 -6.865 -7.793 1.00 0.00 H new ATOM 1221 N THR A 81 1.559 -8.004 -2.615 1.00 0.00 N ATOM 1222 CA THR A 81 2.623 -7.772 -1.640 1.00 0.00 C ATOM 1223 C THR A 81 3.634 -8.914 -1.643 1.00 0.00 C ATOM 1224 O THR A 81 4.779 -8.738 -1.227 1.00 0.00 O ATOM 1225 CB THR A 81 2.038 -7.610 -0.239 1.00 0.00 C ATOM 1226 OG1 THR A 81 3.060 -7.327 0.699 1.00 0.00 O ATOM 1227 CG2 THR A 81 1.300 -8.838 0.240 1.00 0.00 C ATOM 0 H THR A 81 0.643 -8.197 -2.211 1.00 0.00 H new ATOM 0 HA THR A 81 3.137 -6.854 -1.925 1.00 0.00 H new ATOM 0 HB THR A 81 1.330 -6.784 -0.310 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.297 -6.377 0.649 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.908 -8.660 1.241 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.475 -9.055 -0.439 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.983 -9.687 0.264 1.00 0.00 H new ATOM 1235 N GLY A 82 3.205 -10.084 -2.108 1.00 0.00 N ATOM 1236 CA GLY A 82 4.092 -11.234 -2.149 1.00 0.00 C ATOM 1237 C GLY A 82 5.452 -10.904 -2.735 1.00 0.00 C ATOM 1238 O GLY A 82 6.473 -11.414 -2.276 1.00 0.00 O ATOM 0 H GLY A 82 2.262 -10.256 -2.456 1.00 0.00 H new ATOM 0 HA2 GLY A 82 4.221 -11.624 -1.139 1.00 0.00 H new ATOM 0 HA3 GLY A 82 3.629 -12.024 -2.740 1.00 0.00 H new ATOM 1242 N ASP A 83 5.462 -10.046 -3.749 1.00 0.00 N ATOM 1243 CA ASP A 83 6.706 -9.647 -4.399 1.00 0.00 C ATOM 1244 C ASP A 83 7.499 -8.688 -3.515 1.00 0.00 C ATOM 1245 O ASP A 83 7.502 -7.479 -3.741 1.00 0.00 O ATOM 1246 CB ASP A 83 6.413 -8.991 -5.749 1.00 0.00 C ATOM 1247 CG ASP A 83 5.500 -9.836 -6.616 1.00 0.00 C ATOM 1248 OD1 ASP A 83 5.909 -10.952 -6.997 1.00 0.00 O ATOM 1249 OD2 ASP A 83 4.377 -9.380 -6.915 1.00 0.00 O ATOM 0 H ASP A 83 4.624 -9.614 -4.139 1.00 0.00 H new ATOM 0 HA ASP A 83 7.306 -10.543 -4.561 1.00 0.00 H new ATOM 0 HB2 ASP A 83 5.954 -8.016 -5.584 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.351 -8.816 -6.276 1.00 0.00 H new ATOM 1254 N PHE A 84 8.167 -9.238 -2.507 1.00 0.00 N ATOM 1255 CA PHE A 84 8.963 -8.433 -1.585 1.00 0.00 C ATOM 1256 C PHE A 84 10.121 -7.752 -2.303 1.00 0.00 C ATOM 1257 O PHE A 84 10.150 -6.528 -2.432 1.00 0.00 O ATOM 1258 CB PHE A 84 9.503 -9.306 -0.453 1.00 0.00 C ATOM 1259 CG PHE A 84 8.459 -9.752 0.535 1.00 0.00 C ATOM 1260 CD1 PHE A 84 7.257 -9.069 0.670 1.00 0.00 C ATOM 1261 CD2 PHE A 84 8.685 -10.858 1.334 1.00 0.00 C ATOM 1262 CE1 PHE A 84 6.306 -9.484 1.581 1.00 0.00 C ATOM 1263 CE2 PHE A 84 7.738 -11.277 2.248 1.00 0.00 C ATOM 1264 CZ PHE A 84 6.548 -10.589 2.372 1.00 0.00 C ATOM 0 H PHE A 84 8.174 -10.238 -2.307 1.00 0.00 H new ATOM 0 HA PHE A 84 8.314 -7.661 -1.171 1.00 0.00 H new ATOM 0 HB2 PHE A 84 9.979 -10.187 -0.884 1.00 0.00 H new ATOM 0 HB3 PHE A 84 10.278 -8.753 0.079 1.00 0.00 H new ATOM 0 HD1 PHE A 84 7.064 -8.203 0.055 1.00 0.00 H new ATOM 0 HD2 PHE A 84 9.614 -11.401 1.242 1.00 0.00 H new ATOM 0 HE1 PHE A 84 5.375 -8.945 1.674 1.00 0.00 H new ATOM 0 HE2 PHE A 84 7.929 -12.142 2.865 1.00 0.00 H new ATOM 0 HZ PHE A 84 5.807 -10.915 3.087 1.00 0.00 H new ATOM 1274 N ASN A 85 11.076 -8.551 -2.768 1.00 0.00 N ATOM 1275 CA ASN A 85 12.237 -8.019 -3.474 1.00 0.00 C ATOM 1276 C ASN A 85 11.813 -7.303 -4.750 1.00 0.00 C ATOM 1277 O ASN A 85 12.583 -6.530 -5.322 1.00 0.00 O ATOM 1278 CB ASN A 85 13.211 -9.146 -3.823 1.00 0.00 C ATOM 1279 CG ASN A 85 13.842 -9.780 -2.602 1.00 0.00 C ATOM 1280 OD1 ASN A 85 14.791 -9.244 -2.029 1.00 0.00 O ATOM 1281 ND2 ASN A 85 13.318 -10.931 -2.196 1.00 0.00 N ATOM 0 H ASN A 85 11.070 -9.566 -2.669 1.00 0.00 H new ATOM 0 HA ASN A 85 12.732 -7.305 -2.816 1.00 0.00 H new ATOM 0 HB2 ASN A 85 12.684 -9.912 -4.392 1.00 0.00 H new ATOM 0 HB3 ASN A 85 13.996 -8.753 -4.469 1.00 0.00 H new ATOM 0 HD21 ASN A 85 13.702 -11.406 -1.379 1.00 0.00 H new ATOM 0 HD22 ASN A 85 12.532 -11.340 -2.701 1.00 0.00 H new ATOM 1288 N GLY A 86 10.595 -7.578 -5.204 1.00 0.00 N ATOM 1289 CA GLY A 86 10.107 -6.964 -6.421 1.00 0.00 C ATOM 1290 C GLY A 86 10.641 -7.659 -7.658 1.00 0.00 C ATOM 1291 O GLY A 86 10.347 -7.253 -8.782 1.00 0.00 O ATOM 0 H GLY A 86 9.939 -8.214 -4.751 1.00 0.00 H new ATOM 0 HA2 GLY A 86 9.017 -6.992 -6.430 1.00 0.00 H new ATOM 0 HA3 GLY A 86 10.399 -5.914 -6.440 1.00 0.00 H new ATOM 1295 N ASN A 87 11.431 -8.714 -7.450 1.00 0.00 N ATOM 1296 CA ASN A 87 12.005 -9.463 -8.569 1.00 0.00 C ATOM 1297 C ASN A 87 10.962 -10.365 -9.228 1.00 0.00 C ATOM 1298 O ASN A 87 11.109 -10.746 -10.389 1.00 0.00 O ATOM 1299 CB ASN A 87 13.221 -10.299 -8.132 1.00 0.00 C ATOM 1300 CG ASN A 87 13.194 -10.702 -6.669 1.00 0.00 C ATOM 1301 OD1 ASN A 87 14.172 -10.511 -5.946 1.00 0.00 O ATOM 1302 ND2 ASN A 87 12.078 -11.268 -6.226 1.00 0.00 N ATOM 0 H ASN A 87 11.686 -9.066 -6.527 1.00 0.00 H new ATOM 0 HA ASN A 87 12.342 -8.727 -9.299 1.00 0.00 H new ATOM 0 HB2 ASN A 87 13.271 -11.198 -8.746 1.00 0.00 H new ATOM 0 HB3 ASN A 87 14.130 -9.730 -8.326 1.00 0.00 H new ATOM 0 HD21 ASN A 87 12.008 -11.563 -5.252 1.00 0.00 H new ATOM 0 HD22 ASN A 87 11.291 -11.408 -6.859 1.00 0.00 H new ATOM 1309 N GLY A 88 9.907 -10.698 -8.489 1.00 0.00 N ATOM 1310 CA GLY A 88 8.861 -11.544 -9.035 1.00 0.00 C ATOM 1311 C GLY A 88 8.975 -12.992 -8.595 1.00 0.00 C ATOM 1312 O GLY A 88 8.861 -13.904 -9.413 1.00 0.00 O ATOM 0 H GLY A 88 9.758 -10.398 -7.525 1.00 0.00 H new ATOM 0 HA2 GLY A 88 7.890 -11.153 -8.730 1.00 0.00 H new ATOM 0 HA3 GLY A 88 8.896 -11.498 -10.123 1.00 0.00 H new ATOM 1316 N LYS A 89 9.188 -13.207 -7.301 1.00 0.00 N ATOM 1317 CA LYS A 89 9.302 -14.556 -6.759 1.00 0.00 C ATOM 1318 C LYS A 89 9.019 -14.554 -5.261 1.00 0.00 C ATOM 1319 O LYS A 89 9.749 -13.943 -4.481 1.00 0.00 O ATOM 1320 CB LYS A 89 10.693 -15.135 -7.033 1.00 0.00 C ATOM 1321 CG LYS A 89 11.830 -14.230 -6.592 1.00 0.00 C ATOM 1322 CD LYS A 89 13.179 -14.912 -6.756 1.00 0.00 C ATOM 1323 CE LYS A 89 14.221 -14.317 -5.822 1.00 0.00 C ATOM 1324 NZ LYS A 89 15.496 -15.085 -5.851 1.00 0.00 N ATOM 0 H LYS A 89 9.285 -12.465 -6.608 1.00 0.00 H new ATOM 0 HA LYS A 89 8.563 -15.185 -7.255 1.00 0.00 H new ATOM 0 HB2 LYS A 89 10.785 -16.094 -6.522 1.00 0.00 H new ATOM 0 HB3 LYS A 89 10.791 -15.332 -8.101 1.00 0.00 H new ATOM 0 HG2 LYS A 89 11.812 -13.310 -7.177 1.00 0.00 H new ATOM 0 HG3 LYS A 89 11.688 -13.947 -5.549 1.00 0.00 H new ATOM 0 HD2 LYS A 89 13.076 -15.978 -6.555 1.00 0.00 H new ATOM 0 HD3 LYS A 89 13.515 -14.813 -7.788 1.00 0.00 H new ATOM 0 HE2 LYS A 89 14.414 -13.282 -6.105 1.00 0.00 H new ATOM 0 HE3 LYS A 89 13.830 -14.301 -4.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 16.180 -14.647 -5.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 15.317 -16.066 -5.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 15.883 -15.079 -6.816 1.00 0.00 H new ATOM 1338 N ILE A 90 7.948 -15.232 -4.867 1.00 0.00 N ATOM 1339 CA ILE A 90 7.562 -15.300 -3.463 1.00 0.00 C ATOM 1340 C ILE A 90 7.781 -16.700 -2.904 1.00 0.00 C ATOM 1341 O ILE A 90 7.010 -17.617 -3.185 1.00 0.00 O ATOM 1342 CB ILE A 90 6.082 -14.906 -3.253 1.00 0.00 C ATOM 1343 CG1 ILE A 90 5.565 -14.056 -4.420 1.00 0.00 C ATOM 1344 CG2 ILE A 90 5.918 -14.158 -1.939 1.00 0.00 C ATOM 1345 CD1 ILE A 90 6.455 -12.881 -4.764 1.00 0.00 C ATOM 0 H ILE A 90 7.332 -15.742 -5.499 1.00 0.00 H new ATOM 0 HA ILE A 90 8.195 -14.588 -2.932 1.00 0.00 H new ATOM 0 HB ILE A 90 5.490 -15.820 -3.215 1.00 0.00 H new ATOM 0 HG12 ILE A 90 5.461 -14.690 -5.300 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.570 -13.686 -4.174 1.00 0.00 H new ATOM 0 HG21 ILE A 90 4.871 -13.886 -1.803 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.237 -14.796 -1.115 1.00 0.00 H new ATOM 0 HG23 ILE A 90 6.528 -13.255 -1.956 1.00 0.00 H new ATOM 0 HD11 ILE A 90 6.022 -12.329 -5.598 1.00 0.00 H new ATOM 0 HD12 ILE A 90 6.540 -12.223 -3.899 1.00 0.00 H new ATOM 0 HD13 ILE A 90 7.444 -13.243 -5.043 1.00 0.00 H new ATOM 1357 N ASP A 91 8.833 -16.861 -2.110 1.00 0.00 N ATOM 1358 CA ASP A 91 9.140 -18.159 -1.518 1.00 0.00 C ATOM 1359 C ASP A 91 10.250 -18.052 -0.483 1.00 0.00 C ATOM 1360 O ASP A 91 10.059 -18.414 0.676 1.00 0.00 O ATOM 1361 CB ASP A 91 9.530 -19.159 -2.608 1.00 0.00 C ATOM 1362 CG ASP A 91 8.453 -20.197 -2.856 1.00 0.00 C ATOM 1363 OD1 ASP A 91 7.300 -19.970 -2.431 1.00 0.00 O ATOM 1364 OD2 ASP A 91 8.762 -21.237 -3.474 1.00 0.00 O ATOM 0 H ASP A 91 9.484 -16.116 -1.862 1.00 0.00 H new ATOM 0 HA ASP A 91 8.243 -18.514 -1.011 1.00 0.00 H new ATOM 0 HB2 ASP A 91 9.732 -18.621 -3.534 1.00 0.00 H new ATOM 0 HB3 ASP A 91 10.455 -19.661 -2.322 1.00 0.00 H new ATOM 1369 N ILE A 92 11.406 -17.558 -0.901 1.00 0.00 N ATOM 1370 CA ILE A 92 12.531 -17.415 0.010 1.00 0.00 C ATOM 1371 C ILE A 92 12.503 -16.059 0.698 1.00 0.00 C ATOM 1372 O ILE A 92 12.918 -15.925 1.849 1.00 0.00 O ATOM 1373 CB ILE A 92 13.879 -17.584 -0.709 1.00 0.00 C ATOM 1374 CG1 ILE A 92 15.012 -17.570 0.315 1.00 0.00 C ATOM 1375 CG2 ILE A 92 14.076 -16.492 -1.751 1.00 0.00 C ATOM 1376 CD1 ILE A 92 15.242 -18.912 0.969 1.00 0.00 C ATOM 0 H ILE A 92 11.589 -17.252 -1.857 1.00 0.00 H new ATOM 0 HA ILE A 92 12.432 -18.206 0.753 1.00 0.00 H new ATOM 0 HB ILE A 92 13.886 -18.542 -1.229 1.00 0.00 H new ATOM 0 HG12 ILE A 92 15.932 -17.250 -0.175 1.00 0.00 H new ATOM 0 HG13 ILE A 92 14.788 -16.832 1.085 1.00 0.00 H new ATOM 0 HG21 ILE A 92 15.036 -16.632 -2.247 1.00 0.00 H new ATOM 0 HG22 ILE A 92 13.275 -16.544 -2.489 1.00 0.00 H new ATOM 0 HG23 ILE A 92 14.057 -15.517 -1.264 1.00 0.00 H new ATOM 0 HD11 ILE A 92 16.060 -18.832 1.685 1.00 0.00 H new ATOM 0 HD12 ILE A 92 14.335 -19.224 1.487 1.00 0.00 H new ATOM 0 HD13 ILE A 92 15.497 -19.649 0.207 1.00 0.00 H new ATOM 1388 N GLY A 93 12.005 -15.056 -0.012 1.00 0.00 N ATOM 1389 CA GLY A 93 11.927 -13.727 0.554 1.00 0.00 C ATOM 1390 C GLY A 93 11.005 -13.668 1.757 1.00 0.00 C ATOM 1391 O GLY A 93 10.949 -12.655 2.453 1.00 0.00 O ATOM 0 H GLY A 93 11.655 -15.140 -0.966 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.925 -13.400 0.847 1.00 0.00 H new ATOM 0 HA3 GLY A 93 11.574 -13.031 -0.206 1.00 0.00 H new ATOM 1395 N ASP A 94 10.282 -14.758 2.002 1.00 0.00 N ATOM 1396 CA ASP A 94 9.362 -14.825 3.126 1.00 0.00 C ATOM 1397 C ASP A 94 10.119 -14.898 4.445 1.00 0.00 C ATOM 1398 O ASP A 94 9.767 -14.227 5.415 1.00 0.00 O ATOM 1399 CB ASP A 94 8.437 -16.039 2.982 1.00 0.00 C ATOM 1400 CG ASP A 94 9.157 -17.356 3.217 1.00 0.00 C ATOM 1401 OD1 ASP A 94 10.345 -17.459 2.848 1.00 0.00 O ATOM 1402 OD2 ASP A 94 8.529 -18.284 3.769 1.00 0.00 O ATOM 0 H ASP A 94 10.318 -15.605 1.435 1.00 0.00 H new ATOM 0 HA ASP A 94 8.759 -13.917 3.127 1.00 0.00 H new ATOM 0 HB2 ASP A 94 7.613 -15.949 3.690 1.00 0.00 H new ATOM 0 HB3 ASP A 94 8.000 -16.042 1.983 1.00 0.00 H new ATOM 1407 N LEU A 95 11.154 -15.729 4.475 1.00 0.00 N ATOM 1408 CA LEU A 95 11.957 -15.901 5.681 1.00 0.00 C ATOM 1409 C LEU A 95 13.367 -15.345 5.501 1.00 0.00 C ATOM 1410 O LEU A 95 14.315 -15.839 6.111 1.00 0.00 O ATOM 1411 CB LEU A 95 12.028 -17.382 6.060 1.00 0.00 C ATOM 1412 CG LEU A 95 12.653 -18.293 5.001 1.00 0.00 C ATOM 1413 CD1 LEU A 95 14.149 -18.434 5.235 1.00 0.00 C ATOM 1414 CD2 LEU A 95 11.980 -19.656 5.007 1.00 0.00 C ATOM 0 H LEU A 95 11.457 -16.293 3.681 1.00 0.00 H new ATOM 0 HA LEU A 95 11.474 -15.342 6.483 1.00 0.00 H new ATOM 0 HB2 LEU A 95 12.600 -17.478 6.983 1.00 0.00 H new ATOM 0 HB3 LEU A 95 11.019 -17.736 6.272 1.00 0.00 H new ATOM 0 HG LEU A 95 12.500 -17.839 4.022 1.00 0.00 H new ATOM 0 HD11 LEU A 95 14.577 -19.085 4.473 1.00 0.00 H new ATOM 0 HD12 LEU A 95 14.620 -17.453 5.180 1.00 0.00 H new ATOM 0 HD13 LEU A 95 14.324 -18.865 6.221 1.00 0.00 H new ATOM 0 HD21 LEU A 95 12.437 -20.291 4.248 1.00 0.00 H new ATOM 0 HD22 LEU A 95 12.102 -20.117 5.987 1.00 0.00 H new ATOM 0 HD23 LEU A 95 10.918 -19.538 4.790 1.00 0.00 H new ATOM 1426 N ALA A 96 13.508 -14.324 4.661 1.00 0.00 N ATOM 1427 CA ALA A 96 14.819 -13.731 4.419 1.00 0.00 C ATOM 1428 C ALA A 96 14.734 -12.263 3.995 1.00 0.00 C ATOM 1429 O ALA A 96 15.615 -11.470 4.323 1.00 0.00 O ATOM 1430 CB ALA A 96 15.566 -14.535 3.366 1.00 0.00 C ATOM 0 H ALA A 96 12.742 -13.895 4.143 1.00 0.00 H new ATOM 0 HA ALA A 96 15.363 -13.759 5.363 1.00 0.00 H new ATOM 0 HB1 ALA A 96 16.544 -14.086 3.191 1.00 0.00 H new ATOM 0 HB2 ALA A 96 15.695 -15.560 3.714 1.00 0.00 H new ATOM 0 HB3 ALA A 96 14.996 -14.536 2.437 1.00 0.00 H new ATOM 1436 N MET A 97 13.693 -11.905 3.249 1.00 0.00 N ATOM 1437 CA MET A 97 13.543 -10.532 2.775 1.00 0.00 C ATOM 1438 C MET A 97 12.766 -9.656 3.757 1.00 0.00 C ATOM 1439 O MET A 97 13.342 -8.802 4.429 1.00 0.00 O ATOM 1440 CB MET A 97 12.848 -10.512 1.411 1.00 0.00 C ATOM 1441 CG MET A 97 13.536 -9.632 0.379 1.00 0.00 C ATOM 1442 SD MET A 97 14.053 -8.033 1.035 1.00 0.00 S ATOM 1443 CE MET A 97 13.894 -7.012 -0.427 1.00 0.00 C ATOM 0 H MET A 97 12.947 -12.539 2.962 1.00 0.00 H new ATOM 0 HA MET A 97 14.548 -10.118 2.686 1.00 0.00 H new ATOM 0 HB2 MET A 97 12.795 -11.531 1.027 1.00 0.00 H new ATOM 0 HB3 MET A 97 11.823 -10.167 1.542 1.00 0.00 H new ATOM 0 HG2 MET A 97 14.408 -10.156 -0.011 1.00 0.00 H new ATOM 0 HG3 MET A 97 12.859 -9.471 -0.460 1.00 0.00 H new ATOM 0 HE1 MET A 97 13.702 -5.981 -0.131 1.00 0.00 H new ATOM 0 HE2 MET A 97 14.817 -7.058 -1.005 1.00 0.00 H new ATOM 0 HE3 MET A 97 13.066 -7.375 -1.036 1.00 0.00 H new ATOM 1453 N VAL A 98 11.451 -9.845 3.806 1.00 0.00 N ATOM 1454 CA VAL A 98 10.602 -9.041 4.674 1.00 0.00 C ATOM 1455 C VAL A 98 10.963 -9.169 6.152 1.00 0.00 C ATOM 1456 O VAL A 98 11.205 -8.163 6.816 1.00 0.00 O ATOM 1457 CB VAL A 98 9.103 -9.369 4.483 1.00 0.00 C ATOM 1458 CG1 VAL A 98 8.764 -10.767 4.985 1.00 0.00 C ATOM 1459 CG2 VAL A 98 8.250 -8.330 5.188 1.00 0.00 C ATOM 0 H VAL A 98 10.953 -10.545 3.257 1.00 0.00 H new ATOM 0 HA VAL A 98 10.784 -8.010 4.372 1.00 0.00 H new ATOM 0 HB VAL A 98 8.888 -9.345 3.415 1.00 0.00 H new ATOM 0 HG11 VAL A 98 7.702 -10.960 4.834 1.00 0.00 H new ATOM 0 HG12 VAL A 98 9.349 -11.503 4.434 1.00 0.00 H new ATOM 0 HG13 VAL A 98 8.998 -10.839 6.047 1.00 0.00 H new ATOM 0 HG21 VAL A 98 7.196 -8.569 5.048 1.00 0.00 H new ATOM 0 HG22 VAL A 98 8.484 -8.329 6.253 1.00 0.00 H new ATOM 0 HG23 VAL A 98 8.457 -7.345 4.770 1.00 0.00 H new ATOM 1469 N SER A 99 10.983 -10.392 6.677 1.00 0.00 N ATOM 1470 CA SER A 99 11.288 -10.594 8.089 1.00 0.00 C ATOM 1471 C SER A 99 12.701 -10.147 8.443 1.00 0.00 C ATOM 1472 O SER A 99 13.040 -10.035 9.621 1.00 0.00 O ATOM 1473 CB SER A 99 11.090 -12.052 8.494 1.00 0.00 C ATOM 1474 OG SER A 99 12.151 -12.866 8.026 1.00 0.00 O ATOM 0 H SER A 99 10.794 -11.247 6.153 1.00 0.00 H new ATOM 0 HA SER A 99 10.589 -9.972 8.648 1.00 0.00 H new ATOM 0 HB2 SER A 99 11.025 -12.124 9.580 1.00 0.00 H new ATOM 0 HB3 SER A 99 10.145 -12.418 8.093 1.00 0.00 H new ATOM 0 HG SER A 99 11.998 -13.794 8.302 1.00 0.00 H new ATOM 1480 N LYS A 100 13.523 -9.888 7.436 1.00 0.00 N ATOM 1481 CA LYS A 100 14.886 -9.451 7.688 1.00 0.00 C ATOM 1482 C LYS A 100 14.901 -8.023 8.203 1.00 0.00 C ATOM 1483 O LYS A 100 15.795 -7.633 8.954 1.00 0.00 O ATOM 1484 CB LYS A 100 15.741 -9.591 6.421 1.00 0.00 C ATOM 1485 CG LYS A 100 17.007 -8.739 6.416 1.00 0.00 C ATOM 1486 CD LYS A 100 16.752 -7.322 5.908 1.00 0.00 C ATOM 1487 CE LYS A 100 15.970 -7.313 4.604 1.00 0.00 C ATOM 1488 NZ LYS A 100 16.344 -6.161 3.738 1.00 0.00 N ATOM 0 H LYS A 100 13.274 -9.972 6.450 1.00 0.00 H new ATOM 0 HA LYS A 100 15.319 -10.091 8.457 1.00 0.00 H new ATOM 0 HB2 LYS A 100 16.022 -10.637 6.301 1.00 0.00 H new ATOM 0 HB3 LYS A 100 15.134 -9.323 5.556 1.00 0.00 H new ATOM 0 HG2 LYS A 100 17.414 -8.692 7.426 1.00 0.00 H new ATOM 0 HG3 LYS A 100 17.761 -9.217 5.790 1.00 0.00 H new ATOM 0 HD2 LYS A 100 16.203 -6.760 6.663 1.00 0.00 H new ATOM 0 HD3 LYS A 100 17.705 -6.813 5.762 1.00 0.00 H new ATOM 0 HE2 LYS A 100 16.150 -8.244 4.067 1.00 0.00 H new ATOM 0 HE3 LYS A 100 14.903 -7.272 4.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 16.223 -6.424 2.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 15.733 -5.348 3.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 17.337 -5.905 3.911 1.00 0.00 H new ATOM 1502 N ASN A 101 13.900 -7.251 7.814 1.00 0.00 N ATOM 1503 CA ASN A 101 13.800 -5.875 8.257 1.00 0.00 C ATOM 1504 C ASN A 101 12.997 -5.806 9.547 1.00 0.00 C ATOM 1505 O ASN A 101 13.468 -5.277 10.552 1.00 0.00 O ATOM 1506 CB ASN A 101 13.149 -5.000 7.180 1.00 0.00 C ATOM 1507 CG ASN A 101 13.382 -5.521 5.774 1.00 0.00 C ATOM 1508 OD1 ASN A 101 14.324 -5.112 5.096 1.00 0.00 O ATOM 1509 ND2 ASN A 101 12.520 -6.428 5.328 1.00 0.00 N ATOM 0 H ASN A 101 13.149 -7.554 7.194 1.00 0.00 H new ATOM 0 HA ASN A 101 14.805 -5.496 8.439 1.00 0.00 H new ATOM 0 HB2 ASN A 101 12.077 -4.941 7.367 1.00 0.00 H new ATOM 0 HB3 ASN A 101 13.542 -3.986 7.256 1.00 0.00 H new ATOM 0 HD21 ASN A 101 12.625 -6.813 4.389 1.00 0.00 H new ATOM 0 HD22 ASN A 101 11.753 -6.739 5.924 1.00 0.00 H new ATOM 1516 N ILE A 102 11.772 -6.338 9.498 1.00 0.00 N ATOM 1517 CA ILE A 102 10.865 -6.340 10.640 1.00 0.00 C ATOM 1518 C ILE A 102 10.976 -5.044 11.425 1.00 0.00 C ATOM 1519 O ILE A 102 11.886 -4.851 12.230 1.00 0.00 O ATOM 1520 CB ILE A 102 11.095 -7.549 11.573 1.00 0.00 C ATOM 1521 CG1 ILE A 102 10.838 -8.856 10.810 1.00 0.00 C ATOM 1522 CG2 ILE A 102 10.199 -7.460 12.808 1.00 0.00 C ATOM 1523 CD1 ILE A 102 9.370 -9.227 10.668 1.00 0.00 C ATOM 0 H ILE A 102 11.385 -6.778 8.663 1.00 0.00 H new ATOM 0 HA ILE A 102 9.856 -6.426 10.236 1.00 0.00 H new ATOM 0 HB ILE A 102 12.132 -7.537 11.910 1.00 0.00 H new ATOM 0 HG12 ILE A 102 11.276 -8.773 9.815 1.00 0.00 H new ATOM 0 HG13 ILE A 102 11.357 -9.668 11.320 1.00 0.00 H new ATOM 0 HG21 ILE A 102 10.378 -8.322 13.450 1.00 0.00 H new ATOM 0 HG22 ILE A 102 10.425 -6.545 13.356 1.00 0.00 H new ATOM 0 HG23 ILE A 102 9.154 -7.449 12.499 1.00 0.00 H new ATOM 0 HD11 ILE A 102 9.283 -10.163 10.116 1.00 0.00 H new ATOM 0 HD12 ILE A 102 8.928 -9.346 11.657 1.00 0.00 H new ATOM 0 HD13 ILE A 102 8.846 -8.438 10.129 1.00 0.00 H new ATOM 1535 N GLY A 103 10.032 -4.160 11.168 1.00 0.00 N ATOM 1536 CA GLY A 103 10.016 -2.873 11.835 1.00 0.00 C ATOM 1537 C GLY A 103 11.168 -2.000 11.384 1.00 0.00 C ATOM 1538 O GLY A 103 11.709 -1.214 12.161 1.00 0.00 O ATOM 0 H GLY A 103 9.270 -4.308 10.506 1.00 0.00 H new ATOM 0 HA2 GLY A 103 9.073 -2.367 11.629 1.00 0.00 H new ATOM 0 HA3 GLY A 103 10.070 -3.020 12.914 1.00 0.00 H new ATOM 1542 N SER A 104 11.548 -2.155 10.120 1.00 0.00 N ATOM 1543 CA SER A 104 12.652 -1.396 9.541 1.00 0.00 C ATOM 1544 C SER A 104 12.435 0.108 9.682 1.00 0.00 C ATOM 1545 O SER A 104 13.367 0.852 9.989 1.00 0.00 O ATOM 1546 CB SER A 104 12.818 -1.768 8.066 1.00 0.00 C ATOM 1547 OG SER A 104 12.243 -0.790 7.218 1.00 0.00 O ATOM 0 H SER A 104 11.104 -2.805 9.472 1.00 0.00 H new ATOM 0 HA SER A 104 13.560 -1.652 10.087 1.00 0.00 H new ATOM 0 HB2 SER A 104 13.877 -1.876 7.833 1.00 0.00 H new ATOM 0 HB3 SER A 104 12.351 -2.735 7.878 1.00 0.00 H new ATOM 0 HG SER A 104 11.363 -1.096 6.916 1.00 0.00 H new ATOM 1553 N THR A 105 11.205 0.553 9.444 1.00 0.00 N ATOM 1554 CA THR A 105 10.871 1.972 9.532 1.00 0.00 C ATOM 1555 C THR A 105 11.443 2.732 8.340 1.00 0.00 C ATOM 1556 O THR A 105 11.896 3.870 8.473 1.00 0.00 O ATOM 1557 CB THR A 105 11.393 2.573 10.840 1.00 0.00 C ATOM 1558 OG1 THR A 105 11.584 1.565 11.817 1.00 0.00 O ATOM 1559 CG2 THR A 105 10.465 3.613 11.430 1.00 0.00 C ATOM 0 H THR A 105 10.422 -0.049 9.188 1.00 0.00 H new ATOM 0 HA THR A 105 9.785 2.065 9.518 1.00 0.00 H new ATOM 0 HB THR A 105 12.337 3.053 10.581 1.00 0.00 H new ATOM 0 HG1 THR A 105 11.919 1.970 12.644 1.00 0.00 H new ATOM 0 HG21 THR A 105 10.893 3.999 12.355 1.00 0.00 H new ATOM 0 HG22 THR A 105 10.337 4.430 10.720 1.00 0.00 H new ATOM 0 HG23 THR A 105 9.496 3.159 11.640 1.00 0.00 H new ATOM 1567 N THR A 106 11.416 2.093 7.175 1.00 0.00 N ATOM 1568 CA THR A 106 11.930 2.701 5.952 1.00 0.00 C ATOM 1569 C THR A 106 11.751 1.760 4.765 1.00 0.00 C ATOM 1570 O THR A 106 11.411 2.190 3.662 1.00 0.00 O ATOM 1571 CB THR A 106 13.408 3.060 6.115 1.00 0.00 C ATOM 1572 OG1 THR A 106 13.975 3.429 4.870 1.00 0.00 O ATOM 1573 CG2 THR A 106 14.239 1.929 6.681 1.00 0.00 C ATOM 0 H THR A 106 11.043 1.152 7.052 1.00 0.00 H new ATOM 0 HA THR A 106 11.363 3.613 5.762 1.00 0.00 H new ATOM 0 HB THR A 106 13.427 3.892 6.819 1.00 0.00 H new ATOM 0 HG1 THR A 106 14.920 3.656 4.995 1.00 0.00 H new ATOM 0 HG21 THR A 106 15.277 2.250 6.771 1.00 0.00 H new ATOM 0 HG22 THR A 106 13.858 1.654 7.664 1.00 0.00 H new ATOM 0 HG23 THR A 106 14.182 1.067 6.016 1.00 0.00 H new ATOM 1581 N ASN A 107 11.982 0.472 4.999 1.00 0.00 N ATOM 1582 CA ASN A 107 11.847 -0.535 3.953 1.00 0.00 C ATOM 1583 C ASN A 107 10.384 -0.919 3.749 1.00 0.00 C ATOM 1584 O ASN A 107 10.001 -2.074 3.930 1.00 0.00 O ATOM 1585 CB ASN A 107 12.672 -1.777 4.303 1.00 0.00 C ATOM 1586 CG ASN A 107 12.824 -2.720 3.126 1.00 0.00 C ATOM 1587 OD1 ASN A 107 13.626 -2.481 2.223 1.00 0.00 O ATOM 1588 ND2 ASN A 107 12.052 -3.801 3.130 1.00 0.00 N ATOM 0 H ASN A 107 12.264 0.101 5.906 1.00 0.00 H new ATOM 0 HA ASN A 107 12.222 -0.109 3.022 1.00 0.00 H new ATOM 0 HB2 ASN A 107 13.659 -1.469 4.648 1.00 0.00 H new ATOM 0 HB3 ASN A 107 12.196 -2.305 5.129 1.00 0.00 H new ATOM 0 HD21 ASN A 107 12.110 -4.472 2.364 1.00 0.00 H new ATOM 0 HD22 ASN A 107 11.401 -3.960 3.899 1.00 0.00 H new ATOM 1595 N THR A 108 9.573 0.062 3.369 1.00 0.00 N ATOM 1596 CA THR A 108 8.149 -0.161 3.134 1.00 0.00 C ATOM 1597 C THR A 108 7.899 -0.747 1.744 1.00 0.00 C ATOM 1598 O THR A 108 6.757 -1.002 1.363 1.00 0.00 O ATOM 1599 CB THR A 108 7.383 1.154 3.288 1.00 0.00 C ATOM 1600 OG1 THR A 108 7.652 1.748 4.546 1.00 0.00 O ATOM 1601 CG2 THR A 108 5.883 0.993 3.168 1.00 0.00 C ATOM 0 H THR A 108 9.878 1.023 3.216 1.00 0.00 H new ATOM 0 HA THR A 108 7.794 -0.879 3.873 1.00 0.00 H new ATOM 0 HB THR A 108 7.730 1.786 2.470 1.00 0.00 H new ATOM 0 HG1 THR A 108 7.154 2.588 4.624 1.00 0.00 H new ATOM 0 HG21 THR A 108 5.402 1.964 3.287 1.00 0.00 H new ATOM 0 HG22 THR A 108 5.638 0.585 2.187 1.00 0.00 H new ATOM 0 HG23 THR A 108 5.527 0.314 3.943 1.00 0.00 H new ATOM 1609 N SER A 109 8.972 -0.941 0.983 1.00 0.00 N ATOM 1610 CA SER A 109 8.871 -1.472 -0.371 1.00 0.00 C ATOM 1611 C SER A 109 8.310 -2.895 -0.408 1.00 0.00 C ATOM 1612 O SER A 109 7.973 -3.393 -1.481 1.00 0.00 O ATOM 1613 CB SER A 109 10.242 -1.443 -1.047 1.00 0.00 C ATOM 1614 OG SER A 109 10.659 -0.113 -1.300 1.00 0.00 O ATOM 0 H SER A 109 9.925 -0.737 1.283 1.00 0.00 H new ATOM 0 HA SER A 109 8.171 -0.834 -0.911 1.00 0.00 H new ATOM 0 HB2 SER A 109 10.974 -1.942 -0.412 1.00 0.00 H new ATOM 0 HB3 SER A 109 10.201 -1.999 -1.984 1.00 0.00 H new ATOM 0 HG SER A 109 11.539 -0.122 -1.731 1.00 0.00 H new ATOM 1620 N LEU A 110 8.215 -3.562 0.744 1.00 0.00 N ATOM 1621 CA LEU A 110 7.698 -4.930 0.759 1.00 0.00 C ATOM 1622 C LEU A 110 6.968 -5.284 2.054 1.00 0.00 C ATOM 1623 O LEU A 110 7.080 -6.410 2.539 1.00 0.00 O ATOM 1624 CB LEU A 110 8.830 -5.931 0.522 1.00 0.00 C ATOM 1625 CG LEU A 110 10.056 -5.782 1.429 1.00 0.00 C ATOM 1626 CD1 LEU A 110 9.722 -6.156 2.870 1.00 0.00 C ATOM 1627 CD2 LEU A 110 11.194 -6.646 0.906 1.00 0.00 C ATOM 0 H LEU A 110 8.481 -3.189 1.655 1.00 0.00 H new ATOM 0 HA LEU A 110 6.969 -4.988 -0.049 1.00 0.00 H new ATOM 0 HB2 LEU A 110 8.431 -6.938 0.646 1.00 0.00 H new ATOM 0 HB3 LEU A 110 9.156 -5.843 -0.514 1.00 0.00 H new ATOM 0 HG LEU A 110 10.367 -4.737 1.419 1.00 0.00 H new ATOM 0 HD11 LEU A 110 10.610 -6.041 3.491 1.00 0.00 H new ATOM 0 HD12 LEU A 110 8.932 -5.503 3.242 1.00 0.00 H new ATOM 0 HD13 LEU A 110 9.384 -7.192 2.908 1.00 0.00 H new ATOM 0 HD21 LEU A 110 12.063 -6.536 1.555 1.00 0.00 H new ATOM 0 HD22 LEU A 110 10.881 -7.690 0.892 1.00 0.00 H new ATOM 0 HD23 LEU A 110 11.454 -6.332 -0.105 1.00 0.00 H new ATOM 1639 N ASP A 111 6.197 -4.351 2.604 1.00 0.00 N ATOM 1640 CA ASP A 111 5.458 -4.625 3.814 1.00 0.00 C ATOM 1641 C ASP A 111 3.986 -4.824 3.480 1.00 0.00 C ATOM 1642 O ASP A 111 3.323 -3.899 3.014 1.00 0.00 O ATOM 1643 CB ASP A 111 5.622 -3.477 4.818 1.00 0.00 C ATOM 1644 CG ASP A 111 7.040 -2.939 4.895 1.00 0.00 C ATOM 1645 OD1 ASP A 111 7.881 -3.342 4.064 1.00 0.00 O ATOM 1646 OD2 ASP A 111 7.309 -2.111 5.791 1.00 0.00 O ATOM 0 H ASP A 111 6.073 -3.410 2.230 1.00 0.00 H new ATOM 0 HA ASP A 111 5.850 -5.535 4.268 1.00 0.00 H new ATOM 0 HB2 ASP A 111 4.948 -2.665 4.543 1.00 0.00 H new ATOM 0 HB3 ASP A 111 5.319 -3.823 5.806 1.00 0.00 H new ATOM 1651 N LEU A 112 3.475 -6.029 3.731 1.00 0.00 N ATOM 1652 CA LEU A 112 2.066 -6.338 3.472 1.00 0.00 C ATOM 1653 C LEU A 112 1.188 -5.172 3.911 1.00 0.00 C ATOM 1654 O LEU A 112 0.145 -4.888 3.323 1.00 0.00 O ATOM 1655 CB LEU A 112 1.657 -7.583 4.260 1.00 0.00 C ATOM 1656 CG LEU A 112 1.934 -8.927 3.585 1.00 0.00 C ATOM 1657 CD1 LEU A 112 3.388 -9.031 3.149 1.00 0.00 C ATOM 1658 CD2 LEU A 112 1.567 -10.089 4.510 1.00 0.00 C ATOM 0 H LEU A 112 4.013 -6.807 4.113 1.00 0.00 H new ATOM 0 HA LEU A 112 1.938 -6.514 2.404 1.00 0.00 H new ATOM 0 HB2 LEU A 112 2.175 -7.568 5.219 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.590 -7.519 4.473 1.00 0.00 H new ATOM 0 HG LEU A 112 1.308 -8.987 2.695 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.557 -9.997 2.672 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.614 -8.233 2.442 1.00 0.00 H new ATOM 0 HD13 LEU A 112 4.037 -8.938 4.020 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.773 -11.034 4.007 1.00 0.00 H new ATOM 0 HD22 LEU A 112 2.159 -10.028 5.423 1.00 0.00 H new ATOM 0 HD23 LEU A 112 0.507 -10.035 4.760 1.00 0.00 H new ATOM 1670 N ASN A 113 1.639 -4.526 4.973 1.00 0.00 N ATOM 1671 CA ASN A 113 0.949 -3.397 5.574 1.00 0.00 C ATOM 1672 C ASN A 113 1.477 -2.063 5.064 1.00 0.00 C ATOM 1673 O ASN A 113 0.782 -1.051 5.120 1.00 0.00 O ATOM 1674 CB ASN A 113 1.168 -3.453 7.077 1.00 0.00 C ATOM 1675 CG ASN A 113 -0.109 -3.702 7.855 1.00 0.00 C ATOM 1676 OD1 ASN A 113 -0.306 -3.149 8.937 1.00 0.00 O ATOM 1677 ND2 ASN A 113 -0.982 -4.543 7.313 1.00 0.00 N ATOM 0 H ASN A 113 2.507 -4.774 5.448 1.00 0.00 H new ATOM 0 HA ASN A 113 -0.107 -3.465 5.311 1.00 0.00 H new ATOM 0 HB2 ASN A 113 1.885 -4.242 7.305 1.00 0.00 H new ATOM 0 HB3 ASN A 113 1.611 -2.514 7.409 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -1.856 -4.752 7.796 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -0.779 -4.980 6.414 1.00 0.00 H new ATOM 1684 N LYS A 114 2.728 -2.058 4.623 1.00 0.00 N ATOM 1685 CA LYS A 114 3.378 -0.835 4.162 1.00 0.00 C ATOM 1686 C LYS A 114 3.111 0.284 5.158 1.00 0.00 C ATOM 1687 O LYS A 114 3.004 1.454 4.793 1.00 0.00 O ATOM 1688 CB LYS A 114 2.928 -0.433 2.747 1.00 0.00 C ATOM 1689 CG LYS A 114 1.426 -0.477 2.510 1.00 0.00 C ATOM 1690 CD LYS A 114 0.730 0.763 3.049 1.00 0.00 C ATOM 1691 CE LYS A 114 1.137 2.011 2.279 1.00 0.00 C ATOM 1692 NZ LYS A 114 1.428 3.154 3.187 1.00 0.00 N ATOM 0 H LYS A 114 3.316 -2.890 4.574 1.00 0.00 H new ATOM 0 HA LYS A 114 4.450 -1.022 4.103 1.00 0.00 H new ATOM 0 HB2 LYS A 114 3.283 0.577 2.543 1.00 0.00 H new ATOM 0 HB3 LYS A 114 3.413 -1.092 2.027 1.00 0.00 H new ATOM 0 HG2 LYS A 114 1.230 -0.568 1.442 1.00 0.00 H new ATOM 0 HG3 LYS A 114 1.009 -1.364 2.987 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -0.350 0.631 2.986 1.00 0.00 H new ATOM 0 HD3 LYS A 114 0.975 0.889 4.104 1.00 0.00 H new ATOM 0 HE2 LYS A 114 2.018 1.794 1.675 1.00 0.00 H new ATOM 0 HE3 LYS A 114 0.339 2.289 1.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 1.685 3.989 2.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 0.585 3.368 3.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 2.218 2.905 3.816 1.00 0.00 H new ATOM 1706 N ASP A 115 3.004 -0.101 6.433 1.00 0.00 N ATOM 1707 CA ASP A 115 2.745 0.851 7.501 1.00 0.00 C ATOM 1708 C ASP A 115 4.049 1.459 8.020 1.00 0.00 C ATOM 1709 O ASP A 115 4.035 2.279 8.938 1.00 0.00 O ATOM 1710 CB ASP A 115 1.978 0.167 8.642 1.00 0.00 C ATOM 1711 CG ASP A 115 1.708 1.104 9.803 1.00 0.00 C ATOM 1712 OD1 ASP A 115 2.589 1.236 10.678 1.00 0.00 O ATOM 1713 OD2 ASP A 115 0.615 1.707 9.837 1.00 0.00 O ATOM 0 H ASP A 115 3.094 -1.068 6.744 1.00 0.00 H new ATOM 0 HA ASP A 115 2.134 1.660 7.101 1.00 0.00 H new ATOM 0 HB2 ASP A 115 1.031 -0.216 8.261 1.00 0.00 H new ATOM 0 HB3 ASP A 115 2.549 -0.691 8.997 1.00 0.00 H new ATOM 1718 N GLY A 116 5.174 1.058 7.426 1.00 0.00 N ATOM 1719 CA GLY A 116 6.459 1.588 7.847 1.00 0.00 C ATOM 1720 C GLY A 116 7.117 0.745 8.922 1.00 0.00 C ATOM 1721 O GLY A 116 7.828 1.265 9.779 1.00 0.00 O ATOM 0 H GLY A 116 5.216 0.380 6.665 1.00 0.00 H new ATOM 0 HA2 GLY A 116 7.122 1.651 6.984 1.00 0.00 H new ATOM 0 HA3 GLY A 116 6.324 2.603 8.219 1.00 0.00 H new ATOM 1725 N SER A 117 6.875 -0.559 8.878 1.00 0.00 N ATOM 1726 CA SER A 117 7.450 -1.477 9.855 1.00 0.00 C ATOM 1727 C SER A 117 7.054 -2.899 9.554 1.00 0.00 C ATOM 1728 O SER A 117 5.901 -3.286 9.747 1.00 0.00 O ATOM 1729 CB SER A 117 6.985 -1.123 11.271 1.00 0.00 C ATOM 1730 OG SER A 117 7.881 -0.222 11.900 1.00 0.00 O ATOM 0 H SER A 117 6.284 -1.006 8.176 1.00 0.00 H new ATOM 0 HA SER A 117 8.534 -1.383 9.793 1.00 0.00 H new ATOM 0 HB2 SER A 117 5.990 -0.679 11.229 1.00 0.00 H new ATOM 0 HB3 SER A 117 6.903 -2.032 11.867 1.00 0.00 H new ATOM 0 HG SER A 117 8.238 0.402 11.234 1.00 0.00 H new ATOM 1736 N ILE A 118 8.014 -3.691 9.116 1.00 0.00 N ATOM 1737 CA ILE A 118 7.737 -5.077 8.842 1.00 0.00 C ATOM 1738 C ILE A 118 7.394 -5.770 10.142 1.00 0.00 C ATOM 1739 O ILE A 118 8.235 -5.969 11.014 1.00 0.00 O ATOM 1740 CB ILE A 118 8.910 -5.782 8.129 1.00 0.00 C ATOM 1741 CG1 ILE A 118 8.916 -5.388 6.656 1.00 0.00 C ATOM 1742 CG2 ILE A 118 8.804 -7.298 8.273 1.00 0.00 C ATOM 1743 CD1 ILE A 118 7.564 -5.550 6.002 1.00 0.00 C ATOM 0 H ILE A 118 8.977 -3.399 8.946 1.00 0.00 H new ATOM 0 HA ILE A 118 6.891 -5.133 8.157 1.00 0.00 H new ATOM 0 HB ILE A 118 9.845 -5.467 8.593 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.238 -4.351 6.563 1.00 0.00 H new ATOM 0 HG13 ILE A 118 9.647 -5.997 6.124 1.00 0.00 H new ATOM 0 HG21 ILE A 118 9.642 -7.772 7.762 1.00 0.00 H new ATOM 0 HG22 ILE A 118 8.825 -7.565 9.329 1.00 0.00 H new ATOM 0 HG23 ILE A 118 7.869 -7.641 7.831 1.00 0.00 H new ATOM 0 HD11 ILE A 118 7.629 -5.255 4.955 1.00 0.00 H new ATOM 0 HD12 ILE A 118 7.251 -6.592 6.067 1.00 0.00 H new ATOM 0 HD13 ILE A 118 6.835 -4.920 6.512 1.00 0.00 H new ATOM 1755 N ASP A 119 6.135 -6.089 10.279 1.00 0.00 N ATOM 1756 CA ASP A 119 5.652 -6.723 11.500 1.00 0.00 C ATOM 1757 C ASP A 119 4.787 -7.954 11.215 1.00 0.00 C ATOM 1758 O ASP A 119 5.014 -8.675 10.244 1.00 0.00 O ATOM 1759 CB ASP A 119 4.889 -5.697 12.340 1.00 0.00 C ATOM 1760 CG ASP A 119 5.115 -5.882 13.828 1.00 0.00 C ATOM 1761 OD1 ASP A 119 6.242 -6.254 14.216 1.00 0.00 O ATOM 1762 OD2 ASP A 119 4.164 -5.655 14.606 1.00 0.00 O ATOM 0 H ASP A 119 5.420 -5.926 9.570 1.00 0.00 H new ATOM 0 HA ASP A 119 6.517 -7.079 12.060 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.199 -4.693 12.051 1.00 0.00 H new ATOM 0 HB3 ASP A 119 3.823 -5.776 12.125 1.00 0.00 H new ATOM 1767 N GLU A 120 3.812 -8.202 12.086 1.00 0.00 N ATOM 1768 CA GLU A 120 2.928 -9.360 11.945 1.00 0.00 C ATOM 1769 C GLU A 120 1.982 -9.211 10.755 1.00 0.00 C ATOM 1770 O GLU A 120 1.323 -10.170 10.354 1.00 0.00 O ATOM 1771 CB GLU A 120 2.123 -9.568 13.230 1.00 0.00 C ATOM 1772 CG GLU A 120 2.687 -10.659 14.126 1.00 0.00 C ATOM 1773 CD GLU A 120 2.772 -10.235 15.579 1.00 0.00 C ATOM 1774 OE1 GLU A 120 3.638 -9.394 15.903 1.00 0.00 O ATOM 1775 OE2 GLU A 120 1.975 -10.743 16.394 1.00 0.00 O ATOM 0 H GLU A 120 3.613 -7.617 12.898 1.00 0.00 H new ATOM 0 HA GLU A 120 3.555 -10.233 11.763 1.00 0.00 H new ATOM 0 HB2 GLU A 120 2.092 -8.631 13.786 1.00 0.00 H new ATOM 0 HB3 GLU A 120 1.095 -9.818 12.969 1.00 0.00 H new ATOM 0 HG2 GLU A 120 2.062 -11.548 14.047 1.00 0.00 H new ATOM 0 HG3 GLU A 120 3.681 -10.936 13.774 1.00 0.00 H new ATOM 1782 N TYR A 121 1.921 -8.012 10.191 1.00 0.00 N ATOM 1783 CA TYR A 121 1.060 -7.747 9.045 1.00 0.00 C ATOM 1784 C TYR A 121 1.718 -8.222 7.752 1.00 0.00 C ATOM 1785 O TYR A 121 1.048 -8.395 6.738 1.00 0.00 O ATOM 1786 CB TYR A 121 0.738 -6.250 8.938 1.00 0.00 C ATOM 1787 CG TYR A 121 1.281 -5.404 10.073 1.00 0.00 C ATOM 1788 CD1 TYR A 121 0.711 -5.458 11.339 1.00 0.00 C ATOM 1789 CD2 TYR A 121 2.362 -4.554 9.877 1.00 0.00 C ATOM 1790 CE1 TYR A 121 1.202 -4.688 12.377 1.00 0.00 C ATOM 1791 CE2 TYR A 121 2.860 -3.781 10.909 1.00 0.00 C ATOM 1792 CZ TYR A 121 2.276 -3.851 12.156 1.00 0.00 C ATOM 1793 OH TYR A 121 2.767 -3.082 13.187 1.00 0.00 O ATOM 0 H TYR A 121 2.459 -7.206 10.509 1.00 0.00 H new ATOM 0 HA TYR A 121 0.132 -8.298 9.194 1.00 0.00 H new ATOM 0 HB2 TYR A 121 1.138 -5.872 7.997 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.344 -6.127 8.896 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -0.130 -6.113 11.515 1.00 0.00 H new ATOM 0 HD2 TYR A 121 2.821 -4.496 8.901 1.00 0.00 H new ATOM 0 HE1 TYR A 121 0.747 -4.741 13.355 1.00 0.00 H new ATOM 0 HE2 TYR A 121 3.702 -3.126 10.740 1.00 0.00 H new ATOM 0 HH TYR A 121 3.267 -3.650 13.809 1.00 0.00 H new ATOM 1803 N GLU A 122 3.035 -8.417 7.804 1.00 0.00 N ATOM 1804 CA GLU A 122 3.812 -8.857 6.641 1.00 0.00 C ATOM 1805 C GLU A 122 3.948 -10.376 6.585 1.00 0.00 C ATOM 1806 O GLU A 122 4.258 -10.946 5.539 1.00 0.00 O ATOM 1807 CB GLU A 122 5.207 -8.227 6.663 1.00 0.00 C ATOM 1808 CG GLU A 122 5.336 -7.055 7.619 1.00 0.00 C ATOM 1809 CD GLU A 122 4.547 -5.840 7.172 1.00 0.00 C ATOM 1810 OE1 GLU A 122 3.707 -5.981 6.260 1.00 0.00 O ATOM 1811 OE2 GLU A 122 4.765 -4.749 7.740 1.00 0.00 O ATOM 0 H GLU A 122 3.592 -8.276 8.647 1.00 0.00 H new ATOM 0 HA GLU A 122 3.270 -8.530 5.753 1.00 0.00 H new ATOM 0 HB2 GLU A 122 5.935 -8.990 6.938 1.00 0.00 H new ATOM 0 HB3 GLU A 122 5.460 -7.893 5.657 1.00 0.00 H new ATOM 0 HG2 GLU A 122 4.994 -7.360 8.608 1.00 0.00 H new ATOM 0 HG3 GLU A 122 6.388 -6.784 7.714 1.00 0.00 H new ATOM 1818 N ILE A 123 3.730 -11.018 7.719 1.00 0.00 N ATOM 1819 CA ILE A 123 3.842 -12.469 7.819 1.00 0.00 C ATOM 1820 C ILE A 123 2.491 -13.151 7.646 1.00 0.00 C ATOM 1821 O ILE A 123 2.410 -14.259 7.117 1.00 0.00 O ATOM 1822 CB ILE A 123 4.440 -12.900 9.176 1.00 0.00 C ATOM 1823 CG1 ILE A 123 5.520 -11.914 9.629 1.00 0.00 C ATOM 1824 CG2 ILE A 123 5.007 -14.308 9.080 1.00 0.00 C ATOM 1825 CD1 ILE A 123 6.745 -11.907 8.743 1.00 0.00 C ATOM 0 H ILE A 123 3.472 -10.557 8.591 1.00 0.00 H new ATOM 0 HA ILE A 123 4.508 -12.779 7.014 1.00 0.00 H new ATOM 0 HB ILE A 123 3.644 -12.897 9.920 1.00 0.00 H new ATOM 0 HG12 ILE A 123 5.096 -10.910 9.655 1.00 0.00 H new ATOM 0 HG13 ILE A 123 5.820 -12.160 10.648 1.00 0.00 H new ATOM 0 HG21 ILE A 123 5.425 -14.598 10.044 1.00 0.00 H new ATOM 0 HG22 ILE A 123 4.213 -15.002 8.805 1.00 0.00 H new ATOM 0 HG23 ILE A 123 5.790 -14.334 8.322 1.00 0.00 H new ATOM 0 HD11 ILE A 123 7.466 -11.185 9.125 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.194 -12.900 8.736 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.458 -11.631 7.728 1.00 0.00 H new ATOM 1837 N SER A 124 1.435 -12.487 8.109 1.00 0.00 N ATOM 1838 CA SER A 124 0.074 -13.022 8.030 1.00 0.00 C ATOM 1839 C SER A 124 -0.159 -13.818 6.745 1.00 0.00 C ATOM 1840 O SER A 124 -0.728 -14.909 6.777 1.00 0.00 O ATOM 1841 CB SER A 124 -0.943 -11.884 8.123 1.00 0.00 C ATOM 1842 OG SER A 124 -1.389 -11.707 9.457 1.00 0.00 O ATOM 0 H SER A 124 1.495 -11.568 8.547 1.00 0.00 H new ATOM 0 HA SER A 124 -0.056 -13.704 8.870 1.00 0.00 H new ATOM 0 HB2 SER A 124 -0.493 -10.960 7.761 1.00 0.00 H new ATOM 0 HB3 SER A 124 -1.794 -12.099 7.477 1.00 0.00 H new ATOM 0 HG SER A 124 -2.145 -11.084 9.469 1.00 0.00 H new ATOM 1848 N PHE A 125 0.274 -13.265 5.618 1.00 0.00 N ATOM 1849 CA PHE A 125 0.100 -13.925 4.329 1.00 0.00 C ATOM 1850 C PHE A 125 1.326 -14.755 3.956 1.00 0.00 C ATOM 1851 O PHE A 125 1.205 -15.819 3.347 1.00 0.00 O ATOM 1852 CB PHE A 125 -0.179 -12.886 3.244 1.00 0.00 C ATOM 1853 CG PHE A 125 -0.327 -13.469 1.867 1.00 0.00 C ATOM 1854 CD1 PHE A 125 -1.454 -14.201 1.527 1.00 0.00 C ATOM 1855 CD2 PHE A 125 0.660 -13.282 0.912 1.00 0.00 C ATOM 1856 CE1 PHE A 125 -1.593 -14.736 0.261 1.00 0.00 C ATOM 1857 CE2 PHE A 125 0.526 -13.815 -0.356 1.00 0.00 C ATOM 1858 CZ PHE A 125 -0.602 -14.542 -0.682 1.00 0.00 C ATOM 0 H PHE A 125 0.747 -12.363 5.570 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.750 -14.602 4.410 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -1.090 -12.345 3.499 1.00 0.00 H new ATOM 0 HB3 PHE A 125 0.632 -12.158 3.235 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.232 -14.355 2.260 1.00 0.00 H new ATOM 0 HD2 PHE A 125 1.544 -12.713 1.162 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -2.475 -15.305 0.009 1.00 0.00 H new ATOM 0 HE2 PHE A 125 1.303 -13.663 -1.091 1.00 0.00 H new ATOM 0 HZ PHE A 125 -0.709 -14.958 -1.673 1.00 0.00 H new ATOM 1868 N ILE A 126 2.502 -14.254 4.310 1.00 0.00 N ATOM 1869 CA ILE A 126 3.752 -14.937 3.999 1.00 0.00 C ATOM 1870 C ILE A 126 3.951 -16.191 4.854 1.00 0.00 C ATOM 1871 O ILE A 126 4.878 -16.966 4.620 1.00 0.00 O ATOM 1872 CB ILE A 126 4.958 -13.978 4.157 1.00 0.00 C ATOM 1873 CG1 ILE A 126 5.866 -14.072 2.931 1.00 0.00 C ATOM 1874 CG2 ILE A 126 5.745 -14.267 5.433 1.00 0.00 C ATOM 1875 CD1 ILE A 126 5.385 -13.246 1.759 1.00 0.00 C ATOM 0 H ILE A 126 2.617 -13.375 4.814 1.00 0.00 H new ATOM 0 HA ILE A 126 3.691 -15.257 2.959 1.00 0.00 H new ATOM 0 HB ILE A 126 4.572 -12.962 4.237 1.00 0.00 H new ATOM 0 HG12 ILE A 126 6.870 -13.748 3.206 1.00 0.00 H new ATOM 0 HG13 ILE A 126 5.941 -15.115 2.624 1.00 0.00 H new ATOM 0 HG21 ILE A 126 6.583 -13.574 5.508 1.00 0.00 H new ATOM 0 HG22 ILE A 126 5.093 -14.144 6.298 1.00 0.00 H new ATOM 0 HG23 ILE A 126 6.121 -15.290 5.405 1.00 0.00 H new ATOM 0 HD11 ILE A 126 6.077 -13.360 0.925 1.00 0.00 H new ATOM 0 HD12 ILE A 126 4.394 -13.585 1.457 1.00 0.00 H new ATOM 0 HD13 ILE A 126 5.337 -12.196 2.049 1.00 0.00 H new ATOM 1887 N ASN A 127 3.089 -16.388 5.844 1.00 0.00 N ATOM 1888 CA ASN A 127 3.196 -17.552 6.715 1.00 0.00 C ATOM 1889 C ASN A 127 2.451 -18.745 6.125 1.00 0.00 C ATOM 1890 O ASN A 127 2.831 -19.896 6.343 1.00 0.00 O ATOM 1891 CB ASN A 127 2.647 -17.231 8.107 1.00 0.00 C ATOM 1892 CG ASN A 127 3.598 -17.646 9.213 1.00 0.00 C ATOM 1893 OD1 ASN A 127 4.125 -18.758 9.208 1.00 0.00 O ATOM 1894 ND2 ASN A 127 3.821 -16.751 10.169 1.00 0.00 N ATOM 0 H ASN A 127 2.314 -15.762 6.063 1.00 0.00 H new ATOM 0 HA ASN A 127 4.251 -17.811 6.801 1.00 0.00 H new ATOM 0 HB2 ASN A 127 2.453 -16.161 8.180 1.00 0.00 H new ATOM 0 HB3 ASN A 127 1.692 -17.738 8.244 1.00 0.00 H new ATOM 0 HD21 ASN A 127 4.451 -16.974 10.939 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.362 -15.841 10.133 1.00 0.00 H new ATOM 1901 N HIS A 128 1.383 -18.466 5.382 1.00 0.00 N ATOM 1902 CA HIS A 128 0.582 -19.522 4.774 1.00 0.00 C ATOM 1903 C HIS A 128 1.029 -19.826 3.347 1.00 0.00 C ATOM 1904 O HIS A 128 1.295 -20.979 3.007 1.00 0.00 O ATOM 1905 CB HIS A 128 -0.898 -19.138 4.787 1.00 0.00 C ATOM 1906 CG HIS A 128 -1.647 -19.681 5.964 1.00 0.00 C ATOM 1907 ND1 HIS A 128 -2.995 -19.469 6.163 1.00 0.00 N ATOM 1908 CD2 HIS A 128 -1.229 -20.435 7.009 1.00 0.00 C ATOM 1909 CE1 HIS A 128 -3.373 -20.066 7.280 1.00 0.00 C ATOM 1910 NE2 HIS A 128 -2.321 -20.659 7.811 1.00 0.00 N ATOM 0 H HIS A 128 1.054 -17.520 5.188 1.00 0.00 H new ATOM 0 HA HIS A 128 0.728 -20.425 5.367 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -0.983 -18.051 4.783 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -1.366 -19.498 3.871 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -0.224 -20.793 7.180 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -4.373 -20.068 7.688 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -2.319 -21.197 8.678 1.00 0.00 H new ATOM 1919 N ARG A 129 1.096 -18.791 2.511 1.00 0.00 N ATOM 1920 CA ARG A 129 1.498 -18.949 1.113 1.00 0.00 C ATOM 1921 C ARG A 129 2.661 -19.928 0.971 1.00 0.00 C ATOM 1922 O ARG A 129 2.760 -20.653 -0.020 1.00 0.00 O ATOM 1923 CB ARG A 129 1.882 -17.592 0.517 1.00 0.00 C ATOM 1924 CG ARG A 129 0.925 -17.108 -0.559 1.00 0.00 C ATOM 1925 CD ARG A 129 0.772 -18.132 -1.672 1.00 0.00 C ATOM 1926 NE ARG A 129 0.176 -17.552 -2.874 1.00 0.00 N ATOM 1927 CZ ARG A 129 -0.391 -18.269 -3.841 1.00 0.00 C ATOM 1928 NH1 ARG A 129 -0.440 -19.593 -3.754 1.00 0.00 N ATOM 1929 NH2 ARG A 129 -0.910 -17.661 -4.899 1.00 0.00 N ATOM 0 H ARG A 129 0.877 -17.831 2.778 1.00 0.00 H new ATOM 0 HA ARG A 129 0.647 -19.356 0.567 1.00 0.00 H new ATOM 0 HB2 ARG A 129 1.922 -16.852 1.316 1.00 0.00 H new ATOM 0 HB3 ARG A 129 2.885 -17.660 0.096 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -0.049 -16.904 -0.115 1.00 0.00 H new ATOM 0 HG3 ARG A 129 1.289 -16.169 -0.975 1.00 0.00 H new ATOM 0 HD2 ARG A 129 1.749 -18.549 -1.917 1.00 0.00 H new ATOM 0 HD3 ARG A 129 0.152 -18.957 -1.322 1.00 0.00 H new ATOM 0 HE ARG A 129 0.196 -16.537 -2.978 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -0.042 -20.066 -2.943 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -0.876 -20.137 -4.498 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -0.874 -16.644 -4.971 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -1.345 -18.210 -5.641 1.00 0.00 H new ATOM 1943 N ILE A 130 3.537 -19.946 1.969 1.00 0.00 N ATOM 1944 CA ILE A 130 4.690 -20.836 1.959 1.00 0.00 C ATOM 1945 C ILE A 130 4.387 -22.135 2.702 1.00 0.00 C ATOM 1946 O ILE A 130 4.771 -23.218 2.259 1.00 0.00 O ATOM 1947 CB ILE A 130 5.924 -20.153 2.589 1.00 0.00 C ATOM 1948 CG1 ILE A 130 6.328 -18.935 1.760 1.00 0.00 C ATOM 1949 CG2 ILE A 130 7.087 -21.131 2.701 1.00 0.00 C ATOM 1950 CD1 ILE A 130 5.560 -17.682 2.117 1.00 0.00 C ATOM 0 H ILE A 130 3.470 -19.353 2.796 1.00 0.00 H new ATOM 0 HA ILE A 130 4.911 -21.070 0.918 1.00 0.00 H new ATOM 0 HB ILE A 130 5.662 -19.824 3.595 1.00 0.00 H new ATOM 0 HG12 ILE A 130 7.394 -18.750 1.896 1.00 0.00 H new ATOM 0 HG13 ILE A 130 6.175 -19.157 0.704 1.00 0.00 H new ATOM 0 HG21 ILE A 130 7.944 -20.627 3.147 1.00 0.00 H new ATOM 0 HG22 ILE A 130 6.795 -21.974 3.327 1.00 0.00 H new ATOM 0 HG23 ILE A 130 7.355 -21.493 1.708 1.00 0.00 H new ATOM 0 HD11 ILE A 130 5.898 -16.857 1.490 1.00 0.00 H new ATOM 0 HD12 ILE A 130 4.495 -17.849 1.954 1.00 0.00 H new ATOM 0 HD13 ILE A 130 5.733 -17.436 3.165 1.00 0.00 H new