USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 968 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 84 TYR OH : rot -130:sc= 0.422 USER MOD Set 1.2: A 121 SER OG : rot 21:sc= 1.3 USER MOD Set 2.1: A 93 HIS :FLIP no HD1:sc= -0.291 F(o=-2.4,f=-0.59) USER MOD Set 2.2: A 95 THR OG1 : rot -113:sc= -0.301 USER MOD Set 3.1: A 27 ASN : amide:sc= -0.795 X(o=-1.1,f=-0.7) USER MOD Set 3.2: A 76 THR OG1 : rot 180:sc= -0.255 USER MOD Set 4.1: A 14 SER OG : rot -24:sc= -0.101! USER MOD Set 4.2: A 124 LYS NZ :NH3+ -154:sc= 0.735 (180deg=0) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 159:sc= -0.369 USER MOD Single : A 18 ASN : amide:sc= -1.07 K(o=-1.1,f=-2.2!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl 172:sc= -1.85 (180deg=-2.03) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot 70:sc= -5.56! USER MOD Single : A 44 SER OG : rot 22:sc= 1.31 USER MOD Single : A 47 TYR OH : rot 0:sc= -1.91! USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -112:sc= -0.0332 (180deg=-1.79!) USER MOD Single : A 51 THR OG1 : rot -18:sc= 0.362 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -0.122 X(o=-0.12,f=-0.33) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot -76:sc= 0.848 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.524 USER MOD Single : A 80 TYR OH : rot 180:sc= -0.0655 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0.00072 USER MOD Single : A 86 GLN : amide:sc= -0.0102 X(o=-0.01,f=-0.092) USER MOD Single : A 88 GLN : amide:sc= -0.0187 X(o=-0.019,f=0) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl -159:sc= -4.77! (180deg=-5.33!) USER MOD Single : A 127 MET CE :methyl -160:sc= -4.14! (180deg=-6.34!) USER MOD Single : A 128 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 SER OG : rot 180:sc= -0.025 USER MOD ----------------------------------------------------------------- ATOM 66 N LEU A 8 -13.955 -10.141 3.937 1.00 0.00 N ATOM 67 CA LEU A 8 -13.974 -8.689 3.887 1.00 0.00 C ATOM 68 C LEU A 8 -13.933 -8.232 2.427 1.00 0.00 C ATOM 69 O LEU A 8 -14.974 -7.993 1.818 1.00 0.00 O ATOM 70 CB LEU A 8 -12.848 -8.108 4.744 1.00 0.00 C ATOM 71 CG LEU A 8 -13.052 -8.182 6.259 1.00 0.00 C ATOM 72 CD1 LEU A 8 -14.490 -7.821 6.637 1.00 0.00 C ATOM 73 CD2 LEU A 8 -12.645 -9.554 6.800 1.00 0.00 C ATOM 0 HA LEU A 8 -14.900 -8.306 4.316 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -11.923 -8.629 4.496 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.709 -7.063 4.467 1.00 0.00 H new ATOM 0 HG LEU A 8 -12.401 -7.444 6.728 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -14.608 -7.881 7.719 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -14.710 -6.807 6.304 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -15.178 -8.517 6.158 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -12.800 -9.580 7.879 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -13.252 -10.326 6.327 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -11.593 -9.734 6.580 1.00 0.00 H new ATOM 85 N GLY A 9 -12.718 -8.125 1.908 1.00 0.00 N ATOM 86 CA GLY A 9 -12.528 -7.702 0.531 1.00 0.00 C ATOM 87 C GLY A 9 -11.116 -8.038 0.045 1.00 0.00 C ATOM 88 O GLY A 9 -10.381 -8.761 0.714 1.00 0.00 O ATOM 0 H GLY A 9 -11.856 -8.324 2.416 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.263 -8.191 -0.108 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.699 -6.629 0.449 1.00 0.00 H new ATOM 92 N THR A 10 -10.780 -7.495 -1.117 1.00 0.00 N ATOM 93 CA THR A 10 -9.470 -7.728 -1.700 1.00 0.00 C ATOM 94 C THR A 10 -8.708 -6.409 -1.841 1.00 0.00 C ATOM 95 O THR A 10 -9.278 -5.335 -1.657 1.00 0.00 O ATOM 96 CB THR A 10 -9.668 -8.460 -3.029 1.00 0.00 C ATOM 97 OG1 THR A 10 -10.286 -9.690 -2.659 1.00 0.00 O ATOM 98 CG2 THR A 10 -8.343 -8.886 -3.665 1.00 0.00 C ATOM 0 H THR A 10 -11.392 -6.895 -1.669 1.00 0.00 H new ATOM 0 HA THR A 10 -8.855 -8.356 -1.055 1.00 0.00 H new ATOM 0 HB THR A 10 -10.213 -7.817 -3.720 1.00 0.00 H new ATOM 0 HG1 THR A 10 -10.452 -10.227 -3.462 1.00 0.00 H new ATOM 0 HG21 THR A 10 -8.540 -9.401 -4.605 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.731 -8.005 -3.855 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.813 -9.556 -2.988 1.00 0.00 H new ATOM 106 N LEU A 11 -7.429 -6.534 -2.166 1.00 0.00 N ATOM 107 CA LEU A 11 -6.582 -5.365 -2.333 1.00 0.00 C ATOM 108 C LEU A 11 -5.796 -5.493 -3.640 1.00 0.00 C ATOM 109 O LEU A 11 -5.402 -6.592 -4.026 1.00 0.00 O ATOM 110 CB LEU A 11 -5.698 -5.163 -1.101 1.00 0.00 C ATOM 111 CG LEU A 11 -4.374 -4.434 -1.338 1.00 0.00 C ATOM 112 CD1 LEU A 11 -4.614 -2.985 -1.767 1.00 0.00 C ATOM 113 CD2 LEU A 11 -3.470 -4.526 -0.107 1.00 0.00 C ATOM 0 H LEU A 11 -6.959 -7.427 -2.318 1.00 0.00 H new ATOM 0 HA LEU A 11 -7.189 -4.463 -2.412 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.268 -4.607 -0.357 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.480 -6.140 -0.671 1.00 0.00 H new ATOM 0 HG LEU A 11 -3.853 -4.929 -2.158 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -3.656 -2.490 -1.929 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -5.191 -2.970 -2.692 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -5.166 -2.461 -0.987 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -2.535 -4.000 -0.302 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -3.971 -4.071 0.747 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -3.258 -5.573 0.112 1.00 0.00 H new ATOM 125 N PHE A 12 -5.592 -4.354 -4.285 1.00 0.00 N ATOM 126 CA PHE A 12 -4.861 -4.324 -5.540 1.00 0.00 C ATOM 127 C PHE A 12 -3.728 -3.297 -5.490 1.00 0.00 C ATOM 128 O PHE A 12 -3.919 -2.179 -5.014 1.00 0.00 O ATOM 129 CB PHE A 12 -5.856 -3.917 -6.628 1.00 0.00 C ATOM 130 CG PHE A 12 -7.143 -4.743 -6.635 1.00 0.00 C ATOM 131 CD1 PHE A 12 -7.080 -6.102 -6.609 1.00 0.00 C ATOM 132 CD2 PHE A 12 -8.351 -4.120 -6.668 1.00 0.00 C ATOM 133 CE1 PHE A 12 -8.275 -6.869 -6.616 1.00 0.00 C ATOM 134 CE2 PHE A 12 -9.546 -4.887 -6.674 1.00 0.00 C ATOM 135 CZ PHE A 12 -9.483 -6.245 -6.648 1.00 0.00 C ATOM 0 H PHE A 12 -5.921 -3.444 -3.961 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.420 -5.301 -5.738 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -6.112 -2.866 -6.497 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.373 -4.008 -7.601 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -6.121 -6.597 -6.583 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.402 -3.041 -6.690 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -8.225 -7.948 -6.596 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -10.505 -4.392 -6.699 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.392 -6.828 -6.653 1.00 0.00 H new ATOM 145 N PHE A 13 -2.573 -3.713 -5.989 1.00 0.00 N ATOM 146 CA PHE A 13 -1.409 -2.843 -6.007 1.00 0.00 C ATOM 147 C PHE A 13 -0.365 -3.345 -7.007 1.00 0.00 C ATOM 148 O PHE A 13 -0.477 -4.457 -7.520 1.00 0.00 O ATOM 149 CB PHE A 13 -0.807 -2.871 -4.601 1.00 0.00 C ATOM 150 CG PHE A 13 -0.283 -4.244 -4.176 1.00 0.00 C ATOM 151 CD1 PHE A 13 -1.148 -5.281 -4.010 1.00 0.00 C ATOM 152 CD2 PHE A 13 1.048 -4.429 -3.965 1.00 0.00 C ATOM 153 CE1 PHE A 13 -0.661 -6.555 -3.615 1.00 0.00 C ATOM 154 CE2 PHE A 13 1.535 -5.703 -3.571 1.00 0.00 C ATOM 155 CZ PHE A 13 0.670 -6.739 -3.404 1.00 0.00 C ATOM 0 H PHE A 13 -2.418 -4.641 -6.384 1.00 0.00 H new ATOM 0 HA PHE A 13 -1.702 -1.836 -6.303 1.00 0.00 H new ATOM 0 HB2 PHE A 13 0.010 -2.151 -4.552 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -1.563 -2.545 -3.887 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -2.205 -5.135 -4.179 1.00 0.00 H new ATOM 0 HD2 PHE A 13 1.735 -3.606 -4.097 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -1.348 -7.378 -3.482 1.00 0.00 H new ATOM 0 HE2 PHE A 13 2.592 -5.849 -3.404 1.00 0.00 H new ATOM 0 HZ PHE A 13 1.040 -7.708 -3.104 1.00 0.00 H new ATOM 165 N SER A 14 0.626 -2.501 -7.252 1.00 0.00 N ATOM 166 CA SER A 14 1.690 -2.846 -8.181 1.00 0.00 C ATOM 167 C SER A 14 3.008 -2.221 -7.721 1.00 0.00 C ATOM 168 O SER A 14 3.128 -0.999 -7.646 1.00 0.00 O ATOM 169 CB SER A 14 1.351 -2.386 -9.601 1.00 0.00 C ATOM 170 OG SER A 14 2.021 -1.176 -9.944 1.00 0.00 O ATOM 0 H SER A 14 0.715 -1.579 -6.824 1.00 0.00 H new ATOM 0 HA SER A 14 1.795 -3.931 -8.195 1.00 0.00 H new ATOM 0 HB2 SER A 14 1.626 -3.166 -10.310 1.00 0.00 H new ATOM 0 HB3 SER A 14 0.274 -2.241 -9.688 1.00 0.00 H new ATOM 0 HG SER A 14 2.242 -0.682 -9.127 1.00 0.00 H new ATOM 176 N LEU A 15 3.965 -3.089 -7.425 1.00 0.00 N ATOM 177 CA LEU A 15 5.271 -2.637 -6.975 1.00 0.00 C ATOM 178 C LEU A 15 6.117 -2.244 -8.188 1.00 0.00 C ATOM 179 O LEU A 15 5.983 -2.834 -9.259 1.00 0.00 O ATOM 180 CB LEU A 15 5.926 -3.696 -6.086 1.00 0.00 C ATOM 181 CG LEU A 15 5.155 -4.081 -4.822 1.00 0.00 C ATOM 182 CD1 LEU A 15 5.234 -5.588 -4.570 1.00 0.00 C ATOM 183 CD2 LEU A 15 5.638 -3.272 -3.617 1.00 0.00 C ATOM 0 H LEU A 15 3.862 -4.102 -7.488 1.00 0.00 H new ATOM 0 HA LEU A 15 5.173 -1.747 -6.353 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.081 -4.596 -6.681 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.911 -3.335 -5.791 1.00 0.00 H new ATOM 0 HG LEU A 15 4.104 -3.834 -4.974 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.678 -5.835 -3.666 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.804 -6.122 -5.418 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.276 -5.882 -4.447 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.073 -3.565 -2.732 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.698 -3.464 -3.451 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.487 -2.210 -3.808 1.00 0.00 H new ATOM 195 N GLU A 16 6.968 -1.251 -7.979 1.00 0.00 N ATOM 196 CA GLU A 16 7.835 -0.772 -9.042 1.00 0.00 C ATOM 197 C GLU A 16 9.074 -0.096 -8.453 1.00 0.00 C ATOM 198 O GLU A 16 8.971 0.955 -7.821 1.00 0.00 O ATOM 199 CB GLU A 16 7.083 0.179 -9.976 1.00 0.00 C ATOM 200 CG GLU A 16 8.058 1.017 -10.805 1.00 0.00 C ATOM 201 CD GLU A 16 7.487 1.308 -12.195 1.00 0.00 C ATOM 202 OE1 GLU A 16 6.779 2.331 -12.314 1.00 0.00 O ATOM 203 OE2 GLU A 16 7.772 0.501 -13.106 1.00 0.00 O ATOM 0 H GLU A 16 7.076 -0.765 -7.089 1.00 0.00 H new ATOM 0 HA GLU A 16 8.159 -1.628 -9.633 1.00 0.00 H new ATOM 0 HB2 GLU A 16 6.435 -0.394 -10.639 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.439 0.836 -9.391 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.266 1.955 -10.290 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.007 0.489 -10.901 1.00 0.00 H new ATOM 210 N TYR A 17 10.217 -0.726 -8.679 1.00 0.00 N ATOM 211 CA TYR A 17 11.475 -0.198 -8.178 1.00 0.00 C ATOM 212 C TYR A 17 12.144 0.704 -9.218 1.00 0.00 C ATOM 213 O TYR A 17 12.247 0.338 -10.388 1.00 0.00 O ATOM 214 CB TYR A 17 12.370 -1.412 -7.923 1.00 0.00 C ATOM 215 CG TYR A 17 13.744 -1.063 -7.347 1.00 0.00 C ATOM 216 CD1 TYR A 17 14.776 -0.709 -8.192 1.00 0.00 C ATOM 217 CD2 TYR A 17 13.950 -1.101 -5.983 1.00 0.00 C ATOM 218 CE1 TYR A 17 16.069 -0.380 -7.650 1.00 0.00 C ATOM 219 CE2 TYR A 17 15.243 -0.771 -5.441 1.00 0.00 C ATOM 220 CZ TYR A 17 16.239 -0.427 -6.302 1.00 0.00 C ATOM 221 OH TYR A 17 17.460 -0.116 -5.790 1.00 0.00 O ATOM 0 H TYR A 17 10.299 -1.598 -9.203 1.00 0.00 H new ATOM 0 HA TYR A 17 11.311 0.397 -7.279 1.00 0.00 H new ATOM 0 HB2 TYR A 17 11.861 -2.088 -7.236 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.507 -1.953 -8.860 1.00 0.00 H new ATOM 0 HD1 TYR A 17 14.614 -0.679 -9.259 1.00 0.00 H new ATOM 0 HD2 TYR A 17 13.142 -1.378 -5.322 1.00 0.00 H new ATOM 0 HE1 TYR A 17 16.886 -0.102 -8.300 1.00 0.00 H new ATOM 0 HE2 TYR A 17 15.418 -0.796 -4.376 1.00 0.00 H new ATOM 0 HH TYR A 17 17.364 0.142 -4.849 1.00 0.00 H new ATOM 231 N ASN A 18 12.581 1.865 -8.753 1.00 0.00 N ATOM 232 CA ASN A 18 13.238 2.822 -9.628 1.00 0.00 C ATOM 233 C ASN A 18 14.703 2.421 -9.806 1.00 0.00 C ATOM 234 O ASN A 18 15.541 2.721 -8.957 1.00 0.00 O ATOM 235 CB ASN A 18 13.202 4.229 -9.029 1.00 0.00 C ATOM 236 CG ASN A 18 13.294 5.293 -10.125 1.00 0.00 C ATOM 237 OD1 ASN A 18 13.147 5.021 -11.305 1.00 0.00 O ATOM 238 ND2 ASN A 18 13.546 6.518 -9.670 1.00 0.00 N ATOM 0 H ASN A 18 12.493 2.165 -7.782 1.00 0.00 H new ATOM 0 HA ASN A 18 12.713 2.823 -10.583 1.00 0.00 H new ATOM 0 HB2 ASN A 18 12.281 4.364 -8.463 1.00 0.00 H new ATOM 0 HB3 ASN A 18 14.028 4.351 -8.328 1.00 0.00 H new ATOM 0 HD21 ASN A 18 13.627 7.298 -10.323 1.00 0.00 H new ATOM 0 HD22 ASN A 18 13.658 6.677 -8.669 1.00 0.00 H new ATOM 245 N PHE A 19 14.969 1.749 -10.917 1.00 0.00 N ATOM 246 CA PHE A 19 16.318 1.304 -11.218 1.00 0.00 C ATOM 247 C PHE A 19 17.218 2.487 -11.582 1.00 0.00 C ATOM 248 O PHE A 19 18.413 2.476 -11.291 1.00 0.00 O ATOM 249 CB PHE A 19 16.222 0.364 -12.421 1.00 0.00 C ATOM 250 CG PHE A 19 16.343 -1.119 -12.063 1.00 0.00 C ATOM 251 CD1 PHE A 19 15.317 -1.753 -11.435 1.00 0.00 C ATOM 252 CD2 PHE A 19 17.476 -1.803 -12.374 1.00 0.00 C ATOM 253 CE1 PHE A 19 15.429 -3.129 -11.103 1.00 0.00 C ATOM 254 CE2 PHE A 19 17.589 -3.179 -12.042 1.00 0.00 C ATOM 255 CZ PHE A 19 16.563 -3.813 -11.413 1.00 0.00 C ATOM 0 H PHE A 19 14.272 1.502 -11.620 1.00 0.00 H new ATOM 0 HA PHE A 19 16.748 0.809 -10.348 1.00 0.00 H new ATOM 0 HB2 PHE A 19 15.269 0.529 -12.923 1.00 0.00 H new ATOM 0 HB3 PHE A 19 17.006 0.621 -13.133 1.00 0.00 H new ATOM 0 HD1 PHE A 19 14.417 -1.210 -11.189 1.00 0.00 H new ATOM 0 HD2 PHE A 19 18.290 -1.300 -12.874 1.00 0.00 H new ATOM 0 HE1 PHE A 19 14.614 -3.632 -10.604 1.00 0.00 H new ATOM 0 HE2 PHE A 19 18.489 -3.722 -12.289 1.00 0.00 H new ATOM 0 HZ PHE A 19 16.649 -4.859 -11.160 1.00 0.00 H new ATOM 265 N GLU A 20 16.608 3.480 -12.214 1.00 0.00 N ATOM 266 CA GLU A 20 17.339 4.668 -12.621 1.00 0.00 C ATOM 267 C GLU A 20 17.922 5.378 -11.397 1.00 0.00 C ATOM 268 O GLU A 20 19.089 5.766 -11.398 1.00 0.00 O ATOM 269 CB GLU A 20 16.444 5.612 -13.427 1.00 0.00 C ATOM 270 CG GLU A 20 17.237 6.818 -13.936 1.00 0.00 C ATOM 271 CD GLU A 20 17.644 6.629 -15.399 1.00 0.00 C ATOM 272 OE1 GLU A 20 18.194 5.548 -15.700 1.00 0.00 O ATOM 273 OE2 GLU A 20 17.396 7.570 -16.183 1.00 0.00 O ATOM 0 H GLU A 20 15.617 3.486 -12.454 1.00 0.00 H new ATOM 0 HA GLU A 20 18.163 4.361 -13.266 1.00 0.00 H new ATOM 0 HB2 GLU A 20 16.010 5.075 -14.271 1.00 0.00 H new ATOM 0 HB3 GLU A 20 15.616 5.953 -12.806 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.636 7.722 -13.836 1.00 0.00 H new ATOM 0 HG3 GLU A 20 18.127 6.958 -13.322 1.00 0.00 H new ATOM 280 N ARG A 21 17.083 5.525 -10.382 1.00 0.00 N ATOM 281 CA ARG A 21 17.501 6.181 -9.155 1.00 0.00 C ATOM 282 C ARG A 21 17.513 5.181 -7.997 1.00 0.00 C ATOM 283 O ARG A 21 17.426 5.572 -6.834 1.00 0.00 O ATOM 284 CB ARG A 21 16.569 7.343 -8.807 1.00 0.00 C ATOM 285 CG ARG A 21 16.321 8.232 -10.028 1.00 0.00 C ATOM 286 CD ARG A 21 15.211 9.247 -9.750 1.00 0.00 C ATOM 287 NE ARG A 21 15.782 10.610 -9.662 1.00 0.00 N ATOM 288 CZ ARG A 21 16.261 11.293 -10.711 1.00 0.00 C ATOM 289 NH1 ARG A 21 16.241 10.744 -11.934 1.00 0.00 N ATOM 290 NH2 ARG A 21 16.761 12.524 -10.538 1.00 0.00 N ATOM 0 H ARG A 21 16.116 5.201 -10.384 1.00 0.00 H new ATOM 0 HA ARG A 21 18.506 6.572 -9.313 1.00 0.00 H new ATOM 0 HB2 ARG A 21 15.620 6.955 -8.437 1.00 0.00 H new ATOM 0 HB3 ARG A 21 17.006 7.936 -8.004 1.00 0.00 H new ATOM 0 HG2 ARG A 21 17.239 8.756 -10.294 1.00 0.00 H new ATOM 0 HG3 ARG A 21 16.048 7.614 -10.883 1.00 0.00 H new ATOM 0 HD2 ARG A 21 14.464 9.207 -10.543 1.00 0.00 H new ATOM 0 HD3 ARG A 21 14.702 8.996 -8.819 1.00 0.00 H new ATOM 0 HE ARG A 21 15.813 11.057 -8.746 1.00 0.00 H new ATOM 0 HH11 ARG A 21 15.861 9.807 -12.066 1.00 0.00 H new ATOM 0 HH12 ARG A 21 16.606 11.264 -12.732 1.00 0.00 H new ATOM 0 HH21 ARG A 21 16.777 12.942 -9.608 1.00 0.00 H new ATOM 0 HH22 ARG A 21 17.125 13.043 -11.337 1.00 0.00 H new ATOM 304 N LYS A 22 17.620 3.910 -8.355 1.00 0.00 N ATOM 305 CA LYS A 22 17.644 2.852 -7.360 1.00 0.00 C ATOM 306 C LYS A 22 16.708 3.220 -6.207 1.00 0.00 C ATOM 307 O LYS A 22 17.162 3.498 -5.098 1.00 0.00 O ATOM 308 CB LYS A 22 19.081 2.564 -6.918 1.00 0.00 C ATOM 309 CG LYS A 22 19.664 1.377 -7.687 1.00 0.00 C ATOM 310 CD LYS A 22 20.486 1.851 -8.886 1.00 0.00 C ATOM 311 CE LYS A 22 20.737 0.704 -9.867 1.00 0.00 C ATOM 312 NZ LYS A 22 21.770 1.084 -10.857 1.00 0.00 N ATOM 0 H LYS A 22 17.691 3.589 -9.321 1.00 0.00 H new ATOM 0 HA LYS A 22 17.273 1.920 -7.787 1.00 0.00 H new ATOM 0 HB2 LYS A 22 19.699 3.447 -7.081 1.00 0.00 H new ATOM 0 HB3 LYS A 22 19.101 2.354 -5.849 1.00 0.00 H new ATOM 0 HG2 LYS A 22 20.292 0.782 -7.023 1.00 0.00 H new ATOM 0 HG3 LYS A 22 18.857 0.729 -8.028 1.00 0.00 H new ATOM 0 HD2 LYS A 22 19.961 2.660 -9.394 1.00 0.00 H new ATOM 0 HD3 LYS A 22 21.438 2.255 -8.542 1.00 0.00 H new ATOM 0 HE2 LYS A 22 21.056 -0.185 -9.322 1.00 0.00 H new ATOM 0 HE3 LYS A 22 19.810 0.447 -10.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 21.928 0.294 -11.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 21.451 1.919 -11.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 22.658 1.306 -10.364 1.00 0.00 H new ATOM 326 N ALA A 23 15.418 3.209 -6.508 1.00 0.00 N ATOM 327 CA ALA A 23 14.414 3.539 -5.511 1.00 0.00 C ATOM 328 C ALA A 23 13.312 2.478 -5.533 1.00 0.00 C ATOM 329 O ALA A 23 13.355 1.550 -6.340 1.00 0.00 O ATOM 330 CB ALA A 23 13.874 4.946 -5.775 1.00 0.00 C ATOM 0 H ALA A 23 15.045 2.977 -7.428 1.00 0.00 H new ATOM 0 HA ALA A 23 14.851 3.540 -4.512 1.00 0.00 H new ATOM 0 HB1 ALA A 23 13.121 5.193 -5.027 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.691 5.666 -5.719 1.00 0.00 H new ATOM 0 HB3 ALA A 23 13.425 4.983 -6.768 1.00 0.00 H new ATOM 336 N PHE A 24 12.350 2.650 -4.638 1.00 0.00 N ATOM 337 CA PHE A 24 11.239 1.719 -4.545 1.00 0.00 C ATOM 338 C PHE A 24 9.900 2.459 -4.572 1.00 0.00 C ATOM 339 O PHE A 24 9.623 3.280 -3.699 1.00 0.00 O ATOM 340 CB PHE A 24 11.378 0.988 -3.208 1.00 0.00 C ATOM 341 CG PHE A 24 10.324 -0.097 -2.979 1.00 0.00 C ATOM 342 CD1 PHE A 24 9.745 -0.717 -4.042 1.00 0.00 C ATOM 343 CD2 PHE A 24 9.966 -0.441 -1.713 1.00 0.00 C ATOM 344 CE1 PHE A 24 8.766 -1.724 -3.829 1.00 0.00 C ATOM 345 CE2 PHE A 24 8.988 -1.448 -1.500 1.00 0.00 C ATOM 346 CZ PHE A 24 8.409 -2.068 -2.563 1.00 0.00 C ATOM 0 H PHE A 24 12.317 3.421 -3.971 1.00 0.00 H new ATOM 0 HA PHE A 24 11.260 1.030 -5.389 1.00 0.00 H new ATOM 0 HB2 PHE A 24 12.368 0.535 -3.154 1.00 0.00 H new ATOM 0 HB3 PHE A 24 11.316 1.716 -2.399 1.00 0.00 H new ATOM 0 HD1 PHE A 24 10.029 -0.444 -5.047 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.426 0.052 -0.869 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.305 -2.216 -4.673 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.704 -1.721 -0.495 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.665 -2.834 -2.401 1.00 0.00 H new ATOM 356 N VAL A 25 9.104 2.141 -5.582 1.00 0.00 N ATOM 357 CA VAL A 25 7.801 2.766 -5.734 1.00 0.00 C ATOM 358 C VAL A 25 6.710 1.747 -5.398 1.00 0.00 C ATOM 359 O VAL A 25 6.521 0.772 -6.124 1.00 0.00 O ATOM 360 CB VAL A 25 7.661 3.350 -7.141 1.00 0.00 C ATOM 361 CG1 VAL A 25 6.485 4.325 -7.215 1.00 0.00 C ATOM 362 CG2 VAL A 25 8.960 4.023 -7.587 1.00 0.00 C ATOM 0 H VAL A 25 9.336 1.458 -6.303 1.00 0.00 H new ATOM 0 HA VAL A 25 7.693 3.599 -5.039 1.00 0.00 H new ATOM 0 HB VAL A 25 7.458 2.527 -7.827 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.408 4.726 -8.226 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.563 3.803 -6.960 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.645 5.142 -6.512 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.833 4.430 -8.590 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.207 4.830 -6.897 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.767 3.290 -7.592 1.00 0.00 H new ATOM 372 N VAL A 26 6.020 2.008 -4.297 1.00 0.00 N ATOM 373 CA VAL A 26 4.953 1.126 -3.856 1.00 0.00 C ATOM 374 C VAL A 26 3.602 1.769 -4.175 1.00 0.00 C ATOM 375 O VAL A 26 3.053 2.505 -3.357 1.00 0.00 O ATOM 376 CB VAL A 26 5.124 0.799 -2.371 1.00 0.00 C ATOM 377 CG1 VAL A 26 3.906 0.048 -1.831 1.00 0.00 C ATOM 378 CG2 VAL A 26 6.410 0.004 -2.130 1.00 0.00 C ATOM 0 H VAL A 26 6.179 2.818 -3.697 1.00 0.00 H new ATOM 0 HA VAL A 26 4.996 0.177 -4.391 1.00 0.00 H new ATOM 0 HB VAL A 26 5.205 1.740 -1.827 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.054 -0.172 -0.774 1.00 0.00 H new ATOM 0 HG12 VAL A 26 3.015 0.664 -1.952 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.780 -0.884 -2.381 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.508 -0.216 -1.067 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.371 -0.929 -2.691 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.268 0.590 -2.460 1.00 0.00 H new ATOM 388 N ASN A 27 3.105 1.466 -5.365 1.00 0.00 N ATOM 389 CA ASN A 27 1.828 2.006 -5.802 1.00 0.00 C ATOM 390 C ASN A 27 0.694 1.233 -5.124 1.00 0.00 C ATOM 391 O ASN A 27 0.756 0.010 -5.005 1.00 0.00 O ATOM 392 CB ASN A 27 1.658 1.863 -7.315 1.00 0.00 C ATOM 393 CG ASN A 27 0.201 2.079 -7.727 1.00 0.00 C ATOM 394 OD1 ASN A 27 -0.599 1.159 -7.780 1.00 0.00 O ATOM 395 ND2 ASN A 27 -0.099 3.343 -8.013 1.00 0.00 N ATOM 0 H ASN A 27 3.563 0.854 -6.040 1.00 0.00 H new ATOM 0 HA ASN A 27 1.799 3.062 -5.534 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.295 2.585 -7.826 1.00 0.00 H new ATOM 0 HB3 ASN A 27 1.985 0.872 -7.629 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.047 3.590 -8.297 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.619 4.065 -7.948 1.00 0.00 H new ATOM 402 N ILE A 28 -0.314 1.979 -4.696 1.00 0.00 N ATOM 403 CA ILE A 28 -1.460 1.380 -4.033 1.00 0.00 C ATOM 404 C ILE A 28 -2.716 1.629 -4.871 1.00 0.00 C ATOM 405 O ILE A 28 -3.296 2.712 -4.819 1.00 0.00 O ATOM 406 CB ILE A 28 -1.570 1.885 -2.594 1.00 0.00 C ATOM 407 CG1 ILE A 28 -0.260 1.667 -1.834 1.00 0.00 C ATOM 408 CG2 ILE A 28 -2.761 1.244 -1.878 1.00 0.00 C ATOM 409 CD1 ILE A 28 -0.418 2.025 -0.355 1.00 0.00 C ATOM 0 H ILE A 28 -0.361 2.993 -4.795 1.00 0.00 H new ATOM 0 HA ILE A 28 -1.336 0.300 -3.958 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.751 2.960 -2.622 1.00 0.00 H new ATOM 0 HG12 ILE A 28 0.051 0.627 -1.929 1.00 0.00 H new ATOM 0 HG13 ILE A 28 0.527 2.276 -2.277 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.817 1.620 -0.856 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.681 1.493 -2.407 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.635 0.161 -1.860 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.527 1.861 0.162 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -0.705 3.072 -0.263 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.189 1.397 0.091 1.00 0.00 H new ATOM 421 N LYS A 29 -3.098 0.607 -5.624 1.00 0.00 N ATOM 422 CA LYS A 29 -4.275 0.702 -6.471 1.00 0.00 C ATOM 423 C LYS A 29 -5.508 0.945 -5.598 1.00 0.00 C ATOM 424 O LYS A 29 -5.457 1.727 -4.650 1.00 0.00 O ATOM 425 CB LYS A 29 -4.390 -0.532 -7.368 1.00 0.00 C ATOM 426 CG LYS A 29 -5.060 -0.183 -8.698 1.00 0.00 C ATOM 427 CD LYS A 29 -4.779 -1.255 -9.752 1.00 0.00 C ATOM 428 CE LYS A 29 -6.026 -2.098 -10.024 1.00 0.00 C ATOM 429 NZ LYS A 29 -6.226 -2.274 -11.480 1.00 0.00 N ATOM 0 H LYS A 29 -2.614 -0.290 -5.665 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.190 1.553 -7.147 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.398 -0.945 -7.554 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.966 -1.304 -6.858 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.136 -0.084 -8.552 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -4.696 0.782 -9.050 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -4.447 -0.783 -10.676 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -3.967 -1.899 -9.413 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -5.925 -3.072 -9.545 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.900 -1.616 -9.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -7.077 -2.849 -11.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -6.343 -1.343 -11.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -5.399 -2.754 -11.889 1.00 0.00 H new ATOM 443 N GLU A 30 -6.587 0.262 -5.951 1.00 0.00 N ATOM 444 CA GLU A 30 -7.831 0.394 -5.212 1.00 0.00 C ATOM 445 C GLU A 30 -8.163 -0.916 -4.494 1.00 0.00 C ATOM 446 O GLU A 30 -7.537 -1.944 -4.747 1.00 0.00 O ATOM 447 CB GLU A 30 -8.975 0.818 -6.135 1.00 0.00 C ATOM 448 CG GLU A 30 -9.318 -0.293 -7.130 1.00 0.00 C ATOM 449 CD GLU A 30 -10.137 0.253 -8.300 1.00 0.00 C ATOM 450 OE1 GLU A 30 -9.694 1.270 -8.878 1.00 0.00 O ATOM 451 OE2 GLU A 30 -11.188 -0.358 -8.591 1.00 0.00 O ATOM 0 H GLU A 30 -6.625 -0.384 -6.739 1.00 0.00 H new ATOM 0 HA GLU A 30 -7.704 1.175 -4.462 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -9.855 1.063 -5.540 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -8.694 1.722 -6.676 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -8.400 -0.747 -7.504 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -9.879 -1.079 -6.624 1.00 0.00 H new ATOM 458 N ALA A 31 -9.148 -0.836 -3.611 1.00 0.00 N ATOM 459 CA ALA A 31 -9.571 -2.002 -2.854 1.00 0.00 C ATOM 460 C ALA A 31 -11.063 -2.245 -3.092 1.00 0.00 C ATOM 461 O ALA A 31 -11.836 -1.298 -3.227 1.00 0.00 O ATOM 462 CB ALA A 31 -9.243 -1.797 -1.374 1.00 0.00 C ATOM 0 H ALA A 31 -9.665 0.018 -3.403 1.00 0.00 H new ATOM 0 HA ALA A 31 -9.035 -2.891 -3.187 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -9.560 -2.672 -0.806 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.168 -1.658 -1.255 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -9.766 -0.915 -1.004 1.00 0.00 H new ATOM 468 N ARG A 32 -11.423 -3.520 -3.135 1.00 0.00 N ATOM 469 CA ARG A 32 -12.808 -3.900 -3.354 1.00 0.00 C ATOM 470 C ARG A 32 -13.235 -4.959 -2.337 1.00 0.00 C ATOM 471 O ARG A 32 -12.537 -5.953 -2.140 1.00 0.00 O ATOM 472 CB ARG A 32 -13.012 -4.448 -4.768 1.00 0.00 C ATOM 473 CG ARG A 32 -13.520 -3.357 -5.712 1.00 0.00 C ATOM 474 CD ARG A 32 -14.930 -3.677 -6.212 1.00 0.00 C ATOM 475 NE ARG A 32 -15.255 -2.832 -7.383 1.00 0.00 N ATOM 476 CZ ARG A 32 -14.845 -3.090 -8.632 1.00 0.00 C ATOM 477 NH1 ARG A 32 -14.090 -4.169 -8.880 1.00 0.00 N ATOM 478 NH2 ARG A 32 -15.188 -2.268 -9.633 1.00 0.00 N ATOM 0 H ARG A 32 -10.779 -4.303 -3.022 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.420 -3.007 -3.231 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -12.072 -4.851 -5.145 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -13.725 -5.272 -4.743 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -13.523 -2.397 -5.196 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -12.843 -3.261 -6.560 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -14.998 -4.731 -6.483 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.655 -3.505 -5.416 1.00 0.00 H new ATOM 0 HE ARG A 32 -15.827 -2.001 -7.229 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -13.827 -4.794 -8.118 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -13.778 -4.365 -9.831 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -15.761 -1.446 -9.444 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -14.876 -2.464 -10.584 1.00 0.00 H new ATOM 492 N GLY A 33 -14.380 -4.711 -1.717 1.00 0.00 N ATOM 493 CA GLY A 33 -14.908 -5.632 -0.725 1.00 0.00 C ATOM 494 C GLY A 33 -14.787 -5.048 0.684 1.00 0.00 C ATOM 495 O GLY A 33 -14.315 -5.719 1.600 1.00 0.00 O ATOM 0 H GLY A 33 -14.956 -3.886 -1.883 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -15.954 -5.848 -0.944 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.369 -6.578 -0.778 1.00 0.00 H new ATOM 499 N LEU A 34 -15.223 -3.803 0.813 1.00 0.00 N ATOM 500 CA LEU A 34 -15.170 -3.121 2.095 1.00 0.00 C ATOM 501 C LEU A 34 -16.587 -2.987 2.656 1.00 0.00 C ATOM 502 O LEU A 34 -17.414 -2.268 2.097 1.00 0.00 O ATOM 503 CB LEU A 34 -14.432 -1.787 1.962 1.00 0.00 C ATOM 504 CG LEU A 34 -13.171 -1.801 1.097 1.00 0.00 C ATOM 505 CD1 LEU A 34 -12.234 -0.651 1.473 1.00 0.00 C ATOM 506 CD2 LEU A 34 -12.470 -3.159 1.172 1.00 0.00 C ATOM 0 H LEU A 34 -15.614 -3.249 0.051 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.597 -3.706 2.814 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.123 -1.052 1.550 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.160 -1.444 2.960 1.00 0.00 H new ATOM 0 HG LEU A 34 -13.468 -1.648 0.059 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.345 -0.685 0.843 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -12.747 0.299 1.326 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -11.941 -0.747 2.518 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -11.576 -3.142 0.548 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -12.188 -3.366 2.204 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.146 -3.937 0.817 1.00 0.00 H new ATOM 518 N PRO A 35 -16.830 -3.708 3.783 1.00 0.00 N ATOM 519 CA PRO A 35 -18.133 -3.677 4.425 1.00 0.00 C ATOM 520 C PRO A 35 -18.340 -2.363 5.181 1.00 0.00 C ATOM 521 O PRO A 35 -17.470 -1.934 5.937 1.00 0.00 O ATOM 522 CB PRO A 35 -18.152 -4.894 5.335 1.00 0.00 C ATOM 523 CG PRO A 35 -16.699 -5.300 5.520 1.00 0.00 C ATOM 524 CD PRO A 35 -15.874 -4.570 4.472 1.00 0.00 C ATOM 0 HA PRO A 35 -18.955 -3.717 3.710 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -18.616 -4.658 6.293 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -18.730 -5.704 4.891 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -16.356 -5.044 6.522 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -16.587 -6.379 5.411 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -15.075 -3.988 4.932 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -15.402 -5.269 3.782 1.00 0.00 H new ATOM 532 N ALA A 36 -19.497 -1.760 4.949 1.00 0.00 N ATOM 533 CA ALA A 36 -19.829 -0.504 5.599 1.00 0.00 C ATOM 534 C ALA A 36 -19.512 -0.607 7.092 1.00 0.00 C ATOM 535 O ALA A 36 -19.371 -1.706 7.626 1.00 0.00 O ATOM 536 CB ALA A 36 -21.299 -0.166 5.337 1.00 0.00 C ATOM 0 H ALA A 36 -20.216 -2.118 4.320 1.00 0.00 H new ATOM 0 HA ALA A 36 -19.229 0.309 5.190 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -21.548 0.776 5.825 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -21.466 -0.074 4.264 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -21.931 -0.959 5.736 1.00 0.00 H new ATOM 542 N MET A 37 -19.410 0.553 7.724 1.00 0.00 N ATOM 543 CA MET A 37 -19.112 0.607 9.145 1.00 0.00 C ATOM 544 C MET A 37 -20.289 1.190 9.930 1.00 0.00 C ATOM 545 O MET A 37 -20.531 0.801 11.072 1.00 0.00 O ATOM 546 CB MET A 37 -17.869 1.470 9.374 1.00 0.00 C ATOM 547 CG MET A 37 -16.599 0.616 9.363 1.00 0.00 C ATOM 548 SD MET A 37 -16.365 -0.149 10.959 1.00 0.00 S ATOM 549 CE MET A 37 -15.024 -1.264 10.574 1.00 0.00 C ATOM 0 H MET A 37 -19.528 1.463 7.278 1.00 0.00 H new ATOM 0 HA MET A 37 -18.931 -0.408 9.498 1.00 0.00 H new ATOM 0 HB2 MET A 37 -17.805 2.234 8.599 1.00 0.00 H new ATOM 0 HB3 MET A 37 -17.954 1.990 10.328 1.00 0.00 H new ATOM 0 HG2 MET A 37 -16.672 -0.150 8.591 1.00 0.00 H new ATOM 0 HG3 MET A 37 -15.736 1.235 9.117 1.00 0.00 H new ATOM 0 HE1 MET A 37 -14.655 -1.721 11.493 1.00 0.00 H new ATOM 0 HE2 MET A 37 -15.380 -2.043 9.899 1.00 0.00 H new ATOM 0 HE3 MET A 37 -14.217 -0.710 10.095 1.00 0.00 H new ATOM 614 N MET A 42 -25.197 2.665 3.625 1.00 0.00 N ATOM 615 CA MET A 42 -24.284 1.632 3.167 1.00 0.00 C ATOM 616 C MET A 42 -23.066 2.245 2.474 1.00 0.00 C ATOM 617 O MET A 42 -22.874 2.064 1.272 1.00 0.00 O ATOM 618 CB MET A 42 -25.011 0.702 2.194 1.00 0.00 C ATOM 619 CG MET A 42 -24.166 -0.535 1.882 1.00 0.00 C ATOM 620 SD MET A 42 -25.170 -2.006 1.997 1.00 0.00 S ATOM 621 CE MET A 42 -24.533 -2.699 3.513 1.00 0.00 C ATOM 0 HA MET A 42 -23.940 1.068 4.034 1.00 0.00 H new ATOM 0 HB2 MET A 42 -25.965 0.396 2.622 1.00 0.00 H new ATOM 0 HB3 MET A 42 -25.233 1.237 1.271 1.00 0.00 H new ATOM 0 HG2 MET A 42 -23.741 -0.452 0.882 1.00 0.00 H new ATOM 0 HG3 MET A 42 -23.330 -0.600 2.579 1.00 0.00 H new ATOM 0 HE1 MET A 42 -25.055 -3.630 3.735 1.00 0.00 H new ATOM 0 HE2 MET A 42 -23.467 -2.898 3.402 1.00 0.00 H new ATOM 0 HE3 MET A 42 -24.687 -1.993 4.329 1.00 0.00 H new ATOM 631 N THR A 43 -22.273 2.958 3.261 1.00 0.00 N ATOM 632 CA THR A 43 -21.079 3.599 2.738 1.00 0.00 C ATOM 633 C THR A 43 -20.095 3.898 3.870 1.00 0.00 C ATOM 634 O THR A 43 -20.464 3.867 5.043 1.00 0.00 O ATOM 635 CB THR A 43 -21.512 4.846 1.964 1.00 0.00 C ATOM 636 OG1 THR A 43 -20.300 5.345 1.404 1.00 0.00 O ATOM 637 CG2 THR A 43 -21.988 5.971 2.885 1.00 0.00 C ATOM 0 H THR A 43 -22.435 3.106 4.257 1.00 0.00 H new ATOM 0 HA THR A 43 -20.546 2.942 2.051 1.00 0.00 H new ATOM 0 HB THR A 43 -22.310 4.583 1.270 1.00 0.00 H new ATOM 0 HG1 THR A 43 -19.989 4.736 0.701 1.00 0.00 H new ATOM 0 HG21 THR A 43 -22.283 6.832 2.285 1.00 0.00 H new ATOM 0 HG22 THR A 43 -22.841 5.626 3.470 1.00 0.00 H new ATOM 0 HG23 THR A 43 -21.179 6.258 3.557 1.00 0.00 H new ATOM 645 N SER A 44 -18.861 4.181 3.479 1.00 0.00 N ATOM 646 CA SER A 44 -17.820 4.485 4.447 1.00 0.00 C ATOM 647 C SER A 44 -16.625 5.132 3.744 1.00 0.00 C ATOM 648 O SER A 44 -16.611 5.254 2.520 1.00 0.00 O ATOM 649 CB SER A 44 -17.378 3.226 5.195 1.00 0.00 C ATOM 650 OG SER A 44 -18.268 2.896 6.258 1.00 0.00 O ATOM 0 H SER A 44 -18.558 4.206 2.505 1.00 0.00 H new ATOM 0 HA SER A 44 -18.226 5.184 5.178 1.00 0.00 H new ATOM 0 HB2 SER A 44 -17.322 2.391 4.497 1.00 0.00 H new ATOM 0 HB3 SER A 44 -16.375 3.375 5.595 1.00 0.00 H new ATOM 0 HG SER A 44 -19.140 3.314 6.096 1.00 0.00 H new ATOM 656 N ASP A 45 -15.651 5.530 4.549 1.00 0.00 N ATOM 657 CA ASP A 45 -14.454 6.161 4.020 1.00 0.00 C ATOM 658 C ASP A 45 -13.221 5.408 4.521 1.00 0.00 C ATOM 659 O ASP A 45 -12.437 5.943 5.304 1.00 0.00 O ATOM 660 CB ASP A 45 -14.344 7.614 4.489 1.00 0.00 C ATOM 661 CG ASP A 45 -14.709 7.848 5.956 1.00 0.00 C ATOM 662 OD1 ASP A 45 -14.848 6.836 6.676 1.00 0.00 O ATOM 663 OD2 ASP A 45 -14.840 9.035 6.325 1.00 0.00 O ATOM 0 H ASP A 45 -15.666 5.428 5.564 1.00 0.00 H new ATOM 0 HA ASP A 45 -14.513 6.137 2.932 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -13.322 7.957 4.325 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -14.991 8.231 3.866 1.00 0.00 H new ATOM 668 N PRO A 46 -13.083 4.144 4.037 1.00 0.00 N ATOM 669 CA PRO A 46 -11.958 3.312 4.428 1.00 0.00 C ATOM 670 C PRO A 46 -10.675 3.758 3.725 1.00 0.00 C ATOM 671 O PRO A 46 -10.728 4.448 2.707 1.00 0.00 O ATOM 672 CB PRO A 46 -12.372 1.895 4.065 1.00 0.00 C ATOM 673 CG PRO A 46 -13.509 2.037 3.066 1.00 0.00 C ATOM 674 CD PRO A 46 -13.990 3.478 3.108 1.00 0.00 C ATOM 0 HA PRO A 46 -11.730 3.387 5.491 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.538 1.343 3.632 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -12.694 1.344 4.948 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -13.170 1.777 2.063 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -14.323 1.356 3.315 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -13.952 3.937 2.120 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -15.023 3.541 3.450 1.00 0.00 H new ATOM 682 N TYR A 47 -9.551 3.347 4.295 1.00 0.00 N ATOM 683 CA TYR A 47 -8.257 3.697 3.735 1.00 0.00 C ATOM 684 C TYR A 47 -7.187 2.687 4.157 1.00 0.00 C ATOM 685 O TYR A 47 -7.191 2.210 5.291 1.00 0.00 O ATOM 686 CB TYR A 47 -7.903 5.068 4.314 1.00 0.00 C ATOM 687 CG TYR A 47 -7.515 5.038 5.794 1.00 0.00 C ATOM 688 CD1 TYR A 47 -8.493 4.928 6.761 1.00 0.00 C ATOM 689 CD2 TYR A 47 -6.188 5.122 6.161 1.00 0.00 C ATOM 690 CE1 TYR A 47 -8.129 4.899 8.154 1.00 0.00 C ATOM 691 CE2 TYR A 47 -5.823 5.093 7.554 1.00 0.00 C ATOM 692 CZ TYR A 47 -6.811 4.984 8.481 1.00 0.00 C ATOM 693 OH TYR A 47 -6.467 4.957 9.797 1.00 0.00 O ATOM 0 H TYR A 47 -9.510 2.775 5.139 1.00 0.00 H new ATOM 0 HA TYR A 47 -8.299 3.702 2.646 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.078 5.491 3.741 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -8.755 5.736 4.186 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -9.532 4.864 6.473 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -5.423 5.210 5.404 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -8.884 4.812 8.921 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -4.788 5.156 7.855 1.00 0.00 H new ATOM 0 HH TYR A 47 -7.276 4.876 10.345 1.00 0.00 H new ATOM 703 N ILE A 48 -6.296 2.392 3.222 1.00 0.00 N ATOM 704 CA ILE A 48 -5.223 1.448 3.482 1.00 0.00 C ATOM 705 C ILE A 48 -3.998 2.205 3.999 1.00 0.00 C ATOM 706 O ILE A 48 -3.730 3.326 3.570 1.00 0.00 O ATOM 707 CB ILE A 48 -4.942 0.600 2.240 1.00 0.00 C ATOM 708 CG1 ILE A 48 -6.229 -0.033 1.706 1.00 0.00 C ATOM 709 CG2 ILE A 48 -3.863 -0.448 2.524 1.00 0.00 C ATOM 710 CD1 ILE A 48 -5.946 -0.893 0.472 1.00 0.00 C ATOM 0 H ILE A 48 -6.295 2.790 2.283 1.00 0.00 H new ATOM 0 HA ILE A 48 -5.516 0.744 4.261 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.557 1.255 1.459 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -6.687 -0.645 2.483 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -6.945 0.749 1.452 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.682 -1.037 1.625 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -2.941 0.051 2.822 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -4.196 -1.105 3.327 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -6.877 -1.331 0.113 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -5.510 -0.273 -0.312 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -5.249 -1.688 0.735 1.00 0.00 H new ATOM 722 N LYS A 49 -3.287 1.562 4.915 1.00 0.00 N ATOM 723 CA LYS A 49 -2.097 2.161 5.495 1.00 0.00 C ATOM 724 C LYS A 49 -0.869 1.348 5.081 1.00 0.00 C ATOM 725 O LYS A 49 -0.843 0.129 5.244 1.00 0.00 O ATOM 726 CB LYS A 49 -2.256 2.308 7.009 1.00 0.00 C ATOM 727 CG LYS A 49 -3.026 3.583 7.359 1.00 0.00 C ATOM 728 CD LYS A 49 -3.146 3.753 8.875 1.00 0.00 C ATOM 729 CE LYS A 49 -2.540 5.083 9.327 1.00 0.00 C ATOM 730 NZ LYS A 49 -1.169 4.878 9.847 1.00 0.00 N ATOM 0 H LYS A 49 -3.513 0.632 5.269 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.954 3.172 5.113 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.781 1.441 7.409 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.274 2.331 7.481 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.518 4.448 6.932 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -4.020 3.545 6.914 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -4.195 3.709 9.168 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -2.640 2.929 9.378 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -2.517 5.782 8.491 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -3.165 5.530 10.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -0.772 5.791 10.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.199 4.228 10.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -0.571 4.472 9.099 1.00 0.00 H new ATOM 744 N MET A 50 0.119 2.056 4.553 1.00 0.00 N ATOM 745 CA MET A 50 1.347 1.416 4.115 1.00 0.00 C ATOM 746 C MET A 50 2.427 1.503 5.196 1.00 0.00 C ATOM 747 O MET A 50 2.446 2.447 5.984 1.00 0.00 O ATOM 748 CB MET A 50 1.848 2.092 2.837 1.00 0.00 C ATOM 749 CG MET A 50 2.443 1.066 1.871 1.00 0.00 C ATOM 750 SD MET A 50 4.103 0.645 2.373 1.00 0.00 S ATOM 751 CE MET A 50 5.007 1.976 1.600 1.00 0.00 C ATOM 0 H MET A 50 0.094 3.067 4.419 1.00 0.00 H new ATOM 0 HA MET A 50 1.137 0.364 3.922 1.00 0.00 H new ATOM 0 HB2 MET A 50 1.025 2.618 2.353 1.00 0.00 H new ATOM 0 HB3 MET A 50 2.600 2.840 3.088 1.00 0.00 H new ATOM 0 HG2 MET A 50 1.822 0.170 1.851 1.00 0.00 H new ATOM 0 HG3 MET A 50 2.452 1.470 0.859 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.624 1.577 0.795 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.305 2.704 1.192 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.644 2.461 2.340 1.00 0.00 H new ATOM 761 N THR A 51 3.299 0.505 5.197 1.00 0.00 N ATOM 762 CA THR A 51 4.380 0.458 6.168 1.00 0.00 C ATOM 763 C THR A 51 5.519 -0.425 5.655 1.00 0.00 C ATOM 764 O THR A 51 5.289 -1.557 5.230 1.00 0.00 O ATOM 765 CB THR A 51 3.797 -0.016 7.501 1.00 0.00 C ATOM 766 OG1 THR A 51 2.947 1.052 7.907 1.00 0.00 O ATOM 767 CG2 THR A 51 4.852 -0.095 8.606 1.00 0.00 C ATOM 0 H THR A 51 3.279 -0.276 4.542 1.00 0.00 H new ATOM 0 HA THR A 51 4.818 1.444 6.320 1.00 0.00 H new ATOM 0 HB THR A 51 3.337 -0.995 7.369 1.00 0.00 H new ATOM 0 HG1 THR A 51 3.180 1.863 7.409 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.386 -0.436 9.530 1.00 0.00 H new ATOM 0 HG22 THR A 51 5.634 -0.796 8.313 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.289 0.891 8.763 1.00 0.00 H new ATOM 775 N ILE A 52 6.723 0.126 5.710 1.00 0.00 N ATOM 776 CA ILE A 52 7.898 -0.598 5.257 1.00 0.00 C ATOM 777 C ILE A 52 8.448 -1.442 6.408 1.00 0.00 C ATOM 778 O ILE A 52 9.293 -0.981 7.173 1.00 0.00 O ATOM 779 CB ILE A 52 8.923 0.368 4.658 1.00 0.00 C ATOM 780 CG1 ILE A 52 8.343 1.103 3.449 1.00 0.00 C ATOM 781 CG2 ILE A 52 10.226 -0.358 4.317 1.00 0.00 C ATOM 782 CD1 ILE A 52 9.453 1.552 2.496 1.00 0.00 C ATOM 0 H ILE A 52 6.910 1.065 6.061 1.00 0.00 H new ATOM 0 HA ILE A 52 7.635 -1.287 4.454 1.00 0.00 H new ATOM 0 HB ILE A 52 9.161 1.122 5.408 1.00 0.00 H new ATOM 0 HG12 ILE A 52 7.648 0.450 2.921 1.00 0.00 H new ATOM 0 HG13 ILE A 52 7.774 1.970 3.785 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.937 0.351 3.893 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.646 -0.796 5.222 1.00 0.00 H new ATOM 0 HG23 ILE A 52 10.024 -1.147 3.592 1.00 0.00 H new ATOM 0 HD11 ILE A 52 9.013 2.072 1.645 1.00 0.00 H new ATOM 0 HD12 ILE A 52 10.133 2.224 3.020 1.00 0.00 H new ATOM 0 HD13 ILE A 52 10.004 0.680 2.143 1.00 0.00 H new ATOM 794 N LEU A 53 7.945 -2.665 6.494 1.00 0.00 N ATOM 795 CA LEU A 53 8.376 -3.579 7.539 1.00 0.00 C ATOM 796 C LEU A 53 9.653 -4.293 7.093 1.00 0.00 C ATOM 797 O LEU A 53 9.918 -4.409 5.897 1.00 0.00 O ATOM 798 CB LEU A 53 7.240 -4.531 7.919 1.00 0.00 C ATOM 799 CG LEU A 53 6.068 -3.907 8.679 1.00 0.00 C ATOM 800 CD1 LEU A 53 6.561 -3.102 9.883 1.00 0.00 C ATOM 801 CD2 LEU A 53 5.195 -3.066 7.746 1.00 0.00 C ATOM 0 H LEU A 53 7.244 -3.044 5.858 1.00 0.00 H new ATOM 0 HA LEU A 53 8.619 -3.030 8.448 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.854 -4.987 7.007 1.00 0.00 H new ATOM 0 HB3 LEU A 53 7.655 -5.335 8.527 1.00 0.00 H new ATOM 0 HG LEU A 53 5.444 -4.713 9.065 1.00 0.00 H new ATOM 0 HD11 LEU A 53 5.708 -2.669 10.405 1.00 0.00 H new ATOM 0 HD12 LEU A 53 7.107 -3.758 10.561 1.00 0.00 H new ATOM 0 HD13 LEU A 53 7.220 -2.304 9.542 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.369 -2.634 8.311 1.00 0.00 H new ATOM 0 HD22 LEU A 53 5.794 -2.266 7.310 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.799 -3.698 6.951 1.00 0.00 H new ATOM 813 N PRO A 54 10.432 -4.764 8.103 1.00 0.00 N ATOM 814 CA PRO A 54 10.045 -4.583 9.492 1.00 0.00 C ATOM 815 C PRO A 54 10.275 -3.139 9.942 1.00 0.00 C ATOM 816 O PRO A 54 9.604 -2.654 10.851 1.00 0.00 O ATOM 817 CB PRO A 54 10.883 -5.587 10.267 1.00 0.00 C ATOM 818 CG PRO A 54 12.035 -5.965 9.351 1.00 0.00 C ATOM 819 CD PRO A 54 11.696 -5.478 7.951 1.00 0.00 C ATOM 0 HA PRO A 54 8.982 -4.757 9.659 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.250 -5.154 11.197 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.293 -6.464 10.535 1.00 0.00 H new ATOM 0 HG2 PRO A 54 12.964 -5.512 9.698 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.186 -7.044 9.354 1.00 0.00 H new ATOM 0 HD2 PRO A 54 12.475 -4.824 7.560 1.00 0.00 H new ATOM 0 HD3 PRO A 54 11.599 -6.311 7.255 1.00 0.00 H new ATOM 827 N GLU A 55 11.226 -2.492 9.284 1.00 0.00 N ATOM 828 CA GLU A 55 11.553 -1.113 9.604 1.00 0.00 C ATOM 829 C GLU A 55 10.372 -0.436 10.302 1.00 0.00 C ATOM 830 O GLU A 55 10.430 -0.158 11.499 1.00 0.00 O ATOM 831 CB GLU A 55 11.964 -0.341 8.349 1.00 0.00 C ATOM 832 CG GLU A 55 13.482 -0.371 8.159 1.00 0.00 C ATOM 833 CD GLU A 55 13.867 -1.238 6.958 1.00 0.00 C ATOM 834 OE1 GLU A 55 13.420 -2.405 6.934 1.00 0.00 O ATOM 835 OE2 GLU A 55 14.600 -0.714 6.092 1.00 0.00 O ATOM 0 H GLU A 55 11.781 -2.898 8.530 1.00 0.00 H new ATOM 0 HA GLU A 55 12.403 -1.111 10.286 1.00 0.00 H new ATOM 0 HB2 GLU A 55 11.476 -0.774 7.476 1.00 0.00 H new ATOM 0 HB3 GLU A 55 11.624 0.692 8.425 1.00 0.00 H new ATOM 0 HG2 GLU A 55 13.854 0.643 8.014 1.00 0.00 H new ATOM 0 HG3 GLU A 55 13.957 -0.759 9.060 1.00 0.00 H new ATOM 842 N LYS A 56 9.328 -0.191 9.525 1.00 0.00 N ATOM 843 CA LYS A 56 8.135 0.449 10.053 1.00 0.00 C ATOM 844 C LYS A 56 8.370 1.957 10.150 1.00 0.00 C ATOM 845 O LYS A 56 7.531 2.688 10.675 1.00 0.00 O ATOM 846 CB LYS A 56 7.724 -0.196 11.379 1.00 0.00 C ATOM 847 CG LYS A 56 6.223 -0.033 11.626 1.00 0.00 C ATOM 848 CD LYS A 56 5.858 -0.421 13.060 1.00 0.00 C ATOM 849 CE LYS A 56 4.604 -1.296 13.090 1.00 0.00 C ATOM 850 NZ LYS A 56 3.756 -0.949 14.252 1.00 0.00 N ATOM 0 H LYS A 56 9.283 -0.424 8.533 1.00 0.00 H new ATOM 0 HA LYS A 56 7.293 0.301 9.377 1.00 0.00 H new ATOM 0 HB2 LYS A 56 7.981 -1.255 11.367 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.282 0.259 12.197 1.00 0.00 H new ATOM 0 HG2 LYS A 56 5.930 1.000 11.439 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.666 -0.654 10.924 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.690 -0.956 13.518 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.692 0.479 13.653 1.00 0.00 H new ATOM 0 HE2 LYS A 56 4.039 -1.163 12.168 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.888 -2.347 13.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 2.909 -1.553 14.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 4.293 -1.099 15.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 3.469 0.049 14.187 1.00 0.00 H new ATOM 864 N LYS A 57 9.516 2.379 9.636 1.00 0.00 N ATOM 865 CA LYS A 57 9.872 3.788 9.658 1.00 0.00 C ATOM 866 C LYS A 57 8.985 4.550 8.672 1.00 0.00 C ATOM 867 O LYS A 57 7.996 5.164 9.068 1.00 0.00 O ATOM 868 CB LYS A 57 11.370 3.966 9.402 1.00 0.00 C ATOM 869 CG LYS A 57 12.081 4.494 10.650 1.00 0.00 C ATOM 870 CD LYS A 57 11.643 5.926 10.965 1.00 0.00 C ATOM 871 CE LYS A 57 12.591 6.579 11.973 1.00 0.00 C ATOM 872 NZ LYS A 57 12.374 8.043 12.015 1.00 0.00 N ATOM 0 H LYS A 57 10.210 1.770 9.202 1.00 0.00 H new ATOM 0 HA LYS A 57 9.688 4.212 10.645 1.00 0.00 H new ATOM 0 HB2 LYS A 57 11.808 3.013 9.106 1.00 0.00 H new ATOM 0 HB3 LYS A 57 11.521 4.657 8.573 1.00 0.00 H new ATOM 0 HG2 LYS A 57 11.861 3.847 11.499 1.00 0.00 H new ATOM 0 HG3 LYS A 57 13.160 4.465 10.498 1.00 0.00 H new ATOM 0 HD2 LYS A 57 11.621 6.514 10.047 1.00 0.00 H new ATOM 0 HD3 LYS A 57 10.629 5.921 11.365 1.00 0.00 H new ATOM 0 HE2 LYS A 57 12.429 6.153 12.963 1.00 0.00 H new ATOM 0 HE3 LYS A 57 13.625 6.366 11.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 13.025 8.471 12.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 12.551 8.447 11.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 11.393 8.241 12.297 1.00 0.00 H new ATOM 886 N HIS A 58 9.370 4.484 7.406 1.00 0.00 N ATOM 887 CA HIS A 58 8.622 5.160 6.360 1.00 0.00 C ATOM 888 C HIS A 58 7.163 4.700 6.393 1.00 0.00 C ATOM 889 O HIS A 58 6.795 3.740 5.717 1.00 0.00 O ATOM 890 CB HIS A 58 9.280 4.945 4.995 1.00 0.00 C ATOM 891 CG HIS A 58 10.770 5.189 4.987 1.00 0.00 C ATOM 892 ND1 HIS A 58 11.386 6.097 5.831 1.00 0.00 N ATOM 893 CD2 HIS A 58 11.760 4.633 4.231 1.00 0.00 C ATOM 894 CE1 HIS A 58 12.688 6.082 5.583 1.00 0.00 C ATOM 895 NE2 HIS A 58 12.918 5.174 4.591 1.00 0.00 N ATOM 0 H HIS A 58 10.190 3.973 7.081 1.00 0.00 H new ATOM 0 HA HIS A 58 8.632 6.235 6.538 1.00 0.00 H new ATOM 0 HB2 HIS A 58 9.088 3.923 4.667 1.00 0.00 H new ATOM 0 HB3 HIS A 58 8.810 5.607 4.268 1.00 0.00 H new ATOM 0 HD2 HIS A 58 11.625 3.880 3.469 1.00 0.00 H new ATOM 0 HE1 HIS A 58 13.436 6.683 6.079 1.00 0.00 H new ATOM 0 HE2 HIS A 58 13.829 4.948 4.192 1.00 0.00 H new ATOM 903 N LYS A 59 6.372 5.406 7.187 1.00 0.00 N ATOM 904 CA LYS A 59 4.961 5.082 7.318 1.00 0.00 C ATOM 905 C LYS A 59 4.139 6.052 6.467 1.00 0.00 C ATOM 906 O LYS A 59 4.148 7.257 6.710 1.00 0.00 O ATOM 907 CB LYS A 59 4.552 5.058 8.792 1.00 0.00 C ATOM 908 CG LYS A 59 4.959 3.739 9.452 1.00 0.00 C ATOM 909 CD LYS A 59 4.769 3.804 10.969 1.00 0.00 C ATOM 910 CE LYS A 59 3.398 3.259 11.374 1.00 0.00 C ATOM 911 NZ LYS A 59 3.073 3.655 12.763 1.00 0.00 N ATOM 0 H LYS A 59 6.681 6.201 7.746 1.00 0.00 H new ATOM 0 HA LYS A 59 4.763 4.079 6.940 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.020 5.891 9.317 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.474 5.194 8.876 1.00 0.00 H new ATOM 0 HG2 LYS A 59 4.363 2.924 9.042 1.00 0.00 H new ATOM 0 HG3 LYS A 59 6.001 3.519 9.221 1.00 0.00 H new ATOM 0 HD2 LYS A 59 5.553 3.229 11.462 1.00 0.00 H new ATOM 0 HD3 LYS A 59 4.869 4.835 11.308 1.00 0.00 H new ATOM 0 HE2 LYS A 59 2.635 3.636 10.694 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.392 2.172 11.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 2.139 3.277 13.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 3.793 3.274 13.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 3.058 4.692 12.834 1.00 0.00 H new ATOM 925 N VAL A 60 3.448 5.489 5.486 1.00 0.00 N ATOM 926 CA VAL A 60 2.622 6.289 4.598 1.00 0.00 C ATOM 927 C VAL A 60 1.236 5.650 4.485 1.00 0.00 C ATOM 928 O VAL A 60 1.106 4.428 4.537 1.00 0.00 O ATOM 929 CB VAL A 60 3.317 6.453 3.245 1.00 0.00 C ATOM 930 CG1 VAL A 60 4.545 7.358 3.366 1.00 0.00 C ATOM 931 CG2 VAL A 60 3.693 5.094 2.652 1.00 0.00 C ATOM 0 H VAL A 60 3.443 4.489 5.287 1.00 0.00 H new ATOM 0 HA VAL A 60 2.486 7.292 5.002 1.00 0.00 H new ATOM 0 HB VAL A 60 2.614 6.932 2.563 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.021 7.458 2.390 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.239 8.341 3.723 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.252 6.920 4.071 1.00 0.00 H new ATOM 0 HG21 VAL A 60 4.185 5.240 1.691 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.370 4.575 3.331 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.792 4.497 2.511 1.00 0.00 H new ATOM 941 N LYS A 61 0.236 6.506 4.332 1.00 0.00 N ATOM 942 CA LYS A 61 -1.135 6.041 4.211 1.00 0.00 C ATOM 943 C LYS A 61 -1.770 6.658 2.964 1.00 0.00 C ATOM 944 O LYS A 61 -1.229 7.602 2.390 1.00 0.00 O ATOM 945 CB LYS A 61 -1.911 6.320 5.499 1.00 0.00 C ATOM 946 CG LYS A 61 -2.190 7.816 5.658 1.00 0.00 C ATOM 947 CD LYS A 61 -3.576 8.055 6.260 1.00 0.00 C ATOM 948 CE LYS A 61 -4.585 8.439 5.176 1.00 0.00 C ATOM 949 NZ LYS A 61 -5.342 9.646 5.576 1.00 0.00 N ATOM 0 H LYS A 61 0.348 7.519 4.289 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.160 4.959 4.080 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -2.852 5.770 5.487 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.342 5.959 6.356 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -1.430 8.265 6.297 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -2.122 8.307 4.687 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -3.914 7.155 6.774 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -3.520 8.847 7.007 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -4.065 8.624 4.236 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -5.273 7.612 5.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -6.022 9.893 4.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -5.854 9.457 6.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -4.683 10.438 5.719 1.00 0.00 H new ATOM 963 N THR A 62 -2.910 6.101 2.581 1.00 0.00 N ATOM 964 CA THR A 62 -3.625 6.586 1.413 1.00 0.00 C ATOM 965 C THR A 62 -4.879 7.353 1.835 1.00 0.00 C ATOM 966 O THR A 62 -5.605 6.919 2.729 1.00 0.00 O ATOM 967 CB THR A 62 -3.921 5.387 0.509 1.00 0.00 C ATOM 968 OG1 THR A 62 -4.772 4.560 1.298 1.00 0.00 O ATOM 969 CG2 THR A 62 -2.685 4.521 0.262 1.00 0.00 C ATOM 0 H THR A 62 -3.356 5.318 3.059 1.00 0.00 H new ATOM 0 HA THR A 62 -3.023 7.297 0.848 1.00 0.00 H new ATOM 0 HB THR A 62 -4.314 5.740 -0.445 1.00 0.00 H new ATOM 0 HG1 THR A 62 -4.237 4.086 1.969 1.00 0.00 H new ATOM 0 HG21 THR A 62 -2.950 3.685 -0.385 1.00 0.00 H new ATOM 0 HG22 THR A 62 -1.911 5.120 -0.218 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.312 4.140 1.213 1.00 0.00 H new ATOM 977 N ARG A 63 -5.096 8.479 1.172 1.00 0.00 N ATOM 978 CA ARG A 63 -6.251 9.311 1.468 1.00 0.00 C ATOM 979 C ARG A 63 -7.522 8.460 1.507 1.00 0.00 C ATOM 980 O ARG A 63 -7.734 7.615 0.639 1.00 0.00 O ATOM 981 CB ARG A 63 -6.416 10.415 0.422 1.00 0.00 C ATOM 982 CG ARG A 63 -7.249 11.574 0.975 1.00 0.00 C ATOM 983 CD ARG A 63 -8.191 12.131 -0.094 1.00 0.00 C ATOM 984 NE ARG A 63 -8.147 13.610 -0.086 1.00 0.00 N ATOM 985 CZ ARG A 63 -7.259 14.339 -0.776 1.00 0.00 C ATOM 986 NH1 ARG A 63 -6.335 13.730 -1.532 1.00 0.00 N ATOM 987 NH2 ARG A 63 -7.293 15.677 -0.709 1.00 0.00 N ATOM 0 H ARG A 63 -4.492 8.835 0.431 1.00 0.00 H new ATOM 0 HA ARG A 63 -6.088 9.771 2.443 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.436 10.780 0.116 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.897 10.009 -0.468 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -7.828 11.233 1.833 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.588 12.365 1.330 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.903 11.756 -1.076 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -9.209 11.788 0.092 1.00 0.00 H new ATOM 0 HE ARG A 63 -8.836 14.106 0.480 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -6.308 12.712 -1.582 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -5.659 14.285 -2.057 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -7.995 16.141 -0.133 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -6.617 16.231 -1.234 1.00 0.00 H new ATOM 1001 N VAL A 64 -8.334 8.714 2.523 1.00 0.00 N ATOM 1002 CA VAL A 64 -9.579 7.982 2.686 1.00 0.00 C ATOM 1003 C VAL A 64 -10.660 8.622 1.814 1.00 0.00 C ATOM 1004 O VAL A 64 -10.870 9.833 1.867 1.00 0.00 O ATOM 1005 CB VAL A 64 -9.961 7.924 4.167 1.00 0.00 C ATOM 1006 CG1 VAL A 64 -8.716 7.940 5.055 1.00 0.00 C ATOM 1007 CG2 VAL A 64 -10.911 9.066 4.532 1.00 0.00 C ATOM 0 H VAL A 64 -8.154 9.416 3.241 1.00 0.00 H new ATOM 0 HA VAL A 64 -9.463 6.951 2.353 1.00 0.00 H new ATOM 0 HB VAL A 64 -10.484 6.984 4.342 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -9.015 7.898 6.102 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -8.091 7.078 4.821 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.153 8.856 4.875 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -11.167 9.002 5.590 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.425 10.021 4.333 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -11.819 8.989 3.934 1.00 0.00 H new ATOM 1017 N LEU A 65 -11.319 7.780 1.031 1.00 0.00 N ATOM 1018 CA LEU A 65 -12.374 8.249 0.148 1.00 0.00 C ATOM 1019 C LEU A 65 -13.562 8.723 0.988 1.00 0.00 C ATOM 1020 O LEU A 65 -13.576 8.547 2.205 1.00 0.00 O ATOM 1021 CB LEU A 65 -12.735 7.170 -0.875 1.00 0.00 C ATOM 1022 CG LEU A 65 -11.780 7.023 -2.061 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -11.604 8.355 -2.792 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -10.440 6.432 -1.615 1.00 0.00 C ATOM 0 H LEU A 65 -11.143 6.776 0.990 1.00 0.00 H new ATOM 0 HA LEU A 65 -12.032 9.105 -0.434 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.791 6.212 -0.358 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -13.732 7.383 -1.261 1.00 0.00 H new ATOM 0 HG LEU A 65 -12.221 6.323 -2.770 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.920 8.222 -3.631 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -12.570 8.697 -3.162 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.196 9.096 -2.105 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.779 6.338 -2.477 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -9.981 7.088 -0.876 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.605 5.449 -1.175 1.00 0.00 H new ATOM 1036 N ARG A 66 -14.529 9.316 0.304 1.00 0.00 N ATOM 1037 CA ARG A 66 -15.719 9.817 0.971 1.00 0.00 C ATOM 1038 C ARG A 66 -16.957 9.057 0.491 1.00 0.00 C ATOM 1039 O ARG A 66 -17.235 9.009 -0.706 1.00 0.00 O ATOM 1040 CB ARG A 66 -15.911 11.311 0.705 1.00 0.00 C ATOM 1041 CG ARG A 66 -14.719 12.118 1.221 1.00 0.00 C ATOM 1042 CD ARG A 66 -14.224 11.569 2.561 1.00 0.00 C ATOM 1043 NE ARG A 66 -13.483 12.619 3.296 1.00 0.00 N ATOM 1044 CZ ARG A 66 -13.227 12.578 4.610 1.00 0.00 C ATOM 1045 NH1 ARG A 66 -13.652 11.539 5.343 1.00 0.00 N ATOM 1046 NH2 ARG A 66 -12.548 13.575 5.193 1.00 0.00 N ATOM 0 H ARG A 66 -14.513 9.461 -0.706 1.00 0.00 H new ATOM 0 HA ARG A 66 -15.588 9.664 2.042 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -16.034 11.481 -0.365 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -16.825 11.656 1.189 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -13.911 12.087 0.490 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -15.005 13.163 1.336 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -15.069 11.224 3.157 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -13.579 10.706 2.394 1.00 0.00 H new ATOM 0 HE ARG A 66 -13.146 13.424 2.768 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -14.170 10.780 4.900 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -13.457 11.507 6.344 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -12.225 14.366 4.636 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -12.354 13.543 6.194 1.00 0.00 H new ATOM 1060 N LYS A 67 -17.667 8.481 1.450 1.00 0.00 N ATOM 1061 CA LYS A 67 -18.869 7.725 1.140 1.00 0.00 C ATOM 1062 C LYS A 67 -18.589 6.791 -0.039 1.00 0.00 C ATOM 1063 O LYS A 67 -18.851 7.142 -1.189 1.00 0.00 O ATOM 1064 CB LYS A 67 -20.051 8.669 0.910 1.00 0.00 C ATOM 1065 CG LYS A 67 -20.774 8.973 2.224 1.00 0.00 C ATOM 1066 CD LYS A 67 -21.224 10.435 2.276 1.00 0.00 C ATOM 1067 CE LYS A 67 -21.481 10.878 3.718 1.00 0.00 C ATOM 1068 NZ LYS A 67 -22.114 12.215 3.744 1.00 0.00 N ATOM 0 H LYS A 67 -17.433 8.523 2.442 1.00 0.00 H new ATOM 0 HA LYS A 67 -19.152 7.097 1.984 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -19.697 9.598 0.462 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -20.748 8.219 0.203 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -21.639 8.318 2.327 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -20.113 8.762 3.064 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -20.461 11.070 1.827 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -22.132 10.561 1.686 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -22.125 10.154 4.218 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -20.541 10.903 4.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -22.282 12.501 4.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -21.486 12.905 3.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -23.020 12.180 3.235 1.00 0.00 H new ATOM 1082 N THR A 68 -18.060 5.621 0.287 1.00 0.00 N ATOM 1083 CA THR A 68 -17.742 4.634 -0.731 1.00 0.00 C ATOM 1084 C THR A 68 -17.308 3.319 -0.081 1.00 0.00 C ATOM 1085 O THR A 68 -16.801 3.313 1.039 1.00 0.00 O ATOM 1086 CB THR A 68 -16.681 5.234 -1.656 1.00 0.00 C ATOM 1087 OG1 THR A 68 -16.830 4.507 -2.872 1.00 0.00 O ATOM 1088 CG2 THR A 68 -15.257 4.910 -1.200 1.00 0.00 C ATOM 0 H THR A 68 -17.844 5.334 1.242 1.00 0.00 H new ATOM 0 HA THR A 68 -18.618 4.390 -1.332 1.00 0.00 H new ATOM 0 HB THR A 68 -16.810 6.315 -1.704 1.00 0.00 H new ATOM 0 HG1 THR A 68 -16.181 4.833 -3.530 1.00 0.00 H new ATOM 0 HG21 THR A 68 -14.543 5.359 -1.890 1.00 0.00 H new ATOM 0 HG22 THR A 68 -15.095 5.311 -0.199 1.00 0.00 H new ATOM 0 HG23 THR A 68 -15.117 3.829 -1.185 1.00 0.00 H new ATOM 1096 N LEU A 69 -17.525 2.235 -0.812 1.00 0.00 N ATOM 1097 CA LEU A 69 -17.162 0.916 -0.321 1.00 0.00 C ATOM 1098 C LEU A 69 -15.911 0.430 -1.054 1.00 0.00 C ATOM 1099 O LEU A 69 -15.177 -0.415 -0.544 1.00 0.00 O ATOM 1100 CB LEU A 69 -18.350 -0.041 -0.431 1.00 0.00 C ATOM 1101 CG LEU A 69 -19.494 0.192 0.559 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -20.324 -1.079 0.746 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -18.965 0.733 1.889 1.00 0.00 C ATOM 0 H LEU A 69 -17.948 2.243 -1.740 1.00 0.00 H new ATOM 0 HA LEU A 69 -16.913 0.959 0.739 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -18.752 0.025 -1.442 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -17.984 -1.059 -0.300 1.00 0.00 H new ATOM 0 HG LEU A 69 -20.157 0.951 0.144 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -21.130 -0.886 1.454 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -20.747 -1.381 -0.212 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -19.687 -1.876 1.129 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -19.797 0.890 2.575 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -18.268 0.015 2.322 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -18.452 1.679 1.719 1.00 0.00 H new ATOM 1115 N ASP A 70 -15.705 0.985 -2.240 1.00 0.00 N ATOM 1116 CA ASP A 70 -14.555 0.618 -3.048 1.00 0.00 C ATOM 1117 C ASP A 70 -13.721 1.868 -3.338 1.00 0.00 C ATOM 1118 O ASP A 70 -13.895 2.507 -4.374 1.00 0.00 O ATOM 1119 CB ASP A 70 -14.991 0.019 -4.387 1.00 0.00 C ATOM 1120 CG ASP A 70 -16.126 0.766 -5.090 1.00 0.00 C ATOM 1121 OD1 ASP A 70 -16.232 1.989 -4.854 1.00 0.00 O ATOM 1122 OD2 ASP A 70 -16.861 0.097 -5.848 1.00 0.00 O ATOM 0 H ASP A 70 -16.315 1.686 -2.660 1.00 0.00 H new ATOM 0 HA ASP A 70 -13.976 -0.121 -2.494 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.128 -0.011 -5.053 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -15.302 -1.013 -4.222 1.00 0.00 H new ATOM 1127 N PRO A 71 -12.810 2.186 -2.380 1.00 0.00 N ATOM 1128 CA PRO A 71 -11.950 3.348 -2.523 1.00 0.00 C ATOM 1129 C PRO A 71 -10.838 3.086 -3.541 1.00 0.00 C ATOM 1130 O PRO A 71 -10.299 1.982 -3.606 1.00 0.00 O ATOM 1131 CB PRO A 71 -11.421 3.620 -1.124 1.00 0.00 C ATOM 1132 CG PRO A 71 -11.632 2.334 -0.341 1.00 0.00 C ATOM 1133 CD PRO A 71 -12.577 1.452 -1.140 1.00 0.00 C ATOM 0 HA PRO A 71 -12.480 4.218 -2.911 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -10.366 3.892 -1.152 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -11.952 4.451 -0.660 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -10.682 1.826 -0.178 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -12.051 2.550 0.642 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -12.136 0.474 -1.335 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -13.509 1.280 -0.601 1.00 0.00 H new ATOM 1141 N ALA A 72 -10.528 4.119 -4.310 1.00 0.00 N ATOM 1142 CA ALA A 72 -9.491 4.013 -5.322 1.00 0.00 C ATOM 1143 C ALA A 72 -8.437 5.095 -5.080 1.00 0.00 C ATOM 1144 O ALA A 72 -8.554 6.207 -5.592 1.00 0.00 O ATOM 1145 CB ALA A 72 -10.121 4.115 -6.713 1.00 0.00 C ATOM 0 H ALA A 72 -10.977 5.033 -4.253 1.00 0.00 H new ATOM 0 HA ALA A 72 -8.992 3.046 -5.260 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.342 4.035 -7.472 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.841 3.308 -6.846 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -10.628 5.074 -6.813 1.00 0.00 H new ATOM 1151 N PHE A 73 -7.430 4.731 -4.299 1.00 0.00 N ATOM 1152 CA PHE A 73 -6.356 5.657 -3.983 1.00 0.00 C ATOM 1153 C PHE A 73 -5.354 5.749 -5.135 1.00 0.00 C ATOM 1154 O PHE A 73 -4.902 6.839 -5.484 1.00 0.00 O ATOM 1155 CB PHE A 73 -5.642 5.109 -2.745 1.00 0.00 C ATOM 1156 CG PHE A 73 -6.579 4.460 -1.723 1.00 0.00 C ATOM 1157 CD1 PHE A 73 -7.413 5.234 -0.979 1.00 0.00 C ATOM 1158 CD2 PHE A 73 -6.576 3.110 -1.560 1.00 0.00 C ATOM 1159 CE1 PHE A 73 -8.282 4.632 -0.031 1.00 0.00 C ATOM 1160 CE2 PHE A 73 -7.445 2.508 -0.611 1.00 0.00 C ATOM 1161 CZ PHE A 73 -8.280 3.282 0.133 1.00 0.00 C ATOM 0 H PHE A 73 -7.336 3.808 -3.876 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.763 6.653 -3.811 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.901 4.375 -3.061 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -5.100 5.922 -2.261 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -7.415 6.306 -1.109 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -5.913 2.496 -2.152 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -8.945 5.247 0.560 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.443 1.436 -0.480 1.00 0.00 H new ATOM 0 HZ PHE A 73 -8.941 2.825 0.854 1.00 0.00 H new ATOM 1171 N ASP A 74 -5.037 4.591 -5.695 1.00 0.00 N ATOM 1172 CA ASP A 74 -4.097 4.527 -6.801 1.00 0.00 C ATOM 1173 C ASP A 74 -2.966 5.530 -6.563 1.00 0.00 C ATOM 1174 O ASP A 74 -2.561 6.244 -7.478 1.00 0.00 O ATOM 1175 CB ASP A 74 -4.777 4.888 -8.124 1.00 0.00 C ATOM 1176 CG ASP A 74 -4.366 4.026 -9.319 1.00 0.00 C ATOM 1177 OD1 ASP A 74 -3.141 3.912 -9.542 1.00 0.00 O ATOM 1178 OD2 ASP A 74 -5.285 3.500 -9.982 1.00 0.00 O ATOM 0 H ASP A 74 -5.415 3.689 -5.403 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.713 3.508 -6.858 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.856 4.810 -7.993 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.558 5.931 -8.355 1.00 0.00 H new ATOM 1183 N GLU A 75 -2.488 5.551 -5.327 1.00 0.00 N ATOM 1184 CA GLU A 75 -1.412 6.454 -4.956 1.00 0.00 C ATOM 1185 C GLU A 75 -0.056 5.831 -5.294 1.00 0.00 C ATOM 1186 O GLU A 75 0.006 4.746 -5.872 1.00 0.00 O ATOM 1187 CB GLU A 75 -1.491 6.822 -3.473 1.00 0.00 C ATOM 1188 CG GLU A 75 -2.251 8.135 -3.274 1.00 0.00 C ATOM 1189 CD GLU A 75 -1.468 9.090 -2.372 1.00 0.00 C ATOM 1190 OE1 GLU A 75 -1.221 8.700 -1.210 1.00 0.00 O ATOM 1191 OE2 GLU A 75 -1.133 10.189 -2.865 1.00 0.00 O ATOM 0 H GLU A 75 -2.826 4.957 -4.570 1.00 0.00 H new ATOM 0 HA GLU A 75 -1.522 7.373 -5.531 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -1.988 6.023 -2.922 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -0.485 6.914 -3.063 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -2.429 8.606 -4.241 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -3.227 7.931 -2.834 1.00 0.00 H new ATOM 1198 N THR A 76 0.997 6.543 -4.920 1.00 0.00 N ATOM 1199 CA THR A 76 2.348 6.073 -5.177 1.00 0.00 C ATOM 1200 C THR A 76 3.337 6.751 -4.227 1.00 0.00 C ATOM 1201 O THR A 76 3.375 7.977 -4.135 1.00 0.00 O ATOM 1202 CB THR A 76 2.660 6.317 -6.654 1.00 0.00 C ATOM 1203 OG1 THR A 76 1.983 5.261 -7.331 1.00 0.00 O ATOM 1204 CG2 THR A 76 4.136 6.086 -6.987 1.00 0.00 C ATOM 0 H THR A 76 0.942 7.442 -4.441 1.00 0.00 H new ATOM 0 HA THR A 76 2.439 5.004 -4.983 1.00 0.00 H new ATOM 0 HB THR A 76 2.383 7.337 -6.919 1.00 0.00 H new ATOM 0 HG1 THR A 76 2.131 5.344 -8.296 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.303 6.273 -8.048 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.753 6.765 -6.397 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.405 5.056 -6.753 1.00 0.00 H new ATOM 1212 N PHE A 77 4.115 5.923 -3.544 1.00 0.00 N ATOM 1213 CA PHE A 77 5.102 6.428 -2.604 1.00 0.00 C ATOM 1214 C PHE A 77 6.501 5.913 -2.950 1.00 0.00 C ATOM 1215 O PHE A 77 6.756 4.711 -2.889 1.00 0.00 O ATOM 1216 CB PHE A 77 4.708 5.908 -1.220 1.00 0.00 C ATOM 1217 CG PHE A 77 3.263 6.221 -0.826 1.00 0.00 C ATOM 1218 CD1 PHE A 77 2.893 7.503 -0.559 1.00 0.00 C ATOM 1219 CD2 PHE A 77 2.348 5.218 -0.744 1.00 0.00 C ATOM 1220 CE1 PHE A 77 1.552 7.793 -0.193 1.00 0.00 C ATOM 1221 CE2 PHE A 77 1.007 5.509 -0.378 1.00 0.00 C ATOM 1222 CZ PHE A 77 0.638 6.790 -0.110 1.00 0.00 C ATOM 0 H PHE A 77 4.082 4.907 -3.623 1.00 0.00 H new ATOM 0 HA PHE A 77 5.126 7.517 -2.638 1.00 0.00 H new ATOM 0 HB2 PHE A 77 4.855 4.828 -1.193 1.00 0.00 H new ATOM 0 HB3 PHE A 77 5.378 6.340 -0.477 1.00 0.00 H new ATOM 0 HD1 PHE A 77 3.619 8.300 -0.625 1.00 0.00 H new ATOM 0 HD2 PHE A 77 2.641 4.201 -0.957 1.00 0.00 H new ATOM 0 HE1 PHE A 77 1.258 8.810 0.019 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.280 4.713 -0.313 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.382 7.011 0.169 1.00 0.00 H new ATOM 1232 N THR A 78 7.369 6.848 -3.305 1.00 0.00 N ATOM 1233 CA THR A 78 8.736 6.504 -3.661 1.00 0.00 C ATOM 1234 C THR A 78 9.622 6.483 -2.414 1.00 0.00 C ATOM 1235 O THR A 78 9.303 7.118 -1.410 1.00 0.00 O ATOM 1236 CB THR A 78 9.210 7.494 -4.726 1.00 0.00 C ATOM 1237 OG1 THR A 78 8.775 6.917 -5.955 1.00 0.00 O ATOM 1238 CG2 THR A 78 10.735 7.533 -4.852 1.00 0.00 C ATOM 0 H THR A 78 7.153 7.844 -3.354 1.00 0.00 H new ATOM 0 HA THR A 78 8.795 5.500 -4.081 1.00 0.00 H new ATOM 0 HB THR A 78 8.840 8.491 -4.485 1.00 0.00 H new ATOM 0 HG1 THR A 78 9.040 7.496 -6.700 1.00 0.00 H new ATOM 0 HG21 THR A 78 11.018 8.251 -5.621 1.00 0.00 H new ATOM 0 HG22 THR A 78 11.171 7.831 -3.899 1.00 0.00 H new ATOM 0 HG23 THR A 78 11.103 6.544 -5.126 1.00 0.00 H new ATOM 1246 N PHE A 79 10.717 5.744 -2.518 1.00 0.00 N ATOM 1247 CA PHE A 79 11.651 5.631 -1.411 1.00 0.00 C ATOM 1248 C PHE A 79 13.072 5.373 -1.917 1.00 0.00 C ATOM 1249 O PHE A 79 13.355 4.311 -2.468 1.00 0.00 O ATOM 1250 CB PHE A 79 11.200 4.440 -0.564 1.00 0.00 C ATOM 1251 CG PHE A 79 9.712 4.456 -0.210 1.00 0.00 C ATOM 1252 CD1 PHE A 79 9.216 5.433 0.596 1.00 0.00 C ATOM 1253 CD2 PHE A 79 8.885 3.495 -0.701 1.00 0.00 C ATOM 1254 CE1 PHE A 79 7.834 5.449 0.925 1.00 0.00 C ATOM 1255 CE2 PHE A 79 7.504 3.510 -0.372 1.00 0.00 C ATOM 1256 CZ PHE A 79 7.007 4.487 0.434 1.00 0.00 C ATOM 0 H PHE A 79 10.978 5.218 -3.352 1.00 0.00 H new ATOM 0 HA PHE A 79 11.661 6.557 -0.837 1.00 0.00 H new ATOM 0 HB2 PHE A 79 11.425 3.519 -1.102 1.00 0.00 H new ATOM 0 HB3 PHE A 79 11.782 4.422 0.357 1.00 0.00 H new ATOM 0 HD1 PHE A 79 9.873 6.197 0.986 1.00 0.00 H new ATOM 0 HD2 PHE A 79 9.279 2.720 -1.342 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.440 6.225 1.565 1.00 0.00 H new ATOM 0 HE2 PHE A 79 6.848 2.746 -0.762 1.00 0.00 H new ATOM 0 HZ PHE A 79 5.956 4.499 0.684 1.00 0.00 H new ATOM 1266 N TYR A 80 13.928 6.364 -1.712 1.00 0.00 N ATOM 1267 CA TYR A 80 15.312 6.257 -2.140 1.00 0.00 C ATOM 1268 C TYR A 80 16.198 5.734 -1.007 1.00 0.00 C ATOM 1269 O TYR A 80 15.885 5.922 0.167 1.00 0.00 O ATOM 1270 CB TYR A 80 15.752 7.677 -2.502 1.00 0.00 C ATOM 1271 CG TYR A 80 14.785 8.410 -3.433 1.00 0.00 C ATOM 1272 CD1 TYR A 80 14.810 8.158 -4.790 1.00 0.00 C ATOM 1273 CD2 TYR A 80 13.888 9.323 -2.917 1.00 0.00 C ATOM 1274 CE1 TYR A 80 13.900 8.848 -5.667 1.00 0.00 C ATOM 1275 CE2 TYR A 80 12.978 10.013 -3.794 1.00 0.00 C ATOM 1276 CZ TYR A 80 13.029 9.741 -5.126 1.00 0.00 C ATOM 1277 OH TYR A 80 12.169 10.393 -5.954 1.00 0.00 O ATOM 0 H TYR A 80 13.689 7.244 -1.255 1.00 0.00 H new ATOM 0 HA TYR A 80 15.402 5.565 -2.977 1.00 0.00 H new ATOM 0 HB2 TYR A 80 15.866 8.256 -1.585 1.00 0.00 H new ATOM 0 HB3 TYR A 80 16.733 7.633 -2.976 1.00 0.00 H new ATOM 0 HD1 TYR A 80 15.512 7.443 -5.194 1.00 0.00 H new ATOM 0 HD2 TYR A 80 13.869 9.520 -1.855 1.00 0.00 H new ATOM 0 HE1 TYR A 80 13.909 8.660 -6.731 1.00 0.00 H new ATOM 0 HE2 TYR A 80 12.271 10.730 -3.403 1.00 0.00 H new ATOM 0 HH TYR A 80 11.605 10.999 -5.429 1.00 0.00 H new ATOM 1287 N GLY A 81 17.287 5.089 -1.400 1.00 0.00 N ATOM 1288 CA GLY A 81 18.220 4.538 -0.433 1.00 0.00 C ATOM 1289 C GLY A 81 18.197 3.008 -0.458 1.00 0.00 C ATOM 1290 O GLY A 81 19.241 2.366 -0.350 1.00 0.00 O ATOM 0 H GLY A 81 17.544 4.936 -2.375 1.00 0.00 H new ATOM 0 HA2 GLY A 81 19.227 4.894 -0.651 1.00 0.00 H new ATOM 0 HA3 GLY A 81 17.966 4.893 0.566 1.00 0.00 H new ATOM 1294 N ILE A 82 16.996 2.469 -0.603 1.00 0.00 N ATOM 1295 CA ILE A 82 16.823 1.027 -0.644 1.00 0.00 C ATOM 1296 C ILE A 82 17.778 0.433 -1.681 1.00 0.00 C ATOM 1297 O ILE A 82 17.644 0.695 -2.876 1.00 0.00 O ATOM 1298 CB ILE A 82 15.355 0.670 -0.884 1.00 0.00 C ATOM 1299 CG1 ILE A 82 14.451 1.338 0.154 1.00 0.00 C ATOM 1300 CG2 ILE A 82 15.159 -0.847 -0.923 1.00 0.00 C ATOM 1301 CD1 ILE A 82 13.481 2.317 -0.511 1.00 0.00 C ATOM 0 H ILE A 82 16.133 3.005 -0.694 1.00 0.00 H new ATOM 0 HA ILE A 82 17.081 0.585 0.318 1.00 0.00 H new ATOM 0 HB ILE A 82 15.065 1.058 -1.861 1.00 0.00 H new ATOM 0 HG12 ILE A 82 13.890 0.577 0.696 1.00 0.00 H new ATOM 0 HG13 ILE A 82 15.061 1.866 0.886 1.00 0.00 H new ATOM 0 HG21 ILE A 82 14.107 -1.074 -1.095 1.00 0.00 H new ATOM 0 HG22 ILE A 82 15.758 -1.271 -1.729 1.00 0.00 H new ATOM 0 HG23 ILE A 82 15.473 -1.279 0.027 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.850 2.778 0.250 1.00 0.00 H new ATOM 0 HD12 ILE A 82 14.045 3.091 -1.032 1.00 0.00 H new ATOM 0 HD13 ILE A 82 12.856 1.781 -1.225 1.00 0.00 H new ATOM 1313 N PRO A 83 18.746 -0.377 -1.174 1.00 0.00 N ATOM 1314 CA PRO A 83 19.722 -1.011 -2.044 1.00 0.00 C ATOM 1315 C PRO A 83 19.098 -2.178 -2.810 1.00 0.00 C ATOM 1316 O PRO A 83 19.808 -3.065 -3.283 1.00 0.00 O ATOM 1317 CB PRO A 83 20.850 -1.442 -1.120 1.00 0.00 C ATOM 1318 CG PRO A 83 20.260 -1.453 0.281 1.00 0.00 C ATOM 1319 CD PRO A 83 18.935 -0.710 0.235 1.00 0.00 C ATOM 0 HA PRO A 83 20.093 -0.340 -2.819 1.00 0.00 H new ATOM 0 HB2 PRO A 83 21.224 -2.428 -1.394 1.00 0.00 H new ATOM 0 HB3 PRO A 83 21.692 -0.753 -1.184 1.00 0.00 H new ATOM 0 HG2 PRO A 83 20.112 -2.477 0.625 1.00 0.00 H new ATOM 0 HG3 PRO A 83 20.941 -0.976 0.986 1.00 0.00 H new ATOM 0 HD2 PRO A 83 18.120 -1.330 0.608 1.00 0.00 H new ATOM 0 HD3 PRO A 83 18.962 0.187 0.854 1.00 0.00 H new ATOM 1327 N TYR A 84 17.778 -2.141 -2.909 1.00 0.00 N ATOM 1328 CA TYR A 84 17.050 -3.185 -3.611 1.00 0.00 C ATOM 1329 C TYR A 84 17.175 -4.525 -2.882 1.00 0.00 C ATOM 1330 O TYR A 84 16.171 -5.124 -2.499 1.00 0.00 O ATOM 1331 CB TYR A 84 17.706 -3.304 -4.988 1.00 0.00 C ATOM 1332 CG TYR A 84 16.941 -4.197 -5.967 1.00 0.00 C ATOM 1333 CD1 TYR A 84 15.601 -3.969 -6.206 1.00 0.00 C ATOM 1334 CD2 TYR A 84 17.591 -5.231 -6.610 1.00 0.00 C ATOM 1335 CE1 TYR A 84 14.881 -4.809 -7.127 1.00 0.00 C ATOM 1336 CE2 TYR A 84 16.870 -6.072 -7.531 1.00 0.00 C ATOM 1337 CZ TYR A 84 15.551 -5.819 -7.744 1.00 0.00 C ATOM 1338 OH TYR A 84 14.871 -6.613 -8.614 1.00 0.00 O ATOM 0 H TYR A 84 17.193 -1.404 -2.515 1.00 0.00 H new ATOM 0 HA TYR A 84 15.990 -2.939 -3.673 1.00 0.00 H new ATOM 0 HB2 TYR A 84 17.803 -2.308 -5.420 1.00 0.00 H new ATOM 0 HB3 TYR A 84 18.715 -3.698 -4.866 1.00 0.00 H new ATOM 0 HD1 TYR A 84 15.093 -3.160 -5.702 1.00 0.00 H new ATOM 0 HD2 TYR A 84 18.640 -5.409 -6.423 1.00 0.00 H new ATOM 0 HE1 TYR A 84 13.832 -4.641 -7.324 1.00 0.00 H new ATOM 0 HE2 TYR A 84 17.366 -6.885 -8.041 1.00 0.00 H new ATOM 0 HH TYR A 84 15.033 -7.554 -8.393 1.00 0.00 H new ATOM 1348 N THR A 85 18.417 -4.956 -2.712 1.00 0.00 N ATOM 1349 CA THR A 85 18.686 -6.214 -2.036 1.00 0.00 C ATOM 1350 C THR A 85 18.031 -6.227 -0.654 1.00 0.00 C ATOM 1351 O THR A 85 17.843 -7.289 -0.062 1.00 0.00 O ATOM 1352 CB THR A 85 20.202 -6.412 -1.993 1.00 0.00 C ATOM 1353 OG1 THR A 85 20.687 -5.241 -1.340 1.00 0.00 O ATOM 1354 CG2 THR A 85 20.841 -6.355 -3.382 1.00 0.00 C ATOM 0 H THR A 85 19.247 -4.457 -3.031 1.00 0.00 H new ATOM 0 HA THR A 85 18.249 -7.055 -2.575 1.00 0.00 H new ATOM 0 HB THR A 85 20.429 -7.372 -1.529 1.00 0.00 H new ATOM 0 HG1 THR A 85 21.663 -5.287 -1.268 1.00 0.00 H new ATOM 0 HG21 THR A 85 21.918 -6.501 -3.294 1.00 0.00 H new ATOM 0 HG22 THR A 85 20.418 -7.140 -4.009 1.00 0.00 H new ATOM 0 HG23 THR A 85 20.643 -5.383 -3.834 1.00 0.00 H new ATOM 1362 N GLN A 86 17.703 -5.035 -0.178 1.00 0.00 N ATOM 1363 CA GLN A 86 17.073 -4.896 1.124 1.00 0.00 C ATOM 1364 C GLN A 86 15.554 -5.029 0.996 1.00 0.00 C ATOM 1365 O GLN A 86 14.847 -5.106 2.000 1.00 0.00 O ATOM 1366 CB GLN A 86 17.454 -3.566 1.778 1.00 0.00 C ATOM 1367 CG GLN A 86 17.159 -3.589 3.279 1.00 0.00 C ATOM 1368 CD GLN A 86 18.427 -3.320 4.091 1.00 0.00 C ATOM 1369 OE1 GLN A 86 19.463 -3.933 3.894 1.00 0.00 O ATOM 1370 NE2 GLN A 86 18.288 -2.371 5.012 1.00 0.00 N ATOM 0 H GLN A 86 17.862 -4.156 -0.671 1.00 0.00 H new ATOM 0 HA GLN A 86 17.435 -5.697 1.768 1.00 0.00 H new ATOM 0 HB2 GLN A 86 18.513 -3.367 1.615 1.00 0.00 H new ATOM 0 HB3 GLN A 86 16.901 -2.753 1.307 1.00 0.00 H new ATOM 0 HG2 GLN A 86 16.405 -2.839 3.517 1.00 0.00 H new ATOM 0 HG3 GLN A 86 16.744 -4.558 3.557 1.00 0.00 H new ATOM 0 HE21 GLN A 86 17.392 -1.897 5.125 1.00 0.00 H new ATOM 0 HE22 GLN A 86 19.077 -2.117 5.606 1.00 0.00 H new ATOM 1379 N ILE A 87 15.097 -5.052 -0.248 1.00 0.00 N ATOM 1380 CA ILE A 87 13.675 -5.175 -0.520 1.00 0.00 C ATOM 1381 C ILE A 87 13.162 -6.498 0.053 1.00 0.00 C ATOM 1382 O ILE A 87 12.184 -6.518 0.799 1.00 0.00 O ATOM 1383 CB ILE A 87 13.399 -5.005 -2.015 1.00 0.00 C ATOM 1384 CG1 ILE A 87 13.924 -3.659 -2.520 1.00 0.00 C ATOM 1385 CG2 ILE A 87 11.912 -5.192 -2.323 1.00 0.00 C ATOM 1386 CD1 ILE A 87 12.943 -2.531 -2.195 1.00 0.00 C ATOM 0 H ILE A 87 15.686 -4.988 -1.078 1.00 0.00 H new ATOM 0 HA ILE A 87 13.122 -4.377 -0.024 1.00 0.00 H new ATOM 0 HB ILE A 87 13.940 -5.784 -2.553 1.00 0.00 H new ATOM 0 HG12 ILE A 87 14.891 -3.447 -2.064 1.00 0.00 H new ATOM 0 HG13 ILE A 87 14.084 -3.708 -3.597 1.00 0.00 H new ATOM 0 HG21 ILE A 87 11.743 -5.066 -3.392 1.00 0.00 H new ATOM 0 HG22 ILE A 87 11.601 -6.192 -2.022 1.00 0.00 H new ATOM 0 HG23 ILE A 87 11.331 -4.451 -1.774 1.00 0.00 H new ATOM 0 HD11 ILE A 87 13.340 -1.586 -2.565 1.00 0.00 H new ATOM 0 HD12 ILE A 87 11.984 -2.734 -2.673 1.00 0.00 H new ATOM 0 HD13 ILE A 87 12.804 -2.469 -1.116 1.00 0.00 H new ATOM 1398 N GLN A 88 13.846 -7.571 -0.317 1.00 0.00 N ATOM 1399 CA GLN A 88 13.473 -8.895 0.151 1.00 0.00 C ATOM 1400 C GLN A 88 13.298 -8.891 1.671 1.00 0.00 C ATOM 1401 O GLN A 88 12.463 -9.618 2.206 1.00 0.00 O ATOM 1402 CB GLN A 88 14.503 -9.940 -0.280 1.00 0.00 C ATOM 1403 CG GLN A 88 14.697 -9.925 -1.797 1.00 0.00 C ATOM 1404 CD GLN A 88 16.160 -10.183 -2.165 1.00 0.00 C ATOM 1405 OE1 GLN A 88 16.764 -11.164 -1.764 1.00 0.00 O ATOM 1406 NE2 GLN A 88 16.693 -9.251 -2.950 1.00 0.00 N ATOM 0 H GLN A 88 14.657 -7.550 -0.936 1.00 0.00 H new ATOM 0 HA GLN A 88 12.520 -9.164 -0.304 1.00 0.00 H new ATOM 0 HB2 GLN A 88 15.455 -9.743 0.214 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.177 -10.930 0.039 1.00 0.00 H new ATOM 0 HG2 GLN A 88 14.064 -10.684 -2.256 1.00 0.00 H new ATOM 0 HG3 GLN A 88 14.382 -8.962 -2.198 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.131 -8.454 -3.250 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.664 -9.333 -3.252 1.00 0.00 H new ATOM 1415 N GLU A 89 14.101 -8.063 2.325 1.00 0.00 N ATOM 1416 CA GLU A 89 14.046 -7.955 3.773 1.00 0.00 C ATOM 1417 C GLU A 89 12.864 -7.079 4.195 1.00 0.00 C ATOM 1418 O GLU A 89 12.316 -7.252 5.283 1.00 0.00 O ATOM 1419 CB GLU A 89 15.360 -7.408 4.332 1.00 0.00 C ATOM 1420 CG GLU A 89 16.373 -8.534 4.553 1.00 0.00 C ATOM 1421 CD GLU A 89 16.077 -9.290 5.850 1.00 0.00 C ATOM 1422 OE1 GLU A 89 15.874 -8.603 6.874 1.00 0.00 O ATOM 1423 OE2 GLU A 89 16.061 -10.539 5.788 1.00 0.00 O ATOM 0 H GLU A 89 14.793 -7.461 1.878 1.00 0.00 H new ATOM 0 HA GLU A 89 13.900 -8.953 4.187 1.00 0.00 H new ATOM 0 HB2 GLU A 89 15.774 -6.672 3.643 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.172 -6.893 5.274 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.344 -9.225 3.710 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.380 -8.120 4.591 1.00 0.00 H new ATOM 1430 N LEU A 90 12.506 -6.158 3.312 1.00 0.00 N ATOM 1431 CA LEU A 90 11.399 -5.256 3.580 1.00 0.00 C ATOM 1432 C LEU A 90 10.094 -6.053 3.619 1.00 0.00 C ATOM 1433 O LEU A 90 10.113 -7.283 3.591 1.00 0.00 O ATOM 1434 CB LEU A 90 11.388 -4.107 2.569 1.00 0.00 C ATOM 1435 CG LEU A 90 12.234 -2.885 2.933 1.00 0.00 C ATOM 1436 CD1 LEU A 90 13.095 -3.162 4.166 1.00 0.00 C ATOM 1437 CD2 LEU A 90 13.073 -2.425 1.739 1.00 0.00 C ATOM 0 H LEU A 90 12.963 -6.017 2.411 1.00 0.00 H new ATOM 0 HA LEU A 90 11.516 -4.789 4.558 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.734 -4.491 1.609 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.357 -3.782 2.430 1.00 0.00 H new ATOM 0 HG LEU A 90 11.561 -2.067 3.188 1.00 0.00 H new ATOM 0 HD11 LEU A 90 13.686 -2.278 4.403 1.00 0.00 H new ATOM 0 HD12 LEU A 90 12.452 -3.406 5.012 1.00 0.00 H new ATOM 0 HD13 LEU A 90 13.762 -4.000 3.963 1.00 0.00 H new ATOM 0 HD21 LEU A 90 13.665 -1.555 2.024 1.00 0.00 H new ATOM 0 HD22 LEU A 90 13.738 -3.231 1.430 1.00 0.00 H new ATOM 0 HD23 LEU A 90 12.414 -2.160 0.912 1.00 0.00 H new ATOM 1449 N ALA A 91 8.992 -5.321 3.685 1.00 0.00 N ATOM 1450 CA ALA A 91 7.680 -5.945 3.728 1.00 0.00 C ATOM 1451 C ALA A 91 6.615 -4.867 3.940 1.00 0.00 C ATOM 1452 O ALA A 91 6.622 -4.173 4.955 1.00 0.00 O ATOM 1453 CB ALA A 91 7.658 -7.010 4.826 1.00 0.00 C ATOM 0 H ALA A 91 8.980 -4.301 3.710 1.00 0.00 H new ATOM 0 HA ALA A 91 7.461 -6.445 2.784 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.674 -7.478 4.859 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.413 -7.767 4.614 1.00 0.00 H new ATOM 0 HB3 ALA A 91 7.871 -6.545 5.788 1.00 0.00 H new ATOM 1459 N LEU A 92 5.724 -4.761 2.964 1.00 0.00 N ATOM 1460 CA LEU A 92 4.654 -3.780 3.031 1.00 0.00 C ATOM 1461 C LEU A 92 3.501 -4.345 3.862 1.00 0.00 C ATOM 1462 O LEU A 92 3.191 -5.532 3.774 1.00 0.00 O ATOM 1463 CB LEU A 92 4.242 -3.342 1.624 1.00 0.00 C ATOM 1464 CG LEU A 92 5.382 -2.960 0.678 1.00 0.00 C ATOM 1465 CD1 LEU A 92 4.936 -3.049 -0.782 1.00 0.00 C ATOM 1466 CD2 LEU A 92 5.942 -1.579 1.024 1.00 0.00 C ATOM 0 H LEU A 92 5.722 -5.338 2.123 1.00 0.00 H new ATOM 0 HA LEU A 92 4.996 -2.876 3.535 1.00 0.00 H new ATOM 0 HB2 LEU A 92 3.672 -4.150 1.166 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.570 -2.489 1.713 1.00 0.00 H new ATOM 0 HG LEU A 92 6.191 -3.678 0.811 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.765 -2.772 -1.433 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.624 -4.069 -1.006 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.101 -2.369 -0.949 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.751 -1.332 0.337 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.151 -0.834 0.937 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.323 -1.586 2.045 1.00 0.00 H new ATOM 1478 N HIS A 93 2.897 -3.468 4.650 1.00 0.00 N ATOM 1479 CA HIS A 93 1.784 -3.865 5.496 1.00 0.00 C ATOM 1480 C HIS A 93 0.559 -3.010 5.167 1.00 0.00 C ATOM 1481 O HIS A 93 0.496 -1.839 5.540 1.00 0.00 O ATOM 1482 CB HIS A 93 2.175 -3.797 6.974 1.00 0.00 C ATOM 1483 CG HIS A 93 1.100 -4.283 7.916 1.00 0.00 C ATOM 1484 ND1 HIS A 93 0.554 -5.522 8.083 1.00 0.00 N flip ATOM 1485 CD2 HIS A 93 0.465 -3.451 8.823 1.00 0.00 C flip ATOM 1486 CE1 HIS A 93 -0.363 -5.451 9.040 1.00 0.00 C flip ATOM 1487 NE2 HIS A 93 -0.420 -4.168 9.499 1.00 0.00 N flip ATOM 0 H HIS A 93 3.157 -2.484 4.721 1.00 0.00 H new ATOM 0 HA HIS A 93 1.523 -4.904 5.296 1.00 0.00 H new ATOM 0 HB2 HIS A 93 3.075 -4.391 7.129 1.00 0.00 H new ATOM 0 HB3 HIS A 93 2.426 -2.767 7.226 1.00 0.00 H new ATOM 0 HD2 HIS A 93 0.659 -2.397 8.956 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.965 -6.274 9.397 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -1.036 -3.821 10.234 1.00 0.00 H new ATOM 1495 N PHE A 94 -0.385 -3.628 4.472 1.00 0.00 N ATOM 1496 CA PHE A 94 -1.605 -2.939 4.089 1.00 0.00 C ATOM 1497 C PHE A 94 -2.732 -3.224 5.083 1.00 0.00 C ATOM 1498 O PHE A 94 -3.273 -4.328 5.114 1.00 0.00 O ATOM 1499 CB PHE A 94 -2.008 -3.474 2.713 1.00 0.00 C ATOM 1500 CG PHE A 94 -0.959 -3.241 1.623 1.00 0.00 C ATOM 1501 CD1 PHE A 94 -0.412 -2.007 1.459 1.00 0.00 C ATOM 1502 CD2 PHE A 94 -0.574 -4.268 0.819 1.00 0.00 C ATOM 1503 CE1 PHE A 94 0.561 -1.791 0.447 1.00 0.00 C ATOM 1504 CE2 PHE A 94 0.399 -4.052 -0.192 1.00 0.00 C ATOM 1505 CZ PHE A 94 0.946 -2.818 -0.357 1.00 0.00 C ATOM 0 H PHE A 94 -0.329 -4.599 4.164 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.434 -1.863 4.074 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.203 -4.544 2.793 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -2.943 -3.002 2.410 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -0.717 -1.191 2.098 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -1.009 -5.248 0.950 1.00 0.00 H new ATOM 0 HE1 PHE A 94 0.995 -0.811 0.316 1.00 0.00 H new ATOM 0 HE2 PHE A 94 0.705 -4.868 -0.830 1.00 0.00 H new ATOM 0 HZ PHE A 94 1.686 -2.654 -1.126 1.00 0.00 H new ATOM 1515 N THR A 95 -3.052 -2.209 5.873 1.00 0.00 N ATOM 1516 CA THR A 95 -4.105 -2.336 6.866 1.00 0.00 C ATOM 1517 C THR A 95 -5.391 -1.674 6.369 1.00 0.00 C ATOM 1518 O THR A 95 -5.474 -0.449 6.296 1.00 0.00 O ATOM 1519 CB THR A 95 -3.588 -1.749 8.181 1.00 0.00 C ATOM 1520 OG1 THR A 95 -2.461 -2.559 8.504 1.00 0.00 O ATOM 1521 CG2 THR A 95 -4.556 -1.975 9.344 1.00 0.00 C ATOM 0 H THR A 95 -2.600 -1.295 5.845 1.00 0.00 H new ATOM 0 HA THR A 95 -4.361 -3.381 7.038 1.00 0.00 H new ATOM 0 HB THR A 95 -3.413 -0.680 8.057 1.00 0.00 H new ATOM 0 HG1 THR A 95 -2.650 -3.073 9.317 1.00 0.00 H new ATOM 0 HG21 THR A 95 -4.141 -1.539 10.253 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.512 -1.502 9.119 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.706 -3.045 9.490 1.00 0.00 H new ATOM 1529 N ILE A 96 -6.362 -2.513 6.039 1.00 0.00 N ATOM 1530 CA ILE A 96 -7.640 -2.024 5.550 1.00 0.00 C ATOM 1531 C ILE A 96 -8.495 -1.573 6.735 1.00 0.00 C ATOM 1532 O ILE A 96 -9.313 -2.339 7.243 1.00 0.00 O ATOM 1533 CB ILE A 96 -8.315 -3.078 4.670 1.00 0.00 C ATOM 1534 CG1 ILE A 96 -7.428 -3.449 3.480 1.00 0.00 C ATOM 1535 CG2 ILE A 96 -9.704 -2.613 4.227 1.00 0.00 C ATOM 1536 CD1 ILE A 96 -6.269 -4.346 3.919 1.00 0.00 C ATOM 0 H ILE A 96 -6.289 -3.529 6.101 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.496 -1.153 4.911 1.00 0.00 H new ATOM 0 HB ILE A 96 -8.452 -3.982 5.263 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -8.023 -3.961 2.724 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.036 -2.543 3.017 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.163 -3.380 3.603 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -10.327 -2.439 5.105 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -9.614 -1.688 3.658 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.654 -4.595 3.054 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.662 -3.821 4.657 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -6.664 -5.262 4.359 1.00 0.00 H new ATOM 1548 N LEU A 97 -8.277 -0.331 7.142 1.00 0.00 N ATOM 1549 CA LEU A 97 -9.018 0.232 8.258 1.00 0.00 C ATOM 1550 C LEU A 97 -9.779 1.473 7.786 1.00 0.00 C ATOM 1551 O LEU A 97 -9.526 1.982 6.696 1.00 0.00 O ATOM 1552 CB LEU A 97 -8.085 0.496 9.442 1.00 0.00 C ATOM 1553 CG LEU A 97 -7.406 1.867 9.468 1.00 0.00 C ATOM 1554 CD1 LEU A 97 -6.826 2.166 10.852 1.00 0.00 C ATOM 1555 CD2 LEU A 97 -6.348 1.975 8.368 1.00 0.00 C ATOM 0 H LEU A 97 -7.598 0.301 6.719 1.00 0.00 H new ATOM 0 HA LEU A 97 -9.761 -0.479 8.619 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -8.656 0.378 10.363 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -7.311 -0.271 9.447 1.00 0.00 H new ATOM 0 HG LEU A 97 -8.161 2.626 9.265 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -6.349 3.146 10.843 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -7.627 2.159 11.591 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -6.088 1.406 11.109 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -5.880 2.959 8.408 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -5.589 1.206 8.516 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -6.819 1.837 7.395 1.00 0.00 H new ATOM 1567 N SER A 98 -10.695 1.923 8.631 1.00 0.00 N ATOM 1568 CA SER A 98 -11.494 3.094 8.314 1.00 0.00 C ATOM 1569 C SER A 98 -11.184 4.222 9.300 1.00 0.00 C ATOM 1570 O SER A 98 -10.892 3.968 10.467 1.00 0.00 O ATOM 1571 CB SER A 98 -12.988 2.764 8.337 1.00 0.00 C ATOM 1572 OG SER A 98 -13.790 3.898 8.017 1.00 0.00 O ATOM 0 H SER A 98 -10.901 1.498 9.535 1.00 0.00 H new ATOM 0 HA SER A 98 -11.237 3.421 7.306 1.00 0.00 H new ATOM 0 HB2 SER A 98 -13.193 1.963 7.627 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.262 2.393 9.325 1.00 0.00 H new ATOM 0 HG SER A 98 -14.737 3.646 8.041 1.00 0.00 H new ATOM 1701 N ASP A 106 -11.456 1.902 13.587 1.00 0.00 N ATOM 1702 CA ASP A 106 -12.346 0.841 13.148 1.00 0.00 C ATOM 1703 C ASP A 106 -11.705 0.097 11.974 1.00 0.00 C ATOM 1704 O ASP A 106 -12.028 0.360 10.817 1.00 0.00 O ATOM 1705 CB ASP A 106 -13.686 1.407 12.673 1.00 0.00 C ATOM 1706 CG ASP A 106 -14.776 1.472 13.745 1.00 0.00 C ATOM 1707 OD1 ASP A 106 -14.491 1.016 14.873 1.00 0.00 O ATOM 1708 OD2 ASP A 106 -15.870 1.976 13.411 1.00 0.00 O ATOM 0 HA ASP A 106 -12.516 0.172 13.992 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -13.521 2.411 12.282 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -14.048 0.798 11.845 1.00 0.00 H new ATOM 1713 N ILE A 107 -10.808 -0.817 12.313 1.00 0.00 N ATOM 1714 CA ILE A 107 -10.120 -1.601 11.302 1.00 0.00 C ATOM 1715 C ILE A 107 -11.041 -2.722 10.817 1.00 0.00 C ATOM 1716 O ILE A 107 -11.846 -3.246 11.585 1.00 0.00 O ATOM 1717 CB ILE A 107 -8.774 -2.099 11.835 1.00 0.00 C ATOM 1718 CG1 ILE A 107 -7.871 -0.927 12.224 1.00 0.00 C ATOM 1719 CG2 ILE A 107 -8.099 -3.033 10.829 1.00 0.00 C ATOM 1720 CD1 ILE A 107 -6.947 -1.308 13.383 1.00 0.00 C ATOM 0 H ILE A 107 -10.542 -1.032 13.274 1.00 0.00 H new ATOM 0 HA ILE A 107 -9.886 -0.983 10.435 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.957 -2.678 12.740 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -7.275 -0.622 11.364 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -8.483 -0.071 12.508 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -7.145 -3.373 11.232 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.742 -3.894 10.644 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -7.929 -2.499 9.894 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -6.316 -0.457 13.640 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -7.546 -1.590 14.249 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -6.320 -2.149 13.087 1.00 0.00 H new ATOM 1732 N ILE A 108 -10.892 -3.057 9.543 1.00 0.00 N ATOM 1733 CA ILE A 108 -11.701 -4.106 8.946 1.00 0.00 C ATOM 1734 C ILE A 108 -10.860 -5.376 8.807 1.00 0.00 C ATOM 1735 O ILE A 108 -11.321 -6.469 9.135 1.00 0.00 O ATOM 1736 CB ILE A 108 -12.312 -3.626 7.628 1.00 0.00 C ATOM 1737 CG1 ILE A 108 -13.469 -2.657 7.881 1.00 0.00 C ATOM 1738 CG2 ILE A 108 -12.737 -4.810 6.757 1.00 0.00 C ATOM 1739 CD1 ILE A 108 -13.406 -1.466 6.923 1.00 0.00 C ATOM 0 H ILE A 108 -10.223 -2.620 8.908 1.00 0.00 H new ATOM 0 HA ILE A 108 -12.544 -4.351 9.592 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.547 -3.079 7.077 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -14.418 -3.178 7.757 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -13.432 -2.302 8.911 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -13.168 -4.441 5.826 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.867 -5.428 6.534 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -13.479 -5.405 7.289 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -14.239 -0.793 7.124 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -12.466 -0.933 7.067 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -13.467 -1.822 5.895 1.00 0.00 H new ATOM 1751 N GLY A 109 -9.642 -5.190 8.321 1.00 0.00 N ATOM 1752 CA GLY A 109 -8.732 -6.308 8.135 1.00 0.00 C ATOM 1753 C GLY A 109 -7.298 -5.818 7.925 1.00 0.00 C ATOM 1754 O GLY A 109 -7.058 -4.617 7.814 1.00 0.00 O ATOM 0 H GLY A 109 -9.264 -4.282 8.050 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -8.773 -6.963 9.005 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -9.048 -6.899 7.276 1.00 0.00 H new ATOM 1758 N GLU A 110 -6.381 -6.774 7.875 1.00 0.00 N ATOM 1759 CA GLU A 110 -4.977 -6.455 7.680 1.00 0.00 C ATOM 1760 C GLU A 110 -4.406 -7.265 6.514 1.00 0.00 C ATOM 1761 O GLU A 110 -4.858 -8.378 6.247 1.00 0.00 O ATOM 1762 CB GLU A 110 -4.176 -6.698 8.961 1.00 0.00 C ATOM 1763 CG GLU A 110 -4.530 -5.665 10.032 1.00 0.00 C ATOM 1764 CD GLU A 110 -4.638 -6.319 11.411 1.00 0.00 C ATOM 1765 OE1 GLU A 110 -3.571 -6.512 12.033 1.00 0.00 O ATOM 1766 OE2 GLU A 110 -5.785 -6.612 11.812 1.00 0.00 O ATOM 0 H GLU A 110 -6.583 -7.770 7.966 1.00 0.00 H new ATOM 0 HA GLU A 110 -4.896 -5.396 7.436 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.379 -7.701 9.337 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.109 -6.649 8.742 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -3.770 -4.884 10.055 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -5.474 -5.183 9.779 1.00 0.00 H new ATOM 1773 N VAL A 111 -3.421 -6.676 5.852 1.00 0.00 N ATOM 1774 CA VAL A 111 -2.784 -7.329 4.722 1.00 0.00 C ATOM 1775 C VAL A 111 -1.272 -7.104 4.794 1.00 0.00 C ATOM 1776 O VAL A 111 -0.819 -6.055 5.249 1.00 0.00 O ATOM 1777 CB VAL A 111 -3.401 -6.831 3.413 1.00 0.00 C ATOM 1778 CG1 VAL A 111 -2.399 -6.933 2.261 1.00 0.00 C ATOM 1779 CG2 VAL A 111 -4.688 -7.592 3.090 1.00 0.00 C ATOM 0 H VAL A 111 -3.049 -5.753 6.077 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.955 -8.405 4.757 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.657 -5.779 3.541 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.863 -6.573 1.343 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.522 -6.326 2.487 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.098 -7.973 2.132 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -5.106 -7.219 2.155 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -4.467 -8.655 2.990 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.409 -7.445 3.894 1.00 0.00 H new ATOM 1789 N LEU A 112 -0.534 -8.105 4.337 1.00 0.00 N ATOM 1790 CA LEU A 112 0.917 -8.029 4.344 1.00 0.00 C ATOM 1791 C LEU A 112 1.463 -8.666 3.065 1.00 0.00 C ATOM 1792 O LEU A 112 0.971 -9.705 2.626 1.00 0.00 O ATOM 1793 CB LEU A 112 1.479 -8.646 5.626 1.00 0.00 C ATOM 1794 CG LEU A 112 3.005 -8.685 5.738 1.00 0.00 C ATOM 1795 CD1 LEU A 112 3.544 -7.387 6.343 1.00 0.00 C ATOM 1796 CD2 LEU A 112 3.466 -9.916 6.521 1.00 0.00 C ATOM 0 H LEU A 112 -0.914 -8.973 3.959 1.00 0.00 H new ATOM 0 HA LEU A 112 1.244 -6.989 4.347 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.086 -8.089 6.476 1.00 0.00 H new ATOM 0 HB3 LEU A 112 1.102 -9.665 5.711 1.00 0.00 H new ATOM 0 HG LEU A 112 3.419 -8.768 4.733 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.631 -7.441 6.411 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.262 -6.546 5.710 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.124 -7.248 7.339 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.554 -9.919 6.586 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.043 -9.888 7.525 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.130 -10.819 6.011 1.00 0.00 H new ATOM 1808 N ILE A 113 2.471 -8.016 2.502 1.00 0.00 N ATOM 1809 CA ILE A 113 3.089 -8.506 1.282 1.00 0.00 C ATOM 1810 C ILE A 113 4.611 -8.457 1.430 1.00 0.00 C ATOM 1811 O ILE A 113 5.228 -7.418 1.198 1.00 0.00 O ATOM 1812 CB ILE A 113 2.564 -7.735 0.069 1.00 0.00 C ATOM 1813 CG1 ILE A 113 2.510 -8.633 -1.169 1.00 0.00 C ATOM 1814 CG2 ILE A 113 3.390 -6.471 -0.176 1.00 0.00 C ATOM 1815 CD1 ILE A 113 1.158 -9.342 -1.273 1.00 0.00 C ATOM 0 H ILE A 113 2.875 -7.154 2.868 1.00 0.00 H new ATOM 0 HA ILE A 113 2.819 -9.548 1.110 1.00 0.00 H new ATOM 0 HB ILE A 113 1.543 -7.417 0.281 1.00 0.00 H new ATOM 0 HG12 ILE A 113 2.681 -8.035 -2.064 1.00 0.00 H new ATOM 0 HG13 ILE A 113 3.310 -9.372 -1.122 1.00 0.00 H new ATOM 0 HG21 ILE A 113 2.996 -5.941 -1.044 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.334 -5.825 0.700 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.429 -6.745 -0.359 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.146 -9.974 -2.161 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.001 -9.958 -0.387 1.00 0.00 H new ATOM 0 HD13 ILE A 113 0.363 -8.600 -1.345 1.00 0.00 H new ATOM 1827 N PRO A 114 5.188 -9.623 1.827 1.00 0.00 N ATOM 1828 CA PRO A 114 6.626 -9.722 2.010 1.00 0.00 C ATOM 1829 C PRO A 114 7.347 -9.784 0.661 1.00 0.00 C ATOM 1830 O PRO A 114 7.109 -10.692 -0.133 1.00 0.00 O ATOM 1831 CB PRO A 114 6.831 -10.971 2.851 1.00 0.00 C ATOM 1832 CG PRO A 114 5.549 -11.778 2.717 1.00 0.00 C ATOM 1833 CD PRO A 114 4.489 -10.873 2.112 1.00 0.00 C ATOM 0 HA PRO A 114 7.048 -8.849 2.509 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.691 -11.542 2.500 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.024 -10.713 3.893 1.00 0.00 H new ATOM 0 HG2 PRO A 114 5.712 -12.651 2.085 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.226 -12.146 3.691 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.068 -11.307 1.205 1.00 0.00 H new ATOM 0 HD3 PRO A 114 3.661 -10.715 2.803 1.00 0.00 H new ATOM 1841 N LEU A 115 8.214 -8.806 0.445 1.00 0.00 N ATOM 1842 CA LEU A 115 8.971 -8.738 -0.794 1.00 0.00 C ATOM 1843 C LEU A 115 10.126 -9.740 -0.736 1.00 0.00 C ATOM 1844 O LEU A 115 10.930 -9.819 -1.663 1.00 0.00 O ATOM 1845 CB LEU A 115 9.417 -7.301 -1.071 1.00 0.00 C ATOM 1846 CG LEU A 115 8.374 -6.212 -0.811 1.00 0.00 C ATOM 1847 CD1 LEU A 115 8.962 -4.821 -1.051 1.00 0.00 C ATOM 1848 CD2 LEU A 115 7.112 -6.453 -1.643 1.00 0.00 C ATOM 0 H LEU A 115 8.409 -8.054 1.106 1.00 0.00 H new ATOM 0 HA LEU A 115 8.344 -9.021 -1.640 1.00 0.00 H new ATOM 0 HB2 LEU A 115 10.294 -7.090 -0.459 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.731 -7.234 -2.113 1.00 0.00 H new ATOM 0 HG LEU A 115 8.083 -6.261 0.238 1.00 0.00 H new ATOM 0 HD11 LEU A 115 8.200 -4.066 -0.859 1.00 0.00 H new ATOM 0 HD12 LEU A 115 9.807 -4.662 -0.381 1.00 0.00 H new ATOM 0 HD13 LEU A 115 9.299 -4.742 -2.085 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.386 -5.665 -1.440 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.368 -6.446 -2.703 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.682 -7.419 -1.380 1.00 0.00 H new ATOM 1860 N SER A 116 10.170 -10.481 0.361 1.00 0.00 N ATOM 1861 CA SER A 116 11.213 -11.475 0.552 1.00 0.00 C ATOM 1862 C SER A 116 11.129 -12.537 -0.546 1.00 0.00 C ATOM 1863 O SER A 116 10.507 -13.581 -0.358 1.00 0.00 O ATOM 1864 CB SER A 116 11.107 -12.127 1.932 1.00 0.00 C ATOM 1865 OG SER A 116 12.049 -13.183 2.097 1.00 0.00 O ATOM 0 H SER A 116 9.500 -10.413 1.127 1.00 0.00 H new ATOM 0 HA SER A 116 12.179 -10.974 0.491 1.00 0.00 H new ATOM 0 HB2 SER A 116 11.269 -11.373 2.703 1.00 0.00 H new ATOM 0 HB3 SER A 116 10.098 -12.516 2.073 1.00 0.00 H new ATOM 0 HG SER A 116 11.951 -13.572 2.991 1.00 0.00 H new ATOM 1871 N GLY A 117 11.765 -12.235 -1.668 1.00 0.00 N ATOM 1872 CA GLY A 117 11.771 -13.151 -2.795 1.00 0.00 C ATOM 1873 C GLY A 117 11.315 -12.448 -4.075 1.00 0.00 C ATOM 1874 O GLY A 117 11.778 -12.776 -5.167 1.00 0.00 O ATOM 0 H GLY A 117 12.280 -11.368 -1.821 1.00 0.00 H new ATOM 0 HA2 GLY A 117 12.774 -13.555 -2.935 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.114 -13.995 -2.586 1.00 0.00 H new ATOM 1878 N ILE A 118 10.412 -11.495 -3.899 1.00 0.00 N ATOM 1879 CA ILE A 118 9.888 -10.743 -5.027 1.00 0.00 C ATOM 1880 C ILE A 118 11.052 -10.158 -5.830 1.00 0.00 C ATOM 1881 O ILE A 118 12.014 -9.651 -5.255 1.00 0.00 O ATOM 1882 CB ILE A 118 8.882 -9.693 -4.550 1.00 0.00 C ATOM 1883 CG1 ILE A 118 7.511 -10.324 -4.295 1.00 0.00 C ATOM 1884 CG2 ILE A 118 8.801 -8.524 -5.533 1.00 0.00 C ATOM 1885 CD1 ILE A 118 6.623 -10.226 -5.537 1.00 0.00 C ATOM 0 H ILE A 118 10.030 -11.226 -2.992 1.00 0.00 H new ATOM 0 HA ILE A 118 9.335 -11.400 -5.698 1.00 0.00 H new ATOM 0 HB ILE A 118 9.233 -9.290 -3.600 1.00 0.00 H new ATOM 0 HG12 ILE A 118 7.635 -11.370 -4.014 1.00 0.00 H new ATOM 0 HG13 ILE A 118 7.027 -9.823 -3.457 1.00 0.00 H new ATOM 0 HG21 ILE A 118 8.079 -7.793 -5.170 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.781 -8.054 -5.621 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.486 -8.891 -6.510 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.655 -10.682 -5.329 1.00 0.00 H new ATOM 0 HD12 ILE A 118 6.482 -9.178 -5.801 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.099 -10.748 -6.367 1.00 0.00 H new ATOM 1897 N GLU A 119 10.926 -10.249 -7.145 1.00 0.00 N ATOM 1898 CA GLU A 119 11.955 -9.735 -8.033 1.00 0.00 C ATOM 1899 C GLU A 119 11.353 -8.737 -9.023 1.00 0.00 C ATOM 1900 O GLU A 119 10.589 -9.119 -9.908 1.00 0.00 O ATOM 1901 CB GLU A 119 12.665 -10.875 -8.767 1.00 0.00 C ATOM 1902 CG GLU A 119 11.823 -11.379 -9.941 1.00 0.00 C ATOM 1903 CD GLU A 119 12.245 -12.791 -10.352 1.00 0.00 C ATOM 1904 OE1 GLU A 119 13.329 -12.905 -10.963 1.00 0.00 O ATOM 1905 OE2 GLU A 119 11.473 -13.726 -10.045 1.00 0.00 O ATOM 0 H GLU A 119 10.127 -10.671 -7.618 1.00 0.00 H new ATOM 0 HA GLU A 119 12.700 -9.214 -7.431 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.633 -10.531 -9.130 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.857 -11.694 -8.074 1.00 0.00 H new ATOM 0 HG2 GLU A 119 10.769 -11.377 -9.664 1.00 0.00 H new ATOM 0 HG3 GLU A 119 11.932 -10.702 -10.788 1.00 0.00 H new ATOM 1912 N LEU A 120 11.719 -7.477 -8.840 1.00 0.00 N ATOM 1913 CA LEU A 120 11.224 -6.420 -9.707 1.00 0.00 C ATOM 1914 C LEU A 120 12.329 -6.007 -10.681 1.00 0.00 C ATOM 1915 O LEU A 120 12.279 -4.921 -11.258 1.00 0.00 O ATOM 1916 CB LEU A 120 10.672 -5.261 -8.875 1.00 0.00 C ATOM 1917 CG LEU A 120 9.659 -5.635 -7.791 1.00 0.00 C ATOM 1918 CD1 LEU A 120 10.048 -5.023 -6.444 1.00 0.00 C ATOM 1919 CD2 LEU A 120 8.240 -5.247 -8.209 1.00 0.00 C ATOM 0 H LEU A 120 12.352 -7.164 -8.104 1.00 0.00 H new ATOM 0 HA LEU A 120 10.387 -6.778 -10.307 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.509 -4.750 -8.401 1.00 0.00 H new ATOM 0 HB3 LEU A 120 10.203 -4.546 -9.551 1.00 0.00 H new ATOM 0 HG LEU A 120 9.673 -6.718 -7.669 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.312 -5.304 -5.691 1.00 0.00 H new ATOM 0 HD12 LEU A 120 11.030 -5.391 -6.147 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.080 -3.937 -6.533 1.00 0.00 H new ATOM 0 HD21 LEU A 120 7.540 -5.524 -7.421 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.191 -4.171 -8.376 1.00 0.00 H new ATOM 0 HD23 LEU A 120 7.976 -5.769 -9.129 1.00 0.00 H new ATOM 1931 N SER A 121 13.300 -6.894 -10.836 1.00 0.00 N ATOM 1932 CA SER A 121 14.415 -6.635 -11.731 1.00 0.00 C ATOM 1933 C SER A 121 13.923 -6.584 -13.179 1.00 0.00 C ATOM 1934 O SER A 121 14.335 -5.718 -13.949 1.00 0.00 O ATOM 1935 CB SER A 121 15.504 -7.699 -11.578 1.00 0.00 C ATOM 1936 OG SER A 121 16.344 -7.445 -10.455 1.00 0.00 O ATOM 0 H SER A 121 13.338 -7.794 -10.357 1.00 0.00 H new ATOM 0 HA SER A 121 14.848 -5.670 -11.467 1.00 0.00 H new ATOM 0 HB2 SER A 121 15.040 -8.679 -11.470 1.00 0.00 H new ATOM 0 HB3 SER A 121 16.109 -7.731 -12.484 1.00 0.00 H new ATOM 0 HG SER A 121 15.880 -6.853 -9.827 1.00 0.00 H new ATOM 1942 N GLU A 122 13.048 -7.524 -13.506 1.00 0.00 N ATOM 1943 CA GLU A 122 12.495 -7.597 -14.848 1.00 0.00 C ATOM 1944 C GLU A 122 11.762 -6.299 -15.192 1.00 0.00 C ATOM 1945 O GLU A 122 12.179 -5.564 -16.085 1.00 0.00 O ATOM 1946 CB GLU A 122 11.568 -8.806 -14.994 1.00 0.00 C ATOM 1947 CG GLU A 122 12.354 -10.054 -15.402 1.00 0.00 C ATOM 1948 CD GLU A 122 11.742 -10.706 -16.643 1.00 0.00 C ATOM 1949 OE1 GLU A 122 10.518 -10.957 -16.607 1.00 0.00 O ATOM 1950 OE2 GLU A 122 12.511 -10.938 -17.600 1.00 0.00 O ATOM 0 H GLU A 122 12.708 -8.241 -12.865 1.00 0.00 H new ATOM 0 HA GLU A 122 13.317 -7.724 -15.552 1.00 0.00 H new ATOM 0 HB2 GLU A 122 11.052 -8.989 -14.051 1.00 0.00 H new ATOM 0 HB3 GLU A 122 10.803 -8.594 -15.740 1.00 0.00 H new ATOM 0 HG2 GLU A 122 13.391 -9.786 -15.602 1.00 0.00 H new ATOM 0 HG3 GLU A 122 12.363 -10.768 -14.578 1.00 0.00 H new ATOM 1957 N GLY A 123 10.681 -6.057 -14.464 1.00 0.00 N ATOM 1958 CA GLY A 123 9.886 -4.860 -14.681 1.00 0.00 C ATOM 1959 C GLY A 123 8.884 -4.654 -13.543 1.00 0.00 C ATOM 1960 O GLY A 123 9.170 -4.982 -12.392 1.00 0.00 O ATOM 0 H GLY A 123 10.338 -6.669 -13.724 1.00 0.00 H new ATOM 0 HA2 GLY A 123 10.541 -3.992 -14.755 1.00 0.00 H new ATOM 0 HA3 GLY A 123 9.354 -4.939 -15.629 1.00 0.00 H new ATOM 1964 N LYS A 124 7.731 -4.112 -13.903 1.00 0.00 N ATOM 1965 CA LYS A 124 6.685 -3.858 -12.927 1.00 0.00 C ATOM 1966 C LYS A 124 5.729 -5.052 -12.888 1.00 0.00 C ATOM 1967 O LYS A 124 5.371 -5.599 -13.930 1.00 0.00 O ATOM 1968 CB LYS A 124 5.993 -2.525 -13.218 1.00 0.00 C ATOM 1969 CG LYS A 124 4.885 -2.249 -12.199 1.00 0.00 C ATOM 1970 CD LYS A 124 4.059 -1.026 -12.605 1.00 0.00 C ATOM 1971 CE LYS A 124 4.054 0.025 -11.493 1.00 0.00 C ATOM 1972 NZ LYS A 124 2.828 0.851 -11.567 1.00 0.00 N ATOM 0 H LYS A 124 7.497 -3.841 -14.858 1.00 0.00 H new ATOM 0 HA LYS A 124 7.111 -3.758 -11.929 1.00 0.00 H new ATOM 0 HB2 LYS A 124 6.725 -1.718 -13.192 1.00 0.00 H new ATOM 0 HB3 LYS A 124 5.572 -2.541 -14.223 1.00 0.00 H new ATOM 0 HG2 LYS A 124 4.235 -3.120 -12.118 1.00 0.00 H new ATOM 0 HG3 LYS A 124 5.324 -2.086 -11.215 1.00 0.00 H new ATOM 0 HD2 LYS A 124 4.468 -0.593 -13.518 1.00 0.00 H new ATOM 0 HD3 LYS A 124 3.036 -1.331 -12.827 1.00 0.00 H new ATOM 0 HE2 LYS A 124 4.112 -0.465 -10.521 1.00 0.00 H new ATOM 0 HE3 LYS A 124 4.934 0.661 -11.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 3.012 1.783 -11.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 2.549 0.970 -12.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 2.060 0.380 -11.047 1.00 0.00 H new ATOM 1986 N MET A 125 5.343 -5.421 -11.676 1.00 0.00 N ATOM 1987 CA MET A 125 4.435 -6.540 -11.487 1.00 0.00 C ATOM 1988 C MET A 125 3.325 -6.184 -10.496 1.00 0.00 C ATOM 1989 O MET A 125 3.598 -5.689 -9.404 1.00 0.00 O ATOM 1990 CB MET A 125 5.216 -7.749 -10.967 1.00 0.00 C ATOM 1991 CG MET A 125 5.332 -7.711 -9.442 1.00 0.00 C ATOM 1992 SD MET A 125 6.256 -9.126 -8.865 1.00 0.00 S ATOM 1993 CE MET A 125 7.920 -8.507 -9.052 1.00 0.00 C ATOM 0 H MET A 125 5.642 -4.965 -10.814 1.00 0.00 H new ATOM 0 HA MET A 125 3.977 -6.778 -12.447 1.00 0.00 H new ATOM 0 HB2 MET A 125 4.718 -8.668 -11.275 1.00 0.00 H new ATOM 0 HB3 MET A 125 6.211 -7.762 -11.411 1.00 0.00 H new ATOM 0 HG2 MET A 125 5.826 -6.791 -9.129 1.00 0.00 H new ATOM 0 HG3 MET A 125 4.339 -7.707 -8.993 1.00 0.00 H new ATOM 0 HE1 MET A 125 8.616 -9.344 -9.101 1.00 0.00 H new ATOM 0 HE2 MET A 125 7.990 -7.923 -9.970 1.00 0.00 H new ATOM 0 HE3 MET A 125 8.171 -7.876 -8.200 1.00 0.00 H new ATOM 2003 N LEU A 126 2.096 -6.451 -10.914 1.00 0.00 N ATOM 2004 CA LEU A 126 0.943 -6.165 -10.077 1.00 0.00 C ATOM 2005 C LEU A 126 0.656 -7.373 -9.183 1.00 0.00 C ATOM 2006 O LEU A 126 1.069 -8.490 -9.491 1.00 0.00 O ATOM 2007 CB LEU A 126 -0.249 -5.738 -10.935 1.00 0.00 C ATOM 2008 CG LEU A 126 -1.129 -4.629 -10.355 1.00 0.00 C ATOM 2009 CD1 LEU A 126 -1.675 -3.726 -11.464 1.00 0.00 C ATOM 2010 CD2 LEU A 126 -2.247 -5.212 -9.489 1.00 0.00 C ATOM 0 H LEU A 126 1.874 -6.862 -11.821 1.00 0.00 H new ATOM 0 HA LEU A 126 1.150 -5.322 -9.418 1.00 0.00 H new ATOM 0 HB2 LEU A 126 0.126 -5.408 -11.904 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -0.873 -6.613 -11.116 1.00 0.00 H new ATOM 0 HG LEU A 126 -0.511 -4.007 -9.707 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -2.297 -2.946 -11.025 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -0.845 -3.268 -12.002 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -2.272 -4.320 -12.156 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.857 -4.402 -9.089 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -2.870 -5.871 -10.094 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.812 -5.779 -8.666 1.00 0.00 H new ATOM 2022 N MET A 127 -0.050 -7.108 -8.093 1.00 0.00 N ATOM 2023 CA MET A 127 -0.397 -8.159 -7.152 1.00 0.00 C ATOM 2024 C MET A 127 -1.658 -7.796 -6.365 1.00 0.00 C ATOM 2025 O MET A 127 -2.037 -6.628 -6.297 1.00 0.00 O ATOM 2026 CB MET A 127 0.765 -8.380 -6.181 1.00 0.00 C ATOM 2027 CG MET A 127 1.986 -8.947 -6.907 1.00 0.00 C ATOM 2028 SD MET A 127 2.967 -9.924 -5.780 1.00 0.00 S ATOM 2029 CE MET A 127 2.996 -8.832 -4.368 1.00 0.00 C ATOM 0 H MET A 127 -0.391 -6.180 -7.841 1.00 0.00 H new ATOM 0 HA MET A 127 -0.592 -9.073 -7.713 1.00 0.00 H new ATOM 0 HB2 MET A 127 1.028 -7.437 -5.702 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.458 -9.064 -5.390 1.00 0.00 H new ATOM 0 HG2 MET A 127 1.666 -9.560 -7.749 1.00 0.00 H new ATOM 0 HG3 MET A 127 2.587 -8.134 -7.315 1.00 0.00 H new ATOM 0 HE1 MET A 127 3.830 -9.099 -3.719 1.00 0.00 H new ATOM 0 HE2 MET A 127 3.114 -7.803 -4.706 1.00 0.00 H new ATOM 0 HE3 MET A 127 2.061 -8.927 -3.815 1.00 0.00 H new ATOM 2039 N ASN A 128 -2.274 -8.820 -5.792 1.00 0.00 N ATOM 2040 CA ASN A 128 -3.485 -8.623 -5.013 1.00 0.00 C ATOM 2041 C ASN A 128 -3.383 -9.420 -3.711 1.00 0.00 C ATOM 2042 O ASN A 128 -2.578 -10.345 -3.606 1.00 0.00 O ATOM 2043 CB ASN A 128 -4.716 -9.118 -5.775 1.00 0.00 C ATOM 2044 CG ASN A 128 -4.382 -10.351 -6.616 1.00 0.00 C ATOM 2045 OD1 ASN A 128 -3.994 -10.262 -7.769 1.00 0.00 O ATOM 2046 ND2 ASN A 128 -4.554 -11.505 -5.976 1.00 0.00 N ATOM 0 H ASN A 128 -1.957 -9.788 -5.852 1.00 0.00 H new ATOM 0 HA ASN A 128 -3.589 -7.556 -4.814 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.512 -9.359 -5.070 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.092 -8.324 -6.421 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -4.358 -12.386 -6.451 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -4.882 -11.509 -5.010 1.00 0.00 H new ATOM 2053 N ARG A 129 -4.211 -9.033 -2.751 1.00 0.00 N ATOM 2054 CA ARG A 129 -4.224 -9.700 -1.460 1.00 0.00 C ATOM 2055 C ARG A 129 -5.648 -9.745 -0.901 1.00 0.00 C ATOM 2056 O ARG A 129 -6.445 -8.842 -1.149 1.00 0.00 O ATOM 2057 CB ARG A 129 -3.314 -8.983 -0.461 1.00 0.00 C ATOM 2058 CG ARG A 129 -1.908 -9.587 -0.469 1.00 0.00 C ATOM 2059 CD ARG A 129 -1.934 -11.043 -0.002 1.00 0.00 C ATOM 2060 NE ARG A 129 -1.147 -11.886 -0.929 1.00 0.00 N ATOM 2061 CZ ARG A 129 -1.010 -13.214 -0.805 1.00 0.00 C ATOM 2062 NH1 ARG A 129 -1.607 -13.857 0.208 1.00 0.00 N ATOM 2063 NH2 ARG A 129 -0.277 -13.897 -1.694 1.00 0.00 N ATOM 0 H ARG A 129 -4.877 -8.266 -2.842 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.855 -10.715 -1.607 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -3.260 -7.923 -0.709 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -3.739 -9.055 0.540 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.490 -9.531 -1.474 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -1.255 -9.005 0.181 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -1.526 -11.118 1.006 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -2.963 -11.401 0.043 1.00 0.00 H new ATOM 0 HE ARG A 129 -0.679 -11.428 -1.711 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -2.165 -13.336 0.884 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.503 -14.867 0.303 1.00 0.00 H new ATOM 0 HH21 ARG A 129 0.177 -13.407 -2.465 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -0.172 -14.907 -1.600 1.00 0.00 H new ATOM 2077 N GLU A 130 -5.923 -10.807 -0.157 1.00 0.00 N ATOM 2078 CA GLU A 130 -7.236 -10.982 0.439 1.00 0.00 C ATOM 2079 C GLU A 130 -7.267 -10.375 1.843 1.00 0.00 C ATOM 2080 O GLU A 130 -6.273 -10.420 2.565 1.00 0.00 O ATOM 2081 CB GLU A 130 -7.630 -12.460 0.472 1.00 0.00 C ATOM 2082 CG GLU A 130 -6.998 -13.169 1.672 1.00 0.00 C ATOM 2083 CD GLU A 130 -6.433 -14.532 1.267 1.00 0.00 C ATOM 2084 OE1 GLU A 130 -7.220 -15.332 0.716 1.00 0.00 O ATOM 2085 OE2 GLU A 130 -5.227 -14.744 1.518 1.00 0.00 O ATOM 0 H GLU A 130 -5.259 -11.554 0.046 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.966 -10.459 -0.178 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.715 -12.550 0.522 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.312 -12.946 -0.451 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.203 -12.550 2.087 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.743 -13.299 2.457 1.00 0.00 H new ATOM 2092 N ILE A 131 -8.420 -9.820 2.188 1.00 0.00 N ATOM 2093 CA ILE A 131 -8.594 -9.204 3.492 1.00 0.00 C ATOM 2094 C ILE A 131 -9.445 -10.121 4.375 1.00 0.00 C ATOM 2095 O ILE A 131 -10.620 -10.346 4.090 1.00 0.00 O ATOM 2096 CB ILE A 131 -9.162 -7.791 3.346 1.00 0.00 C ATOM 2097 CG1 ILE A 131 -8.155 -6.864 2.662 1.00 0.00 C ATOM 2098 CG2 ILE A 131 -9.620 -7.242 4.699 1.00 0.00 C ATOM 2099 CD1 ILE A 131 -8.768 -6.206 1.425 1.00 0.00 C ATOM 0 H ILE A 131 -9.243 -9.784 1.586 1.00 0.00 H new ATOM 0 HA ILE A 131 -7.631 -9.086 3.989 1.00 0.00 H new ATOM 0 HB ILE A 131 -10.042 -7.840 2.704 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -7.828 -6.096 3.363 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -7.269 -7.431 2.375 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -10.020 -6.236 4.567 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -10.394 -7.889 5.111 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -8.773 -7.209 5.384 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -8.031 -5.552 0.958 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -9.071 -6.976 0.716 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -9.639 -5.620 1.719 1.00 0.00 H new ATOM 2111 N ILE A 132 -8.817 -10.624 5.427 1.00 0.00 N ATOM 2112 CA ILE A 132 -9.502 -11.510 6.353 1.00 0.00 C ATOM 2113 C ILE A 132 -9.330 -10.983 7.779 1.00 0.00 C ATOM 2114 O ILE A 132 -8.807 -9.888 7.981 1.00 0.00 O ATOM 2115 CB ILE A 132 -9.022 -12.952 6.169 1.00 0.00 C ATOM 2116 CG1 ILE A 132 -7.506 -13.004 5.967 1.00 0.00 C ATOM 2117 CG2 ILE A 132 -9.776 -13.638 5.028 1.00 0.00 C ATOM 2118 CD1 ILE A 132 -6.769 -12.617 7.250 1.00 0.00 C ATOM 0 H ILE A 132 -7.842 -10.435 5.659 1.00 0.00 H new ATOM 0 HA ILE A 132 -10.572 -11.525 6.145 1.00 0.00 H new ATOM 0 HB ILE A 132 -9.244 -13.506 7.081 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -7.210 -14.008 5.662 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -7.219 -12.329 5.161 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -9.417 -14.661 4.918 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.843 -13.650 5.252 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -9.607 -13.092 4.100 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -5.693 -12.662 7.079 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -7.049 -11.604 7.539 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -7.039 -13.309 8.048 1.00 0.00 H new ATOM 2130 N SER A 133 -9.780 -11.787 8.731 1.00 0.00 N ATOM 2131 CA SER A 133 -9.682 -11.415 10.133 1.00 0.00 C ATOM 2132 C SER A 133 -8.329 -11.851 10.697 1.00 0.00 C ATOM 2133 O SER A 133 -8.251 -12.812 11.461 1.00 0.00 O ATOM 2134 CB SER A 133 -10.821 -12.033 10.947 1.00 0.00 C ATOM 2135 OG SER A 133 -10.650 -11.825 12.346 1.00 0.00 O ATOM 0 H SER A 133 -10.213 -12.694 8.560 1.00 0.00 H new ATOM 0 HA SER A 133 -9.766 -10.331 10.206 1.00 0.00 H new ATOM 0 HB2 SER A 133 -11.770 -11.601 10.629 1.00 0.00 H new ATOM 0 HB3 SER A 133 -10.874 -13.102 10.743 1.00 0.00 H new ATOM 0 HG SER A 133 -11.398 -12.233 12.831 1.00 0.00 H new