USER MOD reduce.3.24.130724 H: found=0, std=0, add=734, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 732 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 Single : A 1 MET CE :methyl 164:sc= -3.18 (180deg=-4.64!) USER MOD Single : A 1 MET N :NH3+ 168:sc= 0.69 (180deg=0.579) USER MOD Single : A 7 ASN : amide:sc= 0.452 K(o=0.45,f=-8.9!) USER MOD Single : A 9 HIS : no HD1:sc=-0.00822 X(o=-0.0082,f=-0.013) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 172:sc= 1.29 (180deg=1.13) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl -160:sc= -0.55 (180deg=-2.08!) USER MOD Single : A 16 SER OG : rot -24:sc= 0.413 USER MOD Single : A 17 TYR OH : rot 94:sc= 0.00923 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 1.74 K(o=1.7,f=0) USER MOD Single : A 37 SER OG : rot -84:sc= 1.07 USER MOD Single : A 45 MET CE :methyl 179:sc= 0 (180deg=-0.00278) USER MOD Single : A 49 HIS : no HD1:sc= -0.221 X(o=-0.22,f=0) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 65 GLN : amide:sc= 0.0173 X(o=0.017,f=-0.0013) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.692 USER MOD Single : A 77 LYS NZ :NH3+ 162:sc= 1.6 (180deg=1.21) USER MOD Single : A 79 GLN : amide:sc= 1.21 K(o=1.2,f=0) USER MOD Single : A 81 SER OG : rot 180:sc= 0.042 USER MOD Single : A 82 LYS NZ :NH3+ -171:sc= 1.27 (180deg=1.2) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.875 0.977 -3.769 1.00 0.00 N ATOM 2 CA MET A 1 5.243 -0.172 -4.479 1.00 0.00 C ATOM 3 C MET A 1 3.976 0.263 -5.228 1.00 0.00 C ATOM 4 O MET A 1 3.497 1.387 -5.057 1.00 0.00 O ATOM 5 CB MET A 1 4.986 -1.395 -3.565 1.00 0.00 C ATOM 6 CG MET A 1 3.755 -1.300 -2.648 1.00 0.00 C ATOM 7 SD MET A 1 3.591 -2.677 -1.482 1.00 0.00 S ATOM 8 CE MET A 1 3.126 -3.982 -2.643 1.00 0.00 C ATOM 0 H1 MET A 1 6.601 0.623 -3.114 1.00 0.00 H new ATOM 0 H2 MET A 1 6.315 1.614 -4.463 1.00 0.00 H new ATOM 0 H3 MET A 1 5.150 1.496 -3.234 1.00 0.00 H new ATOM 0 HA MET A 1 5.969 -0.510 -5.219 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.879 -2.279 -4.194 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.867 -1.551 -2.943 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.805 -0.367 -2.087 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.858 -1.253 -3.266 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.256 -4.955 -2.168 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.083 -3.856 -2.933 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.758 -3.923 -3.529 1.00 0.00 H new ATOM 20 N GLU A 2 3.400 -0.632 -6.039 1.00 0.00 N ATOM 21 CA GLU A 2 2.473 -0.290 -7.109 1.00 0.00 C ATOM 22 C GLU A 2 1.185 -1.095 -6.881 1.00 0.00 C ATOM 23 O GLU A 2 1.008 -2.158 -7.464 1.00 0.00 O ATOM 24 CB GLU A 2 3.206 -0.568 -8.447 1.00 0.00 C ATOM 25 CG GLU A 2 3.800 0.691 -9.099 1.00 0.00 C ATOM 26 CD GLU A 2 4.796 1.462 -8.207 1.00 0.00 C ATOM 27 OE1 GLU A 2 5.768 0.858 -7.690 1.00 0.00 O ATOM 28 OE2 GLU A 2 4.622 2.692 -8.033 1.00 0.00 O ATOM 0 H GLU A 2 3.573 -1.634 -5.963 1.00 0.00 H new ATOM 0 HA GLU A 2 2.171 0.757 -7.132 1.00 0.00 H new ATOM 0 HB2 GLU A 2 4.006 -1.287 -8.270 1.00 0.00 H new ATOM 0 HB3 GLU A 2 2.508 -1.033 -9.144 1.00 0.00 H new ATOM 0 HG2 GLU A 2 4.304 0.404 -10.022 1.00 0.00 H new ATOM 0 HG3 GLU A 2 2.986 1.361 -9.376 1.00 0.00 H new ATOM 35 N ILE A 3 0.344 -0.648 -5.937 1.00 0.00 N ATOM 36 CA ILE A 3 -0.960 -1.256 -5.617 1.00 0.00 C ATOM 37 C ILE A 3 -1.930 -1.035 -6.797 1.00 0.00 C ATOM 38 O ILE A 3 -1.851 -0.009 -7.478 1.00 0.00 O ATOM 39 CB ILE A 3 -1.523 -0.646 -4.307 1.00 0.00 C ATOM 40 CG1 ILE A 3 -0.585 -0.858 -3.098 1.00 0.00 C ATOM 41 CG2 ILE A 3 -2.930 -1.173 -3.940 1.00 0.00 C ATOM 42 CD1 ILE A 3 -0.443 -2.284 -2.552 1.00 0.00 C ATOM 0 H ILE A 3 0.555 0.166 -5.360 1.00 0.00 H new ATOM 0 HA ILE A 3 -0.839 -2.328 -5.462 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.597 0.420 -4.521 1.00 0.00 H new ATOM 0 HG12 ILE A 3 0.408 -0.504 -3.377 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -0.934 -0.220 -2.286 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -3.263 -0.705 -3.014 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -3.629 -0.931 -4.740 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -2.890 -2.254 -3.807 1.00 0.00 H new ATOM 0 HD11 ILE A 3 0.245 -2.283 -1.706 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.418 -2.648 -2.227 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.055 -2.936 -3.334 1.00 0.00 H new ATOM 54 N GLU A 4 -2.887 -1.953 -7.000 1.00 0.00 N ATOM 55 CA GLU A 4 -3.931 -1.846 -8.020 1.00 0.00 C ATOM 56 C GLU A 4 -5.196 -2.602 -7.569 1.00 0.00 C ATOM 57 O GLU A 4 -5.268 -3.830 -7.632 1.00 0.00 O ATOM 58 CB GLU A 4 -3.381 -2.396 -9.345 1.00 0.00 C ATOM 59 CG GLU A 4 -4.296 -2.096 -10.535 1.00 0.00 C ATOM 60 CD GLU A 4 -3.692 -2.488 -11.900 1.00 0.00 C ATOM 61 OE1 GLU A 4 -2.497 -2.209 -12.160 1.00 0.00 O ATOM 62 OE2 GLU A 4 -4.427 -3.044 -12.750 1.00 0.00 O ATOM 0 H GLU A 4 -2.955 -2.807 -6.446 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.214 -0.803 -8.164 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -2.397 -1.966 -9.531 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -3.247 -3.474 -9.258 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -5.238 -2.627 -10.399 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -4.528 -1.031 -10.543 1.00 0.00 H new ATOM 69 N ARG A 5 -6.222 -1.891 -7.094 1.00 0.00 N ATOM 70 CA ARG A 5 -7.529 -2.503 -6.823 1.00 0.00 C ATOM 71 C ARG A 5 -8.182 -2.786 -8.187 1.00 0.00 C ATOM 72 O ARG A 5 -8.359 -1.851 -8.972 1.00 0.00 O ATOM 73 CB ARG A 5 -8.372 -1.570 -5.923 1.00 0.00 C ATOM 74 CG ARG A 5 -8.948 -2.284 -4.691 1.00 0.00 C ATOM 75 CD ARG A 5 -10.135 -3.205 -4.990 1.00 0.00 C ATOM 76 NE ARG A 5 -11.341 -2.436 -5.306 1.00 0.00 N ATOM 77 CZ ARG A 5 -12.316 -2.074 -4.469 1.00 0.00 C ATOM 78 NH1 ARG A 5 -12.447 -2.591 -3.247 1.00 0.00 N ATOM 79 NH2 ARG A 5 -13.178 -1.154 -4.862 1.00 0.00 N ATOM 0 H ARG A 5 -6.175 -0.893 -6.889 1.00 0.00 H new ATOM 0 HA ARG A 5 -7.440 -3.441 -6.275 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -7.754 -0.734 -5.596 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -9.190 -1.151 -6.509 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -8.157 -2.871 -4.224 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -9.260 -1.534 -3.964 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -9.889 -3.859 -5.827 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -10.326 -3.847 -4.130 1.00 0.00 H new ATOM 0 HE ARG A 5 -11.448 -2.143 -6.277 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -11.786 -3.294 -2.917 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -13.208 -2.283 -2.642 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -13.091 -0.736 -5.788 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -13.931 -0.862 -4.239 1.00 0.00 H new ATOM 93 N ILE A 6 -8.465 -4.056 -8.509 1.00 0.00 N ATOM 94 CA ILE A 6 -9.063 -4.439 -9.786 1.00 0.00 C ATOM 95 C ILE A 6 -10.572 -4.229 -9.714 1.00 0.00 C ATOM 96 O ILE A 6 -11.156 -3.586 -10.592 1.00 0.00 O ATOM 97 CB ILE A 6 -8.739 -5.915 -10.090 1.00 0.00 C ATOM 98 CG1 ILE A 6 -7.236 -6.212 -9.953 1.00 0.00 C ATOM 99 CG2 ILE A 6 -9.258 -6.373 -11.461 1.00 0.00 C ATOM 100 CD1 ILE A 6 -6.322 -5.319 -10.793 1.00 0.00 C ATOM 0 H ILE A 6 -8.284 -4.844 -7.887 1.00 0.00 H new ATOM 0 HA ILE A 6 -8.654 -3.822 -10.586 1.00 0.00 H new ATOM 0 HB ILE A 6 -9.272 -6.494 -9.336 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -6.955 -6.110 -8.905 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -7.059 -7.251 -10.231 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -8.999 -7.420 -11.617 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -10.341 -6.258 -11.497 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -8.803 -5.766 -12.244 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -5.283 -5.605 -10.629 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -6.568 -5.436 -11.848 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -6.462 -4.278 -10.501 1.00 0.00 H new ATOM 112 N ASN A 7 -11.187 -4.823 -8.690 1.00 0.00 N ATOM 113 CA ASN A 7 -12.619 -4.784 -8.413 1.00 0.00 C ATOM 114 C ASN A 7 -12.857 -5.228 -6.959 1.00 0.00 C ATOM 115 O ASN A 7 -11.905 -5.488 -6.225 1.00 0.00 O ATOM 116 CB ASN A 7 -13.413 -5.642 -9.430 1.00 0.00 C ATOM 117 CG ASN A 7 -13.211 -7.153 -9.326 1.00 0.00 C ATOM 118 OD1 ASN A 7 -12.560 -7.653 -8.420 1.00 0.00 O ATOM 119 ND2 ASN A 7 -13.770 -7.915 -10.250 1.00 0.00 N ATOM 0 H ASN A 7 -10.673 -5.370 -8.000 1.00 0.00 H new ATOM 0 HA ASN A 7 -12.988 -3.765 -8.529 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -14.475 -5.427 -9.307 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -13.138 -5.326 -10.436 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -13.660 -8.928 -10.211 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -14.312 -7.490 -11.003 1.00 0.00 H new ATOM 126 N GLU A 8 -14.121 -5.353 -6.546 1.00 0.00 N ATOM 127 CA GLU A 8 -14.539 -5.765 -5.198 1.00 0.00 C ATOM 128 C GLU A 8 -13.955 -7.117 -4.718 1.00 0.00 C ATOM 129 O GLU A 8 -14.005 -7.436 -3.528 1.00 0.00 O ATOM 130 CB GLU A 8 -16.078 -5.795 -5.196 1.00 0.00 C ATOM 131 CG GLU A 8 -16.696 -6.055 -3.813 1.00 0.00 C ATOM 132 CD GLU A 8 -18.187 -5.665 -3.720 1.00 0.00 C ATOM 133 OE1 GLU A 8 -18.918 -5.702 -4.737 1.00 0.00 O ATOM 134 OE2 GLU A 8 -18.659 -5.336 -2.602 1.00 0.00 O ATOM 0 H GLU A 8 -14.912 -5.164 -7.161 1.00 0.00 H new ATOM 0 HA GLU A 8 -14.140 -5.044 -4.484 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -16.450 -4.844 -5.576 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -16.417 -6.568 -5.885 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -16.590 -7.112 -3.569 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -16.135 -5.497 -3.063 1.00 0.00 H new ATOM 141 N HIS A 9 -13.404 -7.916 -5.630 1.00 0.00 N ATOM 142 CA HIS A 9 -13.041 -9.312 -5.417 1.00 0.00 C ATOM 143 C HIS A 9 -11.546 -9.571 -5.606 1.00 0.00 C ATOM 144 O HIS A 9 -10.996 -10.470 -4.970 1.00 0.00 O ATOM 145 CB HIS A 9 -13.855 -10.156 -6.399 1.00 0.00 C ATOM 146 CG HIS A 9 -15.350 -10.006 -6.221 1.00 0.00 C ATOM 147 ND1 HIS A 9 -16.262 -9.637 -7.190 1.00 0.00 N ATOM 148 CD2 HIS A 9 -16.040 -10.085 -5.039 1.00 0.00 C ATOM 149 CE1 HIS A 9 -17.462 -9.501 -6.599 1.00 0.00 C ATOM 150 NE2 HIS A 9 -17.382 -9.777 -5.287 1.00 0.00 N ATOM 0 H HIS A 9 -13.191 -7.594 -6.574 1.00 0.00 H new ATOM 0 HA HIS A 9 -13.264 -9.580 -4.384 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -13.587 -9.875 -7.418 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -13.585 -11.205 -6.276 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -15.619 -10.342 -4.078 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -18.368 -9.209 -7.110 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -18.144 -9.765 -4.609 1.00 0.00 H new ATOM 158 N THR A 10 -10.876 -8.771 -6.421 1.00 0.00 N ATOM 159 CA THR A 10 -9.491 -8.973 -6.818 1.00 0.00 C ATOM 160 C THR A 10 -8.712 -7.678 -6.605 1.00 0.00 C ATOM 161 O THR A 10 -9.175 -6.581 -6.930 1.00 0.00 O ATOM 162 CB THR A 10 -9.473 -9.433 -8.289 1.00 0.00 C ATOM 163 OG1 THR A 10 -10.227 -10.633 -8.404 1.00 0.00 O ATOM 164 CG2 THR A 10 -8.067 -9.696 -8.837 1.00 0.00 C ATOM 0 H THR A 10 -11.293 -7.938 -6.837 1.00 0.00 H new ATOM 0 HA THR A 10 -9.011 -9.742 -6.213 1.00 0.00 H new ATOM 0 HB THR A 10 -9.900 -8.619 -8.875 1.00 0.00 H new ATOM 0 HG1 THR A 10 -10.223 -10.933 -9.337 1.00 0.00 H new ATOM 0 HG21 THR A 10 -8.136 -10.016 -9.877 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.476 -8.782 -8.777 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.587 -10.478 -8.248 1.00 0.00 H new ATOM 172 N VAL A 11 -7.476 -7.816 -6.133 1.00 0.00 N ATOM 173 CA VAL A 11 -6.493 -6.740 -6.141 1.00 0.00 C ATOM 174 C VAL A 11 -5.225 -7.326 -6.753 1.00 0.00 C ATOM 175 O VAL A 11 -5.000 -8.536 -6.684 1.00 0.00 O ATOM 176 CB VAL A 11 -6.309 -6.110 -4.738 1.00 0.00 C ATOM 177 CG1 VAL A 11 -7.662 -5.697 -4.134 1.00 0.00 C ATOM 178 CG2 VAL A 11 -5.606 -7.009 -3.716 1.00 0.00 C ATOM 0 H VAL A 11 -7.127 -8.686 -5.731 1.00 0.00 H new ATOM 0 HA VAL A 11 -6.819 -5.893 -6.744 1.00 0.00 H new ATOM 0 HB VAL A 11 -5.668 -5.248 -4.921 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -7.502 -5.258 -3.149 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -8.142 -4.966 -4.784 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -8.302 -6.575 -4.040 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -5.523 -6.483 -2.765 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -6.184 -7.922 -3.576 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -4.610 -7.262 -4.079 1.00 0.00 H new ATOM 188 N LYS A 12 -4.387 -6.493 -7.359 1.00 0.00 N ATOM 189 CA LYS A 12 -3.050 -6.901 -7.753 1.00 0.00 C ATOM 190 C LYS A 12 -2.086 -5.836 -7.290 1.00 0.00 C ATOM 191 O LYS A 12 -2.500 -4.754 -6.879 1.00 0.00 O ATOM 192 CB LYS A 12 -2.991 -7.251 -9.253 1.00 0.00 C ATOM 193 CG LYS A 12 -2.533 -6.173 -10.228 1.00 0.00 C ATOM 194 CD LYS A 12 -2.470 -6.748 -11.651 1.00 0.00 C ATOM 195 CE LYS A 12 -1.976 -5.636 -12.576 1.00 0.00 C ATOM 196 NZ LYS A 12 -1.399 -6.144 -13.849 1.00 0.00 N ATOM 0 H LYS A 12 -4.615 -5.526 -7.588 1.00 0.00 H new ATOM 0 HA LYS A 12 -2.752 -7.831 -7.269 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -2.327 -8.108 -9.369 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -3.986 -7.575 -9.558 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -3.220 -5.328 -10.198 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -1.553 -5.797 -9.934 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -1.797 -7.605 -11.689 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -3.452 -7.100 -11.966 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -2.805 -4.966 -12.803 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -1.223 -5.046 -12.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -1.208 -5.345 -14.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -0.512 -6.649 -13.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -2.073 -6.794 -14.301 1.00 0.00 H new ATOM 210 N PHE A 13 -0.803 -6.132 -7.342 1.00 0.00 N ATOM 211 CA PHE A 13 0.220 -5.135 -7.140 1.00 0.00 C ATOM 212 C PHE A 13 1.485 -5.592 -7.844 1.00 0.00 C ATOM 213 O PHE A 13 1.648 -6.768 -8.181 1.00 0.00 O ATOM 214 CB PHE A 13 0.457 -4.886 -5.640 1.00 0.00 C ATOM 215 CG PHE A 13 0.844 -6.110 -4.846 1.00 0.00 C ATOM 216 CD1 PHE A 13 -0.162 -6.973 -4.377 1.00 0.00 C ATOM 217 CD2 PHE A 13 2.193 -6.379 -4.562 1.00 0.00 C ATOM 218 CE1 PHE A 13 0.179 -8.092 -3.610 1.00 0.00 C ATOM 219 CE2 PHE A 13 2.529 -7.474 -3.751 1.00 0.00 C ATOM 220 CZ PHE A 13 1.520 -8.316 -3.255 1.00 0.00 C ATOM 0 H PHE A 13 -0.444 -7.069 -7.525 1.00 0.00 H new ATOM 0 HA PHE A 13 -0.099 -4.183 -7.565 1.00 0.00 H new ATOM 0 HB2 PHE A 13 1.241 -4.137 -5.530 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -0.450 -4.463 -5.209 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -1.198 -6.772 -4.609 1.00 0.00 H new ATOM 0 HD2 PHE A 13 2.969 -5.746 -4.966 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -0.587 -8.783 -3.291 1.00 0.00 H new ATOM 0 HE2 PHE A 13 3.563 -7.669 -3.508 1.00 0.00 H new ATOM 0 HZ PHE A 13 1.775 -9.136 -2.600 1.00 0.00 H new ATOM 230 N TYR A 14 2.408 -4.657 -8.010 1.00 0.00 N ATOM 231 CA TYR A 14 3.749 -4.921 -8.454 1.00 0.00 C ATOM 232 C TYR A 14 4.677 -4.468 -7.330 1.00 0.00 C ATOM 233 O TYR A 14 4.421 -3.458 -6.662 1.00 0.00 O ATOM 234 CB TYR A 14 3.962 -4.204 -9.785 1.00 0.00 C ATOM 235 CG TYR A 14 5.407 -4.209 -10.187 1.00 0.00 C ATOM 236 CD1 TYR A 14 5.989 -5.403 -10.638 1.00 0.00 C ATOM 237 CD2 TYR A 14 6.189 -3.062 -9.986 1.00 0.00 C ATOM 238 CE1 TYR A 14 7.362 -5.464 -10.906 1.00 0.00 C ATOM 239 CE2 TYR A 14 7.571 -3.111 -10.256 1.00 0.00 C ATOM 240 CZ TYR A 14 8.166 -4.311 -10.722 1.00 0.00 C ATOM 241 OH TYR A 14 9.503 -4.377 -10.986 1.00 0.00 O ATOM 0 H TYR A 14 2.230 -3.669 -7.832 1.00 0.00 H new ATOM 0 HA TYR A 14 3.955 -5.974 -8.646 1.00 0.00 H new ATOM 0 HB2 TYR A 14 3.366 -4.687 -10.559 1.00 0.00 H new ATOM 0 HB3 TYR A 14 3.609 -3.176 -9.706 1.00 0.00 H new ATOM 0 HD1 TYR A 14 5.375 -6.280 -10.779 1.00 0.00 H new ATOM 0 HD2 TYR A 14 5.736 -2.150 -9.628 1.00 0.00 H new ATOM 0 HE1 TYR A 14 7.807 -6.386 -11.251 1.00 0.00 H new ATOM 0 HE2 TYR A 14 8.180 -2.231 -10.107 1.00 0.00 H new ATOM 0 HH TYR A 14 9.914 -3.505 -10.812 1.00 0.00 H new ATOM 251 N MET A 15 5.729 -5.245 -7.102 1.00 0.00 N ATOM 252 CA MET A 15 6.672 -5.080 -6.016 1.00 0.00 C ATOM 253 C MET A 15 8.060 -5.178 -6.629 1.00 0.00 C ATOM 254 O MET A 15 8.451 -6.245 -7.097 1.00 0.00 O ATOM 255 CB MET A 15 6.466 -6.196 -4.993 1.00 0.00 C ATOM 256 CG MET A 15 7.195 -5.884 -3.702 1.00 0.00 C ATOM 257 SD MET A 15 6.359 -4.693 -2.636 1.00 0.00 S ATOM 258 CE MET A 15 6.717 -5.419 -1.018 1.00 0.00 C ATOM 0 H MET A 15 5.953 -6.041 -7.699 1.00 0.00 H new ATOM 0 HA MET A 15 6.539 -4.125 -5.508 1.00 0.00 H new ATOM 0 HB2 MET A 15 5.402 -6.321 -4.794 1.00 0.00 H new ATOM 0 HB3 MET A 15 6.827 -7.140 -5.401 1.00 0.00 H new ATOM 0 HG2 MET A 15 7.337 -6.811 -3.147 1.00 0.00 H new ATOM 0 HG3 MET A 15 8.187 -5.502 -3.943 1.00 0.00 H new ATOM 0 HE1 MET A 15 6.006 -5.040 -0.284 1.00 0.00 H new ATOM 0 HE2 MET A 15 6.632 -6.504 -1.079 1.00 0.00 H new ATOM 0 HE3 MET A 15 7.729 -5.151 -0.715 1.00 0.00 H new ATOM 268 N SER A 16 8.808 -4.086 -6.646 1.00 0.00 N ATOM 269 CA SER A 16 10.188 -4.132 -7.099 1.00 0.00 C ATOM 270 C SER A 16 11.021 -4.824 -6.023 1.00 0.00 C ATOM 271 O SER A 16 10.672 -4.789 -4.840 1.00 0.00 O ATOM 272 CB SER A 16 10.716 -2.720 -7.362 1.00 0.00 C ATOM 273 OG SER A 16 9.792 -1.941 -8.111 1.00 0.00 O ATOM 0 H SER A 16 8.485 -3.164 -6.354 1.00 0.00 H new ATOM 0 HA SER A 16 10.253 -4.687 -8.035 1.00 0.00 H new ATOM 0 HB2 SER A 16 10.922 -2.226 -6.412 1.00 0.00 H new ATOM 0 HB3 SER A 16 11.661 -2.780 -7.901 1.00 0.00 H new ATOM 0 HG SER A 16 9.205 -2.534 -8.625 1.00 0.00 H new ATOM 279 N TYR A 17 12.168 -5.384 -6.404 1.00 0.00 N ATOM 280 CA TYR A 17 13.117 -5.953 -5.449 1.00 0.00 C ATOM 281 C TYR A 17 13.465 -4.965 -4.342 1.00 0.00 C ATOM 282 O TYR A 17 13.433 -5.329 -3.174 1.00 0.00 O ATOM 283 CB TYR A 17 14.382 -6.439 -6.161 1.00 0.00 C ATOM 284 CG TYR A 17 14.184 -7.552 -7.172 1.00 0.00 C ATOM 285 CD1 TYR A 17 13.166 -8.515 -7.016 1.00 0.00 C ATOM 286 CD2 TYR A 17 15.067 -7.646 -8.264 1.00 0.00 C ATOM 287 CE1 TYR A 17 13.054 -9.574 -7.930 1.00 0.00 C ATOM 288 CE2 TYR A 17 14.952 -8.699 -9.184 1.00 0.00 C ATOM 289 CZ TYR A 17 13.946 -9.679 -9.021 1.00 0.00 C ATOM 290 OH TYR A 17 13.838 -10.733 -9.877 1.00 0.00 O ATOM 0 H TYR A 17 12.464 -5.456 -7.377 1.00 0.00 H new ATOM 0 HA TYR A 17 12.634 -6.811 -4.982 1.00 0.00 H new ATOM 0 HB2 TYR A 17 14.839 -5.590 -6.669 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.092 -6.780 -5.408 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.472 -8.438 -6.192 1.00 0.00 H new ATOM 0 HD2 TYR A 17 15.839 -6.902 -8.395 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.279 -10.315 -7.798 1.00 0.00 H new ATOM 0 HE2 TYR A 17 15.634 -8.761 -10.019 1.00 0.00 H new ATOM 0 HH TYR A 17 13.274 -10.480 -10.638 1.00 0.00 H new ATOM 300 N GLY A 18 13.707 -3.695 -4.665 1.00 0.00 N ATOM 301 CA GLY A 18 14.107 -2.753 -3.633 1.00 0.00 C ATOM 302 C GLY A 18 12.945 -2.241 -2.780 1.00 0.00 C ATOM 303 O GLY A 18 13.192 -1.705 -1.704 1.00 0.00 O ATOM 0 H GLY A 18 13.635 -3.307 -5.606 1.00 0.00 H new ATOM 0 HA2 GLY A 18 14.840 -3.231 -2.983 1.00 0.00 H new ATOM 0 HA3 GLY A 18 14.603 -1.903 -4.102 1.00 0.00 H new ATOM 307 N ASP A 19 11.683 -2.473 -3.169 1.00 0.00 N ATOM 308 CA ASP A 19 10.553 -2.287 -2.247 1.00 0.00 C ATOM 309 C ASP A 19 10.607 -3.356 -1.154 1.00 0.00 C ATOM 310 O ASP A 19 10.236 -3.097 -0.007 1.00 0.00 O ATOM 311 CB ASP A 19 9.198 -2.393 -2.968 1.00 0.00 C ATOM 312 CG ASP A 19 8.575 -1.029 -3.271 1.00 0.00 C ATOM 313 OD1 ASP A 19 8.051 -0.386 -2.332 1.00 0.00 O ATOM 314 OD2 ASP A 19 8.520 -0.631 -4.455 1.00 0.00 O ATOM 0 H ASP A 19 11.421 -2.786 -4.104 1.00 0.00 H new ATOM 0 HA ASP A 19 10.639 -1.287 -1.821 1.00 0.00 H new ATOM 0 HB2 ASP A 19 9.331 -2.941 -3.901 1.00 0.00 H new ATOM 0 HB3 ASP A 19 8.509 -2.972 -2.353 1.00 0.00 H new ATOM 319 N ILE A 20 11.064 -4.560 -1.506 1.00 0.00 N ATOM 320 CA ILE A 20 11.228 -5.677 -0.584 1.00 0.00 C ATOM 321 C ILE A 20 12.450 -5.370 0.301 1.00 0.00 C ATOM 322 O ILE A 20 12.356 -5.521 1.521 1.00 0.00 O ATOM 323 CB ILE A 20 11.288 -6.997 -1.411 1.00 0.00 C ATOM 324 CG1 ILE A 20 9.940 -7.220 -2.140 1.00 0.00 C ATOM 325 CG2 ILE A 20 11.620 -8.227 -0.568 1.00 0.00 C ATOM 326 CD1 ILE A 20 9.995 -8.173 -3.340 1.00 0.00 C ATOM 0 H ILE A 20 11.335 -4.786 -2.463 1.00 0.00 H new ATOM 0 HA ILE A 20 10.391 -5.815 0.100 1.00 0.00 H new ATOM 0 HB ILE A 20 12.100 -6.877 -2.129 1.00 0.00 H new ATOM 0 HG12 ILE A 20 9.217 -7.607 -1.422 1.00 0.00 H new ATOM 0 HG13 ILE A 20 9.566 -6.255 -2.480 1.00 0.00 H new ATOM 0 HG21 ILE A 20 11.645 -9.110 -1.207 1.00 0.00 H new ATOM 0 HG22 ILE A 20 12.593 -8.093 -0.096 1.00 0.00 H new ATOM 0 HG23 ILE A 20 10.859 -8.357 0.201 1.00 0.00 H new ATOM 0 HD11 ILE A 20 9.002 -8.261 -3.780 1.00 0.00 H new ATOM 0 HD12 ILE A 20 10.688 -7.781 -4.084 1.00 0.00 H new ATOM 0 HD13 ILE A 20 10.334 -9.155 -3.010 1.00 0.00 H new ATOM 338 N GLU A 21 13.546 -4.847 -0.271 1.00 0.00 N ATOM 339 CA GLU A 21 14.722 -4.434 0.498 1.00 0.00 C ATOM 340 C GLU A 21 14.379 -3.319 1.496 1.00 0.00 C ATOM 341 O GLU A 21 14.909 -3.307 2.609 1.00 0.00 O ATOM 342 CB GLU A 21 15.848 -3.898 -0.406 1.00 0.00 C ATOM 343 CG GLU A 21 16.386 -4.848 -1.479 1.00 0.00 C ATOM 344 CD GLU A 21 17.678 -4.303 -2.116 1.00 0.00 C ATOM 345 OE1 GLU A 21 17.599 -3.542 -3.108 1.00 0.00 O ATOM 346 OE2 GLU A 21 18.787 -4.643 -1.632 1.00 0.00 O ATOM 0 H GLU A 21 13.638 -4.700 -1.276 1.00 0.00 H new ATOM 0 HA GLU A 21 15.056 -5.330 1.021 1.00 0.00 H new ATOM 0 HB2 GLU A 21 15.486 -2.997 -0.901 1.00 0.00 H new ATOM 0 HB3 GLU A 21 16.681 -3.599 0.231 1.00 0.00 H new ATOM 0 HG2 GLU A 21 16.581 -5.825 -1.037 1.00 0.00 H new ATOM 0 HG3 GLU A 21 15.631 -4.992 -2.251 1.00 0.00 H new ATOM 353 N ASP A 22 13.502 -2.384 1.118 1.00 0.00 N ATOM 354 CA ASP A 22 13.137 -1.231 1.950 1.00 0.00 C ATOM 355 C ASP A 22 12.453 -1.682 3.233 1.00 0.00 C ATOM 356 O ASP A 22 12.753 -1.207 4.333 1.00 0.00 O ATOM 357 CB ASP A 22 12.162 -0.327 1.203 1.00 0.00 C ATOM 358 CG ASP A 22 11.804 0.901 2.060 1.00 0.00 C ATOM 359 OD1 ASP A 22 12.672 1.789 2.238 1.00 0.00 O ATOM 360 OD2 ASP A 22 10.649 0.989 2.540 1.00 0.00 O ATOM 0 H ASP A 22 13.021 -2.405 0.219 1.00 0.00 H new ATOM 0 HA ASP A 22 14.057 -0.695 2.184 1.00 0.00 H new ATOM 0 HB2 ASP A 22 12.605 -0.004 0.261 1.00 0.00 H new ATOM 0 HB3 ASP A 22 11.257 -0.883 0.956 1.00 0.00 H new ATOM 365 N ARG A 23 11.561 -2.659 3.071 1.00 0.00 N ATOM 366 CA ARG A 23 10.865 -3.324 4.166 1.00 0.00 C ATOM 367 C ARG A 23 11.803 -4.256 4.948 1.00 0.00 C ATOM 368 O ARG A 23 11.393 -4.813 5.965 1.00 0.00 O ATOM 369 CB ARG A 23 9.636 -4.049 3.592 1.00 0.00 C ATOM 370 CG ARG A 23 8.588 -3.050 3.084 1.00 0.00 C ATOM 371 CD ARG A 23 7.590 -3.703 2.121 1.00 0.00 C ATOM 372 NE ARG A 23 6.562 -2.729 1.699 1.00 0.00 N ATOM 373 CZ ARG A 23 6.715 -1.733 0.814 1.00 0.00 C ATOM 374 NH1 ARG A 23 7.850 -1.584 0.141 1.00 0.00 N ATOM 375 NH2 ARG A 23 5.723 -0.872 0.612 1.00 0.00 N ATOM 0 H ARG A 23 11.298 -3.016 2.153 1.00 0.00 H new ATOM 0 HA ARG A 23 10.523 -2.588 4.894 1.00 0.00 H new ATOM 0 HB2 ARG A 23 9.945 -4.702 2.776 1.00 0.00 H new ATOM 0 HB3 ARG A 23 9.194 -4.684 4.360 1.00 0.00 H new ATOM 0 HG2 ARG A 23 8.049 -2.627 3.932 1.00 0.00 H new ATOM 0 HG3 ARG A 23 9.089 -2.223 2.581 1.00 0.00 H new ATOM 0 HD2 ARG A 23 8.117 -4.086 1.247 1.00 0.00 H new ATOM 0 HD3 ARG A 23 7.114 -4.556 2.605 1.00 0.00 H new ATOM 0 HE ARG A 23 5.640 -2.824 2.125 1.00 0.00 H new ATOM 0 HH11 ARG A 23 8.622 -2.233 0.294 1.00 0.00 H new ATOM 0 HH12 ARG A 23 7.950 -0.821 -0.528 1.00 0.00 H new ATOM 0 HH21 ARG A 23 4.849 -0.970 1.129 1.00 0.00 H new ATOM 0 HH22 ARG A 23 5.835 -0.113 -0.060 1.00 0.00 H new ATOM 389 N GLY A 24 13.050 -4.421 4.499 1.00 0.00 N ATOM 390 CA GLY A 24 14.062 -5.232 5.158 1.00 0.00 C ATOM 391 C GLY A 24 13.890 -6.729 4.902 1.00 0.00 C ATOM 392 O GLY A 24 14.548 -7.537 5.565 1.00 0.00 O ATOM 0 H GLY A 24 13.387 -3.980 3.643 1.00 0.00 H new ATOM 0 HA2 GLY A 24 15.049 -4.922 4.814 1.00 0.00 H new ATOM 0 HA3 GLY A 24 14.026 -5.046 6.231 1.00 0.00 H new ATOM 396 N PHE A 25 13.021 -7.103 3.958 1.00 0.00 N ATOM 397 CA PHE A 25 12.934 -8.464 3.435 1.00 0.00 C ATOM 398 C PHE A 25 14.015 -8.626 2.347 1.00 0.00 C ATOM 399 O PHE A 25 14.833 -7.724 2.123 1.00 0.00 O ATOM 400 CB PHE A 25 11.502 -8.725 2.922 1.00 0.00 C ATOM 401 CG PHE A 25 10.442 -8.695 4.010 1.00 0.00 C ATOM 402 CD1 PHE A 25 9.999 -7.454 4.496 1.00 0.00 C ATOM 403 CD2 PHE A 25 9.919 -9.881 4.569 1.00 0.00 C ATOM 404 CE1 PHE A 25 9.113 -7.382 5.582 1.00 0.00 C ATOM 405 CE2 PHE A 25 9.040 -9.806 5.662 1.00 0.00 C ATOM 406 CZ PHE A 25 8.643 -8.560 6.180 1.00 0.00 C ATOM 0 H PHE A 25 12.353 -6.460 3.533 1.00 0.00 H new ATOM 0 HA PHE A 25 13.124 -9.210 4.206 1.00 0.00 H new ATOM 0 HB2 PHE A 25 11.255 -7.978 2.168 1.00 0.00 H new ATOM 0 HB3 PHE A 25 11.475 -9.697 2.429 1.00 0.00 H new ATOM 0 HD1 PHE A 25 10.344 -6.544 4.028 1.00 0.00 H new ATOM 0 HD2 PHE A 25 10.193 -10.841 4.158 1.00 0.00 H new ATOM 0 HE1 PHE A 25 8.794 -6.421 5.957 1.00 0.00 H new ATOM 0 HE2 PHE A 25 8.665 -10.715 6.109 1.00 0.00 H new ATOM 0 HZ PHE A 25 7.981 -8.511 7.032 1.00 0.00 H new ATOM 416 N ASP A 26 14.017 -9.758 1.638 1.00 0.00 N ATOM 417 CA ASP A 26 14.900 -9.998 0.497 1.00 0.00 C ATOM 418 C ASP A 26 14.082 -10.690 -0.575 1.00 0.00 C ATOM 419 O ASP A 26 13.194 -11.475 -0.233 1.00 0.00 O ATOM 420 CB ASP A 26 16.058 -10.918 0.883 1.00 0.00 C ATOM 421 CG ASP A 26 17.225 -10.757 -0.097 1.00 0.00 C ATOM 422 OD1 ASP A 26 17.174 -11.390 -1.177 1.00 0.00 O ATOM 423 OD2 ASP A 26 18.181 -10.004 0.208 1.00 0.00 O ATOM 0 H ASP A 26 13.398 -10.542 1.844 1.00 0.00 H new ATOM 0 HA ASP A 26 15.310 -9.049 0.152 1.00 0.00 H new ATOM 0 HB2 ASP A 26 16.391 -10.687 1.895 1.00 0.00 H new ATOM 0 HB3 ASP A 26 15.720 -11.954 0.887 1.00 0.00 H new ATOM 428 N ARG A 27 14.365 -10.444 -1.854 1.00 0.00 N ATOM 429 CA ARG A 27 13.637 -11.099 -2.938 1.00 0.00 C ATOM 430 C ARG A 27 13.719 -12.624 -2.831 1.00 0.00 C ATOM 431 O ARG A 27 12.739 -13.295 -3.149 1.00 0.00 O ATOM 432 CB ARG A 27 14.111 -10.570 -4.307 1.00 0.00 C ATOM 433 CG ARG A 27 15.540 -10.994 -4.695 1.00 0.00 C ATOM 434 CD ARG A 27 16.001 -10.312 -5.988 1.00 0.00 C ATOM 435 NE ARG A 27 17.349 -10.766 -6.379 1.00 0.00 N ATOM 436 CZ ARG A 27 17.660 -11.658 -7.332 1.00 0.00 C ATOM 437 NH1 ARG A 27 16.711 -12.247 -8.058 1.00 0.00 N ATOM 438 NH2 ARG A 27 18.936 -11.962 -7.557 1.00 0.00 N ATOM 0 H ARG A 27 15.091 -9.798 -2.163 1.00 0.00 H new ATOM 0 HA ARG A 27 12.581 -10.847 -2.845 1.00 0.00 H new ATOM 0 HB2 ARG A 27 13.421 -10.918 -5.076 1.00 0.00 H new ATOM 0 HB3 ARG A 27 14.058 -9.481 -4.300 1.00 0.00 H new ATOM 0 HG2 ARG A 27 16.226 -10.743 -3.886 1.00 0.00 H new ATOM 0 HG3 ARG A 27 15.577 -12.076 -4.821 1.00 0.00 H new ATOM 0 HD2 ARG A 27 15.294 -10.530 -6.789 1.00 0.00 H new ATOM 0 HD3 ARG A 27 16.004 -9.231 -5.851 1.00 0.00 H new ATOM 0 HE ARG A 27 18.131 -10.357 -5.868 1.00 0.00 H new ATOM 0 HH11 ARG A 27 15.730 -12.022 -7.894 1.00 0.00 H new ATOM 0 HH12 ARG A 27 16.966 -12.923 -8.778 1.00 0.00 H new ATOM 0 HH21 ARG A 27 19.671 -11.518 -7.006 1.00 0.00 H new ATOM 0 HH22 ARG A 27 19.179 -12.639 -8.280 1.00 0.00 H new ATOM 452 N GLU A 28 14.853 -13.169 -2.378 1.00 0.00 N ATOM 453 CA GLU A 28 14.977 -14.607 -2.177 1.00 0.00 C ATOM 454 C GLU A 28 14.249 -15.002 -0.894 1.00 0.00 C ATOM 455 O GLU A 28 13.485 -15.961 -0.880 1.00 0.00 O ATOM 456 CB GLU A 28 16.450 -15.031 -2.121 1.00 0.00 C ATOM 457 CG GLU A 28 17.145 -14.873 -3.477 1.00 0.00 C ATOM 458 CD GLU A 28 18.559 -15.479 -3.460 1.00 0.00 C ATOM 459 OE1 GLU A 28 19.530 -14.769 -3.098 1.00 0.00 O ATOM 460 OE2 GLU A 28 18.716 -16.671 -3.826 1.00 0.00 O ATOM 0 H GLU A 28 15.691 -12.635 -2.146 1.00 0.00 H new ATOM 0 HA GLU A 28 14.521 -15.124 -3.022 1.00 0.00 H new ATOM 0 HB2 GLU A 28 16.971 -14.432 -1.374 1.00 0.00 H new ATOM 0 HB3 GLU A 28 16.516 -16.070 -1.799 1.00 0.00 H new ATOM 0 HG2 GLU A 28 16.550 -15.358 -4.251 1.00 0.00 H new ATOM 0 HG3 GLU A 28 17.204 -13.816 -3.736 1.00 0.00 H new ATOM 467 N GLU A 29 14.445 -14.254 0.191 1.00 0.00 N ATOM 468 CA GLU A 29 13.931 -14.607 1.512 1.00 0.00 C ATOM 469 C GLU A 29 12.413 -14.717 1.518 1.00 0.00 C ATOM 470 O GLU A 29 11.873 -15.623 2.151 1.00 0.00 O ATOM 471 CB GLU A 29 14.408 -13.565 2.532 1.00 0.00 C ATOM 472 CG GLU A 29 15.903 -13.679 2.830 1.00 0.00 C ATOM 473 CD GLU A 29 16.208 -14.699 3.945 1.00 0.00 C ATOM 474 OE1 GLU A 29 16.154 -15.925 3.685 1.00 0.00 O ATOM 475 OE2 GLU A 29 16.495 -14.284 5.092 1.00 0.00 O ATOM 0 H GLU A 29 14.969 -13.379 0.177 1.00 0.00 H new ATOM 0 HA GLU A 29 14.318 -15.589 1.785 1.00 0.00 H new ATOM 0 HB2 GLU A 29 14.191 -12.566 2.154 1.00 0.00 H new ATOM 0 HB3 GLU A 29 13.846 -13.684 3.458 1.00 0.00 H new ATOM 0 HG2 GLU A 29 16.430 -13.971 1.921 1.00 0.00 H new ATOM 0 HG3 GLU A 29 16.287 -12.702 3.121 1.00 0.00 H new ATOM 482 N ILE A 30 11.745 -13.847 0.764 1.00 0.00 N ATOM 483 CA ILE A 30 10.300 -13.924 0.523 1.00 0.00 C ATOM 484 C ILE A 30 9.930 -15.319 -0.002 1.00 0.00 C ATOM 485 O ILE A 30 8.985 -15.919 0.504 1.00 0.00 O ATOM 486 CB ILE A 30 9.847 -12.819 -0.460 1.00 0.00 C ATOM 487 CG1 ILE A 30 10.057 -11.405 0.118 1.00 0.00 C ATOM 488 CG2 ILE A 30 8.393 -12.994 -0.945 1.00 0.00 C ATOM 489 CD1 ILE A 30 8.884 -10.770 0.889 1.00 0.00 C ATOM 0 H ILE A 30 12.194 -13.059 0.297 1.00 0.00 H new ATOM 0 HA ILE A 30 9.777 -13.760 1.465 1.00 0.00 H new ATOM 0 HB ILE A 30 10.491 -12.931 -1.333 1.00 0.00 H new ATOM 0 HG12 ILE A 30 10.919 -11.439 0.785 1.00 0.00 H new ATOM 0 HG13 ILE A 30 10.317 -10.740 -0.706 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.139 -12.186 -1.631 1.00 0.00 H new ATOM 0 HG22 ILE A 30 8.293 -13.951 -1.458 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.718 -12.969 -0.089 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.172 -9.778 1.238 1.00 0.00 H new ATOM 0 HD12 ILE A 30 8.019 -10.686 0.231 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.630 -11.396 1.745 1.00 0.00 H new ATOM 501 N TRP A 31 10.650 -15.857 -0.991 1.00 0.00 N ATOM 502 CA TRP A 31 10.344 -17.178 -1.545 1.00 0.00 C ATOM 503 C TRP A 31 10.625 -18.322 -0.557 1.00 0.00 C ATOM 504 O TRP A 31 10.047 -19.402 -0.716 1.00 0.00 O ATOM 505 CB TRP A 31 11.120 -17.433 -2.842 1.00 0.00 C ATOM 506 CG TRP A 31 10.837 -16.529 -4.009 1.00 0.00 C ATOM 507 CD1 TRP A 31 11.775 -15.857 -4.714 1.00 0.00 C ATOM 508 CD2 TRP A 31 9.564 -16.231 -4.667 1.00 0.00 C ATOM 509 NE1 TRP A 31 11.177 -15.152 -5.740 1.00 0.00 N ATOM 510 CE2 TRP A 31 9.813 -15.355 -5.768 1.00 0.00 C ATOM 511 CE3 TRP A 31 8.225 -16.627 -4.461 1.00 0.00 C ATOM 512 CZ2 TRP A 31 8.788 -14.898 -6.614 1.00 0.00 C ATOM 513 CZ3 TRP A 31 7.190 -16.172 -5.299 1.00 0.00 C ATOM 514 CH2 TRP A 31 7.463 -15.312 -6.378 1.00 0.00 C ATOM 0 H TRP A 31 11.450 -15.396 -1.425 1.00 0.00 H new ATOM 0 HA TRP A 31 9.274 -17.168 -1.753 1.00 0.00 H new ATOM 0 HB2 TRP A 31 12.184 -17.367 -2.616 1.00 0.00 H new ATOM 0 HB3 TRP A 31 10.924 -18.458 -3.155 1.00 0.00 H new ATOM 0 HD1 TRP A 31 12.835 -15.870 -4.506 1.00 0.00 H new ATOM 0 HE1 TRP A 31 11.681 -14.555 -6.396 1.00 0.00 H new ATOM 0 HE3 TRP A 31 7.990 -17.293 -3.644 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 9.014 -14.236 -7.437 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 6.174 -16.487 -5.111 1.00 0.00 H new ATOM 0 HH2 TRP A 31 6.664 -14.972 -7.020 1.00 0.00 H new ATOM 525 N TYR A 32 11.480 -18.113 0.453 1.00 0.00 N ATOM 526 CA TYR A 32 12.121 -19.200 1.200 1.00 0.00 C ATOM 527 C TYR A 32 11.812 -19.190 2.706 1.00 0.00 C ATOM 528 O TYR A 32 12.328 -20.037 3.440 1.00 0.00 O ATOM 529 CB TYR A 32 13.630 -19.182 0.892 1.00 0.00 C ATOM 530 CG TYR A 32 13.986 -19.373 -0.574 1.00 0.00 C ATOM 531 CD1 TYR A 32 13.421 -20.430 -1.314 1.00 0.00 C ATOM 532 CD2 TYR A 32 14.885 -18.491 -1.201 1.00 0.00 C ATOM 533 CE1 TYR A 32 13.713 -20.571 -2.678 1.00 0.00 C ATOM 534 CE2 TYR A 32 15.157 -18.606 -2.573 1.00 0.00 C ATOM 535 CZ TYR A 32 14.574 -19.654 -3.322 1.00 0.00 C ATOM 536 OH TYR A 32 14.838 -19.798 -4.655 1.00 0.00 O ATOM 0 H TYR A 32 11.746 -17.182 0.775 1.00 0.00 H new ATOM 0 HA TYR A 32 11.696 -20.146 0.864 1.00 0.00 H new ATOM 0 HB2 TYR A 32 14.044 -18.232 1.231 1.00 0.00 H new ATOM 0 HB3 TYR A 32 14.114 -19.966 1.474 1.00 0.00 H new ATOM 0 HD1 TYR A 32 12.761 -21.134 -0.829 1.00 0.00 H new ATOM 0 HD2 TYR A 32 15.370 -17.719 -0.622 1.00 0.00 H new ATOM 0 HE1 TYR A 32 13.278 -21.385 -3.239 1.00 0.00 H new ATOM 0 HE2 TYR A 32 15.811 -17.895 -3.056 1.00 0.00 H new ATOM 0 HH TYR A 32 15.446 -19.087 -4.947 1.00 0.00 H new ATOM 546 N ASN A 33 10.953 -18.283 3.182 1.00 0.00 N ATOM 547 CA ASN A 33 10.571 -18.134 4.580 1.00 0.00 C ATOM 548 C ASN A 33 9.065 -17.895 4.603 1.00 0.00 C ATOM 549 O ASN A 33 8.639 -16.742 4.586 1.00 0.00 O ATOM 550 CB ASN A 33 11.309 -16.931 5.187 1.00 0.00 C ATOM 551 CG ASN A 33 12.813 -17.114 5.289 1.00 0.00 C ATOM 552 OD1 ASN A 33 13.346 -17.625 6.272 1.00 0.00 O ATOM 553 ND2 ASN A 33 13.507 -16.661 4.264 1.00 0.00 N ATOM 0 H ASN A 33 10.489 -17.608 2.575 1.00 0.00 H new ATOM 0 HA ASN A 33 10.830 -19.019 5.161 1.00 0.00 H new ATOM 0 HB2 ASN A 33 11.101 -16.048 4.582 1.00 0.00 H new ATOM 0 HB3 ASN A 33 10.909 -16.737 6.182 1.00 0.00 H new ATOM 0 HD21 ASN A 33 14.525 -16.728 4.268 1.00 0.00 H new ATOM 0 HD22 ASN A 33 13.026 -16.244 3.467 1.00 0.00 H new ATOM 560 N ARG A 34 8.251 -18.958 4.554 1.00 0.00 N ATOM 561 CA ARG A 34 6.807 -18.881 4.291 1.00 0.00 C ATOM 562 C ARG A 34 6.087 -17.815 5.120 1.00 0.00 C ATOM 563 O ARG A 34 5.225 -17.098 4.602 1.00 0.00 O ATOM 564 CB ARG A 34 6.184 -20.272 4.491 1.00 0.00 C ATOM 565 CG ARG A 34 4.658 -20.273 4.298 1.00 0.00 C ATOM 566 CD ARG A 34 4.122 -21.707 4.222 1.00 0.00 C ATOM 567 NE ARG A 34 2.653 -21.734 4.100 1.00 0.00 N ATOM 568 CZ ARG A 34 1.889 -22.836 4.048 1.00 0.00 C ATOM 569 NH1 ARG A 34 2.438 -24.048 4.096 1.00 0.00 N ATOM 570 NH2 ARG A 34 0.567 -22.720 3.946 1.00 0.00 N ATOM 0 H ARG A 34 8.583 -19.912 4.698 1.00 0.00 H new ATOM 0 HA ARG A 34 6.677 -18.564 3.256 1.00 0.00 H new ATOM 0 HB2 ARG A 34 6.635 -20.972 3.788 1.00 0.00 H new ATOM 0 HB3 ARG A 34 6.419 -20.630 5.493 1.00 0.00 H new ATOM 0 HG2 ARG A 34 4.182 -19.745 5.124 1.00 0.00 H new ATOM 0 HG3 ARG A 34 4.402 -19.735 3.385 1.00 0.00 H new ATOM 0 HD2 ARG A 34 4.568 -22.217 3.368 1.00 0.00 H new ATOM 0 HD3 ARG A 34 4.423 -22.256 5.114 1.00 0.00 H new ATOM 0 HE ARG A 34 2.175 -20.835 4.051 1.00 0.00 H new ATOM 0 HH11 ARG A 34 3.450 -24.147 4.173 1.00 0.00 H new ATOM 0 HH12 ARG A 34 1.846 -24.878 4.056 1.00 0.00 H new ATOM 0 HH21 ARG A 34 0.138 -21.796 3.908 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -0.017 -23.556 3.906 1.00 0.00 H new ATOM 584 N GLU A 35 6.405 -17.700 6.408 1.00 0.00 N ATOM 585 CA GLU A 35 5.737 -16.743 7.272 1.00 0.00 C ATOM 586 C GLU A 35 6.195 -15.313 6.976 1.00 0.00 C ATOM 587 O GLU A 35 5.399 -14.378 7.067 1.00 0.00 O ATOM 588 CB GLU A 35 5.902 -17.115 8.757 1.00 0.00 C ATOM 589 CG GLU A 35 7.329 -17.100 9.335 1.00 0.00 C ATOM 590 CD GLU A 35 8.166 -18.325 8.918 1.00 0.00 C ATOM 591 OE1 GLU A 35 8.764 -18.303 7.816 1.00 0.00 O ATOM 592 OE2 GLU A 35 8.231 -19.310 9.695 1.00 0.00 O ATOM 0 H GLU A 35 7.121 -18.259 6.871 1.00 0.00 H new ATOM 0 HA GLU A 35 4.670 -16.785 7.055 1.00 0.00 H new ATOM 0 HB2 GLU A 35 5.292 -16.430 9.346 1.00 0.00 H new ATOM 0 HB3 GLU A 35 5.490 -18.114 8.902 1.00 0.00 H new ATOM 0 HG2 GLU A 35 7.837 -16.193 9.008 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.273 -17.060 10.423 1.00 0.00 H new ATOM 599 N ARG A 36 7.454 -15.126 6.562 1.00 0.00 N ATOM 600 CA ARG A 36 7.963 -13.833 6.151 1.00 0.00 C ATOM 601 C ARG A 36 7.494 -13.485 4.741 1.00 0.00 C ATOM 602 O ARG A 36 7.489 -12.304 4.397 1.00 0.00 O ATOM 603 CB ARG A 36 9.486 -13.803 6.255 1.00 0.00 C ATOM 604 CG ARG A 36 10.033 -13.985 7.684 1.00 0.00 C ATOM 605 CD ARG A 36 9.242 -13.220 8.765 1.00 0.00 C ATOM 606 NE ARG A 36 9.853 -13.357 10.096 1.00 0.00 N ATOM 607 CZ ARG A 36 9.272 -13.021 11.258 1.00 0.00 C ATOM 608 NH1 ARG A 36 8.038 -12.519 11.296 1.00 0.00 N ATOM 609 NH2 ARG A 36 9.941 -13.192 12.396 1.00 0.00 N ATOM 0 H ARG A 36 8.143 -15.876 6.506 1.00 0.00 H new ATOM 0 HA ARG A 36 7.564 -13.074 6.824 1.00 0.00 H new ATOM 0 HB2 ARG A 36 9.896 -14.588 5.620 1.00 0.00 H new ATOM 0 HB3 ARG A 36 9.846 -12.853 5.860 1.00 0.00 H new ATOM 0 HG2 ARG A 36 10.029 -15.047 7.930 1.00 0.00 H new ATOM 0 HG3 ARG A 36 11.072 -13.656 7.708 1.00 0.00 H new ATOM 0 HD2 ARG A 36 9.190 -12.165 8.497 1.00 0.00 H new ATOM 0 HD3 ARG A 36 8.218 -13.592 8.796 1.00 0.00 H new ATOM 0 HE ARG A 36 10.798 -13.739 10.139 1.00 0.00 H new ATOM 0 HH11 ARG A 36 7.516 -12.383 10.430 1.00 0.00 H new ATOM 0 HH12 ARG A 36 7.616 -12.270 12.191 1.00 0.00 H new ATOM 0 HH21 ARG A 36 10.886 -13.575 12.379 1.00 0.00 H new ATOM 0 HH22 ARG A 36 9.509 -12.940 13.285 1.00 0.00 H new ATOM 623 N SER A 37 7.071 -14.459 3.935 1.00 0.00 N ATOM 624 CA SER A 37 6.362 -14.149 2.708 1.00 0.00 C ATOM 625 C SER A 37 5.062 -13.444 3.097 1.00 0.00 C ATOM 626 O SER A 37 4.795 -12.356 2.604 1.00 0.00 O ATOM 627 CB SER A 37 6.063 -15.391 1.852 1.00 0.00 C ATOM 628 OG SER A 37 6.971 -16.451 2.069 1.00 0.00 O ATOM 0 H SER A 37 7.208 -15.454 4.112 1.00 0.00 H new ATOM 0 HA SER A 37 6.994 -13.512 2.090 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.052 -15.738 2.068 1.00 0.00 H new ATOM 0 HB3 SER A 37 6.086 -15.112 0.799 1.00 0.00 H new ATOM 0 HG SER A 37 7.771 -16.314 1.520 1.00 0.00 H new ATOM 634 N GLU A 38 4.278 -14.041 4.004 1.00 0.00 N ATOM 635 CA GLU A 38 2.922 -13.634 4.339 1.00 0.00 C ATOM 636 C GLU A 38 2.808 -12.149 4.697 1.00 0.00 C ATOM 637 O GLU A 38 1.817 -11.516 4.335 1.00 0.00 O ATOM 638 CB GLU A 38 2.420 -14.538 5.474 1.00 0.00 C ATOM 639 CG GLU A 38 0.909 -14.739 5.373 1.00 0.00 C ATOM 640 CD GLU A 38 0.375 -15.594 6.537 1.00 0.00 C ATOM 641 OE1 GLU A 38 0.415 -16.846 6.438 1.00 0.00 O ATOM 642 OE2 GLU A 38 -0.100 -15.023 7.548 1.00 0.00 O ATOM 0 H GLU A 38 4.590 -14.851 4.541 1.00 0.00 H new ATOM 0 HA GLU A 38 2.292 -13.754 3.458 1.00 0.00 H new ATOM 0 HB2 GLU A 38 2.925 -15.503 5.428 1.00 0.00 H new ATOM 0 HB3 GLU A 38 2.670 -14.094 6.438 1.00 0.00 H new ATOM 0 HG2 GLU A 38 0.411 -13.769 5.374 1.00 0.00 H new ATOM 0 HG3 GLU A 38 0.667 -15.221 4.426 1.00 0.00 H new ATOM 649 N GLU A 39 3.825 -11.569 5.336 1.00 0.00 N ATOM 650 CA GLU A 39 3.855 -10.176 5.758 1.00 0.00 C ATOM 651 C GLU A 39 3.626 -9.222 4.578 1.00 0.00 C ATOM 652 O GLU A 39 2.972 -8.190 4.723 1.00 0.00 O ATOM 653 CB GLU A 39 5.212 -9.845 6.407 1.00 0.00 C ATOM 654 CG GLU A 39 5.929 -10.956 7.179 1.00 0.00 C ATOM 655 CD GLU A 39 5.320 -11.373 8.535 1.00 0.00 C ATOM 656 OE1 GLU A 39 4.105 -11.183 8.782 1.00 0.00 O ATOM 657 OE2 GLU A 39 6.103 -11.869 9.386 1.00 0.00 O ATOM 0 H GLU A 39 4.676 -12.076 5.580 1.00 0.00 H new ATOM 0 HA GLU A 39 3.050 -10.040 6.480 1.00 0.00 H new ATOM 0 HB2 GLU A 39 5.883 -9.498 5.621 1.00 0.00 H new ATOM 0 HB3 GLU A 39 5.061 -9.008 7.089 1.00 0.00 H new ATOM 0 HG2 GLU A 39 5.971 -11.839 6.541 1.00 0.00 H new ATOM 0 HG3 GLU A 39 6.957 -10.639 7.353 1.00 0.00 H new ATOM 664 N LEU A 40 4.160 -9.580 3.406 1.00 0.00 N ATOM 665 CA LEU A 40 3.978 -8.837 2.163 1.00 0.00 C ATOM 666 C LEU A 40 2.487 -8.756 1.844 1.00 0.00 C ATOM 667 O LEU A 40 1.931 -7.670 1.672 1.00 0.00 O ATOM 668 CB LEU A 40 4.801 -9.523 1.055 1.00 0.00 C ATOM 669 CG LEU A 40 4.735 -9.005 -0.399 1.00 0.00 C ATOM 670 CD1 LEU A 40 4.047 -10.028 -1.303 1.00 0.00 C ATOM 671 CD2 LEU A 40 4.107 -7.623 -0.605 1.00 0.00 C ATOM 0 H LEU A 40 4.741 -10.411 3.297 1.00 0.00 H new ATOM 0 HA LEU A 40 4.339 -7.812 2.250 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.846 -9.490 1.362 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.507 -10.572 1.037 1.00 0.00 H new ATOM 0 HG LEU A 40 5.781 -8.874 -0.675 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.010 -9.645 -2.323 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.607 -10.963 -1.286 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.033 -10.206 -0.945 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.119 -7.372 -1.666 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.078 -7.634 -0.246 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.677 -6.878 -0.050 1.00 0.00 H new ATOM 683 N PHE A 41 1.833 -9.913 1.822 1.00 0.00 N ATOM 684 CA PHE A 41 0.430 -10.057 1.468 1.00 0.00 C ATOM 685 C PHE A 41 -0.463 -9.378 2.511 1.00 0.00 C ATOM 686 O PHE A 41 -1.509 -8.824 2.166 1.00 0.00 O ATOM 687 CB PHE A 41 0.087 -11.541 1.299 1.00 0.00 C ATOM 688 CG PHE A 41 1.014 -12.250 0.329 1.00 0.00 C ATOM 689 CD1 PHE A 41 2.269 -12.685 0.783 1.00 0.00 C ATOM 690 CD2 PHE A 41 0.682 -12.392 -1.031 1.00 0.00 C ATOM 691 CE1 PHE A 41 3.194 -13.261 -0.103 1.00 0.00 C ATOM 692 CE2 PHE A 41 1.605 -12.979 -1.918 1.00 0.00 C ATOM 693 CZ PHE A 41 2.859 -13.418 -1.456 1.00 0.00 C ATOM 0 H PHE A 41 2.279 -10.800 2.057 1.00 0.00 H new ATOM 0 HA PHE A 41 0.245 -9.559 0.516 1.00 0.00 H new ATOM 0 HB2 PHE A 41 0.138 -12.034 2.270 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -0.940 -11.634 0.947 1.00 0.00 H new ATOM 0 HD1 PHE A 41 2.526 -12.575 1.826 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -0.277 -12.052 -1.393 1.00 0.00 H new ATOM 0 HE1 PHE A 41 4.160 -13.582 0.256 1.00 0.00 H new ATOM 0 HE2 PHE A 41 1.348 -13.093 -2.961 1.00 0.00 H new ATOM 0 HZ PHE A 41 3.560 -13.874 -2.139 1.00 0.00 H new ATOM 703 N TRP A 42 -0.044 -9.371 3.777 1.00 0.00 N ATOM 704 CA TRP A 42 -0.706 -8.591 4.805 1.00 0.00 C ATOM 705 C TRP A 42 -0.585 -7.083 4.546 1.00 0.00 C ATOM 706 O TRP A 42 -1.591 -6.387 4.669 1.00 0.00 O ATOM 707 CB TRP A 42 -0.165 -8.979 6.187 1.00 0.00 C ATOM 708 CG TRP A 42 -0.776 -10.234 6.729 1.00 0.00 C ATOM 709 CD1 TRP A 42 -0.149 -11.423 6.881 1.00 0.00 C ATOM 710 CD2 TRP A 42 -2.161 -10.466 7.138 1.00 0.00 C ATOM 711 NE1 TRP A 42 -1.038 -12.362 7.358 1.00 0.00 N ATOM 712 CE2 TRP A 42 -2.302 -11.835 7.518 1.00 0.00 C ATOM 713 CE3 TRP A 42 -3.320 -9.660 7.200 1.00 0.00 C ATOM 714 CZ2 TRP A 42 -3.530 -12.377 7.931 1.00 0.00 C ATOM 715 CZ3 TRP A 42 -4.556 -10.192 7.613 1.00 0.00 C ATOM 716 CH2 TRP A 42 -4.665 -11.548 7.972 1.00 0.00 C ATOM 0 H TRP A 42 0.759 -9.904 4.110 1.00 0.00 H new ATOM 0 HA TRP A 42 -1.771 -8.821 4.777 1.00 0.00 H new ATOM 0 HB2 TRP A 42 0.916 -9.107 6.124 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -0.350 -8.162 6.885 1.00 0.00 H new ATOM 0 HD1 TRP A 42 0.892 -11.609 6.661 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -0.791 -13.329 7.567 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -3.256 -8.617 6.926 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -3.602 -13.417 8.213 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -5.427 -9.555 7.655 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -5.619 -11.951 8.279 1.00 0.00 H new ATOM 727 N GLU A 43 0.585 -6.560 4.175 1.00 0.00 N ATOM 728 CA GLU A 43 0.790 -5.131 4.003 1.00 0.00 C ATOM 729 C GLU A 43 -0.063 -4.591 2.845 1.00 0.00 C ATOM 730 O GLU A 43 -0.672 -3.527 2.951 1.00 0.00 O ATOM 731 CB GLU A 43 2.286 -4.894 3.740 1.00 0.00 C ATOM 732 CG GLU A 43 2.697 -3.422 3.775 1.00 0.00 C ATOM 733 CD GLU A 43 2.745 -2.873 5.215 1.00 0.00 C ATOM 734 OE1 GLU A 43 1.694 -2.440 5.745 1.00 0.00 O ATOM 735 OE2 GLU A 43 3.842 -2.862 5.823 1.00 0.00 O ATOM 0 H GLU A 43 1.415 -7.121 3.986 1.00 0.00 H new ATOM 0 HA GLU A 43 0.481 -4.599 4.903 1.00 0.00 H new ATOM 0 HB2 GLU A 43 2.866 -5.441 4.483 1.00 0.00 H new ATOM 0 HB3 GLU A 43 2.544 -5.310 2.766 1.00 0.00 H new ATOM 0 HG2 GLU A 43 3.676 -3.307 3.310 1.00 0.00 H new ATOM 0 HG3 GLU A 43 1.993 -2.834 3.186 1.00 0.00 H new ATOM 742 N VAL A 44 -0.143 -5.326 1.736 1.00 0.00 N ATOM 743 CA VAL A 44 -0.942 -4.917 0.598 1.00 0.00 C ATOM 744 C VAL A 44 -2.430 -4.975 0.893 1.00 0.00 C ATOM 745 O VAL A 44 -3.158 -4.052 0.539 1.00 0.00 O ATOM 746 CB VAL A 44 -0.598 -5.771 -0.614 1.00 0.00 C ATOM 747 CG1 VAL A 44 0.839 -5.471 -1.022 1.00 0.00 C ATOM 748 CG2 VAL A 44 -0.730 -7.272 -0.401 1.00 0.00 C ATOM 0 H VAL A 44 0.343 -6.214 1.609 1.00 0.00 H new ATOM 0 HA VAL A 44 -0.702 -3.876 0.382 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.324 -5.508 -1.384 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.104 -6.074 -1.890 1.00 0.00 H new ATOM 0 HG12 VAL A 44 0.933 -4.414 -1.272 1.00 0.00 H new ATOM 0 HG13 VAL A 44 1.509 -5.709 -0.196 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -0.464 -7.795 -1.320 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -0.062 -7.586 0.401 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.759 -7.512 -0.132 1.00 0.00 H new ATOM 758 N MET A 45 -2.889 -6.047 1.536 1.00 0.00 N ATOM 759 CA MET A 45 -4.261 -6.167 1.957 1.00 0.00 C ATOM 760 C MET A 45 -4.605 -5.014 2.911 1.00 0.00 C ATOM 761 O MET A 45 -5.678 -4.421 2.802 1.00 0.00 O ATOM 762 CB MET A 45 -4.452 -7.557 2.565 1.00 0.00 C ATOM 763 CG MET A 45 -5.895 -7.782 2.990 1.00 0.00 C ATOM 764 SD MET A 45 -7.173 -7.516 1.720 1.00 0.00 S ATOM 765 CE MET A 45 -6.712 -8.764 0.484 1.00 0.00 C ATOM 0 H MET A 45 -2.310 -6.852 1.775 1.00 0.00 H new ATOM 0 HA MET A 45 -4.955 -6.081 1.121 1.00 0.00 H new ATOM 0 HB2 MET A 45 -4.162 -8.317 1.839 1.00 0.00 H new ATOM 0 HB3 MET A 45 -3.795 -7.673 3.427 1.00 0.00 H new ATOM 0 HG2 MET A 45 -5.986 -8.805 3.356 1.00 0.00 H new ATOM 0 HG3 MET A 45 -6.109 -7.122 3.831 1.00 0.00 H new ATOM 0 HE1 MET A 45 -7.418 -8.732 -0.346 1.00 0.00 H new ATOM 0 HE2 MET A 45 -5.708 -8.557 0.115 1.00 0.00 H new ATOM 0 HE3 MET A 45 -6.734 -9.754 0.940 1.00 0.00 H new ATOM 775 N ASP A 46 -3.688 -4.638 3.803 1.00 0.00 N ATOM 776 CA ASP A 46 -3.871 -3.495 4.688 1.00 0.00 C ATOM 777 C ASP A 46 -4.014 -2.185 3.907 1.00 0.00 C ATOM 778 O ASP A 46 -4.857 -1.349 4.243 1.00 0.00 O ATOM 779 CB ASP A 46 -2.710 -3.379 5.675 1.00 0.00 C ATOM 780 CG ASP A 46 -2.954 -2.188 6.615 1.00 0.00 C ATOM 781 OD1 ASP A 46 -3.781 -2.320 7.550 1.00 0.00 O ATOM 782 OD2 ASP A 46 -2.318 -1.121 6.437 1.00 0.00 O ATOM 0 H ASP A 46 -2.798 -5.120 3.930 1.00 0.00 H new ATOM 0 HA ASP A 46 -4.796 -3.666 5.239 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.616 -4.299 6.253 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -1.772 -3.244 5.136 1.00 0.00 H new ATOM 787 N GLU A 47 -3.254 -2.029 2.823 1.00 0.00 N ATOM 788 CA GLU A 47 -3.293 -0.891 1.922 1.00 0.00 C ATOM 789 C GLU A 47 -4.648 -0.732 1.201 1.00 0.00 C ATOM 790 O GLU A 47 -4.906 0.333 0.635 1.00 0.00 O ATOM 791 CB GLU A 47 -2.145 -1.030 0.903 1.00 0.00 C ATOM 792 CG GLU A 47 -0.950 -0.117 1.177 1.00 0.00 C ATOM 793 CD GLU A 47 -1.305 1.374 1.034 1.00 0.00 C ATOM 794 OE1 GLU A 47 -1.246 1.910 -0.097 1.00 0.00 O ATOM 795 OE2 GLU A 47 -1.619 2.032 2.056 1.00 0.00 O ATOM 0 H GLU A 47 -2.566 -2.727 2.542 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.168 0.013 2.518 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -1.803 -2.065 0.897 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.531 -0.816 -0.094 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -0.577 -0.304 2.184 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -0.143 -0.363 0.487 1.00 0.00 H new ATOM 802 N VAL A 48 -5.520 -1.747 1.230 1.00 0.00 N ATOM 803 CA VAL A 48 -6.833 -1.732 0.569 1.00 0.00 C ATOM 804 C VAL A 48 -7.975 -2.000 1.557 1.00 0.00 C ATOM 805 O VAL A 48 -9.150 -1.893 1.195 1.00 0.00 O ATOM 806 CB VAL A 48 -6.848 -2.706 -0.627 1.00 0.00 C ATOM 807 CG1 VAL A 48 -5.797 -2.318 -1.673 1.00 0.00 C ATOM 808 CG2 VAL A 48 -6.581 -4.159 -0.219 1.00 0.00 C ATOM 0 H VAL A 48 -5.330 -2.619 1.723 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.004 -0.729 0.178 1.00 0.00 H new ATOM 0 HB VAL A 48 -7.853 -2.633 -1.042 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -5.832 -3.023 -2.503 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -6.004 -1.313 -2.041 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -4.806 -2.341 -1.219 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -6.604 -4.795 -1.104 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -5.601 -4.230 0.253 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -7.347 -4.486 0.484 1.00 0.00 H new ATOM 818 N HIS A 49 -7.653 -2.312 2.812 1.00 0.00 N ATOM 819 CA HIS A 49 -8.611 -2.666 3.847 1.00 0.00 C ATOM 820 C HIS A 49 -9.689 -1.612 4.107 1.00 0.00 C ATOM 821 O HIS A 49 -10.722 -1.967 4.665 1.00 0.00 O ATOM 822 CB HIS A 49 -7.875 -3.046 5.137 1.00 0.00 C ATOM 823 CG HIS A 49 -8.239 -4.422 5.627 1.00 0.00 C ATOM 824 ND1 HIS A 49 -8.726 -4.765 6.868 1.00 0.00 N ATOM 825 CD2 HIS A 49 -8.139 -5.573 4.896 1.00 0.00 C ATOM 826 CE1 HIS A 49 -8.909 -6.097 6.882 1.00 0.00 C ATOM 827 NE2 HIS A 49 -8.564 -6.641 5.697 1.00 0.00 N ATOM 0 H HIS A 49 -6.688 -2.324 3.142 1.00 0.00 H new ATOM 0 HA HIS A 49 -9.159 -3.529 3.469 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -6.800 -2.998 4.965 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -8.107 -2.315 5.912 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -7.792 -5.646 3.876 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -9.282 -6.656 7.728 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -8.604 -7.627 5.438 1.00 0.00 H new ATOM 835 N GLU A 50 -9.513 -0.351 3.695 1.00 0.00 N ATOM 836 CA GLU A 50 -10.570 0.644 3.868 1.00 0.00 C ATOM 837 C GLU A 50 -11.815 0.332 3.019 1.00 0.00 C ATOM 838 O GLU A 50 -12.894 0.856 3.312 1.00 0.00 O ATOM 839 CB GLU A 50 -10.041 2.054 3.589 1.00 0.00 C ATOM 840 CG GLU A 50 -8.991 2.499 4.615 1.00 0.00 C ATOM 841 CD GLU A 50 -9.532 2.566 6.057 1.00 0.00 C ATOM 842 OE1 GLU A 50 -10.336 3.479 6.367 1.00 0.00 O ATOM 843 OE2 GLU A 50 -9.127 1.733 6.905 1.00 0.00 O ATOM 0 H GLU A 50 -8.665 -0.003 3.248 1.00 0.00 H new ATOM 0 HA GLU A 50 -10.887 0.598 4.910 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -9.605 2.084 2.591 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -10.872 2.759 3.595 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -8.148 1.809 4.583 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -8.611 3.480 4.332 1.00 0.00 H new ATOM 850 N GLU A 51 -11.699 -0.538 2.007 1.00 0.00 N ATOM 851 CA GLU A 51 -12.837 -1.187 1.371 1.00 0.00 C ATOM 852 C GLU A 51 -12.824 -2.693 1.637 1.00 0.00 C ATOM 853 O GLU A 51 -13.884 -3.291 1.821 1.00 0.00 O ATOM 854 CB GLU A 51 -12.821 -0.930 -0.136 1.00 0.00 C ATOM 855 CG GLU A 51 -13.353 0.473 -0.430 1.00 0.00 C ATOM 856 CD GLU A 51 -13.568 0.705 -1.937 1.00 0.00 C ATOM 857 OE1 GLU A 51 -14.299 -0.087 -2.582 1.00 0.00 O ATOM 858 OE2 GLU A 51 -13.003 1.679 -2.492 1.00 0.00 O ATOM 0 H GLU A 51 -10.800 -0.809 1.608 1.00 0.00 H new ATOM 0 HA GLU A 51 -13.747 -0.765 1.797 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -11.806 -1.032 -0.520 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -13.431 -1.674 -0.647 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -14.295 0.621 0.098 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -12.652 1.214 -0.046 1.00 0.00 H new ATOM 865 N GLU A 52 -11.651 -3.329 1.667 1.00 0.00 N ATOM 866 CA GLU A 52 -11.594 -4.776 1.826 1.00 0.00 C ATOM 867 C GLU A 52 -12.055 -5.233 3.221 1.00 0.00 C ATOM 868 O GLU A 52 -12.360 -6.416 3.370 1.00 0.00 O ATOM 869 CB GLU A 52 -10.227 -5.345 1.436 1.00 0.00 C ATOM 870 CG GLU A 52 -9.872 -5.087 -0.033 1.00 0.00 C ATOM 871 CD GLU A 52 -10.934 -5.559 -1.037 1.00 0.00 C ATOM 872 OE1 GLU A 52 -11.338 -6.743 -0.948 1.00 0.00 O ATOM 873 OE2 GLU A 52 -11.332 -4.750 -1.910 1.00 0.00 O ATOM 0 H GLU A 52 -10.744 -2.870 1.584 1.00 0.00 H new ATOM 0 HA GLU A 52 -12.312 -5.197 1.122 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -9.460 -4.904 2.073 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -10.219 -6.419 1.624 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -9.708 -4.018 -0.172 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -8.929 -5.586 -0.259 1.00 0.00 H new ATOM 880 N GLU A 53 -12.201 -4.341 4.218 1.00 0.00 N ATOM 881 CA GLU A 53 -12.865 -4.699 5.473 1.00 0.00 C ATOM 882 C GLU A 53 -14.295 -5.216 5.242 1.00 0.00 C ATOM 883 O GLU A 53 -14.787 -6.020 6.036 1.00 0.00 O ATOM 884 CB GLU A 53 -12.863 -3.534 6.481 1.00 0.00 C ATOM 885 CG GLU A 53 -13.737 -2.332 6.079 1.00 0.00 C ATOM 886 CD GLU A 53 -13.725 -1.244 7.174 1.00 0.00 C ATOM 887 OE1 GLU A 53 -14.422 -1.412 8.207 1.00 0.00 O ATOM 888 OE2 GLU A 53 -13.034 -0.208 7.019 1.00 0.00 O ATOM 0 H GLU A 53 -11.870 -3.377 4.175 1.00 0.00 H new ATOM 0 HA GLU A 53 -12.283 -5.513 5.905 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -13.204 -3.907 7.447 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -11.837 -3.191 6.616 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -13.374 -1.912 5.141 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -14.760 -2.665 5.904 1.00 0.00 H new ATOM 895 N PHE A 54 -14.962 -4.792 4.160 1.00 0.00 N ATOM 896 CA PHE A 54 -16.309 -5.246 3.819 1.00 0.00 C ATOM 897 C PHE A 54 -16.298 -6.631 3.149 1.00 0.00 C ATOM 898 O PHE A 54 -17.369 -7.174 2.864 1.00 0.00 O ATOM 899 CB PHE A 54 -16.992 -4.231 2.884 1.00 0.00 C ATOM 900 CG PHE A 54 -16.963 -2.779 3.337 1.00 0.00 C ATOM 901 CD1 PHE A 54 -17.393 -2.419 4.630 1.00 0.00 C ATOM 902 CD2 PHE A 54 -16.521 -1.780 2.449 1.00 0.00 C ATOM 903 CE1 PHE A 54 -17.355 -1.073 5.037 1.00 0.00 C ATOM 904 CE2 PHE A 54 -16.485 -0.434 2.856 1.00 0.00 C ATOM 905 CZ PHE A 54 -16.897 -0.081 4.153 1.00 0.00 C ATOM 0 H PHE A 54 -14.577 -4.121 3.496 1.00 0.00 H new ATOM 0 HA PHE A 54 -16.868 -5.326 4.751 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -16.518 -4.294 1.904 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -18.032 -4.529 2.755 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -17.752 -3.178 5.309 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -16.208 -2.048 1.451 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -17.678 -0.801 6.031 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -16.141 0.328 2.172 1.00 0.00 H new ATOM 0 HZ PHE A 54 -16.862 0.951 4.470 1.00 0.00 H new ATOM 915 N ALA A 55 -15.115 -7.184 2.853 1.00 0.00 N ATOM 916 CA ALA A 55 -14.935 -8.344 1.984 1.00 0.00 C ATOM 917 C ALA A 55 -13.776 -9.228 2.470 1.00 0.00 C ATOM 918 O ALA A 55 -13.038 -9.796 1.658 1.00 0.00 O ATOM 919 CB ALA A 55 -14.751 -7.858 0.543 1.00 0.00 C ATOM 0 H ALA A 55 -14.236 -6.824 3.224 1.00 0.00 H new ATOM 0 HA ALA A 55 -15.822 -8.977 2.019 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -14.616 -8.716 -0.116 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -15.633 -7.298 0.233 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -13.873 -7.214 0.485 1.00 0.00 H new ATOM 925 N VAL A 56 -13.622 -9.353 3.790 1.00 0.00 N ATOM 926 CA VAL A 56 -12.697 -10.274 4.450 1.00 0.00 C ATOM 927 C VAL A 56 -13.554 -11.239 5.272 1.00 0.00 C ATOM 928 O VAL A 56 -13.617 -11.217 6.502 1.00 0.00 O ATOM 929 CB VAL A 56 -11.557 -9.522 5.171 1.00 0.00 C ATOM 930 CG1 VAL A 56 -12.035 -8.464 6.175 1.00 0.00 C ATOM 931 CG2 VAL A 56 -10.603 -10.515 5.846 1.00 0.00 C ATOM 0 H VAL A 56 -14.159 -8.794 4.453 1.00 0.00 H new ATOM 0 HA VAL A 56 -12.125 -10.886 3.753 1.00 0.00 H new ATOM 0 HB VAL A 56 -11.028 -8.971 4.394 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -11.172 -7.984 6.636 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -12.633 -7.715 5.657 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -12.640 -8.941 6.946 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -9.806 -9.969 6.349 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -11.153 -11.109 6.576 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -10.172 -11.174 5.093 1.00 0.00 H new ATOM 941 N GLU A 57 -14.327 -12.035 4.537 1.00 0.00 N ATOM 942 CA GLU A 57 -15.402 -12.857 5.076 1.00 0.00 C ATOM 943 C GLU A 57 -15.615 -14.079 4.161 1.00 0.00 C ATOM 944 O GLU A 57 -16.739 -14.519 3.905 1.00 0.00 O ATOM 945 CB GLU A 57 -16.644 -11.971 5.261 1.00 0.00 C ATOM 946 CG GLU A 57 -17.044 -11.134 4.030 1.00 0.00 C ATOM 947 CD GLU A 57 -18.540 -10.764 4.063 1.00 0.00 C ATOM 948 OE1 GLU A 57 -18.968 -10.004 4.965 1.00 0.00 O ATOM 949 OE2 GLU A 57 -19.304 -11.230 3.180 1.00 0.00 O ATOM 0 H GLU A 57 -14.219 -12.127 3.527 1.00 0.00 H new ATOM 0 HA GLU A 57 -15.159 -13.262 6.058 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -17.486 -12.606 5.537 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -16.467 -11.295 6.098 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -16.444 -10.225 3.996 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -16.826 -11.694 3.121 1.00 0.00 H new ATOM 956 N GLY A 58 -14.510 -14.593 3.624 1.00 0.00 N ATOM 957 CA GLY A 58 -14.454 -15.649 2.624 1.00 0.00 C ATOM 958 C GLY A 58 -13.013 -16.132 2.463 1.00 0.00 C ATOM 959 O GLY A 58 -12.124 -15.682 3.199 1.00 0.00 O ATOM 0 H GLY A 58 -13.582 -14.264 3.891 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -15.095 -16.479 2.922 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -14.833 -15.280 1.671 1.00 0.00 H new ATOM 963 N PRO A 59 -12.773 -17.055 1.520 1.00 0.00 N ATOM 964 CA PRO A 59 -11.442 -17.558 1.209 1.00 0.00 C ATOM 965 C PRO A 59 -10.568 -16.454 0.601 1.00 0.00 C ATOM 966 O PRO A 59 -11.051 -15.387 0.211 1.00 0.00 O ATOM 967 CB PRO A 59 -11.669 -18.723 0.245 1.00 0.00 C ATOM 968 CG PRO A 59 -12.962 -18.332 -0.455 1.00 0.00 C ATOM 969 CD PRO A 59 -13.764 -17.645 0.637 1.00 0.00 C ATOM 0 HA PRO A 59 -10.904 -17.889 2.097 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -10.844 -18.832 -0.459 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -11.765 -19.672 0.772 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -12.777 -17.665 -1.297 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -13.485 -19.204 -0.849 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -14.425 -16.884 0.221 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -14.394 -18.357 1.171 1.00 0.00 H new ATOM 977 N LEU A 60 -9.272 -16.743 0.468 1.00 0.00 N ATOM 978 CA LEU A 60 -8.275 -15.861 -0.136 1.00 0.00 C ATOM 979 C LEU A 60 -7.389 -16.729 -1.027 1.00 0.00 C ATOM 980 O LEU A 60 -7.153 -17.905 -0.727 1.00 0.00 O ATOM 981 CB LEU A 60 -7.450 -15.149 0.957 1.00 0.00 C ATOM 982 CG LEU A 60 -7.226 -13.639 0.733 1.00 0.00 C ATOM 983 CD1 LEU A 60 -6.381 -13.080 1.884 1.00 0.00 C ATOM 984 CD2 LEU A 60 -6.535 -13.292 -0.593 1.00 0.00 C ATOM 0 H LEU A 60 -8.876 -17.627 0.789 1.00 0.00 H new ATOM 0 HA LEU A 60 -8.751 -15.079 -0.728 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.951 -15.287 1.915 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.478 -15.637 1.032 1.00 0.00 H new ATOM 0 HG LEU A 60 -8.218 -13.189 0.696 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -6.219 -12.013 1.732 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -6.903 -13.237 2.828 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -5.419 -13.593 1.912 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -6.417 -12.211 -0.670 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.555 -13.768 -0.628 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -7.142 -13.650 -1.424 1.00 0.00 H new ATOM 996 N TRP A 61 -6.902 -16.148 -2.117 1.00 0.00 N ATOM 997 CA TRP A 61 -6.312 -16.839 -3.251 1.00 0.00 C ATOM 998 C TRP A 61 -5.166 -15.975 -3.761 1.00 0.00 C ATOM 999 O TRP A 61 -5.287 -14.749 -3.741 1.00 0.00 O ATOM 1000 CB TRP A 61 -7.394 -16.932 -4.329 1.00 0.00 C ATOM 1001 CG TRP A 61 -8.615 -17.744 -4.016 1.00 0.00 C ATOM 1002 CD1 TRP A 61 -9.742 -17.294 -3.414 1.00 0.00 C ATOM 1003 CD2 TRP A 61 -8.860 -19.145 -4.318 1.00 0.00 C ATOM 1004 NE1 TRP A 61 -10.663 -18.324 -3.329 1.00 0.00 N ATOM 1005 CE2 TRP A 61 -10.165 -19.495 -3.863 1.00 0.00 C ATOM 1006 CE3 TRP A 61 -8.101 -20.150 -4.945 1.00 0.00 C ATOM 1007 CZ2 TRP A 61 -10.682 -20.791 -4.013 1.00 0.00 C ATOM 1008 CZ3 TRP A 61 -8.608 -21.454 -5.102 1.00 0.00 C ATOM 1009 CH2 TRP A 61 -9.896 -21.775 -4.636 1.00 0.00 C ATOM 0 H TRP A 61 -6.909 -15.135 -2.237 1.00 0.00 H new ATOM 0 HA TRP A 61 -5.947 -17.832 -2.989 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -7.716 -15.919 -4.570 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -6.938 -17.344 -5.229 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -9.898 -16.287 -3.056 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -11.594 -18.229 -2.922 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -7.112 -19.917 -5.312 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -11.672 -21.029 -3.654 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -8.006 -22.211 -5.582 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -10.280 -22.777 -4.757 1.00 0.00 H new ATOM 1020 N ILE A 62 -4.072 -16.581 -4.230 1.00 0.00 N ATOM 1021 CA ILE A 62 -2.834 -15.873 -4.548 1.00 0.00 C ATOM 1022 C ILE A 62 -2.300 -16.429 -5.880 1.00 0.00 C ATOM 1023 O ILE A 62 -2.291 -17.646 -6.087 1.00 0.00 O ATOM 1024 CB ILE A 62 -1.784 -16.061 -3.413 1.00 0.00 C ATOM 1025 CG1 ILE A 62 -2.307 -16.099 -1.951 1.00 0.00 C ATOM 1026 CG2 ILE A 62 -0.675 -15.000 -3.523 1.00 0.00 C ATOM 1027 CD1 ILE A 62 -2.793 -14.767 -1.355 1.00 0.00 C ATOM 0 H ILE A 62 -4.023 -17.585 -4.400 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.026 -14.804 -4.637 1.00 0.00 H new ATOM 0 HB ILE A 62 -1.412 -17.069 -3.594 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.129 -16.813 -1.902 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -1.511 -16.486 -1.315 1.00 0.00 H new ATOM 0 HG21 ILE A 62 0.050 -15.147 -2.722 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.175 -15.095 -4.487 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -1.113 -14.006 -3.438 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.132 -14.928 -0.332 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -1.974 -14.047 -1.357 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.618 -14.380 -1.953 1.00 0.00 H new ATOM 1039 N GLN A 63 -1.816 -15.547 -6.757 1.00 0.00 N ATOM 1040 CA GLN A 63 -1.074 -15.855 -7.980 1.00 0.00 C ATOM 1041 C GLN A 63 0.112 -14.881 -8.063 1.00 0.00 C ATOM 1042 O GLN A 63 0.010 -13.740 -7.616 1.00 0.00 O ATOM 1043 CB GLN A 63 -2.048 -15.740 -9.172 1.00 0.00 C ATOM 1044 CG GLN A 63 -1.409 -15.967 -10.552 1.00 0.00 C ATOM 1045 CD GLN A 63 -2.447 -15.974 -11.683 1.00 0.00 C ATOM 1046 OE1 GLN A 63 -3.503 -16.596 -11.589 1.00 0.00 O ATOM 1047 NE2 GLN A 63 -2.179 -15.280 -12.783 1.00 0.00 N ATOM 0 H GLN A 63 -1.938 -14.543 -6.625 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.670 -16.867 -7.991 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -2.852 -16.463 -9.037 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -2.503 -14.750 -9.157 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -0.674 -15.185 -10.742 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -0.872 -16.916 -10.549 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -1.302 -14.764 -12.860 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -2.850 -15.263 -13.551 1.00 0.00 H new ATOM 1056 N VAL A 64 1.244 -15.297 -8.629 1.00 0.00 N ATOM 1057 CA VAL A 64 2.470 -14.490 -8.654 1.00 0.00 C ATOM 1058 C VAL A 64 3.249 -14.777 -9.938 1.00 0.00 C ATOM 1059 O VAL A 64 3.140 -15.870 -10.498 1.00 0.00 O ATOM 1060 CB VAL A 64 3.273 -14.750 -7.362 1.00 0.00 C ATOM 1061 CG1 VAL A 64 3.931 -16.139 -7.320 1.00 0.00 C ATOM 1062 CG2 VAL A 64 4.318 -13.649 -7.146 1.00 0.00 C ATOM 0 H VAL A 64 1.340 -16.204 -9.085 1.00 0.00 H new ATOM 0 HA VAL A 64 2.241 -13.424 -8.671 1.00 0.00 H new ATOM 0 HB VAL A 64 2.553 -14.729 -6.544 1.00 0.00 H new ATOM 0 HG11 VAL A 64 4.479 -16.254 -6.385 1.00 0.00 H new ATOM 0 HG12 VAL A 64 3.162 -16.908 -7.387 1.00 0.00 H new ATOM 0 HG13 VAL A 64 4.620 -16.241 -8.159 1.00 0.00 H new ATOM 0 HG21 VAL A 64 4.874 -13.850 -6.230 1.00 0.00 H new ATOM 0 HG22 VAL A 64 5.006 -13.629 -7.991 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.818 -12.684 -7.063 1.00 0.00 H new ATOM 1072 N GLN A 65 4.068 -13.819 -10.384 1.00 0.00 N ATOM 1073 CA GLN A 65 5.138 -14.068 -11.325 1.00 0.00 C ATOM 1074 C GLN A 65 6.306 -13.154 -10.970 1.00 0.00 C ATOM 1075 O GLN A 65 6.105 -12.045 -10.468 1.00 0.00 O ATOM 1076 CB GLN A 65 4.667 -13.833 -12.768 1.00 0.00 C ATOM 1077 CG GLN A 65 3.949 -12.500 -13.027 1.00 0.00 C ATOM 1078 CD GLN A 65 2.433 -12.609 -12.904 1.00 0.00 C ATOM 1079 OE1 GLN A 65 1.753 -13.119 -13.789 1.00 0.00 O ATOM 1080 NE2 GLN A 65 1.853 -12.127 -11.817 1.00 0.00 N ATOM 0 H GLN A 65 3.997 -12.844 -10.093 1.00 0.00 H new ATOM 0 HA GLN A 65 5.454 -15.109 -11.262 1.00 0.00 H new ATOM 0 HB2 GLN A 65 5.533 -13.892 -13.427 1.00 0.00 H new ATOM 0 HB3 GLN A 65 3.997 -14.646 -13.049 1.00 0.00 H new ATOM 0 HG2 GLN A 65 4.313 -11.754 -12.321 1.00 0.00 H new ATOM 0 HG3 GLN A 65 4.203 -12.144 -14.026 1.00 0.00 H new ATOM 0 HE21 GLN A 65 2.419 -11.703 -11.082 1.00 0.00 H new ATOM 0 HE22 GLN A 65 0.840 -12.179 -11.714 1.00 0.00 H new ATOM 1089 N ALA A 66 7.516 -13.617 -11.265 1.00 0.00 N ATOM 1090 CA ALA A 66 8.723 -12.806 -11.200 1.00 0.00 C ATOM 1091 C ALA A 66 8.898 -12.076 -12.534 1.00 0.00 C ATOM 1092 O ALA A 66 8.559 -12.602 -13.598 1.00 0.00 O ATOM 1093 CB ALA A 66 9.933 -13.702 -10.912 1.00 0.00 C ATOM 0 H ALA A 66 7.687 -14.579 -11.560 1.00 0.00 H new ATOM 0 HA ALA A 66 8.641 -12.073 -10.397 1.00 0.00 H new ATOM 0 HB1 ALA A 66 10.835 -13.091 -10.864 1.00 0.00 H new ATOM 0 HB2 ALA A 66 9.789 -14.212 -9.960 1.00 0.00 H new ATOM 0 HB3 ALA A 66 10.037 -14.440 -11.707 1.00 0.00 H new ATOM 1099 N LEU A 67 9.454 -10.872 -12.460 1.00 0.00 N ATOM 1100 CA LEU A 67 9.769 -9.963 -13.551 1.00 0.00 C ATOM 1101 C LEU A 67 11.242 -9.549 -13.424 1.00 0.00 C ATOM 1102 O LEU A 67 11.942 -9.994 -12.512 1.00 0.00 O ATOM 1103 CB LEU A 67 8.823 -8.748 -13.486 1.00 0.00 C ATOM 1104 CG LEU A 67 7.351 -9.148 -13.713 1.00 0.00 C ATOM 1105 CD1 LEU A 67 6.602 -9.283 -12.407 1.00 0.00 C ATOM 1106 CD2 LEU A 67 6.604 -8.109 -14.542 1.00 0.00 C ATOM 0 H LEU A 67 9.717 -10.475 -11.558 1.00 0.00 H new ATOM 0 HA LEU A 67 9.626 -10.442 -14.519 1.00 0.00 H new ATOM 0 HB2 LEU A 67 8.921 -8.264 -12.514 1.00 0.00 H new ATOM 0 HB3 LEU A 67 9.120 -8.017 -14.238 1.00 0.00 H new ATOM 0 HG LEU A 67 7.386 -10.103 -14.237 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.569 -9.566 -12.608 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.075 -10.050 -11.794 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.621 -8.331 -11.877 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.571 -8.428 -14.680 1.00 0.00 H new ATOM 0 HD22 LEU A 67 6.622 -7.150 -14.025 1.00 0.00 H new ATOM 0 HD23 LEU A 67 7.084 -8.006 -15.515 1.00 0.00 H new ATOM 1118 N ASP A 68 11.730 -8.711 -14.344 1.00 0.00 N ATOM 1119 CA ASP A 68 13.167 -8.443 -14.487 1.00 0.00 C ATOM 1120 C ASP A 68 13.814 -7.887 -13.212 1.00 0.00 C ATOM 1121 O ASP A 68 14.946 -8.262 -12.897 1.00 0.00 O ATOM 1122 CB ASP A 68 13.416 -7.497 -15.666 1.00 0.00 C ATOM 1123 CG ASP A 68 14.923 -7.353 -15.961 1.00 0.00 C ATOM 1124 OD1 ASP A 68 15.575 -8.371 -16.297 1.00 0.00 O ATOM 1125 OD2 ASP A 68 15.446 -6.215 -15.920 1.00 0.00 O ATOM 0 H ASP A 68 11.146 -8.202 -15.007 1.00 0.00 H new ATOM 0 HA ASP A 68 13.642 -9.405 -14.679 1.00 0.00 H new ATOM 0 HB2 ASP A 68 12.904 -7.874 -16.552 1.00 0.00 H new ATOM 0 HB3 ASP A 68 12.991 -6.518 -15.445 1.00 0.00 H new ATOM 1130 N LYS A 69 13.093 -7.041 -12.456 1.00 0.00 N ATOM 1131 CA LYS A 69 13.585 -6.417 -11.217 1.00 0.00 C ATOM 1132 C LYS A 69 12.513 -6.379 -10.117 1.00 0.00 C ATOM 1133 O LYS A 69 12.516 -5.485 -9.268 1.00 0.00 O ATOM 1134 CB LYS A 69 14.152 -5.013 -11.498 1.00 0.00 C ATOM 1135 CG LYS A 69 15.335 -4.960 -12.470 1.00 0.00 C ATOM 1136 CD LYS A 69 16.631 -5.562 -11.898 1.00 0.00 C ATOM 1137 CE LYS A 69 17.775 -5.592 -12.927 1.00 0.00 C ATOM 1138 NZ LYS A 69 18.254 -4.238 -13.319 1.00 0.00 N ATOM 0 H LYS A 69 12.139 -6.768 -12.692 1.00 0.00 H new ATOM 0 HA LYS A 69 14.395 -7.042 -10.841 1.00 0.00 H new ATOM 0 HB2 LYS A 69 13.351 -4.390 -11.895 1.00 0.00 H new ATOM 0 HB3 LYS A 69 14.462 -4.570 -10.552 1.00 0.00 H new ATOM 0 HG2 LYS A 69 15.069 -5.493 -13.383 1.00 0.00 H new ATOM 0 HG3 LYS A 69 15.519 -3.922 -12.749 1.00 0.00 H new ATOM 0 HD2 LYS A 69 16.944 -4.982 -11.029 1.00 0.00 H new ATOM 0 HD3 LYS A 69 16.434 -6.576 -11.550 1.00 0.00 H new ATOM 0 HE2 LYS A 69 18.610 -6.159 -12.515 1.00 0.00 H new ATOM 0 HE3 LYS A 69 17.438 -6.122 -13.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 19.023 -4.329 -14.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 17.470 -3.701 -13.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 18.604 -3.737 -12.478 1.00 0.00 H new ATOM 1152 N GLY A 70 11.560 -7.308 -10.131 1.00 0.00 N ATOM 1153 CA GLY A 70 10.437 -7.287 -9.205 1.00 0.00 C ATOM 1154 C GLY A 70 9.522 -8.485 -9.404 1.00 0.00 C ATOM 1155 O GLY A 70 9.867 -9.429 -10.113 1.00 0.00 O ATOM 0 H GLY A 70 11.547 -8.092 -10.783 1.00 0.00 H new ATOM 0 HA2 GLY A 70 10.810 -7.280 -8.181 1.00 0.00 H new ATOM 0 HA3 GLY A 70 9.868 -6.368 -9.343 1.00 0.00 H new ATOM 1159 N LEU A 71 8.347 -8.449 -8.786 1.00 0.00 N ATOM 1160 CA LEU A 71 7.289 -9.451 -8.889 1.00 0.00 C ATOM 1161 C LEU A 71 5.976 -8.710 -9.124 1.00 0.00 C ATOM 1162 O LEU A 71 5.749 -7.666 -8.518 1.00 0.00 O ATOM 1163 CB LEU A 71 7.098 -10.225 -7.565 1.00 0.00 C ATOM 1164 CG LEU A 71 8.142 -11.227 -7.044 1.00 0.00 C ATOM 1165 CD1 LEU A 71 9.504 -10.617 -6.719 1.00 0.00 C ATOM 1166 CD2 LEU A 71 7.595 -11.826 -5.738 1.00 0.00 C ATOM 0 H LEU A 71 8.092 -7.680 -8.166 1.00 0.00 H new ATOM 0 HA LEU A 71 7.557 -10.143 -9.687 1.00 0.00 H new ATOM 0 HB2 LEU A 71 6.962 -9.479 -6.782 1.00 0.00 H new ATOM 0 HB3 LEU A 71 6.158 -10.769 -7.653 1.00 0.00 H new ATOM 0 HG LEU A 71 8.299 -11.955 -7.840 1.00 0.00 H new ATOM 0 HD11 LEU A 71 10.175 -11.397 -6.359 1.00 0.00 H new ATOM 0 HD12 LEU A 71 9.923 -10.164 -7.617 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.387 -9.855 -5.949 1.00 0.00 H new ATOM 0 HD21 LEU A 71 8.312 -12.544 -5.339 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.436 -11.030 -5.011 1.00 0.00 H new ATOM 0 HD23 LEU A 71 6.649 -12.330 -5.937 1.00 0.00 H new ATOM 1178 N GLU A 72 5.072 -9.289 -9.907 1.00 0.00 N ATOM 1179 CA GLU A 72 3.653 -8.943 -9.881 1.00 0.00 C ATOM 1180 C GLU A 72 2.950 -10.050 -9.121 1.00 0.00 C ATOM 1181 O GLU A 72 3.179 -11.235 -9.388 1.00 0.00 O ATOM 1182 CB GLU A 72 2.979 -8.852 -11.261 1.00 0.00 C ATOM 1183 CG GLU A 72 3.185 -7.537 -12.017 1.00 0.00 C ATOM 1184 CD GLU A 72 2.282 -7.491 -13.265 1.00 0.00 C ATOM 1185 OE1 GLU A 72 1.103 -7.077 -13.145 1.00 0.00 O ATOM 1186 OE2 GLU A 72 2.738 -7.879 -14.368 1.00 0.00 O ATOM 0 H GLU A 72 5.304 -10.017 -10.583 1.00 0.00 H new ATOM 0 HA GLU A 72 3.577 -7.953 -9.431 1.00 0.00 H new ATOM 0 HB2 GLU A 72 3.351 -9.668 -11.881 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.908 -9.012 -11.133 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.958 -6.695 -11.364 1.00 0.00 H new ATOM 0 HG3 GLU A 72 4.230 -7.439 -12.312 1.00 0.00 H new ATOM 1193 N ILE A 73 2.039 -9.654 -8.245 1.00 0.00 N ATOM 1194 CA ILE A 73 1.228 -10.524 -7.428 1.00 0.00 C ATOM 1195 C ILE A 73 -0.219 -10.138 -7.751 1.00 0.00 C ATOM 1196 O ILE A 73 -0.561 -8.957 -7.727 1.00 0.00 O ATOM 1197 CB ILE A 73 1.528 -10.320 -5.921 1.00 0.00 C ATOM 1198 CG1 ILE A 73 2.983 -10.451 -5.391 1.00 0.00 C ATOM 1199 CG2 ILE A 73 0.684 -11.309 -5.097 1.00 0.00 C ATOM 1200 CD1 ILE A 73 4.014 -9.461 -5.942 1.00 0.00 C ATOM 0 H ILE A 73 1.841 -8.667 -8.082 1.00 0.00 H new ATOM 0 HA ILE A 73 1.429 -11.575 -7.636 1.00 0.00 H new ATOM 0 HB ILE A 73 1.289 -9.263 -5.803 1.00 0.00 H new ATOM 0 HG12 ILE A 73 2.959 -10.347 -4.306 1.00 0.00 H new ATOM 0 HG13 ILE A 73 3.333 -11.460 -5.607 1.00 0.00 H new ATOM 0 HG21 ILE A 73 0.892 -11.169 -4.036 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.374 -11.130 -5.286 1.00 0.00 H new ATOM 0 HG23 ILE A 73 0.936 -12.330 -5.384 1.00 0.00 H new ATOM 0 HD11 ILE A 73 4.987 -9.660 -5.492 1.00 0.00 H new ATOM 0 HD12 ILE A 73 4.085 -9.574 -7.024 1.00 0.00 H new ATOM 0 HD13 ILE A 73 3.705 -8.443 -5.703 1.00 0.00 H new ATOM 1212 N ILE A 74 -1.075 -11.117 -8.032 1.00 0.00 N ATOM 1213 CA ILE A 74 -2.527 -10.963 -8.127 1.00 0.00 C ATOM 1214 C ILE A 74 -3.077 -11.743 -6.925 1.00 0.00 C ATOM 1215 O ILE A 74 -2.627 -12.862 -6.683 1.00 0.00 O ATOM 1216 CB ILE A 74 -3.027 -11.521 -9.491 1.00 0.00 C ATOM 1217 CG1 ILE A 74 -2.722 -10.653 -10.735 1.00 0.00 C ATOM 1218 CG2 ILE A 74 -4.555 -11.726 -9.491 1.00 0.00 C ATOM 1219 CD1 ILE A 74 -1.244 -10.371 -11.036 1.00 0.00 C ATOM 0 H ILE A 74 -0.767 -12.074 -8.206 1.00 0.00 H new ATOM 0 HA ILE A 74 -2.861 -9.926 -8.097 1.00 0.00 H new ATOM 0 HB ILE A 74 -2.467 -12.452 -9.577 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -3.159 -11.142 -11.606 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.233 -9.697 -10.616 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -4.870 -12.117 -10.459 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -4.827 -12.434 -8.708 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -5.050 -10.773 -9.306 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.166 -9.754 -11.931 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.795 -9.846 -10.193 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.720 -11.313 -11.198 1.00 0.00 H new ATOM 1231 N VAL A 75 -4.058 -11.214 -6.189 1.00 0.00 N ATOM 1232 CA VAL A 75 -4.745 -11.962 -5.137 1.00 0.00 C ATOM 1233 C VAL A 75 -6.254 -11.803 -5.328 1.00 0.00 C ATOM 1234 O VAL A 75 -6.721 -10.741 -5.753 1.00 0.00 O ATOM 1235 CB VAL A 75 -4.215 -11.627 -3.722 1.00 0.00 C ATOM 1236 CG1 VAL A 75 -2.685 -11.651 -3.634 1.00 0.00 C ATOM 1237 CG2 VAL A 75 -4.628 -10.254 -3.222 1.00 0.00 C ATOM 0 H VAL A 75 -4.396 -10.259 -6.306 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.522 -13.025 -5.226 1.00 0.00 H new ATOM 0 HB VAL A 75 -4.662 -12.409 -3.108 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -2.375 -11.408 -2.618 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.321 -12.644 -3.897 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -2.269 -10.918 -4.325 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -4.219 -10.092 -2.225 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -4.246 -9.490 -3.899 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.716 -10.193 -3.183 1.00 0.00 H new ATOM 1247 N THR A 76 -7.014 -12.869 -5.083 1.00 0.00 N ATOM 1248 CA THR A 76 -8.377 -13.011 -5.584 1.00 0.00 C ATOM 1249 C THR A 76 -9.284 -13.510 -4.451 1.00 0.00 C ATOM 1250 O THR A 76 -8.802 -13.994 -3.420 1.00 0.00 O ATOM 1251 CB THR A 76 -8.404 -13.887 -6.871 1.00 0.00 C ATOM 1252 OG1 THR A 76 -8.450 -15.273 -6.642 1.00 0.00 O ATOM 1253 CG2 THR A 76 -7.193 -13.685 -7.799 1.00 0.00 C ATOM 0 H THR A 76 -6.697 -13.663 -4.527 1.00 0.00 H new ATOM 0 HA THR A 76 -8.775 -12.045 -5.896 1.00 0.00 H new ATOM 0 HB THR A 76 -9.327 -13.537 -7.333 1.00 0.00 H new ATOM 0 HG1 THR A 76 -8.466 -15.746 -7.500 1.00 0.00 H new ATOM 0 HG21 THR A 76 -7.291 -14.332 -8.671 1.00 0.00 H new ATOM 0 HG22 THR A 76 -7.152 -12.645 -8.122 1.00 0.00 H new ATOM 0 HG23 THR A 76 -6.278 -13.935 -7.262 1.00 0.00 H new ATOM 1261 N LYS A 77 -10.597 -13.364 -4.621 1.00 0.00 N ATOM 1262 CA LYS A 77 -11.645 -13.870 -3.737 1.00 0.00 C ATOM 1263 C LYS A 77 -12.824 -14.286 -4.614 1.00 0.00 C ATOM 1264 O LYS A 77 -12.901 -13.885 -5.780 1.00 0.00 O ATOM 1265 CB LYS A 77 -12.071 -12.813 -2.695 1.00 0.00 C ATOM 1266 CG LYS A 77 -11.002 -12.535 -1.619 1.00 0.00 C ATOM 1267 CD LYS A 77 -10.109 -11.304 -1.851 1.00 0.00 C ATOM 1268 CE LYS A 77 -10.845 -9.951 -1.859 1.00 0.00 C ATOM 1269 NZ LYS A 77 -11.215 -9.443 -0.509 1.00 0.00 N ATOM 0 H LYS A 77 -10.979 -12.862 -5.423 1.00 0.00 H new ATOM 0 HA LYS A 77 -11.273 -14.723 -3.170 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -12.305 -11.882 -3.211 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -12.987 -13.146 -2.207 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -11.505 -12.418 -0.659 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -10.361 -13.413 -1.538 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -9.344 -11.279 -1.075 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -9.593 -11.424 -2.803 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -10.214 -9.211 -2.352 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -11.750 -10.047 -2.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -11.420 -8.425 -0.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -12.058 -9.947 -0.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -10.426 -9.601 0.150 1.00 0.00 H new ATOM 1283 N ALA A 78 -13.733 -15.093 -4.059 1.00 0.00 N ATOM 1284 CA ALA A 78 -14.946 -15.501 -4.759 1.00 0.00 C ATOM 1285 C ALA A 78 -15.789 -14.265 -5.099 1.00 0.00 C ATOM 1286 O ALA A 78 -15.819 -13.299 -4.331 1.00 0.00 O ATOM 1287 CB ALA A 78 -15.741 -16.484 -3.890 1.00 0.00 C ATOM 0 H ALA A 78 -13.646 -15.477 -3.118 1.00 0.00 H new ATOM 0 HA ALA A 78 -14.680 -16.002 -5.689 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -16.646 -16.786 -4.417 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -15.131 -17.363 -3.684 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -16.012 -16.002 -2.951 1.00 0.00 H new ATOM 1293 N GLN A 79 -16.488 -14.320 -6.238 1.00 0.00 N ATOM 1294 CA GLN A 79 -17.483 -13.317 -6.614 1.00 0.00 C ATOM 1295 C GLN A 79 -18.724 -13.445 -5.714 1.00 0.00 C ATOM 1296 O GLN A 79 -18.898 -14.438 -5.000 1.00 0.00 O ATOM 1297 CB GLN A 79 -17.862 -13.482 -8.100 1.00 0.00 C ATOM 1298 CG GLN A 79 -16.715 -13.115 -9.055 1.00 0.00 C ATOM 1299 CD GLN A 79 -17.079 -13.428 -10.508 1.00 0.00 C ATOM 1300 OE1 GLN A 79 -17.007 -14.576 -10.945 1.00 0.00 O ATOM 1301 NE2 GLN A 79 -17.480 -12.441 -11.295 1.00 0.00 N ATOM 0 H GLN A 79 -16.377 -15.065 -6.926 1.00 0.00 H new ATOM 0 HA GLN A 79 -17.061 -12.322 -6.476 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -18.162 -14.514 -8.281 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -18.726 -12.856 -8.321 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -16.482 -12.055 -8.957 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -15.817 -13.666 -8.776 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -17.539 -11.490 -10.931 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -17.730 -12.632 -12.265 1.00 0.00 H new ATOM 1310 N LEU A 80 -19.625 -12.464 -5.811 1.00 0.00 N ATOM 1311 CA LEU A 80 -20.946 -12.450 -5.187 1.00 0.00 C ATOM 1312 C LEU A 80 -21.918 -11.925 -6.243 1.00 0.00 C ATOM 1313 O LEU A 80 -21.511 -11.164 -7.121 1.00 0.00 O ATOM 1314 CB LEU A 80 -20.892 -11.552 -3.934 1.00 0.00 C ATOM 1315 CG LEU A 80 -22.200 -11.482 -3.114 1.00 0.00 C ATOM 1316 CD1 LEU A 80 -22.619 -12.849 -2.558 1.00 0.00 C ATOM 1317 CD2 LEU A 80 -22.024 -10.504 -1.948 1.00 0.00 C ATOM 0 H LEU A 80 -19.442 -11.619 -6.353 1.00 0.00 H new ATOM 0 HA LEU A 80 -21.272 -13.436 -4.858 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -20.094 -11.911 -3.284 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -20.622 -10.542 -4.242 1.00 0.00 H new ATOM 0 HG LEU A 80 -22.985 -11.142 -3.790 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -23.543 -12.743 -1.990 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -22.777 -13.544 -3.382 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -21.835 -13.232 -1.906 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -22.947 -10.456 -1.371 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -21.212 -10.846 -1.306 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -21.787 -9.514 -2.336 1.00 0.00 H new ATOM 1329 N SER A 81 -23.195 -12.306 -6.168 1.00 0.00 N ATOM 1330 CA SER A 81 -24.200 -12.073 -7.208 1.00 0.00 C ATOM 1331 C SER A 81 -24.492 -10.595 -7.523 1.00 0.00 C ATOM 1332 O SER A 81 -25.127 -10.308 -8.542 1.00 0.00 O ATOM 1333 CB SER A 81 -25.470 -12.849 -6.835 1.00 0.00 C ATOM 1334 OG SER A 81 -25.769 -12.719 -5.446 1.00 0.00 O ATOM 0 H SER A 81 -23.570 -12.800 -5.358 1.00 0.00 H new ATOM 0 HA SER A 81 -23.785 -12.443 -8.145 1.00 0.00 H new ATOM 0 HB2 SER A 81 -26.309 -12.482 -7.426 1.00 0.00 H new ATOM 0 HB3 SER A 81 -25.341 -13.902 -7.084 1.00 0.00 H new ATOM 0 HG SER A 81 -26.584 -13.222 -5.238 1.00 0.00 H new ATOM 1340 N LYS A 82 -24.000 -9.642 -6.715 1.00 0.00 N ATOM 1341 CA LYS A 82 -23.962 -8.233 -7.118 1.00 0.00 C ATOM 1342 C LYS A 82 -23.241 -8.111 -8.460 1.00 0.00 C ATOM 1343 O LYS A 82 -23.776 -7.504 -9.381 1.00 0.00 O ATOM 1344 CB LYS A 82 -23.266 -7.354 -6.064 1.00 0.00 C ATOM 1345 CG LYS A 82 -23.965 -7.370 -4.694 1.00 0.00 C ATOM 1346 CD LYS A 82 -23.457 -6.265 -3.749 1.00 0.00 C ATOM 1347 CE LYS A 82 -21.939 -6.341 -3.504 1.00 0.00 C ATOM 1348 NZ LYS A 82 -21.455 -5.275 -2.590 1.00 0.00 N ATOM 0 H LYS A 82 -23.625 -9.823 -5.784 1.00 0.00 H new ATOM 0 HA LYS A 82 -24.989 -7.879 -7.211 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -22.237 -7.692 -5.942 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -23.223 -6.328 -6.429 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -25.039 -7.252 -4.838 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -23.811 -8.342 -4.225 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -23.704 -5.291 -4.171 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -23.979 -6.341 -2.795 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -21.691 -7.316 -3.084 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -21.416 -6.262 -4.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -20.415 -5.274 -2.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -21.798 -4.351 -2.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -21.813 -5.452 -1.630 1.00 0.00 H new ATOM 1362 N ASP A 83 -22.078 -8.758 -8.592 1.00 0.00 N ATOM 1363 CA ASP A 83 -21.258 -8.828 -9.808 1.00 0.00 C ATOM 1364 C ASP A 83 -21.782 -9.927 -10.742 1.00 0.00 C ATOM 1365 O ASP A 83 -21.042 -10.777 -11.248 1.00 0.00 O ATOM 1366 CB ASP A 83 -19.791 -9.042 -9.413 1.00 0.00 C ATOM 1367 CG ASP A 83 -18.822 -9.039 -10.610 1.00 0.00 C ATOM 1368 OD1 ASP A 83 -19.031 -8.275 -11.583 1.00 0.00 O ATOM 1369 OD2 ASP A 83 -17.800 -9.763 -10.533 1.00 0.00 O ATOM 0 H ASP A 83 -21.662 -9.273 -7.816 1.00 0.00 H new ATOM 0 HA ASP A 83 -21.323 -7.891 -10.361 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -19.494 -8.260 -8.714 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -19.701 -9.992 -8.886 1.00 0.00 H new ATOM 1374 N LEU A 84 -23.102 -9.954 -10.920 1.00 0.00 N ATOM 1375 CA LEU A 84 -23.819 -10.829 -11.836 1.00 0.00 C ATOM 1376 C LEU A 84 -25.047 -10.047 -12.290 1.00 0.00 C ATOM 1377 O LEU A 84 -25.221 -9.811 -13.486 1.00 0.00 O ATOM 1378 CB LEU A 84 -24.203 -12.152 -11.132 1.00 0.00 C ATOM 1379 CG LEU A 84 -24.492 -13.336 -12.074 1.00 0.00 C ATOM 1380 CD1 LEU A 84 -24.751 -14.590 -11.229 1.00 0.00 C ATOM 1381 CD2 LEU A 84 -25.698 -13.101 -12.982 1.00 0.00 C ATOM 0 H LEU A 84 -23.727 -9.335 -10.403 1.00 0.00 H new ATOM 0 HA LEU A 84 -23.208 -11.111 -12.693 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -23.395 -12.434 -10.457 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -25.085 -11.975 -10.516 1.00 0.00 H new ATOM 0 HG LEU A 84 -23.620 -13.455 -12.717 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -24.957 -15.435 -11.886 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -23.872 -14.808 -10.622 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -25.608 -14.419 -10.578 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -25.848 -13.972 -13.620 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -26.587 -12.941 -12.372 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -25.521 -12.222 -13.602 1.00 0.00 H new ATOM 1393 N ASP A 85 -25.856 -9.576 -11.335 1.00 0.00 N ATOM 1394 CA ASP A 85 -27.036 -8.762 -11.638 1.00 0.00 C ATOM 1395 C ASP A 85 -26.638 -7.378 -12.158 1.00 0.00 C ATOM 1396 O ASP A 85 -27.233 -6.883 -13.119 1.00 0.00 O ATOM 1397 CB ASP A 85 -27.902 -8.601 -10.389 1.00 0.00 C ATOM 1398 CG ASP A 85 -29.209 -7.862 -10.718 1.00 0.00 C ATOM 1399 OD1 ASP A 85 -30.012 -8.379 -11.533 1.00 0.00 O ATOM 1400 OD2 ASP A 85 -29.465 -6.786 -10.131 1.00 0.00 O ATOM 0 H ASP A 85 -25.713 -9.747 -10.340 1.00 0.00 H new ATOM 0 HA ASP A 85 -27.602 -9.277 -12.415 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -28.130 -9.582 -9.971 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -27.350 -8.050 -9.628 1.00 0.00 H new ATOM 1405 N LYS A 86 -25.596 -6.786 -11.560 1.00 0.00 N ATOM 1406 CA LYS A 86 -25.049 -5.464 -11.857 1.00 0.00 C ATOM 1407 C LYS A 86 -23.558 -5.582 -12.190 1.00 0.00 C ATOM 1408 O LYS A 86 -22.958 -6.656 -12.090 1.00 0.00 O ATOM 1409 CB LYS A 86 -25.247 -4.531 -10.650 1.00 0.00 C ATOM 1410 CG LYS A 86 -26.702 -4.290 -10.245 1.00 0.00 C ATOM 1411 CD LYS A 86 -27.616 -3.831 -11.388 1.00 0.00 C ATOM 1412 CE LYS A 86 -29.025 -3.482 -10.886 1.00 0.00 C ATOM 1413 NZ LYS A 86 -29.098 -2.166 -10.193 1.00 0.00 N ATOM 0 H LYS A 86 -25.084 -7.250 -10.810 1.00 0.00 H new ATOM 0 HA LYS A 86 -25.573 -5.046 -12.716 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -24.714 -4.949 -9.796 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -24.785 -3.570 -10.875 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -27.105 -5.211 -9.823 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -26.726 -3.540 -9.455 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -27.178 -2.960 -11.876 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -27.682 -4.618 -12.139 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -29.713 -3.477 -11.732 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -29.363 -4.262 -10.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -30.074 -1.992 -9.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -28.466 -2.173 -9.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -28.805 -1.412 -10.847 1.00 0.00 H new ATOM 1427 N LEU A 87 -22.949 -4.459 -12.571 1.00 0.00 N ATOM 1428 CA LEU A 87 -21.515 -4.247 -12.449 1.00 0.00 C ATOM 1429 C LEU A 87 -21.186 -3.910 -10.986 1.00 0.00 C ATOM 1430 O LEU A 87 -22.088 -3.600 -10.202 1.00 0.00 O ATOM 1431 CB LEU A 87 -21.108 -3.127 -13.394 1.00 0.00 C ATOM 1432 CG LEU A 87 -21.127 -3.614 -14.854 1.00 0.00 C ATOM 1433 CD1 LEU A 87 -20.930 -2.391 -15.719 1.00 0.00 C ATOM 1434 CD2 LEU A 87 -20.022 -4.629 -15.166 1.00 0.00 C ATOM 0 H LEU A 87 -23.446 -3.666 -12.976 1.00 0.00 H new ATOM 0 HA LEU A 87 -20.957 -5.143 -12.722 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -21.787 -2.282 -13.278 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -20.110 -2.772 -13.137 1.00 0.00 H new ATOM 0 HG LEU A 87 -22.073 -4.122 -15.043 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -20.936 -2.683 -16.769 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -21.737 -1.682 -15.535 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -19.975 -1.924 -15.477 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -20.091 -4.932 -16.211 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -19.048 -4.174 -14.983 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -20.140 -5.503 -14.526 1.00 0.00 H new ATOM 1446 N VAL A 88 -19.903 -3.905 -10.622 1.00 0.00 N ATOM 1447 CA VAL A 88 -19.429 -3.482 -9.299 1.00 0.00 C ATOM 1448 C VAL A 88 -18.223 -2.537 -9.470 1.00 0.00 C ATOM 1449 O VAL A 88 -17.593 -2.547 -10.535 1.00 0.00 O ATOM 1450 CB VAL A 88 -19.122 -4.702 -8.399 1.00 0.00 C ATOM 1451 CG1 VAL A 88 -20.374 -5.560 -8.154 1.00 0.00 C ATOM 1452 CG2 VAL A 88 -17.982 -5.573 -8.937 1.00 0.00 C ATOM 0 H VAL A 88 -19.151 -4.199 -11.246 1.00 0.00 H new ATOM 0 HA VAL A 88 -20.214 -2.928 -8.785 1.00 0.00 H new ATOM 0 HB VAL A 88 -18.791 -4.286 -7.447 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -20.116 -6.407 -7.518 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -21.138 -4.957 -7.664 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -20.757 -5.926 -9.107 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -17.815 -6.412 -8.261 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -18.247 -5.950 -9.925 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -17.072 -4.978 -9.008 1.00 0.00 H new ATOM 1462 N PRO A 89 -17.909 -1.706 -8.459 1.00 0.00 N ATOM 1463 CA PRO A 89 -16.792 -0.774 -8.495 1.00 0.00 C ATOM 1464 C PRO A 89 -15.450 -1.432 -8.834 1.00 0.00 C ATOM 1465 O PRO A 89 -15.180 -2.584 -8.466 1.00 0.00 O ATOM 1466 CB PRO A 89 -16.735 -0.131 -7.108 1.00 0.00 C ATOM 1467 CG PRO A 89 -18.170 -0.225 -6.610 1.00 0.00 C ATOM 1468 CD PRO A 89 -18.681 -1.513 -7.243 1.00 0.00 C ATOM 0 HA PRO A 89 -16.955 -0.047 -9.290 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -16.047 -0.660 -6.449 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -16.396 0.904 -7.159 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -18.216 -0.267 -5.522 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -18.760 0.637 -6.921 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -18.554 -2.356 -6.564 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -19.745 -1.441 -7.466 1.00 0.00 H new ATOM 1476 N ARG A 90 -14.592 -0.641 -9.484 1.00 0.00 N ATOM 1477 CA ARG A 90 -13.167 -0.934 -9.590 1.00 0.00 C ATOM 1478 C ARG A 90 -12.548 -0.848 -8.197 1.00 0.00 C ATOM 1479 O ARG A 90 -13.003 -0.021 -7.373 1.00 0.00 O ATOM 1480 CB ARG A 90 -12.465 0.037 -10.546 1.00 0.00 C ATOM 1481 CG ARG A 90 -12.929 -0.146 -11.999 1.00 0.00 C ATOM 1482 CD ARG A 90 -12.062 0.696 -12.937 1.00 0.00 C ATOM 1483 NE ARG A 90 -12.482 0.554 -14.344 1.00 0.00 N ATOM 1484 CZ ARG A 90 -11.946 1.188 -15.396 1.00 0.00 C ATOM 1485 NH1 ARG A 90 -10.927 2.031 -15.235 1.00 0.00 N ATOM 1486 NH2 ARG A 90 -12.436 0.976 -16.614 1.00 0.00 N ATOM 1487 OXT ARG A 90 -11.605 -1.613 -7.912 1.00 0.00 O ATOM 0 H ARG A 90 -14.870 0.222 -9.951 1.00 0.00 H new ATOM 0 HA ARG A 90 -13.039 -1.937 -9.997 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -12.661 1.062 -10.230 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -11.387 -0.114 -10.488 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -12.867 -1.197 -12.279 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -13.974 0.148 -12.095 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -12.121 1.744 -12.644 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -11.019 0.395 -12.837 1.00 0.00 H new ATOM 0 HE ARG A 90 -13.253 -0.087 -14.534 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -10.547 2.199 -14.304 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -10.527 2.508 -16.043 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -13.217 0.333 -16.745 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -12.031 1.457 -17.417 1.00 0.00 H new TER 1501 ARG A 90