USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1018 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 14 ASN : amide:sc= -2.29! C(o=-1.5!,f=-8.5!) USER MOD Set 1.2: A 42 SER OG : rot -100:sc= 1.87 USER MOD Set 1.3: A 71 HIS : no HD1:sc= -1.05 K(o=-1.5,f=-3.1) USER MOD Set 2.1: A 49 HIS : no HD1:sc= -1.25 X(o=-1,f=-0.95) USER MOD Set 2.2: A 52 SER OG : rot -150:sc= 0.228 USER MOD Set 3.1: A 45 THR OG1 : rot 160:sc= 0 USER MOD Set 3.2: A 93 HIS : no HE2:sc= -3.33 K(o=-3.3,f=-5.3!) USER MOD Set 4.1: A 28 GLN : amide:sc= -0.315 K(o=0.018,f=-0.84) USER MOD Set 4.2: A 67 TYR OH : rot 180:sc= 0 USER MOD Set 4.3: A 150 HIS : no HE2:sc= 0.333 K(o=0.018,f=-2!) USER MOD Set 5.1: A 11 CYS SG : rot -150:sc= -0.112 USER MOD Set 5.2: A 12 THR OG1 : rot 180:sc= 0.0894 USER MOD Set 6.1: A 6 HIS : no HE2:sc= -0.0433 K(o=-3.9,f=-6.1!) USER MOD Set 6.2: A 8 THR OG1 : rot -127:sc= -0.733 USER MOD Set 6.3: A 41 THR OG1 : rot -147:sc= 0.133 USER MOD Set 6.4: A 80 HIS : no HD1:sc= -3.27! C(o=-3.9!,f=-5.6!) USER MOD Single : A 16 CYS SG : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= -0.396 USER MOD Single : A 20 MET CE :methyl 165:sc= -3.33 (180deg=-4.06) USER MOD Single : A 23 LYS NZ :NH3+ 165:sc= 1.03 (180deg=0.838) USER MOD Single : A 24 MET CE :methyl -132:sc= -1.47 (180deg=-4.14!) USER MOD Single : A 27 GLN : amide:sc= -1.66 K(o=-1.7,f=-0.2) USER MOD Single : A 31 HIS : no HD1:sc= -0.0295 X(o=-0.029,f=0) USER MOD Single : A 47 ASN : amide:sc= -0.433 X(o=-0.43,f=-0.66) USER MOD Single : A 53 CYS SG : rot 31:sc= -0.115 USER MOD Single : A 65 HIS : no HD1:sc= -1.64! C(o=-1.6!,f=-4.7!) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= -1.04 X(o=-1,f=-1.4) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -0.0264 K(o=-0.026,f=-2.3!) USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 109 MET CE :methyl -142:sc= -2.24 (180deg=-5.82!) USER MOD Single : A 112 SER OG : rot -35:sc= 0.363 USER MOD Single : A 144 SER OG : rot 75:sc= 1.28 USER MOD ----------------------------------------------------------------- ATOM 50 N PRO A 4 -6.057 20.487 -17.563 1.00 1.00 N ATOM 51 CA PRO A 4 -5.938 21.221 -16.302 1.00 1.00 C ATOM 52 C PRO A 4 -4.724 22.139 -16.262 1.00 1.00 C ATOM 53 O PRO A 4 -3.787 22.000 -17.052 1.00 1.00 O ATOM 54 CB PRO A 4 -5.796 20.120 -15.250 1.00 1.00 C ATOM 55 CG PRO A 4 -5.293 18.940 -15.999 1.00 1.00 C ATOM 56 CD PRO A 4 -5.877 19.042 -17.373 1.00 1.00 C ATOM 0 HA PRO A 4 -6.795 21.876 -16.146 1.00 1.00 H new ATOM 0 HB2 PRO A 4 -5.102 20.413 -14.462 1.00 1.00 H new ATOM 0 HB3 PRO A 4 -6.751 19.906 -14.770 1.00 1.00 H new ATOM 0 HG2 PRO A 4 -4.204 18.938 -16.038 1.00 1.00 H new ATOM 0 HG3 PRO A 4 -5.597 18.012 -15.514 1.00 1.00 H new ATOM 0 HD2 PRO A 4 -5.211 18.618 -18.125 1.00 1.00 H new ATOM 0 HD3 PRO A 4 -6.823 18.506 -17.448 1.00 1.00 H new ATOM 64 N LEU A 5 -4.726 23.038 -15.291 1.00 1.00 N ATOM 65 CA LEU A 5 -3.642 23.998 -15.126 1.00 1.00 C ATOM 66 C LEU A 5 -2.377 23.312 -14.630 1.00 1.00 C ATOM 67 O LEU A 5 -2.347 22.097 -14.451 1.00 1.00 O ATOM 68 CB LEU A 5 -4.042 25.076 -14.133 1.00 1.00 C ATOM 69 CG LEU A 5 -3.470 26.466 -14.426 1.00 1.00 C ATOM 70 CD1 LEU A 5 -4.452 27.279 -15.249 1.00 1.00 C ATOM 71 CD2 LEU A 5 -3.105 27.185 -13.136 1.00 1.00 C ATOM 0 H LEU A 5 -5.471 23.124 -14.600 1.00 1.00 H new ATOM 0 HA LEU A 5 -3.444 24.447 -16.099 1.00 1.00 H new ATOM 0 HB2 LEU A 5 -5.130 25.144 -14.111 1.00 1.00 H new ATOM 0 HB3 LEU A 5 -3.721 24.770 -13.137 1.00 1.00 H new ATOM 0 HG LEU A 5 -2.556 26.348 -15.008 1.00 1.00 H new ATOM 0 HD11 LEU A 5 -4.031 28.264 -15.449 1.00 1.00 H new ATOM 0 HD12 LEU A 5 -4.646 26.769 -16.193 1.00 1.00 H new ATOM 0 HD13 LEU A 5 -5.386 27.389 -14.697 1.00 1.00 H new ATOM 0 HD21 LEU A 5 -2.701 28.170 -13.370 1.00 1.00 H new ATOM 0 HD22 LEU A 5 -3.995 27.296 -12.517 1.00 1.00 H new ATOM 0 HD23 LEU A 5 -2.357 26.605 -12.595 1.00 1.00 H new ATOM 83 N HIS A 6 -1.356 24.102 -14.328 1.00 1.00 N ATOM 84 CA HIS A 6 -0.096 23.551 -13.862 1.00 1.00 C ATOM 85 C HIS A 6 0.676 24.583 -13.061 1.00 1.00 C ATOM 86 O HIS A 6 1.250 25.506 -13.625 1.00 1.00 O ATOM 87 CB HIS A 6 0.761 23.120 -15.052 1.00 1.00 C ATOM 88 CG HIS A 6 1.606 21.902 -14.811 1.00 1.00 C ATOM 89 ND1 HIS A 6 2.405 21.345 -15.787 1.00 1.00 N ATOM 90 CD2 HIS A 6 1.784 21.140 -13.704 1.00 1.00 C ATOM 91 CE1 HIS A 6 3.035 20.295 -15.292 1.00 1.00 C ATOM 92 NE2 HIS A 6 2.679 20.149 -14.032 1.00 1.00 N ATOM 0 H HIS A 6 -1.377 25.119 -14.397 1.00 1.00 H new ATOM 0 HA HIS A 6 -0.319 22.691 -13.230 1.00 1.00 H new ATOM 0 HB2 HIS A 6 0.107 22.929 -15.903 1.00 1.00 H new ATOM 0 HB3 HIS A 6 1.413 23.948 -15.331 1.00 1.00 H new ATOM 0 HD1 HIS A 6 2.495 21.690 -16.743 1.00 1.00 H new ATOM 0 HD2 HIS A 6 1.311 21.284 -12.744 1.00 1.00 H new ATOM 0 HE1 HIS A 6 3.726 19.662 -15.830 1.00 1.00 H new ATOM 101 N VAL A 7 0.686 24.422 -11.753 1.00 1.00 N ATOM 102 CA VAL A 7 1.484 25.291 -10.898 1.00 1.00 C ATOM 103 C VAL A 7 2.690 24.494 -10.445 1.00 1.00 C ATOM 104 O VAL A 7 2.529 23.404 -9.915 1.00 1.00 O ATOM 105 CB VAL A 7 0.727 25.779 -9.643 1.00 1.00 C ATOM 106 CG1 VAL A 7 1.396 27.003 -9.050 1.00 1.00 C ATOM 107 CG2 VAL A 7 -0.730 26.060 -9.937 1.00 1.00 C ATOM 0 H VAL A 7 0.156 23.705 -11.258 1.00 1.00 H new ATOM 0 HA VAL A 7 1.749 26.177 -11.474 1.00 1.00 H new ATOM 0 HB VAL A 7 0.765 24.973 -8.910 1.00 1.00 H new ATOM 0 HG11 VAL A 7 0.844 27.328 -8.168 1.00 1.00 H new ATOM 0 HG12 VAL A 7 2.420 26.757 -8.768 1.00 1.00 H new ATOM 0 HG13 VAL A 7 1.405 27.806 -9.787 1.00 1.00 H new ATOM 0 HG21 VAL A 7 -1.225 26.401 -9.028 1.00 1.00 H new ATOM 0 HG22 VAL A 7 -0.804 26.833 -10.702 1.00 1.00 H new ATOM 0 HG23 VAL A 7 -1.212 25.149 -10.293 1.00 1.00 H new ATOM 117 N THR A 8 3.879 24.944 -10.772 1.00 1.00 N ATOM 118 CA THR A 8 5.073 24.235 -10.355 1.00 1.00 C ATOM 119 C THR A 8 5.976 25.150 -9.519 1.00 1.00 C ATOM 120 O THR A 8 6.432 26.187 -9.986 1.00 1.00 O ATOM 121 CB THR A 8 5.827 23.638 -11.572 1.00 1.00 C ATOM 122 OG1 THR A 8 6.809 22.698 -11.130 1.00 1.00 O ATOM 123 CG2 THR A 8 6.492 24.703 -12.429 1.00 1.00 C ATOM 0 H THR A 8 4.048 25.788 -11.319 1.00 1.00 H new ATOM 0 HA THR A 8 4.773 23.398 -9.725 1.00 1.00 H new ATOM 0 HB THR A 8 5.082 23.138 -12.191 1.00 1.00 H new ATOM 0 HG1 THR A 8 7.680 22.930 -11.515 1.00 1.00 H new ATOM 0 HG21 THR A 8 7.005 24.229 -13.266 1.00 1.00 H new ATOM 0 HG22 THR A 8 5.735 25.389 -12.809 1.00 1.00 H new ATOM 0 HG23 THR A 8 7.214 25.256 -11.828 1.00 1.00 H new ATOM 131 N PHE A 9 6.138 24.822 -8.242 1.00 1.00 N ATOM 132 CA PHE A 9 6.965 25.641 -7.356 1.00 1.00 C ATOM 133 C PHE A 9 8.425 25.275 -7.502 1.00 1.00 C ATOM 134 O PHE A 9 8.805 24.121 -7.317 1.00 1.00 O ATOM 135 CB PHE A 9 6.562 25.472 -5.901 1.00 1.00 C ATOM 136 CG PHE A 9 5.116 25.172 -5.716 1.00 1.00 C ATOM 137 CD1 PHE A 9 4.155 26.147 -5.889 1.00 1.00 C ATOM 138 CD2 PHE A 9 4.721 23.898 -5.377 1.00 1.00 C ATOM 139 CE1 PHE A 9 2.825 25.851 -5.722 1.00 1.00 C ATOM 140 CE2 PHE A 9 3.398 23.597 -5.209 1.00 1.00 C ATOM 141 CZ PHE A 9 2.447 24.573 -5.382 1.00 1.00 C ATOM 0 H PHE A 9 5.715 24.006 -7.799 1.00 1.00 H new ATOM 0 HA PHE A 9 6.812 26.680 -7.647 1.00 1.00 H new ATOM 0 HB2 PHE A 9 7.151 24.668 -5.460 1.00 1.00 H new ATOM 0 HB3 PHE A 9 6.808 26.383 -5.356 1.00 1.00 H new ATOM 0 HD1 PHE A 9 4.451 27.150 -6.158 1.00 1.00 H new ATOM 0 HD2 PHE A 9 5.465 23.127 -5.242 1.00 1.00 H new ATOM 0 HE1 PHE A 9 2.078 26.619 -5.857 1.00 1.00 H new ATOM 0 HE2 PHE A 9 3.101 22.594 -4.941 1.00 1.00 H new ATOM 0 HZ PHE A 9 1.401 24.337 -5.251 1.00 1.00 H new ATOM 151 N VAL A 10 9.255 26.267 -7.748 1.00 1.00 N ATOM 152 CA VAL A 10 10.662 26.042 -7.989 1.00 1.00 C ATOM 153 C VAL A 10 11.522 26.583 -6.849 1.00 1.00 C ATOM 154 O VAL A 10 11.642 27.798 -6.664 1.00 1.00 O ATOM 155 CB VAL A 10 11.079 26.706 -9.303 1.00 1.00 C ATOM 156 CG1 VAL A 10 12.502 26.341 -9.666 1.00 1.00 C ATOM 157 CG2 VAL A 10 10.117 26.323 -10.414 1.00 1.00 C ATOM 0 H VAL A 10 8.974 27.247 -7.786 1.00 1.00 H new ATOM 0 HA VAL A 10 10.819 24.965 -8.051 1.00 1.00 H new ATOM 0 HB VAL A 10 11.039 27.787 -9.172 1.00 1.00 H new ATOM 0 HG11 VAL A 10 12.774 26.826 -10.604 1.00 1.00 H new ATOM 0 HG12 VAL A 10 13.176 26.674 -8.877 1.00 1.00 H new ATOM 0 HG13 VAL A 10 12.583 25.260 -9.780 1.00 1.00 H new ATOM 0 HG21 VAL A 10 10.425 26.802 -11.343 1.00 1.00 H new ATOM 0 HG22 VAL A 10 10.124 25.241 -10.544 1.00 1.00 H new ATOM 0 HG23 VAL A 10 9.111 26.651 -10.153 1.00 1.00 H new ATOM 167 N CYS A 11 12.143 25.678 -6.113 1.00 1.00 N ATOM 168 CA CYS A 11 13.008 26.051 -5.005 1.00 1.00 C ATOM 169 C CYS A 11 14.227 25.139 -4.955 1.00 1.00 C ATOM 170 O CYS A 11 14.197 24.018 -5.459 1.00 1.00 O ATOM 171 CB CYS A 11 12.241 25.974 -3.682 1.00 1.00 C ATOM 172 SG CYS A 11 13.245 26.305 -2.213 1.00 1.00 S ATOM 0 H CYS A 11 12.064 24.672 -6.264 1.00 1.00 H new ATOM 0 HA CYS A 11 13.343 27.077 -5.158 1.00 1.00 H new ATOM 0 HB2 CYS A 11 11.417 26.687 -3.712 1.00 1.00 H new ATOM 0 HB3 CYS A 11 11.800 24.981 -3.589 1.00 1.00 H new ATOM 0 HG CYS A 11 12.766 25.643 -1.202 1.00 1.00 H new ATOM 178 N THR A 12 15.300 25.629 -4.358 1.00 1.00 N ATOM 179 CA THR A 12 16.519 24.860 -4.227 1.00 1.00 C ATOM 180 C THR A 12 16.328 23.705 -3.247 1.00 1.00 C ATOM 181 O THR A 12 16.407 23.882 -2.036 1.00 1.00 O ATOM 182 CB THR A 12 17.676 25.759 -3.772 1.00 1.00 C ATOM 183 OG1 THR A 12 17.169 26.807 -2.935 1.00 1.00 O ATOM 184 CG2 THR A 12 18.390 26.356 -4.971 1.00 1.00 C ATOM 0 H THR A 12 15.348 26.564 -3.954 1.00 1.00 H new ATOM 0 HA THR A 12 16.765 24.444 -5.204 1.00 1.00 H new ATOM 0 HB THR A 12 18.389 25.157 -3.209 1.00 1.00 H new ATOM 0 HG1 THR A 12 17.909 27.380 -2.643 1.00 1.00 H new ATOM 0 HG21 THR A 12 19.207 26.991 -4.629 1.00 1.00 H new ATOM 0 HG22 THR A 12 18.789 25.555 -5.593 1.00 1.00 H new ATOM 0 HG23 THR A 12 17.687 26.952 -5.553 1.00 1.00 H new ATOM 192 N GLY A 13 15.959 22.546 -3.777 1.00 1.00 N ATOM 193 CA GLY A 13 15.748 21.382 -2.941 1.00 1.00 C ATOM 194 C GLY A 13 14.449 20.682 -3.268 1.00 1.00 C ATOM 195 O GLY A 13 14.402 19.457 -3.327 1.00 1.00 O ATOM 0 H GLY A 13 15.802 22.392 -4.773 1.00 1.00 H new ATOM 0 HA2 GLY A 13 16.578 20.687 -3.070 1.00 1.00 H new ATOM 0 HA3 GLY A 13 15.745 21.683 -1.893 1.00 1.00 H new ATOM 199 N ASN A 14 13.405 21.479 -3.487 1.00 1.00 N ATOM 200 CA ASN A 14 12.068 20.973 -3.833 1.00 1.00 C ATOM 201 C ASN A 14 11.483 20.101 -2.715 1.00 1.00 C ATOM 202 O ASN A 14 10.496 19.389 -2.905 1.00 1.00 O ATOM 203 CB ASN A 14 12.120 20.171 -5.143 1.00 1.00 C ATOM 204 CG ASN A 14 10.739 19.802 -5.652 1.00 1.00 C ATOM 205 OD1 ASN A 14 10.538 18.740 -6.231 1.00 1.00 O ATOM 206 ND2 ASN A 14 9.782 20.688 -5.459 1.00 1.00 N ATOM 0 H ASN A 14 13.457 22.496 -3.431 1.00 1.00 H new ATOM 0 HA ASN A 14 11.417 21.838 -3.963 1.00 1.00 H new ATOM 0 HB2 ASN A 14 12.640 20.755 -5.903 1.00 1.00 H new ATOM 0 HB3 ASN A 14 12.701 19.262 -4.986 1.00 1.00 H new ATOM 0 HD21 ASN A 14 8.838 20.500 -5.796 1.00 1.00 H new ATOM 0 HD22 ASN A 14 9.986 21.561 -4.973 1.00 1.00 H new ATOM 213 N ILE A 15 12.020 20.229 -1.520 1.00 1.00 N ATOM 214 CA ILE A 15 11.584 19.387 -0.425 1.00 1.00 C ATOM 215 C ILE A 15 11.184 20.197 0.797 1.00 1.00 C ATOM 216 O ILE A 15 10.915 19.638 1.851 1.00 1.00 O ATOM 217 CB ILE A 15 12.683 18.381 -0.037 1.00 1.00 C ATOM 218 CG1 ILE A 15 14.003 19.108 0.233 1.00 1.00 C ATOM 219 CG2 ILE A 15 12.859 17.348 -1.139 1.00 1.00 C ATOM 220 CD1 ILE A 15 14.933 18.352 1.152 1.00 1.00 C ATOM 0 H ILE A 15 12.751 20.900 -1.283 1.00 1.00 H new ATOM 0 HA ILE A 15 10.704 18.848 -0.776 1.00 1.00 H new ATOM 0 HB ILE A 15 12.382 17.869 0.877 1.00 1.00 H new ATOM 0 HG12 ILE A 15 14.510 19.288 -0.715 1.00 1.00 H new ATOM 0 HG13 ILE A 15 13.788 20.083 0.669 1.00 1.00 H new ATOM 0 HG21 ILE A 15 13.639 16.641 -0.854 1.00 1.00 H new ATOM 0 HG22 ILE A 15 11.921 16.813 -1.289 1.00 1.00 H new ATOM 0 HG23 ILE A 15 13.143 17.848 -2.065 1.00 1.00 H new ATOM 0 HD11 ILE A 15 15.847 18.927 1.298 1.00 1.00 H new ATOM 0 HD12 ILE A 15 14.446 18.195 2.114 1.00 1.00 H new ATOM 0 HD13 ILE A 15 15.178 17.387 0.708 1.00 1.00 H new ATOM 232 N CYS A 16 11.049 21.505 0.640 1.00 1.00 N ATOM 233 CA CYS A 16 10.678 22.341 1.770 1.00 1.00 C ATOM 234 C CYS A 16 9.457 23.208 1.460 1.00 1.00 C ATOM 235 O CYS A 16 8.330 22.734 1.546 1.00 1.00 O ATOM 236 CB CYS A 16 11.857 23.209 2.207 1.00 1.00 C ATOM 237 SG CYS A 16 13.320 22.266 2.696 1.00 1.00 S ATOM 0 H CYS A 16 11.187 22.002 -0.240 1.00 1.00 H new ATOM 0 HA CYS A 16 10.408 21.678 2.592 1.00 1.00 H new ATOM 0 HB2 CYS A 16 12.125 23.879 1.390 1.00 1.00 H new ATOM 0 HB3 CYS A 16 11.544 23.835 3.043 1.00 1.00 H new ATOM 0 HG CYS A 16 14.266 23.085 3.048 1.00 1.00 H new ATOM 243 N ARG A 17 9.682 24.410 0.935 1.00 1.00 N ATOM 244 CA ARG A 17 8.584 25.348 0.688 1.00 1.00 C ATOM 245 C ARG A 17 7.736 24.957 -0.522 1.00 1.00 C ATOM 246 O ARG A 17 6.532 25.211 -0.544 1.00 1.00 O ATOM 247 CB ARG A 17 9.114 26.784 0.559 1.00 1.00 C ATOM 248 CG ARG A 17 10.534 26.882 0.020 1.00 1.00 C ATOM 249 CD ARG A 17 11.127 28.264 0.274 1.00 1.00 C ATOM 250 NE ARG A 17 12.548 28.321 -0.064 1.00 1.00 N ATOM 251 CZ ARG A 17 13.509 28.682 0.792 1.00 1.00 C ATOM 252 NH1 ARG A 17 13.204 29.082 2.018 1.00 1.00 N ATOM 253 NH2 ARG A 17 14.781 28.659 0.417 1.00 1.00 N ATOM 0 H ARG A 17 10.605 24.758 0.674 1.00 1.00 H new ATOM 0 HA ARG A 17 7.923 25.301 1.554 1.00 1.00 H new ATOM 0 HB2 ARG A 17 8.449 27.346 -0.097 1.00 1.00 H new ATOM 0 HB3 ARG A 17 9.076 27.262 1.538 1.00 1.00 H new ATOM 0 HG2 ARG A 17 11.158 26.123 0.492 1.00 1.00 H new ATOM 0 HG3 ARG A 17 10.535 26.674 -1.050 1.00 1.00 H new ATOM 0 HD2 ARG A 17 10.585 29.005 -0.314 1.00 1.00 H new ATOM 0 HD3 ARG A 17 10.993 28.529 1.323 1.00 1.00 H new ATOM 0 HE ARG A 17 12.824 28.069 -1.013 1.00 1.00 H new ATOM 0 HH11 ARG A 17 12.229 29.116 2.315 1.00 1.00 H new ATOM 0 HH12 ARG A 17 13.944 29.356 2.664 1.00 1.00 H new ATOM 0 HH21 ARG A 17 15.029 28.365 -0.528 1.00 1.00 H new ATOM 0 HH22 ARG A 17 15.511 28.935 1.073 1.00 1.00 H new ATOM 267 N SER A 18 8.349 24.305 -1.503 1.00 1.00 N ATOM 268 CA SER A 18 7.615 23.858 -2.684 1.00 1.00 C ATOM 269 C SER A 18 6.525 22.840 -2.299 1.00 1.00 C ATOM 270 O SER A 18 5.340 23.102 -2.499 1.00 1.00 O ATOM 271 CB SER A 18 8.573 23.267 -3.722 1.00 1.00 C ATOM 272 OG SER A 18 9.629 24.163 -4.017 1.00 1.00 O ATOM 0 H SER A 18 9.343 24.075 -1.506 1.00 1.00 H new ATOM 0 HA SER A 18 7.124 24.723 -3.129 1.00 1.00 H new ATOM 0 HB2 SER A 18 8.983 22.329 -3.349 1.00 1.00 H new ATOM 0 HB3 SER A 18 8.025 23.034 -4.635 1.00 1.00 H new ATOM 0 HG SER A 18 10.225 23.758 -4.681 1.00 1.00 H new ATOM 278 N PRO A 19 6.894 21.695 -1.672 1.00 1.00 N ATOM 279 CA PRO A 19 5.920 20.681 -1.261 1.00 1.00 C ATOM 280 C PRO A 19 4.942 21.217 -0.230 1.00 1.00 C ATOM 281 O PRO A 19 3.802 20.788 -0.192 1.00 1.00 O ATOM 282 CB PRO A 19 6.782 19.562 -0.667 1.00 1.00 C ATOM 283 CG PRO A 19 8.051 20.225 -0.286 1.00 1.00 C ATOM 284 CD PRO A 19 8.266 21.296 -1.308 1.00 1.00 C ATOM 0 HA PRO A 19 5.301 20.347 -2.094 1.00 1.00 H new ATOM 0 HB2 PRO A 19 6.299 19.106 0.197 1.00 1.00 H new ATOM 0 HB3 PRO A 19 6.953 18.767 -1.393 1.00 1.00 H new ATOM 0 HG2 PRO A 19 7.987 20.647 0.717 1.00 1.00 H new ATOM 0 HG3 PRO A 19 8.878 19.515 -0.281 1.00 1.00 H new ATOM 0 HD2 PRO A 19 8.834 22.133 -0.901 1.00 1.00 H new ATOM 0 HD3 PRO A 19 8.819 20.924 -2.170 1.00 1.00 H new ATOM 292 N MET A 20 5.353 22.225 0.527 1.00 1.00 N ATOM 293 CA MET A 20 4.478 22.805 1.540 1.00 1.00 C ATOM 294 C MET A 20 3.231 23.400 0.901 1.00 1.00 C ATOM 295 O MET A 20 2.116 22.994 1.217 1.00 1.00 O ATOM 296 CB MET A 20 5.199 23.876 2.347 1.00 1.00 C ATOM 297 CG MET A 20 6.182 23.324 3.365 1.00 1.00 C ATOM 298 SD MET A 20 6.775 24.579 4.506 1.00 1.00 S ATOM 299 CE MET A 20 5.258 24.983 5.363 1.00 1.00 C ATOM 0 H MET A 20 6.276 22.655 0.462 1.00 1.00 H new ATOM 0 HA MET A 20 4.185 22.001 2.214 1.00 1.00 H new ATOM 0 HB2 MET A 20 5.732 24.535 1.662 1.00 1.00 H new ATOM 0 HB3 MET A 20 4.459 24.486 2.865 1.00 1.00 H new ATOM 0 HG2 MET A 20 5.704 22.523 3.929 1.00 1.00 H new ATOM 0 HG3 MET A 20 7.031 22.883 2.842 1.00 1.00 H new ATOM 0 HE1 MET A 20 5.490 25.540 6.271 1.00 1.00 H new ATOM 0 HE2 MET A 20 4.625 25.591 4.716 1.00 1.00 H new ATOM 0 HE3 MET A 20 4.733 24.065 5.625 1.00 1.00 H new ATOM 309 N ALA A 21 3.428 24.263 -0.086 1.00 1.00 N ATOM 310 CA ALA A 21 2.299 24.891 -0.757 1.00 1.00 C ATOM 311 C ALA A 21 1.617 23.895 -1.671 1.00 1.00 C ATOM 312 O ALA A 21 0.409 23.971 -1.899 1.00 1.00 O ATOM 313 CB ALA A 21 2.725 26.116 -1.543 1.00 1.00 C ATOM 0 H ALA A 21 4.345 24.541 -0.436 1.00 1.00 H new ATOM 0 HA ALA A 21 1.596 25.217 0.010 1.00 1.00 H new ATOM 0 HB1 ALA A 21 1.855 26.557 -2.030 1.00 1.00 H new ATOM 0 HB2 ALA A 21 3.171 26.845 -0.867 1.00 1.00 H new ATOM 0 HB3 ALA A 21 3.456 25.828 -2.299 1.00 1.00 H new ATOM 319 N GLU A 22 2.399 22.927 -2.135 1.00 1.00 N ATOM 320 CA GLU A 22 1.898 21.883 -3.010 1.00 1.00 C ATOM 321 C GLU A 22 0.722 21.181 -2.336 1.00 1.00 C ATOM 322 O GLU A 22 -0.390 21.232 -2.823 1.00 1.00 O ATOM 323 CB GLU A 22 3.020 20.875 -3.325 1.00 1.00 C ATOM 324 CG GLU A 22 2.898 20.204 -4.686 1.00 1.00 C ATOM 325 CD GLU A 22 3.813 19.003 -4.824 1.00 1.00 C ATOM 326 OE1 GLU A 22 3.458 17.911 -4.345 1.00 1.00 O ATOM 327 OE2 GLU A 22 4.890 19.146 -5.431 1.00 1.00 O ATOM 0 H GLU A 22 3.392 22.847 -1.915 1.00 1.00 H new ATOM 0 HA GLU A 22 1.560 22.324 -3.948 1.00 1.00 H new ATOM 0 HB2 GLU A 22 3.980 21.389 -3.272 1.00 1.00 H new ATOM 0 HB3 GLU A 22 3.028 20.105 -2.553 1.00 1.00 H new ATOM 0 HG2 GLU A 22 1.866 19.890 -4.842 1.00 1.00 H new ATOM 0 HG3 GLU A 22 3.133 20.927 -5.467 1.00 1.00 H new ATOM 334 N LYS A 23 0.920 20.783 -1.093 1.00 1.00 N ATOM 335 CA LYS A 23 -0.108 20.050 -0.375 1.00 1.00 C ATOM 336 C LYS A 23 -1.147 21.014 0.173 1.00 1.00 C ATOM 337 O LYS A 23 -2.321 20.691 0.232 1.00 1.00 O ATOM 338 CB LYS A 23 0.479 19.236 0.786 1.00 1.00 C ATOM 339 CG LYS A 23 1.957 18.908 0.656 1.00 1.00 C ATOM 340 CD LYS A 23 2.210 17.499 0.156 1.00 1.00 C ATOM 341 CE LYS A 23 2.864 17.504 -1.209 1.00 1.00 C ATOM 342 NZ LYS A 23 1.875 17.724 -2.299 1.00 1.00 N ATOM 0 H LYS A 23 1.775 20.952 -0.563 1.00 1.00 H new ATOM 0 HA LYS A 23 -0.569 19.360 -1.081 1.00 1.00 H new ATOM 0 HB2 LYS A 23 0.325 19.789 1.712 1.00 1.00 H new ATOM 0 HB3 LYS A 23 -0.078 18.304 0.875 1.00 1.00 H new ATOM 0 HG2 LYS A 23 2.422 19.619 -0.027 1.00 1.00 H new ATOM 0 HG3 LYS A 23 2.438 19.035 1.626 1.00 1.00 H new ATOM 0 HD2 LYS A 23 2.847 16.969 0.864 1.00 1.00 H new ATOM 0 HD3 LYS A 23 1.267 16.954 0.107 1.00 1.00 H new ATOM 0 HE2 LYS A 23 3.623 18.285 -1.245 1.00 1.00 H new ATOM 0 HE3 LYS A 23 3.376 16.555 -1.370 1.00 1.00 H new ATOM 0 HZ1 LYS A 23 2.375 17.973 -3.176 1.00 1.00 H new ATOM 0 HZ2 LYS A 23 1.324 16.855 -2.449 1.00 1.00 H new ATOM 0 HZ3 LYS A 23 1.233 18.499 -2.035 1.00 1.00 H new ATOM 356 N MET A 24 -0.707 22.218 0.523 1.00 1.00 N ATOM 357 CA MET A 24 -1.580 23.204 1.140 1.00 1.00 C ATOM 358 C MET A 24 -2.743 23.608 0.246 1.00 1.00 C ATOM 359 O MET A 24 -3.877 23.154 0.434 1.00 1.00 O ATOM 360 CB MET A 24 -0.780 24.435 1.544 1.00 1.00 C ATOM 361 CG MET A 24 0.002 24.232 2.828 1.00 1.00 C ATOM 362 SD MET A 24 -0.642 25.215 4.196 1.00 1.00 S ATOM 363 CE MET A 24 0.010 26.829 3.775 1.00 1.00 C ATOM 0 H MET A 24 0.254 22.533 0.388 1.00 1.00 H new ATOM 0 HA MET A 24 -2.009 22.734 2.025 1.00 1.00 H new ATOM 0 HB2 MET A 24 -0.090 24.694 0.741 1.00 1.00 H new ATOM 0 HB3 MET A 24 -1.458 25.279 1.667 1.00 1.00 H new ATOM 0 HG2 MET A 24 -0.022 23.177 3.101 1.00 1.00 H new ATOM 0 HG3 MET A 24 1.046 24.493 2.658 1.00 1.00 H new ATOM 0 HE1 MET A 24 0.477 27.273 4.654 1.00 1.00 H new ATOM 0 HE2 MET A 24 0.752 26.726 2.983 1.00 1.00 H new ATOM 0 HE3 MET A 24 -0.801 27.471 3.431 1.00 1.00 H new ATOM 373 N PHE A 25 -2.474 24.432 -0.752 1.00 1.00 N ATOM 374 CA PHE A 25 -3.555 24.944 -1.570 1.00 1.00 C ATOM 375 C PHE A 25 -4.051 23.907 -2.559 1.00 1.00 C ATOM 376 O PHE A 25 -5.226 23.924 -2.922 1.00 1.00 O ATOM 377 CB PHE A 25 -3.160 26.241 -2.282 1.00 1.00 C ATOM 378 CG PHE A 25 -2.286 26.075 -3.481 1.00 1.00 C ATOM 379 CD1 PHE A 25 -2.826 25.822 -4.734 1.00 1.00 C ATOM 380 CD2 PHE A 25 -0.924 26.209 -3.357 1.00 1.00 C ATOM 381 CE1 PHE A 25 -2.007 25.697 -5.836 1.00 1.00 C ATOM 382 CE2 PHE A 25 -0.108 26.098 -4.451 1.00 1.00 C ATOM 383 CZ PHE A 25 -0.645 25.842 -5.691 1.00 1.00 C ATOM 0 H PHE A 25 -1.541 24.753 -1.010 1.00 1.00 H new ATOM 0 HA PHE A 25 -4.380 25.176 -0.896 1.00 1.00 H new ATOM 0 HB2 PHE A 25 -4.069 26.760 -2.586 1.00 1.00 H new ATOM 0 HB3 PHE A 25 -2.649 26.886 -1.568 1.00 1.00 H new ATOM 0 HD1 PHE A 25 -3.895 25.722 -4.847 1.00 1.00 H new ATOM 0 HD2 PHE A 25 -0.493 26.404 -2.386 1.00 1.00 H new ATOM 0 HE1 PHE A 25 -2.431 25.487 -6.807 1.00 1.00 H new ATOM 0 HE2 PHE A 25 0.960 26.212 -4.340 1.00 1.00 H new ATOM 0 HZ PHE A 25 0.002 25.755 -6.552 1.00 1.00 H new ATOM 393 N ALA A 26 -3.177 23.011 -3.013 1.00 1.00 N ATOM 394 CA ALA A 26 -3.629 21.995 -3.961 1.00 1.00 C ATOM 395 C ALA A 26 -4.668 21.080 -3.323 1.00 1.00 C ATOM 396 O ALA A 26 -5.626 20.663 -3.979 1.00 1.00 O ATOM 397 CB ALA A 26 -2.480 21.195 -4.520 1.00 1.00 C ATOM 0 H ALA A 26 -2.192 22.965 -2.754 1.00 1.00 H new ATOM 0 HA ALA A 26 -4.096 22.517 -4.796 1.00 1.00 H new ATOM 0 HB1 ALA A 26 -2.861 20.451 -5.220 1.00 1.00 H new ATOM 0 HB2 ALA A 26 -1.791 21.862 -5.038 1.00 1.00 H new ATOM 0 HB3 ALA A 26 -1.957 20.693 -3.706 1.00 1.00 H new ATOM 403 N GLN A 27 -4.473 20.763 -2.043 1.00 1.00 N ATOM 404 CA GLN A 27 -5.439 19.932 -1.336 1.00 1.00 C ATOM 405 C GLN A 27 -6.754 20.693 -1.218 1.00 1.00 C ATOM 406 O GLN A 27 -7.828 20.116 -1.357 1.00 1.00 O ATOM 407 CB GLN A 27 -4.932 19.469 0.034 1.00 1.00 C ATOM 408 CG GLN A 27 -5.253 20.402 1.190 1.00 1.00 C ATOM 409 CD GLN A 27 -5.788 19.660 2.396 1.00 1.00 C ATOM 410 OE1 GLN A 27 -6.550 20.208 3.189 1.00 1.00 O ATOM 411 NE2 GLN A 27 -5.409 18.403 2.521 1.00 1.00 N ATOM 0 H GLN A 27 -3.672 21.063 -1.487 1.00 1.00 H new ATOM 0 HA GLN A 27 -5.594 19.021 -1.913 1.00 1.00 H new ATOM 0 HB2 GLN A 27 -5.358 18.489 0.249 1.00 1.00 H new ATOM 0 HB3 GLN A 27 -3.851 19.342 -0.020 1.00 1.00 H new ATOM 0 HG2 GLN A 27 -4.354 20.949 1.473 1.00 1.00 H new ATOM 0 HG3 GLN A 27 -5.987 21.140 0.865 1.00 1.00 H new ATOM 0 HE21 GLN A 27 -4.774 17.991 1.837 1.00 1.00 H new ATOM 0 HE22 GLN A 27 -5.751 17.843 3.302 1.00 1.00 H new ATOM 420 N GLN A 28 -6.654 22.003 -0.996 1.00 1.00 N ATOM 421 CA GLN A 28 -7.825 22.865 -0.948 1.00 1.00 C ATOM 422 C GLN A 28 -8.589 22.787 -2.268 1.00 1.00 C ATOM 423 O GLN A 28 -9.817 22.705 -2.286 1.00 1.00 O ATOM 424 CB GLN A 28 -7.411 24.309 -0.678 1.00 1.00 C ATOM 425 CG GLN A 28 -6.719 24.513 0.657 1.00 1.00 C ATOM 426 CD GLN A 28 -6.281 25.949 0.843 1.00 1.00 C ATOM 427 OE1 GLN A 28 -6.860 26.865 0.257 1.00 1.00 O ATOM 428 NE2 GLN A 28 -5.270 26.160 1.666 1.00 1.00 N ATOM 0 H GLN A 28 -5.769 22.488 -0.847 1.00 1.00 H new ATOM 0 HA GLN A 28 -8.472 22.525 -0.139 1.00 1.00 H new ATOM 0 HB2 GLN A 28 -6.745 24.640 -1.475 1.00 1.00 H new ATOM 0 HB3 GLN A 28 -8.296 24.944 -0.717 1.00 1.00 H new ATOM 0 HG2 GLN A 28 -7.394 24.230 1.465 1.00 1.00 H new ATOM 0 HG3 GLN A 28 -5.852 23.856 0.722 1.00 1.00 H new ATOM 0 HE21 GLN A 28 -4.818 25.373 2.131 1.00 1.00 H new ATOM 0 HE22 GLN A 28 -4.941 27.110 1.836 1.00 1.00 H new ATOM 437 N LEU A 29 -7.841 22.789 -3.369 1.00 1.00 N ATOM 438 CA LEU A 29 -8.428 22.710 -4.701 1.00 1.00 C ATOM 439 C LEU A 29 -9.308 21.472 -4.826 1.00 1.00 C ATOM 440 O LEU A 29 -10.496 21.572 -5.110 1.00 1.00 O ATOM 441 CB LEU A 29 -7.340 22.677 -5.780 1.00 1.00 C ATOM 442 CG LEU A 29 -6.415 23.889 -5.810 1.00 1.00 C ATOM 443 CD1 LEU A 29 -5.302 23.684 -6.823 1.00 1.00 C ATOM 444 CD2 LEU A 29 -7.198 25.155 -6.125 1.00 1.00 C ATOM 0 H LEU A 29 -6.823 22.845 -3.363 1.00 1.00 H new ATOM 0 HA LEU A 29 -9.039 23.601 -4.847 1.00 1.00 H new ATOM 0 HB2 LEU A 29 -6.735 21.782 -5.635 1.00 1.00 H new ATOM 0 HB3 LEU A 29 -7.820 22.583 -6.754 1.00 1.00 H new ATOM 0 HG LEU A 29 -5.966 24.002 -4.823 1.00 1.00 H new ATOM 0 HD11 LEU A 29 -4.652 24.559 -6.831 1.00 1.00 H new ATOM 0 HD12 LEU A 29 -4.721 22.802 -6.552 1.00 1.00 H new ATOM 0 HD13 LEU A 29 -5.733 23.544 -7.814 1.00 1.00 H new ATOM 0 HD21 LEU A 29 -6.519 26.008 -6.142 1.00 1.00 H new ATOM 0 HD22 LEU A 29 -7.677 25.054 -7.099 1.00 1.00 H new ATOM 0 HD23 LEU A 29 -7.959 25.312 -5.361 1.00 1.00 H new ATOM 456 N ARG A 30 -8.714 20.303 -4.650 1.00 1.00 N ATOM 457 CA ARG A 30 -9.468 19.057 -4.732 1.00 1.00 C ATOM 458 C ARG A 30 -10.603 19.028 -3.702 1.00 1.00 C ATOM 459 O ARG A 30 -11.700 18.565 -4.003 1.00 1.00 O ATOM 460 CB ARG A 30 -8.541 17.843 -4.589 1.00 1.00 C ATOM 461 CG ARG A 30 -7.591 17.920 -3.407 1.00 1.00 C ATOM 462 CD ARG A 30 -6.174 17.551 -3.813 1.00 1.00 C ATOM 463 NE ARG A 30 -6.045 16.137 -4.162 1.00 1.00 N ATOM 464 CZ ARG A 30 -5.161 15.660 -5.043 1.00 1.00 C ATOM 465 NH1 ARG A 30 -4.352 16.488 -5.703 1.00 1.00 N ATOM 466 NH2 ARG A 30 -5.090 14.353 -5.270 1.00 1.00 N ATOM 0 H ARG A 30 -7.720 20.188 -4.451 1.00 1.00 H new ATOM 0 HA ARG A 30 -9.926 19.004 -5.720 1.00 1.00 H new ATOM 0 HB2 ARG A 30 -9.150 16.944 -4.493 1.00 1.00 H new ATOM 0 HB3 ARG A 30 -7.957 17.736 -5.503 1.00 1.00 H new ATOM 0 HG2 ARG A 30 -7.602 18.929 -2.994 1.00 1.00 H new ATOM 0 HG3 ARG A 30 -7.932 17.249 -2.619 1.00 1.00 H new ATOM 0 HD2 ARG A 30 -5.872 18.162 -4.664 1.00 1.00 H new ATOM 0 HD3 ARG A 30 -5.492 17.784 -2.995 1.00 1.00 H new ATOM 0 HE ARG A 30 -6.669 15.473 -3.704 1.00 1.00 H new ATOM 0 HH11 ARG A 30 -4.405 17.493 -5.537 1.00 1.00 H new ATOM 0 HH12 ARG A 30 -3.680 16.117 -6.374 1.00 1.00 H new ATOM 0 HH21 ARG A 30 -5.710 13.714 -4.772 1.00 1.00 H new ATOM 0 HH22 ARG A 30 -4.415 13.988 -5.942 1.00 1.00 H new ATOM 480 N HIS A 31 -10.345 19.571 -2.507 1.00 1.00 N ATOM 481 CA HIS A 31 -11.362 19.650 -1.447 1.00 1.00 C ATOM 482 C HIS A 31 -12.575 20.480 -1.869 1.00 1.00 C ATOM 483 O HIS A 31 -13.676 20.280 -1.358 1.00 1.00 O ATOM 484 CB HIS A 31 -10.766 20.229 -0.160 1.00 1.00 C ATOM 485 CG HIS A 31 -10.198 19.198 0.768 1.00 1.00 C ATOM 486 ND1 HIS A 31 -10.571 19.091 2.086 1.00 1.00 N ATOM 487 CD2 HIS A 31 -9.269 18.234 0.565 1.00 1.00 C ATOM 488 CE1 HIS A 31 -9.901 18.109 2.655 1.00 1.00 C ATOM 489 NE2 HIS A 31 -9.102 17.569 1.754 1.00 1.00 N ATOM 0 H HIS A 31 -9.440 19.963 -2.247 1.00 1.00 H new ATOM 0 HA HIS A 31 -11.700 18.630 -1.263 1.00 1.00 H new ATOM 0 HB2 HIS A 31 -9.981 20.938 -0.423 1.00 1.00 H new ATOM 0 HB3 HIS A 31 -11.539 20.789 0.366 1.00 1.00 H new ATOM 0 HD2 HIS A 31 -8.754 18.027 -0.362 1.00 1.00 H new ATOM 0 HE1 HIS A 31 -9.991 17.798 3.685 1.00 1.00 H new ATOM 0 HE2 HIS A 31 -8.466 16.788 1.915 1.00 1.00 H new ATOM 498 N ARG A 32 -12.376 21.398 -2.807 1.00 1.00 N ATOM 499 CA ARG A 32 -13.493 22.215 -3.263 1.00 1.00 C ATOM 500 C ARG A 32 -14.028 21.691 -4.586 1.00 1.00 C ATOM 501 O ARG A 32 -15.144 22.004 -4.996 1.00 1.00 O ATOM 502 CB ARG A 32 -13.113 23.687 -3.345 1.00 1.00 C ATOM 503 CG ARG A 32 -11.999 24.021 -4.312 1.00 1.00 C ATOM 504 CD ARG A 32 -11.141 25.163 -3.786 1.00 1.00 C ATOM 505 NE ARG A 32 -11.943 26.255 -3.231 1.00 1.00 N ATOM 506 CZ ARG A 32 -11.794 26.730 -1.992 1.00 1.00 C ATOM 507 NH1 ARG A 32 -10.899 26.191 -1.173 1.00 1.00 N ATOM 508 NH2 ARG A 32 -12.558 27.727 -1.568 1.00 1.00 N ATOM 0 H ARG A 32 -11.481 21.592 -3.255 1.00 1.00 H new ATOM 0 HA ARG A 32 -14.293 22.141 -2.527 1.00 1.00 H new ATOM 0 HB2 ARG A 32 -13.998 24.257 -3.627 1.00 1.00 H new ATOM 0 HB3 ARG A 32 -12.820 24.024 -2.351 1.00 1.00 H new ATOM 0 HG2 ARG A 32 -11.378 23.140 -4.474 1.00 1.00 H new ATOM 0 HG3 ARG A 32 -12.422 24.295 -5.278 1.00 1.00 H new ATOM 0 HD2 ARG A 32 -10.468 24.784 -3.017 1.00 1.00 H new ATOM 0 HD3 ARG A 32 -10.518 25.548 -4.594 1.00 1.00 H new ATOM 0 HE ARG A 32 -12.657 26.677 -3.825 1.00 1.00 H new ATOM 0 HH11 ARG A 32 -10.322 25.411 -1.490 1.00 1.00 H new ATOM 0 HH12 ARG A 32 -10.788 26.556 -0.227 1.00 1.00 H new ATOM 0 HH21 ARG A 32 -13.260 28.131 -2.188 1.00 1.00 H new ATOM 0 HH22 ARG A 32 -12.444 28.090 -0.622 1.00 1.00 H new ATOM 522 N GLY A 33 -13.203 20.906 -5.256 1.00 1.00 N ATOM 523 CA GLY A 33 -13.606 20.283 -6.500 1.00 1.00 C ATOM 524 C GLY A 33 -12.927 20.896 -7.699 1.00 1.00 C ATOM 525 O GLY A 33 -13.518 20.988 -8.772 1.00 1.00 O ATOM 0 H GLY A 33 -12.252 20.686 -4.959 1.00 1.00 H new ATOM 0 HA2 GLY A 33 -13.376 19.218 -6.461 1.00 1.00 H new ATOM 0 HA3 GLY A 33 -14.686 20.371 -6.614 1.00 1.00 H new ATOM 529 N LEU A 34 -11.669 21.288 -7.539 1.00 1.00 N ATOM 530 CA LEU A 34 -10.926 21.918 -8.619 1.00 1.00 C ATOM 531 C LEU A 34 -9.574 21.245 -8.800 1.00 1.00 C ATOM 532 O LEU A 34 -8.828 21.575 -9.714 1.00 1.00 O ATOM 533 CB LEU A 34 -10.719 23.394 -8.297 1.00 1.00 C ATOM 534 CG LEU A 34 -11.985 24.149 -7.899 1.00 1.00 C ATOM 535 CD1 LEU A 34 -11.628 25.504 -7.325 1.00 1.00 C ATOM 536 CD2 LEU A 34 -12.925 24.289 -9.085 1.00 1.00 C ATOM 0 H LEU A 34 -11.144 21.180 -6.671 1.00 1.00 H new ATOM 0 HA LEU A 34 -11.495 21.816 -9.543 1.00 1.00 H new ATOM 0 HB2 LEU A 34 -9.995 23.476 -7.487 1.00 1.00 H new ATOM 0 HB3 LEU A 34 -10.280 23.883 -9.167 1.00 1.00 H new ATOM 0 HG LEU A 34 -12.504 23.577 -7.130 1.00 1.00 H new ATOM 0 HD11 LEU A 34 -12.539 26.032 -7.045 1.00 1.00 H new ATOM 0 HD12 LEU A 34 -11.000 25.372 -6.444 1.00 1.00 H new ATOM 0 HD13 LEU A 34 -11.087 26.085 -8.072 1.00 1.00 H new ATOM 0 HD21 LEU A 34 -13.820 24.830 -8.778 1.00 1.00 H new ATOM 0 HD22 LEU A 34 -12.425 24.838 -9.883 1.00 1.00 H new ATOM 0 HD23 LEU A 34 -13.205 23.299 -9.446 1.00 1.00 H new ATOM 548 N GLY A 35 -9.275 20.284 -7.928 1.00 1.00 N ATOM 549 CA GLY A 35 -8.001 19.578 -7.992 1.00 1.00 C ATOM 550 C GLY A 35 -7.797 18.867 -9.318 1.00 1.00 C ATOM 551 O GLY A 35 -6.669 18.601 -9.728 1.00 1.00 O ATOM 0 H GLY A 35 -9.893 19.980 -7.176 1.00 1.00 H new ATOM 0 HA2 GLY A 35 -7.188 20.287 -7.835 1.00 1.00 H new ATOM 0 HA3 GLY A 35 -7.951 18.851 -7.182 1.00 1.00 H new ATOM 555 N ASP A 36 -8.903 18.527 -9.958 1.00 1.00 N ATOM 556 CA ASP A 36 -8.881 17.879 -11.259 1.00 1.00 C ATOM 557 C ASP A 36 -8.650 18.916 -12.349 1.00 1.00 C ATOM 558 O ASP A 36 -8.013 18.648 -13.367 1.00 1.00 O ATOM 559 CB ASP A 36 -10.220 17.179 -11.521 1.00 1.00 C ATOM 560 CG ASP A 36 -10.606 16.193 -10.433 1.00 1.00 C ATOM 561 OD1 ASP A 36 -11.202 16.621 -9.417 1.00 1.00 O ATOM 562 OD2 ASP A 36 -10.325 14.985 -10.590 1.00 1.00 O ATOM 0 H ASP A 36 -9.840 18.692 -9.591 1.00 1.00 H new ATOM 0 HA ASP A 36 -8.075 17.145 -11.268 1.00 1.00 H new ATOM 0 HB2 ASP A 36 -11.003 17.931 -11.614 1.00 1.00 H new ATOM 0 HB3 ASP A 36 -10.167 16.654 -12.475 1.00 1.00 H new ATOM 567 N ALA A 37 -9.157 20.113 -12.094 1.00 1.00 N ATOM 568 CA ALA A 37 -9.118 21.203 -13.059 1.00 1.00 C ATOM 569 C ALA A 37 -7.764 21.904 -13.103 1.00 1.00 C ATOM 570 O ALA A 37 -7.462 22.627 -14.051 1.00 1.00 O ATOM 571 CB ALA A 37 -10.217 22.203 -12.742 1.00 1.00 C ATOM 0 H ALA A 37 -9.607 20.357 -11.212 1.00 1.00 H new ATOM 0 HA ALA A 37 -9.279 20.770 -14.046 1.00 1.00 H new ATOM 0 HB1 ALA A 37 -10.187 23.018 -13.465 1.00 1.00 H new ATOM 0 HB2 ALA A 37 -11.186 21.707 -12.795 1.00 1.00 H new ATOM 0 HB3 ALA A 37 -10.068 22.602 -11.739 1.00 1.00 H new ATOM 577 N VAL A 38 -6.960 21.726 -12.070 1.00 1.00 N ATOM 578 CA VAL A 38 -5.657 22.376 -12.012 1.00 1.00 C ATOM 579 C VAL A 38 -4.634 21.480 -11.328 1.00 1.00 C ATOM 580 O VAL A 38 -4.882 20.939 -10.252 1.00 1.00 O ATOM 581 CB VAL A 38 -5.741 23.747 -11.296 1.00 1.00 C ATOM 582 CG1 VAL A 38 -6.701 23.678 -10.122 1.00 1.00 C ATOM 583 CG2 VAL A 38 -4.365 24.210 -10.830 1.00 1.00 C ATOM 0 H VAL A 38 -7.181 21.142 -11.264 1.00 1.00 H new ATOM 0 HA VAL A 38 -5.332 22.552 -13.037 1.00 1.00 H new ATOM 0 HB VAL A 38 -6.118 24.476 -12.013 1.00 1.00 H new ATOM 0 HG11 VAL A 38 -6.747 24.650 -9.632 1.00 1.00 H new ATOM 0 HG12 VAL A 38 -7.694 23.405 -10.479 1.00 1.00 H new ATOM 0 HG13 VAL A 38 -6.353 22.929 -9.411 1.00 1.00 H new ATOM 0 HG21 VAL A 38 -4.455 25.175 -10.331 1.00 1.00 H new ATOM 0 HG22 VAL A 38 -3.951 23.479 -10.135 1.00 1.00 H new ATOM 0 HG23 VAL A 38 -3.703 24.307 -11.691 1.00 1.00 H new ATOM 593 N ARG A 39 -3.500 21.297 -11.988 1.00 1.00 N ATOM 594 CA ARG A 39 -2.453 20.440 -11.482 1.00 1.00 C ATOM 595 C ARG A 39 -1.448 21.251 -10.704 1.00 1.00 C ATOM 596 O ARG A 39 -1.047 22.337 -11.124 1.00 1.00 O ATOM 597 CB ARG A 39 -1.773 19.707 -12.634 1.00 1.00 C ATOM 598 CG ARG A 39 -2.766 19.011 -13.533 1.00 1.00 C ATOM 599 CD ARG A 39 -3.603 18.025 -12.751 1.00 1.00 C ATOM 600 NE ARG A 39 -2.998 16.695 -12.708 1.00 1.00 N ATOM 601 CZ ARG A 39 -3.675 15.575 -12.463 1.00 1.00 C ATOM 602 NH1 ARG A 39 -4.976 15.623 -12.203 1.00 1.00 N ATOM 603 NH2 ARG A 39 -3.048 14.403 -12.467 1.00 1.00 N ATOM 0 H ARG A 39 -3.286 21.738 -12.883 1.00 1.00 H new ATOM 0 HA ARG A 39 -2.893 19.701 -10.813 1.00 1.00 H new ATOM 0 HB2 ARG A 39 -1.190 20.417 -13.221 1.00 1.00 H new ATOM 0 HB3 ARG A 39 -1.073 18.974 -12.233 1.00 1.00 H new ATOM 0 HG2 ARG A 39 -3.414 19.749 -14.006 1.00 1.00 H new ATOM 0 HG3 ARG A 39 -2.237 18.492 -14.332 1.00 1.00 H new ATOM 0 HD2 ARG A 39 -3.738 18.393 -11.734 1.00 1.00 H new ATOM 0 HD3 ARG A 39 -4.594 17.957 -13.200 1.00 1.00 H new ATOM 0 HE ARG A 39 -1.995 16.620 -12.876 1.00 1.00 H new ATOM 0 HH11 ARG A 39 -5.461 16.520 -12.190 1.00 1.00 H new ATOM 0 HH12 ARG A 39 -5.491 14.763 -12.016 1.00 1.00 H new ATOM 0 HH21 ARG A 39 -2.047 14.361 -12.658 1.00 1.00 H new ATOM 0 HH22 ARG A 39 -3.568 13.546 -12.279 1.00 1.00 H new ATOM 617 N VAL A 40 -0.978 20.689 -9.616 1.00 1.00 N ATOM 618 CA VAL A 40 -0.034 21.377 -8.765 1.00 1.00 C ATOM 619 C VAL A 40 1.176 20.490 -8.523 1.00 1.00 C ATOM 620 O VAL A 40 1.063 19.355 -8.057 1.00 1.00 O ATOM 621 CB VAL A 40 -0.690 21.819 -7.436 1.00 1.00 C ATOM 622 CG1 VAL A 40 0.339 22.370 -6.474 1.00 1.00 C ATOM 623 CG2 VAL A 40 -1.762 22.862 -7.701 1.00 1.00 C ATOM 0 H VAL A 40 -1.234 19.754 -9.298 1.00 1.00 H new ATOM 0 HA VAL A 40 0.296 22.285 -9.269 1.00 1.00 H new ATOM 0 HB VAL A 40 -1.147 20.941 -6.980 1.00 1.00 H new ATOM 0 HG11 VAL A 40 -0.153 22.672 -5.549 1.00 1.00 H new ATOM 0 HG12 VAL A 40 1.081 21.602 -6.256 1.00 1.00 H new ATOM 0 HG13 VAL A 40 0.831 23.233 -6.922 1.00 1.00 H new ATOM 0 HG21 VAL A 40 -2.216 23.165 -6.758 1.00 1.00 H new ATOM 0 HG22 VAL A 40 -1.313 23.731 -8.183 1.00 1.00 H new ATOM 0 HG23 VAL A 40 -2.527 22.440 -8.353 1.00 1.00 H new ATOM 633 N THR A 41 2.315 21.008 -8.936 1.00 1.00 N ATOM 634 CA THR A 41 3.572 20.292 -8.895 1.00 1.00 C ATOM 635 C THR A 41 4.669 21.202 -8.374 1.00 1.00 C ATOM 636 O THR A 41 4.415 22.362 -8.036 1.00 1.00 O ATOM 637 CB THR A 41 3.957 19.817 -10.313 1.00 1.00 C ATOM 638 OG1 THR A 41 4.071 20.957 -11.178 1.00 1.00 O ATOM 639 CG2 THR A 41 2.912 18.871 -10.883 1.00 1.00 C ATOM 0 H THR A 41 2.394 21.952 -9.315 1.00 1.00 H new ATOM 0 HA THR A 41 3.459 19.432 -8.235 1.00 1.00 H new ATOM 0 HB THR A 41 4.907 19.286 -10.247 1.00 1.00 H new ATOM 0 HG1 THR A 41 3.797 20.708 -12.085 1.00 1.00 H new ATOM 0 HG21 THR A 41 3.213 18.555 -11.882 1.00 1.00 H new ATOM 0 HG22 THR A 41 2.822 17.997 -10.238 1.00 1.00 H new ATOM 0 HG23 THR A 41 1.951 19.382 -10.938 1.00 1.00 H new ATOM 647 N SER A 42 5.894 20.714 -8.388 1.00 1.00 N ATOM 648 CA SER A 42 7.012 21.505 -7.934 1.00 1.00 C ATOM 649 C SER A 42 8.324 20.911 -8.434 1.00 1.00 C ATOM 650 O SER A 42 8.337 19.809 -8.996 1.00 1.00 O ATOM 651 CB SER A 42 6.992 21.602 -6.407 1.00 1.00 C ATOM 652 OG SER A 42 7.102 20.325 -5.809 1.00 1.00 O ATOM 0 H SER A 42 6.136 19.776 -8.708 1.00 1.00 H new ATOM 0 HA SER A 42 6.928 22.512 -8.343 1.00 1.00 H new ATOM 0 HB2 SER A 42 7.813 22.235 -6.070 1.00 1.00 H new ATOM 0 HB3 SER A 42 6.067 22.079 -6.083 1.00 1.00 H new ATOM 0 HG SER A 42 6.214 20.014 -5.536 1.00 1.00 H new ATOM 658 N ALA A 43 9.404 21.679 -8.310 1.00 1.00 N ATOM 659 CA ALA A 43 10.714 21.232 -8.756 1.00 1.00 C ATOM 660 C ALA A 43 11.832 22.068 -8.148 1.00 1.00 C ATOM 661 O ALA A 43 11.598 23.113 -7.539 1.00 1.00 O ATOM 662 CB ALA A 43 10.805 21.293 -10.270 1.00 1.00 C ATOM 0 H ALA A 43 9.394 22.614 -7.903 1.00 1.00 H new ATOM 0 HA ALA A 43 10.836 20.202 -8.421 1.00 1.00 H new ATOM 0 HB1 ALA A 43 11.791 20.956 -10.589 1.00 1.00 H new ATOM 0 HB2 ALA A 43 10.042 20.649 -10.707 1.00 1.00 H new ATOM 0 HB3 ALA A 43 10.647 22.319 -10.603 1.00 1.00 H new ATOM 668 N GLY A 44 13.042 21.557 -8.284 1.00 1.00 N ATOM 669 CA GLY A 44 14.212 22.243 -7.791 1.00 1.00 C ATOM 670 C GLY A 44 15.233 22.440 -8.886 1.00 1.00 C ATOM 671 O GLY A 44 15.554 21.501 -9.611 1.00 1.00 O ATOM 0 H GLY A 44 13.236 20.663 -8.735 1.00 1.00 H new ATOM 0 HA2 GLY A 44 13.923 23.211 -7.381 1.00 1.00 H new ATOM 0 HA3 GLY A 44 14.655 21.671 -6.976 1.00 1.00 H new ATOM 675 N THR A 45 15.738 23.661 -9.014 1.00 1.00 N ATOM 676 CA THR A 45 16.703 23.991 -10.056 1.00 1.00 C ATOM 677 C THR A 45 18.057 23.328 -9.784 1.00 1.00 C ATOM 678 O THR A 45 18.803 23.010 -10.708 1.00 1.00 O ATOM 679 CB THR A 45 16.901 25.518 -10.152 1.00 1.00 C ATOM 680 OG1 THR A 45 17.252 26.052 -8.864 1.00 1.00 O ATOM 681 CG2 THR A 45 15.638 26.201 -10.660 1.00 1.00 C ATOM 0 H THR A 45 15.494 24.443 -8.406 1.00 1.00 H new ATOM 0 HA THR A 45 16.305 23.615 -10.999 1.00 1.00 H new ATOM 0 HB THR A 45 17.708 25.710 -10.859 1.00 1.00 H new ATOM 0 HG1 THR A 45 17.680 26.926 -8.978 1.00 1.00 H new ATOM 0 HG21 THR A 45 15.804 27.277 -10.718 1.00 1.00 H new ATOM 0 HG22 THR A 45 15.390 25.818 -11.650 1.00 1.00 H new ATOM 0 HG23 THR A 45 14.814 25.998 -9.976 1.00 1.00 H new ATOM 689 N GLY A 46 18.341 23.084 -8.505 1.00 1.00 N ATOM 690 CA GLY A 46 19.625 22.521 -8.115 1.00 1.00 C ATOM 691 C GLY A 46 19.555 21.042 -7.797 1.00 1.00 C ATOM 692 O GLY A 46 20.514 20.476 -7.277 1.00 1.00 O ATOM 0 H GLY A 46 17.703 23.267 -7.730 1.00 1.00 H new ATOM 0 HA2 GLY A 46 20.344 22.680 -8.919 1.00 1.00 H new ATOM 0 HA3 GLY A 46 20.000 23.056 -7.243 1.00 1.00 H new ATOM 696 N ASN A 47 18.380 20.450 -8.035 1.00 1.00 N ATOM 697 CA ASN A 47 18.131 19.006 -7.851 1.00 1.00 C ATOM 698 C ASN A 47 18.706 18.426 -6.546 1.00 1.00 C ATOM 699 O ASN A 47 19.047 17.247 -6.499 1.00 1.00 O ATOM 700 CB ASN A 47 18.654 18.204 -9.060 1.00 1.00 C ATOM 701 CG ASN A 47 20.164 18.266 -9.261 1.00 1.00 C ATOM 702 OD1 ASN A 47 20.672 19.122 -9.988 1.00 1.00 O ATOM 703 ND2 ASN A 47 20.891 17.359 -8.626 1.00 1.00 N ATOM 0 H ASN A 47 17.562 20.961 -8.365 1.00 1.00 H new ATOM 0 HA ASN A 47 17.048 18.906 -7.776 1.00 1.00 H new ATOM 0 HB2 ASN A 47 18.359 17.161 -8.942 1.00 1.00 H new ATOM 0 HB3 ASN A 47 18.166 18.573 -9.962 1.00 1.00 H new ATOM 0 HD21 ASN A 47 21.906 17.354 -8.731 1.00 1.00 H new ATOM 0 HD22 ASN A 47 20.436 16.665 -8.032 1.00 1.00 H new ATOM 710 N TRP A 48 18.700 19.221 -5.472 1.00 1.00 N ATOM 711 CA TRP A 48 19.223 18.791 -4.164 1.00 1.00 C ATOM 712 C TRP A 48 18.725 17.406 -3.763 1.00 1.00 C ATOM 713 O TRP A 48 19.479 16.438 -3.720 1.00 1.00 O ATOM 714 CB TRP A 48 18.812 19.799 -3.086 1.00 1.00 C ATOM 715 CG TRP A 48 19.923 20.693 -2.631 1.00 1.00 C ATOM 716 CD1 TRP A 48 20.676 20.539 -1.508 1.00 1.00 C ATOM 717 CD2 TRP A 48 20.398 21.882 -3.276 1.00 1.00 C ATOM 718 NE1 TRP A 48 21.602 21.550 -1.418 1.00 1.00 N ATOM 719 CE2 TRP A 48 21.453 22.389 -2.492 1.00 1.00 C ATOM 720 CE3 TRP A 48 20.040 22.563 -4.444 1.00 1.00 C ATOM 721 CZ2 TRP A 48 22.148 23.547 -2.836 1.00 1.00 C ATOM 722 CZ3 TRP A 48 20.731 23.709 -4.784 1.00 1.00 C ATOM 723 CH2 TRP A 48 21.777 24.190 -3.986 1.00 1.00 C ATOM 0 H TRP A 48 18.336 20.174 -5.480 1.00 1.00 H new ATOM 0 HA TRP A 48 20.308 18.743 -4.254 1.00 1.00 H new ATOM 0 HB2 TRP A 48 17.999 20.415 -3.470 1.00 1.00 H new ATOM 0 HB3 TRP A 48 18.421 19.256 -2.226 1.00 1.00 H new ATOM 0 HD1 TRP A 48 20.562 19.739 -0.792 1.00 1.00 H new ATOM 0 HE1 TRP A 48 22.289 21.659 -0.672 1.00 1.00 H new ATOM 0 HE3 TRP A 48 19.238 22.199 -5.069 1.00 1.00 H new ATOM 0 HZ2 TRP A 48 22.950 23.923 -2.218 1.00 1.00 H new ATOM 0 HZ3 TRP A 48 20.460 24.245 -5.682 1.00 1.00 H new ATOM 0 HH2 TRP A 48 22.301 25.086 -4.284 1.00 1.00 H new ATOM 734 N HIS A 49 17.464 17.351 -3.407 1.00 1.00 N ATOM 735 CA HIS A 49 16.849 16.100 -3.001 1.00 1.00 C ATOM 736 C HIS A 49 15.893 15.593 -4.065 1.00 1.00 C ATOM 737 O HIS A 49 14.811 15.109 -3.752 1.00 1.00 O ATOM 738 CB HIS A 49 16.134 16.246 -1.656 1.00 1.00 C ATOM 739 CG HIS A 49 17.058 16.212 -0.478 1.00 1.00 C ATOM 740 ND1 HIS A 49 17.031 15.207 0.467 1.00 1.00 N ATOM 741 CD2 HIS A 49 18.032 17.067 -0.088 1.00 1.00 C ATOM 742 CE1 HIS A 49 17.947 15.447 1.385 1.00 1.00 C ATOM 743 NE2 HIS A 49 18.566 16.567 1.072 1.00 1.00 N ATOM 0 H HIS A 49 16.839 18.157 -3.389 1.00 1.00 H new ATOM 0 HA HIS A 49 17.644 15.364 -2.881 1.00 1.00 H new ATOM 0 HB2 HIS A 49 15.583 17.186 -1.647 1.00 1.00 H new ATOM 0 HB3 HIS A 49 15.401 15.446 -1.555 1.00 1.00 H new ATOM 0 HD2 HIS A 49 18.332 17.972 -0.595 1.00 1.00 H new ATOM 0 HE1 HIS A 49 18.154 14.830 2.247 1.00 1.00 H new ATOM 0 HE2 HIS A 49 19.322 16.994 1.607 1.00 1.00 H new ATOM 752 N VAL A 50 16.308 15.684 -5.323 1.00 1.00 N ATOM 753 CA VAL A 50 15.488 15.197 -6.425 1.00 1.00 C ATOM 754 C VAL A 50 15.277 13.686 -6.302 1.00 1.00 C ATOM 755 O VAL A 50 16.224 12.926 -6.080 1.00 1.00 O ATOM 756 CB VAL A 50 16.102 15.540 -7.804 1.00 1.00 C ATOM 757 CG1 VAL A 50 17.466 14.891 -7.979 1.00 1.00 C ATOM 758 CG2 VAL A 50 15.170 15.117 -8.932 1.00 1.00 C ATOM 0 H VAL A 50 17.202 16.088 -5.604 1.00 1.00 H new ATOM 0 HA VAL A 50 14.525 15.703 -6.361 1.00 1.00 H new ATOM 0 HB VAL A 50 16.232 16.621 -7.845 1.00 1.00 H new ATOM 0 HG11 VAL A 50 17.870 15.151 -8.957 1.00 1.00 H new ATOM 0 HG12 VAL A 50 18.141 15.248 -7.201 1.00 1.00 H new ATOM 0 HG13 VAL A 50 17.366 13.808 -7.904 1.00 1.00 H new ATOM 0 HG21 VAL A 50 15.622 15.368 -9.891 1.00 1.00 H new ATOM 0 HG22 VAL A 50 15.002 14.041 -8.881 1.00 1.00 H new ATOM 0 HG23 VAL A 50 14.218 15.638 -8.832 1.00 1.00 H new ATOM 768 N GLY A 51 14.024 13.266 -6.368 1.00 1.00 N ATOM 769 CA GLY A 51 13.704 11.862 -6.211 1.00 1.00 C ATOM 770 C GLY A 51 13.362 11.520 -4.778 1.00 1.00 C ATOM 771 O GLY A 51 12.864 10.432 -4.495 1.00 1.00 O ATOM 0 H GLY A 51 13.220 13.873 -6.528 1.00 1.00 H new ATOM 0 HA2 GLY A 51 12.863 11.607 -6.856 1.00 1.00 H new ATOM 0 HA3 GLY A 51 14.551 11.258 -6.537 1.00 1.00 H new ATOM 775 N SER A 52 13.671 12.439 -3.872 1.00 1.00 N ATOM 776 CA SER A 52 13.380 12.262 -2.457 1.00 1.00 C ATOM 777 C SER A 52 11.917 12.597 -2.178 1.00 1.00 C ATOM 778 O SER A 52 11.100 12.698 -3.098 1.00 1.00 O ATOM 779 CB SER A 52 14.288 13.154 -1.614 1.00 1.00 C ATOM 780 OG SER A 52 14.416 12.669 -0.289 1.00 1.00 O ATOM 0 H SER A 52 14.128 13.323 -4.097 1.00 1.00 H new ATOM 0 HA SER A 52 13.564 11.221 -2.190 1.00 1.00 H new ATOM 0 HB2 SER A 52 15.273 13.212 -2.077 1.00 1.00 H new ATOM 0 HB3 SER A 52 13.886 14.167 -1.593 1.00 1.00 H new ATOM 0 HG SER A 52 14.565 13.421 0.322 1.00 1.00 H new ATOM 786 N CYS A 53 11.633 12.900 -0.929 1.00 1.00 N ATOM 787 CA CYS A 53 10.293 13.220 -0.498 1.00 1.00 C ATOM 788 C CYS A 53 10.352 14.499 0.316 1.00 1.00 C ATOM 789 O CYS A 53 11.435 15.046 0.525 1.00 1.00 O ATOM 790 CB CYS A 53 9.743 12.065 0.342 1.00 1.00 C ATOM 791 SG CYS A 53 7.966 12.152 0.700 1.00 1.00 S ATOM 0 H CYS A 53 12.329 12.931 -0.184 1.00 1.00 H new ATOM 0 HA CYS A 53 9.633 13.365 -1.353 1.00 1.00 H new ATOM 0 HB2 CYS A 53 9.948 11.129 -0.177 1.00 1.00 H new ATOM 0 HB3 CYS A 53 10.287 12.032 1.286 1.00 1.00 H new ATOM 0 HG CYS A 53 7.354 12.742 -0.283 1.00 1.00 H new ATOM 797 N ALA A 54 9.197 15.012 0.709 1.00 1.00 N ATOM 798 CA ALA A 54 9.137 16.243 1.485 1.00 1.00 C ATOM 799 C ALA A 54 9.987 16.136 2.749 1.00 1.00 C ATOM 800 O ALA A 54 9.961 15.114 3.442 1.00 1.00 O ATOM 801 CB ALA A 54 7.695 16.573 1.828 1.00 1.00 C ATOM 0 H ALA A 54 8.288 14.596 0.504 1.00 1.00 H new ATOM 0 HA ALA A 54 9.545 17.053 0.881 1.00 1.00 H new ATOM 0 HB1 ALA A 54 7.661 17.495 2.408 1.00 1.00 H new ATOM 0 HB2 ALA A 54 7.123 16.701 0.909 1.00 1.00 H new ATOM 0 HB3 ALA A 54 7.265 15.760 2.413 1.00 1.00 H new ATOM 807 N ASP A 55 10.723 17.202 3.045 1.00 1.00 N ATOM 808 CA ASP A 55 11.620 17.222 4.190 1.00 1.00 C ATOM 809 C ASP A 55 10.831 17.062 5.474 1.00 1.00 C ATOM 810 O ASP A 55 9.734 17.610 5.617 1.00 1.00 O ATOM 811 CB ASP A 55 12.421 18.524 4.240 1.00 1.00 C ATOM 812 CG ASP A 55 13.575 18.457 5.219 1.00 1.00 C ATOM 813 OD1 ASP A 55 13.319 18.482 6.442 1.00 1.00 O ATOM 814 OD2 ASP A 55 14.738 18.378 4.768 1.00 1.00 O ATOM 0 H ASP A 55 10.714 18.066 2.504 1.00 1.00 H new ATOM 0 HA ASP A 55 12.317 16.391 4.085 1.00 1.00 H new ATOM 0 HB2 ASP A 55 12.805 18.749 3.245 1.00 1.00 H new ATOM 0 HB3 ASP A 55 11.759 19.344 4.519 1.00 1.00 H new ATOM 819 N GLU A 56 11.393 16.301 6.394 1.00 1.00 N ATOM 820 CA GLU A 56 10.762 16.003 7.670 1.00 1.00 C ATOM 821 C GLU A 56 10.285 17.250 8.416 1.00 1.00 C ATOM 822 O GLU A 56 9.284 17.188 9.130 1.00 1.00 O ATOM 823 CB GLU A 56 11.725 15.209 8.544 1.00 1.00 C ATOM 824 CG GLU A 56 13.056 15.904 8.776 1.00 1.00 C ATOM 825 CD GLU A 56 13.999 15.064 9.601 1.00 1.00 C ATOM 826 OE1 GLU A 56 13.772 14.936 10.824 1.00 1.00 O ATOM 827 OE2 GLU A 56 14.975 14.534 9.037 1.00 1.00 O ATOM 0 H GLU A 56 12.309 15.867 6.277 1.00 1.00 H new ATOM 0 HA GLU A 56 9.871 15.413 7.453 1.00 1.00 H new ATOM 0 HB2 GLU A 56 11.253 15.017 9.508 1.00 1.00 H new ATOM 0 HB3 GLU A 56 11.908 14.240 8.080 1.00 1.00 H new ATOM 0 HG2 GLU A 56 13.519 16.130 7.815 1.00 1.00 H new ATOM 0 HG3 GLU A 56 12.885 16.856 9.279 1.00 1.00 H new ATOM 834 N ARG A 57 10.956 18.387 8.241 1.00 1.00 N ATOM 835 CA ARG A 57 10.556 19.608 8.935 1.00 1.00 C ATOM 836 C ARG A 57 9.249 20.150 8.366 1.00 1.00 C ATOM 837 O ARG A 57 8.334 20.509 9.107 1.00 1.00 O ATOM 838 CB ARG A 57 11.664 20.664 8.816 1.00 1.00 C ATOM 839 CG ARG A 57 12.091 20.943 7.379 1.00 1.00 C ATOM 840 CD ARG A 57 13.226 21.952 7.292 1.00 1.00 C ATOM 841 NE ARG A 57 14.399 21.543 8.063 1.00 1.00 N ATOM 842 CZ ARG A 57 15.652 21.595 7.608 1.00 1.00 C ATOM 843 NH1 ARG A 57 15.901 21.967 6.357 1.00 1.00 N ATOM 844 NH2 ARG A 57 16.659 21.263 8.402 1.00 1.00 N ATOM 0 H ARG A 57 11.769 18.488 7.633 1.00 1.00 H new ATOM 0 HA ARG A 57 10.398 19.373 9.988 1.00 1.00 H new ATOM 0 HB2 ARG A 57 11.319 21.593 9.270 1.00 1.00 H new ATOM 0 HB3 ARG A 57 12.532 20.333 9.386 1.00 1.00 H new ATOM 0 HG2 ARG A 57 12.402 20.010 6.909 1.00 1.00 H new ATOM 0 HG3 ARG A 57 11.235 21.315 6.815 1.00 1.00 H new ATOM 0 HD2 ARG A 57 13.510 22.086 6.248 1.00 1.00 H new ATOM 0 HD3 ARG A 57 12.877 22.919 7.654 1.00 1.00 H new ATOM 0 HE ARG A 57 14.250 21.195 9.010 1.00 1.00 H new ATOM 0 HH11 ARG A 57 15.131 22.216 5.736 1.00 1.00 H new ATOM 0 HH12 ARG A 57 16.862 22.004 6.018 1.00 1.00 H new ATOM 0 HH21 ARG A 57 16.476 20.968 9.361 1.00 1.00 H new ATOM 0 HH22 ARG A 57 17.617 21.303 8.054 1.00 1.00 H new ATOM 858 N ALA A 58 9.158 20.162 7.044 1.00 1.00 N ATOM 859 CA ALA A 58 7.968 20.643 6.364 1.00 1.00 C ATOM 860 C ALA A 58 6.840 19.646 6.547 1.00 1.00 C ATOM 861 O ALA A 58 5.678 20.021 6.711 1.00 1.00 O ATOM 862 CB ALA A 58 8.265 20.862 4.890 1.00 1.00 C ATOM 0 H ALA A 58 9.899 19.842 6.420 1.00 1.00 H new ATOM 0 HA ALA A 58 7.662 21.597 6.794 1.00 1.00 H new ATOM 0 HB1 ALA A 58 7.367 21.223 4.388 1.00 1.00 H new ATOM 0 HB2 ALA A 58 9.061 21.599 4.785 1.00 1.00 H new ATOM 0 HB3 ALA A 58 8.580 19.921 4.439 1.00 1.00 H new ATOM 868 N ALA A 59 7.204 18.370 6.556 1.00 1.00 N ATOM 869 CA ALA A 59 6.247 17.306 6.773 1.00 1.00 C ATOM 870 C ALA A 59 5.642 17.444 8.160 1.00 1.00 C ATOM 871 O ALA A 59 4.427 17.353 8.323 1.00 1.00 O ATOM 872 CB ALA A 59 6.914 15.947 6.607 1.00 1.00 C ATOM 0 H ALA A 59 8.162 18.051 6.414 1.00 1.00 H new ATOM 0 HA ALA A 59 5.452 17.381 6.031 1.00 1.00 H new ATOM 0 HB1 ALA A 59 6.180 15.159 6.774 1.00 1.00 H new ATOM 0 HB2 ALA A 59 7.317 15.860 5.598 1.00 1.00 H new ATOM 0 HB3 ALA A 59 7.723 15.848 7.330 1.00 1.00 H new ATOM 878 N GLY A 60 6.494 17.712 9.148 1.00 1.00 N ATOM 879 CA GLY A 60 6.026 17.894 10.506 1.00 1.00 C ATOM 880 C GLY A 60 4.985 18.988 10.640 1.00 1.00 C ATOM 881 O GLY A 60 3.956 18.783 11.282 1.00 1.00 O ATOM 0 H GLY A 60 7.503 17.806 9.028 1.00 1.00 H new ATOM 0 HA2 GLY A 60 5.605 16.955 10.867 1.00 1.00 H new ATOM 0 HA3 GLY A 60 6.875 18.130 11.147 1.00 1.00 H new ATOM 885 N VAL A 61 5.218 20.145 10.025 1.00 1.00 N ATOM 886 CA VAL A 61 4.262 21.237 10.147 1.00 1.00 C ATOM 887 C VAL A 61 2.998 20.969 9.328 1.00 1.00 C ATOM 888 O VAL A 61 1.889 21.205 9.810 1.00 1.00 O ATOM 889 CB VAL A 61 4.863 22.622 9.795 1.00 1.00 C ATOM 890 CG1 VAL A 61 6.121 22.890 10.602 1.00 1.00 C ATOM 891 CG2 VAL A 61 5.137 22.779 8.313 1.00 1.00 C ATOM 0 H VAL A 61 6.038 20.346 9.452 1.00 1.00 H new ATOM 0 HA VAL A 61 3.990 21.276 11.202 1.00 1.00 H new ATOM 0 HB VAL A 61 4.110 23.364 10.061 1.00 1.00 H new ATOM 0 HG11 VAL A 61 6.523 23.868 10.336 1.00 1.00 H new ATOM 0 HG12 VAL A 61 5.882 22.873 11.665 1.00 1.00 H new ATOM 0 HG13 VAL A 61 6.863 22.122 10.385 1.00 1.00 H new ATOM 0 HG21 VAL A 61 5.557 23.767 8.123 1.00 1.00 H new ATOM 0 HG22 VAL A 61 5.845 22.016 7.991 1.00 1.00 H new ATOM 0 HG23 VAL A 61 4.206 22.668 7.757 1.00 1.00 H new ATOM 901 N LEU A 62 3.147 20.389 8.143 1.00 1.00 N ATOM 902 CA LEU A 62 1.988 20.084 7.307 1.00 1.00 C ATOM 903 C LEU A 62 1.068 19.094 8.009 1.00 1.00 C ATOM 904 O LEU A 62 -0.116 19.371 8.212 1.00 1.00 O ATOM 905 CB LEU A 62 2.424 19.532 5.946 1.00 1.00 C ATOM 906 CG LEU A 62 2.581 20.567 4.822 1.00 1.00 C ATOM 907 CD1 LEU A 62 3.350 21.789 5.298 1.00 1.00 C ATOM 908 CD2 LEU A 62 3.287 19.936 3.636 1.00 1.00 C ATOM 0 H LEU A 62 4.046 20.123 7.741 1.00 1.00 H new ATOM 0 HA LEU A 62 1.440 21.011 7.140 1.00 1.00 H new ATOM 0 HB2 LEU A 62 3.375 19.015 6.073 1.00 1.00 H new ATOM 0 HB3 LEU A 62 1.696 18.786 5.628 1.00 1.00 H new ATOM 0 HG LEU A 62 1.586 20.894 4.520 1.00 1.00 H new ATOM 0 HD11 LEU A 62 3.444 22.502 4.479 1.00 1.00 H new ATOM 0 HD12 LEU A 62 2.816 22.255 6.126 1.00 1.00 H new ATOM 0 HD13 LEU A 62 4.343 21.487 5.631 1.00 1.00 H new ATOM 0 HD21 LEU A 62 3.395 20.675 2.842 1.00 1.00 H new ATOM 0 HD22 LEU A 62 4.273 19.586 3.943 1.00 1.00 H new ATOM 0 HD23 LEU A 62 2.701 19.093 3.270 1.00 1.00 H new ATOM 920 N ARG A 63 1.637 17.977 8.437 1.00 1.00 N ATOM 921 CA ARG A 63 0.885 16.944 9.143 1.00 1.00 C ATOM 922 C ARG A 63 0.266 17.488 10.434 1.00 1.00 C ATOM 923 O ARG A 63 -0.792 17.029 10.864 1.00 1.00 O ATOM 924 CB ARG A 63 1.792 15.746 9.455 1.00 1.00 C ATOM 925 CG ARG A 63 2.750 15.982 10.616 1.00 1.00 C ATOM 926 CD ARG A 63 3.811 14.897 10.702 1.00 1.00 C ATOM 927 NE ARG A 63 3.243 13.590 11.039 1.00 1.00 N ATOM 928 CZ ARG A 63 3.777 12.423 10.678 1.00 1.00 C ATOM 929 NH1 ARG A 63 4.890 12.390 9.960 1.00 1.00 N ATOM 930 NH2 ARG A 63 3.203 11.289 11.051 1.00 1.00 N ATOM 0 H ARG A 63 2.625 17.760 8.307 1.00 1.00 H new ATOM 0 HA ARG A 63 0.073 16.618 8.493 1.00 1.00 H new ATOM 0 HB2 ARG A 63 1.169 14.881 9.681 1.00 1.00 H new ATOM 0 HB3 ARG A 63 2.370 15.499 8.564 1.00 1.00 H new ATOM 0 HG2 ARG A 63 3.232 16.953 10.498 1.00 1.00 H new ATOM 0 HG3 ARG A 63 2.188 16.016 11.550 1.00 1.00 H new ATOM 0 HD2 ARG A 63 4.335 14.828 9.749 1.00 1.00 H new ATOM 0 HD3 ARG A 63 4.551 15.174 11.453 1.00 1.00 H new ATOM 0 HE ARG A 63 2.382 13.571 11.586 1.00 1.00 H new ATOM 0 HH11 ARG A 63 5.343 13.260 9.681 1.00 1.00 H new ATOM 0 HH12 ARG A 63 5.294 11.494 9.687 1.00 1.00 H new ATOM 0 HH21 ARG A 63 2.353 11.309 11.614 1.00 1.00 H new ATOM 0 HH22 ARG A 63 3.611 10.396 10.775 1.00 1.00 H new ATOM 944 N ALA A 64 0.904 18.495 11.023 1.00 1.00 N ATOM 945 CA ALA A 64 0.404 19.103 12.251 1.00 1.00 C ATOM 946 C ALA A 64 -0.849 19.920 11.976 1.00 1.00 C ATOM 947 O ALA A 64 -1.728 20.045 12.827 1.00 1.00 O ATOM 948 CB ALA A 64 1.463 19.985 12.891 1.00 1.00 C ATOM 0 H ALA A 64 1.768 18.907 10.670 1.00 1.00 H new ATOM 0 HA ALA A 64 0.156 18.298 12.942 1.00 1.00 H new ATOM 0 HB1 ALA A 64 1.065 20.426 13.805 1.00 1.00 H new ATOM 0 HB2 ALA A 64 2.341 19.384 13.130 1.00 1.00 H new ATOM 0 HB3 ALA A 64 1.744 20.778 12.198 1.00 1.00 H new ATOM 954 N HIS A 65 -0.930 20.466 10.773 1.00 1.00 N ATOM 955 CA HIS A 65 -2.073 21.280 10.388 1.00 1.00 C ATOM 956 C HIS A 65 -3.091 20.442 9.609 1.00 1.00 C ATOM 957 O HIS A 65 -4.079 20.959 9.093 1.00 1.00 O ATOM 958 CB HIS A 65 -1.617 22.501 9.578 1.00 1.00 C ATOM 959 CG HIS A 65 -0.738 23.442 10.356 1.00 1.00 C ATOM 960 ND1 HIS A 65 -1.220 24.297 11.322 1.00 1.00 N ATOM 961 CD2 HIS A 65 0.604 23.641 10.326 1.00 1.00 C ATOM 962 CE1 HIS A 65 -0.214 24.973 11.851 1.00 1.00 C ATOM 963 NE2 HIS A 65 0.900 24.593 11.262 1.00 1.00 N ATOM 0 H HIS A 65 -0.220 20.361 10.048 1.00 1.00 H new ATOM 0 HA HIS A 65 -2.562 21.644 11.292 1.00 1.00 H new ATOM 0 HB2 HIS A 65 -1.078 22.160 8.694 1.00 1.00 H new ATOM 0 HB3 HIS A 65 -2.495 23.043 9.227 1.00 1.00 H new ATOM 0 HD2 HIS A 65 1.310 23.139 9.681 1.00 1.00 H new ATOM 0 HE1 HIS A 65 -0.293 25.712 12.634 1.00 1.00 H new ATOM 0 HE2 HIS A 65 1.832 24.950 11.470 1.00 1.00 H new ATOM 972 N GLY A 66 -2.815 19.144 9.511 1.00 1.00 N ATOM 973 CA GLY A 66 -3.735 18.224 8.857 1.00 1.00 C ATOM 974 C GLY A 66 -3.509 18.120 7.363 1.00 1.00 C ATOM 975 O GLY A 66 -4.354 17.596 6.635 1.00 1.00 O ATOM 0 H GLY A 66 -1.967 18.710 9.874 1.00 1.00 H new ATOM 0 HA2 GLY A 66 -3.630 17.235 9.304 1.00 1.00 H new ATOM 0 HA3 GLY A 66 -4.758 18.550 9.042 1.00 1.00 H new ATOM 979 N TYR A 67 -2.379 18.632 6.906 1.00 1.00 N ATOM 980 CA TYR A 67 -2.040 18.587 5.494 1.00 1.00 C ATOM 981 C TYR A 67 -1.223 17.342 5.171 1.00 1.00 C ATOM 982 O TYR A 67 -0.528 16.810 6.035 1.00 1.00 O ATOM 983 CB TYR A 67 -1.265 19.840 5.083 1.00 1.00 C ATOM 984 CG TYR A 67 -2.122 21.082 4.990 1.00 1.00 C ATOM 985 CD1 TYR A 67 -3.003 21.272 3.930 1.00 1.00 C ATOM 986 CD2 TYR A 67 -2.050 22.066 5.967 1.00 1.00 C ATOM 987 CE1 TYR A 67 -3.792 22.406 3.852 1.00 1.00 C ATOM 988 CE2 TYR A 67 -2.837 23.198 5.897 1.00 1.00 C ATOM 989 CZ TYR A 67 -3.701 23.365 4.834 1.00 1.00 C ATOM 990 OH TYR A 67 -4.492 24.489 4.765 1.00 1.00 O ATOM 0 H TYR A 67 -1.679 19.085 7.494 1.00 1.00 H new ATOM 0 HA TYR A 67 -2.971 18.549 4.929 1.00 1.00 H new ATOM 0 HB2 TYR A 67 -0.465 20.014 5.803 1.00 1.00 H new ATOM 0 HB3 TYR A 67 -0.791 19.663 4.117 1.00 1.00 H new ATOM 0 HD1 TYR A 67 -3.072 20.522 3.156 1.00 1.00 H new ATOM 0 HD2 TYR A 67 -1.367 21.944 6.795 1.00 1.00 H new ATOM 0 HE1 TYR A 67 -4.475 22.537 3.026 1.00 1.00 H new ATOM 0 HE2 TYR A 67 -2.777 23.949 6.670 1.00 1.00 H new ATOM 0 HH TYR A 67 -4.308 25.067 5.535 1.00 1.00 H new ATOM 1000 N PRO A 68 -1.335 16.835 3.933 1.00 1.00 N ATOM 1001 CA PRO A 68 -0.543 15.697 3.480 1.00 1.00 C ATOM 1002 C PRO A 68 0.920 16.074 3.374 1.00 1.00 C ATOM 1003 O PRO A 68 1.256 17.246 3.209 1.00 1.00 O ATOM 1004 CB PRO A 68 -1.111 15.377 2.099 1.00 1.00 C ATOM 1005 CG PRO A 68 -1.732 16.651 1.639 1.00 1.00 C ATOM 1006 CD PRO A 68 -2.238 17.333 2.881 1.00 1.00 C ATOM 0 HA PRO A 68 -0.596 14.851 4.165 1.00 1.00 H new ATOM 0 HB2 PRO A 68 -0.328 15.049 1.415 1.00 1.00 H new ATOM 0 HB3 PRO A 68 -1.846 14.574 2.150 1.00 1.00 H new ATOM 0 HG2 PRO A 68 -1.005 17.275 1.119 1.00 1.00 H new ATOM 0 HG3 PRO A 68 -2.546 16.459 0.939 1.00 1.00 H new ATOM 0 HD2 PRO A 68 -2.191 18.418 2.791 1.00 1.00 H new ATOM 0 HD3 PRO A 68 -3.277 17.075 3.087 1.00 1.00 H new ATOM 1014 N THR A 69 1.788 15.092 3.463 1.00 1.00 N ATOM 1015 CA THR A 69 3.209 15.370 3.443 1.00 1.00 C ATOM 1016 C THR A 69 3.947 14.480 2.449 1.00 1.00 C ATOM 1017 O THR A 69 5.176 14.485 2.387 1.00 1.00 O ATOM 1018 CB THR A 69 3.805 15.192 4.855 1.00 1.00 C ATOM 1019 OG1 THR A 69 3.715 13.819 5.265 1.00 1.00 O ATOM 1020 CG2 THR A 69 3.068 16.054 5.863 1.00 1.00 C ATOM 0 H THR A 69 1.542 14.106 3.549 1.00 1.00 H new ATOM 0 HA THR A 69 3.338 16.404 3.122 1.00 1.00 H new ATOM 0 HB THR A 69 4.851 15.497 4.816 1.00 1.00 H new ATOM 0 HG1 THR A 69 4.098 13.720 6.162 1.00 1.00 H new ATOM 0 HG21 THR A 69 3.505 15.912 6.851 1.00 1.00 H new ATOM 0 HG22 THR A 69 3.152 17.102 5.576 1.00 1.00 H new ATOM 0 HG23 THR A 69 2.017 15.768 5.887 1.00 1.00 H new ATOM 1028 N ASP A 70 3.194 13.772 1.618 1.00 1.00 N ATOM 1029 CA ASP A 70 3.794 12.884 0.633 1.00 1.00 C ATOM 1030 C ASP A 70 3.887 13.566 -0.727 1.00 1.00 C ATOM 1031 O ASP A 70 2.974 14.289 -1.138 1.00 1.00 O ATOM 1032 CB ASP A 70 2.999 11.584 0.505 1.00 1.00 C ATOM 1033 CG ASP A 70 3.707 10.567 -0.379 1.00 1.00 C ATOM 1034 OD1 ASP A 70 3.496 10.589 -1.607 1.00 1.00 O ATOM 1035 OD2 ASP A 70 4.489 9.753 0.159 1.00 1.00 O ATOM 0 H ASP A 70 2.174 13.795 1.606 1.00 1.00 H new ATOM 0 HA ASP A 70 4.800 12.645 0.978 1.00 1.00 H new ATOM 0 HB2 ASP A 70 2.842 11.156 1.495 1.00 1.00 H new ATOM 0 HB3 ASP A 70 2.014 11.801 0.091 1.00 1.00 H new ATOM 1040 N HIS A 71 5.035 13.389 -1.367 1.00 1.00 N ATOM 1041 CA HIS A 71 5.310 13.914 -2.696 1.00 1.00 C ATOM 1042 C HIS A 71 6.713 13.475 -3.080 1.00 1.00 C ATOM 1043 O HIS A 71 7.504 13.137 -2.206 1.00 1.00 O ATOM 1044 CB HIS A 71 5.145 15.458 -2.732 1.00 1.00 C ATOM 1045 CG HIS A 71 6.387 16.272 -2.997 1.00 1.00 C ATOM 1046 ND1 HIS A 71 6.482 17.157 -4.050 1.00 1.00 N ATOM 1047 CD2 HIS A 71 7.566 16.369 -2.325 1.00 1.00 C ATOM 1048 CE1 HIS A 71 7.657 17.755 -4.020 1.00 1.00 C ATOM 1049 NE2 HIS A 71 8.334 17.296 -2.986 1.00 1.00 N ATOM 0 H HIS A 71 5.815 12.867 -0.969 1.00 1.00 H new ATOM 0 HA HIS A 71 4.596 13.523 -3.421 1.00 1.00 H new ATOM 0 HB2 HIS A 71 4.409 15.703 -3.498 1.00 1.00 H new ATOM 0 HB3 HIS A 71 4.728 15.777 -1.777 1.00 1.00 H new ATOM 0 HD2 HIS A 71 7.846 15.820 -1.438 1.00 1.00 H new ATOM 0 HE1 HIS A 71 8.006 18.496 -4.724 1.00 1.00 H new ATOM 0 HE2 HIS A 71 9.276 17.583 -2.720 1.00 1.00 H new ATOM 1058 N ARG A 72 7.056 13.524 -4.349 1.00 1.00 N ATOM 1059 CA ARG A 72 8.382 13.110 -4.745 1.00 1.00 C ATOM 1060 C ARG A 72 9.069 14.267 -5.442 1.00 1.00 C ATOM 1061 O ARG A 72 8.528 14.831 -6.394 1.00 1.00 O ATOM 1062 CB ARG A 72 8.329 11.884 -5.654 1.00 1.00 C ATOM 1063 CG ARG A 72 9.448 10.896 -5.382 1.00 1.00 C ATOM 1064 CD ARG A 72 9.278 10.245 -4.015 1.00 1.00 C ATOM 1065 NE ARG A 72 10.515 9.615 -3.556 1.00 1.00 N ATOM 1066 CZ ARG A 72 10.605 8.803 -2.505 1.00 1.00 C ATOM 1067 NH1 ARG A 72 9.521 8.468 -1.808 1.00 1.00 N ATOM 1068 NH2 ARG A 72 11.789 8.317 -2.144 1.00 1.00 N ATOM 0 H ARG A 72 6.451 13.839 -5.107 1.00 1.00 H new ATOM 0 HA ARG A 72 8.949 12.829 -3.858 1.00 1.00 H new ATOM 0 HB2 ARG A 72 7.370 11.383 -5.524 1.00 1.00 H new ATOM 0 HB3 ARG A 72 8.381 12.207 -6.694 1.00 1.00 H new ATOM 0 HG2 ARG A 72 9.457 10.129 -6.156 1.00 1.00 H new ATOM 0 HG3 ARG A 72 10.409 11.407 -5.429 1.00 1.00 H new ATOM 0 HD2 ARG A 72 8.963 10.997 -3.291 1.00 1.00 H new ATOM 0 HD3 ARG A 72 8.486 9.498 -4.064 1.00 1.00 H new ATOM 0 HE ARG A 72 11.369 9.812 -4.078 1.00 1.00 H new ATOM 0 HH11 ARG A 72 8.608 8.834 -2.077 1.00 1.00 H new ATOM 0 HH12 ARG A 72 9.604 7.845 -1.005 1.00 1.00 H new ATOM 0 HH21 ARG A 72 12.625 8.567 -2.672 1.00 1.00 H new ATOM 0 HH22 ARG A 72 11.861 7.695 -1.339 1.00 1.00 H new ATOM 1082 N ALA A 73 10.196 14.684 -4.889 1.00 1.00 N ATOM 1083 CA ALA A 73 10.933 15.825 -5.413 1.00 1.00 C ATOM 1084 C ALA A 73 11.364 15.590 -6.857 1.00 1.00 C ATOM 1085 O ALA A 73 11.756 14.485 -7.228 1.00 1.00 O ATOM 1086 CB ALA A 73 12.137 16.129 -4.535 1.00 1.00 C ATOM 0 H ALA A 73 10.624 14.247 -4.072 1.00 1.00 H new ATOM 0 HA ALA A 73 10.268 16.689 -5.402 1.00 1.00 H new ATOM 0 HB1 ALA A 73 12.677 16.985 -4.941 1.00 1.00 H new ATOM 0 HB2 ALA A 73 11.801 16.358 -3.524 1.00 1.00 H new ATOM 0 HB3 ALA A 73 12.797 15.262 -4.510 1.00 1.00 H new ATOM 1092 N ALA A 74 11.281 16.630 -7.658 1.00 1.00 N ATOM 1093 CA ALA A 74 11.669 16.556 -9.053 1.00 1.00 C ATOM 1094 C ALA A 74 12.513 17.761 -9.425 1.00 1.00 C ATOM 1095 O ALA A 74 12.412 18.816 -8.803 1.00 1.00 O ATOM 1096 CB ALA A 74 10.426 16.493 -9.932 1.00 1.00 C ATOM 0 H ALA A 74 10.945 17.547 -7.364 1.00 1.00 H new ATOM 0 HA ALA A 74 12.261 15.654 -9.210 1.00 1.00 H new ATOM 0 HB1 ALA A 74 10.723 16.438 -10.979 1.00 1.00 H new ATOM 0 HB2 ALA A 74 9.842 15.610 -9.673 1.00 1.00 H new ATOM 0 HB3 ALA A 74 9.822 17.387 -9.773 1.00 1.00 H new ATOM 1102 N GLN A 75 13.402 17.594 -10.391 1.00 1.00 N ATOM 1103 CA GLN A 75 14.213 18.698 -10.859 1.00 1.00 C ATOM 1104 C GLN A 75 13.453 19.429 -11.957 1.00 1.00 C ATOM 1105 O GLN A 75 12.573 18.849 -12.600 1.00 1.00 O ATOM 1106 CB GLN A 75 15.566 18.181 -11.354 1.00 1.00 C ATOM 1107 CG GLN A 75 16.370 19.181 -12.178 1.00 1.00 C ATOM 1108 CD GLN A 75 17.776 18.696 -12.472 1.00 1.00 C ATOM 1109 OE1 GLN A 75 18.021 17.495 -12.573 1.00 1.00 O ATOM 1110 NE2 GLN A 75 18.710 19.625 -12.605 1.00 1.00 N ATOM 0 H GLN A 75 13.577 16.707 -10.863 1.00 1.00 H new ATOM 0 HA GLN A 75 14.411 19.397 -10.046 1.00 1.00 H new ATOM 0 HB2 GLN A 75 16.161 17.880 -10.492 1.00 1.00 H new ATOM 0 HB3 GLN A 75 15.400 17.287 -11.955 1.00 1.00 H new ATOM 0 HG2 GLN A 75 15.852 19.372 -13.118 1.00 1.00 H new ATOM 0 HG3 GLN A 75 16.421 20.129 -11.643 1.00 1.00 H new ATOM 0 HE21 GLN A 75 18.465 20.611 -12.514 1.00 1.00 H new ATOM 0 HE22 GLN A 75 19.674 19.355 -12.799 1.00 1.00 H new ATOM 1119 N VAL A 76 13.739 20.707 -12.122 1.00 1.00 N ATOM 1120 CA VAL A 76 13.063 21.510 -13.128 1.00 1.00 C ATOM 1121 C VAL A 76 13.379 20.993 -14.523 1.00 1.00 C ATOM 1122 O VAL A 76 14.522 21.032 -14.973 1.00 1.00 O ATOM 1123 CB VAL A 76 13.472 22.984 -13.039 1.00 1.00 C ATOM 1124 CG1 VAL A 76 12.642 23.848 -13.944 1.00 1.00 C ATOM 1125 CG2 VAL A 76 13.401 23.494 -11.610 1.00 1.00 C ATOM 0 H VAL A 76 14.434 21.213 -11.573 1.00 1.00 H new ATOM 0 HA VAL A 76 11.993 21.431 -12.938 1.00 1.00 H new ATOM 0 HB VAL A 76 14.508 23.045 -13.374 1.00 1.00 H new ATOM 0 HG11 VAL A 76 12.963 24.886 -13.852 1.00 1.00 H new ATOM 0 HG12 VAL A 76 12.767 23.520 -14.976 1.00 1.00 H new ATOM 0 HG13 VAL A 76 11.592 23.767 -13.662 1.00 1.00 H new ATOM 0 HG21 VAL A 76 13.697 24.543 -11.583 1.00 1.00 H new ATOM 0 HG22 VAL A 76 12.381 23.396 -11.239 1.00 1.00 H new ATOM 0 HG23 VAL A 76 14.074 22.910 -10.982 1.00 1.00 H new ATOM 1135 N GLY A 77 12.355 20.492 -15.178 1.00 1.00 N ATOM 1136 CA GLY A 77 12.502 19.978 -16.517 1.00 1.00 C ATOM 1137 C GLY A 77 11.533 20.635 -17.464 1.00 1.00 C ATOM 1138 O GLY A 77 10.819 21.562 -17.075 1.00 1.00 O ATOM 0 H GLY A 77 11.409 20.431 -14.801 1.00 1.00 H new ATOM 0 HA2 GLY A 77 13.522 20.145 -16.863 1.00 1.00 H new ATOM 0 HA3 GLY A 77 12.338 18.900 -16.515 1.00 1.00 H new ATOM 1142 N THR A 78 11.427 20.091 -18.664 1.00 1.00 N ATOM 1143 CA THR A 78 10.556 20.644 -19.687 1.00 1.00 C ATOM 1144 C THR A 78 9.100 20.663 -19.222 1.00 1.00 C ATOM 1145 O THR A 78 8.408 21.667 -19.381 1.00 1.00 O ATOM 1146 CB THR A 78 10.692 19.848 -20.998 1.00 1.00 C ATOM 1147 OG1 THR A 78 12.010 20.021 -21.531 1.00 1.00 O ATOM 1148 CG2 THR A 78 9.661 20.289 -22.024 1.00 1.00 C ATOM 0 H THR A 78 11.939 19.258 -18.956 1.00 1.00 H new ATOM 0 HA THR A 78 10.864 21.674 -19.869 1.00 1.00 H new ATOM 0 HB THR A 78 10.518 18.795 -20.776 1.00 1.00 H new ATOM 0 HG1 THR A 78 12.095 19.512 -22.364 1.00 1.00 H new ATOM 0 HG21 THR A 78 9.785 19.707 -22.937 1.00 1.00 H new ATOM 0 HG22 THR A 78 8.659 20.129 -21.625 1.00 1.00 H new ATOM 0 HG23 THR A 78 9.799 21.347 -22.246 1.00 1.00 H new ATOM 1156 N GLU A 79 8.654 19.569 -18.601 1.00 1.00 N ATOM 1157 CA GLU A 79 7.298 19.491 -18.065 1.00 1.00 C ATOM 1158 C GLU A 79 7.048 20.587 -17.028 1.00 1.00 C ATOM 1159 O GLU A 79 5.929 21.074 -16.880 1.00 1.00 O ATOM 1160 CB GLU A 79 7.047 18.118 -17.435 1.00 1.00 C ATOM 1161 CG GLU A 79 8.035 17.770 -16.334 1.00 1.00 C ATOM 1162 CD GLU A 79 7.562 16.629 -15.459 1.00 1.00 C ATOM 1163 OE1 GLU A 79 7.855 15.462 -15.790 1.00 1.00 O ATOM 1164 OE2 GLU A 79 6.885 16.894 -14.441 1.00 1.00 O ATOM 0 H GLU A 79 9.213 18.728 -18.458 1.00 1.00 H new ATOM 0 HA GLU A 79 6.607 19.636 -18.895 1.00 1.00 H new ATOM 0 HB2 GLU A 79 6.036 18.093 -17.028 1.00 1.00 H new ATOM 0 HB3 GLU A 79 7.097 17.355 -18.212 1.00 1.00 H new ATOM 0 HG2 GLU A 79 8.993 17.505 -16.782 1.00 1.00 H new ATOM 0 HG3 GLU A 79 8.206 18.650 -15.714 1.00 1.00 H new ATOM 1171 N HIS A 80 8.097 20.975 -16.311 1.00 1.00 N ATOM 1172 CA HIS A 80 7.969 22.008 -15.293 1.00 1.00 C ATOM 1173 C HIS A 80 7.888 23.382 -15.943 1.00 1.00 C ATOM 1174 O HIS A 80 7.067 24.204 -15.559 1.00 1.00 O ATOM 1175 CB HIS A 80 9.106 21.924 -14.260 1.00 1.00 C ATOM 1176 CG HIS A 80 9.073 20.634 -13.488 1.00 1.00 C ATOM 1177 ND1 HIS A 80 9.734 19.487 -13.887 1.00 1.00 N ATOM 1178 CD2 HIS A 80 8.425 20.307 -12.343 1.00 1.00 C ATOM 1179 CE1 HIS A 80 9.494 18.520 -13.020 1.00 1.00 C ATOM 1180 NE2 HIS A 80 8.705 18.990 -12.075 1.00 1.00 N ATOM 0 H HIS A 80 9.037 20.593 -16.415 1.00 1.00 H new ATOM 0 HA HIS A 80 7.040 21.842 -14.747 1.00 1.00 H new ATOM 0 HB2 HIS A 80 10.065 22.017 -14.769 1.00 1.00 H new ATOM 0 HB3 HIS A 80 9.029 22.763 -13.568 1.00 1.00 H new ATOM 0 HD2 HIS A 80 7.803 20.962 -11.751 1.00 1.00 H new ATOM 0 HE1 HIS A 80 9.880 17.513 -13.076 1.00 1.00 H new ATOM 0 HE2 HIS A 80 8.359 18.461 -11.274 1.00 1.00 H new ATOM 1189 N LEU A 81 8.695 23.598 -16.976 1.00 1.00 N ATOM 1190 CA LEU A 81 8.673 24.857 -17.722 1.00 1.00 C ATOM 1191 C LEU A 81 7.395 24.972 -18.529 1.00 1.00 C ATOM 1192 O LEU A 81 7.060 26.043 -19.025 1.00 1.00 O ATOM 1193 CB LEU A 81 9.858 24.935 -18.675 1.00 1.00 C ATOM 1194 CG LEU A 81 11.204 24.546 -18.066 1.00 1.00 C ATOM 1195 CD1 LEU A 81 12.239 24.334 -19.156 1.00 1.00 C ATOM 1196 CD2 LEU A 81 11.667 25.620 -17.096 1.00 1.00 C ATOM 0 H LEU A 81 9.374 22.918 -17.318 1.00 1.00 H new ATOM 0 HA LEU A 81 8.728 25.672 -17.001 1.00 1.00 H new ATOM 0 HB2 LEU A 81 9.662 24.286 -19.529 1.00 1.00 H new ATOM 0 HB3 LEU A 81 9.930 25.953 -19.058 1.00 1.00 H new ATOM 0 HG LEU A 81 11.084 23.610 -17.521 1.00 1.00 H new ATOM 0 HD11 LEU A 81 13.192 24.058 -18.704 1.00 1.00 H new ATOM 0 HD12 LEU A 81 11.908 23.537 -19.822 1.00 1.00 H new ATOM 0 HD13 LEU A 81 12.361 25.255 -19.726 1.00 1.00 H new ATOM 0 HD21 LEU A 81 12.627 25.333 -16.667 1.00 1.00 H new ATOM 0 HD22 LEU A 81 11.774 26.567 -17.625 1.00 1.00 H new ATOM 0 HD23 LEU A 81 10.932 25.731 -16.299 1.00 1.00 H new ATOM 1208 N ALA A 82 6.709 23.848 -18.724 1.00 1.00 N ATOM 1209 CA ALA A 82 5.487 23.841 -19.495 1.00 1.00 C ATOM 1210 C ALA A 82 4.308 24.193 -18.611 1.00 1.00 C ATOM 1211 O ALA A 82 3.169 24.248 -19.073 1.00 1.00 O ATOM 1212 CB ALA A 82 5.265 22.479 -20.122 1.00 1.00 C ATOM 0 H ALA A 82 6.985 22.937 -18.356 1.00 1.00 H new ATOM 0 HA ALA A 82 5.576 24.585 -20.286 1.00 1.00 H new ATOM 0 HB1 ALA A 82 4.340 22.491 -20.699 1.00 1.00 H new ATOM 0 HB2 ALA A 82 6.101 22.241 -20.780 1.00 1.00 H new ATOM 0 HB3 ALA A 82 5.194 21.725 -19.338 1.00 1.00 H new ATOM 1218 N ALA A 83 4.565 24.293 -17.311 1.00 1.00 N ATOM 1219 CA ALA A 83 3.524 24.649 -16.363 1.00 1.00 C ATOM 1220 C ALA A 83 2.912 26.002 -16.709 1.00 1.00 C ATOM 1221 O ALA A 83 3.587 26.880 -17.242 1.00 1.00 O ATOM 1222 CB ALA A 83 4.071 24.662 -14.949 1.00 1.00 C ATOM 0 H ALA A 83 5.482 24.133 -16.894 1.00 1.00 H new ATOM 0 HA ALA A 83 2.740 23.894 -16.424 1.00 1.00 H new ATOM 0 HB1 ALA A 83 3.276 24.931 -14.254 1.00 1.00 H new ATOM 0 HB2 ALA A 83 4.454 23.673 -14.698 1.00 1.00 H new ATOM 0 HB3 ALA A 83 4.878 25.392 -14.878 1.00 1.00 H new ATOM 1228 N ASP A 84 1.638 26.172 -16.392 1.00 1.00 N ATOM 1229 CA ASP A 84 0.957 27.429 -16.670 1.00 1.00 C ATOM 1230 C ASP A 84 1.391 28.479 -15.667 1.00 1.00 C ATOM 1231 O ASP A 84 1.322 29.676 -15.930 1.00 1.00 O ATOM 1232 CB ASP A 84 -0.561 27.261 -16.613 1.00 1.00 C ATOM 1233 CG ASP A 84 -1.273 28.468 -17.199 1.00 1.00 C ATOM 1234 OD1 ASP A 84 -0.995 28.800 -18.375 1.00 1.00 O ATOM 1235 OD2 ASP A 84 -2.103 29.078 -16.494 1.00 1.00 O ATOM 0 H ASP A 84 1.057 25.462 -15.945 1.00 1.00 H new ATOM 0 HA ASP A 84 1.228 27.746 -17.677 1.00 1.00 H new ATOM 0 HB2 ASP A 84 -0.850 26.364 -17.161 1.00 1.00 H new ATOM 0 HB3 ASP A 84 -0.874 27.118 -15.579 1.00 1.00 H new ATOM 1240 N LEU A 85 1.993 28.010 -14.584 1.00 1.00 N ATOM 1241 CA LEU A 85 2.422 28.879 -13.512 1.00 1.00 C ATOM 1242 C LEU A 85 3.594 28.244 -12.802 1.00 1.00 C ATOM 1243 O LEU A 85 3.493 27.138 -12.273 1.00 1.00 O ATOM 1244 CB LEU A 85 1.285 29.082 -12.511 1.00 1.00 C ATOM 1245 CG LEU A 85 1.398 30.291 -11.573 1.00 1.00 C ATOM 1246 CD1 LEU A 85 0.395 30.146 -10.466 1.00 1.00 C ATOM 1247 CD2 LEU A 85 2.779 30.434 -10.979 1.00 1.00 C ATOM 0 H LEU A 85 2.194 27.022 -14.429 1.00 1.00 H new ATOM 0 HA LEU A 85 2.710 29.844 -13.928 1.00 1.00 H new ATOM 0 HB2 LEU A 85 0.353 29.171 -13.069 1.00 1.00 H new ATOM 0 HB3 LEU A 85 1.206 28.183 -11.899 1.00 1.00 H new ATOM 0 HG LEU A 85 1.202 31.187 -12.162 1.00 1.00 H new ATOM 0 HD11 LEU A 85 0.468 31.001 -9.794 1.00 1.00 H new ATOM 0 HD12 LEU A 85 -0.609 30.101 -10.888 1.00 1.00 H new ATOM 0 HD13 LEU A 85 0.596 29.230 -9.910 1.00 1.00 H new ATOM 0 HD21 LEU A 85 2.805 31.304 -10.323 1.00 1.00 H new ATOM 0 HD22 LEU A 85 3.023 29.540 -10.405 1.00 1.00 H new ATOM 0 HD23 LEU A 85 3.508 30.561 -11.779 1.00 1.00 H new ATOM 1259 N LEU A 86 4.716 28.912 -12.846 1.00 1.00 N ATOM 1260 CA LEU A 86 5.877 28.425 -12.181 1.00 1.00 C ATOM 1261 C LEU A 86 6.160 29.282 -10.961 1.00 1.00 C ATOM 1262 O LEU A 86 6.658 30.397 -11.071 1.00 1.00 O ATOM 1263 CB LEU A 86 7.027 28.390 -13.163 1.00 1.00 C ATOM 1264 CG LEU A 86 6.807 27.435 -14.343 1.00 1.00 C ATOM 1265 CD1 LEU A 86 5.741 27.934 -15.292 1.00 1.00 C ATOM 1266 CD2 LEU A 86 8.089 27.247 -15.085 1.00 1.00 C ATOM 0 H LEU A 86 4.843 29.796 -13.339 1.00 1.00 H new ATOM 0 HA LEU A 86 5.726 27.407 -11.821 1.00 1.00 H new ATOM 0 HB2 LEU A 86 7.194 29.396 -13.548 1.00 1.00 H new ATOM 0 HB3 LEU A 86 7.934 28.097 -12.635 1.00 1.00 H new ATOM 0 HG LEU A 86 6.465 26.484 -13.934 1.00 1.00 H new ATOM 0 HD11 LEU A 86 5.622 27.224 -16.111 1.00 1.00 H new ATOM 0 HD12 LEU A 86 4.796 28.034 -14.758 1.00 1.00 H new ATOM 0 HD13 LEU A 86 6.036 28.904 -15.693 1.00 1.00 H new ATOM 0 HD21 LEU A 86 7.929 26.568 -15.922 1.00 1.00 H new ATOM 0 HD22 LEU A 86 8.437 28.210 -15.460 1.00 1.00 H new ATOM 0 HD23 LEU A 86 8.839 26.826 -14.415 1.00 1.00 H new ATOM 1278 N VAL A 87 5.835 28.730 -9.801 1.00 1.00 N ATOM 1279 CA VAL A 87 5.957 29.449 -8.543 1.00 1.00 C ATOM 1280 C VAL A 87 7.381 29.372 -8.014 1.00 1.00 C ATOM 1281 O VAL A 87 7.774 28.418 -7.353 1.00 1.00 O ATOM 1282 CB VAL A 87 4.974 28.916 -7.481 1.00 1.00 C ATOM 1283 CG1 VAL A 87 5.272 29.511 -6.124 1.00 1.00 C ATOM 1284 CG2 VAL A 87 3.546 29.227 -7.878 1.00 1.00 C ATOM 0 H VAL A 87 5.482 27.778 -9.706 1.00 1.00 H new ATOM 0 HA VAL A 87 5.706 30.491 -8.743 1.00 1.00 H new ATOM 0 HB VAL A 87 5.098 27.835 -7.420 1.00 1.00 H new ATOM 0 HG11 VAL A 87 4.565 29.120 -5.392 1.00 1.00 H new ATOM 0 HG12 VAL A 87 6.287 29.247 -5.826 1.00 1.00 H new ATOM 0 HG13 VAL A 87 5.179 30.596 -6.174 1.00 1.00 H new ATOM 0 HG21 VAL A 87 2.865 28.844 -7.118 1.00 1.00 H new ATOM 0 HG22 VAL A 87 3.420 30.306 -7.967 1.00 1.00 H new ATOM 0 HG23 VAL A 87 3.323 28.755 -8.835 1.00 1.00 H new ATOM 1294 N ALA A 88 8.178 30.337 -8.399 1.00 1.00 N ATOM 1295 CA ALA A 88 9.557 30.390 -7.962 1.00 1.00 C ATOM 1296 C ALA A 88 9.644 30.930 -6.547 1.00 1.00 C ATOM 1297 O ALA A 88 8.846 31.775 -6.141 1.00 1.00 O ATOM 1298 CB ALA A 88 10.391 31.227 -8.907 1.00 1.00 C ATOM 0 H ALA A 88 7.898 31.100 -9.016 1.00 1.00 H new ATOM 0 HA ALA A 88 9.957 29.376 -7.969 1.00 1.00 H new ATOM 0 HB1 ALA A 88 11.423 31.251 -8.557 1.00 1.00 H new ATOM 0 HB2 ALA A 88 10.357 30.791 -9.906 1.00 1.00 H new ATOM 0 HB3 ALA A 88 9.995 32.242 -8.940 1.00 1.00 H new ATOM 1304 N LEU A 89 10.605 30.429 -5.792 1.00 1.00 N ATOM 1305 CA LEU A 89 10.826 30.886 -4.434 1.00 1.00 C ATOM 1306 C LEU A 89 11.907 31.962 -4.426 1.00 1.00 C ATOM 1307 O LEU A 89 12.138 32.624 -3.424 1.00 1.00 O ATOM 1308 CB LEU A 89 11.217 29.706 -3.536 1.00 1.00 C ATOM 1309 CG LEU A 89 10.049 28.856 -3.017 1.00 1.00 C ATOM 1310 CD1 LEU A 89 9.033 29.727 -2.293 1.00 1.00 C ATOM 1311 CD2 LEU A 89 9.381 28.082 -4.145 1.00 1.00 C ATOM 0 H LEU A 89 11.249 29.700 -6.100 1.00 1.00 H new ATOM 0 HA LEU A 89 9.905 31.317 -4.041 1.00 1.00 H new ATOM 0 HB2 LEU A 89 11.896 29.059 -4.091 1.00 1.00 H new ATOM 0 HB3 LEU A 89 11.772 30.091 -2.680 1.00 1.00 H new ATOM 0 HG LEU A 89 10.454 28.132 -2.310 1.00 1.00 H new ATOM 0 HD11 LEU A 89 8.213 29.106 -1.933 1.00 1.00 H new ATOM 0 HD12 LEU A 89 9.513 30.220 -1.448 1.00 1.00 H new ATOM 0 HD13 LEU A 89 8.644 30.479 -2.979 1.00 1.00 H new ATOM 0 HD21 LEU A 89 8.558 27.491 -3.743 1.00 1.00 H new ATOM 0 HD22 LEU A 89 8.996 28.781 -4.888 1.00 1.00 H new ATOM 0 HD23 LEU A 89 10.109 27.420 -4.613 1.00 1.00 H new ATOM 1323 N ASP A 90 12.545 32.139 -5.578 1.00 1.00 N ATOM 1324 CA ASP A 90 13.583 33.152 -5.744 1.00 1.00 C ATOM 1325 C ASP A 90 13.649 33.639 -7.179 1.00 1.00 C ATOM 1326 O ASP A 90 13.348 32.889 -8.112 1.00 1.00 O ATOM 1327 CB ASP A 90 14.957 32.611 -5.358 1.00 1.00 C ATOM 1328 CG ASP A 90 15.289 32.772 -3.896 1.00 1.00 C ATOM 1329 OD1 ASP A 90 15.576 33.912 -3.479 1.00 1.00 O ATOM 1330 OD2 ASP A 90 15.218 31.770 -3.156 1.00 1.00 O ATOM 0 H ASP A 90 12.360 31.590 -6.417 1.00 1.00 H new ATOM 0 HA ASP A 90 13.318 33.979 -5.085 1.00 1.00 H new ATOM 0 HB2 ASP A 90 15.006 31.553 -5.617 1.00 1.00 H new ATOM 0 HB3 ASP A 90 15.717 33.120 -5.951 1.00 1.00 H new ATOM 1335 N ARG A 91 14.140 34.862 -7.344 1.00 1.00 N ATOM 1336 CA ARG A 91 14.320 35.482 -8.658 1.00 1.00 C ATOM 1337 C ARG A 91 15.299 34.692 -9.520 1.00 1.00 C ATOM 1338 O ARG A 91 15.259 34.761 -10.748 1.00 1.00 O ATOM 1339 CB ARG A 91 14.811 36.916 -8.491 1.00 1.00 C ATOM 1340 CG ARG A 91 15.843 37.063 -7.388 1.00 1.00 C ATOM 1341 CD ARG A 91 16.153 38.518 -7.102 1.00 1.00 C ATOM 1342 NE ARG A 91 16.736 38.696 -5.774 1.00 1.00 N ATOM 1343 CZ ARG A 91 17.371 39.799 -5.380 1.00 1.00 C ATOM 1344 NH1 ARG A 91 17.565 40.803 -6.227 1.00 1.00 N ATOM 1345 NH2 ARG A 91 17.814 39.907 -4.134 1.00 1.00 N ATOM 0 H ARG A 91 14.427 35.457 -6.567 1.00 1.00 H new ATOM 0 HA ARG A 91 13.355 35.483 -9.165 1.00 1.00 H new ATOM 0 HB2 ARG A 91 15.241 37.259 -9.432 1.00 1.00 H new ATOM 0 HB3 ARG A 91 13.961 37.563 -8.275 1.00 1.00 H new ATOM 0 HG2 ARG A 91 15.476 36.584 -6.480 1.00 1.00 H new ATOM 0 HG3 ARG A 91 16.758 36.545 -7.675 1.00 1.00 H new ATOM 0 HD2 ARG A 91 16.842 38.898 -7.856 1.00 1.00 H new ATOM 0 HD3 ARG A 91 15.239 39.107 -7.180 1.00 1.00 H new ATOM 0 HE ARG A 91 16.652 37.928 -5.108 1.00 1.00 H new ATOM 0 HH11 ARG A 91 17.227 40.733 -7.187 1.00 1.00 H new ATOM 0 HH12 ARG A 91 18.052 41.644 -5.918 1.00 1.00 H new ATOM 0 HH21 ARG A 91 17.669 39.144 -3.473 1.00 1.00 H new ATOM 0 HH22 ARG A 91 18.300 40.753 -3.837 1.00 1.00 H new ATOM 1359 N ASN A 92 16.115 33.876 -8.870 1.00 1.00 N ATOM 1360 CA ASN A 92 17.088 33.060 -9.575 1.00 1.00 C ATOM 1361 C ASN A 92 16.372 31.902 -10.242 1.00 1.00 C ATOM 1362 O ASN A 92 16.492 31.688 -11.445 1.00 1.00 O ATOM 1363 CB ASN A 92 18.140 32.516 -8.604 1.00 1.00 C ATOM 1364 CG ASN A 92 19.073 33.583 -8.063 1.00 1.00 C ATOM 1365 OD1 ASN A 92 18.702 34.746 -7.916 1.00 1.00 O ATOM 1366 ND2 ASN A 92 20.298 33.189 -7.763 1.00 1.00 N ATOM 0 H ASN A 92 16.122 33.762 -7.856 1.00 1.00 H new ATOM 0 HA ASN A 92 17.589 33.674 -10.323 1.00 1.00 H new ATOM 0 HB2 ASN A 92 17.635 32.029 -7.770 1.00 1.00 H new ATOM 0 HB3 ASN A 92 18.730 31.752 -9.110 1.00 1.00 H new ATOM 0 HD21 ASN A 92 20.974 33.859 -7.395 1.00 1.00 H new ATOM 0 HD22 ASN A 92 20.568 32.215 -7.899 1.00 1.00 H new ATOM 1373 N HIS A 93 15.581 31.191 -9.441 1.00 1.00 N ATOM 1374 CA HIS A 93 14.803 30.062 -9.927 1.00 1.00 C ATOM 1375 C HIS A 93 13.871 30.520 -11.047 1.00 1.00 C ATOM 1376 O HIS A 93 13.785 29.876 -12.086 1.00 1.00 O ATOM 1377 CB HIS A 93 13.986 29.420 -8.792 1.00 1.00 C ATOM 1378 CG HIS A 93 14.768 29.167 -7.532 1.00 1.00 C ATOM 1379 ND1 HIS A 93 14.227 29.311 -6.273 1.00 1.00 N ATOM 1380 CD2 HIS A 93 16.062 28.802 -7.339 1.00 1.00 C ATOM 1381 CE1 HIS A 93 15.149 29.057 -5.365 1.00 1.00 C ATOM 1382 NE2 HIS A 93 16.275 28.746 -5.981 1.00 1.00 N ATOM 0 H HIS A 93 15.464 31.382 -8.446 1.00 1.00 H new ATOM 0 HA HIS A 93 15.493 29.312 -10.312 1.00 1.00 H new ATOM 0 HB2 HIS A 93 13.141 30.067 -8.557 1.00 1.00 H new ATOM 0 HB3 HIS A 93 13.575 28.475 -9.146 1.00 1.00 H new ATOM 0 HD1 HIS A 93 13.262 29.574 -6.074 1.00 1.00 H new ATOM 0 HD2 HIS A 93 16.790 28.594 -8.110 1.00 1.00 H new ATOM 0 HE1 HIS A 93 15.007 29.097 -4.295 1.00 1.00 H new ATOM 1391 N ALA A 94 13.208 31.660 -10.836 1.00 1.00 N ATOM 1392 CA ALA A 94 12.301 32.224 -11.833 1.00 1.00 C ATOM 1393 C ALA A 94 13.037 32.531 -13.132 1.00 1.00 C ATOM 1394 O ALA A 94 12.544 32.226 -14.226 1.00 1.00 O ATOM 1395 CB ALA A 94 11.623 33.477 -11.292 1.00 1.00 C ATOM 0 H ALA A 94 13.284 32.210 -9.980 1.00 1.00 H new ATOM 0 HA ALA A 94 11.533 31.481 -12.049 1.00 1.00 H new ATOM 0 HB1 ALA A 94 10.951 33.883 -12.049 1.00 1.00 H new ATOM 0 HB2 ALA A 94 11.053 33.225 -10.398 1.00 1.00 H new ATOM 0 HB3 ALA A 94 12.379 34.221 -11.042 1.00 1.00 H new ATOM 1401 N ARG A 95 14.218 33.134 -13.004 1.00 1.00 N ATOM 1402 CA ARG A 95 15.045 33.463 -14.155 1.00 1.00 C ATOM 1403 C ARG A 95 15.358 32.222 -14.971 1.00 1.00 C ATOM 1404 O ARG A 95 15.187 32.217 -16.190 1.00 1.00 O ATOM 1405 CB ARG A 95 16.358 34.128 -13.715 1.00 1.00 C ATOM 1406 CG ARG A 95 17.538 33.758 -14.608 1.00 1.00 C ATOM 1407 CD ARG A 95 18.765 34.609 -14.355 1.00 1.00 C ATOM 1408 NE ARG A 95 19.955 34.017 -14.962 1.00 1.00 N ATOM 1409 CZ ARG A 95 20.768 34.648 -15.813 1.00 1.00 C ATOM 1410 NH1 ARG A 95 20.515 35.898 -16.196 1.00 1.00 N ATOM 1411 NH2 ARG A 95 21.841 34.018 -16.276 1.00 1.00 N ATOM 0 H ARG A 95 14.622 33.404 -12.107 1.00 1.00 H new ATOM 0 HA ARG A 95 14.481 34.162 -14.773 1.00 1.00 H new ATOM 0 HB2 ARG A 95 16.231 35.211 -13.720 1.00 1.00 H new ATOM 0 HB3 ARG A 95 16.580 33.837 -12.688 1.00 1.00 H new ATOM 0 HG2 ARG A 95 17.791 32.710 -14.449 1.00 1.00 H new ATOM 0 HG3 ARG A 95 17.242 33.860 -15.652 1.00 1.00 H new ATOM 0 HD2 ARG A 95 18.607 35.609 -14.759 1.00 1.00 H new ATOM 0 HD3 ARG A 95 18.918 34.720 -13.282 1.00 1.00 H new ATOM 0 HE ARG A 95 20.181 33.053 -14.718 1.00 1.00 H new ATOM 0 HH11 ARG A 95 19.693 36.384 -15.839 1.00 1.00 H new ATOM 0 HH12 ARG A 95 21.144 36.369 -16.847 1.00 1.00 H new ATOM 0 HH21 ARG A 95 22.038 33.061 -15.981 1.00 1.00 H new ATOM 0 HH22 ARG A 95 22.469 34.490 -16.926 1.00 1.00 H new ATOM 1425 N LEU A 96 15.721 31.148 -14.284 1.00 1.00 N ATOM 1426 CA LEU A 96 16.144 29.930 -14.951 1.00 1.00 C ATOM 1427 C LEU A 96 15.008 29.351 -15.770 1.00 1.00 C ATOM 1428 O LEU A 96 15.173 29.063 -16.940 1.00 1.00 O ATOM 1429 CB LEU A 96 16.635 28.902 -13.931 1.00 1.00 C ATOM 1430 CG LEU A 96 17.694 29.420 -12.961 1.00 1.00 C ATOM 1431 CD1 LEU A 96 18.162 28.313 -12.032 1.00 1.00 C ATOM 1432 CD2 LEU A 96 18.867 30.020 -13.717 1.00 1.00 C ATOM 0 H LEU A 96 15.730 31.098 -13.265 1.00 1.00 H new ATOM 0 HA LEU A 96 16.967 30.176 -15.621 1.00 1.00 H new ATOM 0 HB2 LEU A 96 15.781 28.543 -13.357 1.00 1.00 H new ATOM 0 HB3 LEU A 96 17.041 28.044 -14.467 1.00 1.00 H new ATOM 0 HG LEU A 96 17.243 30.205 -12.353 1.00 1.00 H new ATOM 0 HD11 LEU A 96 18.916 28.705 -11.350 1.00 1.00 H new ATOM 0 HD12 LEU A 96 17.315 27.937 -11.459 1.00 1.00 H new ATOM 0 HD13 LEU A 96 18.591 27.502 -12.620 1.00 1.00 H new ATOM 0 HD21 LEU A 96 19.610 30.383 -13.007 1.00 1.00 H new ATOM 0 HD22 LEU A 96 19.316 29.259 -14.355 1.00 1.00 H new ATOM 0 HD23 LEU A 96 18.518 30.849 -14.332 1.00 1.00 H new ATOM 1444 N LEU A 97 13.832 29.306 -15.171 1.00 1.00 N ATOM 1445 CA LEU A 97 12.646 28.746 -15.819 1.00 1.00 C ATOM 1446 C LEU A 97 12.382 29.409 -17.167 1.00 1.00 C ATOM 1447 O LEU A 97 12.321 28.746 -18.198 1.00 1.00 O ATOM 1448 CB LEU A 97 11.428 28.956 -14.917 1.00 1.00 C ATOM 1449 CG LEU A 97 11.552 28.392 -13.507 1.00 1.00 C ATOM 1450 CD1 LEU A 97 10.462 28.949 -12.611 1.00 1.00 C ATOM 1451 CD2 LEU A 97 11.481 26.883 -13.541 1.00 1.00 C ATOM 0 H LEU A 97 13.666 29.653 -14.226 1.00 1.00 H new ATOM 0 HA LEU A 97 12.822 27.683 -15.984 1.00 1.00 H new ATOM 0 HB2 LEU A 97 11.230 30.026 -14.846 1.00 1.00 H new ATOM 0 HB3 LEU A 97 10.560 28.503 -15.396 1.00 1.00 H new ATOM 0 HG LEU A 97 12.518 28.690 -13.100 1.00 1.00 H new ATOM 0 HD11 LEU A 97 10.568 28.534 -11.609 1.00 1.00 H new ATOM 0 HD12 LEU A 97 10.548 30.035 -12.565 1.00 1.00 H new ATOM 0 HD13 LEU A 97 9.486 28.679 -13.014 1.00 1.00 H new ATOM 0 HD21 LEU A 97 11.571 26.492 -12.528 1.00 1.00 H new ATOM 0 HD22 LEU A 97 10.526 26.573 -13.966 1.00 1.00 H new ATOM 0 HD23 LEU A 97 12.295 26.494 -14.153 1.00 1.00 H new ATOM 1463 N ARG A 98 12.150 30.712 -17.134 1.00 1.00 N ATOM 1464 CA ARG A 98 11.862 31.479 -18.346 1.00 1.00 C ATOM 1465 C ARG A 98 12.982 31.394 -19.377 1.00 1.00 C ATOM 1466 O ARG A 98 12.714 31.206 -20.564 1.00 1.00 O ATOM 1467 CB ARG A 98 11.559 32.934 -18.002 1.00 1.00 C ATOM 1468 CG ARG A 98 12.671 33.630 -17.251 1.00 1.00 C ATOM 1469 CD ARG A 98 12.133 34.839 -16.512 1.00 1.00 C ATOM 1470 NE ARG A 98 12.229 36.049 -17.326 1.00 1.00 N ATOM 1471 CZ ARG A 98 11.824 37.253 -16.934 1.00 1.00 C ATOM 1472 NH1 ARG A 98 11.256 37.419 -15.746 1.00 1.00 N ATOM 1473 NH2 ARG A 98 11.986 38.293 -17.739 1.00 1.00 N ATOM 0 H ARG A 98 12.155 31.267 -16.278 1.00 1.00 H new ATOM 0 HA ARG A 98 10.980 31.029 -18.801 1.00 1.00 H new ATOM 0 HB2 ARG A 98 11.358 33.481 -18.923 1.00 1.00 H new ATOM 0 HB3 ARG A 98 10.649 32.974 -17.403 1.00 1.00 H new ATOM 0 HG2 ARG A 98 13.130 32.938 -16.544 1.00 1.00 H new ATOM 0 HG3 ARG A 98 13.451 33.939 -17.947 1.00 1.00 H new ATOM 0 HD2 ARG A 98 11.093 34.666 -16.237 1.00 1.00 H new ATOM 0 HD3 ARG A 98 12.689 34.978 -15.585 1.00 1.00 H new ATOM 0 HE ARG A 98 12.634 35.964 -18.258 1.00 1.00 H new ATOM 0 HH11 ARG A 98 11.127 36.619 -15.126 1.00 1.00 H new ATOM 0 HH12 ARG A 98 10.948 38.346 -15.453 1.00 1.00 H new ATOM 0 HH21 ARG A 98 12.419 38.167 -18.654 1.00 1.00 H new ATOM 0 HH22 ARG A 98 11.677 39.219 -17.444 1.00 1.00 H new ATOM 1487 N GLN A 99 14.232 31.540 -18.948 1.00 1.00 N ATOM 1488 CA GLN A 99 15.340 31.447 -19.889 1.00 1.00 C ATOM 1489 C GLN A 99 15.443 30.024 -20.432 1.00 1.00 C ATOM 1490 O GLN A 99 15.975 29.795 -21.518 1.00 1.00 O ATOM 1491 CB GLN A 99 16.669 31.899 -19.266 1.00 1.00 C ATOM 1492 CG GLN A 99 17.138 31.083 -18.077 1.00 1.00 C ATOM 1493 CD GLN A 99 18.622 31.243 -17.803 1.00 1.00 C ATOM 1494 OE1 GLN A 99 19.202 32.297 -18.060 1.00 1.00 O ATOM 1495 NE2 GLN A 99 19.250 30.200 -17.280 1.00 1.00 N ATOM 0 H GLN A 99 14.498 31.719 -17.980 1.00 1.00 H new ATOM 0 HA GLN A 99 15.136 32.128 -20.715 1.00 1.00 H new ATOM 0 HB2 GLN A 99 17.441 31.867 -20.035 1.00 1.00 H new ATOM 0 HB3 GLN A 99 16.571 32.939 -18.956 1.00 1.00 H new ATOM 0 HG2 GLN A 99 16.576 31.382 -17.192 1.00 1.00 H new ATOM 0 HG3 GLN A 99 16.917 30.030 -18.255 1.00 1.00 H new ATOM 0 HE21 GLN A 99 18.735 29.342 -17.080 1.00 1.00 H new ATOM 0 HE22 GLN A 99 20.248 30.255 -17.077 1.00 1.00 H new ATOM 1504 N LEU A 100 14.921 29.075 -19.660 1.00 1.00 N ATOM 1505 CA LEU A 100 14.904 27.673 -20.048 1.00 1.00 C ATOM 1506 C LEU A 100 13.745 27.360 -20.990 1.00 1.00 C ATOM 1507 O LEU A 100 13.715 26.297 -21.611 1.00 1.00 O ATOM 1508 CB LEU A 100 14.829 26.772 -18.810 1.00 1.00 C ATOM 1509 CG LEU A 100 16.138 26.631 -18.021 1.00 1.00 C ATOM 1510 CD1 LEU A 100 16.201 25.288 -17.312 1.00 1.00 C ATOM 1511 CD2 LEU A 100 17.350 26.835 -18.921 1.00 1.00 C ATOM 0 H LEU A 100 14.499 29.259 -18.750 1.00 1.00 H new ATOM 0 HA LEU A 100 15.834 27.474 -20.581 1.00 1.00 H new ATOM 0 HB2 LEU A 100 14.062 27.163 -18.142 1.00 1.00 H new ATOM 0 HB3 LEU A 100 14.504 25.780 -19.122 1.00 1.00 H new ATOM 0 HG LEU A 100 16.157 27.413 -17.262 1.00 1.00 H new ATOM 0 HD11 LEU A 100 17.138 25.212 -16.760 1.00 1.00 H new ATOM 0 HD12 LEU A 100 15.364 25.202 -16.620 1.00 1.00 H new ATOM 0 HD13 LEU A 100 16.147 24.485 -18.048 1.00 1.00 H new ATOM 0 HD21 LEU A 100 18.262 26.729 -18.333 1.00 1.00 H new ATOM 0 HD22 LEU A 100 17.342 26.090 -19.716 1.00 1.00 H new ATOM 0 HD23 LEU A 100 17.314 27.833 -19.359 1.00 1.00 H new ATOM 1523 N GLY A 101 12.787 28.277 -21.096 1.00 1.00 N ATOM 1524 CA GLY A 101 11.661 28.041 -21.972 1.00 1.00 C ATOM 1525 C GLY A 101 10.378 28.722 -21.531 1.00 1.00 C ATOM 1526 O GLY A 101 9.508 28.981 -22.361 1.00 1.00 O ATOM 0 H GLY A 101 12.772 29.166 -20.597 1.00 1.00 H new ATOM 0 HA2 GLY A 101 11.916 28.385 -22.974 1.00 1.00 H new ATOM 0 HA3 GLY A 101 11.485 26.967 -22.039 1.00 1.00 H new ATOM 1530 N VAL A 102 10.222 28.985 -20.231 1.00 1.00 N ATOM 1531 CA VAL A 102 8.988 29.599 -19.744 1.00 1.00 C ATOM 1532 C VAL A 102 8.960 31.112 -20.044 1.00 1.00 C ATOM 1533 O VAL A 102 9.745 31.606 -20.856 1.00 1.00 O ATOM 1534 CB VAL A 102 8.708 29.270 -18.233 1.00 1.00 C ATOM 1535 CG1 VAL A 102 9.107 30.351 -17.251 1.00 1.00 C ATOM 1536 CG2 VAL A 102 7.259 28.870 -18.073 1.00 1.00 C ATOM 0 H VAL A 102 10.918 28.787 -19.512 1.00 1.00 H new ATOM 0 HA VAL A 102 8.162 29.151 -20.297 1.00 1.00 H new ATOM 0 HB VAL A 102 9.361 28.437 -17.971 1.00 1.00 H new ATOM 0 HG11 VAL A 102 8.872 30.026 -16.237 1.00 1.00 H new ATOM 0 HG12 VAL A 102 10.177 30.540 -17.333 1.00 1.00 H new ATOM 0 HG13 VAL A 102 8.559 31.266 -17.475 1.00 1.00 H new ATOM 0 HG21 VAL A 102 7.058 28.640 -17.027 1.00 1.00 H new ATOM 0 HG22 VAL A 102 6.617 29.691 -18.394 1.00 1.00 H new ATOM 0 HG23 VAL A 102 7.055 27.990 -18.683 1.00 1.00 H new ATOM 1546 N GLU A 103 8.111 31.851 -19.355 1.00 1.00 N ATOM 1547 CA GLU A 103 7.970 33.276 -19.569 1.00 1.00 C ATOM 1548 C GLU A 103 7.347 33.872 -18.326 1.00 1.00 C ATOM 1549 O GLU A 103 6.803 33.135 -17.502 1.00 1.00 O ATOM 1550 CB GLU A 103 7.075 33.545 -20.782 1.00 1.00 C ATOM 1551 CG GLU A 103 5.660 33.015 -20.607 1.00 1.00 C ATOM 1552 CD GLU A 103 4.815 33.154 -21.853 1.00 1.00 C ATOM 1553 OE1 GLU A 103 4.232 34.237 -22.061 1.00 1.00 O ATOM 1554 OE2 GLU A 103 4.708 32.172 -22.613 1.00 1.00 O ATOM 0 H GLU A 103 7.499 31.477 -18.630 1.00 1.00 H new ATOM 0 HA GLU A 103 8.944 33.725 -19.761 1.00 1.00 H new ATOM 0 HB2 GLU A 103 7.035 34.619 -20.966 1.00 1.00 H new ATOM 0 HB3 GLU A 103 7.522 33.087 -21.665 1.00 1.00 H new ATOM 0 HG2 GLU A 103 5.705 31.964 -20.321 1.00 1.00 H new ATOM 0 HG3 GLU A 103 5.178 33.548 -19.787 1.00 1.00 H new ATOM 1561 N ALA A 104 7.422 35.187 -18.189 1.00 1.00 N ATOM 1562 CA ALA A 104 6.946 35.858 -16.990 1.00 1.00 C ATOM 1563 C ALA A 104 5.447 35.676 -16.811 1.00 1.00 C ATOM 1564 O ALA A 104 4.918 35.827 -15.707 1.00 1.00 O ATOM 1565 CB ALA A 104 7.310 37.336 -17.011 1.00 1.00 C ATOM 0 H ALA A 104 7.809 35.812 -18.896 1.00 1.00 H new ATOM 0 HA ALA A 104 7.443 35.396 -16.137 1.00 1.00 H new ATOM 0 HB1 ALA A 104 6.942 37.814 -16.103 1.00 1.00 H new ATOM 0 HB2 ALA A 104 8.393 37.443 -17.064 1.00 1.00 H new ATOM 0 HB3 ALA A 104 6.855 37.810 -17.881 1.00 1.00 H new ATOM 1571 N ALA A 105 4.752 35.423 -17.914 1.00 1.00 N ATOM 1572 CA ALA A 105 3.327 35.155 -17.864 1.00 1.00 C ATOM 1573 C ALA A 105 3.050 33.943 -16.983 1.00 1.00 C ATOM 1574 O ALA A 105 2.031 33.883 -16.292 1.00 1.00 O ATOM 1575 CB ALA A 105 2.779 34.932 -19.263 1.00 1.00 C ATOM 0 H ALA A 105 5.155 35.399 -18.851 1.00 1.00 H new ATOM 0 HA ALA A 105 2.825 36.021 -17.433 1.00 1.00 H new ATOM 0 HB1 ALA A 105 1.709 34.732 -19.207 1.00 1.00 H new ATOM 0 HB2 ALA A 105 2.951 35.823 -19.867 1.00 1.00 H new ATOM 0 HB3 ALA A 105 3.284 34.081 -19.720 1.00 1.00 H new ATOM 1581 N ARG A 106 3.977 32.979 -17.016 1.00 1.00 N ATOM 1582 CA ARG A 106 3.831 31.742 -16.265 1.00 1.00 C ATOM 1583 C ARG A 106 4.676 31.752 -15.006 1.00 1.00 C ATOM 1584 O ARG A 106 4.230 31.317 -13.949 1.00 1.00 O ATOM 1585 CB ARG A 106 4.255 30.538 -17.106 1.00 1.00 C ATOM 1586 CG ARG A 106 4.041 30.711 -18.593 1.00 1.00 C ATOM 1587 CD ARG A 106 3.819 29.377 -19.278 1.00 1.00 C ATOM 1588 NE ARG A 106 2.389 29.112 -19.437 1.00 1.00 N ATOM 1589 CZ ARG A 106 1.743 29.125 -20.603 1.00 1.00 C ATOM 1590 NH1 ARG A 106 2.404 29.342 -21.740 1.00 1.00 N ATOM 1591 NH2 ARG A 106 0.428 28.940 -20.633 1.00 1.00 N ATOM 0 H ARG A 106 4.838 33.039 -17.560 1.00 1.00 H new ATOM 0 HA ARG A 106 2.777 31.664 -15.999 1.00 1.00 H new ATOM 0 HB2 ARG A 106 5.311 30.336 -16.924 1.00 1.00 H new ATOM 0 HB3 ARG A 106 3.700 29.662 -16.770 1.00 1.00 H new ATOM 0 HG2 ARG A 106 3.181 31.358 -18.766 1.00 1.00 H new ATOM 0 HG3 ARG A 106 4.907 31.207 -19.032 1.00 1.00 H new ATOM 0 HD2 ARG A 106 4.305 29.378 -20.254 1.00 1.00 H new ATOM 0 HD3 ARG A 106 4.279 28.581 -18.693 1.00 1.00 H new ATOM 0 HE ARG A 106 1.849 28.903 -18.597 1.00 1.00 H new ATOM 0 HH11 ARG A 106 3.412 29.500 -21.722 1.00 1.00 H new ATOM 0 HH12 ARG A 106 1.902 29.350 -22.628 1.00 1.00 H new ATOM 0 HH21 ARG A 106 -0.086 28.788 -19.765 1.00 1.00 H new ATOM 0 HH22 ARG A 106 -0.068 28.950 -21.524 1.00 1.00 H new ATOM 1605 N VAL A 107 5.891 32.275 -15.100 1.00 1.00 N ATOM 1606 CA VAL A 107 6.792 32.234 -13.972 1.00 1.00 C ATOM 1607 C VAL A 107 6.385 33.310 -12.954 1.00 1.00 C ATOM 1608 O VAL A 107 6.244 34.484 -13.298 1.00 1.00 O ATOM 1609 CB VAL A 107 8.269 32.440 -14.399 1.00 1.00 C ATOM 1610 CG1 VAL A 107 8.509 33.845 -14.886 1.00 1.00 C ATOM 1611 CG2 VAL A 107 9.199 32.091 -13.254 1.00 1.00 C ATOM 0 H VAL A 107 6.265 32.725 -15.935 1.00 1.00 H new ATOM 0 HA VAL A 107 6.719 31.245 -13.520 1.00 1.00 H new ATOM 0 HB VAL A 107 8.480 31.769 -15.232 1.00 1.00 H new ATOM 0 HG11 VAL A 107 9.554 33.956 -15.177 1.00 1.00 H new ATOM 0 HG12 VAL A 107 7.869 34.046 -15.745 1.00 1.00 H new ATOM 0 HG13 VAL A 107 8.278 34.551 -14.088 1.00 1.00 H new ATOM 0 HG21 VAL A 107 10.233 32.240 -13.566 1.00 1.00 H new ATOM 0 HG22 VAL A 107 8.982 32.733 -12.400 1.00 1.00 H new ATOM 0 HG23 VAL A 107 9.052 31.049 -12.971 1.00 1.00 H new ATOM 1621 N ARG A 108 6.072 32.899 -11.737 1.00 1.00 N ATOM 1622 CA ARG A 108 5.642 33.841 -10.716 1.00 1.00 C ATOM 1623 C ARG A 108 6.251 33.481 -9.377 1.00 1.00 C ATOM 1624 O ARG A 108 6.433 32.315 -9.061 1.00 1.00 O ATOM 1625 CB ARG A 108 4.115 33.833 -10.576 1.00 1.00 C ATOM 1626 CG ARG A 108 3.361 33.914 -11.892 1.00 1.00 C ATOM 1627 CD ARG A 108 3.317 35.331 -12.424 1.00 1.00 C ATOM 1628 NE ARG A 108 2.312 36.138 -11.723 1.00 1.00 N ATOM 1629 CZ ARG A 108 1.857 37.315 -12.162 1.00 1.00 C ATOM 1630 NH1 ARG A 108 2.378 37.866 -13.254 1.00 1.00 N ATOM 1631 NH2 ARG A 108 0.887 37.945 -11.506 1.00 1.00 N ATOM 0 H ARG A 108 6.107 31.926 -11.432 1.00 1.00 H new ATOM 0 HA ARG A 108 5.974 34.834 -11.021 1.00 1.00 H new ATOM 0 HB2 ARG A 108 3.815 32.923 -10.056 1.00 1.00 H new ATOM 0 HB3 ARG A 108 3.816 34.672 -9.948 1.00 1.00 H new ATOM 0 HG2 ARG A 108 3.838 33.264 -12.626 1.00 1.00 H new ATOM 0 HG3 ARG A 108 2.345 33.545 -11.753 1.00 1.00 H new ATOM 0 HD2 ARG A 108 4.298 35.793 -12.313 1.00 1.00 H new ATOM 0 HD3 ARG A 108 3.092 35.314 -13.490 1.00 1.00 H new ATOM 0 HE ARG A 108 1.937 35.778 -10.845 1.00 1.00 H new ATOM 0 HH11 ARG A 108 3.126 37.390 -13.758 1.00 1.00 H new ATOM 0 HH12 ARG A 108 2.029 38.765 -13.588 1.00 1.00 H new ATOM 0 HH21 ARG A 108 0.487 37.530 -10.664 1.00 1.00 H new ATOM 0 HH22 ARG A 108 0.542 38.843 -11.844 1.00 1.00 H new ATOM 1645 N MET A 109 6.556 34.491 -8.595 1.00 1.00 N ATOM 1646 CA MET A 109 7.121 34.292 -7.270 1.00 1.00 C ATOM 1647 C MET A 109 6.033 33.909 -6.277 1.00 1.00 C ATOM 1648 O MET A 109 4.962 34.507 -6.286 1.00 1.00 O ATOM 1649 CB MET A 109 7.815 35.562 -6.801 1.00 1.00 C ATOM 1650 CG MET A 109 9.038 35.924 -7.619 1.00 1.00 C ATOM 1651 SD MET A 109 10.380 34.758 -7.371 1.00 1.00 S ATOM 1652 CE MET A 109 10.468 34.777 -5.584 1.00 1.00 C ATOM 0 H MET A 109 6.423 35.469 -8.852 1.00 1.00 H new ATOM 0 HA MET A 109 7.849 33.482 -7.326 1.00 1.00 H new ATOM 0 HB2 MET A 109 7.106 36.389 -6.839 1.00 1.00 H new ATOM 0 HB3 MET A 109 8.109 35.441 -5.758 1.00 1.00 H new ATOM 0 HG2 MET A 109 8.772 35.952 -8.676 1.00 1.00 H new ATOM 0 HG3 MET A 109 9.373 36.925 -7.348 1.00 1.00 H new ATOM 0 HE1 MET A 109 11.510 34.721 -5.270 1.00 1.00 H new ATOM 0 HE2 MET A 109 10.025 35.699 -5.208 1.00 1.00 H new ATOM 0 HE3 MET A 109 9.922 33.923 -5.184 1.00 1.00 H new ATOM 1662 N LEU A 110 6.320 32.956 -5.393 1.00 1.00 N ATOM 1663 CA LEU A 110 5.349 32.513 -4.389 1.00 1.00 C ATOM 1664 C LEU A 110 4.877 33.673 -3.519 1.00 1.00 C ATOM 1665 O LEU A 110 3.680 33.913 -3.391 1.00 1.00 O ATOM 1666 CB LEU A 110 5.975 31.405 -3.518 1.00 1.00 C ATOM 1667 CG LEU A 110 5.050 30.719 -2.488 1.00 1.00 C ATOM 1668 CD1 LEU A 110 4.959 31.522 -1.197 1.00 1.00 C ATOM 1669 CD2 LEU A 110 3.660 30.485 -3.070 1.00 1.00 C ATOM 0 H LEU A 110 7.218 32.474 -5.350 1.00 1.00 H new ATOM 0 HA LEU A 110 4.476 32.117 -4.907 1.00 1.00 H new ATOM 0 HB2 LEU A 110 6.373 30.637 -4.181 1.00 1.00 H new ATOM 0 HB3 LEU A 110 6.822 31.833 -2.981 1.00 1.00 H new ATOM 0 HG LEU A 110 5.491 29.751 -2.250 1.00 1.00 H new ATOM 0 HD11 LEU A 110 4.300 31.010 -0.496 1.00 1.00 H new ATOM 0 HD12 LEU A 110 5.952 31.619 -0.758 1.00 1.00 H new ATOM 0 HD13 LEU A 110 4.560 32.513 -1.412 1.00 1.00 H new ATOM 0 HD21 LEU A 110 3.030 30.001 -2.324 1.00 1.00 H new ATOM 0 HD22 LEU A 110 3.219 31.441 -3.353 1.00 1.00 H new ATOM 0 HD23 LEU A 110 3.737 29.846 -3.950 1.00 1.00 H new ATOM 1681 N ARG A 111 5.820 34.432 -2.978 1.00 1.00 N ATOM 1682 CA ARG A 111 5.488 35.536 -2.086 1.00 1.00 C ATOM 1683 C ARG A 111 4.829 36.669 -2.858 1.00 1.00 C ATOM 1684 O ARG A 111 4.164 37.524 -2.282 1.00 1.00 O ATOM 1685 CB ARG A 111 6.737 36.068 -1.387 1.00 1.00 C ATOM 1686 CG ARG A 111 6.414 37.080 -0.305 1.00 1.00 C ATOM 1687 CD ARG A 111 7.618 37.920 0.075 1.00 1.00 C ATOM 1688 NE ARG A 111 7.331 38.759 1.233 1.00 1.00 N ATOM 1689 CZ ARG A 111 8.090 38.792 2.325 1.00 1.00 C ATOM 1690 NH1 ARG A 111 9.198 38.067 2.378 1.00 1.00 N ATOM 1691 NH2 ARG A 111 7.749 39.552 3.357 1.00 1.00 N ATOM 0 H ARG A 111 6.819 34.305 -3.140 1.00 1.00 H new ATOM 0 HA ARG A 111 4.794 35.156 -1.336 1.00 1.00 H new ATOM 0 HB2 ARG A 111 7.286 35.235 -0.948 1.00 1.00 H new ATOM 0 HB3 ARG A 111 7.394 36.528 -2.125 1.00 1.00 H new ATOM 0 HG2 ARG A 111 5.612 37.733 -0.649 1.00 1.00 H new ATOM 0 HG3 ARG A 111 6.044 36.559 0.578 1.00 1.00 H new ATOM 0 HD2 ARG A 111 8.464 37.269 0.295 1.00 1.00 H new ATOM 0 HD3 ARG A 111 7.909 38.546 -0.768 1.00 1.00 H new ATOM 0 HE ARG A 111 6.503 39.353 1.204 1.00 1.00 H new ATOM 0 HH11 ARG A 111 9.466 37.486 1.583 1.00 1.00 H new ATOM 0 HH12 ARG A 111 9.783 38.090 3.213 1.00 1.00 H new ATOM 0 HH21 ARG A 111 6.900 40.116 3.317 1.00 1.00 H new ATOM 0 HH22 ARG A 111 8.336 39.572 4.191 1.00 1.00 H new ATOM 1705 N SER A 112 4.983 36.647 -4.173 1.00 1.00 N ATOM 1706 CA SER A 112 4.430 37.689 -5.006 1.00 1.00 C ATOM 1707 C SER A 112 2.919 37.527 -5.149 1.00 1.00 C ATOM 1708 O SER A 112 2.260 38.393 -5.726 1.00 1.00 O ATOM 1709 CB SER A 112 5.114 37.698 -6.375 1.00 1.00 C ATOM 1710 OG SER A 112 4.652 38.774 -7.174 1.00 1.00 O ATOM 0 H SER A 112 5.486 35.919 -4.680 1.00 1.00 H new ATOM 0 HA SER A 112 4.617 38.649 -4.525 1.00 1.00 H new ATOM 0 HB2 SER A 112 6.193 37.776 -6.244 1.00 1.00 H new ATOM 0 HB3 SER A 112 4.923 36.754 -6.886 1.00 1.00 H new ATOM 0 HG SER A 112 3.703 38.936 -6.988 1.00 1.00 H new ATOM 1716 N PHE A 113 2.364 36.419 -4.653 1.00 1.00 N ATOM 1717 CA PHE A 113 0.925 36.217 -4.671 1.00 1.00 C ATOM 1718 C PHE A 113 0.298 36.758 -3.387 1.00 1.00 C ATOM 1719 O PHE A 113 -0.912 36.977 -3.324 1.00 1.00 O ATOM 1720 CB PHE A 113 0.609 34.722 -4.796 1.00 1.00 C ATOM 1721 CG PHE A 113 0.975 34.113 -6.122 1.00 1.00 C ATOM 1722 CD1 PHE A 113 0.127 34.233 -7.211 1.00 1.00 C ATOM 1723 CD2 PHE A 113 2.154 33.406 -6.273 1.00 1.00 C ATOM 1724 CE1 PHE A 113 0.448 33.659 -8.426 1.00 1.00 C ATOM 1725 CE2 PHE A 113 2.480 32.827 -7.486 1.00 1.00 C ATOM 1726 CZ PHE A 113 1.628 32.955 -8.564 1.00 1.00 C ATOM 0 H PHE A 113 2.893 35.653 -4.236 1.00 1.00 H new ATOM 0 HA PHE A 113 0.511 36.751 -5.526 1.00 1.00 H new ATOM 0 HB2 PHE A 113 1.136 34.186 -4.007 1.00 1.00 H new ATOM 0 HB3 PHE A 113 -0.457 34.574 -4.625 1.00 1.00 H new ATOM 0 HD1 PHE A 113 -0.797 34.782 -7.109 1.00 1.00 H new ATOM 0 HD2 PHE A 113 2.827 33.305 -5.435 1.00 1.00 H new ATOM 0 HE1 PHE A 113 -0.223 33.761 -9.266 1.00 1.00 H new ATOM 0 HE2 PHE A 113 3.402 32.274 -7.590 1.00 1.00 H new ATOM 0 HZ PHE A 113 1.883 32.506 -9.513 1.00 1.00 H new ATOM 1736 N ASP A 114 1.134 36.954 -2.368 1.00 1.00 N ATOM 1737 CA ASP A 114 0.675 37.438 -1.065 1.00 1.00 C ATOM 1738 C ASP A 114 0.196 38.877 -1.162 1.00 1.00 C ATOM 1739 O ASP A 114 0.975 39.778 -1.475 1.00 1.00 O ATOM 1740 CB ASP A 114 1.799 37.343 -0.024 1.00 1.00 C ATOM 1741 CG ASP A 114 1.401 37.895 1.336 1.00 1.00 C ATOM 1742 OD1 ASP A 114 0.198 37.907 1.662 1.00 1.00 O ATOM 1743 OD2 ASP A 114 2.304 38.347 2.073 1.00 1.00 O ATOM 0 H ASP A 114 2.138 36.784 -2.420 1.00 1.00 H new ATOM 0 HA ASP A 114 -0.157 36.807 -0.751 1.00 1.00 H new ATOM 0 HB2 ASP A 114 2.096 36.300 0.087 1.00 1.00 H new ATOM 0 HB3 ASP A 114 2.671 37.886 -0.389 1.00 1.00 H new ATOM 2056 N GLU A 136 7.292 27.000 10.483 1.00 1.00 N ATOM 2057 CA GLU A 136 5.954 27.574 10.510 1.00 1.00 C ATOM 2058 C GLU A 136 5.923 28.944 9.834 1.00 1.00 C ATOM 2059 O GLU A 136 4.871 29.397 9.385 1.00 1.00 O ATOM 2060 CB GLU A 136 5.461 27.660 11.941 1.00 1.00 C ATOM 2061 CG GLU A 136 5.174 26.294 12.521 1.00 1.00 C ATOM 2062 CD GLU A 136 3.768 25.807 12.218 1.00 1.00 C ATOM 2063 OE1 GLU A 136 3.485 25.446 11.060 1.00 1.00 O ATOM 2064 OE2 GLU A 136 2.940 25.769 13.148 1.00 1.00 O ATOM 0 HA GLU A 136 5.286 26.922 9.947 1.00 1.00 H new ATOM 0 HB2 GLU A 136 6.209 28.164 12.553 1.00 1.00 H new ATOM 0 HB3 GLU A 136 4.557 28.267 11.978 1.00 1.00 H new ATOM 0 HG2 GLU A 136 5.894 25.578 12.125 1.00 1.00 H new ATOM 0 HG3 GLU A 136 5.317 26.326 13.601 1.00 1.00 H new ATOM 2071 N GLU A 137 7.074 29.612 9.784 1.00 1.00 N ATOM 2072 CA GLU A 137 7.187 30.884 9.077 1.00 1.00 C ATOM 2073 C GLU A 137 6.923 30.661 7.603 1.00 1.00 C ATOM 2074 O GLU A 137 6.172 31.400 6.971 1.00 1.00 O ATOM 2075 CB GLU A 137 8.577 31.496 9.258 1.00 1.00 C ATOM 2076 CG GLU A 137 8.759 32.802 8.499 1.00 1.00 C ATOM 2077 CD GLU A 137 7.988 33.951 9.120 1.00 1.00 C ATOM 2078 OE1 GLU A 137 8.430 34.469 10.164 1.00 1.00 O ATOM 2079 OE2 GLU A 137 6.939 34.343 8.571 1.00 1.00 O ATOM 0 H GLU A 137 7.938 29.294 10.223 1.00 1.00 H new ATOM 0 HA GLU A 137 6.453 31.575 9.491 1.00 1.00 H new ATOM 0 HB2 GLU A 137 8.754 31.672 10.319 1.00 1.00 H new ATOM 0 HB3 GLU A 137 9.328 30.781 8.923 1.00 1.00 H new ATOM 0 HG2 GLU A 137 9.819 33.055 8.468 1.00 1.00 H new ATOM 0 HG3 GLU A 137 8.434 32.667 7.468 1.00 1.00 H new ATOM 2086 N VAL A 138 7.557 29.640 7.056 1.00 1.00 N ATOM 2087 CA VAL A 138 7.345 29.281 5.667 1.00 1.00 C ATOM 2088 C VAL A 138 5.888 28.875 5.469 1.00 1.00 C ATOM 2089 O VAL A 138 5.268 29.178 4.452 1.00 1.00 O ATOM 2090 CB VAL A 138 8.269 28.126 5.249 1.00 1.00 C ATOM 2091 CG1 VAL A 138 8.014 27.705 3.817 1.00 1.00 C ATOM 2092 CG2 VAL A 138 9.730 28.499 5.459 1.00 1.00 C ATOM 0 H VAL A 138 8.222 29.046 7.552 1.00 1.00 H new ATOM 0 HA VAL A 138 7.578 30.144 5.044 1.00 1.00 H new ATOM 0 HB VAL A 138 8.043 27.271 5.886 1.00 1.00 H new ATOM 0 HG11 VAL A 138 8.684 26.887 3.554 1.00 1.00 H new ATOM 0 HG12 VAL A 138 6.980 27.375 3.713 1.00 1.00 H new ATOM 0 HG13 VAL A 138 8.194 28.550 3.152 1.00 1.00 H new ATOM 0 HG21 VAL A 138 10.365 27.666 5.156 1.00 1.00 H new ATOM 0 HG22 VAL A 138 9.971 29.376 4.859 1.00 1.00 H new ATOM 0 HG23 VAL A 138 9.901 28.722 6.512 1.00 1.00 H new ATOM 2102 N PHE A 139 5.362 28.157 6.437 1.00 1.00 N ATOM 2103 CA PHE A 139 3.957 27.785 6.418 1.00 1.00 C ATOM 2104 C PHE A 139 3.098 29.044 6.314 1.00 1.00 C ATOM 2105 O PHE A 139 2.164 29.116 5.511 1.00 1.00 O ATOM 2106 CB PHE A 139 3.586 26.973 7.663 1.00 1.00 C ATOM 2107 CG PHE A 139 2.147 26.545 7.692 1.00 1.00 C ATOM 2108 CD1 PHE A 139 1.169 27.378 8.217 1.00 1.00 C ATOM 2109 CD2 PHE A 139 1.772 25.309 7.195 1.00 1.00 C ATOM 2110 CE1 PHE A 139 -0.154 26.985 8.241 1.00 1.00 C ATOM 2111 CE2 PHE A 139 0.450 24.910 7.217 1.00 1.00 C ATOM 2112 CZ PHE A 139 -0.514 25.749 7.742 1.00 1.00 C ATOM 0 H PHE A 139 5.881 27.818 7.247 1.00 1.00 H new ATOM 0 HA PHE A 139 3.771 27.154 5.549 1.00 1.00 H new ATOM 0 HB2 PHE A 139 4.221 26.088 7.713 1.00 1.00 H new ATOM 0 HB3 PHE A 139 3.798 27.568 8.551 1.00 1.00 H new ATOM 0 HD1 PHE A 139 1.446 28.345 8.611 1.00 1.00 H new ATOM 0 HD2 PHE A 139 2.522 24.649 6.785 1.00 1.00 H new ATOM 0 HE1 PHE A 139 -0.906 27.643 8.649 1.00 1.00 H new ATOM 0 HE2 PHE A 139 0.170 23.944 6.824 1.00 1.00 H new ATOM 0 HZ PHE A 139 -1.548 25.438 7.762 1.00 1.00 H new ATOM 2122 N ALA A 140 3.494 30.059 7.073 1.00 1.00 N ATOM 2123 CA ALA A 140 2.807 31.342 7.095 1.00 1.00 C ATOM 2124 C ALA A 140 2.948 32.068 5.765 1.00 1.00 C ATOM 2125 O ALA A 140 1.965 32.546 5.207 1.00 1.00 O ATOM 2126 CB ALA A 140 3.358 32.215 8.206 1.00 1.00 C ATOM 0 H ALA A 140 4.303 30.014 7.692 1.00 1.00 H new ATOM 0 HA ALA A 140 1.750 31.147 7.273 1.00 1.00 H new ATOM 0 HB1 ALA A 140 2.835 33.171 8.211 1.00 1.00 H new ATOM 0 HB2 ALA A 140 3.213 31.718 9.165 1.00 1.00 H new ATOM 0 HB3 ALA A 140 4.422 32.384 8.042 1.00 1.00 H new ATOM 2132 N VAL A 141 4.177 32.158 5.262 1.00 1.00 N ATOM 2133 CA VAL A 141 4.432 32.861 4.008 1.00 1.00 C ATOM 2134 C VAL A 141 3.623 32.249 2.871 1.00 1.00 C ATOM 2135 O VAL A 141 3.003 32.953 2.071 1.00 1.00 O ATOM 2136 CB VAL A 141 5.949 32.900 3.645 1.00 1.00 C ATOM 2137 CG1 VAL A 141 6.618 31.548 3.694 1.00 1.00 C ATOM 2138 CG2 VAL A 141 6.174 33.540 2.282 1.00 1.00 C ATOM 0 H VAL A 141 5.006 31.756 5.700 1.00 1.00 H new ATOM 0 HA VAL A 141 4.111 33.893 4.152 1.00 1.00 H new ATOM 0 HB VAL A 141 6.416 33.513 4.416 1.00 1.00 H new ATOM 0 HG11 VAL A 141 7.670 31.653 3.430 1.00 1.00 H new ATOM 0 HG12 VAL A 141 6.535 31.137 4.700 1.00 1.00 H new ATOM 0 HG13 VAL A 141 6.132 30.876 2.987 1.00 1.00 H new ATOM 0 HG21 VAL A 141 7.241 33.553 2.058 1.00 1.00 H new ATOM 0 HG22 VAL A 141 5.649 32.965 1.519 1.00 1.00 H new ATOM 0 HG23 VAL A 141 5.793 34.561 2.292 1.00 1.00 H new ATOM 2148 N ILE A 142 3.554 30.938 2.877 1.00 1.00 N ATOM 2149 CA ILE A 142 2.789 30.210 1.875 1.00 1.00 C ATOM 2150 C ILE A 142 1.286 30.394 2.051 1.00 1.00 C ATOM 2151 O ILE A 142 0.587 30.705 1.091 1.00 1.00 O ATOM 2152 CB ILE A 142 3.121 28.714 1.900 1.00 1.00 C ATOM 2153 CG1 ILE A 142 4.526 28.501 1.361 1.00 1.00 C ATOM 2154 CG2 ILE A 142 2.110 27.917 1.082 1.00 1.00 C ATOM 2155 CD1 ILE A 142 5.234 27.338 1.992 1.00 1.00 C ATOM 0 H ILE A 142 4.019 30.346 3.565 1.00 1.00 H new ATOM 0 HA ILE A 142 3.076 30.628 0.910 1.00 1.00 H new ATOM 0 HB ILE A 142 3.070 28.358 2.929 1.00 1.00 H new ATOM 0 HG12 ILE A 142 4.474 28.345 0.283 1.00 1.00 H new ATOM 0 HG13 ILE A 142 5.111 29.406 1.524 1.00 1.00 H new ATOM 0 HG21 ILE A 142 2.368 26.859 1.116 1.00 1.00 H new ATOM 0 HG22 ILE A 142 1.112 28.061 1.497 1.00 1.00 H new ATOM 0 HG23 ILE A 142 2.126 28.261 0.048 1.00 1.00 H new ATOM 0 HD11 ILE A 142 6.231 27.242 1.562 1.00 1.00 H new ATOM 0 HD12 ILE A 142 5.316 27.502 3.067 1.00 1.00 H new ATOM 0 HD13 ILE A 142 4.670 26.424 1.806 1.00 1.00 H new ATOM 2167 N GLU A 143 0.789 30.160 3.261 1.00 1.00 N ATOM 2168 CA GLU A 143 -0.645 30.320 3.542 1.00 1.00 C ATOM 2169 C GLU A 143 -1.104 31.725 3.166 1.00 1.00 C ATOM 2170 O GLU A 143 -2.256 31.942 2.785 1.00 1.00 O ATOM 2171 CB GLU A 143 -0.961 30.038 5.015 1.00 1.00 C ATOM 2172 CG GLU A 143 -0.640 31.187 5.960 1.00 1.00 C ATOM 2173 CD GLU A 143 -1.060 30.902 7.388 1.00 1.00 C ATOM 2174 OE1 GLU A 143 -2.248 30.574 7.605 1.00 1.00 O ATOM 2175 OE2 GLU A 143 -0.216 31.027 8.299 1.00 1.00 O ATOM 0 H GLU A 143 1.347 29.861 4.061 1.00 1.00 H new ATOM 0 HA GLU A 143 -1.187 29.593 2.937 1.00 1.00 H new ATOM 0 HB2 GLU A 143 -2.019 29.794 5.106 1.00 1.00 H new ATOM 0 HB3 GLU A 143 -0.402 29.157 5.331 1.00 1.00 H new ATOM 0 HG2 GLU A 143 0.431 31.386 5.933 1.00 1.00 H new ATOM 0 HG3 GLU A 143 -1.141 32.090 5.611 1.00 1.00 H new ATOM 2182 N SER A 144 -0.187 32.669 3.298 1.00 1.00 N ATOM 2183 CA SER A 144 -0.435 34.061 2.969 1.00 1.00 C ATOM 2184 C SER A 144 -0.450 34.257 1.457 1.00 1.00 C ATOM 2185 O SER A 144 -1.081 35.174 0.943 1.00 1.00 O ATOM 2186 CB SER A 144 0.626 34.934 3.622 1.00 1.00 C ATOM 2187 OG SER A 144 0.577 34.811 5.035 1.00 1.00 O ATOM 0 H SER A 144 0.757 32.489 3.639 1.00 1.00 H new ATOM 0 HA SER A 144 -1.413 34.353 3.352 1.00 1.00 H new ATOM 0 HB2 SER A 144 1.613 34.646 3.261 1.00 1.00 H new ATOM 0 HB3 SER A 144 0.473 35.975 3.337 1.00 1.00 H new ATOM 0 HG SER A 144 0.969 33.953 5.302 1.00 1.00 H new ATOM 2193 N ALA A 145 0.276 33.402 0.754 1.00 1.00 N ATOM 2194 CA ALA A 145 0.320 33.451 -0.698 1.00 1.00 C ATOM 2195 C ALA A 145 -0.811 32.667 -1.318 1.00 1.00 C ATOM 2196 O ALA A 145 -1.193 32.929 -2.455 1.00 1.00 O ATOM 2197 CB ALA A 145 1.630 32.916 -1.240 1.00 1.00 C ATOM 0 H ALA A 145 0.845 32.663 1.168 1.00 1.00 H new ATOM 0 HA ALA A 145 0.221 34.503 -0.966 1.00 1.00 H new ATOM 0 HB1 ALA A 145 1.623 32.970 -2.329 1.00 1.00 H new ATOM 0 HB2 ALA A 145 2.455 33.514 -0.853 1.00 1.00 H new ATOM 0 HB3 ALA A 145 1.756 31.879 -0.929 1.00 1.00 H new ATOM 2203 N LEU A 146 -1.342 31.686 -0.599 1.00 1.00 N ATOM 2204 CA LEU A 146 -2.407 30.852 -1.130 1.00 1.00 C ATOM 2205 C LEU A 146 -3.627 31.679 -1.600 1.00 1.00 C ATOM 2206 O LEU A 146 -4.212 31.351 -2.628 1.00 1.00 O ATOM 2207 CB LEU A 146 -2.825 29.783 -0.109 1.00 1.00 C ATOM 2208 CG LEU A 146 -1.705 28.831 0.333 1.00 1.00 C ATOM 2209 CD1 LEU A 146 -2.287 27.576 0.964 1.00 1.00 C ATOM 2210 CD2 LEU A 146 -0.810 28.463 -0.839 1.00 1.00 C ATOM 0 H LEU A 146 -1.052 31.451 0.350 1.00 1.00 H new ATOM 0 HA LEU A 146 -2.009 30.351 -2.012 1.00 1.00 H new ATOM 0 HB2 LEU A 146 -3.225 30.282 0.773 1.00 1.00 H new ATOM 0 HB3 LEU A 146 -3.635 29.192 -0.536 1.00 1.00 H new ATOM 0 HG LEU A 146 -1.100 29.348 1.078 1.00 1.00 H new ATOM 0 HD11 LEU A 146 -1.477 26.914 1.271 1.00 1.00 H new ATOM 0 HD12 LEU A 146 -2.882 27.849 1.835 1.00 1.00 H new ATOM 0 HD13 LEU A 146 -2.919 27.064 0.239 1.00 1.00 H new ATOM 0 HD21 LEU A 146 -0.025 27.788 -0.499 1.00 1.00 H new ATOM 0 HD22 LEU A 146 -1.403 27.971 -1.609 1.00 1.00 H new ATOM 0 HD23 LEU A 146 -0.359 29.366 -1.250 1.00 1.00 H new ATOM 2222 N PRO A 147 -4.009 32.783 -0.898 1.00 1.00 N ATOM 2223 CA PRO A 147 -5.128 33.648 -1.326 1.00 1.00 C ATOM 2224 C PRO A 147 -4.813 34.386 -2.626 1.00 1.00 C ATOM 2225 O PRO A 147 -5.710 34.861 -3.322 1.00 1.00 O ATOM 2226 CB PRO A 147 -5.271 34.657 -0.182 1.00 1.00 C ATOM 2227 CG PRO A 147 -3.940 34.672 0.471 1.00 1.00 C ATOM 2228 CD PRO A 147 -3.411 33.278 0.352 1.00 1.00 C ATOM 0 HA PRO A 147 -6.032 33.070 -1.519 1.00 1.00 H new ATOM 0 HB2 PRO A 147 -5.540 35.645 -0.556 1.00 1.00 H new ATOM 0 HB3 PRO A 147 -6.052 34.357 0.516 1.00 1.00 H new ATOM 0 HG2 PRO A 147 -3.274 35.385 -0.015 1.00 1.00 H new ATOM 0 HG3 PRO A 147 -4.021 34.972 1.516 1.00 1.00 H new ATOM 0 HD2 PRO A 147 -2.322 33.266 0.307 1.00 1.00 H new ATOM 0 HD3 PRO A 147 -3.702 32.665 1.205 1.00 1.00 H new ATOM 2236 N GLY A 148 -3.539 34.370 -2.986 1.00 1.00 N ATOM 2237 CA GLY A 148 -3.099 35.029 -4.196 1.00 1.00 C ATOM 2238 C GLY A 148 -2.825 34.019 -5.285 1.00 1.00 C ATOM 2239 O GLY A 148 -3.135 34.244 -6.457 1.00 1.00 O ATOM 0 H GLY A 148 -2.798 33.909 -2.458 1.00 1.00 H new ATOM 0 HA2 GLY A 148 -3.861 35.733 -4.530 1.00 1.00 H new ATOM 0 HA3 GLY A 148 -2.197 35.607 -3.994 1.00 1.00 H new ATOM 2243 N LEU A 149 -2.339 32.856 -4.865 1.00 1.00 N ATOM 2244 CA LEU A 149 -2.030 31.773 -5.780 1.00 1.00 C ATOM 2245 C LEU A 149 -3.335 31.146 -6.262 1.00 1.00 C ATOM 2246 O LEU A 149 -3.497 30.839 -7.441 1.00 1.00 O ATOM 2247 CB LEU A 149 -1.130 30.730 -5.088 1.00 1.00 C ATOM 2248 CG LEU A 149 0.112 30.328 -5.874 1.00 1.00 C ATOM 2249 CD1 LEU A 149 0.731 29.071 -5.301 1.00 1.00 C ATOM 2250 CD2 LEU A 149 -0.232 30.117 -7.325 1.00 1.00 C ATOM 0 H LEU A 149 -2.150 32.642 -3.886 1.00 1.00 H new ATOM 0 HA LEU A 149 -1.484 32.158 -6.641 1.00 1.00 H new ATOM 0 HB2 LEU A 149 -0.818 31.126 -4.122 1.00 1.00 H new ATOM 0 HB3 LEU A 149 -1.721 29.836 -4.890 1.00 1.00 H new ATOM 0 HG LEU A 149 0.838 31.137 -5.795 1.00 1.00 H new ATOM 0 HD11 LEU A 149 1.616 28.805 -5.879 1.00 1.00 H new ATOM 0 HD12 LEU A 149 1.015 29.246 -4.263 1.00 1.00 H new ATOM 0 HD13 LEU A 149 0.009 28.256 -5.347 1.00 1.00 H new ATOM 0 HD21 LEU A 149 0.665 29.830 -7.874 1.00 1.00 H new ATOM 0 HD22 LEU A 149 -0.978 29.327 -7.411 1.00 1.00 H new ATOM 0 HD23 LEU A 149 -0.633 31.041 -7.742 1.00 1.00 H new ATOM 2262 N HIS A 150 -4.270 30.998 -5.326 1.00 1.00 N ATOM 2263 CA HIS A 150 -5.610 30.502 -5.627 1.00 1.00 C ATOM 2264 C HIS A 150 -6.243 31.305 -6.739 1.00 1.00 C ATOM 2265 O HIS A 150 -6.549 30.784 -7.803 1.00 1.00 O ATOM 2266 CB HIS A 150 -6.511 30.650 -4.417 1.00 1.00 C ATOM 2267 CG HIS A 150 -7.048 29.369 -3.913 1.00 1.00 C ATOM 2268 ND1 HIS A 150 -8.104 28.702 -4.487 1.00 1.00 N ATOM 2269 CD2 HIS A 150 -6.673 28.651 -2.848 1.00 1.00 C ATOM 2270 CE1 HIS A 150 -8.361 27.620 -3.779 1.00 1.00 C ATOM 2271 NE2 HIS A 150 -7.503 27.560 -2.768 1.00 1.00 N ATOM 0 H HIS A 150 -4.121 31.218 -4.341 1.00 1.00 H new ATOM 0 HA HIS A 150 -5.507 29.456 -5.917 1.00 1.00 H new ATOM 0 HB2 HIS A 150 -5.953 31.139 -3.618 1.00 1.00 H new ATOM 0 HB3 HIS A 150 -7.343 31.306 -4.673 1.00 1.00 H new ATOM 0 HD1 HIS A 150 -8.607 28.996 -5.324 1.00 1.00 H new ATOM 0 HD2 HIS A 150 -5.864 28.887 -2.173 1.00 1.00 H new ATOM 0 HE1 HIS A 150 -9.140 26.902 -3.987 1.00 1.00 H new ATOM 2280 N ASP A 151 -6.325 32.602 -6.506 1.00 1.00 N ATOM 2281 CA ASP A 151 -7.005 33.510 -7.416 1.00 1.00 C ATOM 2282 C ASP A 151 -6.415 33.429 -8.807 1.00 1.00 C ATOM 2283 O ASP A 151 -7.139 33.416 -9.801 1.00 1.00 O ATOM 2284 CB ASP A 151 -6.891 34.937 -6.890 1.00 1.00 C ATOM 2285 CG ASP A 151 -7.887 35.881 -7.531 1.00 1.00 C ATOM 2286 OD1 ASP A 151 -9.068 35.857 -7.135 1.00 1.00 O ATOM 2287 OD2 ASP A 151 -7.490 36.668 -8.415 1.00 1.00 O ATOM 0 H ASP A 151 -5.925 33.056 -5.685 1.00 1.00 H new ATOM 0 HA ASP A 151 -8.054 33.220 -7.474 1.00 1.00 H new ATOM 0 HB2 ASP A 151 -7.043 34.935 -5.811 1.00 1.00 H new ATOM 0 HB3 ASP A 151 -5.881 35.306 -7.069 1.00 1.00 H new ATOM 2292 N TRP A 152 -5.098 33.326 -8.854 1.00 1.00 N ATOM 2293 CA TRP A 152 -4.377 33.241 -10.107 1.00 1.00 C ATOM 2294 C TRP A 152 -4.762 31.980 -10.861 1.00 1.00 C ATOM 2295 O TRP A 152 -5.255 32.051 -11.985 1.00 1.00 O ATOM 2296 CB TRP A 152 -2.873 33.255 -9.836 1.00 1.00 C ATOM 2297 CG TRP A 152 -2.034 33.446 -11.065 1.00 1.00 C ATOM 2298 CD1 TRP A 152 -1.402 34.593 -11.448 1.00 1.00 C ATOM 2299 CD2 TRP A 152 -1.739 32.470 -12.075 1.00 1.00 C ATOM 2300 NE1 TRP A 152 -0.721 34.385 -12.623 1.00 1.00 N ATOM 2301 CE2 TRP A 152 -0.918 33.093 -13.027 1.00 1.00 C ATOM 2302 CE3 TRP A 152 -2.086 31.127 -12.266 1.00 1.00 C ATOM 2303 CZ2 TRP A 152 -0.441 32.425 -14.148 1.00 1.00 C ATOM 2304 CZ3 TRP A 152 -1.612 30.466 -13.382 1.00 1.00 C ATOM 2305 CH2 TRP A 152 -0.796 31.118 -14.310 1.00 1.00 C ATOM 0 H TRP A 152 -4.502 33.299 -8.026 1.00 1.00 H new ATOM 0 HA TRP A 152 -4.640 34.101 -10.723 1.00 1.00 H new ATOM 0 HB2 TRP A 152 -2.649 34.053 -9.128 1.00 1.00 H new ATOM 0 HB3 TRP A 152 -2.591 32.317 -9.358 1.00 1.00 H new ATOM 0 HD1 TRP A 152 -1.433 35.527 -10.907 1.00 1.00 H new ATOM 0 HE1 TRP A 152 -0.160 35.081 -13.114 1.00 1.00 H new ATOM 0 HE3 TRP A 152 -2.715 30.616 -11.552 1.00 1.00 H new ATOM 0 HZ2 TRP A 152 0.190 32.924 -14.868 1.00 1.00 H new ATOM 0 HZ3 TRP A 152 -1.876 29.431 -13.540 1.00 1.00 H new ATOM 0 HH2 TRP A 152 -0.439 30.576 -15.173 1.00 1.00 H new ATOM 2316 N VAL A 153 -4.565 30.829 -10.230 1.00 1.00 N ATOM 2317 CA VAL A 153 -4.858 29.559 -10.884 1.00 1.00 C ATOM 2318 C VAL A 153 -6.337 29.483 -11.255 1.00 1.00 C ATOM 2319 O VAL A 153 -6.676 29.073 -12.366 1.00 1.00 O ATOM 2320 CB VAL A 153 -4.437 28.342 -10.020 1.00 1.00 C ATOM 2321 CG1 VAL A 153 -3.007 28.515 -9.537 1.00 1.00 C ATOM 2322 CG2 VAL A 153 -5.367 28.125 -8.837 1.00 1.00 C ATOM 0 H VAL A 153 -4.208 30.748 -9.278 1.00 1.00 H new ATOM 0 HA VAL A 153 -4.264 29.515 -11.797 1.00 1.00 H new ATOM 0 HB VAL A 153 -4.505 27.456 -10.651 1.00 1.00 H new ATOM 0 HG11 VAL A 153 -2.721 27.655 -8.931 1.00 1.00 H new ATOM 0 HG12 VAL A 153 -2.340 28.592 -10.395 1.00 1.00 H new ATOM 0 HG13 VAL A 153 -2.933 29.422 -8.937 1.00 1.00 H new ATOM 0 HG21 VAL A 153 -5.030 27.262 -8.263 1.00 1.00 H new ATOM 0 HG22 VAL A 153 -5.358 29.010 -8.200 1.00 1.00 H new ATOM 0 HG23 VAL A 153 -6.380 27.948 -9.198 1.00 1.00 H new ATOM 2332 N ASP A 154 -7.205 29.960 -10.358 1.00 1.00 N ATOM 2333 CA ASP A 154 -8.641 29.971 -10.606 1.00 1.00 C ATOM 2334 C ASP A 154 -8.978 30.829 -11.831 1.00 1.00 C ATOM 2335 O ASP A 154 -9.683 30.385 -12.738 1.00 1.00 O ATOM 2336 CB ASP A 154 -9.413 30.475 -9.372 1.00 1.00 C ATOM 2337 CG ASP A 154 -9.647 29.399 -8.314 1.00 1.00 C ATOM 2338 OD1 ASP A 154 -10.496 28.516 -8.550 1.00 1.00 O ATOM 2339 OD2 ASP A 154 -9.003 29.448 -7.235 1.00 1.00 O ATOM 0 H ASP A 154 -6.933 30.343 -9.453 1.00 1.00 H new ATOM 0 HA ASP A 154 -8.949 28.945 -10.807 1.00 1.00 H new ATOM 0 HB2 ASP A 154 -8.862 31.301 -8.922 1.00 1.00 H new ATOM 0 HB3 ASP A 154 -10.376 30.872 -9.694 1.00 1.00 H new ATOM 2344 N GLU A 155 -8.440 32.048 -11.861 1.00 1.00 N ATOM 2345 CA GLU A 155 -8.705 32.984 -12.958 1.00 1.00 C ATOM 2346 C GLU A 155 -8.168 32.432 -14.274 1.00 1.00 C ATOM 2347 O GLU A 155 -8.837 32.482 -15.303 1.00 1.00 O ATOM 2348 CB GLU A 155 -8.088 34.369 -12.685 1.00 1.00 C ATOM 2349 CG GLU A 155 -6.649 34.518 -13.167 1.00 1.00 C ATOM 2350 CD GLU A 155 -6.098 35.919 -13.001 1.00 1.00 C ATOM 2351 OE1 GLU A 155 -6.828 36.788 -12.464 1.00 1.00 O ATOM 2352 OE2 GLU A 155 -4.926 36.155 -13.363 1.00 1.00 O ATOM 0 H GLU A 155 -7.818 32.412 -11.139 1.00 1.00 H new ATOM 0 HA GLU A 155 -9.786 33.101 -13.030 1.00 1.00 H new ATOM 0 HB2 GLU A 155 -8.702 35.129 -13.168 1.00 1.00 H new ATOM 0 HB3 GLU A 155 -8.123 34.565 -11.613 1.00 1.00 H new ATOM 0 HG2 GLU A 155 -6.016 33.820 -12.619 1.00 1.00 H new ATOM 0 HG3 GLU A 155 -6.596 34.237 -14.219 1.00 1.00 H new ATOM 2359 N ARG A 156 -7.001 31.810 -14.198 1.00 1.00 N ATOM 2360 CA ARG A 156 -6.338 31.304 -15.378 1.00 1.00 C ATOM 2361 C ARG A 156 -7.064 30.099 -15.927 1.00 1.00 C ATOM 2362 O ARG A 156 -7.360 30.044 -17.116 1.00 1.00 O ATOM 2363 CB ARG A 156 -4.891 30.964 -15.072 1.00 1.00 C ATOM 2364 CG ARG A 156 -4.028 32.189 -14.855 1.00 1.00 C ATOM 2365 CD ARG A 156 -4.268 33.214 -15.937 1.00 1.00 C ATOM 2366 NE ARG A 156 -3.407 34.383 -15.785 1.00 1.00 N ATOM 2367 CZ ARG A 156 -2.183 34.484 -16.304 1.00 1.00 C ATOM 2368 NH1 ARG A 156 -1.655 33.473 -16.994 1.00 1.00 N ATOM 2369 NH2 ARG A 156 -1.480 35.597 -16.120 1.00 1.00 N ATOM 0 H ARG A 156 -6.497 31.646 -13.327 1.00 1.00 H new ATOM 0 HA ARG A 156 -6.354 32.085 -16.139 1.00 1.00 H new ATOM 0 HB2 ARG A 156 -4.852 30.336 -14.182 1.00 1.00 H new ATOM 0 HB3 ARG A 156 -4.480 30.378 -15.894 1.00 1.00 H new ATOM 0 HG2 ARG A 156 -4.247 32.625 -13.880 1.00 1.00 H new ATOM 0 HG3 ARG A 156 -2.977 31.902 -14.847 1.00 1.00 H new ATOM 0 HD2 ARG A 156 -4.093 32.759 -16.912 1.00 1.00 H new ATOM 0 HD3 ARG A 156 -5.312 33.527 -15.914 1.00 1.00 H new ATOM 0 HE ARG A 156 -3.765 35.173 -15.248 1.00 1.00 H new ATOM 0 HH11 ARG A 156 -2.188 32.614 -17.128 1.00 1.00 H new ATOM 0 HH12 ARG A 156 -0.718 33.559 -17.388 1.00 1.00 H new ATOM 0 HH21 ARG A 156 -1.877 36.368 -15.584 1.00 1.00 H new ATOM 0 HH22 ARG A 156 -0.543 35.680 -16.515 1.00 1.00 H new ATOM 2383 N LEU A 157 -7.410 29.170 -15.047 1.00 1.00 N ATOM 2384 CA LEU A 157 -8.102 27.958 -15.466 1.00 1.00 C ATOM 2385 C LEU A 157 -9.465 28.311 -16.039 1.00 1.00 C ATOM 2386 O LEU A 157 -10.014 27.589 -16.867 1.00 1.00 O ATOM 2387 CB LEU A 157 -8.206 26.938 -14.309 1.00 1.00 C ATOM 2388 CG LEU A 157 -9.085 27.304 -13.102 1.00 1.00 C ATOM 2389 CD1 LEU A 157 -10.559 27.047 -13.383 1.00 1.00 C ATOM 2390 CD2 LEU A 157 -8.642 26.512 -11.883 1.00 1.00 C ATOM 0 H LEU A 157 -7.225 29.230 -14.046 1.00 1.00 H new ATOM 0 HA LEU A 157 -7.519 27.476 -16.251 1.00 1.00 H new ATOM 0 HB2 LEU A 157 -8.579 26.001 -14.722 1.00 1.00 H new ATOM 0 HB3 LEU A 157 -7.198 26.745 -13.942 1.00 1.00 H new ATOM 0 HG LEU A 157 -8.964 28.370 -12.910 1.00 1.00 H new ATOM 0 HD11 LEU A 157 -11.149 27.317 -12.507 1.00 1.00 H new ATOM 0 HD12 LEU A 157 -10.877 27.648 -14.235 1.00 1.00 H new ATOM 0 HD13 LEU A 157 -10.708 25.991 -13.609 1.00 1.00 H new ATOM 0 HD21 LEU A 157 -9.268 26.775 -11.031 1.00 1.00 H new ATOM 0 HD22 LEU A 157 -8.737 25.446 -12.088 1.00 1.00 H new ATOM 0 HD23 LEU A 157 -7.602 26.746 -11.655 1.00 1.00 H new