USER MOD reduce.3.24.130724 H: found=0, std=0, add=1255, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1253 hydrogens (23 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 NoAdj-H: A 68 HIS HE2 : A 68 HIS NE2 : A 171 ZNZN :(H bumps) USER MOD NoAdj-H: A 83 HIS HE2 : A 83 HIS NE2 : A 171 ZNZN :(H bumps) USER MOD NoAdj-H: A 96 HIS HD1 : A 96 HIS ND1 : A 171 ZNZN :(H bumps) USER MOD NoAdj-H: A 118 HIS HE2 : A 118 HIS NE2 : A 170 ZNZN :(H bumps) USER MOD NoAdj-H: A 122 HIS HE2 : A 122 HIS NE2 : A 170 ZNZN :(H bumps) USER MOD NoAdj-H: A 128 HIS HE2 : A 128 HIS NE2 : A 170 ZNZN :(H bumps) USER MOD Set 1.1: A 104 THR OG1 : rot -38:sc= 0.802 USER MOD Set 1.2: A 106 ASN :FLIP amide:sc= -6.65! C(o=-11!,f=-5.8!) USER MOD Set 2.1: A 21 TYR OH : rot -30:sc= -0.167 USER MOD Set 2.2: A 51 LYS NZ :NH3+ -121:sc= 0.29 (180deg=0) USER MOD Set 3.1: A 32 HIS : no HE2:sc= -3.69! C(o=-9!,f=-13!) USER MOD Set 3.2: A 36 LYS NZ :NH3+ 141:sc= -5.31! (180deg=-0.742) USER MOD Set 4.1: A 12 THR OG1 : rot 180:sc=-0.00713 USER MOD Set 4.2: A 13 HIS : no HD1:sc= -1.6! C(o=-2.8!,f=-10!) USER MOD Set 4.3: A 48 THR OG1 : rot 141:sc= -1.18! USER MOD Set 5.1: A 6 ASN :FLIP amide:sc= -1.61 F(o=-2.3,f=-1.7) USER MOD Set 5.2: A 86 GLN :FLIP amide:sc= -0.0764 F(o=-2.3,f=-1.7) USER MOD Single : A 1 VAL N :NH3+ 175:sc= -1.38 (180deg=-1.45) USER MOD Single : A 3 THR OG1 : rot 22:sc= 0.479 USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.152 USER MOD Single : A 16 TYR OH : rot 180:sc= -0.198 USER MOD Single : A 20 ASN : amide:sc= -0.211 K(o=-0.21,f=-3.4!) USER MOD Single : A 22 THR OG1 : rot 85:sc= 0.18 USER MOD Single : A 39 GLN : amide:sc= -1.41 K(o=-1.4,f=-2.4!) USER MOD Single : A 42 SER OG : rot 84:sc= 0.843 USER MOD Single : A 43 ASN : amide:sc= -3.14! C(o=-3.1!,f=-3!) USER MOD Single : A 45 THR OG1 : rot -72:sc= 0.755 USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.0907 USER MOD Single : A 53 SER OG : rot -36:sc= 0.208 USER MOD Single : A 56 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -0.507 X(o=-0.51,f=-0.0083) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN :FLIP amide:sc= -2.59! C(o=-4.8!,f=-2.6!) USER MOD Single : A 105 ASN : amide:sc= -6.55! C(o=-6.6!,f=-6.3!) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 ASN :FLIP amide:sc= -0.0457 F(o=-1.8!,f=-0.046) USER MOD Single : A 113 HIS : no HE2:sc= -1.4 X(o=-1.4,f=-1.7!) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 139:sc= -0.0249 USER MOD Single : A 130 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 MET CE :methyl -157:sc= -0.186 (180deg=-1.03) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot -4:sc= 0.337 USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 THR OG1 : rot -151:sc= 0.0441 USER MOD Single : A 143 SER OG : rot -160:sc= 0 USER MOD Single : A 147 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 150 GLN : amide:sc= -0.424 X(o=-0.42,f=-0.51) USER MOD Single : A 157 GLN : amide:sc= -3.33 K(o=-3.3,f=-5!) USER MOD Single : A 160 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot -142:sc= -1.67 USER MOD Single : A 164 GLN : amide:sc= -0.0495 K(o=-0.049,f=-1.7!) USER MOD Single : A 165 ASN : amide:sc= -2.73! C(o=-2.7!,f=-2.3!) USER MOD Single : A 168 GLN : amide:sc= -0.0849 X(o=-0.085,f=-0.097) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 -26.890 -8.020 -7.844 1.00 0.00 N ATOM 2 CA VAL A 1 -25.820 -8.716 -8.612 1.00 0.00 C ATOM 3 C VAL A 1 -24.448 -8.301 -8.067 1.00 0.00 C ATOM 4 O VAL A 1 -23.485 -8.197 -8.800 1.00 0.00 O ATOM 5 CB VAL A 1 -25.924 -8.331 -10.093 1.00 0.00 C ATOM 6 CG1 VAL A 1 -27.304 -8.720 -10.628 1.00 0.00 C ATOM 7 CG2 VAL A 1 -25.726 -6.819 -10.247 1.00 0.00 C ATOM 0 H1 VAL A 1 -27.816 -8.234 -8.266 1.00 0.00 H new ATOM 0 H2 VAL A 1 -26.876 -8.346 -6.856 1.00 0.00 H new ATOM 0 H3 VAL A 1 -26.726 -6.993 -7.872 1.00 0.00 H new ATOM 0 HA VAL A 1 -25.938 -9.795 -8.509 1.00 0.00 H new ATOM 0 HB VAL A 1 -25.154 -8.857 -10.657 1.00 0.00 H new ATOM 0 HG11 VAL A 1 -27.377 -8.446 -11.680 1.00 0.00 H new ATOM 0 HG12 VAL A 1 -27.445 -9.796 -10.523 1.00 0.00 H new ATOM 0 HG13 VAL A 1 -28.074 -8.196 -10.063 1.00 0.00 H new ATOM 0 HG21 VAL A 1 -25.800 -6.548 -11.300 1.00 0.00 H new ATOM 0 HG22 VAL A 1 -26.494 -6.292 -9.681 1.00 0.00 H new ATOM 0 HG23 VAL A 1 -24.742 -6.541 -9.869 1.00 0.00 H new ATOM 19 N LEU A 2 -24.352 -8.061 -6.782 1.00 0.00 N ATOM 20 CA LEU A 2 -23.043 -7.647 -6.181 1.00 0.00 C ATOM 21 C LEU A 2 -22.383 -8.856 -5.508 1.00 0.00 C ATOM 22 O LEU A 2 -23.002 -9.557 -4.733 1.00 0.00 O ATOM 23 CB LEU A 2 -23.297 -6.570 -5.123 1.00 0.00 C ATOM 24 CG LEU A 2 -24.028 -5.373 -5.748 1.00 0.00 C ATOM 25 CD1 LEU A 2 -24.354 -4.355 -4.648 1.00 0.00 C ATOM 26 CD2 LEU A 2 -23.140 -4.711 -6.816 1.00 0.00 C ATOM 0 H LEU A 2 -25.125 -8.134 -6.121 1.00 0.00 H new ATOM 0 HA LEU A 2 -22.390 -7.259 -6.963 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -23.892 -6.983 -4.308 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -22.351 -6.243 -4.692 1.00 0.00 H new ATOM 0 HG LEU A 2 -24.949 -5.717 -6.219 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -24.873 -3.502 -5.084 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -24.991 -4.822 -3.897 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -23.430 -4.017 -4.180 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -23.667 -3.863 -7.253 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -22.215 -4.365 -6.356 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -22.908 -5.436 -7.596 1.00 0.00 H new ATOM 38 N THR A 3 -21.126 -9.104 -5.793 1.00 0.00 N ATOM 39 CA THR A 3 -20.419 -10.266 -5.163 1.00 0.00 C ATOM 40 C THR A 3 -19.567 -9.768 -3.993 1.00 0.00 C ATOM 41 O THR A 3 -18.737 -8.893 -4.145 1.00 0.00 O ATOM 42 CB THR A 3 -19.515 -10.935 -6.201 1.00 0.00 C ATOM 43 OG1 THR A 3 -18.543 -10.003 -6.653 1.00 0.00 O ATOM 44 CG2 THR A 3 -20.362 -11.414 -7.381 1.00 0.00 C ATOM 0 H THR A 3 -20.558 -8.551 -6.435 1.00 0.00 H new ATOM 0 HA THR A 3 -21.152 -10.986 -4.800 1.00 0.00 H new ATOM 0 HB THR A 3 -19.011 -11.790 -5.750 1.00 0.00 H new ATOM 0 HG1 THR A 3 -18.433 -9.295 -5.984 1.00 0.00 H new ATOM 0 HG21 THR A 3 -19.719 -11.891 -8.121 1.00 0.00 H new ATOM 0 HG22 THR A 3 -21.104 -12.131 -7.029 1.00 0.00 H new ATOM 0 HG23 THR A 3 -20.868 -10.562 -7.835 1.00 0.00 H new ATOM 52 N GLU A 4 -19.764 -10.316 -2.826 1.00 0.00 N ATOM 53 CA GLU A 4 -18.966 -9.872 -1.649 1.00 0.00 C ATOM 54 C GLU A 4 -17.570 -10.503 -1.703 1.00 0.00 C ATOM 55 O GLU A 4 -17.430 -11.700 -1.853 1.00 0.00 O ATOM 56 CB GLU A 4 -19.684 -10.311 -0.371 1.00 0.00 C ATOM 57 CG GLU A 4 -18.914 -9.818 0.855 1.00 0.00 C ATOM 58 CD GLU A 4 -19.727 -10.114 2.119 1.00 0.00 C ATOM 59 OE1 GLU A 4 -20.854 -10.562 1.983 1.00 0.00 O ATOM 60 OE2 GLU A 4 -19.210 -9.888 3.200 1.00 0.00 O ATOM 0 H GLU A 4 -20.444 -11.053 -2.636 1.00 0.00 H new ATOM 0 HA GLU A 4 -18.863 -8.787 -1.660 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -20.698 -9.912 -0.358 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -19.768 -11.397 -0.346 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -17.943 -10.310 0.910 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -18.725 -8.748 0.773 1.00 0.00 H new ATOM 67 N GLY A 5 -16.535 -9.704 -1.571 1.00 0.00 N ATOM 68 CA GLY A 5 -15.137 -10.248 -1.602 1.00 0.00 C ATOM 69 C GLY A 5 -14.274 -9.428 -2.565 1.00 0.00 C ATOM 70 O GLY A 5 -13.339 -8.765 -2.160 1.00 0.00 O ATOM 0 H GLY A 5 -16.599 -8.694 -1.443 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -14.706 -10.220 -0.601 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -15.152 -11.292 -1.914 1.00 0.00 H new ATOM 74 N ASN A 6 -14.566 -9.475 -3.838 1.00 0.00 N ATOM 75 CA ASN A 6 -13.745 -8.704 -4.819 1.00 0.00 C ATOM 76 C ASN A 6 -14.568 -8.404 -6.081 1.00 0.00 C ATOM 77 O ASN A 6 -14.390 -9.043 -7.098 1.00 0.00 O ATOM 78 CB ASN A 6 -12.523 -9.537 -5.216 1.00 0.00 C ATOM 79 CG ASN A 6 -11.533 -9.589 -4.052 1.00 0.00 C ATOM 80 OD1 ASN A 6 -10.892 -8.506 -3.716 1.00 0.00 O flip ATOM 81 ND2 ASN A 6 -11.339 -10.625 -3.445 1.00 0.00 N flip ATOM 0 H ASN A 6 -15.334 -10.012 -4.240 1.00 0.00 H new ATOM 0 HA ASN A 6 -13.433 -7.766 -4.359 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -12.832 -10.546 -5.488 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -12.044 -9.102 -6.094 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -11.842 -11.472 -3.709 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -10.674 -10.646 -2.672 1.00 0.00 H new ATOM 88 N PRO A 7 -15.460 -7.441 -6.031 1.00 0.00 N ATOM 89 CA PRO A 7 -16.290 -7.095 -7.223 1.00 0.00 C ATOM 90 C PRO A 7 -15.457 -6.942 -8.506 1.00 0.00 C ATOM 91 O PRO A 7 -14.502 -6.190 -8.555 1.00 0.00 O ATOM 92 CB PRO A 7 -16.920 -5.766 -6.786 1.00 0.00 C ATOM 93 CG PRO A 7 -16.874 -5.726 -5.252 1.00 0.00 C ATOM 94 CD PRO A 7 -15.715 -6.632 -4.803 1.00 0.00 C ATOM 0 HA PRO A 7 -17.013 -7.867 -7.485 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -16.374 -4.923 -7.210 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -17.947 -5.691 -7.142 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -16.723 -4.706 -4.899 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -17.818 -6.073 -4.831 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -14.839 -6.056 -4.505 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -15.991 -7.256 -3.953 1.00 0.00 H new ATOM 102 N ARG A 8 -15.820 -7.657 -9.540 1.00 0.00 N ATOM 103 CA ARG A 8 -15.065 -7.574 -10.829 1.00 0.00 C ATOM 104 C ARG A 8 -15.690 -6.499 -11.721 1.00 0.00 C ATOM 105 O ARG A 8 -16.822 -6.101 -11.527 1.00 0.00 O ATOM 106 CB ARG A 8 -15.146 -8.924 -11.551 1.00 0.00 C ATOM 107 CG ARG A 8 -14.323 -9.970 -10.797 1.00 0.00 C ATOM 108 CD ARG A 8 -14.528 -11.343 -11.445 1.00 0.00 C ATOM 109 NE ARG A 8 -15.936 -11.782 -11.228 1.00 0.00 N ATOM 110 CZ ARG A 8 -16.421 -12.789 -11.900 1.00 0.00 C ATOM 111 NH1 ARG A 8 -15.664 -13.440 -12.743 1.00 0.00 N ATOM 112 NH2 ARG A 8 -17.662 -13.151 -11.719 1.00 0.00 N ATOM 0 H ARG A 8 -16.612 -8.299 -9.548 1.00 0.00 H new ATOM 0 HA ARG A 8 -14.025 -7.322 -10.622 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -16.185 -9.247 -11.620 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -14.775 -8.823 -12.571 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -13.267 -9.701 -10.816 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -14.625 -10.001 -9.750 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -14.311 -11.291 -12.512 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -13.838 -12.068 -11.014 1.00 0.00 H new ATOM 0 HE ARG A 8 -16.522 -11.293 -10.551 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -14.692 -13.161 -12.876 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -16.045 -14.227 -13.268 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -18.249 -12.647 -11.054 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -18.045 -13.938 -12.243 1.00 0.00 H new ATOM 126 N TRP A 9 -14.966 -6.029 -12.704 1.00 0.00 N ATOM 127 CA TRP A 9 -15.528 -4.984 -13.609 1.00 0.00 C ATOM 128 C TRP A 9 -16.373 -5.658 -14.690 1.00 0.00 C ATOM 129 O TRP A 9 -15.949 -6.602 -15.328 1.00 0.00 O ATOM 130 CB TRP A 9 -14.386 -4.201 -14.255 1.00 0.00 C ATOM 131 CG TRP A 9 -13.574 -3.549 -13.182 1.00 0.00 C ATOM 132 CD1 TRP A 9 -12.497 -4.102 -12.579 1.00 0.00 C ATOM 133 CD2 TRP A 9 -13.760 -2.239 -12.569 1.00 0.00 C ATOM 134 NE1 TRP A 9 -12.006 -3.214 -11.638 1.00 0.00 N ATOM 135 CE2 TRP A 9 -12.750 -2.050 -11.596 1.00 0.00 C ATOM 136 CE3 TRP A 9 -14.695 -1.205 -12.762 1.00 0.00 C ATOM 137 CZ2 TRP A 9 -12.669 -0.878 -10.841 1.00 0.00 C ATOM 138 CZ3 TRP A 9 -14.618 -0.024 -12.004 1.00 0.00 C ATOM 139 CH2 TRP A 9 -13.606 0.139 -11.047 1.00 0.00 C ATOM 0 H TRP A 9 -14.013 -6.323 -12.918 1.00 0.00 H new ATOM 0 HA TRP A 9 -16.152 -4.297 -13.037 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -13.760 -4.868 -14.848 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -14.784 -3.448 -14.936 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -12.087 -5.077 -12.796 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -11.194 -3.396 -11.048 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -15.477 -1.320 -13.498 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -11.889 -0.758 -10.104 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -15.342 0.762 -12.159 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -13.550 1.050 -10.469 1.00 0.00 H new ATOM 150 N GLU A 10 -17.573 -5.191 -14.888 1.00 0.00 N ATOM 151 CA GLU A 10 -18.458 -5.813 -15.912 1.00 0.00 C ATOM 152 C GLU A 10 -18.126 -5.264 -17.306 1.00 0.00 C ATOM 153 O GLU A 10 -18.542 -5.810 -18.308 1.00 0.00 O ATOM 154 CB GLU A 10 -19.911 -5.496 -15.555 1.00 0.00 C ATOM 155 CG GLU A 10 -20.294 -6.264 -14.286 1.00 0.00 C ATOM 156 CD GLU A 10 -21.743 -5.954 -13.910 1.00 0.00 C ATOM 157 OE1 GLU A 10 -22.309 -5.052 -14.505 1.00 0.00 O ATOM 158 OE2 GLU A 10 -22.264 -6.624 -13.033 1.00 0.00 O ATOM 0 H GLU A 10 -17.981 -4.403 -14.384 1.00 0.00 H new ATOM 0 HA GLU A 10 -18.305 -6.892 -15.926 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -20.034 -4.424 -15.398 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -20.570 -5.776 -16.377 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -20.172 -7.335 -14.447 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -19.629 -5.987 -13.468 1.00 0.00 H new ATOM 165 N GLN A 11 -17.376 -4.194 -17.383 1.00 0.00 N ATOM 166 CA GLN A 11 -17.021 -3.628 -18.722 1.00 0.00 C ATOM 167 C GLN A 11 -15.807 -4.371 -19.292 1.00 0.00 C ATOM 168 O GLN A 11 -14.968 -4.857 -18.559 1.00 0.00 O ATOM 169 CB GLN A 11 -16.669 -2.141 -18.587 1.00 0.00 C ATOM 170 CG GLN A 11 -17.925 -1.332 -18.260 1.00 0.00 C ATOM 171 CD GLN A 11 -17.557 0.149 -18.127 1.00 0.00 C ATOM 172 OE1 GLN A 11 -16.490 0.480 -17.651 1.00 0.00 O ATOM 173 NE2 GLN A 11 -18.401 1.059 -18.535 1.00 0.00 N ATOM 0 H GLN A 11 -16.996 -3.690 -16.582 1.00 0.00 H new ATOM 0 HA GLN A 11 -17.876 -3.744 -19.388 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -15.925 -2.005 -17.802 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -16.225 -1.779 -19.514 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -18.670 -1.464 -19.045 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -18.371 -1.692 -17.333 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -19.297 0.781 -18.935 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -18.164 2.048 -18.454 1.00 0.00 H new ATOM 182 N THR A 12 -15.694 -4.444 -20.597 1.00 0.00 N ATOM 183 CA THR A 12 -14.517 -5.133 -21.221 1.00 0.00 C ATOM 184 C THR A 12 -13.478 -4.078 -21.602 1.00 0.00 C ATOM 185 O THR A 12 -12.370 -4.388 -21.994 1.00 0.00 O ATOM 186 CB THR A 12 -14.963 -5.883 -22.480 1.00 0.00 C ATOM 187 OG1 THR A 12 -15.791 -5.038 -23.267 1.00 0.00 O ATOM 188 CG2 THR A 12 -15.736 -7.142 -22.085 1.00 0.00 C ATOM 0 H THR A 12 -16.366 -4.056 -21.259 1.00 0.00 H new ATOM 0 HA THR A 12 -14.090 -5.845 -20.515 1.00 0.00 H new ATOM 0 HB THR A 12 -14.086 -6.170 -23.059 1.00 0.00 H new ATOM 0 HG1 THR A 12 -16.075 -5.517 -24.073 1.00 0.00 H new ATOM 0 HG21 THR A 12 -16.051 -7.672 -22.984 1.00 0.00 H new ATOM 0 HG22 THR A 12 -15.095 -7.790 -21.487 1.00 0.00 H new ATOM 0 HG23 THR A 12 -16.614 -6.862 -21.502 1.00 0.00 H new ATOM 196 N HIS A 13 -13.839 -2.828 -21.470 1.00 0.00 N ATOM 197 CA HIS A 13 -12.907 -1.705 -21.793 1.00 0.00 C ATOM 198 C HIS A 13 -12.740 -0.854 -20.534 1.00 0.00 C ATOM 199 O HIS A 13 -13.705 -0.358 -19.987 1.00 0.00 O ATOM 200 CB HIS A 13 -13.509 -0.845 -22.911 1.00 0.00 C ATOM 201 CG HIS A 13 -13.337 -1.535 -24.237 1.00 0.00 C ATOM 202 ND1 HIS A 13 -12.427 -1.092 -25.184 1.00 0.00 N ATOM 203 CD2 HIS A 13 -13.945 -2.637 -24.789 1.00 0.00 C ATOM 204 CE1 HIS A 13 -12.511 -1.915 -26.244 1.00 0.00 C ATOM 205 NE2 HIS A 13 -13.422 -2.874 -26.057 1.00 0.00 N ATOM 0 H HIS A 13 -14.759 -2.532 -21.145 1.00 0.00 H new ATOM 0 HA HIS A 13 -11.944 -2.094 -22.123 1.00 0.00 H new ATOM 0 HB2 HIS A 13 -14.567 -0.670 -22.717 1.00 0.00 H new ATOM 0 HB3 HIS A 13 -13.023 0.130 -22.933 1.00 0.00 H new ATOM 0 HD2 HIS A 13 -14.712 -3.229 -24.312 1.00 0.00 H new ATOM 0 HE1 HIS A 13 -11.914 -1.813 -27.138 1.00 0.00 H new ATOM 0 HE2 HIS A 13 -13.679 -3.619 -26.704 1.00 0.00 H new ATOM 213 N LEU A 14 -11.529 -0.688 -20.061 1.00 0.00 N ATOM 214 CA LEU A 14 -11.299 0.122 -18.825 1.00 0.00 C ATOM 215 C LEU A 14 -10.593 1.429 -19.187 1.00 0.00 C ATOM 216 O LEU A 14 -9.922 1.532 -20.196 1.00 0.00 O ATOM 217 CB LEU A 14 -10.417 -0.670 -17.858 1.00 0.00 C ATOM 218 CG LEU A 14 -11.047 -2.045 -17.588 1.00 0.00 C ATOM 219 CD1 LEU A 14 -10.158 -2.838 -16.614 1.00 0.00 C ATOM 220 CD2 LEU A 14 -12.453 -1.869 -16.986 1.00 0.00 C ATOM 0 H LEU A 14 -10.686 -1.081 -20.480 1.00 0.00 H new ATOM 0 HA LEU A 14 -12.258 0.344 -18.357 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -9.419 -0.793 -18.279 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -10.303 -0.122 -16.923 1.00 0.00 H new ATOM 0 HG LEU A 14 -11.130 -2.592 -18.527 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -10.607 -3.813 -16.424 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -9.169 -2.973 -17.052 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -10.068 -2.291 -15.676 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -12.893 -2.848 -16.797 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -12.381 -1.317 -16.049 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -13.082 -1.317 -17.685 1.00 0.00 H new ATOM 232 N THR A 15 -10.739 2.427 -18.356 1.00 0.00 N ATOM 233 CA THR A 15 -10.084 3.744 -18.609 1.00 0.00 C ATOM 234 C THR A 15 -9.277 4.130 -17.370 1.00 0.00 C ATOM 235 O THR A 15 -9.592 3.732 -16.267 1.00 0.00 O ATOM 236 CB THR A 15 -11.159 4.804 -18.867 1.00 0.00 C ATOM 237 OG1 THR A 15 -12.012 4.889 -17.733 1.00 0.00 O ATOM 238 CG2 THR A 15 -11.977 4.417 -20.100 1.00 0.00 C ATOM 0 H THR A 15 -11.292 2.384 -17.500 1.00 0.00 H new ATOM 0 HA THR A 15 -9.429 3.677 -19.477 1.00 0.00 H new ATOM 0 HB THR A 15 -10.686 5.771 -19.042 1.00 0.00 H new ATOM 0 HG1 THR A 15 -12.701 5.567 -17.892 1.00 0.00 H new ATOM 0 HG21 THR A 15 -12.741 5.173 -20.282 1.00 0.00 H new ATOM 0 HG22 THR A 15 -11.319 4.350 -20.967 1.00 0.00 H new ATOM 0 HG23 THR A 15 -12.454 3.452 -19.932 1.00 0.00 H new ATOM 246 N TYR A 16 -8.239 4.904 -17.538 1.00 0.00 N ATOM 247 CA TYR A 16 -7.411 5.320 -16.367 1.00 0.00 C ATOM 248 C TYR A 16 -6.937 6.754 -16.580 1.00 0.00 C ATOM 249 O TYR A 16 -6.917 7.252 -17.687 1.00 0.00 O ATOM 250 CB TYR A 16 -6.195 4.397 -16.231 1.00 0.00 C ATOM 251 CG TYR A 16 -5.311 4.525 -17.449 1.00 0.00 C ATOM 252 CD1 TYR A 16 -4.340 5.533 -17.507 1.00 0.00 C ATOM 253 CD2 TYR A 16 -5.450 3.627 -18.514 1.00 0.00 C ATOM 254 CE1 TYR A 16 -3.510 5.644 -18.630 1.00 0.00 C ATOM 255 CE2 TYR A 16 -4.622 3.738 -19.637 1.00 0.00 C ATOM 256 CZ TYR A 16 -3.652 4.746 -19.695 1.00 0.00 C ATOM 257 OH TYR A 16 -2.833 4.853 -20.802 1.00 0.00 O ATOM 0 H TYR A 16 -7.927 5.268 -18.438 1.00 0.00 H new ATOM 0 HA TYR A 16 -8.009 5.255 -15.458 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -5.632 4.654 -15.334 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -6.523 3.364 -16.116 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -4.231 6.225 -16.685 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -6.197 2.848 -18.469 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -2.761 6.421 -18.674 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -4.731 3.046 -20.459 1.00 0.00 H new ATOM 0 HH TYR A 16 -3.062 4.152 -21.448 1.00 0.00 H new ATOM 267 N ARG A 17 -6.562 7.428 -15.527 1.00 0.00 N ATOM 268 CA ARG A 17 -6.094 8.838 -15.669 1.00 0.00 C ATOM 269 C ARG A 17 -5.075 9.157 -14.574 1.00 0.00 C ATOM 270 O ARG A 17 -5.309 8.911 -13.407 1.00 0.00 O ATOM 271 CB ARG A 17 -7.291 9.782 -15.529 1.00 0.00 C ATOM 272 CG ARG A 17 -6.866 11.205 -15.894 1.00 0.00 C ATOM 273 CD ARG A 17 -8.064 12.146 -15.754 1.00 0.00 C ATOM 274 NE ARG A 17 -9.147 11.700 -16.671 1.00 0.00 N ATOM 275 CZ ARG A 17 -10.357 12.154 -16.523 1.00 0.00 C ATOM 276 NH1 ARG A 17 -10.619 13.034 -15.594 1.00 0.00 N ATOM 277 NH2 ARG A 17 -11.306 11.727 -17.306 1.00 0.00 N ATOM 0 H ARG A 17 -6.559 7.064 -14.574 1.00 0.00 H new ATOM 0 HA ARG A 17 -5.629 8.967 -16.646 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -8.103 9.456 -16.179 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -7.671 9.755 -14.508 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -6.055 11.532 -15.243 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -6.486 11.232 -16.915 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -8.421 12.148 -14.724 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -7.768 13.168 -15.991 1.00 0.00 H new ATOM 0 HE ARG A 17 -8.940 11.037 -17.418 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -9.874 13.367 -14.982 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -11.569 13.388 -15.480 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -11.099 11.040 -18.031 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -12.257 12.080 -17.194 1.00 0.00 H new ATOM 291 N ILE A 18 -3.952 9.716 -14.935 1.00 0.00 N ATOM 292 CA ILE A 18 -2.928 10.066 -13.910 1.00 0.00 C ATOM 293 C ILE A 18 -3.236 11.469 -13.372 1.00 0.00 C ATOM 294 O ILE A 18 -3.274 12.432 -14.111 1.00 0.00 O ATOM 295 CB ILE A 18 -1.535 10.038 -14.545 1.00 0.00 C ATOM 296 CG1 ILE A 18 -1.253 8.627 -15.077 1.00 0.00 C ATOM 297 CG2 ILE A 18 -0.489 10.407 -13.494 1.00 0.00 C ATOM 298 CD1 ILE A 18 0.037 8.624 -15.904 1.00 0.00 C ATOM 0 H ILE A 18 -3.699 9.946 -15.896 1.00 0.00 H new ATOM 0 HA ILE A 18 -2.952 9.346 -13.092 1.00 0.00 H new ATOM 0 HB ILE A 18 -1.490 10.754 -15.365 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -1.163 7.928 -14.246 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -2.088 8.287 -15.690 1.00 0.00 H new ATOM 0 HG21 ILE A 18 0.503 10.387 -13.945 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -0.694 11.407 -13.112 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -0.529 9.690 -12.674 1.00 0.00 H new ATOM 0 HD11 ILE A 18 0.228 7.618 -16.277 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -0.069 9.309 -16.745 1.00 0.00 H new ATOM 0 HD13 ILE A 18 0.871 8.943 -15.279 1.00 0.00 H new ATOM 310 N GLU A 19 -3.477 11.587 -12.092 1.00 0.00 N ATOM 311 CA GLU A 19 -3.808 12.923 -11.511 1.00 0.00 C ATOM 312 C GLU A 19 -2.602 13.865 -11.585 1.00 0.00 C ATOM 313 O GLU A 19 -2.743 15.039 -11.864 1.00 0.00 O ATOM 314 CB GLU A 19 -4.227 12.748 -10.048 1.00 0.00 C ATOM 315 CG GLU A 19 -5.592 12.058 -9.982 1.00 0.00 C ATOM 316 CD GLU A 19 -5.967 11.811 -8.519 1.00 0.00 C ATOM 317 OE1 GLU A 19 -5.171 12.153 -7.659 1.00 0.00 O ATOM 318 OE2 GLU A 19 -7.042 11.285 -8.283 1.00 0.00 O ATOM 0 H GLU A 19 -3.459 10.816 -11.424 1.00 0.00 H new ATOM 0 HA GLU A 19 -4.624 13.360 -12.086 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -3.483 12.156 -9.515 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -4.275 13.719 -9.555 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -6.349 12.678 -10.463 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -5.561 11.114 -10.525 1.00 0.00 H new ATOM 325 N ASN A 20 -1.419 13.374 -11.331 1.00 0.00 N ATOM 326 CA ASN A 20 -0.223 14.266 -11.388 1.00 0.00 C ATOM 327 C ASN A 20 1.046 13.429 -11.533 1.00 0.00 C ATOM 328 O ASN A 20 1.126 12.312 -11.063 1.00 0.00 O ATOM 329 CB ASN A 20 -0.135 15.094 -10.103 1.00 0.00 C ATOM 330 CG ASN A 20 1.026 16.086 -10.218 1.00 0.00 C ATOM 331 OD1 ASN A 20 1.385 16.493 -11.305 1.00 0.00 O ATOM 332 ND2 ASN A 20 1.635 16.491 -9.137 1.00 0.00 N ATOM 0 H ASN A 20 -1.229 12.402 -11.088 1.00 0.00 H new ATOM 0 HA ASN A 20 -0.319 14.930 -12.247 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -1.070 15.629 -9.937 1.00 0.00 H new ATOM 0 HB3 ASN A 20 0.015 14.439 -9.245 1.00 0.00 H new ATOM 0 HD21 ASN A 20 2.412 17.149 -9.205 1.00 0.00 H new ATOM 0 HD22 ASN A 20 1.334 16.150 -8.224 1.00 0.00 H new ATOM 339 N TYR A 21 2.047 13.971 -12.175 1.00 0.00 N ATOM 340 CA TYR A 21 3.328 13.227 -12.352 1.00 0.00 C ATOM 341 C TYR A 21 4.310 13.678 -11.267 1.00 0.00 C ATOM 342 O TYR A 21 4.478 14.858 -11.032 1.00 0.00 O ATOM 343 CB TYR A 21 3.908 13.548 -13.732 1.00 0.00 C ATOM 344 CG TYR A 21 3.026 12.950 -14.805 1.00 0.00 C ATOM 345 CD1 TYR A 21 3.267 11.651 -15.263 1.00 0.00 C ATOM 346 CD2 TYR A 21 1.974 13.700 -15.347 1.00 0.00 C ATOM 347 CE1 TYR A 21 2.456 11.098 -16.262 1.00 0.00 C ATOM 348 CE2 TYR A 21 1.162 13.147 -16.347 1.00 0.00 C ATOM 349 CZ TYR A 21 1.404 11.845 -16.803 1.00 0.00 C ATOM 350 OH TYR A 21 0.604 11.300 -17.788 1.00 0.00 O ATOM 0 H TYR A 21 2.032 14.904 -12.587 1.00 0.00 H new ATOM 0 HA TYR A 21 3.155 12.154 -12.273 1.00 0.00 H new ATOM 0 HB2 TYR A 21 3.979 14.627 -13.866 1.00 0.00 H new ATOM 0 HB3 TYR A 21 4.919 13.149 -13.814 1.00 0.00 H new ATOM 0 HD1 TYR A 21 4.079 11.074 -14.846 1.00 0.00 H new ATOM 0 HD2 TYR A 21 1.789 14.704 -14.994 1.00 0.00 H new ATOM 0 HE1 TYR A 21 2.643 10.095 -16.615 1.00 0.00 H new ATOM 0 HE2 TYR A 21 0.351 13.724 -16.765 1.00 0.00 H new ATOM 0 HH TYR A 21 1.126 10.662 -18.318 1.00 0.00 H new ATOM 360 N THR A 22 4.955 12.763 -10.594 1.00 0.00 N ATOM 361 CA THR A 22 5.907 13.177 -9.524 1.00 0.00 C ATOM 362 C THR A 22 7.128 13.867 -10.171 1.00 0.00 C ATOM 363 O THR A 22 7.557 13.471 -11.237 1.00 0.00 O ATOM 364 CB THR A 22 6.362 11.944 -8.730 1.00 0.00 C ATOM 365 OG1 THR A 22 7.383 12.322 -7.814 1.00 0.00 O ATOM 366 CG2 THR A 22 6.893 10.869 -9.683 1.00 0.00 C ATOM 0 H THR A 22 4.865 11.757 -10.737 1.00 0.00 H new ATOM 0 HA THR A 22 5.415 13.873 -8.844 1.00 0.00 H new ATOM 0 HB THR A 22 5.512 11.538 -8.182 1.00 0.00 H new ATOM 0 HG1 THR A 22 6.974 12.669 -6.994 1.00 0.00 H new ATOM 0 HG21 THR A 22 7.213 9.999 -9.109 1.00 0.00 H new ATOM 0 HG22 THR A 22 6.105 10.576 -10.376 1.00 0.00 H new ATOM 0 HG23 THR A 22 7.740 11.265 -10.243 1.00 0.00 H new ATOM 374 N PRO A 23 7.694 14.893 -9.554 1.00 0.00 N ATOM 375 CA PRO A 23 8.877 15.585 -10.153 1.00 0.00 C ATOM 376 C PRO A 23 10.108 14.669 -10.202 1.00 0.00 C ATOM 377 O PRO A 23 11.133 15.016 -10.756 1.00 0.00 O ATOM 378 CB PRO A 23 9.096 16.766 -9.187 1.00 0.00 C ATOM 379 CG PRO A 23 8.287 16.487 -7.909 1.00 0.00 C ATOM 380 CD PRO A 23 7.220 15.433 -8.244 1.00 0.00 C ATOM 0 HA PRO A 23 8.718 15.890 -11.187 1.00 0.00 H new ATOM 0 HB2 PRO A 23 10.155 16.876 -8.952 1.00 0.00 H new ATOM 0 HB3 PRO A 23 8.773 17.700 -9.647 1.00 0.00 H new ATOM 0 HG2 PRO A 23 8.941 16.128 -7.114 1.00 0.00 H new ATOM 0 HG3 PRO A 23 7.818 17.402 -7.547 1.00 0.00 H new ATOM 0 HD2 PRO A 23 7.165 14.656 -7.482 1.00 0.00 H new ATOM 0 HD3 PRO A 23 6.226 15.873 -8.323 1.00 0.00 H new ATOM 388 N ASP A 24 10.007 13.504 -9.624 1.00 0.00 N ATOM 389 CA ASP A 24 11.159 12.559 -9.628 1.00 0.00 C ATOM 390 C ASP A 24 11.537 12.210 -11.069 1.00 0.00 C ATOM 391 O ASP A 24 12.699 12.105 -11.407 1.00 0.00 O ATOM 392 CB ASP A 24 10.769 11.284 -8.879 1.00 0.00 C ATOM 393 CG ASP A 24 10.648 11.589 -7.385 1.00 0.00 C ATOM 394 OD1 ASP A 24 11.283 12.530 -6.940 1.00 0.00 O ATOM 395 OD2 ASP A 24 9.923 10.876 -6.712 1.00 0.00 O ATOM 0 H ASP A 24 9.172 13.164 -9.147 1.00 0.00 H new ATOM 0 HA ASP A 24 12.013 13.026 -9.137 1.00 0.00 H new ATOM 0 HB2 ASP A 24 9.823 10.900 -9.261 1.00 0.00 H new ATOM 0 HB3 ASP A 24 11.518 10.509 -9.044 1.00 0.00 H new ATOM 400 N LEU A 25 10.560 12.018 -11.921 1.00 0.00 N ATOM 401 CA LEU A 25 10.849 11.663 -13.349 1.00 0.00 C ATOM 402 C LEU A 25 9.882 12.446 -14.259 1.00 0.00 C ATOM 403 O LEU A 25 8.771 12.737 -13.861 1.00 0.00 O ATOM 404 CB LEU A 25 10.606 10.157 -13.553 1.00 0.00 C ATOM 405 CG LEU A 25 11.511 9.319 -12.620 1.00 0.00 C ATOM 406 CD1 LEU A 25 11.060 7.836 -12.608 1.00 0.00 C ATOM 407 CD2 LEU A 25 12.972 9.404 -13.097 1.00 0.00 C ATOM 0 H LEU A 25 9.569 12.092 -11.689 1.00 0.00 H new ATOM 0 HA LEU A 25 11.883 11.910 -13.591 1.00 0.00 H new ATOM 0 HB2 LEU A 25 9.560 9.924 -13.356 1.00 0.00 H new ATOM 0 HB3 LEU A 25 10.802 9.891 -14.592 1.00 0.00 H new ATOM 0 HG LEU A 25 11.430 9.720 -11.610 1.00 0.00 H new ATOM 0 HD11 LEU A 25 11.709 7.264 -11.946 1.00 0.00 H new ATOM 0 HD12 LEU A 25 10.032 7.771 -12.253 1.00 0.00 H new ATOM 0 HD13 LEU A 25 11.121 7.429 -13.617 1.00 0.00 H new ATOM 0 HD21 LEU A 25 13.605 8.812 -12.436 1.00 0.00 H new ATOM 0 HD22 LEU A 25 13.046 9.017 -14.113 1.00 0.00 H new ATOM 0 HD23 LEU A 25 13.301 10.443 -13.079 1.00 0.00 H new ATOM 419 N PRO A 26 10.272 12.785 -15.476 1.00 0.00 N ATOM 420 CA PRO A 26 9.346 13.528 -16.374 1.00 0.00 C ATOM 421 C PRO A 26 8.001 12.800 -16.523 1.00 0.00 C ATOM 422 O PRO A 26 7.798 11.736 -15.973 1.00 0.00 O ATOM 423 CB PRO A 26 10.122 13.579 -17.709 1.00 0.00 C ATOM 424 CG PRO A 26 11.530 12.985 -17.483 1.00 0.00 C ATOM 425 CD PRO A 26 11.623 12.471 -16.034 1.00 0.00 C ATOM 0 HA PRO A 26 9.084 14.517 -15.998 1.00 0.00 H new ATOM 0 HB2 PRO A 26 9.592 13.015 -18.476 1.00 0.00 H new ATOM 0 HB3 PRO A 26 10.197 14.607 -18.064 1.00 0.00 H new ATOM 0 HG2 PRO A 26 11.714 12.172 -18.185 1.00 0.00 H new ATOM 0 HG3 PRO A 26 12.293 13.742 -17.665 1.00 0.00 H new ATOM 0 HD2 PRO A 26 11.836 11.403 -15.998 1.00 0.00 H new ATOM 0 HD3 PRO A 26 12.415 12.973 -15.478 1.00 0.00 H new ATOM 433 N ARG A 27 7.080 13.364 -17.257 1.00 0.00 N ATOM 434 CA ARG A 27 5.755 12.698 -17.431 1.00 0.00 C ATOM 435 C ARG A 27 5.817 11.737 -18.622 1.00 0.00 C ATOM 436 O ARG A 27 5.251 10.663 -18.598 1.00 0.00 O ATOM 437 CB ARG A 27 4.681 13.764 -17.679 1.00 0.00 C ATOM 438 CG ARG A 27 4.903 14.416 -19.047 1.00 0.00 C ATOM 439 CD ARG A 27 3.978 15.625 -19.196 1.00 0.00 C ATOM 440 NE ARG A 27 4.158 16.217 -20.551 1.00 0.00 N ATOM 441 CZ ARG A 27 3.270 17.043 -21.030 1.00 0.00 C ATOM 442 NH1 ARG A 27 2.218 17.359 -20.323 1.00 0.00 N ATOM 443 NH2 ARG A 27 3.431 17.551 -22.221 1.00 0.00 N ATOM 0 H ARG A 27 7.186 14.255 -17.743 1.00 0.00 H new ATOM 0 HA ARG A 27 5.506 12.136 -16.531 1.00 0.00 H new ATOM 0 HB2 ARG A 27 3.690 13.311 -17.638 1.00 0.00 H new ATOM 0 HB3 ARG A 27 4.719 14.520 -16.895 1.00 0.00 H new ATOM 0 HG2 ARG A 27 5.943 14.726 -19.149 1.00 0.00 H new ATOM 0 HG3 ARG A 27 4.707 13.695 -19.841 1.00 0.00 H new ATOM 0 HD2 ARG A 27 2.940 15.324 -19.053 1.00 0.00 H new ATOM 0 HD3 ARG A 27 4.203 16.367 -18.429 1.00 0.00 H new ATOM 0 HE ARG A 27 4.979 15.975 -21.106 1.00 0.00 H new ATOM 0 HH11 ARG A 27 2.089 16.959 -19.393 1.00 0.00 H new ATOM 0 HH12 ARG A 27 1.525 18.005 -20.701 1.00 0.00 H new ATOM 0 HH21 ARG A 27 4.250 17.302 -22.775 1.00 0.00 H new ATOM 0 HH22 ARG A 27 2.738 18.197 -22.598 1.00 0.00 H new ATOM 457 N ALA A 28 6.496 12.123 -19.668 1.00 0.00 N ATOM 458 CA ALA A 28 6.595 11.243 -20.868 1.00 0.00 C ATOM 459 C ALA A 28 7.231 9.905 -20.485 1.00 0.00 C ATOM 460 O ALA A 28 6.784 8.851 -20.894 1.00 0.00 O ATOM 461 CB ALA A 28 7.468 11.927 -21.921 1.00 0.00 C ATOM 0 H ALA A 28 6.988 13.013 -19.744 1.00 0.00 H new ATOM 0 HA ALA A 28 5.596 11.066 -21.266 1.00 0.00 H new ATOM 0 HB1 ALA A 28 7.544 11.288 -22.801 1.00 0.00 H new ATOM 0 HB2 ALA A 28 7.020 12.880 -22.202 1.00 0.00 H new ATOM 0 HB3 ALA A 28 8.463 12.101 -21.512 1.00 0.00 H new ATOM 467 N ASP A 29 8.280 9.944 -19.710 1.00 0.00 N ATOM 468 CA ASP A 29 8.965 8.685 -19.304 1.00 0.00 C ATOM 469 C ASP A 29 8.083 7.896 -18.332 1.00 0.00 C ATOM 470 O ASP A 29 8.002 6.683 -18.397 1.00 0.00 O ATOM 471 CB ASP A 29 10.299 9.026 -18.628 1.00 0.00 C ATOM 472 CG ASP A 29 11.289 9.533 -19.681 1.00 0.00 C ATOM 473 OD1 ASP A 29 11.029 9.331 -20.856 1.00 0.00 O ATOM 474 OD2 ASP A 29 12.292 10.108 -19.295 1.00 0.00 O ATOM 0 H ASP A 29 8.694 10.799 -19.339 1.00 0.00 H new ATOM 0 HA ASP A 29 9.148 8.076 -20.189 1.00 0.00 H new ATOM 0 HB2 ASP A 29 10.147 9.785 -17.861 1.00 0.00 H new ATOM 0 HB3 ASP A 29 10.702 8.145 -18.129 1.00 0.00 H new ATOM 479 N VAL A 30 7.423 8.565 -17.431 1.00 0.00 N ATOM 480 CA VAL A 30 6.560 7.836 -16.460 1.00 0.00 C ATOM 481 C VAL A 30 5.350 7.254 -17.196 1.00 0.00 C ATOM 482 O VAL A 30 4.972 6.119 -16.982 1.00 0.00 O ATOM 483 CB VAL A 30 6.078 8.809 -15.380 1.00 0.00 C ATOM 484 CG1 VAL A 30 5.030 8.125 -14.495 1.00 0.00 C ATOM 485 CG2 VAL A 30 7.267 9.246 -14.521 1.00 0.00 C ATOM 0 H VAL A 30 7.442 9.579 -17.324 1.00 0.00 H new ATOM 0 HA VAL A 30 7.129 7.030 -15.997 1.00 0.00 H new ATOM 0 HB VAL A 30 5.631 9.682 -15.855 1.00 0.00 H new ATOM 0 HG11 VAL A 30 4.691 8.822 -13.728 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.182 7.817 -15.107 1.00 0.00 H new ATOM 0 HG13 VAL A 30 5.471 7.249 -14.019 1.00 0.00 H new ATOM 0 HG21 VAL A 30 6.925 9.939 -13.752 1.00 0.00 H new ATOM 0 HG22 VAL A 30 7.715 8.372 -14.049 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.008 9.739 -15.150 1.00 0.00 H new ATOM 495 N ASP A 31 4.746 8.016 -18.065 1.00 0.00 N ATOM 496 CA ASP A 31 3.565 7.502 -18.814 1.00 0.00 C ATOM 497 C ASP A 31 3.986 6.255 -19.590 1.00 0.00 C ATOM 498 O ASP A 31 3.254 5.290 -19.686 1.00 0.00 O ATOM 499 CB ASP A 31 3.071 8.578 -19.788 1.00 0.00 C ATOM 500 CG ASP A 31 1.855 8.061 -20.565 1.00 0.00 C ATOM 501 OD1 ASP A 31 1.673 6.857 -20.619 1.00 0.00 O ATOM 502 OD2 ASP A 31 1.124 8.883 -21.092 1.00 0.00 O ATOM 0 H ASP A 31 5.019 8.973 -18.289 1.00 0.00 H new ATOM 0 HA ASP A 31 2.760 7.253 -18.123 1.00 0.00 H new ATOM 0 HB2 ASP A 31 2.806 9.482 -19.240 1.00 0.00 H new ATOM 0 HB3 ASP A 31 3.868 8.847 -20.481 1.00 0.00 H new ATOM 507 N HIS A 32 5.164 6.274 -20.143 1.00 0.00 N ATOM 508 CA HIS A 32 5.649 5.100 -20.916 1.00 0.00 C ATOM 509 C HIS A 32 5.625 3.860 -20.016 1.00 0.00 C ATOM 510 O HIS A 32 5.143 2.812 -20.398 1.00 0.00 O ATOM 511 CB HIS A 32 7.085 5.382 -21.371 1.00 0.00 C ATOM 512 CG HIS A 32 7.515 4.376 -22.401 1.00 0.00 C ATOM 513 ND1 HIS A 32 6.874 4.250 -23.622 1.00 0.00 N ATOM 514 CD2 HIS A 32 8.536 3.458 -22.416 1.00 0.00 C ATOM 515 CE1 HIS A 32 7.511 3.290 -24.316 1.00 0.00 C ATOM 516 NE2 HIS A 32 8.532 2.773 -23.626 1.00 0.00 N ATOM 0 H HIS A 32 5.816 7.057 -20.092 1.00 0.00 H new ATOM 0 HA HIS A 32 5.012 4.924 -21.783 1.00 0.00 H new ATOM 0 HB2 HIS A 32 7.151 6.388 -21.786 1.00 0.00 H new ATOM 0 HB3 HIS A 32 7.758 5.346 -20.515 1.00 0.00 H new ATOM 0 HD1 HIS A 32 6.066 4.787 -23.937 1.00 0.00 H new ATOM 0 HD2 HIS A 32 9.236 3.293 -21.610 1.00 0.00 H new ATOM 0 HE1 HIS A 32 7.231 2.975 -25.310 1.00 0.00 H new ATOM 524 N ALA A 33 6.141 3.973 -18.821 1.00 0.00 N ATOM 525 CA ALA A 33 6.145 2.805 -17.889 1.00 0.00 C ATOM 526 C ALA A 33 4.710 2.341 -17.611 1.00 0.00 C ATOM 527 O ALA A 33 4.429 1.160 -17.527 1.00 0.00 O ATOM 528 CB ALA A 33 6.799 3.218 -16.572 1.00 0.00 C ATOM 0 H ALA A 33 6.561 4.825 -18.448 1.00 0.00 H new ATOM 0 HA ALA A 33 6.702 1.987 -18.347 1.00 0.00 H new ATOM 0 HB1 ALA A 33 6.805 2.370 -15.887 1.00 0.00 H new ATOM 0 HB2 ALA A 33 7.823 3.540 -16.760 1.00 0.00 H new ATOM 0 HB3 ALA A 33 6.236 4.039 -16.128 1.00 0.00 H new ATOM 534 N ILE A 34 3.805 3.267 -17.450 1.00 0.00 N ATOM 535 CA ILE A 34 2.389 2.896 -17.154 1.00 0.00 C ATOM 536 C ILE A 34 1.752 2.260 -18.392 1.00 0.00 C ATOM 537 O ILE A 34 0.985 1.322 -18.292 1.00 0.00 O ATOM 538 CB ILE A 34 1.599 4.156 -16.777 1.00 0.00 C ATOM 539 CG1 ILE A 34 2.216 4.822 -15.534 1.00 0.00 C ATOM 540 CG2 ILE A 34 0.141 3.784 -16.488 1.00 0.00 C ATOM 541 CD1 ILE A 34 2.312 3.834 -14.363 1.00 0.00 C ATOM 0 H ILE A 34 3.985 4.269 -17.511 1.00 0.00 H new ATOM 0 HA ILE A 34 2.370 2.186 -16.327 1.00 0.00 H new ATOM 0 HB ILE A 34 1.639 4.857 -17.611 1.00 0.00 H new ATOM 0 HG12 ILE A 34 3.209 5.200 -15.776 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.611 5.680 -15.240 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -0.417 4.681 -16.221 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -0.302 3.332 -17.375 1.00 0.00 H new ATOM 0 HG23 ILE A 34 0.104 3.074 -15.662 1.00 0.00 H new ATOM 0 HD11 ILE A 34 2.752 4.334 -13.500 1.00 0.00 H new ATOM 0 HD12 ILE A 34 1.315 3.476 -14.106 1.00 0.00 H new ATOM 0 HD13 ILE A 34 2.938 2.989 -14.650 1.00 0.00 H new ATOM 553 N GLU A 35 2.044 2.773 -19.556 1.00 0.00 N ATOM 554 CA GLU A 35 1.427 2.203 -20.790 1.00 0.00 C ATOM 555 C GLU A 35 1.909 0.764 -20.997 1.00 0.00 C ATOM 556 O GLU A 35 1.138 -0.110 -21.340 1.00 0.00 O ATOM 557 CB GLU A 35 1.834 3.052 -21.997 1.00 0.00 C ATOM 558 CG GLU A 35 1.198 2.479 -23.267 1.00 0.00 C ATOM 559 CD GLU A 35 1.455 3.423 -24.444 1.00 0.00 C ATOM 560 OE1 GLU A 35 2.065 4.456 -24.226 1.00 0.00 O ATOM 561 OE2 GLU A 35 1.038 3.096 -25.543 1.00 0.00 O ATOM 0 H GLU A 35 2.679 3.557 -19.707 1.00 0.00 H new ATOM 0 HA GLU A 35 0.342 2.206 -20.684 1.00 0.00 H new ATOM 0 HB2 GLU A 35 1.515 4.084 -21.852 1.00 0.00 H new ATOM 0 HB3 GLU A 35 2.919 3.065 -22.096 1.00 0.00 H new ATOM 0 HG2 GLU A 35 1.613 1.494 -23.481 1.00 0.00 H new ATOM 0 HG3 GLU A 35 0.126 2.348 -23.121 1.00 0.00 H new ATOM 568 N LYS A 36 3.168 0.503 -20.779 1.00 0.00 N ATOM 569 CA LYS A 36 3.681 -0.889 -20.953 1.00 0.00 C ATOM 570 C LYS A 36 2.990 -1.826 -19.966 1.00 0.00 C ATOM 571 O LYS A 36 2.692 -2.959 -20.287 1.00 0.00 O ATOM 572 CB LYS A 36 5.199 -0.924 -20.729 1.00 0.00 C ATOM 573 CG LYS A 36 5.913 -0.442 -21.991 1.00 0.00 C ATOM 574 CD LYS A 36 7.424 -0.438 -21.753 1.00 0.00 C ATOM 575 CE LYS A 36 8.160 -0.243 -23.090 1.00 0.00 C ATOM 576 NZ LYS A 36 7.299 0.526 -24.036 1.00 0.00 N ATOM 0 H LYS A 36 3.864 1.190 -20.489 1.00 0.00 H new ATOM 0 HA LYS A 36 3.465 -1.219 -21.969 1.00 0.00 H new ATOM 0 HB2 LYS A 36 5.467 -0.291 -19.883 1.00 0.00 H new ATOM 0 HB3 LYS A 36 5.517 -1.937 -20.483 1.00 0.00 H new ATOM 0 HG2 LYS A 36 5.668 -1.092 -22.831 1.00 0.00 H new ATOM 0 HG3 LYS A 36 5.573 0.560 -22.254 1.00 0.00 H new ATOM 0 HD2 LYS A 36 7.690 0.360 -21.061 1.00 0.00 H new ATOM 0 HD3 LYS A 36 7.731 -1.376 -21.291 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.098 0.287 -22.925 1.00 0.00 H new ATOM 0 HE3 LYS A 36 8.413 -1.212 -23.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 7.886 1.193 -24.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 6.830 -0.131 -24.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 6.579 1.053 -23.501 1.00 0.00 H new ATOM 590 N ALA A 37 2.740 -1.378 -18.767 1.00 0.00 N ATOM 591 CA ALA A 37 2.079 -2.277 -17.786 1.00 0.00 C ATOM 592 C ALA A 37 0.716 -2.695 -18.344 1.00 0.00 C ATOM 593 O ALA A 37 0.374 -3.862 -18.351 1.00 0.00 O ATOM 594 CB ALA A 37 1.896 -1.545 -16.449 1.00 0.00 C ATOM 0 H ALA A 37 2.962 -0.442 -18.429 1.00 0.00 H new ATOM 0 HA ALA A 37 2.695 -3.160 -17.618 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.411 -2.209 -15.734 1.00 0.00 H new ATOM 0 HB2 ALA A 37 2.870 -1.245 -16.062 1.00 0.00 H new ATOM 0 HB3 ALA A 37 1.277 -0.661 -16.600 1.00 0.00 H new ATOM 600 N PHE A 38 -0.062 -1.765 -18.829 1.00 0.00 N ATOM 601 CA PHE A 38 -1.387 -2.143 -19.396 1.00 0.00 C ATOM 602 C PHE A 38 -1.175 -3.090 -20.588 1.00 0.00 C ATOM 603 O PHE A 38 -1.890 -4.059 -20.757 1.00 0.00 O ATOM 604 CB PHE A 38 -2.129 -0.883 -19.863 1.00 0.00 C ATOM 605 CG PHE A 38 -2.740 -0.177 -18.669 1.00 0.00 C ATOM 606 CD1 PHE A 38 -3.769 -0.794 -17.946 1.00 0.00 C ATOM 607 CD2 PHE A 38 -2.282 1.093 -18.287 1.00 0.00 C ATOM 608 CE1 PHE A 38 -4.338 -0.144 -16.843 1.00 0.00 C ATOM 609 CE2 PHE A 38 -2.854 1.741 -17.185 1.00 0.00 C ATOM 610 CZ PHE A 38 -3.881 1.123 -16.464 1.00 0.00 C ATOM 0 H PHE A 38 0.160 -0.770 -18.857 1.00 0.00 H new ATOM 0 HA PHE A 38 -1.981 -2.644 -18.632 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.440 -0.214 -20.380 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -2.908 -1.152 -20.576 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -4.124 -1.771 -18.239 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -1.489 1.571 -18.843 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -5.130 -0.621 -16.285 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -2.502 2.719 -16.892 1.00 0.00 H new ATOM 0 HZ PHE A 38 -4.321 1.624 -15.615 1.00 0.00 H new ATOM 620 N GLN A 39 -0.195 -2.818 -21.414 1.00 0.00 N ATOM 621 CA GLN A 39 0.059 -3.706 -22.588 1.00 0.00 C ATOM 622 C GLN A 39 0.379 -5.128 -22.116 1.00 0.00 C ATOM 623 O GLN A 39 -0.082 -6.096 -22.687 1.00 0.00 O ATOM 624 CB GLN A 39 1.238 -3.170 -23.403 1.00 0.00 C ATOM 625 CG GLN A 39 0.835 -1.873 -24.109 1.00 0.00 C ATOM 626 CD GLN A 39 2.025 -1.354 -24.919 1.00 0.00 C ATOM 627 OE1 GLN A 39 2.175 -0.164 -25.111 1.00 0.00 O ATOM 628 NE2 GLN A 39 2.888 -2.209 -25.399 1.00 0.00 N ATOM 0 H GLN A 39 0.437 -2.022 -21.326 1.00 0.00 H new ATOM 0 HA GLN A 39 -0.836 -3.724 -23.209 1.00 0.00 H new ATOM 0 HB2 GLN A 39 2.091 -2.989 -22.749 1.00 0.00 H new ATOM 0 HB3 GLN A 39 1.551 -3.912 -24.137 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -0.017 -2.051 -24.765 1.00 0.00 H new ATOM 0 HG3 GLN A 39 0.524 -1.127 -23.377 1.00 0.00 H new ATOM 0 HE21 GLN A 39 2.760 -3.208 -25.237 1.00 0.00 H new ATOM 0 HE22 GLN A 39 3.689 -1.878 -25.936 1.00 0.00 H new ATOM 637 N LEU A 40 1.172 -5.271 -21.086 1.00 0.00 N ATOM 638 CA LEU A 40 1.509 -6.647 -20.611 1.00 0.00 C ATOM 639 C LEU A 40 0.237 -7.393 -20.204 1.00 0.00 C ATOM 640 O LEU A 40 0.068 -8.555 -20.516 1.00 0.00 O ATOM 641 CB LEU A 40 2.444 -6.578 -19.399 1.00 0.00 C ATOM 642 CG LEU A 40 3.841 -6.088 -19.807 1.00 0.00 C ATOM 643 CD1 LEU A 40 4.679 -5.891 -18.539 1.00 0.00 C ATOM 644 CD2 LEU A 40 4.530 -7.125 -20.722 1.00 0.00 C ATOM 0 H LEU A 40 1.596 -4.507 -20.559 1.00 0.00 H new ATOM 0 HA LEU A 40 2.002 -7.175 -21.427 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.024 -5.907 -18.649 1.00 0.00 H new ATOM 0 HB3 LEU A 40 2.521 -7.563 -18.938 1.00 0.00 H new ATOM 0 HG LEU A 40 3.751 -5.149 -20.353 1.00 0.00 H new ATOM 0 HD11 LEU A 40 5.675 -5.543 -18.812 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.199 -5.152 -17.897 1.00 0.00 H new ATOM 0 HD13 LEU A 40 4.759 -6.838 -18.005 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.519 -6.763 -21.002 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.628 -8.071 -20.190 1.00 0.00 H new ATOM 0 HD23 LEU A 40 3.930 -7.273 -21.620 1.00 0.00 H new ATOM 656 N TRP A 41 -0.654 -6.748 -19.503 1.00 0.00 N ATOM 657 CA TRP A 41 -1.902 -7.445 -19.073 1.00 0.00 C ATOM 658 C TRP A 41 -2.842 -7.654 -20.270 1.00 0.00 C ATOM 659 O TRP A 41 -3.456 -8.692 -20.414 1.00 0.00 O ATOM 660 CB TRP A 41 -2.614 -6.588 -18.026 1.00 0.00 C ATOM 661 CG TRP A 41 -1.779 -6.507 -16.792 1.00 0.00 C ATOM 662 CD1 TRP A 41 -1.206 -5.377 -16.322 1.00 0.00 C ATOM 663 CD2 TRP A 41 -1.413 -7.569 -15.867 1.00 0.00 C ATOM 664 NE1 TRP A 41 -0.507 -5.677 -15.168 1.00 0.00 N ATOM 665 CE2 TRP A 41 -0.605 -7.016 -14.846 1.00 0.00 C ATOM 666 CE3 TRP A 41 -1.701 -8.944 -15.815 1.00 0.00 C ATOM 667 CZ2 TRP A 41 -0.098 -7.800 -13.810 1.00 0.00 C ATOM 668 CZ3 TRP A 41 -1.193 -9.737 -14.773 1.00 0.00 C ATOM 669 CH2 TRP A 41 -0.392 -9.166 -13.773 1.00 0.00 C ATOM 0 H TRP A 41 -0.574 -5.774 -19.210 1.00 0.00 H new ATOM 0 HA TRP A 41 -1.639 -8.417 -18.656 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -2.794 -5.588 -18.421 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -3.588 -7.018 -17.791 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -1.282 -4.399 -16.774 1.00 0.00 H new ATOM 0 HE1 TRP A 41 0.017 -4.993 -14.622 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -2.316 -9.393 -16.581 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 0.517 -7.355 -13.042 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -1.420 -10.792 -14.742 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -0.003 -9.781 -12.975 1.00 0.00 H new ATOM 680 N SER A 42 -2.969 -6.669 -21.120 1.00 0.00 N ATOM 681 CA SER A 42 -3.880 -6.800 -22.300 1.00 0.00 C ATOM 682 C SER A 42 -3.327 -7.832 -23.286 1.00 0.00 C ATOM 683 O SER A 42 -4.068 -8.557 -23.922 1.00 0.00 O ATOM 684 CB SER A 42 -4.005 -5.445 -22.998 1.00 0.00 C ATOM 685 OG SER A 42 -4.713 -5.610 -24.221 1.00 0.00 O ATOM 0 H SER A 42 -2.481 -5.776 -21.049 1.00 0.00 H new ATOM 0 HA SER A 42 -4.860 -7.130 -21.956 1.00 0.00 H new ATOM 0 HB2 SER A 42 -4.528 -4.738 -22.354 1.00 0.00 H new ATOM 0 HB3 SER A 42 -3.016 -5.029 -23.190 1.00 0.00 H new ATOM 0 HG SER A 42 -5.677 -5.599 -24.045 1.00 0.00 H new ATOM 691 N ASN A 43 -2.032 -7.889 -23.432 1.00 0.00 N ATOM 692 CA ASN A 43 -1.427 -8.854 -24.394 1.00 0.00 C ATOM 693 C ASN A 43 -1.804 -10.289 -24.013 1.00 0.00 C ATOM 694 O ASN A 43 -1.717 -11.189 -24.825 1.00 0.00 O ATOM 695 CB ASN A 43 0.099 -8.709 -24.372 1.00 0.00 C ATOM 696 CG ASN A 43 0.501 -7.366 -24.989 1.00 0.00 C ATOM 697 OD1 ASN A 43 1.434 -6.732 -24.536 1.00 0.00 O ATOM 698 ND2 ASN A 43 -0.169 -6.902 -26.009 1.00 0.00 N ATOM 0 H ASN A 43 -1.365 -7.307 -22.925 1.00 0.00 H new ATOM 0 HA ASN A 43 -1.805 -8.639 -25.394 1.00 0.00 H new ATOM 0 HB2 ASN A 43 0.465 -8.773 -23.347 1.00 0.00 H new ATOM 0 HB3 ASN A 43 0.559 -9.527 -24.926 1.00 0.00 H new ATOM 0 HD21 ASN A 43 0.091 -6.008 -26.425 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -0.952 -7.434 -26.389 1.00 0.00 H new ATOM 705 N VAL A 44 -2.218 -10.514 -22.787 1.00 0.00 N ATOM 706 CA VAL A 44 -2.595 -11.902 -22.352 1.00 0.00 C ATOM 707 C VAL A 44 -4.100 -11.983 -22.084 1.00 0.00 C ATOM 708 O VAL A 44 -4.608 -13.020 -21.704 1.00 0.00 O ATOM 709 CB VAL A 44 -1.846 -12.248 -21.065 1.00 0.00 C ATOM 710 CG1 VAL A 44 -0.360 -12.440 -21.371 1.00 0.00 C ATOM 711 CG2 VAL A 44 -2.017 -11.109 -20.057 1.00 0.00 C ATOM 0 H VAL A 44 -2.312 -9.797 -22.067 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.331 -12.603 -23.144 1.00 0.00 H new ATOM 0 HB VAL A 44 -2.250 -13.170 -20.647 1.00 0.00 H new ATOM 0 HG11 VAL A 44 0.172 -12.687 -20.452 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.238 -13.251 -22.089 1.00 0.00 H new ATOM 0 HG13 VAL A 44 0.047 -11.520 -21.790 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.484 -11.353 -19.138 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -1.613 -10.188 -20.477 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -3.076 -10.974 -19.837 1.00 0.00 H new ATOM 721 N THR A 45 -4.825 -10.907 -22.279 1.00 0.00 N ATOM 722 CA THR A 45 -6.304 -10.942 -22.033 1.00 0.00 C ATOM 723 C THR A 45 -7.017 -10.046 -23.066 1.00 0.00 C ATOM 724 O THR A 45 -6.457 -9.066 -23.516 1.00 0.00 O ATOM 725 CB THR A 45 -6.592 -10.412 -20.623 1.00 0.00 C ATOM 726 OG1 THR A 45 -5.786 -9.267 -20.378 1.00 0.00 O ATOM 727 CG2 THR A 45 -6.278 -11.493 -19.587 1.00 0.00 C ATOM 0 H THR A 45 -4.459 -10.009 -22.596 1.00 0.00 H new ATOM 0 HA THR A 45 -6.666 -11.966 -22.125 1.00 0.00 H new ATOM 0 HB THR A 45 -7.645 -10.141 -20.546 1.00 0.00 H new ATOM 0 HG1 THR A 45 -4.852 -9.542 -20.264 1.00 0.00 H new ATOM 0 HG21 THR A 45 -6.485 -11.110 -18.588 1.00 0.00 H new ATOM 0 HG22 THR A 45 -6.899 -12.369 -19.776 1.00 0.00 H new ATOM 0 HG23 THR A 45 -5.227 -11.771 -19.659 1.00 0.00 H new ATOM 735 N PRO A 46 -8.248 -10.355 -23.437 1.00 0.00 N ATOM 736 CA PRO A 46 -8.989 -9.509 -24.421 1.00 0.00 C ATOM 737 C PRO A 46 -9.365 -8.135 -23.837 1.00 0.00 C ATOM 738 O PRO A 46 -10.100 -7.376 -24.435 1.00 0.00 O ATOM 739 CB PRO A 46 -10.249 -10.354 -24.686 1.00 0.00 C ATOM 740 CG PRO A 46 -10.380 -11.361 -23.535 1.00 0.00 C ATOM 741 CD PRO A 46 -8.985 -11.550 -22.924 1.00 0.00 C ATOM 0 HA PRO A 46 -8.406 -9.280 -25.313 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.132 -9.718 -24.741 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -10.169 -10.872 -25.642 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -11.081 -10.996 -22.784 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -10.770 -12.311 -23.900 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -9.018 -11.571 -21.835 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -8.522 -12.483 -23.247 1.00 0.00 H new ATOM 749 N LEU A 47 -8.880 -7.822 -22.668 1.00 0.00 N ATOM 750 CA LEU A 47 -9.221 -6.511 -22.041 1.00 0.00 C ATOM 751 C LEU A 47 -8.495 -5.381 -22.773 1.00 0.00 C ATOM 752 O LEU A 47 -7.429 -5.573 -23.323 1.00 0.00 O ATOM 753 CB LEU A 47 -8.776 -6.522 -20.576 1.00 0.00 C ATOM 754 CG LEU A 47 -9.488 -7.646 -19.812 1.00 0.00 C ATOM 755 CD1 LEU A 47 -8.846 -7.799 -18.431 1.00 0.00 C ATOM 756 CD2 LEU A 47 -10.981 -7.317 -19.644 1.00 0.00 C ATOM 0 H LEU A 47 -8.261 -8.417 -22.118 1.00 0.00 H new ATOM 0 HA LEU A 47 -10.298 -6.352 -22.104 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -7.696 -6.661 -20.518 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -8.999 -5.561 -20.114 1.00 0.00 H new ATOM 0 HG LEU A 47 -9.392 -8.574 -20.375 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -9.348 -8.596 -17.883 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -7.791 -8.046 -18.546 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -8.942 -6.864 -17.880 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -11.472 -8.124 -19.100 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -11.088 -6.386 -19.087 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -11.442 -7.208 -20.626 1.00 0.00 H new ATOM 768 N THR A 48 -9.062 -4.197 -22.769 1.00 0.00 N ATOM 769 CA THR A 48 -8.411 -3.033 -23.449 1.00 0.00 C ATOM 770 C THR A 48 -8.372 -1.858 -22.472 1.00 0.00 C ATOM 771 O THR A 48 -9.222 -1.730 -21.613 1.00 0.00 O ATOM 772 CB THR A 48 -9.229 -2.635 -24.681 1.00 0.00 C ATOM 773 OG1 THR A 48 -10.523 -2.227 -24.265 1.00 0.00 O ATOM 774 CG2 THR A 48 -9.348 -3.825 -25.635 1.00 0.00 C ATOM 0 H THR A 48 -9.954 -3.987 -22.321 1.00 0.00 H new ATOM 0 HA THR A 48 -7.401 -3.302 -23.758 1.00 0.00 H new ATOM 0 HB THR A 48 -8.731 -1.815 -25.199 1.00 0.00 H new ATOM 0 HG1 THR A 48 -10.809 -1.455 -24.797 1.00 0.00 H new ATOM 0 HG21 THR A 48 -9.931 -3.534 -26.509 1.00 0.00 H new ATOM 0 HG22 THR A 48 -8.353 -4.139 -25.951 1.00 0.00 H new ATOM 0 HG23 THR A 48 -9.845 -4.651 -25.126 1.00 0.00 H new ATOM 782 N PHE A 49 -7.386 -1.006 -22.590 1.00 0.00 N ATOM 783 CA PHE A 49 -7.268 0.167 -21.664 1.00 0.00 C ATOM 784 C PHE A 49 -7.110 1.446 -22.483 1.00 0.00 C ATOM 785 O PHE A 49 -6.630 1.424 -23.599 1.00 0.00 O ATOM 786 CB PHE A 49 -6.037 -0.024 -20.779 1.00 0.00 C ATOM 787 CG PHE A 49 -6.261 -1.201 -19.859 1.00 0.00 C ATOM 788 CD1 PHE A 49 -5.885 -2.489 -20.262 1.00 0.00 C ATOM 789 CD2 PHE A 49 -6.843 -1.004 -18.603 1.00 0.00 C ATOM 790 CE1 PHE A 49 -6.094 -3.579 -19.407 1.00 0.00 C ATOM 791 CE2 PHE A 49 -7.052 -2.092 -17.748 1.00 0.00 C ATOM 792 CZ PHE A 49 -6.679 -3.380 -18.149 1.00 0.00 C ATOM 0 H PHE A 49 -6.650 -1.071 -23.293 1.00 0.00 H new ATOM 0 HA PHE A 49 -8.162 0.242 -21.045 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.154 -0.193 -21.396 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.851 0.878 -20.196 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -5.434 -2.642 -21.231 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -7.132 -0.011 -18.292 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -5.804 -4.572 -19.717 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -7.501 -1.938 -16.778 1.00 0.00 H new ATOM 0 HZ PHE A 49 -6.842 -4.220 -17.490 1.00 0.00 H new ATOM 802 N THR A 50 -7.510 2.567 -21.940 1.00 0.00 N ATOM 803 CA THR A 50 -7.381 3.848 -22.697 1.00 0.00 C ATOM 804 C THR A 50 -7.256 5.024 -21.724 1.00 0.00 C ATOM 805 O THR A 50 -7.980 5.126 -20.752 1.00 0.00 O ATOM 806 CB THR A 50 -8.620 4.050 -23.574 1.00 0.00 C ATOM 807 OG1 THR A 50 -8.718 2.984 -24.507 1.00 0.00 O ATOM 808 CG2 THR A 50 -8.507 5.379 -24.324 1.00 0.00 C ATOM 0 H THR A 50 -7.919 2.651 -21.009 1.00 0.00 H new ATOM 0 HA THR A 50 -6.489 3.802 -23.321 1.00 0.00 H new ATOM 0 HB THR A 50 -9.510 4.065 -22.946 1.00 0.00 H new ATOM 0 HG1 THR A 50 -9.512 3.112 -25.068 1.00 0.00 H new ATOM 0 HG21 THR A 50 -9.390 5.521 -24.948 1.00 0.00 H new ATOM 0 HG22 THR A 50 -8.434 6.197 -23.607 1.00 0.00 H new ATOM 0 HG23 THR A 50 -7.617 5.367 -24.953 1.00 0.00 H new ATOM 816 N LYS A 51 -6.336 5.913 -21.990 1.00 0.00 N ATOM 817 CA LYS A 51 -6.138 7.097 -21.104 1.00 0.00 C ATOM 818 C LYS A 51 -7.207 8.148 -21.412 1.00 0.00 C ATOM 819 O LYS A 51 -7.439 8.491 -22.556 1.00 0.00 O ATOM 820 CB LYS A 51 -4.746 7.687 -21.363 1.00 0.00 C ATOM 821 CG LYS A 51 -4.505 8.903 -20.461 1.00 0.00 C ATOM 822 CD LYS A 51 -3.107 9.463 -20.736 1.00 0.00 C ATOM 823 CE LYS A 51 -2.843 10.668 -19.832 1.00 0.00 C ATOM 824 NZ LYS A 51 -1.480 11.204 -20.109 1.00 0.00 N ATOM 0 H LYS A 51 -5.707 5.869 -22.792 1.00 0.00 H new ATOM 0 HA LYS A 51 -6.221 6.796 -20.060 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -3.983 6.931 -21.177 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.657 7.979 -22.409 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -5.260 9.667 -20.650 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -4.596 8.617 -19.413 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -2.356 8.693 -20.559 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.022 9.757 -21.782 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -3.592 11.440 -20.008 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -2.926 10.376 -18.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -0.913 11.177 -19.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -1.021 10.624 -20.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -1.554 12.186 -20.443 1.00 0.00 H new ATOM 838 N VAL A 52 -7.852 8.666 -20.395 1.00 0.00 N ATOM 839 CA VAL A 52 -8.908 9.709 -20.601 1.00 0.00 C ATOM 840 C VAL A 52 -8.494 10.986 -19.868 1.00 0.00 C ATOM 841 O VAL A 52 -8.119 10.958 -18.714 1.00 0.00 O ATOM 842 CB VAL A 52 -10.248 9.202 -20.045 1.00 0.00 C ATOM 843 CG1 VAL A 52 -10.781 8.085 -20.944 1.00 0.00 C ATOM 844 CG2 VAL A 52 -10.056 8.654 -18.627 1.00 0.00 C ATOM 0 H VAL A 52 -7.691 8.409 -19.421 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.021 9.917 -21.665 1.00 0.00 H new ATOM 0 HB VAL A 52 -10.957 10.030 -20.019 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -11.732 7.724 -20.551 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -10.928 8.469 -21.953 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -10.064 7.265 -20.969 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -11.011 8.297 -18.242 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -9.343 7.830 -18.649 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -9.677 9.445 -17.980 1.00 0.00 H new ATOM 854 N SER A 53 -8.547 12.109 -20.534 1.00 0.00 N ATOM 855 CA SER A 53 -8.152 13.394 -19.880 1.00 0.00 C ATOM 856 C SER A 53 -9.407 14.091 -19.354 1.00 0.00 C ATOM 857 O SER A 53 -9.332 15.075 -18.645 1.00 0.00 O ATOM 858 CB SER A 53 -7.461 14.296 -20.904 1.00 0.00 C ATOM 859 OG SER A 53 -7.177 15.554 -20.305 1.00 0.00 O ATOM 0 H SER A 53 -8.847 12.193 -21.505 1.00 0.00 H new ATOM 0 HA SER A 53 -7.468 13.193 -19.056 1.00 0.00 H new ATOM 0 HB2 SER A 53 -6.540 13.830 -21.253 1.00 0.00 H new ATOM 0 HB3 SER A 53 -8.100 14.432 -21.776 1.00 0.00 H new ATOM 0 HG SER A 53 -7.903 15.796 -19.692 1.00 0.00 H new ATOM 865 N GLU A 54 -10.562 13.585 -19.698 1.00 0.00 N ATOM 866 CA GLU A 54 -11.837 14.207 -19.227 1.00 0.00 C ATOM 867 C GLU A 54 -12.862 13.102 -18.951 1.00 0.00 C ATOM 868 O GLU A 54 -12.815 12.042 -19.540 1.00 0.00 O ATOM 869 CB GLU A 54 -12.383 15.142 -20.312 1.00 0.00 C ATOM 870 CG GLU A 54 -11.426 16.321 -20.511 1.00 0.00 C ATOM 871 CD GLU A 54 -11.976 17.253 -21.594 1.00 0.00 C ATOM 872 OE1 GLU A 54 -12.942 16.879 -22.238 1.00 0.00 O ATOM 873 OE2 GLU A 54 -11.427 18.331 -21.752 1.00 0.00 O ATOM 0 H GLU A 54 -10.679 12.762 -20.289 1.00 0.00 H new ATOM 0 HA GLU A 54 -11.651 14.777 -18.316 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -12.502 14.597 -21.248 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -13.370 15.507 -20.027 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -11.305 16.866 -19.575 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.439 15.957 -20.797 1.00 0.00 H new ATOM 880 N GLY A 55 -13.785 13.335 -18.051 1.00 0.00 N ATOM 881 CA GLY A 55 -14.808 12.289 -17.729 1.00 0.00 C ATOM 882 C GLY A 55 -14.348 11.495 -16.503 1.00 0.00 C ATOM 883 O GLY A 55 -13.296 11.746 -15.953 1.00 0.00 O ATOM 0 H GLY A 55 -13.875 14.204 -17.525 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -15.774 12.756 -17.534 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -14.943 11.621 -18.580 1.00 0.00 H new ATOM 887 N GLN A 56 -15.122 10.538 -16.064 1.00 0.00 N ATOM 888 CA GLN A 56 -14.708 9.738 -14.872 1.00 0.00 C ATOM 889 C GLN A 56 -13.755 8.621 -15.302 1.00 0.00 C ATOM 890 O GLN A 56 -14.006 7.908 -16.253 1.00 0.00 O ATOM 891 CB GLN A 56 -15.938 9.120 -14.201 1.00 0.00 C ATOM 892 CG GLN A 56 -16.751 10.215 -13.510 1.00 0.00 C ATOM 893 CD GLN A 56 -17.980 9.597 -12.838 1.00 0.00 C ATOM 894 OE1 GLN A 56 -18.406 8.424 -13.222 1.00 0.00 O flip ATOM 895 NE2 GLN A 56 -18.559 10.190 -11.950 1.00 0.00 N flip ATOM 0 H GLN A 56 -16.018 10.276 -16.476 1.00 0.00 H new ATOM 0 HA GLN A 56 -14.204 10.397 -14.166 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -16.552 8.611 -14.944 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -15.629 8.369 -13.474 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -16.136 10.725 -12.768 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -17.061 10.966 -14.237 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -18.228 11.106 -11.648 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -19.376 9.772 -11.506 1.00 0.00 H new ATOM 904 N ALA A 57 -12.668 8.454 -14.593 1.00 0.00 N ATOM 905 CA ALA A 57 -11.695 7.374 -14.938 1.00 0.00 C ATOM 906 C ALA A 57 -11.950 6.183 -14.013 1.00 0.00 C ATOM 907 O ALA A 57 -12.060 6.329 -12.812 1.00 0.00 O ATOM 908 CB ALA A 57 -10.268 7.890 -14.734 1.00 0.00 C ATOM 0 H ALA A 57 -12.411 9.022 -13.786 1.00 0.00 H new ATOM 0 HA ALA A 57 -11.817 7.072 -15.978 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -9.557 7.103 -14.985 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -10.097 8.752 -15.378 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -10.132 8.183 -13.693 1.00 0.00 H new ATOM 914 N ASP A 58 -12.055 5.006 -14.559 1.00 0.00 N ATOM 915 CA ASP A 58 -12.320 3.814 -13.706 1.00 0.00 C ATOM 916 C ASP A 58 -11.196 3.644 -12.683 1.00 0.00 C ATOM 917 O ASP A 58 -11.440 3.374 -11.523 1.00 0.00 O ATOM 918 CB ASP A 58 -12.390 2.567 -14.588 1.00 0.00 C ATOM 919 CG ASP A 58 -13.662 2.606 -15.436 1.00 0.00 C ATOM 920 OD1 ASP A 58 -14.640 3.173 -14.976 1.00 0.00 O ATOM 921 OD2 ASP A 58 -13.638 2.062 -16.529 1.00 0.00 O ATOM 0 H ASP A 58 -11.969 4.816 -15.558 1.00 0.00 H new ATOM 0 HA ASP A 58 -13.266 3.952 -13.182 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -11.513 2.516 -15.233 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -12.382 1.670 -13.968 1.00 0.00 H new ATOM 926 N ILE A 59 -9.965 3.797 -13.108 1.00 0.00 N ATOM 927 CA ILE A 59 -8.804 3.643 -12.174 1.00 0.00 C ATOM 928 C ILE A 59 -8.006 4.949 -12.118 1.00 0.00 C ATOM 929 O ILE A 59 -7.491 5.412 -13.119 1.00 0.00 O ATOM 930 CB ILE A 59 -7.896 2.529 -12.696 1.00 0.00 C ATOM 931 CG1 ILE A 59 -8.687 1.221 -12.764 1.00 0.00 C ATOM 932 CG2 ILE A 59 -6.700 2.358 -11.757 1.00 0.00 C ATOM 933 CD1 ILE A 59 -7.870 0.167 -13.514 1.00 0.00 C ATOM 0 H ILE A 59 -9.712 4.024 -14.070 1.00 0.00 H new ATOM 0 HA ILE A 59 -9.169 3.399 -11.176 1.00 0.00 H new ATOM 0 HB ILE A 59 -7.536 2.789 -13.691 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -8.916 0.870 -11.758 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -9.639 1.385 -13.269 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -6.054 1.563 -12.131 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -6.138 3.291 -11.710 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -7.055 2.098 -10.760 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -8.434 -0.764 -13.562 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -7.663 0.518 -14.525 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -6.930 -0.005 -12.990 1.00 0.00 H new ATOM 945 N MET A 60 -7.888 5.546 -10.956 1.00 0.00 N ATOM 946 CA MET A 60 -7.107 6.819 -10.833 1.00 0.00 C ATOM 947 C MET A 60 -5.709 6.521 -10.284 1.00 0.00 C ATOM 948 O MET A 60 -5.553 5.856 -9.279 1.00 0.00 O ATOM 949 CB MET A 60 -7.822 7.786 -9.884 1.00 0.00 C ATOM 950 CG MET A 60 -9.031 8.402 -10.593 1.00 0.00 C ATOM 951 SD MET A 60 -9.865 9.557 -9.476 1.00 0.00 S ATOM 952 CE MET A 60 -10.487 10.689 -10.745 1.00 0.00 C ATOM 0 H MET A 60 -8.299 5.207 -10.086 1.00 0.00 H new ATOM 0 HA MET A 60 -7.024 7.274 -11.820 1.00 0.00 H new ATOM 0 HB2 MET A 60 -8.144 7.259 -8.986 1.00 0.00 H new ATOM 0 HB3 MET A 60 -7.137 8.571 -9.564 1.00 0.00 H new ATOM 0 HG2 MET A 60 -8.710 8.921 -11.496 1.00 0.00 H new ATOM 0 HG3 MET A 60 -9.722 7.618 -10.904 1.00 0.00 H new ATOM 0 HE1 MET A 60 -11.045 11.496 -10.271 1.00 0.00 H new ATOM 0 HE2 MET A 60 -9.649 11.106 -11.303 1.00 0.00 H new ATOM 0 HE3 MET A 60 -11.143 10.147 -11.426 1.00 0.00 H new ATOM 962 N ILE A 61 -4.692 7.034 -10.930 1.00 0.00 N ATOM 963 CA ILE A 61 -3.288 6.823 -10.457 1.00 0.00 C ATOM 964 C ILE A 61 -2.763 8.152 -9.922 1.00 0.00 C ATOM 965 O ILE A 61 -2.811 9.161 -10.599 1.00 0.00 O ATOM 966 CB ILE A 61 -2.411 6.373 -11.630 1.00 0.00 C ATOM 967 CG1 ILE A 61 -2.847 4.980 -12.091 1.00 0.00 C ATOM 968 CG2 ILE A 61 -0.945 6.332 -11.187 1.00 0.00 C ATOM 969 CD1 ILE A 61 -2.170 4.646 -13.423 1.00 0.00 C ATOM 0 H ILE A 61 -4.776 7.597 -11.776 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.265 6.059 -9.680 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.520 7.077 -12.455 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -2.580 4.237 -11.339 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -3.931 4.945 -12.203 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -0.321 6.012 -12.022 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -0.635 7.325 -10.863 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.834 5.630 -10.361 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -2.481 3.654 -13.751 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.459 5.383 -14.173 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -1.088 4.663 -13.295 1.00 0.00 H new ATOM 981 N SER A 62 -2.270 8.175 -8.713 1.00 0.00 N ATOM 982 CA SER A 62 -1.757 9.461 -8.152 1.00 0.00 C ATOM 983 C SER A 62 -0.639 9.194 -7.145 1.00 0.00 C ATOM 984 O SER A 62 -0.494 8.104 -6.624 1.00 0.00 O ATOM 985 CB SER A 62 -2.902 10.195 -7.456 1.00 0.00 C ATOM 986 OG SER A 62 -3.214 9.532 -6.238 1.00 0.00 O ATOM 0 H SER A 62 -2.200 7.368 -8.093 1.00 0.00 H new ATOM 0 HA SER A 62 -1.360 10.071 -8.964 1.00 0.00 H new ATOM 0 HB2 SER A 62 -2.619 11.229 -7.258 1.00 0.00 H new ATOM 0 HB3 SER A 62 -3.779 10.222 -8.103 1.00 0.00 H new ATOM 0 HG SER A 62 -3.947 10.002 -5.788 1.00 0.00 H new ATOM 992 N PHE A 63 0.153 10.198 -6.871 1.00 0.00 N ATOM 993 CA PHE A 63 1.279 10.056 -5.899 1.00 0.00 C ATOM 994 C PHE A 63 0.917 10.800 -4.611 1.00 0.00 C ATOM 995 O PHE A 63 0.333 11.865 -4.651 1.00 0.00 O ATOM 996 CB PHE A 63 2.534 10.669 -6.519 1.00 0.00 C ATOM 997 CG PHE A 63 2.997 9.799 -7.661 1.00 0.00 C ATOM 998 CD1 PHE A 63 3.901 8.756 -7.428 1.00 0.00 C ATOM 999 CD2 PHE A 63 2.520 10.035 -8.957 1.00 0.00 C ATOM 1000 CE1 PHE A 63 4.330 7.951 -8.490 1.00 0.00 C ATOM 1001 CE2 PHE A 63 2.949 9.229 -10.019 1.00 0.00 C ATOM 1002 CZ PHE A 63 3.854 8.188 -9.784 1.00 0.00 C ATOM 0 H PHE A 63 0.066 11.125 -7.286 1.00 0.00 H new ATOM 0 HA PHE A 63 1.459 9.006 -5.669 1.00 0.00 H new ATOM 0 HB2 PHE A 63 2.323 11.677 -6.876 1.00 0.00 H new ATOM 0 HB3 PHE A 63 3.320 10.755 -5.769 1.00 0.00 H new ATOM 0 HD1 PHE A 63 4.268 8.572 -6.429 1.00 0.00 H new ATOM 0 HD2 PHE A 63 1.821 10.839 -9.137 1.00 0.00 H new ATOM 0 HE1 PHE A 63 5.028 7.147 -8.310 1.00 0.00 H new ATOM 0 HE2 PHE A 63 2.582 9.411 -11.018 1.00 0.00 H new ATOM 0 HZ PHE A 63 4.186 7.567 -10.603 1.00 0.00 H new ATOM 1012 N VAL A 64 1.236 10.238 -3.467 1.00 0.00 N ATOM 1013 CA VAL A 64 0.885 10.904 -2.165 1.00 0.00 C ATOM 1014 C VAL A 64 2.104 10.975 -1.235 1.00 0.00 C ATOM 1015 O VAL A 64 3.064 10.241 -1.382 1.00 0.00 O ATOM 1016 CB VAL A 64 -0.222 10.097 -1.492 1.00 0.00 C ATOM 1017 CG1 VAL A 64 -1.447 10.061 -2.407 1.00 0.00 C ATOM 1018 CG2 VAL A 64 0.265 8.668 -1.250 1.00 0.00 C ATOM 0 H VAL A 64 1.724 9.347 -3.377 1.00 0.00 H new ATOM 0 HA VAL A 64 0.552 11.923 -2.364 1.00 0.00 H new ATOM 0 HB VAL A 64 -0.484 10.561 -0.541 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -2.240 9.485 -1.930 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -1.795 11.078 -2.589 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -1.180 9.594 -3.355 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -0.525 8.091 -0.769 1.00 0.00 H new ATOM 0 HG22 VAL A 64 0.524 8.206 -2.203 1.00 0.00 H new ATOM 0 HG23 VAL A 64 1.144 8.687 -0.605 1.00 0.00 H new ATOM 1028 N ARG A 65 2.055 11.864 -0.268 1.00 0.00 N ATOM 1029 CA ARG A 65 3.182 12.022 0.708 1.00 0.00 C ATOM 1030 C ARG A 65 2.623 12.037 2.133 1.00 0.00 C ATOM 1031 O ARG A 65 1.564 12.575 2.388 1.00 0.00 O ATOM 1032 CB ARG A 65 3.895 13.352 0.447 1.00 0.00 C ATOM 1033 CG ARG A 65 4.770 13.233 -0.796 1.00 0.00 C ATOM 1034 CD ARG A 65 5.456 14.572 -1.061 1.00 0.00 C ATOM 1035 NE ARG A 65 4.416 15.615 -1.292 1.00 0.00 N ATOM 1036 CZ ARG A 65 4.741 16.879 -1.286 1.00 0.00 C ATOM 1037 NH1 ARG A 65 5.977 17.236 -1.072 1.00 0.00 N ATOM 1038 NH2 ARG A 65 3.831 17.787 -1.499 1.00 0.00 N ATOM 0 H ARG A 65 1.269 12.496 -0.113 1.00 0.00 H new ATOM 0 HA ARG A 65 3.880 11.193 0.591 1.00 0.00 H new ATOM 0 HB2 ARG A 65 3.162 14.148 0.312 1.00 0.00 H new ATOM 0 HB3 ARG A 65 4.506 13.623 1.308 1.00 0.00 H new ATOM 0 HG2 ARG A 65 5.516 12.451 -0.656 1.00 0.00 H new ATOM 0 HG3 ARG A 65 4.164 12.946 -1.655 1.00 0.00 H new ATOM 0 HD2 ARG A 65 6.083 14.848 -0.213 1.00 0.00 H new ATOM 0 HD3 ARG A 65 6.110 14.494 -1.929 1.00 0.00 H new ATOM 0 HE ARG A 65 3.447 15.340 -1.455 1.00 0.00 H new ATOM 0 HH11 ARG A 65 6.692 16.527 -0.909 1.00 0.00 H new ATOM 0 HH12 ARG A 65 6.229 18.224 -1.068 1.00 0.00 H new ATOM 0 HH21 ARG A 65 2.864 17.510 -1.670 1.00 0.00 H new ATOM 0 HH22 ARG A 65 4.085 18.775 -1.494 1.00 0.00 H new ATOM 1052 N GLY A 66 3.338 11.463 3.063 1.00 0.00 N ATOM 1053 CA GLY A 66 2.869 11.449 4.483 1.00 0.00 C ATOM 1054 C GLY A 66 1.372 11.138 4.547 1.00 0.00 C ATOM 1055 O GLY A 66 0.841 10.407 3.734 1.00 0.00 O ATOM 0 H GLY A 66 4.232 11.000 2.901 1.00 0.00 H new ATOM 0 HA2 GLY A 66 3.426 10.703 5.049 1.00 0.00 H new ATOM 0 HA3 GLY A 66 3.066 12.415 4.947 1.00 0.00 H new ATOM 1059 N ASP A 67 0.690 11.693 5.512 1.00 0.00 N ATOM 1060 CA ASP A 67 -0.772 11.441 5.642 1.00 0.00 C ATOM 1061 C ASP A 67 -1.505 12.070 4.456 1.00 0.00 C ATOM 1062 O ASP A 67 -1.289 13.217 4.119 1.00 0.00 O ATOM 1063 CB ASP A 67 -1.281 12.062 6.942 1.00 0.00 C ATOM 1064 CG ASP A 67 -2.714 11.596 7.202 1.00 0.00 C ATOM 1065 OD1 ASP A 67 -3.312 11.048 6.291 1.00 0.00 O ATOM 1066 OD2 ASP A 67 -3.190 11.795 8.308 1.00 0.00 O ATOM 0 H ASP A 67 1.086 12.313 6.219 1.00 0.00 H new ATOM 0 HA ASP A 67 -0.956 10.367 5.655 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -0.637 11.773 7.772 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -1.247 13.149 6.876 1.00 0.00 H new ATOM 1071 N HIS A 68 -2.365 11.321 3.815 1.00 0.00 N ATOM 1072 CA HIS A 68 -3.120 11.856 2.637 1.00 0.00 C ATOM 1073 C HIS A 68 -4.598 11.487 2.767 1.00 0.00 C ATOM 1074 O HIS A 68 -5.171 10.866 1.894 1.00 0.00 O ATOM 1075 CB HIS A 68 -2.550 11.247 1.361 1.00 0.00 C ATOM 1076 CG HIS A 68 -2.358 9.773 1.564 1.00 0.00 C ATOM 1077 ND1 HIS A 68 -1.537 9.266 2.559 1.00 0.00 N ATOM 1078 CD2 HIS A 68 -2.877 8.686 0.914 1.00 0.00 C ATOM 1079 CE1 HIS A 68 -1.589 7.926 2.482 1.00 0.00 C ATOM 1080 NE2 HIS A 68 -2.392 7.517 1.495 1.00 0.00 N ATOM 0 H HIS A 68 -2.580 10.354 4.058 1.00 0.00 H new ATOM 0 HA HIS A 68 -3.023 12.941 2.600 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -3.225 11.427 0.524 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -1.600 11.719 1.111 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -0.993 9.811 3.228 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -3.559 8.728 0.078 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -1.048 7.260 3.138 1.00 0.00 H new ATOM 1088 N ARG A 69 -5.209 11.866 3.855 1.00 0.00 N ATOM 1089 CA ARG A 69 -6.654 11.558 4.074 1.00 0.00 C ATOM 1090 C ARG A 69 -6.887 10.044 4.032 1.00 0.00 C ATOM 1091 O ARG A 69 -7.778 9.567 3.361 1.00 0.00 O ATOM 1092 CB ARG A 69 -7.509 12.243 2.997 1.00 0.00 C ATOM 1093 CG ARG A 69 -7.301 13.757 3.073 1.00 0.00 C ATOM 1094 CD ARG A 69 -8.165 14.458 2.019 1.00 0.00 C ATOM 1095 NE ARG A 69 -7.804 13.993 0.636 1.00 0.00 N ATOM 1096 CZ ARG A 69 -6.598 14.117 0.147 1.00 0.00 C ATOM 1097 NH1 ARG A 69 -5.674 14.771 0.794 1.00 0.00 N ATOM 1098 NH2 ARG A 69 -6.329 13.621 -1.029 1.00 0.00 N ATOM 0 H ARG A 69 -4.764 12.383 4.613 1.00 0.00 H new ATOM 0 HA ARG A 69 -6.944 11.935 5.055 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -7.232 11.876 2.009 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -8.562 12.001 3.144 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -7.561 14.119 4.068 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -6.250 13.997 2.912 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -9.218 14.255 2.212 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -8.030 15.537 2.091 1.00 0.00 H new ATOM 0 HE ARG A 69 -8.527 13.565 0.058 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -5.887 15.196 1.697 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -4.738 14.858 0.398 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -7.057 13.141 -1.559 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -5.391 13.713 -1.419 1.00 0.00 H new ATOM 1112 N ASP A 70 -6.101 9.285 4.756 1.00 0.00 N ATOM 1113 CA ASP A 70 -6.283 7.797 4.774 1.00 0.00 C ATOM 1114 C ASP A 70 -6.012 7.262 6.184 1.00 0.00 C ATOM 1115 O ASP A 70 -5.460 7.946 7.023 1.00 0.00 O ATOM 1116 CB ASP A 70 -5.310 7.135 3.792 1.00 0.00 C ATOM 1117 CG ASP A 70 -5.771 7.384 2.354 1.00 0.00 C ATOM 1118 OD1 ASP A 70 -6.928 7.722 2.173 1.00 0.00 O ATOM 1119 OD2 ASP A 70 -4.962 7.220 1.458 1.00 0.00 O ATOM 0 H ASP A 70 -5.338 9.632 5.338 1.00 0.00 H new ATOM 0 HA ASP A 70 -7.307 7.565 4.480 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -4.306 7.535 3.936 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -5.257 6.064 3.986 1.00 0.00 H new ATOM 1124 N ASN A 71 -6.399 6.040 6.449 1.00 0.00 N ATOM 1125 CA ASN A 71 -6.166 5.448 7.802 1.00 0.00 C ATOM 1126 C ASN A 71 -4.842 4.683 7.801 1.00 0.00 C ATOM 1127 O ASN A 71 -4.527 3.977 8.738 1.00 0.00 O ATOM 1128 CB ASN A 71 -7.300 4.475 8.138 1.00 0.00 C ATOM 1129 CG ASN A 71 -8.597 5.254 8.344 1.00 0.00 C ATOM 1130 OD1 ASN A 71 -9.631 4.888 7.819 1.00 0.00 O ATOM 1131 ND2 ASN A 71 -8.587 6.319 9.094 1.00 0.00 N ATOM 0 H ASN A 71 -6.868 5.425 5.784 1.00 0.00 H new ATOM 0 HA ASN A 71 -6.133 6.247 8.543 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -7.423 3.751 7.332 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -7.055 3.912 9.038 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -9.447 6.847 9.242 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -7.719 6.625 9.534 1.00 0.00 H new ATOM 1138 N SER A 72 -4.066 4.811 6.752 1.00 0.00 N ATOM 1139 CA SER A 72 -2.758 4.084 6.677 1.00 0.00 C ATOM 1140 C SER A 72 -1.649 5.032 6.200 1.00 0.00 C ATOM 1141 O SER A 72 -1.169 4.910 5.090 1.00 0.00 O ATOM 1142 CB SER A 72 -2.889 2.928 5.684 1.00 0.00 C ATOM 1143 OG SER A 72 -3.907 2.041 6.129 1.00 0.00 O ATOM 0 H SER A 72 -4.283 5.390 5.941 1.00 0.00 H new ATOM 0 HA SER A 72 -2.501 3.707 7.667 1.00 0.00 H new ATOM 0 HB2 SER A 72 -3.132 3.311 4.693 1.00 0.00 H new ATOM 0 HB3 SER A 72 -1.941 2.398 5.598 1.00 0.00 H new ATOM 0 HG SER A 72 -3.995 1.300 5.494 1.00 0.00 H new ATOM 1149 N PRO A 73 -1.230 5.964 7.026 1.00 0.00 N ATOM 1150 CA PRO A 73 -0.149 6.908 6.628 1.00 0.00 C ATOM 1151 C PRO A 73 1.199 6.186 6.463 1.00 0.00 C ATOM 1152 O PRO A 73 1.453 5.173 7.084 1.00 0.00 O ATOM 1153 CB PRO A 73 -0.124 7.913 7.800 1.00 0.00 C ATOM 1154 CG PRO A 73 -1.123 7.437 8.879 1.00 0.00 C ATOM 1155 CD PRO A 73 -1.798 6.141 8.390 1.00 0.00 C ATOM 0 HA PRO A 73 -0.324 7.383 5.663 1.00 0.00 H new ATOM 0 HB2 PRO A 73 0.880 7.982 8.218 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -0.392 8.910 7.450 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -0.605 7.261 9.822 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -1.872 8.206 9.066 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -1.565 5.295 9.037 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -2.884 6.235 8.366 1.00 0.00 H new ATOM 1163 N PHE A 74 2.057 6.698 5.625 1.00 0.00 N ATOM 1164 CA PHE A 74 3.377 6.039 5.413 1.00 0.00 C ATOM 1165 C PHE A 74 4.308 6.346 6.591 1.00 0.00 C ATOM 1166 O PHE A 74 4.241 7.402 7.188 1.00 0.00 O ATOM 1167 CB PHE A 74 3.991 6.568 4.116 1.00 0.00 C ATOM 1168 CG PHE A 74 3.178 6.073 2.948 1.00 0.00 C ATOM 1169 CD1 PHE A 74 2.076 6.813 2.503 1.00 0.00 C ATOM 1170 CD2 PHE A 74 3.519 4.873 2.313 1.00 0.00 C ATOM 1171 CE1 PHE A 74 1.317 6.355 1.421 1.00 0.00 C ATOM 1172 CE2 PHE A 74 2.760 4.415 1.230 1.00 0.00 C ATOM 1173 CZ PHE A 74 1.659 5.157 0.784 1.00 0.00 C ATOM 0 H PHE A 74 1.902 7.544 5.077 1.00 0.00 H new ATOM 0 HA PHE A 74 3.242 4.960 5.344 1.00 0.00 H new ATOM 0 HB2 PHE A 74 4.010 7.658 4.126 1.00 0.00 H new ATOM 0 HB3 PHE A 74 5.024 6.232 4.025 1.00 0.00 H new ATOM 0 HD1 PHE A 74 1.812 7.737 2.995 1.00 0.00 H new ATOM 0 HD2 PHE A 74 4.367 4.301 2.659 1.00 0.00 H new ATOM 0 HE1 PHE A 74 0.467 6.926 1.077 1.00 0.00 H new ATOM 0 HE2 PHE A 74 3.023 3.490 0.738 1.00 0.00 H new ATOM 0 HZ PHE A 74 1.074 4.804 -0.052 1.00 0.00 H new ATOM 1183 N ASP A 75 5.179 5.423 6.927 1.00 0.00 N ATOM 1184 CA ASP A 75 6.129 5.639 8.065 1.00 0.00 C ATOM 1185 C ASP A 75 7.541 5.817 7.514 1.00 0.00 C ATOM 1186 O ASP A 75 8.369 4.932 7.601 1.00 0.00 O ATOM 1187 CB ASP A 75 6.112 4.417 8.987 1.00 0.00 C ATOM 1188 CG ASP A 75 6.894 4.734 10.264 1.00 0.00 C ATOM 1189 OD1 ASP A 75 7.459 5.812 10.338 1.00 0.00 O ATOM 1190 OD2 ASP A 75 6.912 3.894 11.148 1.00 0.00 O ATOM 0 H ASP A 75 5.273 4.522 6.457 1.00 0.00 H new ATOM 0 HA ASP A 75 5.828 6.526 8.622 1.00 0.00 H new ATOM 0 HB2 ASP A 75 5.085 4.148 9.234 1.00 0.00 H new ATOM 0 HB3 ASP A 75 6.554 3.559 8.480 1.00 0.00 H new ATOM 1195 N GLY A 76 7.824 6.953 6.951 1.00 0.00 N ATOM 1196 CA GLY A 76 9.188 7.187 6.397 1.00 0.00 C ATOM 1197 C GLY A 76 9.502 6.105 5.355 1.00 0.00 C ATOM 1198 O GLY A 76 8.605 5.463 4.846 1.00 0.00 O ATOM 0 H GLY A 76 7.173 7.732 6.849 1.00 0.00 H new ATOM 0 HA2 GLY A 76 9.244 8.175 5.941 1.00 0.00 H new ATOM 0 HA3 GLY A 76 9.928 7.164 7.197 1.00 0.00 H new ATOM 1202 N PRO A 77 10.760 5.893 5.034 1.00 0.00 N ATOM 1203 CA PRO A 77 11.131 4.854 4.031 1.00 0.00 C ATOM 1204 C PRO A 77 10.628 3.458 4.434 1.00 0.00 C ATOM 1205 O PRO A 77 10.581 2.549 3.630 1.00 0.00 O ATOM 1206 CB PRO A 77 12.672 4.929 4.031 1.00 0.00 C ATOM 1207 CG PRO A 77 13.083 6.212 4.775 1.00 0.00 C ATOM 1208 CD PRO A 77 11.891 6.661 5.633 1.00 0.00 C ATOM 0 HA PRO A 77 10.687 5.024 3.050 1.00 0.00 H new ATOM 0 HB2 PRO A 77 13.097 4.052 4.519 1.00 0.00 H new ATOM 0 HB3 PRO A 77 13.053 4.941 3.010 1.00 0.00 H new ATOM 0 HG2 PRO A 77 13.956 6.027 5.401 1.00 0.00 H new ATOM 0 HG3 PRO A 77 13.359 6.993 4.066 1.00 0.00 H new ATOM 0 HD2 PRO A 77 12.034 6.419 6.686 1.00 0.00 H new ATOM 0 HD3 PRO A 77 11.729 7.737 5.572 1.00 0.00 H new ATOM 1216 N GLY A 78 10.251 3.287 5.674 1.00 0.00 N ATOM 1217 CA GLY A 78 9.753 1.955 6.131 1.00 0.00 C ATOM 1218 C GLY A 78 8.242 1.868 5.908 1.00 0.00 C ATOM 1219 O GLY A 78 7.621 2.791 5.421 1.00 0.00 O ATOM 0 H GLY A 78 10.266 4.012 6.391 1.00 0.00 H new ATOM 0 HA2 GLY A 78 10.258 1.159 5.583 1.00 0.00 H new ATOM 0 HA3 GLY A 78 9.984 1.812 7.187 1.00 0.00 H new ATOM 1223 N GLY A 79 7.643 0.763 6.265 1.00 0.00 N ATOM 1224 CA GLY A 79 6.169 0.613 6.080 1.00 0.00 C ATOM 1225 C GLY A 79 5.872 0.111 4.665 1.00 0.00 C ATOM 1226 O GLY A 79 6.745 -0.368 3.969 1.00 0.00 O ATOM 0 H GLY A 79 8.111 -0.044 6.677 1.00 0.00 H new ATOM 0 HA2 GLY A 79 5.770 -0.086 6.815 1.00 0.00 H new ATOM 0 HA3 GLY A 79 5.673 1.569 6.248 1.00 0.00 H new ATOM 1230 N ASN A 80 4.643 0.218 4.237 1.00 0.00 N ATOM 1231 CA ASN A 80 4.286 -0.251 2.869 1.00 0.00 C ATOM 1232 C ASN A 80 4.799 0.755 1.840 1.00 0.00 C ATOM 1233 O ASN A 80 4.868 1.941 2.097 1.00 0.00 O ATOM 1234 CB ASN A 80 2.767 -0.379 2.754 1.00 0.00 C ATOM 1235 CG ASN A 80 2.272 -1.415 3.763 1.00 0.00 C ATOM 1236 OD1 ASN A 80 2.773 -2.620 3.738 1.00 0.00 O flip ATOM 1237 ND2 ASN A 80 1.423 -1.127 4.581 1.00 0.00 N flip ATOM 0 H ASN A 80 3.871 0.610 4.776 1.00 0.00 H new ATOM 0 HA ASN A 80 4.743 -1.223 2.684 1.00 0.00 H new ATOM 0 HB2 ASN A 80 2.294 0.585 2.942 1.00 0.00 H new ATOM 0 HB3 ASN A 80 2.491 -0.678 1.743 1.00 0.00 H new ATOM 0 HD21 ASN A 80 1.032 -0.185 4.600 1.00 0.00 H new ATOM 0 HD22 ASN A 80 1.101 -1.827 5.249 1.00 0.00 H new ATOM 1244 N LEU A 81 5.179 0.287 0.680 1.00 0.00 N ATOM 1245 CA LEU A 81 5.711 1.210 -0.365 1.00 0.00 C ATOM 1246 C LEU A 81 4.582 1.673 -1.289 1.00 0.00 C ATOM 1247 O LEU A 81 4.707 2.662 -1.984 1.00 0.00 O ATOM 1248 CB LEU A 81 6.752 0.460 -1.193 1.00 0.00 C ATOM 1249 CG LEU A 81 7.698 -0.296 -0.261 1.00 0.00 C ATOM 1250 CD1 LEU A 81 8.812 -0.933 -1.092 1.00 0.00 C ATOM 1251 CD2 LEU A 81 8.296 0.668 0.775 1.00 0.00 C ATOM 0 H LEU A 81 5.144 -0.696 0.411 1.00 0.00 H new ATOM 0 HA LEU A 81 6.156 2.081 0.116 1.00 0.00 H new ATOM 0 HB2 LEU A 81 6.259 -0.237 -1.871 1.00 0.00 H new ATOM 0 HB3 LEU A 81 7.315 1.161 -1.810 1.00 0.00 H new ATOM 0 HG LEU A 81 7.148 -1.074 0.268 1.00 0.00 H new ATOM 0 HD11 LEU A 81 9.492 -1.475 -0.435 1.00 0.00 H new ATOM 0 HD12 LEU A 81 8.377 -1.624 -1.814 1.00 0.00 H new ATOM 0 HD13 LEU A 81 9.362 -0.155 -1.621 1.00 0.00 H new ATOM 0 HD21 LEU A 81 8.969 0.121 1.435 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.850 1.455 0.263 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.494 1.114 1.363 1.00 0.00 H new ATOM 1263 N ALA A 82 3.482 0.973 -1.314 1.00 0.00 N ATOM 1264 CA ALA A 82 2.365 1.393 -2.206 1.00 0.00 C ATOM 1265 C ALA A 82 1.115 0.574 -1.886 1.00 0.00 C ATOM 1266 O ALA A 82 1.189 -0.473 -1.274 1.00 0.00 O ATOM 1267 CB ALA A 82 2.767 1.169 -3.664 1.00 0.00 C ATOM 0 H ALA A 82 3.308 0.134 -0.760 1.00 0.00 H new ATOM 0 HA ALA A 82 2.152 2.450 -2.046 1.00 0.00 H new ATOM 0 HB1 ALA A 82 1.951 1.476 -4.318 1.00 0.00 H new ATOM 0 HB2 ALA A 82 3.655 1.759 -3.891 1.00 0.00 H new ATOM 0 HB3 ALA A 82 2.982 0.112 -3.824 1.00 0.00 H new ATOM 1273 N HIS A 83 -0.034 1.041 -2.295 1.00 0.00 N ATOM 1274 CA HIS A 83 -1.285 0.286 -2.010 1.00 0.00 C ATOM 1275 C HIS A 83 -2.416 0.805 -2.903 1.00 0.00 C ATOM 1276 O HIS A 83 -2.225 1.698 -3.704 1.00 0.00 O ATOM 1277 CB HIS A 83 -1.661 0.458 -0.536 1.00 0.00 C ATOM 1278 CG HIS A 83 -1.949 1.908 -0.241 1.00 0.00 C ATOM 1279 ND1 HIS A 83 -3.042 2.301 0.516 1.00 0.00 N ATOM 1280 CD2 HIS A 83 -1.297 3.069 -0.586 1.00 0.00 C ATOM 1281 CE1 HIS A 83 -3.017 3.643 0.601 1.00 0.00 C ATOM 1282 NE2 HIS A 83 -1.975 4.162 -0.053 1.00 0.00 N ATOM 0 H HIS A 83 -0.159 1.911 -2.813 1.00 0.00 H new ATOM 0 HA HIS A 83 -1.126 -0.772 -2.218 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -2.535 -0.149 -0.302 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -0.848 0.104 0.098 1.00 0.00 H new ATOM 0 HD1 HIS A 83 -3.739 1.684 0.933 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -0.397 3.124 -1.180 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -3.751 4.230 1.134 1.00 0.00 H new ATOM 1290 N ALA A 84 -3.592 0.247 -2.775 1.00 0.00 N ATOM 1291 CA ALA A 84 -4.735 0.698 -3.620 1.00 0.00 C ATOM 1292 C ALA A 84 -6.044 0.197 -3.003 1.00 0.00 C ATOM 1293 O ALA A 84 -6.040 -0.634 -2.118 1.00 0.00 O ATOM 1294 CB ALA A 84 -4.587 0.117 -5.026 1.00 0.00 C ATOM 0 H ALA A 84 -3.809 -0.504 -2.119 1.00 0.00 H new ATOM 0 HA ALA A 84 -4.744 1.787 -3.674 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -5.422 0.446 -5.645 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -3.651 0.462 -5.466 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -4.582 -0.972 -4.971 1.00 0.00 H new ATOM 1300 N PHE A 85 -7.164 0.700 -3.458 1.00 0.00 N ATOM 1301 CA PHE A 85 -8.478 0.259 -2.895 1.00 0.00 C ATOM 1302 C PHE A 85 -9.134 -0.749 -3.840 1.00 0.00 C ATOM 1303 O PHE A 85 -9.171 -0.560 -5.040 1.00 0.00 O ATOM 1304 CB PHE A 85 -9.397 1.473 -2.744 1.00 0.00 C ATOM 1305 CG PHE A 85 -8.895 2.351 -1.622 1.00 0.00 C ATOM 1306 CD1 PHE A 85 -9.274 2.077 -0.302 1.00 0.00 C ATOM 1307 CD2 PHE A 85 -8.053 3.436 -1.896 1.00 0.00 C ATOM 1308 CE1 PHE A 85 -8.812 2.886 0.743 1.00 0.00 C ATOM 1309 CE2 PHE A 85 -7.591 4.246 -0.850 1.00 0.00 C ATOM 1310 CZ PHE A 85 -7.970 3.970 0.469 1.00 0.00 C ATOM 0 H PHE A 85 -7.226 1.400 -4.198 1.00 0.00 H new ATOM 0 HA PHE A 85 -8.314 -0.207 -1.923 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -9.427 2.038 -3.676 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -10.416 1.147 -2.536 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -9.923 1.241 -0.090 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -7.760 3.648 -2.913 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -9.105 2.674 1.761 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -6.942 5.083 -1.061 1.00 0.00 H new ATOM 0 HZ PHE A 85 -7.613 4.593 1.275 1.00 0.00 H new ATOM 1320 N GLN A 86 -9.659 -1.818 -3.305 1.00 0.00 N ATOM 1321 CA GLN A 86 -10.320 -2.837 -4.167 1.00 0.00 C ATOM 1322 C GLN A 86 -11.489 -2.166 -4.913 1.00 0.00 C ATOM 1323 O GLN A 86 -12.077 -1.230 -4.405 1.00 0.00 O ATOM 1324 CB GLN A 86 -10.847 -3.971 -3.277 1.00 0.00 C ATOM 1325 CG GLN A 86 -9.668 -4.789 -2.735 1.00 0.00 C ATOM 1326 CD GLN A 86 -10.124 -5.618 -1.531 1.00 0.00 C ATOM 1327 OE1 GLN A 86 -10.858 -5.057 -0.608 1.00 0.00 O flip ATOM 1328 NE2 GLN A 86 -9.805 -6.786 -1.426 1.00 0.00 N flip ATOM 0 H GLN A 86 -9.658 -2.029 -2.307 1.00 0.00 H new ATOM 0 HA GLN A 86 -9.614 -3.245 -4.890 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -11.427 -3.559 -2.451 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -11.517 -4.614 -3.848 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -9.280 -5.445 -3.514 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -8.855 -4.124 -2.444 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -9.232 -7.225 -2.147 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -10.111 -7.327 -0.617 1.00 0.00 H new ATOM 1337 N PRO A 87 -11.835 -2.617 -6.104 1.00 0.00 N ATOM 1338 CA PRO A 87 -12.957 -1.991 -6.858 1.00 0.00 C ATOM 1339 C PRO A 87 -14.151 -1.665 -5.949 1.00 0.00 C ATOM 1340 O PRO A 87 -14.711 -2.533 -5.310 1.00 0.00 O ATOM 1341 CB PRO A 87 -13.295 -3.080 -7.889 1.00 0.00 C ATOM 1342 CG PRO A 87 -12.093 -4.045 -7.974 1.00 0.00 C ATOM 1343 CD PRO A 87 -11.158 -3.761 -6.779 1.00 0.00 C ATOM 0 HA PRO A 87 -12.701 -1.031 -7.306 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -14.196 -3.618 -7.594 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -13.495 -2.634 -8.863 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -12.435 -5.080 -7.951 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -11.560 -3.906 -8.915 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -11.067 -4.625 -6.120 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -10.151 -3.502 -7.105 1.00 0.00 H new ATOM 1351 N GLY A 88 -14.536 -0.417 -5.881 1.00 0.00 N ATOM 1352 CA GLY A 88 -15.683 -0.038 -5.007 1.00 0.00 C ATOM 1353 C GLY A 88 -16.290 1.289 -5.488 1.00 0.00 C ATOM 1354 O GLY A 88 -15.974 1.766 -6.561 1.00 0.00 O ATOM 0 H GLY A 88 -14.106 0.354 -6.392 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -16.440 -0.822 -5.025 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -15.348 0.058 -3.974 1.00 0.00 H new ATOM 1358 N PRO A 89 -17.169 1.877 -4.706 1.00 0.00 N ATOM 1359 CA PRO A 89 -17.828 3.159 -5.096 1.00 0.00 C ATOM 1360 C PRO A 89 -16.918 4.392 -4.935 1.00 0.00 C ATOM 1361 O PRO A 89 -16.518 4.745 -3.843 1.00 0.00 O ATOM 1362 CB PRO A 89 -19.011 3.213 -4.111 1.00 0.00 C ATOM 1363 CG PRO A 89 -18.697 2.263 -2.940 1.00 0.00 C ATOM 1364 CD PRO A 89 -17.573 1.309 -3.386 1.00 0.00 C ATOM 0 HA PRO A 89 -18.105 3.183 -6.150 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -19.159 4.230 -3.748 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -19.934 2.914 -4.607 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -18.389 2.830 -2.062 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -19.586 1.699 -2.659 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -16.744 1.300 -2.678 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -17.926 0.282 -3.477 1.00 0.00 H new ATOM 1372 N GLY A 90 -16.623 5.065 -6.016 1.00 0.00 N ATOM 1373 CA GLY A 90 -15.777 6.294 -5.934 1.00 0.00 C ATOM 1374 C GLY A 90 -14.302 5.945 -5.714 1.00 0.00 C ATOM 1375 O GLY A 90 -13.634 5.431 -6.591 1.00 0.00 O ATOM 0 H GLY A 90 -16.932 4.816 -6.956 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -15.882 6.872 -6.852 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -16.128 6.925 -5.118 1.00 0.00 H new ATOM 1379 N ILE A 91 -13.784 6.258 -4.555 1.00 0.00 N ATOM 1380 CA ILE A 91 -12.344 5.989 -4.268 1.00 0.00 C ATOM 1381 C ILE A 91 -11.986 4.539 -4.590 1.00 0.00 C ATOM 1382 O ILE A 91 -10.828 4.181 -4.659 1.00 0.00 O ATOM 1383 CB ILE A 91 -12.061 6.261 -2.791 1.00 0.00 C ATOM 1384 CG1 ILE A 91 -10.563 6.083 -2.522 1.00 0.00 C ATOM 1385 CG2 ILE A 91 -12.860 5.282 -1.927 1.00 0.00 C ATOM 1386 CD1 ILE A 91 -10.209 6.695 -1.166 1.00 0.00 C ATOM 0 H ILE A 91 -14.301 6.691 -3.790 1.00 0.00 H new ATOM 0 HA ILE A 91 -11.739 6.645 -4.894 1.00 0.00 H new ATOM 0 HB ILE A 91 -12.356 7.281 -2.544 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -10.305 5.024 -2.533 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -9.982 6.561 -3.311 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -12.657 5.477 -0.874 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -13.925 5.411 -2.121 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -12.568 4.260 -2.170 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -9.143 6.567 -0.976 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -10.452 7.758 -1.172 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -10.779 6.197 -0.382 1.00 0.00 H new ATOM 1398 N GLY A 92 -12.959 3.702 -4.783 1.00 0.00 N ATOM 1399 CA GLY A 92 -12.652 2.278 -5.094 1.00 0.00 C ATOM 1400 C GLY A 92 -11.826 2.191 -6.382 1.00 0.00 C ATOM 1401 O GLY A 92 -12.149 2.803 -7.380 1.00 0.00 O ATOM 0 H GLY A 92 -13.951 3.937 -4.740 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -12.102 1.827 -4.268 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -13.578 1.714 -5.207 1.00 0.00 H new ATOM 1405 N GLY A 93 -10.768 1.419 -6.366 1.00 0.00 N ATOM 1406 CA GLY A 93 -9.917 1.265 -7.588 1.00 0.00 C ATOM 1407 C GLY A 93 -8.801 2.319 -7.618 1.00 0.00 C ATOM 1408 O GLY A 93 -7.912 2.259 -8.444 1.00 0.00 O ATOM 0 H GLY A 93 -10.455 0.886 -5.555 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -9.480 0.267 -7.608 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -10.536 1.360 -8.481 1.00 0.00 H new ATOM 1412 N ASP A 94 -8.833 3.287 -6.740 1.00 0.00 N ATOM 1413 CA ASP A 94 -7.763 4.334 -6.751 1.00 0.00 C ATOM 1414 C ASP A 94 -6.402 3.714 -6.398 1.00 0.00 C ATOM 1415 O ASP A 94 -6.260 3.028 -5.407 1.00 0.00 O ATOM 1416 CB ASP A 94 -8.093 5.428 -5.725 1.00 0.00 C ATOM 1417 CG ASP A 94 -9.176 6.360 -6.276 1.00 0.00 C ATOM 1418 OD1 ASP A 94 -9.544 6.201 -7.427 1.00 0.00 O ATOM 1419 OD2 ASP A 94 -9.603 7.232 -5.538 1.00 0.00 O ATOM 0 H ASP A 94 -9.547 3.400 -6.020 1.00 0.00 H new ATOM 0 HA ASP A 94 -7.714 4.765 -7.751 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -8.433 4.973 -4.794 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -7.195 6.000 -5.491 1.00 0.00 H new ATOM 1424 N ALA A 95 -5.395 3.975 -7.196 1.00 0.00 N ATOM 1425 CA ALA A 95 -4.030 3.430 -6.907 1.00 0.00 C ATOM 1426 C ALA A 95 -3.178 4.529 -6.263 1.00 0.00 C ATOM 1427 O ALA A 95 -3.083 5.629 -6.775 1.00 0.00 O ATOM 1428 CB ALA A 95 -3.372 2.980 -8.211 1.00 0.00 C ATOM 0 H ALA A 95 -5.460 4.545 -8.039 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.111 2.579 -6.230 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -2.379 2.584 -8.000 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -3.980 2.205 -8.677 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.287 3.830 -8.888 1.00 0.00 H new ATOM 1434 N HIS A 96 -2.553 4.236 -5.148 1.00 0.00 N ATOM 1435 CA HIS A 96 -1.694 5.253 -4.456 1.00 0.00 C ATOM 1436 C HIS A 96 -0.237 4.775 -4.473 1.00 0.00 C ATOM 1437 O HIS A 96 0.048 3.638 -4.154 1.00 0.00 O ATOM 1438 CB HIS A 96 -2.148 5.390 -2.999 1.00 0.00 C ATOM 1439 CG HIS A 96 -3.445 6.150 -2.922 1.00 0.00 C ATOM 1440 ND1 HIS A 96 -3.785 6.540 -1.637 1.00 0.00 N ATOM 1441 CD2 HIS A 96 -4.412 6.565 -3.802 1.00 0.00 C ATOM 1442 CE1 HIS A 96 -4.950 7.183 -1.755 1.00 0.00 C ATOM 1443 NE2 HIS A 96 -5.368 7.224 -3.033 1.00 0.00 N ATOM 0 H HIS A 96 -2.601 3.329 -4.683 1.00 0.00 H new ATOM 0 HA HIS A 96 -1.781 6.212 -4.966 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -2.271 4.402 -2.556 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -1.382 5.906 -2.420 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -4.429 6.412 -4.871 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -5.490 7.617 -0.926 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -6.226 7.657 -3.375 1.00 0.00 H new ATOM 1451 N PHE A 97 0.689 5.638 -4.832 1.00 0.00 N ATOM 1452 CA PHE A 97 2.141 5.244 -4.861 1.00 0.00 C ATOM 1453 C PHE A 97 2.922 6.108 -3.863 1.00 0.00 C ATOM 1454 O PHE A 97 2.786 7.317 -3.836 1.00 0.00 O ATOM 1455 CB PHE A 97 2.703 5.467 -6.270 1.00 0.00 C ATOM 1456 CG PHE A 97 2.131 4.435 -7.214 1.00 0.00 C ATOM 1457 CD1 PHE A 97 0.874 4.638 -7.793 1.00 0.00 C ATOM 1458 CD2 PHE A 97 2.856 3.273 -7.506 1.00 0.00 C ATOM 1459 CE1 PHE A 97 0.340 3.676 -8.664 1.00 0.00 C ATOM 1460 CE2 PHE A 97 2.325 2.314 -8.378 1.00 0.00 C ATOM 1461 CZ PHE A 97 1.066 2.515 -8.955 1.00 0.00 C ATOM 0 H PHE A 97 0.502 6.602 -5.107 1.00 0.00 H new ATOM 0 HA PHE A 97 2.238 4.192 -4.591 1.00 0.00 H new ATOM 0 HB2 PHE A 97 2.454 6.470 -6.617 1.00 0.00 H new ATOM 0 HB3 PHE A 97 3.791 5.396 -6.254 1.00 0.00 H new ATOM 0 HD1 PHE A 97 0.315 5.535 -7.570 1.00 0.00 H new ATOM 0 HD2 PHE A 97 3.826 3.116 -7.058 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -0.631 3.831 -9.110 1.00 0.00 H new ATOM 0 HE2 PHE A 97 2.887 1.420 -8.605 1.00 0.00 H new ATOM 0 HZ PHE A 97 0.654 1.774 -9.625 1.00 0.00 H new ATOM 1471 N ASP A 98 3.739 5.499 -3.042 1.00 0.00 N ATOM 1472 CA ASP A 98 4.524 6.291 -2.052 1.00 0.00 C ATOM 1473 C ASP A 98 5.504 7.206 -2.791 1.00 0.00 C ATOM 1474 O ASP A 98 6.277 6.766 -3.619 1.00 0.00 O ATOM 1475 CB ASP A 98 5.291 5.346 -1.122 1.00 0.00 C ATOM 1476 CG ASP A 98 5.937 6.157 0.001 1.00 0.00 C ATOM 1477 OD1 ASP A 98 6.232 7.319 -0.228 1.00 0.00 O ATOM 1478 OD2 ASP A 98 6.119 5.605 1.074 1.00 0.00 O ATOM 0 H ASP A 98 3.895 4.491 -3.015 1.00 0.00 H new ATOM 0 HA ASP A 98 3.845 6.900 -1.455 1.00 0.00 H new ATOM 0 HB2 ASP A 98 4.615 4.600 -0.705 1.00 0.00 H new ATOM 0 HB3 ASP A 98 6.055 4.806 -1.682 1.00 0.00 H new ATOM 1483 N GLU A 99 5.465 8.483 -2.507 1.00 0.00 N ATOM 1484 CA GLU A 99 6.377 9.446 -3.197 1.00 0.00 C ATOM 1485 C GLU A 99 7.568 9.783 -2.292 1.00 0.00 C ATOM 1486 O GLU A 99 8.429 10.561 -2.651 1.00 0.00 O ATOM 1487 CB GLU A 99 5.588 10.716 -3.507 1.00 0.00 C ATOM 1488 CG GLU A 99 6.355 11.592 -4.499 1.00 0.00 C ATOM 1489 CD GLU A 99 5.435 12.705 -4.998 1.00 0.00 C ATOM 1490 OE1 GLU A 99 4.249 12.635 -4.718 1.00 0.00 O ATOM 1491 OE2 GLU A 99 5.928 13.605 -5.657 1.00 0.00 O ATOM 0 H GLU A 99 4.836 8.903 -1.822 1.00 0.00 H new ATOM 0 HA GLU A 99 6.757 9.004 -4.118 1.00 0.00 H new ATOM 0 HB2 GLU A 99 4.614 10.455 -3.921 1.00 0.00 H new ATOM 0 HB3 GLU A 99 5.405 11.272 -2.587 1.00 0.00 H new ATOM 0 HG2 GLU A 99 7.236 12.019 -4.020 1.00 0.00 H new ATOM 0 HG3 GLU A 99 6.707 10.991 -5.337 1.00 0.00 H new ATOM 1498 N ASP A 100 7.626 9.208 -1.120 1.00 0.00 N ATOM 1499 CA ASP A 100 8.764 9.509 -0.202 1.00 0.00 C ATOM 1500 C ASP A 100 10.027 8.804 -0.699 1.00 0.00 C ATOM 1501 O ASP A 100 11.130 9.179 -0.354 1.00 0.00 O ATOM 1502 CB ASP A 100 8.433 9.023 1.212 1.00 0.00 C ATOM 1503 CG ASP A 100 7.361 9.924 1.825 1.00 0.00 C ATOM 1504 OD1 ASP A 100 7.168 11.014 1.311 1.00 0.00 O ATOM 1505 OD2 ASP A 100 6.757 9.513 2.802 1.00 0.00 O ATOM 0 H ASP A 100 6.939 8.546 -0.760 1.00 0.00 H new ATOM 0 HA ASP A 100 8.932 10.586 -0.184 1.00 0.00 H new ATOM 0 HB2 ASP A 100 8.081 7.992 1.180 1.00 0.00 H new ATOM 0 HB3 ASP A 100 9.330 9.035 1.831 1.00 0.00 H new ATOM 1510 N GLU A 101 9.879 7.793 -1.516 1.00 0.00 N ATOM 1511 CA GLU A 101 11.077 7.069 -2.047 1.00 0.00 C ATOM 1512 C GLU A 101 11.386 7.579 -3.455 1.00 0.00 C ATOM 1513 O GLU A 101 10.534 8.131 -4.125 1.00 0.00 O ATOM 1514 CB GLU A 101 10.788 5.567 -2.105 1.00 0.00 C ATOM 1515 CG GLU A 101 10.714 5.007 -0.685 1.00 0.00 C ATOM 1516 CD GLU A 101 10.425 3.507 -0.741 1.00 0.00 C ATOM 1517 OE1 GLU A 101 10.146 3.015 -1.824 1.00 0.00 O ATOM 1518 OE2 GLU A 101 10.490 2.875 0.300 1.00 0.00 O ATOM 0 H GLU A 101 8.980 7.436 -1.840 1.00 0.00 H new ATOM 0 HA GLU A 101 11.930 7.247 -1.392 1.00 0.00 H new ATOM 0 HB2 GLU A 101 9.849 5.387 -2.628 1.00 0.00 H new ATOM 0 HB3 GLU A 101 11.570 5.057 -2.668 1.00 0.00 H new ATOM 0 HG2 GLU A 101 11.653 5.188 -0.162 1.00 0.00 H new ATOM 0 HG3 GLU A 101 9.933 5.518 -0.122 1.00 0.00 H new ATOM 1525 N ARG A 102 12.601 7.407 -3.911 1.00 0.00 N ATOM 1526 CA ARG A 102 12.962 7.892 -5.276 1.00 0.00 C ATOM 1527 C ARG A 102 12.638 6.807 -6.304 1.00 0.00 C ATOM 1528 O ARG A 102 13.220 5.740 -6.306 1.00 0.00 O ATOM 1529 CB ARG A 102 14.455 8.214 -5.322 1.00 0.00 C ATOM 1530 CG ARG A 102 14.779 8.889 -6.653 1.00 0.00 C ATOM 1531 CD ARG A 102 16.270 9.224 -6.707 1.00 0.00 C ATOM 1532 NE ARG A 102 16.516 10.222 -7.799 1.00 0.00 N ATOM 1533 CZ ARG A 102 16.133 10.002 -9.030 1.00 0.00 C ATOM 1534 NH1 ARG A 102 15.709 8.824 -9.398 1.00 0.00 N ATOM 1535 NH2 ARG A 102 16.225 10.956 -9.915 1.00 0.00 N ATOM 0 H ARG A 102 13.356 6.953 -3.398 1.00 0.00 H new ATOM 0 HA ARG A 102 12.391 8.791 -5.507 1.00 0.00 H new ATOM 0 HB2 ARG A 102 14.724 8.868 -4.493 1.00 0.00 H new ATOM 0 HB3 ARG A 102 15.040 7.301 -5.211 1.00 0.00 H new ATOM 0 HG2 ARG A 102 14.513 8.231 -7.480 1.00 0.00 H new ATOM 0 HG3 ARG A 102 14.187 9.797 -6.765 1.00 0.00 H new ATOM 0 HD2 ARG A 102 16.598 9.628 -5.749 1.00 0.00 H new ATOM 0 HD3 ARG A 102 16.851 8.320 -6.888 1.00 0.00 H new ATOM 0 HE ARG A 102 16.994 11.095 -7.576 1.00 0.00 H new ATOM 0 HH11 ARG A 102 15.673 8.061 -8.722 1.00 0.00 H new ATOM 0 HH12 ARG A 102 15.413 8.666 -10.361 1.00 0.00 H new ATOM 0 HH21 ARG A 102 16.594 11.868 -9.645 1.00 0.00 H new ATOM 0 HH22 ARG A 102 15.928 10.790 -10.877 1.00 0.00 H new ATOM 1549 N TRP A 103 11.701 7.075 -7.172 1.00 0.00 N ATOM 1550 CA TRP A 103 11.308 6.073 -8.206 1.00 0.00 C ATOM 1551 C TRP A 103 12.164 6.255 -9.464 1.00 0.00 C ATOM 1552 O TRP A 103 12.601 7.345 -9.775 1.00 0.00 O ATOM 1553 CB TRP A 103 9.835 6.279 -8.565 1.00 0.00 C ATOM 1554 CG TRP A 103 8.981 5.976 -7.373 1.00 0.00 C ATOM 1555 CD1 TRP A 103 8.315 6.899 -6.638 1.00 0.00 C ATOM 1556 CD2 TRP A 103 8.690 4.684 -6.764 1.00 0.00 C ATOM 1557 NE1 TRP A 103 7.635 6.254 -5.620 1.00 0.00 N ATOM 1558 CE2 TRP A 103 7.835 4.891 -5.656 1.00 0.00 C ATOM 1559 CE3 TRP A 103 9.081 3.368 -7.061 1.00 0.00 C ATOM 1560 CZ2 TRP A 103 7.383 3.830 -4.872 1.00 0.00 C ATOM 1561 CZ3 TRP A 103 8.628 2.297 -6.274 1.00 0.00 C ATOM 1562 CH2 TRP A 103 7.780 2.528 -5.181 1.00 0.00 C ATOM 0 H TRP A 103 11.185 7.954 -7.210 1.00 0.00 H new ATOM 0 HA TRP A 103 11.461 5.068 -7.812 1.00 0.00 H new ATOM 0 HB2 TRP A 103 9.670 7.306 -8.892 1.00 0.00 H new ATOM 0 HB3 TRP A 103 9.559 5.631 -9.397 1.00 0.00 H new ATOM 0 HD1 TRP A 103 8.315 7.964 -6.817 1.00 0.00 H new ATOM 0 HE1 TRP A 103 7.056 6.729 -4.927 1.00 0.00 H new ATOM 0 HE3 TRP A 103 9.734 3.179 -7.900 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 6.730 4.014 -4.032 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 8.934 1.289 -6.512 1.00 0.00 H new ATOM 0 HH2 TRP A 103 7.435 1.700 -4.580 1.00 0.00 H new ATOM 1573 N THR A 104 12.392 5.188 -10.195 1.00 0.00 N ATOM 1574 CA THR A 104 13.203 5.274 -11.455 1.00 0.00 C ATOM 1575 C THR A 104 12.391 4.671 -12.602 1.00 0.00 C ATOM 1576 O THR A 104 11.425 3.969 -12.384 1.00 0.00 O ATOM 1577 CB THR A 104 14.502 4.472 -11.307 1.00 0.00 C ATOM 1578 OG1 THR A 104 14.202 3.086 -11.282 1.00 0.00 O ATOM 1579 CG2 THR A 104 15.215 4.865 -10.013 1.00 0.00 C ATOM 0 H THR A 104 12.049 4.254 -9.971 1.00 0.00 H new ATOM 0 HA THR A 104 13.443 6.318 -11.654 1.00 0.00 H new ATOM 0 HB THR A 104 15.154 4.689 -12.153 1.00 0.00 H new ATOM 0 HG1 THR A 104 13.370 2.940 -10.785 1.00 0.00 H new ATOM 0 HG21 THR A 104 16.136 4.291 -9.916 1.00 0.00 H new ATOM 0 HG22 THR A 104 15.451 5.929 -10.037 1.00 0.00 H new ATOM 0 HG23 THR A 104 14.566 4.656 -9.162 1.00 0.00 H new ATOM 1587 N ASN A 105 12.785 4.930 -13.823 1.00 0.00 N ATOM 1588 CA ASN A 105 12.052 4.365 -15.001 1.00 0.00 C ATOM 1589 C ASN A 105 12.913 3.278 -15.652 1.00 0.00 C ATOM 1590 O ASN A 105 12.880 3.084 -16.850 1.00 0.00 O ATOM 1591 CB ASN A 105 11.777 5.476 -16.021 1.00 0.00 C ATOM 1592 CG ASN A 105 10.700 6.417 -15.477 1.00 0.00 C ATOM 1593 OD1 ASN A 105 9.817 5.995 -14.757 1.00 0.00 O ATOM 1594 ND2 ASN A 105 10.742 7.688 -15.779 1.00 0.00 N ATOM 0 H ASN A 105 13.589 5.513 -14.058 1.00 0.00 H new ATOM 0 HA ASN A 105 11.105 3.939 -14.671 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.692 6.033 -16.223 1.00 0.00 H new ATOM 0 HB3 ASN A 105 11.452 5.043 -16.967 1.00 0.00 H new ATOM 0 HD21 ASN A 105 10.034 8.323 -15.410 1.00 0.00 H new ATOM 0 HD22 ASN A 105 11.482 8.044 -16.383 1.00 0.00 H new ATOM 1601 N ASN A 106 13.697 2.572 -14.871 1.00 0.00 N ATOM 1602 CA ASN A 106 14.570 1.504 -15.451 1.00 0.00 C ATOM 1603 C ASN A 106 14.783 0.373 -14.430 1.00 0.00 C ATOM 1604 O ASN A 106 14.068 0.260 -13.454 1.00 0.00 O ATOM 1605 CB ASN A 106 15.920 2.111 -15.835 1.00 0.00 C ATOM 1606 CG ASN A 106 16.439 2.967 -14.680 1.00 0.00 C ATOM 1607 OD1 ASN A 106 15.934 2.807 -13.487 1.00 0.00 O flip ATOM 1608 ND2 ASN A 106 17.312 3.791 -14.864 1.00 0.00 N flip ATOM 0 H ASN A 106 13.769 2.689 -13.860 1.00 0.00 H new ATOM 0 HA ASN A 106 14.086 1.089 -16.335 1.00 0.00 H new ATOM 0 HB2 ASN A 106 16.634 1.320 -16.066 1.00 0.00 H new ATOM 0 HB3 ASN A 106 15.815 2.718 -16.734 1.00 0.00 H new ATOM 0 HD21 ASN A 106 17.707 3.916 -15.796 1.00 0.00 H new ATOM 0 HD22 ASN A 106 17.650 4.358 -14.086 1.00 0.00 H new ATOM 1615 N PHE A 107 15.753 -0.475 -14.669 1.00 0.00 N ATOM 1616 CA PHE A 107 16.019 -1.622 -13.742 1.00 0.00 C ATOM 1617 C PHE A 107 16.918 -1.184 -12.576 1.00 0.00 C ATOM 1618 O PHE A 107 17.656 -1.976 -12.024 1.00 0.00 O ATOM 1619 CB PHE A 107 16.721 -2.737 -14.523 1.00 0.00 C ATOM 1620 CG PHE A 107 17.925 -2.169 -15.238 1.00 0.00 C ATOM 1621 CD1 PHE A 107 17.789 -1.641 -16.528 1.00 0.00 C ATOM 1622 CD2 PHE A 107 19.177 -2.163 -14.610 1.00 0.00 C ATOM 1623 CE1 PHE A 107 18.903 -1.110 -17.190 1.00 0.00 C ATOM 1624 CE2 PHE A 107 20.291 -1.631 -15.273 1.00 0.00 C ATOM 1625 CZ PHE A 107 20.154 -1.105 -16.563 1.00 0.00 C ATOM 0 H PHE A 107 16.378 -0.422 -15.473 1.00 0.00 H new ATOM 0 HA PHE A 107 15.071 -1.975 -13.337 1.00 0.00 H new ATOM 0 HB2 PHE A 107 17.029 -3.533 -13.845 1.00 0.00 H new ATOM 0 HB3 PHE A 107 16.033 -3.181 -15.243 1.00 0.00 H new ATOM 0 HD1 PHE A 107 16.824 -1.643 -17.013 1.00 0.00 H new ATOM 0 HD2 PHE A 107 19.284 -2.568 -13.615 1.00 0.00 H new ATOM 0 HE1 PHE A 107 18.797 -0.704 -18.185 1.00 0.00 H new ATOM 0 HE2 PHE A 107 21.256 -1.627 -14.788 1.00 0.00 H new ATOM 0 HZ PHE A 107 21.013 -0.696 -17.074 1.00 0.00 H new ATOM 1635 N ARG A 108 16.869 0.061 -12.196 1.00 0.00 N ATOM 1636 CA ARG A 108 17.730 0.529 -11.070 1.00 0.00 C ATOM 1637 C ARG A 108 17.149 0.075 -9.725 1.00 0.00 C ATOM 1638 O ARG A 108 16.330 -0.821 -9.656 1.00 0.00 O ATOM 1639 CB ARG A 108 17.848 2.055 -11.118 1.00 0.00 C ATOM 1640 CG ARG A 108 18.745 2.447 -12.299 1.00 0.00 C ATOM 1641 CD ARG A 108 18.807 3.970 -12.427 1.00 0.00 C ATOM 1642 NE ARG A 108 19.458 4.548 -11.217 1.00 0.00 N ATOM 1643 CZ ARG A 108 19.876 5.785 -11.226 1.00 0.00 C ATOM 1644 NH1 ARG A 108 19.736 6.514 -12.301 1.00 0.00 N ATOM 1645 NH2 ARG A 108 20.434 6.292 -10.159 1.00 0.00 N ATOM 0 H ARG A 108 16.272 0.775 -12.614 1.00 0.00 H new ATOM 0 HA ARG A 108 18.723 0.092 -11.173 1.00 0.00 H new ATOM 0 HB2 ARG A 108 16.862 2.506 -11.228 1.00 0.00 H new ATOM 0 HB3 ARG A 108 18.268 2.430 -10.185 1.00 0.00 H new ATOM 0 HG2 ARG A 108 19.748 2.045 -12.154 1.00 0.00 H new ATOM 0 HG3 ARG A 108 18.358 2.012 -13.220 1.00 0.00 H new ATOM 0 HD2 ARG A 108 19.366 4.247 -13.321 1.00 0.00 H new ATOM 0 HD3 ARG A 108 17.802 4.377 -12.541 1.00 0.00 H new ATOM 0 HE ARG A 108 19.577 3.976 -10.381 1.00 0.00 H new ATOM 0 HH11 ARG A 108 19.300 6.117 -13.133 1.00 0.00 H new ATOM 0 HH12 ARG A 108 20.063 7.480 -12.308 1.00 0.00 H new ATOM 0 HH21 ARG A 108 20.543 5.722 -9.320 1.00 0.00 H new ATOM 0 HH22 ARG A 108 20.761 7.258 -10.165 1.00 0.00 H new ATOM 1659 N GLU A 109 17.603 0.668 -8.659 1.00 0.00 N ATOM 1660 CA GLU A 109 17.133 0.269 -7.298 1.00 0.00 C ATOM 1661 C GLU A 109 15.613 0.065 -7.264 1.00 0.00 C ATOM 1662 O GLU A 109 15.142 -1.008 -6.941 1.00 0.00 O ATOM 1663 CB GLU A 109 17.513 1.366 -6.305 1.00 0.00 C ATOM 1664 CG GLU A 109 19.037 1.435 -6.184 1.00 0.00 C ATOM 1665 CD GLU A 109 19.423 2.533 -5.191 1.00 0.00 C ATOM 1666 OE1 GLU A 109 18.544 3.276 -4.788 1.00 0.00 O ATOM 1667 OE2 GLU A 109 20.593 2.613 -4.852 1.00 0.00 O ATOM 0 H GLU A 109 18.289 1.423 -8.669 1.00 0.00 H new ATOM 0 HA GLU A 109 17.607 -0.676 -7.033 1.00 0.00 H new ATOM 0 HB2 GLU A 109 17.120 2.326 -6.639 1.00 0.00 H new ATOM 0 HB3 GLU A 109 17.069 1.160 -5.331 1.00 0.00 H new ATOM 0 HG2 GLU A 109 19.429 0.474 -5.850 1.00 0.00 H new ATOM 0 HG3 GLU A 109 19.481 1.639 -7.158 1.00 0.00 H new ATOM 1674 N TYR A 110 14.841 1.081 -7.572 1.00 0.00 N ATOM 1675 CA TYR A 110 13.346 0.939 -7.534 1.00 0.00 C ATOM 1676 C TYR A 110 12.774 1.125 -8.934 1.00 0.00 C ATOM 1677 O TYR A 110 12.953 2.151 -9.553 1.00 0.00 O ATOM 1678 CB TYR A 110 12.759 2.012 -6.614 1.00 0.00 C ATOM 1679 CG TYR A 110 13.213 1.769 -5.195 1.00 0.00 C ATOM 1680 CD1 TYR A 110 12.456 0.950 -4.349 1.00 0.00 C ATOM 1681 CD2 TYR A 110 14.388 2.365 -4.723 1.00 0.00 C ATOM 1682 CE1 TYR A 110 12.874 0.726 -3.032 1.00 0.00 C ATOM 1683 CE2 TYR A 110 14.806 2.143 -3.406 1.00 0.00 C ATOM 1684 CZ TYR A 110 14.049 1.323 -2.560 1.00 0.00 C ATOM 1685 OH TYR A 110 14.459 1.105 -1.259 1.00 0.00 O ATOM 0 H TYR A 110 15.180 2.003 -7.848 1.00 0.00 H new ATOM 0 HA TYR A 110 13.090 -0.054 -7.163 1.00 0.00 H new ATOM 0 HB2 TYR A 110 13.077 3.001 -6.944 1.00 0.00 H new ATOM 0 HB3 TYR A 110 11.670 1.994 -6.666 1.00 0.00 H new ATOM 0 HD1 TYR A 110 11.549 0.491 -4.713 1.00 0.00 H new ATOM 0 HD2 TYR A 110 14.973 2.997 -5.376 1.00 0.00 H new ATOM 0 HE1 TYR A 110 12.290 0.093 -2.380 1.00 0.00 H new ATOM 0 HE2 TYR A 110 15.712 2.604 -3.042 1.00 0.00 H new ATOM 0 HH TYR A 110 15.294 1.591 -1.093 1.00 0.00 H new ATOM 1695 N ASN A 111 12.071 0.142 -9.432 1.00 0.00 N ATOM 1696 CA ASN A 111 11.465 0.258 -10.791 1.00 0.00 C ATOM 1697 C ASN A 111 9.987 0.620 -10.632 1.00 0.00 C ATOM 1698 O ASN A 111 9.213 -0.133 -10.087 1.00 0.00 O ATOM 1699 CB ASN A 111 11.586 -1.084 -11.517 1.00 0.00 C ATOM 1700 CG ASN A 111 11.227 -0.911 -12.997 1.00 0.00 C ATOM 1701 OD1 ASN A 111 11.064 0.289 -13.489 1.00 0.00 O flip ATOM 1702 ND2 ASN A 111 11.091 -1.881 -13.715 1.00 0.00 N flip ATOM 0 H ASN A 111 11.890 -0.740 -8.953 1.00 0.00 H new ATOM 0 HA ASN A 111 11.979 1.026 -11.369 1.00 0.00 H new ATOM 0 HB2 ASN A 111 12.602 -1.468 -11.423 1.00 0.00 H new ATOM 0 HB3 ASN A 111 10.924 -1.817 -11.057 1.00 0.00 H new ATOM 0 HD21 ASN A 111 11.217 -2.819 -13.335 1.00 0.00 H new ATOM 0 HD22 ASN A 111 10.850 -1.758 -14.699 1.00 0.00 H new ATOM 1709 N LEU A 112 9.585 1.767 -11.092 1.00 0.00 N ATOM 1710 CA LEU A 112 8.154 2.161 -10.947 1.00 0.00 C ATOM 1711 C LEU A 112 7.257 1.147 -11.663 1.00 0.00 C ATOM 1712 O LEU A 112 6.187 0.806 -11.197 1.00 0.00 O ATOM 1713 CB LEU A 112 7.949 3.559 -11.543 1.00 0.00 C ATOM 1714 CG LEU A 112 6.478 3.986 -11.412 1.00 0.00 C ATOM 1715 CD1 LEU A 112 6.045 3.970 -9.937 1.00 0.00 C ATOM 1716 CD2 LEU A 112 6.321 5.403 -11.978 1.00 0.00 C ATOM 0 H LEU A 112 10.180 2.450 -11.561 1.00 0.00 H new ATOM 0 HA LEU A 112 7.888 2.177 -9.890 1.00 0.00 H new ATOM 0 HB2 LEU A 112 8.590 4.277 -11.031 1.00 0.00 H new ATOM 0 HB3 LEU A 112 8.243 3.561 -12.593 1.00 0.00 H new ATOM 0 HG LEU A 112 5.850 3.289 -11.966 1.00 0.00 H new ATOM 0 HD11 LEU A 112 5.001 4.275 -9.861 1.00 0.00 H new ATOM 0 HD12 LEU A 112 6.159 2.963 -9.535 1.00 0.00 H new ATOM 0 HD13 LEU A 112 6.667 4.661 -9.368 1.00 0.00 H new ATOM 0 HD21 LEU A 112 5.281 5.717 -11.890 1.00 0.00 H new ATOM 0 HD22 LEU A 112 6.956 6.091 -11.419 1.00 0.00 H new ATOM 0 HD23 LEU A 112 6.615 5.410 -13.028 1.00 0.00 H new ATOM 1728 N HIS A 113 7.674 0.692 -12.805 1.00 0.00 N ATOM 1729 CA HIS A 113 6.851 -0.274 -13.585 1.00 0.00 C ATOM 1730 C HIS A 113 6.583 -1.573 -12.805 1.00 0.00 C ATOM 1731 O HIS A 113 5.489 -2.102 -12.851 1.00 0.00 O ATOM 1732 CB HIS A 113 7.587 -0.596 -14.887 1.00 0.00 C ATOM 1733 CG HIS A 113 6.790 -1.577 -15.699 1.00 0.00 C ATOM 1734 ND1 HIS A 113 7.369 -2.345 -16.697 1.00 0.00 N ATOM 1735 CD2 HIS A 113 5.463 -1.926 -15.678 1.00 0.00 C ATOM 1736 CE1 HIS A 113 6.402 -3.109 -17.231 1.00 0.00 C ATOM 1737 NE2 HIS A 113 5.220 -2.896 -16.647 1.00 0.00 N ATOM 0 H HIS A 113 8.560 0.949 -13.240 1.00 0.00 H new ATOM 0 HA HIS A 113 5.883 0.184 -13.787 1.00 0.00 H new ATOM 0 HB2 HIS A 113 7.747 0.318 -15.460 1.00 0.00 H new ATOM 0 HB3 HIS A 113 8.571 -1.009 -14.665 1.00 0.00 H new ATOM 0 HD1 HIS A 113 8.350 -2.332 -16.975 1.00 0.00 H new ATOM 0 HD2 HIS A 113 4.721 -1.512 -15.012 1.00 0.00 H new ATOM 0 HE1 HIS A 113 6.561 -3.811 -18.036 1.00 0.00 H new ATOM 1745 N ARG A 114 7.553 -2.119 -12.114 1.00 0.00 N ATOM 1746 CA ARG A 114 7.286 -3.399 -11.385 1.00 0.00 C ATOM 1747 C ARG A 114 6.159 -3.195 -10.363 1.00 0.00 C ATOM 1748 O ARG A 114 5.295 -4.036 -10.198 1.00 0.00 O ATOM 1749 CB ARG A 114 8.579 -3.908 -10.697 1.00 0.00 C ATOM 1750 CG ARG A 114 8.758 -3.303 -9.295 1.00 0.00 C ATOM 1751 CD ARG A 114 10.104 -3.753 -8.723 1.00 0.00 C ATOM 1752 NE ARG A 114 10.141 -3.470 -7.250 1.00 0.00 N ATOM 1753 CZ ARG A 114 9.963 -2.265 -6.780 1.00 0.00 C ATOM 1754 NH1 ARG A 114 9.934 -1.240 -7.586 1.00 0.00 N ATOM 1755 NH2 ARG A 114 9.862 -2.079 -5.492 1.00 0.00 N ATOM 0 H ARG A 114 8.498 -1.745 -12.023 1.00 0.00 H new ATOM 0 HA ARG A 114 6.967 -4.157 -12.100 1.00 0.00 H new ATOM 0 HB2 ARG A 114 8.547 -4.995 -10.622 1.00 0.00 H new ATOM 0 HB3 ARG A 114 9.442 -3.657 -11.314 1.00 0.00 H new ATOM 0 HG2 ARG A 114 8.716 -2.215 -9.347 1.00 0.00 H new ATOM 0 HG3 ARG A 114 7.946 -3.622 -8.641 1.00 0.00 H new ATOM 0 HD2 ARG A 114 10.250 -4.818 -8.903 1.00 0.00 H new ATOM 0 HD3 ARG A 114 10.918 -3.230 -9.225 1.00 0.00 H new ATOM 0 HE ARG A 114 10.309 -4.238 -6.600 1.00 0.00 H new ATOM 0 HH11 ARG A 114 10.051 -1.377 -8.590 1.00 0.00 H new ATOM 0 HH12 ARG A 114 9.795 -0.301 -7.212 1.00 0.00 H new ATOM 0 HH21 ARG A 114 9.922 -2.874 -4.856 1.00 0.00 H new ATOM 0 HH22 ARG A 114 9.723 -1.139 -5.122 1.00 0.00 H new ATOM 1769 N VAL A 115 6.166 -2.089 -9.674 1.00 0.00 N ATOM 1770 CA VAL A 115 5.103 -1.839 -8.662 1.00 0.00 C ATOM 1771 C VAL A 115 3.776 -1.584 -9.378 1.00 0.00 C ATOM 1772 O VAL A 115 2.732 -2.025 -8.941 1.00 0.00 O ATOM 1773 CB VAL A 115 5.480 -0.629 -7.798 1.00 0.00 C ATOM 1774 CG1 VAL A 115 4.440 -0.432 -6.688 1.00 0.00 C ATOM 1775 CG2 VAL A 115 6.859 -0.866 -7.172 1.00 0.00 C ATOM 0 H VAL A 115 6.861 -1.348 -9.768 1.00 0.00 H new ATOM 0 HA VAL A 115 5.001 -2.710 -8.015 1.00 0.00 H new ATOM 0 HB VAL A 115 5.507 0.265 -8.422 1.00 0.00 H new ATOM 0 HG11 VAL A 115 4.716 0.429 -6.080 1.00 0.00 H new ATOM 0 HG12 VAL A 115 3.460 -0.262 -7.134 1.00 0.00 H new ATOM 0 HG13 VAL A 115 4.404 -1.323 -6.061 1.00 0.00 H new ATOM 0 HG21 VAL A 115 7.132 -0.008 -6.557 1.00 0.00 H new ATOM 0 HG22 VAL A 115 6.828 -1.762 -6.552 1.00 0.00 H new ATOM 0 HG23 VAL A 115 7.599 -0.996 -7.961 1.00 0.00 H new ATOM 1785 N ALA A 116 3.802 -0.874 -10.474 1.00 0.00 N ATOM 1786 CA ALA A 116 2.532 -0.598 -11.203 1.00 0.00 C ATOM 1787 C ALA A 116 1.887 -1.923 -11.623 1.00 0.00 C ATOM 1788 O ALA A 116 0.689 -2.088 -11.538 1.00 0.00 O ATOM 1789 CB ALA A 116 2.825 0.249 -12.444 1.00 0.00 C ATOM 0 H ALA A 116 4.642 -0.476 -10.893 1.00 0.00 H new ATOM 0 HA ALA A 116 1.849 -0.054 -10.550 1.00 0.00 H new ATOM 0 HB1 ALA A 116 1.895 0.450 -12.976 1.00 0.00 H new ATOM 0 HB2 ALA A 116 3.281 1.192 -12.142 1.00 0.00 H new ATOM 0 HB3 ALA A 116 3.508 -0.291 -13.100 1.00 0.00 H new ATOM 1795 N ALA A 117 2.668 -2.875 -12.061 1.00 0.00 N ATOM 1796 CA ALA A 117 2.082 -4.188 -12.465 1.00 0.00 C ATOM 1797 C ALA A 117 1.424 -4.834 -11.246 1.00 0.00 C ATOM 1798 O ALA A 117 0.372 -5.438 -11.338 1.00 0.00 O ATOM 1799 CB ALA A 117 3.182 -5.114 -12.992 1.00 0.00 C ATOM 0 H ALA A 117 3.681 -2.802 -12.156 1.00 0.00 H new ATOM 0 HA ALA A 117 1.344 -4.027 -13.251 1.00 0.00 H new ATOM 0 HB1 ALA A 117 2.745 -6.069 -13.284 1.00 0.00 H new ATOM 0 HB2 ALA A 117 3.661 -4.655 -13.857 1.00 0.00 H new ATOM 0 HB3 ALA A 117 3.924 -5.279 -12.211 1.00 0.00 H new ATOM 1805 N HIS A 118 2.047 -4.723 -10.106 1.00 0.00 N ATOM 1806 CA HIS A 118 1.479 -5.342 -8.875 1.00 0.00 C ATOM 1807 C HIS A 118 0.213 -4.590 -8.441 1.00 0.00 C ATOM 1808 O HIS A 118 -0.812 -5.189 -8.184 1.00 0.00 O ATOM 1809 CB HIS A 118 2.531 -5.258 -7.764 1.00 0.00 C ATOM 1810 CG HIS A 118 2.142 -6.123 -6.592 1.00 0.00 C ATOM 1811 ND1 HIS A 118 3.058 -6.944 -5.955 1.00 0.00 N ATOM 1812 CD2 HIS A 118 0.959 -6.289 -5.913 1.00 0.00 C ATOM 1813 CE1 HIS A 118 2.418 -7.559 -4.943 1.00 0.00 C ATOM 1814 NE2 HIS A 118 1.136 -7.196 -4.873 1.00 0.00 N ATOM 0 H HIS A 118 2.929 -4.228 -9.973 1.00 0.00 H new ATOM 0 HA HIS A 118 1.216 -6.381 -9.072 1.00 0.00 H new ATOM 0 HB2 HIS A 118 3.500 -5.575 -8.150 1.00 0.00 H new ATOM 0 HB3 HIS A 118 2.640 -4.224 -7.438 1.00 0.00 H new ATOM 0 HD1 HIS A 118 4.039 -7.061 -6.207 1.00 0.00 H new ATOM 0 HD2 HIS A 118 0.031 -5.790 -6.151 1.00 0.00 H new ATOM 0 HE1 HIS A 118 2.886 -8.261 -4.269 1.00 0.00 H new ATOM 1822 N GLU A 119 0.264 -3.288 -8.357 1.00 0.00 N ATOM 1823 CA GLU A 119 -0.948 -2.531 -7.927 1.00 0.00 C ATOM 1824 C GLU A 119 -2.103 -2.819 -8.892 1.00 0.00 C ATOM 1825 O GLU A 119 -3.238 -2.985 -8.485 1.00 0.00 O ATOM 1826 CB GLU A 119 -0.639 -1.030 -7.938 1.00 0.00 C ATOM 1827 CG GLU A 119 0.393 -0.708 -6.853 1.00 0.00 C ATOM 1828 CD GLU A 119 -0.227 -0.924 -5.473 1.00 0.00 C ATOM 1829 OE1 GLU A 119 -1.444 -0.924 -5.387 1.00 0.00 O ATOM 1830 OE2 GLU A 119 0.525 -1.089 -4.527 1.00 0.00 O ATOM 0 H GLU A 119 1.085 -2.719 -8.565 1.00 0.00 H new ATOM 0 HA GLU A 119 -1.231 -2.840 -6.921 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -0.258 -0.734 -8.915 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -1.552 -0.460 -7.766 1.00 0.00 H new ATOM 0 HG2 GLU A 119 1.270 -1.344 -6.972 1.00 0.00 H new ATOM 0 HG3 GLU A 119 0.731 0.323 -6.953 1.00 0.00 H new ATOM 1837 N LEU A 120 -1.827 -2.891 -10.164 1.00 0.00 N ATOM 1838 CA LEU A 120 -2.913 -3.179 -11.144 1.00 0.00 C ATOM 1839 C LEU A 120 -3.496 -4.568 -10.876 1.00 0.00 C ATOM 1840 O LEU A 120 -4.690 -4.776 -10.966 1.00 0.00 O ATOM 1841 CB LEU A 120 -2.360 -3.117 -12.571 1.00 0.00 C ATOM 1842 CG LEU A 120 -2.020 -1.666 -12.938 1.00 0.00 C ATOM 1843 CD1 LEU A 120 -1.281 -1.655 -14.277 1.00 0.00 C ATOM 1844 CD2 LEU A 120 -3.306 -0.815 -13.045 1.00 0.00 C ATOM 0 H LEU A 120 -0.899 -2.763 -10.568 1.00 0.00 H new ATOM 0 HA LEU A 120 -3.699 -2.431 -11.034 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -1.469 -3.740 -12.652 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -3.093 -3.516 -13.272 1.00 0.00 H new ATOM 0 HG LEU A 120 -1.390 -1.238 -12.158 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -1.034 -0.628 -14.548 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -0.364 -2.238 -14.191 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -1.917 -2.091 -15.047 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.043 0.210 -13.306 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -3.954 -1.231 -13.816 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.828 -0.823 -12.088 1.00 0.00 H new ATOM 1856 N GLY A 121 -2.666 -5.523 -10.556 1.00 0.00 N ATOM 1857 CA GLY A 121 -3.182 -6.898 -10.293 1.00 0.00 C ATOM 1858 C GLY A 121 -4.185 -6.859 -9.139 1.00 0.00 C ATOM 1859 O GLY A 121 -5.206 -7.518 -9.170 1.00 0.00 O ATOM 0 H GLY A 121 -1.656 -5.412 -10.465 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -3.659 -7.296 -11.189 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -2.356 -7.566 -10.048 1.00 0.00 H new ATOM 1863 N HIS A 122 -3.912 -6.085 -8.126 1.00 0.00 N ATOM 1864 CA HIS A 122 -4.862 -6.002 -6.984 1.00 0.00 C ATOM 1865 C HIS A 122 -6.193 -5.461 -7.499 1.00 0.00 C ATOM 1866 O HIS A 122 -7.254 -5.899 -7.098 1.00 0.00 O ATOM 1867 CB HIS A 122 -4.307 -5.068 -5.906 1.00 0.00 C ATOM 1868 CG HIS A 122 -3.179 -5.752 -5.182 1.00 0.00 C ATOM 1869 ND1 HIS A 122 -3.178 -7.118 -4.935 1.00 0.00 N ATOM 1870 CD2 HIS A 122 -2.014 -5.272 -4.641 1.00 0.00 C ATOM 1871 CE1 HIS A 122 -2.043 -7.408 -4.272 1.00 0.00 C ATOM 1872 NE2 HIS A 122 -1.298 -6.318 -4.066 1.00 0.00 N ATOM 0 H HIS A 122 -3.075 -5.508 -8.040 1.00 0.00 H new ATOM 0 HA HIS A 122 -5.002 -6.991 -6.548 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -3.954 -4.142 -6.359 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -5.095 -4.799 -5.202 1.00 0.00 H new ATOM 0 HD1 HIS A 122 -3.904 -7.781 -5.206 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -1.700 -4.239 -4.658 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -1.768 -8.400 -3.946 1.00 0.00 H new ATOM 1880 N SER A 123 -6.142 -4.512 -8.393 1.00 0.00 N ATOM 1881 CA SER A 123 -7.398 -3.938 -8.949 1.00 0.00 C ATOM 1882 C SER A 123 -8.073 -4.980 -9.843 1.00 0.00 C ATOM 1883 O SER A 123 -9.274 -4.970 -10.029 1.00 0.00 O ATOM 1884 CB SER A 123 -7.067 -2.699 -9.781 1.00 0.00 C ATOM 1885 OG SER A 123 -6.616 -1.660 -8.920 1.00 0.00 O ATOM 0 H SER A 123 -5.281 -4.109 -8.763 1.00 0.00 H new ATOM 0 HA SER A 123 -8.066 -3.661 -8.134 1.00 0.00 H new ATOM 0 HB2 SER A 123 -6.299 -2.936 -10.517 1.00 0.00 H new ATOM 0 HB3 SER A 123 -7.948 -2.372 -10.334 1.00 0.00 H new ATOM 0 HG SER A 123 -6.401 -0.865 -9.451 1.00 0.00 H new ATOM 1891 N LEU A 124 -7.308 -5.882 -10.398 1.00 0.00 N ATOM 1892 CA LEU A 124 -7.903 -6.927 -11.279 1.00 0.00 C ATOM 1893 C LEU A 124 -8.453 -8.067 -10.422 1.00 0.00 C ATOM 1894 O LEU A 124 -9.054 -8.997 -10.923 1.00 0.00 O ATOM 1895 CB LEU A 124 -6.826 -7.479 -12.214 1.00 0.00 C ATOM 1896 CG LEU A 124 -6.425 -6.423 -13.252 1.00 0.00 C ATOM 1897 CD1 LEU A 124 -5.210 -6.931 -14.032 1.00 0.00 C ATOM 1898 CD2 LEU A 124 -7.592 -6.154 -14.227 1.00 0.00 C ATOM 0 H LEU A 124 -6.297 -5.940 -10.279 1.00 0.00 H new ATOM 0 HA LEU A 124 -8.710 -6.487 -11.865 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -5.952 -7.779 -11.635 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -7.196 -8.371 -12.718 1.00 0.00 H new ATOM 0 HG LEU A 124 -6.179 -5.492 -12.741 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -4.917 -6.187 -14.773 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -4.382 -7.104 -13.344 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -5.465 -7.864 -14.535 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -7.291 -5.402 -14.957 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -7.854 -7.077 -14.744 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -8.456 -5.792 -13.669 1.00 0.00 H new ATOM 1910 N GLY A 125 -8.260 -8.004 -9.132 1.00 0.00 N ATOM 1911 CA GLY A 125 -8.779 -9.086 -8.242 1.00 0.00 C ATOM 1912 C GLY A 125 -7.730 -10.191 -8.093 1.00 0.00 C ATOM 1913 O GLY A 125 -8.024 -11.273 -7.625 1.00 0.00 O ATOM 0 H GLY A 125 -7.765 -7.250 -8.655 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -9.028 -8.675 -7.263 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -9.698 -9.500 -8.657 1.00 0.00 H new ATOM 1917 N LEU A 126 -6.508 -9.931 -8.478 1.00 0.00 N ATOM 1918 CA LEU A 126 -5.452 -10.976 -8.341 1.00 0.00 C ATOM 1919 C LEU A 126 -4.948 -10.984 -6.898 1.00 0.00 C ATOM 1920 O LEU A 126 -4.597 -9.960 -6.347 1.00 0.00 O ATOM 1921 CB LEU A 126 -4.284 -10.667 -9.284 1.00 0.00 C ATOM 1922 CG LEU A 126 -4.768 -10.641 -10.740 1.00 0.00 C ATOM 1923 CD1 LEU A 126 -3.588 -10.292 -11.656 1.00 0.00 C ATOM 1924 CD2 LEU A 126 -5.336 -12.015 -11.137 1.00 0.00 C ATOM 0 H LEU A 126 -6.197 -9.046 -8.879 1.00 0.00 H new ATOM 0 HA LEU A 126 -5.869 -11.950 -8.598 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -3.842 -9.705 -9.023 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -3.504 -11.419 -9.166 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.553 -9.892 -10.843 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.925 -10.272 -12.692 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.193 -9.313 -11.384 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -2.806 -11.043 -11.544 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -5.676 -11.983 -12.172 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.560 -12.773 -11.033 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.175 -12.263 -10.487 1.00 0.00 H new ATOM 1936 N SER A 127 -4.915 -12.133 -6.281 1.00 0.00 N ATOM 1937 CA SER A 127 -4.442 -12.217 -4.870 1.00 0.00 C ATOM 1938 C SER A 127 -2.929 -12.415 -4.845 1.00 0.00 C ATOM 1939 O SER A 127 -2.311 -12.682 -5.855 1.00 0.00 O ATOM 1940 CB SER A 127 -5.117 -13.405 -4.187 1.00 0.00 C ATOM 1941 OG SER A 127 -6.510 -13.147 -4.071 1.00 0.00 O ATOM 0 H SER A 127 -5.197 -13.021 -6.695 1.00 0.00 H new ATOM 0 HA SER A 127 -4.694 -11.295 -4.346 1.00 0.00 H new ATOM 0 HB2 SER A 127 -4.950 -14.315 -4.764 1.00 0.00 H new ATOM 0 HB3 SER A 127 -4.682 -13.569 -3.201 1.00 0.00 H new ATOM 0 HG SER A 127 -6.948 -13.907 -3.635 1.00 0.00 H new ATOM 1947 N HIS A 128 -2.328 -12.303 -3.695 1.00 0.00 N ATOM 1948 CA HIS A 128 -0.857 -12.503 -3.609 1.00 0.00 C ATOM 1949 C HIS A 128 -0.542 -13.981 -3.865 1.00 0.00 C ATOM 1950 O HIS A 128 -1.388 -14.836 -3.689 1.00 0.00 O ATOM 1951 CB HIS A 128 -0.366 -12.102 -2.215 1.00 0.00 C ATOM 1952 CG HIS A 128 -0.408 -10.604 -2.077 1.00 0.00 C ATOM 1953 ND1 HIS A 128 -1.356 -9.954 -1.300 1.00 0.00 N ATOM 1954 CD2 HIS A 128 0.379 -9.615 -2.612 1.00 0.00 C ATOM 1955 CE1 HIS A 128 -1.117 -8.632 -1.391 1.00 0.00 C ATOM 1956 NE2 HIS A 128 -0.070 -8.371 -2.179 1.00 0.00 N ATOM 0 H HIS A 128 -2.791 -12.082 -2.813 1.00 0.00 H new ATOM 0 HA HIS A 128 -0.354 -11.886 -4.354 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -0.990 -12.565 -1.451 1.00 0.00 H new ATOM 0 HB3 HIS A 128 0.650 -12.463 -2.058 1.00 0.00 H new ATOM 0 HD1 HIS A 128 -2.098 -10.397 -0.759 1.00 0.00 H new ATOM 0 HD2 HIS A 128 1.220 -9.778 -3.270 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -1.700 -7.875 -0.888 1.00 0.00 H new ATOM 1964 N SER A 129 0.663 -14.290 -4.286 1.00 0.00 N ATOM 1965 CA SER A 129 1.037 -15.718 -4.565 1.00 0.00 C ATOM 1966 C SER A 129 2.297 -16.087 -3.777 1.00 0.00 C ATOM 1967 O SER A 129 3.014 -15.231 -3.296 1.00 0.00 O ATOM 1968 CB SER A 129 1.310 -15.886 -6.059 1.00 0.00 C ATOM 1969 OG SER A 129 1.666 -17.237 -6.322 1.00 0.00 O ATOM 0 H SER A 129 1.408 -13.612 -4.449 1.00 0.00 H new ATOM 0 HA SER A 129 0.218 -16.371 -4.263 1.00 0.00 H new ATOM 0 HB2 SER A 129 0.426 -15.612 -6.635 1.00 0.00 H new ATOM 0 HB3 SER A 129 2.113 -15.219 -6.371 1.00 0.00 H new ATOM 0 HG SER A 129 1.235 -17.534 -7.151 1.00 0.00 H new ATOM 1975 N THR A 130 2.569 -17.363 -3.639 1.00 0.00 N ATOM 1976 CA THR A 130 3.777 -17.813 -2.878 1.00 0.00 C ATOM 1977 C THR A 130 4.855 -18.293 -3.856 1.00 0.00 C ATOM 1978 O THR A 130 5.822 -18.918 -3.469 1.00 0.00 O ATOM 1979 CB THR A 130 3.379 -18.959 -1.944 1.00 0.00 C ATOM 1980 OG1 THR A 130 2.897 -20.052 -2.715 1.00 0.00 O ATOM 1981 CG2 THR A 130 2.281 -18.480 -0.992 1.00 0.00 C ATOM 0 H THR A 130 2.001 -18.117 -4.024 1.00 0.00 H new ATOM 0 HA THR A 130 4.173 -16.983 -2.293 1.00 0.00 H new ATOM 0 HB THR A 130 4.247 -19.278 -1.367 1.00 0.00 H new ATOM 0 HG1 THR A 130 2.644 -20.787 -2.118 1.00 0.00 H new ATOM 0 HG21 THR A 130 1.996 -19.294 -0.326 1.00 0.00 H new ATOM 0 HG22 THR A 130 2.651 -17.642 -0.402 1.00 0.00 H new ATOM 0 HG23 THR A 130 1.412 -18.162 -1.569 1.00 0.00 H new ATOM 1989 N ASP A 131 4.698 -17.998 -5.120 1.00 0.00 N ATOM 1990 CA ASP A 131 5.718 -18.426 -6.127 1.00 0.00 C ATOM 1991 C ASP A 131 6.846 -17.388 -6.163 1.00 0.00 C ATOM 1992 O ASP A 131 6.606 -16.202 -6.243 1.00 0.00 O ATOM 1993 CB ASP A 131 5.065 -18.529 -7.509 1.00 0.00 C ATOM 1994 CG ASP A 131 6.086 -19.045 -8.527 1.00 0.00 C ATOM 1995 OD1 ASP A 131 7.266 -19.019 -8.220 1.00 0.00 O ATOM 1996 OD2 ASP A 131 5.669 -19.458 -9.597 1.00 0.00 O ATOM 0 H ASP A 131 3.907 -17.479 -5.500 1.00 0.00 H new ATOM 0 HA ASP A 131 6.123 -19.400 -5.853 1.00 0.00 H new ATOM 0 HB2 ASP A 131 4.208 -19.201 -7.467 1.00 0.00 H new ATOM 0 HB3 ASP A 131 4.690 -17.553 -7.818 1.00 0.00 H new ATOM 2001 N ILE A 132 8.073 -17.822 -6.089 1.00 0.00 N ATOM 2002 CA ILE A 132 9.209 -16.853 -6.101 1.00 0.00 C ATOM 2003 C ILE A 132 9.198 -16.035 -7.400 1.00 0.00 C ATOM 2004 O ILE A 132 9.504 -14.859 -7.402 1.00 0.00 O ATOM 2005 CB ILE A 132 10.541 -17.612 -5.979 1.00 0.00 C ATOM 2006 CG1 ILE A 132 11.679 -16.613 -5.735 1.00 0.00 C ATOM 2007 CG2 ILE A 132 10.824 -18.395 -7.266 1.00 0.00 C ATOM 2008 CD1 ILE A 132 12.962 -17.368 -5.375 1.00 0.00 C ATOM 0 H ILE A 132 8.340 -18.804 -6.021 1.00 0.00 H new ATOM 0 HA ILE A 132 9.100 -16.174 -5.256 1.00 0.00 H new ATOM 0 HB ILE A 132 10.475 -18.309 -5.144 1.00 0.00 H new ATOM 0 HG12 ILE A 132 11.841 -16.007 -6.626 1.00 0.00 H new ATOM 0 HG13 ILE A 132 11.410 -15.930 -4.929 1.00 0.00 H new ATOM 0 HG21 ILE A 132 11.770 -18.928 -7.167 1.00 0.00 H new ATOM 0 HG22 ILE A 132 10.021 -19.111 -7.441 1.00 0.00 H new ATOM 0 HG23 ILE A 132 10.883 -17.704 -8.107 1.00 0.00 H new ATOM 0 HD11 ILE A 132 13.768 -16.655 -5.203 1.00 0.00 H new ATOM 0 HD12 ILE A 132 12.797 -17.955 -4.471 1.00 0.00 H new ATOM 0 HD13 ILE A 132 13.235 -18.033 -6.195 1.00 0.00 H new ATOM 2020 N GLY A 133 8.874 -16.646 -8.506 1.00 0.00 N ATOM 2021 CA GLY A 133 8.878 -15.899 -9.800 1.00 0.00 C ATOM 2022 C GLY A 133 7.601 -15.064 -9.964 1.00 0.00 C ATOM 2023 O GLY A 133 7.415 -14.407 -10.969 1.00 0.00 O ATOM 0 H GLY A 133 8.607 -17.628 -8.572 1.00 0.00 H new ATOM 0 HA2 GLY A 133 9.750 -15.247 -9.843 1.00 0.00 H new ATOM 0 HA3 GLY A 133 8.965 -16.602 -10.628 1.00 0.00 H new ATOM 2027 N ALA A 134 6.718 -15.071 -9.000 1.00 0.00 N ATOM 2028 CA ALA A 134 5.468 -14.260 -9.141 1.00 0.00 C ATOM 2029 C ALA A 134 5.752 -12.811 -8.739 1.00 0.00 C ATOM 2030 O ALA A 134 6.280 -12.541 -7.679 1.00 0.00 O ATOM 2031 CB ALA A 134 4.365 -14.842 -8.245 1.00 0.00 C ATOM 0 H ALA A 134 6.804 -15.596 -8.130 1.00 0.00 H new ATOM 0 HA ALA A 134 5.134 -14.289 -10.178 1.00 0.00 H new ATOM 0 HB1 ALA A 134 3.458 -14.247 -8.352 1.00 0.00 H new ATOM 0 HB2 ALA A 134 4.161 -15.871 -8.541 1.00 0.00 H new ATOM 0 HB3 ALA A 134 4.692 -14.821 -7.205 1.00 0.00 H new ATOM 2037 N LEU A 135 5.398 -11.875 -9.576 1.00 0.00 N ATOM 2038 CA LEU A 135 5.640 -10.447 -9.238 1.00 0.00 C ATOM 2039 C LEU A 135 4.744 -10.059 -8.064 1.00 0.00 C ATOM 2040 O LEU A 135 5.043 -9.152 -7.312 1.00 0.00 O ATOM 2041 CB LEU A 135 5.288 -9.563 -10.436 1.00 0.00 C ATOM 2042 CG LEU A 135 6.170 -9.916 -11.643 1.00 0.00 C ATOM 2043 CD1 LEU A 135 5.747 -9.059 -12.844 1.00 0.00 C ATOM 2044 CD2 LEU A 135 7.653 -9.653 -11.312 1.00 0.00 C ATOM 0 H LEU A 135 4.952 -12.039 -10.479 1.00 0.00 H new ATOM 0 HA LEU A 135 6.690 -10.310 -8.979 1.00 0.00 H new ATOM 0 HB2 LEU A 135 4.237 -9.693 -10.695 1.00 0.00 H new ATOM 0 HB3 LEU A 135 5.424 -8.514 -10.174 1.00 0.00 H new ATOM 0 HG LEU A 135 6.047 -10.972 -11.883 1.00 0.00 H new ATOM 0 HD11 LEU A 135 6.370 -9.305 -13.704 1.00 0.00 H new ATOM 0 HD12 LEU A 135 4.702 -9.258 -13.083 1.00 0.00 H new ATOM 0 HD13 LEU A 135 5.868 -8.004 -12.599 1.00 0.00 H new ATOM 0 HD21 LEU A 135 8.269 -9.907 -12.175 1.00 0.00 H new ATOM 0 HD22 LEU A 135 7.790 -8.600 -11.066 1.00 0.00 H new ATOM 0 HD23 LEU A 135 7.950 -10.266 -10.461 1.00 0.00 H new ATOM 2056 N MET A 136 3.637 -10.734 -7.913 1.00 0.00 N ATOM 2057 CA MET A 136 2.705 -10.398 -6.803 1.00 0.00 C ATOM 2058 C MET A 136 3.308 -10.854 -5.471 1.00 0.00 C ATOM 2059 O MET A 136 2.647 -11.465 -4.655 1.00 0.00 O ATOM 2060 CB MET A 136 1.369 -11.116 -7.030 1.00 0.00 C ATOM 2061 CG MET A 136 0.797 -10.724 -8.397 1.00 0.00 C ATOM 2062 SD MET A 136 0.502 -8.936 -8.456 1.00 0.00 S ATOM 2063 CE MET A 136 -0.850 -8.870 -7.253 1.00 0.00 C ATOM 0 H MET A 136 3.339 -11.504 -8.512 1.00 0.00 H new ATOM 0 HA MET A 136 2.543 -9.320 -6.776 1.00 0.00 H new ATOM 0 HB2 MET A 136 1.512 -12.195 -6.981 1.00 0.00 H new ATOM 0 HB3 MET A 136 0.665 -10.852 -6.241 1.00 0.00 H new ATOM 0 HG2 MET A 136 1.490 -11.013 -9.187 1.00 0.00 H new ATOM 0 HG3 MET A 136 -0.134 -11.261 -8.578 1.00 0.00 H new ATOM 0 HE1 MET A 136 -1.446 -7.974 -7.424 1.00 0.00 H new ATOM 0 HE2 MET A 136 -1.480 -9.752 -7.365 1.00 0.00 H new ATOM 0 HE3 MET A 136 -0.438 -8.844 -6.244 1.00 0.00 H new ATOM 2073 N TYR A 137 4.562 -10.564 -5.248 1.00 0.00 N ATOM 2074 CA TYR A 137 5.214 -10.986 -3.974 1.00 0.00 C ATOM 2075 C TYR A 137 4.623 -10.156 -2.810 1.00 0.00 C ATOM 2076 O TYR A 137 4.623 -8.944 -2.882 1.00 0.00 O ATOM 2077 CB TYR A 137 6.720 -10.690 -4.078 1.00 0.00 C ATOM 2078 CG TYR A 137 7.493 -11.576 -3.120 1.00 0.00 C ATOM 2079 CD1 TYR A 137 7.355 -11.415 -1.736 1.00 0.00 C ATOM 2080 CD2 TYR A 137 8.348 -12.567 -3.625 1.00 0.00 C ATOM 2081 CE1 TYR A 137 8.069 -12.242 -0.860 1.00 0.00 C ATOM 2082 CE2 TYR A 137 9.061 -13.393 -2.749 1.00 0.00 C ATOM 2083 CZ TYR A 137 8.922 -13.230 -1.365 1.00 0.00 C ATOM 2084 OH TYR A 137 9.623 -14.043 -0.497 1.00 0.00 O ATOM 0 H TYR A 137 5.164 -10.053 -5.894 1.00 0.00 H new ATOM 0 HA TYR A 137 5.046 -12.048 -3.797 1.00 0.00 H new ATOM 0 HB2 TYR A 137 7.062 -10.860 -5.099 1.00 0.00 H new ATOM 0 HB3 TYR A 137 6.909 -9.641 -3.849 1.00 0.00 H new ATOM 0 HD1 TYR A 137 6.698 -10.653 -1.344 1.00 0.00 H new ATOM 0 HD2 TYR A 137 8.456 -12.693 -4.692 1.00 0.00 H new ATOM 0 HE1 TYR A 137 7.961 -12.117 0.207 1.00 0.00 H new ATOM 0 HE2 TYR A 137 9.718 -14.156 -3.140 1.00 0.00 H new ATOM 0 HH TYR A 137 10.168 -14.676 -1.010 1.00 0.00 H new ATOM 2094 N PRO A 138 4.143 -10.755 -1.733 1.00 0.00 N ATOM 2095 CA PRO A 138 3.602 -9.932 -0.614 1.00 0.00 C ATOM 2096 C PRO A 138 4.608 -8.865 -0.153 1.00 0.00 C ATOM 2097 O PRO A 138 4.376 -7.679 -0.282 1.00 0.00 O ATOM 2098 CB PRO A 138 3.344 -10.981 0.485 1.00 0.00 C ATOM 2099 CG PRO A 138 3.448 -12.381 -0.151 1.00 0.00 C ATOM 2100 CD PRO A 138 4.091 -12.237 -1.545 1.00 0.00 C ATOM 0 HA PRO A 138 2.711 -9.367 -0.889 1.00 0.00 H new ATOM 0 HB2 PRO A 138 4.071 -10.874 1.290 1.00 0.00 H new ATOM 0 HB3 PRO A 138 2.357 -10.836 0.925 1.00 0.00 H new ATOM 0 HG2 PRO A 138 4.048 -13.039 0.477 1.00 0.00 H new ATOM 0 HG3 PRO A 138 2.460 -12.834 -0.234 1.00 0.00 H new ATOM 0 HD2 PRO A 138 5.084 -12.685 -1.581 1.00 0.00 H new ATOM 0 HD3 PRO A 138 3.495 -12.722 -2.318 1.00 0.00 H new ATOM 2108 N SER A 139 5.724 -9.286 0.381 1.00 0.00 N ATOM 2109 CA SER A 139 6.753 -8.313 0.853 1.00 0.00 C ATOM 2110 C SER A 139 7.664 -7.917 -0.317 1.00 0.00 C ATOM 2111 O SER A 139 7.633 -8.519 -1.371 1.00 0.00 O ATOM 2112 CB SER A 139 7.592 -8.971 1.952 1.00 0.00 C ATOM 2113 OG SER A 139 8.247 -10.115 1.419 1.00 0.00 O ATOM 0 H SER A 139 5.968 -10.268 0.511 1.00 0.00 H new ATOM 0 HA SER A 139 6.263 -7.421 1.244 1.00 0.00 H new ATOM 0 HB2 SER A 139 8.326 -8.264 2.338 1.00 0.00 H new ATOM 0 HB3 SER A 139 6.956 -9.259 2.789 1.00 0.00 H new ATOM 0 HG SER A 139 7.960 -10.254 0.492 1.00 0.00 H new ATOM 2119 N TYR A 140 8.485 -6.915 -0.139 1.00 0.00 N ATOM 2120 CA TYR A 140 9.406 -6.496 -1.241 1.00 0.00 C ATOM 2121 C TYR A 140 10.679 -7.351 -1.177 1.00 0.00 C ATOM 2122 O TYR A 140 11.228 -7.585 -0.119 1.00 0.00 O ATOM 2123 CB TYR A 140 9.775 -5.012 -1.079 1.00 0.00 C ATOM 2124 CG TYR A 140 10.898 -4.660 -2.031 1.00 0.00 C ATOM 2125 CD1 TYR A 140 10.628 -4.425 -3.384 1.00 0.00 C ATOM 2126 CD2 TYR A 140 12.213 -4.582 -1.557 1.00 0.00 C ATOM 2127 CE1 TYR A 140 11.674 -4.110 -4.261 1.00 0.00 C ATOM 2128 CE2 TYR A 140 13.258 -4.269 -2.434 1.00 0.00 C ATOM 2129 CZ TYR A 140 12.988 -4.032 -3.786 1.00 0.00 C ATOM 2130 OH TYR A 140 14.019 -3.725 -4.651 1.00 0.00 O ATOM 0 H TYR A 140 8.559 -6.369 0.719 1.00 0.00 H new ATOM 0 HA TYR A 140 8.912 -6.635 -2.203 1.00 0.00 H new ATOM 0 HB2 TYR A 140 8.905 -4.387 -1.280 1.00 0.00 H new ATOM 0 HB3 TYR A 140 10.080 -4.813 -0.052 1.00 0.00 H new ATOM 0 HD1 TYR A 140 9.614 -4.486 -3.752 1.00 0.00 H new ATOM 0 HD2 TYR A 140 12.421 -4.764 -0.513 1.00 0.00 H new ATOM 0 HE1 TYR A 140 11.466 -3.927 -5.305 1.00 0.00 H new ATOM 0 HE2 TYR A 140 14.272 -4.210 -2.067 1.00 0.00 H new ATOM 0 HH TYR A 140 14.866 -3.711 -4.158 1.00 0.00 H new ATOM 2140 N THR A 141 11.152 -7.814 -2.304 1.00 0.00 N ATOM 2141 CA THR A 141 12.390 -8.651 -2.319 1.00 0.00 C ATOM 2142 C THR A 141 13.148 -8.389 -3.619 1.00 0.00 C ATOM 2143 O THR A 141 12.626 -7.786 -4.537 1.00 0.00 O ATOM 2144 CB THR A 141 12.010 -10.133 -2.250 1.00 0.00 C ATOM 2145 OG1 THR A 141 11.157 -10.450 -3.340 1.00 0.00 O ATOM 2146 CG2 THR A 141 11.290 -10.425 -0.932 1.00 0.00 C ATOM 0 H THR A 141 10.733 -7.648 -3.219 1.00 0.00 H new ATOM 0 HA THR A 141 13.014 -8.397 -1.462 1.00 0.00 H new ATOM 0 HB THR A 141 12.913 -10.741 -2.304 1.00 0.00 H new ATOM 0 HG1 THR A 141 10.559 -11.184 -3.085 1.00 0.00 H new ATOM 0 HG21 THR A 141 11.023 -11.481 -0.890 1.00 0.00 H new ATOM 0 HG22 THR A 141 11.948 -10.183 -0.097 1.00 0.00 H new ATOM 0 HG23 THR A 141 10.386 -9.819 -0.869 1.00 0.00 H new ATOM 2154 N PHE A 142 14.372 -8.830 -3.711 1.00 0.00 N ATOM 2155 CA PHE A 142 15.145 -8.593 -4.960 1.00 0.00 C ATOM 2156 C PHE A 142 14.373 -9.190 -6.135 1.00 0.00 C ATOM 2157 O PHE A 142 13.826 -10.270 -6.044 1.00 0.00 O ATOM 2158 CB PHE A 142 16.514 -9.271 -4.858 1.00 0.00 C ATOM 2159 CG PHE A 142 17.342 -8.909 -6.068 1.00 0.00 C ATOM 2160 CD1 PHE A 142 17.281 -9.699 -7.224 1.00 0.00 C ATOM 2161 CD2 PHE A 142 18.171 -7.779 -6.037 1.00 0.00 C ATOM 2162 CE1 PHE A 142 18.046 -9.358 -8.346 1.00 0.00 C ATOM 2163 CE2 PHE A 142 18.936 -7.440 -7.160 1.00 0.00 C ATOM 2164 CZ PHE A 142 18.874 -8.229 -8.314 1.00 0.00 C ATOM 0 H PHE A 142 14.867 -9.341 -2.980 1.00 0.00 H new ATOM 0 HA PHE A 142 15.286 -7.522 -5.108 1.00 0.00 H new ATOM 0 HB2 PHE A 142 17.022 -8.954 -3.947 1.00 0.00 H new ATOM 0 HB3 PHE A 142 16.393 -10.353 -4.796 1.00 0.00 H new ATOM 0 HD1 PHE A 142 16.644 -10.571 -7.249 1.00 0.00 H new ATOM 0 HD2 PHE A 142 18.220 -7.170 -5.147 1.00 0.00 H new ATOM 0 HE1 PHE A 142 17.997 -9.966 -9.237 1.00 0.00 H new ATOM 0 HE2 PHE A 142 19.574 -6.569 -7.135 1.00 0.00 H new ATOM 0 HZ PHE A 142 19.464 -7.967 -9.180 1.00 0.00 H new ATOM 2174 N SER A 143 14.316 -8.491 -7.237 1.00 0.00 N ATOM 2175 CA SER A 143 13.570 -9.007 -8.424 1.00 0.00 C ATOM 2176 C SER A 143 14.355 -8.691 -9.699 1.00 0.00 C ATOM 2177 O SER A 143 15.143 -7.767 -9.744 1.00 0.00 O ATOM 2178 CB SER A 143 12.198 -8.332 -8.487 1.00 0.00 C ATOM 2179 OG SER A 143 12.369 -6.928 -8.631 1.00 0.00 O ATOM 0 H SER A 143 14.756 -7.580 -7.368 1.00 0.00 H new ATOM 0 HA SER A 143 13.444 -10.086 -8.337 1.00 0.00 H new ATOM 0 HB2 SER A 143 11.624 -8.727 -9.325 1.00 0.00 H new ATOM 0 HB3 SER A 143 11.631 -8.550 -7.582 1.00 0.00 H new ATOM 0 HG SER A 143 11.547 -6.469 -8.358 1.00 0.00 H new ATOM 2185 N GLY A 144 14.147 -9.457 -10.738 1.00 0.00 N ATOM 2186 CA GLY A 144 14.878 -9.209 -12.017 1.00 0.00 C ATOM 2187 C GLY A 144 14.043 -8.287 -12.908 1.00 0.00 C ATOM 2188 O GLY A 144 13.635 -7.217 -12.501 1.00 0.00 O ATOM 0 H GLY A 144 13.501 -10.246 -10.756 1.00 0.00 H new ATOM 0 HA2 GLY A 144 15.848 -8.755 -11.813 1.00 0.00 H new ATOM 0 HA3 GLY A 144 15.069 -10.152 -12.529 1.00 0.00 H new ATOM 2192 N ASP A 145 13.788 -8.694 -14.122 1.00 0.00 N ATOM 2193 CA ASP A 145 12.981 -7.844 -15.046 1.00 0.00 C ATOM 2194 C ASP A 145 11.492 -8.021 -14.735 1.00 0.00 C ATOM 2195 O ASP A 145 11.088 -8.985 -14.118 1.00 0.00 O ATOM 2196 CB ASP A 145 13.261 -8.262 -16.491 1.00 0.00 C ATOM 2197 CG ASP A 145 14.684 -7.847 -16.866 1.00 0.00 C ATOM 2198 OD1 ASP A 145 15.167 -6.885 -16.292 1.00 0.00 O ATOM 2199 OD2 ASP A 145 15.269 -8.502 -17.715 1.00 0.00 O ATOM 0 H ASP A 145 14.104 -9.580 -14.515 1.00 0.00 H new ATOM 0 HA ASP A 145 13.253 -6.797 -14.912 1.00 0.00 H new ATOM 0 HB2 ASP A 145 13.143 -9.340 -16.600 1.00 0.00 H new ATOM 0 HB3 ASP A 145 12.543 -7.793 -17.164 1.00 0.00 H new ATOM 2204 N VAL A 146 10.672 -7.090 -15.147 1.00 0.00 N ATOM 2205 CA VAL A 146 9.211 -7.203 -14.861 1.00 0.00 C ATOM 2206 C VAL A 146 8.526 -8.024 -15.955 1.00 0.00 C ATOM 2207 O VAL A 146 8.416 -7.598 -17.087 1.00 0.00 O ATOM 2208 CB VAL A 146 8.600 -5.803 -14.826 1.00 0.00 C ATOM 2209 CG1 VAL A 146 7.136 -5.894 -14.396 1.00 0.00 C ATOM 2210 CG2 VAL A 146 9.376 -4.940 -13.830 1.00 0.00 C ATOM 0 H VAL A 146 10.950 -6.258 -15.668 1.00 0.00 H new ATOM 0 HA VAL A 146 9.069 -7.698 -13.900 1.00 0.00 H new ATOM 0 HB VAL A 146 8.655 -5.354 -15.818 1.00 0.00 H new ATOM 0 HG11 VAL A 146 6.701 -4.895 -14.371 1.00 0.00 H new ATOM 0 HG12 VAL A 146 6.586 -6.512 -15.106 1.00 0.00 H new ATOM 0 HG13 VAL A 146 7.075 -6.341 -13.404 1.00 0.00 H new ATOM 0 HG21 VAL A 146 8.944 -3.940 -13.801 1.00 0.00 H new ATOM 0 HG22 VAL A 146 9.319 -5.389 -12.838 1.00 0.00 H new ATOM 0 HG23 VAL A 146 10.419 -4.876 -14.140 1.00 0.00 H new ATOM 2220 N GLN A 147 8.058 -9.201 -15.624 1.00 0.00 N ATOM 2221 CA GLN A 147 7.370 -10.056 -16.640 1.00 0.00 C ATOM 2222 C GLN A 147 6.242 -10.833 -15.958 1.00 0.00 C ATOM 2223 O GLN A 147 6.323 -11.158 -14.790 1.00 0.00 O ATOM 2224 CB GLN A 147 8.373 -11.045 -17.244 1.00 0.00 C ATOM 2225 CG GLN A 147 9.439 -10.283 -18.037 1.00 0.00 C ATOM 2226 CD GLN A 147 10.427 -11.277 -18.649 1.00 0.00 C ATOM 2227 OE1 GLN A 147 10.231 -11.745 -19.752 1.00 0.00 O ATOM 2228 NE2 GLN A 147 11.487 -11.625 -17.971 1.00 0.00 N ATOM 0 H GLN A 147 8.123 -9.608 -14.691 1.00 0.00 H new ATOM 0 HA GLN A 147 6.962 -9.427 -17.431 1.00 0.00 H new ATOM 0 HB2 GLN A 147 8.843 -11.629 -16.453 1.00 0.00 H new ATOM 0 HB3 GLN A 147 7.856 -11.749 -17.896 1.00 0.00 H new ATOM 0 HG2 GLN A 147 8.969 -9.691 -18.822 1.00 0.00 H new ATOM 0 HG3 GLN A 147 9.965 -9.587 -17.384 1.00 0.00 H new ATOM 0 HE21 GLN A 147 11.652 -11.232 -17.044 1.00 0.00 H new ATOM 0 HE22 GLN A 147 12.151 -12.290 -18.368 1.00 0.00 H new ATOM 2237 N LEU A 148 5.194 -11.142 -16.670 1.00 0.00 N ATOM 2238 CA LEU A 148 4.078 -11.904 -16.041 1.00 0.00 C ATOM 2239 C LEU A 148 4.490 -13.368 -15.908 1.00 0.00 C ATOM 2240 O LEU A 148 5.162 -13.915 -16.759 1.00 0.00 O ATOM 2241 CB LEU A 148 2.824 -11.821 -16.913 1.00 0.00 C ATOM 2242 CG LEU A 148 2.472 -10.356 -17.189 1.00 0.00 C ATOM 2243 CD1 LEU A 148 1.221 -10.299 -18.071 1.00 0.00 C ATOM 2244 CD2 LEU A 148 2.209 -9.613 -15.869 1.00 0.00 C ATOM 0 H LEU A 148 5.062 -10.902 -17.653 1.00 0.00 H new ATOM 0 HA LEU A 148 3.863 -11.478 -15.061 1.00 0.00 H new ATOM 0 HB2 LEU A 148 2.990 -12.347 -17.853 1.00 0.00 H new ATOM 0 HB3 LEU A 148 1.991 -12.316 -16.414 1.00 0.00 H new ATOM 0 HG LEU A 148 3.307 -9.876 -17.699 1.00 0.00 H new ATOM 0 HD11 LEU A 148 0.964 -9.259 -18.272 1.00 0.00 H new ATOM 0 HD12 LEU A 148 1.416 -10.813 -19.012 1.00 0.00 H new ATOM 0 HD13 LEU A 148 0.391 -10.785 -17.557 1.00 0.00 H new ATOM 0 HD21 LEU A 148 1.960 -8.573 -16.080 1.00 0.00 H new ATOM 0 HD22 LEU A 148 1.378 -10.086 -15.345 1.00 0.00 H new ATOM 0 HD23 LEU A 148 3.102 -9.653 -15.245 1.00 0.00 H new ATOM 2256 N ALA A 149 4.085 -14.010 -14.850 1.00 0.00 N ATOM 2257 CA ALA A 149 4.440 -15.448 -14.660 1.00 0.00 C ATOM 2258 C ALA A 149 3.277 -16.310 -15.149 1.00 0.00 C ATOM 2259 O ALA A 149 2.173 -15.832 -15.324 1.00 0.00 O ATOM 2260 CB ALA A 149 4.689 -15.720 -13.176 1.00 0.00 C ATOM 0 H ALA A 149 3.521 -13.602 -14.104 1.00 0.00 H new ATOM 0 HA ALA A 149 5.342 -15.686 -15.224 1.00 0.00 H new ATOM 0 HB1 ALA A 149 4.948 -16.770 -13.037 1.00 0.00 H new ATOM 0 HB2 ALA A 149 5.509 -15.094 -12.824 1.00 0.00 H new ATOM 0 HB3 ALA A 149 3.788 -15.491 -12.608 1.00 0.00 H new ATOM 2266 N GLN A 150 3.504 -17.575 -15.372 1.00 0.00 N ATOM 2267 CA GLN A 150 2.397 -18.448 -15.849 1.00 0.00 C ATOM 2268 C GLN A 150 1.276 -18.435 -14.807 1.00 0.00 C ATOM 2269 O GLN A 150 0.109 -18.398 -15.138 1.00 0.00 O ATOM 2270 CB GLN A 150 2.912 -19.880 -16.036 1.00 0.00 C ATOM 2271 CG GLN A 150 1.825 -20.746 -16.683 1.00 0.00 C ATOM 2272 CD GLN A 150 1.562 -20.263 -18.113 1.00 0.00 C ATOM 2273 OE1 GLN A 150 2.484 -20.060 -18.876 1.00 0.00 O ATOM 2274 NE2 GLN A 150 0.334 -20.074 -18.511 1.00 0.00 N ATOM 0 H GLN A 150 4.403 -18.039 -15.245 1.00 0.00 H new ATOM 0 HA GLN A 150 2.020 -18.080 -16.803 1.00 0.00 H new ATOM 0 HB2 GLN A 150 3.805 -19.876 -16.661 1.00 0.00 H new ATOM 0 HB3 GLN A 150 3.199 -20.301 -15.072 1.00 0.00 H new ATOM 0 HG2 GLN A 150 2.137 -21.790 -16.693 1.00 0.00 H new ATOM 0 HG3 GLN A 150 0.908 -20.693 -16.097 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -0.442 -20.244 -17.871 1.00 0.00 H new ATOM 0 HE22 GLN A 150 0.149 -19.756 -19.462 1.00 0.00 H new ATOM 2283 N ASP A 151 1.622 -18.464 -13.549 1.00 0.00 N ATOM 2284 CA ASP A 151 0.577 -18.452 -12.488 1.00 0.00 C ATOM 2285 C ASP A 151 -0.272 -17.180 -12.608 1.00 0.00 C ATOM 2286 O ASP A 151 -1.475 -17.214 -12.442 1.00 0.00 O ATOM 2287 CB ASP A 151 1.245 -18.495 -11.113 1.00 0.00 C ATOM 2288 CG ASP A 151 0.171 -18.532 -10.025 1.00 0.00 C ATOM 2289 OD1 ASP A 151 -0.985 -18.326 -10.355 1.00 0.00 O ATOM 2290 OD2 ASP A 151 0.523 -18.768 -8.880 1.00 0.00 O ATOM 0 H ASP A 151 2.584 -18.495 -13.211 1.00 0.00 H new ATOM 0 HA ASP A 151 -0.066 -19.324 -12.607 1.00 0.00 H new ATOM 0 HB2 ASP A 151 1.886 -19.373 -11.036 1.00 0.00 H new ATOM 0 HB3 ASP A 151 1.883 -17.621 -10.979 1.00 0.00 H new ATOM 2295 N ASP A 152 0.339 -16.057 -12.895 1.00 0.00 N ATOM 2296 CA ASP A 152 -0.448 -14.795 -13.022 1.00 0.00 C ATOM 2297 C ASP A 152 -1.253 -14.821 -14.322 1.00 0.00 C ATOM 2298 O ASP A 152 -2.393 -14.402 -14.367 1.00 0.00 O ATOM 2299 CB ASP A 152 0.501 -13.590 -13.048 1.00 0.00 C ATOM 2300 CG ASP A 152 1.087 -13.358 -11.654 1.00 0.00 C ATOM 2301 OD1 ASP A 152 0.458 -13.767 -10.692 1.00 0.00 O ATOM 2302 OD2 ASP A 152 2.152 -12.766 -11.571 1.00 0.00 O ATOM 0 H ASP A 152 1.343 -15.961 -13.046 1.00 0.00 H new ATOM 0 HA ASP A 152 -1.123 -14.711 -12.170 1.00 0.00 H new ATOM 0 HB2 ASP A 152 1.303 -13.764 -13.765 1.00 0.00 H new ATOM 0 HB3 ASP A 152 -0.035 -12.701 -13.379 1.00 0.00 H new ATOM 2307 N ILE A 153 -0.670 -15.312 -15.379 1.00 0.00 N ATOM 2308 CA ILE A 153 -1.399 -15.363 -16.677 1.00 0.00 C ATOM 2309 C ILE A 153 -2.622 -16.280 -16.548 1.00 0.00 C ATOM 2310 O ILE A 153 -3.722 -15.920 -16.912 1.00 0.00 O ATOM 2311 CB ILE A 153 -0.454 -15.910 -17.748 1.00 0.00 C ATOM 2312 CG1 ILE A 153 0.633 -14.869 -18.029 1.00 0.00 C ATOM 2313 CG2 ILE A 153 -1.237 -16.199 -19.033 1.00 0.00 C ATOM 2314 CD1 ILE A 153 1.738 -15.497 -18.880 1.00 0.00 C ATOM 0 H ILE A 153 0.281 -15.681 -15.401 1.00 0.00 H new ATOM 0 HA ILE A 153 -1.735 -14.364 -16.954 1.00 0.00 H new ATOM 0 HB ILE A 153 0.003 -16.835 -17.397 1.00 0.00 H new ATOM 0 HG12 ILE A 153 0.204 -14.011 -18.547 1.00 0.00 H new ATOM 0 HG13 ILE A 153 1.048 -14.500 -17.091 1.00 0.00 H new ATOM 0 HG21 ILE A 153 -0.559 -16.588 -19.792 1.00 0.00 H new ATOM 0 HG22 ILE A 153 -2.014 -16.936 -18.828 1.00 0.00 H new ATOM 0 HG23 ILE A 153 -1.696 -15.279 -19.394 1.00 0.00 H new ATOM 0 HD11 ILE A 153 2.511 -14.754 -19.079 1.00 0.00 H new ATOM 0 HD12 ILE A 153 2.174 -16.340 -18.345 1.00 0.00 H new ATOM 0 HD13 ILE A 153 1.317 -15.845 -19.824 1.00 0.00 H new ATOM 2326 N ASP A 154 -2.434 -17.464 -16.040 1.00 0.00 N ATOM 2327 CA ASP A 154 -3.581 -18.407 -15.886 1.00 0.00 C ATOM 2328 C ASP A 154 -4.635 -17.800 -14.957 1.00 0.00 C ATOM 2329 O ASP A 154 -5.823 -17.945 -15.170 1.00 0.00 O ATOM 2330 CB ASP A 154 -3.086 -19.732 -15.303 1.00 0.00 C ATOM 2331 CG ASP A 154 -2.251 -20.474 -16.348 1.00 0.00 C ATOM 2332 OD1 ASP A 154 -2.411 -20.181 -17.522 1.00 0.00 O ATOM 2333 OD2 ASP A 154 -1.469 -21.326 -15.958 1.00 0.00 O ATOM 0 H ASP A 154 -1.533 -17.823 -15.723 1.00 0.00 H new ATOM 0 HA ASP A 154 -4.027 -18.586 -16.864 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -2.489 -19.547 -14.410 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -3.934 -20.346 -14.998 1.00 0.00 H new ATOM 2338 N GLY A 155 -4.206 -17.153 -13.911 1.00 0.00 N ATOM 2339 CA GLY A 155 -5.174 -16.559 -12.941 1.00 0.00 C ATOM 2340 C GLY A 155 -6.098 -15.545 -13.625 1.00 0.00 C ATOM 2341 O GLY A 155 -7.309 -15.636 -13.528 1.00 0.00 O ATOM 0 H GLY A 155 -3.223 -17.008 -13.683 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -5.771 -17.351 -12.489 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -4.629 -16.070 -12.133 1.00 0.00 H new ATOM 2345 N ILE A 156 -5.551 -14.570 -14.300 1.00 0.00 N ATOM 2346 CA ILE A 156 -6.421 -13.551 -14.960 1.00 0.00 C ATOM 2347 C ILE A 156 -7.188 -14.189 -16.121 1.00 0.00 C ATOM 2348 O ILE A 156 -8.346 -13.897 -16.347 1.00 0.00 O ATOM 2349 CB ILE A 156 -5.569 -12.375 -15.464 1.00 0.00 C ATOM 2350 CG1 ILE A 156 -6.494 -11.211 -15.853 1.00 0.00 C ATOM 2351 CG2 ILE A 156 -4.742 -12.796 -16.687 1.00 0.00 C ATOM 2352 CD1 ILE A 156 -7.143 -10.587 -14.603 1.00 0.00 C ATOM 0 H ILE A 156 -4.548 -14.434 -14.423 1.00 0.00 H new ATOM 0 HA ILE A 156 -7.139 -13.174 -14.232 1.00 0.00 H new ATOM 0 HB ILE A 156 -4.890 -12.065 -14.670 1.00 0.00 H new ATOM 0 HG12 ILE A 156 -5.925 -10.452 -16.390 1.00 0.00 H new ATOM 0 HG13 ILE A 156 -7.269 -11.568 -16.531 1.00 0.00 H new ATOM 0 HG21 ILE A 156 -4.145 -11.951 -17.031 1.00 0.00 H new ATOM 0 HG22 ILE A 156 -4.082 -13.620 -16.414 1.00 0.00 H new ATOM 0 HG23 ILE A 156 -5.411 -13.116 -17.486 1.00 0.00 H new ATOM 0 HD11 ILE A 156 -7.793 -9.765 -14.903 1.00 0.00 H new ATOM 0 HD12 ILE A 156 -7.730 -11.343 -14.082 1.00 0.00 H new ATOM 0 HD13 ILE A 156 -6.365 -10.210 -13.939 1.00 0.00 H new ATOM 2364 N GLN A 157 -6.554 -15.057 -16.858 1.00 0.00 N ATOM 2365 CA GLN A 157 -7.249 -15.709 -18.002 1.00 0.00 C ATOM 2366 C GLN A 157 -8.408 -16.550 -17.470 1.00 0.00 C ATOM 2367 O GLN A 157 -9.473 -16.595 -18.054 1.00 0.00 O ATOM 2368 CB GLN A 157 -6.266 -16.609 -18.754 1.00 0.00 C ATOM 2369 CG GLN A 157 -5.246 -15.737 -19.484 1.00 0.00 C ATOM 2370 CD GLN A 157 -4.143 -16.620 -20.064 1.00 0.00 C ATOM 2371 OE1 GLN A 157 -3.961 -17.743 -19.639 1.00 0.00 O ATOM 2372 NE2 GLN A 157 -3.394 -16.155 -21.026 1.00 0.00 N ATOM 0 H GLN A 157 -5.585 -15.343 -16.718 1.00 0.00 H new ATOM 0 HA GLN A 157 -7.630 -14.947 -18.682 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -5.759 -17.277 -18.057 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -6.801 -17.238 -19.466 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -5.735 -15.177 -20.281 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -4.818 -15.007 -18.797 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -3.548 -15.212 -21.382 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -2.654 -16.735 -21.422 1.00 0.00 H new ATOM 2381 N ALA A 158 -8.212 -17.218 -16.369 1.00 0.00 N ATOM 2382 CA ALA A 158 -9.305 -18.053 -15.805 1.00 0.00 C ATOM 2383 C ALA A 158 -10.515 -17.166 -15.492 1.00 0.00 C ATOM 2384 O ALA A 158 -11.643 -17.527 -15.765 1.00 0.00 O ATOM 2385 CB ALA A 158 -8.813 -18.729 -14.524 1.00 0.00 C ATOM 0 H ALA A 158 -7.342 -17.221 -15.836 1.00 0.00 H new ATOM 0 HA ALA A 158 -9.597 -18.815 -16.528 1.00 0.00 H new ATOM 0 HB1 ALA A 158 -9.611 -19.343 -14.107 1.00 0.00 H new ATOM 0 HB2 ALA A 158 -7.953 -19.359 -14.752 1.00 0.00 H new ATOM 0 HB3 ALA A 158 -8.524 -17.968 -13.799 1.00 0.00 H new ATOM 2391 N ILE A 159 -10.295 -16.009 -14.922 1.00 0.00 N ATOM 2392 CA ILE A 159 -11.446 -15.113 -14.601 1.00 0.00 C ATOM 2393 C ILE A 159 -12.174 -14.715 -15.891 1.00 0.00 C ATOM 2394 O ILE A 159 -13.380 -14.828 -15.993 1.00 0.00 O ATOM 2395 CB ILE A 159 -10.932 -13.856 -13.896 1.00 0.00 C ATOM 2396 CG1 ILE A 159 -10.340 -14.247 -12.540 1.00 0.00 C ATOM 2397 CG2 ILE A 159 -12.088 -12.878 -13.677 1.00 0.00 C ATOM 2398 CD1 ILE A 159 -9.608 -13.052 -11.923 1.00 0.00 C ATOM 0 H ILE A 159 -9.376 -15.648 -14.667 1.00 0.00 H new ATOM 0 HA ILE A 159 -12.140 -15.641 -13.947 1.00 0.00 H new ATOM 0 HB ILE A 159 -10.168 -13.382 -14.512 1.00 0.00 H new ATOM 0 HG12 ILE A 159 -11.133 -14.583 -11.871 1.00 0.00 H new ATOM 0 HG13 ILE A 159 -9.651 -15.082 -12.662 1.00 0.00 H new ATOM 0 HG21 ILE A 159 -11.718 -11.984 -13.175 1.00 0.00 H new ATOM 0 HG22 ILE A 159 -12.518 -12.602 -14.640 1.00 0.00 H new ATOM 0 HG23 ILE A 159 -12.853 -13.351 -13.060 1.00 0.00 H new ATOM 0 HD11 ILE A 159 -9.190 -13.340 -10.958 1.00 0.00 H new ATOM 0 HD12 ILE A 159 -8.804 -12.736 -12.587 1.00 0.00 H new ATOM 0 HD13 ILE A 159 -10.308 -12.229 -11.784 1.00 0.00 H new ATOM 2410 N TYR A 160 -11.453 -14.252 -16.882 1.00 0.00 N ATOM 2411 CA TYR A 160 -12.106 -13.850 -18.169 1.00 0.00 C ATOM 2412 C TYR A 160 -12.028 -15.010 -19.160 1.00 0.00 C ATOM 2413 O TYR A 160 -13.025 -15.603 -19.520 1.00 0.00 O ATOM 2414 CB TYR A 160 -11.380 -12.638 -18.761 1.00 0.00 C ATOM 2415 CG TYR A 160 -11.725 -11.398 -17.971 1.00 0.00 C ATOM 2416 CD1 TYR A 160 -10.954 -11.041 -16.860 1.00 0.00 C ATOM 2417 CD2 TYR A 160 -12.810 -10.598 -18.357 1.00 0.00 C ATOM 2418 CE1 TYR A 160 -11.265 -9.886 -16.133 1.00 0.00 C ATOM 2419 CE2 TYR A 160 -13.122 -9.443 -17.628 1.00 0.00 C ATOM 2420 CZ TYR A 160 -12.349 -9.087 -16.516 1.00 0.00 C ATOM 2421 OH TYR A 160 -12.657 -7.945 -15.801 1.00 0.00 O ATOM 0 H TYR A 160 -10.440 -14.135 -16.857 1.00 0.00 H new ATOM 0 HA TYR A 160 -13.148 -13.594 -17.978 1.00 0.00 H new ATOM 0 HB2 TYR A 160 -10.303 -12.804 -18.743 1.00 0.00 H new ATOM 0 HB3 TYR A 160 -11.665 -12.506 -19.805 1.00 0.00 H new ATOM 0 HD1 TYR A 160 -10.118 -11.657 -16.563 1.00 0.00 H new ATOM 0 HD2 TYR A 160 -13.405 -10.872 -19.216 1.00 0.00 H new ATOM 0 HE1 TYR A 160 -10.668 -9.611 -15.276 1.00 0.00 H new ATOM 0 HE2 TYR A 160 -13.959 -8.827 -17.924 1.00 0.00 H new ATOM 0 HH TYR A 160 -13.437 -7.508 -16.203 1.00 0.00 H new ATOM 2431 N GLY A 161 -10.843 -15.334 -19.602 1.00 0.00 N ATOM 2432 CA GLY A 161 -10.683 -16.453 -20.572 1.00 0.00 C ATOM 2433 C GLY A 161 -9.299 -16.374 -21.218 1.00 0.00 C ATOM 2434 O GLY A 161 -8.472 -15.569 -20.840 1.00 0.00 O ATOM 0 H GLY A 161 -9.976 -14.870 -19.331 1.00 0.00 H new ATOM 0 HA2 GLY A 161 -10.805 -17.409 -20.063 1.00 0.00 H new ATOM 0 HA3 GLY A 161 -11.457 -16.398 -21.337 1.00 0.00 H new ATOM 2438 N ARG A 162 -9.041 -17.204 -22.192 1.00 0.00 N ATOM 2439 CA ARG A 162 -7.712 -17.184 -22.867 1.00 0.00 C ATOM 2440 C ARG A 162 -7.772 -16.223 -24.053 1.00 0.00 C ATOM 2441 O ARG A 162 -8.769 -16.136 -24.743 1.00 0.00 O ATOM 2442 CB ARG A 162 -7.374 -18.591 -23.364 1.00 0.00 C ATOM 2443 CG ARG A 162 -7.155 -19.525 -22.171 1.00 0.00 C ATOM 2444 CD ARG A 162 -6.819 -20.926 -22.681 1.00 0.00 C ATOM 2445 NE ARG A 162 -6.672 -21.855 -21.526 1.00 0.00 N ATOM 2446 CZ ARG A 162 -6.693 -23.144 -21.723 1.00 0.00 C ATOM 2447 NH1 ARG A 162 -6.848 -23.613 -22.931 1.00 0.00 N ATOM 2448 NH2 ARG A 162 -6.563 -23.962 -20.713 1.00 0.00 N ATOM 0 H ARG A 162 -9.697 -17.898 -22.551 1.00 0.00 H new ATOM 0 HA ARG A 162 -6.945 -16.855 -22.166 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -8.182 -18.969 -23.990 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -6.478 -18.562 -23.984 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -6.346 -19.150 -21.545 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -8.050 -19.557 -21.550 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -7.605 -21.280 -23.348 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -5.896 -20.902 -23.261 1.00 0.00 H new ATOM 0 HE ARG A 162 -6.555 -21.484 -20.583 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -6.952 -22.972 -23.717 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -6.865 -24.621 -23.089 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -6.445 -23.593 -19.770 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -6.580 -24.970 -20.868 1.00 0.00 H new ATOM 2462 N SER A 163 -6.719 -15.497 -24.297 1.00 0.00 N ATOM 2463 CA SER A 163 -6.736 -14.548 -25.440 1.00 0.00 C ATOM 2464 C SER A 163 -6.562 -15.324 -26.747 1.00 0.00 C ATOM 2465 O SER A 163 -5.469 -15.457 -27.258 1.00 0.00 O ATOM 2466 CB SER A 163 -5.593 -13.546 -25.282 1.00 0.00 C ATOM 2467 OG SER A 163 -5.931 -12.606 -24.270 1.00 0.00 O ATOM 0 H SER A 163 -5.853 -15.519 -23.758 1.00 0.00 H new ATOM 0 HA SER A 163 -7.686 -14.014 -25.460 1.00 0.00 H new ATOM 0 HB2 SER A 163 -4.672 -14.066 -25.019 1.00 0.00 H new ATOM 0 HB3 SER A 163 -5.411 -13.032 -26.226 1.00 0.00 H new ATOM 0 HG SER A 163 -5.610 -11.717 -24.529 1.00 0.00 H new ATOM 2473 N GLN A 164 -7.636 -15.826 -27.299 1.00 0.00 N ATOM 2474 CA GLN A 164 -7.536 -16.584 -28.585 1.00 0.00 C ATOM 2475 C GLN A 164 -7.785 -15.628 -29.749 1.00 0.00 C ATOM 2476 O GLN A 164 -8.908 -15.282 -30.055 1.00 0.00 O ATOM 2477 CB GLN A 164 -8.584 -17.698 -28.615 1.00 0.00 C ATOM 2478 CG GLN A 164 -8.204 -18.784 -27.610 1.00 0.00 C ATOM 2479 CD GLN A 164 -9.360 -19.773 -27.478 1.00 0.00 C ATOM 2480 OE1 GLN A 164 -10.501 -19.428 -27.716 1.00 0.00 O ATOM 2481 NE2 GLN A 164 -9.112 -20.999 -27.110 1.00 0.00 N ATOM 0 H GLN A 164 -8.578 -15.745 -26.916 1.00 0.00 H new ATOM 0 HA GLN A 164 -6.542 -17.024 -28.669 1.00 0.00 H new ATOM 0 HB2 GLN A 164 -9.567 -17.293 -28.374 1.00 0.00 H new ATOM 0 HB3 GLN A 164 -8.650 -18.122 -29.617 1.00 0.00 H new ATOM 0 HG2 GLN A 164 -7.303 -19.301 -27.939 1.00 0.00 H new ATOM 0 HG3 GLN A 164 -7.979 -18.337 -26.641 1.00 0.00 H new ATOM 0 HE21 GLN A 164 -8.154 -21.288 -26.910 1.00 0.00 H new ATOM 0 HE22 GLN A 164 -9.876 -21.669 -27.022 1.00 0.00 H new ATOM 2490 N ASN A 165 -6.742 -15.194 -30.397 1.00 0.00 N ATOM 2491 CA ASN A 165 -6.909 -14.256 -31.538 1.00 0.00 C ATOM 2492 C ASN A 165 -5.651 -14.326 -32.414 1.00 0.00 C ATOM 2493 O ASN A 165 -4.594 -14.678 -31.928 1.00 0.00 O ATOM 2494 CB ASN A 165 -7.087 -12.836 -30.986 1.00 0.00 C ATOM 2495 CG ASN A 165 -8.513 -12.678 -30.449 1.00 0.00 C ATOM 2496 OD1 ASN A 165 -9.442 -12.494 -31.210 1.00 0.00 O ATOM 2497 ND2 ASN A 165 -8.727 -12.747 -29.161 1.00 0.00 N ATOM 0 H ASN A 165 -5.778 -15.450 -30.184 1.00 0.00 H new ATOM 0 HA ASN A 165 -7.782 -14.523 -32.134 1.00 0.00 H new ATOM 0 HB2 ASN A 165 -6.364 -12.649 -30.192 1.00 0.00 H new ATOM 0 HB3 ASN A 165 -6.897 -12.102 -31.769 1.00 0.00 H new ATOM 0 HD21 ASN A 165 -9.674 -12.646 -28.795 1.00 0.00 H new ATOM 0 HD22 ASN A 165 -7.947 -12.901 -28.522 1.00 0.00 H new ATOM 2504 N PRO A 166 -5.726 -13.993 -33.686 1.00 0.00 N ATOM 2505 CA PRO A 166 -4.510 -14.037 -34.542 1.00 0.00 C ATOM 2506 C PRO A 166 -3.619 -12.809 -34.311 1.00 0.00 C ATOM 2507 O PRO A 166 -3.481 -11.954 -35.162 1.00 0.00 O ATOM 2508 CB PRO A 166 -5.124 -14.022 -35.947 1.00 0.00 C ATOM 2509 CG PRO A 166 -6.514 -13.380 -35.825 1.00 0.00 C ATOM 2510 CD PRO A 166 -6.989 -13.574 -34.373 1.00 0.00 C ATOM 0 HA PRO A 166 -3.862 -14.891 -34.348 1.00 0.00 H new ATOM 0 HB2 PRO A 166 -4.497 -13.455 -36.635 1.00 0.00 H new ATOM 0 HB3 PRO A 166 -5.201 -15.034 -36.345 1.00 0.00 H new ATOM 0 HG2 PRO A 166 -6.470 -12.320 -36.075 1.00 0.00 H new ATOM 0 HG3 PRO A 166 -7.213 -13.843 -36.522 1.00 0.00 H new ATOM 0 HD2 PRO A 166 -7.398 -12.656 -33.951 1.00 0.00 H new ATOM 0 HD3 PRO A 166 -7.767 -14.334 -34.296 1.00 0.00 H new ATOM 2518 N VAL A 167 -3.016 -12.717 -33.157 1.00 0.00 N ATOM 2519 CA VAL A 167 -2.136 -11.550 -32.863 1.00 0.00 C ATOM 2520 C VAL A 167 -0.728 -11.853 -33.363 1.00 0.00 C ATOM 2521 O VAL A 167 -0.194 -12.919 -33.133 1.00 0.00 O ATOM 2522 CB VAL A 167 -2.100 -11.293 -31.355 1.00 0.00 C ATOM 2523 CG1 VAL A 167 -1.427 -9.946 -31.085 1.00 0.00 C ATOM 2524 CG2 VAL A 167 -3.527 -11.259 -30.807 1.00 0.00 C ATOM 0 H VAL A 167 -3.095 -13.401 -32.404 1.00 0.00 H new ATOM 0 HA VAL A 167 -2.525 -10.664 -33.365 1.00 0.00 H new ATOM 0 HB VAL A 167 -1.539 -12.090 -30.866 1.00 0.00 H new ATOM 0 HG11 VAL A 167 -1.401 -9.761 -30.011 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -0.409 -9.963 -31.476 1.00 0.00 H new ATOM 0 HG13 VAL A 167 -1.991 -9.153 -31.576 1.00 0.00 H new ATOM 0 HG21 VAL A 167 -3.500 -11.076 -29.733 1.00 0.00 H new ATOM 0 HG22 VAL A 167 -4.086 -10.462 -31.297 1.00 0.00 H new ATOM 0 HG23 VAL A 167 -4.014 -12.215 -31.000 1.00 0.00 H new ATOM 2534 N GLN A 168 -0.125 -10.917 -34.051 1.00 0.00 N ATOM 2535 CA GLN A 168 1.256 -11.122 -34.592 1.00 0.00 C ATOM 2536 C GLN A 168 2.181 -10.015 -34.062 1.00 0.00 C ATOM 2537 O GLN A 168 2.440 -9.049 -34.751 1.00 0.00 O ATOM 2538 CB GLN A 168 1.198 -11.046 -36.119 1.00 0.00 C ATOM 2539 CG GLN A 168 0.281 -12.153 -36.641 1.00 0.00 C ATOM 2540 CD GLN A 168 0.950 -13.511 -36.424 1.00 0.00 C ATOM 2541 OE1 GLN A 168 2.020 -13.766 -36.943 1.00 0.00 O ATOM 2542 NE2 GLN A 168 0.360 -14.398 -35.670 1.00 0.00 N ATOM 0 H GLN A 168 -0.535 -10.008 -34.264 1.00 0.00 H new ATOM 0 HA GLN A 168 1.640 -12.093 -34.279 1.00 0.00 H new ATOM 0 HB2 GLN A 168 0.826 -10.071 -36.433 1.00 0.00 H new ATOM 0 HB3 GLN A 168 2.198 -11.157 -36.539 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -0.678 -12.121 -36.123 1.00 0.00 H new ATOM 0 HG3 GLN A 168 0.076 -12.001 -37.701 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -0.537 -14.182 -35.236 1.00 0.00 H new ATOM 0 HE22 GLN A 168 0.796 -15.307 -35.515 1.00 0.00 H new ATOM 2551 N PRO A 169 2.675 -10.137 -32.843 1.00 0.00 N ATOM 2552 CA PRO A 169 3.570 -9.090 -32.274 1.00 0.00 C ATOM 2553 C PRO A 169 4.939 -9.068 -32.969 1.00 0.00 C ATOM 2554 O PRO A 169 5.772 -8.271 -32.570 1.00 0.00 O ATOM 2555 CB PRO A 169 3.687 -9.514 -30.793 1.00 0.00 C ATOM 2556 CG PRO A 169 3.062 -10.916 -30.633 1.00 0.00 C ATOM 2557 CD PRO A 169 2.386 -11.308 -31.963 1.00 0.00 C ATOM 2558 OXT PRO A 169 5.129 -9.848 -33.886 1.00 0.00 O ATOM 0 HA PRO A 169 3.185 -8.079 -32.404 1.00 0.00 H new ATOM 0 HB2 PRO A 169 4.732 -9.528 -30.485 1.00 0.00 H new ATOM 0 HB3 PRO A 169 3.175 -8.796 -30.152 1.00 0.00 H new ATOM 0 HG2 PRO A 169 3.829 -11.644 -30.369 1.00 0.00 H new ATOM 0 HG3 PRO A 169 2.332 -10.915 -29.824 1.00 0.00 H new ATOM 0 HD2 PRO A 169 2.800 -12.231 -32.370 1.00 0.00 H new ATOM 0 HD3 PRO A 169 1.315 -11.466 -31.840 1.00 0.00 H new TER 2566 PRO A 169 HETATM 2567 ZN ZN A 170 0.428 -6.529 -2.981 1.00 0.00 ZN HETATM 2568 ZN ZN A 171 -2.433 6.299 -0.180 1.00 0.00 ZN HETATM 2569 CA CA A 172 8.148 3.822 2.366 1.00 0.00 CA HETATM 2570 N1 CGS A 173 3.241 -4.162 0.581 1.00 0.00 N HETATM 2571 CC CGS A 173 3.697 -5.389 1.340 1.00 0.00 C HETATM 2572 CA CGS A 173 1.952 -4.061 -0.177 1.00 0.00 C HETATM 2573 S4 CGS A 173 4.520 -3.081 -0.010 1.00 0.00 S HETATM 2574 C5 CGS A 173 3.872 -5.324 2.852 1.00 0.00 C HETATM 2575 CD CGS A 173 5.039 -4.704 3.453 1.00 0.00 C HETATM 2576 CE CGS A 173 5.211 -4.640 4.888 1.00 0.00 C HETATM 2577 CZ CGS A 173 4.185 -5.214 5.706 1.00 0.00 C HETATM 2578 N11 CGS A 173 3.060 -5.813 5.166 1.00 0.00 N HETATM 2579 CY CGS A 173 2.910 -5.866 3.777 1.00 0.00 C HETATM 2580 C17 CGS A 173 5.128 -3.642 -1.594 1.00 0.00 C HETATM 2581 CE2 CGS A 173 6.125 -4.695 -1.679 1.00 0.00 C HETATM 2582 CD2 CGS A 173 6.639 -5.117 -2.969 1.00 0.00 C HETATM 2583 C20 CGS A 173 6.161 -4.492 -4.212 1.00 0.00 C HETATM 2584 CD1 CGS A 173 5.152 -3.435 -4.104 1.00 0.00 C HETATM 2585 CE1 CGS A 173 4.645 -3.019 -2.809 1.00 0.00 C HETATM 2586 O27 CGS A 173 6.656 -4.894 -5.472 1.00 0.00 O HETATM 2587 COM CGS A 173 6.114 -6.093 -6.038 1.00 0.00 C HETATM 2588 O32 CGS A 173 5.546 -3.183 0.979 1.00 0.00 O HETATM 2589 O33 CGS A 173 3.831 -1.837 -0.174 1.00 0.00 O HETATM 2590 C34 CGS A 173 1.984 -4.974 -1.422 1.00 0.00 C HETATM 2591 N35 CGS A 173 2.023 -4.355 -2.594 1.00 0.00 N HETATM 2592 CB CGS A 173 0.584 -4.077 0.556 1.00 0.00 C HETATM 2593 CG2 CGS A 173 -0.377 -3.002 0.054 1.00 0.00 C HETATM 2594 CG1 CGS A 173 0.700 -3.901 2.067 1.00 0.00 C HETATM 2595 O47 CGS A 173 1.974 -6.206 -1.359 1.00 0.00 O HETATM 2596 O48 CGS A 173 2.051 -5.107 -3.756 1.00 0.00 O HETATM 0 HOM3 CGS A 173 6.309 -6.931 -5.369 1.00 0.00 H new HETATM 0 HOM2 CGS A 173 5.038 -5.978 -6.172 1.00 0.00 H new HETATM 0 HOM1 CGS A 173 6.582 -6.283 -7.004 1.00 0.00 H new HETATM 0 HG23 CGS A 173 0.067 -2.018 0.205 1.00 0.00 H new HETATM 0 HG22 CGS A 173 -0.570 -3.154 -1.008 1.00 0.00 H new HETATM 0 HG21 CGS A 173 -1.315 -3.066 0.606 1.00 0.00 H new HETATM 0 HG13 CGS A 173 1.301 -4.710 2.482 1.00 0.00 H new HETATM 0 HG12 CGS A 173 1.176 -2.945 2.287 1.00 0.00 H new HETATM 0 HG11 CGS A 173 -0.294 -3.922 2.513 1.00 0.00 H new HETATM 0 HZ CGS A 173 4.294 -5.178 6.790 1.00 0.00 H new HETATM 0 HY CGS A 173 2.017 -6.343 3.372 1.00 0.00 H new HETATM 0 HE2 CGS A 173 6.489 -5.171 -0.769 1.00 0.00 H new HETATM 0 HE1 CGS A 173 3.894 -2.231 -2.750 1.00 0.00 H new HETATM 0 HE CGS A 173 6.090 -4.172 5.331 1.00 0.00 H new HETATM 0 HD2 CGS A 173 7.389 -5.907 -3.017 1.00 0.00 H new HETATM 0 HD1 CGS A 173 4.777 -2.955 -5.008 1.00 0.00 H new HETATM 0 HD CGS A 173 5.805 -4.276 2.807 1.00 0.00 H new HETATM 0 HC2 CGS A 173 2.983 -6.185 1.130 1.00 0.00 H new HETATM 0 HC1 CGS A 173 4.652 -5.697 0.915 1.00 0.00 H new HETATM 0 HB CGS A 173 0.192 -5.069 0.330 1.00 0.00 H new HETATM 0 HA CGS A 173 1.953 -3.005 -0.448 1.00 0.00 H new HETATM 0 H49 CGS A 173 2.032 -3.336 -2.639 1.00 0.00 H new