USER MOD reduce.3.24.130724 H: found=0, std=0, add=847, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 846 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 132 MET CE :methyl -171:sc= -1.07 (180deg=-1.51!) USER MOD Set 1.2: A 136 MET CE :methyl 149:sc= -0.116 (180deg=0) USER MOD Set 2.1: A 76 SER OG : rot -35:sc= 0.203 USER MOD Set 2.2: A 86 HIS : no HD1:sc= -3.41 K(o=-3.2,f=-4.3!) USER MOD Set 3.1: A 45 THR OG1 : rot 128:sc= -1.13 USER MOD Set 3.2: A 47 TYR OH : rot 30:sc= 0 USER MOD Single : A 27 GLN : amide:sc= -0.114 K(o=-0.11,f=-0.63) USER MOD Single : A 28 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 29 GLN : amide:sc= -1.63 K(o=-1.6,f=-3.1) USER MOD Single : A 32 THR OG1 : rot -15:sc= -0.298 USER MOD Single : A 37 ASN : amide:sc= -4.61! C(o=-4.6!,f=-7!) USER MOD Single : A 39 LYS NZ :NH3+ -138:sc= 0 (180deg=-0.0612) USER MOD Single : A 43 THR OG1 : rot 180:sc= -0.0468 USER MOD Single : A 51 SER OG : rot -52:sc= 0.00289 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 39:sc= 0.11 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 HIS : no HE2:sc= -9.96! C(o=-10!,f=-13!) USER MOD Single : A 80 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 150:sc= -1.24 USER MOD Single : A 90 MET CE :methyl 149:sc= -0.612 (180deg=-3.5!) USER MOD Single : A 92 ASN : amide:sc= -0.824 K(o=-0.82,f=-3.7!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 79:sc= 0.148 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 85:sc= 0.794 USER MOD Single : A 137 CYS SG : rot 180:sc= 0 USER MOD Single : A 139 CYS SG : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 27 9.698 8.992 1.774 1.00 0.00 N ATOM 2 CA GLN A 27 9.540 8.582 3.202 1.00 0.00 C ATOM 3 C GLN A 27 9.876 7.096 3.372 1.00 0.00 C ATOM 4 O GLN A 27 9.482 6.269 2.569 1.00 0.00 O ATOM 5 CB GLN A 27 8.067 8.836 3.526 1.00 0.00 C ATOM 6 CG GLN A 27 7.780 10.337 3.456 1.00 0.00 C ATOM 7 CD GLN A 27 8.526 11.054 4.581 1.00 0.00 C ATOM 8 OE1 GLN A 27 8.526 10.603 5.709 1.00 0.00 O ATOM 9 NE2 GLN A 27 9.169 12.159 4.322 1.00 0.00 N ATOM 0 HA GLN A 27 10.207 9.135 3.864 1.00 0.00 H new ATOM 0 HB2 GLN A 27 7.431 8.300 2.821 1.00 0.00 H new ATOM 0 HB3 GLN A 27 7.832 8.456 4.520 1.00 0.00 H new ATOM 0 HG2 GLN A 27 8.092 10.733 2.489 1.00 0.00 H new ATOM 0 HG3 GLN A 27 6.709 10.517 3.544 1.00 0.00 H new ATOM 0 HE21 GLN A 27 9.170 12.539 3.375 1.00 0.00 H new ATOM 0 HE22 GLN A 27 9.671 12.643 5.066 1.00 0.00 H new ATOM 18 N GLN A 28 10.598 6.761 4.415 1.00 0.00 N ATOM 19 CA GLN A 28 10.970 5.333 4.660 1.00 0.00 C ATOM 20 C GLN A 28 10.544 4.915 6.070 1.00 0.00 C ATOM 21 O GLN A 28 10.461 5.737 6.966 1.00 0.00 O ATOM 22 CB GLN A 28 12.493 5.289 4.523 1.00 0.00 C ATOM 23 CG GLN A 28 12.890 5.692 3.101 1.00 0.00 C ATOM 24 CD GLN A 28 14.412 5.621 2.955 1.00 0.00 C ATOM 25 OE1 GLN A 28 15.071 4.895 3.671 1.00 0.00 O ATOM 26 NE2 GLN A 28 15.002 6.350 2.047 1.00 0.00 N ATOM 0 H GLN A 28 10.947 7.420 5.111 1.00 0.00 H new ATOM 0 HA GLN A 28 10.481 4.652 3.964 1.00 0.00 H new ATOM 0 HB2 GLN A 28 12.953 5.963 5.245 1.00 0.00 H new ATOM 0 HB3 GLN A 28 12.860 4.287 4.744 1.00 0.00 H new ATOM 0 HG2 GLN A 28 12.414 5.030 2.378 1.00 0.00 H new ATOM 0 HG3 GLN A 28 12.540 6.702 2.887 1.00 0.00 H new ATOM 0 HE21 GLN A 28 14.449 6.960 1.445 1.00 0.00 H new ATOM 0 HE22 GLN A 28 16.016 6.309 1.940 1.00 0.00 H new ATOM 35 N GLN A 29 10.278 3.645 6.268 1.00 0.00 N ATOM 36 CA GLN A 29 9.854 3.158 7.623 1.00 0.00 C ATOM 37 C GLN A 29 10.922 2.198 8.188 1.00 0.00 C ATOM 38 O GLN A 29 11.454 1.391 7.453 1.00 0.00 O ATOM 39 CB GLN A 29 8.524 2.413 7.411 1.00 0.00 C ATOM 40 CG GLN A 29 7.501 3.300 6.680 1.00 0.00 C ATOM 41 CD GLN A 29 7.220 4.567 7.491 1.00 0.00 C ATOM 42 OE1 GLN A 29 7.272 4.553 8.704 1.00 0.00 O ATOM 43 NE2 GLN A 29 6.920 5.670 6.861 1.00 0.00 N ATOM 0 H GLN A 29 10.336 2.923 5.550 1.00 0.00 H new ATOM 0 HA GLN A 29 9.738 3.979 8.331 1.00 0.00 H new ATOM 0 HB2 GLN A 29 8.700 1.505 6.834 1.00 0.00 H new ATOM 0 HB3 GLN A 29 8.119 2.104 8.375 1.00 0.00 H new ATOM 0 HG2 GLN A 29 7.881 3.568 5.694 1.00 0.00 H new ATOM 0 HG3 GLN A 29 6.575 2.747 6.525 1.00 0.00 H new ATOM 0 HE21 GLN A 29 6.877 5.680 5.842 1.00 0.00 H new ATOM 0 HE22 GLN A 29 6.729 6.522 7.388 1.00 0.00 H new ATOM 52 N PRO A 30 11.219 2.310 9.477 1.00 0.00 N ATOM 53 CA PRO A 30 12.244 1.425 10.080 1.00 0.00 C ATOM 54 C PRO A 30 11.649 0.056 10.462 1.00 0.00 C ATOM 55 O PRO A 30 11.813 -0.911 9.739 1.00 0.00 O ATOM 56 CB PRO A 30 12.707 2.204 11.311 1.00 0.00 C ATOM 57 CG PRO A 30 11.571 3.116 11.675 1.00 0.00 C ATOM 58 CD PRO A 30 10.658 3.238 10.477 1.00 0.00 C ATOM 0 HA PRO A 30 13.062 1.195 9.397 1.00 0.00 H new ATOM 0 HB2 PRO A 30 12.944 1.529 12.133 1.00 0.00 H new ATOM 0 HB3 PRO A 30 13.611 2.774 11.095 1.00 0.00 H new ATOM 0 HG2 PRO A 30 11.024 2.719 12.530 1.00 0.00 H new ATOM 0 HG3 PRO A 30 11.949 4.096 11.966 1.00 0.00 H new ATOM 0 HD2 PRO A 30 9.633 2.971 10.733 1.00 0.00 H new ATOM 0 HD3 PRO A 30 10.636 4.260 10.099 1.00 0.00 H new ATOM 66 N GLU A 31 10.971 -0.033 11.586 1.00 0.00 N ATOM 67 CA GLU A 31 10.372 -1.333 12.020 1.00 0.00 C ATOM 68 C GLU A 31 8.847 -1.239 12.013 1.00 0.00 C ATOM 69 O GLU A 31 8.272 -0.402 12.690 1.00 0.00 O ATOM 70 CB GLU A 31 10.889 -1.553 13.441 1.00 0.00 C ATOM 71 CG GLU A 31 10.403 -2.906 13.961 1.00 0.00 C ATOM 72 CD GLU A 31 10.807 -3.068 15.429 1.00 0.00 C ATOM 73 OE1 GLU A 31 10.819 -2.073 16.134 1.00 0.00 O ATOM 74 OE2 GLU A 31 11.098 -4.186 15.821 1.00 0.00 O ATOM 0 H GLU A 31 10.808 0.747 12.223 1.00 0.00 H new ATOM 0 HA GLU A 31 10.643 -2.154 11.357 1.00 0.00 H new ATOM 0 HB2 GLU A 31 11.978 -1.518 13.452 1.00 0.00 H new ATOM 0 HB3 GLU A 31 10.538 -0.754 14.094 1.00 0.00 H new ATOM 0 HG2 GLU A 31 9.320 -2.977 13.862 1.00 0.00 H new ATOM 0 HG3 GLU A 31 10.832 -3.711 13.364 1.00 0.00 H new ATOM 81 N THR A 32 8.196 -2.086 11.254 1.00 0.00 N ATOM 82 CA THR A 32 6.703 -2.055 11.190 1.00 0.00 C ATOM 83 C THR A 32 6.184 -3.399 10.654 1.00 0.00 C ATOM 84 O THR A 32 6.861 -4.050 9.869 1.00 0.00 O ATOM 85 CB THR A 32 6.399 -0.895 10.221 1.00 0.00 C ATOM 86 OG1 THR A 32 6.790 0.329 10.826 1.00 0.00 O ATOM 87 CG2 THR A 32 4.902 -0.831 9.879 1.00 0.00 C ATOM 0 H THR A 32 8.637 -2.800 10.674 1.00 0.00 H new ATOM 0 HA THR A 32 6.223 -1.907 12.157 1.00 0.00 H new ATOM 0 HB THR A 32 6.955 -1.062 9.299 1.00 0.00 H new ATOM 0 HG1 THR A 32 6.935 0.188 11.785 1.00 0.00 H new ATOM 0 HG21 THR A 32 4.720 -0.003 9.194 1.00 0.00 H new ATOM 0 HG22 THR A 32 4.596 -1.765 9.408 1.00 0.00 H new ATOM 0 HG23 THR A 32 4.326 -0.680 10.792 1.00 0.00 H new ATOM 95 N GLU A 33 4.989 -3.812 11.056 1.00 0.00 N ATOM 96 CA GLU A 33 4.449 -5.102 10.538 1.00 0.00 C ATOM 97 C GLU A 33 3.217 -4.853 9.666 1.00 0.00 C ATOM 98 O GLU A 33 2.424 -3.951 9.905 1.00 0.00 O ATOM 99 CB GLU A 33 4.071 -5.902 11.785 1.00 0.00 C ATOM 100 CG GLU A 33 5.325 -6.166 12.623 1.00 0.00 C ATOM 101 CD GLU A 33 4.975 -7.069 13.811 1.00 0.00 C ATOM 102 OE1 GLU A 33 3.860 -6.977 14.296 1.00 0.00 O ATOM 103 OE2 GLU A 33 5.832 -7.837 14.215 1.00 0.00 O ATOM 0 H GLU A 33 4.384 -3.313 11.708 1.00 0.00 H new ATOM 0 HA GLU A 33 5.172 -5.631 9.917 1.00 0.00 H new ATOM 0 HB2 GLU A 33 3.337 -5.352 12.374 1.00 0.00 H new ATOM 0 HB3 GLU A 33 3.607 -6.846 11.498 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.091 -6.639 12.009 1.00 0.00 H new ATOM 0 HG3 GLU A 33 5.740 -5.224 12.981 1.00 0.00 H new ATOM 110 N ALA A 34 3.061 -5.666 8.661 1.00 0.00 N ATOM 111 CA ALA A 34 1.908 -5.543 7.737 1.00 0.00 C ATOM 112 C ALA A 34 0.932 -6.722 7.828 1.00 0.00 C ATOM 113 O ALA A 34 1.313 -7.900 7.672 1.00 0.00 O ATOM 114 CB ALA A 34 2.525 -5.487 6.342 1.00 0.00 C ATOM 0 H ALA A 34 3.702 -6.428 8.439 1.00 0.00 H new ATOM 0 HA ALA A 34 1.318 -4.661 7.987 1.00 0.00 H new ATOM 0 HB1 ALA A 34 1.734 -5.396 5.598 1.00 0.00 H new ATOM 0 HB2 ALA A 34 3.190 -4.626 6.273 1.00 0.00 H new ATOM 0 HB3 ALA A 34 3.092 -6.399 6.158 1.00 0.00 H new ATOM 120 N VAL A 35 -0.331 -6.395 7.996 1.00 0.00 N ATOM 121 CA VAL A 35 -1.406 -7.433 7.998 1.00 0.00 C ATOM 122 C VAL A 35 -2.255 -7.173 6.732 1.00 0.00 C ATOM 123 O VAL A 35 -2.731 -6.082 6.538 1.00 0.00 O ATOM 124 CB VAL A 35 -2.207 -7.204 9.298 1.00 0.00 C ATOM 125 CG1 VAL A 35 -3.488 -8.058 9.316 1.00 0.00 C ATOM 126 CG2 VAL A 35 -1.330 -7.556 10.505 1.00 0.00 C ATOM 0 H VAL A 35 -0.662 -5.440 8.133 1.00 0.00 H new ATOM 0 HA VAL A 35 -1.051 -8.463 7.976 1.00 0.00 H new ATOM 0 HB VAL A 35 -2.498 -6.155 9.346 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -4.033 -7.877 10.243 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -4.117 -7.789 8.467 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -3.223 -9.113 9.251 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -1.894 -7.395 11.424 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.028 -8.602 10.443 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -0.443 -6.922 10.508 1.00 0.00 H new ATOM 136 N LEU A 36 -2.369 -8.131 5.833 1.00 0.00 N ATOM 137 CA LEU A 36 -3.111 -7.905 4.544 1.00 0.00 C ATOM 138 C LEU A 36 -4.309 -8.862 4.312 1.00 0.00 C ATOM 139 O LEU A 36 -4.173 -10.069 4.316 1.00 0.00 O ATOM 140 CB LEU A 36 -2.057 -8.113 3.451 1.00 0.00 C ATOM 141 CG LEU A 36 -2.237 -7.064 2.344 1.00 0.00 C ATOM 142 CD1 LEU A 36 -0.865 -6.634 1.816 1.00 0.00 C ATOM 143 CD2 LEU A 36 -3.058 -7.660 1.195 1.00 0.00 C ATOM 0 H LEU A 36 -1.976 -9.066 5.939 1.00 0.00 H new ATOM 0 HA LEU A 36 -3.560 -6.912 4.551 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.057 -8.035 3.878 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -2.148 -9.115 3.032 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.759 -6.199 2.752 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.994 -5.890 1.030 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.280 -6.205 2.630 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.343 -7.501 1.412 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -3.184 -6.913 0.412 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -2.539 -8.528 0.789 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -4.037 -7.964 1.567 1.00 0.00 H new ATOM 155 N ASN A 37 -5.479 -8.284 4.044 1.00 0.00 N ATOM 156 CA ASN A 37 -6.781 -9.027 3.712 1.00 0.00 C ATOM 157 C ASN A 37 -7.477 -9.699 4.912 1.00 0.00 C ATOM 158 O ASN A 37 -8.402 -10.455 4.702 1.00 0.00 O ATOM 159 CB ASN A 37 -6.402 -10.120 2.675 1.00 0.00 C ATOM 160 CG ASN A 37 -7.553 -10.386 1.704 1.00 0.00 C ATOM 161 OD1 ASN A 37 -7.401 -10.214 0.511 1.00 0.00 O ATOM 162 ND2 ASN A 37 -8.698 -10.815 2.157 1.00 0.00 N ATOM 0 H ASN A 37 -5.594 -7.270 4.041 1.00 0.00 H new ATOM 0 HA ASN A 37 -7.498 -8.293 3.345 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -5.519 -9.806 2.119 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -6.141 -11.042 3.194 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -9.463 -11.005 1.510 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -8.828 -10.960 3.158 1.00 0.00 H new ATOM 169 N GLY A 38 -7.133 -9.371 6.138 1.00 0.00 N ATOM 170 CA GLY A 38 -7.853 -9.974 7.317 1.00 0.00 C ATOM 171 C GLY A 38 -6.885 -10.823 8.140 1.00 0.00 C ATOM 172 O GLY A 38 -6.884 -10.768 9.358 1.00 0.00 O ATOM 0 H GLY A 38 -6.389 -8.715 6.376 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -8.276 -9.185 7.938 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -8.685 -10.588 6.971 1.00 0.00 H new ATOM 176 N LYS A 39 -6.046 -11.585 7.480 1.00 0.00 N ATOM 177 CA LYS A 39 -5.044 -12.424 8.209 1.00 0.00 C ATOM 178 C LYS A 39 -3.732 -11.654 8.195 1.00 0.00 C ATOM 179 O LYS A 39 -3.447 -10.962 7.226 1.00 0.00 O ATOM 180 CB LYS A 39 -4.938 -13.743 7.424 1.00 0.00 C ATOM 181 CG LYS A 39 -4.529 -13.478 5.959 1.00 0.00 C ATOM 182 CD LYS A 39 -5.613 -13.989 5.002 1.00 0.00 C ATOM 183 CE LYS A 39 -5.174 -13.745 3.556 1.00 0.00 C ATOM 184 NZ LYS A 39 -4.274 -14.886 3.231 1.00 0.00 N ATOM 0 H LYS A 39 -6.012 -11.662 6.463 1.00 0.00 H new ATOM 0 HA LYS A 39 -5.313 -12.639 9.243 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -4.205 -14.396 7.898 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.894 -14.265 7.450 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -4.373 -12.410 5.805 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -3.582 -13.973 5.744 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -5.786 -15.053 5.166 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -6.556 -13.479 5.198 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -6.031 -13.714 2.883 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -4.655 -12.792 3.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -3.450 -14.538 2.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -3.953 -15.337 4.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -4.789 -15.581 2.654 1.00 0.00 H new ATOM 198 N GLY A 40 -2.962 -11.704 9.269 1.00 0.00 N ATOM 199 CA GLY A 40 -1.710 -10.894 9.295 1.00 0.00 C ATOM 200 C GLY A 40 -0.602 -11.537 8.477 1.00 0.00 C ATOM 201 O GLY A 40 0.054 -12.468 8.903 1.00 0.00 O ATOM 0 H GLY A 40 -3.148 -12.259 10.104 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -1.915 -9.896 8.907 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -1.377 -10.773 10.326 1.00 0.00 H new ATOM 205 N LEU A 41 -0.334 -10.952 7.338 1.00 0.00 N ATOM 206 CA LEU A 41 0.790 -11.398 6.493 1.00 0.00 C ATOM 207 C LEU A 41 1.658 -10.165 6.198 1.00 0.00 C ATOM 208 O LEU A 41 1.243 -9.267 5.483 1.00 0.00 O ATOM 209 CB LEU A 41 0.118 -11.971 5.218 1.00 0.00 C ATOM 210 CG LEU A 41 1.121 -12.135 4.051 1.00 0.00 C ATOM 211 CD1 LEU A 41 2.304 -13.012 4.475 1.00 0.00 C ATOM 212 CD2 LEU A 41 0.410 -12.783 2.860 1.00 0.00 C ATOM 0 H LEU A 41 -0.865 -10.168 6.959 1.00 0.00 H new ATOM 0 HA LEU A 41 1.435 -12.151 6.945 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.329 -12.938 5.449 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -0.692 -11.311 4.908 1.00 0.00 H new ATOM 0 HG LEU A 41 1.498 -11.151 3.771 1.00 0.00 H new ATOM 0 HD11 LEU A 41 2.998 -13.115 3.641 1.00 0.00 H new ATOM 0 HD12 LEU A 41 2.817 -12.549 5.318 1.00 0.00 H new ATOM 0 HD13 LEU A 41 1.940 -13.997 4.768 1.00 0.00 H new ATOM 0 HD21 LEU A 41 1.114 -12.900 2.036 1.00 0.00 H new ATOM 0 HD22 LEU A 41 0.028 -13.761 3.153 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -0.419 -12.150 2.542 1.00 0.00 H new ATOM 224 N GLY A 42 2.847 -10.138 6.714 1.00 0.00 N ATOM 225 CA GLY A 42 3.773 -9.008 6.462 1.00 0.00 C ATOM 226 C GLY A 42 4.475 -8.609 7.755 1.00 0.00 C ATOM 227 O GLY A 42 3.854 -8.114 8.673 1.00 0.00 O ATOM 0 H GLY A 42 3.226 -10.870 7.315 1.00 0.00 H new ATOM 0 HA2 GLY A 42 4.510 -9.292 5.711 1.00 0.00 H new ATOM 0 HA3 GLY A 42 3.221 -8.158 6.061 1.00 0.00 H new ATOM 231 N THR A 43 5.771 -8.786 7.816 1.00 0.00 N ATOM 232 CA THR A 43 6.547 -8.363 9.017 1.00 0.00 C ATOM 233 C THR A 43 7.885 -7.862 8.505 1.00 0.00 C ATOM 234 O THR A 43 8.660 -8.646 7.997 1.00 0.00 O ATOM 235 CB THR A 43 6.714 -9.624 9.866 1.00 0.00 C ATOM 236 OG1 THR A 43 5.438 -10.193 10.124 1.00 0.00 O ATOM 237 CG2 THR A 43 7.393 -9.266 11.188 1.00 0.00 C ATOM 0 H THR A 43 6.329 -9.211 7.075 1.00 0.00 H new ATOM 0 HA THR A 43 6.073 -7.580 9.609 1.00 0.00 H new ATOM 0 HB THR A 43 7.330 -10.344 9.328 1.00 0.00 H new ATOM 0 HG1 THR A 43 5.544 -11.002 10.667 1.00 0.00 H new ATOM 0 HG21 THR A 43 7.511 -10.166 11.792 1.00 0.00 H new ATOM 0 HG22 THR A 43 8.373 -8.832 10.988 1.00 0.00 H new ATOM 0 HG23 THR A 43 6.780 -8.545 11.728 1.00 0.00 H new ATOM 245 N GLY A 44 8.156 -6.575 8.600 1.00 0.00 N ATOM 246 CA GLY A 44 9.448 -6.057 8.059 1.00 0.00 C ATOM 247 C GLY A 44 9.447 -4.546 7.939 1.00 0.00 C ATOM 248 O GLY A 44 9.131 -3.824 8.871 1.00 0.00 O ATOM 0 H GLY A 44 7.545 -5.876 9.023 1.00 0.00 H new ATOM 0 HA2 GLY A 44 10.265 -6.369 8.710 1.00 0.00 H new ATOM 0 HA3 GLY A 44 9.634 -6.499 7.080 1.00 0.00 H new ATOM 252 N THR A 45 9.849 -4.077 6.792 1.00 0.00 N ATOM 253 CA THR A 45 9.940 -2.593 6.565 1.00 0.00 C ATOM 254 C THR A 45 9.045 -2.118 5.417 1.00 0.00 C ATOM 255 O THR A 45 8.864 -2.801 4.427 1.00 0.00 O ATOM 256 CB THR A 45 11.413 -2.320 6.237 1.00 0.00 C ATOM 257 OG1 THR A 45 11.776 -3.024 5.061 1.00 0.00 O ATOM 258 CG2 THR A 45 12.298 -2.770 7.403 1.00 0.00 C ATOM 0 H THR A 45 10.121 -4.652 5.995 1.00 0.00 H new ATOM 0 HA THR A 45 9.598 -2.052 7.447 1.00 0.00 H new ATOM 0 HB THR A 45 11.553 -1.251 6.076 1.00 0.00 H new ATOM 0 HG1 THR A 45 12.194 -2.406 4.426 1.00 0.00 H new ATOM 0 HG21 THR A 45 13.343 -2.573 7.164 1.00 0.00 H new ATOM 0 HG22 THR A 45 12.022 -2.220 8.303 1.00 0.00 H new ATOM 0 HG23 THR A 45 12.160 -3.838 7.574 1.00 0.00 H new ATOM 266 N LEU A 46 8.503 -0.931 5.551 1.00 0.00 N ATOM 267 CA LEU A 46 7.631 -0.356 4.480 1.00 0.00 C ATOM 268 C LEU A 46 8.289 0.891 3.877 1.00 0.00 C ATOM 269 O LEU A 46 8.679 1.796 4.594 1.00 0.00 O ATOM 270 CB LEU A 46 6.331 0.033 5.193 1.00 0.00 C ATOM 271 CG LEU A 46 5.283 0.473 4.161 1.00 0.00 C ATOM 272 CD1 LEU A 46 3.879 0.294 4.745 1.00 0.00 C ATOM 273 CD2 LEU A 46 5.495 1.945 3.794 1.00 0.00 C ATOM 0 H LEU A 46 8.630 -0.331 6.366 1.00 0.00 H new ATOM 0 HA LEU A 46 7.462 -1.061 3.666 1.00 0.00 H new ATOM 0 HB2 LEU A 46 5.955 -0.812 5.769 1.00 0.00 H new ATOM 0 HB3 LEU A 46 6.521 0.841 5.899 1.00 0.00 H new ATOM 0 HG LEU A 46 5.389 -0.140 3.266 1.00 0.00 H new ATOM 0 HD11 LEU A 46 3.137 0.607 4.011 1.00 0.00 H new ATOM 0 HD12 LEU A 46 3.721 -0.755 4.997 1.00 0.00 H new ATOM 0 HD13 LEU A 46 3.779 0.902 5.644 1.00 0.00 H new ATOM 0 HD21 LEU A 46 4.747 2.249 3.061 1.00 0.00 H new ATOM 0 HD22 LEU A 46 5.398 2.561 4.688 1.00 0.00 H new ATOM 0 HD23 LEU A 46 6.491 2.075 3.371 1.00 0.00 H new ATOM 285 N TYR A 47 8.386 0.952 2.571 1.00 0.00 N ATOM 286 CA TYR A 47 8.984 2.154 1.907 1.00 0.00 C ATOM 287 C TYR A 47 7.899 2.904 1.131 1.00 0.00 C ATOM 288 O TYR A 47 7.123 2.301 0.410 1.00 0.00 O ATOM 289 CB TYR A 47 10.041 1.625 0.937 1.00 0.00 C ATOM 290 CG TYR A 47 11.137 0.919 1.694 1.00 0.00 C ATOM 291 CD1 TYR A 47 12.253 1.636 2.140 1.00 0.00 C ATOM 292 CD2 TYR A 47 11.037 -0.450 1.950 1.00 0.00 C ATOM 293 CE1 TYR A 47 13.271 0.981 2.841 1.00 0.00 C ATOM 294 CE2 TYR A 47 12.053 -1.106 2.649 1.00 0.00 C ATOM 295 CZ TYR A 47 13.171 -0.393 3.095 1.00 0.00 C ATOM 296 OH TYR A 47 14.175 -1.043 3.785 1.00 0.00 O ATOM 0 H TYR A 47 8.076 0.219 1.934 1.00 0.00 H new ATOM 0 HA TYR A 47 9.418 2.840 2.634 1.00 0.00 H new ATOM 0 HB2 TYR A 47 9.581 0.939 0.225 1.00 0.00 H new ATOM 0 HB3 TYR A 47 10.460 2.449 0.360 1.00 0.00 H new ATOM 0 HD1 TYR A 47 12.328 2.695 1.943 1.00 0.00 H new ATOM 0 HD2 TYR A 47 10.174 -1.002 1.608 1.00 0.00 H new ATOM 0 HE1 TYR A 47 14.132 1.534 3.186 1.00 0.00 H new ATOM 0 HE2 TYR A 47 11.975 -2.165 2.845 1.00 0.00 H new ATOM 0 HH TYR A 47 14.600 -0.419 4.410 1.00 0.00 H new ATOM 306 N ILE A 48 7.841 4.209 1.270 1.00 0.00 N ATOM 307 CA ILE A 48 6.807 5.005 0.535 1.00 0.00 C ATOM 308 C ILE A 48 7.476 5.836 -0.566 1.00 0.00 C ATOM 309 O ILE A 48 8.371 6.620 -0.305 1.00 0.00 O ATOM 310 CB ILE A 48 6.160 5.910 1.594 1.00 0.00 C ATOM 311 CG1 ILE A 48 5.528 5.045 2.691 1.00 0.00 C ATOM 312 CG2 ILE A 48 5.068 6.768 0.944 1.00 0.00 C ATOM 313 CD1 ILE A 48 5.025 5.940 3.824 1.00 0.00 C ATOM 0 H ILE A 48 8.466 4.756 1.861 1.00 0.00 H new ATOM 0 HA ILE A 48 6.064 4.373 0.048 1.00 0.00 H new ATOM 0 HB ILE A 48 6.924 6.556 2.027 1.00 0.00 H new ATOM 0 HG12 ILE A 48 4.703 4.464 2.280 1.00 0.00 H new ATOM 0 HG13 ILE A 48 6.260 4.333 3.074 1.00 0.00 H new ATOM 0 HG21 ILE A 48 4.611 7.409 1.698 1.00 0.00 H new ATOM 0 HG22 ILE A 48 5.508 7.386 0.162 1.00 0.00 H new ATOM 0 HG23 ILE A 48 4.307 6.120 0.509 1.00 0.00 H new ATOM 0 HD11 ILE A 48 4.576 5.323 4.603 1.00 0.00 H new ATOM 0 HD12 ILE A 48 5.860 6.502 4.242 1.00 0.00 H new ATOM 0 HD13 ILE A 48 4.279 6.634 3.436 1.00 0.00 H new ATOM 325 N ALA A 49 7.039 5.668 -1.792 1.00 0.00 N ATOM 326 CA ALA A 49 7.628 6.441 -2.928 1.00 0.00 C ATOM 327 C ALA A 49 6.625 7.490 -3.415 1.00 0.00 C ATOM 328 O ALA A 49 5.427 7.303 -3.316 1.00 0.00 O ATOM 329 CB ALA A 49 7.909 5.405 -4.017 1.00 0.00 C ATOM 0 H ALA A 49 6.294 5.023 -2.054 1.00 0.00 H new ATOM 0 HA ALA A 49 8.535 6.975 -2.645 1.00 0.00 H new ATOM 0 HB1 ALA A 49 8.344 5.899 -4.886 1.00 0.00 H new ATOM 0 HB2 ALA A 49 8.606 4.658 -3.637 1.00 0.00 H new ATOM 0 HB3 ALA A 49 6.977 4.918 -4.305 1.00 0.00 H new ATOM 335 N GLU A 50 7.107 8.598 -3.937 1.00 0.00 N ATOM 336 CA GLU A 50 6.194 9.701 -4.428 1.00 0.00 C ATOM 337 C GLU A 50 5.038 9.163 -5.290 1.00 0.00 C ATOM 338 O GLU A 50 3.962 9.735 -5.315 1.00 0.00 O ATOM 339 CB GLU A 50 7.092 10.614 -5.265 1.00 0.00 C ATOM 340 CG GLU A 50 6.302 11.856 -5.689 1.00 0.00 C ATOM 341 CD GLU A 50 7.165 12.729 -6.606 1.00 0.00 C ATOM 342 OE1 GLU A 50 8.370 12.752 -6.414 1.00 0.00 O ATOM 343 OE2 GLU A 50 6.605 13.363 -7.485 1.00 0.00 O ATOM 0 H GLU A 50 8.102 8.792 -4.047 1.00 0.00 H new ATOM 0 HA GLU A 50 5.724 10.216 -3.590 1.00 0.00 H new ATOM 0 HB2 GLU A 50 7.969 10.907 -4.689 1.00 0.00 H new ATOM 0 HB3 GLU A 50 7.452 10.081 -6.145 1.00 0.00 H new ATOM 0 HG2 GLU A 50 5.390 11.559 -6.206 1.00 0.00 H new ATOM 0 HG3 GLU A 50 5.999 12.424 -4.809 1.00 0.00 H new ATOM 350 N SER A 51 5.257 8.069 -5.977 1.00 0.00 N ATOM 351 CA SER A 51 4.178 7.476 -6.829 1.00 0.00 C ATOM 352 C SER A 51 4.223 5.942 -6.772 1.00 0.00 C ATOM 353 O SER A 51 3.718 5.276 -7.657 1.00 0.00 O ATOM 354 CB SER A 51 4.482 7.965 -8.243 1.00 0.00 C ATOM 355 OG SER A 51 3.286 7.954 -9.012 1.00 0.00 O ATOM 0 H SER A 51 6.140 7.559 -5.985 1.00 0.00 H new ATOM 0 HA SER A 51 3.184 7.772 -6.494 1.00 0.00 H new ATOM 0 HB2 SER A 51 4.897 8.972 -8.210 1.00 0.00 H new ATOM 0 HB3 SER A 51 5.233 7.326 -8.708 1.00 0.00 H new ATOM 0 HG SER A 51 2.866 7.071 -8.951 1.00 0.00 H new ATOM 361 N ARG A 52 4.814 5.380 -5.736 1.00 0.00 N ATOM 362 CA ARG A 52 4.891 3.888 -5.619 1.00 0.00 C ATOM 363 C ARG A 52 5.097 3.484 -4.158 1.00 0.00 C ATOM 364 O ARG A 52 5.375 4.316 -3.313 1.00 0.00 O ATOM 365 CB ARG A 52 6.111 3.479 -6.450 1.00 0.00 C ATOM 366 CG ARG A 52 5.746 3.451 -7.934 1.00 0.00 C ATOM 367 CD ARG A 52 6.808 2.667 -8.707 1.00 0.00 C ATOM 368 NE ARG A 52 6.409 2.784 -10.137 1.00 0.00 N ATOM 369 CZ ARG A 52 7.053 3.595 -10.930 1.00 0.00 C ATOM 370 NH1 ARG A 52 8.357 3.557 -10.983 1.00 0.00 N ATOM 371 NH2 ARG A 52 6.395 4.443 -11.672 1.00 0.00 N ATOM 0 H ARG A 52 5.245 5.894 -4.968 1.00 0.00 H new ATOM 0 HA ARG A 52 3.977 3.406 -5.966 1.00 0.00 H new ATOM 0 HB2 ARG A 52 6.928 4.180 -6.281 1.00 0.00 H new ATOM 0 HB3 ARG A 52 6.463 2.497 -6.135 1.00 0.00 H new ATOM 0 HG2 ARG A 52 4.768 2.990 -8.070 1.00 0.00 H new ATOM 0 HG3 ARG A 52 5.676 4.467 -8.321 1.00 0.00 H new ATOM 0 HD2 ARG A 52 7.803 3.080 -8.540 1.00 0.00 H new ATOM 0 HD3 ARG A 52 6.838 1.625 -8.390 1.00 0.00 H new ATOM 0 HE ARG A 52 5.632 2.230 -10.496 1.00 0.00 H new ATOM 0 HH11 ARG A 52 8.872 2.893 -10.404 1.00 0.00 H new ATOM 0 HH12 ARG A 52 8.861 4.191 -11.603 1.00 0.00 H new ATOM 0 HH21 ARG A 52 5.376 4.472 -11.632 1.00 0.00 H new ATOM 0 HH22 ARG A 52 6.899 5.077 -12.292 1.00 0.00 H new ATOM 385 N LEU A 53 4.973 2.210 -3.864 1.00 0.00 N ATOM 386 CA LEU A 53 5.174 1.734 -2.459 1.00 0.00 C ATOM 387 C LEU A 53 5.936 0.404 -2.469 1.00 0.00 C ATOM 388 O LEU A 53 5.526 -0.546 -3.111 1.00 0.00 O ATOM 389 CB LEU A 53 3.755 1.554 -1.884 1.00 0.00 C ATOM 390 CG LEU A 53 3.630 2.315 -0.553 1.00 0.00 C ATOM 391 CD1 LEU A 53 2.960 3.670 -0.794 1.00 0.00 C ATOM 392 CD2 LEU A 53 2.783 1.502 0.432 1.00 0.00 C ATOM 0 H LEU A 53 4.741 1.480 -4.538 1.00 0.00 H new ATOM 0 HA LEU A 53 5.758 2.432 -1.860 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.016 1.923 -2.595 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.548 0.495 -1.729 1.00 0.00 H new ATOM 0 HG LEU A 53 4.626 2.468 -0.137 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.873 4.206 0.151 1.00 0.00 H new ATOM 0 HD12 LEU A 53 3.562 4.255 -1.489 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.967 3.515 -1.216 1.00 0.00 H new ATOM 0 HD21 LEU A 53 2.698 2.045 1.373 1.00 0.00 H new ATOM 0 HD22 LEU A 53 1.789 1.344 0.013 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.259 0.538 0.612 1.00 0.00 H new ATOM 404 N SER A 54 7.042 0.337 -1.760 1.00 0.00 N ATOM 405 CA SER A 54 7.843 -0.926 -1.720 1.00 0.00 C ATOM 406 C SER A 54 7.883 -1.483 -0.299 1.00 0.00 C ATOM 407 O SER A 54 8.170 -0.773 0.643 1.00 0.00 O ATOM 408 CB SER A 54 9.241 -0.530 -2.190 1.00 0.00 C ATOM 409 OG SER A 54 9.207 -0.253 -3.584 1.00 0.00 O ATOM 0 H SER A 54 7.422 1.106 -1.208 1.00 0.00 H new ATOM 0 HA SER A 54 7.414 -1.706 -2.349 1.00 0.00 H new ATOM 0 HB2 SER A 54 9.587 0.346 -1.642 1.00 0.00 H new ATOM 0 HB3 SER A 54 9.948 -1.334 -1.984 1.00 0.00 H new ATOM 0 HG SER A 54 10.103 0.003 -3.889 1.00 0.00 H new ATOM 415 N TRP A 55 7.585 -2.752 -0.146 1.00 0.00 N ATOM 416 CA TRP A 55 7.589 -3.380 1.214 1.00 0.00 C ATOM 417 C TRP A 55 8.626 -4.502 1.295 1.00 0.00 C ATOM 418 O TRP A 55 8.825 -5.233 0.338 1.00 0.00 O ATOM 419 CB TRP A 55 6.182 -3.947 1.386 1.00 0.00 C ATOM 420 CG TRP A 55 5.753 -3.810 2.807 1.00 0.00 C ATOM 421 CD1 TRP A 55 5.050 -2.770 3.298 1.00 0.00 C ATOM 422 CD2 TRP A 55 5.981 -4.714 3.928 1.00 0.00 C ATOM 423 NE1 TRP A 55 4.836 -2.973 4.647 1.00 0.00 N ATOM 424 CE2 TRP A 55 5.387 -4.154 5.082 1.00 0.00 C ATOM 425 CE3 TRP A 55 6.637 -5.951 4.061 1.00 0.00 C ATOM 426 CZ2 TRP A 55 5.438 -4.789 6.318 1.00 0.00 C ATOM 427 CZ3 TRP A 55 6.688 -6.596 5.308 1.00 0.00 C ATOM 428 CH2 TRP A 55 6.088 -6.011 6.433 1.00 0.00 C ATOM 0 H TRP A 55 7.338 -3.383 -0.909 1.00 0.00 H new ATOM 0 HA TRP A 55 7.847 -2.662 1.992 1.00 0.00 H new ATOM 0 HB2 TRP A 55 5.485 -3.420 0.734 1.00 0.00 H new ATOM 0 HB3 TRP A 55 6.164 -4.996 1.091 1.00 0.00 H new ATOM 0 HD1 TRP A 55 4.710 -1.917 2.729 1.00 0.00 H new ATOM 0 HE1 TRP A 55 4.329 -2.324 5.249 1.00 0.00 H new ATOM 0 HE3 TRP A 55 7.104 -6.407 3.200 1.00 0.00 H new ATOM 0 HZ2 TRP A 55 4.976 -4.335 7.182 1.00 0.00 H new ATOM 0 HZ3 TRP A 55 7.192 -7.547 5.401 1.00 0.00 H new ATOM 0 HH2 TRP A 55 6.132 -6.511 7.389 1.00 0.00 H new ATOM 439 N LEU A 56 9.271 -4.658 2.433 1.00 0.00 N ATOM 440 CA LEU A 56 10.276 -5.755 2.584 1.00 0.00 C ATOM 441 C LEU A 56 9.751 -6.822 3.535 1.00 0.00 C ATOM 442 O LEU A 56 9.352 -6.525 4.656 1.00 0.00 O ATOM 443 CB LEU A 56 11.518 -5.098 3.167 1.00 0.00 C ATOM 444 CG LEU A 56 12.769 -5.900 2.766 1.00 0.00 C ATOM 445 CD1 LEU A 56 13.910 -4.940 2.428 1.00 0.00 C ATOM 446 CD2 LEU A 56 13.197 -6.804 3.928 1.00 0.00 C ATOM 0 H LEU A 56 9.142 -4.073 3.258 1.00 0.00 H new ATOM 0 HA LEU A 56 10.486 -6.243 1.632 1.00 0.00 H new ATOM 0 HB2 LEU A 56 11.601 -4.073 2.807 1.00 0.00 H new ATOM 0 HB3 LEU A 56 11.439 -5.049 4.253 1.00 0.00 H new ATOM 0 HG LEU A 56 12.537 -6.512 1.894 1.00 0.00 H new ATOM 0 HD11 LEU A 56 14.794 -5.511 2.145 1.00 0.00 H new ATOM 0 HD12 LEU A 56 13.612 -4.298 1.599 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.139 -4.326 3.299 1.00 0.00 H new ATOM 0 HD21 LEU A 56 14.083 -7.371 3.641 1.00 0.00 H new ATOM 0 HD22 LEU A 56 13.425 -6.192 4.801 1.00 0.00 H new ATOM 0 HD23 LEU A 56 12.388 -7.493 4.170 1.00 0.00 H new ATOM 458 N ASP A 57 9.761 -8.060 3.093 1.00 0.00 N ATOM 459 CA ASP A 57 9.264 -9.176 3.948 1.00 0.00 C ATOM 460 C ASP A 57 10.344 -9.639 4.926 1.00 0.00 C ATOM 461 O ASP A 57 11.514 -9.760 4.588 1.00 0.00 O ATOM 462 CB ASP A 57 8.879 -10.319 3.000 1.00 0.00 C ATOM 463 CG ASP A 57 7.837 -9.832 1.986 1.00 0.00 C ATOM 464 OD1 ASP A 57 6.657 -9.942 2.281 1.00 0.00 O ATOM 465 OD2 ASP A 57 8.234 -9.359 0.935 1.00 0.00 O ATOM 0 H ASP A 57 10.095 -8.341 2.171 1.00 0.00 H new ATOM 0 HA ASP A 57 8.411 -8.852 4.544 1.00 0.00 H new ATOM 0 HB2 ASP A 57 9.764 -10.683 2.478 1.00 0.00 H new ATOM 0 HB3 ASP A 57 8.479 -11.157 3.571 1.00 0.00 H new ATOM 470 N GLY A 58 9.927 -9.888 6.141 1.00 0.00 N ATOM 471 CA GLY A 58 10.834 -10.330 7.239 1.00 0.00 C ATOM 472 C GLY A 58 11.718 -11.517 6.839 1.00 0.00 C ATOM 473 O GLY A 58 12.735 -11.757 7.470 1.00 0.00 O ATOM 0 H GLY A 58 8.952 -9.798 6.426 1.00 0.00 H new ATOM 0 HA2 GLY A 58 11.468 -9.495 7.538 1.00 0.00 H new ATOM 0 HA3 GLY A 58 10.237 -10.604 8.109 1.00 0.00 H new ATOM 477 N SER A 59 11.353 -12.266 5.815 1.00 0.00 N ATOM 478 CA SER A 59 12.188 -13.442 5.405 1.00 0.00 C ATOM 479 C SER A 59 13.336 -13.025 4.466 1.00 0.00 C ATOM 480 O SER A 59 13.969 -13.872 3.860 1.00 0.00 O ATOM 481 CB SER A 59 11.221 -14.375 4.675 1.00 0.00 C ATOM 482 OG SER A 59 10.246 -14.851 5.594 1.00 0.00 O ATOM 0 H SER A 59 10.517 -12.111 5.251 1.00 0.00 H new ATOM 0 HA SER A 59 12.659 -13.914 6.267 1.00 0.00 H new ATOM 0 HB2 SER A 59 10.737 -13.846 3.854 1.00 0.00 H new ATOM 0 HB3 SER A 59 11.765 -15.212 4.238 1.00 0.00 H new ATOM 0 HG SER A 59 9.623 -15.448 5.130 1.00 0.00 H new ATOM 488 N GLY A 60 13.620 -11.737 4.348 1.00 0.00 N ATOM 489 CA GLY A 60 14.734 -11.286 3.461 1.00 0.00 C ATOM 490 C GLY A 60 14.265 -11.158 2.022 1.00 0.00 C ATOM 491 O GLY A 60 15.058 -11.253 1.098 1.00 0.00 O ATOM 0 H GLY A 60 13.124 -10.988 4.831 1.00 0.00 H new ATOM 0 HA2 GLY A 60 15.116 -10.326 3.810 1.00 0.00 H new ATOM 0 HA3 GLY A 60 15.559 -11.997 3.517 1.00 0.00 H new ATOM 495 N LEU A 61 12.989 -10.947 1.821 1.00 0.00 N ATOM 496 CA LEU A 61 12.456 -10.816 0.429 1.00 0.00 C ATOM 497 C LEU A 61 11.664 -9.524 0.295 1.00 0.00 C ATOM 498 O LEU A 61 10.721 -9.299 1.026 1.00 0.00 O ATOM 499 CB LEU A 61 11.542 -12.028 0.233 1.00 0.00 C ATOM 500 CG LEU A 61 12.353 -13.318 0.378 1.00 0.00 C ATOM 501 CD1 LEU A 61 11.411 -14.522 0.314 1.00 0.00 C ATOM 502 CD2 LEU A 61 13.373 -13.412 -0.757 1.00 0.00 C ATOM 0 H LEU A 61 12.292 -10.860 2.561 1.00 0.00 H new ATOM 0 HA LEU A 61 13.251 -10.785 -0.316 1.00 0.00 H new ATOM 0 HB2 LEU A 61 10.736 -12.010 0.967 1.00 0.00 H new ATOM 0 HB3 LEU A 61 11.077 -11.989 -0.752 1.00 0.00 H new ATOM 0 HG LEU A 61 12.874 -13.312 1.335 1.00 0.00 H new ATOM 0 HD11 LEU A 61 11.988 -15.441 0.417 1.00 0.00 H new ATOM 0 HD12 LEU A 61 10.683 -14.458 1.123 1.00 0.00 H new ATOM 0 HD13 LEU A 61 10.890 -14.526 -0.644 1.00 0.00 H new ATOM 0 HD21 LEU A 61 13.950 -14.331 -0.653 1.00 0.00 H new ATOM 0 HD22 LEU A 61 12.852 -13.417 -1.715 1.00 0.00 H new ATOM 0 HD23 LEU A 61 14.045 -12.555 -0.714 1.00 0.00 H new ATOM 514 N GLY A 62 12.042 -8.674 -0.629 1.00 0.00 N ATOM 515 CA GLY A 62 11.308 -7.387 -0.810 1.00 0.00 C ATOM 516 C GLY A 62 10.518 -7.405 -2.108 1.00 0.00 C ATOM 517 O GLY A 62 10.793 -8.179 -3.005 1.00 0.00 O ATOM 0 H GLY A 62 12.827 -8.818 -1.264 1.00 0.00 H new ATOM 0 HA2 GLY A 62 10.634 -7.224 0.031 1.00 0.00 H new ATOM 0 HA3 GLY A 62 12.014 -6.557 -0.818 1.00 0.00 H new ATOM 521 N PHE A 63 9.544 -6.538 -2.206 1.00 0.00 N ATOM 522 CA PHE A 63 8.724 -6.456 -3.449 1.00 0.00 C ATOM 523 C PHE A 63 8.152 -5.054 -3.587 1.00 0.00 C ATOM 524 O PHE A 63 7.811 -4.416 -2.605 1.00 0.00 O ATOM 525 CB PHE A 63 7.635 -7.541 -3.349 1.00 0.00 C ATOM 526 CG PHE A 63 6.694 -7.326 -2.178 1.00 0.00 C ATOM 527 CD1 PHE A 63 7.154 -7.448 -0.859 1.00 0.00 C ATOM 528 CD2 PHE A 63 5.339 -7.063 -2.419 1.00 0.00 C ATOM 529 CE1 PHE A 63 6.262 -7.307 0.213 1.00 0.00 C ATOM 530 CE2 PHE A 63 4.449 -6.910 -1.348 1.00 0.00 C ATOM 531 CZ PHE A 63 4.907 -7.034 -0.032 1.00 0.00 C ATOM 0 H PHE A 63 9.281 -5.879 -1.473 1.00 0.00 H new ATOM 0 HA PHE A 63 9.316 -6.637 -4.346 1.00 0.00 H new ATOM 0 HB2 PHE A 63 7.058 -7.557 -4.274 1.00 0.00 H new ATOM 0 HB3 PHE A 63 8.110 -8.517 -3.253 1.00 0.00 H new ATOM 0 HD1 PHE A 63 8.198 -7.651 -0.669 1.00 0.00 H new ATOM 0 HD2 PHE A 63 4.979 -6.978 -3.434 1.00 0.00 H new ATOM 0 HE1 PHE A 63 6.617 -7.408 1.228 1.00 0.00 H new ATOM 0 HE2 PHE A 63 3.408 -6.696 -1.539 1.00 0.00 H new ATOM 0 HZ PHE A 63 4.220 -6.920 0.793 1.00 0.00 H new ATOM 541 N SER A 64 8.081 -4.559 -4.802 1.00 0.00 N ATOM 542 CA SER A 64 7.572 -3.178 -5.018 1.00 0.00 C ATOM 543 C SER A 64 6.172 -3.178 -5.622 1.00 0.00 C ATOM 544 O SER A 64 5.917 -3.798 -6.639 1.00 0.00 O ATOM 545 CB SER A 64 8.571 -2.543 -5.982 1.00 0.00 C ATOM 546 OG SER A 64 8.877 -3.465 -7.017 1.00 0.00 O ATOM 0 H SER A 64 8.355 -5.057 -5.649 1.00 0.00 H new ATOM 0 HA SER A 64 7.489 -2.632 -4.078 1.00 0.00 H new ATOM 0 HB2 SER A 64 8.154 -1.629 -6.405 1.00 0.00 H new ATOM 0 HB3 SER A 64 9.480 -2.262 -5.449 1.00 0.00 H new ATOM 0 HG SER A 64 8.065 -3.950 -7.274 1.00 0.00 H new ATOM 552 N LEU A 65 5.272 -2.460 -4.999 1.00 0.00 N ATOM 553 CA LEU A 65 3.877 -2.367 -5.515 1.00 0.00 C ATOM 554 C LEU A 65 3.719 -1.068 -6.316 1.00 0.00 C ATOM 555 O LEU A 65 3.795 0.020 -5.766 1.00 0.00 O ATOM 556 CB LEU A 65 2.986 -2.342 -4.269 1.00 0.00 C ATOM 557 CG LEU A 65 3.179 -3.634 -3.471 1.00 0.00 C ATOM 558 CD1 LEU A 65 2.462 -3.515 -2.125 1.00 0.00 C ATOM 559 CD2 LEU A 65 2.595 -4.811 -4.256 1.00 0.00 C ATOM 0 H LEU A 65 5.449 -1.929 -4.146 1.00 0.00 H new ATOM 0 HA LEU A 65 3.617 -3.195 -6.174 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.234 -1.480 -3.650 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.941 -2.235 -4.559 1.00 0.00 H new ATOM 0 HG LEU A 65 4.243 -3.801 -3.303 1.00 0.00 H new ATOM 0 HD11 LEU A 65 2.599 -4.435 -1.557 1.00 0.00 H new ATOM 0 HD12 LEU A 65 2.877 -2.677 -1.565 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.398 -3.348 -2.293 1.00 0.00 H new ATOM 0 HD21 LEU A 65 2.732 -5.731 -3.688 1.00 0.00 H new ATOM 0 HD22 LEU A 65 1.531 -4.644 -4.424 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.105 -4.897 -5.215 1.00 0.00 H new ATOM 571 N GLU A 66 3.513 -1.179 -7.607 1.00 0.00 N ATOM 572 CA GLU A 66 3.360 0.043 -8.462 1.00 0.00 C ATOM 573 C GLU A 66 2.021 0.727 -8.181 1.00 0.00 C ATOM 574 O GLU A 66 1.922 1.942 -8.198 1.00 0.00 O ATOM 575 CB GLU A 66 3.410 -0.459 -9.908 1.00 0.00 C ATOM 576 CG GLU A 66 4.797 -1.042 -10.200 1.00 0.00 C ATOM 577 CD GLU A 66 4.879 -1.478 -11.666 1.00 0.00 C ATOM 578 OE1 GLU A 66 3.861 -1.881 -12.207 1.00 0.00 O ATOM 579 OE2 GLU A 66 5.961 -1.403 -12.225 1.00 0.00 O ATOM 0 H GLU A 66 3.444 -2.065 -8.107 1.00 0.00 H new ATOM 0 HA GLU A 66 4.141 0.777 -8.261 1.00 0.00 H new ATOM 0 HB2 GLU A 66 2.644 -1.218 -10.067 1.00 0.00 H new ATOM 0 HB3 GLU A 66 3.196 0.359 -10.596 1.00 0.00 H new ATOM 0 HG2 GLU A 66 5.566 -0.299 -9.989 1.00 0.00 H new ATOM 0 HG3 GLU A 66 4.989 -1.893 -9.547 1.00 0.00 H new ATOM 586 N TYR A 67 0.994 -0.048 -7.925 1.00 0.00 N ATOM 587 CA TYR A 67 -0.353 0.543 -7.640 1.00 0.00 C ATOM 588 C TYR A 67 -0.637 0.509 -6.124 1.00 0.00 C ATOM 589 O TYR A 67 -0.253 -0.435 -5.460 1.00 0.00 O ATOM 590 CB TYR A 67 -1.358 -0.328 -8.413 1.00 0.00 C ATOM 591 CG TYR A 67 -1.272 -1.769 -7.959 1.00 0.00 C ATOM 592 CD1 TYR A 67 -1.916 -2.173 -6.782 1.00 0.00 C ATOM 593 CD2 TYR A 67 -0.553 -2.702 -8.718 1.00 0.00 C ATOM 594 CE1 TYR A 67 -1.838 -3.506 -6.364 1.00 0.00 C ATOM 595 CE2 TYR A 67 -0.477 -4.037 -8.299 1.00 0.00 C ATOM 596 CZ TYR A 67 -1.118 -4.439 -7.121 1.00 0.00 C ATOM 597 OH TYR A 67 -1.043 -5.754 -6.709 1.00 0.00 O ATOM 0 H TYR A 67 1.030 -1.067 -7.901 1.00 0.00 H new ATOM 0 HA TYR A 67 -0.418 1.587 -7.948 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -2.369 0.048 -8.257 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -1.155 -0.265 -9.482 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -2.473 -1.455 -6.197 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -0.057 -2.392 -9.626 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -2.334 -3.816 -5.456 1.00 0.00 H new ATOM 0 HE2 TYR A 67 0.076 -4.756 -8.885 1.00 0.00 H new ATOM 0 HH TYR A 67 -0.507 -6.267 -7.349 1.00 0.00 H new ATOM 607 N PRO A 68 -1.299 1.537 -5.608 1.00 0.00 N ATOM 608 CA PRO A 68 -1.605 1.565 -4.156 1.00 0.00 C ATOM 609 C PRO A 68 -2.698 0.546 -3.826 1.00 0.00 C ATOM 610 O PRO A 68 -3.733 0.511 -4.468 1.00 0.00 O ATOM 611 CB PRO A 68 -2.097 2.989 -3.913 1.00 0.00 C ATOM 612 CG PRO A 68 -2.615 3.452 -5.236 1.00 0.00 C ATOM 613 CD PRO A 68 -1.817 2.740 -6.296 1.00 0.00 C ATOM 0 HA PRO A 68 -0.748 1.309 -3.533 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -2.879 3.012 -3.154 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -1.290 3.630 -3.559 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -3.676 3.225 -5.335 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -2.509 4.532 -5.335 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -2.438 2.474 -7.151 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -1.007 3.364 -6.672 1.00 0.00 H new ATOM 621 N THR A 69 -2.471 -0.277 -2.831 1.00 0.00 N ATOM 622 CA THR A 69 -3.489 -1.302 -2.443 1.00 0.00 C ATOM 623 C THR A 69 -4.369 -0.780 -1.298 1.00 0.00 C ATOM 624 O THR A 69 -4.928 -1.554 -0.543 1.00 0.00 O ATOM 625 CB THR A 69 -2.677 -2.512 -1.984 1.00 0.00 C ATOM 626 OG1 THR A 69 -1.764 -2.883 -3.007 1.00 0.00 O ATOM 627 CG2 THR A 69 -3.617 -3.680 -1.687 1.00 0.00 C ATOM 0 H THR A 69 -1.620 -0.282 -2.269 1.00 0.00 H new ATOM 0 HA THR A 69 -4.159 -1.546 -3.268 1.00 0.00 H new ATOM 0 HB THR A 69 -2.125 -2.256 -1.079 1.00 0.00 H new ATOM 0 HG1 THR A 69 -1.241 -3.658 -2.714 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.035 -4.541 -1.360 1.00 0.00 H new ATOM 0 HG22 THR A 69 -4.315 -3.394 -0.900 1.00 0.00 H new ATOM 0 HG23 THR A 69 -4.172 -3.939 -2.589 1.00 0.00 H new ATOM 635 N ILE A 70 -4.492 0.523 -1.171 1.00 0.00 N ATOM 636 CA ILE A 70 -5.334 1.104 -0.080 1.00 0.00 C ATOM 637 C ILE A 70 -6.671 1.608 -0.649 1.00 0.00 C ATOM 638 O ILE A 70 -6.735 2.095 -1.763 1.00 0.00 O ATOM 639 CB ILE A 70 -4.501 2.257 0.504 1.00 0.00 C ATOM 640 CG1 ILE A 70 -5.275 2.933 1.642 1.00 0.00 C ATOM 641 CG2 ILE A 70 -4.193 3.295 -0.581 1.00 0.00 C ATOM 642 CD1 ILE A 70 -4.326 3.821 2.450 1.00 0.00 C ATOM 0 H ILE A 70 -4.043 1.208 -1.779 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.585 0.370 0.686 1.00 0.00 H new ATOM 0 HB ILE A 70 -3.565 1.849 0.886 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -6.091 3.530 1.236 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -5.723 2.179 2.289 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -3.603 4.105 -0.153 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -3.631 2.823 -1.387 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.126 3.696 -0.976 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.877 4.301 3.259 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.525 3.211 2.869 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -3.899 4.584 1.799 1.00 0.00 H new ATOM 654 N SER A 71 -7.726 1.492 0.120 1.00 0.00 N ATOM 655 CA SER A 71 -9.068 1.963 -0.347 1.00 0.00 C ATOM 656 C SER A 71 -9.768 2.702 0.794 1.00 0.00 C ATOM 657 O SER A 71 -9.938 3.908 0.747 1.00 0.00 O ATOM 658 CB SER A 71 -9.830 0.696 -0.738 1.00 0.00 C ATOM 659 OG SER A 71 -10.504 0.915 -1.968 1.00 0.00 O ATOM 0 H SER A 71 -7.715 1.089 1.057 1.00 0.00 H new ATOM 0 HA SER A 71 -9.006 2.654 -1.188 1.00 0.00 H new ATOM 0 HB2 SER A 71 -9.140 -0.143 -0.832 1.00 0.00 H new ATOM 0 HB3 SER A 71 -10.546 0.434 0.041 1.00 0.00 H new ATOM 0 HG SER A 71 -10.992 0.104 -2.222 1.00 0.00 H new ATOM 665 N LEU A 72 -10.140 1.989 1.831 1.00 0.00 N ATOM 666 CA LEU A 72 -10.789 2.635 3.006 1.00 0.00 C ATOM 667 C LEU A 72 -9.748 2.731 4.108 1.00 0.00 C ATOM 668 O LEU A 72 -9.141 1.745 4.428 1.00 0.00 O ATOM 669 CB LEU A 72 -11.923 1.681 3.413 1.00 0.00 C ATOM 670 CG LEU A 72 -12.645 2.198 4.668 1.00 0.00 C ATOM 671 CD1 LEU A 72 -14.124 1.820 4.587 1.00 0.00 C ATOM 672 CD2 LEU A 72 -12.054 1.561 5.932 1.00 0.00 C ATOM 0 H LEU A 72 -10.019 0.979 1.910 1.00 0.00 H new ATOM 0 HA LEU A 72 -11.175 3.634 2.803 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -12.634 1.583 2.593 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -11.518 0.687 3.604 1.00 0.00 H new ATOM 0 HG LEU A 72 -12.523 3.280 4.717 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -14.642 2.184 5.474 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.567 2.270 3.698 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -14.220 0.736 4.530 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -12.578 1.940 6.809 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -12.167 0.478 5.881 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -10.996 1.812 6.005 1.00 0.00 H new ATOM 684 N HIS A 73 -9.523 3.892 4.669 1.00 0.00 N ATOM 685 CA HIS A 73 -8.499 4.039 5.742 1.00 0.00 C ATOM 686 C HIS A 73 -9.173 4.197 7.110 1.00 0.00 C ATOM 687 O HIS A 73 -9.889 5.147 7.361 1.00 0.00 O ATOM 688 CB HIS A 73 -7.722 5.304 5.363 1.00 0.00 C ATOM 689 CG HIS A 73 -6.603 5.535 6.341 1.00 0.00 C ATOM 690 ND1 HIS A 73 -6.837 5.862 7.667 1.00 0.00 N ATOM 691 CD2 HIS A 73 -5.238 5.501 6.199 1.00 0.00 C ATOM 692 CE1 HIS A 73 -5.640 6.013 8.265 1.00 0.00 C ATOM 693 NE2 HIS A 73 -4.633 5.804 7.415 1.00 0.00 N ATOM 0 H HIS A 73 -10.012 4.753 4.425 1.00 0.00 H new ATOM 0 HA HIS A 73 -7.849 3.168 5.821 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -7.320 5.205 4.355 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -8.392 6.163 5.356 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -7.750 5.969 8.110 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -4.713 5.274 5.283 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -5.511 6.272 9.306 1.00 0.00 H new ATOM 701 N ALA A 74 -8.937 3.254 7.988 1.00 0.00 N ATOM 702 CA ALA A 74 -9.540 3.299 9.355 1.00 0.00 C ATOM 703 C ALA A 74 -8.471 3.660 10.392 1.00 0.00 C ATOM 704 O ALA A 74 -7.522 2.919 10.602 1.00 0.00 O ATOM 705 CB ALA A 74 -10.084 1.879 9.605 1.00 0.00 C ATOM 0 H ALA A 74 -8.343 2.443 7.812 1.00 0.00 H new ATOM 0 HA ALA A 74 -10.325 4.051 9.434 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -10.543 1.834 10.593 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -10.829 1.636 8.847 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -9.265 1.161 9.552 1.00 0.00 H new ATOM 711 N VAL A 75 -8.628 4.790 11.043 1.00 0.00 N ATOM 712 CA VAL A 75 -7.633 5.214 12.081 1.00 0.00 C ATOM 713 C VAL A 75 -8.011 4.626 13.443 1.00 0.00 C ATOM 714 O VAL A 75 -8.265 5.342 14.393 1.00 0.00 O ATOM 715 CB VAL A 75 -7.687 6.751 12.110 1.00 0.00 C ATOM 716 CG1 VAL A 75 -7.280 7.299 10.744 1.00 0.00 C ATOM 717 CG2 VAL A 75 -9.105 7.235 12.451 1.00 0.00 C ATOM 0 H VAL A 75 -9.403 5.437 10.900 1.00 0.00 H new ATOM 0 HA VAL A 75 -6.628 4.861 11.851 1.00 0.00 H new ATOM 0 HB VAL A 75 -6.999 7.111 12.875 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -7.318 8.388 10.763 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.266 6.975 10.509 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -7.965 6.925 9.983 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -9.124 8.325 12.467 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -9.804 6.871 11.698 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -9.394 6.853 13.430 1.00 0.00 H new ATOM 727 N SER A 76 -8.055 3.315 13.542 1.00 0.00 N ATOM 728 CA SER A 76 -8.419 2.640 14.837 1.00 0.00 C ATOM 729 C SER A 76 -9.757 3.164 15.376 1.00 0.00 C ATOM 730 O SER A 76 -9.789 4.047 16.217 1.00 0.00 O ATOM 731 CB SER A 76 -7.284 2.966 15.815 1.00 0.00 C ATOM 732 OG SER A 76 -6.037 2.841 15.143 1.00 0.00 O ATOM 0 H SER A 76 -7.852 2.676 12.773 1.00 0.00 H new ATOM 0 HA SER A 76 -8.537 1.565 14.699 1.00 0.00 H new ATOM 0 HB2 SER A 76 -7.402 3.978 16.203 1.00 0.00 H new ATOM 0 HB3 SER A 76 -7.319 2.291 16.670 1.00 0.00 H new ATOM 0 HG SER A 76 -6.089 2.112 14.490 1.00 0.00 H new ATOM 738 N ARG A 77 -10.854 2.624 14.897 1.00 0.00 N ATOM 739 CA ARG A 77 -12.201 3.081 15.379 1.00 0.00 C ATOM 740 C ARG A 77 -12.324 2.843 16.886 1.00 0.00 C ATOM 741 O ARG A 77 -12.808 3.688 17.618 1.00 0.00 O ATOM 742 CB ARG A 77 -13.222 2.228 14.618 1.00 0.00 C ATOM 743 CG ARG A 77 -14.629 2.778 14.858 1.00 0.00 C ATOM 744 CD ARG A 77 -14.889 3.951 13.910 1.00 0.00 C ATOM 745 NE ARG A 77 -15.066 3.327 12.570 1.00 0.00 N ATOM 746 CZ ARG A 77 -15.909 3.842 11.716 1.00 0.00 C ATOM 747 NH1 ARG A 77 -17.180 3.902 12.009 1.00 0.00 N ATOM 748 NH2 ARG A 77 -15.483 4.296 10.569 1.00 0.00 N ATOM 0 H ARG A 77 -10.876 1.886 14.193 1.00 0.00 H new ATOM 0 HA ARG A 77 -12.358 4.145 15.204 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -12.995 2.235 13.552 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -13.164 1.191 14.949 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -15.369 1.995 14.696 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -14.732 3.104 15.893 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -15.777 4.509 14.206 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -14.055 4.653 13.912 1.00 0.00 H new ATOM 0 HE ARG A 77 -14.529 2.497 12.319 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -17.514 3.547 12.905 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -17.839 4.304 11.342 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -14.490 4.249 10.339 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -16.143 4.698 9.903 1.00 0.00 H new ATOM 762 N ASP A 78 -11.882 1.698 17.347 1.00 0.00 N ATOM 763 CA ASP A 78 -11.952 1.381 18.807 1.00 0.00 C ATOM 764 C ASP A 78 -10.596 1.636 19.464 1.00 0.00 C ATOM 765 O ASP A 78 -9.609 1.003 19.131 1.00 0.00 O ATOM 766 CB ASP A 78 -12.311 -0.106 18.873 1.00 0.00 C ATOM 767 CG ASP A 78 -13.677 -0.336 18.220 1.00 0.00 C ATOM 768 OD1 ASP A 78 -14.522 0.539 18.331 1.00 0.00 O ATOM 769 OD2 ASP A 78 -13.854 -1.383 17.619 1.00 0.00 O ATOM 0 H ASP A 78 -11.473 0.964 16.769 1.00 0.00 H new ATOM 0 HA ASP A 78 -12.681 1.998 19.331 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -11.550 -0.697 18.364 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -12.332 -0.439 19.911 1.00 0.00 H new ATOM 774 N LEU A 79 -10.542 2.559 20.398 1.00 0.00 N ATOM 775 CA LEU A 79 -9.254 2.870 21.090 1.00 0.00 C ATOM 776 C LEU A 79 -9.476 3.001 22.596 1.00 0.00 C ATOM 777 O LEU A 79 -9.104 2.143 23.372 1.00 0.00 O ATOM 778 CB LEU A 79 -8.786 4.196 20.487 1.00 0.00 C ATOM 779 CG LEU A 79 -8.158 3.943 19.112 1.00 0.00 C ATOM 780 CD1 LEU A 79 -8.037 5.268 18.357 1.00 0.00 C ATOM 781 CD2 LEU A 79 -6.767 3.322 19.287 1.00 0.00 C ATOM 0 H LEU A 79 -11.341 3.111 20.710 1.00 0.00 H new ATOM 0 HA LEU A 79 -8.513 2.083 20.954 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -9.628 4.881 20.393 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -8.061 4.671 21.147 1.00 0.00 H new ATOM 0 HG LEU A 79 -8.789 3.258 18.546 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -7.590 5.090 17.379 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -9.027 5.706 18.230 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -7.407 5.954 18.924 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -6.323 3.143 18.308 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -6.133 4.004 19.854 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -6.855 2.377 19.824 1.00 0.00 H new ATOM 793 N ASN A 80 -10.081 4.082 23.009 1.00 0.00 N ATOM 794 CA ASN A 80 -10.354 4.326 24.469 1.00 0.00 C ATOM 795 C ASN A 80 -9.070 4.196 25.303 1.00 0.00 C ATOM 796 O ASN A 80 -9.085 3.668 26.400 1.00 0.00 O ATOM 797 CB ASN A 80 -11.374 3.259 24.884 1.00 0.00 C ATOM 798 CG ASN A 80 -12.688 3.482 24.131 1.00 0.00 C ATOM 799 OD1 ASN A 80 -12.972 4.578 23.689 1.00 0.00 O ATOM 800 ND2 ASN A 80 -13.509 2.482 23.967 1.00 0.00 N ATOM 0 H ASN A 80 -10.406 4.824 22.390 1.00 0.00 H new ATOM 0 HA ASN A 80 -10.731 5.335 24.637 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -10.983 2.265 24.667 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -11.547 3.306 25.959 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -14.388 2.620 23.468 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -13.272 1.562 24.337 1.00 0.00 H new ATOM 807 N ALA A 81 -7.966 4.679 24.780 1.00 0.00 N ATOM 808 CA ALA A 81 -6.672 4.598 25.523 1.00 0.00 C ATOM 809 C ALA A 81 -5.618 5.463 24.834 1.00 0.00 C ATOM 810 O ALA A 81 -5.220 6.498 25.335 1.00 0.00 O ATOM 811 CB ALA A 81 -6.278 3.119 25.480 1.00 0.00 C ATOM 0 H ALA A 81 -7.909 5.127 23.866 1.00 0.00 H new ATOM 0 HA ALA A 81 -6.757 4.961 26.547 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -5.334 2.978 26.007 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -7.054 2.522 25.959 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -6.165 2.802 24.443 1.00 0.00 H new ATOM 817 N TYR A 82 -5.180 5.033 23.689 1.00 0.00 N ATOM 818 CA TYR A 82 -4.151 5.800 22.920 1.00 0.00 C ATOM 819 C TYR A 82 -4.733 6.229 21.556 1.00 0.00 C ATOM 820 O TYR A 82 -5.404 5.443 20.918 1.00 0.00 O ATOM 821 CB TYR A 82 -2.982 4.820 22.729 1.00 0.00 C ATOM 822 CG TYR A 82 -1.672 5.501 23.066 1.00 0.00 C ATOM 823 CD1 TYR A 82 -0.955 6.178 22.071 1.00 0.00 C ATOM 824 CD2 TYR A 82 -1.177 5.453 24.375 1.00 0.00 C ATOM 825 CE1 TYR A 82 0.255 6.805 22.386 1.00 0.00 C ATOM 826 CE2 TYR A 82 0.034 6.080 24.689 1.00 0.00 C ATOM 827 CZ TYR A 82 0.751 6.757 23.694 1.00 0.00 C ATOM 828 OH TYR A 82 1.944 7.375 24.003 1.00 0.00 O ATOM 0 H TYR A 82 -5.492 4.171 23.242 1.00 0.00 H new ATOM 0 HA TYR A 82 -3.834 6.708 23.434 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -3.121 3.947 23.366 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -2.961 4.463 21.699 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -1.336 6.216 21.061 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -1.730 4.932 25.142 1.00 0.00 H new ATOM 0 HE1 TYR A 82 0.807 7.327 21.619 1.00 0.00 H new ATOM 0 HE2 TYR A 82 0.416 6.042 25.699 1.00 0.00 H new ATOM 0 HH TYR A 82 2.142 7.246 24.954 1.00 0.00 H new ATOM 838 N PRO A 83 -4.472 7.460 21.142 1.00 0.00 N ATOM 839 CA PRO A 83 -5.009 7.933 19.838 1.00 0.00 C ATOM 840 C PRO A 83 -4.282 7.246 18.676 1.00 0.00 C ATOM 841 O PRO A 83 -4.835 7.080 17.604 1.00 0.00 O ATOM 842 CB PRO A 83 -4.724 9.431 19.847 1.00 0.00 C ATOM 843 CG PRO A 83 -3.568 9.600 20.777 1.00 0.00 C ATOM 844 CD PRO A 83 -3.676 8.511 21.811 1.00 0.00 C ATOM 0 HA PRO A 83 -6.068 7.709 19.709 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -4.482 9.793 18.848 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -5.591 9.996 20.189 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -2.624 9.527 20.237 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -3.591 10.583 21.247 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -2.694 8.141 22.105 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -4.167 8.868 22.717 1.00 0.00 H new ATOM 852 N ARG A 84 -3.047 6.855 18.885 1.00 0.00 N ATOM 853 CA ARG A 84 -2.265 6.182 17.800 1.00 0.00 C ATOM 854 C ARG A 84 -1.761 4.821 18.293 1.00 0.00 C ATOM 855 O ARG A 84 -1.267 4.708 19.401 1.00 0.00 O ATOM 856 CB ARG A 84 -1.086 7.121 17.524 1.00 0.00 C ATOM 857 CG ARG A 84 -1.599 8.490 17.068 1.00 0.00 C ATOM 858 CD ARG A 84 -2.297 8.349 15.716 1.00 0.00 C ATOM 859 NE ARG A 84 -2.580 9.746 15.279 1.00 0.00 N ATOM 860 CZ ARG A 84 -3.717 10.309 15.584 1.00 0.00 C ATOM 861 NH1 ARG A 84 -3.903 10.797 16.779 1.00 0.00 N ATOM 862 NH2 ARG A 84 -4.667 10.388 14.691 1.00 0.00 N ATOM 0 H ARG A 84 -2.545 6.974 19.765 1.00 0.00 H new ATOM 0 HA ARG A 84 -2.860 6.002 16.905 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -0.481 7.232 18.424 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -0.441 6.692 16.757 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -2.291 8.895 17.806 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -0.770 9.193 16.989 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -1.662 7.832 14.997 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -3.216 7.770 15.805 1.00 0.00 H new ATOM 0 HE ARG A 84 -1.884 10.262 14.741 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -3.160 10.739 17.475 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -4.792 11.237 17.018 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -4.520 10.010 13.755 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -5.556 10.828 14.929 1.00 0.00 H new ATOM 876 N GLU A 85 -1.878 3.786 17.480 1.00 0.00 N ATOM 877 CA GLU A 85 -1.400 2.427 17.908 1.00 0.00 C ATOM 878 C GLU A 85 -1.415 1.418 16.747 1.00 0.00 C ATOM 879 O GLU A 85 -0.566 0.545 16.680 1.00 0.00 O ATOM 880 CB GLU A 85 -2.380 1.986 19.003 1.00 0.00 C ATOM 881 CG GLU A 85 -1.916 0.656 19.603 1.00 0.00 C ATOM 882 CD GLU A 85 -2.957 0.154 20.607 1.00 0.00 C ATOM 883 OE1 GLU A 85 -4.133 0.378 20.372 1.00 0.00 O ATOM 884 OE2 GLU A 85 -2.561 -0.445 21.592 1.00 0.00 O ATOM 0 H GLU A 85 -2.282 3.827 16.544 1.00 0.00 H new ATOM 0 HA GLU A 85 -0.368 2.469 18.256 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -2.438 2.747 19.781 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -3.382 1.879 18.587 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -1.773 -0.081 18.813 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -0.953 0.785 20.096 1.00 0.00 H new ATOM 891 N HIS A 86 -2.384 1.501 15.858 1.00 0.00 N ATOM 892 CA HIS A 86 -2.464 0.513 14.725 1.00 0.00 C ATOM 893 C HIS A 86 -3.303 1.069 13.556 1.00 0.00 C ATOM 894 O HIS A 86 -4.393 1.569 13.773 1.00 0.00 O ATOM 895 CB HIS A 86 -3.144 -0.721 15.361 1.00 0.00 C ATOM 896 CG HIS A 86 -4.513 -0.370 15.888 1.00 0.00 C ATOM 897 ND1 HIS A 86 -5.651 -0.451 15.102 1.00 0.00 N ATOM 898 CD2 HIS A 86 -4.942 0.042 17.126 1.00 0.00 C ATOM 899 CE1 HIS A 86 -6.700 -0.100 15.869 1.00 0.00 C ATOM 900 NE2 HIS A 86 -6.321 0.212 17.111 1.00 0.00 N ATOM 0 H HIS A 86 -3.120 2.207 15.868 1.00 0.00 H new ATOM 0 HA HIS A 86 -1.487 0.284 14.299 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -3.228 -1.517 14.621 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -2.525 -1.104 16.172 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -4.304 0.209 17.981 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -7.723 -0.074 15.523 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -6.916 0.511 17.883 1.00 0.00 H new ATOM 908 N LEU A 87 -2.806 0.991 12.320 1.00 0.00 N ATOM 909 CA LEU A 87 -3.597 1.526 11.170 1.00 0.00 C ATOM 910 C LEU A 87 -4.276 0.423 10.356 1.00 0.00 C ATOM 911 O LEU A 87 -3.636 -0.452 9.813 1.00 0.00 O ATOM 912 CB LEU A 87 -2.620 2.325 10.300 1.00 0.00 C ATOM 913 CG LEU A 87 -3.364 3.454 9.575 1.00 0.00 C ATOM 914 CD1 LEU A 87 -2.365 4.289 8.772 1.00 0.00 C ATOM 915 CD2 LEU A 87 -4.405 2.859 8.617 1.00 0.00 C ATOM 0 H LEU A 87 -1.902 0.585 12.078 1.00 0.00 H new ATOM 0 HA LEU A 87 -4.408 2.152 11.541 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.826 2.741 10.920 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.145 1.666 9.573 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.864 4.083 10.311 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.893 5.091 8.257 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -1.624 4.717 9.447 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.866 3.654 8.040 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.931 3.665 8.105 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.905 2.228 7.883 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.120 2.261 9.182 1.00 0.00 H new ATOM 927 N TYR A 88 -5.586 0.487 10.270 1.00 0.00 N ATOM 928 CA TYR A 88 -6.355 -0.529 9.487 1.00 0.00 C ATOM 929 C TYR A 88 -6.971 0.090 8.242 1.00 0.00 C ATOM 930 O TYR A 88 -7.798 0.969 8.395 1.00 0.00 O ATOM 931 CB TYR A 88 -7.506 -0.911 10.421 1.00 0.00 C ATOM 932 CG TYR A 88 -8.086 -2.259 10.056 1.00 0.00 C ATOM 933 CD1 TYR A 88 -7.557 -3.393 10.648 1.00 0.00 C ATOM 934 CD2 TYR A 88 -9.154 -2.377 9.148 1.00 0.00 C ATOM 935 CE1 TYR A 88 -8.080 -4.645 10.360 1.00 0.00 C ATOM 936 CE2 TYR A 88 -9.680 -3.639 8.849 1.00 0.00 C ATOM 937 CZ TYR A 88 -9.143 -4.777 9.462 1.00 0.00 C ATOM 938 OH TYR A 88 -9.660 -6.027 9.190 1.00 0.00 O ATOM 0 H TYR A 88 -6.157 1.206 10.713 1.00 0.00 H new ATOM 0 HA TYR A 88 -5.719 -1.357 9.175 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -7.149 -0.933 11.451 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -8.286 -0.151 10.370 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -6.732 -3.302 11.339 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -9.568 -1.495 8.682 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -7.664 -5.523 10.832 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -10.496 -3.734 8.149 1.00 0.00 H new ATOM 0 HH TYR A 88 -10.612 -5.947 8.972 1.00 0.00 H new ATOM 948 N VAL A 89 -6.662 -0.373 7.023 1.00 0.00 N ATOM 949 CA VAL A 89 -7.373 0.222 5.831 1.00 0.00 C ATOM 950 C VAL A 89 -8.047 -0.896 4.996 1.00 0.00 C ATOM 951 O VAL A 89 -7.429 -1.846 4.573 1.00 0.00 O ATOM 952 CB VAL A 89 -6.370 1.109 5.044 1.00 0.00 C ATOM 953 CG1 VAL A 89 -5.664 2.069 6.012 1.00 0.00 C ATOM 954 CG2 VAL A 89 -5.285 0.300 4.367 1.00 0.00 C ATOM 0 H VAL A 89 -5.979 -1.103 6.819 1.00 0.00 H new ATOM 0 HA VAL A 89 -8.190 0.875 6.138 1.00 0.00 H new ATOM 0 HB VAL A 89 -6.952 1.636 4.288 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -4.960 2.691 5.459 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -6.404 2.704 6.499 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -5.126 1.495 6.766 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -4.612 0.970 3.832 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -4.723 -0.255 5.118 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.738 -0.398 3.663 1.00 0.00 H new ATOM 964 N MET A 90 -9.345 -0.807 4.822 1.00 0.00 N ATOM 965 CA MET A 90 -10.097 -1.890 4.099 1.00 0.00 C ATOM 966 C MET A 90 -10.171 -1.669 2.587 1.00 0.00 C ATOM 967 O MET A 90 -10.479 -0.595 2.113 1.00 0.00 O ATOM 968 CB MET A 90 -11.482 -1.868 4.737 1.00 0.00 C ATOM 969 CG MET A 90 -11.408 -2.609 6.073 1.00 0.00 C ATOM 970 SD MET A 90 -13.029 -2.584 6.875 1.00 0.00 S ATOM 971 CE MET A 90 -12.496 -1.860 8.445 1.00 0.00 C ATOM 0 H MET A 90 -9.920 -0.030 5.149 1.00 0.00 H new ATOM 0 HA MET A 90 -9.597 -2.853 4.197 1.00 0.00 H new ATOM 0 HB2 MET A 90 -11.813 -0.841 4.890 1.00 0.00 H new ATOM 0 HB3 MET A 90 -12.210 -2.343 4.080 1.00 0.00 H new ATOM 0 HG2 MET A 90 -11.087 -3.638 5.912 1.00 0.00 H new ATOM 0 HG3 MET A 90 -10.665 -2.141 6.719 1.00 0.00 H new ATOM 0 HE1 MET A 90 -13.306 -1.262 8.864 1.00 0.00 H new ATOM 0 HE2 MET A 90 -12.234 -2.656 9.142 1.00 0.00 H new ATOM 0 HE3 MET A 90 -11.626 -1.225 8.276 1.00 0.00 H new ATOM 981 N VAL A 91 -9.886 -2.709 1.834 1.00 0.00 N ATOM 982 CA VAL A 91 -9.929 -2.613 0.342 1.00 0.00 C ATOM 983 C VAL A 91 -10.856 -3.700 -0.225 1.00 0.00 C ATOM 984 O VAL A 91 -10.975 -4.781 0.329 1.00 0.00 O ATOM 985 CB VAL A 91 -8.482 -2.842 -0.125 1.00 0.00 C ATOM 986 CG1 VAL A 91 -8.408 -2.748 -1.654 1.00 0.00 C ATOM 987 CG2 VAL A 91 -7.555 -1.780 0.492 1.00 0.00 C ATOM 0 H VAL A 91 -9.624 -3.626 2.195 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.312 -1.651 0.002 1.00 0.00 H new ATOM 0 HB VAL A 91 -8.162 -3.833 0.197 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.381 -2.911 -1.979 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -9.053 -3.507 -2.097 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -8.737 -1.759 -1.974 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -6.532 -1.950 0.156 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -7.880 -0.788 0.179 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -7.596 -1.849 1.579 1.00 0.00 H new ATOM 997 N ASN A 92 -11.502 -3.415 -1.332 1.00 0.00 N ATOM 998 CA ASN A 92 -12.420 -4.417 -1.958 1.00 0.00 C ATOM 999 C ASN A 92 -11.628 -5.335 -2.892 1.00 0.00 C ATOM 1000 O ASN A 92 -10.694 -4.906 -3.548 1.00 0.00 O ATOM 1001 CB ASN A 92 -13.433 -3.590 -2.748 1.00 0.00 C ATOM 1002 CG ASN A 92 -14.243 -2.718 -1.788 1.00 0.00 C ATOM 1003 OD1 ASN A 92 -13.684 -1.984 -0.996 1.00 0.00 O ATOM 1004 ND2 ASN A 92 -15.546 -2.765 -1.824 1.00 0.00 N ATOM 0 H ASN A 92 -11.431 -2.527 -1.830 1.00 0.00 H new ATOM 0 HA ASN A 92 -12.907 -5.054 -1.220 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -12.918 -2.964 -3.477 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -14.098 -4.248 -3.307 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -16.095 -2.186 -1.188 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -16.016 -3.380 -2.488 1.00 0.00 H new ATOM 1011 N ALA A 93 -11.995 -6.593 -2.952 1.00 0.00 N ATOM 1012 CA ALA A 93 -11.273 -7.558 -3.837 1.00 0.00 C ATOM 1013 C ALA A 93 -12.002 -7.696 -5.173 1.00 0.00 C ATOM 1014 O ALA A 93 -13.213 -7.825 -5.217 1.00 0.00 O ATOM 1015 CB ALA A 93 -11.294 -8.884 -3.075 1.00 0.00 C ATOM 0 H ALA A 93 -12.769 -6.994 -2.422 1.00 0.00 H new ATOM 0 HA ALA A 93 -10.257 -7.233 -4.062 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -10.782 -9.648 -3.660 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -10.789 -8.761 -2.117 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -12.326 -9.189 -2.904 1.00 0.00 H new ATOM 1021 N LYS A 94 -11.267 -7.668 -6.258 1.00 0.00 N ATOM 1022 CA LYS A 94 -11.895 -7.797 -7.609 1.00 0.00 C ATOM 1023 C LYS A 94 -11.378 -9.051 -8.316 1.00 0.00 C ATOM 1024 O LYS A 94 -10.183 -9.249 -8.448 1.00 0.00 O ATOM 1025 CB LYS A 94 -11.466 -6.538 -8.361 1.00 0.00 C ATOM 1026 CG LYS A 94 -12.515 -5.445 -8.162 1.00 0.00 C ATOM 1027 CD LYS A 94 -12.116 -4.204 -8.963 1.00 0.00 C ATOM 1028 CE LYS A 94 -13.301 -3.238 -9.033 1.00 0.00 C ATOM 1029 NZ LYS A 94 -12.997 -2.341 -10.182 1.00 0.00 N ATOM 0 H LYS A 94 -10.253 -7.561 -6.265 1.00 0.00 H new ATOM 0 HA LYS A 94 -12.980 -7.891 -7.556 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.496 -6.197 -7.998 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -11.350 -6.757 -9.422 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -13.493 -5.801 -8.486 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.601 -5.196 -7.104 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -11.262 -3.715 -8.495 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.807 -4.491 -9.968 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -14.238 -3.773 -9.187 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -13.405 -2.672 -8.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -13.765 -1.649 -10.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -12.103 -1.840 -10.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -12.910 -2.907 -11.050 1.00 0.00 H new ATOM 1043 N PHE A 95 -12.273 -9.893 -8.773 1.00 0.00 N ATOM 1044 CA PHE A 95 -11.856 -11.144 -9.479 1.00 0.00 C ATOM 1045 C PHE A 95 -12.354 -11.125 -10.928 1.00 0.00 C ATOM 1046 O PHE A 95 -13.428 -10.624 -11.214 1.00 0.00 O ATOM 1047 CB PHE A 95 -12.518 -12.280 -8.698 1.00 0.00 C ATOM 1048 CG PHE A 95 -11.967 -12.310 -7.292 1.00 0.00 C ATOM 1049 CD1 PHE A 95 -10.778 -12.995 -7.021 1.00 0.00 C ATOM 1050 CD2 PHE A 95 -12.648 -11.653 -6.259 1.00 0.00 C ATOM 1051 CE1 PHE A 95 -10.267 -13.024 -5.716 1.00 0.00 C ATOM 1052 CE2 PHE A 95 -12.137 -11.682 -4.955 1.00 0.00 C ATOM 1053 CZ PHE A 95 -10.947 -12.367 -4.684 1.00 0.00 C ATOM 0 H PHE A 95 -13.281 -9.766 -8.686 1.00 0.00 H new ATOM 0 HA PHE A 95 -10.772 -11.255 -9.518 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -13.598 -12.138 -8.674 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -12.333 -13.233 -9.193 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -10.253 -13.502 -7.817 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -13.566 -11.124 -6.468 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -9.349 -13.553 -5.507 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -12.662 -11.175 -4.158 1.00 0.00 H new ATOM 0 HZ PHE A 95 -10.553 -12.389 -3.679 1.00 0.00 H new ATOM 1063 N GLY A 96 -11.580 -11.669 -11.835 1.00 0.00 N ATOM 1064 CA GLY A 96 -11.991 -11.694 -13.273 1.00 0.00 C ATOM 1065 C GLY A 96 -11.841 -10.296 -13.875 1.00 0.00 C ATOM 1066 O GLY A 96 -12.633 -9.884 -14.704 1.00 0.00 O ATOM 0 H GLY A 96 -10.676 -12.099 -11.640 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -11.377 -12.406 -13.825 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -13.024 -12.029 -13.360 1.00 0.00 H new ATOM 1070 N GLU A 97 -10.832 -9.567 -13.461 1.00 0.00 N ATOM 1071 CA GLU A 97 -10.615 -8.180 -14.002 1.00 0.00 C ATOM 1072 C GLU A 97 -10.467 -8.216 -15.529 1.00 0.00 C ATOM 1073 O GLU A 97 -9.917 -9.152 -16.084 1.00 0.00 O ATOM 1074 CB GLU A 97 -9.326 -7.670 -13.337 1.00 0.00 C ATOM 1075 CG GLU A 97 -8.145 -8.587 -13.684 1.00 0.00 C ATOM 1076 CD GLU A 97 -6.862 -8.016 -13.078 1.00 0.00 C ATOM 1077 OE1 GLU A 97 -6.409 -6.989 -13.554 1.00 0.00 O ATOM 1078 OE2 GLU A 97 -6.354 -8.617 -12.143 1.00 0.00 O ATOM 0 H GLU A 97 -10.146 -9.870 -12.770 1.00 0.00 H new ATOM 0 HA GLU A 97 -11.459 -7.525 -13.785 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -9.115 -6.654 -13.670 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -9.458 -7.630 -12.256 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -8.325 -9.591 -13.301 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -8.042 -8.672 -14.766 1.00 0.00 H new ATOM 1085 N GLU A 98 -10.954 -7.200 -16.206 1.00 0.00 N ATOM 1086 CA GLU A 98 -10.850 -7.163 -17.702 1.00 0.00 C ATOM 1087 C GLU A 98 -9.379 -7.167 -18.129 1.00 0.00 C ATOM 1088 O GLU A 98 -8.575 -6.412 -17.611 1.00 0.00 O ATOM 1089 CB GLU A 98 -11.524 -5.855 -18.131 1.00 0.00 C ATOM 1090 CG GLU A 98 -13.003 -5.893 -17.744 1.00 0.00 C ATOM 1091 CD GLU A 98 -13.697 -4.626 -18.250 1.00 0.00 C ATOM 1092 OE1 GLU A 98 -13.727 -3.655 -17.514 1.00 0.00 O ATOM 1093 OE2 GLU A 98 -14.187 -4.651 -19.368 1.00 0.00 O ATOM 0 H GLU A 98 -11.419 -6.395 -15.787 1.00 0.00 H new ATOM 0 HA GLU A 98 -11.324 -8.030 -18.162 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -11.034 -5.007 -17.653 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -11.422 -5.717 -19.207 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -13.479 -6.776 -18.171 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -13.105 -5.968 -16.661 1.00 0.00 H new ATOM 1100 N SER A 99 -9.029 -8.016 -19.066 1.00 0.00 N ATOM 1101 CA SER A 99 -7.612 -8.086 -19.541 1.00 0.00 C ATOM 1102 C SER A 99 -7.570 -8.341 -21.051 1.00 0.00 C ATOM 1103 O SER A 99 -8.491 -8.902 -21.618 1.00 0.00 O ATOM 1104 CB SER A 99 -6.998 -9.262 -18.782 1.00 0.00 C ATOM 1105 OG SER A 99 -7.085 -9.015 -17.385 1.00 0.00 O ATOM 0 H SER A 99 -9.668 -8.666 -19.524 1.00 0.00 H new ATOM 0 HA SER A 99 -7.071 -7.157 -19.362 1.00 0.00 H new ATOM 0 HB2 SER A 99 -7.521 -10.185 -19.033 1.00 0.00 H new ATOM 0 HB3 SER A 99 -5.957 -9.396 -19.075 1.00 0.00 H new ATOM 0 HG SER A 99 -7.994 -9.209 -17.074 1.00 0.00 H new ATOM 1111 N LYS A 100 -6.506 -7.931 -21.700 1.00 0.00 N ATOM 1112 CA LYS A 100 -6.381 -8.142 -23.173 1.00 0.00 C ATOM 1113 C LYS A 100 -5.520 -9.374 -23.457 1.00 0.00 C ATOM 1114 O LYS A 100 -4.576 -9.660 -22.745 1.00 0.00 O ATOM 1115 CB LYS A 100 -5.699 -6.877 -23.698 1.00 0.00 C ATOM 1116 CG LYS A 100 -6.630 -5.679 -23.514 1.00 0.00 C ATOM 1117 CD LYS A 100 -5.968 -4.423 -24.083 1.00 0.00 C ATOM 1118 CE LYS A 100 -5.873 -4.542 -25.606 1.00 0.00 C ATOM 1119 NZ LYS A 100 -5.588 -3.159 -26.082 1.00 0.00 N ATOM 0 H LYS A 100 -5.714 -7.456 -21.267 1.00 0.00 H new ATOM 0 HA LYS A 100 -7.346 -8.312 -23.650 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -4.763 -6.708 -23.165 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -5.449 -6.997 -24.752 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -7.579 -5.862 -24.018 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -6.853 -5.538 -22.456 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -6.546 -3.540 -23.812 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -4.974 -4.297 -23.655 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -5.082 -5.232 -25.900 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -6.802 -4.923 -26.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -5.509 -3.158 -27.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -6.361 -2.526 -25.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -4.695 -2.826 -25.666 1.00 0.00 H new ATOM 1133 N GLU A 101 -5.840 -10.112 -24.501 1.00 0.00 N ATOM 1134 CA GLU A 101 -5.049 -11.346 -24.857 1.00 0.00 C ATOM 1135 C GLU A 101 -4.942 -12.296 -23.654 1.00 0.00 C ATOM 1136 O GLU A 101 -3.985 -13.038 -23.524 1.00 0.00 O ATOM 1137 CB GLU A 101 -3.662 -10.843 -25.277 1.00 0.00 C ATOM 1138 CG GLU A 101 -2.928 -11.942 -26.050 1.00 0.00 C ATOM 1139 CD GLU A 101 -3.414 -11.964 -27.502 1.00 0.00 C ATOM 1140 OE1 GLU A 101 -4.577 -11.672 -27.724 1.00 0.00 O ATOM 1141 OE2 GLU A 101 -2.612 -12.274 -28.367 1.00 0.00 O ATOM 0 H GLU A 101 -6.620 -9.912 -25.127 1.00 0.00 H new ATOM 0 HA GLU A 101 -5.530 -11.911 -25.655 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -3.760 -9.952 -25.897 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -3.086 -10.557 -24.397 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -1.853 -11.766 -26.019 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -3.106 -12.910 -25.582 1.00 0.00 H new ATOM 1148 N SER A 102 -5.920 -12.267 -22.779 1.00 0.00 N ATOM 1149 CA SER A 102 -5.896 -13.160 -21.578 1.00 0.00 C ATOM 1150 C SER A 102 -7.163 -14.017 -21.531 1.00 0.00 C ATOM 1151 O SER A 102 -8.251 -13.541 -21.803 1.00 0.00 O ATOM 1152 CB SER A 102 -5.847 -12.211 -20.382 1.00 0.00 C ATOM 1153 OG SER A 102 -5.707 -12.968 -19.187 1.00 0.00 O ATOM 0 H SER A 102 -6.737 -11.660 -22.846 1.00 0.00 H new ATOM 0 HA SER A 102 -5.049 -13.846 -21.590 1.00 0.00 H new ATOM 0 HB2 SER A 102 -5.012 -11.518 -20.487 1.00 0.00 H new ATOM 0 HB3 SER A 102 -6.756 -11.611 -20.342 1.00 0.00 H new ATOM 0 HG SER A 102 -5.674 -12.362 -18.418 1.00 0.00 H new ATOM 1159 N VAL A 103 -7.023 -15.275 -21.186 1.00 0.00 N ATOM 1160 CA VAL A 103 -8.210 -16.184 -21.113 1.00 0.00 C ATOM 1161 C VAL A 103 -8.222 -16.936 -19.776 1.00 0.00 C ATOM 1162 O VAL A 103 -7.179 -17.232 -19.217 1.00 0.00 O ATOM 1163 CB VAL A 103 -8.051 -17.158 -22.292 1.00 0.00 C ATOM 1164 CG1 VAL A 103 -8.055 -16.373 -23.604 1.00 0.00 C ATOM 1165 CG2 VAL A 103 -6.728 -17.927 -22.171 1.00 0.00 C ATOM 0 H VAL A 103 -6.132 -15.713 -20.951 1.00 0.00 H new ATOM 0 HA VAL A 103 -9.151 -15.637 -21.172 1.00 0.00 H new ATOM 0 HB VAL A 103 -8.880 -17.866 -22.278 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -7.942 -17.062 -24.441 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -8.997 -15.834 -23.702 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.228 -15.663 -23.605 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -6.628 -18.613 -23.012 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.896 -17.223 -22.176 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -6.719 -18.492 -21.239 1.00 0.00 H new ATOM 1175 N ALA A 104 -9.393 -17.244 -19.269 1.00 0.00 N ATOM 1176 CA ALA A 104 -9.490 -17.979 -17.969 1.00 0.00 C ATOM 1177 C ALA A 104 -9.986 -19.407 -18.207 1.00 0.00 C ATOM 1178 O ALA A 104 -10.973 -19.622 -18.888 1.00 0.00 O ATOM 1179 CB ALA A 104 -10.508 -17.189 -17.143 1.00 0.00 C ATOM 0 H ALA A 104 -10.288 -17.017 -19.702 1.00 0.00 H new ATOM 0 HA ALA A 104 -8.527 -18.056 -17.464 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -10.636 -17.665 -16.171 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -10.150 -16.169 -17.003 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -11.464 -17.169 -17.666 1.00 0.00 H new ATOM 1185 N GLU A 105 -9.308 -20.380 -17.645 1.00 0.00 N ATOM 1186 CA GLU A 105 -9.728 -21.807 -17.825 1.00 0.00 C ATOM 1187 C GLU A 105 -10.977 -22.101 -16.991 1.00 0.00 C ATOM 1188 O GLU A 105 -11.860 -22.825 -17.420 1.00 0.00 O ATOM 1189 CB GLU A 105 -8.545 -22.647 -17.332 1.00 0.00 C ATOM 1190 CG GLU A 105 -7.347 -22.447 -18.267 1.00 0.00 C ATOM 1191 CD GLU A 105 -7.674 -23.000 -19.657 1.00 0.00 C ATOM 1192 OE1 GLU A 105 -8.414 -23.967 -19.732 1.00 0.00 O ATOM 1193 OE2 GLU A 105 -7.180 -22.444 -20.624 1.00 0.00 O ATOM 0 H GLU A 105 -8.478 -20.246 -17.067 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.976 -22.030 -18.863 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.278 -22.357 -16.316 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.822 -23.701 -17.300 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.101 -21.387 -18.336 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -6.470 -22.952 -17.862 1.00 0.00 H new ATOM 1200 N GLU A 106 -11.053 -21.544 -15.806 1.00 0.00 N ATOM 1201 CA GLU A 106 -12.239 -21.781 -14.925 1.00 0.00 C ATOM 1202 C GLU A 106 -12.877 -20.446 -14.524 1.00 0.00 C ATOM 1203 O GLU A 106 -12.189 -19.463 -14.312 1.00 0.00 O ATOM 1204 CB GLU A 106 -11.682 -22.498 -13.696 1.00 0.00 C ATOM 1205 CG GLU A 106 -12.833 -22.880 -12.763 1.00 0.00 C ATOM 1206 CD GLU A 106 -12.269 -23.493 -11.479 1.00 0.00 C ATOM 1207 OE1 GLU A 106 -11.213 -23.057 -11.050 1.00 0.00 O ATOM 1208 OE2 GLU A 106 -12.903 -24.389 -10.945 1.00 0.00 O ATOM 0 H GLU A 106 -10.340 -20.932 -15.410 1.00 0.00 H new ATOM 0 HA GLU A 106 -13.012 -22.366 -15.423 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -11.134 -23.390 -13.999 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -10.976 -21.852 -13.174 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -13.430 -22.000 -12.526 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -13.495 -23.591 -13.257 1.00 0.00 H new ATOM 1215 N GLU A 107 -14.184 -20.414 -14.421 1.00 0.00 N ATOM 1216 CA GLU A 107 -14.889 -19.152 -14.032 1.00 0.00 C ATOM 1217 C GLU A 107 -16.233 -19.467 -13.362 1.00 0.00 C ATOM 1218 O GLU A 107 -17.154 -18.670 -13.402 1.00 0.00 O ATOM 1219 CB GLU A 107 -15.099 -18.383 -15.347 1.00 0.00 C ATOM 1220 CG GLU A 107 -15.926 -19.225 -16.328 1.00 0.00 C ATOM 1221 CD GLU A 107 -16.034 -18.487 -17.664 1.00 0.00 C ATOM 1222 OE1 GLU A 107 -16.704 -17.470 -17.704 1.00 0.00 O ATOM 1223 OE2 GLU A 107 -15.447 -18.955 -18.625 1.00 0.00 O ATOM 0 H GLU A 107 -14.796 -21.212 -14.591 1.00 0.00 H new ATOM 0 HA GLU A 107 -14.314 -18.570 -13.312 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -15.608 -17.440 -15.148 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -14.134 -18.137 -15.791 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -15.457 -20.198 -16.474 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -16.920 -19.408 -15.919 1.00 0.00 H new ATOM 1230 N ASP A 108 -16.348 -20.625 -12.749 1.00 0.00 N ATOM 1231 CA ASP A 108 -17.623 -21.008 -12.070 1.00 0.00 C ATOM 1232 C ASP A 108 -17.511 -20.778 -10.561 1.00 0.00 C ATOM 1233 O ASP A 108 -16.703 -21.397 -9.892 1.00 0.00 O ATOM 1234 CB ASP A 108 -17.803 -22.496 -12.375 1.00 0.00 C ATOM 1235 CG ASP A 108 -19.147 -22.975 -11.820 1.00 0.00 C ATOM 1236 OD1 ASP A 108 -20.086 -22.196 -11.835 1.00 0.00 O ATOM 1237 OD2 ASP A 108 -19.215 -24.115 -11.390 1.00 0.00 O ATOM 0 H ASP A 108 -15.606 -21.323 -12.692 1.00 0.00 H new ATOM 0 HA ASP A 108 -18.469 -20.415 -12.418 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -17.762 -22.665 -13.451 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -16.989 -23.070 -11.931 1.00 0.00 H new ATOM 1242 N SER A 109 -18.318 -19.890 -10.027 1.00 0.00 N ATOM 1243 CA SER A 109 -18.274 -19.605 -8.560 1.00 0.00 C ATOM 1244 C SER A 109 -19.680 -19.703 -7.961 1.00 0.00 C ATOM 1245 O SER A 109 -20.667 -19.516 -8.647 1.00 0.00 O ATOM 1246 CB SER A 109 -17.741 -18.177 -8.449 1.00 0.00 C ATOM 1247 OG SER A 109 -18.693 -17.277 -9.005 1.00 0.00 O ATOM 0 H SER A 109 -19.008 -19.349 -10.549 1.00 0.00 H new ATOM 0 HA SER A 109 -17.648 -20.315 -8.019 1.00 0.00 H new ATOM 0 HB2 SER A 109 -17.553 -17.927 -7.405 1.00 0.00 H new ATOM 0 HB3 SER A 109 -16.790 -18.089 -8.974 1.00 0.00 H new ATOM 0 HG SER A 109 -18.356 -16.360 -8.934 1.00 0.00 H new ATOM 1253 N ASP A 110 -19.767 -19.994 -6.683 1.00 0.00 N ATOM 1254 CA ASP A 110 -21.104 -20.107 -6.019 1.00 0.00 C ATOM 1255 C ASP A 110 -21.242 -19.047 -4.921 1.00 0.00 C ATOM 1256 O ASP A 110 -21.984 -18.092 -5.065 1.00 0.00 O ATOM 1257 CB ASP A 110 -21.128 -21.514 -5.416 1.00 0.00 C ATOM 1258 CG ASP A 110 -21.149 -22.554 -6.539 1.00 0.00 C ATOM 1259 OD1 ASP A 110 -21.748 -22.279 -7.566 1.00 0.00 O ATOM 1260 OD2 ASP A 110 -20.563 -23.609 -6.352 1.00 0.00 O ATOM 0 H ASP A 110 -18.967 -20.158 -6.071 1.00 0.00 H new ATOM 0 HA ASP A 110 -21.927 -19.948 -6.716 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -20.253 -21.664 -4.784 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -22.005 -21.633 -4.780 1.00 0.00 H new ATOM 1265 N ASP A 111 -20.529 -19.212 -3.831 1.00 0.00 N ATOM 1266 CA ASP A 111 -20.606 -18.223 -2.712 1.00 0.00 C ATOM 1267 C ASP A 111 -19.203 -17.917 -2.182 1.00 0.00 C ATOM 1268 O ASP A 111 -18.583 -18.744 -1.538 1.00 0.00 O ATOM 1269 CB ASP A 111 -21.449 -18.907 -1.634 1.00 0.00 C ATOM 1270 CG ASP A 111 -22.860 -19.168 -2.171 1.00 0.00 C ATOM 1271 OD1 ASP A 111 -23.334 -18.362 -2.957 1.00 0.00 O ATOM 1272 OD2 ASP A 111 -23.441 -20.168 -1.784 1.00 0.00 O ATOM 0 H ASP A 111 -19.894 -19.994 -3.670 1.00 0.00 H new ATOM 0 HA ASP A 111 -21.041 -17.275 -3.028 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -20.983 -19.846 -1.336 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -21.498 -18.279 -0.744 1.00 0.00 H new ATOM 1277 N ASP A 112 -18.706 -16.730 -2.447 1.00 0.00 N ATOM 1278 CA ASP A 112 -17.343 -16.350 -1.963 1.00 0.00 C ATOM 1279 C ASP A 112 -17.412 -15.880 -0.508 1.00 0.00 C ATOM 1280 O ASP A 112 -18.097 -14.923 -0.191 1.00 0.00 O ATOM 1281 CB ASP A 112 -16.899 -15.206 -2.877 1.00 0.00 C ATOM 1282 CG ASP A 112 -16.825 -15.700 -4.324 1.00 0.00 C ATOM 1283 OD1 ASP A 112 -16.479 -16.855 -4.519 1.00 0.00 O ATOM 1284 OD2 ASP A 112 -17.112 -14.915 -5.212 1.00 0.00 O ATOM 0 H ASP A 112 -19.190 -16.007 -2.980 1.00 0.00 H new ATOM 0 HA ASP A 112 -16.646 -17.187 -1.994 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -17.600 -14.375 -2.802 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -15.926 -14.832 -2.560 1.00 0.00 H new ATOM 1289 N VAL A 113 -16.707 -16.550 0.373 1.00 0.00 N ATOM 1290 CA VAL A 113 -16.720 -16.153 1.819 1.00 0.00 C ATOM 1291 C VAL A 113 -15.959 -14.836 2.006 1.00 0.00 C ATOM 1292 O VAL A 113 -16.355 -13.987 2.785 1.00 0.00 O ATOM 1293 CB VAL A 113 -16.020 -17.300 2.568 1.00 0.00 C ATOM 1294 CG1 VAL A 113 -15.993 -17.003 4.070 1.00 0.00 C ATOM 1295 CG2 VAL A 113 -16.782 -18.608 2.332 1.00 0.00 C ATOM 0 H VAL A 113 -16.122 -17.356 0.153 1.00 0.00 H new ATOM 0 HA VAL A 113 -17.731 -15.994 2.193 1.00 0.00 H new ATOM 0 HB VAL A 113 -14.999 -17.394 2.197 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -15.496 -17.820 4.593 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -15.450 -16.074 4.248 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -17.014 -16.903 4.440 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -16.285 -19.420 2.863 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -17.803 -18.506 2.699 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -16.801 -18.831 1.265 1.00 0.00 H new ATOM 1305 N GLU A 114 -14.865 -14.670 1.301 1.00 0.00 N ATOM 1306 CA GLU A 114 -14.056 -13.428 1.424 1.00 0.00 C ATOM 1307 C GLU A 114 -14.245 -12.523 0.183 1.00 0.00 C ATOM 1308 O GLU A 114 -13.346 -12.406 -0.628 1.00 0.00 O ATOM 1309 CB GLU A 114 -12.608 -13.922 1.533 1.00 0.00 C ATOM 1310 CG GLU A 114 -12.207 -14.727 0.281 1.00 0.00 C ATOM 1311 CD GLU A 114 -10.857 -14.236 -0.258 1.00 0.00 C ATOM 1312 OE1 GLU A 114 -10.841 -13.205 -0.907 1.00 0.00 O ATOM 1313 OE2 GLU A 114 -9.866 -14.902 -0.009 1.00 0.00 O ATOM 0 H GLU A 114 -14.499 -15.354 0.639 1.00 0.00 H new ATOM 0 HA GLU A 114 -14.349 -12.824 2.283 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -11.937 -13.071 1.654 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -12.497 -14.544 2.421 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -12.144 -15.787 0.527 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -12.973 -14.623 -0.488 1.00 0.00 H new ATOM 1320 N PRO A 115 -15.407 -11.891 0.067 1.00 0.00 N ATOM 1321 CA PRO A 115 -15.654 -10.998 -1.098 1.00 0.00 C ATOM 1322 C PRO A 115 -14.797 -9.734 -0.988 1.00 0.00 C ATOM 1323 O PRO A 115 -14.381 -9.168 -1.984 1.00 0.00 O ATOM 1324 CB PRO A 115 -17.140 -10.661 -0.993 1.00 0.00 C ATOM 1325 CG PRO A 115 -17.471 -10.840 0.453 1.00 0.00 C ATOM 1326 CD PRO A 115 -16.576 -11.933 0.970 1.00 0.00 C ATOM 0 HA PRO A 115 -15.398 -11.459 -2.052 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -17.338 -9.641 -1.321 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -17.740 -11.320 -1.621 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -17.309 -9.914 1.005 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -18.520 -11.107 0.580 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -16.287 -11.756 2.006 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -17.071 -12.904 0.938 1.00 0.00 H new ATOM 1334 N ILE A 116 -14.532 -9.292 0.219 1.00 0.00 N ATOM 1335 CA ILE A 116 -13.700 -8.065 0.420 1.00 0.00 C ATOM 1336 C ILE A 116 -12.439 -8.425 1.217 1.00 0.00 C ATOM 1337 O ILE A 116 -12.452 -9.336 2.027 1.00 0.00 O ATOM 1338 CB ILE A 116 -14.589 -7.097 1.214 1.00 0.00 C ATOM 1339 CG1 ILE A 116 -15.861 -6.790 0.416 1.00 0.00 C ATOM 1340 CG2 ILE A 116 -13.832 -5.788 1.469 1.00 0.00 C ATOM 1341 CD1 ILE A 116 -16.825 -5.976 1.281 1.00 0.00 C ATOM 0 H ILE A 116 -14.859 -9.733 1.079 1.00 0.00 H new ATOM 0 HA ILE A 116 -13.373 -7.622 -0.521 1.00 0.00 H new ATOM 0 HB ILE A 116 -14.854 -7.559 2.165 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -15.610 -6.235 -0.488 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -16.336 -7.718 0.099 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -14.467 -5.104 2.033 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -12.927 -5.996 2.039 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -13.563 -5.332 0.516 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -17.729 -5.758 0.712 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -17.086 -6.547 2.172 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -16.348 -5.041 1.576 1.00 0.00 H new ATOM 1353 N ALA A 117 -11.358 -7.717 0.988 1.00 0.00 N ATOM 1354 CA ALA A 117 -10.090 -8.004 1.720 1.00 0.00 C ATOM 1355 C ALA A 117 -9.820 -6.893 2.729 1.00 0.00 C ATOM 1356 O ALA A 117 -9.943 -5.722 2.392 1.00 0.00 O ATOM 1357 CB ALA A 117 -9.017 -8.003 0.635 1.00 0.00 C ATOM 0 H ALA A 117 -11.303 -6.948 0.320 1.00 0.00 H new ATOM 0 HA ALA A 117 -10.121 -8.944 2.271 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -8.045 -8.207 1.084 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -9.245 -8.773 -0.102 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -8.994 -7.029 0.147 1.00 0.00 H new ATOM 1363 N GLU A 118 -9.441 -7.232 3.952 1.00 0.00 N ATOM 1364 CA GLU A 118 -9.158 -6.143 4.948 1.00 0.00 C ATOM 1365 C GLU A 118 -7.656 -5.985 5.108 1.00 0.00 C ATOM 1366 O GLU A 118 -6.982 -6.863 5.606 1.00 0.00 O ATOM 1367 CB GLU A 118 -9.805 -6.550 6.273 1.00 0.00 C ATOM 1368 CG GLU A 118 -11.301 -6.812 6.070 1.00 0.00 C ATOM 1369 CD GLU A 118 -11.524 -8.253 5.599 1.00 0.00 C ATOM 1370 OE1 GLU A 118 -10.741 -9.110 5.978 1.00 0.00 O ATOM 1371 OE2 GLU A 118 -12.474 -8.475 4.866 1.00 0.00 O ATOM 0 H GLU A 118 -9.320 -8.186 4.291 1.00 0.00 H new ATOM 0 HA GLU A 118 -9.565 -5.188 4.615 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -9.321 -7.445 6.663 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -9.663 -5.762 7.013 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -11.838 -6.639 7.002 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -11.704 -6.115 5.336 1.00 0.00 H new ATOM 1378 N PHE A 119 -7.131 -4.865 4.689 1.00 0.00 N ATOM 1379 CA PHE A 119 -5.672 -4.629 4.808 1.00 0.00 C ATOM 1380 C PHE A 119 -5.424 -3.838 6.088 1.00 0.00 C ATOM 1381 O PHE A 119 -5.993 -2.786 6.300 1.00 0.00 O ATOM 1382 CB PHE A 119 -5.349 -3.871 3.495 1.00 0.00 C ATOM 1383 CG PHE A 119 -3.969 -3.237 3.469 1.00 0.00 C ATOM 1384 CD1 PHE A 119 -3.648 -2.198 4.342 1.00 0.00 C ATOM 1385 CD2 PHE A 119 -3.031 -3.655 2.515 1.00 0.00 C ATOM 1386 CE1 PHE A 119 -2.410 -1.578 4.275 1.00 0.00 C ATOM 1387 CE2 PHE A 119 -1.777 -3.033 2.454 1.00 0.00 C ATOM 1388 CZ PHE A 119 -1.474 -1.990 3.336 1.00 0.00 C ATOM 0 H PHE A 119 -7.658 -4.101 4.267 1.00 0.00 H new ATOM 0 HA PHE A 119 -5.036 -5.509 4.899 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -5.435 -4.564 2.658 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -6.097 -3.093 3.343 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -4.370 -1.874 5.077 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -3.274 -4.453 1.830 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -2.173 -0.773 4.955 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -1.046 -3.358 1.728 1.00 0.00 H new ATOM 0 HZ PHE A 119 -0.510 -1.505 3.286 1.00 0.00 H new ATOM 1398 N ARG A 120 -4.572 -4.333 6.936 1.00 0.00 N ATOM 1399 CA ARG A 120 -4.260 -3.610 8.197 1.00 0.00 C ATOM 1400 C ARG A 120 -2.765 -3.390 8.275 1.00 0.00 C ATOM 1401 O ARG A 120 -1.994 -4.330 8.270 1.00 0.00 O ATOM 1402 CB ARG A 120 -4.770 -4.514 9.334 1.00 0.00 C ATOM 1403 CG ARG A 120 -4.393 -3.920 10.705 1.00 0.00 C ATOM 1404 CD ARG A 120 -4.858 -4.859 11.822 1.00 0.00 C ATOM 1405 NE ARG A 120 -4.744 -4.055 13.072 1.00 0.00 N ATOM 1406 CZ ARG A 120 -4.620 -4.656 14.224 1.00 0.00 C ATOM 1407 NH1 ARG A 120 -3.434 -4.954 14.679 1.00 0.00 N ATOM 1408 NH2 ARG A 120 -5.683 -4.958 14.920 1.00 0.00 N ATOM 0 H ARG A 120 -4.074 -5.214 6.809 1.00 0.00 H new ATOM 0 HA ARG A 120 -4.732 -2.629 8.258 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -5.852 -4.622 9.263 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -4.343 -5.512 9.233 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -3.314 -3.775 10.765 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -4.854 -2.940 10.826 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -5.883 -5.191 11.658 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -4.237 -5.754 11.870 1.00 0.00 H new ATOM 0 HE ARG A 120 -4.763 -3.036 13.027 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -2.605 -4.717 14.135 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -3.336 -5.424 15.579 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -6.610 -4.724 14.563 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -5.587 -5.428 15.820 1.00 0.00 H new ATOM 1422 N PHE A 121 -2.341 -2.151 8.352 1.00 0.00 N ATOM 1423 CA PHE A 121 -0.888 -1.867 8.455 1.00 0.00 C ATOM 1424 C PHE A 121 -0.641 -1.250 9.816 1.00 0.00 C ATOM 1425 O PHE A 121 -1.184 -0.223 10.177 1.00 0.00 O ATOM 1426 CB PHE A 121 -0.507 -1.000 7.236 1.00 0.00 C ATOM 1427 CG PHE A 121 0.138 -1.900 6.159 1.00 0.00 C ATOM 1428 CD1 PHE A 121 -0.420 -3.161 5.843 1.00 0.00 C ATOM 1429 CD2 PHE A 121 1.308 -1.498 5.510 1.00 0.00 C ATOM 1430 CE1 PHE A 121 0.174 -3.990 4.902 1.00 0.00 C ATOM 1431 CE2 PHE A 121 1.899 -2.337 4.549 1.00 0.00 C ATOM 1432 CZ PHE A 121 1.326 -3.588 4.251 1.00 0.00 C ATOM 0 H PHE A 121 -2.944 -1.329 8.347 1.00 0.00 H new ATOM 0 HA PHE A 121 -0.245 -2.746 8.410 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -1.392 -0.507 6.834 1.00 0.00 H new ATOM 0 HB3 PHE A 121 0.187 -0.215 7.535 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -1.322 -3.483 6.342 1.00 0.00 H new ATOM 0 HD2 PHE A 121 1.758 -0.545 5.746 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -0.264 -4.951 4.678 1.00 0.00 H new ATOM 0 HE2 PHE A 121 2.796 -2.021 4.037 1.00 0.00 H new ATOM 0 HZ PHE A 121 1.785 -4.232 3.516 1.00 0.00 H new ATOM 1442 N VAL A 122 0.092 -1.968 10.613 1.00 0.00 N ATOM 1443 CA VAL A 122 0.320 -1.561 12.024 1.00 0.00 C ATOM 1444 C VAL A 122 1.814 -1.751 12.390 1.00 0.00 C ATOM 1445 O VAL A 122 2.344 -2.841 12.273 1.00 0.00 O ATOM 1446 CB VAL A 122 -0.614 -2.516 12.842 1.00 0.00 C ATOM 1447 CG1 VAL A 122 -2.085 -2.182 12.563 1.00 0.00 C ATOM 1448 CG2 VAL A 122 -0.448 -3.987 12.433 1.00 0.00 C ATOM 0 H VAL A 122 0.552 -2.837 10.341 1.00 0.00 H new ATOM 0 HA VAL A 122 0.097 -0.513 12.223 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.340 -2.376 13.888 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -2.725 -2.852 13.137 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.285 -1.151 12.854 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -2.291 -2.306 11.500 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -1.117 -4.608 13.029 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -0.692 -4.101 11.377 1.00 0.00 H new ATOM 0 HG23 VAL A 122 0.583 -4.298 12.603 1.00 0.00 H new ATOM 1458 N PRO A 123 2.467 -0.678 12.825 1.00 0.00 N ATOM 1459 CA PRO A 123 3.889 -0.768 13.198 1.00 0.00 C ATOM 1460 C PRO A 123 4.036 -1.055 14.695 1.00 0.00 C ATOM 1461 O PRO A 123 3.209 -0.648 15.493 1.00 0.00 O ATOM 1462 CB PRO A 123 4.423 0.622 12.878 1.00 0.00 C ATOM 1463 CG PRO A 123 3.238 1.543 12.957 1.00 0.00 C ATOM 1464 CD PRO A 123 1.983 0.699 13.002 1.00 0.00 C ATOM 0 HA PRO A 123 4.416 -1.567 12.676 1.00 0.00 H new ATOM 0 HB2 PRO A 123 5.196 0.917 13.588 1.00 0.00 H new ATOM 0 HB3 PRO A 123 4.874 0.649 11.886 1.00 0.00 H new ATOM 0 HG2 PRO A 123 3.305 2.172 13.845 1.00 0.00 H new ATOM 0 HG3 PRO A 123 3.217 2.209 12.095 1.00 0.00 H new ATOM 0 HD2 PRO A 123 1.457 0.818 13.949 1.00 0.00 H new ATOM 0 HD3 PRO A 123 1.285 0.980 12.213 1.00 0.00 H new ATOM 1472 N SER A 124 5.094 -1.731 15.076 1.00 0.00 N ATOM 1473 CA SER A 124 5.323 -2.029 16.525 1.00 0.00 C ATOM 1474 C SER A 124 5.860 -0.781 17.235 1.00 0.00 C ATOM 1475 O SER A 124 5.630 -0.578 18.412 1.00 0.00 O ATOM 1476 CB SER A 124 6.363 -3.151 16.547 1.00 0.00 C ATOM 1477 OG SER A 124 6.509 -3.632 17.876 1.00 0.00 O ATOM 0 H SER A 124 5.810 -2.090 14.444 1.00 0.00 H new ATOM 0 HA SER A 124 4.407 -2.321 17.037 1.00 0.00 H new ATOM 0 HB2 SER A 124 6.054 -3.961 15.887 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.319 -2.783 16.174 1.00 0.00 H new ATOM 0 HG SER A 124 7.174 -4.352 17.892 1.00 0.00 H new ATOM 1483 N ASP A 125 6.577 0.052 16.515 1.00 0.00 N ATOM 1484 CA ASP A 125 7.144 1.297 17.118 1.00 0.00 C ATOM 1485 C ASP A 125 6.148 2.449 17.030 1.00 0.00 C ATOM 1486 O ASP A 125 5.689 2.801 15.957 1.00 0.00 O ATOM 1487 CB ASP A 125 8.395 1.598 16.294 1.00 0.00 C ATOM 1488 CG ASP A 125 9.200 2.716 16.960 1.00 0.00 C ATOM 1489 OD1 ASP A 125 8.589 3.589 17.556 1.00 0.00 O ATOM 1490 OD2 ASP A 125 10.415 2.685 16.860 1.00 0.00 O ATOM 0 H ASP A 125 6.794 -0.081 15.527 1.00 0.00 H new ATOM 0 HA ASP A 125 7.370 1.171 18.177 1.00 0.00 H new ATOM 0 HB2 ASP A 125 9.007 0.701 16.205 1.00 0.00 H new ATOM 0 HB3 ASP A 125 8.113 1.893 15.283 1.00 0.00 H new ATOM 1495 N LYS A 126 5.829 3.057 18.152 1.00 0.00 N ATOM 1496 CA LYS A 126 4.876 4.219 18.148 1.00 0.00 C ATOM 1497 C LYS A 126 5.474 5.340 17.299 1.00 0.00 C ATOM 1498 O LYS A 126 4.774 6.045 16.591 1.00 0.00 O ATOM 1499 CB LYS A 126 4.751 4.662 19.610 1.00 0.00 C ATOM 1500 CG LYS A 126 3.442 4.136 20.193 1.00 0.00 C ATOM 1501 CD LYS A 126 3.437 4.334 21.712 1.00 0.00 C ATOM 1502 CE LYS A 126 4.499 3.434 22.347 1.00 0.00 C ATOM 1503 NZ LYS A 126 3.882 2.945 23.612 1.00 0.00 N ATOM 0 H LYS A 126 6.188 2.799 19.071 1.00 0.00 H new ATOM 0 HA LYS A 126 3.901 3.961 17.734 1.00 0.00 H new ATOM 0 HB2 LYS A 126 5.595 4.286 20.188 1.00 0.00 H new ATOM 0 HB3 LYS A 126 4.779 5.750 19.675 1.00 0.00 H new ATOM 0 HG2 LYS A 126 2.597 4.659 19.746 1.00 0.00 H new ATOM 0 HG3 LYS A 126 3.325 3.079 19.954 1.00 0.00 H new ATOM 0 HD2 LYS A 126 3.637 5.378 21.954 1.00 0.00 H new ATOM 0 HD3 LYS A 126 2.454 4.096 22.117 1.00 0.00 H new ATOM 0 HE2 LYS A 126 4.759 2.605 21.689 1.00 0.00 H new ATOM 0 HE3 LYS A 126 5.418 3.986 22.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 4.551 2.320 24.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 3.651 3.755 24.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 3.013 2.418 23.393 1.00 0.00 H new ATOM 1517 N SER A 127 6.779 5.472 17.350 1.00 0.00 N ATOM 1518 CA SER A 127 7.464 6.508 16.530 1.00 0.00 C ATOM 1519 C SER A 127 7.282 6.165 15.052 1.00 0.00 C ATOM 1520 O SER A 127 7.228 7.046 14.208 1.00 0.00 O ATOM 1521 CB SER A 127 8.944 6.447 16.921 1.00 0.00 C ATOM 1522 OG SER A 127 9.641 7.513 16.290 1.00 0.00 O ATOM 0 H SER A 127 7.396 4.902 17.928 1.00 0.00 H new ATOM 0 HA SER A 127 7.062 7.507 16.697 1.00 0.00 H new ATOM 0 HB2 SER A 127 9.049 6.519 18.004 1.00 0.00 H new ATOM 0 HB3 SER A 127 9.372 5.490 16.622 1.00 0.00 H new ATOM 0 HG SER A 127 10.588 7.478 16.539 1.00 0.00 H new ATOM 1528 N ALA A 128 7.176 4.885 14.731 1.00 0.00 N ATOM 1529 CA ALA A 128 6.981 4.491 13.300 1.00 0.00 C ATOM 1530 C ALA A 128 5.555 4.832 12.865 1.00 0.00 C ATOM 1531 O ALA A 128 5.316 5.187 11.722 1.00 0.00 O ATOM 1532 CB ALA A 128 7.220 2.983 13.237 1.00 0.00 C ATOM 0 H ALA A 128 7.216 4.111 15.395 1.00 0.00 H new ATOM 0 HA ALA A 128 7.663 5.020 12.634 1.00 0.00 H new ATOM 0 HB1 ALA A 128 7.091 2.637 12.212 1.00 0.00 H new ATOM 0 HB2 ALA A 128 8.234 2.761 13.570 1.00 0.00 H new ATOM 0 HB3 ALA A 128 6.506 2.474 13.884 1.00 0.00 H new ATOM 1538 N LEU A 129 4.606 4.733 13.773 1.00 0.00 N ATOM 1539 CA LEU A 129 3.186 5.057 13.421 1.00 0.00 C ATOM 1540 C LEU A 129 3.035 6.557 13.169 1.00 0.00 C ATOM 1541 O LEU A 129 2.441 6.967 12.186 1.00 0.00 O ATOM 1542 CB LEU A 129 2.350 4.637 14.633 1.00 0.00 C ATOM 1543 CG LEU A 129 0.869 4.616 14.244 1.00 0.00 C ATOM 1544 CD1 LEU A 129 0.569 3.374 13.401 1.00 0.00 C ATOM 1545 CD2 LEU A 129 0.015 4.583 15.511 1.00 0.00 C ATOM 0 H LEU A 129 4.756 4.442 14.739 1.00 0.00 H new ATOM 0 HA LEU A 129 2.868 4.541 12.515 1.00 0.00 H new ATOM 0 HB2 LEU A 129 2.661 3.651 14.980 1.00 0.00 H new ATOM 0 HB3 LEU A 129 2.511 5.331 15.458 1.00 0.00 H new ATOM 0 HG LEU A 129 0.638 5.509 13.664 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.486 3.366 13.128 1.00 0.00 H new ATOM 0 HD12 LEU A 129 1.178 3.392 12.497 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.802 2.478 13.977 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.040 4.568 15.238 1.00 0.00 H new ATOM 0 HD22 LEU A 129 0.254 3.689 16.087 1.00 0.00 H new ATOM 0 HD23 LEU A 129 0.222 5.468 16.112 1.00 0.00 H new ATOM 1557 N GLU A 130 3.583 7.379 14.042 1.00 0.00 N ATOM 1558 CA GLU A 130 3.483 8.858 13.846 1.00 0.00 C ATOM 1559 C GLU A 130 4.226 9.244 12.565 1.00 0.00 C ATOM 1560 O GLU A 130 3.816 10.141 11.845 1.00 0.00 O ATOM 1561 CB GLU A 130 4.112 9.498 15.092 1.00 0.00 C ATOM 1562 CG GLU A 130 5.583 9.096 15.232 1.00 0.00 C ATOM 1563 CD GLU A 130 6.215 9.881 16.384 1.00 0.00 C ATOM 1564 OE1 GLU A 130 6.162 9.398 17.504 1.00 0.00 O ATOM 1565 OE2 GLU A 130 6.741 10.951 16.125 1.00 0.00 O ATOM 0 H GLU A 130 4.092 7.086 14.876 1.00 0.00 H new ATOM 0 HA GLU A 130 2.454 9.200 13.733 1.00 0.00 H new ATOM 0 HB2 GLU A 130 4.032 10.583 15.027 1.00 0.00 H new ATOM 0 HB3 GLU A 130 3.561 9.190 15.981 1.00 0.00 H new ATOM 0 HG2 GLU A 130 5.663 8.025 15.420 1.00 0.00 H new ATOM 0 HG3 GLU A 130 6.117 9.298 14.303 1.00 0.00 H new ATOM 1572 N ALA A 131 5.300 8.549 12.266 1.00 0.00 N ATOM 1573 CA ALA A 131 6.066 8.842 11.014 1.00 0.00 C ATOM 1574 C ALA A 131 5.208 8.448 9.812 1.00 0.00 C ATOM 1575 O ALA A 131 5.229 9.095 8.781 1.00 0.00 O ATOM 1576 CB ALA A 131 7.327 7.975 11.086 1.00 0.00 C ATOM 0 H ALA A 131 5.678 7.792 12.836 1.00 0.00 H new ATOM 0 HA ALA A 131 6.325 9.896 10.914 1.00 0.00 H new ATOM 0 HB1 ALA A 131 7.935 8.142 10.197 1.00 0.00 H new ATOM 0 HB2 ALA A 131 7.902 8.241 11.973 1.00 0.00 H new ATOM 0 HB3 ALA A 131 7.043 6.924 11.140 1.00 0.00 H new ATOM 1582 N MET A 132 4.442 7.392 9.956 1.00 0.00 N ATOM 1583 CA MET A 132 3.552 6.939 8.840 1.00 0.00 C ATOM 1584 C MET A 132 2.437 7.960 8.620 1.00 0.00 C ATOM 1585 O MET A 132 2.026 8.209 7.501 1.00 0.00 O ATOM 1586 CB MET A 132 2.965 5.598 9.298 1.00 0.00 C ATOM 1587 CG MET A 132 4.004 4.492 9.113 1.00 0.00 C ATOM 1588 SD MET A 132 4.087 4.030 7.364 1.00 0.00 S ATOM 1589 CE MET A 132 2.461 3.242 7.262 1.00 0.00 C ATOM 0 H MET A 132 4.395 6.823 10.801 1.00 0.00 H new ATOM 0 HA MET A 132 4.094 6.838 7.900 1.00 0.00 H new ATOM 0 HB2 MET A 132 2.667 5.659 10.345 1.00 0.00 H new ATOM 0 HB3 MET A 132 2.068 5.367 8.724 1.00 0.00 H new ATOM 0 HG2 MET A 132 4.980 4.834 9.457 1.00 0.00 H new ATOM 0 HG3 MET A 132 3.739 3.624 9.717 1.00 0.00 H new ATOM 0 HE1 MET A 132 2.361 2.737 6.301 1.00 0.00 H new ATOM 0 HE2 MET A 132 2.358 2.514 8.067 1.00 0.00 H new ATOM 0 HE3 MET A 132 1.683 4.000 7.356 1.00 0.00 H new ATOM 1599 N PHE A 133 1.947 8.555 9.685 1.00 0.00 N ATOM 1600 CA PHE A 133 0.854 9.570 9.555 1.00 0.00 C ATOM 1601 C PHE A 133 1.393 10.822 8.915 1.00 0.00 C ATOM 1602 O PHE A 133 0.735 11.420 8.089 1.00 0.00 O ATOM 1603 CB PHE A 133 0.343 9.818 10.989 1.00 0.00 C ATOM 1604 CG PHE A 133 -0.705 8.768 11.393 1.00 0.00 C ATOM 1605 CD1 PHE A 133 -0.696 7.469 10.836 1.00 0.00 C ATOM 1606 CD2 PHE A 133 -1.676 9.097 12.347 1.00 0.00 C ATOM 1607 CE1 PHE A 133 -1.646 6.523 11.229 1.00 0.00 C ATOM 1608 CE2 PHE A 133 -2.630 8.147 12.737 1.00 0.00 C ATOM 1609 CZ PHE A 133 -2.616 6.863 12.178 1.00 0.00 C ATOM 0 H PHE A 133 2.259 8.379 10.640 1.00 0.00 H new ATOM 0 HA PHE A 133 0.038 9.231 8.917 1.00 0.00 H new ATOM 0 HB2 PHE A 133 1.180 9.788 11.687 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -0.092 10.815 11.056 1.00 0.00 H new ATOM 0 HD1 PHE A 133 0.051 7.206 10.101 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -1.690 10.085 12.783 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -1.632 5.531 10.801 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -3.378 8.406 13.471 1.00 0.00 H new ATOM 0 HZ PHE A 133 -3.354 6.135 12.480 1.00 0.00 H new ATOM 1619 N THR A 134 2.603 11.196 9.251 1.00 0.00 N ATOM 1620 CA THR A 134 3.212 12.392 8.604 1.00 0.00 C ATOM 1621 C THR A 134 3.456 12.050 7.133 1.00 0.00 C ATOM 1622 O THR A 134 3.311 12.884 6.257 1.00 0.00 O ATOM 1623 CB THR A 134 4.529 12.646 9.342 1.00 0.00 C ATOM 1624 OG1 THR A 134 4.276 12.748 10.737 1.00 0.00 O ATOM 1625 CG2 THR A 134 5.157 13.946 8.839 1.00 0.00 C ATOM 0 H THR A 134 3.190 10.727 9.941 1.00 0.00 H new ATOM 0 HA THR A 134 2.581 13.280 8.651 1.00 0.00 H new ATOM 0 HB THR A 134 5.215 11.820 9.156 1.00 0.00 H new ATOM 0 HG1 THR A 134 4.261 11.852 11.133 1.00 0.00 H new ATOM 0 HG21 THR A 134 6.094 14.125 9.366 1.00 0.00 H new ATOM 0 HG22 THR A 134 5.351 13.866 7.769 1.00 0.00 H new ATOM 0 HG23 THR A 134 4.474 14.775 9.023 1.00 0.00 H new ATOM 1633 N ALA A 135 3.802 10.805 6.864 1.00 0.00 N ATOM 1634 CA ALA A 135 4.027 10.376 5.446 1.00 0.00 C ATOM 1635 C ALA A 135 2.692 10.337 4.695 1.00 0.00 C ATOM 1636 O ALA A 135 2.573 10.844 3.593 1.00 0.00 O ATOM 1637 CB ALA A 135 4.631 8.972 5.533 1.00 0.00 C ATOM 0 H ALA A 135 3.936 10.075 7.564 1.00 0.00 H new ATOM 0 HA ALA A 135 4.682 11.062 4.910 1.00 0.00 H new ATOM 0 HB1 ALA A 135 4.822 8.595 4.528 1.00 0.00 H new ATOM 0 HB2 ALA A 135 5.567 9.013 6.089 1.00 0.00 H new ATOM 0 HB3 ALA A 135 3.934 8.307 6.044 1.00 0.00 H new ATOM 1643 N MET A 136 1.691 9.736 5.295 1.00 0.00 N ATOM 1644 CA MET A 136 0.346 9.646 4.640 1.00 0.00 C ATOM 1645 C MET A 136 -0.333 11.014 4.626 1.00 0.00 C ATOM 1646 O MET A 136 -0.841 11.449 3.610 1.00 0.00 O ATOM 1647 CB MET A 136 -0.463 8.660 5.487 1.00 0.00 C ATOM 1648 CG MET A 136 0.015 7.233 5.210 1.00 0.00 C ATOM 1649 SD MET A 136 -1.092 6.057 6.027 1.00 0.00 S ATOM 1650 CE MET A 136 -0.266 4.545 5.475 1.00 0.00 C ATOM 0 H MET A 136 1.749 9.301 6.216 1.00 0.00 H new ATOM 0 HA MET A 136 0.426 9.317 3.604 1.00 0.00 H new ATOM 0 HB2 MET A 136 -0.347 8.894 6.545 1.00 0.00 H new ATOM 0 HB3 MET A 136 -1.524 8.750 5.254 1.00 0.00 H new ATOM 0 HG2 MET A 136 0.033 7.046 4.136 1.00 0.00 H new ATOM 0 HG3 MET A 136 1.034 7.102 5.574 1.00 0.00 H new ATOM 0 HE1 MET A 136 -0.387 3.768 6.230 1.00 0.00 H new ATOM 0 HE2 MET A 136 -0.708 4.211 4.536 1.00 0.00 H new ATOM 0 HE3 MET A 136 0.795 4.744 5.326 1.00 0.00 H new ATOM 1660 N CYS A 137 -0.343 11.691 5.753 1.00 0.00 N ATOM 1661 CA CYS A 137 -0.995 13.042 5.819 1.00 0.00 C ATOM 1662 C CYS A 137 -0.319 14.004 4.838 1.00 0.00 C ATOM 1663 O CYS A 137 -0.981 14.738 4.123 1.00 0.00 O ATOM 1664 CB CYS A 137 -0.806 13.527 7.257 1.00 0.00 C ATOM 1665 SG CYS A 137 -1.861 14.970 7.551 1.00 0.00 S ATOM 0 H CYS A 137 0.071 11.368 6.627 1.00 0.00 H new ATOM 0 HA CYS A 137 -2.050 12.994 5.549 1.00 0.00 H new ATOM 0 HB2 CYS A 137 -1.058 12.730 7.957 1.00 0.00 H new ATOM 0 HB3 CYS A 137 0.239 13.785 7.431 1.00 0.00 H new ATOM 0 HG CYS A 137 -1.702 15.382 8.774 1.00 0.00 H new ATOM 1671 N GLU A 138 0.994 14.000 4.801 1.00 0.00 N ATOM 1672 CA GLU A 138 1.732 14.912 3.866 1.00 0.00 C ATOM 1673 C GLU A 138 1.502 14.474 2.425 1.00 0.00 C ATOM 1674 O GLU A 138 1.392 15.288 1.524 1.00 0.00 O ATOM 1675 CB GLU A 138 3.211 14.783 4.241 1.00 0.00 C ATOM 1676 CG GLU A 138 4.034 15.779 3.421 1.00 0.00 C ATOM 1677 CD GLU A 138 5.523 15.558 3.693 1.00 0.00 C ATOM 1678 OE1 GLU A 138 5.908 14.417 3.890 1.00 0.00 O ATOM 1679 OE2 GLU A 138 6.255 16.536 3.699 1.00 0.00 O ATOM 0 H GLU A 138 1.587 13.404 5.378 1.00 0.00 H new ATOM 0 HA GLU A 138 1.392 15.944 3.948 1.00 0.00 H new ATOM 0 HB2 GLU A 138 3.345 14.974 5.306 1.00 0.00 H new ATOM 0 HB3 GLU A 138 3.558 13.767 4.053 1.00 0.00 H new ATOM 0 HG2 GLU A 138 3.825 15.652 2.359 1.00 0.00 H new ATOM 0 HG3 GLU A 138 3.754 16.800 3.681 1.00 0.00 H new ATOM 1686 N CYS A 139 1.423 13.193 2.216 1.00 0.00 N ATOM 1687 CA CYS A 139 1.191 12.652 0.839 1.00 0.00 C ATOM 1688 C CYS A 139 -0.245 12.951 0.401 1.00 0.00 C ATOM 1689 O CYS A 139 -0.495 13.287 -0.743 1.00 0.00 O ATOM 1690 CB CYS A 139 1.416 11.143 0.947 1.00 0.00 C ATOM 1691 SG CYS A 139 1.296 10.393 -0.695 1.00 0.00 S ATOM 0 H CYS A 139 1.509 12.485 2.945 1.00 0.00 H new ATOM 0 HA CYS A 139 1.857 13.102 0.102 1.00 0.00 H new ATOM 0 HB2 CYS A 139 2.396 10.941 1.379 1.00 0.00 H new ATOM 0 HB3 CYS A 139 0.676 10.702 1.615 1.00 0.00 H new ATOM 0 HG CYS A 139 1.489 9.111 -0.602 1.00 0.00 H new ATOM 1697 N GLN A 140 -1.183 12.833 1.310 1.00 0.00 N ATOM 1698 CA GLN A 140 -2.616 13.110 0.968 1.00 0.00 C ATOM 1699 C GLN A 140 -2.808 14.597 0.670 1.00 0.00 C ATOM 1700 O GLN A 140 -3.510 14.965 -0.256 1.00 0.00 O ATOM 1701 CB GLN A 140 -3.422 12.708 2.208 1.00 0.00 C ATOM 1702 CG GLN A 140 -3.982 11.298 2.023 1.00 0.00 C ATOM 1703 CD GLN A 140 -4.824 10.919 3.228 1.00 0.00 C ATOM 1704 OE1 GLN A 140 -5.830 11.539 3.510 1.00 0.00 O ATOM 1705 NE2 GLN A 140 -4.442 9.914 3.959 1.00 0.00 N ATOM 0 H GLN A 140 -1.018 12.556 2.278 1.00 0.00 H new ATOM 0 HA GLN A 140 -2.936 12.558 0.084 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -2.788 12.745 3.094 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -4.236 13.415 2.370 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -4.586 11.252 1.117 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -3.166 10.586 1.899 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -3.596 9.399 3.715 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -4.988 9.641 4.776 1.00 0.00 H new ATOM 1714 N ALA A 141 -2.188 15.449 1.453 1.00 0.00 N ATOM 1715 CA ALA A 141 -2.327 16.925 1.228 1.00 0.00 C ATOM 1716 C ALA A 141 -1.617 17.326 -0.069 1.00 0.00 C ATOM 1717 O ALA A 141 -2.102 18.155 -0.818 1.00 0.00 O ATOM 1718 CB ALA A 141 -1.661 17.592 2.434 1.00 0.00 C ATOM 0 H ALA A 141 -1.592 15.187 2.238 1.00 0.00 H new ATOM 0 HA ALA A 141 -3.370 17.227 1.132 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -1.727 18.675 2.333 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -2.168 17.281 3.348 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.613 17.295 2.481 1.00 0.00 H new ATOM 1724 N LEU A 142 -0.474 16.739 -0.331 1.00 0.00 N ATOM 1725 CA LEU A 142 0.286 17.073 -1.581 1.00 0.00 C ATOM 1726 C LEU A 142 -0.440 16.503 -2.802 1.00 0.00 C ATOM 1727 O LEU A 142 -0.417 17.084 -3.872 1.00 0.00 O ATOM 1728 CB LEU A 142 1.663 16.408 -1.414 1.00 0.00 C ATOM 1729 CG LEU A 142 2.745 17.183 -2.188 1.00 0.00 C ATOM 1730 CD1 LEU A 142 2.405 17.222 -3.683 1.00 0.00 C ATOM 1731 CD2 LEU A 142 2.850 18.614 -1.649 1.00 0.00 C ATOM 0 H LEU A 142 -0.032 16.041 0.267 1.00 0.00 H new ATOM 0 HA LEU A 142 0.376 18.149 -1.732 1.00 0.00 H new ATOM 0 HB2 LEU A 142 1.926 16.367 -0.357 1.00 0.00 H new ATOM 0 HB3 LEU A 142 1.620 15.379 -1.772 1.00 0.00 H new ATOM 0 HG LEU A 142 3.700 16.675 -2.054 1.00 0.00 H new ATOM 0 HD11 LEU A 142 3.179 17.773 -4.218 1.00 0.00 H new ATOM 0 HD12 LEU A 142 2.351 16.205 -4.070 1.00 0.00 H new ATOM 0 HD13 LEU A 142 1.444 17.716 -3.825 1.00 0.00 H new ATOM 0 HD21 LEU A 142 3.618 19.156 -2.202 1.00 0.00 H new ATOM 0 HD22 LEU A 142 1.892 19.119 -1.769 1.00 0.00 H new ATOM 0 HD23 LEU A 142 3.116 18.586 -0.592 1.00 0.00 H new TER 1743 LEU A 142