USER MOD reduce.3.24.130724 H: found=0, std=0, add=1112, rem=0, adj=29 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 : no HD1:sc=-0.00659 K(o=-2.2,f=-5.6!) USER MOD Set 1.2: A 86 THR OG1 : rot 180:sc= -2.17! USER MOD Set 2.1: A 69 MET CE :methyl 162:sc= -0.323 (180deg=-1.33) USER MOD Set 2.2: A 76 MET CE :methyl -163:sc= -0.0947 (180deg=-0.827) USER MOD Set 3.1: A 25 CYS SG : rot 71:sc= 2.05 USER MOD Set 3.2: A 81 HIS : no HE2:sc= -0.272 K(o=1.8,f=-11!) USER MOD Set 4.1: A 22 ASN : amide:sc= -0.672 K(o=-0.54,f=0.083) USER MOD Set 4.2: A 50 GLN : amide:sc= 0.129 K(o=-0.54,f=0.083) USER MOD Set 5.1: A 9 MET CE :methyl -179:sc= -3.48! (180deg=-3.62!) USER MOD Set 5.2: A 12 MET CE :methyl 168:sc= -2.27 (180deg=-2.45!) USER MOD Set 5.3: A 118 CYS SG : rot 180:sc= -0.0899 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -154:sc= 1.31 (180deg=0.604) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot -151:sc= -3.69! USER MOD Single : A 6 LYS NZ :NH3+ -179:sc= 1 (180deg=0.866) USER MOD Single : A 7 LYS NZ :NH3+ -168:sc= -0.0358 (180deg=-0.278) USER MOD Single : A 8 GLN : amide:sc= -0.215 X(o=-0.22,f=-0.048) USER MOD Single : A 15 HIS : no HD1:sc= 1.18 K(o=1.2,f=-3.8!) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 TYR OH : rot -152:sc= 1.25 USER MOD Single : A 46 ASN : amide:sc= -0.221 X(o=-0.22,f=-0.11) USER MOD Single : A 47 ASN : amide:sc= -1.39 K(o=-1.4,f=-8.3!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 54 HIS : no HD1:sc= 0.942 K(o=0.94,f=-5.1!) USER MOD Single : A 56 SER OG : rot 177:sc= 1.25 USER MOD Single : A 57 MET CE :methyl -152:sc= -0.194 (180deg=-0.883) USER MOD Single : A 62 GLN : amide:sc= -0.503 K(o=-0.5,f=-1.3) USER MOD Single : A 64 THR OG1 : rot 80:sc= 0.155 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ -166:sc= -0.03 (180deg=-0.277) USER MOD Single : A 72 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 ASN : amide:sc= -2.04! K(o=-2!,f=-0.04) USER MOD Single : A 82 SER OG : rot 81:sc= 0.471 USER MOD Single : A 91 SER OG : rot -77:sc= 1.23 USER MOD Single : A 95 LYS NZ :NH3+ -160:sc= -0.0425 (180deg=-0.396) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot -86:sc= 1.08 USER MOD Single : A 105 TYR OH : rot -56:sc= 0.226 USER MOD Single : A 109 SER OG : rot 71:sc= 0.931 USER MOD Single : A 114 GLN : amide:sc= -0.295 X(o=-0.3,f=-0.46) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ -165:sc=-0.00465 (180deg=-0.179) USER MOD Single : A 120 SER OG : rot 5:sc= -1.54 USER MOD Single : A 124 LYS NZ :NH3+ 169:sc= 1.25 (180deg=1.18) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.127 -3.240 5.060 1.00 0.00 N ATOM 2 CA MET A 1 -12.689 -3.228 3.647 1.00 0.00 C ATOM 3 C MET A 1 -11.875 -1.976 3.364 1.00 0.00 C ATOM 4 O MET A 1 -11.920 -1.009 4.129 1.00 0.00 O ATOM 5 CB MET A 1 -13.890 -3.299 2.690 1.00 0.00 C ATOM 6 CG MET A 1 -14.706 -2.015 2.616 1.00 0.00 C ATOM 7 SD MET A 1 -15.491 -1.596 4.184 1.00 0.00 S ATOM 8 CE MET A 1 -16.197 -0.001 3.792 1.00 0.00 C ATOM 0 H1 MET A 1 -13.278 -4.222 5.368 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.396 -2.799 5.654 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.016 -2.708 5.152 1.00 0.00 H new ATOM 0 HA MET A 1 -12.069 -4.109 3.479 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.530 -3.546 1.691 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.543 -4.114 3.004 1.00 0.00 H new ATOM 0 HG2 MET A 1 -14.057 -1.195 2.309 1.00 0.00 H new ATOM 0 HG3 MET A 1 -15.472 -2.120 1.848 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.718 0.391 4.665 1.00 0.00 H new ATOM 0 HE2 MET A 1 -15.403 0.688 3.504 1.00 0.00 H new ATOM 0 HE3 MET A 1 -16.901 -0.108 2.967 1.00 0.00 H new ATOM 20 N ILE A 2 -11.123 -2.002 2.275 1.00 0.00 N ATOM 21 CA ILE A 2 -10.336 -0.852 1.856 1.00 0.00 C ATOM 22 C ILE A 2 -10.904 -0.283 0.561 1.00 0.00 C ATOM 23 O ILE A 2 -11.336 -1.029 -0.319 1.00 0.00 O ATOM 24 CB ILE A 2 -8.842 -1.220 1.671 1.00 0.00 C ATOM 25 CG1 ILE A 2 -8.028 0.008 1.239 1.00 0.00 C ATOM 26 CG2 ILE A 2 -8.679 -2.362 0.672 1.00 0.00 C ATOM 27 CD1 ILE A 2 -6.541 -0.251 1.145 1.00 0.00 C ATOM 0 H ILE A 2 -11.041 -2.813 1.661 1.00 0.00 H new ATOM 0 HA ILE A 2 -10.394 -0.098 2.641 1.00 0.00 H new ATOM 0 HB ILE A 2 -8.457 -1.560 2.632 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -8.390 0.350 0.270 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -8.203 0.817 1.948 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -7.621 -2.600 0.561 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -9.213 -3.241 1.034 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -9.087 -2.062 -0.293 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -6.032 0.661 0.835 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -6.164 -0.564 2.119 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -6.354 -1.037 0.414 1.00 0.00 H new ATOM 39 N THR A 3 -10.937 1.033 0.460 1.00 0.00 N ATOM 40 CA THR A 3 -11.484 1.688 -0.713 1.00 0.00 C ATOM 41 C THR A 3 -10.448 2.593 -1.375 1.00 0.00 C ATOM 42 O THR A 3 -9.918 3.518 -0.753 1.00 0.00 O ATOM 43 CB THR A 3 -12.736 2.509 -0.347 1.00 0.00 C ATOM 44 OG1 THR A 3 -13.692 1.667 0.311 1.00 0.00 O ATOM 45 CG2 THR A 3 -13.371 3.122 -1.589 1.00 0.00 C ATOM 0 H THR A 3 -10.591 1.670 1.178 1.00 0.00 H new ATOM 0 HA THR A 3 -11.765 0.909 -1.421 1.00 0.00 H new ATOM 0 HB THR A 3 -12.431 3.315 0.320 1.00 0.00 H new ATOM 0 HG1 THR A 3 -14.486 2.193 0.544 1.00 0.00 H new ATOM 0 HG21 THR A 3 -14.252 3.696 -1.302 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.653 3.780 -2.078 1.00 0.00 H new ATOM 0 HG23 THR A 3 -13.663 2.329 -2.277 1.00 0.00 H new ATOM 53 N LEU A 4 -10.162 2.307 -2.635 1.00 0.00 N ATOM 54 CA LEU A 4 -9.259 3.116 -3.437 1.00 0.00 C ATOM 55 C LEU A 4 -9.702 3.071 -4.890 1.00 0.00 C ATOM 56 O LEU A 4 -10.533 2.245 -5.264 1.00 0.00 O ATOM 57 CB LEU A 4 -7.796 2.660 -3.280 1.00 0.00 C ATOM 58 CG LEU A 4 -7.527 1.159 -3.437 1.00 0.00 C ATOM 59 CD1 LEU A 4 -7.428 0.769 -4.904 1.00 0.00 C ATOM 60 CD2 LEU A 4 -6.255 0.772 -2.698 1.00 0.00 C ATOM 0 H LEU A 4 -10.551 1.505 -3.131 1.00 0.00 H new ATOM 0 HA LEU A 4 -9.302 4.146 -3.084 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.192 3.193 -4.014 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -7.446 2.968 -2.295 1.00 0.00 H new ATOM 0 HG LEU A 4 -8.367 0.617 -3.002 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -7.237 -0.301 -4.984 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -8.364 1.009 -5.408 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -6.612 1.319 -5.373 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -6.076 -0.296 -2.818 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.413 1.329 -3.107 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -6.364 1.005 -1.639 1.00 0.00 H new ATOM 72 N THR A 5 -9.176 3.962 -5.705 1.00 0.00 N ATOM 73 CA THR A 5 -9.619 4.049 -7.085 1.00 0.00 C ATOM 74 C THR A 5 -8.754 3.169 -7.972 1.00 0.00 C ATOM 75 O THR A 5 -7.632 2.815 -7.600 1.00 0.00 O ATOM 76 CB THR A 5 -9.597 5.503 -7.603 1.00 0.00 C ATOM 77 OG1 THR A 5 -8.251 5.958 -7.773 1.00 0.00 O ATOM 78 CG2 THR A 5 -10.313 6.420 -6.628 1.00 0.00 C ATOM 0 H THR A 5 -8.450 4.629 -5.443 1.00 0.00 H new ATOM 0 HA THR A 5 -10.650 3.697 -7.121 1.00 0.00 H new ATOM 0 HB THR A 5 -10.107 5.525 -8.566 1.00 0.00 H new ATOM 0 HG1 THR A 5 -8.215 6.929 -7.645 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.290 7.442 -7.006 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.348 6.097 -6.518 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.816 6.380 -5.659 1.00 0.00 H new ATOM 86 N LYS A 6 -9.288 2.802 -9.130 1.00 0.00 N ATOM 87 CA LYS A 6 -8.553 1.995 -10.096 1.00 0.00 C ATOM 88 C LYS A 6 -7.251 2.685 -10.465 1.00 0.00 C ATOM 89 O LYS A 6 -6.208 2.051 -10.599 1.00 0.00 O ATOM 90 CB LYS A 6 -9.398 1.787 -11.347 1.00 0.00 C ATOM 91 CG LYS A 6 -8.857 0.718 -12.284 1.00 0.00 C ATOM 92 CD LYS A 6 -9.858 0.364 -13.371 1.00 0.00 C ATOM 93 CE LYS A 6 -9.249 -0.569 -14.404 1.00 0.00 C ATOM 94 NZ LYS A 6 -8.232 0.118 -15.245 1.00 0.00 N ATOM 0 H LYS A 6 -10.232 3.052 -9.424 1.00 0.00 H new ATOM 0 HA LYS A 6 -8.329 1.026 -9.650 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -10.411 1.516 -11.049 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -9.466 2.730 -11.889 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -7.932 1.069 -12.742 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.610 -0.176 -11.712 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -10.732 -0.108 -12.923 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -10.203 1.275 -13.860 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -8.788 -1.418 -13.899 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -10.038 -0.968 -15.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -7.854 -0.549 -15.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -8.673 0.923 -15.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -7.457 0.461 -14.642 1.00 0.00 H new ATOM 108 N LYS A 7 -7.339 3.996 -10.606 1.00 0.00 N ATOM 109 CA LYS A 7 -6.198 4.838 -10.894 1.00 0.00 C ATOM 110 C LYS A 7 -5.099 4.664 -9.849 1.00 0.00 C ATOM 111 O LYS A 7 -3.939 4.473 -10.191 1.00 0.00 O ATOM 112 CB LYS A 7 -6.674 6.281 -10.909 1.00 0.00 C ATOM 113 CG LYS A 7 -5.566 7.299 -11.004 1.00 0.00 C ATOM 114 CD LYS A 7 -4.849 7.238 -12.343 1.00 0.00 C ATOM 115 CE LYS A 7 -3.654 8.172 -12.369 1.00 0.00 C ATOM 116 NZ LYS A 7 -4.028 9.557 -11.990 1.00 0.00 N ATOM 0 H LYS A 7 -8.217 4.509 -10.522 1.00 0.00 H new ATOM 0 HA LYS A 7 -5.776 4.558 -11.859 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.352 6.419 -11.752 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -7.249 6.471 -10.003 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -5.978 8.298 -10.859 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -4.849 7.130 -10.201 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -4.520 6.217 -12.536 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -5.541 7.506 -13.141 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -2.889 7.802 -11.686 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -3.216 8.174 -13.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -3.243 10.202 -12.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -4.874 9.846 -12.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -4.229 9.596 -10.970 1.00 0.00 H new ATOM 130 N GLN A 8 -5.477 4.727 -8.578 1.00 0.00 N ATOM 131 CA GLN A 8 -4.522 4.568 -7.482 1.00 0.00 C ATOM 132 C GLN A 8 -3.868 3.189 -7.534 1.00 0.00 C ATOM 133 O GLN A 8 -2.678 3.051 -7.260 1.00 0.00 O ATOM 134 CB GLN A 8 -5.224 4.770 -6.132 1.00 0.00 C ATOM 135 CG GLN A 8 -5.924 6.112 -5.996 1.00 0.00 C ATOM 136 CD GLN A 8 -4.991 7.300 -6.131 1.00 0.00 C ATOM 137 OE1 GLN A 8 -4.759 7.804 -7.229 1.00 0.00 O ATOM 138 NE2 GLN A 8 -4.468 7.770 -5.010 1.00 0.00 N ATOM 0 H GLN A 8 -6.439 4.887 -8.278 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.744 5.324 -7.591 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.955 3.974 -5.991 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -4.489 4.672 -5.333 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.703 6.184 -6.755 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.419 6.158 -5.026 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -4.685 7.323 -4.119 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -3.847 8.579 -5.037 1.00 0.00 H new ATOM 147 N MET A 9 -4.646 2.174 -7.898 1.00 0.00 N ATOM 148 CA MET A 9 -4.106 0.830 -8.069 1.00 0.00 C ATOM 149 C MET A 9 -3.142 0.796 -9.250 1.00 0.00 C ATOM 150 O MET A 9 -2.039 0.266 -9.146 1.00 0.00 O ATOM 151 CB MET A 9 -5.231 -0.188 -8.275 1.00 0.00 C ATOM 152 CG MET A 9 -4.730 -1.595 -8.574 1.00 0.00 C ATOM 153 SD MET A 9 -6.064 -2.804 -8.696 1.00 0.00 S ATOM 154 CE MET A 9 -6.658 -2.809 -7.006 1.00 0.00 C ATOM 0 H MET A 9 -5.646 2.256 -8.079 1.00 0.00 H new ATOM 0 HA MET A 9 -3.564 0.562 -7.162 1.00 0.00 H new ATOM 0 HB2 MET A 9 -5.854 -0.215 -7.381 1.00 0.00 H new ATOM 0 HB3 MET A 9 -5.866 0.145 -9.096 1.00 0.00 H new ATOM 0 HG2 MET A 9 -4.169 -1.585 -9.509 1.00 0.00 H new ATOM 0 HG3 MET A 9 -4.038 -1.903 -7.790 1.00 0.00 H new ATOM 0 HE1 MET A 9 -7.476 -3.523 -6.910 1.00 0.00 H new ATOM 0 HE2 MET A 9 -5.847 -3.094 -6.336 1.00 0.00 H new ATOM 0 HE3 MET A 9 -7.013 -1.813 -6.742 1.00 0.00 H new ATOM 164 N GLU A 10 -3.566 1.381 -10.363 1.00 0.00 N ATOM 165 CA GLU A 10 -2.752 1.477 -11.558 1.00 0.00 C ATOM 166 C GLU A 10 -1.452 2.229 -11.292 1.00 0.00 C ATOM 167 O GLU A 10 -0.401 1.878 -11.831 1.00 0.00 O ATOM 168 CB GLU A 10 -3.560 2.174 -12.643 1.00 0.00 C ATOM 169 CG GLU A 10 -4.544 1.257 -13.348 1.00 0.00 C ATOM 170 CD GLU A 10 -5.373 1.985 -14.379 1.00 0.00 C ATOM 171 OE1 GLU A 10 -4.784 2.622 -15.277 1.00 0.00 O ATOM 172 OE2 GLU A 10 -6.615 1.926 -14.297 1.00 0.00 O ATOM 0 H GLU A 10 -4.490 1.803 -10.458 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.479 0.473 -11.883 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.105 3.007 -12.200 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.876 2.596 -13.380 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -3.999 0.446 -13.831 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -5.205 0.802 -12.610 1.00 0.00 H new ATOM 179 N GLU A 11 -1.536 3.256 -10.457 1.00 0.00 N ATOM 180 CA GLU A 11 -0.376 4.021 -10.042 1.00 0.00 C ATOM 181 C GLU A 11 0.616 3.134 -9.291 1.00 0.00 C ATOM 182 O GLU A 11 1.830 3.224 -9.498 1.00 0.00 O ATOM 183 CB GLU A 11 -0.837 5.191 -9.174 1.00 0.00 C ATOM 184 CG GLU A 11 -1.324 6.387 -9.977 1.00 0.00 C ATOM 185 CD GLU A 11 -0.298 6.868 -10.987 1.00 0.00 C ATOM 186 OE1 GLU A 11 0.674 7.539 -10.583 1.00 0.00 O ATOM 187 OE2 GLU A 11 -0.468 6.588 -12.195 1.00 0.00 O ATOM 0 H GLU A 11 -2.413 3.580 -10.050 1.00 0.00 H new ATOM 0 HA GLU A 11 0.138 4.410 -10.921 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -1.639 4.853 -8.518 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -0.013 5.505 -8.533 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -2.244 6.120 -10.498 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -1.568 7.202 -9.296 1.00 0.00 H new ATOM 194 N MET A 12 0.095 2.259 -8.437 1.00 0.00 N ATOM 195 CA MET A 12 0.934 1.305 -7.723 1.00 0.00 C ATOM 196 C MET A 12 1.500 0.274 -8.694 1.00 0.00 C ATOM 197 O MET A 12 2.665 -0.103 -8.599 1.00 0.00 O ATOM 198 CB MET A 12 0.151 0.604 -6.606 1.00 0.00 C ATOM 199 CG MET A 12 -0.328 1.547 -5.513 1.00 0.00 C ATOM 200 SD MET A 12 -1.083 0.681 -4.119 1.00 0.00 S ATOM 201 CE MET A 12 -2.441 -0.163 -4.928 1.00 0.00 C ATOM 0 H MET A 12 -0.900 2.191 -8.223 1.00 0.00 H new ATOM 0 HA MET A 12 1.756 1.855 -7.265 1.00 0.00 H new ATOM 0 HB2 MET A 12 -0.711 0.098 -7.041 1.00 0.00 H new ATOM 0 HB3 MET A 12 0.781 -0.165 -6.160 1.00 0.00 H new ATOM 0 HG2 MET A 12 0.515 2.137 -5.154 1.00 0.00 H new ATOM 0 HG3 MET A 12 -1.050 2.246 -5.934 1.00 0.00 H new ATOM 0 HE1 MET A 12 -2.868 -0.900 -4.248 1.00 0.00 H new ATOM 0 HE2 MET A 12 -3.207 0.562 -5.205 1.00 0.00 H new ATOM 0 HE3 MET A 12 -2.076 -0.665 -5.824 1.00 0.00 H new ATOM 211 N LEU A 13 0.668 -0.159 -9.640 1.00 0.00 N ATOM 212 CA LEU A 13 1.077 -1.129 -10.654 1.00 0.00 C ATOM 213 C LEU A 13 2.228 -0.592 -11.504 1.00 0.00 C ATOM 214 O LEU A 13 3.202 -1.298 -11.769 1.00 0.00 O ATOM 215 CB LEU A 13 -0.108 -1.481 -11.558 1.00 0.00 C ATOM 216 CG LEU A 13 -1.275 -2.194 -10.868 1.00 0.00 C ATOM 217 CD1 LEU A 13 -2.411 -2.429 -11.852 1.00 0.00 C ATOM 218 CD2 LEU A 13 -0.816 -3.511 -10.263 1.00 0.00 C ATOM 0 H LEU A 13 -0.300 0.150 -9.725 1.00 0.00 H new ATOM 0 HA LEU A 13 1.420 -2.025 -10.137 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.483 -0.563 -12.011 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.252 -2.113 -12.370 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.640 -1.555 -10.064 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.232 -2.936 -11.345 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.760 -1.472 -12.240 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -2.056 -3.047 -12.677 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.659 -4.002 -9.778 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.424 -4.156 -11.050 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -0.035 -3.321 -9.527 1.00 0.00 H new ATOM 230 N ALA A 14 2.110 0.662 -11.924 1.00 0.00 N ATOM 231 CA ALA A 14 3.145 1.303 -12.727 1.00 0.00 C ATOM 232 C ALA A 14 4.442 1.417 -11.939 1.00 0.00 C ATOM 233 O ALA A 14 5.531 1.221 -12.478 1.00 0.00 O ATOM 234 CB ALA A 14 2.683 2.675 -13.197 1.00 0.00 C ATOM 0 H ALA A 14 1.306 1.256 -11.721 1.00 0.00 H new ATOM 0 HA ALA A 14 3.331 0.683 -13.604 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.468 3.138 -13.795 1.00 0.00 H new ATOM 0 HB2 ALA A 14 1.782 2.568 -13.801 1.00 0.00 H new ATOM 0 HB3 ALA A 14 2.467 3.302 -12.332 1.00 0.00 H new ATOM 240 N HIS A 15 4.321 1.716 -10.653 1.00 0.00 N ATOM 241 CA HIS A 15 5.487 1.805 -9.788 1.00 0.00 C ATOM 242 C HIS A 15 6.087 0.418 -9.570 1.00 0.00 C ATOM 243 O HIS A 15 7.300 0.269 -9.428 1.00 0.00 O ATOM 244 CB HIS A 15 5.117 2.448 -8.450 1.00 0.00 C ATOM 245 CG HIS A 15 6.307 2.911 -7.668 1.00 0.00 C ATOM 246 ND1 HIS A 15 6.886 4.146 -7.850 1.00 0.00 N ATOM 247 CD2 HIS A 15 7.031 2.300 -6.703 1.00 0.00 C ATOM 248 CE1 HIS A 15 7.914 4.274 -7.037 1.00 0.00 C ATOM 249 NE2 HIS A 15 8.025 3.168 -6.325 1.00 0.00 N ATOM 0 H HIS A 15 3.432 1.900 -10.188 1.00 0.00 H new ATOM 0 HA HIS A 15 6.233 2.435 -10.273 1.00 0.00 H new ATOM 0 HB2 HIS A 15 4.458 3.297 -8.632 1.00 0.00 H new ATOM 0 HB3 HIS A 15 4.555 1.730 -7.853 1.00 0.00 H new ATOM 0 HD2 HIS A 15 6.859 1.311 -6.303 1.00 0.00 H new ATOM 0 HE1 HIS A 15 8.558 5.138 -6.965 1.00 0.00 H new ATOM 0 HE2 HIS A 15 8.732 2.988 -5.612 1.00 0.00 H new ATOM 258 N ALA A 16 5.221 -0.588 -9.541 1.00 0.00 N ATOM 259 CA ALA A 16 5.653 -1.973 -9.392 1.00 0.00 C ATOM 260 C ALA A 16 6.446 -2.432 -10.611 1.00 0.00 C ATOM 261 O ALA A 16 7.539 -2.979 -10.475 1.00 0.00 O ATOM 262 CB ALA A 16 4.455 -2.886 -9.163 1.00 0.00 C ATOM 0 H ALA A 16 4.211 -0.470 -9.619 1.00 0.00 H new ATOM 0 HA ALA A 16 6.305 -2.030 -8.521 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.797 -3.915 -9.054 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.932 -2.580 -8.257 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.777 -2.817 -10.014 1.00 0.00 H new ATOM 268 N ARG A 17 5.894 -2.191 -11.799 1.00 0.00 N ATOM 269 CA ARG A 17 6.553 -2.575 -13.048 1.00 0.00 C ATOM 270 C ARG A 17 7.900 -1.860 -13.172 1.00 0.00 C ATOM 271 O ARG A 17 8.857 -2.396 -13.730 1.00 0.00 O ATOM 272 CB ARG A 17 5.650 -2.256 -14.250 1.00 0.00 C ATOM 273 CG ARG A 17 5.823 -0.849 -14.793 1.00 0.00 C ATOM 274 CD ARG A 17 4.731 -0.469 -15.781 1.00 0.00 C ATOM 275 NE ARG A 17 4.495 -1.505 -16.790 1.00 0.00 N ATOM 276 CZ ARG A 17 5.313 -1.767 -17.811 1.00 0.00 C ATOM 277 NH1 ARG A 17 6.429 -1.065 -17.982 1.00 0.00 N ATOM 278 NH2 ARG A 17 4.995 -2.720 -18.678 1.00 0.00 N ATOM 0 H ARG A 17 4.992 -1.732 -11.924 1.00 0.00 H new ATOM 0 HA ARG A 17 6.734 -3.650 -13.037 1.00 0.00 H new ATOM 0 HB2 ARG A 17 5.857 -2.970 -15.047 1.00 0.00 H new ATOM 0 HB3 ARG A 17 4.609 -2.397 -13.958 1.00 0.00 H new ATOM 0 HG2 ARG A 17 5.822 -0.140 -13.965 1.00 0.00 H new ATOM 0 HG3 ARG A 17 6.794 -0.768 -15.281 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.805 -0.279 -15.238 1.00 0.00 H new ATOM 0 HD3 ARG A 17 5.005 0.461 -16.279 1.00 0.00 H new ATOM 0 HE ARG A 17 3.646 -2.065 -16.706 1.00 0.00 H new ATOM 0 HH11 ARG A 17 6.667 -0.318 -17.329 1.00 0.00 H new ATOM 0 HH12 ARG A 17 7.048 -1.273 -18.766 1.00 0.00 H new ATOM 0 HH21 ARG A 17 4.130 -3.247 -18.562 1.00 0.00 H new ATOM 0 HH22 ARG A 17 5.616 -2.925 -19.461 1.00 0.00 H new ATOM 292 N GLN A 18 7.950 -0.644 -12.638 1.00 0.00 N ATOM 293 CA GLN A 18 9.164 0.161 -12.617 1.00 0.00 C ATOM 294 C GLN A 18 10.251 -0.493 -11.762 1.00 0.00 C ATOM 295 O GLN A 18 11.410 -0.585 -12.170 1.00 0.00 O ATOM 296 CB GLN A 18 8.830 1.547 -12.061 1.00 0.00 C ATOM 297 CG GLN A 18 10.013 2.494 -11.972 1.00 0.00 C ATOM 298 CD GLN A 18 9.653 3.789 -11.268 1.00 0.00 C ATOM 299 OE1 GLN A 18 9.771 3.896 -10.047 1.00 0.00 O ATOM 300 NE2 GLN A 18 9.215 4.782 -12.025 1.00 0.00 N ATOM 0 H GLN A 18 7.146 -0.188 -12.206 1.00 0.00 H new ATOM 0 HA GLN A 18 9.546 0.244 -13.634 1.00 0.00 H new ATOM 0 HB2 GLN A 18 8.064 2.001 -12.690 1.00 0.00 H new ATOM 0 HB3 GLN A 18 8.399 1.431 -11.067 1.00 0.00 H new ATOM 0 HG2 GLN A 18 10.829 2.006 -11.438 1.00 0.00 H new ATOM 0 HG3 GLN A 18 10.376 2.716 -12.976 1.00 0.00 H new ATOM 0 HE21 GLN A 18 9.131 4.656 -13.034 1.00 0.00 H new ATOM 0 HE22 GLN A 18 8.962 5.674 -11.600 1.00 0.00 H new ATOM 309 N ALA A 19 9.861 -0.960 -10.585 1.00 0.00 N ATOM 310 CA ALA A 19 10.815 -1.468 -9.604 1.00 0.00 C ATOM 311 C ALA A 19 11.185 -2.933 -9.843 1.00 0.00 C ATOM 312 O ALA A 19 12.081 -3.458 -9.183 1.00 0.00 O ATOM 313 CB ALA A 19 10.267 -1.287 -8.196 1.00 0.00 C ATOM 0 H ALA A 19 8.887 -0.999 -10.283 1.00 0.00 H new ATOM 0 HA ALA A 19 11.730 -0.886 -9.719 1.00 0.00 H new ATOM 0 HB1 ALA A 19 10.988 -1.670 -7.473 1.00 0.00 H new ATOM 0 HB2 ALA A 19 10.091 -0.228 -8.007 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.329 -1.834 -8.098 1.00 0.00 H new ATOM 319 N LEU A 20 10.506 -3.587 -10.780 1.00 0.00 N ATOM 320 CA LEU A 20 10.805 -4.977 -11.113 1.00 0.00 C ATOM 321 C LEU A 20 12.280 -5.139 -11.482 1.00 0.00 C ATOM 322 O LEU A 20 12.868 -4.254 -12.105 1.00 0.00 O ATOM 323 CB LEU A 20 9.919 -5.454 -12.269 1.00 0.00 C ATOM 324 CG LEU A 20 8.429 -5.580 -11.948 1.00 0.00 C ATOM 325 CD1 LEU A 20 7.661 -6.062 -13.169 1.00 0.00 C ATOM 326 CD2 LEU A 20 8.214 -6.526 -10.776 1.00 0.00 C ATOM 0 H LEU A 20 9.745 -3.178 -11.322 1.00 0.00 H new ATOM 0 HA LEU A 20 10.597 -5.589 -10.235 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.036 -4.762 -13.103 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.283 -6.424 -12.607 1.00 0.00 H new ATOM 0 HG LEU A 20 8.052 -4.596 -11.669 1.00 0.00 H new ATOM 0 HD11 LEU A 20 6.602 -6.146 -12.923 1.00 0.00 H new ATOM 0 HD12 LEU A 20 7.789 -5.349 -13.984 1.00 0.00 H new ATOM 0 HD13 LEU A 20 8.041 -7.036 -13.476 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.148 -6.603 -10.562 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.606 -7.511 -11.027 1.00 0.00 H new ATOM 0 HD23 LEU A 20 8.734 -6.142 -9.898 1.00 0.00 H new ATOM 338 N PRO A 21 12.900 -6.268 -11.100 1.00 0.00 N ATOM 339 CA PRO A 21 12.245 -7.360 -10.394 1.00 0.00 C ATOM 340 C PRO A 21 12.427 -7.293 -8.874 1.00 0.00 C ATOM 341 O PRO A 21 12.476 -8.323 -8.200 1.00 0.00 O ATOM 342 CB PRO A 21 12.960 -8.584 -10.966 1.00 0.00 C ATOM 343 CG PRO A 21 14.310 -8.099 -11.416 1.00 0.00 C ATOM 344 CD PRO A 21 14.307 -6.589 -11.341 1.00 0.00 C ATOM 0 HA PRO A 21 11.164 -7.353 -10.533 1.00 0.00 H new ATOM 0 HB2 PRO A 21 13.057 -9.367 -10.214 1.00 0.00 H new ATOM 0 HB3 PRO A 21 12.400 -9.010 -11.799 1.00 0.00 H new ATOM 0 HG2 PRO A 21 15.095 -8.511 -10.782 1.00 0.00 H new ATOM 0 HG3 PRO A 21 14.515 -8.431 -12.434 1.00 0.00 H new ATOM 0 HD2 PRO A 21 14.946 -6.225 -10.537 1.00 0.00 H new ATOM 0 HD3 PRO A 21 14.670 -6.139 -12.265 1.00 0.00 H new ATOM 352 N ASN A 22 12.530 -6.083 -8.343 1.00 0.00 N ATOM 353 CA ASN A 22 12.594 -5.886 -6.898 1.00 0.00 C ATOM 354 C ASN A 22 11.181 -5.800 -6.340 1.00 0.00 C ATOM 355 O ASN A 22 10.217 -5.666 -7.101 1.00 0.00 O ATOM 356 CB ASN A 22 13.378 -4.612 -6.560 1.00 0.00 C ATOM 357 CG ASN A 22 14.850 -4.711 -6.923 1.00 0.00 C ATOM 358 OD1 ASN A 22 15.461 -3.733 -7.359 1.00 0.00 O ATOM 359 ND2 ASN A 22 15.439 -5.883 -6.724 1.00 0.00 N ATOM 0 H ASN A 22 12.571 -5.222 -8.889 1.00 0.00 H new ATOM 0 HA ASN A 22 13.112 -6.731 -6.445 1.00 0.00 H new ATOM 0 HB2 ASN A 22 12.935 -3.768 -7.088 1.00 0.00 H new ATOM 0 HB3 ASN A 22 13.285 -4.406 -5.494 1.00 0.00 H new ATOM 0 HD21 ASN A 22 16.431 -5.997 -6.933 1.00 0.00 H new ATOM 0 HD22 ASN A 22 14.900 -6.670 -6.362 1.00 0.00 H new ATOM 366 N GLU A 23 11.046 -5.872 -5.028 1.00 0.00 N ATOM 367 CA GLU A 23 9.732 -5.847 -4.414 1.00 0.00 C ATOM 368 C GLU A 23 9.260 -4.405 -4.224 1.00 0.00 C ATOM 369 O GLU A 23 9.561 -3.749 -3.225 1.00 0.00 O ATOM 370 CB GLU A 23 9.703 -6.639 -3.091 1.00 0.00 C ATOM 371 CG GLU A 23 10.625 -6.118 -1.990 1.00 0.00 C ATOM 372 CD GLU A 23 12.093 -6.292 -2.308 1.00 0.00 C ATOM 373 OE1 GLU A 23 12.641 -7.366 -2.000 1.00 0.00 O ATOM 374 OE2 GLU A 23 12.694 -5.358 -2.874 1.00 0.00 O ATOM 0 H GLU A 23 11.824 -5.948 -4.372 1.00 0.00 H new ATOM 0 HA GLU A 23 9.034 -6.344 -5.088 1.00 0.00 H new ATOM 0 HB2 GLU A 23 8.681 -6.643 -2.713 1.00 0.00 H new ATOM 0 HB3 GLU A 23 9.968 -7.675 -3.302 1.00 0.00 H new ATOM 0 HG2 GLU A 23 10.419 -5.061 -1.823 1.00 0.00 H new ATOM 0 HG3 GLU A 23 10.398 -6.638 -1.059 1.00 0.00 H new ATOM 381 N ALA A 24 8.539 -3.908 -5.221 1.00 0.00 N ATOM 382 CA ALA A 24 8.006 -2.551 -5.189 1.00 0.00 C ATOM 383 C ALA A 24 7.119 -2.338 -3.969 1.00 0.00 C ATOM 384 O ALA A 24 6.132 -3.052 -3.770 1.00 0.00 O ATOM 385 CB ALA A 24 7.232 -2.258 -6.459 1.00 0.00 C ATOM 0 H ALA A 24 8.308 -4.428 -6.068 1.00 0.00 H new ATOM 0 HA ALA A 24 8.847 -1.861 -5.121 1.00 0.00 H new ATOM 0 HB1 ALA A 24 6.840 -1.242 -6.420 1.00 0.00 H new ATOM 0 HB2 ALA A 24 7.893 -2.360 -7.320 1.00 0.00 H new ATOM 0 HB3 ALA A 24 6.405 -2.962 -6.552 1.00 0.00 H new ATOM 391 N CYS A 25 7.483 -1.360 -3.152 1.00 0.00 N ATOM 392 CA CYS A 25 6.750 -1.071 -1.931 1.00 0.00 C ATOM 393 C CYS A 25 6.560 0.434 -1.761 1.00 0.00 C ATOM 394 O CYS A 25 7.174 1.236 -2.473 1.00 0.00 O ATOM 395 CB CYS A 25 7.489 -1.654 -0.722 1.00 0.00 C ATOM 396 SG CYS A 25 7.782 -3.437 -0.831 1.00 0.00 S ATOM 0 H CYS A 25 8.285 -0.752 -3.315 1.00 0.00 H new ATOM 0 HA CYS A 25 5.766 -1.535 -2.000 1.00 0.00 H new ATOM 0 HB2 CYS A 25 8.446 -1.144 -0.613 1.00 0.00 H new ATOM 0 HB3 CYS A 25 6.913 -1.445 0.179 1.00 0.00 H new ATOM 0 HG CYS A 25 8.681 -3.674 -1.739 1.00 0.00 H new ATOM 402 N GLY A 26 5.694 0.809 -0.832 1.00 0.00 N ATOM 403 CA GLY A 26 5.429 2.208 -0.569 1.00 0.00 C ATOM 404 C GLY A 26 4.508 2.372 0.615 1.00 0.00 C ATOM 405 O GLY A 26 4.299 1.424 1.363 1.00 0.00 O ATOM 0 H GLY A 26 5.164 0.161 -0.249 1.00 0.00 H new ATOM 0 HA2 GLY A 26 6.367 2.730 -0.379 1.00 0.00 H new ATOM 0 HA3 GLY A 26 4.981 2.668 -1.449 1.00 0.00 H new ATOM 409 N LEU A 27 3.938 3.555 0.776 1.00 0.00 N ATOM 410 CA LEU A 27 3.037 3.820 1.892 1.00 0.00 C ATOM 411 C LEU A 27 1.689 4.303 1.377 1.00 0.00 C ATOM 412 O LEU A 27 1.599 4.859 0.282 1.00 0.00 O ATOM 413 CB LEU A 27 3.634 4.875 2.831 1.00 0.00 C ATOM 414 CG LEU A 27 4.931 4.475 3.538 1.00 0.00 C ATOM 415 CD1 LEU A 27 5.484 5.642 4.343 1.00 0.00 C ATOM 416 CD2 LEU A 27 4.701 3.271 4.439 1.00 0.00 C ATOM 0 H LEU A 27 4.081 4.348 0.150 1.00 0.00 H new ATOM 0 HA LEU A 27 2.900 2.891 2.446 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.820 5.783 2.257 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.890 5.123 3.588 1.00 0.00 H new ATOM 0 HG LEU A 27 5.663 4.202 2.778 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.406 5.338 4.838 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.689 6.479 3.676 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.753 5.946 5.092 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.635 3.002 4.933 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.951 3.517 5.191 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.352 2.430 3.840 1.00 0.00 H new ATOM 428 N LEU A 28 0.647 4.085 2.164 1.00 0.00 N ATOM 429 CA LEU A 28 -0.695 4.504 1.787 1.00 0.00 C ATOM 430 C LEU A 28 -1.301 5.383 2.869 1.00 0.00 C ATOM 431 O LEU A 28 -1.344 4.998 4.042 1.00 0.00 O ATOM 432 CB LEU A 28 -1.585 3.282 1.552 1.00 0.00 C ATOM 433 CG LEU A 28 -1.119 2.342 0.438 1.00 0.00 C ATOM 434 CD1 LEU A 28 -1.998 1.105 0.391 1.00 0.00 C ATOM 435 CD2 LEU A 28 -1.134 3.059 -0.905 1.00 0.00 C ATOM 0 H LEU A 28 0.705 3.619 3.070 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.629 5.079 0.863 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.649 2.715 2.481 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.593 3.626 1.318 1.00 0.00 H new ATOM 0 HG LEU A 28 -0.096 2.032 0.650 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.655 0.445 -0.406 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.941 0.582 1.345 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.030 1.399 0.200 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.800 2.376 -1.686 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.147 3.396 -1.126 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.466 3.920 -0.866 1.00 0.00 H new ATOM 447 N GLY A 29 -1.766 6.559 2.474 1.00 0.00 N ATOM 448 CA GLY A 29 -2.377 7.470 3.415 1.00 0.00 C ATOM 449 C GLY A 29 -3.751 7.921 2.967 1.00 0.00 C ATOM 450 O GLY A 29 -4.054 7.941 1.770 1.00 0.00 O ATOM 0 H GLY A 29 -1.730 6.898 1.513 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.455 6.985 4.388 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.735 8.341 3.543 1.00 0.00 H new ATOM 454 N GLY A 30 -4.588 8.274 3.924 1.00 0.00 N ATOM 455 CA GLY A 30 -5.919 8.736 3.604 1.00 0.00 C ATOM 456 C GLY A 30 -6.784 8.885 4.835 1.00 0.00 C ATOM 457 O GLY A 30 -6.349 9.445 5.843 1.00 0.00 O ATOM 0 H GLY A 30 -4.370 8.249 4.920 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -5.855 9.695 3.089 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.389 8.035 2.915 1.00 0.00 H new ATOM 461 N ARG A 31 -7.999 8.366 4.760 1.00 0.00 N ATOM 462 CA ARG A 31 -8.952 8.481 5.852 1.00 0.00 C ATOM 463 C ARG A 31 -9.166 7.119 6.490 1.00 0.00 C ATOM 464 O ARG A 31 -9.301 6.115 5.787 1.00 0.00 O ATOM 465 CB ARG A 31 -10.294 9.014 5.338 1.00 0.00 C ATOM 466 CG ARG A 31 -10.168 10.236 4.447 1.00 0.00 C ATOM 467 CD ARG A 31 -11.516 10.652 3.876 1.00 0.00 C ATOM 468 NE ARG A 31 -11.361 11.607 2.783 1.00 0.00 N ATOM 469 CZ ARG A 31 -12.356 12.055 2.020 1.00 0.00 C ATOM 470 NH1 ARG A 31 -13.611 11.687 2.250 1.00 0.00 N ATOM 471 NH2 ARG A 31 -12.093 12.877 1.016 1.00 0.00 N ATOM 0 H ARG A 31 -8.350 7.858 3.948 1.00 0.00 H new ATOM 0 HA ARG A 31 -8.552 9.176 6.590 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -10.800 8.223 4.784 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -10.926 9.261 6.191 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -9.743 11.062 5.018 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -9.476 10.023 3.632 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -12.049 9.771 3.518 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -12.125 11.095 4.664 1.00 0.00 H new ATOM 0 HE ARG A 31 -10.422 11.956 2.590 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -13.824 11.053 3.020 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -14.362 12.039 1.657 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -11.132 13.164 0.830 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -12.851 13.223 0.428 1.00 0.00 H new ATOM 485 N ARG A 32 -9.190 7.077 7.809 1.00 0.00 N ATOM 486 CA ARG A 32 -9.429 5.834 8.514 1.00 0.00 C ATOM 487 C ARG A 32 -10.622 5.976 9.445 1.00 0.00 C ATOM 488 O ARG A 32 -10.734 6.950 10.195 1.00 0.00 O ATOM 489 CB ARG A 32 -8.201 5.405 9.321 1.00 0.00 C ATOM 490 CG ARG A 32 -8.343 4.014 9.922 1.00 0.00 C ATOM 491 CD ARG A 32 -7.232 3.699 10.911 1.00 0.00 C ATOM 492 NE ARG A 32 -7.265 4.581 12.077 1.00 0.00 N ATOM 493 CZ ARG A 32 -7.816 4.259 13.246 1.00 0.00 C ATOM 494 NH1 ARG A 32 -8.410 3.081 13.406 1.00 0.00 N ATOM 495 NH2 ARG A 32 -7.780 5.126 14.248 1.00 0.00 N ATOM 0 H ARG A 32 -9.047 7.888 8.412 1.00 0.00 H new ATOM 0 HA ARG A 32 -9.637 5.067 7.768 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -7.322 5.429 8.676 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -8.029 6.125 10.121 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -9.307 3.934 10.424 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -8.337 3.273 9.123 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -7.322 2.663 11.238 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -6.267 3.793 10.413 1.00 0.00 H new ATOM 0 HE ARG A 32 -6.838 5.503 11.989 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -8.445 2.418 12.631 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -8.830 2.840 14.303 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -7.332 6.034 14.121 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -8.200 4.886 15.146 1.00 0.00 H new ATOM 509 N ASP A 33 -11.515 5.013 9.373 1.00 0.00 N ATOM 510 CA ASP A 33 -12.641 4.944 10.288 1.00 0.00 C ATOM 511 C ASP A 33 -12.285 3.959 11.394 1.00 0.00 C ATOM 512 O ASP A 33 -11.105 3.808 11.709 1.00 0.00 O ATOM 513 CB ASP A 33 -13.906 4.508 9.550 1.00 0.00 C ATOM 514 CG ASP A 33 -15.163 5.017 10.224 1.00 0.00 C ATOM 515 OD1 ASP A 33 -15.644 4.363 11.171 1.00 0.00 O ATOM 516 OD2 ASP A 33 -15.662 6.089 9.824 1.00 0.00 O ATOM 0 H ASP A 33 -11.485 4.260 8.686 1.00 0.00 H new ATOM 0 HA ASP A 33 -12.842 5.926 10.717 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -13.871 4.875 8.524 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -13.938 3.420 9.498 1.00 0.00 H new ATOM 521 N GLY A 34 -13.288 3.316 11.994 1.00 0.00 N ATOM 522 CA GLY A 34 -13.025 2.287 12.993 1.00 0.00 C ATOM 523 C GLY A 34 -11.932 1.338 12.548 1.00 0.00 C ATOM 524 O GLY A 34 -10.930 1.152 13.241 1.00 0.00 O ATOM 0 H GLY A 34 -14.276 3.488 11.807 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -12.737 2.758 13.933 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -13.939 1.725 13.185 1.00 0.00 H new ATOM 528 N ASP A 35 -12.130 0.750 11.383 1.00 0.00 N ATOM 529 CA ASP A 35 -11.089 -0.043 10.735 1.00 0.00 C ATOM 530 C ASP A 35 -11.120 0.163 9.216 1.00 0.00 C ATOM 531 O ASP A 35 -10.295 -0.386 8.486 1.00 0.00 O ATOM 532 CB ASP A 35 -11.242 -1.531 11.082 1.00 0.00 C ATOM 533 CG ASP A 35 -10.126 -2.385 10.506 1.00 0.00 C ATOM 534 OD1 ASP A 35 -8.954 -2.190 10.896 1.00 0.00 O ATOM 535 OD2 ASP A 35 -10.413 -3.246 9.649 1.00 0.00 O ATOM 0 H ASP A 35 -13.004 0.804 10.860 1.00 0.00 H new ATOM 0 HA ASP A 35 -10.122 0.296 11.108 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -11.260 -1.647 12.166 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.200 -1.891 10.707 1.00 0.00 H new ATOM 540 N ASP A 36 -12.053 0.983 8.741 1.00 0.00 N ATOM 541 CA ASP A 36 -12.192 1.220 7.306 1.00 0.00 C ATOM 542 C ASP A 36 -11.033 2.062 6.802 1.00 0.00 C ATOM 543 O ASP A 36 -10.499 2.900 7.530 1.00 0.00 O ATOM 544 CB ASP A 36 -13.502 1.929 6.980 1.00 0.00 C ATOM 545 CG ASP A 36 -14.698 1.294 7.656 1.00 0.00 C ATOM 546 OD1 ASP A 36 -14.948 1.597 8.842 1.00 0.00 O ATOM 547 OD2 ASP A 36 -15.386 0.478 7.011 1.00 0.00 O ATOM 0 H ASP A 36 -12.719 1.491 9.322 1.00 0.00 H new ATOM 0 HA ASP A 36 -12.191 0.249 6.811 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -13.430 2.973 7.285 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -13.655 1.922 5.901 1.00 0.00 H new ATOM 552 N ARG A 37 -10.658 1.840 5.557 1.00 0.00 N ATOM 553 CA ARG A 37 -9.488 2.490 4.972 1.00 0.00 C ATOM 554 C ARG A 37 -9.854 3.144 3.639 1.00 0.00 C ATOM 555 O ARG A 37 -10.258 2.456 2.702 1.00 0.00 O ATOM 556 CB ARG A 37 -8.366 1.464 4.739 1.00 0.00 C ATOM 557 CG ARG A 37 -8.174 0.456 5.872 1.00 0.00 C ATOM 558 CD ARG A 37 -7.546 1.077 7.115 1.00 0.00 C ATOM 559 NE ARG A 37 -7.583 0.153 8.257 1.00 0.00 N ATOM 560 CZ ARG A 37 -6.555 -0.094 9.076 1.00 0.00 C ATOM 561 NH1 ARG A 37 -5.373 0.477 8.865 1.00 0.00 N ATOM 562 NH2 ARG A 37 -6.707 -0.927 10.103 1.00 0.00 N ATOM 0 H ARG A 37 -11.148 1.210 4.922 1.00 0.00 H new ATOM 0 HA ARG A 37 -9.141 3.254 5.667 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -8.576 0.919 3.819 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -7.429 2.000 4.585 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -9.139 0.024 6.135 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -7.544 -0.362 5.522 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -6.513 1.353 6.903 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -8.075 1.995 7.371 1.00 0.00 H new ATOM 0 HE ARG A 37 -8.459 -0.337 8.439 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -5.246 1.108 8.074 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -4.594 0.284 9.494 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -7.608 -1.377 10.266 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -5.923 -1.115 10.727 1.00 0.00 H new ATOM 576 N TRP A 38 -9.724 4.463 3.555 1.00 0.00 N ATOM 577 CA TRP A 38 -9.967 5.179 2.304 1.00 0.00 C ATOM 578 C TRP A 38 -8.689 5.850 1.819 1.00 0.00 C ATOM 579 O TRP A 38 -8.165 6.753 2.475 1.00 0.00 O ATOM 580 CB TRP A 38 -11.064 6.228 2.476 1.00 0.00 C ATOM 581 CG TRP A 38 -12.404 5.648 2.810 1.00 0.00 C ATOM 582 CD1 TRP A 38 -13.278 5.055 1.946 1.00 0.00 C ATOM 583 CD2 TRP A 38 -13.027 5.614 4.097 1.00 0.00 C ATOM 584 NE1 TRP A 38 -14.406 4.654 2.618 1.00 0.00 N ATOM 585 CE2 TRP A 38 -14.278 4.988 3.939 1.00 0.00 C ATOM 586 CE3 TRP A 38 -12.651 6.054 5.369 1.00 0.00 C ATOM 587 CZ2 TRP A 38 -15.153 4.791 5.005 1.00 0.00 C ATOM 588 CZ3 TRP A 38 -13.519 5.858 6.423 1.00 0.00 C ATOM 589 CH2 TRP A 38 -14.758 5.232 6.236 1.00 0.00 C ATOM 0 H TRP A 38 -9.452 5.060 4.336 1.00 0.00 H new ATOM 0 HA TRP A 38 -10.295 4.451 1.562 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -10.771 6.921 3.264 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -11.148 6.808 1.557 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -13.107 4.921 0.888 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -15.209 4.184 2.201 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -11.698 6.539 5.524 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -16.108 4.307 4.863 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -13.238 6.193 7.410 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -15.415 5.095 7.083 1.00 0.00 H new ATOM 600 N VAL A 39 -8.193 5.414 0.670 1.00 0.00 N ATOM 601 CA VAL A 39 -6.922 5.905 0.148 1.00 0.00 C ATOM 602 C VAL A 39 -7.105 7.135 -0.738 1.00 0.00 C ATOM 603 O VAL A 39 -7.656 7.042 -1.836 1.00 0.00 O ATOM 604 CB VAL A 39 -6.191 4.817 -0.667 1.00 0.00 C ATOM 605 CG1 VAL A 39 -4.811 5.297 -1.091 1.00 0.00 C ATOM 606 CG2 VAL A 39 -6.083 3.527 0.129 1.00 0.00 C ATOM 0 H VAL A 39 -8.651 4.720 0.079 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.323 6.178 1.017 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.777 4.618 -1.564 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.314 4.514 -1.664 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -4.910 6.191 -1.707 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.219 5.530 -0.206 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.564 2.775 -0.466 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.525 3.712 1.047 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.082 3.168 0.377 1.00 0.00 H new ATOM 616 N GLU A 40 -6.640 8.283 -0.256 1.00 0.00 N ATOM 617 CA GLU A 40 -6.633 9.500 -1.061 1.00 0.00 C ATOM 618 C GLU A 40 -5.232 9.791 -1.580 1.00 0.00 C ATOM 619 O GLU A 40 -5.064 10.400 -2.637 1.00 0.00 O ATOM 620 CB GLU A 40 -7.130 10.709 -0.261 1.00 0.00 C ATOM 621 CG GLU A 40 -8.626 10.711 0.014 1.00 0.00 C ATOM 622 CD GLU A 40 -9.105 12.034 0.584 1.00 0.00 C ATOM 623 OE1 GLU A 40 -8.947 12.262 1.803 1.00 0.00 O ATOM 624 OE2 GLU A 40 -9.652 12.857 -0.179 1.00 0.00 O ATOM 0 H GLU A 40 -6.264 8.396 0.685 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.309 9.333 -1.899 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.598 10.743 0.690 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.872 11.619 -0.803 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -9.163 10.500 -0.911 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.866 9.909 0.712 1.00 0.00 H new ATOM 631 N ARG A 41 -4.224 9.347 -0.842 1.00 0.00 N ATOM 632 CA ARG A 41 -2.849 9.661 -1.188 1.00 0.00 C ATOM 633 C ARG A 41 -1.967 8.421 -1.142 1.00 0.00 C ATOM 634 O ARG A 41 -1.975 7.671 -0.167 1.00 0.00 O ATOM 635 CB ARG A 41 -2.295 10.729 -0.241 1.00 0.00 C ATOM 636 CG ARG A 41 -0.925 11.242 -0.649 1.00 0.00 C ATOM 637 CD ARG A 41 -0.968 11.900 -2.018 1.00 0.00 C ATOM 638 NE ARG A 41 0.365 12.225 -2.514 1.00 0.00 N ATOM 639 CZ ARG A 41 0.596 12.862 -3.658 1.00 0.00 C ATOM 640 NH1 ARG A 41 -0.418 13.246 -4.427 1.00 0.00 N ATOM 641 NH2 ARG A 41 1.846 13.105 -4.033 1.00 0.00 N ATOM 0 H ARG A 41 -4.333 8.773 -0.006 1.00 0.00 H new ATOM 0 HA ARG A 41 -2.843 10.044 -2.208 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -2.992 11.566 -0.202 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.236 10.316 0.766 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -0.567 11.959 0.090 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -0.214 10.416 -0.662 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -1.464 11.234 -2.724 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -1.566 12.810 -1.964 1.00 0.00 H new ATOM 0 HE ARG A 41 1.168 11.947 -1.949 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -1.377 13.052 -4.140 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -0.237 13.734 -5.304 1.00 0.00 H new ATOM 0 HH21 ARG A 41 2.623 12.803 -3.445 1.00 0.00 H new ATOM 0 HH22 ARG A 41 2.030 13.593 -4.910 1.00 0.00 H new ATOM 655 N VAL A 42 -1.211 8.210 -2.208 1.00 0.00 N ATOM 656 CA VAL A 42 -0.251 7.122 -2.263 1.00 0.00 C ATOM 657 C VAL A 42 1.162 7.684 -2.149 1.00 0.00 C ATOM 658 O VAL A 42 1.486 8.680 -2.792 1.00 0.00 O ATOM 659 CB VAL A 42 -0.383 6.315 -3.579 1.00 0.00 C ATOM 660 CG1 VAL A 42 0.610 5.161 -3.613 1.00 0.00 C ATOM 661 CG2 VAL A 42 -1.806 5.798 -3.753 1.00 0.00 C ATOM 0 H VAL A 42 -1.245 8.783 -3.051 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.455 6.448 -1.431 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.155 6.985 -4.408 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.496 4.611 -4.547 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.625 5.552 -3.543 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.420 4.493 -2.773 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -1.877 5.234 -4.683 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -2.063 5.150 -2.915 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.498 6.640 -3.785 1.00 0.00 H new ATOM 671 N TYR A 43 1.982 7.063 -1.318 1.00 0.00 N ATOM 672 CA TYR A 43 3.366 7.478 -1.142 1.00 0.00 C ATOM 673 C TYR A 43 4.311 6.424 -1.713 1.00 0.00 C ATOM 674 O TYR A 43 4.737 5.513 -1.004 1.00 0.00 O ATOM 675 CB TYR A 43 3.683 7.723 0.339 1.00 0.00 C ATOM 676 CG TYR A 43 2.981 8.925 0.937 1.00 0.00 C ATOM 677 CD1 TYR A 43 1.698 8.819 1.462 1.00 0.00 C ATOM 678 CD2 TYR A 43 3.609 10.163 0.985 1.00 0.00 C ATOM 679 CE1 TYR A 43 1.062 9.915 2.016 1.00 0.00 C ATOM 680 CE2 TYR A 43 2.980 11.262 1.536 1.00 0.00 C ATOM 681 CZ TYR A 43 1.708 11.135 2.051 1.00 0.00 C ATOM 682 OH TYR A 43 1.080 12.227 2.607 1.00 0.00 O ATOM 0 H TYR A 43 1.711 6.261 -0.749 1.00 0.00 H new ATOM 0 HA TYR A 43 3.510 8.414 -1.682 1.00 0.00 H new ATOM 0 HB2 TYR A 43 3.408 6.836 0.909 1.00 0.00 H new ATOM 0 HB3 TYR A 43 4.759 7.853 0.451 1.00 0.00 H new ATOM 0 HD1 TYR A 43 1.190 7.866 1.437 1.00 0.00 H new ATOM 0 HD2 TYR A 43 4.606 10.268 0.584 1.00 0.00 H new ATOM 0 HE1 TYR A 43 0.065 9.817 2.419 1.00 0.00 H new ATOM 0 HE2 TYR A 43 3.483 12.217 1.563 1.00 0.00 H new ATOM 0 HH TYR A 43 1.418 13.047 2.190 1.00 0.00 H new ATOM 692 N PRO A 44 4.614 6.504 -3.017 1.00 0.00 N ATOM 693 CA PRO A 44 5.473 5.530 -3.686 1.00 0.00 C ATOM 694 C PRO A 44 6.925 5.639 -3.225 1.00 0.00 C ATOM 695 O PRO A 44 7.608 6.622 -3.516 1.00 0.00 O ATOM 696 CB PRO A 44 5.352 5.890 -5.176 1.00 0.00 C ATOM 697 CG PRO A 44 4.224 6.865 -5.267 1.00 0.00 C ATOM 698 CD PRO A 44 4.168 7.554 -3.937 1.00 0.00 C ATOM 0 HA PRO A 44 5.174 4.505 -3.465 1.00 0.00 H new ATOM 0 HB2 PRO A 44 6.278 6.327 -5.549 1.00 0.00 H new ATOM 0 HB3 PRO A 44 5.152 5.003 -5.778 1.00 0.00 H new ATOM 0 HG2 PRO A 44 4.391 7.581 -6.071 1.00 0.00 H new ATOM 0 HG3 PRO A 44 3.285 6.356 -5.483 1.00 0.00 H new ATOM 0 HD2 PRO A 44 4.821 8.426 -3.904 1.00 0.00 H new ATOM 0 HD3 PRO A 44 3.162 7.900 -3.701 1.00 0.00 H new ATOM 706 N LEU A 45 7.387 4.627 -2.502 1.00 0.00 N ATOM 707 CA LEU A 45 8.745 4.624 -1.976 1.00 0.00 C ATOM 708 C LEU A 45 9.696 3.925 -2.940 1.00 0.00 C ATOM 709 O LEU A 45 9.269 3.355 -3.949 1.00 0.00 O ATOM 710 CB LEU A 45 8.791 3.945 -0.603 1.00 0.00 C ATOM 711 CG LEU A 45 7.967 4.630 0.492 1.00 0.00 C ATOM 712 CD1 LEU A 45 8.071 3.858 1.797 1.00 0.00 C ATOM 713 CD2 LEU A 45 8.423 6.070 0.686 1.00 0.00 C ATOM 0 H LEU A 45 6.841 3.798 -2.267 1.00 0.00 H new ATOM 0 HA LEU A 45 9.066 5.660 -1.863 1.00 0.00 H new ATOM 0 HB2 LEU A 45 8.440 2.919 -0.711 1.00 0.00 H new ATOM 0 HB3 LEU A 45 9.829 3.894 -0.275 1.00 0.00 H new ATOM 0 HG LEU A 45 6.923 4.641 0.179 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.480 4.358 2.564 1.00 0.00 H new ATOM 0 HD12 LEU A 45 7.695 2.845 1.652 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.113 3.816 2.113 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.825 6.539 1.468 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.474 6.083 0.976 1.00 0.00 H new ATOM 0 HD23 LEU A 45 8.297 6.620 -0.246 1.00 0.00 H new ATOM 725 N ASN A 46 10.980 3.971 -2.626 1.00 0.00 N ATOM 726 CA ASN A 46 11.999 3.384 -3.483 1.00 0.00 C ATOM 727 C ASN A 46 12.647 2.195 -2.786 1.00 0.00 C ATOM 728 O ASN A 46 12.564 2.065 -1.565 1.00 0.00 O ATOM 729 CB ASN A 46 13.057 4.438 -3.839 1.00 0.00 C ATOM 730 CG ASN A 46 13.949 4.027 -5.001 1.00 0.00 C ATOM 731 OD1 ASN A 46 13.616 4.259 -6.160 1.00 0.00 O ATOM 732 ND2 ASN A 46 15.092 3.426 -4.703 1.00 0.00 N ATOM 0 H ASN A 46 11.343 4.411 -1.780 1.00 0.00 H new ATOM 0 HA ASN A 46 11.531 3.035 -4.403 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.558 5.375 -4.087 1.00 0.00 H new ATOM 0 HB3 ASN A 46 13.678 4.630 -2.964 1.00 0.00 H new ATOM 0 HD21 ASN A 46 15.727 3.140 -5.448 1.00 0.00 H new ATOM 0 HD22 ASN A 46 15.336 3.249 -3.729 1.00 0.00 H new ATOM 739 N ASN A 47 13.281 1.334 -3.565 1.00 0.00 N ATOM 740 CA ASN A 47 13.945 0.151 -3.033 1.00 0.00 C ATOM 741 C ASN A 47 15.346 0.492 -2.526 1.00 0.00 C ATOM 742 O ASN A 47 16.222 0.867 -3.305 1.00 0.00 O ATOM 743 CB ASN A 47 14.020 -0.938 -4.111 1.00 0.00 C ATOM 744 CG ASN A 47 14.890 -2.108 -3.700 1.00 0.00 C ATOM 745 OD1 ASN A 47 16.097 -2.103 -3.924 1.00 0.00 O ATOM 746 ND2 ASN A 47 14.284 -3.125 -3.111 1.00 0.00 N ATOM 0 H ASN A 47 13.351 1.432 -4.578 1.00 0.00 H new ATOM 0 HA ASN A 47 13.362 -0.221 -2.191 1.00 0.00 H new ATOM 0 HB2 ASN A 47 13.014 -1.297 -4.329 1.00 0.00 H new ATOM 0 HB3 ASN A 47 14.411 -0.506 -5.032 1.00 0.00 H new ATOM 0 HD21 ASN A 47 14.822 -3.943 -2.825 1.00 0.00 H new ATOM 0 HD22 ASN A 47 13.279 -3.091 -2.942 1.00 0.00 H new ATOM 753 N LEU A 48 15.533 0.413 -1.212 1.00 0.00 N ATOM 754 CA LEU A 48 16.842 0.613 -0.609 1.00 0.00 C ATOM 755 C LEU A 48 17.732 -0.612 -0.813 1.00 0.00 C ATOM 756 O LEU A 48 18.822 -0.512 -1.384 1.00 0.00 O ATOM 757 CB LEU A 48 16.694 0.915 0.885 1.00 0.00 C ATOM 758 CG LEU A 48 16.273 2.347 1.246 1.00 0.00 C ATOM 759 CD1 LEU A 48 17.355 3.339 0.846 1.00 0.00 C ATOM 760 CD2 LEU A 48 14.945 2.726 0.603 1.00 0.00 C ATOM 0 H LEU A 48 14.789 0.211 -0.544 1.00 0.00 H new ATOM 0 HA LEU A 48 17.316 1.463 -1.099 1.00 0.00 H new ATOM 0 HB2 LEU A 48 15.960 0.226 1.303 1.00 0.00 H new ATOM 0 HB3 LEU A 48 17.645 0.703 1.374 1.00 0.00 H new ATOM 0 HG LEU A 48 16.140 2.384 2.327 1.00 0.00 H new ATOM 0 HD11 LEU A 48 17.039 4.348 1.110 1.00 0.00 H new ATOM 0 HD12 LEU A 48 18.280 3.100 1.371 1.00 0.00 H new ATOM 0 HD13 LEU A 48 17.523 3.281 -0.229 1.00 0.00 H new ATOM 0 HD21 LEU A 48 14.683 3.746 0.883 1.00 0.00 H new ATOM 0 HD22 LEU A 48 15.034 2.659 -0.481 1.00 0.00 H new ATOM 0 HD23 LEU A 48 14.167 2.044 0.946 1.00 0.00 H new ATOM 772 N ASP A 49 17.262 -1.763 -0.339 1.00 0.00 N ATOM 773 CA ASP A 49 18.003 -3.016 -0.472 1.00 0.00 C ATOM 774 C ASP A 49 17.432 -3.830 -1.614 1.00 0.00 C ATOM 775 O ASP A 49 16.275 -4.251 -1.560 1.00 0.00 O ATOM 776 CB ASP A 49 17.931 -3.844 0.816 1.00 0.00 C ATOM 777 CG ASP A 49 18.631 -3.186 1.989 1.00 0.00 C ATOM 778 OD1 ASP A 49 19.851 -3.397 2.160 1.00 0.00 O ATOM 779 OD2 ASP A 49 17.962 -2.465 2.759 1.00 0.00 O ATOM 0 H ASP A 49 16.368 -1.855 0.143 1.00 0.00 H new ATOM 0 HA ASP A 49 19.046 -2.769 -0.670 1.00 0.00 H new ATOM 0 HB2 ASP A 49 16.885 -4.013 1.074 1.00 0.00 H new ATOM 0 HB3 ASP A 49 18.377 -4.822 0.637 1.00 0.00 H new ATOM 784 N GLN A 50 18.237 -4.069 -2.636 1.00 0.00 N ATOM 785 CA GLN A 50 17.746 -4.727 -3.836 1.00 0.00 C ATOM 786 C GLN A 50 17.544 -6.216 -3.606 1.00 0.00 C ATOM 787 O GLN A 50 18.473 -7.018 -3.716 1.00 0.00 O ATOM 788 CB GLN A 50 18.674 -4.478 -5.024 1.00 0.00 C ATOM 789 CG GLN A 50 18.779 -3.010 -5.396 1.00 0.00 C ATOM 790 CD GLN A 50 19.341 -2.795 -6.785 1.00 0.00 C ATOM 791 OE1 GLN A 50 20.554 -2.675 -6.968 1.00 0.00 O ATOM 792 NE2 GLN A 50 18.463 -2.739 -7.772 1.00 0.00 N ATOM 0 H GLN A 50 19.226 -3.820 -2.660 1.00 0.00 H new ATOM 0 HA GLN A 50 16.775 -4.292 -4.074 1.00 0.00 H new ATOM 0 HB2 GLN A 50 19.667 -4.860 -4.788 1.00 0.00 H new ATOM 0 HB3 GLN A 50 18.312 -5.040 -5.885 1.00 0.00 H new ATOM 0 HG2 GLN A 50 17.791 -2.553 -5.334 1.00 0.00 H new ATOM 0 HG3 GLN A 50 19.412 -2.500 -4.670 1.00 0.00 H new ATOM 0 HE21 GLN A 50 17.468 -2.843 -7.576 1.00 0.00 H new ATOM 0 HE22 GLN A 50 18.781 -2.591 -8.730 1.00 0.00 H new ATOM 801 N SER A 51 16.325 -6.559 -3.238 1.00 0.00 N ATOM 802 CA SER A 51 15.927 -7.935 -3.028 1.00 0.00 C ATOM 803 C SER A 51 14.702 -8.249 -3.886 1.00 0.00 C ATOM 804 O SER A 51 14.124 -7.350 -4.496 1.00 0.00 O ATOM 805 CB SER A 51 15.607 -8.150 -1.549 1.00 0.00 C ATOM 806 OG SER A 51 16.633 -7.624 -0.721 1.00 0.00 O ATOM 0 H SER A 51 15.578 -5.884 -3.075 1.00 0.00 H new ATOM 0 HA SER A 51 16.739 -8.602 -3.316 1.00 0.00 H new ATOM 0 HB2 SER A 51 14.658 -7.671 -1.306 1.00 0.00 H new ATOM 0 HB3 SER A 51 15.486 -9.215 -1.351 1.00 0.00 H new ATOM 0 HG SER A 51 16.403 -7.773 0.220 1.00 0.00 H new ATOM 812 N PRO A 52 14.338 -9.532 -4.027 1.00 0.00 N ATOM 813 CA PRO A 52 13.071 -9.923 -4.623 1.00 0.00 C ATOM 814 C PRO A 52 12.004 -10.258 -3.576 1.00 0.00 C ATOM 815 O PRO A 52 10.900 -10.684 -3.922 1.00 0.00 O ATOM 816 CB PRO A 52 13.467 -11.175 -5.395 1.00 0.00 C ATOM 817 CG PRO A 52 14.578 -11.793 -4.596 1.00 0.00 C ATOM 818 CD PRO A 52 15.152 -10.713 -3.703 1.00 0.00 C ATOM 0 HA PRO A 52 12.625 -9.131 -5.225 1.00 0.00 H new ATOM 0 HB2 PRO A 52 12.625 -11.860 -5.494 1.00 0.00 H new ATOM 0 HB3 PRO A 52 13.797 -10.928 -6.404 1.00 0.00 H new ATOM 0 HG2 PRO A 52 14.204 -12.625 -3.999 1.00 0.00 H new ATOM 0 HG3 PRO A 52 15.347 -12.194 -5.256 1.00 0.00 H new ATOM 0 HD2 PRO A 52 15.072 -10.979 -2.649 1.00 0.00 H new ATOM 0 HD3 PRO A 52 16.208 -10.541 -3.909 1.00 0.00 H new ATOM 826 N GLU A 53 12.332 -10.045 -2.300 1.00 0.00 N ATOM 827 CA GLU A 53 11.491 -10.507 -1.196 1.00 0.00 C ATOM 828 C GLU A 53 11.436 -9.490 -0.052 1.00 0.00 C ATOM 829 O GLU A 53 10.359 -9.039 0.340 1.00 0.00 O ATOM 830 CB GLU A 53 12.010 -11.842 -0.648 1.00 0.00 C ATOM 831 CG GLU A 53 12.000 -12.981 -1.655 1.00 0.00 C ATOM 832 CD GLU A 53 10.612 -13.274 -2.186 1.00 0.00 C ATOM 833 OE1 GLU A 53 9.636 -13.117 -1.426 1.00 0.00 O ATOM 834 OE2 GLU A 53 10.493 -13.689 -3.360 1.00 0.00 O ATOM 0 H GLU A 53 13.176 -9.554 -2.006 1.00 0.00 H new ATOM 0 HA GLU A 53 10.485 -10.632 -1.597 1.00 0.00 H new ATOM 0 HB2 GLU A 53 13.029 -11.701 -0.287 1.00 0.00 H new ATOM 0 HB3 GLU A 53 11.404 -12.128 0.212 1.00 0.00 H new ATOM 0 HG2 GLU A 53 12.659 -12.732 -2.487 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.403 -13.879 -1.187 1.00 0.00 H new ATOM 841 N HIS A 54 12.601 -9.146 0.495 1.00 0.00 N ATOM 842 CA HIS A 54 12.672 -8.272 1.668 1.00 0.00 C ATOM 843 C HIS A 54 12.788 -6.815 1.261 1.00 0.00 C ATOM 844 O HIS A 54 13.616 -6.454 0.429 1.00 0.00 O ATOM 845 CB HIS A 54 13.860 -8.623 2.557 1.00 0.00 C ATOM 846 CG HIS A 54 13.743 -9.928 3.283 1.00 0.00 C ATOM 847 ND1 HIS A 54 14.327 -10.155 4.507 1.00 0.00 N ATOM 848 CD2 HIS A 54 13.116 -11.077 2.950 1.00 0.00 C ATOM 849 CE1 HIS A 54 14.070 -11.389 4.893 1.00 0.00 C ATOM 850 NE2 HIS A 54 13.336 -11.973 3.966 1.00 0.00 N ATOM 0 H HIS A 54 13.508 -9.458 0.147 1.00 0.00 H new ATOM 0 HA HIS A 54 11.748 -8.425 2.225 1.00 0.00 H new ATOM 0 HB2 HIS A 54 14.760 -8.645 1.943 1.00 0.00 H new ATOM 0 HB3 HIS A 54 13.994 -7.827 3.290 1.00 0.00 H new ATOM 0 HD2 HIS A 54 12.547 -11.257 2.050 1.00 0.00 H new ATOM 0 HE1 HIS A 54 14.404 -11.845 5.813 1.00 0.00 H new ATOM 0 HE2 HIS A 54 12.989 -12.932 3.999 1.00 0.00 H new ATOM 859 N PHE A 55 12.010 -5.976 1.909 1.00 0.00 N ATOM 860 CA PHE A 55 11.930 -4.573 1.540 1.00 0.00 C ATOM 861 C PHE A 55 12.422 -3.681 2.671 1.00 0.00 C ATOM 862 O PHE A 55 12.275 -4.011 3.851 1.00 0.00 O ATOM 863 CB PHE A 55 10.490 -4.196 1.159 1.00 0.00 C ATOM 864 CG PHE A 55 9.495 -4.312 2.288 1.00 0.00 C ATOM 865 CD1 PHE A 55 8.887 -5.525 2.577 1.00 0.00 C ATOM 866 CD2 PHE A 55 9.163 -3.202 3.054 1.00 0.00 C ATOM 867 CE1 PHE A 55 7.972 -5.629 3.607 1.00 0.00 C ATOM 868 CE2 PHE A 55 8.249 -3.302 4.085 1.00 0.00 C ATOM 869 CZ PHE A 55 7.653 -4.517 4.363 1.00 0.00 C ATOM 0 H PHE A 55 11.420 -6.239 2.698 1.00 0.00 H new ATOM 0 HA PHE A 55 12.575 -4.418 0.675 1.00 0.00 H new ATOM 0 HB2 PHE A 55 10.482 -3.171 0.788 1.00 0.00 H new ATOM 0 HB3 PHE A 55 10.165 -4.835 0.338 1.00 0.00 H new ATOM 0 HD1 PHE A 55 9.132 -6.398 1.990 1.00 0.00 H new ATOM 0 HD2 PHE A 55 9.625 -2.249 2.841 1.00 0.00 H new ATOM 0 HE1 PHE A 55 7.506 -6.579 3.821 1.00 0.00 H new ATOM 0 HE2 PHE A 55 8.001 -2.431 4.673 1.00 0.00 H new ATOM 0 HZ PHE A 55 6.939 -4.598 5.170 1.00 0.00 H new ATOM 879 N SER A 56 13.004 -2.554 2.300 1.00 0.00 N ATOM 880 CA SER A 56 13.448 -1.561 3.261 1.00 0.00 C ATOM 881 C SER A 56 12.980 -0.182 2.822 1.00 0.00 C ATOM 882 O SER A 56 13.114 0.176 1.650 1.00 0.00 O ATOM 883 CB SER A 56 14.974 -1.574 3.380 1.00 0.00 C ATOM 884 OG SER A 56 15.476 -2.892 3.544 1.00 0.00 O ATOM 0 H SER A 56 13.181 -2.302 1.328 1.00 0.00 H new ATOM 0 HA SER A 56 13.020 -1.800 4.235 1.00 0.00 H new ATOM 0 HB2 SER A 56 15.413 -1.126 2.488 1.00 0.00 H new ATOM 0 HB3 SER A 56 15.278 -0.960 4.228 1.00 0.00 H new ATOM 0 HG SER A 56 16.455 -2.868 3.569 1.00 0.00 H new ATOM 890 N MET A 57 12.425 0.582 3.747 1.00 0.00 N ATOM 891 CA MET A 57 11.978 1.934 3.444 1.00 0.00 C ATOM 892 C MET A 57 12.976 2.954 3.977 1.00 0.00 C ATOM 893 O MET A 57 13.665 2.701 4.967 1.00 0.00 O ATOM 894 CB MET A 57 10.576 2.210 4.013 1.00 0.00 C ATOM 895 CG MET A 57 10.440 1.992 5.513 1.00 0.00 C ATOM 896 SD MET A 57 9.678 0.405 5.926 1.00 0.00 S ATOM 897 CE MET A 57 8.044 0.601 5.201 1.00 0.00 C ATOM 0 H MET A 57 12.273 0.292 4.713 1.00 0.00 H new ATOM 0 HA MET A 57 11.919 2.027 2.360 1.00 0.00 H new ATOM 0 HB2 MET A 57 10.303 3.240 3.784 1.00 0.00 H new ATOM 0 HB3 MET A 57 9.859 1.569 3.501 1.00 0.00 H new ATOM 0 HG2 MET A 57 11.426 2.047 5.974 1.00 0.00 H new ATOM 0 HG3 MET A 57 9.843 2.798 5.940 1.00 0.00 H new ATOM 0 HE1 MET A 57 7.326 -0.005 5.753 1.00 0.00 H new ATOM 0 HE2 MET A 57 7.748 1.649 5.250 1.00 0.00 H new ATOM 0 HE3 MET A 57 8.067 0.278 4.160 1.00 0.00 H new ATOM 907 N ASP A 58 13.066 4.097 3.307 1.00 0.00 N ATOM 908 CA ASP A 58 13.989 5.152 3.719 1.00 0.00 C ATOM 909 C ASP A 58 13.401 5.928 4.896 1.00 0.00 C ATOM 910 O ASP A 58 12.202 6.204 4.919 1.00 0.00 O ATOM 911 CB ASP A 58 14.254 6.096 2.538 1.00 0.00 C ATOM 912 CG ASP A 58 15.162 7.260 2.891 1.00 0.00 C ATOM 913 OD1 ASP A 58 14.640 8.305 3.320 1.00 0.00 O ATOM 914 OD2 ASP A 58 16.394 7.138 2.735 1.00 0.00 O ATOM 0 H ASP A 58 12.514 4.318 2.478 1.00 0.00 H new ATOM 0 HA ASP A 58 14.932 4.704 4.033 1.00 0.00 H new ATOM 0 HB2 ASP A 58 14.702 5.529 1.722 1.00 0.00 H new ATOM 0 HB3 ASP A 58 13.304 6.484 2.172 1.00 0.00 H new ATOM 919 N PRO A 59 14.237 6.305 5.878 1.00 0.00 N ATOM 920 CA PRO A 59 13.775 7.017 7.069 1.00 0.00 C ATOM 921 C PRO A 59 13.530 8.504 6.826 1.00 0.00 C ATOM 922 O PRO A 59 12.662 9.109 7.461 1.00 0.00 O ATOM 923 CB PRO A 59 14.925 6.819 8.058 1.00 0.00 C ATOM 924 CG PRO A 59 16.142 6.659 7.209 1.00 0.00 C ATOM 925 CD PRO A 59 15.687 6.024 5.922 1.00 0.00 C ATOM 0 HA PRO A 59 12.814 6.638 7.416 1.00 0.00 H new ATOM 0 HB2 PRO A 59 15.021 7.673 8.728 1.00 0.00 H new ATOM 0 HB3 PRO A 59 14.761 5.941 8.683 1.00 0.00 H new ATOM 0 HG2 PRO A 59 16.612 7.624 7.020 1.00 0.00 H new ATOM 0 HG3 PRO A 59 16.884 6.035 7.708 1.00 0.00 H new ATOM 0 HD2 PRO A 59 16.203 6.451 5.062 1.00 0.00 H new ATOM 0 HD3 PRO A 59 15.886 4.952 5.913 1.00 0.00 H new ATOM 933 N ARG A 60 14.280 9.083 5.899 1.00 0.00 N ATOM 934 CA ARG A 60 14.207 10.514 5.639 1.00 0.00 C ATOM 935 C ARG A 60 12.942 10.836 4.858 1.00 0.00 C ATOM 936 O ARG A 60 12.203 11.764 5.197 1.00 0.00 O ATOM 937 CB ARG A 60 15.436 10.969 4.853 1.00 0.00 C ATOM 938 CG ARG A 60 16.752 10.503 5.454 1.00 0.00 C ATOM 939 CD ARG A 60 17.929 10.937 4.601 1.00 0.00 C ATOM 940 NE ARG A 60 19.207 10.459 5.131 1.00 0.00 N ATOM 941 CZ ARG A 60 20.087 11.238 5.763 1.00 0.00 C ATOM 942 NH1 ARG A 60 19.789 12.506 6.029 1.00 0.00 N ATOM 943 NH2 ARG A 60 21.258 10.747 6.147 1.00 0.00 N ATOM 0 H ARG A 60 14.948 8.582 5.313 1.00 0.00 H new ATOM 0 HA ARG A 60 14.181 11.044 6.591 1.00 0.00 H new ATOM 0 HB2 ARG A 60 15.361 10.597 3.831 1.00 0.00 H new ATOM 0 HB3 ARG A 60 15.438 12.058 4.796 1.00 0.00 H new ATOM 0 HG2 ARG A 60 16.859 10.909 6.460 1.00 0.00 H new ATOM 0 HG3 ARG A 60 16.748 9.417 5.547 1.00 0.00 H new ATOM 0 HD2 ARG A 60 17.797 10.562 3.586 1.00 0.00 H new ATOM 0 HD3 ARG A 60 17.948 12.025 4.539 1.00 0.00 H new ATOM 0 HE ARG A 60 19.438 9.473 5.010 1.00 0.00 H new ATOM 0 HH11 ARG A 60 18.885 12.887 5.750 1.00 0.00 H new ATOM 0 HH12 ARG A 60 20.464 13.098 6.512 1.00 0.00 H new ATOM 0 HH21 ARG A 60 21.488 9.771 5.959 1.00 0.00 H new ATOM 0 HH22 ARG A 60 21.928 11.345 6.630 1.00 0.00 H new ATOM 957 N GLU A 61 12.687 10.043 3.824 1.00 0.00 N ATOM 958 CA GLU A 61 11.492 10.205 3.012 1.00 0.00 C ATOM 959 C GLU A 61 10.249 9.861 3.823 1.00 0.00 C ATOM 960 O GLU A 61 9.200 10.486 3.663 1.00 0.00 O ATOM 961 CB GLU A 61 11.562 9.321 1.765 1.00 0.00 C ATOM 962 CG GLU A 61 12.643 9.738 0.781 1.00 0.00 C ATOM 963 CD GLU A 61 12.441 11.146 0.260 1.00 0.00 C ATOM 964 OE1 GLU A 61 11.327 11.456 -0.218 1.00 0.00 O ATOM 965 OE2 GLU A 61 13.389 11.957 0.326 1.00 0.00 O ATOM 0 H GLU A 61 13.296 9.279 3.529 1.00 0.00 H new ATOM 0 HA GLU A 61 11.433 11.247 2.698 1.00 0.00 H new ATOM 0 HB2 GLU A 61 11.739 8.290 2.071 1.00 0.00 H new ATOM 0 HB3 GLU A 61 10.596 9.342 1.261 1.00 0.00 H new ATOM 0 HG2 GLU A 61 13.617 9.670 1.266 1.00 0.00 H new ATOM 0 HG3 GLU A 61 12.655 9.042 -0.058 1.00 0.00 H new ATOM 972 N GLN A 62 10.383 8.872 4.702 1.00 0.00 N ATOM 973 CA GLN A 62 9.290 8.439 5.550 1.00 0.00 C ATOM 974 C GLN A 62 8.904 9.533 6.539 1.00 0.00 C ATOM 975 O GLN A 62 7.722 9.797 6.750 1.00 0.00 O ATOM 976 CB GLN A 62 9.686 7.168 6.300 1.00 0.00 C ATOM 977 CG GLN A 62 8.591 6.625 7.190 1.00 0.00 C ATOM 978 CD GLN A 62 8.999 5.361 7.920 1.00 0.00 C ATOM 979 OE1 GLN A 62 8.798 4.253 7.431 1.00 0.00 O ATOM 980 NE2 GLN A 62 9.580 5.523 9.098 1.00 0.00 N ATOM 0 H GLN A 62 11.250 8.354 4.842 1.00 0.00 H new ATOM 0 HA GLN A 62 8.426 8.229 4.919 1.00 0.00 H new ATOM 0 HB2 GLN A 62 9.968 6.403 5.577 1.00 0.00 H new ATOM 0 HB3 GLN A 62 10.568 7.374 6.907 1.00 0.00 H new ATOM 0 HG2 GLN A 62 8.311 7.386 7.919 1.00 0.00 H new ATOM 0 HG3 GLN A 62 7.707 6.421 6.587 1.00 0.00 H new ATOM 0 HE21 GLN A 62 9.729 6.462 9.469 1.00 0.00 H new ATOM 0 HE22 GLN A 62 9.879 4.709 9.635 1.00 0.00 H new ATOM 989 N LEU A 63 9.907 10.174 7.131 1.00 0.00 N ATOM 990 CA LEU A 63 9.671 11.237 8.100 1.00 0.00 C ATOM 991 C LEU A 63 8.858 12.362 7.470 1.00 0.00 C ATOM 992 O LEU A 63 7.866 12.824 8.041 1.00 0.00 O ATOM 993 CB LEU A 63 11.006 11.780 8.619 1.00 0.00 C ATOM 994 CG LEU A 63 10.901 12.884 9.675 1.00 0.00 C ATOM 995 CD1 LEU A 63 10.241 12.355 10.939 1.00 0.00 C ATOM 996 CD2 LEU A 63 12.276 13.459 9.986 1.00 0.00 C ATOM 0 H LEU A 63 10.892 9.975 6.956 1.00 0.00 H new ATOM 0 HA LEU A 63 9.105 10.826 8.936 1.00 0.00 H new ATOM 0 HB2 LEU A 63 11.577 10.952 9.039 1.00 0.00 H new ATOM 0 HB3 LEU A 63 11.576 12.163 7.773 1.00 0.00 H new ATOM 0 HG LEU A 63 10.278 13.684 9.275 1.00 0.00 H new ATOM 0 HD11 LEU A 63 10.176 13.154 11.677 1.00 0.00 H new ATOM 0 HD12 LEU A 63 9.239 11.996 10.703 1.00 0.00 H new ATOM 0 HD13 LEU A 63 10.835 11.535 11.344 1.00 0.00 H new ATOM 0 HD21 LEU A 63 12.181 14.242 10.738 1.00 0.00 H new ATOM 0 HD22 LEU A 63 12.924 12.668 10.365 1.00 0.00 H new ATOM 0 HD23 LEU A 63 12.709 13.879 9.078 1.00 0.00 H new ATOM 1008 N THR A 64 9.271 12.775 6.280 1.00 0.00 N ATOM 1009 CA THR A 64 8.574 13.816 5.549 1.00 0.00 C ATOM 1010 C THR A 64 7.180 13.349 5.135 1.00 0.00 C ATOM 1011 O THR A 64 6.220 14.109 5.210 1.00 0.00 O ATOM 1012 CB THR A 64 9.374 14.236 4.304 1.00 0.00 C ATOM 1013 OG1 THR A 64 10.730 14.511 4.681 1.00 0.00 O ATOM 1014 CG2 THR A 64 8.766 15.469 3.648 1.00 0.00 C ATOM 0 H THR A 64 10.090 12.401 5.801 1.00 0.00 H new ATOM 0 HA THR A 64 8.473 14.677 6.210 1.00 0.00 H new ATOM 0 HB THR A 64 9.344 13.418 3.584 1.00 0.00 H new ATOM 0 HG1 THR A 64 11.222 13.668 4.769 1.00 0.00 H new ATOM 0 HG21 THR A 64 9.353 15.742 2.771 1.00 0.00 H new ATOM 0 HG22 THR A 64 7.741 15.252 3.346 1.00 0.00 H new ATOM 0 HG23 THR A 64 8.768 16.297 4.357 1.00 0.00 H new ATOM 1022 N ALA A 65 7.074 12.088 4.723 1.00 0.00 N ATOM 1023 CA ALA A 65 5.796 11.516 4.315 1.00 0.00 C ATOM 1024 C ALA A 65 4.794 11.533 5.468 1.00 0.00 C ATOM 1025 O ALA A 65 3.631 11.894 5.287 1.00 0.00 O ATOM 1026 CB ALA A 65 5.991 10.097 3.803 1.00 0.00 C ATOM 0 H ALA A 65 7.861 11.442 4.663 1.00 0.00 H new ATOM 0 HA ALA A 65 5.393 12.128 3.508 1.00 0.00 H new ATOM 0 HB1 ALA A 65 5.028 9.683 3.502 1.00 0.00 H new ATOM 0 HB2 ALA A 65 6.665 10.109 2.946 1.00 0.00 H new ATOM 0 HB3 ALA A 65 6.420 9.481 4.593 1.00 0.00 H new ATOM 1032 N VAL A 66 5.256 11.151 6.655 1.00 0.00 N ATOM 1033 CA VAL A 66 4.411 11.150 7.846 1.00 0.00 C ATOM 1034 C VAL A 66 3.963 12.569 8.185 1.00 0.00 C ATOM 1035 O VAL A 66 2.788 12.811 8.477 1.00 0.00 O ATOM 1036 CB VAL A 66 5.140 10.532 9.061 1.00 0.00 C ATOM 1037 CG1 VAL A 66 4.298 10.656 10.324 1.00 0.00 C ATOM 1038 CG2 VAL A 66 5.472 9.073 8.791 1.00 0.00 C ATOM 0 H VAL A 66 6.213 10.837 6.818 1.00 0.00 H new ATOM 0 HA VAL A 66 3.537 10.537 7.624 1.00 0.00 H new ATOM 0 HB VAL A 66 6.068 11.083 9.216 1.00 0.00 H new ATOM 0 HG11 VAL A 66 4.834 10.213 11.164 1.00 0.00 H new ATOM 0 HG12 VAL A 66 4.105 11.709 10.531 1.00 0.00 H new ATOM 0 HG13 VAL A 66 3.351 10.135 10.183 1.00 0.00 H new ATOM 0 HG21 VAL A 66 5.985 8.651 9.655 1.00 0.00 H new ATOM 0 HG22 VAL A 66 4.552 8.518 8.609 1.00 0.00 H new ATOM 0 HG23 VAL A 66 6.118 9.003 7.916 1.00 0.00 H new ATOM 1048 N LYS A 67 4.903 13.503 8.118 1.00 0.00 N ATOM 1049 CA LYS A 67 4.622 14.905 8.409 1.00 0.00 C ATOM 1050 C LYS A 67 3.662 15.481 7.375 1.00 0.00 C ATOM 1051 O LYS A 67 2.740 16.220 7.712 1.00 0.00 O ATOM 1052 CB LYS A 67 5.922 15.711 8.428 1.00 0.00 C ATOM 1053 CG LYS A 67 5.752 17.139 8.918 1.00 0.00 C ATOM 1054 CD LYS A 67 7.095 17.829 9.085 1.00 0.00 C ATOM 1055 CE LYS A 67 6.925 19.258 9.568 1.00 0.00 C ATOM 1056 NZ LYS A 67 8.227 19.911 9.862 1.00 0.00 N ATOM 0 H LYS A 67 5.872 13.314 7.863 1.00 0.00 H new ATOM 0 HA LYS A 67 4.154 14.969 9.391 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.645 15.202 9.066 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.342 15.730 7.422 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.139 17.698 8.211 1.00 0.00 H new ATOM 0 HG3 LYS A 67 5.220 17.138 9.870 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.706 17.273 9.796 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.629 17.825 8.135 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.394 19.835 8.811 1.00 0.00 H new ATOM 0 HE3 LYS A 67 6.306 19.265 10.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 8.061 20.884 10.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 8.724 19.377 10.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.809 19.929 9.000 1.00 0.00 H new ATOM 1070 N ASP A 68 3.879 15.112 6.121 1.00 0.00 N ATOM 1071 CA ASP A 68 3.053 15.584 5.011 1.00 0.00 C ATOM 1072 C ASP A 68 1.625 15.092 5.171 1.00 0.00 C ATOM 1073 O ASP A 68 0.663 15.858 5.057 1.00 0.00 O ATOM 1074 CB ASP A 68 3.631 15.072 3.686 1.00 0.00 C ATOM 1075 CG ASP A 68 2.830 15.511 2.476 1.00 0.00 C ATOM 1076 OD1 ASP A 68 3.054 16.638 1.988 1.00 0.00 O ATOM 1077 OD2 ASP A 68 1.984 14.726 1.999 1.00 0.00 O ATOM 0 H ASP A 68 4.629 14.480 5.841 1.00 0.00 H new ATOM 0 HA ASP A 68 3.051 16.674 5.010 1.00 0.00 H new ATOM 0 HB2 ASP A 68 4.656 15.427 3.583 1.00 0.00 H new ATOM 0 HB3 ASP A 68 3.672 13.983 3.711 1.00 0.00 H new ATOM 1082 N MET A 69 1.509 13.806 5.442 1.00 0.00 N ATOM 1083 CA MET A 69 0.225 13.155 5.639 1.00 0.00 C ATOM 1084 C MET A 69 -0.537 13.796 6.790 1.00 0.00 C ATOM 1085 O MET A 69 -1.706 14.164 6.651 1.00 0.00 O ATOM 1086 CB MET A 69 0.476 11.682 5.927 1.00 0.00 C ATOM 1087 CG MET A 69 -0.762 10.810 5.919 1.00 0.00 C ATOM 1088 SD MET A 69 -0.391 9.108 5.455 1.00 0.00 S ATOM 1089 CE MET A 69 1.217 8.880 6.211 1.00 0.00 C ATOM 0 H MET A 69 2.308 13.178 5.533 1.00 0.00 H new ATOM 0 HA MET A 69 -0.383 13.265 4.741 1.00 0.00 H new ATOM 0 HB2 MET A 69 1.178 11.297 5.188 1.00 0.00 H new ATOM 0 HB3 MET A 69 0.958 11.594 6.901 1.00 0.00 H new ATOM 0 HG2 MET A 69 -1.221 10.824 6.908 1.00 0.00 H new ATOM 0 HG3 MET A 69 -1.492 11.224 5.223 1.00 0.00 H new ATOM 0 HE1 MET A 69 1.433 7.815 6.291 1.00 0.00 H new ATOM 0 HE2 MET A 69 1.979 9.360 5.597 1.00 0.00 H new ATOM 0 HE3 MET A 69 1.218 9.327 7.205 1.00 0.00 H new ATOM 1099 N ARG A 70 0.150 13.958 7.911 1.00 0.00 N ATOM 1100 CA ARG A 70 -0.439 14.595 9.087 1.00 0.00 C ATOM 1101 C ARG A 70 -0.833 16.041 8.787 1.00 0.00 C ATOM 1102 O ARG A 70 -1.886 16.508 9.219 1.00 0.00 O ATOM 1103 CB ARG A 70 0.532 14.563 10.276 1.00 0.00 C ATOM 1104 CG ARG A 70 0.040 15.370 11.473 1.00 0.00 C ATOM 1105 CD ARG A 70 1.066 15.419 12.591 1.00 0.00 C ATOM 1106 NE ARG A 70 0.703 16.399 13.617 1.00 0.00 N ATOM 1107 CZ ARG A 70 1.493 16.745 14.633 1.00 0.00 C ATOM 1108 NH1 ARG A 70 2.649 16.123 14.824 1.00 0.00 N ATOM 1109 NH2 ARG A 70 1.115 17.701 15.472 1.00 0.00 N ATOM 0 H ARG A 70 1.117 13.658 8.034 1.00 0.00 H new ATOM 0 HA ARG A 70 -1.335 14.031 9.348 1.00 0.00 H new ATOM 0 HB2 ARG A 70 0.688 13.529 10.582 1.00 0.00 H new ATOM 0 HB3 ARG A 70 1.500 14.950 9.957 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -0.195 16.385 11.153 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -0.885 14.932 11.849 1.00 0.00 H new ATOM 0 HD2 ARG A 70 1.156 14.432 13.046 1.00 0.00 H new ATOM 0 HD3 ARG A 70 2.043 15.670 12.178 1.00 0.00 H new ATOM 0 HE ARG A 70 -0.212 16.845 13.550 1.00 0.00 H new ATOM 0 HH11 ARG A 70 2.937 15.376 14.192 1.00 0.00 H new ATOM 0 HH12 ARG A 70 3.250 16.392 15.603 1.00 0.00 H new ATOM 0 HH21 ARG A 70 0.220 18.171 15.339 1.00 0.00 H new ATOM 0 HH22 ARG A 70 1.720 17.966 16.250 1.00 0.00 H new ATOM 1123 N LYS A 71 0.013 16.733 8.035 1.00 0.00 N ATOM 1124 CA LYS A 71 -0.193 18.146 7.723 1.00 0.00 C ATOM 1125 C LYS A 71 -1.520 18.372 7.003 1.00 0.00 C ATOM 1126 O LYS A 71 -2.222 19.345 7.270 1.00 0.00 O ATOM 1127 CB LYS A 71 0.959 18.658 6.857 1.00 0.00 C ATOM 1128 CG LYS A 71 0.927 20.154 6.596 1.00 0.00 C ATOM 1129 CD LYS A 71 2.096 20.583 5.724 1.00 0.00 C ATOM 1130 CE LYS A 71 2.065 22.074 5.432 1.00 0.00 C ATOM 1131 NZ LYS A 71 0.802 22.487 4.766 1.00 0.00 N ATOM 0 H LYS A 71 0.858 16.335 7.625 1.00 0.00 H new ATOM 0 HA LYS A 71 -0.221 18.698 8.663 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.902 18.405 7.341 1.00 0.00 H new ATOM 0 HB3 LYS A 71 0.941 18.134 5.902 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -0.011 20.421 6.109 1.00 0.00 H new ATOM 0 HG3 LYS A 71 0.959 20.692 7.543 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.032 20.329 6.221 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.073 20.028 4.786 1.00 0.00 H new ATOM 0 HE2 LYS A 71 2.181 22.628 6.364 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.912 22.336 4.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 0.913 23.444 4.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 0.581 21.822 3.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.027 22.485 5.460 1.00 0.00 H new ATOM 1145 N ASN A 72 -1.861 17.465 6.097 1.00 0.00 N ATOM 1146 CA ASN A 72 -3.101 17.590 5.333 1.00 0.00 C ATOM 1147 C ASN A 72 -4.285 17.050 6.131 1.00 0.00 C ATOM 1148 O ASN A 72 -5.438 17.379 5.856 1.00 0.00 O ATOM 1149 CB ASN A 72 -2.988 16.846 4.000 1.00 0.00 C ATOM 1150 CG ASN A 72 -4.106 17.197 3.031 1.00 0.00 C ATOM 1151 OD1 ASN A 72 -3.991 18.143 2.255 1.00 0.00 O ATOM 1152 ND2 ASN A 72 -5.192 16.439 3.063 1.00 0.00 N ATOM 0 H ASN A 72 -1.304 16.641 5.872 1.00 0.00 H new ATOM 0 HA ASN A 72 -3.269 18.648 5.133 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.028 17.079 3.539 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -2.999 15.772 4.187 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -5.968 16.633 2.430 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -5.252 15.662 3.721 1.00 0.00 H new ATOM 1159 N GLY A 73 -3.993 16.226 7.126 1.00 0.00 N ATOM 1160 CA GLY A 73 -5.043 15.669 7.957 1.00 0.00 C ATOM 1161 C GLY A 73 -5.328 14.214 7.640 1.00 0.00 C ATOM 1162 O GLY A 73 -6.384 13.689 7.992 1.00 0.00 O ATOM 0 H GLY A 73 -3.048 15.932 7.374 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -4.758 15.759 9.005 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -5.955 16.251 7.823 1.00 0.00 H new ATOM 1166 N TRP A 74 -4.387 13.558 6.977 1.00 0.00 N ATOM 1167 CA TRP A 74 -4.529 12.150 6.645 1.00 0.00 C ATOM 1168 C TRP A 74 -3.836 11.275 7.682 1.00 0.00 C ATOM 1169 O TRP A 74 -3.080 11.765 8.525 1.00 0.00 O ATOM 1170 CB TRP A 74 -3.942 11.852 5.263 1.00 0.00 C ATOM 1171 CG TRP A 74 -4.767 12.351 4.119 1.00 0.00 C ATOM 1172 CD1 TRP A 74 -6.120 12.249 3.979 1.00 0.00 C ATOM 1173 CD2 TRP A 74 -4.288 12.996 2.933 1.00 0.00 C ATOM 1174 NE1 TRP A 74 -6.512 12.795 2.783 1.00 0.00 N ATOM 1175 CE2 TRP A 74 -5.408 13.261 2.122 1.00 0.00 C ATOM 1176 CE3 TRP A 74 -3.023 13.381 2.479 1.00 0.00 C ATOM 1177 CZ2 TRP A 74 -5.300 13.893 0.885 1.00 0.00 C ATOM 1178 CZ3 TRP A 74 -2.918 14.003 1.250 1.00 0.00 C ATOM 1179 CH2 TRP A 74 -4.051 14.255 0.464 1.00 0.00 C ATOM 0 H TRP A 74 -3.515 13.980 6.658 1.00 0.00 H new ATOM 0 HA TRP A 74 -5.595 11.923 6.638 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -2.949 12.297 5.200 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -3.815 10.774 5.160 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -6.785 11.804 4.704 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -7.472 12.845 2.441 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -2.144 13.196 3.078 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -6.173 14.090 0.280 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -1.945 14.301 0.888 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -3.935 14.744 -0.492 1.00 0.00 H new ATOM 1190 N VAL A 75 -4.106 9.980 7.614 1.00 0.00 N ATOM 1191 CA VAL A 75 -3.451 9.004 8.474 1.00 0.00 C ATOM 1192 C VAL A 75 -2.925 7.846 7.639 1.00 0.00 C ATOM 1193 O VAL A 75 -3.408 7.606 6.529 1.00 0.00 O ATOM 1194 CB VAL A 75 -4.398 8.453 9.566 1.00 0.00 C ATOM 1195 CG1 VAL A 75 -4.763 9.540 10.566 1.00 0.00 C ATOM 1196 CG2 VAL A 75 -5.650 7.853 8.943 1.00 0.00 C ATOM 0 H VAL A 75 -4.782 9.577 6.965 1.00 0.00 H new ATOM 0 HA VAL A 75 -2.628 9.518 8.972 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.872 7.663 10.101 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.430 9.128 11.324 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -3.857 9.914 11.044 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.264 10.358 10.048 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.301 7.472 9.730 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.177 8.620 8.375 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.370 7.037 8.277 1.00 0.00 H new ATOM 1206 N MET A 76 -1.938 7.135 8.166 1.00 0.00 N ATOM 1207 CA MET A 76 -1.354 6.005 7.456 1.00 0.00 C ATOM 1208 C MET A 76 -2.286 4.802 7.520 1.00 0.00 C ATOM 1209 O MET A 76 -2.627 4.318 8.599 1.00 0.00 O ATOM 1210 CB MET A 76 0.015 5.642 8.039 1.00 0.00 C ATOM 1211 CG MET A 76 0.699 4.494 7.311 1.00 0.00 C ATOM 1212 SD MET A 76 2.307 4.075 8.016 1.00 0.00 S ATOM 1213 CE MET A 76 3.223 5.582 7.709 1.00 0.00 C ATOM 0 H MET A 76 -1.525 7.320 9.080 1.00 0.00 H new ATOM 0 HA MET A 76 -1.218 6.293 6.414 1.00 0.00 H new ATOM 0 HB2 MET A 76 0.660 6.520 8.004 1.00 0.00 H new ATOM 0 HB3 MET A 76 -0.105 5.376 9.089 1.00 0.00 H new ATOM 0 HG2 MET A 76 0.054 3.616 7.341 1.00 0.00 H new ATOM 0 HG3 MET A 76 0.826 4.760 6.262 1.00 0.00 H new ATOM 0 HE1 MET A 76 4.291 5.385 7.805 1.00 0.00 H new ATOM 0 HE2 MET A 76 3.009 5.939 6.702 1.00 0.00 H new ATOM 0 HE3 MET A 76 2.928 6.341 8.433 1.00 0.00 H new ATOM 1223 N LEU A 77 -2.700 4.330 6.359 1.00 0.00 N ATOM 1224 CA LEU A 77 -3.602 3.197 6.282 1.00 0.00 C ATOM 1225 C LEU A 77 -2.814 1.897 6.270 1.00 0.00 C ATOM 1226 O LEU A 77 -3.287 0.861 6.743 1.00 0.00 O ATOM 1227 CB LEU A 77 -4.462 3.295 5.024 1.00 0.00 C ATOM 1228 CG LEU A 77 -5.278 4.581 4.901 1.00 0.00 C ATOM 1229 CD1 LEU A 77 -6.033 4.601 3.587 1.00 0.00 C ATOM 1230 CD2 LEU A 77 -6.239 4.723 6.072 1.00 0.00 C ATOM 0 H LEU A 77 -2.425 4.715 5.455 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.251 3.208 7.158 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -3.815 3.208 4.151 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -5.144 2.445 5.001 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.592 5.428 4.920 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.610 5.523 3.513 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -5.325 4.548 2.760 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.708 3.746 3.542 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.810 5.645 5.964 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.922 3.873 6.088 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.675 4.752 7.004 1.00 0.00 H new ATOM 1242 N GLY A 78 -1.612 1.965 5.724 1.00 0.00 N ATOM 1243 CA GLY A 78 -0.762 0.801 5.632 1.00 0.00 C ATOM 1244 C GLY A 78 0.276 0.960 4.547 1.00 0.00 C ATOM 1245 O GLY A 78 0.789 2.060 4.330 1.00 0.00 O ATOM 0 H GLY A 78 -1.206 2.818 5.338 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -0.267 0.633 6.589 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.370 -0.080 5.429 1.00 0.00 H new ATOM 1249 N ASN A 79 0.567 -0.124 3.847 1.00 0.00 N ATOM 1250 CA ASN A 79 1.571 -0.105 2.792 1.00 0.00 C ATOM 1251 C ASN A 79 1.255 -1.152 1.740 1.00 0.00 C ATOM 1252 O ASN A 79 0.336 -1.957 1.907 1.00 0.00 O ATOM 1253 CB ASN A 79 2.987 -0.346 3.344 1.00 0.00 C ATOM 1254 CG ASN A 79 3.243 -1.765 3.851 1.00 0.00 C ATOM 1255 OD1 ASN A 79 4.344 -2.292 3.703 1.00 0.00 O ATOM 1256 ND2 ASN A 79 2.253 -2.382 4.475 1.00 0.00 N ATOM 0 H ASN A 79 0.122 -1.031 3.989 1.00 0.00 H new ATOM 0 HA ASN A 79 1.545 0.887 2.342 1.00 0.00 H new ATOM 0 HB2 ASN A 79 3.711 -0.119 2.561 1.00 0.00 H new ATOM 0 HB3 ASN A 79 3.168 0.355 4.159 1.00 0.00 H new ATOM 0 HD21 ASN A 79 2.392 -3.321 4.849 1.00 0.00 H new ATOM 0 HD22 ASN A 79 1.351 -1.919 4.582 1.00 0.00 H new ATOM 1263 N PHE A 80 2.026 -1.142 0.668 1.00 0.00 N ATOM 1264 CA PHE A 80 1.854 -2.123 -0.387 1.00 0.00 C ATOM 1265 C PHE A 80 3.184 -2.792 -0.708 1.00 0.00 C ATOM 1266 O PHE A 80 4.241 -2.162 -0.656 1.00 0.00 O ATOM 1267 CB PHE A 80 1.217 -1.508 -1.648 1.00 0.00 C ATOM 1268 CG PHE A 80 2.061 -0.500 -2.382 1.00 0.00 C ATOM 1269 CD1 PHE A 80 2.016 0.845 -2.048 1.00 0.00 C ATOM 1270 CD2 PHE A 80 2.881 -0.898 -3.429 1.00 0.00 C ATOM 1271 CE1 PHE A 80 2.775 1.770 -2.741 1.00 0.00 C ATOM 1272 CE2 PHE A 80 3.638 0.023 -4.125 1.00 0.00 C ATOM 1273 CZ PHE A 80 3.585 1.360 -3.780 1.00 0.00 C ATOM 0 H PHE A 80 2.774 -0.468 0.505 1.00 0.00 H new ATOM 0 HA PHE A 80 1.162 -2.884 -0.026 1.00 0.00 H new ATOM 0 HB2 PHE A 80 0.967 -2.315 -2.337 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.280 -1.030 -1.363 1.00 0.00 H new ATOM 0 HD1 PHE A 80 1.382 1.174 -1.238 1.00 0.00 H new ATOM 0 HD2 PHE A 80 2.927 -1.942 -3.703 1.00 0.00 H new ATOM 0 HE1 PHE A 80 2.734 2.814 -2.469 1.00 0.00 H new ATOM 0 HE2 PHE A 80 4.271 -0.301 -4.938 1.00 0.00 H new ATOM 0 HZ PHE A 80 4.176 2.083 -4.323 1.00 0.00 H new ATOM 1283 N HIS A 81 3.115 -4.075 -1.012 1.00 0.00 N ATOM 1284 CA HIS A 81 4.288 -4.889 -1.267 1.00 0.00 C ATOM 1285 C HIS A 81 4.036 -5.773 -2.478 1.00 0.00 C ATOM 1286 O HIS A 81 3.012 -6.446 -2.568 1.00 0.00 O ATOM 1287 CB HIS A 81 4.591 -5.727 -0.021 1.00 0.00 C ATOM 1288 CG HIS A 81 5.702 -6.724 -0.159 1.00 0.00 C ATOM 1289 ND1 HIS A 81 7.031 -6.378 -0.233 1.00 0.00 N ATOM 1290 CD2 HIS A 81 5.667 -8.075 -0.176 1.00 0.00 C ATOM 1291 CE1 HIS A 81 7.764 -7.476 -0.285 1.00 0.00 C ATOM 1292 NE2 HIS A 81 6.962 -8.525 -0.248 1.00 0.00 N ATOM 0 H HIS A 81 2.235 -4.585 -1.089 1.00 0.00 H new ATOM 0 HA HIS A 81 5.151 -4.259 -1.481 1.00 0.00 H new ATOM 0 HB2 HIS A 81 4.835 -5.050 0.798 1.00 0.00 H new ATOM 0 HB3 HIS A 81 3.684 -6.259 0.265 1.00 0.00 H new ATOM 0 HD1 HIS A 81 7.393 -5.425 -0.246 1.00 0.00 H new ATOM 0 HD2 HIS A 81 4.780 -8.690 -0.140 1.00 0.00 H new ATOM 0 HE1 HIS A 81 8.842 -7.510 -0.347 1.00 0.00 H new ATOM 1301 N SER A 82 4.973 -5.778 -3.397 1.00 0.00 N ATOM 1302 CA SER A 82 4.787 -6.466 -4.665 1.00 0.00 C ATOM 1303 C SER A 82 5.749 -7.639 -4.798 1.00 0.00 C ATOM 1304 O SER A 82 6.794 -7.668 -4.152 1.00 0.00 O ATOM 1305 CB SER A 82 5.001 -5.483 -5.816 1.00 0.00 C ATOM 1306 OG SER A 82 4.262 -4.293 -5.605 1.00 0.00 O ATOM 0 H SER A 82 5.876 -5.314 -3.295 1.00 0.00 H new ATOM 0 HA SER A 82 3.770 -6.857 -4.701 1.00 0.00 H new ATOM 0 HB2 SER A 82 6.061 -5.247 -5.906 1.00 0.00 H new ATOM 0 HB3 SER A 82 4.696 -5.944 -6.755 1.00 0.00 H new ATOM 0 HG SER A 82 4.747 -3.712 -4.982 1.00 0.00 H new ATOM 1312 N HIS A 83 5.375 -8.613 -5.613 1.00 0.00 N ATOM 1313 CA HIS A 83 6.251 -9.733 -5.923 1.00 0.00 C ATOM 1314 C HIS A 83 6.380 -9.890 -7.437 1.00 0.00 C ATOM 1315 O HIS A 83 5.401 -9.720 -8.165 1.00 0.00 O ATOM 1316 CB HIS A 83 5.710 -11.024 -5.305 1.00 0.00 C ATOM 1317 CG HIS A 83 6.272 -11.338 -3.949 1.00 0.00 C ATOM 1318 ND1 HIS A 83 5.505 -11.794 -2.900 1.00 0.00 N ATOM 1319 CD2 HIS A 83 7.547 -11.314 -3.496 1.00 0.00 C ATOM 1320 CE1 HIS A 83 6.286 -12.031 -1.861 1.00 0.00 C ATOM 1321 NE2 HIS A 83 7.533 -11.751 -2.196 1.00 0.00 N ATOM 0 H HIS A 83 4.466 -8.651 -6.074 1.00 0.00 H new ATOM 0 HA HIS A 83 7.236 -9.533 -5.500 1.00 0.00 H new ATOM 0 HB2 HIS A 83 4.625 -10.950 -5.228 1.00 0.00 H new ATOM 0 HB3 HIS A 83 5.927 -11.854 -5.977 1.00 0.00 H new ATOM 0 HD2 HIS A 83 8.418 -11.007 -4.056 1.00 0.00 H new ATOM 0 HE1 HIS A 83 5.959 -12.394 -0.898 1.00 0.00 H new ATOM 0 HE2 HIS A 83 8.348 -11.844 -1.590 1.00 0.00 H new ATOM 1330 N PRO A 84 7.586 -10.229 -7.922 1.00 0.00 N ATOM 1331 CA PRO A 84 7.864 -10.331 -9.363 1.00 0.00 C ATOM 1332 C PRO A 84 7.165 -11.508 -10.052 1.00 0.00 C ATOM 1333 O PRO A 84 6.416 -11.314 -11.005 1.00 0.00 O ATOM 1334 CB PRO A 84 9.388 -10.509 -9.421 1.00 0.00 C ATOM 1335 CG PRO A 84 9.766 -11.065 -8.091 1.00 0.00 C ATOM 1336 CD PRO A 84 8.791 -10.485 -7.106 1.00 0.00 C ATOM 0 HA PRO A 84 7.490 -9.455 -9.892 1.00 0.00 H new ATOM 0 HB2 PRO A 84 9.675 -11.185 -10.227 1.00 0.00 H new ATOM 0 HB3 PRO A 84 9.889 -9.559 -9.608 1.00 0.00 H new ATOM 0 HG2 PRO A 84 9.715 -12.154 -8.095 1.00 0.00 H new ATOM 0 HG3 PRO A 84 10.790 -10.794 -7.832 1.00 0.00 H new ATOM 0 HD2 PRO A 84 8.584 -11.178 -6.291 1.00 0.00 H new ATOM 0 HD3 PRO A 84 9.173 -9.569 -6.656 1.00 0.00 H new ATOM 1344 N ALA A 85 7.393 -12.718 -9.562 1.00 0.00 N ATOM 1345 CA ALA A 85 6.892 -13.909 -10.238 1.00 0.00 C ATOM 1346 C ALA A 85 6.197 -14.844 -9.260 1.00 0.00 C ATOM 1347 O ALA A 85 6.251 -16.067 -9.399 1.00 0.00 O ATOM 1348 CB ALA A 85 8.034 -14.628 -10.941 1.00 0.00 C ATOM 0 H ALA A 85 7.917 -12.902 -8.706 1.00 0.00 H new ATOM 0 HA ALA A 85 6.158 -13.597 -10.981 1.00 0.00 H new ATOM 0 HB1 ALA A 85 7.650 -15.516 -11.443 1.00 0.00 H new ATOM 0 HB2 ALA A 85 8.485 -13.962 -11.676 1.00 0.00 H new ATOM 0 HB3 ALA A 85 8.785 -14.922 -10.208 1.00 0.00 H new ATOM 1354 N THR A 86 5.527 -14.263 -8.286 1.00 0.00 N ATOM 1355 CA THR A 86 4.839 -15.036 -7.267 1.00 0.00 C ATOM 1356 C THR A 86 3.459 -14.448 -6.983 1.00 0.00 C ATOM 1357 O THR A 86 3.226 -13.258 -7.219 1.00 0.00 O ATOM 1358 CB THR A 86 5.676 -15.095 -5.974 1.00 0.00 C ATOM 1359 OG1 THR A 86 6.374 -13.859 -5.794 1.00 0.00 O ATOM 1360 CG2 THR A 86 6.672 -16.245 -6.021 1.00 0.00 C ATOM 0 H THR A 86 5.443 -13.252 -8.177 1.00 0.00 H new ATOM 0 HA THR A 86 4.709 -16.052 -7.640 1.00 0.00 H new ATOM 0 HB THR A 86 5.000 -15.260 -5.135 1.00 0.00 H new ATOM 0 HG1 THR A 86 6.904 -13.899 -4.970 1.00 0.00 H new ATOM 0 HG21 THR A 86 7.250 -16.264 -5.097 1.00 0.00 H new ATOM 0 HG22 THR A 86 6.135 -17.187 -6.133 1.00 0.00 H new ATOM 0 HG23 THR A 86 7.346 -16.109 -6.867 1.00 0.00 H new ATOM 1368 N PRO A 87 2.521 -15.279 -6.495 1.00 0.00 N ATOM 1369 CA PRO A 87 1.135 -14.868 -6.246 1.00 0.00 C ATOM 1370 C PRO A 87 1.007 -13.836 -5.129 1.00 0.00 C ATOM 1371 O PRO A 87 1.951 -13.587 -4.377 1.00 0.00 O ATOM 1372 CB PRO A 87 0.428 -16.168 -5.843 1.00 0.00 C ATOM 1373 CG PRO A 87 1.352 -17.265 -6.244 1.00 0.00 C ATOM 1374 CD PRO A 87 2.734 -16.693 -6.152 1.00 0.00 C ATOM 0 HA PRO A 87 0.708 -14.386 -7.126 1.00 0.00 H new ATOM 0 HB2 PRO A 87 0.232 -16.192 -4.771 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -0.535 -16.263 -6.345 1.00 0.00 H new ATOM 0 HG2 PRO A 87 1.242 -18.128 -5.587 1.00 0.00 H new ATOM 0 HG3 PRO A 87 1.137 -17.606 -7.257 1.00 0.00 H new ATOM 0 HD2 PRO A 87 3.155 -16.809 -5.153 1.00 0.00 H new ATOM 0 HD3 PRO A 87 3.421 -17.179 -6.845 1.00 0.00 H new ATOM 1382 N ALA A 88 -0.171 -13.237 -5.032 1.00 0.00 N ATOM 1383 CA ALA A 88 -0.444 -12.258 -3.998 1.00 0.00 C ATOM 1384 C ALA A 88 -0.819 -12.949 -2.693 1.00 0.00 C ATOM 1385 O ALA A 88 -1.993 -13.058 -2.348 1.00 0.00 O ATOM 1386 CB ALA A 88 -1.541 -11.297 -4.437 1.00 0.00 C ATOM 0 H ALA A 88 -0.954 -13.415 -5.661 1.00 0.00 H new ATOM 0 HA ALA A 88 0.463 -11.678 -3.829 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -1.728 -10.572 -3.645 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -1.227 -10.774 -5.340 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -2.454 -11.856 -4.640 1.00 0.00 H new ATOM 1392 N ARG A 89 0.192 -13.459 -2.009 1.00 0.00 N ATOM 1393 CA ARG A 89 0.022 -14.096 -0.714 1.00 0.00 C ATOM 1394 C ARG A 89 1.252 -13.845 0.140 1.00 0.00 C ATOM 1395 O ARG A 89 2.365 -13.777 -0.383 1.00 0.00 O ATOM 1396 CB ARG A 89 -0.206 -15.604 -0.861 1.00 0.00 C ATOM 1397 CG ARG A 89 -1.638 -15.985 -1.196 1.00 0.00 C ATOM 1398 CD ARG A 89 -1.806 -17.493 -1.283 1.00 0.00 C ATOM 1399 NE ARG A 89 -3.211 -17.882 -1.379 1.00 0.00 N ATOM 1400 CZ ARG A 89 -3.627 -19.120 -1.622 1.00 0.00 C ATOM 1401 NH1 ARG A 89 -2.753 -20.092 -1.854 1.00 0.00 N ATOM 1402 NH2 ARG A 89 -4.923 -19.377 -1.654 1.00 0.00 N ATOM 0 H ARG A 89 1.157 -13.443 -2.338 1.00 0.00 H new ATOM 0 HA ARG A 89 -0.857 -13.666 -0.234 1.00 0.00 H new ATOM 0 HB2 ARG A 89 0.452 -15.986 -1.641 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.082 -16.096 0.068 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -2.309 -15.586 -0.436 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -1.924 -15.530 -2.144 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -1.266 -17.869 -2.152 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.360 -17.959 -0.404 1.00 0.00 H new ATOM 0 HE ARG A 89 -3.917 -17.157 -1.251 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -1.753 -19.891 -1.847 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -3.082 -21.040 -2.040 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -5.596 -18.627 -1.493 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -5.251 -20.325 -1.840 1.00 0.00 H new ATOM 1416 N PRO A 90 1.072 -13.678 1.455 1.00 0.00 N ATOM 1417 CA PRO A 90 2.178 -13.460 2.380 1.00 0.00 C ATOM 1418 C PRO A 90 2.969 -14.739 2.626 1.00 0.00 C ATOM 1419 O PRO A 90 2.481 -15.667 3.280 1.00 0.00 O ATOM 1420 CB PRO A 90 1.499 -12.991 3.678 1.00 0.00 C ATOM 1421 CG PRO A 90 0.053 -12.802 3.340 1.00 0.00 C ATOM 1422 CD PRO A 90 -0.220 -13.678 2.152 1.00 0.00 C ATOM 0 HA PRO A 90 2.896 -12.739 1.989 1.00 0.00 H new ATOM 0 HB2 PRO A 90 1.621 -13.728 4.471 1.00 0.00 H new ATOM 0 HB3 PRO A 90 1.941 -12.061 4.036 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -0.582 -13.079 4.181 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -0.159 -11.758 3.110 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -0.521 -14.683 2.449 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -1.018 -13.278 1.527 1.00 0.00 H new ATOM 1430 N SER A 91 4.180 -14.796 2.091 1.00 0.00 N ATOM 1431 CA SER A 91 5.040 -15.948 2.292 1.00 0.00 C ATOM 1432 C SER A 91 5.689 -15.861 3.667 1.00 0.00 C ATOM 1433 O SER A 91 5.511 -14.867 4.370 1.00 0.00 O ATOM 1434 CB SER A 91 6.108 -16.013 1.196 1.00 0.00 C ATOM 1435 OG SER A 91 6.971 -14.885 1.243 1.00 0.00 O ATOM 0 H SER A 91 4.587 -14.058 1.516 1.00 0.00 H new ATOM 0 HA SER A 91 4.442 -16.858 2.237 1.00 0.00 H new ATOM 0 HB2 SER A 91 6.693 -16.925 1.310 1.00 0.00 H new ATOM 0 HB3 SER A 91 5.626 -16.064 0.220 1.00 0.00 H new ATOM 0 HG SER A 91 6.515 -14.108 0.858 1.00 0.00 H new ATOM 1441 N ALA A 92 6.438 -16.888 4.053 1.00 0.00 N ATOM 1442 CA ALA A 92 7.119 -16.896 5.346 1.00 0.00 C ATOM 1443 C ALA A 92 8.023 -15.675 5.495 1.00 0.00 C ATOM 1444 O ALA A 92 8.183 -15.136 6.593 1.00 0.00 O ATOM 1445 CB ALA A 92 7.920 -18.178 5.517 1.00 0.00 C ATOM 0 H ALA A 92 6.590 -17.726 3.491 1.00 0.00 H new ATOM 0 HA ALA A 92 6.362 -16.853 6.129 1.00 0.00 H new ATOM 0 HB1 ALA A 92 8.421 -18.168 6.485 1.00 0.00 H new ATOM 0 HB2 ALA A 92 7.249 -19.036 5.464 1.00 0.00 H new ATOM 0 HB3 ALA A 92 8.664 -18.250 4.724 1.00 0.00 H new ATOM 1451 N GLU A 93 8.591 -15.234 4.379 1.00 0.00 N ATOM 1452 CA GLU A 93 9.431 -14.045 4.358 1.00 0.00 C ATOM 1453 C GLU A 93 8.611 -12.805 4.705 1.00 0.00 C ATOM 1454 O GLU A 93 9.008 -12.000 5.547 1.00 0.00 O ATOM 1455 CB GLU A 93 10.071 -13.878 2.975 1.00 0.00 C ATOM 1456 CG GLU A 93 10.962 -15.041 2.565 1.00 0.00 C ATOM 1457 CD GLU A 93 12.154 -15.209 3.483 1.00 0.00 C ATOM 1458 OE1 GLU A 93 13.139 -14.457 3.323 1.00 0.00 O ATOM 1459 OE2 GLU A 93 12.115 -16.088 4.365 1.00 0.00 O ATOM 0 H GLU A 93 8.483 -15.686 3.471 1.00 0.00 H new ATOM 0 HA GLU A 93 10.217 -14.163 5.103 1.00 0.00 H new ATOM 0 HB2 GLU A 93 9.282 -13.758 2.232 1.00 0.00 H new ATOM 0 HB3 GLU A 93 10.660 -12.961 2.966 1.00 0.00 H new ATOM 0 HG2 GLU A 93 10.376 -15.960 2.563 1.00 0.00 H new ATOM 0 HG3 GLU A 93 11.312 -14.884 1.545 1.00 0.00 H new ATOM 1466 N ASP A 94 7.450 -12.675 4.067 1.00 0.00 N ATOM 1467 CA ASP A 94 6.572 -11.522 4.282 1.00 0.00 C ATOM 1468 C ASP A 94 5.960 -11.574 5.676 1.00 0.00 C ATOM 1469 O ASP A 94 5.759 -10.545 6.321 1.00 0.00 O ATOM 1470 CB ASP A 94 5.446 -11.485 3.239 1.00 0.00 C ATOM 1471 CG ASP A 94 5.942 -11.602 1.811 1.00 0.00 C ATOM 1472 OD1 ASP A 94 6.589 -10.655 1.314 1.00 0.00 O ATOM 1473 OD2 ASP A 94 5.675 -12.647 1.178 1.00 0.00 O ATOM 0 H ASP A 94 7.093 -13.354 3.395 1.00 0.00 H new ATOM 0 HA ASP A 94 7.178 -10.621 4.181 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.748 -12.297 3.441 1.00 0.00 H new ATOM 0 HB3 ASP A 94 4.891 -10.553 3.348 1.00 0.00 H new ATOM 1478 N LYS A 95 5.670 -12.787 6.133 1.00 0.00 N ATOM 1479 CA LYS A 95 5.089 -13.006 7.455 1.00 0.00 C ATOM 1480 C LYS A 95 6.003 -12.472 8.555 1.00 0.00 C ATOM 1481 O LYS A 95 5.535 -11.921 9.550 1.00 0.00 O ATOM 1482 CB LYS A 95 4.818 -14.500 7.669 1.00 0.00 C ATOM 1483 CG LYS A 95 3.704 -15.054 6.787 1.00 0.00 C ATOM 1484 CD LYS A 95 2.334 -14.553 7.216 1.00 0.00 C ATOM 1485 CE LYS A 95 1.882 -15.213 8.509 1.00 0.00 C ATOM 1486 NZ LYS A 95 1.687 -16.679 8.347 1.00 0.00 N ATOM 0 H LYS A 95 5.829 -13.643 5.602 1.00 0.00 H new ATOM 0 HA LYS A 95 4.147 -12.461 7.507 1.00 0.00 H new ATOM 0 HB2 LYS A 95 5.734 -15.058 7.475 1.00 0.00 H new ATOM 0 HB3 LYS A 95 4.559 -14.667 8.714 1.00 0.00 H new ATOM 0 HG2 LYS A 95 3.886 -14.768 5.751 1.00 0.00 H new ATOM 0 HG3 LYS A 95 3.720 -16.143 6.825 1.00 0.00 H new ATOM 0 HD2 LYS A 95 2.366 -13.472 7.349 1.00 0.00 H new ATOM 0 HD3 LYS A 95 1.608 -14.756 6.429 1.00 0.00 H new ATOM 0 HE2 LYS A 95 2.622 -15.029 9.288 1.00 0.00 H new ATOM 0 HE3 LYS A 95 0.949 -14.758 8.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 1.075 -17.034 9.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 1.241 -16.870 7.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 2.609 -17.159 8.391 1.00 0.00 H new ATOM 1500 N ARG A 96 7.307 -12.633 8.364 1.00 0.00 N ATOM 1501 CA ARG A 96 8.288 -12.153 9.332 1.00 0.00 C ATOM 1502 C ARG A 96 8.456 -10.638 9.251 1.00 0.00 C ATOM 1503 O ARG A 96 8.960 -10.010 10.182 1.00 0.00 O ATOM 1504 CB ARG A 96 9.636 -12.841 9.116 1.00 0.00 C ATOM 1505 CG ARG A 96 9.640 -14.305 9.513 1.00 0.00 C ATOM 1506 CD ARG A 96 11.018 -14.918 9.352 1.00 0.00 C ATOM 1507 NE ARG A 96 11.080 -16.280 9.876 1.00 0.00 N ATOM 1508 CZ ARG A 96 12.159 -16.800 10.454 1.00 0.00 C ATOM 1509 NH1 ARG A 96 13.244 -16.056 10.626 1.00 0.00 N ATOM 1510 NH2 ARG A 96 12.141 -18.057 10.875 1.00 0.00 N ATOM 0 H ARG A 96 7.711 -13.092 7.548 1.00 0.00 H new ATOM 0 HA ARG A 96 7.917 -12.401 10.327 1.00 0.00 H new ATOM 0 HB2 ARG A 96 9.913 -12.757 8.065 1.00 0.00 H new ATOM 0 HB3 ARG A 96 10.399 -12.315 9.690 1.00 0.00 H new ATOM 0 HG2 ARG A 96 9.315 -14.404 10.549 1.00 0.00 H new ATOM 0 HG3 ARG A 96 8.923 -14.852 8.900 1.00 0.00 H new ATOM 0 HD2 ARG A 96 11.290 -14.924 8.297 1.00 0.00 H new ATOM 0 HD3 ARG A 96 11.752 -14.298 9.867 1.00 0.00 H new ATOM 0 HE ARG A 96 10.249 -16.865 9.794 1.00 0.00 H new ATOM 0 HH11 ARG A 96 13.251 -15.085 10.315 1.00 0.00 H new ATOM 0 HH12 ARG A 96 14.071 -16.455 11.069 1.00 0.00 H new ATOM 0 HH21 ARG A 96 11.301 -18.623 10.755 1.00 0.00 H new ATOM 0 HH22 ARG A 96 12.967 -18.458 11.319 1.00 0.00 H new ATOM 1524 N LEU A 97 8.033 -10.057 8.137 1.00 0.00 N ATOM 1525 CA LEU A 97 8.153 -8.626 7.925 1.00 0.00 C ATOM 1526 C LEU A 97 6.907 -7.894 8.424 1.00 0.00 C ATOM 1527 O LEU A 97 6.805 -6.672 8.320 1.00 0.00 O ATOM 1528 CB LEU A 97 8.385 -8.344 6.439 1.00 0.00 C ATOM 1529 CG LEU A 97 9.671 -8.945 5.863 1.00 0.00 C ATOM 1530 CD1 LEU A 97 9.771 -8.668 4.369 1.00 0.00 C ATOM 1531 CD2 LEU A 97 10.890 -8.398 6.593 1.00 0.00 C ATOM 0 H LEU A 97 7.601 -10.561 7.363 1.00 0.00 H new ATOM 0 HA LEU A 97 9.006 -8.257 8.495 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.536 -8.729 5.874 1.00 0.00 H new ATOM 0 HB3 LEU A 97 8.406 -7.265 6.288 1.00 0.00 H new ATOM 0 HG LEU A 97 9.640 -10.025 6.008 1.00 0.00 H new ATOM 0 HD11 LEU A 97 10.691 -9.103 3.979 1.00 0.00 H new ATOM 0 HD12 LEU A 97 8.916 -9.111 3.859 1.00 0.00 H new ATOM 0 HD13 LEU A 97 9.778 -7.591 4.198 1.00 0.00 H new ATOM 0 HD21 LEU A 97 11.794 -8.836 6.170 1.00 0.00 H new ATOM 0 HD22 LEU A 97 10.925 -7.314 6.481 1.00 0.00 H new ATOM 0 HD23 LEU A 97 10.825 -8.651 7.651 1.00 0.00 H new ATOM 1543 N ALA A 98 5.965 -8.650 8.972 1.00 0.00 N ATOM 1544 CA ALA A 98 4.762 -8.076 9.546 1.00 0.00 C ATOM 1545 C ALA A 98 5.030 -7.645 10.980 1.00 0.00 C ATOM 1546 O ALA A 98 4.971 -8.455 11.906 1.00 0.00 O ATOM 1547 CB ALA A 98 3.615 -9.070 9.490 1.00 0.00 C ATOM 0 H ALA A 98 6.014 -9.667 9.030 1.00 0.00 H new ATOM 0 HA ALA A 98 4.477 -7.200 8.963 1.00 0.00 H new ATOM 0 HB1 ALA A 98 2.722 -8.620 9.925 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.417 -9.339 8.452 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.881 -9.965 10.052 1.00 0.00 H new ATOM 1553 N PHE A 99 5.355 -6.374 11.150 1.00 0.00 N ATOM 1554 CA PHE A 99 5.742 -5.855 12.456 1.00 0.00 C ATOM 1555 C PHE A 99 4.613 -5.076 13.127 1.00 0.00 C ATOM 1556 O PHE A 99 4.611 -4.916 14.347 1.00 0.00 O ATOM 1557 CB PHE A 99 6.973 -4.949 12.330 1.00 0.00 C ATOM 1558 CG PHE A 99 8.175 -5.629 11.741 1.00 0.00 C ATOM 1559 CD1 PHE A 99 8.786 -6.682 12.404 1.00 0.00 C ATOM 1560 CD2 PHE A 99 8.696 -5.214 10.525 1.00 0.00 C ATOM 1561 CE1 PHE A 99 9.892 -7.308 11.864 1.00 0.00 C ATOM 1562 CE2 PHE A 99 9.803 -5.836 9.981 1.00 0.00 C ATOM 1563 CZ PHE A 99 10.402 -6.884 10.651 1.00 0.00 C ATOM 0 H PHE A 99 5.359 -5.681 10.402 1.00 0.00 H new ATOM 0 HA PHE A 99 5.976 -6.718 13.080 1.00 0.00 H new ATOM 0 HB2 PHE A 99 6.716 -4.089 11.712 1.00 0.00 H new ATOM 0 HB3 PHE A 99 7.232 -4.567 13.317 1.00 0.00 H new ATOM 0 HD1 PHE A 99 8.393 -7.016 13.353 1.00 0.00 H new ATOM 0 HD2 PHE A 99 8.231 -4.395 9.997 1.00 0.00 H new ATOM 0 HE1 PHE A 99 10.358 -8.128 12.389 1.00 0.00 H new ATOM 0 HE2 PHE A 99 10.199 -5.503 9.033 1.00 0.00 H new ATOM 0 HZ PHE A 99 11.268 -7.372 10.228 1.00 0.00 H new ATOM 1573 N ASP A 100 3.658 -4.591 12.342 1.00 0.00 N ATOM 1574 CA ASP A 100 2.614 -3.719 12.875 1.00 0.00 C ATOM 1575 C ASP A 100 1.236 -4.123 12.359 1.00 0.00 C ATOM 1576 O ASP A 100 0.808 -3.679 11.292 1.00 0.00 O ATOM 1577 CB ASP A 100 2.895 -2.255 12.539 1.00 0.00 C ATOM 1578 CG ASP A 100 2.067 -1.307 13.384 1.00 0.00 C ATOM 1579 OD1 ASP A 100 0.863 -1.148 13.104 1.00 0.00 O ATOM 1580 OD2 ASP A 100 2.625 -0.710 14.336 1.00 0.00 O ATOM 0 H ASP A 100 3.583 -4.783 11.343 1.00 0.00 H new ATOM 0 HA ASP A 100 2.619 -3.832 13.959 1.00 0.00 H new ATOM 0 HB2 ASP A 100 3.954 -2.045 12.691 1.00 0.00 H new ATOM 0 HB3 ASP A 100 2.684 -2.079 11.484 1.00 0.00 H new ATOM 1585 N PRO A 101 0.547 -5.015 13.091 1.00 0.00 N ATOM 1586 CA PRO A 101 -0.764 -5.567 12.691 1.00 0.00 C ATOM 1587 C PRO A 101 -1.870 -4.513 12.512 1.00 0.00 C ATOM 1588 O PRO A 101 -2.991 -4.847 12.114 1.00 0.00 O ATOM 1589 CB PRO A 101 -1.125 -6.510 13.847 1.00 0.00 C ATOM 1590 CG PRO A 101 0.164 -6.803 14.529 1.00 0.00 C ATOM 1591 CD PRO A 101 0.992 -5.562 14.385 1.00 0.00 C ATOM 0 HA PRO A 101 -0.692 -6.045 11.714 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -1.834 -6.042 14.530 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -1.592 -7.423 13.479 1.00 0.00 H new ATOM 0 HG2 PRO A 101 0.004 -7.047 15.579 1.00 0.00 H new ATOM 0 HG3 PRO A 101 0.661 -7.660 14.075 1.00 0.00 H new ATOM 0 HD2 PRO A 101 0.815 -4.862 15.201 1.00 0.00 H new ATOM 0 HD3 PRO A 101 2.059 -5.786 14.383 1.00 0.00 H new ATOM 1599 N SER A 102 -1.571 -3.254 12.809 1.00 0.00 N ATOM 1600 CA SER A 102 -2.545 -2.182 12.640 1.00 0.00 C ATOM 1601 C SER A 102 -2.498 -1.647 11.212 1.00 0.00 C ATOM 1602 O SER A 102 -3.432 -0.984 10.743 1.00 0.00 O ATOM 1603 CB SER A 102 -2.273 -1.054 13.636 1.00 0.00 C ATOM 1604 OG SER A 102 -2.311 -1.524 14.976 1.00 0.00 O ATOM 0 H SER A 102 -0.665 -2.951 13.167 1.00 0.00 H new ATOM 0 HA SER A 102 -3.540 -2.583 12.832 1.00 0.00 H new ATOM 0 HB2 SER A 102 -1.297 -0.613 13.431 1.00 0.00 H new ATOM 0 HB3 SER A 102 -3.013 -0.265 13.505 1.00 0.00 H new ATOM 0 HG SER A 102 -2.132 -0.780 15.589 1.00 0.00 H new ATOM 1610 N LEU A 103 -1.409 -1.949 10.524 1.00 0.00 N ATOM 1611 CA LEU A 103 -1.227 -1.518 9.151 1.00 0.00 C ATOM 1612 C LEU A 103 -1.781 -2.554 8.183 1.00 0.00 C ATOM 1613 O LEU A 103 -1.775 -3.753 8.467 1.00 0.00 O ATOM 1614 CB LEU A 103 0.257 -1.286 8.864 1.00 0.00 C ATOM 1615 CG LEU A 103 0.894 -0.118 9.618 1.00 0.00 C ATOM 1616 CD1 LEU A 103 2.377 -0.027 9.298 1.00 0.00 C ATOM 1617 CD2 LEU A 103 0.199 1.189 9.269 1.00 0.00 C ATOM 0 H LEU A 103 -0.633 -2.495 10.899 1.00 0.00 H new ATOM 0 HA LEU A 103 -1.771 -0.584 9.012 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.804 -2.196 9.109 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.381 -1.117 7.794 1.00 0.00 H new ATOM 0 HG LEU A 103 0.777 -0.296 10.687 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.816 0.809 9.842 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.871 -0.952 9.595 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.509 0.128 8.227 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.667 2.007 9.816 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.285 1.372 8.198 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.854 1.125 9.543 1.00 0.00 H new ATOM 1629 N SER A 104 -2.267 -2.087 7.043 1.00 0.00 N ATOM 1630 CA SER A 104 -2.749 -2.976 6.005 1.00 0.00 C ATOM 1631 C SER A 104 -1.606 -3.346 5.062 1.00 0.00 C ATOM 1632 O SER A 104 -0.793 -2.493 4.690 1.00 0.00 O ATOM 1633 CB SER A 104 -3.897 -2.315 5.235 1.00 0.00 C ATOM 1634 OG SER A 104 -3.546 -1.007 4.815 1.00 0.00 O ATOM 0 H SER A 104 -2.337 -1.095 6.816 1.00 0.00 H new ATOM 0 HA SER A 104 -3.127 -3.889 6.464 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.153 -2.922 4.367 1.00 0.00 H new ATOM 0 HB3 SER A 104 -4.784 -2.271 5.866 1.00 0.00 H new ATOM 0 HG SER A 104 -3.743 -0.369 5.532 1.00 0.00 H new ATOM 1640 N TYR A 105 -1.525 -4.618 4.704 1.00 0.00 N ATOM 1641 CA TYR A 105 -0.482 -5.090 3.809 1.00 0.00 C ATOM 1642 C TYR A 105 -1.079 -5.452 2.453 1.00 0.00 C ATOM 1643 O TYR A 105 -1.599 -6.552 2.270 1.00 0.00 O ATOM 1644 CB TYR A 105 0.234 -6.313 4.399 1.00 0.00 C ATOM 1645 CG TYR A 105 0.858 -6.088 5.760 1.00 0.00 C ATOM 1646 CD1 TYR A 105 0.109 -6.224 6.920 1.00 0.00 C ATOM 1647 CD2 TYR A 105 2.202 -5.758 5.882 1.00 0.00 C ATOM 1648 CE1 TYR A 105 0.678 -6.034 8.163 1.00 0.00 C ATOM 1649 CE2 TYR A 105 2.780 -5.571 7.121 1.00 0.00 C ATOM 1650 CZ TYR A 105 2.015 -5.708 8.258 1.00 0.00 C ATOM 1651 OH TYR A 105 2.587 -5.522 9.498 1.00 0.00 O ATOM 0 H TYR A 105 -2.170 -5.342 5.020 1.00 0.00 H new ATOM 0 HA TYR A 105 0.245 -4.288 3.683 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -0.480 -7.133 4.473 1.00 0.00 H new ATOM 0 HB3 TYR A 105 1.013 -6.630 3.706 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -0.937 -6.483 6.849 1.00 0.00 H new ATOM 0 HD2 TYR A 105 2.804 -5.646 4.993 1.00 0.00 H new ATOM 0 HE1 TYR A 105 0.080 -6.140 9.056 1.00 0.00 H new ATOM 0 HE2 TYR A 105 3.827 -5.318 7.199 1.00 0.00 H new ATOM 0 HH TYR A 105 2.091 -4.832 9.987 1.00 0.00 H new ATOM 1661 N LEU A 106 -1.042 -4.515 1.515 1.00 0.00 N ATOM 1662 CA LEU A 106 -1.523 -4.778 0.166 1.00 0.00 C ATOM 1663 C LEU A 106 -0.438 -5.477 -0.635 1.00 0.00 C ATOM 1664 O LEU A 106 0.720 -5.077 -0.597 1.00 0.00 O ATOM 1665 CB LEU A 106 -1.953 -3.484 -0.540 1.00 0.00 C ATOM 1666 CG LEU A 106 -3.275 -2.872 -0.062 1.00 0.00 C ATOM 1667 CD1 LEU A 106 -3.146 -2.300 1.343 1.00 0.00 C ATOM 1668 CD2 LEU A 106 -3.742 -1.795 -1.032 1.00 0.00 C ATOM 0 H LEU A 106 -0.686 -3.571 1.662 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.399 -5.423 0.236 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -1.164 -2.743 -0.412 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.032 -3.684 -1.609 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.020 -3.667 -0.032 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -4.101 -1.874 1.651 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.862 -3.094 2.034 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.382 -1.522 1.351 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.682 -1.370 -0.679 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.989 -1.009 -1.094 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.890 -2.234 -2.019 1.00 0.00 H new ATOM 1680 N ILE A 107 -0.805 -6.530 -1.341 1.00 0.00 N ATOM 1681 CA ILE A 107 0.166 -7.312 -2.091 1.00 0.00 C ATOM 1682 C ILE A 107 -0.165 -7.306 -3.578 1.00 0.00 C ATOM 1683 O ILE A 107 -1.298 -7.581 -3.977 1.00 0.00 O ATOM 1684 CB ILE A 107 0.246 -8.765 -1.576 1.00 0.00 C ATOM 1685 CG1 ILE A 107 0.618 -8.780 -0.088 1.00 0.00 C ATOM 1686 CG2 ILE A 107 1.259 -9.566 -2.386 1.00 0.00 C ATOM 1687 CD1 ILE A 107 0.717 -10.168 0.508 1.00 0.00 C ATOM 0 H ILE A 107 -1.766 -6.865 -1.412 1.00 0.00 H new ATOM 0 HA ILE A 107 1.139 -6.845 -1.943 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.733 -9.230 -1.696 1.00 0.00 H new ATOM 0 HG12 ILE A 107 1.573 -8.271 0.042 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -0.126 -8.209 0.468 1.00 0.00 H new ATOM 0 HG21 ILE A 107 1.301 -10.587 -2.008 1.00 0.00 H new ATOM 0 HG22 ILE A 107 0.959 -9.579 -3.434 1.00 0.00 H new ATOM 0 HG23 ILE A 107 2.243 -9.105 -2.296 1.00 0.00 H new ATOM 0 HD11 ILE A 107 0.984 -10.093 1.562 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -0.243 -10.675 0.412 1.00 0.00 H new ATOM 0 HD13 ILE A 107 1.482 -10.737 -0.020 1.00 0.00 H new ATOM 1699 N ILE A 108 0.828 -6.972 -4.386 1.00 0.00 N ATOM 1700 CA ILE A 108 0.668 -6.939 -5.829 1.00 0.00 C ATOM 1701 C ILE A 108 1.416 -8.102 -6.476 1.00 0.00 C ATOM 1702 O ILE A 108 2.604 -8.311 -6.219 1.00 0.00 O ATOM 1703 CB ILE A 108 1.180 -5.607 -6.420 1.00 0.00 C ATOM 1704 CG1 ILE A 108 0.434 -4.425 -5.792 1.00 0.00 C ATOM 1705 CG2 ILE A 108 1.017 -5.595 -7.935 1.00 0.00 C ATOM 1706 CD1 ILE A 108 0.923 -3.070 -6.264 1.00 0.00 C ATOM 0 H ILE A 108 1.761 -6.718 -4.062 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.397 -7.028 -6.043 1.00 0.00 H new ATOM 0 HB ILE A 108 2.241 -5.512 -6.189 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -0.628 -4.516 -6.019 1.00 0.00 H new ATOM 0 HG13 ILE A 108 0.534 -4.479 -4.708 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.383 -4.649 -8.333 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.588 -6.416 -8.369 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.037 -5.712 -8.189 1.00 0.00 H new ATOM 0 HD11 ILE A 108 0.347 -2.285 -5.775 1.00 0.00 H new ATOM 0 HD12 ILE A 108 1.978 -2.956 -6.013 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.797 -2.994 -7.344 1.00 0.00 H new ATOM 1718 N SER A 109 0.711 -8.864 -7.302 1.00 0.00 N ATOM 1719 CA SER A 109 1.303 -10.003 -7.986 1.00 0.00 C ATOM 1720 C SER A 109 1.428 -9.732 -9.483 1.00 0.00 C ATOM 1721 O SER A 109 0.435 -9.432 -10.154 1.00 0.00 O ATOM 1722 CB SER A 109 0.453 -11.254 -7.753 1.00 0.00 C ATOM 1723 OG SER A 109 1.015 -12.389 -8.391 1.00 0.00 O ATOM 0 H SER A 109 -0.275 -8.712 -7.514 1.00 0.00 H new ATOM 0 HA SER A 109 2.301 -10.165 -7.580 1.00 0.00 H new ATOM 0 HB2 SER A 109 0.366 -11.442 -6.683 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.556 -11.085 -8.130 1.00 0.00 H new ATOM 0 HG SER A 109 1.828 -12.662 -7.916 1.00 0.00 H new ATOM 1729 N LEU A 110 2.646 -9.838 -9.997 1.00 0.00 N ATOM 1730 CA LEU A 110 2.893 -9.671 -11.422 1.00 0.00 C ATOM 1731 C LEU A 110 3.064 -11.029 -12.097 1.00 0.00 C ATOM 1732 O LEU A 110 3.567 -11.119 -13.217 1.00 0.00 O ATOM 1733 CB LEU A 110 4.141 -8.809 -11.667 1.00 0.00 C ATOM 1734 CG LEU A 110 4.005 -7.313 -11.339 1.00 0.00 C ATOM 1735 CD1 LEU A 110 2.729 -6.739 -11.942 1.00 0.00 C ATOM 1736 CD2 LEU A 110 4.053 -7.071 -9.835 1.00 0.00 C ATOM 0 H LEU A 110 3.480 -10.040 -9.446 1.00 0.00 H new ATOM 0 HA LEU A 110 2.030 -9.164 -11.853 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.961 -9.217 -11.076 1.00 0.00 H new ATOM 0 HB3 LEU A 110 4.425 -8.906 -12.715 1.00 0.00 H new ATOM 0 HG LEU A 110 4.854 -6.795 -11.786 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.655 -5.680 -11.696 1.00 0.00 H new ATOM 0 HD12 LEU A 110 2.752 -6.860 -13.025 1.00 0.00 H new ATOM 0 HD13 LEU A 110 1.866 -7.267 -11.537 1.00 0.00 H new ATOM 0 HD21 LEU A 110 3.954 -6.004 -9.635 1.00 0.00 H new ATOM 0 HD22 LEU A 110 3.235 -7.608 -9.354 1.00 0.00 H new ATOM 0 HD23 LEU A 110 5.004 -7.428 -9.439 1.00 0.00 H new ATOM 1748 N ALA A 111 2.616 -12.082 -11.413 1.00 0.00 N ATOM 1749 CA ALA A 111 2.742 -13.451 -11.918 1.00 0.00 C ATOM 1750 C ALA A 111 1.874 -13.666 -13.158 1.00 0.00 C ATOM 1751 O ALA A 111 2.124 -14.570 -13.960 1.00 0.00 O ATOM 1752 CB ALA A 111 2.373 -14.454 -10.832 1.00 0.00 C ATOM 0 H ALA A 111 2.160 -12.013 -10.503 1.00 0.00 H new ATOM 0 HA ALA A 111 3.782 -13.609 -12.204 1.00 0.00 H new ATOM 0 HB1 ALA A 111 2.472 -15.467 -11.223 1.00 0.00 H new ATOM 0 HB2 ALA A 111 3.039 -14.328 -9.979 1.00 0.00 H new ATOM 0 HB3 ALA A 111 1.343 -14.286 -10.516 1.00 0.00 H new ATOM 1758 N GLU A 112 0.855 -12.833 -13.306 1.00 0.00 N ATOM 1759 CA GLU A 112 -0.033 -12.881 -14.460 1.00 0.00 C ATOM 1760 C GLU A 112 -0.079 -11.507 -15.122 1.00 0.00 C ATOM 1761 O GLU A 112 -0.894 -10.665 -14.757 1.00 0.00 O ATOM 1762 CB GLU A 112 -1.437 -13.339 -14.051 1.00 0.00 C ATOM 1763 CG GLU A 112 -2.406 -13.466 -15.220 1.00 0.00 C ATOM 1764 CD GLU A 112 -1.871 -14.348 -16.330 1.00 0.00 C ATOM 1765 OE1 GLU A 112 -1.748 -15.575 -16.117 1.00 0.00 O ATOM 1766 OE2 GLU A 112 -1.571 -13.822 -17.421 1.00 0.00 O ATOM 0 H GLU A 112 0.620 -12.105 -12.631 1.00 0.00 H new ATOM 0 HA GLU A 112 0.353 -13.607 -15.176 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -1.362 -14.302 -13.546 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -1.844 -12.631 -13.329 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -3.351 -13.874 -14.861 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -2.618 -12.474 -15.620 1.00 0.00 H new ATOM 1773 N PRO A 113 0.843 -11.247 -16.061 1.00 0.00 N ATOM 1774 CA PRO A 113 1.020 -9.918 -16.669 1.00 0.00 C ATOM 1775 C PRO A 113 -0.218 -9.399 -17.388 1.00 0.00 C ATOM 1776 O PRO A 113 -0.352 -8.197 -17.616 1.00 0.00 O ATOM 1777 CB PRO A 113 2.169 -10.122 -17.665 1.00 0.00 C ATOM 1778 CG PRO A 113 2.863 -11.359 -17.207 1.00 0.00 C ATOM 1779 CD PRO A 113 1.798 -12.227 -16.605 1.00 0.00 C ATOM 0 HA PRO A 113 1.219 -9.167 -15.904 1.00 0.00 H new ATOM 0 HB2 PRO A 113 1.794 -10.234 -18.682 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.846 -9.268 -17.667 1.00 0.00 H new ATOM 0 HG2 PRO A 113 3.354 -11.863 -18.040 1.00 0.00 H new ATOM 0 HG3 PRO A 113 3.637 -11.125 -16.475 1.00 0.00 H new ATOM 0 HD2 PRO A 113 1.334 -12.872 -17.351 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.198 -12.876 -15.826 1.00 0.00 H new ATOM 1787 N GLN A 114 -1.119 -10.299 -17.738 1.00 0.00 N ATOM 1788 CA GLN A 114 -2.352 -9.911 -18.407 1.00 0.00 C ATOM 1789 C GLN A 114 -3.409 -9.496 -17.395 1.00 0.00 C ATOM 1790 O GLN A 114 -4.329 -8.744 -17.716 1.00 0.00 O ATOM 1791 CB GLN A 114 -2.885 -11.049 -19.280 1.00 0.00 C ATOM 1792 CG GLN A 114 -2.065 -11.290 -20.536 1.00 0.00 C ATOM 1793 CD GLN A 114 -1.895 -10.032 -21.365 1.00 0.00 C ATOM 1794 OE1 GLN A 114 -0.918 -9.300 -21.214 1.00 0.00 O ATOM 1795 NE2 GLN A 114 -2.855 -9.763 -22.235 1.00 0.00 N ATOM 0 H GLN A 114 -1.023 -11.301 -17.572 1.00 0.00 H new ATOM 0 HA GLN A 114 -2.125 -9.059 -19.048 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -2.910 -11.966 -18.691 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -3.913 -10.826 -19.565 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -1.084 -11.674 -20.258 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -2.548 -12.058 -21.140 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -3.649 -10.396 -22.330 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -2.801 -8.923 -22.811 1.00 0.00 H new ATOM 1804 N LYS A 115 -3.259 -9.969 -16.169 1.00 0.00 N ATOM 1805 CA LYS A 115 -4.229 -9.706 -15.118 1.00 0.00 C ATOM 1806 C LYS A 115 -3.536 -9.555 -13.767 1.00 0.00 C ATOM 1807 O LYS A 115 -3.543 -10.482 -12.954 1.00 0.00 O ATOM 1808 CB LYS A 115 -5.269 -10.828 -15.050 1.00 0.00 C ATOM 1809 CG LYS A 115 -6.346 -10.741 -16.120 1.00 0.00 C ATOM 1810 CD LYS A 115 -7.191 -9.490 -15.948 1.00 0.00 C ATOM 1811 CE LYS A 115 -8.257 -9.382 -17.022 1.00 0.00 C ATOM 1812 NZ LYS A 115 -9.117 -8.187 -16.824 1.00 0.00 N ATOM 0 H LYS A 115 -2.468 -10.542 -15.875 1.00 0.00 H new ATOM 0 HA LYS A 115 -4.736 -8.771 -15.356 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -4.759 -11.787 -15.140 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -5.744 -10.810 -14.069 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -5.883 -10.737 -17.107 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.984 -11.624 -16.071 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -7.664 -9.502 -14.966 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -6.549 -8.610 -15.982 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -7.782 -9.331 -18.002 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -8.874 -10.280 -17.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -9.834 -8.146 -17.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -9.589 -8.248 -15.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -8.531 -7.328 -16.857 1.00 0.00 H new ATOM 1826 N PRO A 116 -2.915 -8.391 -13.518 1.00 0.00 N ATOM 1827 CA PRO A 116 -2.203 -8.127 -12.265 1.00 0.00 C ATOM 1828 C PRO A 116 -3.137 -8.191 -11.064 1.00 0.00 C ATOM 1829 O PRO A 116 -4.145 -7.481 -11.008 1.00 0.00 O ATOM 1830 CB PRO A 116 -1.657 -6.706 -12.443 1.00 0.00 C ATOM 1831 CG PRO A 116 -1.680 -6.465 -13.912 1.00 0.00 C ATOM 1832 CD PRO A 116 -2.853 -7.242 -14.433 1.00 0.00 C ATOM 0 HA PRO A 116 -1.425 -8.866 -12.074 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -2.272 -5.978 -11.914 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -0.646 -6.619 -12.045 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -1.785 -5.403 -14.133 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -0.752 -6.797 -14.378 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -3.771 -6.655 -14.407 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -2.704 -7.555 -15.466 1.00 0.00 H new ATOM 1840 N VAL A 117 -2.811 -9.048 -10.107 1.00 0.00 N ATOM 1841 CA VAL A 117 -3.659 -9.230 -8.943 1.00 0.00 C ATOM 1842 C VAL A 117 -3.190 -8.351 -7.794 1.00 0.00 C ATOM 1843 O VAL A 117 -2.041 -8.440 -7.365 1.00 0.00 O ATOM 1844 CB VAL A 117 -3.662 -10.700 -8.472 1.00 0.00 C ATOM 1845 CG1 VAL A 117 -4.647 -10.905 -7.331 1.00 0.00 C ATOM 1846 CG2 VAL A 117 -3.974 -11.638 -9.624 1.00 0.00 C ATOM 0 H VAL A 117 -1.970 -9.624 -10.115 1.00 0.00 H new ATOM 0 HA VAL A 117 -4.670 -8.947 -9.237 1.00 0.00 H new ATOM 0 HB VAL A 117 -2.663 -10.934 -8.104 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -4.629 -11.949 -7.018 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -4.368 -10.270 -6.491 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.651 -10.643 -7.666 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -3.970 -12.668 -9.266 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -4.956 -11.399 -10.032 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -3.220 -11.522 -10.402 1.00 0.00 H new ATOM 1856 N CYS A 118 -4.077 -7.496 -7.314 1.00 0.00 N ATOM 1857 CA CYS A 118 -3.804 -6.696 -6.136 1.00 0.00 C ATOM 1858 C CYS A 118 -4.771 -7.079 -5.024 1.00 0.00 C ATOM 1859 O CYS A 118 -5.985 -6.945 -5.179 1.00 0.00 O ATOM 1860 CB CYS A 118 -3.923 -5.205 -6.462 1.00 0.00 C ATOM 1861 SG CYS A 118 -3.453 -4.104 -5.106 1.00 0.00 S ATOM 0 H CYS A 118 -4.997 -7.339 -7.726 1.00 0.00 H new ATOM 0 HA CYS A 118 -2.785 -6.889 -5.802 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -3.298 -4.984 -7.327 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -4.952 -4.989 -6.749 1.00 0.00 H new ATOM 0 HG CYS A 118 -3.587 -2.868 -5.485 1.00 0.00 H new ATOM 1867 N LYS A 119 -4.239 -7.573 -3.919 1.00 0.00 N ATOM 1868 CA LYS A 119 -5.059 -7.934 -2.774 1.00 0.00 C ATOM 1869 C LYS A 119 -4.597 -7.184 -1.540 1.00 0.00 C ATOM 1870 O LYS A 119 -3.527 -6.579 -1.531 1.00 0.00 O ATOM 1871 CB LYS A 119 -5.015 -9.439 -2.495 1.00 0.00 C ATOM 1872 CG LYS A 119 -5.765 -10.295 -3.509 1.00 0.00 C ATOM 1873 CD LYS A 119 -5.720 -11.766 -3.115 1.00 0.00 C ATOM 1874 CE LYS A 119 -6.661 -12.619 -3.954 1.00 0.00 C ATOM 1875 NZ LYS A 119 -8.091 -12.301 -3.690 1.00 0.00 N ATOM 0 H LYS A 119 -3.240 -7.734 -3.790 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.086 -7.659 -3.013 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -3.974 -9.760 -2.468 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.431 -9.624 -1.505 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -6.801 -9.963 -3.576 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -5.325 -10.165 -4.498 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -4.701 -12.138 -3.225 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -5.984 -11.866 -2.062 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -6.445 -12.464 -5.011 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -6.480 -13.673 -3.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -8.692 -13.057 -4.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -8.246 -12.225 -2.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -8.335 -11.398 -4.145 1.00 0.00 H new ATOM 1889 N SER A 120 -5.415 -7.217 -0.510 1.00 0.00 N ATOM 1890 CA SER A 120 -5.094 -6.568 0.746 1.00 0.00 C ATOM 1891 C SER A 120 -5.169 -7.579 1.879 1.00 0.00 C ATOM 1892 O SER A 120 -6.210 -8.192 2.106 1.00 0.00 O ATOM 1893 CB SER A 120 -6.058 -5.410 1.001 1.00 0.00 C ATOM 1894 OG SER A 120 -6.037 -4.487 -0.075 1.00 0.00 O ATOM 0 H SER A 120 -6.318 -7.692 -0.518 1.00 0.00 H new ATOM 0 HA SER A 120 -4.081 -6.169 0.695 1.00 0.00 H new ATOM 0 HB2 SER A 120 -7.069 -5.796 1.135 1.00 0.00 H new ATOM 0 HB3 SER A 120 -5.786 -4.902 1.926 1.00 0.00 H new ATOM 0 HG SER A 120 -5.463 -4.832 -0.791 1.00 0.00 H new ATOM 1900 N PHE A 121 -4.065 -7.777 2.573 1.00 0.00 N ATOM 1901 CA PHE A 121 -4.027 -8.730 3.666 1.00 0.00 C ATOM 1902 C PHE A 121 -3.764 -8.030 4.985 1.00 0.00 C ATOM 1903 O PHE A 121 -2.891 -7.167 5.089 1.00 0.00 O ATOM 1904 CB PHE A 121 -2.966 -9.802 3.416 1.00 0.00 C ATOM 1905 CG PHE A 121 -3.293 -10.711 2.267 1.00 0.00 C ATOM 1906 CD1 PHE A 121 -4.050 -11.854 2.470 1.00 0.00 C ATOM 1907 CD2 PHE A 121 -2.847 -10.425 0.987 1.00 0.00 C ATOM 1908 CE1 PHE A 121 -4.355 -12.695 1.418 1.00 0.00 C ATOM 1909 CE2 PHE A 121 -3.148 -11.261 -0.068 1.00 0.00 C ATOM 1910 CZ PHE A 121 -3.904 -12.398 0.148 1.00 0.00 C ATOM 0 H PHE A 121 -3.184 -7.292 2.400 1.00 0.00 H new ATOM 0 HA PHE A 121 -5.002 -9.214 3.721 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -2.009 -9.317 3.224 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -2.845 -10.400 4.319 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -4.405 -12.090 3.462 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -2.257 -9.537 0.813 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -4.945 -13.583 1.589 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -2.794 -11.028 -1.061 1.00 0.00 H new ATOM 0 HZ PHE A 121 -4.142 -13.054 -0.677 1.00 0.00 H new ATOM 1920 N LEU A 122 -4.544 -8.392 5.984 1.00 0.00 N ATOM 1921 CA LEU A 122 -4.353 -7.877 7.322 1.00 0.00 C ATOM 1922 C LEU A 122 -3.666 -8.934 8.168 1.00 0.00 C ATOM 1923 O LEU A 122 -4.278 -9.934 8.543 1.00 0.00 O ATOM 1924 CB LEU A 122 -5.704 -7.507 7.936 1.00 0.00 C ATOM 1925 CG LEU A 122 -6.522 -6.493 7.135 1.00 0.00 C ATOM 1926 CD1 LEU A 122 -7.924 -6.362 7.708 1.00 0.00 C ATOM 1927 CD2 LEU A 122 -5.826 -5.140 7.121 1.00 0.00 C ATOM 0 H LEU A 122 -5.321 -9.046 5.891 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.732 -6.982 7.285 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -6.294 -8.416 8.053 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -5.534 -7.106 8.935 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.603 -6.852 6.109 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -8.489 -5.636 7.124 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -8.425 -7.329 7.668 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -7.864 -6.027 8.743 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.422 -4.430 6.547 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.715 -4.777 8.143 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.842 -5.242 6.663 1.00 0.00 H new ATOM 1939 N ILE A 123 -2.395 -8.728 8.460 1.00 0.00 N ATOM 1940 CA ILE A 123 -1.644 -9.689 9.244 1.00 0.00 C ATOM 1941 C ILE A 123 -1.726 -9.328 10.716 1.00 0.00 C ATOM 1942 O ILE A 123 -1.158 -8.329 11.154 1.00 0.00 O ATOM 1943 CB ILE A 123 -0.169 -9.772 8.798 1.00 0.00 C ATOM 1944 CG1 ILE A 123 -0.087 -10.034 7.290 1.00 0.00 C ATOM 1945 CG2 ILE A 123 0.553 -10.870 9.571 1.00 0.00 C ATOM 1946 CD1 ILE A 123 1.329 -10.068 6.752 1.00 0.00 C ATOM 0 H ILE A 123 -1.864 -7.908 8.167 1.00 0.00 H new ATOM 0 HA ILE A 123 -2.089 -10.671 9.082 1.00 0.00 H new ATOM 0 HB ILE A 123 0.318 -8.821 9.011 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -0.573 -10.984 7.069 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.647 -9.260 6.765 1.00 0.00 H new ATOM 0 HG21 ILE A 123 1.593 -10.919 9.248 1.00 0.00 H new ATOM 0 HG22 ILE A 123 0.515 -10.649 10.638 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.068 -11.828 9.381 1.00 0.00 H new ATOM 0 HD11 ILE A 123 1.306 -10.258 5.679 1.00 0.00 H new ATOM 0 HD12 ILE A 123 1.813 -9.110 6.941 1.00 0.00 H new ATOM 0 HD13 ILE A 123 1.888 -10.861 7.249 1.00 0.00 H new ATOM 1958 N LYS A 124 -2.463 -10.131 11.463 1.00 0.00 N ATOM 1959 CA LYS A 124 -2.675 -9.879 12.874 1.00 0.00 C ATOM 1960 C LYS A 124 -1.772 -10.777 13.709 1.00 0.00 C ATOM 1961 O LYS A 124 -0.894 -11.457 13.173 1.00 0.00 O ATOM 1962 CB LYS A 124 -4.147 -10.118 13.228 1.00 0.00 C ATOM 1963 CG LYS A 124 -5.114 -9.265 12.417 1.00 0.00 C ATOM 1964 CD LYS A 124 -4.918 -7.777 12.680 1.00 0.00 C ATOM 1965 CE LYS A 124 -5.823 -6.934 11.793 1.00 0.00 C ATOM 1966 NZ LYS A 124 -5.714 -5.479 12.095 1.00 0.00 N ATOM 0 H LYS A 124 -2.927 -10.968 11.111 1.00 0.00 H new ATOM 0 HA LYS A 124 -2.425 -8.841 13.094 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -4.384 -11.170 13.071 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -4.295 -9.913 14.288 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -4.974 -9.467 11.355 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -6.138 -9.545 12.662 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -5.128 -7.560 13.727 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -3.877 -7.508 12.501 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -5.566 -7.106 10.748 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -6.857 -7.254 11.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -6.198 -4.933 11.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -6.156 -5.281 13.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -4.711 -5.205 12.127 1.00 0.00 H new ATOM 1980 N LYS A 125 -1.986 -10.771 15.015 1.00 0.00 N ATOM 1981 CA LYS A 125 -1.203 -11.594 15.924 1.00 0.00 C ATOM 1982 C LYS A 125 -1.419 -13.072 15.628 1.00 0.00 C ATOM 1983 O LYS A 125 -0.468 -13.816 15.391 1.00 0.00 O ATOM 1984 CB LYS A 125 -1.594 -11.298 17.372 1.00 0.00 C ATOM 1985 CG LYS A 125 -0.642 -11.893 18.399 1.00 0.00 C ATOM 1986 CD LYS A 125 0.767 -11.338 18.242 1.00 0.00 C ATOM 1987 CE LYS A 125 1.723 -11.943 19.257 1.00 0.00 C ATOM 1988 NZ LYS A 125 3.105 -11.418 19.099 1.00 0.00 N ATOM 0 H LYS A 125 -2.699 -10.202 15.472 1.00 0.00 H new ATOM 0 HA LYS A 125 -0.149 -11.356 15.780 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -1.637 -10.218 17.513 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -2.597 -11.684 17.554 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -1.008 -11.679 19.403 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -0.621 -12.977 18.292 1.00 0.00 H new ATOM 0 HD2 LYS A 125 1.129 -11.542 17.234 1.00 0.00 H new ATOM 0 HD3 LYS A 125 0.747 -10.255 18.361 1.00 0.00 H new ATOM 0 HE2 LYS A 125 1.366 -11.729 20.264 1.00 0.00 H new ATOM 0 HE3 LYS A 125 1.732 -13.027 19.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 3.726 -11.855 19.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 3.456 -11.645 18.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 3.102 -10.386 19.230 1.00 0.00 H new ATOM 2002 N ASP A 126 -2.677 -13.478 15.643 1.00 0.00 N ATOM 2003 CA ASP A 126 -3.044 -14.874 15.424 1.00 0.00 C ATOM 2004 C ASP A 126 -2.730 -15.317 13.997 1.00 0.00 C ATOM 2005 O ASP A 126 -1.917 -16.217 13.781 1.00 0.00 O ATOM 2006 CB ASP A 126 -4.534 -15.097 15.715 1.00 0.00 C ATOM 2007 CG ASP A 126 -4.889 -14.895 17.177 1.00 0.00 C ATOM 2008 OD1 ASP A 126 -4.732 -15.845 17.971 1.00 0.00 O ATOM 2009 OD2 ASP A 126 -5.332 -13.785 17.536 1.00 0.00 O ATOM 0 H ASP A 126 -3.470 -12.858 15.806 1.00 0.00 H new ATOM 0 HA ASP A 126 -2.450 -15.476 16.112 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -5.124 -14.413 15.106 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -4.810 -16.108 15.416 1.00 0.00 H new ATOM 2014 N GLY A 127 -3.363 -14.675 13.023 1.00 0.00 N ATOM 2015 CA GLY A 127 -3.183 -15.070 11.640 1.00 0.00 C ATOM 2016 C GLY A 127 -3.434 -13.933 10.675 1.00 0.00 C ATOM 2017 O GLY A 127 -3.621 -12.786 11.090 1.00 0.00 O ATOM 0 H GLY A 127 -3.997 -13.889 13.166 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -2.168 -15.443 11.501 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -3.859 -15.893 11.410 1.00 0.00 H new ATOM 2021 N VAL A 128 -3.452 -14.248 9.389 1.00 0.00 N ATOM 2022 CA VAL A 128 -3.667 -13.240 8.366 1.00 0.00 C ATOM 2023 C VAL A 128 -5.109 -13.283 7.858 1.00 0.00 C ATOM 2024 O VAL A 128 -5.649 -14.351 7.557 1.00 0.00 O ATOM 2025 CB VAL A 128 -2.675 -13.400 7.185 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -2.802 -14.771 6.537 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -2.877 -12.300 6.153 1.00 0.00 C ATOM 0 H VAL A 128 -3.320 -15.194 9.030 1.00 0.00 H new ATOM 0 HA VAL A 128 -3.484 -12.268 8.824 1.00 0.00 H new ATOM 0 HB VAL A 128 -1.666 -13.312 7.588 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -2.093 -14.851 5.713 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -2.588 -15.544 7.276 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -3.816 -14.902 6.158 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -2.169 -12.434 5.335 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -3.894 -12.348 5.765 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -2.712 -11.329 6.619 1.00 0.00 H new ATOM 2037 N ASP A 129 -5.736 -12.121 7.798 1.00 0.00 N ATOM 2038 CA ASP A 129 -7.101 -12.012 7.310 1.00 0.00 C ATOM 2039 C ASP A 129 -7.115 -11.298 5.970 1.00 0.00 C ATOM 2040 O ASP A 129 -6.560 -10.207 5.835 1.00 0.00 O ATOM 2041 CB ASP A 129 -7.969 -11.260 8.319 1.00 0.00 C ATOM 2042 CG ASP A 129 -9.439 -11.275 7.949 1.00 0.00 C ATOM 2043 OD1 ASP A 129 -9.982 -12.380 7.728 1.00 0.00 O ATOM 2044 OD2 ASP A 129 -10.060 -10.193 7.895 1.00 0.00 O ATOM 0 H ASP A 129 -5.319 -11.235 8.083 1.00 0.00 H new ATOM 0 HA ASP A 129 -7.510 -13.014 7.182 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -7.842 -11.706 9.305 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.626 -10.228 8.389 1.00 0.00 H new ATOM 2049 N GLU A 130 -7.723 -11.923 4.978 1.00 0.00 N ATOM 2050 CA GLU A 130 -7.783 -11.349 3.650 1.00 0.00 C ATOM 2051 C GLU A 130 -8.902 -10.315 3.563 1.00 0.00 C ATOM 2052 O GLU A 130 -10.020 -10.548 4.025 1.00 0.00 O ATOM 2053 CB GLU A 130 -7.974 -12.449 2.608 1.00 0.00 C ATOM 2054 CG GLU A 130 -9.138 -13.382 2.888 1.00 0.00 C ATOM 2055 CD GLU A 130 -9.298 -14.429 1.809 1.00 0.00 C ATOM 2056 OE1 GLU A 130 -9.784 -14.087 0.711 1.00 0.00 O ATOM 2057 OE2 GLU A 130 -8.920 -15.594 2.047 1.00 0.00 O ATOM 0 H GLU A 130 -8.182 -12.829 5.069 1.00 0.00 H new ATOM 0 HA GLU A 130 -6.840 -10.842 3.445 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.121 -11.987 1.632 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.059 -13.038 2.547 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -8.986 -13.873 3.849 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -10.057 -12.801 2.968 1.00 0.00 H new ATOM 2064 N GLU A 131 -8.579 -9.170 2.988 1.00 0.00 N ATOM 2065 CA GLU A 131 -9.528 -8.078 2.859 1.00 0.00 C ATOM 2066 C GLU A 131 -9.781 -7.777 1.381 1.00 0.00 C ATOM 2067 O GLU A 131 -8.905 -7.979 0.538 1.00 0.00 O ATOM 2068 CB GLU A 131 -8.988 -6.841 3.586 1.00 0.00 C ATOM 2069 CG GLU A 131 -9.939 -5.657 3.584 1.00 0.00 C ATOM 2070 CD GLU A 131 -11.302 -6.010 4.142 1.00 0.00 C ATOM 2071 OE1 GLU A 131 -11.483 -5.938 5.371 1.00 0.00 O ATOM 2072 OE2 GLU A 131 -12.206 -6.348 3.346 1.00 0.00 O ATOM 0 H GLU A 131 -7.657 -8.971 2.599 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.477 -8.362 3.314 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -8.761 -7.109 4.618 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -8.049 -6.540 3.121 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -9.507 -4.847 4.172 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -10.051 -5.287 2.565 1.00 0.00 H new ATOM 2079 N GLU A 132 -10.977 -7.304 1.071 1.00 0.00 N ATOM 2080 CA GLU A 132 -11.353 -7.038 -0.305 1.00 0.00 C ATOM 2081 C GLU A 132 -11.266 -5.542 -0.596 1.00 0.00 C ATOM 2082 O GLU A 132 -11.514 -4.709 0.283 1.00 0.00 O ATOM 2083 CB GLU A 132 -12.765 -7.567 -0.574 1.00 0.00 C ATOM 2084 CG GLU A 132 -13.216 -7.415 -2.019 1.00 0.00 C ATOM 2085 CD GLU A 132 -14.488 -8.182 -2.320 1.00 0.00 C ATOM 2086 OE1 GLU A 132 -15.537 -7.868 -1.720 1.00 0.00 O ATOM 2087 OE2 GLU A 132 -14.445 -9.097 -3.172 1.00 0.00 O ATOM 0 H GLU A 132 -11.704 -7.097 1.756 1.00 0.00 H new ATOM 0 HA GLU A 132 -10.661 -7.554 -0.970 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.806 -8.621 -0.300 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.468 -7.042 0.073 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.374 -6.359 -2.237 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -12.423 -7.762 -2.681 1.00 0.00 H new ATOM 2094 N ILE A 133 -10.899 -5.211 -1.823 1.00 0.00 N ATOM 2095 CA ILE A 133 -10.732 -3.823 -2.222 1.00 0.00 C ATOM 2096 C ILE A 133 -11.968 -3.327 -2.960 1.00 0.00 C ATOM 2097 O ILE A 133 -12.518 -4.021 -3.817 1.00 0.00 O ATOM 2098 CB ILE A 133 -9.492 -3.640 -3.130 1.00 0.00 C ATOM 2099 CG1 ILE A 133 -8.254 -4.247 -2.466 1.00 0.00 C ATOM 2100 CG2 ILE A 133 -9.265 -2.165 -3.430 1.00 0.00 C ATOM 2101 CD1 ILE A 133 -7.001 -4.146 -3.307 1.00 0.00 C ATOM 0 H ILE A 133 -10.710 -5.887 -2.563 1.00 0.00 H new ATOM 0 HA ILE A 133 -10.589 -3.240 -1.312 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.671 -4.159 -4.071 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -8.082 -3.747 -1.513 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -8.449 -5.296 -2.245 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -8.389 -2.054 -4.069 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -10.139 -1.758 -3.938 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -9.104 -1.625 -2.497 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -6.166 -4.597 -2.771 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -7.153 -4.671 -4.250 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -6.780 -3.097 -3.506 1.00 0.00 H new ATOM 2113 N ILE A 134 -12.410 -2.131 -2.613 1.00 0.00 N ATOM 2114 CA ILE A 134 -13.510 -1.498 -3.314 1.00 0.00 C ATOM 2115 C ILE A 134 -12.957 -0.489 -4.308 1.00 0.00 C ATOM 2116 O ILE A 134 -12.387 0.532 -3.919 1.00 0.00 O ATOM 2117 CB ILE A 134 -14.480 -0.791 -2.337 1.00 0.00 C ATOM 2118 CG1 ILE A 134 -15.015 -1.785 -1.299 1.00 0.00 C ATOM 2119 CG2 ILE A 134 -15.626 -0.136 -3.097 1.00 0.00 C ATOM 2120 CD1 ILE A 134 -15.786 -2.946 -1.897 1.00 0.00 C ATOM 0 H ILE A 134 -12.022 -1.579 -1.848 1.00 0.00 H new ATOM 0 HA ILE A 134 -14.071 -2.273 -3.836 1.00 0.00 H new ATOM 0 HB ILE A 134 -13.931 -0.010 -1.812 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -14.178 -2.177 -0.721 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -15.662 -1.253 -0.602 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -16.296 0.355 -2.392 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -15.226 0.602 -3.792 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -16.176 -0.896 -3.651 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -16.131 -3.603 -1.099 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -16.645 -2.566 -2.450 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -15.137 -3.504 -2.572 1.00 0.00 H new ATOM 2132 N LEU A 135 -13.121 -0.791 -5.587 1.00 0.00 N ATOM 2133 CA LEU A 135 -12.531 0.008 -6.650 1.00 0.00 C ATOM 2134 C LEU A 135 -13.512 1.023 -7.199 1.00 0.00 C ATOM 2135 O LEU A 135 -14.553 0.664 -7.749 1.00 0.00 O ATOM 2136 CB LEU A 135 -12.038 -0.893 -7.790 1.00 0.00 C ATOM 2137 CG LEU A 135 -10.820 -1.749 -7.460 1.00 0.00 C ATOM 2138 CD1 LEU A 135 -10.481 -2.662 -8.626 1.00 0.00 C ATOM 2139 CD2 LEU A 135 -9.634 -0.864 -7.109 1.00 0.00 C ATOM 0 H LEU A 135 -13.662 -1.591 -5.916 1.00 0.00 H new ATOM 0 HA LEU A 135 -11.687 0.546 -6.218 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -12.854 -1.551 -8.091 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -11.800 -0.267 -8.650 1.00 0.00 H new ATOM 0 HG LEU A 135 -11.054 -2.371 -6.596 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -9.609 -3.266 -8.374 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.328 -3.316 -8.834 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -10.262 -2.060 -9.508 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -8.771 -1.488 -6.875 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -9.398 -0.220 -7.956 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -9.882 -0.249 -6.244 1.00 0.00 H new ATOM 2151 N LYS A 136 -13.174 2.291 -7.039 1.00 0.00 N ATOM 2152 CA LYS A 136 -13.945 3.364 -7.641 1.00 0.00 C ATOM 2153 C LYS A 136 -13.312 3.770 -8.966 1.00 0.00 C ATOM 2154 O LYS A 136 -12.127 3.508 -9.202 1.00 0.00 O ATOM 2155 CB LYS A 136 -14.032 4.564 -6.694 1.00 0.00 C ATOM 2156 CG LYS A 136 -14.831 4.284 -5.430 1.00 0.00 C ATOM 2157 CD LYS A 136 -14.937 5.518 -4.548 1.00 0.00 C ATOM 2158 CE LYS A 136 -15.806 5.255 -3.328 1.00 0.00 C ATOM 2159 NZ LYS A 136 -15.870 6.433 -2.424 1.00 0.00 N ATOM 0 H LYS A 136 -12.369 2.603 -6.496 1.00 0.00 H new ATOM 0 HA LYS A 136 -14.959 3.009 -7.827 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -13.024 4.871 -6.416 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -14.486 5.402 -7.223 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -15.830 3.942 -5.699 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -14.358 3.477 -4.871 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -13.941 5.825 -4.228 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -15.356 6.344 -5.124 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -16.813 4.991 -3.651 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -15.412 4.399 -2.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -16.472 6.210 -1.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -14.912 6.670 -2.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -16.270 7.244 -2.938 1.00 0.00 H new ATOM 2173 N GLU A 137 -14.096 4.394 -9.833 1.00 0.00 N ATOM 2174 CA GLU A 137 -13.612 4.770 -11.152 1.00 0.00 C ATOM 2175 C GLU A 137 -12.970 6.145 -11.098 1.00 0.00 C ATOM 2176 O GLU A 137 -12.080 6.468 -11.885 1.00 0.00 O ATOM 2177 CB GLU A 137 -14.768 4.787 -12.152 1.00 0.00 C ATOM 2178 CG GLU A 137 -14.357 4.434 -13.570 1.00 0.00 C ATOM 2179 CD GLU A 137 -14.010 2.967 -13.719 1.00 0.00 C ATOM 2180 OE1 GLU A 137 -12.843 2.594 -13.471 1.00 0.00 O ATOM 2181 OE2 GLU A 137 -14.908 2.178 -14.076 1.00 0.00 O ATOM 0 H GLU A 137 -15.066 4.650 -9.648 1.00 0.00 H new ATOM 0 HA GLU A 137 -12.871 4.038 -11.473 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -15.533 4.085 -11.820 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -15.222 5.778 -12.151 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -15.168 4.685 -14.254 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -13.498 5.040 -13.858 1.00 0.00 H new ATOM 2188 N GLU A 138 -13.422 6.933 -10.143 1.00 0.00 N ATOM 2189 CA GLU A 138 -12.954 8.294 -9.968 1.00 0.00 C ATOM 2190 C GLU A 138 -12.685 8.571 -8.494 1.00 0.00 C ATOM 2191 O GLU A 138 -12.992 7.742 -7.637 1.00 0.00 O ATOM 2192 CB GLU A 138 -14.006 9.273 -10.484 1.00 0.00 C ATOM 2193 CG GLU A 138 -14.359 9.095 -11.953 1.00 0.00 C ATOM 2194 CD GLU A 138 -15.501 9.989 -12.384 1.00 0.00 C ATOM 2195 OE1 GLU A 138 -16.668 9.648 -12.089 1.00 0.00 O ATOM 2196 OE2 GLU A 138 -15.236 11.034 -13.012 1.00 0.00 O ATOM 0 H GLU A 138 -14.127 6.647 -9.464 1.00 0.00 H new ATOM 0 HA GLU A 138 -12.030 8.422 -10.531 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -14.912 9.162 -9.888 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -13.646 10.290 -10.329 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -13.482 9.311 -12.563 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -14.627 8.054 -12.136 1.00 0.00 H new ATOM 2203 N LEU A 139 -12.130 9.742 -8.202 1.00 0.00 N ATOM 2204 CA LEU A 139 -11.893 10.154 -6.824 1.00 0.00 C ATOM 2205 C LEU A 139 -13.183 10.695 -6.212 1.00 0.00 C ATOM 2206 O LEU A 139 -14.251 10.591 -6.816 1.00 0.00 O ATOM 2207 CB LEU A 139 -10.795 11.221 -6.770 1.00 0.00 C ATOM 2208 CG LEU A 139 -9.408 10.759 -7.220 1.00 0.00 C ATOM 2209 CD1 LEU A 139 -8.445 11.937 -7.264 1.00 0.00 C ATOM 2210 CD2 LEU A 139 -8.875 9.678 -6.291 1.00 0.00 C ATOM 0 H LEU A 139 -11.836 10.423 -8.902 1.00 0.00 H new ATOM 0 HA LEU A 139 -11.565 9.288 -6.250 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -11.099 12.062 -7.393 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -10.722 11.591 -5.747 1.00 0.00 H new ATOM 0 HG LEU A 139 -9.495 10.340 -8.223 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -7.462 11.592 -7.586 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -8.815 12.684 -7.966 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -8.367 12.380 -6.271 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -7.888 9.363 -6.628 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -8.804 10.072 -5.277 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -9.552 8.823 -6.301 1.00 0.00 H new