USER MOD reduce.3.24.130724 H: found=0, std=0, add=1117, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1118 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 122 LYS NZ :NH3+ -176:sc= 0.228 (180deg=0) USER MOD Set 1.2: A 126 ASN : amide:sc= -2.92 K(o=-2.7,f=-4.7!) USER MOD Set 2.1: A 21 GLN : amide:sc= -2.11! K(o=-2.1!,f=-0.045) USER MOD Set 2.2: A 25 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 12 THR OG1 : rot 130:sc= 0 USER MOD Set 3.2: A 31 MET CE :methyl -128:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 43:sc= -2.02! USER MOD Single : A 19 THR OG1 : rot 78:sc= -5.03! USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 ASN : amide:sc= -1.5 X(o=-1.5,f=-1.7!) USER MOD Single : A 28 LYS NZ :NH3+ -165:sc= 0.992 (180deg=0.82) USER MOD Single : A 29 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.433) USER MOD Single : A 32 GLN : amide:sc= -9.6! C(o=-9.6!,f=-9.7!) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 CYS SG : rot 66:sc= 0.144! USER MOD Single : A 45 SER OG : rot 93:sc= 0.484! USER MOD Single : A 49 SER OG : rot 33:sc= -1.22! USER MOD Single : A 50 SER OG : rot -110:sc= 0.94 USER MOD Single : A 53 LYS NZ :NH3+ -153:sc= -6.54! (180deg=-8.35!) USER MOD Single : A 54 GLN : amide:sc=-0.00298 X(o=-0.003,f=0.12) USER MOD Single : A 55 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.228) USER MOD Single : A 56 MET CE :methyl -126:sc= -2.17 (180deg=-7.18!) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot -148:sc= 0.0872! USER MOD Single : A 67 LYS NZ :NH3+ -150:sc= -5.16! (180deg=-7.38!) USER MOD Single : A 71 THR OG1 : rot -110:sc= -6.13! USER MOD Single : A 79 ASN : amide:sc= -9.48! C(o=-9.5!,f=-5.6!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot -70:sc= -2.31! USER MOD Single : A 93 LYS NZ :NH3+ 134:sc= -15.6! (180deg=-17.6!) USER MOD Single : A 96 THR OG1 : rot -107:sc= -0.888! USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot -149:sc= -1.94 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.16 K(o=-0.16,f=-2!) USER MOD Single : A 111 GLN : amide:sc= -0.194 X(o=-0.19,f=-0.68) USER MOD Single : A 123 SER OG : rot -66:sc= 0.0994 USER MOD Single : A 132 LYS NZ :NH3+ -127:sc=-0.00707 (180deg=-0.23) USER MOD Single : A 133 SER OG : rot 180:sc= 0.00308 USER MOD Single : A 141 SER OG : rot 105:sc= 0.7 USER MOD ----------------------------------------------------------------- ATOM 105 N VAL A 7 112.969 3.059 -13.963 1.00 0.00 N ATOM 106 CA VAL A 7 113.191 4.367 -13.289 1.00 0.00 C ATOM 107 C VAL A 7 114.683 4.694 -13.256 1.00 0.00 C ATOM 108 O VAL A 7 115.085 5.816 -13.491 1.00 0.00 O ATOM 109 CB VAL A 7 112.651 4.297 -11.857 1.00 0.00 C ATOM 110 CG1 VAL A 7 111.367 3.469 -11.835 1.00 0.00 C ATOM 111 CG2 VAL A 7 113.688 3.644 -10.945 1.00 0.00 C ATOM 0 HA VAL A 7 112.669 5.148 -13.842 1.00 0.00 H new ATOM 0 HB VAL A 7 112.442 5.307 -11.504 1.00 0.00 H new ATOM 0 HG11 VAL A 7 110.983 3.420 -10.816 1.00 0.00 H new ATOM 0 HG12 VAL A 7 110.623 3.935 -12.481 1.00 0.00 H new ATOM 0 HG13 VAL A 7 111.578 2.461 -12.193 1.00 0.00 H new ATOM 0 HG21 VAL A 7 113.299 3.596 -9.928 1.00 0.00 H new ATOM 0 HG22 VAL A 7 113.901 2.636 -11.300 1.00 0.00 H new ATOM 0 HG23 VAL A 7 114.605 4.233 -10.956 1.00 0.00 H new ATOM 121 N LYS A 8 115.510 3.733 -12.948 1.00 0.00 N ATOM 122 CA LYS A 8 116.970 4.014 -12.883 1.00 0.00 C ATOM 123 C LYS A 8 117.196 5.170 -11.903 1.00 0.00 C ATOM 124 O LYS A 8 118.313 5.519 -11.580 1.00 0.00 O ATOM 125 CB LYS A 8 117.479 4.383 -14.282 1.00 0.00 C ATOM 126 CG LYS A 8 118.503 5.519 -14.195 1.00 0.00 C ATOM 127 CD LYS A 8 119.111 5.764 -15.577 1.00 0.00 C ATOM 128 CE LYS A 8 118.217 6.721 -16.366 1.00 0.00 C ATOM 129 NZ LYS A 8 118.858 7.036 -17.674 1.00 0.00 N ATOM 0 H LYS A 8 115.239 2.772 -12.740 1.00 0.00 H new ATOM 0 HA LYS A 8 117.516 3.136 -12.539 1.00 0.00 H new ATOM 0 HB2 LYS A 8 117.933 3.511 -14.753 1.00 0.00 H new ATOM 0 HB3 LYS A 8 116.643 4.686 -14.912 1.00 0.00 H new ATOM 0 HG2 LYS A 8 118.024 6.428 -13.830 1.00 0.00 H new ATOM 0 HG3 LYS A 8 119.286 5.263 -13.481 1.00 0.00 H new ATOM 0 HD2 LYS A 8 120.112 6.184 -15.476 1.00 0.00 H new ATOM 0 HD3 LYS A 8 119.214 4.821 -16.113 1.00 0.00 H new ATOM 0 HE2 LYS A 8 117.238 6.270 -16.528 1.00 0.00 H new ATOM 0 HE3 LYS A 8 118.056 7.637 -15.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 118.250 7.687 -18.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 119.783 7.483 -17.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 118.989 6.158 -18.216 1.00 0.00 H new ATOM 143 N GLY A 9 116.133 5.760 -11.422 1.00 0.00 N ATOM 144 CA GLY A 9 116.268 6.886 -10.457 1.00 0.00 C ATOM 145 C GLY A 9 115.313 8.014 -10.847 1.00 0.00 C ATOM 146 O GLY A 9 115.703 8.974 -11.480 1.00 0.00 O ATOM 0 H GLY A 9 115.173 5.508 -11.659 1.00 0.00 H new ATOM 0 HA2 GLY A 9 116.046 6.541 -9.447 1.00 0.00 H new ATOM 0 HA3 GLY A 9 117.295 7.251 -10.451 1.00 0.00 H new ATOM 150 N ALA A 10 114.063 7.907 -10.469 1.00 0.00 N ATOM 151 CA ALA A 10 113.082 8.979 -10.818 1.00 0.00 C ATOM 152 C ALA A 10 111.677 8.379 -10.861 1.00 0.00 C ATOM 153 O ALA A 10 110.866 8.726 -11.697 1.00 0.00 O ATOM 154 CB ALA A 10 113.423 9.568 -12.190 1.00 0.00 C ATOM 0 H ALA A 10 113.681 7.126 -9.936 1.00 0.00 H new ATOM 0 HA ALA A 10 113.126 9.768 -10.067 1.00 0.00 H new ATOM 0 HB1 ALA A 10 112.705 10.349 -12.439 1.00 0.00 H new ATOM 0 HB2 ALA A 10 114.427 9.993 -12.164 1.00 0.00 H new ATOM 0 HB3 ALA A 10 113.381 8.782 -12.944 1.00 0.00 H new ATOM 160 N LEU A 11 111.387 7.476 -9.970 1.00 0.00 N ATOM 161 CA LEU A 11 110.040 6.844 -9.960 1.00 0.00 C ATOM 162 C LEU A 11 108.972 7.890 -9.637 1.00 0.00 C ATOM 163 O LEU A 11 109.224 9.078 -9.659 1.00 0.00 O ATOM 164 CB LEU A 11 110.015 5.730 -8.911 1.00 0.00 C ATOM 165 CG LEU A 11 109.783 6.313 -7.511 1.00 0.00 C ATOM 166 CD1 LEU A 11 110.112 5.247 -6.465 1.00 0.00 C ATOM 167 CD2 LEU A 11 110.688 7.527 -7.280 1.00 0.00 C ATOM 0 H LEU A 11 112.026 7.147 -9.246 1.00 0.00 H new ATOM 0 HA LEU A 11 109.829 6.423 -10.943 1.00 0.00 H new ATOM 0 HB2 LEU A 11 109.226 5.016 -9.149 1.00 0.00 H new ATOM 0 HB3 LEU A 11 110.957 5.182 -8.931 1.00 0.00 H new ATOM 0 HG LEU A 11 108.741 6.623 -7.426 1.00 0.00 H new ATOM 0 HD11 LEU A 11 109.949 5.654 -5.467 1.00 0.00 H new ATOM 0 HD12 LEU A 11 109.467 4.381 -6.613 1.00 0.00 H new ATOM 0 HD13 LEU A 11 111.154 4.945 -6.568 1.00 0.00 H new ATOM 0 HD21 LEU A 11 110.511 7.928 -6.282 1.00 0.00 H new ATOM 0 HD22 LEU A 11 111.732 7.225 -7.370 1.00 0.00 H new ATOM 0 HD23 LEU A 11 110.467 8.293 -8.024 1.00 0.00 H new ATOM 179 N THR A 12 107.779 7.456 -9.342 1.00 0.00 N ATOM 180 CA THR A 12 106.689 8.421 -9.024 1.00 0.00 C ATOM 181 C THR A 12 107.165 9.423 -7.966 1.00 0.00 C ATOM 182 O THR A 12 108.211 9.267 -7.369 1.00 0.00 O ATOM 183 CB THR A 12 105.475 7.658 -8.488 1.00 0.00 C ATOM 184 OG1 THR A 12 105.845 6.945 -7.317 1.00 0.00 O ATOM 185 CG2 THR A 12 104.978 6.676 -9.550 1.00 0.00 C ATOM 0 H THR A 12 107.511 6.473 -9.307 1.00 0.00 H new ATOM 0 HA THR A 12 106.416 8.961 -9.931 1.00 0.00 H new ATOM 0 HB THR A 12 104.679 8.363 -8.248 1.00 0.00 H new ATOM 0 HG1 THR A 12 105.201 7.133 -6.603 1.00 0.00 H new ATOM 0 HG21 THR A 12 104.114 6.133 -9.168 1.00 0.00 H new ATOM 0 HG22 THR A 12 104.694 7.224 -10.448 1.00 0.00 H new ATOM 0 HG23 THR A 12 105.772 5.970 -9.792 1.00 0.00 H new ATOM 193 N SER A 13 106.394 10.451 -7.734 1.00 0.00 N ATOM 194 CA SER A 13 106.774 11.477 -6.718 1.00 0.00 C ATOM 195 C SER A 13 106.881 10.825 -5.336 1.00 0.00 C ATOM 196 O SER A 13 106.973 11.498 -4.328 1.00 0.00 O ATOM 197 CB SER A 13 105.709 12.574 -6.682 1.00 0.00 C ATOM 198 OG SER A 13 105.426 12.909 -5.330 1.00 0.00 O ATOM 0 H SER A 13 105.509 10.626 -8.209 1.00 0.00 H new ATOM 0 HA SER A 13 107.738 11.910 -6.986 1.00 0.00 H new ATOM 0 HB2 SER A 13 106.059 13.454 -7.221 1.00 0.00 H new ATOM 0 HB3 SER A 13 104.802 12.233 -7.182 1.00 0.00 H new ATOM 0 HG SER A 13 106.263 12.959 -4.823 1.00 0.00 H new ATOM 204 N GLY A 14 106.850 9.523 -5.279 1.00 0.00 N ATOM 205 CA GLY A 14 106.929 8.828 -3.963 1.00 0.00 C ATOM 206 C GLY A 14 108.032 9.448 -3.101 1.00 0.00 C ATOM 207 O GLY A 14 107.955 9.453 -1.889 1.00 0.00 O ATOM 0 H GLY A 14 106.773 8.908 -6.089 1.00 0.00 H new ATOM 0 HA2 GLY A 14 105.971 8.900 -3.448 1.00 0.00 H new ATOM 0 HA3 GLY A 14 107.130 7.768 -4.115 1.00 0.00 H new ATOM 211 N ARG A 15 109.062 9.960 -3.709 1.00 0.00 N ATOM 212 CA ARG A 15 110.168 10.563 -2.911 1.00 0.00 C ATOM 213 C ARG A 15 109.658 11.757 -2.096 1.00 0.00 C ATOM 214 O ARG A 15 109.737 11.769 -0.883 1.00 0.00 O ATOM 215 CB ARG A 15 111.277 11.033 -3.856 1.00 0.00 C ATOM 216 CG ARG A 15 110.665 11.449 -5.194 1.00 0.00 C ATOM 217 CD ARG A 15 111.454 12.619 -5.787 1.00 0.00 C ATOM 218 NE ARG A 15 110.806 13.903 -5.400 1.00 0.00 N ATOM 219 CZ ARG A 15 111.011 14.978 -6.111 1.00 0.00 C ATOM 220 NH1 ARG A 15 111.785 14.927 -7.161 1.00 0.00 N ATOM 221 NH2 ARG A 15 110.444 16.103 -5.772 1.00 0.00 N ATOM 0 H ARG A 15 109.188 9.988 -4.721 1.00 0.00 H new ATOM 0 HA ARG A 15 110.555 9.810 -2.225 1.00 0.00 H new ATOM 0 HB2 ARG A 15 111.815 11.872 -3.414 1.00 0.00 H new ATOM 0 HB3 ARG A 15 112.002 10.234 -4.009 1.00 0.00 H new ATOM 0 HG2 ARG A 15 110.673 10.606 -5.885 1.00 0.00 H new ATOM 0 HG3 ARG A 15 109.623 11.736 -5.054 1.00 0.00 H new ATOM 0 HD2 ARG A 15 112.483 12.596 -5.428 1.00 0.00 H new ATOM 0 HD3 ARG A 15 111.493 12.532 -6.873 1.00 0.00 H new ATOM 0 HE ARG A 15 110.202 13.942 -4.579 1.00 0.00 H new ATOM 0 HH11 ARG A 15 112.229 14.047 -7.425 1.00 0.00 H new ATOM 0 HH12 ARG A 15 111.946 15.767 -7.717 1.00 0.00 H new ATOM 0 HH21 ARG A 15 109.840 16.143 -4.951 1.00 0.00 H new ATOM 0 HH22 ARG A 15 110.605 16.943 -6.328 1.00 0.00 H new ATOM 235 N GLU A 16 109.160 12.771 -2.749 1.00 0.00 N ATOM 236 CA GLU A 16 108.678 13.976 -2.009 1.00 0.00 C ATOM 237 C GLU A 16 107.263 13.759 -1.470 1.00 0.00 C ATOM 238 O GLU A 16 106.931 14.198 -0.388 1.00 0.00 O ATOM 239 CB GLU A 16 108.662 15.177 -2.958 1.00 0.00 C ATOM 240 CG GLU A 16 108.574 16.470 -2.145 1.00 0.00 C ATOM 241 CD GLU A 16 108.725 17.673 -3.079 1.00 0.00 C ATOM 242 OE1 GLU A 16 109.836 17.922 -3.517 1.00 0.00 O ATOM 243 OE2 GLU A 16 107.727 18.324 -3.340 1.00 0.00 O ATOM 0 H GLU A 16 109.065 12.819 -3.763 1.00 0.00 H new ATOM 0 HA GLU A 16 109.351 14.156 -1.171 1.00 0.00 H new ATOM 0 HB2 GLU A 16 109.563 15.181 -3.571 1.00 0.00 H new ATOM 0 HB3 GLU A 16 107.814 15.105 -3.639 1.00 0.00 H new ATOM 0 HG2 GLU A 16 107.618 16.519 -1.623 1.00 0.00 H new ATOM 0 HG3 GLU A 16 109.354 16.487 -1.384 1.00 0.00 H new ATOM 250 N GLU A 17 106.417 13.122 -2.225 1.00 0.00 N ATOM 251 CA GLU A 17 105.014 12.923 -1.764 1.00 0.00 C ATOM 252 C GLU A 17 104.933 11.882 -0.643 1.00 0.00 C ATOM 253 O GLU A 17 104.318 12.113 0.378 1.00 0.00 O ATOM 254 CB GLU A 17 104.159 12.457 -2.944 1.00 0.00 C ATOM 255 CG GLU A 17 102.813 11.944 -2.429 1.00 0.00 C ATOM 256 CD GLU A 17 101.739 12.169 -3.494 1.00 0.00 C ATOM 257 OE1 GLU A 17 101.740 13.232 -4.093 1.00 0.00 O ATOM 258 OE2 GLU A 17 100.933 11.275 -3.693 1.00 0.00 O ATOM 0 H GLU A 17 106.634 12.730 -3.141 1.00 0.00 H new ATOM 0 HA GLU A 17 104.646 13.872 -1.375 1.00 0.00 H new ATOM 0 HB2 GLU A 17 104.004 13.280 -3.641 1.00 0.00 H new ATOM 0 HB3 GLU A 17 104.675 11.668 -3.492 1.00 0.00 H new ATOM 0 HG2 GLU A 17 102.884 10.883 -2.188 1.00 0.00 H new ATOM 0 HG3 GLU A 17 102.542 12.462 -1.509 1.00 0.00 H new ATOM 265 N LEU A 18 105.504 10.726 -0.829 1.00 0.00 N ATOM 266 CA LEU A 18 105.395 9.677 0.226 1.00 0.00 C ATOM 267 C LEU A 18 106.323 9.957 1.415 1.00 0.00 C ATOM 268 O LEU A 18 105.980 9.652 2.539 1.00 0.00 O ATOM 269 CB LEU A 18 105.727 8.307 -0.373 1.00 0.00 C ATOM 270 CG LEU A 18 104.467 7.436 -0.380 1.00 0.00 C ATOM 271 CD1 LEU A 18 103.996 7.206 1.058 1.00 0.00 C ATOM 272 CD2 LEU A 18 103.362 8.142 -1.173 1.00 0.00 C ATOM 0 H LEU A 18 106.037 10.462 -1.657 1.00 0.00 H new ATOM 0 HA LEU A 18 104.370 9.687 0.596 1.00 0.00 H new ATOM 0 HB2 LEU A 18 106.107 8.424 -1.388 1.00 0.00 H new ATOM 0 HB3 LEU A 18 106.513 7.824 0.208 1.00 0.00 H new ATOM 0 HG LEU A 18 104.692 6.477 -0.846 1.00 0.00 H new ATOM 0 HD11 LEU A 18 103.099 6.586 1.052 1.00 0.00 H new ATOM 0 HD12 LEU A 18 104.781 6.703 1.622 1.00 0.00 H new ATOM 0 HD13 LEU A 18 103.771 8.165 1.525 1.00 0.00 H new ATOM 0 HD21 LEU A 18 102.465 7.522 -1.178 1.00 0.00 H new ATOM 0 HD22 LEU A 18 103.137 9.102 -0.708 1.00 0.00 H new ATOM 0 HD23 LEU A 18 103.697 8.305 -2.198 1.00 0.00 H new ATOM 284 N THR A 19 107.488 10.514 1.210 1.00 0.00 N ATOM 285 CA THR A 19 108.373 10.758 2.385 1.00 0.00 C ATOM 286 C THR A 19 107.785 11.879 3.235 1.00 0.00 C ATOM 287 O THR A 19 107.547 11.714 4.413 1.00 0.00 O ATOM 288 CB THR A 19 109.774 11.149 1.914 1.00 0.00 C ATOM 289 OG1 THR A 19 110.183 10.260 0.886 1.00 0.00 O ATOM 290 CG2 THR A 19 110.759 11.068 3.089 1.00 0.00 C ATOM 0 H THR A 19 107.857 10.804 0.304 1.00 0.00 H new ATOM 0 HA THR A 19 108.442 9.846 2.979 1.00 0.00 H new ATOM 0 HB THR A 19 109.759 12.170 1.533 1.00 0.00 H new ATOM 0 HG1 THR A 19 109.744 10.508 0.045 1.00 0.00 H new ATOM 0 HG21 THR A 19 111.756 11.348 2.748 1.00 0.00 H new ATOM 0 HG22 THR A 19 110.441 11.749 3.878 1.00 0.00 H new ATOM 0 HG23 THR A 19 110.780 10.049 3.476 1.00 0.00 H new ATOM 298 N ARG A 20 107.536 13.014 2.645 1.00 0.00 N ATOM 299 CA ARG A 20 106.952 14.144 3.414 1.00 0.00 C ATOM 300 C ARG A 20 105.672 13.685 4.119 1.00 0.00 C ATOM 301 O ARG A 20 105.305 14.196 5.159 1.00 0.00 O ATOM 302 CB ARG A 20 106.610 15.279 2.455 1.00 0.00 C ATOM 303 CG ARG A 20 107.887 16.015 2.074 1.00 0.00 C ATOM 304 CD ARG A 20 107.550 17.187 1.151 1.00 0.00 C ATOM 305 NE ARG A 20 106.260 16.918 0.455 1.00 0.00 N ATOM 306 CZ ARG A 20 105.136 17.329 0.976 1.00 0.00 C ATOM 307 NH1 ARG A 20 105.138 17.974 2.111 1.00 0.00 N ATOM 308 NH2 ARG A 20 104.009 17.094 0.362 1.00 0.00 N ATOM 0 H ARG A 20 107.713 13.207 1.659 1.00 0.00 H new ATOM 0 HA ARG A 20 107.674 14.485 4.156 1.00 0.00 H new ATOM 0 HB2 ARG A 20 106.124 14.883 1.563 1.00 0.00 H new ATOM 0 HB3 ARG A 20 105.906 15.967 2.923 1.00 0.00 H new ATOM 0 HG2 ARG A 20 108.390 16.378 2.970 1.00 0.00 H new ATOM 0 HG3 ARG A 20 108.576 15.333 1.576 1.00 0.00 H new ATOM 0 HD2 ARG A 20 107.479 18.109 1.728 1.00 0.00 H new ATOM 0 HD3 ARG A 20 108.347 17.329 0.421 1.00 0.00 H new ATOM 0 HE ARG A 20 106.255 16.412 -0.430 1.00 0.00 H new ATOM 0 HH11 ARG A 20 106.019 18.157 2.592 1.00 0.00 H new ATOM 0 HH12 ARG A 20 104.259 18.295 2.517 1.00 0.00 H new ATOM 0 HH21 ARG A 20 104.007 16.589 -0.524 1.00 0.00 H new ATOM 0 HH22 ARG A 20 103.130 17.415 0.768 1.00 0.00 H new ATOM 322 N GLN A 21 104.978 12.739 3.546 1.00 0.00 N ATOM 323 CA GLN A 21 103.708 12.261 4.163 1.00 0.00 C ATOM 324 C GLN A 21 103.988 11.307 5.329 1.00 0.00 C ATOM 325 O GLN A 21 103.133 11.081 6.161 1.00 0.00 O ATOM 326 CB GLN A 21 102.872 11.538 3.108 1.00 0.00 C ATOM 327 CG GLN A 21 102.418 12.538 2.045 1.00 0.00 C ATOM 328 CD GLN A 21 101.131 13.225 2.507 1.00 0.00 C ATOM 329 OE1 GLN A 21 100.486 13.910 1.739 1.00 0.00 O ATOM 330 NE2 GLN A 21 100.728 13.068 3.738 1.00 0.00 N ATOM 0 H GLN A 21 105.237 12.276 2.675 1.00 0.00 H new ATOM 0 HA GLN A 21 103.165 13.125 4.546 1.00 0.00 H new ATOM 0 HB2 GLN A 21 103.457 10.742 2.648 1.00 0.00 H new ATOM 0 HB3 GLN A 21 102.006 11.068 3.574 1.00 0.00 H new ATOM 0 HG2 GLN A 21 103.197 13.280 1.872 1.00 0.00 H new ATOM 0 HG3 GLN A 21 102.250 12.026 1.097 1.00 0.00 H new ATOM 0 HE21 GLN A 21 101.270 12.493 4.383 1.00 0.00 H new ATOM 0 HE22 GLN A 21 99.871 13.521 4.056 1.00 0.00 H new ATOM 339 N VAL A 22 105.157 10.730 5.401 1.00 0.00 N ATOM 340 CA VAL A 22 105.431 9.785 6.525 1.00 0.00 C ATOM 341 C VAL A 22 104.963 10.418 7.837 1.00 0.00 C ATOM 342 O VAL A 22 104.527 9.736 8.742 1.00 0.00 O ATOM 343 CB VAL A 22 106.930 9.473 6.609 1.00 0.00 C ATOM 344 CG1 VAL A 22 107.444 9.045 5.236 1.00 0.00 C ATOM 345 CG2 VAL A 22 107.695 10.714 7.079 1.00 0.00 C ATOM 0 H VAL A 22 105.924 10.868 4.743 1.00 0.00 H new ATOM 0 HA VAL A 22 104.892 8.854 6.349 1.00 0.00 H new ATOM 0 HB VAL A 22 107.086 8.664 7.323 1.00 0.00 H new ATOM 0 HG11 VAL A 22 108.510 8.824 5.299 1.00 0.00 H new ATOM 0 HG12 VAL A 22 106.908 8.155 4.908 1.00 0.00 H new ATOM 0 HG13 VAL A 22 107.282 9.850 4.520 1.00 0.00 H new ATOM 0 HG21 VAL A 22 108.759 10.485 7.136 1.00 0.00 H new ATOM 0 HG22 VAL A 22 107.537 11.528 6.372 1.00 0.00 H new ATOM 0 HG23 VAL A 22 107.334 11.013 8.063 1.00 0.00 H new ATOM 355 N GLY A 23 105.034 11.717 7.947 1.00 0.00 N ATOM 356 CA GLY A 23 104.572 12.376 9.200 1.00 0.00 C ATOM 357 C GLY A 23 103.133 11.941 9.475 1.00 0.00 C ATOM 358 O GLY A 23 102.612 12.114 10.559 1.00 0.00 O ATOM 0 H GLY A 23 105.390 12.346 7.228 1.00 0.00 H new ATOM 0 HA2 GLY A 23 105.217 12.099 10.034 1.00 0.00 H new ATOM 0 HA3 GLY A 23 104.628 13.460 9.100 1.00 0.00 H new ATOM 362 N ARG A 24 102.492 11.367 8.492 1.00 0.00 N ATOM 363 CA ARG A 24 101.089 10.904 8.674 1.00 0.00 C ATOM 364 C ARG A 24 101.053 9.377 8.579 1.00 0.00 C ATOM 365 O ARG A 24 100.398 8.712 9.356 1.00 0.00 O ATOM 366 CB ARG A 24 100.205 11.511 7.577 1.00 0.00 C ATOM 367 CG ARG A 24 99.235 12.520 8.196 1.00 0.00 C ATOM 368 CD ARG A 24 100.010 13.752 8.668 1.00 0.00 C ATOM 369 NE ARG A 24 100.687 14.389 7.503 1.00 0.00 N ATOM 370 CZ ARG A 24 99.979 14.968 6.573 1.00 0.00 C ATOM 371 NH1 ARG A 24 98.677 14.990 6.663 1.00 0.00 N ATOM 372 NH2 ARG A 24 100.572 15.526 5.553 1.00 0.00 N ATOM 0 H ARG A 24 102.884 11.199 7.566 1.00 0.00 H new ATOM 0 HA ARG A 24 100.717 11.220 9.649 1.00 0.00 H new ATOM 0 HB2 ARG A 24 100.825 12.001 6.827 1.00 0.00 H new ATOM 0 HB3 ARG A 24 99.650 10.724 7.067 1.00 0.00 H new ATOM 0 HG2 ARG A 24 98.480 12.810 7.465 1.00 0.00 H new ATOM 0 HG3 ARG A 24 98.708 12.066 9.035 1.00 0.00 H new ATOM 0 HD2 ARG A 24 99.332 14.462 9.141 1.00 0.00 H new ATOM 0 HD3 ARG A 24 100.747 13.466 9.419 1.00 0.00 H new ATOM 0 HE ARG A 24 101.704 14.372 7.433 1.00 0.00 H new ATOM 0 HH11 ARG A 24 98.213 14.555 7.460 1.00 0.00 H new ATOM 0 HH12 ARG A 24 98.123 15.443 5.936 1.00 0.00 H new ATOM 0 HH21 ARG A 24 101.589 15.509 5.483 1.00 0.00 H new ATOM 0 HH22 ARG A 24 100.018 15.979 4.826 1.00 0.00 H new ATOM 386 N TYR A 25 101.758 8.816 7.632 1.00 0.00 N ATOM 387 CA TYR A 25 101.768 7.333 7.493 1.00 0.00 C ATOM 388 C TYR A 25 102.966 6.761 8.251 1.00 0.00 C ATOM 389 O TYR A 25 102.930 5.647 8.734 1.00 0.00 O ATOM 390 CB TYR A 25 101.877 6.948 6.014 1.00 0.00 C ATOM 391 CG TYR A 25 101.109 7.934 5.166 1.00 0.00 C ATOM 392 CD1 TYR A 25 100.002 8.610 5.697 1.00 0.00 C ATOM 393 CD2 TYR A 25 101.506 8.173 3.845 1.00 0.00 C ATOM 394 CE1 TYR A 25 99.295 9.522 4.907 1.00 0.00 C ATOM 395 CE2 TYR A 25 100.797 9.085 3.055 1.00 0.00 C ATOM 396 CZ TYR A 25 99.692 9.760 3.586 1.00 0.00 C ATOM 397 OH TYR A 25 98.993 10.660 2.807 1.00 0.00 O ATOM 0 H TYR A 25 102.326 9.321 6.951 1.00 0.00 H new ATOM 0 HA TYR A 25 100.843 6.929 7.903 1.00 0.00 H new ATOM 0 HB2 TYR A 25 102.924 6.932 5.710 1.00 0.00 H new ATOM 0 HB3 TYR A 25 101.485 5.942 5.862 1.00 0.00 H new ATOM 0 HD1 TYR A 25 99.695 8.427 6.716 1.00 0.00 H new ATOM 0 HD2 TYR A 25 102.360 7.653 3.435 1.00 0.00 H new ATOM 0 HE1 TYR A 25 98.442 10.043 5.316 1.00 0.00 H new ATOM 0 HE2 TYR A 25 101.103 9.268 2.035 1.00 0.00 H new ATOM 0 HH TYR A 25 99.400 10.708 1.917 1.00 0.00 H new ATOM 407 N LYS A 26 104.030 7.511 8.358 1.00 0.00 N ATOM 408 CA LYS A 26 105.224 6.999 9.083 1.00 0.00 C ATOM 409 C LYS A 26 105.671 5.680 8.450 1.00 0.00 C ATOM 410 O LYS A 26 106.600 5.045 8.908 1.00 0.00 O ATOM 411 CB LYS A 26 104.868 6.766 10.553 1.00 0.00 C ATOM 412 CG LYS A 26 105.140 8.041 11.353 1.00 0.00 C ATOM 413 CD LYS A 26 104.727 7.828 12.810 1.00 0.00 C ATOM 414 CE LYS A 26 105.458 8.833 13.701 1.00 0.00 C ATOM 415 NZ LYS A 26 105.107 8.580 15.128 1.00 0.00 N ATOM 0 H LYS A 26 104.122 8.452 7.976 1.00 0.00 H new ATOM 0 HA LYS A 26 106.032 7.728 9.018 1.00 0.00 H new ATOM 0 HB2 LYS A 26 103.819 6.484 10.644 1.00 0.00 H new ATOM 0 HB3 LYS A 26 105.456 5.940 10.954 1.00 0.00 H new ATOM 0 HG2 LYS A 26 106.198 8.299 11.298 1.00 0.00 H new ATOM 0 HG3 LYS A 26 104.586 8.876 10.925 1.00 0.00 H new ATOM 0 HD2 LYS A 26 103.649 7.950 12.915 1.00 0.00 H new ATOM 0 HD3 LYS A 26 104.964 6.811 13.121 1.00 0.00 H new ATOM 0 HE2 LYS A 26 106.535 8.745 13.559 1.00 0.00 H new ATOM 0 HE3 LYS A 26 105.182 9.850 13.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 105.604 9.263 15.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 104.080 8.685 15.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 105.391 7.614 15.390 1.00 0.00 H new ATOM 429 N ASN A 27 105.016 5.262 7.400 1.00 0.00 N ATOM 430 CA ASN A 27 105.405 3.986 6.742 1.00 0.00 C ATOM 431 C ASN A 27 106.473 4.261 5.683 1.00 0.00 C ATOM 432 O ASN A 27 106.537 5.331 5.112 1.00 0.00 O ATOM 433 CB ASN A 27 104.177 3.360 6.079 1.00 0.00 C ATOM 434 CG ASN A 27 103.474 2.434 7.073 1.00 0.00 C ATOM 435 OD1 ASN A 27 102.858 1.461 6.685 1.00 0.00 O ATOM 436 ND2 ASN A 27 103.541 2.697 8.350 1.00 0.00 N ATOM 0 H ASN A 27 104.229 5.750 6.972 1.00 0.00 H new ATOM 0 HA ASN A 27 105.805 3.300 7.489 1.00 0.00 H new ATOM 0 HB2 ASN A 27 103.493 4.141 5.747 1.00 0.00 H new ATOM 0 HB3 ASN A 27 104.475 2.800 5.193 1.00 0.00 H new ATOM 0 HD21 ASN A 27 103.076 2.086 9.022 1.00 0.00 H new ATOM 0 HD22 ASN A 27 104.058 3.514 8.676 1.00 0.00 H new ATOM 443 N LYS A 28 107.312 3.299 5.421 1.00 0.00 N ATOM 444 CA LYS A 28 108.382 3.487 4.402 1.00 0.00 C ATOM 445 C LYS A 28 108.394 2.268 3.476 1.00 0.00 C ATOM 446 O LYS A 28 108.501 2.377 2.266 1.00 0.00 O ATOM 447 CB LYS A 28 109.734 3.595 5.107 1.00 0.00 C ATOM 448 CG LYS A 28 109.869 4.970 5.765 1.00 0.00 C ATOM 449 CD LYS A 28 109.400 4.895 7.219 1.00 0.00 C ATOM 450 CE LYS A 28 109.725 6.211 7.929 1.00 0.00 C ATOM 451 NZ LYS A 28 109.213 6.161 9.328 1.00 0.00 N ATOM 0 H LYS A 28 107.303 2.384 5.872 1.00 0.00 H new ATOM 0 HA LYS A 28 108.197 4.394 3.827 1.00 0.00 H new ATOM 0 HB2 LYS A 28 109.825 2.812 5.859 1.00 0.00 H new ATOM 0 HB3 LYS A 28 110.541 3.444 4.390 1.00 0.00 H new ATOM 0 HG2 LYS A 28 110.906 5.303 5.724 1.00 0.00 H new ATOM 0 HG3 LYS A 28 109.277 5.705 5.219 1.00 0.00 H new ATOM 0 HD2 LYS A 28 108.327 4.704 7.257 1.00 0.00 H new ATOM 0 HD3 LYS A 28 109.890 4.065 7.728 1.00 0.00 H new ATOM 0 HE2 LYS A 28 110.802 6.379 7.930 1.00 0.00 H new ATOM 0 HE3 LYS A 28 109.272 7.046 7.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 109.201 7.121 9.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 108.248 5.772 9.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 109.832 5.555 9.903 1.00 0.00 H new ATOM 465 N LYS A 29 108.282 1.107 4.057 1.00 0.00 N ATOM 466 CA LYS A 29 108.281 -0.151 3.262 1.00 0.00 C ATOM 467 C LYS A 29 106.989 -0.249 2.451 1.00 0.00 C ATOM 468 O LYS A 29 106.807 -1.142 1.651 1.00 0.00 O ATOM 469 CB LYS A 29 108.352 -1.340 4.225 1.00 0.00 C ATOM 470 CG LYS A 29 107.654 -0.983 5.541 1.00 0.00 C ATOM 471 CD LYS A 29 106.224 -0.520 5.258 1.00 0.00 C ATOM 472 CE LYS A 29 105.374 -0.687 6.519 1.00 0.00 C ATOM 473 NZ LYS A 29 106.123 -0.159 7.695 1.00 0.00 N ATOM 0 H LYS A 29 108.190 0.975 5.064 1.00 0.00 H new ATOM 0 HA LYS A 29 109.135 -0.156 2.585 1.00 0.00 H new ATOM 0 HB2 LYS A 29 107.878 -2.213 3.776 1.00 0.00 H new ATOM 0 HB3 LYS A 29 109.392 -1.605 4.414 1.00 0.00 H new ATOM 0 HG2 LYS A 29 107.642 -1.848 6.204 1.00 0.00 H new ATOM 0 HG3 LYS A 29 108.206 -0.196 6.055 1.00 0.00 H new ATOM 0 HD2 LYS A 29 106.224 0.523 4.942 1.00 0.00 H new ATOM 0 HD3 LYS A 29 105.798 -1.101 4.440 1.00 0.00 H new ATOM 0 HE2 LYS A 29 104.429 -0.155 6.407 1.00 0.00 H new ATOM 0 HE3 LYS A 29 105.132 -1.739 6.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 105.455 0.061 8.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 106.803 -0.874 8.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 106.634 0.705 7.422 1.00 0.00 H new ATOM 487 N PHE A 30 106.077 0.644 2.677 1.00 0.00 N ATOM 488 CA PHE A 30 104.777 0.583 1.953 1.00 0.00 C ATOM 489 C PHE A 30 104.947 0.841 0.445 1.00 0.00 C ATOM 490 O PHE A 30 104.920 -0.069 -0.364 1.00 0.00 O ATOM 491 CB PHE A 30 103.927 1.713 2.529 1.00 0.00 C ATOM 492 CG PHE A 30 104.751 3.001 2.569 1.00 0.00 C ATOM 493 CD1 PHE A 30 106.062 3.050 2.038 1.00 0.00 C ATOM 494 CD2 PHE A 30 104.198 4.158 3.130 1.00 0.00 C ATOM 495 CE1 PHE A 30 106.789 4.241 2.071 1.00 0.00 C ATOM 496 CE2 PHE A 30 104.938 5.348 3.164 1.00 0.00 C ATOM 497 CZ PHE A 30 106.232 5.387 2.633 1.00 0.00 C ATOM 0 H PHE A 30 106.172 1.419 3.334 1.00 0.00 H new ATOM 0 HA PHE A 30 104.333 -0.405 2.074 1.00 0.00 H new ATOM 0 HB2 PHE A 30 103.035 1.858 1.920 1.00 0.00 H new ATOM 0 HB3 PHE A 30 103.589 1.453 3.532 1.00 0.00 H new ATOM 0 HD1 PHE A 30 106.501 2.163 1.606 1.00 0.00 H new ATOM 0 HD2 PHE A 30 103.198 4.134 3.538 1.00 0.00 H new ATOM 0 HE1 PHE A 30 107.787 4.274 1.659 1.00 0.00 H new ATOM 0 HE2 PHE A 30 104.508 6.237 3.601 1.00 0.00 H new ATOM 0 HZ PHE A 30 106.799 6.306 2.659 1.00 0.00 H new ATOM 507 N MET A 31 105.155 2.075 0.080 1.00 0.00 N ATOM 508 CA MET A 31 105.361 2.438 -1.343 1.00 0.00 C ATOM 509 C MET A 31 106.805 2.157 -1.740 1.00 0.00 C ATOM 510 O MET A 31 107.084 1.574 -2.769 1.00 0.00 O ATOM 511 CB MET A 31 105.062 3.927 -1.521 1.00 0.00 C ATOM 512 CG MET A 31 105.601 4.406 -2.869 1.00 0.00 C ATOM 513 SD MET A 31 105.014 3.305 -4.180 1.00 0.00 S ATOM 514 CE MET A 31 105.813 4.155 -5.564 1.00 0.00 C ATOM 0 H MET A 31 105.191 2.863 0.727 1.00 0.00 H new ATOM 0 HA MET A 31 104.697 1.848 -1.974 1.00 0.00 H new ATOM 0 HB2 MET A 31 103.987 4.101 -1.466 1.00 0.00 H new ATOM 0 HB3 MET A 31 105.519 4.498 -0.713 1.00 0.00 H new ATOM 0 HG2 MET A 31 105.272 5.427 -3.062 1.00 0.00 H new ATOM 0 HG3 MET A 31 106.691 4.420 -2.852 1.00 0.00 H new ATOM 0 HE1 MET A 31 105.074 4.364 -6.338 1.00 0.00 H new ATOM 0 HE2 MET A 31 106.247 5.092 -5.214 1.00 0.00 H new ATOM 0 HE3 MET A 31 106.600 3.522 -5.975 1.00 0.00 H new ATOM 524 N GLN A 32 107.730 2.598 -0.931 1.00 0.00 N ATOM 525 CA GLN A 32 109.158 2.396 -1.250 1.00 0.00 C ATOM 526 C GLN A 32 109.533 0.926 -1.029 1.00 0.00 C ATOM 527 O GLN A 32 110.415 0.400 -1.678 1.00 0.00 O ATOM 528 CB GLN A 32 109.997 3.334 -0.381 1.00 0.00 C ATOM 529 CG GLN A 32 109.535 4.778 -0.617 1.00 0.00 C ATOM 530 CD GLN A 32 109.647 5.125 -2.104 1.00 0.00 C ATOM 531 OE1 GLN A 32 108.863 4.666 -2.909 1.00 0.00 O ATOM 532 NE2 GLN A 32 110.592 5.928 -2.504 1.00 0.00 N ATOM 0 H GLN A 32 107.549 3.093 -0.058 1.00 0.00 H new ATOM 0 HA GLN A 32 109.354 2.631 -2.296 1.00 0.00 H new ATOM 0 HB2 GLN A 32 109.888 3.071 0.671 1.00 0.00 H new ATOM 0 HB3 GLN A 32 111.054 3.231 -0.628 1.00 0.00 H new ATOM 0 HG2 GLN A 32 108.504 4.898 -0.283 1.00 0.00 H new ATOM 0 HG3 GLN A 32 110.143 5.464 -0.028 1.00 0.00 H new ATOM 0 HE21 GLN A 32 111.252 6.315 -1.829 1.00 0.00 H new ATOM 0 HE22 GLN A 32 110.672 6.170 -3.492 1.00 0.00 H new ATOM 541 N GLY A 33 108.871 0.245 -0.129 1.00 0.00 N ATOM 542 CA GLY A 33 109.206 -1.189 0.086 1.00 0.00 C ATOM 543 C GLY A 33 108.798 -1.964 -1.165 1.00 0.00 C ATOM 544 O GLY A 33 109.581 -2.699 -1.736 1.00 0.00 O ATOM 0 H GLY A 33 108.123 0.616 0.458 1.00 0.00 H new ATOM 0 HA2 GLY A 33 110.273 -1.306 0.275 1.00 0.00 H new ATOM 0 HA3 GLY A 33 108.683 -1.575 0.961 1.00 0.00 H new ATOM 548 N THR A 34 107.583 -1.784 -1.614 1.00 0.00 N ATOM 549 CA THR A 34 107.146 -2.492 -2.848 1.00 0.00 C ATOM 550 C THR A 34 108.057 -2.052 -3.994 1.00 0.00 C ATOM 551 O THR A 34 108.188 -2.721 -4.999 1.00 0.00 O ATOM 552 CB THR A 34 105.693 -2.130 -3.172 1.00 0.00 C ATOM 553 OG1 THR A 34 105.294 -2.803 -4.358 1.00 0.00 O ATOM 554 CG2 THR A 34 105.568 -0.620 -3.375 1.00 0.00 C ATOM 0 H THR A 34 106.882 -1.182 -1.182 1.00 0.00 H new ATOM 0 HA THR A 34 107.209 -3.571 -2.706 1.00 0.00 H new ATOM 0 HB THR A 34 105.052 -2.434 -2.345 1.00 0.00 H new ATOM 0 HG1 THR A 34 104.364 -2.574 -4.567 1.00 0.00 H new ATOM 0 HG21 THR A 34 104.533 -0.368 -3.605 1.00 0.00 H new ATOM 0 HG22 THR A 34 105.873 -0.104 -2.465 1.00 0.00 H new ATOM 0 HG23 THR A 34 106.209 -0.310 -4.200 1.00 0.00 H new ATOM 562 N VAL A 35 108.691 -0.923 -3.835 1.00 0.00 N ATOM 563 CA VAL A 35 109.607 -0.409 -4.891 1.00 0.00 C ATOM 564 C VAL A 35 110.894 -1.246 -4.906 1.00 0.00 C ATOM 565 O VAL A 35 111.233 -1.862 -5.895 1.00 0.00 O ATOM 566 CB VAL A 35 109.935 1.054 -4.574 1.00 0.00 C ATOM 567 CG1 VAL A 35 111.289 1.436 -5.162 1.00 0.00 C ATOM 568 CG2 VAL A 35 108.859 1.964 -5.168 1.00 0.00 C ATOM 0 H VAL A 35 108.612 -0.329 -3.010 1.00 0.00 H new ATOM 0 HA VAL A 35 109.134 -0.479 -5.871 1.00 0.00 H new ATOM 0 HB VAL A 35 109.968 1.174 -3.491 1.00 0.00 H new ATOM 0 HG11 VAL A 35 111.506 2.478 -4.928 1.00 0.00 H new ATOM 0 HG12 VAL A 35 112.064 0.799 -4.735 1.00 0.00 H new ATOM 0 HG13 VAL A 35 111.266 1.305 -6.244 1.00 0.00 H new ATOM 0 HG21 VAL A 35 109.095 3.003 -4.941 1.00 0.00 H new ATOM 0 HG22 VAL A 35 108.824 1.828 -6.249 1.00 0.00 H new ATOM 0 HG23 VAL A 35 107.890 1.710 -4.738 1.00 0.00 H new ATOM 578 N ALA A 36 111.614 -1.269 -3.816 1.00 0.00 N ATOM 579 CA ALA A 36 112.877 -2.059 -3.766 1.00 0.00 C ATOM 580 C ALA A 36 112.648 -3.447 -4.367 1.00 0.00 C ATOM 581 O ALA A 36 113.376 -3.881 -5.237 1.00 0.00 O ATOM 582 CB ALA A 36 113.332 -2.201 -2.313 1.00 0.00 C ATOM 0 H ALA A 36 111.380 -0.773 -2.956 1.00 0.00 H new ATOM 0 HA ALA A 36 113.645 -1.543 -4.341 1.00 0.00 H new ATOM 0 HB1 ALA A 36 114.256 -2.779 -2.276 1.00 0.00 H new ATOM 0 HB2 ALA A 36 113.505 -1.212 -1.888 1.00 0.00 H new ATOM 0 HB3 ALA A 36 112.560 -2.713 -1.738 1.00 0.00 H new ATOM 588 N VAL A 37 111.648 -4.152 -3.912 1.00 0.00 N ATOM 589 CA VAL A 37 111.394 -5.510 -4.469 1.00 0.00 C ATOM 590 C VAL A 37 111.282 -5.413 -5.989 1.00 0.00 C ATOM 591 O VAL A 37 111.787 -6.255 -6.710 1.00 0.00 O ATOM 592 CB VAL A 37 110.094 -6.075 -3.897 1.00 0.00 C ATOM 593 CG1 VAL A 37 108.983 -5.037 -4.031 1.00 0.00 C ATOM 594 CG2 VAL A 37 109.705 -7.336 -4.671 1.00 0.00 C ATOM 0 H VAL A 37 111.001 -3.849 -3.184 1.00 0.00 H new ATOM 0 HA VAL A 37 112.217 -6.172 -4.199 1.00 0.00 H new ATOM 0 HB VAL A 37 110.237 -6.320 -2.845 1.00 0.00 H new ATOM 0 HG11 VAL A 37 108.057 -5.441 -3.623 1.00 0.00 H new ATOM 0 HG12 VAL A 37 109.259 -4.136 -3.483 1.00 0.00 H new ATOM 0 HG13 VAL A 37 108.839 -4.792 -5.083 1.00 0.00 H new ATOM 0 HG21 VAL A 37 108.778 -7.741 -4.265 1.00 0.00 H new ATOM 0 HG22 VAL A 37 109.562 -7.088 -5.723 1.00 0.00 H new ATOM 0 HG23 VAL A 37 110.497 -8.079 -4.578 1.00 0.00 H new ATOM 604 N CYS A 38 110.648 -4.386 -6.493 1.00 0.00 N ATOM 605 CA CYS A 38 110.548 -4.256 -7.968 1.00 0.00 C ATOM 606 C CYS A 38 111.958 -4.375 -8.533 1.00 0.00 C ATOM 607 O CYS A 38 112.172 -4.850 -9.628 1.00 0.00 O ATOM 608 CB CYS A 38 109.955 -2.895 -8.340 1.00 0.00 C ATOM 609 SG CYS A 38 108.326 -2.715 -7.573 1.00 0.00 S ATOM 0 H CYS A 38 110.203 -3.644 -5.953 1.00 0.00 H new ATOM 0 HA CYS A 38 109.899 -5.031 -8.375 1.00 0.00 H new ATOM 0 HB2 CYS A 38 110.616 -2.095 -8.006 1.00 0.00 H new ATOM 0 HB3 CYS A 38 109.870 -2.807 -9.423 1.00 0.00 H new ATOM 0 HG CYS A 38 108.457 -2.679 -6.280 1.00 0.00 H new ATOM 615 N ALA A 39 112.927 -3.941 -7.779 1.00 0.00 N ATOM 616 CA ALA A 39 114.333 -4.031 -8.245 1.00 0.00 C ATOM 617 C ALA A 39 114.867 -5.457 -8.042 1.00 0.00 C ATOM 618 O ALA A 39 115.462 -6.041 -8.925 1.00 0.00 O ATOM 619 CB ALA A 39 115.190 -3.050 -7.450 1.00 0.00 C ATOM 0 H ALA A 39 112.803 -3.526 -6.856 1.00 0.00 H new ATOM 0 HA ALA A 39 114.375 -3.784 -9.306 1.00 0.00 H new ATOM 0 HB1 ALA A 39 116.224 -3.113 -7.789 1.00 0.00 H new ATOM 0 HB2 ALA A 39 114.819 -2.036 -7.602 1.00 0.00 H new ATOM 0 HB3 ALA A 39 115.140 -3.299 -6.390 1.00 0.00 H new ATOM 625 N ARG A 40 114.687 -6.002 -6.867 1.00 0.00 N ATOM 626 CA ARG A 40 115.219 -7.367 -6.574 1.00 0.00 C ATOM 627 C ARG A 40 115.020 -8.300 -7.773 1.00 0.00 C ATOM 628 O ARG A 40 115.901 -9.058 -8.118 1.00 0.00 O ATOM 629 CB ARG A 40 114.504 -7.941 -5.342 1.00 0.00 C ATOM 630 CG ARG A 40 114.831 -9.433 -5.190 1.00 0.00 C ATOM 631 CD ARG A 40 113.573 -10.268 -5.439 1.00 0.00 C ATOM 632 NE ARG A 40 112.761 -10.326 -4.191 1.00 0.00 N ATOM 633 CZ ARG A 40 111.964 -11.336 -3.977 1.00 0.00 C ATOM 634 NH1 ARG A 40 111.877 -12.297 -4.856 1.00 0.00 N ATOM 635 NH2 ARG A 40 111.253 -11.387 -2.883 1.00 0.00 N ATOM 0 H ARG A 40 114.192 -5.558 -6.094 1.00 0.00 H new ATOM 0 HA ARG A 40 116.288 -7.289 -6.376 1.00 0.00 H new ATOM 0 HB2 ARG A 40 114.813 -7.400 -4.448 1.00 0.00 H new ATOM 0 HB3 ARG A 40 113.427 -7.805 -5.441 1.00 0.00 H new ATOM 0 HG2 ARG A 40 115.612 -9.717 -5.895 1.00 0.00 H new ATOM 0 HG3 ARG A 40 115.217 -9.630 -4.190 1.00 0.00 H new ATOM 0 HD2 ARG A 40 112.987 -9.830 -6.247 1.00 0.00 H new ATOM 0 HD3 ARG A 40 113.848 -11.275 -5.754 1.00 0.00 H new ATOM 0 HE ARG A 40 112.828 -9.575 -3.504 1.00 0.00 H new ATOM 0 HH11 ARG A 40 112.432 -12.258 -5.711 1.00 0.00 H new ATOM 0 HH12 ARG A 40 111.254 -13.087 -4.688 1.00 0.00 H new ATOM 0 HH21 ARG A 40 111.321 -10.637 -2.195 1.00 0.00 H new ATOM 0 HH22 ARG A 40 110.630 -12.177 -2.716 1.00 0.00 H new ATOM 649 N ILE A 41 113.883 -8.274 -8.408 1.00 0.00 N ATOM 650 CA ILE A 41 113.684 -9.187 -9.574 1.00 0.00 C ATOM 651 C ILE A 41 114.082 -8.500 -10.886 1.00 0.00 C ATOM 652 O ILE A 41 114.333 -9.154 -11.879 1.00 0.00 O ATOM 653 CB ILE A 41 112.222 -9.621 -9.653 1.00 0.00 C ATOM 654 CG1 ILE A 41 111.330 -8.525 -9.072 1.00 0.00 C ATOM 655 CG2 ILE A 41 112.037 -10.910 -8.857 1.00 0.00 C ATOM 656 CD1 ILE A 41 111.646 -7.200 -9.762 1.00 0.00 C ATOM 0 H ILE A 41 113.093 -7.672 -8.178 1.00 0.00 H new ATOM 0 HA ILE A 41 114.320 -10.060 -9.431 1.00 0.00 H new ATOM 0 HB ILE A 41 111.947 -9.792 -10.694 1.00 0.00 H new ATOM 0 HG12 ILE A 41 110.280 -8.781 -9.214 1.00 0.00 H new ATOM 0 HG13 ILE A 41 111.494 -8.437 -7.998 1.00 0.00 H new ATOM 0 HG21 ILE A 41 110.995 -11.224 -8.910 1.00 0.00 H new ATOM 0 HG22 ILE A 41 112.673 -11.690 -9.275 1.00 0.00 H new ATOM 0 HG23 ILE A 41 112.311 -10.737 -7.816 1.00 0.00 H new ATOM 0 HD11 ILE A 41 111.012 -6.415 -9.350 1.00 0.00 H new ATOM 0 HD12 ILE A 41 112.693 -6.944 -9.597 1.00 0.00 H new ATOM 0 HD13 ILE A 41 111.460 -7.293 -10.832 1.00 0.00 H new ATOM 668 N ALA A 42 114.130 -7.196 -10.916 1.00 0.00 N ATOM 669 CA ALA A 42 114.497 -6.504 -12.183 1.00 0.00 C ATOM 670 C ALA A 42 116.017 -6.343 -12.265 1.00 0.00 C ATOM 671 O ALA A 42 116.540 -5.808 -13.221 1.00 0.00 O ATOM 672 CB ALA A 42 113.818 -5.134 -12.231 1.00 0.00 C ATOM 0 H ALA A 42 113.933 -6.584 -10.124 1.00 0.00 H new ATOM 0 HA ALA A 42 114.161 -7.099 -13.032 1.00 0.00 H new ATOM 0 HB1 ALA A 42 114.086 -4.627 -13.158 1.00 0.00 H new ATOM 0 HB2 ALA A 42 112.736 -5.262 -12.187 1.00 0.00 H new ATOM 0 HB3 ALA A 42 114.147 -4.535 -11.382 1.00 0.00 H new ATOM 678 N VAL A 43 116.724 -6.788 -11.260 1.00 0.00 N ATOM 679 CA VAL A 43 118.214 -6.651 -11.267 1.00 0.00 C ATOM 680 C VAL A 43 118.752 -6.706 -12.702 1.00 0.00 C ATOM 681 O VAL A 43 119.752 -6.097 -13.019 1.00 0.00 O ATOM 682 CB VAL A 43 118.836 -7.768 -10.423 1.00 0.00 C ATOM 683 CG1 VAL A 43 117.813 -8.290 -9.417 1.00 0.00 C ATOM 684 CG2 VAL A 43 119.294 -8.916 -11.321 1.00 0.00 C ATOM 0 H VAL A 43 116.335 -7.241 -10.433 1.00 0.00 H new ATOM 0 HA VAL A 43 118.483 -5.686 -10.839 1.00 0.00 H new ATOM 0 HB VAL A 43 119.697 -7.364 -9.891 1.00 0.00 H new ATOM 0 HG11 VAL A 43 118.262 -9.084 -8.820 1.00 0.00 H new ATOM 0 HG12 VAL A 43 117.499 -7.477 -8.762 1.00 0.00 H new ATOM 0 HG13 VAL A 43 116.946 -8.682 -9.949 1.00 0.00 H new ATOM 0 HG21 VAL A 43 119.734 -9.703 -10.709 1.00 0.00 H new ATOM 0 HG22 VAL A 43 118.439 -9.315 -11.866 1.00 0.00 H new ATOM 0 HG23 VAL A 43 120.037 -8.550 -12.030 1.00 0.00 H new ATOM 694 N ALA A 44 118.102 -7.424 -13.571 1.00 0.00 N ATOM 695 CA ALA A 44 118.584 -7.509 -14.979 1.00 0.00 C ATOM 696 C ALA A 44 119.990 -8.115 -15.000 1.00 0.00 C ATOM 697 O ALA A 44 120.427 -8.659 -15.995 1.00 0.00 O ATOM 698 CB ALA A 44 118.619 -6.107 -15.594 1.00 0.00 C ATOM 0 H ALA A 44 117.256 -7.957 -13.369 1.00 0.00 H new ATOM 0 HA ALA A 44 117.909 -8.139 -15.557 1.00 0.00 H new ATOM 0 HB1 ALA A 44 118.972 -6.170 -16.623 1.00 0.00 H new ATOM 0 HB2 ALA A 44 117.617 -5.678 -15.579 1.00 0.00 H new ATOM 0 HB3 ALA A 44 119.293 -5.474 -15.018 1.00 0.00 H new ATOM 704 N SER A 45 120.702 -8.028 -13.909 1.00 0.00 N ATOM 705 CA SER A 45 122.075 -8.601 -13.866 1.00 0.00 C ATOM 706 C SER A 45 122.008 -10.106 -14.088 1.00 0.00 C ATOM 707 O SER A 45 121.225 -10.602 -14.874 1.00 0.00 O ATOM 708 CB SER A 45 122.702 -8.331 -12.501 1.00 0.00 C ATOM 709 OG SER A 45 124.115 -8.257 -12.640 1.00 0.00 O ATOM 0 H SER A 45 120.390 -7.584 -13.045 1.00 0.00 H new ATOM 0 HA SER A 45 122.678 -8.138 -14.647 1.00 0.00 H new ATOM 0 HB2 SER A 45 122.316 -7.399 -12.089 1.00 0.00 H new ATOM 0 HB3 SER A 45 122.435 -9.123 -11.802 1.00 0.00 H new ATOM 0 HG SER A 45 124.381 -7.325 -12.785 1.00 0.00 H new ATOM 715 N ASP A 46 122.824 -10.834 -13.388 1.00 0.00 N ATOM 716 CA ASP A 46 122.823 -12.316 -13.534 1.00 0.00 C ATOM 717 C ASP A 46 122.955 -12.955 -12.152 1.00 0.00 C ATOM 718 O ASP A 46 123.801 -13.798 -11.926 1.00 0.00 O ATOM 719 CB ASP A 46 124.001 -12.745 -14.412 1.00 0.00 C ATOM 720 CG ASP A 46 123.972 -14.263 -14.598 1.00 0.00 C ATOM 721 OD1 ASP A 46 123.120 -14.898 -13.999 1.00 0.00 O ATOM 722 OD2 ASP A 46 124.804 -14.765 -15.337 1.00 0.00 O ATOM 0 H ASP A 46 123.497 -10.467 -12.716 1.00 0.00 H new ATOM 0 HA ASP A 46 121.892 -12.639 -14.000 1.00 0.00 H new ATOM 0 HB2 ASP A 46 123.946 -12.248 -15.381 1.00 0.00 H new ATOM 0 HB3 ASP A 46 124.941 -12.442 -13.951 1.00 0.00 H new ATOM 727 N GLY A 47 122.130 -12.557 -11.221 1.00 0.00 N ATOM 728 CA GLY A 47 122.218 -13.141 -9.854 1.00 0.00 C ATOM 729 C GLY A 47 120.872 -13.014 -9.143 1.00 0.00 C ATOM 730 O GLY A 47 120.352 -13.969 -8.602 1.00 0.00 O ATOM 0 H GLY A 47 121.401 -11.855 -11.348 1.00 0.00 H new ATOM 0 HA2 GLY A 47 122.508 -14.190 -9.916 1.00 0.00 H new ATOM 0 HA3 GLY A 47 122.991 -12.630 -9.280 1.00 0.00 H new ATOM 734 N VAL A 48 120.308 -11.840 -9.133 1.00 0.00 N ATOM 735 CA VAL A 48 118.999 -11.646 -8.450 1.00 0.00 C ATOM 736 C VAL A 48 119.170 -11.848 -6.946 1.00 0.00 C ATOM 737 O VAL A 48 120.072 -12.527 -6.497 1.00 0.00 O ATOM 738 CB VAL A 48 117.978 -12.649 -8.991 1.00 0.00 C ATOM 739 CG1 VAL A 48 116.564 -12.160 -8.671 1.00 0.00 C ATOM 740 CG2 VAL A 48 118.140 -12.775 -10.508 1.00 0.00 C ATOM 0 H VAL A 48 120.697 -11.004 -9.569 1.00 0.00 H new ATOM 0 HA VAL A 48 118.642 -10.634 -8.640 1.00 0.00 H new ATOM 0 HB VAL A 48 118.142 -13.621 -8.525 1.00 0.00 H new ATOM 0 HG11 VAL A 48 115.836 -12.874 -9.056 1.00 0.00 H new ATOM 0 HG12 VAL A 48 116.446 -12.069 -7.591 1.00 0.00 H new ATOM 0 HG13 VAL A 48 116.401 -11.188 -9.137 1.00 0.00 H new ATOM 0 HG21 VAL A 48 117.413 -13.490 -10.893 1.00 0.00 H new ATOM 0 HG22 VAL A 48 117.976 -11.803 -10.973 1.00 0.00 H new ATOM 0 HG23 VAL A 48 119.147 -13.122 -10.739 1.00 0.00 H new ATOM 750 N SER A 49 118.310 -11.257 -6.163 1.00 0.00 N ATOM 751 CA SER A 49 118.421 -11.405 -4.686 1.00 0.00 C ATOM 752 C SER A 49 117.092 -11.906 -4.117 1.00 0.00 C ATOM 753 O SER A 49 116.441 -12.757 -4.689 1.00 0.00 O ATOM 754 CB SER A 49 118.760 -10.050 -4.067 1.00 0.00 C ATOM 755 OG SER A 49 118.706 -10.154 -2.651 1.00 0.00 O ATOM 0 H SER A 49 117.534 -10.677 -6.484 1.00 0.00 H new ATOM 0 HA SER A 49 119.207 -12.123 -4.452 1.00 0.00 H new ATOM 0 HB2 SER A 49 119.754 -9.732 -4.382 1.00 0.00 H new ATOM 0 HB3 SER A 49 118.058 -9.292 -4.415 1.00 0.00 H new ATOM 0 HG SER A 49 118.986 -11.052 -2.378 1.00 0.00 H new ATOM 761 N SER A 50 116.692 -11.383 -2.990 1.00 0.00 N ATOM 762 CA SER A 50 115.413 -11.818 -2.364 1.00 0.00 C ATOM 763 C SER A 50 115.497 -11.560 -0.862 1.00 0.00 C ATOM 764 O SER A 50 114.835 -10.689 -0.332 1.00 0.00 O ATOM 765 CB SER A 50 115.197 -13.312 -2.613 1.00 0.00 C ATOM 766 OG SER A 50 114.469 -13.868 -1.525 1.00 0.00 O ATOM 0 H SER A 50 117.202 -10.667 -2.473 1.00 0.00 H new ATOM 0 HA SER A 50 114.580 -11.263 -2.796 1.00 0.00 H new ATOM 0 HB2 SER A 50 114.652 -13.462 -3.545 1.00 0.00 H new ATOM 0 HB3 SER A 50 116.157 -13.817 -2.720 1.00 0.00 H new ATOM 0 HG SER A 50 115.055 -14.458 -1.006 1.00 0.00 H new ATOM 772 N GLU A 51 116.317 -12.304 -0.174 1.00 0.00 N ATOM 773 CA GLU A 51 116.459 -12.099 1.292 1.00 0.00 C ATOM 774 C GLU A 51 117.209 -10.789 1.550 1.00 0.00 C ATOM 775 O GLU A 51 116.952 -10.098 2.512 1.00 0.00 O ATOM 776 CB GLU A 51 117.244 -13.265 1.897 1.00 0.00 C ATOM 777 CG GLU A 51 116.691 -14.586 1.361 1.00 0.00 C ATOM 778 CD GLU A 51 117.438 -14.971 0.082 1.00 0.00 C ATOM 779 OE1 GLU A 51 118.647 -15.126 0.150 1.00 0.00 O ATOM 780 OE2 GLU A 51 116.790 -15.105 -0.942 1.00 0.00 O ATOM 0 H GLU A 51 116.896 -13.047 -0.566 1.00 0.00 H new ATOM 0 HA GLU A 51 115.472 -12.051 1.751 1.00 0.00 H new ATOM 0 HB2 GLU A 51 118.301 -13.173 1.648 1.00 0.00 H new ATOM 0 HB3 GLU A 51 117.170 -13.242 2.984 1.00 0.00 H new ATOM 0 HG2 GLU A 51 116.803 -15.370 2.110 1.00 0.00 H new ATOM 0 HG3 GLU A 51 115.625 -14.490 1.157 1.00 0.00 H new ATOM 787 N GLU A 52 118.141 -10.446 0.702 1.00 0.00 N ATOM 788 CA GLU A 52 118.905 -9.183 0.912 1.00 0.00 C ATOM 789 C GLU A 52 118.009 -7.977 0.618 1.00 0.00 C ATOM 790 O GLU A 52 117.886 -7.079 1.426 1.00 0.00 O ATOM 791 CB GLU A 52 120.112 -9.162 -0.022 1.00 0.00 C ATOM 792 CG GLU A 52 121.366 -9.589 0.746 1.00 0.00 C ATOM 793 CD GLU A 52 121.681 -8.552 1.825 1.00 0.00 C ATOM 794 OE1 GLU A 52 121.471 -7.377 1.571 1.00 0.00 O ATOM 795 OE2 GLU A 52 122.128 -8.950 2.889 1.00 0.00 O ATOM 0 H GLU A 52 118.405 -10.983 -0.124 1.00 0.00 H new ATOM 0 HA GLU A 52 119.241 -9.133 1.948 1.00 0.00 H new ATOM 0 HB2 GLU A 52 119.944 -9.833 -0.865 1.00 0.00 H new ATOM 0 HB3 GLU A 52 120.249 -8.162 -0.433 1.00 0.00 H new ATOM 0 HG2 GLU A 52 121.211 -10.567 1.201 1.00 0.00 H new ATOM 0 HG3 GLU A 52 122.209 -9.685 0.062 1.00 0.00 H new ATOM 802 N LYS A 53 117.367 -7.947 -0.523 1.00 0.00 N ATOM 803 CA LYS A 53 116.478 -6.788 -0.822 1.00 0.00 C ATOM 804 C LYS A 53 115.445 -6.692 0.297 1.00 0.00 C ATOM 805 O LYS A 53 115.047 -5.619 0.704 1.00 0.00 O ATOM 806 CB LYS A 53 115.777 -6.984 -2.177 1.00 0.00 C ATOM 807 CG LYS A 53 114.448 -6.224 -2.192 1.00 0.00 C ATOM 808 CD LYS A 53 113.312 -7.181 -1.829 1.00 0.00 C ATOM 809 CE LYS A 53 112.210 -6.405 -1.114 1.00 0.00 C ATOM 810 NZ LYS A 53 111.025 -7.288 -0.915 1.00 0.00 N ATOM 0 H LYS A 53 117.419 -8.663 -1.248 1.00 0.00 H new ATOM 0 HA LYS A 53 117.063 -5.870 -0.880 1.00 0.00 H new ATOM 0 HB2 LYS A 53 116.419 -6.628 -2.983 1.00 0.00 H new ATOM 0 HB3 LYS A 53 115.601 -8.045 -2.355 1.00 0.00 H new ATOM 0 HG2 LYS A 53 114.482 -5.396 -1.483 1.00 0.00 H new ATOM 0 HG3 LYS A 53 114.274 -5.793 -3.178 1.00 0.00 H new ATOM 0 HD2 LYS A 53 112.916 -7.652 -2.729 1.00 0.00 H new ATOM 0 HD3 LYS A 53 113.685 -7.980 -1.188 1.00 0.00 H new ATOM 0 HE2 LYS A 53 112.572 -6.043 -0.152 1.00 0.00 H new ATOM 0 HE3 LYS A 53 111.929 -5.529 -1.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 110.163 -6.707 -0.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 110.951 -7.954 -1.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 111.133 -7.819 -0.027 1.00 0.00 H new ATOM 824 N GLN A 54 115.023 -7.814 0.813 1.00 0.00 N ATOM 825 CA GLN A 54 114.035 -7.797 1.920 1.00 0.00 C ATOM 826 C GLN A 54 114.582 -6.908 3.044 1.00 0.00 C ATOM 827 O GLN A 54 113.869 -6.115 3.634 1.00 0.00 O ATOM 828 CB GLN A 54 113.813 -9.233 2.415 1.00 0.00 C ATOM 829 CG GLN A 54 114.439 -9.419 3.797 1.00 0.00 C ATOM 830 CD GLN A 54 114.269 -10.872 4.244 1.00 0.00 C ATOM 831 OE1 GLN A 54 115.219 -11.630 4.260 1.00 0.00 O ATOM 832 NE2 GLN A 54 113.091 -11.296 4.609 1.00 0.00 N ATOM 0 H GLN A 54 115.322 -8.742 0.513 1.00 0.00 H new ATOM 0 HA GLN A 54 113.079 -7.397 1.583 1.00 0.00 H new ATOM 0 HB2 GLN A 54 112.746 -9.449 2.459 1.00 0.00 H new ATOM 0 HB3 GLN A 54 114.252 -9.940 1.711 1.00 0.00 H new ATOM 0 HG2 GLN A 54 115.497 -9.158 3.767 1.00 0.00 H new ATOM 0 HG3 GLN A 54 113.966 -8.749 4.515 1.00 0.00 H new ATOM 0 HE21 GLN A 54 112.293 -10.660 4.596 1.00 0.00 H new ATOM 0 HE22 GLN A 54 112.967 -12.263 4.908 1.00 0.00 H new ATOM 841 N LYS A 55 115.853 -7.020 3.331 1.00 0.00 N ATOM 842 CA LYS A 55 116.451 -6.170 4.395 1.00 0.00 C ATOM 843 C LYS A 55 116.269 -4.709 3.991 1.00 0.00 C ATOM 844 O LYS A 55 115.986 -3.854 4.806 1.00 0.00 O ATOM 845 CB LYS A 55 117.944 -6.488 4.533 1.00 0.00 C ATOM 846 CG LYS A 55 118.176 -7.333 5.788 1.00 0.00 C ATOM 847 CD LYS A 55 117.475 -8.684 5.631 1.00 0.00 C ATOM 848 CE LYS A 55 117.955 -9.638 6.726 1.00 0.00 C ATOM 849 NZ LYS A 55 117.601 -9.080 8.062 1.00 0.00 N ATOM 0 H LYS A 55 116.499 -7.663 2.874 1.00 0.00 H new ATOM 0 HA LYS A 55 115.964 -6.361 5.351 1.00 0.00 H new ATOM 0 HB2 LYS A 55 118.295 -7.024 3.651 1.00 0.00 H new ATOM 0 HB3 LYS A 55 118.519 -5.564 4.593 1.00 0.00 H new ATOM 0 HG2 LYS A 55 119.244 -7.482 5.947 1.00 0.00 H new ATOM 0 HG3 LYS A 55 117.793 -6.812 6.666 1.00 0.00 H new ATOM 0 HD2 LYS A 55 116.395 -8.555 5.695 1.00 0.00 H new ATOM 0 HD3 LYS A 55 117.688 -9.104 4.648 1.00 0.00 H new ATOM 0 HE2 LYS A 55 117.496 -10.618 6.596 1.00 0.00 H new ATOM 0 HE3 LYS A 55 119.033 -9.779 6.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 117.707 -9.819 8.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 118.233 -8.284 8.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 116.616 -8.747 8.049 1.00 0.00 H new ATOM 863 N MET A 56 116.419 -4.423 2.726 1.00 0.00 N ATOM 864 CA MET A 56 116.245 -3.026 2.250 1.00 0.00 C ATOM 865 C MET A 56 114.895 -2.493 2.742 1.00 0.00 C ATOM 866 O MET A 56 114.810 -1.411 3.286 1.00 0.00 O ATOM 867 CB MET A 56 116.274 -3.011 0.716 1.00 0.00 C ATOM 868 CG MET A 56 117.275 -1.966 0.217 1.00 0.00 C ATOM 869 SD MET A 56 116.523 -0.321 0.302 1.00 0.00 S ATOM 870 CE MET A 56 118.038 0.642 0.065 1.00 0.00 C ATOM 0 H MET A 56 116.655 -5.101 2.001 1.00 0.00 H new ATOM 0 HA MET A 56 117.048 -2.398 2.636 1.00 0.00 H new ATOM 0 HB2 MET A 56 116.549 -3.997 0.340 1.00 0.00 H new ATOM 0 HB3 MET A 56 115.280 -2.788 0.328 1.00 0.00 H new ATOM 0 HG2 MET A 56 118.180 -1.995 0.823 1.00 0.00 H new ATOM 0 HG3 MET A 56 117.570 -2.190 -0.808 1.00 0.00 H new ATOM 0 HE1 MET A 56 118.144 1.359 0.879 1.00 0.00 H new ATOM 0 HE2 MET A 56 118.898 -0.028 0.058 1.00 0.00 H new ATOM 0 HE3 MET A 56 117.985 1.175 -0.884 1.00 0.00 H new ATOM 880 N ILE A 57 113.836 -3.241 2.567 1.00 0.00 N ATOM 881 CA ILE A 57 112.510 -2.752 3.041 1.00 0.00 C ATOM 882 C ILE A 57 112.617 -2.394 4.524 1.00 0.00 C ATOM 883 O ILE A 57 112.218 -1.327 4.944 1.00 0.00 O ATOM 884 CB ILE A 57 111.439 -3.832 2.851 1.00 0.00 C ATOM 885 CG1 ILE A 57 111.818 -4.734 1.678 1.00 0.00 C ATOM 886 CG2 ILE A 57 110.081 -3.177 2.565 1.00 0.00 C ATOM 887 CD1 ILE A 57 110.671 -5.711 1.390 1.00 0.00 C ATOM 0 H ILE A 57 113.832 -4.159 2.122 1.00 0.00 H new ATOM 0 HA ILE A 57 112.223 -1.875 2.461 1.00 0.00 H new ATOM 0 HB ILE A 57 111.371 -4.426 3.763 1.00 0.00 H new ATOM 0 HG12 ILE A 57 112.026 -4.131 0.794 1.00 0.00 H new ATOM 0 HG13 ILE A 57 112.729 -5.285 1.909 1.00 0.00 H new ATOM 0 HG21 ILE A 57 109.325 -3.951 2.431 1.00 0.00 H new ATOM 0 HG22 ILE A 57 109.802 -2.538 3.403 1.00 0.00 H new ATOM 0 HG23 ILE A 57 110.150 -2.577 1.658 1.00 0.00 H new ATOM 0 HD11 ILE A 57 110.942 -6.354 0.553 1.00 0.00 H new ATOM 0 HD12 ILE A 57 110.484 -6.323 2.272 1.00 0.00 H new ATOM 0 HD13 ILE A 57 109.770 -5.151 1.140 1.00 0.00 H new ATOM 899 N GLY A 58 113.167 -3.268 5.325 1.00 0.00 N ATOM 900 CA GLY A 58 113.305 -2.942 6.774 1.00 0.00 C ATOM 901 C GLY A 58 114.020 -1.596 6.894 1.00 0.00 C ATOM 902 O GLY A 58 113.612 -0.712 7.632 1.00 0.00 O ATOM 0 H GLY A 58 113.522 -4.182 5.043 1.00 0.00 H new ATOM 0 HA2 GLY A 58 112.325 -2.895 7.248 1.00 0.00 H new ATOM 0 HA3 GLY A 58 113.871 -3.720 7.287 1.00 0.00 H new ATOM 906 N PHE A 59 115.076 -1.426 6.149 1.00 0.00 N ATOM 907 CA PHE A 59 115.812 -0.139 6.189 1.00 0.00 C ATOM 908 C PHE A 59 114.821 0.981 5.880 1.00 0.00 C ATOM 909 O PHE A 59 114.841 2.029 6.490 1.00 0.00 O ATOM 910 CB PHE A 59 116.929 -0.169 5.141 1.00 0.00 C ATOM 911 CG PHE A 59 116.979 1.140 4.392 1.00 0.00 C ATOM 912 CD1 PHE A 59 117.602 2.250 4.968 1.00 0.00 C ATOM 913 CD2 PHE A 59 116.410 1.239 3.118 1.00 0.00 C ATOM 914 CE1 PHE A 59 117.654 3.460 4.271 1.00 0.00 C ATOM 915 CE2 PHE A 59 116.463 2.448 2.420 1.00 0.00 C ATOM 916 CZ PHE A 59 117.084 3.559 2.996 1.00 0.00 C ATOM 0 H PHE A 59 115.459 -2.126 5.514 1.00 0.00 H new ATOM 0 HA PHE A 59 116.259 0.026 7.169 1.00 0.00 H new ATOM 0 HB2 PHE A 59 117.887 -0.355 5.626 1.00 0.00 H new ATOM 0 HB3 PHE A 59 116.760 -0.989 4.443 1.00 0.00 H new ATOM 0 HD1 PHE A 59 118.043 2.173 5.951 1.00 0.00 H new ATOM 0 HD2 PHE A 59 115.929 0.380 2.674 1.00 0.00 H new ATOM 0 HE1 PHE A 59 118.134 4.319 4.716 1.00 0.00 H new ATOM 0 HE2 PHE A 59 116.024 2.524 1.436 1.00 0.00 H new ATOM 0 HZ PHE A 59 117.124 4.494 2.458 1.00 0.00 H new ATOM 926 N LEU A 60 113.934 0.750 4.951 1.00 0.00 N ATOM 927 CA LEU A 60 112.919 1.783 4.618 1.00 0.00 C ATOM 928 C LEU A 60 112.195 2.169 5.906 1.00 0.00 C ATOM 929 O LEU A 60 111.973 3.330 6.184 1.00 0.00 O ATOM 930 CB LEU A 60 111.917 1.200 3.614 1.00 0.00 C ATOM 931 CG LEU A 60 111.924 1.987 2.293 1.00 0.00 C ATOM 932 CD1 LEU A 60 113.354 2.387 1.903 1.00 0.00 C ATOM 933 CD2 LEU A 60 111.346 1.092 1.198 1.00 0.00 C ATOM 0 H LEU A 60 113.870 -0.112 4.409 1.00 0.00 H new ATOM 0 HA LEU A 60 113.393 2.660 4.178 1.00 0.00 H new ATOM 0 HB2 LEU A 60 112.161 0.156 3.418 1.00 0.00 H new ATOM 0 HB3 LEU A 60 110.916 1.218 4.045 1.00 0.00 H new ATOM 0 HG LEU A 60 111.330 2.893 2.414 1.00 0.00 H new ATOM 0 HD11 LEU A 60 113.334 2.943 0.965 1.00 0.00 H new ATOM 0 HD12 LEU A 60 113.783 3.012 2.686 1.00 0.00 H new ATOM 0 HD13 LEU A 60 113.962 1.491 1.780 1.00 0.00 H new ATOM 0 HD21 LEU A 60 111.342 1.632 0.251 1.00 0.00 H new ATOM 0 HD22 LEU A 60 111.957 0.195 1.101 1.00 0.00 H new ATOM 0 HD23 LEU A 60 110.326 0.810 1.459 1.00 0.00 H new ATOM 945 N ARG A 61 111.840 1.198 6.704 1.00 0.00 N ATOM 946 CA ARG A 61 111.145 1.506 7.982 1.00 0.00 C ATOM 947 C ARG A 61 111.932 2.587 8.717 1.00 0.00 C ATOM 948 O ARG A 61 111.369 3.487 9.308 1.00 0.00 O ATOM 949 CB ARG A 61 111.079 0.246 8.849 1.00 0.00 C ATOM 950 CG ARG A 61 110.448 -0.895 8.050 1.00 0.00 C ATOM 951 CD ARG A 61 110.531 -2.192 8.857 1.00 0.00 C ATOM 952 NE ARG A 61 109.549 -2.144 9.977 1.00 0.00 N ATOM 953 CZ ARG A 61 109.893 -1.627 11.125 1.00 0.00 C ATOM 954 NH1 ARG A 61 111.096 -1.150 11.293 1.00 0.00 N ATOM 955 NH2 ARG A 61 109.032 -1.586 12.105 1.00 0.00 N ATOM 0 H ARG A 61 112.002 0.207 6.525 1.00 0.00 H new ATOM 0 HA ARG A 61 110.132 1.853 7.779 1.00 0.00 H new ATOM 0 HB2 ARG A 61 112.080 -0.036 9.176 1.00 0.00 H new ATOM 0 HB3 ARG A 61 110.494 0.441 9.748 1.00 0.00 H new ATOM 0 HG2 ARG A 61 109.408 -0.662 7.823 1.00 0.00 H new ATOM 0 HG3 ARG A 61 110.963 -1.014 7.097 1.00 0.00 H new ATOM 0 HD2 ARG A 61 110.323 -3.047 8.214 1.00 0.00 H new ATOM 0 HD3 ARG A 61 111.539 -2.325 9.249 1.00 0.00 H new ATOM 0 HE ARG A 61 108.608 -2.515 9.846 1.00 0.00 H new ATOM 0 HH11 ARG A 61 111.769 -1.181 10.527 1.00 0.00 H new ATOM 0 HH12 ARG A 61 111.364 -0.746 12.191 1.00 0.00 H new ATOM 0 HH21 ARG A 61 108.091 -1.958 11.973 1.00 0.00 H new ATOM 0 HH22 ARG A 61 109.300 -1.182 13.003 1.00 0.00 H new ATOM 969 N SER A 62 113.235 2.507 8.682 1.00 0.00 N ATOM 970 CA SER A 62 114.059 3.538 9.379 1.00 0.00 C ATOM 971 C SER A 62 114.827 4.384 8.354 1.00 0.00 C ATOM 972 O SER A 62 115.656 5.195 8.711 1.00 0.00 O ATOM 973 CB SER A 62 115.048 2.846 10.317 1.00 0.00 C ATOM 974 OG SER A 62 114.347 2.332 11.442 1.00 0.00 O ATOM 0 H SER A 62 113.763 1.777 8.204 1.00 0.00 H new ATOM 0 HA SER A 62 113.403 4.191 9.954 1.00 0.00 H new ATOM 0 HB2 SER A 62 115.560 2.039 9.793 1.00 0.00 H new ATOM 0 HB3 SER A 62 115.813 3.551 10.642 1.00 0.00 H new ATOM 0 HG SER A 62 114.978 1.886 12.045 1.00 0.00 H new ATOM 980 N SER A 63 114.566 4.194 7.085 1.00 0.00 N ATOM 981 CA SER A 63 115.291 4.979 6.038 1.00 0.00 C ATOM 982 C SER A 63 115.403 6.447 6.446 1.00 0.00 C ATOM 983 O SER A 63 114.894 6.860 7.466 1.00 0.00 O ATOM 984 CB SER A 63 114.535 4.893 4.716 1.00 0.00 C ATOM 985 OG SER A 63 114.632 6.139 4.039 1.00 0.00 O ATOM 0 H SER A 63 113.881 3.528 6.728 1.00 0.00 H new ATOM 0 HA SER A 63 116.291 4.560 5.927 1.00 0.00 H new ATOM 0 HB2 SER A 63 114.949 4.097 4.098 1.00 0.00 H new ATOM 0 HB3 SER A 63 113.489 4.645 4.897 1.00 0.00 H new ATOM 0 HG SER A 63 113.819 6.290 3.513 1.00 0.00 H new ATOM 991 N GLU A 64 116.062 7.239 5.643 1.00 0.00 N ATOM 992 CA GLU A 64 116.207 8.683 5.972 1.00 0.00 C ATOM 993 C GLU A 64 114.823 9.323 6.048 1.00 0.00 C ATOM 994 O GLU A 64 114.655 10.396 6.591 1.00 0.00 O ATOM 995 CB GLU A 64 117.034 9.377 4.886 1.00 0.00 C ATOM 996 CG GLU A 64 117.372 10.806 5.330 1.00 0.00 C ATOM 997 CD GLU A 64 118.891 10.994 5.345 1.00 0.00 C ATOM 998 OE1 GLU A 64 119.572 10.114 5.843 1.00 0.00 O ATOM 999 OE2 GLU A 64 119.346 12.016 4.858 1.00 0.00 O ATOM 0 H GLU A 64 116.506 6.946 4.773 1.00 0.00 H new ATOM 0 HA GLU A 64 116.713 8.790 6.932 1.00 0.00 H new ATOM 0 HB2 GLU A 64 117.950 8.817 4.699 1.00 0.00 H new ATOM 0 HB3 GLU A 64 116.477 9.399 3.949 1.00 0.00 H new ATOM 0 HG2 GLU A 64 116.913 11.526 4.653 1.00 0.00 H new ATOM 0 HG3 GLU A 64 116.962 10.996 6.322 1.00 0.00 H new ATOM 1006 N GLU A 65 113.825 8.670 5.514 1.00 0.00 N ATOM 1007 CA GLU A 65 112.453 9.245 5.566 1.00 0.00 C ATOM 1008 C GLU A 65 112.218 9.824 6.960 1.00 0.00 C ATOM 1009 O GLU A 65 111.328 10.623 7.172 1.00 0.00 O ATOM 1010 CB GLU A 65 111.425 8.144 5.293 1.00 0.00 C ATOM 1011 CG GLU A 65 111.247 7.957 3.780 1.00 0.00 C ATOM 1012 CD GLU A 65 111.352 6.471 3.431 1.00 0.00 C ATOM 1013 OE1 GLU A 65 112.464 5.973 3.375 1.00 0.00 O ATOM 1014 OE2 GLU A 65 110.318 5.856 3.224 1.00 0.00 O ATOM 0 H GLU A 65 113.902 7.767 5.046 1.00 0.00 H new ATOM 0 HA GLU A 65 112.349 10.027 4.814 1.00 0.00 H new ATOM 0 HB2 GLU A 65 111.752 7.209 5.748 1.00 0.00 H new ATOM 0 HB3 GLU A 65 110.471 8.404 5.751 1.00 0.00 H new ATOM 0 HG2 GLU A 65 110.279 8.347 3.467 1.00 0.00 H new ATOM 0 HG3 GLU A 65 112.008 8.522 3.241 1.00 0.00 H new ATOM 1021 N LEU A 66 113.022 9.433 7.911 1.00 0.00 N ATOM 1022 CA LEU A 66 112.855 9.970 9.292 1.00 0.00 C ATOM 1023 C LEU A 66 112.746 11.491 9.210 1.00 0.00 C ATOM 1024 O LEU A 66 112.209 12.140 10.086 1.00 0.00 O ATOM 1025 CB LEU A 66 114.072 9.596 10.148 1.00 0.00 C ATOM 1026 CG LEU A 66 114.354 8.094 10.028 1.00 0.00 C ATOM 1027 CD1 LEU A 66 115.862 7.863 9.897 1.00 0.00 C ATOM 1028 CD2 LEU A 66 113.844 7.374 11.278 1.00 0.00 C ATOM 0 H LEU A 66 113.785 8.767 7.792 1.00 0.00 H new ATOM 0 HA LEU A 66 111.958 9.548 9.746 1.00 0.00 H new ATOM 0 HB2 LEU A 66 114.943 10.165 9.825 1.00 0.00 H new ATOM 0 HB3 LEU A 66 113.889 9.858 11.190 1.00 0.00 H new ATOM 0 HG LEU A 66 113.845 7.704 9.147 1.00 0.00 H new ATOM 0 HD11 LEU A 66 116.060 6.795 9.812 1.00 0.00 H new ATOM 0 HD12 LEU A 66 116.232 8.373 9.008 1.00 0.00 H new ATOM 0 HD13 LEU A 66 116.368 8.257 10.778 1.00 0.00 H new ATOM 0 HD21 LEU A 66 114.045 6.306 11.191 1.00 0.00 H new ATOM 0 HD22 LEU A 66 114.352 7.768 12.158 1.00 0.00 H new ATOM 0 HD23 LEU A 66 112.770 7.534 11.377 1.00 0.00 H new ATOM 1040 N LYS A 67 113.258 12.059 8.155 1.00 0.00 N ATOM 1041 CA LYS A 67 113.200 13.537 7.987 1.00 0.00 C ATOM 1042 C LYS A 67 111.822 13.941 7.461 1.00 0.00 C ATOM 1043 O LYS A 67 111.206 14.852 7.972 1.00 0.00 O ATOM 1044 CB LYS A 67 114.270 13.970 6.985 1.00 0.00 C ATOM 1045 CG LYS A 67 114.352 12.937 5.856 1.00 0.00 C ATOM 1046 CD LYS A 67 114.205 13.633 4.507 1.00 0.00 C ATOM 1047 CE LYS A 67 113.931 12.584 3.429 1.00 0.00 C ATOM 1048 NZ LYS A 67 115.151 11.756 3.216 1.00 0.00 N ATOM 0 H LYS A 67 113.718 11.558 7.395 1.00 0.00 H new ATOM 0 HA LYS A 67 113.376 14.020 8.948 1.00 0.00 H new ATOM 0 HB2 LYS A 67 114.028 14.952 6.578 1.00 0.00 H new ATOM 0 HB3 LYS A 67 115.236 14.060 7.482 1.00 0.00 H new ATOM 0 HG2 LYS A 67 115.305 12.410 5.902 1.00 0.00 H new ATOM 0 HG3 LYS A 67 113.568 12.189 5.977 1.00 0.00 H new ATOM 0 HD2 LYS A 67 113.390 14.356 4.544 1.00 0.00 H new ATOM 0 HD3 LYS A 67 115.113 14.188 4.269 1.00 0.00 H new ATOM 0 HE2 LYS A 67 113.096 11.950 3.728 1.00 0.00 H new ATOM 0 HE3 LYS A 67 113.643 13.072 2.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 115.179 11.427 2.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 115.997 12.327 3.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 115.130 10.935 3.855 1.00 0.00 H new ATOM 1062 N VAL A 68 111.336 13.272 6.441 1.00 0.00 N ATOM 1063 CA VAL A 68 109.995 13.616 5.883 1.00 0.00 C ATOM 1064 C VAL A 68 110.134 14.780 4.895 1.00 0.00 C ATOM 1065 O VAL A 68 109.365 15.716 4.936 1.00 0.00 O ATOM 1066 CB VAL A 68 109.059 14.024 7.037 1.00 0.00 C ATOM 1067 CG1 VAL A 68 107.601 14.016 6.573 1.00 0.00 C ATOM 1068 CG2 VAL A 68 109.222 13.039 8.201 1.00 0.00 C ATOM 0 H VAL A 68 111.814 12.502 5.973 1.00 0.00 H new ATOM 0 HA VAL A 68 109.580 12.753 5.363 1.00 0.00 H new ATOM 0 HB VAL A 68 109.323 15.031 7.361 1.00 0.00 H new ATOM 0 HG11 VAL A 68 106.954 14.307 7.401 1.00 0.00 H new ATOM 0 HG12 VAL A 68 107.477 14.721 5.751 1.00 0.00 H new ATOM 0 HG13 VAL A 68 107.332 13.015 6.236 1.00 0.00 H new ATOM 0 HG21 VAL A 68 108.560 13.328 9.017 1.00 0.00 H new ATOM 0 HG22 VAL A 68 108.967 12.034 7.865 1.00 0.00 H new ATOM 0 HG23 VAL A 68 110.255 13.055 8.549 1.00 0.00 H new ATOM 1078 N PHE A 69 111.102 14.736 4.001 1.00 0.00 N ATOM 1079 CA PHE A 69 111.257 15.868 3.031 1.00 0.00 C ATOM 1080 C PHE A 69 112.315 15.572 1.956 1.00 0.00 C ATOM 1081 O PHE A 69 112.015 15.554 0.779 1.00 0.00 O ATOM 1082 CB PHE A 69 111.682 17.130 3.786 1.00 0.00 C ATOM 1083 CG PHE A 69 110.523 17.674 4.585 1.00 0.00 C ATOM 1084 CD1 PHE A 69 109.451 18.295 3.935 1.00 0.00 C ATOM 1085 CD2 PHE A 69 110.523 17.556 5.980 1.00 0.00 C ATOM 1086 CE1 PHE A 69 108.378 18.800 4.680 1.00 0.00 C ATOM 1087 CE2 PHE A 69 109.451 18.060 6.726 1.00 0.00 C ATOM 1088 CZ PHE A 69 108.378 18.682 6.076 1.00 0.00 C ATOM 0 H PHE A 69 111.778 13.978 3.904 1.00 0.00 H new ATOM 0 HA PHE A 69 110.294 16.006 2.539 1.00 0.00 H new ATOM 0 HB2 PHE A 69 112.516 16.902 4.450 1.00 0.00 H new ATOM 0 HB3 PHE A 69 112.033 17.884 3.081 1.00 0.00 H new ATOM 0 HD1 PHE A 69 109.451 18.385 2.859 1.00 0.00 H new ATOM 0 HD2 PHE A 69 111.351 17.076 6.481 1.00 0.00 H new ATOM 0 HE1 PHE A 69 107.551 19.280 4.179 1.00 0.00 H new ATOM 0 HE2 PHE A 69 109.452 17.969 7.802 1.00 0.00 H new ATOM 0 HZ PHE A 69 107.550 19.071 6.651 1.00 0.00 H new ATOM 1098 N ASP A 70 113.556 15.392 2.333 1.00 0.00 N ATOM 1099 CA ASP A 70 114.618 15.160 1.302 1.00 0.00 C ATOM 1100 C ASP A 70 114.167 14.105 0.291 1.00 0.00 C ATOM 1101 O ASP A 70 114.475 12.930 0.404 1.00 0.00 O ATOM 1102 CB ASP A 70 115.918 14.710 1.971 1.00 0.00 C ATOM 1103 CG ASP A 70 117.070 14.823 0.970 1.00 0.00 C ATOM 1104 OD1 ASP A 70 117.193 13.941 0.137 1.00 0.00 O ATOM 1105 OD2 ASP A 70 117.808 15.791 1.053 1.00 0.00 O ATOM 0 H ASP A 70 113.880 15.395 3.300 1.00 0.00 H new ATOM 0 HA ASP A 70 114.792 16.099 0.776 1.00 0.00 H new ATOM 0 HB2 ASP A 70 116.121 15.326 2.847 1.00 0.00 H new ATOM 0 HB3 ASP A 70 115.824 13.681 2.319 1.00 0.00 H new ATOM 1110 N THR A 71 113.451 14.530 -0.711 1.00 0.00 N ATOM 1111 CA THR A 71 112.978 13.586 -1.756 1.00 0.00 C ATOM 1112 C THR A 71 114.187 13.012 -2.494 1.00 0.00 C ATOM 1113 O THR A 71 114.190 11.871 -2.912 1.00 0.00 O ATOM 1114 CB THR A 71 112.091 14.340 -2.750 1.00 0.00 C ATOM 1115 OG1 THR A 71 112.664 14.262 -4.046 1.00 0.00 O ATOM 1116 CG2 THR A 71 111.981 15.807 -2.332 1.00 0.00 C ATOM 0 H THR A 71 113.171 15.501 -0.851 1.00 0.00 H new ATOM 0 HA THR A 71 112.409 12.778 -1.296 1.00 0.00 H new ATOM 0 HB THR A 71 111.098 13.891 -2.760 1.00 0.00 H new ATOM 0 HG1 THR A 71 113.002 15.144 -4.308 1.00 0.00 H new ATOM 0 HG21 THR A 71 111.349 16.341 -3.042 1.00 0.00 H new ATOM 0 HG22 THR A 71 111.542 15.870 -1.336 1.00 0.00 H new ATOM 0 HG23 THR A 71 112.974 16.257 -2.320 1.00 0.00 H new ATOM 1124 N ALA A 72 115.214 13.799 -2.657 1.00 0.00 N ATOM 1125 CA ALA A 72 116.424 13.305 -3.368 1.00 0.00 C ATOM 1126 C ALA A 72 116.982 12.089 -2.631 1.00 0.00 C ATOM 1127 O ALA A 72 117.466 11.156 -3.237 1.00 0.00 O ATOM 1128 CB ALA A 72 117.481 14.410 -3.405 1.00 0.00 C ATOM 0 H ALA A 72 115.267 14.763 -2.328 1.00 0.00 H new ATOM 0 HA ALA A 72 116.159 13.024 -4.387 1.00 0.00 H new ATOM 0 HB1 ALA A 72 118.368 14.048 -3.926 1.00 0.00 H new ATOM 0 HB2 ALA A 72 117.081 15.278 -3.929 1.00 0.00 H new ATOM 0 HB3 ALA A 72 117.748 14.692 -2.387 1.00 0.00 H new ATOM 1134 N GLU A 73 116.916 12.094 -1.327 1.00 0.00 N ATOM 1135 CA GLU A 73 117.444 10.939 -0.546 1.00 0.00 C ATOM 1136 C GLU A 73 116.553 9.714 -0.770 1.00 0.00 C ATOM 1137 O GLU A 73 117.019 8.591 -0.798 1.00 0.00 O ATOM 1138 CB GLU A 73 117.451 11.295 0.941 1.00 0.00 C ATOM 1139 CG GLU A 73 118.749 12.030 1.285 1.00 0.00 C ATOM 1140 CD GLU A 73 119.854 11.011 1.566 1.00 0.00 C ATOM 1141 OE1 GLU A 73 119.732 9.890 1.099 1.00 0.00 O ATOM 1142 OE2 GLU A 73 120.803 11.368 2.244 1.00 0.00 O ATOM 0 H GLU A 73 116.519 12.849 -0.768 1.00 0.00 H new ATOM 0 HA GLU A 73 118.458 10.713 -0.875 1.00 0.00 H new ATOM 0 HB2 GLU A 73 116.592 11.922 1.180 1.00 0.00 H new ATOM 0 HB3 GLU A 73 117.363 10.390 1.543 1.00 0.00 H new ATOM 0 HG2 GLU A 73 119.041 12.680 0.460 1.00 0.00 H new ATOM 0 HG3 GLU A 73 118.598 12.668 2.156 1.00 0.00 H new ATOM 1149 N VAL A 74 115.274 9.919 -0.929 1.00 0.00 N ATOM 1150 CA VAL A 74 114.360 8.763 -1.149 1.00 0.00 C ATOM 1151 C VAL A 74 114.678 8.118 -2.504 1.00 0.00 C ATOM 1152 O VAL A 74 115.129 6.981 -2.586 1.00 0.00 O ATOM 1153 CB VAL A 74 112.920 9.271 -1.130 1.00 0.00 C ATOM 1154 CG1 VAL A 74 111.955 8.086 -1.148 1.00 0.00 C ATOM 1155 CG2 VAL A 74 112.690 10.101 0.138 1.00 0.00 C ATOM 0 H VAL A 74 114.824 10.834 -0.916 1.00 0.00 H new ATOM 0 HA VAL A 74 114.492 8.017 -0.365 1.00 0.00 H new ATOM 0 HB VAL A 74 112.743 9.891 -2.009 1.00 0.00 H new ATOM 0 HG11 VAL A 74 110.929 8.452 -1.134 1.00 0.00 H new ATOM 0 HG12 VAL A 74 112.118 7.498 -2.051 1.00 0.00 H new ATOM 0 HG13 VAL A 74 112.129 7.462 -0.272 1.00 0.00 H new ATOM 0 HG21 VAL A 74 111.663 10.465 0.153 1.00 0.00 H new ATOM 0 HG22 VAL A 74 112.869 9.481 1.016 1.00 0.00 H new ATOM 0 HG23 VAL A 74 113.375 10.949 0.147 1.00 0.00 H new ATOM 1165 N ILE A 75 114.471 8.836 -3.572 1.00 0.00 N ATOM 1166 CA ILE A 75 114.793 8.266 -4.903 1.00 0.00 C ATOM 1167 C ILE A 75 116.228 7.761 -4.853 1.00 0.00 C ATOM 1168 O ILE A 75 116.624 6.911 -5.611 1.00 0.00 O ATOM 1169 CB ILE A 75 114.664 9.334 -5.992 1.00 0.00 C ATOM 1170 CG1 ILE A 75 115.329 10.634 -5.519 1.00 0.00 C ATOM 1171 CG2 ILE A 75 113.183 9.586 -6.296 1.00 0.00 C ATOM 1172 CD1 ILE A 75 116.462 11.008 -6.478 1.00 0.00 C ATOM 0 H ILE A 75 114.096 9.785 -3.579 1.00 0.00 H new ATOM 0 HA ILE A 75 114.101 7.457 -5.139 1.00 0.00 H new ATOM 0 HB ILE A 75 115.160 8.988 -6.899 1.00 0.00 H new ATOM 0 HG12 ILE A 75 114.593 11.437 -5.478 1.00 0.00 H new ATOM 0 HG13 ILE A 75 115.720 10.508 -4.509 1.00 0.00 H new ATOM 0 HG21 ILE A 75 113.095 10.347 -7.072 1.00 0.00 H new ATOM 0 HG22 ILE A 75 112.720 8.661 -6.641 1.00 0.00 H new ATOM 0 HG23 ILE A 75 112.679 9.929 -5.392 1.00 0.00 H new ATOM 0 HD11 ILE A 75 116.934 11.931 -6.141 1.00 0.00 H new ATOM 0 HD12 ILE A 75 117.202 10.208 -6.496 1.00 0.00 H new ATOM 0 HD13 ILE A 75 116.058 11.151 -7.480 1.00 0.00 H new ATOM 1184 N GLU A 76 117.013 8.287 -3.957 1.00 0.00 N ATOM 1185 CA GLU A 76 118.425 7.832 -3.855 1.00 0.00 C ATOM 1186 C GLU A 76 118.443 6.339 -3.544 1.00 0.00 C ATOM 1187 O GLU A 76 119.216 5.593 -4.110 1.00 0.00 O ATOM 1188 CB GLU A 76 119.145 8.591 -2.740 1.00 0.00 C ATOM 1189 CG GLU A 76 120.650 8.588 -3.012 1.00 0.00 C ATOM 1190 CD GLU A 76 120.975 9.616 -4.098 1.00 0.00 C ATOM 1191 OE1 GLU A 76 120.062 10.008 -4.806 1.00 0.00 O ATOM 1192 OE2 GLU A 76 122.131 9.993 -4.202 1.00 0.00 O ATOM 0 H GLU A 76 116.739 9.011 -3.292 1.00 0.00 H new ATOM 0 HA GLU A 76 118.935 8.025 -4.799 1.00 0.00 H new ATOM 0 HB2 GLU A 76 118.776 9.615 -2.686 1.00 0.00 H new ATOM 0 HB3 GLU A 76 118.938 8.126 -1.776 1.00 0.00 H new ATOM 0 HG2 GLU A 76 121.196 8.824 -2.098 1.00 0.00 H new ATOM 0 HG3 GLU A 76 120.971 7.596 -3.328 1.00 0.00 H new ATOM 1199 N PHE A 77 117.602 5.885 -2.650 1.00 0.00 N ATOM 1200 CA PHE A 77 117.608 4.433 -2.338 1.00 0.00 C ATOM 1201 C PHE A 77 117.087 3.662 -3.545 1.00 0.00 C ATOM 1202 O PHE A 77 117.791 2.848 -4.105 1.00 0.00 O ATOM 1203 CB PHE A 77 116.728 4.144 -1.118 1.00 0.00 C ATOM 1204 CG PHE A 77 115.400 3.563 -1.553 1.00 0.00 C ATOM 1205 CD1 PHE A 77 115.303 2.212 -1.913 1.00 0.00 C ATOM 1206 CD2 PHE A 77 114.266 4.378 -1.594 1.00 0.00 C ATOM 1207 CE1 PHE A 77 114.069 1.680 -2.311 1.00 0.00 C ATOM 1208 CE2 PHE A 77 113.036 3.848 -1.994 1.00 0.00 C ATOM 1209 CZ PHE A 77 112.935 2.500 -2.352 1.00 0.00 C ATOM 0 H PHE A 77 116.926 6.448 -2.134 1.00 0.00 H new ATOM 0 HA PHE A 77 118.627 4.120 -2.110 1.00 0.00 H new ATOM 0 HB2 PHE A 77 117.236 3.447 -0.451 1.00 0.00 H new ATOM 0 HB3 PHE A 77 116.564 5.062 -0.554 1.00 0.00 H new ATOM 0 HD1 PHE A 77 116.179 1.581 -1.884 1.00 0.00 H new ATOM 0 HD2 PHE A 77 114.340 5.419 -1.316 1.00 0.00 H new ATOM 0 HE1 PHE A 77 113.993 0.638 -2.586 1.00 0.00 H new ATOM 0 HE2 PHE A 77 112.162 4.481 -2.027 1.00 0.00 H new ATOM 0 HZ PHE A 77 111.984 2.092 -2.660 1.00 0.00 H new ATOM 1219 N PHE A 78 115.871 3.901 -3.972 1.00 0.00 N ATOM 1220 CA PHE A 78 115.382 3.136 -5.151 1.00 0.00 C ATOM 1221 C PHE A 78 116.306 3.392 -6.341 1.00 0.00 C ATOM 1222 O PHE A 78 116.706 2.480 -7.031 1.00 0.00 O ATOM 1223 CB PHE A 78 113.957 3.553 -5.514 1.00 0.00 C ATOM 1224 CG PHE A 78 113.376 2.572 -6.523 1.00 0.00 C ATOM 1225 CD1 PHE A 78 113.731 1.210 -6.487 1.00 0.00 C ATOM 1226 CD2 PHE A 78 112.479 3.026 -7.497 1.00 0.00 C ATOM 1227 CE1 PHE A 78 113.189 0.317 -7.421 1.00 0.00 C ATOM 1228 CE2 PHE A 78 111.937 2.129 -8.429 1.00 0.00 C ATOM 1229 CZ PHE A 78 112.293 0.776 -8.391 1.00 0.00 C ATOM 0 H PHE A 78 115.217 4.571 -3.568 1.00 0.00 H new ATOM 0 HA PHE A 78 115.381 2.075 -4.902 1.00 0.00 H new ATOM 0 HB2 PHE A 78 113.336 3.579 -4.618 1.00 0.00 H new ATOM 0 HB3 PHE A 78 113.958 4.560 -5.931 1.00 0.00 H new ATOM 0 HD1 PHE A 78 114.422 0.853 -5.738 1.00 0.00 H new ATOM 0 HD2 PHE A 78 112.204 4.070 -7.531 1.00 0.00 H new ATOM 0 HE1 PHE A 78 113.464 -0.727 -7.391 1.00 0.00 H new ATOM 0 HE2 PHE A 78 111.244 2.483 -9.177 1.00 0.00 H new ATOM 0 HZ PHE A 78 111.876 0.087 -9.111 1.00 0.00 H new ATOM 1239 N ASN A 79 116.652 4.626 -6.581 1.00 0.00 N ATOM 1240 CA ASN A 79 117.552 4.943 -7.729 1.00 0.00 C ATOM 1241 C ASN A 79 118.782 4.045 -7.667 1.00 0.00 C ATOM 1242 O ASN A 79 119.097 3.342 -8.606 1.00 0.00 O ATOM 1243 CB ASN A 79 118.003 6.404 -7.642 1.00 0.00 C ATOM 1244 CG ASN A 79 118.995 6.703 -8.768 1.00 0.00 C ATOM 1245 OD1 ASN A 79 119.428 7.827 -8.928 1.00 0.00 O ATOM 1246 ND2 ASN A 79 119.377 5.739 -9.560 1.00 0.00 N ATOM 0 H ASN A 79 116.351 5.431 -6.032 1.00 0.00 H new ATOM 0 HA ASN A 79 117.015 4.779 -8.663 1.00 0.00 H new ATOM 0 HB2 ASN A 79 117.141 7.066 -7.718 1.00 0.00 H new ATOM 0 HB3 ASN A 79 118.467 6.595 -6.674 1.00 0.00 H new ATOM 0 HD21 ASN A 79 120.039 5.929 -10.313 1.00 0.00 H new ATOM 0 HD22 ASN A 79 119.014 4.795 -9.426 1.00 0.00 H new ATOM 1253 N LYS A 80 119.478 4.054 -6.568 1.00 0.00 N ATOM 1254 CA LYS A 80 120.679 3.191 -6.457 1.00 0.00 C ATOM 1255 C LYS A 80 120.252 1.736 -6.634 1.00 0.00 C ATOM 1256 O LYS A 80 120.984 0.922 -7.160 1.00 0.00 O ATOM 1257 CB LYS A 80 121.323 3.379 -5.083 1.00 0.00 C ATOM 1258 CG LYS A 80 122.266 4.585 -5.122 1.00 0.00 C ATOM 1259 CD LYS A 80 123.631 4.156 -5.668 1.00 0.00 C ATOM 1260 CE LYS A 80 124.263 3.133 -4.722 1.00 0.00 C ATOM 1261 NZ LYS A 80 125.724 3.402 -4.604 1.00 0.00 N ATOM 0 H LYS A 80 119.267 4.620 -5.746 1.00 0.00 H new ATOM 0 HA LYS A 80 121.404 3.460 -7.225 1.00 0.00 H new ATOM 0 HB2 LYS A 80 120.553 3.530 -4.326 1.00 0.00 H new ATOM 0 HB3 LYS A 80 121.874 2.482 -4.802 1.00 0.00 H new ATOM 0 HG2 LYS A 80 121.843 5.369 -5.749 1.00 0.00 H new ATOM 0 HG3 LYS A 80 122.379 5.003 -4.122 1.00 0.00 H new ATOM 0 HD2 LYS A 80 123.517 3.725 -6.663 1.00 0.00 H new ATOM 0 HD3 LYS A 80 124.283 5.024 -5.769 1.00 0.00 H new ATOM 0 HE2 LYS A 80 123.792 3.189 -3.741 1.00 0.00 H new ATOM 0 HE3 LYS A 80 124.097 2.123 -5.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 126.154 2.707 -3.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 126.168 3.327 -5.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 125.871 4.360 -4.227 1.00 0.00 H new ATOM 1275 N LEU A 81 119.069 1.401 -6.197 1.00 0.00 N ATOM 1276 CA LEU A 81 118.598 -0.005 -6.340 1.00 0.00 C ATOM 1277 C LEU A 81 118.384 -0.344 -7.825 1.00 0.00 C ATOM 1278 O LEU A 81 118.919 -1.308 -8.324 1.00 0.00 O ATOM 1279 CB LEU A 81 117.280 -0.187 -5.565 1.00 0.00 C ATOM 1280 CG LEU A 81 117.485 0.029 -4.053 1.00 0.00 C ATOM 1281 CD1 LEU A 81 116.665 -1.004 -3.281 1.00 0.00 C ATOM 1282 CD2 LEU A 81 118.963 -0.117 -3.661 1.00 0.00 C ATOM 0 H LEU A 81 118.410 2.038 -5.749 1.00 0.00 H new ATOM 0 HA LEU A 81 119.353 -0.678 -5.933 1.00 0.00 H new ATOM 0 HB2 LEU A 81 116.536 0.517 -5.938 1.00 0.00 H new ATOM 0 HB3 LEU A 81 116.887 -1.188 -5.742 1.00 0.00 H new ATOM 0 HG LEU A 81 117.160 1.040 -3.808 1.00 0.00 H new ATOM 0 HD11 LEU A 81 116.807 -0.855 -2.211 1.00 0.00 H new ATOM 0 HD12 LEU A 81 115.609 -0.888 -3.527 1.00 0.00 H new ATOM 0 HD13 LEU A 81 116.993 -2.007 -3.554 1.00 0.00 H new ATOM 0 HD21 LEU A 81 119.072 0.041 -2.588 1.00 0.00 H new ATOM 0 HD22 LEU A 81 119.310 -1.118 -3.917 1.00 0.00 H new ATOM 0 HD23 LEU A 81 119.557 0.622 -4.199 1.00 0.00 H new ATOM 1294 N VAL A 82 117.608 0.421 -8.542 1.00 0.00 N ATOM 1295 CA VAL A 82 117.380 0.090 -9.981 1.00 0.00 C ATOM 1296 C VAL A 82 118.692 0.148 -10.775 1.00 0.00 C ATOM 1297 O VAL A 82 118.979 -0.720 -11.568 1.00 0.00 O ATOM 1298 CB VAL A 82 116.383 1.080 -10.579 1.00 0.00 C ATOM 1299 CG1 VAL A 82 114.973 0.757 -10.073 1.00 0.00 C ATOM 1300 CG2 VAL A 82 116.768 2.499 -10.159 1.00 0.00 C ATOM 0 H VAL A 82 117.126 1.252 -8.201 1.00 0.00 H new ATOM 0 HA VAL A 82 116.984 -0.924 -10.041 1.00 0.00 H new ATOM 0 HB VAL A 82 116.400 1.005 -11.666 1.00 0.00 H new ATOM 0 HG11 VAL A 82 114.262 1.464 -10.500 1.00 0.00 H new ATOM 0 HG12 VAL A 82 114.702 -0.255 -10.372 1.00 0.00 H new ATOM 0 HG13 VAL A 82 114.950 0.832 -8.986 1.00 0.00 H new ATOM 0 HG21 VAL A 82 116.059 3.209 -10.584 1.00 0.00 H new ATOM 0 HG22 VAL A 82 116.750 2.574 -9.072 1.00 0.00 H new ATOM 0 HG23 VAL A 82 117.770 2.726 -10.522 1.00 0.00 H new ATOM 1310 N THR A 83 119.480 1.169 -10.600 1.00 0.00 N ATOM 1311 CA THR A 83 120.746 1.261 -11.384 1.00 0.00 C ATOM 1312 C THR A 83 121.842 0.367 -10.781 1.00 0.00 C ATOM 1313 O THR A 83 122.543 -0.327 -11.491 1.00 0.00 O ATOM 1314 CB THR A 83 121.222 2.715 -11.406 1.00 0.00 C ATOM 1315 OG1 THR A 83 122.027 2.930 -12.556 1.00 0.00 O ATOM 1316 CG2 THR A 83 122.038 3.004 -10.150 1.00 0.00 C ATOM 0 H THR A 83 119.307 1.939 -9.954 1.00 0.00 H new ATOM 0 HA THR A 83 120.549 0.916 -12.399 1.00 0.00 H new ATOM 0 HB THR A 83 120.359 3.380 -11.437 1.00 0.00 H new ATOM 0 HG1 THR A 83 122.331 3.861 -12.573 1.00 0.00 H new ATOM 0 HG21 THR A 83 122.377 4.040 -10.167 1.00 0.00 H new ATOM 0 HG22 THR A 83 121.419 2.839 -9.268 1.00 0.00 H new ATOM 0 HG23 THR A 83 122.902 2.340 -10.117 1.00 0.00 H new ATOM 1324 N SER A 84 122.021 0.400 -9.488 1.00 0.00 N ATOM 1325 CA SER A 84 123.100 -0.423 -8.858 1.00 0.00 C ATOM 1326 C SER A 84 122.701 -1.901 -8.753 1.00 0.00 C ATOM 1327 O SER A 84 123.548 -2.764 -8.630 1.00 0.00 O ATOM 1328 CB SER A 84 123.388 0.110 -7.454 1.00 0.00 C ATOM 1329 OG SER A 84 123.154 1.512 -7.426 1.00 0.00 O ATOM 0 H SER A 84 121.468 0.960 -8.839 1.00 0.00 H new ATOM 0 HA SER A 84 123.985 -0.351 -9.490 1.00 0.00 H new ATOM 0 HB2 SER A 84 122.751 -0.391 -6.725 1.00 0.00 H new ATOM 0 HB3 SER A 84 124.420 -0.104 -7.176 1.00 0.00 H new ATOM 0 HG SER A 84 123.846 1.970 -7.947 1.00 0.00 H new ATOM 1335 N PHE A 85 121.435 -2.209 -8.762 1.00 0.00 N ATOM 1336 CA PHE A 85 121.030 -3.639 -8.618 1.00 0.00 C ATOM 1337 C PHE A 85 121.364 -4.452 -9.873 1.00 0.00 C ATOM 1338 O PHE A 85 121.005 -5.604 -9.975 1.00 0.00 O ATOM 1339 CB PHE A 85 119.533 -3.744 -8.302 1.00 0.00 C ATOM 1340 CG PHE A 85 118.698 -3.634 -9.561 1.00 0.00 C ATOM 1341 CD1 PHE A 85 119.212 -3.049 -10.727 1.00 0.00 C ATOM 1342 CD2 PHE A 85 117.403 -4.157 -9.561 1.00 0.00 C ATOM 1343 CE1 PHE A 85 118.429 -2.995 -11.887 1.00 0.00 C ATOM 1344 CE2 PHE A 85 116.621 -4.096 -10.717 1.00 0.00 C ATOM 1345 CZ PHE A 85 117.134 -3.518 -11.881 1.00 0.00 C ATOM 0 H PHE A 85 120.669 -1.543 -8.861 1.00 0.00 H new ATOM 0 HA PHE A 85 121.599 -4.058 -7.788 1.00 0.00 H new ATOM 0 HB2 PHE A 85 119.329 -4.694 -7.809 1.00 0.00 H new ATOM 0 HB3 PHE A 85 119.250 -2.956 -7.605 1.00 0.00 H new ATOM 0 HD1 PHE A 85 120.212 -2.640 -10.731 1.00 0.00 H new ATOM 0 HD2 PHE A 85 117.005 -4.610 -8.665 1.00 0.00 H new ATOM 0 HE1 PHE A 85 118.827 -2.549 -12.786 1.00 0.00 H new ATOM 0 HE2 PHE A 85 115.618 -4.496 -10.711 1.00 0.00 H new ATOM 0 HZ PHE A 85 116.530 -3.476 -12.775 1.00 0.00 H new ATOM 1355 N ASP A 86 122.040 -3.889 -10.836 1.00 0.00 N ATOM 1356 CA ASP A 86 122.362 -4.698 -12.045 1.00 0.00 C ATOM 1357 C ASP A 86 123.701 -5.409 -11.837 1.00 0.00 C ATOM 1358 O ASP A 86 124.244 -6.014 -12.740 1.00 0.00 O ATOM 1359 CB ASP A 86 122.426 -3.817 -13.287 1.00 0.00 C ATOM 1360 CG ASP A 86 123.069 -2.474 -12.938 1.00 0.00 C ATOM 1361 OD1 ASP A 86 123.938 -2.461 -12.082 1.00 0.00 O ATOM 1362 OD2 ASP A 86 122.682 -1.482 -13.533 1.00 0.00 O ATOM 0 H ASP A 86 122.377 -2.926 -10.841 1.00 0.00 H new ATOM 0 HA ASP A 86 121.574 -5.436 -12.194 1.00 0.00 H new ATOM 0 HB2 ASP A 86 123.002 -4.314 -14.067 1.00 0.00 H new ATOM 0 HB3 ASP A 86 121.423 -3.658 -13.683 1.00 0.00 H new ATOM 1367 N PHE A 87 124.217 -5.362 -10.641 1.00 0.00 N ATOM 1368 CA PHE A 87 125.501 -6.057 -10.342 1.00 0.00 C ATOM 1369 C PHE A 87 125.324 -6.817 -9.027 1.00 0.00 C ATOM 1370 O PHE A 87 125.132 -8.016 -9.010 1.00 0.00 O ATOM 1371 CB PHE A 87 126.647 -5.033 -10.215 1.00 0.00 C ATOM 1372 CG PHE A 87 127.486 -5.333 -8.986 1.00 0.00 C ATOM 1373 CD1 PHE A 87 127.863 -6.651 -8.691 1.00 0.00 C ATOM 1374 CD2 PHE A 87 127.870 -4.293 -8.125 1.00 0.00 C ATOM 1375 CE1 PHE A 87 128.611 -6.922 -7.546 1.00 0.00 C ATOM 1376 CE2 PHE A 87 128.627 -4.572 -6.982 1.00 0.00 C ATOM 1377 CZ PHE A 87 128.995 -5.889 -6.694 1.00 0.00 C ATOM 0 H PHE A 87 123.801 -4.868 -9.851 1.00 0.00 H new ATOM 0 HA PHE A 87 125.755 -6.745 -11.148 1.00 0.00 H new ATOM 0 HB2 PHE A 87 127.272 -5.064 -11.107 1.00 0.00 H new ATOM 0 HB3 PHE A 87 126.238 -4.025 -10.147 1.00 0.00 H new ATOM 0 HD1 PHE A 87 127.574 -7.456 -9.351 1.00 0.00 H new ATOM 0 HD2 PHE A 87 127.581 -3.276 -8.345 1.00 0.00 H new ATOM 0 HE1 PHE A 87 128.894 -7.939 -7.318 1.00 0.00 H new ATOM 0 HE2 PHE A 87 128.927 -3.771 -6.323 1.00 0.00 H new ATOM 0 HZ PHE A 87 129.577 -6.106 -5.811 1.00 0.00 H new ATOM 1387 N ASP A 88 125.384 -6.123 -7.925 1.00 0.00 N ATOM 1388 CA ASP A 88 125.214 -6.794 -6.610 1.00 0.00 C ATOM 1389 C ASP A 88 123.737 -6.772 -6.227 1.00 0.00 C ATOM 1390 O ASP A 88 123.282 -5.901 -5.513 1.00 0.00 O ATOM 1391 CB ASP A 88 126.017 -6.048 -5.550 1.00 0.00 C ATOM 1392 CG ASP A 88 126.067 -4.560 -5.901 1.00 0.00 C ATOM 1393 OD1 ASP A 88 125.280 -4.142 -6.735 1.00 0.00 O ATOM 1394 OD2 ASP A 88 126.887 -3.864 -5.331 1.00 0.00 O ATOM 0 H ASP A 88 125.544 -5.117 -7.880 1.00 0.00 H new ATOM 0 HA ASP A 88 125.566 -7.823 -6.676 1.00 0.00 H new ATOM 0 HB2 ASP A 88 125.561 -6.186 -4.569 1.00 0.00 H new ATOM 0 HB3 ASP A 88 127.027 -6.453 -5.492 1.00 0.00 H new ATOM 1399 N LEU A 89 122.984 -7.718 -6.700 1.00 0.00 N ATOM 1400 CA LEU A 89 121.538 -7.750 -6.370 1.00 0.00 C ATOM 1401 C LEU A 89 121.370 -7.842 -4.855 1.00 0.00 C ATOM 1402 O LEU A 89 120.687 -7.046 -4.244 1.00 0.00 O ATOM 1403 CB LEU A 89 120.893 -8.967 -7.039 1.00 0.00 C ATOM 1404 CG LEU A 89 121.307 -9.061 -8.524 1.00 0.00 C ATOM 1405 CD1 LEU A 89 121.906 -7.742 -9.021 1.00 0.00 C ATOM 1406 CD2 LEU A 89 122.348 -10.162 -8.715 1.00 0.00 C ATOM 0 H LEU A 89 123.309 -8.474 -7.303 1.00 0.00 H new ATOM 0 HA LEU A 89 121.055 -6.842 -6.732 1.00 0.00 H new ATOM 0 HB2 LEU A 89 121.191 -9.876 -6.516 1.00 0.00 H new ATOM 0 HB3 LEU A 89 119.808 -8.897 -6.963 1.00 0.00 H new ATOM 0 HG LEU A 89 120.407 -9.286 -9.096 1.00 0.00 H new ATOM 0 HD11 LEU A 89 122.187 -7.842 -10.069 1.00 0.00 H new ATOM 0 HD12 LEU A 89 121.169 -6.946 -8.917 1.00 0.00 H new ATOM 0 HD13 LEU A 89 122.789 -7.498 -8.431 1.00 0.00 H new ATOM 0 HD21 LEU A 89 122.631 -10.217 -9.766 1.00 0.00 H new ATOM 0 HD22 LEU A 89 123.229 -9.938 -8.114 1.00 0.00 H new ATOM 0 HD23 LEU A 89 121.928 -11.118 -8.402 1.00 0.00 H new ATOM 1418 N GLU A 90 121.983 -8.814 -4.246 1.00 0.00 N ATOM 1419 CA GLU A 90 121.854 -8.967 -2.768 1.00 0.00 C ATOM 1420 C GLU A 90 122.760 -7.965 -2.036 1.00 0.00 C ATOM 1421 O GLU A 90 122.343 -7.294 -1.109 1.00 0.00 O ATOM 1422 CB GLU A 90 122.266 -10.391 -2.373 1.00 0.00 C ATOM 1423 CG GLU A 90 122.409 -11.250 -3.628 1.00 0.00 C ATOM 1424 CD GLU A 90 123.749 -10.952 -4.303 1.00 0.00 C ATOM 1425 OE1 GLU A 90 124.087 -9.786 -4.416 1.00 0.00 O ATOM 1426 OE2 GLU A 90 124.414 -11.896 -4.697 1.00 0.00 O ATOM 0 H GLU A 90 122.569 -9.511 -4.705 1.00 0.00 H new ATOM 0 HA GLU A 90 120.818 -8.777 -2.486 1.00 0.00 H new ATOM 0 HB2 GLU A 90 123.208 -10.369 -1.826 1.00 0.00 H new ATOM 0 HB3 GLU A 90 121.520 -10.824 -1.706 1.00 0.00 H new ATOM 0 HG2 GLU A 90 122.349 -12.307 -3.367 1.00 0.00 H new ATOM 0 HG3 GLU A 90 121.590 -11.045 -4.317 1.00 0.00 H new ATOM 1433 N ILE A 91 124.002 -7.883 -2.423 1.00 0.00 N ATOM 1434 CA ILE A 91 124.949 -6.960 -1.729 1.00 0.00 C ATOM 1435 C ILE A 91 124.680 -5.497 -2.105 1.00 0.00 C ATOM 1436 O ILE A 91 124.960 -4.594 -1.343 1.00 0.00 O ATOM 1437 CB ILE A 91 126.380 -7.328 -2.133 1.00 0.00 C ATOM 1438 CG1 ILE A 91 126.413 -8.780 -2.611 1.00 0.00 C ATOM 1439 CG2 ILE A 91 127.319 -7.167 -0.937 1.00 0.00 C ATOM 1440 CD1 ILE A 91 127.859 -9.266 -2.667 1.00 0.00 C ATOM 0 H ILE A 91 124.406 -8.417 -3.193 1.00 0.00 H new ATOM 0 HA ILE A 91 124.811 -7.065 -0.653 1.00 0.00 H new ATOM 0 HB ILE A 91 126.707 -6.667 -2.936 1.00 0.00 H new ATOM 0 HG12 ILE A 91 125.833 -9.409 -1.936 1.00 0.00 H new ATOM 0 HG13 ILE A 91 125.953 -8.860 -3.596 1.00 0.00 H new ATOM 0 HG21 ILE A 91 128.334 -7.431 -1.233 1.00 0.00 H new ATOM 0 HG22 ILE A 91 127.298 -6.132 -0.595 1.00 0.00 H new ATOM 0 HG23 ILE A 91 126.995 -7.823 -0.129 1.00 0.00 H new ATOM 0 HD11 ILE A 91 127.882 -10.301 -3.008 1.00 0.00 H new ATOM 0 HD12 ILE A 91 128.426 -8.643 -3.359 1.00 0.00 H new ATOM 0 HD13 ILE A 91 128.303 -9.201 -1.674 1.00 0.00 H new ATOM 1452 N GLY A 92 124.171 -5.251 -3.278 1.00 0.00 N ATOM 1453 CA GLY A 92 123.923 -3.840 -3.702 1.00 0.00 C ATOM 1454 C GLY A 92 122.933 -3.150 -2.759 1.00 0.00 C ATOM 1455 O GLY A 92 123.192 -2.078 -2.250 1.00 0.00 O ATOM 0 H GLY A 92 123.915 -5.962 -3.963 1.00 0.00 H new ATOM 0 HA2 GLY A 92 124.864 -3.289 -3.714 1.00 0.00 H new ATOM 0 HA3 GLY A 92 123.532 -3.825 -4.719 1.00 0.00 H new ATOM 1459 N LYS A 93 121.794 -3.741 -2.539 1.00 0.00 N ATOM 1460 CA LYS A 93 120.780 -3.101 -1.650 1.00 0.00 C ATOM 1461 C LYS A 93 121.167 -3.269 -0.176 1.00 0.00 C ATOM 1462 O LYS A 93 120.657 -2.577 0.687 1.00 0.00 O ATOM 1463 CB LYS A 93 119.399 -3.734 -1.885 1.00 0.00 C ATOM 1464 CG LYS A 93 119.525 -5.047 -2.673 1.00 0.00 C ATOM 1465 CD LYS A 93 119.249 -4.794 -4.161 1.00 0.00 C ATOM 1466 CE LYS A 93 120.512 -4.261 -4.840 1.00 0.00 C ATOM 1467 NZ LYS A 93 120.740 -2.847 -4.428 1.00 0.00 N ATOM 0 H LYS A 93 121.519 -4.640 -2.935 1.00 0.00 H new ATOM 0 HA LYS A 93 120.743 -2.038 -1.888 1.00 0.00 H new ATOM 0 HB2 LYS A 93 118.914 -3.925 -0.928 1.00 0.00 H new ATOM 0 HB3 LYS A 93 118.763 -3.037 -2.431 1.00 0.00 H new ATOM 0 HG2 LYS A 93 120.524 -5.463 -2.546 1.00 0.00 H new ATOM 0 HG3 LYS A 93 118.821 -5.783 -2.284 1.00 0.00 H new ATOM 0 HD2 LYS A 93 118.928 -5.718 -4.643 1.00 0.00 H new ATOM 0 HD3 LYS A 93 118.435 -4.077 -4.272 1.00 0.00 H new ATOM 0 HE2 LYS A 93 121.371 -4.874 -4.566 1.00 0.00 H new ATOM 0 HE3 LYS A 93 120.409 -4.323 -5.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 121.740 -2.717 -4.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 120.498 -2.213 -5.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 120.142 -2.624 -3.607 1.00 0.00 H new ATOM 1481 N GLY A 94 122.043 -4.185 0.129 1.00 0.00 N ATOM 1482 CA GLY A 94 122.425 -4.399 1.557 1.00 0.00 C ATOM 1483 C GLY A 94 123.229 -3.207 2.109 1.00 0.00 C ATOM 1484 O GLY A 94 122.900 -2.667 3.146 1.00 0.00 O ATOM 0 H GLY A 94 122.510 -4.793 -0.543 1.00 0.00 H new ATOM 0 HA2 GLY A 94 121.527 -4.543 2.158 1.00 0.00 H new ATOM 0 HA3 GLY A 94 123.017 -5.310 1.644 1.00 0.00 H new ATOM 1488 N GLU A 95 124.286 -2.800 1.450 1.00 0.00 N ATOM 1489 CA GLU A 95 125.097 -1.655 1.980 1.00 0.00 C ATOM 1490 C GLU A 95 124.436 -0.324 1.614 1.00 0.00 C ATOM 1491 O GLU A 95 124.381 0.600 2.409 1.00 0.00 O ATOM 1492 CB GLU A 95 126.510 -1.702 1.382 1.00 0.00 C ATOM 1493 CG GLU A 95 127.104 -0.286 1.323 1.00 0.00 C ATOM 1494 CD GLU A 95 126.597 0.428 0.069 1.00 0.00 C ATOM 1495 OE1 GLU A 95 126.461 -0.230 -0.949 1.00 0.00 O ATOM 1496 OE2 GLU A 95 126.353 1.621 0.148 1.00 0.00 O ATOM 0 H GLU A 95 124.622 -3.205 0.576 1.00 0.00 H new ATOM 0 HA GLU A 95 125.155 -1.739 3.065 1.00 0.00 H new ATOM 0 HB2 GLU A 95 127.148 -2.348 1.986 1.00 0.00 H new ATOM 0 HB3 GLU A 95 126.476 -2.133 0.381 1.00 0.00 H new ATOM 0 HG2 GLU A 95 126.822 0.276 2.213 1.00 0.00 H new ATOM 0 HG3 GLU A 95 128.193 -0.337 1.310 1.00 0.00 H new ATOM 1503 N THR A 96 123.946 -0.205 0.416 1.00 0.00 N ATOM 1504 CA THR A 96 123.310 1.074 0.011 1.00 0.00 C ATOM 1505 C THR A 96 122.305 1.505 1.081 1.00 0.00 C ATOM 1506 O THR A 96 122.289 2.642 1.510 1.00 0.00 O ATOM 1507 CB THR A 96 122.603 0.893 -1.330 1.00 0.00 C ATOM 1508 OG1 THR A 96 121.909 -0.345 -1.332 1.00 0.00 O ATOM 1509 CG2 THR A 96 123.641 0.904 -2.454 1.00 0.00 C ATOM 0 H THR A 96 123.958 -0.934 -0.297 1.00 0.00 H new ATOM 0 HA THR A 96 124.074 1.845 -0.093 1.00 0.00 H new ATOM 0 HB THR A 96 121.893 1.705 -1.485 1.00 0.00 H new ATOM 0 HG1 THR A 96 122.375 -0.980 -1.914 1.00 0.00 H new ATOM 0 HG21 THR A 96 123.140 0.775 -3.413 1.00 0.00 H new ATOM 0 HG22 THR A 96 124.174 1.855 -2.448 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.350 0.090 -2.303 1.00 0.00 H new ATOM 1517 N MET A 97 121.473 0.603 1.522 1.00 0.00 N ATOM 1518 CA MET A 97 120.470 0.955 2.568 1.00 0.00 C ATOM 1519 C MET A 97 121.174 1.585 3.772 1.00 0.00 C ATOM 1520 O MET A 97 120.577 2.307 4.551 1.00 0.00 O ATOM 1521 CB MET A 97 119.761 -0.321 3.022 1.00 0.00 C ATOM 1522 CG MET A 97 120.727 -1.177 3.846 1.00 0.00 C ATOM 1523 SD MET A 97 120.361 -0.979 5.607 1.00 0.00 S ATOM 1524 CE MET A 97 120.000 -2.716 5.960 1.00 0.00 C ATOM 0 H MET A 97 121.444 -0.365 1.203 1.00 0.00 H new ATOM 0 HA MET A 97 119.751 1.664 2.157 1.00 0.00 H new ATOM 0 HB2 MET A 97 118.883 -0.070 3.617 1.00 0.00 H new ATOM 0 HB3 MET A 97 119.409 -0.882 2.156 1.00 0.00 H new ATOM 0 HG2 MET A 97 120.635 -2.225 3.560 1.00 0.00 H new ATOM 0 HG3 MET A 97 121.756 -0.881 3.642 1.00 0.00 H new ATOM 0 HE1 MET A 97 119.744 -2.828 7.014 1.00 0.00 H new ATOM 0 HE2 MET A 97 119.162 -3.046 5.346 1.00 0.00 H new ATOM 0 HE3 MET A 97 120.877 -3.323 5.734 1.00 0.00 H new ATOM 1534 N LYS A 98 122.434 1.305 3.937 1.00 0.00 N ATOM 1535 CA LYS A 98 123.175 1.862 5.100 1.00 0.00 C ATOM 1536 C LYS A 98 123.508 3.334 4.878 1.00 0.00 C ATOM 1537 O LYS A 98 123.393 4.139 5.779 1.00 0.00 O ATOM 1538 CB LYS A 98 124.479 1.087 5.288 1.00 0.00 C ATOM 1539 CG LYS A 98 124.166 -0.388 5.548 1.00 0.00 C ATOM 1540 CD LYS A 98 125.434 -1.103 6.020 1.00 0.00 C ATOM 1541 CE LYS A 98 125.055 -2.422 6.696 1.00 0.00 C ATOM 1542 NZ LYS A 98 126.258 -3.006 7.355 1.00 0.00 N ATOM 0 H LYS A 98 122.985 0.713 3.315 1.00 0.00 H new ATOM 0 HA LYS A 98 122.545 1.770 5.985 1.00 0.00 H new ATOM 0 HB2 LYS A 98 125.104 1.186 4.400 1.00 0.00 H new ATOM 0 HB3 LYS A 98 125.044 1.502 6.123 1.00 0.00 H new ATOM 0 HG2 LYS A 98 123.383 -0.477 6.301 1.00 0.00 H new ATOM 0 HG3 LYS A 98 123.788 -0.856 4.639 1.00 0.00 H new ATOM 0 HD2 LYS A 98 126.094 -1.293 5.173 1.00 0.00 H new ATOM 0 HD3 LYS A 98 125.983 -0.470 6.717 1.00 0.00 H new ATOM 0 HE2 LYS A 98 124.270 -2.253 7.433 1.00 0.00 H new ATOM 0 HE3 LYS A 98 124.656 -3.119 5.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 126.001 -3.903 7.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 126.994 -3.181 6.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 126.619 -2.342 8.069 1.00 0.00 H new ATOM 1556 N TYR A 99 123.949 3.704 3.707 1.00 0.00 N ATOM 1557 CA TYR A 99 124.307 5.135 3.501 1.00 0.00 C ATOM 1558 C TYR A 99 123.059 6.021 3.560 1.00 0.00 C ATOM 1559 O TYR A 99 123.139 7.165 3.964 1.00 0.00 O ATOM 1560 CB TYR A 99 125.056 5.320 2.175 1.00 0.00 C ATOM 1561 CG TYR A 99 124.094 5.429 1.024 1.00 0.00 C ATOM 1562 CD1 TYR A 99 123.324 6.582 0.851 1.00 0.00 C ATOM 1563 CD2 TYR A 99 123.990 4.375 0.117 1.00 0.00 C ATOM 1564 CE1 TYR A 99 122.446 6.678 -0.235 1.00 0.00 C ATOM 1565 CE2 TYR A 99 123.112 4.464 -0.967 1.00 0.00 C ATOM 1566 CZ TYR A 99 122.338 5.618 -1.144 1.00 0.00 C ATOM 1567 OH TYR A 99 121.472 5.712 -2.214 1.00 0.00 O ATOM 0 H TYR A 99 124.075 3.093 2.900 1.00 0.00 H new ATOM 0 HA TYR A 99 124.972 5.442 4.308 1.00 0.00 H new ATOM 0 HB2 TYR A 99 125.673 6.217 2.224 1.00 0.00 H new ATOM 0 HB3 TYR A 99 125.729 4.478 2.013 1.00 0.00 H new ATOM 0 HD1 TYR A 99 123.406 7.398 1.554 1.00 0.00 H new ATOM 0 HD2 TYR A 99 124.590 3.487 0.252 1.00 0.00 H new ATOM 0 HE1 TYR A 99 121.852 7.569 -0.372 1.00 0.00 H new ATOM 0 HE2 TYR A 99 123.031 3.645 -1.666 1.00 0.00 H new ATOM 0 HH TYR A 99 121.137 4.820 -2.443 1.00 0.00 H new ATOM 1577 N ILE A 100 121.900 5.525 3.197 1.00 0.00 N ATOM 1578 CA ILE A 100 120.691 6.399 3.290 1.00 0.00 C ATOM 1579 C ILE A 100 120.360 6.610 4.768 1.00 0.00 C ATOM 1580 O ILE A 100 120.275 7.726 5.242 1.00 0.00 O ATOM 1581 CB ILE A 100 119.489 5.754 2.596 1.00 0.00 C ATOM 1582 CG1 ILE A 100 119.757 5.636 1.096 1.00 0.00 C ATOM 1583 CG2 ILE A 100 118.254 6.630 2.819 1.00 0.00 C ATOM 1584 CD1 ILE A 100 120.671 4.441 0.836 1.00 0.00 C ATOM 0 H ILE A 100 121.741 4.579 2.850 1.00 0.00 H new ATOM 0 HA ILE A 100 120.902 7.348 2.797 1.00 0.00 H new ATOM 0 HB ILE A 100 119.322 4.760 3.011 1.00 0.00 H new ATOM 0 HG12 ILE A 100 118.818 5.514 0.556 1.00 0.00 H new ATOM 0 HG13 ILE A 100 120.221 6.550 0.725 1.00 0.00 H new ATOM 0 HG21 ILE A 100 117.393 6.177 2.327 1.00 0.00 H new ATOM 0 HG22 ILE A 100 118.058 6.717 3.888 1.00 0.00 H new ATOM 0 HG23 ILE A 100 118.431 7.621 2.401 1.00 0.00 H new ATOM 0 HD11 ILE A 100 120.863 4.356 -0.234 1.00 0.00 H new ATOM 0 HD12 ILE A 100 121.614 4.583 1.364 1.00 0.00 H new ATOM 0 HD13 ILE A 100 120.189 3.530 1.192 1.00 0.00 H new ATOM 1596 N LEU A 101 120.188 5.544 5.506 1.00 0.00 N ATOM 1597 CA LEU A 101 119.882 5.690 6.958 1.00 0.00 C ATOM 1598 C LEU A 101 121.108 6.256 7.665 1.00 0.00 C ATOM 1599 O LEU A 101 121.046 7.277 8.319 1.00 0.00 O ATOM 1600 CB LEU A 101 119.547 4.318 7.546 1.00 0.00 C ATOM 1601 CG LEU A 101 118.187 4.376 8.238 1.00 0.00 C ATOM 1602 CD1 LEU A 101 117.708 2.956 8.551 1.00 0.00 C ATOM 1603 CD2 LEU A 101 118.314 5.179 9.535 1.00 0.00 C ATOM 0 H LEU A 101 120.246 4.584 5.167 1.00 0.00 H new ATOM 0 HA LEU A 101 119.033 6.360 7.093 1.00 0.00 H new ATOM 0 HB2 LEU A 101 119.533 3.566 6.757 1.00 0.00 H new ATOM 0 HB3 LEU A 101 120.316 4.018 8.258 1.00 0.00 H new ATOM 0 HG LEU A 101 117.463 4.859 7.582 1.00 0.00 H new ATOM 0 HD11 LEU A 101 116.737 3.000 9.045 1.00 0.00 H new ATOM 0 HD12 LEU A 101 117.618 2.390 7.624 1.00 0.00 H new ATOM 0 HD13 LEU A 101 118.427 2.466 9.207 1.00 0.00 H new ATOM 0 HD21 LEU A 101 117.345 5.223 10.032 1.00 0.00 H new ATOM 0 HD22 LEU A 101 119.038 4.697 10.192 1.00 0.00 H new ATOM 0 HD23 LEU A 101 118.650 6.190 9.305 1.00 0.00 H new ATOM 1615 N ALA A 102 122.227 5.603 7.532 1.00 0.00 N ATOM 1616 CA ALA A 102 123.455 6.111 8.190 1.00 0.00 C ATOM 1617 C ALA A 102 123.623 7.587 7.837 1.00 0.00 C ATOM 1618 O ALA A 102 123.216 8.460 8.577 1.00 0.00 O ATOM 1619 CB ALA A 102 124.669 5.323 7.694 1.00 0.00 C ATOM 0 H ALA A 102 122.342 4.742 6.997 1.00 0.00 H new ATOM 0 HA ALA A 102 123.373 5.993 9.271 1.00 0.00 H new ATOM 0 HB1 ALA A 102 125.570 5.699 8.179 1.00 0.00 H new ATOM 0 HB2 ALA A 102 124.541 4.268 7.934 1.00 0.00 H new ATOM 0 HB3 ALA A 102 124.763 5.440 6.614 1.00 0.00 H new ATOM 1625 N LEU A 103 124.208 7.871 6.705 1.00 0.00 N ATOM 1626 CA LEU A 103 124.400 9.289 6.294 1.00 0.00 C ATOM 1627 C LEU A 103 125.180 10.041 7.375 1.00 0.00 C ATOM 1628 O LEU A 103 125.842 11.020 7.095 1.00 0.00 O ATOM 1629 CB LEU A 103 123.036 9.952 6.086 1.00 0.00 C ATOM 1630 CG LEU A 103 123.224 11.452 5.853 1.00 0.00 C ATOM 1631 CD1 LEU A 103 124.179 11.671 4.679 1.00 0.00 C ATOM 1632 CD2 LEU A 103 121.870 12.090 5.534 1.00 0.00 C ATOM 0 H LEU A 103 124.562 7.178 6.045 1.00 0.00 H new ATOM 0 HA LEU A 103 124.963 9.320 5.361 1.00 0.00 H new ATOM 0 HB2 LEU A 103 122.528 9.502 5.233 1.00 0.00 H new ATOM 0 HB3 LEU A 103 122.403 9.786 6.958 1.00 0.00 H new ATOM 0 HG LEU A 103 123.641 11.910 6.750 1.00 0.00 H new ATOM 0 HD11 LEU A 103 124.313 12.740 4.513 1.00 0.00 H new ATOM 0 HD12 LEU A 103 125.143 11.215 4.904 1.00 0.00 H new ATOM 0 HD13 LEU A 103 123.763 11.214 3.781 1.00 0.00 H new ATOM 0 HD21 LEU A 103 122.002 13.159 5.368 1.00 0.00 H new ATOM 0 HD22 LEU A 103 121.454 11.632 4.637 1.00 0.00 H new ATOM 0 HD23 LEU A 103 121.188 11.934 6.370 1.00 0.00 H new ATOM 1644 N LYS A 104 125.115 9.592 8.605 1.00 0.00 N ATOM 1645 CA LYS A 104 125.869 10.285 9.692 1.00 0.00 C ATOM 1646 C LYS A 104 127.107 10.936 9.076 1.00 0.00 C ATOM 1647 O LYS A 104 127.452 12.062 9.376 1.00 0.00 O ATOM 1648 CB LYS A 104 126.298 9.255 10.741 1.00 0.00 C ATOM 1649 CG LYS A 104 126.386 9.897 12.126 1.00 0.00 C ATOM 1650 CD LYS A 104 125.515 9.115 13.113 1.00 0.00 C ATOM 1651 CE LYS A 104 124.063 9.109 12.628 1.00 0.00 C ATOM 1652 NZ LYS A 104 123.152 9.334 13.785 1.00 0.00 N ATOM 0 H LYS A 104 124.575 8.779 8.901 1.00 0.00 H new ATOM 0 HA LYS A 104 125.245 11.042 10.167 1.00 0.00 H new ATOM 0 HB2 LYS A 104 125.585 8.431 10.762 1.00 0.00 H new ATOM 0 HB3 LYS A 104 127.265 8.833 10.469 1.00 0.00 H new ATOM 0 HG2 LYS A 104 127.421 9.907 12.468 1.00 0.00 H new ATOM 0 HG3 LYS A 104 126.056 10.935 12.078 1.00 0.00 H new ATOM 0 HD2 LYS A 104 125.882 8.093 13.206 1.00 0.00 H new ATOM 0 HD3 LYS A 104 125.576 9.566 14.103 1.00 0.00 H new ATOM 0 HE2 LYS A 104 123.915 9.887 11.879 1.00 0.00 H new ATOM 0 HE3 LYS A 104 123.832 8.157 12.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 122.165 9.330 13.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 123.287 8.577 14.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 123.367 10.253 14.223 1.00 0.00 H new ATOM 1666 N ASP A 105 127.757 10.231 8.191 1.00 0.00 N ATOM 1667 CA ASP A 105 128.957 10.791 7.513 1.00 0.00 C ATOM 1668 C ASP A 105 128.696 10.787 6.003 1.00 0.00 C ATOM 1669 O ASP A 105 128.195 11.746 5.452 1.00 0.00 O ATOM 1670 CB ASP A 105 130.183 9.927 7.835 1.00 0.00 C ATOM 1671 CG ASP A 105 131.157 10.723 8.708 1.00 0.00 C ATOM 1672 OD1 ASP A 105 131.961 11.451 8.151 1.00 0.00 O ATOM 1673 OD2 ASP A 105 131.082 10.589 9.918 1.00 0.00 O ATOM 0 H ASP A 105 127.505 9.284 7.907 1.00 0.00 H new ATOM 0 HA ASP A 105 129.149 11.807 7.858 1.00 0.00 H new ATOM 0 HB2 ASP A 105 129.875 9.018 8.352 1.00 0.00 H new ATOM 0 HB3 ASP A 105 130.675 9.618 6.913 1.00 0.00 H new ATOM 1678 N GLN A 106 129.011 9.704 5.340 1.00 0.00 N ATOM 1679 CA GLN A 106 128.765 9.616 3.869 1.00 0.00 C ATOM 1680 C GLN A 106 129.705 8.572 3.255 1.00 0.00 C ATOM 1681 O GLN A 106 129.268 7.541 2.778 1.00 0.00 O ATOM 1682 CB GLN A 106 128.998 10.980 3.206 1.00 0.00 C ATOM 1683 CG GLN A 106 127.654 11.677 2.966 1.00 0.00 C ATOM 1684 CD GLN A 106 127.160 11.361 1.552 1.00 0.00 C ATOM 1685 OE1 GLN A 106 127.714 10.518 0.876 1.00 0.00 O ATOM 1686 NE2 GLN A 106 126.132 12.008 1.074 1.00 0.00 N ATOM 0 H GLN A 106 129.430 8.873 5.756 1.00 0.00 H new ATOM 0 HA GLN A 106 127.730 9.319 3.700 1.00 0.00 H new ATOM 0 HB2 GLN A 106 129.631 11.600 3.841 1.00 0.00 H new ATOM 0 HB3 GLN A 106 129.525 10.850 2.261 1.00 0.00 H new ATOM 0 HG2 GLN A 106 126.922 11.342 3.701 1.00 0.00 H new ATOM 0 HG3 GLN A 106 127.763 12.754 3.092 1.00 0.00 H new ATOM 0 HE21 GLN A 106 125.666 12.716 1.641 1.00 0.00 H new ATOM 0 HE22 GLN A 106 125.794 11.805 0.133 1.00 0.00 H new ATOM 1695 N PRO A 107 130.987 8.831 3.266 1.00 0.00 N ATOM 1696 CA PRO A 107 132.000 7.893 2.699 1.00 0.00 C ATOM 1697 C PRO A 107 132.120 6.601 3.510 1.00 0.00 C ATOM 1698 O PRO A 107 132.689 5.629 3.056 1.00 0.00 O ATOM 1699 CB PRO A 107 133.310 8.679 2.772 1.00 0.00 C ATOM 1700 CG PRO A 107 133.102 9.681 3.856 1.00 0.00 C ATOM 1701 CD PRO A 107 131.620 10.041 3.817 1.00 0.00 C ATOM 0 HA PRO A 107 131.730 7.579 1.691 1.00 0.00 H new ATOM 0 HB2 PRO A 107 134.151 8.023 2.997 1.00 0.00 H new ATOM 0 HB3 PRO A 107 133.531 9.166 1.822 1.00 0.00 H new ATOM 0 HG2 PRO A 107 133.378 9.269 4.827 1.00 0.00 H new ATOM 0 HG3 PRO A 107 133.722 10.563 3.696 1.00 0.00 H new ATOM 0 HD2 PRO A 107 131.238 10.277 4.810 1.00 0.00 H new ATOM 0 HD3 PRO A 107 131.435 10.912 3.189 1.00 0.00 H new ATOM 1709 N GLU A 108 131.597 6.577 4.706 1.00 0.00 N ATOM 1710 CA GLU A 108 131.702 5.339 5.527 1.00 0.00 C ATOM 1711 C GLU A 108 130.740 4.279 4.978 1.00 0.00 C ATOM 1712 O GLU A 108 131.133 3.167 4.671 1.00 0.00 O ATOM 1713 CB GLU A 108 131.399 5.667 6.998 1.00 0.00 C ATOM 1714 CG GLU A 108 129.890 5.714 7.255 1.00 0.00 C ATOM 1715 CD GLU A 108 129.263 6.870 6.471 1.00 0.00 C ATOM 1716 OE1 GLU A 108 129.451 6.920 5.268 1.00 0.00 O ATOM 1717 OE2 GLU A 108 128.602 7.688 7.090 1.00 0.00 O ATOM 0 H GLU A 108 131.106 7.355 5.147 1.00 0.00 H new ATOM 0 HA GLU A 108 132.715 4.939 5.473 1.00 0.00 H new ATOM 0 HB2 GLU A 108 131.857 4.917 7.643 1.00 0.00 H new ATOM 0 HB3 GLU A 108 131.845 6.627 7.259 1.00 0.00 H new ATOM 0 HG2 GLU A 108 129.432 4.771 6.957 1.00 0.00 H new ATOM 0 HG3 GLU A 108 129.698 5.839 8.321 1.00 0.00 H new ATOM 1724 N ALA A 109 129.489 4.611 4.825 1.00 0.00 N ATOM 1725 CA ALA A 109 128.531 3.619 4.272 1.00 0.00 C ATOM 1726 C ALA A 109 128.972 3.281 2.849 1.00 0.00 C ATOM 1727 O ALA A 109 128.910 2.146 2.412 1.00 0.00 O ATOM 1728 CB ALA A 109 127.126 4.222 4.255 1.00 0.00 C ATOM 0 H ALA A 109 129.092 5.521 5.058 1.00 0.00 H new ATOM 0 HA ALA A 109 128.515 2.717 4.884 1.00 0.00 H new ATOM 0 HB1 ALA A 109 126.423 3.495 3.849 1.00 0.00 H new ATOM 0 HB2 ALA A 109 126.831 4.485 5.271 1.00 0.00 H new ATOM 0 HB3 ALA A 109 127.122 5.117 3.633 1.00 0.00 H new ATOM 1734 N ALA A 110 129.441 4.264 2.132 1.00 0.00 N ATOM 1735 CA ALA A 110 129.914 4.021 0.745 1.00 0.00 C ATOM 1736 C ALA A 110 131.118 3.084 0.795 1.00 0.00 C ATOM 1737 O ALA A 110 131.288 2.230 -0.051 1.00 0.00 O ATOM 1738 CB ALA A 110 130.320 5.348 0.100 1.00 0.00 C ATOM 0 H ALA A 110 129.516 5.230 2.451 1.00 0.00 H new ATOM 0 HA ALA A 110 129.117 3.569 0.154 1.00 0.00 H new ATOM 0 HB1 ALA A 110 130.667 5.167 -0.917 1.00 0.00 H new ATOM 0 HB2 ALA A 110 129.461 6.019 0.077 1.00 0.00 H new ATOM 0 HB3 ALA A 110 131.122 5.805 0.681 1.00 0.00 H new ATOM 1744 N GLN A 111 131.954 3.226 1.791 1.00 0.00 N ATOM 1745 CA GLN A 111 133.132 2.324 1.888 1.00 0.00 C ATOM 1746 C GLN A 111 132.635 0.888 1.786 1.00 0.00 C ATOM 1747 O GLN A 111 133.113 0.112 0.980 1.00 0.00 O ATOM 1748 CB GLN A 111 133.848 2.538 3.222 1.00 0.00 C ATOM 1749 CG GLN A 111 134.609 3.866 3.180 1.00 0.00 C ATOM 1750 CD GLN A 111 136.116 3.601 3.240 1.00 0.00 C ATOM 1751 OE1 GLN A 111 136.563 2.735 3.965 1.00 0.00 O ATOM 1752 NE2 GLN A 111 136.921 4.315 2.502 1.00 0.00 N ATOM 0 H GLN A 111 131.871 3.921 2.533 1.00 0.00 H new ATOM 0 HA GLN A 111 133.838 2.537 1.085 1.00 0.00 H new ATOM 0 HB2 GLN A 111 133.126 2.545 4.038 1.00 0.00 H new ATOM 0 HB3 GLN A 111 134.538 1.716 3.414 1.00 0.00 H new ATOM 0 HG2 GLN A 111 134.362 4.409 2.268 1.00 0.00 H new ATOM 0 HG3 GLN A 111 134.307 4.495 4.017 1.00 0.00 H new ATOM 0 HE21 GLN A 111 136.545 5.042 1.893 1.00 0.00 H new ATOM 0 HE22 GLN A 111 137.926 4.146 2.534 1.00 0.00 H new ATOM 1761 N LEU A 112 131.653 0.529 2.570 1.00 0.00 N ATOM 1762 CA LEU A 112 131.120 -0.852 2.464 1.00 0.00 C ATOM 1763 C LEU A 112 130.800 -1.095 0.996 1.00 0.00 C ATOM 1764 O LEU A 112 131.029 -2.155 0.457 1.00 0.00 O ATOM 1765 CB LEU A 112 129.846 -0.992 3.299 1.00 0.00 C ATOM 1766 CG LEU A 112 130.208 -1.399 4.728 1.00 0.00 C ATOM 1767 CD1 LEU A 112 130.597 -2.880 4.766 1.00 0.00 C ATOM 1768 CD2 LEU A 112 131.385 -0.556 5.217 1.00 0.00 C ATOM 0 H LEU A 112 131.206 1.124 3.267 1.00 0.00 H new ATOM 0 HA LEU A 112 131.848 -1.575 2.833 1.00 0.00 H new ATOM 0 HB2 LEU A 112 129.299 -0.049 3.307 1.00 0.00 H new ATOM 0 HB3 LEU A 112 129.188 -1.738 2.854 1.00 0.00 H new ATOM 0 HG LEU A 112 129.345 -1.236 5.374 1.00 0.00 H new ATOM 0 HD11 LEU A 112 130.854 -3.163 5.787 1.00 0.00 H new ATOM 0 HD12 LEU A 112 129.759 -3.485 4.422 1.00 0.00 H new ATOM 0 HD13 LEU A 112 131.456 -3.047 4.116 1.00 0.00 H new ATOM 0 HD21 LEU A 112 131.642 -0.847 6.236 1.00 0.00 H new ATOM 0 HD22 LEU A 112 132.244 -0.718 4.566 1.00 0.00 H new ATOM 0 HD23 LEU A 112 131.110 0.498 5.199 1.00 0.00 H new ATOM 1780 N ALA A 113 130.290 -0.095 0.337 1.00 0.00 N ATOM 1781 CA ALA A 113 129.978 -0.239 -1.109 1.00 0.00 C ATOM 1782 C ALA A 113 131.263 -0.619 -1.854 1.00 0.00 C ATOM 1783 O ALA A 113 131.229 -1.243 -2.896 1.00 0.00 O ATOM 1784 CB ALA A 113 129.443 1.087 -1.654 1.00 0.00 C ATOM 0 H ALA A 113 130.075 0.818 0.739 1.00 0.00 H new ATOM 0 HA ALA A 113 129.223 -1.012 -1.250 1.00 0.00 H new ATOM 0 HB1 ALA A 113 129.215 0.979 -2.714 1.00 0.00 H new ATOM 0 HB2 ALA A 113 128.537 1.363 -1.114 1.00 0.00 H new ATOM 0 HB3 ALA A 113 130.195 1.865 -1.522 1.00 0.00 H new ATOM 1790 N LEU A 114 132.398 -0.238 -1.323 1.00 0.00 N ATOM 1791 CA LEU A 114 133.693 -0.566 -1.994 1.00 0.00 C ATOM 1792 C LEU A 114 133.940 -2.072 -1.910 1.00 0.00 C ATOM 1793 O LEU A 114 134.097 -2.751 -2.916 1.00 0.00 O ATOM 1794 CB LEU A 114 134.832 0.180 -1.294 1.00 0.00 C ATOM 1795 CG LEU A 114 135.917 0.535 -2.314 1.00 0.00 C ATOM 1796 CD1 LEU A 114 136.339 -0.725 -3.072 1.00 0.00 C ATOM 1797 CD2 LEU A 114 135.370 1.568 -3.305 1.00 0.00 C ATOM 0 H LEU A 114 132.484 0.287 -0.453 1.00 0.00 H new ATOM 0 HA LEU A 114 133.650 -0.263 -3.040 1.00 0.00 H new ATOM 0 HB2 LEU A 114 134.451 1.086 -0.823 1.00 0.00 H new ATOM 0 HB3 LEU A 114 135.252 -0.439 -0.501 1.00 0.00 H new ATOM 0 HG LEU A 114 136.780 0.952 -1.794 1.00 0.00 H new ATOM 0 HD11 LEU A 114 137.111 -0.471 -3.798 1.00 0.00 H new ATOM 0 HD12 LEU A 114 136.730 -1.459 -2.368 1.00 0.00 H new ATOM 0 HD13 LEU A 114 135.477 -1.143 -3.591 1.00 0.00 H new ATOM 0 HD21 LEU A 114 136.143 1.820 -4.031 1.00 0.00 H new ATOM 0 HD22 LEU A 114 134.506 1.152 -3.824 1.00 0.00 H new ATOM 0 HD23 LEU A 114 135.071 2.467 -2.766 1.00 0.00 H new ATOM 1809 N ARG A 115 133.949 -2.624 -0.727 1.00 0.00 N ATOM 1810 CA ARG A 115 134.152 -4.087 -0.643 1.00 0.00 C ATOM 1811 C ARG A 115 133.100 -4.701 -1.561 1.00 0.00 C ATOM 1812 O ARG A 115 133.379 -5.559 -2.369 1.00 0.00 O ATOM 1813 CB ARG A 115 133.988 -4.576 0.804 1.00 0.00 C ATOM 1814 CG ARG A 115 133.747 -3.382 1.729 1.00 0.00 C ATOM 1815 CD ARG A 115 135.021 -2.539 1.826 1.00 0.00 C ATOM 1816 NE ARG A 115 136.007 -3.003 0.810 1.00 0.00 N ATOM 1817 CZ ARG A 115 136.947 -2.198 0.398 1.00 0.00 C ATOM 1818 NH1 ARG A 115 137.024 -0.986 0.877 1.00 0.00 N ATOM 1819 NH2 ARG A 115 137.811 -2.604 -0.491 1.00 0.00 N ATOM 0 H ARG A 115 133.828 -2.136 0.160 1.00 0.00 H new ATOM 0 HA ARG A 115 135.158 -4.376 -0.948 1.00 0.00 H new ATOM 0 HB2 ARG A 115 133.153 -5.273 0.870 1.00 0.00 H new ATOM 0 HB3 ARG A 115 134.880 -5.117 1.118 1.00 0.00 H new ATOM 0 HG2 ARG A 115 132.926 -2.775 1.348 1.00 0.00 H new ATOM 0 HG3 ARG A 115 133.454 -3.730 2.719 1.00 0.00 H new ATOM 0 HD2 ARG A 115 134.786 -1.487 1.665 1.00 0.00 H new ATOM 0 HD3 ARG A 115 135.448 -2.621 2.826 1.00 0.00 H new ATOM 0 HE ARG A 115 135.947 -3.950 0.437 1.00 0.00 H new ATOM 0 HH11 ARG A 115 136.349 -0.669 1.573 1.00 0.00 H new ATOM 0 HH12 ARG A 115 137.759 -0.356 0.555 1.00 0.00 H new ATOM 0 HH21 ARG A 115 137.752 -3.551 -0.864 1.00 0.00 H new ATOM 0 HH22 ARG A 115 138.546 -1.974 -0.813 1.00 0.00 H new ATOM 1833 N VAL A 116 131.898 -4.209 -1.510 1.00 0.00 N ATOM 1834 CA VAL A 116 130.876 -4.731 -2.442 1.00 0.00 C ATOM 1835 C VAL A 116 131.522 -4.714 -3.823 1.00 0.00 C ATOM 1836 O VAL A 116 131.277 -5.560 -4.655 1.00 0.00 O ATOM 1837 CB VAL A 116 129.646 -3.818 -2.412 1.00 0.00 C ATOM 1838 CG1 VAL A 116 129.103 -3.612 -3.826 1.00 0.00 C ATOM 1839 CG2 VAL A 116 128.553 -4.443 -1.539 1.00 0.00 C ATOM 0 H VAL A 116 131.585 -3.478 -0.871 1.00 0.00 H new ATOM 0 HA VAL A 116 130.549 -5.736 -2.174 1.00 0.00 H new ATOM 0 HB VAL A 116 129.941 -2.854 -1.996 1.00 0.00 H new ATOM 0 HG11 VAL A 116 128.229 -2.961 -3.789 1.00 0.00 H new ATOM 0 HG12 VAL A 116 129.872 -3.153 -4.448 1.00 0.00 H new ATOM 0 HG13 VAL A 116 128.820 -4.575 -4.251 1.00 0.00 H new ATOM 0 HG21 VAL A 116 127.682 -3.788 -1.522 1.00 0.00 H new ATOM 0 HG22 VAL A 116 128.270 -5.413 -1.949 1.00 0.00 H new ATOM 0 HG23 VAL A 116 128.928 -4.573 -0.524 1.00 0.00 H new ATOM 1849 N GLY A 117 132.384 -3.762 -4.056 1.00 0.00 N ATOM 1850 CA GLY A 117 133.079 -3.706 -5.363 1.00 0.00 C ATOM 1851 C GLY A 117 133.664 -5.087 -5.635 1.00 0.00 C ATOM 1852 O GLY A 117 133.486 -5.662 -6.704 1.00 0.00 O ATOM 0 H GLY A 117 132.633 -3.025 -3.397 1.00 0.00 H new ATOM 0 HA2 GLY A 117 132.385 -3.422 -6.154 1.00 0.00 H new ATOM 0 HA3 GLY A 117 133.867 -2.953 -5.345 1.00 0.00 H new ATOM 1856 N ILE A 118 134.349 -5.650 -4.670 1.00 0.00 N ATOM 1857 CA ILE A 118 134.907 -7.004 -4.914 1.00 0.00 C ATOM 1858 C ILE A 118 133.769 -7.893 -5.391 1.00 0.00 C ATOM 1859 O ILE A 118 133.962 -8.790 -6.185 1.00 0.00 O ATOM 1860 CB ILE A 118 135.596 -7.596 -3.665 1.00 0.00 C ATOM 1861 CG1 ILE A 118 134.729 -7.513 -2.397 1.00 0.00 C ATOM 1862 CG2 ILE A 118 136.879 -6.810 -3.408 1.00 0.00 C ATOM 1863 CD1 ILE A 118 133.323 -8.078 -2.631 1.00 0.00 C ATOM 0 H ILE A 118 134.539 -5.243 -3.754 1.00 0.00 H new ATOM 0 HA ILE A 118 135.687 -6.940 -5.673 1.00 0.00 H new ATOM 0 HB ILE A 118 135.783 -8.650 -3.869 1.00 0.00 H new ATOM 0 HG12 ILE A 118 135.212 -8.063 -1.590 1.00 0.00 H new ATOM 0 HG13 ILE A 118 134.654 -6.474 -2.075 1.00 0.00 H new ATOM 0 HG21 ILE A 118 137.382 -7.212 -2.529 1.00 0.00 H new ATOM 0 HG22 ILE A 118 137.537 -6.894 -4.273 1.00 0.00 H new ATOM 0 HG23 ILE A 118 136.635 -5.761 -3.238 1.00 0.00 H new ATOM 0 HD11 ILE A 118 132.742 -8.001 -1.712 1.00 0.00 H new ATOM 0 HD12 ILE A 118 132.830 -7.511 -3.420 1.00 0.00 H new ATOM 0 HD13 ILE A 118 133.396 -9.124 -2.927 1.00 0.00 H new ATOM 1875 N ALA A 119 132.569 -7.639 -4.934 1.00 0.00 N ATOM 1876 CA ALA A 119 131.433 -8.464 -5.396 1.00 0.00 C ATOM 1877 C ALA A 119 131.169 -8.146 -6.863 1.00 0.00 C ATOM 1878 O ALA A 119 130.735 -8.992 -7.614 1.00 0.00 O ATOM 1879 CB ALA A 119 130.192 -8.183 -4.549 1.00 0.00 C ATOM 0 H ALA A 119 132.337 -6.902 -4.268 1.00 0.00 H new ATOM 0 HA ALA A 119 131.674 -9.522 -5.289 1.00 0.00 H new ATOM 0 HB1 ALA A 119 129.364 -8.798 -4.901 1.00 0.00 H new ATOM 0 HB2 ALA A 119 130.402 -8.420 -3.506 1.00 0.00 H new ATOM 0 HB3 ALA A 119 129.924 -7.130 -4.635 1.00 0.00 H new ATOM 1885 N VAL A 120 131.463 -6.953 -7.308 1.00 0.00 N ATOM 1886 CA VAL A 120 131.242 -6.671 -8.748 1.00 0.00 C ATOM 1887 C VAL A 120 131.925 -7.796 -9.491 1.00 0.00 C ATOM 1888 O VAL A 120 131.422 -8.323 -10.463 1.00 0.00 O ATOM 1889 CB VAL A 120 131.858 -5.329 -9.132 1.00 0.00 C ATOM 1890 CG1 VAL A 120 131.637 -5.078 -10.623 1.00 0.00 C ATOM 1891 CG2 VAL A 120 131.192 -4.219 -8.321 1.00 0.00 C ATOM 0 H VAL A 120 131.836 -6.184 -6.752 1.00 0.00 H new ATOM 0 HA VAL A 120 130.180 -6.613 -8.988 1.00 0.00 H new ATOM 0 HB VAL A 120 132.928 -5.341 -8.922 1.00 0.00 H new ATOM 0 HG11 VAL A 120 132.076 -4.120 -10.900 1.00 0.00 H new ATOM 0 HG12 VAL A 120 132.109 -5.873 -11.200 1.00 0.00 H new ATOM 0 HG13 VAL A 120 130.568 -5.062 -10.835 1.00 0.00 H new ATOM 0 HG21 VAL A 120 131.629 -3.258 -8.592 1.00 0.00 H new ATOM 0 HG22 VAL A 120 130.123 -4.204 -8.534 1.00 0.00 H new ATOM 0 HG23 VAL A 120 131.348 -4.402 -7.258 1.00 0.00 H new ATOM 1901 N ALA A 121 133.045 -8.217 -8.985 1.00 0.00 N ATOM 1902 CA ALA A 121 133.737 -9.373 -9.603 1.00 0.00 C ATOM 1903 C ALA A 121 133.136 -10.641 -8.985 1.00 0.00 C ATOM 1904 O ALA A 121 133.223 -11.723 -9.531 1.00 0.00 O ATOM 1905 CB ALA A 121 135.236 -9.305 -9.298 1.00 0.00 C ATOM 0 H ALA A 121 133.510 -7.812 -8.173 1.00 0.00 H new ATOM 0 HA ALA A 121 133.609 -9.370 -10.686 1.00 0.00 H new ATOM 0 HB1 ALA A 121 135.739 -10.157 -9.755 1.00 0.00 H new ATOM 0 HB2 ALA A 121 135.648 -8.381 -9.703 1.00 0.00 H new ATOM 0 HB3 ALA A 121 135.389 -9.329 -8.219 1.00 0.00 H new ATOM 1911 N LYS A 122 132.525 -10.494 -7.832 1.00 0.00 N ATOM 1912 CA LYS A 122 131.902 -11.659 -7.130 1.00 0.00 C ATOM 1913 C LYS A 122 130.490 -11.282 -6.654 1.00 0.00 C ATOM 1914 O LYS A 122 130.164 -11.433 -5.494 1.00 0.00 O ATOM 1915 CB LYS A 122 132.754 -12.071 -5.924 1.00 0.00 C ATOM 1916 CG LYS A 122 134.238 -11.880 -6.243 1.00 0.00 C ATOM 1917 CD LYS A 122 135.056 -12.964 -5.537 1.00 0.00 C ATOM 1918 CE LYS A 122 136.499 -12.486 -5.368 1.00 0.00 C ATOM 1919 NZ LYS A 122 137.281 -13.519 -4.631 1.00 0.00 N ATOM 0 H LYS A 122 132.431 -9.604 -7.343 1.00 0.00 H new ATOM 0 HA LYS A 122 131.843 -12.496 -7.825 1.00 0.00 H new ATOM 0 HB2 LYS A 122 132.481 -11.474 -5.054 1.00 0.00 H new ATOM 0 HB3 LYS A 122 132.559 -13.113 -5.669 1.00 0.00 H new ATOM 0 HG2 LYS A 122 134.399 -11.932 -7.320 1.00 0.00 H new ATOM 0 HG3 LYS A 122 134.566 -10.893 -5.919 1.00 0.00 H new ATOM 0 HD2 LYS A 122 134.620 -13.188 -4.564 1.00 0.00 H new ATOM 0 HD3 LYS A 122 135.033 -13.887 -6.116 1.00 0.00 H new ATOM 0 HE2 LYS A 122 136.949 -12.301 -6.343 1.00 0.00 H new ATOM 0 HE3 LYS A 122 136.519 -11.542 -4.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 138.244 -13.166 -4.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 136.817 -13.723 -3.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 137.329 -14.389 -5.199 1.00 0.00 H new ATOM 1933 N SER A 123 129.665 -10.761 -7.526 1.00 0.00 N ATOM 1934 CA SER A 123 128.289 -10.342 -7.108 1.00 0.00 C ATOM 1935 C SER A 123 127.712 -11.347 -6.119 1.00 0.00 C ATOM 1936 O SER A 123 126.731 -11.084 -5.451 1.00 0.00 O ATOM 1937 CB SER A 123 127.384 -10.260 -8.338 1.00 0.00 C ATOM 1938 OG SER A 123 128.182 -10.050 -9.495 1.00 0.00 O ATOM 0 H SER A 123 129.883 -10.607 -8.510 1.00 0.00 H new ATOM 0 HA SER A 123 128.346 -9.365 -6.629 1.00 0.00 H new ATOM 0 HB2 SER A 123 126.808 -11.179 -8.442 1.00 0.00 H new ATOM 0 HB3 SER A 123 126.668 -9.446 -8.223 1.00 0.00 H new ATOM 0 HG SER A 123 128.602 -9.166 -9.447 1.00 0.00 H new ATOM 1944 N ASP A 124 128.315 -12.485 -6.008 1.00 0.00 N ATOM 1945 CA ASP A 124 127.808 -13.500 -5.047 1.00 0.00 C ATOM 1946 C ASP A 124 128.962 -14.403 -4.611 1.00 0.00 C ATOM 1947 O ASP A 124 128.900 -15.610 -4.732 1.00 0.00 O ATOM 1948 CB ASP A 124 126.712 -14.333 -5.716 1.00 0.00 C ATOM 1949 CG ASP A 124 127.346 -15.345 -6.672 1.00 0.00 C ATOM 1950 OD1 ASP A 124 127.728 -14.945 -7.760 1.00 0.00 O ATOM 1951 OD2 ASP A 124 127.440 -16.503 -6.300 1.00 0.00 O ATOM 0 H ASP A 124 129.140 -12.763 -6.540 1.00 0.00 H new ATOM 0 HA ASP A 124 127.391 -13.004 -4.171 1.00 0.00 H new ATOM 0 HB2 ASP A 124 126.123 -14.852 -4.960 1.00 0.00 H new ATOM 0 HB3 ASP A 124 126.028 -13.682 -6.261 1.00 0.00 H new ATOM 1956 N GLY A 125 130.022 -13.826 -4.103 1.00 0.00 N ATOM 1957 CA GLY A 125 131.177 -14.657 -3.664 1.00 0.00 C ATOM 1958 C GLY A 125 131.976 -13.921 -2.585 1.00 0.00 C ATOM 1959 O GLY A 125 132.435 -14.518 -1.631 1.00 0.00 O ATOM 0 H GLY A 125 130.135 -12.820 -3.975 1.00 0.00 H new ATOM 0 HA2 GLY A 125 130.821 -15.612 -3.276 1.00 0.00 H new ATOM 0 HA3 GLY A 125 131.820 -14.879 -4.516 1.00 0.00 H new ATOM 1963 N ASN A 126 132.157 -12.633 -2.724 1.00 0.00 N ATOM 1964 CA ASN A 126 132.939 -11.883 -1.699 1.00 0.00 C ATOM 1965 C ASN A 126 132.024 -10.921 -0.932 1.00 0.00 C ATOM 1966 O ASN A 126 130.829 -10.875 -1.150 1.00 0.00 O ATOM 1967 CB ASN A 126 134.067 -11.109 -2.384 1.00 0.00 C ATOM 1968 CG ASN A 126 135.330 -11.971 -2.415 1.00 0.00 C ATOM 1969 OD1 ASN A 126 135.254 -13.183 -2.376 1.00 0.00 O ATOM 1970 ND2 ASN A 126 136.498 -11.393 -2.483 1.00 0.00 N ATOM 0 H ASN A 126 131.800 -12.072 -3.497 1.00 0.00 H new ATOM 0 HA ASN A 126 133.369 -12.589 -0.988 1.00 0.00 H new ATOM 0 HB2 ASN A 126 133.773 -10.838 -3.398 1.00 0.00 H new ATOM 0 HB3 ASN A 126 134.261 -10.179 -1.850 1.00 0.00 H new ATOM 0 HD21 ASN A 126 137.347 -11.959 -2.503 1.00 0.00 H new ATOM 0 HD22 ASN A 126 136.562 -10.376 -2.516 1.00 0.00 H new ATOM 1977 N PHE A 127 132.584 -10.169 -0.019 1.00 0.00 N ATOM 1978 CA PHE A 127 131.775 -9.214 0.799 1.00 0.00 C ATOM 1979 C PHE A 127 131.302 -9.910 2.071 1.00 0.00 C ATOM 1980 O PHE A 127 131.425 -11.109 2.220 1.00 0.00 O ATOM 1981 CB PHE A 127 130.555 -8.715 0.022 1.00 0.00 C ATOM 1982 CG PHE A 127 130.177 -7.355 0.559 1.00 0.00 C ATOM 1983 CD1 PHE A 127 131.003 -6.262 0.296 1.00 0.00 C ATOM 1984 CD2 PHE A 127 129.024 -7.190 1.337 1.00 0.00 C ATOM 1985 CE1 PHE A 127 130.682 -4.999 0.806 1.00 0.00 C ATOM 1986 CE2 PHE A 127 128.698 -5.923 1.844 1.00 0.00 C ATOM 1987 CZ PHE A 127 129.529 -4.828 1.578 1.00 0.00 C ATOM 0 H PHE A 127 133.581 -10.176 0.197 1.00 0.00 H new ATOM 0 HA PHE A 127 132.405 -8.359 1.045 1.00 0.00 H new ATOM 0 HB2 PHE A 127 130.781 -8.654 -1.042 1.00 0.00 H new ATOM 0 HB3 PHE A 127 129.724 -9.411 0.132 1.00 0.00 H new ATOM 0 HD1 PHE A 127 131.893 -6.391 -0.303 1.00 0.00 H new ATOM 0 HD2 PHE A 127 128.387 -8.037 1.546 1.00 0.00 H new ATOM 0 HE1 PHE A 127 131.325 -4.156 0.603 1.00 0.00 H new ATOM 0 HE2 PHE A 127 127.806 -5.792 2.439 1.00 0.00 H new ATOM 0 HZ PHE A 127 129.280 -3.853 1.969 1.00 0.00 H new ATOM 1997 N ASP A 128 130.761 -9.163 2.991 1.00 0.00 N ATOM 1998 CA ASP A 128 130.276 -9.771 4.255 1.00 0.00 C ATOM 1999 C ASP A 128 131.474 -10.159 5.126 1.00 0.00 C ATOM 2000 O ASP A 128 131.333 -10.458 6.294 1.00 0.00 O ATOM 2001 CB ASP A 128 129.441 -11.009 3.928 1.00 0.00 C ATOM 2002 CG ASP A 128 128.742 -10.815 2.581 1.00 0.00 C ATOM 2003 OD1 ASP A 128 127.701 -10.178 2.562 1.00 0.00 O ATOM 2004 OD2 ASP A 128 129.257 -11.308 1.591 1.00 0.00 O ATOM 0 H ASP A 128 130.634 -8.153 2.919 1.00 0.00 H new ATOM 0 HA ASP A 128 129.660 -9.055 4.799 1.00 0.00 H new ATOM 0 HB2 ASP A 128 130.079 -11.892 3.894 1.00 0.00 H new ATOM 0 HB3 ASP A 128 128.702 -11.179 4.711 1.00 0.00 H new ATOM 2009 N ASP A 129 132.656 -10.140 4.570 1.00 0.00 N ATOM 2010 CA ASP A 129 133.864 -10.490 5.372 1.00 0.00 C ATOM 2011 C ASP A 129 134.518 -9.201 5.853 1.00 0.00 C ATOM 2012 O ASP A 129 135.092 -9.144 6.922 1.00 0.00 O ATOM 2013 CB ASP A 129 134.849 -11.277 4.504 1.00 0.00 C ATOM 2014 CG ASP A 129 136.171 -11.445 5.256 1.00 0.00 C ATOM 2015 OD1 ASP A 129 136.959 -10.514 5.242 1.00 0.00 O ATOM 2016 OD2 ASP A 129 136.372 -12.501 5.832 1.00 0.00 O ATOM 0 H ASP A 129 132.837 -9.897 3.596 1.00 0.00 H new ATOM 0 HA ASP A 129 133.579 -11.104 6.227 1.00 0.00 H new ATOM 0 HB2 ASP A 129 134.432 -12.253 4.257 1.00 0.00 H new ATOM 0 HB3 ASP A 129 135.018 -10.755 3.562 1.00 0.00 H new ATOM 2021 N ASP A 130 134.416 -8.157 5.081 1.00 0.00 N ATOM 2022 CA ASP A 130 135.009 -6.867 5.505 1.00 0.00 C ATOM 2023 C ASP A 130 134.016 -6.173 6.431 1.00 0.00 C ATOM 2024 O ASP A 130 134.380 -5.358 7.252 1.00 0.00 O ATOM 2025 CB ASP A 130 135.271 -5.990 4.279 1.00 0.00 C ATOM 2026 CG ASP A 130 136.394 -4.999 4.590 1.00 0.00 C ATOM 2027 OD1 ASP A 130 136.093 -3.940 5.116 1.00 0.00 O ATOM 2028 OD2 ASP A 130 137.535 -5.316 4.297 1.00 0.00 O ATOM 0 H ASP A 130 133.947 -8.144 4.175 1.00 0.00 H new ATOM 0 HA ASP A 130 135.954 -7.036 6.021 1.00 0.00 H new ATOM 0 HB2 ASP A 130 135.546 -6.611 3.427 1.00 0.00 H new ATOM 0 HB3 ASP A 130 134.364 -5.453 4.003 1.00 0.00 H new ATOM 2033 N GLU A 131 132.757 -6.505 6.309 1.00 0.00 N ATOM 2034 CA GLU A 131 131.729 -5.874 7.179 1.00 0.00 C ATOM 2035 C GLU A 131 132.171 -5.973 8.638 1.00 0.00 C ATOM 2036 O GLU A 131 131.833 -5.148 9.455 1.00 0.00 O ATOM 2037 CB GLU A 131 130.395 -6.601 6.994 1.00 0.00 C ATOM 2038 CG GLU A 131 129.655 -6.012 5.792 1.00 0.00 C ATOM 2039 CD GLU A 131 130.604 -5.945 4.594 1.00 0.00 C ATOM 2040 OE1 GLU A 131 131.585 -5.225 4.680 1.00 0.00 O ATOM 2041 OE2 GLU A 131 130.336 -6.618 3.612 1.00 0.00 O ATOM 0 H GLU A 131 132.399 -7.188 5.642 1.00 0.00 H new ATOM 0 HA GLU A 131 131.610 -4.825 6.908 1.00 0.00 H new ATOM 0 HB2 GLU A 131 130.567 -7.666 6.842 1.00 0.00 H new ATOM 0 HB3 GLU A 131 129.787 -6.502 7.893 1.00 0.00 H new ATOM 0 HG2 GLU A 131 128.787 -6.625 5.549 1.00 0.00 H new ATOM 0 HG3 GLU A 131 129.284 -5.016 6.032 1.00 0.00 H new ATOM 2048 N LYS A 132 132.934 -6.966 8.977 1.00 0.00 N ATOM 2049 CA LYS A 132 133.393 -7.082 10.386 1.00 0.00 C ATOM 2050 C LYS A 132 134.346 -5.924 10.683 1.00 0.00 C ATOM 2051 O LYS A 132 134.160 -5.179 11.625 1.00 0.00 O ATOM 2052 CB LYS A 132 134.101 -8.420 10.574 1.00 0.00 C ATOM 2053 CG LYS A 132 133.334 -9.495 9.800 1.00 0.00 C ATOM 2054 CD LYS A 132 133.137 -10.728 10.680 1.00 0.00 C ATOM 2055 CE LYS A 132 132.562 -11.868 9.840 1.00 0.00 C ATOM 2056 NZ LYS A 132 133.629 -12.427 8.962 1.00 0.00 N ATOM 0 H LYS A 132 133.259 -7.699 8.347 1.00 0.00 H new ATOM 0 HA LYS A 132 132.547 -7.037 11.071 1.00 0.00 H new ATOM 0 HB2 LYS A 132 135.128 -8.357 10.216 1.00 0.00 H new ATOM 0 HB3 LYS A 132 134.148 -8.677 11.632 1.00 0.00 H new ATOM 0 HG2 LYS A 132 132.367 -9.106 9.482 1.00 0.00 H new ATOM 0 HG3 LYS A 132 133.881 -9.766 8.897 1.00 0.00 H new ATOM 0 HD2 LYS A 132 134.088 -11.030 11.119 1.00 0.00 H new ATOM 0 HD3 LYS A 132 132.464 -10.495 11.505 1.00 0.00 H new ATOM 0 HE2 LYS A 132 132.165 -12.648 10.490 1.00 0.00 H new ATOM 0 HE3 LYS A 132 131.732 -11.505 9.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 133.299 -12.435 7.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 134.483 -11.839 9.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 133.851 -13.398 9.260 1.00 0.00 H new ATOM 2070 N SER A 133 135.351 -5.748 9.870 1.00 0.00 N ATOM 2071 CA SER A 133 136.297 -4.620 10.091 1.00 0.00 C ATOM 2072 C SER A 133 135.654 -3.335 9.566 1.00 0.00 C ATOM 2073 O SER A 133 135.804 -2.268 10.136 1.00 0.00 O ATOM 2074 CB SER A 133 137.601 -4.888 9.338 1.00 0.00 C ATOM 2075 OG SER A 133 137.863 -6.285 9.335 1.00 0.00 O ATOM 0 H SER A 133 135.557 -6.337 9.063 1.00 0.00 H new ATOM 0 HA SER A 133 136.517 -4.520 11.154 1.00 0.00 H new ATOM 0 HB2 SER A 133 137.526 -4.518 8.315 1.00 0.00 H new ATOM 0 HB3 SER A 133 138.424 -4.353 9.811 1.00 0.00 H new ATOM 0 HG SER A 133 138.697 -6.460 8.852 1.00 0.00 H new ATOM 2081 N ALA A 134 134.919 -3.433 8.489 1.00 0.00 N ATOM 2082 CA ALA A 134 134.250 -2.228 7.937 1.00 0.00 C ATOM 2083 C ALA A 134 133.246 -1.734 8.969 1.00 0.00 C ATOM 2084 O ALA A 134 133.248 -0.580 9.350 1.00 0.00 O ATOM 2085 CB ALA A 134 133.530 -2.581 6.631 1.00 0.00 C ATOM 0 H ALA A 134 134.756 -4.297 7.971 1.00 0.00 H new ATOM 0 HA ALA A 134 134.985 -1.452 7.723 1.00 0.00 H new ATOM 0 HB1 ALA A 134 133.042 -1.691 6.233 1.00 0.00 H new ATOM 0 HB2 ALA A 134 134.254 -2.953 5.906 1.00 0.00 H new ATOM 0 HB3 ALA A 134 132.782 -3.350 6.824 1.00 0.00 H new ATOM 2091 N VAL A 135 132.402 -2.606 9.452 1.00 0.00 N ATOM 2092 CA VAL A 135 131.430 -2.175 10.485 1.00 0.00 C ATOM 2093 C VAL A 135 132.215 -1.497 11.606 1.00 0.00 C ATOM 2094 O VAL A 135 131.756 -0.558 12.222 1.00 0.00 O ATOM 2095 CB VAL A 135 130.660 -3.386 11.020 1.00 0.00 C ATOM 2096 CG1 VAL A 135 129.775 -2.958 12.190 1.00 0.00 C ATOM 2097 CG2 VAL A 135 129.780 -3.952 9.901 1.00 0.00 C ATOM 0 H VAL A 135 132.347 -3.587 9.177 1.00 0.00 H new ATOM 0 HA VAL A 135 130.703 -1.480 10.064 1.00 0.00 H new ATOM 0 HB VAL A 135 131.364 -4.145 11.360 1.00 0.00 H new ATOM 0 HG11 VAL A 135 129.229 -3.822 12.568 1.00 0.00 H new ATOM 0 HG12 VAL A 135 130.397 -2.546 12.985 1.00 0.00 H new ATOM 0 HG13 VAL A 135 129.067 -2.200 11.853 1.00 0.00 H new ATOM 0 HG21 VAL A 135 129.228 -4.815 10.273 1.00 0.00 H new ATOM 0 HG22 VAL A 135 129.077 -3.188 9.569 1.00 0.00 H new ATOM 0 HG23 VAL A 135 130.408 -4.257 9.063 1.00 0.00 H new ATOM 2107 N ARG A 136 133.412 -1.957 11.863 1.00 0.00 N ATOM 2108 CA ARG A 136 134.237 -1.322 12.930 1.00 0.00 C ATOM 2109 C ARG A 136 134.248 0.187 12.703 1.00 0.00 C ATOM 2110 O ARG A 136 133.927 0.969 13.577 1.00 0.00 O ATOM 2111 CB ARG A 136 135.680 -1.839 12.833 1.00 0.00 C ATOM 2112 CG ARG A 136 136.325 -1.887 14.228 1.00 0.00 C ATOM 2113 CD ARG A 136 136.769 -3.317 14.557 1.00 0.00 C ATOM 2114 NE ARG A 136 138.251 -3.414 14.440 1.00 0.00 N ATOM 2115 CZ ARG A 136 138.877 -4.452 14.924 1.00 0.00 C ATOM 2116 NH1 ARG A 136 138.205 -5.404 15.510 1.00 0.00 N ATOM 2117 NH2 ARG A 136 140.175 -4.537 14.821 1.00 0.00 N ATOM 0 H ARG A 136 133.851 -2.742 11.382 1.00 0.00 H new ATOM 0 HA ARG A 136 133.822 -1.561 13.909 1.00 0.00 H new ATOM 0 HB2 ARG A 136 135.688 -2.834 12.387 1.00 0.00 H new ATOM 0 HB3 ARG A 136 136.262 -1.191 12.178 1.00 0.00 H new ATOM 0 HG2 ARG A 136 137.182 -1.215 14.264 1.00 0.00 H new ATOM 0 HG3 ARG A 136 135.615 -1.537 14.977 1.00 0.00 H new ATOM 0 HD2 ARG A 136 136.455 -3.584 15.566 1.00 0.00 H new ATOM 0 HD3 ARG A 136 136.292 -4.023 13.877 1.00 0.00 H new ATOM 0 HE ARG A 136 138.776 -2.669 13.982 1.00 0.00 H new ATOM 0 HH11 ARG A 136 137.190 -5.337 15.590 1.00 0.00 H new ATOM 0 HH12 ARG A 136 138.694 -6.215 15.888 1.00 0.00 H new ATOM 0 HH21 ARG A 136 140.700 -3.792 14.362 1.00 0.00 H new ATOM 0 HH22 ARG A 136 140.665 -5.348 15.199 1.00 0.00 H new ATOM 2131 N GLU A 137 134.625 0.594 11.524 1.00 0.00 N ATOM 2132 CA GLU A 137 134.675 2.051 11.208 1.00 0.00 C ATOM 2133 C GLU A 137 133.262 2.594 10.969 1.00 0.00 C ATOM 2134 O GLU A 137 132.993 3.756 11.193 1.00 0.00 O ATOM 2135 CB GLU A 137 135.519 2.267 9.951 1.00 0.00 C ATOM 2136 CG GLU A 137 136.861 1.547 10.107 1.00 0.00 C ATOM 2137 CD GLU A 137 137.657 1.664 8.806 1.00 0.00 C ATOM 2138 OE1 GLU A 137 137.079 2.084 7.816 1.00 0.00 O ATOM 2139 OE2 GLU A 137 138.831 1.332 8.821 1.00 0.00 O ATOM 0 H GLU A 137 134.903 -0.022 10.760 1.00 0.00 H new ATOM 0 HA GLU A 137 135.119 2.580 12.051 1.00 0.00 H new ATOM 0 HB2 GLU A 137 134.991 1.888 9.076 1.00 0.00 H new ATOM 0 HB3 GLU A 137 135.683 3.332 9.789 1.00 0.00 H new ATOM 0 HG2 GLU A 137 137.426 1.982 10.932 1.00 0.00 H new ATOM 0 HG3 GLU A 137 136.697 0.498 10.352 1.00 0.00 H new ATOM 2146 N ILE A 138 132.360 1.774 10.500 1.00 0.00 N ATOM 2147 CA ILE A 138 130.976 2.266 10.234 1.00 0.00 C ATOM 2148 C ILE A 138 130.266 2.568 11.559 1.00 0.00 C ATOM 2149 O ILE A 138 129.782 3.659 11.780 1.00 0.00 O ATOM 2150 CB ILE A 138 130.206 1.193 9.442 1.00 0.00 C ATOM 2151 CG1 ILE A 138 129.540 1.839 8.223 1.00 0.00 C ATOM 2152 CG2 ILE A 138 129.130 0.537 10.318 1.00 0.00 C ATOM 2153 CD1 ILE A 138 130.577 2.046 7.115 1.00 0.00 C ATOM 0 H ILE A 138 132.520 0.789 10.290 1.00 0.00 H new ATOM 0 HA ILE A 138 131.016 3.185 9.649 1.00 0.00 H new ATOM 0 HB ILE A 138 130.911 0.426 9.121 1.00 0.00 H new ATOM 0 HG12 ILE A 138 128.730 1.206 7.862 1.00 0.00 H new ATOM 0 HG13 ILE A 138 129.097 2.795 8.503 1.00 0.00 H new ATOM 0 HG21 ILE A 138 128.599 -0.218 9.738 1.00 0.00 H new ATOM 0 HG22 ILE A 138 129.601 0.066 11.181 1.00 0.00 H new ATOM 0 HG23 ILE A 138 128.425 1.296 10.658 1.00 0.00 H new ATOM 0 HD11 ILE A 138 130.099 2.506 6.250 1.00 0.00 H new ATOM 0 HD12 ILE A 138 131.373 2.697 7.478 1.00 0.00 H new ATOM 0 HD13 ILE A 138 130.999 1.083 6.827 1.00 0.00 H new ATOM 2165 N ALA A 139 130.198 1.612 12.438 1.00 0.00 N ATOM 2166 CA ALA A 139 129.522 1.835 13.743 1.00 0.00 C ATOM 2167 C ALA A 139 130.187 3.004 14.469 1.00 0.00 C ATOM 2168 O ALA A 139 129.528 3.886 14.982 1.00 0.00 O ATOM 2169 CB ALA A 139 129.648 0.571 14.593 1.00 0.00 C ATOM 0 H ALA A 139 130.585 0.677 12.308 1.00 0.00 H new ATOM 0 HA ALA A 139 128.469 2.065 13.577 1.00 0.00 H new ATOM 0 HB1 ALA A 139 129.154 0.727 15.552 1.00 0.00 H new ATOM 0 HB2 ALA A 139 129.178 -0.265 14.074 1.00 0.00 H new ATOM 0 HB3 ALA A 139 130.702 0.348 14.759 1.00 0.00 H new ATOM 2175 N ARG A 140 131.491 3.017 14.517 1.00 0.00 N ATOM 2176 CA ARG A 140 132.196 4.128 15.212 1.00 0.00 C ATOM 2177 C ARG A 140 132.024 5.422 14.412 1.00 0.00 C ATOM 2178 O ARG A 140 131.751 6.471 14.961 1.00 0.00 O ATOM 2179 CB ARG A 140 133.685 3.793 15.326 1.00 0.00 C ATOM 2180 CG ARG A 140 133.913 2.886 16.536 1.00 0.00 C ATOM 2181 CD ARG A 140 134.058 3.741 17.796 1.00 0.00 C ATOM 2182 NE ARG A 140 134.458 2.875 18.941 1.00 0.00 N ATOM 2183 CZ ARG A 140 134.439 3.351 20.156 1.00 0.00 C ATOM 2184 NH1 ARG A 140 134.070 4.584 20.369 1.00 0.00 N ATOM 2185 NH2 ARG A 140 134.789 2.593 21.159 1.00 0.00 N ATOM 0 H ARG A 140 132.097 2.307 14.105 1.00 0.00 H new ATOM 0 HA ARG A 140 131.775 4.259 16.209 1.00 0.00 H new ATOM 0 HB2 ARG A 140 134.028 3.298 14.417 1.00 0.00 H new ATOM 0 HB3 ARG A 140 134.268 4.708 15.429 1.00 0.00 H new ATOM 0 HG2 ARG A 140 133.078 2.194 16.647 1.00 0.00 H new ATOM 0 HG3 ARG A 140 134.809 2.283 16.388 1.00 0.00 H new ATOM 0 HD2 ARG A 140 134.805 4.519 17.636 1.00 0.00 H new ATOM 0 HD3 ARG A 140 133.116 4.243 18.018 1.00 0.00 H new ATOM 0 HE ARG A 140 134.746 1.911 18.775 1.00 0.00 H new ATOM 0 HH11 ARG A 140 133.796 5.177 19.586 1.00 0.00 H new ATOM 0 HH12 ARG A 140 134.055 4.955 21.319 1.00 0.00 H new ATOM 0 HH21 ARG A 140 135.077 1.629 20.993 1.00 0.00 H new ATOM 0 HH22 ARG A 140 134.774 2.965 22.109 1.00 0.00 H new ATOM 2199 N SER A 141 132.180 5.355 13.118 1.00 0.00 N ATOM 2200 CA SER A 141 132.024 6.581 12.284 1.00 0.00 C ATOM 2201 C SER A 141 130.620 7.152 12.481 1.00 0.00 C ATOM 2202 O SER A 141 130.443 8.338 12.674 1.00 0.00 O ATOM 2203 CB SER A 141 132.229 6.228 10.811 1.00 0.00 C ATOM 2204 OG SER A 141 133.587 5.865 10.599 1.00 0.00 O ATOM 0 H SER A 141 132.409 4.505 12.602 1.00 0.00 H new ATOM 0 HA SER A 141 132.765 7.322 12.584 1.00 0.00 H new ATOM 0 HB2 SER A 141 131.572 5.405 10.528 1.00 0.00 H new ATOM 0 HB3 SER A 141 131.965 7.078 10.181 1.00 0.00 H new ATOM 0 HG SER A 141 133.654 4.892 10.503 1.00 0.00 H new ATOM 2210 N LEU A 142 129.618 6.316 12.439 1.00 0.00 N ATOM 2211 CA LEU A 142 128.229 6.814 12.629 1.00 0.00 C ATOM 2212 C LEU A 142 127.899 6.810 14.124 1.00 0.00 C ATOM 2213 O LEU A 142 127.783 7.850 14.742 1.00 0.00 O ATOM 2214 CB LEU A 142 127.242 5.915 11.879 1.00 0.00 C ATOM 2215 CG LEU A 142 127.824 5.507 10.521 1.00 0.00 C ATOM 2216 CD1 LEU A 142 127.117 4.248 10.036 1.00 0.00 C ATOM 2217 CD2 LEU A 142 127.603 6.622 9.498 1.00 0.00 C ATOM 0 H LEU A 142 129.703 5.312 12.282 1.00 0.00 H new ATOM 0 HA LEU A 142 128.148 7.827 12.235 1.00 0.00 H new ATOM 0 HB2 LEU A 142 127.026 5.026 12.472 1.00 0.00 H new ATOM 0 HB3 LEU A 142 126.298 6.440 11.735 1.00 0.00 H new ATOM 0 HG LEU A 142 128.893 5.324 10.631 1.00 0.00 H new ATOM 0 HD11 LEU A 142 127.525 3.951 9.070 1.00 0.00 H new ATOM 0 HD12 LEU A 142 127.269 3.445 10.757 1.00 0.00 H new ATOM 0 HD13 LEU A 142 126.050 4.446 9.934 1.00 0.00 H new ATOM 0 HD21 LEU A 142 128.020 6.322 8.537 1.00 0.00 H new ATOM 0 HD22 LEU A 142 126.535 6.808 9.388 1.00 0.00 H new ATOM 0 HD23 LEU A 142 128.096 7.532 9.839 1.00 0.00 H new ATOM 2229 N GLY A 143 127.760 5.653 14.721 1.00 0.00 N ATOM 2230 CA GLY A 143 127.454 5.613 16.180 1.00 0.00 C ATOM 2231 C GLY A 143 126.763 4.297 16.562 1.00 0.00 C ATOM 2232 O GLY A 143 125.856 4.284 17.370 1.00 0.00 O ATOM 0 H GLY A 143 127.844 4.744 14.266 1.00 0.00 H new ATOM 0 HA2 GLY A 143 128.376 5.723 16.751 1.00 0.00 H new ATOM 0 HA3 GLY A 143 126.813 6.454 16.444 1.00 0.00 H new ATOM 2236 N PHE A 144 127.183 3.188 16.008 1.00 0.00 N ATOM 2237 CA PHE A 144 126.536 1.890 16.376 1.00 0.00 C ATOM 2238 C PHE A 144 127.515 1.040 17.187 1.00 0.00 C ATOM 2239 O PHE A 144 128.285 1.544 17.981 1.00 0.00 O ATOM 2240 CB PHE A 144 126.137 1.109 15.121 1.00 0.00 C ATOM 2241 CG PHE A 144 125.607 2.042 14.061 1.00 0.00 C ATOM 2242 CD1 PHE A 144 124.916 3.204 14.421 1.00 0.00 C ATOM 2243 CD2 PHE A 144 125.804 1.734 12.711 1.00 0.00 C ATOM 2244 CE1 PHE A 144 124.423 4.058 13.430 1.00 0.00 C ATOM 2245 CE2 PHE A 144 125.313 2.587 11.719 1.00 0.00 C ATOM 2246 CZ PHE A 144 124.620 3.750 12.078 1.00 0.00 C ATOM 0 H PHE A 144 127.937 3.123 15.324 1.00 0.00 H new ATOM 0 HA PHE A 144 125.644 2.108 16.964 1.00 0.00 H new ATOM 0 HB2 PHE A 144 126.999 0.564 14.736 1.00 0.00 H new ATOM 0 HB3 PHE A 144 125.378 0.368 15.373 1.00 0.00 H new ATOM 0 HD1 PHE A 144 124.764 3.441 15.464 1.00 0.00 H new ATOM 0 HD2 PHE A 144 126.336 0.836 12.435 1.00 0.00 H new ATOM 0 HE1 PHE A 144 123.890 4.956 13.707 1.00 0.00 H new ATOM 0 HE2 PHE A 144 125.468 2.350 10.677 1.00 0.00 H new ATOM 0 HZ PHE A 144 124.238 4.409 11.313 1.00 0.00 H new ATOM 2256 N ASP A 145 127.491 -0.252 16.987 1.00 0.00 N ATOM 2257 CA ASP A 145 128.419 -1.148 17.735 1.00 0.00 C ATOM 2258 C ASP A 145 129.731 -1.280 16.952 1.00 0.00 C ATOM 2259 O ASP A 145 129.757 -1.827 15.868 1.00 0.00 O ATOM 2260 CB ASP A 145 127.778 -2.529 17.887 1.00 0.00 C ATOM 2261 CG ASP A 145 126.987 -2.584 19.195 1.00 0.00 C ATOM 2262 OD1 ASP A 145 127.604 -2.782 20.229 1.00 0.00 O ATOM 2263 OD2 ASP A 145 125.778 -2.428 19.141 1.00 0.00 O ATOM 0 H ASP A 145 126.866 -0.726 16.335 1.00 0.00 H new ATOM 0 HA ASP A 145 128.620 -0.729 18.721 1.00 0.00 H new ATOM 0 HB2 ASP A 145 127.119 -2.731 17.043 1.00 0.00 H new ATOM 0 HB3 ASP A 145 128.547 -3.301 17.882 1.00 0.00 H new ATOM 2268 N PRO A 146 130.811 -0.775 17.491 1.00 0.00 N ATOM 2269 CA PRO A 146 132.144 -0.830 16.824 1.00 0.00 C ATOM 2270 C PRO A 146 132.473 -2.215 16.255 1.00 0.00 C ATOM 2271 O PRO A 146 133.130 -3.016 16.889 1.00 0.00 O ATOM 2272 CB PRO A 146 133.125 -0.468 17.939 1.00 0.00 C ATOM 2273 CG PRO A 146 132.343 0.357 18.904 1.00 0.00 C ATOM 2274 CD PRO A 146 130.885 -0.093 18.795 1.00 0.00 C ATOM 0 HA PRO A 146 132.184 -0.159 15.966 1.00 0.00 H new ATOM 0 HB2 PRO A 146 133.522 -1.363 18.419 1.00 0.00 H new ATOM 0 HB3 PRO A 146 133.977 0.088 17.547 1.00 0.00 H new ATOM 0 HG2 PRO A 146 132.715 0.219 19.919 1.00 0.00 H new ATOM 0 HG3 PRO A 146 132.438 1.418 18.671 1.00 0.00 H new ATOM 0 HD2 PRO A 146 130.614 -0.763 19.610 1.00 0.00 H new ATOM 0 HD3 PRO A 146 130.202 0.756 18.839 1.00 0.00 H new ATOM 2282 N ALA A 147 132.036 -2.492 15.056 1.00 0.00 N ATOM 2283 CA ALA A 147 132.337 -3.809 14.428 1.00 0.00 C ATOM 2284 C ALA A 147 131.709 -4.943 15.228 1.00 0.00 C ATOM 2285 O ALA A 147 132.029 -5.162 16.379 1.00 0.00 O ATOM 2286 CB ALA A 147 133.848 -4.017 14.367 1.00 0.00 C ATOM 0 H ALA A 147 131.480 -1.858 14.482 1.00 0.00 H new ATOM 0 HA ALA A 147 131.920 -3.813 13.421 1.00 0.00 H new ATOM 0 HB1 ALA A 147 134.064 -4.981 13.907 1.00 0.00 H new ATOM 0 HB2 ALA A 147 134.301 -3.222 13.774 1.00 0.00 H new ATOM 0 HB3 ALA A 147 134.259 -3.996 15.376 1.00 0.00 H new ATOM 2292 N GLU A 148 130.829 -5.675 14.612 1.00 0.00 N ATOM 2293 CA GLU A 148 130.183 -6.817 15.313 1.00 0.00 C ATOM 2294 C GLU A 148 128.961 -7.290 14.518 1.00 0.00 C ATOM 2295 O GLU A 148 128.019 -7.811 15.080 1.00 0.00 O ATOM 2296 CB GLU A 148 129.740 -6.375 16.715 1.00 0.00 C ATOM 2297 CG GLU A 148 130.619 -7.048 17.773 1.00 0.00 C ATOM 2298 CD GLU A 148 130.103 -8.463 18.041 1.00 0.00 C ATOM 2299 OE1 GLU A 148 128.945 -8.592 18.403 1.00 0.00 O ATOM 2300 OE2 GLU A 148 130.875 -9.394 17.878 1.00 0.00 O ATOM 0 H GLU A 148 130.527 -5.532 13.648 1.00 0.00 H new ATOM 0 HA GLU A 148 130.897 -7.636 15.397 1.00 0.00 H new ATOM 0 HB2 GLU A 148 129.813 -5.291 16.804 1.00 0.00 H new ATOM 0 HB3 GLU A 148 128.695 -6.639 16.876 1.00 0.00 H new ATOM 0 HG2 GLU A 148 131.653 -7.085 17.431 1.00 0.00 H new ATOM 0 HG3 GLU A 148 130.608 -6.465 18.694 1.00 0.00 H new ATOM 2307 N PHE A 149 128.968 -7.135 13.215 1.00 0.00 N ATOM 2308 CA PHE A 149 127.798 -7.595 12.412 1.00 0.00 C ATOM 2309 C PHE A 149 128.273 -8.625 11.397 1.00 0.00 C ATOM 2310 O PHE A 149 127.837 -9.759 11.396 1.00 0.00 O ATOM 2311 CB PHE A 149 127.154 -6.417 11.667 1.00 0.00 C ATOM 2312 CG PHE A 149 126.958 -5.238 12.596 1.00 0.00 C ATOM 2313 CD1 PHE A 149 126.731 -5.436 13.963 1.00 0.00 C ATOM 2314 CD2 PHE A 149 127.011 -3.938 12.081 1.00 0.00 C ATOM 2315 CE1 PHE A 149 126.559 -4.337 14.811 1.00 0.00 C ATOM 2316 CE2 PHE A 149 126.840 -2.839 12.929 1.00 0.00 C ATOM 2317 CZ PHE A 149 126.616 -3.038 14.295 1.00 0.00 C ATOM 0 H PHE A 149 129.727 -6.714 12.680 1.00 0.00 H new ATOM 0 HA PHE A 149 127.058 -8.031 13.083 1.00 0.00 H new ATOM 0 HB2 PHE A 149 127.784 -6.124 10.827 1.00 0.00 H new ATOM 0 HB3 PHE A 149 126.193 -6.724 11.253 1.00 0.00 H new ATOM 0 HD1 PHE A 149 126.689 -6.438 14.363 1.00 0.00 H new ATOM 0 HD2 PHE A 149 127.184 -3.783 11.026 1.00 0.00 H new ATOM 0 HE1 PHE A 149 126.382 -4.491 15.865 1.00 0.00 H new ATOM 0 HE2 PHE A 149 126.881 -1.837 12.529 1.00 0.00 H new ATOM 0 HZ PHE A 149 126.487 -2.190 14.951 1.00 0.00 H new ATOM 2327 N GLY A 150 129.167 -8.241 10.532 1.00 0.00 N ATOM 2328 CA GLY A 150 129.670 -9.200 9.519 1.00 0.00 C ATOM 2329 C GLY A 150 128.504 -10.051 9.014 1.00 0.00 C ATOM 2330 O GLY A 150 128.342 -11.189 9.405 1.00 0.00 O ATOM 0 H GLY A 150 129.570 -7.305 10.484 1.00 0.00 H new ATOM 0 HA2 GLY A 150 130.131 -8.664 8.690 1.00 0.00 H new ATOM 0 HA3 GLY A 150 130.440 -9.837 9.954 1.00 0.00 H new