USER MOD reduce.3.24.130724 H: found=0, std=0, add=930, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 933 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: C 108 GLN :FLIP amide:sc= -0.0832 F(o=-2.2!,f=-0.089) USER MOD Set 1.2: C 111 LYS NZ :NH3+ -168:sc=-0.00605 (180deg=-0.174) USER MOD Set 2.1: B 68 GLN :FLIP amide:sc= -0.0672 F(o=-2!,f=-0.08) USER MOD Set 2.2: B 71 LYS NZ :NH3+ -167:sc= -0.0128 (180deg=-0.198) USER MOD Set 3.1: A 28 GLN :FLIP amide:sc= -0.116 F(o=-1.9!,f=-0.14) USER MOD Set 3.2: A 31 LYS NZ :NH3+ -166:sc= -0.0253 (180deg=-0.223) USER MOD Single : A 1 GLY N :NH3+ -123:sc= 0.116 (180deg=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 10 GLN : amide:sc= -0.0551 X(o=-0.055,f=-0.059) USER MOD Single : A 11 GLN : amide:sc= -0.362 K(o=-0.36,f=-1.9) USER MOD Single : A 16 GLN : amide:sc= -0.49 X(o=-0.49,f=-0.49) USER MOD Single : A 18 GLN : amide:sc=-0.00112 X(o=-0.0011,f=-0.24) USER MOD Single : A 20 GLN :FLIP amide:sc= -2.41! C(o=-5.6!,f=-2.4!) USER MOD Single : A 21 HIS : no HD1:sc= -2.83 K(o=-2.8,f=-6.3!) USER MOD Single : A 23 GLN : amide:sc= -0.19 X(o=-0.19,f=-0.19) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot -34:sc= 1.28 USER MOD Single : A 30 LYS NZ :NH3+ -148:sc= -0.0948 (180deg=-0.956) USER MOD Single : A 37 ASN : amide:sc= -0.163 K(o=-0.16,f=-1.5!) USER MOD Single : B 47 SER OG : rot 180:sc= 0 USER MOD Single : B 50 GLN : amide:sc= -0.0638 X(o=-0.064,f=-0.066) USER MOD Single : B 51 GLN : amide:sc= -0.253 K(o=-0.25,f=-1.4) USER MOD Single : B 56 GLN : amide:sc= -0.477 X(o=-0.48,f=-0.48) USER MOD Single : B 58 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : B 60 GLN :FLIP amide:sc= -2.13! C(o=-5.3!,f=-2.1!) USER MOD Single : B 61 HIS : no HD1:sc= -2.9 K(o=-2.9,f=-6.6!) USER MOD Single : B 63 GLN : amide:sc= -0.169 X(o=-0.17,f=-0.17) USER MOD Single : B 67 SER OG : rot 180:sc= 0 USER MOD Single : B 69 TYR OH : rot -33:sc= 1.23 USER MOD Single : B 70 LYS NZ :NH3+ -132:sc= -0.0749 (180deg=-0.926) USER MOD Single : B 77 ASN : amide:sc= -0.0272 K(o=-0.027,f=-1.3) USER MOD Single : C 87 SER OG : rot 180:sc= 0 USER MOD Single : C 90 GLN : amide:sc= -0.0759 X(o=-0.076,f=-0.076) USER MOD Single : C 91 GLN : amide:sc= -0.43 K(o=-0.43,f=-1.9) USER MOD Single : C 96 GLN : amide:sc= -0.395 X(o=-0.4,f=-0.4) USER MOD Single : C 98 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : C 100 GLN :FLIP amide:sc= -2.26! C(o=-5.7!,f=-2.3!) USER MOD Single : C 101 HIS : no HD1:sc= -2.92 K(o=-2.9,f=-6.7!) USER MOD Single : C 103 GLN : amide:sc= -0.175 X(o=-0.18,f=-0.18) USER MOD Single : C 107 SER OG : rot 180:sc= 0 USER MOD Single : C 109 TYR OH : rot -31:sc= 1.26 USER MOD Single : C 110 LYS NZ :NH3+ -144:sc= -0.168 (180deg=-1.1) USER MOD Single : C 117 ASN : amide:sc= -0.152 K(o=-0.15,f=-1.5) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.497 -28.643 5.663 1.00 0.00 N ATOM 2 CA GLY A 1 -3.945 -28.963 5.721 1.00 0.00 C ATOM 3 C GLY A 1 -4.807 -27.753 5.443 1.00 0.00 C ATOM 4 O GLY A 1 -4.288 -26.671 5.166 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.034 -29.255 4.961 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.372 -27.647 5.390 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.069 -28.802 6.597 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.172 -29.744 4.995 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.188 -29.362 6.706 1.00 0.00 H new ATOM 10 N LEU A 2 -6.126 -27.939 5.515 1.00 0.00 N ATOM 11 CA LEU A 2 -7.087 -26.858 5.270 1.00 0.00 C ATOM 12 C LEU A 2 -6.877 -25.670 6.208 1.00 0.00 C ATOM 13 O LEU A 2 -6.701 -24.547 5.740 1.00 0.00 O ATOM 14 CB LEU A 2 -8.528 -27.380 5.378 1.00 0.00 C ATOM 15 CG LEU A 2 -9.142 -27.864 4.061 1.00 0.00 C ATOM 16 CD1 LEU A 2 -8.206 -28.792 3.310 1.00 0.00 C ATOM 17 CD2 LEU A 2 -10.475 -28.548 4.299 1.00 0.00 C ATOM 0 H LEU A 2 -6.557 -28.835 5.743 1.00 0.00 H new ATOM 0 HA LEU A 2 -6.914 -26.501 4.255 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -8.548 -28.201 6.094 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -9.156 -26.587 5.784 1.00 0.00 H new ATOM 0 HG LEU A 2 -9.307 -26.981 3.444 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -8.679 -29.113 2.382 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -7.279 -28.267 3.082 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -7.987 -29.664 3.926 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -10.888 -28.881 3.347 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -10.331 -29.408 4.953 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -11.165 -27.847 4.768 1.00 0.00 H new ATOM 29 N PRO A 3 -6.929 -25.883 7.540 1.00 0.00 N ATOM 30 CA PRO A 3 -6.769 -24.816 8.522 1.00 0.00 C ATOM 31 C PRO A 3 -5.517 -23.974 8.276 1.00 0.00 C ATOM 32 O PRO A 3 -5.523 -22.767 8.473 1.00 0.00 O ATOM 33 CB PRO A 3 -6.664 -25.544 9.871 1.00 0.00 C ATOM 34 CG PRO A 3 -6.675 -27.005 9.569 1.00 0.00 C ATOM 35 CD PRO A 3 -7.200 -27.162 8.177 1.00 0.00 C ATOM 0 HA PRO A 3 -7.602 -24.115 8.475 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -5.749 -25.263 10.393 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -7.497 -25.277 10.521 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -5.672 -27.423 9.652 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -7.303 -27.541 10.280 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -6.702 -27.979 7.655 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -8.267 -27.387 8.178 1.00 0.00 H new ATOM 43 N ASP A 4 -4.455 -24.633 7.827 1.00 0.00 N ATOM 44 CA ASP A 4 -3.185 -23.971 7.530 1.00 0.00 C ATOM 45 C ASP A 4 -3.309 -23.088 6.292 1.00 0.00 C ATOM 46 O ASP A 4 -2.702 -22.022 6.210 1.00 0.00 O ATOM 47 CB ASP A 4 -2.108 -25.040 7.338 1.00 0.00 C ATOM 48 CG ASP A 4 -0.760 -24.473 6.987 1.00 0.00 C ATOM 49 OD1 ASP A 4 -0.265 -23.603 7.728 1.00 0.00 O ATOM 50 OD2 ASP A 4 -0.186 -24.903 5.971 1.00 0.00 O ATOM 0 H ASP A 4 -4.447 -25.639 7.658 1.00 0.00 H new ATOM 0 HA ASP A 4 -2.907 -23.323 8.361 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -2.021 -25.626 8.253 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -2.422 -25.725 6.550 1.00 0.00 H new ATOM 55 N VAL A 5 -4.121 -23.523 5.345 1.00 0.00 N ATOM 56 CA VAL A 5 -4.352 -22.768 4.127 1.00 0.00 C ATOM 57 C VAL A 5 -5.295 -21.594 4.400 1.00 0.00 C ATOM 58 O VAL A 5 -5.028 -20.462 3.989 1.00 0.00 O ATOM 59 CB VAL A 5 -4.946 -23.675 3.026 1.00 0.00 C ATOM 60 CG1 VAL A 5 -5.339 -22.872 1.802 1.00 0.00 C ATOM 61 CG2 VAL A 5 -3.961 -24.769 2.643 1.00 0.00 C ATOM 0 H VAL A 5 -4.635 -24.402 5.398 1.00 0.00 H new ATOM 0 HA VAL A 5 -3.394 -22.381 3.780 1.00 0.00 H new ATOM 0 HB VAL A 5 -5.846 -24.138 3.430 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -5.753 -23.540 1.046 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -6.087 -22.129 2.079 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -4.460 -22.369 1.399 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -4.398 -25.397 1.867 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -3.042 -24.317 2.270 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -3.736 -25.378 3.518 1.00 0.00 H new ATOM 71 N ALA A 6 -6.396 -21.869 5.098 1.00 0.00 N ATOM 72 CA ALA A 6 -7.377 -20.836 5.424 1.00 0.00 C ATOM 73 C ALA A 6 -6.842 -19.857 6.462 1.00 0.00 C ATOM 74 O ALA A 6 -7.319 -18.732 6.556 1.00 0.00 O ATOM 75 CB ALA A 6 -8.686 -21.448 5.881 1.00 0.00 C ATOM 0 H ALA A 6 -6.631 -22.798 5.448 1.00 0.00 H new ATOM 0 HA ALA A 6 -7.568 -20.273 4.510 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -9.396 -20.655 6.116 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -9.092 -22.074 5.086 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -8.513 -22.056 6.769 1.00 0.00 H new ATOM 81 N SER A 7 -5.830 -20.266 7.216 1.00 0.00 N ATOM 82 CA SER A 7 -5.226 -19.380 8.201 1.00 0.00 C ATOM 83 C SER A 7 -4.512 -18.259 7.453 1.00 0.00 C ATOM 84 O SER A 7 -4.380 -17.137 7.938 1.00 0.00 O ATOM 85 CB SER A 7 -4.239 -20.143 9.091 1.00 0.00 C ATOM 86 OG SER A 7 -3.716 -19.317 10.122 1.00 0.00 O ATOM 0 H SER A 7 -5.414 -21.196 7.165 1.00 0.00 H new ATOM 0 HA SER A 7 -5.999 -18.969 8.850 1.00 0.00 H new ATOM 0 HB2 SER A 7 -4.739 -21.005 9.533 1.00 0.00 H new ATOM 0 HB3 SER A 7 -3.421 -20.527 8.482 1.00 0.00 H new ATOM 0 HG SER A 7 -3.092 -19.835 10.671 1.00 0.00 H new ATOM 92 N LEU A 8 -4.083 -18.570 6.240 1.00 0.00 N ATOM 93 CA LEU A 8 -3.410 -17.594 5.416 1.00 0.00 C ATOM 94 C LEU A 8 -4.406 -16.580 4.862 1.00 0.00 C ATOM 95 O LEU A 8 -4.033 -15.460 4.534 1.00 0.00 O ATOM 96 CB LEU A 8 -2.644 -18.288 4.288 1.00 0.00 C ATOM 97 CG LEU A 8 -1.936 -17.356 3.312 1.00 0.00 C ATOM 98 CD1 LEU A 8 -0.904 -16.508 4.033 1.00 0.00 C ATOM 99 CD2 LEU A 8 -1.277 -18.158 2.209 1.00 0.00 C ATOM 0 H LEU A 8 -4.191 -19.489 5.811 1.00 0.00 H new ATOM 0 HA LEU A 8 -2.691 -17.054 6.032 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -1.904 -18.954 4.730 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.341 -18.912 3.728 1.00 0.00 H new ATOM 0 HG LEU A 8 -2.678 -16.691 2.870 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -0.410 -15.850 3.318 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.396 -15.908 4.798 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.163 -17.156 4.501 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.774 -17.481 1.518 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.547 -18.842 2.643 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.034 -18.729 1.672 1.00 0.00 H new ATOM 111 N ARG A 9 -5.681 -16.959 4.789 1.00 0.00 N ATOM 112 CA ARG A 9 -6.711 -16.037 4.307 1.00 0.00 C ATOM 113 C ARG A 9 -6.915 -14.931 5.335 1.00 0.00 C ATOM 114 O ARG A 9 -7.383 -13.848 5.005 1.00 0.00 O ATOM 115 CB ARG A 9 -8.069 -16.724 4.066 1.00 0.00 C ATOM 116 CG ARG A 9 -8.017 -18.174 3.612 1.00 0.00 C ATOM 117 CD ARG A 9 -7.160 -18.379 2.378 1.00 0.00 C ATOM 118 NE ARG A 9 -7.339 -19.704 1.804 1.00 0.00 N ATOM 119 CZ ARG A 9 -8.411 -20.073 1.107 1.00 0.00 C ATOM 120 NH1 ARG A 9 -9.392 -19.203 0.867 1.00 0.00 N ATOM 121 NH2 ARG A 9 -8.496 -21.308 0.648 1.00 0.00 N ATOM 0 H ARG A 9 -6.023 -17.883 5.053 1.00 0.00 H new ATOM 0 HA ARG A 9 -6.360 -15.643 3.353 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -8.646 -16.675 4.989 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -8.615 -16.150 3.317 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -7.628 -18.789 4.424 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -9.030 -18.521 3.406 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -7.411 -17.624 1.633 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -6.111 -18.235 2.637 1.00 0.00 H new ATOM 0 HE ARG A 9 -6.598 -20.391 1.944 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -9.324 -18.248 1.218 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -10.211 -19.492 0.332 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -7.743 -21.972 0.828 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -9.315 -21.598 0.113 1.00 0.00 H new ATOM 135 N GLN A 10 -6.542 -15.194 6.584 1.00 0.00 N ATOM 136 CA GLN A 10 -6.676 -14.189 7.627 1.00 0.00 C ATOM 137 C GLN A 10 -5.602 -13.138 7.419 1.00 0.00 C ATOM 138 O GLN A 10 -5.836 -11.934 7.568 1.00 0.00 O ATOM 139 CB GLN A 10 -6.534 -14.820 9.012 1.00 0.00 C ATOM 140 CG GLN A 10 -6.902 -16.290 9.047 1.00 0.00 C ATOM 141 CD GLN A 10 -6.878 -16.855 10.452 1.00 0.00 C ATOM 142 OE1 GLN A 10 -5.884 -16.725 11.166 1.00 0.00 O ATOM 143 NE2 GLN A 10 -7.968 -17.489 10.853 1.00 0.00 N ATOM 0 H GLN A 10 -6.150 -16.083 6.894 1.00 0.00 H new ATOM 0 HA GLN A 10 -7.665 -13.734 7.570 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -5.505 -14.703 9.352 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -7.166 -14.278 9.716 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -7.896 -16.424 8.621 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -6.209 -16.851 8.420 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -8.769 -17.573 10.227 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -8.007 -17.894 11.788 1.00 0.00 H new ATOM 152 N GLN A 11 -4.422 -13.620 7.040 1.00 0.00 N ATOM 153 CA GLN A 11 -3.284 -12.759 6.770 1.00 0.00 C ATOM 154 C GLN A 11 -3.515 -11.948 5.499 1.00 0.00 C ATOM 155 O GLN A 11 -3.066 -10.813 5.398 1.00 0.00 O ATOM 156 CB GLN A 11 -2.003 -13.593 6.638 1.00 0.00 C ATOM 157 CG GLN A 11 -1.713 -14.482 7.839 1.00 0.00 C ATOM 158 CD GLN A 11 -1.532 -13.708 9.130 1.00 0.00 C ATOM 159 OE1 GLN A 11 -2.469 -13.091 9.637 1.00 0.00 O ATOM 160 NE2 GLN A 11 -0.323 -13.732 9.670 1.00 0.00 N ATOM 0 H GLN A 11 -4.232 -14.614 6.913 1.00 0.00 H new ATOM 0 HA GLN A 11 -3.170 -12.069 7.606 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -2.079 -14.217 5.748 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -1.159 -12.921 6.485 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -2.530 -15.193 7.962 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -0.812 -15.063 7.643 1.00 0.00 H new ATOM 0 HE21 GLN A 11 0.427 -14.255 9.218 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -0.142 -13.227 10.538 1.00 0.00 H new ATOM 169 N VAL A 12 -4.221 -12.525 4.525 1.00 0.00 N ATOM 170 CA VAL A 12 -4.485 -11.810 3.285 1.00 0.00 C ATOM 171 C VAL A 12 -5.548 -10.738 3.497 1.00 0.00 C ATOM 172 O VAL A 12 -5.491 -9.676 2.882 1.00 0.00 O ATOM 173 CB VAL A 12 -4.868 -12.755 2.115 1.00 0.00 C ATOM 174 CG1 VAL A 12 -3.756 -13.758 1.858 1.00 0.00 C ATOM 175 CG2 VAL A 12 -6.175 -13.470 2.363 1.00 0.00 C ATOM 0 H VAL A 12 -4.611 -13.466 4.572 1.00 0.00 H new ATOM 0 HA VAL A 12 -3.553 -11.325 2.995 1.00 0.00 H new ATOM 0 HB VAL A 12 -5.002 -12.134 1.229 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -4.040 -14.413 1.035 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -2.840 -13.227 1.600 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -3.589 -14.354 2.755 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -6.401 -14.119 1.517 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -6.095 -14.070 3.270 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -6.974 -12.738 2.481 1.00 0.00 H new ATOM 185 N GLU A 13 -6.486 -10.989 4.415 1.00 0.00 N ATOM 186 CA GLU A 13 -7.505 -9.994 4.733 1.00 0.00 C ATOM 187 C GLU A 13 -6.838 -8.848 5.479 1.00 0.00 C ATOM 188 O GLU A 13 -7.237 -7.686 5.372 1.00 0.00 O ATOM 189 CB GLU A 13 -8.634 -10.595 5.569 1.00 0.00 C ATOM 190 CG GLU A 13 -9.456 -11.634 4.824 1.00 0.00 C ATOM 191 CD GLU A 13 -10.636 -12.118 5.627 1.00 0.00 C ATOM 192 OE1 GLU A 13 -11.515 -11.293 5.939 1.00 0.00 O ATOM 193 OE2 GLU A 13 -10.691 -13.321 5.943 1.00 0.00 O ATOM 0 H GLU A 13 -6.558 -11.859 4.942 1.00 0.00 H new ATOM 0 HA GLU A 13 -7.954 -9.631 3.808 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -8.209 -11.052 6.463 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -9.293 -9.794 5.904 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -9.809 -11.208 3.885 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -8.820 -12.482 4.570 1.00 0.00 H new ATOM 200 N ALA A 14 -5.782 -9.190 6.200 1.00 0.00 N ATOM 201 CA ALA A 14 -4.995 -8.216 6.930 1.00 0.00 C ATOM 202 C ALA A 14 -4.312 -7.278 5.953 1.00 0.00 C ATOM 203 O ALA A 14 -4.420 -6.056 6.046 1.00 0.00 O ATOM 204 CB ALA A 14 -3.944 -8.936 7.735 1.00 0.00 C ATOM 0 H ALA A 14 -5.449 -10.150 6.294 1.00 0.00 H new ATOM 0 HA ALA A 14 -5.646 -7.644 7.591 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -3.348 -8.210 8.287 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -4.426 -9.618 8.436 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -3.297 -9.502 7.065 1.00 0.00 H new ATOM 210 N LEU A 15 -3.604 -7.893 5.010 1.00 0.00 N ATOM 211 CA LEU A 15 -2.870 -7.178 3.973 1.00 0.00 C ATOM 212 C LEU A 15 -3.785 -6.276 3.159 1.00 0.00 C ATOM 213 O LEU A 15 -3.393 -5.179 2.761 1.00 0.00 O ATOM 214 CB LEU A 15 -2.187 -8.180 3.032 1.00 0.00 C ATOM 215 CG LEU A 15 -0.735 -8.529 3.369 1.00 0.00 C ATOM 216 CD1 LEU A 15 0.138 -7.307 3.201 1.00 0.00 C ATOM 217 CD2 LEU A 15 -0.610 -9.084 4.777 1.00 0.00 C ATOM 0 H LEU A 15 -3.524 -8.908 4.944 1.00 0.00 H new ATOM 0 HA LEU A 15 -2.124 -6.556 4.467 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -2.770 -9.101 3.028 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -2.218 -7.778 2.019 1.00 0.00 H new ATOM 0 HG LEU A 15 -0.401 -9.305 2.680 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.170 -7.561 3.442 1.00 0.00 H new ATOM 0 HD12 LEU A 15 0.082 -6.959 2.170 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -0.207 -6.519 3.870 1.00 0.00 H new ATOM 0 HD21 LEU A 15 0.434 -9.321 4.983 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.962 -8.342 5.493 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -1.212 -9.988 4.866 1.00 0.00 H new ATOM 229 N GLN A 16 -5.004 -6.742 2.902 1.00 0.00 N ATOM 230 CA GLN A 16 -5.947 -5.955 2.109 1.00 0.00 C ATOM 231 C GLN A 16 -6.543 -4.828 2.926 1.00 0.00 C ATOM 232 O GLN A 16 -6.939 -3.812 2.376 1.00 0.00 O ATOM 233 CB GLN A 16 -7.051 -6.824 1.484 1.00 0.00 C ATOM 234 CG GLN A 16 -7.993 -7.471 2.481 1.00 0.00 C ATOM 235 CD GLN A 16 -9.046 -8.331 1.812 1.00 0.00 C ATOM 236 OE1 GLN A 16 -8.727 -9.302 1.126 1.00 0.00 O ATOM 237 NE2 GLN A 16 -10.307 -7.979 2.007 1.00 0.00 N ATOM 0 H GLN A 16 -5.359 -7.643 3.223 1.00 0.00 H new ATOM 0 HA GLN A 16 -5.379 -5.518 1.287 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -7.635 -6.208 0.801 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -6.583 -7.607 0.887 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -7.417 -8.082 3.176 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -8.483 -6.695 3.069 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -10.526 -7.166 2.583 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -11.059 -8.520 1.581 1.00 0.00 H new ATOM 246 N GLY A 17 -6.579 -4.981 4.238 1.00 0.00 N ATOM 247 CA GLY A 17 -7.103 -3.920 5.072 1.00 0.00 C ATOM 248 C GLY A 17 -6.168 -2.731 5.075 1.00 0.00 C ATOM 249 O GLY A 17 -6.592 -1.566 5.066 1.00 0.00 O ATOM 0 H GLY A 17 -6.259 -5.811 4.738 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -8.085 -3.616 4.708 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -7.239 -4.285 6.090 1.00 0.00 H new ATOM 253 N GLN A 18 -4.880 -3.032 5.067 1.00 0.00 N ATOM 254 CA GLN A 18 -3.857 -2.006 5.069 1.00 0.00 C ATOM 255 C GLN A 18 -3.768 -1.310 3.717 1.00 0.00 C ATOM 256 O GLN A 18 -3.705 -0.091 3.645 1.00 0.00 O ATOM 257 CB GLN A 18 -2.499 -2.608 5.432 1.00 0.00 C ATOM 258 CG GLN A 18 -2.505 -3.421 6.712 1.00 0.00 C ATOM 259 CD GLN A 18 -1.148 -4.012 7.028 1.00 0.00 C ATOM 260 OE1 GLN A 18 -0.627 -4.835 6.275 1.00 0.00 O ATOM 261 NE2 GLN A 18 -0.563 -3.591 8.134 1.00 0.00 N ATOM 0 H GLN A 18 -4.519 -3.986 5.059 1.00 0.00 H new ATOM 0 HA GLN A 18 -4.134 -1.264 5.818 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -2.164 -3.243 4.612 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -1.771 -1.803 5.529 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -2.824 -2.788 7.540 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -3.237 -4.224 6.625 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -1.030 -2.908 8.730 1.00 0.00 H new ATOM 0 HE22 GLN A 18 0.356 -3.949 8.393 1.00 0.00 H new ATOM 270 N VAL A 19 -3.749 -2.073 2.645 1.00 0.00 N ATOM 271 CA VAL A 19 -3.644 -1.479 1.322 1.00 0.00 C ATOM 272 C VAL A 19 -4.916 -0.718 0.941 1.00 0.00 C ATOM 273 O VAL A 19 -4.847 0.290 0.238 1.00 0.00 O ATOM 274 CB VAL A 19 -3.311 -2.558 0.262 1.00 0.00 C ATOM 275 CG1 VAL A 19 -4.431 -3.572 0.150 1.00 0.00 C ATOM 276 CG2 VAL A 19 -3.038 -1.949 -1.097 1.00 0.00 C ATOM 0 H VAL A 19 -3.804 -3.091 2.658 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.827 -0.758 1.350 1.00 0.00 H new ATOM 0 HB VAL A 19 -2.404 -3.061 0.598 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -4.172 -4.318 -0.601 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -4.576 -4.061 1.113 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -5.351 -3.067 -0.143 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.809 -2.740 -1.811 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.918 -1.401 -1.433 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -2.191 -1.267 -1.027 1.00 0.00 H new ATOM 286 N GLN A 20 -6.072 -1.188 1.404 1.00 0.00 N ATOM 287 CA GLN A 20 -7.327 -0.520 1.083 1.00 0.00 C ATOM 288 C GLN A 20 -7.397 0.844 1.744 1.00 0.00 C ATOM 289 O GLN A 20 -7.843 1.803 1.123 1.00 0.00 O ATOM 290 CB GLN A 20 -8.547 -1.359 1.474 1.00 0.00 C ATOM 291 CG GLN A 20 -8.795 -1.468 2.970 1.00 0.00 C ATOM 292 CD GLN A 20 -10.018 -2.306 3.276 1.00 0.00 C ATOM 293 OE1 GLN A 20 -9.806 -3.564 3.630 1.00 0.00 O flip ATOM 294 NE2 GLN A 20 -11.148 -1.834 3.148 1.00 0.00 N flip ATOM 0 H GLN A 20 -6.164 -2.015 1.993 1.00 0.00 H new ATOM 0 HA GLN A 20 -7.349 -0.393 0.001 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -9.431 -0.929 1.004 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -8.426 -2.363 1.066 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -7.922 -1.908 3.452 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -8.923 -0.471 3.391 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -11.265 -0.859 2.873 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -11.967 -2.418 3.317 1.00 0.00 H new ATOM 303 N HIS A 21 -6.963 0.948 3.004 1.00 0.00 N ATOM 304 CA HIS A 21 -7.014 2.240 3.670 1.00 0.00 C ATOM 305 C HIS A 21 -5.849 3.121 3.209 1.00 0.00 C ATOM 306 O HIS A 21 -5.915 4.339 3.319 1.00 0.00 O ATOM 307 CB HIS A 21 -7.078 2.103 5.198 1.00 0.00 C ATOM 308 CG HIS A 21 -5.762 2.004 5.863 1.00 0.00 C ATOM 309 ND1 HIS A 21 -4.969 0.913 5.750 1.00 0.00 N ATOM 310 CD2 HIS A 21 -5.082 2.904 6.615 1.00 0.00 C ATOM 311 CE1 HIS A 21 -3.848 1.154 6.406 1.00 0.00 C ATOM 312 NE2 HIS A 21 -3.852 2.347 6.957 1.00 0.00 N ATOM 0 H HIS A 21 -6.587 0.181 3.561 1.00 0.00 H new ATOM 0 HA HIS A 21 -7.941 2.735 3.380 1.00 0.00 H new ATOM 0 HB2 HIS A 21 -7.612 2.962 5.604 1.00 0.00 H new ATOM 0 HB3 HIS A 21 -7.663 1.217 5.446 1.00 0.00 H new ATOM 0 HD2 HIS A 21 -5.434 3.885 6.900 1.00 0.00 H new ATOM 0 HE1 HIS A 21 -3.028 0.455 6.480 1.00 0.00 H new ATOM 0 HE2 HIS A 21 -3.113 2.774 7.515 1.00 0.00 H new ATOM 320 N LEU A 22 -4.805 2.502 2.647 1.00 0.00 N ATOM 321 CA LEU A 22 -3.667 3.261 2.127 1.00 0.00 C ATOM 322 C LEU A 22 -4.087 3.974 0.859 1.00 0.00 C ATOM 323 O LEU A 22 -3.787 5.144 0.664 1.00 0.00 O ATOM 324 CB LEU A 22 -2.460 2.368 1.822 1.00 0.00 C ATOM 325 CG LEU A 22 -1.686 1.867 3.038 1.00 0.00 C ATOM 326 CD1 LEU A 22 -0.352 1.286 2.609 1.00 0.00 C ATOM 327 CD2 LEU A 22 -1.480 2.985 4.042 1.00 0.00 C ATOM 0 H LEU A 22 -4.726 1.490 2.542 1.00 0.00 H new ATOM 0 HA LEU A 22 -3.365 3.973 2.896 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -2.804 1.505 1.252 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -1.774 2.921 1.180 1.00 0.00 H new ATOM 0 HG LEU A 22 -2.270 1.082 3.518 1.00 0.00 H new ATOM 0 HD11 LEU A 22 0.190 0.932 3.486 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -0.521 0.453 1.926 1.00 0.00 H new ATOM 0 HD13 LEU A 22 0.235 2.055 2.106 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -0.926 2.605 4.901 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.917 3.794 3.576 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -2.449 3.361 4.372 1.00 0.00 H new ATOM 339 N GLN A 23 -4.807 3.252 0.008 1.00 0.00 N ATOM 340 CA GLN A 23 -5.305 3.812 -1.238 1.00 0.00 C ATOM 341 C GLN A 23 -6.403 4.814 -0.904 1.00 0.00 C ATOM 342 O GLN A 23 -6.561 5.834 -1.572 1.00 0.00 O ATOM 343 CB GLN A 23 -5.850 2.687 -2.135 1.00 0.00 C ATOM 344 CG GLN A 23 -5.818 2.982 -3.630 1.00 0.00 C ATOM 345 CD GLN A 23 -6.810 4.046 -4.052 1.00 0.00 C ATOM 346 OE1 GLN A 23 -8.020 3.904 -3.847 1.00 0.00 O ATOM 347 NE2 GLN A 23 -6.311 5.120 -4.648 1.00 0.00 N ATOM 0 H GLN A 23 -5.058 2.275 0.161 1.00 0.00 H new ATOM 0 HA GLN A 23 -4.503 4.314 -1.778 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -5.274 1.781 -1.946 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -6.879 2.477 -1.843 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -4.814 3.300 -3.909 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -6.025 2.064 -4.179 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -5.305 5.199 -4.799 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -6.933 5.868 -4.956 1.00 0.00 H new ATOM 356 N ALA A 24 -7.133 4.509 0.162 1.00 0.00 N ATOM 357 CA ALA A 24 -8.203 5.360 0.651 1.00 0.00 C ATOM 358 C ALA A 24 -7.663 6.740 0.958 1.00 0.00 C ATOM 359 O ALA A 24 -8.134 7.741 0.423 1.00 0.00 O ATOM 360 CB ALA A 24 -8.808 4.743 1.899 1.00 0.00 C ATOM 0 H ALA A 24 -6.996 3.661 0.711 1.00 0.00 H new ATOM 0 HA ALA A 24 -8.975 5.450 -0.113 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -9.612 5.381 2.267 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -9.207 3.757 1.661 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -8.040 4.647 2.667 1.00 0.00 H new ATOM 366 N ALA A 25 -6.651 6.773 1.814 1.00 0.00 N ATOM 367 CA ALA A 25 -6.005 8.015 2.194 1.00 0.00 C ATOM 368 C ALA A 25 -5.369 8.667 0.978 1.00 0.00 C ATOM 369 O ALA A 25 -5.452 9.879 0.799 1.00 0.00 O ATOM 370 CB ALA A 25 -4.958 7.758 3.270 1.00 0.00 C ATOM 0 H ALA A 25 -6.259 5.944 2.260 1.00 0.00 H new ATOM 0 HA ALA A 25 -6.757 8.693 2.599 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -4.481 8.699 3.546 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -5.437 7.323 4.147 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -4.206 7.068 2.888 1.00 0.00 H new ATOM 376 N PHE A 26 -4.739 7.843 0.136 1.00 0.00 N ATOM 377 CA PHE A 26 -4.082 8.323 -1.079 1.00 0.00 C ATOM 378 C PHE A 26 -5.049 9.074 -1.975 1.00 0.00 C ATOM 379 O PHE A 26 -4.629 9.910 -2.749 1.00 0.00 O ATOM 380 CB PHE A 26 -3.494 7.169 -1.893 1.00 0.00 C ATOM 381 CG PHE A 26 -2.012 7.243 -2.097 1.00 0.00 C ATOM 382 CD1 PHE A 26 -1.340 8.452 -1.989 1.00 0.00 C ATOM 383 CD2 PHE A 26 -1.291 6.105 -2.419 1.00 0.00 C ATOM 384 CE1 PHE A 26 0.018 8.519 -2.192 1.00 0.00 C ATOM 385 CE2 PHE A 26 0.069 6.168 -2.627 1.00 0.00 C ATOM 386 CZ PHE A 26 0.725 7.376 -2.512 1.00 0.00 C ATOM 0 H PHE A 26 -4.671 6.835 0.276 1.00 0.00 H new ATOM 0 HA PHE A 26 -3.286 8.989 -0.748 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -3.733 6.230 -1.393 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -3.981 7.144 -2.868 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -1.889 9.349 -1.743 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -1.801 5.157 -2.508 1.00 0.00 H new ATOM 0 HE1 PHE A 26 0.532 9.465 -2.101 1.00 0.00 H new ATOM 0 HE2 PHE A 26 0.620 5.274 -2.879 1.00 0.00 H new ATOM 0 HZ PHE A 26 1.792 7.428 -2.672 1.00 0.00 H new ATOM 396 N SER A 27 -6.344 8.769 -1.880 1.00 0.00 N ATOM 397 CA SER A 27 -7.344 9.440 -2.711 1.00 0.00 C ATOM 398 C SER A 27 -7.222 10.959 -2.568 1.00 0.00 C ATOM 399 O SER A 27 -7.544 11.716 -3.486 1.00 0.00 O ATOM 400 CB SER A 27 -8.756 8.963 -2.347 1.00 0.00 C ATOM 401 OG SER A 27 -9.723 9.483 -3.246 1.00 0.00 O ATOM 0 H SER A 27 -6.722 8.069 -1.242 1.00 0.00 H new ATOM 0 HA SER A 27 -7.162 9.181 -3.754 1.00 0.00 H new ATOM 0 HB2 SER A 27 -8.790 7.874 -2.363 1.00 0.00 H new ATOM 0 HB3 SER A 27 -8.997 9.274 -1.330 1.00 0.00 H new ATOM 0 HG SER A 27 -10.613 9.162 -2.991 1.00 0.00 H new ATOM 407 N GLN A 28 -6.713 11.394 -1.423 1.00 0.00 N ATOM 408 CA GLN A 28 -6.499 12.806 -1.158 1.00 0.00 C ATOM 409 C GLN A 28 -5.077 13.215 -1.540 1.00 0.00 C ATOM 410 O GLN A 28 -4.871 14.163 -2.290 1.00 0.00 O ATOM 411 CB GLN A 28 -6.737 13.109 0.329 1.00 0.00 C ATOM 412 CG GLN A 28 -8.139 12.768 0.820 1.00 0.00 C ATOM 413 CD GLN A 28 -9.181 13.789 0.406 1.00 0.00 C ATOM 414 OE1 GLN A 28 -8.733 14.942 -0.069 1.00 0.00 O flip ATOM 415 NE2 GLN A 28 -10.382 13.553 0.540 1.00 0.00 N flip ATOM 0 H GLN A 28 -6.439 10.779 -0.657 1.00 0.00 H new ATOM 0 HA GLN A 28 -7.206 13.377 -1.761 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -6.011 12.553 0.922 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -6.549 14.168 0.507 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -8.425 11.790 0.433 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -8.127 12.690 1.907 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -10.687 12.652 0.909 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -11.072 14.258 0.281 1.00 0.00 H new ATOM 424 N TYR A 29 -4.102 12.495 -1.001 1.00 0.00 N ATOM 425 CA TYR A 29 -2.684 12.776 -1.241 1.00 0.00 C ATOM 426 C TYR A 29 -2.282 12.614 -2.702 1.00 0.00 C ATOM 427 O TYR A 29 -1.253 13.136 -3.127 1.00 0.00 O ATOM 428 CB TYR A 29 -1.845 11.860 -0.377 1.00 0.00 C ATOM 429 CG TYR A 29 -2.322 11.856 1.043 1.00 0.00 C ATOM 430 CD1 TYR A 29 -2.404 13.031 1.775 1.00 0.00 C ATOM 431 CD2 TYR A 29 -2.737 10.683 1.634 1.00 0.00 C ATOM 432 CE1 TYR A 29 -2.886 13.029 3.059 1.00 0.00 C ATOM 433 CE2 TYR A 29 -3.216 10.667 2.918 1.00 0.00 C ATOM 434 CZ TYR A 29 -3.295 11.843 3.632 1.00 0.00 C ATOM 435 OH TYR A 29 -3.779 11.830 4.917 1.00 0.00 O ATOM 0 H TYR A 29 -4.267 11.699 -0.385 1.00 0.00 H new ATOM 0 HA TYR A 29 -2.511 13.821 -0.982 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -1.881 10.847 -0.777 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -0.803 12.179 -0.411 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -2.084 13.960 1.328 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -2.684 9.760 1.076 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -2.945 13.951 3.618 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -3.530 9.737 3.368 1.00 0.00 H new ATOM 0 HH TYR A 29 -3.310 12.505 5.450 1.00 0.00 H new ATOM 445 N LYS A 30 -3.075 11.880 -3.460 1.00 0.00 N ATOM 446 CA LYS A 30 -2.779 11.645 -4.866 1.00 0.00 C ATOM 447 C LYS A 30 -2.894 12.945 -5.670 1.00 0.00 C ATOM 448 O LYS A 30 -2.259 13.099 -6.711 1.00 0.00 O ATOM 449 CB LYS A 30 -3.702 10.561 -5.433 1.00 0.00 C ATOM 450 CG LYS A 30 -5.130 11.029 -5.651 1.00 0.00 C ATOM 451 CD LYS A 30 -5.885 10.204 -6.690 1.00 0.00 C ATOM 452 CE LYS A 30 -5.918 8.715 -6.367 1.00 0.00 C ATOM 453 NZ LYS A 30 -4.736 7.986 -6.911 1.00 0.00 N ATOM 0 H LYS A 30 -3.930 11.435 -3.128 1.00 0.00 H new ATOM 0 HA LYS A 30 -1.751 11.292 -4.949 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -3.295 10.209 -6.381 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -3.708 9.709 -4.753 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -5.667 10.987 -4.704 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -5.119 12.073 -5.965 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -6.907 10.575 -6.766 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -5.420 10.347 -7.666 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -5.957 8.582 -5.286 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -6.830 8.278 -6.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -5.012 7.015 -7.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -4.385 8.477 -7.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -3.985 7.957 -6.192 1.00 0.00 H new ATOM 467 N LYS A 31 -3.678 13.897 -5.165 1.00 0.00 N ATOM 468 CA LYS A 31 -3.830 15.188 -5.827 1.00 0.00 C ATOM 469 C LYS A 31 -3.145 16.272 -5.003 1.00 0.00 C ATOM 470 O LYS A 31 -3.588 17.420 -4.946 1.00 0.00 O ATOM 471 CB LYS A 31 -5.317 15.507 -6.078 1.00 0.00 C ATOM 472 CG LYS A 31 -6.227 15.278 -4.879 1.00 0.00 C ATOM 473 CD LYS A 31 -6.263 16.481 -3.949 1.00 0.00 C ATOM 474 CE LYS A 31 -7.175 16.240 -2.759 1.00 0.00 C ATOM 475 NZ LYS A 31 -8.585 16.005 -3.178 1.00 0.00 N ATOM 0 H LYS A 31 -4.215 13.798 -4.303 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.347 15.149 -6.803 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -5.404 16.548 -6.390 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -5.671 14.895 -6.908 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -7.236 15.059 -5.227 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -5.884 14.403 -4.326 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -5.255 16.700 -3.597 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -6.606 17.357 -4.499 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -6.816 15.379 -2.195 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -7.134 17.100 -2.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -9.210 16.081 -2.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -8.860 16.716 -3.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -8.671 15.054 -3.591 1.00 0.00 H new ATOM 489 N VAL A 32 -2.049 15.883 -4.368 1.00 0.00 N ATOM 490 CA VAL A 32 -1.270 16.788 -3.540 1.00 0.00 C ATOM 491 C VAL A 32 -0.060 17.325 -4.306 1.00 0.00 C ATOM 492 O VAL A 32 0.339 18.479 -4.118 1.00 0.00 O ATOM 493 CB VAL A 32 -0.831 16.089 -2.233 1.00 0.00 C ATOM 494 CG1 VAL A 32 0.342 16.792 -1.576 1.00 0.00 C ATOM 495 CG2 VAL A 32 -2.000 16.005 -1.270 1.00 0.00 C ATOM 0 H VAL A 32 -1.677 14.934 -4.413 1.00 0.00 H new ATOM 0 HA VAL A 32 -1.902 17.636 -3.276 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.502 15.083 -2.493 1.00 0.00 H new ATOM 0 HG11 VAL A 32 0.616 16.266 -0.661 1.00 0.00 H new ATOM 0 HG12 VAL A 32 1.191 16.798 -2.259 1.00 0.00 H new ATOM 0 HG13 VAL A 32 0.063 17.818 -1.335 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -1.681 15.511 -0.352 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -2.353 17.010 -1.037 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -2.808 15.434 -1.727 1.00 0.00 H new ATOM 505 N GLU A 33 0.521 16.516 -5.191 1.00 0.00 N ATOM 506 CA GLU A 33 1.662 16.987 -5.963 1.00 0.00 C ATOM 507 C GLU A 33 1.232 17.620 -7.262 1.00 0.00 C ATOM 508 O GLU A 33 1.149 16.985 -8.319 1.00 0.00 O ATOM 509 CB GLU A 33 2.665 15.908 -6.253 1.00 0.00 C ATOM 510 CG GLU A 33 3.919 16.442 -6.932 1.00 0.00 C ATOM 511 CD GLU A 33 4.779 15.357 -7.531 1.00 0.00 C ATOM 512 OE1 GLU A 33 5.327 14.545 -6.773 1.00 0.00 O ATOM 513 OE2 GLU A 33 4.890 15.315 -8.771 1.00 0.00 O ATOM 0 H GLU A 33 0.229 15.558 -5.386 1.00 0.00 H new ATOM 0 HA GLU A 33 2.144 17.735 -5.333 1.00 0.00 H new ATOM 0 HB2 GLU A 33 2.943 15.415 -5.321 1.00 0.00 H new ATOM 0 HB3 GLU A 33 2.206 15.152 -6.889 1.00 0.00 H new ATOM 0 HG2 GLU A 33 3.630 17.142 -7.716 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.507 17.003 -6.205 1.00 0.00 H new ATOM 520 N LEU A 34 0.991 18.882 -7.139 1.00 0.00 N ATOM 521 CA LEU A 34 0.585 19.749 -8.237 1.00 0.00 C ATOM 522 C LEU A 34 0.709 21.215 -7.828 1.00 0.00 C ATOM 523 O LEU A 34 1.047 22.069 -8.651 1.00 0.00 O ATOM 524 CB LEU A 34 -0.815 19.402 -8.775 1.00 0.00 C ATOM 525 CG LEU A 34 -2.009 19.298 -7.807 1.00 0.00 C ATOM 526 CD1 LEU A 34 -2.755 18.007 -8.063 1.00 0.00 C ATOM 527 CD2 LEU A 34 -1.679 19.421 -6.341 1.00 0.00 C ATOM 0 H LEU A 34 1.069 19.372 -6.248 1.00 0.00 H new ATOM 0 HA LEU A 34 1.266 19.576 -9.070 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.069 20.152 -9.524 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.735 18.447 -9.295 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.628 20.169 -8.023 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.600 17.933 -7.378 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -3.118 17.994 -9.091 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -2.085 17.162 -7.905 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -2.593 19.333 -5.754 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.987 18.629 -6.056 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -1.218 20.390 -6.152 1.00 0.00 H new ATOM 539 N PHE A 35 0.491 21.496 -6.545 1.00 0.00 N ATOM 540 CA PHE A 35 0.649 22.856 -6.031 1.00 0.00 C ATOM 541 C PHE A 35 2.136 23.220 -5.998 1.00 0.00 C ATOM 542 O PHE A 35 2.556 24.165 -6.660 1.00 0.00 O ATOM 543 CB PHE A 35 0.030 23.046 -4.634 1.00 0.00 C ATOM 544 CG PHE A 35 -1.462 23.218 -4.631 1.00 0.00 C ATOM 545 CD1 PHE A 35 -2.303 22.128 -4.747 1.00 0.00 C ATOM 546 CD2 PHE A 35 -2.022 24.480 -4.526 1.00 0.00 C ATOM 547 CE1 PHE A 35 -3.678 22.289 -4.759 1.00 0.00 C ATOM 548 CE2 PHE A 35 -3.392 24.650 -4.535 1.00 0.00 C ATOM 549 CZ PHE A 35 -4.221 23.555 -4.654 1.00 0.00 C ATOM 0 H PHE A 35 0.207 20.808 -5.848 1.00 0.00 H new ATOM 0 HA PHE A 35 0.110 23.521 -6.706 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.285 22.184 -4.018 1.00 0.00 H new ATOM 0 HB3 PHE A 35 0.484 23.919 -4.165 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -1.882 21.137 -4.829 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -1.379 25.343 -4.436 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -4.324 21.428 -4.850 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.814 25.640 -4.449 1.00 0.00 H new ATOM 0 HZ PHE A 35 -5.293 23.687 -4.665 1.00 0.00 H new ATOM 559 N PRO A 36 2.971 22.465 -5.249 1.00 0.00 N ATOM 560 CA PRO A 36 4.405 22.734 -5.181 1.00 0.00 C ATOM 561 C PRO A 36 5.134 22.202 -6.409 1.00 0.00 C ATOM 562 O PRO A 36 4.517 21.602 -7.295 1.00 0.00 O ATOM 563 CB PRO A 36 4.845 21.976 -3.929 1.00 0.00 C ATOM 564 CG PRO A 36 3.891 20.836 -3.815 1.00 0.00 C ATOM 565 CD PRO A 36 2.597 21.290 -4.435 1.00 0.00 C ATOM 0 HA PRO A 36 4.628 23.800 -5.147 1.00 0.00 H new ATOM 0 HB2 PRO A 36 5.872 21.624 -4.021 1.00 0.00 H new ATOM 0 HB3 PRO A 36 4.805 22.614 -3.046 1.00 0.00 H new ATOM 0 HG2 PRO A 36 4.278 19.955 -4.328 1.00 0.00 H new ATOM 0 HG3 PRO A 36 3.743 20.558 -2.771 1.00 0.00 H new ATOM 0 HD2 PRO A 36 2.154 20.506 -5.049 1.00 0.00 H new ATOM 0 HD3 PRO A 36 1.862 21.552 -3.674 1.00 0.00 H new ATOM 573 N ASN A 37 6.440 22.417 -6.460 1.00 0.00 N ATOM 574 CA ASN A 37 7.234 21.948 -7.588 1.00 0.00 C ATOM 575 C ASN A 37 7.349 20.432 -7.573 1.00 0.00 C ATOM 576 O ASN A 37 7.078 19.771 -8.575 1.00 0.00 O ATOM 577 CB ASN A 37 8.639 22.555 -7.571 1.00 0.00 C ATOM 578 CG ASN A 37 8.632 24.064 -7.638 1.00 0.00 C ATOM 579 OD1 ASN A 37 8.141 24.738 -6.734 1.00 0.00 O ATOM 580 ND2 ASN A 37 9.175 24.603 -8.716 1.00 0.00 N ATOM 0 H ASN A 37 6.970 22.909 -5.741 1.00 0.00 H new ATOM 0 HA ASN A 37 6.722 22.266 -8.496 1.00 0.00 H new ATOM 0 HB2 ASN A 37 9.154 22.240 -6.663 1.00 0.00 H new ATOM 0 HB3 ASN A 37 9.208 22.162 -8.413 1.00 0.00 H new ATOM 0 HD21 ASN A 37 9.198 25.617 -8.823 1.00 0.00 H new ATOM 0 HD22 ASN A 37 9.571 24.005 -9.441 1.00 0.00 H new ATOM 587 N GLY A 38 7.767 19.887 -6.435 1.00 0.00 N ATOM 588 CA GLY A 38 7.935 18.454 -6.319 1.00 0.00 C ATOM 589 C GLY A 38 9.289 18.027 -6.839 1.00 0.00 C ATOM 590 O GLY A 38 10.299 18.178 -6.152 1.00 0.00 O ATOM 0 H GLY A 38 7.992 20.415 -5.592 1.00 0.00 H new ATOM 0 HA2 GLY A 38 7.830 18.155 -5.276 1.00 0.00 H new ATOM 0 HA3 GLY A 38 7.149 17.945 -6.877 1.00 0.00 H new ATOM 594 N GLY A 39 9.315 17.521 -8.065 1.00 0.00 N ATOM 595 CA GLY A 39 10.565 17.109 -8.669 1.00 0.00 C ATOM 596 C GLY A 39 11.211 18.247 -9.422 1.00 0.00 C ATOM 597 O GLY A 39 11.061 18.364 -10.640 1.00 0.00 O ATOM 0 H GLY A 39 8.491 17.389 -8.652 1.00 0.00 H new ATOM 0 HA2 GLY A 39 11.244 16.750 -7.896 1.00 0.00 H new ATOM 0 HA3 GLY A 39 10.386 16.276 -9.348 1.00 0.00 H new ATOM 601 N ILE A 40 11.914 19.101 -8.693 1.00 0.00 N ATOM 602 CA ILE A 40 12.574 20.252 -9.285 1.00 0.00 C ATOM 603 C ILE A 40 14.094 20.093 -9.210 1.00 0.00 C ATOM 604 O ILE A 40 14.570 19.413 -8.282 1.00 0.00 O ATOM 605 CB ILE A 40 12.132 21.560 -8.579 1.00 0.00 C ATOM 606 CG1 ILE A 40 12.714 22.788 -9.279 1.00 0.00 C ATOM 607 CG2 ILE A 40 12.535 21.547 -7.112 1.00 0.00 C ATOM 608 CD1 ILE A 40 12.136 23.036 -10.654 1.00 0.00 C ATOM 609 OXT ILE A 40 14.796 20.638 -10.083 1.00 0.00 O ATOM 0 H ILE A 40 12.042 19.016 -7.685 1.00 0.00 H new ATOM 0 HA ILE A 40 12.282 20.313 -10.333 1.00 0.00 H new ATOM 0 HB ILE A 40 11.045 21.617 -8.639 1.00 0.00 H new ATOM 0 HG12 ILE A 40 12.539 23.666 -8.657 1.00 0.00 H new ATOM 0 HG13 ILE A 40 13.794 22.668 -9.365 1.00 0.00 H new ATOM 0 HG21 ILE A 40 12.214 22.475 -6.638 1.00 0.00 H new ATOM 0 HG22 ILE A 40 12.062 20.702 -6.612 1.00 0.00 H new ATOM 0 HG23 ILE A 40 13.618 21.455 -7.033 1.00 0.00 H new ATOM 0 HD11 ILE A 40 12.597 23.923 -11.088 1.00 0.00 H new ATOM 0 HD12 ILE A 40 12.334 22.175 -11.293 1.00 0.00 H new ATOM 0 HD13 ILE A 40 11.060 23.189 -10.574 1.00 0.00 H new TER 621 ILE A 40 ATOM 622 N GLY B 41 0.453 -29.178 -2.855 1.00 0.00 N ATOM 623 CA GLY B 41 1.132 -29.724 -1.658 1.00 0.00 C ATOM 624 C GLY B 41 1.532 -28.639 -0.680 1.00 0.00 C ATOM 625 O GLY B 41 1.249 -27.463 -0.904 1.00 0.00 O ATOM 0 HA2 GLY B 41 0.471 -30.434 -1.160 1.00 0.00 H new ATOM 0 HA3 GLY B 41 2.019 -30.277 -1.967 1.00 0.00 H new ATOM 631 N LEU B 42 2.197 -29.037 0.402 1.00 0.00 N ATOM 632 CA LEU B 42 2.652 -28.100 1.432 1.00 0.00 C ATOM 633 C LEU B 42 3.596 -27.034 0.869 1.00 0.00 C ATOM 634 O LEU B 42 3.338 -25.846 1.033 1.00 0.00 O ATOM 635 CB LEU B 42 3.322 -28.862 2.585 1.00 0.00 C ATOM 636 CG LEU B 42 2.396 -29.265 3.739 1.00 0.00 C ATOM 637 CD1 LEU B 42 1.138 -29.934 3.234 1.00 0.00 C ATOM 638 CD2 LEU B 42 3.113 -30.178 4.715 1.00 0.00 C ATOM 0 H LEU B 42 2.435 -30.011 0.591 1.00 0.00 H new ATOM 0 HA LEU B 42 1.773 -27.579 1.811 1.00 0.00 H new ATOM 0 HB2 LEU B 42 3.784 -29.763 2.181 1.00 0.00 H new ATOM 0 HB3 LEU B 42 4.126 -28.245 2.986 1.00 0.00 H new ATOM 0 HG LEU B 42 2.110 -28.350 4.258 1.00 0.00 H new ATOM 0 HD11 LEU B 42 0.506 -30.206 4.079 1.00 0.00 H new ATOM 0 HD12 LEU B 42 0.597 -29.248 2.582 1.00 0.00 H new ATOM 0 HD13 LEU B 42 1.402 -30.832 2.675 1.00 0.00 H new ATOM 0 HD21 LEU B 42 2.435 -30.450 5.524 1.00 0.00 H new ATOM 0 HD22 LEU B 42 3.440 -31.080 4.197 1.00 0.00 H new ATOM 0 HD23 LEU B 42 3.980 -29.662 5.126 1.00 0.00 H new ATOM 650 N PRO B 43 4.721 -27.433 0.235 1.00 0.00 N ATOM 651 CA PRO B 43 5.700 -26.496 -0.315 1.00 0.00 C ATOM 652 C PRO B 43 5.056 -25.433 -1.213 1.00 0.00 C ATOM 653 O PRO B 43 5.492 -24.286 -1.241 1.00 0.00 O ATOM 654 CB PRO B 43 6.668 -27.370 -1.126 1.00 0.00 C ATOM 655 CG PRO B 43 6.141 -28.769 -1.056 1.00 0.00 C ATOM 656 CD PRO B 43 5.143 -28.817 0.059 1.00 0.00 C ATOM 0 HA PRO B 43 6.195 -25.939 0.480 1.00 0.00 H new ATOM 0 HB2 PRO B 43 6.725 -27.029 -2.160 1.00 0.00 H new ATOM 0 HB3 PRO B 43 7.676 -27.315 -0.716 1.00 0.00 H new ATOM 0 HG2 PRO B 43 5.675 -29.051 -2.000 1.00 0.00 H new ATOM 0 HG3 PRO B 43 6.951 -29.476 -0.876 1.00 0.00 H new ATOM 0 HD2 PRO B 43 4.299 -29.460 -0.192 1.00 0.00 H new ATOM 0 HD3 PRO B 43 5.587 -29.215 0.971 1.00 0.00 H new ATOM 664 N ASP B 44 4.009 -25.838 -1.928 1.00 0.00 N ATOM 665 CA ASP B 44 3.265 -24.948 -2.826 1.00 0.00 C ATOM 666 C ASP B 44 2.452 -23.934 -2.028 1.00 0.00 C ATOM 667 O ASP B 44 2.323 -22.774 -2.420 1.00 0.00 O ATOM 668 CB ASP B 44 2.351 -25.796 -3.715 1.00 0.00 C ATOM 669 CG ASP B 44 1.525 -24.977 -4.670 1.00 0.00 C ATOM 670 OD1 ASP B 44 2.108 -24.209 -5.460 1.00 0.00 O ATOM 671 OD2 ASP B 44 0.287 -25.110 -4.632 1.00 0.00 O ATOM 0 H ASP B 44 3.650 -26.792 -1.903 1.00 0.00 H new ATOM 0 HA ASP B 44 3.965 -24.391 -3.449 1.00 0.00 H new ATOM 0 HB2 ASP B 44 2.959 -26.500 -4.283 1.00 0.00 H new ATOM 0 HB3 ASP B 44 1.686 -26.386 -3.084 1.00 0.00 H new ATOM 676 N VAL B 45 1.927 -24.374 -0.899 1.00 0.00 N ATOM 677 CA VAL B 45 1.154 -23.512 -0.026 1.00 0.00 C ATOM 678 C VAL B 45 2.076 -22.560 0.736 1.00 0.00 C ATOM 679 O VAL B 45 1.828 -21.356 0.801 1.00 0.00 O ATOM 680 CB VAL B 45 0.324 -24.348 0.973 1.00 0.00 C ATOM 681 CG1 VAL B 45 -0.387 -23.464 1.984 1.00 0.00 C ATOM 682 CG2 VAL B 45 -0.677 -25.221 0.234 1.00 0.00 C ATOM 0 H VAL B 45 2.024 -25.332 -0.564 1.00 0.00 H new ATOM 0 HA VAL B 45 0.472 -22.928 -0.644 1.00 0.00 H new ATOM 0 HB VAL B 45 1.014 -24.990 1.521 1.00 0.00 H new ATOM 0 HG11 VAL B 45 -0.961 -24.086 2.671 1.00 0.00 H new ATOM 0 HG12 VAL B 45 0.349 -22.888 2.545 1.00 0.00 H new ATOM 0 HG13 VAL B 45 -1.060 -22.783 1.462 1.00 0.00 H new ATOM 0 HG21 VAL B 45 -1.253 -25.803 0.953 1.00 0.00 H new ATOM 0 HG22 VAL B 45 -1.351 -24.591 -0.346 1.00 0.00 H new ATOM 0 HG23 VAL B 45 -0.146 -25.896 -0.436 1.00 0.00 H new ATOM 692 N ALA B 46 3.145 -23.104 1.315 1.00 0.00 N ATOM 693 CA ALA B 46 4.090 -22.297 2.077 1.00 0.00 C ATOM 694 C ALA B 46 4.913 -21.383 1.178 1.00 0.00 C ATOM 695 O ALA B 46 5.442 -20.374 1.636 1.00 0.00 O ATOM 696 CB ALA B 46 4.993 -23.164 2.932 1.00 0.00 C ATOM 0 H ALA B 46 3.376 -24.096 1.270 1.00 0.00 H new ATOM 0 HA ALA B 46 3.501 -21.663 2.740 1.00 0.00 H new ATOM 0 HB1 ALA B 46 5.686 -22.531 3.487 1.00 0.00 H new ATOM 0 HB2 ALA B 46 4.388 -23.741 3.632 1.00 0.00 H new ATOM 0 HB3 ALA B 46 5.556 -23.844 2.293 1.00 0.00 H new ATOM 702 N SER B 47 4.995 -21.710 -0.103 1.00 0.00 N ATOM 703 CA SER B 47 5.725 -20.869 -1.041 1.00 0.00 C ATOM 704 C SER B 47 4.964 -19.565 -1.203 1.00 0.00 C ATOM 705 O SER B 47 5.532 -18.511 -1.489 1.00 0.00 O ATOM 706 CB SER B 47 5.878 -21.560 -2.395 1.00 0.00 C ATOM 707 OG SER B 47 6.756 -20.837 -3.242 1.00 0.00 O ATOM 0 H SER B 47 4.571 -22.542 -0.514 1.00 0.00 H new ATOM 0 HA SER B 47 6.726 -20.679 -0.654 1.00 0.00 H new ATOM 0 HB2 SER B 47 6.259 -22.571 -2.250 1.00 0.00 H new ATOM 0 HB3 SER B 47 4.902 -21.652 -2.872 1.00 0.00 H new ATOM 0 HG SER B 47 6.838 -21.301 -4.101 1.00 0.00 H new ATOM 713 N LEU B 48 3.664 -19.640 -0.986 1.00 0.00 N ATOM 714 CA LEU B 48 2.827 -18.470 -1.086 1.00 0.00 C ATOM 715 C LEU B 48 3.033 -17.561 0.120 1.00 0.00 C ATOM 716 O LEU B 48 2.796 -16.362 0.037 1.00 0.00 O ATOM 717 CB LEU B 48 1.360 -18.875 -1.228 1.00 0.00 C ATOM 718 CG LEU B 48 0.364 -17.721 -1.279 1.00 0.00 C ATOM 719 CD1 LEU B 48 0.647 -16.811 -2.462 1.00 0.00 C ATOM 720 CD2 LEU B 48 -1.054 -18.251 -1.364 1.00 0.00 C ATOM 0 H LEU B 48 3.171 -20.498 -0.740 1.00 0.00 H new ATOM 0 HA LEU B 48 3.111 -17.912 -1.978 1.00 0.00 H new ATOM 0 HB2 LEU B 48 1.251 -19.467 -2.137 1.00 0.00 H new ATOM 0 HB3 LEU B 48 1.097 -19.523 -0.392 1.00 0.00 H new ATOM 0 HG LEU B 48 0.474 -17.141 -0.363 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -0.077 -15.996 -2.476 1.00 0.00 H new ATOM 0 HD12 LEU B 48 1.653 -16.401 -2.373 1.00 0.00 H new ATOM 0 HD13 LEU B 48 0.568 -17.382 -3.387 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -1.753 -17.416 -1.400 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -1.163 -18.854 -2.265 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -1.266 -18.865 -0.488 1.00 0.00 H new ATOM 732 N ARG B 49 3.504 -18.126 1.232 1.00 0.00 N ATOM 733 CA ARG B 49 3.766 -17.329 2.433 1.00 0.00 C ATOM 734 C ARG B 49 4.958 -16.417 2.179 1.00 0.00 C ATOM 735 O ARG B 49 5.115 -15.393 2.834 1.00 0.00 O ATOM 736 CB ARG B 49 4.076 -18.189 3.672 1.00 0.00 C ATOM 737 CG ARG B 49 3.379 -19.540 3.751 1.00 0.00 C ATOM 738 CD ARG B 49 1.870 -19.437 3.623 1.00 0.00 C ATOM 739 NE ARG B 49 1.199 -20.684 3.966 1.00 0.00 N ATOM 740 CZ ARG B 49 1.080 -21.144 5.207 1.00 0.00 C ATOM 741 NH1 ARG B 49 1.536 -20.439 6.233 1.00 0.00 N ATOM 742 NH2 ARG B 49 0.478 -22.295 5.417 1.00 0.00 N ATOM 0 H ARG B 49 3.710 -19.120 1.327 1.00 0.00 H new ATOM 0 HA ARG B 49 2.858 -16.762 2.638 1.00 0.00 H new ATOM 0 HB2 ARG B 49 5.152 -18.357 3.710 1.00 0.00 H new ATOM 0 HB3 ARG B 49 3.811 -17.616 4.560 1.00 0.00 H new ATOM 0 HG2 ARG B 49 3.762 -20.187 2.962 1.00 0.00 H new ATOM 0 HG3 ARG B 49 3.626 -20.015 4.700 1.00 0.00 H new ATOM 0 HD2 ARG B 49 1.506 -18.641 4.272 1.00 0.00 H new ATOM 0 HD3 ARG B 49 1.613 -19.158 2.601 1.00 0.00 H new ATOM 0 HE ARG B 49 0.797 -21.237 3.209 1.00 0.00 H new ATOM 0 HH11 ARG B 49 1.982 -19.536 6.073 1.00 0.00 H new ATOM 0 HH12 ARG B 49 1.440 -20.800 7.182 1.00 0.00 H new ATOM 0 HH21 ARG B 49 0.107 -22.827 4.630 1.00 0.00 H new ATOM 0 HH22 ARG B 49 0.383 -22.655 6.367 1.00 0.00 H new ATOM 756 N GLN B 50 5.794 -16.778 1.212 1.00 0.00 N ATOM 757 CA GLN B 50 6.947 -15.957 0.883 1.00 0.00 C ATOM 758 C GLN B 50 6.459 -14.733 0.129 1.00 0.00 C ATOM 759 O GLN B 50 6.945 -13.617 0.322 1.00 0.00 O ATOM 760 CB GLN B 50 7.945 -16.740 0.028 1.00 0.00 C ATOM 761 CG GLN B 50 7.860 -18.248 0.213 1.00 0.00 C ATOM 762 CD GLN B 50 8.946 -18.990 -0.548 1.00 0.00 C ATOM 763 OE1 GLN B 50 9.121 -18.784 -1.748 1.00 0.00 O ATOM 764 NE2 GLN B 50 9.678 -19.857 0.141 1.00 0.00 N ATOM 0 H GLN B 50 5.695 -17.623 0.650 1.00 0.00 H new ATOM 0 HA GLN B 50 7.458 -15.658 1.798 1.00 0.00 H new ATOM 0 HB2 GLN B 50 7.775 -16.502 -1.022 1.00 0.00 H new ATOM 0 HB3 GLN B 50 8.955 -16.410 0.271 1.00 0.00 H new ATOM 0 HG2 GLN B 50 7.937 -18.486 1.274 1.00 0.00 H new ATOM 0 HG3 GLN B 50 6.883 -18.597 -0.121 1.00 0.00 H new ATOM 0 HE21 GLN B 50 9.500 -19.998 1.135 1.00 0.00 H new ATOM 0 HE22 GLN B 50 10.419 -20.382 -0.324 1.00 0.00 H new ATOM 773 N GLN B 51 5.466 -14.965 -0.719 1.00 0.00 N ATOM 774 CA GLN B 51 4.865 -13.907 -1.506 1.00 0.00 C ATOM 775 C GLN B 51 4.049 -12.980 -0.614 1.00 0.00 C ATOM 776 O GLN B 51 3.968 -11.785 -0.867 1.00 0.00 O ATOM 777 CB GLN B 51 3.982 -14.494 -2.616 1.00 0.00 C ATOM 778 CG GLN B 51 4.694 -15.493 -3.517 1.00 0.00 C ATOM 779 CD GLN B 51 5.871 -14.890 -4.262 1.00 0.00 C ATOM 780 OE1 GLN B 51 6.887 -14.537 -3.662 1.00 0.00 O ATOM 781 NE2 GLN B 51 5.733 -14.753 -5.576 1.00 0.00 N ATOM 0 H GLN B 51 5.060 -15.887 -0.877 1.00 0.00 H new ATOM 0 HA GLN B 51 5.663 -13.329 -1.971 1.00 0.00 H new ATOM 0 HB2 GLN B 51 3.121 -14.983 -2.160 1.00 0.00 H new ATOM 0 HB3 GLN B 51 3.598 -13.678 -3.229 1.00 0.00 H new ATOM 0 HG2 GLN B 51 5.044 -16.331 -2.915 1.00 0.00 H new ATOM 0 HG3 GLN B 51 3.982 -15.894 -4.238 1.00 0.00 H new ATOM 0 HE21 GLN B 51 4.874 -15.059 -6.033 1.00 0.00 H new ATOM 0 HE22 GLN B 51 6.486 -14.342 -6.128 1.00 0.00 H new ATOM 790 N VAL B 52 3.446 -13.527 0.437 1.00 0.00 N ATOM 791 CA VAL B 52 2.651 -12.712 1.341 1.00 0.00 C ATOM 792 C VAL B 52 3.551 -11.866 2.235 1.00 0.00 C ATOM 793 O VAL B 52 3.199 -10.740 2.580 1.00 0.00 O ATOM 794 CB VAL B 52 1.647 -13.547 2.180 1.00 0.00 C ATOM 795 CG1 VAL B 52 0.701 -14.314 1.268 1.00 0.00 C ATOM 796 CG2 VAL B 52 2.341 -14.488 3.139 1.00 0.00 C ATOM 0 H VAL B 52 3.493 -14.517 0.679 1.00 0.00 H new ATOM 0 HA VAL B 52 2.050 -12.046 0.722 1.00 0.00 H new ATOM 0 HB VAL B 52 1.070 -12.846 2.783 1.00 0.00 H new ATOM 0 HG11 VAL B 52 0.004 -14.894 1.872 1.00 0.00 H new ATOM 0 HG12 VAL B 52 0.145 -13.612 0.647 1.00 0.00 H new ATOM 0 HG13 VAL B 52 1.275 -14.986 0.631 1.00 0.00 H new ATOM 0 HG21 VAL B 52 1.595 -15.049 3.702 1.00 0.00 H new ATOM 0 HG22 VAL B 52 2.969 -15.181 2.579 1.00 0.00 H new ATOM 0 HG23 VAL B 52 2.960 -13.914 3.828 1.00 0.00 H new ATOM 806 N GLU B 53 4.736 -12.382 2.562 1.00 0.00 N ATOM 807 CA GLU B 53 5.689 -11.620 3.360 1.00 0.00 C ATOM 808 C GLU B 53 6.231 -10.484 2.503 1.00 0.00 C ATOM 809 O GLU B 53 6.555 -9.403 2.993 1.00 0.00 O ATOM 810 CB GLU B 53 6.823 -12.513 3.862 1.00 0.00 C ATOM 811 CG GLU B 53 6.382 -13.533 4.897 1.00 0.00 C ATOM 812 CD GLU B 53 7.537 -14.342 5.434 1.00 0.00 C ATOM 813 OE1 GLU B 53 8.483 -13.739 5.972 1.00 0.00 O ATOM 814 OE2 GLU B 53 7.495 -15.580 5.322 1.00 0.00 O ATOM 0 H GLU B 53 5.054 -13.312 2.290 1.00 0.00 H new ATOM 0 HA GLU B 53 5.189 -11.214 4.239 1.00 0.00 H new ATOM 0 HB2 GLU B 53 7.265 -13.036 3.014 1.00 0.00 H new ATOM 0 HB3 GLU B 53 7.604 -11.886 4.292 1.00 0.00 H new ATOM 0 HG2 GLU B 53 5.887 -13.020 5.721 1.00 0.00 H new ATOM 0 HG3 GLU B 53 5.647 -14.204 4.452 1.00 0.00 H new ATOM 821 N ALA B 54 6.280 -10.742 1.206 1.00 0.00 N ATOM 822 CA ALA B 54 6.718 -9.756 0.235 1.00 0.00 C ATOM 823 C ALA B 54 5.737 -8.599 0.206 1.00 0.00 C ATOM 824 O ALA B 54 6.107 -7.434 0.352 1.00 0.00 O ATOM 825 CB ALA B 54 6.759 -10.393 -1.130 1.00 0.00 C ATOM 0 H ALA B 54 6.018 -11.640 0.799 1.00 0.00 H new ATOM 0 HA ALA B 54 7.708 -9.391 0.510 1.00 0.00 H new ATOM 0 HB1 ALA B 54 7.087 -9.658 -1.865 1.00 0.00 H new ATOM 0 HB2 ALA B 54 7.455 -11.232 -1.119 1.00 0.00 H new ATOM 0 HB3 ALA B 54 5.764 -10.751 -1.394 1.00 0.00 H new ATOM 831 N LEU B 55 4.473 -8.962 0.019 1.00 0.00 N ATOM 832 CA LEU B 55 3.372 -8.014 -0.036 1.00 0.00 C ATOM 833 C LEU B 55 3.290 -7.177 1.229 1.00 0.00 C ATOM 834 O LEU B 55 2.972 -5.990 1.176 1.00 0.00 O ATOM 835 CB LEU B 55 2.045 -8.760 -0.225 1.00 0.00 C ATOM 836 CG LEU B 55 1.558 -8.912 -1.669 1.00 0.00 C ATOM 837 CD1 LEU B 55 1.228 -7.556 -2.244 1.00 0.00 C ATOM 838 CD2 LEU B 55 2.597 -9.597 -2.531 1.00 0.00 C ATOM 0 H LEU B 55 4.183 -9.933 -0.100 1.00 0.00 H new ATOM 0 HA LEU B 55 3.555 -7.350 -0.881 1.00 0.00 H new ATOM 0 HB2 LEU B 55 2.145 -9.754 0.210 1.00 0.00 H new ATOM 0 HB3 LEU B 55 1.275 -8.240 0.344 1.00 0.00 H new ATOM 0 HG LEU B 55 0.662 -9.533 -1.660 1.00 0.00 H new ATOM 0 HD11 LEU B 55 0.882 -7.671 -3.271 1.00 0.00 H new ATOM 0 HD12 LEU B 55 0.445 -7.089 -1.647 1.00 0.00 H new ATOM 0 HD13 LEU B 55 2.119 -6.928 -2.229 1.00 0.00 H new ATOM 0 HD21 LEU B 55 2.221 -9.690 -3.550 1.00 0.00 H new ATOM 0 HD22 LEU B 55 3.513 -9.007 -2.535 1.00 0.00 H new ATOM 0 HD23 LEU B 55 2.806 -10.589 -2.130 1.00 0.00 H new ATOM 850 N GLN B 56 3.564 -7.798 2.374 1.00 0.00 N ATOM 851 CA GLN B 56 3.487 -7.078 3.641 1.00 0.00 C ATOM 852 C GLN B 56 4.687 -6.174 3.836 1.00 0.00 C ATOM 853 O GLN B 56 4.592 -5.171 4.528 1.00 0.00 O ATOM 854 CB GLN B 56 3.311 -8.025 4.841 1.00 0.00 C ATOM 855 CG GLN B 56 4.485 -8.949 5.103 1.00 0.00 C ATOM 856 CD GLN B 56 4.247 -9.873 6.281 1.00 0.00 C ATOM 857 OE1 GLN B 56 3.305 -10.668 6.277 1.00 0.00 O ATOM 858 NE2 GLN B 56 5.098 -9.780 7.292 1.00 0.00 N ATOM 0 H GLN B 56 3.836 -8.778 2.451 1.00 0.00 H new ATOM 0 HA GLN B 56 2.595 -6.453 3.592 1.00 0.00 H new ATOM 0 HB2 GLN B 56 3.132 -7.427 5.734 1.00 0.00 H new ATOM 0 HB3 GLN B 56 2.419 -8.631 4.679 1.00 0.00 H new ATOM 0 HG2 GLN B 56 4.679 -9.545 4.212 1.00 0.00 H new ATOM 0 HG3 GLN B 56 5.378 -8.352 5.288 1.00 0.00 H new ATOM 0 HE21 GLN B 56 5.864 -9.108 7.254 1.00 0.00 H new ATOM 0 HE22 GLN B 56 4.987 -10.381 8.109 1.00 0.00 H new ATOM 867 N GLY B 57 5.801 -6.503 3.205 1.00 0.00 N ATOM 868 CA GLY B 57 6.971 -5.658 3.317 1.00 0.00 C ATOM 869 C GLY B 57 6.755 -4.347 2.590 1.00 0.00 C ATOM 870 O GLY B 57 7.178 -3.272 3.045 1.00 0.00 O ATOM 0 H GLY B 57 5.917 -7.332 2.622 1.00 0.00 H new ATOM 0 HA2 GLY B 57 7.188 -5.466 4.368 1.00 0.00 H new ATOM 0 HA3 GLY B 57 7.838 -6.172 2.902 1.00 0.00 H new ATOM 874 N GLN B 58 6.073 -4.434 1.461 1.00 0.00 N ATOM 875 CA GLN B 58 5.784 -3.262 0.655 1.00 0.00 C ATOM 876 C GLN B 58 4.727 -2.391 1.316 1.00 0.00 C ATOM 877 O GLN B 58 4.880 -1.182 1.402 1.00 0.00 O ATOM 878 CB GLN B 58 5.314 -3.677 -0.741 1.00 0.00 C ATOM 879 CG GLN B 58 6.260 -4.633 -1.443 1.00 0.00 C ATOM 880 CD GLN B 58 5.758 -5.047 -2.812 1.00 0.00 C ATOM 881 OE1 GLN B 58 4.685 -5.639 -2.942 1.00 0.00 O ATOM 882 NE2 GLN B 58 6.530 -4.734 -3.840 1.00 0.00 N ATOM 0 H GLN B 58 5.708 -5.308 1.081 1.00 0.00 H new ATOM 0 HA GLN B 58 6.703 -2.683 0.566 1.00 0.00 H new ATOM 0 HB2 GLN B 58 4.333 -4.144 -0.660 1.00 0.00 H new ATOM 0 HB3 GLN B 58 5.192 -2.784 -1.354 1.00 0.00 H new ATOM 0 HG2 GLN B 58 7.237 -4.162 -1.545 1.00 0.00 H new ATOM 0 HG3 GLN B 58 6.397 -5.521 -0.826 1.00 0.00 H new ATOM 0 HE21 GLN B 58 7.411 -4.243 -3.686 1.00 0.00 H new ATOM 0 HE22 GLN B 58 6.244 -4.983 -4.787 1.00 0.00 H new ATOM 891 N VAL B 59 3.650 -2.992 1.773 1.00 0.00 N ATOM 892 CA VAL B 59 2.588 -2.220 2.396 1.00 0.00 C ATOM 893 C VAL B 59 3.019 -1.633 3.739 1.00 0.00 C ATOM 894 O VAL B 59 2.572 -0.548 4.113 1.00 0.00 O ATOM 895 CB VAL B 59 1.309 -3.074 2.560 1.00 0.00 C ATOM 896 CG1 VAL B 59 1.550 -4.243 3.497 1.00 0.00 C ATOM 897 CG2 VAL B 59 0.143 -2.241 3.056 1.00 0.00 C ATOM 0 H VAL B 59 3.484 -3.997 1.728 1.00 0.00 H new ATOM 0 HA VAL B 59 2.366 -1.385 1.731 1.00 0.00 H new ATOM 0 HB VAL B 59 1.054 -3.463 1.574 1.00 0.00 H new ATOM 0 HG11 VAL B 59 0.634 -4.826 3.594 1.00 0.00 H new ATOM 0 HG12 VAL B 59 2.342 -4.875 3.094 1.00 0.00 H new ATOM 0 HG13 VAL B 59 1.847 -3.869 4.477 1.00 0.00 H new ATOM 0 HG21 VAL B 59 -0.738 -2.874 3.159 1.00 0.00 H new ATOM 0 HG22 VAL B 59 0.393 -1.805 4.024 1.00 0.00 H new ATOM 0 HG23 VAL B 59 -0.064 -1.444 2.342 1.00 0.00 H new ATOM 907 N GLN B 60 3.882 -2.339 4.463 1.00 0.00 N ATOM 908 CA GLN B 60 4.333 -1.847 5.757 1.00 0.00 C ATOM 909 C GLN B 60 5.202 -0.613 5.596 1.00 0.00 C ATOM 910 O GLN B 60 5.074 0.330 6.369 1.00 0.00 O ATOM 911 CB GLN B 60 5.083 -2.920 6.554 1.00 0.00 C ATOM 912 CG GLN B 60 6.473 -3.253 6.033 1.00 0.00 C ATOM 913 CD GLN B 60 7.152 -4.315 6.876 1.00 0.00 C ATOM 914 OE1 GLN B 60 7.097 -5.555 6.425 1.00 0.00 O flip ATOM 915 NE2 GLN B 60 7.687 -4.027 7.946 1.00 0.00 N flip ATOM 0 H GLN B 60 4.276 -3.237 4.182 1.00 0.00 H new ATOM 0 HA GLN B 60 3.439 -1.580 6.321 1.00 0.00 H new ATOM 0 HB2 GLN B 60 5.169 -2.589 7.589 1.00 0.00 H new ATOM 0 HB3 GLN B 60 4.485 -3.831 6.559 1.00 0.00 H new ATOM 0 HG2 GLN B 60 6.401 -3.599 5.002 1.00 0.00 H new ATOM 0 HG3 GLN B 60 7.084 -2.350 6.025 1.00 0.00 H new ATOM 0 HE21 GLN B 60 7.709 -3.057 8.260 1.00 0.00 H new ATOM 0 HE22 GLN B 60 8.108 -4.758 8.519 1.00 0.00 H new ATOM 924 N HIS B 61 6.085 -0.607 4.593 1.00 0.00 N ATOM 925 CA HIS B 61 6.937 0.554 4.395 1.00 0.00 C ATOM 926 C HIS B 61 6.160 1.662 3.684 1.00 0.00 C ATOM 927 O HIS B 61 6.528 2.833 3.768 1.00 0.00 O ATOM 928 CB HIS B 61 8.245 0.204 3.671 1.00 0.00 C ATOM 929 CG HIS B 61 8.166 0.232 2.198 1.00 0.00 C ATOM 930 ND1 HIS B 61 7.476 -0.689 1.485 1.00 0.00 N ATOM 931 CD2 HIS B 61 8.660 1.122 1.304 1.00 0.00 C ATOM 932 CE1 HIS B 61 7.546 -0.356 0.209 1.00 0.00 C ATOM 933 NE2 HIS B 61 8.257 0.738 0.029 1.00 0.00 N ATOM 0 H HIS B 61 6.222 -1.369 3.929 1.00 0.00 H new ATOM 0 HA HIS B 61 7.234 0.924 5.376 1.00 0.00 H new ATOM 0 HB2 HIS B 61 9.019 0.901 3.992 1.00 0.00 H new ATOM 0 HB3 HIS B 61 8.562 -0.791 3.985 1.00 0.00 H new ATOM 0 HD2 HIS B 61 9.265 1.985 1.541 1.00 0.00 H new ATOM 0 HE1 HIS B 61 7.078 -0.913 -0.589 1.00 0.00 H new ATOM 0 HE2 HIS B 61 8.467 1.203 -0.854 1.00 0.00 H new ATOM 941 N LEU B 62 5.050 1.300 3.026 1.00 0.00 N ATOM 942 CA LEU B 62 4.210 2.295 2.364 1.00 0.00 C ATOM 943 C LEU B 62 3.469 3.094 3.412 1.00 0.00 C ATOM 944 O LEU B 62 3.378 4.313 3.332 1.00 0.00 O ATOM 945 CB LEU B 62 3.195 1.661 1.408 1.00 0.00 C ATOM 946 CG LEU B 62 3.770 1.139 0.094 1.00 0.00 C ATOM 947 CD1 LEU B 62 2.655 0.829 -0.891 1.00 0.00 C ATOM 948 CD2 LEU B 62 4.736 2.143 -0.499 1.00 0.00 C ATOM 0 H LEU B 62 4.720 0.339 2.941 1.00 0.00 H new ATOM 0 HA LEU B 62 4.864 2.936 1.773 1.00 0.00 H new ATOM 0 HB2 LEU B 62 2.703 0.836 1.923 1.00 0.00 H new ATOM 0 HB3 LEU B 62 2.426 2.399 1.181 1.00 0.00 H new ATOM 0 HG LEU B 62 4.314 0.217 0.300 1.00 0.00 H new ATOM 0 HD11 LEU B 62 3.084 0.458 -1.822 1.00 0.00 H new ATOM 0 HD12 LEU B 62 1.996 0.071 -0.468 1.00 0.00 H new ATOM 0 HD13 LEU B 62 2.084 1.735 -1.091 1.00 0.00 H new ATOM 0 HD21 LEU B 62 5.136 1.754 -1.435 1.00 0.00 H new ATOM 0 HD22 LEU B 62 4.215 3.081 -0.689 1.00 0.00 H new ATOM 0 HD23 LEU B 62 5.554 2.318 0.200 1.00 0.00 H new ATOM 960 N GLN B 63 2.954 2.387 4.412 1.00 0.00 N ATOM 961 CA GLN B 63 2.235 3.015 5.508 1.00 0.00 C ATOM 962 C GLN B 63 3.247 3.775 6.361 1.00 0.00 C ATOM 963 O GLN B 63 2.957 4.842 6.898 1.00 0.00 O ATOM 964 CB GLN B 63 1.509 1.942 6.336 1.00 0.00 C ATOM 965 CG GLN B 63 0.269 2.429 7.071 1.00 0.00 C ATOM 966 CD GLN B 63 0.587 3.350 8.231 1.00 0.00 C ATOM 967 OE1 GLN B 63 1.294 2.964 9.162 1.00 0.00 O ATOM 968 NE2 GLN B 63 0.077 4.571 8.186 1.00 0.00 N ATOM 0 H GLN B 63 3.023 1.372 4.484 1.00 0.00 H new ATOM 0 HA GLN B 63 1.483 3.708 5.131 1.00 0.00 H new ATOM 0 HB2 GLN B 63 1.223 1.125 5.674 1.00 0.00 H new ATOM 0 HB3 GLN B 63 2.208 1.532 7.065 1.00 0.00 H new ATOM 0 HG2 GLN B 63 -0.381 2.951 6.368 1.00 0.00 H new ATOM 0 HG3 GLN B 63 -0.288 1.568 7.441 1.00 0.00 H new ATOM 0 HE21 GLN B 63 -0.504 4.852 7.396 1.00 0.00 H new ATOM 0 HE22 GLN B 63 0.265 5.231 8.941 1.00 0.00 H new ATOM 977 N ALA B 64 4.452 3.215 6.438 1.00 0.00 N ATOM 978 CA ALA B 64 5.555 3.814 7.177 1.00 0.00 C ATOM 979 C ALA B 64 5.825 5.213 6.658 1.00 0.00 C ATOM 980 O ALA B 64 5.782 6.188 7.409 1.00 0.00 O ATOM 981 CB ALA B 64 6.803 2.953 7.024 1.00 0.00 C ATOM 0 H ALA B 64 4.689 2.331 5.988 1.00 0.00 H new ATOM 0 HA ALA B 64 5.289 3.874 8.232 1.00 0.00 H new ATOM 0 HB1 ALA B 64 7.626 3.404 7.578 1.00 0.00 H new ATOM 0 HB2 ALA B 64 6.606 1.955 7.415 1.00 0.00 H new ATOM 0 HB3 ALA B 64 7.070 2.884 5.970 1.00 0.00 H new ATOM 987 N ALA B 65 6.081 5.298 5.359 1.00 0.00 N ATOM 988 CA ALA B 65 6.336 6.570 4.709 1.00 0.00 C ATOM 989 C ALA B 65 5.113 7.466 4.817 1.00 0.00 C ATOM 990 O ALA B 65 5.229 8.667 5.059 1.00 0.00 O ATOM 991 CB ALA B 65 6.709 6.346 3.251 1.00 0.00 C ATOM 0 H ALA B 65 6.117 4.493 4.734 1.00 0.00 H new ATOM 0 HA ALA B 65 7.171 7.063 5.208 1.00 0.00 H new ATOM 0 HB1 ALA B 65 6.898 7.307 2.772 1.00 0.00 H new ATOM 0 HB2 ALA B 65 7.606 5.730 3.196 1.00 0.00 H new ATOM 0 HB3 ALA B 65 5.890 5.841 2.739 1.00 0.00 H new ATOM 997 N PHE B 66 3.934 6.869 4.641 1.00 0.00 N ATOM 998 CA PHE B 66 2.674 7.602 4.716 1.00 0.00 C ATOM 999 C PHE B 66 2.515 8.297 6.053 1.00 0.00 C ATOM 1000 O PHE B 66 1.809 9.282 6.138 1.00 0.00 O ATOM 1001 CB PHE B 66 1.469 6.677 4.523 1.00 0.00 C ATOM 1002 CG PHE B 66 0.595 7.026 3.356 1.00 0.00 C ATOM 1003 CD1 PHE B 66 0.608 8.302 2.812 1.00 0.00 C ATOM 1004 CD2 PHE B 66 -0.261 6.077 2.814 1.00 0.00 C ATOM 1005 CE1 PHE B 66 -0.210 8.621 1.750 1.00 0.00 C ATOM 1006 CE2 PHE B 66 -1.083 6.394 1.751 1.00 0.00 C ATOM 1007 CZ PHE B 66 -1.055 7.666 1.219 1.00 0.00 C ATOM 0 H PHE B 66 3.827 5.874 4.444 1.00 0.00 H new ATOM 0 HA PHE B 66 2.707 8.339 3.914 1.00 0.00 H new ATOM 0 HB2 PHE B 66 1.828 5.655 4.399 1.00 0.00 H new ATOM 0 HB3 PHE B 66 0.865 6.694 5.430 1.00 0.00 H new ATOM 0 HD1 PHE B 66 1.266 9.053 3.225 1.00 0.00 H new ATOM 0 HD2 PHE B 66 -0.284 5.080 3.228 1.00 0.00 H new ATOM 0 HE1 PHE B 66 -0.190 9.617 1.333 1.00 0.00 H new ATOM 0 HE2 PHE B 66 -1.746 5.648 1.337 1.00 0.00 H new ATOM 0 HZ PHE B 66 -1.695 7.916 0.386 1.00 0.00 H new ATOM 1017 N SER B 67 3.156 7.780 7.102 1.00 0.00 N ATOM 1018 CA SER B 67 3.047 8.387 8.425 1.00 0.00 C ATOM 1019 C SER B 67 3.407 9.873 8.363 1.00 0.00 C ATOM 1020 O SER B 67 2.922 10.680 9.157 1.00 0.00 O ATOM 1021 CB SER B 67 3.945 7.651 9.424 1.00 0.00 C ATOM 1022 OG SER B 67 3.728 8.118 10.748 1.00 0.00 O ATOM 0 H SER B 67 3.749 6.951 7.061 1.00 0.00 H new ATOM 0 HA SER B 67 2.015 8.301 8.764 1.00 0.00 H new ATOM 0 HB2 SER B 67 3.747 6.580 9.376 1.00 0.00 H new ATOM 0 HB3 SER B 67 4.991 7.794 9.152 1.00 0.00 H new ATOM 0 HG SER B 67 4.312 7.631 11.366 1.00 0.00 H new ATOM 1028 N GLN B 68 4.235 10.226 7.387 1.00 0.00 N ATOM 1029 CA GLN B 68 4.638 11.607 7.176 1.00 0.00 C ATOM 1030 C GLN B 68 3.703 12.290 6.177 1.00 0.00 C ATOM 1031 O GLN B 68 3.135 13.341 6.456 1.00 0.00 O ATOM 1032 CB GLN B 68 6.078 11.663 6.650 1.00 0.00 C ATOM 1033 CG GLN B 68 7.110 11.035 7.575 1.00 0.00 C ATOM 1034 CD GLN B 68 7.442 11.899 8.776 1.00 0.00 C ATOM 1035 OE1 GLN B 68 7.067 13.169 8.722 1.00 0.00 O flip ATOM 1036 NE2 GLN B 68 8.054 11.431 9.737 1.00 0.00 N flip ATOM 0 H GLN B 68 4.643 9.566 6.725 1.00 0.00 H new ATOM 0 HA GLN B 68 4.582 12.130 8.130 1.00 0.00 H new ATOM 0 HB2 GLN B 68 6.119 11.159 5.684 1.00 0.00 H new ATOM 0 HB3 GLN B 68 6.349 12.705 6.478 1.00 0.00 H new ATOM 0 HG2 GLN B 68 6.738 10.071 7.921 1.00 0.00 H new ATOM 0 HG3 GLN B 68 8.023 10.841 7.012 1.00 0.00 H new ATOM 0 HE21 GLN B 68 8.325 10.448 9.739 1.00 0.00 H new ATOM 0 HE22 GLN B 68 8.290 12.027 10.530 1.00 0.00 H new ATOM 1045 N TYR B 69 3.569 11.684 5.005 1.00 0.00 N ATOM 1046 CA TYR B 69 2.735 12.220 3.926 1.00 0.00 C ATOM 1047 C TYR B 69 1.258 12.320 4.303 1.00 0.00 C ATOM 1048 O TYR B 69 0.499 13.055 3.675 1.00 0.00 O ATOM 1049 CB TYR B 69 2.894 11.344 2.699 1.00 0.00 C ATOM 1050 CG TYR B 69 4.340 11.076 2.401 1.00 0.00 C ATOM 1051 CD1 TYR B 69 5.241 12.115 2.189 1.00 0.00 C ATOM 1052 CD2 TYR B 69 4.817 9.785 2.382 1.00 0.00 C ATOM 1053 CE1 TYR B 69 6.569 11.860 1.971 1.00 0.00 C ATOM 1054 CE2 TYR B 69 6.142 9.519 2.154 1.00 0.00 C ATOM 1055 CZ TYR B 69 7.023 10.558 1.952 1.00 0.00 C ATOM 1056 OH TYR B 69 8.353 10.296 1.742 1.00 0.00 O ATOM 0 H TYR B 69 4.033 10.807 4.771 1.00 0.00 H new ATOM 0 HA TYR B 69 3.074 13.236 3.725 1.00 0.00 H new ATOM 0 HB2 TYR B 69 2.372 10.400 2.854 1.00 0.00 H new ATOM 0 HB3 TYR B 69 2.428 11.829 1.841 1.00 0.00 H new ATOM 0 HD1 TYR B 69 4.889 13.136 2.196 1.00 0.00 H new ATOM 0 HD2 TYR B 69 4.134 8.966 2.550 1.00 0.00 H new ATOM 0 HE1 TYR B 69 7.259 12.676 1.814 1.00 0.00 H new ATOM 0 HE2 TYR B 69 6.494 8.498 2.133 1.00 0.00 H new ATOM 0 HH TYR B 69 8.730 10.976 1.145 1.00 0.00 H new ATOM 1066 N LYS B 70 0.855 11.569 5.317 1.00 0.00 N ATOM 1067 CA LYS B 70 -0.534 11.565 5.762 1.00 0.00 C ATOM 1068 C LYS B 70 -0.917 12.920 6.366 1.00 0.00 C ATOM 1069 O LYS B 70 -2.087 13.295 6.378 1.00 0.00 O ATOM 1070 CB LYS B 70 -0.783 10.427 6.764 1.00 0.00 C ATOM 1071 CG LYS B 70 -0.216 10.694 8.153 1.00 0.00 C ATOM 1072 CD LYS B 70 -0.928 9.908 9.252 1.00 0.00 C ATOM 1073 CE LYS B 70 -0.916 8.406 9.014 1.00 0.00 C ATOM 1074 NZ LYS B 70 -2.088 7.951 8.214 1.00 0.00 N ATOM 0 H LYS B 70 1.470 10.953 5.849 1.00 0.00 H new ATOM 0 HA LYS B 70 -1.168 11.393 4.892 1.00 0.00 H new ATOM 0 HB2 LYS B 70 -1.856 10.257 6.847 1.00 0.00 H new ATOM 0 HB3 LYS B 70 -0.344 9.509 6.373 1.00 0.00 H new ATOM 0 HG2 LYS B 70 0.844 10.440 8.161 1.00 0.00 H new ATOM 0 HG3 LYS B 70 -0.290 11.760 8.370 1.00 0.00 H new ATOM 0 HD2 LYS B 70 -0.453 10.122 10.209 1.00 0.00 H new ATOM 0 HD3 LYS B 70 -1.960 10.250 9.325 1.00 0.00 H new ATOM 0 HE2 LYS B 70 0.003 8.130 8.497 1.00 0.00 H new ATOM 0 HE3 LYS B 70 -0.911 7.888 9.973 1.00 0.00 H new ATOM 0 HZ1 LYS B 70 -2.524 7.127 8.675 1.00 0.00 H new ATOM 0 HZ2 LYS B 70 -2.785 8.721 8.150 1.00 0.00 H new ATOM 0 HZ3 LYS B 70 -1.775 7.688 7.258 1.00 0.00 H new ATOM 1088 N LYS B 71 0.079 13.669 6.837 1.00 0.00 N ATOM 1089 CA LYS B 71 -0.166 14.993 7.398 1.00 0.00 C ATOM 1090 C LYS B 71 0.412 16.059 6.471 1.00 0.00 C ATOM 1091 O LYS B 71 0.874 17.112 6.908 1.00 0.00 O ATOM 1092 CB LYS B 71 0.399 15.101 8.826 1.00 0.00 C ATOM 1093 CG LYS B 71 1.821 14.574 9.000 1.00 0.00 C ATOM 1094 CD LYS B 71 2.874 15.617 8.645 1.00 0.00 C ATOM 1095 CE LYS B 71 4.281 15.078 8.837 1.00 0.00 C ATOM 1096 NZ LYS B 71 4.554 14.713 10.254 1.00 0.00 N ATOM 0 H LYS B 71 1.058 13.382 6.841 1.00 0.00 H new ATOM 0 HA LYS B 71 -1.241 15.157 7.474 1.00 0.00 H new ATOM 0 HB2 LYS B 71 0.376 16.147 9.131 1.00 0.00 H new ATOM 0 HB3 LYS B 71 -0.259 14.557 9.503 1.00 0.00 H new ATOM 0 HG2 LYS B 71 1.963 14.254 10.032 1.00 0.00 H new ATOM 0 HG3 LYS B 71 1.959 13.694 8.372 1.00 0.00 H new ATOM 0 HD2 LYS B 71 2.742 15.931 7.609 1.00 0.00 H new ATOM 0 HD3 LYS B 71 2.735 16.502 9.266 1.00 0.00 H new ATOM 0 HE2 LYS B 71 4.422 14.202 8.204 1.00 0.00 H new ATOM 0 HE3 LYS B 71 5.003 15.827 8.511 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 5.575 14.562 10.383 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 4.236 15.482 10.878 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 4.042 13.840 10.492 1.00 0.00 H new ATOM 1110 N VAL B 72 0.369 15.764 5.178 1.00 0.00 N ATOM 1111 CA VAL B 72 0.871 16.672 4.159 1.00 0.00 C ATOM 1112 C VAL B 72 -0.262 17.503 3.551 1.00 0.00 C ATOM 1113 O VAL B 72 -0.068 18.680 3.219 1.00 0.00 O ATOM 1114 CB VAL B 72 1.635 15.892 3.064 1.00 0.00 C ATOM 1115 CG1 VAL B 72 1.794 16.693 1.791 1.00 0.00 C ATOM 1116 CG2 VAL B 72 2.996 15.464 3.580 1.00 0.00 C ATOM 0 H VAL B 72 -0.013 14.893 4.809 1.00 0.00 H new ATOM 0 HA VAL B 72 1.567 17.362 4.635 1.00 0.00 H new ATOM 0 HB VAL B 72 1.040 15.011 2.822 1.00 0.00 H new ATOM 0 HG11 VAL B 72 2.337 16.101 1.054 1.00 0.00 H new ATOM 0 HG12 VAL B 72 0.810 16.949 1.397 1.00 0.00 H new ATOM 0 HG13 VAL B 72 2.349 17.607 2.003 1.00 0.00 H new ATOM 0 HG21 VAL B 72 3.525 14.916 2.800 1.00 0.00 H new ATOM 0 HG22 VAL B 72 3.573 16.346 3.859 1.00 0.00 H new ATOM 0 HG23 VAL B 72 2.869 14.823 4.452 1.00 0.00 H new ATOM 1126 N GLU B 73 -1.453 16.920 3.423 1.00 0.00 N ATOM 1127 CA GLU B 73 -2.574 17.670 2.869 1.00 0.00 C ATOM 1128 C GLU B 73 -3.348 18.386 3.952 1.00 0.00 C ATOM 1129 O GLU B 73 -4.317 17.877 4.523 1.00 0.00 O ATOM 1130 CB GLU B 73 -3.526 16.823 2.072 1.00 0.00 C ATOM 1131 CG GLU B 73 -4.587 17.654 1.361 1.00 0.00 C ATOM 1132 CD GLU B 73 -5.738 16.832 0.835 1.00 0.00 C ATOM 1133 OE1 GLU B 73 -5.517 15.998 -0.056 1.00 0.00 O ATOM 1134 OE2 GLU B 73 -6.868 17.020 1.328 1.00 0.00 O ATOM 0 H GLU B 73 -1.662 15.957 3.688 1.00 0.00 H new ATOM 0 HA GLU B 73 -2.123 18.394 2.191 1.00 0.00 H new ATOM 0 HB2 GLU B 73 -2.966 16.247 1.336 1.00 0.00 H new ATOM 0 HB3 GLU B 73 -4.013 16.107 2.734 1.00 0.00 H new ATOM 0 HG2 GLU B 73 -4.972 18.405 2.050 1.00 0.00 H new ATOM 0 HG3 GLU B 73 -4.124 18.189 0.532 1.00 0.00 H new ATOM 1141 N LEU B 74 -2.892 19.573 4.183 1.00 0.00 N ATOM 1142 CA LEU B 74 -3.463 20.492 5.155 1.00 0.00 C ATOM 1143 C LEU B 74 -2.884 21.893 4.967 1.00 0.00 C ATOM 1144 O LEU B 74 -3.571 22.893 5.183 1.00 0.00 O ATOM 1145 CB LEU B 74 -3.324 19.987 6.599 1.00 0.00 C ATOM 1146 CG LEU B 74 -1.943 19.570 7.139 1.00 0.00 C ATOM 1147 CD1 LEU B 74 -2.051 18.221 7.818 1.00 0.00 C ATOM 1148 CD2 LEU B 74 -0.813 19.560 6.136 1.00 0.00 C ATOM 0 H LEU B 74 -2.085 19.958 3.692 1.00 0.00 H new ATOM 0 HA LEU B 74 -4.536 20.546 4.970 1.00 0.00 H new ATOM 0 HB2 LEU B 74 -3.706 20.770 7.254 1.00 0.00 H new ATOM 0 HB3 LEU B 74 -3.987 19.129 6.708 1.00 0.00 H new ATOM 0 HG LEU B 74 -1.668 20.353 7.846 1.00 0.00 H new ATOM 0 HD11 LEU B 74 -1.073 17.927 8.200 1.00 0.00 H new ATOM 0 HD12 LEU B 74 -2.759 18.285 8.644 1.00 0.00 H new ATOM 0 HD13 LEU B 74 -2.398 17.479 7.099 1.00 0.00 H new ATOM 0 HD21 LEU B 74 0.109 19.251 6.629 1.00 0.00 H new ATOM 0 HD22 LEU B 74 -1.046 18.861 5.332 1.00 0.00 H new ATOM 0 HD23 LEU B 74 -0.685 20.560 5.722 1.00 0.00 H new ATOM 1160 N PHE B 75 -1.635 21.963 4.510 1.00 0.00 N ATOM 1161 CA PHE B 75 -1.000 23.252 4.230 1.00 0.00 C ATOM 1162 C PHE B 75 -1.608 23.853 2.956 1.00 0.00 C ATOM 1163 O PHE B 75 -2.171 24.946 2.996 1.00 0.00 O ATOM 1164 CB PHE B 75 0.533 23.152 4.088 1.00 0.00 C ATOM 1165 CG PHE B 75 1.285 23.076 5.386 1.00 0.00 C ATOM 1166 CD1 PHE B 75 1.382 21.885 6.079 1.00 0.00 C ATOM 1167 CD2 PHE B 75 1.892 24.204 5.912 1.00 0.00 C ATOM 1168 CE1 PHE B 75 2.069 21.818 7.276 1.00 0.00 C ATOM 1169 CE2 PHE B 75 2.583 24.143 7.108 1.00 0.00 C ATOM 1170 CZ PHE B 75 2.671 22.948 7.790 1.00 0.00 C ATOM 0 H PHE B 75 -1.046 21.151 4.327 1.00 0.00 H new ATOM 0 HA PHE B 75 -1.191 23.900 5.086 1.00 0.00 H new ATOM 0 HB2 PHE B 75 0.771 22.269 3.495 1.00 0.00 H new ATOM 0 HB3 PHE B 75 0.889 24.018 3.529 1.00 0.00 H new ATOM 0 HD1 PHE B 75 0.916 20.996 5.681 1.00 0.00 H new ATOM 0 HD2 PHE B 75 1.825 25.142 5.382 1.00 0.00 H new ATOM 0 HE1 PHE B 75 2.135 20.881 7.809 1.00 0.00 H new ATOM 0 HE2 PHE B 75 3.053 25.030 7.507 1.00 0.00 H new ATOM 0 HZ PHE B 75 3.210 22.897 8.724 1.00 0.00 H new ATOM 1180 N PRO B 76 -1.524 23.142 1.805 1.00 0.00 N ATOM 1181 CA PRO B 76 -2.096 23.627 0.550 1.00 0.00 C ATOM 1182 C PRO B 76 -3.601 23.396 0.487 1.00 0.00 C ATOM 1183 O PRO B 76 -4.189 22.833 1.412 1.00 0.00 O ATOM 1184 CB PRO B 76 -1.382 22.792 -0.509 1.00 0.00 C ATOM 1185 CG PRO B 76 -1.075 21.500 0.172 1.00 0.00 C ATOM 1186 CD PRO B 76 -0.888 21.816 1.633 1.00 0.00 C ATOM 0 HA PRO B 76 -1.962 24.701 0.422 1.00 0.00 H new ATOM 0 HB2 PRO B 76 -2.013 22.638 -1.384 1.00 0.00 H new ATOM 0 HB3 PRO B 76 -0.473 23.284 -0.854 1.00 0.00 H new ATOM 0 HG2 PRO B 76 -1.886 20.786 0.031 1.00 0.00 H new ATOM 0 HG3 PRO B 76 -0.175 21.047 -0.244 1.00 0.00 H new ATOM 0 HD2 PRO B 76 -1.359 21.064 2.266 1.00 0.00 H new ATOM 0 HD3 PRO B 76 0.168 21.843 1.902 1.00 0.00 H new ATOM 1194 N ASN B 77 -4.223 23.831 -0.602 1.00 0.00 N ATOM 1195 CA ASN B 77 -5.663 23.663 -0.763 1.00 0.00 C ATOM 1196 C ASN B 77 -6.026 22.204 -0.993 1.00 0.00 C ATOM 1197 O ASN B 77 -6.956 21.686 -0.380 1.00 0.00 O ATOM 1198 CB ASN B 77 -6.196 24.499 -1.931 1.00 0.00 C ATOM 1199 CG ASN B 77 -5.956 25.985 -1.761 1.00 0.00 C ATOM 1200 OD1 ASN B 77 -4.812 26.443 -1.751 1.00 0.00 O ATOM 1201 ND2 ASN B 77 -7.030 26.753 -1.633 1.00 0.00 N ATOM 0 H ASN B 77 -3.759 24.299 -1.381 1.00 0.00 H new ATOM 0 HA ASN B 77 -6.125 24.007 0.163 1.00 0.00 H new ATOM 0 HB2 ASN B 77 -5.723 24.165 -2.854 1.00 0.00 H new ATOM 0 HB3 ASN B 77 -7.266 24.320 -2.038 1.00 0.00 H new ATOM 0 HD21 ASN B 77 -6.925 27.761 -1.521 1.00 0.00 H new ATOM 0 HD22 ASN B 77 -7.960 26.335 -1.646 1.00 0.00 H new ATOM 1208 N GLY B 78 -5.308 21.551 -1.901 1.00 0.00 N ATOM 1209 CA GLY B 78 -5.597 20.164 -2.215 1.00 0.00 C ATOM 1210 C GLY B 78 -6.769 20.057 -3.167 1.00 0.00 C ATOM 1211 O GLY B 78 -6.625 20.310 -4.362 1.00 0.00 O ATOM 0 H GLY B 78 -4.532 21.957 -2.424 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -4.718 19.697 -2.660 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -5.818 19.618 -1.298 1.00 0.00 H new ATOM 1215 N GLY B 79 -7.934 19.712 -2.638 1.00 0.00 N ATOM 1216 CA GLY B 79 -9.119 19.612 -3.464 1.00 0.00 C ATOM 1217 C GLY B 79 -9.847 20.933 -3.539 1.00 0.00 C ATOM 1218 O GLY B 79 -10.766 21.185 -2.758 1.00 0.00 O ATOM 0 H GLY B 79 -8.080 19.500 -1.651 1.00 0.00 H new ATOM 0 HA2 GLY B 79 -8.840 19.290 -4.467 1.00 0.00 H new ATOM 0 HA3 GLY B 79 -9.784 18.850 -3.059 1.00 0.00 H new ATOM 1222 N ILE B 80 -9.421 21.786 -4.458 1.00 0.00 N ATOM 1223 CA ILE B 80 -10.022 23.098 -4.616 1.00 0.00 C ATOM 1224 C ILE B 80 -10.739 23.207 -5.965 1.00 0.00 C ATOM 1225 O ILE B 80 -10.285 22.568 -6.933 1.00 0.00 O ATOM 1226 CB ILE B 80 -8.950 24.207 -4.480 1.00 0.00 C ATOM 1227 CG1 ILE B 80 -9.581 25.596 -4.545 1.00 0.00 C ATOM 1228 CG2 ILE B 80 -7.880 24.056 -5.549 1.00 0.00 C ATOM 1229 CD1 ILE B 80 -10.460 25.921 -3.355 1.00 0.00 C ATOM 1230 OXT ILE B 80 -11.765 23.914 -6.040 1.00 0.00 O ATOM 0 H ILE B 80 -8.659 21.591 -5.107 1.00 0.00 H new ATOM 0 HA ILE B 80 -10.760 23.233 -3.825 1.00 0.00 H new ATOM 0 HB ILE B 80 -8.479 24.097 -3.503 1.00 0.00 H new ATOM 0 HG12 ILE B 80 -8.790 26.342 -4.616 1.00 0.00 H new ATOM 0 HG13 ILE B 80 -10.174 25.674 -5.456 1.00 0.00 H new ATOM 0 HG21 ILE B 80 -7.137 24.846 -5.434 1.00 0.00 H new ATOM 0 HG22 ILE B 80 -7.396 23.085 -5.445 1.00 0.00 H new ATOM 0 HG23 ILE B 80 -8.338 24.129 -6.535 1.00 0.00 H new ATOM 0 HD11 ILE B 80 -10.873 26.923 -3.471 1.00 0.00 H new ATOM 0 HD12 ILE B 80 -11.273 25.198 -3.295 1.00 0.00 H new ATOM 0 HD13 ILE B 80 -9.867 25.877 -2.442 1.00 0.00 H new TER 1242 ILE B 80 ATOM 1243 N GLY C 81 -8.325 -28.078 -1.172 1.00 0.00 N ATOM 1244 CA GLY C 81 -7.771 -28.652 -2.421 1.00 0.00 C ATOM 1245 C GLY C 81 -6.899 -27.665 -3.165 1.00 0.00 C ATOM 1246 O GLY C 81 -6.713 -26.535 -2.710 1.00 0.00 O ATOM 0 HA2 GLY C 81 -7.188 -29.542 -2.183 1.00 0.00 H new ATOM 0 HA3 GLY C 81 -8.589 -28.970 -3.067 1.00 0.00 H new ATOM 1252 N LEU C 82 -6.367 -28.083 -4.316 1.00 0.00 N ATOM 1253 CA LEU C 82 -5.507 -27.213 -5.127 1.00 0.00 C ATOM 1254 C LEU C 82 -6.243 -25.942 -5.569 1.00 0.00 C ATOM 1255 O LEU C 82 -5.754 -24.845 -5.335 1.00 0.00 O ATOM 1256 CB LEU C 82 -4.935 -27.942 -6.356 1.00 0.00 C ATOM 1257 CG LEU C 82 -4.268 -29.296 -6.105 1.00 0.00 C ATOM 1258 CD1 LEU C 82 -3.382 -29.680 -7.279 1.00 0.00 C ATOM 1259 CD2 LEU C 82 -3.493 -29.327 -4.800 1.00 0.00 C ATOM 0 H LEU C 82 -6.515 -29.013 -4.707 1.00 0.00 H new ATOM 0 HA LEU C 82 -4.673 -26.927 -4.486 1.00 0.00 H new ATOM 0 HB2 LEU C 82 -5.744 -28.089 -7.071 1.00 0.00 H new ATOM 0 HB3 LEU C 82 -4.205 -27.286 -6.831 1.00 0.00 H new ATOM 0 HG LEU C 82 -5.063 -30.036 -6.012 1.00 0.00 H new ATOM 0 HD11 LEU C 82 -2.916 -30.646 -7.083 1.00 0.00 H new ATOM 0 HD12 LEU C 82 -3.986 -29.746 -8.184 1.00 0.00 H new ATOM 0 HD13 LEU C 82 -2.608 -28.924 -7.413 1.00 0.00 H new ATOM 0 HD21 LEU C 82 -3.039 -30.309 -4.670 1.00 0.00 H new ATOM 0 HD22 LEU C 82 -2.712 -28.567 -4.822 1.00 0.00 H new ATOM 0 HD23 LEU C 82 -4.170 -29.127 -3.970 1.00 0.00 H new ATOM 1271 N PRO C 83 -7.412 -26.069 -6.248 1.00 0.00 N ATOM 1272 CA PRO C 83 -8.180 -24.922 -6.738 1.00 0.00 C ATOM 1273 C PRO C 83 -8.448 -23.880 -5.649 1.00 0.00 C ATOM 1274 O PRO C 83 -8.484 -22.685 -5.918 1.00 0.00 O ATOM 1275 CB PRO C 83 -9.504 -25.520 -7.233 1.00 0.00 C ATOM 1276 CG PRO C 83 -9.468 -26.973 -6.900 1.00 0.00 C ATOM 1277 CD PRO C 83 -8.036 -27.329 -6.634 1.00 0.00 C ATOM 0 HA PRO C 83 -7.628 -24.393 -7.515 1.00 0.00 H new ATOM 0 HB2 PRO C 83 -10.352 -25.033 -6.752 1.00 0.00 H new ATOM 0 HB3 PRO C 83 -9.618 -25.372 -8.307 1.00 0.00 H new ATOM 0 HG2 PRO C 83 -10.086 -27.184 -6.027 1.00 0.00 H new ATOM 0 HG3 PRO C 83 -9.866 -27.567 -7.723 1.00 0.00 H new ATOM 0 HD2 PRO C 83 -7.953 -28.072 -5.841 1.00 0.00 H new ATOM 0 HD3 PRO C 83 -7.561 -27.752 -7.519 1.00 0.00 H new ATOM 1285 N ASP C 84 -8.626 -24.354 -4.422 1.00 0.00 N ATOM 1286 CA ASP C 84 -8.875 -23.491 -3.266 1.00 0.00 C ATOM 1287 C ASP C 84 -7.608 -22.741 -2.877 1.00 0.00 C ATOM 1288 O ASP C 84 -7.655 -21.585 -2.459 1.00 0.00 O ATOM 1289 CB ASP C 84 -9.371 -24.354 -2.105 1.00 0.00 C ATOM 1290 CG ASP C 84 -9.641 -23.569 -0.849 1.00 0.00 C ATOM 1291 OD1 ASP C 84 -10.437 -22.608 -0.904 1.00 0.00 O ATOM 1292 OD2 ASP C 84 -9.066 -23.918 0.198 1.00 0.00 O ATOM 0 H ASP C 84 -8.602 -25.348 -4.197 1.00 0.00 H new ATOM 0 HA ASP C 84 -9.634 -22.750 -3.518 1.00 0.00 H new ATOM 0 HB2 ASP C 84 -10.284 -24.867 -2.407 1.00 0.00 H new ATOM 0 HB3 ASP C 84 -8.629 -25.123 -1.891 1.00 0.00 H new ATOM 1297 N VAL C 85 -6.472 -23.400 -3.048 1.00 0.00 N ATOM 1298 CA VAL C 85 -5.185 -22.801 -2.744 1.00 0.00 C ATOM 1299 C VAL C 85 -4.786 -21.819 -3.845 1.00 0.00 C ATOM 1300 O VAL C 85 -4.377 -20.691 -3.566 1.00 0.00 O ATOM 1301 CB VAL C 85 -4.094 -23.887 -2.589 1.00 0.00 C ATOM 1302 CG1 VAL C 85 -2.713 -23.270 -2.429 1.00 0.00 C ATOM 1303 CG2 VAL C 85 -4.411 -24.800 -1.414 1.00 0.00 C ATOM 0 H VAL C 85 -6.418 -24.356 -3.398 1.00 0.00 H new ATOM 0 HA VAL C 85 -5.276 -22.264 -1.800 1.00 0.00 H new ATOM 0 HB VAL C 85 -4.087 -24.483 -3.502 1.00 0.00 H new ATOM 0 HG11 VAL C 85 -1.971 -24.061 -2.323 1.00 0.00 H new ATOM 0 HG12 VAL C 85 -2.479 -22.669 -3.308 1.00 0.00 H new ATOM 0 HG13 VAL C 85 -2.698 -22.637 -1.542 1.00 0.00 H new ATOM 0 HG21 VAL C 85 -3.632 -25.557 -1.321 1.00 0.00 H new ATOM 0 HG22 VAL C 85 -4.456 -24.211 -0.498 1.00 0.00 H new ATOM 0 HG23 VAL C 85 -5.372 -25.286 -1.580 1.00 0.00 H new ATOM 1313 N ALA C 86 -4.911 -22.251 -5.100 1.00 0.00 N ATOM 1314 CA ALA C 86 -4.560 -21.405 -6.238 1.00 0.00 C ATOM 1315 C ALA C 86 -5.549 -20.260 -6.423 1.00 0.00 C ATOM 1316 O ALA C 86 -5.215 -19.245 -7.029 1.00 0.00 O ATOM 1317 CB ALA C 86 -4.442 -22.216 -7.510 1.00 0.00 C ATOM 0 H ALA C 86 -5.252 -23.179 -5.353 1.00 0.00 H new ATOM 0 HA ALA C 86 -3.586 -20.968 -6.018 1.00 0.00 H new ATOM 0 HB1 ALA C 86 -4.180 -21.558 -8.338 1.00 0.00 H new ATOM 0 HB2 ALA C 86 -3.667 -22.973 -7.389 1.00 0.00 H new ATOM 0 HB3 ALA C 86 -5.394 -22.703 -7.721 1.00 0.00 H new ATOM 1323 N SER C 87 -6.749 -20.399 -5.877 1.00 0.00 N ATOM 1324 CA SER C 87 -7.737 -19.335 -5.968 1.00 0.00 C ATOM 1325 C SER C 87 -7.245 -18.164 -5.135 1.00 0.00 C ATOM 1326 O SER C 87 -7.549 -17.004 -5.405 1.00 0.00 O ATOM 1327 CB SER C 87 -9.105 -19.811 -5.459 1.00 0.00 C ATOM 1328 OG SER C 87 -10.114 -18.833 -5.665 1.00 0.00 O ATOM 0 H SER C 87 -7.059 -21.229 -5.372 1.00 0.00 H new ATOM 0 HA SER C 87 -7.861 -19.036 -7.009 1.00 0.00 H new ATOM 0 HB2 SER C 87 -9.382 -20.733 -5.970 1.00 0.00 H new ATOM 0 HB3 SER C 87 -9.036 -20.044 -4.396 1.00 0.00 H new ATOM 0 HG SER C 87 -10.971 -19.171 -5.330 1.00 0.00 H new ATOM 1334 N LEU C 88 -6.451 -18.481 -4.126 1.00 0.00 N ATOM 1335 CA LEU C 88 -5.903 -17.460 -3.268 1.00 0.00 C ATOM 1336 C LEU C 88 -4.790 -16.699 -3.977 1.00 0.00 C ATOM 1337 O LEU C 88 -4.507 -15.555 -3.638 1.00 0.00 O ATOM 1338 CB LEU C 88 -5.410 -18.074 -1.958 1.00 0.00 C ATOM 1339 CG LEU C 88 -4.757 -17.096 -0.980 1.00 0.00 C ATOM 1340 CD1 LEU C 88 -5.737 -16.012 -0.554 1.00 0.00 C ATOM 1341 CD2 LEU C 88 -4.229 -17.836 0.235 1.00 0.00 C ATOM 0 H LEU C 88 -6.176 -19.434 -3.887 1.00 0.00 H new ATOM 0 HA LEU C 88 -6.691 -16.746 -3.030 1.00 0.00 H new ATOM 0 HB2 LEU C 88 -6.254 -18.551 -1.460 1.00 0.00 H new ATOM 0 HB3 LEU C 88 -4.693 -18.860 -2.192 1.00 0.00 H new ATOM 0 HG LEU C 88 -3.922 -16.616 -1.490 1.00 0.00 H new ATOM 0 HD11 LEU C 88 -5.246 -15.331 0.141 1.00 0.00 H new ATOM 0 HD12 LEU C 88 -6.070 -15.458 -1.431 1.00 0.00 H new ATOM 0 HD13 LEU C 88 -6.597 -16.470 -0.066 1.00 0.00 H new ATOM 0 HD21 LEU C 88 -3.767 -17.126 0.921 1.00 0.00 H new ATOM 0 HD22 LEU C 88 -5.052 -18.344 0.738 1.00 0.00 H new ATOM 0 HD23 LEU C 88 -3.488 -18.570 -0.080 1.00 0.00 H new ATOM 1353 N ARG C 89 -4.183 -17.319 -4.985 1.00 0.00 N ATOM 1354 CA ARG C 89 -3.129 -16.655 -5.750 1.00 0.00 C ATOM 1355 C ARG C 89 -3.743 -15.534 -6.581 1.00 0.00 C ATOM 1356 O ARG C 89 -3.062 -14.590 -6.954 1.00 0.00 O ATOM 1357 CB ARG C 89 -2.382 -17.609 -6.701 1.00 0.00 C ATOM 1358 CG ARG C 89 -2.250 -19.054 -6.246 1.00 0.00 C ATOM 1359 CD ARG C 89 -1.621 -19.182 -4.873 1.00 0.00 C ATOM 1360 NE ARG C 89 -1.251 -20.554 -4.561 1.00 0.00 N ATOM 1361 CZ ARG C 89 -0.210 -21.179 -5.104 1.00 0.00 C ATOM 1362 NH1 ARG C 89 0.603 -20.529 -5.936 1.00 0.00 N ATOM 1363 NH2 ARG C 89 0.026 -22.441 -4.798 1.00 0.00 N ATOM 0 H ARG C 89 -4.398 -18.268 -5.289 1.00 0.00 H new ATOM 0 HA ARG C 89 -2.407 -16.273 -5.028 1.00 0.00 H new ATOM 0 HB2 ARG C 89 -2.893 -17.600 -7.664 1.00 0.00 H new ATOM 0 HB3 ARG C 89 -1.381 -17.211 -6.867 1.00 0.00 H new ATOM 0 HG2 ARG C 89 -3.236 -19.518 -6.233 1.00 0.00 H new ATOM 0 HG3 ARG C 89 -1.648 -19.604 -6.969 1.00 0.00 H new ATOM 0 HD2 ARG C 89 -0.736 -18.548 -4.821 1.00 0.00 H new ATOM 0 HD3 ARG C 89 -2.319 -18.816 -4.120 1.00 0.00 H new ATOM 0 HE ARG C 89 -1.822 -21.065 -3.888 1.00 0.00 H new ATOM 0 HH11 ARG C 89 0.428 -19.549 -6.158 1.00 0.00 H new ATOM 0 HH12 ARG C 89 1.400 -21.011 -6.351 1.00 0.00 H new ATOM 0 HH21 ARG C 89 -0.588 -22.932 -4.148 1.00 0.00 H new ATOM 0 HH22 ARG C 89 0.823 -22.926 -5.211 1.00 0.00 H new ATOM 1377 N GLN C 90 -5.039 -15.629 -6.851 1.00 0.00 N ATOM 1378 CA GLN C 90 -5.711 -14.592 -7.618 1.00 0.00 C ATOM 1379 C GLN C 90 -5.890 -13.376 -6.726 1.00 0.00 C ATOM 1380 O GLN C 90 -5.758 -12.232 -7.159 1.00 0.00 O ATOM 1381 CB GLN C 90 -7.071 -15.082 -8.121 1.00 0.00 C ATOM 1382 CG GLN C 90 -7.171 -16.594 -8.243 1.00 0.00 C ATOM 1383 CD GLN C 90 -8.480 -17.048 -8.856 1.00 0.00 C ATOM 1384 OE1 GLN C 90 -9.558 -16.711 -8.365 1.00 0.00 O ATOM 1385 NE2 GLN C 90 -8.398 -17.823 -9.927 1.00 0.00 N ATOM 0 H GLN C 90 -5.636 -16.401 -6.555 1.00 0.00 H new ATOM 0 HA GLN C 90 -5.108 -14.335 -8.489 1.00 0.00 H new ATOM 0 HB2 GLN C 90 -7.848 -14.729 -7.442 1.00 0.00 H new ATOM 0 HB3 GLN C 90 -7.271 -14.634 -9.094 1.00 0.00 H new ATOM 0 HG2 GLN C 90 -6.344 -16.960 -8.851 1.00 0.00 H new ATOM 0 HG3 GLN C 90 -7.063 -17.042 -7.255 1.00 0.00 H new ATOM 0 HE21 GLN C 90 -7.485 -18.079 -10.302 1.00 0.00 H new ATOM 0 HE22 GLN C 90 -9.248 -18.164 -10.376 1.00 0.00 H new ATOM 1394 N GLN C 91 -6.172 -13.650 -5.458 1.00 0.00 N ATOM 1395 CA GLN C 91 -6.358 -12.606 -4.469 1.00 0.00 C ATOM 1396 C GLN C 91 -5.024 -11.949 -4.137 1.00 0.00 C ATOM 1397 O GLN C 91 -4.971 -10.758 -3.856 1.00 0.00 O ATOM 1398 CB GLN C 91 -7.000 -13.182 -3.203 1.00 0.00 C ATOM 1399 CG GLN C 91 -8.313 -13.908 -3.451 1.00 0.00 C ATOM 1400 CD GLN C 91 -9.388 -13.011 -4.030 1.00 0.00 C ATOM 1401 OE1 GLN C 91 -9.271 -12.522 -5.156 1.00 0.00 O ATOM 1402 NE2 GLN C 91 -10.439 -12.782 -3.260 1.00 0.00 N ATOM 0 H GLN C 91 -6.277 -14.596 -5.092 1.00 0.00 H new ATOM 0 HA GLN C 91 -7.024 -11.849 -4.882 1.00 0.00 H new ATOM 0 HB2 GLN C 91 -6.298 -13.872 -2.734 1.00 0.00 H new ATOM 0 HB3 GLN C 91 -7.173 -12.372 -2.495 1.00 0.00 H new ATOM 0 HG2 GLN C 91 -8.138 -14.741 -4.132 1.00 0.00 H new ATOM 0 HG3 GLN C 91 -8.669 -14.333 -2.513 1.00 0.00 H new ATOM 0 HE21 GLN C 91 -10.495 -13.207 -2.334 1.00 0.00 H new ATOM 0 HE22 GLN C 91 -11.193 -12.180 -3.592 1.00 0.00 H new ATOM 1411 N VAL C 92 -3.939 -12.723 -4.181 1.00 0.00 N ATOM 1412 CA VAL C 92 -2.622 -12.172 -3.890 1.00 0.00 C ATOM 1413 C VAL C 92 -2.127 -11.322 -5.054 1.00 0.00 C ATOM 1414 O VAL C 92 -1.447 -10.320 -4.838 1.00 0.00 O ATOM 1415 CB VAL C 92 -1.579 -13.259 -3.512 1.00 0.00 C ATOM 1416 CG1 VAL C 92 -2.050 -14.044 -2.299 1.00 0.00 C ATOM 1417 CG2 VAL C 92 -1.285 -14.193 -4.663 1.00 0.00 C ATOM 0 H VAL C 92 -3.947 -13.717 -4.412 1.00 0.00 H new ATOM 0 HA VAL C 92 -2.735 -11.537 -3.011 1.00 0.00 H new ATOM 0 HB VAL C 92 -0.649 -12.745 -3.268 1.00 0.00 H new ATOM 0 HG11 VAL C 92 -1.309 -14.802 -2.046 1.00 0.00 H new ATOM 0 HG12 VAL C 92 -2.179 -13.367 -1.455 1.00 0.00 H new ATOM 0 HG13 VAL C 92 -3.001 -14.527 -2.525 1.00 0.00 H new ATOM 0 HG21 VAL C 92 -0.551 -14.935 -4.351 1.00 0.00 H new ATOM 0 HG22 VAL C 92 -2.203 -14.696 -4.967 1.00 0.00 H new ATOM 0 HG23 VAL C 92 -0.889 -13.622 -5.503 1.00 0.00 H new ATOM 1427 N GLU C 93 -2.512 -11.683 -6.280 1.00 0.00 N ATOM 1428 CA GLU C 93 -2.139 -10.891 -7.445 1.00 0.00 C ATOM 1429 C GLU C 93 -2.901 -9.575 -7.393 1.00 0.00 C ATOM 1430 O GLU C 93 -2.415 -8.528 -7.826 1.00 0.00 O ATOM 1431 CB GLU C 93 -2.438 -11.629 -8.747 1.00 0.00 C ATOM 1432 CG GLU C 93 -1.568 -12.853 -8.970 1.00 0.00 C ATOM 1433 CD GLU C 93 -1.807 -13.490 -10.318 1.00 0.00 C ATOM 1434 OE1 GLU C 93 -1.592 -12.808 -11.341 1.00 0.00 O ATOM 1435 OE2 GLU C 93 -2.202 -14.670 -10.359 1.00 0.00 O ATOM 0 H GLU C 93 -3.075 -12.508 -6.487 1.00 0.00 H new ATOM 0 HA GLU C 93 -1.065 -10.708 -7.423 1.00 0.00 H new ATOM 0 HB2 GLU C 93 -3.485 -11.933 -8.749 1.00 0.00 H new ATOM 0 HB3 GLU C 93 -2.304 -10.942 -9.583 1.00 0.00 H new ATOM 0 HG2 GLU C 93 -0.519 -12.570 -8.886 1.00 0.00 H new ATOM 0 HG3 GLU C 93 -1.765 -13.584 -8.186 1.00 0.00 H new ATOM 1442 N ALA C 94 -4.089 -9.644 -6.811 1.00 0.00 N ATOM 1443 CA ALA C 94 -4.931 -8.477 -6.626 1.00 0.00 C ATOM 1444 C ALA C 94 -4.257 -7.505 -5.673 1.00 0.00 C ATOM 1445 O ALA C 94 -4.079 -6.324 -5.972 1.00 0.00 O ATOM 1446 CB ALA C 94 -6.247 -8.917 -6.035 1.00 0.00 C ATOM 0 H ALA C 94 -4.494 -10.510 -6.455 1.00 0.00 H new ATOM 0 HA ALA C 94 -5.094 -7.986 -7.585 1.00 0.00 H new ATOM 0 HB1 ALA C 94 -6.890 -8.048 -5.891 1.00 0.00 H new ATOM 0 HB2 ALA C 94 -6.733 -9.620 -6.712 1.00 0.00 H new ATOM 0 HB3 ALA C 94 -6.071 -9.401 -5.075 1.00 0.00 H new ATOM 1452 N LEU C 95 -3.884 -8.043 -4.518 1.00 0.00 N ATOM 1453 CA LEU C 95 -3.219 -7.285 -3.471 1.00 0.00 C ATOM 1454 C LEU C 95 -1.932 -6.649 -3.969 1.00 0.00 C ATOM 1455 O LEU C 95 -1.593 -5.530 -3.579 1.00 0.00 O ATOM 1456 CB LEU C 95 -2.895 -8.207 -2.286 1.00 0.00 C ATOM 1457 CG LEU C 95 -3.924 -8.232 -1.152 1.00 0.00 C ATOM 1458 CD1 LEU C 95 -3.979 -6.875 -0.477 1.00 0.00 C ATOM 1459 CD2 LEU C 95 -5.297 -8.637 -1.666 1.00 0.00 C ATOM 0 H LEU C 95 -4.036 -9.024 -4.282 1.00 0.00 H new ATOM 0 HA LEU C 95 -3.897 -6.491 -3.159 1.00 0.00 H new ATOM 0 HB2 LEU C 95 -2.776 -9.222 -2.664 1.00 0.00 H new ATOM 0 HB3 LEU C 95 -1.933 -7.907 -1.870 1.00 0.00 H new ATOM 0 HG LEU C 95 -3.615 -8.978 -0.420 1.00 0.00 H new ATOM 0 HD11 LEU C 95 -4.713 -6.899 0.329 1.00 0.00 H new ATOM 0 HD12 LEU C 95 -2.998 -6.632 -0.068 1.00 0.00 H new ATOM 0 HD13 LEU C 95 -4.266 -6.117 -1.206 1.00 0.00 H new ATOM 0 HD21 LEU C 95 -6.007 -8.646 -0.839 1.00 0.00 H new ATOM 0 HD22 LEU C 95 -5.628 -7.923 -2.421 1.00 0.00 H new ATOM 0 HD23 LEU C 95 -5.241 -9.632 -2.107 1.00 0.00 H new ATOM 1471 N GLN C 96 -1.206 -7.363 -4.818 1.00 0.00 N ATOM 1472 CA GLN C 96 0.055 -6.838 -5.331 1.00 0.00 C ATOM 1473 C GLN C 96 -0.179 -5.786 -6.397 1.00 0.00 C ATOM 1474 O GLN C 96 0.651 -4.914 -6.593 1.00 0.00 O ATOM 1475 CB GLN C 96 0.980 -7.951 -5.848 1.00 0.00 C ATOM 1476 CG GLN C 96 0.460 -8.709 -7.058 1.00 0.00 C ATOM 1477 CD GLN C 96 1.407 -9.793 -7.525 1.00 0.00 C ATOM 1478 OE1 GLN C 96 1.722 -10.722 -6.780 1.00 0.00 O ATOM 1479 NE2 GLN C 96 1.867 -9.680 -8.762 1.00 0.00 N ATOM 0 H GLN C 96 -1.460 -8.289 -5.162 1.00 0.00 H new ATOM 0 HA GLN C 96 0.563 -6.362 -4.492 1.00 0.00 H new ATOM 0 HB2 GLN C 96 1.945 -7.512 -6.100 1.00 0.00 H new ATOM 0 HB3 GLN C 96 1.154 -8.662 -5.040 1.00 0.00 H new ATOM 0 HG2 GLN C 96 -0.504 -9.156 -6.814 1.00 0.00 H new ATOM 0 HG3 GLN C 96 0.288 -8.007 -7.874 1.00 0.00 H new ATOM 0 HE21 GLN C 96 1.579 -8.893 -9.343 1.00 0.00 H new ATOM 0 HE22 GLN C 96 2.510 -10.380 -9.133 1.00 0.00 H new ATOM 1488 N GLY C 97 -1.318 -5.846 -7.062 1.00 0.00 N ATOM 1489 CA GLY C 97 -1.621 -4.847 -8.068 1.00 0.00 C ATOM 1490 C GLY C 97 -1.883 -3.501 -7.425 1.00 0.00 C ATOM 1491 O GLY C 97 -1.492 -2.447 -7.942 1.00 0.00 O ATOM 0 H GLY C 97 -2.034 -6.560 -6.928 1.00 0.00 H new ATOM 0 HA2 GLY C 97 -0.790 -4.765 -8.768 1.00 0.00 H new ATOM 0 HA3 GLY C 97 -2.493 -5.156 -8.644 1.00 0.00 H new ATOM 1495 N GLN C 98 -2.533 -3.540 -6.274 1.00 0.00 N ATOM 1496 CA GLN C 98 -2.855 -2.332 -5.539 1.00 0.00 C ATOM 1497 C GLN C 98 -1.618 -1.740 -4.885 1.00 0.00 C ATOM 1498 O GLN C 98 -1.387 -0.541 -4.955 1.00 0.00 O ATOM 1499 CB GLN C 98 -3.911 -2.627 -4.475 1.00 0.00 C ATOM 1500 CG GLN C 98 -5.150 -3.313 -5.017 1.00 0.00 C ATOM 1501 CD GLN C 98 -6.157 -3.623 -3.931 1.00 0.00 C ATOM 1502 OE1 GLN C 98 -5.872 -4.379 -3.002 1.00 0.00 O ATOM 1503 NE2 GLN C 98 -7.338 -3.035 -4.034 1.00 0.00 N ATOM 0 H GLN C 98 -2.849 -4.401 -5.828 1.00 0.00 H new ATOM 0 HA GLN C 98 -3.250 -1.604 -6.248 1.00 0.00 H new ATOM 0 HB2 GLN C 98 -3.469 -3.255 -3.701 1.00 0.00 H new ATOM 0 HB3 GLN C 98 -4.204 -1.692 -3.998 1.00 0.00 H new ATOM 0 HG2 GLN C 98 -5.615 -2.676 -5.770 1.00 0.00 H new ATOM 0 HG3 GLN C 98 -4.861 -4.238 -5.516 1.00 0.00 H new ATOM 0 HE21 GLN C 98 -7.532 -2.415 -4.821 1.00 0.00 H new ATOM 0 HE22 GLN C 98 -8.054 -3.201 -3.327 1.00 0.00 H new ATOM 1512 N VAL C 99 -0.827 -2.566 -4.238 1.00 0.00 N ATOM 1513 CA VAL C 99 0.361 -2.069 -3.568 1.00 0.00 C ATOM 1514 C VAL C 99 1.422 -1.605 -4.569 1.00 0.00 C ATOM 1515 O VAL C 99 2.166 -0.665 -4.291 1.00 0.00 O ATOM 1516 CB VAL C 99 0.941 -3.138 -2.609 1.00 0.00 C ATOM 1517 CG1 VAL C 99 1.416 -4.364 -3.378 1.00 0.00 C ATOM 1518 CG2 VAL C 99 2.074 -2.578 -1.770 1.00 0.00 C ATOM 0 H VAL C 99 -0.978 -3.572 -4.160 1.00 0.00 H new ATOM 0 HA VAL C 99 0.065 -1.202 -2.978 1.00 0.00 H new ATOM 0 HB VAL C 99 0.136 -3.437 -1.937 1.00 0.00 H new ATOM 0 HG11 VAL C 99 1.818 -5.098 -2.680 1.00 0.00 H new ATOM 0 HG12 VAL C 99 0.577 -4.801 -3.920 1.00 0.00 H new ATOM 0 HG13 VAL C 99 2.193 -4.072 -4.085 1.00 0.00 H new ATOM 0 HG21 VAL C 99 2.456 -3.356 -1.109 1.00 0.00 H new ATOM 0 HG22 VAL C 99 2.874 -2.232 -2.424 1.00 0.00 H new ATOM 0 HG23 VAL C 99 1.707 -1.743 -1.173 1.00 0.00 H new ATOM 1528 N GLN C 100 1.491 -2.249 -5.728 1.00 0.00 N ATOM 1529 CA GLN C 100 2.475 -1.862 -6.732 1.00 0.00 C ATOM 1530 C GLN C 100 2.158 -0.491 -7.299 1.00 0.00 C ATOM 1531 O GLN C 100 3.061 0.318 -7.485 1.00 0.00 O ATOM 1532 CB GLN C 100 2.581 -2.890 -7.865 1.00 0.00 C ATOM 1533 CG GLN C 100 1.378 -2.940 -8.795 1.00 0.00 C ATOM 1534 CD GLN C 100 1.570 -3.949 -9.908 1.00 0.00 C ATOM 1535 OE1 GLN C 100 0.968 -5.121 -9.768 1.00 0.00 O flip ATOM 1536 NE2 GLN C 100 2.291 -3.692 -10.869 1.00 0.00 N flip ATOM 0 H GLN C 100 0.889 -3.028 -5.993 1.00 0.00 H new ATOM 0 HA GLN C 100 3.441 -1.824 -6.229 1.00 0.00 H new ATOM 0 HB2 GLN C 100 3.470 -2.669 -8.455 1.00 0.00 H new ATOM 0 HB3 GLN C 100 2.726 -3.878 -7.428 1.00 0.00 H new ATOM 0 HG2 GLN C 100 0.486 -3.195 -8.223 1.00 0.00 H new ATOM 0 HG3 GLN C 100 1.209 -1.953 -9.225 1.00 0.00 H new ATOM 0 HE21 GLN C 100 2.737 -2.778 -10.942 1.00 0.00 H new ATOM 0 HE22 GLN C 100 2.443 -4.393 -11.594 1.00 0.00 H new ATOM 1545 N HIS C 101 0.886 -0.215 -7.574 1.00 0.00 N ATOM 1546 CA HIS C 101 0.541 1.088 -8.116 1.00 0.00 C ATOM 1547 C HIS C 101 0.517 2.140 -7.005 1.00 0.00 C ATOM 1548 O HIS C 101 0.637 3.333 -7.274 1.00 0.00 O ATOM 1549 CB HIS C 101 -0.768 1.051 -8.917 1.00 0.00 C ATOM 1550 CG HIS C 101 -1.986 1.255 -8.112 1.00 0.00 C ATOM 1551 ND1 HIS C 101 -2.445 0.333 -7.235 1.00 0.00 N ATOM 1552 CD2 HIS C 101 -2.823 2.318 -8.024 1.00 0.00 C ATOM 1553 CE1 HIS C 101 -3.515 0.830 -6.638 1.00 0.00 C ATOM 1554 NE2 HIS C 101 -3.799 2.038 -7.079 1.00 0.00 N ATOM 0 H HIS C 101 0.103 -0.854 -7.435 1.00 0.00 H new ATOM 0 HA HIS C 101 1.317 1.375 -8.826 1.00 0.00 H new ATOM 0 HB2 HIS C 101 -0.727 1.818 -9.691 1.00 0.00 H new ATOM 0 HB3 HIS C 101 -0.841 0.089 -9.425 1.00 0.00 H new ATOM 0 HD2 HIS C 101 -2.743 3.231 -8.595 1.00 0.00 H new ATOM 0 HE1 HIS C 101 -4.085 0.310 -5.883 1.00 0.00 H new ATOM 0 HE2 HIS C 101 -4.571 2.638 -6.788 1.00 0.00 H new ATOM 1562 N LEU C 102 0.413 1.694 -5.747 1.00 0.00 N ATOM 1563 CA LEU C 102 0.440 2.619 -4.615 1.00 0.00 C ATOM 1564 C LEU C 102 1.849 3.140 -4.438 1.00 0.00 C ATOM 1565 O LEU C 102 2.059 4.330 -4.241 1.00 0.00 O ATOM 1566 CB LEU C 102 -0.018 1.961 -3.311 1.00 0.00 C ATOM 1567 CG LEU C 102 -1.518 1.717 -3.185 1.00 0.00 C ATOM 1568 CD1 LEU C 102 -1.877 1.371 -1.750 1.00 0.00 C ATOM 1569 CD2 LEU C 102 -2.292 2.934 -3.650 1.00 0.00 C ATOM 0 H LEU C 102 0.311 0.712 -5.492 1.00 0.00 H new ATOM 0 HA LEU C 102 -0.254 3.430 -4.835 1.00 0.00 H new ATOM 0 HB2 LEU C 102 0.497 1.006 -3.207 1.00 0.00 H new ATOM 0 HB3 LEU C 102 0.301 2.587 -2.478 1.00 0.00 H new ATOM 0 HG LEU C 102 -1.789 0.874 -3.821 1.00 0.00 H new ATOM 0 HD11 LEU C 102 -2.951 1.199 -1.675 1.00 0.00 H new ATOM 0 HD12 LEU C 102 -1.344 0.469 -1.449 1.00 0.00 H new ATOM 0 HD13 LEU C 102 -1.595 2.196 -1.095 1.00 0.00 H new ATOM 0 HD21 LEU C 102 -3.361 2.744 -3.554 1.00 0.00 H new ATOM 0 HD22 LEU C 102 -2.020 3.794 -3.038 1.00 0.00 H new ATOM 0 HD23 LEU C 102 -2.053 3.141 -4.693 1.00 0.00 H new ATOM 1581 N GLN C 103 2.812 2.233 -4.537 1.00 0.00 N ATOM 1582 CA GLN C 103 4.216 2.587 -4.423 1.00 0.00 C ATOM 1583 C GLN C 103 4.607 3.383 -5.666 1.00 0.00 C ATOM 1584 O GLN C 103 5.411 4.309 -5.604 1.00 0.00 O ATOM 1585 CB GLN C 103 5.067 1.313 -4.289 1.00 0.00 C ATOM 1586 CG GLN C 103 6.385 1.497 -3.543 1.00 0.00 C ATOM 1587 CD GLN C 103 7.396 2.318 -4.315 1.00 0.00 C ATOM 1588 OE1 GLN C 103 7.796 1.947 -5.418 1.00 0.00 O ATOM 1589 NE2 GLN C 103 7.817 3.436 -3.743 1.00 0.00 N ATOM 0 H GLN C 103 2.642 1.240 -4.697 1.00 0.00 H new ATOM 0 HA GLN C 103 4.389 3.194 -3.535 1.00 0.00 H new ATOM 0 HB2 GLN C 103 4.479 0.553 -3.775 1.00 0.00 H new ATOM 0 HB3 GLN C 103 5.281 0.930 -5.287 1.00 0.00 H new ATOM 0 HG2 GLN C 103 6.189 1.980 -2.586 1.00 0.00 H new ATOM 0 HG3 GLN C 103 6.812 0.518 -3.325 1.00 0.00 H new ATOM 0 HE21 GLN C 103 7.459 3.706 -2.827 1.00 0.00 H new ATOM 0 HE22 GLN C 103 8.499 4.027 -4.219 1.00 0.00 H new ATOM 1598 N ALA C 104 3.991 3.015 -6.785 1.00 0.00 N ATOM 1599 CA ALA C 104 4.207 3.678 -8.063 1.00 0.00 C ATOM 1600 C ALA C 104 3.905 5.161 -7.943 1.00 0.00 C ATOM 1601 O ALA C 104 4.754 6.006 -8.226 1.00 0.00 O ATOM 1602 CB ALA C 104 3.303 3.054 -9.115 1.00 0.00 C ATOM 0 H ALA C 104 3.325 2.244 -6.829 1.00 0.00 H new ATOM 0 HA ALA C 104 5.249 3.555 -8.357 1.00 0.00 H new ATOM 0 HB1 ALA C 104 3.463 3.549 -10.073 1.00 0.00 H new ATOM 0 HB2 ALA C 104 3.535 1.993 -9.212 1.00 0.00 H new ATOM 0 HB3 ALA C 104 2.261 3.171 -8.816 1.00 0.00 H new ATOM 1608 N ALA C 105 2.694 5.461 -7.499 1.00 0.00 N ATOM 1609 CA ALA C 105 2.261 6.834 -7.310 1.00 0.00 C ATOM 1610 C ALA C 105 3.111 7.500 -6.241 1.00 0.00 C ATOM 1611 O ALA C 105 3.504 8.656 -6.374 1.00 0.00 O ATOM 1612 CB ALA C 105 0.790 6.872 -6.922 1.00 0.00 C ATOM 0 H ALA C 105 1.989 4.763 -7.261 1.00 0.00 H new ATOM 0 HA ALA C 105 2.384 7.379 -8.246 1.00 0.00 H new ATOM 0 HB1 ALA C 105 0.477 7.907 -6.783 1.00 0.00 H new ATOM 0 HB2 ALA C 105 0.193 6.415 -7.712 1.00 0.00 H new ATOM 0 HB3 ALA C 105 0.644 6.321 -5.993 1.00 0.00 H new ATOM 1618 N PHE C 106 3.393 6.744 -5.187 1.00 0.00 N ATOM 1619 CA PHE C 106 4.198 7.220 -4.069 1.00 0.00 C ATOM 1620 C PHE C 106 5.573 7.685 -4.523 1.00 0.00 C ATOM 1621 O PHE C 106 6.188 8.495 -3.852 1.00 0.00 O ATOM 1622 CB PHE C 106 4.354 6.114 -3.025 1.00 0.00 C ATOM 1623 CG PHE C 106 3.912 6.498 -1.641 1.00 0.00 C ATOM 1624 CD1 PHE C 106 3.725 7.829 -1.289 1.00 0.00 C ATOM 1625 CD2 PHE C 106 3.686 5.517 -0.687 1.00 0.00 C ATOM 1626 CE1 PHE C 106 3.315 8.163 -0.015 1.00 0.00 C ATOM 1627 CE2 PHE C 106 3.275 5.850 0.586 1.00 0.00 C ATOM 1628 CZ PHE C 106 3.091 7.173 0.921 1.00 0.00 C ATOM 0 H PHE C 106 3.069 5.782 -5.083 1.00 0.00 H new ATOM 0 HA PHE C 106 3.678 8.072 -3.631 1.00 0.00 H new ATOM 0 HB2 PHE C 106 3.782 5.244 -3.347 1.00 0.00 H new ATOM 0 HB3 PHE C 106 5.401 5.812 -2.988 1.00 0.00 H new ATOM 0 HD1 PHE C 106 3.902 8.607 -2.017 1.00 0.00 H new ATOM 0 HD2 PHE C 106 3.834 4.479 -0.945 1.00 0.00 H new ATOM 0 HE1 PHE C 106 3.169 9.200 0.251 1.00 0.00 H new ATOM 0 HE2 PHE C 106 3.098 5.076 1.318 1.00 0.00 H new ATOM 0 HZ PHE C 106 2.771 7.437 1.918 1.00 0.00 H new ATOM 1638 N SER C 107 6.055 7.175 -5.658 1.00 0.00 N ATOM 1639 CA SER C 107 7.366 7.569 -6.177 1.00 0.00 C ATOM 1640 C SER C 107 7.440 9.087 -6.340 1.00 0.00 C ATOM 1641 O SER C 107 8.516 9.680 -6.257 1.00 0.00 O ATOM 1642 CB SER C 107 7.646 6.867 -7.512 1.00 0.00 C ATOM 1643 OG SER C 107 8.954 7.148 -7.988 1.00 0.00 O ATOM 0 H SER C 107 5.561 6.492 -6.232 1.00 0.00 H new ATOM 0 HA SER C 107 8.130 7.263 -5.462 1.00 0.00 H new ATOM 0 HB2 SER C 107 7.527 5.791 -7.389 1.00 0.00 H new ATOM 0 HB3 SER C 107 6.913 7.187 -8.252 1.00 0.00 H new ATOM 0 HG SER C 107 9.099 6.684 -8.839 1.00 0.00 H new ATOM 1649 N GLN C 108 6.283 9.703 -6.537 1.00 0.00 N ATOM 1650 CA GLN C 108 6.188 11.148 -6.674 1.00 0.00 C ATOM 1651 C GLN C 108 5.909 11.791 -5.317 1.00 0.00 C ATOM 1652 O GLN C 108 6.606 12.707 -4.891 1.00 0.00 O ATOM 1653 CB GLN C 108 5.064 11.512 -7.658 1.00 0.00 C ATOM 1654 CG GLN C 108 5.254 10.947 -9.059 1.00 0.00 C ATOM 1655 CD GLN C 108 6.255 11.734 -9.885 1.00 0.00 C ATOM 1656 OE1 GLN C 108 6.640 12.906 -9.401 1.00 0.00 O flip ATOM 1657 NE2 GLN C 108 6.653 11.303 -10.964 1.00 0.00 N flip ATOM 0 H GLN C 108 5.389 9.218 -6.606 1.00 0.00 H new ATOM 0 HA GLN C 108 7.137 11.523 -7.057 1.00 0.00 H new ATOM 0 HB2 GLN C 108 4.116 11.152 -7.259 1.00 0.00 H new ATOM 0 HB3 GLN C 108 4.991 12.598 -7.723 1.00 0.00 H new ATOM 0 HG2 GLN C 108 5.586 9.912 -8.985 1.00 0.00 H new ATOM 0 HG3 GLN C 108 4.294 10.938 -9.574 1.00 0.00 H new ATOM 0 HE21 GLN C 108 6.332 10.395 -11.300 1.00 0.00 H new ATOM 0 HE22 GLN C 108 7.305 11.853 -11.524 1.00 0.00 H new ATOM 1666 N TYR C 109 4.869 11.307 -4.654 1.00 0.00 N ATOM 1667 CA TYR C 109 4.446 11.839 -3.356 1.00 0.00 C ATOM 1668 C TYR C 109 5.492 11.662 -2.260 1.00 0.00 C ATOM 1669 O TYR C 109 5.454 12.354 -1.245 1.00 0.00 O ATOM 1670 CB TYR C 109 3.145 11.175 -2.937 1.00 0.00 C ATOM 1671 CG TYR C 109 2.139 11.190 -4.051 1.00 0.00 C ATOM 1672 CD1 TYR C 109 1.740 12.381 -4.637 1.00 0.00 C ATOM 1673 CD2 TYR C 109 1.633 10.012 -4.551 1.00 0.00 C ATOM 1674 CE1 TYR C 109 0.864 12.389 -5.692 1.00 0.00 C ATOM 1675 CE2 TYR C 109 0.748 10.006 -5.599 1.00 0.00 C ATOM 1676 CZ TYR C 109 0.365 11.197 -6.175 1.00 0.00 C ATOM 1677 OH TYR C 109 -0.508 11.194 -7.237 1.00 0.00 O ATOM 0 H TYR C 109 4.293 10.537 -4.995 1.00 0.00 H new ATOM 0 HA TYR C 109 4.307 12.913 -3.483 1.00 0.00 H new ATOM 0 HB2 TYR C 109 3.341 10.146 -2.635 1.00 0.00 H new ATOM 0 HB3 TYR C 109 2.735 11.690 -2.068 1.00 0.00 H new ATOM 0 HD1 TYR C 109 2.125 13.316 -4.257 1.00 0.00 H new ATOM 0 HD2 TYR C 109 1.938 9.075 -4.110 1.00 0.00 H new ATOM 0 HE1 TYR C 109 0.566 13.324 -6.143 1.00 0.00 H new ATOM 0 HE2 TYR C 109 0.353 9.072 -5.971 1.00 0.00 H new ATOM 0 HH TYR C 109 -1.044 12.014 -7.222 1.00 0.00 H new ATOM 1687 N LYS C 110 6.414 10.735 -2.453 1.00 0.00 N ATOM 1688 CA LYS C 110 7.449 10.491 -1.456 1.00 0.00 C ATOM 1689 C LYS C 110 8.383 11.695 -1.336 1.00 0.00 C ATOM 1690 O LYS C 110 8.976 11.925 -0.287 1.00 0.00 O ATOM 1691 CB LYS C 110 8.254 9.228 -1.772 1.00 0.00 C ATOM 1692 CG LYS C 110 9.073 9.316 -3.054 1.00 0.00 C ATOM 1693 CD LYS C 110 10.254 8.347 -3.059 1.00 0.00 C ATOM 1694 CE LYS C 110 9.815 6.886 -3.023 1.00 0.00 C ATOM 1695 NZ LYS C 110 9.546 6.404 -1.637 1.00 0.00 N ATOM 0 H LYS C 110 6.470 10.143 -3.281 1.00 0.00 H new ATOM 0 HA LYS C 110 6.947 10.338 -0.501 1.00 0.00 H new ATOM 0 HB2 LYS C 110 8.925 9.020 -0.939 1.00 0.00 H new ATOM 0 HB3 LYS C 110 7.569 8.383 -1.848 1.00 0.00 H new ATOM 0 HG2 LYS C 110 8.430 9.105 -3.908 1.00 0.00 H new ATOM 0 HG3 LYS C 110 9.442 10.334 -3.177 1.00 0.00 H new ATOM 0 HD2 LYS C 110 10.857 8.519 -3.951 1.00 0.00 H new ATOM 0 HD3 LYS C 110 10.891 8.552 -2.199 1.00 0.00 H new ATOM 0 HE2 LYS C 110 8.916 6.765 -3.627 1.00 0.00 H new ATOM 0 HE3 LYS C 110 10.589 6.266 -3.476 1.00 0.00 H new ATOM 0 HZ1 LYS C 110 9.846 5.412 -1.550 1.00 0.00 H new ATOM 0 HZ2 LYS C 110 10.076 6.987 -0.958 1.00 0.00 H new ATOM 0 HZ3 LYS C 110 8.528 6.477 -1.436 1.00 0.00 H new ATOM 1709 N LYS C 111 8.495 12.478 -2.401 1.00 0.00 N ATOM 1710 CA LYS C 111 9.340 13.666 -2.379 1.00 0.00 C ATOM 1711 C LYS C 111 8.475 14.918 -2.347 1.00 0.00 C ATOM 1712 O LYS C 111 8.810 15.954 -2.923 1.00 0.00 O ATOM 1713 CB LYS C 111 10.314 13.674 -3.570 1.00 0.00 C ATOM 1714 CG LYS C 111 9.677 13.348 -4.917 1.00 0.00 C ATOM 1715 CD LYS C 111 9.068 14.578 -5.573 1.00 0.00 C ATOM 1716 CE LYS C 111 8.462 14.258 -6.930 1.00 0.00 C ATOM 1717 NZ LYS C 111 9.482 13.783 -7.907 1.00 0.00 N ATOM 0 H LYS C 111 8.015 12.314 -3.286 1.00 0.00 H new ATOM 0 HA LYS C 111 9.947 13.651 -1.474 1.00 0.00 H new ATOM 0 HB2 LYS C 111 10.781 14.657 -3.633 1.00 0.00 H new ATOM 0 HB3 LYS C 111 11.109 12.954 -3.376 1.00 0.00 H new ATOM 0 HG2 LYS C 111 10.429 12.919 -5.579 1.00 0.00 H new ATOM 0 HG3 LYS C 111 8.905 12.591 -4.779 1.00 0.00 H new ATOM 0 HD2 LYS C 111 8.299 14.993 -4.921 1.00 0.00 H new ATOM 0 HD3 LYS C 111 9.835 15.344 -5.690 1.00 0.00 H new ATOM 0 HE2 LYS C 111 7.693 13.495 -6.811 1.00 0.00 H new ATOM 0 HE3 LYS C 111 7.970 15.147 -7.325 1.00 0.00 H new ATOM 0 HZ1 LYS C 111 9.070 13.772 -8.862 1.00 0.00 H new ATOM 0 HZ2 LYS C 111 10.302 14.423 -7.892 1.00 0.00 H new ATOM 0 HZ3 LYS C 111 9.787 12.822 -7.651 1.00 0.00 H new ATOM 1731 N VAL C 112 7.354 14.800 -1.653 1.00 0.00 N ATOM 1732 CA VAL C 112 6.416 15.899 -1.512 1.00 0.00 C ATOM 1733 C VAL C 112 6.594 16.609 -0.166 1.00 0.00 C ATOM 1734 O VAL C 112 6.471 17.836 -0.085 1.00 0.00 O ATOM 1735 CB VAL C 112 4.957 15.404 -1.693 1.00 0.00 C ATOM 1736 CG1 VAL C 112 3.947 16.377 -1.113 1.00 0.00 C ATOM 1737 CG2 VAL C 112 4.672 15.158 -3.168 1.00 0.00 C ATOM 0 H VAL C 112 7.071 13.945 -1.175 1.00 0.00 H new ATOM 0 HA VAL C 112 6.627 16.624 -2.298 1.00 0.00 H new ATOM 0 HB VAL C 112 4.854 14.469 -1.143 1.00 0.00 H new ATOM 0 HG11 VAL C 112 2.940 15.988 -1.263 1.00 0.00 H new ATOM 0 HG12 VAL C 112 4.133 16.501 -0.046 1.00 0.00 H new ATOM 0 HG13 VAL C 112 4.042 17.341 -1.613 1.00 0.00 H new ATOM 0 HG21 VAL C 112 3.646 14.811 -3.287 1.00 0.00 H new ATOM 0 HG22 VAL C 112 4.808 16.085 -3.724 1.00 0.00 H new ATOM 0 HG23 VAL C 112 5.358 14.402 -3.550 1.00 0.00 H new ATOM 1747 N GLU C 113 6.913 15.860 0.891 1.00 0.00 N ATOM 1748 CA GLU C 113 7.115 16.486 2.193 1.00 0.00 C ATOM 1749 C GLU C 113 8.549 16.911 2.375 1.00 0.00 C ATOM 1750 O GLU C 113 9.408 16.168 2.857 1.00 0.00 O ATOM 1751 CB GLU C 113 6.721 15.599 3.337 1.00 0.00 C ATOM 1752 CG GLU C 113 6.803 16.310 4.681 1.00 0.00 C ATOM 1753 CD GLU C 113 6.734 15.362 5.855 1.00 0.00 C ATOM 1754 OE1 GLU C 113 5.677 14.749 6.065 1.00 0.00 O ATOM 1755 OE2 GLU C 113 7.749 15.235 6.568 1.00 0.00 O ATOM 0 H GLU C 113 7.034 14.847 0.872 1.00 0.00 H new ATOM 0 HA GLU C 113 6.463 17.360 2.204 1.00 0.00 H new ATOM 0 HB2 GLU C 113 5.704 15.240 3.181 1.00 0.00 H new ATOM 0 HB3 GLU C 113 7.369 14.723 3.353 1.00 0.00 H new ATOM 0 HG2 GLU C 113 7.734 16.874 4.731 1.00 0.00 H new ATOM 0 HG3 GLU C 113 5.989 17.031 4.755 1.00 0.00 H new ATOM 1762 N LEU C 114 8.764 18.123 1.970 1.00 0.00 N ATOM 1763 CA LEU C 114 10.061 18.798 2.024 1.00 0.00 C ATOM 1764 C LEU C 114 9.869 20.286 1.760 1.00 0.00 C ATOM 1765 O LEU C 114 10.515 21.126 2.389 1.00 0.00 O ATOM 1766 CB LEU C 114 11.032 18.167 1.020 1.00 0.00 C ATOM 1767 CG LEU C 114 10.330 17.368 -0.072 1.00 0.00 C ATOM 1768 CD1 LEU C 114 9.644 18.251 -1.086 1.00 0.00 C ATOM 1769 CD2 LEU C 114 11.258 16.393 -0.732 1.00 0.00 C ATOM 0 H LEU C 114 8.027 18.707 1.575 1.00 0.00 H new ATOM 0 HA LEU C 114 10.496 18.679 3.016 1.00 0.00 H new ATOM 0 HB2 LEU C 114 11.630 18.953 0.559 1.00 0.00 H new ATOM 0 HB3 LEU C 114 11.722 17.513 1.553 1.00 0.00 H new ATOM 0 HG LEU C 114 9.547 16.794 0.423 1.00 0.00 H new ATOM 0 HD11 LEU C 114 9.160 17.631 -1.841 1.00 0.00 H new ATOM 0 HD12 LEU C 114 8.895 18.865 -0.586 1.00 0.00 H new ATOM 0 HD13 LEU C 114 10.381 18.896 -1.565 1.00 0.00 H new ATOM 0 HD21 LEU C 114 10.719 15.843 -1.504 1.00 0.00 H new ATOM 0 HD22 LEU C 114 12.091 16.932 -1.184 1.00 0.00 H new ATOM 0 HD23 LEU C 114 11.640 15.694 0.012 1.00 0.00 H new ATOM 1781 N PHE C 115 8.947 20.608 0.849 1.00 0.00 N ATOM 1782 CA PHE C 115 8.642 22.011 0.548 1.00 0.00 C ATOM 1783 C PHE C 115 7.969 22.666 1.757 1.00 0.00 C ATOM 1784 O PHE C 115 8.494 23.635 2.307 1.00 0.00 O ATOM 1785 CB PHE C 115 7.751 22.183 -0.698 1.00 0.00 C ATOM 1786 CG PHE C 115 8.477 22.062 -2.004 1.00 0.00 C ATOM 1787 CD1 PHE C 115 8.799 20.827 -2.527 1.00 0.00 C ATOM 1788 CD2 PHE C 115 8.849 23.197 -2.701 1.00 0.00 C ATOM 1789 CE1 PHE C 115 9.481 20.720 -3.722 1.00 0.00 C ATOM 1790 CE2 PHE C 115 9.528 23.098 -3.897 1.00 0.00 C ATOM 1791 CZ PHE C 115 9.847 21.858 -4.409 1.00 0.00 C ATOM 0 H PHE C 115 8.406 19.929 0.314 1.00 0.00 H new ATOM 0 HA PHE C 115 9.591 22.500 0.329 1.00 0.00 H new ATOM 0 HB2 PHE C 115 6.958 21.436 -0.667 1.00 0.00 H new ATOM 0 HB3 PHE C 115 7.271 23.160 -0.653 1.00 0.00 H new ATOM 0 HD1 PHE C 115 8.514 19.932 -1.994 1.00 0.00 H new ATOM 0 HD2 PHE C 115 8.605 24.171 -2.304 1.00 0.00 H new ATOM 0 HE1 PHE C 115 9.728 19.746 -4.118 1.00 0.00 H new ATOM 0 HE2 PHE C 115 9.810 23.992 -4.433 1.00 0.00 H new ATOM 0 HZ PHE C 115 10.381 21.779 -5.344 1.00 0.00 H new ATOM 1801 N PRO C 116 6.802 22.144 2.208 1.00 0.00 N ATOM 1802 CA PRO C 116 6.102 22.698 3.366 1.00 0.00 C ATOM 1803 C PRO C 116 6.730 22.233 4.676 1.00 0.00 C ATOM 1804 O PRO C 116 7.708 21.483 4.671 1.00 0.00 O ATOM 1805 CB PRO C 116 4.691 22.135 3.226 1.00 0.00 C ATOM 1806 CG PRO C 116 4.864 20.836 2.510 1.00 0.00 C ATOM 1807 CD PRO C 116 6.083 20.980 1.640 1.00 0.00 C ATOM 0 HA PRO C 116 6.138 23.787 3.392 1.00 0.00 H new ATOM 0 HB2 PRO C 116 4.225 21.990 4.201 1.00 0.00 H new ATOM 0 HB3 PRO C 116 4.049 22.813 2.664 1.00 0.00 H new ATOM 0 HG2 PRO C 116 4.989 20.017 3.219 1.00 0.00 H new ATOM 0 HG3 PRO C 116 3.985 20.606 1.909 1.00 0.00 H new ATOM 0 HD2 PRO C 116 6.699 20.081 1.666 1.00 0.00 H new ATOM 0 HD3 PRO C 116 5.811 21.150 0.598 1.00 0.00 H new ATOM 1815 N ASN C 117 6.167 22.673 5.795 1.00 0.00 N ATOM 1816 CA ASN C 117 6.690 22.292 7.107 1.00 0.00 C ATOM 1817 C ASN C 117 6.373 20.835 7.423 1.00 0.00 C ATOM 1818 O ASN C 117 7.246 20.082 7.848 1.00 0.00 O ATOM 1819 CB ASN C 117 6.119 23.189 8.214 1.00 0.00 C ATOM 1820 CG ASN C 117 6.461 24.655 8.024 1.00 0.00 C ATOM 1821 OD1 ASN C 117 6.071 25.270 7.034 1.00 0.00 O ATOM 1822 ND2 ASN C 117 7.198 25.219 8.973 1.00 0.00 N ATOM 0 H ASN C 117 5.355 23.289 5.824 1.00 0.00 H new ATOM 0 HA ASN C 117 7.772 22.420 7.070 1.00 0.00 H new ATOM 0 HB2 ASN C 117 5.035 23.075 8.244 1.00 0.00 H new ATOM 0 HB3 ASN C 117 6.501 22.854 9.178 1.00 0.00 H new ATOM 0 HD21 ASN C 117 7.462 26.201 8.897 1.00 0.00 H new ATOM 0 HD22 ASN C 117 7.500 24.670 9.778 1.00 0.00 H new ATOM 1829 N GLY C 118 5.116 20.451 7.230 1.00 0.00 N ATOM 1830 CA GLY C 118 4.702 19.091 7.519 1.00 0.00 C ATOM 1831 C GLY C 118 4.435 18.906 8.998 1.00 0.00 C ATOM 1832 O GLY C 118 3.385 19.313 9.497 1.00 0.00 O ATOM 0 H GLY C 118 4.376 21.058 6.878 1.00 0.00 H new ATOM 0 HA2 GLY C 118 3.803 18.853 6.951 1.00 0.00 H new ATOM 0 HA3 GLY C 118 5.476 18.395 7.196 1.00 0.00 H new ATOM 1836 N GLY C 119 5.394 18.323 9.703 1.00 0.00 N ATOM 1837 CA GLY C 119 5.256 18.127 11.134 1.00 0.00 C ATOM 1838 C GLY C 119 5.779 19.319 11.905 1.00 0.00 C ATOM 1839 O GLY C 119 6.925 19.322 12.355 1.00 0.00 O ATOM 0 H GLY C 119 6.270 17.980 9.308 1.00 0.00 H new ATOM 0 HA2 GLY C 119 4.207 17.963 11.381 1.00 0.00 H new ATOM 0 HA3 GLY C 119 5.798 17.230 11.434 1.00 0.00 H new ATOM 1843 N ILE C 120 4.948 20.341 12.038 1.00 0.00 N ATOM 1844 CA ILE C 120 5.337 21.551 12.740 1.00 0.00 C ATOM 1845 C ILE C 120 4.510 21.719 14.012 1.00 0.00 C ATOM 1846 O ILE C 120 3.318 21.349 13.997 1.00 0.00 O ATOM 1847 CB ILE C 120 5.169 22.792 11.825 1.00 0.00 C ATOM 1848 CG1 ILE C 120 5.692 24.055 12.508 1.00 0.00 C ATOM 1849 CG2 ILE C 120 3.715 22.972 11.424 1.00 0.00 C ATOM 1850 CD1 ILE C 120 7.190 24.072 12.684 1.00 0.00 C ATOM 1851 OXT ILE C 120 5.058 22.200 15.021 1.00 0.00 O ATOM 0 H ILE C 120 3.998 20.355 11.667 1.00 0.00 H new ATOM 0 HA ILE C 120 6.388 21.463 13.015 1.00 0.00 H new ATOM 0 HB ILE C 120 5.759 22.623 10.924 1.00 0.00 H new ATOM 0 HG12 ILE C 120 5.394 24.924 11.922 1.00 0.00 H new ATOM 0 HG13 ILE C 120 5.219 24.152 13.485 1.00 0.00 H new ATOM 0 HG21 ILE C 120 3.620 23.848 10.783 1.00 0.00 H new ATOM 0 HG22 ILE C 120 3.374 22.088 10.884 1.00 0.00 H new ATOM 0 HG23 ILE C 120 3.105 23.109 12.317 1.00 0.00 H new ATOM 0 HD11 ILE C 120 7.488 24.998 13.175 1.00 0.00 H new ATOM 0 HD12 ILE C 120 7.494 23.223 13.296 1.00 0.00 H new ATOM 0 HD13 ILE C 120 7.672 24.007 11.708 1.00 0.00 H new TER 1863 ILE C 120