USER MOD reduce.3.24.130724 H: found=0, std=0, add=1164, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1163 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 58 HIS :FLIP no HD1:sc= 0.0542 F(o=-0.64,f=0.13) USER MOD Set 1.2: A 59 SER OG : rot 64:sc= 0.0716 USER MOD Set 2.1: A 51 THR OG1 : rot -64:sc= 0.339 USER MOD Set 2.2: A 69 THR OG1 : rot -75:sc= 1.39 USER MOD Set 3.1: A 46 TYR OH : rot 30:sc= -0.0829 USER MOD Set 3.2: A 123 TYR OH : rot 97:sc= 0.685 USER MOD Set 4.1: A 29 HIS :FLIP no HD1:sc=-0.00583 X(o=-0.13,f=-0.0058) USER MOD Set 4.2: A 30 GLN :FLIP amide:sc= 0 X(o=-0.41,f=-0.0058) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.242 X(o=-0.24,f=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN :FLIP amide:sc= -0.628 F(o=-1.2,f=-0.63) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= -0.123 (180deg=-0.123) USER MOD Single : A 26 SER OG : rot 180:sc= 0.0207 USER MOD Single : A 36 THR OG1 : rot 140:sc= -1.24 USER MOD Single : A 39 SER OG : rot 43:sc= 1.06 USER MOD Single : A 40 ASN : amide:sc= -0.346 X(o=-0.35,f=-0.068) USER MOD Single : A 41 CYS SG : rot -2:sc= -0.388 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.0519 USER MOD Single : A 48 ASN :FLIP amide:sc= -0.414 F(o=-1.1,f=-0.41) USER MOD Single : A 50 ASN : amide:sc= -0.0409 K(o=-0.041,f=-1.5!) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 CYS SG : rot 27:sc= 0.158 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 CYS SG : rot 150:sc= -0.993 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= -0.843 USER MOD Single : A 76 CYS SG : rot -160:sc= -1.61 USER MOD Single : A 77 SER OG : rot 43:sc= 0.306 USER MOD Single : A 79 CYS SG : rot 39:sc= -2.25 USER MOD Single : A 85 CYS SG : rot 130:sc= -1.14 USER MOD Single : A 86 GLN : amide:sc= 0.331 X(o=0.33,f=-0.0061) USER MOD Single : A 87 GLN : amide:sc= -0.0396 X(o=-0.04,f=-0.04) USER MOD Single : A 91 HIS : no HD1:sc= -1.37 K(o=-1.4,f=-2.3) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -100:sc= -1.49 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 THR OG1 : rot 70:sc= -1.75 USER MOD Single : A 101 GLN : amide:sc= -0.0166 X(o=-0.017,f=-0.097) USER MOD Single : A 103 THR OG1 : rot -90:sc= -0.894 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 111 CYS SG : rot 38:sc= 0.437 USER MOD Single : A 112 SER OG : rot 28:sc= 0.103 USER MOD Single : A 115 GLN :FLIP amide:sc= -1.69 F(o=-3.5!,f=-1.7) USER MOD Single : A 119 TYR OH : rot 31:sc= 0.00554 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot -106:sc= 0.0787 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 ASN : amide:sc= -2.88 X(o=-2.9,f=-3!) USER MOD Single : A 141 ASN : amide:sc= -0.185 X(o=-0.18,f=-0.05) USER MOD Single : A 143 ASN : amide:sc= 0.172 X(o=0.17,f=-0.14) USER MOD Single : A 157 SER OG : rot 180:sc= 0 USER MOD Single : A 159 ASN : amide:sc= -3.11 K(o=-3.1,f=-11!) USER MOD Single : A 161 SER OG : rot 180:sc= -0.161 USER MOD Single : A 169 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 130 N GLY A 12 -8.882 -15.293 0.573 1.00 0.00 N ATOM 131 CA GLY A 12 -8.505 -14.321 -0.437 1.00 0.00 C ATOM 132 C GLY A 12 -8.345 -14.942 -1.809 1.00 0.00 C ATOM 133 O GLY A 12 -9.020 -15.918 -2.139 1.00 0.00 O ATOM 0 HA2 GLY A 12 -9.261 -13.537 -0.482 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -7.569 -13.844 -0.146 1.00 0.00 H new ATOM 137 N PHE A 13 -7.450 -14.377 -2.613 1.00 0.00 N ATOM 138 CA PHE A 13 -7.203 -14.882 -3.959 1.00 0.00 C ATOM 139 C PHE A 13 -5.726 -14.764 -4.321 1.00 0.00 C ATOM 140 O PHE A 13 -5.156 -13.674 -4.297 1.00 0.00 O ATOM 141 CB PHE A 13 -8.052 -14.119 -4.976 1.00 0.00 C ATOM 142 CG PHE A 13 -9.491 -14.550 -5.001 1.00 0.00 C ATOM 143 CD1 PHE A 13 -9.825 -15.879 -5.210 1.00 0.00 C ATOM 144 CD2 PHE A 13 -10.508 -13.628 -4.816 1.00 0.00 C ATOM 145 CE1 PHE A 13 -11.148 -16.280 -5.233 1.00 0.00 C ATOM 146 CE2 PHE A 13 -11.833 -14.022 -4.839 1.00 0.00 C ATOM 147 CZ PHE A 13 -12.153 -15.350 -5.047 1.00 0.00 C ATOM 0 H PHE A 13 -6.883 -13.569 -2.356 1.00 0.00 H new ATOM 0 HA PHE A 13 -7.481 -15.936 -3.982 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -8.004 -13.054 -4.750 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -7.623 -14.254 -5.969 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -9.043 -16.609 -5.357 1.00 0.00 H new ATOM 0 HD2 PHE A 13 -10.263 -12.589 -4.652 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -11.396 -17.319 -5.396 1.00 0.00 H new ATOM 0 HE2 PHE A 13 -12.617 -13.293 -4.695 1.00 0.00 H new ATOM 0 HZ PHE A 13 -13.187 -15.661 -5.064 1.00 0.00 H new ATOM 157 N SER A 14 -5.113 -15.894 -4.659 1.00 0.00 N ATOM 158 CA SER A 14 -3.703 -15.918 -5.028 1.00 0.00 C ATOM 159 C SER A 14 -3.437 -16.976 -6.094 1.00 0.00 C ATOM 160 O SER A 14 -4.329 -17.741 -6.460 1.00 0.00 O ATOM 161 CB SER A 14 -2.837 -16.189 -3.796 1.00 0.00 C ATOM 162 OG SER A 14 -3.339 -17.284 -3.050 1.00 0.00 O ATOM 0 H SER A 14 -5.571 -16.805 -4.685 1.00 0.00 H new ATOM 0 HA SER A 14 -3.444 -14.942 -5.439 1.00 0.00 H new ATOM 0 HB2 SER A 14 -1.813 -16.395 -4.106 1.00 0.00 H new ATOM 0 HB3 SER A 14 -2.806 -15.300 -3.166 1.00 0.00 H new ATOM 0 HG SER A 14 -2.767 -17.438 -2.269 1.00 0.00 H new ATOM 168 N ASN A 15 -2.203 -17.013 -6.588 1.00 0.00 N ATOM 169 CA ASN A 15 -1.819 -17.977 -7.613 1.00 0.00 C ATOM 170 C ASN A 15 -2.646 -17.782 -8.880 1.00 0.00 C ATOM 171 O ASN A 15 -3.056 -18.750 -9.522 1.00 0.00 O ATOM 172 CB ASN A 15 -1.992 -19.404 -7.090 1.00 0.00 C ATOM 173 CG ASN A 15 -1.094 -19.698 -5.905 1.00 0.00 C ATOM 174 OD1 ASN A 15 -1.556 -20.159 -4.860 1.00 0.00 O ATOM 175 ND2 ASN A 15 0.198 -19.433 -6.060 1.00 0.00 N ATOM 0 H ASN A 15 -1.453 -16.387 -6.295 1.00 0.00 H new ATOM 0 HA ASN A 15 -0.770 -17.812 -7.858 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.032 -19.559 -6.802 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -1.775 -20.110 -7.891 1.00 0.00 H new ATOM 0 HD21 ASN A 15 0.850 -19.611 -5.296 1.00 0.00 H new ATOM 0 HD22 ASN A 15 0.538 -19.052 -6.943 1.00 0.00 H new ATOM 182 N LEU A 16 -2.887 -16.524 -9.236 1.00 0.00 N ATOM 183 CA LEU A 16 -3.664 -16.202 -10.426 1.00 0.00 C ATOM 184 C LEU A 16 -2.901 -15.240 -11.332 1.00 0.00 C ATOM 185 O LEU A 16 -2.055 -14.476 -10.868 1.00 0.00 O ATOM 186 CB LEU A 16 -5.010 -15.590 -10.032 1.00 0.00 C ATOM 187 CG LEU A 16 -5.840 -16.423 -9.056 1.00 0.00 C ATOM 188 CD1 LEU A 16 -6.749 -15.529 -8.228 1.00 0.00 C ATOM 189 CD2 LEU A 16 -6.655 -17.467 -9.806 1.00 0.00 C ATOM 0 H LEU A 16 -2.555 -15.711 -8.717 1.00 0.00 H new ATOM 0 HA LEU A 16 -3.840 -17.127 -10.975 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -4.830 -14.611 -9.588 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -5.596 -15.427 -10.936 1.00 0.00 H new ATOM 0 HG LEU A 16 -5.159 -16.939 -8.379 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -7.332 -16.141 -7.539 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -6.145 -14.820 -7.662 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -7.423 -14.984 -8.889 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -7.240 -18.051 -9.096 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -7.326 -16.970 -10.507 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.983 -18.128 -10.354 1.00 0.00 H new ATOM 201 N GLU A 17 -3.206 -15.285 -12.624 1.00 0.00 N ATOM 202 CA GLU A 17 -2.549 -14.418 -13.594 1.00 0.00 C ATOM 203 C GLU A 17 -3.504 -14.043 -14.723 1.00 0.00 C ATOM 204 O GLU A 17 -4.140 -14.907 -15.326 1.00 0.00 O ATOM 205 CB GLU A 17 -1.307 -15.107 -14.167 1.00 0.00 C ATOM 206 CG GLU A 17 -0.006 -14.631 -13.542 1.00 0.00 C ATOM 207 CD GLU A 17 1.159 -14.687 -14.510 1.00 0.00 C ATOM 208 OE1 GLU A 17 0.914 -14.700 -15.735 1.00 0.00 O ATOM 209 OE2 GLU A 17 2.318 -14.717 -14.044 1.00 0.00 O ATOM 0 H GLU A 17 -3.904 -15.913 -13.023 1.00 0.00 H new ATOM 0 HA GLU A 17 -2.245 -13.505 -13.081 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -1.398 -16.183 -14.021 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -1.269 -14.934 -15.242 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -0.130 -13.608 -13.187 1.00 0.00 H new ATOM 0 HG3 GLU A 17 0.220 -15.245 -12.670 1.00 0.00 H new ATOM 216 N SER A 18 -3.600 -12.747 -15.004 1.00 0.00 N ATOM 217 CA SER A 18 -4.477 -12.255 -16.060 1.00 0.00 C ATOM 218 C SER A 18 -5.929 -12.631 -15.782 1.00 0.00 C ATOM 219 O SER A 18 -6.686 -12.949 -16.699 1.00 0.00 O ATOM 220 CB SER A 18 -4.042 -12.817 -17.415 1.00 0.00 C ATOM 221 OG SER A 18 -4.127 -11.830 -18.428 1.00 0.00 O ATOM 0 H SER A 18 -3.081 -12.018 -14.514 1.00 0.00 H new ATOM 0 HA SER A 18 -4.401 -11.168 -16.084 1.00 0.00 H new ATOM 0 HB2 SER A 18 -3.019 -13.186 -17.347 1.00 0.00 H new ATOM 0 HB3 SER A 18 -4.671 -13.668 -17.678 1.00 0.00 H new ATOM 0 HG SER A 18 -3.842 -12.214 -19.284 1.00 0.00 H new ATOM 227 N GLN A 19 -6.310 -12.594 -14.508 1.00 0.00 N ATOM 228 CA GLN A 19 -7.671 -12.931 -14.108 1.00 0.00 C ATOM 229 C GLN A 19 -8.385 -11.714 -13.529 1.00 0.00 C ATOM 230 O GLN A 19 -7.753 -10.713 -13.194 1.00 0.00 O ATOM 231 CB GLN A 19 -7.657 -14.065 -13.081 1.00 0.00 C ATOM 232 CG GLN A 19 -7.465 -15.441 -13.697 1.00 0.00 C ATOM 233 CD GLN A 19 -8.418 -16.474 -13.127 1.00 0.00 C ATOM 234 OE1 GLN A 19 -7.875 -17.609 -12.702 1.00 0.00 O flip ATOM 235 NE2 GLN A 19 -9.627 -16.255 -13.071 1.00 0.00 N flip ATOM 0 H GLN A 19 -5.695 -12.334 -13.736 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.213 -13.260 -14.995 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -6.858 -13.883 -12.362 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -8.595 -14.052 -12.525 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -7.609 -15.375 -14.775 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -6.439 -15.769 -13.532 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -10.001 -15.368 -13.409 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -10.256 -16.960 -12.686 1.00 0.00 H new ATOM 244 N VAL A 20 -9.706 -11.808 -13.414 1.00 0.00 N ATOM 245 CA VAL A 20 -10.507 -10.715 -12.876 1.00 0.00 C ATOM 246 C VAL A 20 -11.345 -11.181 -11.691 1.00 0.00 C ATOM 247 O VAL A 20 -11.944 -12.255 -11.726 1.00 0.00 O ATOM 248 CB VAL A 20 -11.440 -10.120 -13.948 1.00 0.00 C ATOM 249 CG1 VAL A 20 -12.115 -8.861 -13.429 1.00 0.00 C ATOM 250 CG2 VAL A 20 -10.668 -9.831 -15.226 1.00 0.00 C ATOM 0 H VAL A 20 -10.244 -12.630 -13.686 1.00 0.00 H new ATOM 0 HA VAL A 20 -9.810 -9.945 -12.545 1.00 0.00 H new ATOM 0 HB VAL A 20 -12.215 -10.852 -14.176 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -12.770 -8.455 -14.200 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -12.703 -9.102 -12.543 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -11.357 -8.122 -13.171 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -11.343 -9.411 -15.972 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -9.871 -9.118 -15.016 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -10.236 -10.756 -15.607 1.00 0.00 H new ATOM 260 N LEU A 21 -11.384 -10.363 -10.643 1.00 0.00 N ATOM 261 CA LEU A 21 -12.151 -10.692 -9.446 1.00 0.00 C ATOM 262 C LEU A 21 -13.021 -9.515 -9.017 1.00 0.00 C ATOM 263 O LEU A 21 -12.671 -8.357 -9.245 1.00 0.00 O ATOM 264 CB LEU A 21 -11.212 -11.089 -8.306 1.00 0.00 C ATOM 265 CG LEU A 21 -10.091 -12.055 -8.697 1.00 0.00 C ATOM 266 CD1 LEU A 21 -9.041 -12.125 -7.600 1.00 0.00 C ATOM 267 CD2 LEU A 21 -10.657 -13.437 -8.986 1.00 0.00 C ATOM 0 H LEU A 21 -10.894 -9.469 -10.598 1.00 0.00 H new ATOM 0 HA LEU A 21 -12.801 -11.535 -9.682 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -10.764 -10.185 -7.893 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -11.803 -11.544 -7.511 1.00 0.00 H new ATOM 0 HG LEU A 21 -9.614 -11.682 -9.604 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -8.252 -12.816 -7.895 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -8.615 -11.135 -7.441 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -9.503 -12.474 -6.676 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -9.847 -14.112 -9.262 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -11.159 -13.818 -8.097 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -11.372 -13.373 -9.806 1.00 0.00 H new ATOM 279 N GLU A 22 -14.154 -9.820 -8.395 1.00 0.00 N ATOM 280 CA GLU A 22 -15.075 -8.787 -7.933 1.00 0.00 C ATOM 281 C GLU A 22 -15.846 -9.256 -6.704 1.00 0.00 C ATOM 282 O GLU A 22 -16.596 -10.230 -6.762 1.00 0.00 O ATOM 283 CB GLU A 22 -16.052 -8.409 -9.048 1.00 0.00 C ATOM 284 CG GLU A 22 -15.411 -7.618 -10.177 1.00 0.00 C ATOM 285 CD GLU A 22 -16.421 -6.818 -10.974 1.00 0.00 C ATOM 286 OE1 GLU A 22 -16.941 -5.816 -10.438 1.00 0.00 O ATOM 287 OE2 GLU A 22 -16.693 -7.191 -12.135 1.00 0.00 O ATOM 0 H GLU A 22 -14.457 -10.774 -8.199 1.00 0.00 H new ATOM 0 HA GLU A 22 -14.489 -7.909 -7.660 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -16.493 -9.318 -9.457 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -16.867 -7.823 -8.622 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -14.663 -6.942 -9.763 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -14.888 -8.303 -10.844 1.00 0.00 H new ATOM 294 N LYS A 23 -15.655 -8.556 -5.590 1.00 0.00 N ATOM 295 CA LYS A 23 -16.333 -8.901 -4.345 1.00 0.00 C ATOM 296 C LYS A 23 -17.224 -7.756 -3.875 1.00 0.00 C ATOM 297 O LYS A 23 -16.878 -6.584 -4.027 1.00 0.00 O ATOM 298 CB LYS A 23 -15.309 -9.244 -3.261 1.00 0.00 C ATOM 299 CG LYS A 23 -14.766 -10.661 -3.362 1.00 0.00 C ATOM 300 CD LYS A 23 -13.812 -10.977 -2.222 1.00 0.00 C ATOM 301 CE LYS A 23 -12.524 -11.608 -2.729 1.00 0.00 C ATOM 302 NZ LYS A 23 -11.345 -11.194 -1.919 1.00 0.00 N ATOM 0 H LYS A 23 -15.037 -7.747 -5.524 1.00 0.00 H new ATOM 0 HA LYS A 23 -16.961 -9.772 -4.531 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -14.479 -8.541 -3.322 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -15.770 -9.109 -2.282 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -15.594 -11.370 -3.352 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -14.250 -10.787 -4.314 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -13.580 -10.062 -1.677 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -14.297 -11.653 -1.518 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -12.618 -12.694 -2.705 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -12.367 -11.325 -3.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -10.488 -11.646 -2.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -11.240 -10.160 -1.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -11.483 -11.486 -0.931 1.00 0.00 H new ATOM 316 N ARG A 24 -18.371 -8.104 -3.302 1.00 0.00 N ATOM 317 CA ARG A 24 -19.313 -7.106 -2.808 1.00 0.00 C ATOM 318 C ARG A 24 -19.328 -7.079 -1.283 1.00 0.00 C ATOM 319 O ARG A 24 -18.610 -7.837 -0.632 1.00 0.00 O ATOM 320 CB ARG A 24 -20.719 -7.394 -3.341 1.00 0.00 C ATOM 321 CG ARG A 24 -21.085 -6.572 -4.566 1.00 0.00 C ATOM 322 CD ARG A 24 -22.408 -5.845 -4.380 1.00 0.00 C ATOM 323 NE ARG A 24 -23.247 -5.920 -5.574 1.00 0.00 N ATOM 324 CZ ARG A 24 -23.046 -5.187 -6.668 1.00 0.00 C ATOM 325 NH1 ARG A 24 -22.037 -4.326 -6.723 1.00 0.00 N ATOM 326 NH2 ARG A 24 -23.855 -5.316 -7.710 1.00 0.00 N ATOM 0 H ARG A 24 -18.671 -9.070 -3.168 1.00 0.00 H new ATOM 0 HA ARG A 24 -18.990 -6.128 -3.166 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -20.795 -8.453 -3.588 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -21.445 -7.198 -2.552 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -20.296 -5.847 -4.767 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -21.147 -7.224 -5.437 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -22.943 -6.276 -3.534 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -22.216 -4.800 -4.137 1.00 0.00 H new ATOM 0 HE ARG A 24 -24.032 -6.571 -5.570 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -21.410 -4.223 -5.925 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -21.888 -3.768 -7.564 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -24.631 -5.976 -7.674 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -23.701 -4.755 -8.548 1.00 0.00 H new ATOM 340 N ALA A 25 -20.153 -6.202 -0.720 1.00 0.00 N ATOM 341 CA ALA A 25 -20.262 -6.078 0.729 1.00 0.00 C ATOM 342 C ALA A 25 -20.831 -7.351 1.346 1.00 0.00 C ATOM 343 O ALA A 25 -20.342 -7.828 2.370 1.00 0.00 O ATOM 344 CB ALA A 25 -21.127 -4.881 1.091 1.00 0.00 C ATOM 0 H ALA A 25 -20.755 -5.567 -1.245 1.00 0.00 H new ATOM 0 HA ALA A 25 -19.262 -5.925 1.134 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -21.200 -4.800 2.175 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -20.678 -3.973 0.689 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -22.123 -5.011 0.669 1.00 0.00 H new ATOM 350 N SER A 26 -21.867 -7.895 0.717 1.00 0.00 N ATOM 351 CA SER A 26 -22.504 -9.113 1.204 1.00 0.00 C ATOM 352 C SER A 26 -21.523 -10.281 1.192 1.00 0.00 C ATOM 353 O SER A 26 -21.579 -11.160 2.051 1.00 0.00 O ATOM 354 CB SER A 26 -23.726 -9.451 0.349 1.00 0.00 C ATOM 355 OG SER A 26 -24.385 -8.274 -0.087 1.00 0.00 O ATOM 0 H SER A 26 -22.284 -7.512 -0.131 1.00 0.00 H new ATOM 0 HA SER A 26 -22.824 -8.940 2.231 1.00 0.00 H new ATOM 0 HB2 SER A 26 -23.418 -10.040 -0.515 1.00 0.00 H new ATOM 0 HB3 SER A 26 -24.417 -10.067 0.924 1.00 0.00 H new ATOM 0 HG SER A 26 -25.162 -8.517 -0.633 1.00 0.00 H new ATOM 361 N GLU A 27 -20.624 -10.281 0.213 1.00 0.00 N ATOM 362 CA GLU A 27 -19.629 -11.341 0.089 1.00 0.00 C ATOM 363 C GLU A 27 -18.564 -11.215 1.173 1.00 0.00 C ATOM 364 O GLU A 27 -18.371 -12.129 1.976 1.00 0.00 O ATOM 365 CB GLU A 27 -18.974 -11.294 -1.292 1.00 0.00 C ATOM 366 CG GLU A 27 -19.702 -12.121 -2.339 1.00 0.00 C ATOM 367 CD GLU A 27 -19.225 -11.828 -3.748 1.00 0.00 C ATOM 368 OE1 GLU A 27 -19.005 -10.640 -4.066 1.00 0.00 O ATOM 369 OE2 GLU A 27 -19.074 -12.786 -4.535 1.00 0.00 O ATOM 0 H GLU A 27 -20.564 -9.560 -0.506 1.00 0.00 H new ATOM 0 HA GLU A 27 -20.136 -12.298 0.211 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -18.927 -10.258 -1.628 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -17.947 -11.649 -1.210 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -19.559 -13.180 -2.124 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -20.772 -11.924 -2.273 1.00 0.00 H new ATOM 376 N LEU A 28 -17.876 -10.079 1.193 1.00 0.00 N ATOM 377 CA LEU A 28 -16.830 -9.834 2.178 1.00 0.00 C ATOM 378 C LEU A 28 -17.407 -9.818 3.590 1.00 0.00 C ATOM 379 O LEU A 28 -17.109 -10.693 4.403 1.00 0.00 O ATOM 380 CB LEU A 28 -16.125 -8.509 1.885 1.00 0.00 C ATOM 381 CG LEU A 28 -15.404 -8.443 0.537 1.00 0.00 C ATOM 382 CD1 LEU A 28 -15.493 -7.044 -0.050 1.00 0.00 C ATOM 383 CD2 LEU A 28 -13.951 -8.868 0.690 1.00 0.00 C ATOM 0 H LEU A 28 -18.024 -9.312 0.537 1.00 0.00 H new ATOM 0 HA LEU A 28 -16.104 -10.644 2.111 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -16.861 -7.706 1.926 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -15.401 -8.317 2.677 1.00 0.00 H new ATOM 0 HG LEU A 28 -15.894 -9.133 -0.150 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -14.974 -7.018 -1.008 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -16.540 -6.777 -0.196 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -15.029 -6.333 0.633 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -13.453 -8.815 -0.278 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -13.449 -8.203 1.393 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -13.909 -9.891 1.065 1.00 0.00 H new ATOM 395 N HIS A 29 -18.234 -8.817 3.875 1.00 0.00 N ATOM 396 CA HIS A 29 -18.853 -8.688 5.189 1.00 0.00 C ATOM 397 C HIS A 29 -17.793 -8.558 6.280 1.00 0.00 C ATOM 398 O HIS A 29 -17.803 -9.296 7.265 1.00 0.00 O ATOM 399 CB HIS A 29 -19.757 -9.893 5.468 1.00 0.00 C ATOM 400 CG HIS A 29 -21.126 -9.517 5.943 1.00 0.00 C ATOM 401 ND1 HIS A 29 -21.523 -8.500 6.752 1.00 0.00 N flip ATOM 402 CD2 HIS A 29 -22.271 -10.202 5.605 1.00 0.00 C flip ATOM 403 CE1 HIS A 29 -22.905 -8.557 6.911 1.00 0.00 C flip ATOM 404 NE2 HIS A 29 -23.305 -9.595 6.203 1.00 0.00 N flip ATOM 0 H HIS A 29 -18.491 -8.084 3.214 1.00 0.00 H new ATOM 0 HA HIS A 29 -19.459 -7.782 5.194 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -19.847 -10.487 4.559 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -19.283 -10.527 6.217 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -22.326 -11.074 4.970 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -23.522 -7.889 7.494 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -24.276 -9.897 6.121 1.00 0.00 H new ATOM 412 N GLN A 30 -16.878 -7.611 6.097 1.00 0.00 N ATOM 413 CA GLN A 30 -15.810 -7.382 7.063 1.00 0.00 C ATOM 414 C GLN A 30 -14.941 -8.626 7.219 1.00 0.00 C ATOM 415 O GLN A 30 -15.112 -9.401 8.160 1.00 0.00 O ATOM 416 CB GLN A 30 -16.396 -6.983 8.419 1.00 0.00 C ATOM 417 CG GLN A 30 -16.969 -5.575 8.444 1.00 0.00 C ATOM 418 CD GLN A 30 -18.358 -5.521 9.047 1.00 0.00 C ATOM 419 OE1 GLN A 30 -19.284 -6.277 8.469 1.00 0.00 O flip ATOM 420 NE2 GLN A 30 -18.597 -4.808 10.022 1.00 0.00 N flip ATOM 0 H GLN A 30 -16.855 -6.990 5.288 1.00 0.00 H new ATOM 0 HA GLN A 30 -15.187 -6.569 6.691 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -17.180 -7.690 8.689 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -15.619 -7.064 9.179 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -16.304 -4.926 9.014 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -17.003 -5.183 7.428 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -17.855 -4.243 10.435 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -19.537 -4.782 10.417 1.00 0.00 H new ATOM 429 N ARG A 31 -14.007 -8.809 6.291 1.00 0.00 N ATOM 430 CA ARG A 31 -13.110 -9.957 6.325 1.00 0.00 C ATOM 431 C ARG A 31 -11.720 -9.576 5.826 1.00 0.00 C ATOM 432 O ARG A 31 -11.557 -8.588 5.110 1.00 0.00 O ATOM 433 CB ARG A 31 -13.675 -11.098 5.476 1.00 0.00 C ATOM 434 CG ARG A 31 -14.767 -11.893 6.173 1.00 0.00 C ATOM 435 CD ARG A 31 -15.221 -13.073 5.329 1.00 0.00 C ATOM 436 NE ARG A 31 -16.471 -13.649 5.820 1.00 0.00 N ATOM 437 CZ ARG A 31 -16.907 -14.863 5.492 1.00 0.00 C ATOM 438 NH1 ARG A 31 -16.200 -15.632 4.674 1.00 0.00 N ATOM 439 NH2 ARG A 31 -18.056 -15.310 5.983 1.00 0.00 N ATOM 0 H ARG A 31 -13.852 -8.176 5.506 1.00 0.00 H new ATOM 0 HA ARG A 31 -13.026 -10.291 7.359 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -14.073 -10.687 4.548 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -12.864 -11.773 5.203 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -14.400 -12.252 7.135 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -15.617 -11.243 6.379 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -15.352 -12.751 4.296 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -14.445 -13.838 5.329 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.043 -13.088 6.451 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -15.317 -15.294 4.292 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -16.540 -16.561 4.427 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -18.605 -14.723 6.612 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -18.390 -16.240 5.732 1.00 0.00 H new ATOM 453 N ASP A 32 -10.722 -10.366 6.208 1.00 0.00 N ATOM 454 CA ASP A 32 -9.346 -10.110 5.799 1.00 0.00 C ATOM 455 C ASP A 32 -9.085 -10.659 4.399 1.00 0.00 C ATOM 456 O ASP A 32 -9.267 -11.849 4.143 1.00 0.00 O ATOM 457 CB ASP A 32 -8.370 -10.739 6.795 1.00 0.00 C ATOM 458 CG ASP A 32 -6.946 -10.260 6.588 1.00 0.00 C ATOM 459 OD1 ASP A 32 -6.444 -10.364 5.449 1.00 0.00 O ATOM 460 OD2 ASP A 32 -6.334 -9.781 7.565 1.00 0.00 O ATOM 0 H ASP A 32 -10.840 -11.188 6.800 1.00 0.00 H new ATOM 0 HA ASP A 32 -9.192 -9.031 5.783 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -8.687 -10.501 7.810 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.404 -11.824 6.697 1.00 0.00 H new ATOM 465 N VAL A 33 -8.659 -9.781 3.496 1.00 0.00 N ATOM 466 CA VAL A 33 -8.374 -10.176 2.123 1.00 0.00 C ATOM 467 C VAL A 33 -6.889 -10.469 1.932 1.00 0.00 C ATOM 468 O VAL A 33 -6.037 -9.635 2.239 1.00 0.00 O ATOM 469 CB VAL A 33 -8.801 -9.086 1.123 1.00 0.00 C ATOM 470 CG1 VAL A 33 -8.683 -9.593 -0.306 1.00 0.00 C ATOM 471 CG2 VAL A 33 -10.220 -8.621 1.415 1.00 0.00 C ATOM 0 H VAL A 33 -8.504 -8.792 3.691 1.00 0.00 H new ATOM 0 HA VAL A 33 -8.950 -11.081 1.930 1.00 0.00 H new ATOM 0 HB VAL A 33 -8.132 -8.233 1.237 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -8.989 -8.808 -0.997 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -7.649 -9.872 -0.509 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -9.326 -10.463 -0.438 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -10.505 -7.851 0.699 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -10.904 -9.465 1.331 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -10.269 -8.213 2.425 1.00 0.00 H new ATOM 481 N LEU A 34 -6.587 -11.659 1.421 1.00 0.00 N ATOM 482 CA LEU A 34 -5.205 -12.063 1.188 1.00 0.00 C ATOM 483 C LEU A 34 -4.925 -12.205 -0.305 1.00 0.00 C ATOM 484 O LEU A 34 -5.467 -13.092 -0.965 1.00 0.00 O ATOM 485 CB LEU A 34 -4.910 -13.382 1.903 1.00 0.00 C ATOM 486 CG LEU A 34 -3.424 -13.686 2.115 1.00 0.00 C ATOM 487 CD1 LEU A 34 -3.001 -13.316 3.528 1.00 0.00 C ATOM 488 CD2 LEU A 34 -3.133 -15.153 1.838 1.00 0.00 C ATOM 0 H LEU A 34 -7.281 -12.360 1.161 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.553 -11.288 1.589 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.405 -13.370 2.874 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -5.354 -14.196 1.329 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.847 -13.084 1.414 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.942 -13.539 3.661 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -3.171 -12.252 3.692 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -3.586 -13.892 4.245 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -2.072 -15.349 1.994 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -3.720 -15.774 2.514 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -3.398 -15.388 0.807 1.00 0.00 H new ATOM 500 N LEU A 35 -4.078 -11.327 -0.830 1.00 0.00 N ATOM 501 CA LEU A 35 -3.728 -11.355 -2.245 1.00 0.00 C ATOM 502 C LEU A 35 -2.214 -11.378 -2.430 1.00 0.00 C ATOM 503 O LEU A 35 -1.541 -10.364 -2.250 1.00 0.00 O ATOM 504 CB LEU A 35 -4.323 -10.142 -2.964 1.00 0.00 C ATOM 505 CG LEU A 35 -5.776 -9.826 -2.604 1.00 0.00 C ATOM 506 CD1 LEU A 35 -6.176 -8.464 -3.152 1.00 0.00 C ATOM 507 CD2 LEU A 35 -6.703 -10.909 -3.131 1.00 0.00 C ATOM 0 H LEU A 35 -3.621 -10.587 -0.297 1.00 0.00 H new ATOM 0 HA LEU A 35 -4.143 -12.265 -2.678 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -3.711 -9.269 -2.739 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.259 -10.308 -4.039 1.00 0.00 H new ATOM 0 HG LEU A 35 -5.865 -9.798 -1.518 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -7.212 -8.255 -2.887 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -5.531 -7.696 -2.725 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -6.072 -8.464 -4.237 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -7.732 -10.668 -2.866 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -6.612 -10.969 -4.216 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -6.430 -11.868 -2.690 1.00 0.00 H new ATOM 519 N THR A 36 -1.686 -12.542 -2.794 1.00 0.00 N ATOM 520 CA THR A 36 -0.251 -12.697 -3.005 1.00 0.00 C ATOM 521 C THR A 36 0.030 -13.683 -4.135 1.00 0.00 C ATOM 522 O THR A 36 -0.850 -14.440 -4.544 1.00 0.00 O ATOM 523 CB THR A 36 0.428 -13.171 -1.719 1.00 0.00 C ATOM 524 OG1 THR A 36 1.776 -13.529 -1.965 1.00 0.00 O ATOM 525 CG2 THR A 36 -0.256 -14.365 -1.087 1.00 0.00 C ATOM 0 H THR A 36 -2.230 -13.391 -2.949 1.00 0.00 H new ATOM 0 HA THR A 36 0.156 -11.725 -3.285 1.00 0.00 H new ATOM 0 HB THR A 36 0.363 -12.328 -1.031 1.00 0.00 H new ATOM 0 HG1 THR A 36 2.337 -13.220 -1.224 1.00 0.00 H new ATOM 0 HG21 THR A 36 0.276 -14.650 -0.179 1.00 0.00 H new ATOM 0 HG22 THR A 36 -1.285 -14.105 -0.839 1.00 0.00 H new ATOM 0 HG23 THR A 36 -0.251 -15.200 -1.788 1.00 0.00 H new ATOM 533 N GLU A 37 1.261 -13.667 -4.635 1.00 0.00 N ATOM 534 CA GLU A 37 1.658 -14.559 -5.718 1.00 0.00 C ATOM 535 C GLU A 37 0.801 -14.323 -6.958 1.00 0.00 C ATOM 536 O GLU A 37 0.543 -15.246 -7.731 1.00 0.00 O ATOM 537 CB GLU A 37 1.545 -16.018 -5.271 1.00 0.00 C ATOM 538 CG GLU A 37 2.846 -16.591 -4.732 1.00 0.00 C ATOM 539 CD GLU A 37 3.171 -17.953 -5.317 1.00 0.00 C ATOM 540 OE1 GLU A 37 2.773 -18.214 -6.471 1.00 0.00 O ATOM 541 OE2 GLU A 37 3.822 -18.758 -4.618 1.00 0.00 O ATOM 0 H GLU A 37 2.001 -13.046 -4.307 1.00 0.00 H new ATOM 0 HA GLU A 37 2.696 -14.345 -5.972 1.00 0.00 H new ATOM 0 HB2 GLU A 37 0.777 -16.095 -4.501 1.00 0.00 H new ATOM 0 HB3 GLU A 37 1.213 -16.623 -6.115 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.661 -15.901 -4.952 1.00 0.00 H new ATOM 0 HG3 GLU A 37 2.781 -16.672 -3.647 1.00 0.00 H new ATOM 548 N LEU A 38 0.364 -13.082 -7.141 1.00 0.00 N ATOM 549 CA LEU A 38 -0.464 -12.725 -8.287 1.00 0.00 C ATOM 550 C LEU A 38 0.339 -11.933 -9.313 1.00 0.00 C ATOM 551 O LEU A 38 1.472 -11.527 -9.051 1.00 0.00 O ATOM 552 CB LEU A 38 -1.677 -11.910 -7.832 1.00 0.00 C ATOM 553 CG LEU A 38 -2.596 -12.621 -6.836 1.00 0.00 C ATOM 554 CD1 LEU A 38 -3.075 -11.654 -5.764 1.00 0.00 C ATOM 555 CD2 LEU A 38 -3.781 -13.246 -7.558 1.00 0.00 C ATOM 0 H LEU A 38 0.569 -12.307 -6.511 1.00 0.00 H new ATOM 0 HA LEU A 38 -0.809 -13.647 -8.756 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.324 -10.983 -7.380 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -2.261 -11.635 -8.710 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.028 -13.415 -6.352 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.727 -12.179 -5.066 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.216 -11.252 -5.226 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -3.626 -10.837 -6.231 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.424 -13.747 -6.835 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.347 -12.468 -8.069 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.421 -13.971 -8.288 1.00 0.00 H new ATOM 567 N SER A 39 -0.254 -11.714 -10.482 1.00 0.00 N ATOM 568 CA SER A 39 0.406 -10.969 -11.547 1.00 0.00 C ATOM 569 C SER A 39 -0.572 -10.650 -12.674 1.00 0.00 C ATOM 570 O SER A 39 -1.188 -11.549 -13.248 1.00 0.00 O ATOM 571 CB SER A 39 1.592 -11.765 -12.096 1.00 0.00 C ATOM 572 OG SER A 39 2.792 -11.422 -11.424 1.00 0.00 O ATOM 0 H SER A 39 -1.191 -12.042 -10.716 1.00 0.00 H new ATOM 0 HA SER A 39 0.770 -10.031 -11.128 1.00 0.00 H new ATOM 0 HB2 SER A 39 1.401 -12.832 -11.984 1.00 0.00 H new ATOM 0 HB3 SER A 39 1.701 -11.571 -13.163 1.00 0.00 H new ATOM 0 HG SER A 39 2.621 -11.360 -10.461 1.00 0.00 H new ATOM 578 N ASN A 40 -0.711 -9.365 -12.984 1.00 0.00 N ATOM 579 CA ASN A 40 -1.615 -8.928 -14.042 1.00 0.00 C ATOM 580 C ASN A 40 -3.055 -9.316 -13.719 1.00 0.00 C ATOM 581 O ASN A 40 -3.860 -9.562 -14.619 1.00 0.00 O ATOM 582 CB ASN A 40 -1.194 -9.534 -15.383 1.00 0.00 C ATOM 583 CG ASN A 40 -0.524 -8.520 -16.290 1.00 0.00 C ATOM 584 OD1 ASN A 40 0.549 -8.771 -16.835 1.00 0.00 O ATOM 585 ND2 ASN A 40 -1.158 -7.364 -16.454 1.00 0.00 N ATOM 0 H ASN A 40 -0.210 -8.609 -12.518 1.00 0.00 H new ATOM 0 HA ASN A 40 -1.559 -7.842 -14.112 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -0.512 -10.365 -15.205 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -2.071 -9.943 -15.885 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -0.756 -6.642 -17.052 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -2.047 -7.198 -15.982 1.00 0.00 H new ATOM 592 N CYS A 41 -3.375 -9.370 -12.430 1.00 0.00 N ATOM 593 CA CYS A 41 -4.718 -9.727 -11.989 1.00 0.00 C ATOM 594 C CYS A 41 -5.454 -8.508 -11.444 1.00 0.00 C ATOM 595 O CYS A 41 -4.963 -7.824 -10.545 1.00 0.00 O ATOM 596 CB CYS A 41 -4.652 -10.818 -10.919 1.00 0.00 C ATOM 597 SG CYS A 41 -6.161 -11.806 -10.779 1.00 0.00 S ATOM 0 H CYS A 41 -2.722 -9.171 -11.672 1.00 0.00 H new ATOM 0 HA CYS A 41 -5.268 -10.105 -12.851 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -3.816 -11.481 -11.142 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -4.443 -10.354 -9.955 1.00 0.00 H new ATOM 0 HG CYS A 41 -7.054 -11.354 -11.609 1.00 0.00 H new ATOM 603 N THR A 42 -6.635 -8.242 -11.992 1.00 0.00 N ATOM 604 CA THR A 42 -7.440 -7.106 -11.560 1.00 0.00 C ATOM 605 C THR A 42 -8.511 -7.545 -10.566 1.00 0.00 C ATOM 606 O THR A 42 -9.238 -8.509 -10.807 1.00 0.00 O ATOM 607 CB THR A 42 -8.093 -6.430 -12.766 1.00 0.00 C ATOM 608 OG1 THR A 42 -8.291 -7.359 -13.816 1.00 0.00 O ATOM 609 CG2 THR A 42 -7.281 -5.278 -13.319 1.00 0.00 C ATOM 0 H THR A 42 -7.056 -8.798 -12.736 1.00 0.00 H new ATOM 0 HA THR A 42 -6.781 -6.392 -11.065 1.00 0.00 H new ATOM 0 HB THR A 42 -9.043 -6.041 -12.399 1.00 0.00 H new ATOM 0 HG1 THR A 42 -8.711 -6.907 -14.577 1.00 0.00 H new ATOM 0 HG21 THR A 42 -7.801 -4.843 -14.173 1.00 0.00 H new ATOM 0 HG22 THR A 42 -7.153 -4.519 -12.547 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.303 -5.641 -13.636 1.00 0.00 H new ATOM 617 N VAL A 43 -8.603 -6.831 -9.448 1.00 0.00 N ATOM 618 CA VAL A 43 -9.585 -7.147 -8.419 1.00 0.00 C ATOM 619 C VAL A 43 -10.351 -5.901 -7.989 1.00 0.00 C ATOM 620 O VAL A 43 -9.774 -4.968 -7.430 1.00 0.00 O ATOM 621 CB VAL A 43 -8.920 -7.780 -7.182 1.00 0.00 C ATOM 622 CG1 VAL A 43 -9.973 -8.282 -6.207 1.00 0.00 C ATOM 623 CG2 VAL A 43 -7.984 -8.905 -7.596 1.00 0.00 C ATOM 0 H VAL A 43 -8.009 -6.030 -9.233 1.00 0.00 H new ATOM 0 HA VAL A 43 -10.280 -7.865 -8.855 1.00 0.00 H new ATOM 0 HB VAL A 43 -8.329 -7.015 -6.678 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -9.484 -8.726 -5.340 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -10.597 -7.449 -5.885 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -10.594 -9.032 -6.697 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -7.523 -9.340 -6.709 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -8.549 -9.672 -8.125 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.208 -8.510 -8.251 1.00 0.00 H new ATOM 633 N ARG A 44 -11.652 -5.892 -8.255 1.00 0.00 N ATOM 634 CA ARG A 44 -12.498 -4.760 -7.896 1.00 0.00 C ATOM 635 C ARG A 44 -13.405 -5.108 -6.720 1.00 0.00 C ATOM 636 O ARG A 44 -14.422 -5.782 -6.885 1.00 0.00 O ATOM 637 CB ARG A 44 -13.343 -4.328 -9.096 1.00 0.00 C ATOM 638 CG ARG A 44 -12.532 -4.114 -10.364 1.00 0.00 C ATOM 639 CD ARG A 44 -13.344 -4.437 -11.607 1.00 0.00 C ATOM 640 NE ARG A 44 -12.937 -3.627 -12.753 1.00 0.00 N ATOM 641 CZ ARG A 44 -13.306 -2.360 -12.932 1.00 0.00 C ATOM 642 NH1 ARG A 44 -14.090 -1.758 -12.047 1.00 0.00 N ATOM 643 NH2 ARG A 44 -12.890 -1.694 -14.001 1.00 0.00 N ATOM 0 H ARG A 44 -12.144 -6.656 -8.718 1.00 0.00 H new ATOM 0 HA ARG A 44 -11.850 -3.935 -7.599 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -14.105 -5.084 -9.285 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -13.866 -3.404 -8.848 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -12.192 -3.079 -10.409 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -11.641 -4.741 -10.337 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -13.229 -5.493 -11.851 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -14.402 -4.270 -11.403 1.00 0.00 H new ATOM 0 HE ARG A 44 -12.336 -4.057 -13.456 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -14.414 -2.266 -11.224 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -14.369 -0.787 -12.190 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -12.288 -2.152 -14.685 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -13.172 -0.724 -14.139 1.00 0.00 H new ATOM 657 N LEU A 45 -13.031 -4.643 -5.533 1.00 0.00 N ATOM 658 CA LEU A 45 -13.811 -4.905 -4.328 1.00 0.00 C ATOM 659 C LEU A 45 -14.805 -3.778 -4.069 1.00 0.00 C ATOM 660 O LEU A 45 -14.647 -2.668 -4.579 1.00 0.00 O ATOM 661 CB LEU A 45 -12.884 -5.071 -3.122 1.00 0.00 C ATOM 662 CG LEU A 45 -11.675 -5.979 -3.353 1.00 0.00 C ATOM 663 CD1 LEU A 45 -10.660 -5.811 -2.232 1.00 0.00 C ATOM 664 CD2 LEU A 45 -12.114 -7.432 -3.465 1.00 0.00 C ATOM 0 H LEU A 45 -12.193 -4.083 -5.379 1.00 0.00 H new ATOM 0 HA LEU A 45 -14.368 -5.829 -4.479 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -12.527 -4.087 -2.820 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -13.464 -5.469 -2.290 1.00 0.00 H new ATOM 0 HG LEU A 45 -11.201 -5.690 -4.291 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -9.807 -6.465 -2.413 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -10.323 -4.775 -2.199 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -11.122 -6.073 -1.280 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -11.241 -8.064 -3.629 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -12.612 -7.734 -2.544 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -12.803 -7.540 -4.302 1.00 0.00 H new ATOM 676 N TYR A 46 -15.829 -4.070 -3.273 1.00 0.00 N ATOM 677 CA TYR A 46 -16.849 -3.080 -2.947 1.00 0.00 C ATOM 678 C TYR A 46 -17.543 -3.425 -1.633 1.00 0.00 C ATOM 679 O TYR A 46 -18.327 -4.371 -1.563 1.00 0.00 O ATOM 680 CB TYR A 46 -17.881 -2.991 -4.073 1.00 0.00 C ATOM 681 CG TYR A 46 -17.282 -2.644 -5.417 1.00 0.00 C ATOM 682 CD1 TYR A 46 -16.973 -1.329 -5.743 1.00 0.00 C ATOM 683 CD2 TYR A 46 -17.024 -3.632 -6.360 1.00 0.00 C ATOM 684 CE1 TYR A 46 -16.425 -1.009 -6.971 1.00 0.00 C ATOM 685 CE2 TYR A 46 -16.476 -3.319 -7.589 1.00 0.00 C ATOM 686 CZ TYR A 46 -16.177 -2.007 -7.890 1.00 0.00 C ATOM 687 OH TYR A 46 -15.632 -1.691 -9.113 1.00 0.00 O ATOM 0 H TYR A 46 -15.974 -4.983 -2.842 1.00 0.00 H new ATOM 0 HA TYR A 46 -16.358 -2.113 -2.835 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -18.403 -3.945 -4.152 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -18.627 -2.240 -3.812 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -17.164 -0.545 -5.026 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -17.256 -4.661 -6.128 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -16.192 0.018 -7.210 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -16.283 -4.099 -8.311 1.00 0.00 H new ATOM 0 HH TYR A 46 -15.063 -0.898 -9.023 1.00 0.00 H new ATOM 697 N GLY A 47 -17.249 -2.651 -0.593 1.00 0.00 N ATOM 698 CA GLY A 47 -17.852 -2.890 0.704 1.00 0.00 C ATOM 699 C GLY A 47 -17.062 -2.264 1.837 1.00 0.00 C ATOM 700 O GLY A 47 -16.871 -1.048 1.870 1.00 0.00 O ATOM 0 H GLY A 47 -16.603 -1.862 -0.626 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -18.866 -2.490 0.709 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -17.932 -3.964 0.871 1.00 0.00 H new ATOM 704 N ASN A 48 -16.603 -3.094 2.767 1.00 0.00 N ATOM 705 CA ASN A 48 -15.830 -2.614 3.906 1.00 0.00 C ATOM 706 C ASN A 48 -15.204 -3.779 4.671 1.00 0.00 C ATOM 707 O ASN A 48 -15.740 -4.226 5.684 1.00 0.00 O ATOM 708 CB ASN A 48 -16.719 -1.793 4.842 1.00 0.00 C ATOM 709 CG ASN A 48 -15.944 -1.195 6.000 1.00 0.00 C ATOM 710 OD1 ASN A 48 -14.836 -0.532 5.690 1.00 0.00 O flip ATOM 711 ND2 ASN A 48 -16.336 -1.328 7.159 1.00 0.00 N flip ATOM 0 H ASN A 48 -16.753 -4.103 2.754 1.00 0.00 H new ATOM 0 HA ASN A 48 -15.028 -1.980 3.528 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -17.196 -0.993 4.276 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -17.516 -2.427 5.231 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -17.194 -1.846 7.351 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -15.803 -0.920 7.927 1.00 0.00 H new ATOM 718 N PRO A 49 -14.053 -4.284 4.194 1.00 0.00 N ATOM 719 CA PRO A 49 -13.354 -5.401 4.838 1.00 0.00 C ATOM 720 C PRO A 49 -12.726 -5.000 6.168 1.00 0.00 C ATOM 721 O PRO A 49 -12.644 -3.817 6.495 1.00 0.00 O ATOM 722 CB PRO A 49 -12.270 -5.773 3.824 1.00 0.00 C ATOM 723 CG PRO A 49 -12.022 -4.521 3.058 1.00 0.00 C ATOM 724 CD PRO A 49 -13.344 -3.808 2.990 1.00 0.00 C ATOM 0 HA PRO A 49 -14.030 -6.222 5.079 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -11.364 -6.118 4.322 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -12.601 -6.579 3.169 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -11.271 -3.904 3.551 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -11.646 -4.743 2.059 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -13.217 -2.725 3.000 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -13.888 -4.057 2.079 1.00 0.00 H new ATOM 732 N ASN A 50 -12.283 -5.995 6.930 1.00 0.00 N ATOM 733 CA ASN A 50 -11.662 -5.746 8.226 1.00 0.00 C ATOM 734 C ASN A 50 -10.223 -5.266 8.056 1.00 0.00 C ATOM 735 O ASN A 50 -9.868 -4.171 8.494 1.00 0.00 O ATOM 736 CB ASN A 50 -11.691 -7.013 9.082 1.00 0.00 C ATOM 737 CG ASN A 50 -11.555 -6.715 10.561 1.00 0.00 C ATOM 738 OD1 ASN A 50 -10.944 -5.719 10.953 1.00 0.00 O ATOM 739 ND2 ASN A 50 -12.124 -7.578 11.395 1.00 0.00 N ATOM 0 H ASN A 50 -12.342 -6.980 6.673 1.00 0.00 H new ATOM 0 HA ASN A 50 -12.231 -4.964 8.729 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -12.626 -7.546 8.906 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -10.883 -7.676 8.772 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -12.064 -7.429 12.402 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -12.621 -8.390 11.028 1.00 0.00 H new ATOM 746 N THR A 51 -9.400 -6.092 7.419 1.00 0.00 N ATOM 747 CA THR A 51 -8.001 -5.751 7.191 1.00 0.00 C ATOM 748 C THR A 51 -7.530 -6.265 5.835 1.00 0.00 C ATOM 749 O THR A 51 -7.583 -7.464 5.562 1.00 0.00 O ATOM 750 CB THR A 51 -7.126 -6.332 8.303 1.00 0.00 C ATOM 751 OG1 THR A 51 -7.796 -6.274 9.550 1.00 0.00 O ATOM 752 CG2 THR A 51 -5.802 -5.616 8.459 1.00 0.00 C ATOM 0 H THR A 51 -9.678 -7.002 7.052 1.00 0.00 H new ATOM 0 HA THR A 51 -7.911 -4.665 7.198 1.00 0.00 H new ATOM 0 HB THR A 51 -6.930 -7.363 8.008 1.00 0.00 H new ATOM 0 HG1 THR A 51 -7.942 -5.338 9.800 1.00 0.00 H new ATOM 0 HG21 THR A 51 -5.231 -6.078 9.264 1.00 0.00 H new ATOM 0 HG22 THR A 51 -5.239 -5.686 7.528 1.00 0.00 H new ATOM 0 HG23 THR A 51 -5.981 -4.567 8.697 1.00 0.00 H new ATOM 760 N LEU A 52 -7.068 -5.351 4.989 1.00 0.00 N ATOM 761 CA LEU A 52 -6.587 -5.711 3.661 1.00 0.00 C ATOM 762 C LEU A 52 -5.082 -5.956 3.676 1.00 0.00 C ATOM 763 O LEU A 52 -4.344 -5.303 4.413 1.00 0.00 O ATOM 764 CB LEU A 52 -6.926 -4.609 2.655 1.00 0.00 C ATOM 765 CG LEU A 52 -6.770 -5.004 1.185 1.00 0.00 C ATOM 766 CD1 LEU A 52 -8.038 -5.671 0.675 1.00 0.00 C ATOM 767 CD2 LEU A 52 -6.429 -3.785 0.341 1.00 0.00 C ATOM 0 H LEU A 52 -7.017 -4.354 5.200 1.00 0.00 H new ATOM 0 HA LEU A 52 -7.085 -6.633 3.360 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -7.954 -4.289 2.822 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.288 -3.748 2.854 1.00 0.00 H new ATOM 0 HG LEU A 52 -5.951 -5.719 1.104 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.909 -5.945 -0.372 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -8.239 -6.567 1.262 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.876 -4.980 0.769 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -6.321 -4.083 -0.702 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -7.227 -3.048 0.427 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.494 -3.349 0.692 1.00 0.00 H new ATOM 779 N ARG A 53 -4.631 -6.902 2.857 1.00 0.00 N ATOM 780 CA ARG A 53 -3.214 -7.232 2.776 1.00 0.00 C ATOM 781 C ARG A 53 -2.828 -7.634 1.356 1.00 0.00 C ATOM 782 O ARG A 53 -3.414 -8.550 0.779 1.00 0.00 O ATOM 783 CB ARG A 53 -2.876 -8.364 3.748 1.00 0.00 C ATOM 784 CG ARG A 53 -1.383 -8.574 3.942 1.00 0.00 C ATOM 785 CD ARG A 53 -1.090 -9.364 5.207 1.00 0.00 C ATOM 786 NE ARG A 53 -1.412 -8.605 6.413 1.00 0.00 N ATOM 787 CZ ARG A 53 -1.469 -9.137 7.632 1.00 0.00 C ATOM 788 NH1 ARG A 53 -1.226 -10.429 7.811 1.00 0.00 N ATOM 789 NH2 ARG A 53 -1.767 -8.374 8.675 1.00 0.00 N ATOM 0 H ARG A 53 -5.228 -7.453 2.240 1.00 0.00 H new ATOM 0 HA ARG A 53 -2.644 -6.344 3.050 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -3.333 -8.151 4.714 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -3.320 -9.290 3.383 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -0.974 -9.101 3.080 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -0.882 -7.607 3.992 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -1.665 -10.290 5.197 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -0.036 -9.643 5.225 1.00 0.00 H new ATOM 0 HE ARG A 53 -1.605 -7.608 6.315 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -0.994 -11.020 7.012 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -1.271 -10.831 8.747 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -1.953 -7.380 8.543 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -1.811 -8.781 9.609 1.00 0.00 H new ATOM 803 N LEU A 54 -1.839 -6.943 0.799 1.00 0.00 N ATOM 804 CA LEU A 54 -1.375 -7.228 -0.554 1.00 0.00 C ATOM 805 C LEU A 54 0.149 -7.280 -0.608 1.00 0.00 C ATOM 806 O LEU A 54 0.817 -6.248 -0.542 1.00 0.00 O ATOM 807 CB LEU A 54 -1.894 -6.170 -1.528 1.00 0.00 C ATOM 808 CG LEU A 54 -1.450 -6.355 -2.981 1.00 0.00 C ATOM 809 CD1 LEU A 54 -2.431 -7.244 -3.729 1.00 0.00 C ATOM 810 CD2 LEU A 54 -1.316 -5.005 -3.671 1.00 0.00 C ATOM 0 H LEU A 54 -1.343 -6.182 1.263 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.765 -8.203 -0.846 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.983 -6.170 -1.494 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.564 -5.189 -1.185 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.475 -6.842 -2.986 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -2.099 -7.364 -4.760 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -2.478 -8.220 -3.247 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -3.420 -6.785 -3.717 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -1.000 -5.154 -4.703 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.278 -4.492 -3.657 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.575 -4.401 -3.148 1.00 0.00 H new ATOM 822 N THR A 55 0.691 -8.487 -0.727 1.00 0.00 N ATOM 823 CA THR A 55 2.138 -8.670 -0.790 1.00 0.00 C ATOM 824 C THR A 55 2.521 -9.578 -1.954 1.00 0.00 C ATOM 825 O THR A 55 1.704 -10.364 -2.436 1.00 0.00 O ATOM 826 CB THR A 55 2.655 -9.258 0.523 1.00 0.00 C ATOM 827 OG1 THR A 55 2.120 -10.552 0.740 1.00 0.00 O ATOM 828 CG2 THR A 55 2.318 -8.412 1.731 1.00 0.00 C ATOM 0 H THR A 55 0.153 -9.352 -0.782 1.00 0.00 H new ATOM 0 HA THR A 55 2.597 -7.694 -0.949 1.00 0.00 H new ATOM 0 HB THR A 55 3.739 -9.293 0.416 1.00 0.00 H new ATOM 0 HG1 THR A 55 2.465 -10.911 1.584 1.00 0.00 H new ATOM 0 HG21 THR A 55 2.714 -8.886 2.629 1.00 0.00 H new ATOM 0 HG22 THR A 55 2.761 -7.423 1.618 1.00 0.00 H new ATOM 0 HG23 THR A 55 1.236 -8.317 1.818 1.00 0.00 H new ATOM 836 N LYS A 56 3.767 -9.465 -2.401 1.00 0.00 N ATOM 837 CA LYS A 56 4.258 -10.276 -3.510 1.00 0.00 C ATOM 838 C LYS A 56 3.440 -10.025 -4.772 1.00 0.00 C ATOM 839 O LYS A 56 3.199 -10.939 -5.560 1.00 0.00 O ATOM 840 CB LYS A 56 4.208 -11.761 -3.143 1.00 0.00 C ATOM 841 CG LYS A 56 5.334 -12.196 -2.216 1.00 0.00 C ATOM 842 CD LYS A 56 6.336 -13.087 -2.933 1.00 0.00 C ATOM 843 CE LYS A 56 7.609 -13.265 -2.120 1.00 0.00 C ATOM 844 NZ LYS A 56 7.827 -14.686 -1.733 1.00 0.00 N ATOM 0 H LYS A 56 4.455 -8.820 -2.013 1.00 0.00 H new ATOM 0 HA LYS A 56 5.292 -9.991 -3.707 1.00 0.00 H new ATOM 0 HB2 LYS A 56 3.252 -11.977 -2.666 1.00 0.00 H new ATOM 0 HB3 LYS A 56 4.250 -12.354 -4.056 1.00 0.00 H new ATOM 0 HG2 LYS A 56 5.844 -11.316 -1.824 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.917 -12.730 -1.362 1.00 0.00 H new ATOM 0 HD2 LYS A 56 5.886 -14.061 -3.124 1.00 0.00 H new ATOM 0 HD3 LYS A 56 6.581 -12.654 -3.903 1.00 0.00 H new ATOM 0 HE2 LYS A 56 8.462 -12.912 -2.699 1.00 0.00 H new ATOM 0 HE3 LYS A 56 7.556 -12.649 -1.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 8.705 -14.765 -1.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 7.025 -15.016 -1.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 7.904 -15.271 -2.589 1.00 0.00 H new ATOM 858 N ALA A 57 3.016 -8.780 -4.959 1.00 0.00 N ATOM 859 CA ALA A 57 2.225 -8.408 -6.126 1.00 0.00 C ATOM 860 C ALA A 57 3.106 -7.809 -7.217 1.00 0.00 C ATOM 861 O ALA A 57 4.193 -7.302 -6.943 1.00 0.00 O ATOM 862 CB ALA A 57 1.131 -7.428 -5.731 1.00 0.00 C ATOM 0 H ALA A 57 3.207 -8.011 -4.317 1.00 0.00 H new ATOM 0 HA ALA A 57 1.762 -9.311 -6.524 1.00 0.00 H new ATOM 0 HB1 ALA A 57 0.548 -7.159 -6.612 1.00 0.00 H new ATOM 0 HB2 ALA A 57 0.478 -7.891 -4.991 1.00 0.00 H new ATOM 0 HB3 ALA A 57 1.582 -6.531 -5.306 1.00 0.00 H new ATOM 868 N HIS A 58 2.628 -7.870 -8.456 1.00 0.00 N ATOM 869 CA HIS A 58 3.371 -7.334 -9.590 1.00 0.00 C ATOM 870 C HIS A 58 2.448 -7.087 -10.778 1.00 0.00 C ATOM 871 O HIS A 58 1.822 -8.012 -11.293 1.00 0.00 O ATOM 872 CB HIS A 58 4.493 -8.294 -9.992 1.00 0.00 C ATOM 873 CG HIS A 58 5.563 -7.651 -10.818 1.00 0.00 C ATOM 874 ND1 HIS A 58 5.501 -6.579 -11.649 1.00 0.00 N flip ATOM 875 CD2 HIS A 58 6.867 -8.089 -10.861 1.00 0.00 C flip ATOM 876 CE1 HIS A 58 6.759 -6.356 -12.201 1.00 0.00 C flip ATOM 877 NE2 HIS A 58 7.544 -7.288 -11.696 1.00 0.00 N flip ATOM 0 H HIS A 58 1.729 -8.286 -8.700 1.00 0.00 H new ATOM 0 HA HIS A 58 3.808 -6.382 -9.288 1.00 0.00 H new ATOM 0 HB2 HIS A 58 4.943 -8.712 -9.091 1.00 0.00 H new ATOM 0 HB3 HIS A 58 4.065 -9.126 -10.551 1.00 0.00 H new ATOM 0 HD2 HIS A 58 7.273 -8.930 -10.318 1.00 0.00 H new ATOM 0 HE1 HIS A 58 7.036 -5.580 -12.899 1.00 0.00 H new ATOM 0 HE2 HIS A 58 8.536 -7.386 -11.912 1.00 0.00 H new ATOM 885 N SER A 59 2.369 -5.832 -11.209 1.00 0.00 N ATOM 886 CA SER A 59 1.522 -5.463 -12.337 1.00 0.00 C ATOM 887 C SER A 59 0.058 -5.780 -12.045 1.00 0.00 C ATOM 888 O SER A 59 -0.705 -6.124 -12.948 1.00 0.00 O ATOM 889 CB SER A 59 1.971 -6.197 -13.601 1.00 0.00 C ATOM 890 OG SER A 59 3.241 -5.738 -14.032 1.00 0.00 O ATOM 0 H SER A 59 2.881 -5.054 -10.794 1.00 0.00 H new ATOM 0 HA SER A 59 1.619 -4.389 -12.495 1.00 0.00 H new ATOM 0 HB2 SER A 59 2.014 -7.269 -13.407 1.00 0.00 H new ATOM 0 HB3 SER A 59 1.238 -6.046 -14.393 1.00 0.00 H new ATOM 0 HG SER A 59 3.914 -5.952 -13.353 1.00 0.00 H new ATOM 896 N CYS A 60 -0.327 -5.661 -10.779 1.00 0.00 N ATOM 897 CA CYS A 60 -1.699 -5.933 -10.368 1.00 0.00 C ATOM 898 C CYS A 60 -2.395 -4.656 -9.910 1.00 0.00 C ATOM 899 O CYS A 60 -1.743 -3.686 -9.524 1.00 0.00 O ATOM 900 CB CYS A 60 -1.720 -6.971 -9.243 1.00 0.00 C ATOM 901 SG CYS A 60 -0.738 -8.450 -9.585 1.00 0.00 S ATOM 0 H CYS A 60 0.292 -5.378 -10.020 1.00 0.00 H new ATOM 0 HA CYS A 60 -2.237 -6.329 -11.229 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -1.352 -6.507 -8.328 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -2.752 -7.268 -9.057 1.00 0.00 H new ATOM 0 HG CYS A 60 0.223 -8.152 -10.408 1.00 0.00 H new ATOM 907 N LYS A 61 -3.724 -4.663 -9.956 1.00 0.00 N ATOM 908 CA LYS A 61 -4.509 -3.505 -9.545 1.00 0.00 C ATOM 909 C LYS A 61 -5.498 -3.881 -8.446 1.00 0.00 C ATOM 910 O LYS A 61 -6.159 -4.917 -8.520 1.00 0.00 O ATOM 911 CB LYS A 61 -5.259 -2.922 -10.745 1.00 0.00 C ATOM 912 CG LYS A 61 -4.538 -1.757 -11.405 1.00 0.00 C ATOM 913 CD LYS A 61 -5.184 -1.381 -12.728 1.00 0.00 C ATOM 914 CE LYS A 61 -4.511 -0.168 -13.352 1.00 0.00 C ATOM 915 NZ LYS A 61 -4.779 -0.073 -14.814 1.00 0.00 N ATOM 0 H LYS A 61 -4.279 -5.458 -10.274 1.00 0.00 H new ATOM 0 HA LYS A 61 -3.825 -2.753 -9.151 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -5.413 -3.709 -11.484 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -6.246 -2.591 -10.421 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -4.547 -0.896 -10.737 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -3.493 -2.021 -11.571 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -5.125 -2.225 -13.416 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -6.242 -1.171 -12.571 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -4.865 0.737 -12.859 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -3.436 -0.223 -13.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -4.303 0.767 -15.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -4.418 -0.925 -15.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -5.804 0.005 -14.975 1.00 0.00 H new ATOM 929 N LEU A 62 -5.592 -3.035 -7.426 1.00 0.00 N ATOM 930 CA LEU A 62 -6.499 -3.279 -6.311 1.00 0.00 C ATOM 931 C LEU A 62 -7.370 -2.057 -6.039 1.00 0.00 C ATOM 932 O LEU A 62 -6.863 -0.954 -5.837 1.00 0.00 O ATOM 933 CB LEU A 62 -5.709 -3.647 -5.053 1.00 0.00 C ATOM 934 CG LEU A 62 -6.524 -4.329 -3.953 1.00 0.00 C ATOM 935 CD1 LEU A 62 -7.193 -5.586 -4.487 1.00 0.00 C ATOM 936 CD2 LEU A 62 -5.639 -4.658 -2.761 1.00 0.00 C ATOM 0 H LEU A 62 -5.051 -2.174 -7.348 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.148 -4.112 -6.581 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.888 -4.306 -5.337 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -5.263 -2.740 -4.644 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.302 -3.641 -3.623 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.768 -6.058 -3.691 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.859 -5.323 -5.309 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -6.432 -6.279 -4.845 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.235 -5.143 -1.988 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -4.839 -5.328 -3.076 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -5.207 -3.739 -2.364 1.00 0.00 H new ATOM 948 N LEU A 63 -8.683 -2.261 -6.034 1.00 0.00 N ATOM 949 CA LEU A 63 -9.626 -1.177 -5.786 1.00 0.00 C ATOM 950 C LEU A 63 -10.691 -1.603 -4.781 1.00 0.00 C ATOM 951 O LEU A 63 -11.547 -2.436 -5.084 1.00 0.00 O ATOM 952 CB LEU A 63 -10.287 -0.739 -7.095 1.00 0.00 C ATOM 953 CG LEU A 63 -9.321 -0.446 -8.244 1.00 0.00 C ATOM 954 CD1 LEU A 63 -9.904 -0.917 -9.567 1.00 0.00 C ATOM 955 CD2 LEU A 63 -8.996 1.039 -8.300 1.00 0.00 C ATOM 0 H LEU A 63 -9.119 -3.168 -6.199 1.00 0.00 H new ATOM 0 HA LEU A 63 -9.074 -0.336 -5.367 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -10.979 -1.519 -7.413 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -10.880 0.155 -6.903 1.00 0.00 H new ATOM 0 HG LEU A 63 -8.396 -0.994 -8.064 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -9.202 -0.700 -10.372 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -10.085 -1.991 -9.523 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -10.844 -0.398 -9.756 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -8.307 1.230 -9.123 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -9.913 1.607 -8.455 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -8.534 1.346 -7.362 1.00 0.00 H new ATOM 967 N CYS A 64 -10.632 -1.029 -3.584 1.00 0.00 N ATOM 968 CA CYS A 64 -11.593 -1.352 -2.535 1.00 0.00 C ATOM 969 C CYS A 64 -11.915 -0.123 -1.691 1.00 0.00 C ATOM 970 O CYS A 64 -11.094 0.785 -1.560 1.00 0.00 O ATOM 971 CB CYS A 64 -11.047 -2.468 -1.642 1.00 0.00 C ATOM 972 SG CYS A 64 -12.212 -3.047 -0.387 1.00 0.00 S ATOM 0 H CYS A 64 -9.930 -0.339 -3.316 1.00 0.00 H new ATOM 0 HA CYS A 64 -12.512 -1.692 -3.012 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -10.757 -3.311 -2.269 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -10.143 -2.113 -1.147 1.00 0.00 H new ATOM 0 HG CYS A 64 -11.986 -4.301 -0.131 1.00 0.00 H new ATOM 978 N GLY A 65 -13.115 -0.102 -1.121 1.00 0.00 N ATOM 979 CA GLY A 65 -13.526 1.018 -0.296 1.00 0.00 C ATOM 980 C GLY A 65 -12.618 1.218 0.904 1.00 0.00 C ATOM 981 O GLY A 65 -11.659 0.469 1.088 1.00 0.00 O ATOM 0 H GLY A 65 -13.811 -0.842 -1.216 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -13.532 1.926 -0.899 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -14.548 0.857 0.048 1.00 0.00 H new ATOM 985 N PRO A 66 -12.900 2.226 1.746 1.00 0.00 N ATOM 986 CA PRO A 66 -12.092 2.509 2.938 1.00 0.00 C ATOM 987 C PRO A 66 -12.060 1.330 3.904 1.00 0.00 C ATOM 988 O PRO A 66 -13.083 0.954 4.475 1.00 0.00 O ATOM 989 CB PRO A 66 -12.795 3.712 3.581 1.00 0.00 C ATOM 990 CG PRO A 66 -14.165 3.726 2.994 1.00 0.00 C ATOM 991 CD PRO A 66 -14.024 3.166 1.609 1.00 0.00 C ATOM 0 HA PRO A 66 -11.050 2.701 2.684 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -12.833 3.612 4.666 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -12.265 4.639 3.365 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -14.852 3.125 3.590 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -14.568 4.738 2.967 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -14.934 2.662 1.282 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -13.811 3.946 0.878 1.00 0.00 H new ATOM 999 N VAL A 67 -10.877 0.750 4.082 1.00 0.00 N ATOM 1000 CA VAL A 67 -10.709 -0.388 4.978 1.00 0.00 C ATOM 1001 C VAL A 67 -11.158 -0.044 6.396 1.00 0.00 C ATOM 1002 O VAL A 67 -11.217 1.126 6.771 1.00 0.00 O ATOM 1003 CB VAL A 67 -9.243 -0.866 5.012 1.00 0.00 C ATOM 1004 CG1 VAL A 67 -8.331 0.234 5.535 1.00 0.00 C ATOM 1005 CG2 VAL A 67 -9.108 -2.126 5.854 1.00 0.00 C ATOM 0 H VAL A 67 -10.020 1.050 3.617 1.00 0.00 H new ATOM 0 HA VAL A 67 -11.334 -1.192 4.589 1.00 0.00 H new ATOM 0 HB VAL A 67 -8.937 -1.104 3.993 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -7.302 -0.124 5.551 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -8.402 1.106 4.884 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -8.635 0.509 6.545 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -8.066 -2.446 5.865 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -9.435 -1.919 6.873 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -9.726 -2.916 5.428 1.00 0.00 H new ATOM 1015 N SER A 68 -11.472 -1.072 7.177 1.00 0.00 N ATOM 1016 CA SER A 68 -11.916 -0.880 8.552 1.00 0.00 C ATOM 1017 C SER A 68 -10.755 -0.451 9.445 1.00 0.00 C ATOM 1018 O SER A 68 -10.847 0.542 10.165 1.00 0.00 O ATOM 1019 CB SER A 68 -12.543 -2.166 9.093 1.00 0.00 C ATOM 1020 OG SER A 68 -13.097 -1.962 10.380 1.00 0.00 O ATOM 0 H SER A 68 -11.427 -2.047 6.881 1.00 0.00 H new ATOM 0 HA SER A 68 -12.666 -0.089 8.557 1.00 0.00 H new ATOM 0 HB2 SER A 68 -13.320 -2.511 8.410 1.00 0.00 H new ATOM 0 HB3 SER A 68 -11.788 -2.951 9.139 1.00 0.00 H new ATOM 0 HG SER A 68 -13.493 -2.799 10.702 1.00 0.00 H new ATOM 1026 N THR A 69 -9.664 -1.209 9.393 1.00 0.00 N ATOM 1027 CA THR A 69 -8.486 -0.907 10.198 1.00 0.00 C ATOM 1028 C THR A 69 -7.398 -0.253 9.350 1.00 0.00 C ATOM 1029 O THR A 69 -7.221 0.964 9.383 1.00 0.00 O ATOM 1030 CB THR A 69 -7.947 -2.182 10.849 1.00 0.00 C ATOM 1031 OG1 THR A 69 -8.062 -3.283 9.965 1.00 0.00 O ATOM 1032 CG2 THR A 69 -8.662 -2.548 12.132 1.00 0.00 C ATOM 0 H THR A 69 -9.571 -2.036 8.803 1.00 0.00 H new ATOM 0 HA THR A 69 -8.781 -0.206 10.979 1.00 0.00 H new ATOM 0 HB THR A 69 -6.904 -1.968 11.082 1.00 0.00 H new ATOM 0 HG1 THR A 69 -8.997 -3.576 9.927 1.00 0.00 H new ATOM 0 HG21 THR A 69 -8.230 -3.461 12.541 1.00 0.00 H new ATOM 0 HG22 THR A 69 -8.551 -1.739 12.854 1.00 0.00 H new ATOM 0 HG23 THR A 69 -9.720 -2.707 11.926 1.00 0.00 H new ATOM 1040 N SER A 70 -6.672 -1.070 8.592 1.00 0.00 N ATOM 1041 CA SER A 70 -5.601 -0.568 7.738 1.00 0.00 C ATOM 1042 C SER A 70 -5.199 -1.613 6.701 1.00 0.00 C ATOM 1043 O SER A 70 -5.755 -2.710 6.660 1.00 0.00 O ATOM 1044 CB SER A 70 -4.386 -0.176 8.581 1.00 0.00 C ATOM 1045 OG SER A 70 -4.739 -0.012 9.944 1.00 0.00 O ATOM 0 H SER A 70 -6.806 -2.080 8.552 1.00 0.00 H new ATOM 0 HA SER A 70 -5.971 0.315 7.216 1.00 0.00 H new ATOM 0 HB2 SER A 70 -3.616 -0.942 8.492 1.00 0.00 H new ATOM 0 HB3 SER A 70 -3.959 0.751 8.199 1.00 0.00 H new ATOM 0 HG SER A 70 -3.944 0.237 10.460 1.00 0.00 H new ATOM 1051 N VAL A 71 -4.228 -1.263 5.863 1.00 0.00 N ATOM 1052 CA VAL A 71 -3.748 -2.169 4.827 1.00 0.00 C ATOM 1053 C VAL A 71 -2.234 -2.342 4.910 1.00 0.00 C ATOM 1054 O VAL A 71 -1.535 -1.508 5.484 1.00 0.00 O ATOM 1055 CB VAL A 71 -4.118 -1.661 3.421 1.00 0.00 C ATOM 1056 CG1 VAL A 71 -3.790 -2.710 2.370 1.00 0.00 C ATOM 1057 CG2 VAL A 71 -5.590 -1.279 3.362 1.00 0.00 C ATOM 0 H VAL A 71 -3.758 -0.358 5.882 1.00 0.00 H new ATOM 0 HA VAL A 71 -4.233 -3.130 4.997 1.00 0.00 H new ATOM 0 HB VAL A 71 -3.526 -0.771 3.209 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.058 -2.333 1.383 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -2.723 -2.930 2.396 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.353 -3.620 2.576 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.833 -0.922 2.361 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.202 -2.150 3.595 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -5.791 -0.490 4.087 1.00 0.00 H new ATOM 1067 N PHE A 72 -1.736 -3.433 4.336 1.00 0.00 N ATOM 1068 CA PHE A 72 -0.304 -3.715 4.348 1.00 0.00 C ATOM 1069 C PHE A 72 0.208 -3.999 2.940 1.00 0.00 C ATOM 1070 O PHE A 72 -0.533 -4.484 2.085 1.00 0.00 O ATOM 1071 CB PHE A 72 -0.007 -4.906 5.262 1.00 0.00 C ATOM 1072 CG PHE A 72 -0.006 -4.556 6.722 1.00 0.00 C ATOM 1073 CD1 PHE A 72 -1.198 -4.377 7.407 1.00 0.00 C ATOM 1074 CD2 PHE A 72 1.187 -4.406 7.411 1.00 0.00 C ATOM 1075 CE1 PHE A 72 -1.200 -4.054 8.750 1.00 0.00 C ATOM 1076 CE2 PHE A 72 1.192 -4.084 8.755 1.00 0.00 C ATOM 1077 CZ PHE A 72 -0.003 -3.907 9.425 1.00 0.00 C ATOM 0 H PHE A 72 -2.301 -4.135 3.858 1.00 0.00 H new ATOM 0 HA PHE A 72 0.212 -2.834 4.730 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -0.749 -5.684 5.084 1.00 0.00 H new ATOM 0 HB3 PHE A 72 0.964 -5.324 4.996 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -2.136 -4.491 6.884 1.00 0.00 H new ATOM 0 HD2 PHE A 72 2.124 -4.542 6.892 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -2.136 -3.917 9.272 1.00 0.00 H new ATOM 0 HE2 PHE A 72 2.129 -3.971 9.281 1.00 0.00 H new ATOM 0 HZ PHE A 72 -0.002 -3.654 10.475 1.00 0.00 H new ATOM 1087 N LEU A 73 1.481 -3.696 2.706 1.00 0.00 N ATOM 1088 CA LEU A 73 2.094 -3.919 1.403 1.00 0.00 C ATOM 1089 C LEU A 73 3.557 -4.326 1.553 1.00 0.00 C ATOM 1090 O LEU A 73 4.323 -3.676 2.264 1.00 0.00 O ATOM 1091 CB LEU A 73 1.990 -2.656 0.545 1.00 0.00 C ATOM 1092 CG LEU A 73 1.979 -2.899 -0.966 1.00 0.00 C ATOM 1093 CD1 LEU A 73 0.555 -3.085 -1.466 1.00 0.00 C ATOM 1094 CD2 LEU A 73 2.658 -1.749 -1.694 1.00 0.00 C ATOM 0 H LEU A 73 2.108 -3.295 3.403 1.00 0.00 H new ATOM 0 HA LEU A 73 1.558 -4.730 0.911 1.00 0.00 H new ATOM 0 HB2 LEU A 73 1.079 -2.123 0.819 1.00 0.00 H new ATOM 0 HB3 LEU A 73 2.827 -2.001 0.786 1.00 0.00 H new ATOM 0 HG LEU A 73 2.536 -3.813 -1.173 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.567 -3.257 -2.542 1.00 0.00 H new ATOM 0 HD12 LEU A 73 0.103 -3.942 -0.967 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -0.027 -2.190 -1.248 1.00 0.00 H new ATOM 0 HD21 LEU A 73 2.642 -1.938 -2.767 1.00 0.00 H new ATOM 0 HD22 LEU A 73 2.129 -0.820 -1.481 1.00 0.00 H new ATOM 0 HD23 LEU A 73 3.691 -1.664 -1.356 1.00 0.00 H new ATOM 1106 N GLU A 74 3.938 -5.406 0.878 1.00 0.00 N ATOM 1107 CA GLU A 74 5.310 -5.898 0.937 1.00 0.00 C ATOM 1108 C GLU A 74 5.637 -6.752 -0.284 1.00 0.00 C ATOM 1109 O GLU A 74 4.803 -7.526 -0.754 1.00 0.00 O ATOM 1110 CB GLU A 74 5.526 -6.712 2.215 1.00 0.00 C ATOM 1111 CG GLU A 74 6.948 -7.225 2.377 1.00 0.00 C ATOM 1112 CD GLU A 74 7.120 -8.085 3.614 1.00 0.00 C ATOM 1113 OE1 GLU A 74 6.135 -8.730 4.030 1.00 0.00 O ATOM 1114 OE2 GLU A 74 8.239 -8.112 4.167 1.00 0.00 O ATOM 0 H GLU A 74 3.317 -5.956 0.285 1.00 0.00 H new ATOM 0 HA GLU A 74 5.978 -5.037 0.944 1.00 0.00 H new ATOM 0 HB2 GLU A 74 5.271 -6.095 3.076 1.00 0.00 H new ATOM 0 HB3 GLU A 74 4.841 -7.560 2.216 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.224 -7.804 1.495 1.00 0.00 H new ATOM 0 HG3 GLU A 74 7.632 -6.378 2.430 1.00 0.00 H new ATOM 1121 N ASP A 75 6.856 -6.606 -0.792 1.00 0.00 N ATOM 1122 CA ASP A 75 7.294 -7.365 -1.958 1.00 0.00 C ATOM 1123 C ASP A 75 6.431 -7.041 -3.175 1.00 0.00 C ATOM 1124 O ASP A 75 6.136 -7.915 -3.989 1.00 0.00 O ATOM 1125 CB ASP A 75 7.243 -8.866 -1.667 1.00 0.00 C ATOM 1126 CG ASP A 75 8.523 -9.376 -1.036 1.00 0.00 C ATOM 1127 OD1 ASP A 75 9.176 -8.600 -0.308 1.00 0.00 O ATOM 1128 OD2 ASP A 75 8.873 -10.552 -1.269 1.00 0.00 O ATOM 0 H ASP A 75 7.558 -5.969 -0.415 1.00 0.00 H new ATOM 0 HA ASP A 75 8.323 -7.080 -2.178 1.00 0.00 H new ATOM 0 HB2 ASP A 75 6.405 -9.076 -1.003 1.00 0.00 H new ATOM 0 HB3 ASP A 75 7.058 -9.407 -2.595 1.00 0.00 H new ATOM 1133 N CYS A 76 6.031 -5.779 -3.290 1.00 0.00 N ATOM 1134 CA CYS A 76 5.202 -5.339 -4.406 1.00 0.00 C ATOM 1135 C CYS A 76 5.984 -4.411 -5.330 1.00 0.00 C ATOM 1136 O CYS A 76 6.800 -3.609 -4.875 1.00 0.00 O ATOM 1137 CB CYS A 76 3.950 -4.628 -3.891 1.00 0.00 C ATOM 1138 SG CYS A 76 2.778 -5.716 -3.045 1.00 0.00 S ATOM 0 H CYS A 76 6.267 -5.043 -2.624 1.00 0.00 H new ATOM 0 HA CYS A 76 4.902 -6.220 -4.973 1.00 0.00 H new ATOM 0 HB2 CYS A 76 4.251 -3.834 -3.207 1.00 0.00 H new ATOM 0 HB3 CYS A 76 3.445 -4.151 -4.731 1.00 0.00 H new ATOM 0 HG CYS A 76 1.605 -5.155 -3.020 1.00 0.00 H new ATOM 1144 N SER A 77 5.730 -4.525 -6.630 1.00 0.00 N ATOM 1145 CA SER A 77 6.411 -3.695 -7.616 1.00 0.00 C ATOM 1146 C SER A 77 5.554 -3.516 -8.864 1.00 0.00 C ATOM 1147 O SER A 77 4.975 -4.475 -9.375 1.00 0.00 O ATOM 1148 CB SER A 77 7.758 -4.317 -7.994 1.00 0.00 C ATOM 1149 OG SER A 77 8.435 -3.525 -8.954 1.00 0.00 O ATOM 0 H SER A 77 5.058 -5.184 -7.024 1.00 0.00 H new ATOM 0 HA SER A 77 6.582 -2.715 -7.171 1.00 0.00 H new ATOM 0 HB2 SER A 77 8.377 -4.421 -7.103 1.00 0.00 H new ATOM 0 HB3 SER A 77 7.600 -5.320 -8.391 1.00 0.00 H new ATOM 0 HG SER A 77 8.355 -2.579 -8.712 1.00 0.00 H new ATOM 1155 N ASP A 78 5.479 -2.281 -9.351 1.00 0.00 N ATOM 1156 CA ASP A 78 4.694 -1.975 -10.541 1.00 0.00 C ATOM 1157 C ASP A 78 3.221 -2.304 -10.324 1.00 0.00 C ATOM 1158 O ASP A 78 2.541 -2.787 -11.230 1.00 0.00 O ATOM 1159 CB ASP A 78 5.231 -2.751 -11.746 1.00 0.00 C ATOM 1160 CG ASP A 78 6.400 -2.052 -12.411 1.00 0.00 C ATOM 1161 OD1 ASP A 78 6.247 -0.874 -12.794 1.00 0.00 O ATOM 1162 OD2 ASP A 78 7.469 -2.684 -12.545 1.00 0.00 O ATOM 0 H ASP A 78 5.952 -1.477 -8.940 1.00 0.00 H new ATOM 0 HA ASP A 78 4.782 -0.906 -10.737 1.00 0.00 H new ATOM 0 HB2 ASP A 78 5.541 -3.745 -11.425 1.00 0.00 H new ATOM 0 HB3 ASP A 78 4.431 -2.886 -12.474 1.00 0.00 H new ATOM 1167 N CYS A 79 2.732 -2.040 -9.117 1.00 0.00 N ATOM 1168 CA CYS A 79 1.338 -2.307 -8.781 1.00 0.00 C ATOM 1169 C CYS A 79 0.604 -1.016 -8.434 1.00 0.00 C ATOM 1170 O CYS A 79 1.226 0.023 -8.210 1.00 0.00 O ATOM 1171 CB CYS A 79 1.252 -3.285 -7.608 1.00 0.00 C ATOM 1172 SG CYS A 79 2.137 -4.839 -7.877 1.00 0.00 S ATOM 0 H CYS A 79 3.280 -1.641 -8.355 1.00 0.00 H new ATOM 0 HA CYS A 79 0.860 -2.753 -9.654 1.00 0.00 H new ATOM 0 HB2 CYS A 79 1.651 -2.802 -6.716 1.00 0.00 H new ATOM 0 HB3 CYS A 79 0.203 -3.506 -7.409 1.00 0.00 H new ATOM 0 HG CYS A 79 3.251 -4.601 -8.503 1.00 0.00 H new ATOM 1178 N VAL A 80 -0.723 -1.087 -8.394 1.00 0.00 N ATOM 1179 CA VAL A 80 -1.542 0.076 -8.075 1.00 0.00 C ATOM 1180 C VAL A 80 -2.548 -0.244 -6.975 1.00 0.00 C ATOM 1181 O VAL A 80 -3.593 -0.843 -7.230 1.00 0.00 O ATOM 1182 CB VAL A 80 -2.300 0.586 -9.315 1.00 0.00 C ATOM 1183 CG1 VAL A 80 -2.987 1.909 -9.015 1.00 0.00 C ATOM 1184 CG2 VAL A 80 -1.354 0.725 -10.499 1.00 0.00 C ATOM 0 H VAL A 80 -1.254 -1.938 -8.579 1.00 0.00 H new ATOM 0 HA VAL A 80 -0.863 0.854 -7.727 1.00 0.00 H new ATOM 0 HB VAL A 80 -3.067 -0.144 -9.575 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -3.517 2.253 -9.903 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -3.696 1.774 -8.199 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -2.241 2.650 -8.728 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -1.907 1.086 -11.366 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.563 1.433 -10.252 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -0.913 -0.245 -10.728 1.00 0.00 H new ATOM 1194 N LEU A 81 -2.226 0.159 -5.750 1.00 0.00 N ATOM 1195 CA LEU A 81 -3.102 -0.086 -4.610 1.00 0.00 C ATOM 1196 C LEU A 81 -3.984 1.127 -4.332 1.00 0.00 C ATOM 1197 O LEU A 81 -3.490 2.201 -3.988 1.00 0.00 O ATOM 1198 CB LEU A 81 -2.275 -0.424 -3.368 1.00 0.00 C ATOM 1199 CG LEU A 81 -3.090 -0.806 -2.130 1.00 0.00 C ATOM 1200 CD1 LEU A 81 -3.074 -2.313 -1.922 1.00 0.00 C ATOM 1201 CD2 LEU A 81 -2.557 -0.091 -0.896 1.00 0.00 C ATOM 0 H LEU A 81 -1.365 0.656 -5.521 1.00 0.00 H new ATOM 0 HA LEU A 81 -3.744 -0.933 -4.852 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -1.604 -1.248 -3.611 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.650 0.434 -3.122 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.122 -0.493 -2.290 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.659 -2.564 -1.037 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -3.505 -2.805 -2.794 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -2.047 -2.651 -1.786 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -3.149 -0.375 -0.026 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -1.516 -0.372 -0.734 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -2.623 0.987 -1.043 1.00 0.00 H new ATOM 1213 N ALA A 82 -5.292 0.949 -4.482 1.00 0.00 N ATOM 1214 CA ALA A 82 -6.244 2.028 -4.247 1.00 0.00 C ATOM 1215 C ALA A 82 -7.194 1.683 -3.107 1.00 0.00 C ATOM 1216 O ALA A 82 -8.189 0.984 -3.302 1.00 0.00 O ATOM 1217 CB ALA A 82 -7.026 2.327 -5.517 1.00 0.00 C ATOM 0 H ALA A 82 -5.717 0.066 -4.766 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.684 2.918 -3.961 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -7.733 3.135 -5.327 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -6.337 2.626 -6.307 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.569 1.435 -5.828 1.00 0.00 H new ATOM 1223 N VAL A 83 -6.882 2.177 -1.913 1.00 0.00 N ATOM 1224 CA VAL A 83 -7.708 1.921 -0.739 1.00 0.00 C ATOM 1225 C VAL A 83 -7.350 2.868 0.401 1.00 0.00 C ATOM 1226 O VAL A 83 -6.203 2.914 0.848 1.00 0.00 O ATOM 1227 CB VAL A 83 -7.557 0.465 -0.256 1.00 0.00 C ATOM 1228 CG1 VAL A 83 -6.119 0.178 0.150 1.00 0.00 C ATOM 1229 CG2 VAL A 83 -8.511 0.180 0.895 1.00 0.00 C ATOM 0 H VAL A 83 -6.063 2.757 -1.733 1.00 0.00 H new ATOM 0 HA VAL A 83 -8.744 2.091 -1.034 1.00 0.00 H new ATOM 0 HB VAL A 83 -7.814 -0.197 -1.083 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -6.035 -0.855 0.488 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.461 0.335 -0.705 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -5.829 0.849 0.959 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -8.389 -0.853 1.222 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -8.291 0.851 1.725 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -9.538 0.337 0.564 1.00 0.00 H new ATOM 1239 N ALA A 84 -8.339 3.625 0.868 1.00 0.00 N ATOM 1240 CA ALA A 84 -8.127 4.573 1.955 1.00 0.00 C ATOM 1241 C ALA A 84 -8.042 3.857 3.298 1.00 0.00 C ATOM 1242 O ALA A 84 -8.803 2.928 3.568 1.00 0.00 O ATOM 1243 CB ALA A 84 -9.243 5.607 1.976 1.00 0.00 C ATOM 0 H ALA A 84 -9.294 3.600 0.510 1.00 0.00 H new ATOM 0 HA ALA A 84 -7.178 5.081 1.783 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.073 6.309 2.792 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.256 6.147 1.029 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.200 5.106 2.121 1.00 0.00 H new ATOM 1249 N CYS A 85 -7.110 4.296 4.139 1.00 0.00 N ATOM 1250 CA CYS A 85 -6.924 3.697 5.455 1.00 0.00 C ATOM 1251 C CYS A 85 -6.379 4.719 6.447 1.00 0.00 C ATOM 1252 O CYS A 85 -6.089 5.859 6.083 1.00 0.00 O ATOM 1253 CB CYS A 85 -5.975 2.500 5.366 1.00 0.00 C ATOM 1254 SG CYS A 85 -4.399 2.869 4.559 1.00 0.00 S ATOM 0 H CYS A 85 -6.472 5.065 3.932 1.00 0.00 H new ATOM 0 HA CYS A 85 -7.896 3.355 5.810 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -5.778 2.130 6.372 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -6.471 1.696 4.822 1.00 0.00 H new ATOM 0 HG CYS A 85 -3.421 2.441 5.301 1.00 0.00 H new ATOM 1260 N GLN A 86 -6.241 4.305 7.702 1.00 0.00 N ATOM 1261 CA GLN A 86 -5.730 5.184 8.747 1.00 0.00 C ATOM 1262 C GLN A 86 -4.206 5.158 8.782 1.00 0.00 C ATOM 1263 O GLN A 86 -3.565 6.151 9.127 1.00 0.00 O ATOM 1264 CB GLN A 86 -6.291 4.772 10.109 1.00 0.00 C ATOM 1265 CG GLN A 86 -7.809 4.810 10.178 1.00 0.00 C ATOM 1266 CD GLN A 86 -8.355 4.079 11.389 1.00 0.00 C ATOM 1267 OE1 GLN A 86 -9.093 4.651 12.193 1.00 0.00 O ATOM 1268 NE2 GLN A 86 -7.995 2.809 11.526 1.00 0.00 N ATOM 0 H GLN A 86 -6.476 3.365 8.020 1.00 0.00 H new ATOM 0 HA GLN A 86 -6.053 6.201 8.522 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -5.950 3.764 10.343 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -5.884 5.432 10.875 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -8.142 5.848 10.203 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -8.222 4.365 9.273 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -7.382 2.375 10.836 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -8.331 2.266 12.322 1.00 0.00 H new ATOM 1277 N GLN A 87 -3.630 4.015 8.422 1.00 0.00 N ATOM 1278 CA GLN A 87 -2.181 3.858 8.411 1.00 0.00 C ATOM 1279 C GLN A 87 -1.748 2.895 7.310 1.00 0.00 C ATOM 1280 O GLN A 87 -2.344 1.833 7.131 1.00 0.00 O ATOM 1281 CB GLN A 87 -1.692 3.354 9.772 1.00 0.00 C ATOM 1282 CG GLN A 87 -1.069 4.440 10.633 1.00 0.00 C ATOM 1283 CD GLN A 87 -0.966 4.040 12.092 1.00 0.00 C ATOM 1284 OE1 GLN A 87 -1.651 4.596 12.950 1.00 0.00 O ATOM 1285 NE2 GLN A 87 -0.104 3.072 12.380 1.00 0.00 N ATOM 0 H GLN A 87 -4.146 3.184 8.134 1.00 0.00 H new ATOM 0 HA GLN A 87 -1.734 4.832 8.212 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -2.531 2.912 10.310 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -0.960 2.561 9.615 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -0.074 4.674 10.253 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -1.664 5.350 10.551 1.00 0.00 H new ATOM 0 HE21 GLN A 87 0.444 2.639 11.636 1.00 0.00 H new ATOM 0 HE22 GLN A 87 0.011 2.762 13.345 1.00 0.00 H new ATOM 1294 N LEU A 88 -0.707 3.273 6.575 1.00 0.00 N ATOM 1295 CA LEU A 88 -0.195 2.442 5.491 1.00 0.00 C ATOM 1296 C LEU A 88 1.231 1.986 5.782 1.00 0.00 C ATOM 1297 O LEU A 88 2.115 2.803 6.037 1.00 0.00 O ATOM 1298 CB LEU A 88 -0.238 3.211 4.168 1.00 0.00 C ATOM 1299 CG LEU A 88 0.070 2.375 2.924 1.00 0.00 C ATOM 1300 CD1 LEU A 88 -1.053 1.383 2.657 1.00 0.00 C ATOM 1301 CD2 LEU A 88 0.288 3.277 1.717 1.00 0.00 C ATOM 0 H LEU A 88 -0.202 4.149 6.710 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.830 1.559 5.411 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.228 3.653 4.054 1.00 0.00 H new ATOM 0 HB3 LEU A 88 0.475 4.034 4.220 1.00 0.00 H new ATOM 0 HG LEU A 88 0.987 1.814 3.103 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -0.817 0.797 1.769 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.161 0.717 3.513 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -1.986 1.924 2.498 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.506 2.666 0.841 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -0.612 3.865 1.535 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.126 3.947 1.910 1.00 0.00 H new ATOM 1313 N ARG A 89 1.447 0.675 5.740 1.00 0.00 N ATOM 1314 CA ARG A 89 2.766 0.108 5.998 1.00 0.00 C ATOM 1315 C ARG A 89 3.317 -0.576 4.751 1.00 0.00 C ATOM 1316 O ARG A 89 2.731 -1.535 4.247 1.00 0.00 O ATOM 1317 CB ARG A 89 2.696 -0.892 7.154 1.00 0.00 C ATOM 1318 CG ARG A 89 2.715 -0.238 8.527 1.00 0.00 C ATOM 1319 CD ARG A 89 3.097 -1.230 9.615 1.00 0.00 C ATOM 1320 NE ARG A 89 2.034 -1.391 10.604 1.00 0.00 N ATOM 1321 CZ ARG A 89 2.222 -1.912 11.815 1.00 0.00 C ATOM 1322 NH1 ARG A 89 3.428 -2.322 12.189 1.00 0.00 N ATOM 1323 NH2 ARG A 89 1.201 -2.022 12.654 1.00 0.00 N ATOM 0 H ARG A 89 0.726 -0.015 5.530 1.00 0.00 H new ATOM 0 HA ARG A 89 3.438 0.922 6.271 1.00 0.00 H new ATOM 0 HB2 ARG A 89 1.787 -1.485 7.056 1.00 0.00 H new ATOM 0 HB3 ARG A 89 3.536 -1.582 7.078 1.00 0.00 H new ATOM 0 HG2 ARG A 89 3.422 0.591 8.526 1.00 0.00 H new ATOM 0 HG3 ARG A 89 1.733 0.181 8.745 1.00 0.00 H new ATOM 0 HD2 ARG A 89 3.321 -2.196 9.163 1.00 0.00 H new ATOM 0 HD3 ARG A 89 4.006 -0.892 10.112 1.00 0.00 H new ATOM 0 HE ARG A 89 1.093 -1.087 10.352 1.00 0.00 H new ATOM 0 HH11 ARG A 89 4.217 -2.239 11.548 1.00 0.00 H new ATOM 0 HH12 ARG A 89 3.566 -2.720 13.118 1.00 0.00 H new ATOM 0 HH21 ARG A 89 0.273 -1.708 12.372 1.00 0.00 H new ATOM 0 HH22 ARG A 89 1.344 -2.421 13.582 1.00 0.00 H new ATOM 1337 N ILE A 90 4.447 -0.079 4.260 1.00 0.00 N ATOM 1338 CA ILE A 90 5.077 -0.642 3.072 1.00 0.00 C ATOM 1339 C ILE A 90 6.492 -1.122 3.379 1.00 0.00 C ATOM 1340 O ILE A 90 7.111 -0.683 4.348 1.00 0.00 O ATOM 1341 CB ILE A 90 5.133 0.384 1.924 1.00 0.00 C ATOM 1342 CG1 ILE A 90 3.757 1.018 1.705 1.00 0.00 C ATOM 1343 CG2 ILE A 90 5.627 -0.277 0.646 1.00 0.00 C ATOM 1344 CD1 ILE A 90 3.802 2.524 1.565 1.00 0.00 C ATOM 0 H ILE A 90 4.945 0.713 4.667 1.00 0.00 H new ATOM 0 HA ILE A 90 4.466 -1.489 2.761 1.00 0.00 H new ATOM 0 HB ILE A 90 5.834 1.172 2.197 1.00 0.00 H new ATOM 0 HG12 ILE A 90 3.307 0.591 0.809 1.00 0.00 H new ATOM 0 HG13 ILE A 90 3.109 0.758 2.542 1.00 0.00 H new ATOM 0 HG21 ILE A 90 5.661 0.461 -0.156 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.626 -0.682 0.809 1.00 0.00 H new ATOM 0 HG23 ILE A 90 4.949 -1.084 0.368 1.00 0.00 H new ATOM 0 HD11 ILE A 90 2.792 2.906 1.412 1.00 0.00 H new ATOM 0 HD12 ILE A 90 4.222 2.961 2.471 1.00 0.00 H new ATOM 0 HD13 ILE A 90 4.424 2.792 0.711 1.00 0.00 H new ATOM 1356 N HIS A 91 6.997 -2.027 2.547 1.00 0.00 N ATOM 1357 CA HIS A 91 8.340 -2.568 2.730 1.00 0.00 C ATOM 1358 C HIS A 91 8.781 -3.355 1.501 1.00 0.00 C ATOM 1359 O HIS A 91 8.028 -4.172 0.971 1.00 0.00 O ATOM 1360 CB HIS A 91 8.386 -3.464 3.969 1.00 0.00 C ATOM 1361 CG HIS A 91 9.765 -3.644 4.526 1.00 0.00 C ATOM 1362 ND1 HIS A 91 10.830 -4.128 3.801 1.00 0.00 N ATOM 1363 CD2 HIS A 91 10.243 -3.391 5.771 1.00 0.00 C ATOM 1364 CE1 HIS A 91 11.898 -4.156 4.609 1.00 0.00 C ATOM 1365 NE2 HIS A 91 11.596 -3.718 5.815 1.00 0.00 N ATOM 0 H HIS A 91 6.498 -2.401 1.740 1.00 0.00 H new ATOM 0 HA HIS A 91 9.026 -1.733 2.869 1.00 0.00 H new ATOM 0 HB2 HIS A 91 7.744 -3.038 4.740 1.00 0.00 H new ATOM 0 HB3 HIS A 91 7.974 -4.441 3.716 1.00 0.00 H new ATOM 0 HD2 HIS A 91 9.666 -2.999 6.596 1.00 0.00 H new ATOM 0 HE1 HIS A 91 12.880 -4.494 4.311 1.00 0.00 H new ATOM 0 HE2 HIS A 91 12.223 -3.636 6.615 1.00 0.00 H new ATOM 1373 N SER A 92 10.006 -3.104 1.051 1.00 0.00 N ATOM 1374 CA SER A 92 10.548 -3.790 -0.116 1.00 0.00 C ATOM 1375 C SER A 92 9.701 -3.507 -1.354 1.00 0.00 C ATOM 1376 O SER A 92 9.533 -4.373 -2.213 1.00 0.00 O ATOM 1377 CB SER A 92 10.616 -5.297 0.138 1.00 0.00 C ATOM 1378 OG SER A 92 11.827 -5.843 -0.353 1.00 0.00 O ATOM 0 H SER A 92 10.642 -2.430 1.477 1.00 0.00 H new ATOM 0 HA SER A 92 11.556 -3.414 -0.293 1.00 0.00 H new ATOM 0 HB2 SER A 92 10.532 -5.493 1.207 1.00 0.00 H new ATOM 0 HB3 SER A 92 9.770 -5.788 -0.343 1.00 0.00 H new ATOM 0 HG SER A 92 11.846 -6.807 -0.177 1.00 0.00 H new ATOM 1384 N THR A 93 9.172 -2.292 -1.438 1.00 0.00 N ATOM 1385 CA THR A 93 8.343 -1.895 -2.570 1.00 0.00 C ATOM 1386 C THR A 93 9.086 -0.914 -3.471 1.00 0.00 C ATOM 1387 O THR A 93 9.919 -0.137 -3.004 1.00 0.00 O ATOM 1388 CB THR A 93 7.038 -1.266 -2.079 1.00 0.00 C ATOM 1389 OG1 THR A 93 6.344 -2.157 -1.223 1.00 0.00 O ATOM 1390 CG2 THR A 93 6.100 -0.883 -3.202 1.00 0.00 C ATOM 0 H THR A 93 9.302 -1.564 -0.735 1.00 0.00 H new ATOM 0 HA THR A 93 8.112 -2.789 -3.149 1.00 0.00 H new ATOM 0 HB THR A 93 7.334 -0.360 -1.550 1.00 0.00 H new ATOM 0 HG1 THR A 93 5.628 -2.601 -1.724 1.00 0.00 H new ATOM 0 HG21 THR A 93 5.194 -0.443 -2.785 1.00 0.00 H new ATOM 0 HG22 THR A 93 6.589 -0.159 -3.853 1.00 0.00 H new ATOM 0 HG23 THR A 93 5.840 -1.771 -3.778 1.00 0.00 H new ATOM 1398 N LYS A 94 8.781 -0.956 -4.764 1.00 0.00 N ATOM 1399 CA LYS A 94 9.422 -0.069 -5.728 1.00 0.00 C ATOM 1400 C LYS A 94 8.561 0.092 -6.978 1.00 0.00 C ATOM 1401 O LYS A 94 8.044 -0.886 -7.518 1.00 0.00 O ATOM 1402 CB LYS A 94 10.801 -0.610 -6.112 1.00 0.00 C ATOM 1403 CG LYS A 94 10.772 -2.038 -6.630 1.00 0.00 C ATOM 1404 CD LYS A 94 12.053 -2.389 -7.371 1.00 0.00 C ATOM 1405 CE LYS A 94 12.555 -3.774 -6.993 1.00 0.00 C ATOM 1406 NZ LYS A 94 13.121 -4.498 -8.164 1.00 0.00 N ATOM 0 H LYS A 94 8.095 -1.594 -5.168 1.00 0.00 H new ATOM 0 HA LYS A 94 9.539 0.909 -5.261 1.00 0.00 H new ATOM 0 HB2 LYS A 94 11.236 0.036 -6.875 1.00 0.00 H new ATOM 0 HB3 LYS A 94 11.456 -0.561 -5.242 1.00 0.00 H new ATOM 0 HG2 LYS A 94 10.633 -2.726 -5.796 1.00 0.00 H new ATOM 0 HG3 LYS A 94 9.918 -2.167 -7.296 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.876 -2.346 -8.446 1.00 0.00 H new ATOM 0 HD3 LYS A 94 12.820 -1.649 -7.144 1.00 0.00 H new ATOM 0 HE2 LYS A 94 13.317 -3.685 -6.218 1.00 0.00 H new ATOM 0 HE3 LYS A 94 11.735 -4.354 -6.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.452 -5.437 -7.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 12.387 -4.606 -8.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 13.920 -3.958 -8.553 1.00 0.00 H new ATOM 1420 N ASP A 95 8.413 1.333 -7.432 1.00 0.00 N ATOM 1421 CA ASP A 95 7.615 1.622 -8.619 1.00 0.00 C ATOM 1422 C ASP A 95 6.175 1.154 -8.436 1.00 0.00 C ATOM 1423 O ASP A 95 5.510 0.769 -9.396 1.00 0.00 O ATOM 1424 CB ASP A 95 8.232 0.952 -9.849 1.00 0.00 C ATOM 1425 CG ASP A 95 9.140 1.888 -10.623 1.00 0.00 C ATOM 1426 OD1 ASP A 95 8.799 3.083 -10.741 1.00 0.00 O ATOM 1427 OD2 ASP A 95 10.192 1.425 -11.112 1.00 0.00 O ATOM 0 H ASP A 95 8.835 2.153 -6.997 1.00 0.00 H new ATOM 0 HA ASP A 95 7.608 2.702 -8.768 1.00 0.00 H new ATOM 0 HB2 ASP A 95 8.800 0.076 -9.536 1.00 0.00 H new ATOM 0 HB3 ASP A 95 7.436 0.598 -10.504 1.00 0.00 H new ATOM 1432 N THR A 96 5.702 1.188 -7.194 1.00 0.00 N ATOM 1433 CA THR A 96 4.340 0.765 -6.885 1.00 0.00 C ATOM 1434 C THR A 96 3.484 1.954 -6.460 1.00 0.00 C ATOM 1435 O THR A 96 3.569 2.418 -5.323 1.00 0.00 O ATOM 1436 CB THR A 96 4.351 -0.289 -5.777 1.00 0.00 C ATOM 1437 OG1 THR A 96 5.370 -1.247 -6.006 1.00 0.00 O ATOM 1438 CG2 THR A 96 3.042 -1.034 -5.646 1.00 0.00 C ATOM 0 H THR A 96 6.240 1.503 -6.387 1.00 0.00 H new ATOM 0 HA THR A 96 3.908 0.332 -7.787 1.00 0.00 H new ATOM 0 HB THR A 96 4.529 0.264 -4.855 1.00 0.00 H new ATOM 0 HG1 THR A 96 6.247 -0.831 -5.869 1.00 0.00 H new ATOM 0 HG21 THR A 96 3.119 -1.766 -4.842 1.00 0.00 H new ATOM 0 HG22 THR A 96 2.243 -0.328 -5.419 1.00 0.00 H new ATOM 0 HG23 THR A 96 2.819 -1.545 -6.582 1.00 0.00 H new ATOM 1446 N ARG A 97 2.659 2.441 -7.380 1.00 0.00 N ATOM 1447 CA ARG A 97 1.786 3.575 -7.100 1.00 0.00 C ATOM 1448 C ARG A 97 0.716 3.194 -6.082 1.00 0.00 C ATOM 1449 O ARG A 97 0.121 2.120 -6.165 1.00 0.00 O ATOM 1450 CB ARG A 97 1.126 4.071 -8.388 1.00 0.00 C ATOM 1451 CG ARG A 97 2.113 4.341 -9.512 1.00 0.00 C ATOM 1452 CD ARG A 97 1.397 4.623 -10.823 1.00 0.00 C ATOM 1453 NE ARG A 97 2.084 4.018 -11.963 1.00 0.00 N ATOM 1454 CZ ARG A 97 1.660 4.116 -13.220 1.00 0.00 C ATOM 1455 NH1 ARG A 97 0.554 4.791 -13.505 1.00 0.00 N ATOM 1456 NH2 ARG A 97 2.345 3.535 -14.198 1.00 0.00 N ATOM 0 H ARG A 97 2.576 2.068 -8.326 1.00 0.00 H new ATOM 0 HA ARG A 97 2.395 4.377 -6.682 1.00 0.00 H new ATOM 0 HB2 ARG A 97 0.400 3.330 -8.723 1.00 0.00 H new ATOM 0 HB3 ARG A 97 0.573 4.985 -8.174 1.00 0.00 H new ATOM 0 HG2 ARG A 97 2.742 5.191 -9.249 1.00 0.00 H new ATOM 0 HG3 ARG A 97 2.773 3.482 -9.633 1.00 0.00 H new ATOM 0 HD2 ARG A 97 0.378 4.240 -10.769 1.00 0.00 H new ATOM 0 HD3 ARG A 97 1.326 5.700 -10.973 1.00 0.00 H new ATOM 0 HE ARG A 97 2.938 3.490 -11.784 1.00 0.00 H new ATOM 0 HH11 ARG A 97 0.023 5.239 -12.758 1.00 0.00 H new ATOM 0 HH12 ARG A 97 0.235 4.862 -14.471 1.00 0.00 H new ATOM 0 HH21 ARG A 97 3.196 3.014 -13.985 1.00 0.00 H new ATOM 0 HH22 ARG A 97 2.020 3.610 -15.162 1.00 0.00 H new ATOM 1470 N ILE A 98 0.478 4.081 -5.121 1.00 0.00 N ATOM 1471 CA ILE A 98 -0.521 3.834 -4.087 1.00 0.00 C ATOM 1472 C ILE A 98 -1.372 5.074 -3.838 1.00 0.00 C ATOM 1473 O ILE A 98 -0.937 6.015 -3.174 1.00 0.00 O ATOM 1474 CB ILE A 98 0.136 3.401 -2.762 1.00 0.00 C ATOM 1475 CG1 ILE A 98 1.208 2.339 -3.019 1.00 0.00 C ATOM 1476 CG2 ILE A 98 -0.916 2.878 -1.795 1.00 0.00 C ATOM 1477 CD1 ILE A 98 2.094 2.072 -1.822 1.00 0.00 C ATOM 0 H ILE A 98 0.962 4.975 -5.037 1.00 0.00 H new ATOM 0 HA ILE A 98 -1.157 3.026 -4.449 1.00 0.00 H new ATOM 0 HB ILE A 98 0.615 4.270 -2.311 1.00 0.00 H new ATOM 0 HG12 ILE A 98 0.723 1.409 -3.316 1.00 0.00 H new ATOM 0 HG13 ILE A 98 1.829 2.657 -3.857 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -0.436 2.576 -0.864 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -1.644 3.663 -1.590 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -1.422 2.020 -2.237 1.00 0.00 H new ATOM 0 HD11 ILE A 98 2.830 1.309 -2.077 1.00 0.00 H new ATOM 0 HD12 ILE A 98 2.607 2.990 -1.537 1.00 0.00 H new ATOM 0 HD13 ILE A 98 1.484 1.724 -0.988 1.00 0.00 H new ATOM 1489 N PHE A 99 -2.588 5.067 -4.376 1.00 0.00 N ATOM 1490 CA PHE A 99 -3.502 6.191 -4.212 1.00 0.00 C ATOM 1491 C PHE A 99 -4.481 5.934 -3.070 1.00 0.00 C ATOM 1492 O PHE A 99 -5.394 5.119 -3.194 1.00 0.00 O ATOM 1493 CB PHE A 99 -4.270 6.444 -5.510 1.00 0.00 C ATOM 1494 CG PHE A 99 -3.387 6.817 -6.667 1.00 0.00 C ATOM 1495 CD1 PHE A 99 -2.625 5.855 -7.312 1.00 0.00 C ATOM 1496 CD2 PHE A 99 -3.319 8.128 -7.110 1.00 0.00 C ATOM 1497 CE1 PHE A 99 -1.813 6.194 -8.377 1.00 0.00 C ATOM 1498 CE2 PHE A 99 -2.507 8.473 -8.174 1.00 0.00 C ATOM 1499 CZ PHE A 99 -1.754 7.505 -8.809 1.00 0.00 C ATOM 0 H PHE A 99 -2.962 4.296 -4.929 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.912 7.075 -3.969 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.835 5.549 -5.769 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -4.994 7.241 -5.344 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -2.667 4.829 -6.978 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.907 8.889 -6.618 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -1.225 5.435 -8.871 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -2.461 9.499 -8.509 1.00 0.00 H new ATOM 0 HZ PHE A 99 -1.120 7.772 -9.642 1.00 0.00 H new ATOM 1509 N LEU A 100 -4.284 6.636 -1.959 1.00 0.00 N ATOM 1510 CA LEU A 100 -5.149 6.484 -0.795 1.00 0.00 C ATOM 1511 C LEU A 100 -5.209 7.777 0.012 1.00 0.00 C ATOM 1512 O LEU A 100 -4.577 8.772 -0.344 1.00 0.00 O ATOM 1513 CB LEU A 100 -4.653 5.338 0.089 1.00 0.00 C ATOM 1514 CG LEU A 100 -3.340 5.608 0.827 1.00 0.00 C ATOM 1515 CD1 LEU A 100 -3.062 4.509 1.841 1.00 0.00 C ATOM 1516 CD2 LEU A 100 -2.190 5.729 -0.162 1.00 0.00 C ATOM 0 H LEU A 100 -3.533 7.316 -1.840 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.154 6.252 -1.148 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.424 5.107 0.824 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -4.527 4.450 -0.531 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.433 6.552 1.363 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.124 4.718 2.356 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.874 4.470 2.567 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -2.988 3.550 1.328 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.263 5.921 0.379 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -2.096 4.801 -0.725 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.386 6.552 -0.849 1.00 0.00 H new ATOM 1528 N GLN A 101 -5.971 7.754 1.100 1.00 0.00 N ATOM 1529 CA GLN A 101 -6.113 8.925 1.959 1.00 0.00 C ATOM 1530 C GLN A 101 -5.834 8.567 3.414 1.00 0.00 C ATOM 1531 O GLN A 101 -6.736 8.160 4.148 1.00 0.00 O ATOM 1532 CB GLN A 101 -7.519 9.513 1.825 1.00 0.00 C ATOM 1533 CG GLN A 101 -7.689 10.847 2.535 1.00 0.00 C ATOM 1534 CD GLN A 101 -8.914 11.604 2.065 1.00 0.00 C ATOM 1535 OE1 GLN A 101 -9.076 11.869 0.873 1.00 0.00 O ATOM 1536 NE2 GLN A 101 -9.787 11.959 3.002 1.00 0.00 N ATOM 0 H GLN A 101 -6.500 6.938 1.408 1.00 0.00 H new ATOM 0 HA GLN A 101 -5.384 9.670 1.641 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -7.751 9.641 0.768 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -8.241 8.802 2.226 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -7.762 10.676 3.609 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -6.802 11.459 2.369 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -9.613 11.719 3.978 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -10.631 12.471 2.745 1.00 0.00 H new ATOM 1545 N VAL A 102 -4.580 8.720 3.826 1.00 0.00 N ATOM 1546 CA VAL A 102 -4.182 8.412 5.194 1.00 0.00 C ATOM 1547 C VAL A 102 -4.622 9.510 6.156 1.00 0.00 C ATOM 1548 O VAL A 102 -4.294 10.682 5.969 1.00 0.00 O ATOM 1549 CB VAL A 102 -2.657 8.228 5.308 1.00 0.00 C ATOM 1550 CG1 VAL A 102 -2.228 6.913 4.673 1.00 0.00 C ATOM 1551 CG2 VAL A 102 -1.927 9.399 4.668 1.00 0.00 C ATOM 0 H VAL A 102 -3.822 9.056 3.232 1.00 0.00 H new ATOM 0 HA VAL A 102 -4.675 7.478 5.463 1.00 0.00 H new ATOM 0 HB VAL A 102 -2.392 8.199 6.365 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -1.148 6.801 4.763 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -2.723 6.085 5.181 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -2.506 6.910 3.619 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.851 9.250 4.759 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -2.197 9.464 3.614 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -2.209 10.323 5.172 1.00 0.00 H new ATOM 1561 N THR A 103 -5.367 9.125 7.186 1.00 0.00 N ATOM 1562 CA THR A 103 -5.853 10.076 8.179 1.00 0.00 C ATOM 1563 C THR A 103 -4.789 10.351 9.236 1.00 0.00 C ATOM 1564 O THR A 103 -4.698 11.457 9.768 1.00 0.00 O ATOM 1565 CB THR A 103 -7.125 9.549 8.843 1.00 0.00 C ATOM 1566 OG1 THR A 103 -7.081 8.138 8.964 1.00 0.00 O ATOM 1567 CG2 THR A 103 -8.387 9.906 8.089 1.00 0.00 C ATOM 0 H THR A 103 -5.648 8.159 7.355 1.00 0.00 H new ATOM 0 HA THR A 103 -6.081 11.011 7.667 1.00 0.00 H new ATOM 0 HB THR A 103 -7.158 10.028 9.821 1.00 0.00 H new ATOM 0 HG1 THR A 103 -7.471 7.729 8.163 1.00 0.00 H new ATOM 0 HG21 THR A 103 -9.252 9.501 8.615 1.00 0.00 H new ATOM 0 HG22 THR A 103 -8.477 10.990 8.023 1.00 0.00 H new ATOM 0 HG23 THR A 103 -8.343 9.484 7.085 1.00 0.00 H new ATOM 1575 N SER A 104 -3.986 9.336 9.536 1.00 0.00 N ATOM 1576 CA SER A 104 -2.927 9.467 10.530 1.00 0.00 C ATOM 1577 C SER A 104 -1.577 9.704 9.857 1.00 0.00 C ATOM 1578 O SER A 104 -1.051 10.816 9.874 1.00 0.00 O ATOM 1579 CB SER A 104 -2.864 8.214 11.406 1.00 0.00 C ATOM 1580 OG SER A 104 -3.152 8.522 12.759 1.00 0.00 O ATOM 0 H SER A 104 -4.048 8.414 9.105 1.00 0.00 H new ATOM 0 HA SER A 104 -3.155 10.328 11.158 1.00 0.00 H new ATOM 0 HB2 SER A 104 -3.575 7.474 11.039 1.00 0.00 H new ATOM 0 HB3 SER A 104 -1.873 7.766 11.335 1.00 0.00 H new ATOM 0 HG SER A 104 -3.107 7.704 13.297 1.00 0.00 H new ATOM 1586 N ARG A 105 -1.024 8.649 9.268 1.00 0.00 N ATOM 1587 CA ARG A 105 0.265 8.743 8.590 1.00 0.00 C ATOM 1588 C ARG A 105 0.634 7.413 7.940 1.00 0.00 C ATOM 1589 O ARG A 105 -0.034 6.401 8.150 1.00 0.00 O ATOM 1590 CB ARG A 105 1.355 9.163 9.576 1.00 0.00 C ATOM 1591 CG ARG A 105 1.474 8.243 10.781 1.00 0.00 C ATOM 1592 CD ARG A 105 2.642 7.280 10.634 1.00 0.00 C ATOM 1593 NE ARG A 105 3.338 7.068 11.902 1.00 0.00 N ATOM 1594 CZ ARG A 105 2.899 6.257 12.861 1.00 0.00 C ATOM 1595 NH1 ARG A 105 1.767 5.580 12.702 1.00 0.00 N ATOM 1596 NH2 ARG A 105 3.592 6.121 13.982 1.00 0.00 N ATOM 0 H ARG A 105 -1.447 7.721 9.246 1.00 0.00 H new ATOM 0 HA ARG A 105 0.183 9.499 7.809 1.00 0.00 H new ATOM 0 HB2 ARG A 105 2.312 9.192 9.056 1.00 0.00 H new ATOM 0 HB3 ARG A 105 1.150 10.176 9.922 1.00 0.00 H new ATOM 0 HG2 ARG A 105 1.604 8.839 11.684 1.00 0.00 H new ATOM 0 HG3 ARG A 105 0.549 7.679 10.902 1.00 0.00 H new ATOM 0 HD2 ARG A 105 2.279 6.325 10.255 1.00 0.00 H new ATOM 0 HD3 ARG A 105 3.343 7.670 9.896 1.00 0.00 H new ATOM 0 HE ARG A 105 4.211 7.571 12.061 1.00 0.00 H new ATOM 0 HH11 ARG A 105 1.229 5.680 11.841 1.00 0.00 H new ATOM 0 HH12 ARG A 105 1.436 4.960 13.441 1.00 0.00 H new ATOM 0 HH21 ARG A 105 4.462 6.638 14.110 1.00 0.00 H new ATOM 0 HH22 ARG A 105 3.256 5.499 14.717 1.00 0.00 H new ATOM 1610 N ALA A 106 1.704 7.424 7.151 1.00 0.00 N ATOM 1611 CA ALA A 106 2.164 6.219 6.470 1.00 0.00 C ATOM 1612 C ALA A 106 3.596 5.878 6.866 1.00 0.00 C ATOM 1613 O ALA A 106 4.364 6.751 7.268 1.00 0.00 O ATOM 1614 CB ALA A 106 2.059 6.394 4.961 1.00 0.00 C ATOM 0 H ALA A 106 2.268 8.254 6.968 1.00 0.00 H new ATOM 0 HA ALA A 106 1.524 5.391 6.775 1.00 0.00 H new ATOM 0 HB1 ALA A 106 2.405 5.488 4.465 1.00 0.00 H new ATOM 0 HB2 ALA A 106 1.021 6.583 4.688 1.00 0.00 H new ATOM 0 HB3 ALA A 106 2.676 7.237 4.649 1.00 0.00 H new ATOM 1620 N ILE A 107 3.948 4.600 6.752 1.00 0.00 N ATOM 1621 CA ILE A 107 5.288 4.144 7.099 1.00 0.00 C ATOM 1622 C ILE A 107 5.940 3.415 5.930 1.00 0.00 C ATOM 1623 O ILE A 107 5.299 2.616 5.247 1.00 0.00 O ATOM 1624 CB ILE A 107 5.263 3.208 8.323 1.00 0.00 C ATOM 1625 CG1 ILE A 107 4.435 3.828 9.450 1.00 0.00 C ATOM 1626 CG2 ILE A 107 6.679 2.918 8.797 1.00 0.00 C ATOM 1627 CD1 ILE A 107 4.999 5.133 9.968 1.00 0.00 C ATOM 0 H ILE A 107 3.324 3.864 6.422 1.00 0.00 H new ATOM 0 HA ILE A 107 5.872 5.032 7.341 1.00 0.00 H new ATOM 0 HB ILE A 107 4.798 2.266 8.032 1.00 0.00 H new ATOM 0 HG12 ILE A 107 3.419 3.997 9.093 1.00 0.00 H new ATOM 0 HG13 ILE A 107 4.369 3.118 10.274 1.00 0.00 H new ATOM 0 HG21 ILE A 107 6.645 2.256 9.662 1.00 0.00 H new ATOM 0 HG22 ILE A 107 7.240 2.439 7.995 1.00 0.00 H new ATOM 0 HG23 ILE A 107 7.168 3.852 9.074 1.00 0.00 H new ATOM 0 HD11 ILE A 107 4.361 5.514 10.765 1.00 0.00 H new ATOM 0 HD12 ILE A 107 6.004 4.966 10.356 1.00 0.00 H new ATOM 0 HD13 ILE A 107 5.039 5.860 9.156 1.00 0.00 H new ATOM 1639 N VAL A 108 7.220 3.694 5.705 1.00 0.00 N ATOM 1640 CA VAL A 108 7.962 3.065 4.619 1.00 0.00 C ATOM 1641 C VAL A 108 9.343 2.616 5.084 1.00 0.00 C ATOM 1642 O VAL A 108 9.984 3.287 5.892 1.00 0.00 O ATOM 1643 CB VAL A 108 8.121 4.018 3.420 1.00 0.00 C ATOM 1644 CG1 VAL A 108 6.799 4.179 2.687 1.00 0.00 C ATOM 1645 CG2 VAL A 108 8.654 5.368 3.878 1.00 0.00 C ATOM 0 H VAL A 108 7.765 4.353 6.261 1.00 0.00 H new ATOM 0 HA VAL A 108 7.386 2.194 4.307 1.00 0.00 H new ATOM 0 HB VAL A 108 8.843 3.585 2.728 1.00 0.00 H new ATOM 0 HG11 VAL A 108 6.931 4.856 1.843 1.00 0.00 H new ATOM 0 HG12 VAL A 108 6.464 3.207 2.324 1.00 0.00 H new ATOM 0 HG13 VAL A 108 6.053 4.589 3.368 1.00 0.00 H new ATOM 0 HG21 VAL A 108 8.760 6.028 3.017 1.00 0.00 H new ATOM 0 HG22 VAL A 108 7.959 5.811 4.592 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.625 5.233 4.354 1.00 0.00 H new ATOM 1655 N GLU A 109 9.795 1.477 4.570 1.00 0.00 N ATOM 1656 CA GLU A 109 11.100 0.940 4.934 1.00 0.00 C ATOM 1657 C GLU A 109 11.695 0.129 3.787 1.00 0.00 C ATOM 1658 O GLU A 109 11.055 -0.781 3.260 1.00 0.00 O ATOM 1659 CB GLU A 109 10.984 0.067 6.185 1.00 0.00 C ATOM 1660 CG GLU A 109 12.179 0.177 7.115 1.00 0.00 C ATOM 1661 CD GLU A 109 12.041 -0.696 8.347 1.00 0.00 C ATOM 1662 OE1 GLU A 109 12.247 -1.923 8.233 1.00 0.00 O ATOM 1663 OE2 GLU A 109 11.726 -0.153 9.428 1.00 0.00 O ATOM 0 H GLU A 109 9.277 0.908 3.900 1.00 0.00 H new ATOM 0 HA GLU A 109 11.764 1.778 5.144 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.083 0.346 6.731 1.00 0.00 H new ATOM 0 HB3 GLU A 109 10.864 -0.973 5.882 1.00 0.00 H new ATOM 0 HG2 GLU A 109 13.083 -0.104 6.574 1.00 0.00 H new ATOM 0 HG3 GLU A 109 12.301 1.216 7.422 1.00 0.00 H new ATOM 1670 N ASP A 110 12.923 0.466 3.406 1.00 0.00 N ATOM 1671 CA ASP A 110 13.605 -0.230 2.321 1.00 0.00 C ATOM 1672 C ASP A 110 12.822 -0.107 1.017 1.00 0.00 C ATOM 1673 O ASP A 110 12.765 -1.047 0.224 1.00 0.00 O ATOM 1674 CB ASP A 110 13.800 -1.705 2.679 1.00 0.00 C ATOM 1675 CG ASP A 110 15.220 -2.177 2.430 1.00 0.00 C ATOM 1676 OD1 ASP A 110 16.074 -1.982 3.319 1.00 0.00 O ATOM 1677 OD2 ASP A 110 15.476 -2.741 1.345 1.00 0.00 O ATOM 0 H ASP A 110 13.466 1.217 3.833 1.00 0.00 H new ATOM 0 HA ASP A 110 14.581 0.234 2.180 1.00 0.00 H new ATOM 0 HB2 ASP A 110 13.548 -1.858 3.728 1.00 0.00 H new ATOM 0 HB3 ASP A 110 13.110 -2.313 2.094 1.00 0.00 H new ATOM 1682 N CYS A 111 12.221 1.058 0.802 1.00 0.00 N ATOM 1683 CA CYS A 111 11.441 1.305 -0.406 1.00 0.00 C ATOM 1684 C CYS A 111 12.076 2.406 -1.249 1.00 0.00 C ATOM 1685 O CYS A 111 12.733 3.304 -0.721 1.00 0.00 O ATOM 1686 CB CYS A 111 10.005 1.691 -0.042 1.00 0.00 C ATOM 1687 SG CYS A 111 9.158 0.481 1.002 1.00 0.00 S ATOM 0 H CYS A 111 12.259 1.846 1.448 1.00 0.00 H new ATOM 0 HA CYS A 111 11.426 0.386 -0.992 1.00 0.00 H new ATOM 0 HB2 CYS A 111 10.017 2.652 0.471 1.00 0.00 H new ATOM 0 HB3 CYS A 111 9.433 1.827 -0.960 1.00 0.00 H new ATOM 0 HG CYS A 111 9.999 -0.016 1.860 1.00 0.00 H new ATOM 1693 N SER A 112 11.877 2.330 -2.559 1.00 0.00 N ATOM 1694 CA SER A 112 12.431 3.320 -3.477 1.00 0.00 C ATOM 1695 C SER A 112 11.516 3.518 -4.680 1.00 0.00 C ATOM 1696 O SER A 112 11.067 2.551 -5.297 1.00 0.00 O ATOM 1697 CB SER A 112 13.823 2.891 -3.944 1.00 0.00 C ATOM 1698 OG SER A 112 14.821 3.329 -3.040 1.00 0.00 O ATOM 0 H SER A 112 11.336 1.593 -3.011 1.00 0.00 H new ATOM 0 HA SER A 112 12.511 4.268 -2.945 1.00 0.00 H new ATOM 0 HB2 SER A 112 13.861 1.805 -4.035 1.00 0.00 H new ATOM 0 HB3 SER A 112 14.020 3.301 -4.935 1.00 0.00 H new ATOM 0 HG SER A 112 14.437 3.409 -2.142 1.00 0.00 H new ATOM 1704 N GLY A 113 11.243 4.777 -5.009 1.00 0.00 N ATOM 1705 CA GLY A 113 10.382 5.077 -6.139 1.00 0.00 C ATOM 1706 C GLY A 113 8.912 4.919 -5.805 1.00 0.00 C ATOM 1707 O GLY A 113 8.100 4.609 -6.677 1.00 0.00 O ATOM 0 H GLY A 113 11.602 5.594 -4.514 1.00 0.00 H new ATOM 0 HA2 GLY A 113 10.568 6.098 -6.473 1.00 0.00 H new ATOM 0 HA3 GLY A 113 10.636 4.419 -6.970 1.00 0.00 H new ATOM 1711 N ILE A 114 8.567 5.134 -4.540 1.00 0.00 N ATOM 1712 CA ILE A 114 7.186 5.014 -4.092 1.00 0.00 C ATOM 1713 C ILE A 114 6.400 6.288 -4.385 1.00 0.00 C ATOM 1714 O ILE A 114 6.972 7.376 -4.466 1.00 0.00 O ATOM 1715 CB ILE A 114 7.105 4.712 -2.584 1.00 0.00 C ATOM 1716 CG1 ILE A 114 8.049 3.564 -2.220 1.00 0.00 C ATOM 1717 CG2 ILE A 114 5.676 4.376 -2.187 1.00 0.00 C ATOM 1718 CD1 ILE A 114 7.674 2.245 -2.862 1.00 0.00 C ATOM 0 H ILE A 114 9.227 5.393 -3.806 1.00 0.00 H new ATOM 0 HA ILE A 114 6.748 4.183 -4.645 1.00 0.00 H new ATOM 0 HB ILE A 114 7.415 5.600 -2.034 1.00 0.00 H new ATOM 0 HG12 ILE A 114 9.063 3.829 -2.520 1.00 0.00 H new ATOM 0 HG13 ILE A 114 8.058 3.442 -1.137 1.00 0.00 H new ATOM 0 HG21 ILE A 114 5.635 4.165 -1.118 1.00 0.00 H new ATOM 0 HG22 ILE A 114 5.027 5.221 -2.415 1.00 0.00 H new ATOM 0 HG23 ILE A 114 5.340 3.500 -2.743 1.00 0.00 H new ATOM 0 HD11 ILE A 114 8.386 1.478 -2.560 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.673 1.957 -2.543 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.693 2.350 -3.947 1.00 0.00 H new ATOM 1730 N GLN A 115 5.089 6.146 -4.544 1.00 0.00 N ATOM 1731 CA GLN A 115 4.225 7.286 -4.829 1.00 0.00 C ATOM 1732 C GLN A 115 3.047 7.330 -3.862 1.00 0.00 C ATOM 1733 O GLN A 115 2.429 6.305 -3.575 1.00 0.00 O ATOM 1734 CB GLN A 115 3.716 7.221 -6.270 1.00 0.00 C ATOM 1735 CG GLN A 115 4.559 8.021 -7.250 1.00 0.00 C ATOM 1736 CD GLN A 115 4.269 7.664 -8.695 1.00 0.00 C ATOM 1737 OE1 GLN A 115 2.989 7.602 -9.045 1.00 0.00 O flip ATOM 1738 NE2 GLN A 115 5.185 7.447 -9.488 1.00 0.00 N flip ATOM 0 H GLN A 115 4.601 5.253 -4.480 1.00 0.00 H new ATOM 0 HA GLN A 115 4.812 8.196 -4.700 1.00 0.00 H new ATOM 0 HB2 GLN A 115 3.691 6.180 -6.591 1.00 0.00 H new ATOM 0 HB3 GLN A 115 2.690 7.589 -6.301 1.00 0.00 H new ATOM 0 HG2 GLN A 115 4.375 9.085 -7.098 1.00 0.00 H new ATOM 0 HG3 GLN A 115 5.615 7.848 -7.042 1.00 0.00 H new ATOM 0 HE21 GLN A 115 6.154 7.506 -9.176 1.00 0.00 H new ATOM 0 HE22 GLN A 115 4.975 7.208 -10.457 1.00 0.00 H new ATOM 1747 N PHE A 116 2.741 8.523 -3.362 1.00 0.00 N ATOM 1748 CA PHE A 116 1.636 8.701 -2.428 1.00 0.00 C ATOM 1749 C PHE A 116 0.667 9.767 -2.928 1.00 0.00 C ATOM 1750 O PHE A 116 0.962 10.961 -2.878 1.00 0.00 O ATOM 1751 CB PHE A 116 2.167 9.086 -1.046 1.00 0.00 C ATOM 1752 CG PHE A 116 2.834 7.952 -0.321 1.00 0.00 C ATOM 1753 CD1 PHE A 116 2.086 7.047 0.414 1.00 0.00 C ATOM 1754 CD2 PHE A 116 4.210 7.794 -0.373 1.00 0.00 C ATOM 1755 CE1 PHE A 116 2.698 6.003 1.082 1.00 0.00 C ATOM 1756 CE2 PHE A 116 4.827 6.751 0.293 1.00 0.00 C ATOM 1757 CZ PHE A 116 4.070 5.855 1.022 1.00 0.00 C ATOM 0 H PHE A 116 3.244 9.381 -3.589 1.00 0.00 H new ATOM 0 HA PHE A 116 1.100 7.755 -2.354 1.00 0.00 H new ATOM 0 HB2 PHE A 116 2.878 9.905 -1.154 1.00 0.00 H new ATOM 0 HB3 PHE A 116 1.341 9.458 -0.440 1.00 0.00 H new ATOM 0 HD1 PHE A 116 1.013 7.158 0.466 1.00 0.00 H new ATOM 0 HD2 PHE A 116 4.807 8.493 -0.940 1.00 0.00 H new ATOM 0 HE1 PHE A 116 2.104 5.303 1.651 1.00 0.00 H new ATOM 0 HE2 PHE A 116 5.900 6.637 0.243 1.00 0.00 H new ATOM 0 HZ PHE A 116 4.550 5.040 1.544 1.00 0.00 H new ATOM 1767 N ALA A 117 -0.491 9.328 -3.411 1.00 0.00 N ATOM 1768 CA ALA A 117 -1.504 10.244 -3.920 1.00 0.00 C ATOM 1769 C ALA A 117 -2.819 10.087 -3.163 1.00 0.00 C ATOM 1770 O ALA A 117 -3.145 8.998 -2.688 1.00 0.00 O ATOM 1771 CB ALA A 117 -1.719 10.015 -5.409 1.00 0.00 C ATOM 0 H ALA A 117 -0.751 8.343 -3.460 1.00 0.00 H new ATOM 0 HA ALA A 117 -1.148 11.263 -3.766 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -2.478 10.705 -5.777 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -0.784 10.186 -5.942 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -2.050 8.990 -5.575 1.00 0.00 H new ATOM 1777 N PRO A 118 -3.596 11.177 -3.038 1.00 0.00 N ATOM 1778 CA PRO A 118 -4.881 11.154 -2.333 1.00 0.00 C ATOM 1779 C PRO A 118 -5.806 10.057 -2.850 1.00 0.00 C ATOM 1780 O PRO A 118 -5.585 9.502 -3.926 1.00 0.00 O ATOM 1781 CB PRO A 118 -5.475 12.535 -2.626 1.00 0.00 C ATOM 1782 CG PRO A 118 -4.298 13.401 -2.912 1.00 0.00 C ATOM 1783 CD PRO A 118 -3.282 12.514 -3.574 1.00 0.00 C ATOM 0 HA PRO A 118 -4.757 10.946 -1.270 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -6.157 12.500 -3.476 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -6.045 12.909 -1.775 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -4.573 14.231 -3.562 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -3.899 13.833 -1.994 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -3.370 12.543 -4.660 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -2.264 12.816 -3.329 1.00 0.00 H new ATOM 1791 N TYR A 119 -6.842 9.750 -2.076 1.00 0.00 N ATOM 1792 CA TYR A 119 -7.800 8.718 -2.457 1.00 0.00 C ATOM 1793 C TYR A 119 -8.901 9.299 -3.338 1.00 0.00 C ATOM 1794 O TYR A 119 -9.779 10.018 -2.860 1.00 0.00 O ATOM 1795 CB TYR A 119 -8.414 8.078 -1.211 1.00 0.00 C ATOM 1796 CG TYR A 119 -9.378 6.955 -1.520 1.00 0.00 C ATOM 1797 CD1 TYR A 119 -8.916 5.685 -1.839 1.00 0.00 C ATOM 1798 CD2 TYR A 119 -10.751 7.166 -1.492 1.00 0.00 C ATOM 1799 CE1 TYR A 119 -9.795 4.657 -2.122 1.00 0.00 C ATOM 1800 CE2 TYR A 119 -11.636 6.142 -1.774 1.00 0.00 C ATOM 1801 CZ TYR A 119 -11.153 4.890 -2.088 1.00 0.00 C ATOM 1802 OH TYR A 119 -12.031 3.868 -2.370 1.00 0.00 O ATOM 0 H TYR A 119 -7.040 10.200 -1.182 1.00 0.00 H new ATOM 0 HA TYR A 119 -7.268 7.955 -3.025 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -7.614 7.695 -0.578 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -8.935 8.845 -0.638 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -7.853 5.498 -1.866 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -11.133 8.146 -1.246 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -9.419 3.675 -2.369 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -12.701 6.322 -1.748 1.00 0.00 H new ATOM 0 HH TYR A 119 -11.642 3.015 -2.086 1.00 0.00 H new ATOM 1812 N THR A 120 -8.849 8.983 -4.628 1.00 0.00 N ATOM 1813 CA THR A 120 -9.841 9.473 -5.577 1.00 0.00 C ATOM 1814 C THR A 120 -10.566 8.313 -6.254 1.00 0.00 C ATOM 1815 O THR A 120 -10.003 7.628 -7.107 1.00 0.00 O ATOM 1816 CB THR A 120 -9.175 10.357 -6.632 1.00 0.00 C ATOM 1817 OG1 THR A 120 -10.057 10.597 -7.714 1.00 0.00 O ATOM 1818 CG2 THR A 120 -7.905 9.761 -7.199 1.00 0.00 C ATOM 0 H THR A 120 -8.129 8.389 -5.040 1.00 0.00 H new ATOM 0 HA THR A 120 -10.573 10.064 -5.026 1.00 0.00 H new ATOM 0 HB THR A 120 -8.923 11.283 -6.115 1.00 0.00 H new ATOM 0 HG1 THR A 120 -9.613 11.165 -8.378 1.00 0.00 H new ATOM 0 HG21 THR A 120 -7.485 10.439 -7.941 1.00 0.00 H new ATOM 0 HG22 THR A 120 -7.184 9.610 -6.396 1.00 0.00 H new ATOM 0 HG23 THR A 120 -8.131 8.804 -7.669 1.00 0.00 H new ATOM 1826 N TRP A 121 -11.821 8.100 -5.868 1.00 0.00 N ATOM 1827 CA TRP A 121 -12.623 7.023 -6.437 1.00 0.00 C ATOM 1828 C TRP A 121 -14.112 7.297 -6.249 1.00 0.00 C ATOM 1829 O TRP A 121 -14.577 7.514 -5.130 1.00 0.00 O ATOM 1830 CB TRP A 121 -12.252 5.687 -5.793 1.00 0.00 C ATOM 1831 CG TRP A 121 -12.229 4.547 -6.766 1.00 0.00 C ATOM 1832 CD1 TRP A 121 -11.685 4.548 -8.017 1.00 0.00 C ATOM 1833 CD2 TRP A 121 -12.776 3.238 -6.566 1.00 0.00 C ATOM 1834 NE1 TRP A 121 -11.860 3.321 -8.609 1.00 0.00 N ATOM 1835 CE2 TRP A 121 -12.526 2.499 -7.738 1.00 0.00 C ATOM 1836 CE3 TRP A 121 -13.451 2.619 -5.511 1.00 0.00 C ATOM 1837 CZ2 TRP A 121 -12.928 1.174 -7.882 1.00 0.00 C ATOM 1838 CZ3 TRP A 121 -13.849 1.303 -5.655 1.00 0.00 C ATOM 1839 CH2 TRP A 121 -13.587 0.593 -6.832 1.00 0.00 C ATOM 0 H TRP A 121 -12.304 8.659 -5.164 1.00 0.00 H new ATOM 0 HA TRP A 121 -12.413 6.972 -7.505 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -11.271 5.777 -5.325 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -12.965 5.464 -4.999 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -11.189 5.391 -8.475 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -11.545 3.064 -9.545 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -13.658 3.159 -4.599 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -12.727 0.624 -8.790 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -14.371 0.815 -4.845 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -13.911 -0.434 -6.914 1.00 0.00 H new ATOM 1850 N SER A 122 -14.854 7.285 -7.351 1.00 0.00 N ATOM 1851 CA SER A 122 -16.291 7.532 -7.309 1.00 0.00 C ATOM 1852 C SER A 122 -17.073 6.236 -7.491 1.00 0.00 C ATOM 1853 O SER A 122 -16.580 5.281 -8.092 1.00 0.00 O ATOM 1854 CB SER A 122 -16.688 8.538 -8.390 1.00 0.00 C ATOM 1855 OG SER A 122 -15.960 9.747 -8.256 1.00 0.00 O ATOM 0 H SER A 122 -14.484 7.107 -8.285 1.00 0.00 H new ATOM 0 HA SER A 122 -16.534 7.946 -6.330 1.00 0.00 H new ATOM 0 HB2 SER A 122 -16.506 8.108 -9.375 1.00 0.00 H new ATOM 0 HB3 SER A 122 -17.756 8.744 -8.324 1.00 0.00 H new ATOM 0 HG SER A 122 -16.232 10.372 -8.960 1.00 0.00 H new ATOM 1861 N TYR A 123 -18.296 6.210 -6.969 1.00 0.00 N ATOM 1862 CA TYR A 123 -19.148 5.031 -7.074 1.00 0.00 C ATOM 1863 C TYR A 123 -20.520 5.294 -6.458 1.00 0.00 C ATOM 1864 O TYR A 123 -20.653 6.110 -5.545 1.00 0.00 O ATOM 1865 CB TYR A 123 -18.485 3.835 -6.387 1.00 0.00 C ATOM 1866 CG TYR A 123 -18.579 2.552 -7.181 1.00 0.00 C ATOM 1867 CD1 TYR A 123 -18.089 2.479 -8.479 1.00 0.00 C ATOM 1868 CD2 TYR A 123 -19.157 1.414 -6.632 1.00 0.00 C ATOM 1869 CE1 TYR A 123 -18.173 1.308 -9.208 1.00 0.00 C ATOM 1870 CE2 TYR A 123 -19.244 0.240 -7.355 1.00 0.00 C ATOM 1871 CZ TYR A 123 -18.752 0.192 -8.641 1.00 0.00 C ATOM 1872 OH TYR A 123 -18.836 -0.976 -9.364 1.00 0.00 O ATOM 0 H TYR A 123 -18.719 6.992 -6.469 1.00 0.00 H new ATOM 0 HA TYR A 123 -19.284 4.803 -8.131 1.00 0.00 H new ATOM 0 HB2 TYR A 123 -17.435 4.066 -6.208 1.00 0.00 H new ATOM 0 HB3 TYR A 123 -18.949 3.684 -5.412 1.00 0.00 H new ATOM 0 HD1 TYR A 123 -17.635 3.351 -8.925 1.00 0.00 H new ATOM 0 HD2 TYR A 123 -19.544 1.448 -5.624 1.00 0.00 H new ATOM 0 HE1 TYR A 123 -17.787 1.267 -10.216 1.00 0.00 H new ATOM 0 HE2 TYR A 123 -19.696 -0.636 -6.914 1.00 0.00 H new ATOM 0 HH TYR A 123 -18.091 -1.565 -9.122 1.00 0.00 H new ATOM 1882 N PRO A 124 -21.563 4.603 -6.950 1.00 0.00 N ATOM 1883 CA PRO A 124 -22.929 4.766 -6.443 1.00 0.00 C ATOM 1884 C PRO A 124 -23.004 4.636 -4.925 1.00 0.00 C ATOM 1885 O PRO A 124 -23.894 5.198 -4.286 1.00 0.00 O ATOM 1886 CB PRO A 124 -23.697 3.627 -7.116 1.00 0.00 C ATOM 1887 CG PRO A 124 -22.937 3.346 -8.365 1.00 0.00 C ATOM 1888 CD PRO A 124 -21.492 3.610 -8.039 1.00 0.00 C ATOM 0 HA PRO A 124 -23.329 5.756 -6.663 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -23.744 2.747 -6.474 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -24.725 3.917 -7.334 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -23.082 2.315 -8.687 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -23.276 3.985 -9.180 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -20.979 2.702 -7.722 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -20.950 3.998 -8.902 1.00 0.00 H new ATOM 1896 N GLU A 125 -22.064 3.890 -4.352 1.00 0.00 N ATOM 1897 CA GLU A 125 -22.024 3.687 -2.909 1.00 0.00 C ATOM 1898 C GLU A 125 -20.619 3.924 -2.365 1.00 0.00 C ATOM 1899 O GLU A 125 -20.056 3.074 -1.673 1.00 0.00 O ATOM 1900 CB GLU A 125 -22.490 2.271 -2.560 1.00 0.00 C ATOM 1901 CG GLU A 125 -23.183 2.174 -1.210 1.00 0.00 C ATOM 1902 CD GLU A 125 -22.909 0.859 -0.508 1.00 0.00 C ATOM 1903 OE1 GLU A 125 -21.724 0.555 -0.257 1.00 0.00 O ATOM 1904 OE2 GLU A 125 -23.880 0.132 -0.208 1.00 0.00 O ATOM 0 H GLU A 125 -21.320 3.417 -4.865 1.00 0.00 H new ATOM 0 HA GLU A 125 -22.698 4.408 -2.446 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -23.172 1.920 -3.335 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -21.629 1.602 -2.566 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -22.852 2.996 -0.576 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -24.258 2.291 -1.348 1.00 0.00 H new ATOM 1911 N ILE A 126 -20.057 5.086 -2.682 1.00 0.00 N ATOM 1912 CA ILE A 126 -18.717 5.437 -2.226 1.00 0.00 C ATOM 1913 C ILE A 126 -18.773 6.284 -0.957 1.00 0.00 C ATOM 1914 O ILE A 126 -17.961 6.112 -0.048 1.00 0.00 O ATOM 1915 CB ILE A 126 -17.936 6.202 -3.314 1.00 0.00 C ATOM 1916 CG1 ILE A 126 -16.489 6.436 -2.870 1.00 0.00 C ATOM 1917 CG2 ILE A 126 -18.618 7.523 -3.634 1.00 0.00 C ATOM 1918 CD1 ILE A 126 -15.588 5.241 -3.091 1.00 0.00 C ATOM 0 H ILE A 126 -20.509 5.800 -3.253 1.00 0.00 H new ATOM 0 HA ILE A 126 -18.199 4.503 -2.010 1.00 0.00 H new ATOM 0 HB ILE A 126 -17.924 5.596 -4.220 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -16.085 7.291 -3.412 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -16.480 6.697 -1.812 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -18.052 8.048 -4.404 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -19.629 7.333 -3.994 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -18.662 8.137 -2.734 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -14.579 5.479 -2.754 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -15.968 4.389 -2.527 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -15.567 4.993 -4.152 1.00 0.00 H new ATOM 1930 N ASP A 127 -19.737 7.197 -0.903 1.00 0.00 N ATOM 1931 CA ASP A 127 -19.899 8.070 0.254 1.00 0.00 C ATOM 1932 C ASP A 127 -20.432 7.292 1.452 1.00 0.00 C ATOM 1933 O ASP A 127 -20.017 7.522 2.589 1.00 0.00 O ATOM 1934 CB ASP A 127 -20.843 9.228 -0.083 1.00 0.00 C ATOM 1935 CG ASP A 127 -20.196 10.583 0.129 1.00 0.00 C ATOM 1936 OD1 ASP A 127 -18.976 10.702 -0.113 1.00 0.00 O ATOM 1937 OD2 ASP A 127 -20.908 11.524 0.536 1.00 0.00 O ATOM 0 H ASP A 127 -20.418 7.352 -1.647 1.00 0.00 H new ATOM 0 HA ASP A 127 -18.921 8.474 0.514 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -21.165 9.141 -1.121 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -21.738 9.155 0.535 1.00 0.00 H new ATOM 1942 N LYS A 128 -21.352 6.371 1.191 1.00 0.00 N ATOM 1943 CA LYS A 128 -21.942 5.558 2.248 1.00 0.00 C ATOM 1944 C LYS A 128 -20.916 4.589 2.829 1.00 0.00 C ATOM 1945 O LYS A 128 -20.986 4.227 4.004 1.00 0.00 O ATOM 1946 CB LYS A 128 -23.146 4.782 1.713 1.00 0.00 C ATOM 1947 CG LYS A 128 -24.460 5.537 1.837 1.00 0.00 C ATOM 1948 CD LYS A 128 -25.355 5.303 0.630 1.00 0.00 C ATOM 1949 CE LYS A 128 -26.826 5.334 1.011 1.00 0.00 C ATOM 1950 NZ LYS A 128 -27.325 3.988 1.407 1.00 0.00 N ATOM 0 H LYS A 128 -21.706 6.168 0.256 1.00 0.00 H new ATOM 0 HA LYS A 128 -22.273 6.227 3.042 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -22.974 4.538 0.665 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -23.227 3.837 2.251 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -24.978 5.220 2.742 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -24.259 6.603 1.941 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -25.157 6.065 -0.124 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -25.115 4.340 0.180 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -26.973 6.033 1.835 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -27.411 5.705 0.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -28.332 4.051 1.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -27.208 3.327 0.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -26.784 3.644 2.226 1.00 0.00 H new ATOM 1964 N ASP A 129 -19.965 4.172 1.998 1.00 0.00 N ATOM 1965 CA ASP A 129 -18.926 3.244 2.431 1.00 0.00 C ATOM 1966 C ASP A 129 -18.128 3.823 3.595 1.00 0.00 C ATOM 1967 O ASP A 129 -17.855 3.133 4.576 1.00 0.00 O ATOM 1968 CB ASP A 129 -17.988 2.919 1.266 1.00 0.00 C ATOM 1969 CG ASP A 129 -18.441 1.704 0.482 1.00 0.00 C ATOM 1970 OD1 ASP A 129 -19.091 0.820 1.079 1.00 0.00 O ATOM 1971 OD2 ASP A 129 -18.147 1.636 -0.731 1.00 0.00 O ATOM 0 H ASP A 129 -19.893 4.462 1.023 1.00 0.00 H new ATOM 0 HA ASP A 129 -19.410 2.327 2.768 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -17.931 3.779 0.598 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -16.983 2.746 1.650 1.00 0.00 H new ATOM 1976 N PHE A 130 -17.757 5.095 3.478 1.00 0.00 N ATOM 1977 CA PHE A 130 -16.991 5.765 4.523 1.00 0.00 C ATOM 1978 C PHE A 130 -17.775 5.809 5.830 1.00 0.00 C ATOM 1979 O PHE A 130 -17.194 5.784 6.915 1.00 0.00 O ATOM 1980 CB PHE A 130 -16.627 7.185 4.084 1.00 0.00 C ATOM 1981 CG PHE A 130 -15.289 7.279 3.407 1.00 0.00 C ATOM 1982 CD1 PHE A 130 -15.161 7.003 2.056 1.00 0.00 C ATOM 1983 CD2 PHE A 130 -14.160 7.645 4.123 1.00 0.00 C ATOM 1984 CE1 PHE A 130 -13.932 7.090 1.430 1.00 0.00 C ATOM 1985 CE2 PHE A 130 -12.928 7.733 3.503 1.00 0.00 C ATOM 1986 CZ PHE A 130 -12.814 7.455 2.154 1.00 0.00 C ATOM 0 H PHE A 130 -17.974 5.681 2.672 1.00 0.00 H new ATOM 0 HA PHE A 130 -16.076 5.197 4.690 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -17.395 7.555 3.405 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -16.631 7.839 4.956 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -16.032 6.716 1.485 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -14.244 7.864 5.177 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -13.846 6.873 0.376 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -12.056 8.019 4.072 1.00 0.00 H new ATOM 0 HZ PHE A 130 -11.852 7.523 1.667 1.00 0.00 H new ATOM 1996 N GLU A 131 -19.098 5.875 5.719 1.00 0.00 N ATOM 1997 CA GLU A 131 -19.962 5.923 6.893 1.00 0.00 C ATOM 1998 C GLU A 131 -19.837 4.643 7.713 1.00 0.00 C ATOM 1999 O GLU A 131 -19.926 4.669 8.940 1.00 0.00 O ATOM 2000 CB GLU A 131 -21.417 6.135 6.472 1.00 0.00 C ATOM 2001 CG GLU A 131 -22.187 7.068 7.393 1.00 0.00 C ATOM 2002 CD GLU A 131 -23.686 6.994 7.178 1.00 0.00 C ATOM 2003 OE1 GLU A 131 -24.327 6.099 7.769 1.00 0.00 O ATOM 2004 OE2 GLU A 131 -24.219 7.829 6.418 1.00 0.00 O ATOM 0 H GLU A 131 -19.595 5.896 4.828 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.645 6.762 7.513 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -21.439 6.538 5.460 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -21.922 5.170 6.442 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -21.960 6.818 8.429 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -21.851 8.092 7.231 1.00 0.00 H new ATOM 2011 N SER A 132 -19.633 3.523 7.026 1.00 0.00 N ATOM 2012 CA SER A 132 -19.498 2.233 7.691 1.00 0.00 C ATOM 2013 C SER A 132 -18.313 2.237 8.652 1.00 0.00 C ATOM 2014 O SER A 132 -18.489 2.210 9.870 1.00 0.00 O ATOM 2015 CB SER A 132 -19.326 1.119 6.657 1.00 0.00 C ATOM 2016 OG SER A 132 -20.580 0.597 6.255 1.00 0.00 O ATOM 0 H SER A 132 -19.558 3.484 6.010 1.00 0.00 H new ATOM 0 HA SER A 132 -20.407 2.051 8.264 1.00 0.00 H new ATOM 0 HB2 SER A 132 -18.794 1.505 5.788 1.00 0.00 H new ATOM 0 HB3 SER A 132 -18.714 0.321 7.077 1.00 0.00 H new ATOM 0 HG SER A 132 -20.442 -0.112 5.593 1.00 0.00 H new ATOM 2022 N SER A 133 -17.107 2.272 8.096 1.00 0.00 N ATOM 2023 CA SER A 133 -15.893 2.281 8.905 1.00 0.00 C ATOM 2024 C SER A 133 -15.857 3.500 9.821 1.00 0.00 C ATOM 2025 O SER A 133 -15.302 3.448 10.918 1.00 0.00 O ATOM 2026 CB SER A 133 -14.656 2.267 8.005 1.00 0.00 C ATOM 2027 OG SER A 133 -14.940 2.838 6.740 1.00 0.00 O ATOM 0 H SER A 133 -16.944 2.295 7.089 1.00 0.00 H new ATOM 0 HA SER A 133 -15.893 1.385 9.525 1.00 0.00 H new ATOM 0 HB2 SER A 133 -13.848 2.820 8.484 1.00 0.00 H new ATOM 0 HB3 SER A 133 -14.308 1.242 7.875 1.00 0.00 H new ATOM 0 HG SER A 133 -15.000 2.128 6.067 1.00 0.00 H new ATOM 2033 N GLY A 134 -16.454 4.595 9.362 1.00 0.00 N ATOM 2034 CA GLY A 134 -16.478 5.812 10.152 1.00 0.00 C ATOM 2035 C GLY A 134 -15.247 6.670 9.936 1.00 0.00 C ATOM 2036 O GLY A 134 -14.838 7.416 10.825 1.00 0.00 O ATOM 0 H GLY A 134 -16.921 4.661 8.458 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -17.368 6.388 9.898 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -16.556 5.554 11.208 1.00 0.00 H new ATOM 2040 N LEU A 135 -14.655 6.565 8.750 1.00 0.00 N ATOM 2041 CA LEU A 135 -13.464 7.337 8.419 1.00 0.00 C ATOM 2042 C LEU A 135 -13.839 8.732 7.928 1.00 0.00 C ATOM 2043 O LEU A 135 -14.958 8.958 7.466 1.00 0.00 O ATOM 2044 CB LEU A 135 -12.641 6.612 7.353 1.00 0.00 C ATOM 2045 CG LEU A 135 -11.833 5.416 7.859 1.00 0.00 C ATOM 2046 CD1 LEU A 135 -11.142 4.710 6.702 1.00 0.00 C ATOM 2047 CD2 LEU A 135 -10.816 5.863 8.898 1.00 0.00 C ATOM 0 H LEU A 135 -14.981 5.952 8.003 1.00 0.00 H new ATOM 0 HA LEU A 135 -12.864 7.439 9.323 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -13.314 6.269 6.567 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -11.956 7.327 6.897 1.00 0.00 H new ATOM 0 HG LEU A 135 -12.518 4.711 8.330 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -10.572 3.862 7.081 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.890 4.356 5.993 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -10.468 5.405 6.202 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -10.250 5.000 9.248 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -10.135 6.588 8.452 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -11.334 6.322 9.740 1.00 0.00 H new ATOM 2059 N ASP A 136 -12.896 9.662 8.030 1.00 0.00 N ATOM 2060 CA ASP A 136 -13.127 11.035 7.596 1.00 0.00 C ATOM 2061 C ASP A 136 -12.759 11.211 6.127 1.00 0.00 C ATOM 2062 O ASP A 136 -11.689 10.786 5.691 1.00 0.00 O ATOM 2063 CB ASP A 136 -12.319 12.008 8.457 1.00 0.00 C ATOM 2064 CG ASP A 136 -13.118 12.543 9.630 1.00 0.00 C ATOM 2065 OD1 ASP A 136 -13.586 11.726 10.451 1.00 0.00 O ATOM 2066 OD2 ASP A 136 -13.275 13.778 9.727 1.00 0.00 O ATOM 0 H ASP A 136 -11.965 9.490 8.409 1.00 0.00 H new ATOM 0 HA ASP A 136 -14.189 11.252 7.714 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -11.426 11.505 8.828 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -11.982 12.841 7.840 1.00 0.00 H new ATOM 2071 N ARG A 137 -13.651 11.838 5.368 1.00 0.00 N ATOM 2072 CA ARG A 137 -13.421 12.070 3.948 1.00 0.00 C ATOM 2073 C ARG A 137 -12.898 13.482 3.704 1.00 0.00 C ATOM 2074 O ARG A 137 -13.205 14.101 2.684 1.00 0.00 O ATOM 2075 CB ARG A 137 -14.711 11.843 3.158 1.00 0.00 C ATOM 2076 CG ARG A 137 -14.520 10.995 1.912 1.00 0.00 C ATOM 2077 CD ARG A 137 -15.649 11.203 0.917 1.00 0.00 C ATOM 2078 NE ARG A 137 -15.548 10.296 -0.224 1.00 0.00 N ATOM 2079 CZ ARG A 137 -14.734 10.493 -1.258 1.00 0.00 C ATOM 2080 NH1 ARG A 137 -13.948 11.561 -1.300 1.00 0.00 N ATOM 2081 NH2 ARG A 137 -14.705 9.617 -2.255 1.00 0.00 N ATOM 0 H ARG A 137 -14.542 12.195 5.714 1.00 0.00 H new ATOM 0 HA ARG A 137 -12.666 11.362 3.606 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -15.444 11.362 3.806 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -15.125 12.809 2.870 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -13.569 11.246 1.442 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -14.469 9.943 2.191 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -16.605 11.051 1.417 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -15.635 12.234 0.563 1.00 0.00 H new ATOM 0 HE ARG A 137 -16.136 9.463 -0.228 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -13.965 12.237 -0.537 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -13.326 11.706 -2.096 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -15.306 8.794 -2.228 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -14.081 9.767 -3.048 1.00 0.00 H new ATOM 2095 N SER A 138 -12.108 13.988 4.646 1.00 0.00 N ATOM 2096 CA SER A 138 -11.544 15.327 4.533 1.00 0.00 C ATOM 2097 C SER A 138 -10.133 15.373 5.111 1.00 0.00 C ATOM 2098 O SER A 138 -9.155 15.505 4.375 1.00 0.00 O ATOM 2099 CB SER A 138 -12.435 16.342 5.252 1.00 0.00 C ATOM 2100 OG SER A 138 -11.796 17.603 5.348 1.00 0.00 O ATOM 0 H SER A 138 -11.844 13.490 5.496 1.00 0.00 H new ATOM 0 HA SER A 138 -11.493 15.584 3.475 1.00 0.00 H new ATOM 0 HB2 SER A 138 -13.377 16.448 4.715 1.00 0.00 H new ATOM 0 HB3 SER A 138 -12.676 15.976 6.250 1.00 0.00 H new ATOM 0 HG SER A 138 -12.386 18.235 5.810 1.00 0.00 H new ATOM 2106 N LYS A 139 -10.036 15.262 6.431 1.00 0.00 N ATOM 2107 CA LYS A 139 -8.744 15.289 7.107 1.00 0.00 C ATOM 2108 C LYS A 139 -7.885 14.102 6.684 1.00 0.00 C ATOM 2109 O LYS A 139 -8.293 12.949 6.816 1.00 0.00 O ATOM 2110 CB LYS A 139 -8.938 15.277 8.624 1.00 0.00 C ATOM 2111 CG LYS A 139 -9.845 16.388 9.130 1.00 0.00 C ATOM 2112 CD LYS A 139 -9.348 16.954 10.451 1.00 0.00 C ATOM 2113 CE LYS A 139 -10.291 18.020 10.990 1.00 0.00 C ATOM 2114 NZ LYS A 139 -9.550 19.166 11.587 1.00 0.00 N ATOM 0 H LYS A 139 -10.836 15.153 7.054 1.00 0.00 H new ATOM 0 HA LYS A 139 -8.231 16.207 6.821 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -9.355 14.315 8.921 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -7.965 15.365 9.107 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -9.896 17.184 8.388 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -10.857 16.004 9.255 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -9.252 16.149 11.180 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -8.354 17.381 10.315 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -10.930 18.381 10.184 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -10.945 17.579 11.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -10.228 19.870 11.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -8.960 18.826 12.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -8.945 19.603 10.863 1.00 0.00 H new ATOM 2128 N ASN A 140 -6.692 14.393 6.173 1.00 0.00 N ATOM 2129 CA ASN A 140 -5.776 13.349 5.731 1.00 0.00 C ATOM 2130 C ASN A 140 -4.359 13.894 5.584 1.00 0.00 C ATOM 2131 O ASN A 140 -4.136 14.895 4.904 1.00 0.00 O ATOM 2132 CB ASN A 140 -6.248 12.759 4.401 1.00 0.00 C ATOM 2133 CG ASN A 140 -6.291 13.792 3.292 1.00 0.00 C ATOM 2134 OD1 ASN A 140 -6.894 14.855 3.442 1.00 0.00 O ATOM 2135 ND2 ASN A 140 -5.650 13.484 2.171 1.00 0.00 N ATOM 0 H ASN A 140 -6.338 15.342 6.055 1.00 0.00 H new ATOM 0 HA ASN A 140 -5.767 12.564 6.487 1.00 0.00 H new ATOM 0 HB2 ASN A 140 -5.582 11.946 4.111 1.00 0.00 H new ATOM 0 HB3 ASN A 140 -7.241 12.327 4.530 1.00 0.00 H new ATOM 0 HD21 ASN A 140 -5.644 14.140 1.390 1.00 0.00 H new ATOM 0 HD22 ASN A 140 -5.163 12.591 2.091 1.00 0.00 H new ATOM 2142 N ASN A 141 -3.405 13.227 6.225 1.00 0.00 N ATOM 2143 CA ASN A 141 -2.009 13.643 6.165 1.00 0.00 C ATOM 2144 C ASN A 141 -1.206 12.720 5.252 1.00 0.00 C ATOM 2145 O ASN A 141 -0.435 11.883 5.720 1.00 0.00 O ATOM 2146 CB ASN A 141 -1.399 13.658 7.570 1.00 0.00 C ATOM 2147 CG ASN A 141 -1.099 15.064 8.054 1.00 0.00 C ATOM 2148 OD1 ASN A 141 -1.482 15.448 9.158 1.00 0.00 O ATOM 2149 ND2 ASN A 141 -0.409 15.840 7.226 1.00 0.00 N ATOM 0 H ASN A 141 -3.573 12.396 6.792 1.00 0.00 H new ATOM 0 HA ASN A 141 -1.971 14.651 5.752 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -2.085 13.175 8.266 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -0.480 13.072 7.571 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -0.177 16.796 7.497 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -0.111 15.480 6.319 1.00 0.00 H new ATOM 2156 N TRP A 142 -1.394 12.880 3.947 1.00 0.00 N ATOM 2157 CA TRP A 142 -0.688 12.062 2.967 1.00 0.00 C ATOM 2158 C TRP A 142 0.692 12.639 2.668 1.00 0.00 C ATOM 2159 O TRP A 142 1.621 11.907 2.331 1.00 0.00 O ATOM 2160 CB TRP A 142 -1.503 11.956 1.676 1.00 0.00 C ATOM 2161 CG TRP A 142 -1.711 13.273 0.992 1.00 0.00 C ATOM 2162 CD1 TRP A 142 -2.625 14.233 1.321 1.00 0.00 C ATOM 2163 CD2 TRP A 142 -0.995 13.774 -0.142 1.00 0.00 C ATOM 2164 NE1 TRP A 142 -2.519 15.300 0.463 1.00 0.00 N ATOM 2165 CE2 TRP A 142 -1.525 15.043 -0.443 1.00 0.00 C ATOM 2166 CE3 TRP A 142 0.046 13.274 -0.930 1.00 0.00 C ATOM 2167 CZ2 TRP A 142 -1.050 15.816 -1.500 1.00 0.00 C ATOM 2168 CZ3 TRP A 142 0.517 14.043 -1.978 1.00 0.00 C ATOM 2169 CH2 TRP A 142 -0.031 15.302 -2.255 1.00 0.00 C ATOM 0 H TRP A 142 -2.029 13.568 3.543 1.00 0.00 H new ATOM 0 HA TRP A 142 -0.560 11.065 3.389 1.00 0.00 H new ATOM 0 HB2 TRP A 142 -0.997 11.275 0.991 1.00 0.00 H new ATOM 0 HB3 TRP A 142 -2.474 11.516 1.903 1.00 0.00 H new ATOM 0 HD1 TRP A 142 -3.329 14.163 2.137 1.00 0.00 H new ATOM 0 HE1 TRP A 142 -3.088 16.146 0.495 1.00 0.00 H new ATOM 0 HE3 TRP A 142 0.475 12.304 -0.724 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 -1.471 16.787 -1.716 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 1.321 13.667 -2.593 1.00 0.00 H new ATOM 0 HH2 TRP A 142 0.359 15.879 -3.081 1.00 0.00 H new ATOM 2180 N ASN A 143 0.818 13.957 2.794 1.00 0.00 N ATOM 2181 CA ASN A 143 2.085 14.631 2.539 1.00 0.00 C ATOM 2182 C ASN A 143 3.117 14.264 3.601 1.00 0.00 C ATOM 2183 O ASN A 143 4.315 14.208 3.323 1.00 0.00 O ATOM 2184 CB ASN A 143 1.884 16.148 2.509 1.00 0.00 C ATOM 2185 CG ASN A 143 1.180 16.612 1.249 1.00 0.00 C ATOM 2186 OD1 ASN A 143 0.077 17.155 1.306 1.00 0.00 O ATOM 2187 ND2 ASN A 143 1.816 16.400 0.103 1.00 0.00 N ATOM 0 H ASN A 143 0.058 14.578 3.071 1.00 0.00 H new ATOM 0 HA ASN A 143 2.455 14.302 1.568 1.00 0.00 H new ATOM 0 HB2 ASN A 143 1.303 16.452 3.380 1.00 0.00 H new ATOM 0 HB3 ASN A 143 2.853 16.642 2.584 1.00 0.00 H new ATOM 0 HD21 ASN A 143 1.391 16.691 -0.777 1.00 0.00 H new ATOM 0 HD22 ASN A 143 2.729 15.946 0.103 1.00 0.00 H new ATOM 2194 N ASP A 144 2.644 14.017 4.818 1.00 0.00 N ATOM 2195 CA ASP A 144 3.525 13.655 5.922 1.00 0.00 C ATOM 2196 C ASP A 144 3.691 12.141 6.011 1.00 0.00 C ATOM 2197 O ASP A 144 2.717 11.409 6.193 1.00 0.00 O ATOM 2198 CB ASP A 144 2.974 14.201 7.241 1.00 0.00 C ATOM 2199 CG ASP A 144 3.784 15.370 7.766 1.00 0.00 C ATOM 2200 OD1 ASP A 144 4.170 16.238 6.955 1.00 0.00 O ATOM 2201 OD2 ASP A 144 4.034 15.418 8.990 1.00 0.00 O ATOM 0 H ASP A 144 1.655 14.061 5.065 1.00 0.00 H new ATOM 0 HA ASP A 144 4.503 14.098 5.735 1.00 0.00 H new ATOM 0 HB2 ASP A 144 1.940 14.514 7.098 1.00 0.00 H new ATOM 0 HB3 ASP A 144 2.966 13.405 7.985 1.00 0.00 H new ATOM 2206 N VAL A 145 4.930 11.677 5.881 1.00 0.00 N ATOM 2207 CA VAL A 145 5.223 10.251 5.948 1.00 0.00 C ATOM 2208 C VAL A 145 6.527 9.991 6.694 1.00 0.00 C ATOM 2209 O VAL A 145 7.395 10.861 6.767 1.00 0.00 O ATOM 2210 CB VAL A 145 5.317 9.631 4.541 1.00 0.00 C ATOM 2211 CG1 VAL A 145 5.424 8.116 4.630 1.00 0.00 C ATOM 2212 CG2 VAL A 145 4.122 10.040 3.696 1.00 0.00 C ATOM 0 H VAL A 145 5.747 12.269 5.729 1.00 0.00 H new ATOM 0 HA VAL A 145 4.400 9.784 6.489 1.00 0.00 H new ATOM 0 HB VAL A 145 6.219 10.007 4.058 1.00 0.00 H new ATOM 0 HG11 VAL A 145 5.489 7.696 3.626 1.00 0.00 H new ATOM 0 HG12 VAL A 145 6.317 7.847 5.195 1.00 0.00 H new ATOM 0 HG13 VAL A 145 4.543 7.718 5.133 1.00 0.00 H new ATOM 0 HG21 VAL A 145 4.206 9.592 2.706 1.00 0.00 H new ATOM 0 HG22 VAL A 145 3.204 9.696 4.173 1.00 0.00 H new ATOM 0 HG23 VAL A 145 4.097 11.126 3.602 1.00 0.00 H new ATOM 2222 N ASP A 146 6.658 8.790 7.246 1.00 0.00 N ATOM 2223 CA ASP A 146 7.857 8.415 7.986 1.00 0.00 C ATOM 2224 C ASP A 146 8.798 7.588 7.117 1.00 0.00 C ATOM 2225 O ASP A 146 8.381 6.618 6.483 1.00 0.00 O ATOM 2226 CB ASP A 146 7.482 7.629 9.244 1.00 0.00 C ATOM 2227 CG ASP A 146 7.291 8.526 10.450 1.00 0.00 C ATOM 2228 OD1 ASP A 146 6.440 9.438 10.384 1.00 0.00 O ATOM 2229 OD2 ASP A 146 7.993 8.318 11.463 1.00 0.00 O ATOM 0 H ASP A 146 5.948 8.059 7.195 1.00 0.00 H new ATOM 0 HA ASP A 146 8.373 9.330 8.278 1.00 0.00 H new ATOM 0 HB2 ASP A 146 6.564 7.071 9.060 1.00 0.00 H new ATOM 0 HB3 ASP A 146 8.262 6.898 9.458 1.00 0.00 H new ATOM 2234 N ASP A 147 10.069 7.977 7.091 1.00 0.00 N ATOM 2235 CA ASP A 147 11.068 7.271 6.298 1.00 0.00 C ATOM 2236 C ASP A 147 12.033 6.504 7.197 1.00 0.00 C ATOM 2237 O ASP A 147 12.112 6.757 8.398 1.00 0.00 O ATOM 2238 CB ASP A 147 11.843 8.257 5.420 1.00 0.00 C ATOM 2239 CG ASP A 147 12.146 7.694 4.047 1.00 0.00 C ATOM 2240 OD1 ASP A 147 12.483 6.494 3.958 1.00 0.00 O ATOM 2241 OD2 ASP A 147 12.048 8.452 3.059 1.00 0.00 O ATOM 0 H ASP A 147 10.431 8.777 7.610 1.00 0.00 H new ATOM 0 HA ASP A 147 10.550 6.556 5.659 1.00 0.00 H new ATOM 0 HB2 ASP A 147 11.266 9.176 5.314 1.00 0.00 H new ATOM 0 HB3 ASP A 147 12.777 8.523 5.915 1.00 0.00 H new ATOM 2246 N PHE A 148 12.765 5.566 6.605 1.00 0.00 N ATOM 2247 CA PHE A 148 13.725 4.762 7.351 1.00 0.00 C ATOM 2248 C PHE A 148 14.875 4.315 6.452 1.00 0.00 C ATOM 2249 O PHE A 148 15.051 3.124 6.195 1.00 0.00 O ATOM 2250 CB PHE A 148 13.033 3.542 7.964 1.00 0.00 C ATOM 2251 CG PHE A 148 12.447 3.803 9.321 1.00 0.00 C ATOM 2252 CD1 PHE A 148 13.262 3.877 10.440 1.00 0.00 C ATOM 2253 CD2 PHE A 148 11.082 3.976 9.480 1.00 0.00 C ATOM 2254 CE1 PHE A 148 12.725 4.117 11.691 1.00 0.00 C ATOM 2255 CE2 PHE A 148 10.539 4.217 10.728 1.00 0.00 C ATOM 2256 CZ PHE A 148 11.361 4.287 11.834 1.00 0.00 C ATOM 0 H PHE A 148 12.711 5.344 5.611 1.00 0.00 H new ATOM 0 HA PHE A 148 14.134 5.378 8.152 1.00 0.00 H new ATOM 0 HB2 PHE A 148 12.241 3.209 7.293 1.00 0.00 H new ATOM 0 HB3 PHE A 148 13.752 2.726 8.039 1.00 0.00 H new ATOM 0 HD1 PHE A 148 14.329 3.746 10.333 1.00 0.00 H new ATOM 0 HD2 PHE A 148 10.434 3.922 8.618 1.00 0.00 H new ATOM 0 HE1 PHE A 148 13.370 4.172 12.555 1.00 0.00 H new ATOM 0 HE2 PHE A 148 9.473 4.350 10.837 1.00 0.00 H new ATOM 0 HZ PHE A 148 10.939 4.474 12.810 1.00 0.00 H new ATOM 2396 N SER A 157 15.441 11.785 2.376 1.00 0.00 N ATOM 2397 CA SER A 157 15.470 10.381 1.983 1.00 0.00 C ATOM 2398 C SER A 157 14.665 10.157 0.702 1.00 0.00 C ATOM 2399 O SER A 157 13.440 10.276 0.705 1.00 0.00 O ATOM 2400 CB SER A 157 14.913 9.506 3.106 1.00 0.00 C ATOM 2401 OG SER A 157 15.847 9.375 4.164 1.00 0.00 O ATOM 0 HA SER A 157 16.507 10.103 1.793 1.00 0.00 H new ATOM 0 HB2 SER A 157 13.988 9.941 3.485 1.00 0.00 H new ATOM 0 HB3 SER A 157 14.664 8.520 2.713 1.00 0.00 H new ATOM 0 HG SER A 157 15.465 8.812 4.870 1.00 0.00 H new ATOM 2407 N PRO A 158 15.343 9.829 -0.414 1.00 0.00 N ATOM 2408 CA PRO A 158 14.674 9.591 -1.698 1.00 0.00 C ATOM 2409 C PRO A 158 13.912 8.269 -1.719 1.00 0.00 C ATOM 2410 O PRO A 158 14.213 7.379 -2.514 1.00 0.00 O ATOM 2411 CB PRO A 158 15.831 9.560 -2.697 1.00 0.00 C ATOM 2412 CG PRO A 158 17.003 9.104 -1.899 1.00 0.00 C ATOM 2413 CD PRO A 158 16.807 9.663 -0.516 1.00 0.00 C ATOM 0 HA PRO A 158 13.925 10.352 -1.916 1.00 0.00 H new ATOM 0 HB2 PRO A 158 15.624 8.879 -3.522 1.00 0.00 H new ATOM 0 HB3 PRO A 158 16.006 10.544 -3.132 1.00 0.00 H new ATOM 0 HG2 PRO A 158 17.059 8.016 -1.875 1.00 0.00 H new ATOM 0 HG3 PRO A 158 17.935 9.462 -2.336 1.00 0.00 H new ATOM 0 HD2 PRO A 158 17.188 8.986 0.248 1.00 0.00 H new ATOM 0 HD3 PRO A 158 17.328 10.612 -0.389 1.00 0.00 H new ATOM 2421 N ASN A 159 12.924 8.148 -0.839 1.00 0.00 N ATOM 2422 CA ASN A 159 12.118 6.936 -0.756 1.00 0.00 C ATOM 2423 C ASN A 159 10.717 7.173 -1.310 1.00 0.00 C ATOM 2424 O ASN A 159 10.290 6.505 -2.251 1.00 0.00 O ATOM 2425 CB ASN A 159 12.031 6.457 0.693 1.00 0.00 C ATOM 2426 CG ASN A 159 11.321 5.124 0.821 1.00 0.00 C ATOM 2427 OD1 ASN A 159 10.521 4.750 -0.037 1.00 0.00 O ATOM 2428 ND2 ASN A 159 11.612 4.400 1.894 1.00 0.00 N ATOM 0 H ASN A 159 12.662 8.875 -0.173 1.00 0.00 H new ATOM 0 HA ASN A 159 12.601 6.167 -1.359 1.00 0.00 H new ATOM 0 HB2 ASN A 159 13.036 6.371 1.105 1.00 0.00 H new ATOM 0 HB3 ASN A 159 11.506 7.204 1.288 1.00 0.00 H new ATOM 0 HD21 ASN A 159 11.166 3.493 2.034 1.00 0.00 H new ATOM 0 HD22 ASN A 159 12.282 4.750 2.579 1.00 0.00 H new ATOM 2435 N TRP A 160 10.007 8.130 -0.720 1.00 0.00 N ATOM 2436 CA TRP A 160 8.653 8.456 -1.154 1.00 0.00 C ATOM 2437 C TRP A 160 8.639 9.747 -1.967 1.00 0.00 C ATOM 2438 O TRP A 160 9.515 10.598 -1.816 1.00 0.00 O ATOM 2439 CB TRP A 160 7.725 8.589 0.054 1.00 0.00 C ATOM 2440 CG TRP A 160 8.112 9.702 0.981 1.00 0.00 C ATOM 2441 CD1 TRP A 160 9.129 9.693 1.892 1.00 0.00 C ATOM 2442 CD2 TRP A 160 7.486 10.985 1.089 1.00 0.00 C ATOM 2443 NE1 TRP A 160 9.173 10.893 2.559 1.00 0.00 N ATOM 2444 CE2 TRP A 160 8.176 11.703 2.085 1.00 0.00 C ATOM 2445 CE3 TRP A 160 6.410 11.597 0.440 1.00 0.00 C ATOM 2446 CZ2 TRP A 160 7.824 13.000 2.446 1.00 0.00 C ATOM 2447 CZ3 TRP A 160 6.062 12.886 0.800 1.00 0.00 C ATOM 2448 CH2 TRP A 160 6.767 13.575 1.794 1.00 0.00 C ATOM 0 H TRP A 160 10.347 8.693 0.060 1.00 0.00 H new ATOM 0 HA TRP A 160 8.296 7.645 -1.788 1.00 0.00 H new ATOM 0 HB2 TRP A 160 6.706 8.755 -0.296 1.00 0.00 H new ATOM 0 HB3 TRP A 160 7.723 7.650 0.607 1.00 0.00 H new ATOM 0 HD1 TRP A 160 9.800 8.864 2.063 1.00 0.00 H new ATOM 0 HE1 TRP A 160 9.841 11.141 3.289 1.00 0.00 H new ATOM 0 HE3 TRP A 160 5.861 11.073 -0.328 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 8.365 13.534 3.213 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 5.232 13.369 0.306 1.00 0.00 H new ATOM 0 HH2 TRP A 160 6.471 14.581 2.052 1.00 0.00 H new ATOM 2459 N SER A 161 7.636 9.886 -2.830 1.00 0.00 N ATOM 2460 CA SER A 161 7.508 11.074 -3.667 1.00 0.00 C ATOM 2461 C SER A 161 6.042 11.390 -3.943 1.00 0.00 C ATOM 2462 O SER A 161 5.147 10.669 -3.499 1.00 0.00 O ATOM 2463 CB SER A 161 8.256 10.878 -4.987 1.00 0.00 C ATOM 2464 OG SER A 161 8.163 12.032 -5.802 1.00 0.00 O ATOM 0 H SER A 161 6.902 9.192 -2.967 1.00 0.00 H new ATOM 0 HA SER A 161 7.948 11.914 -3.130 1.00 0.00 H new ATOM 0 HB2 SER A 161 9.304 10.655 -4.785 1.00 0.00 H new ATOM 0 HB3 SER A 161 7.844 10.020 -5.518 1.00 0.00 H new ATOM 0 HG SER A 161 8.651 11.882 -6.639 1.00 0.00 H new ATOM 2470 N ILE A 162 5.803 12.470 -4.679 1.00 0.00 N ATOM 2471 CA ILE A 162 4.446 12.882 -5.015 1.00 0.00 C ATOM 2472 C ILE A 162 4.204 12.801 -6.518 1.00 0.00 C ATOM 2473 O ILE A 162 5.136 12.916 -7.313 1.00 0.00 O ATOM 2474 CB ILE A 162 4.160 14.319 -4.538 1.00 0.00 C ATOM 2475 CG1 ILE A 162 4.583 14.490 -3.078 1.00 0.00 C ATOM 2476 CG2 ILE A 162 2.686 14.652 -4.712 1.00 0.00 C ATOM 2477 CD1 ILE A 162 3.810 13.609 -2.120 1.00 0.00 C ATOM 0 H ILE A 162 6.532 13.076 -5.054 1.00 0.00 H new ATOM 0 HA ILE A 162 3.772 12.196 -4.503 1.00 0.00 H new ATOM 0 HB ILE A 162 4.742 15.010 -5.147 1.00 0.00 H new ATOM 0 HG12 ILE A 162 5.646 14.267 -2.987 1.00 0.00 H new ATOM 0 HG13 ILE A 162 4.450 15.532 -2.789 1.00 0.00 H new ATOM 0 HG21 ILE A 162 2.500 15.670 -4.371 1.00 0.00 H new ATOM 0 HG22 ILE A 162 2.416 14.567 -5.765 1.00 0.00 H new ATOM 0 HG23 ILE A 162 2.084 13.957 -4.126 1.00 0.00 H new ATOM 0 HD11 ILE A 162 4.161 13.782 -1.103 1.00 0.00 H new ATOM 0 HD12 ILE A 162 2.748 13.847 -2.183 1.00 0.00 H new ATOM 0 HD13 ILE A 162 3.963 12.563 -2.384 1.00 0.00 H new ATOM 2489 N LEU A 163 2.948 12.600 -6.900 1.00 0.00 N ATOM 2490 CA LEU A 163 2.584 12.503 -8.309 1.00 0.00 C ATOM 2491 C LEU A 163 2.072 13.844 -8.832 1.00 0.00 C ATOM 2492 O LEU A 163 1.318 14.538 -8.149 1.00 0.00 O ATOM 2493 CB LEU A 163 1.515 11.425 -8.506 1.00 0.00 C ATOM 2494 CG LEU A 163 1.112 11.170 -9.960 1.00 0.00 C ATOM 2495 CD1 LEU A 163 2.076 10.194 -10.617 1.00 0.00 C ATOM 2496 CD2 LEU A 163 -0.315 10.646 -10.031 1.00 0.00 C ATOM 0 H LEU A 163 2.165 12.501 -6.254 1.00 0.00 H new ATOM 0 HA LEU A 163 3.476 12.230 -8.872 1.00 0.00 H new ATOM 0 HB2 LEU A 163 1.879 10.491 -8.077 1.00 0.00 H new ATOM 0 HB3 LEU A 163 0.626 11.709 -7.943 1.00 0.00 H new ATOM 0 HG LEU A 163 1.159 12.114 -10.503 1.00 0.00 H new ATOM 0 HD11 LEU A 163 1.774 10.024 -11.651 1.00 0.00 H new ATOM 0 HD12 LEU A 163 3.084 10.609 -10.597 1.00 0.00 H new ATOM 0 HD13 LEU A 163 2.062 9.248 -10.075 1.00 0.00 H new ATOM 0 HD21 LEU A 163 -0.586 10.470 -11.072 1.00 0.00 H new ATOM 0 HD22 LEU A 163 -0.388 9.712 -9.474 1.00 0.00 H new ATOM 0 HD23 LEU A 163 -0.994 11.381 -9.598 1.00 0.00 H new ATOM 2508 N PRO A 164 2.476 14.232 -10.056 1.00 0.00 N ATOM 2509 CA PRO A 164 2.051 15.499 -10.661 1.00 0.00 C ATOM 2510 C PRO A 164 0.569 15.499 -11.021 1.00 0.00 C ATOM 2511 O PRO A 164 -0.134 14.512 -10.803 1.00 0.00 O ATOM 2512 CB PRO A 164 2.908 15.597 -11.926 1.00 0.00 C ATOM 2513 CG PRO A 164 3.257 14.188 -12.258 1.00 0.00 C ATOM 2514 CD PRO A 164 3.375 13.470 -10.943 1.00 0.00 C ATOM 0 HA PRO A 164 2.179 16.339 -9.978 1.00 0.00 H new ATOM 0 HB2 PRO A 164 2.359 16.071 -12.740 1.00 0.00 H new ATOM 0 HB3 PRO A 164 3.802 16.196 -11.753 1.00 0.00 H new ATOM 0 HG2 PRO A 164 2.489 13.733 -12.884 1.00 0.00 H new ATOM 0 HG3 PRO A 164 4.193 14.139 -12.815 1.00 0.00 H new ATOM 0 HD2 PRO A 164 3.069 12.427 -11.026 1.00 0.00 H new ATOM 0 HD3 PRO A 164 4.401 13.473 -10.574 1.00 0.00 H new ATOM 2522 N GLU A 165 0.100 16.613 -11.573 1.00 0.00 N ATOM 2523 CA GLU A 165 -1.299 16.743 -11.963 1.00 0.00 C ATOM 2524 C GLU A 165 -1.482 16.433 -13.445 1.00 0.00 C ATOM 2525 O GLU A 165 -2.223 17.121 -14.148 1.00 0.00 O ATOM 2526 CB GLU A 165 -1.807 18.153 -11.657 1.00 0.00 C ATOM 2527 CG GLU A 165 -1.937 18.444 -10.170 1.00 0.00 C ATOM 2528 CD GLU A 165 -2.060 19.926 -9.875 1.00 0.00 C ATOM 2529 OE1 GLU A 165 -2.841 20.608 -10.572 1.00 0.00 O ATOM 2530 OE2 GLU A 165 -1.374 20.405 -8.948 1.00 0.00 O ATOM 0 H GLU A 165 0.668 17.439 -11.760 1.00 0.00 H new ATOM 0 HA GLU A 165 -1.879 16.023 -11.386 1.00 0.00 H new ATOM 0 HB2 GLU A 165 -1.128 18.880 -12.103 1.00 0.00 H new ATOM 0 HB3 GLU A 165 -2.778 18.291 -12.132 1.00 0.00 H new ATOM 0 HG2 GLU A 165 -2.811 17.925 -9.777 1.00 0.00 H new ATOM 0 HG3 GLU A 165 -1.068 18.044 -9.648 1.00 0.00 H new ATOM 2537 N GLU A 166 -0.800 15.393 -13.916 1.00 0.00 N ATOM 2538 CA GLU A 166 -0.887 14.993 -15.316 1.00 0.00 C ATOM 2539 C GLU A 166 -1.350 13.545 -15.441 1.00 0.00 C ATOM 2540 O GLU A 166 -2.174 13.219 -16.295 1.00 0.00 O ATOM 2541 CB GLU A 166 0.469 15.167 -16.003 1.00 0.00 C ATOM 2542 CG GLU A 166 0.903 16.619 -16.131 1.00 0.00 C ATOM 2543 CD GLU A 166 1.459 16.942 -17.505 1.00 0.00 C ATOM 2544 OE1 GLU A 166 0.781 16.633 -18.507 1.00 0.00 O ATOM 2545 OE2 GLU A 166 2.571 17.506 -17.577 1.00 0.00 O ATOM 0 H GLU A 166 -0.182 14.813 -13.349 1.00 0.00 H new ATOM 0 HA GLU A 166 -1.620 15.634 -15.806 1.00 0.00 H new ATOM 0 HB2 GLU A 166 1.225 14.618 -15.441 1.00 0.00 H new ATOM 0 HB3 GLU A 166 0.424 14.721 -16.996 1.00 0.00 H new ATOM 0 HG2 GLU A 166 0.052 17.268 -15.926 1.00 0.00 H new ATOM 0 HG3 GLU A 166 1.659 16.836 -15.377 1.00 0.00 H new ATOM 2552 N GLU A 167 -0.813 12.680 -14.586 1.00 0.00 N ATOM 2553 CA GLU A 167 -1.171 11.266 -14.605 1.00 0.00 C ATOM 2554 C GLU A 167 -2.141 10.932 -13.475 1.00 0.00 C ATOM 2555 O GLU A 167 -2.154 9.811 -12.968 1.00 0.00 O ATOM 2556 CB GLU A 167 0.084 10.400 -14.487 1.00 0.00 C ATOM 2557 CG GLU A 167 1.019 10.519 -15.680 1.00 0.00 C ATOM 2558 CD GLU A 167 2.462 10.223 -15.319 1.00 0.00 C ATOM 2559 OE1 GLU A 167 2.690 9.440 -14.374 1.00 0.00 O ATOM 2560 OE2 GLU A 167 3.365 10.774 -15.984 1.00 0.00 O ATOM 0 H GLU A 167 -0.129 12.933 -13.872 1.00 0.00 H new ATOM 0 HA GLU A 167 -1.663 11.055 -15.555 1.00 0.00 H new ATOM 0 HB2 GLU A 167 0.625 10.680 -13.583 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -0.213 9.358 -14.371 1.00 0.00 H new ATOM 0 HG2 GLU A 167 0.695 9.832 -16.461 1.00 0.00 H new ATOM 0 HG3 GLU A 167 0.950 11.526 -16.092 1.00 0.00 H new ATOM 2567 N ARG A 168 -2.952 11.911 -13.086 1.00 0.00 N ATOM 2568 CA ARG A 168 -3.924 11.716 -12.016 1.00 0.00 C ATOM 2569 C ARG A 168 -5.146 10.959 -12.524 1.00 0.00 C ATOM 2570 O ARG A 168 -5.776 10.206 -11.781 1.00 0.00 O ATOM 2571 CB ARG A 168 -4.350 13.064 -11.434 1.00 0.00 C ATOM 2572 CG ARG A 168 -3.191 13.894 -10.911 1.00 0.00 C ATOM 2573 CD ARG A 168 -2.848 13.527 -9.476 1.00 0.00 C ATOM 2574 NE ARG A 168 -3.993 13.684 -8.583 1.00 0.00 N ATOM 2575 CZ ARG A 168 -4.389 14.853 -8.083 1.00 0.00 C ATOM 2576 NH1 ARG A 168 -3.737 15.969 -8.386 1.00 0.00 N ATOM 2577 NH2 ARG A 168 -5.442 14.906 -7.278 1.00 0.00 N ATOM 0 H ARG A 168 -2.955 12.845 -13.495 1.00 0.00 H new ATOM 0 HA ARG A 168 -3.451 11.123 -11.233 1.00 0.00 H new ATOM 0 HB2 ARG A 168 -4.875 13.632 -12.202 1.00 0.00 H new ATOM 0 HB3 ARG A 168 -5.058 12.893 -10.623 1.00 0.00 H new ATOM 0 HG2 ARG A 168 -2.318 13.742 -11.545 1.00 0.00 H new ATOM 0 HG3 ARG A 168 -3.445 14.952 -10.966 1.00 0.00 H new ATOM 0 HD2 ARG A 168 -2.498 12.495 -9.439 1.00 0.00 H new ATOM 0 HD3 ARG A 168 -2.028 14.154 -9.127 1.00 0.00 H new ATOM 0 HE ARG A 168 -4.520 12.849 -8.327 1.00 0.00 H new ATOM 0 HH11 ARG A 168 -2.927 15.934 -9.005 1.00 0.00 H new ATOM 0 HH12 ARG A 168 -4.046 16.861 -7.999 1.00 0.00 H new ATOM 0 HH21 ARG A 168 -5.947 14.052 -7.043 1.00 0.00 H new ATOM 0 HH22 ARG A 168 -5.746 15.801 -6.894 1.00 0.00 H new ATOM 2591 N ASN A 169 -5.476 11.161 -13.797 1.00 0.00 N ATOM 2592 CA ASN A 169 -6.622 10.497 -14.405 1.00 0.00 C ATOM 2593 C ASN A 169 -6.188 9.236 -15.145 1.00 0.00 C ATOM 2594 O ASN A 169 -5.537 9.309 -16.187 1.00 0.00 O ATOM 2595 CB ASN A 169 -7.341 11.448 -15.364 1.00 0.00 C ATOM 2596 CG ASN A 169 -8.844 11.439 -15.169 1.00 0.00 C ATOM 2597 OD1 ASN A 169 -9.573 10.766 -15.898 1.00 0.00 O ATOM 2598 ND2 ASN A 169 -9.316 12.190 -14.180 1.00 0.00 N ATOM 0 H ASN A 169 -4.965 11.780 -14.426 1.00 0.00 H new ATOM 0 HA ASN A 169 -7.310 10.210 -13.610 1.00 0.00 H new ATOM 0 HB2 ASN A 169 -6.965 12.460 -15.217 1.00 0.00 H new ATOM 0 HB3 ASN A 169 -7.109 11.167 -16.391 1.00 0.00 H new ATOM 0 HD21 ASN A 169 -10.319 12.225 -14.000 1.00 0.00 H new ATOM 0 HD22 ASN A 169 -8.675 12.732 -13.600 1.00 0.00 H new ATOM 2605 N ILE A 170 -6.553 8.081 -14.600 1.00 0.00 N ATOM 2606 CA ILE A 170 -6.200 6.804 -15.208 1.00 0.00 C ATOM 2607 C ILE A 170 -7.394 6.193 -15.936 1.00 0.00 C ATOM 2608 O ILE A 170 -8.467 6.027 -15.357 1.00 0.00 O ATOM 2609 CB ILE A 170 -5.686 5.801 -14.155 1.00 0.00 C ATOM 2610 CG1 ILE A 170 -4.595 6.442 -13.295 1.00 0.00 C ATOM 2611 CG2 ILE A 170 -5.164 4.542 -14.832 1.00 0.00 C ATOM 2612 CD1 ILE A 170 -4.746 6.158 -11.817 1.00 0.00 C ATOM 0 H ILE A 170 -7.093 8.003 -13.738 1.00 0.00 H new ATOM 0 HA ILE A 170 -5.404 7.005 -15.925 1.00 0.00 H new ATOM 0 HB ILE A 170 -6.516 5.523 -13.506 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -3.622 6.081 -13.628 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -4.606 7.520 -13.453 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -4.805 3.844 -14.075 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -5.967 4.076 -15.403 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -4.345 4.802 -15.503 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -3.938 6.643 -11.269 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -5.704 6.544 -11.468 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -4.704 5.082 -11.647 1.00 0.00 H new