USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1026 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 34 CYS SG : rot -8:sc= 1.33 USER MOD Set 1.2: A 83 THR OG1 : rot 129:sc= 0.135 USER MOD Set 2.1: A 61 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 104 SER OG : rot 145:sc= 0.35 USER MOD Set 2.3: A 106 GLN : amide:sc= -0.008 X(o=0.34,f=0.086) USER MOD Set 3.1: A 12 GLN :FLIP amide:sc= -2.6! C(o=-6.6!,f=-5.3!) USER MOD Set 3.2: A 15 SER OG : rot 126:sc= -2.67! USER MOD Single : A 21 ASN : amide:sc= -4.21 K(o=-4.2,f=-15!) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : no HD1:sc= -1.68! C(o=-1.7!,f=-3.1!) USER MOD Single : A 36 MET CE :methyl -131:sc= -2.19 (180deg=-7.22!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 114:sc= 0.776 USER MOD Single : A 44 THR OG1 : rot 117:sc= -0.366 USER MOD Single : A 46 CYS SG : rot 180:sc= -7.38! USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 109:sc=-0.000871 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 TYR OH : rot -151:sc= 0.038 USER MOD Single : A 77 GLN : amide:sc= -0.137 X(o=-0.14,f=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= 0.204 X(o=0.2,f=-0.17) USER MOD Single : A 85 LYS NZ :NH3+ 134:sc= -0.357 (180deg=-1.55!) USER MOD Single : A 88 GLN :FLIP amide:sc= -0.834 F(o=-3.7!,f=-0.83) USER MOD Single : A 91 HIS : no HE2:sc= 0.448 K(o=0.45,f=-5.4!) USER MOD Single : A 93 ASN : amide:sc= -0.0251 X(o=-0.025,f=0.071) USER MOD Single : A 95 GLN : amide:sc= -1.12 K(o=-1.1,f=-2.3!) USER MOD Single : A 105 ASN : amide:sc= -0.0962 K(o=-0.096,f=-3.1!) USER MOD Single : A 109 THR OG1 : rot 180:sc= -0.0318 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 MET CE :methyl -123:sc= -0.0458 (180deg=-2.25!) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 MET CE :methyl -116:sc= -10.5! (180deg=-11.6!) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl 143:sc= -3.51! (180deg=-4.22!) USER MOD Single : A 126 GLN : amide:sc=-0.00877 X(o=-0.0088,f=0) USER MOD Single : A 129 THR OG1 : rot 180:sc= 0.2 USER MOD Single : A 134 ASN : amide:sc= -0.0122 X(o=-0.012,f=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ -115:sc= 0.12 (180deg=0.0175) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ -146:sc= -0.228 (180deg=-1.08) USER MOD ----------------------------------------------------------------- ATOM 127 N GLN A 12 13.278 13.610 4.322 1.00 0.00 N ATOM 128 CA GLN A 12 13.805 12.337 4.782 1.00 0.00 C ATOM 129 C GLN A 12 12.778 11.225 4.558 1.00 0.00 C ATOM 130 O GLN A 12 11.606 11.381 4.896 1.00 0.00 O ATOM 131 CB GLN A 12 14.218 12.413 6.253 1.00 0.00 C ATOM 132 CG GLN A 12 14.382 11.014 6.850 1.00 0.00 C ATOM 133 CD GLN A 12 15.713 10.887 7.593 1.00 0.00 C ATOM 134 OE1 GLN A 12 15.912 11.829 8.511 1.00 0.00 O flip ATOM 135 NE2 GLN A 12 16.507 9.993 7.350 1.00 0.00 N flip ATOM 0 HA GLN A 12 14.697 12.104 4.200 1.00 0.00 H new ATOM 0 HB2 GLN A 12 15.155 12.963 6.343 1.00 0.00 H new ATOM 0 HB3 GLN A 12 13.468 12.967 6.817 1.00 0.00 H new ATOM 0 HG2 GLN A 12 13.559 10.808 7.534 1.00 0.00 H new ATOM 0 HG3 GLN A 12 14.332 10.268 6.057 1.00 0.00 H new ATOM 0 HE21 GLN A 12 16.292 9.301 6.632 1.00 0.00 H new ATOM 0 HE22 GLN A 12 17.386 9.937 7.865 1.00 0.00 H new ATOM 144 N PRO A 13 13.268 10.099 3.974 1.00 0.00 N ATOM 145 CA PRO A 13 12.406 8.961 3.701 1.00 0.00 C ATOM 146 C PRO A 13 12.083 8.197 4.986 1.00 0.00 C ATOM 147 O PRO A 13 12.924 7.463 5.504 1.00 0.00 O ATOM 148 CB PRO A 13 13.168 8.124 2.687 1.00 0.00 C ATOM 149 CG PRO A 13 14.617 8.575 2.780 1.00 0.00 C ATOM 150 CD PRO A 13 14.651 9.879 3.561 1.00 0.00 C ATOM 0 HA PRO A 13 11.434 9.255 3.304 1.00 0.00 H new ATOM 0 HB2 PRO A 13 13.075 7.061 2.909 1.00 0.00 H new ATOM 0 HB3 PRO A 13 12.775 8.275 1.681 1.00 0.00 H new ATOM 0 HG2 PRO A 13 15.222 7.817 3.277 1.00 0.00 H new ATOM 0 HG3 PRO A 13 15.038 8.715 1.784 1.00 0.00 H new ATOM 0 HD2 PRO A 13 15.315 9.808 4.422 1.00 0.00 H new ATOM 0 HD3 PRO A 13 15.016 10.701 2.945 1.00 0.00 H new ATOM 158 N VAL A 14 10.863 8.395 5.464 1.00 0.00 N ATOM 159 CA VAL A 14 10.419 7.733 6.679 1.00 0.00 C ATOM 160 C VAL A 14 11.638 7.334 7.513 1.00 0.00 C ATOM 161 O VAL A 14 12.160 6.230 7.368 1.00 0.00 O ATOM 162 CB VAL A 14 9.520 6.545 6.329 1.00 0.00 C ATOM 163 CG1 VAL A 14 8.079 7.001 6.088 1.00 0.00 C ATOM 164 CG2 VAL A 14 10.064 5.784 5.119 1.00 0.00 C ATOM 0 H VAL A 14 10.168 9.004 5.032 1.00 0.00 H new ATOM 0 HA VAL A 14 9.818 8.411 7.285 1.00 0.00 H new ATOM 0 HB VAL A 14 9.518 5.864 7.180 1.00 0.00 H new ATOM 0 HG11 VAL A 14 7.461 6.138 5.841 1.00 0.00 H new ATOM 0 HG12 VAL A 14 7.693 7.478 6.989 1.00 0.00 H new ATOM 0 HG13 VAL A 14 8.056 7.712 5.262 1.00 0.00 H new ATOM 0 HG21 VAL A 14 9.407 4.945 4.891 1.00 0.00 H new ATOM 0 HG22 VAL A 14 10.110 6.453 4.259 1.00 0.00 H new ATOM 0 HG23 VAL A 14 11.064 5.412 5.343 1.00 0.00 H new ATOM 174 N SER A 15 12.058 8.256 8.368 1.00 0.00 N ATOM 175 CA SER A 15 13.206 8.014 9.224 1.00 0.00 C ATOM 176 C SER A 15 12.993 6.736 10.038 1.00 0.00 C ATOM 177 O SER A 15 13.951 6.039 10.368 1.00 0.00 O ATOM 178 CB SER A 15 13.457 9.201 10.157 1.00 0.00 C ATOM 179 OG SER A 15 14.585 9.971 9.750 1.00 0.00 O ATOM 0 H SER A 15 11.623 9.171 8.486 1.00 0.00 H new ATOM 0 HA SER A 15 14.084 7.891 8.590 1.00 0.00 H new ATOM 0 HB2 SER A 15 12.573 9.838 10.180 1.00 0.00 H new ATOM 0 HB3 SER A 15 13.614 8.837 11.172 1.00 0.00 H new ATOM 0 HG SER A 15 14.322 10.910 9.652 1.00 0.00 H new ATOM 185 N LEU A 16 11.730 6.468 10.338 1.00 0.00 N ATOM 186 CA LEU A 16 11.379 5.286 11.106 1.00 0.00 C ATOM 187 C LEU A 16 10.158 4.615 10.473 1.00 0.00 C ATOM 188 O LEU A 16 9.550 5.164 9.555 1.00 0.00 O ATOM 189 CB LEU A 16 11.187 5.643 12.582 1.00 0.00 C ATOM 190 CG LEU A 16 11.176 7.137 12.914 1.00 0.00 C ATOM 191 CD1 LEU A 16 9.905 7.806 12.389 1.00 0.00 C ATOM 192 CD2 LEU A 16 11.367 7.366 14.415 1.00 0.00 C ATOM 0 H LEU A 16 10.938 7.049 10.063 1.00 0.00 H new ATOM 0 HA LEU A 16 12.192 4.560 11.080 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.247 5.209 12.921 1.00 0.00 H new ATOM 0 HB3 LEU A 16 11.983 5.169 13.157 1.00 0.00 H new ATOM 0 HG LEU A 16 12.019 7.606 12.407 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.923 8.867 12.638 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.852 7.688 11.307 1.00 0.00 H new ATOM 0 HD13 LEU A 16 9.033 7.340 12.847 1.00 0.00 H new ATOM 0 HD21 LEU A 16 11.355 8.436 14.624 1.00 0.00 H new ATOM 0 HD22 LEU A 16 10.559 6.880 14.963 1.00 0.00 H new ATOM 0 HD23 LEU A 16 12.322 6.945 14.729 1.00 0.00 H new ATOM 204 N PRO A 17 9.828 3.406 11.001 1.00 0.00 N ATOM 205 CA PRO A 17 8.691 2.655 10.497 1.00 0.00 C ATOM 206 C PRO A 17 7.373 3.265 10.979 1.00 0.00 C ATOM 207 O PRO A 17 6.332 3.079 10.351 1.00 0.00 O ATOM 208 CB PRO A 17 8.906 1.235 10.995 1.00 0.00 C ATOM 209 CG PRO A 17 9.900 1.341 12.140 1.00 0.00 C ATOM 210 CD PRO A 17 10.525 2.725 12.088 1.00 0.00 C ATOM 0 HA PRO A 17 8.622 2.675 9.409 1.00 0.00 H new ATOM 0 HB2 PRO A 17 7.968 0.793 11.332 1.00 0.00 H new ATOM 0 HB3 PRO A 17 9.292 0.597 10.200 1.00 0.00 H new ATOM 0 HG2 PRO A 17 9.400 1.184 13.096 1.00 0.00 H new ATOM 0 HG3 PRO A 17 10.667 0.572 12.052 1.00 0.00 H new ATOM 0 HD2 PRO A 17 10.397 3.253 13.033 1.00 0.00 H new ATOM 0 HD3 PRO A 17 11.597 2.669 11.897 1.00 0.00 H new ATOM 218 N GLU A 18 7.461 3.980 12.091 1.00 0.00 N ATOM 219 CA GLU A 18 6.289 4.618 12.665 1.00 0.00 C ATOM 220 C GLU A 18 5.593 5.490 11.618 1.00 0.00 C ATOM 221 O GLU A 18 4.407 5.310 11.345 1.00 0.00 O ATOM 222 CB GLU A 18 6.661 5.439 13.902 1.00 0.00 C ATOM 223 CG GLU A 18 7.596 4.651 14.822 1.00 0.00 C ATOM 224 CD GLU A 18 7.329 4.986 16.291 1.00 0.00 C ATOM 225 OE1 GLU A 18 7.051 6.174 16.560 1.00 0.00 O ATOM 226 OE2 GLU A 18 7.410 4.046 17.111 1.00 0.00 O ATOM 0 H GLU A 18 8.326 4.131 12.610 1.00 0.00 H new ATOM 0 HA GLU A 18 5.595 3.840 12.981 1.00 0.00 H new ATOM 0 HB2 GLU A 18 7.144 6.367 13.595 1.00 0.00 H new ATOM 0 HB3 GLU A 18 5.757 5.714 14.446 1.00 0.00 H new ATOM 0 HG2 GLU A 18 7.458 3.582 14.658 1.00 0.00 H new ATOM 0 HG3 GLU A 18 8.633 4.880 14.576 1.00 0.00 H new ATOM 233 N GLU A 19 6.360 6.415 11.060 1.00 0.00 N ATOM 234 CA GLU A 19 5.831 7.315 10.049 1.00 0.00 C ATOM 235 C GLU A 19 5.065 6.526 8.985 1.00 0.00 C ATOM 236 O GLU A 19 3.985 6.936 8.562 1.00 0.00 O ATOM 237 CB GLU A 19 6.950 8.145 9.416 1.00 0.00 C ATOM 238 CG GLU A 19 7.583 9.085 10.445 1.00 0.00 C ATOM 239 CD GLU A 19 6.701 10.312 10.683 1.00 0.00 C ATOM 240 OE1 GLU A 19 6.216 10.867 9.674 1.00 0.00 O ATOM 241 OE2 GLU A 19 6.532 10.667 11.870 1.00 0.00 O ATOM 0 H GLU A 19 7.343 6.561 11.289 1.00 0.00 H new ATOM 0 HA GLU A 19 5.138 8.005 10.530 1.00 0.00 H new ATOM 0 HB2 GLU A 19 7.712 7.482 9.006 1.00 0.00 H new ATOM 0 HB3 GLU A 19 6.551 8.726 8.584 1.00 0.00 H new ATOM 0 HG2 GLU A 19 7.733 8.553 11.384 1.00 0.00 H new ATOM 0 HG3 GLU A 19 8.566 9.402 10.097 1.00 0.00 H new ATOM 248 N LEU A 20 5.654 5.409 8.583 1.00 0.00 N ATOM 249 CA LEU A 20 5.040 4.560 7.577 1.00 0.00 C ATOM 250 C LEU A 20 3.735 3.984 8.129 1.00 0.00 C ATOM 251 O LEU A 20 2.815 3.682 7.370 1.00 0.00 O ATOM 252 CB LEU A 20 6.029 3.495 7.099 1.00 0.00 C ATOM 253 CG LEU A 20 5.797 2.947 5.689 1.00 0.00 C ATOM 254 CD1 LEU A 20 5.491 4.079 4.706 1.00 0.00 C ATOM 255 CD2 LEU A 20 6.981 2.094 5.231 1.00 0.00 C ATOM 0 H LEU A 20 6.550 5.073 8.936 1.00 0.00 H new ATOM 0 HA LEU A 20 4.782 5.143 6.693 1.00 0.00 H new ATOM 0 HB2 LEU A 20 7.034 3.915 7.143 1.00 0.00 H new ATOM 0 HB3 LEU A 20 6.001 2.661 7.800 1.00 0.00 H new ATOM 0 HG LEU A 20 4.923 2.296 5.714 1.00 0.00 H new ATOM 0 HD11 LEU A 20 5.330 3.663 3.711 1.00 0.00 H new ATOM 0 HD12 LEU A 20 4.594 4.608 5.028 1.00 0.00 H new ATOM 0 HD13 LEU A 20 6.331 4.773 4.678 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.791 1.717 4.226 1.00 0.00 H new ATOM 0 HD22 LEU A 20 7.886 2.701 5.225 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.111 1.255 5.915 1.00 0.00 H new ATOM 267 N ASN A 21 3.696 3.849 9.446 1.00 0.00 N ATOM 268 CA ASN A 21 2.518 3.314 10.109 1.00 0.00 C ATOM 269 C ASN A 21 1.434 4.392 10.160 1.00 0.00 C ATOM 270 O ASN A 21 0.245 4.080 10.210 1.00 0.00 O ATOM 271 CB ASN A 21 2.837 2.896 11.545 1.00 0.00 C ATOM 272 CG ASN A 21 2.829 1.372 11.687 1.00 0.00 C ATOM 273 OD1 ASN A 21 1.917 0.687 11.253 1.00 0.00 O ATOM 274 ND2 ASN A 21 3.893 0.882 12.317 1.00 0.00 N ATOM 0 H ASN A 21 4.461 4.101 10.072 1.00 0.00 H new ATOM 0 HA ASN A 21 2.180 2.443 9.547 1.00 0.00 H new ATOM 0 HB2 ASN A 21 3.813 3.287 11.833 1.00 0.00 H new ATOM 0 HB3 ASN A 21 2.106 3.332 12.226 1.00 0.00 H new ATOM 0 HD21 ASN A 21 3.982 -0.124 12.462 1.00 0.00 H new ATOM 0 HD22 ASN A 21 4.620 1.512 12.655 1.00 0.00 H new ATOM 281 N ARG A 22 1.882 5.639 10.146 1.00 0.00 N ATOM 282 CA ARG A 22 0.965 6.765 10.191 1.00 0.00 C ATOM 283 C ARG A 22 0.140 6.829 8.904 1.00 0.00 C ATOM 284 O ARG A 22 -0.966 7.366 8.897 1.00 0.00 O ATOM 285 CB ARG A 22 1.720 8.084 10.371 1.00 0.00 C ATOM 286 CG ARG A 22 2.684 8.006 11.556 1.00 0.00 C ATOM 287 CD ARG A 22 3.313 9.371 11.841 1.00 0.00 C ATOM 288 NE ARG A 22 2.637 10.011 12.991 1.00 0.00 N ATOM 289 CZ ARG A 22 2.644 11.330 13.229 1.00 0.00 C ATOM 290 NH1 ARG A 22 3.294 12.157 12.398 1.00 0.00 N ATOM 291 NH2 ARG A 22 2.003 11.821 14.298 1.00 0.00 N ATOM 0 H ARG A 22 2.869 5.894 10.104 1.00 0.00 H new ATOM 0 HA ARG A 22 0.303 6.619 11.045 1.00 0.00 H new ATOM 0 HB2 ARG A 22 2.274 8.317 9.462 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.009 8.895 10.528 1.00 0.00 H new ATOM 0 HG2 ARG A 22 2.152 7.655 12.440 1.00 0.00 H new ATOM 0 HG3 ARG A 22 3.467 7.278 11.345 1.00 0.00 H new ATOM 0 HD2 ARG A 22 4.376 9.253 12.053 1.00 0.00 H new ATOM 0 HD3 ARG A 22 3.232 10.009 10.961 1.00 0.00 H new ATOM 0 HE ARG A 22 2.134 9.410 13.644 1.00 0.00 H new ATOM 0 HH11 ARG A 22 3.783 11.782 11.585 1.00 0.00 H new ATOM 0 HH12 ARG A 22 3.300 13.161 12.579 1.00 0.00 H new ATOM 0 HH21 ARG A 22 1.510 11.191 14.931 1.00 0.00 H new ATOM 0 HH22 ARG A 22 2.008 12.825 14.479 1.00 0.00 H new ATOM 305 N VAL A 23 0.711 6.273 7.845 1.00 0.00 N ATOM 306 CA VAL A 23 0.042 6.260 6.555 1.00 0.00 C ATOM 307 C VAL A 23 -0.187 4.811 6.119 1.00 0.00 C ATOM 308 O VAL A 23 -0.482 4.550 4.954 1.00 0.00 O ATOM 309 CB VAL A 23 0.849 7.070 5.539 1.00 0.00 C ATOM 310 CG1 VAL A 23 0.809 8.563 5.872 1.00 0.00 C ATOM 311 CG2 VAL A 23 2.291 6.565 5.457 1.00 0.00 C ATOM 0 H VAL A 23 1.629 5.828 7.854 1.00 0.00 H new ATOM 0 HA VAL A 23 -0.936 6.736 6.627 1.00 0.00 H new ATOM 0 HB VAL A 23 0.390 6.933 4.560 1.00 0.00 H new ATOM 0 HG11 VAL A 23 1.390 9.116 5.134 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -0.224 8.912 5.856 1.00 0.00 H new ATOM 0 HG13 VAL A 23 1.232 8.726 6.863 1.00 0.00 H new ATOM 0 HG21 VAL A 23 2.843 7.158 4.728 1.00 0.00 H new ATOM 0 HG22 VAL A 23 2.765 6.658 6.434 1.00 0.00 H new ATOM 0 HG23 VAL A 23 2.293 5.519 5.151 1.00 0.00 H new ATOM 321 N ARG A 24 -0.041 3.908 7.077 1.00 0.00 N ATOM 322 CA ARG A 24 -0.228 2.493 6.806 1.00 0.00 C ATOM 323 C ARG A 24 -1.712 2.129 6.886 1.00 0.00 C ATOM 324 O ARG A 24 -2.213 1.782 7.955 1.00 0.00 O ATOM 325 CB ARG A 24 0.555 1.634 7.801 1.00 0.00 C ATOM 326 CG ARG A 24 0.311 0.144 7.549 1.00 0.00 C ATOM 327 CD ARG A 24 0.546 -0.672 8.822 1.00 0.00 C ATOM 328 NE ARG A 24 -0.527 -0.399 9.804 1.00 0.00 N ATOM 329 CZ ARG A 24 -1.724 -1.000 9.795 1.00 0.00 C ATOM 330 NH1 ARG A 24 -2.009 -1.912 8.856 1.00 0.00 N ATOM 331 NH2 ARG A 24 -2.637 -0.689 10.726 1.00 0.00 N ATOM 0 H ARG A 24 0.205 4.129 8.042 1.00 0.00 H new ATOM 0 HA ARG A 24 0.144 2.296 5.801 1.00 0.00 H new ATOM 0 HB2 ARG A 24 1.620 1.851 7.716 1.00 0.00 H new ATOM 0 HB3 ARG A 24 0.258 1.888 8.819 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -0.710 -0.007 7.199 1.00 0.00 H new ATOM 0 HG3 ARG A 24 0.974 -0.208 6.759 1.00 0.00 H new ATOM 0 HD2 ARG A 24 0.570 -1.735 8.583 1.00 0.00 H new ATOM 0 HD3 ARG A 24 1.516 -0.420 9.251 1.00 0.00 H new ATOM 0 HE ARG A 24 -0.344 0.290 10.533 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -1.314 -2.149 8.148 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -2.921 -2.370 8.849 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -2.420 0.005 11.441 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -3.549 -1.147 10.719 1.00 0.00 H new ATOM 345 N LEU A 25 -2.373 2.219 5.741 1.00 0.00 N ATOM 346 CA LEU A 25 -3.790 1.903 5.668 1.00 0.00 C ATOM 347 C LEU A 25 -4.045 0.561 6.357 1.00 0.00 C ATOM 348 O LEU A 25 -3.149 -0.277 6.442 1.00 0.00 O ATOM 349 CB LEU A 25 -4.275 1.953 4.218 1.00 0.00 C ATOM 350 CG LEU A 25 -5.053 3.207 3.814 1.00 0.00 C ATOM 351 CD1 LEU A 25 -5.597 3.079 2.390 1.00 0.00 C ATOM 352 CD2 LEU A 25 -6.159 3.517 4.824 1.00 0.00 C ATOM 0 H LEU A 25 -1.954 2.506 4.857 1.00 0.00 H new ATOM 0 HA LEU A 25 -4.376 2.651 6.202 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.409 1.860 3.563 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.907 1.083 4.037 1.00 0.00 H new ATOM 0 HG LEU A 25 -4.365 4.052 3.822 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -6.146 3.983 2.128 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.769 2.943 1.695 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -6.265 2.220 2.332 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.696 4.413 4.512 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -6.852 2.677 4.873 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.718 3.682 5.807 1.00 0.00 H new ATOM 364 N SER A 26 -5.271 0.399 6.831 1.00 0.00 N ATOM 365 CA SER A 26 -5.656 -0.827 7.509 1.00 0.00 C ATOM 366 C SER A 26 -6.947 -1.379 6.902 1.00 0.00 C ATOM 367 O SER A 26 -7.887 -0.628 6.645 1.00 0.00 O ATOM 368 CB SER A 26 -5.833 -0.593 9.011 1.00 0.00 C ATOM 369 OG SER A 26 -6.725 0.485 9.281 1.00 0.00 O ATOM 0 H SER A 26 -6.011 1.097 6.759 1.00 0.00 H new ATOM 0 HA SER A 26 -4.858 -1.557 7.374 1.00 0.00 H new ATOM 0 HB2 SER A 26 -6.211 -1.502 9.478 1.00 0.00 H new ATOM 0 HB3 SER A 26 -4.863 -0.383 9.462 1.00 0.00 H new ATOM 0 HG SER A 26 -6.813 0.602 10.250 1.00 0.00 H new ATOM 375 N ARG A 27 -6.951 -2.686 6.689 1.00 0.00 N ATOM 376 CA ARG A 27 -8.111 -3.347 6.116 1.00 0.00 C ATOM 377 C ARG A 27 -9.399 -2.701 6.631 1.00 0.00 C ATOM 378 O ARG A 27 -10.345 -2.503 5.871 1.00 0.00 O ATOM 379 CB ARG A 27 -8.123 -4.838 6.462 1.00 0.00 C ATOM 380 CG ARG A 27 -8.771 -5.656 5.344 1.00 0.00 C ATOM 381 CD ARG A 27 -8.658 -7.155 5.625 1.00 0.00 C ATOM 382 NE ARG A 27 -9.606 -7.543 6.693 1.00 0.00 N ATOM 383 CZ ARG A 27 -9.335 -7.460 8.003 1.00 0.00 C ATOM 384 NH1 ARG A 27 -8.144 -7.003 8.414 1.00 0.00 N ATOM 385 NH2 ARG A 27 -10.256 -7.834 8.902 1.00 0.00 N ATOM 0 H ARG A 27 -6.169 -3.305 6.903 1.00 0.00 H new ATOM 0 HA ARG A 27 -8.053 -3.237 5.033 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -7.103 -5.185 6.626 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -8.667 -4.994 7.394 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -9.821 -5.379 5.247 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -8.291 -5.423 4.393 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -8.869 -7.720 4.717 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -7.639 -7.401 5.925 1.00 0.00 H new ATOM 0 HE ARG A 27 -10.522 -7.895 6.415 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -7.443 -6.718 7.730 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -7.938 -6.940 9.411 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -11.162 -8.182 8.589 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -10.050 -7.771 9.899 1.00 0.00 H new ATOM 399 N HIS A 28 -9.393 -2.390 7.919 1.00 0.00 N ATOM 400 CA HIS A 28 -10.548 -1.770 8.545 1.00 0.00 C ATOM 401 C HIS A 28 -10.944 -0.516 7.764 1.00 0.00 C ATOM 402 O HIS A 28 -12.024 -0.460 7.178 1.00 0.00 O ATOM 403 CB HIS A 28 -10.279 -1.487 10.024 1.00 0.00 C ATOM 404 CG HIS A 28 -10.457 -2.688 10.922 1.00 0.00 C ATOM 405 ND1 HIS A 28 -11.071 -2.615 12.160 1.00 0.00 N ATOM 406 CD2 HIS A 28 -10.096 -3.992 10.748 1.00 0.00 C ATOM 407 CE1 HIS A 28 -11.073 -3.825 12.699 1.00 0.00 C ATOM 408 NE2 HIS A 28 -10.468 -4.677 11.822 1.00 0.00 N ATOM 0 H HIS A 28 -8.606 -2.556 8.546 1.00 0.00 H new ATOM 0 HA HIS A 28 -11.394 -2.457 8.515 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -9.261 -1.113 10.132 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -10.947 -0.694 10.359 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -9.593 -4.398 9.883 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -11.482 -4.090 13.663 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -10.325 -5.676 11.968 1.00 0.00 H new ATOM 416 N LYS A 29 -10.047 0.460 7.781 1.00 0.00 N ATOM 417 CA LYS A 29 -10.289 1.710 7.081 1.00 0.00 C ATOM 418 C LYS A 29 -10.705 1.411 5.640 1.00 0.00 C ATOM 419 O LYS A 29 -11.665 1.991 5.134 1.00 0.00 O ATOM 420 CB LYS A 29 -9.071 2.630 7.192 1.00 0.00 C ATOM 421 CG LYS A 29 -9.039 3.336 8.548 1.00 0.00 C ATOM 422 CD LYS A 29 -7.792 4.213 8.680 1.00 0.00 C ATOM 423 CE LYS A 29 -8.054 5.403 9.606 1.00 0.00 C ATOM 424 NZ LYS A 29 -7.940 4.993 11.023 1.00 0.00 N ATOM 0 H LYS A 29 -9.152 0.410 8.268 1.00 0.00 H new ATOM 0 HA LYS A 29 -11.113 2.253 7.544 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -8.159 2.049 7.059 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -9.096 3.371 6.393 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -9.933 3.949 8.664 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -9.054 2.596 9.348 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.965 3.619 9.070 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -7.490 4.573 7.696 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -7.342 6.200 9.394 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -9.049 5.806 9.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -8.121 5.813 11.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -8.637 4.248 11.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -6.982 4.630 11.203 1.00 0.00 H new ATOM 438 N LEU A 30 -9.962 0.506 5.019 1.00 0.00 N ATOM 439 CA LEU A 30 -10.242 0.123 3.646 1.00 0.00 C ATOM 440 C LEU A 30 -11.678 -0.397 3.548 1.00 0.00 C ATOM 441 O LEU A 30 -12.442 0.037 2.687 1.00 0.00 O ATOM 442 CB LEU A 30 -9.193 -0.870 3.142 1.00 0.00 C ATOM 443 CG LEU A 30 -7.805 -0.293 2.858 1.00 0.00 C ATOM 444 CD1 LEU A 30 -6.760 -1.405 2.749 1.00 0.00 C ATOM 445 CD2 LEU A 30 -7.825 0.599 1.615 1.00 0.00 C ATOM 0 H LEU A 30 -9.167 0.027 5.442 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.171 0.989 2.987 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.090 -1.665 3.880 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -9.567 -1.331 2.228 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.518 0.336 3.701 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -5.782 -0.967 2.547 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -6.722 -1.961 3.686 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -7.030 -2.080 1.937 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -6.826 0.996 1.436 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -8.143 0.014 0.752 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -8.521 1.424 1.770 1.00 0.00 H new ATOM 457 N GLU A 31 -12.001 -1.320 4.442 1.00 0.00 N ATOM 458 CA GLU A 31 -13.331 -1.904 4.468 1.00 0.00 C ATOM 459 C GLU A 31 -14.391 -0.805 4.562 1.00 0.00 C ATOM 460 O GLU A 31 -15.550 -1.023 4.211 1.00 0.00 O ATOM 461 CB GLU A 31 -13.471 -2.900 5.620 1.00 0.00 C ATOM 462 CG GLU A 31 -14.541 -3.949 5.312 1.00 0.00 C ATOM 463 CD GLU A 31 -15.755 -3.780 6.228 1.00 0.00 C ATOM 464 OE1 GLU A 31 -16.385 -2.704 6.141 1.00 0.00 O ATOM 465 OE2 GLU A 31 -16.024 -4.730 6.994 1.00 0.00 O ATOM 0 H GLU A 31 -11.364 -1.678 5.154 1.00 0.00 H new ATOM 0 HA GLU A 31 -13.484 -2.452 3.538 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -12.515 -3.392 5.798 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -13.731 -2.368 6.535 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -14.852 -3.862 4.271 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -14.123 -4.948 5.437 1.00 0.00 H new ATOM 472 N ARG A 32 -13.957 0.353 5.037 1.00 0.00 N ATOM 473 CA ARG A 32 -14.854 1.487 5.182 1.00 0.00 C ATOM 474 C ARG A 32 -14.738 2.414 3.970 1.00 0.00 C ATOM 475 O ARG A 32 -15.747 2.805 3.385 1.00 0.00 O ATOM 476 CB ARG A 32 -14.541 2.279 6.453 1.00 0.00 C ATOM 477 CG ARG A 32 -14.035 1.356 7.563 1.00 0.00 C ATOM 478 CD ARG A 32 -14.689 1.700 8.903 1.00 0.00 C ATOM 479 NE ARG A 32 -14.538 0.569 9.846 1.00 0.00 N ATOM 480 CZ ARG A 32 -15.227 0.446 10.988 1.00 0.00 C ATOM 481 NH1 ARG A 32 -16.119 1.383 11.337 1.00 0.00 N ATOM 482 NH2 ARG A 32 -15.024 -0.614 11.782 1.00 0.00 N ATOM 0 H ARG A 32 -12.995 0.531 5.327 1.00 0.00 H new ATOM 0 HA ARG A 32 -15.870 1.099 5.251 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -13.790 3.039 6.237 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -15.436 2.802 6.790 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -14.250 0.319 7.305 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -12.952 1.445 7.649 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -14.231 2.596 9.321 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.746 1.922 8.755 1.00 0.00 H new ATOM 0 HE ARG A 32 -13.867 -0.163 9.611 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -16.273 2.190 10.733 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -16.644 1.289 12.207 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -14.345 -1.327 11.517 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -15.549 -0.708 12.652 1.00 0.00 H new ATOM 496 N TRP A 33 -13.500 2.738 3.630 1.00 0.00 N ATOM 497 CA TRP A 33 -13.239 3.612 2.499 1.00 0.00 C ATOM 498 C TRP A 33 -13.640 2.867 1.224 1.00 0.00 C ATOM 499 O TRP A 33 -13.796 3.477 0.167 1.00 0.00 O ATOM 500 CB TRP A 33 -11.780 4.073 2.487 1.00 0.00 C ATOM 501 CG TRP A 33 -11.295 4.638 3.824 1.00 0.00 C ATOM 502 CD1 TRP A 33 -11.989 4.775 4.962 1.00 0.00 C ATOM 503 CD2 TRP A 33 -9.974 5.139 4.117 1.00 0.00 C ATOM 504 NE1 TRP A 33 -11.216 5.325 5.963 1.00 0.00 N ATOM 505 CE2 TRP A 33 -9.951 5.554 5.433 1.00 0.00 C ATOM 506 CE3 TRP A 33 -8.836 5.238 3.297 1.00 0.00 C ATOM 507 CZ2 TRP A 33 -8.815 6.096 6.046 1.00 0.00 C ATOM 508 CZ3 TRP A 33 -7.709 5.783 3.925 1.00 0.00 C ATOM 509 CH2 TRP A 33 -7.670 6.205 5.249 1.00 0.00 C ATOM 0 H TRP A 33 -12.666 2.411 4.118 1.00 0.00 H new ATOM 0 HA TRP A 33 -13.832 4.524 2.572 1.00 0.00 H new ATOM 0 HB2 TRP A 33 -11.146 3.231 2.208 1.00 0.00 H new ATOM 0 HB3 TRP A 33 -11.656 4.834 1.716 1.00 0.00 H new ATOM 0 HD1 TRP A 33 -13.024 4.490 5.081 1.00 0.00 H new ATOM 0 HE1 TRP A 33 -11.517 5.527 6.917 1.00 0.00 H new ATOM 0 HE3 TRP A 33 -8.831 4.919 2.265 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 -8.822 6.413 7.078 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 -6.807 5.882 3.340 1.00 0.00 H new ATOM 0 HH2 TRP A 33 -6.760 6.615 5.661 1.00 0.00 H new ATOM 520 N CYS A 34 -13.797 1.559 1.365 1.00 0.00 N ATOM 521 CA CYS A 34 -14.177 0.724 0.238 1.00 0.00 C ATOM 522 C CYS A 34 -15.603 1.095 -0.174 1.00 0.00 C ATOM 523 O CYS A 34 -16.059 0.719 -1.253 1.00 0.00 O ATOM 524 CB CYS A 34 -14.046 -0.764 0.566 1.00 0.00 C ATOM 525 SG CYS A 34 -15.108 -1.748 -0.553 1.00 0.00 S ATOM 0 H CYS A 34 -13.668 1.057 2.243 1.00 0.00 H new ATOM 0 HA CYS A 34 -13.500 0.905 -0.597 1.00 0.00 H new ATOM 0 HB2 CYS A 34 -13.007 -1.077 0.463 1.00 0.00 H new ATOM 0 HB3 CYS A 34 -14.332 -0.943 1.603 1.00 0.00 H new ATOM 0 HG CYS A 34 -15.851 -0.949 -1.260 1.00 0.00 H new ATOM 531 N HIS A 35 -16.269 1.826 0.708 1.00 0.00 N ATOM 532 CA HIS A 35 -17.634 2.251 0.449 1.00 0.00 C ATOM 533 C HIS A 35 -17.671 3.769 0.257 1.00 0.00 C ATOM 534 O HIS A 35 -18.746 4.365 0.204 1.00 0.00 O ATOM 535 CB HIS A 35 -18.572 1.771 1.559 1.00 0.00 C ATOM 536 CG HIS A 35 -19.202 2.888 2.357 1.00 0.00 C ATOM 537 ND1 HIS A 35 -20.349 3.546 1.949 1.00 0.00 N ATOM 538 CD2 HIS A 35 -18.833 3.455 3.541 1.00 0.00 C ATOM 539 CE1 HIS A 35 -20.648 4.466 2.854 1.00 0.00 C ATOM 540 NE2 HIS A 35 -19.707 4.408 3.840 1.00 0.00 N ATOM 0 H HIS A 35 -15.889 2.135 1.603 1.00 0.00 H new ATOM 0 HA HIS A 35 -17.992 1.794 -0.473 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -19.362 1.165 1.116 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -18.015 1.124 2.236 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -17.975 3.176 4.135 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -21.489 5.143 2.818 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -19.680 5.000 4.670 1.00 0.00 H new ATOM 548 N MET A 36 -16.485 4.350 0.157 1.00 0.00 N ATOM 549 CA MET A 36 -16.368 5.786 -0.029 1.00 0.00 C ATOM 550 C MET A 36 -15.905 6.119 -1.448 1.00 0.00 C ATOM 551 O MET A 36 -15.346 5.268 -2.139 1.00 0.00 O ATOM 552 CB MET A 36 -15.368 6.352 0.981 1.00 0.00 C ATOM 553 CG MET A 36 -15.742 5.947 2.409 1.00 0.00 C ATOM 554 SD MET A 36 -17.248 6.768 2.902 1.00 0.00 S ATOM 555 CE MET A 36 -16.566 8.147 3.807 1.00 0.00 C ATOM 0 H MET A 36 -15.596 3.852 0.201 1.00 0.00 H new ATOM 0 HA MET A 36 -17.349 6.235 0.127 1.00 0.00 H new ATOM 0 HB2 MET A 36 -14.366 5.991 0.747 1.00 0.00 H new ATOM 0 HB3 MET A 36 -15.342 7.439 0.902 1.00 0.00 H new ATOM 0 HG2 MET A 36 -15.872 4.866 2.467 1.00 0.00 H new ATOM 0 HG3 MET A 36 -14.935 6.209 3.093 1.00 0.00 H new ATOM 0 HE1 MET A 36 -17.065 8.231 4.772 1.00 0.00 H new ATOM 0 HE2 MET A 36 -15.499 7.988 3.963 1.00 0.00 H new ATOM 0 HE3 MET A 36 -16.717 9.065 3.239 1.00 0.00 H new ATOM 565 N PRO A 37 -16.160 7.393 -1.852 1.00 0.00 N ATOM 566 CA PRO A 37 -15.775 7.849 -3.177 1.00 0.00 C ATOM 567 C PRO A 37 -14.266 8.090 -3.257 1.00 0.00 C ATOM 568 O PRO A 37 -13.607 7.616 -4.181 1.00 0.00 O ATOM 569 CB PRO A 37 -16.590 9.111 -3.410 1.00 0.00 C ATOM 570 CG PRO A 37 -17.050 9.571 -2.037 1.00 0.00 C ATOM 571 CD PRO A 37 -16.819 8.428 -1.061 1.00 0.00 C ATOM 0 HA PRO A 37 -15.978 7.110 -3.952 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -15.990 9.879 -3.898 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -17.442 8.911 -4.060 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -16.496 10.457 -1.726 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -18.104 9.846 -2.060 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -16.197 8.742 -0.223 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -17.759 8.068 -0.643 1.00 0.00 H new ATOM 579 N PHE A 38 -13.763 8.825 -2.276 1.00 0.00 N ATOM 580 CA PHE A 38 -12.344 9.134 -2.224 1.00 0.00 C ATOM 581 C PHE A 38 -11.545 7.949 -1.677 1.00 0.00 C ATOM 582 O PHE A 38 -10.727 8.111 -0.773 1.00 0.00 O ATOM 583 CB PHE A 38 -12.180 10.324 -1.277 1.00 0.00 C ATOM 584 CG PHE A 38 -12.958 10.189 0.033 1.00 0.00 C ATOM 585 CD1 PHE A 38 -12.406 9.531 1.088 1.00 0.00 C ATOM 586 CD2 PHE A 38 -14.203 10.728 0.144 1.00 0.00 C ATOM 587 CE1 PHE A 38 -13.129 9.406 2.304 1.00 0.00 C ATOM 588 CE2 PHE A 38 -14.925 10.602 1.360 1.00 0.00 C ATOM 589 CZ PHE A 38 -14.373 9.944 2.414 1.00 0.00 C ATOM 0 H PHE A 38 -14.313 9.216 -1.511 1.00 0.00 H new ATOM 0 HA PHE A 38 -11.975 9.356 -3.225 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -11.122 10.450 -1.048 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -12.505 11.230 -1.789 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -11.418 9.104 1.001 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -14.642 11.251 -0.693 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -12.691 8.884 3.141 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -15.913 11.029 1.448 1.00 0.00 H new ATOM 0 HZ PHE A 38 -14.923 9.849 3.339 1.00 0.00 H new ATOM 599 N PHE A 39 -11.810 6.783 -2.249 1.00 0.00 N ATOM 600 CA PHE A 39 -11.125 5.572 -1.831 1.00 0.00 C ATOM 601 C PHE A 39 -9.803 5.402 -2.581 1.00 0.00 C ATOM 602 O PHE A 39 -8.730 5.521 -1.991 1.00 0.00 O ATOM 603 CB PHE A 39 -12.046 4.398 -2.172 1.00 0.00 C ATOM 604 CG PHE A 39 -11.448 3.026 -1.853 1.00 0.00 C ATOM 605 CD1 PHE A 39 -11.265 2.648 -0.559 1.00 0.00 C ATOM 606 CD2 PHE A 39 -11.101 2.184 -2.863 1.00 0.00 C ATOM 607 CE1 PHE A 39 -10.710 1.375 -0.263 1.00 0.00 C ATOM 608 CE2 PHE A 39 -10.546 0.911 -2.567 1.00 0.00 C ATOM 609 CZ PHE A 39 -10.363 0.533 -1.274 1.00 0.00 C ATOM 0 H PHE A 39 -12.490 6.652 -2.998 1.00 0.00 H new ATOM 0 HA PHE A 39 -10.903 5.619 -0.765 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -12.981 4.512 -1.624 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -12.292 4.438 -3.233 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -11.542 3.316 0.243 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -11.248 2.484 -3.890 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -10.563 1.075 0.764 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -10.269 0.243 -3.369 1.00 0.00 H new ATOM 0 HZ PHE A 39 -9.942 -0.436 -1.049 1.00 0.00 H new ATOM 619 N ALA A 40 -9.923 5.127 -3.872 1.00 0.00 N ATOM 620 CA ALA A 40 -8.750 4.940 -4.709 1.00 0.00 C ATOM 621 C ALA A 40 -7.831 6.156 -4.572 1.00 0.00 C ATOM 622 O ALA A 40 -6.621 6.008 -4.408 1.00 0.00 O ATOM 623 CB ALA A 40 -9.188 4.702 -6.156 1.00 0.00 C ATOM 0 H ALA A 40 -10.814 5.029 -4.358 1.00 0.00 H new ATOM 0 HA ALA A 40 -8.187 4.063 -4.389 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -8.308 4.562 -6.784 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -9.814 3.811 -6.205 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.754 5.563 -6.511 1.00 0.00 H new ATOM 629 N LYS A 41 -8.441 7.330 -4.643 1.00 0.00 N ATOM 630 CA LYS A 41 -7.693 8.570 -4.529 1.00 0.00 C ATOM 631 C LYS A 41 -6.913 8.570 -3.212 1.00 0.00 C ATOM 632 O LYS A 41 -5.716 8.853 -3.195 1.00 0.00 O ATOM 633 CB LYS A 41 -8.622 9.774 -4.693 1.00 0.00 C ATOM 634 CG LYS A 41 -7.825 11.046 -4.986 1.00 0.00 C ATOM 635 CD LYS A 41 -7.481 11.788 -3.693 1.00 0.00 C ATOM 636 CE LYS A 41 -7.348 13.292 -3.942 1.00 0.00 C ATOM 637 NZ LYS A 41 -6.107 13.811 -3.324 1.00 0.00 N ATOM 0 H LYS A 41 -9.445 7.448 -4.778 1.00 0.00 H new ATOM 0 HA LYS A 41 -6.962 8.649 -5.334 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -9.326 9.587 -5.504 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -9.210 9.910 -3.785 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -6.908 10.791 -5.518 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -8.402 11.698 -5.641 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -8.256 11.606 -2.948 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -6.548 11.400 -3.284 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -7.338 13.490 -5.014 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -8.212 13.813 -3.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -6.032 14.833 -3.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -6.132 13.639 -2.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -5.285 13.326 -3.737 1.00 0.00 H new ATOM 651 N THR A 42 -7.624 8.251 -2.140 1.00 0.00 N ATOM 652 CA THR A 42 -7.014 8.211 -0.822 1.00 0.00 C ATOM 653 C THR A 42 -6.034 7.041 -0.724 1.00 0.00 C ATOM 654 O THR A 42 -4.820 7.243 -0.707 1.00 0.00 O ATOM 655 CB THR A 42 -8.136 8.152 0.216 1.00 0.00 C ATOM 656 OG1 THR A 42 -8.858 9.365 0.017 1.00 0.00 O ATOM 657 CG2 THR A 42 -7.614 8.262 1.650 1.00 0.00 C ATOM 0 H THR A 42 -8.617 8.018 -2.158 1.00 0.00 H new ATOM 0 HA THR A 42 -6.422 9.107 -0.632 1.00 0.00 H new ATOM 0 HB THR A 42 -8.687 7.219 0.100 1.00 0.00 H new ATOM 0 HG1 THR A 42 -9.754 9.160 -0.322 1.00 0.00 H new ATOM 0 HG21 THR A 42 -8.451 8.215 2.347 1.00 0.00 H new ATOM 0 HG22 THR A 42 -6.927 7.440 1.851 1.00 0.00 H new ATOM 0 HG23 THR A 42 -7.091 9.210 1.775 1.00 0.00 H new ATOM 665 N VAL A 43 -6.596 5.843 -0.661 1.00 0.00 N ATOM 666 CA VAL A 43 -5.786 4.640 -0.565 1.00 0.00 C ATOM 667 C VAL A 43 -4.507 4.825 -1.384 1.00 0.00 C ATOM 668 O VAL A 43 -3.437 4.372 -0.981 1.00 0.00 O ATOM 669 CB VAL A 43 -6.604 3.422 -0.999 1.00 0.00 C ATOM 670 CG1 VAL A 43 -7.866 3.277 -0.145 1.00 0.00 C ATOM 671 CG2 VAL A 43 -6.954 3.499 -2.486 1.00 0.00 C ATOM 0 H VAL A 43 -7.603 5.679 -0.675 1.00 0.00 H new ATOM 0 HA VAL A 43 -5.487 4.462 0.468 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.991 2.534 -0.845 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -8.430 2.404 -0.474 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -7.585 3.155 0.901 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -8.483 4.169 -0.253 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -7.535 2.621 -2.769 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -7.539 4.399 -2.676 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -6.037 3.532 -3.074 1.00 0.00 H new ATOM 681 N THR A 44 -4.661 5.489 -2.520 1.00 0.00 N ATOM 682 CA THR A 44 -3.532 5.739 -3.400 1.00 0.00 C ATOM 683 C THR A 44 -2.484 6.599 -2.691 1.00 0.00 C ATOM 684 O THR A 44 -2.679 7.800 -2.512 1.00 0.00 O ATOM 685 CB THR A 44 -4.067 6.370 -4.687 1.00 0.00 C ATOM 686 OG1 THR A 44 -4.617 5.272 -5.410 1.00 0.00 O ATOM 687 CG2 THR A 44 -2.948 6.889 -5.593 1.00 0.00 C ATOM 0 H THR A 44 -5.551 5.862 -2.851 1.00 0.00 H new ATOM 0 HA THR A 44 -3.022 4.812 -3.663 1.00 0.00 H new ATOM 0 HB THR A 44 -4.741 7.189 -4.437 1.00 0.00 H new ATOM 0 HG1 THR A 44 -5.582 5.403 -5.520 1.00 0.00 H new ATOM 0 HG21 THR A 44 -3.381 7.327 -6.492 1.00 0.00 H new ATOM 0 HG22 THR A 44 -2.372 7.647 -5.062 1.00 0.00 H new ATOM 0 HG23 THR A 44 -2.293 6.064 -5.871 1.00 0.00 H new ATOM 695 N GLY A 45 -1.394 5.950 -2.307 1.00 0.00 N ATOM 696 CA GLY A 45 -0.315 6.641 -1.622 1.00 0.00 C ATOM 697 C GLY A 45 -0.074 6.041 -0.235 1.00 0.00 C ATOM 698 O GLY A 45 1.035 6.115 0.293 1.00 0.00 O ATOM 0 H GLY A 45 -1.235 4.954 -2.457 1.00 0.00 H new ATOM 0 HA2 GLY A 45 0.598 6.575 -2.214 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -0.558 7.699 -1.527 1.00 0.00 H new ATOM 702 N CYS A 46 -1.130 5.462 0.316 1.00 0.00 N ATOM 703 CA CYS A 46 -1.047 4.850 1.631 1.00 0.00 C ATOM 704 C CYS A 46 -0.304 3.519 1.496 1.00 0.00 C ATOM 705 O CYS A 46 -0.113 3.020 0.388 1.00 0.00 O ATOM 706 CB CYS A 46 -2.431 4.670 2.259 1.00 0.00 C ATOM 707 SG CYS A 46 -3.096 6.293 2.783 1.00 0.00 S ATOM 0 H CYS A 46 -2.048 5.404 -0.124 1.00 0.00 H new ATOM 0 HA CYS A 46 -0.496 5.505 2.306 1.00 0.00 H new ATOM 0 HB2 CYS A 46 -3.107 4.205 1.542 1.00 0.00 H new ATOM 0 HB3 CYS A 46 -2.366 4.000 3.116 1.00 0.00 H new ATOM 0 HG CYS A 46 -4.272 6.130 3.313 1.00 0.00 H new ATOM 713 N PHE A 47 0.095 2.983 2.640 1.00 0.00 N ATOM 714 CA PHE A 47 0.813 1.720 2.664 1.00 0.00 C ATOM 715 C PHE A 47 0.028 0.657 3.436 1.00 0.00 C ATOM 716 O PHE A 47 -0.720 0.981 4.358 1.00 0.00 O ATOM 717 CB PHE A 47 2.142 1.974 3.378 1.00 0.00 C ATOM 718 CG PHE A 47 3.149 2.776 2.551 1.00 0.00 C ATOM 719 CD1 PHE A 47 2.880 4.067 2.217 1.00 0.00 C ATOM 720 CD2 PHE A 47 4.313 2.198 2.149 1.00 0.00 C ATOM 721 CE1 PHE A 47 3.815 4.811 1.450 1.00 0.00 C ATOM 722 CE2 PHE A 47 5.247 2.942 1.382 1.00 0.00 C ATOM 723 CZ PHE A 47 4.979 4.233 1.048 1.00 0.00 C ATOM 0 H PHE A 47 -0.065 3.400 3.557 1.00 0.00 H new ATOM 0 HA PHE A 47 0.960 1.357 1.647 1.00 0.00 H new ATOM 0 HB2 PHE A 47 1.947 2.506 4.309 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.588 1.016 3.645 1.00 0.00 H new ATOM 0 HD1 PHE A 47 1.956 4.526 2.535 1.00 0.00 H new ATOM 0 HD2 PHE A 47 4.526 1.173 2.414 1.00 0.00 H new ATOM 0 HE1 PHE A 47 3.602 5.836 1.186 1.00 0.00 H new ATOM 0 HE2 PHE A 47 6.171 2.483 1.063 1.00 0.00 H new ATOM 0 HZ PHE A 47 5.690 4.799 0.464 1.00 0.00 H new ATOM 733 N VAL A 48 0.225 -0.589 3.032 1.00 0.00 N ATOM 734 CA VAL A 48 -0.455 -1.701 3.674 1.00 0.00 C ATOM 735 C VAL A 48 0.496 -2.897 3.754 1.00 0.00 C ATOM 736 O VAL A 48 1.424 -3.011 2.954 1.00 0.00 O ATOM 737 CB VAL A 48 -1.755 -2.018 2.932 1.00 0.00 C ATOM 738 CG1 VAL A 48 -2.735 -0.846 3.017 1.00 0.00 C ATOM 739 CG2 VAL A 48 -1.476 -2.396 1.476 1.00 0.00 C ATOM 0 H VAL A 48 0.846 -0.853 2.267 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.735 -1.440 4.695 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.218 -2.877 3.418 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.650 -1.098 2.481 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.970 -0.643 4.062 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.284 0.039 2.568 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.416 -2.617 0.971 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -0.980 -1.566 0.973 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.833 -3.275 1.445 1.00 0.00 H new ATOM 749 N ARG A 49 0.232 -3.758 4.725 1.00 0.00 N ATOM 750 CA ARG A 49 1.052 -4.942 4.919 1.00 0.00 C ATOM 751 C ARG A 49 0.404 -6.153 4.246 1.00 0.00 C ATOM 752 O ARG A 49 -0.747 -6.483 4.529 1.00 0.00 O ATOM 753 CB ARG A 49 1.248 -5.238 6.407 1.00 0.00 C ATOM 754 CG ARG A 49 2.724 -5.477 6.729 1.00 0.00 C ATOM 755 CD ARG A 49 2.991 -5.322 8.228 1.00 0.00 C ATOM 756 NE ARG A 49 3.516 -6.590 8.782 1.00 0.00 N ATOM 757 CZ ARG A 49 3.610 -6.854 10.092 1.00 0.00 C ATOM 758 NH1 ARG A 49 3.216 -5.942 10.990 1.00 0.00 N ATOM 759 NH2 ARG A 49 4.099 -8.032 10.504 1.00 0.00 N ATOM 0 H ARG A 49 -0.538 -3.660 5.386 1.00 0.00 H new ATOM 0 HA ARG A 49 2.025 -4.749 4.467 1.00 0.00 H new ATOM 0 HB2 ARG A 49 0.873 -4.404 7.000 1.00 0.00 H new ATOM 0 HB3 ARG A 49 0.664 -6.115 6.687 1.00 0.00 H new ATOM 0 HG2 ARG A 49 3.013 -6.477 6.406 1.00 0.00 H new ATOM 0 HG3 ARG A 49 3.340 -4.772 6.171 1.00 0.00 H new ATOM 0 HD2 ARG A 49 3.707 -4.518 8.397 1.00 0.00 H new ATOM 0 HD3 ARG A 49 2.071 -5.044 8.743 1.00 0.00 H new ATOM 0 HE ARG A 49 3.825 -7.307 8.126 1.00 0.00 H new ATOM 0 HH11 ARG A 49 2.844 -5.045 10.677 1.00 0.00 H new ATOM 0 HH12 ARG A 49 3.288 -6.144 11.987 1.00 0.00 H new ATOM 0 HH21 ARG A 49 4.399 -8.727 9.820 1.00 0.00 H new ATOM 0 HH22 ARG A 49 4.171 -8.234 11.501 1.00 0.00 H new ATOM 773 N ILE A 50 1.171 -6.784 3.369 1.00 0.00 N ATOM 774 CA ILE A 50 0.686 -7.952 2.654 1.00 0.00 C ATOM 775 C ILE A 50 1.241 -9.216 3.313 1.00 0.00 C ATOM 776 O ILE A 50 2.371 -9.220 3.801 1.00 0.00 O ATOM 777 CB ILE A 50 1.012 -7.841 1.163 1.00 0.00 C ATOM 778 CG1 ILE A 50 0.035 -8.667 0.325 1.00 0.00 C ATOM 779 CG2 ILE A 50 2.468 -8.226 0.891 1.00 0.00 C ATOM 780 CD1 ILE A 50 -1.355 -8.028 0.314 1.00 0.00 C ATOM 0 H ILE A 50 2.125 -6.508 3.137 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.401 -8.012 2.715 1.00 0.00 H new ATOM 0 HB ILE A 50 0.892 -6.800 0.863 1.00 0.00 H new ATOM 0 HG12 ILE A 50 0.408 -8.752 -0.696 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.029 -9.678 0.727 1.00 0.00 H new ATOM 0 HG21 ILE A 50 2.674 -8.139 -0.176 1.00 0.00 H new ATOM 0 HG22 ILE A 50 3.130 -7.560 1.444 1.00 0.00 H new ATOM 0 HG23 ILE A 50 2.638 -9.254 1.211 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.030 -8.635 -0.289 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.735 -7.966 1.334 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.292 -7.026 -0.111 1.00 0.00 H new ATOM 792 N GLY A 51 0.422 -10.257 3.306 1.00 0.00 N ATOM 793 CA GLY A 51 0.818 -11.524 3.898 1.00 0.00 C ATOM 794 C GLY A 51 1.018 -12.593 2.821 1.00 0.00 C ATOM 795 O GLY A 51 0.188 -13.488 2.669 1.00 0.00 O ATOM 0 H GLY A 51 -0.514 -10.250 2.900 1.00 0.00 H new ATOM 0 HA2 GLY A 51 1.742 -11.393 4.462 1.00 0.00 H new ATOM 0 HA3 GLY A 51 0.057 -11.853 4.605 1.00 0.00 H new ATOM 799 N ILE A 52 2.123 -12.464 2.103 1.00 0.00 N ATOM 800 CA ILE A 52 2.443 -13.408 1.045 1.00 0.00 C ATOM 801 C ILE A 52 2.042 -14.817 1.487 1.00 0.00 C ATOM 802 O ILE A 52 1.484 -15.582 0.702 1.00 0.00 O ATOM 803 CB ILE A 52 3.914 -13.285 0.644 1.00 0.00 C ATOM 804 CG1 ILE A 52 4.833 -13.700 1.795 1.00 0.00 C ATOM 805 CG2 ILE A 52 4.228 -11.875 0.138 1.00 0.00 C ATOM 806 CD1 ILE A 52 4.815 -12.656 2.914 1.00 0.00 C ATOM 0 H ILE A 52 2.809 -11.720 2.233 1.00 0.00 H new ATOM 0 HA ILE A 52 1.871 -13.180 0.145 1.00 0.00 H new ATOM 0 HB ILE A 52 4.102 -13.972 -0.181 1.00 0.00 H new ATOM 0 HG12 ILE A 52 4.516 -14.666 2.188 1.00 0.00 H new ATOM 0 HG13 ILE A 52 5.851 -13.825 1.426 1.00 0.00 H new ATOM 0 HG21 ILE A 52 5.280 -11.814 -0.140 1.00 0.00 H new ATOM 0 HG22 ILE A 52 3.609 -11.654 -0.732 1.00 0.00 H new ATOM 0 HG23 ILE A 52 4.019 -11.151 0.925 1.00 0.00 H new ATOM 0 HD11 ILE A 52 5.476 -12.975 3.720 1.00 0.00 H new ATOM 0 HD12 ILE A 52 5.156 -11.697 2.523 1.00 0.00 H new ATOM 0 HD13 ILE A 52 3.800 -12.551 3.297 1.00 0.00 H new ATOM 917 N VAL A 60 5.430 -14.732 7.432 1.00 0.00 N ATOM 918 CA VAL A 60 6.006 -14.057 6.281 1.00 0.00 C ATOM 919 C VAL A 60 5.102 -12.892 5.873 1.00 0.00 C ATOM 920 O VAL A 60 3.887 -13.053 5.764 1.00 0.00 O ATOM 921 CB VAL A 60 6.237 -15.059 5.148 1.00 0.00 C ATOM 922 CG1 VAL A 60 7.190 -14.488 4.096 1.00 0.00 C ATOM 923 CG2 VAL A 60 6.756 -16.392 5.692 1.00 0.00 C ATOM 0 HA VAL A 60 6.981 -13.640 6.532 1.00 0.00 H new ATOM 0 HB VAL A 60 5.278 -15.245 4.665 1.00 0.00 H new ATOM 0 HG11 VAL A 60 7.337 -15.220 3.302 1.00 0.00 H new ATOM 0 HG12 VAL A 60 6.764 -13.577 3.675 1.00 0.00 H new ATOM 0 HG13 VAL A 60 8.149 -14.259 4.560 1.00 0.00 H new ATOM 0 HG21 VAL A 60 6.912 -17.086 4.866 1.00 0.00 H new ATOM 0 HG22 VAL A 60 7.700 -16.230 6.213 1.00 0.00 H new ATOM 0 HG23 VAL A 60 6.027 -16.811 6.385 1.00 0.00 H new ATOM 933 N TYR A 61 5.729 -11.745 5.659 1.00 0.00 N ATOM 934 CA TYR A 61 4.996 -10.553 5.266 1.00 0.00 C ATOM 935 C TYR A 61 5.870 -9.627 4.417 1.00 0.00 C ATOM 936 O TYR A 61 7.089 -9.785 4.375 1.00 0.00 O ATOM 937 CB TYR A 61 4.628 -9.836 6.566 1.00 0.00 C ATOM 938 CG TYR A 61 3.394 -10.410 7.265 1.00 0.00 C ATOM 939 CD1 TYR A 61 2.131 -10.082 6.816 1.00 0.00 C ATOM 940 CD2 TYR A 61 3.544 -11.257 8.345 1.00 0.00 C ATOM 941 CE1 TYR A 61 0.970 -10.623 7.474 1.00 0.00 C ATOM 942 CE2 TYR A 61 2.382 -11.797 9.003 1.00 0.00 C ATOM 943 CZ TYR A 61 1.153 -11.453 8.535 1.00 0.00 C ATOM 944 OH TYR A 61 0.056 -11.964 9.156 1.00 0.00 O ATOM 0 H TYR A 61 6.737 -11.615 5.750 1.00 0.00 H new ATOM 0 HA TYR A 61 4.121 -10.819 4.673 1.00 0.00 H new ATOM 0 HB2 TYR A 61 5.476 -9.886 7.249 1.00 0.00 H new ATOM 0 HB3 TYR A 61 4.454 -8.782 6.351 1.00 0.00 H new ATOM 0 HD1 TYR A 61 2.013 -9.420 5.971 1.00 0.00 H new ATOM 0 HD2 TYR A 61 4.532 -11.515 8.696 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -0.024 -10.375 7.132 1.00 0.00 H new ATOM 0 HE2 TYR A 61 2.485 -12.460 9.849 1.00 0.00 H new ATOM 0 HH TYR A 61 0.338 -12.541 9.896 1.00 0.00 H new ATOM 954 N ARG A 62 5.213 -8.682 3.762 1.00 0.00 N ATOM 955 CA ARG A 62 5.914 -7.731 2.917 1.00 0.00 C ATOM 956 C ARG A 62 5.148 -6.408 2.858 1.00 0.00 C ATOM 957 O ARG A 62 3.920 -6.400 2.789 1.00 0.00 O ATOM 958 CB ARG A 62 6.086 -8.277 1.498 1.00 0.00 C ATOM 959 CG ARG A 62 6.798 -9.631 1.514 1.00 0.00 C ATOM 960 CD ARG A 62 7.315 -9.995 0.121 1.00 0.00 C ATOM 961 NE ARG A 62 8.534 -9.214 -0.187 1.00 0.00 N ATOM 962 CZ ARG A 62 9.722 -9.413 0.401 1.00 0.00 C ATOM 963 NH1 ARG A 62 9.857 -10.369 1.331 1.00 0.00 N ATOM 964 NH2 ARG A 62 10.774 -8.657 0.059 1.00 0.00 N ATOM 0 H ARG A 62 4.202 -8.554 3.799 1.00 0.00 H new ATOM 0 HA ARG A 62 6.900 -7.565 3.352 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.110 -8.381 1.024 1.00 0.00 H new ATOM 0 HB3 ARG A 62 6.658 -7.568 0.899 1.00 0.00 H new ATOM 0 HG2 ARG A 62 7.630 -9.600 2.218 1.00 0.00 H new ATOM 0 HG3 ARG A 62 6.112 -10.402 1.864 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.535 -11.062 0.073 1.00 0.00 H new ATOM 0 HD3 ARG A 62 6.546 -9.794 -0.625 1.00 0.00 H new ATOM 0 HE ARG A 62 8.466 -8.479 -0.890 1.00 0.00 H new ATOM 0 HH11 ARG A 62 9.056 -10.945 1.591 1.00 0.00 H new ATOM 0 HH12 ARG A 62 10.761 -10.521 1.779 1.00 0.00 H new ATOM 0 HH21 ARG A 62 10.671 -7.930 -0.649 1.00 0.00 H new ATOM 0 HH22 ARG A 62 11.678 -8.809 0.507 1.00 0.00 H new ATOM 978 N VAL A 63 5.905 -5.320 2.887 1.00 0.00 N ATOM 979 CA VAL A 63 5.313 -3.995 2.837 1.00 0.00 C ATOM 980 C VAL A 63 5.121 -3.581 1.377 1.00 0.00 C ATOM 981 O VAL A 63 5.974 -3.852 0.533 1.00 0.00 O ATOM 982 CB VAL A 63 6.172 -3.008 3.630 1.00 0.00 C ATOM 983 CG1 VAL A 63 5.527 -1.621 3.662 1.00 0.00 C ATOM 984 CG2 VAL A 63 6.434 -3.523 5.046 1.00 0.00 C ATOM 0 H VAL A 63 6.923 -5.330 2.945 1.00 0.00 H new ATOM 0 HA VAL A 63 4.329 -3.999 3.306 1.00 0.00 H new ATOM 0 HB VAL A 63 7.133 -2.919 3.123 1.00 0.00 H new ATOM 0 HG11 VAL A 63 6.158 -0.939 4.232 1.00 0.00 H new ATOM 0 HG12 VAL A 63 5.416 -1.248 2.644 1.00 0.00 H new ATOM 0 HG13 VAL A 63 4.546 -1.687 4.133 1.00 0.00 H new ATOM 0 HG21 VAL A 63 7.047 -2.802 5.588 1.00 0.00 H new ATOM 0 HG22 VAL A 63 5.485 -3.656 5.566 1.00 0.00 H new ATOM 0 HG23 VAL A 63 6.957 -4.478 4.995 1.00 0.00 H new ATOM 994 N ALA A 64 3.994 -2.931 1.122 1.00 0.00 N ATOM 995 CA ALA A 64 3.679 -2.477 -0.222 1.00 0.00 C ATOM 996 C ALA A 64 2.952 -1.134 -0.144 1.00 0.00 C ATOM 997 O ALA A 64 2.355 -0.805 0.880 1.00 0.00 O ATOM 998 CB ALA A 64 2.855 -3.546 -0.941 1.00 0.00 C ATOM 0 H ALA A 64 3.288 -2.708 1.824 1.00 0.00 H new ATOM 0 HA ALA A 64 4.590 -2.325 -0.800 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.618 -3.206 -1.949 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.428 -4.472 -0.995 1.00 0.00 H new ATOM 0 HB3 ALA A 64 1.930 -3.723 -0.392 1.00 0.00 H new ATOM 1004 N GLU A 65 3.025 -0.393 -1.240 1.00 0.00 N ATOM 1005 CA GLU A 65 2.380 0.907 -1.309 1.00 0.00 C ATOM 1006 C GLU A 65 1.310 0.912 -2.402 1.00 0.00 C ATOM 1007 O GLU A 65 1.555 0.456 -3.518 1.00 0.00 O ATOM 1008 CB GLU A 65 3.408 2.016 -1.544 1.00 0.00 C ATOM 1009 CG GLU A 65 2.725 3.381 -1.655 1.00 0.00 C ATOM 1010 CD GLU A 65 3.704 4.444 -2.158 1.00 0.00 C ATOM 1011 OE1 GLU A 65 4.060 4.369 -3.354 1.00 0.00 O ATOM 1012 OE2 GLU A 65 4.075 5.309 -1.334 1.00 0.00 O ATOM 0 H GLU A 65 3.521 -0.668 -2.088 1.00 0.00 H new ATOM 0 HA GLU A 65 1.895 1.101 -0.352 1.00 0.00 H new ATOM 0 HB2 GLU A 65 4.127 2.030 -0.725 1.00 0.00 H new ATOM 0 HB3 GLU A 65 3.968 1.810 -2.456 1.00 0.00 H new ATOM 0 HG2 GLU A 65 1.876 3.313 -2.335 1.00 0.00 H new ATOM 0 HG3 GLU A 65 2.331 3.675 -0.682 1.00 0.00 H new ATOM 1019 N ILE A 66 0.145 1.431 -2.043 1.00 0.00 N ATOM 1020 CA ILE A 66 -0.964 1.501 -2.979 1.00 0.00 C ATOM 1021 C ILE A 66 -0.645 2.531 -4.065 1.00 0.00 C ATOM 1022 O ILE A 66 -0.297 3.671 -3.761 1.00 0.00 O ATOM 1023 CB ILE A 66 -2.274 1.775 -2.238 1.00 0.00 C ATOM 1024 CG1 ILE A 66 -2.502 0.746 -1.128 1.00 0.00 C ATOM 1025 CG2 ILE A 66 -3.452 1.838 -3.212 1.00 0.00 C ATOM 1026 CD1 ILE A 66 -3.516 1.259 -0.104 1.00 0.00 C ATOM 0 H ILE A 66 -0.055 1.807 -1.116 1.00 0.00 H new ATOM 0 HA ILE A 66 -1.102 0.542 -3.479 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.198 2.752 -1.761 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -2.859 -0.188 -1.561 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.557 0.527 -0.631 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -4.371 2.034 -2.659 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.285 2.638 -3.934 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.541 0.887 -3.738 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -3.659 0.509 0.673 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -3.145 2.180 0.345 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -4.467 1.454 -0.600 1.00 0.00 H new ATOM 1038 N THR A 67 -0.776 2.092 -5.308 1.00 0.00 N ATOM 1039 CA THR A 67 -0.506 2.961 -6.441 1.00 0.00 C ATOM 1040 C THR A 67 -1.786 3.205 -7.242 1.00 0.00 C ATOM 1041 O THR A 67 -1.747 3.812 -8.311 1.00 0.00 O ATOM 1042 CB THR A 67 0.616 2.328 -7.266 1.00 0.00 C ATOM 1043 OG1 THR A 67 -0.031 1.286 -7.990 1.00 0.00 O ATOM 1044 CG2 THR A 67 1.641 1.596 -6.397 1.00 0.00 C ATOM 0 H THR A 67 -1.066 1.146 -5.556 1.00 0.00 H new ATOM 0 HA THR A 67 -0.172 3.946 -6.114 1.00 0.00 H new ATOM 0 HB THR A 67 1.119 3.101 -7.847 1.00 0.00 H new ATOM 0 HG1 THR A 67 0.624 0.823 -8.553 1.00 0.00 H new ATOM 0 HG21 THR A 67 2.415 1.165 -7.032 1.00 0.00 H new ATOM 0 HG22 THR A 67 2.094 2.299 -5.699 1.00 0.00 H new ATOM 0 HG23 THR A 67 1.145 0.801 -5.840 1.00 0.00 H new ATOM 1052 N GLY A 68 -2.891 2.720 -6.695 1.00 0.00 N ATOM 1053 CA GLY A 68 -4.180 2.878 -7.346 1.00 0.00 C ATOM 1054 C GLY A 68 -5.122 1.728 -6.984 1.00 0.00 C ATOM 1055 O GLY A 68 -4.745 0.823 -6.240 1.00 0.00 O ATOM 0 H GLY A 68 -2.920 2.217 -5.808 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -4.627 3.827 -7.049 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -4.043 2.914 -8.427 1.00 0.00 H new ATOM 1059 N VAL A 69 -6.328 1.800 -7.526 1.00 0.00 N ATOM 1060 CA VAL A 69 -7.326 0.776 -7.270 1.00 0.00 C ATOM 1061 C VAL A 69 -7.838 0.223 -8.602 1.00 0.00 C ATOM 1062 O VAL A 69 -8.361 0.969 -9.427 1.00 0.00 O ATOM 1063 CB VAL A 69 -8.442 1.341 -6.389 1.00 0.00 C ATOM 1064 CG1 VAL A 69 -9.597 0.346 -6.260 1.00 0.00 C ATOM 1065 CG2 VAL A 69 -7.906 1.741 -5.013 1.00 0.00 C ATOM 0 H VAL A 69 -6.637 2.552 -8.142 1.00 0.00 H new ATOM 0 HA VAL A 69 -6.886 -0.056 -6.720 1.00 0.00 H new ATOM 0 HB VAL A 69 -8.827 2.239 -6.872 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -10.376 0.773 -5.629 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -10.006 0.133 -7.248 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -9.233 -0.578 -5.812 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -8.720 2.139 -4.407 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -7.481 0.867 -4.520 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -7.135 2.502 -5.130 1.00 0.00 H new ATOM 1075 N VAL A 70 -7.668 -1.080 -8.770 1.00 0.00 N ATOM 1076 CA VAL A 70 -8.106 -1.741 -9.987 1.00 0.00 C ATOM 1077 C VAL A 70 -9.463 -2.404 -9.743 1.00 0.00 C ATOM 1078 O VAL A 70 -10.024 -2.296 -8.653 1.00 0.00 O ATOM 1079 CB VAL A 70 -7.036 -2.727 -10.461 1.00 0.00 C ATOM 1080 CG1 VAL A 70 -5.772 -1.990 -10.910 1.00 0.00 C ATOM 1081 CG2 VAL A 70 -6.715 -3.753 -9.373 1.00 0.00 C ATOM 0 H VAL A 70 -7.233 -1.696 -8.083 1.00 0.00 H new ATOM 0 HA VAL A 70 -8.239 -1.015 -10.789 1.00 0.00 H new ATOM 0 HB VAL A 70 -7.434 -3.265 -11.321 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -5.027 -2.714 -11.242 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -6.016 -1.317 -11.732 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -5.371 -1.414 -10.076 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.952 -4.442 -9.736 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -6.347 -3.239 -8.485 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -7.617 -4.311 -9.122 1.00 0.00 H new ATOM 1091 N GLU A 71 -9.952 -3.076 -10.775 1.00 0.00 N ATOM 1092 CA GLU A 71 -11.233 -3.756 -10.686 1.00 0.00 C ATOM 1093 C GLU A 71 -11.117 -5.179 -11.236 1.00 0.00 C ATOM 1094 O GLU A 71 -10.749 -5.373 -12.393 1.00 0.00 O ATOM 1095 CB GLU A 71 -12.322 -2.972 -11.419 1.00 0.00 C ATOM 1096 CG GLU A 71 -12.372 -3.355 -12.899 1.00 0.00 C ATOM 1097 CD GLU A 71 -13.402 -2.509 -13.651 1.00 0.00 C ATOM 1098 OE1 GLU A 71 -13.205 -1.275 -13.687 1.00 0.00 O ATOM 1099 OE2 GLU A 71 -14.363 -3.115 -14.172 1.00 0.00 O ATOM 0 H GLU A 71 -9.484 -3.164 -11.677 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.519 -3.815 -9.636 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.289 -3.167 -10.956 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.133 -1.903 -11.323 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.388 -3.219 -13.347 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.623 -4.411 -12.997 1.00 0.00 H new ATOM 1106 N THR A 72 -11.439 -6.138 -10.380 1.00 0.00 N ATOM 1107 CA THR A 72 -11.376 -7.538 -10.766 1.00 0.00 C ATOM 1108 C THR A 72 -12.747 -8.022 -11.242 1.00 0.00 C ATOM 1109 O THR A 72 -13.726 -7.279 -11.186 1.00 0.00 O ATOM 1110 CB THR A 72 -10.830 -8.332 -9.577 1.00 0.00 C ATOM 1111 OG1 THR A 72 -11.687 -7.974 -8.497 1.00 0.00 O ATOM 1112 CG2 THR A 72 -9.448 -7.846 -9.134 1.00 0.00 C ATOM 0 H THR A 72 -11.744 -5.973 -9.421 1.00 0.00 H new ATOM 0 HA THR A 72 -10.703 -7.686 -11.611 1.00 0.00 H new ATOM 0 HB THR A 72 -10.776 -9.388 -9.840 1.00 0.00 H new ATOM 0 HG1 THR A 72 -12.261 -8.735 -8.269 1.00 0.00 H new ATOM 0 HG21 THR A 72 -9.107 -8.442 -8.288 1.00 0.00 H new ATOM 0 HG22 THR A 72 -8.744 -7.951 -9.959 1.00 0.00 H new ATOM 0 HG23 THR A 72 -9.508 -6.798 -8.839 1.00 0.00 H new ATOM 1120 N ALA A 73 -12.774 -9.265 -11.699 1.00 0.00 N ATOM 1121 CA ALA A 73 -14.009 -9.857 -12.184 1.00 0.00 C ATOM 1122 C ALA A 73 -14.637 -10.700 -11.072 1.00 0.00 C ATOM 1123 O ALA A 73 -15.859 -10.796 -10.977 1.00 0.00 O ATOM 1124 CB ALA A 73 -13.722 -10.676 -13.444 1.00 0.00 C ATOM 0 H ALA A 73 -11.960 -9.879 -11.744 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.726 -9.082 -12.455 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -14.648 -11.120 -13.808 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.304 -10.026 -14.213 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.008 -11.466 -13.210 1.00 0.00 H new ATOM 1130 N LYS A 74 -13.772 -11.288 -10.259 1.00 0.00 N ATOM 1131 CA LYS A 74 -14.227 -12.119 -9.157 1.00 0.00 C ATOM 1132 C LYS A 74 -14.310 -11.272 -7.886 1.00 0.00 C ATOM 1133 O LYS A 74 -13.571 -10.301 -7.733 1.00 0.00 O ATOM 1134 CB LYS A 74 -13.336 -13.355 -9.015 1.00 0.00 C ATOM 1135 CG LYS A 74 -13.551 -14.323 -10.181 1.00 0.00 C ATOM 1136 CD LYS A 74 -13.846 -15.736 -9.673 1.00 0.00 C ATOM 1137 CE LYS A 74 -13.347 -16.790 -10.663 1.00 0.00 C ATOM 1138 NZ LYS A 74 -12.238 -17.572 -10.073 1.00 0.00 N ATOM 0 H LYS A 74 -12.759 -11.206 -10.341 1.00 0.00 H new ATOM 0 HA LYS A 74 -15.230 -12.498 -9.354 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -12.290 -13.051 -8.978 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -13.555 -13.859 -8.074 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -14.378 -13.975 -10.800 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -12.664 -14.338 -10.814 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -13.367 -15.886 -8.705 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -14.919 -15.855 -9.520 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -14.165 -17.457 -10.936 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -13.011 -16.306 -11.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -11.911 -18.283 -10.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -11.452 -16.934 -9.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -12.570 -18.049 -9.211 1.00 0.00 H new ATOM 1152 N VAL A 75 -15.217 -11.670 -7.006 1.00 0.00 N ATOM 1153 CA VAL A 75 -15.407 -10.960 -5.753 1.00 0.00 C ATOM 1154 C VAL A 75 -15.060 -11.888 -4.588 1.00 0.00 C ATOM 1155 O VAL A 75 -15.217 -13.104 -4.690 1.00 0.00 O ATOM 1156 CB VAL A 75 -16.832 -10.409 -5.675 1.00 0.00 C ATOM 1157 CG1 VAL A 75 -17.180 -9.990 -4.245 1.00 0.00 C ATOM 1158 CG2 VAL A 75 -17.025 -9.246 -6.650 1.00 0.00 C ATOM 0 H VAL A 75 -15.829 -12.476 -7.136 1.00 0.00 H new ATOM 0 HA VAL A 75 -14.737 -10.102 -5.695 1.00 0.00 H new ATOM 0 HB VAL A 75 -17.516 -11.206 -5.966 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -18.198 -9.602 -4.217 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.102 -10.853 -3.584 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -16.488 -9.216 -3.914 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -18.046 -8.873 -6.574 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.327 -8.445 -6.404 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -16.839 -9.590 -7.668 1.00 0.00 H new ATOM 1168 N TYR A 76 -14.594 -11.280 -3.507 1.00 0.00 N ATOM 1169 CA TYR A 76 -14.223 -12.037 -2.324 1.00 0.00 C ATOM 1170 C TYR A 76 -14.773 -11.379 -1.057 1.00 0.00 C ATOM 1171 O TYR A 76 -15.163 -10.212 -1.078 1.00 0.00 O ATOM 1172 CB TYR A 76 -12.694 -12.016 -2.272 1.00 0.00 C ATOM 1173 CG TYR A 76 -12.089 -10.612 -2.319 1.00 0.00 C ATOM 1174 CD1 TYR A 76 -12.169 -9.788 -1.216 1.00 0.00 C ATOM 1175 CD2 TYR A 76 -11.462 -10.169 -3.467 1.00 0.00 C ATOM 1176 CE1 TYR A 76 -11.600 -8.466 -1.261 1.00 0.00 C ATOM 1177 CE2 TYR A 76 -10.893 -8.847 -3.512 1.00 0.00 C ATOM 1178 CZ TYR A 76 -10.989 -8.061 -2.407 1.00 0.00 C ATOM 1179 OH TYR A 76 -10.452 -6.813 -2.449 1.00 0.00 O ATOM 0 H TYR A 76 -14.465 -10.271 -3.426 1.00 0.00 H new ATOM 0 HA TYR A 76 -14.626 -13.049 -2.374 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -12.365 -12.512 -1.359 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -12.304 -12.597 -3.108 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -12.659 -10.134 -0.318 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -11.398 -10.814 -4.331 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -11.657 -7.811 -0.404 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -10.401 -8.488 -4.404 1.00 0.00 H new ATOM 0 HH TYR A 76 -10.473 -6.478 -3.370 1.00 0.00 H new ATOM 1189 N GLN A 77 -14.787 -12.155 0.017 1.00 0.00 N ATOM 1190 CA GLN A 77 -15.283 -11.662 1.290 1.00 0.00 C ATOM 1191 C GLN A 77 -14.251 -10.740 1.941 1.00 0.00 C ATOM 1192 O GLN A 77 -13.048 -10.967 1.821 1.00 0.00 O ATOM 1193 CB GLN A 77 -15.649 -12.820 2.222 1.00 0.00 C ATOM 1194 CG GLN A 77 -16.126 -12.301 3.580 1.00 0.00 C ATOM 1195 CD GLN A 77 -16.844 -13.401 4.365 1.00 0.00 C ATOM 1196 OE1 GLN A 77 -16.315 -14.474 4.605 1.00 0.00 O ATOM 1197 NE2 GLN A 77 -18.074 -13.075 4.751 1.00 0.00 N ATOM 0 H GLN A 77 -14.463 -13.122 0.031 1.00 0.00 H new ATOM 0 HA GLN A 77 -16.190 -11.087 1.106 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -16.431 -13.426 1.765 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -14.783 -13.468 2.360 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -15.274 -11.936 4.154 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -16.798 -11.455 3.435 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -18.456 -12.159 4.516 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -18.635 -13.741 5.282 1.00 0.00 H new ATOM 1206 N LEU A 78 -14.758 -9.719 2.617 1.00 0.00 N ATOM 1207 CA LEU A 78 -13.894 -8.762 3.287 1.00 0.00 C ATOM 1208 C LEU A 78 -14.459 -8.457 4.676 1.00 0.00 C ATOM 1209 O LEU A 78 -14.904 -7.341 4.938 1.00 0.00 O ATOM 1210 CB LEU A 78 -13.696 -7.519 2.417 1.00 0.00 C ATOM 1211 CG LEU A 78 -12.891 -6.381 3.048 1.00 0.00 C ATOM 1212 CD1 LEU A 78 -11.481 -6.847 3.419 1.00 0.00 C ATOM 1213 CD2 LEU A 78 -12.866 -5.155 2.133 1.00 0.00 C ATOM 0 H LEU A 78 -15.756 -9.534 2.715 1.00 0.00 H new ATOM 0 HA LEU A 78 -12.899 -9.183 3.432 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.200 -7.821 1.494 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -14.677 -7.133 2.140 1.00 0.00 H new ATOM 0 HG LEU A 78 -13.386 -6.084 3.972 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -10.930 -6.019 3.865 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -11.545 -7.668 4.134 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -10.962 -7.186 2.522 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.288 -4.361 2.605 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.408 -5.421 1.181 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -13.885 -4.809 1.961 1.00 0.00 H new ATOM 1225 N GLY A 79 -14.423 -9.470 5.530 1.00 0.00 N ATOM 1226 CA GLY A 79 -14.925 -9.324 6.885 1.00 0.00 C ATOM 1227 C GLY A 79 -16.447 -9.170 6.892 1.00 0.00 C ATOM 1228 O GLY A 79 -17.003 -8.500 7.761 1.00 0.00 O ATOM 0 H GLY A 79 -14.054 -10.395 5.309 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -14.641 -10.194 7.477 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -14.466 -8.454 7.355 1.00 0.00 H new ATOM 1232 N GLY A 80 -17.079 -9.802 5.913 1.00 0.00 N ATOM 1233 CA GLY A 80 -18.526 -9.743 5.795 1.00 0.00 C ATOM 1234 C GLY A 80 -18.943 -9.153 4.447 1.00 0.00 C ATOM 1235 O GLY A 80 -19.782 -9.721 3.749 1.00 0.00 O ATOM 0 H GLY A 80 -16.615 -10.357 5.194 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -18.944 -10.744 5.903 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -18.936 -9.137 6.603 1.00 0.00 H new ATOM 1239 N THR A 81 -18.337 -8.021 4.119 1.00 0.00 N ATOM 1240 CA THR A 81 -18.635 -7.348 2.867 1.00 0.00 C ATOM 1241 C THR A 81 -17.819 -7.960 1.726 1.00 0.00 C ATOM 1242 O THR A 81 -16.660 -8.325 1.913 1.00 0.00 O ATOM 1243 CB THR A 81 -18.380 -5.852 3.062 1.00 0.00 C ATOM 1244 OG1 THR A 81 -18.936 -5.251 1.895 1.00 0.00 O ATOM 1245 CG2 THR A 81 -16.894 -5.497 2.992 1.00 0.00 C ATOM 0 H THR A 81 -17.641 -7.553 4.699 1.00 0.00 H new ATOM 0 HA THR A 81 -19.680 -7.480 2.585 1.00 0.00 H new ATOM 0 HB THR A 81 -18.783 -5.537 4.025 1.00 0.00 H new ATOM 0 HG1 THR A 81 -18.816 -4.279 1.939 1.00 0.00 H new ATOM 0 HG21 THR A 81 -16.769 -4.424 3.137 1.00 0.00 H new ATOM 0 HG22 THR A 81 -16.355 -6.034 3.773 1.00 0.00 H new ATOM 0 HG23 THR A 81 -16.498 -5.780 2.017 1.00 0.00 H new ATOM 1253 N ARG A 82 -18.458 -8.052 0.568 1.00 0.00 N ATOM 1254 CA ARG A 82 -17.806 -8.613 -0.603 1.00 0.00 C ATOM 1255 C ARG A 82 -17.403 -7.499 -1.571 1.00 0.00 C ATOM 1256 O ARG A 82 -18.261 -6.829 -2.143 1.00 0.00 O ATOM 1257 CB ARG A 82 -18.726 -9.599 -1.326 1.00 0.00 C ATOM 1258 CG ARG A 82 -18.422 -11.039 -0.907 1.00 0.00 C ATOM 1259 CD ARG A 82 -18.805 -12.025 -2.013 1.00 0.00 C ATOM 1260 NE ARG A 82 -19.690 -13.079 -1.468 1.00 0.00 N ATOM 1261 CZ ARG A 82 -21.020 -12.962 -1.361 1.00 0.00 C ATOM 1262 NH1 ARG A 82 -21.628 -11.837 -1.761 1.00 0.00 N ATOM 1263 NH2 ARG A 82 -21.743 -13.970 -0.855 1.00 0.00 N ATOM 0 H ARG A 82 -19.420 -7.748 0.416 1.00 0.00 H new ATOM 0 HA ARG A 82 -16.917 -9.144 -0.265 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -19.766 -9.363 -1.102 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -18.601 -9.496 -2.404 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -17.361 -11.138 -0.678 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -18.969 -11.279 0.005 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -19.310 -11.498 -2.823 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -17.907 -12.476 -2.437 1.00 0.00 H new ATOM 0 HE ARG A 82 -19.260 -13.949 -1.154 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -21.078 -11.070 -2.147 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -22.641 -11.748 -1.680 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -21.281 -14.827 -0.551 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -22.756 -13.881 -0.774 1.00 0.00 H new ATOM 1277 N THR A 83 -16.097 -7.335 -1.724 1.00 0.00 N ATOM 1278 CA THR A 83 -15.571 -6.313 -2.613 1.00 0.00 C ATOM 1279 C THR A 83 -14.890 -6.958 -3.822 1.00 0.00 C ATOM 1280 O THR A 83 -14.662 -8.166 -3.840 1.00 0.00 O ATOM 1281 CB THR A 83 -14.639 -5.413 -1.799 1.00 0.00 C ATOM 1282 OG1 THR A 83 -14.321 -4.347 -2.690 1.00 0.00 O ATOM 1283 CG2 THR A 83 -13.289 -6.074 -1.512 1.00 0.00 C ATOM 0 H THR A 83 -15.388 -7.892 -1.248 1.00 0.00 H new ATOM 0 HA THR A 83 -16.370 -5.694 -3.021 1.00 0.00 H new ATOM 0 HB THR A 83 -15.121 -5.149 -0.858 1.00 0.00 H new ATOM 0 HG1 THR A 83 -14.488 -3.489 -2.246 1.00 0.00 H new ATOM 0 HG21 THR A 83 -12.666 -5.393 -0.932 1.00 0.00 H new ATOM 0 HG22 THR A 83 -13.446 -6.992 -0.946 1.00 0.00 H new ATOM 0 HG23 THR A 83 -12.791 -6.308 -2.453 1.00 0.00 H new ATOM 1291 N ASN A 84 -14.584 -6.122 -4.804 1.00 0.00 N ATOM 1292 CA ASN A 84 -13.933 -6.595 -6.014 1.00 0.00 C ATOM 1293 C ASN A 84 -12.865 -5.587 -6.441 1.00 0.00 C ATOM 1294 O ASN A 84 -12.397 -5.618 -7.578 1.00 0.00 O ATOM 1295 CB ASN A 84 -14.937 -6.736 -7.160 1.00 0.00 C ATOM 1296 CG ASN A 84 -15.175 -5.390 -7.848 1.00 0.00 C ATOM 1297 OD1 ASN A 84 -15.636 -4.431 -7.251 1.00 0.00 O ATOM 1298 ND2 ASN A 84 -14.835 -5.372 -9.134 1.00 0.00 N ATOM 0 H ASN A 84 -14.775 -5.120 -4.786 1.00 0.00 H new ATOM 0 HA ASN A 84 -13.490 -7.568 -5.801 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -14.566 -7.459 -7.886 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -15.880 -7.124 -6.776 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -14.955 -4.520 -9.681 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -14.454 -6.210 -9.573 1.00 0.00 H new ATOM 1305 N LYS A 85 -12.511 -4.717 -5.507 1.00 0.00 N ATOM 1306 CA LYS A 85 -11.507 -3.701 -5.773 1.00 0.00 C ATOM 1307 C LYS A 85 -10.122 -4.257 -5.435 1.00 0.00 C ATOM 1308 O LYS A 85 -9.831 -4.546 -4.275 1.00 0.00 O ATOM 1309 CB LYS A 85 -11.846 -2.405 -5.033 1.00 0.00 C ATOM 1310 CG LYS A 85 -13.214 -1.871 -5.462 1.00 0.00 C ATOM 1311 CD LYS A 85 -13.259 -0.344 -5.372 1.00 0.00 C ATOM 1312 CE LYS A 85 -12.946 0.295 -6.726 1.00 0.00 C ATOM 1313 NZ LYS A 85 -13.868 -0.215 -7.765 1.00 0.00 N ATOM 0 H LYS A 85 -12.901 -4.695 -4.565 1.00 0.00 H new ATOM 0 HA LYS A 85 -11.498 -3.443 -6.832 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -11.842 -2.584 -3.958 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -11.080 -1.656 -5.234 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -13.427 -2.185 -6.484 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -13.991 -2.299 -4.828 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -14.245 -0.025 -5.035 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -12.541 0.001 -4.628 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -13.035 1.379 -6.653 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -11.916 0.078 -7.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -14.227 0.580 -8.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -13.360 -0.879 -8.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -14.665 -0.705 -7.311 1.00 0.00 H new ATOM 1327 N GLY A 86 -9.305 -4.392 -6.469 1.00 0.00 N ATOM 1328 CA GLY A 86 -7.958 -4.909 -6.297 1.00 0.00 C ATOM 1329 C GLY A 86 -6.981 -3.786 -5.941 1.00 0.00 C ATOM 1330 O GLY A 86 -6.725 -2.900 -6.755 1.00 0.00 O ATOM 0 H GLY A 86 -9.550 -4.152 -7.430 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -7.952 -5.664 -5.511 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -7.634 -5.401 -7.214 1.00 0.00 H new ATOM 1334 N LEU A 87 -6.462 -3.860 -4.724 1.00 0.00 N ATOM 1335 CA LEU A 87 -5.519 -2.861 -4.251 1.00 0.00 C ATOM 1336 C LEU A 87 -4.217 -2.978 -5.046 1.00 0.00 C ATOM 1337 O LEU A 87 -3.519 -3.987 -4.957 1.00 0.00 O ATOM 1338 CB LEU A 87 -5.328 -2.980 -2.737 1.00 0.00 C ATOM 1339 CG LEU A 87 -6.109 -1.980 -1.882 1.00 0.00 C ATOM 1340 CD1 LEU A 87 -5.655 -2.035 -0.422 1.00 0.00 C ATOM 1341 CD2 LEU A 87 -6.009 -0.567 -2.461 1.00 0.00 C ATOM 0 H LEU A 87 -6.677 -4.596 -4.051 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.908 -1.858 -4.423 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -5.612 -3.987 -2.433 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.267 -2.867 -2.515 1.00 0.00 H new ATOM 0 HG LEU A 87 -7.162 -2.262 -1.903 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.226 -1.315 0.164 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.821 -3.037 -0.027 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.594 -1.792 -0.362 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -6.573 0.124 -1.834 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.964 -0.259 -2.491 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.419 -0.558 -3.471 1.00 0.00 H new ATOM 1353 N GLN A 88 -3.929 -1.931 -5.806 1.00 0.00 N ATOM 1354 CA GLN A 88 -2.724 -1.904 -6.616 1.00 0.00 C ATOM 1355 C GLN A 88 -1.504 -1.604 -5.743 1.00 0.00 C ATOM 1356 O GLN A 88 -1.203 -0.444 -5.467 1.00 0.00 O ATOM 1357 CB GLN A 88 -2.849 -0.885 -7.751 1.00 0.00 C ATOM 1358 CG GLN A 88 -2.331 -1.466 -9.069 1.00 0.00 C ATOM 1359 CD GLN A 88 -2.459 -0.449 -10.204 1.00 0.00 C ATOM 1360 OE1 GLN A 88 -3.676 0.074 -10.327 1.00 0.00 O flip ATOM 1361 NE2 GLN A 88 -1.516 -0.158 -10.921 1.00 0.00 N flip ATOM 0 H GLN A 88 -4.510 -1.096 -5.877 1.00 0.00 H new ATOM 0 HA GLN A 88 -2.591 -2.887 -7.067 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -3.892 -0.588 -7.865 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -2.287 0.015 -7.500 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -1.288 -1.760 -8.956 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -2.891 -2.367 -9.318 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -0.608 -0.597 -10.772 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -1.636 0.525 -11.669 1.00 0.00 H new ATOM 1370 N LEU A 89 -0.834 -2.671 -5.332 1.00 0.00 N ATOM 1371 CA LEU A 89 0.347 -2.536 -4.495 1.00 0.00 C ATOM 1372 C LEU A 89 1.600 -2.672 -5.363 1.00 0.00 C ATOM 1373 O LEU A 89 1.627 -3.468 -6.300 1.00 0.00 O ATOM 1374 CB LEU A 89 0.295 -3.528 -3.332 1.00 0.00 C ATOM 1375 CG LEU A 89 -1.037 -3.614 -2.583 1.00 0.00 C ATOM 1376 CD1 LEU A 89 -0.887 -4.415 -1.288 1.00 0.00 C ATOM 1377 CD2 LEU A 89 -1.616 -2.221 -2.332 1.00 0.00 C ATOM 0 H LEU A 89 -1.086 -3.632 -5.563 1.00 0.00 H new ATOM 0 HA LEU A 89 0.380 -1.546 -4.039 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.539 -4.519 -3.715 1.00 0.00 H new ATOM 0 HB3 LEU A 89 1.074 -3.262 -2.618 1.00 0.00 H new ATOM 0 HG LEU A 89 -1.749 -4.149 -3.212 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.848 -4.461 -0.775 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.552 -5.425 -1.522 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.154 -3.930 -0.643 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -2.562 -2.311 -1.798 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -0.916 -1.638 -1.733 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -1.783 -1.719 -3.285 1.00 0.00 H new ATOM 1389 N ARG A 90 2.606 -1.882 -5.020 1.00 0.00 N ATOM 1390 CA ARG A 90 3.859 -1.904 -5.756 1.00 0.00 C ATOM 1391 C ARG A 90 5.003 -2.352 -4.844 1.00 0.00 C ATOM 1392 O ARG A 90 5.157 -1.838 -3.738 1.00 0.00 O ATOM 1393 CB ARG A 90 4.185 -0.523 -6.330 1.00 0.00 C ATOM 1394 CG ARG A 90 5.559 -0.520 -7.003 1.00 0.00 C ATOM 1395 CD ARG A 90 5.953 0.894 -7.438 1.00 0.00 C ATOM 1396 NE ARG A 90 5.801 1.033 -8.903 1.00 0.00 N ATOM 1397 CZ ARG A 90 6.733 0.668 -9.793 1.00 0.00 C ATOM 1398 NH1 ARG A 90 7.890 0.139 -9.373 1.00 0.00 N ATOM 1399 NH2 ARG A 90 6.508 0.831 -11.104 1.00 0.00 N ATOM 0 H ARG A 90 2.579 -1.222 -4.242 1.00 0.00 H new ATOM 0 HA ARG A 90 3.748 -2.610 -6.579 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.421 -0.236 -7.053 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.165 0.220 -5.533 1.00 0.00 H new ATOM 0 HG2 ARG A 90 6.306 -0.914 -6.314 1.00 0.00 H new ATOM 0 HG3 ARG A 90 5.545 -1.181 -7.870 1.00 0.00 H new ATOM 0 HD2 ARG A 90 5.329 1.628 -6.928 1.00 0.00 H new ATOM 0 HD3 ARG A 90 6.984 1.098 -7.150 1.00 0.00 H new ATOM 0 HE ARG A 90 4.932 1.432 -9.258 1.00 0.00 H new ATOM 0 HH11 ARG A 90 8.061 0.014 -8.375 1.00 0.00 H new ATOM 0 HH12 ARG A 90 8.600 -0.139 -10.051 1.00 0.00 H new ATOM 0 HH21 ARG A 90 5.627 1.233 -11.424 1.00 0.00 H new ATOM 0 HH22 ARG A 90 7.218 0.553 -11.782 1.00 0.00 H new ATOM 1413 N HIS A 91 5.775 -3.306 -5.343 1.00 0.00 N ATOM 1414 CA HIS A 91 6.900 -3.830 -4.587 1.00 0.00 C ATOM 1415 C HIS A 91 8.201 -3.546 -5.340 1.00 0.00 C ATOM 1416 O HIS A 91 8.526 -4.235 -6.307 1.00 0.00 O ATOM 1417 CB HIS A 91 6.704 -5.316 -4.280 1.00 0.00 C ATOM 1418 CG HIS A 91 7.602 -5.841 -3.186 1.00 0.00 C ATOM 1419 ND1 HIS A 91 7.476 -5.455 -1.863 1.00 0.00 N ATOM 1420 CD2 HIS A 91 8.639 -6.726 -3.231 1.00 0.00 C ATOM 1421 CE1 HIS A 91 8.401 -6.084 -1.153 1.00 0.00 C ATOM 1422 NE2 HIS A 91 9.121 -6.871 -2.003 1.00 0.00 N ATOM 0 H HIS A 91 5.644 -3.730 -6.261 1.00 0.00 H new ATOM 0 HA HIS A 91 6.962 -3.325 -3.623 1.00 0.00 H new ATOM 0 HB2 HIS A 91 5.665 -5.484 -3.995 1.00 0.00 H new ATOM 0 HB3 HIS A 91 6.882 -5.891 -5.189 1.00 0.00 H new ATOM 0 HD1 HIS A 91 6.788 -4.798 -1.497 1.00 0.00 H new ATOM 0 HD2 HIS A 91 9.006 -7.224 -4.116 1.00 0.00 H new ATOM 0 HE1 HIS A 91 8.557 -5.990 -0.089 1.00 0.00 H new ATOM 1430 N GLY A 92 8.911 -2.532 -4.869 1.00 0.00 N ATOM 1431 CA GLY A 92 10.170 -2.148 -5.486 1.00 0.00 C ATOM 1432 C GLY A 92 9.948 -1.630 -6.908 1.00 0.00 C ATOM 1433 O GLY A 92 9.100 -0.767 -7.133 1.00 0.00 O ATOM 0 H GLY A 92 8.639 -1.964 -4.067 1.00 0.00 H new ATOM 0 HA2 GLY A 92 10.653 -1.377 -4.886 1.00 0.00 H new ATOM 0 HA3 GLY A 92 10.844 -3.004 -5.508 1.00 0.00 H new ATOM 1437 N ASN A 93 10.724 -2.177 -7.832 1.00 0.00 N ATOM 1438 CA ASN A 93 10.623 -1.781 -9.226 1.00 0.00 C ATOM 1439 C ASN A 93 9.613 -2.684 -9.936 1.00 0.00 C ATOM 1440 O ASN A 93 9.576 -2.734 -11.165 1.00 0.00 O ATOM 1441 CB ASN A 93 11.969 -1.924 -9.938 1.00 0.00 C ATOM 1442 CG ASN A 93 12.256 -0.707 -10.819 1.00 0.00 C ATOM 1443 OD1 ASN A 93 11.473 -0.329 -11.675 1.00 0.00 O ATOM 1444 ND2 ASN A 93 13.420 -0.116 -10.562 1.00 0.00 N ATOM 0 H ASN A 93 11.426 -2.892 -7.642 1.00 0.00 H new ATOM 0 HA ASN A 93 10.308 -0.738 -9.259 1.00 0.00 H new ATOM 0 HB2 ASN A 93 12.764 -2.039 -9.201 1.00 0.00 H new ATOM 0 HB3 ASN A 93 11.967 -2.827 -10.549 1.00 0.00 H new ATOM 0 HD21 ASN A 93 13.704 0.705 -11.096 1.00 0.00 H new ATOM 0 HD22 ASN A 93 14.029 -0.484 -9.831 1.00 0.00 H new ATOM 1451 N ASP A 94 8.819 -3.377 -9.133 1.00 0.00 N ATOM 1452 CA ASP A 94 7.811 -4.276 -9.670 1.00 0.00 C ATOM 1453 C ASP A 94 6.452 -3.937 -9.054 1.00 0.00 C ATOM 1454 O ASP A 94 6.369 -3.586 -7.879 1.00 0.00 O ATOM 1455 CB ASP A 94 8.135 -5.732 -9.329 1.00 0.00 C ATOM 1456 CG ASP A 94 8.734 -6.547 -10.478 1.00 0.00 C ATOM 1457 OD1 ASP A 94 9.976 -6.502 -10.618 1.00 0.00 O ATOM 1458 OD2 ASP A 94 7.937 -7.196 -11.189 1.00 0.00 O ATOM 0 H ASP A 94 8.853 -3.334 -8.114 1.00 0.00 H new ATOM 0 HA ASP A 94 7.792 -4.155 -10.753 1.00 0.00 H new ATOM 0 HB2 ASP A 94 8.832 -5.747 -8.491 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.222 -6.223 -8.993 1.00 0.00 H new ATOM 1463 N GLN A 95 5.420 -4.056 -9.877 1.00 0.00 N ATOM 1464 CA GLN A 95 4.069 -3.767 -9.428 1.00 0.00 C ATOM 1465 C GLN A 95 3.323 -5.066 -9.118 1.00 0.00 C ATOM 1466 O GLN A 95 3.698 -6.133 -9.603 1.00 0.00 O ATOM 1467 CB GLN A 95 3.312 -2.935 -10.466 1.00 0.00 C ATOM 1468 CG GLN A 95 3.500 -1.438 -10.212 1.00 0.00 C ATOM 1469 CD GLN A 95 3.863 -0.704 -11.504 1.00 0.00 C ATOM 1470 OE1 GLN A 95 4.865 -0.978 -12.143 1.00 0.00 O ATOM 1471 NE2 GLN A 95 2.995 0.242 -11.851 1.00 0.00 N ATOM 0 H GLN A 95 5.493 -4.348 -10.851 1.00 0.00 H new ATOM 0 HA GLN A 95 4.130 -3.178 -8.513 1.00 0.00 H new ATOM 0 HB2 GLN A 95 3.666 -3.185 -11.466 1.00 0.00 H new ATOM 0 HB3 GLN A 95 2.251 -3.183 -10.432 1.00 0.00 H new ATOM 0 HG2 GLN A 95 2.584 -1.018 -9.796 1.00 0.00 H new ATOM 0 HG3 GLN A 95 4.285 -1.287 -9.471 1.00 0.00 H new ATOM 0 HE21 GLN A 95 2.176 0.420 -11.270 1.00 0.00 H new ATOM 0 HE22 GLN A 95 3.149 0.789 -12.698 1.00 0.00 H new ATOM 1480 N ARG A 96 2.281 -4.935 -8.310 1.00 0.00 N ATOM 1481 CA ARG A 96 1.479 -6.085 -7.929 1.00 0.00 C ATOM 1482 C ARG A 96 0.019 -5.674 -7.734 1.00 0.00 C ATOM 1483 O ARG A 96 -0.326 -4.503 -7.889 1.00 0.00 O ATOM 1484 CB ARG A 96 2.001 -6.716 -6.637 1.00 0.00 C ATOM 1485 CG ARG A 96 3.049 -7.791 -6.935 1.00 0.00 C ATOM 1486 CD ARG A 96 3.901 -8.084 -5.699 1.00 0.00 C ATOM 1487 NE ARG A 96 5.303 -8.337 -6.100 1.00 0.00 N ATOM 1488 CZ ARG A 96 6.242 -8.827 -5.279 1.00 0.00 C ATOM 1489 NH1 ARG A 96 5.934 -9.119 -4.007 1.00 0.00 N ATOM 1490 NH2 ARG A 96 7.489 -9.025 -5.728 1.00 0.00 N ATOM 0 H ARG A 96 1.974 -4.049 -7.908 1.00 0.00 H new ATOM 0 HA ARG A 96 1.549 -6.818 -8.733 1.00 0.00 H new ATOM 0 HB2 ARG A 96 2.437 -5.945 -6.002 1.00 0.00 H new ATOM 0 HB3 ARG A 96 1.172 -7.155 -6.082 1.00 0.00 H new ATOM 0 HG2 ARG A 96 2.554 -8.705 -7.265 1.00 0.00 H new ATOM 0 HG3 ARG A 96 3.690 -7.462 -7.753 1.00 0.00 H new ATOM 0 HD2 ARG A 96 3.858 -7.241 -5.009 1.00 0.00 H new ATOM 0 HD3 ARG A 96 3.503 -8.950 -5.170 1.00 0.00 H new ATOM 0 HE ARG A 96 5.571 -8.125 -7.061 1.00 0.00 H new ATOM 0 HH11 ARG A 96 4.985 -8.968 -3.664 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.649 -9.492 -3.382 1.00 0.00 H new ATOM 0 HH21 ARG A 96 7.724 -8.803 -6.695 1.00 0.00 H new ATOM 0 HH22 ARG A 96 8.203 -9.398 -5.102 1.00 0.00 H new ATOM 1504 N VAL A 97 -0.801 -6.659 -7.398 1.00 0.00 N ATOM 1505 CA VAL A 97 -2.216 -6.414 -7.180 1.00 0.00 C ATOM 1506 C VAL A 97 -2.772 -7.474 -6.228 1.00 0.00 C ATOM 1507 O VAL A 97 -2.937 -8.632 -6.610 1.00 0.00 O ATOM 1508 CB VAL A 97 -2.952 -6.369 -8.521 1.00 0.00 C ATOM 1509 CG1 VAL A 97 -4.467 -6.418 -8.316 1.00 0.00 C ATOM 1510 CG2 VAL A 97 -2.546 -5.135 -9.328 1.00 0.00 C ATOM 0 H VAL A 97 -0.512 -7.629 -7.271 1.00 0.00 H new ATOM 0 HA VAL A 97 -2.367 -5.443 -6.709 1.00 0.00 H new ATOM 0 HB VAL A 97 -2.663 -7.251 -9.092 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -4.966 -6.385 -9.284 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -4.735 -7.341 -7.801 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -4.781 -5.564 -7.716 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.083 -5.127 -10.276 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -2.791 -4.235 -8.765 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.473 -5.162 -9.519 1.00 0.00 H new ATOM 1520 N PHE A 98 -3.046 -7.042 -5.006 1.00 0.00 N ATOM 1521 CA PHE A 98 -3.580 -7.939 -3.996 1.00 0.00 C ATOM 1522 C PHE A 98 -5.023 -7.571 -3.643 1.00 0.00 C ATOM 1523 O PHE A 98 -5.632 -6.732 -4.303 1.00 0.00 O ATOM 1524 CB PHE A 98 -2.706 -7.782 -2.750 1.00 0.00 C ATOM 1525 CG PHE A 98 -1.254 -8.218 -2.949 1.00 0.00 C ATOM 1526 CD1 PHE A 98 -0.356 -7.361 -3.506 1.00 0.00 C ATOM 1527 CD2 PHE A 98 -0.860 -9.464 -2.570 1.00 0.00 C ATOM 1528 CE1 PHE A 98 0.992 -7.766 -3.691 1.00 0.00 C ATOM 1529 CE2 PHE A 98 0.489 -9.869 -2.755 1.00 0.00 C ATOM 1530 CZ PHE A 98 1.386 -9.012 -3.311 1.00 0.00 C ATOM 0 H PHE A 98 -2.908 -6.081 -4.692 1.00 0.00 H new ATOM 0 HA PHE A 98 -3.576 -8.963 -4.369 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -2.721 -6.738 -2.437 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -3.141 -8.364 -1.938 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -0.669 -6.372 -3.808 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -1.573 -10.145 -2.129 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.705 -7.086 -4.133 1.00 0.00 H new ATOM 0 HE2 PHE A 98 0.802 -10.858 -2.454 1.00 0.00 H new ATOM 0 HZ PHE A 98 2.412 -9.320 -3.451 1.00 0.00 H new ATOM 1540 N ARG A 99 -5.526 -8.217 -2.601 1.00 0.00 N ATOM 1541 CA ARG A 99 -6.886 -7.968 -2.152 1.00 0.00 C ATOM 1542 C ARG A 99 -6.883 -7.460 -0.709 1.00 0.00 C ATOM 1543 O ARG A 99 -5.917 -7.665 0.024 1.00 0.00 O ATOM 1544 CB ARG A 99 -7.735 -9.238 -2.237 1.00 0.00 C ATOM 1545 CG ARG A 99 -7.801 -9.759 -3.674 1.00 0.00 C ATOM 1546 CD ARG A 99 -8.534 -11.101 -3.737 1.00 0.00 C ATOM 1547 NE ARG A 99 -9.045 -11.334 -5.107 1.00 0.00 N ATOM 1548 CZ ARG A 99 -9.690 -12.444 -5.489 1.00 0.00 C ATOM 1549 NH1 ARG A 99 -9.907 -13.430 -4.607 1.00 0.00 N ATOM 1550 NH2 ARG A 99 -10.119 -12.569 -6.752 1.00 0.00 N ATOM 0 H ARG A 99 -5.017 -8.912 -2.055 1.00 0.00 H new ATOM 0 HA ARG A 99 -7.319 -7.211 -2.806 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -7.314 -10.005 -1.587 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -8.742 -9.031 -1.875 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -8.311 -9.032 -4.305 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -6.792 -9.873 -4.070 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -7.859 -11.907 -3.449 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -9.360 -11.108 -3.026 1.00 0.00 H new ATOM 0 HE ARG A 99 -8.897 -10.604 -5.803 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -9.581 -13.335 -3.645 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -10.398 -14.275 -4.898 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -9.954 -11.819 -7.423 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -10.610 -13.414 -7.042 1.00 0.00 H new ATOM 1564 N LEU A 100 -7.976 -6.805 -0.344 1.00 0.00 N ATOM 1565 CA LEU A 100 -8.112 -6.265 0.998 1.00 0.00 C ATOM 1566 C LEU A 100 -8.007 -7.404 2.014 1.00 0.00 C ATOM 1567 O LEU A 100 -7.441 -7.229 3.092 1.00 0.00 O ATOM 1568 CB LEU A 100 -9.401 -5.450 1.119 1.00 0.00 C ATOM 1569 CG LEU A 100 -9.346 -4.023 0.569 1.00 0.00 C ATOM 1570 CD1 LEU A 100 -9.104 -4.027 -0.941 1.00 0.00 C ATOM 1571 CD2 LEU A 100 -10.606 -3.241 0.946 1.00 0.00 C ATOM 0 H LEU A 100 -8.775 -6.636 -0.955 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.301 -5.569 1.213 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -10.197 -5.987 0.603 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -9.680 -5.402 2.172 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.500 -3.512 1.029 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.069 -3.001 -1.307 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -8.157 -4.521 -1.156 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -9.913 -4.562 -1.438 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -10.541 -2.230 0.543 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -11.482 -3.741 0.533 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -10.694 -3.194 2.031 1.00 0.00 H new ATOM 1583 N GLU A 101 -8.561 -8.546 1.634 1.00 0.00 N ATOM 1584 CA GLU A 101 -8.537 -9.714 2.499 1.00 0.00 C ATOM 1585 C GLU A 101 -7.095 -10.080 2.856 1.00 0.00 C ATOM 1586 O GLU A 101 -6.831 -10.585 3.946 1.00 0.00 O ATOM 1587 CB GLU A 101 -9.257 -10.895 1.845 1.00 0.00 C ATOM 1588 CG GLU A 101 -8.676 -11.195 0.462 1.00 0.00 C ATOM 1589 CD GLU A 101 -9.256 -12.491 -0.108 1.00 0.00 C ATOM 1590 OE1 GLU A 101 -9.187 -13.509 0.613 1.00 0.00 O ATOM 1591 OE2 GLU A 101 -9.756 -12.433 -1.252 1.00 0.00 O ATOM 0 H GLU A 101 -9.029 -8.688 0.739 1.00 0.00 H new ATOM 0 HA GLU A 101 -9.068 -9.472 3.419 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -9.167 -11.777 2.480 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -10.320 -10.673 1.756 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -8.892 -10.368 -0.214 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -7.591 -11.277 0.529 1.00 0.00 H new ATOM 1598 N PHE A 102 -6.200 -9.812 1.916 1.00 0.00 N ATOM 1599 CA PHE A 102 -4.792 -10.107 2.118 1.00 0.00 C ATOM 1600 C PHE A 102 -4.065 -8.914 2.742 1.00 0.00 C ATOM 1601 O PHE A 102 -2.939 -9.048 3.217 1.00 0.00 O ATOM 1602 CB PHE A 102 -4.192 -10.390 0.739 1.00 0.00 C ATOM 1603 CG PHE A 102 -4.890 -11.518 -0.024 1.00 0.00 C ATOM 1604 CD1 PHE A 102 -5.563 -12.484 0.657 1.00 0.00 C ATOM 1605 CD2 PHE A 102 -4.837 -11.555 -1.382 1.00 0.00 C ATOM 1606 CE1 PHE A 102 -6.211 -13.531 -0.051 1.00 0.00 C ATOM 1607 CE2 PHE A 102 -5.485 -12.601 -2.090 1.00 0.00 C ATOM 1608 CZ PHE A 102 -6.159 -13.567 -1.410 1.00 0.00 C ATOM 0 H PHE A 102 -6.423 -9.394 1.013 1.00 0.00 H new ATOM 0 HA PHE A 102 -4.683 -10.957 2.792 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -4.236 -9.480 0.141 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -3.138 -10.643 0.858 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -5.605 -12.455 1.736 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -4.302 -10.788 -1.922 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -6.745 -14.299 0.489 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -5.443 -12.630 -3.169 1.00 0.00 H new ATOM 0 HZ PHE A 102 -6.653 -14.362 -1.949 1.00 0.00 H new ATOM 1618 N VAL A 103 -4.740 -7.774 2.719 1.00 0.00 N ATOM 1619 CA VAL A 103 -4.173 -6.558 3.277 1.00 0.00 C ATOM 1620 C VAL A 103 -4.213 -6.635 4.804 1.00 0.00 C ATOM 1621 O VAL A 103 -5.251 -6.388 5.415 1.00 0.00 O ATOM 1622 CB VAL A 103 -4.907 -5.336 2.721 1.00 0.00 C ATOM 1623 CG1 VAL A 103 -4.743 -4.129 3.648 1.00 0.00 C ATOM 1624 CG2 VAL A 103 -4.430 -5.008 1.304 1.00 0.00 C ATOM 0 H VAL A 103 -5.674 -7.667 2.323 1.00 0.00 H new ATOM 0 HA VAL A 103 -3.128 -6.455 2.984 1.00 0.00 H new ATOM 0 HB VAL A 103 -5.969 -5.577 2.670 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.274 -3.274 3.230 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -5.153 -4.366 4.630 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -3.685 -3.886 3.746 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -4.967 -4.136 0.932 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -3.361 -4.796 1.320 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -4.622 -5.858 0.650 1.00 0.00 H new ATOM 1634 N SER A 104 -3.069 -6.980 5.377 1.00 0.00 N ATOM 1635 CA SER A 104 -2.960 -7.093 6.822 1.00 0.00 C ATOM 1636 C SER A 104 -3.451 -5.806 7.486 1.00 0.00 C ATOM 1637 O SER A 104 -3.523 -4.760 6.843 1.00 0.00 O ATOM 1638 CB SER A 104 -1.520 -7.393 7.244 1.00 0.00 C ATOM 1639 OG SER A 104 -1.457 -8.403 8.247 1.00 0.00 O ATOM 0 H SER A 104 -2.210 -7.185 4.867 1.00 0.00 H new ATOM 0 HA SER A 104 -3.586 -7.924 7.148 1.00 0.00 H new ATOM 0 HB2 SER A 104 -0.946 -7.710 6.374 1.00 0.00 H new ATOM 0 HB3 SER A 104 -1.054 -6.481 7.618 1.00 0.00 H new ATOM 0 HG SER A 104 -0.657 -8.952 8.108 1.00 0.00 H new ATOM 1645 N ASN A 105 -3.777 -5.924 8.765 1.00 0.00 N ATOM 1646 CA ASN A 105 -4.259 -4.782 9.524 1.00 0.00 C ATOM 1647 C ASN A 105 -3.371 -4.581 10.754 1.00 0.00 C ATOM 1648 O ASN A 105 -3.858 -4.214 11.822 1.00 0.00 O ATOM 1649 CB ASN A 105 -5.693 -5.008 10.007 1.00 0.00 C ATOM 1650 CG ASN A 105 -5.772 -6.216 10.943 1.00 0.00 C ATOM 1651 OD1 ASN A 105 -5.342 -7.312 10.623 1.00 0.00 O ATOM 1652 ND2 ASN A 105 -6.344 -5.955 12.115 1.00 0.00 N ATOM 0 H ASN A 105 -3.717 -6.793 9.295 1.00 0.00 H new ATOM 0 HA ASN A 105 -4.231 -3.908 8.873 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -6.051 -4.118 10.525 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -6.349 -5.164 9.150 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -6.444 -6.695 12.810 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -6.683 -5.015 12.319 1.00 0.00 H new ATOM 1659 N GLN A 106 -2.084 -4.831 10.562 1.00 0.00 N ATOM 1660 CA GLN A 106 -1.124 -4.681 11.643 1.00 0.00 C ATOM 1661 C GLN A 106 -0.185 -3.507 11.360 1.00 0.00 C ATOM 1662 O GLN A 106 -0.133 -3.005 10.238 1.00 0.00 O ATOM 1663 CB GLN A 106 -0.336 -5.975 11.858 1.00 0.00 C ATOM 1664 CG GLN A 106 -1.161 -6.996 12.643 1.00 0.00 C ATOM 1665 CD GLN A 106 -1.472 -8.225 11.785 1.00 0.00 C ATOM 1666 OE1 GLN A 106 -0.603 -8.817 11.166 1.00 0.00 O ATOM 1667 NE2 GLN A 106 -2.755 -8.574 11.785 1.00 0.00 N ATOM 0 H GLN A 106 -1.684 -5.136 9.675 1.00 0.00 H new ATOM 0 HA GLN A 106 -1.670 -4.469 12.562 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -0.052 -6.396 10.894 1.00 0.00 H new ATOM 0 HB3 GLN A 106 0.587 -5.758 12.395 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -0.616 -7.300 13.536 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -2.091 -6.537 12.978 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -3.430 -8.034 12.326 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -3.064 -9.382 11.244 1.00 0.00 H new ATOM 1676 N GLU A 107 0.535 -3.104 12.397 1.00 0.00 N ATOM 1677 CA GLU A 107 1.469 -1.998 12.274 1.00 0.00 C ATOM 1678 C GLU A 107 2.820 -2.499 11.759 1.00 0.00 C ATOM 1679 O GLU A 107 3.279 -3.570 12.152 1.00 0.00 O ATOM 1680 CB GLU A 107 1.628 -1.264 13.607 1.00 0.00 C ATOM 1681 CG GLU A 107 0.267 -0.867 14.181 1.00 0.00 C ATOM 1682 CD GLU A 107 0.264 0.598 14.623 1.00 0.00 C ATOM 1683 OE1 GLU A 107 0.611 0.836 15.800 1.00 0.00 O ATOM 1684 OE2 GLU A 107 -0.085 1.446 13.774 1.00 0.00 O ATOM 0 H GLU A 107 0.490 -3.524 13.326 1.00 0.00 H new ATOM 0 HA GLU A 107 1.068 -1.287 11.551 1.00 0.00 H new ATOM 0 HB2 GLU A 107 2.154 -1.902 14.317 1.00 0.00 H new ATOM 0 HB3 GLU A 107 2.240 -0.374 13.465 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -0.508 -1.026 13.431 1.00 0.00 H new ATOM 0 HG3 GLU A 107 0.026 -1.507 15.030 1.00 0.00 H new ATOM 1691 N PHE A 108 3.418 -1.701 10.887 1.00 0.00 N ATOM 1692 CA PHE A 108 4.707 -2.050 10.314 1.00 0.00 C ATOM 1693 C PHE A 108 5.758 -2.248 11.409 1.00 0.00 C ATOM 1694 O PHE A 108 6.004 -1.346 12.208 1.00 0.00 O ATOM 1695 CB PHE A 108 5.131 -0.882 9.422 1.00 0.00 C ATOM 1696 CG PHE A 108 4.440 -0.858 8.057 1.00 0.00 C ATOM 1697 CD1 PHE A 108 4.336 -2.001 7.328 1.00 0.00 C ATOM 1698 CD2 PHE A 108 3.929 0.306 7.574 1.00 0.00 C ATOM 1699 CE1 PHE A 108 3.694 -1.980 6.061 1.00 0.00 C ATOM 1700 CE2 PHE A 108 3.287 0.328 6.307 1.00 0.00 C ATOM 1701 CZ PHE A 108 3.183 -0.815 5.578 1.00 0.00 C ATOM 0 H PHE A 108 3.034 -0.813 10.563 1.00 0.00 H new ATOM 0 HA PHE A 108 4.625 -2.981 9.753 1.00 0.00 H new ATOM 0 HB2 PHE A 108 4.920 0.053 9.941 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.210 -0.927 9.271 1.00 0.00 H new ATOM 0 HD1 PHE A 108 4.742 -2.925 7.712 1.00 0.00 H new ATOM 0 HD2 PHE A 108 4.011 1.214 8.154 1.00 0.00 H new ATOM 0 HE1 PHE A 108 3.612 -2.888 5.482 1.00 0.00 H new ATOM 0 HE2 PHE A 108 2.882 1.252 5.923 1.00 0.00 H new ATOM 0 HZ PHE A 108 2.694 -0.798 4.615 1.00 0.00 H new ATOM 1711 N THR A 109 6.349 -3.434 11.409 1.00 0.00 N ATOM 1712 CA THR A 109 7.367 -3.762 12.392 1.00 0.00 C ATOM 1713 C THR A 109 8.701 -3.113 12.015 1.00 0.00 C ATOM 1714 O THR A 109 8.817 -2.492 10.960 1.00 0.00 O ATOM 1715 CB THR A 109 7.443 -5.286 12.504 1.00 0.00 C ATOM 1716 OG1 THR A 109 7.575 -5.727 11.156 1.00 0.00 O ATOM 1717 CG2 THR A 109 6.124 -5.905 12.971 1.00 0.00 C ATOM 0 H THR A 109 6.142 -4.179 10.744 1.00 0.00 H new ATOM 0 HA THR A 109 7.112 -3.362 13.373 1.00 0.00 H new ATOM 0 HB THR A 109 8.238 -5.560 13.197 1.00 0.00 H new ATOM 0 HG1 THR A 109 7.633 -6.705 11.136 1.00 0.00 H new ATOM 0 HG21 THR A 109 6.232 -6.988 13.034 1.00 0.00 H new ATOM 0 HG22 THR A 109 5.864 -5.509 13.953 1.00 0.00 H new ATOM 0 HG23 THR A 109 5.335 -5.660 12.260 1.00 0.00 H new ATOM 1725 N GLU A 110 9.674 -3.280 12.898 1.00 0.00 N ATOM 1726 CA GLU A 110 10.995 -2.719 12.671 1.00 0.00 C ATOM 1727 C GLU A 110 11.751 -3.545 11.629 1.00 0.00 C ATOM 1728 O GLU A 110 12.661 -3.041 10.973 1.00 0.00 O ATOM 1729 CB GLU A 110 11.785 -2.630 13.978 1.00 0.00 C ATOM 1730 CG GLU A 110 13.241 -2.243 13.713 1.00 0.00 C ATOM 1731 CD GLU A 110 14.060 -2.272 15.006 1.00 0.00 C ATOM 1732 OE1 GLU A 110 14.438 -3.391 15.413 1.00 0.00 O ATOM 1733 OE2 GLU A 110 14.289 -1.173 15.557 1.00 0.00 O ATOM 0 H GLU A 110 9.574 -3.796 13.772 1.00 0.00 H new ATOM 0 HA GLU A 110 10.876 -1.706 12.287 1.00 0.00 H new ATOM 0 HB2 GLU A 110 11.324 -1.894 14.637 1.00 0.00 H new ATOM 0 HB3 GLU A 110 11.748 -3.589 14.495 1.00 0.00 H new ATOM 0 HG2 GLU A 110 13.677 -2.929 12.987 1.00 0.00 H new ATOM 0 HG3 GLU A 110 13.282 -1.246 13.274 1.00 0.00 H new ATOM 1740 N SER A 111 11.346 -4.801 11.508 1.00 0.00 N ATOM 1741 CA SER A 111 11.973 -5.702 10.557 1.00 0.00 C ATOM 1742 C SER A 111 11.439 -5.431 9.149 1.00 0.00 C ATOM 1743 O SER A 111 12.161 -4.919 8.295 1.00 0.00 O ATOM 1744 CB SER A 111 11.735 -7.163 10.942 1.00 0.00 C ATOM 1745 OG SER A 111 12.146 -7.436 12.280 1.00 0.00 O ATOM 0 H SER A 111 10.591 -5.216 12.054 1.00 0.00 H new ATOM 0 HA SER A 111 13.048 -5.521 10.573 1.00 0.00 H new ATOM 0 HB2 SER A 111 10.677 -7.399 10.832 1.00 0.00 H new ATOM 0 HB3 SER A 111 12.279 -7.812 10.256 1.00 0.00 H new ATOM 0 HG SER A 111 11.976 -8.378 12.489 1.00 0.00 H new ATOM 1751 N GLU A 112 10.178 -5.787 8.950 1.00 0.00 N ATOM 1752 CA GLU A 112 9.539 -5.588 7.660 1.00 0.00 C ATOM 1753 C GLU A 112 9.999 -4.269 7.038 1.00 0.00 C ATOM 1754 O GLU A 112 10.610 -4.262 5.971 1.00 0.00 O ATOM 1755 CB GLU A 112 8.015 -5.631 7.792 1.00 0.00 C ATOM 1756 CG GLU A 112 7.495 -7.066 7.676 1.00 0.00 C ATOM 1757 CD GLU A 112 7.474 -7.525 6.216 1.00 0.00 C ATOM 1758 OE1 GLU A 112 6.504 -7.156 5.520 1.00 0.00 O ATOM 1759 OE2 GLU A 112 8.428 -8.235 5.831 1.00 0.00 O ATOM 0 H GLU A 112 9.582 -6.212 9.660 1.00 0.00 H new ATOM 0 HA GLU A 112 9.837 -6.402 6.999 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.717 -5.209 8.752 1.00 0.00 H new ATOM 0 HB3 GLU A 112 7.562 -5.012 7.018 1.00 0.00 H new ATOM 0 HG2 GLU A 112 8.126 -7.734 8.262 1.00 0.00 H new ATOM 0 HG3 GLU A 112 6.491 -7.128 8.095 1.00 0.00 H new ATOM 1766 N PHE A 113 9.686 -3.183 7.731 1.00 0.00 N ATOM 1767 CA PHE A 113 10.059 -1.861 7.259 1.00 0.00 C ATOM 1768 C PHE A 113 11.451 -1.878 6.623 1.00 0.00 C ATOM 1769 O PHE A 113 11.661 -1.288 5.564 1.00 0.00 O ATOM 1770 CB PHE A 113 10.081 -0.940 8.480 1.00 0.00 C ATOM 1771 CG PHE A 113 10.488 0.501 8.166 1.00 0.00 C ATOM 1772 CD1 PHE A 113 9.858 1.184 7.173 1.00 0.00 C ATOM 1773 CD2 PHE A 113 11.479 1.099 8.879 1.00 0.00 C ATOM 1774 CE1 PHE A 113 10.236 2.522 6.881 1.00 0.00 C ATOM 1775 CE2 PHE A 113 11.857 2.436 8.588 1.00 0.00 C ATOM 1776 CZ PHE A 113 11.227 3.120 7.594 1.00 0.00 C ATOM 0 H PHE A 113 9.178 -3.192 8.616 1.00 0.00 H new ATOM 0 HA PHE A 113 9.349 -1.521 6.505 1.00 0.00 H new ATOM 0 HB2 PHE A 113 9.091 -0.936 8.937 1.00 0.00 H new ATOM 0 HB3 PHE A 113 10.771 -1.349 9.218 1.00 0.00 H new ATOM 0 HD1 PHE A 113 9.070 0.709 6.606 1.00 0.00 H new ATOM 0 HD2 PHE A 113 11.979 0.556 9.668 1.00 0.00 H new ATOM 0 HE1 PHE A 113 9.736 3.064 6.092 1.00 0.00 H new ATOM 0 HE2 PHE A 113 12.644 2.910 9.155 1.00 0.00 H new ATOM 0 HZ PHE A 113 11.514 4.137 7.372 1.00 0.00 H new ATOM 1786 N MET A 114 12.366 -2.560 7.296 1.00 0.00 N ATOM 1787 CA MET A 114 13.731 -2.662 6.811 1.00 0.00 C ATOM 1788 C MET A 114 13.828 -3.657 5.652 1.00 0.00 C ATOM 1789 O MET A 114 14.519 -3.403 4.667 1.00 0.00 O ATOM 1790 CB MET A 114 14.646 -3.114 7.950 1.00 0.00 C ATOM 1791 CG MET A 114 14.633 -2.102 9.098 1.00 0.00 C ATOM 1792 SD MET A 114 15.609 -0.673 8.664 1.00 0.00 S ATOM 1793 CE MET A 114 14.884 0.541 9.754 1.00 0.00 C ATOM 0 H MET A 114 12.188 -3.048 8.174 1.00 0.00 H new ATOM 0 HA MET A 114 14.043 -1.682 6.451 1.00 0.00 H new ATOM 0 HB2 MET A 114 14.323 -4.089 8.316 1.00 0.00 H new ATOM 0 HB3 MET A 114 15.663 -3.234 7.578 1.00 0.00 H new ATOM 0 HG2 MET A 114 13.609 -1.800 9.316 1.00 0.00 H new ATOM 0 HG3 MET A 114 15.029 -2.562 10.003 1.00 0.00 H new ATOM 0 HE1 MET A 114 14.515 1.382 9.167 1.00 0.00 H new ATOM 0 HE2 MET A 114 14.057 0.090 10.302 1.00 0.00 H new ATOM 0 HE3 MET A 114 15.637 0.893 10.459 1.00 0.00 H new ATOM 1803 N LYS A 115 13.126 -4.770 5.810 1.00 0.00 N ATOM 1804 CA LYS A 115 13.125 -5.804 4.790 1.00 0.00 C ATOM 1805 C LYS A 115 12.598 -5.220 3.477 1.00 0.00 C ATOM 1806 O LYS A 115 13.162 -5.468 2.413 1.00 0.00 O ATOM 1807 CB LYS A 115 12.349 -7.031 5.272 1.00 0.00 C ATOM 1808 CG LYS A 115 12.959 -7.596 6.556 1.00 0.00 C ATOM 1809 CD LYS A 115 13.747 -8.877 6.272 1.00 0.00 C ATOM 1810 CE LYS A 115 12.807 -10.033 5.925 1.00 0.00 C ATOM 1811 NZ LYS A 115 13.529 -11.076 5.162 1.00 0.00 N ATOM 0 H LYS A 115 12.554 -4.978 6.629 1.00 0.00 H new ATOM 0 HA LYS A 115 14.140 -6.152 4.600 1.00 0.00 H new ATOM 0 HB2 LYS A 115 11.308 -6.761 5.448 1.00 0.00 H new ATOM 0 HB3 LYS A 115 12.353 -7.796 4.496 1.00 0.00 H new ATOM 0 HG2 LYS A 115 13.616 -6.853 7.008 1.00 0.00 H new ATOM 0 HG3 LYS A 115 12.169 -7.803 7.278 1.00 0.00 H new ATOM 0 HD2 LYS A 115 14.440 -8.707 5.448 1.00 0.00 H new ATOM 0 HD3 LYS A 115 14.347 -9.140 7.143 1.00 0.00 H new ATOM 0 HE2 LYS A 115 12.395 -10.462 6.839 1.00 0.00 H new ATOM 0 HE3 LYS A 115 11.966 -9.662 5.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 12.877 -11.854 4.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 13.901 -10.667 4.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 14.317 -11.441 5.734 1.00 0.00 H new ATOM 1825 N TRP A 116 11.522 -4.455 3.597 1.00 0.00 N ATOM 1826 CA TRP A 116 10.913 -3.834 2.434 1.00 0.00 C ATOM 1827 C TRP A 116 11.895 -2.799 1.881 1.00 0.00 C ATOM 1828 O TRP A 116 12.156 -2.765 0.679 1.00 0.00 O ATOM 1829 CB TRP A 116 9.549 -3.235 2.784 1.00 0.00 C ATOM 1830 CG TRP A 116 9.162 -2.027 1.929 1.00 0.00 C ATOM 1831 CD1 TRP A 116 8.719 -2.019 0.664 1.00 0.00 C ATOM 1832 CD2 TRP A 116 9.201 -0.641 2.330 1.00 0.00 C ATOM 1833 NE1 TRP A 116 8.471 -0.735 0.223 1.00 0.00 N ATOM 1834 CE2 TRP A 116 8.773 0.129 1.269 1.00 0.00 C ATOM 1835 CE3 TRP A 116 9.585 -0.059 3.551 1.00 0.00 C ATOM 1836 CZ2 TRP A 116 8.689 1.526 1.320 1.00 0.00 C ATOM 1837 CZ3 TRP A 116 9.495 1.338 3.586 1.00 0.00 C ATOM 1838 CH2 TRP A 116 9.067 2.128 2.526 1.00 0.00 C ATOM 0 H TRP A 116 11.057 -4.252 4.482 1.00 0.00 H new ATOM 0 HA TRP A 116 10.716 -4.576 1.660 1.00 0.00 H new ATOM 0 HB2 TRP A 116 8.786 -4.005 2.673 1.00 0.00 H new ATOM 0 HB3 TRP A 116 9.552 -2.939 3.833 1.00 0.00 H new ATOM 0 HD1 TRP A 116 8.574 -2.906 0.065 1.00 0.00 H new ATOM 0 HE1 TRP A 116 8.129 -0.469 -0.700 1.00 0.00 H new ATOM 0 HE3 TRP A 116 9.922 -0.643 4.395 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 8.351 2.107 0.475 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 9.778 1.837 4.501 1.00 0.00 H new ATOM 0 HH2 TRP A 116 9.026 3.202 2.632 1.00 0.00 H new ATOM 1849 N LYS A 117 12.415 -1.981 2.785 1.00 0.00 N ATOM 1850 CA LYS A 117 13.363 -0.949 2.403 1.00 0.00 C ATOM 1851 C LYS A 117 14.389 -1.539 1.433 1.00 0.00 C ATOM 1852 O LYS A 117 14.673 -0.951 0.391 1.00 0.00 O ATOM 1853 CB LYS A 117 13.987 -0.309 3.644 1.00 0.00 C ATOM 1854 CG LYS A 117 13.412 1.088 3.889 1.00 0.00 C ATOM 1855 CD LYS A 117 13.585 1.504 5.351 1.00 0.00 C ATOM 1856 CE LYS A 117 15.044 1.853 5.652 1.00 0.00 C ATOM 1857 NZ LYS A 117 15.177 3.292 5.974 1.00 0.00 N ATOM 0 H LYS A 117 12.197 -2.013 3.781 1.00 0.00 H new ATOM 0 HA LYS A 117 12.855 -0.140 1.877 1.00 0.00 H new ATOM 0 HB2 LYS A 117 13.803 -0.939 4.514 1.00 0.00 H new ATOM 0 HB3 LYS A 117 15.068 -0.245 3.520 1.00 0.00 H new ATOM 0 HG2 LYS A 117 13.910 1.809 3.241 1.00 0.00 H new ATOM 0 HG3 LYS A 117 12.354 1.101 3.626 1.00 0.00 H new ATOM 0 HD2 LYS A 117 12.950 2.363 5.566 1.00 0.00 H new ATOM 0 HD3 LYS A 117 13.259 0.695 6.004 1.00 0.00 H new ATOM 0 HE2 LYS A 117 15.403 1.253 6.488 1.00 0.00 H new ATOM 0 HE3 LYS A 117 15.668 1.607 4.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 16.173 3.512 6.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 14.854 3.860 5.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 14.597 3.516 6.808 1.00 0.00 H new ATOM 1871 N GLU A 118 14.918 -2.693 1.811 1.00 0.00 N ATOM 1872 CA GLU A 118 15.907 -3.369 0.988 1.00 0.00 C ATOM 1873 C GLU A 118 15.507 -3.298 -0.487 1.00 0.00 C ATOM 1874 O GLU A 118 16.309 -2.904 -1.333 1.00 0.00 O ATOM 1875 CB GLU A 118 16.094 -4.820 1.437 1.00 0.00 C ATOM 1876 CG GLU A 118 16.758 -4.887 2.813 1.00 0.00 C ATOM 1877 CD GLU A 118 18.256 -5.175 2.686 1.00 0.00 C ATOM 1878 OE1 GLU A 118 18.593 -6.369 2.533 1.00 0.00 O ATOM 1879 OE2 GLU A 118 19.029 -4.195 2.744 1.00 0.00 O ATOM 0 H GLU A 118 14.681 -3.178 2.677 1.00 0.00 H new ATOM 0 HA GLU A 118 16.863 -2.860 1.110 1.00 0.00 H new ATOM 0 HB2 GLU A 118 15.127 -5.321 1.471 1.00 0.00 H new ATOM 0 HB3 GLU A 118 16.704 -5.354 0.709 1.00 0.00 H new ATOM 0 HG2 GLU A 118 16.609 -3.944 3.339 1.00 0.00 H new ATOM 0 HG3 GLU A 118 16.284 -5.665 3.412 1.00 0.00 H new ATOM 1886 N ALA A 119 14.267 -3.685 -0.751 1.00 0.00 N ATOM 1887 CA ALA A 119 13.752 -3.670 -2.109 1.00 0.00 C ATOM 1888 C ALA A 119 13.946 -2.276 -2.708 1.00 0.00 C ATOM 1889 O ALA A 119 14.394 -2.142 -3.846 1.00 0.00 O ATOM 1890 CB ALA A 119 12.284 -4.103 -2.103 1.00 0.00 C ATOM 0 H ALA A 119 13.605 -4.011 -0.047 1.00 0.00 H new ATOM 0 HA ALA A 119 14.298 -4.376 -2.734 1.00 0.00 H new ATOM 0 HB1 ALA A 119 11.897 -4.092 -3.122 1.00 0.00 H new ATOM 0 HB2 ALA A 119 12.204 -5.111 -1.695 1.00 0.00 H new ATOM 0 HB3 ALA A 119 11.704 -3.415 -1.487 1.00 0.00 H new ATOM 1896 N MET A 120 13.598 -1.272 -1.916 1.00 0.00 N ATOM 1897 CA MET A 120 13.728 0.107 -2.354 1.00 0.00 C ATOM 1898 C MET A 120 15.198 0.487 -2.540 1.00 0.00 C ATOM 1899 O MET A 120 15.550 1.170 -3.500 1.00 0.00 O ATOM 1900 CB MET A 120 13.088 1.034 -1.318 1.00 0.00 C ATOM 1901 CG MET A 120 11.643 0.619 -1.030 1.00 0.00 C ATOM 1902 SD MET A 120 10.537 1.423 -2.176 1.00 0.00 S ATOM 1903 CE MET A 120 10.986 3.128 -1.898 1.00 0.00 C ATOM 0 H MET A 120 13.226 -1.387 -0.973 1.00 0.00 H new ATOM 0 HA MET A 120 13.221 0.213 -3.313 1.00 0.00 H new ATOM 0 HB2 MET A 120 13.668 1.010 -0.395 1.00 0.00 H new ATOM 0 HB3 MET A 120 13.110 2.061 -1.681 1.00 0.00 H new ATOM 0 HG2 MET A 120 11.543 -0.463 -1.114 1.00 0.00 H new ATOM 0 HG3 MET A 120 11.377 0.885 -0.007 1.00 0.00 H new ATOM 0 HE1 MET A 120 10.133 3.666 -1.486 1.00 0.00 H new ATOM 0 HE2 MET A 120 11.818 3.175 -1.196 1.00 0.00 H new ATOM 0 HE3 MET A 120 11.282 3.585 -2.842 1.00 0.00 H new ATOM 1913 N PHE A 121 16.018 0.027 -1.606 1.00 0.00 N ATOM 1914 CA PHE A 121 17.442 0.311 -1.654 1.00 0.00 C ATOM 1915 C PHE A 121 18.106 -0.419 -2.823 1.00 0.00 C ATOM 1916 O PHE A 121 19.027 0.107 -3.447 1.00 0.00 O ATOM 1917 CB PHE A 121 18.044 -0.197 -0.343 1.00 0.00 C ATOM 1918 CG PHE A 121 17.960 0.805 0.810 1.00 0.00 C ATOM 1919 CD1 PHE A 121 16.747 1.231 1.253 1.00 0.00 C ATOM 1920 CD2 PHE A 121 19.098 1.269 1.392 1.00 0.00 C ATOM 1921 CE1 PHE A 121 16.668 2.162 2.323 1.00 0.00 C ATOM 1922 CE2 PHE A 121 19.019 2.199 2.462 1.00 0.00 C ATOM 1923 CZ PHE A 121 17.806 2.626 2.905 1.00 0.00 C ATOM 0 H PHE A 121 15.723 -0.541 -0.811 1.00 0.00 H new ATOM 0 HA PHE A 121 17.604 1.380 -1.788 1.00 0.00 H new ATOM 0 HB2 PHE A 121 17.532 -1.114 -0.052 1.00 0.00 H new ATOM 0 HB3 PHE A 121 19.090 -0.455 -0.511 1.00 0.00 H new ATOM 0 HD1 PHE A 121 15.843 0.861 0.791 1.00 0.00 H new ATOM 0 HD2 PHE A 121 20.061 0.930 1.041 1.00 0.00 H new ATOM 0 HE1 PHE A 121 15.705 2.501 2.674 1.00 0.00 H new ATOM 0 HE2 PHE A 121 19.923 2.568 2.924 1.00 0.00 H new ATOM 0 HZ PHE A 121 17.747 3.333 3.719 1.00 0.00 H new ATOM 1933 N SER A 122 17.614 -1.621 -3.086 1.00 0.00 N ATOM 1934 CA SER A 122 18.148 -2.429 -4.169 1.00 0.00 C ATOM 1935 C SER A 122 17.717 -1.848 -5.517 1.00 0.00 C ATOM 1936 O SER A 122 18.491 -1.846 -6.473 1.00 0.00 O ATOM 1937 CB SER A 122 17.692 -3.884 -4.048 1.00 0.00 C ATOM 1938 OG SER A 122 18.637 -4.789 -4.612 1.00 0.00 O ATOM 0 H SER A 122 16.851 -2.055 -2.567 1.00 0.00 H new ATOM 0 HA SER A 122 19.236 -2.411 -4.104 1.00 0.00 H new ATOM 0 HB2 SER A 122 17.538 -4.129 -2.997 1.00 0.00 H new ATOM 0 HB3 SER A 122 16.731 -4.005 -4.548 1.00 0.00 H new ATOM 0 HG SER A 122 18.310 -5.707 -4.513 1.00 0.00 H new ATOM 1944 N ALA A 123 16.482 -1.369 -5.551 1.00 0.00 N ATOM 1945 CA ALA A 123 15.938 -0.787 -6.766 1.00 0.00 C ATOM 1946 C ALA A 123 16.336 0.689 -6.841 1.00 0.00 C ATOM 1947 O ALA A 123 15.844 1.425 -7.696 1.00 0.00 O ATOM 1948 CB ALA A 123 14.421 -0.983 -6.792 1.00 0.00 C ATOM 0 H ALA A 123 15.843 -1.372 -4.756 1.00 0.00 H new ATOM 0 HA ALA A 123 16.346 -1.285 -7.646 1.00 0.00 H new ATOM 0 HB1 ALA A 123 14.013 -0.546 -7.704 1.00 0.00 H new ATOM 0 HB2 ALA A 123 14.191 -2.048 -6.766 1.00 0.00 H new ATOM 0 HB3 ALA A 123 13.976 -0.494 -5.925 1.00 0.00 H new ATOM 1954 N GLY A 124 17.222 1.077 -5.936 1.00 0.00 N ATOM 1955 CA GLY A 124 17.691 2.452 -5.889 1.00 0.00 C ATOM 1956 C GLY A 124 16.519 3.433 -5.951 1.00 0.00 C ATOM 1957 O GLY A 124 16.609 4.473 -6.603 1.00 0.00 O ATOM 0 H GLY A 124 17.628 0.464 -5.229 1.00 0.00 H new ATOM 0 HA2 GLY A 124 18.259 2.615 -4.973 1.00 0.00 H new ATOM 0 HA3 GLY A 124 18.370 2.637 -6.722 1.00 0.00 H new ATOM 1961 N MET A 125 15.446 3.069 -5.265 1.00 0.00 N ATOM 1962 CA MET A 125 14.258 3.905 -5.234 1.00 0.00 C ATOM 1963 C MET A 125 14.274 4.835 -4.019 1.00 0.00 C ATOM 1964 O MET A 125 15.278 4.923 -3.313 1.00 0.00 O ATOM 1965 CB MET A 125 13.012 3.019 -5.181 1.00 0.00 C ATOM 1966 CG MET A 125 12.488 2.726 -6.589 1.00 0.00 C ATOM 1967 SD MET A 125 10.765 3.177 -6.705 1.00 0.00 S ATOM 1968 CE MET A 125 10.009 1.578 -6.465 1.00 0.00 C ATOM 0 H MET A 125 15.374 2.206 -4.726 1.00 0.00 H new ATOM 0 HA MET A 125 14.243 4.516 -6.136 1.00 0.00 H new ATOM 0 HB2 MET A 125 13.248 2.083 -4.675 1.00 0.00 H new ATOM 0 HB3 MET A 125 12.236 3.511 -4.595 1.00 0.00 H new ATOM 0 HG2 MET A 125 13.068 3.282 -7.325 1.00 0.00 H new ATOM 0 HG3 MET A 125 12.612 1.668 -6.819 1.00 0.00 H new ATOM 0 HE1 MET A 125 9.097 1.691 -5.879 1.00 0.00 H new ATOM 0 HE2 MET A 125 9.767 1.141 -7.434 1.00 0.00 H new ATOM 0 HE3 MET A 125 10.701 0.924 -5.935 1.00 0.00 H new ATOM 1978 N GLN A 126 13.151 5.507 -3.814 1.00 0.00 N ATOM 1979 CA GLN A 126 13.023 6.428 -2.697 1.00 0.00 C ATOM 1980 C GLN A 126 11.767 6.106 -1.884 1.00 0.00 C ATOM 1981 O GLN A 126 10.738 5.735 -2.447 1.00 0.00 O ATOM 1982 CB GLN A 126 13.005 7.879 -3.182 1.00 0.00 C ATOM 1983 CG GLN A 126 14.331 8.250 -3.849 1.00 0.00 C ATOM 1984 CD GLN A 126 14.149 9.422 -4.816 1.00 0.00 C ATOM 1985 OE1 GLN A 126 13.862 10.542 -4.427 1.00 0.00 O ATOM 1986 NE2 GLN A 126 14.332 9.103 -6.094 1.00 0.00 N ATOM 0 H GLN A 126 12.321 5.432 -4.402 1.00 0.00 H new ATOM 0 HA GLN A 126 13.892 6.306 -2.050 1.00 0.00 H new ATOM 0 HB2 GLN A 126 12.187 8.020 -3.888 1.00 0.00 H new ATOM 0 HB3 GLN A 126 12.818 8.545 -2.340 1.00 0.00 H new ATOM 0 HG2 GLN A 126 15.064 8.513 -3.087 1.00 0.00 H new ATOM 0 HG3 GLN A 126 14.725 7.388 -4.387 1.00 0.00 H new ATOM 0 HE21 GLN A 126 14.571 8.145 -6.351 1.00 0.00 H new ATOM 0 HE22 GLN A 126 14.234 9.816 -6.817 1.00 0.00 H new ATOM 1995 N LEU A 127 11.893 6.260 -0.575 1.00 0.00 N ATOM 1996 CA LEU A 127 10.781 5.990 0.321 1.00 0.00 C ATOM 1997 C LEU A 127 9.946 7.262 0.488 1.00 0.00 C ATOM 1998 O LEU A 127 10.255 8.294 -0.106 1.00 0.00 O ATOM 1999 CB LEU A 127 11.286 5.408 1.643 1.00 0.00 C ATOM 2000 CG LEU A 127 12.557 4.560 1.560 1.00 0.00 C ATOM 2001 CD1 LEU A 127 13.435 4.767 2.795 1.00 0.00 C ATOM 2002 CD2 LEU A 127 12.218 3.085 1.338 1.00 0.00 C ATOM 0 H LEU A 127 12.748 6.568 -0.112 1.00 0.00 H new ATOM 0 HA LEU A 127 10.125 5.231 -0.104 1.00 0.00 H new ATOM 0 HB2 LEU A 127 11.467 6.231 2.334 1.00 0.00 H new ATOM 0 HB3 LEU A 127 10.493 4.797 2.075 1.00 0.00 H new ATOM 0 HG LEU A 127 13.133 4.891 0.696 1.00 0.00 H new ATOM 0 HD11 LEU A 127 14.332 4.153 2.711 1.00 0.00 H new ATOM 0 HD12 LEU A 127 13.719 5.817 2.867 1.00 0.00 H new ATOM 0 HD13 LEU A 127 12.880 4.479 3.688 1.00 0.00 H new ATOM 0 HD21 LEU A 127 13.139 2.504 1.283 1.00 0.00 H new ATOM 0 HD22 LEU A 127 11.610 2.723 2.167 1.00 0.00 H new ATOM 0 HD23 LEU A 127 11.663 2.975 0.406 1.00 0.00 H new ATOM 2014 N PRO A 128 8.877 7.142 1.320 1.00 0.00 N ATOM 2015 CA PRO A 128 7.996 8.270 1.573 1.00 0.00 C ATOM 2016 C PRO A 128 8.656 9.283 2.510 1.00 0.00 C ATOM 2017 O PRO A 128 9.180 8.913 3.560 1.00 0.00 O ATOM 2018 CB PRO A 128 6.732 7.658 2.155 1.00 0.00 C ATOM 2019 CG PRO A 128 7.125 6.271 2.638 1.00 0.00 C ATOM 2020 CD PRO A 128 8.481 5.936 2.040 1.00 0.00 C ATOM 0 HA PRO A 128 7.769 8.838 0.670 1.00 0.00 H new ATOM 0 HB2 PRO A 128 6.347 8.263 2.976 1.00 0.00 H new ATOM 0 HB3 PRO A 128 5.944 7.601 1.404 1.00 0.00 H new ATOM 0 HG2 PRO A 128 7.171 6.245 3.727 1.00 0.00 H new ATOM 0 HG3 PRO A 128 6.381 5.535 2.333 1.00 0.00 H new ATOM 0 HD2 PRO A 128 9.204 5.682 2.815 1.00 0.00 H new ATOM 0 HD3 PRO A 128 8.417 5.078 1.371 1.00 0.00 H new ATOM 2028 N THR A 129 8.611 10.541 2.096 1.00 0.00 N ATOM 2029 CA THR A 129 9.198 11.610 2.885 1.00 0.00 C ATOM 2030 C THR A 129 8.257 12.013 4.022 1.00 0.00 C ATOM 2031 O THR A 129 7.043 12.076 3.835 1.00 0.00 O ATOM 2032 CB THR A 129 9.537 12.764 1.940 1.00 0.00 C ATOM 2033 OG1 THR A 129 8.555 12.671 0.912 1.00 0.00 O ATOM 2034 CG2 THR A 129 10.864 12.551 1.208 1.00 0.00 C ATOM 0 H THR A 129 8.177 10.844 1.224 1.00 0.00 H new ATOM 0 HA THR A 129 10.119 11.284 3.368 1.00 0.00 H new ATOM 0 HB THR A 129 9.580 13.695 2.505 1.00 0.00 H new ATOM 0 HG1 THR A 129 8.700 13.384 0.256 1.00 0.00 H new ATOM 0 HG21 THR A 129 11.057 13.399 0.550 1.00 0.00 H new ATOM 0 HG22 THR A 129 11.671 12.465 1.936 1.00 0.00 H new ATOM 0 HG23 THR A 129 10.810 11.637 0.616 1.00 0.00 H new ATOM 2042 N LEU A 130 8.853 12.274 5.176 1.00 0.00 N ATOM 2043 CA LEU A 130 8.083 12.669 6.344 1.00 0.00 C ATOM 2044 C LEU A 130 6.946 13.596 5.909 1.00 0.00 C ATOM 2045 O LEU A 130 5.877 13.600 6.517 1.00 0.00 O ATOM 2046 CB LEU A 130 8.998 13.276 7.409 1.00 0.00 C ATOM 2047 CG LEU A 130 9.911 12.294 8.147 1.00 0.00 C ATOM 2048 CD1 LEU A 130 9.193 10.968 8.408 1.00 0.00 C ATOM 2049 CD2 LEU A 130 11.226 12.095 7.392 1.00 0.00 C ATOM 0 H LEU A 130 9.860 12.220 5.328 1.00 0.00 H new ATOM 0 HA LEU A 130 7.624 11.797 6.811 1.00 0.00 H new ATOM 0 HB2 LEU A 130 9.621 14.035 6.935 1.00 0.00 H new ATOM 0 HB3 LEU A 130 8.377 13.787 8.145 1.00 0.00 H new ATOM 0 HG LEU A 130 10.159 12.722 9.118 1.00 0.00 H new ATOM 0 HD11 LEU A 130 9.864 10.288 8.933 1.00 0.00 H new ATOM 0 HD12 LEU A 130 8.308 11.148 9.018 1.00 0.00 H new ATOM 0 HD13 LEU A 130 8.895 10.522 7.459 1.00 0.00 H new ATOM 0 HD21 LEU A 130 11.856 11.393 7.938 1.00 0.00 H new ATOM 0 HD22 LEU A 130 11.018 11.699 6.398 1.00 0.00 H new ATOM 0 HD23 LEU A 130 11.742 13.051 7.302 1.00 0.00 H new ATOM 2061 N ASP A 131 7.215 14.360 4.861 1.00 0.00 N ATOM 2062 CA ASP A 131 6.228 15.289 4.338 1.00 0.00 C ATOM 2063 C ASP A 131 5.056 14.503 3.748 1.00 0.00 C ATOM 2064 O ASP A 131 3.909 14.697 4.149 1.00 0.00 O ATOM 2065 CB ASP A 131 6.822 16.156 3.226 1.00 0.00 C ATOM 2066 CG ASP A 131 6.205 17.550 3.093 1.00 0.00 C ATOM 2067 OD1 ASP A 131 4.998 17.667 3.397 1.00 0.00 O ATOM 2068 OD2 ASP A 131 6.953 18.466 2.691 1.00 0.00 O ATOM 0 H ASP A 131 8.103 14.355 4.359 1.00 0.00 H new ATOM 0 HA ASP A 131 5.900 15.928 5.158 1.00 0.00 H new ATOM 0 HB2 ASP A 131 7.892 16.264 3.403 1.00 0.00 H new ATOM 0 HB3 ASP A 131 6.707 15.632 2.277 1.00 0.00 H new ATOM 2073 N GLU A 132 5.384 13.631 2.806 1.00 0.00 N ATOM 2074 CA GLU A 132 4.372 12.814 2.157 1.00 0.00 C ATOM 2075 C GLU A 132 3.583 12.019 3.200 1.00 0.00 C ATOM 2076 O GLU A 132 2.412 11.705 2.991 1.00 0.00 O ATOM 2077 CB GLU A 132 5.002 11.883 1.119 1.00 0.00 C ATOM 2078 CG GLU A 132 4.811 12.432 -0.296 1.00 0.00 C ATOM 2079 CD GLU A 132 4.509 11.304 -1.286 1.00 0.00 C ATOM 2080 OE1 GLU A 132 3.314 10.957 -1.403 1.00 0.00 O ATOM 2081 OE2 GLU A 132 5.480 10.815 -1.902 1.00 0.00 O ATOM 0 H GLU A 132 6.336 13.472 2.476 1.00 0.00 H new ATOM 0 HA GLU A 132 3.681 13.474 1.633 1.00 0.00 H new ATOM 0 HB2 GLU A 132 6.066 11.767 1.327 1.00 0.00 H new ATOM 0 HB3 GLU A 132 4.552 10.893 1.193 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.995 13.155 -0.302 1.00 0.00 H new ATOM 0 HG3 GLU A 132 5.710 12.964 -0.608 1.00 0.00 H new ATOM 2088 N ILE A 133 4.257 11.715 4.300 1.00 0.00 N ATOM 2089 CA ILE A 133 3.633 10.962 5.375 1.00 0.00 C ATOM 2090 C ILE A 133 2.576 11.833 6.055 1.00 0.00 C ATOM 2091 O ILE A 133 1.422 11.427 6.186 1.00 0.00 O ATOM 2092 CB ILE A 133 4.695 10.420 6.335 1.00 0.00 C ATOM 2093 CG1 ILE A 133 5.687 9.516 5.601 1.00 0.00 C ATOM 2094 CG2 ILE A 133 4.046 9.712 7.526 1.00 0.00 C ATOM 2095 CD1 ILE A 133 5.260 8.050 5.686 1.00 0.00 C ATOM 0 H ILE A 133 5.228 11.976 4.470 1.00 0.00 H new ATOM 0 HA ILE A 133 3.118 10.087 4.979 1.00 0.00 H new ATOM 0 HB ILE A 133 5.261 11.263 6.731 1.00 0.00 H new ATOM 0 HG12 ILE A 133 5.755 9.818 4.556 1.00 0.00 H new ATOM 0 HG13 ILE A 133 6.681 9.635 6.033 1.00 0.00 H new ATOM 0 HG21 ILE A 133 4.822 9.336 8.193 1.00 0.00 H new ATOM 0 HG22 ILE A 133 3.413 10.415 8.066 1.00 0.00 H new ATOM 0 HG23 ILE A 133 3.440 8.879 7.168 1.00 0.00 H new ATOM 0 HD11 ILE A 133 5.982 7.429 5.156 1.00 0.00 H new ATOM 0 HD12 ILE A 133 5.216 7.744 6.731 1.00 0.00 H new ATOM 0 HD13 ILE A 133 4.277 7.931 5.231 1.00 0.00 H new ATOM 2107 N ASN A 134 3.007 13.015 6.471 1.00 0.00 N ATOM 2108 CA ASN A 134 2.112 13.948 7.134 1.00 0.00 C ATOM 2109 C ASN A 134 1.001 14.359 6.166 1.00 0.00 C ATOM 2110 O ASN A 134 -0.181 14.238 6.484 1.00 0.00 O ATOM 2111 CB ASN A 134 2.856 15.213 7.566 1.00 0.00 C ATOM 2112 CG ASN A 134 2.175 15.866 8.771 1.00 0.00 C ATOM 2113 OD1 ASN A 134 1.572 16.922 8.679 1.00 0.00 O ATOM 2114 ND2 ASN A 134 2.305 15.179 9.902 1.00 0.00 N ATOM 0 H ASN A 134 3.965 13.348 6.362 1.00 0.00 H new ATOM 0 HA ASN A 134 1.702 13.453 8.014 1.00 0.00 H new ATOM 0 HB2 ASN A 134 3.887 14.965 7.817 1.00 0.00 H new ATOM 0 HB3 ASN A 134 2.891 15.920 6.737 1.00 0.00 H new ATOM 0 HD21 ASN A 134 1.886 15.530 10.763 1.00 0.00 H new ATOM 0 HD22 ASN A 134 2.824 14.301 9.908 1.00 0.00 H new ATOM 2121 N LYS A 135 1.421 14.836 5.003 1.00 0.00 N ATOM 2122 CA LYS A 135 0.476 15.266 3.986 1.00 0.00 C ATOM 2123 C LYS A 135 -0.529 14.143 3.723 1.00 0.00 C ATOM 2124 O LYS A 135 -1.724 14.395 3.580 1.00 0.00 O ATOM 2125 CB LYS A 135 1.215 15.736 2.732 1.00 0.00 C ATOM 2126 CG LYS A 135 1.443 14.575 1.762 1.00 0.00 C ATOM 2127 CD LYS A 135 0.186 14.297 0.935 1.00 0.00 C ATOM 2128 CE LYS A 135 0.432 14.580 -0.548 1.00 0.00 C ATOM 2129 NZ LYS A 135 0.250 16.019 -0.839 1.00 0.00 N ATOM 0 H LYS A 135 2.402 14.934 4.743 1.00 0.00 H new ATOM 0 HA LYS A 135 -0.092 16.128 4.334 1.00 0.00 H new ATOM 0 HB2 LYS A 135 0.639 16.519 2.238 1.00 0.00 H new ATOM 0 HB3 LYS A 135 2.173 16.173 3.013 1.00 0.00 H new ATOM 0 HG2 LYS A 135 2.275 14.809 1.098 1.00 0.00 H new ATOM 0 HG3 LYS A 135 1.722 13.680 2.319 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -0.117 13.258 1.065 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -0.635 14.916 1.296 1.00 0.00 H new ATOM 0 HE2 LYS A 135 1.442 14.273 -0.820 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -0.255 13.991 -1.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 0.421 16.193 -1.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -0.721 16.302 -0.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 0.923 16.575 -0.273 1.00 0.00 H new ATOM 2143 N LYS A 136 -0.007 12.926 3.666 1.00 0.00 N ATOM 2144 CA LYS A 136 -0.843 11.764 3.421 1.00 0.00 C ATOM 2145 C LYS A 136 -1.706 11.493 4.656 1.00 0.00 C ATOM 2146 O LYS A 136 -2.924 11.363 4.550 1.00 0.00 O ATOM 2147 CB LYS A 136 0.012 10.569 2.995 1.00 0.00 C ATOM 2148 CG LYS A 136 -0.850 9.319 2.801 1.00 0.00 C ATOM 2149 CD LYS A 136 -2.144 9.656 2.057 1.00 0.00 C ATOM 2150 CE LYS A 136 -1.853 10.084 0.617 1.00 0.00 C ATOM 2151 NZ LYS A 136 -3.088 10.042 -0.196 1.00 0.00 N ATOM 0 H LYS A 136 0.985 12.720 3.785 1.00 0.00 H new ATOM 0 HA LYS A 136 -1.523 11.952 2.590 1.00 0.00 H new ATOM 0 HB2 LYS A 136 0.534 10.803 2.067 1.00 0.00 H new ATOM 0 HB3 LYS A 136 0.775 10.376 3.749 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -0.290 8.569 2.242 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -1.087 8.882 3.771 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -2.804 8.788 2.056 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -2.670 10.456 2.579 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -1.439 11.092 0.608 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -1.101 9.426 0.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -2.993 9.316 -0.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -3.898 9.811 0.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -3.243 10.969 -0.641 1.00 0.00 H new ATOM 2165 N GLU A 137 -1.040 11.417 5.799 1.00 0.00 N ATOM 2166 CA GLU A 137 -1.730 11.164 7.052 1.00 0.00 C ATOM 2167 C GLU A 137 -3.021 11.983 7.121 1.00 0.00 C ATOM 2168 O GLU A 137 -4.110 11.423 7.236 1.00 0.00 O ATOM 2169 CB GLU A 137 -0.825 11.466 8.247 1.00 0.00 C ATOM 2170 CG GLU A 137 -1.313 10.740 9.502 1.00 0.00 C ATOM 2171 CD GLU A 137 -0.495 11.152 10.728 1.00 0.00 C ATOM 2172 OE1 GLU A 137 -0.079 12.330 10.762 1.00 0.00 O ATOM 2173 OE2 GLU A 137 -0.304 10.280 11.603 1.00 0.00 O ATOM 0 H GLU A 137 -0.029 11.526 5.883 1.00 0.00 H new ATOM 0 HA GLU A 137 -1.990 10.106 7.094 1.00 0.00 H new ATOM 0 HB2 GLU A 137 0.197 11.161 8.020 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -0.804 12.540 8.429 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -2.366 10.966 9.671 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -1.237 9.663 9.356 1.00 0.00 H new ATOM 2180 N LEU A 138 -2.856 13.296 7.048 1.00 0.00 N ATOM 2181 CA LEU A 138 -3.995 14.197 7.101 1.00 0.00 C ATOM 2182 C LEU A 138 -5.093 13.679 6.171 1.00 0.00 C ATOM 2183 O LEU A 138 -6.254 13.587 6.567 1.00 0.00 O ATOM 2184 CB LEU A 138 -3.557 15.631 6.798 1.00 0.00 C ATOM 2185 CG LEU A 138 -3.053 16.446 7.991 1.00 0.00 C ATOM 2186 CD1 LEU A 138 -4.049 16.393 9.151 1.00 0.00 C ATOM 2187 CD2 LEU A 138 -1.655 15.990 8.414 1.00 0.00 C ATOM 0 H LEU A 138 -1.951 13.757 6.953 1.00 0.00 H new ATOM 0 HA LEU A 138 -4.415 14.222 8.106 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -2.768 15.597 6.047 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.399 16.160 6.352 1.00 0.00 H new ATOM 0 HG LEU A 138 -2.973 17.489 7.684 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.667 16.980 9.986 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -5.006 16.802 8.828 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -4.185 15.359 9.467 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -1.320 16.585 9.264 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -1.686 14.938 8.697 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -0.962 16.122 7.583 1.00 0.00 H new ATOM 2199 N SER A 139 -4.688 13.354 4.952 1.00 0.00 N ATOM 2200 CA SER A 139 -5.624 12.848 3.963 1.00 0.00 C ATOM 2201 C SER A 139 -6.456 11.712 4.562 1.00 0.00 C ATOM 2202 O SER A 139 -7.668 11.654 4.363 1.00 0.00 O ATOM 2203 CB SER A 139 -4.892 12.365 2.709 1.00 0.00 C ATOM 2204 OG SER A 139 -5.336 13.043 1.537 1.00 0.00 O ATOM 0 H SER A 139 -3.724 13.431 4.627 1.00 0.00 H new ATOM 0 HA SER A 139 -6.288 13.662 3.673 1.00 0.00 H new ATOM 0 HB2 SER A 139 -3.820 12.519 2.833 1.00 0.00 H new ATOM 0 HB3 SER A 139 -5.048 11.293 2.589 1.00 0.00 H new ATOM 0 HG SER A 139 -4.844 12.708 0.759 1.00 0.00 H new ATOM 2210 N ILE A 140 -5.771 10.837 5.284 1.00 0.00 N ATOM 2211 CA ILE A 140 -6.432 9.707 5.914 1.00 0.00 C ATOM 2212 C ILE A 140 -7.427 10.219 6.957 1.00 0.00 C ATOM 2213 O ILE A 140 -8.603 9.858 6.929 1.00 0.00 O ATOM 2214 CB ILE A 140 -5.400 8.728 6.477 1.00 0.00 C ATOM 2215 CG1 ILE A 140 -4.761 7.901 5.360 1.00 0.00 C ATOM 2216 CG2 ILE A 140 -6.017 7.845 7.563 1.00 0.00 C ATOM 2217 CD1 ILE A 140 -3.469 8.554 4.864 1.00 0.00 C ATOM 0 H ILE A 140 -4.765 10.888 5.447 1.00 0.00 H new ATOM 0 HA ILE A 140 -7.004 9.142 5.178 1.00 0.00 H new ATOM 0 HB ILE A 140 -4.603 9.305 6.946 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -4.548 6.896 5.723 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -5.462 7.799 4.532 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -5.262 7.158 7.946 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -6.384 8.471 8.376 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -6.845 7.275 7.142 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -3.035 7.946 4.070 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -3.689 9.550 4.479 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -2.761 8.632 5.689 1.00 0.00 H new ATOM 2229 N LYS A 141 -6.919 11.053 7.853 1.00 0.00 N ATOM 2230 CA LYS A 141 -7.749 11.619 8.903 1.00 0.00 C ATOM 2231 C LYS A 141 -9.042 12.160 8.290 1.00 0.00 C ATOM 2232 O LYS A 141 -10.135 11.839 8.754 1.00 0.00 O ATOM 2233 CB LYS A 141 -6.964 12.661 9.702 1.00 0.00 C ATOM 2234 CG LYS A 141 -6.073 11.991 10.750 1.00 0.00 C ATOM 2235 CD LYS A 141 -4.603 12.037 10.330 1.00 0.00 C ATOM 2236 CE LYS A 141 -3.688 12.178 11.548 1.00 0.00 C ATOM 2237 NZ LYS A 141 -3.987 13.431 12.278 1.00 0.00 N ATOM 0 H LYS A 141 -5.943 11.350 7.873 1.00 0.00 H new ATOM 0 HA LYS A 141 -8.034 10.849 9.620 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -6.351 13.257 9.026 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -7.656 13.346 10.192 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -6.196 12.491 11.711 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -6.383 10.955 10.888 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -4.349 11.129 9.783 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -4.441 12.874 9.651 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -3.821 11.323 12.211 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -2.646 12.175 11.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -3.109 13.815 12.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -4.398 14.125 11.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -4.664 13.234 13.043 1.00 0.00 H new ATOM 2251 N GLU A 142 -8.875 12.973 7.256 1.00 0.00 N ATOM 2252 CA GLU A 142 -10.015 13.561 6.575 1.00 0.00 C ATOM 2253 C GLU A 142 -11.013 12.473 6.173 1.00 0.00 C ATOM 2254 O GLU A 142 -12.194 12.555 6.509 1.00 0.00 O ATOM 2255 CB GLU A 142 -9.567 14.371 5.357 1.00 0.00 C ATOM 2256 CG GLU A 142 -9.280 15.824 5.740 1.00 0.00 C ATOM 2257 CD GLU A 142 -9.775 16.786 4.657 1.00 0.00 C ATOM 2258 OE1 GLU A 142 -10.974 17.135 4.714 1.00 0.00 O ATOM 2259 OE2 GLU A 142 -8.943 17.149 3.798 1.00 0.00 O ATOM 0 H GLU A 142 -7.967 13.238 6.874 1.00 0.00 H new ATOM 0 HA GLU A 142 -10.511 14.245 7.263 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -8.673 13.921 4.926 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -10.341 14.339 4.590 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -9.766 16.057 6.688 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -8.209 15.959 5.889 1.00 0.00 H new