USER MOD reduce.3.24.130724 H: found=0, std=0, add=1156, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1156 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 23 ASN : amide:sc= -0.857 K(o=-2.8,f=-0.73) USER MOD Set 1.2: A 101 HIS : no HD1:sc= -1.52 K(o=-2.8,f=-8.5!) USER MOD Set 1.3: A 115 CYS SG : rot 9:sc= -0.406 USER MOD Set 2.1: A 88 THR OG1 : rot 180:sc= 0.144 USER MOD Set 2.2: A 104 ASN : amide:sc= -0.186 K(o=-0.042,f=-5.6!) USER MOD Set 3.1: A 83 HIS : no HD1:sc= -0.174 K(o=-1.3,f=-0.13) USER MOD Set 3.2: A 85 MET CE :methyl -126:sc= -1.09 (180deg=-0.453) USER MOD Set 4.1: A 54 SER OG : rot -20:sc= 0.178 USER MOD Set 4.2: A 57 LYS NZ :NH3+ -126:sc= 0.865 (180deg=-0.5) USER MOD Set 5.1: A 20 THR OG1 : rot -167:sc= 0.694 USER MOD Set 5.2: A 117 ASN : amide:sc= -2.21 K(o=-1.5,f=0.011) USER MOD Set 6.1: A 17 TYR OH : rot 180:sc= 0 USER MOD Set 6.2: A 21 GLN : amide:sc= -0.199 K(o=-0.2,f=0.31) USER MOD Set 7.1: A 13 ASN : amide:sc= -3.85! X(o=-7.3!,f=-7.1) USER MOD Set 7.2: A 98 HIS : no HD1:sc= -3.43! C(o=-7.3!,f=-7.1!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 147:sc= 0.0709 (180deg=0) USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= -0.483 K(o=-0.48,f=-8.6!) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 173:sc=-0.00145 (180deg=-0.038) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 89:sc= 0.562 USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= 0.387 K(o=0.39,f=-1.8) USER MOD Single : A 22 ASN : amide:sc= -0.163 K(o=-0.16,f=-3.4!) USER MOD Single : A 25 THR OG1 : rot 38:sc= 0.00959 USER MOD Single : A 30 GLN : amide:sc= -0.405 K(o=-0.41,f=-3.8!) USER MOD Single : A 31 ASN : amide:sc= -0.445 K(o=-0.44,f=-2!) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 HIS : no HE2:sc= 0.155 K(o=0.15,f=-0.69) USER MOD Single : A 37 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0592) USER MOD Single : A 42 TYR OH : rot 180:sc= -0.0845 USER MOD Single : A 47 SER OG : rot -36:sc= 0.473 USER MOD Single : A 49 LYS NZ :NH3+ 157:sc= 0.714 (180deg=0.403) USER MOD Single : A 53 THR OG1 : rot 49:sc= 1.65 USER MOD Single : A 55 LYS NZ :NH3+ 135:sc= 1.3 (180deg=0.555) USER MOD Single : A 60 SER OG : rot -140:sc= 0.496 USER MOD Single : A 61 GLN : amide:sc= 0.0625 K(o=0.063,f=-1.3) USER MOD Single : A 62 CYS SG : rot -24:sc= 0.115 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0.00472 USER MOD Single : A 69 LYS NZ :NH3+ 149:sc= -0.75 (180deg=-2.13!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 95:sc= 0.668 USER MOD Single : A 92 SER OG : rot 180:sc= 0.116 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 110 ASN : amide:sc= -3.3! C(o=-3.3!,f=-7.8!) USER MOD Single : A 114 TYR OH : rot -80:sc= -1.85! USER MOD Single : A 118 SER OG : rot 130:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00747) USER MOD Single : A 127 HIS : no HD1:sc=-0.00771 X(o=-0.0077,f=-0.019) USER MOD Single : A 128 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0101) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 90:sc= 0.304 USER MOD Single : A 137 TYR OH : rot -140:sc= -0.165 USER MOD Single : A 139 HIS : no HD1:sc= 0 X(o=0,f=-0.0057) USER MOD Single : A 142 ASN : amide:sc= -0.514 X(o=-0.51,f=-0.084) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 147 HIS : no HD1:sc= -0.0845 X(o=-0.084,f=-0.0012) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -18.619 12.856 17.387 1.00 0.00 N ATOM 2 CA MET A 1 -19.451 12.183 16.361 1.00 0.00 C ATOM 3 C MET A 1 -18.748 10.918 15.860 1.00 0.00 C ATOM 4 O MET A 1 -17.511 10.847 15.886 1.00 0.00 O ATOM 5 CB MET A 1 -19.766 13.147 15.180 1.00 0.00 C ATOM 6 CG MET A 1 -20.629 12.533 14.056 1.00 0.00 C ATOM 7 SD MET A 1 -22.150 11.784 14.682 1.00 0.00 S ATOM 8 CE MET A 1 -22.906 11.109 13.204 1.00 0.00 C ATOM 0 H1 MET A 1 -18.754 13.885 17.323 1.00 0.00 H new ATOM 0 H2 MET A 1 -18.901 12.528 18.333 1.00 0.00 H new ATOM 0 H3 MET A 1 -17.617 12.628 17.226 1.00 0.00 H new ATOM 0 HA MET A 1 -20.399 11.897 16.817 1.00 0.00 H new ATOM 0 HB2 MET A 1 -20.278 14.026 15.573 1.00 0.00 H new ATOM 0 HB3 MET A 1 -18.826 13.492 14.750 1.00 0.00 H new ATOM 0 HG2 MET A 1 -20.881 13.307 13.331 1.00 0.00 H new ATOM 0 HG3 MET A 1 -20.047 11.778 13.527 1.00 0.00 H new ATOM 0 HE1 MET A 1 -23.847 10.624 13.465 1.00 0.00 H new ATOM 0 HE2 MET A 1 -23.097 11.913 12.493 1.00 0.00 H new ATOM 0 HE3 MET A 1 -22.235 10.378 12.753 1.00 0.00 H new ATOM 20 N ALA A 2 -19.568 9.917 15.446 1.00 0.00 N ATOM 21 CA ALA A 2 -19.103 8.707 14.747 1.00 0.00 C ATOM 22 C ALA A 2 -18.298 9.131 13.512 1.00 0.00 C ATOM 23 O ALA A 2 -18.802 9.926 12.702 1.00 0.00 O ATOM 24 CB ALA A 2 -20.304 7.820 14.355 1.00 0.00 C ATOM 0 H ALA A 2 -20.577 9.935 15.593 1.00 0.00 H new ATOM 0 HA ALA A 2 -18.463 8.118 15.404 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -19.945 6.929 13.839 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -20.847 7.525 15.253 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -20.969 8.378 13.696 1.00 0.00 H new ATOM 30 N TYR A 3 -17.043 8.647 13.411 1.00 0.00 N ATOM 31 CA TYR A 3 -16.074 9.124 12.406 1.00 0.00 C ATOM 32 C TYR A 3 -16.623 8.999 10.974 1.00 0.00 C ATOM 33 O TYR A 3 -16.795 7.889 10.452 1.00 0.00 O ATOM 34 CB TYR A 3 -14.721 8.381 12.543 1.00 0.00 C ATOM 35 CG TYR A 3 -14.037 8.600 13.906 1.00 0.00 C ATOM 36 CD1 TYR A 3 -13.778 9.898 14.378 1.00 0.00 C ATOM 37 CD2 TYR A 3 -13.677 7.527 14.734 1.00 0.00 C ATOM 38 CE1 TYR A 3 -13.185 10.109 15.607 1.00 0.00 C ATOM 39 CE2 TYR A 3 -13.086 7.743 15.968 1.00 0.00 C ATOM 40 CZ TYR A 3 -12.844 9.034 16.397 1.00 0.00 C ATOM 41 OH TYR A 3 -12.258 9.255 17.623 1.00 0.00 O ATOM 0 H TYR A 3 -16.675 7.918 14.022 1.00 0.00 H new ATOM 0 HA TYR A 3 -15.906 10.183 12.599 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -14.885 7.314 12.394 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -14.050 8.714 11.751 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -14.048 10.747 13.768 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -13.864 6.516 14.404 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -12.989 11.115 15.948 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -12.815 6.905 16.593 1.00 0.00 H new ATOM 0 HH TYR A 3 -12.079 8.396 18.060 1.00 0.00 H new ATOM 51 N ASN A 4 -16.972 10.163 10.409 1.00 0.00 N ATOM 52 CA ASN A 4 -17.346 10.318 8.995 1.00 0.00 C ATOM 53 C ASN A 4 -16.083 10.140 8.142 1.00 0.00 C ATOM 54 O ASN A 4 -14.971 10.337 8.639 1.00 0.00 O ATOM 55 CB ASN A 4 -17.972 11.733 8.795 1.00 0.00 C ATOM 56 CG ASN A 4 -18.673 11.979 7.444 1.00 0.00 C ATOM 57 OD1 ASN A 4 -18.296 11.441 6.403 1.00 0.00 O ATOM 58 ND2 ASN A 4 -19.701 12.811 7.452 1.00 0.00 N ATOM 0 H ASN A 4 -17.003 11.039 10.930 1.00 0.00 H new ATOM 0 HA ASN A 4 -18.082 9.572 8.693 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -18.695 11.905 9.593 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -17.184 12.477 8.913 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -20.197 13.017 6.585 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -19.998 13.247 8.325 1.00 0.00 H new ATOM 65 N LYS A 5 -16.259 9.745 6.877 1.00 0.00 N ATOM 66 CA LYS A 5 -15.164 9.672 5.895 1.00 0.00 C ATOM 67 C LYS A 5 -14.469 11.041 5.762 1.00 0.00 C ATOM 68 O LYS A 5 -13.272 11.103 5.549 1.00 0.00 O ATOM 69 CB LYS A 5 -15.714 9.235 4.522 1.00 0.00 C ATOM 70 CG LYS A 5 -16.361 7.838 4.500 1.00 0.00 C ATOM 71 CD LYS A 5 -17.075 7.538 3.163 1.00 0.00 C ATOM 72 CE LYS A 5 -18.216 8.536 2.872 1.00 0.00 C ATOM 73 NZ LYS A 5 -18.830 8.322 1.542 1.00 0.00 N ATOM 0 H LYS A 5 -17.165 9.466 6.501 1.00 0.00 H new ATOM 0 HA LYS A 5 -14.436 8.938 6.242 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -16.452 9.967 4.192 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -14.900 9.254 3.797 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -15.595 7.083 4.676 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -17.079 7.760 5.317 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -16.349 7.572 2.350 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -17.478 6.526 3.188 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -18.982 8.442 3.642 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -17.829 9.553 2.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -19.590 9.016 1.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -18.107 8.438 0.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -19.225 7.361 1.492 1.00 0.00 H new ATOM 87 N GLU A 6 -15.251 12.128 5.902 1.00 0.00 N ATOM 88 CA GLU A 6 -14.735 13.513 5.885 1.00 0.00 C ATOM 89 C GLU A 6 -13.758 13.748 7.064 1.00 0.00 C ATOM 90 O GLU A 6 -12.636 14.232 6.871 1.00 0.00 O ATOM 91 CB GLU A 6 -15.922 14.514 5.957 1.00 0.00 C ATOM 92 CG GLU A 6 -16.981 14.311 4.855 1.00 0.00 C ATOM 93 CD GLU A 6 -18.149 15.313 4.927 1.00 0.00 C ATOM 94 OE1 GLU A 6 -18.979 15.220 5.856 1.00 0.00 O ATOM 95 OE2 GLU A 6 -18.250 16.192 4.046 1.00 0.00 O ATOM 0 H GLU A 6 -16.261 12.072 6.031 1.00 0.00 H new ATOM 0 HA GLU A 6 -14.188 13.673 4.956 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -16.403 14.422 6.931 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -15.532 15.530 5.889 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -16.500 14.397 3.881 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -17.378 13.298 4.927 1.00 0.00 H new ATOM 102 N GLU A 7 -14.222 13.377 8.276 1.00 0.00 N ATOM 103 CA GLU A 7 -13.440 13.477 9.535 1.00 0.00 C ATOM 104 C GLU A 7 -12.182 12.597 9.483 1.00 0.00 C ATOM 105 O GLU A 7 -11.112 12.992 9.965 1.00 0.00 O ATOM 106 CB GLU A 7 -14.304 13.062 10.755 1.00 0.00 C ATOM 107 CG GLU A 7 -15.602 13.869 10.919 1.00 0.00 C ATOM 108 CD GLU A 7 -16.337 13.565 12.235 1.00 0.00 C ATOM 109 OE1 GLU A 7 -17.184 12.646 12.269 1.00 0.00 O ATOM 110 OE2 GLU A 7 -16.071 14.255 13.242 1.00 0.00 O ATOM 0 H GLU A 7 -15.158 12.996 8.414 1.00 0.00 H new ATOM 0 HA GLU A 7 -13.137 14.518 9.644 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -14.557 12.006 10.663 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -13.707 13.169 11.661 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -15.369 14.933 10.877 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -16.265 13.654 10.081 1.00 0.00 H new ATOM 117 N LYS A 8 -12.337 11.405 8.879 1.00 0.00 N ATOM 118 CA LYS A 8 -11.278 10.407 8.767 1.00 0.00 C ATOM 119 C LYS A 8 -10.177 10.940 7.847 1.00 0.00 C ATOM 120 O LYS A 8 -9.078 11.173 8.296 1.00 0.00 O ATOM 121 CB LYS A 8 -11.854 9.064 8.223 1.00 0.00 C ATOM 122 CG LYS A 8 -10.838 7.904 8.115 1.00 0.00 C ATOM 123 CD LYS A 8 -10.239 7.479 9.479 1.00 0.00 C ATOM 124 CE LYS A 8 -11.293 6.934 10.463 1.00 0.00 C ATOM 125 NZ LYS A 8 -11.983 5.725 9.936 1.00 0.00 N ATOM 0 H LYS A 8 -13.216 11.112 8.452 1.00 0.00 H new ATOM 0 HA LYS A 8 -10.854 10.214 9.752 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -12.672 8.749 8.871 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -12.281 9.244 7.236 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -11.328 7.044 7.658 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -10.029 8.201 7.448 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -9.478 6.716 9.312 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -9.738 8.335 9.931 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -10.812 6.691 11.410 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -12.030 7.710 10.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -12.595 5.325 10.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -12.561 5.987 9.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -11.276 5.018 9.652 1.00 0.00 H new ATOM 139 N ILE A 9 -10.544 11.214 6.589 1.00 0.00 N ATOM 140 CA ILE A 9 -9.614 11.643 5.522 1.00 0.00 C ATOM 141 C ILE A 9 -8.828 12.903 5.909 1.00 0.00 C ATOM 142 O ILE A 9 -7.633 12.989 5.648 1.00 0.00 O ATOM 143 CB ILE A 9 -10.366 11.855 4.143 1.00 0.00 C ATOM 144 CG1 ILE A 9 -10.924 10.496 3.613 1.00 0.00 C ATOM 145 CG2 ILE A 9 -9.470 12.533 3.068 1.00 0.00 C ATOM 146 CD1 ILE A 9 -9.865 9.442 3.401 1.00 0.00 C ATOM 0 H ILE A 9 -11.511 11.144 6.272 1.00 0.00 H new ATOM 0 HA ILE A 9 -8.895 10.834 5.396 1.00 0.00 H new ATOM 0 HB ILE A 9 -11.196 12.535 4.335 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -11.663 10.118 4.319 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -11.443 10.670 2.671 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -10.037 12.653 2.145 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -9.149 13.511 3.426 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -8.595 11.911 2.878 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -10.330 8.528 3.032 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -9.138 9.799 2.672 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -9.361 9.237 4.346 1.00 0.00 H new ATOM 158 N LYS A 10 -9.480 13.854 6.579 1.00 0.00 N ATOM 159 CA LYS A 10 -8.830 15.120 6.938 1.00 0.00 C ATOM 160 C LYS A 10 -7.706 14.874 7.962 1.00 0.00 C ATOM 161 O LYS A 10 -6.554 15.267 7.732 1.00 0.00 O ATOM 162 CB LYS A 10 -9.853 16.160 7.469 1.00 0.00 C ATOM 163 CG LYS A 10 -9.209 17.506 7.883 1.00 0.00 C ATOM 164 CD LYS A 10 -8.422 18.183 6.731 1.00 0.00 C ATOM 165 CE LYS A 10 -7.538 19.341 7.221 1.00 0.00 C ATOM 166 NZ LYS A 10 -8.322 20.443 7.828 1.00 0.00 N ATOM 0 H LYS A 10 -10.450 13.775 6.883 1.00 0.00 H new ATOM 0 HA LYS A 10 -8.388 15.538 6.033 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -10.602 16.346 6.699 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -10.376 15.738 8.327 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -9.989 18.184 8.230 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -8.537 17.337 8.724 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -7.798 17.439 6.235 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -9.125 18.557 5.986 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -6.824 18.963 7.953 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -6.960 19.731 6.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -7.677 21.197 8.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -8.986 20.825 7.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -8.854 20.081 8.645 1.00 0.00 H new ATOM 180 N SER A 11 -8.052 14.177 9.047 1.00 0.00 N ATOM 181 CA SER A 11 -7.115 13.873 10.135 1.00 0.00 C ATOM 182 C SER A 11 -6.014 12.912 9.642 1.00 0.00 C ATOM 183 O SER A 11 -4.826 13.244 9.666 1.00 0.00 O ATOM 184 CB SER A 11 -7.896 13.250 11.312 1.00 0.00 C ATOM 185 OG SER A 11 -8.987 14.076 11.697 1.00 0.00 O ATOM 0 H SER A 11 -8.990 13.806 9.198 1.00 0.00 H new ATOM 0 HA SER A 11 -6.633 14.791 10.470 1.00 0.00 H new ATOM 0 HB2 SER A 11 -8.265 12.265 11.027 1.00 0.00 H new ATOM 0 HB3 SER A 11 -7.227 13.107 12.161 1.00 0.00 H new ATOM 0 HG SER A 11 -9.781 13.834 11.175 1.00 0.00 H new ATOM 191 N LEU A 12 -6.454 11.724 9.194 1.00 0.00 N ATOM 192 CA LEU A 12 -5.603 10.612 8.712 1.00 0.00 C ATOM 193 C LEU A 12 -4.576 11.004 7.631 1.00 0.00 C ATOM 194 O LEU A 12 -3.404 10.608 7.705 1.00 0.00 O ATOM 195 CB LEU A 12 -6.561 9.533 8.150 1.00 0.00 C ATOM 196 CG LEU A 12 -5.945 8.296 7.450 1.00 0.00 C ATOM 197 CD1 LEU A 12 -5.061 7.476 8.407 1.00 0.00 C ATOM 198 CD2 LEU A 12 -7.058 7.448 6.800 1.00 0.00 C ATOM 0 H LEU A 12 -7.448 11.499 9.154 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.003 10.261 9.552 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -7.179 9.175 8.974 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.229 10.019 7.439 1.00 0.00 H new ATOM 0 HG LEU A 12 -5.282 8.641 6.656 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -4.649 6.618 7.876 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -4.247 8.100 8.775 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -5.661 7.128 9.248 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.615 6.581 6.310 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -7.756 7.114 7.567 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.590 8.049 6.062 1.00 0.00 H new ATOM 210 N ASN A 13 -5.026 11.767 6.620 1.00 0.00 N ATOM 211 CA ASN A 13 -4.204 12.049 5.417 1.00 0.00 C ATOM 212 C ASN A 13 -3.174 13.156 5.684 1.00 0.00 C ATOM 213 O ASN A 13 -2.535 13.617 4.764 1.00 0.00 O ATOM 214 CB ASN A 13 -5.079 12.376 4.173 1.00 0.00 C ATOM 215 CG ASN A 13 -5.977 11.217 3.688 1.00 0.00 C ATOM 216 OD1 ASN A 13 -6.238 11.087 2.496 1.00 0.00 O ATOM 217 ND2 ASN A 13 -6.503 10.390 4.588 1.00 0.00 N ATOM 0 H ASN A 13 -5.949 12.200 6.606 1.00 0.00 H new ATOM 0 HA ASN A 13 -3.655 11.135 5.189 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -5.711 13.233 4.406 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -4.424 12.676 3.355 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -7.128 9.641 4.289 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -6.281 10.505 5.577 1.00 0.00 H new ATOM 224 N ARG A 14 -3.036 13.592 6.944 1.00 0.00 N ATOM 225 CA ARG A 14 -1.832 14.310 7.396 1.00 0.00 C ATOM 226 C ARG A 14 -0.600 13.391 7.236 1.00 0.00 C ATOM 227 O ARG A 14 0.443 13.801 6.714 1.00 0.00 O ATOM 228 CB ARG A 14 -2.007 14.752 8.875 1.00 0.00 C ATOM 229 CG ARG A 14 -0.821 15.546 9.480 1.00 0.00 C ATOM 230 CD ARG A 14 -0.478 16.817 8.675 1.00 0.00 C ATOM 231 NE ARG A 14 -1.670 17.653 8.402 1.00 0.00 N ATOM 232 CZ ARG A 14 -1.780 18.543 7.401 1.00 0.00 C ATOM 233 NH1 ARG A 14 -0.756 18.804 6.599 1.00 0.00 N ATOM 234 NH2 ARG A 14 -2.934 19.174 7.218 1.00 0.00 N ATOM 0 H ARG A 14 -3.742 13.461 7.669 1.00 0.00 H new ATOM 0 HA ARG A 14 -1.683 15.203 6.789 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -2.906 15.364 8.949 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -2.175 13.864 9.484 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -1.063 15.825 10.505 1.00 0.00 H new ATOM 0 HG3 ARG A 14 0.057 14.901 9.524 1.00 0.00 H new ATOM 0 HD2 ARG A 14 0.256 17.405 9.226 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -0.014 16.531 7.731 1.00 0.00 H new ATOM 0 HE ARG A 14 -2.471 17.544 9.023 1.00 0.00 H new ATOM 0 HH11 ARG A 14 0.134 18.326 6.737 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -0.859 19.483 5.845 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -3.724 18.981 7.834 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -3.030 19.852 6.462 1.00 0.00 H new ATOM 248 N MET A 15 -0.773 12.125 7.652 1.00 0.00 N ATOM 249 CA MET A 15 0.277 11.097 7.642 1.00 0.00 C ATOM 250 C MET A 15 0.381 10.473 6.246 1.00 0.00 C ATOM 251 O MET A 15 1.445 10.471 5.648 1.00 0.00 O ATOM 252 CB MET A 15 -0.037 10.003 8.699 1.00 0.00 C ATOM 253 CG MET A 15 -0.219 10.531 10.133 1.00 0.00 C ATOM 254 SD MET A 15 -1.714 11.531 10.340 1.00 0.00 S ATOM 255 CE MET A 15 -1.507 12.175 12.000 1.00 0.00 C ATOM 0 H MET A 15 -1.664 11.783 8.011 1.00 0.00 H new ATOM 0 HA MET A 15 1.231 11.560 7.893 1.00 0.00 H new ATOM 0 HB2 MET A 15 -0.945 9.478 8.401 1.00 0.00 H new ATOM 0 HB3 MET A 15 0.770 9.270 8.695 1.00 0.00 H new ATOM 0 HG2 MET A 15 -0.256 9.687 10.822 1.00 0.00 H new ATOM 0 HG3 MET A 15 0.651 11.128 10.407 1.00 0.00 H new ATOM 0 HE1 MET A 15 -2.358 12.807 12.254 1.00 0.00 H new ATOM 0 HE2 MET A 15 -1.446 11.347 12.707 1.00 0.00 H new ATOM 0 HE3 MET A 15 -0.590 12.763 12.051 1.00 0.00 H new ATOM 265 N GLN A 16 -0.762 9.982 5.730 1.00 0.00 N ATOM 266 CA GLN A 16 -0.865 9.290 4.409 1.00 0.00 C ATOM 267 C GLN A 16 -0.269 10.125 3.256 1.00 0.00 C ATOM 268 O GLN A 16 0.378 9.589 2.348 1.00 0.00 O ATOM 269 CB GLN A 16 -2.353 8.986 4.091 1.00 0.00 C ATOM 270 CG GLN A 16 -3.081 8.118 5.131 1.00 0.00 C ATOM 271 CD GLN A 16 -2.424 6.759 5.332 1.00 0.00 C ATOM 272 OE1 GLN A 16 -1.594 6.591 6.223 1.00 0.00 O ATOM 273 NE2 GLN A 16 -2.745 5.799 4.476 1.00 0.00 N ATOM 0 H GLN A 16 -1.656 10.050 6.216 1.00 0.00 H new ATOM 0 HA GLN A 16 -0.290 8.367 4.487 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.887 9.931 3.992 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -2.406 8.487 3.123 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -3.108 8.647 6.084 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -4.115 7.973 4.817 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -3.439 5.975 3.749 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -2.298 4.885 4.544 1.00 0.00 H new ATOM 282 N TYR A 17 -0.492 11.440 3.338 1.00 0.00 N ATOM 283 CA TYR A 17 -0.043 12.400 2.311 1.00 0.00 C ATOM 284 C TYR A 17 1.460 12.631 2.445 1.00 0.00 C ATOM 285 O TYR A 17 2.205 12.409 1.489 1.00 0.00 O ATOM 286 CB TYR A 17 -0.830 13.731 2.408 1.00 0.00 C ATOM 287 CG TYR A 17 -0.351 14.854 1.480 1.00 0.00 C ATOM 288 CD1 TYR A 17 -0.528 14.775 0.096 1.00 0.00 C ATOM 289 CD2 TYR A 17 0.282 15.999 1.989 1.00 0.00 C ATOM 290 CE1 TYR A 17 -0.094 15.783 -0.741 1.00 0.00 C ATOM 291 CE2 TYR A 17 0.712 17.007 1.152 1.00 0.00 C ATOM 292 CZ TYR A 17 0.522 16.894 -0.211 1.00 0.00 C ATOM 293 OH TYR A 17 0.968 17.895 -1.046 1.00 0.00 O ATOM 0 H TYR A 17 -0.988 11.874 4.116 1.00 0.00 H new ATOM 0 HA TYR A 17 -0.244 11.981 1.325 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -1.879 13.528 2.192 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -0.779 14.088 3.437 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -1.014 13.908 -0.327 1.00 0.00 H new ATOM 0 HD2 TYR A 17 0.435 16.092 3.054 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.237 15.700 -1.808 1.00 0.00 H new ATOM 0 HE2 TYR A 17 1.196 17.882 1.561 1.00 0.00 H new ATOM 0 HH TYR A 17 1.378 18.607 -0.513 1.00 0.00 H new ATOM 303 N GLU A 18 1.894 13.017 3.660 1.00 0.00 N ATOM 304 CA GLU A 18 3.283 13.451 3.902 1.00 0.00 C ATOM 305 C GLU A 18 4.280 12.288 3.744 1.00 0.00 C ATOM 306 O GLU A 18 5.306 12.451 3.085 1.00 0.00 O ATOM 307 CB GLU A 18 3.437 14.094 5.302 1.00 0.00 C ATOM 308 CG GLU A 18 4.850 14.663 5.572 1.00 0.00 C ATOM 309 CD GLU A 18 4.970 15.352 6.936 1.00 0.00 C ATOM 310 OE1 GLU A 18 5.291 14.675 7.933 1.00 0.00 O ATOM 311 OE2 GLU A 18 4.724 16.576 7.022 1.00 0.00 O ATOM 0 H GLU A 18 1.302 13.037 4.490 1.00 0.00 H new ATOM 0 HA GLU A 18 3.514 14.202 3.147 1.00 0.00 H new ATOM 0 HB2 GLU A 18 2.706 14.896 5.406 1.00 0.00 H new ATOM 0 HB3 GLU A 18 3.204 13.349 6.062 1.00 0.00 H new ATOM 0 HG2 GLU A 18 5.578 13.854 5.515 1.00 0.00 H new ATOM 0 HG3 GLU A 18 5.104 15.376 4.788 1.00 0.00 H new ATOM 318 N VAL A 19 3.943 11.117 4.318 1.00 0.00 N ATOM 319 CA VAL A 19 4.843 9.943 4.338 1.00 0.00 C ATOM 320 C VAL A 19 5.153 9.480 2.896 1.00 0.00 C ATOM 321 O VAL A 19 6.311 9.351 2.520 1.00 0.00 O ATOM 322 CB VAL A 19 4.243 8.752 5.192 1.00 0.00 C ATOM 323 CG1 VAL A 19 5.058 7.451 5.024 1.00 0.00 C ATOM 324 CG2 VAL A 19 4.153 9.123 6.695 1.00 0.00 C ATOM 0 H VAL A 19 3.047 10.957 4.778 1.00 0.00 H new ATOM 0 HA VAL A 19 5.772 10.248 4.819 1.00 0.00 H new ATOM 0 HB VAL A 19 3.237 8.575 4.811 1.00 0.00 H new ATOM 0 HG11 VAL A 19 4.611 6.661 5.627 1.00 0.00 H new ATOM 0 HG12 VAL A 19 5.055 7.153 3.976 1.00 0.00 H new ATOM 0 HG13 VAL A 19 6.084 7.620 5.350 1.00 0.00 H new ATOM 0 HG21 VAL A 19 3.737 8.284 7.253 1.00 0.00 H new ATOM 0 HG22 VAL A 19 5.149 9.352 7.073 1.00 0.00 H new ATOM 0 HG23 VAL A 19 3.509 9.994 6.817 1.00 0.00 H new ATOM 334 N THR A 20 4.101 9.244 2.105 1.00 0.00 N ATOM 335 CA THR A 20 4.220 8.880 0.677 1.00 0.00 C ATOM 336 C THR A 20 4.816 10.024 -0.185 1.00 0.00 C ATOM 337 O THR A 20 5.393 9.764 -1.248 1.00 0.00 O ATOM 338 CB THR A 20 2.823 8.417 0.152 1.00 0.00 C ATOM 339 OG1 THR A 20 2.315 7.417 1.060 1.00 0.00 O ATOM 340 CG2 THR A 20 2.872 7.833 -1.278 1.00 0.00 C ATOM 0 H THR A 20 3.137 9.299 2.432 1.00 0.00 H new ATOM 0 HA THR A 20 4.928 8.056 0.588 1.00 0.00 H new ATOM 0 HB THR A 20 2.175 9.292 0.107 1.00 0.00 H new ATOM 0 HG1 THR A 20 1.548 6.964 0.652 1.00 0.00 H new ATOM 0 HG21 THR A 20 1.870 7.531 -1.582 1.00 0.00 H new ATOM 0 HG22 THR A 20 3.248 8.589 -1.967 1.00 0.00 H new ATOM 0 HG23 THR A 20 3.533 6.966 -1.295 1.00 0.00 H new ATOM 348 N GLN A 21 4.727 11.273 0.305 1.00 0.00 N ATOM 349 CA GLN A 21 5.268 12.456 -0.410 1.00 0.00 C ATOM 350 C GLN A 21 6.806 12.479 -0.333 1.00 0.00 C ATOM 351 O GLN A 21 7.487 12.621 -1.358 1.00 0.00 O ATOM 352 CB GLN A 21 4.680 13.766 0.188 1.00 0.00 C ATOM 353 CG GLN A 21 5.282 15.078 -0.360 1.00 0.00 C ATOM 354 CD GLN A 21 4.734 16.316 0.351 1.00 0.00 C ATOM 355 OE1 GLN A 21 5.261 16.737 1.382 1.00 0.00 O ATOM 356 NE2 GLN A 21 3.693 16.912 -0.195 1.00 0.00 N ATOM 0 H GLN A 21 4.285 11.496 1.197 1.00 0.00 H new ATOM 0 HA GLN A 21 4.975 12.387 -1.458 1.00 0.00 H new ATOM 0 HB2 GLN A 21 3.605 13.777 0.007 1.00 0.00 H new ATOM 0 HB3 GLN A 21 4.821 13.746 1.269 1.00 0.00 H new ATOM 0 HG2 GLN A 21 6.366 15.050 -0.250 1.00 0.00 H new ATOM 0 HG3 GLN A 21 5.071 15.153 -1.427 1.00 0.00 H new ATOM 0 HE21 GLN A 21 3.281 16.537 -1.049 1.00 0.00 H new ATOM 0 HE22 GLN A 21 3.300 17.748 0.237 1.00 0.00 H new ATOM 365 N ASN A 22 7.348 12.302 0.888 1.00 0.00 N ATOM 366 CA ASN A 22 8.787 12.521 1.174 1.00 0.00 C ATOM 367 C ASN A 22 9.527 11.196 1.421 1.00 0.00 C ATOM 368 O ASN A 22 10.753 11.200 1.576 1.00 0.00 O ATOM 369 CB ASN A 22 8.953 13.483 2.397 1.00 0.00 C ATOM 370 CG ASN A 22 8.599 12.876 3.770 1.00 0.00 C ATOM 371 OD1 ASN A 22 7.803 11.946 3.876 1.00 0.00 O ATOM 372 ND2 ASN A 22 9.189 13.416 4.833 1.00 0.00 N ATOM 0 H ASN A 22 6.808 12.005 1.701 1.00 0.00 H new ATOM 0 HA ASN A 22 9.236 12.984 0.295 1.00 0.00 H new ATOM 0 HB2 ASN A 22 9.986 13.829 2.427 1.00 0.00 H new ATOM 0 HB3 ASN A 22 8.327 14.361 2.235 1.00 0.00 H new ATOM 0 HD21 ASN A 22 8.985 13.059 5.766 1.00 0.00 H new ATOM 0 HD22 ASN A 22 9.846 14.187 4.715 1.00 0.00 H new ATOM 379 N ASN A 23 8.764 10.077 1.461 1.00 0.00 N ATOM 380 CA ASN A 23 9.268 8.741 1.848 1.00 0.00 C ATOM 381 C ASN A 23 9.793 8.777 3.291 1.00 0.00 C ATOM 382 O ASN A 23 10.935 8.393 3.582 1.00 0.00 O ATOM 383 CB ASN A 23 10.315 8.171 0.839 1.00 0.00 C ATOM 384 CG ASN A 23 9.711 7.641 -0.465 1.00 0.00 C ATOM 385 OD1 ASN A 23 10.232 6.696 -1.041 1.00 0.00 O ATOM 386 ND2 ASN A 23 8.629 8.245 -0.953 1.00 0.00 N ATOM 0 H ASN A 23 7.772 10.079 1.223 1.00 0.00 H new ATOM 0 HA ASN A 23 8.432 8.042 1.808 1.00 0.00 H new ATOM 0 HB2 ASN A 23 11.035 8.953 0.600 1.00 0.00 H new ATOM 0 HB3 ASN A 23 10.868 7.366 1.323 1.00 0.00 H new ATOM 0 HD21 ASN A 23 8.215 7.921 -1.827 1.00 0.00 H new ATOM 0 HD22 ASN A 23 8.214 9.031 -0.452 1.00 0.00 H new ATOM 393 N GLY A 24 8.927 9.287 4.178 1.00 0.00 N ATOM 394 CA GLY A 24 9.221 9.357 5.604 1.00 0.00 C ATOM 395 C GLY A 24 8.845 8.083 6.336 1.00 0.00 C ATOM 396 O GLY A 24 8.226 7.177 5.765 1.00 0.00 O ATOM 0 H GLY A 24 8.012 9.658 3.923 1.00 0.00 H new ATOM 0 HA2 GLY A 24 10.284 9.553 5.744 1.00 0.00 H new ATOM 0 HA3 GLY A 24 8.682 10.197 6.042 1.00 0.00 H new ATOM 400 N THR A 25 9.243 8.022 7.607 1.00 0.00 N ATOM 401 CA THR A 25 8.875 6.941 8.534 1.00 0.00 C ATOM 402 C THR A 25 8.395 7.564 9.847 1.00 0.00 C ATOM 403 O THR A 25 9.049 8.473 10.380 1.00 0.00 O ATOM 404 CB THR A 25 10.075 5.966 8.812 1.00 0.00 C ATOM 405 OG1 THR A 25 11.245 6.705 9.220 1.00 0.00 O ATOM 406 CG2 THR A 25 10.431 5.120 7.589 1.00 0.00 C ATOM 0 H THR A 25 9.840 8.732 8.032 1.00 0.00 H new ATOM 0 HA THR A 25 8.082 6.350 8.076 1.00 0.00 H new ATOM 0 HB THR A 25 9.753 5.299 9.611 1.00 0.00 H new ATOM 0 HG1 THR A 25 10.976 7.451 9.796 1.00 0.00 H new ATOM 0 HG21 THR A 25 11.266 4.463 7.832 1.00 0.00 H new ATOM 0 HG22 THR A 25 9.569 4.519 7.299 1.00 0.00 H new ATOM 0 HG23 THR A 25 10.712 5.774 6.764 1.00 0.00 H new ATOM 414 N GLU A 26 7.241 7.101 10.346 1.00 0.00 N ATOM 415 CA GLU A 26 6.687 7.555 11.636 1.00 0.00 C ATOM 416 C GLU A 26 7.314 6.739 12.790 1.00 0.00 C ATOM 417 O GLU A 26 7.631 5.558 12.597 1.00 0.00 O ATOM 418 CB GLU A 26 5.140 7.444 11.633 1.00 0.00 C ATOM 419 CG GLU A 26 4.448 8.325 10.572 1.00 0.00 C ATOM 420 CD GLU A 26 2.940 8.452 10.811 1.00 0.00 C ATOM 421 OE1 GLU A 26 2.540 9.271 11.668 1.00 0.00 O ATOM 422 OE2 GLU A 26 2.150 7.726 10.177 1.00 0.00 O ATOM 0 H GLU A 26 6.665 6.405 9.872 1.00 0.00 H new ATOM 0 HA GLU A 26 6.938 8.605 11.786 1.00 0.00 H new ATOM 0 HB2 GLU A 26 4.861 6.404 11.464 1.00 0.00 H new ATOM 0 HB3 GLU A 26 4.765 7.719 12.619 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.899 9.317 10.578 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.622 7.902 9.583 1.00 0.00 H new ATOM 429 N PRO A 27 7.516 7.369 13.998 1.00 0.00 N ATOM 430 CA PRO A 27 8.264 6.756 15.139 1.00 0.00 C ATOM 431 C PRO A 27 7.696 5.388 15.620 1.00 0.00 C ATOM 432 O PRO A 27 6.526 5.079 15.352 1.00 0.00 O ATOM 433 CB PRO A 27 8.153 7.839 16.253 1.00 0.00 C ATOM 434 CG PRO A 27 7.917 9.118 15.518 1.00 0.00 C ATOM 435 CD PRO A 27 7.040 8.739 14.351 1.00 0.00 C ATOM 0 HA PRO A 27 9.286 6.508 14.854 1.00 0.00 H new ATOM 0 HB2 PRO A 27 7.334 7.619 16.938 1.00 0.00 H new ATOM 0 HB3 PRO A 27 9.064 7.888 16.850 1.00 0.00 H new ATOM 0 HG2 PRO A 27 7.429 9.856 16.155 1.00 0.00 H new ATOM 0 HG3 PRO A 27 8.855 9.559 15.180 1.00 0.00 H new ATOM 0 HD2 PRO A 27 5.985 8.741 14.623 1.00 0.00 H new ATOM 0 HD3 PRO A 27 7.156 9.433 13.518 1.00 0.00 H new ATOM 443 N PRO A 28 8.533 4.543 16.333 1.00 0.00 N ATOM 444 CA PRO A 28 8.076 3.262 16.958 1.00 0.00 C ATOM 445 C PRO A 28 6.826 3.428 17.858 1.00 0.00 C ATOM 446 O PRO A 28 6.542 4.534 18.335 1.00 0.00 O ATOM 447 CB PRO A 28 9.311 2.812 17.783 1.00 0.00 C ATOM 448 CG PRO A 28 10.475 3.396 17.040 1.00 0.00 C ATOM 449 CD PRO A 28 10.000 4.750 16.557 1.00 0.00 C ATOM 0 HA PRO A 28 7.759 2.537 16.209 1.00 0.00 H new ATOM 0 HB2 PRO A 28 9.264 3.183 18.807 1.00 0.00 H new ATOM 0 HB3 PRO A 28 9.378 1.726 17.841 1.00 0.00 H new ATOM 0 HG2 PRO A 28 11.347 3.493 17.687 1.00 0.00 H new ATOM 0 HG3 PRO A 28 10.767 2.760 16.204 1.00 0.00 H new ATOM 0 HD2 PRO A 28 10.188 5.529 17.296 1.00 0.00 H new ATOM 0 HD3 PRO A 28 10.508 5.051 15.641 1.00 0.00 H new ATOM 457 N PHE A 29 6.112 2.297 18.082 1.00 0.00 N ATOM 458 CA PHE A 29 4.775 2.227 18.742 1.00 0.00 C ATOM 459 C PHE A 29 3.778 3.249 18.146 1.00 0.00 C ATOM 460 O PHE A 29 2.908 3.769 18.841 1.00 0.00 O ATOM 461 CB PHE A 29 4.836 2.210 20.316 1.00 0.00 C ATOM 462 CG PHE A 29 5.521 3.396 21.023 1.00 0.00 C ATOM 463 CD1 PHE A 29 4.802 4.533 21.403 1.00 0.00 C ATOM 464 CD2 PHE A 29 6.893 3.364 21.318 1.00 0.00 C ATOM 465 CE1 PHE A 29 5.425 5.590 22.046 1.00 0.00 C ATOM 466 CE2 PHE A 29 7.511 4.423 21.960 1.00 0.00 C ATOM 467 CZ PHE A 29 6.778 5.532 22.322 1.00 0.00 C ATOM 0 H PHE A 29 6.457 1.379 17.802 1.00 0.00 H new ATOM 0 HA PHE A 29 4.367 1.246 18.500 1.00 0.00 H new ATOM 0 HB2 PHE A 29 3.814 2.142 20.690 1.00 0.00 H new ATOM 0 HB3 PHE A 29 5.348 1.297 20.621 1.00 0.00 H new ATOM 0 HD1 PHE A 29 3.744 4.588 21.192 1.00 0.00 H new ATOM 0 HD2 PHE A 29 7.476 2.499 21.039 1.00 0.00 H new ATOM 0 HE1 PHE A 29 4.853 6.460 22.332 1.00 0.00 H new ATOM 0 HE2 PHE A 29 8.568 4.380 22.177 1.00 0.00 H new ATOM 0 HZ PHE A 29 7.262 6.358 22.823 1.00 0.00 H new ATOM 477 N GLN A 30 3.923 3.471 16.813 1.00 0.00 N ATOM 478 CA GLN A 30 3.007 4.282 15.977 1.00 0.00 C ATOM 479 C GLN A 30 1.565 3.773 16.117 1.00 0.00 C ATOM 480 O GLN A 30 0.642 4.540 16.408 1.00 0.00 O ATOM 481 CB GLN A 30 3.453 4.174 14.490 1.00 0.00 C ATOM 482 CG GLN A 30 2.556 4.903 13.466 1.00 0.00 C ATOM 483 CD GLN A 30 2.872 4.560 12.008 1.00 0.00 C ATOM 484 OE1 GLN A 30 4.002 4.201 11.660 1.00 0.00 O ATOM 485 NE2 GLN A 30 1.874 4.690 11.146 1.00 0.00 N ATOM 0 H GLN A 30 4.700 3.080 16.280 1.00 0.00 H new ATOM 0 HA GLN A 30 3.045 5.321 16.306 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.465 4.569 14.404 1.00 0.00 H new ATOM 0 HB3 GLN A 30 3.498 3.119 14.219 1.00 0.00 H new ATOM 0 HG2 GLN A 30 1.514 4.655 13.669 1.00 0.00 H new ATOM 0 HG3 GLN A 30 2.661 5.979 13.607 1.00 0.00 H new ATOM 0 HE21 GLN A 30 0.955 4.989 11.471 1.00 0.00 H new ATOM 0 HE22 GLN A 30 2.025 4.491 10.157 1.00 0.00 H new ATOM 494 N ASN A 31 1.401 2.455 15.914 1.00 0.00 N ATOM 495 CA ASN A 31 0.105 1.767 16.034 1.00 0.00 C ATOM 496 C ASN A 31 0.224 0.641 17.062 1.00 0.00 C ATOM 497 O ASN A 31 1.308 0.367 17.570 1.00 0.00 O ATOM 498 CB ASN A 31 -0.364 1.191 14.661 1.00 0.00 C ATOM 499 CG ASN A 31 -0.558 2.237 13.551 1.00 0.00 C ATOM 500 OD1 ASN A 31 -0.350 1.947 12.372 1.00 0.00 O ATOM 501 ND2 ASN A 31 -0.975 3.449 13.907 1.00 0.00 N ATOM 0 H ASN A 31 2.169 1.833 15.660 1.00 0.00 H new ATOM 0 HA ASN A 31 -0.641 2.491 16.362 1.00 0.00 H new ATOM 0 HB2 ASN A 31 0.367 0.456 14.323 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -1.305 0.661 14.809 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -1.130 4.164 13.196 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -1.140 3.663 14.891 1.00 0.00 H new ATOM 508 N GLU A 32 -0.912 0.039 17.412 1.00 0.00 N ATOM 509 CA GLU A 32 -0.963 -1.181 18.239 1.00 0.00 C ATOM 510 C GLU A 32 -0.895 -2.452 17.355 1.00 0.00 C ATOM 511 O GLU A 32 -0.558 -3.542 17.830 1.00 0.00 O ATOM 512 CB GLU A 32 -2.266 -1.163 19.095 1.00 0.00 C ATOM 513 CG GLU A 32 -2.368 -2.271 20.170 1.00 0.00 C ATOM 514 CD GLU A 32 -1.226 -2.219 21.200 1.00 0.00 C ATOM 515 OE1 GLU A 32 -1.289 -1.392 22.131 1.00 0.00 O ATOM 516 OE2 GLU A 32 -0.256 -2.992 21.081 1.00 0.00 O ATOM 0 H GLU A 32 -1.831 0.380 17.132 1.00 0.00 H new ATOM 0 HA GLU A 32 -0.099 -1.202 18.903 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -2.344 -0.194 19.588 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -3.122 -1.250 18.426 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -3.322 -2.179 20.689 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -2.364 -3.245 19.681 1.00 0.00 H new ATOM 523 N TYR A 33 -1.203 -2.289 16.050 1.00 0.00 N ATOM 524 CA TYR A 33 -1.554 -3.412 15.148 1.00 0.00 C ATOM 525 C TYR A 33 -0.471 -3.686 14.093 1.00 0.00 C ATOM 526 O TYR A 33 -0.291 -4.831 13.666 1.00 0.00 O ATOM 527 CB TYR A 33 -2.899 -3.070 14.439 1.00 0.00 C ATOM 528 CG TYR A 33 -3.970 -2.513 15.398 1.00 0.00 C ATOM 529 CD1 TYR A 33 -4.650 -3.351 16.288 1.00 0.00 C ATOM 530 CD2 TYR A 33 -4.269 -1.144 15.444 1.00 0.00 C ATOM 531 CE1 TYR A 33 -5.586 -2.855 17.171 1.00 0.00 C ATOM 532 CE2 TYR A 33 -5.203 -0.647 16.332 1.00 0.00 C ATOM 533 CZ TYR A 33 -5.857 -1.503 17.190 1.00 0.00 C ATOM 534 OH TYR A 33 -6.788 -1.004 18.069 1.00 0.00 O ATOM 0 H TYR A 33 -1.216 -1.378 15.591 1.00 0.00 H new ATOM 0 HA TYR A 33 -1.643 -4.316 15.751 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -2.711 -2.340 13.652 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -3.285 -3.967 13.956 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -4.437 -4.410 16.284 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -3.761 -0.467 14.774 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -6.104 -3.522 17.844 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -5.420 0.411 16.353 1.00 0.00 H new ATOM 0 HH TYR A 33 -6.859 -0.033 17.954 1.00 0.00 H new ATOM 544 N TRP A 34 0.262 -2.629 13.698 1.00 0.00 N ATOM 545 CA TRP A 34 1.050 -2.617 12.441 1.00 0.00 C ATOM 546 C TRP A 34 2.335 -3.493 12.485 1.00 0.00 C ATOM 547 O TRP A 34 2.961 -3.749 11.448 1.00 0.00 O ATOM 548 CB TRP A 34 1.335 -1.139 12.020 1.00 0.00 C ATOM 549 CG TRP A 34 2.453 -0.353 12.691 1.00 0.00 C ATOM 550 CD1 TRP A 34 3.135 0.674 12.088 1.00 0.00 C ATOM 551 CD2 TRP A 34 3.027 -0.468 14.020 1.00 0.00 C ATOM 552 NE1 TRP A 34 4.069 1.186 12.927 1.00 0.00 N ATOM 553 CE2 TRP A 34 4.039 0.505 14.103 1.00 0.00 C ATOM 554 CE3 TRP A 34 2.809 -1.292 15.126 1.00 0.00 C ATOM 555 CZ2 TRP A 34 4.816 0.666 15.237 1.00 0.00 C ATOM 556 CZ3 TRP A 34 3.582 -1.128 16.246 1.00 0.00 C ATOM 557 CH2 TRP A 34 4.574 -0.161 16.291 1.00 0.00 C ATOM 0 H TRP A 34 0.328 -1.763 14.233 1.00 0.00 H new ATOM 0 HA TRP A 34 0.444 -3.093 11.670 1.00 0.00 H new ATOM 0 HB2 TRP A 34 1.540 -1.142 10.949 1.00 0.00 H new ATOM 0 HB3 TRP A 34 0.412 -0.578 12.167 1.00 0.00 H new ATOM 0 HD1 TRP A 34 2.953 1.026 11.083 1.00 0.00 H new ATOM 0 HE1 TRP A 34 4.696 1.961 12.710 1.00 0.00 H new ATOM 0 HE3 TRP A 34 2.040 -2.050 15.099 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 5.587 1.421 15.284 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 3.416 -1.761 17.105 1.00 0.00 H new ATOM 0 HH2 TRP A 34 5.171 -0.061 17.186 1.00 0.00 H new ATOM 568 N ASP A 35 2.682 -3.968 13.693 1.00 0.00 N ATOM 569 CA ASP A 35 3.848 -4.840 13.960 1.00 0.00 C ATOM 570 C ASP A 35 3.479 -6.319 13.751 1.00 0.00 C ATOM 571 O ASP A 35 4.342 -7.139 13.425 1.00 0.00 O ATOM 572 CB ASP A 35 4.340 -4.622 15.424 1.00 0.00 C ATOM 573 CG ASP A 35 3.301 -5.045 16.484 1.00 0.00 C ATOM 574 OD1 ASP A 35 2.209 -4.422 16.548 1.00 0.00 O ATOM 575 OD2 ASP A 35 3.540 -6.027 17.217 1.00 0.00 O ATOM 0 H ASP A 35 2.148 -3.753 14.535 1.00 0.00 H new ATOM 0 HA ASP A 35 4.645 -4.580 13.263 1.00 0.00 H new ATOM 0 HB2 ASP A 35 5.259 -5.187 15.580 1.00 0.00 H new ATOM 0 HB3 ASP A 35 4.585 -3.569 15.565 1.00 0.00 H new ATOM 580 N HIS A 36 2.180 -6.637 13.946 1.00 0.00 N ATOM 581 CA HIS A 36 1.652 -8.010 13.854 1.00 0.00 C ATOM 582 C HIS A 36 1.816 -8.556 12.423 1.00 0.00 C ATOM 583 O HIS A 36 1.266 -8.016 11.466 1.00 0.00 O ATOM 584 CB HIS A 36 0.173 -8.058 14.332 1.00 0.00 C ATOM 585 CG HIS A 36 0.020 -7.932 15.825 1.00 0.00 C ATOM 586 ND1 HIS A 36 0.350 -6.789 16.523 1.00 0.00 N ATOM 587 CD2 HIS A 36 -0.382 -8.829 16.756 1.00 0.00 C ATOM 588 CE1 HIS A 36 0.165 -6.997 17.814 1.00 0.00 C ATOM 589 NE2 HIS A 36 -0.282 -8.225 17.982 1.00 0.00 N ATOM 0 H HIS A 36 1.468 -5.943 14.173 1.00 0.00 H new ATOM 0 HA HIS A 36 2.228 -8.657 14.516 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -0.383 -7.255 13.849 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -0.275 -8.997 14.007 1.00 0.00 H new ATOM 0 HD1 HIS A 36 0.684 -5.920 16.107 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -0.720 -9.837 16.567 1.00 0.00 H new ATOM 0 HE1 HIS A 36 0.349 -6.280 18.601 1.00 0.00 H new ATOM 598 N LYS A 37 2.606 -9.640 12.322 1.00 0.00 N ATOM 599 CA LYS A 37 3.075 -10.236 11.054 1.00 0.00 C ATOM 600 C LYS A 37 2.050 -11.235 10.483 1.00 0.00 C ATOM 601 O LYS A 37 2.286 -11.832 9.429 1.00 0.00 O ATOM 602 CB LYS A 37 4.433 -10.950 11.325 1.00 0.00 C ATOM 603 CG LYS A 37 5.462 -10.082 12.075 1.00 0.00 C ATOM 604 CD LYS A 37 6.777 -10.830 12.348 1.00 0.00 C ATOM 605 CE LYS A 37 7.800 -9.955 13.095 1.00 0.00 C ATOM 606 NZ LYS A 37 8.205 -8.747 12.318 1.00 0.00 N ATOM 0 H LYS A 37 2.946 -10.141 13.143 1.00 0.00 H new ATOM 0 HA LYS A 37 3.199 -9.447 10.312 1.00 0.00 H new ATOM 0 HB2 LYS A 37 4.246 -11.855 11.904 1.00 0.00 H new ATOM 0 HB3 LYS A 37 4.863 -11.263 10.374 1.00 0.00 H new ATOM 0 HG2 LYS A 37 5.672 -9.187 11.490 1.00 0.00 H new ATOM 0 HG3 LYS A 37 5.033 -9.751 13.021 1.00 0.00 H new ATOM 0 HD2 LYS A 37 6.569 -11.724 12.935 1.00 0.00 H new ATOM 0 HD3 LYS A 37 7.207 -11.162 11.403 1.00 0.00 H new ATOM 0 HE2 LYS A 37 7.376 -9.642 14.049 1.00 0.00 H new ATOM 0 HE3 LYS A 37 8.685 -10.550 13.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 8.990 -8.269 12.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 8.510 -9.033 11.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 7.397 -8.096 12.242 1.00 0.00 H new ATOM 620 N GLU A 38 0.917 -11.371 11.194 1.00 0.00 N ATOM 621 CA GLU A 38 -0.134 -12.375 10.943 1.00 0.00 C ATOM 622 C GLU A 38 -0.655 -12.347 9.492 1.00 0.00 C ATOM 623 O GLU A 38 -0.619 -11.293 8.841 1.00 0.00 O ATOM 624 CB GLU A 38 -1.305 -12.122 11.932 1.00 0.00 C ATOM 625 CG GLU A 38 -0.875 -12.089 13.418 1.00 0.00 C ATOM 626 CD GLU A 38 -2.014 -11.708 14.378 1.00 0.00 C ATOM 627 OE1 GLU A 38 -2.260 -10.503 14.575 1.00 0.00 O ATOM 628 OE2 GLU A 38 -2.670 -12.612 14.943 1.00 0.00 O ATOM 0 H GLU A 38 0.700 -10.765 11.986 1.00 0.00 H new ATOM 0 HA GLU A 38 0.301 -13.363 11.097 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -1.781 -11.174 11.681 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -2.055 -12.901 11.798 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -0.487 -13.069 13.698 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.058 -11.377 13.536 1.00 0.00 H new ATOM 635 N GLU A 39 -1.118 -13.516 8.985 1.00 0.00 N ATOM 636 CA GLU A 39 -1.795 -13.600 7.677 1.00 0.00 C ATOM 637 C GLU A 39 -2.990 -12.636 7.650 1.00 0.00 C ATOM 638 O GLU A 39 -3.798 -12.605 8.580 1.00 0.00 O ATOM 639 CB GLU A 39 -2.279 -15.038 7.338 1.00 0.00 C ATOM 640 CG GLU A 39 -1.162 -16.063 7.042 1.00 0.00 C ATOM 641 CD GLU A 39 -0.265 -16.379 8.249 1.00 0.00 C ATOM 642 OE1 GLU A 39 -0.715 -17.115 9.152 1.00 0.00 O ATOM 643 OE2 GLU A 39 0.885 -15.890 8.311 1.00 0.00 O ATOM 0 H GLU A 39 -1.033 -14.411 9.466 1.00 0.00 H new ATOM 0 HA GLU A 39 -1.062 -13.321 6.920 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.876 -15.408 8.172 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -2.939 -14.986 6.472 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -1.617 -16.988 6.689 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -0.541 -15.683 6.231 1.00 0.00 H new ATOM 650 N GLY A 40 -3.072 -11.864 6.576 1.00 0.00 N ATOM 651 CA GLY A 40 -4.033 -10.788 6.470 1.00 0.00 C ATOM 652 C GLY A 40 -3.736 -9.924 5.273 1.00 0.00 C ATOM 653 O GLY A 40 -3.468 -10.454 4.196 1.00 0.00 O ATOM 0 H GLY A 40 -2.473 -11.970 5.757 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -5.039 -11.199 6.387 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -4.010 -10.183 7.376 1.00 0.00 H new ATOM 657 N LEU A 41 -3.803 -8.600 5.442 1.00 0.00 N ATOM 658 CA LEU A 41 -3.482 -7.621 4.388 1.00 0.00 C ATOM 659 C LEU A 41 -2.815 -6.387 4.998 1.00 0.00 C ATOM 660 O LEU A 41 -2.740 -6.239 6.223 1.00 0.00 O ATOM 661 CB LEU A 41 -4.779 -7.198 3.625 1.00 0.00 C ATOM 662 CG LEU A 41 -5.381 -8.273 2.666 1.00 0.00 C ATOM 663 CD1 LEU A 41 -6.833 -7.958 2.290 1.00 0.00 C ATOM 664 CD2 LEU A 41 -4.514 -8.459 1.396 1.00 0.00 C ATOM 0 H LEU A 41 -4.084 -8.169 6.323 1.00 0.00 H new ATOM 0 HA LEU A 41 -2.793 -8.086 3.683 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -5.538 -6.926 4.359 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -4.561 -6.301 3.045 1.00 0.00 H new ATOM 0 HG LEU A 41 -5.378 -9.215 3.215 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.212 -8.731 1.622 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -7.444 -7.927 3.192 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -6.877 -6.991 1.788 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.966 -9.215 0.754 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -4.453 -7.514 0.856 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -3.512 -8.779 1.683 1.00 0.00 H new ATOM 676 N TYR A 42 -2.337 -5.525 4.111 1.00 0.00 N ATOM 677 CA TYR A 42 -1.992 -4.145 4.414 1.00 0.00 C ATOM 678 C TYR A 42 -2.626 -3.290 3.326 1.00 0.00 C ATOM 679 O TYR A 42 -2.491 -3.577 2.126 1.00 0.00 O ATOM 680 CB TYR A 42 -0.467 -3.900 4.579 1.00 0.00 C ATOM 681 CG TYR A 42 0.497 -4.383 3.474 1.00 0.00 C ATOM 682 CD1 TYR A 42 0.603 -3.719 2.243 1.00 0.00 C ATOM 683 CD2 TYR A 42 1.359 -5.465 3.697 1.00 0.00 C ATOM 684 CE1 TYR A 42 1.523 -4.114 1.293 1.00 0.00 C ATOM 685 CE2 TYR A 42 2.289 -5.850 2.755 1.00 0.00 C ATOM 686 CZ TYR A 42 2.364 -5.181 1.555 1.00 0.00 C ATOM 687 OH TYR A 42 3.294 -5.569 0.616 1.00 0.00 O ATOM 0 H TYR A 42 -2.175 -5.774 3.135 1.00 0.00 H new ATOM 0 HA TYR A 42 -2.385 -3.870 5.393 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -0.318 -2.827 4.698 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -0.158 -4.370 5.513 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -0.048 -2.883 2.035 1.00 0.00 H new ATOM 0 HD2 TYR A 42 1.293 -6.009 4.627 1.00 0.00 H new ATOM 0 HE1 TYR A 42 1.586 -3.593 0.349 1.00 0.00 H new ATOM 0 HE2 TYR A 42 2.957 -6.674 2.958 1.00 0.00 H new ATOM 0 HH TYR A 42 3.804 -6.333 0.957 1.00 0.00 H new ATOM 697 N VAL A 43 -3.389 -2.288 3.764 1.00 0.00 N ATOM 698 CA VAL A 43 -4.301 -1.522 2.910 1.00 0.00 C ATOM 699 C VAL A 43 -4.021 -0.022 3.062 1.00 0.00 C ATOM 700 O VAL A 43 -3.468 0.404 4.087 1.00 0.00 O ATOM 701 CB VAL A 43 -5.818 -1.856 3.258 1.00 0.00 C ATOM 702 CG1 VAL A 43 -6.089 -3.386 3.184 1.00 0.00 C ATOM 703 CG2 VAL A 43 -6.250 -1.287 4.630 1.00 0.00 C ATOM 0 H VAL A 43 -3.392 -1.980 4.736 1.00 0.00 H new ATOM 0 HA VAL A 43 -4.130 -1.805 1.871 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.427 -1.361 2.501 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -7.133 -3.583 3.427 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -5.877 -3.745 2.177 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -5.447 -3.904 3.897 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -7.293 -1.543 4.818 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -5.624 -1.713 5.414 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -6.138 -0.203 4.626 1.00 0.00 H new ATOM 713 N ASP A 44 -4.414 0.779 2.052 1.00 0.00 N ATOM 714 CA ASP A 44 -4.280 2.245 2.128 1.00 0.00 C ATOM 715 C ASP A 44 -5.445 2.753 2.978 1.00 0.00 C ATOM 716 O ASP A 44 -6.603 2.718 2.537 1.00 0.00 O ATOM 717 CB ASP A 44 -4.251 2.913 0.718 1.00 0.00 C ATOM 718 CG ASP A 44 -3.861 4.419 0.708 1.00 0.00 C ATOM 719 OD1 ASP A 44 -3.558 5.000 1.783 1.00 0.00 O ATOM 720 OD2 ASP A 44 -3.876 5.034 -0.384 1.00 0.00 O ATOM 0 H ASP A 44 -4.823 0.438 1.182 1.00 0.00 H new ATOM 0 HA ASP A 44 -3.327 2.513 2.584 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -3.547 2.367 0.089 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -5.235 2.806 0.262 1.00 0.00 H new ATOM 725 N ILE A 45 -5.102 3.140 4.221 1.00 0.00 N ATOM 726 CA ILE A 45 -6.059 3.459 5.320 1.00 0.00 C ATOM 727 C ILE A 45 -7.195 4.401 4.859 1.00 0.00 C ATOM 728 O ILE A 45 -8.318 4.326 5.375 1.00 0.00 O ATOM 729 CB ILE A 45 -5.344 4.120 6.581 1.00 0.00 C ATOM 730 CG1 ILE A 45 -3.907 3.561 6.801 1.00 0.00 C ATOM 731 CG2 ILE A 45 -6.200 3.952 7.870 1.00 0.00 C ATOM 732 CD1 ILE A 45 -3.145 4.155 7.976 1.00 0.00 C ATOM 0 H ILE A 45 -4.128 3.245 4.506 1.00 0.00 H new ATOM 0 HA ILE A 45 -6.481 2.497 5.609 1.00 0.00 H new ATOM 0 HB ILE A 45 -5.252 5.185 6.366 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -3.973 2.482 6.942 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -3.328 3.729 5.893 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -5.684 4.414 8.712 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -7.168 4.433 7.729 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -6.348 2.891 8.073 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -2.158 3.697 8.039 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -3.037 5.230 7.834 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -3.693 3.964 8.899 1.00 0.00 H new ATOM 744 N VAL A 46 -6.865 5.279 3.887 1.00 0.00 N ATOM 745 CA VAL A 46 -7.769 6.313 3.334 1.00 0.00 C ATOM 746 C VAL A 46 -9.138 5.744 2.867 1.00 0.00 C ATOM 747 O VAL A 46 -10.179 6.382 3.047 1.00 0.00 O ATOM 748 CB VAL A 46 -7.059 7.059 2.139 1.00 0.00 C ATOM 749 CG1 VAL A 46 -5.740 7.722 2.609 1.00 0.00 C ATOM 750 CG2 VAL A 46 -6.798 6.089 0.948 1.00 0.00 C ATOM 0 H VAL A 46 -5.941 5.289 3.455 1.00 0.00 H new ATOM 0 HA VAL A 46 -7.982 7.012 4.143 1.00 0.00 H new ATOM 0 HB VAL A 46 -7.729 7.845 1.790 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -5.268 8.230 1.768 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -5.956 8.445 3.395 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -5.066 6.957 2.995 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.308 6.630 0.139 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -6.157 5.272 1.278 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -7.746 5.686 0.593 1.00 0.00 H new ATOM 760 N SER A 47 -9.118 4.531 2.309 1.00 0.00 N ATOM 761 CA SER A 47 -10.302 3.914 1.690 1.00 0.00 C ATOM 762 C SER A 47 -10.277 2.384 1.879 1.00 0.00 C ATOM 763 O SER A 47 -11.106 1.679 1.296 1.00 0.00 O ATOM 764 CB SER A 47 -10.361 4.323 0.187 1.00 0.00 C ATOM 765 OG SER A 47 -11.523 3.839 -0.473 1.00 0.00 O ATOM 0 H SER A 47 -8.283 3.946 2.272 1.00 0.00 H new ATOM 0 HA SER A 47 -11.208 4.274 2.177 1.00 0.00 H new ATOM 0 HB2 SER A 47 -10.332 5.410 0.110 1.00 0.00 H new ATOM 0 HB3 SER A 47 -9.475 3.944 -0.323 1.00 0.00 H new ATOM 0 HG SER A 47 -11.749 2.950 -0.128 1.00 0.00 H new ATOM 771 N GLY A 48 -9.338 1.881 2.719 1.00 0.00 N ATOM 772 CA GLY A 48 -9.223 0.446 3.004 1.00 0.00 C ATOM 773 C GLY A 48 -8.885 -0.390 1.777 1.00 0.00 C ATOM 774 O GLY A 48 -9.261 -1.561 1.702 1.00 0.00 O ATOM 0 H GLY A 48 -8.652 2.457 3.207 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.453 0.294 3.761 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -10.162 0.091 3.429 1.00 0.00 H new ATOM 778 N LYS A 49 -8.158 0.232 0.829 1.00 0.00 N ATOM 779 CA LYS A 49 -7.805 -0.374 -0.468 1.00 0.00 C ATOM 780 C LYS A 49 -6.792 -1.512 -0.266 1.00 0.00 C ATOM 781 O LYS A 49 -5.666 -1.225 0.123 1.00 0.00 O ATOM 782 CB LYS A 49 -7.176 0.714 -1.384 1.00 0.00 C ATOM 783 CG LYS A 49 -8.058 1.957 -1.581 1.00 0.00 C ATOM 784 CD LYS A 49 -9.313 1.676 -2.450 1.00 0.00 C ATOM 785 CE LYS A 49 -8.968 1.497 -3.932 1.00 0.00 C ATOM 786 NZ LYS A 49 -10.173 1.269 -4.757 1.00 0.00 N ATOM 0 H LYS A 49 -7.796 1.179 0.944 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.706 -0.779 -0.929 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -6.221 1.023 -0.959 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -6.964 0.274 -2.359 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -8.373 2.331 -0.607 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -7.467 2.745 -2.049 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -9.811 0.778 -2.085 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -10.019 2.499 -2.341 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -8.444 2.383 -4.292 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -8.286 0.655 -4.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -9.975 1.536 -5.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -10.436 0.264 -4.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -10.957 1.847 -4.393 1.00 0.00 H new ATOM 800 N PRO A 50 -7.164 -2.815 -0.512 1.00 0.00 N ATOM 801 CA PRO A 50 -6.203 -3.941 -0.411 1.00 0.00 C ATOM 802 C PRO A 50 -5.035 -3.772 -1.402 1.00 0.00 C ATOM 803 O PRO A 50 -5.249 -3.641 -2.614 1.00 0.00 O ATOM 804 CB PRO A 50 -7.063 -5.196 -0.713 1.00 0.00 C ATOM 805 CG PRO A 50 -8.263 -4.675 -1.441 1.00 0.00 C ATOM 806 CD PRO A 50 -8.524 -3.292 -0.877 1.00 0.00 C ATOM 0 HA PRO A 50 -5.724 -4.005 0.566 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -6.513 -5.915 -1.321 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -7.350 -5.709 0.205 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -8.080 -4.631 -2.515 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -9.124 -5.327 -1.291 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -8.996 -2.640 -1.611 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.185 -3.328 -0.011 1.00 0.00 H new ATOM 814 N LEU A 51 -3.806 -3.733 -0.859 1.00 0.00 N ATOM 815 CA LEU A 51 -2.587 -3.431 -1.624 1.00 0.00 C ATOM 816 C LEU A 51 -1.734 -4.682 -1.789 1.00 0.00 C ATOM 817 O LEU A 51 -1.272 -4.976 -2.900 1.00 0.00 O ATOM 818 CB LEU A 51 -1.817 -2.274 -0.929 1.00 0.00 C ATOM 819 CG LEU A 51 -2.609 -0.926 -0.852 1.00 0.00 C ATOM 820 CD1 LEU A 51 -1.730 0.242 -0.364 1.00 0.00 C ATOM 821 CD2 LEU A 51 -3.310 -0.609 -2.201 1.00 0.00 C ATOM 0 H LEU A 51 -3.631 -3.912 0.130 1.00 0.00 H new ATOM 0 HA LEU A 51 -2.852 -3.101 -2.629 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -1.553 -2.585 0.082 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -0.883 -2.103 -1.464 1.00 0.00 H new ATOM 0 HG LEU A 51 -3.389 -1.052 -0.101 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.325 1.155 -0.328 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.348 0.018 0.632 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -0.895 0.380 -1.051 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -3.852 0.333 -2.117 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -2.562 -0.528 -2.990 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.009 -1.409 -2.445 1.00 0.00 H new ATOM 833 N PHE A 52 -1.543 -5.413 -0.678 1.00 0.00 N ATOM 834 CA PHE A 52 -0.899 -6.744 -0.676 1.00 0.00 C ATOM 835 C PHE A 52 -0.973 -7.347 0.745 1.00 0.00 C ATOM 836 O PHE A 52 -1.267 -6.632 1.698 1.00 0.00 O ATOM 837 CB PHE A 52 0.572 -6.676 -1.212 1.00 0.00 C ATOM 838 CG PHE A 52 1.206 -8.039 -1.460 1.00 0.00 C ATOM 839 CD1 PHE A 52 0.691 -8.896 -2.439 1.00 0.00 C ATOM 840 CD2 PHE A 52 2.281 -8.483 -0.694 1.00 0.00 C ATOM 841 CE1 PHE A 52 1.238 -10.144 -2.641 1.00 0.00 C ATOM 842 CE2 PHE A 52 2.824 -9.722 -0.905 1.00 0.00 C ATOM 843 CZ PHE A 52 2.305 -10.557 -1.873 1.00 0.00 C ATOM 0 H PHE A 52 -1.831 -5.099 0.249 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.439 -7.400 -1.359 1.00 0.00 H new ATOM 0 HB2 PHE A 52 0.583 -6.107 -2.142 1.00 0.00 H new ATOM 0 HB3 PHE A 52 1.184 -6.127 -0.496 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -0.145 -8.575 -3.043 1.00 0.00 H new ATOM 0 HD2 PHE A 52 2.690 -7.844 0.074 1.00 0.00 H new ATOM 0 HE1 PHE A 52 0.832 -10.797 -3.399 1.00 0.00 H new ATOM 0 HE2 PHE A 52 3.664 -10.048 -0.310 1.00 0.00 H new ATOM 0 HZ PHE A 52 2.735 -11.535 -2.029 1.00 0.00 H new ATOM 853 N THR A 53 -0.709 -8.666 0.877 1.00 0.00 N ATOM 854 CA THR A 53 -0.888 -9.406 2.143 1.00 0.00 C ATOM 855 C THR A 53 0.267 -9.172 3.148 1.00 0.00 C ATOM 856 O THR A 53 1.430 -8.995 2.766 1.00 0.00 O ATOM 857 CB THR A 53 -1.040 -10.948 1.881 1.00 0.00 C ATOM 858 OG1 THR A 53 -1.280 -11.654 3.114 1.00 0.00 O ATOM 859 CG2 THR A 53 0.194 -11.554 1.207 1.00 0.00 C ATOM 0 H THR A 53 -0.367 -9.245 0.110 1.00 0.00 H new ATOM 0 HA THR A 53 -1.803 -9.015 2.588 1.00 0.00 H new ATOM 0 HB THR A 53 -1.891 -11.058 1.208 1.00 0.00 H new ATOM 0 HG1 THR A 53 -2.000 -11.211 3.610 1.00 0.00 H new ATOM 0 HG21 THR A 53 0.035 -12.621 1.049 1.00 0.00 H new ATOM 0 HG22 THR A 53 0.361 -11.066 0.247 1.00 0.00 H new ATOM 0 HG23 THR A 53 1.066 -11.407 1.845 1.00 0.00 H new ATOM 867 N SER A 54 -0.105 -9.187 4.441 1.00 0.00 N ATOM 868 CA SER A 54 0.833 -9.188 5.583 1.00 0.00 C ATOM 869 C SER A 54 1.561 -10.551 5.749 1.00 0.00 C ATOM 870 O SER A 54 2.518 -10.651 6.524 1.00 0.00 O ATOM 871 CB SER A 54 0.081 -8.790 6.879 1.00 0.00 C ATOM 872 OG SER A 54 0.964 -8.654 7.987 1.00 0.00 O ATOM 0 H SER A 54 -1.084 -9.199 4.729 1.00 0.00 H new ATOM 0 HA SER A 54 1.609 -8.450 5.380 1.00 0.00 H new ATOM 0 HB2 SER A 54 -0.446 -7.850 6.718 1.00 0.00 H new ATOM 0 HB3 SER A 54 -0.673 -9.543 7.107 1.00 0.00 H new ATOM 0 HG SER A 54 1.797 -9.136 7.802 1.00 0.00 H new ATOM 878 N LYS A 55 1.062 -11.605 5.069 1.00 0.00 N ATOM 879 CA LYS A 55 1.718 -12.934 5.048 1.00 0.00 C ATOM 880 C LYS A 55 3.151 -12.873 4.453 1.00 0.00 C ATOM 881 O LYS A 55 4.048 -13.576 4.927 1.00 0.00 O ATOM 882 CB LYS A 55 0.848 -13.962 4.273 1.00 0.00 C ATOM 883 CG LYS A 55 1.435 -15.397 4.233 1.00 0.00 C ATOM 884 CD LYS A 55 0.525 -16.416 3.514 1.00 0.00 C ATOM 885 CE LYS A 55 0.286 -16.073 2.036 1.00 0.00 C ATOM 886 NZ LYS A 55 1.541 -16.101 1.248 1.00 0.00 N ATOM 0 H LYS A 55 0.201 -11.562 4.523 1.00 0.00 H new ATOM 0 HA LYS A 55 1.813 -13.261 6.083 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.141 -14.000 4.729 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.714 -13.609 3.251 1.00 0.00 H new ATOM 0 HG2 LYS A 55 2.403 -15.371 3.733 1.00 0.00 H new ATOM 0 HG3 LYS A 55 1.612 -15.737 5.253 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.974 -17.407 3.583 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -0.434 -16.464 4.029 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -0.425 -16.781 1.610 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.166 -15.084 1.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.378 -16.607 0.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 1.845 -15.127 1.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.281 -16.589 1.792 1.00 0.00 H new ATOM 900 N ASP A 56 3.362 -12.012 3.439 1.00 0.00 N ATOM 901 CA ASP A 56 4.682 -11.878 2.743 1.00 0.00 C ATOM 902 C ASP A 56 5.336 -10.532 3.083 1.00 0.00 C ATOM 903 O ASP A 56 6.222 -10.048 2.367 1.00 0.00 O ATOM 904 CB ASP A 56 4.506 -12.007 1.213 1.00 0.00 C ATOM 905 CG ASP A 56 3.986 -13.379 0.781 1.00 0.00 C ATOM 906 OD1 ASP A 56 2.800 -13.665 1.026 1.00 0.00 O ATOM 907 OD2 ASP A 56 4.750 -14.187 0.206 1.00 0.00 O ATOM 0 H ASP A 56 2.640 -11.391 3.073 1.00 0.00 H new ATOM 0 HA ASP A 56 5.331 -12.682 3.090 1.00 0.00 H new ATOM 0 HB2 ASP A 56 3.815 -11.238 0.867 1.00 0.00 H new ATOM 0 HB3 ASP A 56 5.463 -11.818 0.726 1.00 0.00 H new ATOM 912 N LYS A 57 4.912 -9.962 4.207 1.00 0.00 N ATOM 913 CA LYS A 57 5.339 -8.636 4.664 1.00 0.00 C ATOM 914 C LYS A 57 6.760 -8.666 5.278 1.00 0.00 C ATOM 915 O LYS A 57 7.238 -9.714 5.724 1.00 0.00 O ATOM 916 CB LYS A 57 4.313 -8.150 5.711 1.00 0.00 C ATOM 917 CG LYS A 57 4.471 -6.702 6.194 1.00 0.00 C ATOM 918 CD LYS A 57 3.560 -6.365 7.381 1.00 0.00 C ATOM 919 CE LYS A 57 3.866 -7.143 8.667 1.00 0.00 C ATOM 920 NZ LYS A 57 2.963 -6.730 9.768 1.00 0.00 N ATOM 0 H LYS A 57 4.251 -10.413 4.839 1.00 0.00 H new ATOM 0 HA LYS A 57 5.381 -7.956 3.813 1.00 0.00 H new ATOM 0 HB2 LYS A 57 3.314 -8.263 5.290 1.00 0.00 H new ATOM 0 HB3 LYS A 57 4.370 -8.808 6.578 1.00 0.00 H new ATOM 0 HG2 LYS A 57 5.509 -6.531 6.479 1.00 0.00 H new ATOM 0 HG3 LYS A 57 4.251 -6.024 5.370 1.00 0.00 H new ATOM 0 HD2 LYS A 57 3.639 -5.298 7.591 1.00 0.00 H new ATOM 0 HD3 LYS A 57 2.526 -6.557 7.094 1.00 0.00 H new ATOM 0 HE2 LYS A 57 3.756 -8.212 8.484 1.00 0.00 H new ATOM 0 HE3 LYS A 57 4.902 -6.975 8.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 3.529 -6.448 10.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 2.381 -5.926 9.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 2.345 -7.525 10.027 1.00 0.00 H new ATOM 934 N PHE A 58 7.394 -7.487 5.309 1.00 0.00 N ATOM 935 CA PHE A 58 8.668 -7.237 6.018 1.00 0.00 C ATOM 936 C PHE A 58 8.356 -6.507 7.339 1.00 0.00 C ATOM 937 O PHE A 58 7.187 -6.266 7.644 1.00 0.00 O ATOM 938 CB PHE A 58 9.624 -6.398 5.121 1.00 0.00 C ATOM 939 CG PHE A 58 10.196 -7.185 3.936 1.00 0.00 C ATOM 940 CD1 PHE A 58 9.390 -7.531 2.847 1.00 0.00 C ATOM 941 CD2 PHE A 58 11.535 -7.584 3.913 1.00 0.00 C ATOM 942 CE1 PHE A 58 9.903 -8.256 1.788 1.00 0.00 C ATOM 943 CE2 PHE A 58 12.047 -8.308 2.850 1.00 0.00 C ATOM 944 CZ PHE A 58 11.230 -8.640 1.783 1.00 0.00 C ATOM 0 H PHE A 58 7.033 -6.660 4.834 1.00 0.00 H new ATOM 0 HA PHE A 58 9.170 -8.179 6.240 1.00 0.00 H new ATOM 0 HB2 PHE A 58 9.086 -5.528 4.744 1.00 0.00 H new ATOM 0 HB3 PHE A 58 10.447 -6.024 5.730 1.00 0.00 H new ATOM 0 HD1 PHE A 58 8.354 -7.228 2.833 1.00 0.00 H new ATOM 0 HD2 PHE A 58 12.181 -7.323 4.738 1.00 0.00 H new ATOM 0 HE1 PHE A 58 9.263 -8.524 0.960 1.00 0.00 H new ATOM 0 HE2 PHE A 58 13.083 -8.614 2.853 1.00 0.00 H new ATOM 0 HZ PHE A 58 11.629 -9.198 0.949 1.00 0.00 H new ATOM 954 N ASP A 59 9.386 -6.207 8.146 1.00 0.00 N ATOM 955 CA ASP A 59 9.219 -5.569 9.482 1.00 0.00 C ATOM 956 C ASP A 59 8.419 -4.233 9.407 1.00 0.00 C ATOM 957 O ASP A 59 8.261 -3.659 8.321 1.00 0.00 O ATOM 958 CB ASP A 59 10.612 -5.361 10.124 1.00 0.00 C ATOM 959 CG ASP A 59 10.568 -4.902 11.595 1.00 0.00 C ATOM 960 OD1 ASP A 59 10.322 -5.750 12.485 1.00 0.00 O ATOM 961 OD2 ASP A 59 10.758 -3.698 11.867 1.00 0.00 O ATOM 0 H ASP A 59 10.358 -6.395 7.901 1.00 0.00 H new ATOM 0 HA ASP A 59 8.628 -6.236 10.110 1.00 0.00 H new ATOM 0 HB2 ASP A 59 11.171 -6.295 10.063 1.00 0.00 H new ATOM 0 HB3 ASP A 59 11.162 -4.622 9.541 1.00 0.00 H new ATOM 966 N SER A 60 7.907 -3.793 10.579 1.00 0.00 N ATOM 967 CA SER A 60 7.028 -2.607 10.753 1.00 0.00 C ATOM 968 C SER A 60 7.702 -1.270 10.279 1.00 0.00 C ATOM 969 O SER A 60 8.572 -1.294 9.421 1.00 0.00 O ATOM 970 CB SER A 60 6.609 -2.563 12.245 1.00 0.00 C ATOM 971 OG SER A 60 5.545 -1.662 12.467 1.00 0.00 O ATOM 0 H SER A 60 8.099 -4.268 11.461 1.00 0.00 H new ATOM 0 HA SER A 60 6.149 -2.703 10.116 1.00 0.00 H new ATOM 0 HB2 SER A 60 6.313 -3.561 12.568 1.00 0.00 H new ATOM 0 HB3 SER A 60 7.465 -2.271 12.854 1.00 0.00 H new ATOM 0 HG SER A 60 5.694 -1.180 13.307 1.00 0.00 H new ATOM 977 N GLN A 61 7.264 -0.101 10.831 1.00 0.00 N ATOM 978 CA GLN A 61 7.699 1.267 10.378 1.00 0.00 C ATOM 979 C GLN A 61 9.245 1.456 10.225 1.00 0.00 C ATOM 980 O GLN A 61 9.697 2.378 9.524 1.00 0.00 O ATOM 981 CB GLN A 61 7.092 2.376 11.313 1.00 0.00 C ATOM 982 CG GLN A 61 7.231 2.160 12.851 1.00 0.00 C ATOM 983 CD GLN A 61 8.658 2.106 13.395 1.00 0.00 C ATOM 984 OE1 GLN A 61 9.235 1.033 13.544 1.00 0.00 O ATOM 985 NE2 GLN A 61 9.256 3.259 13.635 1.00 0.00 N ATOM 0 H GLN A 61 6.599 -0.074 11.604 1.00 0.00 H new ATOM 0 HA GLN A 61 7.303 1.372 9.368 1.00 0.00 H new ATOM 0 HB2 GLN A 61 7.562 3.326 11.061 1.00 0.00 H new ATOM 0 HB3 GLN A 61 6.032 2.473 11.079 1.00 0.00 H new ATOM 0 HG2 GLN A 61 6.700 2.964 13.360 1.00 0.00 H new ATOM 0 HG3 GLN A 61 6.728 1.229 13.114 1.00 0.00 H new ATOM 0 HE21 GLN A 61 8.749 4.134 13.501 1.00 0.00 H new ATOM 0 HE22 GLN A 61 10.225 3.274 13.954 1.00 0.00 H new ATOM 994 N CYS A 62 10.028 0.586 10.895 1.00 0.00 N ATOM 995 CA CYS A 62 11.514 0.567 10.843 1.00 0.00 C ATOM 996 C CYS A 62 12.037 0.285 9.408 1.00 0.00 C ATOM 997 O CYS A 62 13.191 0.584 9.079 1.00 0.00 O ATOM 998 CB CYS A 62 12.057 -0.488 11.838 1.00 0.00 C ATOM 999 SG CYS A 62 13.861 -0.576 11.909 1.00 0.00 S ATOM 0 H CYS A 62 9.643 -0.139 11.500 1.00 0.00 H new ATOM 0 HA CYS A 62 11.876 1.554 11.129 1.00 0.00 H new ATOM 0 HB2 CYS A 62 11.676 -0.263 12.834 1.00 0.00 H new ATOM 0 HB3 CYS A 62 11.667 -1.467 11.561 1.00 0.00 H new ATOM 0 HG CYS A 62 14.362 -0.125 10.797 1.00 0.00 H new ATOM 1005 N GLY A 63 11.164 -0.302 8.582 1.00 0.00 N ATOM 1006 CA GLY A 63 11.392 -0.524 7.157 1.00 0.00 C ATOM 1007 C GLY A 63 10.086 -0.425 6.391 1.00 0.00 C ATOM 1008 O GLY A 63 9.049 -0.016 6.952 1.00 0.00 O ATOM 0 H GLY A 63 10.256 -0.643 8.898 1.00 0.00 H new ATOM 0 HA2 GLY A 63 12.101 0.212 6.777 1.00 0.00 H new ATOM 0 HA3 GLY A 63 11.838 -1.506 7.002 1.00 0.00 H new ATOM 1012 N TRP A 64 10.131 -0.751 5.097 1.00 0.00 N ATOM 1013 CA TRP A 64 8.956 -0.748 4.208 1.00 0.00 C ATOM 1014 C TRP A 64 8.785 -2.145 3.563 1.00 0.00 C ATOM 1015 O TRP A 64 9.771 -2.707 3.061 1.00 0.00 O ATOM 1016 CB TRP A 64 9.112 0.354 3.128 1.00 0.00 C ATOM 1017 CG TRP A 64 9.246 1.764 3.687 1.00 0.00 C ATOM 1018 CD1 TRP A 64 8.510 2.339 4.696 1.00 0.00 C ATOM 1019 CD2 TRP A 64 10.168 2.770 3.251 1.00 0.00 C ATOM 1020 NE1 TRP A 64 8.914 3.638 4.900 1.00 0.00 N ATOM 1021 CE2 TRP A 64 9.929 3.923 4.029 1.00 0.00 C ATOM 1022 CE3 TRP A 64 11.166 2.810 2.274 1.00 0.00 C ATOM 1023 CZ2 TRP A 64 10.656 5.097 3.862 1.00 0.00 C ATOM 1024 CZ3 TRP A 64 11.888 3.976 2.109 1.00 0.00 C ATOM 1025 CH2 TRP A 64 11.626 5.104 2.901 1.00 0.00 C ATOM 0 H TRP A 64 10.993 -1.029 4.627 1.00 0.00 H new ATOM 0 HA TRP A 64 8.060 -0.527 4.788 1.00 0.00 H new ATOM 0 HB2 TRP A 64 9.990 0.131 2.522 1.00 0.00 H new ATOM 0 HB3 TRP A 64 8.249 0.320 2.463 1.00 0.00 H new ATOM 0 HD1 TRP A 64 7.727 1.842 5.249 1.00 0.00 H new ATOM 0 HE1 TRP A 64 8.522 4.282 5.587 1.00 0.00 H new ATOM 0 HE3 TRP A 64 11.369 1.946 1.659 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 10.461 5.969 4.469 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 12.665 4.020 1.360 1.00 0.00 H new ATOM 0 HH2 TRP A 64 12.207 6.001 2.747 1.00 0.00 H new ATOM 1036 N PRO A 65 7.544 -2.750 3.587 1.00 0.00 N ATOM 1037 CA PRO A 65 7.271 -4.043 2.925 1.00 0.00 C ATOM 1038 C PRO A 65 7.305 -3.901 1.388 1.00 0.00 C ATOM 1039 O PRO A 65 6.513 -3.142 0.806 1.00 0.00 O ATOM 1040 CB PRO A 65 5.854 -4.449 3.446 1.00 0.00 C ATOM 1041 CG PRO A 65 5.567 -3.510 4.585 1.00 0.00 C ATOM 1042 CD PRO A 65 6.327 -2.245 4.264 1.00 0.00 C ATOM 0 HA PRO A 65 8.020 -4.800 3.155 1.00 0.00 H new ATOM 0 HB2 PRO A 65 5.104 -4.355 2.660 1.00 0.00 H new ATOM 0 HB3 PRO A 65 5.839 -5.487 3.778 1.00 0.00 H new ATOM 0 HG2 PRO A 65 4.498 -3.314 4.673 1.00 0.00 H new ATOM 0 HG3 PRO A 65 5.893 -3.934 5.535 1.00 0.00 H new ATOM 0 HD2 PRO A 65 5.752 -1.582 3.618 1.00 0.00 H new ATOM 0 HD3 PRO A 65 6.571 -1.681 5.164 1.00 0.00 H new ATOM 1050 N SER A 66 8.242 -4.612 0.748 1.00 0.00 N ATOM 1051 CA SER A 66 8.401 -4.603 -0.708 1.00 0.00 C ATOM 1052 C SER A 66 8.215 -6.022 -1.268 1.00 0.00 C ATOM 1053 O SER A 66 8.747 -6.991 -0.730 1.00 0.00 O ATOM 1054 CB SER A 66 9.782 -4.023 -1.090 1.00 0.00 C ATOM 1055 OG SER A 66 10.829 -4.735 -0.461 1.00 0.00 O ATOM 0 H SER A 66 8.913 -5.211 1.229 1.00 0.00 H new ATOM 0 HA SER A 66 7.636 -3.964 -1.149 1.00 0.00 H new ATOM 0 HB2 SER A 66 9.910 -4.064 -2.172 1.00 0.00 H new ATOM 0 HB3 SER A 66 9.830 -2.973 -0.803 1.00 0.00 H new ATOM 0 HG SER A 66 11.691 -4.348 -0.722 1.00 0.00 H new ATOM 1061 N PHE A 67 7.444 -6.126 -2.350 1.00 0.00 N ATOM 1062 CA PHE A 67 7.217 -7.374 -3.093 1.00 0.00 C ATOM 1063 C PHE A 67 7.273 -7.021 -4.597 1.00 0.00 C ATOM 1064 O PHE A 67 7.631 -5.899 -4.941 1.00 0.00 O ATOM 1065 CB PHE A 67 5.849 -8.007 -2.667 1.00 0.00 C ATOM 1066 CG PHE A 67 5.777 -9.529 -2.842 1.00 0.00 C ATOM 1067 CD1 PHE A 67 6.338 -10.382 -1.888 1.00 0.00 C ATOM 1068 CD2 PHE A 67 5.159 -10.110 -3.947 1.00 0.00 C ATOM 1069 CE1 PHE A 67 6.275 -11.753 -2.038 1.00 0.00 C ATOM 1070 CE2 PHE A 67 5.098 -11.478 -4.095 1.00 0.00 C ATOM 1071 CZ PHE A 67 5.657 -12.302 -3.141 1.00 0.00 C ATOM 0 H PHE A 67 6.947 -5.329 -2.747 1.00 0.00 H new ATOM 0 HA PHE A 67 7.977 -8.124 -2.875 1.00 0.00 H new ATOM 0 HB2 PHE A 67 5.659 -7.764 -1.622 1.00 0.00 H new ATOM 0 HB3 PHE A 67 5.052 -7.548 -3.251 1.00 0.00 H new ATOM 0 HD1 PHE A 67 6.828 -9.963 -1.021 1.00 0.00 H new ATOM 0 HD2 PHE A 67 4.719 -9.476 -4.702 1.00 0.00 H new ATOM 0 HE1 PHE A 67 6.711 -12.397 -1.289 1.00 0.00 H new ATOM 0 HE2 PHE A 67 4.612 -11.906 -4.959 1.00 0.00 H new ATOM 0 HZ PHE A 67 5.611 -13.375 -3.258 1.00 0.00 H new ATOM 1081 N THR A 68 7.020 -7.985 -5.487 1.00 0.00 N ATOM 1082 CA THR A 68 6.841 -7.707 -6.930 1.00 0.00 C ATOM 1083 C THR A 68 5.336 -7.652 -7.285 1.00 0.00 C ATOM 1084 O THR A 68 4.874 -6.695 -7.915 1.00 0.00 O ATOM 1085 CB THR A 68 7.561 -8.801 -7.787 1.00 0.00 C ATOM 1086 OG1 THR A 68 7.224 -10.108 -7.288 1.00 0.00 O ATOM 1087 CG2 THR A 68 9.087 -8.633 -7.779 1.00 0.00 C ATOM 0 H THR A 68 6.933 -8.971 -5.240 1.00 0.00 H new ATOM 0 HA THR A 68 7.287 -6.738 -7.155 1.00 0.00 H new ATOM 0 HB THR A 68 7.218 -8.687 -8.815 1.00 0.00 H new ATOM 0 HG1 THR A 68 7.675 -10.790 -7.828 1.00 0.00 H new ATOM 0 HG21 THR A 68 9.542 -9.415 -8.387 1.00 0.00 H new ATOM 0 HG22 THR A 68 9.348 -7.657 -8.188 1.00 0.00 H new ATOM 0 HG23 THR A 68 9.456 -8.708 -6.756 1.00 0.00 H new ATOM 1095 N LYS A 69 4.584 -8.669 -6.816 1.00 0.00 N ATOM 1096 CA LYS A 69 3.118 -8.764 -7.000 1.00 0.00 C ATOM 1097 C LYS A 69 2.372 -7.755 -6.093 1.00 0.00 C ATOM 1098 O LYS A 69 2.558 -7.772 -4.873 1.00 0.00 O ATOM 1099 CB LYS A 69 2.607 -10.212 -6.715 1.00 0.00 C ATOM 1100 CG LYS A 69 1.060 -10.377 -6.738 1.00 0.00 C ATOM 1101 CD LYS A 69 0.567 -11.841 -6.553 1.00 0.00 C ATOM 1102 CE LYS A 69 0.662 -12.701 -7.837 1.00 0.00 C ATOM 1103 NZ LYS A 69 2.058 -12.954 -8.283 1.00 0.00 N ATOM 0 H LYS A 69 4.978 -9.453 -6.296 1.00 0.00 H new ATOM 0 HA LYS A 69 2.907 -8.518 -8.041 1.00 0.00 H new ATOM 0 HB2 LYS A 69 3.041 -10.887 -7.453 1.00 0.00 H new ATOM 0 HB3 LYS A 69 2.977 -10.527 -5.739 1.00 0.00 H new ATOM 0 HG2 LYS A 69 0.629 -9.759 -5.950 1.00 0.00 H new ATOM 0 HG3 LYS A 69 0.680 -9.996 -7.686 1.00 0.00 H new ATOM 0 HD2 LYS A 69 1.153 -12.315 -5.766 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -0.469 -11.825 -6.214 1.00 0.00 H new ATOM 0 HE2 LYS A 69 0.167 -13.656 -7.662 1.00 0.00 H new ATOM 0 HE3 LYS A 69 0.118 -12.202 -8.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 2.109 -13.879 -8.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 2.351 -12.209 -8.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 2.692 -12.951 -7.458 1.00 0.00 H new ATOM 1117 N PRO A 70 1.556 -6.832 -6.692 1.00 0.00 N ATOM 1118 CA PRO A 70 0.534 -6.050 -5.969 1.00 0.00 C ATOM 1119 C PRO A 70 -0.872 -6.681 -6.111 1.00 0.00 C ATOM 1120 O PRO A 70 -1.039 -7.726 -6.751 1.00 0.00 O ATOM 1121 CB PRO A 70 0.615 -4.700 -6.702 1.00 0.00 C ATOM 1122 CG PRO A 70 0.870 -5.066 -8.145 1.00 0.00 C ATOM 1123 CD PRO A 70 1.600 -6.414 -8.126 1.00 0.00 C ATOM 0 HA PRO A 70 0.700 -5.989 -4.893 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -0.310 -4.134 -6.594 1.00 0.00 H new ATOM 0 HB3 PRO A 70 1.417 -4.079 -6.303 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -0.066 -5.139 -8.699 1.00 0.00 H new ATOM 0 HG3 PRO A 70 1.474 -4.304 -8.638 1.00 0.00 H new ATOM 0 HD2 PRO A 70 1.107 -7.143 -8.769 1.00 0.00 H new ATOM 0 HD3 PRO A 70 2.626 -6.317 -8.482 1.00 0.00 H new ATOM 1131 N ILE A 71 -1.869 -6.044 -5.491 1.00 0.00 N ATOM 1132 CA ILE A 71 -3.284 -6.301 -5.771 1.00 0.00 C ATOM 1133 C ILE A 71 -3.707 -5.290 -6.850 1.00 0.00 C ATOM 1134 O ILE A 71 -4.068 -4.149 -6.554 1.00 0.00 O ATOM 1135 CB ILE A 71 -4.177 -6.198 -4.479 1.00 0.00 C ATOM 1136 CG1 ILE A 71 -3.775 -7.332 -3.479 1.00 0.00 C ATOM 1137 CG2 ILE A 71 -5.696 -6.241 -4.815 1.00 0.00 C ATOM 1138 CD1 ILE A 71 -4.576 -7.388 -2.192 1.00 0.00 C ATOM 0 H ILE A 71 -1.716 -5.332 -4.777 1.00 0.00 H new ATOM 0 HA ILE A 71 -3.424 -7.323 -6.124 1.00 0.00 H new ATOM 0 HB ILE A 71 -3.998 -5.231 -4.009 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -3.872 -8.291 -3.988 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -2.722 -7.211 -3.225 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -6.275 -6.167 -3.894 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -5.948 -5.407 -5.470 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -5.931 -7.180 -5.317 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -4.214 -8.210 -1.574 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -4.461 -6.449 -1.651 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -5.629 -7.546 -2.425 1.00 0.00 H new ATOM 1150 N GLU A 72 -3.694 -5.757 -8.103 1.00 0.00 N ATOM 1151 CA GLU A 72 -3.698 -4.890 -9.300 1.00 0.00 C ATOM 1152 C GLU A 72 -5.075 -4.228 -9.516 1.00 0.00 C ATOM 1153 O GLU A 72 -5.198 -3.274 -10.276 1.00 0.00 O ATOM 1154 CB GLU A 72 -3.281 -5.721 -10.544 1.00 0.00 C ATOM 1155 CG GLU A 72 -4.238 -6.878 -10.890 1.00 0.00 C ATOM 1156 CD GLU A 72 -3.787 -7.711 -12.094 1.00 0.00 C ATOM 1157 OE1 GLU A 72 -4.012 -7.284 -13.244 1.00 0.00 O ATOM 1158 OE2 GLU A 72 -3.197 -8.794 -11.899 1.00 0.00 O ATOM 0 H GLU A 72 -3.680 -6.753 -8.323 1.00 0.00 H new ATOM 0 HA GLU A 72 -2.977 -4.086 -9.148 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -3.211 -5.054 -11.404 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -2.284 -6.129 -10.375 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -4.333 -7.531 -10.023 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -5.229 -6.470 -11.092 1.00 0.00 H new ATOM 1165 N GLU A 73 -6.102 -4.768 -8.834 1.00 0.00 N ATOM 1166 CA GLU A 73 -7.476 -4.273 -8.915 1.00 0.00 C ATOM 1167 C GLU A 73 -7.605 -2.877 -8.288 1.00 0.00 C ATOM 1168 O GLU A 73 -8.306 -2.017 -8.820 1.00 0.00 O ATOM 1169 CB GLU A 73 -8.423 -5.258 -8.194 1.00 0.00 C ATOM 1170 CG GLU A 73 -8.347 -6.710 -8.705 1.00 0.00 C ATOM 1171 CD GLU A 73 -8.590 -6.839 -10.221 1.00 0.00 C ATOM 1172 OE1 GLU A 73 -9.750 -6.674 -10.660 1.00 0.00 O ATOM 1173 OE2 GLU A 73 -7.629 -7.093 -10.976 1.00 0.00 O ATOM 0 H GLU A 73 -5.994 -5.566 -8.208 1.00 0.00 H new ATOM 0 HA GLU A 73 -7.750 -4.197 -9.967 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -8.193 -5.249 -7.129 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -9.447 -4.902 -8.302 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -7.366 -7.121 -8.466 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -9.083 -7.313 -8.174 1.00 0.00 H new ATOM 1180 N GLU A 74 -6.956 -2.686 -7.116 1.00 0.00 N ATOM 1181 CA GLU A 74 -7.045 -1.429 -6.341 1.00 0.00 C ATOM 1182 C GLU A 74 -5.825 -0.532 -6.585 1.00 0.00 C ATOM 1183 O GLU A 74 -5.861 0.681 -6.317 1.00 0.00 O ATOM 1184 CB GLU A 74 -7.172 -1.778 -4.840 1.00 0.00 C ATOM 1185 CG GLU A 74 -8.272 -2.808 -4.523 1.00 0.00 C ATOM 1186 CD GLU A 74 -9.685 -2.386 -4.966 1.00 0.00 C ATOM 1187 OE1 GLU A 74 -10.346 -1.609 -4.240 1.00 0.00 O ATOM 1188 OE2 GLU A 74 -10.148 -2.837 -6.038 1.00 0.00 O ATOM 0 H GLU A 74 -6.361 -3.393 -6.685 1.00 0.00 H new ATOM 0 HA GLU A 74 -7.923 -0.872 -6.668 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -6.216 -2.163 -4.486 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -7.374 -0.864 -4.282 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -8.019 -3.752 -5.007 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.281 -2.993 -3.449 1.00 0.00 H new ATOM 1195 N VAL A 75 -4.753 -1.142 -7.095 1.00 0.00 N ATOM 1196 CA VAL A 75 -3.492 -0.466 -7.367 1.00 0.00 C ATOM 1197 C VAL A 75 -3.489 0.062 -8.812 1.00 0.00 C ATOM 1198 O VAL A 75 -3.815 -0.674 -9.745 1.00 0.00 O ATOM 1199 CB VAL A 75 -2.293 -1.448 -7.111 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -0.959 -0.838 -7.557 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -2.241 -1.852 -5.616 1.00 0.00 C ATOM 0 H VAL A 75 -4.741 -2.134 -7.333 1.00 0.00 H new ATOM 0 HA VAL A 75 -3.377 0.385 -6.695 1.00 0.00 H new ATOM 0 HB VAL A 75 -2.458 -2.343 -7.711 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.153 -1.546 -7.364 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.999 -0.615 -8.623 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -0.775 0.081 -7.001 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -1.406 -2.533 -5.452 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -2.109 -0.961 -5.003 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -3.172 -2.347 -5.340 1.00 0.00 H new ATOM 1211 N GLU A 76 -3.157 1.351 -8.969 1.00 0.00 N ATOM 1212 CA GLU A 76 -3.004 1.999 -10.277 1.00 0.00 C ATOM 1213 C GLU A 76 -1.542 2.352 -10.467 1.00 0.00 C ATOM 1214 O GLU A 76 -0.994 3.117 -9.683 1.00 0.00 O ATOM 1215 CB GLU A 76 -3.881 3.275 -10.367 1.00 0.00 C ATOM 1216 CG GLU A 76 -5.387 2.999 -10.483 1.00 0.00 C ATOM 1217 CD GLU A 76 -5.770 2.274 -11.794 1.00 0.00 C ATOM 1218 OE1 GLU A 76 -5.908 2.947 -12.834 1.00 0.00 O ATOM 1219 OE2 GLU A 76 -5.950 1.037 -11.785 1.00 0.00 O ATOM 0 H GLU A 76 -2.986 1.978 -8.183 1.00 0.00 H new ATOM 0 HA GLU A 76 -3.331 1.318 -11.062 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -3.703 3.887 -9.483 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.563 3.860 -11.230 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -5.706 2.395 -9.634 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -5.929 3.943 -10.425 1.00 0.00 H new ATOM 1226 N GLU A 77 -0.927 1.810 -11.514 1.00 0.00 N ATOM 1227 CA GLU A 77 0.476 2.073 -11.842 1.00 0.00 C ATOM 1228 C GLU A 77 0.540 3.315 -12.756 1.00 0.00 C ATOM 1229 O GLU A 77 -0.006 3.311 -13.863 1.00 0.00 O ATOM 1230 CB GLU A 77 1.168 0.821 -12.479 1.00 0.00 C ATOM 1231 CG GLU A 77 0.574 0.271 -13.804 1.00 0.00 C ATOM 1232 CD GLU A 77 -0.787 -0.430 -13.653 1.00 0.00 C ATOM 1233 OE1 GLU A 77 -0.810 -1.582 -13.184 1.00 0.00 O ATOM 1234 OE2 GLU A 77 -1.836 0.171 -13.983 1.00 0.00 O ATOM 0 H GLU A 77 -1.388 1.173 -12.164 1.00 0.00 H new ATOM 0 HA GLU A 77 1.035 2.278 -10.929 1.00 0.00 H new ATOM 0 HB2 GLU A 77 2.214 1.069 -12.657 1.00 0.00 H new ATOM 0 HB3 GLU A 77 1.151 0.017 -11.743 1.00 0.00 H new ATOM 0 HG2 GLU A 77 0.467 1.096 -14.509 1.00 0.00 H new ATOM 0 HG3 GLU A 77 1.283 -0.432 -14.241 1.00 0.00 H new ATOM 1241 N LYS A 78 1.170 4.394 -12.258 1.00 0.00 N ATOM 1242 CA LYS A 78 1.194 5.710 -12.923 1.00 0.00 C ATOM 1243 C LYS A 78 2.647 6.101 -13.197 1.00 0.00 C ATOM 1244 O LYS A 78 3.391 6.363 -12.253 1.00 0.00 O ATOM 1245 CB LYS A 78 0.507 6.773 -12.014 1.00 0.00 C ATOM 1246 CG LYS A 78 -0.952 6.435 -11.624 1.00 0.00 C ATOM 1247 CD LYS A 78 -1.917 6.400 -12.830 1.00 0.00 C ATOM 1248 CE LYS A 78 -2.109 7.782 -13.476 1.00 0.00 C ATOM 1249 NZ LYS A 78 -3.029 7.721 -14.625 1.00 0.00 N ATOM 0 H LYS A 78 1.681 4.377 -11.375 1.00 0.00 H new ATOM 0 HA LYS A 78 0.650 5.660 -13.866 1.00 0.00 H new ATOM 0 HB2 LYS A 78 1.096 6.890 -11.104 1.00 0.00 H new ATOM 0 HB3 LYS A 78 0.519 7.735 -12.527 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -0.972 5.467 -11.124 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -1.308 7.172 -10.904 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -1.534 5.704 -13.577 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -2.885 6.018 -12.505 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -2.498 8.480 -12.735 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -1.144 8.169 -13.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -3.135 8.671 -15.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -2.645 7.074 -15.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -3.957 7.375 -14.308 1.00 0.00 H new ATOM 1263 N LEU A 79 3.048 6.099 -14.480 1.00 0.00 N ATOM 1264 CA LEU A 79 4.434 6.380 -14.896 1.00 0.00 C ATOM 1265 C LEU A 79 4.879 7.764 -14.387 1.00 0.00 C ATOM 1266 O LEU A 79 4.201 8.770 -14.615 1.00 0.00 O ATOM 1267 CB LEU A 79 4.576 6.316 -16.440 1.00 0.00 C ATOM 1268 CG LEU A 79 6.038 6.456 -16.982 1.00 0.00 C ATOM 1269 CD1 LEU A 79 6.913 5.252 -16.562 1.00 0.00 C ATOM 1270 CD2 LEU A 79 6.056 6.662 -18.511 1.00 0.00 C ATOM 0 H LEU A 79 2.420 5.902 -15.259 1.00 0.00 H new ATOM 0 HA LEU A 79 5.076 5.616 -14.458 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.166 5.368 -16.787 1.00 0.00 H new ATOM 0 HB3 LEU A 79 3.966 7.106 -16.878 1.00 0.00 H new ATOM 0 HG LEU A 79 6.471 7.348 -16.529 1.00 0.00 H new ATOM 0 HD11 LEU A 79 7.922 5.381 -16.955 1.00 0.00 H new ATOM 0 HD12 LEU A 79 6.952 5.192 -15.474 1.00 0.00 H new ATOM 0 HD13 LEU A 79 6.483 4.333 -16.961 1.00 0.00 H new ATOM 0 HD21 LEU A 79 7.087 6.755 -18.853 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.588 5.807 -18.999 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.507 7.569 -18.762 1.00 0.00 H new ATOM 1282 N ASP A 80 6.019 7.784 -13.689 1.00 0.00 N ATOM 1283 CA ASP A 80 6.539 8.967 -12.997 1.00 0.00 C ATOM 1284 C ASP A 80 8.013 9.209 -13.378 1.00 0.00 C ATOM 1285 O ASP A 80 8.759 8.267 -13.659 1.00 0.00 O ATOM 1286 CB ASP A 80 6.381 8.778 -11.464 1.00 0.00 C ATOM 1287 CG ASP A 80 6.875 9.990 -10.665 1.00 0.00 C ATOM 1288 OD1 ASP A 80 6.189 11.031 -10.675 1.00 0.00 O ATOM 1289 OD2 ASP A 80 7.963 9.928 -10.058 1.00 0.00 O ATOM 0 H ASP A 80 6.617 6.964 -13.587 1.00 0.00 H new ATOM 0 HA ASP A 80 5.970 9.845 -13.302 1.00 0.00 H new ATOM 0 HB2 ASP A 80 5.332 8.597 -11.230 1.00 0.00 H new ATOM 0 HB3 ASP A 80 6.934 7.892 -11.152 1.00 0.00 H new ATOM 1294 N THR A 81 8.415 10.487 -13.398 1.00 0.00 N ATOM 1295 CA THR A 81 9.792 10.920 -13.719 1.00 0.00 C ATOM 1296 C THR A 81 10.234 12.074 -12.785 1.00 0.00 C ATOM 1297 O THR A 81 11.247 12.741 -13.047 1.00 0.00 O ATOM 1298 CB THR A 81 9.890 11.375 -15.221 1.00 0.00 C ATOM 1299 OG1 THR A 81 8.872 12.347 -15.489 1.00 0.00 O ATOM 1300 CG2 THR A 81 9.742 10.200 -16.213 1.00 0.00 C ATOM 0 H THR A 81 7.788 11.264 -13.189 1.00 0.00 H new ATOM 0 HA THR A 81 10.459 10.072 -13.564 1.00 0.00 H new ATOM 0 HB THR A 81 10.883 11.800 -15.365 1.00 0.00 H new ATOM 0 HG1 THR A 81 8.932 12.634 -16.424 1.00 0.00 H new ATOM 0 HG21 THR A 81 9.818 10.574 -17.234 1.00 0.00 H new ATOM 0 HG22 THR A 81 10.532 9.471 -16.034 1.00 0.00 H new ATOM 0 HG23 THR A 81 8.771 9.725 -16.072 1.00 0.00 H new ATOM 1308 N SER A 82 9.503 12.264 -11.661 1.00 0.00 N ATOM 1309 CA SER A 82 9.750 13.367 -10.707 1.00 0.00 C ATOM 1310 C SER A 82 11.071 13.171 -9.920 1.00 0.00 C ATOM 1311 O SER A 82 11.585 14.124 -9.331 1.00 0.00 O ATOM 1312 CB SER A 82 8.557 13.495 -9.731 1.00 0.00 C ATOM 1313 OG SER A 82 7.338 13.711 -10.420 1.00 0.00 O ATOM 0 H SER A 82 8.728 11.658 -11.392 1.00 0.00 H new ATOM 0 HA SER A 82 9.850 14.287 -11.283 1.00 0.00 H new ATOM 0 HB2 SER A 82 8.480 12.589 -9.130 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.737 14.320 -9.042 1.00 0.00 H new ATOM 0 HG SER A 82 6.881 12.854 -10.552 1.00 0.00 H new ATOM 1319 N HIS A 83 11.610 11.931 -9.922 1.00 0.00 N ATOM 1320 CA HIS A 83 12.902 11.605 -9.268 1.00 0.00 C ATOM 1321 C HIS A 83 14.090 11.924 -10.210 1.00 0.00 C ATOM 1322 O HIS A 83 15.253 11.852 -9.802 1.00 0.00 O ATOM 1323 CB HIS A 83 12.898 10.108 -8.844 1.00 0.00 C ATOM 1324 CG HIS A 83 14.011 9.684 -7.903 1.00 0.00 C ATOM 1325 ND1 HIS A 83 13.928 9.813 -6.532 1.00 0.00 N ATOM 1326 CD2 HIS A 83 15.211 9.098 -8.144 1.00 0.00 C ATOM 1327 CE1 HIS A 83 15.023 9.326 -5.975 1.00 0.00 C ATOM 1328 NE2 HIS A 83 15.816 8.883 -6.930 1.00 0.00 N ATOM 0 H HIS A 83 11.167 11.131 -10.373 1.00 0.00 H new ATOM 0 HA HIS A 83 13.024 12.221 -8.377 1.00 0.00 H new ATOM 0 HB2 HIS A 83 11.942 9.887 -8.368 1.00 0.00 H new ATOM 0 HB3 HIS A 83 12.955 9.495 -9.744 1.00 0.00 H new ATOM 0 HD2 HIS A 83 15.616 8.847 -9.113 1.00 0.00 H new ATOM 0 HE1 HIS A 83 15.233 9.296 -4.916 1.00 0.00 H new ATOM 0 HE2 HIS A 83 16.729 8.451 -6.790 1.00 0.00 H new ATOM 1337 N GLY A 84 13.780 12.299 -11.469 1.00 0.00 N ATOM 1338 CA GLY A 84 14.799 12.609 -12.478 1.00 0.00 C ATOM 1339 C GLY A 84 15.205 11.404 -13.315 1.00 0.00 C ATOM 1340 O GLY A 84 16.115 11.495 -14.143 1.00 0.00 O ATOM 0 H GLY A 84 12.822 12.393 -11.807 1.00 0.00 H new ATOM 0 HA2 GLY A 84 14.421 13.390 -13.138 1.00 0.00 H new ATOM 0 HA3 GLY A 84 15.682 13.011 -11.981 1.00 0.00 H new ATOM 1344 N MET A 85 14.518 10.268 -13.094 1.00 0.00 N ATOM 1345 CA MET A 85 14.729 9.002 -13.835 1.00 0.00 C ATOM 1346 C MET A 85 13.367 8.379 -14.168 1.00 0.00 C ATOM 1347 O MET A 85 12.345 8.757 -13.577 1.00 0.00 O ATOM 1348 CB MET A 85 15.563 7.972 -13.006 1.00 0.00 C ATOM 1349 CG MET A 85 16.982 8.408 -12.625 1.00 0.00 C ATOM 1350 SD MET A 85 17.921 7.101 -11.794 1.00 0.00 S ATOM 1351 CE MET A 85 16.852 6.656 -10.422 1.00 0.00 C ATOM 0 H MET A 85 13.788 10.199 -12.385 1.00 0.00 H new ATOM 0 HA MET A 85 15.284 9.237 -14.743 1.00 0.00 H new ATOM 0 HB2 MET A 85 15.016 7.744 -12.091 1.00 0.00 H new ATOM 0 HB3 MET A 85 15.630 7.046 -13.576 1.00 0.00 H new ATOM 0 HG2 MET A 85 17.516 8.716 -13.524 1.00 0.00 H new ATOM 0 HG3 MET A 85 16.926 9.279 -11.973 1.00 0.00 H new ATOM 0 HE1 MET A 85 17.411 6.723 -9.489 1.00 0.00 H new ATOM 0 HE2 MET A 85 16.003 7.338 -10.386 1.00 0.00 H new ATOM 0 HE3 MET A 85 16.493 5.636 -10.557 1.00 0.00 H new ATOM 1361 N ILE A 86 13.377 7.399 -15.089 1.00 0.00 N ATOM 1362 CA ILE A 86 12.183 6.596 -15.423 1.00 0.00 C ATOM 1363 C ILE A 86 11.838 5.669 -14.246 1.00 0.00 C ATOM 1364 O ILE A 86 12.688 4.901 -13.768 1.00 0.00 O ATOM 1365 CB ILE A 86 12.377 5.741 -16.739 1.00 0.00 C ATOM 1366 CG1 ILE A 86 12.695 6.661 -17.958 1.00 0.00 C ATOM 1367 CG2 ILE A 86 11.146 4.828 -17.026 1.00 0.00 C ATOM 1368 CD1 ILE A 86 11.647 7.717 -18.257 1.00 0.00 C ATOM 0 H ILE A 86 14.208 7.141 -15.621 1.00 0.00 H new ATOM 0 HA ILE A 86 11.364 7.291 -15.608 1.00 0.00 H new ATOM 0 HB ILE A 86 13.231 5.084 -16.578 1.00 0.00 H new ATOM 0 HG12 ILE A 86 13.649 7.158 -17.780 1.00 0.00 H new ATOM 0 HG13 ILE A 86 12.822 6.036 -18.842 1.00 0.00 H new ATOM 0 HG21 ILE A 86 11.321 4.258 -17.939 1.00 0.00 H new ATOM 0 HG22 ILE A 86 11.000 4.142 -16.192 1.00 0.00 H new ATOM 0 HG23 ILE A 86 10.256 5.445 -17.148 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.959 8.305 -19.120 1.00 0.00 H new ATOM 0 HD12 ILE A 86 10.694 7.233 -18.472 1.00 0.00 H new ATOM 0 HD13 ILE A 86 11.534 8.372 -17.393 1.00 0.00 H new ATOM 1380 N ARG A 87 10.589 5.769 -13.790 1.00 0.00 N ATOM 1381 CA ARG A 87 10.044 4.969 -12.693 1.00 0.00 C ATOM 1382 C ARG A 87 8.516 5.011 -12.799 1.00 0.00 C ATOM 1383 O ARG A 87 7.971 5.650 -13.684 1.00 0.00 O ATOM 1384 CB ARG A 87 10.514 5.513 -11.312 1.00 0.00 C ATOM 1385 CG ARG A 87 9.982 6.923 -10.973 1.00 0.00 C ATOM 1386 CD ARG A 87 10.493 7.447 -9.626 1.00 0.00 C ATOM 1387 NE ARG A 87 10.159 6.550 -8.498 1.00 0.00 N ATOM 1388 CZ ARG A 87 10.254 6.877 -7.202 1.00 0.00 C ATOM 1389 NH1 ARG A 87 10.531 8.118 -6.830 1.00 0.00 N ATOM 1390 NH2 ARG A 87 10.025 5.966 -6.284 1.00 0.00 N ATOM 0 H ARG A 87 9.913 6.424 -14.182 1.00 0.00 H new ATOM 0 HA ARG A 87 10.403 3.943 -12.769 1.00 0.00 H new ATOM 0 HB2 ARG A 87 10.196 4.820 -10.533 1.00 0.00 H new ATOM 0 HB3 ARG A 87 11.604 5.534 -11.294 1.00 0.00 H new ATOM 0 HG2 ARG A 87 10.276 7.616 -11.762 1.00 0.00 H new ATOM 0 HG3 ARG A 87 8.892 6.901 -10.958 1.00 0.00 H new ATOM 0 HD2 ARG A 87 11.575 7.572 -9.677 1.00 0.00 H new ATOM 0 HD3 ARG A 87 10.066 8.433 -9.439 1.00 0.00 H new ATOM 0 HE ARG A 87 9.831 5.611 -8.724 1.00 0.00 H new ATOM 0 HH11 ARG A 87 10.676 8.841 -7.534 1.00 0.00 H new ATOM 0 HH12 ARG A 87 10.600 8.350 -5.839 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.776 5.016 -6.559 1.00 0.00 H new ATOM 0 HH22 ARG A 87 10.096 6.209 -5.296 1.00 0.00 H new ATOM 1404 N THR A 88 7.835 4.285 -11.924 1.00 0.00 N ATOM 1405 CA THR A 88 6.374 4.317 -11.818 1.00 0.00 C ATOM 1406 C THR A 88 5.977 4.467 -10.347 1.00 0.00 C ATOM 1407 O THR A 88 6.621 3.913 -9.478 1.00 0.00 O ATOM 1408 CB THR A 88 5.758 3.040 -12.481 1.00 0.00 C ATOM 1409 OG1 THR A 88 6.102 3.025 -13.870 1.00 0.00 O ATOM 1410 CG2 THR A 88 4.233 2.949 -12.337 1.00 0.00 C ATOM 0 H THR A 88 8.279 3.651 -11.260 1.00 0.00 H new ATOM 0 HA THR A 88 5.974 5.176 -12.358 1.00 0.00 H new ATOM 0 HB THR A 88 6.173 2.179 -11.958 1.00 0.00 H new ATOM 0 HG1 THR A 88 5.721 2.227 -14.293 1.00 0.00 H new ATOM 0 HG21 THR A 88 3.876 2.039 -12.820 1.00 0.00 H new ATOM 0 HG22 THR A 88 3.968 2.927 -11.280 1.00 0.00 H new ATOM 0 HG23 THR A 88 3.771 3.816 -12.809 1.00 0.00 H new ATOM 1418 N GLU A 89 4.961 5.271 -10.081 1.00 0.00 N ATOM 1419 CA GLU A 89 4.419 5.479 -8.729 1.00 0.00 C ATOM 1420 C GLU A 89 2.978 4.980 -8.706 1.00 0.00 C ATOM 1421 O GLU A 89 2.193 5.327 -9.593 1.00 0.00 O ATOM 1422 CB GLU A 89 4.518 6.979 -8.332 1.00 0.00 C ATOM 1423 CG GLU A 89 4.057 7.293 -6.895 1.00 0.00 C ATOM 1424 CD GLU A 89 4.468 8.694 -6.426 1.00 0.00 C ATOM 1425 OE1 GLU A 89 5.619 8.862 -5.956 1.00 0.00 O ATOM 1426 OE2 GLU A 89 3.662 9.638 -6.535 1.00 0.00 O ATOM 0 H GLU A 89 4.477 5.809 -10.800 1.00 0.00 H new ATOM 0 HA GLU A 89 4.999 4.918 -7.996 1.00 0.00 H new ATOM 0 HB2 GLU A 89 5.552 7.305 -8.447 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.919 7.566 -9.028 1.00 0.00 H new ATOM 0 HG2 GLU A 89 2.972 7.201 -6.839 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.475 6.551 -6.215 1.00 0.00 H new ATOM 1433 N VAL A 90 2.629 4.157 -7.705 1.00 0.00 N ATOM 1434 CA VAL A 90 1.288 3.566 -7.609 1.00 0.00 C ATOM 1435 C VAL A 90 0.395 4.471 -6.762 1.00 0.00 C ATOM 1436 O VAL A 90 0.676 4.747 -5.594 1.00 0.00 O ATOM 1437 CB VAL A 90 1.294 2.075 -7.088 1.00 0.00 C ATOM 1438 CG1 VAL A 90 1.887 1.139 -8.165 1.00 0.00 C ATOM 1439 CG2 VAL A 90 2.048 1.913 -5.753 1.00 0.00 C ATOM 0 H VAL A 90 3.259 3.886 -6.950 1.00 0.00 H new ATOM 0 HA VAL A 90 0.879 3.503 -8.617 1.00 0.00 H new ATOM 0 HB VAL A 90 0.258 1.797 -6.896 1.00 0.00 H new ATOM 0 HG11 VAL A 90 1.887 0.113 -7.796 1.00 0.00 H new ATOM 0 HG12 VAL A 90 1.284 1.199 -9.071 1.00 0.00 H new ATOM 0 HG13 VAL A 90 2.909 1.444 -8.389 1.00 0.00 H new ATOM 0 HG21 VAL A 90 2.019 0.868 -5.443 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.084 2.226 -5.880 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.574 2.531 -4.990 1.00 0.00 H new ATOM 1449 N ARG A 91 -0.660 4.975 -7.405 1.00 0.00 N ATOM 1450 CA ARG A 91 -1.523 6.011 -6.859 1.00 0.00 C ATOM 1451 C ARG A 91 -2.820 6.081 -7.680 1.00 0.00 C ATOM 1452 O ARG A 91 -2.767 6.136 -8.916 1.00 0.00 O ATOM 1453 CB ARG A 91 -0.766 7.378 -6.849 1.00 0.00 C ATOM 1454 CG ARG A 91 -0.136 7.824 -8.193 1.00 0.00 C ATOM 1455 CD ARG A 91 0.622 9.161 -8.070 1.00 0.00 C ATOM 1456 NE ARG A 91 -0.245 10.259 -7.571 1.00 0.00 N ATOM 1457 CZ ARG A 91 0.189 11.368 -6.940 1.00 0.00 C ATOM 1458 NH1 ARG A 91 1.474 11.534 -6.677 1.00 0.00 N ATOM 1459 NH2 ARG A 91 -0.676 12.293 -6.540 1.00 0.00 N ATOM 0 H ARG A 91 -0.939 4.666 -8.336 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.789 5.774 -5.829 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -1.461 8.152 -6.524 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.025 7.326 -6.101 1.00 0.00 H new ATOM 0 HG2 ARG A 91 0.549 7.052 -8.544 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -0.920 7.921 -8.944 1.00 0.00 H new ATOM 0 HD2 ARG A 91 1.469 9.035 -7.395 1.00 0.00 H new ATOM 0 HD3 ARG A 91 1.028 9.436 -9.043 1.00 0.00 H new ATOM 0 HE ARG A 91 -1.250 10.166 -7.718 1.00 0.00 H new ATOM 0 HH11 ARG A 91 2.147 10.819 -6.952 1.00 0.00 H new ATOM 0 HH12 ARG A 91 1.792 12.377 -6.199 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -1.674 12.166 -6.710 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -0.343 13.131 -6.063 1.00 0.00 H new ATOM 1473 N SER A 92 -3.981 6.015 -7.011 1.00 0.00 N ATOM 1474 CA SER A 92 -5.289 6.211 -7.672 1.00 0.00 C ATOM 1475 C SER A 92 -5.794 7.653 -7.426 1.00 0.00 C ATOM 1476 O SER A 92 -5.149 8.438 -6.718 1.00 0.00 O ATOM 1477 CB SER A 92 -6.291 5.135 -7.202 1.00 0.00 C ATOM 1478 OG SER A 92 -7.482 5.145 -7.972 1.00 0.00 O ATOM 0 H SER A 92 -4.045 5.827 -6.010 1.00 0.00 H new ATOM 0 HA SER A 92 -5.181 6.090 -8.750 1.00 0.00 H new ATOM 0 HB2 SER A 92 -5.825 4.152 -7.268 1.00 0.00 H new ATOM 0 HB3 SER A 92 -6.536 5.301 -6.153 1.00 0.00 H new ATOM 0 HG SER A 92 -8.089 4.449 -7.644 1.00 0.00 H new ATOM 1484 N ARG A 93 -6.955 7.988 -8.009 1.00 0.00 N ATOM 1485 CA ARG A 93 -7.375 9.387 -8.202 1.00 0.00 C ATOM 1486 C ARG A 93 -7.970 10.030 -6.927 1.00 0.00 C ATOM 1487 O ARG A 93 -7.442 11.034 -6.436 1.00 0.00 O ATOM 1488 CB ARG A 93 -8.395 9.449 -9.369 1.00 0.00 C ATOM 1489 CG ARG A 93 -8.811 10.880 -9.788 1.00 0.00 C ATOM 1490 CD ARG A 93 -9.763 10.898 -11.002 1.00 0.00 C ATOM 1491 NE ARG A 93 -11.021 10.161 -10.742 1.00 0.00 N ATOM 1492 CZ ARG A 93 -12.249 10.546 -11.115 1.00 0.00 C ATOM 1493 NH1 ARG A 93 -12.432 11.669 -11.794 1.00 0.00 N ATOM 1494 NH2 ARG A 93 -13.294 9.786 -10.805 1.00 0.00 N ATOM 0 H ARG A 93 -7.626 7.303 -8.358 1.00 0.00 H new ATOM 0 HA ARG A 93 -6.484 9.968 -8.441 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -7.968 8.941 -10.234 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -9.289 8.895 -9.083 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -9.296 11.373 -8.945 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -7.918 11.458 -10.025 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -9.997 11.930 -11.262 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -9.259 10.459 -11.863 1.00 0.00 H new ATOM 0 HE ARG A 93 -10.946 9.280 -10.233 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -11.632 12.253 -12.039 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -13.373 11.950 -12.071 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -13.158 8.918 -10.287 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -14.233 10.071 -11.085 1.00 0.00 H new ATOM 1508 N THR A 94 -9.045 9.428 -6.384 1.00 0.00 N ATOM 1509 CA THR A 94 -9.933 10.099 -5.409 1.00 0.00 C ATOM 1510 C THR A 94 -9.263 10.330 -4.027 1.00 0.00 C ATOM 1511 O THR A 94 -9.026 11.482 -3.631 1.00 0.00 O ATOM 1512 CB THR A 94 -11.266 9.291 -5.250 1.00 0.00 C ATOM 1513 OG1 THR A 94 -11.914 9.193 -6.532 1.00 0.00 O ATOM 1514 CG2 THR A 94 -12.231 9.938 -4.239 1.00 0.00 C ATOM 0 H THR A 94 -9.323 8.472 -6.605 1.00 0.00 H new ATOM 0 HA THR A 94 -10.151 11.089 -5.810 1.00 0.00 H new ATOM 0 HB THR A 94 -11.009 8.303 -4.868 1.00 0.00 H new ATOM 0 HG1 THR A 94 -12.748 8.687 -6.439 1.00 0.00 H new ATOM 0 HG21 THR A 94 -13.138 9.338 -4.167 1.00 0.00 H new ATOM 0 HG22 THR A 94 -11.752 9.990 -3.261 1.00 0.00 H new ATOM 0 HG23 THR A 94 -12.486 10.944 -4.572 1.00 0.00 H new ATOM 1522 N ALA A 95 -8.954 9.243 -3.307 1.00 0.00 N ATOM 1523 CA ALA A 95 -8.359 9.297 -1.943 1.00 0.00 C ATOM 1524 C ALA A 95 -7.022 8.540 -1.897 1.00 0.00 C ATOM 1525 O ALA A 95 -6.213 8.716 -0.989 1.00 0.00 O ATOM 1526 CB ALA A 95 -9.351 8.713 -0.916 1.00 0.00 C ATOM 0 H ALA A 95 -9.106 8.293 -3.646 1.00 0.00 H new ATOM 0 HA ALA A 95 -8.161 10.339 -1.690 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -8.910 8.755 0.080 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -10.273 9.294 -0.930 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -9.571 7.677 -1.172 1.00 0.00 H new ATOM 1532 N ASP A 96 -6.812 7.734 -2.930 1.00 0.00 N ATOM 1533 CA ASP A 96 -5.931 6.552 -2.912 1.00 0.00 C ATOM 1534 C ASP A 96 -4.557 6.853 -3.530 1.00 0.00 C ATOM 1535 O ASP A 96 -3.808 5.937 -3.846 1.00 0.00 O ATOM 1536 CB ASP A 96 -6.638 5.359 -3.635 1.00 0.00 C ATOM 1537 CG ASP A 96 -8.176 5.490 -3.642 1.00 0.00 C ATOM 1538 OD1 ASP A 96 -8.716 6.182 -4.539 1.00 0.00 O ATOM 1539 OD2 ASP A 96 -8.847 4.954 -2.747 1.00 0.00 O ATOM 0 H ASP A 96 -7.259 7.881 -3.835 1.00 0.00 H new ATOM 0 HA ASP A 96 -5.747 6.274 -1.874 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -6.279 5.298 -4.662 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -6.360 4.426 -3.144 1.00 0.00 H new ATOM 1544 N SER A 97 -4.239 8.141 -3.753 1.00 0.00 N ATOM 1545 CA SER A 97 -2.904 8.562 -4.260 1.00 0.00 C ATOM 1546 C SER A 97 -1.753 8.236 -3.265 1.00 0.00 C ATOM 1547 O SER A 97 -0.570 8.361 -3.598 1.00 0.00 O ATOM 1548 CB SER A 97 -2.925 10.069 -4.591 1.00 0.00 C ATOM 1549 OG SER A 97 -3.277 10.845 -3.460 1.00 0.00 O ATOM 0 H SER A 97 -4.884 8.915 -3.592 1.00 0.00 H new ATOM 0 HA SER A 97 -2.702 7.989 -5.165 1.00 0.00 H new ATOM 0 HB2 SER A 97 -1.944 10.376 -4.953 1.00 0.00 H new ATOM 0 HB3 SER A 97 -3.635 10.256 -5.397 1.00 0.00 H new ATOM 0 HG SER A 97 -3.279 11.794 -3.703 1.00 0.00 H new ATOM 1555 N HIS A 98 -2.135 7.825 -2.051 1.00 0.00 N ATOM 1556 CA HIS A 98 -1.245 7.592 -0.911 1.00 0.00 C ATOM 1557 C HIS A 98 -0.655 6.169 -0.870 1.00 0.00 C ATOM 1558 O HIS A 98 0.049 5.858 0.101 1.00 0.00 O ATOM 1559 CB HIS A 98 -2.024 7.911 0.385 1.00 0.00 C ATOM 1560 CG HIS A 98 -2.639 9.277 0.349 1.00 0.00 C ATOM 1561 ND1 HIS A 98 -3.988 9.498 0.383 1.00 0.00 N ATOM 1562 CD2 HIS A 98 -2.066 10.487 0.237 1.00 0.00 C ATOM 1563 CE1 HIS A 98 -4.219 10.790 0.292 1.00 0.00 C ATOM 1564 NE2 HIS A 98 -3.069 11.416 0.201 1.00 0.00 N ATOM 0 H HIS A 98 -3.113 7.638 -1.828 1.00 0.00 H new ATOM 0 HA HIS A 98 -0.383 8.252 -1.014 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -2.806 7.165 0.531 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -1.351 7.839 1.239 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -1.006 10.689 0.185 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -5.193 11.258 0.292 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -2.944 12.425 0.118 1.00 0.00 H new ATOM 1573 N LEU A 99 -0.993 5.295 -1.871 1.00 0.00 N ATOM 1574 CA LEU A 99 -0.493 3.886 -1.921 1.00 0.00 C ATOM 1575 C LEU A 99 1.041 3.824 -1.672 1.00 0.00 C ATOM 1576 O LEU A 99 1.491 3.433 -0.591 1.00 0.00 O ATOM 1577 CB LEU A 99 -0.802 3.176 -3.292 1.00 0.00 C ATOM 1578 CG LEU A 99 -2.238 3.302 -3.885 1.00 0.00 C ATOM 1579 CD1 LEU A 99 -2.380 2.529 -5.217 1.00 0.00 C ATOM 1580 CD2 LEU A 99 -3.315 2.874 -2.884 1.00 0.00 C ATOM 0 H LEU A 99 -1.606 5.543 -2.648 1.00 0.00 H new ATOM 0 HA LEU A 99 -1.026 3.359 -1.130 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -0.102 3.564 -4.032 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -0.584 2.115 -3.173 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.393 4.360 -4.098 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -3.395 2.642 -5.597 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -1.673 2.927 -5.946 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -2.171 1.472 -5.049 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.299 2.979 -3.341 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -3.155 1.834 -2.601 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.258 3.505 -1.997 1.00 0.00 H new ATOM 1592 N GLY A 100 1.823 4.272 -2.666 1.00 0.00 N ATOM 1593 CA GLY A 100 3.278 4.124 -2.638 1.00 0.00 C ATOM 1594 C GLY A 100 3.871 4.280 -4.019 1.00 0.00 C ATOM 1595 O GLY A 100 3.286 4.952 -4.873 1.00 0.00 O ATOM 0 H GLY A 100 1.467 4.740 -3.499 1.00 0.00 H new ATOM 0 HA2 GLY A 100 3.709 4.868 -1.968 1.00 0.00 H new ATOM 0 HA3 GLY A 100 3.539 3.145 -2.236 1.00 0.00 H new ATOM 1599 N HIS A 101 5.049 3.696 -4.237 1.00 0.00 N ATOM 1600 CA HIS A 101 5.756 3.737 -5.531 1.00 0.00 C ATOM 1601 C HIS A 101 6.302 2.343 -5.884 1.00 0.00 C ATOM 1602 O HIS A 101 6.346 1.442 -5.034 1.00 0.00 O ATOM 1603 CB HIS A 101 6.890 4.790 -5.485 1.00 0.00 C ATOM 1604 CG HIS A 101 7.811 4.627 -4.304 1.00 0.00 C ATOM 1605 ND1 HIS A 101 8.853 3.725 -4.270 1.00 0.00 N ATOM 1606 CD2 HIS A 101 7.823 5.245 -3.101 1.00 0.00 C ATOM 1607 CE1 HIS A 101 9.459 3.802 -3.103 1.00 0.00 C ATOM 1608 NE2 HIS A 101 8.853 4.715 -2.382 1.00 0.00 N ATOM 0 H HIS A 101 5.550 3.174 -3.518 1.00 0.00 H new ATOM 0 HA HIS A 101 5.055 4.030 -6.312 1.00 0.00 H new ATOM 0 HB2 HIS A 101 7.474 4.725 -6.403 1.00 0.00 H new ATOM 0 HB3 HIS A 101 6.449 5.787 -5.458 1.00 0.00 H new ATOM 0 HD2 HIS A 101 7.142 6.016 -2.771 1.00 0.00 H new ATOM 0 HE1 HIS A 101 10.310 3.214 -2.793 1.00 0.00 H new ATOM 0 HE2 HIS A 101 9.112 4.986 -1.433 1.00 0.00 H new ATOM 1617 N VAL A 102 6.699 2.178 -7.149 1.00 0.00 N ATOM 1618 CA VAL A 102 7.365 0.959 -7.650 1.00 0.00 C ATOM 1619 C VAL A 102 8.617 1.372 -8.439 1.00 0.00 C ATOM 1620 O VAL A 102 8.733 2.525 -8.874 1.00 0.00 O ATOM 1621 CB VAL A 102 6.425 0.036 -8.532 1.00 0.00 C ATOM 1622 CG1 VAL A 102 5.145 -0.372 -7.766 1.00 0.00 C ATOM 1623 CG2 VAL A 102 6.067 0.691 -9.877 1.00 0.00 C ATOM 0 H VAL A 102 6.568 2.891 -7.866 1.00 0.00 H new ATOM 0 HA VAL A 102 7.636 0.353 -6.785 1.00 0.00 H new ATOM 0 HB VAL A 102 6.993 -0.869 -8.748 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.526 -1.004 -8.403 1.00 0.00 H new ATOM 0 HG12 VAL A 102 5.419 -0.922 -6.866 1.00 0.00 H new ATOM 0 HG13 VAL A 102 4.586 0.522 -7.489 1.00 0.00 H new ATOM 0 HG21 VAL A 102 5.422 0.022 -10.447 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.546 1.631 -9.697 1.00 0.00 H new ATOM 0 HG23 VAL A 102 6.979 0.884 -10.442 1.00 0.00 H new ATOM 1633 N PHE A 103 9.583 0.460 -8.598 1.00 0.00 N ATOM 1634 CA PHE A 103 10.796 0.751 -9.378 1.00 0.00 C ATOM 1635 C PHE A 103 10.818 -0.113 -10.644 1.00 0.00 C ATOM 1636 O PHE A 103 10.777 -1.339 -10.560 1.00 0.00 O ATOM 1637 CB PHE A 103 12.075 0.542 -8.504 1.00 0.00 C ATOM 1638 CG PHE A 103 13.275 1.433 -8.873 1.00 0.00 C ATOM 1639 CD1 PHE A 103 13.096 2.674 -9.508 1.00 0.00 C ATOM 1640 CD2 PHE A 103 14.579 1.054 -8.547 1.00 0.00 C ATOM 1641 CE1 PHE A 103 14.177 3.487 -9.806 1.00 0.00 C ATOM 1642 CE2 PHE A 103 15.655 1.872 -8.839 1.00 0.00 C ATOM 1643 CZ PHE A 103 15.454 3.088 -9.471 1.00 0.00 C ATOM 0 H PHE A 103 9.551 -0.479 -8.201 1.00 0.00 H new ATOM 0 HA PHE A 103 10.787 1.797 -9.686 1.00 0.00 H new ATOM 0 HB2 PHE A 103 11.816 0.723 -7.461 1.00 0.00 H new ATOM 0 HB3 PHE A 103 12.381 -0.501 -8.580 1.00 0.00 H new ATOM 0 HD1 PHE A 103 12.099 2.999 -9.768 1.00 0.00 H new ATOM 0 HD2 PHE A 103 14.750 0.106 -8.059 1.00 0.00 H new ATOM 0 HE1 PHE A 103 14.020 4.434 -10.301 1.00 0.00 H new ATOM 0 HE2 PHE A 103 16.655 1.562 -8.574 1.00 0.00 H new ATOM 0 HZ PHE A 103 16.297 3.723 -9.701 1.00 0.00 H new ATOM 1653 N ASN A 104 10.888 0.562 -11.811 1.00 0.00 N ATOM 1654 CA ASN A 104 10.987 -0.074 -13.150 1.00 0.00 C ATOM 1655 C ASN A 104 12.405 -0.651 -13.383 1.00 0.00 C ATOM 1656 O ASN A 104 12.674 -1.286 -14.408 1.00 0.00 O ATOM 1657 CB ASN A 104 10.634 0.966 -14.261 1.00 0.00 C ATOM 1658 CG ASN A 104 9.233 1.572 -14.122 1.00 0.00 C ATOM 1659 OD1 ASN A 104 8.721 1.746 -13.014 1.00 0.00 O ATOM 1660 ND2 ASN A 104 8.603 1.885 -15.244 1.00 0.00 N ATOM 0 H ASN A 104 10.877 1.581 -11.854 1.00 0.00 H new ATOM 0 HA ASN A 104 10.275 -0.898 -13.195 1.00 0.00 H new ATOM 0 HB2 ASN A 104 11.370 1.769 -14.240 1.00 0.00 H new ATOM 0 HB3 ASN A 104 10.716 0.484 -15.235 1.00 0.00 H new ATOM 0 HD21 ASN A 104 7.665 2.283 -15.208 1.00 0.00 H new ATOM 0 HD22 ASN A 104 9.056 1.728 -16.144 1.00 0.00 H new ATOM 1667 N ASP A 105 13.286 -0.421 -12.392 1.00 0.00 N ATOM 1668 CA ASP A 105 14.678 -0.875 -12.374 1.00 0.00 C ATOM 1669 C ASP A 105 14.824 -1.952 -11.267 1.00 0.00 C ATOM 1670 O ASP A 105 15.871 -2.093 -10.625 1.00 0.00 O ATOM 1671 CB ASP A 105 15.576 0.377 -12.139 1.00 0.00 C ATOM 1672 CG ASP A 105 17.063 0.123 -12.385 1.00 0.00 C ATOM 1673 OD1 ASP A 105 17.448 -0.027 -13.559 1.00 0.00 O ATOM 1674 OD2 ASP A 105 17.851 0.076 -11.419 1.00 0.00 O ATOM 0 H ASP A 105 13.034 0.105 -11.555 1.00 0.00 H new ATOM 0 HA ASP A 105 14.987 -1.336 -13.312 1.00 0.00 H new ATOM 0 HB2 ASP A 105 15.241 1.181 -12.794 1.00 0.00 H new ATOM 0 HB3 ASP A 105 15.440 0.723 -11.114 1.00 0.00 H new ATOM 1679 N GLY A 106 13.736 -2.739 -11.077 1.00 0.00 N ATOM 1680 CA GLY A 106 13.656 -3.752 -10.026 1.00 0.00 C ATOM 1681 C GLY A 106 13.185 -5.091 -10.602 1.00 0.00 C ATOM 1682 O GLY A 106 11.979 -5.320 -10.658 1.00 0.00 O ATOM 0 H GLY A 106 12.897 -2.680 -11.654 1.00 0.00 H new ATOM 0 HA2 GLY A 106 14.632 -3.875 -9.557 1.00 0.00 H new ATOM 0 HA3 GLY A 106 12.968 -3.423 -9.248 1.00 0.00 H new ATOM 1686 N PRO A 107 14.128 -6.003 -11.045 1.00 0.00 N ATOM 1687 CA PRO A 107 13.782 -7.261 -11.784 1.00 0.00 C ATOM 1688 C PRO A 107 12.810 -8.190 -11.009 1.00 0.00 C ATOM 1689 O PRO A 107 12.922 -8.351 -9.794 1.00 0.00 O ATOM 1690 CB PRO A 107 15.168 -7.949 -12.008 1.00 0.00 C ATOM 1691 CG PRO A 107 16.075 -7.318 -10.995 1.00 0.00 C ATOM 1692 CD PRO A 107 15.597 -5.888 -10.861 1.00 0.00 C ATOM 0 HA PRO A 107 13.247 -7.044 -12.709 1.00 0.00 H new ATOM 0 HB2 PRO A 107 15.103 -9.027 -11.863 1.00 0.00 H new ATOM 0 HB3 PRO A 107 15.532 -7.785 -13.022 1.00 0.00 H new ATOM 0 HG2 PRO A 107 16.021 -7.841 -10.040 1.00 0.00 H new ATOM 0 HG3 PRO A 107 17.114 -7.356 -11.321 1.00 0.00 H new ATOM 0 HD2 PRO A 107 15.849 -5.469 -9.887 1.00 0.00 H new ATOM 0 HD3 PRO A 107 16.048 -5.241 -11.613 1.00 0.00 H new ATOM 1700 N GLY A 108 11.871 -8.787 -11.749 1.00 0.00 N ATOM 1701 CA GLY A 108 10.864 -9.685 -11.189 1.00 0.00 C ATOM 1702 C GLY A 108 9.962 -10.239 -12.289 1.00 0.00 C ATOM 1703 O GLY A 108 10.201 -9.937 -13.467 1.00 0.00 O ATOM 0 H GLY A 108 11.790 -8.659 -12.758 1.00 0.00 H new ATOM 0 HA2 GLY A 108 11.353 -10.506 -10.665 1.00 0.00 H new ATOM 0 HA3 GLY A 108 10.262 -9.151 -10.453 1.00 0.00 H new ATOM 1707 N PRO A 109 8.894 -11.036 -11.946 1.00 0.00 N ATOM 1708 CA PRO A 109 7.905 -11.556 -12.945 1.00 0.00 C ATOM 1709 C PRO A 109 7.162 -10.413 -13.681 1.00 0.00 C ATOM 1710 O PRO A 109 6.717 -10.571 -14.821 1.00 0.00 O ATOM 1711 CB PRO A 109 6.934 -12.423 -12.075 1.00 0.00 C ATOM 1712 CG PRO A 109 7.124 -11.922 -10.672 1.00 0.00 C ATOM 1713 CD PRO A 109 8.581 -11.516 -10.576 1.00 0.00 C ATOM 0 HA PRO A 109 8.377 -12.125 -13.746 1.00 0.00 H new ATOM 0 HB2 PRO A 109 5.900 -12.306 -12.400 1.00 0.00 H new ATOM 0 HB3 PRO A 109 7.174 -13.483 -12.152 1.00 0.00 H new ATOM 0 HG2 PRO A 109 6.467 -11.077 -10.466 1.00 0.00 H new ATOM 0 HG3 PRO A 109 6.885 -12.697 -9.944 1.00 0.00 H new ATOM 0 HD2 PRO A 109 8.732 -10.734 -9.832 1.00 0.00 H new ATOM 0 HD3 PRO A 109 9.214 -12.356 -10.290 1.00 0.00 H new ATOM 1721 N ASN A 110 7.042 -9.265 -12.996 1.00 0.00 N ATOM 1722 CA ASN A 110 6.440 -8.029 -13.539 1.00 0.00 C ATOM 1723 C ASN A 110 7.531 -7.021 -13.968 1.00 0.00 C ATOM 1724 O ASN A 110 7.299 -6.163 -14.832 1.00 0.00 O ATOM 1725 CB ASN A 110 5.494 -7.392 -12.479 1.00 0.00 C ATOM 1726 CG ASN A 110 6.179 -6.976 -11.166 1.00 0.00 C ATOM 1727 OD1 ASN A 110 7.215 -7.523 -10.779 1.00 0.00 O ATOM 1728 ND2 ASN A 110 5.599 -6.007 -10.472 1.00 0.00 N ATOM 0 H ASN A 110 7.365 -9.164 -12.034 1.00 0.00 H new ATOM 0 HA ASN A 110 5.859 -8.287 -14.425 1.00 0.00 H new ATOM 0 HB2 ASN A 110 5.019 -6.515 -12.918 1.00 0.00 H new ATOM 0 HB3 ASN A 110 4.700 -8.102 -12.248 1.00 0.00 H new ATOM 0 HD21 ASN A 110 6.009 -5.694 -9.592 1.00 0.00 H new ATOM 0 HD22 ASN A 110 4.743 -5.574 -10.818 1.00 0.00 H new ATOM 1735 N GLY A 111 8.714 -7.127 -13.330 1.00 0.00 N ATOM 1736 CA GLY A 111 9.846 -6.219 -13.590 1.00 0.00 C ATOM 1737 C GLY A 111 9.754 -4.903 -12.810 1.00 0.00 C ATOM 1738 O GLY A 111 10.569 -3.993 -13.013 1.00 0.00 O ATOM 0 H GLY A 111 8.909 -7.839 -12.626 1.00 0.00 H new ATOM 0 HA2 GLY A 111 10.776 -6.724 -13.330 1.00 0.00 H new ATOM 0 HA3 GLY A 111 9.890 -6.000 -14.657 1.00 0.00 H new ATOM 1742 N LEU A 112 8.744 -4.805 -11.926 1.00 0.00 N ATOM 1743 CA LEU A 112 8.562 -3.676 -10.998 1.00 0.00 C ATOM 1744 C LEU A 112 8.855 -4.149 -9.570 1.00 0.00 C ATOM 1745 O LEU A 112 8.755 -5.351 -9.275 1.00 0.00 O ATOM 1746 CB LEU A 112 7.107 -3.137 -11.062 1.00 0.00 C ATOM 1747 CG LEU A 112 6.617 -2.581 -12.434 1.00 0.00 C ATOM 1748 CD1 LEU A 112 5.136 -2.154 -12.348 1.00 0.00 C ATOM 1749 CD2 LEU A 112 7.515 -1.418 -12.905 1.00 0.00 C ATOM 0 H LEU A 112 8.021 -5.519 -11.836 1.00 0.00 H new ATOM 0 HA LEU A 112 9.245 -2.876 -11.284 1.00 0.00 H new ATOM 0 HB2 LEU A 112 6.435 -3.941 -10.763 1.00 0.00 H new ATOM 0 HB3 LEU A 112 7.006 -2.345 -10.320 1.00 0.00 H new ATOM 0 HG LEU A 112 6.691 -3.375 -13.177 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.812 -1.769 -13.315 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.524 -3.014 -12.077 1.00 0.00 H new ATOM 0 HD13 LEU A 112 5.025 -1.377 -11.592 1.00 0.00 H new ATOM 0 HD21 LEU A 112 7.155 -1.046 -13.864 1.00 0.00 H new ATOM 0 HD22 LEU A 112 7.485 -0.614 -12.169 1.00 0.00 H new ATOM 0 HD23 LEU A 112 8.540 -1.771 -13.015 1.00 0.00 H new ATOM 1761 N ARG A 113 9.172 -3.204 -8.675 1.00 0.00 N ATOM 1762 CA ARG A 113 9.331 -3.502 -7.240 1.00 0.00 C ATOM 1763 C ARG A 113 8.266 -2.730 -6.457 1.00 0.00 C ATOM 1764 O ARG A 113 8.403 -1.529 -6.250 1.00 0.00 O ATOM 1765 CB ARG A 113 10.751 -3.115 -6.750 1.00 0.00 C ATOM 1766 CG ARG A 113 11.066 -3.559 -5.296 1.00 0.00 C ATOM 1767 CD ARG A 113 11.059 -5.098 -5.140 1.00 0.00 C ATOM 1768 NE ARG A 113 11.998 -5.747 -6.075 1.00 0.00 N ATOM 1769 CZ ARG A 113 12.150 -7.061 -6.246 1.00 0.00 C ATOM 1770 NH1 ARG A 113 11.463 -7.930 -5.523 1.00 0.00 N ATOM 1771 NH2 ARG A 113 13.018 -7.496 -7.138 1.00 0.00 N ATOM 0 H ARG A 113 9.324 -2.225 -8.917 1.00 0.00 H new ATOM 0 HA ARG A 113 9.206 -4.572 -7.077 1.00 0.00 H new ATOM 0 HB2 ARG A 113 11.488 -3.557 -7.421 1.00 0.00 H new ATOM 0 HB3 ARG A 113 10.865 -2.033 -6.820 1.00 0.00 H new ATOM 0 HG2 ARG A 113 12.041 -3.170 -5.003 1.00 0.00 H new ATOM 0 HG3 ARG A 113 10.332 -3.124 -4.618 1.00 0.00 H new ATOM 0 HD2 ARG A 113 11.325 -5.361 -4.116 1.00 0.00 H new ATOM 0 HD3 ARG A 113 10.052 -5.477 -5.315 1.00 0.00 H new ATOM 0 HE ARG A 113 12.584 -5.135 -6.642 1.00 0.00 H new ATOM 0 HH11 ARG A 113 10.803 -7.599 -4.820 1.00 0.00 H new ATOM 0 HH12 ARG A 113 11.594 -8.931 -5.669 1.00 0.00 H new ATOM 0 HH21 ARG A 113 13.563 -6.830 -7.686 1.00 0.00 H new ATOM 0 HH22 ARG A 113 13.145 -8.498 -7.280 1.00 0.00 H new ATOM 1785 N TYR A 114 7.230 -3.443 -6.009 1.00 0.00 N ATOM 1786 CA TYR A 114 6.098 -2.874 -5.269 1.00 0.00 C ATOM 1787 C TYR A 114 6.522 -2.542 -3.825 1.00 0.00 C ATOM 1788 O TYR A 114 6.528 -3.412 -2.965 1.00 0.00 O ATOM 1789 CB TYR A 114 4.905 -3.878 -5.320 1.00 0.00 C ATOM 1790 CG TYR A 114 3.591 -3.327 -4.766 1.00 0.00 C ATOM 1791 CD1 TYR A 114 2.989 -2.219 -5.366 1.00 0.00 C ATOM 1792 CD2 TYR A 114 2.956 -3.894 -3.655 1.00 0.00 C ATOM 1793 CE1 TYR A 114 1.817 -1.698 -4.883 1.00 0.00 C ATOM 1794 CE2 TYR A 114 1.779 -3.364 -3.163 1.00 0.00 C ATOM 1795 CZ TYR A 114 1.215 -2.269 -3.789 1.00 0.00 C ATOM 1796 OH TYR A 114 0.074 -1.711 -3.291 1.00 0.00 O ATOM 0 H TYR A 114 7.152 -4.450 -6.152 1.00 0.00 H new ATOM 0 HA TYR A 114 5.775 -1.939 -5.727 1.00 0.00 H new ATOM 0 HB2 TYR A 114 4.749 -4.185 -6.354 1.00 0.00 H new ATOM 0 HB3 TYR A 114 5.175 -4.773 -4.759 1.00 0.00 H new ATOM 0 HD1 TYR A 114 3.456 -1.764 -6.227 1.00 0.00 H new ATOM 0 HD2 TYR A 114 3.392 -4.758 -3.176 1.00 0.00 H new ATOM 0 HE1 TYR A 114 1.368 -0.840 -5.362 1.00 0.00 H new ATOM 0 HE2 TYR A 114 1.304 -3.801 -2.297 1.00 0.00 H new ATOM 0 HH TYR A 114 0.304 -0.937 -2.735 1.00 0.00 H new ATOM 1806 N CYS A 115 6.875 -1.266 -3.574 1.00 0.00 N ATOM 1807 CA CYS A 115 7.471 -0.821 -2.297 1.00 0.00 C ATOM 1808 C CYS A 115 6.592 0.266 -1.652 1.00 0.00 C ATOM 1809 O CYS A 115 6.501 1.400 -2.151 1.00 0.00 O ATOM 1810 CB CYS A 115 8.922 -0.335 -2.545 1.00 0.00 C ATOM 1811 SG CYS A 115 9.117 0.696 -4.013 1.00 0.00 S ATOM 0 H CYS A 115 6.755 -0.513 -4.252 1.00 0.00 H new ATOM 0 HA CYS A 115 7.515 -1.654 -1.595 1.00 0.00 H new ATOM 0 HB2 CYS A 115 9.259 0.226 -1.673 1.00 0.00 H new ATOM 0 HB3 CYS A 115 9.574 -1.204 -2.636 1.00 0.00 H new ATOM 0 HG CYS A 115 7.946 0.992 -4.494 1.00 0.00 H new ATOM 1817 N ILE A 116 5.925 -0.114 -0.548 1.00 0.00 N ATOM 1818 CA ILE A 116 4.897 0.702 0.129 1.00 0.00 C ATOM 1819 C ILE A 116 5.341 1.037 1.565 1.00 0.00 C ATOM 1820 O ILE A 116 6.009 0.228 2.211 1.00 0.00 O ATOM 1821 CB ILE A 116 3.526 -0.081 0.158 1.00 0.00 C ATOM 1822 CG1 ILE A 116 3.115 -0.556 -1.270 1.00 0.00 C ATOM 1823 CG2 ILE A 116 2.401 0.766 0.785 1.00 0.00 C ATOM 1824 CD1 ILE A 116 2.904 0.556 -2.283 1.00 0.00 C ATOM 0 H ILE A 116 6.087 -1.012 -0.092 1.00 0.00 H new ATOM 0 HA ILE A 116 4.767 1.633 -0.423 1.00 0.00 H new ATOM 0 HB ILE A 116 3.675 -0.961 0.784 1.00 0.00 H new ATOM 0 HG12 ILE A 116 3.885 -1.229 -1.648 1.00 0.00 H new ATOM 0 HG13 ILE A 116 2.195 -1.135 -1.193 1.00 0.00 H new ATOM 0 HG21 ILE A 116 1.473 0.194 0.788 1.00 0.00 H new ATOM 0 HG22 ILE A 116 2.669 1.027 1.809 1.00 0.00 H new ATOM 0 HG23 ILE A 116 2.264 1.677 0.203 1.00 0.00 H new ATOM 0 HD11 ILE A 116 2.621 0.125 -3.243 1.00 0.00 H new ATOM 0 HD12 ILE A 116 2.112 1.219 -1.936 1.00 0.00 H new ATOM 0 HD13 ILE A 116 3.827 1.124 -2.398 1.00 0.00 H new ATOM 1836 N ASN A 117 4.942 2.223 2.058 1.00 0.00 N ATOM 1837 CA ASN A 117 5.288 2.705 3.397 1.00 0.00 C ATOM 1838 C ASN A 117 4.484 1.972 4.475 1.00 0.00 C ATOM 1839 O ASN A 117 3.271 2.139 4.536 1.00 0.00 O ATOM 1840 CB ASN A 117 5.001 4.222 3.480 1.00 0.00 C ATOM 1841 CG ASN A 117 5.838 5.044 2.501 1.00 0.00 C ATOM 1842 OD1 ASN A 117 7.030 4.816 2.352 1.00 0.00 O ATOM 1843 ND2 ASN A 117 5.213 5.986 1.819 1.00 0.00 N ATOM 0 H ASN A 117 4.365 2.876 1.529 1.00 0.00 H new ATOM 0 HA ASN A 117 6.346 2.511 3.572 1.00 0.00 H new ATOM 0 HB2 ASN A 117 3.944 4.397 3.281 1.00 0.00 H new ATOM 0 HB3 ASN A 117 5.196 4.568 4.495 1.00 0.00 H new ATOM 0 HD21 ASN A 117 5.726 6.551 1.142 1.00 0.00 H new ATOM 0 HD22 ASN A 117 4.217 6.149 1.969 1.00 0.00 H new ATOM 1850 N SER A 118 5.170 1.186 5.341 1.00 0.00 N ATOM 1851 CA SER A 118 4.534 0.529 6.519 1.00 0.00 C ATOM 1852 C SER A 118 3.930 1.585 7.476 1.00 0.00 C ATOM 1853 O SER A 118 2.987 1.297 8.221 1.00 0.00 O ATOM 1854 CB SER A 118 5.567 -0.337 7.281 1.00 0.00 C ATOM 1855 OG SER A 118 4.972 -1.100 8.330 1.00 0.00 O ATOM 0 H SER A 118 6.166 0.989 5.249 1.00 0.00 H new ATOM 0 HA SER A 118 3.732 -0.113 6.154 1.00 0.00 H new ATOM 0 HB2 SER A 118 6.059 -1.011 6.580 1.00 0.00 H new ATOM 0 HB3 SER A 118 6.340 0.308 7.699 1.00 0.00 H new ATOM 0 HG SER A 118 5.252 -2.036 8.253 1.00 0.00 H new ATOM 1861 N ALA A 119 4.496 2.807 7.428 1.00 0.00 N ATOM 1862 CA ALA A 119 4.075 3.948 8.252 1.00 0.00 C ATOM 1863 C ALA A 119 2.889 4.717 7.616 1.00 0.00 C ATOM 1864 O ALA A 119 2.508 5.776 8.111 1.00 0.00 O ATOM 1865 CB ALA A 119 5.280 4.880 8.459 1.00 0.00 C ATOM 0 H ALA A 119 5.272 3.028 6.804 1.00 0.00 H new ATOM 0 HA ALA A 119 3.724 3.574 9.214 1.00 0.00 H new ATOM 0 HB1 ALA A 119 4.981 5.732 9.070 1.00 0.00 H new ATOM 0 HB2 ALA A 119 6.079 4.336 8.963 1.00 0.00 H new ATOM 0 HB3 ALA A 119 5.636 5.234 7.492 1.00 0.00 H new ATOM 1871 N ALA A 120 2.326 4.188 6.512 1.00 0.00 N ATOM 1872 CA ALA A 120 1.123 4.746 5.861 1.00 0.00 C ATOM 1873 C ALA A 120 0.147 3.607 5.513 1.00 0.00 C ATOM 1874 O ALA A 120 -0.707 3.749 4.634 1.00 0.00 O ATOM 1875 CB ALA A 120 1.528 5.552 4.605 1.00 0.00 C ATOM 0 H ALA A 120 2.693 3.359 6.045 1.00 0.00 H new ATOM 0 HA ALA A 120 0.617 5.428 6.544 1.00 0.00 H new ATOM 0 HB1 ALA A 120 0.635 5.960 4.131 1.00 0.00 H new ATOM 0 HB2 ALA A 120 2.190 6.368 4.894 1.00 0.00 H new ATOM 0 HB3 ALA A 120 2.044 4.897 3.903 1.00 0.00 H new ATOM 1881 N LEU A 121 0.260 2.480 6.243 1.00 0.00 N ATOM 1882 CA LEU A 121 -0.567 1.281 6.014 1.00 0.00 C ATOM 1883 C LEU A 121 -1.432 0.926 7.225 1.00 0.00 C ATOM 1884 O LEU A 121 -1.085 1.216 8.374 1.00 0.00 O ATOM 1885 CB LEU A 121 0.326 0.078 5.642 1.00 0.00 C ATOM 1886 CG LEU A 121 0.952 0.141 4.234 1.00 0.00 C ATOM 1887 CD1 LEU A 121 1.929 -1.021 3.998 1.00 0.00 C ATOM 1888 CD2 LEU A 121 -0.155 0.235 3.164 1.00 0.00 C ATOM 0 H LEU A 121 0.927 2.376 7.008 1.00 0.00 H new ATOM 0 HA LEU A 121 -1.239 1.513 5.188 1.00 0.00 H new ATOM 0 HB2 LEU A 121 1.128 -0.001 6.376 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -0.267 -0.833 5.719 1.00 0.00 H new ATOM 0 HG LEU A 121 1.552 1.047 4.153 1.00 0.00 H new ATOM 0 HD11 LEU A 121 2.351 -0.944 2.996 1.00 0.00 H new ATOM 0 HD12 LEU A 121 2.732 -0.976 4.734 1.00 0.00 H new ATOM 0 HD13 LEU A 121 1.399 -1.968 4.097 1.00 0.00 H new ATOM 0 HD21 LEU A 121 0.299 0.279 2.174 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -0.799 -0.642 3.229 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -0.748 1.134 3.332 1.00 0.00 H new ATOM 1900 N ARG A 122 -2.559 0.278 6.915 1.00 0.00 N ATOM 1901 CA ARG A 122 -3.483 -0.311 7.878 1.00 0.00 C ATOM 1902 C ARG A 122 -3.427 -1.829 7.688 1.00 0.00 C ATOM 1903 O ARG A 122 -3.818 -2.353 6.644 1.00 0.00 O ATOM 1904 CB ARG A 122 -4.916 0.248 7.649 1.00 0.00 C ATOM 1905 CG ARG A 122 -6.045 -0.517 8.347 1.00 0.00 C ATOM 1906 CD ARG A 122 -5.877 -0.619 9.873 1.00 0.00 C ATOM 1907 NE ARG A 122 -6.824 -1.583 10.435 1.00 0.00 N ATOM 1908 CZ ARG A 122 -6.683 -2.229 11.591 1.00 0.00 C ATOM 1909 NH1 ARG A 122 -5.690 -1.942 12.427 1.00 0.00 N ATOM 1910 NH2 ARG A 122 -7.564 -3.135 11.917 1.00 0.00 N ATOM 0 H ARG A 122 -2.860 0.147 5.949 1.00 0.00 H new ATOM 0 HA ARG A 122 -3.207 -0.060 8.902 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -4.941 1.284 7.987 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -5.116 0.257 6.578 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -6.993 -0.026 8.128 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -6.102 -1.522 7.929 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -4.858 -0.922 10.112 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -6.034 0.359 10.327 1.00 0.00 H new ATOM 0 HE ARG A 122 -7.666 -1.777 9.894 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -5.017 -1.214 12.188 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -5.601 -2.450 13.307 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -8.343 -3.337 11.291 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -7.473 -3.641 12.798 1.00 0.00 H new ATOM 1924 N PHE A 123 -2.897 -2.511 8.694 1.00 0.00 N ATOM 1925 CA PHE A 123 -2.709 -3.959 8.681 1.00 0.00 C ATOM 1926 C PHE A 123 -3.940 -4.620 9.302 1.00 0.00 C ATOM 1927 O PHE A 123 -4.264 -4.375 10.470 1.00 0.00 O ATOM 1928 CB PHE A 123 -1.401 -4.314 9.428 1.00 0.00 C ATOM 1929 CG PHE A 123 -0.175 -3.623 8.812 1.00 0.00 C ATOM 1930 CD1 PHE A 123 0.104 -2.287 9.085 1.00 0.00 C ATOM 1931 CD2 PHE A 123 0.673 -4.289 7.940 1.00 0.00 C ATOM 1932 CE1 PHE A 123 1.186 -1.650 8.523 1.00 0.00 C ATOM 1933 CE2 PHE A 123 1.752 -3.636 7.371 1.00 0.00 C ATOM 1934 CZ PHE A 123 2.009 -2.326 7.667 1.00 0.00 C ATOM 0 H PHE A 123 -2.580 -2.069 9.557 1.00 0.00 H new ATOM 0 HA PHE A 123 -2.608 -4.333 7.662 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -1.492 -4.023 10.475 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -1.255 -5.394 9.409 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -0.543 -1.738 9.753 1.00 0.00 H new ATOM 0 HD2 PHE A 123 0.490 -5.327 7.703 1.00 0.00 H new ATOM 0 HE1 PHE A 123 1.385 -0.615 8.758 1.00 0.00 H new ATOM 0 HE2 PHE A 123 2.398 -4.166 6.686 1.00 0.00 H new ATOM 0 HZ PHE A 123 2.859 -1.827 7.226 1.00 0.00 H new ATOM 1944 N VAL A 124 -4.630 -5.438 8.493 1.00 0.00 N ATOM 1945 CA VAL A 124 -5.911 -6.050 8.840 1.00 0.00 C ATOM 1946 C VAL A 124 -5.705 -7.573 8.853 1.00 0.00 C ATOM 1947 O VAL A 124 -5.507 -8.161 7.783 1.00 0.00 O ATOM 1948 CB VAL A 124 -7.037 -5.666 7.805 1.00 0.00 C ATOM 1949 CG1 VAL A 124 -8.409 -6.244 8.233 1.00 0.00 C ATOM 1950 CG2 VAL A 124 -7.110 -4.127 7.596 1.00 0.00 C ATOM 0 H VAL A 124 -4.302 -5.694 7.562 1.00 0.00 H new ATOM 0 HA VAL A 124 -6.237 -5.688 9.815 1.00 0.00 H new ATOM 0 HB VAL A 124 -6.775 -6.114 6.847 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -9.166 -5.963 7.501 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -8.344 -7.331 8.290 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -8.683 -5.845 9.210 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -7.896 -3.894 6.877 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -7.332 -3.641 8.546 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -6.154 -3.765 7.218 1.00 0.00 H new ATOM 1960 N PRO A 125 -5.709 -8.233 10.054 1.00 0.00 N ATOM 1961 CA PRO A 125 -5.519 -9.698 10.154 1.00 0.00 C ATOM 1962 C PRO A 125 -6.711 -10.457 9.531 1.00 0.00 C ATOM 1963 O PRO A 125 -7.793 -9.888 9.362 1.00 0.00 O ATOM 1964 CB PRO A 125 -5.421 -9.944 11.683 1.00 0.00 C ATOM 1965 CG PRO A 125 -6.191 -8.810 12.294 1.00 0.00 C ATOM 1966 CD PRO A 125 -5.926 -7.614 11.397 1.00 0.00 C ATOM 0 HA PRO A 125 -4.641 -10.054 9.615 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -5.848 -10.908 11.958 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -4.384 -9.947 12.019 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -7.256 -9.038 12.341 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -5.862 -8.616 13.315 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -6.768 -6.922 11.390 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -5.053 -7.050 11.726 1.00 0.00 H new ATOM 1974 N LYS A 126 -6.495 -11.736 9.196 1.00 0.00 N ATOM 1975 CA LYS A 126 -7.507 -12.605 8.546 1.00 0.00 C ATOM 1976 C LYS A 126 -8.729 -12.852 9.463 1.00 0.00 C ATOM 1977 O LYS A 126 -9.854 -13.073 8.987 1.00 0.00 O ATOM 1978 CB LYS A 126 -6.825 -13.925 8.096 1.00 0.00 C ATOM 1979 CG LYS A 126 -7.703 -14.861 7.241 1.00 0.00 C ATOM 1980 CD LYS A 126 -6.913 -16.055 6.649 1.00 0.00 C ATOM 1981 CE LYS A 126 -6.213 -16.926 7.713 1.00 0.00 C ATOM 1982 NZ LYS A 126 -7.171 -17.476 8.697 1.00 0.00 N ATOM 0 H LYS A 126 -5.607 -12.209 9.367 1.00 0.00 H new ATOM 0 HA LYS A 126 -7.902 -12.100 7.664 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -5.928 -13.676 7.529 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -6.501 -14.468 8.984 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -8.522 -15.241 7.852 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -8.150 -14.289 6.428 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -7.595 -16.680 6.072 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -6.164 -15.675 5.954 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -5.687 -17.745 7.222 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -5.462 -16.331 8.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -6.664 -18.082 9.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -7.630 -16.695 9.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -7.893 -18.038 8.202 1.00 0.00 H new ATOM 1996 N HIS A 127 -8.486 -12.756 10.779 1.00 0.00 N ATOM 1997 CA HIS A 127 -9.531 -12.835 11.829 1.00 0.00 C ATOM 1998 C HIS A 127 -10.422 -11.563 11.846 1.00 0.00 C ATOM 1999 O HIS A 127 -11.472 -11.540 12.491 1.00 0.00 O ATOM 2000 CB HIS A 127 -8.861 -13.072 13.214 1.00 0.00 C ATOM 2001 CG HIS A 127 -9.824 -13.265 14.364 1.00 0.00 C ATOM 2002 ND1 HIS A 127 -9.725 -12.587 15.557 1.00 0.00 N ATOM 2003 CD2 HIS A 127 -10.912 -14.061 14.482 1.00 0.00 C ATOM 2004 CE1 HIS A 127 -10.712 -12.950 16.354 1.00 0.00 C ATOM 2005 NE2 HIS A 127 -11.446 -13.843 15.725 1.00 0.00 N ATOM 0 H HIS A 127 -7.548 -12.619 11.156 1.00 0.00 H new ATOM 0 HA HIS A 127 -10.187 -13.676 11.604 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -8.220 -13.951 13.145 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -8.215 -12.223 13.439 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -11.290 -14.743 13.734 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -10.888 -12.578 17.352 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -12.277 -14.299 16.101 1.00 0.00 H new ATOM 2014 N LYS A 128 -9.982 -10.506 11.144 1.00 0.00 N ATOM 2015 CA LYS A 128 -10.773 -9.272 10.925 1.00 0.00 C ATOM 2016 C LYS A 128 -11.263 -9.169 9.469 1.00 0.00 C ATOM 2017 O LYS A 128 -12.205 -8.421 9.193 1.00 0.00 O ATOM 2018 CB LYS A 128 -9.940 -8.005 11.306 1.00 0.00 C ATOM 2019 CG LYS A 128 -9.984 -7.607 12.800 1.00 0.00 C ATOM 2020 CD LYS A 128 -11.418 -7.252 13.263 1.00 0.00 C ATOM 2021 CE LYS A 128 -11.455 -6.574 14.642 1.00 0.00 C ATOM 2022 NZ LYS A 128 -10.811 -7.399 15.703 1.00 0.00 N ATOM 0 H LYS A 128 -9.061 -10.478 10.707 1.00 0.00 H new ATOM 0 HA LYS A 128 -11.648 -9.324 11.573 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -8.901 -8.175 11.023 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -10.298 -7.164 10.713 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -9.600 -8.428 13.405 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -9.327 -6.753 12.967 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -11.878 -6.592 12.528 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -12.019 -8.161 13.295 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -10.952 -5.609 14.582 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -12.491 -6.377 14.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -10.922 -6.929 16.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -11.262 -8.336 15.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -9.799 -7.509 15.491 1.00 0.00 H new ATOM 2036 N LEU A 129 -10.629 -9.924 8.547 1.00 0.00 N ATOM 2037 CA LEU A 129 -10.929 -9.847 7.104 1.00 0.00 C ATOM 2038 C LEU A 129 -12.330 -10.375 6.793 1.00 0.00 C ATOM 2039 O LEU A 129 -13.059 -9.733 6.053 1.00 0.00 O ATOM 2040 CB LEU A 129 -9.857 -10.592 6.275 1.00 0.00 C ATOM 2041 CG LEU A 129 -8.480 -9.872 6.151 1.00 0.00 C ATOM 2042 CD1 LEU A 129 -7.470 -10.748 5.401 1.00 0.00 C ATOM 2043 CD2 LEU A 129 -8.628 -8.491 5.484 1.00 0.00 C ATOM 0 H LEU A 129 -9.901 -10.599 8.781 1.00 0.00 H new ATOM 0 HA LEU A 129 -10.905 -8.795 6.819 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -9.695 -11.573 6.722 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -10.251 -10.760 5.272 1.00 0.00 H new ATOM 0 HG LEU A 129 -8.097 -9.708 7.158 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -6.517 -10.223 5.328 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -7.328 -11.684 5.941 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -7.845 -10.960 4.400 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -7.650 -8.015 5.412 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -9.047 -8.612 4.485 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -9.292 -7.867 6.082 1.00 0.00 H new ATOM 2055 N LYS A 130 -12.723 -11.509 7.407 1.00 0.00 N ATOM 2056 CA LYS A 130 -14.068 -12.128 7.188 1.00 0.00 C ATOM 2057 C LYS A 130 -15.208 -11.110 7.439 1.00 0.00 C ATOM 2058 O LYS A 130 -16.276 -11.176 6.827 1.00 0.00 O ATOM 2059 CB LYS A 130 -14.239 -13.353 8.114 1.00 0.00 C ATOM 2060 CG LYS A 130 -13.169 -14.455 7.945 1.00 0.00 C ATOM 2061 CD LYS A 130 -13.279 -15.547 9.038 1.00 0.00 C ATOM 2062 CE LYS A 130 -13.024 -14.989 10.455 1.00 0.00 C ATOM 2063 NZ LYS A 130 -13.183 -16.016 11.505 1.00 0.00 N ATOM 0 H LYS A 130 -12.134 -12.024 8.062 1.00 0.00 H new ATOM 0 HA LYS A 130 -14.128 -12.447 6.147 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -14.227 -13.011 9.149 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -15.221 -13.791 7.935 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -13.275 -14.915 6.962 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -12.177 -14.005 7.981 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -14.271 -15.996 9.000 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -12.562 -16.341 8.828 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -12.016 -14.577 10.504 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -13.714 -14.167 10.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -13.001 -15.591 12.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -14.152 -16.392 11.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -12.507 -16.789 11.340 1.00 0.00 H new ATOM 2077 N GLU A 131 -14.927 -10.161 8.335 1.00 0.00 N ATOM 2078 CA GLU A 131 -15.811 -9.049 8.665 1.00 0.00 C ATOM 2079 C GLU A 131 -15.643 -7.917 7.637 1.00 0.00 C ATOM 2080 O GLU A 131 -16.620 -7.439 7.060 1.00 0.00 O ATOM 2081 CB GLU A 131 -15.451 -8.538 10.086 1.00 0.00 C ATOM 2082 CG GLU A 131 -16.235 -7.302 10.573 1.00 0.00 C ATOM 2083 CD GLU A 131 -15.635 -6.693 11.851 1.00 0.00 C ATOM 2084 OE1 GLU A 131 -14.686 -5.893 11.738 1.00 0.00 O ATOM 2085 OE2 GLU A 131 -16.091 -7.023 12.969 1.00 0.00 O ATOM 0 H GLU A 131 -14.054 -10.148 8.863 1.00 0.00 H new ATOM 0 HA GLU A 131 -16.849 -9.381 8.642 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -15.612 -9.350 10.795 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -14.387 -8.302 10.108 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -16.246 -6.549 9.785 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -17.271 -7.583 10.760 1.00 0.00 H new ATOM 2092 N GLU A 132 -14.380 -7.530 7.387 1.00 0.00 N ATOM 2093 CA GLU A 132 -14.029 -6.234 6.763 1.00 0.00 C ATOM 2094 C GLU A 132 -13.602 -6.405 5.277 1.00 0.00 C ATOM 2095 O GLU A 132 -12.962 -5.518 4.690 1.00 0.00 O ATOM 2096 CB GLU A 132 -12.919 -5.550 7.638 1.00 0.00 C ATOM 2097 CG GLU A 132 -12.693 -4.053 7.339 1.00 0.00 C ATOM 2098 CD GLU A 132 -11.738 -3.352 8.320 1.00 0.00 C ATOM 2099 OE1 GLU A 132 -10.508 -3.459 8.150 1.00 0.00 O ATOM 2100 OE2 GLU A 132 -12.219 -2.680 9.265 1.00 0.00 O ATOM 0 H GLU A 132 -13.569 -8.106 7.611 1.00 0.00 H new ATOM 0 HA GLU A 132 -14.906 -5.587 6.735 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -13.185 -5.660 8.689 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -11.979 -6.082 7.489 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.297 -3.951 6.329 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.655 -3.541 7.357 1.00 0.00 H new ATOM 2107 N GLY A 133 -14.001 -7.527 4.648 1.00 0.00 N ATOM 2108 CA GLY A 133 -13.758 -7.729 3.212 1.00 0.00 C ATOM 2109 C GLY A 133 -12.781 -8.844 2.918 1.00 0.00 C ATOM 2110 O GLY A 133 -11.755 -8.614 2.275 1.00 0.00 O ATOM 0 H GLY A 133 -14.487 -8.297 5.107 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -14.705 -7.947 2.718 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -13.380 -6.802 2.781 1.00 0.00 H new ATOM 2114 N TYR A 134 -13.078 -10.050 3.444 1.00 0.00 N ATOM 2115 CA TYR A 134 -12.310 -11.295 3.202 1.00 0.00 C ATOM 2116 C TYR A 134 -11.923 -11.505 1.732 1.00 0.00 C ATOM 2117 O TYR A 134 -10.848 -11.992 1.451 1.00 0.00 O ATOM 2118 CB TYR A 134 -13.118 -12.526 3.700 1.00 0.00 C ATOM 2119 CG TYR A 134 -14.524 -12.647 3.086 1.00 0.00 C ATOM 2120 CD1 TYR A 134 -14.749 -13.355 1.897 1.00 0.00 C ATOM 2121 CD2 TYR A 134 -15.624 -12.030 3.687 1.00 0.00 C ATOM 2122 CE1 TYR A 134 -16.007 -13.431 1.340 1.00 0.00 C ATOM 2123 CE2 TYR A 134 -16.878 -12.111 3.136 1.00 0.00 C ATOM 2124 CZ TYR A 134 -17.068 -12.813 1.967 1.00 0.00 C ATOM 2125 OH TYR A 134 -18.334 -12.888 1.418 1.00 0.00 O ATOM 0 H TYR A 134 -13.876 -10.192 4.063 1.00 0.00 H new ATOM 0 HA TYR A 134 -11.381 -11.190 3.763 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -12.555 -13.432 3.473 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -13.211 -12.471 4.785 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -13.922 -13.849 1.409 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -15.484 -11.478 4.605 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -16.161 -13.971 0.418 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -17.714 -11.625 3.618 1.00 0.00 H new ATOM 0 HH TYR A 134 -18.966 -12.400 1.986 1.00 0.00 H new ATOM 2135 N GLU A 135 -12.803 -11.103 0.809 1.00 0.00 N ATOM 2136 CA GLU A 135 -12.625 -11.308 -0.643 1.00 0.00 C ATOM 2137 C GLU A 135 -11.296 -10.718 -1.193 1.00 0.00 C ATOM 2138 O GLU A 135 -10.837 -11.104 -2.267 1.00 0.00 O ATOM 2139 CB GLU A 135 -13.831 -10.712 -1.397 1.00 0.00 C ATOM 2140 CG GLU A 135 -13.943 -9.170 -1.325 1.00 0.00 C ATOM 2141 CD GLU A 135 -15.115 -8.626 -2.153 1.00 0.00 C ATOM 2142 OE1 GLU A 135 -15.033 -8.658 -3.404 1.00 0.00 O ATOM 2143 OE2 GLU A 135 -16.129 -8.192 -1.563 1.00 0.00 O ATOM 0 H GLU A 135 -13.670 -10.620 1.046 1.00 0.00 H new ATOM 0 HA GLU A 135 -12.568 -12.384 -0.810 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -13.770 -11.009 -2.444 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -14.745 -11.148 -0.994 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -14.065 -8.866 -0.285 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -13.014 -8.725 -1.680 1.00 0.00 H new ATOM 2150 N SER A 136 -10.676 -9.836 -0.409 1.00 0.00 N ATOM 2151 CA SER A 136 -9.487 -9.083 -0.804 1.00 0.00 C ATOM 2152 C SER A 136 -8.194 -9.929 -0.610 1.00 0.00 C ATOM 2153 O SER A 136 -7.189 -9.721 -1.295 1.00 0.00 O ATOM 2154 CB SER A 136 -9.456 -7.803 0.034 1.00 0.00 C ATOM 2155 OG SER A 136 -10.681 -7.094 -0.070 1.00 0.00 O ATOM 0 H SER A 136 -10.993 -9.621 0.536 1.00 0.00 H new ATOM 0 HA SER A 136 -9.529 -8.833 -1.864 1.00 0.00 H new ATOM 0 HB2 SER A 136 -9.264 -8.053 1.078 1.00 0.00 H new ATOM 0 HB3 SER A 136 -8.635 -7.167 -0.298 1.00 0.00 H new ATOM 0 HG SER A 136 -11.296 -7.400 0.628 1.00 0.00 H new ATOM 2161 N TYR A 137 -8.206 -10.830 0.384 1.00 0.00 N ATOM 2162 CA TYR A 137 -7.118 -11.819 0.595 1.00 0.00 C ATOM 2163 C TYR A 137 -7.621 -13.233 0.303 1.00 0.00 C ATOM 2164 O TYR A 137 -7.084 -13.955 -0.544 1.00 0.00 O ATOM 2165 CB TYR A 137 -6.609 -11.704 2.052 1.00 0.00 C ATOM 2166 CG TYR A 137 -5.523 -12.701 2.499 1.00 0.00 C ATOM 2167 CD1 TYR A 137 -4.359 -12.904 1.751 1.00 0.00 C ATOM 2168 CD2 TYR A 137 -5.655 -13.429 3.691 1.00 0.00 C ATOM 2169 CE1 TYR A 137 -3.386 -13.789 2.175 1.00 0.00 C ATOM 2170 CE2 TYR A 137 -4.679 -14.301 4.114 1.00 0.00 C ATOM 2171 CZ TYR A 137 -3.554 -14.476 3.354 1.00 0.00 C ATOM 2172 OH TYR A 137 -2.575 -15.327 3.783 1.00 0.00 O ATOM 0 H TYR A 137 -8.962 -10.900 1.065 1.00 0.00 H new ATOM 0 HA TYR A 137 -6.295 -11.611 -0.089 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -6.221 -10.695 2.196 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -7.464 -11.815 2.718 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -4.218 -12.361 0.828 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -6.544 -13.302 4.291 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -2.496 -13.941 1.582 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -4.799 -14.844 5.040 1.00 0.00 H new ATOM 0 HH TYR A 137 -2.985 -16.133 4.162 1.00 0.00 H new ATOM 2182 N LEU A 138 -8.682 -13.590 1.016 1.00 0.00 N ATOM 2183 CA LEU A 138 -9.231 -14.946 1.062 1.00 0.00 C ATOM 2184 C LEU A 138 -9.845 -15.375 -0.291 1.00 0.00 C ATOM 2185 O LEU A 138 -9.953 -16.570 -0.532 1.00 0.00 O ATOM 2186 CB LEU A 138 -10.287 -15.078 2.211 1.00 0.00 C ATOM 2187 CG LEU A 138 -9.768 -14.891 3.691 1.00 0.00 C ATOM 2188 CD1 LEU A 138 -9.389 -13.428 4.035 1.00 0.00 C ATOM 2189 CD2 LEU A 138 -10.793 -15.414 4.726 1.00 0.00 C ATOM 0 H LEU A 138 -9.201 -12.929 1.595 1.00 0.00 H new ATOM 0 HA LEU A 138 -8.400 -15.620 1.268 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -11.074 -14.345 2.033 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -10.747 -16.063 2.136 1.00 0.00 H new ATOM 0 HG LEU A 138 -8.857 -15.486 3.748 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -9.041 -13.375 5.067 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -8.596 -13.091 3.367 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -10.263 -12.788 3.913 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -10.401 -15.268 5.732 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -11.730 -14.867 4.619 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -10.972 -16.476 4.557 1.00 0.00 H new ATOM 2201 N HIS A 139 -10.345 -14.424 -1.114 1.00 0.00 N ATOM 2202 CA HIS A 139 -10.722 -14.722 -2.527 1.00 0.00 C ATOM 2203 C HIS A 139 -9.570 -14.429 -3.530 1.00 0.00 C ATOM 2204 O HIS A 139 -9.286 -15.261 -4.398 1.00 0.00 O ATOM 2205 CB HIS A 139 -12.023 -14.002 -2.950 1.00 0.00 C ATOM 2206 CG HIS A 139 -12.532 -14.426 -4.305 1.00 0.00 C ATOM 2207 ND1 HIS A 139 -12.698 -13.558 -5.365 1.00 0.00 N ATOM 2208 CD2 HIS A 139 -12.902 -15.650 -4.764 1.00 0.00 C ATOM 2209 CE1 HIS A 139 -13.140 -14.229 -6.413 1.00 0.00 C ATOM 2210 NE2 HIS A 139 -13.271 -15.496 -6.071 1.00 0.00 N ATOM 0 H HIS A 139 -10.497 -13.455 -0.835 1.00 0.00 H new ATOM 0 HA HIS A 139 -10.913 -15.795 -2.562 1.00 0.00 H new ATOM 0 HB2 HIS A 139 -12.794 -14.195 -2.204 1.00 0.00 H new ATOM 0 HB3 HIS A 139 -11.848 -12.926 -2.957 1.00 0.00 H new ATOM 0 HD2 HIS A 139 -12.904 -16.572 -4.202 1.00 0.00 H new ATOM 0 HE1 HIS A 139 -13.357 -13.811 -7.385 1.00 0.00 H new ATOM 0 HE2 HIS A 139 -13.596 -16.243 -6.685 1.00 0.00 H new ATOM 2219 N LEU A 140 -8.961 -13.219 -3.442 1.00 0.00 N ATOM 2220 CA LEU A 140 -7.967 -12.745 -4.450 1.00 0.00 C ATOM 2221 C LEU A 140 -6.685 -13.606 -4.456 1.00 0.00 C ATOM 2222 O LEU A 140 -6.251 -14.065 -5.517 1.00 0.00 O ATOM 2223 CB LEU A 140 -7.588 -11.249 -4.223 1.00 0.00 C ATOM 2224 CG LEU A 140 -8.694 -10.183 -4.496 1.00 0.00 C ATOM 2225 CD1 LEU A 140 -8.170 -8.762 -4.192 1.00 0.00 C ATOM 2226 CD2 LEU A 140 -9.234 -10.279 -5.934 1.00 0.00 C ATOM 0 H LEU A 140 -9.137 -12.554 -2.689 1.00 0.00 H new ATOM 0 HA LEU A 140 -8.451 -12.845 -5.421 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -7.259 -11.137 -3.190 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -6.732 -11.018 -4.857 1.00 0.00 H new ATOM 0 HG LEU A 140 -9.527 -10.391 -3.824 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -8.957 -8.034 -4.389 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -7.872 -8.700 -3.145 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -7.310 -8.548 -4.827 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -10.002 -9.521 -6.086 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -8.420 -10.117 -6.640 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -9.663 -11.268 -6.096 1.00 0.00 H new ATOM 2238 N PHE A 141 -6.089 -13.821 -3.272 1.00 0.00 N ATOM 2239 CA PHE A 141 -4.895 -14.687 -3.150 1.00 0.00 C ATOM 2240 C PHE A 141 -5.311 -16.172 -3.158 1.00 0.00 C ATOM 2241 O PHE A 141 -4.696 -16.999 -3.836 1.00 0.00 O ATOM 2242 CB PHE A 141 -4.090 -14.352 -1.856 1.00 0.00 C ATOM 2243 CG PHE A 141 -2.917 -15.313 -1.598 1.00 0.00 C ATOM 2244 CD1 PHE A 141 -1.724 -15.198 -2.313 1.00 0.00 C ATOM 2245 CD2 PHE A 141 -3.030 -16.364 -0.679 1.00 0.00 C ATOM 2246 CE1 PHE A 141 -0.689 -16.094 -2.118 1.00 0.00 C ATOM 2247 CE2 PHE A 141 -1.992 -17.250 -0.487 1.00 0.00 C ATOM 2248 CZ PHE A 141 -0.823 -17.120 -1.209 1.00 0.00 C ATOM 0 H PHE A 141 -6.407 -13.414 -2.392 1.00 0.00 H new ATOM 0 HA PHE A 141 -4.248 -14.499 -4.006 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -3.706 -13.334 -1.929 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -4.765 -14.377 -1.001 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -1.607 -14.398 -3.029 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -3.943 -16.482 -0.113 1.00 0.00 H new ATOM 0 HE1 PHE A 141 0.227 -15.989 -2.680 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -2.094 -18.050 0.232 1.00 0.00 H new ATOM 0 HZ PHE A 141 -0.015 -17.821 -1.062 1.00 0.00 H new ATOM 2258 N ASN A 142 -6.380 -16.482 -2.423 1.00 0.00 N ATOM 2259 CA ASN A 142 -6.893 -17.852 -2.301 1.00 0.00 C ATOM 2260 C ASN A 142 -8.111 -17.977 -3.229 1.00 0.00 C ATOM 2261 O ASN A 142 -9.238 -17.695 -2.832 1.00 0.00 O ATOM 2262 CB ASN A 142 -7.220 -18.158 -0.810 1.00 0.00 C ATOM 2263 CG ASN A 142 -7.811 -19.551 -0.573 1.00 0.00 C ATOM 2264 OD1 ASN A 142 -7.082 -20.519 -0.363 1.00 0.00 O ATOM 2265 ND2 ASN A 142 -9.139 -19.660 -0.599 1.00 0.00 N ATOM 0 H ASN A 142 -6.916 -15.793 -1.895 1.00 0.00 H new ATOM 0 HA ASN A 142 -6.154 -18.593 -2.607 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -6.308 -18.057 -0.221 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -7.922 -17.410 -0.442 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -9.579 -20.566 -0.442 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -9.715 -18.837 -0.776 1.00 0.00 H new ATOM 2272 N LYS A 143 -7.844 -18.318 -4.506 1.00 0.00 N ATOM 2273 CA LYS A 143 -8.867 -18.402 -5.575 1.00 0.00 C ATOM 2274 C LYS A 143 -9.851 -19.557 -5.276 1.00 0.00 C ATOM 2275 O LYS A 143 -9.691 -20.677 -5.775 1.00 0.00 O ATOM 2276 CB LYS A 143 -8.163 -18.590 -6.956 1.00 0.00 C ATOM 2277 CG LYS A 143 -9.047 -18.329 -8.211 1.00 0.00 C ATOM 2278 CD LYS A 143 -8.267 -18.567 -9.532 1.00 0.00 C ATOM 2279 CE LYS A 143 -8.968 -17.996 -10.786 1.00 0.00 C ATOM 2280 NZ LYS A 143 -10.279 -18.626 -11.065 1.00 0.00 N ATOM 0 H LYS A 143 -6.904 -18.546 -4.830 1.00 0.00 H new ATOM 0 HA LYS A 143 -9.443 -17.477 -5.609 1.00 0.00 H new ATOM 0 HB2 LYS A 143 -7.302 -17.923 -6.997 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -7.780 -19.609 -7.011 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -9.919 -18.982 -8.182 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -9.416 -17.304 -8.188 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -7.278 -18.117 -9.444 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -8.119 -19.638 -9.667 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -9.109 -16.923 -10.657 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -8.317 -18.131 -11.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -10.695 -18.199 -11.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -10.148 -19.646 -11.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -10.915 -18.476 -10.256 1.00 0.00 H new ATOM 2294 N LEU A 144 -10.832 -19.280 -4.398 1.00 0.00 N ATOM 2295 CA LEU A 144 -11.809 -20.278 -3.937 1.00 0.00 C ATOM 2296 C LEU A 144 -13.037 -20.215 -4.850 1.00 0.00 C ATOM 2297 O LEU A 144 -13.877 -19.312 -4.732 1.00 0.00 O ATOM 2298 CB LEU A 144 -12.170 -20.045 -2.425 1.00 0.00 C ATOM 2299 CG LEU A 144 -12.919 -21.196 -1.650 1.00 0.00 C ATOM 2300 CD1 LEU A 144 -14.420 -21.290 -1.999 1.00 0.00 C ATOM 2301 CD2 LEU A 144 -12.206 -22.556 -1.847 1.00 0.00 C ATOM 0 H LEU A 144 -10.968 -18.356 -3.989 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.385 -21.280 -3.997 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -11.244 -19.832 -1.891 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -12.786 -19.148 -2.365 1.00 0.00 H new ATOM 0 HG LEU A 144 -12.873 -20.934 -0.593 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -14.875 -22.102 -1.432 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -14.912 -20.351 -1.747 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -14.534 -21.484 -3.065 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -12.744 -23.331 -1.302 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -12.186 -22.806 -2.908 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -11.185 -22.490 -1.471 1.00 0.00 H new ATOM 2313 N GLU A 145 -13.091 -21.155 -5.800 1.00 0.00 N ATOM 2314 CA GLU A 145 -14.247 -21.348 -6.666 1.00 0.00 C ATOM 2315 C GLU A 145 -15.349 -22.030 -5.851 1.00 0.00 C ATOM 2316 O GLU A 145 -15.080 -23.012 -5.145 1.00 0.00 O ATOM 2317 CB GLU A 145 -13.863 -22.198 -7.900 1.00 0.00 C ATOM 2318 CG GLU A 145 -14.876 -22.129 -9.062 1.00 0.00 C ATOM 2319 CD GLU A 145 -14.368 -22.786 -10.358 1.00 0.00 C ATOM 2320 OE1 GLU A 145 -13.296 -22.376 -10.851 1.00 0.00 O ATOM 2321 OE2 GLU A 145 -15.042 -23.686 -10.905 1.00 0.00 O ATOM 0 H GLU A 145 -12.327 -21.804 -5.986 1.00 0.00 H new ATOM 0 HA GLU A 145 -14.606 -20.386 -7.033 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -12.889 -21.870 -8.263 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -13.754 -23.237 -7.590 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -15.802 -22.616 -8.756 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -15.116 -21.085 -9.263 1.00 0.00 H new ATOM 2328 N HIS A 146 -16.566 -21.485 -5.933 1.00 0.00 N ATOM 2329 CA HIS A 146 -17.707 -21.941 -5.130 1.00 0.00 C ATOM 2330 C HIS A 146 -18.143 -23.369 -5.516 1.00 0.00 C ATOM 2331 O HIS A 146 -17.857 -23.848 -6.625 1.00 0.00 O ATOM 2332 CB HIS A 146 -18.885 -20.944 -5.251 1.00 0.00 C ATOM 2333 CG HIS A 146 -18.550 -19.568 -4.743 1.00 0.00 C ATOM 2334 ND1 HIS A 146 -18.451 -18.460 -5.561 1.00 0.00 N ATOM 2335 CD2 HIS A 146 -18.283 -19.126 -3.491 1.00 0.00 C ATOM 2336 CE1 HIS A 146 -18.136 -17.405 -4.836 1.00 0.00 C ATOM 2337 NE2 HIS A 146 -18.029 -17.782 -3.579 1.00 0.00 N ATOM 0 H HIS A 146 -16.790 -20.712 -6.560 1.00 0.00 H new ATOM 0 HA HIS A 146 -17.390 -21.975 -4.088 1.00 0.00 H new ATOM 0 HB2 HIS A 146 -19.188 -20.875 -6.296 1.00 0.00 H new ATOM 0 HB3 HIS A 146 -19.739 -21.331 -4.696 1.00 0.00 H new ATOM 0 HD2 HIS A 146 -18.272 -19.722 -2.590 1.00 0.00 H new ATOM 0 HE1 HIS A 146 -17.990 -16.402 -5.210 1.00 0.00 H new ATOM 0 HE2 HIS A 146 -17.795 -17.172 -2.796 1.00 0.00 H new ATOM 2346 N HIS A 147 -18.810 -24.031 -4.558 1.00 0.00 N ATOM 2347 CA HIS A 147 -19.285 -25.423 -4.673 1.00 0.00 C ATOM 2348 C HIS A 147 -20.146 -25.646 -5.953 1.00 0.00 C ATOM 2349 O HIS A 147 -21.153 -24.937 -6.146 1.00 0.00 O ATOM 2350 CB HIS A 147 -20.050 -25.832 -3.372 1.00 0.00 C ATOM 2351 CG HIS A 147 -21.263 -24.993 -3.051 1.00 0.00 C ATOM 2352 ND1 HIS A 147 -22.548 -25.406 -3.313 1.00 0.00 N ATOM 2353 CD2 HIS A 147 -21.375 -23.750 -2.517 1.00 0.00 C ATOM 2354 CE1 HIS A 147 -23.396 -24.460 -2.960 1.00 0.00 C ATOM 2355 NE2 HIS A 147 -22.712 -23.442 -2.473 1.00 0.00 N ATOM 0 H HIS A 147 -19.041 -23.605 -3.660 1.00 0.00 H new ATOM 0 HA HIS A 147 -18.417 -26.073 -4.780 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -20.361 -26.872 -3.464 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -19.359 -25.780 -2.531 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -20.562 -23.120 -2.188 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -24.471 -24.510 -3.054 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -23.111 -22.571 -2.122 1.00 0.00 H new TER 2364 HIS A 147