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 9 MET CE :methyl -109:sc= -0.62 (180deg=-1.47) USER MOD Set 1.2: A 118 CYS SG : rot 140:sc= -0.191 USER MOD Set 2.1: A 22 ASN : amide:sc= 0 X(o=-0.72,f=-0.57) USER MOD Set 2.2: A 47 ASN : amide:sc= -0.721 X(o=-0.72,f=-0.4) USER MOD Set 3.1: A 15 HIS : no HD1:sc= -0.994! C(o=-0.99!,f=-3.9!) USER MOD Set 3.2: A 18 GLN : amide:sc= 0 X(o=-0.99,f=-0.99) USER MOD Set 4.1: A 7 LYS NZ :NH3+ 165:sc= 1.15 (180deg=0.543) USER MOD Set 4.2: A 8 GLN : amide:sc= -1.79 K(o=-0.64,f=-1.4) USER MOD Set 5.1: A 1 MET CE :methyl -159:sc= 0 (180deg=0) USER MOD Set 5.2: A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET N :NH3+ -177:sc= 2.26 (180deg=2.04) USER MOD Single : A 5 THR OG1 : rot 120:sc= -2.29! USER MOD Single : A 6 LYS NZ :NH3+ -165:sc= 1.17 (180deg=1.01) USER MOD Single : A 12 MET CE :methyl -177:sc= -1.24 (180deg=-1.36) USER MOD Single : A 25 CYS SG : rot 180:sc= 0.0362 USER MOD Single : A 43 TYR OH : rot -87:sc= 1.27 USER MOD Single : A 46 ASN : amide:sc= -0.151 X(o=-0.15,f=-0.26) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 SER OG : rot 93:sc= 1.32 USER MOD Single : A 54 HIS : no HD1:sc= 1.04 K(o=1,f=-5.5!) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 MET CE :methyl -143:sc= -0.214 (180deg=-0.863) USER MOD Single : A 62 GLN : amide:sc= 0.586 K(o=0.59,f=-0.66) USER MOD Single : A 64 THR OG1 : rot 79:sc= 1.22 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 MET CE :methyl -143:sc= -1.03 (180deg=-2.47) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= 1.03 K(o=1,f=-1.3!) USER MOD Single : A 76 MET CE :methyl 166:sc= -0.0644 (180deg=-0.329) USER MOD Single : A 79 ASN : amide:sc= -0.363 K(o=-0.36,f=0.34) USER MOD Single : A 81 HIS : no HD1:sc= -0.102 K(o=-0.1,f=-6.3!) USER MOD Single : A 82 SER OG : rot 180:sc= -0.956 USER MOD Single : A 83 HIS : no HD1:sc= 0.521 K(o=0.55,f=-3.5!) USER MOD Single : A 86 THR OG1 : rot 180:sc= -1.36 USER MOD Single : A 91 SER OG : rot 34:sc= 0.16 USER MOD Single : A 95 LYS NZ :NH3+ -170:sc= -0.0209 (180deg=-0.19) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 150:sc= -0.121 USER MOD Single : A 105 TYR OH : rot 70:sc= 0.43 USER MOD Single : A 109 SER OG : rot 63:sc= -0.83! USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0102) USER MOD Single : A 120 SER OG : rot -119:sc= -2.01 USER MOD Single : A 124 LYS NZ :NH3+ 173:sc= 1.29 (180deg=1.22) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ -159:sc= -0.148 (180deg=-0.606) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.738 -2.193 5.007 1.00 0.00 N ATOM 2 CA MET A 1 -12.858 -2.682 3.916 1.00 0.00 C ATOM 3 C MET A 1 -12.000 -1.534 3.400 1.00 0.00 C ATOM 4 O MET A 1 -12.159 -0.392 3.833 1.00 0.00 O ATOM 5 CB MET A 1 -13.686 -3.287 2.770 1.00 0.00 C ATOM 6 CG MET A 1 -14.381 -2.274 1.873 1.00 0.00 C ATOM 7 SD MET A 1 -15.486 -1.173 2.770 1.00 0.00 S ATOM 8 CE MET A 1 -16.223 -0.282 1.406 1.00 0.00 C ATOM 0 H1 MET A 1 -14.287 -2.988 5.393 1.00 0.00 H new ATOM 0 H2 MET A 1 -13.156 -1.775 5.761 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.388 -1.473 4.632 1.00 0.00 H new ATOM 0 HA MET A 1 -12.213 -3.466 4.313 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.031 -3.904 2.155 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.440 -3.949 3.197 1.00 0.00 H new ATOM 0 HG2 MET A 1 -13.628 -1.680 1.356 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.949 -2.805 1.109 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.632 0.662 1.767 1.00 0.00 H new ATOM 0 HE2 MET A 1 -15.464 -0.083 0.649 1.00 0.00 H new ATOM 0 HE3 MET A 1 -17.022 -0.881 0.970 1.00 0.00 H new ATOM 20 N ILE A 2 -11.085 -1.833 2.491 1.00 0.00 N ATOM 21 CA ILE A 2 -10.234 -0.813 1.903 1.00 0.00 C ATOM 22 C ILE A 2 -10.757 -0.406 0.522 1.00 0.00 C ATOM 23 O ILE A 2 -11.161 -1.250 -0.282 1.00 0.00 O ATOM 24 CB ILE A 2 -8.765 -1.289 1.813 1.00 0.00 C ATOM 25 CG1 ILE A 2 -7.885 -0.211 1.173 1.00 0.00 C ATOM 26 CG2 ILE A 2 -8.671 -2.594 1.038 1.00 0.00 C ATOM 27 CD1 ILE A 2 -6.414 -0.567 1.130 1.00 0.00 C ATOM 0 H ILE A 2 -10.913 -2.777 2.144 1.00 0.00 H new ATOM 0 HA ILE A 2 -10.260 0.061 2.554 1.00 0.00 H new ATOM 0 HB ILE A 2 -8.400 -1.467 2.825 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -8.234 -0.027 0.157 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -8.008 0.720 1.726 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -7.630 -2.912 0.986 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -9.260 -3.360 1.543 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -9.056 -2.447 0.029 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -5.857 0.245 0.663 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -6.047 -0.722 2.145 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -6.277 -1.480 0.551 1.00 0.00 H new ATOM 39 N THR A 3 -10.784 0.890 0.270 1.00 0.00 N ATOM 40 CA THR A 3 -11.281 1.419 -0.985 1.00 0.00 C ATOM 41 C THR A 3 -10.235 2.315 -1.645 1.00 0.00 C ATOM 42 O THR A 3 -9.684 3.218 -1.006 1.00 0.00 O ATOM 43 CB THR A 3 -12.576 2.226 -0.758 1.00 0.00 C ATOM 44 OG1 THR A 3 -13.500 1.450 0.019 1.00 0.00 O ATOM 45 CG2 THR A 3 -13.224 2.608 -2.079 1.00 0.00 C ATOM 0 H THR A 3 -10.464 1.602 0.927 1.00 0.00 H new ATOM 0 HA THR A 3 -11.494 0.576 -1.642 1.00 0.00 H new ATOM 0 HB THR A 3 -12.317 3.140 -0.224 1.00 0.00 H new ATOM 0 HG1 THR A 3 -14.321 1.966 0.163 1.00 0.00 H new ATOM 0 HG21 THR A 3 -14.134 3.176 -1.887 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.532 3.217 -2.661 1.00 0.00 H new ATOM 0 HG23 THR A 3 -13.471 1.705 -2.638 1.00 0.00 H new ATOM 53 N LEU A 4 -9.947 2.045 -2.912 1.00 0.00 N ATOM 54 CA LEU A 4 -9.055 2.884 -3.695 1.00 0.00 C ATOM 55 C LEU A 4 -9.483 2.872 -5.152 1.00 0.00 C ATOM 56 O LEU A 4 -10.278 2.031 -5.568 1.00 0.00 O ATOM 57 CB LEU A 4 -7.587 2.460 -3.539 1.00 0.00 C ATOM 58 CG LEU A 4 -7.251 1.011 -3.898 1.00 0.00 C ATOM 59 CD1 LEU A 4 -6.804 0.908 -5.351 1.00 0.00 C ATOM 60 CD2 LEU A 4 -6.173 0.470 -2.969 1.00 0.00 C ATOM 0 H LEU A 4 -10.323 1.245 -3.420 1.00 0.00 H new ATOM 0 HA LEU A 4 -9.126 3.904 -3.317 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -6.975 3.115 -4.159 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -7.291 2.632 -2.504 1.00 0.00 H new ATOM 0 HG LEU A 4 -8.150 0.408 -3.773 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -6.570 -0.130 -5.587 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -7.605 1.257 -6.004 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.918 1.524 -5.504 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -5.945 -0.562 -3.238 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -5.273 1.077 -3.064 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -6.528 0.507 -1.939 1.00 0.00 H new ATOM 72 N THR A 5 -8.969 3.807 -5.917 1.00 0.00 N ATOM 73 CA THR A 5 -9.453 4.018 -7.269 1.00 0.00 C ATOM 74 C THR A 5 -8.451 3.534 -8.314 1.00 0.00 C ATOM 75 O THR A 5 -7.310 3.199 -7.986 1.00 0.00 O ATOM 76 CB THR A 5 -9.768 5.506 -7.493 1.00 0.00 C ATOM 77 OG1 THR A 5 -8.560 6.279 -7.463 1.00 0.00 O ATOM 78 CG2 THR A 5 -10.714 6.001 -6.408 1.00 0.00 C ATOM 0 H THR A 5 -8.217 4.434 -5.631 1.00 0.00 H new ATOM 0 HA THR A 5 -10.364 3.431 -7.386 1.00 0.00 H new ATOM 0 HB THR A 5 -10.240 5.621 -8.469 1.00 0.00 H new ATOM 0 HG1 THR A 5 -8.444 6.738 -8.321 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.934 7.056 -6.571 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.640 5.427 -6.443 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.246 5.875 -5.432 1.00 0.00 H new ATOM 86 N LYS A 6 -8.898 3.491 -9.568 1.00 0.00 N ATOM 87 CA LYS A 6 -8.061 3.080 -10.691 1.00 0.00 C ATOM 88 C LYS A 6 -6.780 3.899 -10.759 1.00 0.00 C ATOM 89 O LYS A 6 -5.707 3.355 -10.987 1.00 0.00 O ATOM 90 CB LYS A 6 -8.829 3.230 -12.008 1.00 0.00 C ATOM 91 CG LYS A 6 -9.776 2.082 -12.320 1.00 0.00 C ATOM 92 CD LYS A 6 -9.019 0.788 -12.558 1.00 0.00 C ATOM 93 CE LYS A 6 -9.814 -0.180 -13.422 1.00 0.00 C ATOM 94 NZ LYS A 6 -11.064 -0.651 -12.766 1.00 0.00 N ATOM 0 H LYS A 6 -9.851 3.740 -9.833 1.00 0.00 H new ATOM 0 HA LYS A 6 -7.795 2.034 -10.537 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -9.401 4.158 -11.977 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.112 3.325 -12.823 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -10.474 1.950 -11.494 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -10.368 2.326 -13.202 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -8.066 1.007 -13.040 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -8.791 0.319 -11.601 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -10.065 0.305 -14.365 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -9.190 -1.041 -13.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -11.429 -1.483 -13.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -10.862 -0.907 -11.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -11.775 0.108 -12.789 1.00 0.00 H new ATOM 108 N LYS A 7 -6.898 5.201 -10.548 1.00 0.00 N ATOM 109 CA LYS A 7 -5.759 6.098 -10.631 1.00 0.00 C ATOM 110 C LYS A 7 -4.735 5.766 -9.545 1.00 0.00 C ATOM 111 O LYS A 7 -3.532 5.814 -9.786 1.00 0.00 O ATOM 112 CB LYS A 7 -6.255 7.540 -10.506 1.00 0.00 C ATOM 113 CG LYS A 7 -5.343 8.575 -11.144 1.00 0.00 C ATOM 114 CD LYS A 7 -4.234 9.026 -10.204 1.00 0.00 C ATOM 115 CE LYS A 7 -4.789 9.829 -9.039 1.00 0.00 C ATOM 116 NZ LYS A 7 -3.721 10.241 -8.095 1.00 0.00 N ATOM 0 H LYS A 7 -7.778 5.661 -10.316 1.00 0.00 H new ATOM 0 HA LYS A 7 -5.262 5.976 -11.593 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.242 7.613 -10.962 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -6.374 7.780 -9.449 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -4.902 8.158 -12.049 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -5.934 9.440 -11.446 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -3.699 8.155 -9.826 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -3.512 9.630 -10.753 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -5.300 10.714 -9.418 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -5.533 9.234 -8.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -4.083 10.985 -7.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -3.424 9.421 -7.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -2.907 10.605 -8.630 1.00 0.00 H new ATOM 130 N GLN A 8 -5.219 5.409 -8.360 1.00 0.00 N ATOM 131 CA GLN A 8 -4.339 4.989 -7.270 1.00 0.00 C ATOM 132 C GLN A 8 -3.671 3.667 -7.632 1.00 0.00 C ATOM 133 O GLN A 8 -2.487 3.464 -7.368 1.00 0.00 O ATOM 134 CB GLN A 8 -5.131 4.819 -5.968 1.00 0.00 C ATOM 135 CG GLN A 8 -6.051 5.984 -5.635 1.00 0.00 C ATOM 136 CD GLN A 8 -5.319 7.303 -5.502 1.00 0.00 C ATOM 137 OE1 GLN A 8 -5.170 8.047 -6.471 1.00 0.00 O ATOM 138 NE2 GLN A 8 -4.869 7.607 -4.299 1.00 0.00 N ATOM 0 H GLN A 8 -6.212 5.401 -8.128 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.581 5.758 -7.121 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.727 3.909 -6.036 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -4.429 4.680 -5.146 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.809 6.074 -6.413 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -6.574 5.771 -4.703 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -5.014 6.962 -3.522 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -4.377 8.487 -4.146 1.00 0.00 H new ATOM 147 N MET A 9 -4.448 2.772 -8.235 1.00 0.00 N ATOM 148 CA MET A 9 -3.931 1.499 -8.717 1.00 0.00 C ATOM 149 C MET A 9 -2.837 1.739 -9.750 1.00 0.00 C ATOM 150 O MET A 9 -1.763 1.153 -9.674 1.00 0.00 O ATOM 151 CB MET A 9 -5.062 0.665 -9.327 1.00 0.00 C ATOM 152 CG MET A 9 -4.611 -0.672 -9.887 1.00 0.00 C ATOM 153 SD MET A 9 -3.969 -1.768 -8.609 1.00 0.00 S ATOM 154 CE MET A 9 -5.428 -1.996 -7.590 1.00 0.00 C ATOM 0 H MET A 9 -5.445 2.908 -8.401 1.00 0.00 H new ATOM 0 HA MET A 9 -3.508 0.949 -7.876 1.00 0.00 H new ATOM 0 HB2 MET A 9 -5.822 0.490 -8.566 1.00 0.00 H new ATOM 0 HB3 MET A 9 -5.535 1.240 -10.123 1.00 0.00 H new ATOM 0 HG2 MET A 9 -5.450 -1.155 -10.389 1.00 0.00 H new ATOM 0 HG3 MET A 9 -3.841 -0.507 -10.641 1.00 0.00 H new ATOM 0 HE1 MET A 9 -5.297 -1.470 -6.644 1.00 0.00 H new ATOM 0 HE2 MET A 9 -6.300 -1.598 -8.109 1.00 0.00 H new ATOM 0 HE3 MET A 9 -5.575 -3.059 -7.397 1.00 0.00 H new ATOM 164 N GLU A 10 -3.121 2.625 -10.694 1.00 0.00 N ATOM 165 CA GLU A 10 -2.182 3.001 -11.726 1.00 0.00 C ATOM 166 C GLU A 10 -0.910 3.589 -11.120 1.00 0.00 C ATOM 167 O GLU A 10 0.192 3.303 -11.581 1.00 0.00 O ATOM 168 CB GLU A 10 -2.861 4.015 -12.646 1.00 0.00 C ATOM 169 CG GLU A 10 -3.938 3.419 -13.537 1.00 0.00 C ATOM 170 CD GLU A 10 -3.386 2.454 -14.565 1.00 0.00 C ATOM 171 OE1 GLU A 10 -3.152 1.276 -14.225 1.00 0.00 O ATOM 172 OE2 GLU A 10 -3.191 2.868 -15.728 1.00 0.00 O ATOM 0 H GLU A 10 -4.019 3.104 -10.760 1.00 0.00 H new ATOM 0 HA GLU A 10 -1.890 2.119 -12.296 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.303 4.803 -12.037 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.104 4.484 -13.274 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.670 2.902 -12.917 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -4.466 4.224 -14.048 1.00 0.00 H new ATOM 179 N GLU A 11 -1.073 4.397 -10.076 1.00 0.00 N ATOM 180 CA GLU A 11 0.049 4.996 -9.373 1.00 0.00 C ATOM 181 C GLU A 11 0.909 3.932 -8.692 1.00 0.00 C ATOM 182 O GLU A 11 2.141 4.002 -8.722 1.00 0.00 O ATOM 183 CB GLU A 11 -0.476 6.016 -8.361 1.00 0.00 C ATOM 184 CG GLU A 11 -0.735 7.388 -8.966 1.00 0.00 C ATOM 185 CD GLU A 11 -1.170 8.413 -7.940 1.00 0.00 C ATOM 186 OE1 GLU A 11 -2.218 8.209 -7.297 1.00 0.00 O ATOM 187 OE2 GLU A 11 -0.478 9.444 -7.784 1.00 0.00 O ATOM 0 H GLU A 11 -1.985 4.652 -9.697 1.00 0.00 H new ATOM 0 HA GLU A 11 0.688 5.507 -10.094 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -1.400 5.640 -7.923 1.00 0.00 H new ATOM 0 HB3 GLU A 11 0.244 6.115 -7.549 1.00 0.00 H new ATOM 0 HG2 GLU A 11 0.171 7.738 -9.460 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -1.504 7.301 -9.734 1.00 0.00 H new ATOM 194 N MET A 12 0.264 2.945 -8.089 1.00 0.00 N ATOM 195 CA MET A 12 0.985 1.837 -7.474 1.00 0.00 C ATOM 196 C MET A 12 1.626 0.952 -8.543 1.00 0.00 C ATOM 197 O MET A 12 2.791 0.573 -8.426 1.00 0.00 O ATOM 198 CB MET A 12 0.056 1.005 -6.589 1.00 0.00 C ATOM 199 CG MET A 12 -0.495 1.771 -5.398 1.00 0.00 C ATOM 200 SD MET A 12 -1.505 0.749 -4.310 1.00 0.00 S ATOM 201 CE MET A 12 -2.823 0.266 -5.424 1.00 0.00 C ATOM 0 H MET A 12 -0.751 2.887 -8.012 1.00 0.00 H new ATOM 0 HA MET A 12 1.773 2.256 -6.848 1.00 0.00 H new ATOM 0 HB2 MET A 12 -0.775 0.639 -7.192 1.00 0.00 H new ATOM 0 HB3 MET A 12 0.598 0.130 -6.229 1.00 0.00 H new ATOM 0 HG2 MET A 12 0.334 2.190 -4.828 1.00 0.00 H new ATOM 0 HG3 MET A 12 -1.092 2.610 -5.757 1.00 0.00 H new ATOM 0 HE1 MET A 12 -3.559 -0.328 -4.881 1.00 0.00 H new ATOM 0 HE2 MET A 12 -3.303 1.157 -5.828 1.00 0.00 H new ATOM 0 HE3 MET A 12 -2.410 -0.326 -6.241 1.00 0.00 H new ATOM 211 N LEU A 13 0.861 0.648 -9.589 1.00 0.00 N ATOM 212 CA LEU A 13 1.337 -0.177 -10.701 1.00 0.00 C ATOM 213 C LEU A 13 2.537 0.461 -11.391 1.00 0.00 C ATOM 214 O LEU A 13 3.486 -0.229 -11.769 1.00 0.00 O ATOM 215 CB LEU A 13 0.206 -0.404 -11.712 1.00 0.00 C ATOM 216 CG LEU A 13 -0.884 -1.379 -11.259 1.00 0.00 C ATOM 217 CD1 LEU A 13 -1.928 -1.555 -12.350 1.00 0.00 C ATOM 218 CD2 LEU A 13 -0.274 -2.723 -10.879 1.00 0.00 C ATOM 0 H LEU A 13 -0.103 0.964 -9.691 1.00 0.00 H new ATOM 0 HA LEU A 13 1.654 -1.138 -10.295 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.258 0.556 -11.937 1.00 0.00 H new ATOM 0 HB3 LEU A 13 0.639 -0.774 -12.641 1.00 0.00 H new ATOM 0 HG LEU A 13 -1.374 -0.963 -10.379 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -2.695 -2.251 -12.011 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.386 -0.592 -12.574 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.453 -1.949 -13.248 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -1.063 -3.403 -10.560 1.00 0.00 H new ATOM 0 HD22 LEU A 13 0.242 -3.145 -11.741 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.436 -2.583 -10.064 1.00 0.00 H new ATOM 230 N ALA A 14 2.493 1.779 -11.548 1.00 0.00 N ATOM 231 CA ALA A 14 3.599 2.514 -12.147 1.00 0.00 C ATOM 232 C ALA A 14 4.864 2.355 -11.315 1.00 0.00 C ATOM 233 O ALA A 14 5.943 2.117 -11.854 1.00 0.00 O ATOM 234 CB ALA A 14 3.248 3.987 -12.302 1.00 0.00 C ATOM 0 H ALA A 14 1.703 2.360 -11.268 1.00 0.00 H new ATOM 0 HA ALA A 14 3.783 2.099 -13.138 1.00 0.00 H new ATOM 0 HB1 ALA A 14 4.089 4.516 -12.751 1.00 0.00 H new ATOM 0 HB2 ALA A 14 2.372 4.087 -12.943 1.00 0.00 H new ATOM 0 HB3 ALA A 14 3.032 4.414 -11.323 1.00 0.00 H new ATOM 240 N HIS A 15 4.729 2.476 -9.999 1.00 0.00 N ATOM 241 CA HIS A 15 5.871 2.295 -9.109 1.00 0.00 C ATOM 242 C HIS A 15 6.306 0.835 -9.095 1.00 0.00 C ATOM 243 O HIS A 15 7.491 0.533 -8.983 1.00 0.00 O ATOM 244 CB HIS A 15 5.534 2.749 -7.691 1.00 0.00 C ATOM 245 CG HIS A 15 6.726 2.812 -6.774 1.00 0.00 C ATOM 246 ND1 HIS A 15 7.817 3.626 -7.005 1.00 0.00 N ATOM 247 CD2 HIS A 15 6.988 2.159 -5.617 1.00 0.00 C ATOM 248 CE1 HIS A 15 8.694 3.469 -6.030 1.00 0.00 C ATOM 249 NE2 HIS A 15 8.216 2.585 -5.173 1.00 0.00 N ATOM 0 H HIS A 15 3.851 2.696 -9.528 1.00 0.00 H new ATOM 0 HA HIS A 15 6.691 2.908 -9.484 1.00 0.00 H new ATOM 0 HB2 HIS A 15 5.069 3.734 -7.736 1.00 0.00 H new ATOM 0 HB3 HIS A 15 4.797 2.067 -7.267 1.00 0.00 H new ATOM 0 HD2 HIS A 15 6.349 1.436 -5.132 1.00 0.00 H new ATOM 0 HE1 HIS A 15 9.643 3.978 -5.947 1.00 0.00 H new ATOM 0 HE2 HIS A 15 8.682 2.271 -4.322 1.00 0.00 H new ATOM 258 N ALA A 16 5.338 -0.062 -9.202 1.00 0.00 N ATOM 259 CA ALA A 16 5.616 -1.492 -9.225 1.00 0.00 C ATOM 260 C ALA A 16 6.479 -1.868 -10.424 1.00 0.00 C ATOM 261 O ALA A 16 7.527 -2.488 -10.267 1.00 0.00 O ATOM 262 CB ALA A 16 4.318 -2.285 -9.235 1.00 0.00 C ATOM 0 H ALA A 16 4.349 0.175 -9.275 1.00 0.00 H new ATOM 0 HA ALA A 16 6.172 -1.740 -8.321 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.543 -3.351 -9.252 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.741 -2.050 -8.340 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.738 -2.022 -10.120 1.00 0.00 H new ATOM 268 N ARG A 17 6.047 -1.465 -11.618 1.00 0.00 N ATOM 269 CA ARG A 17 6.790 -1.756 -12.841 1.00 0.00 C ATOM 270 C ARG A 17 8.145 -1.048 -12.823 1.00 0.00 C ATOM 271 O ARG A 17 9.127 -1.540 -13.379 1.00 0.00 O ATOM 272 CB ARG A 17 5.982 -1.365 -14.082 1.00 0.00 C ATOM 273 CG ARG A 17 5.806 0.128 -14.249 1.00 0.00 C ATOM 274 CD ARG A 17 4.865 0.467 -15.397 1.00 0.00 C ATOM 275 NE ARG A 17 5.290 -0.131 -16.662 1.00 0.00 N ATOM 276 CZ ARG A 17 4.533 -0.158 -17.762 1.00 0.00 C ATOM 277 NH1 ARG A 17 3.354 0.460 -17.778 1.00 0.00 N ATOM 278 NH2 ARG A 17 4.973 -0.780 -18.851 1.00 0.00 N ATOM 0 H ARG A 17 5.187 -0.936 -11.763 1.00 0.00 H new ATOM 0 HA ARG A 17 6.966 -2.831 -12.887 1.00 0.00 H new ATOM 0 HB2 ARG A 17 6.477 -1.765 -14.967 1.00 0.00 H new ATOM 0 HB3 ARG A 17 4.999 -1.834 -14.027 1.00 0.00 H new ATOM 0 HG2 ARG A 17 5.417 0.553 -13.324 1.00 0.00 H new ATOM 0 HG3 ARG A 17 6.777 0.590 -14.428 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.860 0.121 -15.154 1.00 0.00 H new ATOM 0 HD3 ARG A 17 4.810 1.550 -15.510 1.00 0.00 H new ATOM 0 HE ARG A 17 6.218 -0.552 -16.707 1.00 0.00 H new ATOM 0 HH11 ARG A 17 3.027 0.956 -16.949 1.00 0.00 H new ATOM 0 HH12 ARG A 17 2.778 0.438 -18.619 1.00 0.00 H new ATOM 0 HH21 ARG A 17 5.886 -1.235 -18.845 1.00 0.00 H new ATOM 0 HH22 ARG A 17 4.398 -0.803 -19.693 1.00 0.00 H new ATOM 292 N GLN A 18 8.179 0.112 -12.181 1.00 0.00 N ATOM 293 CA GLN A 18 9.404 0.885 -12.031 1.00 0.00 C ATOM 294 C GLN A 18 10.419 0.167 -11.142 1.00 0.00 C ATOM 295 O GLN A 18 11.615 0.141 -11.435 1.00 0.00 O ATOM 296 CB GLN A 18 9.064 2.247 -11.431 1.00 0.00 C ATOM 297 CG GLN A 18 10.274 3.103 -11.120 1.00 0.00 C ATOM 298 CD GLN A 18 9.896 4.438 -10.517 1.00 0.00 C ATOM 299 OE1 GLN A 18 9.728 4.560 -9.303 1.00 0.00 O ATOM 300 NE2 GLN A 18 9.773 5.448 -11.358 1.00 0.00 N ATOM 0 H GLN A 18 7.361 0.542 -11.751 1.00 0.00 H new ATOM 0 HA GLN A 18 9.856 1.007 -13.015 1.00 0.00 H new ATOM 0 HB2 GLN A 18 8.418 2.787 -12.124 1.00 0.00 H new ATOM 0 HB3 GLN A 18 8.493 2.097 -10.515 1.00 0.00 H new ATOM 0 HG2 GLN A 18 10.927 2.568 -10.431 1.00 0.00 H new ATOM 0 HG3 GLN A 18 10.843 3.269 -12.035 1.00 0.00 H new ATOM 0 HE21 GLN A 18 9.921 5.301 -12.356 1.00 0.00 H new ATOM 0 HE22 GLN A 18 9.530 6.375 -11.009 1.00 0.00 H new ATOM 309 N ALA A 19 9.932 -0.416 -10.058 1.00 0.00 N ATOM 310 CA ALA A 19 10.800 -1.031 -9.055 1.00 0.00 C ATOM 311 C ALA A 19 11.133 -2.483 -9.388 1.00 0.00 C ATOM 312 O ALA A 19 11.769 -3.178 -8.593 1.00 0.00 O ATOM 313 CB ALA A 19 10.154 -0.941 -7.681 1.00 0.00 C ATOM 0 H ALA A 19 8.936 -0.478 -9.846 1.00 0.00 H new ATOM 0 HA ALA A 19 11.739 -0.478 -9.054 1.00 0.00 H new ATOM 0 HB1 ALA A 19 10.808 -1.402 -6.941 1.00 0.00 H new ATOM 0 HB2 ALA A 19 9.994 0.106 -7.422 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.197 -1.462 -7.694 1.00 0.00 H new ATOM 319 N LEU A 20 10.707 -2.942 -10.557 1.00 0.00 N ATOM 320 CA LEU A 20 11.015 -4.294 -11.000 1.00 0.00 C ATOM 321 C LEU A 20 12.522 -4.472 -11.169 1.00 0.00 C ATOM 322 O LEU A 20 13.229 -3.533 -11.543 1.00 0.00 O ATOM 323 CB LEU A 20 10.303 -4.603 -12.319 1.00 0.00 C ATOM 324 CG LEU A 20 8.774 -4.666 -12.247 1.00 0.00 C ATOM 325 CD1 LEU A 20 8.192 -5.002 -13.612 1.00 0.00 C ATOM 326 CD2 LEU A 20 8.326 -5.690 -11.213 1.00 0.00 C ATOM 0 H LEU A 20 10.148 -2.398 -11.215 1.00 0.00 H new ATOM 0 HA LEU A 20 10.662 -4.989 -10.239 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.583 -3.844 -13.049 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.671 -5.558 -12.695 1.00 0.00 H new ATOM 0 HG LEU A 20 8.405 -3.687 -11.942 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.105 -5.043 -13.544 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.482 -4.235 -14.330 1.00 0.00 H new ATOM 0 HD13 LEU A 20 8.572 -5.969 -13.941 1.00 0.00 H new ATOM 0 HD21 LEU A 20 7.237 -5.719 -11.178 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.706 -6.674 -11.487 1.00 0.00 H new ATOM 0 HD23 LEU A 20 8.713 -5.411 -10.233 1.00 0.00 H new ATOM 338 N PRO A 21 13.039 -5.676 -10.899 1.00 0.00 N ATOM 339 CA PRO A 21 12.259 -6.811 -10.436 1.00 0.00 C ATOM 340 C PRO A 21 12.369 -7.032 -8.925 1.00 0.00 C ATOM 341 O PRO A 21 12.422 -8.175 -8.463 1.00 0.00 O ATOM 342 CB PRO A 21 12.931 -7.953 -11.194 1.00 0.00 C ATOM 343 CG PRO A 21 14.375 -7.553 -11.299 1.00 0.00 C ATOM 344 CD PRO A 21 14.444 -6.059 -11.071 1.00 0.00 C ATOM 0 HA PRO A 21 11.189 -6.698 -10.611 1.00 0.00 H new ATOM 0 HB2 PRO A 21 12.821 -8.898 -10.662 1.00 0.00 H new ATOM 0 HB3 PRO A 21 12.486 -8.088 -12.180 1.00 0.00 H new ATOM 0 HG2 PRO A 21 14.976 -8.083 -10.560 1.00 0.00 H new ATOM 0 HG3 PRO A 21 14.775 -7.811 -12.279 1.00 0.00 H new ATOM 0 HD2 PRO A 21 15.038 -5.814 -10.190 1.00 0.00 H new ATOM 0 HD3 PRO A 21 14.900 -5.544 -11.917 1.00 0.00 H new ATOM 352 N ASN A 22 12.387 -5.950 -8.157 1.00 0.00 N ATOM 353 CA ASN A 22 12.521 -6.053 -6.708 1.00 0.00 C ATOM 354 C ASN A 22 11.175 -5.838 -6.025 1.00 0.00 C ATOM 355 O ASN A 22 10.136 -5.778 -6.684 1.00 0.00 O ATOM 356 CB ASN A 22 13.533 -5.034 -6.172 1.00 0.00 C ATOM 357 CG ASN A 22 14.926 -5.205 -6.752 1.00 0.00 C ATOM 358 OD1 ASN A 22 15.309 -6.290 -7.189 1.00 0.00 O ATOM 359 ND2 ASN A 22 15.702 -4.133 -6.738 1.00 0.00 N ATOM 0 H ASN A 22 12.311 -4.996 -8.510 1.00 0.00 H new ATOM 0 HA ASN A 22 12.881 -7.057 -6.484 1.00 0.00 H new ATOM 0 HB2 ASN A 22 13.176 -4.028 -6.393 1.00 0.00 H new ATOM 0 HB3 ASN A 22 13.586 -5.122 -5.087 1.00 0.00 H new ATOM 0 HD21 ASN A 22 16.655 -4.188 -7.098 1.00 0.00 H new ATOM 0 HD22 ASN A 22 15.347 -3.251 -6.367 1.00 0.00 H new ATOM 366 N GLU A 23 11.204 -5.726 -4.700 1.00 0.00 N ATOM 367 CA GLU A 23 10.002 -5.467 -3.915 1.00 0.00 C ATOM 368 C GLU A 23 9.531 -4.031 -4.094 1.00 0.00 C ATOM 369 O GLU A 23 10.136 -3.091 -3.574 1.00 0.00 O ATOM 370 CB GLU A 23 10.263 -5.744 -2.434 1.00 0.00 C ATOM 371 CG GLU A 23 10.014 -7.187 -2.024 1.00 0.00 C ATOM 372 CD GLU A 23 8.546 -7.483 -1.779 1.00 0.00 C ATOM 373 OE1 GLU A 23 7.685 -6.903 -2.473 1.00 0.00 O ATOM 374 OE2 GLU A 23 8.245 -8.297 -0.880 1.00 0.00 O ATOM 0 H GLU A 23 12.055 -5.812 -4.144 1.00 0.00 H new ATOM 0 HA GLU A 23 9.219 -6.136 -4.273 1.00 0.00 H new ATOM 0 HB2 GLU A 23 11.296 -5.484 -2.202 1.00 0.00 H new ATOM 0 HB3 GLU A 23 9.628 -5.092 -1.835 1.00 0.00 H new ATOM 0 HG2 GLU A 23 10.389 -7.851 -2.803 1.00 0.00 H new ATOM 0 HG3 GLU A 23 10.580 -7.406 -1.119 1.00 0.00 H new ATOM 381 N ALA A 24 8.456 -3.865 -4.848 1.00 0.00 N ATOM 382 CA ALA A 24 7.858 -2.556 -5.033 1.00 0.00 C ATOM 383 C ALA A 24 7.080 -2.161 -3.788 1.00 0.00 C ATOM 384 O ALA A 24 5.972 -2.644 -3.558 1.00 0.00 O ATOM 385 CB ALA A 24 6.955 -2.551 -6.256 1.00 0.00 C ATOM 0 H ALA A 24 7.981 -4.621 -5.341 1.00 0.00 H new ATOM 0 HA ALA A 24 8.651 -1.826 -5.195 1.00 0.00 H new ATOM 0 HB1 ALA A 24 6.515 -1.561 -6.379 1.00 0.00 H new ATOM 0 HB2 ALA A 24 7.540 -2.801 -7.141 1.00 0.00 H new ATOM 0 HB3 ALA A 24 6.162 -3.287 -6.126 1.00 0.00 H new ATOM 391 N CYS A 25 7.663 -1.283 -2.990 1.00 0.00 N ATOM 392 CA CYS A 25 7.086 -0.921 -1.705 1.00 0.00 C ATOM 393 C CYS A 25 6.666 0.546 -1.673 1.00 0.00 C ATOM 394 O CYS A 25 7.015 1.325 -2.564 1.00 0.00 O ATOM 395 CB CYS A 25 8.097 -1.204 -0.589 1.00 0.00 C ATOM 396 SG CYS A 25 9.727 -0.463 -0.863 1.00 0.00 S ATOM 0 H CYS A 25 8.538 -0.806 -3.209 1.00 0.00 H new ATOM 0 HA CYS A 25 6.192 -1.525 -1.551 1.00 0.00 H new ATOM 0 HB2 CYS A 25 7.695 -0.833 0.354 1.00 0.00 H new ATOM 0 HB3 CYS A 25 8.213 -2.283 -0.483 1.00 0.00 H new ATOM 0 HG CYS A 25 10.510 -0.756 0.133 1.00 0.00 H new ATOM 402 N GLY A 26 5.902 0.907 -0.651 1.00 0.00 N ATOM 403 CA GLY A 26 5.440 2.268 -0.497 1.00 0.00 C ATOM 404 C GLY A 26 4.435 2.386 0.624 1.00 0.00 C ATOM 405 O GLY A 26 4.154 1.400 1.310 1.00 0.00 O ATOM 0 H GLY A 26 5.592 0.270 0.083 1.00 0.00 H new ATOM 0 HA2 GLY A 26 6.289 2.921 -0.297 1.00 0.00 H new ATOM 0 HA3 GLY A 26 4.989 2.608 -1.429 1.00 0.00 H new ATOM 409 N LEU A 27 3.869 3.571 0.793 1.00 0.00 N ATOM 410 CA LEU A 27 2.918 3.815 1.867 1.00 0.00 C ATOM 411 C LEU A 27 1.599 4.324 1.308 1.00 0.00 C ATOM 412 O LEU A 27 1.555 4.919 0.227 1.00 0.00 O ATOM 413 CB LEU A 27 3.481 4.840 2.857 1.00 0.00 C ATOM 414 CG LEU A 27 4.714 4.388 3.642 1.00 0.00 C ATOM 415 CD1 LEU A 27 5.245 5.525 4.502 1.00 0.00 C ATOM 416 CD2 LEU A 27 4.379 3.180 4.506 1.00 0.00 C ATOM 0 H LEU A 27 4.052 4.380 0.199 1.00 0.00 H new ATOM 0 HA LEU A 27 2.745 2.872 2.385 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.733 5.748 2.309 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.696 5.103 3.566 1.00 0.00 H new ATOM 0 HG LEU A 27 5.490 4.102 2.932 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.122 5.185 5.053 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.520 6.365 3.865 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.474 5.840 5.205 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.266 2.870 5.058 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.588 3.443 5.208 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.043 2.360 3.871 1.00 0.00 H new ATOM 428 N LEU A 28 0.526 4.086 2.045 1.00 0.00 N ATOM 429 CA LEU A 28 -0.796 4.534 1.639 1.00 0.00 C ATOM 430 C LEU A 28 -1.318 5.592 2.597 1.00 0.00 C ATOM 431 O LEU A 28 -1.269 5.419 3.819 1.00 0.00 O ATOM 432 CB LEU A 28 -1.773 3.356 1.589 1.00 0.00 C ATOM 433 CG LEU A 28 -1.424 2.260 0.583 1.00 0.00 C ATOM 434 CD1 LEU A 28 -2.445 1.140 0.648 1.00 0.00 C ATOM 435 CD2 LEU A 28 -1.349 2.825 -0.828 1.00 0.00 C ATOM 0 H LEU A 28 0.545 3.583 2.932 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.714 4.967 0.642 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.830 2.910 2.582 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.766 3.739 1.354 1.00 0.00 H new ATOM 0 HG LEU A 28 -0.445 1.858 0.843 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -2.183 0.367 -0.074 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -2.453 0.713 1.651 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.434 1.535 0.414 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -1.099 2.027 -1.527 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.313 3.256 -1.099 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.581 3.598 -0.870 1.00 0.00 H new ATOM 447 N GLY A 29 -1.826 6.678 2.038 1.00 0.00 N ATOM 448 CA GLY A 29 -2.349 7.750 2.849 1.00 0.00 C ATOM 449 C GLY A 29 -3.796 8.043 2.532 1.00 0.00 C ATOM 450 O GLY A 29 -4.210 8.012 1.369 1.00 0.00 O ATOM 0 H GLY A 29 -1.885 6.835 1.032 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.254 7.487 3.903 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.753 8.649 2.690 1.00 0.00 H new ATOM 454 N GLY A 30 -4.568 8.313 3.564 1.00 0.00 N ATOM 455 CA GLY A 30 -5.968 8.611 3.381 1.00 0.00 C ATOM 456 C GLY A 30 -6.694 8.666 4.701 1.00 0.00 C ATOM 457 O GLY A 30 -6.178 9.215 5.675 1.00 0.00 O ATOM 0 H GLY A 30 -4.249 8.332 4.533 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.074 9.565 2.865 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.423 7.852 2.745 1.00 0.00 H new ATOM 461 N ARG A 31 -7.881 8.093 4.750 1.00 0.00 N ATOM 462 CA ARG A 31 -8.649 8.067 5.980 1.00 0.00 C ATOM 463 C ARG A 31 -8.969 6.641 6.386 1.00 0.00 C ATOM 464 O ARG A 31 -9.423 5.843 5.568 1.00 0.00 O ATOM 465 CB ARG A 31 -9.952 8.856 5.832 1.00 0.00 C ATOM 466 CG ARG A 31 -9.760 10.354 5.671 1.00 0.00 C ATOM 467 CD ARG A 31 -11.086 11.089 5.779 1.00 0.00 C ATOM 468 NE ARG A 31 -11.752 10.819 7.054 1.00 0.00 N ATOM 469 CZ ARG A 31 -12.396 11.735 7.774 1.00 0.00 C ATOM 470 NH1 ARG A 31 -12.527 12.977 7.320 1.00 0.00 N ATOM 471 NH2 ARG A 31 -12.917 11.400 8.949 1.00 0.00 N ATOM 0 H ARG A 31 -8.333 7.641 3.956 1.00 0.00 H new ATOM 0 HA ARG A 31 -8.039 8.532 6.755 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -10.497 8.476 4.968 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -10.575 8.673 6.707 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -9.074 10.720 6.435 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -9.302 10.564 4.704 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -10.917 12.161 5.676 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -11.737 10.789 4.958 1.00 0.00 H new ATOM 0 HE ARG A 31 -11.721 9.866 7.415 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -12.133 13.233 6.415 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -13.022 13.674 7.877 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -12.823 10.445 9.295 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -13.412 12.098 9.505 1.00 0.00 H new ATOM 485 N ARG A 32 -8.706 6.314 7.638 1.00 0.00 N ATOM 486 CA ARG A 32 -9.136 5.044 8.185 1.00 0.00 C ATOM 487 C ARG A 32 -10.140 5.301 9.293 1.00 0.00 C ATOM 488 O ARG A 32 -9.860 6.025 10.251 1.00 0.00 O ATOM 489 CB ARG A 32 -7.948 4.211 8.693 1.00 0.00 C ATOM 490 CG ARG A 32 -7.149 4.862 9.815 1.00 0.00 C ATOM 491 CD ARG A 32 -5.961 4.009 10.236 1.00 0.00 C ATOM 492 NE ARG A 32 -6.361 2.688 10.724 1.00 0.00 N ATOM 493 CZ ARG A 32 -5.524 1.836 11.324 1.00 0.00 C ATOM 494 NH1 ARG A 32 -4.274 2.200 11.583 1.00 0.00 N ATOM 495 NH2 ARG A 32 -5.947 0.630 11.691 1.00 0.00 N ATOM 0 H ARG A 32 -8.198 6.909 8.292 1.00 0.00 H new ATOM 0 HA ARG A 32 -9.608 4.460 7.395 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -8.320 3.247 9.042 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -7.278 4.011 7.857 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -6.796 5.840 9.489 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -7.799 5.028 10.674 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -5.286 3.890 9.389 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -5.405 4.528 11.017 1.00 0.00 H new ATOM 0 HE ARG A 32 -7.332 2.402 10.599 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -3.950 3.132 11.324 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -3.637 1.548 12.041 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -6.913 0.353 11.515 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -5.306 -0.018 12.149 1.00 0.00 H new ATOM 509 N ASP A 33 -11.318 4.737 9.146 1.00 0.00 N ATOM 510 CA ASP A 33 -12.379 4.946 10.111 1.00 0.00 C ATOM 511 C ASP A 33 -12.974 3.604 10.481 1.00 0.00 C ATOM 512 O ASP A 33 -13.598 2.947 9.646 1.00 0.00 O ATOM 513 CB ASP A 33 -13.456 5.867 9.534 1.00 0.00 C ATOM 514 CG ASP A 33 -14.128 6.711 10.595 1.00 0.00 C ATOM 515 OD1 ASP A 33 -14.995 6.188 11.322 1.00 0.00 O ATOM 516 OD2 ASP A 33 -13.788 7.912 10.703 1.00 0.00 O ATOM 0 H ASP A 33 -11.568 4.128 8.366 1.00 0.00 H new ATOM 0 HA ASP A 33 -11.972 5.424 11.002 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -13.008 6.520 8.785 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -14.208 5.266 9.023 1.00 0.00 H new ATOM 521 N GLY A 34 -12.748 3.185 11.717 1.00 0.00 N ATOM 522 CA GLY A 34 -13.137 1.853 12.121 1.00 0.00 C ATOM 523 C GLY A 34 -12.370 0.807 11.343 1.00 0.00 C ATOM 524 O GLY A 34 -11.149 0.691 11.485 1.00 0.00 O ATOM 0 H GLY A 34 -12.303 3.743 12.445 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -12.955 1.725 13.188 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -14.207 1.718 11.962 1.00 0.00 H new ATOM 528 N ASP A 35 -13.070 0.071 10.496 1.00 0.00 N ATOM 529 CA ASP A 35 -12.433 -0.922 9.648 1.00 0.00 C ATOM 530 C ASP A 35 -12.567 -0.554 8.176 1.00 0.00 C ATOM 531 O ASP A 35 -12.376 -1.394 7.294 1.00 0.00 O ATOM 532 CB ASP A 35 -12.998 -2.319 9.910 1.00 0.00 C ATOM 533 CG ASP A 35 -12.351 -2.984 11.111 1.00 0.00 C ATOM 534 OD1 ASP A 35 -11.219 -3.494 10.972 1.00 0.00 O ATOM 535 OD2 ASP A 35 -12.961 -2.982 12.205 1.00 0.00 O ATOM 0 H ASP A 35 -14.081 0.143 10.377 1.00 0.00 H new ATOM 0 HA ASP A 35 -11.372 -0.936 9.898 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -14.074 -2.249 10.071 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.848 -2.941 9.028 1.00 0.00 H new ATOM 540 N ASP A 36 -12.888 0.704 7.899 1.00 0.00 N ATOM 541 CA ASP A 36 -12.877 1.188 6.527 1.00 0.00 C ATOM 542 C ASP A 36 -11.634 2.022 6.296 1.00 0.00 C ATOM 543 O ASP A 36 -11.210 2.795 7.158 1.00 0.00 O ATOM 544 CB ASP A 36 -14.095 2.036 6.177 1.00 0.00 C ATOM 545 CG ASP A 36 -15.412 1.434 6.623 1.00 0.00 C ATOM 546 OD1 ASP A 36 -15.900 0.495 5.953 1.00 0.00 O ATOM 547 OD2 ASP A 36 -15.980 1.913 7.630 1.00 0.00 O ATOM 0 H ASP A 36 -13.156 1.398 8.597 1.00 0.00 H new ATOM 0 HA ASP A 36 -12.893 0.305 5.887 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -13.984 3.020 6.633 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -14.123 2.186 5.098 1.00 0.00 H new ATOM 552 N ARG A 37 -11.047 1.838 5.139 1.00 0.00 N ATOM 553 CA ARG A 37 -9.843 2.558 4.750 1.00 0.00 C ATOM 554 C ARG A 37 -10.028 3.157 3.365 1.00 0.00 C ATOM 555 O ARG A 37 -10.384 2.444 2.426 1.00 0.00 O ATOM 556 CB ARG A 37 -8.601 1.646 4.754 1.00 0.00 C ATOM 557 CG ARG A 37 -8.258 1.040 6.110 1.00 0.00 C ATOM 558 CD ARG A 37 -9.041 -0.237 6.370 1.00 0.00 C ATOM 559 NE ARG A 37 -8.842 -0.743 7.729 1.00 0.00 N ATOM 560 CZ ARG A 37 -9.178 -1.975 8.116 1.00 0.00 C ATOM 561 NH1 ARG A 37 -9.618 -2.852 7.228 1.00 0.00 N ATOM 562 NH2 ARG A 37 -9.047 -2.333 9.384 1.00 0.00 N ATOM 0 H ARG A 37 -11.386 1.184 4.433 1.00 0.00 H new ATOM 0 HA ARG A 37 -9.680 3.349 5.482 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -8.759 0.838 4.040 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -7.744 2.220 4.401 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -7.190 0.827 6.154 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -8.471 1.764 6.896 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -10.102 -0.050 6.206 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -8.737 -0.999 5.653 1.00 0.00 H new ATOM 0 HE ARG A 37 -8.423 -0.119 8.419 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -9.701 -2.586 6.247 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -9.875 -3.793 7.525 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -8.689 -1.666 10.068 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -9.305 -3.275 9.677 1.00 0.00 H new ATOM 576 N TRP A 38 -9.793 4.448 3.235 1.00 0.00 N ATOM 577 CA TRP A 38 -9.920 5.112 1.946 1.00 0.00 C ATOM 578 C TRP A 38 -8.577 5.676 1.505 1.00 0.00 C ATOM 579 O TRP A 38 -8.032 6.577 2.143 1.00 0.00 O ATOM 580 CB TRP A 38 -10.964 6.231 2.017 1.00 0.00 C ATOM 581 CG TRP A 38 -12.313 5.748 2.460 1.00 0.00 C ATOM 582 CD1 TRP A 38 -13.215 5.043 1.718 1.00 0.00 C ATOM 583 CD2 TRP A 38 -12.912 5.936 3.748 1.00 0.00 C ATOM 584 NE1 TRP A 38 -14.333 4.773 2.468 1.00 0.00 N ATOM 585 CE2 TRP A 38 -14.173 5.314 3.716 1.00 0.00 C ATOM 586 CE3 TRP A 38 -12.503 6.566 4.924 1.00 0.00 C ATOM 587 CZ2 TRP A 38 -15.027 5.304 4.815 1.00 0.00 C ATOM 588 CZ3 TRP A 38 -13.351 6.559 6.013 1.00 0.00 C ATOM 589 CH2 TRP A 38 -14.601 5.931 5.953 1.00 0.00 C ATOM 0 H TRP A 38 -9.514 5.059 4.002 1.00 0.00 H new ATOM 0 HA TRP A 38 -10.249 4.376 1.213 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -10.616 7.001 2.705 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -11.056 6.698 1.036 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -13.071 4.741 0.691 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -15.150 4.254 2.148 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -11.540 7.051 4.981 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -15.991 4.819 4.771 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -13.045 7.046 6.927 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -15.241 5.942 6.823 1.00 0.00 H new ATOM 600 N VAL A 39 -8.038 5.127 0.424 1.00 0.00 N ATOM 601 CA VAL A 39 -6.758 5.574 -0.102 1.00 0.00 C ATOM 602 C VAL A 39 -6.957 6.774 -1.020 1.00 0.00 C ATOM 603 O VAL A 39 -7.265 6.619 -2.204 1.00 0.00 O ATOM 604 CB VAL A 39 -6.040 4.457 -0.886 1.00 0.00 C ATOM 605 CG1 VAL A 39 -4.645 4.900 -1.300 1.00 0.00 C ATOM 606 CG2 VAL A 39 -5.978 3.172 -0.070 1.00 0.00 C ATOM 0 H VAL A 39 -8.470 4.370 -0.106 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.138 5.852 0.750 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.616 4.256 -1.789 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -4.157 4.097 -1.852 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -4.717 5.784 -1.934 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -4.060 5.138 -0.411 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.467 2.400 -0.645 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.433 3.355 0.856 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.990 2.840 0.164 1.00 0.00 H new ATOM 616 N GLU A 40 -6.793 7.966 -0.467 1.00 0.00 N ATOM 617 CA GLU A 40 -7.014 9.186 -1.229 1.00 0.00 C ATOM 618 C GLU A 40 -5.728 9.633 -1.919 1.00 0.00 C ATOM 619 O GLU A 40 -5.767 10.323 -2.941 1.00 0.00 O ATOM 620 CB GLU A 40 -7.555 10.294 -0.323 1.00 0.00 C ATOM 621 CG GLU A 40 -8.754 9.863 0.510 1.00 0.00 C ATOM 622 CD GLU A 40 -9.536 11.034 1.056 1.00 0.00 C ATOM 623 OE1 GLU A 40 -8.964 11.849 1.801 1.00 0.00 O ATOM 624 OE2 GLU A 40 -10.732 11.154 0.726 1.00 0.00 O ATOM 0 H GLU A 40 -6.509 8.115 0.501 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.757 8.979 -1.999 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.760 10.628 0.344 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -7.837 11.150 -0.937 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -9.412 9.245 -0.101 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.412 9.242 1.338 1.00 0.00 H new ATOM 631 N ARG A 41 -4.586 9.228 -1.376 1.00 0.00 N ATOM 632 CA ARG A 41 -3.309 9.554 -1.993 1.00 0.00 C ATOM 633 C ARG A 41 -2.277 8.469 -1.703 1.00 0.00 C ATOM 634 O ARG A 41 -2.068 8.084 -0.554 1.00 0.00 O ATOM 635 CB ARG A 41 -2.812 10.922 -1.510 1.00 0.00 C ATOM 636 CG ARG A 41 -2.091 11.724 -2.585 1.00 0.00 C ATOM 637 CD ARG A 41 -0.702 11.181 -2.877 1.00 0.00 C ATOM 638 NE ARG A 41 -0.469 10.996 -4.309 1.00 0.00 N ATOM 639 CZ ARG A 41 0.481 11.627 -5.001 1.00 0.00 C ATOM 640 NH1 ARG A 41 1.233 12.554 -4.417 1.00 0.00 N ATOM 641 NH2 ARG A 41 0.677 11.332 -6.282 1.00 0.00 N ATOM 0 H ARG A 41 -4.519 8.679 -0.519 1.00 0.00 H new ATOM 0 HA ARG A 41 -3.452 9.604 -3.072 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.662 11.500 -1.146 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -2.139 10.777 -0.665 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -2.682 11.714 -3.501 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -2.013 12.764 -2.268 1.00 0.00 H new ATOM 0 HD2 ARG A 41 0.045 11.865 -2.475 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -0.571 10.228 -2.364 1.00 0.00 H new ATOM 0 HE ARG A 41 -1.071 10.343 -4.810 1.00 0.00 H new ATOM 0 HH11 ARG A 41 1.085 12.786 -3.435 1.00 0.00 H new ATOM 0 HH12 ARG A 41 1.958 13.033 -4.951 1.00 0.00 H new ATOM 0 HH21 ARG A 41 0.101 10.623 -6.736 1.00 0.00 H new ATOM 0 HH22 ARG A 41 1.403 11.815 -6.811 1.00 0.00 H new ATOM 655 N VAL A 42 -1.643 7.980 -2.757 1.00 0.00 N ATOM 656 CA VAL A 42 -0.626 6.944 -2.632 1.00 0.00 C ATOM 657 C VAL A 42 0.759 7.577 -2.583 1.00 0.00 C ATOM 658 O VAL A 42 1.055 8.488 -3.351 1.00 0.00 O ATOM 659 CB VAL A 42 -0.686 5.945 -3.810 1.00 0.00 C ATOM 660 CG1 VAL A 42 0.364 4.853 -3.657 1.00 0.00 C ATOM 661 CG2 VAL A 42 -2.074 5.341 -3.929 1.00 0.00 C ATOM 0 H VAL A 42 -1.815 8.285 -3.715 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.821 6.400 -1.708 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.469 6.493 -4.727 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.299 4.165 -4.500 1.00 0.00 H new ATOM 0 HG12 VAL A 42 1.356 5.303 -3.632 1.00 0.00 H new ATOM 0 HG13 VAL A 42 0.190 4.308 -2.729 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.096 4.641 -4.764 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -2.322 4.815 -3.007 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.802 6.134 -4.101 1.00 0.00 H new ATOM 671 N TYR A 43 1.602 7.106 -1.677 1.00 0.00 N ATOM 672 CA TYR A 43 2.954 7.626 -1.561 1.00 0.00 C ATOM 673 C TYR A 43 3.983 6.530 -1.810 1.00 0.00 C ATOM 674 O TYR A 43 4.418 5.841 -0.884 1.00 0.00 O ATOM 675 CB TYR A 43 3.172 8.297 -0.202 1.00 0.00 C ATOM 676 CG TYR A 43 2.407 9.593 -0.068 1.00 0.00 C ATOM 677 CD1 TYR A 43 2.624 10.627 -0.967 1.00 0.00 C ATOM 678 CD2 TYR A 43 1.460 9.779 0.929 1.00 0.00 C ATOM 679 CE1 TYR A 43 1.925 11.810 -0.876 1.00 0.00 C ATOM 680 CE2 TYR A 43 0.748 10.962 1.024 1.00 0.00 C ATOM 681 CZ TYR A 43 0.988 11.975 0.118 1.00 0.00 C ATOM 682 OH TYR A 43 0.274 13.147 0.183 1.00 0.00 O ATOM 0 H TYR A 43 1.374 6.366 -1.013 1.00 0.00 H new ATOM 0 HA TYR A 43 3.088 8.388 -2.329 1.00 0.00 H new ATOM 0 HB2 TYR A 43 2.865 7.614 0.590 1.00 0.00 H new ATOM 0 HB3 TYR A 43 4.236 8.490 -0.062 1.00 0.00 H new ATOM 0 HD1 TYR A 43 3.354 10.502 -1.753 1.00 0.00 H new ATOM 0 HD2 TYR A 43 1.276 8.989 1.642 1.00 0.00 H new ATOM 0 HE1 TYR A 43 2.112 12.605 -1.582 1.00 0.00 H new ATOM 0 HE2 TYR A 43 0.010 11.091 1.802 1.00 0.00 H new ATOM 0 HH TYR A 43 0.775 13.807 0.706 1.00 0.00 H new ATOM 692 N PRO A 44 4.336 6.319 -3.087 1.00 0.00 N ATOM 693 CA PRO A 44 5.326 5.320 -3.488 1.00 0.00 C ATOM 694 C PRO A 44 6.698 5.618 -2.898 1.00 0.00 C ATOM 695 O PRO A 44 7.334 6.612 -3.247 1.00 0.00 O ATOM 696 CB PRO A 44 5.361 5.430 -5.017 1.00 0.00 C ATOM 697 CG PRO A 44 4.096 6.121 -5.387 1.00 0.00 C ATOM 698 CD PRO A 44 3.799 7.048 -4.249 1.00 0.00 C ATOM 0 HA PRO A 44 5.067 4.322 -3.136 1.00 0.00 H new ATOM 0 HB2 PRO A 44 6.231 5.995 -5.351 1.00 0.00 H new ATOM 0 HB3 PRO A 44 5.423 4.446 -5.481 1.00 0.00 H new ATOM 0 HG2 PRO A 44 4.208 6.670 -6.322 1.00 0.00 H new ATOM 0 HG3 PRO A 44 3.286 5.406 -5.532 1.00 0.00 H new ATOM 0 HD2 PRO A 44 4.283 8.016 -4.379 1.00 0.00 H new ATOM 0 HD3 PRO A 44 2.730 7.237 -4.149 1.00 0.00 H new ATOM 706 N LEU A 45 7.142 4.753 -2.002 1.00 0.00 N ATOM 707 CA LEU A 45 8.408 4.940 -1.319 1.00 0.00 C ATOM 708 C LEU A 45 9.513 4.228 -2.094 1.00 0.00 C ATOM 709 O LEU A 45 9.276 3.181 -2.701 1.00 0.00 O ATOM 710 CB LEU A 45 8.289 4.405 0.117 1.00 0.00 C ATOM 711 CG LEU A 45 9.275 4.982 1.138 1.00 0.00 C ATOM 712 CD1 LEU A 45 8.689 4.894 2.538 1.00 0.00 C ATOM 713 CD2 LEU A 45 10.603 4.247 1.092 1.00 0.00 C ATOM 0 H LEU A 45 6.639 3.908 -1.730 1.00 0.00 H new ATOM 0 HA LEU A 45 8.662 5.999 -1.269 1.00 0.00 H new ATOM 0 HB2 LEU A 45 7.277 4.598 0.472 1.00 0.00 H new ATOM 0 HB3 LEU A 45 8.417 3.323 0.091 1.00 0.00 H new ATOM 0 HG LEU A 45 9.451 6.027 0.883 1.00 0.00 H new ATOM 0 HD11 LEU A 45 9.398 5.307 3.256 1.00 0.00 H new ATOM 0 HD12 LEU A 45 7.759 5.461 2.579 1.00 0.00 H new ATOM 0 HD13 LEU A 45 8.489 3.851 2.784 1.00 0.00 H new ATOM 0 HD21 LEU A 45 11.283 4.678 1.827 1.00 0.00 H new ATOM 0 HD22 LEU A 45 10.444 3.193 1.319 1.00 0.00 H new ATOM 0 HD23 LEU A 45 11.037 4.342 0.097 1.00 0.00 H new ATOM 725 N ASN A 46 10.701 4.812 -2.092 1.00 0.00 N ATOM 726 CA ASN A 46 11.838 4.264 -2.826 1.00 0.00 C ATOM 727 C ASN A 46 12.233 2.885 -2.291 1.00 0.00 C ATOM 728 O ASN A 46 12.039 2.582 -1.113 1.00 0.00 O ATOM 729 CB ASN A 46 13.030 5.229 -2.740 1.00 0.00 C ATOM 730 CG ASN A 46 14.279 4.697 -3.423 1.00 0.00 C ATOM 731 OD1 ASN A 46 15.115 4.050 -2.796 1.00 0.00 O ATOM 732 ND2 ASN A 46 14.416 4.968 -4.712 1.00 0.00 N ATOM 0 H ASN A 46 10.907 5.673 -1.586 1.00 0.00 H new ATOM 0 HA ASN A 46 11.545 4.146 -3.869 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.753 6.181 -3.193 1.00 0.00 H new ATOM 0 HB3 ASN A 46 13.253 5.428 -1.692 1.00 0.00 H new ATOM 0 HD21 ASN A 46 15.237 4.637 -5.218 1.00 0.00 H new ATOM 0 HD22 ASN A 46 13.700 5.508 -5.198 1.00 0.00 H new ATOM 739 N ASN A 47 12.754 2.044 -3.168 1.00 0.00 N ATOM 740 CA ASN A 47 13.241 0.729 -2.775 1.00 0.00 C ATOM 741 C ASN A 47 14.659 0.845 -2.214 1.00 0.00 C ATOM 742 O ASN A 47 15.631 0.906 -2.969 1.00 0.00 O ATOM 743 CB ASN A 47 13.222 -0.221 -3.980 1.00 0.00 C ATOM 744 CG ASN A 47 13.567 -1.657 -3.624 1.00 0.00 C ATOM 745 OD1 ASN A 47 14.232 -2.351 -4.394 1.00 0.00 O ATOM 746 ND2 ASN A 47 13.081 -2.132 -2.485 1.00 0.00 N ATOM 0 H ASN A 47 12.852 2.248 -4.163 1.00 0.00 H new ATOM 0 HA ASN A 47 12.588 0.325 -2.001 1.00 0.00 H new ATOM 0 HB2 ASN A 47 12.233 -0.196 -4.437 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.928 0.139 -4.728 1.00 0.00 H new ATOM 0 HD21 ASN A 47 13.254 -3.102 -2.222 1.00 0.00 H new ATOM 0 HD22 ASN A 47 12.534 -1.527 -1.872 1.00 0.00 H new ATOM 753 N LEU A 48 14.760 0.918 -0.888 1.00 0.00 N ATOM 754 CA LEU A 48 16.044 1.088 -0.211 1.00 0.00 C ATOM 755 C LEU A 48 16.970 -0.109 -0.418 1.00 0.00 C ATOM 756 O LEU A 48 18.185 0.057 -0.536 1.00 0.00 O ATOM 757 CB LEU A 48 15.828 1.315 1.287 1.00 0.00 C ATOM 758 CG LEU A 48 15.434 2.737 1.701 1.00 0.00 C ATOM 759 CD1 LEU A 48 16.534 3.724 1.349 1.00 0.00 C ATOM 760 CD2 LEU A 48 14.124 3.160 1.060 1.00 0.00 C ATOM 0 H LEU A 48 13.961 0.861 -0.257 1.00 0.00 H new ATOM 0 HA LEU A 48 16.524 1.961 -0.653 1.00 0.00 H new ATOM 0 HB2 LEU A 48 15.053 0.630 1.630 1.00 0.00 H new ATOM 0 HB3 LEU A 48 16.745 1.046 1.811 1.00 0.00 H new ATOM 0 HG LEU A 48 15.295 2.737 2.782 1.00 0.00 H new ATOM 0 HD11 LEU A 48 16.233 4.727 1.652 1.00 0.00 H new ATOM 0 HD12 LEU A 48 17.451 3.448 1.869 1.00 0.00 H new ATOM 0 HD13 LEU A 48 16.708 3.706 0.273 1.00 0.00 H new ATOM 0 HD21 LEU A 48 13.875 4.173 1.375 1.00 0.00 H new ATOM 0 HD22 LEU A 48 14.224 3.132 -0.025 1.00 0.00 H new ATOM 0 HD23 LEU A 48 13.331 2.479 1.369 1.00 0.00 H new ATOM 772 N ASP A 49 16.404 -1.308 -0.453 1.00 0.00 N ATOM 773 CA ASP A 49 17.212 -2.514 -0.608 1.00 0.00 C ATOM 774 C ASP A 49 17.453 -2.784 -2.086 1.00 0.00 C ATOM 775 O ASP A 49 16.875 -2.130 -2.952 1.00 0.00 O ATOM 776 CB ASP A 49 16.528 -3.735 0.032 1.00 0.00 C ATOM 777 CG ASP A 49 17.524 -4.771 0.526 1.00 0.00 C ATOM 778 OD1 ASP A 49 18.194 -5.405 -0.310 1.00 0.00 O ATOM 779 OD2 ASP A 49 17.635 -4.960 1.756 1.00 0.00 O ATOM 0 H ASP A 49 15.400 -1.473 -0.377 1.00 0.00 H new ATOM 0 HA ASP A 49 18.162 -2.350 -0.100 1.00 0.00 H new ATOM 0 HB2 ASP A 49 15.909 -3.404 0.866 1.00 0.00 H new ATOM 0 HB3 ASP A 49 15.861 -4.196 -0.696 1.00 0.00 H new ATOM 784 N GLN A 50 18.301 -3.751 -2.367 1.00 0.00 N ATOM 785 CA GLN A 50 18.586 -4.162 -3.730 1.00 0.00 C ATOM 786 C GLN A 50 18.137 -5.606 -3.918 1.00 0.00 C ATOM 787 O GLN A 50 18.497 -6.277 -4.886 1.00 0.00 O ATOM 788 CB GLN A 50 20.081 -4.001 -4.023 1.00 0.00 C ATOM 789 CG GLN A 50 20.981 -4.650 -2.985 1.00 0.00 C ATOM 790 CD GLN A 50 22.435 -4.248 -3.138 1.00 0.00 C ATOM 791 OE1 GLN A 50 23.203 -4.896 -3.851 1.00 0.00 O ATOM 792 NE2 GLN A 50 22.816 -3.164 -2.482 1.00 0.00 N ATOM 0 H GLN A 50 18.813 -4.276 -1.658 1.00 0.00 H new ATOM 0 HA GLN A 50 18.040 -3.532 -4.433 1.00 0.00 H new ATOM 0 HB2 GLN A 50 20.299 -4.432 -5.000 1.00 0.00 H new ATOM 0 HB3 GLN A 50 20.318 -2.939 -4.083 1.00 0.00 H new ATOM 0 HG2 GLN A 50 20.635 -4.376 -1.988 1.00 0.00 H new ATOM 0 HG3 GLN A 50 20.898 -5.734 -3.064 1.00 0.00 H new ATOM 0 HE21 GLN A 50 22.147 -2.657 -1.902 1.00 0.00 H new ATOM 0 HE22 GLN A 50 23.779 -2.835 -2.556 1.00 0.00 H new ATOM 801 N SER A 51 17.333 -6.064 -2.969 1.00 0.00 N ATOM 802 CA SER A 51 16.821 -7.419 -2.973 1.00 0.00 C ATOM 803 C SER A 51 15.364 -7.441 -3.437 1.00 0.00 C ATOM 804 O SER A 51 14.594 -6.537 -3.114 1.00 0.00 O ATOM 805 CB SER A 51 16.932 -7.987 -1.556 1.00 0.00 C ATOM 806 OG SER A 51 18.259 -7.863 -1.063 1.00 0.00 O ATOM 0 H SER A 51 17.020 -5.504 -2.176 1.00 0.00 H new ATOM 0 HA SER A 51 17.404 -8.027 -3.665 1.00 0.00 H new ATOM 0 HB2 SER A 51 16.243 -7.462 -0.894 1.00 0.00 H new ATOM 0 HB3 SER A 51 16.636 -9.036 -1.556 1.00 0.00 H new ATOM 0 HG SER A 51 18.344 -7.026 -0.560 1.00 0.00 H new ATOM 812 N PRO A 52 14.969 -8.469 -4.205 1.00 0.00 N ATOM 813 CA PRO A 52 13.595 -8.637 -4.668 1.00 0.00 C ATOM 814 C PRO A 52 12.721 -9.416 -3.685 1.00 0.00 C ATOM 815 O PRO A 52 11.505 -9.492 -3.854 1.00 0.00 O ATOM 816 CB PRO A 52 13.750 -9.441 -5.969 1.00 0.00 C ATOM 817 CG PRO A 52 15.201 -9.797 -6.084 1.00 0.00 C ATOM 818 CD PRO A 52 15.831 -9.515 -4.749 1.00 0.00 C ATOM 0 HA PRO A 52 13.101 -7.673 -4.788 1.00 0.00 H new ATOM 0 HB2 PRO A 52 13.132 -10.338 -5.945 1.00 0.00 H new ATOM 0 HB3 PRO A 52 13.426 -8.853 -6.828 1.00 0.00 H new ATOM 0 HG2 PRO A 52 15.320 -10.847 -6.352 1.00 0.00 H new ATOM 0 HG3 PRO A 52 15.681 -9.211 -6.868 1.00 0.00 H new ATOM 0 HD2 PRO A 52 15.846 -10.400 -4.113 1.00 0.00 H new ATOM 0 HD3 PRO A 52 16.863 -9.178 -4.851 1.00 0.00 H new ATOM 826 N GLU A 53 13.342 -10.013 -2.676 1.00 0.00 N ATOM 827 CA GLU A 53 12.610 -10.846 -1.723 1.00 0.00 C ATOM 828 C GLU A 53 12.319 -10.087 -0.432 1.00 0.00 C ATOM 829 O GLU A 53 11.527 -10.533 0.396 1.00 0.00 O ATOM 830 CB GLU A 53 13.405 -12.110 -1.404 1.00 0.00 C ATOM 831 CG GLU A 53 14.006 -12.783 -2.625 1.00 0.00 C ATOM 832 CD GLU A 53 15.516 -12.806 -2.566 1.00 0.00 C ATOM 833 OE1 GLU A 53 16.135 -11.726 -2.659 1.00 0.00 O ATOM 834 OE2 GLU A 53 16.094 -13.900 -2.409 1.00 0.00 O ATOM 0 H GLU A 53 14.343 -9.939 -2.495 1.00 0.00 H new ATOM 0 HA GLU A 53 11.661 -11.120 -2.184 1.00 0.00 H new ATOM 0 HB2 GLU A 53 14.206 -11.858 -0.709 1.00 0.00 H new ATOM 0 HB3 GLU A 53 12.752 -12.819 -0.895 1.00 0.00 H new ATOM 0 HG2 GLU A 53 13.629 -13.803 -2.700 1.00 0.00 H new ATOM 0 HG3 GLU A 53 13.685 -12.258 -3.525 1.00 0.00 H new ATOM 841 N HIS A 54 12.973 -8.948 -0.254 1.00 0.00 N ATOM 842 CA HIS A 54 12.787 -8.145 0.948 1.00 0.00 C ATOM 843 C HIS A 54 12.525 -6.701 0.585 1.00 0.00 C ATOM 844 O HIS A 54 13.119 -6.163 -0.350 1.00 0.00 O ATOM 845 CB HIS A 54 14.004 -8.206 1.876 1.00 0.00 C ATOM 846 CG HIS A 54 14.096 -9.439 2.719 1.00 0.00 C ATOM 847 ND1 HIS A 54 14.285 -9.398 4.082 1.00 0.00 N ATOM 848 CD2 HIS A 54 14.039 -10.744 2.390 1.00 0.00 C ATOM 849 CE1 HIS A 54 14.342 -10.629 4.554 1.00 0.00 C ATOM 850 NE2 HIS A 54 14.197 -11.467 3.546 1.00 0.00 N ATOM 0 H HIS A 54 13.636 -8.559 -0.925 1.00 0.00 H new ATOM 0 HA HIS A 54 11.929 -8.563 1.474 1.00 0.00 H new ATOM 0 HB2 HIS A 54 14.907 -8.130 1.271 1.00 0.00 H new ATOM 0 HB3 HIS A 54 13.985 -7.336 2.532 1.00 0.00 H new ATOM 0 HD2 HIS A 54 13.895 -11.147 1.399 1.00 0.00 H new ATOM 0 HE1 HIS A 54 14.483 -10.903 5.589 1.00 0.00 H new ATOM 0 HE2 HIS A 54 14.202 -12.485 3.614 1.00 0.00 H new ATOM 859 N PHE A 55 11.651 -6.077 1.340 1.00 0.00 N ATOM 860 CA PHE A 55 11.320 -4.679 1.137 1.00 0.00 C ATOM 861 C PHE A 55 11.767 -3.870 2.344 1.00 0.00 C ATOM 862 O PHE A 55 11.731 -4.356 3.476 1.00 0.00 O ATOM 863 CB PHE A 55 9.813 -4.499 0.890 1.00 0.00 C ATOM 864 CG PHE A 55 8.932 -4.991 2.009 1.00 0.00 C ATOM 865 CD1 PHE A 55 8.603 -6.336 2.115 1.00 0.00 C ATOM 866 CD2 PHE A 55 8.422 -4.106 2.946 1.00 0.00 C ATOM 867 CE1 PHE A 55 7.787 -6.785 3.137 1.00 0.00 C ATOM 868 CE2 PHE A 55 7.607 -4.552 3.969 1.00 0.00 C ATOM 869 CZ PHE A 55 7.288 -5.891 4.064 1.00 0.00 C ATOM 0 H PHE A 55 11.149 -6.519 2.110 1.00 0.00 H new ATOM 0 HA PHE A 55 11.844 -4.319 0.252 1.00 0.00 H new ATOM 0 HB2 PHE A 55 9.609 -3.441 0.723 1.00 0.00 H new ATOM 0 HB3 PHE A 55 9.543 -5.025 -0.026 1.00 0.00 H new ATOM 0 HD1 PHE A 55 8.989 -7.039 1.391 1.00 0.00 H new ATOM 0 HD2 PHE A 55 8.664 -3.056 2.876 1.00 0.00 H new ATOM 0 HE1 PHE A 55 7.540 -7.834 3.210 1.00 0.00 H new ATOM 0 HE2 PHE A 55 7.220 -3.852 4.695 1.00 0.00 H new ATOM 0 HZ PHE A 55 6.649 -6.239 4.862 1.00 0.00 H new ATOM 879 N SER A 56 12.218 -2.654 2.102 1.00 0.00 N ATOM 880 CA SER A 56 12.673 -1.788 3.175 1.00 0.00 C ATOM 881 C SER A 56 12.281 -0.347 2.895 1.00 0.00 C ATOM 882 O SER A 56 12.449 0.151 1.779 1.00 0.00 O ATOM 883 CB SER A 56 14.189 -1.901 3.347 1.00 0.00 C ATOM 884 OG SER A 56 14.574 -3.247 3.574 1.00 0.00 O ATOM 0 H SER A 56 12.279 -2.242 1.171 1.00 0.00 H new ATOM 0 HA SER A 56 12.194 -2.106 4.101 1.00 0.00 H new ATOM 0 HB2 SER A 56 14.689 -1.521 2.456 1.00 0.00 H new ATOM 0 HB3 SER A 56 14.511 -1.280 4.183 1.00 0.00 H new ATOM 0 HG SER A 56 15.547 -3.296 3.679 1.00 0.00 H new ATOM 890 N MET A 57 11.754 0.306 3.915 1.00 0.00 N ATOM 891 CA MET A 57 11.303 1.681 3.807 1.00 0.00 C ATOM 892 C MET A 57 12.041 2.544 4.820 1.00 0.00 C ATOM 893 O MET A 57 11.923 2.334 6.027 1.00 0.00 O ATOM 894 CB MET A 57 9.793 1.761 4.040 1.00 0.00 C ATOM 895 CG MET A 57 8.985 0.944 3.046 1.00 0.00 C ATOM 896 SD MET A 57 7.213 0.989 3.371 1.00 0.00 S ATOM 897 CE MET A 57 7.152 0.314 5.030 1.00 0.00 C ATOM 0 H MET A 57 11.627 -0.102 4.841 1.00 0.00 H new ATOM 0 HA MET A 57 11.518 2.050 2.804 1.00 0.00 H new ATOM 0 HB2 MET A 57 9.570 1.416 5.049 1.00 0.00 H new ATOM 0 HB3 MET A 57 9.479 2.803 3.983 1.00 0.00 H new ATOM 0 HG2 MET A 57 9.174 1.317 2.039 1.00 0.00 H new ATOM 0 HG3 MET A 57 9.327 -0.091 3.072 1.00 0.00 H new ATOM 0 HE1 MET A 57 6.266 -0.312 5.136 1.00 0.00 H new ATOM 0 HE2 MET A 57 8.044 -0.286 5.212 1.00 0.00 H new ATOM 0 HE3 MET A 57 7.109 1.129 5.753 1.00 0.00 H new ATOM 907 N ASP A 58 12.808 3.501 4.322 1.00 0.00 N ATOM 908 CA ASP A 58 13.655 4.328 5.177 1.00 0.00 C ATOM 909 C ASP A 58 12.808 5.215 6.089 1.00 0.00 C ATOM 910 O ASP A 58 11.768 5.729 5.671 1.00 0.00 O ATOM 911 CB ASP A 58 14.568 5.193 4.303 1.00 0.00 C ATOM 912 CG ASP A 58 15.595 5.960 5.104 1.00 0.00 C ATOM 913 OD1 ASP A 58 16.693 5.417 5.337 1.00 0.00 O ATOM 914 OD2 ASP A 58 15.312 7.107 5.502 1.00 0.00 O ATOM 0 H ASP A 58 12.864 3.727 3.329 1.00 0.00 H new ATOM 0 HA ASP A 58 14.261 3.676 5.807 1.00 0.00 H new ATOM 0 HB2 ASP A 58 15.079 4.557 3.580 1.00 0.00 H new ATOM 0 HB3 ASP A 58 13.959 5.896 3.735 1.00 0.00 H new ATOM 919 N PRO A 59 13.247 5.410 7.350 1.00 0.00 N ATOM 920 CA PRO A 59 12.536 6.244 8.330 1.00 0.00 C ATOM 921 C PRO A 59 12.346 7.684 7.860 1.00 0.00 C ATOM 922 O PRO A 59 11.308 8.296 8.120 1.00 0.00 O ATOM 923 CB PRO A 59 13.440 6.203 9.567 1.00 0.00 C ATOM 924 CG PRO A 59 14.245 4.961 9.409 1.00 0.00 C ATOM 925 CD PRO A 59 14.455 4.798 7.934 1.00 0.00 C ATOM 0 HA PRO A 59 11.527 5.873 8.508 1.00 0.00 H new ATOM 0 HB2 PRO A 59 14.079 7.085 9.619 1.00 0.00 H new ATOM 0 HB3 PRO A 59 12.853 6.180 10.485 1.00 0.00 H new ATOM 0 HG2 PRO A 59 15.197 5.042 9.933 1.00 0.00 H new ATOM 0 HG3 PRO A 59 13.723 4.100 9.828 1.00 0.00 H new ATOM 0 HD2 PRO A 59 15.363 5.300 7.599 1.00 0.00 H new ATOM 0 HD3 PRO A 59 14.550 3.749 7.655 1.00 0.00 H new ATOM 933 N ARG A 60 13.339 8.221 7.157 1.00 0.00 N ATOM 934 CA ARG A 60 13.262 9.589 6.656 1.00 0.00 C ATOM 935 C ARG A 60 12.243 9.670 5.535 1.00 0.00 C ATOM 936 O ARG A 60 11.465 10.625 5.450 1.00 0.00 O ATOM 937 CB ARG A 60 14.621 10.068 6.151 1.00 0.00 C ATOM 938 CG ARG A 60 15.679 10.170 7.234 1.00 0.00 C ATOM 939 CD ARG A 60 16.995 10.658 6.661 1.00 0.00 C ATOM 940 NE ARG A 60 18.013 10.853 7.690 1.00 0.00 N ATOM 941 CZ ARG A 60 19.321 10.845 7.445 1.00 0.00 C ATOM 942 NH1 ARG A 60 19.768 10.615 6.216 1.00 0.00 N ATOM 943 NH2 ARG A 60 20.176 11.068 8.431 1.00 0.00 N ATOM 0 H ARG A 60 14.203 7.732 6.922 1.00 0.00 H new ATOM 0 HA ARG A 60 12.955 10.235 7.478 1.00 0.00 H new ATOM 0 HB2 ARG A 60 14.972 9.385 5.378 1.00 0.00 H new ATOM 0 HB3 ARG A 60 14.500 11.045 5.682 1.00 0.00 H new ATOM 0 HG2 ARG A 60 15.342 10.853 8.014 1.00 0.00 H new ATOM 0 HG3 ARG A 60 15.821 9.196 7.702 1.00 0.00 H new ATOM 0 HD2 ARG A 60 17.358 9.938 5.927 1.00 0.00 H new ATOM 0 HD3 ARG A 60 16.832 11.597 6.133 1.00 0.00 H new ATOM 0 HE ARG A 60 17.704 11.004 8.650 1.00 0.00 H new ATOM 0 HH11 ARG A 60 19.108 10.444 5.457 1.00 0.00 H new ATOM 0 HH12 ARG A 60 20.771 10.609 6.031 1.00 0.00 H new ATOM 0 HH21 ARG A 60 19.831 11.245 9.375 1.00 0.00 H new ATOM 0 HH22 ARG A 60 21.179 11.063 8.247 1.00 0.00 H new ATOM 957 N GLU A 61 12.246 8.655 4.679 1.00 0.00 N ATOM 958 CA GLU A 61 11.272 8.562 3.604 1.00 0.00 C ATOM 959 C GLU A 61 9.862 8.472 4.175 1.00 0.00 C ATOM 960 O GLU A 61 8.931 9.086 3.652 1.00 0.00 O ATOM 961 CB GLU A 61 11.562 7.350 2.720 1.00 0.00 C ATOM 962 CG GLU A 61 12.828 7.487 1.893 1.00 0.00 C ATOM 963 CD GLU A 61 12.780 8.677 0.958 1.00 0.00 C ATOM 964 OE1 GLU A 61 11.725 8.901 0.333 1.00 0.00 O ATOM 965 OE2 GLU A 61 13.789 9.407 0.857 1.00 0.00 O ATOM 0 H GLU A 61 12.914 7.885 4.711 1.00 0.00 H new ATOM 0 HA GLU A 61 11.347 9.461 2.993 1.00 0.00 H new ATOM 0 HB2 GLU A 61 11.644 6.464 3.349 1.00 0.00 H new ATOM 0 HB3 GLU A 61 10.717 7.189 2.051 1.00 0.00 H new ATOM 0 HG2 GLU A 61 13.685 7.586 2.559 1.00 0.00 H new ATOM 0 HG3 GLU A 61 12.979 6.577 1.312 1.00 0.00 H new ATOM 972 N GLN A 62 9.722 7.715 5.262 1.00 0.00 N ATOM 973 CA GLN A 62 8.446 7.602 5.958 1.00 0.00 C ATOM 974 C GLN A 62 8.033 8.951 6.528 1.00 0.00 C ATOM 975 O GLN A 62 6.914 9.406 6.311 1.00 0.00 O ATOM 976 CB GLN A 62 8.536 6.592 7.103 1.00 0.00 C ATOM 977 CG GLN A 62 8.818 5.167 6.665 1.00 0.00 C ATOM 978 CD GLN A 62 8.957 4.235 7.850 1.00 0.00 C ATOM 979 OE1 GLN A 62 8.339 4.448 8.893 1.00 0.00 O ATOM 980 NE2 GLN A 62 9.774 3.207 7.711 1.00 0.00 N ATOM 0 H GLN A 62 10.478 7.171 5.678 1.00 0.00 H new ATOM 0 HA GLN A 62 7.704 7.262 5.235 1.00 0.00 H new ATOM 0 HB2 GLN A 62 9.321 6.910 7.790 1.00 0.00 H new ATOM 0 HB3 GLN A 62 7.599 6.609 7.660 1.00 0.00 H new ATOM 0 HG2 GLN A 62 8.012 4.818 6.020 1.00 0.00 H new ATOM 0 HG3 GLN A 62 9.733 5.142 6.073 1.00 0.00 H new ATOM 0 HE21 GLN A 62 10.269 3.064 6.830 1.00 0.00 H new ATOM 0 HE22 GLN A 62 9.910 2.556 8.484 1.00 0.00 H new ATOM 989 N LEU A 63 8.955 9.595 7.243 1.00 0.00 N ATOM 990 CA LEU A 63 8.678 10.873 7.888 1.00 0.00 C ATOM 991 C LEU A 63 8.253 11.919 6.861 1.00 0.00 C ATOM 992 O LEU A 63 7.324 12.685 7.096 1.00 0.00 O ATOM 993 CB LEU A 63 9.909 11.363 8.659 1.00 0.00 C ATOM 994 CG LEU A 63 9.724 12.682 9.415 1.00 0.00 C ATOM 995 CD1 LEU A 63 8.629 12.552 10.463 1.00 0.00 C ATOM 996 CD2 LEU A 63 11.033 13.112 10.058 1.00 0.00 C ATOM 0 H LEU A 63 9.903 9.249 7.389 1.00 0.00 H new ATOM 0 HA LEU A 63 7.858 10.726 8.591 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.201 10.592 9.372 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.735 11.478 7.957 1.00 0.00 H new ATOM 0 HG LEU A 63 9.422 13.448 8.701 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.514 13.500 10.988 1.00 0.00 H new ATOM 0 HD12 LEU A 63 7.689 12.290 9.977 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.898 11.773 11.176 1.00 0.00 H new ATOM 0 HD21 LEU A 63 10.885 14.051 10.591 1.00 0.00 H new ATOM 0 HD22 LEU A 63 11.364 12.345 10.758 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.790 13.249 9.286 1.00 0.00 H new ATOM 1008 N THR A 64 8.930 11.929 5.721 1.00 0.00 N ATOM 1009 CA THR A 64 8.606 12.853 4.645 1.00 0.00 C ATOM 1010 C THR A 64 7.177 12.622 4.146 1.00 0.00 C ATOM 1011 O THR A 64 6.405 13.567 3.971 1.00 0.00 O ATOM 1012 CB THR A 64 9.597 12.699 3.473 1.00 0.00 C ATOM 1013 OG1 THR A 64 10.945 12.837 3.947 1.00 0.00 O ATOM 1014 CG2 THR A 64 9.331 13.735 2.393 1.00 0.00 C ATOM 0 H THR A 64 9.710 11.304 5.518 1.00 0.00 H new ATOM 0 HA THR A 64 8.684 13.866 5.041 1.00 0.00 H new ATOM 0 HB THR A 64 9.460 11.707 3.044 1.00 0.00 H new ATOM 0 HG1 THR A 64 11.228 12.002 4.375 1.00 0.00 H new ATOM 0 HG21 THR A 64 10.044 13.603 1.579 1.00 0.00 H new ATOM 0 HG22 THR A 64 8.318 13.611 2.011 1.00 0.00 H new ATOM 0 HG23 THR A 64 9.440 14.735 2.813 1.00 0.00 H new ATOM 1022 N ALA A 65 6.821 11.355 3.953 1.00 0.00 N ATOM 1023 CA ALA A 65 5.496 11.002 3.466 1.00 0.00 C ATOM 1024 C ALA A 65 4.429 11.301 4.515 1.00 0.00 C ATOM 1025 O ALA A 65 3.396 11.887 4.203 1.00 0.00 O ATOM 1026 CB ALA A 65 5.450 9.534 3.065 1.00 0.00 C ATOM 0 H ALA A 65 7.433 10.558 4.127 1.00 0.00 H new ATOM 0 HA ALA A 65 5.286 11.611 2.587 1.00 0.00 H new ATOM 0 HB1 ALA A 65 4.452 9.287 2.703 1.00 0.00 H new ATOM 0 HB2 ALA A 65 6.178 9.350 2.275 1.00 0.00 H new ATOM 0 HB3 ALA A 65 5.687 8.913 3.929 1.00 0.00 H new ATOM 1032 N VAL A 66 4.697 10.914 5.761 1.00 0.00 N ATOM 1033 CA VAL A 66 3.762 11.143 6.857 1.00 0.00 C ATOM 1034 C VAL A 66 3.567 12.638 7.108 1.00 0.00 C ATOM 1035 O VAL A 66 2.447 13.091 7.340 1.00 0.00 O ATOM 1036 CB VAL A 66 4.232 10.452 8.159 1.00 0.00 C ATOM 1037 CG1 VAL A 66 3.309 10.791 9.319 1.00 0.00 C ATOM 1038 CG2 VAL A 66 4.308 8.943 7.965 1.00 0.00 C ATOM 0 H VAL A 66 5.557 10.439 6.035 1.00 0.00 H new ATOM 0 HA VAL A 66 2.809 10.706 6.560 1.00 0.00 H new ATOM 0 HB VAL A 66 5.229 10.824 8.398 1.00 0.00 H new ATOM 0 HG11 VAL A 66 3.662 10.293 10.222 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.305 11.869 9.478 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.298 10.454 9.090 1.00 0.00 H new ATOM 0 HG21 VAL A 66 4.640 8.473 8.891 1.00 0.00 H new ATOM 0 HG22 VAL A 66 3.323 8.561 7.697 1.00 0.00 H new ATOM 0 HG23 VAL A 66 5.015 8.714 7.168 1.00 0.00 H new ATOM 1048 N LYS A 67 4.655 13.402 7.041 1.00 0.00 N ATOM 1049 CA LYS A 67 4.595 14.844 7.268 1.00 0.00 C ATOM 1050 C LYS A 67 3.650 15.500 6.272 1.00 0.00 C ATOM 1051 O LYS A 67 2.838 16.353 6.634 1.00 0.00 O ATOM 1052 CB LYS A 67 5.985 15.473 7.145 1.00 0.00 C ATOM 1053 CG LYS A 67 6.015 16.947 7.516 1.00 0.00 C ATOM 1054 CD LYS A 67 7.413 17.526 7.402 1.00 0.00 C ATOM 1055 CE LYS A 67 7.437 18.998 7.786 1.00 0.00 C ATOM 1056 NZ LYS A 67 8.813 19.557 7.744 1.00 0.00 N ATOM 0 H LYS A 67 5.588 13.047 6.832 1.00 0.00 H new ATOM 0 HA LYS A 67 4.222 15.009 8.279 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.679 14.930 7.786 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.339 15.356 6.121 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.338 17.500 6.865 1.00 0.00 H new ATOM 0 HG3 LYS A 67 5.651 17.073 8.536 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.093 16.969 8.047 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.775 17.409 6.380 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.795 19.561 7.108 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.026 19.119 8.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 8.788 20.562 8.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.420 19.036 8.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.196 19.465 6.781 1.00 0.00 H new ATOM 1070 N ASP A 68 3.760 15.090 5.021 1.00 0.00 N ATOM 1071 CA ASP A 68 2.902 15.613 3.964 1.00 0.00 C ATOM 1072 C ASP A 68 1.483 15.091 4.141 1.00 0.00 C ATOM 1073 O ASP A 68 0.504 15.826 3.998 1.00 0.00 O ATOM 1074 CB ASP A 68 3.440 15.194 2.599 1.00 0.00 C ATOM 1075 CG ASP A 68 2.700 15.857 1.454 1.00 0.00 C ATOM 1076 OD1 ASP A 68 3.039 17.009 1.111 1.00 0.00 O ATOM 1077 OD2 ASP A 68 1.791 15.227 0.882 1.00 0.00 O ATOM 0 H ASP A 68 4.437 14.394 4.708 1.00 0.00 H new ATOM 0 HA ASP A 68 2.892 16.701 4.024 1.00 0.00 H new ATOM 0 HB2 ASP A 68 4.499 15.445 2.537 1.00 0.00 H new ATOM 0 HB3 ASP A 68 3.363 14.111 2.499 1.00 0.00 H new ATOM 1082 N MET A 69 1.401 13.814 4.482 1.00 0.00 N ATOM 1083 CA MET A 69 0.132 13.117 4.656 1.00 0.00 C ATOM 1084 C MET A 69 -0.733 13.794 5.716 1.00 0.00 C ATOM 1085 O MET A 69 -1.893 14.125 5.470 1.00 0.00 O ATOM 1086 CB MET A 69 0.427 11.681 5.086 1.00 0.00 C ATOM 1087 CG MET A 69 -0.709 10.704 4.863 1.00 0.00 C ATOM 1088 SD MET A 69 -0.277 9.038 5.398 1.00 0.00 S ATOM 1089 CE MET A 69 1.237 8.774 4.480 1.00 0.00 C ATOM 0 H MET A 69 2.218 13.226 4.647 1.00 0.00 H new ATOM 0 HA MET A 69 -0.415 13.137 3.713 1.00 0.00 H new ATOM 0 HB2 MET A 69 1.303 11.327 4.543 1.00 0.00 H new ATOM 0 HB3 MET A 69 0.686 11.680 6.145 1.00 0.00 H new ATOM 0 HG2 MET A 69 -1.591 11.043 5.407 1.00 0.00 H new ATOM 0 HG3 MET A 69 -0.973 10.689 3.805 1.00 0.00 H new ATOM 0 HE1 MET A 69 1.287 7.736 4.151 1.00 0.00 H new ATOM 0 HE2 MET A 69 1.255 9.431 3.610 1.00 0.00 H new ATOM 0 HE3 MET A 69 2.093 8.994 5.118 1.00 0.00 H new ATOM 1099 N ARG A 70 -0.145 14.048 6.879 1.00 0.00 N ATOM 1100 CA ARG A 70 -0.881 14.652 7.988 1.00 0.00 C ATOM 1101 C ARG A 70 -1.116 16.137 7.734 1.00 0.00 C ATOM 1102 O ARG A 70 -2.043 16.728 8.282 1.00 0.00 O ATOM 1103 CB ARG A 70 -0.161 14.414 9.332 1.00 0.00 C ATOM 1104 CG ARG A 70 1.246 14.998 9.422 1.00 0.00 C ATOM 1105 CD ARG A 70 1.239 16.443 9.894 1.00 0.00 C ATOM 1106 NE ARG A 70 1.997 17.311 8.995 1.00 0.00 N ATOM 1107 CZ ARG A 70 2.301 18.580 9.259 1.00 0.00 C ATOM 1108 NH1 ARG A 70 2.011 19.106 10.441 1.00 0.00 N ATOM 1109 NH2 ARG A 70 2.926 19.308 8.339 1.00 0.00 N ATOM 0 H ARG A 70 0.835 13.847 7.080 1.00 0.00 H new ATOM 0 HA ARG A 70 -1.855 14.167 8.053 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -0.767 14.840 10.132 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -0.105 13.340 9.512 1.00 0.00 H new ATOM 0 HG2 ARG A 70 1.844 14.397 10.107 1.00 0.00 H new ATOM 0 HG3 ARG A 70 1.725 14.939 8.445 1.00 0.00 H new ATOM 0 HD2 ARG A 70 0.211 16.798 9.961 1.00 0.00 H new ATOM 0 HD3 ARG A 70 1.662 16.500 10.897 1.00 0.00 H new ATOM 0 HE ARG A 70 2.314 16.919 8.108 1.00 0.00 H new ATOM 0 HH11 ARG A 70 1.553 18.538 11.153 1.00 0.00 H new ATOM 0 HH12 ARG A 70 2.246 20.079 10.638 1.00 0.00 H new ATOM 0 HH21 ARG A 70 3.169 18.894 7.439 1.00 0.00 H new ATOM 0 HH22 ARG A 70 3.163 20.281 8.533 1.00 0.00 H new ATOM 1123 N LYS A 71 -0.274 16.723 6.888 1.00 0.00 N ATOM 1124 CA LYS A 71 -0.356 18.144 6.562 1.00 0.00 C ATOM 1125 C LYS A 71 -1.695 18.488 5.921 1.00 0.00 C ATOM 1126 O LYS A 71 -2.304 19.512 6.236 1.00 0.00 O ATOM 1127 CB LYS A 71 0.768 18.508 5.595 1.00 0.00 C ATOM 1128 CG LYS A 71 0.675 19.912 5.030 1.00 0.00 C ATOM 1129 CD LYS A 71 1.599 20.079 3.839 1.00 0.00 C ATOM 1130 CE LYS A 71 1.263 21.327 3.041 1.00 0.00 C ATOM 1131 NZ LYS A 71 2.006 21.379 1.756 1.00 0.00 N ATOM 0 H LYS A 71 0.481 16.230 6.411 1.00 0.00 H new ATOM 0 HA LYS A 71 -0.260 18.711 7.488 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.723 18.398 6.109 1.00 0.00 H new ATOM 0 HB3 LYS A 71 0.766 17.796 4.770 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -0.352 20.120 4.730 1.00 0.00 H new ATOM 0 HG3 LYS A 71 0.935 20.637 5.802 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.632 20.134 4.184 1.00 0.00 H new ATOM 0 HD3 LYS A 71 1.524 19.203 3.194 1.00 0.00 H new ATOM 0 HE2 LYS A 71 0.192 21.353 2.842 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.499 22.211 3.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 1.749 22.245 1.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 3.028 21.380 1.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 1.761 20.549 1.180 1.00 0.00 H new ATOM 1145 N ASN A 72 -2.152 17.621 5.034 1.00 0.00 N ATOM 1146 CA ASN A 72 -3.405 17.862 4.331 1.00 0.00 C ATOM 1147 C ASN A 72 -4.576 17.247 5.090 1.00 0.00 C ATOM 1148 O ASN A 72 -5.729 17.625 4.886 1.00 0.00 O ATOM 1149 CB ASN A 72 -3.349 17.316 2.903 1.00 0.00 C ATOM 1150 CG ASN A 72 -4.477 17.861 2.041 1.00 0.00 C ATOM 1151 OD1 ASN A 72 -4.955 18.974 2.262 1.00 0.00 O ATOM 1152 ND2 ASN A 72 -4.916 17.089 1.059 1.00 0.00 N ATOM 0 H ASN A 72 -1.681 16.751 4.784 1.00 0.00 H new ATOM 0 HA ASN A 72 -3.555 18.940 4.276 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.391 17.575 2.453 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -3.405 16.228 2.928 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -5.674 17.411 0.457 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -4.496 16.172 0.905 1.00 0.00 H new ATOM 1159 N GLY A 73 -4.274 16.306 5.973 1.00 0.00 N ATOM 1160 CA GLY A 73 -5.310 15.722 6.803 1.00 0.00 C ATOM 1161 C GLY A 73 -5.516 14.240 6.556 1.00 0.00 C ATOM 1162 O GLY A 73 -6.634 13.738 6.681 1.00 0.00 O ATOM 0 H GLY A 73 -3.336 15.937 6.130 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -5.055 15.876 7.851 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -6.248 16.247 6.623 1.00 0.00 H new ATOM 1166 N TRP A 74 -4.449 13.538 6.209 1.00 0.00 N ATOM 1167 CA TRP A 74 -4.519 12.100 5.999 1.00 0.00 C ATOM 1168 C TRP A 74 -3.773 11.353 7.096 1.00 0.00 C ATOM 1169 O TRP A 74 -2.928 11.921 7.791 1.00 0.00 O ATOM 1170 CB TRP A 74 -3.930 11.714 4.641 1.00 0.00 C ATOM 1171 CG TRP A 74 -4.731 12.189 3.471 1.00 0.00 C ATOM 1172 CD1 TRP A 74 -6.063 11.999 3.269 1.00 0.00 C ATOM 1173 CD2 TRP A 74 -4.246 12.905 2.328 1.00 0.00 C ATOM 1174 NE1 TRP A 74 -6.443 12.556 2.078 1.00 0.00 N ATOM 1175 CE2 TRP A 74 -5.348 13.120 1.477 1.00 0.00 C ATOM 1176 CE3 TRP A 74 -2.993 13.388 1.942 1.00 0.00 C ATOM 1177 CZ2 TRP A 74 -5.232 13.795 0.265 1.00 0.00 C ATOM 1178 CZ3 TRP A 74 -2.879 14.057 0.738 1.00 0.00 C ATOM 1179 CH2 TRP A 74 -3.993 14.255 -0.088 1.00 0.00 C ATOM 0 H TRP A 74 -3.523 13.941 6.067 1.00 0.00 H new ATOM 0 HA TRP A 74 -5.572 11.820 6.025 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -2.921 12.120 4.566 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -3.841 10.629 4.591 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -6.724 11.484 3.950 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -7.390 12.552 1.698 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -2.129 13.241 2.573 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -6.089 13.950 -0.373 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -1.915 14.433 0.429 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -3.871 14.782 -1.023 1.00 0.00 H new ATOM 1190 N VAL A 75 -4.099 10.080 7.240 1.00 0.00 N ATOM 1191 CA VAL A 75 -3.410 9.197 8.170 1.00 0.00 C ATOM 1192 C VAL A 75 -2.850 7.999 7.412 1.00 0.00 C ATOM 1193 O VAL A 75 -3.294 7.700 6.298 1.00 0.00 O ATOM 1194 CB VAL A 75 -4.341 8.703 9.305 1.00 0.00 C ATOM 1195 CG1 VAL A 75 -4.765 9.863 10.193 1.00 0.00 C ATOM 1196 CG2 VAL A 75 -5.562 7.992 8.735 1.00 0.00 C ATOM 0 H VAL A 75 -4.848 9.628 6.716 1.00 0.00 H new ATOM 0 HA VAL A 75 -2.603 9.766 8.631 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.785 7.989 9.912 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.419 9.496 10.984 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -3.882 10.324 10.636 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.299 10.602 9.596 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.200 7.654 9.551 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.119 8.680 8.099 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.241 7.133 8.146 1.00 0.00 H new ATOM 1206 N MET A 76 -1.884 7.314 8.009 1.00 0.00 N ATOM 1207 CA MET A 76 -1.236 6.188 7.348 1.00 0.00 C ATOM 1208 C MET A 76 -2.109 4.946 7.439 1.00 0.00 C ATOM 1209 O MET A 76 -2.396 4.449 8.528 1.00 0.00 O ATOM 1210 CB MET A 76 0.144 5.921 7.958 1.00 0.00 C ATOM 1211 CG MET A 76 0.923 4.825 7.243 1.00 0.00 C ATOM 1212 SD MET A 76 2.604 4.627 7.870 1.00 0.00 S ATOM 1213 CE MET A 76 2.291 4.135 9.562 1.00 0.00 C ATOM 0 H MET A 76 -1.533 7.516 8.945 1.00 0.00 H new ATOM 0 HA MET A 76 -1.100 6.440 6.296 1.00 0.00 H new ATOM 0 HB2 MET A 76 0.726 6.842 7.937 1.00 0.00 H new ATOM 0 HB3 MET A 76 0.022 5.645 9.005 1.00 0.00 H new ATOM 0 HG2 MET A 76 0.389 3.881 7.348 1.00 0.00 H new ATOM 0 HG3 MET A 76 0.963 5.052 6.178 1.00 0.00 H new ATOM 0 HE1 MET A 76 3.207 3.740 10.001 1.00 0.00 H new ATOM 0 HE2 MET A 76 1.957 4.999 10.136 1.00 0.00 H new ATOM 0 HE3 MET A 76 1.518 3.366 9.580 1.00 0.00 H new ATOM 1223 N LEU A 77 -2.539 4.459 6.286 1.00 0.00 N ATOM 1224 CA LEU A 77 -3.417 3.300 6.221 1.00 0.00 C ATOM 1225 C LEU A 77 -2.612 2.012 6.335 1.00 0.00 C ATOM 1226 O LEU A 77 -3.093 1.002 6.852 1.00 0.00 O ATOM 1227 CB LEU A 77 -4.196 3.307 4.906 1.00 0.00 C ATOM 1228 CG LEU A 77 -4.975 4.592 4.622 1.00 0.00 C ATOM 1229 CD1 LEU A 77 -5.687 4.495 3.285 1.00 0.00 C ATOM 1230 CD2 LEU A 77 -5.967 4.872 5.737 1.00 0.00 C ATOM 0 H LEU A 77 -2.293 4.851 5.377 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.117 3.350 7.055 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -3.498 3.135 4.087 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -4.894 2.470 4.911 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.269 5.421 4.577 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.237 5.417 3.098 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.954 4.342 2.493 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.382 3.656 3.303 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.512 5.790 5.517 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.670 4.043 5.815 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.432 4.984 6.680 1.00 0.00 H new ATOM 1242 N GLY A 78 -1.385 2.064 5.846 1.00 0.00 N ATOM 1243 CA GLY A 78 -0.520 0.906 5.867 1.00 0.00 C ATOM 1244 C GLY A 78 0.503 0.967 4.758 1.00 0.00 C ATOM 1245 O GLY A 78 0.746 2.039 4.195 1.00 0.00 O ATOM 0 H GLY A 78 -0.969 2.897 5.430 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -0.013 0.845 6.830 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.118 0.000 5.764 1.00 0.00 H new ATOM 1249 N ASN A 79 1.085 -0.170 4.427 1.00 0.00 N ATOM 1250 CA ASN A 79 2.101 -0.231 3.389 1.00 0.00 C ATOM 1251 C ASN A 79 1.827 -1.381 2.439 1.00 0.00 C ATOM 1252 O ASN A 79 0.990 -2.244 2.711 1.00 0.00 O ATOM 1253 CB ASN A 79 3.500 -0.381 3.999 1.00 0.00 C ATOM 1254 CG ASN A 79 3.650 -1.634 4.844 1.00 0.00 C ATOM 1255 OD1 ASN A 79 3.330 -1.639 6.031 1.00 0.00 O ATOM 1256 ND2 ASN A 79 4.156 -2.701 4.243 1.00 0.00 N ATOM 0 H ASN A 79 0.872 -1.067 4.862 1.00 0.00 H new ATOM 0 HA ASN A 79 2.063 0.705 2.831 1.00 0.00 H new ATOM 0 HB2 ASN A 79 4.239 -0.399 3.198 1.00 0.00 H new ATOM 0 HB3 ASN A 79 3.718 0.493 4.613 1.00 0.00 H new ATOM 0 HD21 ASN A 79 4.292 -3.565 4.767 1.00 0.00 H new ATOM 0 HD22 ASN A 79 4.410 -2.658 3.256 1.00 0.00 H new ATOM 1263 N PHE A 80 2.542 -1.396 1.332 1.00 0.00 N ATOM 1264 CA PHE A 80 2.361 -2.433 0.330 1.00 0.00 C ATOM 1265 C PHE A 80 3.702 -2.896 -0.220 1.00 0.00 C ATOM 1266 O PHE A 80 4.721 -2.227 -0.044 1.00 0.00 O ATOM 1267 CB PHE A 80 1.453 -1.948 -0.811 1.00 0.00 C ATOM 1268 CG PHE A 80 1.992 -0.784 -1.600 1.00 0.00 C ATOM 1269 CD1 PHE A 80 2.777 -0.994 -2.721 1.00 0.00 C ATOM 1270 CD2 PHE A 80 1.698 0.516 -1.228 1.00 0.00 C ATOM 1271 CE1 PHE A 80 3.263 0.073 -3.454 1.00 0.00 C ATOM 1272 CE2 PHE A 80 2.178 1.587 -1.957 1.00 0.00 C ATOM 1273 CZ PHE A 80 2.962 1.366 -3.071 1.00 0.00 C ATOM 0 H PHE A 80 3.254 -0.703 1.101 1.00 0.00 H new ATOM 0 HA PHE A 80 1.876 -3.280 0.815 1.00 0.00 H new ATOM 0 HB2 PHE A 80 1.276 -2.780 -1.493 1.00 0.00 H new ATOM 0 HB3 PHE A 80 0.486 -1.668 -0.392 1.00 0.00 H new ATOM 0 HD1 PHE A 80 3.012 -2.003 -3.026 1.00 0.00 H new ATOM 0 HD2 PHE A 80 1.086 0.696 -0.357 1.00 0.00 H new ATOM 0 HE1 PHE A 80 3.877 -0.104 -4.325 1.00 0.00 H new ATOM 0 HE2 PHE A 80 1.940 2.596 -1.655 1.00 0.00 H new ATOM 0 HZ PHE A 80 3.339 2.202 -3.642 1.00 0.00 H new ATOM 1283 N HIS A 81 3.692 -4.061 -0.856 1.00 0.00 N ATOM 1284 CA HIS A 81 4.863 -4.582 -1.547 1.00 0.00 C ATOM 1285 C HIS A 81 4.419 -5.525 -2.661 1.00 0.00 C ATOM 1286 O HIS A 81 3.442 -6.263 -2.506 1.00 0.00 O ATOM 1287 CB HIS A 81 5.831 -5.276 -0.572 1.00 0.00 C ATOM 1288 CG HIS A 81 5.274 -6.471 0.148 1.00 0.00 C ATOM 1289 ND1 HIS A 81 4.632 -6.386 1.366 1.00 0.00 N ATOM 1290 CD2 HIS A 81 5.301 -7.787 -0.164 1.00 0.00 C ATOM 1291 CE1 HIS A 81 4.296 -7.599 1.767 1.00 0.00 C ATOM 1292 NE2 HIS A 81 4.689 -8.467 0.860 1.00 0.00 N ATOM 0 H HIS A 81 2.874 -4.669 -0.907 1.00 0.00 H new ATOM 0 HA HIS A 81 5.409 -3.749 -1.989 1.00 0.00 H new ATOM 0 HB2 HIS A 81 6.717 -5.587 -1.126 1.00 0.00 H new ATOM 0 HB3 HIS A 81 6.158 -4.547 0.169 1.00 0.00 H new ATOM 0 HD2 HIS A 81 5.726 -8.223 -1.056 1.00 0.00 H new ATOM 0 HE1 HIS A 81 3.784 -7.838 2.687 1.00 0.00 H new ATOM 0 HE2 HIS A 81 4.560 -9.478 0.909 1.00 0.00 H new ATOM 1301 N SER A 82 5.115 -5.484 -3.783 1.00 0.00 N ATOM 1302 CA SER A 82 4.689 -6.215 -4.966 1.00 0.00 C ATOM 1303 C SER A 82 5.778 -7.165 -5.453 1.00 0.00 C ATOM 1304 O SER A 82 6.956 -6.808 -5.483 1.00 0.00 O ATOM 1305 CB SER A 82 4.322 -5.228 -6.072 1.00 0.00 C ATOM 1306 OG SER A 82 3.446 -4.227 -5.580 1.00 0.00 O ATOM 0 H SER A 82 5.978 -4.953 -3.901 1.00 0.00 H new ATOM 0 HA SER A 82 3.817 -6.814 -4.704 1.00 0.00 H new ATOM 0 HB2 SER A 82 5.226 -4.765 -6.468 1.00 0.00 H new ATOM 0 HB3 SER A 82 3.848 -5.759 -6.898 1.00 0.00 H new ATOM 0 HG SER A 82 3.224 -3.603 -6.302 1.00 0.00 H new ATOM 1312 N HIS A 83 5.375 -8.366 -5.852 1.00 0.00 N ATOM 1313 CA HIS A 83 6.319 -9.361 -6.343 1.00 0.00 C ATOM 1314 C HIS A 83 6.183 -9.516 -7.856 1.00 0.00 C ATOM 1315 O HIS A 83 5.073 -9.471 -8.387 1.00 0.00 O ATOM 1316 CB HIS A 83 6.085 -10.708 -5.651 1.00 0.00 C ATOM 1317 CG HIS A 83 6.327 -10.672 -4.174 1.00 0.00 C ATOM 1318 ND1 HIS A 83 5.502 -11.281 -3.253 1.00 0.00 N ATOM 1319 CD2 HIS A 83 7.312 -10.082 -3.460 1.00 0.00 C ATOM 1320 CE1 HIS A 83 5.971 -11.060 -2.036 1.00 0.00 C ATOM 1321 NE2 HIS A 83 7.070 -10.333 -2.134 1.00 0.00 N ATOM 0 H HIS A 83 4.402 -8.673 -5.845 1.00 0.00 H new ATOM 0 HA HIS A 83 7.330 -9.023 -6.113 1.00 0.00 H new ATOM 0 HB2 HIS A 83 5.060 -11.029 -5.835 1.00 0.00 H new ATOM 0 HB3 HIS A 83 6.738 -11.456 -6.100 1.00 0.00 H new ATOM 0 HD2 HIS A 83 8.139 -9.516 -3.861 1.00 0.00 H new ATOM 0 HE1 HIS A 83 5.530 -11.414 -1.116 1.00 0.00 H new ATOM 0 HE2 HIS A 83 7.643 -10.012 -1.353 1.00 0.00 H new ATOM 1330 N PRO A 84 7.307 -9.712 -8.570 1.00 0.00 N ATOM 1331 CA PRO A 84 7.316 -9.811 -10.027 1.00 0.00 C ATOM 1332 C PRO A 84 7.097 -11.231 -10.545 1.00 0.00 C ATOM 1333 O PRO A 84 6.184 -11.478 -11.325 1.00 0.00 O ATOM 1334 CB PRO A 84 8.721 -9.321 -10.407 1.00 0.00 C ATOM 1335 CG PRO A 84 9.487 -9.175 -9.123 1.00 0.00 C ATOM 1336 CD PRO A 84 8.664 -9.806 -8.033 1.00 0.00 C ATOM 0 HA PRO A 84 6.502 -9.233 -10.464 1.00 0.00 H new ATOM 0 HB2 PRO A 84 9.212 -10.031 -11.072 1.00 0.00 H new ATOM 0 HB3 PRO A 84 8.669 -8.370 -10.938 1.00 0.00 H new ATOM 0 HG2 PRO A 84 10.460 -9.661 -9.199 1.00 0.00 H new ATOM 0 HG3 PRO A 84 9.672 -8.123 -8.904 1.00 0.00 H new ATOM 0 HD2 PRO A 84 8.957 -10.840 -7.849 1.00 0.00 H new ATOM 0 HD3 PRO A 84 8.765 -9.273 -7.088 1.00 0.00 H new ATOM 1344 N ALA A 85 7.933 -12.164 -10.111 1.00 0.00 N ATOM 1345 CA ALA A 85 7.872 -13.532 -10.606 1.00 0.00 C ATOM 1346 C ALA A 85 7.241 -14.458 -9.579 1.00 0.00 C ATOM 1347 O ALA A 85 7.365 -15.681 -9.666 1.00 0.00 O ATOM 1348 CB ALA A 85 9.268 -14.014 -10.969 1.00 0.00 C ATOM 0 H ALA A 85 8.662 -11.998 -9.417 1.00 0.00 H new ATOM 0 HA ALA A 85 7.246 -13.547 -11.498 1.00 0.00 H new ATOM 0 HB1 ALA A 85 9.215 -15.038 -11.339 1.00 0.00 H new ATOM 0 HB2 ALA A 85 9.685 -13.370 -11.743 1.00 0.00 H new ATOM 0 HB3 ALA A 85 9.906 -13.980 -10.086 1.00 0.00 H new ATOM 1354 N THR A 86 6.548 -13.871 -8.618 1.00 0.00 N ATOM 1355 CA THR A 86 5.932 -14.630 -7.543 1.00 0.00 C ATOM 1356 C THR A 86 4.539 -14.094 -7.223 1.00 0.00 C ATOM 1357 O THR A 86 4.233 -12.928 -7.502 1.00 0.00 O ATOM 1358 CB THR A 86 6.807 -14.610 -6.276 1.00 0.00 C ATOM 1359 OG1 THR A 86 7.626 -13.432 -6.262 1.00 0.00 O ATOM 1360 CG2 THR A 86 7.689 -15.849 -6.203 1.00 0.00 C ATOM 0 H THR A 86 6.397 -12.864 -8.561 1.00 0.00 H new ATOM 0 HA THR A 86 5.839 -15.661 -7.883 1.00 0.00 H new ATOM 0 HB THR A 86 6.147 -14.604 -5.408 1.00 0.00 H new ATOM 0 HG1 THR A 86 8.178 -13.427 -5.452 1.00 0.00 H new ATOM 0 HG21 THR A 86 8.297 -15.810 -5.299 1.00 0.00 H new ATOM 0 HG22 THR A 86 7.063 -16.741 -6.181 1.00 0.00 H new ATOM 0 HG23 THR A 86 8.340 -15.884 -7.077 1.00 0.00 H new ATOM 1368 N PRO A 87 3.676 -14.939 -6.646 1.00 0.00 N ATOM 1369 CA PRO A 87 2.297 -14.571 -6.342 1.00 0.00 C ATOM 1370 C PRO A 87 2.177 -13.713 -5.084 1.00 0.00 C ATOM 1371 O PRO A 87 3.170 -13.188 -4.564 1.00 0.00 O ATOM 1372 CB PRO A 87 1.616 -15.923 -6.138 1.00 0.00 C ATOM 1373 CG PRO A 87 2.693 -16.813 -5.624 1.00 0.00 C ATOM 1374 CD PRO A 87 3.976 -16.327 -6.245 1.00 0.00 C ATOM 0 HA PRO A 87 1.854 -13.964 -7.131 1.00 0.00 H new ATOM 0 HB2 PRO A 87 0.791 -15.848 -5.429 1.00 0.00 H new ATOM 0 HB3 PRO A 87 1.200 -16.302 -7.072 1.00 0.00 H new ATOM 0 HG2 PRO A 87 2.747 -16.770 -4.536 1.00 0.00 H new ATOM 0 HG3 PRO A 87 2.500 -17.852 -5.893 1.00 0.00 H new ATOM 0 HD2 PRO A 87 4.803 -16.368 -5.536 1.00 0.00 H new ATOM 0 HD3 PRO A 87 4.261 -16.937 -7.102 1.00 0.00 H new ATOM 1382 N ALA A 88 0.950 -13.572 -4.607 1.00 0.00 N ATOM 1383 CA ALA A 88 0.673 -12.793 -3.411 1.00 0.00 C ATOM 1384 C ALA A 88 0.699 -13.685 -2.174 1.00 0.00 C ATOM 1385 O ALA A 88 1.179 -14.819 -2.233 1.00 0.00 O ATOM 1386 CB ALA A 88 -0.673 -12.094 -3.545 1.00 0.00 C ATOM 0 H ALA A 88 0.124 -13.991 -5.034 1.00 0.00 H new ATOM 0 HA ALA A 88 1.448 -12.035 -3.297 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -0.872 -11.513 -2.645 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -0.654 -11.430 -4.409 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -1.458 -12.839 -3.677 1.00 0.00 H new ATOM 1392 N ARG A 89 0.177 -13.154 -1.065 1.00 0.00 N ATOM 1393 CA ARG A 89 0.128 -13.851 0.218 1.00 0.00 C ATOM 1394 C ARG A 89 1.503 -13.908 0.878 1.00 0.00 C ATOM 1395 O ARG A 89 2.528 -14.025 0.204 1.00 0.00 O ATOM 1396 CB ARG A 89 -0.455 -15.261 0.079 1.00 0.00 C ATOM 1397 CG ARG A 89 -1.913 -15.273 -0.343 1.00 0.00 C ATOM 1398 CD ARG A 89 -2.506 -16.668 -0.255 1.00 0.00 C ATOM 1399 NE ARG A 89 -3.948 -16.655 -0.475 1.00 0.00 N ATOM 1400 CZ ARG A 89 -4.842 -16.409 0.480 1.00 0.00 C ATOM 1401 NH1 ARG A 89 -4.447 -16.227 1.735 1.00 0.00 N ATOM 1402 NH2 ARG A 89 -6.131 -16.376 0.182 1.00 0.00 N ATOM 0 H ARG A 89 -0.227 -12.218 -1.035 1.00 0.00 H new ATOM 0 HA ARG A 89 -0.536 -13.275 0.862 1.00 0.00 H new ATOM 0 HB2 ARG A 89 0.131 -15.818 -0.652 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -0.356 -15.782 1.031 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -2.482 -14.594 0.292 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -2.000 -14.903 -1.365 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.031 -17.313 -0.994 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -2.291 -17.094 0.725 1.00 0.00 H new ATOM 0 HE ARG A 89 -4.292 -16.846 -1.416 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -3.456 -16.276 1.970 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -5.135 -16.039 2.464 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -6.437 -16.539 -0.777 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -6.818 -16.188 0.912 1.00 0.00 H new ATOM 1416 N PRO A 90 1.534 -13.808 2.215 1.00 0.00 N ATOM 1417 CA PRO A 90 2.777 -13.825 2.982 1.00 0.00 C ATOM 1418 C PRO A 90 3.452 -15.192 2.967 1.00 0.00 C ATOM 1419 O PRO A 90 2.922 -16.168 3.504 1.00 0.00 O ATOM 1420 CB PRO A 90 2.342 -13.463 4.411 1.00 0.00 C ATOM 1421 CG PRO A 90 0.941 -12.968 4.289 1.00 0.00 C ATOM 1422 CD PRO A 90 0.365 -13.656 3.089 1.00 0.00 C ATOM 0 HA PRO A 90 3.510 -13.136 2.563 1.00 0.00 H new ATOM 0 HB2 PRO A 90 2.396 -14.330 5.069 1.00 0.00 H new ATOM 0 HB3 PRO A 90 2.992 -12.699 4.837 1.00 0.00 H new ATOM 0 HG2 PRO A 90 0.366 -13.199 5.185 1.00 0.00 H new ATOM 0 HG3 PRO A 90 0.919 -11.885 4.167 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -0.076 -14.619 3.347 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -0.418 -13.062 2.618 1.00 0.00 H new ATOM 1430 N SER A 91 4.609 -15.257 2.325 1.00 0.00 N ATOM 1431 CA SER A 91 5.450 -16.442 2.364 1.00 0.00 C ATOM 1432 C SER A 91 6.204 -16.477 3.698 1.00 0.00 C ATOM 1433 O SER A 91 5.912 -15.686 4.592 1.00 0.00 O ATOM 1434 CB SER A 91 6.422 -16.427 1.176 1.00 0.00 C ATOM 1435 OG SER A 91 7.169 -17.632 1.092 1.00 0.00 O ATOM 0 H SER A 91 4.989 -14.494 1.765 1.00 0.00 H new ATOM 0 HA SER A 91 4.838 -17.340 2.286 1.00 0.00 H new ATOM 0 HB2 SER A 91 5.864 -16.280 0.251 1.00 0.00 H new ATOM 0 HB3 SER A 91 7.104 -15.582 1.275 1.00 0.00 H new ATOM 0 HG SER A 91 6.615 -18.382 1.393 1.00 0.00 H new ATOM 1441 N ALA A 92 7.178 -17.369 3.831 1.00 0.00 N ATOM 1442 CA ALA A 92 7.884 -17.543 5.098 1.00 0.00 C ATOM 1443 C ALA A 92 8.615 -16.268 5.515 1.00 0.00 C ATOM 1444 O ALA A 92 8.488 -15.821 6.653 1.00 0.00 O ATOM 1445 CB ALA A 92 8.855 -18.709 5.006 1.00 0.00 C ATOM 0 H ALA A 92 7.497 -17.982 3.081 1.00 0.00 H new ATOM 0 HA ALA A 92 7.141 -17.762 5.865 1.00 0.00 H new ATOM 0 HB1 ALA A 92 9.374 -18.826 5.957 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.306 -19.622 4.777 1.00 0.00 H new ATOM 0 HB3 ALA A 92 9.582 -18.515 4.218 1.00 0.00 H new ATOM 1451 N GLU A 93 9.363 -15.674 4.593 1.00 0.00 N ATOM 1452 CA GLU A 93 10.073 -14.434 4.889 1.00 0.00 C ATOM 1453 C GLU A 93 9.095 -13.271 4.963 1.00 0.00 C ATOM 1454 O GLU A 93 9.203 -12.412 5.835 1.00 0.00 O ATOM 1455 CB GLU A 93 11.146 -14.140 3.837 1.00 0.00 C ATOM 1456 CG GLU A 93 12.258 -15.171 3.790 1.00 0.00 C ATOM 1457 CD GLU A 93 13.440 -14.710 2.964 1.00 0.00 C ATOM 1458 OE1 GLU A 93 13.450 -14.941 1.739 1.00 0.00 O ATOM 1459 OE2 GLU A 93 14.371 -14.101 3.537 1.00 0.00 O ATOM 0 H GLU A 93 9.494 -16.025 3.644 1.00 0.00 H new ATOM 0 HA GLU A 93 10.565 -14.556 5.854 1.00 0.00 H new ATOM 0 HB2 GLU A 93 10.674 -14.084 2.856 1.00 0.00 H new ATOM 0 HB3 GLU A 93 11.580 -13.161 4.038 1.00 0.00 H new ATOM 0 HG2 GLU A 93 12.591 -15.389 4.805 1.00 0.00 H new ATOM 0 HG3 GLU A 93 11.870 -16.101 3.375 1.00 0.00 H new ATOM 1466 N ASP A 94 8.133 -13.275 4.048 1.00 0.00 N ATOM 1467 CA ASP A 94 7.126 -12.215 3.951 1.00 0.00 C ATOM 1468 C ASP A 94 6.347 -12.093 5.260 1.00 0.00 C ATOM 1469 O ASP A 94 6.143 -10.998 5.781 1.00 0.00 O ATOM 1470 CB ASP A 94 6.167 -12.536 2.797 1.00 0.00 C ATOM 1471 CG ASP A 94 5.282 -11.372 2.386 1.00 0.00 C ATOM 1472 OD1 ASP A 94 4.392 -10.982 3.163 1.00 0.00 O ATOM 1473 OD2 ASP A 94 5.456 -10.870 1.255 1.00 0.00 O ATOM 0 H ASP A 94 8.025 -14.011 3.350 1.00 0.00 H new ATOM 0 HA ASP A 94 7.625 -11.265 3.761 1.00 0.00 H new ATOM 0 HB2 ASP A 94 6.749 -12.859 1.934 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.535 -13.375 3.087 1.00 0.00 H new ATOM 1478 N LYS A 95 5.945 -13.242 5.797 1.00 0.00 N ATOM 1479 CA LYS A 95 5.201 -13.312 7.051 1.00 0.00 C ATOM 1480 C LYS A 95 5.979 -12.664 8.195 1.00 0.00 C ATOM 1481 O LYS A 95 5.417 -11.939 9.019 1.00 0.00 O ATOM 1482 CB LYS A 95 4.920 -14.782 7.398 1.00 0.00 C ATOM 1483 CG LYS A 95 4.157 -14.984 8.699 1.00 0.00 C ATOM 1484 CD LYS A 95 2.753 -14.401 8.634 1.00 0.00 C ATOM 1485 CE LYS A 95 2.037 -14.532 9.971 1.00 0.00 C ATOM 1486 NZ LYS A 95 1.902 -15.954 10.392 1.00 0.00 N ATOM 0 H LYS A 95 6.126 -14.152 5.374 1.00 0.00 H new ATOM 0 HA LYS A 95 4.265 -12.769 6.921 1.00 0.00 H new ATOM 0 HB2 LYS A 95 4.353 -15.233 6.584 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.868 -15.316 7.460 1.00 0.00 H new ATOM 0 HG2 LYS A 95 4.097 -16.049 8.922 1.00 0.00 H new ATOM 0 HG3 LYS A 95 4.706 -14.517 9.517 1.00 0.00 H new ATOM 0 HD2 LYS A 95 2.806 -13.350 8.349 1.00 0.00 H new ATOM 0 HD3 LYS A 95 2.180 -14.912 7.861 1.00 0.00 H new ATOM 0 HE2 LYS A 95 2.586 -13.979 10.733 1.00 0.00 H new ATOM 0 HE3 LYS A 95 1.048 -14.079 9.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 1.267 -16.014 11.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 1.508 -16.512 9.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 2.837 -16.330 10.649 1.00 0.00 H new ATOM 1500 N ARG A 96 7.276 -12.930 8.235 1.00 0.00 N ATOM 1501 CA ARG A 96 8.123 -12.478 9.332 1.00 0.00 C ATOM 1502 C ARG A 96 8.437 -10.989 9.219 1.00 0.00 C ATOM 1503 O ARG A 96 8.855 -10.361 10.189 1.00 0.00 O ATOM 1504 CB ARG A 96 9.405 -13.310 9.382 1.00 0.00 C ATOM 1505 CG ARG A 96 9.122 -14.790 9.566 1.00 0.00 C ATOM 1506 CD ARG A 96 10.386 -15.631 9.573 1.00 0.00 C ATOM 1507 NE ARG A 96 10.066 -17.058 9.585 1.00 0.00 N ATOM 1508 CZ ARG A 96 10.949 -18.031 9.800 1.00 0.00 C ATOM 1509 NH1 ARG A 96 12.217 -17.745 10.068 1.00 0.00 N ATOM 1510 NH2 ARG A 96 10.549 -19.296 9.765 1.00 0.00 N ATOM 0 H ARG A 96 7.769 -13.460 7.516 1.00 0.00 H new ATOM 0 HA ARG A 96 7.578 -12.621 10.265 1.00 0.00 H new ATOM 0 HB2 ARG A 96 9.968 -13.161 8.461 1.00 0.00 H new ATOM 0 HB3 ARG A 96 10.033 -12.958 10.200 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.586 -14.940 10.503 1.00 0.00 H new ATOM 0 HG3 ARG A 96 8.467 -15.133 8.765 1.00 0.00 H new ATOM 0 HD2 ARG A 96 10.988 -15.397 8.695 1.00 0.00 H new ATOM 0 HD3 ARG A 96 10.988 -15.382 10.447 1.00 0.00 H new ATOM 0 HE ARG A 96 9.097 -17.327 9.417 1.00 0.00 H new ATOM 0 HH11 ARG A 96 12.522 -16.773 10.111 1.00 0.00 H new ATOM 0 HH12 ARG A 96 12.886 -18.497 10.231 1.00 0.00 H new ATOM 0 HH21 ARG A 96 9.572 -19.517 9.574 1.00 0.00 H new ATOM 0 HH22 ARG A 96 11.219 -20.047 9.929 1.00 0.00 H new ATOM 1524 N LEU A 97 8.228 -10.427 8.034 1.00 0.00 N ATOM 1525 CA LEU A 97 8.487 -9.011 7.795 1.00 0.00 C ATOM 1526 C LEU A 97 7.293 -8.148 8.212 1.00 0.00 C ATOM 1527 O LEU A 97 7.219 -6.968 7.871 1.00 0.00 O ATOM 1528 CB LEU A 97 8.811 -8.782 6.318 1.00 0.00 C ATOM 1529 CG LEU A 97 10.109 -9.433 5.835 1.00 0.00 C ATOM 1530 CD1 LEU A 97 10.314 -9.188 4.347 1.00 0.00 C ATOM 1531 CD2 LEU A 97 11.298 -8.909 6.629 1.00 0.00 C ATOM 0 H LEU A 97 7.878 -10.933 7.220 1.00 0.00 H new ATOM 0 HA LEU A 97 9.342 -8.716 8.403 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.985 -9.162 5.717 1.00 0.00 H new ATOM 0 HB3 LEU A 97 8.870 -7.709 6.136 1.00 0.00 H new ATOM 0 HG LEU A 97 10.031 -10.508 5.998 1.00 0.00 H new ATOM 0 HD11 LEU A 97 11.243 -9.660 4.025 1.00 0.00 H new ATOM 0 HD12 LEU A 97 9.479 -9.613 3.790 1.00 0.00 H new ATOM 0 HD13 LEU A 97 10.367 -8.116 4.159 1.00 0.00 H new ATOM 0 HD21 LEU A 97 12.212 -9.383 6.271 1.00 0.00 H new ATOM 0 HD22 LEU A 97 11.375 -7.829 6.499 1.00 0.00 H new ATOM 0 HD23 LEU A 97 11.160 -9.139 7.686 1.00 0.00 H new ATOM 1543 N ALA A 98 6.370 -8.737 8.961 1.00 0.00 N ATOM 1544 CA ALA A 98 5.191 -8.032 9.428 1.00 0.00 C ATOM 1545 C ALA A 98 5.064 -8.163 10.937 1.00 0.00 C ATOM 1546 O ALA A 98 4.897 -9.264 11.466 1.00 0.00 O ATOM 1547 CB ALA A 98 3.948 -8.566 8.743 1.00 0.00 C ATOM 0 H ALA A 98 6.420 -9.711 9.259 1.00 0.00 H new ATOM 0 HA ALA A 98 5.295 -6.976 9.178 1.00 0.00 H new ATOM 0 HB1 ALA A 98 3.073 -8.026 9.105 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.039 -8.429 7.665 1.00 0.00 H new ATOM 0 HB3 ALA A 98 3.837 -9.627 8.966 1.00 0.00 H new ATOM 1553 N PHE A 99 5.158 -7.042 11.627 1.00 0.00 N ATOM 1554 CA PHE A 99 5.137 -7.044 13.086 1.00 0.00 C ATOM 1555 C PHE A 99 3.932 -6.291 13.649 1.00 0.00 C ATOM 1556 O PHE A 99 3.613 -6.430 14.830 1.00 0.00 O ATOM 1557 CB PHE A 99 6.424 -6.421 13.638 1.00 0.00 C ATOM 1558 CG PHE A 99 7.680 -7.155 13.253 1.00 0.00 C ATOM 1559 CD1 PHE A 99 8.076 -8.288 13.944 1.00 0.00 C ATOM 1560 CD2 PHE A 99 8.464 -6.710 12.199 1.00 0.00 C ATOM 1561 CE1 PHE A 99 9.229 -8.964 13.593 1.00 0.00 C ATOM 1562 CE2 PHE A 99 9.620 -7.381 11.844 1.00 0.00 C ATOM 1563 CZ PHE A 99 10.003 -8.509 12.542 1.00 0.00 C ATOM 0 H PHE A 99 5.250 -6.118 11.206 1.00 0.00 H new ATOM 0 HA PHE A 99 5.061 -8.085 13.400 1.00 0.00 H new ATOM 0 HB2 PHE A 99 6.496 -5.392 13.286 1.00 0.00 H new ATOM 0 HB3 PHE A 99 6.358 -6.382 14.725 1.00 0.00 H new ATOM 0 HD1 PHE A 99 7.476 -8.648 14.767 1.00 0.00 H new ATOM 0 HD2 PHE A 99 8.168 -5.829 11.649 1.00 0.00 H new ATOM 0 HE1 PHE A 99 9.525 -9.847 14.139 1.00 0.00 H new ATOM 0 HE2 PHE A 99 10.222 -7.023 11.022 1.00 0.00 H new ATOM 0 HZ PHE A 99 10.906 -9.035 12.267 1.00 0.00 H new ATOM 1573 N ASP A 100 3.258 -5.505 12.817 1.00 0.00 N ATOM 1574 CA ASP A 100 2.185 -4.638 13.303 1.00 0.00 C ATOM 1575 C ASP A 100 0.839 -5.016 12.695 1.00 0.00 C ATOM 1576 O ASP A 100 0.461 -4.515 11.637 1.00 0.00 O ATOM 1577 CB ASP A 100 2.490 -3.163 13.028 1.00 0.00 C ATOM 1578 CG ASP A 100 1.614 -2.238 13.856 1.00 0.00 C ATOM 1579 OD1 ASP A 100 0.511 -1.879 13.404 1.00 0.00 O ATOM 1580 OD2 ASP A 100 2.031 -1.868 14.974 1.00 0.00 O ATOM 0 H ASP A 100 3.431 -5.448 11.813 1.00 0.00 H new ATOM 0 HA ASP A 100 2.126 -4.783 14.382 1.00 0.00 H new ATOM 0 HB2 ASP A 100 3.539 -2.962 13.248 1.00 0.00 H new ATOM 0 HB3 ASP A 100 2.340 -2.953 11.969 1.00 0.00 H new ATOM 1585 N PRO A 101 0.109 -5.932 13.353 1.00 0.00 N ATOM 1586 CA PRO A 101 -1.195 -6.423 12.875 1.00 0.00 C ATOM 1587 C PRO A 101 -2.276 -5.340 12.835 1.00 0.00 C ATOM 1588 O PRO A 101 -3.398 -5.588 12.387 1.00 0.00 O ATOM 1589 CB PRO A 101 -1.571 -7.494 13.902 1.00 0.00 C ATOM 1590 CG PRO A 101 -0.795 -7.153 15.124 1.00 0.00 C ATOM 1591 CD PRO A 101 0.493 -6.561 14.630 1.00 0.00 C ATOM 0 HA PRO A 101 -1.124 -6.784 11.849 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -2.642 -7.489 14.102 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -1.319 -8.491 13.541 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -1.338 -6.444 15.749 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -0.612 -8.039 15.732 1.00 0.00 H new ATOM 0 HD2 PRO A 101 0.896 -5.832 15.333 1.00 0.00 H new ATOM 0 HD3 PRO A 101 1.258 -7.324 14.489 1.00 0.00 H new ATOM 1599 N SER A 102 -1.939 -4.148 13.306 1.00 0.00 N ATOM 1600 CA SER A 102 -2.886 -3.045 13.365 1.00 0.00 C ATOM 1601 C SER A 102 -2.938 -2.328 12.020 1.00 0.00 C ATOM 1602 O SER A 102 -3.861 -1.559 11.739 1.00 0.00 O ATOM 1603 CB SER A 102 -2.472 -2.072 14.467 1.00 0.00 C ATOM 1604 OG SER A 102 -2.112 -2.773 15.647 1.00 0.00 O ATOM 0 H SER A 102 -1.008 -3.919 13.656 1.00 0.00 H new ATOM 0 HA SER A 102 -3.879 -3.435 13.590 1.00 0.00 H new ATOM 0 HB2 SER A 102 -1.632 -1.467 14.127 1.00 0.00 H new ATOM 0 HB3 SER A 102 -3.292 -1.387 14.681 1.00 0.00 H new ATOM 0 HG SER A 102 -1.848 -2.133 16.340 1.00 0.00 H new ATOM 1610 N LEU A 103 -1.934 -2.592 11.200 1.00 0.00 N ATOM 1611 CA LEU A 103 -1.853 -2.023 9.871 1.00 0.00 C ATOM 1612 C LEU A 103 -2.208 -3.072 8.824 1.00 0.00 C ATOM 1613 O LEU A 103 -2.305 -4.262 9.130 1.00 0.00 O ATOM 1614 CB LEU A 103 -0.442 -1.486 9.619 1.00 0.00 C ATOM 1615 CG LEU A 103 -0.032 -0.287 10.478 1.00 0.00 C ATOM 1616 CD1 LEU A 103 1.414 0.100 10.201 1.00 0.00 C ATOM 1617 CD2 LEU A 103 -0.962 0.891 10.222 1.00 0.00 C ATOM 0 H LEU A 103 -1.155 -3.206 11.439 1.00 0.00 H new ATOM 0 HA LEU A 103 -2.565 -1.201 9.797 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.271 -2.293 9.788 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.361 -1.204 8.569 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.114 -0.569 11.528 1.00 0.00 H new ATOM 0 HD11 LEU A 103 1.687 0.954 10.821 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.067 -0.741 10.434 1.00 0.00 H new ATOM 0 HD13 LEU A 103 1.525 0.365 9.149 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.658 1.736 10.840 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.910 1.173 9.170 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.985 0.608 10.472 1.00 0.00 H new ATOM 1629 N SER A 104 -2.405 -2.632 7.594 1.00 0.00 N ATOM 1630 CA SER A 104 -2.720 -3.539 6.511 1.00 0.00 C ATOM 1631 C SER A 104 -1.525 -3.651 5.571 1.00 0.00 C ATOM 1632 O SER A 104 -0.917 -2.642 5.203 1.00 0.00 O ATOM 1633 CB SER A 104 -3.960 -3.054 5.754 1.00 0.00 C ATOM 1634 OG SER A 104 -4.423 -4.034 4.843 1.00 0.00 O ATOM 0 H SER A 104 -2.352 -1.650 7.323 1.00 0.00 H new ATOM 0 HA SER A 104 -2.937 -4.525 6.922 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.751 -2.812 6.464 1.00 0.00 H new ATOM 0 HB3 SER A 104 -3.724 -2.136 5.215 1.00 0.00 H new ATOM 0 HG SER A 104 -5.394 -3.952 4.739 1.00 0.00 H new ATOM 1640 N TYR A 105 -1.178 -4.876 5.209 1.00 0.00 N ATOM 1641 CA TYR A 105 -0.062 -5.122 4.315 1.00 0.00 C ATOM 1642 C TYR A 105 -0.578 -5.560 2.948 1.00 0.00 C ATOM 1643 O TYR A 105 -0.980 -6.709 2.759 1.00 0.00 O ATOM 1644 CB TYR A 105 0.870 -6.193 4.895 1.00 0.00 C ATOM 1645 CG TYR A 105 1.481 -5.824 6.233 1.00 0.00 C ATOM 1646 CD1 TYR A 105 2.644 -5.069 6.302 1.00 0.00 C ATOM 1647 CD2 TYR A 105 0.901 -6.237 7.425 1.00 0.00 C ATOM 1648 CE1 TYR A 105 3.210 -4.733 7.518 1.00 0.00 C ATOM 1649 CE2 TYR A 105 1.462 -5.906 8.646 1.00 0.00 C ATOM 1650 CZ TYR A 105 2.617 -5.155 8.687 1.00 0.00 C ATOM 1651 OH TYR A 105 3.183 -4.826 9.904 1.00 0.00 O ATOM 0 H TYR A 105 -1.658 -5.719 5.524 1.00 0.00 H new ATOM 0 HA TYR A 105 0.504 -4.197 4.204 1.00 0.00 H new ATOM 0 HB2 TYR A 105 0.312 -7.123 5.007 1.00 0.00 H new ATOM 0 HB3 TYR A 105 1.672 -6.386 4.182 1.00 0.00 H new ATOM 0 HD1 TYR A 105 3.116 -4.738 5.389 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -0.003 -6.827 7.399 1.00 0.00 H new ATOM 0 HE1 TYR A 105 4.113 -4.142 7.551 1.00 0.00 H new ATOM 0 HE2 TYR A 105 0.997 -6.235 9.563 1.00 0.00 H new ATOM 0 HH TYR A 105 3.077 -3.865 10.065 1.00 0.00 H new ATOM 1661 N LEU A 106 -0.589 -4.636 2.003 1.00 0.00 N ATOM 1662 CA LEU A 106 -1.065 -4.934 0.659 1.00 0.00 C ATOM 1663 C LEU A 106 0.020 -5.643 -0.135 1.00 0.00 C ATOM 1664 O LEU A 106 1.191 -5.253 -0.094 1.00 0.00 O ATOM 1665 CB LEU A 106 -1.505 -3.663 -0.076 1.00 0.00 C ATOM 1666 CG LEU A 106 -2.812 -3.027 0.413 1.00 0.00 C ATOM 1667 CD1 LEU A 106 -2.631 -2.366 1.771 1.00 0.00 C ATOM 1668 CD2 LEU A 106 -3.322 -2.022 -0.608 1.00 0.00 C ATOM 0 H LEU A 106 -0.275 -3.675 2.139 1.00 0.00 H new ATOM 0 HA LEU A 106 -1.933 -5.587 0.750 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -0.709 -2.923 0.009 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.611 -3.897 -1.135 1.00 0.00 H new ATOM 0 HG LEU A 106 -3.552 -3.819 0.526 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -3.575 -1.925 2.090 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.315 -3.112 2.500 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -1.873 -1.587 1.698 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.250 -1.578 -0.249 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.577 -1.239 -0.752 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.505 -2.528 -1.556 1.00 0.00 H new ATOM 1680 N ILE A 107 -0.368 -6.689 -0.846 1.00 0.00 N ATOM 1681 CA ILE A 107 0.571 -7.455 -1.652 1.00 0.00 C ATOM 1682 C ILE A 107 0.056 -7.573 -3.078 1.00 0.00 C ATOM 1683 O ILE A 107 -1.028 -8.111 -3.311 1.00 0.00 O ATOM 1684 CB ILE A 107 0.809 -8.870 -1.074 1.00 0.00 C ATOM 1685 CG1 ILE A 107 1.240 -8.785 0.391 1.00 0.00 C ATOM 1686 CG2 ILE A 107 1.863 -9.608 -1.894 1.00 0.00 C ATOM 1687 CD1 ILE A 107 1.415 -10.136 1.056 1.00 0.00 C ATOM 0 H ILE A 107 -1.329 -7.029 -0.882 1.00 0.00 H new ATOM 0 HA ILE A 107 1.521 -6.921 -1.640 1.00 0.00 H new ATOM 0 HB ILE A 107 -0.127 -9.426 -1.127 1.00 0.00 H new ATOM 0 HG12 ILE A 107 2.179 -8.236 0.452 1.00 0.00 H new ATOM 0 HG13 ILE A 107 0.498 -8.211 0.946 1.00 0.00 H new ATOM 0 HG21 ILE A 107 2.020 -10.602 -1.475 1.00 0.00 H new ATOM 0 HG22 ILE A 107 1.524 -9.698 -2.926 1.00 0.00 H new ATOM 0 HG23 ILE A 107 2.800 -9.052 -1.868 1.00 0.00 H new ATOM 0 HD11 ILE A 107 1.721 -9.994 2.092 1.00 0.00 H new ATOM 0 HD12 ILE A 107 0.471 -10.681 1.028 1.00 0.00 H new ATOM 0 HD13 ILE A 107 2.179 -10.706 0.527 1.00 0.00 H new ATOM 1699 N ILE A 108 0.824 -7.055 -4.020 1.00 0.00 N ATOM 1700 CA ILE A 108 0.451 -7.109 -5.424 1.00 0.00 C ATOM 1701 C ILE A 108 1.336 -8.109 -6.161 1.00 0.00 C ATOM 1702 O ILE A 108 2.542 -8.182 -5.920 1.00 0.00 O ATOM 1703 CB ILE A 108 0.569 -5.720 -6.094 1.00 0.00 C ATOM 1704 CG1 ILE A 108 -0.276 -4.692 -5.333 1.00 0.00 C ATOM 1705 CG2 ILE A 108 0.139 -5.786 -7.555 1.00 0.00 C ATOM 1706 CD1 ILE A 108 -0.154 -3.281 -5.869 1.00 0.00 C ATOM 0 H ILE A 108 1.713 -6.590 -3.838 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.590 -7.428 -5.480 1.00 0.00 H new ATOM 0 HB ILE A 108 1.613 -5.409 -6.061 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -1.322 -4.996 -5.372 1.00 0.00 H new ATOM 0 HG13 ILE A 108 0.019 -4.699 -4.284 1.00 0.00 H new ATOM 0 HG21 ILE A 108 0.230 -4.798 -8.006 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.776 -6.490 -8.090 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.898 -6.118 -7.615 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.781 -2.612 -5.279 1.00 0.00 H new ATOM 0 HD12 ILE A 108 0.884 -2.956 -5.805 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -0.478 -3.258 -6.910 1.00 0.00 H new ATOM 1718 N SER A 109 0.735 -8.895 -7.037 1.00 0.00 N ATOM 1719 CA SER A 109 1.483 -9.865 -7.815 1.00 0.00 C ATOM 1720 C SER A 109 1.526 -9.455 -9.286 1.00 0.00 C ATOM 1721 O SER A 109 0.490 -9.364 -9.947 1.00 0.00 O ATOM 1722 CB SER A 109 0.867 -11.260 -7.671 1.00 0.00 C ATOM 1723 OG SER A 109 1.654 -12.239 -8.334 1.00 0.00 O ATOM 0 H SER A 109 -0.267 -8.880 -7.227 1.00 0.00 H new ATOM 0 HA SER A 109 2.504 -9.895 -7.433 1.00 0.00 H new ATOM 0 HB2 SER A 109 0.779 -11.514 -6.615 1.00 0.00 H new ATOM 0 HB3 SER A 109 -0.142 -11.260 -8.084 1.00 0.00 H new ATOM 0 HG SER A 109 2.537 -12.289 -7.912 1.00 0.00 H new ATOM 1729 N LEU A 110 2.729 -9.207 -9.787 1.00 0.00 N ATOM 1730 CA LEU A 110 2.925 -8.824 -11.180 1.00 0.00 C ATOM 1731 C LEU A 110 3.348 -10.036 -12.003 1.00 0.00 C ATOM 1732 O LEU A 110 3.913 -9.905 -13.091 1.00 0.00 O ATOM 1733 CB LEU A 110 3.987 -7.724 -11.276 1.00 0.00 C ATOM 1734 CG LEU A 110 3.525 -6.418 -11.929 1.00 0.00 C ATOM 1735 CD1 LEU A 110 3.098 -6.656 -13.372 1.00 0.00 C ATOM 1736 CD2 LEU A 110 2.389 -5.792 -11.133 1.00 0.00 C ATOM 0 H LEU A 110 3.591 -9.265 -9.244 1.00 0.00 H new ATOM 0 HA LEU A 110 1.984 -8.442 -11.577 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.346 -7.501 -10.271 1.00 0.00 H new ATOM 0 HB3 LEU A 110 4.836 -8.111 -11.839 1.00 0.00 H new ATOM 0 HG LEU A 110 4.366 -5.725 -11.932 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.774 -5.715 -13.816 1.00 0.00 H new ATOM 0 HD12 LEU A 110 3.939 -7.054 -13.939 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.275 -7.370 -13.395 1.00 0.00 H new ATOM 0 HD21 LEU A 110 2.075 -4.865 -11.614 1.00 0.00 H new ATOM 0 HD22 LEU A 110 1.547 -6.484 -11.095 1.00 0.00 H new ATOM 0 HD23 LEU A 110 2.729 -5.578 -10.120 1.00 0.00 H new ATOM 1748 N ALA A 111 3.047 -11.219 -11.481 1.00 0.00 N ATOM 1749 CA ALA A 111 3.410 -12.468 -12.140 1.00 0.00 C ATOM 1750 C ALA A 111 2.564 -12.704 -13.389 1.00 0.00 C ATOM 1751 O ALA A 111 2.836 -13.612 -14.174 1.00 0.00 O ATOM 1752 CB ALA A 111 3.265 -13.636 -11.176 1.00 0.00 C ATOM 0 H ALA A 111 2.550 -11.340 -10.599 1.00 0.00 H new ATOM 0 HA ALA A 111 4.452 -12.392 -12.450 1.00 0.00 H new ATOM 0 HB1 ALA A 111 3.539 -14.562 -11.682 1.00 0.00 H new ATOM 0 HB2 ALA A 111 3.920 -13.483 -10.318 1.00 0.00 H new ATOM 0 HB3 ALA A 111 2.231 -13.701 -10.836 1.00 0.00 H new ATOM 1758 N GLU A 112 1.539 -11.879 -13.561 1.00 0.00 N ATOM 1759 CA GLU A 112 0.621 -11.997 -14.685 1.00 0.00 C ATOM 1760 C GLU A 112 -0.053 -10.646 -14.925 1.00 0.00 C ATOM 1761 O GLU A 112 -1.105 -10.355 -14.359 1.00 0.00 O ATOM 1762 CB GLU A 112 -0.406 -13.098 -14.413 1.00 0.00 C ATOM 1763 CG GLU A 112 -1.258 -13.460 -15.615 1.00 0.00 C ATOM 1764 CD GLU A 112 -2.017 -14.753 -15.408 1.00 0.00 C ATOM 1765 OE1 GLU A 112 -2.687 -14.892 -14.364 1.00 0.00 O ATOM 1766 OE2 GLU A 112 -1.945 -15.639 -16.289 1.00 0.00 O ATOM 0 H GLU A 112 1.321 -11.111 -12.926 1.00 0.00 H new ATOM 0 HA GLU A 112 1.168 -12.276 -15.586 1.00 0.00 H new ATOM 0 HB2 GLU A 112 0.117 -13.991 -14.069 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -1.059 -12.778 -13.601 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -1.964 -12.654 -15.814 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -0.622 -13.551 -16.495 1.00 0.00 H new ATOM 1773 N PRO A 113 0.584 -9.789 -15.740 1.00 0.00 N ATOM 1774 CA PRO A 113 0.234 -8.362 -15.852 1.00 0.00 C ATOM 1775 C PRO A 113 -1.071 -8.063 -16.581 1.00 0.00 C ATOM 1776 O PRO A 113 -1.486 -6.907 -16.649 1.00 0.00 O ATOM 1777 CB PRO A 113 1.412 -7.776 -16.623 1.00 0.00 C ATOM 1778 CG PRO A 113 1.928 -8.907 -17.445 1.00 0.00 C ATOM 1779 CD PRO A 113 1.710 -10.148 -16.625 1.00 0.00 C ATOM 0 HA PRO A 113 0.066 -7.939 -14.862 1.00 0.00 H new ATOM 0 HB2 PRO A 113 1.099 -6.942 -17.250 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.178 -7.396 -15.947 1.00 0.00 H new ATOM 0 HG2 PRO A 113 1.400 -8.970 -18.397 1.00 0.00 H new ATOM 0 HG3 PRO A 113 2.985 -8.772 -17.675 1.00 0.00 H new ATOM 0 HD2 PRO A 113 1.468 -11.006 -17.253 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.600 -10.412 -16.054 1.00 0.00 H new ATOM 1787 N GLN A 114 -1.709 -9.083 -17.125 1.00 0.00 N ATOM 1788 CA GLN A 114 -3.004 -8.892 -17.775 1.00 0.00 C ATOM 1789 C GLN A 114 -4.050 -8.493 -16.745 1.00 0.00 C ATOM 1790 O GLN A 114 -4.911 -7.652 -17.004 1.00 0.00 O ATOM 1791 CB GLN A 114 -3.452 -10.149 -18.519 1.00 0.00 C ATOM 1792 CG GLN A 114 -2.707 -10.380 -19.817 1.00 0.00 C ATOM 1793 CD GLN A 114 -3.395 -11.395 -20.703 1.00 0.00 C ATOM 1794 OE1 GLN A 114 -4.031 -12.340 -20.225 1.00 0.00 O ATOM 1795 NE2 GLN A 114 -3.292 -11.189 -22.004 1.00 0.00 N ATOM 0 H GLN A 114 -1.362 -10.042 -17.133 1.00 0.00 H new ATOM 0 HA GLN A 114 -2.895 -8.093 -18.509 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -3.313 -11.014 -17.871 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -4.519 -10.076 -18.730 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -2.616 -9.436 -20.354 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -1.695 -10.720 -19.597 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -2.756 -10.395 -22.354 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -3.749 -11.824 -22.659 1.00 0.00 H new ATOM 1804 N LYS A 115 -3.955 -9.107 -15.578 1.00 0.00 N ATOM 1805 CA LYS A 115 -4.789 -8.772 -14.441 1.00 0.00 C ATOM 1806 C LYS A 115 -4.030 -9.078 -13.158 1.00 0.00 C ATOM 1807 O LYS A 115 -4.201 -10.146 -12.567 1.00 0.00 O ATOM 1808 CB LYS A 115 -6.113 -9.547 -14.458 1.00 0.00 C ATOM 1809 CG LYS A 115 -7.182 -8.950 -15.366 1.00 0.00 C ATOM 1810 CD LYS A 115 -8.508 -9.685 -15.228 1.00 0.00 C ATOM 1811 CE LYS A 115 -9.606 -9.015 -16.041 1.00 0.00 C ATOM 1812 NZ LYS A 115 -10.928 -9.661 -15.828 1.00 0.00 N ATOM 0 H LYS A 115 -3.290 -9.858 -15.393 1.00 0.00 H new ATOM 0 HA LYS A 115 -5.028 -7.710 -14.495 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -5.916 -10.571 -14.774 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -6.504 -9.597 -13.442 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -7.322 -7.897 -15.121 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.847 -8.995 -16.402 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -8.389 -10.717 -15.557 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -8.800 -9.717 -14.178 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -9.669 -7.962 -15.767 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -9.349 -9.055 -17.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -11.648 -9.175 -16.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -10.876 -10.660 -16.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -11.186 -9.601 -14.822 1.00 0.00 H new ATOM 1826 N PRO A 116 -3.147 -8.161 -12.737 1.00 0.00 N ATOM 1827 CA PRO A 116 -2.334 -8.342 -11.531 1.00 0.00 C ATOM 1828 C PRO A 116 -3.207 -8.488 -10.293 1.00 0.00 C ATOM 1829 O PRO A 116 -4.182 -7.755 -10.124 1.00 0.00 O ATOM 1830 CB PRO A 116 -1.494 -7.060 -11.456 1.00 0.00 C ATOM 1831 CG PRO A 116 -2.206 -6.073 -12.316 1.00 0.00 C ATOM 1832 CD PRO A 116 -2.879 -6.872 -13.394 1.00 0.00 C ATOM 0 HA PRO A 116 -1.726 -9.246 -11.572 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -1.414 -6.702 -10.430 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -0.479 -7.233 -11.813 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -2.936 -5.506 -11.737 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -1.508 -5.352 -12.743 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -3.798 -6.395 -13.735 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -2.238 -6.991 -14.268 1.00 0.00 H new ATOM 1840 N VAL A 117 -2.873 -9.442 -9.434 1.00 0.00 N ATOM 1841 CA VAL A 117 -3.673 -9.672 -8.245 1.00 0.00 C ATOM 1842 C VAL A 117 -3.314 -8.647 -7.181 1.00 0.00 C ATOM 1843 O VAL A 117 -2.164 -8.570 -6.743 1.00 0.00 O ATOM 1844 CB VAL A 117 -3.451 -11.095 -7.683 1.00 0.00 C ATOM 1845 CG1 VAL A 117 -4.377 -11.357 -6.502 1.00 0.00 C ATOM 1846 CG2 VAL A 117 -3.655 -12.143 -8.772 1.00 0.00 C ATOM 0 H VAL A 117 -2.067 -10.058 -9.537 1.00 0.00 H new ATOM 0 HA VAL A 117 -4.723 -9.573 -8.520 1.00 0.00 H new ATOM 0 HB VAL A 117 -2.422 -11.166 -7.331 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -4.205 -12.364 -6.121 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -4.176 -10.631 -5.714 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.414 -11.264 -6.825 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -3.494 -13.137 -8.355 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -4.671 -12.072 -9.159 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -2.946 -11.970 -9.581 1.00 0.00 H new ATOM 1856 N CYS A 118 -4.298 -7.855 -6.790 1.00 0.00 N ATOM 1857 CA CYS A 118 -4.119 -6.873 -5.739 1.00 0.00 C ATOM 1858 C CYS A 118 -5.044 -7.180 -4.571 1.00 0.00 C ATOM 1859 O CYS A 118 -6.266 -7.201 -4.735 1.00 0.00 O ATOM 1860 CB CYS A 118 -4.385 -5.466 -6.275 1.00 0.00 C ATOM 1861 SG CYS A 118 -4.009 -4.141 -5.104 1.00 0.00 S ATOM 0 H CYS A 118 -5.236 -7.875 -7.190 1.00 0.00 H new ATOM 0 HA CYS A 118 -3.088 -6.920 -5.388 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -3.793 -5.316 -7.178 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -5.433 -5.392 -6.565 1.00 0.00 H new ATOM 0 HG CYS A 118 -3.447 -3.152 -5.733 1.00 0.00 H new ATOM 1867 N LYS A 119 -4.474 -7.437 -3.406 1.00 0.00 N ATOM 1868 CA LYS A 119 -5.269 -7.605 -2.199 1.00 0.00 C ATOM 1869 C LYS A 119 -4.568 -7.000 -1.001 1.00 0.00 C ATOM 1870 O LYS A 119 -3.370 -6.710 -1.036 1.00 0.00 O ATOM 1871 CB LYS A 119 -5.581 -9.074 -1.905 1.00 0.00 C ATOM 1872 CG LYS A 119 -6.690 -9.661 -2.765 1.00 0.00 C ATOM 1873 CD LYS A 119 -7.036 -11.077 -2.334 1.00 0.00 C ATOM 1874 CE LYS A 119 -8.382 -11.516 -2.891 1.00 0.00 C ATOM 1875 NZ LYS A 119 -8.404 -11.541 -4.378 1.00 0.00 N ATOM 0 H LYS A 119 -3.468 -7.534 -3.269 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.210 -7.085 -2.379 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -4.675 -9.662 -2.050 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.860 -9.171 -0.856 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -7.577 -9.031 -2.697 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -6.380 -9.663 -3.810 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -6.259 -11.762 -2.674 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -7.056 -11.133 -1.246 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -8.622 -12.509 -2.511 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -9.158 -10.841 -2.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -9.319 -11.911 -4.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -8.269 -10.577 -4.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -7.639 -12.153 -4.726 1.00 0.00 H new ATOM 1889 N SER A 120 -5.329 -6.830 0.055 1.00 0.00 N ATOM 1890 CA SER A 120 -4.822 -6.286 1.294 1.00 0.00 C ATOM 1891 C SER A 120 -4.856 -7.368 2.353 1.00 0.00 C ATOM 1892 O SER A 120 -5.920 -7.901 2.667 1.00 0.00 O ATOM 1893 CB SER A 120 -5.677 -5.096 1.724 1.00 0.00 C ATOM 1894 OG SER A 120 -5.766 -4.144 0.679 1.00 0.00 O ATOM 0 H SER A 120 -6.321 -7.066 0.079 1.00 0.00 H new ATOM 0 HA SER A 120 -3.796 -5.943 1.158 1.00 0.00 H new ATOM 0 HB2 SER A 120 -6.675 -5.438 1.998 1.00 0.00 H new ATOM 0 HB3 SER A 120 -5.245 -4.632 2.611 1.00 0.00 H new ATOM 0 HG SER A 120 -5.386 -3.292 0.979 1.00 0.00 H new ATOM 1900 N PHE A 121 -3.701 -7.721 2.881 1.00 0.00 N ATOM 1901 CA PHE A 121 -3.638 -8.761 3.879 1.00 0.00 C ATOM 1902 C PHE A 121 -3.335 -8.163 5.239 1.00 0.00 C ATOM 1903 O PHE A 121 -2.398 -7.383 5.397 1.00 0.00 O ATOM 1904 CB PHE A 121 -2.573 -9.793 3.512 1.00 0.00 C ATOM 1905 CG PHE A 121 -2.825 -10.483 2.200 1.00 0.00 C ATOM 1906 CD1 PHE A 121 -3.590 -11.635 2.146 1.00 0.00 C ATOM 1907 CD2 PHE A 121 -2.295 -9.981 1.023 1.00 0.00 C ATOM 1908 CE1 PHE A 121 -3.825 -12.271 0.941 1.00 0.00 C ATOM 1909 CE2 PHE A 121 -2.524 -10.612 -0.183 1.00 0.00 C ATOM 1910 CZ PHE A 121 -3.291 -11.759 -0.225 1.00 0.00 C ATOM 0 H PHE A 121 -2.802 -7.305 2.636 1.00 0.00 H new ATOM 0 HA PHE A 121 -4.606 -9.260 3.919 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -1.601 -9.301 3.472 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -2.519 -10.542 4.302 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -4.008 -12.042 3.055 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -1.694 -9.084 1.049 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -4.426 -13.168 0.912 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -2.104 -10.209 -1.093 1.00 0.00 H new ATOM 0 HZ PHE A 121 -3.473 -12.255 -1.167 1.00 0.00 H new ATOM 1920 N LEU A 122 -4.136 -8.520 6.215 1.00 0.00 N ATOM 1921 CA LEU A 122 -3.883 -8.115 7.575 1.00 0.00 C ATOM 1922 C LEU A 122 -3.134 -9.228 8.273 1.00 0.00 C ATOM 1923 O LEU A 122 -3.698 -10.282 8.570 1.00 0.00 O ATOM 1924 CB LEU A 122 -5.190 -7.802 8.317 1.00 0.00 C ATOM 1925 CG LEU A 122 -5.962 -6.572 7.816 1.00 0.00 C ATOM 1926 CD1 LEU A 122 -6.730 -6.884 6.537 1.00 0.00 C ATOM 1927 CD2 LEU A 122 -6.905 -6.060 8.893 1.00 0.00 C ATOM 0 H LEU A 122 -4.971 -9.092 6.090 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.287 -7.203 7.573 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -5.843 -8.672 8.247 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.962 -7.659 9.373 1.00 0.00 H new ATOM 0 HG LEU A 122 -5.236 -5.791 7.588 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -7.266 -5.994 6.208 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -6.032 -7.195 5.760 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -7.443 -7.687 6.727 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -7.444 -5.189 8.521 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -7.617 -6.842 9.155 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -6.331 -5.782 9.777 1.00 0.00 H new ATOM 1939 N ILE A 123 -1.861 -9.007 8.509 1.00 0.00 N ATOM 1940 CA ILE A 123 -1.041 -10.017 9.133 1.00 0.00 C ATOM 1941 C ILE A 123 -1.089 -9.855 10.637 1.00 0.00 C ATOM 1942 O ILE A 123 -0.530 -8.913 11.195 1.00 0.00 O ATOM 1943 CB ILE A 123 0.413 -9.957 8.628 1.00 0.00 C ATOM 1944 CG1 ILE A 123 0.435 -10.131 7.106 1.00 0.00 C ATOM 1945 CG2 ILE A 123 1.263 -11.024 9.303 1.00 0.00 C ATOM 1946 CD1 ILE A 123 1.815 -10.060 6.487 1.00 0.00 C ATOM 0 H ILE A 123 -1.374 -8.141 8.279 1.00 0.00 H new ATOM 0 HA ILE A 123 -1.439 -10.995 8.863 1.00 0.00 H new ATOM 0 HB ILE A 123 0.836 -8.985 8.881 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -0.013 -11.093 6.856 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.192 -9.361 6.656 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.286 -10.963 8.931 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.259 -10.864 10.381 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.854 -12.010 9.080 1.00 0.00 H new ATOM 0 HD11 ILE A 123 1.737 -10.193 5.408 1.00 0.00 H new ATOM 0 HD12 ILE A 123 2.260 -9.089 6.702 1.00 0.00 H new ATOM 0 HD13 ILE A 123 2.442 -10.847 6.905 1.00 0.00 H new ATOM 1958 N LYS A 124 -1.781 -10.776 11.280 1.00 0.00 N ATOM 1959 CA LYS A 124 -1.998 -10.722 12.712 1.00 0.00 C ATOM 1960 C LYS A 124 -0.984 -11.599 13.432 1.00 0.00 C ATOM 1961 O LYS A 124 -0.059 -12.135 12.817 1.00 0.00 O ATOM 1962 CB LYS A 124 -3.421 -11.186 13.046 1.00 0.00 C ATOM 1963 CG LYS A 124 -4.515 -10.386 12.352 1.00 0.00 C ATOM 1964 CD LYS A 124 -4.568 -8.955 12.859 1.00 0.00 C ATOM 1965 CE LYS A 124 -5.673 -8.159 12.185 1.00 0.00 C ATOM 1966 NZ LYS A 124 -5.805 -6.799 12.770 1.00 0.00 N ATOM 0 H LYS A 124 -2.208 -11.582 10.824 1.00 0.00 H new ATOM 0 HA LYS A 124 -1.872 -9.692 13.046 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -3.523 -12.236 12.771 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -3.568 -11.123 14.124 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -4.339 -10.385 11.276 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -5.479 -10.867 12.517 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -4.727 -8.957 13.937 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -3.609 -8.470 12.679 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -5.464 -8.078 11.118 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -6.619 -8.692 12.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -6.484 -6.245 12.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -6.144 -6.874 13.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -4.879 -6.325 12.759 1.00 0.00 H new ATOM 1980 N LYS A 125 -1.169 -11.739 14.734 1.00 0.00 N ATOM 1981 CA LYS A 125 -0.315 -12.585 15.549 1.00 0.00 C ATOM 1982 C LYS A 125 -0.489 -14.037 15.147 1.00 0.00 C ATOM 1983 O LYS A 125 0.473 -14.742 14.836 1.00 0.00 O ATOM 1984 CB LYS A 125 -0.685 -12.419 17.024 1.00 0.00 C ATOM 1985 CG LYS A 125 0.188 -13.211 17.997 1.00 0.00 C ATOM 1986 CD LYS A 125 1.537 -12.550 18.259 1.00 0.00 C ATOM 1987 CE LYS A 125 2.466 -12.613 17.056 1.00 0.00 C ATOM 1988 NZ LYS A 125 3.818 -12.090 17.379 1.00 0.00 N ATOM 0 H LYS A 125 -1.912 -11.272 15.253 1.00 0.00 H new ATOM 0 HA LYS A 125 0.724 -12.292 15.397 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -0.625 -11.362 17.282 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -1.723 -12.722 17.160 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -0.343 -13.327 18.942 1.00 0.00 H new ATOM 0 HG3 LYS A 125 0.351 -14.212 17.598 1.00 0.00 H new ATOM 0 HD2 LYS A 125 1.378 -11.508 18.536 1.00 0.00 H new ATOM 0 HD3 LYS A 125 2.016 -13.036 19.109 1.00 0.00 H new ATOM 0 HE2 LYS A 125 2.547 -13.644 16.712 1.00 0.00 H new ATOM 0 HE3 LYS A 125 2.039 -12.036 16.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 4.424 -12.149 16.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 3.743 -11.098 17.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 4.235 -12.656 18.145 1.00 0.00 H new ATOM 2002 N ASP A 126 -1.736 -14.464 15.167 1.00 0.00 N ATOM 2003 CA ASP A 126 -2.092 -15.851 14.901 1.00 0.00 C ATOM 2004 C ASP A 126 -1.921 -16.219 13.432 1.00 0.00 C ATOM 2005 O ASP A 126 -1.502 -17.332 13.112 1.00 0.00 O ATOM 2006 CB ASP A 126 -3.529 -16.113 15.342 1.00 0.00 C ATOM 2007 CG ASP A 126 -3.682 -16.033 16.844 1.00 0.00 C ATOM 2008 OD1 ASP A 126 -3.907 -14.923 17.368 1.00 0.00 O ATOM 2009 OD2 ASP A 126 -3.558 -17.084 17.509 1.00 0.00 O ATOM 0 H ASP A 126 -2.534 -13.862 15.368 1.00 0.00 H new ATOM 0 HA ASP A 126 -1.410 -16.479 15.474 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -4.191 -15.387 14.871 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -3.840 -17.099 14.998 1.00 0.00 H new ATOM 2014 N GLY A 127 -2.245 -15.295 12.542 1.00 0.00 N ATOM 2015 CA GLY A 127 -2.141 -15.581 11.125 1.00 0.00 C ATOM 2016 C GLY A 127 -2.533 -14.404 10.265 1.00 0.00 C ATOM 2017 O GLY A 127 -2.665 -13.289 10.758 1.00 0.00 O ATOM 0 H GLY A 127 -2.576 -14.358 12.772 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -1.117 -15.872 10.891 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -2.778 -16.432 10.882 1.00 0.00 H new ATOM 2021 N VAL A 128 -2.728 -14.653 8.980 1.00 0.00 N ATOM 2022 CA VAL A 128 -3.040 -13.587 8.037 1.00 0.00 C ATOM 2023 C VAL A 128 -4.512 -13.634 7.619 1.00 0.00 C ATOM 2024 O VAL A 128 -5.074 -14.708 7.386 1.00 0.00 O ATOM 2025 CB VAL A 128 -2.128 -13.660 6.786 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -2.280 -14.995 6.073 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -2.408 -12.504 5.833 1.00 0.00 C ATOM 0 H VAL A 128 -2.676 -15.583 8.565 1.00 0.00 H new ATOM 0 HA VAL A 128 -2.854 -12.640 8.544 1.00 0.00 H new ATOM 0 HB VAL A 128 -1.096 -13.575 7.126 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -1.628 -15.017 5.200 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -2.006 -15.803 6.751 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -3.315 -15.123 5.757 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -1.753 -12.581 4.965 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -3.448 -12.544 5.508 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -2.223 -11.559 6.343 1.00 0.00 H new ATOM 2037 N ASP A 129 -5.135 -12.467 7.549 1.00 0.00 N ATOM 2038 CA ASP A 129 -6.524 -12.362 7.123 1.00 0.00 C ATOM 2039 C ASP A 129 -6.622 -11.469 5.895 1.00 0.00 C ATOM 2040 O ASP A 129 -6.120 -10.346 5.900 1.00 0.00 O ATOM 2041 CB ASP A 129 -7.387 -11.800 8.255 1.00 0.00 C ATOM 2042 CG ASP A 129 -8.868 -11.912 7.963 1.00 0.00 C ATOM 2043 OD1 ASP A 129 -9.364 -13.055 7.855 1.00 0.00 O ATOM 2044 OD2 ASP A 129 -9.548 -10.867 7.875 1.00 0.00 O ATOM 0 H ASP A 129 -4.699 -11.575 7.783 1.00 0.00 H new ATOM 0 HA ASP A 129 -6.891 -13.357 6.869 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -7.161 -12.332 9.179 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -7.130 -10.753 8.419 1.00 0.00 H new ATOM 2049 N GLU A 130 -7.241 -11.973 4.840 1.00 0.00 N ATOM 2050 CA GLU A 130 -7.344 -11.237 3.595 1.00 0.00 C ATOM 2051 C GLU A 130 -8.584 -10.345 3.586 1.00 0.00 C ATOM 2052 O GLU A 130 -9.682 -10.782 3.935 1.00 0.00 O ATOM 2053 CB GLU A 130 -7.382 -12.213 2.416 1.00 0.00 C ATOM 2054 CG GLU A 130 -8.553 -13.182 2.453 1.00 0.00 C ATOM 2055 CD GLU A 130 -8.520 -14.193 1.326 1.00 0.00 C ATOM 2056 OE1 GLU A 130 -8.924 -13.847 0.193 1.00 0.00 O ATOM 2057 OE2 GLU A 130 -8.101 -15.346 1.570 1.00 0.00 O ATOM 0 H GLU A 130 -7.681 -12.893 4.823 1.00 0.00 H new ATOM 0 HA GLU A 130 -6.468 -10.595 3.500 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -7.424 -11.644 1.487 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -6.453 -12.783 2.399 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -8.551 -13.709 3.407 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -9.485 -12.619 2.402 1.00 0.00 H new ATOM 2064 N GLU A 131 -8.399 -9.091 3.198 1.00 0.00 N ATOM 2065 CA GLU A 131 -9.511 -8.162 3.063 1.00 0.00 C ATOM 2066 C GLU A 131 -9.728 -7.843 1.588 1.00 0.00 C ATOM 2067 O GLU A 131 -8.852 -8.102 0.758 1.00 0.00 O ATOM 2068 CB GLU A 131 -9.249 -6.882 3.865 1.00 0.00 C ATOM 2069 CG GLU A 131 -10.497 -6.034 4.080 1.00 0.00 C ATOM 2070 CD GLU A 131 -10.288 -4.922 5.085 1.00 0.00 C ATOM 2071 OE1 GLU A 131 -10.330 -5.205 6.300 1.00 0.00 O ATOM 2072 OE2 GLU A 131 -10.105 -3.757 4.666 1.00 0.00 O ATOM 0 H GLU A 131 -7.488 -8.693 2.971 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.413 -8.624 3.463 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -8.830 -7.150 4.835 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -8.498 -6.285 3.347 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -10.806 -5.603 3.128 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -11.311 -6.675 4.419 1.00 0.00 H new ATOM 2079 N GLU A 132 -10.882 -7.281 1.261 1.00 0.00 N ATOM 2080 CA GLU A 132 -11.237 -7.058 -0.129 1.00 0.00 C ATOM 2081 C GLU A 132 -11.154 -5.579 -0.483 1.00 0.00 C ATOM 2082 O GLU A 132 -11.518 -4.715 0.318 1.00 0.00 O ATOM 2083 CB GLU A 132 -12.636 -7.606 -0.409 1.00 0.00 C ATOM 2084 CG GLU A 132 -13.052 -7.514 -1.864 1.00 0.00 C ATOM 2085 CD GLU A 132 -14.278 -8.347 -2.161 1.00 0.00 C ATOM 2086 OE1 GLU A 132 -15.396 -7.921 -1.806 1.00 0.00 O ATOM 2087 OE2 GLU A 132 -14.127 -9.445 -2.735 1.00 0.00 O ATOM 0 H GLU A 132 -11.583 -6.974 1.935 1.00 0.00 H new ATOM 0 HA GLU A 132 -10.522 -7.590 -0.757 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.677 -8.649 -0.095 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.357 -7.061 0.200 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.252 -6.473 -2.118 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -12.228 -7.844 -2.497 1.00 0.00 H new ATOM 2094 N ILE A 133 -10.662 -5.300 -1.684 1.00 0.00 N ATOM 2095 CA ILE A 133 -10.494 -3.933 -2.148 1.00 0.00 C ATOM 2096 C ILE A 133 -11.604 -3.561 -3.120 1.00 0.00 C ATOM 2097 O ILE A 133 -11.892 -4.303 -4.059 1.00 0.00 O ATOM 2098 CB ILE A 133 -9.132 -3.736 -2.848 1.00 0.00 C ATOM 2099 CG1 ILE A 133 -7.998 -4.272 -1.972 1.00 0.00 C ATOM 2100 CG2 ILE A 133 -8.907 -2.264 -3.165 1.00 0.00 C ATOM 2101 CD1 ILE A 133 -6.627 -4.139 -2.599 1.00 0.00 C ATOM 0 H ILE A 133 -10.371 -6.010 -2.357 1.00 0.00 H new ATOM 0 HA ILE A 133 -10.536 -3.288 -1.271 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.140 -4.295 -3.784 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -8.005 -3.741 -1.020 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -8.187 -5.323 -1.753 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -7.943 -2.141 -3.658 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -9.699 -1.908 -3.824 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.918 -1.687 -2.240 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -5.875 -4.540 -1.919 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -6.601 -4.693 -3.537 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -6.416 -3.087 -2.793 1.00 0.00 H new ATOM 2113 N ILE A 134 -12.232 -2.422 -2.884 1.00 0.00 N ATOM 2114 CA ILE A 134 -13.252 -1.913 -3.785 1.00 0.00 C ATOM 2115 C ILE A 134 -12.651 -0.828 -4.673 1.00 0.00 C ATOM 2116 O ILE A 134 -12.110 0.163 -4.177 1.00 0.00 O ATOM 2117 CB ILE A 134 -14.491 -1.365 -3.023 1.00 0.00 C ATOM 2118 CG1 ILE A 134 -15.372 -2.512 -2.497 1.00 0.00 C ATOM 2119 CG2 ILE A 134 -15.314 -0.447 -3.914 1.00 0.00 C ATOM 2120 CD1 ILE A 134 -14.710 -3.398 -1.462 1.00 0.00 C ATOM 0 H ILE A 134 -12.053 -1.830 -2.073 1.00 0.00 H new ATOM 0 HA ILE A 134 -13.600 -2.743 -4.400 1.00 0.00 H new ATOM 0 HB ILE A 134 -14.124 -0.792 -2.172 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -16.278 -2.087 -2.065 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -15.681 -3.130 -3.340 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -16.175 -0.077 -3.358 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -14.700 0.394 -4.235 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -15.657 -1.000 -4.788 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -15.406 -4.177 -1.151 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -13.820 -3.858 -1.892 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -14.427 -2.798 -0.597 1.00 0.00 H new ATOM 2132 N LEU A 135 -12.735 -1.033 -5.982 1.00 0.00 N ATOM 2133 CA LEU A 135 -12.102 -0.142 -6.942 1.00 0.00 C ATOM 2134 C LEU A 135 -13.121 0.761 -7.625 1.00 0.00 C ATOM 2135 O LEU A 135 -14.183 0.304 -8.055 1.00 0.00 O ATOM 2136 CB LEU A 135 -11.355 -0.964 -7.997 1.00 0.00 C ATOM 2137 CG LEU A 135 -10.290 -1.917 -7.452 1.00 0.00 C ATOM 2138 CD1 LEU A 135 -9.664 -2.718 -8.581 1.00 0.00 C ATOM 2139 CD2 LEU A 135 -9.221 -1.148 -6.695 1.00 0.00 C ATOM 0 H LEU A 135 -13.239 -1.814 -6.403 1.00 0.00 H new ATOM 0 HA LEU A 135 -11.400 0.491 -6.399 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -12.083 -1.545 -8.563 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -10.880 -0.278 -8.698 1.00 0.00 H new ATOM 0 HG LEU A 135 -10.772 -2.609 -6.761 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -8.909 -3.391 -8.175 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -10.435 -3.301 -9.085 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -9.198 -2.038 -9.295 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -8.473 -1.844 -6.315 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -8.744 -0.432 -7.365 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -9.678 -0.615 -5.861 1.00 0.00 H new ATOM 2151 N LYS A 136 -12.792 2.044 -7.705 1.00 0.00 N ATOM 2152 CA LYS A 136 -13.585 3.007 -8.462 1.00 0.00 C ATOM 2153 C LYS A 136 -12.775 3.538 -9.637 1.00 0.00 C ATOM 2154 O LYS A 136 -11.549 3.591 -9.573 1.00 0.00 O ATOM 2155 CB LYS A 136 -14.019 4.188 -7.588 1.00 0.00 C ATOM 2156 CG LYS A 136 -15.258 3.937 -6.743 1.00 0.00 C ATOM 2157 CD LYS A 136 -14.932 3.249 -5.430 1.00 0.00 C ATOM 2158 CE LYS A 136 -16.154 3.190 -4.525 1.00 0.00 C ATOM 2159 NZ LYS A 136 -16.725 4.541 -4.264 1.00 0.00 N ATOM 0 H LYS A 136 -11.972 2.446 -7.250 1.00 0.00 H new ATOM 0 HA LYS A 136 -14.476 2.490 -8.819 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -13.194 4.455 -6.927 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -14.204 5.049 -8.231 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -15.754 4.886 -6.540 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -15.961 3.324 -7.307 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -14.571 2.239 -5.625 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -14.127 3.784 -4.925 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -16.914 2.558 -4.984 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -15.881 2.723 -3.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -17.302 4.513 -3.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -15.953 5.227 -4.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -17.320 4.828 -5.067 1.00 0.00 H new ATOM 2173 N GLU A 137 -13.458 3.935 -10.704 1.00 0.00 N ATOM 2174 CA GLU A 137 -12.785 4.524 -11.859 1.00 0.00 C ATOM 2175 C GLU A 137 -12.475 5.994 -11.616 1.00 0.00 C ATOM 2176 O GLU A 137 -11.541 6.550 -12.192 1.00 0.00 O ATOM 2177 CB GLU A 137 -13.634 4.375 -13.124 1.00 0.00 C ATOM 2178 CG GLU A 137 -13.418 3.067 -13.877 1.00 0.00 C ATOM 2179 CD GLU A 137 -13.789 1.843 -13.063 1.00 0.00 C ATOM 2180 OE1 GLU A 137 -14.989 1.496 -13.025 1.00 0.00 O ATOM 2181 OE2 GLU A 137 -12.886 1.217 -12.472 1.00 0.00 O ATOM 0 H GLU A 137 -14.471 3.861 -10.795 1.00 0.00 H new ATOM 0 HA GLU A 137 -11.848 3.987 -12.002 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -14.687 4.454 -12.852 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -13.415 5.206 -13.794 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -14.010 3.080 -14.792 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -12.372 2.995 -14.174 1.00 0.00 H new ATOM 2188 N GLU A 138 -13.257 6.604 -10.750 1.00 0.00 N ATOM 2189 CA GLU A 138 -13.097 8.011 -10.423 1.00 0.00 C ATOM 2190 C GLU A 138 -12.690 8.155 -8.963 1.00 0.00 C ATOM 2191 O GLU A 138 -12.959 7.268 -8.157 1.00 0.00 O ATOM 2192 CB GLU A 138 -14.402 8.767 -10.697 1.00 0.00 C ATOM 2193 CG GLU A 138 -14.336 10.255 -10.385 1.00 0.00 C ATOM 2194 CD GLU A 138 -15.600 10.988 -10.775 1.00 0.00 C ATOM 2195 OE1 GLU A 138 -16.543 11.044 -9.959 1.00 0.00 O ATOM 2196 OE2 GLU A 138 -15.652 11.519 -11.903 1.00 0.00 O ATOM 0 H GLU A 138 -14.019 6.143 -10.253 1.00 0.00 H new ATOM 0 HA GLU A 138 -12.314 8.440 -11.049 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -14.670 8.638 -11.746 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -15.200 8.318 -10.106 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -14.156 10.391 -9.319 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -13.488 10.695 -10.910 1.00 0.00 H new ATOM 2203 N LEU A 139 -12.028 9.260 -8.634 1.00 0.00 N ATOM 2204 CA LEU A 139 -11.626 9.533 -7.260 1.00 0.00 C ATOM 2205 C LEU A 139 -12.845 9.626 -6.354 1.00 0.00 C ATOM 2206 O LEU A 139 -13.942 9.963 -6.804 1.00 0.00 O ATOM 2207 CB LEU A 139 -10.821 10.829 -7.178 1.00 0.00 C ATOM 2208 CG LEU A 139 -9.453 10.790 -7.860 1.00 0.00 C ATOM 2209 CD1 LEU A 139 -8.774 12.146 -7.767 1.00 0.00 C ATOM 2210 CD2 LEU A 139 -8.576 9.716 -7.237 1.00 0.00 C ATOM 0 H LEU A 139 -11.759 9.982 -9.302 1.00 0.00 H new ATOM 0 HA LEU A 139 -10.998 8.708 -6.924 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -11.409 11.632 -7.624 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -10.678 11.084 -6.128 1.00 0.00 H new ATOM 0 HG LEU A 139 -9.601 10.547 -8.912 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -7.802 12.100 -8.257 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -9.393 12.897 -8.258 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -8.640 12.415 -6.719 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -7.607 9.703 -7.735 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -8.436 9.930 -6.177 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -9.055 8.744 -7.351 1.00 0.00 H new