USER MOD reduce.3.24.130724 H: found=0, std=0, add=1112, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1112 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 83 HIS :FLIP no HE2:sc= 0.182 F(o=-0.61,f=-0.058) USER MOD Set 1.2: A 86 THR OG1 : rot 180:sc= -0.414 USER MOD Set 1.3: A 91 SER OG : rot 133:sc= 0.174 USER MOD Set 2.1: A 9 MET CE :methyl -157:sc= -0.205 (180deg=-1.59) USER MOD Set 2.2: A 118 CYS SG : rot -150:sc= 0 USER MOD Single : A 1 MET CE :methyl 136:sc= -0.203 (180deg=-0.953) USER MOD Single : A 1 MET N :NH3+ -179:sc= 2.42 (180deg=2.34) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 167:sc= -3.27! USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 GLN : amide:sc= -0.196 K(o=-0.2,f=-1.1) USER MOD Single : A 12 MET CE :methyl -179:sc= -2.07 (180deg=-2.09) USER MOD Single : A 15 HIS : no HD1:sc= -1.8! X(o=-1.8!,f=-2.1) USER MOD Single : A 18 GLN :FLIP amide:sc= 0 F(o=-0.58,f=0) USER MOD Single : A 22 ASN : amide:sc= 0.268 X(o=0.27,f=-0.068) USER MOD Single : A 25 CYS SG : rot 31:sc= -0.169 USER MOD Single : A 43 TYR OH : rot -149:sc= 1.72 USER MOD Single : A 46 ASN : amide:sc= -0.0707 K(o=-0.071,f=-1.7) USER MOD Single : A 47 ASN : amide:sc= 1.12 K(o=1.1,f=-7.6!) USER MOD Single : A 50 GLN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 51 SER OG : rot 69:sc= 1.27 USER MOD Single : A 54 HIS : no HD1:sc= -0.224 X(o=-0.22,f=0) USER MOD Single : A 56 SER OG : rot -5:sc= 0.287 USER MOD Single : A 57 MET CE :methyl -139:sc= -0.152 (180deg=-1.38) USER MOD Single : A 62 GLN : amide:sc= -0.334 K(o=-0.33,f=-2.3!) USER MOD Single : A 64 THR OG1 : rot 69:sc= 0.821 USER MOD Single : A 67 LYS NZ :NH3+ 143:sc= -1.77! (180deg=-3.85!) USER MOD Single : A 69 MET CE :methyl 147:sc= -0.376 (180deg=-3.02!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= -0.0196 K(o=-0.02,f=-0.77) USER MOD Single : A 76 MET CE :methyl 149:sc= -0.802 (180deg=-2.61!) USER MOD Single : A 79 ASN : amide:sc= -0.286 K(o=-0.29,f=-2.2!) USER MOD Single : A 81 HIS : +bothHN:sc= 0.956 K(o=0.96,f=-6!) USER MOD Single : A 82 SER OG : rot 74:sc= 2.17 USER MOD Single : A 95 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0718) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot -169:sc= 1.06 USER MOD Single : A 105 TYR OH : rot 170:sc= 0.878 USER MOD Single : A 109 SER OG : rot -160:sc= -0.452 USER MOD Single : A 114 GLN : amide:sc= 0.755 K(o=0.75,f=-0.00011) USER MOD Single : A 115 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0173) USER MOD Single : A 119 LYS NZ :NH3+ -161:sc= 1.24 (180deg=1) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 124 LYS NZ :NH3+ -172:sc= 0.959 (180deg=0.88) USER MOD Single : A 125 LYS NZ :NH3+ 159:sc= -0.2 (180deg=-0.787) USER MOD Single : A 136 LYS NZ :NH3+ -162:sc= -0.121 (180deg=-0.547) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.101 -2.951 5.476 1.00 0.00 N ATOM 2 CA MET A 1 -13.229 -2.568 4.054 1.00 0.00 C ATOM 3 C MET A 1 -12.161 -1.552 3.680 1.00 0.00 C ATOM 4 O MET A 1 -11.830 -0.668 4.468 1.00 0.00 O ATOM 5 CB MET A 1 -14.611 -1.964 3.786 1.00 0.00 C ATOM 6 CG MET A 1 -14.826 -1.547 2.338 1.00 0.00 C ATOM 7 SD MET A 1 -16.305 -0.541 2.106 1.00 0.00 S ATOM 8 CE MET A 1 -15.882 0.911 3.071 1.00 0.00 C ATOM 0 H1 MET A 1 -13.826 -3.658 5.712 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.157 -3.354 5.643 1.00 0.00 H new ATOM 0 H3 MET A 1 -13.229 -2.110 6.075 1.00 0.00 H new ATOM 0 HA MET A 1 -13.102 -3.466 3.449 1.00 0.00 H new ATOM 0 HB2 MET A 1 -15.375 -2.690 4.063 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.749 -1.095 4.429 1.00 0.00 H new ATOM 0 HG2 MET A 1 -13.956 -0.988 1.994 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.899 -2.439 1.716 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.153 1.809 2.515 1.00 0.00 H new ATOM 0 HE2 MET A 1 -16.425 0.891 4.016 1.00 0.00 H new ATOM 0 HE3 MET A 1 -14.810 0.917 3.269 1.00 0.00 H new ATOM 20 N ILE A 2 -11.621 -1.681 2.481 1.00 0.00 N ATOM 21 CA ILE A 2 -10.686 -0.699 1.964 1.00 0.00 C ATOM 22 C ILE A 2 -11.109 -0.275 0.559 1.00 0.00 C ATOM 23 O ILE A 2 -11.475 -1.111 -0.273 1.00 0.00 O ATOM 24 CB ILE A 2 -9.231 -1.234 1.966 1.00 0.00 C ATOM 25 CG1 ILE A 2 -8.256 -0.143 1.506 1.00 0.00 C ATOM 26 CG2 ILE A 2 -9.102 -2.480 1.096 1.00 0.00 C ATOM 27 CD1 ILE A 2 -6.801 -0.552 1.593 1.00 0.00 C ATOM 0 H ILE A 2 -11.814 -2.457 1.847 1.00 0.00 H new ATOM 0 HA ILE A 2 -10.706 0.170 2.621 1.00 0.00 H new ATOM 0 HB ILE A 2 -8.975 -1.515 2.988 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -8.487 0.128 0.476 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -8.410 0.749 2.113 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -8.071 -2.833 1.116 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -9.760 -3.260 1.478 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -9.383 -2.239 0.071 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -6.171 0.269 1.252 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -6.552 -0.795 2.626 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -6.630 -1.426 0.964 1.00 0.00 H new ATOM 39 N THR A 3 -11.114 1.024 0.315 1.00 0.00 N ATOM 40 CA THR A 3 -11.526 1.555 -0.971 1.00 0.00 C ATOM 41 C THR A 3 -10.397 2.343 -1.629 1.00 0.00 C ATOM 42 O THR A 3 -9.842 3.276 -1.041 1.00 0.00 O ATOM 43 CB THR A 3 -12.767 2.459 -0.821 1.00 0.00 C ATOM 44 OG1 THR A 3 -13.830 1.726 -0.190 1.00 0.00 O ATOM 45 CG2 THR A 3 -13.237 2.976 -2.173 1.00 0.00 C ATOM 0 H THR A 3 -10.836 1.732 0.994 1.00 0.00 H new ATOM 0 HA THR A 3 -11.779 0.707 -1.607 1.00 0.00 H new ATOM 0 HB THR A 3 -12.491 3.314 -0.203 1.00 0.00 H new ATOM 0 HG1 THR A 3 -14.615 2.305 -0.095 1.00 0.00 H new ATOM 0 HG21 THR A 3 -14.113 3.610 -2.036 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.439 3.555 -2.638 1.00 0.00 H new ATOM 0 HG23 THR A 3 -13.496 2.134 -2.815 1.00 0.00 H new ATOM 53 N LEU A 4 -10.050 1.944 -2.844 1.00 0.00 N ATOM 54 CA LEU A 4 -9.042 2.636 -3.634 1.00 0.00 C ATOM 55 C LEU A 4 -9.618 2.917 -5.013 1.00 0.00 C ATOM 56 O LEU A 4 -10.640 2.345 -5.387 1.00 0.00 O ATOM 57 CB LEU A 4 -7.759 1.805 -3.790 1.00 0.00 C ATOM 58 CG LEU A 4 -7.142 1.231 -2.507 1.00 0.00 C ATOM 59 CD1 LEU A 4 -7.852 -0.046 -2.083 1.00 0.00 C ATOM 60 CD2 LEU A 4 -5.658 0.969 -2.710 1.00 0.00 C ATOM 0 H LEU A 4 -10.458 1.133 -3.309 1.00 0.00 H new ATOM 0 HA LEU A 4 -8.780 3.559 -3.117 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.972 0.975 -4.464 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -7.009 2.428 -4.278 1.00 0.00 H new ATOM 0 HG LEU A 4 -7.266 1.966 -1.711 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -7.395 -0.431 -1.172 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -8.905 0.167 -1.899 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -7.766 -0.790 -2.875 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -5.232 0.562 -1.793 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.522 0.254 -3.522 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -5.155 1.903 -2.961 1.00 0.00 H new ATOM 72 N THR A 5 -8.988 3.794 -5.770 1.00 0.00 N ATOM 73 CA THR A 5 -9.447 4.061 -7.117 1.00 0.00 C ATOM 74 C THR A 5 -8.553 3.355 -8.126 1.00 0.00 C ATOM 75 O THR A 5 -7.472 2.870 -7.779 1.00 0.00 O ATOM 76 CB THR A 5 -9.489 5.569 -7.431 1.00 0.00 C ATOM 77 OG1 THR A 5 -8.164 6.105 -7.459 1.00 0.00 O ATOM 78 CG2 THR A 5 -10.316 6.316 -6.397 1.00 0.00 C ATOM 0 H THR A 5 -8.168 4.327 -5.480 1.00 0.00 H new ATOM 0 HA THR A 5 -10.465 3.678 -7.191 1.00 0.00 H new ATOM 0 HB THR A 5 -9.953 5.696 -8.409 1.00 0.00 H new ATOM 0 HG1 THR A 5 -8.181 7.000 -7.859 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.330 7.378 -6.641 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.335 5.930 -6.398 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.876 6.176 -5.409 1.00 0.00 H new ATOM 86 N LYS A 6 -9.015 3.288 -9.367 1.00 0.00 N ATOM 87 CA LYS A 6 -8.241 2.701 -10.450 1.00 0.00 C ATOM 88 C LYS A 6 -6.914 3.433 -10.595 1.00 0.00 C ATOM 89 O LYS A 6 -5.876 2.827 -10.853 1.00 0.00 O ATOM 90 CB LYS A 6 -9.019 2.803 -11.758 1.00 0.00 C ATOM 91 CG LYS A 6 -8.595 1.783 -12.797 1.00 0.00 C ATOM 92 CD LYS A 6 -9.239 2.062 -14.144 1.00 0.00 C ATOM 93 CE LYS A 6 -9.004 0.922 -15.117 1.00 0.00 C ATOM 94 NZ LYS A 6 -9.413 1.278 -16.500 1.00 0.00 N ATOM 0 H LYS A 6 -9.931 3.637 -9.649 1.00 0.00 H new ATOM 0 HA LYS A 6 -8.053 1.652 -10.220 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -10.082 2.677 -11.550 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.891 3.804 -12.170 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -7.510 1.797 -12.901 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.870 0.783 -12.461 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -10.310 2.215 -14.012 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -8.834 2.985 -14.558 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -7.948 0.651 -15.110 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -9.561 0.044 -14.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -9.236 0.472 -17.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -10.426 1.512 -16.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -8.864 2.100 -16.824 1.00 0.00 H new ATOM 108 N LYS A 7 -6.975 4.742 -10.408 1.00 0.00 N ATOM 109 CA LYS A 7 -5.815 5.599 -10.492 1.00 0.00 C ATOM 110 C LYS A 7 -4.776 5.220 -9.442 1.00 0.00 C ATOM 111 O LYS A 7 -3.598 5.076 -9.755 1.00 0.00 O ATOM 112 CB LYS A 7 -6.246 7.049 -10.306 1.00 0.00 C ATOM 113 CG LYS A 7 -5.103 8.024 -10.451 1.00 0.00 C ATOM 114 CD LYS A 7 -5.553 9.467 -10.300 1.00 0.00 C ATOM 115 CE LYS A 7 -6.602 9.840 -11.334 1.00 0.00 C ATOM 116 NZ LYS A 7 -6.788 11.310 -11.419 1.00 0.00 N ATOM 0 H LYS A 7 -7.840 5.238 -10.192 1.00 0.00 H new ATOM 0 HA LYS A 7 -5.358 5.475 -11.474 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.018 7.290 -11.037 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -6.694 7.166 -9.319 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -4.343 7.803 -9.702 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -4.637 7.891 -11.427 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -5.958 9.619 -9.300 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -4.693 10.129 -10.399 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -6.306 9.453 -12.309 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -7.550 9.367 -11.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -7.511 11.528 -12.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -7.095 11.675 -10.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -5.889 11.759 -11.688 1.00 0.00 H new ATOM 130 N GLN A 8 -5.221 5.052 -8.201 1.00 0.00 N ATOM 131 CA GLN A 8 -4.323 4.670 -7.115 1.00 0.00 C ATOM 132 C GLN A 8 -3.686 3.317 -7.412 1.00 0.00 C ATOM 133 O GLN A 8 -2.512 3.091 -7.118 1.00 0.00 O ATOM 134 CB GLN A 8 -5.071 4.595 -5.780 1.00 0.00 C ATOM 135 CG GLN A 8 -5.960 5.794 -5.484 1.00 0.00 C ATOM 136 CD GLN A 8 -5.294 7.131 -5.763 1.00 0.00 C ATOM 137 OE1 GLN A 8 -5.425 7.682 -6.853 1.00 0.00 O ATOM 138 NE2 GLN A 8 -4.580 7.660 -4.783 1.00 0.00 N ATOM 0 H GLN A 8 -6.195 5.174 -7.922 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.548 5.433 -7.039 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.684 3.694 -5.772 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -4.343 4.492 -4.976 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.868 5.718 -6.082 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.264 5.761 -4.438 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -4.496 7.171 -3.892 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -4.114 8.557 -4.918 1.00 0.00 H new ATOM 147 N MET A 9 -4.468 2.420 -8.002 1.00 0.00 N ATOM 148 CA MET A 9 -3.960 1.118 -8.407 1.00 0.00 C ATOM 149 C MET A 9 -2.895 1.288 -9.482 1.00 0.00 C ATOM 150 O MET A 9 -1.821 0.704 -9.392 1.00 0.00 O ATOM 151 CB MET A 9 -5.096 0.226 -8.913 1.00 0.00 C ATOM 152 CG MET A 9 -4.625 -1.130 -9.411 1.00 0.00 C ATOM 153 SD MET A 9 -5.988 -2.216 -9.868 1.00 0.00 S ATOM 154 CE MET A 9 -6.757 -2.483 -8.271 1.00 0.00 C ATOM 0 H MET A 9 -5.455 2.572 -8.210 1.00 0.00 H new ATOM 0 HA MET A 9 -3.512 0.633 -7.540 1.00 0.00 H new ATOM 0 HB2 MET A 9 -5.817 0.079 -8.109 1.00 0.00 H new ATOM 0 HB3 MET A 9 -5.619 0.739 -9.720 1.00 0.00 H new ATOM 0 HG2 MET A 9 -3.973 -0.989 -10.273 1.00 0.00 H new ATOM 0 HG3 MET A 9 -4.028 -1.610 -8.635 1.00 0.00 H new ATOM 0 HE1 MET A 9 -7.329 -3.411 -8.293 1.00 0.00 H new ATOM 0 HE2 MET A 9 -5.987 -2.550 -7.503 1.00 0.00 H new ATOM 0 HE3 MET A 9 -7.424 -1.651 -8.045 1.00 0.00 H new ATOM 164 N GLU A 10 -3.194 2.114 -10.481 1.00 0.00 N ATOM 165 CA GLU A 10 -2.254 2.432 -11.541 1.00 0.00 C ATOM 166 C GLU A 10 -0.969 3.030 -10.979 1.00 0.00 C ATOM 167 O GLU A 10 0.125 2.669 -11.400 1.00 0.00 O ATOM 168 CB GLU A 10 -2.913 3.408 -12.512 1.00 0.00 C ATOM 169 CG GLU A 10 -3.582 2.734 -13.698 1.00 0.00 C ATOM 170 CD GLU A 10 -2.596 2.355 -14.786 1.00 0.00 C ATOM 171 OE1 GLU A 10 -1.635 1.613 -14.504 1.00 0.00 O ATOM 172 OE2 GLU A 10 -2.770 2.814 -15.934 1.00 0.00 O ATOM 0 H GLU A 10 -4.097 2.580 -10.574 1.00 0.00 H new ATOM 0 HA GLU A 10 -1.987 1.514 -12.064 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.656 3.996 -11.973 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.160 4.105 -12.879 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.102 1.839 -13.357 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.336 3.402 -14.113 1.00 0.00 H new ATOM 179 N GLU A 11 -1.115 3.927 -10.014 1.00 0.00 N ATOM 180 CA GLU A 11 0.019 4.561 -9.363 1.00 0.00 C ATOM 181 C GLU A 11 0.898 3.534 -8.650 1.00 0.00 C ATOM 182 O GLU A 11 2.129 3.603 -8.716 1.00 0.00 O ATOM 183 CB GLU A 11 -0.490 5.635 -8.397 1.00 0.00 C ATOM 184 CG GLU A 11 -0.675 6.992 -9.061 1.00 0.00 C ATOM 185 CD GLU A 11 -1.144 8.074 -8.106 1.00 0.00 C ATOM 186 OE1 GLU A 11 -0.445 8.332 -7.100 1.00 0.00 O ATOM 187 OE2 GLU A 11 -2.187 8.702 -8.380 1.00 0.00 O ATOM 0 H GLU A 11 -2.022 4.234 -9.662 1.00 0.00 H new ATOM 0 HA GLU A 11 0.645 5.035 -10.119 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -1.440 5.312 -7.971 1.00 0.00 H new ATOM 0 HB3 GLU A 11 0.213 5.734 -7.570 1.00 0.00 H new ATOM 0 HG2 GLU A 11 0.269 7.299 -9.510 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -1.397 6.896 -9.871 1.00 0.00 H new ATOM 194 N MET A 12 0.274 2.567 -7.990 1.00 0.00 N ATOM 195 CA MET A 12 1.016 1.482 -7.360 1.00 0.00 C ATOM 196 C MET A 12 1.618 0.562 -8.421 1.00 0.00 C ATOM 197 O MET A 12 2.795 0.203 -8.350 1.00 0.00 O ATOM 198 CB MET A 12 0.116 0.671 -6.425 1.00 0.00 C ATOM 199 CG MET A 12 -0.417 1.460 -5.241 1.00 0.00 C ATOM 200 SD MET A 12 -1.384 0.443 -4.105 1.00 0.00 S ATOM 201 CE MET A 12 -2.660 -0.177 -5.198 1.00 0.00 C ATOM 0 H MET A 12 -0.738 2.511 -7.877 1.00 0.00 H new ATOM 0 HA MET A 12 1.819 1.925 -6.771 1.00 0.00 H new ATOM 0 HB2 MET A 12 -0.726 0.280 -6.997 1.00 0.00 H new ATOM 0 HB3 MET A 12 0.675 -0.188 -6.054 1.00 0.00 H new ATOM 0 HG2 MET A 12 0.418 1.906 -4.701 1.00 0.00 H new ATOM 0 HG3 MET A 12 -1.036 2.280 -5.605 1.00 0.00 H new ATOM 0 HE1 MET A 12 -3.347 -0.809 -4.634 1.00 0.00 H new ATOM 0 HE2 MET A 12 -3.208 0.661 -5.629 1.00 0.00 H new ATOM 0 HE3 MET A 12 -2.203 -0.761 -5.997 1.00 0.00 H new ATOM 211 N LEU A 13 0.802 0.201 -9.408 1.00 0.00 N ATOM 212 CA LEU A 13 1.217 -0.688 -10.491 1.00 0.00 C ATOM 213 C LEU A 13 2.376 -0.101 -11.285 1.00 0.00 C ATOM 214 O LEU A 13 3.274 -0.826 -11.708 1.00 0.00 O ATOM 215 CB LEU A 13 0.040 -0.967 -11.432 1.00 0.00 C ATOM 216 CG LEU A 13 -1.042 -1.892 -10.877 1.00 0.00 C ATOM 217 CD1 LEU A 13 -2.166 -2.050 -11.888 1.00 0.00 C ATOM 218 CD2 LEU A 13 -0.454 -3.248 -10.514 1.00 0.00 C ATOM 0 H LEU A 13 -0.165 0.516 -9.480 1.00 0.00 H new ATOM 0 HA LEU A 13 1.551 -1.621 -10.038 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.422 -0.017 -11.700 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.429 -1.403 -12.352 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.450 -1.445 -9.970 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.931 -2.711 -11.481 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.605 -1.075 -12.100 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.770 -2.477 -12.809 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.240 -3.892 -10.121 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.020 -3.706 -11.403 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.321 -3.118 -9.758 1.00 0.00 H new ATOM 230 N ALA A 14 2.343 1.206 -11.505 1.00 0.00 N ATOM 231 CA ALA A 14 3.417 1.888 -12.215 1.00 0.00 C ATOM 232 C ALA A 14 4.732 1.733 -11.463 1.00 0.00 C ATOM 233 O ALA A 14 5.763 1.410 -12.054 1.00 0.00 O ATOM 234 CB ALA A 14 3.085 3.362 -12.407 1.00 0.00 C ATOM 0 H ALA A 14 1.584 1.816 -11.202 1.00 0.00 H new ATOM 0 HA ALA A 14 3.522 1.430 -13.199 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.900 3.852 -12.939 1.00 0.00 H new ATOM 0 HB2 ALA A 14 2.166 3.456 -12.985 1.00 0.00 H new ATOM 0 HB3 ALA A 14 2.951 3.835 -11.434 1.00 0.00 H new ATOM 240 N HIS A 15 4.681 1.938 -10.151 1.00 0.00 N ATOM 241 CA HIS A 15 5.862 1.767 -9.312 1.00 0.00 C ATOM 242 C HIS A 15 6.293 0.304 -9.307 1.00 0.00 C ATOM 243 O HIS A 15 7.480 0.002 -9.328 1.00 0.00 O ATOM 244 CB HIS A 15 5.581 2.239 -7.884 1.00 0.00 C ATOM 245 CG HIS A 15 6.810 2.344 -7.024 1.00 0.00 C ATOM 246 ND1 HIS A 15 7.728 3.362 -7.144 1.00 0.00 N ATOM 247 CD2 HIS A 15 7.252 1.566 -6.007 1.00 0.00 C ATOM 248 CE1 HIS A 15 8.681 3.204 -6.247 1.00 0.00 C ATOM 249 NE2 HIS A 15 8.418 2.124 -5.538 1.00 0.00 N ATOM 0 H HIS A 15 3.840 2.221 -9.648 1.00 0.00 H new ATOM 0 HA HIS A 15 6.669 2.373 -9.723 1.00 0.00 H new ATOM 0 HB2 HIS A 15 5.093 3.213 -7.923 1.00 0.00 H new ATOM 0 HB3 HIS A 15 4.879 1.549 -7.415 1.00 0.00 H new ATOM 0 HD2 HIS A 15 6.776 0.672 -5.633 1.00 0.00 H new ATOM 0 HE1 HIS A 15 9.535 3.852 -6.115 1.00 0.00 H new ATOM 0 HE2 HIS A 15 8.984 1.763 -4.770 1.00 0.00 H new ATOM 258 N ALA A 16 5.314 -0.593 -9.285 1.00 0.00 N ATOM 259 CA ALA A 16 5.580 -2.029 -9.281 1.00 0.00 C ATOM 260 C ALA A 16 6.281 -2.472 -10.561 1.00 0.00 C ATOM 261 O ALA A 16 7.331 -3.108 -10.511 1.00 0.00 O ATOM 262 CB ALA A 16 4.287 -2.808 -9.089 1.00 0.00 C ATOM 0 H ALA A 16 4.323 -0.351 -9.270 1.00 0.00 H new ATOM 0 HA ALA A 16 6.248 -2.240 -8.446 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.503 -3.876 -9.088 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.832 -2.529 -8.139 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.599 -2.577 -9.902 1.00 0.00 H new ATOM 268 N ARG A 17 5.703 -2.112 -11.702 1.00 0.00 N ATOM 269 CA ARG A 17 6.252 -2.489 -13.001 1.00 0.00 C ATOM 270 C ARG A 17 7.658 -1.922 -13.194 1.00 0.00 C ATOM 271 O ARG A 17 8.529 -2.576 -13.766 1.00 0.00 O ATOM 272 CB ARG A 17 5.332 -2.004 -14.128 1.00 0.00 C ATOM 273 CG ARG A 17 4.068 -2.836 -14.291 1.00 0.00 C ATOM 274 CD ARG A 17 3.047 -2.143 -15.182 1.00 0.00 C ATOM 275 NE ARG A 17 2.395 -1.026 -14.495 1.00 0.00 N ATOM 276 CZ ARG A 17 1.367 -0.331 -14.994 1.00 0.00 C ATOM 277 NH1 ARG A 17 0.941 -0.548 -16.235 1.00 0.00 N ATOM 278 NH2 ARG A 17 0.783 0.606 -14.254 1.00 0.00 N ATOM 0 H ARG A 17 4.849 -1.556 -11.754 1.00 0.00 H new ATOM 0 HA ARG A 17 6.316 -3.577 -13.034 1.00 0.00 H new ATOM 0 HB2 ARG A 17 5.052 -0.968 -13.935 1.00 0.00 H new ATOM 0 HB3 ARG A 17 5.886 -2.015 -15.067 1.00 0.00 H new ATOM 0 HG2 ARG A 17 4.324 -3.806 -14.717 1.00 0.00 H new ATOM 0 HG3 ARG A 17 3.628 -3.024 -13.312 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.539 -1.778 -16.083 1.00 0.00 H new ATOM 0 HD3 ARG A 17 2.294 -2.864 -15.500 1.00 0.00 H new ATOM 0 HE ARG A 17 2.748 -0.761 -13.576 1.00 0.00 H new ATOM 0 HH11 ARG A 17 1.399 -1.250 -16.816 1.00 0.00 H new ATOM 0 HH12 ARG A 17 0.156 -0.012 -16.606 1.00 0.00 H new ATOM 0 HH21 ARG A 17 1.119 0.793 -13.309 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -0.001 1.138 -14.631 1.00 0.00 H new ATOM 292 N GLN A 18 7.872 -0.704 -12.709 1.00 0.00 N ATOM 293 CA GLN A 18 9.167 -0.048 -12.830 1.00 0.00 C ATOM 294 C GLN A 18 10.198 -0.676 -11.894 1.00 0.00 C ATOM 295 O GLN A 18 11.351 -0.886 -12.272 1.00 0.00 O ATOM 296 CB GLN A 18 9.032 1.440 -12.506 1.00 0.00 C ATOM 297 CG GLN A 18 10.313 2.225 -12.728 1.00 0.00 C ATOM 298 CD GLN A 18 10.252 3.637 -12.173 1.00 0.00 C ATOM 299 OE1 GLN A 18 9.068 4.227 -12.155 1.00 0.00 O flip ATOM 300 NE2 GLN A 18 11.269 4.192 -11.760 1.00 0.00 N flip ATOM 0 H GLN A 18 7.163 -0.151 -12.228 1.00 0.00 H new ATOM 0 HA GLN A 18 9.509 -0.175 -13.857 1.00 0.00 H new ATOM 0 HB2 GLN A 18 8.241 1.868 -13.122 1.00 0.00 H new ATOM 0 HB3 GLN A 18 8.722 1.551 -11.467 1.00 0.00 H new ATOM 0 HG2 GLN A 18 11.143 1.694 -12.262 1.00 0.00 H new ATOM 0 HG3 GLN A 18 10.524 2.270 -13.797 1.00 0.00 H new ATOM 0 HE21 GLN A 18 12.164 3.704 -11.790 1.00 0.00 H new ATOM 0 HE22 GLN A 18 11.217 5.140 -11.387 1.00 0.00 H new ATOM 309 N ALA A 19 9.767 -0.982 -10.677 1.00 0.00 N ATOM 310 CA ALA A 19 10.667 -1.461 -9.631 1.00 0.00 C ATOM 311 C ALA A 19 11.240 -2.837 -9.945 1.00 0.00 C ATOM 312 O ALA A 19 12.327 -3.168 -9.483 1.00 0.00 O ATOM 313 CB ALA A 19 9.956 -1.485 -8.290 1.00 0.00 C ATOM 0 H ALA A 19 8.792 -0.907 -10.387 1.00 0.00 H new ATOM 0 HA ALA A 19 11.503 -0.763 -9.585 1.00 0.00 H new ATOM 0 HB1 ALA A 19 10.641 -1.844 -7.522 1.00 0.00 H new ATOM 0 HB2 ALA A 19 9.622 -0.479 -8.037 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.094 -2.149 -8.347 1.00 0.00 H new ATOM 319 N LEU A 20 10.510 -3.636 -10.721 1.00 0.00 N ATOM 320 CA LEU A 20 10.958 -4.978 -11.086 1.00 0.00 C ATOM 321 C LEU A 20 12.365 -4.943 -11.681 1.00 0.00 C ATOM 322 O LEU A 20 12.688 -4.054 -12.469 1.00 0.00 O ATOM 323 CB LEU A 20 9.996 -5.600 -12.098 1.00 0.00 C ATOM 324 CG LEU A 20 8.562 -5.801 -11.611 1.00 0.00 C ATOM 325 CD1 LEU A 20 7.725 -6.449 -12.700 1.00 0.00 C ATOM 326 CD2 LEU A 20 8.535 -6.643 -10.344 1.00 0.00 C ATOM 0 H LEU A 20 9.604 -3.376 -11.110 1.00 0.00 H new ATOM 0 HA LEU A 20 10.975 -5.583 -10.179 1.00 0.00 H new ATOM 0 HB2 LEU A 20 9.974 -4.968 -12.986 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.395 -6.567 -12.404 1.00 0.00 H new ATOM 0 HG LEU A 20 8.137 -4.825 -11.377 1.00 0.00 H new ATOM 0 HD11 LEU A 20 6.705 -6.587 -12.341 1.00 0.00 H new ATOM 0 HD12 LEU A 20 7.716 -5.808 -13.582 1.00 0.00 H new ATOM 0 HD13 LEU A 20 8.153 -7.417 -12.960 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.504 -6.773 -10.015 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.977 -7.619 -10.546 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.105 -6.141 -9.562 1.00 0.00 H new ATOM 338 N PRO A 21 13.221 -5.917 -11.319 1.00 0.00 N ATOM 339 CA PRO A 21 12.894 -6.989 -10.390 1.00 0.00 C ATOM 340 C PRO A 21 13.408 -6.725 -8.971 1.00 0.00 C ATOM 341 O PRO A 21 13.814 -7.647 -8.269 1.00 0.00 O ATOM 342 CB PRO A 21 13.638 -8.168 -11.017 1.00 0.00 C ATOM 343 CG PRO A 21 14.834 -7.566 -11.700 1.00 0.00 C ATOM 344 CD PRO A 21 14.588 -6.077 -11.821 1.00 0.00 C ATOM 0 HA PRO A 21 11.820 -7.130 -10.265 1.00 0.00 H new ATOM 0 HB2 PRO A 21 13.941 -8.890 -10.259 1.00 0.00 H new ATOM 0 HB3 PRO A 21 13.005 -8.699 -11.728 1.00 0.00 H new ATOM 0 HG2 PRO A 21 15.741 -7.759 -11.127 1.00 0.00 H new ATOM 0 HG3 PRO A 21 14.978 -8.012 -12.684 1.00 0.00 H new ATOM 0 HD2 PRO A 21 15.302 -5.502 -11.231 1.00 0.00 H new ATOM 0 HD3 PRO A 21 14.680 -5.737 -12.853 1.00 0.00 H new ATOM 352 N ASN A 22 13.394 -5.465 -8.561 1.00 0.00 N ATOM 353 CA ASN A 22 13.857 -5.073 -7.228 1.00 0.00 C ATOM 354 C ASN A 22 12.685 -5.041 -6.257 1.00 0.00 C ATOM 355 O ASN A 22 12.862 -4.870 -5.050 1.00 0.00 O ATOM 356 CB ASN A 22 14.517 -3.697 -7.316 1.00 0.00 C ATOM 357 CG ASN A 22 15.137 -3.207 -6.013 1.00 0.00 C ATOM 358 OD1 ASN A 22 15.176 -2.004 -5.759 1.00 0.00 O ATOM 359 ND2 ASN A 22 15.633 -4.115 -5.187 1.00 0.00 N ATOM 0 H ASN A 22 13.065 -4.688 -9.134 1.00 0.00 H new ATOM 0 HA ASN A 22 14.583 -5.799 -6.862 1.00 0.00 H new ATOM 0 HB2 ASN A 22 15.291 -3.728 -8.082 1.00 0.00 H new ATOM 0 HB3 ASN A 22 13.773 -2.972 -7.644 1.00 0.00 H new ATOM 0 HD21 ASN A 22 16.064 -3.825 -4.309 1.00 0.00 H new ATOM 0 HD22 ASN A 22 15.584 -5.105 -5.428 1.00 0.00 H new ATOM 366 N GLU A 23 11.493 -5.206 -6.819 1.00 0.00 N ATOM 367 CA GLU A 23 10.240 -5.233 -6.061 1.00 0.00 C ATOM 368 C GLU A 23 9.846 -3.842 -5.581 1.00 0.00 C ATOM 369 O GLU A 23 10.690 -2.974 -5.353 1.00 0.00 O ATOM 370 CB GLU A 23 10.312 -6.213 -4.884 1.00 0.00 C ATOM 371 CG GLU A 23 10.498 -7.660 -5.310 1.00 0.00 C ATOM 372 CD GLU A 23 9.274 -8.247 -5.986 1.00 0.00 C ATOM 373 OE1 GLU A 23 8.555 -7.503 -6.693 1.00 0.00 O ATOM 374 OE2 GLU A 23 9.031 -9.463 -5.814 1.00 0.00 O ATOM 0 H GLU A 23 11.364 -5.326 -7.824 1.00 0.00 H new ATOM 0 HA GLU A 23 9.465 -5.585 -6.742 1.00 0.00 H new ATOM 0 HB2 GLU A 23 11.137 -5.926 -4.232 1.00 0.00 H new ATOM 0 HB3 GLU A 23 9.398 -6.130 -4.296 1.00 0.00 H new ATOM 0 HG2 GLU A 23 11.347 -7.725 -5.991 1.00 0.00 H new ATOM 0 HG3 GLU A 23 10.744 -8.261 -4.434 1.00 0.00 H new ATOM 381 N ALA A 24 8.550 -3.629 -5.455 1.00 0.00 N ATOM 382 CA ALA A 24 8.023 -2.332 -5.090 1.00 0.00 C ATOM 383 C ALA A 24 7.679 -2.257 -3.614 1.00 0.00 C ATOM 384 O ALA A 24 7.259 -3.242 -3.000 1.00 0.00 O ATOM 385 CB ALA A 24 6.797 -2.012 -5.922 1.00 0.00 C ATOM 0 H ALA A 24 7.839 -4.346 -5.602 1.00 0.00 H new ATOM 0 HA ALA A 24 8.801 -1.595 -5.289 1.00 0.00 H new ATOM 0 HB1 ALA A 24 6.410 -1.034 -5.638 1.00 0.00 H new ATOM 0 HB2 ALA A 24 7.066 -2.003 -6.978 1.00 0.00 H new ATOM 0 HB3 ALA A 24 6.032 -2.769 -5.749 1.00 0.00 H new ATOM 391 N CYS A 25 7.870 -1.073 -3.059 1.00 0.00 N ATOM 392 CA CYS A 25 7.491 -0.784 -1.693 1.00 0.00 C ATOM 393 C CYS A 25 6.909 0.626 -1.621 1.00 0.00 C ATOM 394 O CYS A 25 7.025 1.398 -2.579 1.00 0.00 O ATOM 395 CB CYS A 25 8.707 -0.903 -0.772 1.00 0.00 C ATOM 396 SG CYS A 25 10.125 0.088 -1.305 1.00 0.00 S ATOM 0 H CYS A 25 8.294 -0.284 -3.547 1.00 0.00 H new ATOM 0 HA CYS A 25 6.740 -1.502 -1.365 1.00 0.00 H new ATOM 0 HB2 CYS A 25 8.420 -0.598 0.235 1.00 0.00 H new ATOM 0 HB3 CYS A 25 9.007 -1.949 -0.715 1.00 0.00 H new ATOM 0 HG CYS A 25 9.704 1.148 -1.928 1.00 0.00 H new ATOM 402 N GLY A 26 6.278 0.963 -0.510 1.00 0.00 N ATOM 403 CA GLY A 26 5.735 2.295 -0.351 1.00 0.00 C ATOM 404 C GLY A 26 4.684 2.351 0.728 1.00 0.00 C ATOM 405 O GLY A 26 4.510 1.385 1.470 1.00 0.00 O ATOM 0 H GLY A 26 6.131 0.340 0.284 1.00 0.00 H new ATOM 0 HA2 GLY A 26 6.540 2.988 -0.109 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.303 2.626 -1.296 1.00 0.00 H new ATOM 409 N LEU A 27 3.983 3.471 0.813 1.00 0.00 N ATOM 410 CA LEU A 27 2.940 3.642 1.812 1.00 0.00 C ATOM 411 C LEU A 27 1.653 4.130 1.159 1.00 0.00 C ATOM 412 O LEU A 27 1.680 4.768 0.103 1.00 0.00 O ATOM 413 CB LEU A 27 3.381 4.642 2.885 1.00 0.00 C ATOM 414 CG LEU A 27 4.590 4.220 3.723 1.00 0.00 C ATOM 415 CD1 LEU A 27 4.988 5.333 4.680 1.00 0.00 C ATOM 416 CD2 LEU A 27 4.290 2.942 4.494 1.00 0.00 C ATOM 0 H LEU A 27 4.118 4.276 0.201 1.00 0.00 H new ATOM 0 HA LEU A 27 2.759 2.675 2.281 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.611 5.591 2.400 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.541 4.822 3.556 1.00 0.00 H new ATOM 0 HG LEU A 27 5.423 4.027 3.047 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.849 5.016 5.268 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.246 6.227 4.112 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.155 5.555 5.347 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.162 2.659 5.083 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.442 3.108 5.158 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.051 2.142 3.793 1.00 0.00 H new ATOM 428 N LEU A 28 0.532 3.834 1.796 1.00 0.00 N ATOM 429 CA LEU A 28 -0.764 4.276 1.308 1.00 0.00 C ATOM 430 C LEU A 28 -1.369 5.280 2.275 1.00 0.00 C ATOM 431 O LEU A 28 -1.419 5.034 3.483 1.00 0.00 O ATOM 432 CB LEU A 28 -1.704 3.084 1.132 1.00 0.00 C ATOM 433 CG LEU A 28 -1.264 2.062 0.082 1.00 0.00 C ATOM 434 CD1 LEU A 28 -2.242 0.901 0.027 1.00 0.00 C ATOM 435 CD2 LEU A 28 -1.143 2.722 -1.283 1.00 0.00 C ATOM 0 H LEU A 28 0.494 3.287 2.656 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.626 4.755 0.339 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.806 2.576 2.091 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.692 3.457 0.862 1.00 0.00 H new ATOM 0 HG LEU A 28 -0.286 1.674 0.366 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.913 0.184 -0.725 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -2.282 0.413 1.001 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.233 1.272 -0.234 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.829 1.981 -2.019 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.108 3.136 -1.574 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.404 3.522 -1.236 1.00 0.00 H new ATOM 447 N GLY A 29 -1.822 6.407 1.749 1.00 0.00 N ATOM 448 CA GLY A 29 -2.376 7.441 2.593 1.00 0.00 C ATOM 449 C GLY A 29 -3.793 7.803 2.215 1.00 0.00 C ATOM 450 O GLY A 29 -4.208 7.637 1.062 1.00 0.00 O ATOM 0 H GLY A 29 -1.815 6.623 0.752 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.355 7.108 3.631 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.749 8.330 2.531 1.00 0.00 H new ATOM 454 N GLY A 30 -4.540 8.290 3.188 1.00 0.00 N ATOM 455 CA GLY A 30 -5.908 8.682 2.951 1.00 0.00 C ATOM 456 C GLY A 30 -6.658 8.903 4.243 1.00 0.00 C ATOM 457 O GLY A 30 -6.089 9.381 5.227 1.00 0.00 O ATOM 0 H GLY A 30 -4.219 8.422 4.147 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -5.927 9.597 2.358 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.411 7.912 2.365 1.00 0.00 H new ATOM 461 N ARG A 31 -7.929 8.554 4.252 1.00 0.00 N ATOM 462 CA ARG A 31 -8.750 8.715 5.439 1.00 0.00 C ATOM 463 C ARG A 31 -9.303 7.374 5.886 1.00 0.00 C ATOM 464 O ARG A 31 -9.570 6.499 5.063 1.00 0.00 O ATOM 465 CB ARG A 31 -9.895 9.694 5.174 1.00 0.00 C ATOM 466 CG ARG A 31 -9.453 11.148 5.121 1.00 0.00 C ATOM 467 CD ARG A 31 -10.597 12.063 4.712 1.00 0.00 C ATOM 468 NE ARG A 31 -10.976 11.868 3.315 1.00 0.00 N ATOM 469 CZ ARG A 31 -12.229 11.865 2.866 1.00 0.00 C ATOM 470 NH1 ARG A 31 -13.247 12.003 3.709 1.00 0.00 N ATOM 471 NH2 ARG A 31 -12.466 11.715 1.570 1.00 0.00 N ATOM 0 H ARG A 31 -8.418 8.156 3.450 1.00 0.00 H new ATOM 0 HA ARG A 31 -8.124 9.120 6.234 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -10.373 9.434 4.230 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -10.647 9.580 5.954 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -9.075 11.450 6.098 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -8.630 11.254 4.414 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -11.459 11.875 5.352 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -10.305 13.102 4.868 1.00 0.00 H new ATOM 0 HE ARG A 31 -10.228 11.724 2.636 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -13.071 12.112 4.708 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -14.204 12.000 3.357 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -11.689 11.602 0.919 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -13.426 11.712 1.224 1.00 0.00 H new ATOM 485 N ARG A 32 -9.453 7.206 7.185 1.00 0.00 N ATOM 486 CA ARG A 32 -10.033 5.994 7.724 1.00 0.00 C ATOM 487 C ARG A 32 -11.118 6.340 8.732 1.00 0.00 C ATOM 488 O ARG A 32 -10.974 7.276 9.523 1.00 0.00 O ATOM 489 CB ARG A 32 -8.961 5.098 8.359 1.00 0.00 C ATOM 490 CG ARG A 32 -8.198 5.735 9.508 1.00 0.00 C ATOM 491 CD ARG A 32 -7.112 4.801 10.022 1.00 0.00 C ATOM 492 NE ARG A 32 -6.379 5.361 11.152 1.00 0.00 N ATOM 493 CZ ARG A 32 -5.176 4.933 11.544 1.00 0.00 C ATOM 494 NH1 ARG A 32 -4.555 3.966 10.877 1.00 0.00 N ATOM 495 NH2 ARG A 32 -4.597 5.472 12.606 1.00 0.00 N ATOM 0 H ARG A 32 -9.181 7.895 7.886 1.00 0.00 H new ATOM 0 HA ARG A 32 -10.482 5.434 6.904 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -9.436 4.185 8.719 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -8.249 4.804 7.587 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -7.751 6.672 9.177 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -8.887 5.978 10.317 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -7.563 3.854 10.320 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -6.414 4.582 9.214 1.00 0.00 H new ATOM 0 HE ARG A 32 -6.810 6.124 11.673 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -4.997 3.545 10.060 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -3.636 3.644 11.182 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -5.070 6.213 13.124 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -3.678 5.146 12.906 1.00 0.00 H new ATOM 509 N ASP A 33 -12.212 5.600 8.688 1.00 0.00 N ATOM 510 CA ASP A 33 -13.338 5.865 9.575 1.00 0.00 C ATOM 511 C ASP A 33 -13.843 4.562 10.162 1.00 0.00 C ATOM 512 O ASP A 33 -14.119 3.617 9.424 1.00 0.00 O ATOM 513 CB ASP A 33 -14.459 6.584 8.826 1.00 0.00 C ATOM 514 CG ASP A 33 -15.464 7.214 9.764 1.00 0.00 C ATOM 515 OD1 ASP A 33 -15.199 8.334 10.253 1.00 0.00 O ATOM 516 OD2 ASP A 33 -16.519 6.598 10.024 1.00 0.00 O ATOM 0 H ASP A 33 -12.347 4.814 8.052 1.00 0.00 H new ATOM 0 HA ASP A 33 -13.003 6.514 10.384 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -14.029 7.355 8.186 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -14.969 5.876 8.173 1.00 0.00 H new ATOM 521 N GLY A 34 -13.967 4.512 11.482 1.00 0.00 N ATOM 522 CA GLY A 34 -14.237 3.257 12.149 1.00 0.00 C ATOM 523 C GLY A 34 -12.996 2.394 12.143 1.00 0.00 C ATOM 524 O GLY A 34 -12.202 2.419 13.085 1.00 0.00 O ATOM 0 H GLY A 34 -13.885 5.319 12.101 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -14.557 3.442 13.174 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -15.054 2.738 11.649 1.00 0.00 H new ATOM 528 N ASP A 35 -12.841 1.628 11.083 1.00 0.00 N ATOM 529 CA ASP A 35 -11.576 0.962 10.799 1.00 0.00 C ATOM 530 C ASP A 35 -11.402 0.764 9.293 1.00 0.00 C ATOM 531 O ASP A 35 -10.444 0.137 8.843 1.00 0.00 O ATOM 532 CB ASP A 35 -11.484 -0.380 11.530 1.00 0.00 C ATOM 533 CG ASP A 35 -10.052 -0.855 11.677 1.00 0.00 C ATOM 534 OD1 ASP A 35 -9.214 -0.076 12.187 1.00 0.00 O ATOM 535 OD2 ASP A 35 -9.755 -2.009 11.309 1.00 0.00 O ATOM 0 H ASP A 35 -13.575 1.448 10.398 1.00 0.00 H new ATOM 0 HA ASP A 35 -10.770 1.600 11.162 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -11.937 -0.286 12.517 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.059 -1.129 10.985 1.00 0.00 H new ATOM 540 N ASP A 36 -12.318 1.330 8.506 1.00 0.00 N ATOM 541 CA ASP A 36 -12.251 1.205 7.056 1.00 0.00 C ATOM 542 C ASP A 36 -11.390 2.315 6.485 1.00 0.00 C ATOM 543 O ASP A 36 -11.227 3.364 7.100 1.00 0.00 O ATOM 544 CB ASP A 36 -13.642 1.244 6.422 1.00 0.00 C ATOM 545 CG ASP A 36 -14.550 0.142 6.932 1.00 0.00 C ATOM 546 OD1 ASP A 36 -14.114 -1.028 6.963 1.00 0.00 O ATOM 547 OD2 ASP A 36 -15.711 0.440 7.297 1.00 0.00 O ATOM 0 H ASP A 36 -13.109 1.875 8.849 1.00 0.00 H new ATOM 0 HA ASP A 36 -11.806 0.238 6.822 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.102 2.211 6.625 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -13.546 1.158 5.340 1.00 0.00 H new ATOM 552 N ARG A 37 -10.857 2.085 5.301 1.00 0.00 N ATOM 553 CA ARG A 37 -9.834 2.960 4.742 1.00 0.00 C ATOM 554 C ARG A 37 -10.186 3.413 3.328 1.00 0.00 C ATOM 555 O ARG A 37 -10.646 2.617 2.507 1.00 0.00 O ATOM 556 CB ARG A 37 -8.482 2.244 4.711 1.00 0.00 C ATOM 557 CG ARG A 37 -8.201 1.387 5.934 1.00 0.00 C ATOM 558 CD ARG A 37 -6.755 0.925 5.966 1.00 0.00 C ATOM 559 NE ARG A 37 -6.535 -0.152 6.930 1.00 0.00 N ATOM 560 CZ ARG A 37 -6.631 -0.021 8.256 1.00 0.00 C ATOM 561 NH1 ARG A 37 -6.988 1.143 8.793 1.00 0.00 N ATOM 562 NH2 ARG A 37 -6.373 -1.058 9.040 1.00 0.00 N ATOM 0 H ARG A 37 -11.113 1.299 4.703 1.00 0.00 H new ATOM 0 HA ARG A 37 -9.778 3.839 5.384 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -8.438 1.614 3.822 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -7.692 2.988 4.614 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -8.423 1.955 6.837 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -8.862 0.520 5.932 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -6.463 0.585 4.972 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -6.112 1.769 6.216 1.00 0.00 H new ATOM 0 HE ARG A 37 -6.290 -1.072 6.563 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -7.190 1.942 8.191 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -7.060 1.237 9.806 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -6.102 -1.952 8.630 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -6.445 -0.962 10.053 1.00 0.00 H new ATOM 576 N TRP A 38 -9.957 4.690 3.056 1.00 0.00 N ATOM 577 CA TRP A 38 -10.103 5.247 1.720 1.00 0.00 C ATOM 578 C TRP A 38 -8.773 5.826 1.248 1.00 0.00 C ATOM 579 O TRP A 38 -8.279 6.812 1.806 1.00 0.00 O ATOM 580 CB TRP A 38 -11.183 6.331 1.713 1.00 0.00 C ATOM 581 CG TRP A 38 -12.552 5.793 1.989 1.00 0.00 C ATOM 582 CD1 TRP A 38 -13.415 5.285 1.072 1.00 0.00 C ATOM 583 CD2 TRP A 38 -13.209 5.702 3.257 1.00 0.00 C ATOM 584 NE1 TRP A 38 -14.571 4.878 1.687 1.00 0.00 N ATOM 585 CE2 TRP A 38 -14.471 5.124 3.029 1.00 0.00 C ATOM 586 CE3 TRP A 38 -12.853 6.049 4.563 1.00 0.00 C ATOM 587 CZ2 TRP A 38 -15.378 4.885 4.057 1.00 0.00 C ATOM 588 CZ3 TRP A 38 -13.755 5.811 5.582 1.00 0.00 C ATOM 589 CH2 TRP A 38 -15.004 5.236 5.323 1.00 0.00 C ATOM 0 H TRP A 38 -9.664 5.370 3.758 1.00 0.00 H new ATOM 0 HA TRP A 38 -10.404 4.451 1.038 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -10.938 7.086 2.460 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -11.183 6.830 0.744 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -13.219 5.212 0.012 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -15.375 4.460 1.220 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -11.892 6.495 4.772 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -16.342 4.439 3.861 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -13.492 6.073 6.596 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -15.687 5.066 6.142 1.00 0.00 H new ATOM 600 N VAL A 39 -8.187 5.206 0.232 1.00 0.00 N ATOM 601 CA VAL A 39 -6.889 5.628 -0.279 1.00 0.00 C ATOM 602 C VAL A 39 -7.044 6.783 -1.264 1.00 0.00 C ATOM 603 O VAL A 39 -7.510 6.596 -2.388 1.00 0.00 O ATOM 604 CB VAL A 39 -6.139 4.460 -0.960 1.00 0.00 C ATOM 605 CG1 VAL A 39 -4.796 4.923 -1.508 1.00 0.00 C ATOM 606 CG2 VAL A 39 -5.945 3.320 0.025 1.00 0.00 C ATOM 0 H VAL A 39 -8.591 4.407 -0.256 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.300 5.963 0.575 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.741 4.105 -1.797 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.288 4.084 -1.982 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -4.955 5.712 -2.242 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.182 5.305 -0.692 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.416 2.502 -0.464 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.363 3.671 0.877 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.917 2.968 0.370 1.00 0.00 H new ATOM 616 N GLU A 40 -6.656 7.977 -0.833 1.00 0.00 N ATOM 617 CA GLU A 40 -6.808 9.172 -1.655 1.00 0.00 C ATOM 618 C GLU A 40 -5.474 9.617 -2.254 1.00 0.00 C ATOM 619 O GLU A 40 -5.445 10.391 -3.211 1.00 0.00 O ATOM 620 CB GLU A 40 -7.421 10.309 -0.834 1.00 0.00 C ATOM 621 CG GLU A 40 -8.799 9.978 -0.279 1.00 0.00 C ATOM 622 CD GLU A 40 -9.441 11.147 0.437 1.00 0.00 C ATOM 623 OE1 GLU A 40 -9.050 11.439 1.581 1.00 0.00 O ATOM 624 OE2 GLU A 40 -10.350 11.783 -0.138 1.00 0.00 O ATOM 0 H GLU A 40 -6.234 8.144 0.080 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.478 8.923 -2.478 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.753 10.552 -0.007 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -7.493 11.200 -1.458 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -9.447 9.658 -1.095 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.716 9.138 0.410 1.00 0.00 H new ATOM 631 N ARG A 41 -4.368 9.138 -1.693 1.00 0.00 N ATOM 632 CA ARG A 41 -3.048 9.470 -2.222 1.00 0.00 C ATOM 633 C ARG A 41 -2.049 8.351 -1.936 1.00 0.00 C ATOM 634 O ARG A 41 -1.976 7.837 -0.820 1.00 0.00 O ATOM 635 CB ARG A 41 -2.556 10.805 -1.642 1.00 0.00 C ATOM 636 CG ARG A 41 -1.201 11.251 -2.181 1.00 0.00 C ATOM 637 CD ARG A 41 -0.949 12.728 -1.905 1.00 0.00 C ATOM 638 NE ARG A 41 0.405 13.137 -2.286 1.00 0.00 N ATOM 639 CZ ARG A 41 0.742 13.605 -3.491 1.00 0.00 C ATOM 640 NH1 ARG A 41 -0.167 13.722 -4.453 1.00 0.00 N ATOM 641 NH2 ARG A 41 1.997 13.962 -3.733 1.00 0.00 N ATOM 0 H ARG A 41 -4.358 8.524 -0.879 1.00 0.00 H new ATOM 0 HA ARG A 41 -3.130 9.576 -3.304 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.294 11.578 -1.858 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.494 10.718 -0.557 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -0.412 10.654 -1.723 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -1.157 11.068 -3.255 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -1.676 13.328 -2.453 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -1.103 12.930 -0.845 1.00 0.00 H new ATOM 0 HE ARG A 41 1.140 13.059 -1.584 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -1.135 13.453 -4.276 1.00 0.00 H new ATOM 0 HH12 ARG A 41 0.103 14.081 -5.369 1.00 0.00 H new ATOM 0 HH21 ARG A 41 2.701 13.879 -3.000 1.00 0.00 H new ATOM 0 HH22 ARG A 41 2.257 14.320 -4.652 1.00 0.00 H new ATOM 655 N VAL A 42 -1.292 7.970 -2.956 1.00 0.00 N ATOM 656 CA VAL A 42 -0.311 6.899 -2.832 1.00 0.00 C ATOM 657 C VAL A 42 1.102 7.468 -2.773 1.00 0.00 C ATOM 658 O VAL A 42 1.439 8.388 -3.524 1.00 0.00 O ATOM 659 CB VAL A 42 -0.410 5.912 -4.019 1.00 0.00 C ATOM 660 CG1 VAL A 42 0.595 4.777 -3.874 1.00 0.00 C ATOM 661 CG2 VAL A 42 -1.818 5.356 -4.139 1.00 0.00 C ATOM 0 H VAL A 42 -1.339 8.390 -3.885 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.527 6.365 -1.907 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.174 6.462 -4.930 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.503 4.099 -4.722 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.605 5.187 -3.845 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.398 4.232 -2.951 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -1.866 4.664 -4.980 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -2.081 4.830 -3.221 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.520 6.174 -4.302 1.00 0.00 H new ATOM 671 N TYR A 43 1.921 6.931 -1.877 1.00 0.00 N ATOM 672 CA TYR A 43 3.315 7.340 -1.778 1.00 0.00 C ATOM 673 C TYR A 43 4.249 6.166 -2.025 1.00 0.00 C ATOM 674 O TYR A 43 4.656 5.467 -1.093 1.00 0.00 O ATOM 675 CB TYR A 43 3.614 7.992 -0.428 1.00 0.00 C ATOM 676 CG TYR A 43 3.338 9.476 -0.418 1.00 0.00 C ATOM 677 CD1 TYR A 43 4.284 10.374 -0.896 1.00 0.00 C ATOM 678 CD2 TYR A 43 2.131 9.977 0.047 1.00 0.00 C ATOM 679 CE1 TYR A 43 4.035 11.732 -0.906 1.00 0.00 C ATOM 680 CE2 TYR A 43 1.874 11.333 0.035 1.00 0.00 C ATOM 681 CZ TYR A 43 2.829 12.204 -0.440 1.00 0.00 C ATOM 682 OH TYR A 43 2.570 13.555 -0.465 1.00 0.00 O ATOM 0 H TYR A 43 1.643 6.212 -1.209 1.00 0.00 H new ATOM 0 HA TYR A 43 3.490 8.085 -2.554 1.00 0.00 H new ATOM 0 HB2 TYR A 43 3.013 7.511 0.343 1.00 0.00 H new ATOM 0 HB3 TYR A 43 4.659 7.820 -0.171 1.00 0.00 H new ATOM 0 HD1 TYR A 43 5.229 10.004 -1.266 1.00 0.00 H new ATOM 0 HD2 TYR A 43 1.382 9.296 0.424 1.00 0.00 H new ATOM 0 HE1 TYR A 43 4.781 12.419 -1.277 1.00 0.00 H new ATOM 0 HE2 TYR A 43 0.928 11.709 0.396 1.00 0.00 H new ATOM 0 HH TYR A 43 1.980 13.789 0.281 1.00 0.00 H new ATOM 692 N PRO A 44 4.569 5.909 -3.299 1.00 0.00 N ATOM 693 CA PRO A 44 5.496 4.855 -3.680 1.00 0.00 C ATOM 694 C PRO A 44 6.936 5.251 -3.371 1.00 0.00 C ATOM 695 O PRO A 44 7.523 6.091 -4.055 1.00 0.00 O ATOM 696 CB PRO A 44 5.290 4.705 -5.196 1.00 0.00 C ATOM 697 CG PRO A 44 4.132 5.582 -5.544 1.00 0.00 C ATOM 698 CD PRO A 44 4.065 6.627 -4.472 1.00 0.00 C ATOM 0 HA PRO A 44 5.315 3.928 -3.135 1.00 0.00 H new ATOM 0 HB2 PRO A 44 6.184 5.005 -5.743 1.00 0.00 H new ATOM 0 HB3 PRO A 44 5.087 3.667 -5.461 1.00 0.00 H new ATOM 0 HG2 PRO A 44 4.269 6.038 -6.525 1.00 0.00 H new ATOM 0 HG3 PRO A 44 3.207 5.007 -5.586 1.00 0.00 H new ATOM 0 HD2 PRO A 44 4.680 7.495 -4.712 1.00 0.00 H new ATOM 0 HD3 PRO A 44 3.048 6.989 -4.321 1.00 0.00 H new ATOM 706 N LEU A 45 7.490 4.654 -2.330 1.00 0.00 N ATOM 707 CA LEU A 45 8.827 5.001 -1.876 1.00 0.00 C ATOM 708 C LEU A 45 9.878 4.132 -2.555 1.00 0.00 C ATOM 709 O LEU A 45 9.553 3.123 -3.191 1.00 0.00 O ATOM 710 CB LEU A 45 8.921 4.862 -0.354 1.00 0.00 C ATOM 711 CG LEU A 45 7.964 5.759 0.441 1.00 0.00 C ATOM 712 CD1 LEU A 45 8.111 5.508 1.934 1.00 0.00 C ATOM 713 CD2 LEU A 45 8.214 7.227 0.121 1.00 0.00 C ATOM 0 H LEU A 45 7.034 3.925 -1.782 1.00 0.00 H new ATOM 0 HA LEU A 45 9.021 6.039 -2.148 1.00 0.00 H new ATOM 0 HB2 LEU A 45 8.727 3.823 -0.087 1.00 0.00 H new ATOM 0 HB3 LEU A 45 9.943 5.085 -0.047 1.00 0.00 H new ATOM 0 HG LEU A 45 6.943 5.512 0.149 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.424 6.154 2.481 1.00 0.00 H new ATOM 0 HD12 LEU A 45 7.880 4.465 2.152 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.134 5.725 2.240 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.525 7.847 0.695 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.240 7.487 0.382 1.00 0.00 H new ATOM 0 HD23 LEU A 45 8.056 7.399 -0.944 1.00 0.00 H new ATOM 725 N ASN A 46 11.131 4.535 -2.427 1.00 0.00 N ATOM 726 CA ASN A 46 12.239 3.808 -3.025 1.00 0.00 C ATOM 727 C ASN A 46 12.634 2.630 -2.138 1.00 0.00 C ATOM 728 O ASN A 46 12.469 2.681 -0.918 1.00 0.00 O ATOM 729 CB ASN A 46 13.431 4.748 -3.229 1.00 0.00 C ATOM 730 CG ASN A 46 14.604 4.080 -3.917 1.00 0.00 C ATOM 731 OD1 ASN A 46 14.434 3.188 -4.748 1.00 0.00 O ATOM 732 ND2 ASN A 46 15.805 4.514 -3.573 1.00 0.00 N ATOM 0 H ASN A 46 11.408 5.369 -1.910 1.00 0.00 H new ATOM 0 HA ASN A 46 11.928 3.422 -3.996 1.00 0.00 H new ATOM 0 HB2 ASN A 46 13.112 5.607 -3.820 1.00 0.00 H new ATOM 0 HB3 ASN A 46 13.755 5.130 -2.261 1.00 0.00 H new ATOM 0 HD21 ASN A 46 16.636 4.107 -4.001 1.00 0.00 H new ATOM 0 HD22 ASN A 46 15.900 5.256 -2.879 1.00 0.00 H new ATOM 739 N ASN A 47 13.146 1.573 -2.751 1.00 0.00 N ATOM 740 CA ASN A 47 13.542 0.385 -2.007 1.00 0.00 C ATOM 741 C ASN A 47 15.017 0.460 -1.637 1.00 0.00 C ATOM 742 O ASN A 47 15.886 0.588 -2.501 1.00 0.00 O ATOM 743 CB ASN A 47 13.250 -0.890 -2.808 1.00 0.00 C ATOM 744 CG ASN A 47 13.572 -2.150 -2.022 1.00 0.00 C ATOM 745 OD1 ASN A 47 13.614 -2.134 -0.792 1.00 0.00 O ATOM 746 ND2 ASN A 47 13.764 -3.258 -2.720 1.00 0.00 N ATOM 0 H ASN A 47 13.297 1.513 -3.758 1.00 0.00 H new ATOM 0 HA ASN A 47 12.954 0.346 -1.090 1.00 0.00 H new ATOM 0 HB2 ASN A 47 12.199 -0.903 -3.096 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.833 -0.880 -3.729 1.00 0.00 H new ATOM 0 HD21 ASN A 47 13.954 -4.137 -2.239 1.00 0.00 H new ATOM 0 HD22 ASN A 47 13.722 -3.233 -3.739 1.00 0.00 H new ATOM 753 N LEU A 48 15.286 0.420 -0.340 1.00 0.00 N ATOM 754 CA LEU A 48 16.642 0.498 0.173 1.00 0.00 C ATOM 755 C LEU A 48 17.397 -0.812 -0.023 1.00 0.00 C ATOM 756 O LEU A 48 18.627 -0.822 -0.081 1.00 0.00 O ATOM 757 CB LEU A 48 16.621 0.877 1.657 1.00 0.00 C ATOM 758 CG LEU A 48 16.299 2.344 1.971 1.00 0.00 C ATOM 759 CD1 LEU A 48 17.352 3.264 1.377 1.00 0.00 C ATOM 760 CD2 LEU A 48 14.916 2.738 1.475 1.00 0.00 C ATOM 0 H LEU A 48 14.571 0.333 0.383 1.00 0.00 H new ATOM 0 HA LEU A 48 17.166 1.269 -0.391 1.00 0.00 H new ATOM 0 HB2 LEU A 48 15.888 0.248 2.162 1.00 0.00 H new ATOM 0 HB3 LEU A 48 17.594 0.639 2.086 1.00 0.00 H new ATOM 0 HG LEU A 48 16.306 2.452 3.056 1.00 0.00 H new ATOM 0 HD11 LEU A 48 17.105 4.299 1.611 1.00 0.00 H new ATOM 0 HD12 LEU A 48 18.327 3.020 1.798 1.00 0.00 H new ATOM 0 HD13 LEU A 48 17.381 3.134 0.295 1.00 0.00 H new ATOM 0 HD21 LEU A 48 14.727 3.784 1.717 1.00 0.00 H new ATOM 0 HD22 LEU A 48 14.864 2.600 0.395 1.00 0.00 H new ATOM 0 HD23 LEU A 48 14.165 2.113 1.957 1.00 0.00 H new ATOM 772 N ASP A 49 16.676 -1.917 -0.134 1.00 0.00 N ATOM 773 CA ASP A 49 17.325 -3.210 -0.299 1.00 0.00 C ATOM 774 C ASP A 49 17.601 -3.462 -1.774 1.00 0.00 C ATOM 775 O ASP A 49 16.736 -3.241 -2.621 1.00 0.00 O ATOM 776 CB ASP A 49 16.470 -4.350 0.266 1.00 0.00 C ATOM 777 CG ASP A 49 17.311 -5.537 0.698 1.00 0.00 C ATOM 778 OD1 ASP A 49 18.162 -5.990 -0.091 1.00 0.00 O ATOM 779 OD2 ASP A 49 17.128 -6.021 1.838 1.00 0.00 O ATOM 0 H ASP A 49 15.657 -1.947 -0.113 1.00 0.00 H new ATOM 0 HA ASP A 49 18.262 -3.186 0.257 1.00 0.00 H new ATOM 0 HB2 ASP A 49 15.896 -3.984 1.118 1.00 0.00 H new ATOM 0 HB3 ASP A 49 15.751 -4.671 -0.488 1.00 0.00 H new ATOM 784 N GLN A 50 18.803 -3.915 -2.083 1.00 0.00 N ATOM 785 CA GLN A 50 19.172 -4.205 -3.463 1.00 0.00 C ATOM 786 C GLN A 50 18.775 -5.629 -3.833 1.00 0.00 C ATOM 787 O GLN A 50 19.028 -6.089 -4.947 1.00 0.00 O ATOM 788 CB GLN A 50 20.670 -3.993 -3.678 1.00 0.00 C ATOM 789 CG GLN A 50 21.549 -4.818 -2.752 1.00 0.00 C ATOM 790 CD GLN A 50 23.025 -4.621 -3.031 1.00 0.00 C ATOM 791 OE1 GLN A 50 23.424 -4.361 -4.166 1.00 0.00 O ATOM 792 NE2 GLN A 50 23.844 -4.732 -1.999 1.00 0.00 N ATOM 0 H GLN A 50 19.541 -4.091 -1.401 1.00 0.00 H new ATOM 0 HA GLN A 50 18.633 -3.516 -4.113 1.00 0.00 H new ATOM 0 HB2 GLN A 50 20.917 -4.238 -4.711 1.00 0.00 H new ATOM 0 HB3 GLN A 50 20.901 -2.937 -3.537 1.00 0.00 H new ATOM 0 HG2 GLN A 50 21.338 -4.547 -1.718 1.00 0.00 H new ATOM 0 HG3 GLN A 50 21.299 -5.873 -2.862 1.00 0.00 H new ATOM 0 HE21 GLN A 50 23.473 -4.949 -1.074 1.00 0.00 H new ATOM 0 HE22 GLN A 50 24.847 -4.601 -2.128 1.00 0.00 H new ATOM 801 N SER A 51 18.163 -6.322 -2.884 1.00 0.00 N ATOM 802 CA SER A 51 17.658 -7.663 -3.110 1.00 0.00 C ATOM 803 C SER A 51 16.481 -7.648 -4.084 1.00 0.00 C ATOM 804 O SER A 51 15.677 -6.720 -4.082 1.00 0.00 O ATOM 805 CB SER A 51 17.233 -8.278 -1.777 1.00 0.00 C ATOM 806 OG SER A 51 18.349 -8.433 -0.918 1.00 0.00 O ATOM 0 H SER A 51 18.004 -5.970 -1.940 1.00 0.00 H new ATOM 0 HA SER A 51 18.451 -8.265 -3.552 1.00 0.00 H new ATOM 0 HB2 SER A 51 16.486 -7.644 -1.300 1.00 0.00 H new ATOM 0 HB3 SER A 51 16.764 -9.247 -1.951 1.00 0.00 H new ATOM 0 HG SER A 51 18.665 -7.551 -0.630 1.00 0.00 H new ATOM 812 N PRO A 52 16.369 -8.683 -4.927 1.00 0.00 N ATOM 813 CA PRO A 52 15.275 -8.810 -5.892 1.00 0.00 C ATOM 814 C PRO A 52 13.981 -9.291 -5.241 1.00 0.00 C ATOM 815 O PRO A 52 13.006 -9.601 -5.924 1.00 0.00 O ATOM 816 CB PRO A 52 15.802 -9.860 -6.868 1.00 0.00 C ATOM 817 CG PRO A 52 16.693 -10.722 -6.041 1.00 0.00 C ATOM 818 CD PRO A 52 17.318 -9.813 -5.017 1.00 0.00 C ATOM 0 HA PRO A 52 15.021 -7.857 -6.356 1.00 0.00 H new ATOM 0 HB2 PRO A 52 14.989 -10.437 -7.308 1.00 0.00 H new ATOM 0 HB3 PRO A 52 16.348 -9.399 -7.691 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.127 -11.520 -5.560 1.00 0.00 H new ATOM 0 HG3 PRO A 52 17.456 -11.198 -6.657 1.00 0.00 H new ATOM 0 HD2 PRO A 52 17.437 -10.314 -4.056 1.00 0.00 H new ATOM 0 HD3 PRO A 52 18.308 -9.481 -5.328 1.00 0.00 H new ATOM 826 N GLU A 53 13.998 -9.376 -3.920 1.00 0.00 N ATOM 827 CA GLU A 53 12.888 -9.943 -3.167 1.00 0.00 C ATOM 828 C GLU A 53 12.463 -9.015 -2.030 1.00 0.00 C ATOM 829 O GLU A 53 11.320 -8.557 -1.981 1.00 0.00 O ATOM 830 CB GLU A 53 13.310 -11.300 -2.599 1.00 0.00 C ATOM 831 CG GLU A 53 13.821 -12.265 -3.656 1.00 0.00 C ATOM 832 CD GLU A 53 14.662 -13.379 -3.075 1.00 0.00 C ATOM 833 OE1 GLU A 53 15.868 -13.153 -2.840 1.00 0.00 O ATOM 834 OE2 GLU A 53 14.130 -14.489 -2.869 1.00 0.00 O ATOM 0 H GLU A 53 14.775 -9.057 -3.342 1.00 0.00 H new ATOM 0 HA GLU A 53 12.037 -10.066 -3.837 1.00 0.00 H new ATOM 0 HB2 GLU A 53 14.088 -11.146 -1.851 1.00 0.00 H new ATOM 0 HB3 GLU A 53 12.460 -11.751 -2.086 1.00 0.00 H new ATOM 0 HG2 GLU A 53 12.973 -12.696 -4.188 1.00 0.00 H new ATOM 0 HG3 GLU A 53 14.411 -11.715 -4.389 1.00 0.00 H new ATOM 841 N HIS A 54 13.406 -8.735 -1.130 1.00 0.00 N ATOM 842 CA HIS A 54 13.119 -7.967 0.082 1.00 0.00 C ATOM 843 C HIS A 54 12.854 -6.504 -0.237 1.00 0.00 C ATOM 844 O HIS A 54 13.449 -5.939 -1.157 1.00 0.00 O ATOM 845 CB HIS A 54 14.285 -8.058 1.072 1.00 0.00 C ATOM 846 CG HIS A 54 14.519 -9.424 1.647 1.00 0.00 C ATOM 847 ND1 HIS A 54 15.132 -9.624 2.864 1.00 0.00 N ATOM 848 CD2 HIS A 54 14.258 -10.657 1.157 1.00 0.00 C ATOM 849 CE1 HIS A 54 15.233 -10.917 3.098 1.00 0.00 C ATOM 850 NE2 HIS A 54 14.712 -11.570 2.077 1.00 0.00 N ATOM 0 H HIS A 54 14.379 -9.030 -1.218 1.00 0.00 H new ATOM 0 HA HIS A 54 12.224 -8.399 0.530 1.00 0.00 H new ATOM 0 HB2 HIS A 54 15.195 -7.730 0.570 1.00 0.00 H new ATOM 0 HB3 HIS A 54 14.103 -7.361 1.890 1.00 0.00 H new ATOM 0 HD2 HIS A 54 13.780 -10.882 0.215 1.00 0.00 H new ATOM 0 HE1 HIS A 54 15.669 -11.367 3.978 1.00 0.00 H new ATOM 0 HE2 HIS A 54 14.656 -12.584 1.986 1.00 0.00 H new ATOM 859 N PHE A 55 11.975 -5.893 0.543 1.00 0.00 N ATOM 860 CA PHE A 55 11.628 -4.494 0.352 1.00 0.00 C ATOM 861 C PHE A 55 11.796 -3.709 1.651 1.00 0.00 C ATOM 862 O PHE A 55 11.511 -4.212 2.738 1.00 0.00 O ATOM 863 CB PHE A 55 10.187 -4.363 -0.166 1.00 0.00 C ATOM 864 CG PHE A 55 9.124 -4.670 0.860 1.00 0.00 C ATOM 865 CD1 PHE A 55 8.966 -5.951 1.361 1.00 0.00 C ATOM 866 CD2 PHE A 55 8.274 -3.673 1.316 1.00 0.00 C ATOM 867 CE1 PHE A 55 7.987 -6.232 2.296 1.00 0.00 C ATOM 868 CE2 PHE A 55 7.295 -3.947 2.251 1.00 0.00 C ATOM 869 CZ PHE A 55 7.150 -5.229 2.741 1.00 0.00 C ATOM 0 H PHE A 55 11.488 -6.346 1.316 1.00 0.00 H new ATOM 0 HA PHE A 55 12.307 -4.076 -0.391 1.00 0.00 H new ATOM 0 HB2 PHE A 55 10.037 -3.348 -0.534 1.00 0.00 H new ATOM 0 HB3 PHE A 55 10.058 -5.032 -1.016 1.00 0.00 H new ATOM 0 HD1 PHE A 55 9.616 -6.742 1.017 1.00 0.00 H new ATOM 0 HD2 PHE A 55 8.379 -2.668 0.934 1.00 0.00 H new ATOM 0 HE1 PHE A 55 7.877 -7.236 2.678 1.00 0.00 H new ATOM 0 HE2 PHE A 55 6.644 -3.159 2.598 1.00 0.00 H new ATOM 0 HZ PHE A 55 6.384 -5.447 3.470 1.00 0.00 H new ATOM 879 N SER A 56 12.293 -2.491 1.533 1.00 0.00 N ATOM 880 CA SER A 56 12.394 -1.577 2.661 1.00 0.00 C ATOM 881 C SER A 56 12.289 -0.142 2.164 1.00 0.00 C ATOM 882 O SER A 56 12.896 0.214 1.156 1.00 0.00 O ATOM 883 CB SER A 56 13.713 -1.777 3.408 1.00 0.00 C ATOM 884 OG SER A 56 13.836 -3.113 3.869 1.00 0.00 O ATOM 0 H SER A 56 12.638 -2.106 0.654 1.00 0.00 H new ATOM 0 HA SER A 56 11.577 -1.784 3.352 1.00 0.00 H new ATOM 0 HB2 SER A 56 14.548 -1.537 2.750 1.00 0.00 H new ATOM 0 HB3 SER A 56 13.765 -1.090 4.253 1.00 0.00 H new ATOM 0 HG SER A 56 13.011 -3.604 3.674 1.00 0.00 H new ATOM 890 N MET A 57 11.509 0.668 2.859 1.00 0.00 N ATOM 891 CA MET A 57 11.271 2.044 2.440 1.00 0.00 C ATOM 892 C MET A 57 11.968 3.032 3.370 1.00 0.00 C ATOM 893 O MET A 57 11.942 4.234 3.126 1.00 0.00 O ATOM 894 CB MET A 57 9.768 2.339 2.392 1.00 0.00 C ATOM 895 CG MET A 57 9.080 2.287 3.750 1.00 0.00 C ATOM 896 SD MET A 57 8.980 0.620 4.437 1.00 0.00 S ATOM 897 CE MET A 57 7.944 -0.189 3.219 1.00 0.00 C ATOM 0 H MET A 57 11.028 0.399 3.717 1.00 0.00 H new ATOM 0 HA MET A 57 11.688 2.164 1.440 1.00 0.00 H new ATOM 0 HB2 MET A 57 9.616 3.327 1.958 1.00 0.00 H new ATOM 0 HB3 MET A 57 9.289 1.621 1.726 1.00 0.00 H new ATOM 0 HG2 MET A 57 9.619 2.928 4.447 1.00 0.00 H new ATOM 0 HG3 MET A 57 8.073 2.694 3.655 1.00 0.00 H new ATOM 0 HE1 MET A 57 7.228 -0.838 3.724 1.00 0.00 H new ATOM 0 HE2 MET A 57 7.407 0.563 2.641 1.00 0.00 H new ATOM 0 HE3 MET A 57 8.566 -0.785 2.551 1.00 0.00 H new ATOM 907 N ASP A 58 12.589 2.500 4.426 1.00 0.00 N ATOM 908 CA ASP A 58 13.323 3.297 5.425 1.00 0.00 C ATOM 909 C ASP A 58 12.365 4.157 6.264 1.00 0.00 C ATOM 910 O ASP A 58 11.404 4.724 5.744 1.00 0.00 O ATOM 911 CB ASP A 58 14.373 4.190 4.740 1.00 0.00 C ATOM 912 CG ASP A 58 15.380 4.777 5.708 1.00 0.00 C ATOM 913 OD1 ASP A 58 15.066 5.785 6.374 1.00 0.00 O ATOM 914 OD2 ASP A 58 16.502 4.235 5.808 1.00 0.00 O ATOM 0 H ASP A 58 12.599 1.498 4.617 1.00 0.00 H new ATOM 0 HA ASP A 58 13.832 2.603 6.094 1.00 0.00 H new ATOM 0 HB2 ASP A 58 14.901 3.606 3.986 1.00 0.00 H new ATOM 0 HB3 ASP A 58 13.866 5.001 4.217 1.00 0.00 H new ATOM 919 N PRO A 59 12.630 4.285 7.576 1.00 0.00 N ATOM 920 CA PRO A 59 11.777 5.066 8.483 1.00 0.00 C ATOM 921 C PRO A 59 11.821 6.571 8.210 1.00 0.00 C ATOM 922 O PRO A 59 10.888 7.294 8.557 1.00 0.00 O ATOM 923 CB PRO A 59 12.351 4.757 9.869 1.00 0.00 C ATOM 924 CG PRO A 59 13.759 4.348 9.617 1.00 0.00 C ATOM 925 CD PRO A 59 13.751 3.648 8.289 1.00 0.00 C ATOM 0 HA PRO A 59 10.727 4.799 8.366 1.00 0.00 H new ATOM 0 HB2 PRO A 59 12.304 5.630 10.520 1.00 0.00 H new ATOM 0 HB3 PRO A 59 11.790 3.962 10.361 1.00 0.00 H new ATOM 0 HG2 PRO A 59 14.420 5.214 9.598 1.00 0.00 H new ATOM 0 HG3 PRO A 59 14.121 3.688 10.405 1.00 0.00 H new ATOM 0 HD2 PRO A 59 14.693 3.782 7.758 1.00 0.00 H new ATOM 0 HD3 PRO A 59 13.598 2.575 8.401 1.00 0.00 H new ATOM 933 N ARG A 60 12.897 7.043 7.592 1.00 0.00 N ATOM 934 CA ARG A 60 13.039 8.464 7.294 1.00 0.00 C ATOM 935 C ARG A 60 12.155 8.861 6.119 1.00 0.00 C ATOM 936 O ARG A 60 11.517 9.917 6.138 1.00 0.00 O ATOM 937 CB ARG A 60 14.495 8.806 7.002 1.00 0.00 C ATOM 938 CG ARG A 60 15.381 8.771 8.233 1.00 0.00 C ATOM 939 CD ARG A 60 16.843 8.698 7.845 1.00 0.00 C ATOM 940 NE ARG A 60 17.123 7.484 7.086 1.00 0.00 N ATOM 941 CZ ARG A 60 18.274 7.226 6.478 1.00 0.00 C ATOM 942 NH1 ARG A 60 19.258 8.114 6.486 1.00 0.00 N ATOM 943 NH2 ARG A 60 18.432 6.077 5.844 1.00 0.00 N ATOM 0 H ARG A 60 13.681 6.466 7.288 1.00 0.00 H new ATOM 0 HA ARG A 60 12.718 9.028 8.170 1.00 0.00 H new ATOM 0 HB2 ARG A 60 14.884 8.105 6.263 1.00 0.00 H new ATOM 0 HB3 ARG A 60 14.545 9.799 6.556 1.00 0.00 H new ATOM 0 HG2 ARG A 60 15.205 9.661 8.838 1.00 0.00 H new ATOM 0 HG3 ARG A 60 15.121 7.910 8.849 1.00 0.00 H new ATOM 0 HD2 ARG A 60 17.109 9.572 7.251 1.00 0.00 H new ATOM 0 HD3 ARG A 60 17.462 8.721 8.742 1.00 0.00 H new ATOM 0 HE ARG A 60 16.383 6.785 7.018 1.00 0.00 H new ATOM 0 HH11 ARG A 60 19.135 9.007 6.963 1.00 0.00 H new ATOM 0 HH12 ARG A 60 20.138 7.904 6.015 1.00 0.00 H new ATOM 0 HH21 ARG A 60 17.672 5.397 5.825 1.00 0.00 H new ATOM 0 HH22 ARG A 60 19.314 5.871 5.374 1.00 0.00 H new ATOM 957 N GLU A 61 12.105 8.006 5.105 1.00 0.00 N ATOM 958 CA GLU A 61 11.223 8.232 3.971 1.00 0.00 C ATOM 959 C GLU A 61 9.773 8.121 4.429 1.00 0.00 C ATOM 960 O GLU A 61 8.905 8.876 3.982 1.00 0.00 O ATOM 961 CB GLU A 61 11.511 7.230 2.854 1.00 0.00 C ATOM 962 CG GLU A 61 12.931 7.311 2.307 1.00 0.00 C ATOM 963 CD GLU A 61 13.196 8.590 1.538 1.00 0.00 C ATOM 964 OE1 GLU A 61 13.608 9.595 2.157 1.00 0.00 O ATOM 965 OE2 GLU A 61 13.010 8.587 0.303 1.00 0.00 O ATOM 0 H GLU A 61 12.663 7.154 5.046 1.00 0.00 H new ATOM 0 HA GLU A 61 11.400 9.232 3.576 1.00 0.00 H new ATOM 0 HB2 GLU A 61 11.333 6.222 3.228 1.00 0.00 H new ATOM 0 HB3 GLU A 61 10.807 7.397 2.038 1.00 0.00 H new ATOM 0 HG2 GLU A 61 13.638 7.237 3.133 1.00 0.00 H new ATOM 0 HG3 GLU A 61 13.113 6.457 1.655 1.00 0.00 H new ATOM 972 N GLN A 62 9.519 7.180 5.339 1.00 0.00 N ATOM 973 CA GLN A 62 8.211 7.059 5.970 1.00 0.00 C ATOM 974 C GLN A 62 7.868 8.339 6.719 1.00 0.00 C ATOM 975 O GLN A 62 6.780 8.883 6.564 1.00 0.00 O ATOM 976 CB GLN A 62 8.174 5.885 6.950 1.00 0.00 C ATOM 977 CG GLN A 62 8.341 4.524 6.301 1.00 0.00 C ATOM 978 CD GLN A 62 8.263 3.391 7.306 1.00 0.00 C ATOM 979 OE1 GLN A 62 9.270 2.982 7.880 1.00 0.00 O ATOM 980 NE2 GLN A 62 7.064 2.877 7.524 1.00 0.00 N ATOM 0 H GLN A 62 10.204 6.492 5.653 1.00 0.00 H new ATOM 0 HA GLN A 62 7.480 6.883 5.181 1.00 0.00 H new ATOM 0 HB2 GLN A 62 8.962 6.020 7.691 1.00 0.00 H new ATOM 0 HB3 GLN A 62 7.225 5.905 7.487 1.00 0.00 H new ATOM 0 HG2 GLN A 62 7.569 4.388 5.544 1.00 0.00 H new ATOM 0 HG3 GLN A 62 9.302 4.485 5.787 1.00 0.00 H new ATOM 0 HE21 GLN A 62 6.253 3.245 7.027 1.00 0.00 H new ATOM 0 HE22 GLN A 62 6.950 2.112 8.189 1.00 0.00 H new ATOM 989 N LEU A 63 8.819 8.813 7.518 1.00 0.00 N ATOM 990 CA LEU A 63 8.640 10.021 8.317 1.00 0.00 C ATOM 991 C LEU A 63 8.281 11.209 7.431 1.00 0.00 C ATOM 992 O LEU A 63 7.413 12.014 7.772 1.00 0.00 O ATOM 993 CB LEU A 63 9.921 10.319 9.098 1.00 0.00 C ATOM 994 CG LEU A 63 9.845 11.501 10.062 1.00 0.00 C ATOM 995 CD1 LEU A 63 8.847 11.220 11.175 1.00 0.00 C ATOM 996 CD2 LEU A 63 11.219 11.798 10.638 1.00 0.00 C ATOM 0 H LEU A 63 9.732 8.373 7.630 1.00 0.00 H new ATOM 0 HA LEU A 63 7.820 9.856 9.016 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.196 9.429 9.664 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.725 10.505 8.386 1.00 0.00 H new ATOM 0 HG LEU A 63 9.503 12.377 9.511 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.807 12.074 11.852 1.00 0.00 H new ATOM 0 HD12 LEU A 63 7.860 11.051 10.745 1.00 0.00 H new ATOM 0 HD13 LEU A 63 9.158 10.333 11.727 1.00 0.00 H new ATOM 0 HD21 LEU A 63 11.151 12.643 11.324 1.00 0.00 H new ATOM 0 HD22 LEU A 63 11.585 10.923 11.175 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.908 12.042 9.829 1.00 0.00 H new ATOM 1008 N THR A 64 8.947 11.303 6.289 1.00 0.00 N ATOM 1009 CA THR A 64 8.676 12.364 5.333 1.00 0.00 C ATOM 1010 C THR A 64 7.243 12.260 4.806 1.00 0.00 C ATOM 1011 O THR A 64 6.516 13.253 4.747 1.00 0.00 O ATOM 1012 CB THR A 64 9.670 12.308 4.156 1.00 0.00 C ATOM 1013 OG1 THR A 64 11.017 12.327 4.655 1.00 0.00 O ATOM 1014 CG2 THR A 64 9.456 13.482 3.209 1.00 0.00 C ATOM 0 H THR A 64 9.681 10.655 6.003 1.00 0.00 H new ATOM 0 HA THR A 64 8.796 13.317 5.848 1.00 0.00 H new ATOM 0 HB THR A 64 9.498 11.384 3.605 1.00 0.00 H new ATOM 0 HG1 THR A 64 11.205 11.486 5.122 1.00 0.00 H new ATOM 0 HG21 THR A 64 10.169 13.421 2.387 1.00 0.00 H new ATOM 0 HG22 THR A 64 8.441 13.449 2.813 1.00 0.00 H new ATOM 0 HG23 THR A 64 9.605 14.417 3.749 1.00 0.00 H new ATOM 1022 N ALA A 65 6.835 11.044 4.455 1.00 0.00 N ATOM 1023 CA ALA A 65 5.496 10.803 3.930 1.00 0.00 C ATOM 1024 C ALA A 65 4.426 11.051 4.994 1.00 0.00 C ATOM 1025 O ALA A 65 3.392 11.650 4.713 1.00 0.00 O ATOM 1026 CB ALA A 65 5.389 9.384 3.386 1.00 0.00 C ATOM 0 H ALA A 65 7.415 10.208 4.525 1.00 0.00 H new ATOM 0 HA ALA A 65 5.323 11.507 3.116 1.00 0.00 H new ATOM 0 HB1 ALA A 65 4.384 9.218 2.997 1.00 0.00 H new ATOM 0 HB2 ALA A 65 6.115 9.246 2.585 1.00 0.00 H new ATOM 0 HB3 ALA A 65 5.591 8.672 4.186 1.00 0.00 H new ATOM 1032 N VAL A 66 4.684 10.590 6.214 1.00 0.00 N ATOM 1033 CA VAL A 66 3.746 10.772 7.316 1.00 0.00 C ATOM 1034 C VAL A 66 3.574 12.254 7.651 1.00 0.00 C ATOM 1035 O VAL A 66 2.462 12.711 7.923 1.00 0.00 O ATOM 1036 CB VAL A 66 4.190 10.001 8.583 1.00 0.00 C ATOM 1037 CG1 VAL A 66 3.258 10.284 9.752 1.00 0.00 C ATOM 1038 CG2 VAL A 66 4.254 8.505 8.308 1.00 0.00 C ATOM 0 H VAL A 66 5.536 10.087 6.464 1.00 0.00 H new ATOM 0 HA VAL A 66 2.789 10.367 6.986 1.00 0.00 H new ATOM 0 HB VAL A 66 5.188 10.349 8.852 1.00 0.00 H new ATOM 0 HG11 VAL A 66 3.594 9.729 10.628 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.266 11.351 9.973 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.245 9.974 9.493 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.568 7.982 9.211 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.269 8.148 8.006 1.00 0.00 H new ATOM 0 HG23 VAL A 66 4.971 8.312 7.510 1.00 0.00 H new ATOM 1048 N LYS A 67 4.673 13.002 7.619 1.00 0.00 N ATOM 1049 CA LYS A 67 4.631 14.432 7.906 1.00 0.00 C ATOM 1050 C LYS A 67 3.704 15.149 6.931 1.00 0.00 C ATOM 1051 O LYS A 67 2.860 15.955 7.334 1.00 0.00 O ATOM 1052 CB LYS A 67 6.032 15.038 7.823 1.00 0.00 C ATOM 1053 CG LYS A 67 6.075 16.508 8.210 1.00 0.00 C ATOM 1054 CD LYS A 67 7.481 17.088 8.136 1.00 0.00 C ATOM 1055 CE LYS A 67 8.343 16.694 9.332 1.00 0.00 C ATOM 1056 NZ LYS A 67 8.663 15.241 9.359 1.00 0.00 N ATOM 0 H LYS A 67 5.602 12.643 7.398 1.00 0.00 H new ATOM 0 HA LYS A 67 4.248 14.561 8.918 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.702 14.478 8.475 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.409 14.926 6.807 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.417 17.074 7.551 1.00 0.00 H new ATOM 0 HG3 LYS A 67 5.689 16.626 9.223 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.962 16.748 7.219 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.419 18.175 8.080 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.271 17.265 9.309 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.825 16.964 10.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.633 15.106 9.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 7.997 14.751 9.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.582 14.850 8.399 1.00 0.00 H new ATOM 1070 N ASP A 68 3.867 14.837 5.650 1.00 0.00 N ATOM 1071 CA ASP A 68 3.038 15.412 4.596 1.00 0.00 C ATOM 1072 C ASP A 68 1.600 14.950 4.747 1.00 0.00 C ATOM 1073 O ASP A 68 0.659 15.737 4.644 1.00 0.00 O ATOM 1074 CB ASP A 68 3.562 14.985 3.227 1.00 0.00 C ATOM 1075 CG ASP A 68 2.738 15.549 2.085 1.00 0.00 C ATOM 1076 OD1 ASP A 68 3.023 16.684 1.644 1.00 0.00 O ATOM 1077 OD2 ASP A 68 1.825 14.848 1.601 1.00 0.00 O ATOM 0 H ASP A 68 4.573 14.182 5.314 1.00 0.00 H new ATOM 0 HA ASP A 68 3.078 16.498 4.679 1.00 0.00 H new ATOM 0 HB2 ASP A 68 4.596 15.312 3.120 1.00 0.00 H new ATOM 0 HB3 ASP A 68 3.564 13.897 3.166 1.00 0.00 H new ATOM 1082 N MET A 69 1.454 13.664 5.014 1.00 0.00 N ATOM 1083 CA MET A 69 0.148 13.044 5.174 1.00 0.00 C ATOM 1084 C MET A 69 -0.654 13.755 6.257 1.00 0.00 C ATOM 1085 O MET A 69 -1.799 14.149 6.042 1.00 0.00 O ATOM 1086 CB MET A 69 0.327 11.577 5.568 1.00 0.00 C ATOM 1087 CG MET A 69 -0.851 10.695 5.210 1.00 0.00 C ATOM 1088 SD MET A 69 -0.970 10.406 3.437 1.00 0.00 S ATOM 1089 CE MET A 69 0.603 9.608 3.132 1.00 0.00 C ATOM 0 H MET A 69 2.236 13.019 5.126 1.00 0.00 H new ATOM 0 HA MET A 69 -0.390 13.117 4.229 1.00 0.00 H new ATOM 0 HB2 MET A 69 1.221 11.187 5.081 1.00 0.00 H new ATOM 0 HB3 MET A 69 0.498 11.518 6.643 1.00 0.00 H new ATOM 0 HG2 MET A 69 -0.758 9.740 5.727 1.00 0.00 H new ATOM 0 HG3 MET A 69 -1.771 11.160 5.563 1.00 0.00 H new ATOM 0 HE1 MET A 69 0.491 8.877 2.331 1.00 0.00 H new ATOM 0 HE2 MET A 69 1.340 10.356 2.840 1.00 0.00 H new ATOM 0 HE3 MET A 69 0.937 9.104 4.039 1.00 0.00 H new ATOM 1099 N ARG A 70 -0.017 13.961 7.402 1.00 0.00 N ATOM 1100 CA ARG A 70 -0.673 14.572 8.550 1.00 0.00 C ATOM 1101 C ARG A 70 -0.967 16.046 8.281 1.00 0.00 C ATOM 1102 O ARG A 70 -1.946 16.596 8.782 1.00 0.00 O ATOM 1103 CB ARG A 70 0.211 14.429 9.789 1.00 0.00 C ATOM 1104 CG ARG A 70 -0.530 14.615 11.105 1.00 0.00 C ATOM 1105 CD ARG A 70 0.413 14.482 12.289 1.00 0.00 C ATOM 1106 NE ARG A 70 -0.303 14.353 13.559 1.00 0.00 N ATOM 1107 CZ ARG A 70 0.108 14.880 14.708 1.00 0.00 C ATOM 1108 NH1 ARG A 70 1.168 15.683 14.736 1.00 0.00 N ATOM 1109 NH2 ARG A 70 -0.563 14.620 15.823 1.00 0.00 N ATOM 0 H ARG A 70 0.959 13.712 7.561 1.00 0.00 H new ATOM 0 HA ARG A 70 -1.619 14.060 8.724 1.00 0.00 H new ATOM 0 HB2 ARG A 70 0.673 13.442 9.781 1.00 0.00 H new ATOM 0 HB3 ARG A 70 1.018 15.159 9.732 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -1.005 15.596 11.123 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -1.326 13.875 11.185 1.00 0.00 H new ATOM 0 HD2 ARG A 70 1.052 13.611 12.145 1.00 0.00 H new ATOM 0 HD3 ARG A 70 1.066 15.354 12.330 1.00 0.00 H new ATOM 0 HE ARG A 70 -1.175 13.824 13.563 1.00 0.00 H new ATOM 0 HH11 ARG A 70 1.669 15.897 13.874 1.00 0.00 H new ATOM 0 HH12 ARG A 70 1.480 16.085 15.620 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -1.387 14.020 15.794 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -0.254 15.020 16.709 1.00 0.00 H new ATOM 1123 N LYS A 71 -0.118 16.671 7.473 1.00 0.00 N ATOM 1124 CA LYS A 71 -0.270 18.082 7.130 1.00 0.00 C ATOM 1125 C LYS A 71 -1.508 18.292 6.258 1.00 0.00 C ATOM 1126 O LYS A 71 -2.203 19.301 6.374 1.00 0.00 O ATOM 1127 CB LYS A 71 0.978 18.570 6.394 1.00 0.00 C ATOM 1128 CG LYS A 71 1.008 20.069 6.138 1.00 0.00 C ATOM 1129 CD LYS A 71 2.261 20.477 5.379 1.00 0.00 C ATOM 1130 CE LYS A 71 2.295 21.974 5.126 1.00 0.00 C ATOM 1131 NZ LYS A 71 3.480 22.381 4.328 1.00 0.00 N ATOM 0 H LYS A 71 0.688 16.220 7.040 1.00 0.00 H new ATOM 0 HA LYS A 71 -0.394 18.655 8.049 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.859 18.295 6.974 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.050 18.049 5.439 1.00 0.00 H new ATOM 0 HG2 LYS A 71 0.125 20.360 5.569 1.00 0.00 H new ATOM 0 HG3 LYS A 71 0.966 20.603 7.087 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.144 20.183 5.947 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.301 19.945 4.428 1.00 0.00 H new ATOM 0 HE2 LYS A 71 1.387 22.273 4.603 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.302 22.502 6.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 3.462 23.410 4.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 4.348 22.120 4.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 3.461 21.898 3.407 1.00 0.00 H new ATOM 1145 N ASN A 72 -1.771 17.323 5.390 1.00 0.00 N ATOM 1146 CA ASN A 72 -2.915 17.381 4.481 1.00 0.00 C ATOM 1147 C ASN A 72 -4.190 16.891 5.159 1.00 0.00 C ATOM 1148 O ASN A 72 -5.294 17.065 4.636 1.00 0.00 O ATOM 1149 CB ASN A 72 -2.635 16.541 3.235 1.00 0.00 C ATOM 1150 CG ASN A 72 -1.679 17.217 2.272 1.00 0.00 C ATOM 1151 OD1 ASN A 72 -1.709 18.435 2.096 1.00 0.00 O ATOM 1152 ND2 ASN A 72 -0.805 16.432 1.664 1.00 0.00 N ATOM 0 H ASN A 72 -1.204 16.480 5.294 1.00 0.00 H new ATOM 0 HA ASN A 72 -3.063 18.422 4.194 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.220 15.579 3.537 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -3.575 16.336 2.722 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -0.121 16.832 1.021 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -0.815 15.427 1.838 1.00 0.00 H new ATOM 1159 N GLY A 73 -4.039 16.275 6.323 1.00 0.00 N ATOM 1160 CA GLY A 73 -5.189 15.773 7.053 1.00 0.00 C ATOM 1161 C GLY A 73 -5.445 14.305 6.788 1.00 0.00 C ATOM 1162 O GLY A 73 -6.528 13.787 7.078 1.00 0.00 O ATOM 0 H GLY A 73 -3.140 16.113 6.777 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -5.032 15.925 8.121 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -6.072 16.349 6.775 1.00 0.00 H new ATOM 1166 N TRP A 74 -4.448 13.632 6.242 1.00 0.00 N ATOM 1167 CA TRP A 74 -4.552 12.219 5.931 1.00 0.00 C ATOM 1168 C TRP A 74 -3.788 11.384 6.948 1.00 0.00 C ATOM 1169 O TRP A 74 -2.990 11.906 7.726 1.00 0.00 O ATOM 1170 CB TRP A 74 -4.016 11.929 4.527 1.00 0.00 C ATOM 1171 CG TRP A 74 -4.926 12.374 3.429 1.00 0.00 C ATOM 1172 CD1 TRP A 74 -6.270 12.182 3.363 1.00 0.00 C ATOM 1173 CD2 TRP A 74 -4.557 13.059 2.227 1.00 0.00 C ATOM 1174 NE1 TRP A 74 -6.765 12.704 2.199 1.00 0.00 N ATOM 1175 CE2 TRP A 74 -5.735 13.251 1.483 1.00 0.00 C ATOM 1176 CE3 TRP A 74 -3.350 13.529 1.711 1.00 0.00 C ATOM 1177 CZ2 TRP A 74 -5.741 13.894 0.248 1.00 0.00 C ATOM 1178 CZ3 TRP A 74 -3.355 14.168 0.484 1.00 0.00 C ATOM 1179 CH2 TRP A 74 -4.544 14.346 -0.234 1.00 0.00 C ATOM 0 H TRP A 74 -3.548 14.048 6.003 1.00 0.00 H new ATOM 0 HA TRP A 74 -5.607 11.950 5.970 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.051 12.421 4.408 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -3.841 10.858 4.429 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -6.862 11.689 4.120 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -7.744 12.688 1.911 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -2.429 13.397 2.259 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -6.657 14.031 -0.308 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -2.426 14.536 0.073 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -4.515 14.851 -1.188 1.00 0.00 H new ATOM 1190 N VAL A 75 -4.039 10.086 6.932 1.00 0.00 N ATOM 1191 CA VAL A 75 -3.345 9.150 7.804 1.00 0.00 C ATOM 1192 C VAL A 75 -2.798 7.980 6.995 1.00 0.00 C ATOM 1193 O VAL A 75 -3.242 7.724 5.875 1.00 0.00 O ATOM 1194 CB VAL A 75 -4.264 8.608 8.922 1.00 0.00 C ATOM 1195 CG1 VAL A 75 -4.677 9.722 9.872 1.00 0.00 C ATOM 1196 CG2 VAL A 75 -5.491 7.930 8.332 1.00 0.00 C ATOM 0 H VAL A 75 -4.727 9.651 6.317 1.00 0.00 H new ATOM 0 HA VAL A 75 -2.526 9.696 8.271 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.701 7.866 9.489 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.323 9.316 10.650 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -3.789 10.158 10.329 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.215 10.491 9.318 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.123 7.556 9.138 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.052 8.649 7.734 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.179 7.098 7.700 1.00 0.00 H new ATOM 1206 N MET A 76 -1.827 7.282 7.560 1.00 0.00 N ATOM 1207 CA MET A 76 -1.241 6.121 6.910 1.00 0.00 C ATOM 1208 C MET A 76 -2.184 4.927 7.032 1.00 0.00 C ATOM 1209 O MET A 76 -2.572 4.541 8.135 1.00 0.00 O ATOM 1210 CB MET A 76 0.118 5.800 7.536 1.00 0.00 C ATOM 1211 CG MET A 76 0.801 4.575 6.939 1.00 0.00 C ATOM 1212 SD MET A 76 2.445 4.285 7.627 1.00 0.00 S ATOM 1213 CE MET A 76 2.061 4.152 9.370 1.00 0.00 C ATOM 0 H MET A 76 -1.426 7.500 8.472 1.00 0.00 H new ATOM 0 HA MET A 76 -1.091 6.340 5.853 1.00 0.00 H new ATOM 0 HB2 MET A 76 0.774 6.663 7.418 1.00 0.00 H new ATOM 0 HB3 MET A 76 -0.014 5.644 8.607 1.00 0.00 H new ATOM 0 HG2 MET A 76 0.179 3.697 7.113 1.00 0.00 H new ATOM 0 HG3 MET A 76 0.881 4.700 5.859 1.00 0.00 H new ATOM 0 HE1 MET A 76 2.766 3.472 9.847 1.00 0.00 H new ATOM 0 HE2 MET A 76 2.134 5.135 9.835 1.00 0.00 H new ATOM 0 HE3 MET A 76 1.048 3.768 9.491 1.00 0.00 H new ATOM 1223 N LEU A 77 -2.561 4.362 5.896 1.00 0.00 N ATOM 1224 CA LEU A 77 -3.516 3.262 5.868 1.00 0.00 C ATOM 1225 C LEU A 77 -2.807 1.913 5.799 1.00 0.00 C ATOM 1226 O LEU A 77 -3.339 0.896 6.244 1.00 0.00 O ATOM 1227 CB LEU A 77 -4.460 3.425 4.677 1.00 0.00 C ATOM 1228 CG LEU A 77 -5.223 4.751 4.639 1.00 0.00 C ATOM 1229 CD1 LEU A 77 -6.093 4.822 3.400 1.00 0.00 C ATOM 1230 CD2 LEU A 77 -6.067 4.925 5.894 1.00 0.00 C ATOM 0 H LEU A 77 -2.220 4.647 4.978 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.093 3.288 6.792 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -3.882 3.328 3.758 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -5.181 2.607 4.688 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.497 5.564 4.602 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.630 5.771 3.386 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -5.467 4.746 2.511 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.809 4.000 3.410 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.600 5.874 5.845 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.785 4.108 5.965 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.420 4.917 6.771 1.00 0.00 H new ATOM 1242 N GLY A 78 -1.608 1.908 5.239 1.00 0.00 N ATOM 1243 CA GLY A 78 -0.850 0.681 5.133 1.00 0.00 C ATOM 1244 C GLY A 78 0.296 0.800 4.154 1.00 0.00 C ATOM 1245 O GLY A 78 0.763 1.906 3.866 1.00 0.00 O ATOM 0 H GLY A 78 -1.146 2.733 4.856 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -0.460 0.411 6.114 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.511 -0.127 4.819 1.00 0.00 H new ATOM 1249 N ASN A 79 0.731 -0.335 3.629 1.00 0.00 N ATOM 1250 CA ASN A 79 1.851 -0.386 2.697 1.00 0.00 C ATOM 1251 C ASN A 79 1.591 -1.436 1.624 1.00 0.00 C ATOM 1252 O ASN A 79 0.565 -2.118 1.660 1.00 0.00 O ATOM 1253 CB ASN A 79 3.161 -0.692 3.440 1.00 0.00 C ATOM 1254 CG ASN A 79 3.091 -1.937 4.315 1.00 0.00 C ATOM 1255 OD1 ASN A 79 2.360 -2.881 4.033 1.00 0.00 O ATOM 1256 ND2 ASN A 79 3.862 -1.942 5.393 1.00 0.00 N ATOM 0 H ASN A 79 0.320 -1.246 3.835 1.00 0.00 H new ATOM 0 HA ASN A 79 1.950 0.589 2.219 1.00 0.00 H new ATOM 0 HB2 ASN A 79 3.962 -0.815 2.711 1.00 0.00 H new ATOM 0 HB3 ASN A 79 3.425 0.164 4.061 1.00 0.00 H new ATOM 0 HD21 ASN A 79 3.859 -2.748 6.018 1.00 0.00 H new ATOM 0 HD22 ASN A 79 4.458 -1.140 5.597 1.00 0.00 H new ATOM 1263 N PHE A 80 2.506 -1.565 0.672 1.00 0.00 N ATOM 1264 CA PHE A 80 2.340 -2.540 -0.396 1.00 0.00 C ATOM 1265 C PHE A 80 3.666 -3.181 -0.800 1.00 0.00 C ATOM 1266 O PHE A 80 4.720 -2.540 -0.775 1.00 0.00 O ATOM 1267 CB PHE A 80 1.646 -1.910 -1.616 1.00 0.00 C ATOM 1268 CG PHE A 80 2.353 -0.722 -2.214 1.00 0.00 C ATOM 1269 CD1 PHE A 80 2.100 0.560 -1.751 1.00 0.00 C ATOM 1270 CD2 PHE A 80 3.254 -0.885 -3.256 1.00 0.00 C ATOM 1271 CE1 PHE A 80 2.733 1.653 -2.312 1.00 0.00 C ATOM 1272 CE2 PHE A 80 3.893 0.205 -3.818 1.00 0.00 C ATOM 1273 CZ PHE A 80 3.631 1.476 -3.346 1.00 0.00 C ATOM 0 H PHE A 80 3.362 -1.013 0.618 1.00 0.00 H new ATOM 0 HA PHE A 80 1.701 -3.333 -0.007 1.00 0.00 H new ATOM 0 HB2 PHE A 80 1.537 -2.673 -2.386 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.641 -1.606 -1.325 1.00 0.00 H new ATOM 0 HD1 PHE A 80 1.400 0.706 -0.942 1.00 0.00 H new ATOM 0 HD2 PHE A 80 3.459 -1.876 -3.633 1.00 0.00 H new ATOM 0 HE1 PHE A 80 2.525 2.646 -1.942 1.00 0.00 H new ATOM 0 HE2 PHE A 80 4.596 0.062 -4.625 1.00 0.00 H new ATOM 0 HZ PHE A 80 4.127 2.329 -3.784 1.00 0.00 H new ATOM 1283 N HIS A 81 3.592 -4.461 -1.147 1.00 0.00 N ATOM 1284 CA HIS A 81 4.738 -5.220 -1.637 1.00 0.00 C ATOM 1285 C HIS A 81 4.326 -5.956 -2.910 1.00 0.00 C ATOM 1286 O HIS A 81 3.185 -6.394 -3.037 1.00 0.00 O ATOM 1287 CB HIS A 81 5.216 -6.213 -0.557 1.00 0.00 C ATOM 1288 CG HIS A 81 6.465 -6.993 -0.894 1.00 0.00 C ATOM 1289 ND1 HIS A 81 6.781 -8.195 -0.293 1.00 0.00 N ATOM 1290 CD2 HIS A 81 7.490 -6.727 -1.746 1.00 0.00 C ATOM 1291 CE1 HIS A 81 7.936 -8.632 -0.761 1.00 0.00 C ATOM 1292 NE2 HIS A 81 8.389 -7.762 -1.643 1.00 0.00 N ATOM 0 H HIS A 81 2.731 -5.005 -1.096 1.00 0.00 H new ATOM 0 HA HIS A 81 5.566 -4.548 -1.861 1.00 0.00 H new ATOM 0 HB2 HIS A 81 5.392 -5.661 0.366 1.00 0.00 H new ATOM 0 HB3 HIS A 81 4.411 -6.920 -0.357 1.00 0.00 H new ATOM 0 HD1 HIS A 81 6.210 -8.672 0.405 1.00 0.00 H new ATOM 0 HD2 HIS A 81 7.581 -5.862 -2.386 1.00 0.00 H new ATOM 0 HE1 HIS A 81 8.428 -9.549 -0.470 1.00 0.00 H new ATOM 0 HE2 HIS A 81 9.263 -7.844 -2.163 1.00 0.00 H new ATOM 1301 N SER A 82 5.244 -6.089 -3.845 1.00 0.00 N ATOM 1302 CA SER A 82 4.943 -6.701 -5.134 1.00 0.00 C ATOM 1303 C SER A 82 5.664 -8.031 -5.291 1.00 0.00 C ATOM 1304 O SER A 82 6.601 -8.323 -4.550 1.00 0.00 O ATOM 1305 CB SER A 82 5.365 -5.763 -6.264 1.00 0.00 C ATOM 1306 OG SER A 82 6.749 -5.472 -6.179 1.00 0.00 O ATOM 0 H SER A 82 6.211 -5.782 -3.741 1.00 0.00 H new ATOM 0 HA SER A 82 3.869 -6.880 -5.180 1.00 0.00 H new ATOM 0 HB2 SER A 82 5.143 -6.222 -7.227 1.00 0.00 H new ATOM 0 HB3 SER A 82 4.789 -4.839 -6.211 1.00 0.00 H new ATOM 0 HG SER A 82 7.266 -6.256 -6.460 1.00 0.00 H new ATOM 1312 N HIS A 83 5.157 -8.867 -6.191 1.00 0.00 N ATOM 1313 CA HIS A 83 5.878 -10.051 -6.638 1.00 0.00 C ATOM 1314 C HIS A 83 5.743 -10.202 -8.153 1.00 0.00 C ATOM 1315 O HIS A 83 4.678 -9.927 -8.713 1.00 0.00 O ATOM 1316 CB HIS A 83 5.363 -11.309 -5.933 1.00 0.00 C ATOM 1317 CG HIS A 83 5.899 -11.484 -4.549 1.00 0.00 C ATOM 1318 ND1 HIS A 83 7.164 -11.395 -4.078 1.00 0.00 N flip ATOM 1319 CD2 HIS A 83 5.109 -11.801 -3.464 1.00 0.00 C flip ATOM 1320 CE1 HIS A 83 7.117 -11.656 -2.732 1.00 0.00 C flip ATOM 1321 NE2 HIS A 83 5.866 -11.897 -2.386 1.00 0.00 N flip ATOM 0 H HIS A 83 4.243 -8.744 -6.627 1.00 0.00 H new ATOM 0 HA HIS A 83 6.930 -9.928 -6.382 1.00 0.00 H new ATOM 0 HB2 HIS A 83 4.275 -11.270 -5.889 1.00 0.00 H new ATOM 0 HB3 HIS A 83 5.627 -12.183 -6.529 1.00 0.00 H new ATOM 0 HD1 HIS A 83 7.998 -11.175 -4.623 1.00 0.00 H new ATOM 0 HD2 HIS A 83 4.039 -11.948 -3.491 1.00 0.00 H new ATOM 0 HE1 HIS A 83 7.966 -11.663 -2.064 1.00 0.00 H new ATOM 1330 N PRO A 84 6.813 -10.645 -8.835 1.00 0.00 N ATOM 1331 CA PRO A 84 6.834 -10.776 -10.285 1.00 0.00 C ATOM 1332 C PRO A 84 6.413 -12.159 -10.779 1.00 0.00 C ATOM 1333 O PRO A 84 5.511 -12.284 -11.602 1.00 0.00 O ATOM 1334 CB PRO A 84 8.306 -10.513 -10.635 1.00 0.00 C ATOM 1335 CG PRO A 84 9.081 -10.635 -9.352 1.00 0.00 C ATOM 1336 CD PRO A 84 8.109 -11.004 -8.259 1.00 0.00 C ATOM 0 HA PRO A 84 6.126 -10.094 -10.756 1.00 0.00 H new ATOM 0 HB2 PRO A 84 8.663 -11.231 -11.373 1.00 0.00 H new ATOM 0 HB3 PRO A 84 8.430 -9.521 -11.070 1.00 0.00 H new ATOM 0 HG2 PRO A 84 9.857 -11.395 -9.445 1.00 0.00 H new ATOM 0 HG3 PRO A 84 9.581 -9.695 -9.117 1.00 0.00 H new ATOM 0 HD2 PRO A 84 8.162 -12.065 -8.014 1.00 0.00 H new ATOM 0 HD3 PRO A 84 8.308 -10.454 -7.339 1.00 0.00 H new ATOM 1344 N ALA A 85 7.076 -13.196 -10.287 1.00 0.00 N ATOM 1345 CA ALA A 85 6.811 -14.552 -10.744 1.00 0.00 C ATOM 1346 C ALA A 85 6.080 -15.358 -9.681 1.00 0.00 C ATOM 1347 O ALA A 85 5.958 -16.577 -9.787 1.00 0.00 O ATOM 1348 CB ALA A 85 8.114 -15.238 -11.130 1.00 0.00 C ATOM 0 H ALA A 85 7.800 -13.124 -9.572 1.00 0.00 H new ATOM 0 HA ALA A 85 6.167 -14.496 -11.621 1.00 0.00 H new ATOM 0 HB1 ALA A 85 7.904 -16.252 -11.470 1.00 0.00 H new ATOM 0 HB2 ALA A 85 8.596 -14.678 -11.932 1.00 0.00 H new ATOM 0 HB3 ALA A 85 8.776 -15.275 -10.265 1.00 0.00 H new ATOM 1354 N THR A 86 5.582 -14.672 -8.666 1.00 0.00 N ATOM 1355 CA THR A 86 4.880 -15.322 -7.574 1.00 0.00 C ATOM 1356 C THR A 86 3.585 -14.586 -7.246 1.00 0.00 C ATOM 1357 O THR A 86 3.462 -13.389 -7.512 1.00 0.00 O ATOM 1358 CB THR A 86 5.769 -15.407 -6.319 1.00 0.00 C ATOM 1359 OG1 THR A 86 6.660 -14.283 -6.264 1.00 0.00 O ATOM 1360 CG2 THR A 86 6.569 -16.699 -6.314 1.00 0.00 C ATOM 0 H THR A 86 5.652 -13.658 -8.576 1.00 0.00 H new ATOM 0 HA THR A 86 4.635 -16.334 -7.895 1.00 0.00 H new ATOM 0 HB THR A 86 5.122 -15.393 -5.442 1.00 0.00 H new ATOM 0 HG1 THR A 86 7.219 -14.347 -5.461 1.00 0.00 H new ATOM 0 HG21 THR A 86 7.190 -16.739 -5.419 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.887 -17.549 -6.321 1.00 0.00 H new ATOM 0 HG23 THR A 86 7.205 -16.737 -7.199 1.00 0.00 H new ATOM 1368 N PRO A 87 2.597 -15.297 -6.678 1.00 0.00 N ATOM 1369 CA PRO A 87 1.294 -14.725 -6.339 1.00 0.00 C ATOM 1370 C PRO A 87 1.356 -13.799 -5.132 1.00 0.00 C ATOM 1371 O PRO A 87 2.403 -13.652 -4.489 1.00 0.00 O ATOM 1372 CB PRO A 87 0.421 -15.951 -6.020 1.00 0.00 C ATOM 1373 CG PRO A 87 1.226 -17.138 -6.435 1.00 0.00 C ATOM 1374 CD PRO A 87 2.661 -16.721 -6.330 1.00 0.00 C ATOM 0 HA PRO A 87 0.908 -14.111 -7.153 1.00 0.00 H new ATOM 0 HB2 PRO A 87 0.179 -15.994 -4.958 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -0.524 -15.910 -6.561 1.00 0.00 H new ATOM 0 HG2 PRO A 87 1.020 -17.993 -5.791 1.00 0.00 H new ATOM 0 HG3 PRO A 87 0.981 -17.439 -7.453 1.00 0.00 H new ATOM 0 HD2 PRO A 87 3.058 -16.877 -5.327 1.00 0.00 H new ATOM 0 HD3 PRO A 87 3.298 -17.279 -7.016 1.00 0.00 H new ATOM 1382 N ALA A 88 0.227 -13.187 -4.819 1.00 0.00 N ATOM 1383 CA ALA A 88 0.137 -12.281 -3.691 1.00 0.00 C ATOM 1384 C ALA A 88 -0.077 -13.060 -2.400 1.00 0.00 C ATOM 1385 O ALA A 88 -1.209 -13.349 -2.014 1.00 0.00 O ATOM 1386 CB ALA A 88 -0.980 -11.271 -3.906 1.00 0.00 C ATOM 0 H ALA A 88 -0.645 -13.303 -5.335 1.00 0.00 H new ATOM 0 HA ALA A 88 1.077 -11.735 -3.608 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -1.033 -10.599 -3.049 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -0.780 -10.693 -4.808 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -1.929 -11.796 -4.015 1.00 0.00 H new ATOM 1392 N ARG A 89 1.021 -13.430 -1.762 1.00 0.00 N ATOM 1393 CA ARG A 89 0.972 -14.177 -0.517 1.00 0.00 C ATOM 1394 C ARG A 89 2.038 -13.665 0.438 1.00 0.00 C ATOM 1395 O ARG A 89 3.093 -13.198 -0.001 1.00 0.00 O ATOM 1396 CB ARG A 89 1.195 -15.672 -0.779 1.00 0.00 C ATOM 1397 CG ARG A 89 2.584 -15.999 -1.311 1.00 0.00 C ATOM 1398 CD ARG A 89 2.811 -17.499 -1.395 1.00 0.00 C ATOM 1399 NE ARG A 89 4.175 -17.829 -1.807 1.00 0.00 N ATOM 1400 CZ ARG A 89 4.651 -19.072 -1.872 1.00 0.00 C ATOM 1401 NH1 ARG A 89 3.881 -20.100 -1.538 1.00 0.00 N ATOM 1402 NH2 ARG A 89 5.899 -19.286 -2.268 1.00 0.00 N ATOM 0 H ARG A 89 1.964 -13.223 -2.090 1.00 0.00 H new ATOM 0 HA ARG A 89 -0.013 -14.039 -0.070 1.00 0.00 H new ATOM 0 HB2 ARG A 89 1.031 -16.223 0.147 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.450 -16.022 -1.494 1.00 0.00 H new ATOM 0 HG2 ARG A 89 2.710 -15.555 -2.299 1.00 0.00 H new ATOM 0 HG3 ARG A 89 3.337 -15.552 -0.662 1.00 0.00 H new ATOM 0 HD2 ARG A 89 2.607 -17.951 -0.424 1.00 0.00 H new ATOM 0 HD3 ARG A 89 2.105 -17.933 -2.103 1.00 0.00 H new ATOM 0 HE ARG A 89 4.799 -17.062 -2.059 1.00 0.00 H new ATOM 0 HH11 ARG A 89 2.922 -19.940 -1.230 1.00 0.00 H new ATOM 0 HH12 ARG A 89 4.248 -21.050 -1.589 1.00 0.00 H new ATOM 0 HH21 ARG A 89 6.495 -18.499 -2.523 1.00 0.00 H new ATOM 0 HH22 ARG A 89 6.262 -20.238 -2.317 1.00 0.00 H new ATOM 1416 N PRO A 90 1.771 -13.721 1.749 1.00 0.00 N ATOM 1417 CA PRO A 90 2.766 -13.395 2.764 1.00 0.00 C ATOM 1418 C PRO A 90 3.908 -14.403 2.744 1.00 0.00 C ATOM 1419 O PRO A 90 3.743 -15.555 3.153 1.00 0.00 O ATOM 1420 CB PRO A 90 1.994 -13.474 4.090 1.00 0.00 C ATOM 1421 CG PRO A 90 0.553 -13.467 3.707 1.00 0.00 C ATOM 1422 CD PRO A 90 0.483 -14.098 2.347 1.00 0.00 C ATOM 0 HA PRO A 90 3.220 -12.417 2.603 1.00 0.00 H new ATOM 0 HB2 PRO A 90 2.250 -14.379 4.641 1.00 0.00 H new ATOM 0 HB3 PRO A 90 2.234 -12.629 4.736 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -0.045 -14.025 4.427 1.00 0.00 H new ATOM 0 HG3 PRO A 90 0.160 -12.451 3.686 1.00 0.00 H new ATOM 0 HD2 PRO A 90 0.366 -15.180 2.408 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -0.359 -13.719 1.768 1.00 0.00 H new ATOM 1430 N SER A 91 5.052 -13.977 2.237 1.00 0.00 N ATOM 1431 CA SER A 91 6.198 -14.856 2.095 1.00 0.00 C ATOM 1432 C SER A 91 7.031 -14.840 3.373 1.00 0.00 C ATOM 1433 O SER A 91 6.623 -14.240 4.374 1.00 0.00 O ATOM 1434 CB SER A 91 7.027 -14.410 0.894 1.00 0.00 C ATOM 1435 OG SER A 91 6.195 -14.228 -0.243 1.00 0.00 O ATOM 0 H SER A 91 5.211 -13.022 1.915 1.00 0.00 H new ATOM 0 HA SER A 91 5.861 -15.879 1.928 1.00 0.00 H new ATOM 0 HB2 SER A 91 7.544 -13.479 1.127 1.00 0.00 H new ATOM 0 HB3 SER A 91 7.793 -15.154 0.676 1.00 0.00 H new ATOM 0 HG SER A 91 6.412 -13.375 -0.674 1.00 0.00 H new ATOM 1441 N ALA A 92 8.194 -15.492 3.341 1.00 0.00 N ATOM 1442 CA ALA A 92 9.055 -15.586 4.516 1.00 0.00 C ATOM 1443 C ALA A 92 9.401 -14.206 5.058 1.00 0.00 C ATOM 1444 O ALA A 92 9.424 -13.990 6.271 1.00 0.00 O ATOM 1445 CB ALA A 92 10.323 -16.355 4.184 1.00 0.00 C ATOM 0 H ALA A 92 8.560 -15.962 2.513 1.00 0.00 H new ATOM 0 HA ALA A 92 8.508 -16.125 5.290 1.00 0.00 H new ATOM 0 HB1 ALA A 92 10.954 -16.416 5.071 1.00 0.00 H new ATOM 0 HB2 ALA A 92 10.063 -17.361 3.854 1.00 0.00 H new ATOM 0 HB3 ALA A 92 10.863 -15.841 3.389 1.00 0.00 H new ATOM 1451 N GLU A 93 9.663 -13.271 4.154 1.00 0.00 N ATOM 1452 CA GLU A 93 9.991 -11.912 4.550 1.00 0.00 C ATOM 1453 C GLU A 93 8.754 -11.158 5.037 1.00 0.00 C ATOM 1454 O GLU A 93 8.799 -10.523 6.085 1.00 0.00 O ATOM 1455 CB GLU A 93 10.674 -11.155 3.405 1.00 0.00 C ATOM 1456 CG GLU A 93 9.870 -11.113 2.117 1.00 0.00 C ATOM 1457 CD GLU A 93 10.573 -10.333 1.033 1.00 0.00 C ATOM 1458 OE1 GLU A 93 10.474 -9.089 1.034 1.00 0.00 O ATOM 1459 OE2 GLU A 93 11.230 -10.963 0.177 1.00 0.00 O ATOM 0 H GLU A 93 9.654 -13.430 3.146 1.00 0.00 H new ATOM 0 HA GLU A 93 10.692 -11.974 5.383 1.00 0.00 H new ATOM 0 HB2 GLU A 93 10.874 -10.133 3.728 1.00 0.00 H new ATOM 0 HB3 GLU A 93 11.639 -11.620 3.202 1.00 0.00 H new ATOM 0 HG2 GLU A 93 9.688 -12.130 1.771 1.00 0.00 H new ATOM 0 HG3 GLU A 93 8.896 -10.664 2.313 1.00 0.00 H new ATOM 1466 N ASP A 94 7.649 -11.258 4.297 1.00 0.00 N ATOM 1467 CA ASP A 94 6.419 -10.533 4.641 1.00 0.00 C ATOM 1468 C ASP A 94 5.940 -10.922 6.039 1.00 0.00 C ATOM 1469 O ASP A 94 5.456 -10.086 6.800 1.00 0.00 O ATOM 1470 CB ASP A 94 5.299 -10.823 3.630 1.00 0.00 C ATOM 1471 CG ASP A 94 5.680 -10.540 2.187 1.00 0.00 C ATOM 1472 OD1 ASP A 94 5.640 -9.364 1.763 1.00 0.00 O ATOM 1473 OD2 ASP A 94 5.997 -11.506 1.461 1.00 0.00 O ATOM 0 H ASP A 94 7.578 -11.832 3.457 1.00 0.00 H new ATOM 0 HA ASP A 94 6.652 -9.468 4.615 1.00 0.00 H new ATOM 0 HB2 ASP A 94 5.005 -11.869 3.719 1.00 0.00 H new ATOM 0 HB3 ASP A 94 4.426 -10.224 3.889 1.00 0.00 H new ATOM 1478 N LYS A 95 6.089 -12.202 6.363 1.00 0.00 N ATOM 1479 CA LYS A 95 5.703 -12.729 7.668 1.00 0.00 C ATOM 1480 C LYS A 95 6.529 -12.062 8.773 1.00 0.00 C ATOM 1481 O LYS A 95 6.002 -11.681 9.818 1.00 0.00 O ATOM 1482 CB LYS A 95 5.919 -14.251 7.678 1.00 0.00 C ATOM 1483 CG LYS A 95 5.021 -15.037 8.634 1.00 0.00 C ATOM 1484 CD LYS A 95 5.373 -14.810 10.096 1.00 0.00 C ATOM 1485 CE LYS A 95 4.737 -15.862 10.997 1.00 0.00 C ATOM 1486 NZ LYS A 95 3.259 -15.925 10.840 1.00 0.00 N ATOM 0 H LYS A 95 6.479 -12.901 5.731 1.00 0.00 H new ATOM 0 HA LYS A 95 4.651 -12.513 7.854 1.00 0.00 H new ATOM 0 HB2 LYS A 95 5.763 -14.629 6.668 1.00 0.00 H new ATOM 0 HB3 LYS A 95 6.959 -14.451 7.937 1.00 0.00 H new ATOM 0 HG2 LYS A 95 3.982 -14.751 8.467 1.00 0.00 H new ATOM 0 HG3 LYS A 95 5.100 -16.100 8.407 1.00 0.00 H new ATOM 0 HD2 LYS A 95 6.456 -14.833 10.218 1.00 0.00 H new ATOM 0 HD3 LYS A 95 5.039 -13.819 10.401 1.00 0.00 H new ATOM 0 HE2 LYS A 95 5.166 -16.838 10.770 1.00 0.00 H new ATOM 0 HE3 LYS A 95 4.980 -15.641 12.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 2.859 -16.554 11.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 2.857 -14.972 10.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 3.026 -16.293 9.896 1.00 0.00 H new ATOM 1500 N ARG A 96 7.828 -11.926 8.527 1.00 0.00 N ATOM 1501 CA ARG A 96 8.743 -11.336 9.496 1.00 0.00 C ATOM 1502 C ARG A 96 8.613 -9.815 9.549 1.00 0.00 C ATOM 1503 O ARG A 96 8.784 -9.207 10.605 1.00 0.00 O ATOM 1504 CB ARG A 96 10.185 -11.715 9.169 1.00 0.00 C ATOM 1505 CG ARG A 96 10.490 -13.192 9.360 1.00 0.00 C ATOM 1506 CD ARG A 96 11.954 -13.485 9.086 1.00 0.00 C ATOM 1507 NE ARG A 96 12.831 -12.633 9.883 1.00 0.00 N ATOM 1508 CZ ARG A 96 14.058 -12.276 9.518 1.00 0.00 C ATOM 1509 NH1 ARG A 96 14.598 -12.762 8.405 1.00 0.00 N ATOM 1510 NH2 ARG A 96 14.750 -11.443 10.282 1.00 0.00 N ATOM 0 H ARG A 96 8.273 -12.219 7.657 1.00 0.00 H new ATOM 0 HA ARG A 96 8.474 -11.733 10.475 1.00 0.00 H new ATOM 0 HB2 ARG A 96 10.398 -11.440 8.136 1.00 0.00 H new ATOM 0 HB3 ARG A 96 10.856 -11.131 9.799 1.00 0.00 H new ATOM 0 HG2 ARG A 96 10.240 -13.490 10.378 1.00 0.00 H new ATOM 0 HG3 ARG A 96 9.865 -13.785 8.692 1.00 0.00 H new ATOM 0 HD2 ARG A 96 12.164 -14.532 9.307 1.00 0.00 H new ATOM 0 HD3 ARG A 96 12.164 -13.334 8.027 1.00 0.00 H new ATOM 0 HE ARG A 96 12.480 -12.290 10.777 1.00 0.00 H new ATOM 0 HH11 ARG A 96 14.070 -13.414 7.824 1.00 0.00 H new ATOM 0 HH12 ARG A 96 15.540 -12.483 8.131 1.00 0.00 H new ATOM 0 HH21 ARG A 96 14.340 -11.081 11.143 1.00 0.00 H new ATOM 0 HH22 ARG A 96 15.692 -11.164 10.009 1.00 0.00 H new ATOM 1524 N LEU A 97 8.310 -9.205 8.409 1.00 0.00 N ATOM 1525 CA LEU A 97 8.240 -7.752 8.303 1.00 0.00 C ATOM 1526 C LEU A 97 6.892 -7.218 8.788 1.00 0.00 C ATOM 1527 O LEU A 97 6.532 -6.068 8.522 1.00 0.00 O ATOM 1528 CB LEU A 97 8.503 -7.322 6.856 1.00 0.00 C ATOM 1529 CG LEU A 97 9.884 -7.703 6.309 1.00 0.00 C ATOM 1530 CD1 LEU A 97 10.056 -7.201 4.887 1.00 0.00 C ATOM 1531 CD2 LEU A 97 10.989 -7.158 7.204 1.00 0.00 C ATOM 0 H LEU A 97 8.108 -9.698 7.539 1.00 0.00 H new ATOM 0 HA LEU A 97 9.009 -7.326 8.947 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.740 -7.766 6.216 1.00 0.00 H new ATOM 0 HB3 LEU A 97 8.387 -6.240 6.787 1.00 0.00 H new ATOM 0 HG LEU A 97 9.956 -8.791 6.300 1.00 0.00 H new ATOM 0 HD11 LEU A 97 11.043 -7.482 4.519 1.00 0.00 H new ATOM 0 HD12 LEU A 97 9.291 -7.644 4.250 1.00 0.00 H new ATOM 0 HD13 LEU A 97 9.958 -6.116 4.870 1.00 0.00 H new ATOM 0 HD21 LEU A 97 11.960 -7.440 6.797 1.00 0.00 H new ATOM 0 HD22 LEU A 97 10.917 -6.071 7.250 1.00 0.00 H new ATOM 0 HD23 LEU A 97 10.882 -7.572 8.207 1.00 0.00 H new ATOM 1543 N ALA A 98 6.159 -8.055 9.505 1.00 0.00 N ATOM 1544 CA ALA A 98 4.914 -7.646 10.127 1.00 0.00 C ATOM 1545 C ALA A 98 5.206 -6.783 11.348 1.00 0.00 C ATOM 1546 O ALA A 98 5.429 -7.290 12.448 1.00 0.00 O ATOM 1547 CB ALA A 98 4.094 -8.864 10.517 1.00 0.00 C ATOM 0 H ALA A 98 6.410 -9.030 9.670 1.00 0.00 H new ATOM 0 HA ALA A 98 4.335 -7.060 9.413 1.00 0.00 H new ATOM 0 HB1 ALA A 98 3.163 -8.542 10.983 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.870 -9.452 9.627 1.00 0.00 H new ATOM 0 HB3 ALA A 98 4.660 -9.473 11.222 1.00 0.00 H new ATOM 1553 N PHE A 99 5.245 -5.481 11.136 1.00 0.00 N ATOM 1554 CA PHE A 99 5.615 -4.544 12.190 1.00 0.00 C ATOM 1555 C PHE A 99 4.397 -3.833 12.767 1.00 0.00 C ATOM 1556 O PHE A 99 4.390 -3.452 13.939 1.00 0.00 O ATOM 1557 CB PHE A 99 6.605 -3.503 11.659 1.00 0.00 C ATOM 1558 CG PHE A 99 7.883 -4.087 11.125 1.00 0.00 C ATOM 1559 CD1 PHE A 99 8.640 -4.962 11.890 1.00 0.00 C ATOM 1560 CD2 PHE A 99 8.333 -3.751 9.859 1.00 0.00 C ATOM 1561 CE1 PHE A 99 9.820 -5.489 11.401 1.00 0.00 C ATOM 1562 CE2 PHE A 99 9.513 -4.277 9.365 1.00 0.00 C ATOM 1563 CZ PHE A 99 10.256 -5.147 10.137 1.00 0.00 C ATOM 0 H PHE A 99 5.025 -5.043 10.241 1.00 0.00 H new ATOM 0 HA PHE A 99 6.083 -5.124 12.985 1.00 0.00 H new ATOM 0 HB2 PHE A 99 6.122 -2.929 10.868 1.00 0.00 H new ATOM 0 HB3 PHE A 99 6.845 -2.804 12.460 1.00 0.00 H new ATOM 0 HD1 PHE A 99 8.303 -5.235 12.879 1.00 0.00 H new ATOM 0 HD2 PHE A 99 7.756 -3.070 9.251 1.00 0.00 H new ATOM 0 HE1 PHE A 99 10.401 -6.168 12.008 1.00 0.00 H new ATOM 0 HE2 PHE A 99 9.853 -4.007 8.376 1.00 0.00 H new ATOM 0 HZ PHE A 99 11.177 -5.559 9.753 1.00 0.00 H new ATOM 1573 N ASP A 100 3.370 -3.662 11.950 1.00 0.00 N ATOM 1574 CA ASP A 100 2.202 -2.889 12.352 1.00 0.00 C ATOM 1575 C ASP A 100 0.913 -3.590 11.955 1.00 0.00 C ATOM 1576 O ASP A 100 0.392 -3.373 10.861 1.00 0.00 O ATOM 1577 CB ASP A 100 2.242 -1.479 11.761 1.00 0.00 C ATOM 1578 CG ASP A 100 2.609 -0.431 12.792 1.00 0.00 C ATOM 1579 OD1 ASP A 100 3.815 -0.237 13.054 1.00 0.00 O ATOM 1580 OD2 ASP A 100 1.691 0.205 13.352 1.00 0.00 O ATOM 0 H ASP A 100 3.320 -4.046 11.006 1.00 0.00 H new ATOM 0 HA ASP A 100 2.226 -2.807 13.439 1.00 0.00 H new ATOM 0 HB2 ASP A 100 2.964 -1.450 10.945 1.00 0.00 H new ATOM 0 HB3 ASP A 100 1.268 -1.239 11.334 1.00 0.00 H new ATOM 1585 N PRO A 101 0.396 -4.461 12.836 1.00 0.00 N ATOM 1586 CA PRO A 101 -0.824 -5.242 12.577 1.00 0.00 C ATOM 1587 C PRO A 101 -2.069 -4.368 12.411 1.00 0.00 C ATOM 1588 O PRO A 101 -3.155 -4.864 12.111 1.00 0.00 O ATOM 1589 CB PRO A 101 -0.955 -6.135 13.818 1.00 0.00 C ATOM 1590 CG PRO A 101 -0.168 -5.443 14.877 1.00 0.00 C ATOM 1591 CD PRO A 101 0.960 -4.748 14.169 1.00 0.00 C ATOM 0 HA PRO A 101 -0.749 -5.797 11.642 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -1.998 -6.250 14.113 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -0.566 -7.135 13.627 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -0.787 -4.728 15.419 1.00 0.00 H new ATOM 0 HG3 PRO A 101 0.211 -6.156 15.609 1.00 0.00 H new ATOM 0 HD2 PRO A 101 1.258 -3.835 14.685 1.00 0.00 H new ATOM 0 HD3 PRO A 101 1.845 -5.381 14.104 1.00 0.00 H new ATOM 1599 N SER A 102 -1.909 -3.069 12.618 1.00 0.00 N ATOM 1600 CA SER A 102 -3.007 -2.130 12.461 1.00 0.00 C ATOM 1601 C SER A 102 -2.993 -1.515 11.065 1.00 0.00 C ATOM 1602 O SER A 102 -3.848 -0.698 10.722 1.00 0.00 O ATOM 1603 CB SER A 102 -2.914 -1.037 13.523 1.00 0.00 C ATOM 1604 OG SER A 102 -2.741 -1.609 14.811 1.00 0.00 O ATOM 0 H SER A 102 -1.026 -2.641 12.896 1.00 0.00 H new ATOM 0 HA SER A 102 -3.946 -2.668 12.588 1.00 0.00 H new ATOM 0 HB2 SER A 102 -2.079 -0.373 13.298 1.00 0.00 H new ATOM 0 HB3 SER A 102 -3.818 -0.428 13.507 1.00 0.00 H new ATOM 0 HG SER A 102 -2.681 -0.896 15.480 1.00 0.00 H new ATOM 1610 N LEU A 103 -2.016 -1.912 10.260 1.00 0.00 N ATOM 1611 CA LEU A 103 -1.912 -1.438 8.890 1.00 0.00 C ATOM 1612 C LEU A 103 -2.325 -2.533 7.923 1.00 0.00 C ATOM 1613 O LEU A 103 -2.161 -3.720 8.207 1.00 0.00 O ATOM 1614 CB LEU A 103 -0.480 -0.995 8.572 1.00 0.00 C ATOM 1615 CG LEU A 103 0.008 0.256 9.302 1.00 0.00 C ATOM 1616 CD1 LEU A 103 1.438 0.576 8.900 1.00 0.00 C ATOM 1617 CD2 LEU A 103 -0.903 1.439 9.009 1.00 0.00 C ATOM 0 H LEU A 103 -1.282 -2.564 10.536 1.00 0.00 H new ATOM 0 HA LEU A 103 -2.579 -0.583 8.779 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.195 -1.817 8.809 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.404 -0.819 7.499 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.018 0.061 10.374 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.773 1.469 9.427 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.085 -0.262 9.159 1.00 0.00 H new ATOM 0 HD13 LEU A 103 1.483 0.751 7.825 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.538 2.319 9.538 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.909 1.637 7.937 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.915 1.210 9.342 1.00 0.00 H new ATOM 1629 N SER A 104 -2.873 -2.137 6.790 1.00 0.00 N ATOM 1630 CA SER A 104 -3.229 -3.088 5.756 1.00 0.00 C ATOM 1631 C SER A 104 -2.040 -3.335 4.836 1.00 0.00 C ATOM 1632 O SER A 104 -1.532 -2.410 4.195 1.00 0.00 O ATOM 1633 CB SER A 104 -4.431 -2.584 4.957 1.00 0.00 C ATOM 1634 OG SER A 104 -5.574 -2.457 5.789 1.00 0.00 O ATOM 0 H SER A 104 -3.081 -1.165 6.563 1.00 0.00 H new ATOM 0 HA SER A 104 -3.504 -4.031 6.229 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.195 -1.620 4.506 1.00 0.00 H new ATOM 0 HB3 SER A 104 -4.645 -3.274 4.140 1.00 0.00 H new ATOM 0 HG SER A 104 -6.367 -2.303 5.234 1.00 0.00 H new ATOM 1640 N TYR A 105 -1.578 -4.575 4.810 1.00 0.00 N ATOM 1641 CA TYR A 105 -0.492 -4.972 3.929 1.00 0.00 C ATOM 1642 C TYR A 105 -1.050 -5.401 2.579 1.00 0.00 C ATOM 1643 O TYR A 105 -1.653 -6.470 2.458 1.00 0.00 O ATOM 1644 CB TYR A 105 0.316 -6.119 4.549 1.00 0.00 C ATOM 1645 CG TYR A 105 1.273 -5.701 5.650 1.00 0.00 C ATOM 1646 CD1 TYR A 105 0.812 -5.155 6.844 1.00 0.00 C ATOM 1647 CD2 TYR A 105 2.645 -5.865 5.492 1.00 0.00 C ATOM 1648 CE1 TYR A 105 1.692 -4.785 7.847 1.00 0.00 C ATOM 1649 CE2 TYR A 105 3.530 -5.500 6.490 1.00 0.00 C ATOM 1650 CZ TYR A 105 3.050 -4.962 7.665 1.00 0.00 C ATOM 1651 OH TYR A 105 3.931 -4.595 8.662 1.00 0.00 O ATOM 0 H TYR A 105 -1.942 -5.328 5.394 1.00 0.00 H new ATOM 0 HA TYR A 105 0.171 -4.118 3.790 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -0.378 -6.857 4.951 1.00 0.00 H new ATOM 0 HB3 TYR A 105 0.885 -6.612 3.760 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -0.249 -5.018 6.991 1.00 0.00 H new ATOM 0 HD2 TYR A 105 3.026 -6.285 4.573 1.00 0.00 H new ATOM 0 HE1 TYR A 105 1.319 -4.360 8.767 1.00 0.00 H new ATOM 0 HE2 TYR A 105 4.592 -5.636 6.350 1.00 0.00 H new ATOM 0 HH TYR A 105 4.827 -4.927 8.445 1.00 0.00 H new ATOM 1661 N LEU A 106 -0.882 -4.556 1.574 1.00 0.00 N ATOM 1662 CA LEU A 106 -1.348 -4.875 0.235 1.00 0.00 C ATOM 1663 C LEU A 106 -0.238 -5.538 -0.563 1.00 0.00 C ATOM 1664 O LEU A 106 0.906 -5.089 -0.553 1.00 0.00 O ATOM 1665 CB LEU A 106 -1.857 -3.625 -0.498 1.00 0.00 C ATOM 1666 CG LEU A 106 -3.262 -3.153 -0.100 1.00 0.00 C ATOM 1667 CD1 LEU A 106 -3.264 -2.528 1.288 1.00 0.00 C ATOM 1668 CD2 LEU A 106 -3.804 -2.174 -1.130 1.00 0.00 C ATOM 0 H LEU A 106 -0.428 -3.647 1.660 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.184 -5.568 0.329 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -1.155 -2.810 -0.321 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.850 -3.825 -1.569 1.00 0.00 H new ATOM 0 HG LEU A 106 -3.914 -4.026 -0.071 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -4.274 -2.204 1.540 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.926 -3.263 2.018 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.594 -1.669 1.301 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.801 -1.849 -0.833 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -3.144 -1.309 -1.193 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.856 -2.662 -2.103 1.00 0.00 H new ATOM 1680 N ILE A 107 -0.572 -6.618 -1.241 1.00 0.00 N ATOM 1681 CA ILE A 107 0.401 -7.328 -2.049 1.00 0.00 C ATOM 1682 C ILE A 107 -0.051 -7.350 -3.500 1.00 0.00 C ATOM 1683 O ILE A 107 -1.190 -7.714 -3.801 1.00 0.00 O ATOM 1684 CB ILE A 107 0.630 -8.771 -1.543 1.00 0.00 C ATOM 1685 CG1 ILE A 107 0.987 -8.760 -0.052 1.00 0.00 C ATOM 1686 CG2 ILE A 107 1.738 -9.443 -2.347 1.00 0.00 C ATOM 1687 CD1 ILE A 107 1.162 -10.139 0.546 1.00 0.00 C ATOM 0 H ILE A 107 -1.508 -7.023 -1.249 1.00 0.00 H new ATOM 0 HA ILE A 107 1.350 -6.798 -1.968 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.291 -9.338 -1.677 1.00 0.00 H new ATOM 0 HG12 ILE A 107 1.909 -8.195 0.087 1.00 0.00 H new ATOM 0 HG13 ILE A 107 0.205 -8.234 0.495 1.00 0.00 H new ATOM 0 HG21 ILE A 107 1.889 -10.458 -1.980 1.00 0.00 H new ATOM 0 HG22 ILE A 107 1.456 -9.475 -3.399 1.00 0.00 H new ATOM 0 HG23 ILE A 107 2.663 -8.876 -2.237 1.00 0.00 H new ATOM 0 HD11 ILE A 107 1.413 -10.048 1.603 1.00 0.00 H new ATOM 0 HD12 ILE A 107 0.234 -10.702 0.441 1.00 0.00 H new ATOM 0 HD13 ILE A 107 1.965 -10.662 0.026 1.00 0.00 H new ATOM 1699 N ILE A 108 0.841 -6.942 -4.388 1.00 0.00 N ATOM 1700 CA ILE A 108 0.538 -6.866 -5.805 1.00 0.00 C ATOM 1701 C ILE A 108 1.187 -8.026 -6.544 1.00 0.00 C ATOM 1702 O ILE A 108 2.398 -8.232 -6.449 1.00 0.00 O ATOM 1703 CB ILE A 108 1.033 -5.539 -6.417 1.00 0.00 C ATOM 1704 CG1 ILE A 108 0.413 -4.349 -5.681 1.00 0.00 C ATOM 1705 CG2 ILE A 108 0.702 -5.480 -7.905 1.00 0.00 C ATOM 1706 CD1 ILE A 108 0.916 -3.007 -6.165 1.00 0.00 C ATOM 0 H ILE A 108 1.790 -6.656 -4.147 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.546 -6.917 -5.911 1.00 0.00 H new ATOM 0 HB ILE A 108 2.116 -5.489 -6.305 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -0.670 -4.385 -5.798 1.00 0.00 H new ATOM 0 HG13 ILE A 108 0.622 -4.443 -4.615 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.058 -4.537 -8.320 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.188 -6.309 -8.419 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.377 -5.551 -8.041 1.00 0.00 H new ATOM 0 HD11 ILE A 108 0.433 -2.211 -5.598 1.00 0.00 H new ATOM 0 HD12 ILE A 108 1.995 -2.950 -6.023 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.683 -2.891 -7.223 1.00 0.00 H new ATOM 1718 N SER A 109 0.379 -8.780 -7.265 1.00 0.00 N ATOM 1719 CA SER A 109 0.872 -9.916 -8.022 1.00 0.00 C ATOM 1720 C SER A 109 0.959 -9.571 -9.503 1.00 0.00 C ATOM 1721 O SER A 109 -0.060 -9.329 -10.155 1.00 0.00 O ATOM 1722 CB SER A 109 -0.039 -11.132 -7.817 1.00 0.00 C ATOM 1723 OG SER A 109 0.443 -12.265 -8.523 1.00 0.00 O ATOM 0 H SER A 109 -0.626 -8.626 -7.343 1.00 0.00 H new ATOM 0 HA SER A 109 1.871 -10.162 -7.661 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.104 -11.364 -6.754 1.00 0.00 H new ATOM 0 HB3 SER A 109 -1.048 -10.894 -8.154 1.00 0.00 H new ATOM 0 HG SER A 109 -0.285 -12.910 -8.643 1.00 0.00 H new ATOM 1729 N LEU A 110 2.179 -9.536 -10.026 1.00 0.00 N ATOM 1730 CA LEU A 110 2.393 -9.330 -11.449 1.00 0.00 C ATOM 1731 C LEU A 110 2.671 -10.667 -12.126 1.00 0.00 C ATOM 1732 O LEU A 110 3.087 -10.721 -13.287 1.00 0.00 O ATOM 1733 CB LEU A 110 3.542 -8.346 -11.702 1.00 0.00 C ATOM 1734 CG LEU A 110 3.271 -6.898 -11.267 1.00 0.00 C ATOM 1735 CD1 LEU A 110 4.403 -5.988 -11.709 1.00 0.00 C ATOM 1736 CD2 LEU A 110 1.942 -6.403 -11.823 1.00 0.00 C ATOM 0 H LEU A 110 3.035 -9.648 -9.483 1.00 0.00 H new ATOM 0 HA LEU A 110 1.489 -8.895 -11.875 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.429 -8.705 -11.180 1.00 0.00 H new ATOM 0 HB3 LEU A 110 3.775 -8.351 -12.767 1.00 0.00 H new ATOM 0 HG LEU A 110 3.214 -6.877 -10.179 1.00 0.00 H new ATOM 0 HD11 LEU A 110 4.193 -4.966 -11.392 1.00 0.00 H new ATOM 0 HD12 LEU A 110 5.337 -6.324 -11.258 1.00 0.00 H new ATOM 0 HD13 LEU A 110 4.493 -6.020 -12.795 1.00 0.00 H new ATOM 0 HD21 LEU A 110 1.773 -5.375 -11.501 1.00 0.00 H new ATOM 0 HD22 LEU A 110 1.966 -6.443 -12.912 1.00 0.00 H new ATOM 0 HD23 LEU A 110 1.135 -7.036 -11.454 1.00 0.00 H new ATOM 1748 N ALA A 111 2.424 -11.748 -11.384 1.00 0.00 N ATOM 1749 CA ALA A 111 2.553 -13.100 -11.917 1.00 0.00 C ATOM 1750 C ALA A 111 1.526 -13.330 -13.017 1.00 0.00 C ATOM 1751 O ALA A 111 1.714 -14.164 -13.903 1.00 0.00 O ATOM 1752 CB ALA A 111 2.384 -14.131 -10.809 1.00 0.00 C ATOM 0 H ALA A 111 2.132 -11.710 -10.407 1.00 0.00 H new ATOM 0 HA ALA A 111 3.551 -13.213 -12.340 1.00 0.00 H new ATOM 0 HB1 ALA A 111 2.483 -15.133 -11.226 1.00 0.00 H new ATOM 0 HB2 ALA A 111 3.150 -13.977 -10.049 1.00 0.00 H new ATOM 0 HB3 ALA A 111 1.398 -14.022 -10.358 1.00 0.00 H new ATOM 1758 N GLU A 112 0.438 -12.574 -12.944 1.00 0.00 N ATOM 1759 CA GLU A 112 -0.599 -12.610 -13.957 1.00 0.00 C ATOM 1760 C GLU A 112 -0.710 -11.237 -14.618 1.00 0.00 C ATOM 1761 O GLU A 112 -1.476 -10.382 -14.176 1.00 0.00 O ATOM 1762 CB GLU A 112 -1.937 -13.030 -13.346 1.00 0.00 C ATOM 1763 CG GLU A 112 -3.009 -13.296 -14.385 1.00 0.00 C ATOM 1764 CD GLU A 112 -2.552 -14.297 -15.425 1.00 0.00 C ATOM 1765 OE1 GLU A 112 -1.924 -13.879 -16.418 1.00 0.00 O ATOM 1766 OE2 GLU A 112 -2.811 -15.506 -15.251 1.00 0.00 O ATOM 0 H GLU A 112 0.253 -11.922 -12.182 1.00 0.00 H new ATOM 0 HA GLU A 112 -0.335 -13.348 -14.714 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -1.790 -13.928 -12.747 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -2.282 -12.248 -12.669 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -3.907 -13.669 -13.893 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -3.279 -12.361 -14.875 1.00 0.00 H new ATOM 1773 N PRO A 113 0.093 -10.995 -15.665 1.00 0.00 N ATOM 1774 CA PRO A 113 0.197 -9.678 -16.301 1.00 0.00 C ATOM 1775 C PRO A 113 -1.072 -9.268 -17.042 1.00 0.00 C ATOM 1776 O PRO A 113 -1.276 -8.090 -17.337 1.00 0.00 O ATOM 1777 CB PRO A 113 1.362 -9.843 -17.280 1.00 0.00 C ATOM 1778 CG PRO A 113 1.396 -11.301 -17.581 1.00 0.00 C ATOM 1779 CD PRO A 113 0.958 -11.993 -16.321 1.00 0.00 C ATOM 0 HA PRO A 113 0.348 -8.891 -15.563 1.00 0.00 H new ATOM 0 HB2 PRO A 113 1.206 -9.255 -18.184 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.301 -9.507 -16.839 1.00 0.00 H new ATOM 0 HG2 PRO A 113 0.732 -11.544 -18.411 1.00 0.00 H new ATOM 0 HG3 PRO A 113 2.398 -11.616 -17.872 1.00 0.00 H new ATOM 0 HD2 PRO A 113 0.417 -12.914 -16.536 1.00 0.00 H new ATOM 0 HD3 PRO A 113 1.808 -12.262 -15.694 1.00 0.00 H new ATOM 1787 N GLN A 114 -1.924 -10.240 -17.322 1.00 0.00 N ATOM 1788 CA GLN A 114 -3.163 -9.983 -18.042 1.00 0.00 C ATOM 1789 C GLN A 114 -4.238 -9.501 -17.078 1.00 0.00 C ATOM 1790 O GLN A 114 -5.211 -8.863 -17.478 1.00 0.00 O ATOM 1791 CB GLN A 114 -3.638 -11.247 -18.764 1.00 0.00 C ATOM 1792 CG GLN A 114 -4.225 -12.298 -17.836 1.00 0.00 C ATOM 1793 CD GLN A 114 -4.553 -13.595 -18.547 1.00 0.00 C ATOM 1794 OE1 GLN A 114 -5.656 -13.774 -19.067 1.00 0.00 O ATOM 1795 NE2 GLN A 114 -3.609 -14.522 -18.545 1.00 0.00 N ATOM 0 H GLN A 114 -1.781 -11.216 -17.062 1.00 0.00 H new ATOM 0 HA GLN A 114 -2.976 -9.207 -18.785 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -4.388 -10.971 -19.506 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -2.798 -11.682 -19.306 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -3.519 -12.500 -17.031 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -5.130 -11.903 -17.375 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -2.709 -14.333 -18.103 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -3.781 -15.426 -18.985 1.00 0.00 H new ATOM 1804 N LYS A 115 -4.046 -9.802 -15.804 1.00 0.00 N ATOM 1805 CA LYS A 115 -5.017 -9.458 -14.785 1.00 0.00 C ATOM 1806 C LYS A 115 -4.289 -9.084 -13.501 1.00 0.00 C ATOM 1807 O LYS A 115 -4.067 -9.933 -12.640 1.00 0.00 O ATOM 1808 CB LYS A 115 -5.962 -10.644 -14.537 1.00 0.00 C ATOM 1809 CG LYS A 115 -7.277 -10.284 -13.856 1.00 0.00 C ATOM 1810 CD LYS A 115 -8.340 -9.859 -14.865 1.00 0.00 C ATOM 1811 CE LYS A 115 -8.118 -8.445 -15.379 1.00 0.00 C ATOM 1812 NZ LYS A 115 -8.498 -7.421 -14.370 1.00 0.00 N ATOM 0 H LYS A 115 -3.220 -10.287 -15.452 1.00 0.00 H new ATOM 0 HA LYS A 115 -5.611 -8.608 -15.121 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -6.183 -11.120 -15.492 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -5.443 -11.382 -13.925 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -7.638 -11.141 -13.287 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -7.108 -9.476 -13.144 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -8.337 -10.553 -15.706 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -9.324 -9.924 -14.401 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -7.070 -8.317 -15.648 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -8.701 -8.293 -16.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -8.412 -6.473 -14.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -9.481 -7.579 -14.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -7.867 -7.494 -13.546 1.00 0.00 H new ATOM 1826 N PRO A 116 -3.870 -7.816 -13.378 1.00 0.00 N ATOM 1827 CA PRO A 116 -3.115 -7.346 -12.215 1.00 0.00 C ATOM 1828 C PRO A 116 -3.905 -7.508 -10.924 1.00 0.00 C ATOM 1829 O PRO A 116 -4.931 -6.856 -10.721 1.00 0.00 O ATOM 1830 CB PRO A 116 -2.867 -5.864 -12.506 1.00 0.00 C ATOM 1831 CG PRO A 116 -3.072 -5.714 -13.974 1.00 0.00 C ATOM 1832 CD PRO A 116 -4.100 -6.739 -14.353 1.00 0.00 C ATOM 0 HA PRO A 116 -2.197 -7.915 -12.071 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -3.556 -5.232 -11.946 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -1.858 -5.570 -12.217 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -3.414 -4.709 -14.220 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -2.141 -5.876 -14.517 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -5.112 -6.340 -14.283 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -3.965 -7.086 -15.377 1.00 0.00 H new ATOM 1840 N VAL A 117 -3.435 -8.389 -10.059 1.00 0.00 N ATOM 1841 CA VAL A 117 -4.138 -8.675 -8.822 1.00 0.00 C ATOM 1842 C VAL A 117 -3.518 -7.914 -7.658 1.00 0.00 C ATOM 1843 O VAL A 117 -2.325 -8.044 -7.379 1.00 0.00 O ATOM 1844 CB VAL A 117 -4.134 -10.188 -8.502 1.00 0.00 C ATOM 1845 CG1 VAL A 117 -4.899 -10.476 -7.217 1.00 0.00 C ATOM 1846 CG2 VAL A 117 -4.718 -10.986 -9.657 1.00 0.00 C ATOM 0 H VAL A 117 -2.572 -8.917 -10.190 1.00 0.00 H new ATOM 0 HA VAL A 117 -5.169 -8.350 -8.959 1.00 0.00 H new ATOM 0 HB VAL A 117 -3.098 -10.496 -8.359 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -4.881 -11.547 -7.015 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -4.433 -9.943 -6.389 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.932 -10.145 -7.326 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -4.705 -12.047 -9.409 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.745 -10.668 -9.836 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -4.123 -10.816 -10.554 1.00 0.00 H new ATOM 1856 N CYS A 118 -4.337 -7.119 -6.988 1.00 0.00 N ATOM 1857 CA CYS A 118 -3.928 -6.430 -5.780 1.00 0.00 C ATOM 1858 C CYS A 118 -4.722 -6.977 -4.602 1.00 0.00 C ATOM 1859 O CYS A 118 -5.954 -6.961 -4.617 1.00 0.00 O ATOM 1860 CB CYS A 118 -4.149 -4.921 -5.923 1.00 0.00 C ATOM 1861 SG CYS A 118 -3.274 -4.179 -7.321 1.00 0.00 S ATOM 0 H CYS A 118 -5.301 -6.935 -7.267 1.00 0.00 H new ATOM 0 HA CYS A 118 -2.865 -6.599 -5.609 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -5.216 -4.729 -6.032 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -3.829 -4.429 -5.005 1.00 0.00 H new ATOM 0 HG CYS A 118 -2.977 -2.945 -7.041 1.00 0.00 H new ATOM 1867 N LYS A 119 -4.028 -7.480 -3.599 1.00 0.00 N ATOM 1868 CA LYS A 119 -4.688 -8.069 -2.446 1.00 0.00 C ATOM 1869 C LYS A 119 -4.427 -7.241 -1.204 1.00 0.00 C ATOM 1870 O LYS A 119 -3.451 -6.500 -1.137 1.00 0.00 O ATOM 1871 CB LYS A 119 -4.192 -9.490 -2.200 1.00 0.00 C ATOM 1872 CG LYS A 119 -4.368 -10.436 -3.380 1.00 0.00 C ATOM 1873 CD LYS A 119 -5.821 -10.836 -3.576 1.00 0.00 C ATOM 1874 CE LYS A 119 -6.378 -11.527 -2.345 1.00 0.00 C ATOM 1875 NZ LYS A 119 -7.761 -12.018 -2.566 1.00 0.00 N ATOM 0 H LYS A 119 -3.009 -7.493 -3.558 1.00 0.00 H new ATOM 0 HA LYS A 119 -5.757 -8.091 -2.657 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -3.135 -9.451 -1.937 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -4.720 -9.901 -1.340 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -3.998 -9.958 -4.287 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -3.764 -11.329 -3.222 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -6.417 -9.951 -3.798 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -5.904 -11.500 -4.436 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -5.734 -12.364 -2.076 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -6.369 -10.834 -1.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -8.221 -12.186 -1.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -8.301 -11.306 -3.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -7.732 -12.906 -3.106 1.00 0.00 H new ATOM 1889 N SER A 120 -5.296 -7.390 -0.228 1.00 0.00 N ATOM 1890 CA SER A 120 -5.153 -6.704 1.042 1.00 0.00 C ATOM 1891 C SER A 120 -5.196 -7.725 2.164 1.00 0.00 C ATOM 1892 O SER A 120 -6.169 -8.476 2.305 1.00 0.00 O ATOM 1893 CB SER A 120 -6.262 -5.669 1.227 1.00 0.00 C ATOM 1894 OG SER A 120 -6.036 -4.865 2.372 1.00 0.00 O ATOM 0 H SER A 120 -6.120 -7.988 -0.290 1.00 0.00 H new ATOM 0 HA SER A 120 -4.198 -6.179 1.059 1.00 0.00 H new ATOM 0 HB2 SER A 120 -6.321 -5.035 0.342 1.00 0.00 H new ATOM 0 HB3 SER A 120 -7.222 -6.176 1.321 1.00 0.00 H new ATOM 0 HG SER A 120 -6.761 -4.212 2.462 1.00 0.00 H new ATOM 1900 N PHE A 121 -4.137 -7.777 2.942 1.00 0.00 N ATOM 1901 CA PHE A 121 -4.045 -8.738 4.022 1.00 0.00 C ATOM 1902 C PHE A 121 -3.821 -8.040 5.350 1.00 0.00 C ATOM 1903 O PHE A 121 -2.984 -7.143 5.466 1.00 0.00 O ATOM 1904 CB PHE A 121 -2.918 -9.739 3.768 1.00 0.00 C ATOM 1905 CG PHE A 121 -3.143 -10.614 2.567 1.00 0.00 C ATOM 1906 CD1 PHE A 121 -4.123 -11.592 2.583 1.00 0.00 C ATOM 1907 CD2 PHE A 121 -2.370 -10.460 1.428 1.00 0.00 C ATOM 1908 CE1 PHE A 121 -4.334 -12.397 1.479 1.00 0.00 C ATOM 1909 CE2 PHE A 121 -2.574 -11.262 0.323 1.00 0.00 C ATOM 1910 CZ PHE A 121 -3.556 -12.235 0.350 1.00 0.00 C ATOM 0 H PHE A 121 -3.326 -7.165 2.848 1.00 0.00 H new ATOM 0 HA PHE A 121 -4.991 -9.278 4.064 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -1.983 -9.194 3.639 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -2.800 -10.370 4.649 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -4.729 -11.727 3.467 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -1.599 -9.704 1.404 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -5.106 -13.152 1.500 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -1.968 -11.130 -0.561 1.00 0.00 H new ATOM 0 HZ PHE A 121 -3.714 -12.867 -0.511 1.00 0.00 H new ATOM 1920 N LEU A 122 -4.587 -8.446 6.344 1.00 0.00 N ATOM 1921 CA LEU A 122 -4.389 -7.970 7.696 1.00 0.00 C ATOM 1922 C LEU A 122 -3.520 -8.970 8.434 1.00 0.00 C ATOM 1923 O LEU A 122 -3.967 -10.073 8.759 1.00 0.00 O ATOM 1924 CB LEU A 122 -5.734 -7.806 8.411 1.00 0.00 C ATOM 1925 CG LEU A 122 -6.720 -6.856 7.730 1.00 0.00 C ATOM 1926 CD1 LEU A 122 -8.056 -6.863 8.457 1.00 0.00 C ATOM 1927 CD2 LEU A 122 -6.153 -5.444 7.677 1.00 0.00 C ATOM 0 H LEU A 122 -5.356 -9.108 6.238 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.901 -6.996 7.675 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -6.202 -8.786 8.501 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -5.548 -7.447 9.423 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.880 -7.203 6.709 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -8.745 -6.181 7.958 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -8.471 -7.871 8.446 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -7.911 -6.542 9.488 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.869 -4.783 7.189 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.964 -5.090 8.690 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.220 -5.448 7.114 1.00 0.00 H new ATOM 1939 N ILE A 123 -2.276 -8.602 8.674 1.00 0.00 N ATOM 1940 CA ILE A 123 -1.340 -9.512 9.301 1.00 0.00 C ATOM 1941 C ILE A 123 -1.406 -9.385 10.813 1.00 0.00 C ATOM 1942 O ILE A 123 -0.986 -8.382 11.390 1.00 0.00 O ATOM 1943 CB ILE A 123 0.106 -9.282 8.814 1.00 0.00 C ATOM 1944 CG1 ILE A 123 0.176 -9.409 7.288 1.00 0.00 C ATOM 1945 CG2 ILE A 123 1.047 -10.285 9.476 1.00 0.00 C ATOM 1946 CD1 ILE A 123 1.561 -9.196 6.722 1.00 0.00 C ATOM 0 H ILE A 123 -1.893 -7.685 8.446 1.00 0.00 H new ATOM 0 HA ILE A 123 -1.630 -10.522 9.011 1.00 0.00 H new ATOM 0 HB ILE A 123 0.417 -8.275 9.093 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -0.177 -10.399 6.998 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.505 -8.685 6.841 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.065 -10.115 9.126 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.010 -10.160 10.558 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.739 -11.298 9.217 1.00 0.00 H new ATOM 0 HD11 ILE A 123 1.531 -9.302 5.638 1.00 0.00 H new ATOM 0 HD12 ILE A 123 1.910 -8.196 6.980 1.00 0.00 H new ATOM 0 HD13 ILE A 123 2.243 -9.937 7.140 1.00 0.00 H new ATOM 1958 N LYS A 124 -1.957 -10.408 11.439 1.00 0.00 N ATOM 1959 CA LYS A 124 -2.084 -10.452 12.882 1.00 0.00 C ATOM 1960 C LYS A 124 -0.833 -11.059 13.494 1.00 0.00 C ATOM 1961 O LYS A 124 0.173 -11.253 12.806 1.00 0.00 O ATOM 1962 CB LYS A 124 -3.318 -11.270 13.273 1.00 0.00 C ATOM 1963 CG LYS A 124 -4.626 -10.631 12.832 1.00 0.00 C ATOM 1964 CD LYS A 124 -5.823 -11.518 13.135 1.00 0.00 C ATOM 1965 CE LYS A 124 -5.736 -12.844 12.397 1.00 0.00 C ATOM 1966 NZ LYS A 124 -6.980 -13.643 12.544 1.00 0.00 N ATOM 0 H LYS A 124 -2.328 -11.230 10.962 1.00 0.00 H new ATOM 0 HA LYS A 124 -2.202 -9.437 13.261 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -3.241 -12.264 12.833 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -3.332 -11.400 14.355 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -4.749 -9.672 13.335 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -4.587 -10.427 11.762 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -5.879 -11.701 14.208 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -6.740 -11.002 12.851 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -5.546 -12.659 11.340 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -4.890 -13.416 12.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -6.833 -14.592 12.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -7.222 -13.726 13.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -7.757 -13.171 12.039 1.00 0.00 H new ATOM 1980 N LYS A 125 -0.906 -11.366 14.778 1.00 0.00 N ATOM 1981 CA LYS A 125 0.228 -11.916 15.503 1.00 0.00 C ATOM 1982 C LYS A 125 0.734 -13.192 14.848 1.00 0.00 C ATOM 1983 O LYS A 125 1.911 -13.302 14.499 1.00 0.00 O ATOM 1984 CB LYS A 125 -0.168 -12.195 16.951 1.00 0.00 C ATOM 1985 CG LYS A 125 1.021 -12.341 17.880 1.00 0.00 C ATOM 1986 CD LYS A 125 0.589 -12.415 19.332 1.00 0.00 C ATOM 1987 CE LYS A 125 1.785 -12.340 20.265 1.00 0.00 C ATOM 1988 NZ LYS A 125 2.610 -11.130 20.014 1.00 0.00 N ATOM 0 H LYS A 125 -1.746 -11.243 15.344 1.00 0.00 H new ATOM 0 HA LYS A 125 1.034 -11.182 15.481 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -0.803 -11.385 17.309 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -0.764 -13.107 16.988 1.00 0.00 H new ATOM 0 HG2 LYS A 125 1.579 -13.240 17.619 1.00 0.00 H new ATOM 0 HG3 LYS A 125 1.696 -11.496 17.743 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -0.099 -11.598 19.552 1.00 0.00 H new ATOM 0 HD3 LYS A 125 0.046 -13.344 19.506 1.00 0.00 H new ATOM 0 HE2 LYS A 125 1.439 -12.335 21.299 1.00 0.00 H new ATOM 0 HE3 LYS A 125 2.400 -13.231 20.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 3.182 -10.919 20.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 3.238 -11.300 19.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 1.988 -10.323 19.807 1.00 0.00 H new ATOM 2002 N ASP A 126 -0.160 -14.147 14.669 1.00 0.00 N ATOM 2003 CA ASP A 126 0.228 -15.438 14.110 1.00 0.00 C ATOM 2004 C ASP A 126 -0.710 -15.861 12.981 1.00 0.00 C ATOM 2005 O ASP A 126 -0.595 -16.958 12.435 1.00 0.00 O ATOM 2006 CB ASP A 126 0.245 -16.501 15.213 1.00 0.00 C ATOM 2007 CG ASP A 126 1.259 -17.595 14.946 1.00 0.00 C ATOM 2008 OD1 ASP A 126 0.909 -18.601 14.299 1.00 0.00 O ATOM 2009 OD2 ASP A 126 2.418 -17.449 15.386 1.00 0.00 O ATOM 0 H ASP A 126 -1.150 -14.060 14.898 1.00 0.00 H new ATOM 0 HA ASP A 126 1.229 -15.339 13.691 1.00 0.00 H new ATOM 0 HB2 ASP A 126 0.470 -16.026 16.168 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -0.747 -16.943 15.303 1.00 0.00 H new ATOM 2014 N GLY A 127 -1.627 -14.978 12.614 1.00 0.00 N ATOM 2015 CA GLY A 127 -2.589 -15.302 11.575 1.00 0.00 C ATOM 2016 C GLY A 127 -2.765 -14.176 10.587 1.00 0.00 C ATOM 2017 O GLY A 127 -2.368 -13.046 10.859 1.00 0.00 O ATOM 0 H GLY A 127 -1.724 -14.045 13.014 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -2.262 -16.198 11.047 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -3.551 -15.534 12.033 1.00 0.00 H new ATOM 2021 N VAL A 128 -3.358 -14.477 9.439 1.00 0.00 N ATOM 2022 CA VAL A 128 -3.582 -13.468 8.409 1.00 0.00 C ATOM 2023 C VAL A 128 -5.049 -13.444 7.993 1.00 0.00 C ATOM 2024 O VAL A 128 -5.624 -14.478 7.649 1.00 0.00 O ATOM 2025 CB VAL A 128 -2.702 -13.720 7.160 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -2.960 -12.669 6.090 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -1.227 -13.748 7.536 1.00 0.00 C ATOM 0 H VAL A 128 -3.692 -15.410 9.197 1.00 0.00 H new ATOM 0 HA VAL A 128 -3.306 -12.505 8.838 1.00 0.00 H new ATOM 0 HB VAL A 128 -2.971 -14.694 6.751 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -2.329 -12.869 5.224 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -4.008 -12.703 5.792 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -2.728 -11.681 6.487 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -0.627 -13.926 6.643 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -0.946 -12.792 7.977 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -1.050 -14.546 8.257 1.00 0.00 H new ATOM 2037 N ASP A 129 -5.652 -12.265 8.032 1.00 0.00 N ATOM 2038 CA ASP A 129 -7.035 -12.107 7.598 1.00 0.00 C ATOM 2039 C ASP A 129 -7.097 -11.418 6.246 1.00 0.00 C ATOM 2040 O ASP A 129 -6.288 -10.536 5.952 1.00 0.00 O ATOM 2041 CB ASP A 129 -7.862 -11.323 8.619 1.00 0.00 C ATOM 2042 CG ASP A 129 -8.403 -12.204 9.731 1.00 0.00 C ATOM 2043 OD1 ASP A 129 -8.909 -13.302 9.430 1.00 0.00 O ATOM 2044 OD2 ASP A 129 -8.321 -11.807 10.913 1.00 0.00 O ATOM 0 H ASP A 129 -5.209 -11.406 8.358 1.00 0.00 H new ATOM 0 HA ASP A 129 -7.463 -13.106 7.511 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -7.246 -10.535 9.052 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -8.693 -10.835 8.110 1.00 0.00 H new ATOM 2049 N GLU A 130 -8.057 -11.822 5.428 1.00 0.00 N ATOM 2050 CA GLU A 130 -8.208 -11.277 4.083 1.00 0.00 C ATOM 2051 C GLU A 130 -9.208 -10.123 4.074 1.00 0.00 C ATOM 2052 O GLU A 130 -10.343 -10.268 4.534 1.00 0.00 O ATOM 2053 CB GLU A 130 -8.653 -12.382 3.115 1.00 0.00 C ATOM 2054 CG GLU A 130 -8.875 -11.907 1.685 1.00 0.00 C ATOM 2055 CD GLU A 130 -9.231 -13.040 0.739 1.00 0.00 C ATOM 2056 OE1 GLU A 130 -10.133 -13.837 1.067 1.00 0.00 O ATOM 2057 OE2 GLU A 130 -8.601 -13.145 -0.335 1.00 0.00 O ATOM 0 H GLU A 130 -8.749 -12.530 5.673 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.243 -10.890 3.756 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -7.901 -13.171 3.111 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -9.577 -12.825 3.487 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -9.673 -11.165 1.673 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.973 -11.411 1.327 1.00 0.00 H new ATOM 2064 N GLU A 131 -8.764 -8.975 3.571 1.00 0.00 N ATOM 2065 CA GLU A 131 -9.622 -7.804 3.427 1.00 0.00 C ATOM 2066 C GLU A 131 -10.140 -7.721 1.990 1.00 0.00 C ATOM 2067 O GLU A 131 -9.448 -8.118 1.052 1.00 0.00 O ATOM 2068 CB GLU A 131 -8.846 -6.530 3.806 1.00 0.00 C ATOM 2069 CG GLU A 131 -9.635 -5.235 3.638 1.00 0.00 C ATOM 2070 CD GLU A 131 -10.882 -5.174 4.502 1.00 0.00 C ATOM 2071 OE1 GLU A 131 -11.888 -5.819 4.145 1.00 0.00 O ATOM 2072 OE2 GLU A 131 -10.870 -4.466 5.529 1.00 0.00 O ATOM 0 H GLU A 131 -7.805 -8.831 3.254 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.475 -7.894 4.100 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -8.523 -6.612 4.844 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -7.945 -6.473 3.195 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -8.990 -4.391 3.883 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -9.921 -5.125 2.592 1.00 0.00 H new ATOM 2079 N GLU A 132 -11.356 -7.219 1.824 1.00 0.00 N ATOM 2080 CA GLU A 132 -11.981 -7.147 0.517 1.00 0.00 C ATOM 2081 C GLU A 132 -11.674 -5.815 -0.159 1.00 0.00 C ATOM 2082 O GLU A 132 -11.473 -4.795 0.505 1.00 0.00 O ATOM 2083 CB GLU A 132 -13.489 -7.360 0.654 1.00 0.00 C ATOM 2084 CG GLU A 132 -14.160 -6.437 1.655 1.00 0.00 C ATOM 2085 CD GLU A 132 -15.606 -6.811 1.902 1.00 0.00 C ATOM 2086 OE1 GLU A 132 -16.486 -6.313 1.176 1.00 0.00 O ATOM 2087 OE2 GLU A 132 -15.870 -7.609 2.826 1.00 0.00 O ATOM 0 H GLU A 132 -11.929 -6.855 2.585 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.573 -7.936 -0.114 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -13.954 -7.219 -0.322 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.673 -8.393 0.949 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.613 -6.468 2.597 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -14.110 -5.411 1.290 1.00 0.00 H new ATOM 2094 N ILE A 133 -11.643 -5.830 -1.483 1.00 0.00 N ATOM 2095 CA ILE A 133 -11.226 -4.666 -2.255 1.00 0.00 C ATOM 2096 C ILE A 133 -12.413 -4.005 -2.942 1.00 0.00 C ATOM 2097 O ILE A 133 -13.140 -4.643 -3.707 1.00 0.00 O ATOM 2098 CB ILE A 133 -10.175 -5.050 -3.325 1.00 0.00 C ATOM 2099 CG1 ILE A 133 -8.958 -5.715 -2.671 1.00 0.00 C ATOM 2100 CG2 ILE A 133 -9.744 -3.825 -4.123 1.00 0.00 C ATOM 2101 CD1 ILE A 133 -8.222 -4.821 -1.694 1.00 0.00 C ATOM 0 H ILE A 133 -11.903 -6.638 -2.048 1.00 0.00 H new ATOM 0 HA ILE A 133 -10.782 -3.962 -1.551 1.00 0.00 H new ATOM 0 HB ILE A 133 -10.634 -5.763 -4.010 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -9.284 -6.615 -2.150 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -8.266 -6.031 -3.451 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -9.005 -4.118 -4.869 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -10.611 -3.392 -4.622 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -9.307 -3.088 -3.450 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -7.374 -5.362 -1.273 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -7.864 -3.932 -2.213 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -8.898 -4.525 -0.892 1.00 0.00 H new ATOM 2113 N ILE A 134 -12.615 -2.728 -2.644 1.00 0.00 N ATOM 2114 CA ILE A 134 -13.625 -1.926 -3.318 1.00 0.00 C ATOM 2115 C ILE A 134 -12.935 -0.842 -4.143 1.00 0.00 C ATOM 2116 O ILE A 134 -12.124 -0.075 -3.619 1.00 0.00 O ATOM 2117 CB ILE A 134 -14.627 -1.272 -2.324 1.00 0.00 C ATOM 2118 CG1 ILE A 134 -15.599 -2.305 -1.735 1.00 0.00 C ATOM 2119 CG2 ILE A 134 -15.414 -0.159 -2.998 1.00 0.00 C ATOM 2120 CD1 ILE A 134 -14.957 -3.301 -0.794 1.00 0.00 C ATOM 0 H ILE A 134 -12.087 -2.223 -1.933 1.00 0.00 H new ATOM 0 HA ILE A 134 -14.201 -2.590 -3.963 1.00 0.00 H new ATOM 0 HB ILE A 134 -14.037 -0.851 -1.510 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -16.391 -1.778 -1.202 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -16.072 -2.849 -2.553 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -16.107 0.282 -2.282 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -14.727 0.607 -3.356 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -15.973 -0.567 -3.840 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -15.714 -3.993 -0.425 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -14.185 -3.858 -1.325 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -14.509 -2.771 0.046 1.00 0.00 H new ATOM 2132 N LEU A 135 -13.241 -0.792 -5.431 1.00 0.00 N ATOM 2133 CA LEU A 135 -12.567 0.124 -6.339 1.00 0.00 C ATOM 2134 C LEU A 135 -13.501 1.214 -6.854 1.00 0.00 C ATOM 2135 O LEU A 135 -14.722 1.042 -6.902 1.00 0.00 O ATOM 2136 CB LEU A 135 -11.983 -0.654 -7.518 1.00 0.00 C ATOM 2137 CG LEU A 135 -10.854 -1.617 -7.162 1.00 0.00 C ATOM 2138 CD1 LEU A 135 -10.407 -2.392 -8.390 1.00 0.00 C ATOM 2139 CD2 LEU A 135 -9.683 -0.861 -6.556 1.00 0.00 C ATOM 0 H LEU A 135 -13.952 -1.376 -5.871 1.00 0.00 H new ATOM 0 HA LEU A 135 -11.768 0.612 -5.780 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -12.785 -1.219 -7.994 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -11.613 0.058 -8.256 1.00 0.00 H new ATOM 0 HG LEU A 135 -11.227 -2.327 -6.424 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -9.601 -3.074 -8.117 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.247 -2.963 -8.786 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -10.051 -1.696 -9.150 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -8.886 -1.562 -6.308 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -9.312 -0.129 -7.274 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -10.010 -0.348 -5.651 1.00 0.00 H new ATOM 2151 N LYS A 136 -12.910 2.344 -7.224 1.00 0.00 N ATOM 2152 CA LYS A 136 -13.632 3.435 -7.861 1.00 0.00 C ATOM 2153 C LYS A 136 -12.909 3.858 -9.134 1.00 0.00 C ATOM 2154 O LYS A 136 -11.679 3.853 -9.183 1.00 0.00 O ATOM 2155 CB LYS A 136 -13.753 4.632 -6.915 1.00 0.00 C ATOM 2156 CG LYS A 136 -14.648 4.383 -5.713 1.00 0.00 C ATOM 2157 CD LYS A 136 -14.798 5.633 -4.863 1.00 0.00 C ATOM 2158 CE LYS A 136 -15.814 5.436 -3.750 1.00 0.00 C ATOM 2159 NZ LYS A 136 -17.150 5.057 -4.282 1.00 0.00 N ATOM 0 H LYS A 136 -11.916 2.528 -7.090 1.00 0.00 H new ATOM 0 HA LYS A 136 -14.635 3.086 -8.109 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -12.758 4.906 -6.564 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -14.140 5.485 -7.473 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -15.630 4.052 -6.051 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -14.231 3.578 -5.108 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -13.833 5.898 -4.432 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -15.106 6.467 -5.493 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -15.461 4.662 -3.069 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -15.901 6.355 -3.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -17.874 5.226 -3.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -17.364 5.630 -5.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -17.148 4.050 -4.540 1.00 0.00 H new ATOM 2173 N GLU A 137 -13.665 4.225 -10.160 1.00 0.00 N ATOM 2174 CA GLU A 137 -13.074 4.641 -11.423 1.00 0.00 C ATOM 2175 C GLU A 137 -12.611 6.086 -11.349 1.00 0.00 C ATOM 2176 O GLU A 137 -11.689 6.508 -12.052 1.00 0.00 O ATOM 2177 CB GLU A 137 -14.082 4.496 -12.562 1.00 0.00 C ATOM 2178 CG GLU A 137 -14.410 3.060 -12.949 1.00 0.00 C ATOM 2179 CD GLU A 137 -15.390 2.400 -11.999 1.00 0.00 C ATOM 2180 OE1 GLU A 137 -16.603 2.685 -12.105 1.00 0.00 O ATOM 2181 OE2 GLU A 137 -14.955 1.595 -11.151 1.00 0.00 O ATOM 0 H GLU A 137 -14.685 4.243 -10.142 1.00 0.00 H new ATOM 0 HA GLU A 137 -12.216 3.998 -11.616 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -15.005 5.000 -12.277 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -13.694 5.014 -13.439 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -14.825 3.047 -13.957 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -13.489 2.477 -12.975 1.00 0.00 H new ATOM 2188 N GLU A 138 -13.255 6.827 -10.483 1.00 0.00 N ATOM 2189 CA GLU A 138 -12.961 8.237 -10.307 1.00 0.00 C ATOM 2190 C GLU A 138 -12.644 8.523 -8.844 1.00 0.00 C ATOM 2191 O GLU A 138 -12.991 7.735 -7.963 1.00 0.00 O ATOM 2192 CB GLU A 138 -14.149 9.081 -10.777 1.00 0.00 C ATOM 2193 CG GLU A 138 -13.854 10.569 -10.857 1.00 0.00 C ATOM 2194 CD GLU A 138 -12.686 10.876 -11.772 1.00 0.00 C ATOM 2195 OE1 GLU A 138 -12.911 11.056 -12.988 1.00 0.00 O ATOM 2196 OE2 GLU A 138 -11.538 10.928 -11.278 1.00 0.00 O ATOM 0 H GLU A 138 -13.998 6.476 -9.878 1.00 0.00 H new ATOM 0 HA GLU A 138 -12.090 8.500 -10.908 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -14.465 8.730 -11.759 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -14.986 8.923 -10.097 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -14.740 11.094 -11.214 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -13.640 10.949 -9.858 1.00 0.00 H new ATOM 2203 N LEU A 139 -11.980 9.641 -8.595 1.00 0.00 N ATOM 2204 CA LEU A 139 -11.634 10.043 -7.240 1.00 0.00 C ATOM 2205 C LEU A 139 -12.840 10.652 -6.533 1.00 0.00 C ATOM 2206 O LEU A 139 -13.927 10.753 -7.106 1.00 0.00 O ATOM 2207 CB LEU A 139 -10.490 11.060 -7.261 1.00 0.00 C ATOM 2208 CG LEU A 139 -9.159 10.548 -7.813 1.00 0.00 C ATOM 2209 CD1 LEU A 139 -8.150 11.679 -7.899 1.00 0.00 C ATOM 2210 CD2 LEU A 139 -8.616 9.423 -6.946 1.00 0.00 C ATOM 0 H LEU A 139 -11.668 10.290 -9.318 1.00 0.00 H new ATOM 0 HA LEU A 139 -11.316 9.153 -6.696 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -10.803 11.919 -7.855 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -10.327 11.418 -6.244 1.00 0.00 H new ATOM 0 HG LEU A 139 -9.333 10.158 -8.816 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -7.208 11.297 -8.294 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -8.531 12.457 -8.560 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -7.985 12.095 -6.905 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -7.669 9.073 -7.356 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -8.459 9.789 -5.931 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -9.330 8.600 -6.929 1.00 0.00 H new