USER MOD reduce.3.24.130724 H: found=0, std=0, add=882, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 883 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 69 SER OG : rot 91:sc= 1.24 USER MOD Set 1.2: A 131 CYS SG : rot 180:sc= 1.02 USER MOD Set 2.1: A 121 ASN : amide:sc= -0.0974 K(o=-0.29,f=-6.9!) USER MOD Set 2.2: A 137 TYR OH : rot 180:sc= -0.189 USER MOD Set 3.1: A 77 HIS : no HE2:sc= -6.62! C(o=-9.6!,f=-11!) USER MOD Set 3.2: A 101 SER OG : rot 75:sc= -2.94 USER MOD Set 3.3: A 105 THR OG1 : rot -69:sc= -0.0265 USER MOD Set 4.1: A 33 CYS SG : rot 180:sc= -1.16 USER MOD Set 4.2: A 36 HIS : no HD1:sc= -3.44 K(o=-4.6,f=-7.4!) USER MOD Set 5.1: A 32 THR OG1 : rot 84:sc= 0.904 USER MOD Set 5.2: A 52 ASN :FLIP amide:sc= 0.234 F(o=0.2,f=1.1) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -6.35! C(o=-6.4!,f=-8!) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.0119 USER MOD Single : A 54 ASN : amide:sc= -0.147 K(o=-0.15,f=-1.9!) USER MOD Single : A 56 THR OG1 : rot 72:sc= 0.971 USER MOD Single : A 57 THR OG1 : rot -160:sc= -1.03 USER MOD Single : A 61 SER OG : rot 180:sc= -0.137 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 CYS SG : rot 180:sc= -2.89 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 HIS : no HD1:sc= -0.187 X(o=-0.19,f=-0.00028) USER MOD Single : A 84 GLN : amide:sc= -0.448 X(o=-0.45,f=0) USER MOD Single : A 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc=-0.00606 X(o=-0.0061,f=-0.0061) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 ASN :FLIP amide:sc= -0.321 F(o=-2.2,f=-0.32) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 ASN : amide:sc= -0.158 K(o=-0.16,f=-0.74) USER MOD Single : A 108 ASN :FLIP amide:sc=-0.00602 F(o=-1.9,f=-0.006) USER MOD Single : A 110 ASN : amide:sc= -0.415 X(o=-0.42,f=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ -169:sc= -1.18 (180deg=-1.59) USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 63:sc= 1.03 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 203 N TYR A 31 11.629 -2.340 1.871 1.00 0.00 N ATOM 204 CA TYR A 31 11.077 -1.321 0.988 1.00 0.00 C ATOM 205 C TYR A 31 10.450 -0.182 1.804 1.00 0.00 C ATOM 206 O TYR A 31 11.124 0.430 2.632 1.00 0.00 O ATOM 207 CB TYR A 31 10.055 -1.959 0.040 1.00 0.00 C ATOM 208 CG TYR A 31 10.671 -2.905 -0.965 1.00 0.00 C ATOM 209 CD1 TYR A 31 11.759 -2.518 -1.737 1.00 0.00 C ATOM 210 CD2 TYR A 31 10.163 -4.186 -1.142 1.00 0.00 C ATOM 211 CE1 TYR A 31 12.324 -3.381 -2.656 1.00 0.00 C ATOM 212 CE2 TYR A 31 10.722 -5.055 -2.060 1.00 0.00 C ATOM 213 CZ TYR A 31 11.802 -4.648 -2.813 1.00 0.00 C ATOM 214 OH TYR A 31 12.362 -5.510 -3.728 1.00 0.00 O ATOM 0 HA TYR A 31 11.880 -0.890 0.389 1.00 0.00 H new ATOM 0 HB2 TYR A 31 9.314 -2.500 0.629 1.00 0.00 H new ATOM 0 HB3 TYR A 31 9.525 -1.170 -0.493 1.00 0.00 H new ATOM 0 HD1 TYR A 31 12.170 -1.526 -1.617 1.00 0.00 H new ATOM 0 HD2 TYR A 31 9.317 -4.508 -0.553 1.00 0.00 H new ATOM 0 HE1 TYR A 31 13.170 -3.065 -3.248 1.00 0.00 H new ATOM 0 HE2 TYR A 31 10.315 -6.047 -2.186 1.00 0.00 H new ATOM 0 HH TYR A 31 11.878 -6.362 -3.714 1.00 0.00 H new ATOM 224 N THR A 32 9.165 0.101 1.578 1.00 0.00 N ATOM 225 CA THR A 32 8.480 1.163 2.306 1.00 0.00 C ATOM 226 C THR A 32 7.060 0.735 2.663 1.00 0.00 C ATOM 227 O THR A 32 6.311 0.264 1.808 1.00 0.00 O ATOM 228 CB THR A 32 8.447 2.449 1.476 1.00 0.00 C ATOM 229 OG1 THR A 32 9.316 2.352 0.361 1.00 0.00 O ATOM 230 CG2 THR A 32 8.849 3.678 2.263 1.00 0.00 C ATOM 0 H THR A 32 8.583 -0.390 0.899 1.00 0.00 H new ATOM 0 HA THR A 32 9.031 1.355 3.227 1.00 0.00 H new ATOM 0 HB THR A 32 7.410 2.560 1.159 1.00 0.00 H new ATOM 0 HG1 THR A 32 8.856 1.895 -0.374 1.00 0.00 H new ATOM 0 HG21 THR A 32 8.804 4.555 1.617 1.00 0.00 H new ATOM 0 HG22 THR A 32 8.167 3.811 3.103 1.00 0.00 H new ATOM 0 HG23 THR A 32 9.865 3.554 2.637 1.00 0.00 H new ATOM 238 N CYS A 33 6.699 0.896 3.929 1.00 0.00 N ATOM 239 CA CYS A 33 5.371 0.520 4.395 1.00 0.00 C ATOM 240 C CYS A 33 4.290 1.297 3.651 1.00 0.00 C ATOM 241 O CYS A 33 4.445 2.486 3.371 1.00 0.00 O ATOM 242 CB CYS A 33 5.245 0.766 5.898 1.00 0.00 C ATOM 243 SG CYS A 33 4.108 -0.361 6.738 1.00 0.00 S ATOM 0 H CYS A 33 7.306 1.284 4.651 1.00 0.00 H new ATOM 0 HA CYS A 33 5.233 -0.542 4.194 1.00 0.00 H new ATOM 0 HB2 CYS A 33 6.231 0.676 6.354 1.00 0.00 H new ATOM 0 HB3 CYS A 33 4.910 1.791 6.061 1.00 0.00 H new ATOM 0 HG CYS A 33 4.071 -0.075 8.006 1.00 0.00 H new ATOM 249 N LEU A 34 3.194 0.615 3.334 1.00 0.00 N ATOM 250 CA LEU A 34 2.084 1.237 2.622 1.00 0.00 C ATOM 251 C LEU A 34 0.747 0.797 3.212 1.00 0.00 C ATOM 252 O LEU A 34 -0.141 1.616 3.443 1.00 0.00 O ATOM 253 CB LEU A 34 2.144 0.885 1.134 1.00 0.00 C ATOM 254 CG LEU A 34 2.010 2.074 0.182 1.00 0.00 C ATOM 255 CD1 LEU A 34 3.240 2.964 0.265 1.00 0.00 C ATOM 256 CD2 LEU A 34 1.793 1.592 -1.245 1.00 0.00 C ATOM 0 H LEU A 34 3.051 -0.369 3.559 1.00 0.00 H new ATOM 0 HA LEU A 34 2.170 2.318 2.734 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.090 0.383 0.933 1.00 0.00 H new ATOM 0 HB3 LEU A 34 1.351 0.171 0.913 1.00 0.00 H new ATOM 0 HG LEU A 34 1.142 2.660 0.482 1.00 0.00 H new ATOM 0 HD11 LEU A 34 3.127 3.805 -0.419 1.00 0.00 H new ATOM 0 HD12 LEU A 34 3.351 3.337 1.283 1.00 0.00 H new ATOM 0 HD13 LEU A 34 4.124 2.389 -0.009 1.00 0.00 H new ATOM 0 HD21 LEU A 34 1.700 2.451 -1.909 1.00 0.00 H new ATOM 0 HD22 LEU A 34 2.642 0.983 -1.556 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.882 0.996 -1.293 1.00 0.00 H new ATOM 268 N GLY A 35 0.612 -0.503 3.453 1.00 0.00 N ATOM 269 CA GLY A 35 -0.617 -1.033 4.013 1.00 0.00 C ATOM 270 C GLY A 35 -0.422 -2.390 4.657 1.00 0.00 C ATOM 271 O GLY A 35 0.702 -2.883 4.751 1.00 0.00 O ATOM 0 H GLY A 35 1.334 -1.200 3.270 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -1.006 -0.335 4.754 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -1.367 -1.112 3.226 1.00 0.00 H new ATOM 275 N HIS A 36 -1.517 -2.997 5.101 1.00 0.00 N ATOM 276 CA HIS A 36 -1.452 -4.307 5.737 1.00 0.00 C ATOM 277 C HIS A 36 -2.659 -5.159 5.358 1.00 0.00 C ATOM 278 O HIS A 36 -3.694 -4.640 4.937 1.00 0.00 O ATOM 279 CB HIS A 36 -1.379 -4.165 7.259 1.00 0.00 C ATOM 280 CG HIS A 36 -0.131 -3.497 7.742 1.00 0.00 C ATOM 281 ND1 HIS A 36 0.166 -2.175 7.485 1.00 0.00 N ATOM 282 CD2 HIS A 36 0.898 -3.975 8.479 1.00 0.00 C ATOM 283 CE1 HIS A 36 1.325 -1.870 8.041 1.00 0.00 C ATOM 284 NE2 HIS A 36 1.790 -2.945 8.650 1.00 0.00 N ATOM 0 H HIS A 36 -2.456 -2.605 5.033 1.00 0.00 H new ATOM 0 HA HIS A 36 -0.549 -4.803 5.382 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -2.242 -3.595 7.604 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -1.449 -5.154 7.711 1.00 0.00 H new ATOM 0 HD2 HIS A 36 0.999 -4.980 8.862 1.00 0.00 H new ATOM 0 HE1 HIS A 36 1.810 -0.905 8.004 1.00 0.00 H new ATOM 0 HE2 HIS A 36 2.669 -3.001 9.164 1.00 0.00 H new ATOM 293 N LEU A 37 -2.519 -6.470 5.520 1.00 0.00 N ATOM 294 CA LEU A 37 -3.592 -7.403 5.204 1.00 0.00 C ATOM 295 C LEU A 37 -3.874 -8.318 6.393 1.00 0.00 C ATOM 296 O LEU A 37 -3.074 -9.197 6.714 1.00 0.00 O ATOM 297 CB LEU A 37 -3.230 -8.239 3.974 1.00 0.00 C ATOM 298 CG LEU A 37 -1.751 -8.616 3.856 1.00 0.00 C ATOM 299 CD1 LEU A 37 -1.600 -10.010 3.265 1.00 0.00 C ATOM 300 CD2 LEU A 37 -1.008 -7.593 3.009 1.00 0.00 C ATOM 0 H LEU A 37 -1.669 -6.911 5.870 1.00 0.00 H new ATOM 0 HA LEU A 37 -4.491 -6.827 4.985 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -3.822 -9.154 3.989 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -3.520 -7.686 3.080 1.00 0.00 H new ATOM 0 HG LEU A 37 -1.315 -8.619 4.855 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -0.542 -10.260 3.189 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.099 -10.734 3.909 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -2.051 -10.035 2.273 1.00 0.00 H new ATOM 0 HD21 LEU A 37 0.042 -7.876 2.935 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.446 -7.560 2.011 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -1.087 -6.610 3.473 1.00 0.00 H new ATOM 312 N VAL A 38 -5.011 -8.102 7.047 1.00 0.00 N ATOM 313 CA VAL A 38 -5.390 -8.906 8.203 1.00 0.00 C ATOM 314 C VAL A 38 -6.395 -9.987 7.821 1.00 0.00 C ATOM 315 O VAL A 38 -7.475 -9.691 7.309 1.00 0.00 O ATOM 316 CB VAL A 38 -5.993 -8.033 9.320 1.00 0.00 C ATOM 317 CG1 VAL A 38 -6.225 -8.856 10.579 1.00 0.00 C ATOM 318 CG2 VAL A 38 -5.095 -6.841 9.612 1.00 0.00 C ATOM 0 H VAL A 38 -5.685 -7.378 6.797 1.00 0.00 H new ATOM 0 HA VAL A 38 -4.478 -9.378 8.570 1.00 0.00 H new ATOM 0 HB VAL A 38 -6.957 -7.657 8.978 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -6.651 -8.221 11.356 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -6.914 -9.672 10.359 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -5.276 -9.266 10.926 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -5.538 -6.237 10.404 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -4.114 -7.194 9.931 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -4.988 -6.237 8.711 1.00 0.00 H new ATOM 328 N ASN A 39 -6.033 -11.239 8.076 1.00 0.00 N ATOM 329 CA ASN A 39 -6.903 -12.367 7.764 1.00 0.00 C ATOM 330 C ASN A 39 -7.810 -12.693 8.946 1.00 0.00 C ATOM 331 O ASN A 39 -7.350 -12.801 10.082 1.00 0.00 O ATOM 332 CB ASN A 39 -6.070 -13.594 7.390 1.00 0.00 C ATOM 333 CG ASN A 39 -5.357 -13.427 6.063 1.00 0.00 C ATOM 334 OD1 ASN A 39 -5.869 -13.823 5.016 1.00 0.00 O ATOM 335 ND2 ASN A 39 -4.168 -12.838 6.100 1.00 0.00 N ATOM 0 H ASN A 39 -5.142 -11.499 8.499 1.00 0.00 H new ATOM 0 HA ASN A 39 -7.527 -12.090 6.914 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -5.335 -13.783 8.173 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -6.718 -14.469 7.343 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -3.641 -12.698 5.238 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -3.781 -12.525 6.991 1.00 0.00 H new ATOM 342 N LEU A 40 -9.102 -12.849 8.672 1.00 0.00 N ATOM 343 CA LEU A 40 -10.070 -13.163 9.716 1.00 0.00 C ATOM 344 C LEU A 40 -10.365 -14.658 9.755 1.00 0.00 C ATOM 345 O LEU A 40 -11.048 -15.189 8.879 1.00 0.00 O ATOM 346 CB LEU A 40 -11.366 -12.381 9.490 1.00 0.00 C ATOM 347 CG LEU A 40 -11.370 -10.959 10.055 1.00 0.00 C ATOM 348 CD1 LEU A 40 -11.119 -9.945 8.949 1.00 0.00 C ATOM 349 CD2 LEU A 40 -12.686 -10.666 10.758 1.00 0.00 C ATOM 0 H LEU A 40 -9.501 -12.763 7.737 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.640 -12.872 10.674 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -11.560 -12.331 8.419 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -12.190 -12.936 9.938 1.00 0.00 H new ATOM 0 HG LEU A 40 -10.565 -10.878 10.786 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -11.125 -8.939 9.369 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -10.150 -10.140 8.489 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -11.902 -10.028 8.195 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -12.669 -9.650 11.153 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -13.508 -10.766 10.049 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -12.826 -11.371 11.577 1.00 0.00 H new ATOM 361 N ILE A 41 -9.847 -15.331 10.778 1.00 0.00 N ATOM 362 CA ILE A 41 -10.056 -16.766 10.935 1.00 0.00 C ATOM 363 C ILE A 41 -10.688 -17.082 12.290 1.00 0.00 C ATOM 364 O ILE A 41 -10.266 -16.547 13.316 1.00 0.00 O ATOM 365 CB ILE A 41 -8.734 -17.542 10.799 1.00 0.00 C ATOM 366 CG1 ILE A 41 -7.975 -17.079 9.557 1.00 0.00 C ATOM 367 CG2 ILE A 41 -9.001 -19.038 10.732 1.00 0.00 C ATOM 368 CD1 ILE A 41 -8.753 -17.249 8.271 1.00 0.00 C ATOM 0 H ILE A 41 -9.279 -14.905 11.511 1.00 0.00 H new ATOM 0 HA ILE A 41 -10.733 -17.080 10.141 1.00 0.00 H new ATOM 0 HB ILE A 41 -8.120 -17.341 11.677 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -7.710 -16.028 9.675 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -7.042 -17.637 9.483 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -8.056 -19.572 10.636 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -9.508 -19.358 11.642 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -9.631 -19.257 9.870 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -8.151 -16.899 7.432 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -8.996 -18.302 8.129 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -9.674 -16.668 8.323 1.00 0.00 H new ATOM 380 N PRO A 42 -11.715 -17.950 12.315 1.00 0.00 N ATOM 381 CA PRO A 42 -12.403 -18.323 13.557 1.00 0.00 C ATOM 382 C PRO A 42 -11.438 -18.770 14.653 1.00 0.00 C ATOM 383 O PRO A 42 -11.746 -18.673 15.840 1.00 0.00 O ATOM 384 CB PRO A 42 -13.303 -19.484 13.130 1.00 0.00 C ATOM 385 CG PRO A 42 -13.550 -19.252 11.680 1.00 0.00 C ATOM 386 CD PRO A 42 -12.290 -18.634 11.140 1.00 0.00 C ATOM 0 HA PRO A 42 -12.944 -17.480 13.988 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -12.818 -20.445 13.301 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -14.235 -19.492 13.695 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -13.777 -20.187 11.168 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -14.404 -18.592 11.530 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -11.611 -19.388 10.742 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -12.500 -17.935 10.331 1.00 0.00 H new ATOM 394 N GLY A 43 -10.273 -19.263 14.247 1.00 0.00 N ATOM 395 CA GLY A 43 -9.286 -19.719 15.208 1.00 0.00 C ATOM 396 C GLY A 43 -8.378 -18.602 15.686 1.00 0.00 C ATOM 397 O GLY A 43 -7.853 -18.655 16.798 1.00 0.00 O ATOM 0 H GLY A 43 -9.995 -19.355 13.270 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -9.795 -20.160 16.065 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -8.681 -20.506 14.757 1.00 0.00 H new ATOM 401 N LYS A 44 -8.193 -17.587 14.846 1.00 0.00 N ATOM 402 CA LYS A 44 -7.345 -16.453 15.188 1.00 0.00 C ATOM 403 C LYS A 44 -7.236 -15.481 14.016 1.00 0.00 C ATOM 404 O LYS A 44 -7.981 -15.583 13.041 1.00 0.00 O ATOM 405 CB LYS A 44 -5.950 -16.930 15.605 1.00 0.00 C ATOM 406 CG LYS A 44 -5.450 -16.294 16.891 1.00 0.00 C ATOM 407 CD LYS A 44 -4.217 -17.008 17.422 1.00 0.00 C ATOM 408 CE LYS A 44 -3.950 -16.652 18.875 1.00 0.00 C ATOM 409 NZ LYS A 44 -3.363 -15.291 19.015 1.00 0.00 N ATOM 0 H LYS A 44 -8.621 -17.528 13.922 1.00 0.00 H new ATOM 0 HA LYS A 44 -7.805 -15.932 16.028 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -5.967 -18.013 15.728 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -5.245 -16.711 14.803 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -5.215 -15.245 16.712 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -6.239 -16.321 17.642 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -4.351 -18.086 17.329 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -3.351 -16.741 16.816 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -4.881 -16.705 19.439 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -3.272 -17.386 19.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -3.196 -15.087 20.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -2.461 -15.247 18.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -4.021 -14.587 18.623 1.00 0.00 H new ATOM 423 N GLU A 45 -6.301 -14.541 14.119 1.00 0.00 N ATOM 424 CA GLU A 45 -6.093 -13.551 13.068 1.00 0.00 C ATOM 425 C GLU A 45 -4.613 -13.445 12.711 1.00 0.00 C ATOM 426 O GLU A 45 -3.750 -13.917 13.450 1.00 0.00 O ATOM 427 CB GLU A 45 -6.622 -12.187 13.512 1.00 0.00 C ATOM 428 CG GLU A 45 -8.045 -12.231 14.046 1.00 0.00 C ATOM 429 CD GLU A 45 -8.711 -10.869 14.043 1.00 0.00 C ATOM 430 OE1 GLU A 45 -8.573 -10.143 13.035 1.00 0.00 O ATOM 431 OE2 GLU A 45 -9.370 -10.528 15.047 1.00 0.00 O ATOM 0 H GLU A 45 -5.676 -14.444 14.919 1.00 0.00 H new ATOM 0 HA GLU A 45 -6.641 -13.873 12.183 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -5.965 -11.786 14.284 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -6.580 -11.498 12.668 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -8.635 -12.921 13.442 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -8.036 -12.625 15.062 1.00 0.00 H new ATOM 438 N GLN A 46 -4.328 -12.820 11.573 1.00 0.00 N ATOM 439 CA GLN A 46 -2.952 -12.652 11.119 1.00 0.00 C ATOM 440 C GLN A 46 -2.800 -11.376 10.297 1.00 0.00 C ATOM 441 O GLN A 46 -3.419 -11.227 9.243 1.00 0.00 O ATOM 442 CB GLN A 46 -2.515 -13.864 10.292 1.00 0.00 C ATOM 443 CG GLN A 46 -1.327 -14.607 10.884 1.00 0.00 C ATOM 444 CD GLN A 46 -1.579 -16.095 11.023 1.00 0.00 C ATOM 445 OE1 GLN A 46 -1.664 -16.622 12.132 1.00 0.00 O ATOM 446 NE2 GLN A 46 -1.700 -16.783 9.893 1.00 0.00 N ATOM 0 H GLN A 46 -5.030 -12.422 10.949 1.00 0.00 H new ATOM 0 HA GLN A 46 -2.313 -12.571 11.998 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -3.355 -14.553 10.200 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -2.262 -13.534 9.285 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -0.453 -14.448 10.253 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -1.093 -14.189 11.863 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -1.623 -16.306 8.995 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -1.870 -17.788 9.924 1.00 0.00 H new ATOM 455 N LYS A 47 -1.973 -10.457 10.786 1.00 0.00 N ATOM 456 CA LYS A 47 -1.739 -9.194 10.097 1.00 0.00 C ATOM 457 C LYS A 47 -0.346 -9.164 9.476 1.00 0.00 C ATOM 458 O LYS A 47 0.655 -9.365 10.163 1.00 0.00 O ATOM 459 CB LYS A 47 -1.903 -8.021 11.067 1.00 0.00 C ATOM 460 CG LYS A 47 -1.683 -6.663 10.421 1.00 0.00 C ATOM 461 CD LYS A 47 -1.613 -5.557 11.461 1.00 0.00 C ATOM 462 CE LYS A 47 -2.998 -5.070 11.851 1.00 0.00 C ATOM 463 NZ LYS A 47 -3.489 -4.002 10.938 1.00 0.00 N ATOM 0 H LYS A 47 -1.454 -10.564 11.657 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.476 -9.102 9.299 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -2.905 -8.052 11.496 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -1.200 -8.140 11.891 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -0.759 -6.679 9.843 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -2.493 -6.456 9.722 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -1.092 -5.921 12.346 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -1.030 -4.724 11.068 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -3.695 -5.908 11.837 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -2.975 -4.692 12.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -4.437 -3.697 11.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -2.838 -3.191 10.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -3.535 -4.370 9.966 1.00 0.00 H new ATOM 477 N VAL A 48 -0.290 -8.915 8.172 1.00 0.00 N ATOM 478 CA VAL A 48 0.979 -8.860 7.457 1.00 0.00 C ATOM 479 C VAL A 48 1.185 -7.496 6.806 1.00 0.00 C ATOM 480 O VAL A 48 0.260 -6.929 6.225 1.00 0.00 O ATOM 481 CB VAL A 48 1.057 -9.952 6.372 1.00 0.00 C ATOM 482 CG1 VAL A 48 2.438 -9.978 5.735 1.00 0.00 C ATOM 483 CG2 VAL A 48 0.707 -11.313 6.956 1.00 0.00 C ATOM 0 H VAL A 48 -1.110 -8.748 7.589 1.00 0.00 H new ATOM 0 HA VAL A 48 1.766 -9.030 8.192 1.00 0.00 H new ATOM 0 HB VAL A 48 0.329 -9.716 5.596 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.472 -10.756 4.972 1.00 0.00 H new ATOM 0 HG12 VAL A 48 2.646 -9.011 5.277 1.00 0.00 H new ATOM 0 HG13 VAL A 48 3.187 -10.186 6.499 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.768 -12.071 6.175 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.408 -11.558 7.754 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.306 -11.287 7.358 1.00 0.00 H new ATOM 493 N GLU A 49 2.405 -6.977 6.905 1.00 0.00 N ATOM 494 CA GLU A 49 2.735 -5.681 6.323 1.00 0.00 C ATOM 495 C GLU A 49 3.040 -5.820 4.835 1.00 0.00 C ATOM 496 O GLU A 49 3.719 -6.757 4.417 1.00 0.00 O ATOM 497 CB GLU A 49 3.933 -5.063 7.047 1.00 0.00 C ATOM 498 CG GLU A 49 4.205 -3.622 6.649 1.00 0.00 C ATOM 499 CD GLU A 49 5.455 -3.476 5.803 1.00 0.00 C ATOM 500 OE1 GLU A 49 6.450 -4.174 6.089 1.00 0.00 O ATOM 501 OE2 GLU A 49 5.438 -2.664 4.854 1.00 0.00 O ATOM 0 H GLU A 49 3.181 -7.434 7.383 1.00 0.00 H new ATOM 0 HA GLU A 49 1.873 -5.025 6.441 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.760 -5.108 8.122 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.820 -5.662 6.841 1.00 0.00 H new ATOM 0 HG2 GLU A 49 3.349 -3.234 6.096 1.00 0.00 H new ATOM 0 HG3 GLU A 49 4.306 -3.014 7.548 1.00 0.00 H new ATOM 508 N ILE A 50 2.529 -4.885 4.040 1.00 0.00 N ATOM 509 CA ILE A 50 2.747 -4.911 2.598 1.00 0.00 C ATOM 510 C ILE A 50 3.550 -3.697 2.135 1.00 0.00 C ATOM 511 O ILE A 50 3.255 -2.561 2.506 1.00 0.00 O ATOM 512 CB ILE A 50 1.410 -4.971 1.830 1.00 0.00 C ATOM 513 CG1 ILE A 50 1.661 -5.111 0.328 1.00 0.00 C ATOM 514 CG2 ILE A 50 0.562 -3.740 2.122 1.00 0.00 C ATOM 515 CD1 ILE A 50 0.702 -6.061 -0.356 1.00 0.00 C ATOM 0 H ILE A 50 1.963 -4.103 4.369 1.00 0.00 H new ATOM 0 HA ILE A 50 3.318 -5.813 2.379 1.00 0.00 H new ATOM 0 HB ILE A 50 0.860 -5.848 2.170 1.00 0.00 H new ATOM 0 HG12 ILE A 50 1.583 -4.129 -0.139 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.681 -5.459 0.169 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -0.375 -3.805 1.570 1.00 0.00 H new ATOM 0 HG22 ILE A 50 0.351 -3.689 3.190 1.00 0.00 H new ATOM 0 HG23 ILE A 50 1.103 -2.845 1.815 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.937 -6.113 -1.419 1.00 0.00 H new ATOM 0 HD12 ILE A 50 0.796 -7.053 0.085 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -0.319 -5.702 -0.227 1.00 0.00 H new ATOM 527 N THR A 51 4.572 -3.951 1.325 1.00 0.00 N ATOM 528 CA THR A 51 5.427 -2.889 0.810 1.00 0.00 C ATOM 529 C THR A 51 5.149 -2.637 -0.670 1.00 0.00 C ATOM 530 O THR A 51 4.471 -3.426 -1.328 1.00 0.00 O ATOM 531 CB THR A 51 6.898 -3.261 0.999 1.00 0.00 C ATOM 532 OG1 THR A 51 7.052 -4.667 1.068 1.00 0.00 O ATOM 533 CG2 THR A 51 7.509 -2.670 2.249 1.00 0.00 C ATOM 0 H THR A 51 4.829 -4.887 1.010 1.00 0.00 H new ATOM 0 HA THR A 51 5.209 -1.977 1.366 1.00 0.00 H new ATOM 0 HB THR A 51 7.415 -2.848 0.133 1.00 0.00 H new ATOM 0 HG1 THR A 51 8.000 -4.887 1.187 1.00 0.00 H new ATOM 0 HG21 THR A 51 8.553 -2.973 2.322 1.00 0.00 H new ATOM 0 HG22 THR A 51 7.449 -1.583 2.204 1.00 0.00 H new ATOM 0 HG23 THR A 51 6.966 -3.028 3.124 1.00 0.00 H new ATOM 541 N ASN A 52 5.685 -1.536 -1.189 1.00 0.00 N ATOM 542 CA ASN A 52 5.503 -1.186 -2.592 1.00 0.00 C ATOM 543 C ASN A 52 6.360 -2.083 -3.483 1.00 0.00 C ATOM 544 O ASN A 52 7.284 -1.618 -4.150 1.00 0.00 O ATOM 545 CB ASN A 52 5.861 0.283 -2.825 1.00 0.00 C ATOM 546 CG ASN A 52 7.246 0.628 -2.314 1.00 0.00 C ATOM 547 OD1 ASN A 52 7.323 1.056 -1.059 1.00 0.00 O flip ATOM 548 ND2 ASN A 52 8.235 0.510 -3.037 1.00 0.00 N flip ATOM 0 H ASN A 52 6.249 -0.872 -0.658 1.00 0.00 H new ATOM 0 HA ASN A 52 4.455 -1.337 -2.851 1.00 0.00 H new ATOM 0 HB2 ASN A 52 5.805 0.503 -3.891 1.00 0.00 H new ATOM 0 HB3 ASN A 52 5.125 0.917 -2.329 1.00 0.00 H new ATOM 0 HD21 ASN A 52 8.129 0.177 -3.995 1.00 0.00 H new ATOM 0 HD22 ASN A 52 9.160 0.745 -2.678 1.00 0.00 H new ATOM 555 N ARG A 53 6.046 -3.374 -3.480 1.00 0.00 N ATOM 556 CA ARG A 53 6.780 -4.350 -4.276 1.00 0.00 C ATOM 557 C ARG A 53 6.333 -4.350 -5.728 1.00 0.00 C ATOM 558 O ARG A 53 6.843 -5.127 -6.535 1.00 0.00 O ATOM 559 CB ARG A 53 6.605 -5.748 -3.682 1.00 0.00 C ATOM 560 CG ARG A 53 7.658 -6.743 -4.141 1.00 0.00 C ATOM 561 CD ARG A 53 7.214 -8.177 -3.894 1.00 0.00 C ATOM 562 NE ARG A 53 8.345 -9.059 -3.615 1.00 0.00 N ATOM 563 CZ ARG A 53 8.251 -10.385 -3.548 1.00 0.00 C ATOM 564 NH1 ARG A 53 7.082 -10.986 -3.735 1.00 0.00 N ATOM 565 NH2 ARG A 53 9.330 -11.113 -3.291 1.00 0.00 N ATOM 0 H ARG A 53 5.283 -3.770 -2.931 1.00 0.00 H new ATOM 0 HA ARG A 53 7.832 -4.068 -4.252 1.00 0.00 H new ATOM 0 HB2 ARG A 53 6.634 -5.677 -2.595 1.00 0.00 H new ATOM 0 HB3 ARG A 53 5.619 -6.126 -3.951 1.00 0.00 H new ATOM 0 HG2 ARG A 53 7.857 -6.600 -5.203 1.00 0.00 H new ATOM 0 HG3 ARG A 53 8.593 -6.554 -3.614 1.00 0.00 H new ATOM 0 HD2 ARG A 53 6.519 -8.202 -3.055 1.00 0.00 H new ATOM 0 HD3 ARG A 53 6.674 -8.545 -4.766 1.00 0.00 H new ATOM 0 HE ARG A 53 9.260 -8.634 -3.463 1.00 0.00 H new ATOM 0 HH11 ARG A 53 6.249 -10.431 -3.931 1.00 0.00 H new ATOM 0 HH12 ARG A 53 7.017 -12.003 -3.682 1.00 0.00 H new ATOM 0 HH21 ARG A 53 10.230 -10.656 -3.145 1.00 0.00 H new ATOM 0 HH22 ARG A 53 9.259 -12.129 -3.239 1.00 0.00 H new ATOM 579 N ASN A 54 5.370 -3.499 -6.066 1.00 0.00 N ATOM 580 CA ASN A 54 4.862 -3.447 -7.430 1.00 0.00 C ATOM 581 C ASN A 54 4.029 -4.689 -7.719 1.00 0.00 C ATOM 582 O ASN A 54 3.028 -4.625 -8.429 1.00 0.00 O ATOM 583 CB ASN A 54 6.012 -3.338 -8.437 1.00 0.00 C ATOM 584 CG ASN A 54 5.560 -2.782 -9.772 1.00 0.00 C ATOM 585 OD1 ASN A 54 4.632 -1.975 -9.841 1.00 0.00 O ATOM 586 ND2 ASN A 54 6.214 -3.212 -10.845 1.00 0.00 N ATOM 0 H ASN A 54 4.930 -2.843 -5.421 1.00 0.00 H new ATOM 0 HA ASN A 54 4.235 -2.561 -7.532 1.00 0.00 H new ATOM 0 HB2 ASN A 54 6.792 -2.698 -8.025 1.00 0.00 H new ATOM 0 HB3 ASN A 54 6.454 -4.323 -8.588 1.00 0.00 H new ATOM 0 HD21 ASN A 54 5.953 -2.873 -11.771 1.00 0.00 H new ATOM 0 HD22 ASN A 54 6.977 -3.881 -10.743 1.00 0.00 H new ATOM 593 N VAL A 55 4.449 -5.822 -7.154 1.00 0.00 N ATOM 594 CA VAL A 55 3.738 -7.077 -7.342 1.00 0.00 C ATOM 595 C VAL A 55 3.631 -7.850 -6.031 1.00 0.00 C ATOM 596 O VAL A 55 4.594 -7.941 -5.269 1.00 0.00 O ATOM 597 CB VAL A 55 4.436 -7.960 -8.388 1.00 0.00 C ATOM 598 CG1 VAL A 55 3.679 -9.271 -8.577 1.00 0.00 C ATOM 599 CG2 VAL A 55 4.572 -7.217 -9.709 1.00 0.00 C ATOM 0 H VAL A 55 5.278 -5.891 -6.564 1.00 0.00 H new ATOM 0 HA VAL A 55 2.738 -6.827 -7.695 1.00 0.00 H new ATOM 0 HB VAL A 55 5.437 -8.197 -8.026 1.00 0.00 H new ATOM 0 HG11 VAL A 55 4.189 -9.882 -9.322 1.00 0.00 H new ATOM 0 HG12 VAL A 55 3.642 -9.809 -7.630 1.00 0.00 H new ATOM 0 HG13 VAL A 55 2.664 -9.060 -8.915 1.00 0.00 H new ATOM 0 HG21 VAL A 55 5.069 -7.858 -10.437 1.00 0.00 H new ATOM 0 HG22 VAL A 55 3.583 -6.947 -10.078 1.00 0.00 H new ATOM 0 HG23 VAL A 55 5.162 -6.313 -9.559 1.00 0.00 H new ATOM 609 N THR A 56 2.456 -8.408 -5.781 1.00 0.00 N ATOM 610 CA THR A 56 2.209 -9.184 -4.573 1.00 0.00 C ATOM 611 C THR A 56 1.686 -10.569 -4.941 1.00 0.00 C ATOM 612 O THR A 56 0.649 -10.691 -5.593 1.00 0.00 O ATOM 613 CB THR A 56 1.195 -8.460 -3.683 1.00 0.00 C ATOM 614 OG1 THR A 56 1.285 -7.057 -3.864 1.00 0.00 O ATOM 615 CG2 THR A 56 1.375 -8.739 -2.208 1.00 0.00 C ATOM 0 H THR A 56 1.652 -8.337 -6.404 1.00 0.00 H new ATOM 0 HA THR A 56 3.145 -9.293 -4.025 1.00 0.00 H new ATOM 0 HB THR A 56 0.222 -8.843 -3.990 1.00 0.00 H new ATOM 0 HG1 THR A 56 0.920 -6.816 -4.741 1.00 0.00 H new ATOM 0 HG21 THR A 56 0.622 -8.193 -1.640 1.00 0.00 H new ATOM 0 HG22 THR A 56 1.264 -9.808 -2.024 1.00 0.00 H new ATOM 0 HG23 THR A 56 2.369 -8.418 -1.896 1.00 0.00 H new ATOM 623 N THR A 57 2.405 -11.612 -4.538 1.00 0.00 N ATOM 624 CA THR A 57 1.995 -12.975 -4.854 1.00 0.00 C ATOM 625 C THR A 57 1.376 -13.661 -3.641 1.00 0.00 C ATOM 626 O THR A 57 1.959 -13.679 -2.557 1.00 0.00 O ATOM 627 CB THR A 57 3.189 -13.784 -5.366 1.00 0.00 C ATOM 628 OG1 THR A 57 4.403 -13.091 -5.135 1.00 0.00 O ATOM 629 CG2 THR A 57 3.112 -14.091 -6.846 1.00 0.00 C ATOM 0 H THR A 57 3.267 -11.541 -3.997 1.00 0.00 H new ATOM 0 HA THR A 57 1.238 -12.925 -5.637 1.00 0.00 H new ATOM 0 HB THR A 57 3.159 -14.723 -4.813 1.00 0.00 H new ATOM 0 HG1 THR A 57 5.099 -13.445 -5.727 1.00 0.00 H new ATOM 0 HG21 THR A 57 3.988 -14.666 -7.144 1.00 0.00 H new ATOM 0 HG22 THR A 57 2.211 -14.669 -7.051 1.00 0.00 H new ATOM 0 HG23 THR A 57 3.081 -13.159 -7.410 1.00 0.00 H new ATOM 637 N ILE A 58 0.190 -14.227 -3.836 1.00 0.00 N ATOM 638 CA ILE A 58 -0.515 -14.918 -2.764 1.00 0.00 C ATOM 639 C ILE A 58 -0.660 -16.404 -3.077 1.00 0.00 C ATOM 640 O ILE A 58 -1.164 -16.780 -4.137 1.00 0.00 O ATOM 641 CB ILE A 58 -1.911 -14.307 -2.522 1.00 0.00 C ATOM 642 CG1 ILE A 58 -1.789 -12.813 -2.216 1.00 0.00 C ATOM 643 CG2 ILE A 58 -2.622 -15.029 -1.383 1.00 0.00 C ATOM 644 CD1 ILE A 58 -1.472 -11.970 -3.431 1.00 0.00 C ATOM 0 H ILE A 58 -0.304 -14.220 -4.729 1.00 0.00 H new ATOM 0 HA ILE A 58 0.081 -14.798 -1.859 1.00 0.00 H new ATOM 0 HB ILE A 58 -2.505 -14.430 -3.428 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.723 -12.464 -1.775 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -1.009 -12.666 -1.469 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -3.605 -14.584 -1.227 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -2.737 -16.083 -1.636 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.033 -14.937 -0.470 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -1.400 -10.922 -3.138 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -0.523 -12.293 -3.860 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.263 -12.087 -4.171 1.00 0.00 H new ATOM 656 N GLY A 59 -0.213 -17.242 -2.146 1.00 0.00 N ATOM 657 CA GLY A 59 -0.297 -18.679 -2.334 1.00 0.00 C ATOM 658 C GLY A 59 0.561 -19.443 -1.343 1.00 0.00 C ATOM 659 O GLY A 59 0.536 -19.161 -0.144 1.00 0.00 O ATOM 0 H GLY A 59 0.207 -16.950 -1.263 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.335 -18.996 -2.232 1.00 0.00 H new ATOM 0 HA3 GLY A 59 0.014 -18.929 -3.348 1.00 0.00 H new ATOM 663 N ARG A 60 1.323 -20.410 -1.847 1.00 0.00 N ATOM 664 CA ARG A 60 2.198 -21.219 -1.004 1.00 0.00 C ATOM 665 C ARG A 60 3.662 -21.031 -1.388 1.00 0.00 C ATOM 666 O ARG A 60 4.555 -21.179 -0.553 1.00 0.00 O ATOM 667 CB ARG A 60 1.828 -22.700 -1.105 1.00 0.00 C ATOM 668 CG ARG A 60 2.299 -23.522 0.084 1.00 0.00 C ATOM 669 CD ARG A 60 1.420 -24.743 0.308 1.00 0.00 C ATOM 670 NE ARG A 60 2.183 -25.989 0.239 1.00 0.00 N ATOM 671 CZ ARG A 60 3.140 -26.323 1.103 1.00 0.00 C ATOM 672 NH1 ARG A 60 3.465 -25.502 2.095 1.00 0.00 N ATOM 673 NH2 ARG A 60 3.774 -27.480 0.976 1.00 0.00 N ATOM 0 H ARG A 60 1.352 -20.653 -2.837 1.00 0.00 H new ATOM 0 HA ARG A 60 2.062 -20.885 0.025 1.00 0.00 H new ATOM 0 HB2 ARG A 60 0.746 -22.791 -1.194 1.00 0.00 H new ATOM 0 HB3 ARG A 60 2.259 -23.113 -2.017 1.00 0.00 H new ATOM 0 HG2 ARG A 60 3.329 -23.840 -0.079 1.00 0.00 H new ATOM 0 HG3 ARG A 60 2.295 -22.901 0.980 1.00 0.00 H new ATOM 0 HD2 ARG A 60 0.937 -24.668 1.282 1.00 0.00 H new ATOM 0 HD3 ARG A 60 0.628 -24.761 -0.440 1.00 0.00 H new ATOM 0 HE ARG A 60 1.969 -26.641 -0.516 1.00 0.00 H new ATOM 0 HH11 ARG A 60 2.981 -24.610 2.198 1.00 0.00 H new ATOM 0 HH12 ARG A 60 4.199 -25.763 2.754 1.00 0.00 H new ATOM 0 HH21 ARG A 60 3.529 -28.115 0.216 1.00 0.00 H new ATOM 0 HH22 ARG A 60 4.507 -27.735 1.638 1.00 0.00 H new ATOM 687 N SER A 61 3.905 -20.709 -2.657 1.00 0.00 N ATOM 688 CA SER A 61 5.265 -20.507 -3.151 1.00 0.00 C ATOM 689 C SER A 61 6.070 -19.623 -2.203 1.00 0.00 C ATOM 690 O SER A 61 5.656 -18.512 -1.873 1.00 0.00 O ATOM 691 CB SER A 61 5.235 -19.880 -4.547 1.00 0.00 C ATOM 692 OG SER A 61 6.042 -20.610 -5.455 1.00 0.00 O ATOM 0 H SER A 61 3.178 -20.582 -3.361 1.00 0.00 H new ATOM 0 HA SER A 61 5.750 -21.482 -3.205 1.00 0.00 H new ATOM 0 HB2 SER A 61 4.209 -19.849 -4.913 1.00 0.00 H new ATOM 0 HB3 SER A 61 5.585 -18.849 -4.493 1.00 0.00 H new ATOM 0 HG SER A 61 6.003 -20.189 -6.339 1.00 0.00 H new ATOM 698 N ARG A 62 7.222 -20.122 -1.770 1.00 0.00 N ATOM 699 CA ARG A 62 8.083 -19.375 -0.860 1.00 0.00 C ATOM 700 C ARG A 62 8.425 -18.004 -1.439 1.00 0.00 C ATOM 701 O ARG A 62 8.687 -17.055 -0.699 1.00 0.00 O ATOM 702 CB ARG A 62 9.368 -20.158 -0.578 1.00 0.00 C ATOM 703 CG ARG A 62 9.758 -20.175 0.891 1.00 0.00 C ATOM 704 CD ARG A 62 10.751 -21.286 1.192 1.00 0.00 C ATOM 705 NE ARG A 62 11.464 -21.058 2.445 1.00 0.00 N ATOM 706 CZ ARG A 62 10.905 -21.170 3.648 1.00 0.00 C ATOM 707 NH1 ARG A 62 9.626 -21.504 3.764 1.00 0.00 N ATOM 708 NH2 ARG A 62 11.626 -20.946 4.738 1.00 0.00 N ATOM 0 H ARG A 62 7.581 -21.039 -2.034 1.00 0.00 H new ATOM 0 HA ARG A 62 7.543 -19.231 0.076 1.00 0.00 H new ATOM 0 HB2 ARG A 62 9.242 -21.184 -0.924 1.00 0.00 H new ATOM 0 HB3 ARG A 62 10.183 -19.724 -1.157 1.00 0.00 H new ATOM 0 HG2 ARG A 62 10.193 -19.213 1.164 1.00 0.00 H new ATOM 0 HG3 ARG A 62 8.866 -20.307 1.504 1.00 0.00 H new ATOM 0 HD2 ARG A 62 10.224 -22.239 1.243 1.00 0.00 H new ATOM 0 HD3 ARG A 62 11.469 -21.362 0.375 1.00 0.00 H new ATOM 0 HE ARG A 62 12.449 -20.797 2.396 1.00 0.00 H new ATOM 0 HH11 ARG A 62 9.066 -21.676 2.929 1.00 0.00 H new ATOM 0 HH12 ARG A 62 9.203 -21.588 4.688 1.00 0.00 H new ATOM 0 HH21 ARG A 62 12.609 -20.688 4.655 1.00 0.00 H new ATOM 0 HH22 ARG A 62 11.197 -21.032 5.660 1.00 0.00 H new ATOM 722 N SER A 63 8.422 -17.909 -2.765 1.00 0.00 N ATOM 723 CA SER A 63 8.733 -16.658 -3.445 1.00 0.00 C ATOM 724 C SER A 63 7.553 -15.691 -3.389 1.00 0.00 C ATOM 725 O SER A 63 7.729 -14.478 -3.508 1.00 0.00 O ATOM 726 CB SER A 63 9.117 -16.928 -4.901 1.00 0.00 C ATOM 727 OG SER A 63 10.483 -17.290 -5.010 1.00 0.00 O ATOM 0 H SER A 63 8.207 -18.686 -3.390 1.00 0.00 H new ATOM 0 HA SER A 63 9.576 -16.198 -2.931 1.00 0.00 H new ATOM 0 HB2 SER A 63 8.493 -17.726 -5.303 1.00 0.00 H new ATOM 0 HB3 SER A 63 8.924 -16.039 -5.502 1.00 0.00 H new ATOM 0 HG SER A 63 10.703 -17.459 -5.950 1.00 0.00 H new ATOM 733 N CYS A 64 6.349 -16.231 -3.210 1.00 0.00 N ATOM 734 CA CYS A 64 5.146 -15.405 -3.141 1.00 0.00 C ATOM 735 C CYS A 64 5.291 -14.320 -2.079 1.00 0.00 C ATOM 736 O CYS A 64 6.130 -14.424 -1.184 1.00 0.00 O ATOM 737 CB CYS A 64 3.920 -16.269 -2.837 1.00 0.00 C ATOM 738 SG CYS A 64 3.397 -17.319 -4.212 1.00 0.00 S ATOM 0 H CYS A 64 6.181 -17.232 -3.111 1.00 0.00 H new ATOM 0 HA CYS A 64 5.012 -14.926 -4.111 1.00 0.00 H new ATOM 0 HB2 CYS A 64 4.138 -16.900 -1.975 1.00 0.00 H new ATOM 0 HB3 CYS A 64 3.092 -15.619 -2.555 1.00 0.00 H new ATOM 0 HG CYS A 64 2.356 -18.012 -3.857 1.00 0.00 H new ATOM 744 N ASP A 65 4.474 -13.277 -2.185 1.00 0.00 N ATOM 745 CA ASP A 65 4.523 -12.178 -1.232 1.00 0.00 C ATOM 746 C ASP A 65 3.896 -12.578 0.102 1.00 0.00 C ATOM 747 O ASP A 65 4.533 -12.483 1.151 1.00 0.00 O ATOM 748 CB ASP A 65 3.815 -10.945 -1.789 1.00 0.00 C ATOM 749 CG ASP A 65 3.876 -9.763 -0.841 1.00 0.00 C ATOM 750 OD1 ASP A 65 3.419 -9.901 0.313 1.00 0.00 O ATOM 751 OD2 ASP A 65 4.382 -8.697 -1.253 1.00 0.00 O ATOM 0 H ASP A 65 3.773 -13.171 -2.919 1.00 0.00 H new ATOM 0 HA ASP A 65 5.572 -11.936 -1.063 1.00 0.00 H new ATOM 0 HB2 ASP A 65 4.269 -10.668 -2.740 1.00 0.00 H new ATOM 0 HB3 ASP A 65 2.773 -11.190 -1.993 1.00 0.00 H new ATOM 756 N VAL A 66 2.641 -13.017 0.055 1.00 0.00 N ATOM 757 CA VAL A 66 1.929 -13.421 1.264 1.00 0.00 C ATOM 758 C VAL A 66 1.381 -14.840 1.148 1.00 0.00 C ATOM 759 O VAL A 66 0.763 -15.200 0.147 1.00 0.00 O ATOM 760 CB VAL A 66 0.764 -12.463 1.574 1.00 0.00 C ATOM 761 CG1 VAL A 66 0.174 -12.764 2.943 1.00 0.00 C ATOM 762 CG2 VAL A 66 1.224 -11.016 1.490 1.00 0.00 C ATOM 0 H VAL A 66 2.098 -13.102 -0.804 1.00 0.00 H new ATOM 0 HA VAL A 66 2.655 -13.385 2.076 1.00 0.00 H new ATOM 0 HB VAL A 66 -0.015 -12.616 0.827 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.648 -12.077 3.144 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.197 -13.789 2.962 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.943 -12.643 3.705 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.387 -10.355 1.712 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.023 -10.846 2.212 1.00 0.00 H new ATOM 0 HG23 VAL A 66 1.593 -10.809 0.485 1.00 0.00 H new ATOM 772 N ILE A 67 1.600 -15.639 2.188 1.00 0.00 N ATOM 773 CA ILE A 67 1.119 -17.015 2.213 1.00 0.00 C ATOM 774 C ILE A 67 -0.179 -17.113 3.009 1.00 0.00 C ATOM 775 O ILE A 67 -0.273 -16.596 4.123 1.00 0.00 O ATOM 776 CB ILE A 67 2.163 -17.967 2.827 1.00 0.00 C ATOM 777 CG1 ILE A 67 2.677 -17.407 4.155 1.00 0.00 C ATOM 778 CG2 ILE A 67 3.315 -18.188 1.857 1.00 0.00 C ATOM 779 CD1 ILE A 67 3.068 -18.478 5.151 1.00 0.00 C ATOM 0 H ILE A 67 2.109 -15.356 3.026 1.00 0.00 H new ATOM 0 HA ILE A 67 0.940 -17.314 1.180 1.00 0.00 H new ATOM 0 HB ILE A 67 1.687 -18.929 3.020 1.00 0.00 H new ATOM 0 HG12 ILE A 67 3.540 -16.769 3.962 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.906 -16.775 4.597 1.00 0.00 H new ATOM 0 HG21 ILE A 67 4.044 -18.863 2.306 1.00 0.00 H new ATOM 0 HG22 ILE A 67 2.935 -18.626 0.934 1.00 0.00 H new ATOM 0 HG23 ILE A 67 3.792 -17.233 1.636 1.00 0.00 H new ATOM 0 HD11 ILE A 67 3.423 -18.009 6.069 1.00 0.00 H new ATOM 0 HD12 ILE A 67 2.202 -19.102 5.373 1.00 0.00 H new ATOM 0 HD13 ILE A 67 3.861 -19.095 4.729 1.00 0.00 H new ATOM 791 N LEU A 68 -1.182 -17.768 2.432 1.00 0.00 N ATOM 792 CA LEU A 68 -2.475 -17.915 3.098 1.00 0.00 C ATOM 793 C LEU A 68 -2.924 -19.374 3.133 1.00 0.00 C ATOM 794 O LEU A 68 -2.854 -20.078 2.129 1.00 0.00 O ATOM 795 CB LEU A 68 -3.532 -17.059 2.394 1.00 0.00 C ATOM 796 CG LEU A 68 -4.183 -15.986 3.269 1.00 0.00 C ATOM 797 CD1 LEU A 68 -4.851 -16.619 4.481 1.00 0.00 C ATOM 798 CD2 LEU A 68 -3.152 -14.956 3.703 1.00 0.00 C ATOM 0 H LEU A 68 -1.127 -18.203 1.511 1.00 0.00 H new ATOM 0 HA LEU A 68 -2.360 -17.574 4.127 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.071 -16.574 1.534 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.312 -17.716 2.010 1.00 0.00 H new ATOM 0 HG LEU A 68 -4.949 -15.479 2.682 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -5.309 -15.841 5.092 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -5.618 -17.319 4.150 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -4.105 -17.152 5.071 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -3.632 -14.200 4.325 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -2.364 -15.448 4.273 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.720 -14.481 2.823 1.00 0.00 H new ATOM 810 N SER A 69 -3.388 -19.814 4.302 1.00 0.00 N ATOM 811 CA SER A 69 -3.854 -21.184 4.488 1.00 0.00 C ATOM 812 C SER A 69 -2.695 -22.164 4.380 1.00 0.00 C ATOM 813 O SER A 69 -2.286 -22.760 5.374 1.00 0.00 O ATOM 814 CB SER A 69 -4.933 -21.529 3.455 1.00 0.00 C ATOM 815 OG SER A 69 -6.216 -21.573 4.053 1.00 0.00 O ATOM 0 H SER A 69 -3.451 -19.235 5.139 1.00 0.00 H new ATOM 0 HA SER A 69 -4.286 -21.264 5.486 1.00 0.00 H new ATOM 0 HB2 SER A 69 -4.926 -20.788 2.656 1.00 0.00 H new ATOM 0 HB3 SER A 69 -4.708 -22.493 2.998 1.00 0.00 H new ATOM 0 HG SER A 69 -6.635 -20.689 3.994 1.00 0.00 H new ATOM 821 N GLU A 70 -2.176 -22.297 3.158 1.00 0.00 N ATOM 822 CA GLU A 70 -1.043 -23.181 2.833 1.00 0.00 C ATOM 823 C GLU A 70 -1.505 -24.518 2.232 1.00 0.00 C ATOM 824 O GLU A 70 -1.202 -24.806 1.074 1.00 0.00 O ATOM 825 CB GLU A 70 -0.119 -23.421 4.038 1.00 0.00 C ATOM 826 CG GLU A 70 1.353 -23.212 3.724 1.00 0.00 C ATOM 827 CD GLU A 70 2.257 -24.128 4.527 1.00 0.00 C ATOM 828 OE1 GLU A 70 1.780 -25.195 4.967 1.00 0.00 O ATOM 829 OE2 GLU A 70 3.440 -23.777 4.715 1.00 0.00 O ATOM 0 H GLU A 70 -2.533 -21.787 2.350 1.00 0.00 H new ATOM 0 HA GLU A 70 -0.464 -22.654 2.075 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -0.409 -22.750 4.847 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -0.264 -24.439 4.400 1.00 0.00 H new ATOM 0 HG2 GLU A 70 1.522 -23.382 2.661 1.00 0.00 H new ATOM 0 HG3 GLU A 70 1.620 -22.175 3.927 1.00 0.00 H new ATOM 836 N PRO A 71 -2.233 -25.365 2.990 1.00 0.00 N ATOM 837 CA PRO A 71 -2.694 -26.667 2.483 1.00 0.00 C ATOM 838 C PRO A 71 -3.594 -26.556 1.254 1.00 0.00 C ATOM 839 O PRO A 71 -3.496 -27.367 0.333 1.00 0.00 O ATOM 840 CB PRO A 71 -3.482 -27.263 3.654 1.00 0.00 C ATOM 841 CG PRO A 71 -3.011 -26.526 4.857 1.00 0.00 C ATOM 842 CD PRO A 71 -2.651 -25.148 4.386 1.00 0.00 C ATOM 0 HA PRO A 71 -1.849 -27.275 2.158 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -4.555 -27.138 3.511 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -3.296 -28.333 3.750 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -3.789 -26.486 5.619 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -2.150 -27.022 5.306 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -3.499 -24.467 4.451 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -1.848 -24.716 4.984 1.00 0.00 H new ATOM 850 N ASP A 72 -4.484 -25.567 1.247 1.00 0.00 N ATOM 851 CA ASP A 72 -5.407 -25.389 0.129 1.00 0.00 C ATOM 852 C ASP A 72 -5.178 -24.065 -0.594 1.00 0.00 C ATOM 853 O ASP A 72 -6.120 -23.462 -1.110 1.00 0.00 O ATOM 854 CB ASP A 72 -6.852 -25.464 0.624 1.00 0.00 C ATOM 855 CG ASP A 72 -7.102 -24.568 1.821 1.00 0.00 C ATOM 856 OD1 ASP A 72 -7.472 -23.392 1.616 1.00 0.00 O ATOM 857 OD2 ASP A 72 -6.930 -25.041 2.963 1.00 0.00 O ATOM 0 H ASP A 72 -4.586 -24.882 1.996 1.00 0.00 H new ATOM 0 HA ASP A 72 -5.219 -26.194 -0.582 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -7.525 -25.180 -0.185 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -7.089 -26.494 0.889 1.00 0.00 H new ATOM 862 N ILE A 73 -3.929 -23.614 -0.635 1.00 0.00 N ATOM 863 CA ILE A 73 -3.599 -22.364 -1.302 1.00 0.00 C ATOM 864 C ILE A 73 -2.826 -22.610 -2.593 1.00 0.00 C ATOM 865 O ILE A 73 -1.859 -23.373 -2.617 1.00 0.00 O ATOM 866 CB ILE A 73 -2.795 -21.432 -0.371 1.00 0.00 C ATOM 867 CG1 ILE A 73 -3.092 -19.974 -0.712 1.00 0.00 C ATOM 868 CG2 ILE A 73 -1.300 -21.713 -0.453 1.00 0.00 C ATOM 869 CD1 ILE A 73 -4.472 -19.537 -0.281 1.00 0.00 C ATOM 0 H ILE A 73 -3.133 -24.094 -0.216 1.00 0.00 H new ATOM 0 HA ILE A 73 -4.540 -21.875 -1.554 1.00 0.00 H new ATOM 0 HB ILE A 73 -3.105 -21.626 0.656 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -2.349 -19.336 -0.234 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -2.991 -19.830 -1.788 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -0.766 -21.038 0.216 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -1.107 -22.744 -0.158 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -0.956 -21.558 -1.476 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -4.623 -18.492 -0.551 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -5.221 -20.153 -0.779 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -4.569 -19.651 0.799 1.00 0.00 H new ATOM 881 N SER A 74 -3.267 -21.963 -3.666 1.00 0.00 N ATOM 882 CA SER A 74 -2.627 -22.112 -4.966 1.00 0.00 C ATOM 883 C SER A 74 -1.348 -21.287 -5.048 1.00 0.00 C ATOM 884 O SER A 74 -1.318 -20.119 -4.662 1.00 0.00 O ATOM 885 CB SER A 74 -3.588 -21.693 -6.080 1.00 0.00 C ATOM 886 OG SER A 74 -4.744 -22.513 -6.090 1.00 0.00 O ATOM 0 H SER A 74 -4.066 -21.330 -3.660 1.00 0.00 H new ATOM 0 HA SER A 74 -2.365 -23.163 -5.092 1.00 0.00 H new ATOM 0 HB2 SER A 74 -3.878 -20.651 -5.942 1.00 0.00 H new ATOM 0 HB3 SER A 74 -3.083 -21.758 -7.044 1.00 0.00 H new ATOM 0 HG SER A 74 -5.344 -22.224 -6.809 1.00 0.00 H new ATOM 892 N THR A 75 -0.291 -21.905 -5.559 1.00 0.00 N ATOM 893 CA THR A 75 0.998 -21.235 -5.703 1.00 0.00 C ATOM 894 C THR A 75 0.862 -19.977 -6.556 1.00 0.00 C ATOM 895 O THR A 75 1.566 -18.989 -6.344 1.00 0.00 O ATOM 896 CB THR A 75 2.016 -22.187 -6.334 1.00 0.00 C ATOM 897 OG1 THR A 75 2.160 -23.358 -5.551 1.00 0.00 O ATOM 898 CG2 THR A 75 3.390 -21.574 -6.497 1.00 0.00 C ATOM 0 H THR A 75 -0.300 -22.872 -5.882 1.00 0.00 H new ATOM 0 HA THR A 75 1.346 -20.943 -4.712 1.00 0.00 H new ATOM 0 HB THR A 75 1.619 -22.418 -7.323 1.00 0.00 H new ATOM 0 HG1 THR A 75 2.814 -23.955 -5.972 1.00 0.00 H new ATOM 0 HG21 THR A 75 4.062 -22.303 -6.950 1.00 0.00 H new ATOM 0 HG22 THR A 75 3.323 -20.695 -7.138 1.00 0.00 H new ATOM 0 HG23 THR A 75 3.776 -21.282 -5.520 1.00 0.00 H new ATOM 906 N PHE A 76 -0.051 -20.023 -7.520 1.00 0.00 N ATOM 907 CA PHE A 76 -0.291 -18.892 -8.415 1.00 0.00 C ATOM 908 C PHE A 76 -1.659 -18.276 -8.176 1.00 0.00 C ATOM 909 O PHE A 76 -2.163 -17.505 -8.992 1.00 0.00 O ATOM 910 CB PHE A 76 -0.134 -19.309 -9.879 1.00 0.00 C ATOM 911 CG PHE A 76 1.172 -18.886 -10.488 1.00 0.00 C ATOM 912 CD1 PHE A 76 2.372 -19.384 -10.003 1.00 0.00 C ATOM 913 CD2 PHE A 76 1.200 -17.993 -11.546 1.00 0.00 C ATOM 914 CE1 PHE A 76 3.574 -18.996 -10.563 1.00 0.00 C ATOM 915 CE2 PHE A 76 2.400 -17.601 -12.109 1.00 0.00 C ATOM 916 CZ PHE A 76 3.588 -18.104 -11.617 1.00 0.00 C ATOM 0 H PHE A 76 -0.641 -20.835 -7.704 1.00 0.00 H new ATOM 0 HA PHE A 76 0.460 -18.133 -8.193 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -0.225 -20.393 -9.951 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -0.951 -18.881 -10.460 1.00 0.00 H new ATOM 0 HD1 PHE A 76 2.367 -20.082 -9.179 1.00 0.00 H new ATOM 0 HD2 PHE A 76 0.273 -17.598 -11.936 1.00 0.00 H new ATOM 0 HE1 PHE A 76 4.502 -19.390 -10.177 1.00 0.00 H new ATOM 0 HE2 PHE A 76 2.408 -16.902 -12.933 1.00 0.00 H new ATOM 0 HZ PHE A 76 4.527 -17.800 -12.056 1.00 0.00 H new ATOM 926 N HIS A 77 -2.247 -18.652 -7.057 1.00 0.00 N ATOM 927 CA HIS A 77 -3.579 -18.188 -6.650 1.00 0.00 C ATOM 928 C HIS A 77 -3.927 -16.814 -7.224 1.00 0.00 C ATOM 929 O HIS A 77 -4.786 -16.703 -8.098 1.00 0.00 O ATOM 930 CB HIS A 77 -3.687 -18.151 -5.125 1.00 0.00 C ATOM 931 CG HIS A 77 -5.098 -18.184 -4.627 1.00 0.00 C ATOM 932 ND1 HIS A 77 -5.778 -19.356 -4.370 1.00 0.00 N ATOM 933 CD2 HIS A 77 -5.961 -17.180 -4.342 1.00 0.00 C ATOM 934 CE1 HIS A 77 -6.998 -19.071 -3.949 1.00 0.00 C ATOM 935 NE2 HIS A 77 -7.134 -17.759 -3.922 1.00 0.00 N ATOM 0 H HIS A 77 -1.817 -19.294 -6.391 1.00 0.00 H new ATOM 0 HA HIS A 77 -4.296 -18.902 -7.056 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -3.143 -18.999 -4.709 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -3.200 -17.248 -4.756 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -5.399 -20.296 -4.487 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -5.764 -16.122 -4.429 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -7.755 -19.790 -3.674 1.00 0.00 H new ATOM 944 N ALA A 78 -3.275 -15.766 -6.725 1.00 0.00 N ATOM 945 CA ALA A 78 -3.556 -14.415 -7.201 1.00 0.00 C ATOM 946 C ALA A 78 -2.322 -13.519 -7.167 1.00 0.00 C ATOM 947 O ALA A 78 -1.329 -13.827 -6.508 1.00 0.00 O ATOM 948 CB ALA A 78 -4.671 -13.794 -6.375 1.00 0.00 C ATOM 0 H ALA A 78 -2.558 -15.825 -6.001 1.00 0.00 H new ATOM 0 HA ALA A 78 -3.869 -14.497 -8.242 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -4.874 -12.786 -6.737 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -5.572 -14.401 -6.466 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -4.367 -13.749 -5.329 1.00 0.00 H new ATOM 954 N GLU A 79 -2.408 -12.399 -7.879 1.00 0.00 N ATOM 955 CA GLU A 79 -1.321 -11.428 -7.941 1.00 0.00 C ATOM 956 C GLU A 79 -1.876 -10.013 -7.792 1.00 0.00 C ATOM 957 O GLU A 79 -2.836 -9.641 -8.467 1.00 0.00 O ATOM 958 CB GLU A 79 -0.560 -11.562 -9.262 1.00 0.00 C ATOM 959 CG GLU A 79 0.783 -12.259 -9.121 1.00 0.00 C ATOM 960 CD GLU A 79 1.367 -12.681 -10.455 1.00 0.00 C ATOM 961 OE1 GLU A 79 0.811 -13.611 -11.078 1.00 0.00 O ATOM 962 OE2 GLU A 79 2.378 -12.082 -10.877 1.00 0.00 O ATOM 0 H GLU A 79 -3.229 -12.140 -8.426 1.00 0.00 H new ATOM 0 HA GLU A 79 -0.629 -11.624 -7.122 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -1.175 -12.116 -9.972 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -0.402 -10.569 -9.684 1.00 0.00 H new ATOM 0 HG2 GLU A 79 1.483 -11.592 -8.618 1.00 0.00 H new ATOM 0 HG3 GLU A 79 0.667 -13.137 -8.486 1.00 0.00 H new ATOM 969 N PHE A 80 -1.276 -9.230 -6.899 1.00 0.00 N ATOM 970 CA PHE A 80 -1.728 -7.862 -6.662 1.00 0.00 C ATOM 971 C PHE A 80 -0.624 -6.856 -6.973 1.00 0.00 C ATOM 972 O PHE A 80 0.510 -7.010 -6.525 1.00 0.00 O ATOM 973 CB PHE A 80 -2.189 -7.696 -5.211 1.00 0.00 C ATOM 974 CG PHE A 80 -3.546 -8.278 -4.935 1.00 0.00 C ATOM 975 CD1 PHE A 80 -3.813 -9.610 -5.210 1.00 0.00 C ATOM 976 CD2 PHE A 80 -4.553 -7.494 -4.398 1.00 0.00 C ATOM 977 CE1 PHE A 80 -5.060 -10.148 -4.954 1.00 0.00 C ATOM 978 CE2 PHE A 80 -5.803 -8.026 -4.141 1.00 0.00 C ATOM 979 CZ PHE A 80 -6.056 -9.355 -4.418 1.00 0.00 C ATOM 0 H PHE A 80 -0.480 -9.518 -6.330 1.00 0.00 H new ATOM 0 HA PHE A 80 -2.568 -7.668 -7.329 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -1.461 -8.168 -4.552 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -2.202 -6.635 -4.963 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -3.038 -10.234 -5.629 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -4.360 -6.455 -4.177 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -5.256 -11.187 -5.173 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -6.581 -7.403 -3.724 1.00 0.00 H new ATOM 0 HZ PHE A 80 -7.031 -9.774 -4.216 1.00 0.00 H new ATOM 989 N HIS A 81 -0.961 -5.827 -7.742 1.00 0.00 N ATOM 990 CA HIS A 81 0.011 -4.802 -8.105 1.00 0.00 C ATOM 991 C HIS A 81 -0.063 -3.613 -7.152 1.00 0.00 C ATOM 992 O HIS A 81 -1.081 -2.924 -7.081 1.00 0.00 O ATOM 993 CB HIS A 81 -0.224 -4.334 -9.542 1.00 0.00 C ATOM 994 CG HIS A 81 0.095 -5.374 -10.570 1.00 0.00 C ATOM 995 ND1 HIS A 81 0.892 -5.127 -11.669 1.00 0.00 N ATOM 996 CD2 HIS A 81 -0.280 -6.672 -10.664 1.00 0.00 C ATOM 997 CE1 HIS A 81 0.993 -6.228 -12.392 1.00 0.00 C ATOM 998 NE2 HIS A 81 0.291 -7.179 -11.805 1.00 0.00 N ATOM 0 H HIS A 81 -1.895 -5.680 -8.125 1.00 0.00 H new ATOM 0 HA HIS A 81 1.006 -5.240 -8.029 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -1.266 -4.034 -9.652 1.00 0.00 H new ATOM 0 HB3 HIS A 81 0.384 -3.449 -9.731 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -0.911 -7.208 -9.971 1.00 0.00 H new ATOM 0 HE1 HIS A 81 1.555 -6.332 -13.308 1.00 0.00 H new ATOM 0 HE2 HIS A 81 0.189 -8.136 -12.144 1.00 0.00 H new ATOM 1007 N LEU A 82 1.024 -3.376 -6.423 1.00 0.00 N ATOM 1008 CA LEU A 82 1.084 -2.265 -5.476 1.00 0.00 C ATOM 1009 C LEU A 82 1.965 -1.141 -6.011 1.00 0.00 C ATOM 1010 O LEU A 82 3.187 -1.280 -6.088 1.00 0.00 O ATOM 1011 CB LEU A 82 1.615 -2.747 -4.124 1.00 0.00 C ATOM 1012 CG LEU A 82 0.881 -2.183 -2.904 1.00 0.00 C ATOM 1013 CD1 LEU A 82 -0.189 -3.155 -2.431 1.00 0.00 C ATOM 1014 CD2 LEU A 82 1.862 -1.882 -1.782 1.00 0.00 C ATOM 0 H LEU A 82 1.875 -3.937 -6.469 1.00 0.00 H new ATOM 0 HA LEU A 82 0.074 -1.878 -5.344 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.556 -3.835 -4.094 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.670 -2.483 -4.049 1.00 0.00 H new ATOM 0 HG LEU A 82 0.396 -1.251 -3.194 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -0.701 -2.739 -1.563 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -0.909 -3.321 -3.232 1.00 0.00 H new ATOM 0 HD13 LEU A 82 0.275 -4.103 -2.158 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.322 -1.482 -0.924 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.376 -2.799 -1.492 1.00 0.00 H new ATOM 0 HD23 LEU A 82 2.593 -1.149 -2.124 1.00 0.00 H new ATOM 1026 N LEU A 83 1.340 -0.025 -6.375 1.00 0.00 N ATOM 1027 CA LEU A 83 2.067 1.125 -6.901 1.00 0.00 C ATOM 1028 C LEU A 83 1.810 2.368 -6.053 1.00 0.00 C ATOM 1029 O LEU A 83 0.687 2.610 -5.613 1.00 0.00 O ATOM 1030 CB LEU A 83 1.662 1.392 -8.351 1.00 0.00 C ATOM 1031 CG LEU A 83 2.444 0.599 -9.400 1.00 0.00 C ATOM 1032 CD1 LEU A 83 1.795 0.739 -10.768 1.00 0.00 C ATOM 1033 CD2 LEU A 83 3.892 1.062 -9.445 1.00 0.00 C ATOM 0 H LEU A 83 0.330 0.107 -6.315 1.00 0.00 H new ATOM 0 HA LEU A 83 3.132 0.896 -6.864 1.00 0.00 H new ATOM 0 HB2 LEU A 83 0.602 1.166 -8.463 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.785 2.455 -8.556 1.00 0.00 H new ATOM 0 HG LEU A 83 2.428 -0.454 -9.120 1.00 0.00 H new ATOM 0 HD11 LEU A 83 2.365 0.168 -11.501 1.00 0.00 H new ATOM 0 HD12 LEU A 83 0.774 0.360 -10.727 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.780 1.790 -11.058 1.00 0.00 H new ATOM 0 HD21 LEU A 83 4.434 0.488 -10.196 1.00 0.00 H new ATOM 0 HD22 LEU A 83 3.928 2.121 -9.702 1.00 0.00 H new ATOM 0 HD23 LEU A 83 4.353 0.910 -8.469 1.00 0.00 H new ATOM 1045 N GLN A 84 2.860 3.155 -5.833 1.00 0.00 N ATOM 1046 CA GLN A 84 2.747 4.376 -5.042 1.00 0.00 C ATOM 1047 C GLN A 84 3.120 5.598 -5.875 1.00 0.00 C ATOM 1048 O GLN A 84 4.112 5.586 -6.603 1.00 0.00 O ATOM 1049 CB GLN A 84 3.647 4.293 -3.806 1.00 0.00 C ATOM 1050 CG GLN A 84 3.467 5.456 -2.844 1.00 0.00 C ATOM 1051 CD GLN A 84 4.759 6.203 -2.579 1.00 0.00 C ATOM 1052 OE1 GLN A 84 5.226 6.277 -1.442 1.00 0.00 O ATOM 1053 NE2 GLN A 84 5.346 6.762 -3.631 1.00 0.00 N ATOM 0 H GLN A 84 3.797 2.969 -6.191 1.00 0.00 H new ATOM 0 HA GLN A 84 1.710 4.478 -4.722 1.00 0.00 H new ATOM 0 HB2 GLN A 84 3.442 3.361 -3.279 1.00 0.00 H new ATOM 0 HB3 GLN A 84 4.688 4.255 -4.127 1.00 0.00 H new ATOM 0 HG2 GLN A 84 2.729 6.148 -3.251 1.00 0.00 H new ATOM 0 HG3 GLN A 84 3.068 5.083 -1.901 1.00 0.00 H new ATOM 0 HE21 GLN A 84 4.924 6.676 -4.556 1.00 0.00 H new ATOM 0 HE22 GLN A 84 6.219 7.277 -3.514 1.00 0.00 H new ATOM 1062 N MET A 85 2.318 6.653 -5.763 1.00 0.00 N ATOM 1063 CA MET A 85 2.564 7.883 -6.508 1.00 0.00 C ATOM 1064 C MET A 85 2.009 9.093 -5.763 1.00 0.00 C ATOM 1065 O MET A 85 0.967 9.009 -5.113 1.00 0.00 O ATOM 1066 CB MET A 85 1.939 7.791 -7.902 1.00 0.00 C ATOM 1067 CG MET A 85 2.927 8.042 -9.029 1.00 0.00 C ATOM 1068 SD MET A 85 2.187 7.832 -10.661 1.00 0.00 S ATOM 1069 CE MET A 85 3.645 7.870 -11.701 1.00 0.00 C ATOM 0 H MET A 85 1.493 6.681 -5.164 1.00 0.00 H new ATOM 0 HA MET A 85 3.642 8.009 -6.609 1.00 0.00 H new ATOM 0 HB2 MET A 85 1.499 6.802 -8.029 1.00 0.00 H new ATOM 0 HB3 MET A 85 1.126 8.513 -7.975 1.00 0.00 H new ATOM 0 HG2 MET A 85 3.323 9.054 -8.941 1.00 0.00 H new ATOM 0 HG3 MET A 85 3.771 7.359 -8.926 1.00 0.00 H new ATOM 0 HE1 MET A 85 3.351 7.752 -12.744 1.00 0.00 H new ATOM 0 HE2 MET A 85 4.158 8.824 -11.574 1.00 0.00 H new ATOM 0 HE3 MET A 85 4.315 7.058 -11.418 1.00 0.00 H new ATOM 1079 N ASP A 86 2.711 10.217 -5.862 1.00 0.00 N ATOM 1080 CA ASP A 86 2.288 11.444 -5.199 1.00 0.00 C ATOM 1081 C ASP A 86 1.613 12.390 -6.187 1.00 0.00 C ATOM 1082 O ASP A 86 2.158 12.685 -7.250 1.00 0.00 O ATOM 1083 CB ASP A 86 3.487 12.138 -4.548 1.00 0.00 C ATOM 1084 CG ASP A 86 4.621 12.371 -5.527 1.00 0.00 C ATOM 1085 OD1 ASP A 86 5.238 11.377 -5.967 1.00 0.00 O ATOM 1086 OD2 ASP A 86 4.892 13.544 -5.854 1.00 0.00 O ATOM 0 H ASP A 86 3.576 10.303 -6.396 1.00 0.00 H new ATOM 0 HA ASP A 86 1.567 11.179 -4.425 1.00 0.00 H new ATOM 0 HB2 ASP A 86 3.168 13.093 -4.131 1.00 0.00 H new ATOM 0 HB3 ASP A 86 3.847 11.532 -3.717 1.00 0.00 H new ATOM 1091 N VAL A 87 0.423 12.863 -5.829 1.00 0.00 N ATOM 1092 CA VAL A 87 -0.325 13.775 -6.685 1.00 0.00 C ATOM 1093 C VAL A 87 -0.997 14.872 -5.864 1.00 0.00 C ATOM 1094 O VAL A 87 -1.598 14.604 -4.824 1.00 0.00 O ATOM 1095 CB VAL A 87 -1.395 13.025 -7.503 1.00 0.00 C ATOM 1096 CG1 VAL A 87 -2.417 12.372 -6.583 1.00 0.00 C ATOM 1097 CG2 VAL A 87 -2.076 13.965 -8.489 1.00 0.00 C ATOM 0 H VAL A 87 -0.043 12.629 -4.952 1.00 0.00 H new ATOM 0 HA VAL A 87 0.391 14.229 -7.370 1.00 0.00 H new ATOM 0 HB VAL A 87 -0.900 12.238 -8.072 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -3.163 11.848 -7.181 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -1.914 11.662 -5.927 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.907 13.138 -5.982 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -2.827 13.415 -9.056 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -2.555 14.778 -7.944 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.333 14.375 -9.173 1.00 0.00 H new ATOM 1107 N ASP A 88 -0.892 16.109 -6.341 1.00 0.00 N ATOM 1108 CA ASP A 88 -1.490 17.247 -5.652 1.00 0.00 C ATOM 1109 C ASP A 88 -0.914 17.396 -4.247 1.00 0.00 C ATOM 1110 O ASP A 88 -1.641 17.681 -3.294 1.00 0.00 O ATOM 1111 CB ASP A 88 -3.009 17.084 -5.581 1.00 0.00 C ATOM 1112 CG ASP A 88 -3.741 18.395 -5.797 1.00 0.00 C ATOM 1113 OD1 ASP A 88 -3.407 19.382 -5.108 1.00 0.00 O ATOM 1114 OD2 ASP A 88 -4.647 18.434 -6.655 1.00 0.00 O ATOM 0 H ASP A 88 -0.399 16.348 -7.201 1.00 0.00 H new ATOM 0 HA ASP A 88 -1.255 18.149 -6.217 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -3.330 16.363 -6.333 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -3.283 16.674 -4.609 1.00 0.00 H new ATOM 1119 N ASN A 89 0.395 17.200 -4.125 1.00 0.00 N ATOM 1120 CA ASN A 89 1.068 17.312 -2.836 1.00 0.00 C ATOM 1121 C ASN A 89 0.502 16.308 -1.838 1.00 0.00 C ATOM 1122 O ASN A 89 0.472 16.564 -0.634 1.00 0.00 O ATOM 1123 CB ASN A 89 0.927 18.732 -2.285 1.00 0.00 C ATOM 1124 CG ASN A 89 2.053 19.098 -1.338 1.00 0.00 C ATOM 1125 OD1 ASN A 89 3.195 19.290 -1.757 1.00 0.00 O ATOM 1126 ND2 ASN A 89 1.736 19.197 -0.052 1.00 0.00 N ATOM 0 H ASN A 89 1.011 16.963 -4.903 1.00 0.00 H new ATOM 0 HA ASN A 89 2.125 17.091 -2.986 1.00 0.00 H new ATOM 0 HB2 ASN A 89 0.908 19.440 -3.113 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -0.026 18.824 -1.765 1.00 0.00 H new ATOM 0 HD21 ASN A 89 2.452 19.441 0.632 1.00 0.00 H new ATOM 0 HD22 ASN A 89 0.777 19.029 0.251 1.00 0.00 H new ATOM 1133 N PHE A 90 0.055 15.164 -2.347 1.00 0.00 N ATOM 1134 CA PHE A 90 -0.509 14.120 -1.500 1.00 0.00 C ATOM 1135 C PHE A 90 -0.103 12.737 -1.998 1.00 0.00 C ATOM 1136 O PHE A 90 0.252 12.566 -3.164 1.00 0.00 O ATOM 1137 CB PHE A 90 -2.034 14.234 -1.462 1.00 0.00 C ATOM 1138 CG PHE A 90 -2.543 15.113 -0.356 1.00 0.00 C ATOM 1139 CD1 PHE A 90 -2.134 14.910 0.952 1.00 0.00 C ATOM 1140 CD2 PHE A 90 -3.430 16.143 -0.624 1.00 0.00 C ATOM 1141 CE1 PHE A 90 -2.600 15.718 1.972 1.00 0.00 C ATOM 1142 CE2 PHE A 90 -3.900 16.954 0.391 1.00 0.00 C ATOM 1143 CZ PHE A 90 -3.485 16.741 1.691 1.00 0.00 C ATOM 0 H PHE A 90 0.073 14.937 -3.341 1.00 0.00 H new ATOM 0 HA PHE A 90 -0.116 14.253 -0.492 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -2.385 14.626 -2.417 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -2.462 13.238 -1.349 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.443 14.111 1.177 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -3.758 16.314 -1.639 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -2.273 15.550 2.987 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -4.591 17.754 0.168 1.00 0.00 H new ATOM 0 HZ PHE A 90 -3.852 17.373 2.486 1.00 0.00 H new ATOM 1153 N GLN A 91 -0.157 11.753 -1.107 1.00 0.00 N ATOM 1154 CA GLN A 91 0.206 10.385 -1.456 1.00 0.00 C ATOM 1155 C GLN A 91 -0.989 9.637 -2.039 1.00 0.00 C ATOM 1156 O GLN A 91 -2.066 9.607 -1.445 1.00 0.00 O ATOM 1157 CB GLN A 91 0.733 9.646 -0.225 1.00 0.00 C ATOM 1158 CG GLN A 91 1.865 10.374 0.482 1.00 0.00 C ATOM 1159 CD GLN A 91 2.288 9.687 1.766 1.00 0.00 C ATOM 1160 OE1 GLN A 91 1.910 10.105 2.861 1.00 0.00 O ATOM 1161 NE2 GLN A 91 3.075 8.625 1.637 1.00 0.00 N ATOM 0 H GLN A 91 -0.449 11.878 -0.138 1.00 0.00 H new ATOM 0 HA GLN A 91 0.991 10.425 -2.211 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -0.087 9.497 0.478 1.00 0.00 H new ATOM 0 HB3 GLN A 91 1.079 8.657 -0.526 1.00 0.00 H new ATOM 0 HG2 GLN A 91 2.722 10.443 -0.188 1.00 0.00 H new ATOM 0 HG3 GLN A 91 1.552 11.394 0.706 1.00 0.00 H new ATOM 0 HE21 GLN A 91 3.364 8.314 0.710 1.00 0.00 H new ATOM 0 HE22 GLN A 91 3.391 8.121 2.465 1.00 0.00 H new ATOM 1170 N ARG A 92 -0.790 9.035 -3.207 1.00 0.00 N ATOM 1171 CA ARG A 92 -1.850 8.286 -3.873 1.00 0.00 C ATOM 1172 C ARG A 92 -1.497 6.803 -3.956 1.00 0.00 C ATOM 1173 O ARG A 92 -0.510 6.425 -4.586 1.00 0.00 O ATOM 1174 CB ARG A 92 -2.094 8.844 -5.275 1.00 0.00 C ATOM 1175 CG ARG A 92 -3.292 8.224 -5.976 1.00 0.00 C ATOM 1176 CD ARG A 92 -4.600 8.638 -5.320 1.00 0.00 C ATOM 1177 NE ARG A 92 -5.388 7.484 -4.895 1.00 0.00 N ATOM 1178 CZ ARG A 92 -6.128 6.746 -5.720 1.00 0.00 C ATOM 1179 NH1 ARG A 92 -6.184 7.039 -7.013 1.00 0.00 N ATOM 1180 NH2 ARG A 92 -6.812 5.712 -5.251 1.00 0.00 N ATOM 0 H ARG A 92 0.096 9.051 -3.712 1.00 0.00 H new ATOM 0 HA ARG A 92 -2.762 8.392 -3.285 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -2.241 9.922 -5.208 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -1.204 8.681 -5.882 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -3.298 8.526 -7.023 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -3.203 7.138 -5.958 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -4.389 9.270 -4.458 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -5.183 9.237 -6.020 1.00 0.00 H new ATOM 0 HE ARG A 92 -5.370 7.228 -3.908 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -5.659 7.833 -7.379 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -6.752 6.470 -7.641 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -6.771 5.482 -4.258 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -7.379 5.147 -5.883 1.00 0.00 H new ATOM 1194 N ASN A 93 -2.310 5.970 -3.315 1.00 0.00 N ATOM 1195 CA ASN A 93 -2.081 4.529 -3.316 1.00 0.00 C ATOM 1196 C ASN A 93 -3.145 3.807 -4.137 1.00 0.00 C ATOM 1197 O ASN A 93 -4.341 3.948 -3.883 1.00 0.00 O ATOM 1198 CB ASN A 93 -2.075 3.991 -1.884 1.00 0.00 C ATOM 1199 CG ASN A 93 -1.129 4.761 -0.983 1.00 0.00 C ATOM 1200 OD1 ASN A 93 -1.536 5.302 0.046 1.00 0.00 O ATOM 1201 ND2 ASN A 93 0.142 4.813 -1.363 1.00 0.00 N ATOM 0 H ASN A 93 -3.132 6.267 -2.789 1.00 0.00 H new ATOM 0 HA ASN A 93 -1.109 4.343 -3.772 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -3.084 4.042 -1.475 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -1.788 2.940 -1.895 1.00 0.00 H new ATOM 0 HD21 ASN A 93 0.824 5.315 -0.795 1.00 0.00 H new ATOM 0 HD22 ASN A 93 0.436 4.350 -2.223 1.00 0.00 H new ATOM 1208 N LEU A 94 -2.700 3.032 -5.121 1.00 0.00 N ATOM 1209 CA LEU A 94 -3.610 2.283 -5.979 1.00 0.00 C ATOM 1210 C LEU A 94 -3.189 0.821 -6.067 1.00 0.00 C ATOM 1211 O LEU A 94 -2.046 0.514 -6.409 1.00 0.00 O ATOM 1212 CB LEU A 94 -3.648 2.899 -7.379 1.00 0.00 C ATOM 1213 CG LEU A 94 -4.430 4.211 -7.492 1.00 0.00 C ATOM 1214 CD1 LEU A 94 -3.481 5.385 -7.670 1.00 0.00 C ATOM 1215 CD2 LEU A 94 -5.422 4.147 -8.644 1.00 0.00 C ATOM 0 H LEU A 94 -1.713 2.906 -5.344 1.00 0.00 H new ATOM 0 HA LEU A 94 -4.607 2.332 -5.541 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.624 3.075 -7.709 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -4.084 2.174 -8.066 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.988 4.357 -6.567 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -4.055 6.308 -7.748 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -2.812 5.445 -6.812 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -2.894 5.244 -8.578 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.967 5.089 -8.707 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.885 3.975 -9.577 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -6.125 3.331 -8.474 1.00 0.00 H new ATOM 1227 N ILE A 95 -4.116 -0.081 -5.758 1.00 0.00 N ATOM 1228 CA ILE A 95 -3.834 -1.509 -5.805 1.00 0.00 C ATOM 1229 C ILE A 95 -4.630 -2.193 -6.912 1.00 0.00 C ATOM 1230 O ILE A 95 -5.814 -1.917 -7.099 1.00 0.00 O ATOM 1231 CB ILE A 95 -4.153 -2.191 -4.460 1.00 0.00 C ATOM 1232 CG1 ILE A 95 -3.493 -1.430 -3.308 1.00 0.00 C ATOM 1233 CG2 ILE A 95 -3.691 -3.640 -4.477 1.00 0.00 C ATOM 1234 CD1 ILE A 95 -4.371 -0.350 -2.715 1.00 0.00 C ATOM 0 H ILE A 95 -5.067 0.153 -5.473 1.00 0.00 H new ATOM 0 HA ILE A 95 -2.769 -1.613 -6.012 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.233 -2.176 -4.310 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.222 -2.137 -2.524 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.567 -0.979 -3.665 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -3.924 -4.107 -3.520 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -4.203 -4.176 -5.276 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.615 -3.677 -4.647 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -3.839 0.147 -1.904 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -4.621 0.379 -3.486 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -5.286 -0.797 -2.327 1.00 0.00 H new ATOM 1246 N ASN A 96 -3.970 -3.087 -7.641 1.00 0.00 N ATOM 1247 CA ASN A 96 -4.615 -3.812 -8.729 1.00 0.00 C ATOM 1248 C ASN A 96 -4.707 -5.299 -8.404 1.00 0.00 C ATOM 1249 O ASN A 96 -3.703 -5.940 -8.096 1.00 0.00 O ATOM 1250 CB ASN A 96 -3.842 -3.608 -10.034 1.00 0.00 C ATOM 1251 CG ASN A 96 -4.759 -3.349 -11.213 1.00 0.00 C ATOM 1252 OD1 ASN A 96 -5.709 -4.252 -11.433 1.00 0.00 O flip ATOM 1253 ND2 ASN A 96 -4.617 -2.350 -11.918 1.00 0.00 N flip ATOM 0 H ASN A 96 -2.989 -3.327 -7.498 1.00 0.00 H new ATOM 0 HA ASN A 96 -5.625 -3.420 -8.850 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -3.156 -2.769 -9.919 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -3.235 -4.491 -10.236 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -3.874 -1.682 -11.713 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -5.243 -2.190 -12.708 1.00 0.00 H new ATOM 1260 N VAL A 97 -5.918 -5.841 -8.470 1.00 0.00 N ATOM 1261 CA VAL A 97 -6.138 -7.252 -8.178 1.00 0.00 C ATOM 1262 C VAL A 97 -6.151 -8.089 -9.453 1.00 0.00 C ATOM 1263 O VAL A 97 -6.777 -7.718 -10.447 1.00 0.00 O ATOM 1264 CB VAL A 97 -7.464 -7.470 -7.424 1.00 0.00 C ATOM 1265 CG1 VAL A 97 -7.580 -8.910 -6.950 1.00 0.00 C ATOM 1266 CG2 VAL A 97 -7.577 -6.504 -6.255 1.00 0.00 C ATOM 0 H VAL A 97 -6.761 -5.325 -8.723 1.00 0.00 H new ATOM 0 HA VAL A 97 -5.309 -7.573 -7.547 1.00 0.00 H new ATOM 0 HB VAL A 97 -8.288 -7.272 -8.110 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -8.523 -9.044 -6.420 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -7.549 -9.580 -7.810 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.751 -9.140 -6.280 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.519 -6.672 -5.734 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.748 -6.667 -5.567 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.545 -5.479 -6.625 1.00 0.00 H new ATOM 1276 N ILE A 98 -5.456 -9.221 -9.412 1.00 0.00 N ATOM 1277 CA ILE A 98 -5.384 -10.120 -10.558 1.00 0.00 C ATOM 1278 C ILE A 98 -5.917 -11.502 -10.197 1.00 0.00 C ATOM 1279 O ILE A 98 -5.722 -11.980 -9.080 1.00 0.00 O ATOM 1280 CB ILE A 98 -3.940 -10.258 -11.076 1.00 0.00 C ATOM 1281 CG1 ILE A 98 -3.300 -8.879 -11.244 1.00 0.00 C ATOM 1282 CG2 ILE A 98 -3.920 -11.022 -12.391 1.00 0.00 C ATOM 1283 CD1 ILE A 98 -3.974 -8.024 -12.295 1.00 0.00 C ATOM 0 H ILE A 98 -4.933 -9.538 -8.595 1.00 0.00 H new ATOM 0 HA ILE A 98 -6.001 -9.685 -11.344 1.00 0.00 H new ATOM 0 HB ILE A 98 -3.359 -10.819 -10.344 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -3.328 -8.355 -10.288 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -2.250 -9.004 -11.508 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -2.893 -11.111 -12.744 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -4.340 -12.017 -12.240 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -4.513 -10.486 -13.132 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -3.468 -7.061 -12.360 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -3.923 -8.527 -13.261 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -5.018 -7.868 -12.022 1.00 0.00 H new ATOM 1295 N ASP A 99 -6.593 -12.140 -11.147 1.00 0.00 N ATOM 1296 CA ASP A 99 -7.155 -13.466 -10.921 1.00 0.00 C ATOM 1297 C ASP A 99 -6.337 -14.536 -11.637 1.00 0.00 C ATOM 1298 O ASP A 99 -6.249 -14.548 -12.865 1.00 0.00 O ATOM 1299 CB ASP A 99 -8.608 -13.515 -11.397 1.00 0.00 C ATOM 1300 CG ASP A 99 -8.746 -13.199 -12.873 1.00 0.00 C ATOM 1301 OD1 ASP A 99 -8.115 -12.224 -13.333 1.00 0.00 O ATOM 1302 OD2 ASP A 99 -9.484 -13.927 -13.569 1.00 0.00 O ATOM 0 H ASP A 99 -6.764 -11.761 -12.078 1.00 0.00 H new ATOM 0 HA ASP A 99 -7.123 -13.668 -9.850 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -9.018 -14.506 -11.201 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -9.200 -12.805 -10.820 1.00 0.00 H new ATOM 1307 N LYS A 100 -5.745 -15.436 -10.859 1.00 0.00 N ATOM 1308 CA LYS A 100 -4.936 -16.515 -11.412 1.00 0.00 C ATOM 1309 C LYS A 100 -5.114 -17.795 -10.602 1.00 0.00 C ATOM 1310 O LYS A 100 -4.194 -18.604 -10.489 1.00 0.00 O ATOM 1311 CB LYS A 100 -3.459 -16.114 -11.436 1.00 0.00 C ATOM 1312 CG LYS A 100 -3.186 -14.839 -12.217 1.00 0.00 C ATOM 1313 CD LYS A 100 -3.285 -15.072 -13.716 1.00 0.00 C ATOM 1314 CE LYS A 100 -2.346 -14.156 -14.485 1.00 0.00 C ATOM 1315 NZ LYS A 100 -2.513 -14.299 -15.957 1.00 0.00 N ATOM 0 H LYS A 100 -5.811 -15.439 -9.841 1.00 0.00 H new ATOM 0 HA LYS A 100 -5.270 -16.701 -12.433 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -3.110 -15.984 -10.412 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -2.878 -16.927 -11.870 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -3.898 -14.069 -11.920 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -2.192 -14.466 -11.971 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -3.046 -16.111 -13.940 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -4.310 -14.903 -14.045 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -2.532 -13.121 -14.197 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -1.315 -14.382 -14.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -1.855 -13.658 -16.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -2.311 -15.280 -16.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -3.490 -14.059 -16.221 1.00 0.00 H new ATOM 1329 N SER A 101 -6.304 -17.969 -10.035 1.00 0.00 N ATOM 1330 CA SER A 101 -6.604 -19.147 -9.231 1.00 0.00 C ATOM 1331 C SER A 101 -7.456 -20.141 -10.013 1.00 0.00 C ATOM 1332 O SER A 101 -8.092 -19.784 -11.005 1.00 0.00 O ATOM 1333 CB SER A 101 -7.328 -18.744 -7.946 1.00 0.00 C ATOM 1334 OG SER A 101 -6.427 -18.193 -7.003 1.00 0.00 O ATOM 0 H SER A 101 -7.076 -17.308 -10.118 1.00 0.00 H new ATOM 0 HA SER A 101 -5.659 -19.627 -8.975 1.00 0.00 H new ATOM 0 HB2 SER A 101 -8.107 -18.017 -8.177 1.00 0.00 H new ATOM 0 HB3 SER A 101 -7.822 -19.615 -7.515 1.00 0.00 H new ATOM 0 HG SER A 101 -6.180 -17.286 -7.278 1.00 0.00 H new ATOM 1340 N ARG A 102 -7.467 -21.388 -9.553 1.00 0.00 N ATOM 1341 CA ARG A 102 -8.245 -22.436 -10.203 1.00 0.00 C ATOM 1342 C ARG A 102 -9.416 -22.864 -9.323 1.00 0.00 C ATOM 1343 O ARG A 102 -10.460 -23.282 -9.824 1.00 0.00 O ATOM 1344 CB ARG A 102 -7.355 -23.642 -10.511 1.00 0.00 C ATOM 1345 CG ARG A 102 -6.756 -23.614 -11.909 1.00 0.00 C ATOM 1346 CD ARG A 102 -5.272 -23.946 -11.892 1.00 0.00 C ATOM 1347 NE ARG A 102 -4.447 -22.777 -12.186 1.00 0.00 N ATOM 1348 CZ ARG A 102 -4.243 -22.305 -13.414 1.00 0.00 C ATOM 1349 NH1 ARG A 102 -4.798 -22.899 -14.462 1.00 0.00 N ATOM 1350 NH2 ARG A 102 -3.480 -21.235 -13.593 1.00 0.00 N ATOM 0 H ARG A 102 -6.946 -21.697 -8.733 1.00 0.00 H new ATOM 0 HA ARG A 102 -8.641 -22.038 -11.137 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -6.548 -23.684 -9.780 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -7.940 -24.554 -10.393 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -7.281 -24.327 -12.544 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -6.903 -22.627 -12.348 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -5.001 -24.345 -10.914 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -5.067 -24.728 -12.623 1.00 0.00 H new ATOM 0 HE ARG A 102 -4.002 -22.295 -11.405 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -5.385 -23.723 -14.330 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -4.638 -22.532 -15.400 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -3.050 -20.775 -12.790 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -3.323 -20.872 -14.533 1.00 0.00 H new ATOM 1364 N ASN A 103 -9.236 -22.755 -8.010 1.00 0.00 N ATOM 1365 CA ASN A 103 -10.276 -23.129 -7.062 1.00 0.00 C ATOM 1366 C ASN A 103 -11.396 -22.095 -7.033 1.00 0.00 C ATOM 1367 O ASN A 103 -12.537 -22.391 -7.385 1.00 0.00 O ATOM 1368 CB ASN A 103 -9.688 -23.301 -5.674 1.00 0.00 C ATOM 1369 CG ASN A 103 -9.626 -24.755 -5.244 1.00 0.00 C ATOM 1370 OD1 ASN A 103 -10.520 -25.543 -5.548 1.00 0.00 O ATOM 1371 ND2 ASN A 103 -8.565 -25.115 -4.530 1.00 0.00 N ATOM 0 H ASN A 103 -8.378 -22.410 -7.580 1.00 0.00 H new ATOM 0 HA ASN A 103 -10.700 -24.078 -7.389 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -8.684 -22.876 -5.653 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -10.287 -22.739 -4.957 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -8.468 -26.079 -4.211 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -7.847 -24.427 -4.301 1.00 0.00 H new ATOM 1378 N GLY A 104 -11.062 -20.878 -6.612 1.00 0.00 N ATOM 1379 CA GLY A 104 -12.054 -19.820 -6.548 1.00 0.00 C ATOM 1380 C GLY A 104 -11.568 -18.610 -5.772 1.00 0.00 C ATOM 1381 O GLY A 104 -10.998 -18.745 -4.689 1.00 0.00 O ATOM 0 H GLY A 104 -10.125 -20.607 -6.315 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -12.320 -19.515 -7.560 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -12.961 -20.205 -6.082 1.00 0.00 H new ATOM 1385 N THR A 105 -11.801 -17.425 -6.327 1.00 0.00 N ATOM 1386 CA THR A 105 -11.389 -16.182 -5.684 1.00 0.00 C ATOM 1387 C THR A 105 -12.534 -15.175 -5.679 1.00 0.00 C ATOM 1388 O THR A 105 -13.072 -14.827 -6.730 1.00 0.00 O ATOM 1389 CB THR A 105 -10.176 -15.588 -6.403 1.00 0.00 C ATOM 1390 OG1 THR A 105 -9.101 -16.511 -6.417 1.00 0.00 O ATOM 1391 CG2 THR A 105 -9.674 -14.308 -5.775 1.00 0.00 C ATOM 0 H THR A 105 -12.274 -17.299 -7.222 1.00 0.00 H new ATOM 0 HA THR A 105 -11.116 -16.405 -4.653 1.00 0.00 H new ATOM 0 HB THR A 105 -10.520 -15.366 -7.413 1.00 0.00 H new ATOM 0 HG1 THR A 105 -8.755 -16.624 -5.507 1.00 0.00 H new ATOM 0 HG21 THR A 105 -8.813 -13.941 -6.334 1.00 0.00 H new ATOM 0 HG22 THR A 105 -10.465 -13.559 -5.794 1.00 0.00 H new ATOM 0 HG23 THR A 105 -9.381 -14.500 -4.743 1.00 0.00 H new ATOM 1399 N PHE A 106 -12.906 -14.711 -4.489 1.00 0.00 N ATOM 1400 CA PHE A 106 -13.991 -13.745 -4.351 1.00 0.00 C ATOM 1401 C PHE A 106 -13.490 -12.443 -3.733 1.00 0.00 C ATOM 1402 O PHE A 106 -12.905 -12.444 -2.650 1.00 0.00 O ATOM 1403 CB PHE A 106 -15.115 -14.330 -3.495 1.00 0.00 C ATOM 1404 CG PHE A 106 -15.589 -15.676 -3.962 1.00 0.00 C ATOM 1405 CD1 PHE A 106 -14.851 -16.817 -3.692 1.00 0.00 C ATOM 1406 CD2 PHE A 106 -16.773 -15.801 -4.671 1.00 0.00 C ATOM 1407 CE1 PHE A 106 -15.284 -18.058 -4.121 1.00 0.00 C ATOM 1408 CE2 PHE A 106 -17.211 -17.038 -5.103 1.00 0.00 C ATOM 1409 CZ PHE A 106 -16.466 -18.168 -4.827 1.00 0.00 C ATOM 0 H PHE A 106 -12.473 -14.988 -3.608 1.00 0.00 H new ATOM 0 HA PHE A 106 -14.376 -13.526 -5.347 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -14.770 -14.413 -2.465 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -15.957 -13.638 -3.494 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -13.926 -16.736 -3.140 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -17.360 -14.921 -4.888 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -14.699 -18.940 -3.904 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -18.135 -17.121 -5.656 1.00 0.00 H new ATOM 0 HZ PHE A 106 -16.807 -19.136 -5.163 1.00 0.00 H new ATOM 1419 N ILE A 107 -13.727 -11.335 -4.427 1.00 0.00 N ATOM 1420 CA ILE A 107 -13.304 -10.026 -3.945 1.00 0.00 C ATOM 1421 C ILE A 107 -14.479 -9.073 -3.834 1.00 0.00 C ATOM 1422 O ILE A 107 -15.344 -9.013 -4.708 1.00 0.00 O ATOM 1423 CB ILE A 107 -12.214 -9.403 -4.838 1.00 0.00 C ATOM 1424 CG1 ILE A 107 -11.947 -7.940 -4.460 1.00 0.00 C ATOM 1425 CG2 ILE A 107 -12.594 -9.515 -6.306 1.00 0.00 C ATOM 1426 CD1 ILE A 107 -11.198 -7.783 -3.155 1.00 0.00 C ATOM 0 H ILE A 107 -14.210 -11.318 -5.325 1.00 0.00 H new ATOM 0 HA ILE A 107 -12.881 -10.185 -2.953 1.00 0.00 H new ATOM 0 HB ILE A 107 -11.293 -9.962 -4.674 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -11.376 -7.465 -5.258 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -12.898 -7.411 -4.390 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -11.811 -9.069 -6.920 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -12.710 -10.565 -6.573 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -13.534 -8.991 -6.480 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -11.043 -6.724 -2.949 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -11.778 -8.229 -2.347 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -10.232 -8.283 -3.227 1.00 0.00 H new ATOM 1438 N ASN A 108 -14.492 -8.335 -2.740 1.00 0.00 N ATOM 1439 CA ASN A 108 -15.553 -7.368 -2.474 1.00 0.00 C ATOM 1440 C ASN A 108 -16.913 -8.056 -2.427 1.00 0.00 C ATOM 1441 O ASN A 108 -17.940 -7.444 -2.721 1.00 0.00 O ATOM 1442 CB ASN A 108 -15.561 -6.280 -3.550 1.00 0.00 C ATOM 1443 CG ASN A 108 -14.596 -5.150 -3.246 1.00 0.00 C ATOM 1444 OD1 ASN A 108 -13.400 -5.499 -2.786 1.00 0.00 O flip ATOM 1445 ND2 ASN A 108 -14.922 -3.976 -3.423 1.00 0.00 N flip ATOM 0 H ASN A 108 -13.777 -8.384 -2.014 1.00 0.00 H new ATOM 0 HA ASN A 108 -15.359 -6.911 -1.504 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -15.303 -6.724 -4.512 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -16.569 -5.876 -3.645 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -15.852 -3.753 -3.778 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -14.262 -3.227 -3.214 1.00 0.00 H new ATOM 1452 N GLY A 109 -16.913 -9.332 -2.055 1.00 0.00 N ATOM 1453 CA GLY A 109 -18.146 -10.081 -1.975 1.00 0.00 C ATOM 1454 C GLY A 109 -18.731 -10.399 -3.339 1.00 0.00 C ATOM 1455 O GLY A 109 -19.858 -10.884 -3.438 1.00 0.00 O ATOM 0 H GLY A 109 -16.076 -9.859 -1.807 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -17.966 -11.011 -1.436 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -18.874 -9.513 -1.396 1.00 0.00 H new ATOM 1459 N ASN A 110 -17.965 -10.131 -4.394 1.00 0.00 N ATOM 1460 CA ASN A 110 -18.417 -10.394 -5.755 1.00 0.00 C ATOM 1461 C ASN A 110 -17.327 -11.089 -6.564 1.00 0.00 C ATOM 1462 O ASN A 110 -16.137 -10.915 -6.299 1.00 0.00 O ATOM 1463 CB ASN A 110 -18.827 -9.090 -6.440 1.00 0.00 C ATOM 1464 CG ASN A 110 -20.320 -8.837 -6.356 1.00 0.00 C ATOM 1465 OD1 ASN A 110 -21.017 -8.822 -7.370 1.00 0.00 O ATOM 1466 ND2 ASN A 110 -20.819 -8.636 -5.142 1.00 0.00 N ATOM 0 H ASN A 110 -17.028 -9.732 -4.331 1.00 0.00 H new ATOM 0 HA ASN A 110 -19.282 -11.055 -5.703 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -18.294 -8.258 -5.980 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -18.525 -9.122 -7.487 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -21.817 -8.461 -5.023 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -20.205 -8.657 -4.328 1.00 0.00 H new ATOM 1473 N ARG A 111 -17.740 -11.874 -7.553 1.00 0.00 N ATOM 1474 CA ARG A 111 -16.798 -12.595 -8.403 1.00 0.00 C ATOM 1475 C ARG A 111 -16.043 -11.634 -9.318 1.00 0.00 C ATOM 1476 O ARG A 111 -16.640 -10.755 -9.938 1.00 0.00 O ATOM 1477 CB ARG A 111 -17.532 -13.644 -9.240 1.00 0.00 C ATOM 1478 CG ARG A 111 -16.663 -14.828 -9.629 1.00 0.00 C ATOM 1479 CD ARG A 111 -17.452 -16.126 -9.621 1.00 0.00 C ATOM 1480 NE ARG A 111 -17.155 -16.957 -10.786 1.00 0.00 N ATOM 1481 CZ ARG A 111 -17.445 -18.253 -10.867 1.00 0.00 C ATOM 1482 NH1 ARG A 111 -18.042 -18.870 -9.854 1.00 0.00 N ATOM 1483 NH2 ARG A 111 -17.141 -18.934 -11.962 1.00 0.00 N ATOM 0 H ARG A 111 -18.721 -12.028 -7.786 1.00 0.00 H new ATOM 0 HA ARG A 111 -16.076 -13.096 -7.758 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -18.394 -14.005 -8.680 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -17.915 -13.172 -10.145 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -16.244 -14.662 -10.621 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -15.824 -14.907 -8.938 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -17.224 -16.682 -8.712 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -18.518 -15.901 -9.599 1.00 0.00 H new ATOM 0 HE ARG A 111 -16.698 -16.517 -11.585 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -18.280 -18.350 -9.009 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -18.262 -19.864 -9.921 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -16.684 -18.465 -12.744 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -17.364 -19.928 -12.023 1.00 0.00 H new ATOM 1497 N LEU A 112 -14.728 -11.810 -9.397 1.00 0.00 N ATOM 1498 CA LEU A 112 -13.891 -10.961 -10.237 1.00 0.00 C ATOM 1499 C LEU A 112 -14.019 -11.358 -11.705 1.00 0.00 C ATOM 1500 O LEU A 112 -14.104 -12.541 -12.032 1.00 0.00 O ATOM 1501 CB LEU A 112 -12.429 -11.055 -9.796 1.00 0.00 C ATOM 1502 CG LEU A 112 -11.622 -9.765 -9.949 1.00 0.00 C ATOM 1503 CD1 LEU A 112 -10.506 -9.706 -8.918 1.00 0.00 C ATOM 1504 CD2 LEU A 112 -11.055 -9.658 -11.357 1.00 0.00 C ATOM 0 H LEU A 112 -14.219 -12.533 -8.889 1.00 0.00 H new ATOM 0 HA LEU A 112 -14.230 -9.931 -10.126 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -12.400 -11.362 -8.750 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -11.941 -11.841 -10.373 1.00 0.00 H new ATOM 0 HG LEU A 112 -12.289 -8.919 -9.780 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.943 -8.781 -9.043 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -10.934 -9.737 -7.916 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.839 -10.557 -9.054 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -10.483 -8.735 -11.450 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -10.403 -10.510 -11.552 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -11.872 -9.653 -12.079 1.00 0.00 H new ATOM 1516 N VAL A 113 -14.030 -10.361 -12.584 1.00 0.00 N ATOM 1517 CA VAL A 113 -14.148 -10.611 -14.016 1.00 0.00 C ATOM 1518 C VAL A 113 -13.538 -9.474 -14.829 1.00 0.00 C ATOM 1519 O VAL A 113 -13.471 -8.334 -14.368 1.00 0.00 O ATOM 1520 CB VAL A 113 -15.620 -10.792 -14.436 1.00 0.00 C ATOM 1521 CG1 VAL A 113 -16.174 -12.100 -13.893 1.00 0.00 C ATOM 1522 CG2 VAL A 113 -16.457 -9.613 -13.965 1.00 0.00 C ATOM 0 H VAL A 113 -13.959 -9.375 -12.331 1.00 0.00 H new ATOM 0 HA VAL A 113 -13.602 -11.532 -14.219 1.00 0.00 H new ATOM 0 HB VAL A 113 -15.667 -10.830 -15.524 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -17.214 -12.210 -14.200 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -15.590 -12.933 -14.285 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -16.115 -12.096 -12.805 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -17.493 -9.758 -14.270 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -16.405 -9.541 -12.879 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -16.073 -8.694 -14.408 1.00 0.00 H new ATOM 1532 N LYS A 114 -13.093 -9.794 -16.042 1.00 0.00 N ATOM 1533 CA LYS A 114 -12.486 -8.806 -16.931 1.00 0.00 C ATOM 1534 C LYS A 114 -11.106 -8.371 -16.432 1.00 0.00 C ATOM 1535 O LYS A 114 -10.501 -7.456 -16.991 1.00 0.00 O ATOM 1536 CB LYS A 114 -13.399 -7.583 -17.079 1.00 0.00 C ATOM 1537 CG LYS A 114 -13.991 -7.432 -18.470 1.00 0.00 C ATOM 1538 CD LYS A 114 -15.377 -6.808 -18.421 1.00 0.00 C ATOM 1539 CE LYS A 114 -16.265 -7.337 -19.535 1.00 0.00 C ATOM 1540 NZ LYS A 114 -16.336 -6.394 -20.685 1.00 0.00 N ATOM 0 H LYS A 114 -13.142 -10.735 -16.433 1.00 0.00 H new ATOM 0 HA LYS A 114 -12.359 -9.278 -17.905 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -14.210 -7.655 -16.354 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -12.832 -6.685 -16.835 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -13.334 -6.813 -19.081 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -14.047 -8.409 -18.951 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -15.838 -7.018 -17.456 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -15.293 -5.725 -18.505 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -15.883 -8.299 -19.878 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -17.268 -7.512 -19.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -16.951 -6.792 -21.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -16.724 -5.484 -20.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -15.382 -6.246 -21.072 1.00 0.00 H new ATOM 1554 N LYS A 115 -10.608 -9.028 -15.384 1.00 0.00 N ATOM 1555 CA LYS A 115 -9.299 -8.705 -14.822 1.00 0.00 C ATOM 1556 C LYS A 115 -9.127 -7.198 -14.644 1.00 0.00 C ATOM 1557 O LYS A 115 -10.081 -6.431 -14.781 1.00 0.00 O ATOM 1558 CB LYS A 115 -8.188 -9.254 -15.719 1.00 0.00 C ATOM 1559 CG LYS A 115 -8.432 -10.678 -16.188 1.00 0.00 C ATOM 1560 CD LYS A 115 -7.221 -11.240 -16.916 1.00 0.00 C ATOM 1561 CE LYS A 115 -6.352 -12.076 -15.991 1.00 0.00 C ATOM 1562 NZ LYS A 115 -6.018 -11.350 -14.734 1.00 0.00 N ATOM 0 H LYS A 115 -11.093 -9.788 -14.907 1.00 0.00 H new ATOM 0 HA LYS A 115 -9.233 -9.173 -13.840 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -8.083 -8.607 -16.590 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -7.243 -9.216 -15.177 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -8.668 -11.309 -15.331 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -9.298 -10.701 -16.849 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -7.552 -11.851 -17.756 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -6.632 -10.421 -17.329 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -6.869 -13.004 -15.747 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -5.432 -12.350 -16.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -5.280 -11.871 -14.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -5.672 -10.397 -14.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -6.868 -11.275 -14.140 1.00 0.00 H new ATOM 1576 N ASP A 116 -7.901 -6.780 -14.339 1.00 0.00 N ATOM 1577 CA ASP A 116 -7.595 -5.366 -14.145 1.00 0.00 C ATOM 1578 C ASP A 116 -8.539 -4.729 -13.127 1.00 0.00 C ATOM 1579 O ASP A 116 -9.096 -3.657 -13.366 1.00 0.00 O ATOM 1580 CB ASP A 116 -7.683 -4.618 -15.477 1.00 0.00 C ATOM 1581 CG ASP A 116 -7.036 -3.248 -15.414 1.00 0.00 C ATOM 1582 OD1 ASP A 116 -5.789 -3.183 -15.361 1.00 0.00 O ATOM 1583 OD2 ASP A 116 -7.775 -2.241 -15.418 1.00 0.00 O ATOM 0 H ASP A 116 -7.102 -7.403 -14.221 1.00 0.00 H new ATOM 0 HA ASP A 116 -6.579 -5.294 -13.758 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -7.201 -5.209 -16.255 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -8.730 -4.510 -15.762 1.00 0.00 H new ATOM 1588 N TYR A 117 -8.712 -5.394 -11.990 1.00 0.00 N ATOM 1589 CA TYR A 117 -9.586 -4.889 -10.937 1.00 0.00 C ATOM 1590 C TYR A 117 -8.847 -3.887 -10.054 1.00 0.00 C ATOM 1591 O TYR A 117 -7.681 -4.089 -9.713 1.00 0.00 O ATOM 1592 CB TYR A 117 -10.117 -6.044 -10.088 1.00 0.00 C ATOM 1593 CG TYR A 117 -11.147 -5.622 -9.064 1.00 0.00 C ATOM 1594 CD1 TYR A 117 -10.760 -5.086 -7.842 1.00 0.00 C ATOM 1595 CD2 TYR A 117 -12.505 -5.761 -9.319 1.00 0.00 C ATOM 1596 CE1 TYR A 117 -11.698 -4.699 -6.904 1.00 0.00 C ATOM 1597 CE2 TYR A 117 -13.449 -5.377 -8.385 1.00 0.00 C ATOM 1598 CZ TYR A 117 -13.040 -4.847 -7.180 1.00 0.00 C ATOM 1599 OH TYR A 117 -13.977 -4.465 -6.248 1.00 0.00 O ATOM 0 H TYR A 117 -8.260 -6.282 -11.774 1.00 0.00 H new ATOM 0 HA TYR A 117 -10.427 -4.380 -11.408 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -10.557 -6.794 -10.745 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -9.282 -6.520 -9.575 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -9.709 -4.970 -7.622 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -12.829 -6.176 -10.262 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -11.381 -4.283 -5.959 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -14.502 -5.492 -8.598 1.00 0.00 H new ATOM 0 HH TYR A 117 -14.876 -4.635 -6.599 1.00 0.00 H new ATOM 1609 N ILE A 118 -9.529 -2.805 -9.694 1.00 0.00 N ATOM 1610 CA ILE A 118 -8.938 -1.771 -8.861 1.00 0.00 C ATOM 1611 C ILE A 118 -9.348 -1.934 -7.397 1.00 0.00 C ATOM 1612 O ILE A 118 -10.531 -1.880 -7.062 1.00 0.00 O ATOM 1613 CB ILE A 118 -9.337 -0.366 -9.359 1.00 0.00 C ATOM 1614 CG1 ILE A 118 -8.415 0.688 -8.754 1.00 0.00 C ATOM 1615 CG2 ILE A 118 -10.794 -0.059 -9.033 1.00 0.00 C ATOM 1616 CD1 ILE A 118 -6.955 0.429 -9.041 1.00 0.00 C ATOM 0 H ILE A 118 -10.494 -2.624 -9.969 1.00 0.00 H new ATOM 0 HA ILE A 118 -7.856 -1.878 -8.932 1.00 0.00 H new ATOM 0 HB ILE A 118 -9.229 -0.345 -10.443 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -8.688 1.669 -9.144 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -8.567 0.720 -7.675 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -11.046 0.937 -9.396 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -11.438 -0.794 -9.516 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -10.942 -0.100 -7.954 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -6.350 1.212 -8.585 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -6.669 -0.538 -8.627 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -6.791 0.425 -10.119 1.00 0.00 H new ATOM 1628 N LEU A 119 -8.360 -2.134 -6.531 1.00 0.00 N ATOM 1629 CA LEU A 119 -8.615 -2.305 -5.105 1.00 0.00 C ATOM 1630 C LEU A 119 -8.275 -1.033 -4.333 1.00 0.00 C ATOM 1631 O LEU A 119 -7.326 -0.324 -4.668 1.00 0.00 O ATOM 1632 CB LEU A 119 -7.804 -3.482 -4.559 1.00 0.00 C ATOM 1633 CG LEU A 119 -7.877 -3.673 -3.041 1.00 0.00 C ATOM 1634 CD1 LEU A 119 -7.972 -5.150 -2.689 1.00 0.00 C ATOM 1635 CD2 LEU A 119 -6.670 -3.037 -2.368 1.00 0.00 C ATOM 0 H LEU A 119 -7.375 -2.182 -6.792 1.00 0.00 H new ATOM 0 HA LEU A 119 -9.677 -2.513 -4.973 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -8.150 -4.396 -5.042 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -6.760 -3.347 -4.843 1.00 0.00 H new ATOM 0 HG LEU A 119 -8.777 -3.178 -2.674 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -8.023 -5.263 -1.606 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -8.868 -5.575 -3.141 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -7.093 -5.672 -3.068 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -6.737 -3.181 -1.290 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -5.758 -3.503 -2.741 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -6.649 -1.970 -2.591 1.00 0.00 H new ATOM 1647 N LYS A 120 -9.058 -0.755 -3.294 1.00 0.00 N ATOM 1648 CA LYS A 120 -8.845 0.429 -2.468 1.00 0.00 C ATOM 1649 C LYS A 120 -8.887 0.069 -0.986 1.00 0.00 C ATOM 1650 O LYS A 120 -9.114 -1.086 -0.624 1.00 0.00 O ATOM 1651 CB LYS A 120 -9.900 1.492 -2.779 1.00 0.00 C ATOM 1652 CG LYS A 120 -9.410 2.579 -3.720 1.00 0.00 C ATOM 1653 CD LYS A 120 -10.565 3.247 -4.448 1.00 0.00 C ATOM 1654 CE LYS A 120 -10.176 4.620 -4.970 1.00 0.00 C ATOM 1655 NZ LYS A 120 -11.180 5.155 -5.931 1.00 0.00 N ATOM 0 H LYS A 120 -9.846 -1.334 -3.004 1.00 0.00 H new ATOM 0 HA LYS A 120 -7.859 0.832 -2.699 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -10.772 1.008 -3.219 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -10.227 1.951 -1.846 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -8.853 3.327 -3.155 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -8.720 2.149 -4.446 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -10.885 2.618 -5.279 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -11.416 3.341 -3.773 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -10.071 5.310 -4.133 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -9.203 4.560 -5.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -10.877 6.093 -6.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -11.262 4.510 -6.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -12.103 5.236 -5.459 1.00 0.00 H new ATOM 1669 N ASN A 121 -8.665 1.063 -0.132 1.00 0.00 N ATOM 1670 CA ASN A 121 -8.678 0.850 1.311 1.00 0.00 C ATOM 1671 C ASN A 121 -10.042 0.352 1.777 1.00 0.00 C ATOM 1672 O ASN A 121 -11.072 0.702 1.203 1.00 0.00 O ATOM 1673 CB ASN A 121 -8.319 2.144 2.045 1.00 0.00 C ATOM 1674 CG ASN A 121 -9.165 3.319 1.598 1.00 0.00 C ATOM 1675 OD1 ASN A 121 -9.507 3.442 0.421 1.00 0.00 O ATOM 1676 ND2 ASN A 121 -9.508 4.193 2.537 1.00 0.00 N ATOM 0 H ASN A 121 -8.474 2.024 -0.414 1.00 0.00 H new ATOM 0 HA ASN A 121 -7.933 0.089 1.544 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -8.446 1.997 3.118 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -7.267 2.373 1.877 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -10.076 5.005 2.295 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -9.203 4.053 3.500 1.00 0.00 H new ATOM 1683 N GLY A 122 -10.040 -0.469 2.823 1.00 0.00 N ATOM 1684 CA GLY A 122 -11.282 -1.003 3.349 1.00 0.00 C ATOM 1685 C GLY A 122 -11.961 -1.950 2.382 1.00 0.00 C ATOM 1686 O GLY A 122 -13.177 -1.896 2.200 1.00 0.00 O ATOM 0 H GLY A 122 -9.200 -0.774 3.315 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -11.082 -1.526 4.284 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -11.958 -0.180 3.582 1.00 0.00 H new ATOM 1690 N ASP A 123 -11.174 -2.821 1.759 1.00 0.00 N ATOM 1691 CA ASP A 123 -11.706 -3.785 0.803 1.00 0.00 C ATOM 1692 C ASP A 123 -11.579 -5.208 1.336 1.00 0.00 C ATOM 1693 O ASP A 123 -10.543 -5.585 1.886 1.00 0.00 O ATOM 1694 CB ASP A 123 -10.979 -3.662 -0.537 1.00 0.00 C ATOM 1695 CG ASP A 123 -11.604 -2.617 -1.439 1.00 0.00 C ATOM 1696 OD1 ASP A 123 -12.171 -1.637 -0.910 1.00 0.00 O ATOM 1697 OD2 ASP A 123 -11.527 -2.777 -2.676 1.00 0.00 O ATOM 0 H ASP A 123 -10.165 -2.879 1.899 1.00 0.00 H new ATOM 0 HA ASP A 123 -12.763 -3.566 0.655 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -9.935 -3.406 -0.359 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -10.989 -4.628 -1.043 1.00 0.00 H new ATOM 1702 N ARG A 124 -12.636 -5.994 1.169 1.00 0.00 N ATOM 1703 CA ARG A 124 -12.643 -7.377 1.633 1.00 0.00 C ATOM 1704 C ARG A 124 -12.221 -8.326 0.517 1.00 0.00 C ATOM 1705 O ARG A 124 -12.864 -8.396 -0.530 1.00 0.00 O ATOM 1706 CB ARG A 124 -14.033 -7.759 2.145 1.00 0.00 C ATOM 1707 CG ARG A 124 -14.598 -6.775 3.158 1.00 0.00 C ATOM 1708 CD ARG A 124 -15.894 -6.149 2.670 1.00 0.00 C ATOM 1709 NE ARG A 124 -15.954 -4.718 2.960 1.00 0.00 N ATOM 1710 CZ ARG A 124 -16.782 -3.872 2.351 1.00 0.00 C ATOM 1711 NH1 ARG A 124 -17.621 -4.308 1.420 1.00 0.00 N ATOM 1712 NH2 ARG A 124 -16.772 -2.585 2.674 1.00 0.00 N ATOM 0 H ARG A 124 -13.500 -5.697 0.715 1.00 0.00 H new ATOM 0 HA ARG A 124 -11.927 -7.464 2.450 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -14.716 -7.830 1.299 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -13.985 -8.749 2.599 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -14.775 -7.287 4.104 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -13.866 -5.991 3.352 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -15.990 -6.305 1.596 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -16.739 -6.650 3.142 1.00 0.00 H new ATOM 0 HE ARG A 124 -15.324 -4.345 3.671 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -17.634 -5.296 1.167 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -18.253 -3.655 0.957 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -16.130 -2.244 3.389 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -17.407 -1.937 2.207 1.00 0.00 H new ATOM 1726 N ILE A 125 -11.137 -9.059 0.749 1.00 0.00 N ATOM 1727 CA ILE A 125 -10.628 -10.007 -0.234 1.00 0.00 C ATOM 1728 C ILE A 125 -10.725 -11.437 0.283 1.00 0.00 C ATOM 1729 O ILE A 125 -10.331 -11.727 1.412 1.00 0.00 O ATOM 1730 CB ILE A 125 -9.161 -9.705 -0.599 1.00 0.00 C ATOM 1731 CG1 ILE A 125 -8.989 -8.224 -0.952 1.00 0.00 C ATOM 1732 CG2 ILE A 125 -8.710 -10.588 -1.754 1.00 0.00 C ATOM 1733 CD1 ILE A 125 -7.948 -7.520 -0.109 1.00 0.00 C ATOM 0 H ILE A 125 -10.594 -9.014 1.611 1.00 0.00 H new ATOM 0 HA ILE A 125 -11.246 -9.901 -1.126 1.00 0.00 H new ATOM 0 HB ILE A 125 -8.536 -9.924 0.267 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -8.712 -8.139 -2.003 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -9.946 -7.716 -0.832 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -7.672 -10.363 -2.000 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -8.796 -11.636 -1.466 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -9.339 -10.398 -2.624 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -7.879 -6.476 -0.413 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -8.233 -7.574 0.942 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -6.981 -8.003 -0.247 1.00 0.00 H new ATOM 1745 N VAL A 126 -11.253 -12.329 -0.549 1.00 0.00 N ATOM 1746 CA VAL A 126 -11.402 -13.729 -0.173 1.00 0.00 C ATOM 1747 C VAL A 126 -10.708 -14.649 -1.174 1.00 0.00 C ATOM 1748 O VAL A 126 -10.855 -14.489 -2.385 1.00 0.00 O ATOM 1749 CB VAL A 126 -12.886 -14.129 -0.068 1.00 0.00 C ATOM 1750 CG1 VAL A 126 -13.025 -15.544 0.472 1.00 0.00 C ATOM 1751 CG2 VAL A 126 -13.642 -13.141 0.807 1.00 0.00 C ATOM 0 H VAL A 126 -11.585 -12.107 -1.488 1.00 0.00 H new ATOM 0 HA VAL A 126 -10.932 -13.843 0.804 1.00 0.00 H new ATOM 0 HB VAL A 126 -13.320 -14.105 -1.067 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -14.081 -15.806 0.538 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -12.519 -16.240 -0.197 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -12.574 -15.601 1.463 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -14.689 -13.438 0.871 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -13.206 -13.132 1.806 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -13.574 -12.144 0.372 1.00 0.00 H new ATOM 1761 N PHE A 127 -9.954 -15.617 -0.658 1.00 0.00 N ATOM 1762 CA PHE A 127 -9.239 -16.565 -1.505 1.00 0.00 C ATOM 1763 C PHE A 127 -9.725 -17.990 -1.255 1.00 0.00 C ATOM 1764 O PHE A 127 -10.019 -18.366 -0.120 1.00 0.00 O ATOM 1765 CB PHE A 127 -7.733 -16.484 -1.246 1.00 0.00 C ATOM 1766 CG PHE A 127 -7.056 -15.306 -1.893 1.00 0.00 C ATOM 1767 CD1 PHE A 127 -7.462 -14.842 -3.136 1.00 0.00 C ATOM 1768 CD2 PHE A 127 -6.006 -14.665 -1.253 1.00 0.00 C ATOM 1769 CE1 PHE A 127 -6.833 -13.762 -3.726 1.00 0.00 C ATOM 1770 CE2 PHE A 127 -5.374 -13.586 -1.839 1.00 0.00 C ATOM 1771 CZ PHE A 127 -5.788 -13.133 -3.077 1.00 0.00 C ATOM 0 H PHE A 127 -9.823 -15.764 0.343 1.00 0.00 H new ATOM 0 HA PHE A 127 -9.439 -16.303 -2.544 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -7.563 -16.440 -0.170 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -7.264 -17.400 -1.606 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -8.278 -15.330 -3.648 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -5.679 -15.014 -0.285 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -7.158 -13.410 -4.694 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -4.557 -13.097 -1.330 1.00 0.00 H new ATOM 0 HZ PHE A 127 -5.296 -12.289 -3.537 1.00 0.00 H new ATOM 1781 N GLY A 128 -9.801 -18.778 -2.323 1.00 0.00 N ATOM 1782 CA GLY A 128 -10.246 -20.152 -2.203 1.00 0.00 C ATOM 1783 C GLY A 128 -11.724 -20.258 -1.892 1.00 0.00 C ATOM 1784 O GLY A 128 -12.501 -20.769 -2.699 1.00 0.00 O ATOM 0 H GLY A 128 -9.561 -18.487 -3.271 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -10.035 -20.681 -3.132 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -9.676 -20.648 -1.417 1.00 0.00 H new ATOM 1788 N LYS A 129 -12.113 -19.771 -0.717 1.00 0.00 N ATOM 1789 CA LYS A 129 -13.510 -19.809 -0.293 1.00 0.00 C ATOM 1790 C LYS A 129 -13.651 -19.376 1.164 1.00 0.00 C ATOM 1791 O LYS A 129 -14.619 -18.710 1.533 1.00 0.00 O ATOM 1792 CB LYS A 129 -14.089 -21.217 -0.468 1.00 0.00 C ATOM 1793 CG LYS A 129 -13.183 -22.318 0.060 1.00 0.00 C ATOM 1794 CD LYS A 129 -13.054 -23.464 -0.934 1.00 0.00 C ATOM 1795 CE LYS A 129 -13.133 -24.816 -0.242 1.00 0.00 C ATOM 1796 NZ LYS A 129 -14.435 -25.493 -0.491 1.00 0.00 N ATOM 0 H LYS A 129 -11.480 -19.345 -0.040 1.00 0.00 H new ATOM 0 HA LYS A 129 -14.066 -19.113 -0.921 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -15.050 -21.272 0.044 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -14.281 -21.393 -1.526 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -12.196 -21.907 0.272 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -13.580 -22.696 1.002 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -13.845 -23.390 -1.680 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -12.106 -23.381 -1.465 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -12.320 -25.452 -0.594 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -12.992 -24.683 0.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -14.448 -26.411 -0.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -15.209 -24.899 -0.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -14.558 -25.643 -1.513 1.00 0.00 H new ATOM 1810 N SER A 130 -12.683 -19.763 1.989 1.00 0.00 N ATOM 1811 CA SER A 130 -12.706 -19.421 3.407 1.00 0.00 C ATOM 1812 C SER A 130 -11.723 -18.298 3.723 1.00 0.00 C ATOM 1813 O SER A 130 -12.042 -17.376 4.474 1.00 0.00 O ATOM 1814 CB SER A 130 -12.376 -20.651 4.254 1.00 0.00 C ATOM 1815 OG SER A 130 -11.114 -21.191 3.900 1.00 0.00 O ATOM 0 H SER A 130 -11.874 -20.313 1.700 1.00 0.00 H new ATOM 0 HA SER A 130 -13.711 -19.074 3.649 1.00 0.00 H new ATOM 0 HB2 SER A 130 -12.376 -20.380 5.310 1.00 0.00 H new ATOM 0 HB3 SER A 130 -13.149 -21.407 4.119 1.00 0.00 H new ATOM 0 HG SER A 130 -10.926 -21.975 4.457 1.00 0.00 H new ATOM 1821 N CYS A 131 -10.525 -18.381 3.152 1.00 0.00 N ATOM 1822 CA CYS A 131 -9.497 -17.370 3.384 1.00 0.00 C ATOM 1823 C CYS A 131 -10.024 -15.968 3.093 1.00 0.00 C ATOM 1824 O CYS A 131 -10.166 -15.575 1.936 1.00 0.00 O ATOM 1825 CB CYS A 131 -8.268 -17.646 2.522 1.00 0.00 C ATOM 1826 SG CYS A 131 -7.505 -19.259 2.815 1.00 0.00 S ATOM 0 H CYS A 131 -10.242 -19.136 2.527 1.00 0.00 H new ATOM 0 HA CYS A 131 -9.216 -17.423 4.436 1.00 0.00 H new ATOM 0 HB2 CYS A 131 -8.551 -17.576 1.472 1.00 0.00 H new ATOM 0 HB3 CYS A 131 -7.527 -16.867 2.705 1.00 0.00 H new ATOM 0 HG CYS A 131 -6.473 -19.399 2.036 1.00 0.00 H new ATOM 1832 N SER A 132 -10.307 -15.222 4.153 1.00 0.00 N ATOM 1833 CA SER A 132 -10.815 -13.861 4.022 1.00 0.00 C ATOM 1834 C SER A 132 -9.932 -12.874 4.782 1.00 0.00 C ATOM 1835 O SER A 132 -9.586 -13.103 5.941 1.00 0.00 O ATOM 1836 CB SER A 132 -12.253 -13.780 4.539 1.00 0.00 C ATOM 1837 OG SER A 132 -13.031 -14.859 4.052 1.00 0.00 O ATOM 0 H SER A 132 -10.193 -15.537 5.116 1.00 0.00 H new ATOM 0 HA SER A 132 -10.800 -13.594 2.965 1.00 0.00 H new ATOM 0 HB2 SER A 132 -12.252 -13.791 5.629 1.00 0.00 H new ATOM 0 HB3 SER A 132 -12.701 -12.836 4.230 1.00 0.00 H new ATOM 0 HG SER A 132 -12.669 -15.703 4.392 1.00 0.00 H new ATOM 1843 N PHE A 133 -9.575 -11.775 4.124 1.00 0.00 N ATOM 1844 CA PHE A 133 -8.737 -10.754 4.744 1.00 0.00 C ATOM 1845 C PHE A 133 -9.176 -9.355 4.331 1.00 0.00 C ATOM 1846 O PHE A 133 -9.795 -9.170 3.283 1.00 0.00 O ATOM 1847 CB PHE A 133 -7.267 -10.963 4.378 1.00 0.00 C ATOM 1848 CG PHE A 133 -7.030 -11.132 2.905 1.00 0.00 C ATOM 1849 CD1 PHE A 133 -7.475 -12.264 2.241 1.00 0.00 C ATOM 1850 CD2 PHE A 133 -6.358 -10.158 2.184 1.00 0.00 C ATOM 1851 CE1 PHE A 133 -7.257 -12.420 0.886 1.00 0.00 C ATOM 1852 CE2 PHE A 133 -6.137 -10.308 0.828 1.00 0.00 C ATOM 1853 CZ PHE A 133 -6.587 -11.440 0.179 1.00 0.00 C ATOM 0 H PHE A 133 -9.852 -11.569 3.164 1.00 0.00 H new ATOM 0 HA PHE A 133 -8.851 -10.849 5.824 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -6.688 -10.111 4.735 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -6.893 -11.844 4.901 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -7.998 -13.033 2.789 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -6.003 -9.271 2.688 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -7.610 -13.307 0.380 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -5.613 -9.541 0.277 1.00 0.00 H new ATOM 0 HZ PHE A 133 -6.416 -11.560 -0.881 1.00 0.00 H new ATOM 1863 N LEU A 134 -8.848 -8.374 5.162 1.00 0.00 N ATOM 1864 CA LEU A 134 -9.203 -6.986 4.890 1.00 0.00 C ATOM 1865 C LEU A 134 -7.951 -6.142 4.671 1.00 0.00 C ATOM 1866 O LEU A 134 -6.987 -6.237 5.429 1.00 0.00 O ATOM 1867 CB LEU A 134 -10.025 -6.410 6.045 1.00 0.00 C ATOM 1868 CG LEU A 134 -10.534 -4.982 5.831 1.00 0.00 C ATOM 1869 CD1 LEU A 134 -11.906 -4.998 5.177 1.00 0.00 C ATOM 1870 CD2 LEU A 134 -10.580 -4.230 7.152 1.00 0.00 C ATOM 0 H LEU A 134 -8.335 -8.514 6.033 1.00 0.00 H new ATOM 0 HA LEU A 134 -9.804 -6.961 3.981 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -10.881 -7.062 6.222 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -9.417 -6.431 6.949 1.00 0.00 H new ATOM 0 HG LEU A 134 -9.843 -4.465 5.165 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -12.252 -3.975 5.033 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -11.843 -5.499 4.211 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -12.608 -5.531 5.818 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -10.944 -3.217 6.981 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -11.250 -4.745 7.841 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -9.579 -4.188 7.582 1.00 0.00 H new ATOM 1882 N PHE A 135 -7.972 -5.319 3.626 1.00 0.00 N ATOM 1883 CA PHE A 135 -6.836 -4.462 3.308 1.00 0.00 C ATOM 1884 C PHE A 135 -7.135 -3.007 3.591 1.00 0.00 C ATOM 1885 O PHE A 135 -8.237 -2.510 3.357 1.00 0.00 O ATOM 1886 CB PHE A 135 -6.396 -4.610 1.865 1.00 0.00 C ATOM 1887 CG PHE A 135 -5.246 -3.719 1.485 1.00 0.00 C ATOM 1888 CD1 PHE A 135 -3.949 -4.038 1.853 1.00 0.00 C ATOM 1889 CD2 PHE A 135 -5.466 -2.561 0.757 1.00 0.00 C ATOM 1890 CE1 PHE A 135 -2.894 -3.217 1.503 1.00 0.00 C ATOM 1891 CE2 PHE A 135 -4.414 -1.738 0.403 1.00 0.00 C ATOM 1892 CZ PHE A 135 -3.128 -2.066 0.777 1.00 0.00 C ATOM 0 H PHE A 135 -8.762 -5.228 2.987 1.00 0.00 H new ATOM 0 HA PHE A 135 -6.023 -4.790 3.956 1.00 0.00 H new ATOM 0 HB2 PHE A 135 -6.114 -5.647 1.686 1.00 0.00 H new ATOM 0 HB3 PHE A 135 -7.242 -4.393 1.213 1.00 0.00 H new ATOM 0 HD1 PHE A 135 -3.760 -4.938 2.419 1.00 0.00 H new ATOM 0 HD2 PHE A 135 -6.471 -2.298 0.463 1.00 0.00 H new ATOM 0 HE1 PHE A 135 -1.887 -3.475 1.797 1.00 0.00 H new ATOM 0 HE2 PHE A 135 -4.599 -0.839 -0.166 1.00 0.00 H new ATOM 0 HZ PHE A 135 -2.305 -1.423 0.502 1.00 0.00 H new ATOM 1902 N LYS A 136 -6.122 -2.347 4.094 1.00 0.00 N ATOM 1903 CA LYS A 136 -6.200 -0.930 4.431 1.00 0.00 C ATOM 1904 C LYS A 136 -4.818 -0.286 4.388 1.00 0.00 C ATOM 1905 O LYS A 136 -3.813 -0.939 4.670 1.00 0.00 O ATOM 1906 CB LYS A 136 -6.819 -0.748 5.818 1.00 0.00 C ATOM 1907 CG LYS A 136 -7.122 0.702 6.162 1.00 0.00 C ATOM 1908 CD LYS A 136 -8.023 0.808 7.381 1.00 0.00 C ATOM 1909 CE LYS A 136 -7.216 1.017 8.653 1.00 0.00 C ATOM 1910 NZ LYS A 136 -7.100 2.458 9.007 1.00 0.00 N ATOM 0 H LYS A 136 -5.214 -2.770 4.285 1.00 0.00 H new ATOM 0 HA LYS A 136 -6.833 -0.439 3.692 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -7.741 -1.327 5.874 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -6.140 -1.156 6.567 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -6.190 1.235 6.350 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -7.601 1.187 5.311 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -8.719 1.637 7.250 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -8.621 -0.099 7.473 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -7.688 0.478 9.475 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -6.220 0.594 8.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -6.543 2.557 9.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -6.627 2.968 8.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -8.049 2.857 9.155 1.00 0.00 H new ATOM 1924 N TYR A 137 -4.771 0.995 4.040 1.00 0.00 N ATOM 1925 CA TYR A 137 -3.505 1.716 3.971 1.00 0.00 C ATOM 1926 C TYR A 137 -2.986 2.028 5.368 1.00 0.00 C ATOM 1927 O TYR A 137 -3.751 2.384 6.263 1.00 0.00 O ATOM 1928 CB TYR A 137 -3.644 3.016 3.178 1.00 0.00 C ATOM 1929 CG TYR A 137 -4.529 2.916 1.950 1.00 0.00 C ATOM 1930 CD1 TYR A 137 -4.763 1.695 1.326 1.00 0.00 C ATOM 1931 CD2 TYR A 137 -5.121 4.050 1.411 1.00 0.00 C ATOM 1932 CE1 TYR A 137 -5.564 1.611 0.203 1.00 0.00 C ATOM 1933 CE2 TYR A 137 -5.922 3.973 0.288 1.00 0.00 C ATOM 1934 CZ TYR A 137 -6.140 2.751 -0.312 1.00 0.00 C ATOM 1935 OH TYR A 137 -6.936 2.669 -1.434 1.00 0.00 O ATOM 0 H TYR A 137 -5.591 1.554 3.802 1.00 0.00 H new ATOM 0 HA TYR A 137 -2.793 1.070 3.457 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -4.045 3.787 3.837 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -2.652 3.345 2.869 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -4.312 0.799 1.725 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -4.952 5.009 1.878 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -5.738 0.655 -0.269 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -6.375 4.865 -0.118 1.00 0.00 H new ATOM 0 HH TYR A 137 -7.266 3.562 -1.667 1.00 0.00 H new ATOM 1945 N ALA A 138 -1.680 1.888 5.544 1.00 0.00 N ATOM 1946 CA ALA A 138 -1.047 2.151 6.830 1.00 0.00 C ATOM 1947 C ALA A 138 0.134 3.104 6.678 1.00 0.00 C ATOM 1948 O ALA A 138 1.231 2.693 6.298 1.00 0.00 O ATOM 1949 CB ALA A 138 -0.596 0.846 7.469 1.00 0.00 C ATOM 0 H ALA A 138 -1.036 1.593 4.810 1.00 0.00 H new ATOM 0 HA ALA A 138 -1.782 2.628 7.479 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -0.124 1.055 8.429 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -1.459 0.198 7.622 1.00 0.00 H new ATOM 0 HB3 ALA A 138 0.119 0.348 6.814 1.00 0.00 H new