USER MOD reduce.3.24.130724 H: found=0, std=0, add=1093, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1094 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 137 ASN : amide:sc= -1.86 K(o=-2.3,f=-8.3!) USER MOD Set 1.2: A 144 THR OG1 : rot -170:sc= -0.39 USER MOD Set 2.1: A 45 SER OG : rot 105:sc= -1.07! USER MOD Set 2.2: A 143 THR OG1 : rot -160:sc= 0.901 USER MOD Set 3.1: A 81 LYS NZ :NH3+ -168:sc= -0.0913 (180deg=-0.00766) USER MOD Set 3.2: A 135 GLN : amide:sc= -1.33 X(o=-1.4,f=-1.9) USER MOD Set 4.1: A 54 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 131 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 27 SER OG : rot 160:sc= 0.99 USER MOD Set 5.2: A 30 HIS : no HD1:sc= -0.564 K(o=0.43,f=-0.72) USER MOD Set 6.1: A 13 MET CE :methyl -118:sc= -2.3 (180deg=-4.98!) USER MOD Set 6.2: A 150 THR OG1 : rot 125:sc= -0.0383 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 MET CE :methyl -156:sc= -2.8 (180deg=-3.88!) USER MOD Single : A 17 ASN : amide:sc= -0.0177 K(o=-0.018,f=-1.5) USER MOD Single : A 18 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0292) USER MOD Single : A 21 CYS SG : rot 54:sc= 0.667 USER MOD Single : A 23 CYS SG : rot 180:sc= -0.357 USER MOD Single : A 25 ASN : amide:sc= -0.564 X(o=-0.56,f=-0.068) USER MOD Single : A 34 ASN : amide:sc= -0.476 K(o=-0.48,f=-1.5) USER MOD Single : A 35 CYS SG : rot -42:sc= 0.34 USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= -0.0925 X(o=-0.092,f=0) USER MOD Single : A 58 ASN :FLIP amide:sc= 0.265 F(o=-1.7!,f=0.27) USER MOD Single : A 59 GLN : amide:sc= -3.82! C(o=-3.8!,f=-5.6!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= -0.946 USER MOD Single : A 65 SER OG : rot 180:sc= -0.0566 USER MOD Single : A 66 MET CE :methyl -160:sc= 0 (180deg=-0.173) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= -0.415 K(o=-0.41,f=-2.4) USER MOD Single : A 73 ASN : amide:sc= -0.537 X(o=-0.54,f=-0.49) USER MOD Single : A 75 GLN :FLIP amide:sc= -2.18! C(o=-3.7!,f=-2.2!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN :FLIP amide:sc= -0.0718 F(o=-1,f=-0.072) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 MET CE :methyl -160:sc= -3.1! (180deg=-4.22!) USER MOD Single : A 98 SER OG : rot 92:sc= 0.00359 USER MOD Single : A 101 THR OG1 : rot -120:sc= -0.18 USER MOD Single : A 102 GLN : amide:sc= -5.34 K(o=-5.3,f=-13!) USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.132 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 GLN : amide:sc= 0.128 X(o=0.13,f=-0.0085) USER MOD Single : A 126 ASN : amide:sc= -5.76! C(o=-5.8!,f=-5.8!) USER MOD Single : A 128 ASN : amide:sc= -1.35 X(o=-1.3,f=-1.5) USER MOD Single : A 129 SER OG : rot 35:sc= 0.316 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc= -0.85 K(o=-0.85,f=-6.5!) USER MOD Single : A 147 SER OG : rot -141:sc= 0.341 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.872 USER MOD Single : A 157 GLN : amide:sc= 0 K(o=0,f=-0.5) USER MOD ----------------------------------------------------------------- ATOM 73 N TYR A 9 12.698 9.366 0.952 1.00 0.00 N ATOM 74 CA TYR A 9 11.772 8.687 1.851 1.00 0.00 C ATOM 75 C TYR A 9 12.136 7.212 1.996 1.00 0.00 C ATOM 76 O TYR A 9 13.153 6.758 1.472 1.00 0.00 O ATOM 77 CB TYR A 9 10.338 8.822 1.337 1.00 0.00 C ATOM 78 CG TYR A 9 9.967 10.234 0.942 1.00 0.00 C ATOM 79 CD1 TYR A 9 9.486 11.136 1.883 1.00 0.00 C ATOM 80 CD2 TYR A 9 10.098 10.665 -0.372 1.00 0.00 C ATOM 81 CE1 TYR A 9 9.145 12.426 1.526 1.00 0.00 C ATOM 82 CE2 TYR A 9 9.761 11.954 -0.738 1.00 0.00 C ATOM 83 CZ TYR A 9 9.284 12.831 0.214 1.00 0.00 C ATOM 84 OH TYR A 9 8.947 14.115 -0.145 1.00 0.00 O ATOM 0 HA TYR A 9 11.845 9.159 2.831 1.00 0.00 H new ATOM 0 HB2 TYR A 9 10.206 8.166 0.476 1.00 0.00 H new ATOM 0 HB3 TYR A 9 9.650 8.477 2.109 1.00 0.00 H new ATOM 0 HD1 TYR A 9 9.377 10.823 2.911 1.00 0.00 H new ATOM 0 HD2 TYR A 9 10.470 9.981 -1.120 1.00 0.00 H new ATOM 0 HE1 TYR A 9 8.771 13.114 2.270 1.00 0.00 H new ATOM 0 HE2 TYR A 9 9.870 12.273 -1.764 1.00 0.00 H new ATOM 0 HH TYR A 9 9.105 14.239 -1.104 1.00 0.00 H new ATOM 94 N MET A 10 11.296 6.470 2.710 1.00 0.00 N ATOM 95 CA MET A 10 11.527 5.046 2.923 1.00 0.00 C ATOM 96 C MET A 10 10.261 4.242 2.644 1.00 0.00 C ATOM 97 O MET A 10 9.148 4.728 2.851 1.00 0.00 O ATOM 98 CB MET A 10 12.001 4.793 4.355 1.00 0.00 C ATOM 99 CG MET A 10 12.696 5.989 4.985 1.00 0.00 C ATOM 100 SD MET A 10 13.648 5.546 6.451 1.00 0.00 S ATOM 101 CE MET A 10 12.470 4.517 7.322 1.00 0.00 C ATOM 0 H MET A 10 10.450 6.831 3.151 1.00 0.00 H new ATOM 0 HA MET A 10 12.302 4.721 2.229 1.00 0.00 H new ATOM 0 HB2 MET A 10 11.144 4.516 4.969 1.00 0.00 H new ATOM 0 HB3 MET A 10 12.684 3.943 4.358 1.00 0.00 H new ATOM 0 HG2 MET A 10 13.359 6.447 4.251 1.00 0.00 H new ATOM 0 HG3 MET A 10 11.951 6.738 5.253 1.00 0.00 H new ATOM 0 HE1 MET A 10 12.706 4.514 8.386 1.00 0.00 H new ATOM 0 HE2 MET A 10 11.464 4.911 7.175 1.00 0.00 H new ATOM 0 HE3 MET A 10 12.521 3.499 6.936 1.00 0.00 H new ATOM 111 N ASP A 11 10.437 3.012 2.175 1.00 0.00 N ATOM 112 CA ASP A 11 9.308 2.141 1.870 1.00 0.00 C ATOM 113 C ASP A 11 8.620 1.675 3.149 1.00 0.00 C ATOM 114 O ASP A 11 7.530 1.102 3.106 1.00 0.00 O ATOM 115 CB ASP A 11 9.775 0.932 1.058 1.00 0.00 C ATOM 116 CG ASP A 11 11.021 0.292 1.636 1.00 0.00 C ATOM 117 OD1 ASP A 11 11.241 0.420 2.859 1.00 0.00 O ATOM 118 OD2 ASP A 11 11.778 -0.337 0.867 1.00 0.00 O ATOM 0 H ASP A 11 11.351 2.595 1.998 1.00 0.00 H new ATOM 0 HA ASP A 11 8.590 2.711 1.280 1.00 0.00 H new ATOM 0 HB2 ASP A 11 8.975 0.193 1.020 1.00 0.00 H new ATOM 0 HB3 ASP A 11 9.972 1.242 0.032 1.00 0.00 H new ATOM 123 N LEU A 12 9.262 1.924 4.285 1.00 0.00 N ATOM 124 CA LEU A 12 8.712 1.529 5.577 1.00 0.00 C ATOM 125 C LEU A 12 8.457 0.026 5.624 1.00 0.00 C ATOM 126 O LEU A 12 7.658 -0.453 6.428 1.00 0.00 O ATOM 127 CB LEU A 12 7.412 2.287 5.853 1.00 0.00 C ATOM 128 CG LEU A 12 7.413 3.773 5.493 1.00 0.00 C ATOM 129 CD1 LEU A 12 5.998 4.329 5.517 1.00 0.00 C ATOM 130 CD2 LEU A 12 8.310 4.552 6.445 1.00 0.00 C ATOM 0 H LEU A 12 10.164 2.398 4.338 1.00 0.00 H new ATOM 0 HA LEU A 12 9.442 1.779 6.347 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.607 1.801 5.302 1.00 0.00 H new ATOM 0 HB3 LEU A 12 7.176 2.190 6.913 1.00 0.00 H new ATOM 0 HG LEU A 12 7.807 3.882 4.483 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.019 5.388 5.258 1.00 0.00 H new ATOM 0 HD12 LEU A 12 5.383 3.791 4.795 1.00 0.00 H new ATOM 0 HD13 LEU A 12 5.576 4.207 6.515 1.00 0.00 H new ATOM 0 HD21 LEU A 12 8.299 5.608 6.174 1.00 0.00 H new ATOM 0 HD22 LEU A 12 7.945 4.436 7.466 1.00 0.00 H new ATOM 0 HD23 LEU A 12 9.329 4.171 6.378 1.00 0.00 H new ATOM 142 N MET A 13 9.143 -0.713 4.758 1.00 0.00 N ATOM 143 CA MET A 13 8.993 -2.162 4.703 1.00 0.00 C ATOM 144 C MET A 13 9.333 -2.795 6.048 1.00 0.00 C ATOM 145 O MET A 13 8.550 -3.554 6.621 1.00 0.00 O ATOM 146 CB MET A 13 9.888 -2.748 3.609 1.00 0.00 C ATOM 147 CG MET A 13 9.206 -3.823 2.777 1.00 0.00 C ATOM 148 SD MET A 13 8.408 -3.157 1.303 1.00 0.00 S ATOM 149 CE MET A 13 6.720 -3.698 1.559 1.00 0.00 C ATOM 0 H MET A 13 9.808 -0.332 4.085 1.00 0.00 H new ATOM 0 HA MET A 13 7.952 -2.386 4.469 1.00 0.00 H new ATOM 0 HB2 MET A 13 10.217 -1.944 2.950 1.00 0.00 H new ATOM 0 HB3 MET A 13 10.782 -3.169 4.069 1.00 0.00 H new ATOM 0 HG2 MET A 13 9.943 -4.570 2.481 1.00 0.00 H new ATOM 0 HG3 MET A 13 8.462 -4.334 3.389 1.00 0.00 H new ATOM 0 HE1 MET A 13 6.426 -4.369 0.751 1.00 0.00 H new ATOM 0 HE2 MET A 13 6.647 -4.223 2.511 1.00 0.00 H new ATOM 0 HE3 MET A 13 6.058 -2.832 1.570 1.00 0.00 H new ATOM 159 N PRO A 14 10.529 -2.478 6.567 1.00 0.00 N ATOM 160 CA PRO A 14 11.000 -3.005 7.851 1.00 0.00 C ATOM 161 C PRO A 14 10.226 -2.430 9.032 1.00 0.00 C ATOM 162 O PRO A 14 10.440 -2.826 10.179 1.00 0.00 O ATOM 163 CB PRO A 14 12.464 -2.559 7.902 1.00 0.00 C ATOM 164 CG PRO A 14 12.522 -1.353 7.030 1.00 0.00 C ATOM 165 CD PRO A 14 11.513 -1.580 5.939 1.00 0.00 C ATOM 0 HA PRO A 14 10.867 -4.084 7.923 1.00 0.00 H new ATOM 0 HB2 PRO A 14 12.772 -2.326 8.921 1.00 0.00 H new ATOM 0 HB3 PRO A 14 13.130 -3.342 7.539 1.00 0.00 H new ATOM 0 HG2 PRO A 14 12.288 -0.451 7.596 1.00 0.00 H new ATOM 0 HG3 PRO A 14 13.521 -1.219 6.615 1.00 0.00 H new ATOM 0 HD2 PRO A 14 11.055 -0.646 5.614 1.00 0.00 H new ATOM 0 HD3 PRO A 14 11.968 -2.035 5.059 1.00 0.00 H new ATOM 173 N PHE A 15 9.327 -1.495 8.746 1.00 0.00 N ATOM 174 CA PHE A 15 8.521 -0.865 9.785 1.00 0.00 C ATOM 175 C PHE A 15 7.132 -1.494 9.853 1.00 0.00 C ATOM 176 O PHE A 15 6.338 -1.177 10.739 1.00 0.00 O ATOM 177 CB PHE A 15 8.401 0.638 9.526 1.00 0.00 C ATOM 178 CG PHE A 15 9.688 1.386 9.728 1.00 0.00 C ATOM 179 CD1 PHE A 15 10.743 1.225 8.846 1.00 0.00 C ATOM 180 CD2 PHE A 15 9.842 2.249 10.801 1.00 0.00 C ATOM 181 CE1 PHE A 15 11.929 1.912 9.028 1.00 0.00 C ATOM 182 CE2 PHE A 15 11.025 2.939 10.989 1.00 0.00 C ATOM 183 CZ PHE A 15 12.070 2.769 10.102 1.00 0.00 C ATOM 0 H PHE A 15 9.138 -1.156 7.803 1.00 0.00 H new ATOM 0 HA PHE A 15 9.019 -1.023 10.742 1.00 0.00 H new ATOM 0 HB2 PHE A 15 8.055 0.796 8.505 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.641 1.053 10.188 1.00 0.00 H new ATOM 0 HD1 PHE A 15 10.638 0.555 8.006 1.00 0.00 H new ATOM 0 HD2 PHE A 15 9.029 2.384 11.498 1.00 0.00 H new ATOM 0 HE1 PHE A 15 12.744 1.779 8.332 1.00 0.00 H new ATOM 0 HE2 PHE A 15 11.132 3.610 11.828 1.00 0.00 H new ATOM 0 HZ PHE A 15 12.996 3.305 10.248 1.00 0.00 H new ATOM 193 N ILE A 16 6.846 -2.385 8.909 1.00 0.00 N ATOM 194 CA ILE A 16 5.554 -3.058 8.861 1.00 0.00 C ATOM 195 C ILE A 16 5.558 -4.317 9.721 1.00 0.00 C ATOM 196 O ILE A 16 6.468 -5.140 9.631 1.00 0.00 O ATOM 197 CB ILE A 16 5.170 -3.437 7.419 1.00 0.00 C ATOM 198 CG1 ILE A 16 5.015 -2.178 6.562 1.00 0.00 C ATOM 199 CG2 ILE A 16 3.885 -4.252 7.409 1.00 0.00 C ATOM 200 CD1 ILE A 16 5.392 -2.385 5.112 1.00 0.00 C ATOM 0 H ILE A 16 7.491 -2.657 8.168 1.00 0.00 H new ATOM 0 HA ILE A 16 4.818 -2.356 9.252 1.00 0.00 H new ATOM 0 HB ILE A 16 5.967 -4.047 6.995 1.00 0.00 H new ATOM 0 HG12 ILE A 16 3.981 -1.837 6.615 1.00 0.00 H new ATOM 0 HG13 ILE A 16 5.634 -1.385 6.981 1.00 0.00 H new ATOM 0 HG21 ILE A 16 3.627 -4.512 6.382 1.00 0.00 H new ATOM 0 HG22 ILE A 16 4.028 -5.164 7.989 1.00 0.00 H new ATOM 0 HG23 ILE A 16 3.078 -3.665 7.848 1.00 0.00 H new ATOM 0 HD11 ILE A 16 5.258 -1.452 4.564 1.00 0.00 H new ATOM 0 HD12 ILE A 16 6.435 -2.697 5.048 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.756 -3.156 4.677 1.00 0.00 H new ATOM 212 N ASN A 17 4.533 -4.461 10.555 1.00 0.00 N ATOM 213 CA ASN A 17 4.417 -5.621 11.431 1.00 0.00 C ATOM 214 C ASN A 17 3.778 -6.796 10.697 1.00 0.00 C ATOM 215 O ASN A 17 2.556 -6.952 10.696 1.00 0.00 O ATOM 216 CB ASN A 17 3.592 -5.270 12.671 1.00 0.00 C ATOM 217 CG ASN A 17 3.669 -6.343 13.739 1.00 0.00 C ATOM 218 OD1 ASN A 17 4.607 -7.140 13.768 1.00 0.00 O ATOM 219 ND2 ASN A 17 2.680 -6.368 14.625 1.00 0.00 N ATOM 0 H ASN A 17 3.771 -3.789 10.642 1.00 0.00 H new ATOM 0 HA ASN A 17 5.421 -5.912 11.741 1.00 0.00 H new ATOM 0 HB2 ASN A 17 3.945 -4.325 13.083 1.00 0.00 H new ATOM 0 HB3 ASN A 17 2.551 -5.123 12.382 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.678 -7.067 15.368 1.00 0.00 H new ATOM 0 HD22 ASN A 17 1.922 -5.688 14.563 1.00 0.00 H new ATOM 226 N LYS A 18 4.611 -7.621 10.073 1.00 0.00 N ATOM 227 CA LYS A 18 4.130 -8.783 9.336 1.00 0.00 C ATOM 228 C LYS A 18 3.348 -9.722 10.250 1.00 0.00 C ATOM 229 O LYS A 18 2.539 -10.524 9.786 1.00 0.00 O ATOM 230 CB LYS A 18 5.303 -9.533 8.701 1.00 0.00 C ATOM 231 CG LYS A 18 5.734 -8.964 7.360 1.00 0.00 C ATOM 232 CD LYS A 18 5.018 -9.648 6.208 1.00 0.00 C ATOM 233 CE LYS A 18 5.883 -10.729 5.577 1.00 0.00 C ATOM 234 NZ LYS A 18 5.847 -11.995 6.361 1.00 0.00 N ATOM 0 H LYS A 18 5.624 -7.506 10.063 1.00 0.00 H new ATOM 0 HA LYS A 18 3.463 -8.431 8.549 1.00 0.00 H new ATOM 0 HB2 LYS A 18 6.151 -9.510 9.385 1.00 0.00 H new ATOM 0 HB3 LYS A 18 5.027 -10.579 8.570 1.00 0.00 H new ATOM 0 HG2 LYS A 18 5.527 -7.894 7.334 1.00 0.00 H new ATOM 0 HG3 LYS A 18 6.811 -9.083 7.242 1.00 0.00 H new ATOM 0 HD2 LYS A 18 4.088 -10.088 6.567 1.00 0.00 H new ATOM 0 HD3 LYS A 18 4.751 -8.908 5.454 1.00 0.00 H new ATOM 0 HE2 LYS A 18 5.540 -10.921 4.560 1.00 0.00 H new ATOM 0 HE3 LYS A 18 6.912 -10.375 5.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 6.393 -12.727 5.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 6.261 -11.833 7.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 4.862 -12.310 6.466 1.00 0.00 H new ATOM 248 N ALA A 19 3.596 -9.614 11.551 1.00 0.00 N ATOM 249 CA ALA A 19 2.913 -10.451 12.530 1.00 0.00 C ATOM 250 C ALA A 19 1.591 -9.825 12.960 1.00 0.00 C ATOM 251 O ALA A 19 0.930 -10.313 13.877 1.00 0.00 O ATOM 252 CB ALA A 19 3.806 -10.685 13.739 1.00 0.00 C ATOM 0 H ALA A 19 4.264 -8.956 11.951 1.00 0.00 H new ATOM 0 HA ALA A 19 2.695 -11.411 12.062 1.00 0.00 H new ATOM 0 HB1 ALA A 19 3.283 -11.311 14.462 1.00 0.00 H new ATOM 0 HB2 ALA A 19 4.723 -11.183 13.423 1.00 0.00 H new ATOM 0 HB3 ALA A 19 4.053 -9.728 14.200 1.00 0.00 H new ATOM 258 N GLY A 20 1.210 -8.740 12.293 1.00 0.00 N ATOM 259 CA GLY A 20 -0.032 -8.064 12.621 1.00 0.00 C ATOM 260 C GLY A 20 -0.829 -7.684 11.389 1.00 0.00 C ATOM 261 O GLY A 20 -1.837 -6.984 11.486 1.00 0.00 O ATOM 0 H GLY A 20 1.739 -8.317 11.531 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -0.637 -8.711 13.256 1.00 0.00 H new ATOM 0 HA3 GLY A 20 0.188 -7.166 13.198 1.00 0.00 H new ATOM 265 N CYS A 21 -0.376 -8.144 10.228 1.00 0.00 N ATOM 266 CA CYS A 21 -1.053 -7.846 8.971 1.00 0.00 C ATOM 267 C CYS A 21 -2.249 -8.769 8.765 1.00 0.00 C ATOM 268 O CYS A 21 -2.254 -9.907 9.234 1.00 0.00 O ATOM 269 CB CYS A 21 -0.080 -7.983 7.799 1.00 0.00 C ATOM 270 SG CYS A 21 1.216 -6.722 7.764 1.00 0.00 S ATOM 0 H CYS A 21 0.457 -8.725 10.131 1.00 0.00 H new ATOM 0 HA CYS A 21 -1.414 -6.819 9.016 1.00 0.00 H new ATOM 0 HB2 CYS A 21 0.387 -8.967 7.841 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -0.642 -7.937 6.866 1.00 0.00 H new ATOM 0 HG CYS A 21 1.840 -6.709 8.904 1.00 0.00 H new ATOM 276 N GLU A 22 -3.261 -8.270 8.063 1.00 0.00 N ATOM 277 CA GLU A 22 -4.465 -9.050 7.798 1.00 0.00 C ATOM 278 C GLU A 22 -4.902 -8.899 6.344 1.00 0.00 C ATOM 279 O GLU A 22 -4.927 -7.792 5.804 1.00 0.00 O ATOM 280 CB GLU A 22 -5.597 -8.615 8.731 1.00 0.00 C ATOM 281 CG GLU A 22 -6.964 -9.128 8.309 1.00 0.00 C ATOM 282 CD GLU A 22 -7.758 -9.695 9.470 1.00 0.00 C ATOM 283 OE1 GLU A 22 -7.769 -9.062 10.547 1.00 0.00 O ATOM 284 OE2 GLU A 22 -8.368 -10.772 9.302 1.00 0.00 O ATOM 0 H GLU A 22 -3.272 -7.330 7.668 1.00 0.00 H new ATOM 0 HA GLU A 22 -4.235 -10.099 7.983 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.381 -8.968 9.740 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.624 -7.526 8.773 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.527 -8.315 7.851 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.840 -9.898 7.548 1.00 0.00 H new ATOM 291 N CYS A 23 -5.245 -10.018 5.717 1.00 0.00 N ATOM 292 CA CYS A 23 -5.681 -10.011 4.324 1.00 0.00 C ATOM 293 C CYS A 23 -7.087 -10.587 4.192 1.00 0.00 C ATOM 294 O CYS A 23 -7.446 -11.542 4.882 1.00 0.00 O ATOM 295 CB CYS A 23 -4.705 -10.811 3.460 1.00 0.00 C ATOM 296 SG CYS A 23 -4.289 -12.438 4.129 1.00 0.00 S ATOM 0 H CYS A 23 -5.230 -10.941 6.150 1.00 0.00 H new ATOM 0 HA CYS A 23 -5.698 -8.977 3.978 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -5.136 -10.938 2.467 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -3.788 -10.235 3.338 1.00 0.00 H new ATOM 0 HG CYS A 23 -3.460 -13.038 3.327 1.00 0.00 H new ATOM 302 N LEU A 24 -7.879 -10.000 3.301 1.00 0.00 N ATOM 303 CA LEU A 24 -9.247 -10.453 3.078 1.00 0.00 C ATOM 304 C LEU A 24 -9.387 -11.111 1.709 1.00 0.00 C ATOM 305 O LEU A 24 -8.885 -10.599 0.710 1.00 0.00 O ATOM 306 CB LEU A 24 -10.220 -9.278 3.194 1.00 0.00 C ATOM 307 CG LEU A 24 -10.080 -8.412 4.447 1.00 0.00 C ATOM 308 CD1 LEU A 24 -11.257 -7.456 4.568 1.00 0.00 C ATOM 309 CD2 LEU A 24 -9.969 -9.285 5.688 1.00 0.00 C ATOM 0 H LEU A 24 -7.597 -9.209 2.722 1.00 0.00 H new ATOM 0 HA LEU A 24 -9.487 -11.192 3.842 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -10.094 -8.640 2.320 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -11.237 -9.669 3.159 1.00 0.00 H new ATOM 0 HG LEU A 24 -9.167 -7.823 4.359 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -11.141 -6.848 5.465 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.291 -6.808 3.692 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -12.184 -8.026 4.634 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.870 -8.652 6.570 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -10.864 -9.900 5.781 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -9.093 -9.929 5.603 1.00 0.00 H new ATOM 321 N ASN A 25 -10.075 -12.247 1.672 1.00 0.00 N ATOM 322 CA ASN A 25 -10.282 -12.974 0.425 1.00 0.00 C ATOM 323 C ASN A 25 -8.949 -13.348 -0.215 1.00 0.00 C ATOM 324 O ASN A 25 -8.845 -13.458 -1.437 1.00 0.00 O ATOM 325 CB ASN A 25 -11.110 -12.133 -0.549 1.00 0.00 C ATOM 326 CG ASN A 25 -11.875 -12.984 -1.544 1.00 0.00 C ATOM 327 OD1 ASN A 25 -12.670 -13.842 -1.161 1.00 0.00 O ATOM 328 ND2 ASN A 25 -11.636 -12.750 -2.829 1.00 0.00 N ATOM 0 H ASN A 25 -10.498 -12.684 2.491 1.00 0.00 H new ATOM 0 HA ASN A 25 -10.824 -13.891 0.655 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -11.812 -11.517 0.013 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.451 -11.453 -1.088 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -12.120 -13.292 -3.545 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -10.968 -12.028 -3.100 1.00 0.00 H new ATOM 335 N GLU A 26 -7.932 -13.543 0.619 1.00 0.00 N ATOM 336 CA GLU A 26 -6.606 -13.905 0.134 1.00 0.00 C ATOM 337 C GLU A 26 -6.625 -15.279 -0.529 1.00 0.00 C ATOM 338 O GLU A 26 -7.184 -16.233 0.011 1.00 0.00 O ATOM 339 CB GLU A 26 -5.597 -13.896 1.285 1.00 0.00 C ATOM 340 CG GLU A 26 -4.230 -14.435 0.901 1.00 0.00 C ATOM 341 CD GLU A 26 -3.857 -15.685 1.674 1.00 0.00 C ATOM 342 OE1 GLU A 26 -4.755 -16.514 1.932 1.00 0.00 O ATOM 343 OE2 GLU A 26 -2.667 -15.834 2.021 1.00 0.00 O ATOM 0 H GLU A 26 -8.001 -13.456 1.633 1.00 0.00 H new ATOM 0 HA GLU A 26 -6.305 -13.166 -0.609 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -5.486 -12.875 1.651 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -5.994 -14.489 2.109 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -4.217 -14.655 -0.166 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -3.478 -13.666 1.077 1.00 0.00 H new ATOM 350 N SER A 27 -6.009 -15.371 -1.704 1.00 0.00 N ATOM 351 CA SER A 27 -5.959 -16.627 -2.444 1.00 0.00 C ATOM 352 C SER A 27 -5.326 -17.729 -1.601 1.00 0.00 C ATOM 353 O SER A 27 -4.541 -17.458 -0.692 1.00 0.00 O ATOM 354 CB SER A 27 -5.171 -16.446 -3.743 1.00 0.00 C ATOM 355 OG SER A 27 -4.513 -17.646 -4.111 1.00 0.00 O ATOM 0 H SER A 27 -5.538 -14.591 -2.163 1.00 0.00 H new ATOM 0 HA SER A 27 -6.981 -16.920 -2.685 1.00 0.00 H new ATOM 0 HB2 SER A 27 -5.846 -16.138 -4.542 1.00 0.00 H new ATOM 0 HB3 SER A 27 -4.438 -15.649 -3.620 1.00 0.00 H new ATOM 0 HG SER A 27 -4.293 -17.619 -5.065 1.00 0.00 H new ATOM 361 N ASP A 28 -5.673 -18.974 -1.909 1.00 0.00 N ATOM 362 CA ASP A 28 -5.139 -20.119 -1.181 1.00 0.00 C ATOM 363 C ASP A 28 -3.750 -20.489 -1.693 1.00 0.00 C ATOM 364 O ASP A 28 -2.858 -20.819 -0.912 1.00 0.00 O ATOM 365 CB ASP A 28 -6.080 -21.318 -1.312 1.00 0.00 C ATOM 366 CG ASP A 28 -7.289 -21.206 -0.403 1.00 0.00 C ATOM 367 OD1 ASP A 28 -7.106 -21.225 0.833 1.00 0.00 O ATOM 368 OD2 ASP A 28 -8.417 -21.100 -0.927 1.00 0.00 O ATOM 0 H ASP A 28 -6.322 -19.216 -2.658 1.00 0.00 H new ATOM 0 HA ASP A 28 -5.058 -19.844 -0.129 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -6.413 -21.404 -2.346 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.535 -22.232 -1.076 1.00 0.00 H new ATOM 373 N GLU A 29 -3.576 -20.432 -3.010 1.00 0.00 N ATOM 374 CA GLU A 29 -2.296 -20.764 -3.626 1.00 0.00 C ATOM 375 C GLU A 29 -1.339 -19.577 -3.561 1.00 0.00 C ATOM 376 O GLU A 29 -0.125 -19.751 -3.444 1.00 0.00 O ATOM 377 CB GLU A 29 -2.500 -21.190 -5.081 1.00 0.00 C ATOM 378 CG GLU A 29 -3.607 -22.215 -5.265 1.00 0.00 C ATOM 379 CD GLU A 29 -3.746 -22.670 -6.705 1.00 0.00 C ATOM 380 OE1 GLU A 29 -2.706 -22.851 -7.372 1.00 0.00 O ATOM 381 OE2 GLU A 29 -4.894 -22.846 -7.164 1.00 0.00 O ATOM 0 H GLU A 29 -4.304 -20.159 -3.670 1.00 0.00 H new ATOM 0 HA GLU A 29 -1.858 -21.594 -3.071 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.729 -20.309 -5.680 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -1.567 -21.603 -5.464 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -3.406 -23.079 -4.632 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -4.552 -21.788 -4.930 1.00 0.00 H new ATOM 388 N HIS A 30 -1.893 -18.372 -3.640 1.00 0.00 N ATOM 389 CA HIS A 30 -1.089 -17.156 -3.590 1.00 0.00 C ATOM 390 C HIS A 30 -1.259 -16.446 -2.251 1.00 0.00 C ATOM 391 O HIS A 30 -2.333 -16.478 -1.652 1.00 0.00 O ATOM 392 CB HIS A 30 -1.477 -16.216 -4.732 1.00 0.00 C ATOM 393 CG HIS A 30 -1.523 -16.886 -6.071 1.00 0.00 C ATOM 394 ND1 HIS A 30 -2.651 -16.906 -6.864 1.00 0.00 N ATOM 395 CD2 HIS A 30 -0.572 -17.562 -6.756 1.00 0.00 C ATOM 396 CE1 HIS A 30 -2.392 -17.567 -7.978 1.00 0.00 C ATOM 397 NE2 HIS A 30 -1.136 -17.975 -7.938 1.00 0.00 N ATOM 0 H HIS A 30 -2.895 -18.211 -3.739 1.00 0.00 H new ATOM 0 HA HIS A 30 -0.042 -17.438 -3.701 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -2.454 -15.782 -4.518 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -0.764 -15.392 -4.772 1.00 0.00 H new ATOM 0 HD2 HIS A 30 0.443 -17.743 -6.433 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -3.088 -17.744 -8.784 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -0.662 -18.510 -8.666 1.00 0.00 H new ATOM 405 N GLY A 31 -0.190 -15.805 -1.786 1.00 0.00 N ATOM 406 CA GLY A 31 -0.243 -15.097 -0.520 1.00 0.00 C ATOM 407 C GLY A 31 -0.187 -13.592 -0.695 1.00 0.00 C ATOM 408 O GLY A 31 0.441 -13.091 -1.628 1.00 0.00 O ATOM 0 H GLY A 31 0.711 -15.764 -2.263 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -1.160 -15.365 0.005 1.00 0.00 H new ATOM 0 HA3 GLY A 31 0.588 -15.418 0.107 1.00 0.00 H new ATOM 412 N PHE A 32 -0.846 -12.869 0.205 1.00 0.00 N ATOM 413 CA PHE A 32 -0.871 -11.412 0.145 1.00 0.00 C ATOM 414 C PHE A 32 0.424 -10.823 0.697 1.00 0.00 C ATOM 415 O PHE A 32 0.622 -9.608 0.681 1.00 0.00 O ATOM 416 CB PHE A 32 -2.067 -10.869 0.928 1.00 0.00 C ATOM 417 CG PHE A 32 -3.049 -10.116 0.077 1.00 0.00 C ATOM 418 CD1 PHE A 32 -2.645 -9.015 -0.661 1.00 0.00 C ATOM 419 CD2 PHE A 32 -4.376 -10.508 0.015 1.00 0.00 C ATOM 420 CE1 PHE A 32 -3.546 -8.319 -1.444 1.00 0.00 C ATOM 421 CE2 PHE A 32 -5.283 -9.817 -0.767 1.00 0.00 C ATOM 422 CZ PHE A 32 -4.867 -8.722 -1.498 1.00 0.00 C ATOM 0 H PHE A 32 -1.370 -13.268 0.984 1.00 0.00 H new ATOM 0 HA PHE A 32 -0.967 -11.117 -0.900 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -2.581 -11.699 1.413 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -1.705 -10.212 1.719 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -1.614 -8.697 -0.624 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -4.706 -11.364 0.585 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -3.219 -7.461 -2.013 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -6.315 -10.133 -0.806 1.00 0.00 H new ATOM 0 HZ PHE A 32 -5.573 -8.181 -2.111 1.00 0.00 H new ATOM 432 N ASP A 33 1.301 -11.692 1.186 1.00 0.00 N ATOM 433 CA ASP A 33 2.577 -11.260 1.744 1.00 0.00 C ATOM 434 C ASP A 33 3.683 -11.341 0.696 1.00 0.00 C ATOM 435 O ASP A 33 4.691 -10.641 0.788 1.00 0.00 O ATOM 436 CB ASP A 33 2.944 -12.114 2.958 1.00 0.00 C ATOM 437 CG ASP A 33 3.675 -13.385 2.572 1.00 0.00 C ATOM 438 OD1 ASP A 33 3.002 -14.363 2.182 1.00 0.00 O ATOM 439 OD2 ASP A 33 4.921 -13.402 2.658 1.00 0.00 O ATOM 0 H ASP A 33 1.152 -12.701 1.207 1.00 0.00 H new ATOM 0 HA ASP A 33 2.474 -10.222 2.059 1.00 0.00 H new ATOM 0 HB2 ASP A 33 3.569 -11.530 3.634 1.00 0.00 H new ATOM 0 HB3 ASP A 33 2.037 -12.372 3.505 1.00 0.00 H new ATOM 444 N ASN A 34 3.488 -12.200 -0.298 1.00 0.00 N ATOM 445 CA ASN A 34 4.469 -12.374 -1.363 1.00 0.00 C ATOM 446 C ASN A 34 4.452 -11.185 -2.319 1.00 0.00 C ATOM 447 O ASN A 34 5.390 -10.982 -3.090 1.00 0.00 O ATOM 448 CB ASN A 34 4.194 -13.667 -2.133 1.00 0.00 C ATOM 449 CG ASN A 34 3.853 -14.825 -1.216 1.00 0.00 C ATOM 450 OD1 ASN A 34 4.324 -14.892 -0.080 1.00 0.00 O ATOM 451 ND2 ASN A 34 3.032 -15.746 -1.706 1.00 0.00 N ATOM 0 H ASN A 34 2.659 -12.787 -0.389 1.00 0.00 H new ATOM 0 HA ASN A 34 5.457 -12.435 -0.906 1.00 0.00 H new ATOM 0 HB2 ASN A 34 3.371 -13.504 -2.829 1.00 0.00 H new ATOM 0 HB3 ASN A 34 5.069 -13.925 -2.729 1.00 0.00 H new ATOM 0 HD21 ASN A 34 2.768 -16.549 -1.136 1.00 0.00 H new ATOM 0 HD22 ASN A 34 2.665 -15.650 -2.653 1.00 0.00 H new ATOM 458 N CYS A 35 3.379 -10.404 -2.262 1.00 0.00 N ATOM 459 CA CYS A 35 3.239 -9.234 -3.123 1.00 0.00 C ATOM 460 C CYS A 35 3.753 -7.980 -2.424 1.00 0.00 C ATOM 461 O CYS A 35 3.445 -6.859 -2.831 1.00 0.00 O ATOM 462 CB CYS A 35 1.775 -9.045 -3.525 1.00 0.00 C ATOM 463 SG CYS A 35 0.711 -8.462 -2.186 1.00 0.00 S ATOM 0 H CYS A 35 2.594 -10.559 -1.630 1.00 0.00 H new ATOM 0 HA CYS A 35 3.837 -9.399 -4.019 1.00 0.00 H new ATOM 0 HB2 CYS A 35 1.725 -8.334 -4.350 1.00 0.00 H new ATOM 0 HB3 CYS A 35 1.386 -9.993 -3.897 1.00 0.00 H new ATOM 0 HG CYS A 35 1.005 -9.097 -1.090 1.00 0.00 H new ATOM 469 N LEU A 36 4.538 -8.176 -1.370 1.00 0.00 N ATOM 470 CA LEU A 36 5.094 -7.060 -0.613 1.00 0.00 C ATOM 471 C LEU A 36 6.526 -6.766 -1.050 1.00 0.00 C ATOM 472 O LEU A 36 6.946 -5.609 -1.097 1.00 0.00 O ATOM 473 CB LEU A 36 5.060 -7.367 0.885 1.00 0.00 C ATOM 474 CG LEU A 36 3.731 -7.102 1.594 1.00 0.00 C ATOM 475 CD1 LEU A 36 3.588 -7.999 2.814 1.00 0.00 C ATOM 476 CD2 LEU A 36 3.620 -5.637 1.990 1.00 0.00 C ATOM 0 H LEU A 36 4.804 -9.097 -1.021 1.00 0.00 H new ATOM 0 HA LEU A 36 4.484 -6.179 -0.811 1.00 0.00 H new ATOM 0 HB2 LEU A 36 5.322 -8.416 1.027 1.00 0.00 H new ATOM 0 HB3 LEU A 36 5.834 -6.776 1.374 1.00 0.00 H new ATOM 0 HG LEU A 36 2.920 -7.333 0.903 1.00 0.00 H new ATOM 0 HD11 LEU A 36 2.636 -7.796 3.305 1.00 0.00 H new ATOM 0 HD12 LEU A 36 3.621 -9.043 2.504 1.00 0.00 H new ATOM 0 HD13 LEU A 36 4.404 -7.801 3.509 1.00 0.00 H new ATOM 0 HD21 LEU A 36 2.668 -5.467 2.493 1.00 0.00 H new ATOM 0 HD22 LEU A 36 4.437 -5.379 2.663 1.00 0.00 H new ATOM 0 HD23 LEU A 36 3.675 -5.014 1.097 1.00 0.00 H new ATOM 594 N LEU A 43 0.122 -12.016 -5.977 1.00 0.00 N ATOM 595 CA LEU A 43 -1.137 -12.267 -5.285 1.00 0.00 C ATOM 596 C LEU A 43 -2.318 -12.143 -6.242 1.00 0.00 C ATOM 597 O LEU A 43 -2.679 -11.043 -6.658 1.00 0.00 O ATOM 598 CB LEU A 43 -1.305 -11.290 -4.120 1.00 0.00 C ATOM 599 CG LEU A 43 -2.545 -11.492 -3.248 1.00 0.00 C ATOM 600 CD1 LEU A 43 -3.763 -10.854 -3.896 1.00 0.00 C ATOM 601 CD2 LEU A 43 -2.785 -12.974 -2.998 1.00 0.00 C ATOM 0 HA LEU A 43 -1.113 -13.285 -4.897 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -0.423 -11.359 -3.484 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.329 -10.277 -4.522 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.374 -11.005 -2.288 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -4.636 -11.008 -3.261 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.590 -9.785 -4.022 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.938 -11.311 -4.870 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.671 -13.099 -2.376 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.935 -13.484 -3.950 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.921 -13.402 -2.489 1.00 0.00 H new ATOM 613 N GLU A 44 -2.918 -13.279 -6.584 1.00 0.00 N ATOM 614 CA GLU A 44 -4.060 -13.297 -7.491 1.00 0.00 C ATOM 615 C GLU A 44 -5.363 -13.491 -6.721 1.00 0.00 C ATOM 616 O GLU A 44 -5.405 -14.209 -5.722 1.00 0.00 O ATOM 617 CB GLU A 44 -3.898 -14.409 -8.529 1.00 0.00 C ATOM 618 CG GLU A 44 -4.743 -14.205 -9.776 1.00 0.00 C ATOM 619 CD GLU A 44 -4.116 -14.820 -11.012 1.00 0.00 C ATOM 620 OE1 GLU A 44 -3.320 -15.770 -10.865 1.00 0.00 O ATOM 621 OE2 GLU A 44 -4.422 -14.349 -12.128 1.00 0.00 O ATOM 0 H GLU A 44 -2.632 -14.198 -6.247 1.00 0.00 H new ATOM 0 HA GLU A 44 -4.100 -12.335 -8.003 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -2.849 -14.475 -8.818 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -4.163 -15.362 -8.072 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -5.729 -14.642 -9.618 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -4.890 -13.138 -9.940 1.00 0.00 H new ATOM 628 N SER A 45 -6.424 -12.845 -7.193 1.00 0.00 N ATOM 629 CA SER A 45 -7.728 -12.942 -6.547 1.00 0.00 C ATOM 630 C SER A 45 -8.500 -14.152 -7.063 1.00 0.00 C ATOM 631 O SER A 45 -8.579 -14.385 -8.269 1.00 0.00 O ATOM 632 CB SER A 45 -8.537 -11.666 -6.789 1.00 0.00 C ATOM 633 OG SER A 45 -7.708 -10.620 -7.266 1.00 0.00 O ATOM 0 H SER A 45 -6.407 -12.249 -8.020 1.00 0.00 H new ATOM 0 HA SER A 45 -7.567 -13.064 -5.476 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.329 -11.865 -7.511 1.00 0.00 H new ATOM 0 HB3 SER A 45 -9.021 -11.357 -5.862 1.00 0.00 H new ATOM 0 HG SER A 45 -7.857 -10.496 -8.227 1.00 0.00 H new ATOM 639 N ASP A 46 -9.069 -14.920 -6.139 1.00 0.00 N ATOM 640 CA ASP A 46 -9.837 -16.106 -6.498 1.00 0.00 C ATOM 641 C ASP A 46 -11.315 -15.768 -6.662 1.00 0.00 C ATOM 642 O ASP A 46 -12.165 -16.659 -6.707 1.00 0.00 O ATOM 643 CB ASP A 46 -9.664 -17.193 -5.436 1.00 0.00 C ATOM 644 CG ASP A 46 -9.731 -18.590 -6.020 1.00 0.00 C ATOM 645 OD1 ASP A 46 -10.644 -18.851 -6.832 1.00 0.00 O ATOM 646 OD2 ASP A 46 -8.870 -19.423 -5.667 1.00 0.00 O ATOM 0 H ASP A 46 -9.012 -14.742 -5.136 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.460 -16.477 -7.451 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -8.706 -17.058 -4.935 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -10.439 -17.082 -4.677 1.00 0.00 H new ATOM 651 N CYS A 47 -11.615 -14.477 -6.748 1.00 0.00 N ATOM 652 CA CYS A 47 -12.992 -14.021 -6.904 1.00 0.00 C ATOM 653 C CYS A 47 -13.062 -12.809 -7.828 1.00 0.00 C ATOM 654 O CYS A 47 -13.693 -12.856 -8.884 1.00 0.00 O ATOM 655 CB CYS A 47 -13.594 -13.674 -5.542 1.00 0.00 C ATOM 656 SG CYS A 47 -15.378 -13.385 -5.575 1.00 0.00 S ATOM 0 H CYS A 47 -10.924 -13.728 -6.712 1.00 0.00 H new ATOM 0 HA CYS A 47 -13.568 -14.831 -7.352 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -13.381 -14.485 -4.846 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -13.100 -12.783 -5.155 1.00 0.00 H new ATOM 0 HG CYS A 47 -15.794 -13.101 -4.377 1.00 0.00 H new ATOM 662 N ASP A 48 -12.411 -11.725 -7.422 1.00 0.00 N ATOM 663 CA ASP A 48 -12.399 -10.499 -8.213 1.00 0.00 C ATOM 664 C ASP A 48 -11.571 -9.417 -7.526 1.00 0.00 C ATOM 665 O ASP A 48 -10.877 -9.683 -6.545 1.00 0.00 O ATOM 666 CB ASP A 48 -13.827 -9.999 -8.439 1.00 0.00 C ATOM 667 CG ASP A 48 -14.208 -9.982 -9.906 1.00 0.00 C ATOM 668 OD1 ASP A 48 -14.711 -11.013 -10.400 1.00 0.00 O ATOM 669 OD2 ASP A 48 -14.003 -8.938 -10.561 1.00 0.00 O ATOM 0 H ASP A 48 -11.885 -11.670 -6.550 1.00 0.00 H new ATOM 0 HA ASP A 48 -11.943 -10.722 -9.178 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -14.523 -10.636 -7.893 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -13.926 -8.994 -8.029 1.00 0.00 H new ATOM 674 N GLU A 49 -11.649 -8.198 -8.050 1.00 0.00 N ATOM 675 CA GLU A 49 -10.904 -7.077 -7.488 1.00 0.00 C ATOM 676 C GLU A 49 -11.607 -6.523 -6.252 1.00 0.00 C ATOM 677 O GLU A 49 -11.940 -5.339 -6.195 1.00 0.00 O ATOM 678 CB GLU A 49 -10.738 -5.972 -8.533 1.00 0.00 C ATOM 679 CG GLU A 49 -12.037 -5.578 -9.215 1.00 0.00 C ATOM 680 CD GLU A 49 -12.261 -6.322 -10.518 1.00 0.00 C ATOM 681 OE1 GLU A 49 -11.536 -7.306 -10.772 1.00 0.00 O ATOM 682 OE2 GLU A 49 -13.162 -5.919 -11.283 1.00 0.00 O ATOM 0 H GLU A 49 -12.220 -7.961 -8.862 1.00 0.00 H new ATOM 0 HA GLU A 49 -9.919 -7.439 -7.193 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -10.308 -5.092 -8.054 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -10.026 -6.303 -9.289 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -12.871 -5.774 -8.541 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -12.030 -4.506 -9.410 1.00 0.00 H new ATOM 689 N GLN A 50 -11.828 -7.387 -5.267 1.00 0.00 N ATOM 690 CA GLN A 50 -12.492 -6.984 -4.033 1.00 0.00 C ATOM 691 C GLN A 50 -11.726 -7.485 -2.814 1.00 0.00 C ATOM 692 O GLN A 50 -12.322 -7.899 -1.819 1.00 0.00 O ATOM 693 CB GLN A 50 -13.926 -7.516 -4.003 1.00 0.00 C ATOM 694 CG GLN A 50 -14.850 -6.832 -4.997 1.00 0.00 C ATOM 695 CD GLN A 50 -15.816 -5.872 -4.331 1.00 0.00 C ATOM 696 OE1 GLN A 50 -16.749 -6.288 -3.645 1.00 0.00 O ATOM 697 NE2 GLN A 50 -15.595 -4.577 -4.530 1.00 0.00 N ATOM 0 H GLN A 50 -11.557 -8.370 -5.299 1.00 0.00 H new ATOM 0 HA GLN A 50 -12.515 -5.895 -4.002 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -13.912 -8.586 -4.210 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -14.330 -7.391 -2.998 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -14.252 -6.290 -5.729 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -15.414 -7.588 -5.543 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -14.809 -4.276 -5.106 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -16.211 -3.883 -4.106 1.00 0.00 H new ATOM 706 N LEU A 51 -10.400 -7.446 -2.897 1.00 0.00 N ATOM 707 CA LEU A 51 -9.551 -7.896 -1.800 1.00 0.00 C ATOM 708 C LEU A 51 -9.083 -6.717 -0.954 1.00 0.00 C ATOM 709 O LEU A 51 -8.910 -5.607 -1.459 1.00 0.00 O ATOM 710 CB LEU A 51 -8.342 -8.659 -2.345 1.00 0.00 C ATOM 711 CG LEU A 51 -8.622 -9.632 -3.491 1.00 0.00 C ATOM 712 CD1 LEU A 51 -7.704 -9.349 -4.669 1.00 0.00 C ATOM 713 CD2 LEU A 51 -8.461 -11.070 -3.020 1.00 0.00 C ATOM 0 H LEU A 51 -9.890 -7.107 -3.713 1.00 0.00 H new ATOM 0 HA LEU A 51 -10.139 -8.562 -1.168 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -7.603 -7.933 -2.684 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -7.889 -9.216 -1.525 1.00 0.00 H new ATOM 0 HG LEU A 51 -9.652 -9.491 -3.819 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -7.918 -10.052 -5.474 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -7.869 -8.331 -5.022 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -6.666 -9.461 -4.356 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -8.664 -11.749 -3.848 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -7.442 -11.225 -2.665 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -9.162 -11.268 -2.209 1.00 0.00 H new ATOM 725 N LEU A 52 -8.879 -6.965 0.335 1.00 0.00 N ATOM 726 CA LEU A 52 -8.429 -5.924 1.252 1.00 0.00 C ATOM 727 C LEU A 52 -7.045 -6.247 1.807 1.00 0.00 C ATOM 728 O LEU A 52 -6.660 -7.413 1.899 1.00 0.00 O ATOM 729 CB LEU A 52 -9.426 -5.763 2.401 1.00 0.00 C ATOM 730 CG LEU A 52 -10.362 -4.556 2.314 1.00 0.00 C ATOM 731 CD1 LEU A 52 -11.811 -4.994 2.454 1.00 0.00 C ATOM 732 CD2 LEU A 52 -10.008 -3.529 3.379 1.00 0.00 C ATOM 0 H LEU A 52 -9.018 -7.878 0.769 1.00 0.00 H new ATOM 0 HA LEU A 52 -8.368 -4.988 0.697 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.034 -6.666 2.457 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.867 -5.697 3.334 1.00 0.00 H new ATOM 0 HG LEU A 52 -10.237 -4.093 1.335 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -12.462 -4.122 2.390 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -12.059 -5.692 1.654 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -11.952 -5.482 3.418 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -10.684 -2.677 3.302 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -10.104 -3.981 4.366 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -8.982 -3.192 3.233 1.00 0.00 H new ATOM 744 N ILE A 53 -6.303 -5.208 2.175 1.00 0.00 N ATOM 745 CA ILE A 53 -4.964 -5.383 2.723 1.00 0.00 C ATOM 746 C ILE A 53 -4.763 -4.524 3.967 1.00 0.00 C ATOM 747 O ILE A 53 -4.809 -3.295 3.901 1.00 0.00 O ATOM 748 CB ILE A 53 -3.881 -5.028 1.687 1.00 0.00 C ATOM 749 CG1 ILE A 53 -4.116 -5.799 0.387 1.00 0.00 C ATOM 750 CG2 ILE A 53 -2.497 -5.326 2.244 1.00 0.00 C ATOM 751 CD1 ILE A 53 -4.708 -4.954 -0.719 1.00 0.00 C ATOM 0 H ILE A 53 -6.606 -4.237 2.104 1.00 0.00 H new ATOM 0 HA ILE A 53 -4.867 -6.435 2.991 1.00 0.00 H new ATOM 0 HB ILE A 53 -3.942 -3.961 1.471 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -3.169 -6.217 0.046 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -4.782 -6.639 0.587 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.743 -5.070 1.500 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.333 -4.736 3.146 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.423 -6.386 2.486 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -4.847 -5.566 -1.610 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -5.671 -4.557 -0.398 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -4.033 -4.129 -0.947 1.00 0.00 H new ATOM 763 N THR A 54 -4.537 -5.179 5.102 1.00 0.00 N ATOM 764 CA THR A 54 -4.328 -4.476 6.361 1.00 0.00 C ATOM 765 C THR A 54 -2.846 -4.405 6.711 1.00 0.00 C ATOM 766 O THR A 54 -2.088 -5.336 6.439 1.00 0.00 O ATOM 767 CB THR A 54 -5.084 -5.157 7.517 1.00 0.00 C ATOM 768 OG1 THR A 54 -6.491 -5.161 7.248 1.00 0.00 O ATOM 769 CG2 THR A 54 -4.817 -4.444 8.834 1.00 0.00 C ATOM 0 H THR A 54 -4.494 -6.196 5.174 1.00 0.00 H new ATOM 0 HA THR A 54 -4.716 -3.466 6.227 1.00 0.00 H new ATOM 0 HB THR A 54 -4.727 -6.184 7.599 1.00 0.00 H new ATOM 0 HG1 THR A 54 -6.964 -5.597 7.987 1.00 0.00 H new ATOM 0 HG21 THR A 54 -5.362 -4.943 9.635 1.00 0.00 H new ATOM 0 HG22 THR A 54 -3.749 -4.469 9.051 1.00 0.00 H new ATOM 0 HG23 THR A 54 -5.148 -3.408 8.761 1.00 0.00 H new ATOM 777 N VAL A 55 -2.439 -3.294 7.317 1.00 0.00 N ATOM 778 CA VAL A 55 -1.047 -3.101 7.706 1.00 0.00 C ATOM 779 C VAL A 55 -0.944 -2.517 9.110 1.00 0.00 C ATOM 780 O VAL A 55 -1.611 -1.535 9.435 1.00 0.00 O ATOM 781 CB VAL A 55 -0.311 -2.174 6.721 1.00 0.00 C ATOM 782 CG1 VAL A 55 1.195 -2.317 6.875 1.00 0.00 C ATOM 783 CG2 VAL A 55 -0.740 -2.468 5.291 1.00 0.00 C ATOM 0 H VAL A 55 -3.054 -2.514 7.549 1.00 0.00 H new ATOM 0 HA VAL A 55 -0.576 -4.084 7.689 1.00 0.00 H new ATOM 0 HB VAL A 55 -0.578 -1.143 6.952 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.697 -1.654 6.171 1.00 0.00 H new ATOM 0 HG12 VAL A 55 1.484 -2.052 7.892 1.00 0.00 H new ATOM 0 HG13 VAL A 55 1.485 -3.348 6.673 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -0.210 -1.804 4.608 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.504 -3.504 5.046 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -1.814 -2.308 5.193 1.00 0.00 H new ATOM 793 N ALA A 56 -0.104 -3.127 9.939 1.00 0.00 N ATOM 794 CA ALA A 56 0.088 -2.666 11.309 1.00 0.00 C ATOM 795 C ALA A 56 1.504 -2.140 11.518 1.00 0.00 C ATOM 796 O ALA A 56 2.473 -2.898 11.465 1.00 0.00 O ATOM 797 CB ALA A 56 -0.210 -3.789 12.291 1.00 0.00 C ATOM 0 H ALA A 56 0.455 -3.942 9.686 1.00 0.00 H new ATOM 0 HA ALA A 56 -0.607 -1.846 11.490 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -0.062 -3.430 13.310 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -1.242 -4.116 12.167 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.461 -4.627 12.101 1.00 0.00 H new ATOM 803 N PHE A 57 1.618 -0.837 11.753 1.00 0.00 N ATOM 804 CA PHE A 57 2.917 -0.210 11.968 1.00 0.00 C ATOM 805 C PHE A 57 3.212 -0.067 13.458 1.00 0.00 C ATOM 806 O PHE A 57 2.543 0.686 14.165 1.00 0.00 O ATOM 807 CB PHE A 57 2.961 1.163 11.294 1.00 0.00 C ATOM 808 CG PHE A 57 3.150 1.094 9.805 1.00 0.00 C ATOM 809 CD1 PHE A 57 4.395 0.818 9.264 1.00 0.00 C ATOM 810 CD2 PHE A 57 2.083 1.305 8.948 1.00 0.00 C ATOM 811 CE1 PHE A 57 4.572 0.754 7.895 1.00 0.00 C ATOM 812 CE2 PHE A 57 2.254 1.243 7.577 1.00 0.00 C ATOM 813 CZ PHE A 57 3.500 0.966 7.051 1.00 0.00 C ATOM 0 H PHE A 57 0.827 -0.195 11.799 1.00 0.00 H new ATOM 0 HA PHE A 57 3.680 -0.850 11.525 1.00 0.00 H new ATOM 0 HB2 PHE A 57 2.035 1.695 11.510 1.00 0.00 H new ATOM 0 HB3 PHE A 57 3.773 1.746 11.729 1.00 0.00 H new ATOM 0 HD1 PHE A 57 5.237 0.651 9.920 1.00 0.00 H new ATOM 0 HD2 PHE A 57 1.106 1.520 9.355 1.00 0.00 H new ATOM 0 HE1 PHE A 57 5.548 0.538 7.486 1.00 0.00 H new ATOM 0 HE2 PHE A 57 1.414 1.411 6.919 1.00 0.00 H new ATOM 0 HZ PHE A 57 3.636 0.915 5.981 1.00 0.00 H new ATOM 823 N ASN A 58 4.218 -0.796 13.929 1.00 0.00 N ATOM 824 CA ASN A 58 4.602 -0.752 15.335 1.00 0.00 C ATOM 825 C ASN A 58 4.803 0.687 15.799 1.00 0.00 C ATOM 826 O ASN A 58 4.580 1.010 16.966 1.00 0.00 O ATOM 827 CB ASN A 58 5.884 -1.556 15.561 1.00 0.00 C ATOM 828 CG ASN A 58 6.858 -1.427 14.406 1.00 0.00 C ATOM 829 OD1 ASN A 58 6.657 -2.232 13.369 1.00 0.00 O flip ATOM 830 ND2 ASN A 58 7.781 -0.613 14.446 1.00 0.00 N flip ATOM 0 H ASN A 58 4.782 -1.425 13.357 1.00 0.00 H new ATOM 0 HA ASN A 58 3.796 -1.195 15.920 1.00 0.00 H new ATOM 0 HB2 ASN A 58 6.365 -1.217 16.478 1.00 0.00 H new ATOM 0 HB3 ASN A 58 5.631 -2.607 15.703 1.00 0.00 H new ATOM 0 HD21 ASN A 58 7.898 -0.014 15.263 1.00 0.00 H new ATOM 0 HD22 ASN A 58 8.429 -0.538 13.662 1.00 0.00 H new ATOM 837 N GLN A 59 5.225 1.547 14.878 1.00 0.00 N ATOM 838 CA GLN A 59 5.456 2.952 15.193 1.00 0.00 C ATOM 839 C GLN A 59 4.686 3.858 14.237 1.00 0.00 C ATOM 840 O GLN A 59 4.531 3.562 13.052 1.00 0.00 O ATOM 841 CB GLN A 59 6.950 3.272 15.126 1.00 0.00 C ATOM 842 CG GLN A 59 7.525 3.205 13.721 1.00 0.00 C ATOM 843 CD GLN A 59 8.220 4.489 13.312 1.00 0.00 C ATOM 844 OE1 GLN A 59 9.419 4.497 13.032 1.00 0.00 O ATOM 845 NE2 GLN A 59 7.469 5.584 13.276 1.00 0.00 N ATOM 0 H GLN A 59 5.414 1.296 13.908 1.00 0.00 H new ATOM 0 HA GLN A 59 5.097 3.135 16.206 1.00 0.00 H new ATOM 0 HB2 GLN A 59 7.118 4.270 15.531 1.00 0.00 H new ATOM 0 HB3 GLN A 59 7.491 2.574 15.765 1.00 0.00 H new ATOM 0 HG2 GLN A 59 8.233 2.378 13.662 1.00 0.00 H new ATOM 0 HG3 GLN A 59 6.723 2.989 13.015 1.00 0.00 H new ATOM 0 HE21 GLN A 59 6.479 5.532 13.516 1.00 0.00 H new ATOM 0 HE22 GLN A 59 7.882 6.477 13.008 1.00 0.00 H new ATOM 854 N PRO A 60 4.192 4.988 14.763 1.00 0.00 N ATOM 855 CA PRO A 60 3.430 5.961 13.973 1.00 0.00 C ATOM 856 C PRO A 60 4.302 6.697 12.961 1.00 0.00 C ATOM 857 O PRO A 60 5.149 7.510 13.332 1.00 0.00 O ATOM 858 CB PRO A 60 2.897 6.934 15.028 1.00 0.00 C ATOM 859 CG PRO A 60 3.860 6.830 16.160 1.00 0.00 C ATOM 860 CD PRO A 60 4.338 5.405 16.167 1.00 0.00 C ATOM 0 HA PRO A 60 2.650 5.483 13.381 1.00 0.00 H new ATOM 0 HB2 PRO A 60 2.850 7.952 14.640 1.00 0.00 H new ATOM 0 HB3 PRO A 60 1.888 6.665 15.341 1.00 0.00 H new ATOM 0 HG2 PRO A 60 4.693 7.520 16.028 1.00 0.00 H new ATOM 0 HG3 PRO A 60 3.381 7.085 17.105 1.00 0.00 H new ATOM 0 HD2 PRO A 60 5.372 5.330 16.503 1.00 0.00 H new ATOM 0 HD3 PRO A 60 3.740 4.784 16.835 1.00 0.00 H new ATOM 868 N VAL A 61 4.089 6.406 11.682 1.00 0.00 N ATOM 869 CA VAL A 61 4.855 7.042 10.616 1.00 0.00 C ATOM 870 C VAL A 61 3.973 7.962 9.779 1.00 0.00 C ATOM 871 O VAL A 61 2.817 8.213 10.121 1.00 0.00 O ATOM 872 CB VAL A 61 5.508 5.996 9.694 1.00 0.00 C ATOM 873 CG1 VAL A 61 6.354 5.024 10.502 1.00 0.00 C ATOM 874 CG2 VAL A 61 4.447 5.254 8.895 1.00 0.00 C ATOM 0 H VAL A 61 3.393 5.734 11.358 1.00 0.00 H new ATOM 0 HA VAL A 61 5.637 7.631 11.096 1.00 0.00 H new ATOM 0 HB VAL A 61 6.163 6.514 8.993 1.00 0.00 H new ATOM 0 HG11 VAL A 61 6.807 4.293 9.833 1.00 0.00 H new ATOM 0 HG12 VAL A 61 7.138 5.572 11.025 1.00 0.00 H new ATOM 0 HG13 VAL A 61 5.724 4.510 11.228 1.00 0.00 H new ATOM 0 HG21 VAL A 61 4.926 4.519 8.249 1.00 0.00 H new ATOM 0 HG22 VAL A 61 3.765 4.747 9.578 1.00 0.00 H new ATOM 0 HG23 VAL A 61 3.888 5.964 8.285 1.00 0.00 H new ATOM 884 N LYS A 62 4.526 8.462 8.679 1.00 0.00 N ATOM 885 CA LYS A 62 3.790 9.354 7.790 1.00 0.00 C ATOM 886 C LYS A 62 3.730 8.784 6.377 1.00 0.00 C ATOM 887 O LYS A 62 4.762 8.547 5.748 1.00 0.00 O ATOM 888 CB LYS A 62 4.444 10.737 7.767 1.00 0.00 C ATOM 889 CG LYS A 62 4.474 11.419 9.124 1.00 0.00 C ATOM 890 CD LYS A 62 4.124 12.894 9.015 1.00 0.00 C ATOM 891 CE LYS A 62 5.372 13.756 8.906 1.00 0.00 C ATOM 892 NZ LYS A 62 5.740 14.366 10.214 1.00 0.00 N ATOM 0 H LYS A 62 5.482 8.265 8.382 1.00 0.00 H new ATOM 0 HA LYS A 62 2.772 9.447 8.169 1.00 0.00 H new ATOM 0 HB2 LYS A 62 5.464 10.641 7.396 1.00 0.00 H new ATOM 0 HB3 LYS A 62 3.907 11.372 7.063 1.00 0.00 H new ATOM 0 HG2 LYS A 62 3.771 10.926 9.796 1.00 0.00 H new ATOM 0 HG3 LYS A 62 5.465 11.311 9.565 1.00 0.00 H new ATOM 0 HD2 LYS A 62 3.492 13.055 8.142 1.00 0.00 H new ATOM 0 HD3 LYS A 62 3.546 13.197 9.888 1.00 0.00 H new ATOM 0 HE2 LYS A 62 6.201 13.150 8.542 1.00 0.00 H new ATOM 0 HE3 LYS A 62 5.206 14.544 8.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 6.595 14.946 10.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 4.959 14.965 10.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 5.923 13.614 10.909 1.00 0.00 H new ATOM 906 N LEU A 63 2.516 8.568 5.882 1.00 0.00 N ATOM 907 CA LEU A 63 2.322 8.028 4.541 1.00 0.00 C ATOM 908 C LEU A 63 2.345 9.140 3.497 1.00 0.00 C ATOM 909 O LEU A 63 1.309 9.715 3.165 1.00 0.00 O ATOM 910 CB LEU A 63 0.996 7.268 4.463 1.00 0.00 C ATOM 911 CG LEU A 63 0.793 6.166 5.504 1.00 0.00 C ATOM 912 CD1 LEU A 63 -0.492 5.401 5.226 1.00 0.00 C ATOM 913 CD2 LEU A 63 1.986 5.222 5.522 1.00 0.00 C ATOM 0 H LEU A 63 1.652 8.758 6.389 1.00 0.00 H new ATOM 0 HA LEU A 63 3.141 7.341 4.331 1.00 0.00 H new ATOM 0 HB2 LEU A 63 0.182 7.986 4.560 1.00 0.00 H new ATOM 0 HB3 LEU A 63 0.913 6.823 3.471 1.00 0.00 H new ATOM 0 HG LEU A 63 0.710 6.631 6.486 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.621 4.621 5.976 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -1.339 6.086 5.266 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.439 4.947 4.236 1.00 0.00 H new ATOM 0 HD21 LEU A 63 1.824 4.445 6.269 1.00 0.00 H new ATOM 0 HD22 LEU A 63 2.102 4.763 4.540 1.00 0.00 H new ATOM 0 HD23 LEU A 63 2.888 5.781 5.770 1.00 0.00 H new ATOM 925 N TYR A 64 3.533 9.435 2.982 1.00 0.00 N ATOM 926 CA TYR A 64 3.692 10.479 1.976 1.00 0.00 C ATOM 927 C TYR A 64 3.295 9.967 0.594 1.00 0.00 C ATOM 928 O TYR A 64 2.758 10.713 -0.225 1.00 0.00 O ATOM 929 CB TYR A 64 5.138 10.977 1.952 1.00 0.00 C ATOM 930 CG TYR A 64 5.479 11.900 3.100 1.00 0.00 C ATOM 931 CD1 TYR A 64 5.951 11.397 4.305 1.00 0.00 C ATOM 932 CD2 TYR A 64 5.331 13.276 2.978 1.00 0.00 C ATOM 933 CE1 TYR A 64 6.264 12.236 5.357 1.00 0.00 C ATOM 934 CE2 TYR A 64 5.642 14.124 4.024 1.00 0.00 C ATOM 935 CZ TYR A 64 6.108 13.599 5.211 1.00 0.00 C ATOM 936 OH TYR A 64 6.419 14.439 6.256 1.00 0.00 O ATOM 0 H TYR A 64 4.400 8.966 3.244 1.00 0.00 H new ATOM 0 HA TYR A 64 3.034 11.307 2.240 1.00 0.00 H new ATOM 0 HB2 TYR A 64 5.810 10.119 1.975 1.00 0.00 H new ATOM 0 HB3 TYR A 64 5.319 11.498 1.012 1.00 0.00 H new ATOM 0 HD1 TYR A 64 6.076 10.331 4.422 1.00 0.00 H new ATOM 0 HD2 TYR A 64 4.967 13.690 2.050 1.00 0.00 H new ATOM 0 HE1 TYR A 64 6.629 11.827 6.288 1.00 0.00 H new ATOM 0 HE2 TYR A 64 5.521 15.191 3.912 1.00 0.00 H new ATOM 0 HH TYR A 64 6.254 15.368 5.990 1.00 0.00 H new ATOM 946 N SER A 65 3.564 8.690 0.344 1.00 0.00 N ATOM 947 CA SER A 65 3.238 8.078 -0.939 1.00 0.00 C ATOM 948 C SER A 65 3.023 6.576 -0.785 1.00 0.00 C ATOM 949 O SER A 65 3.272 6.008 0.277 1.00 0.00 O ATOM 950 CB SER A 65 4.354 8.343 -1.952 1.00 0.00 C ATOM 951 OG SER A 65 5.360 9.173 -1.398 1.00 0.00 O ATOM 0 H SER A 65 4.007 8.059 1.012 1.00 0.00 H new ATOM 0 HA SER A 65 2.313 8.525 -1.302 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.793 7.397 -2.270 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.937 8.816 -2.841 1.00 0.00 H new ATOM 0 HG SER A 65 6.062 9.326 -2.065 1.00 0.00 H new ATOM 957 N MET A 66 2.557 5.938 -1.855 1.00 0.00 N ATOM 958 CA MET A 66 2.309 4.502 -1.840 1.00 0.00 C ATOM 959 C MET A 66 2.643 3.878 -3.191 1.00 0.00 C ATOM 960 O MET A 66 2.241 4.387 -4.238 1.00 0.00 O ATOM 961 CB MET A 66 0.848 4.219 -1.481 1.00 0.00 C ATOM 962 CG MET A 66 0.369 2.845 -1.923 1.00 0.00 C ATOM 963 SD MET A 66 -1.316 2.492 -1.387 1.00 0.00 S ATOM 964 CE MET A 66 -2.250 3.090 -2.793 1.00 0.00 C ATOM 0 H MET A 66 2.344 6.394 -2.742 1.00 0.00 H new ATOM 0 HA MET A 66 2.955 4.055 -1.084 1.00 0.00 H new ATOM 0 HB2 MET A 66 0.724 4.308 -0.402 1.00 0.00 H new ATOM 0 HB3 MET A 66 0.216 4.980 -1.939 1.00 0.00 H new ATOM 0 HG2 MET A 66 0.422 2.778 -3.010 1.00 0.00 H new ATOM 0 HG3 MET A 66 1.040 2.085 -1.524 1.00 0.00 H new ATOM 0 HE1 MET A 66 -3.281 3.275 -2.493 1.00 0.00 H new ATOM 0 HE2 MET A 66 -1.806 4.017 -3.157 1.00 0.00 H new ATOM 0 HE3 MET A 66 -2.232 2.343 -3.586 1.00 0.00 H new ATOM 974 N LYS A 67 3.380 2.773 -3.162 1.00 0.00 N ATOM 975 CA LYS A 67 3.768 2.079 -4.384 1.00 0.00 C ATOM 976 C LYS A 67 2.883 0.859 -4.621 1.00 0.00 C ATOM 977 O LYS A 67 3.154 -0.226 -4.106 1.00 0.00 O ATOM 978 CB LYS A 67 5.235 1.650 -4.308 1.00 0.00 C ATOM 979 CG LYS A 67 6.209 2.816 -4.288 1.00 0.00 C ATOM 980 CD LYS A 67 7.575 2.411 -4.814 1.00 0.00 C ATOM 981 CE LYS A 67 8.275 3.573 -5.502 1.00 0.00 C ATOM 982 NZ LYS A 67 9.220 3.107 -6.554 1.00 0.00 N ATOM 0 H LYS A 67 3.721 2.338 -2.304 1.00 0.00 H new ATOM 0 HA LYS A 67 3.640 2.768 -5.219 1.00 0.00 H new ATOM 0 HB2 LYS A 67 5.383 1.048 -3.411 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.463 1.012 -5.162 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.813 3.632 -4.892 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.307 3.192 -3.270 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.191 2.050 -3.990 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.465 1.584 -5.516 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.531 4.232 -5.949 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.817 4.160 -4.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.677 3.929 -6.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.945 2.498 -6.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.699 2.568 -7.275 1.00 0.00 H new ATOM 996 N PHE A 68 1.825 1.044 -5.403 1.00 0.00 N ATOM 997 CA PHE A 68 0.901 -0.042 -5.709 1.00 0.00 C ATOM 998 C PHE A 68 0.953 -0.399 -7.191 1.00 0.00 C ATOM 999 O PHE A 68 0.714 0.447 -8.052 1.00 0.00 O ATOM 1000 CB PHE A 68 -0.526 0.349 -5.316 1.00 0.00 C ATOM 1001 CG PHE A 68 -1.274 -0.746 -4.611 1.00 0.00 C ATOM 1002 CD1 PHE A 68 -0.697 -1.427 -3.552 1.00 0.00 C ATOM 1003 CD2 PHE A 68 -2.556 -1.094 -5.008 1.00 0.00 C ATOM 1004 CE1 PHE A 68 -1.384 -2.435 -2.901 1.00 0.00 C ATOM 1005 CE2 PHE A 68 -3.247 -2.100 -4.361 1.00 0.00 C ATOM 1006 CZ PHE A 68 -2.660 -2.772 -3.307 1.00 0.00 C ATOM 0 H PHE A 68 1.586 1.936 -5.837 1.00 0.00 H new ATOM 0 HA PHE A 68 1.203 -0.916 -5.132 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.489 1.227 -4.671 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -1.076 0.635 -6.213 1.00 0.00 H new ATOM 0 HD1 PHE A 68 0.301 -1.168 -3.231 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -3.020 -0.573 -5.832 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.923 -2.958 -2.076 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -4.246 -2.361 -4.679 1.00 0.00 H new ATOM 0 HZ PHE A 68 -3.198 -3.560 -2.801 1.00 0.00 H new ATOM 1016 N GLN A 69 1.267 -1.658 -7.480 1.00 0.00 N ATOM 1017 CA GLN A 69 1.351 -2.127 -8.857 1.00 0.00 C ATOM 1018 C GLN A 69 1.015 -3.612 -8.948 1.00 0.00 C ATOM 1019 O GLN A 69 0.567 -4.218 -7.976 1.00 0.00 O ATOM 1020 CB GLN A 69 2.751 -1.874 -9.420 1.00 0.00 C ATOM 1021 CG GLN A 69 3.671 -1.143 -8.455 1.00 0.00 C ATOM 1022 CD GLN A 69 5.089 -1.024 -8.978 1.00 0.00 C ATOM 1023 OE1 GLN A 69 5.452 -1.656 -9.970 1.00 0.00 O ATOM 1024 NE2 GLN A 69 5.899 -0.210 -8.312 1.00 0.00 N ATOM 0 H GLN A 69 1.467 -2.371 -6.779 1.00 0.00 H new ATOM 0 HA GLN A 69 0.623 -1.571 -9.448 1.00 0.00 H new ATOM 0 HB2 GLN A 69 3.204 -2.829 -9.688 1.00 0.00 H new ATOM 0 HB3 GLN A 69 2.665 -1.293 -10.338 1.00 0.00 H new ATOM 0 HG2 GLN A 69 3.273 -0.146 -8.264 1.00 0.00 H new ATOM 0 HG3 GLN A 69 3.683 -1.670 -7.501 1.00 0.00 H new ATOM 0 HE21 GLN A 69 5.556 0.294 -7.495 1.00 0.00 H new ATOM 0 HE22 GLN A 69 6.865 -0.089 -8.618 1.00 0.00 H new ATOM 1033 N GLY A 70 1.234 -4.193 -10.124 1.00 0.00 N ATOM 1034 CA GLY A 70 0.949 -5.602 -10.321 1.00 0.00 C ATOM 1035 C GLY A 70 2.013 -6.301 -11.143 1.00 0.00 C ATOM 1036 O GLY A 70 3.119 -5.791 -11.328 1.00 0.00 O ATOM 0 H GLY A 70 1.604 -3.712 -10.944 1.00 0.00 H new ATOM 0 HA2 GLY A 70 0.865 -6.091 -9.351 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.016 -5.708 -10.816 1.00 0.00 H new ATOM 1040 N PRO A 71 1.683 -7.497 -11.652 1.00 0.00 N ATOM 1041 CA PRO A 71 2.607 -8.292 -12.467 1.00 0.00 C ATOM 1042 C PRO A 71 2.857 -7.669 -13.836 1.00 0.00 C ATOM 1043 O PRO A 71 2.449 -6.537 -14.097 1.00 0.00 O ATOM 1044 CB PRO A 71 1.884 -9.634 -12.614 1.00 0.00 C ATOM 1045 CG PRO A 71 0.440 -9.306 -12.449 1.00 0.00 C ATOM 1046 CD PRO A 71 0.383 -8.164 -11.473 1.00 0.00 C ATOM 0 HA PRO A 71 3.592 -8.370 -12.007 1.00 0.00 H new ATOM 0 HB2 PRO A 71 2.079 -10.084 -13.587 1.00 0.00 H new ATOM 0 HB3 PRO A 71 2.217 -10.348 -11.860 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -0.008 -9.027 -13.403 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -0.115 -10.166 -12.076 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -0.447 -7.491 -11.690 1.00 0.00 H new ATOM 0 HD3 PRO A 71 0.249 -8.516 -10.450 1.00 0.00 H new ATOM 1054 N ASP A 72 3.528 -8.414 -14.707 1.00 0.00 N ATOM 1055 CA ASP A 72 3.830 -7.935 -16.051 1.00 0.00 C ATOM 1056 C ASP A 72 2.883 -8.553 -17.074 1.00 0.00 C ATOM 1057 O ASP A 72 3.267 -8.810 -18.214 1.00 0.00 O ATOM 1058 CB ASP A 72 5.279 -8.260 -16.417 1.00 0.00 C ATOM 1059 CG ASP A 72 5.951 -7.134 -17.177 1.00 0.00 C ATOM 1060 OD1 ASP A 72 5.243 -6.403 -17.901 1.00 0.00 O ATOM 1061 OD2 ASP A 72 7.184 -6.984 -17.049 1.00 0.00 O ATOM 0 H ASP A 72 3.873 -9.353 -14.507 1.00 0.00 H new ATOM 0 HA ASP A 72 3.694 -6.854 -16.064 1.00 0.00 H new ATOM 0 HB2 ASP A 72 5.843 -8.467 -15.507 1.00 0.00 H new ATOM 0 HB3 ASP A 72 5.303 -9.167 -17.021 1.00 0.00 H new ATOM 1066 N ASN A 73 1.643 -8.789 -16.658 1.00 0.00 N ATOM 1067 CA ASN A 73 0.641 -9.378 -17.538 1.00 0.00 C ATOM 1068 C ASN A 73 -0.348 -8.322 -18.022 1.00 0.00 C ATOM 1069 O ASN A 73 -0.861 -8.400 -19.137 1.00 0.00 O ATOM 1070 CB ASN A 73 -0.108 -10.500 -16.815 1.00 0.00 C ATOM 1071 CG ASN A 73 -1.386 -10.896 -17.528 1.00 0.00 C ATOM 1072 OD1 ASN A 73 -1.400 -11.080 -18.745 1.00 0.00 O ATOM 1073 ND2 ASN A 73 -2.469 -11.028 -16.771 1.00 0.00 N ATOM 0 H ASN A 73 1.308 -8.581 -15.717 1.00 0.00 H new ATOM 0 HA ASN A 73 1.155 -9.793 -18.405 1.00 0.00 H new ATOM 0 HB2 ASN A 73 0.542 -11.371 -16.730 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -0.346 -10.179 -15.801 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -3.358 -11.292 -17.195 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -2.411 -10.866 -15.766 1.00 0.00 H new ATOM 1080 N GLY A 74 -0.610 -7.332 -17.173 1.00 0.00 N ATOM 1081 CA GLY A 74 -1.536 -6.273 -17.531 1.00 0.00 C ATOM 1082 C GLY A 74 -2.707 -6.179 -16.574 1.00 0.00 C ATOM 1083 O GLY A 74 -3.772 -5.676 -16.934 1.00 0.00 O ATOM 0 H GLY A 74 -0.198 -7.245 -16.244 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -1.006 -5.321 -17.546 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.909 -6.446 -18.540 1.00 0.00 H new ATOM 1087 N GLN A 75 -2.512 -6.665 -15.353 1.00 0.00 N ATOM 1088 CA GLN A 75 -3.563 -6.635 -14.342 1.00 0.00 C ATOM 1089 C GLN A 75 -3.099 -5.888 -13.096 1.00 0.00 C ATOM 1090 O GLN A 75 -2.400 -6.445 -12.251 1.00 0.00 O ATOM 1091 CB GLN A 75 -3.984 -8.058 -13.971 1.00 0.00 C ATOM 1092 CG GLN A 75 -4.674 -8.803 -15.103 1.00 0.00 C ATOM 1093 CD GLN A 75 -5.721 -9.780 -14.605 1.00 0.00 C ATOM 1094 OE1 GLN A 75 -5.380 -10.535 -13.568 1.00 0.00 O flip ATOM 1095 NE2 GLN A 75 -6.824 -9.855 -15.148 1.00 0.00 N flip ATOM 0 H GLN A 75 -1.637 -7.084 -15.039 1.00 0.00 H new ATOM 0 HA GLN A 75 -4.420 -6.108 -14.761 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -3.103 -8.620 -13.662 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -4.654 -8.018 -13.112 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -5.144 -8.083 -15.773 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -3.928 -9.342 -15.686 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -7.043 -9.255 -15.943 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -7.518 -10.517 -14.803 1.00 0.00 H new ATOM 1104 N GLY A 76 -3.493 -4.622 -12.989 1.00 0.00 N ATOM 1105 CA GLY A 76 -3.108 -3.820 -11.843 1.00 0.00 C ATOM 1106 C GLY A 76 -4.276 -3.057 -11.250 1.00 0.00 C ATOM 1107 O GLY A 76 -5.245 -2.732 -11.936 1.00 0.00 O ATOM 0 H GLY A 76 -4.072 -4.138 -13.676 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -2.676 -4.467 -11.080 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.332 -3.115 -12.141 1.00 0.00 H new ATOM 1111 N PRO A 77 -4.193 -2.762 -9.945 1.00 0.00 N ATOM 1112 CA PRO A 77 -5.243 -2.030 -9.230 1.00 0.00 C ATOM 1113 C PRO A 77 -5.324 -0.568 -9.656 1.00 0.00 C ATOM 1114 O PRO A 77 -4.304 0.069 -9.921 1.00 0.00 O ATOM 1115 CB PRO A 77 -4.816 -2.137 -7.764 1.00 0.00 C ATOM 1116 CG PRO A 77 -3.340 -2.331 -7.813 1.00 0.00 C ATOM 1117 CD PRO A 77 -3.067 -3.118 -9.065 1.00 0.00 C ATOM 0 HA PRO A 77 -6.233 -2.439 -9.430 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -5.079 -1.237 -7.208 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -5.309 -2.973 -7.268 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -2.821 -1.373 -7.833 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -2.987 -2.866 -6.931 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -2.109 -2.847 -9.509 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -3.035 -4.189 -8.867 1.00 0.00 H new ATOM 1125 N LYS A 78 -6.542 -0.041 -9.720 1.00 0.00 N ATOM 1126 CA LYS A 78 -6.757 1.346 -10.112 1.00 0.00 C ATOM 1127 C LYS A 78 -7.393 2.140 -8.975 1.00 0.00 C ATOM 1128 O LYS A 78 -6.721 2.915 -8.294 1.00 0.00 O ATOM 1129 CB LYS A 78 -7.645 1.415 -11.356 1.00 0.00 C ATOM 1130 CG LYS A 78 -8.171 2.809 -11.652 1.00 0.00 C ATOM 1131 CD LYS A 78 -8.464 2.992 -13.131 1.00 0.00 C ATOM 1132 CE LYS A 78 -7.278 3.601 -13.864 1.00 0.00 C ATOM 1133 NZ LYS A 78 -7.636 4.021 -15.247 1.00 0.00 N ATOM 0 H LYS A 78 -7.396 -0.555 -9.505 1.00 0.00 H new ATOM 0 HA LYS A 78 -5.787 1.787 -10.342 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -7.078 1.059 -12.217 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -8.489 0.737 -11.228 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -9.079 2.986 -11.076 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -7.440 3.551 -11.331 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -8.712 2.028 -13.576 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -9.337 3.633 -13.253 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -6.910 4.463 -13.307 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -6.465 2.876 -13.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -6.801 4.431 -15.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -7.963 3.195 -15.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -8.394 4.732 -15.209 1.00 0.00 H new ATOM 1147 N TYR A 79 -8.691 1.942 -8.776 1.00 0.00 N ATOM 1148 CA TYR A 79 -9.418 2.640 -7.723 1.00 0.00 C ATOM 1149 C TYR A 79 -9.310 1.892 -6.398 1.00 0.00 C ATOM 1150 O TYR A 79 -10.029 0.922 -6.158 1.00 0.00 O ATOM 1151 CB TYR A 79 -10.889 2.803 -8.110 1.00 0.00 C ATOM 1152 CG TYR A 79 -11.603 3.888 -7.336 1.00 0.00 C ATOM 1153 CD1 TYR A 79 -11.488 5.222 -7.705 1.00 0.00 C ATOM 1154 CD2 TYR A 79 -12.394 3.578 -6.237 1.00 0.00 C ATOM 1155 CE1 TYR A 79 -12.138 6.217 -7.000 1.00 0.00 C ATOM 1156 CE2 TYR A 79 -13.049 4.566 -5.527 1.00 0.00 C ATOM 1157 CZ TYR A 79 -12.918 5.883 -5.912 1.00 0.00 C ATOM 1158 OH TYR A 79 -13.568 6.871 -5.209 1.00 0.00 O ATOM 0 H TYR A 79 -9.262 1.304 -9.330 1.00 0.00 H new ATOM 0 HA TYR A 79 -8.970 3.626 -7.601 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -10.953 3.026 -9.175 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.405 1.856 -7.951 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -10.880 5.486 -8.558 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -12.499 2.547 -5.932 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -12.036 7.250 -7.299 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -13.660 4.308 -4.675 1.00 0.00 H new ATOM 0 HH TYR A 79 -14.076 6.469 -4.473 1.00 0.00 H new ATOM 1168 N VAL A 80 -8.405 2.351 -5.539 1.00 0.00 N ATOM 1169 CA VAL A 80 -8.202 1.728 -4.236 1.00 0.00 C ATOM 1170 C VAL A 80 -8.538 2.694 -3.106 1.00 0.00 C ATOM 1171 O VAL A 80 -8.142 3.859 -3.131 1.00 0.00 O ATOM 1172 CB VAL A 80 -6.749 1.243 -4.067 1.00 0.00 C ATOM 1173 CG1 VAL A 80 -6.717 -0.244 -3.750 1.00 0.00 C ATOM 1174 CG2 VAL A 80 -5.937 1.548 -5.316 1.00 0.00 C ATOM 0 H VAL A 80 -7.801 3.152 -5.722 1.00 0.00 H new ATOM 0 HA VAL A 80 -8.873 0.870 -4.187 1.00 0.00 H new ATOM 0 HB VAL A 80 -6.300 1.778 -3.230 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -5.683 -0.569 -3.634 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -7.262 -0.431 -2.825 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -7.183 -0.800 -4.564 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -4.914 1.199 -5.179 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -6.382 1.041 -6.172 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -5.933 2.623 -5.493 1.00 0.00 H new ATOM 1184 N LYS A 81 -9.273 2.202 -2.114 1.00 0.00 N ATOM 1185 CA LYS A 81 -9.663 3.020 -0.972 1.00 0.00 C ATOM 1186 C LYS A 81 -8.682 2.845 0.183 1.00 0.00 C ATOM 1187 O LYS A 81 -8.500 1.739 0.692 1.00 0.00 O ATOM 1188 CB LYS A 81 -11.076 2.653 -0.515 1.00 0.00 C ATOM 1189 CG LYS A 81 -12.122 2.782 -1.608 1.00 0.00 C ATOM 1190 CD LYS A 81 -13.527 2.583 -1.064 1.00 0.00 C ATOM 1191 CE LYS A 81 -14.327 3.876 -1.099 1.00 0.00 C ATOM 1192 NZ LYS A 81 -15.291 3.900 -2.234 1.00 0.00 N ATOM 0 H LYS A 81 -9.611 1.240 -2.078 1.00 0.00 H new ATOM 0 HA LYS A 81 -9.648 4.065 -1.283 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -11.074 1.628 -0.145 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.356 3.293 0.321 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.046 3.766 -2.071 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -11.926 2.047 -2.389 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.040 1.820 -1.650 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -13.473 2.215 -0.039 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -14.868 3.994 -0.160 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.646 4.723 -1.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -15.668 4.862 -2.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.806 3.612 -3.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -16.073 3.243 -2.039 1.00 0.00 H new ATOM 1206 N ILE A 82 -8.055 3.942 0.592 1.00 0.00 N ATOM 1207 CA ILE A 82 -7.095 3.910 1.689 1.00 0.00 C ATOM 1208 C ILE A 82 -7.758 4.281 3.011 1.00 0.00 C ATOM 1209 O ILE A 82 -8.541 5.228 3.080 1.00 0.00 O ATOM 1210 CB ILE A 82 -5.915 4.865 1.433 1.00 0.00 C ATOM 1211 CG1 ILE A 82 -5.197 4.488 0.135 1.00 0.00 C ATOM 1212 CG2 ILE A 82 -4.947 4.839 2.607 1.00 0.00 C ATOM 1213 CD1 ILE A 82 -4.373 5.614 -0.449 1.00 0.00 C ATOM 0 H ILE A 82 -8.194 4.865 0.180 1.00 0.00 H new ATOM 0 HA ILE A 82 -6.718 2.889 1.749 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.303 5.878 1.330 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -4.547 3.633 0.324 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -5.936 4.170 -0.600 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -4.118 5.519 2.410 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -5.466 5.151 3.513 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.562 3.828 2.739 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.893 5.275 -1.367 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -5.021 6.462 -0.670 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -3.611 5.917 0.269 1.00 0.00 H new ATOM 1225 N PHE A 83 -7.437 3.530 4.059 1.00 0.00 N ATOM 1226 CA PHE A 83 -8.000 3.780 5.380 1.00 0.00 C ATOM 1227 C PHE A 83 -6.905 3.812 6.442 1.00 0.00 C ATOM 1228 O PHE A 83 -5.923 3.074 6.358 1.00 0.00 O ATOM 1229 CB PHE A 83 -9.033 2.706 5.729 1.00 0.00 C ATOM 1230 CG PHE A 83 -10.253 2.740 4.854 1.00 0.00 C ATOM 1231 CD1 PHE A 83 -10.255 2.106 3.622 1.00 0.00 C ATOM 1232 CD2 PHE A 83 -11.397 3.407 5.262 1.00 0.00 C ATOM 1233 CE1 PHE A 83 -11.376 2.135 2.813 1.00 0.00 C ATOM 1234 CE2 PHE A 83 -12.521 3.439 4.458 1.00 0.00 C ATOM 1235 CZ PHE A 83 -12.510 2.803 3.232 1.00 0.00 C ATOM 0 H PHE A 83 -6.790 2.743 4.019 1.00 0.00 H new ATOM 0 HA PHE A 83 -8.490 4.753 5.360 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -8.566 1.724 5.649 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -9.338 2.830 6.768 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -9.370 1.583 3.290 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -11.411 3.907 6.219 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -11.365 1.636 1.855 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -13.407 3.961 4.788 1.00 0.00 H new ATOM 0 HZ PHE A 83 -13.387 2.828 2.602 1.00 0.00 H new ATOM 1245 N ILE A 84 -7.080 4.674 7.438 1.00 0.00 N ATOM 1246 CA ILE A 84 -6.107 4.802 8.516 1.00 0.00 C ATOM 1247 C ILE A 84 -6.795 5.092 9.846 1.00 0.00 C ATOM 1248 O ILE A 84 -7.981 5.418 9.885 1.00 0.00 O ATOM 1249 CB ILE A 84 -5.088 5.919 8.224 1.00 0.00 C ATOM 1250 CG1 ILE A 84 -5.805 7.259 8.041 1.00 0.00 C ATOM 1251 CG2 ILE A 84 -4.267 5.578 6.990 1.00 0.00 C ATOM 1252 CD1 ILE A 84 -5.013 8.442 8.550 1.00 0.00 C ATOM 0 H ILE A 84 -7.886 5.294 7.521 1.00 0.00 H new ATOM 0 HA ILE A 84 -5.581 3.849 8.582 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.411 6.004 9.074 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -6.021 7.405 6.983 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -6.763 7.223 8.560 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -3.551 6.377 6.797 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -3.731 4.643 7.156 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -4.929 5.469 6.131 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -5.582 9.358 8.388 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -4.819 8.319 9.616 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -4.066 8.504 8.014 1.00 0.00 H new ATOM 1264 N ASN A 85 -6.042 4.971 10.934 1.00 0.00 N ATOM 1265 CA ASN A 85 -6.579 5.221 12.267 1.00 0.00 C ATOM 1266 C ASN A 85 -7.857 4.421 12.497 1.00 0.00 C ATOM 1267 O ASN A 85 -8.788 4.892 13.153 1.00 0.00 O ATOM 1268 CB ASN A 85 -6.857 6.714 12.456 1.00 0.00 C ATOM 1269 CG ASN A 85 -5.604 7.497 12.799 1.00 0.00 C ATOM 1270 OD1 ASN A 85 -4.610 7.437 11.921 1.00 0.00 O flip ATOM 1271 ND2 ASN A 85 -5.532 8.148 13.841 1.00 0.00 N flip ATOM 0 H ASN A 85 -5.058 4.701 10.919 1.00 0.00 H new ATOM 0 HA ASN A 85 -5.835 4.902 12.997 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -7.296 7.117 11.543 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -7.593 6.846 13.249 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -6.321 8.165 14.487 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -4.683 8.670 14.059 1.00 0.00 H new ATOM 1278 N LEU A 86 -7.896 3.209 11.954 1.00 0.00 N ATOM 1279 CA LEU A 86 -9.060 2.342 12.101 1.00 0.00 C ATOM 1280 C LEU A 86 -9.145 1.780 13.516 1.00 0.00 C ATOM 1281 O LEU A 86 -8.148 1.675 14.230 1.00 0.00 O ATOM 1282 CB LEU A 86 -8.998 1.198 11.088 1.00 0.00 C ATOM 1283 CG LEU A 86 -9.231 1.582 9.626 1.00 0.00 C ATOM 1284 CD1 LEU A 86 -8.875 0.424 8.707 1.00 0.00 C ATOM 1285 CD2 LEU A 86 -10.675 2.011 9.412 1.00 0.00 C ATOM 0 H LEU A 86 -7.135 2.805 11.408 1.00 0.00 H new ATOM 0 HA LEU A 86 -9.953 2.938 11.913 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -8.020 0.723 11.166 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -9.740 0.450 11.369 1.00 0.00 H new ATOM 0 HG LEU A 86 -8.583 2.424 9.383 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -9.047 0.716 7.671 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -7.825 0.163 8.841 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -9.497 -0.438 8.950 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -10.823 2.281 8.366 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -11.341 1.189 9.673 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -10.896 2.871 10.044 1.00 0.00 H new ATOM 1297 N PRO A 87 -10.364 1.406 13.932 1.00 0.00 N ATOM 1298 CA PRO A 87 -10.609 0.845 15.264 1.00 0.00 C ATOM 1299 C PRO A 87 -10.019 -0.553 15.421 1.00 0.00 C ATOM 1300 O PRO A 87 -9.767 -1.008 16.537 1.00 0.00 O ATOM 1301 CB PRO A 87 -12.136 0.794 15.353 1.00 0.00 C ATOM 1302 CG PRO A 87 -12.595 0.714 13.938 1.00 0.00 C ATOM 1303 CD PRO A 87 -11.598 1.502 13.134 1.00 0.00 C ATOM 0 HA PRO A 87 -10.143 1.440 16.049 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -12.471 -0.070 15.927 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -12.534 1.680 15.849 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -12.638 -0.321 13.600 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -13.598 1.127 13.829 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -11.465 1.083 12.137 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -11.914 2.537 13.005 1.00 0.00 H new ATOM 1311 N ARG A 88 -9.801 -1.228 14.298 1.00 0.00 N ATOM 1312 CA ARG A 88 -9.242 -2.574 14.312 1.00 0.00 C ATOM 1313 C ARG A 88 -8.891 -3.032 12.899 1.00 0.00 C ATOM 1314 O ARG A 88 -7.719 -3.100 12.531 1.00 0.00 O ATOM 1315 CB ARG A 88 -10.231 -3.554 14.946 1.00 0.00 C ATOM 1316 CG ARG A 88 -11.679 -3.103 14.853 1.00 0.00 C ATOM 1317 CD ARG A 88 -12.632 -4.288 14.847 1.00 0.00 C ATOM 1318 NE ARG A 88 -13.457 -4.321 13.641 1.00 0.00 N ATOM 1319 CZ ARG A 88 -14.411 -5.220 13.428 1.00 0.00 C ATOM 1320 NH1 ARG A 88 -14.660 -6.155 14.334 1.00 0.00 N ATOM 1321 NH2 ARG A 88 -15.118 -5.184 12.306 1.00 0.00 N ATOM 0 H ARG A 88 -10.003 -0.865 13.366 1.00 0.00 H new ATOM 0 HA ARG A 88 -8.329 -2.554 14.907 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -10.130 -4.525 14.460 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -9.969 -3.694 15.995 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -11.913 -2.451 15.694 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -11.821 -2.516 13.946 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -12.060 -5.213 14.921 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -13.276 -4.240 15.725 1.00 0.00 H new ATOM 0 HE ARG A 88 -13.291 -3.615 12.924 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -14.118 -6.185 15.198 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -15.393 -6.844 14.167 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -14.929 -4.466 11.607 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -15.851 -5.875 12.143 1.00 0.00 H new ATOM 1335 N SER A 89 -9.916 -3.346 12.113 1.00 0.00 N ATOM 1336 CA SER A 89 -9.716 -3.801 10.742 1.00 0.00 C ATOM 1337 C SER A 89 -10.811 -3.264 9.826 1.00 0.00 C ATOM 1338 O SER A 89 -11.738 -2.592 10.277 1.00 0.00 O ATOM 1339 CB SER A 89 -9.695 -5.330 10.688 1.00 0.00 C ATOM 1340 OG SER A 89 -10.951 -5.871 11.060 1.00 0.00 O ATOM 0 H SER A 89 -10.893 -3.294 12.402 1.00 0.00 H new ATOM 0 HA SER A 89 -8.756 -3.419 10.395 1.00 0.00 H new ATOM 0 HB2 SER A 89 -9.438 -5.658 9.681 1.00 0.00 H new ATOM 0 HB3 SER A 89 -8.920 -5.710 11.354 1.00 0.00 H new ATOM 0 HG SER A 89 -10.912 -6.849 11.016 1.00 0.00 H new ATOM 1346 N MET A 90 -10.697 -3.567 8.537 1.00 0.00 N ATOM 1347 CA MET A 90 -11.678 -3.116 7.556 1.00 0.00 C ATOM 1348 C MET A 90 -12.294 -4.301 6.819 1.00 0.00 C ATOM 1349 O MET A 90 -11.581 -5.163 6.306 1.00 0.00 O ATOM 1350 CB MET A 90 -11.027 -2.160 6.555 1.00 0.00 C ATOM 1351 CG MET A 90 -12.027 -1.442 5.663 1.00 0.00 C ATOM 1352 SD MET A 90 -12.330 0.257 6.187 1.00 0.00 S ATOM 1353 CE MET A 90 -13.074 -0.013 7.794 1.00 0.00 C ATOM 0 H MET A 90 -9.936 -4.123 8.147 1.00 0.00 H new ATOM 0 HA MET A 90 -12.471 -2.589 8.087 1.00 0.00 H new ATOM 0 HB2 MET A 90 -10.441 -1.420 7.100 1.00 0.00 H new ATOM 0 HB3 MET A 90 -10.331 -2.720 5.930 1.00 0.00 H new ATOM 0 HG2 MET A 90 -11.658 -1.442 4.637 1.00 0.00 H new ATOM 0 HG3 MET A 90 -12.968 -1.992 5.663 1.00 0.00 H new ATOM 0 HE1 MET A 90 -13.631 0.875 8.091 1.00 0.00 H new ATOM 0 HE2 MET A 90 -13.751 -0.866 7.743 1.00 0.00 H new ATOM 0 HE3 MET A 90 -12.293 -0.213 8.528 1.00 0.00 H new ATOM 1363 N ASP A 91 -13.621 -4.337 6.772 1.00 0.00 N ATOM 1364 CA ASP A 91 -14.333 -5.416 6.097 1.00 0.00 C ATOM 1365 C ASP A 91 -14.875 -4.950 4.749 1.00 0.00 C ATOM 1366 O ASP A 91 -14.533 -3.868 4.271 1.00 0.00 O ATOM 1367 CB ASP A 91 -15.479 -5.925 6.972 1.00 0.00 C ATOM 1368 CG ASP A 91 -15.030 -6.247 8.384 1.00 0.00 C ATOM 1369 OD1 ASP A 91 -14.733 -5.300 9.142 1.00 0.00 O ATOM 1370 OD2 ASP A 91 -14.975 -7.446 8.731 1.00 0.00 O ATOM 0 H ASP A 91 -14.225 -3.632 7.193 1.00 0.00 H new ATOM 0 HA ASP A 91 -13.629 -6.230 5.924 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -16.267 -5.173 7.007 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -15.910 -6.818 6.518 1.00 0.00 H new ATOM 1375 N PHE A 92 -15.721 -5.774 4.140 1.00 0.00 N ATOM 1376 CA PHE A 92 -16.309 -5.447 2.846 1.00 0.00 C ATOM 1377 C PHE A 92 -17.419 -4.412 2.999 1.00 0.00 C ATOM 1378 O PHE A 92 -17.573 -3.524 2.160 1.00 0.00 O ATOM 1379 CB PHE A 92 -16.861 -6.709 2.180 1.00 0.00 C ATOM 1380 CG PHE A 92 -15.801 -7.714 1.829 1.00 0.00 C ATOM 1381 CD1 PHE A 92 -15.210 -8.489 2.813 1.00 0.00 C ATOM 1382 CD2 PHE A 92 -15.397 -7.884 0.515 1.00 0.00 C ATOM 1383 CE1 PHE A 92 -14.234 -9.414 2.493 1.00 0.00 C ATOM 1384 CE2 PHE A 92 -14.422 -8.808 0.188 1.00 0.00 C ATOM 1385 CZ PHE A 92 -13.841 -9.575 1.179 1.00 0.00 C ATOM 0 H PHE A 92 -16.015 -6.673 4.522 1.00 0.00 H new ATOM 0 HA PHE A 92 -15.527 -5.024 2.216 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -17.586 -7.175 2.848 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -17.397 -6.427 1.274 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -15.515 -8.369 3.842 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -15.849 -7.287 -0.264 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -13.779 -10.010 3.270 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -14.115 -8.930 -0.840 1.00 0.00 H new ATOM 0 HZ PHE A 92 -13.081 -10.299 0.927 1.00 0.00 H new ATOM 1395 N GLU A 93 -18.190 -4.533 4.075 1.00 0.00 N ATOM 1396 CA GLU A 93 -19.287 -3.609 4.336 1.00 0.00 C ATOM 1397 C GLU A 93 -18.772 -2.316 4.961 1.00 0.00 C ATOM 1398 O GLU A 93 -19.260 -1.229 4.654 1.00 0.00 O ATOM 1399 CB GLU A 93 -20.321 -4.258 5.259 1.00 0.00 C ATOM 1400 CG GLU A 93 -21.380 -5.058 4.520 1.00 0.00 C ATOM 1401 CD GLU A 93 -22.786 -4.734 4.986 1.00 0.00 C ATOM 1402 OE1 GLU A 93 -23.056 -4.869 6.197 1.00 0.00 O ATOM 1403 OE2 GLU A 93 -23.617 -4.347 4.137 1.00 0.00 O ATOM 0 H GLU A 93 -18.075 -5.262 4.780 1.00 0.00 H new ATOM 0 HA GLU A 93 -19.760 -3.369 3.384 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -19.807 -4.914 5.962 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -20.809 -3.481 5.847 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -21.300 -4.859 3.451 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -21.191 -6.122 4.661 1.00 0.00 H new ATOM 1410 N GLU A 94 -17.782 -2.443 5.840 1.00 0.00 N ATOM 1411 CA GLU A 94 -17.202 -1.285 6.509 1.00 0.00 C ATOM 1412 C GLU A 94 -16.371 -0.454 5.535 1.00 0.00 C ATOM 1413 O GLU A 94 -16.161 0.740 5.744 1.00 0.00 O ATOM 1414 CB GLU A 94 -16.333 -1.731 7.687 1.00 0.00 C ATOM 1415 CG GLU A 94 -17.124 -2.025 8.950 1.00 0.00 C ATOM 1416 CD GLU A 94 -16.366 -1.659 10.211 1.00 0.00 C ATOM 1417 OE1 GLU A 94 -16.321 -0.458 10.550 1.00 0.00 O ATOM 1418 OE2 GLU A 94 -15.819 -2.575 10.861 1.00 0.00 O ATOM 0 H GLU A 94 -17.366 -3.336 6.105 1.00 0.00 H new ATOM 0 HA GLU A 94 -18.018 -0.667 6.883 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -15.778 -2.624 7.400 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -15.599 -0.954 7.901 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -18.064 -1.473 8.922 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -17.377 -3.085 8.977 1.00 0.00 H new ATOM 1425 N ALA A 95 -15.899 -1.096 4.471 1.00 0.00 N ATOM 1426 CA ALA A 95 -15.093 -0.418 3.465 1.00 0.00 C ATOM 1427 C ALA A 95 -15.973 0.321 2.462 1.00 0.00 C ATOM 1428 O ALA A 95 -15.485 1.121 1.665 1.00 0.00 O ATOM 1429 CB ALA A 95 -14.196 -1.415 2.747 1.00 0.00 C ATOM 0 H ALA A 95 -16.062 -2.085 4.284 1.00 0.00 H new ATOM 0 HA ALA A 95 -14.468 0.317 3.972 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -13.599 -0.894 1.998 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -13.534 -1.895 3.468 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -14.810 -2.172 2.259 1.00 0.00 H new ATOM 1435 N GLU A 96 -17.273 0.047 2.509 1.00 0.00 N ATOM 1436 CA GLU A 96 -18.221 0.685 1.603 1.00 0.00 C ATOM 1437 C GLU A 96 -18.969 1.814 2.305 1.00 0.00 C ATOM 1438 O GLU A 96 -19.073 2.924 1.782 1.00 0.00 O ATOM 1439 CB GLU A 96 -19.217 -0.343 1.063 1.00 0.00 C ATOM 1440 CG GLU A 96 -19.149 -0.525 -0.444 1.00 0.00 C ATOM 1441 CD GLU A 96 -20.481 -0.272 -1.123 1.00 0.00 C ATOM 1442 OE1 GLU A 96 -21.524 -0.624 -0.533 1.00 0.00 O ATOM 1443 OE2 GLU A 96 -20.480 0.277 -2.244 1.00 0.00 O ATOM 0 H GLU A 96 -17.693 -0.612 3.164 1.00 0.00 H new ATOM 0 HA GLU A 96 -17.659 1.107 0.770 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -19.032 -1.303 1.545 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -20.226 -0.037 1.338 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -18.401 0.154 -0.855 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -18.817 -1.539 -0.669 1.00 0.00 H new ATOM 1450 N ARG A 97 -19.489 1.523 3.493 1.00 0.00 N ATOM 1451 CA ARG A 97 -20.229 2.512 4.267 1.00 0.00 C ATOM 1452 C ARG A 97 -19.315 3.652 4.708 1.00 0.00 C ATOM 1453 O ARG A 97 -19.676 4.824 4.606 1.00 0.00 O ATOM 1454 CB ARG A 97 -20.871 1.856 5.491 1.00 0.00 C ATOM 1455 CG ARG A 97 -19.879 1.126 6.381 1.00 0.00 C ATOM 1456 CD ARG A 97 -20.527 -0.059 7.081 1.00 0.00 C ATOM 1457 NE ARG A 97 -21.744 0.323 7.791 1.00 0.00 N ATOM 1458 CZ ARG A 97 -22.578 -0.551 8.344 1.00 0.00 C ATOM 1459 NH1 ARG A 97 -22.326 -1.851 8.270 1.00 0.00 N ATOM 1460 NH2 ARG A 97 -23.665 -0.125 8.974 1.00 0.00 N ATOM 0 H ARG A 97 -19.411 0.610 3.941 1.00 0.00 H new ATOM 0 HA ARG A 97 -21.013 2.923 3.630 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -21.379 2.621 6.078 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -21.633 1.152 5.157 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -19.037 0.780 5.782 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -19.479 1.816 7.125 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -20.763 -0.829 6.347 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -19.819 -0.496 7.785 1.00 0.00 H new ATOM 0 HE ARG A 97 -21.966 1.316 7.867 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -21.490 -2.182 7.788 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -22.968 -2.520 8.695 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -23.861 0.874 9.034 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -24.305 -0.797 9.398 1.00 0.00 H new ATOM 1474 N SER A 98 -18.131 3.299 5.198 1.00 0.00 N ATOM 1475 CA SER A 98 -17.167 4.292 5.658 1.00 0.00 C ATOM 1476 C SER A 98 -16.234 4.709 4.525 1.00 0.00 C ATOM 1477 O SER A 98 -15.597 3.868 3.892 1.00 0.00 O ATOM 1478 CB SER A 98 -16.352 3.738 6.828 1.00 0.00 C ATOM 1479 OG SER A 98 -17.171 2.992 7.712 1.00 0.00 O ATOM 0 H SER A 98 -17.816 2.333 5.287 1.00 0.00 H new ATOM 0 HA SER A 98 -17.719 5.171 5.993 1.00 0.00 H new ATOM 0 HB2 SER A 98 -15.550 3.105 6.449 1.00 0.00 H new ATOM 0 HB3 SER A 98 -15.882 4.559 7.369 1.00 0.00 H new ATOM 0 HG SER A 98 -17.155 2.047 7.454 1.00 0.00 H new ATOM 1485 N GLU A 99 -16.160 6.013 4.278 1.00 0.00 N ATOM 1486 CA GLU A 99 -15.306 6.542 3.221 1.00 0.00 C ATOM 1487 C GLU A 99 -13.839 6.513 3.641 1.00 0.00 C ATOM 1488 O GLU A 99 -13.502 6.648 4.818 1.00 0.00 O ATOM 1489 CB GLU A 99 -15.719 7.972 2.869 1.00 0.00 C ATOM 1490 CG GLU A 99 -15.366 8.989 3.941 1.00 0.00 C ATOM 1491 CD GLU A 99 -16.352 10.139 4.002 1.00 0.00 C ATOM 1492 OE1 GLU A 99 -16.695 10.683 2.932 1.00 0.00 O ATOM 1493 OE2 GLU A 99 -16.782 10.495 5.119 1.00 0.00 O ATOM 0 H GLU A 99 -16.680 6.722 4.795 1.00 0.00 H new ATOM 0 HA GLU A 99 -15.427 5.910 2.341 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -15.238 8.260 1.934 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -16.795 7.998 2.695 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -15.333 8.492 4.911 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -14.367 9.381 3.749 1.00 0.00 H new ATOM 1500 N PRO A 100 -12.946 6.331 2.658 1.00 0.00 N ATOM 1501 CA PRO A 100 -11.501 6.280 2.900 1.00 0.00 C ATOM 1502 C PRO A 100 -10.932 7.637 3.300 1.00 0.00 C ATOM 1503 O PRO A 100 -11.629 8.651 3.261 1.00 0.00 O ATOM 1504 CB PRO A 100 -10.930 5.837 1.551 1.00 0.00 C ATOM 1505 CG PRO A 100 -11.942 6.275 0.549 1.00 0.00 C ATOM 1506 CD PRO A 100 -13.277 6.162 1.233 1.00 0.00 C ATOM 0 HA PRO A 100 -11.249 5.612 3.724 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -9.960 6.297 1.361 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -10.782 4.758 1.519 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -11.754 7.299 0.226 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -11.906 5.648 -0.342 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -13.971 6.928 0.888 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.746 5.197 1.041 1.00 0.00 H new ATOM 1514 N THR A 101 -9.659 7.650 3.684 1.00 0.00 N ATOM 1515 CA THR A 101 -8.996 8.882 4.091 1.00 0.00 C ATOM 1516 C THR A 101 -8.491 9.661 2.882 1.00 0.00 C ATOM 1517 O THR A 101 -8.290 10.873 2.953 1.00 0.00 O ATOM 1518 CB THR A 101 -7.812 8.598 5.035 1.00 0.00 C ATOM 1519 OG1 THR A 101 -8.268 7.889 6.192 1.00 0.00 O ATOM 1520 CG2 THR A 101 -7.136 9.892 5.460 1.00 0.00 C ATOM 0 H THR A 101 -9.067 6.820 3.721 1.00 0.00 H new ATOM 0 HA THR A 101 -9.738 9.479 4.620 1.00 0.00 H new ATOM 0 HB THR A 101 -7.086 7.988 4.498 1.00 0.00 H new ATOM 0 HG1 THR A 101 -8.071 8.414 6.996 1.00 0.00 H new ATOM 0 HG21 THR A 101 -6.303 9.666 6.126 1.00 0.00 H new ATOM 0 HG22 THR A 101 -6.764 10.415 4.579 1.00 0.00 H new ATOM 0 HG23 THR A 101 -7.855 10.524 5.980 1.00 0.00 H new ATOM 1528 N GLN A 102 -8.290 8.957 1.773 1.00 0.00 N ATOM 1529 CA GLN A 102 -7.808 9.584 0.547 1.00 0.00 C ATOM 1530 C GLN A 102 -8.492 8.983 -0.676 1.00 0.00 C ATOM 1531 O GLN A 102 -9.365 9.606 -1.279 1.00 0.00 O ATOM 1532 CB GLN A 102 -6.291 9.423 0.429 1.00 0.00 C ATOM 1533 CG GLN A 102 -5.740 9.836 -0.926 1.00 0.00 C ATOM 1534 CD GLN A 102 -4.378 10.494 -0.825 1.00 0.00 C ATOM 1535 OE1 GLN A 102 -3.483 9.995 -0.143 1.00 0.00 O ATOM 1536 NE2 GLN A 102 -4.213 11.621 -1.507 1.00 0.00 N ATOM 0 H GLN A 102 -8.453 7.953 1.698 1.00 0.00 H new ATOM 0 HA GLN A 102 -8.051 10.646 0.591 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -5.809 10.018 1.205 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -6.029 8.382 0.617 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -5.669 8.958 -1.568 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -6.438 10.524 -1.403 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -4.982 12.000 -2.060 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -3.317 12.108 -1.478 1.00 0.00 H new ATOM 1545 N ALA A 103 -8.088 7.770 -1.038 1.00 0.00 N ATOM 1546 CA ALA A 103 -8.663 7.085 -2.189 1.00 0.00 C ATOM 1547 C ALA A 103 -8.333 7.817 -3.485 1.00 0.00 C ATOM 1548 O ALA A 103 -8.745 8.960 -3.687 1.00 0.00 O ATOM 1549 CB ALA A 103 -10.169 6.951 -2.025 1.00 0.00 C ATOM 0 H ALA A 103 -7.365 7.241 -0.551 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.225 6.089 -2.244 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.585 6.438 -2.892 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -10.387 6.377 -1.124 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.615 7.942 -1.941 1.00 0.00 H new ATOM 1555 N LEU A 104 -7.587 7.153 -4.361 1.00 0.00 N ATOM 1556 CA LEU A 104 -7.201 7.741 -5.639 1.00 0.00 C ATOM 1557 C LEU A 104 -7.329 6.723 -6.768 1.00 0.00 C ATOM 1558 O LEU A 104 -7.359 5.517 -6.528 1.00 0.00 O ATOM 1559 CB LEU A 104 -5.765 8.263 -5.569 1.00 0.00 C ATOM 1560 CG LEU A 104 -5.279 8.709 -4.189 1.00 0.00 C ATOM 1561 CD1 LEU A 104 -4.621 7.550 -3.455 1.00 0.00 C ATOM 1562 CD2 LEU A 104 -4.315 9.879 -4.315 1.00 0.00 C ATOM 0 H LEU A 104 -7.237 6.207 -4.210 1.00 0.00 H new ATOM 0 HA LEU A 104 -7.874 8.573 -5.846 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.098 7.481 -5.932 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.672 9.105 -6.255 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.142 9.037 -3.609 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.281 7.886 -2.475 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.341 6.741 -3.332 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -3.768 7.192 -4.031 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.980 10.183 -3.323 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -3.454 9.579 -4.913 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.819 10.715 -4.799 1.00 0.00 H new ATOM 1574 N GLU A 105 -7.403 7.219 -7.999 1.00 0.00 N ATOM 1575 CA GLU A 105 -7.527 6.352 -9.165 1.00 0.00 C ATOM 1576 C GLU A 105 -6.168 6.130 -9.824 1.00 0.00 C ATOM 1577 O GLU A 105 -5.774 6.870 -10.725 1.00 0.00 O ATOM 1578 CB GLU A 105 -8.503 6.957 -10.176 1.00 0.00 C ATOM 1579 CG GLU A 105 -8.611 6.163 -11.467 1.00 0.00 C ATOM 1580 CD GLU A 105 -9.427 6.879 -12.526 1.00 0.00 C ATOM 1581 OE1 GLU A 105 -9.118 8.054 -12.818 1.00 0.00 O ATOM 1582 OE2 GLU A 105 -10.373 6.266 -13.062 1.00 0.00 O ATOM 0 H GLU A 105 -7.379 8.216 -8.215 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.912 5.389 -8.831 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.490 7.027 -9.719 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.187 7.974 -10.410 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.611 5.969 -11.854 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.065 5.195 -11.257 1.00 0.00 H new ATOM 1589 N LEU A 106 -5.457 5.105 -9.367 1.00 0.00 N ATOM 1590 CA LEU A 106 -4.142 4.783 -9.911 1.00 0.00 C ATOM 1591 C LEU A 106 -4.208 4.604 -11.424 1.00 0.00 C ATOM 1592 O LEU A 106 -5.151 4.012 -11.951 1.00 0.00 O ATOM 1593 CB LEU A 106 -3.595 3.512 -9.259 1.00 0.00 C ATOM 1594 CG LEU A 106 -3.642 3.469 -7.731 1.00 0.00 C ATOM 1595 CD1 LEU A 106 -2.924 2.233 -7.210 1.00 0.00 C ATOM 1596 CD2 LEU A 106 -3.029 4.731 -7.142 1.00 0.00 C ATOM 0 H LEU A 106 -5.769 4.483 -8.621 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.472 5.614 -9.691 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.155 2.660 -9.644 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.560 3.382 -9.575 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.685 3.417 -7.420 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.967 2.219 -6.121 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.407 1.339 -7.604 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -1.883 2.255 -7.531 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -3.071 4.682 -6.054 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.990 4.814 -7.461 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.586 5.602 -7.488 1.00 0.00 H new ATOM 1608 N THR A 107 -3.198 5.117 -12.120 1.00 0.00 N ATOM 1609 CA THR A 107 -3.140 5.013 -13.573 1.00 0.00 C ATOM 1610 C THR A 107 -2.038 4.056 -14.012 1.00 0.00 C ATOM 1611 O THR A 107 -1.279 3.549 -13.187 1.00 0.00 O ATOM 1612 CB THR A 107 -2.900 6.388 -14.225 1.00 0.00 C ATOM 1613 OG1 THR A 107 -3.049 6.288 -15.646 1.00 0.00 O ATOM 1614 CG2 THR A 107 -1.512 6.911 -13.891 1.00 0.00 C ATOM 0 H THR A 107 -2.409 5.609 -11.701 1.00 0.00 H new ATOM 0 HA THR A 107 -4.105 4.627 -13.901 1.00 0.00 H new ATOM 0 HB THR A 107 -3.638 7.087 -13.830 1.00 0.00 H new ATOM 0 HG1 THR A 107 -2.897 7.166 -16.053 1.00 0.00 H new ATOM 0 HG21 THR A 107 -1.366 7.883 -14.363 1.00 0.00 H new ATOM 0 HG22 THR A 107 -1.412 7.013 -12.810 1.00 0.00 H new ATOM 0 HG23 THR A 107 -0.761 6.212 -14.260 1.00 0.00 H new ATOM 1622 N GLU A 108 -1.956 3.813 -15.317 1.00 0.00 N ATOM 1623 CA GLU A 108 -0.946 2.916 -15.864 1.00 0.00 C ATOM 1624 C GLU A 108 0.457 3.383 -15.488 1.00 0.00 C ATOM 1625 O GLU A 108 1.392 2.584 -15.424 1.00 0.00 O ATOM 1626 CB GLU A 108 -1.077 2.832 -17.386 1.00 0.00 C ATOM 1627 CG GLU A 108 -1.106 4.189 -18.070 1.00 0.00 C ATOM 1628 CD GLU A 108 -0.951 4.087 -19.575 1.00 0.00 C ATOM 1629 OE1 GLU A 108 -0.947 2.953 -20.096 1.00 0.00 O ATOM 1630 OE2 GLU A 108 -0.834 5.143 -20.232 1.00 0.00 O ATOM 0 H GLU A 108 -2.577 4.225 -16.014 1.00 0.00 H new ATOM 0 HA GLU A 108 -1.107 1.926 -15.438 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -0.243 2.252 -17.783 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -1.989 2.290 -17.634 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -2.047 4.688 -17.838 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -0.307 4.812 -17.668 1.00 0.00 H new ATOM 1637 N ASP A 109 0.597 4.681 -15.243 1.00 0.00 N ATOM 1638 CA ASP A 109 1.885 5.255 -14.873 1.00 0.00 C ATOM 1639 C ASP A 109 2.137 5.106 -13.376 1.00 0.00 C ATOM 1640 O ASP A 109 3.264 5.269 -12.907 1.00 0.00 O ATOM 1641 CB ASP A 109 1.941 6.732 -15.268 1.00 0.00 C ATOM 1642 CG ASP A 109 1.781 6.938 -16.761 1.00 0.00 C ATOM 1643 OD1 ASP A 109 0.626 7.016 -17.228 1.00 0.00 O ATOM 1644 OD2 ASP A 109 2.811 7.021 -17.463 1.00 0.00 O ATOM 0 H ASP A 109 -0.166 5.356 -15.294 1.00 0.00 H new ATOM 0 HA ASP A 109 2.664 4.713 -15.409 1.00 0.00 H new ATOM 0 HB2 ASP A 109 1.156 7.276 -14.743 1.00 0.00 H new ATOM 0 HB3 ASP A 109 2.892 7.156 -14.946 1.00 0.00 H new ATOM 1649 N ASP A 110 1.081 4.797 -12.631 1.00 0.00 N ATOM 1650 CA ASP A 110 1.188 4.626 -11.187 1.00 0.00 C ATOM 1651 C ASP A 110 1.352 3.153 -10.825 1.00 0.00 C ATOM 1652 O ASP A 110 1.688 2.817 -9.689 1.00 0.00 O ATOM 1653 CB ASP A 110 -0.048 5.199 -10.492 1.00 0.00 C ATOM 1654 CG ASP A 110 -0.330 6.632 -10.901 1.00 0.00 C ATOM 1655 OD1 ASP A 110 0.638 7.371 -11.179 1.00 0.00 O ATOM 1656 OD2 ASP A 110 -1.518 7.013 -10.943 1.00 0.00 O ATOM 0 H ASP A 110 0.141 4.660 -13.003 1.00 0.00 H new ATOM 0 HA ASP A 110 2.071 5.166 -10.846 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -0.914 4.580 -10.728 1.00 0.00 H new ATOM 0 HB3 ASP A 110 0.092 5.153 -9.412 1.00 0.00 H new ATOM 1661 N ILE A 111 1.113 2.280 -11.798 1.00 0.00 N ATOM 1662 CA ILE A 111 1.235 0.843 -11.581 1.00 0.00 C ATOM 1663 C ILE A 111 2.263 0.230 -12.526 1.00 0.00 C ATOM 1664 O ILE A 111 2.213 -0.963 -12.826 1.00 0.00 O ATOM 1665 CB ILE A 111 -0.115 0.128 -11.774 1.00 0.00 C ATOM 1666 CG1 ILE A 111 -0.577 0.249 -13.228 1.00 0.00 C ATOM 1667 CG2 ILE A 111 -1.160 0.705 -10.831 1.00 0.00 C ATOM 1668 CD1 ILE A 111 -0.829 -1.085 -13.895 1.00 0.00 C ATOM 0 H ILE A 111 0.834 2.542 -12.743 1.00 0.00 H new ATOM 0 HA ILE A 111 1.565 0.706 -10.551 1.00 0.00 H new ATOM 0 HB ILE A 111 0.013 -0.929 -11.539 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -1.491 0.842 -13.262 1.00 0.00 H new ATOM 0 HG13 ILE A 111 0.177 0.793 -13.796 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -2.109 0.189 -10.980 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -0.832 0.572 -9.800 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -1.289 1.768 -11.037 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -1.153 -0.922 -14.923 1.00 0.00 H new ATOM 0 HD12 ILE A 111 0.089 -1.672 -13.893 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -1.605 -1.623 -13.351 1.00 0.00 H new ATOM 1680 N LYS A 112 3.196 1.054 -12.992 1.00 0.00 N ATOM 1681 CA LYS A 112 4.239 0.593 -13.901 1.00 0.00 C ATOM 1682 C LYS A 112 5.483 0.164 -13.129 1.00 0.00 C ATOM 1683 O LYS A 112 5.464 0.080 -11.902 1.00 0.00 O ATOM 1684 CB LYS A 112 4.599 1.697 -14.897 1.00 0.00 C ATOM 1685 CG LYS A 112 5.197 2.932 -14.246 1.00 0.00 C ATOM 1686 CD LYS A 112 6.239 3.585 -15.139 1.00 0.00 C ATOM 1687 CE LYS A 112 5.819 4.987 -15.554 1.00 0.00 C ATOM 1688 NZ LYS A 112 6.568 5.459 -16.751 1.00 0.00 N ATOM 0 H LYS A 112 3.251 2.045 -12.755 1.00 0.00 H new ATOM 0 HA LYS A 112 3.856 -0.270 -14.446 1.00 0.00 H new ATOM 0 HB2 LYS A 112 5.307 1.301 -15.625 1.00 0.00 H new ATOM 0 HB3 LYS A 112 3.703 1.984 -15.448 1.00 0.00 H new ATOM 0 HG2 LYS A 112 4.405 3.648 -14.026 1.00 0.00 H new ATOM 0 HG3 LYS A 112 5.652 2.658 -13.294 1.00 0.00 H new ATOM 0 HD2 LYS A 112 7.193 3.631 -14.613 1.00 0.00 H new ATOM 0 HD3 LYS A 112 6.393 2.973 -16.027 1.00 0.00 H new ATOM 0 HE2 LYS A 112 4.750 4.998 -15.767 1.00 0.00 H new ATOM 0 HE3 LYS A 112 5.986 5.676 -14.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 6.253 6.418 -17.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 7.586 5.473 -16.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 6.389 4.816 -17.549 1.00 0.00 H new ATOM 1702 N GLU A 113 6.562 -0.104 -13.857 1.00 0.00 N ATOM 1703 CA GLU A 113 7.815 -0.523 -13.239 1.00 0.00 C ATOM 1704 C GLU A 113 8.212 0.429 -12.115 1.00 0.00 C ATOM 1705 O GLU A 113 8.754 0.008 -11.093 1.00 0.00 O ATOM 1706 CB GLU A 113 8.929 -0.588 -14.286 1.00 0.00 C ATOM 1707 CG GLU A 113 9.233 0.752 -14.934 1.00 0.00 C ATOM 1708 CD GLU A 113 10.082 0.616 -16.183 1.00 0.00 C ATOM 1709 OE1 GLU A 113 10.214 -0.517 -16.690 1.00 0.00 O ATOM 1710 OE2 GLU A 113 10.615 1.643 -16.654 1.00 0.00 O ATOM 0 H GLU A 113 6.594 -0.039 -14.874 1.00 0.00 H new ATOM 0 HA GLU A 113 7.667 -1.516 -12.815 1.00 0.00 H new ATOM 0 HB2 GLU A 113 9.836 -0.969 -13.816 1.00 0.00 H new ATOM 0 HB3 GLU A 113 8.647 -1.301 -15.061 1.00 0.00 H new ATOM 0 HG2 GLU A 113 8.297 1.249 -15.188 1.00 0.00 H new ATOM 0 HG3 GLU A 113 9.749 1.390 -14.216 1.00 0.00 H new ATOM 1717 N ASP A 114 7.940 1.714 -12.313 1.00 0.00 N ATOM 1718 CA ASP A 114 8.269 2.727 -11.317 1.00 0.00 C ATOM 1719 C ASP A 114 7.025 3.509 -10.905 1.00 0.00 C ATOM 1720 O ASP A 114 7.096 4.702 -10.617 1.00 0.00 O ATOM 1721 CB ASP A 114 9.330 3.684 -11.862 1.00 0.00 C ATOM 1722 CG ASP A 114 10.363 4.059 -10.818 1.00 0.00 C ATOM 1723 OD1 ASP A 114 11.083 3.156 -10.345 1.00 0.00 O ATOM 1724 OD2 ASP A 114 10.451 5.256 -10.472 1.00 0.00 O ATOM 0 H ASP A 114 7.493 2.079 -13.154 1.00 0.00 H new ATOM 0 HA ASP A 114 8.666 2.220 -10.437 1.00 0.00 H new ATOM 0 HB2 ASP A 114 9.829 3.221 -12.713 1.00 0.00 H new ATOM 0 HB3 ASP A 114 8.845 4.588 -12.230 1.00 0.00 H new ATOM 1729 N GLY A 115 5.884 2.826 -10.882 1.00 0.00 N ATOM 1730 CA GLY A 115 4.640 3.472 -10.507 1.00 0.00 C ATOM 1731 C GLY A 115 4.684 4.044 -9.103 1.00 0.00 C ATOM 1732 O GLY A 115 5.125 3.376 -8.168 1.00 0.00 O ATOM 0 H GLY A 115 5.799 1.837 -11.116 1.00 0.00 H new ATOM 0 HA2 GLY A 115 4.421 4.271 -11.215 1.00 0.00 H new ATOM 0 HA3 GLY A 115 3.825 2.752 -10.577 1.00 0.00 H new ATOM 1736 N ILE A 116 4.228 5.283 -8.956 1.00 0.00 N ATOM 1737 CA ILE A 116 4.218 5.944 -7.657 1.00 0.00 C ATOM 1738 C ILE A 116 2.890 6.651 -7.410 1.00 0.00 C ATOM 1739 O ILE A 116 2.376 7.352 -8.283 1.00 0.00 O ATOM 1740 CB ILE A 116 5.363 6.967 -7.538 1.00 0.00 C ATOM 1741 CG1 ILE A 116 5.308 7.669 -6.179 1.00 0.00 C ATOM 1742 CG2 ILE A 116 5.285 7.983 -8.668 1.00 0.00 C ATOM 1743 CD1 ILE A 116 5.382 6.719 -5.005 1.00 0.00 C ATOM 0 H ILE A 116 3.861 5.850 -9.720 1.00 0.00 H new ATOM 0 HA ILE A 116 4.357 5.167 -6.906 1.00 0.00 H new ATOM 0 HB ILE A 116 6.313 6.438 -7.616 1.00 0.00 H new ATOM 0 HG12 ILE A 116 6.131 8.380 -6.113 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.384 8.244 -6.113 1.00 0.00 H new ATOM 0 HG21 ILE A 116 6.101 8.699 -8.570 1.00 0.00 H new ATOM 0 HG22 ILE A 116 5.366 7.469 -9.626 1.00 0.00 H new ATOM 0 HG23 ILE A 116 4.332 8.510 -8.619 1.00 0.00 H new ATOM 0 HD11 ILE A 116 5.338 7.286 -4.075 1.00 0.00 H new ATOM 0 HD12 ILE A 116 4.544 6.023 -5.046 1.00 0.00 H new ATOM 0 HD13 ILE A 116 6.318 6.162 -5.046 1.00 0.00 H new ATOM 1755 N VAL A 117 2.340 6.465 -6.215 1.00 0.00 N ATOM 1756 CA VAL A 117 1.073 7.088 -5.851 1.00 0.00 C ATOM 1757 C VAL A 117 1.271 8.147 -4.773 1.00 0.00 C ATOM 1758 O VAL A 117 1.421 7.843 -3.589 1.00 0.00 O ATOM 1759 CB VAL A 117 0.058 6.044 -5.349 1.00 0.00 C ATOM 1760 CG1 VAL A 117 -1.330 6.657 -5.240 1.00 0.00 C ATOM 1761 CG2 VAL A 117 0.042 4.832 -6.269 1.00 0.00 C ATOM 0 H VAL A 117 2.752 5.888 -5.482 1.00 0.00 H new ATOM 0 HA VAL A 117 0.682 7.560 -6.752 1.00 0.00 H new ATOM 0 HB VAL A 117 0.363 5.715 -4.356 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -2.033 5.904 -4.884 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -1.305 7.491 -4.539 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -1.647 7.016 -6.219 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -0.681 4.104 -5.900 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -0.238 5.143 -7.275 1.00 0.00 H new ATOM 0 HG23 VAL A 117 1.033 4.379 -6.292 1.00 0.00 H new ATOM 1771 N PRO A 118 1.270 9.422 -5.189 1.00 0.00 N ATOM 1772 CA PRO A 118 1.448 10.554 -4.274 1.00 0.00 C ATOM 1773 C PRO A 118 0.246 10.750 -3.356 1.00 0.00 C ATOM 1774 O PRO A 118 -0.823 11.172 -3.797 1.00 0.00 O ATOM 1775 CB PRO A 118 1.603 11.750 -5.215 1.00 0.00 C ATOM 1776 CG PRO A 118 0.900 11.344 -6.464 1.00 0.00 C ATOM 1777 CD PRO A 118 1.096 9.858 -6.585 1.00 0.00 C ATOM 0 HA PRO A 118 2.296 10.409 -3.605 1.00 0.00 H new ATOM 0 HB2 PRO A 118 1.161 12.650 -4.787 1.00 0.00 H new ATOM 0 HB3 PRO A 118 2.653 11.970 -5.406 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -0.160 11.595 -6.415 1.00 0.00 H new ATOM 0 HG3 PRO A 118 1.311 11.864 -7.330 1.00 0.00 H new ATOM 0 HD2 PRO A 118 0.237 9.376 -7.052 1.00 0.00 H new ATOM 0 HD3 PRO A 118 1.967 9.616 -7.193 1.00 0.00 H new ATOM 1785 N LEU A 119 0.429 10.443 -2.076 1.00 0.00 N ATOM 1786 CA LEU A 119 -0.641 10.586 -1.095 1.00 0.00 C ATOM 1787 C LEU A 119 -0.588 11.958 -0.429 1.00 0.00 C ATOM 1788 O LEU A 119 0.186 12.826 -0.833 1.00 0.00 O ATOM 1789 CB LEU A 119 -0.538 9.488 -0.035 1.00 0.00 C ATOM 1790 CG LEU A 119 -0.528 8.051 -0.557 1.00 0.00 C ATOM 1791 CD1 LEU A 119 0.054 7.109 0.485 1.00 0.00 C ATOM 1792 CD2 LEU A 119 -1.932 7.615 -0.947 1.00 0.00 C ATOM 0 H LEU A 119 1.308 10.094 -1.694 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.594 10.491 -1.616 1.00 0.00 H new ATOM 0 HB2 LEU A 119 0.373 9.651 0.541 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -1.375 9.597 0.655 1.00 0.00 H new ATOM 0 HG LEU A 119 0.103 8.012 -1.445 1.00 0.00 H new ATOM 0 HD11 LEU A 119 0.053 6.091 0.096 1.00 0.00 H new ATOM 0 HD12 LEU A 119 1.076 7.408 0.716 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -0.550 7.152 1.392 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -1.905 6.590 -1.316 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -2.585 7.670 -0.076 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -2.313 8.272 -1.729 1.00 0.00 H new ATOM 1804 N ARG A 120 -1.415 12.145 0.595 1.00 0.00 N ATOM 1805 CA ARG A 120 -1.462 13.410 1.318 1.00 0.00 C ATOM 1806 C ARG A 120 -1.049 13.220 2.774 1.00 0.00 C ATOM 1807 O ARG A 120 -1.866 12.854 3.619 1.00 0.00 O ATOM 1808 CB ARG A 120 -2.868 14.009 1.249 1.00 0.00 C ATOM 1809 CG ARG A 120 -3.971 13.011 1.564 1.00 0.00 C ATOM 1810 CD ARG A 120 -5.343 13.572 1.226 1.00 0.00 C ATOM 1811 NE ARG A 120 -5.470 13.889 -0.194 1.00 0.00 N ATOM 1812 CZ ARG A 120 -6.573 14.388 -0.740 1.00 0.00 C ATOM 1813 NH1 ARG A 120 -7.640 14.626 0.012 1.00 0.00 N ATOM 1814 NH2 ARG A 120 -6.612 14.650 -2.040 1.00 0.00 N ATOM 0 H ARG A 120 -2.061 11.436 0.942 1.00 0.00 H new ATOM 0 HA ARG A 120 -0.759 14.096 0.846 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -2.933 14.843 1.948 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -3.032 14.416 0.251 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -3.804 12.093 1.001 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -3.934 12.748 2.621 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -6.109 12.849 1.506 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -5.522 14.471 1.816 1.00 0.00 H new ATOM 0 HE ARG A 120 -4.667 13.718 -0.800 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -7.614 14.426 1.012 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -8.486 15.009 -0.410 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -5.794 14.468 -2.622 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -7.460 15.033 -2.458 1.00 0.00 H new ATOM 1828 N TYR A 121 0.224 13.470 3.060 1.00 0.00 N ATOM 1829 CA TYR A 121 0.747 13.324 4.413 1.00 0.00 C ATOM 1830 C TYR A 121 -0.046 14.176 5.398 1.00 0.00 C ATOM 1831 O TYR A 121 -0.070 13.900 6.598 1.00 0.00 O ATOM 1832 CB TYR A 121 2.225 13.716 4.456 1.00 0.00 C ATOM 1833 CG TYR A 121 2.454 15.210 4.488 1.00 0.00 C ATOM 1834 CD1 TYR A 121 1.929 16.035 3.501 1.00 0.00 C ATOM 1835 CD2 TYR A 121 3.197 15.797 5.505 1.00 0.00 C ATOM 1836 CE1 TYR A 121 2.137 17.400 3.526 1.00 0.00 C ATOM 1837 CE2 TYR A 121 3.408 17.162 5.539 1.00 0.00 C ATOM 1838 CZ TYR A 121 2.876 17.959 4.547 1.00 0.00 C ATOM 1839 OH TYR A 121 3.086 19.319 4.576 1.00 0.00 O ATOM 0 H TYR A 121 0.913 13.775 2.372 1.00 0.00 H new ATOM 0 HA TYR A 121 0.647 12.278 4.703 1.00 0.00 H new ATOM 0 HB2 TYR A 121 2.686 13.267 5.336 1.00 0.00 H new ATOM 0 HB3 TYR A 121 2.729 13.298 3.584 1.00 0.00 H new ATOM 0 HD1 TYR A 121 1.348 15.601 2.700 1.00 0.00 H new ATOM 0 HD2 TYR A 121 3.617 15.176 6.282 1.00 0.00 H new ATOM 0 HE1 TYR A 121 1.723 18.026 2.750 1.00 0.00 H new ATOM 0 HE2 TYR A 121 3.986 17.602 6.338 1.00 0.00 H new ATOM 0 HH TYR A 121 3.625 19.550 5.361 1.00 0.00 H new ATOM 1849 N VAL A 122 -0.696 15.215 4.883 1.00 0.00 N ATOM 1850 CA VAL A 122 -1.492 16.109 5.716 1.00 0.00 C ATOM 1851 C VAL A 122 -2.566 15.339 6.476 1.00 0.00 C ATOM 1852 O VAL A 122 -3.066 15.800 7.502 1.00 0.00 O ATOM 1853 CB VAL A 122 -2.163 17.210 4.874 1.00 0.00 C ATOM 1854 CG1 VAL A 122 -3.076 16.598 3.822 1.00 0.00 C ATOM 1855 CG2 VAL A 122 -2.936 18.168 5.769 1.00 0.00 C ATOM 0 H VAL A 122 -0.687 15.458 3.893 1.00 0.00 H new ATOM 0 HA VAL A 122 -0.809 16.572 6.428 1.00 0.00 H new ATOM 0 HB VAL A 122 -1.385 17.775 4.361 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -3.541 17.392 3.237 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.492 15.956 3.162 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -3.850 16.007 4.311 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -3.404 18.940 5.158 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -3.706 17.619 6.311 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -2.253 18.633 6.480 1.00 0.00 H new ATOM 1865 N LYS A 123 -2.917 14.164 5.965 1.00 0.00 N ATOM 1866 CA LYS A 123 -3.932 13.328 6.596 1.00 0.00 C ATOM 1867 C LYS A 123 -3.288 12.173 7.357 1.00 0.00 C ATOM 1868 O LYS A 123 -3.808 11.723 8.379 1.00 0.00 O ATOM 1869 CB LYS A 123 -4.899 12.782 5.543 1.00 0.00 C ATOM 1870 CG LYS A 123 -5.597 13.865 4.739 1.00 0.00 C ATOM 1871 CD LYS A 123 -6.884 14.316 5.408 1.00 0.00 C ATOM 1872 CE LYS A 123 -6.659 15.541 6.282 1.00 0.00 C ATOM 1873 NZ LYS A 123 -7.898 16.355 6.423 1.00 0.00 N ATOM 0 H LYS A 123 -2.514 13.769 5.116 1.00 0.00 H new ATOM 0 HA LYS A 123 -4.486 13.944 7.305 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -4.351 12.131 4.861 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -5.651 12.166 6.037 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -4.929 14.718 4.621 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -5.818 13.492 3.739 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -7.631 14.543 4.647 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -7.284 13.504 6.015 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -6.317 15.226 7.268 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -5.868 16.155 5.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -7.704 17.180 7.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -8.211 16.677 5.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -8.645 15.777 6.858 1.00 0.00 H new ATOM 1887 N PHE A 124 -2.154 11.698 6.854 1.00 0.00 N ATOM 1888 CA PHE A 124 -1.439 10.596 7.488 1.00 0.00 C ATOM 1889 C PHE A 124 -0.288 11.115 8.344 1.00 0.00 C ATOM 1890 O PHE A 124 0.748 10.462 8.470 1.00 0.00 O ATOM 1891 CB PHE A 124 -0.906 9.629 6.428 1.00 0.00 C ATOM 1892 CG PHE A 124 -1.903 9.312 5.351 1.00 0.00 C ATOM 1893 CD1 PHE A 124 -2.946 8.432 5.591 1.00 0.00 C ATOM 1894 CD2 PHE A 124 -1.797 9.893 4.097 1.00 0.00 C ATOM 1895 CE1 PHE A 124 -3.866 8.138 4.602 1.00 0.00 C ATOM 1896 CE2 PHE A 124 -2.714 9.603 3.104 1.00 0.00 C ATOM 1897 CZ PHE A 124 -3.749 8.724 3.356 1.00 0.00 C ATOM 0 H PHE A 124 -1.710 12.058 6.009 1.00 0.00 H new ATOM 0 HA PHE A 124 -2.139 10.066 8.134 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.014 10.058 5.972 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -0.601 8.702 6.914 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -3.041 7.970 6.563 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -0.989 10.580 3.893 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -4.675 7.451 4.803 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -2.621 10.064 2.132 1.00 0.00 H new ATOM 0 HZ PHE A 124 -4.465 8.495 2.581 1.00 0.00 H new ATOM 1907 N GLN A 125 -0.478 12.293 8.929 1.00 0.00 N ATOM 1908 CA GLN A 125 0.545 12.901 9.772 1.00 0.00 C ATOM 1909 C GLN A 125 1.026 11.921 10.837 1.00 0.00 C ATOM 1910 O GLN A 125 2.195 11.930 11.221 1.00 0.00 O ATOM 1911 CB GLN A 125 0.003 14.168 10.436 1.00 0.00 C ATOM 1912 CG GLN A 125 -0.511 15.201 9.446 1.00 0.00 C ATOM 1913 CD GLN A 125 0.573 16.151 8.978 1.00 0.00 C ATOM 1914 OE1 GLN A 125 0.622 17.309 9.393 1.00 0.00 O ATOM 1915 NE2 GLN A 125 1.452 15.665 8.109 1.00 0.00 N ATOM 0 H GLN A 125 -1.330 12.845 8.835 1.00 0.00 H new ATOM 0 HA GLN A 125 1.391 13.165 9.138 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -0.804 13.895 11.116 1.00 0.00 H new ATOM 0 HB3 GLN A 125 0.791 14.617 11.041 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -0.938 14.690 8.583 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -1.315 15.773 9.909 1.00 0.00 H new ATOM 0 HE21 GLN A 125 1.374 14.699 7.791 1.00 0.00 H new ATOM 0 HE22 GLN A 125 2.205 16.258 7.759 1.00 0.00 H new ATOM 1924 N ASN A 126 0.116 11.075 11.310 1.00 0.00 N ATOM 1925 CA ASN A 126 0.447 10.089 12.332 1.00 0.00 C ATOM 1926 C ASN A 126 -0.520 8.910 12.284 1.00 0.00 C ATOM 1927 O ASN A 126 -1.621 8.974 12.831 1.00 0.00 O ATOM 1928 CB ASN A 126 0.417 10.732 13.720 1.00 0.00 C ATOM 1929 CG ASN A 126 1.801 11.105 14.215 1.00 0.00 C ATOM 1930 OD1 ASN A 126 2.366 12.119 13.806 1.00 0.00 O ATOM 1931 ND2 ASN A 126 2.354 10.283 15.099 1.00 0.00 N ATOM 0 H ASN A 126 -0.856 11.053 11.002 1.00 0.00 H new ATOM 0 HA ASN A 126 1.453 9.719 12.132 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -0.208 11.625 13.690 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -0.045 10.043 14.427 1.00 0.00 H new ATOM 0 HD21 ASN A 126 3.284 10.481 15.467 1.00 0.00 H new ATOM 0 HD22 ASN A 126 1.848 9.453 15.410 1.00 0.00 H new ATOM 1938 N VAL A 127 -0.101 7.834 11.626 1.00 0.00 N ATOM 1939 CA VAL A 127 -0.929 6.639 11.508 1.00 0.00 C ATOM 1940 C VAL A 127 -0.199 5.410 12.037 1.00 0.00 C ATOM 1941 O VAL A 127 1.005 5.257 11.837 1.00 0.00 O ATOM 1942 CB VAL A 127 -1.344 6.387 10.046 1.00 0.00 C ATOM 1943 CG1 VAL A 127 -1.833 7.674 9.400 1.00 0.00 C ATOM 1944 CG2 VAL A 127 -0.187 5.792 9.259 1.00 0.00 C ATOM 0 H VAL A 127 0.807 7.765 11.166 1.00 0.00 H new ATOM 0 HA VAL A 127 -1.823 6.812 12.107 1.00 0.00 H new ATOM 0 HB VAL A 127 -2.165 5.670 10.038 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -2.122 7.476 8.368 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -2.693 8.054 9.951 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -1.035 8.416 9.418 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -0.498 5.620 8.228 1.00 0.00 H new ATOM 0 HG22 VAL A 127 0.656 6.483 9.273 1.00 0.00 H new ATOM 0 HG23 VAL A 127 0.111 4.846 9.710 1.00 0.00 H new ATOM 1954 N ASN A 128 -0.937 4.536 12.713 1.00 0.00 N ATOM 1955 CA ASN A 128 -0.360 3.319 13.272 1.00 0.00 C ATOM 1956 C ASN A 128 -0.913 2.082 12.570 1.00 0.00 C ATOM 1957 O ASN A 128 -0.365 0.987 12.695 1.00 0.00 O ATOM 1958 CB ASN A 128 -0.644 3.237 14.773 1.00 0.00 C ATOM 1959 CG ASN A 128 -0.325 1.870 15.348 1.00 0.00 C ATOM 1960 OD1 ASN A 128 0.777 1.635 15.843 1.00 0.00 O ATOM 1961 ND2 ASN A 128 -1.291 0.962 15.284 1.00 0.00 N ATOM 0 H ASN A 128 -1.936 4.648 12.887 1.00 0.00 H new ATOM 0 HA ASN A 128 0.718 3.353 13.115 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -0.056 3.993 15.293 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -1.693 3.469 14.955 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -1.135 0.024 15.654 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -2.189 1.202 14.865 1.00 0.00 H new ATOM 1968 N SER A 129 -2.003 2.266 11.831 1.00 0.00 N ATOM 1969 CA SER A 129 -2.633 1.165 11.112 1.00 0.00 C ATOM 1970 C SER A 129 -3.298 1.662 9.832 1.00 0.00 C ATOM 1971 O SER A 129 -4.178 2.523 9.870 1.00 0.00 O ATOM 1972 CB SER A 129 -3.667 0.472 12.002 1.00 0.00 C ATOM 1973 OG SER A 129 -4.686 1.374 12.397 1.00 0.00 O ATOM 0 H SER A 129 -2.468 3.167 11.715 1.00 0.00 H new ATOM 0 HA SER A 129 -1.857 0.448 10.843 1.00 0.00 H new ATOM 0 HB2 SER A 129 -4.108 -0.368 11.466 1.00 0.00 H new ATOM 0 HB3 SER A 129 -3.176 0.064 12.885 1.00 0.00 H new ATOM 0 HG SER A 129 -4.866 2.004 11.668 1.00 0.00 H new ATOM 1979 N VAL A 130 -2.871 1.114 8.699 1.00 0.00 N ATOM 1980 CA VAL A 130 -3.425 1.500 7.407 1.00 0.00 C ATOM 1981 C VAL A 130 -3.980 0.290 6.663 1.00 0.00 C ATOM 1982 O VAL A 130 -3.418 -0.804 6.727 1.00 0.00 O ATOM 1983 CB VAL A 130 -2.366 2.189 6.526 1.00 0.00 C ATOM 1984 CG1 VAL A 130 -1.117 1.328 6.420 1.00 0.00 C ATOM 1985 CG2 VAL A 130 -2.935 2.489 5.147 1.00 0.00 C ATOM 0 H VAL A 130 -2.143 0.401 8.650 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.234 2.202 7.607 1.00 0.00 H new ATOM 0 HB VAL A 130 -2.088 3.134 6.993 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -0.380 1.831 5.794 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -0.700 1.168 7.414 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -1.375 0.366 5.976 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -2.174 2.976 4.537 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -3.242 1.558 4.670 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -3.798 3.148 5.245 1.00 0.00 H new ATOM 1995 N THR A 131 -5.087 0.493 5.956 1.00 0.00 N ATOM 1996 CA THR A 131 -5.719 -0.580 5.200 1.00 0.00 C ATOM 1997 C THR A 131 -6.064 -0.128 3.786 1.00 0.00 C ATOM 1998 O THR A 131 -6.429 1.027 3.565 1.00 0.00 O ATOM 1999 CB THR A 131 -7.002 -1.077 5.894 1.00 0.00 C ATOM 2000 OG1 THR A 131 -6.688 -1.586 7.196 1.00 0.00 O ATOM 2001 CG2 THR A 131 -7.678 -2.162 5.070 1.00 0.00 C ATOM 0 H THR A 131 -5.565 1.392 5.891 1.00 0.00 H new ATOM 0 HA THR A 131 -5.000 -1.398 5.152 1.00 0.00 H new ATOM 0 HB THR A 131 -7.687 -0.235 5.988 1.00 0.00 H new ATOM 0 HG1 THR A 131 -7.508 -1.898 7.632 1.00 0.00 H new ATOM 0 HG21 THR A 131 -8.581 -2.497 5.580 1.00 0.00 H new ATOM 0 HG22 THR A 131 -7.941 -1.764 4.090 1.00 0.00 H new ATOM 0 HG23 THR A 131 -6.997 -3.004 4.948 1.00 0.00 H new ATOM 2009 N ILE A 132 -5.945 -1.045 2.831 1.00 0.00 N ATOM 2010 CA ILE A 132 -6.246 -0.740 1.438 1.00 0.00 C ATOM 2011 C ILE A 132 -7.236 -1.744 0.857 1.00 0.00 C ATOM 2012 O ILE A 132 -6.986 -2.949 0.856 1.00 0.00 O ATOM 2013 CB ILE A 132 -4.971 -0.734 0.575 1.00 0.00 C ATOM 2014 CG1 ILE A 132 -4.007 0.352 1.058 1.00 0.00 C ATOM 2015 CG2 ILE A 132 -5.324 -0.523 -0.890 1.00 0.00 C ATOM 2016 CD1 ILE A 132 -2.575 -0.122 1.180 1.00 0.00 C ATOM 0 H ILE A 132 -5.642 -2.005 2.997 1.00 0.00 H new ATOM 0 HA ILE A 132 -6.690 0.255 1.422 1.00 0.00 H new ATOM 0 HB ILE A 132 -4.478 -1.701 0.674 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -4.045 1.194 0.367 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -4.343 0.720 2.027 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -4.412 -0.521 -1.487 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -5.977 -1.328 -1.227 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -5.836 0.432 -1.007 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.948 0.699 1.527 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -2.523 -0.944 1.894 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -2.221 -0.463 0.207 1.00 0.00 H new ATOM 2028 N PHE A 133 -8.360 -1.239 0.360 1.00 0.00 N ATOM 2029 CA PHE A 133 -9.387 -2.091 -0.227 1.00 0.00 C ATOM 2030 C PHE A 133 -9.418 -1.941 -1.745 1.00 0.00 C ATOM 2031 O PHE A 133 -9.577 -0.838 -2.268 1.00 0.00 O ATOM 2032 CB PHE A 133 -10.759 -1.749 0.358 1.00 0.00 C ATOM 2033 CG PHE A 133 -11.901 -2.389 -0.377 1.00 0.00 C ATOM 2034 CD1 PHE A 133 -11.842 -3.722 -0.750 1.00 0.00 C ATOM 2035 CD2 PHE A 133 -13.035 -1.659 -0.694 1.00 0.00 C ATOM 2036 CE1 PHE A 133 -12.891 -4.314 -1.428 1.00 0.00 C ATOM 2037 CE2 PHE A 133 -14.088 -2.245 -1.371 1.00 0.00 C ATOM 2038 CZ PHE A 133 -14.016 -3.575 -1.737 1.00 0.00 C ATOM 0 H PHE A 133 -8.583 -0.244 0.352 1.00 0.00 H new ATOM 0 HA PHE A 133 -9.144 -3.126 0.013 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -10.788 -2.062 1.402 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -10.891 -0.667 0.346 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -10.966 -4.305 -0.508 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -13.097 -0.619 -0.409 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -12.831 -5.353 -1.716 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -14.966 -1.664 -1.613 1.00 0.00 H new ATOM 0 HZ PHE A 133 -14.838 -4.036 -2.264 1.00 0.00 H new ATOM 2048 N VAL A 134 -9.263 -3.059 -2.447 1.00 0.00 N ATOM 2049 CA VAL A 134 -9.273 -3.053 -3.905 1.00 0.00 C ATOM 2050 C VAL A 134 -10.698 -3.021 -4.445 1.00 0.00 C ATOM 2051 O VAL A 134 -11.522 -3.866 -4.098 1.00 0.00 O ATOM 2052 CB VAL A 134 -8.547 -4.285 -4.477 1.00 0.00 C ATOM 2053 CG1 VAL A 134 -8.613 -4.288 -5.996 1.00 0.00 C ATOM 2054 CG2 VAL A 134 -7.103 -4.322 -3.998 1.00 0.00 C ATOM 0 H VAL A 134 -9.129 -3.980 -2.030 1.00 0.00 H new ATOM 0 HA VAL A 134 -8.747 -2.152 -4.221 1.00 0.00 H new ATOM 0 HB VAL A 134 -9.050 -5.181 -4.114 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -8.095 -5.166 -6.381 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -9.655 -4.313 -6.315 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -8.137 -3.387 -6.383 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -6.605 -5.199 -4.412 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -6.587 -3.421 -4.329 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -7.082 -4.373 -2.909 1.00 0.00 H new ATOM 2064 N GLN A 135 -10.981 -2.040 -5.297 1.00 0.00 N ATOM 2065 CA GLN A 135 -12.308 -1.899 -5.885 1.00 0.00 C ATOM 2066 C GLN A 135 -12.284 -2.240 -7.371 1.00 0.00 C ATOM 2067 O GLN A 135 -12.901 -3.213 -7.804 1.00 0.00 O ATOM 2068 CB GLN A 135 -12.828 -0.474 -5.685 1.00 0.00 C ATOM 2069 CG GLN A 135 -14.331 -0.399 -5.472 1.00 0.00 C ATOM 2070 CD GLN A 135 -14.762 0.885 -4.792 1.00 0.00 C ATOM 2071 OE1 GLN A 135 -14.685 1.966 -5.376 1.00 0.00 O ATOM 2072 NE2 GLN A 135 -15.218 0.773 -3.549 1.00 0.00 N ATOM 0 H GLN A 135 -10.310 -1.332 -5.595 1.00 0.00 H new ATOM 0 HA GLN A 135 -12.977 -2.597 -5.382 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -12.325 -0.030 -4.826 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -12.562 0.126 -6.555 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -14.835 -0.482 -6.435 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -14.651 -1.249 -4.870 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -15.265 -0.143 -3.103 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -15.522 1.603 -3.040 1.00 0.00 H new ATOM 2081 N SER A 136 -11.568 -1.433 -8.147 1.00 0.00 N ATOM 2082 CA SER A 136 -11.467 -1.647 -9.586 1.00 0.00 C ATOM 2083 C SER A 136 -10.008 -1.691 -10.028 1.00 0.00 C ATOM 2084 O SER A 136 -9.105 -1.360 -9.260 1.00 0.00 O ATOM 2085 CB SER A 136 -12.207 -0.540 -10.340 1.00 0.00 C ATOM 2086 OG SER A 136 -13.208 0.049 -9.529 1.00 0.00 O ATOM 0 H SER A 136 -11.049 -0.625 -7.803 1.00 0.00 H new ATOM 0 HA SER A 136 -11.928 -2.607 -9.819 1.00 0.00 H new ATOM 0 HB2 SER A 136 -11.498 0.224 -10.659 1.00 0.00 H new ATOM 0 HB3 SER A 136 -12.661 -0.951 -11.242 1.00 0.00 H new ATOM 0 HG SER A 136 -13.665 0.754 -10.033 1.00 0.00 H new ATOM 2092 N ASN A 137 -9.785 -2.103 -11.272 1.00 0.00 N ATOM 2093 CA ASN A 137 -8.435 -2.192 -11.817 1.00 0.00 C ATOM 2094 C ASN A 137 -8.227 -1.162 -12.923 1.00 0.00 C ATOM 2095 O ASN A 137 -9.084 -0.313 -13.163 1.00 0.00 O ATOM 2096 CB ASN A 137 -8.173 -3.598 -12.358 1.00 0.00 C ATOM 2097 CG ASN A 137 -9.373 -4.512 -12.198 1.00 0.00 C ATOM 2098 OD1 ASN A 137 -10.442 -4.254 -12.751 1.00 0.00 O ATOM 2099 ND2 ASN A 137 -9.200 -5.588 -11.439 1.00 0.00 N ATOM 0 H ASN A 137 -10.521 -2.380 -11.921 1.00 0.00 H new ATOM 0 HA ASN A 137 -7.730 -1.983 -11.012 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -7.906 -3.535 -13.413 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -7.318 -4.031 -11.838 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -9.971 -6.240 -11.295 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -8.296 -5.762 -11.000 1.00 0.00 H new ATOM 2106 N GLN A 138 -7.082 -1.246 -13.594 1.00 0.00 N ATOM 2107 CA GLN A 138 -6.761 -0.321 -14.675 1.00 0.00 C ATOM 2108 C GLN A 138 -7.746 -0.471 -15.830 1.00 0.00 C ATOM 2109 O GLN A 138 -8.473 0.463 -16.164 1.00 0.00 O ATOM 2110 CB GLN A 138 -5.334 -0.559 -15.171 1.00 0.00 C ATOM 2111 CG GLN A 138 -4.278 -0.382 -14.093 1.00 0.00 C ATOM 2112 CD GLN A 138 -4.120 1.063 -13.662 1.00 0.00 C ATOM 2113 OE1 GLN A 138 -3.863 1.943 -14.483 1.00 0.00 O ATOM 2114 NE2 GLN A 138 -4.274 1.315 -12.367 1.00 0.00 N ATOM 0 H GLN A 138 -6.362 -1.944 -13.408 1.00 0.00 H new ATOM 0 HA GLN A 138 -6.838 0.694 -14.286 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -5.263 -1.569 -15.576 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -5.124 0.128 -15.990 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -4.543 -0.988 -13.227 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -3.322 -0.754 -14.462 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -4.487 0.555 -11.721 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -4.180 2.269 -12.018 1.00 0.00 H new ATOM 2123 N GLY A 139 -7.763 -1.654 -16.437 1.00 0.00 N ATOM 2124 CA GLY A 139 -8.661 -1.905 -17.548 1.00 0.00 C ATOM 2125 C GLY A 139 -9.909 -2.657 -17.127 1.00 0.00 C ATOM 2126 O GLY A 139 -10.540 -3.328 -17.942 1.00 0.00 O ATOM 0 H GLY A 139 -7.170 -2.443 -16.179 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -8.948 -0.956 -18.001 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -8.136 -2.477 -18.313 1.00 0.00 H new ATOM 2130 N GLU A 140 -10.263 -2.545 -15.851 1.00 0.00 N ATOM 2131 CA GLU A 140 -11.441 -3.222 -15.324 1.00 0.00 C ATOM 2132 C GLU A 140 -11.286 -4.737 -15.419 1.00 0.00 C ATOM 2133 O GLU A 140 -12.263 -5.460 -15.611 1.00 0.00 O ATOM 2134 CB GLU A 140 -12.694 -2.778 -16.082 1.00 0.00 C ATOM 2135 CG GLU A 140 -12.806 -1.271 -16.243 1.00 0.00 C ATOM 2136 CD GLU A 140 -14.031 -0.859 -17.036 1.00 0.00 C ATOM 2137 OE1 GLU A 140 -15.116 -1.425 -16.788 1.00 0.00 O ATOM 2138 OE2 GLU A 140 -13.905 0.030 -17.904 1.00 0.00 O ATOM 0 H GLU A 140 -9.751 -1.992 -15.164 1.00 0.00 H new ATOM 0 HA GLU A 140 -11.545 -2.950 -14.274 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -12.695 -3.241 -17.069 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -13.576 -3.145 -15.557 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -12.842 -0.806 -15.258 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -11.912 -0.895 -16.741 1.00 0.00 H new ATOM 2145 N GLU A 141 -10.051 -5.210 -15.284 1.00 0.00 N ATOM 2146 CA GLU A 141 -9.768 -6.638 -15.356 1.00 0.00 C ATOM 2147 C GLU A 141 -10.675 -7.421 -14.411 1.00 0.00 C ATOM 2148 O GLU A 141 -11.183 -6.878 -13.430 1.00 0.00 O ATOM 2149 CB GLU A 141 -8.301 -6.908 -15.013 1.00 0.00 C ATOM 2150 CG GLU A 141 -7.325 -6.041 -15.790 1.00 0.00 C ATOM 2151 CD GLU A 141 -6.634 -5.013 -14.915 1.00 0.00 C ATOM 2152 OE1 GLU A 141 -6.318 -5.339 -13.752 1.00 0.00 O ATOM 2153 OE2 GLU A 141 -6.409 -3.882 -15.394 1.00 0.00 O ATOM 0 H GLU A 141 -9.231 -4.625 -15.124 1.00 0.00 H new ATOM 0 HA GLU A 141 -9.962 -6.970 -16.376 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -8.150 -6.744 -13.946 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -8.078 -7.957 -15.209 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -6.574 -6.677 -16.259 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -7.857 -5.531 -16.593 1.00 0.00 H new ATOM 2160 N GLU A 142 -10.874 -8.700 -14.715 1.00 0.00 N ATOM 2161 CA GLU A 142 -11.721 -9.557 -13.894 1.00 0.00 C ATOM 2162 C GLU A 142 -11.134 -9.722 -12.495 1.00 0.00 C ATOM 2163 O GLU A 142 -11.848 -10.032 -11.541 1.00 0.00 O ATOM 2164 CB GLU A 142 -11.890 -10.927 -14.553 1.00 0.00 C ATOM 2165 CG GLU A 142 -10.579 -11.560 -14.986 1.00 0.00 C ATOM 2166 CD GLU A 142 -10.698 -13.056 -15.207 1.00 0.00 C ATOM 2167 OE1 GLU A 142 -11.477 -13.702 -14.476 1.00 0.00 O ATOM 2168 OE2 GLU A 142 -10.012 -13.580 -16.109 1.00 0.00 O ATOM 0 H GLU A 142 -10.460 -9.165 -15.523 1.00 0.00 H new ATOM 0 HA GLU A 142 -12.698 -9.082 -13.806 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -12.394 -11.596 -13.856 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -12.539 -10.825 -15.423 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -10.238 -11.087 -15.907 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -9.819 -11.368 -14.228 1.00 0.00 H new ATOM 2175 N THR A 143 -9.826 -9.514 -12.380 1.00 0.00 N ATOM 2176 CA THR A 143 -9.141 -9.642 -11.100 1.00 0.00 C ATOM 2177 C THR A 143 -7.877 -8.790 -11.065 1.00 0.00 C ATOM 2178 O THR A 143 -7.299 -8.475 -12.106 1.00 0.00 O ATOM 2179 CB THR A 143 -8.767 -11.107 -10.806 1.00 0.00 C ATOM 2180 OG1 THR A 143 -7.751 -11.161 -9.798 1.00 0.00 O ATOM 2181 CG2 THR A 143 -8.275 -11.803 -12.067 1.00 0.00 C ATOM 0 H THR A 143 -9.220 -9.256 -13.159 1.00 0.00 H new ATOM 0 HA THR A 143 -9.834 -9.291 -10.335 1.00 0.00 H new ATOM 0 HB THR A 143 -9.659 -11.622 -10.450 1.00 0.00 H new ATOM 0 HG1 THR A 143 -7.298 -12.029 -9.837 1.00 0.00 H new ATOM 0 HG21 THR A 143 -8.017 -12.836 -11.835 1.00 0.00 H new ATOM 0 HG22 THR A 143 -9.061 -11.786 -12.822 1.00 0.00 H new ATOM 0 HG23 THR A 143 -7.395 -11.286 -12.448 1.00 0.00 H new ATOM 2189 N THR A 144 -7.451 -8.420 -9.861 1.00 0.00 N ATOM 2190 CA THR A 144 -6.256 -7.604 -9.691 1.00 0.00 C ATOM 2191 C THR A 144 -5.111 -8.422 -9.103 1.00 0.00 C ATOM 2192 O THR A 144 -5.259 -9.051 -8.055 1.00 0.00 O ATOM 2193 CB THR A 144 -6.527 -6.393 -8.779 1.00 0.00 C ATOM 2194 OG1 THR A 144 -7.806 -5.827 -9.085 1.00 0.00 O ATOM 2195 CG2 THR A 144 -5.446 -5.337 -8.946 1.00 0.00 C ATOM 0 H THR A 144 -7.916 -8.673 -8.989 1.00 0.00 H new ATOM 0 HA THR A 144 -5.974 -7.247 -10.682 1.00 0.00 H new ATOM 0 HB THR A 144 -6.520 -6.736 -7.744 1.00 0.00 H new ATOM 0 HG1 THR A 144 -7.905 -4.971 -8.618 1.00 0.00 H new ATOM 0 HG21 THR A 144 -5.659 -4.492 -8.292 1.00 0.00 H new ATOM 0 HG22 THR A 144 -4.478 -5.763 -8.684 1.00 0.00 H new ATOM 0 HG23 THR A 144 -5.425 -4.998 -9.982 1.00 0.00 H new ATOM 2203 N ARG A 145 -3.970 -8.409 -9.784 1.00 0.00 N ATOM 2204 CA ARG A 145 -2.800 -9.150 -9.329 1.00 0.00 C ATOM 2205 C ARG A 145 -1.785 -8.217 -8.676 1.00 0.00 C ATOM 2206 O ARG A 145 -1.301 -7.274 -9.303 1.00 0.00 O ATOM 2207 CB ARG A 145 -2.150 -9.888 -10.501 1.00 0.00 C ATOM 2208 CG ARG A 145 -2.716 -11.280 -10.734 1.00 0.00 C ATOM 2209 CD ARG A 145 -1.641 -12.246 -11.207 1.00 0.00 C ATOM 2210 NE ARG A 145 -1.714 -12.484 -12.646 1.00 0.00 N ATOM 2211 CZ ARG A 145 -0.768 -13.114 -13.335 1.00 0.00 C ATOM 2212 NH1 ARG A 145 0.316 -13.566 -12.720 1.00 0.00 N ATOM 2213 NH2 ARG A 145 -0.907 -13.292 -14.642 1.00 0.00 N ATOM 0 H ARG A 145 -3.831 -7.893 -10.653 1.00 0.00 H new ATOM 0 HA ARG A 145 -3.128 -9.878 -8.587 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -2.278 -9.297 -11.408 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -1.078 -9.966 -10.320 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -3.161 -11.652 -9.811 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -3.514 -11.230 -11.475 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -0.659 -11.847 -10.955 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -1.746 -13.193 -10.677 1.00 0.00 H new ATOM 0 HE ARG A 145 -2.535 -12.149 -13.149 1.00 0.00 H new ATOM 0 HH11 ARG A 145 0.426 -13.431 -11.715 1.00 0.00 H new ATOM 0 HH12 ARG A 145 1.040 -14.049 -13.252 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -1.740 -12.945 -15.118 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -0.181 -13.775 -15.171 1.00 0.00 H new ATOM 2227 N ILE A 146 -1.469 -8.485 -7.414 1.00 0.00 N ATOM 2228 CA ILE A 146 -0.512 -7.670 -6.676 1.00 0.00 C ATOM 2229 C ILE A 146 0.888 -8.270 -6.743 1.00 0.00 C ATOM 2230 O ILE A 146 1.066 -9.477 -6.577 1.00 0.00 O ATOM 2231 CB ILE A 146 -0.923 -7.517 -5.200 1.00 0.00 C ATOM 2232 CG1 ILE A 146 -2.445 -7.427 -5.078 1.00 0.00 C ATOM 2233 CG2 ILE A 146 -0.264 -6.287 -4.592 1.00 0.00 C ATOM 2234 CD1 ILE A 146 -3.051 -6.302 -5.888 1.00 0.00 C ATOM 0 H ILE A 146 -1.862 -9.261 -6.881 1.00 0.00 H new ATOM 0 HA ILE A 146 -0.506 -6.687 -7.147 1.00 0.00 H new ATOM 0 HB ILE A 146 -0.585 -8.396 -4.651 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -2.884 -8.372 -5.399 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -2.710 -7.292 -4.029 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -0.564 -6.192 -3.548 1.00 0.00 H new ATOM 0 HG22 ILE A 146 0.820 -6.389 -4.650 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -0.575 -5.398 -5.141 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -4.133 -6.299 -5.754 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -2.641 -5.350 -5.552 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -2.817 -6.446 -6.943 1.00 0.00 H new ATOM 2246 N SER A 147 1.880 -7.419 -6.986 1.00 0.00 N ATOM 2247 CA SER A 147 3.265 -7.866 -7.076 1.00 0.00 C ATOM 2248 C SER A 147 4.152 -7.083 -6.113 1.00 0.00 C ATOM 2249 O SER A 147 4.995 -7.656 -5.422 1.00 0.00 O ATOM 2250 CB SER A 147 3.782 -7.706 -8.508 1.00 0.00 C ATOM 2251 OG SER A 147 4.315 -6.410 -8.716 1.00 0.00 O ATOM 0 H SER A 147 1.750 -6.417 -7.124 1.00 0.00 H new ATOM 0 HA SER A 147 3.300 -8.920 -6.800 1.00 0.00 H new ATOM 0 HB2 SER A 147 4.549 -8.454 -8.707 1.00 0.00 H new ATOM 0 HB3 SER A 147 2.971 -7.886 -9.213 1.00 0.00 H new ATOM 0 HG SER A 147 4.077 -6.099 -9.614 1.00 0.00 H new ATOM 2257 N TYR A 148 3.957 -5.769 -6.074 1.00 0.00 N ATOM 2258 CA TYR A 148 4.740 -4.906 -5.198 1.00 0.00 C ATOM 2259 C TYR A 148 3.837 -3.950 -4.426 1.00 0.00 C ATOM 2260 O TYR A 148 3.078 -3.181 -5.016 1.00 0.00 O ATOM 2261 CB TYR A 148 5.764 -4.113 -6.012 1.00 0.00 C ATOM 2262 CG TYR A 148 6.830 -3.454 -5.166 1.00 0.00 C ATOM 2263 CD1 TYR A 148 7.453 -4.145 -4.135 1.00 0.00 C ATOM 2264 CD2 TYR A 148 7.216 -2.140 -5.400 1.00 0.00 C ATOM 2265 CE1 TYR A 148 8.427 -3.547 -3.359 1.00 0.00 C ATOM 2266 CE2 TYR A 148 8.191 -1.534 -4.631 1.00 0.00 C ATOM 2267 CZ TYR A 148 8.792 -2.241 -3.611 1.00 0.00 C ATOM 2268 OH TYR A 148 9.763 -1.642 -2.842 1.00 0.00 O ATOM 0 H TYR A 148 3.263 -5.279 -6.639 1.00 0.00 H new ATOM 0 HA TYR A 148 5.265 -5.538 -4.482 1.00 0.00 H new ATOM 0 HB2 TYR A 148 6.242 -4.781 -6.729 1.00 0.00 H new ATOM 0 HB3 TYR A 148 5.244 -3.347 -6.588 1.00 0.00 H new ATOM 0 HD1 TYR A 148 7.171 -5.168 -3.936 1.00 0.00 H new ATOM 0 HD2 TYR A 148 6.746 -1.583 -6.197 1.00 0.00 H new ATOM 0 HE1 TYR A 148 8.900 -4.099 -2.560 1.00 0.00 H new ATOM 0 HE2 TYR A 148 8.481 -0.512 -4.828 1.00 0.00 H new ATOM 0 HH TYR A 148 9.903 -0.722 -3.150 1.00 0.00 H new ATOM 2278 N PHE A 149 3.925 -4.004 -3.101 1.00 0.00 N ATOM 2279 CA PHE A 149 3.116 -3.143 -2.245 1.00 0.00 C ATOM 2280 C PHE A 149 3.934 -2.625 -1.066 1.00 0.00 C ATOM 2281 O PHE A 149 4.606 -3.392 -0.376 1.00 0.00 O ATOM 2282 CB PHE A 149 1.890 -3.903 -1.735 1.00 0.00 C ATOM 2283 CG PHE A 149 1.252 -3.272 -0.531 1.00 0.00 C ATOM 2284 CD1 PHE A 149 0.907 -1.930 -0.536 1.00 0.00 C ATOM 2285 CD2 PHE A 149 0.997 -4.021 0.607 1.00 0.00 C ATOM 2286 CE1 PHE A 149 0.319 -1.347 0.570 1.00 0.00 C ATOM 2287 CE2 PHE A 149 0.409 -3.443 1.716 1.00 0.00 C ATOM 2288 CZ PHE A 149 0.071 -2.104 1.698 1.00 0.00 C ATOM 0 H PHE A 149 4.548 -4.635 -2.597 1.00 0.00 H new ATOM 0 HA PHE A 149 2.786 -2.290 -2.838 1.00 0.00 H new ATOM 0 HB2 PHE A 149 1.153 -3.967 -2.535 1.00 0.00 H new ATOM 0 HB3 PHE A 149 2.182 -4.924 -1.489 1.00 0.00 H new ATOM 0 HD1 PHE A 149 1.100 -1.333 -1.415 1.00 0.00 H new ATOM 0 HD2 PHE A 149 1.261 -5.068 0.627 1.00 0.00 H new ATOM 0 HE1 PHE A 149 0.054 -0.300 0.552 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.214 -4.038 2.596 1.00 0.00 H new ATOM 0 HZ PHE A 149 -0.386 -1.650 2.565 1.00 0.00 H new ATOM 2298 N THR A 150 3.872 -1.316 -0.840 1.00 0.00 N ATOM 2299 CA THR A 150 4.607 -0.694 0.253 1.00 0.00 C ATOM 2300 C THR A 150 4.139 0.738 0.486 1.00 0.00 C ATOM 2301 O THR A 150 3.333 1.270 -0.278 1.00 0.00 O ATOM 2302 CB THR A 150 6.123 -0.688 -0.020 1.00 0.00 C ATOM 2303 OG1 THR A 150 6.841 -0.506 1.205 1.00 0.00 O ATOM 2304 CG2 THR A 150 6.492 0.417 -0.999 1.00 0.00 C ATOM 0 H THR A 150 3.320 -0.667 -1.400 1.00 0.00 H new ATOM 0 HA THR A 150 4.408 -1.288 1.145 1.00 0.00 H new ATOM 0 HB THR A 150 6.394 -1.648 -0.460 1.00 0.00 H new ATOM 0 HG1 THR A 150 7.482 -1.239 1.321 1.00 0.00 H new ATOM 0 HG21 THR A 150 7.567 0.402 -1.176 1.00 0.00 H new ATOM 0 HG22 THR A 150 5.967 0.259 -1.941 1.00 0.00 H new ATOM 0 HG23 THR A 150 6.207 1.383 -0.582 1.00 0.00 H new ATOM 2312 N PHE A 151 4.648 1.358 1.545 1.00 0.00 N ATOM 2313 CA PHE A 151 4.282 2.730 1.878 1.00 0.00 C ATOM 2314 C PHE A 151 5.514 3.628 1.920 1.00 0.00 C ATOM 2315 O PHE A 151 6.426 3.412 2.720 1.00 0.00 O ATOM 2316 CB PHE A 151 3.559 2.773 3.226 1.00 0.00 C ATOM 2317 CG PHE A 151 2.067 2.897 3.103 1.00 0.00 C ATOM 2318 CD1 PHE A 151 1.498 4.008 2.503 1.00 0.00 C ATOM 2319 CD2 PHE A 151 1.234 1.902 3.589 1.00 0.00 C ATOM 2320 CE1 PHE A 151 0.125 4.124 2.387 1.00 0.00 C ATOM 2321 CE2 PHE A 151 -0.139 2.012 3.476 1.00 0.00 C ATOM 2322 CZ PHE A 151 -0.694 3.125 2.876 1.00 0.00 C ATOM 0 H PHE A 151 5.316 0.932 2.188 1.00 0.00 H new ATOM 0 HA PHE A 151 3.613 3.100 1.101 1.00 0.00 H new ATOM 0 HB2 PHE A 151 3.795 1.868 3.785 1.00 0.00 H new ATOM 0 HB3 PHE A 151 3.939 3.614 3.806 1.00 0.00 H new ATOM 0 HD1 PHE A 151 2.134 4.793 2.121 1.00 0.00 H new ATOM 0 HD2 PHE A 151 1.663 1.031 4.062 1.00 0.00 H new ATOM 0 HE1 PHE A 151 -0.306 4.994 1.915 1.00 0.00 H new ATOM 0 HE2 PHE A 151 -0.777 1.228 3.857 1.00 0.00 H new ATOM 0 HZ PHE A 151 -1.767 3.214 2.789 1.00 0.00 H new ATOM 2332 N ILE A 152 5.535 4.634 1.052 1.00 0.00 N ATOM 2333 CA ILE A 152 6.655 5.565 0.990 1.00 0.00 C ATOM 2334 C ILE A 152 6.443 6.744 1.933 1.00 0.00 C ATOM 2335 O ILE A 152 5.389 7.378 1.924 1.00 0.00 O ATOM 2336 CB ILE A 152 6.866 6.097 -0.440 1.00 0.00 C ATOM 2337 CG1 ILE A 152 6.848 4.943 -1.445 1.00 0.00 C ATOM 2338 CG2 ILE A 152 8.176 6.865 -0.531 1.00 0.00 C ATOM 2339 CD1 ILE A 152 7.895 3.886 -1.170 1.00 0.00 C ATOM 0 H ILE A 152 4.790 4.825 0.382 1.00 0.00 H new ATOM 0 HA ILE A 152 7.542 5.012 1.298 1.00 0.00 H new ATOM 0 HB ILE A 152 6.050 6.778 -0.683 1.00 0.00 H new ATOM 0 HG12 ILE A 152 5.862 4.478 -1.434 1.00 0.00 H new ATOM 0 HG13 ILE A 152 7.001 5.342 -2.448 1.00 0.00 H new ATOM 0 HG21 ILE A 152 8.311 7.235 -1.547 1.00 0.00 H new ATOM 0 HG22 ILE A 152 8.153 7.707 0.161 1.00 0.00 H new ATOM 0 HG23 ILE A 152 9.004 6.205 -0.272 1.00 0.00 H new ATOM 0 HD11 ILE A 152 7.824 3.099 -1.921 1.00 0.00 H new ATOM 0 HD12 ILE A 152 8.887 4.337 -1.210 1.00 0.00 H new ATOM 0 HD13 ILE A 152 7.730 3.459 -0.181 1.00 0.00 H new ATOM 2351 N GLY A 153 7.455 7.035 2.746 1.00 0.00 N ATOM 2352 CA GLY A 153 7.360 8.139 3.683 1.00 0.00 C ATOM 2353 C GLY A 153 8.481 8.132 4.703 1.00 0.00 C ATOM 2354 O GLY A 153 9.627 7.823 4.375 1.00 0.00 O ATOM 0 H GLY A 153 8.338 6.526 2.772 1.00 0.00 H new ATOM 0 HA2 GLY A 153 7.379 9.080 3.134 1.00 0.00 H new ATOM 0 HA3 GLY A 153 6.402 8.091 4.200 1.00 0.00 H new ATOM 2358 N THR A 154 8.152 8.474 5.944 1.00 0.00 N ATOM 2359 CA THR A 154 9.140 8.509 7.015 1.00 0.00 C ATOM 2360 C THR A 154 8.468 8.543 8.383 1.00 0.00 C ATOM 2361 O THR A 154 7.313 8.945 8.524 1.00 0.00 O ATOM 2362 CB THR A 154 10.070 9.729 6.882 1.00 0.00 C ATOM 2363 OG1 THR A 154 10.312 10.304 8.171 1.00 0.00 O ATOM 2364 CG2 THR A 154 9.461 10.776 5.961 1.00 0.00 C ATOM 0 H THR A 154 7.208 8.731 6.233 1.00 0.00 H new ATOM 0 HA THR A 154 9.733 7.598 6.927 1.00 0.00 H new ATOM 0 HB THR A 154 11.013 9.393 6.451 1.00 0.00 H new ATOM 0 HG1 THR A 154 10.905 11.078 8.078 1.00 0.00 H new ATOM 0 HG21 THR A 154 10.136 11.628 5.883 1.00 0.00 H new ATOM 0 HG22 THR A 154 9.305 10.344 4.972 1.00 0.00 H new ATOM 0 HG23 THR A 154 8.505 11.106 6.367 1.00 0.00 H new ATOM 2372 N PRO A 155 9.205 8.112 9.417 1.00 0.00 N ATOM 2373 CA PRO A 155 8.700 8.085 10.793 1.00 0.00 C ATOM 2374 C PRO A 155 8.526 9.484 11.374 1.00 0.00 C ATOM 2375 O PRO A 155 9.383 10.350 11.199 1.00 0.00 O ATOM 2376 CB PRO A 155 9.787 7.321 11.554 1.00 0.00 C ATOM 2377 CG PRO A 155 11.028 7.533 10.758 1.00 0.00 C ATOM 2378 CD PRO A 155 10.589 7.618 9.322 1.00 0.00 C ATOM 0 HA PRO A 155 7.713 7.626 10.857 1.00 0.00 H new ATOM 0 HB2 PRO A 155 9.899 7.699 12.570 1.00 0.00 H new ATOM 0 HB3 PRO A 155 9.544 6.261 11.634 1.00 0.00 H new ATOM 0 HG2 PRO A 155 11.537 8.446 11.065 1.00 0.00 H new ATOM 0 HG3 PRO A 155 11.730 6.712 10.904 1.00 0.00 H new ATOM 0 HD2 PRO A 155 11.220 8.297 8.749 1.00 0.00 H new ATOM 0 HD3 PRO A 155 10.636 6.647 8.829 1.00 0.00 H new ATOM 2386 N VAL A 156 7.412 9.697 12.066 1.00 0.00 N ATOM 2387 CA VAL A 156 7.126 10.991 12.675 1.00 0.00 C ATOM 2388 C VAL A 156 8.306 11.480 13.507 1.00 0.00 C ATOM 2389 O VAL A 156 8.553 12.681 13.605 1.00 0.00 O ATOM 2390 CB VAL A 156 5.873 10.927 13.569 1.00 0.00 C ATOM 2391 CG1 VAL A 156 4.652 10.539 12.749 1.00 0.00 C ATOM 2392 CG2 VAL A 156 6.088 9.951 14.716 1.00 0.00 C ATOM 0 H VAL A 156 6.692 8.990 12.219 1.00 0.00 H new ATOM 0 HA VAL A 156 6.945 11.691 11.859 1.00 0.00 H new ATOM 0 HB VAL A 156 5.697 11.916 13.992 1.00 0.00 H new ATOM 0 HG11 VAL A 156 3.776 10.499 13.397 1.00 0.00 H new ATOM 0 HG12 VAL A 156 4.490 11.279 11.965 1.00 0.00 H new ATOM 0 HG13 VAL A 156 4.814 9.561 12.296 1.00 0.00 H new ATOM 0 HG21 VAL A 156 5.193 9.918 15.338 1.00 0.00 H new ATOM 0 HG22 VAL A 156 6.289 8.957 14.315 1.00 0.00 H new ATOM 0 HG23 VAL A 156 6.936 10.278 15.318 1.00 0.00 H new ATOM 2402 N GLN A 157 9.032 10.540 14.103 1.00 0.00 N ATOM 2403 CA GLN A 157 10.187 10.875 14.927 1.00 0.00 C ATOM 2404 C GLN A 157 11.051 9.644 15.181 1.00 0.00 C ATOM 2405 O GLN A 157 10.628 8.705 15.853 1.00 0.00 O ATOM 2406 CB GLN A 157 9.733 11.477 16.258 1.00 0.00 C ATOM 2407 CG GLN A 157 8.770 10.589 17.030 1.00 0.00 C ATOM 2408 CD GLN A 157 7.918 11.369 18.012 1.00 0.00 C ATOM 2409 OE1 GLN A 157 8.283 12.466 18.434 1.00 0.00 O ATOM 2410 NE2 GLN A 157 6.774 10.804 18.381 1.00 0.00 N ATOM 0 H GLN A 157 8.841 9.541 14.031 1.00 0.00 H new ATOM 0 HA GLN A 157 10.784 11.610 14.388 1.00 0.00 H new ATOM 0 HB2 GLN A 157 10.609 11.673 16.876 1.00 0.00 H new ATOM 0 HB3 GLN A 157 9.255 12.438 16.068 1.00 0.00 H new ATOM 0 HG2 GLN A 157 8.121 10.066 16.327 1.00 0.00 H new ATOM 0 HG3 GLN A 157 9.335 9.829 17.569 1.00 0.00 H new ATOM 0 HE21 GLN A 157 6.511 9.893 18.006 1.00 0.00 H new ATOM 0 HE22 GLN A 157 6.159 11.281 19.040 1.00 0.00 H new