USER MOD reduce.3.24.130724 H: found=0, std=0, add=997, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 999 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 53 THR OG1 : rot 65:sc= 1.06 USER MOD Set 1.2: A 137 TYR OH : rot -82:sc= 0.186 USER MOD Set 2.1: A 23 ASN : amide:sc= -0.023 K(o=-0.075,f=-2.3!) USER MOD Set 2.2: A 101 HIS : no HD1:sc= -0.0517 K(o=-0.075,f=-1.8) USER MOD Set 3.1: A 88 THR OG1 : rot -170:sc= 0 USER MOD Set 3.2: A 104 ASN : amide:sc= -0.761 K(o=-0.76,f=-0.14) USER MOD Set 4.1: A 60 SER OG : rot 128:sc= 0.16 USER MOD Set 4.2: A 66 SER OG : rot 33:sc= 1.14 USER MOD Set 5.1: A 47 SER OG : rot 30:sc= 0.409 USER MOD Set 5.2: A 49 LYS NZ :NH3+ -149:sc= 1.28 (180deg=-0.103) USER MOD Set 6.1: A 42 TYR OH : rot 0:sc=0.000746 USER MOD Set 6.2: A 54 SER OG : rot 100:sc= 0.158 USER MOD Set 7.1: A 20 THR OG1 : rot 69:sc= -0.201 USER MOD Set 7.2: A 117 ASN : amide:sc= -0.282 K(o=-0.48,f=1.8) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 175:sc= 0.224 (180deg=0.201) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -6.98! K(o=-7!,f=-1.6) USER MOD Single : A 15 MET CE :methyl -133:sc= -1.58 (180deg=-3.9!) USER MOD Single : A 16 GLN : amide:sc= -5.62! C(o=-5.6!,f=-7.4!) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 GLN : amide:sc=-0.000431 X(o=-0.00043,f=-0.088) USER MOD Single : A 22 ASN : amide:sc=-0.00782 K(o=-0.0078,f=-0.6) USER MOD Single : A 25 THR OG1 : rot -33:sc= 0.208! USER MOD Single : A 37 LYS NZ :NH3+ 169:sc= 0.136 (180deg=0.0799) USER MOD Single : A 55 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00382) USER MOD Single : A 57 LYS NZ :NH3+ -136:sc= 0.0817 (180deg=-0.0196) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 CYS SG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 171:sc= 0.713 (180deg=0.654) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=-0.045) USER MOD Single : A 85 MET CE :methyl 174:sc=-0.00522 (180deg=-0.0773) USER MOD Single : A 92 SER OG : rot 180:sc= 0.0519 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 HIS : no HD1:sc= -4.88! C(o=-4.9!,f=-5.4!) USER MOD Single : A 110 ASN : amide:sc= -1.3 K(o=-1.3,f=-0.68) USER MOD Single : A 114 TYR OH : rot 129:sc= 0.377 USER MOD Single : A 115 CYS SG : rot 180:sc= -0.367 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ -151:sc= 1.18 (180deg=0.0612) USER MOD Single : A 127 HIS : no HD1:sc= -1.22 K(o=-1.2,f=-0.13) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 174:sc= 0.783 (180deg=0.758) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= -0.13 USER MOD Single : A 139 HIS : no HD1:sc= 0 X(o=0,f=-0.0017) USER MOD Single : A 142 ASN : amide:sc= 0 K(o=0,f=-0.74) USER MOD ----------------------------------------------------------------- ATOM 87 N GLU A 6 -14.992 10.344 6.982 1.00 0.00 N ATOM 88 CA GLU A 6 -15.249 11.819 7.057 1.00 0.00 C ATOM 89 C GLU A 6 -14.845 12.513 8.388 1.00 0.00 C ATOM 90 O GLU A 6 -14.632 13.734 8.418 1.00 0.00 O ATOM 91 CB GLU A 6 -16.754 12.081 6.769 1.00 0.00 C ATOM 92 CG GLU A 6 -17.277 11.474 5.448 1.00 0.00 C ATOM 93 CD GLU A 6 -16.460 11.906 4.219 1.00 0.00 C ATOM 94 OE1 GLU A 6 -16.689 13.019 3.702 1.00 0.00 O ATOM 95 OE2 GLU A 6 -15.570 11.147 3.774 1.00 0.00 O ATOM 0 HA GLU A 6 -14.599 12.266 6.305 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -17.342 11.680 7.594 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -16.924 13.158 6.750 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -17.261 10.387 5.523 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -18.317 11.768 5.307 1.00 0.00 H new ATOM 102 N GLU A 7 -14.726 11.730 9.464 1.00 0.00 N ATOM 103 CA GLU A 7 -14.343 12.245 10.789 1.00 0.00 C ATOM 104 C GLU A 7 -12.796 12.214 10.874 1.00 0.00 C ATOM 105 O GLU A 7 -12.159 13.162 11.330 1.00 0.00 O ATOM 106 CB GLU A 7 -15.005 11.379 11.910 1.00 0.00 C ATOM 107 CG GLU A 7 -15.336 12.129 13.223 1.00 0.00 C ATOM 108 CD GLU A 7 -14.120 12.678 13.998 1.00 0.00 C ATOM 109 OE1 GLU A 7 -13.455 11.899 14.712 1.00 0.00 O ATOM 110 OE2 GLU A 7 -13.834 13.897 13.915 1.00 0.00 O ATOM 0 H GLU A 7 -14.891 10.724 9.445 1.00 0.00 H new ATOM 0 HA GLU A 7 -14.692 13.268 10.931 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -15.926 10.948 11.516 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -14.339 10.549 12.144 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -16.001 12.960 12.989 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -15.888 11.454 13.877 1.00 0.00 H new ATOM 117 N LYS A 8 -12.233 11.105 10.372 1.00 0.00 N ATOM 118 CA LYS A 8 -10.824 10.712 10.570 1.00 0.00 C ATOM 119 C LYS A 8 -9.873 11.259 9.483 1.00 0.00 C ATOM 120 O LYS A 8 -8.706 11.513 9.772 1.00 0.00 O ATOM 121 CB LYS A 8 -10.752 9.172 10.642 1.00 0.00 C ATOM 122 CG LYS A 8 -11.685 8.574 11.721 1.00 0.00 C ATOM 123 CD LYS A 8 -11.596 7.042 11.837 1.00 0.00 C ATOM 124 CE LYS A 8 -10.212 6.562 12.299 1.00 0.00 C ATOM 125 NZ LYS A 8 -10.173 5.098 12.513 1.00 0.00 N ATOM 0 H LYS A 8 -12.755 10.438 9.803 1.00 0.00 H new ATOM 0 HA LYS A 8 -10.479 11.157 11.503 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -11.016 8.755 9.670 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -9.725 8.871 10.850 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -11.440 9.017 12.686 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -12.714 8.853 11.494 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -12.351 6.690 12.540 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -11.827 6.594 10.870 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -9.466 6.839 11.555 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -9.943 7.071 13.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -9.221 4.818 12.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -10.867 4.835 13.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -10.404 4.611 11.624 1.00 0.00 H new ATOM 139 N ILE A 9 -10.399 11.450 8.255 1.00 0.00 N ATOM 140 CA ILE A 9 -9.610 11.793 7.037 1.00 0.00 C ATOM 141 C ILE A 9 -8.749 13.052 7.253 1.00 0.00 C ATOM 142 O ILE A 9 -7.615 13.129 6.779 1.00 0.00 O ATOM 143 CB ILE A 9 -10.564 11.995 5.780 1.00 0.00 C ATOM 144 CG1 ILE A 9 -11.176 10.640 5.294 1.00 0.00 C ATOM 145 CG2 ILE A 9 -9.885 12.735 4.595 1.00 0.00 C ATOM 146 CD1 ILE A 9 -10.173 9.572 4.912 1.00 0.00 C ATOM 0 H ILE A 9 -11.399 11.371 8.071 1.00 0.00 H new ATOM 0 HA ILE A 9 -8.941 10.955 6.841 1.00 0.00 H new ATOM 0 HB ILE A 9 -11.369 12.639 6.133 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -11.817 10.247 6.083 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -11.815 10.838 4.434 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -10.595 12.836 3.774 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -9.563 13.724 4.920 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -9.020 12.164 4.258 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -10.702 8.675 4.590 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -9.546 9.936 4.098 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -9.548 9.335 5.773 1.00 0.00 H new ATOM 158 N LYS A 10 -9.307 14.008 8.002 1.00 0.00 N ATOM 159 CA LYS A 10 -8.696 15.338 8.245 1.00 0.00 C ATOM 160 C LYS A 10 -7.303 15.222 8.908 1.00 0.00 C ATOM 161 O LYS A 10 -6.364 15.933 8.534 1.00 0.00 O ATOM 162 CB LYS A 10 -9.660 16.223 9.106 1.00 0.00 C ATOM 163 CG LYS A 10 -10.885 16.829 8.358 1.00 0.00 C ATOM 164 CD LYS A 10 -11.749 15.787 7.600 1.00 0.00 C ATOM 165 CE LYS A 10 -13.045 16.379 7.021 1.00 0.00 C ATOM 166 NZ LYS A 10 -14.031 16.708 8.085 1.00 0.00 N ATOM 0 H LYS A 10 -10.207 13.888 8.467 1.00 0.00 H new ATOM 0 HA LYS A 10 -8.546 15.820 7.279 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -10.029 15.621 9.937 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -9.082 17.041 9.537 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -11.515 17.350 9.079 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -10.529 17.575 7.647 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -11.160 15.357 6.790 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -12.001 14.972 8.278 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -12.810 17.279 6.453 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -13.488 15.668 6.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -14.854 17.182 7.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -14.339 15.833 8.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -13.590 17.340 8.784 1.00 0.00 H new ATOM 180 N SER A 11 -7.181 14.301 9.874 1.00 0.00 N ATOM 181 CA SER A 11 -5.891 14.004 10.531 1.00 0.00 C ATOM 182 C SER A 11 -5.137 12.943 9.724 1.00 0.00 C ATOM 183 O SER A 11 -3.955 13.119 9.410 1.00 0.00 O ATOM 184 CB SER A 11 -6.110 13.527 11.983 1.00 0.00 C ATOM 185 OG SER A 11 -6.762 14.523 12.749 1.00 0.00 O ATOM 0 H SER A 11 -7.961 13.744 10.222 1.00 0.00 H new ATOM 0 HA SER A 11 -5.296 14.916 10.566 1.00 0.00 H new ATOM 0 HB2 SER A 11 -6.705 12.614 11.984 1.00 0.00 H new ATOM 0 HB3 SER A 11 -5.150 13.282 12.438 1.00 0.00 H new ATOM 0 HG SER A 11 -6.892 14.199 13.665 1.00 0.00 H new ATOM 191 N LEU A 12 -5.837 11.836 9.412 1.00 0.00 N ATOM 192 CA LEU A 12 -5.299 10.668 8.680 1.00 0.00 C ATOM 193 C LEU A 12 -4.474 11.012 7.419 1.00 0.00 C ATOM 194 O LEU A 12 -3.312 10.629 7.326 1.00 0.00 O ATOM 195 CB LEU A 12 -6.496 9.763 8.301 1.00 0.00 C ATOM 196 CG LEU A 12 -6.178 8.379 7.668 1.00 0.00 C ATOM 197 CD1 LEU A 12 -5.324 7.511 8.621 1.00 0.00 C ATOM 198 CD2 LEU A 12 -7.485 7.663 7.245 1.00 0.00 C ATOM 0 H LEU A 12 -6.818 11.724 9.668 1.00 0.00 H new ATOM 0 HA LEU A 12 -4.593 10.168 9.343 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -7.087 9.593 9.201 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.127 10.314 7.604 1.00 0.00 H new ATOM 0 HG LEU A 12 -5.584 8.539 6.768 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -5.118 6.549 8.151 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -4.384 8.020 8.833 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -5.867 7.350 9.552 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -7.244 6.696 6.804 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -8.118 7.515 8.120 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -8.014 8.274 6.513 1.00 0.00 H new ATOM 210 N ASN A 13 -5.081 11.751 6.480 1.00 0.00 N ATOM 211 CA ASN A 13 -4.447 12.066 5.174 1.00 0.00 C ATOM 212 C ASN A 13 -3.282 13.026 5.359 1.00 0.00 C ATOM 213 O ASN A 13 -2.332 12.986 4.604 1.00 0.00 O ATOM 214 CB ASN A 13 -5.465 12.671 4.172 1.00 0.00 C ATOM 215 CG ASN A 13 -6.551 11.694 3.717 1.00 0.00 C ATOM 216 OD1 ASN A 13 -6.931 11.670 2.544 1.00 0.00 O ATOM 217 ND2 ASN A 13 -7.106 10.912 4.636 1.00 0.00 N ATOM 0 H ASN A 13 -6.014 12.147 6.593 1.00 0.00 H new ATOM 0 HA ASN A 13 -4.079 11.126 4.762 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -5.940 13.537 4.632 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -4.926 13.031 3.296 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -7.861 10.277 4.377 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -6.777 10.947 5.601 1.00 0.00 H new ATOM 224 N ARG A 14 -3.366 13.874 6.386 1.00 0.00 N ATOM 225 CA ARG A 14 -2.309 14.847 6.707 1.00 0.00 C ATOM 226 C ARG A 14 -1.001 14.109 7.088 1.00 0.00 C ATOM 227 O ARG A 14 0.098 14.629 6.888 1.00 0.00 O ATOM 228 CB ARG A 14 -2.784 15.775 7.848 1.00 0.00 C ATOM 229 CG ARG A 14 -1.870 16.987 8.121 1.00 0.00 C ATOM 230 CD ARG A 14 -2.426 17.895 9.230 1.00 0.00 C ATOM 231 NE ARG A 14 -3.803 18.350 8.928 1.00 0.00 N ATOM 232 CZ ARG A 14 -4.547 19.143 9.698 1.00 0.00 C ATOM 233 NH1 ARG A 14 -4.070 19.626 10.842 1.00 0.00 N ATOM 234 NH2 ARG A 14 -5.780 19.449 9.325 1.00 0.00 N ATOM 0 H ARG A 14 -4.165 13.909 7.020 1.00 0.00 H new ATOM 0 HA ARG A 14 -2.102 15.461 5.831 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -3.783 16.138 7.609 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -2.868 15.188 8.763 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -0.878 16.635 8.405 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -1.753 17.565 7.205 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -2.420 17.357 10.178 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -1.775 18.761 9.352 1.00 0.00 H new ATOM 0 HE ARG A 14 -4.218 18.028 8.054 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -3.123 19.390 11.140 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -4.651 20.232 11.421 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -6.156 19.078 8.452 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -6.354 20.056 9.910 1.00 0.00 H new ATOM 248 N MET A 15 -1.156 12.879 7.616 1.00 0.00 N ATOM 249 CA MET A 15 -0.036 11.983 7.952 1.00 0.00 C ATOM 250 C MET A 15 0.389 11.168 6.715 1.00 0.00 C ATOM 251 O MET A 15 1.536 11.239 6.293 1.00 0.00 O ATOM 252 CB MET A 15 -0.435 11.021 9.101 1.00 0.00 C ATOM 253 CG MET A 15 -1.103 11.699 10.304 1.00 0.00 C ATOM 254 SD MET A 15 -1.506 10.533 11.622 1.00 0.00 S ATOM 255 CE MET A 15 -2.395 9.246 10.750 1.00 0.00 C ATOM 0 H MET A 15 -2.071 12.478 7.822 1.00 0.00 H new ATOM 0 HA MET A 15 0.804 12.595 8.280 1.00 0.00 H new ATOM 0 HB2 MET A 15 -1.113 10.266 8.705 1.00 0.00 H new ATOM 0 HB3 MET A 15 0.458 10.499 9.445 1.00 0.00 H new ATOM 0 HG2 MET A 15 -0.440 12.470 10.696 1.00 0.00 H new ATOM 0 HG3 MET A 15 -2.014 12.199 9.975 1.00 0.00 H new ATOM 0 HE1 MET A 15 -3.304 8.997 11.297 1.00 0.00 H new ATOM 0 HE2 MET A 15 -2.657 9.597 9.752 1.00 0.00 H new ATOM 0 HE3 MET A 15 -1.766 8.360 10.669 1.00 0.00 H new ATOM 265 N GLN A 16 -0.572 10.408 6.134 1.00 0.00 N ATOM 266 CA GLN A 16 -0.302 9.448 5.037 1.00 0.00 C ATOM 267 C GLN A 16 0.212 10.157 3.767 1.00 0.00 C ATOM 268 O GLN A 16 1.167 9.714 3.160 1.00 0.00 O ATOM 269 CB GLN A 16 -1.574 8.644 4.684 1.00 0.00 C ATOM 270 CG GLN A 16 -2.239 7.913 5.865 1.00 0.00 C ATOM 271 CD GLN A 16 -3.432 7.061 5.425 1.00 0.00 C ATOM 272 OE1 GLN A 16 -4.061 7.350 4.425 1.00 0.00 O ATOM 273 NE2 GLN A 16 -3.747 6.009 6.165 1.00 0.00 N ATOM 0 H GLN A 16 -1.553 10.444 6.412 1.00 0.00 H new ATOM 0 HA GLN A 16 0.473 8.771 5.397 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.303 9.324 4.242 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -1.319 7.909 3.920 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -1.503 7.277 6.356 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -2.570 8.645 6.602 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -3.202 5.790 6.999 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -4.535 5.417 5.901 1.00 0.00 H new ATOM 282 N TYR A 17 -0.503 11.221 3.360 1.00 0.00 N ATOM 283 CA TYR A 17 -0.101 12.070 2.200 1.00 0.00 C ATOM 284 C TYR A 17 1.278 12.741 2.434 1.00 0.00 C ATOM 285 O TYR A 17 2.049 12.888 1.484 1.00 0.00 O ATOM 286 CB TYR A 17 -1.184 13.132 1.842 1.00 0.00 C ATOM 287 CG TYR A 17 -0.808 14.060 0.669 1.00 0.00 C ATOM 288 CD1 TYR A 17 -0.786 13.588 -0.648 1.00 0.00 C ATOM 289 CD2 TYR A 17 -0.455 15.398 0.887 1.00 0.00 C ATOM 290 CE1 TYR A 17 -0.427 14.412 -1.698 1.00 0.00 C ATOM 291 CE2 TYR A 17 -0.100 16.224 -0.161 1.00 0.00 C ATOM 292 CZ TYR A 17 -0.085 15.731 -1.450 1.00 0.00 C ATOM 293 OH TYR A 17 0.275 16.562 -2.493 1.00 0.00 O ATOM 0 H TYR A 17 -1.366 11.522 3.812 1.00 0.00 H new ATOM 0 HA TYR A 17 -0.009 11.402 1.344 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -2.113 12.617 1.597 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -1.381 13.743 2.723 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -1.054 12.561 -0.848 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -0.461 15.791 1.893 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.413 14.029 -2.708 1.00 0.00 H new ATOM 0 HE2 TYR A 17 0.165 17.254 0.028 1.00 0.00 H new ATOM 0 HH TYR A 17 0.483 17.454 -2.144 1.00 0.00 H new ATOM 303 N GLU A 18 1.578 13.139 3.694 1.00 0.00 N ATOM 304 CA GLU A 18 2.934 13.629 4.078 1.00 0.00 C ATOM 305 C GLU A 18 3.988 12.541 3.798 1.00 0.00 C ATOM 306 O GLU A 18 5.053 12.811 3.234 1.00 0.00 O ATOM 307 CB GLU A 18 2.985 14.035 5.576 1.00 0.00 C ATOM 308 CG GLU A 18 4.371 14.493 6.077 1.00 0.00 C ATOM 309 CD GLU A 18 4.432 14.710 7.601 1.00 0.00 C ATOM 310 OE1 GLU A 18 4.667 13.729 8.343 1.00 0.00 O ATOM 311 OE2 GLU A 18 4.237 15.861 8.062 1.00 0.00 O ATOM 0 H GLU A 18 0.906 13.132 4.462 1.00 0.00 H new ATOM 0 HA GLU A 18 3.153 14.512 3.478 1.00 0.00 H new ATOM 0 HB2 GLU A 18 2.270 14.840 5.744 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.659 13.187 6.179 1.00 0.00 H new ATOM 0 HG2 GLU A 18 5.115 13.749 5.794 1.00 0.00 H new ATOM 0 HG3 GLU A 18 4.642 15.422 5.575 1.00 0.00 H new ATOM 318 N VAL A 19 3.627 11.304 4.146 1.00 0.00 N ATOM 319 CA VAL A 19 4.493 10.130 3.994 1.00 0.00 C ATOM 320 C VAL A 19 4.730 9.830 2.497 1.00 0.00 C ATOM 321 O VAL A 19 5.851 9.570 2.087 1.00 0.00 O ATOM 322 CB VAL A 19 3.871 8.898 4.752 1.00 0.00 C ATOM 323 CG1 VAL A 19 4.568 7.581 4.383 1.00 0.00 C ATOM 324 CG2 VAL A 19 3.916 9.130 6.281 1.00 0.00 C ATOM 0 H VAL A 19 2.715 11.086 4.546 1.00 0.00 H new ATOM 0 HA VAL A 19 5.465 10.336 4.442 1.00 0.00 H new ATOM 0 HB VAL A 19 2.831 8.810 4.437 1.00 0.00 H new ATOM 0 HG11 VAL A 19 4.106 6.759 4.930 1.00 0.00 H new ATOM 0 HG12 VAL A 19 4.470 7.405 3.312 1.00 0.00 H new ATOM 0 HG13 VAL A 19 5.624 7.642 4.645 1.00 0.00 H new ATOM 0 HG21 VAL A 19 3.483 8.270 6.792 1.00 0.00 H new ATOM 0 HG22 VAL A 19 4.951 9.258 6.599 1.00 0.00 H new ATOM 0 HG23 VAL A 19 3.346 10.025 6.530 1.00 0.00 H new ATOM 334 N THR A 20 3.659 9.883 1.696 1.00 0.00 N ATOM 335 CA THR A 20 3.732 9.823 0.219 1.00 0.00 C ATOM 336 C THR A 20 4.647 10.940 -0.345 1.00 0.00 C ATOM 337 O THR A 20 5.438 10.709 -1.262 1.00 0.00 O ATOM 338 CB THR A 20 2.305 9.961 -0.422 1.00 0.00 C ATOM 339 OG1 THR A 20 1.380 9.090 0.246 1.00 0.00 O ATOM 340 CG2 THR A 20 2.315 9.631 -1.928 1.00 0.00 C ATOM 0 H THR A 20 2.707 9.969 2.051 1.00 0.00 H new ATOM 0 HA THR A 20 4.153 8.851 -0.040 1.00 0.00 H new ATOM 0 HB THR A 20 1.996 10.999 -0.304 1.00 0.00 H new ATOM 0 HG1 THR A 20 1.217 9.421 1.154 1.00 0.00 H new ATOM 0 HG21 THR A 20 1.308 9.739 -2.331 1.00 0.00 H new ATOM 0 HG22 THR A 20 2.988 10.314 -2.446 1.00 0.00 H new ATOM 0 HG23 THR A 20 2.656 8.606 -2.074 1.00 0.00 H new ATOM 348 N GLN A 21 4.563 12.122 0.277 1.00 0.00 N ATOM 349 CA GLN A 21 5.222 13.354 -0.202 1.00 0.00 C ATOM 350 C GLN A 21 6.756 13.247 -0.087 1.00 0.00 C ATOM 351 O GLN A 21 7.477 13.632 -1.014 1.00 0.00 O ATOM 352 CB GLN A 21 4.644 14.580 0.584 1.00 0.00 C ATOM 353 CG GLN A 21 5.240 15.983 0.276 1.00 0.00 C ATOM 354 CD GLN A 21 6.419 16.381 1.177 1.00 0.00 C ATOM 355 OE1 GLN A 21 7.582 16.141 0.857 1.00 0.00 O ATOM 356 NE2 GLN A 21 6.108 16.943 2.341 1.00 0.00 N ATOM 0 H GLN A 21 4.031 12.257 1.137 1.00 0.00 H new ATOM 0 HA GLN A 21 5.010 13.496 -1.262 1.00 0.00 H new ATOM 0 HB2 GLN A 21 3.571 14.623 0.396 1.00 0.00 H new ATOM 0 HB3 GLN A 21 4.774 14.387 1.649 1.00 0.00 H new ATOM 0 HG2 GLN A 21 5.568 16.005 -0.763 1.00 0.00 H new ATOM 0 HG3 GLN A 21 4.452 16.730 0.377 1.00 0.00 H new ATOM 0 HE21 GLN A 21 5.132 17.128 2.574 1.00 0.00 H new ATOM 0 HE22 GLN A 21 6.845 17.189 3.001 1.00 0.00 H new ATOM 365 N ASN A 22 7.252 12.700 1.045 1.00 0.00 N ATOM 366 CA ASN A 22 8.710 12.616 1.312 1.00 0.00 C ATOM 367 C ASN A 22 9.219 11.153 1.352 1.00 0.00 C ATOM 368 O ASN A 22 10.398 10.923 1.671 1.00 0.00 O ATOM 369 CB ASN A 22 9.057 13.367 2.631 1.00 0.00 C ATOM 370 CG ASN A 22 8.672 12.630 3.916 1.00 0.00 C ATOM 371 OD1 ASN A 22 9.469 11.882 4.472 1.00 0.00 O ATOM 372 ND2 ASN A 22 7.461 12.845 4.401 1.00 0.00 N ATOM 0 H ASN A 22 6.670 12.311 1.787 1.00 0.00 H new ATOM 0 HA ASN A 22 9.225 13.101 0.483 1.00 0.00 H new ATOM 0 HB2 ASN A 22 10.129 13.562 2.649 1.00 0.00 H new ATOM 0 HB3 ASN A 22 8.557 14.336 2.622 1.00 0.00 H new ATOM 0 HD21 ASN A 22 7.167 12.383 5.261 1.00 0.00 H new ATOM 0 HD22 ASN A 22 6.821 13.473 3.915 1.00 0.00 H new ATOM 379 N ASN A 23 8.326 10.177 1.021 1.00 0.00 N ATOM 380 CA ASN A 23 8.628 8.704 1.070 1.00 0.00 C ATOM 381 C ASN A 23 8.952 8.278 2.516 1.00 0.00 C ATOM 382 O ASN A 23 9.733 7.348 2.760 1.00 0.00 O ATOM 383 CB ASN A 23 9.783 8.299 0.090 1.00 0.00 C ATOM 384 CG ASN A 23 9.465 8.515 -1.389 1.00 0.00 C ATOM 385 OD1 ASN A 23 8.723 9.426 -1.749 1.00 0.00 O ATOM 386 ND2 ASN A 23 10.013 7.673 -2.257 1.00 0.00 N ATOM 0 H ASN A 23 7.376 10.382 0.712 1.00 0.00 H new ATOM 0 HA ASN A 23 7.737 8.173 0.735 1.00 0.00 H new ATOM 0 HB2 ASN A 23 10.675 8.871 0.344 1.00 0.00 H new ATOM 0 HB3 ASN A 23 10.023 7.248 0.247 1.00 0.00 H new ATOM 0 HD21 ASN A 23 9.822 7.772 -3.254 1.00 0.00 H new ATOM 0 HD22 ASN A 23 10.625 6.927 -1.927 1.00 0.00 H new ATOM 393 N GLY A 24 8.305 8.973 3.461 1.00 0.00 N ATOM 394 CA GLY A 24 8.596 8.860 4.876 1.00 0.00 C ATOM 395 C GLY A 24 8.050 7.609 5.531 1.00 0.00 C ATOM 396 O GLY A 24 7.467 6.736 4.886 1.00 0.00 O ATOM 0 H GLY A 24 7.558 9.635 3.250 1.00 0.00 H new ATOM 0 HA2 GLY A 24 9.677 8.886 5.015 1.00 0.00 H new ATOM 0 HA3 GLY A 24 8.188 9.731 5.389 1.00 0.00 H new ATOM 400 N THR A 25 8.338 7.501 6.814 1.00 0.00 N ATOM 401 CA THR A 25 7.736 6.510 7.709 1.00 0.00 C ATOM 402 C THR A 25 6.665 7.246 8.531 1.00 0.00 C ATOM 403 O THR A 25 6.666 8.486 8.568 1.00 0.00 O ATOM 404 CB THR A 25 8.833 5.871 8.635 1.00 0.00 C ATOM 405 OG1 THR A 25 9.948 5.459 7.832 1.00 0.00 O ATOM 406 CG2 THR A 25 8.322 4.653 9.437 1.00 0.00 C ATOM 0 H THR A 25 9.011 8.109 7.281 1.00 0.00 H new ATOM 0 HA THR A 25 7.285 5.691 7.148 1.00 0.00 H new ATOM 0 HB THR A 25 9.121 6.636 9.356 1.00 0.00 H new ATOM 0 HG1 THR A 25 9.629 5.173 6.951 1.00 0.00 H new ATOM 0 HG21 THR A 25 9.129 4.260 10.055 1.00 0.00 H new ATOM 0 HG22 THR A 25 7.492 4.959 10.074 1.00 0.00 H new ATOM 0 HG23 THR A 25 7.984 3.879 8.748 1.00 0.00 H new ATOM 414 N GLU A 26 5.734 6.510 9.151 1.00 0.00 N ATOM 415 CA GLU A 26 4.792 7.092 10.124 1.00 0.00 C ATOM 416 C GLU A 26 5.598 7.693 11.297 1.00 0.00 C ATOM 417 O GLU A 26 6.435 6.994 11.871 1.00 0.00 O ATOM 418 CB GLU A 26 3.829 5.990 10.662 1.00 0.00 C ATOM 419 CG GLU A 26 2.793 6.463 11.715 1.00 0.00 C ATOM 420 CD GLU A 26 2.185 5.303 12.539 1.00 0.00 C ATOM 421 OE1 GLU A 26 1.459 4.466 11.960 1.00 0.00 O ATOM 422 OE2 GLU A 26 2.454 5.208 13.758 1.00 0.00 O ATOM 0 H GLU A 26 5.610 5.509 8.998 1.00 0.00 H new ATOM 0 HA GLU A 26 4.200 7.869 9.640 1.00 0.00 H new ATOM 0 HB2 GLU A 26 3.291 5.558 9.818 1.00 0.00 H new ATOM 0 HB3 GLU A 26 4.428 5.192 11.100 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.271 7.170 12.393 1.00 0.00 H new ATOM 0 HG3 GLU A 26 1.990 7.000 11.209 1.00 0.00 H new ATOM 429 N PRO A 27 5.457 9.011 11.621 1.00 0.00 N ATOM 430 CA PRO A 27 5.922 9.524 12.926 1.00 0.00 C ATOM 431 C PRO A 27 5.068 8.831 14.005 1.00 0.00 C ATOM 432 O PRO A 27 3.868 8.938 13.917 1.00 0.00 O ATOM 433 CB PRO A 27 5.665 11.064 12.834 1.00 0.00 C ATOM 434 CG PRO A 27 5.510 11.337 11.359 1.00 0.00 C ATOM 435 CD PRO A 27 4.878 10.088 10.779 1.00 0.00 C ATOM 0 HA PRO A 27 6.967 9.334 13.171 1.00 0.00 H new ATOM 0 HB2 PRO A 27 4.770 11.350 13.386 1.00 0.00 H new ATOM 0 HB3 PRO A 27 6.495 11.630 13.257 1.00 0.00 H new ATOM 0 HG2 PRO A 27 4.882 12.211 11.186 1.00 0.00 H new ATOM 0 HG3 PRO A 27 6.475 11.540 10.894 1.00 0.00 H new ATOM 0 HD2 PRO A 27 3.790 10.115 10.847 1.00 0.00 H new ATOM 0 HD3 PRO A 27 5.129 9.958 9.726 1.00 0.00 H new ATOM 598 N LYS A 37 2.307 -7.207 12.655 1.00 0.00 N ATOM 599 CA LYS A 37 2.632 -7.901 11.400 1.00 0.00 C ATOM 600 C LYS A 37 1.576 -9.002 11.167 1.00 0.00 C ATOM 601 O LYS A 37 1.832 -10.028 10.521 1.00 0.00 O ATOM 602 CB LYS A 37 4.069 -8.472 11.528 1.00 0.00 C ATOM 603 CG LYS A 37 4.703 -8.995 10.225 1.00 0.00 C ATOM 604 CD LYS A 37 6.171 -9.421 10.422 1.00 0.00 C ATOM 605 CE LYS A 37 7.072 -8.263 10.908 1.00 0.00 C ATOM 606 NZ LYS A 37 8.474 -8.695 11.130 1.00 0.00 N ATOM 0 HA LYS A 37 2.609 -7.233 10.539 1.00 0.00 H new ATOM 0 HB2 LYS A 37 4.714 -7.694 11.936 1.00 0.00 H new ATOM 0 HB3 LYS A 37 4.053 -9.285 12.254 1.00 0.00 H new ATOM 0 HG2 LYS A 37 4.126 -9.844 9.858 1.00 0.00 H new ATOM 0 HG3 LYS A 37 4.651 -8.220 9.461 1.00 0.00 H new ATOM 0 HD2 LYS A 37 6.214 -10.236 11.144 1.00 0.00 H new ATOM 0 HD3 LYS A 37 6.561 -9.808 9.481 1.00 0.00 H new ATOM 0 HE2 LYS A 37 7.054 -7.459 10.173 1.00 0.00 H new ATOM 0 HE3 LYS A 37 6.668 -7.856 11.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 9.076 -7.859 11.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 8.521 -9.303 11.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 8.809 -9.226 10.301 1.00 0.00 H new ATOM 620 N GLU A 38 0.367 -8.728 11.694 1.00 0.00 N ATOM 621 CA GLU A 38 -0.752 -9.674 11.745 1.00 0.00 C ATOM 622 C GLU A 38 -1.193 -10.064 10.331 1.00 0.00 C ATOM 623 O GLU A 38 -1.544 -9.196 9.525 1.00 0.00 O ATOM 624 CB GLU A 38 -1.919 -9.040 12.552 1.00 0.00 C ATOM 625 CG GLU A 38 -1.541 -8.724 14.017 1.00 0.00 C ATOM 626 CD GLU A 38 -2.588 -7.892 14.779 1.00 0.00 C ATOM 627 OE1 GLU A 38 -3.591 -8.460 15.263 1.00 0.00 O ATOM 628 OE2 GLU A 38 -2.404 -6.667 14.917 1.00 0.00 O ATOM 0 H GLU A 38 0.142 -7.821 12.104 1.00 0.00 H new ATOM 0 HA GLU A 38 -0.436 -10.588 12.247 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -2.237 -8.121 12.059 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -2.771 -9.719 12.541 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.383 -9.662 14.549 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.592 -8.188 14.027 1.00 0.00 H new ATOM 635 N GLU A 39 -1.157 -11.381 10.059 1.00 0.00 N ATOM 636 CA GLU A 39 -1.408 -11.952 8.728 1.00 0.00 C ATOM 637 C GLU A 39 -2.822 -11.619 8.235 1.00 0.00 C ATOM 638 O GLU A 39 -3.726 -11.481 9.043 1.00 0.00 O ATOM 639 CB GLU A 39 -1.167 -13.489 8.780 1.00 0.00 C ATOM 640 CG GLU A 39 -2.042 -14.296 9.796 1.00 0.00 C ATOM 641 CD GLU A 39 -3.489 -14.585 9.348 1.00 0.00 C ATOM 642 OE1 GLU A 39 -3.667 -15.070 8.221 1.00 0.00 O ATOM 643 OE2 GLU A 39 -4.450 -14.356 10.126 1.00 0.00 O ATOM 0 H GLU A 39 -0.950 -12.085 10.767 1.00 0.00 H new ATOM 0 HA GLU A 39 -0.716 -11.509 8.011 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -1.338 -13.896 7.783 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -0.118 -13.663 9.019 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -1.547 -15.246 9.999 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -2.075 -13.746 10.736 1.00 0.00 H new ATOM 650 N GLY A 40 -3.009 -11.544 6.916 1.00 0.00 N ATOM 651 CA GLY A 40 -4.276 -11.113 6.330 1.00 0.00 C ATOM 652 C GLY A 40 -4.029 -10.114 5.222 1.00 0.00 C ATOM 653 O GLY A 40 -3.405 -10.464 4.223 1.00 0.00 O ATOM 0 H GLY A 40 -2.292 -11.779 6.230 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -4.815 -11.975 5.938 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -4.906 -10.666 7.098 1.00 0.00 H new ATOM 657 N LEU A 41 -4.473 -8.853 5.395 1.00 0.00 N ATOM 658 CA LEU A 41 -4.280 -7.786 4.390 1.00 0.00 C ATOM 659 C LEU A 41 -3.613 -6.541 4.987 1.00 0.00 C ATOM 660 O LEU A 41 -3.573 -6.346 6.202 1.00 0.00 O ATOM 661 CB LEU A 41 -5.643 -7.382 3.742 1.00 0.00 C ATOM 662 CG LEU A 41 -6.177 -8.326 2.632 1.00 0.00 C ATOM 663 CD1 LEU A 41 -7.605 -7.938 2.186 1.00 0.00 C ATOM 664 CD2 LEU A 41 -5.218 -8.367 1.426 1.00 0.00 C ATOM 0 H LEU A 41 -4.973 -8.546 6.230 1.00 0.00 H new ATOM 0 HA LEU A 41 -3.617 -8.193 3.626 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.393 -7.321 4.531 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.540 -6.382 3.322 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.228 -9.327 3.060 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.942 -8.623 1.408 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.281 -7.997 3.039 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -7.600 -6.920 1.796 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -5.619 -9.036 0.665 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.114 -7.365 1.010 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.242 -8.729 1.749 1.00 0.00 H new ATOM 676 N TYR A 42 -3.086 -5.729 4.073 1.00 0.00 N ATOM 677 CA TYR A 42 -2.705 -4.338 4.287 1.00 0.00 C ATOM 678 C TYR A 42 -3.531 -3.512 3.306 1.00 0.00 C ATOM 679 O TYR A 42 -3.375 -3.643 2.085 1.00 0.00 O ATOM 680 CB TYR A 42 -1.190 -4.097 4.051 1.00 0.00 C ATOM 681 CG TYR A 42 -0.270 -4.627 5.158 1.00 0.00 C ATOM 682 CD1 TYR A 42 -0.547 -4.373 6.510 1.00 0.00 C ATOM 683 CD2 TYR A 42 0.885 -5.352 4.860 1.00 0.00 C ATOM 684 CE1 TYR A 42 0.292 -4.823 7.510 1.00 0.00 C ATOM 685 CE2 TYR A 42 1.720 -5.803 5.857 1.00 0.00 C ATOM 686 CZ TYR A 42 1.420 -5.542 7.179 1.00 0.00 C ATOM 687 OH TYR A 42 2.261 -5.993 8.176 1.00 0.00 O ATOM 0 H TYR A 42 -2.905 -6.040 3.118 1.00 0.00 H new ATOM 0 HA TYR A 42 -2.895 -4.055 5.322 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -0.906 -4.564 3.108 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -1.021 -3.026 3.940 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -1.433 -3.815 6.773 1.00 0.00 H new ATOM 0 HD2 TYR A 42 1.128 -5.563 3.829 1.00 0.00 H new ATOM 0 HE1 TYR A 42 0.066 -4.613 8.545 1.00 0.00 H new ATOM 0 HE2 TYR A 42 2.610 -6.361 5.605 1.00 0.00 H new ATOM 0 HH TYR A 42 1.912 -5.716 9.049 1.00 0.00 H new ATOM 697 N VAL A 43 -4.444 -2.706 3.840 1.00 0.00 N ATOM 698 CA VAL A 43 -5.382 -1.904 3.046 1.00 0.00 C ATOM 699 C VAL A 43 -5.179 -0.429 3.388 1.00 0.00 C ATOM 700 O VAL A 43 -4.710 -0.115 4.486 1.00 0.00 O ATOM 701 CB VAL A 43 -6.876 -2.348 3.321 1.00 0.00 C ATOM 702 CG1 VAL A 43 -7.073 -3.855 3.026 1.00 0.00 C ATOM 703 CG2 VAL A 43 -7.326 -2.013 4.760 1.00 0.00 C ATOM 0 H VAL A 43 -4.558 -2.587 4.847 1.00 0.00 H new ATOM 0 HA VAL A 43 -5.188 -2.061 1.985 1.00 0.00 H new ATOM 0 HB VAL A 43 -7.507 -1.777 2.640 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -8.108 -4.132 3.224 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -6.837 -4.055 1.981 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -6.412 -4.440 3.666 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -8.357 -2.336 4.903 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.682 -2.529 5.472 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.257 -0.937 4.922 1.00 0.00 H new ATOM 713 N ASP A 44 -5.524 0.480 2.472 1.00 0.00 N ATOM 714 CA ASP A 44 -5.403 1.915 2.740 1.00 0.00 C ATOM 715 C ASP A 44 -6.555 2.338 3.662 1.00 0.00 C ATOM 716 O ASP A 44 -7.709 2.154 3.319 1.00 0.00 O ATOM 717 CB ASP A 44 -5.375 2.742 1.435 1.00 0.00 C ATOM 718 CG ASP A 44 -6.576 2.475 0.517 1.00 0.00 C ATOM 719 OD1 ASP A 44 -6.536 1.503 -0.236 1.00 0.00 O ATOM 720 OD2 ASP A 44 -7.551 3.239 0.561 1.00 0.00 O ATOM 0 H ASP A 44 -5.886 0.251 1.546 1.00 0.00 H new ATOM 0 HA ASP A 44 -4.453 2.112 3.237 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -5.348 3.802 1.686 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -4.456 2.520 0.892 1.00 0.00 H new ATOM 725 N ILE A 45 -6.205 2.795 4.870 1.00 0.00 N ATOM 726 CA ILE A 45 -7.172 3.234 5.915 1.00 0.00 C ATOM 727 C ILE A 45 -8.235 4.226 5.368 1.00 0.00 C ATOM 728 O ILE A 45 -9.398 4.186 5.773 1.00 0.00 O ATOM 729 CB ILE A 45 -6.426 3.881 7.151 1.00 0.00 C ATOM 730 CG1 ILE A 45 -5.266 2.955 7.634 1.00 0.00 C ATOM 731 CG2 ILE A 45 -7.417 4.181 8.311 1.00 0.00 C ATOM 732 CD1 ILE A 45 -4.458 3.479 8.803 1.00 0.00 C ATOM 0 H ILE A 45 -5.232 2.876 5.165 1.00 0.00 H new ATOM 0 HA ILE A 45 -7.694 2.334 6.240 1.00 0.00 H new ATOM 0 HB ILE A 45 -5.997 4.830 6.829 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -5.687 1.988 7.910 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -4.590 2.781 6.797 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -6.876 4.625 9.146 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -8.183 4.875 7.965 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -7.888 3.253 8.636 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -3.679 2.760 9.058 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -3.999 4.430 8.531 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -5.113 3.624 9.662 1.00 0.00 H new ATOM 744 N VAL A 46 -7.811 5.099 4.435 1.00 0.00 N ATOM 745 CA VAL A 46 -8.674 6.140 3.822 1.00 0.00 C ATOM 746 C VAL A 46 -9.938 5.576 3.106 1.00 0.00 C ATOM 747 O VAL A 46 -11.057 6.034 3.376 1.00 0.00 O ATOM 748 CB VAL A 46 -7.847 7.058 2.827 1.00 0.00 C ATOM 749 CG1 VAL A 46 -6.852 7.948 3.593 1.00 0.00 C ATOM 750 CG2 VAL A 46 -7.103 6.227 1.763 1.00 0.00 C ATOM 0 H VAL A 46 -6.855 5.106 4.080 1.00 0.00 H new ATOM 0 HA VAL A 46 -9.035 6.740 4.657 1.00 0.00 H new ATOM 0 HB VAL A 46 -8.566 7.696 2.313 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -6.299 8.567 2.886 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -7.396 8.588 4.287 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -6.155 7.320 4.149 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.549 6.894 1.102 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -6.409 5.545 2.254 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -7.824 5.654 1.179 1.00 0.00 H new ATOM 760 N SER A 47 -9.755 4.572 2.220 1.00 0.00 N ATOM 761 CA SER A 47 -10.845 4.047 1.343 1.00 0.00 C ATOM 762 C SER A 47 -11.133 2.549 1.635 1.00 0.00 C ATOM 763 O SER A 47 -12.097 1.969 1.113 1.00 0.00 O ATOM 764 CB SER A 47 -10.462 4.302 -0.145 1.00 0.00 C ATOM 765 OG SER A 47 -11.479 3.905 -1.052 1.00 0.00 O ATOM 0 H SER A 47 -8.860 4.101 2.087 1.00 0.00 H new ATOM 0 HA SER A 47 -11.774 4.576 1.555 1.00 0.00 H new ATOM 0 HB2 SER A 47 -10.251 5.362 -0.284 1.00 0.00 H new ATOM 0 HB3 SER A 47 -9.544 3.762 -0.377 1.00 0.00 H new ATOM 0 HG SER A 47 -12.355 3.997 -0.622 1.00 0.00 H new ATOM 771 N GLY A 48 -10.301 1.953 2.501 1.00 0.00 N ATOM 772 CA GLY A 48 -10.455 0.568 2.953 1.00 0.00 C ATOM 773 C GLY A 48 -10.236 -0.474 1.865 1.00 0.00 C ATOM 774 O GLY A 48 -10.830 -1.553 1.908 1.00 0.00 O ATOM 0 H GLY A 48 -9.495 2.426 2.910 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -9.751 0.383 3.764 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -11.456 0.442 3.365 1.00 0.00 H new ATOM 778 N LYS A 49 -9.356 -0.164 0.906 1.00 0.00 N ATOM 779 CA LYS A 49 -9.191 -0.965 -0.321 1.00 0.00 C ATOM 780 C LYS A 49 -7.916 -1.843 -0.260 1.00 0.00 C ATOM 781 O LYS A 49 -6.888 -1.395 0.248 1.00 0.00 O ATOM 782 CB LYS A 49 -9.160 -0.018 -1.542 1.00 0.00 C ATOM 783 CG LYS A 49 -10.464 0.761 -1.779 1.00 0.00 C ATOM 784 CD LYS A 49 -11.682 -0.162 -1.983 1.00 0.00 C ATOM 785 CE LYS A 49 -12.936 0.615 -2.403 1.00 0.00 C ATOM 786 NZ LYS A 49 -13.290 1.691 -1.433 1.00 0.00 N ATOM 0 H LYS A 49 -8.738 0.646 0.954 1.00 0.00 H new ATOM 0 HA LYS A 49 -10.037 -1.646 -0.415 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -8.345 0.694 -1.413 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -8.934 -0.603 -2.434 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -10.650 1.417 -0.929 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -10.347 1.399 -2.655 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -11.447 -0.907 -2.743 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -11.885 -0.703 -1.058 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -12.775 1.055 -3.387 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -13.774 -0.076 -2.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -14.321 1.826 -1.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -12.969 1.420 -0.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -12.827 2.579 -1.715 1.00 0.00 H new ATOM 800 N PRO A 50 -7.969 -3.117 -0.794 1.00 0.00 N ATOM 801 CA PRO A 50 -6.851 -4.088 -0.686 1.00 0.00 C ATOM 802 C PRO A 50 -5.658 -3.715 -1.591 1.00 0.00 C ATOM 803 O PRO A 50 -5.810 -3.566 -2.812 1.00 0.00 O ATOM 804 CB PRO A 50 -7.509 -5.420 -1.120 1.00 0.00 C ATOM 805 CG PRO A 50 -8.564 -5.005 -2.095 1.00 0.00 C ATOM 806 CD PRO A 50 -9.111 -3.692 -1.566 1.00 0.00 C ATOM 0 HA PRO A 50 -6.420 -4.125 0.314 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -6.784 -6.092 -1.579 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -7.938 -5.948 -0.269 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -8.148 -4.882 -3.095 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -9.350 -5.757 -2.167 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -9.419 -3.031 -2.376 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.984 -3.848 -0.932 1.00 0.00 H new ATOM 814 N LEU A 51 -4.475 -3.544 -0.970 1.00 0.00 N ATOM 815 CA LEU A 51 -3.243 -3.138 -1.675 1.00 0.00 C ATOM 816 C LEU A 51 -2.298 -4.327 -1.810 1.00 0.00 C ATOM 817 O LEU A 51 -1.760 -4.580 -2.897 1.00 0.00 O ATOM 818 CB LEU A 51 -2.567 -1.962 -0.921 1.00 0.00 C ATOM 819 CG LEU A 51 -3.497 -0.734 -0.654 1.00 0.00 C ATOM 820 CD1 LEU A 51 -2.707 0.481 -0.138 1.00 0.00 C ATOM 821 CD2 LEU A 51 -4.341 -0.394 -1.906 1.00 0.00 C ATOM 0 H LEU A 51 -4.346 -3.683 0.032 1.00 0.00 H new ATOM 0 HA LEU A 51 -3.496 -2.797 -2.679 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -2.191 -2.329 0.034 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -1.704 -1.628 -1.497 1.00 0.00 H new ATOM 0 HG LEU A 51 -4.191 -1.010 0.140 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -3.390 1.313 0.035 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -2.208 0.221 0.796 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -1.962 0.772 -0.879 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -4.979 0.464 -1.693 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -3.678 -0.156 -2.738 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.961 -1.251 -2.170 1.00 0.00 H new ATOM 833 N PHE A 52 -2.118 -5.060 -0.698 1.00 0.00 N ATOM 834 CA PHE A 52 -1.370 -6.328 -0.689 1.00 0.00 C ATOM 835 C PHE A 52 -1.552 -7.051 0.651 1.00 0.00 C ATOM 836 O PHE A 52 -1.875 -6.432 1.648 1.00 0.00 O ATOM 837 CB PHE A 52 0.146 -6.131 -1.009 1.00 0.00 C ATOM 838 CG PHE A 52 0.861 -7.445 -1.317 1.00 0.00 C ATOM 839 CD1 PHE A 52 0.451 -8.236 -2.391 1.00 0.00 C ATOM 840 CD2 PHE A 52 1.900 -7.911 -0.516 1.00 0.00 C ATOM 841 CE1 PHE A 52 1.061 -9.445 -2.651 1.00 0.00 C ATOM 842 CE2 PHE A 52 2.512 -9.114 -0.781 1.00 0.00 C ATOM 843 CZ PHE A 52 2.089 -9.883 -1.848 1.00 0.00 C ATOM 0 H PHE A 52 -2.485 -4.792 0.215 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.783 -6.948 -1.485 1.00 0.00 H new ATOM 0 HB2 PHE A 52 0.249 -5.458 -1.861 1.00 0.00 H new ATOM 0 HB3 PHE A 52 0.632 -5.648 -0.161 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -0.354 -7.897 -3.026 1.00 0.00 H new ATOM 0 HD2 PHE A 52 2.230 -7.320 0.325 1.00 0.00 H new ATOM 0 HE1 PHE A 52 0.732 -10.048 -3.485 1.00 0.00 H new ATOM 0 HE2 PHE A 52 3.323 -9.457 -0.155 1.00 0.00 H new ATOM 0 HZ PHE A 52 2.566 -10.830 -2.052 1.00 0.00 H new ATOM 853 N THR A 53 -1.323 -8.369 0.639 1.00 0.00 N ATOM 854 CA THR A 53 -1.498 -9.247 1.804 1.00 0.00 C ATOM 855 C THR A 53 -0.287 -9.192 2.760 1.00 0.00 C ATOM 856 O THR A 53 0.863 -9.053 2.331 1.00 0.00 O ATOM 857 CB THR A 53 -1.754 -10.733 1.342 1.00 0.00 C ATOM 858 OG1 THR A 53 -1.581 -11.657 2.436 1.00 0.00 O ATOM 859 CG2 THR A 53 -0.855 -11.169 0.175 1.00 0.00 C ATOM 0 H THR A 53 -1.006 -8.865 -0.194 1.00 0.00 H new ATOM 0 HA THR A 53 -2.368 -8.884 2.352 1.00 0.00 H new ATOM 0 HB THR A 53 -2.787 -10.754 0.995 1.00 0.00 H new ATOM 0 HG1 THR A 53 -2.267 -11.491 3.116 1.00 0.00 H new ATOM 0 HG21 THR A 53 -1.082 -12.201 -0.093 1.00 0.00 H new ATOM 0 HG22 THR A 53 -1.035 -10.523 -0.684 1.00 0.00 H new ATOM 0 HG23 THR A 53 0.191 -11.094 0.473 1.00 0.00 H new ATOM 867 N SER A 54 -0.589 -9.293 4.068 1.00 0.00 N ATOM 868 CA SER A 54 0.416 -9.460 5.134 1.00 0.00 C ATOM 869 C SER A 54 0.868 -10.932 5.264 1.00 0.00 C ATOM 870 O SER A 54 1.966 -11.205 5.748 1.00 0.00 O ATOM 871 CB SER A 54 -0.154 -8.945 6.478 1.00 0.00 C ATOM 872 OG SER A 54 0.831 -8.945 7.511 1.00 0.00 O ATOM 0 H SER A 54 -1.547 -9.261 4.418 1.00 0.00 H new ATOM 0 HA SER A 54 1.295 -8.872 4.868 1.00 0.00 H new ATOM 0 HB2 SER A 54 -0.540 -7.934 6.345 1.00 0.00 H new ATOM 0 HB3 SER A 54 -0.995 -9.570 6.779 1.00 0.00 H new ATOM 0 HG SER A 54 1.184 -8.038 7.626 1.00 0.00 H new ATOM 878 N LYS A 55 0.009 -11.877 4.849 1.00 0.00 N ATOM 879 CA LYS A 55 0.305 -13.328 4.951 1.00 0.00 C ATOM 880 C LYS A 55 1.301 -13.784 3.846 1.00 0.00 C ATOM 881 O LYS A 55 1.802 -14.916 3.874 1.00 0.00 O ATOM 882 CB LYS A 55 -1.021 -14.144 4.904 1.00 0.00 C ATOM 883 CG LYS A 55 -0.943 -15.558 5.537 1.00 0.00 C ATOM 884 CD LYS A 55 -2.286 -16.323 5.455 1.00 0.00 C ATOM 885 CE LYS A 55 -2.341 -17.551 6.377 1.00 0.00 C ATOM 886 NZ LYS A 55 -1.271 -18.538 6.083 1.00 0.00 N ATOM 0 H LYS A 55 -0.901 -11.668 4.437 1.00 0.00 H new ATOM 0 HA LYS A 55 0.791 -13.518 5.908 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -1.798 -13.576 5.415 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -1.332 -14.244 3.864 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.169 -16.136 5.032 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -0.644 -15.468 6.581 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -3.099 -15.645 5.715 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -2.453 -16.642 4.426 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -2.254 -17.226 7.414 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -3.313 -18.034 6.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -1.365 -19.353 6.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -1.356 -18.859 5.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -0.341 -18.094 6.223 1.00 0.00 H new ATOM 900 N ASP A 56 1.581 -12.888 2.874 1.00 0.00 N ATOM 901 CA ASP A 56 2.625 -13.095 1.845 1.00 0.00 C ATOM 902 C ASP A 56 3.561 -11.863 1.827 1.00 0.00 C ATOM 903 O ASP A 56 4.048 -11.429 0.775 1.00 0.00 O ATOM 904 CB ASP A 56 1.970 -13.367 0.454 1.00 0.00 C ATOM 905 CG ASP A 56 2.967 -13.803 -0.644 1.00 0.00 C ATOM 906 OD1 ASP A 56 3.542 -14.906 -0.531 1.00 0.00 O ATOM 907 OD2 ASP A 56 3.173 -13.057 -1.630 1.00 0.00 O ATOM 0 H ASP A 56 1.089 -11.999 2.780 1.00 0.00 H new ATOM 0 HA ASP A 56 3.224 -13.973 2.084 1.00 0.00 H new ATOM 0 HB2 ASP A 56 1.211 -14.141 0.568 1.00 0.00 H new ATOM 0 HB3 ASP A 56 1.457 -12.464 0.124 1.00 0.00 H new ATOM 912 N LYS A 57 3.841 -11.310 3.026 1.00 0.00 N ATOM 913 CA LYS A 57 4.797 -10.196 3.174 1.00 0.00 C ATOM 914 C LYS A 57 6.163 -10.744 3.605 1.00 0.00 C ATOM 915 O LYS A 57 6.271 -11.880 4.090 1.00 0.00 O ATOM 916 CB LYS A 57 4.314 -9.128 4.199 1.00 0.00 C ATOM 917 CG LYS A 57 4.551 -9.474 5.694 1.00 0.00 C ATOM 918 CD LYS A 57 4.224 -8.299 6.639 1.00 0.00 C ATOM 919 CE LYS A 57 5.172 -7.090 6.459 1.00 0.00 C ATOM 920 NZ LYS A 57 6.575 -7.401 6.849 1.00 0.00 N ATOM 0 H LYS A 57 3.419 -11.617 3.902 1.00 0.00 H new ATOM 0 HA LYS A 57 4.875 -9.703 2.205 1.00 0.00 H new ATOM 0 HB2 LYS A 57 4.817 -8.186 3.979 1.00 0.00 H new ATOM 0 HB3 LYS A 57 3.247 -8.963 4.048 1.00 0.00 H new ATOM 0 HG2 LYS A 57 3.938 -10.334 5.965 1.00 0.00 H new ATOM 0 HG3 LYS A 57 5.591 -9.768 5.834 1.00 0.00 H new ATOM 0 HD2 LYS A 57 3.197 -7.976 6.465 1.00 0.00 H new ATOM 0 HD3 LYS A 57 4.279 -8.645 7.671 1.00 0.00 H new ATOM 0 HE2 LYS A 57 5.151 -6.768 5.418 1.00 0.00 H new ATOM 0 HE3 LYS A 57 4.808 -6.255 7.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 6.961 -6.616 7.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 6.593 -8.274 7.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 7.152 -7.530 5.994 1.00 0.00 H new ATOM 934 N PHE A 58 7.198 -9.935 3.388 1.00 0.00 N ATOM 935 CA PHE A 58 8.534 -10.136 3.977 1.00 0.00 C ATOM 936 C PHE A 58 9.052 -8.789 4.501 1.00 0.00 C ATOM 937 O PHE A 58 8.472 -7.733 4.196 1.00 0.00 O ATOM 938 CB PHE A 58 9.516 -10.817 2.974 1.00 0.00 C ATOM 939 CG PHE A 58 9.663 -10.163 1.594 1.00 0.00 C ATOM 940 CD1 PHE A 58 8.650 -10.276 0.638 1.00 0.00 C ATOM 941 CD2 PHE A 58 10.829 -9.483 1.233 1.00 0.00 C ATOM 942 CE1 PHE A 58 8.792 -9.727 -0.620 1.00 0.00 C ATOM 943 CE2 PHE A 58 10.967 -8.929 -0.025 1.00 0.00 C ATOM 944 CZ PHE A 58 9.952 -9.057 -0.953 1.00 0.00 C ATOM 0 H PHE A 58 7.139 -9.109 2.792 1.00 0.00 H new ATOM 0 HA PHE A 58 8.462 -10.827 4.817 1.00 0.00 H new ATOM 0 HB2 PHE A 58 10.502 -10.856 3.438 1.00 0.00 H new ATOM 0 HB3 PHE A 58 9.192 -11.847 2.828 1.00 0.00 H new ATOM 0 HD1 PHE A 58 7.740 -10.802 0.888 1.00 0.00 H new ATOM 0 HD2 PHE A 58 11.634 -9.389 1.947 1.00 0.00 H new ATOM 0 HE1 PHE A 58 7.996 -9.821 -1.344 1.00 0.00 H new ATOM 0 HE2 PHE A 58 11.870 -8.395 -0.283 1.00 0.00 H new ATOM 0 HZ PHE A 58 10.066 -8.633 -1.940 1.00 0.00 H new ATOM 954 N ASP A 59 10.100 -8.835 5.339 1.00 0.00 N ATOM 955 CA ASP A 59 10.707 -7.628 5.935 1.00 0.00 C ATOM 956 C ASP A 59 11.730 -7.017 4.986 1.00 0.00 C ATOM 957 O ASP A 59 12.326 -7.715 4.156 1.00 0.00 O ATOM 958 CB ASP A 59 11.370 -7.934 7.306 1.00 0.00 C ATOM 959 CG ASP A 59 10.368 -8.351 8.394 1.00 0.00 C ATOM 960 OD1 ASP A 59 9.252 -7.787 8.439 1.00 0.00 O ATOM 961 OD2 ASP A 59 10.695 -9.235 9.223 1.00 0.00 O ATOM 0 H ASP A 59 10.551 -9.705 5.623 1.00 0.00 H new ATOM 0 HA ASP A 59 9.903 -6.911 6.103 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.104 -8.729 7.176 1.00 0.00 H new ATOM 0 HB3 ASP A 59 11.913 -7.051 7.643 1.00 0.00 H new ATOM 966 N SER A 60 11.924 -5.708 5.129 1.00 0.00 N ATOM 967 CA SER A 60 12.777 -4.911 4.256 1.00 0.00 C ATOM 968 C SER A 60 13.983 -4.387 5.036 1.00 0.00 C ATOM 969 O SER A 60 13.830 -3.815 6.124 1.00 0.00 O ATOM 970 CB SER A 60 11.966 -3.740 3.665 1.00 0.00 C ATOM 971 OG SER A 60 12.748 -2.959 2.780 1.00 0.00 O ATOM 0 H SER A 60 11.483 -5.163 5.870 1.00 0.00 H new ATOM 0 HA SER A 60 13.139 -5.536 3.440 1.00 0.00 H new ATOM 0 HB2 SER A 60 11.096 -4.129 3.136 1.00 0.00 H new ATOM 0 HB3 SER A 60 11.592 -3.111 4.473 1.00 0.00 H new ATOM 0 HG SER A 60 12.275 -2.858 1.928 1.00 0.00 H new ATOM 977 N GLN A 61 15.185 -4.596 4.474 1.00 0.00 N ATOM 978 CA GLN A 61 16.428 -3.985 4.976 1.00 0.00 C ATOM 979 C GLN A 61 16.431 -2.470 4.691 1.00 0.00 C ATOM 980 O GLN A 61 17.173 -1.717 5.313 1.00 0.00 O ATOM 981 CB GLN A 61 17.655 -4.679 4.336 1.00 0.00 C ATOM 982 CG GLN A 61 17.686 -4.654 2.794 1.00 0.00 C ATOM 983 CD GLN A 61 18.786 -5.535 2.203 1.00 0.00 C ATOM 984 OE1 GLN A 61 19.902 -5.086 1.951 1.00 0.00 O ATOM 985 NE2 GLN A 61 18.480 -6.805 2.009 1.00 0.00 N ATOM 0 H GLN A 61 15.323 -5.193 3.659 1.00 0.00 H new ATOM 0 HA GLN A 61 16.485 -4.123 6.056 1.00 0.00 H new ATOM 0 HB2 GLN A 61 18.560 -4.201 4.711 1.00 0.00 H new ATOM 0 HB3 GLN A 61 17.681 -5.717 4.668 1.00 0.00 H new ATOM 0 HG2 GLN A 61 16.720 -4.983 2.412 1.00 0.00 H new ATOM 0 HG3 GLN A 61 17.829 -3.628 2.456 1.00 0.00 H new ATOM 0 HE21 GLN A 61 17.543 -7.143 2.229 1.00 0.00 H new ATOM 0 HE22 GLN A 61 19.180 -7.448 1.639 1.00 0.00 H new ATOM 994 N CYS A 62 15.581 -2.044 3.739 1.00 0.00 N ATOM 995 CA CYS A 62 15.335 -0.622 3.451 1.00 0.00 C ATOM 996 C CYS A 62 14.397 -0.002 4.518 1.00 0.00 C ATOM 997 O CYS A 62 14.334 1.223 4.662 1.00 0.00 O ATOM 998 CB CYS A 62 14.714 -0.490 2.048 1.00 0.00 C ATOM 999 SG CYS A 62 15.702 -1.249 0.743 1.00 0.00 S ATOM 0 H CYS A 62 15.045 -2.679 3.147 1.00 0.00 H new ATOM 0 HA CYS A 62 16.281 -0.081 3.481 1.00 0.00 H new ATOM 0 HB2 CYS A 62 13.724 -0.946 2.054 1.00 0.00 H new ATOM 0 HB3 CYS A 62 14.576 0.567 1.819 1.00 0.00 H new ATOM 0 HG CYS A 62 15.104 -1.092 -0.401 1.00 0.00 H new ATOM 1005 N GLY A 63 13.660 -0.869 5.248 1.00 0.00 N ATOM 1006 CA GLY A 63 12.762 -0.439 6.329 1.00 0.00 C ATOM 1007 C GLY A 63 11.316 -0.331 5.860 1.00 0.00 C ATOM 1008 O GLY A 63 10.402 -0.903 6.471 1.00 0.00 O ATOM 0 H GLY A 63 13.674 -1.878 5.101 1.00 0.00 H new ATOM 0 HA2 GLY A 63 12.823 -1.148 7.155 1.00 0.00 H new ATOM 0 HA3 GLY A 63 13.092 0.527 6.712 1.00 0.00 H new ATOM 1012 N TRP A 64 11.119 0.416 4.765 1.00 0.00 N ATOM 1013 CA TRP A 64 9.808 0.582 4.126 1.00 0.00 C ATOM 1014 C TRP A 64 9.386 -0.728 3.447 1.00 0.00 C ATOM 1015 O TRP A 64 10.167 -1.258 2.653 1.00 0.00 O ATOM 1016 CB TRP A 64 9.858 1.754 3.112 1.00 0.00 C ATOM 1017 CG TRP A 64 10.030 3.072 3.804 1.00 0.00 C ATOM 1018 CD1 TRP A 64 9.063 3.768 4.452 1.00 0.00 C ATOM 1019 CD2 TRP A 64 11.239 3.834 3.949 1.00 0.00 C ATOM 1020 NE1 TRP A 64 9.590 4.893 5.000 1.00 0.00 N ATOM 1021 CE2 TRP A 64 10.914 4.970 4.700 1.00 0.00 C ATOM 1022 CE3 TRP A 64 12.558 3.666 3.519 1.00 0.00 C ATOM 1023 CZ2 TRP A 64 11.849 5.940 5.037 1.00 0.00 C ATOM 1024 CZ3 TRP A 64 13.490 4.629 3.847 1.00 0.00 C ATOM 1025 CH2 TRP A 64 13.131 5.754 4.606 1.00 0.00 C ATOM 0 H TRP A 64 11.869 0.924 4.296 1.00 0.00 H new ATOM 0 HA TRP A 64 9.063 0.824 4.884 1.00 0.00 H new ATOM 0 HB2 TRP A 64 10.681 1.598 2.414 1.00 0.00 H new ATOM 0 HB3 TRP A 64 8.940 1.767 2.524 1.00 0.00 H new ATOM 0 HD1 TRP A 64 8.027 3.471 4.522 1.00 0.00 H new ATOM 0 HE1 TRP A 64 9.072 5.576 5.552 1.00 0.00 H new ATOM 0 HE3 TRP A 64 12.842 2.799 2.941 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 11.573 6.808 5.617 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 14.511 4.516 3.515 1.00 0.00 H new ATOM 0 HH2 TRP A 64 13.884 6.487 4.854 1.00 0.00 H new ATOM 1036 N PRO A 65 8.141 -1.255 3.745 1.00 0.00 N ATOM 1037 CA PRO A 65 7.694 -2.587 3.268 1.00 0.00 C ATOM 1038 C PRO A 65 7.826 -2.742 1.739 1.00 0.00 C ATOM 1039 O PRO A 65 7.144 -2.061 0.969 1.00 0.00 O ATOM 1040 CB PRO A 65 6.210 -2.655 3.726 1.00 0.00 C ATOM 1041 CG PRO A 65 6.134 -1.722 4.896 1.00 0.00 C ATOM 1042 CD PRO A 65 7.083 -0.591 4.567 1.00 0.00 C ATOM 0 HA PRO A 65 8.304 -3.396 3.671 1.00 0.00 H new ATOM 0 HB2 PRO A 65 5.534 -2.347 2.928 1.00 0.00 H new ATOM 0 HB3 PRO A 65 5.928 -3.669 4.008 1.00 0.00 H new ATOM 0 HG2 PRO A 65 5.118 -1.354 5.040 1.00 0.00 H new ATOM 0 HG3 PRO A 65 6.425 -2.224 5.819 1.00 0.00 H new ATOM 0 HD2 PRO A 65 6.584 0.204 4.013 1.00 0.00 H new ATOM 0 HD3 PRO A 65 7.498 -0.140 5.468 1.00 0.00 H new ATOM 1050 N SER A 66 8.733 -3.638 1.339 1.00 0.00 N ATOM 1051 CA SER A 66 9.086 -3.894 -0.054 1.00 0.00 C ATOM 1052 C SER A 66 8.491 -5.236 -0.489 1.00 0.00 C ATOM 1053 O SER A 66 9.018 -6.294 -0.155 1.00 0.00 O ATOM 1054 CB SER A 66 10.626 -3.903 -0.178 1.00 0.00 C ATOM 1055 OG SER A 66 11.197 -2.688 0.288 1.00 0.00 O ATOM 0 H SER A 66 9.254 -4.219 1.996 1.00 0.00 H new ATOM 0 HA SER A 66 8.683 -3.116 -0.703 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.032 -4.738 0.392 1.00 0.00 H new ATOM 0 HB3 SER A 66 10.907 -4.061 -1.219 1.00 0.00 H new ATOM 0 HG SER A 66 10.661 -2.338 1.030 1.00 0.00 H new ATOM 1061 N PHE A 67 7.355 -5.182 -1.169 1.00 0.00 N ATOM 1062 CA PHE A 67 6.652 -6.372 -1.669 1.00 0.00 C ATOM 1063 C PHE A 67 7.060 -6.647 -3.130 1.00 0.00 C ATOM 1064 O PHE A 67 7.586 -5.763 -3.818 1.00 0.00 O ATOM 1065 CB PHE A 67 5.120 -6.170 -1.552 1.00 0.00 C ATOM 1066 CG PHE A 67 4.646 -5.717 -0.163 1.00 0.00 C ATOM 1067 CD1 PHE A 67 4.886 -6.501 0.968 1.00 0.00 C ATOM 1068 CD2 PHE A 67 3.958 -4.515 0.009 1.00 0.00 C ATOM 1069 CE1 PHE A 67 4.451 -6.093 2.215 1.00 0.00 C ATOM 1070 CE2 PHE A 67 3.525 -4.113 1.254 1.00 0.00 C ATOM 1071 CZ PHE A 67 3.769 -4.902 2.357 1.00 0.00 C ATOM 0 H PHE A 67 6.884 -4.306 -1.395 1.00 0.00 H new ATOM 0 HA PHE A 67 6.931 -7.236 -1.066 1.00 0.00 H new ATOM 0 HB2 PHE A 67 4.805 -5.431 -2.289 1.00 0.00 H new ATOM 0 HB3 PHE A 67 4.622 -7.106 -1.806 1.00 0.00 H new ATOM 0 HD1 PHE A 67 5.417 -7.436 0.867 1.00 0.00 H new ATOM 0 HD2 PHE A 67 3.761 -3.889 -0.849 1.00 0.00 H new ATOM 0 HE1 PHE A 67 4.646 -6.708 3.081 1.00 0.00 H new ATOM 0 HE2 PHE A 67 2.994 -3.179 1.365 1.00 0.00 H new ATOM 0 HZ PHE A 67 3.427 -4.588 3.332 1.00 0.00 H new ATOM 1081 N THR A 68 6.798 -7.874 -3.589 1.00 0.00 N ATOM 1082 CA THR A 68 7.162 -8.320 -4.949 1.00 0.00 C ATOM 1083 C THR A 68 5.959 -8.204 -5.905 1.00 0.00 C ATOM 1084 O THR A 68 6.118 -7.971 -7.113 1.00 0.00 O ATOM 1085 CB THR A 68 7.676 -9.794 -4.899 1.00 0.00 C ATOM 1086 OG1 THR A 68 8.669 -9.923 -3.867 1.00 0.00 O ATOM 1087 CG2 THR A 68 8.290 -10.247 -6.229 1.00 0.00 C ATOM 0 H THR A 68 6.329 -8.590 -3.034 1.00 0.00 H new ATOM 0 HA THR A 68 7.956 -7.676 -5.327 1.00 0.00 H new ATOM 0 HB THR A 68 6.813 -10.427 -4.693 1.00 0.00 H new ATOM 0 HG1 THR A 68 8.990 -10.849 -3.835 1.00 0.00 H new ATOM 0 HG21 THR A 68 8.631 -11.278 -6.140 1.00 0.00 H new ATOM 0 HG22 THR A 68 7.540 -10.180 -7.017 1.00 0.00 H new ATOM 0 HG23 THR A 68 9.136 -9.605 -6.477 1.00 0.00 H new ATOM 1095 N LYS A 69 4.742 -8.327 -5.339 1.00 0.00 N ATOM 1096 CA LYS A 69 3.481 -8.340 -6.105 1.00 0.00 C ATOM 1097 C LYS A 69 2.513 -7.299 -5.507 1.00 0.00 C ATOM 1098 O LYS A 69 2.566 -7.037 -4.302 1.00 0.00 O ATOM 1099 CB LYS A 69 2.819 -9.754 -6.069 1.00 0.00 C ATOM 1100 CG LYS A 69 3.666 -10.887 -6.695 1.00 0.00 C ATOM 1101 CD LYS A 69 2.912 -12.238 -6.748 1.00 0.00 C ATOM 1102 CE LYS A 69 2.500 -12.757 -5.358 1.00 0.00 C ATOM 1103 NZ LYS A 69 3.671 -13.007 -4.475 1.00 0.00 N ATOM 0 H LYS A 69 4.606 -8.421 -4.332 1.00 0.00 H new ATOM 0 HA LYS A 69 3.701 -8.093 -7.144 1.00 0.00 H new ATOM 0 HB2 LYS A 69 2.604 -10.012 -5.032 1.00 0.00 H new ATOM 0 HB3 LYS A 69 1.863 -9.705 -6.590 1.00 0.00 H new ATOM 0 HG2 LYS A 69 3.960 -10.600 -7.705 1.00 0.00 H new ATOM 0 HG3 LYS A 69 4.583 -11.010 -6.119 1.00 0.00 H new ATOM 0 HD2 LYS A 69 2.021 -12.126 -7.366 1.00 0.00 H new ATOM 0 HD3 LYS A 69 3.545 -12.981 -7.233 1.00 0.00 H new ATOM 0 HE2 LYS A 69 1.839 -12.031 -4.884 1.00 0.00 H new ATOM 0 HE3 LYS A 69 1.931 -13.680 -5.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 3.341 -13.207 -3.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 4.208 -13.822 -4.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 4.284 -12.167 -4.464 1.00 0.00 H new ATOM 1117 N PRO A 70 1.657 -6.643 -6.341 1.00 0.00 N ATOM 1118 CA PRO A 70 0.514 -5.849 -5.859 1.00 0.00 C ATOM 1119 C PRO A 70 -0.820 -6.628 -5.908 1.00 0.00 C ATOM 1120 O PRO A 70 -0.868 -7.793 -6.333 1.00 0.00 O ATOM 1121 CB PRO A 70 0.515 -4.680 -6.873 1.00 0.00 C ATOM 1122 CG PRO A 70 0.906 -5.322 -8.182 1.00 0.00 C ATOM 1123 CD PRO A 70 1.771 -6.540 -7.829 1.00 0.00 C ATOM 0 HA PRO A 70 0.603 -5.553 -4.814 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -0.466 -4.209 -6.938 1.00 0.00 H new ATOM 0 HB3 PRO A 70 1.223 -3.903 -6.584 1.00 0.00 H new ATOM 0 HG2 PRO A 70 0.023 -5.624 -8.745 1.00 0.00 H new ATOM 0 HG3 PRO A 70 1.459 -4.622 -8.808 1.00 0.00 H new ATOM 0 HD2 PRO A 70 1.409 -7.443 -8.321 1.00 0.00 H new ATOM 0 HD3 PRO A 70 2.806 -6.399 -8.142 1.00 0.00 H new ATOM 1131 N ILE A 71 -1.889 -5.966 -5.442 1.00 0.00 N ATOM 1132 CA ILE A 71 -3.269 -6.337 -5.760 1.00 0.00 C ATOM 1133 C ILE A 71 -3.728 -5.399 -6.878 1.00 0.00 C ATOM 1134 O ILE A 71 -3.827 -4.182 -6.685 1.00 0.00 O ATOM 1135 CB ILE A 71 -4.224 -6.269 -4.506 1.00 0.00 C ATOM 1136 CG1 ILE A 71 -3.826 -7.379 -3.479 1.00 0.00 C ATOM 1137 CG2 ILE A 71 -5.717 -6.382 -4.910 1.00 0.00 C ATOM 1138 CD1 ILE A 71 -4.678 -7.422 -2.225 1.00 0.00 C ATOM 0 H ILE A 71 -1.816 -5.153 -4.830 1.00 0.00 H new ATOM 0 HA ILE A 71 -3.312 -7.378 -6.082 1.00 0.00 H new ATOM 0 HB ILE A 71 -4.102 -5.293 -4.035 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -3.883 -8.349 -3.973 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -2.786 -7.230 -3.189 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -6.340 -6.331 -4.017 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -5.975 -5.563 -5.581 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -5.886 -7.332 -5.416 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -4.327 -8.223 -1.574 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -4.603 -6.469 -1.701 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -5.717 -7.605 -2.497 1.00 0.00 H new ATOM 1150 N GLU A 72 -4.021 -5.993 -8.037 1.00 0.00 N ATOM 1151 CA GLU A 72 -4.173 -5.283 -9.322 1.00 0.00 C ATOM 1152 C GLU A 72 -5.418 -4.376 -9.354 1.00 0.00 C ATOM 1153 O GLU A 72 -5.491 -3.459 -10.175 1.00 0.00 O ATOM 1154 CB GLU A 72 -4.241 -6.327 -10.468 1.00 0.00 C ATOM 1155 CG GLU A 72 -3.045 -7.296 -10.510 1.00 0.00 C ATOM 1156 CD GLU A 72 -3.210 -8.387 -11.577 1.00 0.00 C ATOM 1157 OE1 GLU A 72 -3.929 -9.375 -11.319 1.00 0.00 O ATOM 1158 OE2 GLU A 72 -2.648 -8.251 -12.685 1.00 0.00 O ATOM 0 H GLU A 72 -4.163 -7.000 -8.117 1.00 0.00 H new ATOM 0 HA GLU A 72 -3.309 -4.631 -9.450 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -5.159 -6.905 -10.364 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -4.302 -5.801 -11.421 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -2.133 -6.734 -10.708 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -2.926 -7.763 -9.533 1.00 0.00 H new ATOM 1165 N GLU A 73 -6.355 -4.629 -8.425 1.00 0.00 N ATOM 1166 CA GLU A 73 -7.681 -4.001 -8.404 1.00 0.00 C ATOM 1167 C GLU A 73 -7.590 -2.484 -8.177 1.00 0.00 C ATOM 1168 O GLU A 73 -8.224 -1.701 -8.883 1.00 0.00 O ATOM 1169 CB GLU A 73 -8.549 -4.647 -7.278 1.00 0.00 C ATOM 1170 CG GLU A 73 -8.631 -6.190 -7.314 1.00 0.00 C ATOM 1171 CD GLU A 73 -9.117 -6.742 -8.664 1.00 0.00 C ATOM 1172 OE1 GLU A 73 -10.285 -6.497 -9.030 1.00 0.00 O ATOM 1173 OE2 GLU A 73 -8.334 -7.413 -9.369 1.00 0.00 O ATOM 0 H GLU A 73 -6.208 -5.285 -7.658 1.00 0.00 H new ATOM 0 HA GLU A 73 -8.144 -4.167 -9.377 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -8.147 -4.343 -6.312 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -9.560 -4.244 -7.344 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -7.647 -6.604 -7.093 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -9.304 -6.530 -6.527 1.00 0.00 H new ATOM 1180 N GLU A 74 -6.790 -2.086 -7.178 1.00 0.00 N ATOM 1181 CA GLU A 74 -6.753 -0.691 -6.685 1.00 0.00 C ATOM 1182 C GLU A 74 -5.453 0.038 -7.048 1.00 0.00 C ATOM 1183 O GLU A 74 -5.306 1.235 -6.766 1.00 0.00 O ATOM 1184 CB GLU A 74 -6.951 -0.717 -5.151 1.00 0.00 C ATOM 1185 CG GLU A 74 -8.232 -1.453 -4.707 1.00 0.00 C ATOM 1186 CD GLU A 74 -9.521 -0.862 -5.322 1.00 0.00 C ATOM 1187 OE1 GLU A 74 -9.826 0.321 -5.066 1.00 0.00 O ATOM 1188 OE2 GLU A 74 -10.227 -1.573 -6.078 1.00 0.00 O ATOM 0 H GLU A 74 -6.152 -2.713 -6.688 1.00 0.00 H new ATOM 0 HA GLU A 74 -7.553 -0.133 -7.171 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -6.088 -1.197 -4.690 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -6.983 0.307 -4.780 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -8.154 -2.504 -4.985 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.306 -1.416 -3.620 1.00 0.00 H new ATOM 1195 N VAL A 75 -4.527 -0.672 -7.698 1.00 0.00 N ATOM 1196 CA VAL A 75 -3.174 -0.166 -7.958 1.00 0.00 C ATOM 1197 C VAL A 75 -2.991 0.190 -9.439 1.00 0.00 C ATOM 1198 O VAL A 75 -3.317 -0.608 -10.327 1.00 0.00 O ATOM 1199 CB VAL A 75 -2.104 -1.215 -7.490 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -0.667 -0.769 -7.843 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -2.242 -1.478 -5.971 1.00 0.00 C ATOM 0 H VAL A 75 -4.692 -1.612 -8.059 1.00 0.00 H new ATOM 0 HA VAL A 75 -3.032 0.749 -7.384 1.00 0.00 H new ATOM 0 HB VAL A 75 -2.292 -2.145 -8.027 1.00 0.00 H new ATOM 0 HG11 VAL A 75 0.042 -1.523 -7.502 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.578 -0.650 -8.923 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -0.450 0.181 -7.354 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -1.494 -2.207 -5.659 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -2.091 -0.547 -5.425 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -3.238 -1.866 -5.758 1.00 0.00 H new ATOM 1211 N GLU A 76 -2.467 1.407 -9.680 1.00 0.00 N ATOM 1212 CA GLU A 76 -2.141 1.925 -11.017 1.00 0.00 C ATOM 1213 C GLU A 76 -0.645 2.268 -11.031 1.00 0.00 C ATOM 1214 O GLU A 76 -0.221 3.114 -10.260 1.00 0.00 O ATOM 1215 CB GLU A 76 -2.964 3.217 -11.298 1.00 0.00 C ATOM 1216 CG GLU A 76 -4.501 3.071 -11.228 1.00 0.00 C ATOM 1217 CD GLU A 76 -5.128 2.393 -12.453 1.00 0.00 C ATOM 1218 OE1 GLU A 76 -5.053 2.981 -13.562 1.00 0.00 O ATOM 1219 OE2 GLU A 76 -5.728 1.303 -12.322 1.00 0.00 O ATOM 0 H GLU A 76 -2.255 2.069 -8.933 1.00 0.00 H new ATOM 0 HA GLU A 76 -2.379 1.183 -11.779 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -2.659 3.981 -10.583 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -2.699 3.584 -12.289 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -4.759 2.497 -10.338 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -4.943 4.060 -11.109 1.00 0.00 H new ATOM 1226 N GLU A 77 0.152 1.634 -11.898 1.00 0.00 N ATOM 1227 CA GLU A 77 1.596 1.933 -12.010 1.00 0.00 C ATOM 1228 C GLU A 77 1.799 3.137 -12.946 1.00 0.00 C ATOM 1229 O GLU A 77 1.398 3.099 -14.116 1.00 0.00 O ATOM 1230 CB GLU A 77 2.396 0.683 -12.486 1.00 0.00 C ATOM 1231 CG GLU A 77 1.913 0.037 -13.800 1.00 0.00 C ATOM 1232 CD GLU A 77 2.743 -1.183 -14.209 1.00 0.00 C ATOM 1233 OE1 GLU A 77 2.431 -2.309 -13.764 1.00 0.00 O ATOM 1234 OE2 GLU A 77 3.709 -1.030 -14.987 1.00 0.00 O ATOM 0 H GLU A 77 -0.173 0.908 -12.536 1.00 0.00 H new ATOM 0 HA GLU A 77 1.985 2.193 -11.026 1.00 0.00 H new ATOM 0 HB2 GLU A 77 3.441 0.968 -12.606 1.00 0.00 H new ATOM 0 HB3 GLU A 77 2.360 -0.070 -11.698 1.00 0.00 H new ATOM 0 HG2 GLU A 77 0.870 -0.261 -13.690 1.00 0.00 H new ATOM 0 HG3 GLU A 77 1.950 0.779 -14.598 1.00 0.00 H new ATOM 1241 N LYS A 78 2.399 4.220 -12.419 1.00 0.00 N ATOM 1242 CA LYS A 78 2.520 5.489 -13.145 1.00 0.00 C ATOM 1243 C LYS A 78 4.009 5.857 -13.276 1.00 0.00 C ATOM 1244 O LYS A 78 4.631 6.324 -12.321 1.00 0.00 O ATOM 1245 CB LYS A 78 1.698 6.602 -12.407 1.00 0.00 C ATOM 1246 CG LYS A 78 1.208 7.750 -13.321 1.00 0.00 C ATOM 1247 CD LYS A 78 0.269 7.243 -14.453 1.00 0.00 C ATOM 1248 CE LYS A 78 -0.964 6.478 -13.925 1.00 0.00 C ATOM 1249 NZ LYS A 78 -1.786 5.932 -15.023 1.00 0.00 N ATOM 0 H LYS A 78 2.809 4.237 -11.485 1.00 0.00 H new ATOM 0 HA LYS A 78 2.108 5.393 -14.150 1.00 0.00 H new ATOM 0 HB2 LYS A 78 0.834 6.141 -11.929 1.00 0.00 H new ATOM 0 HB3 LYS A 78 2.314 7.024 -11.613 1.00 0.00 H new ATOM 0 HG2 LYS A 78 0.681 8.491 -12.719 1.00 0.00 H new ATOM 0 HG3 LYS A 78 2.069 8.252 -13.763 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -0.066 8.094 -15.046 1.00 0.00 H new ATOM 0 HD3 LYS A 78 0.834 6.592 -15.120 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -0.636 5.664 -13.278 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -1.572 7.146 -13.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -2.603 5.426 -14.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -2.120 6.710 -15.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -1.214 5.275 -15.591 1.00 0.00 H new ATOM 1263 N LEU A 79 4.583 5.589 -14.457 1.00 0.00 N ATOM 1264 CA LEU A 79 5.993 5.866 -14.762 1.00 0.00 C ATOM 1265 C LEU A 79 6.221 7.385 -14.924 1.00 0.00 C ATOM 1266 O LEU A 79 5.325 8.113 -15.372 1.00 0.00 O ATOM 1267 CB LEU A 79 6.402 5.108 -16.053 1.00 0.00 C ATOM 1268 CG LEU A 79 7.892 5.252 -16.507 1.00 0.00 C ATOM 1269 CD1 LEU A 79 8.862 4.698 -15.449 1.00 0.00 C ATOM 1270 CD2 LEU A 79 8.121 4.586 -17.877 1.00 0.00 C ATOM 0 H LEU A 79 4.075 5.169 -15.236 1.00 0.00 H new ATOM 0 HA LEU A 79 6.614 5.519 -13.936 1.00 0.00 H new ATOM 0 HB2 LEU A 79 6.191 4.049 -15.907 1.00 0.00 H new ATOM 0 HB3 LEU A 79 5.763 5.451 -16.867 1.00 0.00 H new ATOM 0 HG LEU A 79 8.101 6.317 -16.614 1.00 0.00 H new ATOM 0 HD11 LEU A 79 9.888 4.815 -15.799 1.00 0.00 H new ATOM 0 HD12 LEU A 79 8.733 5.245 -14.515 1.00 0.00 H new ATOM 0 HD13 LEU A 79 8.654 3.641 -15.282 1.00 0.00 H new ATOM 0 HD21 LEU A 79 9.165 4.701 -18.168 1.00 0.00 H new ATOM 0 HD22 LEU A 79 7.878 3.526 -17.811 1.00 0.00 H new ATOM 0 HD23 LEU A 79 7.482 5.059 -18.623 1.00 0.00 H new ATOM 1282 N ASP A 80 7.421 7.839 -14.539 1.00 0.00 N ATOM 1283 CA ASP A 80 7.851 9.233 -14.668 1.00 0.00 C ATOM 1284 C ASP A 80 9.368 9.257 -14.917 1.00 0.00 C ATOM 1285 O ASP A 80 10.155 8.874 -14.043 1.00 0.00 O ATOM 1286 CB ASP A 80 7.488 10.049 -13.398 1.00 0.00 C ATOM 1287 CG ASP A 80 8.019 11.493 -13.447 1.00 0.00 C ATOM 1288 OD1 ASP A 80 7.404 12.335 -14.127 1.00 0.00 O ATOM 1289 OD2 ASP A 80 9.067 11.786 -12.831 1.00 0.00 O ATOM 0 H ASP A 80 8.130 7.236 -14.122 1.00 0.00 H new ATOM 0 HA ASP A 80 7.333 9.696 -15.508 1.00 0.00 H new ATOM 0 HB2 ASP A 80 6.404 10.069 -13.281 1.00 0.00 H new ATOM 0 HB3 ASP A 80 7.894 9.547 -12.520 1.00 0.00 H new ATOM 1294 N THR A 81 9.762 9.685 -16.119 1.00 0.00 N ATOM 1295 CA THR A 81 11.170 9.881 -16.494 1.00 0.00 C ATOM 1296 C THR A 81 11.551 11.373 -16.387 1.00 0.00 C ATOM 1297 O THR A 81 12.730 11.727 -16.467 1.00 0.00 O ATOM 1298 CB THR A 81 11.437 9.346 -17.940 1.00 0.00 C ATOM 1299 OG1 THR A 81 10.624 10.064 -18.887 1.00 0.00 O ATOM 1300 CG2 THR A 81 11.129 7.843 -18.055 1.00 0.00 C ATOM 0 H THR A 81 9.108 9.908 -16.869 1.00 0.00 H new ATOM 0 HA THR A 81 11.793 9.314 -15.802 1.00 0.00 H new ATOM 0 HB THR A 81 12.494 9.500 -18.157 1.00 0.00 H new ATOM 0 HG1 THR A 81 10.797 9.725 -19.790 1.00 0.00 H new ATOM 0 HG21 THR A 81 11.326 7.508 -19.073 1.00 0.00 H new ATOM 0 HG22 THR A 81 11.761 7.288 -17.362 1.00 0.00 H new ATOM 0 HG23 THR A 81 10.081 7.667 -17.812 1.00 0.00 H new ATOM 1308 N SER A 82 10.531 12.242 -16.154 1.00 0.00 N ATOM 1309 CA SER A 82 10.725 13.700 -15.993 1.00 0.00 C ATOM 1310 C SER A 82 11.459 14.031 -14.670 1.00 0.00 C ATOM 1311 O SER A 82 11.835 15.181 -14.429 1.00 0.00 O ATOM 1312 CB SER A 82 9.349 14.411 -16.043 1.00 0.00 C ATOM 1313 OG SER A 82 8.629 14.042 -17.209 1.00 0.00 O ATOM 0 H SER A 82 9.557 11.948 -16.074 1.00 0.00 H new ATOM 0 HA SER A 82 11.350 14.059 -16.811 1.00 0.00 H new ATOM 0 HB2 SER A 82 8.770 14.153 -15.156 1.00 0.00 H new ATOM 0 HB3 SER A 82 9.493 15.491 -16.027 1.00 0.00 H new ATOM 0 HG SER A 82 7.763 14.501 -17.218 1.00 0.00 H new ATOM 1319 N HIS A 83 11.626 13.005 -13.808 1.00 0.00 N ATOM 1320 CA HIS A 83 12.419 13.075 -12.567 1.00 0.00 C ATOM 1321 C HIS A 83 13.911 13.369 -12.865 1.00 0.00 C ATOM 1322 O HIS A 83 14.613 13.966 -12.042 1.00 0.00 O ATOM 1323 CB HIS A 83 12.282 11.724 -11.810 1.00 0.00 C ATOM 1324 CG HIS A 83 12.822 11.729 -10.404 1.00 0.00 C ATOM 1325 ND1 HIS A 83 14.155 11.530 -10.101 1.00 0.00 N ATOM 1326 CD2 HIS A 83 12.196 11.911 -9.215 1.00 0.00 C ATOM 1327 CE1 HIS A 83 14.321 11.584 -8.792 1.00 0.00 C ATOM 1328 NE2 HIS A 83 13.150 11.815 -8.236 1.00 0.00 N ATOM 0 H HIS A 83 11.204 12.089 -13.960 1.00 0.00 H new ATOM 0 HA HIS A 83 12.040 13.892 -11.952 1.00 0.00 H new ATOM 0 HB2 HIS A 83 11.228 11.447 -11.778 1.00 0.00 H new ATOM 0 HB3 HIS A 83 12.798 10.951 -12.379 1.00 0.00 H new ATOM 0 HD2 HIS A 83 11.142 12.097 -9.067 1.00 0.00 H new ATOM 0 HE1 HIS A 83 15.257 11.460 -8.267 1.00 0.00 H new ATOM 0 HE2 HIS A 83 12.980 11.908 -7.235 1.00 0.00 H new ATOM 1337 N GLY A 84 14.364 12.940 -14.058 1.00 0.00 N ATOM 1338 CA GLY A 84 15.789 12.956 -14.434 1.00 0.00 C ATOM 1339 C GLY A 84 16.337 11.538 -14.539 1.00 0.00 C ATOM 1340 O GLY A 84 17.361 11.287 -15.182 1.00 0.00 O ATOM 0 H GLY A 84 13.753 12.573 -14.787 1.00 0.00 H new ATOM 0 HA2 GLY A 84 15.912 13.470 -15.387 1.00 0.00 H new ATOM 0 HA3 GLY A 84 16.359 13.517 -13.693 1.00 0.00 H new ATOM 1344 N MET A 85 15.616 10.607 -13.904 1.00 0.00 N ATOM 1345 CA MET A 85 15.941 9.175 -13.848 1.00 0.00 C ATOM 1346 C MET A 85 14.657 8.364 -14.085 1.00 0.00 C ATOM 1347 O MET A 85 13.549 8.920 -14.029 1.00 0.00 O ATOM 1348 CB MET A 85 16.545 8.823 -12.455 1.00 0.00 C ATOM 1349 CG MET A 85 17.916 9.449 -12.178 1.00 0.00 C ATOM 1350 SD MET A 85 18.420 9.340 -10.450 1.00 0.00 S ATOM 1351 CE MET A 85 18.366 7.578 -10.134 1.00 0.00 C ATOM 0 H MET A 85 14.761 10.836 -13.397 1.00 0.00 H new ATOM 0 HA MET A 85 16.674 8.933 -14.617 1.00 0.00 H new ATOM 0 HB2 MET A 85 15.850 9.145 -11.680 1.00 0.00 H new ATOM 0 HB3 MET A 85 16.632 7.739 -12.374 1.00 0.00 H new ATOM 0 HG2 MET A 85 18.664 8.955 -12.798 1.00 0.00 H new ATOM 0 HG3 MET A 85 17.895 10.497 -12.477 1.00 0.00 H new ATOM 0 HE1 MET A 85 18.757 7.375 -9.137 1.00 0.00 H new ATOM 0 HE2 MET A 85 17.336 7.228 -10.197 1.00 0.00 H new ATOM 0 HE3 MET A 85 18.972 7.057 -10.875 1.00 0.00 H new ATOM 1361 N ILE A 86 14.819 7.059 -14.361 1.00 0.00 N ATOM 1362 CA ILE A 86 13.695 6.106 -14.412 1.00 0.00 C ATOM 1363 C ILE A 86 13.145 5.937 -12.982 1.00 0.00 C ATOM 1364 O ILE A 86 13.900 5.607 -12.059 1.00 0.00 O ATOM 1365 CB ILE A 86 14.139 4.708 -14.995 1.00 0.00 C ATOM 1366 CG1 ILE A 86 14.760 4.862 -16.421 1.00 0.00 C ATOM 1367 CG2 ILE A 86 12.965 3.692 -15.014 1.00 0.00 C ATOM 1368 CD1 ILE A 86 13.814 5.389 -17.491 1.00 0.00 C ATOM 0 H ILE A 86 15.727 6.636 -14.554 1.00 0.00 H new ATOM 0 HA ILE A 86 12.925 6.497 -15.077 1.00 0.00 H new ATOM 0 HB ILE A 86 14.906 4.313 -14.329 1.00 0.00 H new ATOM 0 HG12 ILE A 86 15.617 5.532 -16.355 1.00 0.00 H new ATOM 0 HG13 ILE A 86 15.139 3.891 -16.741 1.00 0.00 H new ATOM 0 HG21 ILE A 86 13.312 2.743 -15.422 1.00 0.00 H new ATOM 0 HG22 ILE A 86 12.600 3.539 -13.998 1.00 0.00 H new ATOM 0 HG23 ILE A 86 12.158 4.080 -15.635 1.00 0.00 H new ATOM 0 HD11 ILE A 86 14.343 5.458 -18.442 1.00 0.00 H new ATOM 0 HD12 ILE A 86 12.968 4.710 -17.595 1.00 0.00 H new ATOM 0 HD13 ILE A 86 13.453 6.377 -17.203 1.00 0.00 H new ATOM 1380 N ARG A 87 11.845 6.186 -12.818 1.00 0.00 N ATOM 1381 CA ARG A 87 11.172 6.221 -11.512 1.00 0.00 C ATOM 1382 C ARG A 87 9.675 5.996 -11.740 1.00 0.00 C ATOM 1383 O ARG A 87 9.078 6.657 -12.586 1.00 0.00 O ATOM 1384 CB ARG A 87 11.484 7.579 -10.765 1.00 0.00 C ATOM 1385 CG ARG A 87 10.410 8.095 -9.748 1.00 0.00 C ATOM 1386 CD ARG A 87 9.458 9.144 -10.373 1.00 0.00 C ATOM 1387 NE ARG A 87 8.347 9.519 -9.477 1.00 0.00 N ATOM 1388 CZ ARG A 87 7.780 10.737 -9.402 1.00 0.00 C ATOM 1389 NH1 ARG A 87 8.249 11.768 -10.097 1.00 0.00 N ATOM 1390 NH2 ARG A 87 6.757 10.929 -8.597 1.00 0.00 N ATOM 0 H ARG A 87 11.217 6.373 -13.600 1.00 0.00 H new ATOM 0 HA ARG A 87 11.543 5.429 -10.862 1.00 0.00 H new ATOM 0 HB2 ARG A 87 12.427 7.463 -10.231 1.00 0.00 H new ATOM 0 HB3 ARG A 87 11.637 8.352 -11.518 1.00 0.00 H new ATOM 0 HG2 ARG A 87 9.825 7.251 -9.382 1.00 0.00 H new ATOM 0 HG3 ARG A 87 10.912 8.533 -8.885 1.00 0.00 H new ATOM 0 HD2 ARG A 87 10.028 10.037 -10.630 1.00 0.00 H new ATOM 0 HD3 ARG A 87 9.050 8.748 -11.303 1.00 0.00 H new ATOM 0 HE ARG A 87 7.978 8.793 -8.863 1.00 0.00 H new ATOM 0 HH11 ARG A 87 9.058 11.647 -10.706 1.00 0.00 H new ATOM 0 HH12 ARG A 87 7.800 12.681 -10.021 1.00 0.00 H new ATOM 0 HH21 ARG A 87 6.399 10.157 -8.035 1.00 0.00 H new ATOM 0 HH22 ARG A 87 6.322 11.850 -8.535 1.00 0.00 H new ATOM 1404 N THR A 88 9.078 5.051 -11.003 1.00 0.00 N ATOM 1405 CA THR A 88 7.660 4.734 -11.106 1.00 0.00 C ATOM 1406 C THR A 88 7.002 4.961 -9.733 1.00 0.00 C ATOM 1407 O THR A 88 7.643 4.810 -8.691 1.00 0.00 O ATOM 1408 CB THR A 88 7.447 3.267 -11.609 1.00 0.00 C ATOM 1409 OG1 THR A 88 8.324 2.995 -12.718 1.00 0.00 O ATOM 1410 CG2 THR A 88 5.990 3.004 -12.043 1.00 0.00 C ATOM 0 H THR A 88 9.575 4.484 -10.315 1.00 0.00 H new ATOM 0 HA THR A 88 7.191 5.389 -11.840 1.00 0.00 H new ATOM 0 HB THR A 88 7.675 2.606 -10.773 1.00 0.00 H new ATOM 0 HG1 THR A 88 8.078 2.139 -13.127 1.00 0.00 H new ATOM 0 HG21 THR A 88 5.892 1.973 -12.384 1.00 0.00 H new ATOM 0 HG22 THR A 88 5.323 3.171 -11.198 1.00 0.00 H new ATOM 0 HG23 THR A 88 5.724 3.681 -12.855 1.00 0.00 H new ATOM 1418 N GLU A 89 5.759 5.421 -9.735 1.00 0.00 N ATOM 1419 CA GLU A 89 4.973 5.623 -8.515 1.00 0.00 C ATOM 1420 C GLU A 89 3.598 5.005 -8.731 1.00 0.00 C ATOM 1421 O GLU A 89 2.955 5.292 -9.740 1.00 0.00 O ATOM 1422 CB GLU A 89 4.887 7.141 -8.213 1.00 0.00 C ATOM 1423 CG GLU A 89 4.263 7.507 -6.855 1.00 0.00 C ATOM 1424 CD GLU A 89 4.427 8.997 -6.508 1.00 0.00 C ATOM 1425 OE1 GLU A 89 5.582 9.471 -6.476 1.00 0.00 O ATOM 1426 OE2 GLU A 89 3.429 9.699 -6.277 1.00 0.00 O ATOM 0 H GLU A 89 5.259 5.668 -10.589 1.00 0.00 H new ATOM 0 HA GLU A 89 5.439 5.142 -7.655 1.00 0.00 H new ATOM 0 HB2 GLU A 89 5.892 7.561 -8.258 1.00 0.00 H new ATOM 0 HB3 GLU A 89 4.306 7.619 -9.002 1.00 0.00 H new ATOM 0 HG2 GLU A 89 3.202 7.256 -6.868 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.724 6.903 -6.073 1.00 0.00 H new ATOM 1433 N VAL A 90 3.150 4.142 -7.802 1.00 0.00 N ATOM 1434 CA VAL A 90 1.834 3.501 -7.909 1.00 0.00 C ATOM 1435 C VAL A 90 0.807 4.410 -7.246 1.00 0.00 C ATOM 1436 O VAL A 90 0.875 4.692 -6.047 1.00 0.00 O ATOM 1437 CB VAL A 90 1.772 2.041 -7.302 1.00 0.00 C ATOM 1438 CG1 VAL A 90 2.478 1.036 -8.233 1.00 0.00 C ATOM 1439 CG2 VAL A 90 2.365 1.973 -5.873 1.00 0.00 C ATOM 0 H VAL A 90 3.680 3.875 -6.973 1.00 0.00 H new ATOM 0 HA VAL A 90 1.616 3.369 -8.969 1.00 0.00 H new ATOM 0 HB VAL A 90 0.719 1.770 -7.224 1.00 0.00 H new ATOM 0 HG11 VAL A 90 2.425 0.038 -7.798 1.00 0.00 H new ATOM 0 HG12 VAL A 90 1.987 1.035 -9.206 1.00 0.00 H new ATOM 0 HG13 VAL A 90 3.522 1.324 -8.354 1.00 0.00 H new ATOM 0 HG21 VAL A 90 2.299 0.951 -5.500 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.409 2.284 -5.897 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.804 2.636 -5.214 1.00 0.00 H new ATOM 1449 N ARG A 91 -0.088 4.936 -8.085 1.00 0.00 N ATOM 1450 CA ARG A 91 -1.072 5.931 -7.704 1.00 0.00 C ATOM 1451 C ARG A 91 -2.172 6.020 -8.770 1.00 0.00 C ATOM 1452 O ARG A 91 -1.876 6.076 -9.974 1.00 0.00 O ATOM 1453 CB ARG A 91 -0.383 7.312 -7.516 1.00 0.00 C ATOM 1454 CG ARG A 91 0.481 7.782 -8.708 1.00 0.00 C ATOM 1455 CD ARG A 91 1.054 9.185 -8.504 1.00 0.00 C ATOM 1456 NE ARG A 91 1.921 9.583 -9.626 1.00 0.00 N ATOM 1457 CZ ARG A 91 1.627 10.528 -10.528 1.00 0.00 C ATOM 1458 NH1 ARG A 91 0.466 11.191 -10.473 1.00 0.00 N ATOM 1459 NH2 ARG A 91 2.501 10.795 -11.486 1.00 0.00 N ATOM 0 H ARG A 91 -0.143 4.671 -9.068 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.529 5.637 -6.759 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -1.152 8.061 -7.327 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.246 7.269 -6.627 1.00 0.00 H new ATOM 0 HG2 ARG A 91 1.299 7.078 -8.858 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -0.122 7.769 -9.616 1.00 0.00 H new ATOM 0 HD2 ARG A 91 0.238 9.901 -8.402 1.00 0.00 H new ATOM 0 HD3 ARG A 91 1.623 9.215 -7.575 1.00 0.00 H new ATOM 0 HE ARG A 91 2.815 9.101 -9.724 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -0.208 10.979 -9.737 1.00 0.00 H new ATOM 0 HH12 ARG A 91 0.255 11.908 -11.167 1.00 0.00 H new ATOM 0 HH21 ARG A 91 3.383 10.284 -11.529 1.00 0.00 H new ATOM 0 HH22 ARG A 91 2.293 11.512 -12.181 1.00 0.00 H new ATOM 1473 N SER A 92 -3.437 6.012 -8.331 1.00 0.00 N ATOM 1474 CA SER A 92 -4.583 6.311 -9.200 1.00 0.00 C ATOM 1475 C SER A 92 -4.873 7.831 -9.154 1.00 0.00 C ATOM 1476 O SER A 92 -4.263 8.559 -8.357 1.00 0.00 O ATOM 1477 CB SER A 92 -5.797 5.458 -8.772 1.00 0.00 C ATOM 1478 OG SER A 92 -6.881 5.598 -9.654 1.00 0.00 O ATOM 0 H SER A 92 -3.695 5.799 -7.367 1.00 0.00 H new ATOM 0 HA SER A 92 -4.360 6.051 -10.235 1.00 0.00 H new ATOM 0 HB2 SER A 92 -5.503 4.409 -8.724 1.00 0.00 H new ATOM 0 HB3 SER A 92 -6.107 5.749 -7.768 1.00 0.00 H new ATOM 0 HG SER A 92 -7.626 5.041 -9.347 1.00 0.00 H new ATOM 1484 N ARG A 93 -5.831 8.292 -9.971 1.00 0.00 N ATOM 1485 CA ARG A 93 -5.973 9.724 -10.308 1.00 0.00 C ATOM 1486 C ARG A 93 -6.582 10.559 -9.157 1.00 0.00 C ATOM 1487 O ARG A 93 -5.979 11.551 -8.725 1.00 0.00 O ATOM 1488 CB ARG A 93 -6.805 9.904 -11.606 1.00 0.00 C ATOM 1489 CG ARG A 93 -6.162 9.285 -12.869 1.00 0.00 C ATOM 1490 CD ARG A 93 -6.885 9.698 -14.164 1.00 0.00 C ATOM 1491 NE ARG A 93 -6.843 11.164 -14.369 1.00 0.00 N ATOM 1492 CZ ARG A 93 -7.407 11.835 -15.391 1.00 0.00 C ATOM 1493 NH1 ARG A 93 -8.064 11.193 -16.351 1.00 0.00 N ATOM 1494 NH2 ARG A 93 -7.315 13.159 -15.433 1.00 0.00 N ATOM 0 H ARG A 93 -6.526 7.692 -10.416 1.00 0.00 H new ATOM 0 HA ARG A 93 -4.964 10.103 -10.472 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -7.788 9.457 -11.458 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -6.962 10.969 -11.778 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -5.117 9.590 -12.927 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -6.172 8.199 -12.782 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -6.422 9.198 -15.015 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -7.922 9.365 -14.124 1.00 0.00 H new ATOM 0 HE ARG A 93 -6.341 11.715 -13.673 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -8.147 10.177 -16.321 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -8.486 11.716 -17.118 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -6.820 13.660 -14.695 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -7.739 13.676 -16.203 1.00 0.00 H new ATOM 1508 N THR A 94 -7.758 10.149 -8.653 1.00 0.00 N ATOM 1509 CA THR A 94 -8.542 10.978 -7.712 1.00 0.00 C ATOM 1510 C THR A 94 -8.015 10.869 -6.260 1.00 0.00 C ATOM 1511 O THR A 94 -7.501 11.843 -5.700 1.00 0.00 O ATOM 1512 CB THR A 94 -10.064 10.588 -7.761 1.00 0.00 C ATOM 1513 OG1 THR A 94 -10.563 10.710 -9.103 1.00 0.00 O ATOM 1514 CG2 THR A 94 -10.932 11.450 -6.818 1.00 0.00 C ATOM 0 H THR A 94 -8.189 9.252 -8.878 1.00 0.00 H new ATOM 0 HA THR A 94 -8.427 12.014 -8.031 1.00 0.00 H new ATOM 0 HB THR A 94 -10.132 9.554 -7.422 1.00 0.00 H new ATOM 0 HG1 THR A 94 -11.511 10.463 -9.123 1.00 0.00 H new ATOM 0 HG21 THR A 94 -11.973 11.136 -6.894 1.00 0.00 H new ATOM 0 HG22 THR A 94 -10.589 11.324 -5.791 1.00 0.00 H new ATOM 0 HG23 THR A 94 -10.848 12.499 -7.103 1.00 0.00 H new ATOM 1522 N ALA A 95 -8.124 9.669 -5.675 1.00 0.00 N ATOM 1523 CA ALA A 95 -7.867 9.440 -4.238 1.00 0.00 C ATOM 1524 C ALA A 95 -6.562 8.671 -4.006 1.00 0.00 C ATOM 1525 O ALA A 95 -5.755 9.031 -3.142 1.00 0.00 O ATOM 1526 CB ALA A 95 -9.047 8.661 -3.633 1.00 0.00 C ATOM 0 H ALA A 95 -8.393 8.825 -6.181 1.00 0.00 H new ATOM 0 HA ALA A 95 -7.765 10.410 -3.752 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -8.864 8.489 -2.572 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -9.964 9.238 -3.754 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -9.151 7.704 -4.144 1.00 0.00 H new ATOM 1532 N ASP A 96 -6.361 7.622 -4.816 1.00 0.00 N ATOM 1533 CA ASP A 96 -5.353 6.566 -4.572 1.00 0.00 C ATOM 1534 C ASP A 96 -3.910 6.989 -4.884 1.00 0.00 C ATOM 1535 O ASP A 96 -3.028 6.149 -5.019 1.00 0.00 O ATOM 1536 CB ASP A 96 -5.758 5.253 -5.261 1.00 0.00 C ATOM 1537 CG ASP A 96 -7.146 4.772 -4.812 1.00 0.00 C ATOM 1538 OD1 ASP A 96 -7.245 4.105 -3.763 1.00 0.00 O ATOM 1539 OD2 ASP A 96 -8.147 5.105 -5.484 1.00 0.00 O ATOM 0 H ASP A 96 -6.898 7.476 -5.671 1.00 0.00 H new ATOM 0 HA ASP A 96 -5.347 6.389 -3.497 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -5.756 5.395 -6.342 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -5.018 4.484 -5.039 1.00 0.00 H new ATOM 1544 N SER A 97 -3.671 8.302 -4.991 1.00 0.00 N ATOM 1545 CA SER A 97 -2.310 8.875 -5.008 1.00 0.00 C ATOM 1546 C SER A 97 -1.554 8.583 -3.679 1.00 0.00 C ATOM 1547 O SER A 97 -0.336 8.722 -3.601 1.00 0.00 O ATOM 1548 CB SER A 97 -2.402 10.392 -5.279 1.00 0.00 C ATOM 1549 OG SER A 97 -3.270 11.027 -4.360 1.00 0.00 O ATOM 0 H SER A 97 -4.411 9.000 -5.068 1.00 0.00 H new ATOM 0 HA SER A 97 -1.737 8.404 -5.806 1.00 0.00 H new ATOM 0 HB2 SER A 97 -1.409 10.836 -5.211 1.00 0.00 H new ATOM 0 HB3 SER A 97 -2.758 10.561 -6.295 1.00 0.00 H new ATOM 0 HG SER A 97 -3.307 11.987 -4.555 1.00 0.00 H new ATOM 1555 N HIS A 98 -2.318 8.141 -2.658 1.00 0.00 N ATOM 1556 CA HIS A 98 -1.814 7.815 -1.313 1.00 0.00 C ATOM 1557 C HIS A 98 -0.993 6.496 -1.249 1.00 0.00 C ATOM 1558 O HIS A 98 -0.364 6.249 -0.217 1.00 0.00 O ATOM 1559 CB HIS A 98 -3.011 7.711 -0.327 1.00 0.00 C ATOM 1560 CG HIS A 98 -4.071 6.700 -0.733 1.00 0.00 C ATOM 1561 ND1 HIS A 98 -3.819 5.352 -0.910 1.00 0.00 N ATOM 1562 CD2 HIS A 98 -5.377 6.865 -1.044 1.00 0.00 C ATOM 1563 CE1 HIS A 98 -4.919 4.745 -1.311 1.00 0.00 C ATOM 1564 NE2 HIS A 98 -5.875 5.639 -1.401 1.00 0.00 N ATOM 0 H HIS A 98 -3.324 7.999 -2.751 1.00 0.00 H new ATOM 0 HA HIS A 98 -1.135 8.622 -1.037 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -2.632 7.445 0.660 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -3.477 8.692 -0.236 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -5.927 7.794 -1.016 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -5.016 3.692 -1.528 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -6.835 5.452 -1.690 1.00 0.00 H new ATOM 1573 N LEU A 99 -1.086 5.624 -2.298 1.00 0.00 N ATOM 1574 CA LEU A 99 -0.494 4.245 -2.261 1.00 0.00 C ATOM 1575 C LEU A 99 1.017 4.246 -1.897 1.00 0.00 C ATOM 1576 O LEU A 99 1.379 3.989 -0.744 1.00 0.00 O ATOM 1577 CB LEU A 99 -0.684 3.509 -3.626 1.00 0.00 C ATOM 1578 CG LEU A 99 -2.137 3.343 -4.161 1.00 0.00 C ATOM 1579 CD1 LEU A 99 -2.163 2.715 -5.571 1.00 0.00 C ATOM 1580 CD2 LEU A 99 -2.997 2.528 -3.201 1.00 0.00 C ATOM 0 H LEU A 99 -1.560 5.847 -3.173 1.00 0.00 H new ATOM 0 HA LEU A 99 -1.033 3.715 -1.476 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -0.108 4.046 -4.380 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -0.244 2.516 -3.536 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.560 4.345 -4.233 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -3.195 2.617 -5.907 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -1.615 3.354 -6.264 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -1.697 1.730 -5.539 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.004 2.432 -3.607 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.561 1.537 -3.074 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.041 3.031 -2.235 1.00 0.00 H new ATOM 1592 N GLY A 100 1.879 4.585 -2.867 1.00 0.00 N ATOM 1593 CA GLY A 100 3.323 4.542 -2.651 1.00 0.00 C ATOM 1594 C GLY A 100 4.122 4.629 -3.934 1.00 0.00 C ATOM 1595 O GLY A 100 3.597 4.999 -4.986 1.00 0.00 O ATOM 0 H GLY A 100 1.599 4.889 -3.800 1.00 0.00 H new ATOM 0 HA2 GLY A 100 3.610 5.364 -1.996 1.00 0.00 H new ATOM 0 HA3 GLY A 100 3.579 3.617 -2.133 1.00 0.00 H new ATOM 1599 N HIS A 101 5.403 4.253 -3.835 1.00 0.00 N ATOM 1600 CA HIS A 101 6.426 4.463 -4.881 1.00 0.00 C ATOM 1601 C HIS A 101 7.059 3.113 -5.223 1.00 0.00 C ATOM 1602 O HIS A 101 7.309 2.313 -4.322 1.00 0.00 O ATOM 1603 CB HIS A 101 7.510 5.451 -4.354 1.00 0.00 C ATOM 1604 CG HIS A 101 6.941 6.659 -3.650 1.00 0.00 C ATOM 1605 ND1 HIS A 101 6.653 7.839 -4.289 1.00 0.00 N ATOM 1606 CD2 HIS A 101 6.565 6.837 -2.355 1.00 0.00 C ATOM 1607 CE1 HIS A 101 6.129 8.687 -3.429 1.00 0.00 C ATOM 1608 NE2 HIS A 101 6.064 8.107 -2.247 1.00 0.00 N ATOM 0 H HIS A 101 5.771 3.783 -3.008 1.00 0.00 H new ATOM 0 HA HIS A 101 5.972 4.888 -5.776 1.00 0.00 H new ATOM 0 HB2 HIS A 101 8.170 4.920 -3.668 1.00 0.00 H new ATOM 0 HB3 HIS A 101 8.122 5.785 -5.192 1.00 0.00 H new ATOM 0 HD2 HIS A 101 6.646 6.111 -1.559 1.00 0.00 H new ATOM 0 HE1 HIS A 101 5.806 9.692 -3.655 1.00 0.00 H new ATOM 0 HE2 HIS A 101 5.701 8.533 -1.394 1.00 0.00 H new ATOM 1617 N VAL A 102 7.329 2.847 -6.517 1.00 0.00 N ATOM 1618 CA VAL A 102 7.844 1.535 -6.968 1.00 0.00 C ATOM 1619 C VAL A 102 9.021 1.713 -7.929 1.00 0.00 C ATOM 1620 O VAL A 102 9.010 2.573 -8.803 1.00 0.00 O ATOM 1621 CB VAL A 102 6.731 0.628 -7.612 1.00 0.00 C ATOM 1622 CG1 VAL A 102 5.583 0.377 -6.622 1.00 0.00 C ATOM 1623 CG2 VAL A 102 6.188 1.222 -8.914 1.00 0.00 C ATOM 0 H VAL A 102 7.199 3.523 -7.270 1.00 0.00 H new ATOM 0 HA VAL A 102 8.192 1.015 -6.075 1.00 0.00 H new ATOM 0 HB VAL A 102 7.201 -0.326 -7.854 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.828 -0.252 -7.093 1.00 0.00 H new ATOM 0 HG12 VAL A 102 5.971 -0.123 -5.735 1.00 0.00 H new ATOM 0 HG13 VAL A 102 5.135 1.329 -6.335 1.00 0.00 H new ATOM 0 HG21 VAL A 102 5.422 0.563 -9.323 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.754 2.202 -8.714 1.00 0.00 H new ATOM 0 HG23 VAL A 102 7.000 1.325 -9.633 1.00 0.00 H new ATOM 1633 N PHE A 103 10.061 0.896 -7.757 1.00 0.00 N ATOM 1634 CA PHE A 103 11.345 1.108 -8.450 1.00 0.00 C ATOM 1635 C PHE A 103 11.765 -0.103 -9.271 1.00 0.00 C ATOM 1636 O PHE A 103 11.484 -1.246 -8.921 1.00 0.00 O ATOM 1637 CB PHE A 103 12.441 1.481 -7.422 1.00 0.00 C ATOM 1638 CG PHE A 103 12.135 2.769 -6.664 1.00 0.00 C ATOM 1639 CD1 PHE A 103 12.217 4.007 -7.306 1.00 0.00 C ATOM 1640 CD2 PHE A 103 11.747 2.745 -5.326 1.00 0.00 C ATOM 1641 CE1 PHE A 103 11.924 5.173 -6.630 1.00 0.00 C ATOM 1642 CE2 PHE A 103 11.459 3.912 -4.651 1.00 0.00 C ATOM 1643 CZ PHE A 103 11.544 5.123 -5.303 1.00 0.00 C ATOM 0 H PHE A 103 10.045 0.080 -7.145 1.00 0.00 H new ATOM 0 HA PHE A 103 11.212 1.932 -9.151 1.00 0.00 H new ATOM 0 HB2 PHE A 103 12.555 0.665 -6.709 1.00 0.00 H new ATOM 0 HB3 PHE A 103 13.395 1.588 -7.939 1.00 0.00 H new ATOM 0 HD1 PHE A 103 12.513 4.052 -8.344 1.00 0.00 H new ATOM 0 HD2 PHE A 103 11.671 1.799 -4.811 1.00 0.00 H new ATOM 0 HE1 PHE A 103 11.992 6.124 -7.138 1.00 0.00 H new ATOM 0 HE2 PHE A 103 11.167 3.877 -3.612 1.00 0.00 H new ATOM 0 HZ PHE A 103 11.313 6.036 -4.775 1.00 0.00 H new ATOM 1653 N ASN A 104 12.499 0.191 -10.347 1.00 0.00 N ATOM 1654 CA ASN A 104 13.065 -0.805 -11.274 1.00 0.00 C ATOM 1655 C ASN A 104 14.398 -1.376 -10.717 1.00 0.00 C ATOM 1656 O ASN A 104 15.078 -2.167 -11.379 1.00 0.00 O ATOM 1657 CB ASN A 104 13.265 -0.128 -12.655 1.00 0.00 C ATOM 1658 CG ASN A 104 11.957 0.433 -13.227 1.00 0.00 C ATOM 1659 OD1 ASN A 104 11.265 -0.230 -13.987 1.00 0.00 O ATOM 1660 ND2 ASN A 104 11.591 1.650 -12.827 1.00 0.00 N ATOM 0 H ASN A 104 12.725 1.151 -10.608 1.00 0.00 H new ATOM 0 HA ASN A 104 12.383 -1.648 -11.384 1.00 0.00 H new ATOM 0 HB2 ASN A 104 13.992 0.679 -12.559 1.00 0.00 H new ATOM 0 HB3 ASN A 104 13.683 -0.852 -13.354 1.00 0.00 H new ATOM 0 HD21 ASN A 104 10.713 2.052 -13.155 1.00 0.00 H new ATOM 0 HD22 ASN A 104 12.189 2.180 -12.193 1.00 0.00 H new ATOM 1667 N ASP A 105 14.741 -0.956 -9.484 1.00 0.00 N ATOM 1668 CA ASP A 105 15.884 -1.471 -8.701 1.00 0.00 C ATOM 1669 C ASP A 105 15.464 -2.733 -7.920 1.00 0.00 C ATOM 1670 O ASP A 105 16.308 -3.547 -7.529 1.00 0.00 O ATOM 1671 CB ASP A 105 16.362 -0.354 -7.723 1.00 0.00 C ATOM 1672 CG ASP A 105 17.442 -0.789 -6.707 1.00 0.00 C ATOM 1673 OD1 ASP A 105 18.630 -0.883 -7.077 1.00 0.00 O ATOM 1674 OD2 ASP A 105 17.095 -1.051 -5.530 1.00 0.00 O ATOM 0 H ASP A 105 14.219 -0.231 -8.992 1.00 0.00 H new ATOM 0 HA ASP A 105 16.701 -1.743 -9.369 1.00 0.00 H new ATOM 0 HB2 ASP A 105 16.751 0.478 -8.309 1.00 0.00 H new ATOM 0 HB3 ASP A 105 15.498 0.020 -7.173 1.00 0.00 H new ATOM 1679 N GLY A 106 14.147 -2.892 -7.713 1.00 0.00 N ATOM 1680 CA GLY A 106 13.610 -3.998 -6.917 1.00 0.00 C ATOM 1681 C GLY A 106 13.195 -5.198 -7.763 1.00 0.00 C ATOM 1682 O GLY A 106 12.501 -5.012 -8.772 1.00 0.00 O ATOM 0 H GLY A 106 13.436 -2.265 -8.089 1.00 0.00 H new ATOM 0 HA2 GLY A 106 14.360 -4.314 -6.192 1.00 0.00 H new ATOM 0 HA3 GLY A 106 12.748 -3.645 -6.350 1.00 0.00 H new ATOM 1686 N PRO A 107 13.608 -6.453 -7.381 1.00 0.00 N ATOM 1687 CA PRO A 107 13.259 -7.682 -8.138 1.00 0.00 C ATOM 1688 C PRO A 107 11.752 -8.007 -8.040 1.00 0.00 C ATOM 1689 O PRO A 107 11.195 -8.066 -6.939 1.00 0.00 O ATOM 1690 CB PRO A 107 14.133 -8.791 -7.471 1.00 0.00 C ATOM 1691 CG PRO A 107 15.130 -8.054 -6.618 1.00 0.00 C ATOM 1692 CD PRO A 107 14.440 -6.777 -6.194 1.00 0.00 C ATOM 0 HA PRO A 107 13.452 -7.583 -9.206 1.00 0.00 H new ATOM 0 HB2 PRO A 107 13.522 -9.464 -6.869 1.00 0.00 H new ATOM 0 HB3 PRO A 107 14.634 -9.402 -8.222 1.00 0.00 H new ATOM 0 HG2 PRO A 107 15.420 -8.649 -5.752 1.00 0.00 H new ATOM 0 HG3 PRO A 107 16.041 -7.840 -7.177 1.00 0.00 H new ATOM 0 HD2 PRO A 107 13.833 -6.921 -5.300 1.00 0.00 H new ATOM 0 HD3 PRO A 107 15.154 -5.985 -5.970 1.00 0.00 H new ATOM 1700 N GLY A 108 11.115 -8.223 -9.200 1.00 0.00 N ATOM 1701 CA GLY A 108 9.694 -8.554 -9.267 1.00 0.00 C ATOM 1702 C GLY A 108 9.298 -9.126 -10.621 1.00 0.00 C ATOM 1703 O GLY A 108 10.081 -9.018 -11.575 1.00 0.00 O ATOM 0 H GLY A 108 11.572 -8.172 -10.111 1.00 0.00 H new ATOM 0 HA2 GLY A 108 9.454 -9.275 -8.486 1.00 0.00 H new ATOM 0 HA3 GLY A 108 9.105 -7.659 -9.067 1.00 0.00 H new ATOM 1707 N PRO A 109 8.074 -9.746 -10.750 1.00 0.00 N ATOM 1708 CA PRO A 109 7.596 -10.336 -12.029 1.00 0.00 C ATOM 1709 C PRO A 109 7.379 -9.249 -13.112 1.00 0.00 C ATOM 1710 O PRO A 109 7.667 -9.460 -14.293 1.00 0.00 O ATOM 1711 CB PRO A 109 6.267 -11.039 -11.629 1.00 0.00 C ATOM 1712 CG PRO A 109 5.803 -10.313 -10.400 1.00 0.00 C ATOM 1713 CD PRO A 109 7.067 -9.920 -9.663 1.00 0.00 C ATOM 0 HA PRO A 109 8.313 -11.025 -12.475 1.00 0.00 H new ATOM 0 HB2 PRO A 109 5.529 -10.974 -12.429 1.00 0.00 H new ATOM 0 HB3 PRO A 109 6.425 -12.098 -11.426 1.00 0.00 H new ATOM 0 HG2 PRO A 109 5.212 -9.435 -10.662 1.00 0.00 H new ATOM 0 HG3 PRO A 109 5.170 -10.951 -9.782 1.00 0.00 H new ATOM 0 HD2 PRO A 109 6.929 -9.000 -9.095 1.00 0.00 H new ATOM 0 HD3 PRO A 109 7.372 -10.690 -8.954 1.00 0.00 H new ATOM 1721 N ASN A 110 6.889 -8.076 -12.673 1.00 0.00 N ATOM 1722 CA ASN A 110 6.685 -6.897 -13.535 1.00 0.00 C ATOM 1723 C ASN A 110 8.015 -6.131 -13.694 1.00 0.00 C ATOM 1724 O ASN A 110 8.264 -5.497 -14.724 1.00 0.00 O ATOM 1725 CB ASN A 110 5.594 -5.986 -12.907 1.00 0.00 C ATOM 1726 CG ASN A 110 5.246 -4.752 -13.745 1.00 0.00 C ATOM 1727 OD1 ASN A 110 5.328 -4.763 -14.974 1.00 0.00 O ATOM 1728 ND2 ASN A 110 4.856 -3.676 -13.086 1.00 0.00 N ATOM 0 H ASN A 110 6.621 -7.918 -11.702 1.00 0.00 H new ATOM 0 HA ASN A 110 6.352 -7.213 -14.524 1.00 0.00 H new ATOM 0 HB2 ASN A 110 4.689 -6.574 -12.755 1.00 0.00 H new ATOM 0 HB3 ASN A 110 5.932 -5.660 -11.923 1.00 0.00 H new ATOM 0 HD21 ASN A 110 4.614 -2.826 -13.595 1.00 0.00 H new ATOM 0 HD22 ASN A 110 4.797 -3.695 -12.068 1.00 0.00 H new ATOM 1735 N GLY A 111 8.859 -6.209 -12.645 1.00 0.00 N ATOM 1736 CA GLY A 111 10.166 -5.542 -12.615 1.00 0.00 C ATOM 1737 C GLY A 111 10.152 -4.289 -11.747 1.00 0.00 C ATOM 1738 O GLY A 111 11.091 -3.486 -11.788 1.00 0.00 O ATOM 0 H GLY A 111 8.649 -6.737 -11.798 1.00 0.00 H new ATOM 0 HA2 GLY A 111 10.917 -6.235 -12.237 1.00 0.00 H new ATOM 0 HA3 GLY A 111 10.460 -5.276 -13.630 1.00 0.00 H new ATOM 1742 N LEU A 112 9.082 -4.130 -10.948 1.00 0.00 N ATOM 1743 CA LEU A 112 8.900 -2.988 -10.035 1.00 0.00 C ATOM 1744 C LEU A 112 8.974 -3.451 -8.571 1.00 0.00 C ATOM 1745 O LEU A 112 8.726 -4.624 -8.267 1.00 0.00 O ATOM 1746 CB LEU A 112 7.558 -2.265 -10.338 1.00 0.00 C ATOM 1747 CG LEU A 112 7.489 -1.535 -11.720 1.00 0.00 C ATOM 1748 CD1 LEU A 112 6.109 -0.895 -11.956 1.00 0.00 C ATOM 1749 CD2 LEU A 112 8.617 -0.483 -11.846 1.00 0.00 C ATOM 0 H LEU A 112 8.312 -4.798 -10.918 1.00 0.00 H new ATOM 0 HA LEU A 112 9.708 -2.274 -10.196 1.00 0.00 H new ATOM 0 HB2 LEU A 112 6.752 -2.997 -10.292 1.00 0.00 H new ATOM 0 HB3 LEU A 112 7.372 -1.535 -9.550 1.00 0.00 H new ATOM 0 HG LEU A 112 7.637 -2.287 -12.495 1.00 0.00 H new ATOM 0 HD11 LEU A 112 6.100 -0.397 -12.926 1.00 0.00 H new ATOM 0 HD12 LEU A 112 5.341 -1.669 -11.938 1.00 0.00 H new ATOM 0 HD13 LEU A 112 5.908 -0.165 -11.172 1.00 0.00 H new ATOM 0 HD21 LEU A 112 8.548 0.011 -12.815 1.00 0.00 H new ATOM 0 HD22 LEU A 112 8.514 0.258 -11.053 1.00 0.00 H new ATOM 0 HD23 LEU A 112 9.585 -0.976 -11.758 1.00 0.00 H new ATOM 1761 N ARG A 113 9.307 -2.513 -7.670 1.00 0.00 N ATOM 1762 CA ARG A 113 9.467 -2.792 -6.228 1.00 0.00 C ATOM 1763 C ARG A 113 8.281 -2.177 -5.489 1.00 0.00 C ATOM 1764 O ARG A 113 8.267 -0.967 -5.268 1.00 0.00 O ATOM 1765 CB ARG A 113 10.813 -2.168 -5.747 1.00 0.00 C ATOM 1766 CG ARG A 113 11.341 -2.650 -4.372 1.00 0.00 C ATOM 1767 CD ARG A 113 10.692 -1.958 -3.167 1.00 0.00 C ATOM 1768 NE ARG A 113 10.959 -0.510 -3.147 1.00 0.00 N ATOM 1769 CZ ARG A 113 11.640 0.145 -2.187 1.00 0.00 C ATOM 1770 NH1 ARG A 113 12.185 -0.512 -1.162 1.00 0.00 N ATOM 1771 NH2 ARG A 113 11.760 1.461 -2.252 1.00 0.00 N ATOM 0 H ARG A 113 9.474 -1.538 -7.918 1.00 0.00 H new ATOM 0 HA ARG A 113 9.491 -3.864 -6.030 1.00 0.00 H new ATOM 0 HB2 ARG A 113 11.575 -2.377 -6.498 1.00 0.00 H new ATOM 0 HB3 ARG A 113 10.693 -1.085 -5.707 1.00 0.00 H new ATOM 0 HG2 ARG A 113 11.178 -3.725 -4.290 1.00 0.00 H new ATOM 0 HG3 ARG A 113 12.418 -2.487 -4.333 1.00 0.00 H new ATOM 0 HD2 ARG A 113 9.615 -2.127 -3.190 1.00 0.00 H new ATOM 0 HD3 ARG A 113 11.066 -2.407 -2.247 1.00 0.00 H new ATOM 0 HE ARG A 113 10.598 0.043 -3.925 1.00 0.00 H new ATOM 0 HH11 ARG A 113 12.089 -1.525 -1.097 1.00 0.00 H new ATOM 0 HH12 ARG A 113 12.698 -0.001 -0.443 1.00 0.00 H new ATOM 0 HH21 ARG A 113 11.338 1.974 -3.026 1.00 0.00 H new ATOM 0 HH22 ARG A 113 12.274 1.963 -1.528 1.00 0.00 H new ATOM 1785 N TYR A 114 7.330 -3.008 -5.044 1.00 0.00 N ATOM 1786 CA TYR A 114 6.050 -2.525 -4.519 1.00 0.00 C ATOM 1787 C TYR A 114 6.243 -2.009 -3.080 1.00 0.00 C ATOM 1788 O TYR A 114 6.178 -2.770 -2.127 1.00 0.00 O ATOM 1789 CB TYR A 114 5.001 -3.664 -4.628 1.00 0.00 C ATOM 1790 CG TYR A 114 3.557 -3.248 -4.323 1.00 0.00 C ATOM 1791 CD1 TYR A 114 2.894 -2.306 -5.122 1.00 0.00 C ATOM 1792 CD2 TYR A 114 2.857 -3.785 -3.244 1.00 0.00 C ATOM 1793 CE1 TYR A 114 1.594 -1.929 -4.844 1.00 0.00 C ATOM 1794 CE2 TYR A 114 1.567 -3.407 -2.966 1.00 0.00 C ATOM 1795 CZ TYR A 114 0.940 -2.484 -3.761 1.00 0.00 C ATOM 1796 OH TYR A 114 -0.337 -2.104 -3.458 1.00 0.00 O ATOM 0 H TYR A 114 7.426 -4.023 -5.038 1.00 0.00 H new ATOM 0 HA TYR A 114 5.677 -1.684 -5.103 1.00 0.00 H new ATOM 0 HB2 TYR A 114 5.039 -4.077 -5.636 1.00 0.00 H new ATOM 0 HB3 TYR A 114 5.284 -4.465 -3.945 1.00 0.00 H new ATOM 0 HD1 TYR A 114 3.406 -1.869 -5.966 1.00 0.00 H new ATOM 0 HD2 TYR A 114 3.341 -4.515 -2.612 1.00 0.00 H new ATOM 0 HE1 TYR A 114 1.092 -1.205 -5.469 1.00 0.00 H new ATOM 0 HE2 TYR A 114 1.047 -3.836 -2.122 1.00 0.00 H new ATOM 0 HH TYR A 114 -0.899 -2.900 -3.352 1.00 0.00 H new ATOM 1806 N CYS A 115 6.473 -0.690 -2.945 1.00 0.00 N ATOM 1807 CA CYS A 115 6.818 -0.057 -1.664 1.00 0.00 C ATOM 1808 C CYS A 115 5.721 0.919 -1.290 1.00 0.00 C ATOM 1809 O CYS A 115 5.619 2.014 -1.860 1.00 0.00 O ATOM 1810 CB CYS A 115 8.176 0.664 -1.746 1.00 0.00 C ATOM 1811 SG CYS A 115 8.671 1.514 -0.229 1.00 0.00 S ATOM 0 H CYS A 115 6.424 -0.034 -3.724 1.00 0.00 H new ATOM 0 HA CYS A 115 6.905 -0.827 -0.898 1.00 0.00 H new ATOM 0 HB2 CYS A 115 8.944 -0.065 -2.006 1.00 0.00 H new ATOM 0 HB3 CYS A 115 8.138 1.390 -2.558 1.00 0.00 H new ATOM 0 HG CYS A 115 9.826 2.083 -0.408 1.00 0.00 H new ATOM 1817 N ILE A 116 4.881 0.498 -0.348 1.00 0.00 N ATOM 1818 CA ILE A 116 3.711 1.257 0.076 1.00 0.00 C ATOM 1819 C ILE A 116 3.968 1.879 1.446 1.00 0.00 C ATOM 1820 O ILE A 116 4.713 1.331 2.275 1.00 0.00 O ATOM 1821 CB ILE A 116 2.422 0.347 0.081 1.00 0.00 C ATOM 1822 CG1 ILE A 116 2.227 -0.301 -1.317 1.00 0.00 C ATOM 1823 CG2 ILE A 116 1.149 1.137 0.483 1.00 0.00 C ATOM 1824 CD1 ILE A 116 2.095 0.697 -2.458 1.00 0.00 C ATOM 0 H ILE A 116 4.995 -0.387 0.146 1.00 0.00 H new ATOM 0 HA ILE A 116 3.531 2.062 -0.636 1.00 0.00 H new ATOM 0 HB ILE A 116 2.572 -0.431 0.830 1.00 0.00 H new ATOM 0 HG12 ILE A 116 3.072 -0.958 -1.521 1.00 0.00 H new ATOM 0 HG13 ILE A 116 1.335 -0.927 -1.293 1.00 0.00 H new ATOM 0 HG21 ILE A 116 0.288 0.469 0.472 1.00 0.00 H new ATOM 0 HG22 ILE A 116 1.277 1.548 1.484 1.00 0.00 H new ATOM 0 HG23 ILE A 116 0.987 1.950 -0.225 1.00 0.00 H new ATOM 0 HD11 ILE A 116 1.962 0.160 -3.397 1.00 0.00 H new ATOM 0 HD12 ILE A 116 1.232 1.339 -2.282 1.00 0.00 H new ATOM 0 HD13 ILE A 116 2.996 1.308 -2.513 1.00 0.00 H new ATOM 1836 N ASN A 117 3.348 3.041 1.638 1.00 0.00 N ATOM 1837 CA ASN A 117 3.465 3.864 2.832 1.00 0.00 C ATOM 1838 C ASN A 117 2.892 3.116 4.047 1.00 0.00 C ATOM 1839 O ASN A 117 1.714 2.754 4.048 1.00 0.00 O ATOM 1840 CB ASN A 117 2.711 5.193 2.570 1.00 0.00 C ATOM 1841 CG ASN A 117 3.271 5.966 1.358 1.00 0.00 C ATOM 1842 OD1 ASN A 117 4.479 6.002 1.127 1.00 0.00 O ATOM 1843 ND2 ASN A 117 2.397 6.557 0.563 1.00 0.00 N ATOM 0 H ASN A 117 2.728 3.448 0.938 1.00 0.00 H new ATOM 0 HA ASN A 117 4.510 4.081 3.054 1.00 0.00 H new ATOM 0 HB2 ASN A 117 1.655 4.980 2.404 1.00 0.00 H new ATOM 0 HB3 ASN A 117 2.773 5.823 3.458 1.00 0.00 H new ATOM 0 HD21 ASN A 117 2.718 7.058 -0.265 1.00 0.00 H new ATOM 0 HD22 ASN A 117 1.401 6.512 0.777 1.00 0.00 H new ATOM 1850 N SER A 118 3.743 2.866 5.058 1.00 0.00 N ATOM 1851 CA SER A 118 3.359 2.107 6.266 1.00 0.00 C ATOM 1852 C SER A 118 2.250 2.833 7.067 1.00 0.00 C ATOM 1853 O SER A 118 1.445 2.191 7.750 1.00 0.00 O ATOM 1854 CB SER A 118 4.602 1.848 7.149 1.00 0.00 C ATOM 1855 OG SER A 118 4.309 1.034 8.283 1.00 0.00 O ATOM 0 H SER A 118 4.713 3.182 5.063 1.00 0.00 H new ATOM 0 HA SER A 118 2.950 1.148 5.948 1.00 0.00 H new ATOM 0 HB2 SER A 118 5.375 1.366 6.550 1.00 0.00 H new ATOM 0 HB3 SER A 118 5.009 2.801 7.486 1.00 0.00 H new ATOM 0 HG SER A 118 5.125 0.898 8.808 1.00 0.00 H new ATOM 1861 N ALA A 119 2.212 4.175 6.950 1.00 0.00 N ATOM 1862 CA ALA A 119 1.170 5.011 7.579 1.00 0.00 C ATOM 1863 C ALA A 119 -0.178 4.859 6.849 1.00 0.00 C ATOM 1864 O ALA A 119 -1.241 5.086 7.444 1.00 0.00 O ATOM 1865 CB ALA A 119 1.614 6.481 7.584 1.00 0.00 C ATOM 0 H ALA A 119 2.900 4.709 6.419 1.00 0.00 H new ATOM 0 HA ALA A 119 1.033 4.676 8.607 1.00 0.00 H new ATOM 0 HB1 ALA A 119 0.841 7.093 8.049 1.00 0.00 H new ATOM 0 HB2 ALA A 119 2.542 6.579 8.147 1.00 0.00 H new ATOM 0 HB3 ALA A 119 1.774 6.816 6.559 1.00 0.00 H new ATOM 1871 N ALA A 120 -0.126 4.471 5.556 1.00 0.00 N ATOM 1872 CA ALA A 120 -1.328 4.344 4.724 1.00 0.00 C ATOM 1873 C ALA A 120 -2.020 3.012 4.989 1.00 0.00 C ATOM 1874 O ALA A 120 -3.232 2.899 4.842 1.00 0.00 O ATOM 1875 CB ALA A 120 -0.984 4.499 3.235 1.00 0.00 C ATOM 0 H ALA A 120 0.741 4.241 5.071 1.00 0.00 H new ATOM 0 HA ALA A 120 -2.016 5.146 4.991 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -1.892 4.401 2.640 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -0.542 5.481 3.064 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -0.273 3.726 2.943 1.00 0.00 H new ATOM 1881 N LEU A 121 -1.228 2.026 5.428 1.00 0.00 N ATOM 1882 CA LEU A 121 -1.658 0.635 5.542 1.00 0.00 C ATOM 1883 C LEU A 121 -2.408 0.347 6.837 1.00 0.00 C ATOM 1884 O LEU A 121 -2.175 0.977 7.873 1.00 0.00 O ATOM 1885 CB LEU A 121 -0.429 -0.290 5.414 1.00 0.00 C ATOM 1886 CG LEU A 121 0.289 -0.199 4.043 1.00 0.00 C ATOM 1887 CD1 LEU A 121 1.501 -1.131 3.976 1.00 0.00 C ATOM 1888 CD2 LEU A 121 -0.716 -0.456 2.903 1.00 0.00 C ATOM 0 H LEU A 121 -0.261 2.178 5.716 1.00 0.00 H new ATOM 0 HA LEU A 121 -2.362 0.442 4.732 1.00 0.00 H new ATOM 0 HB2 LEU A 121 0.282 -0.043 6.202 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -0.744 -1.320 5.580 1.00 0.00 H new ATOM 0 HG LEU A 121 0.680 0.811 3.921 1.00 0.00 H new ATOM 0 HD11 LEU A 121 1.977 -1.039 3.000 1.00 0.00 H new ATOM 0 HD12 LEU A 121 2.213 -0.858 4.755 1.00 0.00 H new ATOM 0 HD13 LEU A 121 1.177 -2.161 4.125 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -0.203 -0.390 1.944 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -1.148 -1.450 3.016 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -1.509 0.291 2.942 1.00 0.00 H new ATOM 1900 N ARG A 122 -3.294 -0.645 6.734 1.00 0.00 N ATOM 1901 CA ARG A 122 -4.107 -1.145 7.830 1.00 0.00 C ATOM 1902 C ARG A 122 -4.046 -2.668 7.808 1.00 0.00 C ATOM 1903 O ARG A 122 -4.516 -3.301 6.853 1.00 0.00 O ATOM 1904 CB ARG A 122 -5.585 -0.672 7.708 1.00 0.00 C ATOM 1905 CG ARG A 122 -6.447 -0.946 8.961 1.00 0.00 C ATOM 1906 CD ARG A 122 -5.927 -0.178 10.188 1.00 0.00 C ATOM 1907 NE ARG A 122 -6.694 -0.463 11.408 1.00 0.00 N ATOM 1908 CZ ARG A 122 -6.372 -0.018 12.626 1.00 0.00 C ATOM 1909 NH1 ARG A 122 -5.265 0.699 12.816 1.00 0.00 N ATOM 1910 NH2 ARG A 122 -7.155 -0.305 13.652 1.00 0.00 N ATOM 0 H ARG A 122 -3.467 -1.134 5.856 1.00 0.00 H new ATOM 0 HA ARG A 122 -3.718 -0.755 8.771 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -5.596 0.398 7.501 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -6.043 -1.167 6.851 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -7.479 -0.659 8.762 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -6.449 -2.015 9.175 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -4.881 -0.435 10.354 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -5.964 0.892 9.983 1.00 0.00 H new ATOM 0 HE ARG A 122 -7.530 -1.040 11.319 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -4.654 0.913 12.028 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -5.028 1.034 13.750 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -7.998 -0.862 13.510 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -6.916 0.031 14.585 1.00 0.00 H new ATOM 1924 N PHE A 123 -3.437 -3.228 8.848 1.00 0.00 N ATOM 1925 CA PHE A 123 -3.425 -4.669 9.094 1.00 0.00 C ATOM 1926 C PHE A 123 -4.858 -5.111 9.437 1.00 0.00 C ATOM 1927 O PHE A 123 -5.460 -4.612 10.395 1.00 0.00 O ATOM 1928 CB PHE A 123 -2.409 -5.032 10.231 1.00 0.00 C ATOM 1929 CG PHE A 123 -2.541 -4.166 11.492 1.00 0.00 C ATOM 1930 CD1 PHE A 123 -1.867 -2.947 11.599 1.00 0.00 C ATOM 1931 CD2 PHE A 123 -3.372 -4.545 12.547 1.00 0.00 C ATOM 1932 CE1 PHE A 123 -2.022 -2.148 12.710 1.00 0.00 C ATOM 1933 CE2 PHE A 123 -3.517 -3.742 13.659 1.00 0.00 C ATOM 1934 CZ PHE A 123 -2.849 -2.544 13.737 1.00 0.00 C ATOM 0 H PHE A 123 -2.932 -2.690 9.552 1.00 0.00 H new ATOM 0 HA PHE A 123 -3.092 -5.202 8.203 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -2.547 -6.078 10.506 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -1.395 -4.935 9.842 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -1.215 -2.627 10.799 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -3.909 -5.480 12.492 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -1.493 -1.208 12.776 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -4.157 -4.056 14.470 1.00 0.00 H new ATOM 0 HZ PHE A 123 -2.973 -1.913 14.604 1.00 0.00 H new ATOM 1944 N VAL A 124 -5.438 -5.963 8.590 1.00 0.00 N ATOM 1945 CA VAL A 124 -6.762 -6.541 8.823 1.00 0.00 C ATOM 1946 C VAL A 124 -6.606 -8.066 8.720 1.00 0.00 C ATOM 1947 O VAL A 124 -6.502 -8.591 7.606 1.00 0.00 O ATOM 1948 CB VAL A 124 -7.866 -6.021 7.817 1.00 0.00 C ATOM 1949 CG1 VAL A 124 -9.287 -6.440 8.292 1.00 0.00 C ATOM 1950 CG2 VAL A 124 -7.784 -4.485 7.617 1.00 0.00 C ATOM 0 H VAL A 124 -5.002 -6.272 7.721 1.00 0.00 H new ATOM 0 HA VAL A 124 -7.114 -6.234 9.808 1.00 0.00 H new ATOM 0 HB VAL A 124 -7.673 -6.487 6.851 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -10.030 -6.072 7.585 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -9.346 -7.527 8.347 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -9.481 -6.015 9.277 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -8.559 -4.167 6.919 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -7.931 -3.985 8.574 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -6.805 -4.222 7.217 1.00 0.00 H new ATOM 1960 N PRO A 125 -6.497 -8.794 9.880 1.00 0.00 N ATOM 1961 CA PRO A 125 -6.341 -10.267 9.889 1.00 0.00 C ATOM 1962 C PRO A 125 -7.590 -10.991 9.383 1.00 0.00 C ATOM 1963 O PRO A 125 -8.665 -10.396 9.367 1.00 0.00 O ATOM 1964 CB PRO A 125 -6.043 -10.589 11.373 1.00 0.00 C ATOM 1965 CG PRO A 125 -6.680 -9.464 12.131 1.00 0.00 C ATOM 1966 CD PRO A 125 -6.493 -8.241 11.264 1.00 0.00 C ATOM 0 HA PRO A 125 -5.553 -10.605 9.217 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -6.463 -11.552 11.663 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -4.971 -10.639 11.562 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -7.737 -9.660 12.311 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -6.210 -9.331 13.105 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -7.296 -7.518 11.410 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -5.558 -7.728 11.489 1.00 0.00 H new ATOM 1974 N LYS A 126 -7.442 -12.279 8.978 1.00 0.00 N ATOM 1975 CA LYS A 126 -8.569 -13.097 8.439 1.00 0.00 C ATOM 1976 C LYS A 126 -9.754 -13.153 9.417 1.00 0.00 C ATOM 1977 O LYS A 126 -10.910 -13.266 8.999 1.00 0.00 O ATOM 1978 CB LYS A 126 -8.130 -14.538 8.086 1.00 0.00 C ATOM 1979 CG LYS A 126 -6.931 -14.652 7.125 1.00 0.00 C ATOM 1980 CD LYS A 126 -6.708 -16.104 6.627 1.00 0.00 C ATOM 1981 CE LYS A 126 -6.695 -17.157 7.761 1.00 0.00 C ATOM 1982 NZ LYS A 126 -5.671 -16.871 8.797 1.00 0.00 N ATOM 0 H LYS A 126 -6.553 -12.777 9.013 1.00 0.00 H new ATOM 0 HA LYS A 126 -8.888 -12.597 7.524 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.883 -15.060 9.010 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -8.979 -15.059 7.643 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -7.092 -13.998 6.268 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -6.030 -14.301 7.629 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -7.494 -16.359 5.916 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -5.762 -16.152 6.088 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -7.679 -17.193 8.229 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -6.509 -18.142 7.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -5.354 -17.763 9.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -4.859 -16.390 8.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -6.081 -16.259 9.531 1.00 0.00 H new ATOM 1996 N HIS A 127 -9.422 -13.044 10.717 1.00 0.00 N ATOM 1997 CA HIS A 127 -10.390 -13.033 11.830 1.00 0.00 C ATOM 1998 C HIS A 127 -11.355 -11.838 11.681 1.00 0.00 C ATOM 1999 O HIS A 127 -12.553 -11.949 11.944 1.00 0.00 O ATOM 2000 CB HIS A 127 -9.647 -12.957 13.196 1.00 0.00 C ATOM 2001 CG HIS A 127 -8.468 -13.896 13.347 1.00 0.00 C ATOM 2002 ND1 HIS A 127 -8.592 -15.230 13.673 1.00 0.00 N ATOM 2003 CD2 HIS A 127 -7.131 -13.667 13.242 1.00 0.00 C ATOM 2004 CE1 HIS A 127 -7.390 -15.778 13.762 1.00 0.00 C ATOM 2005 NE2 HIS A 127 -6.492 -14.847 13.507 1.00 0.00 N ATOM 0 H HIS A 127 -8.455 -12.959 11.029 1.00 0.00 H new ATOM 0 HA HIS A 127 -10.966 -13.958 11.800 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -9.297 -11.935 13.344 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -10.362 -13.168 13.991 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -6.661 -12.727 12.995 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -7.181 -16.810 14.002 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -5.481 -14.985 13.507 1.00 0.00 H new ATOM 2014 N LYS A 128 -10.809 -10.704 11.216 1.00 0.00 N ATOM 2015 CA LYS A 128 -11.569 -9.462 11.009 1.00 0.00 C ATOM 2016 C LYS A 128 -12.045 -9.343 9.565 1.00 0.00 C ATOM 2017 O LYS A 128 -13.004 -8.638 9.307 1.00 0.00 O ATOM 2018 CB LYS A 128 -10.712 -8.230 11.414 1.00 0.00 C ATOM 2019 CG LYS A 128 -10.587 -8.049 12.941 1.00 0.00 C ATOM 2020 CD LYS A 128 -11.958 -7.753 13.607 1.00 0.00 C ATOM 2021 CE LYS A 128 -11.899 -7.773 15.138 1.00 0.00 C ATOM 2022 NZ LYS A 128 -13.214 -7.443 15.734 1.00 0.00 N ATOM 0 H LYS A 128 -9.822 -10.623 10.972 1.00 0.00 H new ATOM 0 HA LYS A 128 -12.453 -9.493 11.647 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -9.715 -8.332 10.984 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -11.154 -7.331 10.984 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -10.159 -8.951 13.379 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -9.897 -7.232 13.154 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -12.313 -6.777 13.276 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -12.687 -8.489 13.268 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -11.581 -8.758 15.478 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -11.152 -7.059 15.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -13.140 -7.465 16.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -13.505 -6.493 15.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -13.921 -8.139 15.422 1.00 0.00 H new ATOM 2036 N LEU A 129 -11.383 -10.062 8.638 1.00 0.00 N ATOM 2037 CA LEU A 129 -11.715 -10.023 7.203 1.00 0.00 C ATOM 2038 C LEU A 129 -13.076 -10.664 6.953 1.00 0.00 C ATOM 2039 O LEU A 129 -13.884 -10.115 6.225 1.00 0.00 O ATOM 2040 CB LEU A 129 -10.629 -10.724 6.364 1.00 0.00 C ATOM 2041 CG LEU A 129 -9.267 -9.975 6.262 1.00 0.00 C ATOM 2042 CD1 LEU A 129 -8.191 -10.850 5.606 1.00 0.00 C ATOM 2043 CD2 LEU A 129 -9.423 -8.638 5.520 1.00 0.00 C ATOM 0 H LEU A 129 -10.606 -10.684 8.863 1.00 0.00 H new ATOM 0 HA LEU A 129 -11.759 -8.978 6.895 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -10.449 -11.712 6.788 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -11.016 -10.876 5.356 1.00 0.00 H new ATOM 0 HG LEU A 129 -8.937 -9.757 7.278 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -7.254 -10.295 5.551 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -8.044 -11.752 6.200 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -8.509 -11.125 4.600 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -8.456 -8.138 5.464 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -9.795 -8.822 4.512 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -10.129 -8.004 6.057 1.00 0.00 H new ATOM 2055 N LYS A 130 -13.352 -11.796 7.622 1.00 0.00 N ATOM 2056 CA LYS A 130 -14.633 -12.511 7.474 1.00 0.00 C ATOM 2057 C LYS A 130 -15.819 -11.669 7.989 1.00 0.00 C ATOM 2058 O LYS A 130 -16.972 -11.946 7.676 1.00 0.00 O ATOM 2059 CB LYS A 130 -14.541 -13.923 8.129 1.00 0.00 C ATOM 2060 CG LYS A 130 -14.013 -13.986 9.595 1.00 0.00 C ATOM 2061 CD LYS A 130 -15.080 -13.700 10.675 1.00 0.00 C ATOM 2062 CE LYS A 130 -16.200 -14.754 10.710 1.00 0.00 C ATOM 2063 NZ LYS A 130 -17.156 -14.500 11.812 1.00 0.00 N ATOM 0 H LYS A 130 -12.703 -12.238 8.273 1.00 0.00 H new ATOM 0 HA LYS A 130 -14.831 -12.666 6.413 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -15.533 -14.373 8.106 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -13.895 -14.544 7.508 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -13.591 -14.975 9.773 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -13.201 -13.268 9.706 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -14.598 -13.658 11.652 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -15.518 -12.719 10.494 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -16.732 -14.752 9.759 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -15.763 -15.746 10.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -17.950 -15.168 11.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -16.675 -14.627 12.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -17.515 -13.526 11.743 1.00 0.00 H new ATOM 2077 N GLU A 131 -15.507 -10.659 8.804 1.00 0.00 N ATOM 2078 CA GLU A 131 -16.453 -9.619 9.222 1.00 0.00 C ATOM 2079 C GLU A 131 -16.468 -8.450 8.207 1.00 0.00 C ATOM 2080 O GLU A 131 -17.532 -7.947 7.830 1.00 0.00 O ATOM 2081 CB GLU A 131 -16.062 -9.120 10.636 1.00 0.00 C ATOM 2082 CG GLU A 131 -16.075 -10.211 11.730 1.00 0.00 C ATOM 2083 CD GLU A 131 -17.482 -10.773 12.020 1.00 0.00 C ATOM 2084 OE1 GLU A 131 -17.928 -11.708 11.325 1.00 0.00 O ATOM 2085 OE2 GLU A 131 -18.149 -10.289 12.959 1.00 0.00 O ATOM 0 H GLU A 131 -14.575 -10.538 9.199 1.00 0.00 H new ATOM 0 HA GLU A 131 -17.459 -10.036 9.254 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -15.065 -8.683 10.590 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -16.746 -8.323 10.928 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -15.421 -11.028 11.425 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -15.661 -9.798 12.650 1.00 0.00 H new ATOM 2092 N GLU A 132 -15.264 -8.060 7.755 1.00 0.00 N ATOM 2093 CA GLU A 132 -15.013 -6.779 7.051 1.00 0.00 C ATOM 2094 C GLU A 132 -14.828 -6.981 5.529 1.00 0.00 C ATOM 2095 O GLU A 132 -14.244 -6.126 4.847 1.00 0.00 O ATOM 2096 CB GLU A 132 -13.759 -6.093 7.687 1.00 0.00 C ATOM 2097 CG GLU A 132 -13.645 -4.571 7.449 1.00 0.00 C ATOM 2098 CD GLU A 132 -14.828 -3.786 8.039 1.00 0.00 C ATOM 2099 OE1 GLU A 132 -14.879 -3.614 9.280 1.00 0.00 O ATOM 2100 OE2 GLU A 132 -15.720 -3.347 7.279 1.00 0.00 O ATOM 0 H GLU A 132 -14.424 -8.628 7.867 1.00 0.00 H new ATOM 0 HA GLU A 132 -15.884 -6.135 7.170 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -13.772 -6.276 8.761 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -12.864 -6.573 7.292 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.717 -4.207 7.890 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.585 -4.379 6.378 1.00 0.00 H new ATOM 2107 N GLY A 133 -15.323 -8.108 4.982 1.00 0.00 N ATOM 2108 CA GLY A 133 -15.288 -8.322 3.525 1.00 0.00 C ATOM 2109 C GLY A 133 -14.248 -9.340 3.086 1.00 0.00 C ATOM 2110 O GLY A 133 -13.360 -9.003 2.317 1.00 0.00 O ATOM 0 H GLY A 133 -15.743 -8.869 5.515 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -16.272 -8.652 3.191 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -15.086 -7.372 3.031 1.00 0.00 H new ATOM 2114 N TYR A 134 -14.316 -10.562 3.656 1.00 0.00 N ATOM 2115 CA TYR A 134 -13.400 -11.701 3.344 1.00 0.00 C ATOM 2116 C TYR A 134 -13.122 -11.921 1.839 1.00 0.00 C ATOM 2117 O TYR A 134 -12.061 -12.393 1.482 1.00 0.00 O ATOM 2118 CB TYR A 134 -13.920 -13.022 3.968 1.00 0.00 C ATOM 2119 CG TYR A 134 -15.255 -13.554 3.408 1.00 0.00 C ATOM 2120 CD1 TYR A 134 -16.478 -13.037 3.839 1.00 0.00 C ATOM 2121 CD2 TYR A 134 -15.287 -14.585 2.460 1.00 0.00 C ATOM 2122 CE1 TYR A 134 -17.678 -13.520 3.345 1.00 0.00 C ATOM 2123 CE2 TYR A 134 -16.483 -15.072 1.967 1.00 0.00 C ATOM 2124 CZ TYR A 134 -17.678 -14.537 2.413 1.00 0.00 C ATOM 2125 OH TYR A 134 -18.878 -15.028 1.929 1.00 0.00 O ATOM 0 H TYR A 134 -15.017 -10.798 4.358 1.00 0.00 H new ATOM 0 HA TYR A 134 -12.449 -11.414 3.792 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -13.159 -13.790 3.830 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -14.032 -12.874 5.042 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -16.488 -12.244 4.572 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -14.358 -15.008 2.107 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -18.612 -13.101 3.689 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -16.484 -15.867 1.236 1.00 0.00 H new ATOM 0 HH TYR A 134 -18.702 -15.740 1.280 1.00 0.00 H new ATOM 2135 N GLU A 135 -14.078 -11.560 0.979 1.00 0.00 N ATOM 2136 CA GLU A 135 -13.931 -11.664 -0.497 1.00 0.00 C ATOM 2137 C GLU A 135 -12.741 -10.816 -1.037 1.00 0.00 C ATOM 2138 O GLU A 135 -12.288 -11.012 -2.164 1.00 0.00 O ATOM 2139 CB GLU A 135 -15.262 -11.269 -1.181 1.00 0.00 C ATOM 2140 CG GLU A 135 -16.457 -12.156 -0.779 1.00 0.00 C ATOM 2141 CD GLU A 135 -17.771 -11.730 -1.452 1.00 0.00 C ATOM 2142 OE1 GLU A 135 -18.423 -10.781 -0.962 1.00 0.00 O ATOM 2143 OE2 GLU A 135 -18.160 -12.334 -2.472 1.00 0.00 O ATOM 0 H GLU A 135 -14.980 -11.186 1.274 1.00 0.00 H new ATOM 0 HA GLU A 135 -13.699 -12.701 -0.740 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -15.492 -10.232 -0.935 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -15.132 -11.319 -2.262 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -16.239 -13.191 -1.042 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -16.581 -12.121 0.303 1.00 0.00 H new ATOM 2150 N SER A 136 -12.244 -9.891 -0.200 1.00 0.00 N ATOM 2151 CA SER A 136 -11.117 -9.001 -0.521 1.00 0.00 C ATOM 2152 C SER A 136 -9.777 -9.779 -0.446 1.00 0.00 C ATOM 2153 O SER A 136 -8.892 -9.602 -1.276 1.00 0.00 O ATOM 2154 CB SER A 136 -11.132 -7.803 0.467 1.00 0.00 C ATOM 2155 OG SER A 136 -10.204 -6.803 0.116 1.00 0.00 O ATOM 0 H SER A 136 -12.621 -9.738 0.735 1.00 0.00 H new ATOM 0 HA SER A 136 -11.216 -8.623 -1.539 1.00 0.00 H new ATOM 0 HB2 SER A 136 -12.133 -7.372 0.495 1.00 0.00 H new ATOM 0 HB3 SER A 136 -10.911 -8.162 1.472 1.00 0.00 H new ATOM 0 HG SER A 136 -10.251 -6.070 0.765 1.00 0.00 H new ATOM 2161 N TYR A 137 -9.620 -10.605 0.604 1.00 0.00 N ATOM 2162 CA TYR A 137 -8.444 -11.503 0.743 1.00 0.00 C ATOM 2163 C TYR A 137 -8.781 -12.952 0.393 1.00 0.00 C ATOM 2164 O TYR A 137 -8.282 -13.497 -0.576 1.00 0.00 O ATOM 2165 CB TYR A 137 -7.906 -11.448 2.182 1.00 0.00 C ATOM 2166 CG TYR A 137 -6.684 -12.341 2.437 1.00 0.00 C ATOM 2167 CD1 TYR A 137 -5.482 -12.091 1.794 1.00 0.00 C ATOM 2168 CD2 TYR A 137 -6.746 -13.452 3.286 1.00 0.00 C ATOM 2169 CE1 TYR A 137 -4.398 -12.901 1.991 1.00 0.00 C ATOM 2170 CE2 TYR A 137 -5.654 -14.266 3.474 1.00 0.00 C ATOM 2171 CZ TYR A 137 -4.486 -13.984 2.824 1.00 0.00 C ATOM 2172 OH TYR A 137 -3.400 -14.797 2.985 1.00 0.00 O ATOM 0 H TYR A 137 -10.288 -10.674 1.371 1.00 0.00 H new ATOM 0 HA TYR A 137 -7.688 -11.151 0.042 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -7.643 -10.417 2.419 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -8.703 -11.740 2.866 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -5.400 -11.245 1.128 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -7.668 -13.674 3.803 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -3.468 -12.685 1.487 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -5.719 -15.121 4.130 1.00 0.00 H new ATOM 0 HH TYR A 137 -3.359 -15.438 2.245 1.00 0.00 H new ATOM 2182 N LEU A 138 -9.659 -13.542 1.204 1.00 0.00 N ATOM 2183 CA LEU A 138 -9.923 -14.994 1.258 1.00 0.00 C ATOM 2184 C LEU A 138 -10.422 -15.547 -0.102 1.00 0.00 C ATOM 2185 O LEU A 138 -10.371 -16.754 -0.334 1.00 0.00 O ATOM 2186 CB LEU A 138 -10.921 -15.324 2.421 1.00 0.00 C ATOM 2187 CG LEU A 138 -10.427 -15.063 3.901 1.00 0.00 C ATOM 2188 CD1 LEU A 138 -10.208 -13.565 4.210 1.00 0.00 C ATOM 2189 CD2 LEU A 138 -11.408 -15.650 4.936 1.00 0.00 C ATOM 0 H LEU A 138 -10.228 -13.013 1.865 1.00 0.00 H new ATOM 0 HA LEU A 138 -8.979 -15.498 1.466 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -11.828 -14.742 2.261 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -11.198 -16.375 2.339 1.00 0.00 H new ATOM 0 HG LEU A 138 -9.464 -15.569 3.978 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -9.870 -13.452 5.240 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -9.455 -13.160 3.534 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -11.145 -13.025 4.074 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -11.037 -15.452 5.942 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -12.387 -15.187 4.813 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -11.494 -16.726 4.786 1.00 0.00 H new ATOM 2201 N HIS A 139 -10.947 -14.661 -0.974 1.00 0.00 N ATOM 2202 CA HIS A 139 -11.291 -15.014 -2.367 1.00 0.00 C ATOM 2203 C HIS A 139 -10.063 -14.869 -3.309 1.00 0.00 C ATOM 2204 O HIS A 139 -9.718 -15.819 -4.023 1.00 0.00 O ATOM 2205 CB HIS A 139 -12.465 -14.154 -2.868 1.00 0.00 C ATOM 2206 CG HIS A 139 -12.921 -14.485 -4.261 1.00 0.00 C ATOM 2207 ND1 HIS A 139 -12.715 -13.651 -5.336 1.00 0.00 N ATOM 2208 CD2 HIS A 139 -13.587 -15.561 -4.745 1.00 0.00 C ATOM 2209 CE1 HIS A 139 -13.235 -14.193 -6.420 1.00 0.00 C ATOM 2210 NE2 HIS A 139 -13.770 -15.351 -6.090 1.00 0.00 N ATOM 0 H HIS A 139 -11.143 -13.689 -0.735 1.00 0.00 H new ATOM 0 HA HIS A 139 -11.596 -16.060 -2.380 1.00 0.00 H new ATOM 0 HB2 HIS A 139 -13.306 -14.273 -2.185 1.00 0.00 H new ATOM 0 HB3 HIS A 139 -12.173 -13.105 -2.833 1.00 0.00 H new ATOM 0 HD2 HIS A 139 -13.913 -16.422 -4.180 1.00 0.00 H new ATOM 0 HE1 HIS A 139 -13.224 -13.761 -7.410 1.00 0.00 H new ATOM 0 HE2 HIS A 139 -14.244 -15.989 -6.730 1.00 0.00 H new ATOM 2219 N LEU A 140 -9.419 -13.669 -3.305 1.00 0.00 N ATOM 2220 CA LEU A 140 -8.296 -13.345 -4.231 1.00 0.00 C ATOM 2221 C LEU A 140 -7.094 -14.286 -4.013 1.00 0.00 C ATOM 2222 O LEU A 140 -6.563 -14.871 -4.962 1.00 0.00 O ATOM 2223 CB LEU A 140 -7.826 -11.864 -4.050 1.00 0.00 C ATOM 2224 CG LEU A 140 -8.808 -10.741 -4.510 1.00 0.00 C ATOM 2225 CD1 LEU A 140 -8.200 -9.337 -4.260 1.00 0.00 C ATOM 2226 CD2 LEU A 140 -9.192 -10.904 -5.991 1.00 0.00 C ATOM 0 H LEU A 140 -9.659 -12.908 -2.669 1.00 0.00 H new ATOM 0 HA LEU A 140 -8.673 -13.483 -5.244 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -7.604 -11.707 -2.994 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -6.890 -11.738 -4.594 1.00 0.00 H new ATOM 0 HG LEU A 140 -9.716 -10.836 -3.914 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -8.903 -8.572 -4.589 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -7.999 -9.212 -3.196 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -7.269 -9.239 -4.819 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -9.877 -10.106 -6.279 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -8.294 -10.852 -6.607 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -9.677 -11.869 -6.137 1.00 0.00 H new ATOM 2238 N PHE A 141 -6.698 -14.414 -2.742 1.00 0.00 N ATOM 2239 CA PHE A 141 -5.561 -15.246 -2.310 1.00 0.00 C ATOM 2240 C PHE A 141 -5.821 -16.748 -2.554 1.00 0.00 C ATOM 2241 O PHE A 141 -4.880 -17.499 -2.853 1.00 0.00 O ATOM 2242 CB PHE A 141 -5.272 -14.980 -0.815 1.00 0.00 C ATOM 2243 CG PHE A 141 -3.975 -15.597 -0.294 1.00 0.00 C ATOM 2244 CD1 PHE A 141 -2.751 -14.949 -0.489 1.00 0.00 C ATOM 2245 CD2 PHE A 141 -3.976 -16.808 0.403 1.00 0.00 C ATOM 2246 CE1 PHE A 141 -1.580 -15.488 -0.004 1.00 0.00 C ATOM 2247 CE2 PHE A 141 -2.799 -17.349 0.884 1.00 0.00 C ATOM 2248 CZ PHE A 141 -1.605 -16.687 0.680 1.00 0.00 C ATOM 0 H PHE A 141 -7.163 -13.937 -1.970 1.00 0.00 H new ATOM 0 HA PHE A 141 -4.691 -14.973 -2.906 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -5.237 -13.903 -0.652 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -6.104 -15.364 -0.225 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -2.724 -14.013 -1.027 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -4.908 -17.328 0.568 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -0.643 -14.973 -0.159 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -2.813 -18.287 1.418 1.00 0.00 H new ATOM 0 HZ PHE A 141 -0.685 -17.109 1.057 1.00 0.00 H new ATOM 2258 N ASN A 142 -7.092 -17.181 -2.405 1.00 0.00 N ATOM 2259 CA ASN A 142 -7.479 -18.581 -2.661 1.00 0.00 C ATOM 2260 C ASN A 142 -7.581 -18.798 -4.178 1.00 0.00 C ATOM 2261 O ASN A 142 -8.666 -18.745 -4.770 1.00 0.00 O ATOM 2262 CB ASN A 142 -8.799 -18.963 -1.939 1.00 0.00 C ATOM 2263 CG ASN A 142 -9.131 -20.463 -2.019 1.00 0.00 C ATOM 2264 OD1 ASN A 142 -8.232 -21.306 -2.094 1.00 0.00 O ATOM 2265 ND2 ASN A 142 -10.416 -20.807 -1.981 1.00 0.00 N ATOM 0 H ASN A 142 -7.863 -16.582 -2.110 1.00 0.00 H new ATOM 0 HA ASN A 142 -6.712 -19.239 -2.252 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -8.729 -18.670 -0.891 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -9.620 -18.394 -2.375 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -10.682 -21.791 -2.014 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -11.135 -20.086 -1.919 1.00 0.00 H new