USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 890 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 91 HIS : no HD1:sc= -0.312 X(o=0.61,f=0.52) USER MOD Set 1.2: A 124 SER OG : rot -160:sc= -0.0824 USER MOD Set 1.3: A 128 THR OG1 : rot 87:sc= 1.01 USER MOD Set 2.1: A 72 SER OG : rot 60:sc= 0.251 USER MOD Set 2.2: A 103 CYS SG : rot 152:sc= 0.296 USER MOD Set 3.1: A 53 HIS : no HE2:sc= -1.62 K(o=-1.3,f=-2.2) USER MOD Set 3.2: A 71 TYR OH : rot -112:sc= 0.273 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 CYS SG : rot -149:sc= 1.23 USER MOD Single : A 25 MET CE :methyl 175:sc= -0.77 (180deg=-0.87) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0241) USER MOD Single : A 32 SER OG : rot -100:sc= -0.887 USER MOD Single : A 35 ASN : amide:sc=-0.00382 X(o=-0.0038,f=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 52:sc= -0.0135 USER MOD Single : A 44 ASN : amide:sc= -0.0366 X(o=-0.037,f=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 154:sc= -0.353 (180deg=-1.35!) USER MOD Single : A 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl -175:sc= -0.681 (180deg=-0.759) USER MOD Single : A 58 ASN : amide:sc= -0.112 X(o=-0.11,f=0) USER MOD Single : A 63 HIS : no HD1:sc=-0.000716 X(o=-0.00072,f=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 TYR OH : rot 64:sc= 0.559 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 72:sc= 0.036 USER MOD Single : A 96 ASN : amide:sc= -0.449 K(o=-0.45,f=-1.7) USER MOD Single : A 101 GLN : amide:sc= -1.27 K(o=-1.3,f=-5.3!) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 ASN :FLIP amide:sc= 0.157 F(o=-2.1,f=0.16) USER MOD Single : A 111 THR OG1 : rot 2:sc= 0.482 USER MOD Single : A 122 GLN : amide:sc= -0.0196 X(o=-0.02,f=-0.25) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 93 N LEU A 10 1.942 5.107 -3.341 1.00 0.00 N ATOM 94 CA LEU A 10 3.116 4.243 -3.372 1.00 0.00 C ATOM 95 C LEU A 10 3.945 4.495 -4.627 1.00 0.00 C ATOM 96 O LEU A 10 3.507 5.194 -5.543 1.00 0.00 O ATOM 97 CB LEU A 10 2.696 2.774 -3.312 1.00 0.00 C ATOM 98 CG LEU A 10 1.765 2.414 -2.152 1.00 0.00 C ATOM 99 CD1 LEU A 10 1.368 0.948 -2.222 1.00 0.00 C ATOM 100 CD2 LEU A 10 2.431 2.725 -0.820 1.00 0.00 C ATOM 0 HA LEU A 10 3.729 4.475 -2.501 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.202 2.514 -4.248 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.593 2.158 -3.243 1.00 0.00 H new ATOM 0 HG LEU A 10 0.861 3.018 -2.234 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.706 0.710 -1.389 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.852 0.755 -3.162 1.00 0.00 H new ATOM 0 HD13 LEU A 10 2.261 0.326 -2.164 1.00 0.00 H new ATOM 0 HD21 LEU A 10 1.756 2.463 -0.006 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.350 2.147 -0.729 1.00 0.00 H new ATOM 0 HD23 LEU A 10 2.665 3.788 -0.770 1.00 0.00 H new ATOM 112 N ASP A 11 5.143 3.921 -4.666 1.00 0.00 N ATOM 113 CA ASP A 11 6.032 4.082 -5.811 1.00 0.00 C ATOM 114 C ASP A 11 5.826 2.959 -6.821 1.00 0.00 C ATOM 115 O ASP A 11 5.151 1.971 -6.536 1.00 0.00 O ATOM 116 CB ASP A 11 7.491 4.111 -5.349 1.00 0.00 C ATOM 117 CG ASP A 11 8.053 5.519 -5.294 1.00 0.00 C ATOM 118 OD1 ASP A 11 8.209 6.139 -6.366 1.00 0.00 O ATOM 119 OD2 ASP A 11 8.337 6.001 -4.176 1.00 0.00 O ATOM 0 H ASP A 11 5.521 3.340 -3.918 1.00 0.00 H new ATOM 0 HA ASP A 11 5.794 5.029 -6.296 1.00 0.00 H new ATOM 0 HB2 ASP A 11 7.566 3.654 -4.362 1.00 0.00 H new ATOM 0 HB3 ASP A 11 8.096 3.508 -6.026 1.00 0.00 H new ATOM 124 N ALA A 12 6.415 3.118 -8.002 1.00 0.00 N ATOM 125 CA ALA A 12 6.297 2.117 -9.055 1.00 0.00 C ATOM 126 C ALA A 12 6.983 0.815 -8.656 1.00 0.00 C ATOM 127 O ALA A 12 6.568 -0.269 -9.065 1.00 0.00 O ATOM 128 CB ALA A 12 6.883 2.647 -10.354 1.00 0.00 C ATOM 0 H ALA A 12 6.978 3.930 -8.253 1.00 0.00 H new ATOM 0 HA ALA A 12 5.238 1.907 -9.205 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.788 1.889 -11.132 1.00 0.00 H new ATOM 0 HB2 ALA A 12 6.345 3.546 -10.656 1.00 0.00 H new ATOM 0 HB3 ALA A 12 7.936 2.886 -10.207 1.00 0.00 H new ATOM 134 N ALA A 13 8.037 0.931 -7.854 1.00 0.00 N ATOM 135 CA ALA A 13 8.783 -0.237 -7.400 1.00 0.00 C ATOM 136 C ALA A 13 8.141 -0.849 -6.159 1.00 0.00 C ATOM 137 O ALA A 13 8.188 -2.062 -5.959 1.00 0.00 O ATOM 138 CB ALA A 13 10.230 0.139 -7.118 1.00 0.00 C ATOM 0 H ALA A 13 8.393 1.821 -7.506 1.00 0.00 H new ATOM 0 HA ALA A 13 8.761 -0.984 -8.194 1.00 0.00 H new ATOM 0 HB1 ALA A 13 10.776 -0.742 -6.780 1.00 0.00 H new ATOM 0 HB2 ALA A 13 10.690 0.524 -8.028 1.00 0.00 H new ATOM 0 HB3 ALA A 13 10.262 0.905 -6.343 1.00 0.00 H new ATOM 144 N ALA A 14 7.545 -0.001 -5.328 1.00 0.00 N ATOM 145 CA ALA A 14 6.894 -0.457 -4.106 1.00 0.00 C ATOM 146 C ALA A 14 5.583 -1.173 -4.416 1.00 0.00 C ATOM 147 O ALA A 14 5.214 -2.133 -3.742 1.00 0.00 O ATOM 148 CB ALA A 14 6.648 0.715 -3.170 1.00 0.00 C ATOM 0 H ALA A 14 7.499 1.007 -5.479 1.00 0.00 H new ATOM 0 HA ALA A 14 7.558 -1.167 -3.614 1.00 0.00 H new ATOM 0 HB1 ALA A 14 6.161 0.359 -2.262 1.00 0.00 H new ATOM 0 HB2 ALA A 14 7.599 1.181 -2.913 1.00 0.00 H new ATOM 0 HB3 ALA A 14 6.007 1.446 -3.663 1.00 0.00 H new ATOM 154 N ALA A 15 4.883 -0.697 -5.441 1.00 0.00 N ATOM 155 CA ALA A 15 3.613 -1.290 -5.840 1.00 0.00 C ATOM 156 C ALA A 15 3.813 -2.696 -6.397 1.00 0.00 C ATOM 157 O ALA A 15 2.946 -3.558 -6.260 1.00 0.00 O ATOM 158 CB ALA A 15 2.920 -0.408 -6.867 1.00 0.00 C ATOM 0 H ALA A 15 5.175 0.098 -6.010 1.00 0.00 H new ATOM 0 HA ALA A 15 2.981 -1.365 -4.955 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.973 -0.862 -7.157 1.00 0.00 H new ATOM 0 HB2 ALA A 15 2.734 0.576 -6.436 1.00 0.00 H new ATOM 0 HB3 ALA A 15 3.556 -0.304 -7.746 1.00 0.00 H new ATOM 164 N LEU A 16 4.964 -2.920 -7.024 1.00 0.00 N ATOM 165 CA LEU A 16 5.277 -4.222 -7.601 1.00 0.00 C ATOM 166 C LEU A 16 5.365 -5.291 -6.517 1.00 0.00 C ATOM 167 O LEU A 16 4.928 -6.426 -6.713 1.00 0.00 O ATOM 168 CB LEU A 16 6.595 -4.153 -8.379 1.00 0.00 C ATOM 169 CG LEU A 16 6.445 -4.042 -9.898 1.00 0.00 C ATOM 170 CD1 LEU A 16 7.600 -3.252 -10.491 1.00 0.00 C ATOM 171 CD2 LEU A 16 6.363 -5.426 -10.525 1.00 0.00 C ATOM 0 H LEU A 16 5.694 -2.218 -7.145 1.00 0.00 H new ATOM 0 HA LEU A 16 4.473 -4.493 -8.285 1.00 0.00 H new ATOM 0 HB2 LEU A 16 7.166 -3.296 -8.022 1.00 0.00 H new ATOM 0 HB3 LEU A 16 7.181 -5.043 -8.151 1.00 0.00 H new ATOM 0 HG LEU A 16 5.519 -3.510 -10.117 1.00 0.00 H new ATOM 0 HD11 LEU A 16 7.477 -3.183 -11.572 1.00 0.00 H new ATOM 0 HD12 LEU A 16 7.613 -2.250 -10.063 1.00 0.00 H new ATOM 0 HD13 LEU A 16 8.540 -3.756 -10.264 1.00 0.00 H new ATOM 0 HD21 LEU A 16 6.257 -5.330 -11.606 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.272 -5.983 -10.298 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.501 -5.958 -10.121 1.00 0.00 H new ATOM 183 N SER A 17 5.934 -4.923 -5.374 1.00 0.00 N ATOM 184 CA SER A 17 6.079 -5.851 -4.258 1.00 0.00 C ATOM 185 C SER A 17 4.718 -6.243 -3.693 1.00 0.00 C ATOM 186 O SER A 17 4.543 -7.347 -3.178 1.00 0.00 O ATOM 187 CB SER A 17 6.941 -5.228 -3.158 1.00 0.00 C ATOM 188 OG SER A 17 8.308 -5.557 -3.334 1.00 0.00 O ATOM 0 H SER A 17 6.302 -3.989 -5.196 1.00 0.00 H new ATOM 0 HA SER A 17 6.569 -6.751 -4.629 1.00 0.00 H new ATOM 0 HB2 SER A 17 6.820 -4.145 -3.167 1.00 0.00 H new ATOM 0 HB3 SER A 17 6.602 -5.579 -2.183 1.00 0.00 H new ATOM 0 HG SER A 17 8.838 -5.146 -2.620 1.00 0.00 H new ATOM 194 N VAL A 18 3.755 -5.331 -3.792 1.00 0.00 N ATOM 195 CA VAL A 18 2.410 -5.582 -3.290 1.00 0.00 C ATOM 196 C VAL A 18 1.629 -6.487 -4.237 1.00 0.00 C ATOM 197 O VAL A 18 0.869 -7.351 -3.800 1.00 0.00 O ATOM 198 CB VAL A 18 1.630 -4.270 -3.092 1.00 0.00 C ATOM 199 CG1 VAL A 18 0.305 -4.533 -2.394 1.00 0.00 C ATOM 200 CG2 VAL A 18 2.463 -3.266 -2.310 1.00 0.00 C ATOM 0 H VAL A 18 3.882 -4.412 -4.215 1.00 0.00 H new ATOM 0 HA VAL A 18 2.521 -6.079 -2.326 1.00 0.00 H new ATOM 0 HB VAL A 18 1.417 -3.846 -4.073 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.231 -3.593 -2.264 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.296 -5.212 -2.998 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.491 -4.983 -1.419 1.00 0.00 H new ATOM 0 HG21 VAL A 18 1.895 -2.345 -2.180 1.00 0.00 H new ATOM 0 HG22 VAL A 18 2.710 -3.681 -1.333 1.00 0.00 H new ATOM 0 HG23 VAL A 18 3.382 -3.052 -2.856 1.00 0.00 H new ATOM 210 N ALA A 19 1.820 -6.282 -5.536 1.00 0.00 N ATOM 211 CA ALA A 19 1.133 -7.079 -6.544 1.00 0.00 C ATOM 212 C ALA A 19 1.775 -8.454 -6.690 1.00 0.00 C ATOM 213 O ALA A 19 1.103 -9.432 -7.020 1.00 0.00 O ATOM 214 CB ALA A 19 1.131 -6.352 -7.880 1.00 0.00 C ATOM 0 H ALA A 19 2.445 -5.570 -5.915 1.00 0.00 H new ATOM 0 HA ALA A 19 0.103 -7.221 -6.218 1.00 0.00 H new ATOM 0 HB1 ALA A 19 0.615 -6.959 -8.624 1.00 0.00 H new ATOM 0 HB2 ALA A 19 0.619 -5.396 -7.773 1.00 0.00 H new ATOM 0 HB3 ALA A 19 2.158 -6.180 -8.202 1.00 0.00 H new ATOM 220 N GLU A 20 3.079 -8.523 -6.442 1.00 0.00 N ATOM 221 CA GLU A 20 3.812 -9.780 -6.548 1.00 0.00 C ATOM 222 C GLU A 20 3.585 -10.648 -5.314 1.00 0.00 C ATOM 223 O GLU A 20 3.605 -11.877 -5.395 1.00 0.00 O ATOM 224 CB GLU A 20 5.307 -9.509 -6.726 1.00 0.00 C ATOM 225 CG GLU A 20 5.677 -9.033 -8.121 1.00 0.00 C ATOM 226 CD GLU A 20 6.956 -9.666 -8.633 1.00 0.00 C ATOM 227 OE1 GLU A 20 6.899 -10.820 -9.109 1.00 0.00 O ATOM 228 OE2 GLU A 20 8.015 -9.008 -8.557 1.00 0.00 O ATOM 0 H GLU A 20 3.650 -7.724 -6.166 1.00 0.00 H new ATOM 0 HA GLU A 20 3.440 -10.316 -7.421 1.00 0.00 H new ATOM 0 HB2 GLU A 20 5.621 -8.759 -6.000 1.00 0.00 H new ATOM 0 HB3 GLU A 20 5.862 -10.420 -6.503 1.00 0.00 H new ATOM 0 HG2 GLU A 20 4.862 -9.263 -8.807 1.00 0.00 H new ATOM 0 HG3 GLU A 20 5.790 -7.949 -8.113 1.00 0.00 H new ATOM 235 N CYS A 21 3.372 -10.002 -4.172 1.00 0.00 N ATOM 236 CA CYS A 21 3.143 -10.717 -2.921 1.00 0.00 C ATOM 237 C CYS A 21 1.700 -11.201 -2.824 1.00 0.00 C ATOM 238 O CYS A 21 1.436 -12.305 -2.348 1.00 0.00 O ATOM 239 CB CYS A 21 3.474 -9.818 -1.728 1.00 0.00 C ATOM 240 SG CYS A 21 5.202 -9.898 -1.201 1.00 0.00 S ATOM 0 H CYS A 21 3.353 -8.986 -4.087 1.00 0.00 H new ATOM 0 HA CYS A 21 3.799 -11.587 -2.905 1.00 0.00 H new ATOM 0 HB2 CYS A 21 3.231 -8.787 -1.985 1.00 0.00 H new ATOM 0 HB3 CYS A 21 2.836 -10.096 -0.889 1.00 0.00 H new ATOM 0 HG CYS A 21 5.275 -9.687 0.080 1.00 0.00 H new ATOM 246 N VAL A 22 0.769 -10.366 -3.275 1.00 0.00 N ATOM 247 CA VAL A 22 -0.647 -10.710 -3.238 1.00 0.00 C ATOM 248 C VAL A 22 -0.970 -11.829 -4.224 1.00 0.00 C ATOM 249 O VAL A 22 -1.883 -12.623 -4.000 1.00 0.00 O ATOM 250 CB VAL A 22 -1.530 -9.485 -3.552 1.00 0.00 C ATOM 251 CG1 VAL A 22 -1.245 -8.960 -4.951 1.00 0.00 C ATOM 252 CG2 VAL A 22 -3.004 -9.832 -3.394 1.00 0.00 C ATOM 0 H VAL A 22 0.970 -9.447 -3.670 1.00 0.00 H new ATOM 0 HA VAL A 22 -0.863 -11.053 -2.226 1.00 0.00 H new ATOM 0 HB VAL A 22 -1.288 -8.697 -2.839 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -1.879 -8.096 -5.152 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -0.198 -8.666 -5.023 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -1.454 -9.741 -5.682 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.611 -8.955 -3.620 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -3.263 -10.639 -4.079 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -3.195 -10.151 -2.369 1.00 0.00 H new ATOM 262 N GLU A 23 -0.215 -11.884 -5.317 1.00 0.00 N ATOM 263 CA GLU A 23 -0.420 -12.905 -6.338 1.00 0.00 C ATOM 264 C GLU A 23 0.249 -14.221 -5.946 1.00 0.00 C ATOM 265 O GLU A 23 -0.109 -15.283 -6.454 1.00 0.00 O ATOM 266 CB GLU A 23 0.123 -12.424 -7.685 1.00 0.00 C ATOM 267 CG GLU A 23 -0.920 -11.735 -8.550 1.00 0.00 C ATOM 268 CD GLU A 23 -1.205 -12.488 -9.835 1.00 0.00 C ATOM 269 OE1 GLU A 23 -0.458 -12.291 -10.817 1.00 0.00 O ATOM 270 OE2 GLU A 23 -2.176 -13.274 -9.860 1.00 0.00 O ATOM 0 H GLU A 23 0.544 -11.233 -5.518 1.00 0.00 H new ATOM 0 HA GLU A 23 -1.492 -13.081 -6.426 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.950 -11.736 -7.509 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.529 -13.277 -8.229 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -1.845 -11.630 -7.983 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -0.578 -10.729 -8.792 1.00 0.00 H new ATOM 277 N ARG A 24 1.222 -14.144 -5.043 1.00 0.00 N ATOM 278 CA ARG A 24 1.938 -15.331 -4.589 1.00 0.00 C ATOM 279 C ARG A 24 1.184 -16.030 -3.461 1.00 0.00 C ATOM 280 O ARG A 24 1.299 -17.241 -3.282 1.00 0.00 O ATOM 281 CB ARG A 24 3.344 -14.954 -4.120 1.00 0.00 C ATOM 282 CG ARG A 24 4.406 -15.092 -5.200 1.00 0.00 C ATOM 283 CD ARG A 24 5.582 -14.164 -4.947 1.00 0.00 C ATOM 284 NE ARG A 24 6.698 -14.855 -4.304 1.00 0.00 N ATOM 285 CZ ARG A 24 6.800 -15.042 -2.989 1.00 0.00 C ATOM 286 NH1 ARG A 24 5.856 -14.592 -2.170 1.00 0.00 N ATOM 287 NH2 ARG A 24 7.849 -15.681 -2.491 1.00 0.00 N ATOM 0 H ARG A 24 1.532 -13.273 -4.612 1.00 0.00 H new ATOM 0 HA ARG A 24 2.013 -16.021 -5.430 1.00 0.00 H new ATOM 0 HB2 ARG A 24 3.334 -13.925 -3.762 1.00 0.00 H new ATOM 0 HB3 ARG A 24 3.616 -15.584 -3.273 1.00 0.00 H new ATOM 0 HG2 ARG A 24 4.757 -16.123 -5.237 1.00 0.00 H new ATOM 0 HG3 ARG A 24 3.968 -14.869 -6.173 1.00 0.00 H new ATOM 0 HD2 ARG A 24 5.917 -13.737 -5.892 1.00 0.00 H new ATOM 0 HD3 ARG A 24 5.260 -13.334 -4.319 1.00 0.00 H new ATOM 0 HE ARG A 24 7.444 -15.216 -4.898 1.00 0.00 H new ATOM 0 HH11 ARG A 24 5.046 -14.100 -2.547 1.00 0.00 H new ATOM 0 HH12 ARG A 24 5.941 -14.739 -1.164 1.00 0.00 H new ATOM 0 HH21 ARG A 24 8.577 -16.029 -3.115 1.00 0.00 H new ATOM 0 HH22 ARG A 24 7.928 -15.825 -1.484 1.00 0.00 H new ATOM 301 N MET A 25 0.415 -15.257 -2.699 1.00 0.00 N ATOM 302 CA MET A 25 -0.353 -15.804 -1.586 1.00 0.00 C ATOM 303 C MET A 25 -1.714 -16.314 -2.052 1.00 0.00 C ATOM 304 O MET A 25 -2.302 -17.198 -1.428 1.00 0.00 O ATOM 305 CB MET A 25 -0.539 -14.744 -0.499 1.00 0.00 C ATOM 306 CG MET A 25 -1.266 -13.499 -0.981 1.00 0.00 C ATOM 307 SD MET A 25 -1.869 -12.477 0.377 1.00 0.00 S ATOM 308 CE MET A 25 -0.325 -11.901 1.079 1.00 0.00 C ATOM 0 H MET A 25 0.308 -14.251 -2.832 1.00 0.00 H new ATOM 0 HA MET A 25 0.205 -16.646 -1.176 1.00 0.00 H new ATOM 0 HB2 MET A 25 -1.095 -15.180 0.331 1.00 0.00 H new ATOM 0 HB3 MET A 25 0.439 -14.457 -0.112 1.00 0.00 H new ATOM 0 HG2 MET A 25 -0.594 -12.909 -1.604 1.00 0.00 H new ATOM 0 HG3 MET A 25 -2.106 -13.794 -1.609 1.00 0.00 H new ATOM 0 HE1 MET A 25 -0.532 -11.186 1.875 1.00 0.00 H new ATOM 0 HE2 MET A 25 0.228 -12.748 1.487 1.00 0.00 H new ATOM 0 HE3 MET A 25 0.270 -11.419 0.303 1.00 0.00 H new ATOM 318 N ALA A 26 -2.215 -15.752 -3.149 1.00 0.00 N ATOM 319 CA ALA A 26 -3.508 -16.151 -3.691 1.00 0.00 C ATOM 320 C ALA A 26 -3.554 -17.653 -3.967 1.00 0.00 C ATOM 321 O ALA A 26 -4.452 -18.351 -3.493 1.00 0.00 O ATOM 322 CB ALA A 26 -3.813 -15.368 -4.960 1.00 0.00 C ATOM 0 H ALA A 26 -1.744 -15.019 -3.679 1.00 0.00 H new ATOM 0 HA ALA A 26 -4.270 -15.925 -2.945 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -4.782 -15.676 -5.354 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.836 -14.302 -4.733 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -3.040 -15.564 -5.703 1.00 0.00 H new ATOM 328 N PRO A 27 -2.583 -18.173 -4.739 1.00 0.00 N ATOM 329 CA PRO A 27 -2.521 -19.600 -5.075 1.00 0.00 C ATOM 330 C PRO A 27 -2.624 -20.491 -3.841 1.00 0.00 C ATOM 331 O PRO A 27 -3.439 -21.414 -3.796 1.00 0.00 O ATOM 332 CB PRO A 27 -1.146 -19.751 -5.729 1.00 0.00 C ATOM 333 CG PRO A 27 -0.841 -18.403 -6.285 1.00 0.00 C ATOM 334 CD PRO A 27 -1.474 -17.413 -5.346 1.00 0.00 C ATOM 0 HA PRO A 27 -3.349 -19.904 -5.716 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -0.394 -20.059 -5.003 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -1.161 -20.508 -6.513 1.00 0.00 H new ATOM 0 HG2 PRO A 27 0.235 -18.243 -6.352 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.243 -18.297 -7.293 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -0.767 -17.065 -4.593 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -1.835 -16.531 -5.876 1.00 0.00 H new ATOM 342 N THR A 28 -1.794 -20.211 -2.843 1.00 0.00 N ATOM 343 CA THR A 28 -1.791 -20.988 -1.609 1.00 0.00 C ATOM 344 C THR A 28 -3.051 -20.718 -0.791 1.00 0.00 C ATOM 345 O THR A 28 -3.537 -21.592 -0.074 1.00 0.00 O ATOM 346 CB THR A 28 -0.550 -20.662 -0.778 1.00 0.00 C ATOM 347 OG1 THR A 28 -0.521 -21.438 0.407 1.00 0.00 O ATOM 348 CG2 THR A 28 -0.467 -19.206 -0.373 1.00 0.00 C ATOM 0 H THR A 28 -1.114 -19.451 -2.864 1.00 0.00 H new ATOM 0 HA THR A 28 -1.773 -22.045 -1.876 1.00 0.00 H new ATOM 0 HB THR A 28 0.298 -20.893 -1.423 1.00 0.00 H new ATOM 0 HG1 THR A 28 0.281 -21.216 0.924 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.437 -19.043 0.214 1.00 0.00 H new ATOM 0 HG22 THR A 28 -0.438 -18.581 -1.266 1.00 0.00 H new ATOM 0 HG23 THR A 28 -1.340 -18.944 0.225 1.00 0.00 H new ATOM 356 N LEU A 29 -3.574 -19.501 -0.904 1.00 0.00 N ATOM 357 CA LEU A 29 -4.776 -19.117 -0.173 1.00 0.00 C ATOM 358 C LEU A 29 -6.007 -19.823 -0.741 1.00 0.00 C ATOM 359 O LEU A 29 -6.145 -19.963 -1.957 1.00 0.00 O ATOM 360 CB LEU A 29 -4.972 -17.601 -0.234 1.00 0.00 C ATOM 361 CG LEU A 29 -4.160 -16.803 0.788 1.00 0.00 C ATOM 362 CD1 LEU A 29 -4.148 -15.326 0.424 1.00 0.00 C ATOM 363 CD2 LEU A 29 -4.720 -17.004 2.188 1.00 0.00 C ATOM 0 H LEU A 29 -3.185 -18.765 -1.494 1.00 0.00 H new ATOM 0 HA LEU A 29 -4.652 -19.420 0.867 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -4.709 -17.256 -1.234 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -6.029 -17.380 -0.088 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.133 -17.169 0.773 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -3.566 -14.774 1.162 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -3.700 -15.198 -0.561 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -5.170 -14.946 0.410 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -4.130 -16.429 2.902 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -5.756 -16.666 2.218 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -4.676 -18.061 2.449 1.00 0.00 H new ATOM 375 N PRO A 30 -6.922 -20.280 0.133 1.00 0.00 N ATOM 376 CA PRO A 30 -8.141 -20.972 -0.292 1.00 0.00 C ATOM 377 C PRO A 30 -9.182 -20.014 -0.863 1.00 0.00 C ATOM 378 O PRO A 30 -9.062 -18.797 -0.724 1.00 0.00 O ATOM 379 CB PRO A 30 -8.650 -21.605 1.001 1.00 0.00 C ATOM 380 CG PRO A 30 -8.162 -20.701 2.079 1.00 0.00 C ATOM 381 CD PRO A 30 -6.840 -20.157 1.603 1.00 0.00 C ATOM 0 HA PRO A 30 -7.949 -21.689 -1.090 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -9.738 -21.677 1.006 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -8.263 -22.616 1.126 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -8.872 -19.894 2.262 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -8.045 -21.242 3.018 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -6.698 -19.121 1.911 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -6.003 -20.727 2.007 1.00 0.00 H new ATOM 389 N LYS A 31 -10.202 -20.573 -1.506 1.00 0.00 N ATOM 390 CA LYS A 31 -11.264 -19.768 -2.098 1.00 0.00 C ATOM 391 C LYS A 31 -12.426 -19.602 -1.124 1.00 0.00 C ATOM 392 O LYS A 31 -12.505 -20.298 -0.112 1.00 0.00 O ATOM 393 CB LYS A 31 -11.759 -20.412 -3.395 1.00 0.00 C ATOM 394 CG LYS A 31 -12.399 -21.777 -3.190 1.00 0.00 C ATOM 395 CD LYS A 31 -12.168 -22.687 -4.386 1.00 0.00 C ATOM 396 CE LYS A 31 -13.431 -22.849 -5.217 1.00 0.00 C ATOM 397 NZ LYS A 31 -13.913 -21.547 -5.757 1.00 0.00 N ATOM 0 H LYS A 31 -10.315 -21.579 -1.630 1.00 0.00 H new ATOM 0 HA LYS A 31 -10.857 -18.782 -2.323 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -12.482 -19.748 -3.868 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -10.921 -20.513 -4.084 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -11.988 -22.241 -2.294 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -13.470 -21.657 -3.025 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -11.372 -22.277 -5.008 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -11.831 -23.664 -4.041 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -13.237 -23.534 -6.042 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -14.212 -23.300 -4.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -14.703 -21.714 -6.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -14.234 -20.944 -4.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -13.138 -21.073 -6.263 1.00 0.00 H new ATOM 411 N SER A 32 -13.325 -18.673 -1.436 1.00 0.00 N ATOM 412 CA SER A 32 -14.482 -18.416 -0.588 1.00 0.00 C ATOM 413 C SER A 32 -15.767 -18.878 -1.267 1.00 0.00 C ATOM 414 O SER A 32 -15.934 -18.721 -2.476 1.00 0.00 O ATOM 415 CB SER A 32 -14.575 -16.925 -0.257 1.00 0.00 C ATOM 416 OG SER A 32 -13.594 -16.552 0.695 1.00 0.00 O ATOM 0 H SER A 32 -13.274 -18.087 -2.269 1.00 0.00 H new ATOM 0 HA SER A 32 -14.357 -18.980 0.336 1.00 0.00 H new ATOM 0 HB2 SER A 32 -14.445 -16.339 -1.167 1.00 0.00 H new ATOM 0 HB3 SER A 32 -15.568 -16.697 0.131 1.00 0.00 H new ATOM 0 HG SER A 32 -14.004 -16.499 1.584 1.00 0.00 H new ATOM 422 N ASP A 33 -16.674 -19.449 -0.479 1.00 0.00 N ATOM 423 CA ASP A 33 -17.945 -19.934 -1.004 1.00 0.00 C ATOM 424 C ASP A 33 -18.824 -18.773 -1.459 1.00 0.00 C ATOM 425 O ASP A 33 -19.383 -18.046 -0.639 1.00 0.00 O ATOM 426 CB ASP A 33 -18.677 -20.760 0.057 1.00 0.00 C ATOM 427 CG ASP A 33 -18.436 -22.247 -0.101 1.00 0.00 C ATOM 428 OD1 ASP A 33 -18.348 -22.716 -1.256 1.00 0.00 O ATOM 429 OD2 ASP A 33 -18.337 -22.946 0.930 1.00 0.00 O ATOM 0 H ASP A 33 -16.552 -19.587 0.524 1.00 0.00 H new ATOM 0 HA ASP A 33 -17.736 -20.567 -1.866 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -18.350 -20.445 1.048 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -19.747 -20.560 -0.005 1.00 0.00 H new ATOM 434 N LEU A 34 -18.938 -18.604 -2.772 1.00 0.00 N ATOM 435 CA LEU A 34 -19.747 -17.531 -3.338 1.00 0.00 C ATOM 436 C LEU A 34 -21.234 -17.851 -3.225 1.00 0.00 C ATOM 437 O LEU A 34 -22.064 -16.952 -3.089 1.00 0.00 O ATOM 438 CB LEU A 34 -19.373 -17.300 -4.803 1.00 0.00 C ATOM 439 CG LEU A 34 -18.193 -16.354 -5.030 1.00 0.00 C ATOM 440 CD1 LEU A 34 -17.754 -16.386 -6.485 1.00 0.00 C ATOM 441 CD2 LEU A 34 -18.558 -14.938 -4.612 1.00 0.00 C ATOM 0 H LEU A 34 -18.480 -19.197 -3.464 1.00 0.00 H new ATOM 0 HA LEU A 34 -19.546 -16.622 -2.771 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -19.140 -18.262 -5.258 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -20.243 -16.903 -5.326 1.00 0.00 H new ATOM 0 HG LEU A 34 -17.359 -16.690 -4.414 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -16.914 -15.707 -6.626 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -17.451 -17.399 -6.751 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -18.582 -16.076 -7.122 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -17.707 -14.278 -4.780 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -19.407 -14.592 -5.201 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -18.822 -14.927 -3.554 1.00 0.00 H new ATOM 453 N ASN A 35 -21.563 -19.138 -3.280 1.00 0.00 N ATOM 454 CA ASN A 35 -22.951 -19.576 -3.184 1.00 0.00 C ATOM 455 C ASN A 35 -23.480 -19.399 -1.764 1.00 0.00 C ATOM 456 O ASN A 35 -24.661 -19.118 -1.562 1.00 0.00 O ATOM 457 CB ASN A 35 -23.076 -21.040 -3.608 1.00 0.00 C ATOM 458 CG ASN A 35 -24.481 -21.394 -4.055 1.00 0.00 C ATOM 459 OD1 ASN A 35 -24.780 -21.412 -5.249 1.00 0.00 O ATOM 460 ND2 ASN A 35 -25.353 -21.678 -3.094 1.00 0.00 N ATOM 0 H ASN A 35 -20.888 -19.895 -3.390 1.00 0.00 H new ATOM 0 HA ASN A 35 -23.548 -18.958 -3.855 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -22.378 -21.241 -4.420 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -22.790 -21.682 -2.775 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -26.314 -21.923 -3.333 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -25.062 -21.651 -2.117 1.00 0.00 H new ATOM 467 N GLU A 36 -22.597 -19.564 -0.785 1.00 0.00 N ATOM 468 CA GLU A 36 -22.974 -19.423 0.616 1.00 0.00 C ATOM 469 C GLU A 36 -23.249 -17.963 0.962 1.00 0.00 C ATOM 470 O GLU A 36 -24.321 -17.624 1.463 1.00 0.00 O ATOM 471 CB GLU A 36 -21.871 -19.975 1.521 1.00 0.00 C ATOM 472 CG GLU A 36 -22.309 -20.172 2.964 1.00 0.00 C ATOM 473 CD GLU A 36 -21.216 -19.830 3.957 1.00 0.00 C ATOM 474 OE1 GLU A 36 -20.026 -19.973 3.603 1.00 0.00 O ATOM 475 OE2 GLU A 36 -21.548 -19.419 5.089 1.00 0.00 O ATOM 0 H GLU A 36 -21.615 -19.796 -0.936 1.00 0.00 H new ATOM 0 HA GLU A 36 -23.888 -19.994 0.779 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -21.528 -20.929 1.121 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -21.020 -19.295 1.498 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -23.182 -19.551 3.163 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -22.615 -21.208 3.109 1.00 0.00 H new ATOM 482 N VAL A 37 -22.272 -17.103 0.691 1.00 0.00 N ATOM 483 CA VAL A 37 -22.406 -15.680 0.972 1.00 0.00 C ATOM 484 C VAL A 37 -23.589 -15.076 0.220 1.00 0.00 C ATOM 485 O VAL A 37 -24.174 -14.085 0.657 1.00 0.00 O ATOM 486 CB VAL A 37 -21.127 -14.909 0.594 1.00 0.00 C ATOM 487 CG1 VAL A 37 -19.976 -15.306 1.505 1.00 0.00 C ATOM 488 CG2 VAL A 37 -20.770 -15.150 -0.865 1.00 0.00 C ATOM 0 H VAL A 37 -21.378 -17.368 0.277 1.00 0.00 H new ATOM 0 HA VAL A 37 -22.576 -15.587 2.045 1.00 0.00 H new ATOM 0 HB VAL A 37 -21.314 -13.843 0.727 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -19.081 -14.751 1.223 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -20.234 -15.077 2.539 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -19.786 -16.375 1.407 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -19.864 -14.597 -1.114 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -20.602 -16.215 -1.027 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -21.588 -14.811 -1.501 1.00 0.00 H new ATOM 498 N LYS A 38 -23.934 -15.679 -0.915 1.00 0.00 N ATOM 499 CA LYS A 38 -25.046 -15.199 -1.729 1.00 0.00 C ATOM 500 C LYS A 38 -26.338 -15.150 -0.917 1.00 0.00 C ATOM 501 O LYS A 38 -26.972 -14.101 -0.804 1.00 0.00 O ATOM 502 CB LYS A 38 -25.232 -16.097 -2.953 1.00 0.00 C ATOM 503 CG LYS A 38 -24.626 -15.525 -4.224 1.00 0.00 C ATOM 504 CD LYS A 38 -25.263 -16.125 -5.468 1.00 0.00 C ATOM 505 CE LYS A 38 -25.792 -15.048 -6.401 1.00 0.00 C ATOM 506 NZ LYS A 38 -26.772 -15.592 -7.381 1.00 0.00 N ATOM 0 H LYS A 38 -23.460 -16.500 -1.291 1.00 0.00 H new ATOM 0 HA LYS A 38 -24.810 -14.188 -2.060 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -24.783 -17.069 -2.752 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -26.297 -16.265 -3.112 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -24.755 -14.443 -4.234 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -23.553 -15.718 -4.235 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -24.529 -16.735 -5.995 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -26.078 -16.787 -5.177 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -26.265 -14.260 -5.814 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -24.960 -14.591 -6.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -27.108 -14.825 -7.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -26.314 -16.326 -7.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -27.579 -16.005 -6.872 1.00 0.00 H new ATOM 520 N GLU A 39 -26.722 -16.291 -0.353 1.00 0.00 N ATOM 521 CA GLU A 39 -27.937 -16.377 0.447 1.00 0.00 C ATOM 522 C GLU A 39 -27.882 -15.415 1.630 1.00 0.00 C ATOM 523 O GLU A 39 -28.911 -14.909 2.080 1.00 0.00 O ATOM 524 CB GLU A 39 -28.144 -17.809 0.947 1.00 0.00 C ATOM 525 CG GLU A 39 -29.035 -18.645 0.042 1.00 0.00 C ATOM 526 CD GLU A 39 -28.471 -20.028 -0.216 1.00 0.00 C ATOM 527 OE1 GLU A 39 -27.543 -20.146 -1.044 1.00 0.00 O ATOM 528 OE2 GLU A 39 -28.956 -20.994 0.409 1.00 0.00 O ATOM 0 H GLU A 39 -26.209 -17.169 -0.436 1.00 0.00 H new ATOM 0 HA GLU A 39 -28.778 -16.095 -0.186 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -27.174 -18.297 1.039 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -28.581 -17.777 1.945 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -30.022 -18.738 0.495 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -29.168 -18.128 -0.908 1.00 0.00 H new ATOM 535 N LEU A 40 -26.676 -15.166 2.129 1.00 0.00 N ATOM 536 CA LEU A 40 -26.489 -14.264 3.260 1.00 0.00 C ATOM 537 C LEU A 40 -26.903 -12.842 2.896 1.00 0.00 C ATOM 538 O LEU A 40 -27.359 -12.081 3.749 1.00 0.00 O ATOM 539 CB LEU A 40 -25.028 -14.283 3.717 1.00 0.00 C ATOM 540 CG LEU A 40 -24.715 -15.267 4.845 1.00 0.00 C ATOM 541 CD1 LEU A 40 -23.213 -15.376 5.057 1.00 0.00 C ATOM 542 CD2 LEU A 40 -25.407 -14.839 6.131 1.00 0.00 C ATOM 0 H LEU A 40 -25.814 -15.576 1.769 1.00 0.00 H new ATOM 0 HA LEU A 40 -27.123 -14.609 4.077 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -24.398 -14.524 2.860 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -24.752 -13.280 4.043 1.00 0.00 H new ATOM 0 HG LEU A 40 -25.093 -16.249 4.561 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -23.010 -16.081 5.863 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -22.741 -15.728 4.140 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -22.811 -14.398 5.320 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -25.174 -15.550 6.924 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -25.058 -13.847 6.419 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -26.485 -14.813 5.973 1.00 0.00 H new ATOM 554 N LEU A 41 -26.740 -12.490 1.625 1.00 0.00 N ATOM 555 CA LEU A 41 -27.097 -11.158 1.149 1.00 0.00 C ATOM 556 C LEU A 41 -28.608 -10.953 1.181 1.00 0.00 C ATOM 557 O LEU A 41 -29.099 -9.971 1.736 1.00 0.00 O ATOM 558 CB LEU A 41 -26.570 -10.943 -0.271 1.00 0.00 C ATOM 559 CG LEU A 41 -25.055 -11.078 -0.427 1.00 0.00 C ATOM 560 CD1 LEU A 41 -24.641 -10.814 -1.866 1.00 0.00 C ATOM 561 CD2 LEU A 41 -24.337 -10.127 0.519 1.00 0.00 C ATOM 0 H LEU A 41 -26.363 -13.108 0.906 1.00 0.00 H new ATOM 0 HA LEU A 41 -26.637 -10.427 1.814 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -27.053 -11.661 -0.934 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -26.867 -9.949 -0.606 1.00 0.00 H new ATOM 0 HG LEU A 41 -24.771 -12.099 -0.171 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -23.560 -10.915 -1.958 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -25.129 -11.534 -2.523 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -24.937 -9.804 -2.150 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -23.259 -10.236 0.395 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -24.627 -9.101 0.292 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -24.610 -10.362 1.548 1.00 0.00 H new ATOM 573 N LYS A 42 -29.339 -11.887 0.584 1.00 0.00 N ATOM 574 CA LYS A 42 -30.796 -11.809 0.545 1.00 0.00 C ATOM 575 C LYS A 42 -31.381 -11.775 1.955 1.00 0.00 C ATOM 576 O LYS A 42 -32.472 -11.248 2.172 1.00 0.00 O ATOM 577 CB LYS A 42 -31.372 -12.996 -0.228 1.00 0.00 C ATOM 578 CG LYS A 42 -30.910 -13.060 -1.676 1.00 0.00 C ATOM 579 CD LYS A 42 -29.998 -14.251 -1.922 1.00 0.00 C ATOM 580 CE LYS A 42 -29.452 -14.252 -3.340 1.00 0.00 C ATOM 581 NZ LYS A 42 -30.334 -15.004 -4.274 1.00 0.00 N ATOM 0 H LYS A 42 -28.948 -12.707 0.120 1.00 0.00 H new ATOM 0 HA LYS A 42 -31.069 -10.885 0.036 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -31.089 -13.920 0.276 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -32.460 -12.941 -0.204 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -31.778 -13.124 -2.333 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -30.384 -12.140 -1.931 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -29.171 -14.229 -1.213 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -30.548 -15.175 -1.742 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -29.346 -13.225 -3.689 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -28.456 -14.695 -3.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -29.927 -14.981 -5.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -30.415 -15.991 -3.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -31.277 -14.566 -4.289 1.00 0.00 H new ATOM 595 N THR A 43 -30.648 -12.341 2.910 1.00 0.00 N ATOM 596 CA THR A 43 -31.098 -12.375 4.296 1.00 0.00 C ATOM 597 C THR A 43 -30.789 -11.059 5.004 1.00 0.00 C ATOM 598 O THR A 43 -31.539 -10.621 5.875 1.00 0.00 O ATOM 599 CB THR A 43 -30.434 -13.535 5.041 1.00 0.00 C ATOM 600 OG1 THR A 43 -29.100 -13.718 4.597 1.00 0.00 O ATOM 601 CG2 THR A 43 -31.160 -14.852 4.867 1.00 0.00 C ATOM 0 H THR A 43 -29.742 -12.781 2.749 1.00 0.00 H new ATOM 0 HA THR A 43 -32.178 -12.521 4.296 1.00 0.00 H new ATOM 0 HB THR A 43 -30.466 -13.258 6.095 1.00 0.00 H new ATOM 0 HG1 THR A 43 -28.620 -12.865 4.642 1.00 0.00 H new ATOM 0 HG21 THR A 43 -30.637 -15.632 5.421 1.00 0.00 H new ATOM 0 HG22 THR A 43 -32.178 -14.759 5.245 1.00 0.00 H new ATOM 0 HG23 THR A 43 -31.189 -15.115 3.810 1.00 0.00 H new ATOM 609 N ASN A 44 -29.678 -10.436 4.624 1.00 0.00 N ATOM 610 CA ASN A 44 -29.270 -9.171 5.223 1.00 0.00 C ATOM 611 C ASN A 44 -29.603 -7.999 4.305 1.00 0.00 C ATOM 612 O ASN A 44 -30.068 -8.191 3.180 1.00 0.00 O ATOM 613 CB ASN A 44 -27.771 -9.187 5.524 1.00 0.00 C ATOM 614 CG ASN A 44 -27.435 -10.027 6.741 1.00 0.00 C ATOM 615 OD1 ASN A 44 -26.692 -11.004 6.648 1.00 0.00 O ATOM 616 ND2 ASN A 44 -27.982 -9.649 7.890 1.00 0.00 N ATOM 0 H ASN A 44 -29.045 -10.786 3.905 1.00 0.00 H new ATOM 0 HA ASN A 44 -29.821 -9.045 6.155 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -27.233 -9.575 4.659 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -27.424 -8.166 5.684 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -27.792 -10.175 8.743 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -28.592 -8.832 7.920 1.00 0.00 H new ATOM 623 N LYS A 45 -29.364 -6.786 4.792 1.00 0.00 N ATOM 624 CA LYS A 45 -29.639 -5.582 4.016 1.00 0.00 C ATOM 625 C LYS A 45 -28.423 -4.663 3.992 1.00 0.00 C ATOM 626 O LYS A 45 -27.999 -4.205 2.931 1.00 0.00 O ATOM 627 CB LYS A 45 -30.844 -4.839 4.596 1.00 0.00 C ATOM 628 CG LYS A 45 -32.181 -5.379 4.115 1.00 0.00 C ATOM 629 CD LYS A 45 -33.173 -4.258 3.851 1.00 0.00 C ATOM 630 CE LYS A 45 -34.324 -4.727 2.975 1.00 0.00 C ATOM 631 NZ LYS A 45 -34.663 -3.728 1.922 1.00 0.00 N ATOM 0 H LYS A 45 -28.980 -6.610 5.721 1.00 0.00 H new ATOM 0 HA LYS A 45 -29.866 -5.883 2.993 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -30.808 -4.898 5.684 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -30.771 -3.784 4.332 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -32.034 -5.958 3.203 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -32.590 -6.059 4.862 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -33.564 -3.886 4.798 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -32.662 -3.425 3.367 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -34.060 -5.675 2.505 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -35.201 -4.912 3.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -35.452 -4.085 1.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -34.939 -2.831 2.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -33.834 -3.570 1.314 1.00 0.00 H new ATOM 645 N LYS A 46 -27.866 -4.396 5.168 1.00 0.00 N ATOM 646 CA LYS A 46 -26.698 -3.530 5.282 1.00 0.00 C ATOM 647 C LYS A 46 -25.524 -4.094 4.487 1.00 0.00 C ATOM 648 O LYS A 46 -24.781 -3.351 3.847 1.00 0.00 O ATOM 649 CB LYS A 46 -26.302 -3.362 6.749 1.00 0.00 C ATOM 650 CG LYS A 46 -26.983 -2.186 7.433 1.00 0.00 C ATOM 651 CD LYS A 46 -27.649 -2.604 8.735 1.00 0.00 C ATOM 652 CE LYS A 46 -28.066 -1.398 9.561 1.00 0.00 C ATOM 653 NZ LYS A 46 -29.380 -1.608 10.228 1.00 0.00 N ATOM 0 H LYS A 46 -28.204 -4.767 6.056 1.00 0.00 H new ATOM 0 HA LYS A 46 -26.958 -2.555 4.870 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -26.546 -4.277 7.289 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -25.222 -3.233 6.812 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -26.249 -1.406 7.634 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -27.729 -1.757 6.764 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -28.524 -3.217 8.517 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -26.963 -3.223 9.313 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -27.305 -1.194 10.314 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -28.122 -0.520 8.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -29.628 -0.763 10.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -30.111 -1.778 9.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -29.320 -2.431 10.861 1.00 0.00 H new ATOM 667 N LEU A 47 -25.366 -5.412 4.533 1.00 0.00 N ATOM 668 CA LEU A 47 -24.283 -6.077 3.816 1.00 0.00 C ATOM 669 C LEU A 47 -24.594 -6.166 2.325 1.00 0.00 C ATOM 670 O LEU A 47 -23.689 -6.143 1.491 1.00 0.00 O ATOM 671 CB LEU A 47 -24.052 -7.479 4.384 1.00 0.00 C ATOM 672 CG LEU A 47 -23.359 -7.519 5.747 1.00 0.00 C ATOM 673 CD1 LEU A 47 -23.288 -8.946 6.267 1.00 0.00 C ATOM 674 CD2 LEU A 47 -21.966 -6.914 5.653 1.00 0.00 C ATOM 0 H LEU A 47 -25.973 -6.041 5.058 1.00 0.00 H new ATOM 0 HA LEU A 47 -23.377 -5.486 3.947 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -25.014 -7.984 4.468 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -23.454 -8.049 3.673 1.00 0.00 H new ATOM 0 HG LEU A 47 -23.945 -6.927 6.450 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -22.792 -8.955 7.238 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -24.297 -9.346 6.371 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -22.724 -9.561 5.566 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -21.487 -6.950 6.631 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -21.371 -7.480 4.936 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -22.041 -5.878 5.324 1.00 0.00 H new ATOM 686 N ALA A 48 -25.878 -6.266 1.997 1.00 0.00 N ATOM 687 CA ALA A 48 -26.307 -6.357 0.608 1.00 0.00 C ATOM 688 C ALA A 48 -26.141 -5.021 -0.108 1.00 0.00 C ATOM 689 O ALA A 48 -25.780 -4.975 -1.283 1.00 0.00 O ATOM 690 CB ALA A 48 -27.754 -6.822 0.533 1.00 0.00 C ATOM 0 H ALA A 48 -26.639 -6.286 2.675 1.00 0.00 H new ATOM 0 HA ALA A 48 -25.674 -7.089 0.106 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -28.062 -6.886 -0.511 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -27.845 -7.803 0.999 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -28.392 -6.111 1.057 1.00 0.00 H new ATOM 696 N LYS A 49 -26.408 -3.934 0.610 1.00 0.00 N ATOM 697 CA LYS A 49 -26.287 -2.596 0.044 1.00 0.00 C ATOM 698 C LYS A 49 -24.844 -2.106 0.107 1.00 0.00 C ATOM 699 O LYS A 49 -24.399 -1.344 -0.752 1.00 0.00 O ATOM 700 CB LYS A 49 -27.203 -1.620 0.785 1.00 0.00 C ATOM 701 CG LYS A 49 -28.585 -1.491 0.163 1.00 0.00 C ATOM 702 CD LYS A 49 -29.670 -2.008 1.096 1.00 0.00 C ATOM 703 CE LYS A 49 -30.304 -0.879 1.892 1.00 0.00 C ATOM 704 NZ LYS A 49 -30.820 0.202 1.008 1.00 0.00 N ATOM 0 H LYS A 49 -26.709 -3.954 1.584 1.00 0.00 H new ATOM 0 HA LYS A 49 -26.590 -2.643 -1.002 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -27.308 -1.947 1.819 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -26.731 -0.638 0.808 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -28.780 -0.446 -0.079 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -28.616 -2.046 -0.775 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -30.437 -2.521 0.515 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -29.244 -2.742 1.780 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -31.120 -1.275 2.496 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -29.569 -0.464 2.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -31.594 0.703 1.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -30.053 0.872 0.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -31.174 -0.213 0.122 1.00 0.00 H new ATOM 718 N MET A 50 -24.118 -2.548 1.129 1.00 0.00 N ATOM 719 CA MET A 50 -22.726 -2.154 1.305 1.00 0.00 C ATOM 720 C MET A 50 -21.854 -2.721 0.188 1.00 0.00 C ATOM 721 O MET A 50 -21.334 -1.978 -0.645 1.00 0.00 O ATOM 722 CB MET A 50 -22.207 -2.629 2.662 1.00 0.00 C ATOM 723 CG MET A 50 -20.794 -2.160 2.972 1.00 0.00 C ATOM 724 SD MET A 50 -19.844 -3.383 3.897 1.00 0.00 S ATOM 725 CE MET A 50 -18.191 -2.712 3.747 1.00 0.00 C ATOM 0 H MET A 50 -24.471 -3.179 1.848 1.00 0.00 H new ATOM 0 HA MET A 50 -22.675 -1.066 1.265 1.00 0.00 H new ATOM 0 HB2 MET A 50 -22.879 -2.273 3.443 1.00 0.00 H new ATOM 0 HB3 MET A 50 -22.234 -3.718 2.691 1.00 0.00 H new ATOM 0 HG2 MET A 50 -20.277 -1.934 2.039 1.00 0.00 H new ATOM 0 HG3 MET A 50 -20.840 -1.233 3.544 1.00 0.00 H new ATOM 0 HE1 MET A 50 -17.487 -3.359 4.270 1.00 0.00 H new ATOM 0 HE2 MET A 50 -17.917 -2.653 2.694 1.00 0.00 H new ATOM 0 HE3 MET A 50 -18.162 -1.715 4.186 1.00 0.00 H new ATOM 735 N ILE A 51 -21.698 -4.040 0.178 1.00 0.00 N ATOM 736 CA ILE A 51 -20.889 -4.706 -0.836 1.00 0.00 C ATOM 737 C ILE A 51 -21.600 -5.938 -1.387 1.00 0.00 C ATOM 738 O ILE A 51 -20.963 -6.941 -1.713 1.00 0.00 O ATOM 739 CB ILE A 51 -19.518 -5.126 -0.272 1.00 0.00 C ATOM 740 CG1 ILE A 51 -19.691 -5.854 1.061 1.00 0.00 C ATOM 741 CG2 ILE A 51 -18.618 -3.911 -0.107 1.00 0.00 C ATOM 742 CD1 ILE A 51 -18.742 -7.018 1.243 1.00 0.00 C ATOM 0 H ILE A 51 -22.121 -4.669 0.860 1.00 0.00 H new ATOM 0 HA ILE A 51 -20.738 -3.988 -1.642 1.00 0.00 H new ATOM 0 HB ILE A 51 -19.046 -5.809 -0.978 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -19.543 -5.144 1.875 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -20.716 -6.216 1.137 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -17.653 -4.224 0.292 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -18.472 -3.432 -1.075 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -19.083 -3.204 0.580 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -18.922 -7.487 2.211 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -18.905 -7.748 0.450 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -17.714 -6.659 1.200 1.00 0.00 H new ATOM 754 N GLY A 52 -22.922 -5.857 -1.488 1.00 0.00 N ATOM 755 CA GLY A 52 -23.697 -6.971 -2.000 1.00 0.00 C ATOM 756 C GLY A 52 -23.771 -6.980 -3.514 1.00 0.00 C ATOM 757 O GLY A 52 -23.638 -8.030 -4.143 1.00 0.00 O ATOM 0 H GLY A 52 -23.471 -5.039 -1.224 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -23.255 -7.906 -1.656 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -24.706 -6.926 -1.590 1.00 0.00 H new ATOM 761 N HIS A 53 -23.984 -5.807 -4.101 1.00 0.00 N ATOM 762 CA HIS A 53 -24.076 -5.682 -5.551 1.00 0.00 C ATOM 763 C HIS A 53 -22.796 -6.167 -6.224 1.00 0.00 C ATOM 764 O HIS A 53 -22.820 -6.623 -7.367 1.00 0.00 O ATOM 765 CB HIS A 53 -24.353 -4.229 -5.942 1.00 0.00 C ATOM 766 CG HIS A 53 -23.316 -3.269 -5.450 1.00 0.00 C ATOM 767 ND1 HIS A 53 -23.473 -2.511 -4.307 1.00 0.00 N ATOM 768 CD2 HIS A 53 -22.099 -2.943 -5.950 1.00 0.00 C ATOM 769 CE1 HIS A 53 -22.400 -1.761 -4.128 1.00 0.00 C ATOM 770 NE2 HIS A 53 -21.552 -2.005 -5.109 1.00 0.00 N ATOM 0 H HIS A 53 -24.096 -4.929 -3.594 1.00 0.00 H new ATOM 0 HA HIS A 53 -24.902 -6.307 -5.892 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -24.415 -4.159 -7.028 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -25.325 -3.934 -5.548 1.00 0.00 H new ATOM 0 HD1 HIS A 53 -24.290 -2.527 -3.696 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -21.644 -3.346 -6.843 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -22.244 -1.066 -3.316 1.00 0.00 H new ATOM 779 N ILE A 54 -21.679 -6.066 -5.510 1.00 0.00 N ATOM 780 CA ILE A 54 -20.391 -6.496 -6.041 1.00 0.00 C ATOM 781 C ILE A 54 -20.333 -8.014 -6.173 1.00 0.00 C ATOM 782 O ILE A 54 -19.704 -8.543 -7.089 1.00 0.00 O ATOM 783 CB ILE A 54 -19.226 -6.023 -5.149 1.00 0.00 C ATOM 784 CG1 ILE A 54 -19.336 -4.521 -4.880 1.00 0.00 C ATOM 785 CG2 ILE A 54 -17.890 -6.352 -5.800 1.00 0.00 C ATOM 786 CD1 ILE A 54 -18.546 -4.065 -3.673 1.00 0.00 C ATOM 0 H ILE A 54 -21.640 -5.690 -4.563 1.00 0.00 H new ATOM 0 HA ILE A 54 -20.288 -6.043 -7.027 1.00 0.00 H new ATOM 0 HB ILE A 54 -19.283 -6.549 -4.196 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -18.989 -3.976 -5.758 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -20.385 -4.261 -4.737 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -17.078 -6.011 -5.157 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -17.811 -7.430 -5.944 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -17.823 -5.851 -6.766 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -18.670 -2.990 -3.542 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -18.908 -4.583 -2.785 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -17.491 -4.293 -3.822 1.00 0.00 H new ATOM 798 N PHE A 55 -20.992 -8.709 -5.252 1.00 0.00 N ATOM 799 CA PHE A 55 -21.015 -10.167 -5.265 1.00 0.00 C ATOM 800 C PHE A 55 -21.834 -10.687 -6.442 1.00 0.00 C ATOM 801 O PHE A 55 -21.444 -11.646 -7.108 1.00 0.00 O ATOM 802 CB PHE A 55 -21.591 -10.701 -3.953 1.00 0.00 C ATOM 803 CG PHE A 55 -20.644 -10.589 -2.792 1.00 0.00 C ATOM 804 CD1 PHE A 55 -19.388 -11.171 -2.846 1.00 0.00 C ATOM 805 CD2 PHE A 55 -21.010 -9.899 -1.647 1.00 0.00 C ATOM 806 CE1 PHE A 55 -18.515 -11.069 -1.780 1.00 0.00 C ATOM 807 CE2 PHE A 55 -20.141 -9.794 -0.577 1.00 0.00 C ATOM 808 CZ PHE A 55 -18.892 -10.379 -0.643 1.00 0.00 C ATOM 0 H PHE A 55 -21.517 -8.286 -4.487 1.00 0.00 H new ATOM 0 HA PHE A 55 -19.990 -10.521 -5.374 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -22.506 -10.157 -3.719 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -21.868 -11.747 -4.086 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -19.088 -11.711 -3.732 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -21.985 -9.438 -1.590 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -17.539 -11.528 -1.835 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -20.439 -9.255 0.310 1.00 0.00 H new ATOM 0 HZ PHE A 55 -18.211 -10.298 0.192 1.00 0.00 H new ATOM 818 N GLU A 56 -22.973 -10.049 -6.692 1.00 0.00 N ATOM 819 CA GLU A 56 -23.849 -10.447 -7.788 1.00 0.00 C ATOM 820 C GLU A 56 -23.251 -10.050 -9.134 1.00 0.00 C ATOM 821 O GLU A 56 -23.451 -10.732 -10.138 1.00 0.00 O ATOM 822 CB GLU A 56 -25.230 -9.810 -7.623 1.00 0.00 C ATOM 823 CG GLU A 56 -25.822 -9.993 -6.234 1.00 0.00 C ATOM 824 CD GLU A 56 -27.210 -10.605 -6.266 1.00 0.00 C ATOM 825 OE1 GLU A 56 -27.351 -11.727 -6.796 1.00 0.00 O ATOM 826 OE2 GLU A 56 -28.154 -9.962 -5.762 1.00 0.00 O ATOM 0 H GLU A 56 -23.311 -9.254 -6.150 1.00 0.00 H new ATOM 0 HA GLU A 56 -23.952 -11.532 -7.762 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -25.158 -8.744 -7.841 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -25.910 -10.240 -8.358 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -25.162 -10.629 -5.643 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -25.867 -9.026 -5.732 1.00 0.00 H new ATOM 833 N MET A 57 -22.516 -8.943 -9.145 1.00 0.00 N ATOM 834 CA MET A 57 -21.889 -8.455 -10.369 1.00 0.00 C ATOM 835 C MET A 57 -20.920 -9.489 -10.933 1.00 0.00 C ATOM 836 O MET A 57 -20.720 -10.552 -10.347 1.00 0.00 O ATOM 837 CB MET A 57 -21.152 -7.141 -10.101 1.00 0.00 C ATOM 838 CG MET A 57 -21.179 -6.178 -11.277 1.00 0.00 C ATOM 839 SD MET A 57 -21.355 -4.459 -10.762 1.00 0.00 S ATOM 840 CE MET A 57 -19.670 -3.878 -10.936 1.00 0.00 C ATOM 0 H MET A 57 -22.340 -8.367 -8.322 1.00 0.00 H new ATOM 0 HA MET A 57 -22.674 -8.280 -11.105 1.00 0.00 H new ATOM 0 HB2 MET A 57 -21.598 -6.654 -9.233 1.00 0.00 H new ATOM 0 HB3 MET A 57 -20.115 -7.361 -9.846 1.00 0.00 H new ATOM 0 HG2 MET A 57 -20.260 -6.288 -11.853 1.00 0.00 H new ATOM 0 HG3 MET A 57 -22.004 -6.441 -11.939 1.00 0.00 H new ATOM 0 HE1 MET A 57 -19.599 -2.854 -10.570 1.00 0.00 H new ATOM 0 HE2 MET A 57 -19.003 -4.518 -10.358 1.00 0.00 H new ATOM 0 HE3 MET A 57 -19.381 -3.908 -11.987 1.00 0.00 H new ATOM 850 N ASN A 58 -20.320 -9.169 -12.075 1.00 0.00 N ATOM 851 CA ASN A 58 -19.372 -10.070 -12.719 1.00 0.00 C ATOM 852 C ASN A 58 -17.953 -9.812 -12.221 1.00 0.00 C ATOM 853 O ASN A 58 -17.736 -8.987 -11.334 1.00 0.00 O ATOM 854 CB ASN A 58 -19.433 -9.906 -14.239 1.00 0.00 C ATOM 855 CG ASN A 58 -19.476 -11.237 -14.962 1.00 0.00 C ATOM 856 OD1 ASN A 58 -18.608 -11.542 -15.780 1.00 0.00 O ATOM 857 ND2 ASN A 58 -20.492 -12.039 -14.665 1.00 0.00 N ATOM 0 H ASN A 58 -20.474 -8.292 -12.573 1.00 0.00 H new ATOM 0 HA ASN A 58 -19.646 -11.093 -12.461 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -20.315 -9.323 -14.504 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -18.564 -9.340 -14.576 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -20.575 -12.948 -15.121 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -21.189 -11.746 -13.981 1.00 0.00 H new ATOM 864 N ASP A 59 -16.990 -10.524 -12.799 1.00 0.00 N ATOM 865 CA ASP A 59 -15.592 -10.372 -12.414 1.00 0.00 C ATOM 866 C ASP A 59 -14.854 -9.468 -13.396 1.00 0.00 C ATOM 867 O ASP A 59 -14.041 -8.634 -12.996 1.00 0.00 O ATOM 868 CB ASP A 59 -14.907 -11.738 -12.346 1.00 0.00 C ATOM 869 CG ASP A 59 -15.436 -12.594 -11.212 1.00 0.00 C ATOM 870 OD1 ASP A 59 -15.029 -12.361 -10.054 1.00 0.00 O ATOM 871 OD2 ASP A 59 -16.256 -13.496 -11.481 1.00 0.00 O ATOM 0 H ASP A 59 -17.153 -11.211 -13.535 1.00 0.00 H new ATOM 0 HA ASP A 59 -15.561 -9.910 -11.427 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -15.052 -12.262 -13.291 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -13.833 -11.597 -12.221 1.00 0.00 H new ATOM 876 N ASP A 60 -15.142 -9.639 -14.681 1.00 0.00 N ATOM 877 CA ASP A 60 -14.506 -8.838 -15.720 1.00 0.00 C ATOM 878 C ASP A 60 -15.290 -7.553 -15.972 1.00 0.00 C ATOM 879 O ASP A 60 -15.727 -7.288 -17.092 1.00 0.00 O ATOM 880 CB ASP A 60 -14.392 -9.646 -17.015 1.00 0.00 C ATOM 881 CG ASP A 60 -13.074 -10.389 -17.119 1.00 0.00 C ATOM 882 OD1 ASP A 60 -12.739 -11.137 -16.177 1.00 0.00 O ATOM 883 OD2 ASP A 60 -12.377 -10.222 -18.143 1.00 0.00 O ATOM 0 H ASP A 60 -15.812 -10.325 -15.028 1.00 0.00 H new ATOM 0 HA ASP A 60 -13.506 -8.569 -15.379 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -15.214 -10.360 -17.068 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -14.497 -8.976 -17.868 1.00 0.00 H new ATOM 888 N ASP A 61 -15.461 -6.758 -14.921 1.00 0.00 N ATOM 889 CA ASP A 61 -16.191 -5.499 -15.026 1.00 0.00 C ATOM 890 C ASP A 61 -15.400 -4.356 -14.390 1.00 0.00 C ATOM 891 O ASP A 61 -15.135 -4.373 -13.188 1.00 0.00 O ATOM 892 CB ASP A 61 -17.558 -5.623 -14.352 1.00 0.00 C ATOM 893 CG ASP A 61 -18.638 -4.859 -15.090 1.00 0.00 C ATOM 894 OD1 ASP A 61 -19.198 -5.411 -16.061 1.00 0.00 O ATOM 895 OD2 ASP A 61 -18.925 -3.707 -14.698 1.00 0.00 O ATOM 0 H ASP A 61 -15.105 -6.963 -13.987 1.00 0.00 H new ATOM 0 HA ASP A 61 -16.332 -5.276 -16.084 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -17.837 -6.675 -14.293 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -17.490 -5.254 -13.329 1.00 0.00 H new ATOM 900 N PRO A 62 -15.010 -3.343 -15.187 1.00 0.00 N ATOM 901 CA PRO A 62 -14.248 -2.196 -14.684 1.00 0.00 C ATOM 902 C PRO A 62 -14.902 -1.554 -13.465 1.00 0.00 C ATOM 903 O PRO A 62 -14.225 -0.960 -12.626 1.00 0.00 O ATOM 904 CB PRO A 62 -14.248 -1.223 -15.865 1.00 0.00 C ATOM 905 CG PRO A 62 -14.412 -2.086 -17.066 1.00 0.00 C ATOM 906 CD PRO A 62 -15.280 -3.235 -16.633 1.00 0.00 C ATOM 0 HA PRO A 62 -13.251 -2.485 -14.352 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -15.060 -0.501 -15.783 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -13.319 -0.655 -15.910 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -14.875 -1.533 -17.884 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -13.447 -2.440 -17.427 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -16.334 -3.039 -16.831 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -15.022 -4.154 -17.159 1.00 0.00 H new ATOM 914 N HIS A 63 -16.222 -1.679 -13.374 1.00 0.00 N ATOM 915 CA HIS A 63 -16.968 -1.111 -12.257 1.00 0.00 C ATOM 916 C HIS A 63 -16.660 -1.856 -10.961 1.00 0.00 C ATOM 917 O HIS A 63 -16.690 -1.274 -9.878 1.00 0.00 O ATOM 918 CB HIS A 63 -18.469 -1.160 -12.542 1.00 0.00 C ATOM 919 CG HIS A 63 -18.937 -0.090 -13.479 1.00 0.00 C ATOM 920 ND1 HIS A 63 -20.120 0.598 -13.307 1.00 0.00 N ATOM 921 CD2 HIS A 63 -18.372 0.413 -14.602 1.00 0.00 C ATOM 922 CE1 HIS A 63 -20.263 1.475 -14.285 1.00 0.00 C ATOM 923 NE2 HIS A 63 -19.216 1.384 -15.083 1.00 0.00 N ATOM 0 H HIS A 63 -16.797 -2.168 -14.060 1.00 0.00 H new ATOM 0 HA HIS A 63 -16.661 -0.072 -12.139 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -18.719 -2.134 -12.963 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -19.012 -1.070 -11.601 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -17.432 0.108 -15.038 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -21.096 2.151 -14.410 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -19.059 1.944 -15.921 1.00 0.00 H new ATOM 932 N LYS A 64 -16.365 -3.147 -11.082 1.00 0.00 N ATOM 933 CA LYS A 64 -16.052 -3.971 -9.921 1.00 0.00 C ATOM 934 C LYS A 64 -14.835 -3.429 -9.180 1.00 0.00 C ATOM 935 O LYS A 64 -14.898 -3.155 -7.981 1.00 0.00 O ATOM 936 CB LYS A 64 -15.800 -5.418 -10.350 1.00 0.00 C ATOM 937 CG LYS A 64 -16.216 -6.443 -9.308 1.00 0.00 C ATOM 938 CD LYS A 64 -15.599 -7.803 -9.587 1.00 0.00 C ATOM 939 CE LYS A 64 -14.271 -7.971 -8.867 1.00 0.00 C ATOM 940 NZ LYS A 64 -13.381 -8.942 -9.561 1.00 0.00 N ATOM 0 H LYS A 64 -16.336 -3.644 -11.972 1.00 0.00 H new ATOM 0 HA LYS A 64 -16.907 -3.943 -9.246 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -16.341 -5.613 -11.276 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -14.740 -5.544 -10.568 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -15.913 -6.101 -8.318 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -17.302 -6.531 -9.296 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -16.287 -8.587 -9.271 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -15.450 -7.923 -10.660 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -13.771 -7.005 -8.799 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -14.452 -8.309 -7.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -12.486 -9.028 -9.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -13.847 -9.871 -9.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -13.187 -8.607 -10.526 1.00 0.00 H new ATOM 954 N GLU A 65 -13.728 -3.275 -9.900 1.00 0.00 N ATOM 955 CA GLU A 65 -12.497 -2.766 -9.310 1.00 0.00 C ATOM 956 C GLU A 65 -12.709 -1.374 -8.721 1.00 0.00 C ATOM 957 O GLU A 65 -12.068 -1.000 -7.740 1.00 0.00 O ATOM 958 CB GLU A 65 -11.383 -2.725 -10.358 1.00 0.00 C ATOM 959 CG GLU A 65 -10.479 -3.947 -10.334 1.00 0.00 C ATOM 960 CD GLU A 65 -11.133 -5.167 -10.955 1.00 0.00 C ATOM 961 OE1 GLU A 65 -11.869 -5.875 -10.237 1.00 0.00 O ATOM 962 OE2 GLU A 65 -10.906 -5.414 -12.158 1.00 0.00 O ATOM 0 H GLU A 65 -13.659 -3.496 -10.893 1.00 0.00 H new ATOM 0 HA GLU A 65 -12.205 -3.440 -8.505 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -11.830 -2.634 -11.348 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -10.778 -1.833 -10.198 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -9.556 -3.722 -10.868 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -10.204 -4.171 -9.303 1.00 0.00 H new ATOM 969 N GLU A 66 -13.614 -0.612 -9.328 1.00 0.00 N ATOM 970 CA GLU A 66 -13.912 0.738 -8.864 1.00 0.00 C ATOM 971 C GLU A 66 -14.705 0.704 -7.562 1.00 0.00 C ATOM 972 O GLU A 66 -14.594 1.608 -6.733 1.00 0.00 O ATOM 973 CB GLU A 66 -14.694 1.504 -9.932 1.00 0.00 C ATOM 974 CG GLU A 66 -13.970 1.601 -11.265 1.00 0.00 C ATOM 975 CD GLU A 66 -13.178 2.886 -11.407 1.00 0.00 C ATOM 976 OE1 GLU A 66 -12.097 2.987 -10.788 1.00 0.00 O ATOM 977 OE2 GLU A 66 -13.637 3.789 -12.135 1.00 0.00 O ATOM 0 H GLU A 66 -14.153 -0.907 -10.142 1.00 0.00 H new ATOM 0 HA GLU A 66 -12.967 1.249 -8.678 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -15.656 1.016 -10.086 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -14.901 2.510 -9.567 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -13.297 0.750 -11.371 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -14.697 1.535 -12.075 1.00 0.00 H new ATOM 984 N GLU A 67 -15.504 -0.343 -7.387 1.00 0.00 N ATOM 985 CA GLU A 67 -16.316 -0.492 -6.184 1.00 0.00 C ATOM 986 C GLU A 67 -15.499 -1.093 -5.044 1.00 0.00 C ATOM 987 O GLU A 67 -15.694 -0.748 -3.880 1.00 0.00 O ATOM 988 CB GLU A 67 -17.534 -1.372 -6.472 1.00 0.00 C ATOM 989 CG GLU A 67 -18.587 -0.691 -7.332 1.00 0.00 C ATOM 990 CD GLU A 67 -19.548 0.152 -6.518 1.00 0.00 C ATOM 991 OE1 GLU A 67 -19.120 0.713 -5.486 1.00 0.00 O ATOM 992 OE2 GLU A 67 -20.730 0.253 -6.911 1.00 0.00 O ATOM 0 H GLU A 67 -15.607 -1.101 -8.062 1.00 0.00 H new ATOM 0 HA GLU A 67 -16.654 0.499 -5.880 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -17.204 -2.283 -6.970 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -17.987 -1.672 -5.527 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -18.094 -0.061 -8.072 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -19.148 -1.448 -7.880 1.00 0.00 H new ATOM 999 N ILE A 68 -14.584 -1.994 -5.389 1.00 0.00 N ATOM 1000 CA ILE A 68 -13.740 -2.643 -4.394 1.00 0.00 C ATOM 1001 C ILE A 68 -12.606 -1.723 -3.952 1.00 0.00 C ATOM 1002 O ILE A 68 -12.316 -1.607 -2.762 1.00 0.00 O ATOM 1003 CB ILE A 68 -13.140 -3.956 -4.935 1.00 0.00 C ATOM 1004 CG1 ILE A 68 -14.239 -4.840 -5.528 1.00 0.00 C ATOM 1005 CG2 ILE A 68 -12.398 -4.696 -3.831 1.00 0.00 C ATOM 1006 CD1 ILE A 68 -13.731 -5.832 -6.550 1.00 0.00 C ATOM 0 H ILE A 68 -14.409 -2.290 -6.349 1.00 0.00 H new ATOM 0 HA ILE A 68 -14.376 -2.869 -3.538 1.00 0.00 H new ATOM 0 HB ILE A 68 -12.429 -3.713 -5.725 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -14.733 -5.382 -4.721 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -14.993 -4.205 -5.993 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -11.981 -5.621 -4.230 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -11.592 -4.068 -3.450 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -13.089 -4.930 -3.021 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -14.564 -6.424 -6.928 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -13.263 -5.296 -7.376 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -12.999 -6.491 -6.084 1.00 0.00 H new ATOM 1018 N ARG A 69 -11.968 -1.072 -4.920 1.00 0.00 N ATOM 1019 CA ARG A 69 -10.866 -0.162 -4.630 1.00 0.00 C ATOM 1020 C ARG A 69 -11.321 0.976 -3.722 1.00 0.00 C ATOM 1021 O ARG A 69 -10.549 1.480 -2.907 1.00 0.00 O ATOM 1022 CB ARG A 69 -10.291 0.406 -5.928 1.00 0.00 C ATOM 1023 CG ARG A 69 -9.376 -0.561 -6.663 1.00 0.00 C ATOM 1024 CD ARG A 69 -9.233 -0.191 -8.131 1.00 0.00 C ATOM 1025 NE ARG A 69 -7.838 -0.198 -8.564 1.00 0.00 N ATOM 1026 CZ ARG A 69 -7.156 -1.305 -8.846 1.00 0.00 C ATOM 1027 NH1 ARG A 69 -7.735 -2.495 -8.745 1.00 0.00 N ATOM 1028 NH2 ARG A 69 -5.889 -1.223 -9.231 1.00 0.00 N ATOM 0 H ARG A 69 -12.195 -1.158 -5.911 1.00 0.00 H new ATOM 0 HA ARG A 69 -10.090 -0.727 -4.112 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -11.112 0.688 -6.587 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -9.737 1.317 -5.702 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -8.394 -0.564 -6.191 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -9.773 -1.573 -6.579 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -9.805 -0.892 -8.739 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -9.660 0.798 -8.299 1.00 0.00 H new ATOM 0 HE ARG A 69 -7.359 0.698 -8.655 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -8.709 -2.565 -8.450 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -7.206 -3.340 -8.963 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -5.438 -0.312 -9.311 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -5.366 -2.071 -9.447 1.00 0.00 H new ATOM 1042 N LYS A 70 -12.580 1.375 -3.870 1.00 0.00 N ATOM 1043 CA LYS A 70 -13.139 2.454 -3.064 1.00 0.00 C ATOM 1044 C LYS A 70 -13.520 1.955 -1.674 1.00 0.00 C ATOM 1045 O LYS A 70 -13.268 2.623 -0.672 1.00 0.00 O ATOM 1046 CB LYS A 70 -14.363 3.057 -3.759 1.00 0.00 C ATOM 1047 CG LYS A 70 -14.341 4.575 -3.820 1.00 0.00 C ATOM 1048 CD LYS A 70 -15.675 5.133 -4.290 1.00 0.00 C ATOM 1049 CE LYS A 70 -15.485 6.281 -5.269 1.00 0.00 C ATOM 1050 NZ LYS A 70 -14.978 7.508 -4.595 1.00 0.00 N ATOM 0 H LYS A 70 -13.232 0.968 -4.540 1.00 0.00 H new ATOM 0 HA LYS A 70 -12.376 3.225 -2.955 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -14.426 2.662 -4.773 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -15.263 2.736 -3.235 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -14.104 4.976 -2.835 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -13.550 4.902 -4.496 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -16.255 4.341 -4.764 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -16.250 5.478 -3.430 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -14.786 5.980 -6.049 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -16.434 6.501 -5.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -14.862 8.267 -5.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -15.657 7.810 -3.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -14.060 7.305 -4.149 1.00 0.00 H new ATOM 1064 N TYR A 71 -14.128 0.774 -1.621 1.00 0.00 N ATOM 1065 CA TYR A 71 -14.543 0.184 -0.354 1.00 0.00 C ATOM 1066 C TYR A 71 -13.338 -0.324 0.430 1.00 0.00 C ATOM 1067 O TYR A 71 -13.340 -0.322 1.662 1.00 0.00 O ATOM 1068 CB TYR A 71 -15.527 -0.961 -0.598 1.00 0.00 C ATOM 1069 CG TYR A 71 -16.948 -0.500 -0.833 1.00 0.00 C ATOM 1070 CD1 TYR A 71 -17.545 0.431 0.007 1.00 0.00 C ATOM 1071 CD2 TYR A 71 -17.692 -0.996 -1.896 1.00 0.00 C ATOM 1072 CE1 TYR A 71 -18.843 0.855 -0.204 1.00 0.00 C ATOM 1073 CE2 TYR A 71 -18.991 -0.577 -2.115 1.00 0.00 C ATOM 1074 CZ TYR A 71 -19.561 0.348 -1.267 1.00 0.00 C ATOM 1075 OH TYR A 71 -20.854 0.767 -1.481 1.00 0.00 O ATOM 0 H TYR A 71 -14.344 0.207 -2.441 1.00 0.00 H new ATOM 0 HA TYR A 71 -15.036 0.958 0.234 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -15.194 -1.537 -1.461 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -15.509 -1.633 0.260 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -16.985 0.830 0.840 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -17.248 -1.721 -2.562 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -19.293 1.579 0.459 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -19.556 -0.972 -2.946 1.00 0.00 H new ATOM 0 HH TYR A 71 -21.471 0.027 -1.304 1.00 0.00 H new ATOM 1085 N SER A 72 -12.310 -0.759 -0.291 1.00 0.00 N ATOM 1086 CA SER A 72 -11.098 -1.271 0.338 1.00 0.00 C ATOM 1087 C SER A 72 -10.306 -0.143 0.990 1.00 0.00 C ATOM 1088 O SER A 72 -9.298 0.315 0.450 1.00 0.00 O ATOM 1089 CB SER A 72 -10.227 -1.992 -0.694 1.00 0.00 C ATOM 1090 OG SER A 72 -10.684 -3.316 -0.910 1.00 0.00 O ATOM 0 H SER A 72 -12.292 -0.767 -1.311 1.00 0.00 H new ATOM 0 HA SER A 72 -11.392 -1.979 1.113 1.00 0.00 H new ATOM 0 HB2 SER A 72 -10.240 -1.441 -1.634 1.00 0.00 H new ATOM 0 HB3 SER A 72 -9.193 -2.012 -0.351 1.00 0.00 H new ATOM 0 HG SER A 72 -11.607 -3.294 -1.238 1.00 0.00 H new ATOM 1096 N ALA A 73 -10.767 0.302 2.155 1.00 0.00 N ATOM 1097 CA ALA A 73 -10.103 1.376 2.881 1.00 0.00 C ATOM 1098 C ALA A 73 -10.085 1.096 4.380 1.00 0.00 C ATOM 1099 O ALA A 73 -11.135 0.947 5.005 1.00 0.00 O ATOM 1100 CB ALA A 73 -10.786 2.705 2.599 1.00 0.00 C ATOM 0 H ALA A 73 -11.599 -0.066 2.616 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.071 1.430 2.535 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -10.279 3.498 3.148 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.742 2.917 1.531 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -11.828 2.653 2.916 1.00 0.00 H new ATOM 1106 N ILE A 74 -8.887 1.025 4.951 1.00 0.00 N ATOM 1107 CA ILE A 74 -8.734 0.763 6.377 1.00 0.00 C ATOM 1108 C ILE A 74 -8.194 1.987 7.106 1.00 0.00 C ATOM 1109 O ILE A 74 -8.518 2.221 8.270 1.00 0.00 O ATOM 1110 CB ILE A 74 -7.791 -0.429 6.630 1.00 0.00 C ATOM 1111 CG1 ILE A 74 -8.187 -1.617 5.752 1.00 0.00 C ATOM 1112 CG2 ILE A 74 -7.813 -0.818 8.101 1.00 0.00 C ATOM 1113 CD1 ILE A 74 -7.118 -2.682 5.657 1.00 0.00 C ATOM 0 H ILE A 74 -8.008 1.145 4.448 1.00 0.00 H new ATOM 0 HA ILE A 74 -9.725 0.522 6.763 1.00 0.00 H new ATOM 0 HB ILE A 74 -6.775 -0.132 6.368 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -9.099 -2.063 6.149 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -8.419 -1.256 4.750 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -7.142 -1.661 8.264 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -7.487 0.028 8.706 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -8.826 -1.100 8.388 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -7.468 -3.493 5.019 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -6.212 -2.251 5.232 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -6.902 -3.071 6.652 1.00 0.00 H new ATOM 1125 N TYR A 75 -7.366 2.766 6.417 1.00 0.00 N ATOM 1126 CA TYR A 75 -6.781 3.968 7.001 1.00 0.00 C ATOM 1127 C TYR A 75 -7.189 5.210 6.217 1.00 0.00 C ATOM 1128 O TYR A 75 -7.879 6.087 6.740 1.00 0.00 O ATOM 1129 CB TYR A 75 -5.256 3.850 7.037 1.00 0.00 C ATOM 1130 CG TYR A 75 -4.757 2.685 7.861 1.00 0.00 C ATOM 1131 CD1 TYR A 75 -5.209 2.483 9.159 1.00 0.00 C ATOM 1132 CD2 TYR A 75 -3.833 1.787 7.342 1.00 0.00 C ATOM 1133 CE1 TYR A 75 -4.757 1.419 9.916 1.00 0.00 C ATOM 1134 CE2 TYR A 75 -3.374 0.720 8.092 1.00 0.00 C ATOM 1135 CZ TYR A 75 -3.839 0.541 9.378 1.00 0.00 C ATOM 1136 OH TYR A 75 -3.385 -0.519 10.128 1.00 0.00 O ATOM 0 H TYR A 75 -7.085 2.586 5.453 1.00 0.00 H new ATOM 0 HA TYR A 75 -7.156 4.067 8.020 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -4.884 3.749 6.018 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -4.838 4.773 7.438 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -5.926 3.170 9.584 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -3.467 1.925 6.335 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -5.120 1.276 10.923 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -2.656 0.031 7.673 1.00 0.00 H new ATOM 0 HH TYR A 75 -4.131 -1.122 10.328 1.00 0.00 H new ATOM 1347 N LEU A 88 -2.654 9.470 6.058 1.00 0.00 N ATOM 1348 CA LEU A 88 -1.680 8.631 5.369 1.00 0.00 C ATOM 1349 C LEU A 88 -0.299 9.280 5.384 1.00 0.00 C ATOM 1350 O LEU A 88 -0.158 10.468 5.098 1.00 0.00 O ATOM 1351 CB LEU A 88 -2.122 8.378 3.927 1.00 0.00 C ATOM 1352 CG LEU A 88 -3.516 7.767 3.775 1.00 0.00 C ATOM 1353 CD1 LEU A 88 -4.112 8.128 2.424 1.00 0.00 C ATOM 1354 CD2 LEU A 88 -3.457 6.257 3.949 1.00 0.00 C ATOM 0 HA LEU A 88 -1.621 7.678 5.895 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -2.095 9.323 3.384 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.398 7.716 3.452 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.159 8.177 4.553 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -5.104 7.685 2.334 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.190 9.212 2.339 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.470 7.747 1.630 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -4.457 5.839 3.838 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -2.799 5.829 3.193 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.073 6.020 4.941 1.00 0.00 H new ATOM 1366 N THR A 89 0.716 8.490 5.717 1.00 0.00 N ATOM 1367 CA THR A 89 2.087 8.986 5.769 1.00 0.00 C ATOM 1368 C THR A 89 2.998 8.159 4.868 1.00 0.00 C ATOM 1369 O THR A 89 3.819 8.705 4.131 1.00 0.00 O ATOM 1370 CB THR A 89 2.608 8.956 7.207 1.00 0.00 C ATOM 1371 OG1 THR A 89 4.011 9.148 7.236 1.00 0.00 O ATOM 1372 CG2 THR A 89 2.306 7.659 7.926 1.00 0.00 C ATOM 0 H THR A 89 0.615 7.503 5.955 1.00 0.00 H new ATOM 0 HA THR A 89 2.089 10.016 5.411 1.00 0.00 H new ATOM 0 HB THR A 89 2.088 9.766 7.720 1.00 0.00 H new ATOM 0 HG1 THR A 89 4.325 9.127 8.164 1.00 0.00 H new ATOM 0 HG21 THR A 89 2.703 7.704 8.940 1.00 0.00 H new ATOM 0 HG22 THR A 89 1.227 7.507 7.965 1.00 0.00 H new ATOM 0 HG23 THR A 89 2.770 6.830 7.392 1.00 0.00 H new ATOM 1380 N LEU A 90 2.848 6.841 4.933 1.00 0.00 N ATOM 1381 CA LEU A 90 3.658 5.939 4.121 1.00 0.00 C ATOM 1382 C LEU A 90 3.221 4.490 4.315 1.00 0.00 C ATOM 1383 O LEU A 90 2.994 3.764 3.347 1.00 0.00 O ATOM 1384 CB LEU A 90 5.138 6.089 4.479 1.00 0.00 C ATOM 1385 CG LEU A 90 6.101 5.292 3.597 1.00 0.00 C ATOM 1386 CD1 LEU A 90 6.217 5.931 2.221 1.00 0.00 C ATOM 1387 CD2 LEU A 90 7.467 5.192 4.257 1.00 0.00 C ATOM 0 H LEU A 90 2.174 6.373 5.539 1.00 0.00 H new ATOM 0 HA LEU A 90 3.514 6.205 3.074 1.00 0.00 H new ATOM 0 HB2 LEU A 90 5.405 7.144 4.421 1.00 0.00 H new ATOM 0 HB3 LEU A 90 5.279 5.781 5.515 1.00 0.00 H new ATOM 0 HG LEU A 90 5.704 4.284 3.475 1.00 0.00 H new ATOM 0 HD11 LEU A 90 6.906 5.351 1.607 1.00 0.00 H new ATOM 0 HD12 LEU A 90 5.236 5.951 1.745 1.00 0.00 H new ATOM 0 HD13 LEU A 90 6.592 6.949 2.323 1.00 0.00 H new ATOM 0 HD21 LEU A 90 8.140 4.622 3.616 1.00 0.00 H new ATOM 0 HD22 LEU A 90 7.872 6.193 4.409 1.00 0.00 H new ATOM 0 HD23 LEU A 90 7.370 4.690 5.219 1.00 0.00 H new ATOM 1399 N HIS A 91 3.104 4.075 5.572 1.00 0.00 N ATOM 1400 CA HIS A 91 2.694 2.712 5.892 1.00 0.00 C ATOM 1401 C HIS A 91 1.229 2.487 5.532 1.00 0.00 C ATOM 1402 O HIS A 91 0.884 1.496 4.888 1.00 0.00 O ATOM 1403 CB HIS A 91 2.915 2.426 7.378 1.00 0.00 C ATOM 1404 CG HIS A 91 3.304 1.008 7.661 1.00 0.00 C ATOM 1405 ND1 HIS A 91 2.851 0.309 8.761 1.00 0.00 N ATOM 1406 CD2 HIS A 91 4.107 0.156 6.980 1.00 0.00 C ATOM 1407 CE1 HIS A 91 3.360 -0.911 8.744 1.00 0.00 C ATOM 1408 NE2 HIS A 91 4.124 -1.029 7.675 1.00 0.00 N ATOM 0 H HIS A 91 3.287 4.662 6.386 1.00 0.00 H new ATOM 0 HA HIS A 91 3.304 2.028 5.303 1.00 0.00 H new ATOM 0 HB2 HIS A 91 3.692 3.090 7.756 1.00 0.00 H new ATOM 0 HB3 HIS A 91 2.002 2.660 7.925 1.00 0.00 H new ATOM 0 HD2 HIS A 91 4.635 0.368 6.062 1.00 0.00 H new ATOM 0 HE1 HIS A 91 3.181 -1.680 9.480 1.00 0.00 H new ATOM 0 HE2 HIS A 91 4.643 -1.865 7.408 1.00 0.00 H new ATOM 1417 N GLU A 92 0.372 3.411 5.953 1.00 0.00 N ATOM 1418 CA GLU A 92 -1.056 3.314 5.675 1.00 0.00 C ATOM 1419 C GLU A 92 -1.320 3.313 4.172 1.00 0.00 C ATOM 1420 O GLU A 92 -2.277 2.699 3.701 1.00 0.00 O ATOM 1421 CB GLU A 92 -1.807 4.471 6.335 1.00 0.00 C ATOM 1422 CG GLU A 92 -1.802 4.409 7.855 1.00 0.00 C ATOM 1423 CD GLU A 92 -0.750 5.310 8.470 1.00 0.00 C ATOM 1424 OE1 GLU A 92 -0.772 6.528 8.190 1.00 0.00 O ATOM 1425 OE2 GLU A 92 0.096 4.799 9.233 1.00 0.00 O ATOM 0 H GLU A 92 0.642 4.236 6.488 1.00 0.00 H new ATOM 0 HA GLU A 92 -1.417 2.373 6.090 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -1.360 5.413 6.016 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -2.838 4.472 5.983 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -2.785 4.695 8.230 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -1.626 3.381 8.173 1.00 0.00 H new ATOM 1432 N LEU A 93 -0.465 4.006 3.427 1.00 0.00 N ATOM 1433 CA LEU A 93 -0.606 4.086 1.978 1.00 0.00 C ATOM 1434 C LEU A 93 -0.448 2.710 1.338 1.00 0.00 C ATOM 1435 O LEU A 93 -1.078 2.410 0.324 1.00 0.00 O ATOM 1436 CB LEU A 93 0.427 5.052 1.396 1.00 0.00 C ATOM 1437 CG LEU A 93 0.130 6.534 1.629 1.00 0.00 C ATOM 1438 CD1 LEU A 93 1.186 7.401 0.960 1.00 0.00 C ATOM 1439 CD2 LEU A 93 -1.258 6.886 1.112 1.00 0.00 C ATOM 0 H LEU A 93 0.332 4.520 3.803 1.00 0.00 H new ATOM 0 HA LEU A 93 -1.607 4.457 1.757 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.401 4.820 1.826 1.00 0.00 H new ATOM 0 HB3 LEU A 93 0.502 4.876 0.323 1.00 0.00 H new ATOM 0 HG LEU A 93 0.157 6.727 2.701 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.959 8.452 1.136 1.00 0.00 H new ATOM 0 HD12 LEU A 93 2.166 7.167 1.376 1.00 0.00 H new ATOM 0 HD13 LEU A 93 1.191 7.206 -0.112 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.453 7.944 1.286 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -1.312 6.678 0.043 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -2.004 6.289 1.636 1.00 0.00 H new ATOM 1451 N THR A 94 0.397 1.877 1.937 1.00 0.00 N ATOM 1452 CA THR A 94 0.638 0.534 1.425 1.00 0.00 C ATOM 1453 C THR A 94 -0.471 -0.421 1.856 1.00 0.00 C ATOM 1454 O THR A 94 -0.902 -1.277 1.084 1.00 0.00 O ATOM 1455 CB THR A 94 1.991 0.014 1.911 1.00 0.00 C ATOM 1456 OG1 THR A 94 3.009 0.971 1.677 1.00 0.00 O ATOM 1457 CG2 THR A 94 2.412 -1.277 1.241 1.00 0.00 C ATOM 0 H THR A 94 0.926 2.109 2.778 1.00 0.00 H new ATOM 0 HA THR A 94 0.646 0.585 0.336 1.00 0.00 H new ATOM 0 HB THR A 94 1.862 -0.174 2.977 1.00 0.00 H new ATOM 0 HG1 THR A 94 2.900 1.722 2.297 1.00 0.00 H new ATOM 0 HG21 THR A 94 3.380 -1.591 1.631 1.00 0.00 H new ATOM 0 HG22 THR A 94 1.671 -2.051 1.444 1.00 0.00 H new ATOM 0 HG23 THR A 94 2.488 -1.121 0.165 1.00 0.00 H new ATOM 1465 N VAL A 95 -0.927 -0.267 3.095 1.00 0.00 N ATOM 1466 CA VAL A 95 -1.986 -1.116 3.629 1.00 0.00 C ATOM 1467 C VAL A 95 -3.261 -0.990 2.803 1.00 0.00 C ATOM 1468 O VAL A 95 -4.034 -1.942 2.687 1.00 0.00 O ATOM 1469 CB VAL A 95 -2.301 -0.764 5.097 1.00 0.00 C ATOM 1470 CG1 VAL A 95 -3.288 -1.760 5.686 1.00 0.00 C ATOM 1471 CG2 VAL A 95 -1.023 -0.715 5.922 1.00 0.00 C ATOM 0 H VAL A 95 -0.580 0.437 3.747 1.00 0.00 H new ATOM 0 HA VAL A 95 -1.624 -2.143 3.578 1.00 0.00 H new ATOM 0 HB VAL A 95 -2.760 0.224 5.123 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -3.498 -1.495 6.722 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.214 -1.738 5.111 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.861 -2.762 5.647 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -1.266 -0.465 6.955 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -0.532 -1.687 5.890 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -0.355 0.043 5.513 1.00 0.00 H new ATOM 1481 N ASN A 96 -3.475 0.189 2.230 1.00 0.00 N ATOM 1482 CA ASN A 96 -4.657 0.439 1.413 1.00 0.00 C ATOM 1483 C ASN A 96 -4.666 -0.461 0.181 1.00 0.00 C ATOM 1484 O ASN A 96 -5.607 -1.223 -0.037 1.00 0.00 O ATOM 1485 CB ASN A 96 -4.710 1.910 0.991 1.00 0.00 C ATOM 1486 CG ASN A 96 -5.788 2.682 1.724 1.00 0.00 C ATOM 1487 OD1 ASN A 96 -6.900 2.188 1.916 1.00 0.00 O ATOM 1488 ND2 ASN A 96 -5.467 3.903 2.136 1.00 0.00 N ATOM 0 H ASN A 96 -2.845 0.987 2.316 1.00 0.00 H new ATOM 0 HA ASN A 96 -5.539 0.211 2.012 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -3.742 2.374 1.180 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -4.889 1.971 -0.082 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -6.154 4.471 2.633 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -4.534 4.273 1.956 1.00 0.00 H new ATOM 1495 N GLU A 97 -3.611 -0.365 -0.622 1.00 0.00 N ATOM 1496 CA GLU A 97 -3.497 -1.171 -1.832 1.00 0.00 C ATOM 1497 C GLU A 97 -3.200 -2.627 -1.491 1.00 0.00 C ATOM 1498 O GLU A 97 -3.598 -3.539 -2.217 1.00 0.00 O ATOM 1499 CB GLU A 97 -2.399 -0.613 -2.740 1.00 0.00 C ATOM 1500 CG GLU A 97 -2.821 0.627 -3.513 1.00 0.00 C ATOM 1501 CD GLU A 97 -1.645 1.505 -3.891 1.00 0.00 C ATOM 1502 OE1 GLU A 97 -0.783 1.041 -4.667 1.00 0.00 O ATOM 1503 OE2 GLU A 97 -1.586 2.657 -3.412 1.00 0.00 O ATOM 0 H GLU A 97 -2.824 0.262 -0.457 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.451 -1.128 -2.358 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -1.525 -0.374 -2.134 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -2.095 -1.386 -3.446 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -3.350 0.325 -4.417 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -3.523 1.205 -2.911 1.00 0.00 H new ATOM 1510 N ALA A 98 -2.497 -2.840 -0.382 1.00 0.00 N ATOM 1511 CA ALA A 98 -2.146 -4.185 0.054 1.00 0.00 C ATOM 1512 C ALA A 98 -3.395 -5.029 0.290 1.00 0.00 C ATOM 1513 O ALA A 98 -3.375 -6.247 0.112 1.00 0.00 O ATOM 1514 CB ALA A 98 -1.301 -4.127 1.317 1.00 0.00 C ATOM 0 H ALA A 98 -2.160 -2.097 0.230 1.00 0.00 H new ATOM 0 HA ALA A 98 -1.564 -4.656 -0.738 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -1.046 -5.139 1.631 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -0.387 -3.568 1.118 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -1.864 -3.632 2.109 1.00 0.00 H new ATOM 1520 N ALA A 99 -4.479 -4.374 0.691 1.00 0.00 N ATOM 1521 CA ALA A 99 -5.736 -5.065 0.951 1.00 0.00 C ATOM 1522 C ALA A 99 -6.672 -4.969 -0.249 1.00 0.00 C ATOM 1523 O ALA A 99 -7.455 -5.882 -0.513 1.00 0.00 O ATOM 1524 CB ALA A 99 -6.405 -4.493 2.191 1.00 0.00 C ATOM 0 H ALA A 99 -4.512 -3.366 0.843 1.00 0.00 H new ATOM 0 HA ALA A 99 -5.515 -6.118 1.124 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -7.343 -5.018 2.374 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -5.746 -4.618 3.050 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -6.607 -3.433 2.039 1.00 0.00 H new ATOM 1530 N ALA A 100 -6.586 -3.859 -0.972 1.00 0.00 N ATOM 1531 CA ALA A 100 -7.423 -3.643 -2.145 1.00 0.00 C ATOM 1532 C ALA A 100 -7.179 -4.716 -3.199 1.00 0.00 C ATOM 1533 O ALA A 100 -8.099 -5.122 -3.912 1.00 0.00 O ATOM 1534 CB ALA A 100 -7.170 -2.260 -2.727 1.00 0.00 C ATOM 0 H ALA A 100 -5.944 -3.094 -0.766 1.00 0.00 H new ATOM 0 HA ALA A 100 -8.465 -3.708 -1.833 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -7.802 -2.113 -3.603 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -7.404 -1.502 -1.979 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -6.123 -2.173 -3.017 1.00 0.00 H new ATOM 1540 N GLN A 101 -5.936 -5.173 -3.294 1.00 0.00 N ATOM 1541 CA GLN A 101 -5.570 -6.201 -4.263 1.00 0.00 C ATOM 1542 C GLN A 101 -6.086 -7.568 -3.826 1.00 0.00 C ATOM 1543 O GLN A 101 -6.413 -8.415 -4.659 1.00 0.00 O ATOM 1544 CB GLN A 101 -4.051 -6.250 -4.439 1.00 0.00 C ATOM 1545 CG GLN A 101 -3.473 -5.004 -5.090 1.00 0.00 C ATOM 1546 CD GLN A 101 -2.099 -5.243 -5.686 1.00 0.00 C ATOM 1547 OE1 GLN A 101 -1.912 -6.149 -6.499 1.00 0.00 O ATOM 1548 NE2 GLN A 101 -1.130 -4.429 -5.285 1.00 0.00 N ATOM 0 H GLN A 101 -5.164 -4.848 -2.712 1.00 0.00 H new ATOM 0 HA GLN A 101 -6.031 -5.945 -5.217 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.585 -6.390 -3.464 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -3.792 -7.119 -5.043 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -4.150 -4.660 -5.872 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -3.410 -4.207 -4.349 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -1.330 -3.692 -4.609 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -0.185 -4.541 -5.653 1.00 0.00 H new ATOM 1557 N LEU A 102 -6.157 -7.777 -2.516 1.00 0.00 N ATOM 1558 CA LEU A 102 -6.632 -9.043 -1.968 1.00 0.00 C ATOM 1559 C LEU A 102 -8.143 -9.176 -2.136 1.00 0.00 C ATOM 1560 O LEU A 102 -8.651 -10.259 -2.422 1.00 0.00 O ATOM 1561 CB LEU A 102 -6.257 -9.153 -0.488 1.00 0.00 C ATOM 1562 CG LEU A 102 -4.915 -9.831 -0.209 1.00 0.00 C ATOM 1563 CD1 LEU A 102 -4.295 -9.283 1.067 1.00 0.00 C ATOM 1564 CD2 LEU A 102 -5.089 -11.338 -0.115 1.00 0.00 C ATOM 0 H LEU A 102 -5.892 -7.086 -1.814 1.00 0.00 H new ATOM 0 HA LEU A 102 -6.153 -9.853 -2.518 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -6.237 -8.151 -0.059 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -7.041 -9.706 0.030 1.00 0.00 H new ATOM 0 HG LEU A 102 -4.241 -9.614 -1.038 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -3.341 -9.777 1.249 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -4.134 -8.210 0.962 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.966 -9.468 1.906 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -4.124 -11.804 0.084 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -5.780 -11.575 0.694 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -5.488 -11.718 -1.056 1.00 0.00 H new ATOM 1576 N CYS A 103 -8.854 -8.067 -1.955 1.00 0.00 N ATOM 1577 CA CYS A 103 -10.307 -8.063 -2.088 1.00 0.00 C ATOM 1578 C CYS A 103 -10.726 -8.493 -3.490 1.00 0.00 C ATOM 1579 O CYS A 103 -11.785 -9.093 -3.676 1.00 0.00 O ATOM 1580 CB CYS A 103 -10.863 -6.671 -1.782 1.00 0.00 C ATOM 1581 SG CYS A 103 -11.011 -6.308 -0.016 1.00 0.00 S ATOM 0 H CYS A 103 -8.449 -7.162 -1.716 1.00 0.00 H new ATOM 0 HA CYS A 103 -10.715 -8.776 -1.372 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -10.217 -5.924 -2.243 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -11.845 -6.573 -2.246 1.00 0.00 H new ATOM 0 HG CYS A 103 -10.904 -5.026 0.174 1.00 0.00 H new ATOM 1587 N VAL A 104 -9.887 -8.184 -4.474 1.00 0.00 N ATOM 1588 CA VAL A 104 -10.170 -8.539 -5.859 1.00 0.00 C ATOM 1589 C VAL A 104 -10.298 -10.049 -6.024 1.00 0.00 C ATOM 1590 O VAL A 104 -11.367 -10.559 -6.361 1.00 0.00 O ATOM 1591 CB VAL A 104 -9.071 -8.023 -6.806 1.00 0.00 C ATOM 1592 CG1 VAL A 104 -9.479 -8.224 -8.258 1.00 0.00 C ATOM 1593 CG2 VAL A 104 -8.770 -6.558 -6.526 1.00 0.00 C ATOM 0 H VAL A 104 -9.006 -7.689 -4.337 1.00 0.00 H new ATOM 0 HA VAL A 104 -11.117 -8.066 -6.120 1.00 0.00 H new ATOM 0 HB VAL A 104 -8.162 -8.597 -6.626 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -8.690 -7.853 -8.912 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -9.639 -9.285 -8.447 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -10.401 -7.677 -8.456 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -7.991 -6.210 -7.205 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -9.673 -5.966 -6.676 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -8.430 -6.447 -5.496 1.00 0.00 H new ATOM 1603 N LYS A 105 -9.201 -10.761 -5.785 1.00 0.00 N ATOM 1604 CA LYS A 105 -9.190 -12.214 -5.907 1.00 0.00 C ATOM 1605 C LYS A 105 -10.126 -12.853 -4.886 1.00 0.00 C ATOM 1606 O LYS A 105 -10.724 -13.897 -5.145 1.00 0.00 O ATOM 1607 CB LYS A 105 -7.771 -12.751 -5.720 1.00 0.00 C ATOM 1608 CG LYS A 105 -6.834 -12.407 -6.867 1.00 0.00 C ATOM 1609 CD LYS A 105 -7.083 -13.294 -8.075 1.00 0.00 C ATOM 1610 CE LYS A 105 -5.784 -13.666 -8.771 1.00 0.00 C ATOM 1611 NZ LYS A 105 -6.027 -14.329 -10.082 1.00 0.00 N ATOM 0 H LYS A 105 -8.308 -10.355 -5.506 1.00 0.00 H new ATOM 0 HA LYS A 105 -9.541 -12.472 -6.906 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -7.359 -12.351 -4.793 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -7.813 -13.834 -5.609 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -6.969 -11.362 -7.147 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -5.800 -12.518 -6.540 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -7.601 -14.200 -7.761 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -7.738 -12.779 -8.777 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -5.184 -12.769 -8.923 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -5.206 -14.331 -8.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -5.117 -14.567 -10.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -6.578 -15.199 -9.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -6.557 -13.685 -10.704 1.00 0.00 H new ATOM 1625 N ASP A 106 -10.248 -12.218 -3.725 1.00 0.00 N ATOM 1626 CA ASP A 106 -11.112 -12.724 -2.664 1.00 0.00 C ATOM 1627 C ASP A 106 -12.213 -11.722 -2.335 1.00 0.00 C ATOM 1628 O ASP A 106 -12.045 -10.860 -1.471 1.00 0.00 O ATOM 1629 CB ASP A 106 -10.291 -13.027 -1.410 1.00 0.00 C ATOM 1630 CG ASP A 106 -9.723 -14.433 -1.415 1.00 0.00 C ATOM 1631 OD1 ASP A 106 -10.476 -15.375 -1.743 1.00 0.00 O ATOM 1632 OD2 ASP A 106 -8.528 -14.593 -1.092 1.00 0.00 O ATOM 0 H ASP A 106 -9.760 -11.352 -3.495 1.00 0.00 H new ATOM 0 HA ASP A 106 -11.577 -13.645 -3.017 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -9.475 -12.309 -1.331 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -10.918 -12.895 -0.528 1.00 0.00 H new ATOM 1637 N ASN A 107 -13.341 -11.840 -3.027 1.00 0.00 N ATOM 1638 CA ASN A 107 -14.470 -10.945 -2.807 1.00 0.00 C ATOM 1639 C ASN A 107 -15.028 -11.105 -1.395 1.00 0.00 C ATOM 1640 O ASN A 107 -15.636 -10.183 -0.852 1.00 0.00 O ATOM 1641 CB ASN A 107 -15.570 -11.217 -3.837 1.00 0.00 C ATOM 1642 CG ASN A 107 -16.226 -9.943 -4.331 1.00 0.00 C ATOM 1643 OD1 ASN A 107 -15.433 -9.065 -4.934 1.00 0.00 O flip ATOM 1644 ND2 ASN A 107 -17.432 -9.750 -4.171 1.00 0.00 N flip ATOM 0 H ASN A 107 -13.497 -12.547 -3.745 1.00 0.00 H new ATOM 0 HA ASN A 107 -14.117 -9.920 -2.923 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -15.146 -11.756 -4.684 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -16.327 -11.864 -3.394 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -18.003 -10.453 -3.702 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -17.860 -8.887 -4.508 1.00 0.00 H new ATOM 1651 N ALA A 108 -14.818 -12.279 -0.807 1.00 0.00 N ATOM 1652 CA ALA A 108 -15.302 -12.555 0.541 1.00 0.00 C ATOM 1653 C ALA A 108 -14.507 -11.776 1.583 1.00 0.00 C ATOM 1654 O ALA A 108 -15.032 -11.417 2.636 1.00 0.00 O ATOM 1655 CB ALA A 108 -15.232 -14.047 0.828 1.00 0.00 C ATOM 0 H ALA A 108 -14.317 -13.053 -1.242 1.00 0.00 H new ATOM 0 HA ALA A 108 -16.341 -12.231 0.601 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -15.596 -14.241 1.837 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -15.850 -14.585 0.110 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -14.199 -14.386 0.743 1.00 0.00 H new ATOM 1661 N LEU A 109 -13.238 -11.516 1.283 1.00 0.00 N ATOM 1662 CA LEU A 109 -12.372 -10.779 2.196 1.00 0.00 C ATOM 1663 C LEU A 109 -12.950 -9.400 2.507 1.00 0.00 C ATOM 1664 O LEU A 109 -12.657 -8.818 3.551 1.00 0.00 O ATOM 1665 CB LEU A 109 -10.969 -10.638 1.599 1.00 0.00 C ATOM 1666 CG LEU A 109 -9.946 -11.658 2.100 1.00 0.00 C ATOM 1667 CD1 LEU A 109 -8.693 -11.626 1.239 1.00 0.00 C ATOM 1668 CD2 LEU A 109 -9.602 -11.392 3.558 1.00 0.00 C ATOM 0 H LEU A 109 -12.787 -11.805 0.415 1.00 0.00 H new ATOM 0 HA LEU A 109 -12.308 -11.341 3.128 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -11.042 -10.722 0.515 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.597 -9.637 1.817 1.00 0.00 H new ATOM 0 HG LEU A 109 -10.385 -12.653 2.026 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -7.977 -12.359 1.611 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -8.954 -11.865 0.208 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -8.249 -10.631 1.280 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -8.873 -12.127 3.900 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -9.182 -10.391 3.656 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -10.505 -11.468 4.164 1.00 0.00 H new ATOM 1680 N LEU A 110 -13.769 -8.883 1.597 1.00 0.00 N ATOM 1681 CA LEU A 110 -14.386 -7.573 1.778 1.00 0.00 C ATOM 1682 C LEU A 110 -15.182 -7.518 3.078 1.00 0.00 C ATOM 1683 O LEU A 110 -15.245 -6.479 3.735 1.00 0.00 O ATOM 1684 CB LEU A 110 -15.300 -7.249 0.595 1.00 0.00 C ATOM 1685 CG LEU A 110 -14.581 -6.772 -0.668 1.00 0.00 C ATOM 1686 CD1 LEU A 110 -15.369 -7.158 -1.909 1.00 0.00 C ATOM 1687 CD2 LEU A 110 -14.363 -5.267 -0.620 1.00 0.00 C ATOM 0 H LEU A 110 -14.021 -9.351 0.726 1.00 0.00 H new ATOM 0 HA LEU A 110 -13.590 -6.830 1.830 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -15.881 -8.138 0.350 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -16.009 -6.480 0.903 1.00 0.00 H new ATOM 0 HG LEU A 110 -13.607 -7.260 -0.715 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -14.842 -6.810 -2.797 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -15.474 -8.242 -1.951 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -16.357 -6.699 -1.870 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -13.850 -4.945 -1.526 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -15.326 -4.762 -0.549 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -13.756 -5.015 0.250 1.00 0.00 H new ATOM 1699 N THR A 111 -15.788 -8.643 3.444 1.00 0.00 N ATOM 1700 CA THR A 111 -16.580 -8.721 4.666 1.00 0.00 C ATOM 1701 C THR A 111 -15.685 -8.953 5.880 1.00 0.00 C ATOM 1702 O THR A 111 -15.913 -8.387 6.949 1.00 0.00 O ATOM 1703 CB THR A 111 -17.614 -9.842 4.558 1.00 0.00 C ATOM 1704 OG1 THR A 111 -17.009 -11.040 4.104 1.00 0.00 O ATOM 1705 CG2 THR A 111 -18.753 -9.516 3.615 1.00 0.00 C ATOM 0 H THR A 111 -15.746 -9.512 2.912 1.00 0.00 H new ATOM 0 HA THR A 111 -17.098 -7.771 4.795 1.00 0.00 H new ATOM 0 HB THR A 111 -18.018 -9.961 5.563 1.00 0.00 H new ATOM 0 HG1 THR A 111 -16.047 -10.895 3.983 1.00 0.00 H new ATOM 0 HG21 THR A 111 -19.451 -10.353 3.584 1.00 0.00 H new ATOM 0 HG22 THR A 111 -19.272 -8.624 3.966 1.00 0.00 H new ATOM 0 HG23 THR A 111 -18.358 -9.337 2.615 1.00 0.00 H new ATOM 1713 N ARG A 112 -14.666 -9.789 5.708 1.00 0.00 N ATOM 1714 CA ARG A 112 -13.737 -10.094 6.789 1.00 0.00 C ATOM 1715 C ARG A 112 -12.727 -8.966 6.972 1.00 0.00 C ATOM 1716 O ARG A 112 -11.768 -8.847 6.210 1.00 0.00 O ATOM 1717 CB ARG A 112 -13.007 -11.408 6.506 1.00 0.00 C ATOM 1718 CG ARG A 112 -13.932 -12.541 6.091 1.00 0.00 C ATOM 1719 CD ARG A 112 -14.780 -13.023 7.257 1.00 0.00 C ATOM 1720 NE ARG A 112 -14.918 -14.478 7.268 1.00 0.00 N ATOM 1721 CZ ARG A 112 -13.979 -15.308 7.716 1.00 0.00 C ATOM 1722 NH1 ARG A 112 -12.834 -14.832 8.190 1.00 0.00 N ATOM 1723 NH2 ARG A 112 -14.185 -16.617 7.691 1.00 0.00 N ATOM 0 H ARG A 112 -14.463 -10.267 4.830 1.00 0.00 H new ATOM 0 HA ARG A 112 -14.310 -10.197 7.710 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -12.272 -11.243 5.718 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -12.457 -11.708 7.398 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -14.581 -12.205 5.282 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -13.341 -13.370 5.702 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -14.329 -12.694 8.193 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -15.768 -12.565 7.201 1.00 0.00 H new ATOM 0 HE ARG A 112 -15.785 -14.881 6.911 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -12.670 -13.825 8.212 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -12.118 -15.473 8.532 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -15.063 -16.988 7.328 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -13.465 -17.253 8.034 1.00 0.00 H new ATOM 1737 N ARG A 113 -12.951 -8.139 7.988 1.00 0.00 N ATOM 1738 CA ARG A 113 -12.062 -7.018 8.272 1.00 0.00 C ATOM 1739 C ARG A 113 -10.834 -7.479 9.052 1.00 0.00 C ATOM 1740 O ARG A 113 -9.707 -7.093 8.737 1.00 0.00 O ATOM 1741 CB ARG A 113 -12.805 -5.938 9.059 1.00 0.00 C ATOM 1742 CG ARG A 113 -12.055 -4.617 9.139 1.00 0.00 C ATOM 1743 CD ARG A 113 -11.581 -4.327 10.554 1.00 0.00 C ATOM 1744 NE ARG A 113 -11.533 -2.893 10.832 1.00 0.00 N ATOM 1745 CZ ARG A 113 -12.606 -2.157 11.115 1.00 0.00 C ATOM 1746 NH1 ARG A 113 -13.809 -2.715 11.158 1.00 0.00 N ATOM 1747 NH2 ARG A 113 -12.474 -0.860 11.357 1.00 0.00 N ATOM 0 H ARG A 113 -13.740 -8.224 8.628 1.00 0.00 H new ATOM 0 HA ARG A 113 -11.729 -6.601 7.321 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -13.777 -5.767 8.596 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -12.993 -6.301 10.069 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -11.198 -4.643 8.466 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -12.703 -3.809 8.799 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -12.248 -4.812 11.266 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -10.591 -4.758 10.700 1.00 0.00 H new ATOM 0 HE ARG A 113 -10.625 -2.429 10.808 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -13.915 -3.713 10.974 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -14.627 -2.146 11.375 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -11.551 -0.427 11.326 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -13.295 -0.295 11.574 1.00 0.00 H new ATOM 1761 N ASP A 114 -11.059 -8.301 10.070 1.00 0.00 N ATOM 1762 CA ASP A 114 -9.971 -8.812 10.896 1.00 0.00 C ATOM 1763 C ASP A 114 -8.957 -9.580 10.052 1.00 0.00 C ATOM 1764 O ASP A 114 -7.750 -9.360 10.162 1.00 0.00 O ATOM 1765 CB ASP A 114 -10.523 -9.715 12.001 1.00 0.00 C ATOM 1766 CG ASP A 114 -9.876 -9.444 13.345 1.00 0.00 C ATOM 1767 OD1 ASP A 114 -9.575 -8.267 13.632 1.00 0.00 O ATOM 1768 OD2 ASP A 114 -9.671 -10.409 14.111 1.00 0.00 O ATOM 0 H ASP A 114 -11.985 -8.628 10.344 1.00 0.00 H new ATOM 0 HA ASP A 114 -9.464 -7.961 11.351 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -11.600 -9.568 12.083 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -10.364 -10.758 11.728 1.00 0.00 H new ATOM 1773 N GLU A 115 -9.454 -10.481 9.212 1.00 0.00 N ATOM 1774 CA GLU A 115 -8.590 -11.281 8.352 1.00 0.00 C ATOM 1775 C GLU A 115 -7.809 -10.395 7.388 1.00 0.00 C ATOM 1776 O GLU A 115 -6.587 -10.501 7.285 1.00 0.00 O ATOM 1777 CB GLU A 115 -9.420 -12.301 7.568 1.00 0.00 C ATOM 1778 CG GLU A 115 -8.588 -13.197 6.666 1.00 0.00 C ATOM 1779 CD GLU A 115 -9.435 -13.989 5.689 1.00 0.00 C ATOM 1780 OE1 GLU A 115 -10.608 -14.268 6.012 1.00 0.00 O ATOM 1781 OE2 GLU A 115 -8.924 -14.328 4.600 1.00 0.00 O ATOM 0 H GLU A 115 -10.450 -10.676 9.108 1.00 0.00 H new ATOM 0 HA GLU A 115 -7.879 -11.811 8.986 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -9.975 -12.922 8.271 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -10.154 -11.771 6.962 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -7.875 -12.587 6.111 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -8.008 -13.886 7.280 1.00 0.00 H new ATOM 1788 N LEU A 116 -8.521 -9.523 6.683 1.00 0.00 N ATOM 1789 CA LEU A 116 -7.893 -8.619 5.726 1.00 0.00 C ATOM 1790 C LEU A 116 -6.958 -7.640 6.430 1.00 0.00 C ATOM 1791 O LEU A 116 -5.961 -7.199 5.857 1.00 0.00 O ATOM 1792 CB LEU A 116 -8.959 -7.849 4.944 1.00 0.00 C ATOM 1793 CG LEU A 116 -8.417 -6.866 3.906 1.00 0.00 C ATOM 1794 CD1 LEU A 116 -8.238 -7.554 2.561 1.00 0.00 C ATOM 1795 CD2 LEU A 116 -9.344 -5.666 3.774 1.00 0.00 C ATOM 0 H LEU A 116 -9.533 -9.423 6.756 1.00 0.00 H new ATOM 0 HA LEU A 116 -7.304 -9.220 5.032 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -9.606 -8.566 4.439 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -9.581 -7.301 5.651 1.00 0.00 H new ATOM 0 HG LEU A 116 -7.442 -6.512 4.242 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -7.852 -6.839 1.835 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -7.535 -8.380 2.666 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -9.199 -7.937 2.217 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -8.943 -4.976 3.031 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -10.332 -6.002 3.461 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -9.421 -5.159 4.736 1.00 0.00 H new ATOM 1807 N PHE A 117 -7.285 -7.305 7.673 1.00 0.00 N ATOM 1808 CA PHE A 117 -6.473 -6.377 8.453 1.00 0.00 C ATOM 1809 C PHE A 117 -5.118 -6.991 8.794 1.00 0.00 C ATOM 1810 O PHE A 117 -4.125 -6.280 8.943 1.00 0.00 O ATOM 1811 CB PHE A 117 -7.205 -5.982 9.738 1.00 0.00 C ATOM 1812 CG PHE A 117 -6.509 -4.902 10.516 1.00 0.00 C ATOM 1813 CD1 PHE A 117 -6.565 -3.582 10.097 1.00 0.00 C ATOM 1814 CD2 PHE A 117 -5.799 -5.207 11.667 1.00 0.00 C ATOM 1815 CE1 PHE A 117 -5.927 -2.586 10.811 1.00 0.00 C ATOM 1816 CE2 PHE A 117 -5.159 -4.215 12.385 1.00 0.00 C ATOM 1817 CZ PHE A 117 -5.223 -2.903 11.957 1.00 0.00 C ATOM 0 H PHE A 117 -8.106 -7.662 8.162 1.00 0.00 H new ATOM 0 HA PHE A 117 -6.305 -5.485 7.849 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -8.211 -5.646 9.485 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -7.313 -6.863 10.371 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -7.114 -3.329 9.202 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -5.746 -6.231 12.006 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -5.978 -1.561 10.474 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -4.609 -4.465 13.280 1.00 0.00 H new ATOM 0 HZ PHE A 117 -4.724 -2.126 12.517 1.00 0.00 H new ATOM 1827 N ALA A 118 -5.087 -8.314 8.916 1.00 0.00 N ATOM 1828 CA ALA A 118 -3.853 -9.022 9.240 1.00 0.00 C ATOM 1829 C ALA A 118 -3.053 -9.338 7.981 1.00 0.00 C ATOM 1830 O ALA A 118 -1.824 -9.402 8.014 1.00 0.00 O ATOM 1831 CB ALA A 118 -4.165 -10.299 10.005 1.00 0.00 C ATOM 0 H ALA A 118 -5.901 -8.917 8.796 1.00 0.00 H new ATOM 0 HA ALA A 118 -3.245 -8.373 9.870 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -3.236 -10.818 10.241 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -4.687 -10.051 10.929 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -4.796 -10.944 9.394 1.00 0.00 H new ATOM 1837 N LEU A 119 -3.758 -9.536 6.871 1.00 0.00 N ATOM 1838 CA LEU A 119 -3.112 -9.847 5.601 1.00 0.00 C ATOM 1839 C LEU A 119 -2.381 -8.627 5.047 1.00 0.00 C ATOM 1840 O LEU A 119 -1.221 -8.717 4.646 1.00 0.00 O ATOM 1841 CB LEU A 119 -4.146 -10.338 4.586 1.00 0.00 C ATOM 1842 CG LEU A 119 -4.810 -11.673 4.931 1.00 0.00 C ATOM 1843 CD1 LEU A 119 -5.986 -11.939 4.006 1.00 0.00 C ATOM 1844 CD2 LEU A 119 -3.798 -12.807 4.852 1.00 0.00 C ATOM 0 H LEU A 119 -4.776 -9.487 6.826 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.382 -10.636 5.779 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -4.922 -9.579 4.485 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -3.662 -10.431 3.614 1.00 0.00 H new ATOM 0 HG LEU A 119 -5.185 -11.618 5.953 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -6.445 -12.893 4.267 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -6.721 -11.141 4.113 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -5.637 -11.975 2.974 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.287 -13.749 5.100 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -3.393 -12.864 3.842 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -2.988 -12.622 5.558 1.00 0.00 H new ATOM 1856 N ALA A 120 -3.068 -7.490 5.029 1.00 0.00 N ATOM 1857 CA ALA A 120 -2.486 -6.252 4.524 1.00 0.00 C ATOM 1858 C ALA A 120 -1.235 -5.871 5.310 1.00 0.00 C ATOM 1859 O ALA A 120 -0.234 -5.445 4.733 1.00 0.00 O ATOM 1860 CB ALA A 120 -3.509 -5.129 4.580 1.00 0.00 C ATOM 0 H ALA A 120 -4.029 -7.400 5.359 1.00 0.00 H new ATOM 0 HA ALA A 120 -2.195 -6.413 3.486 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.062 -4.210 4.200 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -4.372 -5.392 3.969 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -3.828 -4.978 5.611 1.00 0.00 H new ATOM 1866 N ARG A 121 -1.300 -6.024 6.628 1.00 0.00 N ATOM 1867 CA ARG A 121 -0.173 -5.694 7.493 1.00 0.00 C ATOM 1868 C ARG A 121 1.039 -6.561 7.167 1.00 0.00 C ATOM 1869 O ARG A 121 2.182 -6.132 7.324 1.00 0.00 O ATOM 1870 CB ARG A 121 -0.561 -5.872 8.961 1.00 0.00 C ATOM 1871 CG ARG A 121 -1.432 -4.750 9.501 1.00 0.00 C ATOM 1872 CD ARG A 121 -1.948 -5.066 10.895 1.00 0.00 C ATOM 1873 NE ARG A 121 -0.861 -5.213 11.860 1.00 0.00 N ATOM 1874 CZ ARG A 121 -0.177 -4.191 12.369 1.00 0.00 C ATOM 1875 NH1 ARG A 121 -0.464 -2.947 12.006 1.00 0.00 N ATOM 1876 NH2 ARG A 121 0.796 -4.413 13.242 1.00 0.00 N ATOM 0 H ARG A 121 -2.121 -6.375 7.121 1.00 0.00 H new ATOM 0 HA ARG A 121 0.092 -4.651 7.317 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -1.090 -6.818 9.076 1.00 0.00 H new ATOM 0 HB3 ARG A 121 0.346 -5.938 9.562 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -0.859 -3.823 9.526 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -2.274 -4.586 8.829 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -2.618 -4.271 11.222 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -2.533 -5.985 10.865 1.00 0.00 H new ATOM 0 HE ARG A 121 -0.611 -6.155 12.162 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -1.211 -2.771 11.334 1.00 0.00 H new ATOM 0 HH12 ARG A 121 0.063 -2.167 12.399 1.00 0.00 H new ATOM 0 HH21 ARG A 121 1.021 -5.367 13.524 1.00 0.00 H new ATOM 0 HH22 ARG A 121 1.320 -3.630 13.632 1.00 0.00 H new ATOM 1890 N GLN A 122 0.783 -7.784 6.714 1.00 0.00 N ATOM 1891 CA GLN A 122 1.853 -8.711 6.368 1.00 0.00 C ATOM 1892 C GLN A 122 2.705 -8.163 5.227 1.00 0.00 C ATOM 1893 O GLN A 122 3.934 -8.195 5.285 1.00 0.00 O ATOM 1894 CB GLN A 122 1.272 -10.071 5.978 1.00 0.00 C ATOM 1895 CG GLN A 122 2.325 -11.147 5.774 1.00 0.00 C ATOM 1896 CD GLN A 122 1.809 -12.536 6.097 1.00 0.00 C ATOM 1897 OE1 GLN A 122 1.230 -12.766 7.158 1.00 0.00 O ATOM 1898 NE2 GLN A 122 2.017 -13.473 5.178 1.00 0.00 N ATOM 0 H GLN A 122 -0.157 -8.156 6.578 1.00 0.00 H new ATOM 0 HA GLN A 122 2.489 -8.832 7.245 1.00 0.00 H new ATOM 0 HB2 GLN A 122 0.578 -10.396 6.753 1.00 0.00 H new ATOM 0 HB3 GLN A 122 0.695 -9.960 5.060 1.00 0.00 H new ATOM 0 HG2 GLN A 122 2.669 -11.122 4.740 1.00 0.00 H new ATOM 0 HG3 GLN A 122 3.189 -10.929 6.402 1.00 0.00 H new ATOM 0 HE21 GLN A 122 2.502 -13.239 4.312 1.00 0.00 H new ATOM 0 HE22 GLN A 122 1.692 -14.426 5.339 1.00 0.00 H new ATOM 1907 N ILE A 123 2.043 -7.661 4.190 1.00 0.00 N ATOM 1908 CA ILE A 123 2.738 -7.107 3.035 1.00 0.00 C ATOM 1909 C ILE A 123 3.249 -5.699 3.322 1.00 0.00 C ATOM 1910 O ILE A 123 4.288 -5.287 2.808 1.00 0.00 O ATOM 1911 CB ILE A 123 1.825 -7.066 1.794 1.00 0.00 C ATOM 1912 CG1 ILE A 123 1.162 -8.428 1.574 1.00 0.00 C ATOM 1913 CG2 ILE A 123 2.619 -6.655 0.563 1.00 0.00 C ATOM 1914 CD1 ILE A 123 -0.131 -8.350 0.792 1.00 0.00 C ATOM 0 H ILE A 123 1.026 -7.627 4.126 1.00 0.00 H new ATOM 0 HA ILE A 123 3.584 -7.764 2.833 1.00 0.00 H new ATOM 0 HB ILE A 123 1.044 -6.325 1.963 1.00 0.00 H new ATOM 0 HG12 ILE A 123 1.858 -9.081 1.047 1.00 0.00 H new ATOM 0 HG13 ILE A 123 0.965 -8.888 2.542 1.00 0.00 H new ATOM 0 HG21 ILE A 123 1.959 -6.631 -0.304 1.00 0.00 H new ATOM 0 HG22 ILE A 123 3.048 -5.665 0.720 1.00 0.00 H new ATOM 0 HG23 ILE A 123 3.420 -7.374 0.390 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -0.546 -9.351 0.674 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -0.843 -7.723 1.328 1.00 0.00 H new ATOM 0 HD13 ILE A 123 0.063 -7.919 -0.190 1.00 0.00 H new ATOM 1926 N SER A 124 2.509 -4.965 4.147 1.00 0.00 N ATOM 1927 CA SER A 124 2.885 -3.601 4.502 1.00 0.00 C ATOM 1928 C SER A 124 4.251 -3.569 5.182 1.00 0.00 C ATOM 1929 O SER A 124 5.053 -2.668 4.942 1.00 0.00 O ATOM 1930 CB SER A 124 1.831 -2.983 5.423 1.00 0.00 C ATOM 1931 OG SER A 124 2.073 -1.600 5.619 1.00 0.00 O ATOM 0 H SER A 124 1.646 -5.292 4.582 1.00 0.00 H new ATOM 0 HA SER A 124 2.944 -3.018 3.583 1.00 0.00 H new ATOM 0 HB2 SER A 124 0.840 -3.125 4.993 1.00 0.00 H new ATOM 0 HB3 SER A 124 1.838 -3.496 6.384 1.00 0.00 H new ATOM 0 HG SER A 124 1.610 -1.298 6.428 1.00 0.00 H new ATOM 1937 N ARG A 125 4.507 -4.559 6.030 1.00 0.00 N ATOM 1938 CA ARG A 125 5.776 -4.643 6.745 1.00 0.00 C ATOM 1939 C ARG A 125 6.872 -5.212 5.849 1.00 0.00 C ATOM 1940 O ARG A 125 8.046 -4.871 5.995 1.00 0.00 O ATOM 1941 CB ARG A 125 5.624 -5.509 7.997 1.00 0.00 C ATOM 1942 CG ARG A 125 4.880 -4.818 9.128 1.00 0.00 C ATOM 1943 CD ARG A 125 4.445 -5.808 10.196 1.00 0.00 C ATOM 1944 NE ARG A 125 5.573 -6.561 10.737 1.00 0.00 N ATOM 1945 CZ ARG A 125 5.538 -7.219 11.894 1.00 0.00 C ATOM 1946 NH1 ARG A 125 4.434 -7.221 12.632 1.00 0.00 N ATOM 1947 NH2 ARG A 125 6.609 -7.879 12.314 1.00 0.00 N ATOM 0 H ARG A 125 3.854 -5.314 6.239 1.00 0.00 H new ATOM 0 HA ARG A 125 6.063 -3.634 7.041 1.00 0.00 H new ATOM 0 HB2 ARG A 125 5.096 -6.426 7.733 1.00 0.00 H new ATOM 0 HB3 ARG A 125 6.613 -5.801 8.349 1.00 0.00 H new ATOM 0 HG2 ARG A 125 5.520 -4.057 9.575 1.00 0.00 H new ATOM 0 HG3 ARG A 125 4.005 -4.304 8.729 1.00 0.00 H new ATOM 0 HD2 ARG A 125 3.945 -5.273 11.004 1.00 0.00 H new ATOM 0 HD3 ARG A 125 3.717 -6.500 9.773 1.00 0.00 H new ATOM 0 HE ARG A 125 6.438 -6.584 10.197 1.00 0.00 H new ATOM 0 HH11 ARG A 125 3.607 -6.717 12.313 1.00 0.00 H new ATOM 0 HH12 ARG A 125 4.413 -7.727 13.517 1.00 0.00 H new ATOM 0 HH21 ARG A 125 7.459 -7.882 11.751 1.00 0.00 H new ATOM 0 HH22 ARG A 125 6.582 -8.383 13.200 1.00 0.00 H new ATOM 1961 N GLU A 126 6.481 -6.081 4.923 1.00 0.00 N ATOM 1962 CA GLU A 126 7.431 -6.698 4.004 1.00 0.00 C ATOM 1963 C GLU A 126 8.120 -5.643 3.144 1.00 0.00 C ATOM 1964 O GLU A 126 9.348 -5.597 3.066 1.00 0.00 O ATOM 1965 CB GLU A 126 6.721 -7.719 3.113 1.00 0.00 C ATOM 1966 CG GLU A 126 6.986 -9.161 3.512 1.00 0.00 C ATOM 1967 CD GLU A 126 6.013 -10.131 2.871 1.00 0.00 C ATOM 1968 OE1 GLU A 126 5.925 -10.149 1.625 1.00 0.00 O ATOM 1969 OE2 GLU A 126 5.340 -10.876 3.615 1.00 0.00 O ATOM 0 H GLU A 126 5.513 -6.374 4.789 1.00 0.00 H new ATOM 0 HA GLU A 126 8.191 -7.210 4.595 1.00 0.00 H new ATOM 0 HB2 GLU A 126 5.647 -7.533 3.145 1.00 0.00 H new ATOM 0 HB3 GLU A 126 7.039 -7.572 2.081 1.00 0.00 H new ATOM 0 HG2 GLU A 126 8.003 -9.432 3.228 1.00 0.00 H new ATOM 0 HG3 GLU A 126 6.923 -9.252 4.596 1.00 0.00 H new ATOM 1976 N VAL A 127 7.323 -4.798 2.500 1.00 0.00 N ATOM 1977 CA VAL A 127 7.857 -3.744 1.644 1.00 0.00 C ATOM 1978 C VAL A 127 8.770 -2.807 2.427 1.00 0.00 C ATOM 1979 O VAL A 127 9.835 -2.420 1.949 1.00 0.00 O ATOM 1980 CB VAL A 127 6.727 -2.919 0.998 1.00 0.00 C ATOM 1981 CG1 VAL A 127 7.291 -1.962 -0.040 1.00 0.00 C ATOM 1982 CG2 VAL A 127 5.684 -3.837 0.377 1.00 0.00 C ATOM 0 H VAL A 127 6.305 -4.822 2.554 1.00 0.00 H new ATOM 0 HA VAL A 127 8.433 -4.236 0.860 1.00 0.00 H new ATOM 0 HB VAL A 127 6.242 -2.329 1.776 1.00 0.00 H new ATOM 0 HG11 VAL A 127 6.478 -1.388 -0.485 1.00 0.00 H new ATOM 0 HG12 VAL A 127 7.996 -1.282 0.437 1.00 0.00 H new ATOM 0 HG13 VAL A 127 7.803 -2.529 -0.817 1.00 0.00 H new ATOM 0 HG21 VAL A 127 4.894 -3.237 -0.074 1.00 0.00 H new ATOM 0 HG22 VAL A 127 6.153 -4.455 -0.389 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.257 -4.477 1.149 1.00 0.00 H new ATOM 1992 N THR A 128 8.345 -2.449 3.635 1.00 0.00 N ATOM 1993 CA THR A 128 9.126 -1.557 4.485 1.00 0.00 C ATOM 1994 C THR A 128 10.439 -2.211 4.906 1.00 0.00 C ATOM 1995 O THR A 128 11.426 -1.526 5.175 1.00 0.00 O ATOM 1996 CB THR A 128 8.320 -1.166 5.725 1.00 0.00 C ATOM 1997 OG1 THR A 128 6.935 -1.114 5.428 1.00 0.00 O ATOM 1998 CG2 THR A 128 8.716 0.177 6.298 1.00 0.00 C ATOM 0 H THR A 128 7.466 -2.762 4.047 1.00 0.00 H new ATOM 0 HA THR A 128 9.357 -0.661 3.909 1.00 0.00 H new ATOM 0 HB THR A 128 8.537 -1.937 6.464 1.00 0.00 H new ATOM 0 HG1 THR A 128 6.542 -2.005 5.541 1.00 0.00 H new ATOM 0 HG21 THR A 128 8.106 0.393 7.175 1.00 0.00 H new ATOM 0 HG22 THR A 128 9.768 0.155 6.584 1.00 0.00 H new ATOM 0 HG23 THR A 128 8.561 0.953 5.548 1.00 0.00 H new ATOM 2006 N TYR A 129 10.445 -3.540 4.960 1.00 0.00 N ATOM 2007 CA TYR A 129 11.637 -4.285 5.349 1.00 0.00 C ATOM 2008 C TYR A 129 12.816 -3.942 4.442 1.00 0.00 C ATOM 2009 O TYR A 129 13.831 -3.416 4.898 1.00 0.00 O ATOM 2010 CB TYR A 129 11.363 -5.789 5.301 1.00 0.00 C ATOM 2011 CG TYR A 129 12.281 -6.602 6.185 1.00 0.00 C ATOM 2012 CD1 TYR A 129 12.099 -6.636 7.562 1.00 0.00 C ATOM 2013 CD2 TYR A 129 13.330 -7.334 5.644 1.00 0.00 C ATOM 2014 CE1 TYR A 129 12.936 -7.377 8.375 1.00 0.00 C ATOM 2015 CE2 TYR A 129 14.171 -8.079 6.450 1.00 0.00 C ATOM 2016 CZ TYR A 129 13.969 -8.097 7.813 1.00 0.00 C ATOM 2017 OH TYR A 129 14.804 -8.837 8.620 1.00 0.00 O ATOM 0 H TYR A 129 9.637 -4.123 4.739 1.00 0.00 H new ATOM 0 HA TYR A 129 11.893 -4.001 6.370 1.00 0.00 H new ATOM 0 HB2 TYR A 129 10.331 -5.971 5.599 1.00 0.00 H new ATOM 0 HB3 TYR A 129 11.463 -6.135 4.272 1.00 0.00 H new ATOM 0 HD1 TYR A 129 11.290 -6.074 8.005 1.00 0.00 H new ATOM 0 HD2 TYR A 129 13.492 -7.321 4.576 1.00 0.00 H new ATOM 0 HE1 TYR A 129 12.782 -7.392 9.444 1.00 0.00 H new ATOM 0 HE2 TYR A 129 14.982 -8.644 6.014 1.00 0.00 H new ATOM 0 HH TYR A 129 15.479 -9.286 8.069 1.00 0.00 H new ATOM 2027 N LYS A 130 12.675 -4.245 3.156 1.00 0.00 N ATOM 2028 CA LYS A 130 13.728 -3.970 2.186 1.00 0.00 C ATOM 2029 C LYS A 130 13.403 -2.726 1.366 1.00 0.00 C ATOM 2030 O LYS A 130 12.273 -2.237 1.383 1.00 0.00 O ATOM 2031 CB LYS A 130 13.922 -5.170 1.258 1.00 0.00 C ATOM 2032 CG LYS A 130 14.224 -6.466 1.997 1.00 0.00 C ATOM 2033 CD LYS A 130 13.165 -7.526 1.731 1.00 0.00 C ATOM 2034 CE LYS A 130 13.701 -8.645 0.852 1.00 0.00 C ATOM 2035 NZ LYS A 130 12.626 -9.281 0.043 1.00 0.00 N ATOM 0 H LYS A 130 11.842 -4.681 2.761 1.00 0.00 H new ATOM 0 HA LYS A 130 14.653 -3.790 2.734 1.00 0.00 H new ATOM 0 HB2 LYS A 130 13.022 -5.304 0.658 1.00 0.00 H new ATOM 0 HB3 LYS A 130 14.737 -4.957 0.567 1.00 0.00 H new ATOM 0 HG2 LYS A 130 15.200 -6.841 1.689 1.00 0.00 H new ATOM 0 HG3 LYS A 130 14.281 -6.270 3.068 1.00 0.00 H new ATOM 0 HD2 LYS A 130 12.819 -7.941 2.678 1.00 0.00 H new ATOM 0 HD3 LYS A 130 12.302 -7.066 1.250 1.00 0.00 H new ATOM 0 HE2 LYS A 130 14.468 -8.248 0.187 1.00 0.00 H new ATOM 0 HE3 LYS A 130 14.179 -9.399 1.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 13.034 -10.038 -0.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 11.906 -9.683 0.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 12.186 -8.567 -0.572 1.00 0.00 H new