USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 752 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 13 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 17 ASN : amide:sc= -1.62! X(o=-1.6!,f=-1.4) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 ASN : amide:sc= -0.17 K(o=-0.17,f=-1.3!) USER MOD Single : A 9 ASN : amide:sc= -0.0148 X(o=-0.015,f=0) USER MOD Single : A 12 GLN : amide:sc= -1.43! C(o=-1.4!,f=-1.4!) USER MOD Single : A 16 MET CE :methyl -119:sc= -0.014 (180deg=-1.55!) USER MOD Single : A 20 SER OG : rot 180:sc= 0.0172 USER MOD Single : A 22 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 25 HIS : no HD1:sc= -3.29! C(o=-3.3!,f=-6.3!) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 HIS : no HD1:sc= -0.0024 X(o=-0.0024,f=-0.0024) USER MOD Single : A 34 GLN : amide:sc= -11.7! C(o=-12!,f=-20!) USER MOD Single : A 45 MET CE :methyl 155:sc= 0 (180deg=-0.00736) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 147:sc= -5.33! (180deg=-7.92!) USER MOD Single : A 51 GLN : amide:sc= -4.49! C(o=-4.5!,f=-10!) USER MOD Single : A 52 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 TYR OH : rot 180:sc= -2.32! USER MOD Single : A 59 MET CE :methyl -122:sc= -0.054 (180deg=-0.0875) USER MOD Single : A 61 TYR OH : rot 180:sc= -0.0762 USER MOD Single : A 65 ASN : amide:sc= -0.168 K(o=-0.17,f=-0.93) USER MOD Single : A 68 HIS : no HD1:sc= -3.59! C(o=-3.6!,f=-3.7!) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 TYR OH : rot 180:sc=-0.00735 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0.251 USER MOD Single : A 85 LYS NZ :NH3+ -156:sc= -0.0237 (180deg=-0.229) USER MOD Single : A 87 ASN : amide:sc= 0.478 K(o=0.48,f=-6.3!) USER MOD Single : A 92 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 93 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 94 HIS : no HD1:sc= -0.371 X(o=-0.37,f=-0.49) USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 96 HIS : no HD1:sc= -0.0277 X(o=-0.028,f=-0.44) USER MOD Single : A 97 HIS : no HD1:sc= -0.0408 X(o=-0.041,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.325 0.000 0.000 1.00 0.00 N ATOM 2 CA MET A 1 2.073 0.000 -1.245 1.00 0.00 C ATOM 3 C MET A 1 1.166 -0.339 -2.430 1.00 0.00 C ATOM 4 O MET A 1 0.726 0.552 -3.154 1.00 0.00 O ATOM 5 CB MET A 1 3.207 -1.024 -1.160 1.00 0.00 C ATOM 6 CG MET A 1 4.572 -0.333 -1.170 1.00 0.00 C ATOM 7 SD MET A 1 4.633 0.916 0.103 1.00 0.00 S ATOM 8 CE MET A 1 5.642 2.141 -0.713 1.00 0.00 C ATOM 0 H1 MET A 1 1.963 0.233 0.788 1.00 0.00 H new ATOM 0 H2 MET A 1 0.565 0.708 -0.051 1.00 0.00 H new ATOM 0 H3 MET A 1 0.911 -0.941 0.156 1.00 0.00 H new ATOM 0 HA MET A 1 2.484 0.998 -1.400 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.101 -1.614 -0.250 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.140 -1.717 -1.999 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.362 -1.067 -1.009 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.752 0.120 -2.145 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.781 2.997 -0.052 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.613 1.709 -0.957 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.149 2.466 -1.629 1.00 0.00 H new ATOM 18 N ILE A 2 0.914 -1.630 -2.591 1.00 0.00 N ATOM 19 CA ILE A 2 0.068 -2.098 -3.675 1.00 0.00 C ATOM 20 C ILE A 2 -0.147 -3.606 -3.533 1.00 0.00 C ATOM 21 O ILE A 2 0.357 -4.224 -2.597 1.00 0.00 O ATOM 22 CB ILE A 2 0.652 -1.684 -5.027 1.00 0.00 C ATOM 23 CG1 ILE A 2 -0.459 -1.334 -6.020 1.00 0.00 C ATOM 24 CG2 ILE A 2 1.589 -2.763 -5.573 1.00 0.00 C ATOM 25 CD1 ILE A 2 -0.188 0.013 -6.693 1.00 0.00 C ATOM 0 H ILE A 2 1.281 -2.366 -1.988 1.00 0.00 H new ATOM 0 HA ILE A 2 -0.915 -1.629 -3.622 1.00 0.00 H new ATOM 0 HB ILE A 2 1.249 -0.784 -4.880 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -0.534 -2.114 -6.777 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -1.417 -1.299 -5.502 1.00 0.00 H new ATOM 0 HG21 ILE A 2 1.990 -2.444 -6.535 1.00 0.00 H new ATOM 0 HG22 ILE A 2 2.409 -2.922 -4.872 1.00 0.00 H new ATOM 0 HG23 ILE A 2 1.036 -3.694 -5.702 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -0.992 0.238 -7.394 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -0.138 0.795 -5.935 1.00 0.00 H new ATOM 0 HD13 ILE A 2 0.759 -0.033 -7.230 1.00 0.00 H new ATOM 37 N GLU A 3 -0.897 -4.156 -4.478 1.00 0.00 N ATOM 38 CA GLU A 3 -1.185 -5.580 -4.470 1.00 0.00 C ATOM 39 C GLU A 3 -2.170 -5.928 -5.588 1.00 0.00 C ATOM 40 O GLU A 3 -3.168 -5.235 -5.779 1.00 0.00 O ATOM 41 CB GLU A 3 -1.723 -6.023 -3.108 1.00 0.00 C ATOM 42 CG GLU A 3 -2.776 -5.043 -2.588 1.00 0.00 C ATOM 43 CD GLU A 3 -2.449 -4.592 -1.163 1.00 0.00 C ATOM 44 OE1 GLU A 3 -1.745 -5.306 -0.433 1.00 0.00 O ATOM 45 OE2 GLU A 3 -2.953 -3.455 -0.821 1.00 0.00 O ATOM 0 H GLU A 3 -1.313 -3.641 -5.254 1.00 0.00 H new ATOM 0 HA GLU A 3 -0.255 -6.120 -4.650 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -2.158 -7.019 -3.192 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -0.902 -6.093 -2.394 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -2.826 -4.175 -3.245 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -3.758 -5.515 -2.608 1.00 0.00 H new ATOM 53 N ASP A 4 -1.855 -7.002 -6.297 1.00 0.00 N ATOM 54 CA ASP A 4 -2.700 -7.451 -7.391 1.00 0.00 C ATOM 55 C ASP A 4 -2.006 -8.598 -8.128 1.00 0.00 C ATOM 56 O ASP A 4 -1.020 -8.382 -8.831 1.00 0.00 O ATOM 57 CB ASP A 4 -2.945 -6.323 -8.396 1.00 0.00 C ATOM 58 CG ASP A 4 -4.407 -6.127 -8.803 1.00 0.00 C ATOM 59 OD1 ASP A 4 -5.135 -5.323 -8.202 1.00 0.00 O ATOM 60 OD2 ASP A 4 -4.798 -6.851 -9.797 1.00 0.00 O ATOM 0 H ASP A 4 -1.026 -7.574 -6.135 1.00 0.00 H new ATOM 0 HA ASP A 4 -3.653 -7.774 -6.971 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -2.574 -5.391 -7.971 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -2.357 -6.521 -9.292 1.00 0.00 H new ATOM 66 N PRO A 5 -2.563 -9.824 -7.938 1.00 0.00 N ATOM 67 CA PRO A 5 -2.008 -11.005 -8.576 1.00 0.00 C ATOM 68 C PRO A 5 -2.359 -11.039 -10.065 1.00 0.00 C ATOM 69 O PRO A 5 -3.317 -10.399 -10.496 1.00 0.00 O ATOM 70 CB PRO A 5 -2.587 -12.179 -7.803 1.00 0.00 C ATOM 71 CG PRO A 5 -3.799 -11.634 -7.064 1.00 0.00 C ATOM 72 CD PRO A 5 -3.731 -10.117 -7.112 1.00 0.00 C ATOM 0 HA PRO A 5 -0.919 -11.025 -8.548 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -2.871 -12.988 -8.476 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -1.855 -12.587 -7.106 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -4.720 -11.990 -7.527 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -3.805 -11.983 -6.032 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -4.638 -9.693 -7.544 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -3.626 -9.694 -6.113 1.00 0.00 H new ATOM 80 N MET A 6 -1.563 -11.793 -10.811 1.00 0.00 N ATOM 81 CA MET A 6 -1.778 -11.918 -12.242 1.00 0.00 C ATOM 82 C MET A 6 -0.618 -12.662 -12.907 1.00 0.00 C ATOM 83 O MET A 6 0.308 -12.040 -13.426 1.00 0.00 O ATOM 84 CB MET A 6 -1.914 -10.527 -12.863 1.00 0.00 C ATOM 85 CG MET A 6 -3.204 -10.414 -13.678 1.00 0.00 C ATOM 86 SD MET A 6 -2.922 -10.978 -15.348 1.00 0.00 S ATOM 87 CE MET A 6 -4.278 -12.126 -15.520 1.00 0.00 C ATOM 0 H MET A 6 -0.769 -12.323 -10.451 1.00 0.00 H new ATOM 0 HA MET A 6 -2.693 -12.488 -12.404 1.00 0.00 H new ATOM 0 HB2 MET A 6 -1.909 -9.772 -12.077 1.00 0.00 H new ATOM 0 HB3 MET A 6 -1.056 -10.326 -13.504 1.00 0.00 H new ATOM 0 HG2 MET A 6 -3.991 -11.008 -13.213 1.00 0.00 H new ATOM 0 HG3 MET A 6 -3.548 -9.380 -13.688 1.00 0.00 H new ATOM 0 HE1 MET A 6 -4.252 -12.573 -16.514 1.00 0.00 H new ATOM 0 HE2 MET A 6 -4.189 -12.909 -14.767 1.00 0.00 H new ATOM 0 HE3 MET A 6 -5.222 -11.597 -15.384 1.00 0.00 H new ATOM 97 N GLU A 7 -0.705 -13.984 -12.869 1.00 0.00 N ATOM 98 CA GLU A 7 0.326 -14.819 -13.461 1.00 0.00 C ATOM 99 C GLU A 7 0.076 -14.987 -14.961 1.00 0.00 C ATOM 100 O GLU A 7 -0.335 -14.044 -15.635 1.00 0.00 O ATOM 101 CB GLU A 7 0.400 -16.178 -12.762 1.00 0.00 C ATOM 102 CG GLU A 7 -0.849 -17.012 -13.052 1.00 0.00 C ATOM 103 CD GLU A 7 -1.820 -16.977 -11.870 1.00 0.00 C ATOM 104 OE1 GLU A 7 -1.389 -17.081 -10.712 1.00 0.00 O ATOM 105 OE2 GLU A 7 -3.062 -16.834 -12.188 1.00 0.00 O ATOM 0 H GLU A 7 -1.474 -14.497 -12.437 1.00 0.00 H new ATOM 0 HA GLU A 7 1.288 -14.325 -13.326 1.00 0.00 H new ATOM 0 HB2 GLU A 7 1.287 -16.716 -13.098 1.00 0.00 H new ATOM 0 HB3 GLU A 7 0.503 -16.033 -11.687 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -1.345 -16.632 -13.945 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -0.562 -18.043 -13.261 1.00 0.00 H new ATOM 113 N ASN A 8 0.336 -16.195 -15.440 1.00 0.00 N ATOM 114 CA ASN A 8 0.144 -16.499 -16.848 1.00 0.00 C ATOM 115 C ASN A 8 1.308 -15.917 -17.654 1.00 0.00 C ATOM 116 O ASN A 8 1.337 -16.031 -18.878 1.00 0.00 O ATOM 117 CB ASN A 8 -1.152 -15.878 -17.374 1.00 0.00 C ATOM 118 CG ASN A 8 -1.832 -16.803 -18.386 1.00 0.00 C ATOM 119 OD1 ASN A 8 -1.789 -18.018 -18.281 1.00 0.00 O ATOM 120 ND2 ASN A 8 -2.460 -16.163 -19.367 1.00 0.00 N ATOM 0 H ASN A 8 0.678 -16.975 -14.878 1.00 0.00 H new ATOM 0 HA ASN A 8 0.094 -17.583 -16.955 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -1.829 -15.682 -16.543 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -0.936 -14.918 -17.842 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -2.945 -16.691 -20.092 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -2.457 -15.143 -19.395 1.00 0.00 H new ATOM 127 N ASN A 9 2.238 -15.308 -16.934 1.00 0.00 N ATOM 128 CA ASN A 9 3.401 -14.708 -17.566 1.00 0.00 C ATOM 129 C ASN A 9 4.474 -15.780 -17.770 1.00 0.00 C ATOM 130 O ASN A 9 5.231 -15.728 -18.738 1.00 0.00 O ATOM 131 CB ASN A 9 3.995 -13.603 -16.691 1.00 0.00 C ATOM 132 CG ASN A 9 4.928 -12.703 -17.504 1.00 0.00 C ATOM 133 OD1 ASN A 9 6.139 -12.724 -17.355 1.00 0.00 O ATOM 134 ND2 ASN A 9 4.299 -11.913 -18.369 1.00 0.00 N ATOM 0 H ASN A 9 2.210 -15.217 -15.918 1.00 0.00 H new ATOM 0 HA ASN A 9 3.086 -14.282 -18.518 1.00 0.00 H new ATOM 0 HB2 ASN A 9 3.192 -13.005 -16.259 1.00 0.00 H new ATOM 0 HB3 ASN A 9 4.544 -14.047 -15.861 1.00 0.00 H new ATOM 0 HD21 ASN A 9 4.833 -11.274 -18.958 1.00 0.00 H new ATOM 0 HD22 ASN A 9 3.282 -11.946 -18.443 1.00 0.00 H new ATOM 141 N GLU A 10 4.505 -16.725 -16.842 1.00 0.00 N ATOM 142 CA GLU A 10 5.473 -17.806 -16.907 1.00 0.00 C ATOM 143 C GLU A 10 5.616 -18.304 -18.347 1.00 0.00 C ATOM 144 O GLU A 10 6.651 -18.098 -18.979 1.00 0.00 O ATOM 145 CB GLU A 10 5.082 -18.949 -15.968 1.00 0.00 C ATOM 146 CG GLU A 10 6.005 -18.997 -14.749 1.00 0.00 C ATOM 147 CD GLU A 10 5.197 -19.107 -13.454 1.00 0.00 C ATOM 148 OE1 GLU A 10 4.134 -18.481 -13.331 1.00 0.00 O ATOM 149 OE2 GLU A 10 5.710 -19.878 -12.556 1.00 0.00 O ATOM 0 H GLU A 10 3.875 -16.764 -16.041 1.00 0.00 H new ATOM 0 HA GLU A 10 6.439 -17.423 -16.578 1.00 0.00 H new ATOM 0 HB2 GLU A 10 4.050 -18.820 -15.642 1.00 0.00 H new ATOM 0 HB3 GLU A 10 5.131 -19.897 -16.503 1.00 0.00 H new ATOM 0 HG2 GLU A 10 6.681 -19.848 -14.833 1.00 0.00 H new ATOM 0 HG3 GLU A 10 6.623 -18.100 -14.721 1.00 0.00 H new ATOM 157 N ILE A 11 4.562 -18.950 -18.824 1.00 0.00 N ATOM 158 CA ILE A 11 4.557 -19.478 -20.177 1.00 0.00 C ATOM 159 C ILE A 11 5.221 -18.469 -21.117 1.00 0.00 C ATOM 160 O ILE A 11 5.810 -18.851 -22.127 1.00 0.00 O ATOM 161 CB ILE A 11 3.138 -19.867 -20.596 1.00 0.00 C ATOM 162 CG1 ILE A 11 2.155 -18.725 -20.329 1.00 0.00 C ATOM 163 CG2 ILE A 11 2.703 -21.168 -19.918 1.00 0.00 C ATOM 164 CD1 ILE A 11 0.729 -19.130 -20.704 1.00 0.00 C ATOM 0 H ILE A 11 3.705 -19.120 -18.297 1.00 0.00 H new ATOM 0 HA ILE A 11 5.143 -20.396 -20.229 1.00 0.00 H new ATOM 0 HB ILE A 11 3.137 -20.048 -21.671 1.00 0.00 H new ATOM 0 HG12 ILE A 11 2.193 -18.447 -19.276 1.00 0.00 H new ATOM 0 HG13 ILE A 11 2.450 -17.846 -20.902 1.00 0.00 H new ATOM 0 HG21 ILE A 11 1.691 -21.422 -20.233 1.00 0.00 H new ATOM 0 HG22 ILE A 11 3.383 -21.971 -20.201 1.00 0.00 H new ATOM 0 HG23 ILE A 11 2.725 -21.039 -18.836 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.051 -18.300 -20.504 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.690 -19.384 -21.763 1.00 0.00 H new ATOM 0 HD13 ILE A 11 0.429 -19.995 -20.112 1.00 0.00 H new ATOM 176 N GLN A 12 5.104 -17.202 -20.750 1.00 0.00 N ATOM 177 CA GLN A 12 5.685 -16.135 -21.547 1.00 0.00 C ATOM 178 C GLN A 12 7.187 -16.030 -21.279 1.00 0.00 C ATOM 179 O GLN A 12 8.000 -16.354 -22.143 1.00 0.00 O ATOM 180 CB GLN A 12 4.985 -14.802 -21.274 1.00 0.00 C ATOM 181 CG GLN A 12 4.826 -13.993 -22.562 1.00 0.00 C ATOM 182 CD GLN A 12 4.166 -12.641 -22.282 1.00 0.00 C ATOM 183 OE1 GLN A 12 4.806 -11.602 -22.255 1.00 0.00 O ATOM 184 NE2 GLN A 12 2.854 -12.711 -22.077 1.00 0.00 N ATOM 0 H GLN A 12 4.615 -16.890 -19.911 1.00 0.00 H new ATOM 0 HA GLN A 12 5.539 -16.375 -22.600 1.00 0.00 H new ATOM 0 HB2 GLN A 12 4.006 -14.985 -20.832 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.560 -14.227 -20.548 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.802 -13.837 -23.021 1.00 0.00 H new ATOM 0 HG3 GLN A 12 4.224 -14.555 -23.277 1.00 0.00 H new ATOM 0 HE21 GLN A 12 2.380 -13.613 -22.114 1.00 0.00 H new ATOM 0 HE22 GLN A 12 2.322 -11.863 -21.883 1.00 0.00 H new ATOM 193 N SER A 13 7.511 -15.576 -20.077 1.00 0.00 N ATOM 194 CA SER A 13 8.901 -15.424 -19.683 1.00 0.00 C ATOM 195 C SER A 13 9.707 -16.648 -20.125 1.00 0.00 C ATOM 196 O SER A 13 10.911 -16.552 -20.356 1.00 0.00 O ATOM 197 CB SER A 13 9.028 -15.223 -18.172 1.00 0.00 C ATOM 198 OG SER A 13 10.310 -14.722 -17.805 1.00 0.00 O ATOM 0 H SER A 13 6.834 -15.308 -19.363 1.00 0.00 H new ATOM 0 HA SER A 13 9.300 -14.537 -20.174 1.00 0.00 H new ATOM 0 HB2 SER A 13 8.258 -14.531 -17.833 1.00 0.00 H new ATOM 0 HB3 SER A 13 8.851 -16.171 -17.664 1.00 0.00 H new ATOM 0 HG SER A 13 10.350 -14.606 -16.833 1.00 0.00 H new ATOM 204 N VAL A 14 9.009 -17.769 -20.229 1.00 0.00 N ATOM 205 CA VAL A 14 9.644 -19.010 -20.639 1.00 0.00 C ATOM 206 C VAL A 14 9.780 -19.029 -22.163 1.00 0.00 C ATOM 207 O VAL A 14 10.859 -19.296 -22.690 1.00 0.00 O ATOM 208 CB VAL A 14 8.859 -20.205 -20.094 1.00 0.00 C ATOM 209 CG1 VAL A 14 9.393 -21.519 -20.667 1.00 0.00 C ATOM 210 CG2 VAL A 14 8.882 -20.224 -18.564 1.00 0.00 C ATOM 0 H VAL A 14 8.010 -17.844 -20.037 1.00 0.00 H new ATOM 0 HA VAL A 14 10.649 -19.081 -20.222 1.00 0.00 H new ATOM 0 HB VAL A 14 7.822 -20.098 -20.412 1.00 0.00 H new ATOM 0 HG11 VAL A 14 8.818 -22.352 -20.264 1.00 0.00 H new ATOM 0 HG12 VAL A 14 9.301 -21.506 -21.753 1.00 0.00 H new ATOM 0 HG13 VAL A 14 10.442 -21.636 -20.393 1.00 0.00 H new ATOM 0 HG21 VAL A 14 8.317 -21.083 -18.202 1.00 0.00 H new ATOM 0 HG22 VAL A 14 9.913 -20.295 -18.216 1.00 0.00 H new ATOM 0 HG23 VAL A 14 8.433 -19.307 -18.182 1.00 0.00 H new ATOM 220 N LEU A 15 8.670 -18.743 -22.828 1.00 0.00 N ATOM 221 CA LEU A 15 8.652 -18.725 -24.281 1.00 0.00 C ATOM 222 C LEU A 15 9.709 -17.741 -24.787 1.00 0.00 C ATOM 223 O LEU A 15 10.290 -17.943 -25.852 1.00 0.00 O ATOM 224 CB LEU A 15 7.241 -18.430 -24.795 1.00 0.00 C ATOM 225 CG LEU A 15 7.103 -18.250 -26.308 1.00 0.00 C ATOM 226 CD1 LEU A 15 7.626 -19.478 -27.056 1.00 0.00 C ATOM 227 CD2 LEU A 15 5.660 -17.918 -26.691 1.00 0.00 C ATOM 0 H LEU A 15 7.777 -18.522 -22.387 1.00 0.00 H new ATOM 0 HA LEU A 15 8.913 -19.706 -24.678 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.585 -19.243 -24.484 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.880 -17.525 -24.307 1.00 0.00 H new ATOM 0 HG LEU A 15 7.719 -17.403 -26.609 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.516 -19.324 -28.130 1.00 0.00 H new ATOM 0 HD12 LEU A 15 8.679 -19.629 -26.817 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.056 -20.357 -26.755 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.589 -17.795 -27.772 1.00 0.00 H new ATOM 0 HD22 LEU A 15 5.004 -18.729 -26.374 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.357 -16.993 -26.200 1.00 0.00 H new ATOM 239 N MET A 16 9.926 -16.698 -24.000 1.00 0.00 N ATOM 240 CA MET A 16 10.902 -15.682 -24.355 1.00 0.00 C ATOM 241 C MET A 16 12.303 -16.080 -23.885 1.00 0.00 C ATOM 242 O MET A 16 13.294 -15.772 -24.545 1.00 0.00 O ATOM 243 CB MET A 16 10.509 -14.349 -23.716 1.00 0.00 C ATOM 244 CG MET A 16 9.582 -13.552 -24.637 1.00 0.00 C ATOM 245 SD MET A 16 10.095 -11.843 -24.687 1.00 0.00 S ATOM 246 CE MET A 16 9.313 -11.330 -26.208 1.00 0.00 C ATOM 0 H MET A 16 9.442 -16.534 -23.117 1.00 0.00 H new ATOM 0 HA MET A 16 10.917 -15.584 -25.440 1.00 0.00 H new ATOM 0 HB2 MET A 16 10.012 -14.531 -22.763 1.00 0.00 H new ATOM 0 HB3 MET A 16 11.405 -13.766 -23.502 1.00 0.00 H new ATOM 0 HG2 MET A 16 9.601 -13.976 -25.641 1.00 0.00 H new ATOM 0 HG3 MET A 16 8.554 -13.622 -24.281 1.00 0.00 H new ATOM 0 HE1 MET A 16 10.074 -11.001 -26.916 1.00 0.00 H new ATOM 0 HE2 MET A 16 8.760 -12.168 -26.633 1.00 0.00 H new ATOM 0 HE3 MET A 16 8.627 -10.508 -26.005 1.00 0.00 H new ATOM 256 N ASN A 17 12.340 -16.759 -22.747 1.00 0.00 N ATOM 257 CA ASN A 17 13.602 -17.202 -22.181 1.00 0.00 C ATOM 258 C ASN A 17 14.222 -18.261 -23.095 1.00 0.00 C ATOM 259 O ASN A 17 15.444 -18.342 -23.218 1.00 0.00 O ATOM 260 CB ASN A 17 13.397 -17.830 -20.801 1.00 0.00 C ATOM 261 CG ASN A 17 13.716 -16.829 -19.690 1.00 0.00 C ATOM 262 OD1 ASN A 17 14.722 -16.139 -19.710 1.00 0.00 O ATOM 263 ND2 ASN A 17 12.806 -16.787 -18.721 1.00 0.00 N ATOM 0 H ASN A 17 11.516 -17.013 -22.202 1.00 0.00 H new ATOM 0 HA ASN A 17 14.253 -16.333 -22.088 1.00 0.00 H new ATOM 0 HB2 ASN A 17 12.367 -18.172 -20.703 1.00 0.00 H new ATOM 0 HB3 ASN A 17 14.035 -18.708 -20.699 1.00 0.00 H new ATOM 0 HD21 ASN A 17 12.928 -16.150 -17.934 1.00 0.00 H new ATOM 0 HD22 ASN A 17 11.986 -17.392 -18.765 1.00 0.00 H new ATOM 270 N ALA A 18 13.352 -19.047 -23.712 1.00 0.00 N ATOM 271 CA ALA A 18 13.799 -20.097 -24.611 1.00 0.00 C ATOM 272 C ALA A 18 14.251 -19.473 -25.933 1.00 0.00 C ATOM 273 O ALA A 18 15.364 -19.721 -26.393 1.00 0.00 O ATOM 274 CB ALA A 18 12.676 -21.118 -24.802 1.00 0.00 C ATOM 0 H ALA A 18 12.340 -18.978 -23.607 1.00 0.00 H new ATOM 0 HA ALA A 18 14.653 -20.627 -24.188 1.00 0.00 H new ATOM 0 HB1 ALA A 18 13.011 -21.906 -25.477 1.00 0.00 H new ATOM 0 HB2 ALA A 18 12.412 -21.553 -23.838 1.00 0.00 H new ATOM 0 HB3 ALA A 18 11.803 -20.623 -25.228 1.00 0.00 H new ATOM 280 N LEU A 19 13.363 -18.675 -26.508 1.00 0.00 N ATOM 281 CA LEU A 19 13.656 -18.013 -27.768 1.00 0.00 C ATOM 282 C LEU A 19 12.479 -17.115 -28.153 1.00 0.00 C ATOM 283 O LEU A 19 11.399 -17.605 -28.477 1.00 0.00 O ATOM 284 CB LEU A 19 14.021 -19.041 -28.840 1.00 0.00 C ATOM 285 CG LEU A 19 15.423 -18.915 -29.441 1.00 0.00 C ATOM 286 CD1 LEU A 19 16.053 -20.292 -29.657 1.00 0.00 C ATOM 287 CD2 LEU A 19 15.394 -18.089 -30.729 1.00 0.00 C ATOM 0 H LEU A 19 12.440 -18.472 -26.124 1.00 0.00 H new ATOM 0 HA LEU A 19 14.529 -17.368 -27.666 1.00 0.00 H new ATOM 0 HB2 LEU A 19 13.920 -20.037 -28.409 1.00 0.00 H new ATOM 0 HB3 LEU A 19 13.293 -18.968 -29.648 1.00 0.00 H new ATOM 0 HG LEU A 19 16.053 -18.381 -28.730 1.00 0.00 H new ATOM 0 HD11 LEU A 19 17.048 -20.174 -30.085 1.00 0.00 H new ATOM 0 HD12 LEU A 19 16.128 -20.812 -28.702 1.00 0.00 H new ATOM 0 HD13 LEU A 19 15.432 -20.873 -30.339 1.00 0.00 H new ATOM 0 HD21 LEU A 19 16.402 -18.014 -31.136 1.00 0.00 H new ATOM 0 HD22 LEU A 19 14.744 -18.573 -31.457 1.00 0.00 H new ATOM 0 HD23 LEU A 19 15.015 -17.090 -30.512 1.00 0.00 H new ATOM 299 N SER A 20 12.728 -15.814 -28.105 1.00 0.00 N ATOM 300 CA SER A 20 11.703 -14.843 -28.445 1.00 0.00 C ATOM 301 C SER A 20 11.467 -14.838 -29.957 1.00 0.00 C ATOM 302 O SER A 20 11.639 -15.861 -30.618 1.00 0.00 O ATOM 303 CB SER A 20 12.090 -13.443 -27.964 1.00 0.00 C ATOM 304 OG SER A 20 12.965 -13.487 -26.840 1.00 0.00 O ATOM 0 H SER A 20 13.625 -15.410 -27.836 1.00 0.00 H new ATOM 0 HA SER A 20 10.780 -15.129 -27.941 1.00 0.00 H new ATOM 0 HB2 SER A 20 12.572 -12.901 -28.777 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.189 -12.888 -27.701 1.00 0.00 H new ATOM 0 HG SER A 20 13.190 -12.574 -26.564 1.00 0.00 H new ATOM 310 N LEU A 21 11.076 -13.676 -30.459 1.00 0.00 N ATOM 311 CA LEU A 21 10.815 -13.525 -31.880 1.00 0.00 C ATOM 312 C LEU A 21 10.264 -12.123 -32.147 1.00 0.00 C ATOM 313 O LEU A 21 10.700 -11.447 -33.078 1.00 0.00 O ATOM 314 CB LEU A 21 9.904 -14.648 -32.380 1.00 0.00 C ATOM 315 CG LEU A 21 10.379 -15.390 -33.631 1.00 0.00 C ATOM 316 CD1 LEU A 21 11.446 -16.429 -33.281 1.00 0.00 C ATOM 317 CD2 LEU A 21 9.199 -16.011 -34.382 1.00 0.00 C ATOM 0 H LEU A 21 10.934 -12.830 -29.907 1.00 0.00 H new ATOM 0 HA LEU A 21 11.740 -13.619 -32.449 1.00 0.00 H new ATOM 0 HB2 LEU A 21 9.780 -15.374 -31.576 1.00 0.00 H new ATOM 0 HB3 LEU A 21 8.919 -14.227 -32.583 1.00 0.00 H new ATOM 0 HG LEU A 21 10.842 -14.666 -34.301 1.00 0.00 H new ATOM 0 HD11 LEU A 21 11.766 -16.942 -34.188 1.00 0.00 H new ATOM 0 HD12 LEU A 21 12.302 -15.932 -32.824 1.00 0.00 H new ATOM 0 HD13 LEU A 21 11.032 -17.155 -32.581 1.00 0.00 H new ATOM 0 HD21 LEU A 21 9.565 -16.532 -35.267 1.00 0.00 H new ATOM 0 HD22 LEU A 21 8.685 -16.718 -33.731 1.00 0.00 H new ATOM 0 HD23 LEU A 21 8.506 -15.226 -34.684 1.00 0.00 H new ATOM 329 N GLN A 22 9.314 -11.726 -31.313 1.00 0.00 N ATOM 330 CA GLN A 22 8.699 -10.417 -31.447 1.00 0.00 C ATOM 331 C GLN A 22 7.485 -10.303 -30.523 1.00 0.00 C ATOM 332 O GLN A 22 7.465 -9.468 -29.619 1.00 0.00 O ATOM 333 CB GLN A 22 8.309 -10.140 -32.901 1.00 0.00 C ATOM 334 CG GLN A 22 8.642 -8.699 -33.293 1.00 0.00 C ATOM 335 CD GLN A 22 8.189 -8.402 -34.724 1.00 0.00 C ATOM 336 OE1 GLN A 22 7.167 -8.879 -35.191 1.00 0.00 O ATOM 337 NE2 GLN A 22 9.003 -7.590 -35.392 1.00 0.00 N ATOM 0 H GLN A 22 8.955 -12.289 -30.542 1.00 0.00 H new ATOM 0 HA GLN A 22 9.428 -9.663 -31.151 1.00 0.00 H new ATOM 0 HB2 GLN A 22 8.835 -10.831 -33.560 1.00 0.00 H new ATOM 0 HB3 GLN A 22 7.242 -10.320 -33.036 1.00 0.00 H new ATOM 0 HG2 GLN A 22 8.156 -8.009 -32.603 1.00 0.00 H new ATOM 0 HG3 GLN A 22 9.716 -8.533 -33.206 1.00 0.00 H new ATOM 0 HE21 GLN A 22 9.843 -7.226 -34.942 1.00 0.00 H new ATOM 0 HE22 GLN A 22 8.788 -7.331 -36.355 1.00 0.00 H new ATOM 346 N GLU A 23 6.503 -11.154 -30.780 1.00 0.00 N ATOM 347 CA GLU A 23 5.289 -11.160 -29.982 1.00 0.00 C ATOM 348 C GLU A 23 5.041 -12.554 -29.402 1.00 0.00 C ATOM 349 O GLU A 23 5.734 -13.508 -29.753 1.00 0.00 O ATOM 350 CB GLU A 23 4.089 -10.688 -30.806 1.00 0.00 C ATOM 351 CG GLU A 23 3.672 -9.271 -30.406 1.00 0.00 C ATOM 352 CD GLU A 23 3.468 -8.390 -31.641 1.00 0.00 C ATOM 353 OE1 GLU A 23 2.421 -8.479 -32.299 1.00 0.00 O ATOM 354 OE2 GLU A 23 4.445 -7.591 -31.908 1.00 0.00 O ATOM 0 H GLU A 23 6.523 -11.845 -31.530 1.00 0.00 H new ATOM 0 HA GLU A 23 5.418 -10.462 -29.155 1.00 0.00 H new ATOM 0 HB2 GLU A 23 4.340 -10.711 -31.866 1.00 0.00 H new ATOM 0 HB3 GLU A 23 3.252 -11.372 -30.661 1.00 0.00 H new ATOM 0 HG2 GLU A 23 2.750 -9.310 -29.826 1.00 0.00 H new ATOM 0 HG3 GLU A 23 4.435 -8.831 -29.763 1.00 0.00 H new ATOM 362 N VAL A 24 4.052 -12.627 -28.524 1.00 0.00 N ATOM 363 CA VAL A 24 3.704 -13.888 -27.892 1.00 0.00 C ATOM 364 C VAL A 24 2.181 -14.017 -27.824 1.00 0.00 C ATOM 365 O VAL A 24 1.466 -13.019 -27.897 1.00 0.00 O ATOM 366 CB VAL A 24 4.375 -13.989 -26.520 1.00 0.00 C ATOM 367 CG1 VAL A 24 5.892 -14.131 -26.661 1.00 0.00 C ATOM 368 CG2 VAL A 24 4.016 -12.786 -25.646 1.00 0.00 C ATOM 0 H VAL A 24 3.480 -11.833 -28.235 1.00 0.00 H new ATOM 0 HA VAL A 24 4.075 -14.726 -28.482 1.00 0.00 H new ATOM 0 HB VAL A 24 3.999 -14.886 -26.027 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.344 -14.201 -25.672 1.00 0.00 H new ATOM 0 HG12 VAL A 24 6.122 -15.032 -27.230 1.00 0.00 H new ATOM 0 HG13 VAL A 24 6.292 -13.261 -27.182 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.505 -12.882 -24.677 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.351 -11.870 -26.133 1.00 0.00 H new ATOM 0 HG23 VAL A 24 2.936 -12.748 -25.505 1.00 0.00 H new ATOM 378 N HIS A 25 1.730 -15.255 -27.684 1.00 0.00 N ATOM 379 CA HIS A 25 0.305 -15.527 -27.605 1.00 0.00 C ATOM 380 C HIS A 25 0.055 -16.678 -26.628 1.00 0.00 C ATOM 381 O HIS A 25 0.413 -17.821 -26.906 1.00 0.00 O ATOM 382 CB HIS A 25 -0.275 -15.794 -28.996 1.00 0.00 C ATOM 383 CG HIS A 25 -0.631 -14.543 -29.763 1.00 0.00 C ATOM 384 ND1 HIS A 25 0.321 -13.720 -30.339 1.00 0.00 N ATOM 385 CD2 HIS A 25 -1.844 -13.984 -30.043 1.00 0.00 C ATOM 386 CE1 HIS A 25 -0.301 -12.714 -30.936 1.00 0.00 C ATOM 387 NE2 HIS A 25 -1.643 -12.879 -30.751 1.00 0.00 N ATOM 0 H HIS A 25 2.326 -16.080 -27.623 1.00 0.00 H new ATOM 0 HA HIS A 25 -0.215 -14.650 -27.220 1.00 0.00 H new ATOM 0 HB2 HIS A 25 0.447 -16.370 -29.575 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -1.167 -16.412 -28.894 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -2.804 -14.374 -29.740 1.00 0.00 H new ATOM 0 HE1 HIS A 25 0.171 -11.905 -31.474 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -2.372 -12.256 -31.099 1.00 0.00 H new ATOM 395 N VAL A 26 -0.557 -16.335 -25.504 1.00 0.00 N ATOM 396 CA VAL A 26 -0.858 -17.325 -24.485 1.00 0.00 C ATOM 397 C VAL A 26 -2.352 -17.652 -24.523 1.00 0.00 C ATOM 398 O VAL A 26 -3.107 -17.228 -23.650 1.00 0.00 O ATOM 399 CB VAL A 26 -0.391 -16.826 -23.116 1.00 0.00 C ATOM 400 CG1 VAL A 26 1.120 -17.002 -22.955 1.00 0.00 C ATOM 401 CG2 VAL A 26 -0.800 -15.368 -22.895 1.00 0.00 C ATOM 0 H VAL A 26 -0.852 -15.385 -25.277 1.00 0.00 H new ATOM 0 HA VAL A 26 -0.317 -18.251 -24.681 1.00 0.00 H new ATOM 0 HB VAL A 26 -0.882 -17.431 -22.353 1.00 0.00 H new ATOM 0 HG11 VAL A 26 1.426 -16.640 -21.974 1.00 0.00 H new ATOM 0 HG12 VAL A 26 1.375 -18.058 -23.048 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.637 -16.434 -23.729 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -0.456 -15.038 -21.915 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -0.350 -14.743 -23.667 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -1.885 -15.283 -22.946 1.00 0.00 H new ATOM 411 N SER A 27 -2.735 -18.404 -25.545 1.00 0.00 N ATOM 412 CA SER A 27 -4.125 -18.793 -25.709 1.00 0.00 C ATOM 413 C SER A 27 -4.391 -20.108 -24.974 1.00 0.00 C ATOM 414 O SER A 27 -3.459 -20.765 -24.514 1.00 0.00 O ATOM 415 CB SER A 27 -4.488 -18.929 -27.189 1.00 0.00 C ATOM 416 OG SER A 27 -4.038 -17.814 -27.954 1.00 0.00 O ATOM 0 H SER A 27 -2.106 -18.754 -26.268 1.00 0.00 H new ATOM 0 HA SER A 27 -4.752 -18.011 -25.280 1.00 0.00 H new ATOM 0 HB2 SER A 27 -4.048 -19.843 -27.588 1.00 0.00 H new ATOM 0 HB3 SER A 27 -5.569 -19.025 -27.290 1.00 0.00 H new ATOM 0 HG SER A 27 -4.288 -17.940 -28.893 1.00 0.00 H new ATOM 422 N GLY A 28 -5.667 -20.453 -24.887 1.00 0.00 N ATOM 423 CA GLY A 28 -6.067 -21.678 -24.216 1.00 0.00 C ATOM 424 C GLY A 28 -7.543 -21.627 -23.816 1.00 0.00 C ATOM 425 O GLY A 28 -8.313 -20.841 -24.367 1.00 0.00 O ATOM 0 H GLY A 28 -6.438 -19.905 -25.270 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -5.894 -22.530 -24.873 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -5.451 -21.829 -23.329 1.00 0.00 H new ATOM 429 N ASP A 29 -7.894 -22.474 -22.860 1.00 0.00 N ATOM 430 CA ASP A 29 -9.264 -22.536 -22.380 1.00 0.00 C ATOM 431 C ASP A 29 -9.273 -22.397 -20.856 1.00 0.00 C ATOM 432 O ASP A 29 -9.834 -21.443 -20.320 1.00 0.00 O ATOM 433 CB ASP A 29 -9.913 -23.875 -22.736 1.00 0.00 C ATOM 434 CG ASP A 29 -11.387 -23.793 -23.139 1.00 0.00 C ATOM 435 OD1 ASP A 29 -12.228 -24.556 -22.642 1.00 0.00 O ATOM 436 OD2 ASP A 29 -11.663 -22.886 -24.014 1.00 0.00 O ATOM 0 H ASP A 29 -7.253 -23.124 -22.404 1.00 0.00 H new ATOM 0 HA ASP A 29 -9.823 -21.728 -22.852 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -9.353 -24.327 -23.555 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -9.823 -24.544 -21.880 1.00 0.00 H new ATOM 442 N GLY A 30 -8.644 -23.362 -20.202 1.00 0.00 N ATOM 443 CA GLY A 30 -8.572 -23.360 -18.751 1.00 0.00 C ATOM 444 C GLY A 30 -7.476 -24.304 -18.254 1.00 0.00 C ATOM 445 O GLY A 30 -6.713 -23.957 -17.354 1.00 0.00 O ATOM 0 H GLY A 30 -8.179 -24.151 -20.651 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -8.375 -22.349 -18.395 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -9.533 -23.663 -18.335 1.00 0.00 H new ATOM 449 N SER A 31 -7.432 -25.480 -18.863 1.00 0.00 N ATOM 450 CA SER A 31 -6.441 -26.477 -18.494 1.00 0.00 C ATOM 451 C SER A 31 -5.254 -26.418 -19.458 1.00 0.00 C ATOM 452 O SER A 31 -4.122 -26.181 -19.040 1.00 0.00 O ATOM 453 CB SER A 31 -7.049 -27.881 -18.487 1.00 0.00 C ATOM 454 OG SER A 31 -8.307 -27.915 -17.818 1.00 0.00 O ATOM 0 H SER A 31 -8.066 -25.765 -19.609 1.00 0.00 H new ATOM 0 HA SER A 31 -6.093 -26.255 -17.485 1.00 0.00 H new ATOM 0 HB2 SER A 31 -7.175 -28.227 -19.513 1.00 0.00 H new ATOM 0 HB3 SER A 31 -6.361 -28.572 -18.000 1.00 0.00 H new ATOM 0 HG SER A 31 -8.663 -28.828 -17.837 1.00 0.00 H new ATOM 460 N HIS A 32 -5.554 -26.637 -20.730 1.00 0.00 N ATOM 461 CA HIS A 32 -4.526 -26.611 -21.756 1.00 0.00 C ATOM 462 C HIS A 32 -4.515 -25.241 -22.437 1.00 0.00 C ATOM 463 O HIS A 32 -5.570 -24.676 -22.721 1.00 0.00 O ATOM 464 CB HIS A 32 -4.716 -27.763 -22.745 1.00 0.00 C ATOM 465 CG HIS A 32 -5.652 -27.444 -23.886 1.00 0.00 C ATOM 466 ND1 HIS A 32 -5.207 -27.187 -25.171 1.00 0.00 N ATOM 467 CD2 HIS A 32 -7.012 -27.345 -23.923 1.00 0.00 C ATOM 468 CE1 HIS A 32 -6.260 -26.944 -25.938 1.00 0.00 C ATOM 469 NE2 HIS A 32 -7.377 -27.042 -25.162 1.00 0.00 N ATOM 0 H HIS A 32 -6.494 -26.833 -21.073 1.00 0.00 H new ATOM 0 HA HIS A 32 -3.548 -26.759 -21.299 1.00 0.00 H new ATOM 0 HB2 HIS A 32 -3.744 -28.042 -23.153 1.00 0.00 H new ATOM 0 HB3 HIS A 32 -5.098 -28.631 -22.207 1.00 0.00 H new ATOM 0 HD2 HIS A 32 -7.679 -27.489 -23.086 1.00 0.00 H new ATOM 0 HE1 HIS A 32 -6.237 -26.710 -26.992 1.00 0.00 H new ATOM 0 HE2 HIS A 32 -8.336 -26.905 -25.482 1.00 0.00 H new ATOM 477 N PHE A 33 -3.310 -24.746 -22.679 1.00 0.00 N ATOM 478 CA PHE A 33 -3.148 -23.453 -23.321 1.00 0.00 C ATOM 479 C PHE A 33 -2.055 -23.505 -24.391 1.00 0.00 C ATOM 480 O PHE A 33 -1.001 -24.102 -24.178 1.00 0.00 O ATOM 481 CB PHE A 33 -2.732 -22.461 -22.233 1.00 0.00 C ATOM 482 CG PHE A 33 -3.244 -22.820 -20.836 1.00 0.00 C ATOM 483 CD1 PHE A 33 -4.508 -22.479 -20.467 1.00 0.00 C ATOM 484 CD2 PHE A 33 -2.435 -23.479 -19.964 1.00 0.00 C ATOM 485 CE1 PHE A 33 -4.983 -22.812 -19.171 1.00 0.00 C ATOM 486 CE2 PHE A 33 -2.911 -23.812 -18.668 1.00 0.00 C ATOM 487 CZ PHE A 33 -4.175 -23.471 -18.299 1.00 0.00 C ATOM 0 H PHE A 33 -2.437 -25.217 -22.442 1.00 0.00 H new ATOM 0 HA PHE A 33 -4.080 -23.159 -23.805 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -1.644 -22.402 -22.206 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -3.099 -21.470 -22.500 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -5.150 -21.955 -21.160 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -1.431 -23.749 -20.257 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -5.987 -22.542 -18.878 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -2.269 -24.336 -17.975 1.00 0.00 H new ATOM 0 HZ PHE A 33 -4.537 -23.724 -17.313 1.00 0.00 H new ATOM 497 N GLN A 34 -2.344 -22.872 -25.518 1.00 0.00 N ATOM 498 CA GLN A 34 -1.399 -22.839 -26.622 1.00 0.00 C ATOM 499 C GLN A 34 -0.572 -21.553 -26.574 1.00 0.00 C ATOM 500 O GLN A 34 -1.112 -20.457 -26.715 1.00 0.00 O ATOM 501 CB GLN A 34 -2.119 -22.978 -27.965 1.00 0.00 C ATOM 502 CG GLN A 34 -1.144 -23.389 -29.070 1.00 0.00 C ATOM 503 CD GLN A 34 -0.069 -22.321 -29.277 1.00 0.00 C ATOM 504 OE1 GLN A 34 -0.350 -21.159 -29.522 1.00 0.00 O ATOM 505 NE2 GLN A 34 1.176 -22.777 -29.167 1.00 0.00 N ATOM 0 H GLN A 34 -3.219 -22.378 -25.691 1.00 0.00 H new ATOM 0 HA GLN A 34 -0.722 -23.687 -26.521 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -2.913 -23.720 -27.881 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -2.593 -22.032 -28.227 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -0.674 -24.338 -28.811 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -1.689 -23.547 -30.001 1.00 0.00 H new ATOM 0 HE21 GLN A 34 1.342 -23.762 -28.960 1.00 0.00 H new ATOM 0 HE22 GLN A 34 1.965 -22.142 -29.289 1.00 0.00 H new ATOM 514 N VAL A 35 0.726 -21.729 -26.374 1.00 0.00 N ATOM 515 CA VAL A 35 1.633 -20.596 -26.306 1.00 0.00 C ATOM 516 C VAL A 35 2.356 -20.446 -27.646 1.00 0.00 C ATOM 517 O VAL A 35 3.398 -21.061 -27.866 1.00 0.00 O ATOM 518 CB VAL A 35 2.592 -20.764 -25.125 1.00 0.00 C ATOM 519 CG1 VAL A 35 3.505 -19.545 -24.982 1.00 0.00 C ATOM 520 CG2 VAL A 35 1.824 -21.029 -23.828 1.00 0.00 C ATOM 0 H VAL A 35 1.171 -22.639 -26.257 1.00 0.00 H new ATOM 0 HA VAL A 35 1.080 -19.674 -26.130 1.00 0.00 H new ATOM 0 HB VAL A 35 3.221 -21.632 -25.325 1.00 0.00 H new ATOM 0 HG11 VAL A 35 4.176 -19.690 -24.136 1.00 0.00 H new ATOM 0 HG12 VAL A 35 4.091 -19.421 -25.893 1.00 0.00 H new ATOM 0 HG13 VAL A 35 2.899 -18.654 -24.816 1.00 0.00 H new ATOM 0 HG21 VAL A 35 2.529 -21.145 -23.005 1.00 0.00 H new ATOM 0 HG22 VAL A 35 1.159 -20.191 -23.621 1.00 0.00 H new ATOM 0 HG23 VAL A 35 1.236 -21.941 -23.933 1.00 0.00 H new ATOM 530 N ILE A 36 1.774 -19.623 -28.506 1.00 0.00 N ATOM 531 CA ILE A 36 2.350 -19.384 -29.819 1.00 0.00 C ATOM 532 C ILE A 36 3.225 -18.130 -29.766 1.00 0.00 C ATOM 533 O ILE A 36 2.780 -17.076 -29.312 1.00 0.00 O ATOM 534 CB ILE A 36 1.251 -19.323 -30.882 1.00 0.00 C ATOM 535 CG1 ILE A 36 1.212 -20.612 -31.704 1.00 0.00 C ATOM 536 CG2 ILE A 36 1.412 -18.084 -31.766 1.00 0.00 C ATOM 537 CD1 ILE A 36 -0.090 -20.716 -32.500 1.00 0.00 C ATOM 0 H ILE A 36 0.910 -19.114 -28.320 1.00 0.00 H new ATOM 0 HA ILE A 36 2.997 -20.212 -30.109 1.00 0.00 H new ATOM 0 HB ILE A 36 0.290 -19.235 -30.376 1.00 0.00 H new ATOM 0 HG12 ILE A 36 2.062 -20.639 -32.386 1.00 0.00 H new ATOM 0 HG13 ILE A 36 1.307 -21.473 -31.042 1.00 0.00 H new ATOM 0 HG21 ILE A 36 0.619 -18.064 -32.513 1.00 0.00 H new ATOM 0 HG22 ILE A 36 1.352 -17.187 -31.150 1.00 0.00 H new ATOM 0 HG23 ILE A 36 2.380 -18.117 -32.266 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -0.092 -21.642 -33.076 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -0.937 -20.714 -31.814 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.170 -19.867 -33.179 1.00 0.00 H new ATOM 549 N ALA A 37 4.454 -18.284 -30.236 1.00 0.00 N ATOM 550 CA ALA A 37 5.395 -17.178 -30.248 1.00 0.00 C ATOM 551 C ALA A 37 5.345 -16.486 -31.612 1.00 0.00 C ATOM 552 O ALA A 37 5.722 -17.074 -32.625 1.00 0.00 O ATOM 553 CB ALA A 37 6.795 -17.694 -29.907 1.00 0.00 C ATOM 0 H ALA A 37 4.820 -19.159 -30.612 1.00 0.00 H new ATOM 0 HA ALA A 37 5.127 -16.439 -29.493 1.00 0.00 H new ATOM 0 HB1 ALA A 37 7.501 -16.864 -29.916 1.00 0.00 H new ATOM 0 HB2 ALA A 37 6.784 -18.150 -28.917 1.00 0.00 H new ATOM 0 HB3 ALA A 37 7.099 -18.437 -30.645 1.00 0.00 H new ATOM 559 N VAL A 38 4.876 -15.247 -31.595 1.00 0.00 N ATOM 560 CA VAL A 38 4.772 -14.469 -32.818 1.00 0.00 C ATOM 561 C VAL A 38 6.107 -13.772 -33.089 1.00 0.00 C ATOM 562 O VAL A 38 6.885 -13.533 -32.167 1.00 0.00 O ATOM 563 CB VAL A 38 3.597 -13.494 -32.719 1.00 0.00 C ATOM 564 CG1 VAL A 38 3.507 -12.616 -33.969 1.00 0.00 C ATOM 565 CG2 VAL A 38 2.284 -14.241 -32.478 1.00 0.00 C ATOM 0 H VAL A 38 4.564 -14.762 -30.754 1.00 0.00 H new ATOM 0 HA VAL A 38 4.567 -15.119 -33.668 1.00 0.00 H new ATOM 0 HB VAL A 38 3.773 -12.842 -31.863 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.664 -11.932 -33.873 1.00 0.00 H new ATOM 0 HG12 VAL A 38 4.428 -12.043 -34.079 1.00 0.00 H new ATOM 0 HG13 VAL A 38 3.365 -13.246 -34.847 1.00 0.00 H new ATOM 0 HG21 VAL A 38 1.465 -13.525 -32.412 1.00 0.00 H new ATOM 0 HG22 VAL A 38 2.099 -14.928 -33.304 1.00 0.00 H new ATOM 0 HG23 VAL A 38 2.351 -14.803 -31.547 1.00 0.00 H new ATOM 575 N GLY A 39 6.331 -13.465 -34.358 1.00 0.00 N ATOM 576 CA GLY A 39 7.558 -12.800 -34.762 1.00 0.00 C ATOM 577 C GLY A 39 7.807 -12.973 -36.262 1.00 0.00 C ATOM 578 O GLY A 39 7.017 -12.510 -37.084 1.00 0.00 O ATOM 0 H GLY A 39 5.683 -13.665 -35.120 1.00 0.00 H new ATOM 0 HA2 GLY A 39 7.498 -11.739 -34.520 1.00 0.00 H new ATOM 0 HA3 GLY A 39 8.399 -13.208 -34.201 1.00 0.00 H new ATOM 582 N GLU A 40 8.909 -13.640 -36.573 1.00 0.00 N ATOM 583 CA GLU A 40 9.272 -13.880 -37.959 1.00 0.00 C ATOM 584 C GLU A 40 10.565 -14.695 -38.035 1.00 0.00 C ATOM 585 O GLU A 40 10.733 -15.516 -38.935 1.00 0.00 O ATOM 586 CB GLU A 40 9.408 -12.564 -38.726 1.00 0.00 C ATOM 587 CG GLU A 40 8.480 -12.539 -39.942 1.00 0.00 C ATOM 588 CD GLU A 40 9.211 -12.016 -41.180 1.00 0.00 C ATOM 589 OE1 GLU A 40 10.172 -11.243 -41.051 1.00 0.00 O ATOM 590 OE2 GLU A 40 8.749 -12.441 -42.306 1.00 0.00 O ATOM 0 H GLU A 40 9.562 -14.022 -35.889 1.00 0.00 H new ATOM 0 HA GLU A 40 8.474 -14.455 -38.429 1.00 0.00 H new ATOM 0 HB2 GLU A 40 9.172 -11.729 -38.067 1.00 0.00 H new ATOM 0 HB3 GLU A 40 10.441 -12.433 -39.049 1.00 0.00 H new ATOM 0 HG2 GLU A 40 8.102 -13.543 -40.136 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.616 -11.908 -39.732 1.00 0.00 H new ATOM 598 N LEU A 41 11.445 -14.440 -37.078 1.00 0.00 N ATOM 599 CA LEU A 41 12.718 -15.139 -37.026 1.00 0.00 C ATOM 600 C LEU A 41 12.501 -16.610 -37.386 1.00 0.00 C ATOM 601 O LEU A 41 13.166 -17.139 -38.276 1.00 0.00 O ATOM 602 CB LEU A 41 13.388 -14.932 -35.666 1.00 0.00 C ATOM 603 CG LEU A 41 14.656 -15.748 -35.412 1.00 0.00 C ATOM 604 CD1 LEU A 41 15.753 -15.384 -36.414 1.00 0.00 C ATOM 605 CD2 LEU A 41 15.128 -15.592 -33.965 1.00 0.00 C ATOM 0 H LEU A 41 11.302 -13.759 -36.332 1.00 0.00 H new ATOM 0 HA LEU A 41 13.409 -14.728 -37.762 1.00 0.00 H new ATOM 0 HB2 LEU A 41 13.633 -13.875 -35.561 1.00 0.00 H new ATOM 0 HB3 LEU A 41 12.664 -15.170 -34.887 1.00 0.00 H new ATOM 0 HG LEU A 41 14.419 -16.801 -35.562 1.00 0.00 H new ATOM 0 HD11 LEU A 41 16.643 -15.979 -36.211 1.00 0.00 H new ATOM 0 HD12 LEU A 41 15.404 -15.588 -37.426 1.00 0.00 H new ATOM 0 HD13 LEU A 41 15.995 -14.325 -36.320 1.00 0.00 H new ATOM 0 HD21 LEU A 41 16.031 -16.183 -33.811 1.00 0.00 H new ATOM 0 HD22 LEU A 41 15.342 -14.542 -33.763 1.00 0.00 H new ATOM 0 HD23 LEU A 41 14.348 -15.940 -33.288 1.00 0.00 H new ATOM 617 N PHE A 42 11.569 -17.229 -36.677 1.00 0.00 N ATOM 618 CA PHE A 42 11.257 -18.629 -36.911 1.00 0.00 C ATOM 619 C PHE A 42 10.150 -18.776 -37.957 1.00 0.00 C ATOM 620 O PHE A 42 9.310 -19.669 -37.856 1.00 0.00 O ATOM 621 CB PHE A 42 10.765 -19.206 -35.582 1.00 0.00 C ATOM 622 CG PHE A 42 11.888 -19.570 -34.608 1.00 0.00 C ATOM 623 CD1 PHE A 42 13.148 -19.102 -34.818 1.00 0.00 C ATOM 624 CD2 PHE A 42 11.627 -20.360 -33.533 1.00 0.00 C ATOM 625 CE1 PHE A 42 14.190 -19.440 -33.915 1.00 0.00 C ATOM 626 CE2 PHE A 42 12.669 -20.698 -32.630 1.00 0.00 C ATOM 627 CZ PHE A 42 13.929 -20.230 -32.839 1.00 0.00 C ATOM 0 H PHE A 42 11.019 -16.787 -35.940 1.00 0.00 H new ATOM 0 HA PHE A 42 12.141 -19.151 -37.279 1.00 0.00 H new ATOM 0 HB2 PHE A 42 10.105 -18.481 -35.105 1.00 0.00 H new ATOM 0 HB3 PHE A 42 10.169 -20.096 -35.783 1.00 0.00 H new ATOM 0 HD1 PHE A 42 13.356 -18.474 -35.671 1.00 0.00 H new ATOM 0 HD2 PHE A 42 10.626 -20.731 -33.366 1.00 0.00 H new ATOM 0 HE1 PHE A 42 15.191 -19.070 -34.083 1.00 0.00 H new ATOM 0 HE2 PHE A 42 12.461 -21.327 -31.777 1.00 0.00 H new ATOM 0 HZ PHE A 42 14.721 -20.485 -32.151 1.00 0.00 H new ATOM 637 N ASP A 43 10.186 -17.887 -38.939 1.00 0.00 N ATOM 638 CA ASP A 43 9.197 -17.907 -40.003 1.00 0.00 C ATOM 639 C ASP A 43 9.711 -18.772 -41.156 1.00 0.00 C ATOM 640 O ASP A 43 10.028 -18.258 -42.228 1.00 0.00 O ATOM 641 CB ASP A 43 8.942 -16.499 -40.545 1.00 0.00 C ATOM 642 CG ASP A 43 7.972 -16.426 -41.725 1.00 0.00 C ATOM 643 OD1 ASP A 43 8.292 -15.861 -42.782 1.00 0.00 O ATOM 644 OD2 ASP A 43 6.828 -16.988 -41.526 1.00 0.00 O ATOM 0 H ASP A 43 10.885 -17.148 -39.020 1.00 0.00 H new ATOM 0 HA ASP A 43 8.270 -18.309 -39.594 1.00 0.00 H new ATOM 0 HB2 ASP A 43 8.554 -15.880 -39.736 1.00 0.00 H new ATOM 0 HB3 ASP A 43 9.894 -16.065 -40.850 1.00 0.00 H new ATOM 650 N GLY A 44 9.778 -20.069 -40.896 1.00 0.00 N ATOM 651 CA GLY A 44 10.248 -21.010 -41.898 1.00 0.00 C ATOM 652 C GLY A 44 10.968 -22.192 -41.246 1.00 0.00 C ATOM 653 O GLY A 44 11.140 -23.239 -41.869 1.00 0.00 O ATOM 0 H GLY A 44 9.514 -20.491 -40.005 1.00 0.00 H new ATOM 0 HA2 GLY A 44 9.404 -21.373 -42.485 1.00 0.00 H new ATOM 0 HA3 GLY A 44 10.923 -20.504 -42.588 1.00 0.00 H new ATOM 657 N MET A 45 11.369 -21.985 -40.000 1.00 0.00 N ATOM 658 CA MET A 45 12.066 -23.021 -39.257 1.00 0.00 C ATOM 659 C MET A 45 11.284 -24.336 -39.284 1.00 0.00 C ATOM 660 O MET A 45 10.057 -24.331 -39.369 1.00 0.00 O ATOM 661 CB MET A 45 12.255 -22.569 -37.807 1.00 0.00 C ATOM 662 CG MET A 45 13.053 -23.603 -37.011 1.00 0.00 C ATOM 663 SD MET A 45 13.866 -22.816 -35.630 1.00 0.00 S ATOM 664 CE MET A 45 15.317 -22.176 -36.449 1.00 0.00 C ATOM 0 H MET A 45 11.225 -21.116 -39.487 1.00 0.00 H new ATOM 0 HA MET A 45 13.036 -23.188 -39.725 1.00 0.00 H new ATOM 0 HB2 MET A 45 12.772 -21.610 -37.786 1.00 0.00 H new ATOM 0 HB3 MET A 45 11.282 -22.417 -37.340 1.00 0.00 H new ATOM 0 HG2 MET A 45 12.389 -24.390 -36.653 1.00 0.00 H new ATOM 0 HG3 MET A 45 13.792 -24.079 -37.656 1.00 0.00 H new ATOM 0 HE1 MET A 45 15.699 -21.318 -35.895 1.00 0.00 H new ATOM 0 HE2 MET A 45 16.083 -22.951 -36.491 1.00 0.00 H new ATOM 0 HE3 MET A 45 15.057 -21.868 -37.462 1.00 0.00 H new ATOM 674 N SER A 46 12.027 -25.430 -39.210 1.00 0.00 N ATOM 675 CA SER A 46 11.419 -26.750 -39.225 1.00 0.00 C ATOM 676 C SER A 46 10.714 -27.017 -37.894 1.00 0.00 C ATOM 677 O SER A 46 11.349 -27.021 -36.841 1.00 0.00 O ATOM 678 CB SER A 46 12.463 -27.834 -39.499 1.00 0.00 C ATOM 679 OG SER A 46 11.872 -29.124 -39.628 1.00 0.00 O ATOM 0 H SER A 46 13.045 -25.430 -39.139 1.00 0.00 H new ATOM 0 HA SER A 46 10.685 -26.779 -40.030 1.00 0.00 H new ATOM 0 HB2 SER A 46 13.006 -27.591 -40.412 1.00 0.00 H new ATOM 0 HB3 SER A 46 13.192 -27.849 -38.689 1.00 0.00 H new ATOM 0 HG SER A 46 12.571 -29.788 -39.804 1.00 0.00 H new ATOM 685 N ARG A 47 9.410 -27.233 -37.984 1.00 0.00 N ATOM 686 CA ARG A 47 8.612 -27.500 -36.800 1.00 0.00 C ATOM 687 C ARG A 47 9.405 -28.348 -35.805 1.00 0.00 C ATOM 688 O ARG A 47 9.239 -28.209 -34.594 1.00 0.00 O ATOM 689 CB ARG A 47 7.316 -28.228 -37.162 1.00 0.00 C ATOM 690 CG ARG A 47 6.333 -28.215 -35.989 1.00 0.00 C ATOM 691 CD ARG A 47 4.909 -28.513 -36.463 1.00 0.00 C ATOM 692 NE ARG A 47 4.615 -29.955 -36.305 1.00 0.00 N ATOM 693 CZ ARG A 47 4.989 -30.905 -37.188 1.00 0.00 C ATOM 694 NH1 ARG A 47 5.677 -30.573 -38.302 1.00 0.00 N ATOM 695 NH2 ARG A 47 4.672 -32.163 -36.947 1.00 0.00 N ATOM 0 H ARG A 47 8.886 -27.228 -38.859 1.00 0.00 H new ATOM 0 HA ARG A 47 8.362 -26.541 -36.346 1.00 0.00 H new ATOM 0 HB2 ARG A 47 6.858 -27.753 -38.030 1.00 0.00 H new ATOM 0 HB3 ARG A 47 7.539 -29.257 -37.443 1.00 0.00 H new ATOM 0 HG2 ARG A 47 6.636 -28.955 -35.248 1.00 0.00 H new ATOM 0 HG3 ARG A 47 6.360 -27.242 -35.498 1.00 0.00 H new ATOM 0 HD2 ARG A 47 4.195 -27.923 -35.889 1.00 0.00 H new ATOM 0 HD3 ARG A 47 4.796 -28.223 -37.508 1.00 0.00 H new ATOM 0 HE ARG A 47 4.097 -30.249 -35.477 1.00 0.00 H new ATOM 0 HH11 ARG A 47 5.918 -29.598 -38.481 1.00 0.00 H new ATOM 0 HH12 ARG A 47 5.956 -31.297 -38.964 1.00 0.00 H new ATOM 0 HH21 ARG A 47 4.152 -32.405 -36.104 1.00 0.00 H new ATOM 0 HH22 ARG A 47 4.947 -32.893 -37.604 1.00 0.00 H new ATOM 708 N VAL A 48 10.251 -29.209 -36.353 1.00 0.00 N ATOM 709 CA VAL A 48 11.071 -30.080 -35.528 1.00 0.00 C ATOM 710 C VAL A 48 12.188 -29.260 -34.880 1.00 0.00 C ATOM 711 O VAL A 48 12.308 -29.225 -33.657 1.00 0.00 O ATOM 712 CB VAL A 48 11.596 -31.250 -36.364 1.00 0.00 C ATOM 713 CG1 VAL A 48 12.570 -32.108 -35.554 1.00 0.00 C ATOM 714 CG2 VAL A 48 10.443 -32.095 -36.909 1.00 0.00 C ATOM 0 H VAL A 48 10.386 -29.322 -37.358 1.00 0.00 H new ATOM 0 HA VAL A 48 10.477 -30.513 -34.723 1.00 0.00 H new ATOM 0 HB VAL A 48 12.140 -30.838 -37.214 1.00 0.00 H new ATOM 0 HG11 VAL A 48 12.928 -32.932 -36.171 1.00 0.00 H new ATOM 0 HG12 VAL A 48 13.416 -31.498 -35.237 1.00 0.00 H new ATOM 0 HG13 VAL A 48 12.061 -32.506 -34.676 1.00 0.00 H new ATOM 0 HG21 VAL A 48 10.843 -32.919 -37.499 1.00 0.00 H new ATOM 0 HG22 VAL A 48 9.859 -32.493 -36.079 1.00 0.00 H new ATOM 0 HG23 VAL A 48 9.804 -31.476 -37.538 1.00 0.00 H new ATOM 724 N LYS A 49 12.977 -28.619 -35.730 1.00 0.00 N ATOM 725 CA LYS A 49 14.080 -27.801 -35.256 1.00 0.00 C ATOM 726 C LYS A 49 13.535 -26.689 -34.357 1.00 0.00 C ATOM 727 O LYS A 49 14.160 -26.330 -33.360 1.00 0.00 O ATOM 728 CB LYS A 49 14.911 -27.288 -36.434 1.00 0.00 C ATOM 729 CG LYS A 49 16.408 -27.430 -36.151 1.00 0.00 C ATOM 730 CD LYS A 49 16.999 -26.112 -35.646 1.00 0.00 C ATOM 731 CE LYS A 49 18.437 -26.305 -35.161 1.00 0.00 C ATOM 732 NZ LYS A 49 19.360 -25.425 -35.913 1.00 0.00 N ATOM 0 H LYS A 49 12.874 -28.650 -36.744 1.00 0.00 H new ATOM 0 HA LYS A 49 14.763 -28.396 -34.649 1.00 0.00 H new ATOM 0 HB2 LYS A 49 14.653 -27.844 -37.335 1.00 0.00 H new ATOM 0 HB3 LYS A 49 14.671 -26.242 -36.625 1.00 0.00 H new ATOM 0 HG2 LYS A 49 16.569 -28.212 -35.409 1.00 0.00 H new ATOM 0 HG3 LYS A 49 16.925 -27.740 -37.059 1.00 0.00 H new ATOM 0 HD2 LYS A 49 16.977 -25.370 -36.444 1.00 0.00 H new ATOM 0 HD3 LYS A 49 16.386 -25.723 -34.833 1.00 0.00 H new ATOM 0 HE2 LYS A 49 18.501 -26.083 -34.096 1.00 0.00 H new ATOM 0 HE3 LYS A 49 18.733 -27.346 -35.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 20.332 -25.568 -35.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 19.311 -25.656 -36.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 19.086 -24.432 -35.771 1.00 0.00 H new ATOM 745 N LYS A 50 12.376 -26.176 -34.742 1.00 0.00 N ATOM 746 CA LYS A 50 11.740 -25.113 -33.983 1.00 0.00 C ATOM 747 C LYS A 50 11.396 -25.626 -32.583 1.00 0.00 C ATOM 748 O LYS A 50 12.041 -25.251 -31.605 1.00 0.00 O ATOM 749 CB LYS A 50 10.537 -24.555 -34.746 1.00 0.00 C ATOM 750 CG LYS A 50 10.444 -23.036 -34.590 1.00 0.00 C ATOM 751 CD LYS A 50 9.016 -22.546 -34.836 1.00 0.00 C ATOM 752 CE LYS A 50 8.601 -22.771 -36.291 1.00 0.00 C ATOM 753 NZ LYS A 50 8.516 -24.219 -36.587 1.00 0.00 N ATOM 0 H LYS A 50 11.861 -26.477 -35.569 1.00 0.00 H new ATOM 0 HA LYS A 50 12.425 -24.274 -33.856 1.00 0.00 H new ATOM 0 HB2 LYS A 50 10.621 -24.811 -35.802 1.00 0.00 H new ATOM 0 HB3 LYS A 50 9.622 -25.018 -34.378 1.00 0.00 H new ATOM 0 HG2 LYS A 50 10.763 -22.750 -33.588 1.00 0.00 H new ATOM 0 HG3 LYS A 50 11.124 -22.553 -35.291 1.00 0.00 H new ATOM 0 HD2 LYS A 50 8.328 -23.071 -34.173 1.00 0.00 H new ATOM 0 HD3 LYS A 50 8.945 -21.486 -34.594 1.00 0.00 H new ATOM 0 HE2 LYS A 50 7.637 -22.298 -36.478 1.00 0.00 H new ATOM 0 HE3 LYS A 50 9.322 -22.299 -36.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 7.762 -24.387 -37.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 9.424 -24.548 -36.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 8.302 -24.740 -35.713 1.00 0.00 H new ATOM 766 N GLN A 51 10.381 -26.476 -32.532 1.00 0.00 N ATOM 767 CA GLN A 51 9.944 -27.045 -31.269 1.00 0.00 C ATOM 768 C GLN A 51 11.128 -27.677 -30.533 1.00 0.00 C ATOM 769 O GLN A 51 11.070 -27.889 -29.323 1.00 0.00 O ATOM 770 CB GLN A 51 8.825 -28.066 -31.485 1.00 0.00 C ATOM 771 CG GLN A 51 7.450 -27.405 -31.372 1.00 0.00 C ATOM 772 CD GLN A 51 7.096 -27.122 -29.910 1.00 0.00 C ATOM 773 OE1 GLN A 51 7.820 -26.459 -29.186 1.00 0.00 O ATOM 774 NE2 GLN A 51 5.945 -27.662 -29.519 1.00 0.00 N ATOM 0 H GLN A 51 9.849 -26.784 -33.346 1.00 0.00 H new ATOM 0 HA GLN A 51 9.544 -26.242 -30.651 1.00 0.00 H new ATOM 0 HB2 GLN A 51 8.932 -28.525 -32.468 1.00 0.00 H new ATOM 0 HB3 GLN A 51 8.910 -28.865 -30.749 1.00 0.00 H new ATOM 0 HG2 GLN A 51 7.443 -26.474 -31.939 1.00 0.00 H new ATOM 0 HG3 GLN A 51 6.693 -28.053 -31.814 1.00 0.00 H new ATOM 0 HE21 GLN A 51 5.387 -28.206 -30.177 1.00 0.00 H new ATOM 0 HE22 GLN A 51 5.620 -27.532 -28.561 1.00 0.00 H new ATOM 783 N GLN A 52 12.175 -27.959 -31.295 1.00 0.00 N ATOM 784 CA GLN A 52 13.370 -28.562 -30.730 1.00 0.00 C ATOM 785 C GLN A 52 14.159 -27.525 -29.928 1.00 0.00 C ATOM 786 O GLN A 52 14.585 -27.796 -28.806 1.00 0.00 O ATOM 787 CB GLN A 52 14.239 -29.185 -31.825 1.00 0.00 C ATOM 788 CG GLN A 52 15.620 -29.557 -31.283 1.00 0.00 C ATOM 789 CD GLN A 52 16.371 -30.458 -32.266 1.00 0.00 C ATOM 790 OE1 GLN A 52 16.175 -30.406 -33.469 1.00 0.00 O ATOM 791 NE2 GLN A 52 17.237 -31.285 -31.688 1.00 0.00 N ATOM 0 H GLN A 52 12.220 -27.781 -32.298 1.00 0.00 H new ATOM 0 HA GLN A 52 13.066 -29.361 -30.054 1.00 0.00 H new ATOM 0 HB2 GLN A 52 13.749 -30.074 -32.222 1.00 0.00 H new ATOM 0 HB3 GLN A 52 14.346 -28.484 -32.653 1.00 0.00 H new ATOM 0 HG2 GLN A 52 16.198 -28.652 -31.099 1.00 0.00 H new ATOM 0 HG3 GLN A 52 15.513 -30.067 -30.325 1.00 0.00 H new ATOM 0 HE21 GLN A 52 17.352 -31.276 -30.675 1.00 0.00 H new ATOM 0 HE22 GLN A 52 17.787 -31.928 -32.258 1.00 0.00 H new ATOM 800 N THR A 53 14.330 -26.360 -30.535 1.00 0.00 N ATOM 801 CA THR A 53 15.061 -25.281 -29.891 1.00 0.00 C ATOM 802 C THR A 53 14.142 -24.505 -28.945 1.00 0.00 C ATOM 803 O THR A 53 14.614 -23.809 -28.047 1.00 0.00 O ATOM 804 CB THR A 53 15.681 -24.411 -30.986 1.00 0.00 C ATOM 805 OG1 THR A 53 16.852 -23.871 -30.378 1.00 0.00 O ATOM 806 CG2 THR A 53 14.829 -23.182 -31.310 1.00 0.00 C ATOM 0 H THR A 53 13.975 -26.139 -31.465 1.00 0.00 H new ATOM 0 HA THR A 53 15.867 -25.666 -29.267 1.00 0.00 H new ATOM 0 HB THR A 53 15.818 -25.006 -31.889 1.00 0.00 H new ATOM 0 HG1 THR A 53 17.317 -23.294 -31.019 1.00 0.00 H new ATOM 0 HG21 THR A 53 15.314 -22.599 -32.093 1.00 0.00 H new ATOM 0 HG22 THR A 53 13.845 -23.502 -31.653 1.00 0.00 H new ATOM 0 HG23 THR A 53 14.720 -22.569 -30.416 1.00 0.00 H new ATOM 814 N VAL A 54 12.846 -24.650 -29.180 1.00 0.00 N ATOM 815 CA VAL A 54 11.857 -23.971 -28.360 1.00 0.00 C ATOM 816 C VAL A 54 11.544 -24.827 -27.131 1.00 0.00 C ATOM 817 O VAL A 54 11.514 -24.322 -26.010 1.00 0.00 O ATOM 818 CB VAL A 54 10.616 -23.650 -29.196 1.00 0.00 C ATOM 819 CG1 VAL A 54 9.614 -22.819 -28.393 1.00 0.00 C ATOM 820 CG2 VAL A 54 11.000 -22.940 -30.496 1.00 0.00 C ATOM 0 H VAL A 54 12.458 -25.227 -29.926 1.00 0.00 H new ATOM 0 HA VAL A 54 12.247 -23.019 -28.002 1.00 0.00 H new ATOM 0 HB VAL A 54 10.135 -24.593 -29.458 1.00 0.00 H new ATOM 0 HG11 VAL A 54 8.742 -22.605 -29.010 1.00 0.00 H new ATOM 0 HG12 VAL A 54 9.305 -23.376 -27.509 1.00 0.00 H new ATOM 0 HG13 VAL A 54 10.081 -21.883 -28.087 1.00 0.00 H new ATOM 0 HG21 VAL A 54 10.100 -22.723 -31.072 1.00 0.00 H new ATOM 0 HG22 VAL A 54 11.515 -22.008 -30.263 1.00 0.00 H new ATOM 0 HG23 VAL A 54 11.659 -23.582 -31.081 1.00 0.00 H new ATOM 830 N TYR A 55 11.320 -26.108 -27.384 1.00 0.00 N ATOM 831 CA TYR A 55 11.012 -27.039 -26.312 1.00 0.00 C ATOM 832 C TYR A 55 12.291 -27.587 -25.676 1.00 0.00 C ATOM 833 O TYR A 55 12.266 -28.079 -24.549 1.00 0.00 O ATOM 834 CB TYR A 55 10.246 -28.193 -26.963 1.00 0.00 C ATOM 835 CG TYR A 55 9.350 -28.970 -25.995 1.00 0.00 C ATOM 836 CD1 TYR A 55 8.122 -28.458 -25.630 1.00 0.00 C ATOM 837 CD2 TYR A 55 9.771 -30.182 -25.488 1.00 0.00 C ATOM 838 CE1 TYR A 55 7.279 -29.189 -24.720 1.00 0.00 C ATOM 839 CE2 TYR A 55 8.929 -30.913 -24.578 1.00 0.00 C ATOM 840 CZ TYR A 55 7.724 -30.381 -24.238 1.00 0.00 C ATOM 841 OH TYR A 55 6.929 -31.071 -23.378 1.00 0.00 O ATOM 0 H TYR A 55 11.346 -26.523 -28.315 1.00 0.00 H new ATOM 0 HA TYR A 55 10.438 -26.545 -25.528 1.00 0.00 H new ATOM 0 HB2 TYR A 55 9.632 -27.797 -27.772 1.00 0.00 H new ATOM 0 HB3 TYR A 55 10.961 -28.882 -27.413 1.00 0.00 H new ATOM 0 HD1 TYR A 55 7.793 -27.509 -26.027 1.00 0.00 H new ATOM 0 HD2 TYR A 55 10.732 -30.582 -25.774 1.00 0.00 H new ATOM 0 HE1 TYR A 55 6.315 -28.800 -24.427 1.00 0.00 H new ATOM 0 HE2 TYR A 55 9.247 -31.863 -24.174 1.00 0.00 H new ATOM 0 HH TYR A 55 7.375 -31.904 -23.117 1.00 0.00 H new ATOM 851 N GLY A 56 13.378 -27.483 -26.426 1.00 0.00 N ATOM 852 CA GLY A 56 14.664 -27.962 -25.950 1.00 0.00 C ATOM 853 C GLY A 56 15.022 -27.326 -24.605 1.00 0.00 C ATOM 854 O GLY A 56 15.338 -28.029 -23.646 1.00 0.00 O ATOM 0 H GLY A 56 13.394 -27.074 -27.360 1.00 0.00 H new ATOM 0 HA2 GLY A 56 14.637 -29.047 -25.848 1.00 0.00 H new ATOM 0 HA3 GLY A 56 15.437 -27.730 -26.683 1.00 0.00 H new ATOM 858 N PRO A 57 14.959 -25.968 -24.576 1.00 0.00 N ATOM 859 CA PRO A 57 15.272 -25.230 -23.364 1.00 0.00 C ATOM 860 C PRO A 57 14.136 -25.339 -22.346 1.00 0.00 C ATOM 861 O PRO A 57 14.368 -25.672 -21.185 1.00 0.00 O ATOM 862 CB PRO A 57 15.521 -23.803 -23.826 1.00 0.00 C ATOM 863 CG PRO A 57 14.886 -23.694 -25.203 1.00 0.00 C ATOM 864 CD PRO A 57 14.588 -25.103 -25.692 1.00 0.00 C ATOM 0 HA PRO A 57 16.145 -25.625 -22.845 1.00 0.00 H new ATOM 0 HB2 PRO A 57 15.079 -23.086 -23.134 1.00 0.00 H new ATOM 0 HB3 PRO A 57 16.589 -23.587 -23.870 1.00 0.00 H new ATOM 0 HG2 PRO A 57 13.970 -23.105 -25.155 1.00 0.00 H new ATOM 0 HG3 PRO A 57 15.558 -23.184 -25.894 1.00 0.00 H new ATOM 0 HD2 PRO A 57 13.535 -25.218 -25.950 1.00 0.00 H new ATOM 0 HD3 PRO A 57 15.163 -25.342 -26.587 1.00 0.00 H new ATOM 872 N LEU A 58 12.931 -25.052 -22.818 1.00 0.00 N ATOM 873 CA LEU A 58 11.758 -25.113 -21.963 1.00 0.00 C ATOM 874 C LEU A 58 11.195 -26.536 -21.979 1.00 0.00 C ATOM 875 O LEU A 58 9.980 -26.727 -21.970 1.00 0.00 O ATOM 876 CB LEU A 58 10.741 -24.045 -22.371 1.00 0.00 C ATOM 877 CG LEU A 58 9.947 -24.328 -23.648 1.00 0.00 C ATOM 878 CD1 LEU A 58 8.595 -24.967 -23.323 1.00 0.00 C ATOM 879 CD2 LEU A 58 9.794 -23.060 -24.490 1.00 0.00 C ATOM 0 H LEU A 58 12.742 -24.777 -23.782 1.00 0.00 H new ATOM 0 HA LEU A 58 12.026 -24.887 -20.931 1.00 0.00 H new ATOM 0 HB2 LEU A 58 10.036 -23.911 -21.551 1.00 0.00 H new ATOM 0 HB3 LEU A 58 11.268 -23.099 -22.496 1.00 0.00 H new ATOM 0 HG LEU A 58 10.507 -25.047 -24.246 1.00 0.00 H new ATOM 0 HD11 LEU A 58 8.051 -25.158 -24.248 1.00 0.00 H new ATOM 0 HD12 LEU A 58 8.754 -25.907 -22.795 1.00 0.00 H new ATOM 0 HD13 LEU A 58 8.015 -24.292 -22.694 1.00 0.00 H new ATOM 0 HD21 LEU A 58 9.226 -23.288 -25.392 1.00 0.00 H new ATOM 0 HD22 LEU A 58 9.267 -22.301 -23.912 1.00 0.00 H new ATOM 0 HD23 LEU A 58 10.780 -22.686 -24.767 1.00 0.00 H new ATOM 891 N MET A 59 12.106 -27.498 -22.001 1.00 0.00 N ATOM 892 CA MET A 59 11.716 -28.898 -22.018 1.00 0.00 C ATOM 893 C MET A 59 11.435 -29.406 -20.603 1.00 0.00 C ATOM 894 O MET A 59 10.497 -30.173 -20.389 1.00 0.00 O ATOM 895 CB MET A 59 12.833 -29.732 -22.647 1.00 0.00 C ATOM 896 CG MET A 59 12.272 -30.708 -23.684 1.00 0.00 C ATOM 897 SD MET A 59 12.813 -32.368 -23.315 1.00 0.00 S ATOM 898 CE MET A 59 11.487 -32.895 -22.242 1.00 0.00 C ATOM 0 H MET A 59 13.113 -27.336 -22.007 1.00 0.00 H new ATOM 0 HA MET A 59 10.804 -28.994 -22.606 1.00 0.00 H new ATOM 0 HB2 MET A 59 13.562 -29.073 -23.119 1.00 0.00 H new ATOM 0 HB3 MET A 59 13.360 -30.285 -21.870 1.00 0.00 H new ATOM 0 HG2 MET A 59 11.183 -30.664 -23.686 1.00 0.00 H new ATOM 0 HG3 MET A 59 12.604 -30.422 -24.682 1.00 0.00 H new ATOM 0 HE1 MET A 59 11.896 -33.191 -21.276 1.00 0.00 H new ATOM 0 HE2 MET A 59 10.784 -32.074 -22.102 1.00 0.00 H new ATOM 0 HE3 MET A 59 10.970 -33.742 -22.692 1.00 0.00 H new ATOM 908 N GLU A 60 12.264 -28.957 -19.672 1.00 0.00 N ATOM 909 CA GLU A 60 12.116 -29.356 -18.282 1.00 0.00 C ATOM 910 C GLU A 60 10.872 -28.707 -17.673 1.00 0.00 C ATOM 911 O GLU A 60 9.918 -29.398 -17.316 1.00 0.00 O ATOM 912 CB GLU A 60 13.368 -29.006 -17.475 1.00 0.00 C ATOM 913 CG GLU A 60 14.362 -30.169 -17.475 1.00 0.00 C ATOM 914 CD GLU A 60 13.872 -31.309 -16.579 1.00 0.00 C ATOM 915 OE1 GLU A 60 13.261 -32.267 -17.075 1.00 0.00 O ATOM 916 OE2 GLU A 60 14.148 -31.175 -15.326 1.00 0.00 O ATOM 0 H GLU A 60 13.040 -28.321 -19.853 1.00 0.00 H new ATOM 0 HA GLU A 60 11.991 -30.438 -18.246 1.00 0.00 H new ATOM 0 HB2 GLU A 60 13.841 -28.119 -17.896 1.00 0.00 H new ATOM 0 HB3 GLU A 60 13.088 -28.762 -16.450 1.00 0.00 H new ATOM 0 HG2 GLU A 60 14.499 -30.535 -18.493 1.00 0.00 H new ATOM 0 HG3 GLU A 60 15.335 -29.821 -17.127 1.00 0.00 H new ATOM 924 N TYR A 61 10.921 -27.387 -17.572 1.00 0.00 N ATOM 925 CA TYR A 61 9.810 -26.637 -17.012 1.00 0.00 C ATOM 926 C TYR A 61 8.470 -27.238 -17.443 1.00 0.00 C ATOM 927 O TYR A 61 7.564 -27.394 -16.626 1.00 0.00 O ATOM 928 CB TYR A 61 9.927 -25.222 -17.581 1.00 0.00 C ATOM 929 CG TYR A 61 9.563 -24.118 -16.585 1.00 0.00 C ATOM 930 CD1 TYR A 61 8.257 -23.972 -16.163 1.00 0.00 C ATOM 931 CD2 TYR A 61 10.542 -23.270 -16.109 1.00 0.00 C ATOM 932 CE1 TYR A 61 7.916 -22.934 -15.226 1.00 0.00 C ATOM 933 CE2 TYR A 61 10.200 -22.232 -15.171 1.00 0.00 C ATOM 934 CZ TYR A 61 8.904 -22.115 -14.776 1.00 0.00 C ATOM 935 OH TYR A 61 8.581 -21.134 -13.891 1.00 0.00 O ATOM 0 H TYR A 61 11.713 -26.817 -17.869 1.00 0.00 H new ATOM 0 HA TYR A 61 9.846 -26.654 -15.923 1.00 0.00 H new ATOM 0 HB2 TYR A 61 10.949 -25.064 -17.926 1.00 0.00 H new ATOM 0 HB3 TYR A 61 9.279 -25.138 -18.454 1.00 0.00 H new ATOM 0 HD1 TYR A 61 7.491 -24.636 -16.536 1.00 0.00 H new ATOM 0 HD2 TYR A 61 11.564 -23.385 -16.440 1.00 0.00 H new ATOM 0 HE1 TYR A 61 6.898 -22.808 -14.888 1.00 0.00 H new ATOM 0 HE2 TYR A 61 10.956 -21.561 -14.790 1.00 0.00 H new ATOM 0 HH TYR A 61 9.386 -20.627 -13.656 1.00 0.00 H new ATOM 945 N ILE A 62 8.387 -27.559 -18.726 1.00 0.00 N ATOM 946 CA ILE A 62 7.174 -28.140 -19.275 1.00 0.00 C ATOM 947 C ILE A 62 6.991 -29.552 -18.717 1.00 0.00 C ATOM 948 O ILE A 62 5.903 -29.911 -18.270 1.00 0.00 O ATOM 949 CB ILE A 62 7.196 -28.080 -20.804 1.00 0.00 C ATOM 950 CG1 ILE A 62 6.602 -26.764 -21.310 1.00 0.00 C ATOM 951 CG2 ILE A 62 6.493 -29.297 -21.410 1.00 0.00 C ATOM 952 CD1 ILE A 62 7.023 -25.594 -20.419 1.00 0.00 C ATOM 0 H ILE A 62 9.140 -27.428 -19.401 1.00 0.00 H new ATOM 0 HA ILE A 62 6.302 -27.562 -18.969 1.00 0.00 H new ATOM 0 HB ILE A 62 8.235 -28.111 -21.132 1.00 0.00 H new ATOM 0 HG12 ILE A 62 6.930 -26.583 -22.334 1.00 0.00 H new ATOM 0 HG13 ILE A 62 5.515 -26.836 -21.332 1.00 0.00 H new ATOM 0 HG21 ILE A 62 6.523 -29.230 -22.498 1.00 0.00 H new ATOM 0 HG22 ILE A 62 6.999 -30.207 -21.089 1.00 0.00 H new ATOM 0 HG23 ILE A 62 5.456 -29.322 -21.076 1.00 0.00 H new ATOM 0 HD11 ILE A 62 6.587 -24.671 -20.801 1.00 0.00 H new ATOM 0 HD12 ILE A 62 6.672 -25.767 -19.402 1.00 0.00 H new ATOM 0 HD13 ILE A 62 8.110 -25.509 -20.419 1.00 0.00 H new ATOM 964 N ALA A 63 8.073 -30.316 -18.761 1.00 0.00 N ATOM 965 CA ALA A 63 8.046 -31.682 -18.265 1.00 0.00 C ATOM 966 C ALA A 63 7.274 -31.725 -16.946 1.00 0.00 C ATOM 967 O ALA A 63 6.435 -32.602 -16.742 1.00 0.00 O ATOM 968 CB ALA A 63 9.478 -32.200 -18.120 1.00 0.00 C ATOM 0 H ALA A 63 8.974 -30.015 -19.133 1.00 0.00 H new ATOM 0 HA ALA A 63 7.532 -32.337 -18.969 1.00 0.00 H new ATOM 0 HB1 ALA A 63 9.458 -33.224 -17.748 1.00 0.00 H new ATOM 0 HB2 ALA A 63 9.974 -32.176 -19.090 1.00 0.00 H new ATOM 0 HB3 ALA A 63 10.024 -31.569 -17.418 1.00 0.00 H new ATOM 974 N ASP A 64 7.584 -30.768 -16.083 1.00 0.00 N ATOM 975 CA ASP A 64 6.929 -30.686 -14.789 1.00 0.00 C ATOM 976 C ASP A 64 5.524 -30.109 -14.968 1.00 0.00 C ATOM 977 O ASP A 64 4.584 -30.533 -14.298 1.00 0.00 O ATOM 978 CB ASP A 64 7.700 -29.768 -13.839 1.00 0.00 C ATOM 979 CG ASP A 64 8.437 -30.483 -12.704 1.00 0.00 C ATOM 980 OD1 ASP A 64 9.659 -30.341 -12.547 1.00 0.00 O ATOM 981 OD2 ASP A 64 7.694 -31.222 -11.952 1.00 0.00 O ATOM 0 H ASP A 64 8.280 -30.043 -16.255 1.00 0.00 H new ATOM 0 HA ASP A 64 6.889 -31.690 -14.367 1.00 0.00 H new ATOM 0 HB2 ASP A 64 8.425 -29.196 -14.419 1.00 0.00 H new ATOM 0 HB3 ASP A 64 7.003 -29.052 -13.405 1.00 0.00 H new ATOM 987 N ASN A 65 5.425 -29.149 -15.877 1.00 0.00 N ATOM 988 CA ASN A 65 4.150 -28.509 -16.153 1.00 0.00 C ATOM 989 C ASN A 65 3.149 -29.561 -16.633 1.00 0.00 C ATOM 990 O ASN A 65 1.943 -29.321 -16.633 1.00 0.00 O ATOM 991 CB ASN A 65 4.291 -27.453 -17.251 1.00 0.00 C ATOM 992 CG ASN A 65 3.178 -26.408 -17.153 1.00 0.00 C ATOM 993 OD1 ASN A 65 3.416 -25.227 -16.959 1.00 0.00 O ATOM 994 ND2 ASN A 65 1.953 -26.906 -17.296 1.00 0.00 N ATOM 0 H ASN A 65 6.207 -28.799 -16.431 1.00 0.00 H new ATOM 0 HA ASN A 65 3.806 -28.031 -15.235 1.00 0.00 H new ATOM 0 HB2 ASN A 65 5.262 -26.964 -17.168 1.00 0.00 H new ATOM 0 HB3 ASN A 65 4.259 -27.933 -18.229 1.00 0.00 H new ATOM 0 HD21 ASN A 65 1.142 -26.289 -17.246 1.00 0.00 H new ATOM 0 HD22 ASN A 65 1.824 -27.905 -17.456 1.00 0.00 H new ATOM 1001 N ARG A 66 3.687 -30.705 -17.032 1.00 0.00 N ATOM 1002 CA ARG A 66 2.856 -31.795 -17.514 1.00 0.00 C ATOM 1003 C ARG A 66 1.495 -31.775 -16.814 1.00 0.00 C ATOM 1004 O ARG A 66 0.470 -32.053 -17.433 1.00 0.00 O ATOM 1005 CB ARG A 66 3.527 -33.148 -17.271 1.00 0.00 C ATOM 1006 CG ARG A 66 4.213 -33.656 -18.540 1.00 0.00 C ATOM 1007 CD ARG A 66 3.195 -34.259 -19.510 1.00 0.00 C ATOM 1008 NE ARG A 66 3.441 -33.755 -20.880 1.00 0.00 N ATOM 1009 CZ ARG A 66 2.730 -34.131 -21.964 1.00 0.00 C ATOM 1010 NH1 ARG A 66 1.720 -35.020 -21.846 1.00 0.00 N ATOM 1011 NH2 ARG A 66 3.036 -33.617 -23.141 1.00 0.00 N ATOM 0 H ARG A 66 4.688 -30.900 -17.031 1.00 0.00 H new ATOM 0 HA ARG A 66 2.719 -31.658 -18.587 1.00 0.00 H new ATOM 0 HB2 ARG A 66 4.260 -33.056 -16.469 1.00 0.00 H new ATOM 0 HB3 ARG A 66 2.783 -33.873 -16.941 1.00 0.00 H new ATOM 0 HG2 ARG A 66 4.741 -32.835 -19.025 1.00 0.00 H new ATOM 0 HG3 ARG A 66 4.960 -34.406 -18.279 1.00 0.00 H new ATOM 0 HD2 ARG A 66 3.266 -35.347 -19.495 1.00 0.00 H new ATOM 0 HD3 ARG A 66 2.184 -34.002 -19.195 1.00 0.00 H new ATOM 0 HE ARG A 66 4.195 -33.081 -21.013 1.00 0.00 H new ATOM 0 HH11 ARG A 66 1.490 -35.412 -20.933 1.00 0.00 H new ATOM 0 HH12 ARG A 66 1.187 -35.299 -22.670 1.00 0.00 H new ATOM 0 HH21 ARG A 66 3.800 -32.946 -23.221 1.00 0.00 H new ATOM 0 HH22 ARG A 66 2.508 -33.891 -23.970 1.00 0.00 H new ATOM 1024 N ILE A 67 1.530 -31.442 -15.531 1.00 0.00 N ATOM 1025 CA ILE A 67 0.313 -31.382 -14.740 1.00 0.00 C ATOM 1026 C ILE A 67 -0.825 -30.835 -15.604 1.00 0.00 C ATOM 1027 O ILE A 67 -1.980 -31.225 -15.436 1.00 0.00 O ATOM 1028 CB ILE A 67 0.547 -30.585 -13.456 1.00 0.00 C ATOM 1029 CG1 ILE A 67 -0.561 -30.852 -12.435 1.00 0.00 C ATOM 1030 CG2 ILE A 67 0.703 -29.093 -13.757 1.00 0.00 C ATOM 1031 CD1 ILE A 67 -0.241 -30.190 -11.093 1.00 0.00 C ATOM 0 H ILE A 67 2.382 -31.211 -15.020 1.00 0.00 H new ATOM 0 HA ILE A 67 0.018 -32.381 -14.418 1.00 0.00 H new ATOM 0 HB ILE A 67 1.483 -30.922 -13.010 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -1.510 -30.472 -12.815 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -0.681 -31.926 -12.295 1.00 0.00 H new ATOM 0 HG21 ILE A 67 0.868 -28.549 -12.827 1.00 0.00 H new ATOM 0 HG22 ILE A 67 1.554 -28.943 -14.421 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -0.202 -28.722 -14.238 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -1.044 -30.395 -10.385 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.696 -30.589 -10.704 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -0.146 -29.113 -11.232 1.00 0.00 H new ATOM 1043 N HIS A 68 -0.460 -29.940 -16.511 1.00 0.00 N ATOM 1044 CA HIS A 68 -1.436 -29.336 -17.401 1.00 0.00 C ATOM 1045 C HIS A 68 -1.049 -29.619 -18.854 1.00 0.00 C ATOM 1046 O HIS A 68 -0.499 -30.676 -19.160 1.00 0.00 O ATOM 1047 CB HIS A 68 -1.587 -27.842 -17.108 1.00 0.00 C ATOM 1048 CG HIS A 68 -1.727 -27.515 -15.640 1.00 0.00 C ATOM 1049 ND1 HIS A 68 -1.028 -26.488 -15.030 1.00 0.00 N ATOM 1050 CD2 HIS A 68 -2.494 -28.090 -14.669 1.00 0.00 C ATOM 1051 CE1 HIS A 68 -1.366 -26.456 -13.750 1.00 0.00 C ATOM 1052 NE2 HIS A 68 -2.273 -27.449 -13.527 1.00 0.00 N ATOM 0 H HIS A 68 0.498 -29.619 -16.648 1.00 0.00 H new ATOM 0 HA HIS A 68 -2.416 -29.782 -17.229 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -0.720 -27.315 -17.506 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -2.461 -27.465 -17.639 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -3.166 -28.924 -14.806 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -0.989 -25.764 -13.012 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -2.710 -27.664 -12.631 1.00 0.00 H new ATOM 1060 N ALA A 69 -1.351 -28.655 -19.712 1.00 0.00 N ATOM 1061 CA ALA A 69 -1.042 -28.787 -21.125 1.00 0.00 C ATOM 1062 C ALA A 69 -0.696 -27.411 -21.698 1.00 0.00 C ATOM 1063 O ALA A 69 -1.555 -26.738 -22.266 1.00 0.00 O ATOM 1064 CB ALA A 69 -2.222 -29.439 -21.848 1.00 0.00 C ATOM 0 H ALA A 69 -1.807 -27.779 -19.455 1.00 0.00 H new ATOM 0 HA ALA A 69 -0.175 -29.432 -21.269 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -1.989 -29.538 -22.908 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.408 -30.426 -21.424 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -3.110 -28.819 -21.728 1.00 0.00 H new ATOM 1070 N VAL A 70 0.563 -27.034 -21.529 1.00 0.00 N ATOM 1071 CA VAL A 70 1.032 -25.750 -22.022 1.00 0.00 C ATOM 1072 C VAL A 70 1.874 -25.969 -23.280 1.00 0.00 C ATOM 1073 O VAL A 70 3.079 -26.197 -23.194 1.00 0.00 O ATOM 1074 CB VAL A 70 1.790 -25.011 -20.917 1.00 0.00 C ATOM 1075 CG1 VAL A 70 0.902 -24.803 -19.688 1.00 0.00 C ATOM 1076 CG2 VAL A 70 3.077 -25.750 -20.546 1.00 0.00 C ATOM 0 H VAL A 70 1.273 -27.595 -21.058 1.00 0.00 H new ATOM 0 HA VAL A 70 0.190 -25.117 -22.300 1.00 0.00 H new ATOM 0 HB VAL A 70 2.067 -24.029 -21.300 1.00 0.00 H new ATOM 0 HG11 VAL A 70 1.465 -24.276 -18.918 1.00 0.00 H new ATOM 0 HG12 VAL A 70 0.028 -24.214 -19.966 1.00 0.00 H new ATOM 0 HG13 VAL A 70 0.580 -25.771 -19.304 1.00 0.00 H new ATOM 0 HG21 VAL A 70 3.596 -25.204 -19.759 1.00 0.00 H new ATOM 0 HG22 VAL A 70 2.832 -26.751 -20.192 1.00 0.00 H new ATOM 0 HG23 VAL A 70 3.721 -25.822 -21.423 1.00 0.00 H new ATOM 1086 N SER A 71 1.205 -25.892 -24.422 1.00 0.00 N ATOM 1087 CA SER A 71 1.876 -26.079 -25.697 1.00 0.00 C ATOM 1088 C SER A 71 2.686 -24.830 -26.049 1.00 0.00 C ATOM 1089 O SER A 71 2.379 -23.734 -25.583 1.00 0.00 O ATOM 1090 CB SER A 71 0.871 -26.391 -26.807 1.00 0.00 C ATOM 1091 OG SER A 71 0.022 -27.484 -26.467 1.00 0.00 O ATOM 0 H SER A 71 0.205 -25.703 -24.490 1.00 0.00 H new ATOM 0 HA SER A 71 2.552 -26.929 -25.607 1.00 0.00 H new ATOM 0 HB2 SER A 71 0.263 -25.508 -27.005 1.00 0.00 H new ATOM 0 HB3 SER A 71 1.407 -26.621 -27.727 1.00 0.00 H new ATOM 0 HG SER A 71 -0.606 -27.651 -27.200 1.00 0.00 H new ATOM 1097 N ILE A 72 3.705 -25.037 -26.871 1.00 0.00 N ATOM 1098 CA ILE A 72 4.562 -23.941 -27.291 1.00 0.00 C ATOM 1099 C ILE A 72 4.988 -24.161 -28.744 1.00 0.00 C ATOM 1100 O ILE A 72 5.607 -25.174 -29.066 1.00 0.00 O ATOM 1101 CB ILE A 72 5.736 -23.777 -26.324 1.00 0.00 C ATOM 1102 CG1 ILE A 72 5.919 -22.310 -25.928 1.00 0.00 C ATOM 1103 CG2 ILE A 72 7.016 -24.376 -26.909 1.00 0.00 C ATOM 1104 CD1 ILE A 72 6.220 -22.179 -24.433 1.00 0.00 C ATOM 0 H ILE A 72 3.956 -25.947 -27.257 1.00 0.00 H new ATOM 0 HA ILE A 72 4.018 -22.997 -27.257 1.00 0.00 H new ATOM 0 HB ILE A 72 5.508 -24.331 -25.413 1.00 0.00 H new ATOM 0 HG12 ILE A 72 6.733 -21.872 -26.506 1.00 0.00 H new ATOM 0 HG13 ILE A 72 5.017 -21.749 -26.172 1.00 0.00 H new ATOM 0 HG21 ILE A 72 7.835 -24.246 -26.202 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.866 -25.439 -27.100 1.00 0.00 H new ATOM 0 HG23 ILE A 72 7.260 -23.871 -27.843 1.00 0.00 H new ATOM 0 HD11 ILE A 72 6.346 -21.127 -24.178 1.00 0.00 H new ATOM 0 HD12 ILE A 72 5.393 -22.596 -23.858 1.00 0.00 H new ATOM 0 HD13 ILE A 72 7.136 -22.721 -24.197 1.00 0.00 H new ATOM 1116 N LYS A 73 4.639 -23.196 -29.583 1.00 0.00 N ATOM 1117 CA LYS A 73 4.978 -23.273 -30.993 1.00 0.00 C ATOM 1118 C LYS A 73 5.279 -21.867 -31.518 1.00 0.00 C ATOM 1119 O LYS A 73 4.436 -20.975 -31.432 1.00 0.00 O ATOM 1120 CB LYS A 73 3.877 -23.996 -31.771 1.00 0.00 C ATOM 1121 CG LYS A 73 4.325 -25.402 -32.177 1.00 0.00 C ATOM 1122 CD LYS A 73 3.196 -26.416 -31.979 1.00 0.00 C ATOM 1123 CE LYS A 73 3.691 -27.842 -32.229 1.00 0.00 C ATOM 1124 NZ LYS A 73 2.862 -28.504 -33.260 1.00 0.00 N ATOM 0 H LYS A 73 4.125 -22.357 -29.313 1.00 0.00 H new ATOM 0 HA LYS A 73 5.880 -23.868 -31.135 1.00 0.00 H new ATOM 0 HB2 LYS A 73 2.977 -24.060 -31.160 1.00 0.00 H new ATOM 0 HB3 LYS A 73 3.618 -23.422 -32.661 1.00 0.00 H new ATOM 0 HG2 LYS A 73 4.638 -25.400 -33.221 1.00 0.00 H new ATOM 0 HG3 LYS A 73 5.191 -25.697 -31.585 1.00 0.00 H new ATOM 0 HD2 LYS A 73 2.804 -26.336 -30.965 1.00 0.00 H new ATOM 0 HD3 LYS A 73 2.374 -26.188 -32.658 1.00 0.00 H new ATOM 0 HE2 LYS A 73 4.733 -27.821 -32.550 1.00 0.00 H new ATOM 0 HE3 LYS A 73 3.654 -28.414 -31.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 3.211 -29.471 -33.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 1.873 -28.541 -32.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 2.918 -27.966 -34.148 1.00 0.00 H new ATOM 1137 N ALA A 74 6.482 -21.713 -32.050 1.00 0.00 N ATOM 1138 CA ALA A 74 6.905 -20.432 -32.588 1.00 0.00 C ATOM 1139 C ALA A 74 6.372 -20.282 -34.015 1.00 0.00 C ATOM 1140 O ALA A 74 6.861 -20.935 -34.935 1.00 0.00 O ATOM 1141 CB ALA A 74 8.430 -20.327 -32.521 1.00 0.00 C ATOM 0 H ALA A 74 7.178 -22.455 -32.120 1.00 0.00 H new ATOM 0 HA ALA A 74 6.496 -19.614 -31.995 1.00 0.00 H new ATOM 0 HB1 ALA A 74 8.747 -19.365 -32.925 1.00 0.00 H new ATOM 0 HB2 ALA A 74 8.755 -20.410 -31.484 1.00 0.00 H new ATOM 0 HB3 ALA A 74 8.876 -21.131 -33.106 1.00 0.00 H new ATOM 1147 N TYR A 75 5.377 -19.418 -34.153 1.00 0.00 N ATOM 1148 CA TYR A 75 4.773 -19.175 -35.452 1.00 0.00 C ATOM 1149 C TYR A 75 4.579 -17.676 -35.694 1.00 0.00 C ATOM 1150 O TYR A 75 4.951 -16.855 -34.857 1.00 0.00 O ATOM 1151 CB TYR A 75 3.404 -19.855 -35.415 1.00 0.00 C ATOM 1152 CG TYR A 75 3.456 -21.370 -35.622 1.00 0.00 C ATOM 1153 CD1 TYR A 75 4.281 -21.906 -36.590 1.00 0.00 C ATOM 1154 CD2 TYR A 75 2.678 -22.201 -34.841 1.00 0.00 C ATOM 1155 CE1 TYR A 75 4.330 -23.332 -36.784 1.00 0.00 C ATOM 1156 CE2 TYR A 75 2.727 -23.627 -35.036 1.00 0.00 C ATOM 1157 CZ TYR A 75 3.550 -24.122 -35.998 1.00 0.00 C ATOM 1158 OH TYR A 75 3.596 -25.469 -36.182 1.00 0.00 O ATOM 0 H TYR A 75 4.974 -18.878 -33.387 1.00 0.00 H new ATOM 0 HA TYR A 75 5.409 -19.560 -36.249 1.00 0.00 H new ATOM 0 HB2 TYR A 75 2.932 -19.646 -34.455 1.00 0.00 H new ATOM 0 HB3 TYR A 75 2.770 -19.415 -36.185 1.00 0.00 H new ATOM 0 HD1 TYR A 75 4.889 -21.256 -37.202 1.00 0.00 H new ATOM 0 HD2 TYR A 75 2.032 -21.782 -34.084 1.00 0.00 H new ATOM 0 HE1 TYR A 75 4.972 -23.765 -37.537 1.00 0.00 H new ATOM 0 HE2 TYR A 75 2.124 -24.288 -34.432 1.00 0.00 H new ATOM 0 HH TYR A 75 2.988 -25.906 -35.550 1.00 0.00 H new ATOM 1168 N THR A 76 3.995 -17.366 -36.842 1.00 0.00 N ATOM 1169 CA THR A 76 3.746 -15.981 -37.205 1.00 0.00 C ATOM 1170 C THR A 76 2.419 -15.505 -36.612 1.00 0.00 C ATOM 1171 O THR A 76 1.731 -16.264 -35.932 1.00 0.00 O ATOM 1172 CB THR A 76 3.804 -15.874 -38.730 1.00 0.00 C ATOM 1173 OG1 THR A 76 2.463 -16.118 -39.146 1.00 0.00 O ATOM 1174 CG2 THR A 76 4.606 -17.011 -39.367 1.00 0.00 C ATOM 0 H THR A 76 3.687 -18.050 -37.533 1.00 0.00 H new ATOM 0 HA THR A 76 4.507 -15.320 -36.790 1.00 0.00 H new ATOM 0 HB THR A 76 4.246 -14.918 -39.010 1.00 0.00 H new ATOM 0 HG1 THR A 76 2.409 -16.066 -40.123 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.616 -16.887 -40.450 1.00 0.00 H new ATOM 0 HG22 THR A 76 5.629 -16.990 -38.990 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.146 -17.966 -39.115 1.00 0.00 H new ATOM 1182 N PRO A 77 2.090 -14.217 -36.899 1.00 0.00 N ATOM 1183 CA PRO A 77 0.857 -13.630 -36.402 1.00 0.00 C ATOM 1184 C PRO A 77 -0.351 -14.149 -37.184 1.00 0.00 C ATOM 1185 O PRO A 77 -1.416 -14.372 -36.611 1.00 0.00 O ATOM 1186 CB PRO A 77 1.053 -12.129 -36.539 1.00 0.00 C ATOM 1187 CG PRO A 77 2.190 -11.945 -37.531 1.00 0.00 C ATOM 1188 CD PRO A 77 2.881 -13.288 -37.702 1.00 0.00 C ATOM 0 HA PRO A 77 0.651 -13.898 -35.366 1.00 0.00 H new ATOM 0 HB2 PRO A 77 0.142 -11.647 -36.895 1.00 0.00 H new ATOM 0 HB3 PRO A 77 1.297 -11.678 -35.577 1.00 0.00 H new ATOM 0 HG2 PRO A 77 1.808 -11.588 -38.487 1.00 0.00 H new ATOM 0 HG3 PRO A 77 2.895 -11.196 -37.169 1.00 0.00 H new ATOM 0 HD2 PRO A 77 2.905 -13.591 -38.749 1.00 0.00 H new ATOM 0 HD3 PRO A 77 3.915 -13.248 -37.358 1.00 0.00 H new ATOM 1196 N ALA A 78 -0.145 -14.326 -38.481 1.00 0.00 N ATOM 1197 CA ALA A 78 -1.204 -14.814 -39.347 1.00 0.00 C ATOM 1198 C ALA A 78 -1.268 -16.340 -39.257 1.00 0.00 C ATOM 1199 O ALA A 78 -2.306 -16.939 -39.532 1.00 0.00 O ATOM 1200 CB ALA A 78 -0.961 -14.325 -40.776 1.00 0.00 C ATOM 0 H ALA A 78 0.740 -14.140 -38.953 1.00 0.00 H new ATOM 0 HA ALA A 78 -2.170 -14.424 -39.028 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -1.756 -14.691 -41.426 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -0.953 -13.235 -40.791 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -0.001 -14.700 -41.130 1.00 0.00 H new ATOM 1206 N GLU A 79 -0.144 -16.926 -38.871 1.00 0.00 N ATOM 1207 CA GLU A 79 -0.059 -18.371 -38.741 1.00 0.00 C ATOM 1208 C GLU A 79 -1.042 -18.867 -37.678 1.00 0.00 C ATOM 1209 O GLU A 79 -1.556 -19.980 -37.774 1.00 0.00 O ATOM 1210 CB GLU A 79 1.370 -18.809 -38.413 1.00 0.00 C ATOM 1211 CG GLU A 79 1.480 -20.334 -38.373 1.00 0.00 C ATOM 1212 CD GLU A 79 1.811 -20.896 -39.758 1.00 0.00 C ATOM 1213 OE1 GLU A 79 2.772 -20.444 -40.397 1.00 0.00 O ATOM 1214 OE2 GLU A 79 1.028 -21.837 -40.165 1.00 0.00 O ATOM 0 H GLU A 79 0.716 -16.426 -38.644 1.00 0.00 H new ATOM 0 HA GLU A 79 -0.331 -18.819 -39.697 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.057 -18.411 -39.160 1.00 0.00 H new ATOM 0 HB3 GLU A 79 1.670 -18.394 -37.451 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.253 -20.628 -37.663 1.00 0.00 H new ATOM 0 HG3 GLU A 79 0.542 -20.761 -38.018 1.00 0.00 H new ATOM 1222 N TRP A 80 -1.275 -18.016 -36.690 1.00 0.00 N ATOM 1223 CA TRP A 80 -2.187 -18.353 -35.610 1.00 0.00 C ATOM 1224 C TRP A 80 -3.585 -18.523 -36.209 1.00 0.00 C ATOM 1225 O TRP A 80 -4.060 -19.645 -36.377 1.00 0.00 O ATOM 1226 CB TRP A 80 -2.136 -17.302 -34.500 1.00 0.00 C ATOM 1227 CG TRP A 80 -2.071 -17.890 -33.089 1.00 0.00 C ATOM 1228 CD1 TRP A 80 -1.505 -17.357 -31.998 1.00 0.00 C ATOM 1229 CD2 TRP A 80 -2.617 -19.155 -32.659 1.00 0.00 C ATOM 1230 NE1 TRP A 80 -1.646 -18.181 -30.900 1.00 0.00 N ATOM 1231 CE2 TRP A 80 -2.344 -19.310 -31.315 1.00 0.00 C ATOM 1232 CE3 TRP A 80 -3.319 -20.136 -33.381 1.00 0.00 C ATOM 1233 CZ2 TRP A 80 -2.736 -20.433 -30.577 1.00 0.00 C ATOM 1234 CZ3 TRP A 80 -3.703 -21.253 -32.629 1.00 0.00 C ATOM 1235 CH2 TRP A 80 -3.436 -21.423 -31.276 1.00 0.00 C ATOM 0 H TRP A 80 -0.848 -17.093 -36.615 1.00 0.00 H new ATOM 0 HA TRP A 80 -1.894 -19.290 -35.136 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -1.266 -16.664 -34.657 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -3.017 -16.664 -34.577 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -1.001 -16.402 -31.980 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -1.302 -17.996 -29.958 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -3.544 -20.036 -34.432 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -2.511 -20.530 -29.525 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -4.245 -22.038 -33.136 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -3.767 -22.315 -30.766 1.00 0.00 H new ATOM 1246 N ALA A 81 -4.204 -17.392 -36.514 1.00 0.00 N ATOM 1247 CA ALA A 81 -5.538 -17.402 -37.090 1.00 0.00 C ATOM 1248 C ALA A 81 -5.650 -18.557 -38.087 1.00 0.00 C ATOM 1249 O ALA A 81 -6.598 -19.339 -38.033 1.00 0.00 O ATOM 1250 CB ALA A 81 -5.825 -16.045 -37.736 1.00 0.00 C ATOM 0 H ALA A 81 -3.807 -16.463 -36.373 1.00 0.00 H new ATOM 0 HA ALA A 81 -6.289 -17.561 -36.316 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -6.826 -16.052 -38.168 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -5.762 -15.262 -36.981 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -5.093 -15.853 -38.520 1.00 0.00 H new ATOM 1256 N ARG A 82 -4.669 -18.628 -38.975 1.00 0.00 N ATOM 1257 CA ARG A 82 -4.646 -19.674 -39.982 1.00 0.00 C ATOM 1258 C ARG A 82 -4.640 -21.052 -39.317 1.00 0.00 C ATOM 1259 O ARG A 82 -5.318 -21.970 -39.776 1.00 0.00 O ATOM 1260 CB ARG A 82 -3.415 -19.545 -40.882 1.00 0.00 C ATOM 1261 CG ARG A 82 -3.559 -20.410 -42.136 1.00 0.00 C ATOM 1262 CD ARG A 82 -2.262 -20.419 -42.948 1.00 0.00 C ATOM 1263 NE ARG A 82 -2.566 -20.612 -44.384 1.00 0.00 N ATOM 1264 CZ ARG A 82 -1.719 -20.293 -45.386 1.00 0.00 C ATOM 1265 NH1 ARG A 82 -0.508 -19.761 -45.116 1.00 0.00 N ATOM 1266 NH2 ARG A 82 -2.094 -20.508 -46.633 1.00 0.00 N ATOM 0 H ARG A 82 -3.884 -17.978 -39.018 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.542 -19.565 -40.593 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -3.278 -18.502 -41.169 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.524 -19.844 -40.330 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -3.821 -21.429 -41.851 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -4.375 -20.031 -42.752 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -1.726 -19.481 -42.804 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -1.608 -21.217 -42.596 1.00 0.00 H new ATOM 0 HE ARG A 82 -3.472 -21.011 -44.632 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -0.227 -19.597 -44.149 1.00 0.00 H new ATOM 0 HH12 ARG A 82 0.126 -19.523 -45.879 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -3.011 -20.909 -46.828 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -1.467 -20.273 -47.402 1.00 0.00 H new ATOM 1279 N ASP A 83 -3.867 -21.153 -38.246 1.00 0.00 N ATOM 1280 CA ASP A 83 -3.763 -22.403 -37.512 1.00 0.00 C ATOM 1281 C ASP A 83 -5.095 -22.692 -36.816 1.00 0.00 C ATOM 1282 O ASP A 83 -5.565 -23.829 -36.814 1.00 0.00 O ATOM 1283 CB ASP A 83 -2.676 -22.325 -36.439 1.00 0.00 C ATOM 1284 CG ASP A 83 -1.279 -22.745 -36.902 1.00 0.00 C ATOM 1285 OD1 ASP A 83 -1.023 -22.893 -38.106 1.00 0.00 O ATOM 1286 OD2 ASP A 83 -0.422 -22.925 -35.955 1.00 0.00 O ATOM 0 H ASP A 83 -3.306 -20.389 -37.868 1.00 0.00 H new ATOM 0 HA ASP A 83 -3.511 -23.191 -38.222 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -2.627 -21.302 -36.067 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -2.969 -22.956 -35.600 1.00 0.00 H new ATOM 1292 N ARG A 84 -5.665 -21.644 -36.241 1.00 0.00 N ATOM 1293 CA ARG A 84 -6.933 -21.770 -35.542 1.00 0.00 C ATOM 1294 C ARG A 84 -8.068 -22.001 -36.541 1.00 0.00 C ATOM 1295 O ARG A 84 -9.079 -22.618 -36.207 1.00 0.00 O ATOM 1296 CB ARG A 84 -7.235 -20.518 -34.717 1.00 0.00 C ATOM 1297 CG ARG A 84 -7.814 -20.888 -33.351 1.00 0.00 C ATOM 1298 CD ARG A 84 -7.064 -20.174 -32.225 1.00 0.00 C ATOM 1299 NE ARG A 84 -8.022 -19.465 -31.347 1.00 0.00 N ATOM 1300 CZ ARG A 84 -7.688 -18.442 -30.533 1.00 0.00 C ATOM 1301 NH1 ARG A 84 -6.415 -17.998 -30.477 1.00 0.00 N ATOM 1302 NH2 ARG A 84 -8.626 -17.882 -29.791 1.00 0.00 N ATOM 0 H ARG A 84 -5.272 -20.703 -36.245 1.00 0.00 H new ATOM 0 HA ARG A 84 -6.857 -22.624 -34.869 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -6.322 -19.937 -34.584 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -7.940 -19.885 -35.255 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -8.870 -20.621 -33.315 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -7.753 -21.967 -33.206 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -6.491 -20.896 -31.643 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -6.350 -19.465 -32.645 1.00 0.00 H new ATOM 0 HE ARG A 84 -8.996 -19.769 -31.358 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -5.696 -18.436 -31.053 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -6.172 -17.224 -29.859 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -9.586 -18.224 -29.839 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -8.391 -17.108 -29.170 1.00 0.00 H new ATOM 1315 N LYS A 85 -7.864 -21.493 -37.748 1.00 0.00 N ATOM 1316 CA LYS A 85 -8.859 -21.635 -38.798 1.00 0.00 C ATOM 1317 C LYS A 85 -8.643 -22.967 -39.521 1.00 0.00 C ATOM 1318 O LYS A 85 -9.542 -23.460 -40.200 1.00 0.00 O ATOM 1319 CB LYS A 85 -8.835 -20.420 -39.727 1.00 0.00 C ATOM 1320 CG LYS A 85 -9.982 -19.460 -39.404 1.00 0.00 C ATOM 1321 CD LYS A 85 -9.480 -18.255 -38.606 1.00 0.00 C ATOM 1322 CE LYS A 85 -9.890 -18.362 -37.136 1.00 0.00 C ATOM 1323 NZ LYS A 85 -11.354 -18.195 -36.993 1.00 0.00 N ATOM 0 H LYS A 85 -7.025 -20.983 -38.022 1.00 0.00 H new ATOM 0 HA LYS A 85 -9.862 -21.661 -38.372 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.882 -19.900 -39.627 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -8.912 -20.749 -40.763 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -10.448 -19.120 -40.329 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -10.750 -19.984 -38.834 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -8.394 -18.191 -38.681 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -9.883 -17.337 -39.034 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.588 -19.331 -36.738 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -9.372 -17.601 -36.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -11.574 -17.867 -36.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -11.693 -17.495 -37.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -11.826 -19.106 -37.164 1.00 0.00 H new ATOM 1336 N LEU A 86 -7.447 -23.509 -39.350 1.00 0.00 N ATOM 1337 CA LEU A 86 -7.102 -24.774 -39.978 1.00 0.00 C ATOM 1338 C LEU A 86 -7.065 -25.873 -38.914 1.00 0.00 C ATOM 1339 O LEU A 86 -7.524 -25.670 -37.791 1.00 0.00 O ATOM 1340 CB LEU A 86 -5.800 -24.641 -40.770 1.00 0.00 C ATOM 1341 CG LEU A 86 -5.838 -23.690 -41.968 1.00 0.00 C ATOM 1342 CD1 LEU A 86 -5.723 -24.461 -43.284 1.00 0.00 C ATOM 1343 CD2 LEU A 86 -7.087 -22.807 -41.928 1.00 0.00 C ATOM 0 H LEU A 86 -6.704 -23.096 -38.786 1.00 0.00 H new ATOM 0 HA LEU A 86 -7.863 -25.059 -40.705 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -5.017 -24.306 -40.090 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -5.512 -25.630 -41.126 1.00 0.00 H new ATOM 0 HG LEU A 86 -4.974 -23.028 -41.906 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -5.753 -23.761 -44.119 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -4.781 -25.009 -43.303 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -6.553 -25.162 -43.369 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -7.089 -22.141 -42.791 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -7.978 -23.435 -41.952 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -7.085 -22.215 -41.013 1.00 0.00 H new ATOM 1355 N ASN A 87 -6.515 -27.013 -39.306 1.00 0.00 N ATOM 1356 CA ASN A 87 -6.413 -28.144 -38.400 1.00 0.00 C ATOM 1357 C ASN A 87 -5.072 -28.084 -37.666 1.00 0.00 C ATOM 1358 O ASN A 87 -4.815 -28.886 -36.768 1.00 0.00 O ATOM 1359 CB ASN A 87 -6.475 -29.469 -39.163 1.00 0.00 C ATOM 1360 CG ASN A 87 -5.378 -29.540 -40.228 1.00 0.00 C ATOM 1361 OD1 ASN A 87 -4.897 -28.536 -40.729 1.00 0.00 O ATOM 1362 ND2 ASN A 87 -5.011 -30.778 -40.545 1.00 0.00 N ATOM 0 H ASN A 87 -6.136 -27.177 -40.238 1.00 0.00 H new ATOM 0 HA ASN A 87 -7.247 -28.092 -37.700 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -6.365 -30.300 -38.466 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -7.452 -29.576 -39.634 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -4.286 -30.931 -41.246 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -5.454 -31.574 -40.087 1.00 0.00 H new ATOM 1369 N GLY A 88 -4.252 -27.127 -38.074 1.00 0.00 N ATOM 1370 CA GLY A 88 -2.944 -26.952 -37.466 1.00 0.00 C ATOM 1371 C GLY A 88 -3.040 -26.984 -35.940 1.00 0.00 C ATOM 1372 O GLY A 88 -2.302 -27.717 -35.283 1.00 0.00 O ATOM 0 H GLY A 88 -4.468 -26.464 -38.819 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -2.272 -27.739 -37.808 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -2.514 -26.003 -37.787 1.00 0.00 H new ATOM 1376 N PHE A 89 -3.955 -26.180 -35.419 1.00 0.00 N ATOM 1377 CA PHE A 89 -4.158 -26.106 -33.982 1.00 0.00 C ATOM 1378 C PHE A 89 -5.563 -26.575 -33.602 1.00 0.00 C ATOM 1379 O PHE A 89 -5.814 -26.926 -32.450 1.00 0.00 O ATOM 1380 CB PHE A 89 -3.996 -24.638 -33.582 1.00 0.00 C ATOM 1381 CG PHE A 89 -4.642 -24.285 -32.241 1.00 0.00 C ATOM 1382 CD1 PHE A 89 -4.090 -24.731 -31.081 1.00 0.00 C ATOM 1383 CD2 PHE A 89 -5.769 -23.523 -32.209 1.00 0.00 C ATOM 1384 CE1 PHE A 89 -4.690 -24.403 -29.837 1.00 0.00 C ATOM 1385 CE2 PHE A 89 -6.369 -23.195 -30.964 1.00 0.00 C ATOM 1386 CZ PHE A 89 -5.816 -23.642 -29.804 1.00 0.00 C ATOM 0 H PHE A 89 -4.565 -25.573 -35.967 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.440 -26.748 -33.471 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -2.933 -24.399 -33.536 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -4.430 -24.010 -34.360 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.195 -25.335 -31.106 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -6.207 -23.168 -33.130 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -4.252 -24.758 -28.916 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -7.264 -22.591 -30.938 1.00 0.00 H new ATOM 0 HZ PHE A 89 -6.272 -23.392 -28.857 1.00 0.00 H new ATOM 1396 N LEU A 90 -6.444 -26.566 -34.592 1.00 0.00 N ATOM 1397 CA LEU A 90 -7.818 -26.985 -34.375 1.00 0.00 C ATOM 1398 C LEU A 90 -7.940 -28.484 -34.659 1.00 0.00 C ATOM 1399 O LEU A 90 -8.948 -29.103 -34.324 1.00 0.00 O ATOM 1400 CB LEU A 90 -8.778 -26.124 -35.198 1.00 0.00 C ATOM 1401 CG LEU A 90 -10.215 -26.039 -34.681 1.00 0.00 C ATOM 1402 CD1 LEU A 90 -10.408 -24.805 -33.798 1.00 0.00 C ATOM 1403 CD2 LEU A 90 -11.217 -26.080 -35.837 1.00 0.00 C ATOM 0 H LEU A 90 -6.233 -26.275 -35.546 1.00 0.00 H new ATOM 0 HA LEU A 90 -8.102 -26.832 -33.334 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -8.372 -25.114 -35.252 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -8.802 -26.513 -36.216 1.00 0.00 H new ATOM 0 HG LEU A 90 -10.406 -26.913 -34.058 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -11.438 -24.769 -33.444 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -9.732 -24.859 -32.944 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -10.191 -23.907 -34.376 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -12.231 -26.018 -35.442 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -11.036 -25.238 -36.505 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -11.099 -27.013 -36.388 1.00 0.00 H new ATOM 1415 N GLU A 91 -6.898 -29.024 -35.274 1.00 0.00 N ATOM 1416 CA GLU A 91 -6.875 -30.438 -35.607 1.00 0.00 C ATOM 1417 C GLU A 91 -8.286 -30.928 -35.939 1.00 0.00 C ATOM 1418 O GLU A 91 -8.790 -31.854 -35.306 1.00 0.00 O ATOM 1419 CB GLU A 91 -6.263 -31.259 -34.470 1.00 0.00 C ATOM 1420 CG GLU A 91 -4.747 -31.380 -34.636 1.00 0.00 C ATOM 1421 CD GLU A 91 -4.224 -32.660 -33.980 1.00 0.00 C ATOM 1422 OE1 GLU A 91 -4.936 -33.280 -33.176 1.00 0.00 O ATOM 1423 OE2 GLU A 91 -3.033 -33.007 -34.335 1.00 0.00 O ATOM 0 H GLU A 91 -6.063 -28.507 -35.550 1.00 0.00 H new ATOM 0 HA GLU A 91 -6.248 -30.574 -36.488 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.491 -30.789 -33.513 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -6.711 -32.253 -34.452 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -4.492 -31.380 -35.696 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.258 -30.513 -34.191 1.00 0.00 H new ATOM 1431 N HIS A 92 -8.884 -30.283 -36.930 1.00 0.00 N ATOM 1432 CA HIS A 92 -10.227 -30.641 -37.354 1.00 0.00 C ATOM 1433 C HIS A 92 -10.151 -31.688 -38.467 1.00 0.00 C ATOM 1434 O HIS A 92 -10.843 -31.576 -39.478 1.00 0.00 O ATOM 1435 CB HIS A 92 -11.017 -29.397 -37.763 1.00 0.00 C ATOM 1436 CG HIS A 92 -12.515 -29.564 -37.671 1.00 0.00 C ATOM 1437 ND1 HIS A 92 -13.334 -29.614 -38.785 1.00 0.00 N ATOM 1438 CD2 HIS A 92 -13.333 -29.691 -36.586 1.00 0.00 C ATOM 1439 CE1 HIS A 92 -14.586 -29.765 -38.378 1.00 0.00 C ATOM 1440 NE2 HIS A 92 -14.583 -29.812 -37.015 1.00 0.00 N ATOM 0 H HIS A 92 -8.463 -29.514 -37.452 1.00 0.00 H new ATOM 0 HA HIS A 92 -10.769 -31.086 -36.520 1.00 0.00 H new ATOM 0 HB2 HIS A 92 -10.715 -28.563 -37.130 1.00 0.00 H new ATOM 0 HB3 HIS A 92 -10.753 -29.132 -38.787 1.00 0.00 H new ATOM 0 HD2 HIS A 92 -13.017 -29.693 -35.553 1.00 0.00 H new ATOM 0 HE1 HIS A 92 -15.456 -29.838 -39.014 1.00 0.00 H new ATOM 0 HE2 HIS A 92 -15.406 -29.922 -36.423 1.00 0.00 H new ATOM 1448 N HIS A 93 -9.305 -32.683 -38.244 1.00 0.00 N ATOM 1449 CA HIS A 93 -9.131 -33.750 -39.215 1.00 0.00 C ATOM 1450 C HIS A 93 -8.502 -34.966 -38.534 1.00 0.00 C ATOM 1451 O HIS A 93 -7.650 -34.821 -37.658 1.00 0.00 O ATOM 1452 CB HIS A 93 -8.323 -33.261 -40.419 1.00 0.00 C ATOM 1453 CG HIS A 93 -8.976 -33.542 -41.751 1.00 0.00 C ATOM 1454 ND1 HIS A 93 -8.642 -34.633 -42.535 1.00 0.00 N ATOM 1455 CD2 HIS A 93 -9.946 -32.864 -42.429 1.00 0.00 C ATOM 1456 CE1 HIS A 93 -9.383 -34.602 -43.632 1.00 0.00 C ATOM 1457 NE2 HIS A 93 -10.190 -33.505 -43.565 1.00 0.00 N ATOM 0 H HIS A 93 -8.732 -32.773 -37.405 1.00 0.00 H new ATOM 0 HA HIS A 93 -10.103 -34.057 -39.602 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -8.162 -32.187 -40.324 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -7.341 -33.733 -40.401 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -10.433 -31.959 -42.097 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -9.353 -35.320 -44.438 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -10.869 -33.223 -44.272 1.00 0.00 H new ATOM 1465 N HIS A 94 -8.945 -36.139 -38.962 1.00 0.00 N ATOM 1466 CA HIS A 94 -8.437 -37.381 -38.404 1.00 0.00 C ATOM 1467 C HIS A 94 -7.017 -37.631 -38.918 1.00 0.00 C ATOM 1468 O HIS A 94 -6.560 -36.959 -39.842 1.00 0.00 O ATOM 1469 CB HIS A 94 -9.388 -38.541 -38.703 1.00 0.00 C ATOM 1470 CG HIS A 94 -10.128 -39.056 -37.491 1.00 0.00 C ATOM 1471 ND1 HIS A 94 -9.539 -39.166 -36.244 1.00 0.00 N ATOM 1472 CD2 HIS A 94 -11.414 -39.488 -37.350 1.00 0.00 C ATOM 1473 CE1 HIS A 94 -10.439 -39.645 -35.397 1.00 0.00 C ATOM 1474 NE2 HIS A 94 -11.600 -39.845 -36.085 1.00 0.00 N ATOM 0 H HIS A 94 -9.651 -36.256 -39.689 1.00 0.00 H new ATOM 0 HA HIS A 94 -8.385 -37.301 -37.318 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -10.114 -38.219 -39.450 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -8.819 -39.360 -39.144 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -12.155 -39.532 -38.134 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -10.281 -39.842 -34.347 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -12.468 -40.209 -35.692 1.00 0.00 H new ATOM 1482 N HIS A 95 -6.359 -38.599 -38.297 1.00 0.00 N ATOM 1483 CA HIS A 95 -5.001 -38.945 -38.680 1.00 0.00 C ATOM 1484 C HIS A 95 -4.064 -37.780 -38.359 1.00 0.00 C ATOM 1485 O HIS A 95 -4.499 -36.632 -38.283 1.00 0.00 O ATOM 1486 CB HIS A 95 -4.942 -39.367 -40.150 1.00 0.00 C ATOM 1487 CG HIS A 95 -4.722 -40.846 -40.356 1.00 0.00 C ATOM 1488 ND1 HIS A 95 -3.464 -41.420 -40.385 1.00 0.00 N ATOM 1489 CD2 HIS A 95 -5.613 -41.862 -40.543 1.00 0.00 C ATOM 1490 CE1 HIS A 95 -3.603 -42.723 -40.582 1.00 0.00 C ATOM 1491 NE2 HIS A 95 -4.936 -42.995 -40.679 1.00 0.00 N ATOM 0 H HIS A 95 -6.741 -39.154 -37.531 1.00 0.00 H new ATOM 0 HA HIS A 95 -4.664 -39.805 -38.102 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -5.872 -39.077 -40.638 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -4.139 -38.819 -40.643 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -6.688 -41.761 -40.575 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -2.801 -43.443 -40.653 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -5.345 -43.917 -40.831 1.00 0.00 H new ATOM 1499 N HIS A 96 -2.795 -38.115 -38.179 1.00 0.00 N ATOM 1500 CA HIS A 96 -1.792 -37.110 -37.868 1.00 0.00 C ATOM 1501 C HIS A 96 -0.595 -37.273 -38.807 1.00 0.00 C ATOM 1502 O HIS A 96 -0.496 -38.265 -39.527 1.00 0.00 O ATOM 1503 CB HIS A 96 -1.400 -37.173 -36.391 1.00 0.00 C ATOM 1504 CG HIS A 96 -0.730 -38.465 -35.988 1.00 0.00 C ATOM 1505 ND1 HIS A 96 -1.394 -39.679 -35.963 1.00 0.00 N ATOM 1506 CD2 HIS A 96 0.552 -38.719 -35.595 1.00 0.00 C ATOM 1507 CE1 HIS A 96 -0.542 -40.614 -35.571 1.00 0.00 C ATOM 1508 NE2 HIS A 96 0.663 -40.018 -35.343 1.00 0.00 N ATOM 0 H HIS A 96 -2.438 -39.068 -38.243 1.00 0.00 H new ATOM 0 HA HIS A 96 -2.205 -36.115 -38.032 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -0.730 -36.343 -36.168 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -2.293 -37.034 -35.782 1.00 0.00 H new ATOM 0 HD2 HIS A 96 1.342 -37.988 -35.504 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -0.763 -41.665 -35.453 1.00 0.00 H new ATOM 0 HE2 HIS A 96 1.510 -40.492 -35.030 1.00 0.00 H new ATOM 1516 N HIS A 97 0.285 -36.283 -38.768 1.00 0.00 N ATOM 1517 CA HIS A 97 1.472 -36.303 -39.606 1.00 0.00 C ATOM 1518 C HIS A 97 2.569 -35.453 -38.962 1.00 0.00 C ATOM 1519 O HIS A 97 3.712 -35.893 -38.845 1.00 0.00 O ATOM 1520 CB HIS A 97 1.138 -35.859 -41.032 1.00 0.00 C ATOM 1521 CG HIS A 97 2.138 -36.315 -42.067 1.00 0.00 C ATOM 1522 ND1 HIS A 97 1.764 -36.876 -43.275 1.00 0.00 N ATOM 1523 CD2 HIS A 97 3.502 -36.286 -42.062 1.00 0.00 C ATOM 1524 CE1 HIS A 97 2.860 -37.169 -43.959 1.00 0.00 C ATOM 1525 NE2 HIS A 97 3.937 -36.803 -43.205 1.00 0.00 N ATOM 0 H HIS A 97 0.200 -35.462 -38.169 1.00 0.00 H new ATOM 0 HA HIS A 97 1.849 -37.323 -39.684 1.00 0.00 H new ATOM 0 HB2 HIS A 97 0.153 -36.242 -41.300 1.00 0.00 H new ATOM 0 HB3 HIS A 97 1.075 -34.771 -41.057 1.00 0.00 H new ATOM 0 HD2 HIS A 97 4.123 -35.907 -41.264 1.00 0.00 H new ATOM 0 HE1 HIS A 97 2.895 -37.618 -44.940 1.00 0.00 H new ATOM 0 HE2 HIS A 97 4.915 -36.909 -43.475 1.00 0.00 H new TER 1533 HIS A 97