USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 839 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 65 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.266) USER MOD Set 1.2: A 127 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 113 TYR OH : rot -115:sc= 0.558 USER MOD Set 2.2: A 114 TYR OH : rot 180:sc= -0.196 USER MOD Set 3.1: A 62 HIS : no HE2:sc= -1.21 K(o=-1.9,f=-11!) USER MOD Set 3.2: A 96 GLN : amide:sc= -0.7 K(o=-1.9,f=-4.2!) USER MOD Set 4.1: A 53 SER OG : rot 180:sc= 0.0226 USER MOD Set 4.2: A 129 GLN : amide:sc= 1.82 K(o=4.9,f=0.69!) USER MOD Set 4.3: A 132 ASN : amide:sc= 0.661 K(o=4.9,f=3.5) USER MOD Set 4.4: A 133 HIS : no HE2:sc= 0.785 K(o=4.9,f=1.6) USER MOD Set 4.5: B 149 C O2' : rot 73:sc= 1.64 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot -83:sc= 1.18 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0.0488 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00615) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 1.12 K(o=1.1,f=0) USER MOD Single : A 90 MET CE :methyl 178:sc= -0.0319 (180deg=-0.0363) USER MOD Single : A 92 LYS NZ :NH3+ -173:sc= 2.38 (180deg=2.27) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= 1.07 K(o=1.1,f=-0.92) USER MOD Single : A 101 MET CE :methyl 167:sc= -4.14! (180deg=-5.51!) USER MOD Single : A 102 ASN :FLIP amide:sc= -2.89! C(o=-4.5!,f=-2.9!) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.407 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl -175:sc= -1.6 (180deg=-2.04) USER MOD Single : A 112 ASN : amide:sc= -0.0244 X(o=-0.024,f=-0.0013) USER MOD Single : A 115 THR OG1 : rot 76:sc= 0.167 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot -25:sc= 0.454 USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 SER OG : rot 45:sc= 1.79 USER MOD Single : A 134 LYS NZ :NH3+ 137:sc= 1.12 (180deg=-0.739) USER MOD Single : A 137 LYS NZ :NH3+ 177:sc= 1.2 (180deg=1.09) USER MOD Single : A 138 THR OG1 : rot 50:sc= 0.0264 USER MOD Single : A 140 SER OG : rot 180:sc= 0.705 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= 0.394 X(o=0.39,f=0) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 147 C O2' : rot 113:sc= 1.18 USER MOD Single : B 147 C O5' : rot 180:sc= 0 USER MOD Single : B 148 U O2' : rot 38:sc= 0.947 USER MOD Single : B 150 U O2' : rot 180:sc= 0 USER MOD Single : B 151 C O2' : rot 19:sc= 0.0835 USER MOD Single : B 152 U O2' : rot 180:sc= 0 USER MOD Single : B 152 U O3' : rot 129:sc= 0.0306 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 49 -15.258 -11.039 6.939 1.00 0.00 N ATOM 2 CA GLY A 49 -16.192 -9.895 6.889 1.00 0.00 C ATOM 3 C GLY A 49 -15.552 -8.681 6.232 1.00 0.00 C ATOM 4 O GLY A 49 -14.682 -8.817 5.369 1.00 0.00 O ATOM 0 HA2 GLY A 49 -17.088 -10.179 6.337 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -16.509 -9.638 7.900 1.00 0.00 H new ATOM 8 N ASP A 50 -15.971 -7.477 6.627 1.00 0.00 N ATOM 9 CA ASP A 50 -15.411 -6.202 6.148 1.00 0.00 C ATOM 10 C ASP A 50 -13.915 -6.038 6.507 1.00 0.00 C ATOM 11 O ASP A 50 -13.492 -6.392 7.614 1.00 0.00 O ATOM 12 CB ASP A 50 -16.241 -5.048 6.732 1.00 0.00 C ATOM 13 CG ASP A 50 -15.744 -3.683 6.242 1.00 0.00 C ATOM 14 OD1 ASP A 50 -15.571 -3.525 5.011 1.00 0.00 O ATOM 15 OD2 ASP A 50 -15.519 -2.776 7.078 1.00 0.00 O ATOM 0 H ASP A 50 -16.725 -7.354 7.303 1.00 0.00 H new ATOM 0 HA ASP A 50 -15.465 -6.192 5.059 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -17.287 -5.175 6.453 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -16.195 -5.082 7.820 1.00 0.00 H new ATOM 20 N SER A 51 -13.113 -5.499 5.578 1.00 0.00 N ATOM 21 CA SER A 51 -11.642 -5.395 5.696 1.00 0.00 C ATOM 22 C SER A 51 -11.004 -4.112 5.135 1.00 0.00 C ATOM 23 O SER A 51 -9.808 -3.882 5.352 1.00 0.00 O ATOM 24 CB SER A 51 -10.991 -6.618 5.032 1.00 0.00 C ATOM 25 OG SER A 51 -11.334 -6.712 3.656 1.00 0.00 O ATOM 0 H SER A 51 -13.471 -5.114 4.704 1.00 0.00 H new ATOM 0 HA SER A 51 -11.451 -5.355 6.768 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.908 -6.554 5.134 1.00 0.00 H new ATOM 0 HB3 SER A 51 -11.307 -7.524 5.549 1.00 0.00 H new ATOM 0 HG SER A 51 -10.902 -7.500 3.264 1.00 0.00 H new ATOM 31 N ARG A 52 -11.758 -3.258 4.426 1.00 0.00 N ATOM 32 CA ARG A 52 -11.255 -2.019 3.794 1.00 0.00 C ATOM 33 C ARG A 52 -10.802 -0.949 4.800 1.00 0.00 C ATOM 34 O ARG A 52 -11.232 -0.929 5.955 1.00 0.00 O ATOM 35 CB ARG A 52 -12.332 -1.450 2.841 1.00 0.00 C ATOM 36 CG ARG A 52 -13.626 -1.041 3.572 1.00 0.00 C ATOM 37 CD ARG A 52 -14.697 -0.392 2.684 1.00 0.00 C ATOM 38 NE ARG A 52 -15.064 -1.191 1.493 1.00 0.00 N ATOM 39 CZ ARG A 52 -15.917 -2.197 1.407 1.00 0.00 C ATOM 40 NH1 ARG A 52 -16.402 -2.825 2.438 1.00 0.00 N ATOM 41 NH2 ARG A 52 -16.309 -2.609 0.237 1.00 0.00 N ATOM 0 H ARG A 52 -12.755 -3.408 4.270 1.00 0.00 H new ATOM 0 HA ARG A 52 -10.361 -2.292 3.233 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -11.926 -0.583 2.319 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -12.570 -2.196 2.083 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -14.054 -1.926 4.043 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -13.369 -0.346 4.372 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -15.592 -0.219 3.281 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -14.339 0.584 2.357 1.00 0.00 H new ATOM 0 HE ARG A 52 -14.597 -0.931 0.624 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -16.127 -2.548 3.380 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -17.058 -3.595 2.304 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -15.958 -2.156 -0.607 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -16.967 -3.385 0.164 1.00 0.00 H new ATOM 55 N SER A 53 -10.005 -0.003 4.308 1.00 0.00 N ATOM 56 CA SER A 53 -9.775 1.329 4.890 1.00 0.00 C ATOM 57 C SER A 53 -9.203 2.293 3.840 1.00 0.00 C ATOM 58 O SER A 53 -8.579 1.863 2.865 1.00 0.00 O ATOM 59 CB SER A 53 -8.831 1.265 6.101 1.00 0.00 C ATOM 60 OG SER A 53 -7.537 0.829 5.732 1.00 0.00 O ATOM 0 H SER A 53 -9.473 -0.146 3.450 1.00 0.00 H new ATOM 0 HA SER A 53 -10.742 1.701 5.229 1.00 0.00 H new ATOM 0 HB2 SER A 53 -8.765 2.250 6.564 1.00 0.00 H new ATOM 0 HB3 SER A 53 -9.244 0.588 6.849 1.00 0.00 H new ATOM 0 HG SER A 53 -6.962 0.801 6.525 1.00 0.00 H new ATOM 66 N ALA A 54 -9.429 3.589 4.042 1.00 0.00 N ATOM 67 CA ALA A 54 -8.806 4.738 3.378 1.00 0.00 C ATOM 68 C ALA A 54 -8.973 5.970 4.313 1.00 0.00 C ATOM 69 O ALA A 54 -9.389 5.812 5.468 1.00 0.00 O ATOM 70 CB ALA A 54 -9.416 4.913 1.970 1.00 0.00 C ATOM 0 H ALA A 54 -10.113 3.892 4.736 1.00 0.00 H new ATOM 0 HA ALA A 54 -7.738 4.598 3.214 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -8.953 5.767 1.476 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -9.237 4.013 1.382 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -10.489 5.082 2.057 1.00 0.00 H new ATOM 76 N GLY A 55 -8.662 7.194 3.868 1.00 0.00 N ATOM 77 CA GLY A 55 -8.708 8.416 4.686 1.00 0.00 C ATOM 78 C GLY A 55 -9.329 9.580 3.923 1.00 0.00 C ATOM 79 O GLY A 55 -8.622 10.528 3.576 1.00 0.00 O ATOM 0 H GLY A 55 -8.365 7.368 2.908 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -9.283 8.226 5.592 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -7.699 8.683 4.999 1.00 0.00 H new ATOM 83 N VAL A 56 -10.634 9.472 3.625 1.00 0.00 N ATOM 84 CA VAL A 56 -11.396 10.256 2.622 1.00 0.00 C ATOM 85 C VAL A 56 -10.528 10.580 1.386 1.00 0.00 C ATOM 86 O VAL A 56 -10.025 11.694 1.208 1.00 0.00 O ATOM 87 CB VAL A 56 -12.159 11.422 3.260 1.00 0.00 C ATOM 88 CG1 VAL A 56 -11.321 12.510 3.941 1.00 0.00 C ATOM 89 CG2 VAL A 56 -13.116 12.080 2.256 1.00 0.00 C ATOM 0 H VAL A 56 -11.228 8.795 4.104 1.00 0.00 H new ATOM 0 HA VAL A 56 -12.199 9.641 2.216 1.00 0.00 H new ATOM 0 HB VAL A 56 -12.703 10.934 4.069 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -11.981 13.275 4.351 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -10.735 12.067 4.746 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -10.650 12.963 3.211 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -13.642 12.903 2.740 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -12.548 12.461 1.408 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -13.839 11.343 1.906 1.00 0.00 H new ATOM 99 N PRO A 57 -10.217 9.534 0.605 1.00 0.00 N ATOM 100 CA PRO A 57 -8.892 9.338 0.013 1.00 0.00 C ATOM 101 C PRO A 57 -8.739 9.953 -1.393 1.00 0.00 C ATOM 102 O PRO A 57 -9.725 10.298 -2.052 1.00 0.00 O ATOM 103 CB PRO A 57 -8.772 7.813 0.063 1.00 0.00 C ATOM 104 CG PRO A 57 -10.173 7.356 -0.340 1.00 0.00 C ATOM 105 CD PRO A 57 -10.986 8.295 0.536 1.00 0.00 C ATOM 0 HA PRO A 57 -8.087 9.851 0.539 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -8.011 7.443 -0.625 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -8.501 7.460 1.058 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -10.372 7.493 -1.403 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -10.355 6.305 -0.114 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -11.974 8.470 0.111 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -11.137 7.872 1.529 1.00 0.00 H new ATOM 113 N SER A 58 -7.484 10.099 -1.844 1.00 0.00 N ATOM 114 CA SER A 58 -7.119 10.932 -3.011 1.00 0.00 C ATOM 115 C SER A 58 -6.135 10.247 -3.976 1.00 0.00 C ATOM 116 O SER A 58 -6.568 9.724 -5.003 1.00 0.00 O ATOM 117 CB SER A 58 -6.571 12.293 -2.547 1.00 0.00 C ATOM 118 OG SER A 58 -7.586 13.086 -1.964 1.00 0.00 O ATOM 0 H SER A 58 -6.684 9.640 -1.409 1.00 0.00 H new ATOM 0 HA SER A 58 -8.037 11.084 -3.579 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.769 12.137 -1.825 1.00 0.00 H new ATOM 0 HB3 SER A 58 -6.137 12.821 -3.396 1.00 0.00 H new ATOM 0 HG SER A 58 -8.085 13.549 -2.669 1.00 0.00 H new ATOM 124 N ARG A 59 -4.823 10.276 -3.693 1.00 0.00 N ATOM 125 CA ARG A 59 -3.749 10.035 -4.686 1.00 0.00 C ATOM 126 C ARG A 59 -2.753 8.923 -4.355 1.00 0.00 C ATOM 127 O ARG A 59 -1.998 8.539 -5.248 1.00 0.00 O ATOM 128 CB ARG A 59 -2.994 11.350 -4.917 1.00 0.00 C ATOM 129 CG ARG A 59 -3.646 12.228 -5.995 1.00 0.00 C ATOM 130 CD ARG A 59 -3.057 13.645 -5.996 1.00 0.00 C ATOM 131 NE ARG A 59 -1.580 13.622 -5.988 1.00 0.00 N ATOM 132 CZ ARG A 59 -0.761 14.362 -5.265 1.00 0.00 C ATOM 133 NH1 ARG A 59 -1.150 15.408 -4.597 1.00 0.00 N ATOM 134 NH2 ARG A 59 0.496 14.068 -5.157 1.00 0.00 N ATOM 0 H ARG A 59 -4.467 10.470 -2.757 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.259 9.679 -5.581 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.947 11.906 -3.981 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -1.967 11.128 -5.207 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.501 11.772 -6.974 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.721 12.280 -5.823 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.408 14.184 -6.876 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.417 14.190 -5.123 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.139 12.952 -6.618 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.130 15.690 -4.617 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -0.475 15.946 -4.053 1.00 0.00 H new ATOM 0 HH21 ARG A 59 0.871 13.250 -5.637 1.00 0.00 H new ATOM 0 HH22 ARG A 59 1.110 14.655 -4.592 1.00 0.00 H new ATOM 148 N VAL A 60 -2.737 8.388 -3.130 1.00 0.00 N ATOM 149 CA VAL A 60 -1.916 7.214 -2.770 1.00 0.00 C ATOM 150 C VAL A 60 -2.769 5.977 -2.494 1.00 0.00 C ATOM 151 O VAL A 60 -3.810 6.061 -1.850 1.00 0.00 O ATOM 152 CB VAL A 60 -0.827 7.501 -1.733 1.00 0.00 C ATOM 153 CG1 VAL A 60 -1.185 8.182 -0.417 1.00 0.00 C ATOM 154 CG2 VAL A 60 -0.010 6.247 -1.458 1.00 0.00 C ATOM 0 H VAL A 60 -3.291 8.753 -2.355 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.334 6.965 -3.657 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.261 8.282 -2.240 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.286 8.301 0.187 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.618 9.161 -0.620 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.908 7.571 0.124 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.760 6.469 -0.719 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.664 5.463 -1.077 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.461 5.910 -2.381 1.00 0.00 H new ATOM 164 N ILE A 61 -2.325 4.824 -2.997 1.00 0.00 N ATOM 165 CA ILE A 61 -2.894 3.476 -2.813 1.00 0.00 C ATOM 166 C ILE A 61 -1.845 2.600 -2.148 1.00 0.00 C ATOM 167 O ILE A 61 -0.668 2.702 -2.474 1.00 0.00 O ATOM 168 CB ILE A 61 -3.320 2.925 -4.187 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.603 3.654 -4.633 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.554 1.403 -4.301 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.625 3.761 -6.146 1.00 0.00 C ATOM 0 H ILE A 61 -1.495 4.800 -3.590 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.777 3.498 -2.174 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.460 3.114 -4.830 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.482 3.112 -4.283 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.643 4.648 -4.187 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.848 1.156 -5.321 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.635 0.874 -4.050 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.344 1.104 -3.612 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.532 4.276 -6.461 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.753 4.321 -6.484 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.605 2.762 -6.582 1.00 0.00 H new ATOM 183 N HIS A 62 -2.269 1.729 -1.244 1.00 0.00 N ATOM 184 CA HIS A 62 -1.433 0.802 -0.491 1.00 0.00 C ATOM 185 C HIS A 62 -1.713 -0.655 -0.896 1.00 0.00 C ATOM 186 O HIS A 62 -2.843 -1.018 -1.233 1.00 0.00 O ATOM 187 CB HIS A 62 -1.657 1.076 1.005 1.00 0.00 C ATOM 188 CG HIS A 62 -1.291 -0.054 1.935 1.00 0.00 C ATOM 189 ND1 HIS A 62 -1.928 -1.272 2.049 1.00 0.00 N ATOM 190 CD2 HIS A 62 -0.333 -0.002 2.905 1.00 0.00 C ATOM 191 CE1 HIS A 62 -1.331 -1.949 3.043 1.00 0.00 C ATOM 192 NE2 HIS A 62 -0.340 -1.223 3.582 1.00 0.00 N ATOM 0 H HIS A 62 -3.256 1.645 -1.003 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.378 0.958 -0.717 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.078 1.956 1.286 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.708 1.323 1.158 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -2.710 -1.599 1.482 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.316 0.836 3.113 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.610 -2.942 3.364 1.00 0.00 H new ATOM 200 N ILE A 63 -0.682 -1.502 -0.828 1.00 0.00 N ATOM 201 CA ILE A 63 -0.689 -2.915 -1.238 1.00 0.00 C ATOM 202 C ILE A 63 -0.036 -3.781 -0.143 1.00 0.00 C ATOM 203 O ILE A 63 0.996 -3.383 0.398 1.00 0.00 O ATOM 204 CB ILE A 63 0.052 -3.082 -2.593 1.00 0.00 C ATOM 205 CG1 ILE A 63 -0.251 -2.011 -3.668 1.00 0.00 C ATOM 206 CG2 ILE A 63 -0.280 -4.456 -3.202 1.00 0.00 C ATOM 207 CD1 ILE A 63 0.762 -0.862 -3.697 1.00 0.00 C ATOM 0 H ILE A 63 0.226 -1.209 -0.468 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.719 -3.246 -1.371 1.00 0.00 H new ATOM 0 HB ILE A 63 1.105 -2.972 -2.335 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.273 -2.489 -4.648 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.246 -1.602 -3.490 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.242 -4.569 -4.152 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.037 -5.243 -2.518 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.355 -4.531 -3.367 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.484 -0.151 -4.475 1.00 0.00 H new ATOM 0 HD12 ILE A 63 0.768 -0.358 -2.731 1.00 0.00 H new ATOM 0 HD13 ILE A 63 1.756 -1.258 -3.906 1.00 0.00 H new ATOM 219 N ARG A 64 -0.587 -4.966 0.166 1.00 0.00 N ATOM 220 CA ARG A 64 0.036 -6.016 1.021 1.00 0.00 C ATOM 221 C ARG A 64 0.525 -7.215 0.191 1.00 0.00 C ATOM 222 O ARG A 64 0.275 -7.284 -1.012 1.00 0.00 O ATOM 223 CB ARG A 64 -0.872 -6.468 2.209 1.00 0.00 C ATOM 224 CG ARG A 64 -2.266 -5.819 2.301 1.00 0.00 C ATOM 225 CD ARG A 64 -3.159 -6.420 3.396 1.00 0.00 C ATOM 226 NE ARG A 64 -4.524 -5.853 3.344 1.00 0.00 N ATOM 227 CZ ARG A 64 -5.654 -6.443 3.684 1.00 0.00 C ATOM 228 NH1 ARG A 64 -5.689 -7.639 4.199 1.00 0.00 N ATOM 229 NH2 ARG A 64 -6.791 -5.840 3.511 1.00 0.00 N ATOM 0 H ARG A 64 -1.508 -5.238 -0.178 1.00 0.00 H new ATOM 0 HA ARG A 64 0.910 -5.548 1.474 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -1.003 -7.548 2.145 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -0.341 -6.266 3.139 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.148 -4.752 2.487 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -2.768 -5.921 1.339 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.207 -7.502 3.276 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -2.719 -6.227 4.374 1.00 0.00 H new ATOM 0 HE ARG A 64 -4.601 -4.894 3.006 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -4.822 -8.154 4.353 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -6.584 -8.061 4.449 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -6.815 -4.903 3.109 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.660 -6.304 3.777 1.00 0.00 H new ATOM 243 N LYS A 65 1.169 -8.197 0.845 1.00 0.00 N ATOM 244 CA LYS A 65 1.460 -9.565 0.343 1.00 0.00 C ATOM 245 C LYS A 65 2.578 -9.647 -0.708 1.00 0.00 C ATOM 246 O LYS A 65 2.753 -10.709 -1.315 1.00 0.00 O ATOM 247 CB LYS A 65 0.195 -10.259 -0.223 1.00 0.00 C ATOM 248 CG LYS A 65 -1.117 -10.093 0.544 1.00 0.00 C ATOM 249 CD LYS A 65 -1.236 -10.806 1.890 1.00 0.00 C ATOM 250 CE LYS A 65 -1.431 -12.319 1.661 1.00 0.00 C ATOM 251 NZ LYS A 65 -1.901 -13.042 2.875 1.00 0.00 N ATOM 0 H LYS A 65 1.523 -8.057 1.791 1.00 0.00 H new ATOM 0 HA LYS A 65 1.815 -10.089 1.231 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.038 -9.892 -1.237 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.405 -11.326 -0.299 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.278 -9.028 0.711 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -1.928 -10.441 -0.095 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.340 -10.631 2.486 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -2.077 -10.402 2.453 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -2.151 -12.468 0.856 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.488 -12.754 1.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -2.253 -13.982 2.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -1.112 -13.147 3.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -2.667 -12.502 3.326 1.00 0.00 H new ATOM 265 N LEU A 66 3.312 -8.561 -0.964 1.00 0.00 N ATOM 266 CA LEU A 66 4.353 -8.540 -1.999 1.00 0.00 C ATOM 267 C LEU A 66 5.505 -9.531 -1.715 1.00 0.00 C ATOM 268 O LEU A 66 5.710 -9.943 -0.570 1.00 0.00 O ATOM 269 CB LEU A 66 4.868 -7.100 -2.209 1.00 0.00 C ATOM 270 CG LEU A 66 3.900 -6.271 -3.078 1.00 0.00 C ATOM 271 CD1 LEU A 66 3.496 -4.999 -2.363 1.00 0.00 C ATOM 272 CD2 LEU A 66 4.532 -5.825 -4.393 1.00 0.00 C ATOM 0 H LEU A 66 3.204 -7.678 -0.465 1.00 0.00 H new ATOM 0 HA LEU A 66 3.897 -8.882 -2.928 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.996 -6.614 -1.242 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.849 -7.129 -2.683 1.00 0.00 H new ATOM 0 HG LEU A 66 3.049 -6.925 -3.269 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.813 -4.429 -2.993 1.00 0.00 H new ATOM 0 HD12 LEU A 66 3.000 -5.250 -1.425 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.383 -4.401 -2.155 1.00 0.00 H new ATOM 0 HD21 LEU A 66 3.808 -5.245 -4.966 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.407 -5.210 -4.186 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.832 -6.701 -4.968 1.00 0.00 H new ATOM 284 N PRO A 67 6.288 -9.914 -2.739 1.00 0.00 N ATOM 285 CA PRO A 67 7.595 -10.544 -2.586 1.00 0.00 C ATOM 286 C PRO A 67 8.576 -9.797 -1.663 1.00 0.00 C ATOM 287 O PRO A 67 8.340 -8.683 -1.195 1.00 0.00 O ATOM 288 CB PRO A 67 8.150 -10.669 -4.008 1.00 0.00 C ATOM 289 CG PRO A 67 6.895 -10.787 -4.863 1.00 0.00 C ATOM 290 CD PRO A 67 5.900 -9.876 -4.138 1.00 0.00 C ATOM 0 HA PRO A 67 7.476 -11.505 -2.086 1.00 0.00 H new ATOM 0 HB2 PRO A 67 8.746 -9.799 -4.285 1.00 0.00 H new ATOM 0 HB3 PRO A 67 8.793 -11.543 -4.114 1.00 0.00 H new ATOM 0 HG2 PRO A 67 7.072 -10.458 -5.887 1.00 0.00 H new ATOM 0 HG3 PRO A 67 6.537 -11.815 -4.915 1.00 0.00 H new ATOM 0 HD2 PRO A 67 5.941 -8.860 -4.529 1.00 0.00 H new ATOM 0 HD3 PRO A 67 4.877 -10.227 -4.271 1.00 0.00 H new ATOM 298 N ILE A 68 9.715 -10.449 -1.429 1.00 0.00 N ATOM 299 CA ILE A 68 10.729 -10.132 -0.398 1.00 0.00 C ATOM 300 C ILE A 68 11.348 -8.740 -0.567 1.00 0.00 C ATOM 301 O ILE A 68 11.644 -8.050 0.408 1.00 0.00 O ATOM 302 CB ILE A 68 11.822 -11.227 -0.356 1.00 0.00 C ATOM 303 CG1 ILE A 68 12.521 -11.455 -1.725 1.00 0.00 C ATOM 304 CG2 ILE A 68 11.172 -12.526 0.139 1.00 0.00 C ATOM 305 CD1 ILE A 68 13.687 -12.447 -1.674 1.00 0.00 C ATOM 0 H ILE A 68 9.980 -11.264 -1.983 1.00 0.00 H new ATOM 0 HA ILE A 68 10.207 -10.115 0.559 1.00 0.00 H new ATOM 0 HB ILE A 68 12.609 -10.896 0.322 1.00 0.00 H new ATOM 0 HG12 ILE A 68 11.783 -11.815 -2.442 1.00 0.00 H new ATOM 0 HG13 ILE A 68 12.888 -10.498 -2.097 1.00 0.00 H new ATOM 0 HG21 ILE A 68 11.922 -13.316 0.178 1.00 0.00 H new ATOM 0 HG22 ILE A 68 10.758 -12.369 1.135 1.00 0.00 H new ATOM 0 HG23 ILE A 68 10.374 -12.817 -0.544 1.00 0.00 H new ATOM 0 HD11 ILE A 68 14.121 -12.550 -2.669 1.00 0.00 H new ATOM 0 HD12 ILE A 68 14.447 -12.081 -0.983 1.00 0.00 H new ATOM 0 HD13 ILE A 68 13.325 -13.417 -1.334 1.00 0.00 H new ATOM 317 N ASP A 69 11.505 -8.318 -1.818 1.00 0.00 N ATOM 318 CA ASP A 69 11.812 -6.941 -2.229 1.00 0.00 C ATOM 319 C ASP A 69 11.045 -6.490 -3.491 1.00 0.00 C ATOM 320 O ASP A 69 11.042 -5.303 -3.815 1.00 0.00 O ATOM 321 CB ASP A 69 13.332 -6.827 -2.440 1.00 0.00 C ATOM 322 CG ASP A 69 13.815 -5.371 -2.354 1.00 0.00 C ATOM 323 OD1 ASP A 69 13.689 -4.777 -1.253 1.00 0.00 O ATOM 324 OD2 ASP A 69 14.378 -4.845 -3.344 1.00 0.00 O ATOM 0 H ASP A 69 11.419 -8.951 -2.613 1.00 0.00 H new ATOM 0 HA ASP A 69 11.481 -6.270 -1.436 1.00 0.00 H new ATOM 0 HB2 ASP A 69 13.849 -7.426 -1.690 1.00 0.00 H new ATOM 0 HB3 ASP A 69 13.595 -7.240 -3.414 1.00 0.00 H new ATOM 329 N VAL A 70 10.380 -7.432 -4.183 1.00 0.00 N ATOM 330 CA VAL A 70 9.767 -7.303 -5.518 1.00 0.00 C ATOM 331 C VAL A 70 10.639 -6.459 -6.472 1.00 0.00 C ATOM 332 O VAL A 70 11.863 -6.614 -6.481 1.00 0.00 O ATOM 333 CB VAL A 70 8.259 -6.945 -5.385 1.00 0.00 C ATOM 334 CG1 VAL A 70 7.945 -5.472 -5.075 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.490 -7.394 -6.640 1.00 0.00 C ATOM 0 H VAL A 70 10.247 -8.367 -3.799 1.00 0.00 H new ATOM 0 HA VAL A 70 9.751 -8.262 -6.036 1.00 0.00 H new ATOM 0 HB VAL A 70 7.925 -7.494 -4.505 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.866 -5.337 -5.004 1.00 0.00 H new ATOM 0 HG12 VAL A 70 8.408 -5.193 -4.129 1.00 0.00 H new ATOM 0 HG13 VAL A 70 8.338 -4.841 -5.872 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.436 -7.137 -6.532 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.899 -6.891 -7.516 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.590 -8.473 -6.761 1.00 0.00 H new ATOM 345 N THR A 71 10.057 -5.587 -7.290 1.00 0.00 N ATOM 346 CA THR A 71 10.727 -4.392 -7.813 1.00 0.00 C ATOM 347 C THR A 71 9.716 -3.275 -8.008 1.00 0.00 C ATOM 348 O THR A 71 8.580 -3.475 -8.460 1.00 0.00 O ATOM 349 CB THR A 71 11.554 -4.678 -9.084 1.00 0.00 C ATOM 350 OG1 THR A 71 11.951 -3.464 -9.690 1.00 0.00 O ATOM 351 CG2 THR A 71 10.825 -5.502 -10.140 1.00 0.00 C ATOM 0 H THR A 71 9.095 -5.688 -7.615 1.00 0.00 H new ATOM 0 HA THR A 71 11.456 -4.063 -7.073 1.00 0.00 H new ATOM 0 HB THR A 71 12.406 -5.263 -8.738 1.00 0.00 H new ATOM 0 HG1 THR A 71 12.477 -3.656 -10.494 1.00 0.00 H new ATOM 0 HG21 THR A 71 11.480 -5.655 -10.998 1.00 0.00 H new ATOM 0 HG22 THR A 71 10.546 -6.468 -9.719 1.00 0.00 H new ATOM 0 HG23 THR A 71 9.927 -4.973 -10.459 1.00 0.00 H new ATOM 359 N GLU A 72 10.139 -2.065 -7.655 1.00 0.00 N ATOM 360 CA GLU A 72 9.345 -0.869 -7.897 1.00 0.00 C ATOM 361 C GLU A 72 8.980 -0.724 -9.377 1.00 0.00 C ATOM 362 O GLU A 72 7.880 -0.280 -9.679 1.00 0.00 O ATOM 363 CB GLU A 72 10.061 0.377 -7.364 1.00 0.00 C ATOM 364 CG GLU A 72 11.242 0.808 -8.234 1.00 0.00 C ATOM 365 CD GLU A 72 12.072 1.936 -7.593 1.00 0.00 C ATOM 366 OE1 GLU A 72 12.681 1.716 -6.519 1.00 0.00 O ATOM 367 OE2 GLU A 72 12.157 3.043 -8.177 1.00 0.00 O ATOM 0 H GLU A 72 11.033 -1.888 -7.198 1.00 0.00 H new ATOM 0 HA GLU A 72 8.408 -0.973 -7.349 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.347 1.198 -7.298 1.00 0.00 H new ATOM 0 HB3 GLU A 72 10.415 0.180 -6.352 1.00 0.00 H new ATOM 0 HG2 GLU A 72 11.886 -0.052 -8.417 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.871 1.141 -9.203 1.00 0.00 H new ATOM 374 N GLY A 73 9.857 -1.174 -10.284 1.00 0.00 N ATOM 375 CA GLY A 73 9.636 -1.192 -11.727 1.00 0.00 C ATOM 376 C GLY A 73 8.444 -2.059 -12.135 1.00 0.00 C ATOM 377 O GLY A 73 7.735 -1.702 -13.070 1.00 0.00 O ATOM 0 H GLY A 73 10.769 -1.547 -10.020 1.00 0.00 H new ATOM 0 HA2 GLY A 73 9.474 -0.173 -12.078 1.00 0.00 H new ATOM 0 HA3 GLY A 73 10.534 -1.561 -12.223 1.00 0.00 H new ATOM 381 N GLU A 74 8.162 -3.145 -11.410 1.00 0.00 N ATOM 382 CA GLU A 74 6.907 -3.894 -11.545 1.00 0.00 C ATOM 383 C GLU A 74 5.727 -3.057 -11.064 1.00 0.00 C ATOM 384 O GLU A 74 4.789 -2.833 -11.827 1.00 0.00 O ATOM 385 CB GLU A 74 6.959 -5.253 -10.814 1.00 0.00 C ATOM 386 CG GLU A 74 7.451 -6.346 -11.768 1.00 0.00 C ATOM 387 CD GLU A 74 7.410 -7.734 -11.103 1.00 0.00 C ATOM 388 OE1 GLU A 74 6.341 -8.388 -11.129 1.00 0.00 O ATOM 389 OE2 GLU A 74 8.450 -8.192 -10.569 1.00 0.00 O ATOM 0 H GLU A 74 8.797 -3.531 -10.712 1.00 0.00 H new ATOM 0 HA GLU A 74 6.769 -4.109 -12.605 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.623 -5.186 -9.952 1.00 0.00 H new ATOM 0 HB3 GLU A 74 5.970 -5.509 -10.435 1.00 0.00 H new ATOM 0 HG2 GLU A 74 6.833 -6.353 -12.666 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.470 -6.123 -12.085 1.00 0.00 H new ATOM 396 N VAL A 75 5.779 -2.565 -9.821 1.00 0.00 N ATOM 397 CA VAL A 75 4.650 -1.826 -9.209 1.00 0.00 C ATOM 398 C VAL A 75 4.237 -0.584 -10.033 1.00 0.00 C ATOM 399 O VAL A 75 3.055 -0.362 -10.307 1.00 0.00 O ATOM 400 CB VAL A 75 4.958 -1.478 -7.734 1.00 0.00 C ATOM 401 CG1 VAL A 75 3.732 -0.913 -7.005 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.382 -2.736 -6.956 1.00 0.00 C ATOM 0 H VAL A 75 6.591 -2.662 -9.211 1.00 0.00 H new ATOM 0 HA VAL A 75 3.783 -2.487 -9.219 1.00 0.00 H new ATOM 0 HB VAL A 75 5.755 -0.735 -7.764 1.00 0.00 H new ATOM 0 HG11 VAL A 75 3.996 -0.683 -5.973 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.398 -0.004 -7.505 1.00 0.00 H new ATOM 0 HG13 VAL A 75 2.929 -1.650 -7.019 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.594 -2.469 -5.921 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.576 -3.470 -6.984 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.276 -3.161 -7.412 1.00 0.00 H new ATOM 412 N ILE A 76 5.199 0.217 -10.499 1.00 0.00 N ATOM 413 CA ILE A 76 4.944 1.434 -11.277 1.00 0.00 C ATOM 414 C ILE A 76 4.678 1.177 -12.752 1.00 0.00 C ATOM 415 O ILE A 76 3.895 1.919 -13.341 1.00 0.00 O ATOM 416 CB ILE A 76 6.078 2.454 -11.103 1.00 0.00 C ATOM 417 CG1 ILE A 76 7.434 2.022 -11.699 1.00 0.00 C ATOM 418 CG2 ILE A 76 6.238 2.743 -9.615 1.00 0.00 C ATOM 419 CD1 ILE A 76 7.653 2.562 -13.105 1.00 0.00 C ATOM 0 H ILE A 76 6.191 0.036 -10.345 1.00 0.00 H new ATOM 0 HA ILE A 76 4.023 1.851 -10.870 1.00 0.00 H new ATOM 0 HB ILE A 76 5.789 3.343 -11.664 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.239 2.369 -11.051 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.488 0.934 -11.719 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.040 3.467 -9.469 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.306 3.149 -9.221 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.482 1.820 -9.089 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.622 2.228 -13.476 1.00 0.00 H new ATOM 0 HD12 ILE A 76 6.866 2.194 -13.763 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.628 3.652 -13.084 1.00 0.00 H new ATOM 431 N SER A 77 5.231 0.115 -13.348 1.00 0.00 N ATOM 432 CA SER A 77 4.794 -0.309 -14.699 1.00 0.00 C ATOM 433 C SER A 77 3.335 -0.743 -14.677 1.00 0.00 C ATOM 434 O SER A 77 2.602 -0.549 -15.651 1.00 0.00 O ATOM 435 CB SER A 77 5.682 -1.421 -15.264 1.00 0.00 C ATOM 436 OG SER A 77 5.395 -1.680 -16.631 1.00 0.00 O ATOM 0 H SER A 77 5.965 -0.460 -12.935 1.00 0.00 H new ATOM 0 HA SER A 77 4.893 0.552 -15.360 1.00 0.00 H new ATOM 0 HB2 SER A 77 6.730 -1.138 -15.159 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.538 -2.332 -14.683 1.00 0.00 H new ATOM 0 HG SER A 77 5.981 -2.394 -16.959 1.00 0.00 H new ATOM 442 N LEU A 78 2.893 -1.253 -13.528 1.00 0.00 N ATOM 443 CA LEU A 78 1.504 -1.577 -13.277 1.00 0.00 C ATOM 444 C LEU A 78 0.624 -0.360 -12.936 1.00 0.00 C ATOM 445 O LEU A 78 -0.588 -0.450 -13.133 1.00 0.00 O ATOM 446 CB LEU A 78 1.459 -2.644 -12.175 1.00 0.00 C ATOM 447 CG LEU A 78 1.552 -4.070 -12.727 1.00 0.00 C ATOM 448 CD1 LEU A 78 1.908 -5.048 -11.609 1.00 0.00 C ATOM 449 CD2 LEU A 78 0.208 -4.467 -13.346 1.00 0.00 C ATOM 0 H LEU A 78 3.506 -1.453 -12.738 1.00 0.00 H new ATOM 0 HA LEU A 78 1.072 -1.961 -14.201 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.279 -2.475 -11.478 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.533 -2.537 -11.610 1.00 0.00 H new ATOM 0 HG LEU A 78 2.332 -4.105 -13.488 1.00 0.00 H new ATOM 0 HD11 LEU A 78 1.971 -6.058 -12.015 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.869 -4.771 -11.175 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.139 -5.014 -10.838 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.274 -5.482 -13.739 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.571 -4.423 -12.584 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.037 -3.780 -14.156 1.00 0.00 H new ATOM 461 N GLY A 79 1.191 0.769 -12.488 1.00 0.00 N ATOM 462 CA GLY A 79 0.422 1.988 -12.206 1.00 0.00 C ATOM 463 C GLY A 79 0.484 3.085 -13.271 1.00 0.00 C ATOM 464 O GLY A 79 -0.350 3.988 -13.264 1.00 0.00 O ATOM 0 H GLY A 79 2.191 0.862 -12.312 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.622 1.709 -12.061 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.774 2.405 -11.263 1.00 0.00 H new ATOM 468 N LEU A 80 1.447 3.044 -14.192 1.00 0.00 N ATOM 469 CA LEU A 80 1.705 4.113 -15.153 1.00 0.00 C ATOM 470 C LEU A 80 0.574 4.461 -16.138 1.00 0.00 C ATOM 471 O LEU A 80 0.223 5.641 -16.193 1.00 0.00 O ATOM 472 CB LEU A 80 3.042 3.853 -15.870 1.00 0.00 C ATOM 473 CG LEU A 80 4.181 4.693 -15.275 1.00 0.00 C ATOM 474 CD1 LEU A 80 5.512 4.281 -15.900 1.00 0.00 C ATOM 475 CD2 LEU A 80 3.940 6.179 -15.559 1.00 0.00 C ATOM 0 H LEU A 80 2.081 2.251 -14.292 1.00 0.00 H new ATOM 0 HA LEU A 80 1.762 5.020 -14.551 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.294 2.795 -15.797 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.937 4.083 -16.930 1.00 0.00 H new ATOM 0 HG LEU A 80 4.211 4.525 -14.198 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.316 4.881 -15.473 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.699 3.227 -15.696 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.473 4.441 -16.978 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.753 6.767 -15.133 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.900 6.342 -16.636 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.996 6.487 -15.110 1.00 0.00 H new ATOM 487 N PRO A 81 -0.022 3.515 -16.898 1.00 0.00 N ATOM 488 CA PRO A 81 -1.089 3.792 -17.878 1.00 0.00 C ATOM 489 C PRO A 81 -2.463 4.072 -17.244 1.00 0.00 C ATOM 490 O PRO A 81 -3.510 3.680 -17.763 1.00 0.00 O ATOM 491 CB PRO A 81 -1.054 2.595 -18.838 1.00 0.00 C ATOM 492 CG PRO A 81 -0.643 1.445 -17.927 1.00 0.00 C ATOM 493 CD PRO A 81 0.346 2.103 -16.961 1.00 0.00 C ATOM 0 HA PRO A 81 -0.915 4.725 -18.414 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.025 2.418 -19.300 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -0.339 2.746 -19.647 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -1.499 1.022 -17.401 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -0.180 0.633 -18.487 1.00 0.00 H new ATOM 0 HD2 PRO A 81 0.291 1.642 -15.975 1.00 0.00 H new ATOM 0 HD3 PRO A 81 1.371 1.983 -17.312 1.00 0.00 H new ATOM 501 N PHE A 82 -2.448 4.808 -16.131 1.00 0.00 N ATOM 502 CA PHE A 82 -3.601 5.253 -15.363 1.00 0.00 C ATOM 503 C PHE A 82 -3.574 6.762 -15.116 1.00 0.00 C ATOM 504 O PHE A 82 -4.617 7.414 -15.180 1.00 0.00 O ATOM 505 CB PHE A 82 -3.673 4.477 -14.039 1.00 0.00 C ATOM 506 CG PHE A 82 -3.841 2.987 -14.246 1.00 0.00 C ATOM 507 CD1 PHE A 82 -2.756 2.172 -14.626 1.00 0.00 C ATOM 508 CD2 PHE A 82 -5.126 2.438 -14.156 1.00 0.00 C ATOM 509 CE1 PHE A 82 -2.978 0.821 -14.947 1.00 0.00 C ATOM 510 CE2 PHE A 82 -5.360 1.107 -14.515 1.00 0.00 C ATOM 511 CZ PHE A 82 -4.283 0.297 -14.910 1.00 0.00 C ATOM 0 H PHE A 82 -1.571 5.127 -15.720 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.499 5.046 -15.946 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -2.765 4.660 -13.465 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.506 4.854 -13.446 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -1.758 2.583 -14.671 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.945 3.049 -13.806 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -2.148 0.187 -15.221 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.362 0.705 -14.489 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.457 -0.732 -15.186 1.00 0.00 H new ATOM 521 N GLY A 83 -2.382 7.330 -14.895 1.00 0.00 N ATOM 522 CA GLY A 83 -2.159 8.766 -14.890 1.00 0.00 C ATOM 523 C GLY A 83 -0.727 9.123 -15.276 1.00 0.00 C ATOM 524 O GLY A 83 -0.287 8.974 -16.417 1.00 0.00 O ATOM 0 H GLY A 83 -1.537 6.789 -14.713 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.851 9.243 -15.584 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.377 9.163 -13.899 1.00 0.00 H new ATOM 528 N LYS A 84 -0.009 9.575 -14.257 1.00 0.00 N ATOM 529 CA LYS A 84 1.407 9.900 -14.139 1.00 0.00 C ATOM 530 C LYS A 84 1.728 9.596 -12.677 1.00 0.00 C ATOM 531 O LYS A 84 0.902 9.943 -11.828 1.00 0.00 O ATOM 532 CB LYS A 84 1.574 11.400 -14.464 1.00 0.00 C ATOM 533 CG LYS A 84 2.952 11.814 -14.993 1.00 0.00 C ATOM 534 CD LYS A 84 3.337 11.124 -16.318 1.00 0.00 C ATOM 535 CE LYS A 84 4.690 11.604 -16.865 1.00 0.00 C ATOM 536 NZ LYS A 84 4.650 13.010 -17.348 1.00 0.00 N ATOM 0 H LYS A 84 -0.475 9.746 -13.366 1.00 0.00 H new ATOM 0 HA LYS A 84 2.065 9.347 -14.809 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.822 11.679 -15.202 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.363 11.974 -13.562 1.00 0.00 H new ATOM 0 HG2 LYS A 84 2.967 12.894 -15.138 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.706 11.583 -14.240 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.374 10.046 -16.164 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.562 11.314 -17.060 1.00 0.00 H new ATOM 0 HE2 LYS A 84 5.445 11.514 -16.084 1.00 0.00 H new ATOM 0 HE3 LYS A 84 4.998 10.952 -17.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 5.579 13.270 -17.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 3.926 13.102 -18.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 4.417 13.643 -16.556 1.00 0.00 H new ATOM 550 N VAL A 85 2.798 8.875 -12.353 1.00 0.00 N ATOM 551 CA VAL A 85 2.933 8.273 -11.007 1.00 0.00 C ATOM 552 C VAL A 85 4.272 8.639 -10.384 1.00 0.00 C ATOM 553 O VAL A 85 5.313 8.046 -10.670 1.00 0.00 O ATOM 554 CB VAL A 85 2.510 6.792 -10.947 1.00 0.00 C ATOM 555 CG1 VAL A 85 2.405 6.265 -9.512 1.00 0.00 C ATOM 556 CG2 VAL A 85 1.419 6.476 -11.964 1.00 0.00 C ATOM 0 H VAL A 85 3.578 8.689 -12.984 1.00 0.00 H new ATOM 0 HA VAL A 85 2.194 8.724 -10.345 1.00 0.00 H new ATOM 0 HB VAL A 85 3.311 6.148 -11.309 1.00 0.00 H new ATOM 0 HG11 VAL A 85 2.104 5.218 -9.530 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.373 6.356 -9.019 1.00 0.00 H new ATOM 0 HG13 VAL A 85 1.663 6.846 -8.964 1.00 0.00 H new ATOM 0 HG21 VAL A 85 1.148 5.423 -11.891 1.00 0.00 H new ATOM 0 HG22 VAL A 85 0.543 7.091 -11.761 1.00 0.00 H new ATOM 0 HG23 VAL A 85 1.786 6.687 -12.968 1.00 0.00 H new ATOM 566 N THR A 86 4.226 9.736 -9.624 1.00 0.00 N ATOM 567 CA THR A 86 5.363 10.552 -9.195 1.00 0.00 C ATOM 568 C THR A 86 6.095 9.962 -7.993 1.00 0.00 C ATOM 569 O THR A 86 7.325 10.053 -7.945 1.00 0.00 O ATOM 570 CB THR A 86 4.917 12.006 -8.961 1.00 0.00 C ATOM 571 OG1 THR A 86 6.013 12.825 -8.630 1.00 0.00 O ATOM 572 CG2 THR A 86 3.858 12.158 -7.874 1.00 0.00 C ATOM 0 H THR A 86 3.341 10.099 -9.271 1.00 0.00 H new ATOM 0 HA THR A 86 6.096 10.551 -10.002 1.00 0.00 H new ATOM 0 HB THR A 86 4.473 12.319 -9.906 1.00 0.00 H new ATOM 0 HG1 THR A 86 5.704 13.744 -8.488 1.00 0.00 H new ATOM 0 HG21 THR A 86 3.595 13.210 -7.767 1.00 0.00 H new ATOM 0 HG22 THR A 86 2.970 11.588 -8.149 1.00 0.00 H new ATOM 0 HG23 THR A 86 4.251 11.784 -6.928 1.00 0.00 H new ATOM 580 N ASN A 87 5.396 9.276 -7.073 1.00 0.00 N ATOM 581 CA ASN A 87 6.046 8.585 -5.960 1.00 0.00 C ATOM 582 C ASN A 87 5.594 7.126 -5.765 1.00 0.00 C ATOM 583 O ASN A 87 4.525 6.696 -6.199 1.00 0.00 O ATOM 584 CB ASN A 87 5.871 9.426 -4.677 1.00 0.00 C ATOM 585 CG ASN A 87 6.599 10.763 -4.716 1.00 0.00 C ATOM 586 OD1 ASN A 87 7.819 10.830 -4.780 1.00 0.00 O ATOM 587 ND2 ASN A 87 5.874 11.857 -4.665 1.00 0.00 N ATOM 0 H ASN A 87 4.380 9.189 -7.083 1.00 0.00 H new ATOM 0 HA ASN A 87 7.105 8.498 -6.204 1.00 0.00 H new ATOM 0 HB2 ASN A 87 4.808 9.606 -4.513 1.00 0.00 H new ATOM 0 HB3 ASN A 87 6.232 8.851 -3.824 1.00 0.00 H new ATOM 0 HD21 ASN A 87 6.328 12.771 -4.679 1.00 0.00 H new ATOM 0 HD22 ASN A 87 4.857 11.793 -4.612 1.00 0.00 H new ATOM 594 N LEU A 88 6.428 6.370 -5.056 1.00 0.00 N ATOM 595 CA LEU A 88 6.151 5.054 -4.485 1.00 0.00 C ATOM 596 C LEU A 88 6.925 4.876 -3.165 1.00 0.00 C ATOM 597 O LEU A 88 7.832 5.654 -2.853 1.00 0.00 O ATOM 598 CB LEU A 88 6.515 3.967 -5.516 1.00 0.00 C ATOM 599 CG LEU A 88 8.038 3.704 -5.608 1.00 0.00 C ATOM 600 CD1 LEU A 88 8.405 2.348 -4.997 1.00 0.00 C ATOM 601 CD2 LEU A 88 8.514 3.736 -7.050 1.00 0.00 C ATOM 0 H LEU A 88 7.378 6.680 -4.851 1.00 0.00 H new ATOM 0 HA LEU A 88 5.090 4.962 -4.253 1.00 0.00 H new ATOM 0 HB2 LEU A 88 6.007 3.039 -5.252 1.00 0.00 H new ATOM 0 HB3 LEU A 88 6.144 4.265 -6.496 1.00 0.00 H new ATOM 0 HG LEU A 88 8.531 4.498 -5.046 1.00 0.00 H new ATOM 0 HD11 LEU A 88 9.481 2.192 -5.077 1.00 0.00 H new ATOM 0 HD12 LEU A 88 8.113 2.331 -3.947 1.00 0.00 H new ATOM 0 HD13 LEU A 88 7.883 1.555 -5.532 1.00 0.00 H new ATOM 0 HD21 LEU A 88 9.587 3.548 -7.083 1.00 0.00 H new ATOM 0 HD22 LEU A 88 7.993 2.968 -7.622 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.304 4.715 -7.481 1.00 0.00 H new ATOM 613 N LEU A 89 6.586 3.840 -2.406 1.00 0.00 N ATOM 614 CA LEU A 89 7.281 3.421 -1.187 1.00 0.00 C ATOM 615 C LEU A 89 7.140 1.905 -1.030 1.00 0.00 C ATOM 616 O LEU A 89 6.142 1.322 -1.460 1.00 0.00 O ATOM 617 CB LEU A 89 6.712 4.255 -0.021 1.00 0.00 C ATOM 618 CG LEU A 89 6.602 3.693 1.398 1.00 0.00 C ATOM 619 CD1 LEU A 89 5.697 2.508 1.553 1.00 0.00 C ATOM 620 CD2 LEU A 89 7.931 3.538 2.140 1.00 0.00 C ATOM 0 H LEU A 89 5.789 3.244 -2.629 1.00 0.00 H new ATOM 0 HA LEU A 89 8.354 3.609 -1.217 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.318 5.159 0.045 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.709 4.564 -0.315 1.00 0.00 H new ATOM 0 HG LEU A 89 6.085 4.499 1.919 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.691 2.189 2.595 1.00 0.00 H new ATOM 0 HD12 LEU A 89 4.686 2.780 1.251 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.056 1.692 0.926 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.747 3.133 3.135 1.00 0.00 H new ATOM 0 HD22 LEU A 89 8.580 2.859 1.586 1.00 0.00 H new ATOM 0 HD23 LEU A 89 8.414 4.511 2.228 1.00 0.00 H new ATOM 632 N MET A 90 8.115 1.278 -0.372 1.00 0.00 N ATOM 633 CA MET A 90 8.151 -0.155 -0.072 1.00 0.00 C ATOM 634 C MET A 90 8.379 -0.378 1.427 1.00 0.00 C ATOM 635 O MET A 90 9.448 -0.060 1.951 1.00 0.00 O ATOM 636 CB MET A 90 9.209 -0.831 -0.960 1.00 0.00 C ATOM 637 CG MET A 90 8.867 -0.574 -2.434 1.00 0.00 C ATOM 638 SD MET A 90 9.520 -1.788 -3.603 1.00 0.00 S ATOM 639 CE MET A 90 8.069 -1.771 -4.674 1.00 0.00 C ATOM 0 H MET A 90 8.934 1.773 -0.019 1.00 0.00 H new ATOM 0 HA MET A 90 7.192 -0.619 -0.303 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.199 -0.438 -0.730 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.237 -1.902 -0.762 1.00 0.00 H new ATOM 0 HG2 MET A 90 7.782 -0.541 -2.538 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.243 0.411 -2.711 1.00 0.00 H new ATOM 0 HE1 MET A 90 8.235 -2.434 -5.523 1.00 0.00 H new ATOM 0 HE2 MET A 90 7.199 -2.111 -4.113 1.00 0.00 H new ATOM 0 HE3 MET A 90 7.895 -0.757 -5.035 1.00 0.00 H new ATOM 649 N LEU A 91 7.356 -0.870 2.137 1.00 0.00 N ATOM 650 CA LEU A 91 7.408 -1.178 3.574 1.00 0.00 C ATOM 651 C LEU A 91 8.267 -2.438 3.818 1.00 0.00 C ATOM 652 O LEU A 91 7.748 -3.544 4.009 1.00 0.00 O ATOM 653 CB LEU A 91 5.993 -1.381 4.161 1.00 0.00 C ATOM 654 CG LEU A 91 4.978 -0.217 4.300 1.00 0.00 C ATOM 655 CD1 LEU A 91 5.633 1.040 4.852 1.00 0.00 C ATOM 656 CD2 LEU A 91 4.176 0.113 3.045 1.00 0.00 C ATOM 0 H LEU A 91 6.447 -1.070 1.719 1.00 0.00 H new ATOM 0 HA LEU A 91 7.863 -0.327 4.081 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.510 -2.147 3.554 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.125 -1.801 5.158 1.00 0.00 H new ATOM 0 HG LEU A 91 4.249 -0.597 5.016 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.889 1.832 4.934 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.050 0.830 5.837 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.430 1.360 4.181 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.498 0.941 3.254 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.857 0.395 2.242 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.599 -0.761 2.741 1.00 0.00 H new ATOM 668 N LYS A 92 9.592 -2.257 3.809 1.00 0.00 N ATOM 669 CA LYS A 92 10.640 -3.293 3.772 1.00 0.00 C ATOM 670 C LYS A 92 10.403 -4.471 4.728 1.00 0.00 C ATOM 671 O LYS A 92 10.510 -5.624 4.315 1.00 0.00 O ATOM 672 CB LYS A 92 11.996 -2.595 4.020 1.00 0.00 C ATOM 673 CG LYS A 92 13.251 -3.485 4.099 1.00 0.00 C ATOM 674 CD LYS A 92 13.720 -4.117 2.777 1.00 0.00 C ATOM 675 CE LYS A 92 12.919 -5.368 2.390 1.00 0.00 C ATOM 676 NZ LYS A 92 13.498 -6.051 1.210 1.00 0.00 N ATOM 0 H LYS A 92 9.992 -1.319 3.829 1.00 0.00 H new ATOM 0 HA LYS A 92 10.625 -3.764 2.789 1.00 0.00 H new ATOM 0 HB2 LYS A 92 12.150 -1.867 3.224 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.921 -2.036 4.953 1.00 0.00 H new ATOM 0 HG2 LYS A 92 14.069 -2.889 4.503 1.00 0.00 H new ATOM 0 HG3 LYS A 92 13.058 -4.286 4.812 1.00 0.00 H new ATOM 0 HD2 LYS A 92 13.638 -3.379 1.979 1.00 0.00 H new ATOM 0 HD3 LYS A 92 14.775 -4.380 2.861 1.00 0.00 H new ATOM 0 HE2 LYS A 92 12.894 -6.058 3.233 1.00 0.00 H new ATOM 0 HE3 LYS A 92 11.887 -5.087 2.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 12.865 -6.819 0.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 13.609 -5.368 0.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 14.427 -6.446 1.459 1.00 0.00 H new ATOM 690 N GLY A 93 10.075 -4.185 5.988 1.00 0.00 N ATOM 691 CA GLY A 93 9.935 -5.195 7.046 1.00 0.00 C ATOM 692 C GLY A 93 8.616 -5.980 7.067 1.00 0.00 C ATOM 693 O GLY A 93 8.524 -6.969 7.797 1.00 0.00 O ATOM 0 H GLY A 93 9.896 -3.234 6.310 1.00 0.00 H new ATOM 0 HA2 GLY A 93 10.755 -5.907 6.950 1.00 0.00 H new ATOM 0 HA3 GLY A 93 10.054 -4.700 8.010 1.00 0.00 H new ATOM 697 N LYS A 94 7.592 -5.551 6.310 1.00 0.00 N ATOM 698 CA LYS A 94 6.228 -6.129 6.336 1.00 0.00 C ATOM 699 C LYS A 94 5.682 -6.557 4.965 1.00 0.00 C ATOM 700 O LYS A 94 4.536 -6.998 4.879 1.00 0.00 O ATOM 701 CB LYS A 94 5.241 -5.177 7.042 1.00 0.00 C ATOM 702 CG LYS A 94 5.571 -4.851 8.514 1.00 0.00 C ATOM 703 CD LYS A 94 5.728 -3.356 8.828 1.00 0.00 C ATOM 704 CE LYS A 94 7.044 -2.778 8.287 1.00 0.00 C ATOM 705 NZ LYS A 94 7.279 -1.399 8.792 1.00 0.00 N ATOM 0 H LYS A 94 7.686 -4.779 5.650 1.00 0.00 H new ATOM 0 HA LYS A 94 6.323 -7.052 6.908 1.00 0.00 H new ATOM 0 HB2 LYS A 94 5.200 -4.243 6.481 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.245 -5.618 7.000 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.782 -5.259 9.146 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.494 -5.363 8.786 1.00 0.00 H new ATOM 0 HD2 LYS A 94 4.890 -2.808 8.398 1.00 0.00 H new ATOM 0 HD3 LYS A 94 5.686 -3.208 9.907 1.00 0.00 H new ATOM 0 HE2 LYS A 94 7.874 -3.421 8.581 1.00 0.00 H new ATOM 0 HE3 LYS A 94 7.018 -2.769 7.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 8.175 -1.037 8.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 6.499 -0.781 8.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 7.327 -1.413 9.831 1.00 0.00 H new ATOM 719 N ASN A 95 6.471 -6.441 3.894 1.00 0.00 N ATOM 720 CA ASN A 95 6.085 -6.786 2.512 1.00 0.00 C ATOM 721 C ASN A 95 4.863 -6.001 1.989 1.00 0.00 C ATOM 722 O ASN A 95 4.036 -6.520 1.230 1.00 0.00 O ATOM 723 CB ASN A 95 5.924 -8.308 2.368 1.00 0.00 C ATOM 724 CG ASN A 95 7.220 -9.096 2.517 1.00 0.00 C ATOM 725 OD1 ASN A 95 8.005 -8.920 3.440 1.00 0.00 O ATOM 726 ND2 ASN A 95 7.482 -10.011 1.621 1.00 0.00 N ATOM 0 H ASN A 95 7.428 -6.094 3.961 1.00 0.00 H new ATOM 0 HA ASN A 95 6.901 -6.467 1.864 1.00 0.00 H new ATOM 0 HB2 ASN A 95 5.212 -8.658 3.116 1.00 0.00 H new ATOM 0 HB3 ASN A 95 5.492 -8.524 1.391 1.00 0.00 H new ATOM 0 HD21 ASN A 95 8.333 -10.569 1.695 1.00 0.00 H new ATOM 0 HD22 ASN A 95 6.836 -10.167 0.847 1.00 0.00 H new ATOM 733 N GLN A 96 4.753 -4.733 2.383 1.00 0.00 N ATOM 734 CA GLN A 96 3.712 -3.826 1.903 1.00 0.00 C ATOM 735 C GLN A 96 4.313 -2.711 1.004 1.00 0.00 C ATOM 736 O GLN A 96 5.533 -2.611 0.862 1.00 0.00 O ATOM 737 CB GLN A 96 2.926 -3.267 3.086 1.00 0.00 C ATOM 738 CG GLN A 96 2.363 -4.278 4.093 1.00 0.00 C ATOM 739 CD GLN A 96 2.139 -3.570 5.419 1.00 0.00 C ATOM 740 OE1 GLN A 96 2.475 -4.030 6.496 1.00 0.00 O ATOM 741 NE2 GLN A 96 1.616 -2.375 5.399 1.00 0.00 N ATOM 0 H GLN A 96 5.391 -4.302 3.052 1.00 0.00 H new ATOM 0 HA GLN A 96 3.014 -4.380 1.276 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.574 -2.577 3.626 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.094 -2.682 2.693 1.00 0.00 H new ATOM 0 HG2 GLN A 96 1.426 -4.697 3.725 1.00 0.00 H new ATOM 0 HG3 GLN A 96 3.056 -5.110 4.221 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.324 -1.961 4.514 1.00 0.00 H new ATOM 0 HE22 GLN A 96 1.499 -1.855 6.269 1.00 0.00 H new ATOM 750 N ALA A 97 3.494 -1.839 0.415 1.00 0.00 N ATOM 751 CA ALA A 97 3.910 -0.684 -0.402 1.00 0.00 C ATOM 752 C ALA A 97 2.821 0.385 -0.475 1.00 0.00 C ATOM 753 O ALA A 97 1.664 0.129 -0.144 1.00 0.00 O ATOM 754 CB ALA A 97 4.178 -1.217 -1.828 1.00 0.00 C ATOM 0 H ALA A 97 2.480 -1.916 0.493 1.00 0.00 H new ATOM 0 HA ALA A 97 4.792 -0.224 0.045 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.490 -0.394 -2.471 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.966 -1.969 -1.793 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.267 -1.664 -2.227 1.00 0.00 H new ATOM 760 N PHE A 98 3.211 1.560 -0.967 1.00 0.00 N ATOM 761 CA PHE A 98 2.351 2.637 -1.460 1.00 0.00 C ATOM 762 C PHE A 98 2.680 2.870 -2.951 1.00 0.00 C ATOM 763 O PHE A 98 3.844 2.733 -3.346 1.00 0.00 O ATOM 764 CB PHE A 98 2.679 3.962 -0.752 1.00 0.00 C ATOM 765 CG PHE A 98 2.224 4.245 0.671 1.00 0.00 C ATOM 766 CD1 PHE A 98 1.898 3.224 1.582 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.161 5.584 1.106 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.489 3.543 2.883 1.00 0.00 C ATOM 769 CE2 PHE A 98 1.723 5.911 2.391 1.00 0.00 C ATOM 770 CZ PHE A 98 1.377 4.884 3.268 1.00 0.00 C ATOM 0 H PHE A 98 4.200 1.801 -1.037 1.00 0.00 H new ATOM 0 HA PHE A 98 1.313 2.354 -1.288 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.764 4.065 -0.762 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.278 4.761 -1.376 1.00 0.00 H new ATOM 0 HD1 PHE A 98 1.963 2.190 1.277 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.458 6.374 0.432 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.261 2.757 3.587 1.00 0.00 H new ATOM 0 HE2 PHE A 98 1.653 6.943 2.701 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.018 5.126 4.257 1.00 0.00 H new ATOM 780 N ILE A 99 1.730 3.358 -3.751 1.00 0.00 N ATOM 781 CA ILE A 99 1.970 3.946 -5.071 1.00 0.00 C ATOM 782 C ILE A 99 1.145 5.236 -5.192 1.00 0.00 C ATOM 783 O ILE A 99 -0.046 5.253 -4.877 1.00 0.00 O ATOM 784 CB ILE A 99 1.712 2.903 -6.178 1.00 0.00 C ATOM 785 CG1 ILE A 99 1.974 3.529 -7.557 1.00 0.00 C ATOM 786 CG2 ILE A 99 0.297 2.310 -6.098 1.00 0.00 C ATOM 787 CD1 ILE A 99 2.167 2.511 -8.691 1.00 0.00 C ATOM 0 H ILE A 99 0.744 3.355 -3.491 1.00 0.00 H new ATOM 0 HA ILE A 99 3.014 4.232 -5.197 1.00 0.00 H new ATOM 0 HB ILE A 99 2.405 2.075 -6.027 1.00 0.00 H new ATOM 0 HG12 ILE A 99 1.139 4.182 -7.810 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.863 4.157 -7.494 1.00 0.00 H new ATOM 0 HG21 ILE A 99 0.162 1.581 -6.897 1.00 0.00 H new ATOM 0 HG22 ILE A 99 0.162 1.820 -5.134 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.438 3.107 -6.206 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.346 3.039 -9.627 1.00 0.00 H new ATOM 0 HD12 ILE A 99 3.021 1.872 -8.465 1.00 0.00 H new ATOM 0 HD13 ILE A 99 1.271 1.898 -8.786 1.00 0.00 H new ATOM 799 N GLU A 100 1.798 6.343 -5.551 1.00 0.00 N ATOM 800 CA GLU A 100 1.295 7.711 -5.393 1.00 0.00 C ATOM 801 C GLU A 100 1.424 8.539 -6.660 1.00 0.00 C ATOM 802 O GLU A 100 2.504 8.727 -7.225 1.00 0.00 O ATOM 803 CB GLU A 100 2.001 8.393 -4.223 1.00 0.00 C ATOM 804 CG GLU A 100 1.414 9.777 -3.898 1.00 0.00 C ATOM 805 CD GLU A 100 2.060 10.974 -4.623 1.00 0.00 C ATOM 806 OE1 GLU A 100 3.130 11.446 -4.176 1.00 0.00 O ATOM 807 OE2 GLU A 100 1.438 11.515 -5.563 1.00 0.00 O ATOM 0 H GLU A 100 2.725 6.311 -5.975 1.00 0.00 H new ATOM 0 HA GLU A 100 0.228 7.641 -5.182 1.00 0.00 H new ATOM 0 HB2 GLU A 100 1.930 7.757 -3.341 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.061 8.498 -4.455 1.00 0.00 H new ATOM 0 HG2 GLU A 100 0.351 9.764 -4.138 1.00 0.00 H new ATOM 0 HG3 GLU A 100 1.497 9.941 -2.824 1.00 0.00 H new ATOM 814 N MET A 101 0.275 9.011 -7.117 1.00 0.00 N ATOM 815 CA MET A 101 0.084 9.442 -8.497 1.00 0.00 C ATOM 816 C MET A 101 -0.534 10.836 -8.626 1.00 0.00 C ATOM 817 O MET A 101 -1.065 11.421 -7.687 1.00 0.00 O ATOM 818 CB MET A 101 -0.625 8.347 -9.297 1.00 0.00 C ATOM 819 CG MET A 101 -1.532 7.425 -8.499 1.00 0.00 C ATOM 820 SD MET A 101 -2.560 6.421 -9.575 1.00 0.00 S ATOM 821 CE MET A 101 -1.391 5.879 -10.836 1.00 0.00 C ATOM 0 H MET A 101 -0.559 9.107 -6.538 1.00 0.00 H new ATOM 0 HA MET A 101 1.066 9.576 -8.950 1.00 0.00 H new ATOM 0 HB2 MET A 101 -1.218 8.821 -10.079 1.00 0.00 H new ATOM 0 HB3 MET A 101 0.131 7.740 -9.795 1.00 0.00 H new ATOM 0 HG2 MET A 101 -0.927 6.778 -7.864 1.00 0.00 H new ATOM 0 HG3 MET A 101 -2.165 8.018 -7.839 1.00 0.00 H new ATOM 0 HE1 MET A 101 -1.836 5.076 -11.424 1.00 0.00 H new ATOM 0 HE2 MET A 101 -1.148 6.716 -11.491 1.00 0.00 H new ATOM 0 HE3 MET A 101 -0.481 5.517 -10.357 1.00 0.00 H new ATOM 831 N ASN A 102 -0.389 11.399 -9.821 1.00 0.00 N ATOM 832 CA ASN A 102 -0.467 12.843 -10.080 1.00 0.00 C ATOM 833 C ASN A 102 -1.901 13.420 -10.087 1.00 0.00 C ATOM 834 O ASN A 102 -2.073 14.641 -10.081 1.00 0.00 O ATOM 835 CB ASN A 102 0.291 13.110 -11.398 1.00 0.00 C ATOM 836 CG ASN A 102 -0.570 13.053 -12.638 1.00 0.00 C ATOM 837 OD1 ASN A 102 -1.167 11.920 -12.904 1.00 0.00 O flip ATOM 838 ND2 ASN A 102 -0.688 14.003 -13.394 1.00 0.00 N flip ATOM 0 H ASN A 102 -0.209 10.853 -10.664 1.00 0.00 H new ATOM 0 HA ASN A 102 -0.000 13.374 -9.250 1.00 0.00 H new ATOM 0 HB2 ASN A 102 0.759 14.093 -11.341 1.00 0.00 H new ATOM 0 HB3 ASN A 102 1.094 12.380 -11.495 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -0.220 14.884 -13.182 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -1.254 13.916 -14.238 1.00 0.00 H new ATOM 845 N THR A 103 -2.926 12.560 -10.121 1.00 0.00 N ATOM 846 CA THR A 103 -4.351 12.937 -10.126 1.00 0.00 C ATOM 847 C THR A 103 -5.181 11.946 -9.303 1.00 0.00 C ATOM 848 O THR A 103 -4.947 10.729 -9.303 1.00 0.00 O ATOM 849 CB THR A 103 -4.941 13.151 -11.552 1.00 0.00 C ATOM 850 OG1 THR A 103 -6.112 12.399 -11.776 1.00 0.00 O ATOM 851 CG2 THR A 103 -4.019 12.817 -12.725 1.00 0.00 C ATOM 0 H THR A 103 -2.786 11.550 -10.147 1.00 0.00 H new ATOM 0 HA THR A 103 -4.410 13.914 -9.647 1.00 0.00 H new ATOM 0 HB THR A 103 -5.123 14.226 -11.539 1.00 0.00 H new ATOM 0 HG1 THR A 103 -6.442 12.570 -12.683 1.00 0.00 H new ATOM 0 HG21 THR A 103 -4.541 13.006 -13.663 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.126 13.440 -12.675 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.732 11.767 -12.675 1.00 0.00 H new ATOM 859 N GLU A 104 -6.174 12.491 -8.598 1.00 0.00 N ATOM 860 CA GLU A 104 -7.144 11.718 -7.818 1.00 0.00 C ATOM 861 C GLU A 104 -7.960 10.773 -8.704 1.00 0.00 C ATOM 862 O GLU A 104 -8.316 9.673 -8.285 1.00 0.00 O ATOM 863 CB GLU A 104 -8.107 12.669 -7.080 1.00 0.00 C ATOM 864 CG GLU A 104 -7.388 13.717 -6.224 1.00 0.00 C ATOM 865 CD GLU A 104 -8.394 14.544 -5.399 1.00 0.00 C ATOM 866 OE1 GLU A 104 -8.879 15.589 -5.895 1.00 0.00 O ATOM 867 OE2 GLU A 104 -8.692 14.158 -4.244 1.00 0.00 O ATOM 0 H GLU A 104 -6.330 13.498 -8.552 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.582 11.120 -7.101 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.736 13.177 -7.811 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -8.769 12.082 -6.443 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -6.683 13.223 -5.555 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.808 14.380 -6.866 1.00 0.00 H new ATOM 874 N GLU A 105 -8.239 11.179 -9.945 1.00 0.00 N ATOM 875 CA GLU A 105 -8.978 10.373 -10.913 1.00 0.00 C ATOM 876 C GLU A 105 -8.140 9.247 -11.515 1.00 0.00 C ATOM 877 O GLU A 105 -8.670 8.152 -11.712 1.00 0.00 O ATOM 878 CB GLU A 105 -9.539 11.248 -12.043 1.00 0.00 C ATOM 879 CG GLU A 105 -10.648 12.184 -11.543 1.00 0.00 C ATOM 880 CD GLU A 105 -11.241 12.998 -12.710 1.00 0.00 C ATOM 881 OE1 GLU A 105 -12.216 12.529 -13.349 1.00 0.00 O ATOM 882 OE2 GLU A 105 -10.749 14.116 -12.991 1.00 0.00 O ATOM 0 H GLU A 105 -7.953 12.088 -10.308 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.797 9.916 -10.358 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.734 11.839 -12.479 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -9.931 10.611 -12.835 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.434 11.601 -11.063 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.247 12.860 -10.788 1.00 0.00 H new ATOM 889 N ALA A 106 -6.840 9.462 -11.753 1.00 0.00 N ATOM 890 CA ALA A 106 -5.929 8.372 -12.092 1.00 0.00 C ATOM 891 C ALA A 106 -5.945 7.302 -11.008 1.00 0.00 C ATOM 892 O ALA A 106 -6.160 6.132 -11.299 1.00 0.00 O ATOM 893 CB ALA A 106 -4.504 8.877 -12.283 1.00 0.00 C ATOM 0 H ALA A 106 -6.400 10.381 -11.716 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.274 7.941 -13.032 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -3.852 8.040 -12.534 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.483 9.609 -13.090 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.157 9.343 -11.361 1.00 0.00 H new ATOM 899 N ALA A 107 -5.748 7.684 -9.747 1.00 0.00 N ATOM 900 CA ALA A 107 -5.743 6.681 -8.693 1.00 0.00 C ATOM 901 C ALA A 107 -7.108 6.043 -8.423 1.00 0.00 C ATOM 902 O ALA A 107 -7.181 4.832 -8.239 1.00 0.00 O ATOM 903 CB ALA A 107 -5.198 7.320 -7.450 1.00 0.00 C ATOM 0 H ALA A 107 -5.595 8.645 -9.441 1.00 0.00 H new ATOM 0 HA ALA A 107 -5.114 5.855 -9.025 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.183 6.589 -6.642 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -4.184 7.675 -7.638 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -5.830 8.161 -7.166 1.00 0.00 H new ATOM 909 N ASN A 108 -8.193 6.813 -8.459 1.00 0.00 N ATOM 910 CA ASN A 108 -9.547 6.267 -8.424 1.00 0.00 C ATOM 911 C ASN A 108 -9.761 5.232 -9.545 1.00 0.00 C ATOM 912 O ASN A 108 -10.183 4.115 -9.261 1.00 0.00 O ATOM 913 CB ASN A 108 -10.544 7.430 -8.479 1.00 0.00 C ATOM 914 CG ASN A 108 -11.985 6.945 -8.544 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.578 6.821 -9.604 1.00 0.00 O ATOM 916 ND2 ASN A 108 -12.585 6.647 -7.415 1.00 0.00 N ATOM 0 H ASN A 108 -8.158 7.831 -8.513 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.710 5.723 -7.494 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -10.413 8.061 -7.600 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.331 8.049 -9.350 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -13.548 6.311 -7.422 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -12.088 6.751 -6.530 1.00 0.00 H new ATOM 923 N THR A 109 -9.393 5.537 -10.792 1.00 0.00 N ATOM 924 CA THR A 109 -9.468 4.563 -11.885 1.00 0.00 C ATOM 925 C THR A 109 -8.510 3.388 -11.656 1.00 0.00 C ATOM 926 O THR A 109 -8.860 2.258 -11.991 1.00 0.00 O ATOM 927 CB THR A 109 -9.283 5.237 -13.265 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.235 4.711 -14.167 1.00 0.00 O ATOM 929 CG2 THR A 109 -7.924 5.059 -13.937 1.00 0.00 C ATOM 0 H THR A 109 -9.039 6.452 -11.071 1.00 0.00 H new ATOM 0 HA THR A 109 -10.473 4.141 -11.889 1.00 0.00 H new ATOM 0 HB THR A 109 -9.394 6.300 -13.051 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.124 5.135 -15.043 1.00 0.00 H new ATOM 0 HG21 THR A 109 -7.921 5.578 -14.896 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.145 5.474 -13.298 1.00 0.00 H new ATOM 0 HG23 THR A 109 -7.734 3.998 -14.098 1.00 0.00 H new ATOM 937 N MET A 110 -7.351 3.610 -11.015 1.00 0.00 N ATOM 938 CA MET A 110 -6.354 2.581 -10.729 1.00 0.00 C ATOM 939 C MET A 110 -6.933 1.561 -9.737 1.00 0.00 C ATOM 940 O MET A 110 -7.055 0.370 -10.031 1.00 0.00 O ATOM 941 CB MET A 110 -5.006 3.176 -10.225 1.00 0.00 C ATOM 942 CG MET A 110 -3.921 2.147 -10.584 1.00 0.00 C ATOM 943 SD MET A 110 -2.199 2.544 -10.204 1.00 0.00 S ATOM 944 CE MET A 110 -2.318 3.207 -8.539 1.00 0.00 C ATOM 0 H MET A 110 -7.081 4.533 -10.676 1.00 0.00 H new ATOM 0 HA MET A 110 -6.120 2.071 -11.663 1.00 0.00 H new ATOM 0 HB2 MET A 110 -4.803 4.137 -10.699 1.00 0.00 H new ATOM 0 HB3 MET A 110 -5.036 3.351 -9.150 1.00 0.00 H new ATOM 0 HG2 MET A 110 -4.167 1.215 -10.075 1.00 0.00 H new ATOM 0 HG3 MET A 110 -3.988 1.953 -11.655 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.341 3.571 -8.222 1.00 0.00 H new ATOM 0 HE2 MET A 110 -3.034 4.029 -8.525 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.652 2.424 -7.858 1.00 0.00 H new ATOM 954 N VAL A 111 -7.357 2.048 -8.571 1.00 0.00 N ATOM 955 CA VAL A 111 -7.982 1.259 -7.512 1.00 0.00 C ATOM 956 C VAL A 111 -9.237 0.547 -8.008 1.00 0.00 C ATOM 957 O VAL A 111 -9.401 -0.632 -7.732 1.00 0.00 O ATOM 958 CB VAL A 111 -8.234 2.134 -6.268 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.610 2.762 -6.140 1.00 0.00 C ATOM 960 CG2 VAL A 111 -8.012 1.326 -4.989 1.00 0.00 C ATOM 0 H VAL A 111 -7.272 3.036 -8.331 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.294 0.469 -7.212 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.521 2.947 -6.404 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.657 3.351 -5.224 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.796 3.409 -6.997 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.366 1.978 -6.106 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -8.195 1.960 -4.122 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.698 0.479 -4.970 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.985 0.962 -4.962 1.00 0.00 H new ATOM 970 N ASN A 112 -10.082 1.208 -8.809 1.00 0.00 N ATOM 971 CA ASN A 112 -11.307 0.612 -9.350 1.00 0.00 C ATOM 972 C ASN A 112 -11.005 -0.540 -10.316 1.00 0.00 C ATOM 973 O ASN A 112 -11.608 -1.605 -10.184 1.00 0.00 O ATOM 974 CB ASN A 112 -12.184 1.694 -9.992 1.00 0.00 C ATOM 975 CG ASN A 112 -13.049 2.410 -8.958 1.00 0.00 C ATOM 976 OD1 ASN A 112 -14.271 2.325 -8.973 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.465 3.100 -8.006 1.00 0.00 N ATOM 0 H ASN A 112 -9.934 2.174 -9.100 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.867 0.173 -8.524 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.551 2.420 -10.502 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -12.823 1.241 -10.750 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -13.028 3.558 -7.289 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.448 3.178 -7.983 1.00 0.00 H new ATOM 984 N TYR A 113 -10.018 -0.388 -11.205 1.00 0.00 N ATOM 985 CA TYR A 113 -9.466 -1.501 -11.995 1.00 0.00 C ATOM 986 C TYR A 113 -9.008 -2.669 -11.105 1.00 0.00 C ATOM 987 O TYR A 113 -9.261 -3.826 -11.430 1.00 0.00 O ATOM 988 CB TYR A 113 -8.347 -0.994 -12.934 1.00 0.00 C ATOM 989 CG TYR A 113 -7.092 -1.844 -13.037 1.00 0.00 C ATOM 990 CD1 TYR A 113 -7.140 -3.148 -13.570 1.00 0.00 C ATOM 991 CD2 TYR A 113 -5.862 -1.315 -12.595 1.00 0.00 C ATOM 992 CE1 TYR A 113 -5.968 -3.925 -13.652 1.00 0.00 C ATOM 993 CE2 TYR A 113 -4.686 -2.076 -12.711 1.00 0.00 C ATOM 994 CZ TYR A 113 -4.732 -3.379 -13.250 1.00 0.00 C ATOM 995 OH TYR A 113 -3.595 -4.118 -13.387 1.00 0.00 O ATOM 0 H TYR A 113 -9.576 0.511 -11.400 1.00 0.00 H new ATOM 0 HA TYR A 113 -10.263 -1.901 -12.621 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -8.767 -0.888 -13.934 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -8.054 0.003 -12.604 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -8.079 -3.553 -13.917 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -5.823 -0.324 -12.167 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -6.016 -4.938 -14.023 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -3.743 -1.662 -12.386 1.00 0.00 H new ATOM 0 HH TYR A 113 -3.220 -4.309 -12.502 1.00 0.00 H new ATOM 1005 N TYR A 114 -8.432 -2.412 -9.932 1.00 0.00 N ATOM 1006 CA TYR A 114 -7.952 -3.466 -9.048 1.00 0.00 C ATOM 1007 C TYR A 114 -9.035 -4.018 -8.129 1.00 0.00 C ATOM 1008 O TYR A 114 -8.886 -5.099 -7.559 1.00 0.00 O ATOM 1009 CB TYR A 114 -6.765 -2.977 -8.240 1.00 0.00 C ATOM 1010 CG TYR A 114 -5.492 -2.878 -9.031 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -4.979 -4.025 -9.676 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -4.779 -1.667 -9.014 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -3.683 -3.951 -10.222 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -3.490 -1.604 -9.562 1.00 0.00 C ATOM 1015 CZ TYR A 114 -2.935 -2.761 -10.138 1.00 0.00 C ATOM 1016 OH TYR A 114 -1.690 -2.719 -10.666 1.00 0.00 O ATOM 0 H TYR A 114 -8.286 -1.469 -9.571 1.00 0.00 H new ATOM 0 HA TYR A 114 -7.641 -4.292 -9.687 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -7.000 -1.998 -7.823 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -6.607 -3.652 -7.399 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -5.563 -4.931 -9.748 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -5.224 -0.785 -8.579 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -3.258 -4.816 -10.710 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.931 -0.680 -9.542 1.00 0.00 H new ATOM 0 HH TYR A 114 -1.306 -1.828 -10.528 1.00 0.00 H new ATOM 1026 N THR A 115 -10.154 -3.303 -8.042 1.00 0.00 N ATOM 1027 CA THR A 115 -11.383 -3.745 -7.399 1.00 0.00 C ATOM 1028 C THR A 115 -12.230 -4.578 -8.380 1.00 0.00 C ATOM 1029 O THR A 115 -13.112 -5.345 -7.981 1.00 0.00 O ATOM 1030 CB THR A 115 -12.125 -2.538 -6.789 1.00 0.00 C ATOM 1031 OG1 THR A 115 -11.346 -1.990 -5.745 1.00 0.00 O ATOM 1032 CG2 THR A 115 -13.482 -2.838 -6.161 1.00 0.00 C ATOM 0 H THR A 115 -10.230 -2.364 -8.433 1.00 0.00 H new ATOM 0 HA THR A 115 -11.155 -4.410 -6.566 1.00 0.00 H new ATOM 0 HB THR A 115 -12.285 -1.873 -7.638 1.00 0.00 H new ATOM 0 HG1 THR A 115 -10.605 -1.474 -6.126 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.911 -1.918 -5.765 1.00 0.00 H new ATOM 0 HG22 THR A 115 -14.149 -3.253 -6.917 1.00 0.00 H new ATOM 0 HG23 THR A 115 -13.357 -3.558 -5.352 1.00 0.00 H new ATOM 1040 N SER A 116 -11.901 -4.488 -9.674 1.00 0.00 N ATOM 1041 CA SER A 116 -12.425 -5.261 -10.804 1.00 0.00 C ATOM 1042 C SER A 116 -11.741 -6.627 -10.907 1.00 0.00 C ATOM 1043 O SER A 116 -12.386 -7.663 -11.085 1.00 0.00 O ATOM 1044 CB SER A 116 -12.096 -4.487 -12.092 1.00 0.00 C ATOM 1045 OG SER A 116 -13.222 -4.367 -12.946 1.00 0.00 O ATOM 0 H SER A 116 -11.201 -3.814 -9.983 1.00 0.00 H new ATOM 0 HA SER A 116 -13.496 -5.407 -10.663 1.00 0.00 H new ATOM 0 HB2 SER A 116 -11.730 -3.493 -11.834 1.00 0.00 H new ATOM 0 HB3 SER A 116 -11.291 -4.995 -12.624 1.00 0.00 H new ATOM 0 HG SER A 116 -12.970 -3.868 -13.751 1.00 0.00 H new ATOM 1051 N VAL A 117 -10.407 -6.592 -10.853 1.00 0.00 N ATOM 1052 CA VAL A 117 -9.474 -7.658 -11.205 1.00 0.00 C ATOM 1053 C VAL A 117 -9.055 -8.482 -9.970 1.00 0.00 C ATOM 1054 O VAL A 117 -9.359 -8.132 -8.828 1.00 0.00 O ATOM 1055 CB VAL A 117 -8.262 -6.979 -11.902 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -7.165 -6.555 -10.959 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -7.692 -7.798 -13.062 1.00 0.00 C ATOM 0 H VAL A 117 -9.918 -5.754 -10.538 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.942 -8.376 -11.878 1.00 0.00 H new ATOM 0 HB VAL A 117 -8.686 -6.066 -12.320 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -6.358 -6.090 -11.525 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.561 -5.840 -10.238 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.782 -7.428 -10.431 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -6.849 -7.266 -13.503 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -7.357 -8.767 -12.693 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -8.464 -7.945 -13.817 1.00 0.00 H new ATOM 1067 N THR A 118 -8.222 -9.500 -10.176 1.00 0.00 N ATOM 1068 CA THR A 118 -6.996 -9.633 -9.364 1.00 0.00 C ATOM 1069 C THR A 118 -5.828 -10.043 -10.275 1.00 0.00 C ATOM 1070 O THR A 118 -6.010 -10.953 -11.083 1.00 0.00 O ATOM 1071 CB THR A 118 -7.116 -10.591 -8.167 1.00 0.00 C ATOM 1072 OG1 THR A 118 -8.411 -10.598 -7.604 1.00 0.00 O ATOM 1073 CG2 THR A 118 -6.163 -10.109 -7.071 1.00 0.00 C ATOM 0 H THR A 118 -8.359 -10.230 -10.875 1.00 0.00 H new ATOM 0 HA THR A 118 -6.814 -8.655 -8.918 1.00 0.00 H new ATOM 0 HB THR A 118 -6.884 -11.593 -8.528 1.00 0.00 H new ATOM 0 HG1 THR A 118 -8.854 -9.744 -7.792 1.00 0.00 H new ATOM 0 HG21 THR A 118 -6.231 -10.775 -6.211 1.00 0.00 H new ATOM 0 HG22 THR A 118 -5.141 -10.111 -7.451 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.437 -9.098 -6.770 1.00 0.00 H new ATOM 1081 N PRO A 119 -4.657 -9.370 -10.236 1.00 0.00 N ATOM 1082 CA PRO A 119 -3.616 -9.533 -11.256 1.00 0.00 C ATOM 1083 C PRO A 119 -2.707 -10.757 -10.993 1.00 0.00 C ATOM 1084 O PRO A 119 -2.030 -11.227 -11.905 1.00 0.00 O ATOM 1085 CB PRO A 119 -2.806 -8.220 -11.246 1.00 0.00 C ATOM 1086 CG PRO A 119 -3.521 -7.329 -10.228 1.00 0.00 C ATOM 1087 CD PRO A 119 -4.203 -8.339 -9.326 1.00 0.00 C ATOM 0 HA PRO A 119 -4.066 -9.724 -12.230 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -1.770 -8.397 -10.958 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -2.789 -7.758 -12.233 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -2.821 -6.701 -9.677 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -4.239 -6.663 -10.706 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -3.514 -8.739 -8.582 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -5.035 -7.891 -8.783 1.00 0.00 H new ATOM 1095 N VAL A 120 -2.740 -11.277 -9.753 1.00 0.00 N ATOM 1096 CA VAL A 120 -2.042 -12.457 -9.205 1.00 0.00 C ATOM 1097 C VAL A 120 -0.512 -12.372 -9.320 1.00 0.00 C ATOM 1098 O VAL A 120 0.073 -12.602 -10.376 1.00 0.00 O ATOM 1099 CB VAL A 120 -2.633 -13.757 -9.773 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -2.114 -14.991 -9.031 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -4.156 -13.747 -9.612 1.00 0.00 C ATOM 0 H VAL A 120 -3.315 -10.837 -9.035 1.00 0.00 H new ATOM 0 HA VAL A 120 -2.224 -12.468 -8.130 1.00 0.00 H new ATOM 0 HB VAL A 120 -2.337 -13.807 -10.821 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -2.556 -15.888 -9.464 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -1.029 -15.041 -9.122 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -2.387 -14.924 -7.978 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.571 -14.671 -10.016 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -4.410 -13.667 -8.555 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -4.573 -12.896 -10.150 1.00 0.00 H new ATOM 1111 N LEU A 121 0.136 -11.990 -8.211 1.00 0.00 N ATOM 1112 CA LEU A 121 1.474 -11.380 -8.202 1.00 0.00 C ATOM 1113 C LEU A 121 2.570 -12.362 -8.658 1.00 0.00 C ATOM 1114 O LEU A 121 3.231 -12.143 -9.674 1.00 0.00 O ATOM 1115 CB LEU A 121 1.723 -10.772 -6.803 1.00 0.00 C ATOM 1116 CG LEU A 121 2.724 -9.602 -6.791 1.00 0.00 C ATOM 1117 CD1 LEU A 121 2.638 -8.905 -5.430 1.00 0.00 C ATOM 1118 CD2 LEU A 121 4.156 -10.065 -7.037 1.00 0.00 C ATOM 0 H LEU A 121 -0.262 -12.098 -7.278 1.00 0.00 H new ATOM 0 HA LEU A 121 1.520 -10.577 -8.937 1.00 0.00 H new ATOM 0 HB2 LEU A 121 0.773 -10.427 -6.395 1.00 0.00 H new ATOM 0 HB3 LEU A 121 2.089 -11.555 -6.139 1.00 0.00 H new ATOM 0 HG LEU A 121 2.463 -8.919 -7.599 1.00 0.00 H new ATOM 0 HD11 LEU A 121 3.341 -8.072 -5.403 1.00 0.00 H new ATOM 0 HD12 LEU A 121 1.626 -8.531 -5.276 1.00 0.00 H new ATOM 0 HD13 LEU A 121 2.886 -9.615 -4.641 1.00 0.00 H new ATOM 0 HD21 LEU A 121 4.825 -9.204 -7.019 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.450 -10.769 -6.258 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.219 -10.553 -8.010 1.00 0.00 H new ATOM 1130 N ARG A 122 2.750 -13.450 -7.898 1.00 0.00 N ATOM 1131 CA ARG A 122 3.741 -14.528 -8.116 1.00 0.00 C ATOM 1132 C ARG A 122 3.143 -15.943 -8.178 1.00 0.00 C ATOM 1133 O ARG A 122 3.876 -16.931 -8.191 1.00 0.00 O ATOM 1134 CB ARG A 122 4.872 -14.401 -7.069 1.00 0.00 C ATOM 1135 CG ARG A 122 4.470 -14.413 -5.576 1.00 0.00 C ATOM 1136 CD ARG A 122 3.619 -15.618 -5.140 1.00 0.00 C ATOM 1137 NE ARG A 122 3.606 -15.770 -3.672 1.00 0.00 N ATOM 1138 CZ ARG A 122 3.287 -16.850 -2.981 1.00 0.00 C ATOM 1139 NH1 ARG A 122 2.921 -17.961 -3.555 1.00 0.00 N ATOM 1140 NH2 ARG A 122 3.320 -16.838 -1.681 1.00 0.00 N ATOM 0 H ARG A 122 2.181 -13.617 -7.068 1.00 0.00 H new ATOM 0 HA ARG A 122 4.157 -14.388 -9.114 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.576 -15.217 -7.234 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.409 -13.473 -7.265 1.00 0.00 H new ATOM 0 HG2 ARG A 122 5.377 -14.390 -4.971 1.00 0.00 H new ATOM 0 HG3 ARG A 122 3.918 -13.499 -5.357 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.599 -15.494 -5.503 1.00 0.00 H new ATOM 0 HD3 ARG A 122 4.012 -16.526 -5.597 1.00 0.00 H new ATOM 0 HE ARG A 122 3.873 -14.949 -3.130 1.00 0.00 H new ATOM 0 HH11 ARG A 122 2.873 -18.018 -4.572 1.00 0.00 H new ATOM 0 HH12 ARG A 122 2.682 -18.774 -2.987 1.00 0.00 H new ATOM 0 HH21 ARG A 122 3.594 -15.990 -1.186 1.00 0.00 H new ATOM 0 HH22 ARG A 122 3.072 -17.677 -1.157 1.00 0.00 H new ATOM 1154 N GLY A 123 1.814 -16.044 -8.123 1.00 0.00 N ATOM 1155 CA GLY A 123 1.072 -17.263 -7.766 1.00 0.00 C ATOM 1156 C GLY A 123 0.086 -17.097 -6.596 1.00 0.00 C ATOM 1157 O GLY A 123 -0.428 -18.093 -6.084 1.00 0.00 O ATOM 0 H GLY A 123 1.201 -15.256 -8.332 1.00 0.00 H new ATOM 0 HA2 GLY A 123 0.521 -17.606 -8.642 1.00 0.00 H new ATOM 0 HA3 GLY A 123 1.787 -18.046 -7.512 1.00 0.00 H new ATOM 1161 N GLN A 124 -0.154 -15.861 -6.140 1.00 0.00 N ATOM 1162 CA GLN A 124 -0.990 -15.495 -5.000 1.00 0.00 C ATOM 1163 C GLN A 124 -1.807 -14.230 -5.340 1.00 0.00 C ATOM 1164 O GLN A 124 -1.274 -13.363 -6.044 1.00 0.00 O ATOM 1165 CB GLN A 124 -0.044 -15.265 -3.812 1.00 0.00 C ATOM 1166 CG GLN A 124 -0.743 -14.901 -2.498 1.00 0.00 C ATOM 1167 CD GLN A 124 0.242 -14.709 -1.345 1.00 0.00 C ATOM 1168 OE1 GLN A 124 0.232 -15.428 -0.356 1.00 0.00 O ATOM 1169 NE2 GLN A 124 1.128 -13.740 -1.415 1.00 0.00 N ATOM 0 H GLN A 124 0.258 -15.043 -6.588 1.00 0.00 H new ATOM 0 HA GLN A 124 -1.708 -16.277 -4.752 1.00 0.00 H new ATOM 0 HB2 GLN A 124 0.547 -16.168 -3.656 1.00 0.00 H new ATOM 0 HB3 GLN A 124 0.654 -14.468 -4.070 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -1.317 -13.985 -2.637 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -1.453 -15.686 -2.238 1.00 0.00 H new ATOM 0 HE21 GLN A 124 1.153 -13.129 -2.232 1.00 0.00 H new ATOM 0 HE22 GLN A 124 1.791 -13.599 -0.653 1.00 0.00 H new ATOM 1178 N PRO A 125 -3.064 -14.092 -4.871 1.00 0.00 N ATOM 1179 CA PRO A 125 -3.870 -12.884 -5.058 1.00 0.00 C ATOM 1180 C PRO A 125 -3.213 -11.625 -4.462 1.00 0.00 C ATOM 1181 O PRO A 125 -2.277 -11.711 -3.665 1.00 0.00 O ATOM 1182 CB PRO A 125 -5.224 -13.179 -4.395 1.00 0.00 C ATOM 1183 CG PRO A 125 -5.285 -14.703 -4.341 1.00 0.00 C ATOM 1184 CD PRO A 125 -3.825 -15.086 -4.131 1.00 0.00 C ATOM 0 HA PRO A 125 -3.977 -12.660 -6.119 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -5.284 -12.742 -3.398 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -6.050 -12.767 -4.974 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -5.918 -15.055 -3.526 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -5.687 -15.126 -5.262 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -3.563 -15.076 -3.073 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -3.624 -16.092 -4.500 1.00 0.00 H new ATOM 1192 N ILE A 126 -3.724 -10.446 -4.824 1.00 0.00 N ATOM 1193 CA ILE A 126 -3.135 -9.143 -4.465 1.00 0.00 C ATOM 1194 C ILE A 126 -4.174 -8.231 -3.819 1.00 0.00 C ATOM 1195 O ILE A 126 -5.368 -8.283 -4.119 1.00 0.00 O ATOM 1196 CB ILE A 126 -2.426 -8.427 -5.636 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -1.946 -9.440 -6.694 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -1.258 -7.589 -5.071 1.00 0.00 C ATOM 1199 CD1 ILE A 126 -1.106 -8.823 -7.792 1.00 0.00 C ATOM 0 H ILE A 126 -4.572 -10.363 -5.384 1.00 0.00 H new ATOM 0 HA ILE A 126 -2.354 -9.366 -3.738 1.00 0.00 H new ATOM 0 HB ILE A 126 -3.127 -7.761 -6.140 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -1.366 -10.220 -6.200 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -2.815 -9.923 -7.141 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -0.748 -7.078 -5.888 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -1.646 -6.852 -4.368 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -0.554 -8.245 -4.558 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -0.805 -9.597 -8.498 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -1.689 -8.063 -8.312 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -0.218 -8.364 -7.357 1.00 0.00 H new ATOM 1211 N TYR A 127 -3.688 -7.445 -2.867 1.00 0.00 N ATOM 1212 CA TYR A 127 -4.462 -6.911 -1.751 1.00 0.00 C ATOM 1213 C TYR A 127 -4.306 -5.386 -1.705 1.00 0.00 C ATOM 1214 O TYR A 127 -3.497 -4.852 -0.943 1.00 0.00 O ATOM 1215 CB TYR A 127 -3.984 -7.567 -0.446 1.00 0.00 C ATOM 1216 CG TYR A 127 -4.357 -9.009 -0.141 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -4.144 -10.073 -1.050 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -4.794 -9.299 1.166 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -4.407 -11.403 -0.661 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -5.050 -10.623 1.559 1.00 0.00 C ATOM 1221 CZ TYR A 127 -4.867 -11.681 0.645 1.00 0.00 C ATOM 1222 OH TYR A 127 -5.067 -12.963 1.056 1.00 0.00 O ATOM 0 H TYR A 127 -2.711 -7.151 -2.849 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.520 -7.137 -1.879 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -2.896 -7.503 -0.430 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -4.351 -6.955 0.378 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -3.779 -9.866 -2.045 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -4.934 -8.495 1.873 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -4.256 -12.210 -1.363 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -5.388 -10.831 2.563 1.00 0.00 H new ATOM 0 HH TYR A 127 -5.383 -12.964 1.984 1.00 0.00 H new ATOM 1232 N ILE A 128 -5.052 -4.690 -2.563 1.00 0.00 N ATOM 1233 CA ILE A 128 -5.062 -3.230 -2.658 1.00 0.00 C ATOM 1234 C ILE A 128 -6.131 -2.585 -1.762 1.00 0.00 C ATOM 1235 O ILE A 128 -7.220 -3.127 -1.561 1.00 0.00 O ATOM 1236 CB ILE A 128 -5.180 -2.817 -4.153 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -3.832 -2.186 -4.554 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.367 -1.886 -4.481 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.734 -1.790 -6.025 1.00 0.00 C ATOM 0 H ILE A 128 -5.682 -5.138 -3.228 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.119 -2.844 -2.272 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.397 -3.711 -4.738 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -3.662 -1.302 -3.940 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -3.033 -2.891 -4.326 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.364 -1.655 -5.546 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.302 -2.382 -4.220 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.274 -0.963 -3.909 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.754 -1.355 -6.220 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.870 -2.673 -6.649 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.508 -1.059 -6.257 1.00 0.00 H new ATOM 1251 N GLN A 129 -5.821 -1.372 -1.310 1.00 0.00 N ATOM 1252 CA GLN A 129 -6.720 -0.349 -0.766 1.00 0.00 C ATOM 1253 C GLN A 129 -6.185 1.027 -1.181 1.00 0.00 C ATOM 1254 O GLN A 129 -4.988 1.179 -1.400 1.00 0.00 O ATOM 1255 CB GLN A 129 -6.696 -0.419 0.771 1.00 0.00 C ATOM 1256 CG GLN A 129 -7.715 -1.373 1.393 1.00 0.00 C ATOM 1257 CD GLN A 129 -7.159 -1.986 2.673 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -6.783 -3.148 2.727 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -7.049 -1.236 3.744 1.00 0.00 N ATOM 0 H GLN A 129 -4.853 -1.049 -1.314 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.733 -0.509 -1.136 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -5.698 -0.720 1.090 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -6.869 0.581 1.167 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -8.639 -0.837 1.611 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -7.964 -2.162 0.683 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -7.357 -0.264 3.720 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -6.656 -1.625 4.601 1.00 0.00 H new ATOM 1268 N PHE A 130 -7.007 2.072 -1.177 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.472 3.427 -1.007 1.00 0.00 C ATOM 1270 C PHE A 130 -5.645 3.546 0.289 1.00 0.00 C ATOM 1271 O PHE A 130 -5.847 2.818 1.266 1.00 0.00 O ATOM 1272 CB PHE A 130 -7.606 4.447 -0.963 1.00 0.00 C ATOM 1273 CG PHE A 130 -8.042 5.031 -2.289 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -7.139 5.777 -3.072 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.391 4.934 -2.669 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.592 6.426 -4.233 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.842 5.607 -3.815 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.945 6.354 -4.599 1.00 0.00 C ATOM 0 H PHE A 130 -8.020 2.016 -1.286 1.00 0.00 H new ATOM 0 HA PHE A 130 -5.825 3.629 -1.860 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.471 3.975 -0.497 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.302 5.267 -0.313 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -6.102 5.850 -2.781 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -10.078 4.344 -2.081 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.897 6.982 -4.845 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.883 5.551 -4.096 1.00 0.00 H new ATOM 0 HZ PHE A 130 -9.296 6.871 -5.480 1.00 0.00 H new ATOM 1288 N SER A 131 -4.725 4.503 0.316 1.00 0.00 N ATOM 1289 CA SER A 131 -3.987 4.834 1.528 1.00 0.00 C ATOM 1290 C SER A 131 -4.872 5.539 2.573 1.00 0.00 C ATOM 1291 O SER A 131 -5.884 6.165 2.246 1.00 0.00 O ATOM 1292 CB SER A 131 -2.741 5.637 1.161 1.00 0.00 C ATOM 1293 OG SER A 131 -2.059 6.120 2.294 1.00 0.00 O ATOM 0 H SER A 131 -4.471 5.067 -0.495 1.00 0.00 H new ATOM 0 HA SER A 131 -3.663 3.911 2.008 1.00 0.00 H new ATOM 0 HB2 SER A 131 -2.068 5.011 0.575 1.00 0.00 H new ATOM 0 HB3 SER A 131 -3.027 6.477 0.528 1.00 0.00 H new ATOM 0 HG SER A 131 -1.993 5.408 2.964 1.00 0.00 H new ATOM 1299 N ASN A 132 -4.463 5.491 3.844 1.00 0.00 N ATOM 1300 CA ASN A 132 -4.951 6.367 4.916 1.00 0.00 C ATOM 1301 C ASN A 132 -4.574 7.850 4.698 1.00 0.00 C ATOM 1302 O ASN A 132 -5.095 8.730 5.390 1.00 0.00 O ATOM 1303 CB ASN A 132 -4.380 5.867 6.254 1.00 0.00 C ATOM 1304 CG ASN A 132 -4.853 4.471 6.626 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -6.022 4.125 6.503 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -3.968 3.637 7.124 1.00 0.00 N ATOM 0 H ASN A 132 -3.763 4.823 4.166 1.00 0.00 H new ATOM 0 HA ASN A 132 -6.040 6.324 4.918 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -3.291 5.872 6.201 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -4.664 6.562 7.044 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -4.254 2.700 7.409 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -2.995 3.926 7.226 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.682 8.129 3.747 1.00 0.00 N ATOM 1314 CA HIS A 133 -3.104 9.435 3.416 1.00 0.00 C ATOM 1315 C HIS A 133 -3.511 9.868 1.985 1.00 0.00 C ATOM 1316 O HIS A 133 -4.256 9.168 1.292 1.00 0.00 O ATOM 1317 CB HIS A 133 -1.575 9.345 3.610 1.00 0.00 C ATOM 1318 CG HIS A 133 -1.145 8.622 4.876 1.00 0.00 C ATOM 1319 ND1 HIS A 133 -1.281 9.063 6.180 1.00 0.00 N ATOM 1320 CD2 HIS A 133 -0.629 7.356 4.932 1.00 0.00 C ATOM 1321 CE1 HIS A 133 -0.848 8.080 6.995 1.00 0.00 C ATOM 1322 NE2 HIS A 133 -0.417 7.036 6.275 1.00 0.00 N ATOM 0 H HIS A 133 -3.316 7.394 3.142 1.00 0.00 H new ATOM 0 HA HIS A 133 -3.490 10.210 4.078 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -1.141 8.835 2.750 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -1.163 10.354 3.624 1.00 0.00 H new ATOM 0 HD1 HIS A 133 -1.644 9.970 6.473 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.422 6.717 4.087 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -0.849 8.128 8.074 1.00 0.00 H new ATOM 1330 N LYS A 134 -3.041 11.039 1.534 1.00 0.00 N ATOM 1331 CA LYS A 134 -3.440 11.697 0.266 1.00 0.00 C ATOM 1332 C LYS A 134 -2.265 12.046 -0.667 1.00 0.00 C ATOM 1333 O LYS A 134 -2.475 12.671 -1.702 1.00 0.00 O ATOM 1334 CB LYS A 134 -4.255 12.964 0.591 1.00 0.00 C ATOM 1335 CG LYS A 134 -5.619 12.686 1.244 1.00 0.00 C ATOM 1336 CD LYS A 134 -6.355 14.022 1.441 1.00 0.00 C ATOM 1337 CE LYS A 134 -7.791 13.869 1.945 1.00 0.00 C ATOM 1338 NZ LYS A 134 -7.862 13.230 3.285 1.00 0.00 N ATOM 0 H LYS A 134 -2.349 11.579 2.054 1.00 0.00 H new ATOM 0 HA LYS A 134 -4.041 10.973 -0.284 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -3.669 13.599 1.256 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -4.413 13.527 -0.329 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -6.209 12.019 0.616 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -5.484 12.185 2.202 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -5.795 14.633 2.149 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -6.368 14.562 0.494 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -8.263 14.851 1.989 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -8.361 13.273 1.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -8.556 13.733 3.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -8.152 12.237 3.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -6.928 13.272 3.740 1.00 0.00 H new ATOM 1352 N GLU A 135 -1.044 11.661 -0.309 1.00 0.00 N ATOM 1353 CA GLU A 135 0.245 12.032 -0.917 1.00 0.00 C ATOM 1354 C GLU A 135 1.380 11.259 -0.208 1.00 0.00 C ATOM 1355 O GLU A 135 1.177 10.688 0.866 1.00 0.00 O ATOM 1356 CB GLU A 135 0.463 13.560 -0.822 1.00 0.00 C ATOM 1357 CG GLU A 135 1.674 14.070 -1.617 1.00 0.00 C ATOM 1358 CD GLU A 135 1.538 15.567 -1.949 1.00 0.00 C ATOM 1359 OE1 GLU A 135 1.802 16.424 -1.072 1.00 0.00 O ATOM 1360 OE2 GLU A 135 1.157 15.885 -3.103 1.00 0.00 O ATOM 0 H GLU A 135 -0.911 11.028 0.480 1.00 0.00 H new ATOM 0 HA GLU A 135 0.245 11.765 -1.974 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -0.433 14.067 -1.180 1.00 0.00 H new ATOM 0 HB3 GLU A 135 0.588 13.834 0.226 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.585 13.905 -1.041 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.772 13.499 -2.540 1.00 0.00 H new ATOM 1367 N LEU A 136 2.570 11.222 -0.811 1.00 0.00 N ATOM 1368 CA LEU A 136 3.734 10.449 -0.373 1.00 0.00 C ATOM 1369 C LEU A 136 5.029 11.272 -0.479 1.00 0.00 C ATOM 1370 O LEU A 136 5.698 11.269 -1.514 1.00 0.00 O ATOM 1371 CB LEU A 136 3.762 9.160 -1.205 1.00 0.00 C ATOM 1372 CG LEU A 136 4.947 8.217 -0.971 1.00 0.00 C ATOM 1373 CD1 LEU A 136 5.169 7.899 0.503 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.665 6.926 -1.725 1.00 0.00 C ATOM 0 H LEU A 136 2.757 11.756 -1.659 1.00 0.00 H new ATOM 0 HA LEU A 136 3.658 10.190 0.683 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.843 8.608 -1.008 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.749 9.435 -2.260 1.00 0.00 H new ATOM 0 HG LEU A 136 5.852 8.709 -1.326 1.00 0.00 H new ATOM 0 HD11 LEU A 136 6.021 7.227 0.606 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.366 8.822 1.049 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.278 7.420 0.910 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.492 6.231 -1.579 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.745 6.479 -1.349 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.556 7.142 -2.788 1.00 0.00 H new ATOM 1386 N LYS A 137 5.398 11.957 0.608 1.00 0.00 N ATOM 1387 CA LYS A 137 6.675 12.676 0.745 1.00 0.00 C ATOM 1388 C LYS A 137 7.718 11.791 1.442 1.00 0.00 C ATOM 1389 O LYS A 137 7.778 11.698 2.666 1.00 0.00 O ATOM 1390 CB LYS A 137 6.453 14.072 1.370 1.00 0.00 C ATOM 1391 CG LYS A 137 5.883 14.114 2.799 1.00 0.00 C ATOM 1392 CD LYS A 137 6.931 14.547 3.835 1.00 0.00 C ATOM 1393 CE LYS A 137 6.401 14.336 5.258 1.00 0.00 C ATOM 1394 NZ LYS A 137 7.476 14.546 6.258 1.00 0.00 N ATOM 0 H LYS A 137 4.807 12.031 1.436 1.00 0.00 H new ATOM 0 HA LYS A 137 7.101 12.883 -0.237 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.407 14.599 1.370 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.780 14.631 0.720 1.00 0.00 H new ATOM 0 HG2 LYS A 137 5.039 14.803 2.830 1.00 0.00 H new ATOM 0 HG3 LYS A 137 5.500 13.128 3.064 1.00 0.00 H new ATOM 0 HD2 LYS A 137 7.848 13.975 3.694 1.00 0.00 H new ATOM 0 HD3 LYS A 137 7.184 15.597 3.687 1.00 0.00 H new ATOM 0 HE2 LYS A 137 5.579 15.026 5.451 1.00 0.00 H new ATOM 0 HE3 LYS A 137 6.000 13.327 5.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 7.083 14.448 7.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 8.225 13.838 6.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 7.875 15.500 6.144 1.00 0.00 H new ATOM 1408 N THR A 138 8.495 11.049 0.658 1.00 0.00 N ATOM 1409 CA THR A 138 9.644 10.251 1.123 1.00 0.00 C ATOM 1410 C THR A 138 10.835 11.176 1.431 1.00 0.00 C ATOM 1411 O THR A 138 11.582 11.581 0.538 1.00 0.00 O ATOM 1412 CB THR A 138 10.003 9.151 0.102 1.00 0.00 C ATOM 1413 OG1 THR A 138 9.993 9.651 -1.221 1.00 0.00 O ATOM 1414 CG2 THR A 138 8.980 8.012 0.141 1.00 0.00 C ATOM 0 H THR A 138 8.345 10.979 -0.348 1.00 0.00 H new ATOM 0 HA THR A 138 9.374 9.740 2.047 1.00 0.00 H new ATOM 0 HB THR A 138 10.998 8.798 0.374 1.00 0.00 H new ATOM 0 HG1 THR A 138 10.520 10.476 -1.263 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.256 7.250 -0.588 1.00 0.00 H new ATOM 0 HG22 THR A 138 8.964 7.572 1.138 1.00 0.00 H new ATOM 0 HG23 THR A 138 7.991 8.403 -0.099 1.00 0.00 H new ATOM 1422 N ASP A 139 10.977 11.588 2.699 1.00 0.00 N ATOM 1423 CA ASP A 139 11.875 12.675 3.143 1.00 0.00 C ATOM 1424 C ASP A 139 13.357 12.511 2.738 1.00 0.00 C ATOM 1425 O ASP A 139 14.025 13.499 2.421 1.00 0.00 O ATOM 1426 CB ASP A 139 11.791 12.828 4.672 1.00 0.00 C ATOM 1427 CG ASP A 139 10.487 13.491 5.128 1.00 0.00 C ATOM 1428 OD1 ASP A 139 10.307 14.709 4.896 1.00 0.00 O ATOM 1429 OD2 ASP A 139 9.639 12.815 5.755 1.00 0.00 O ATOM 0 H ASP A 139 10.458 11.165 3.469 1.00 0.00 H new ATOM 0 HA ASP A 139 11.518 13.566 2.626 1.00 0.00 H new ATOM 0 HB2 ASP A 139 11.877 11.846 5.137 1.00 0.00 H new ATOM 0 HB3 ASP A 139 12.637 13.421 5.021 1.00 0.00 H new ATOM 1434 N SER A 140 13.878 11.279 2.751 1.00 0.00 N ATOM 1435 CA SER A 140 15.238 10.914 2.330 1.00 0.00 C ATOM 1436 C SER A 140 15.340 9.430 1.941 1.00 0.00 C ATOM 1437 O SER A 140 14.363 8.682 2.058 1.00 0.00 O ATOM 1438 CB SER A 140 16.254 11.264 3.434 1.00 0.00 C ATOM 1439 OG SER A 140 16.037 10.498 4.608 1.00 0.00 O ATOM 0 H SER A 140 13.341 10.473 3.069 1.00 0.00 H new ATOM 0 HA SER A 140 15.475 11.496 1.439 1.00 0.00 H new ATOM 0 HB2 SER A 140 17.265 11.089 3.067 1.00 0.00 H new ATOM 0 HB3 SER A 140 16.181 12.325 3.673 1.00 0.00 H new ATOM 0 HG SER A 140 16.700 10.744 5.286 1.00 0.00 H new ATOM 1445 N SER A 141 16.524 9.003 1.485 1.00 0.00 N ATOM 1446 CA SER A 141 16.845 7.607 1.153 1.00 0.00 C ATOM 1447 C SER A 141 17.854 7.012 2.155 1.00 0.00 C ATOM 1448 O SER A 141 18.782 7.721 2.571 1.00 0.00 O ATOM 1449 CB SER A 141 17.428 7.514 -0.264 1.00 0.00 C ATOM 1450 OG SER A 141 16.484 7.964 -1.226 1.00 0.00 O ATOM 0 H SER A 141 17.309 9.637 1.332 1.00 0.00 H new ATOM 0 HA SER A 141 15.918 7.036 1.207 1.00 0.00 H new ATOM 0 HB2 SER A 141 18.336 8.114 -0.329 1.00 0.00 H new ATOM 0 HB3 SER A 141 17.711 6.484 -0.479 1.00 0.00 H new ATOM 0 HG SER A 141 16.874 7.899 -2.123 1.00 0.00 H new ATOM 1456 N PRO A 142 17.736 5.722 2.525 1.00 0.00 N ATOM 1457 CA PRO A 142 18.629 5.076 3.489 1.00 0.00 C ATOM 1458 C PRO A 142 20.057 4.922 2.939 1.00 0.00 C ATOM 1459 O PRO A 142 20.269 4.356 1.863 1.00 0.00 O ATOM 1460 CB PRO A 142 17.972 3.728 3.818 1.00 0.00 C ATOM 1461 CG PRO A 142 17.153 3.406 2.571 1.00 0.00 C ATOM 1462 CD PRO A 142 16.705 4.788 2.090 1.00 0.00 C ATOM 0 HA PRO A 142 18.752 5.679 4.389 1.00 0.00 H new ATOM 0 HB2 PRO A 142 18.717 2.958 4.016 1.00 0.00 H new ATOM 0 HB3 PRO A 142 17.341 3.797 4.704 1.00 0.00 H new ATOM 0 HG2 PRO A 142 17.749 2.890 1.818 1.00 0.00 H new ATOM 0 HG3 PRO A 142 16.303 2.763 2.801 1.00 0.00 H new ATOM 0 HD2 PRO A 142 16.595 4.806 1.006 1.00 0.00 H new ATOM 0 HD3 PRO A 142 15.736 5.053 2.513 1.00 0.00 H new ATOM 1470 N ASN A 143 21.038 5.438 3.683 1.00 0.00 N ATOM 1471 CA ASN A 143 22.473 5.414 3.368 1.00 0.00 C ATOM 1472 C ASN A 143 23.312 5.082 4.621 1.00 0.00 C ATOM 1473 O ASN A 143 22.819 5.138 5.752 1.00 0.00 O ATOM 1474 CB ASN A 143 22.864 6.776 2.759 1.00 0.00 C ATOM 1475 CG ASN A 143 22.438 6.922 1.308 1.00 0.00 C ATOM 1476 OD1 ASN A 143 23.154 6.544 0.390 1.00 0.00 O ATOM 1477 ND2 ASN A 143 21.286 7.490 1.036 1.00 0.00 N ATOM 0 H ASN A 143 20.846 5.909 4.567 1.00 0.00 H new ATOM 0 HA ASN A 143 22.680 4.627 2.643 1.00 0.00 H new ATOM 0 HB2 ASN A 143 22.411 7.574 3.347 1.00 0.00 H new ATOM 0 HB3 ASN A 143 23.944 6.902 2.829 1.00 0.00 H new ATOM 0 HD21 ASN A 143 20.994 7.613 0.066 1.00 0.00 H new ATOM 0 HD22 ASN A 143 20.683 7.808 1.794 1.00 0.00 H new ATOM 1484 N GLN A 144 24.596 4.762 4.420 1.00 0.00 N ATOM 1485 CA GLN A 144 25.584 4.451 5.465 1.00 0.00 C ATOM 1486 C GLN A 144 26.936 5.149 5.225 1.00 0.00 C ATOM 1487 O GLN A 144 27.217 5.655 4.137 1.00 0.00 O ATOM 1488 CB GLN A 144 25.767 2.920 5.556 1.00 0.00 C ATOM 1489 CG GLN A 144 24.711 2.281 6.466 1.00 0.00 C ATOM 1490 CD GLN A 144 24.868 0.765 6.543 1.00 0.00 C ATOM 1491 OE1 GLN A 144 25.639 0.227 7.328 1.00 0.00 O ATOM 1492 NE2 GLN A 144 24.143 0.010 5.743 1.00 0.00 N ATOM 0 H GLN A 144 24.995 4.710 3.483 1.00 0.00 H new ATOM 0 HA GLN A 144 25.203 4.834 6.412 1.00 0.00 H new ATOM 0 HB2 GLN A 144 25.701 2.485 4.559 1.00 0.00 H new ATOM 0 HB3 GLN A 144 26.763 2.694 5.937 1.00 0.00 H new ATOM 0 HG2 GLN A 144 24.790 2.705 7.467 1.00 0.00 H new ATOM 0 HG3 GLN A 144 23.716 2.524 6.094 1.00 0.00 H new ATOM 0 HE21 GLN A 144 23.496 0.441 5.083 1.00 0.00 H new ATOM 0 HE22 GLN A 144 24.229 -1.006 5.784 1.00 0.00 H new ATOM 1501 N ALA A 145 27.782 5.156 6.262 1.00 0.00 N ATOM 1502 CA ALA A 145 29.114 5.768 6.276 1.00 0.00 C ATOM 1503 C ALA A 145 30.129 5.115 5.310 1.00 0.00 C ATOM 1504 O ALA A 145 31.076 5.774 4.868 1.00 0.00 O ATOM 1505 CB ALA A 145 29.610 5.704 7.725 1.00 0.00 C ATOM 0 H ALA A 145 27.546 4.716 7.152 1.00 0.00 H new ATOM 0 HA ALA A 145 29.031 6.793 5.915 1.00 0.00 H new ATOM 0 HB1 ALA A 145 30.603 6.149 7.790 1.00 0.00 H new ATOM 0 HB2 ALA A 145 28.923 6.253 8.369 1.00 0.00 H new ATOM 0 HB3 ALA A 145 29.657 4.664 8.048 1.00 0.00 H new ATOM 1511 N ARG A 146 29.933 3.830 4.977 1.00 0.00 N ATOM 1512 CA ARG A 146 30.724 3.036 4.017 1.00 0.00 C ATOM 1513 C ARG A 146 29.871 1.982 3.297 1.00 0.00 C ATOM 1514 O ARG A 146 28.757 1.682 3.737 1.00 0.00 O ATOM 1515 CB ARG A 146 31.932 2.402 4.743 1.00 0.00 C ATOM 1516 CG ARG A 146 31.545 1.358 5.809 1.00 0.00 C ATOM 1517 CD ARG A 146 32.750 0.878 6.628 1.00 0.00 C ATOM 1518 NE ARG A 146 33.741 0.164 5.794 1.00 0.00 N ATOM 1519 CZ ARG A 146 34.965 0.546 5.467 1.00 0.00 C ATOM 1520 NH1 ARG A 146 35.469 1.686 5.848 1.00 0.00 N ATOM 1521 NH2 ARG A 146 35.720 -0.219 4.732 1.00 0.00 N ATOM 1522 OXT ARG A 146 30.305 1.441 2.282 1.00 0.00 O ATOM 0 H ARG A 146 29.177 3.285 5.392 1.00 0.00 H new ATOM 0 HA ARG A 146 31.094 3.703 3.239 1.00 0.00 H new ATOM 0 HB2 ARG A 146 32.580 1.929 4.005 1.00 0.00 H new ATOM 0 HB3 ARG A 146 32.514 3.192 5.218 1.00 0.00 H new ATOM 0 HG2 ARG A 146 30.802 1.788 6.481 1.00 0.00 H new ATOM 0 HG3 ARG A 146 31.077 0.502 5.322 1.00 0.00 H new ATOM 0 HD2 ARG A 146 33.228 1.734 7.105 1.00 0.00 H new ATOM 0 HD3 ARG A 146 32.406 0.219 7.426 1.00 0.00 H new ATOM 0 HE ARG A 146 33.443 -0.738 5.423 1.00 0.00 H new ATOM 0 HH11 ARG A 146 34.915 2.323 6.421 1.00 0.00 H new ATOM 0 HH12 ARG A 146 36.418 1.942 5.573 1.00 0.00 H new ATOM 0 HH21 ARG A 146 35.369 -1.119 4.405 1.00 0.00 H new ATOM 0 HH22 ARG A 146 36.663 0.082 4.484 1.00 0.00 H new TER 1536 ARG A 146 ATOM 1537 O5' C B 147 -0.295 -12.542 6.104 1.00 0.00 O ATOM 1538 C5' C B 147 -0.199 -11.348 5.334 1.00 0.00 C ATOM 1539 C4' C B 147 0.491 -10.191 6.082 1.00 0.00 C ATOM 1540 O4' C B 147 1.887 -10.430 6.231 1.00 0.00 O ATOM 1541 C3' C B 147 0.353 -8.873 5.291 1.00 0.00 C ATOM 1542 O3' C B 147 0.411 -7.754 6.168 1.00 0.00 O ATOM 1543 C2' C B 147 1.581 -8.978 4.376 1.00 0.00 C ATOM 1544 O2' C B 147 1.986 -7.768 3.750 1.00 0.00 O ATOM 1545 C1' C B 147 2.614 -9.614 5.319 1.00 0.00 C ATOM 1546 N1 C B 147 3.654 -10.471 4.680 1.00 0.00 N ATOM 1547 C2 C B 147 4.934 -10.513 5.261 1.00 0.00 C ATOM 1548 O2 C B 147 5.235 -9.817 6.234 1.00 0.00 O ATOM 1549 N3 C B 147 5.890 -11.338 4.760 1.00 0.00 N ATOM 1550 C4 C B 147 5.597 -12.087 3.720 1.00 0.00 C ATOM 1551 N4 C B 147 6.546 -12.876 3.305 1.00 0.00 N ATOM 1552 C5 C B 147 4.322 -12.102 3.096 1.00 0.00 C ATOM 1553 C6 C B 147 3.367 -11.289 3.611 1.00 0.00 C ATOM 0 H5' C B 147 -1.200 -11.034 5.038 1.00 0.00 H new ATOM 0 H5'' C B 147 0.353 -11.559 4.418 1.00 0.00 H new ATOM 0 H4' C B 147 0.008 -10.120 7.056 1.00 0.00 H new ATOM 0 H3' C B 147 -0.585 -8.736 4.754 1.00 0.00 H new ATOM 0 H2' C B 147 1.397 -9.568 3.478 1.00 0.00 H new ATOM 0 HO2' C B 147 2.857 -7.491 4.105 1.00 0.00 H new ATOM 0 HO5' C B 147 -0.742 -13.236 5.577 1.00 0.00 H new ATOM 0 H1' C B 147 3.161 -8.787 5.771 1.00 0.00 H new ATOM 0 H41 C B 147 6.388 -13.485 2.502 1.00 0.00 H new ATOM 0 H42 C B 147 7.447 -12.885 3.782 1.00 0.00 H new ATOM 0 H5 C B 147 4.121 -12.736 2.245 1.00 0.00 H new ATOM 0 H6 C B 147 2.377 -11.283 3.180 1.00 0.00 H new ATOM 1566 P U B 148 -0.786 -7.401 7.185 1.00 0.00 P ATOM 1567 OP1 U B 148 -0.186 -7.039 8.491 1.00 0.00 O ATOM 1568 OP2 U B 148 -1.803 -8.476 7.138 1.00 0.00 O ATOM 1569 O5' U B 148 -1.486 -6.098 6.584 1.00 0.00 O ATOM 1570 C5' U B 148 -0.730 -5.000 6.121 1.00 0.00 C ATOM 1571 C4' U B 148 -1.467 -3.665 6.268 1.00 0.00 C ATOM 1572 O4' U B 148 -2.767 -3.751 5.692 1.00 0.00 O ATOM 1573 C3' U B 148 -1.572 -3.208 7.729 1.00 0.00 C ATOM 1574 O3' U B 148 -1.348 -1.805 7.744 1.00 0.00 O ATOM 1575 C2' U B 148 -3.000 -3.644 8.057 1.00 0.00 C ATOM 1576 O2' U B 148 -3.641 -2.974 9.136 1.00 0.00 O ATOM 1577 C1' U B 148 -3.707 -3.453 6.714 1.00 0.00 C ATOM 1578 N1 U B 148 -4.919 -4.313 6.634 1.00 0.00 N ATOM 1579 C2 U B 148 -6.161 -3.693 6.457 1.00 0.00 C ATOM 1580 O2 U B 148 -6.292 -2.505 6.170 1.00 0.00 O ATOM 1581 N3 U B 148 -7.285 -4.478 6.616 1.00 0.00 N ATOM 1582 C4 U B 148 -7.291 -5.809 6.966 1.00 0.00 C ATOM 1583 O4 U B 148 -8.353 -6.404 7.122 1.00 0.00 O ATOM 1584 C5 U B 148 -5.976 -6.396 7.089 1.00 0.00 C ATOM 1585 C6 U B 148 -4.845 -5.662 6.907 1.00 0.00 C ATOM 0 H5' U B 148 -0.477 -5.156 5.072 1.00 0.00 H new ATOM 0 H5'' U B 148 0.209 -4.954 6.672 1.00 0.00 H new ATOM 0 H4' U B 148 -0.878 -2.918 5.736 1.00 0.00 H new ATOM 0 H3' U B 148 -0.866 -3.611 8.454 1.00 0.00 H new ATOM 0 H2' U B 148 -3.025 -4.663 8.443 1.00 0.00 H new ATOM 0 HO2' U B 148 -3.395 -2.025 9.124 1.00 0.00 H new ATOM 0 H1' U B 148 -4.055 -2.427 6.596 1.00 0.00 H new ATOM 0 H3 U B 148 -8.190 -4.033 6.461 1.00 0.00 H new ATOM 0 H5 U B 148 -5.889 -7.445 7.332 1.00 0.00 H new ATOM 0 H6 U B 148 -3.880 -6.141 6.977 1.00 0.00 H new ATOM 1596 P C B 149 -1.036 -1.025 9.104 1.00 0.00 P ATOM 1597 OP1 C B 149 -0.007 -1.770 9.865 1.00 0.00 O ATOM 1598 OP2 C B 149 -2.338 -0.719 9.739 1.00 0.00 O ATOM 1599 O5' C B 149 -0.403 0.350 8.570 1.00 0.00 O ATOM 1600 C5' C B 149 0.954 0.437 8.164 1.00 0.00 C ATOM 1601 C4' C B 149 1.293 1.763 7.461 1.00 0.00 C ATOM 1602 O4' C B 149 0.829 1.745 6.116 1.00 0.00 O ATOM 1603 C3' C B 149 0.686 2.993 8.158 1.00 0.00 C ATOM 1604 O3' C B 149 1.492 4.162 8.070 1.00 0.00 O ATOM 1605 C2' C B 149 -0.594 3.204 7.353 1.00 0.00 C ATOM 1606 O2' C B 149 -1.182 4.492 7.423 1.00 0.00 O ATOM 1607 C1' C B 149 -0.169 2.749 5.963 1.00 0.00 C ATOM 1608 N1 C B 149 -1.366 2.214 5.274 1.00 0.00 N ATOM 1609 C2 C B 149 -2.094 3.037 4.414 1.00 0.00 C ATOM 1610 O2 C B 149 -1.750 4.192 4.165 1.00 0.00 O ATOM 1611 N3 C B 149 -3.219 2.581 3.823 1.00 0.00 N ATOM 1612 C4 C B 149 -3.596 1.344 4.032 1.00 0.00 C ATOM 1613 N4 C B 149 -4.678 0.971 3.402 1.00 0.00 N ATOM 1614 C5 C B 149 -2.892 0.464 4.892 1.00 0.00 C ATOM 1615 C6 C B 149 -1.799 0.944 5.537 1.00 0.00 C ATOM 0 H5' C B 149 1.179 -0.391 7.492 1.00 0.00 H new ATOM 0 H5'' C B 149 1.596 0.322 9.037 1.00 0.00 H new ATOM 0 H4' C B 149 2.379 1.850 7.502 1.00 0.00 H new ATOM 0 H3' C B 149 0.560 2.828 9.228 1.00 0.00 H new ATOM 0 H2' C B 149 -1.435 2.639 7.755 1.00 0.00 H new ATOM 0 HO2' C B 149 -0.643 5.126 6.906 1.00 0.00 H new ATOM 0 H1' C B 149 0.243 3.567 5.372 1.00 0.00 H new ATOM 0 H41 C B 149 -5.033 0.021 3.516 1.00 0.00 H new ATOM 0 H42 C B 149 -5.168 1.629 2.796 1.00 0.00 H new ATOM 0 H5 C B 149 -3.216 -0.557 5.030 1.00 0.00 H new ATOM 0 H6 C B 149 -1.275 0.328 6.253 1.00 0.00 H new ATOM 1627 P U B 150 2.911 4.272 8.796 1.00 0.00 P ATOM 1628 OP1 U B 150 2.922 3.343 9.954 1.00 0.00 O ATOM 1629 OP2 U B 150 3.209 5.708 9.018 1.00 0.00 O ATOM 1630 O5' U B 150 3.912 3.704 7.678 1.00 0.00 O ATOM 1631 C5' U B 150 4.013 4.313 6.402 1.00 0.00 C ATOM 1632 C4' U B 150 5.474 4.329 5.944 1.00 0.00 C ATOM 1633 O4' U B 150 5.588 4.768 4.591 1.00 0.00 O ATOM 1634 C3' U B 150 6.335 5.215 6.841 1.00 0.00 C ATOM 1635 O3' U B 150 6.968 4.422 7.842 1.00 0.00 O ATOM 1636 C2' U B 150 7.276 5.876 5.826 1.00 0.00 C ATOM 1637 O2' U B 150 8.520 5.204 5.649 1.00 0.00 O ATOM 1638 C1' U B 150 6.542 5.826 4.492 1.00 0.00 C ATOM 1639 N1 U B 150 5.944 7.161 4.186 1.00 0.00 N ATOM 1640 C2 U B 150 6.780 8.211 3.773 1.00 0.00 C ATOM 1641 O2 U B 150 8.001 8.106 3.652 1.00 0.00 O ATOM 1642 N3 U B 150 6.178 9.424 3.501 1.00 0.00 N ATOM 1643 C4 U B 150 4.820 9.650 3.466 1.00 0.00 C ATOM 1644 O4 U B 150 4.389 10.739 3.099 1.00 0.00 O ATOM 1645 C5 U B 150 4.016 8.522 3.877 1.00 0.00 C ATOM 1646 C6 U B 150 4.592 7.354 4.267 1.00 0.00 C ATOM 0 H5' U B 150 3.625 5.331 6.444 1.00 0.00 H new ATOM 0 H5'' U B 150 3.403 3.769 5.681 1.00 0.00 H new ATOM 0 H4' U B 150 5.837 3.304 6.016 1.00 0.00 H new ATOM 0 H3' U B 150 5.808 5.969 7.425 1.00 0.00 H new ATOM 0 H2' U B 150 7.514 6.876 6.188 1.00 0.00 H new ATOM 0 HO2' U B 150 9.061 5.685 4.988 1.00 0.00 H new ATOM 0 H1' U B 150 7.206 5.616 3.654 1.00 0.00 H new ATOM 0 H3 U B 150 6.790 10.218 3.310 1.00 0.00 H new ATOM 0 H5 U B 150 2.939 8.608 3.874 1.00 0.00 H new ATOM 0 H6 U B 150 3.968 6.560 4.650 1.00 0.00 H new ATOM 1657 P C B 151 7.951 5.021 8.956 1.00 0.00 P ATOM 1658 OP1 C B 151 7.689 4.325 10.240 1.00 0.00 O ATOM 1659 OP2 C B 151 7.913 6.504 8.911 1.00 0.00 O ATOM 1660 O5' C B 151 9.381 4.533 8.401 1.00 0.00 O ATOM 1661 C5' C B 151 9.609 3.160 8.098 1.00 0.00 C ATOM 1662 C4' C B 151 11.092 2.814 7.905 1.00 0.00 C ATOM 1663 O4' C B 151 11.679 3.585 6.851 1.00 0.00 O ATOM 1664 C3' C B 151 11.924 3.026 9.179 1.00 0.00 C ATOM 1665 O3' C B 151 12.945 2.038 9.269 1.00 0.00 O ATOM 1666 C2' C B 151 12.532 4.402 8.896 1.00 0.00 C ATOM 1667 O2' C B 151 13.718 4.653 9.644 1.00 0.00 O ATOM 1668 C1' C B 151 12.774 4.319 7.385 1.00 0.00 C ATOM 1669 N1 C B 151 12.885 5.670 6.769 1.00 0.00 N ATOM 1670 C2 C B 151 14.126 6.096 6.269 1.00 0.00 C ATOM 1671 O2 C B 151 15.101 5.342 6.220 1.00 0.00 O ATOM 1672 N3 C B 151 14.286 7.369 5.820 1.00 0.00 N ATOM 1673 C4 C B 151 13.253 8.186 5.858 1.00 0.00 C ATOM 1674 N4 C B 151 13.463 9.410 5.456 1.00 0.00 N ATOM 1675 C5 C B 151 11.968 7.807 6.329 1.00 0.00 C ATOM 1676 C6 C B 151 11.818 6.535 6.777 1.00 0.00 C ATOM 0 H5' C B 151 9.063 2.901 7.191 1.00 0.00 H new ATOM 0 H5'' C B 151 9.202 2.546 8.902 1.00 0.00 H new ATOM 0 H4' C B 151 11.109 1.755 7.648 1.00 0.00 H new ATOM 0 H3' C B 151 11.363 2.960 10.111 1.00 0.00 H new ATOM 0 H2' C B 151 11.895 5.236 9.192 1.00 0.00 H new ATOM 0 HO2' C B 151 14.090 3.804 9.962 1.00 0.00 H new ATOM 0 H1' C B 151 13.721 3.825 7.167 1.00 0.00 H new ATOM 0 H41 C B 151 12.700 10.087 5.463 1.00 0.00 H new ATOM 0 H42 C B 151 14.390 9.689 5.135 1.00 0.00 H new ATOM 0 H5 C B 151 11.143 8.504 6.331 1.00 0.00 H new ATOM 0 H6 C B 151 10.857 6.202 7.141 1.00 0.00 H new ATOM 1688 P U B 152 12.684 0.642 10.005 1.00 0.00 P ATOM 1689 OP1 U B 152 11.295 0.201 9.728 1.00 0.00 O ATOM 1690 OP2 U B 152 13.137 0.772 11.410 1.00 0.00 O ATOM 1691 O5' U B 152 13.703 -0.343 9.239 1.00 0.00 O ATOM 1692 C5' U B 152 13.324 -1.056 8.066 1.00 0.00 C ATOM 1693 C4' U B 152 13.147 -2.579 8.273 1.00 0.00 C ATOM 1694 O4' U B 152 14.245 -3.266 7.672 1.00 0.00 O ATOM 1695 C3' U B 152 13.105 -3.059 9.738 1.00 0.00 C ATOM 1696 O3' U B 152 12.388 -4.291 9.811 1.00 0.00 O ATOM 1697 C2' U B 152 14.601 -3.246 10.030 1.00 0.00 C ATOM 1698 O2' U B 152 14.880 -4.121 11.124 1.00 0.00 O ATOM 1699 C1' U B 152 15.090 -3.800 8.685 1.00 0.00 C ATOM 1700 N1 U B 152 16.520 -3.487 8.396 1.00 0.00 N ATOM 1701 C2 U B 152 17.398 -4.552 8.149 1.00 0.00 C ATOM 1702 O2 U B 152 17.065 -5.739 8.183 1.00 0.00 O ATOM 1703 N3 U B 152 18.704 -4.232 7.839 1.00 0.00 N ATOM 1704 C4 U B 152 19.218 -2.959 7.748 1.00 0.00 C ATOM 1705 O4 U B 152 20.401 -2.795 7.455 1.00 0.00 O ATOM 1706 C5 U B 152 18.263 -1.906 8.022 1.00 0.00 C ATOM 1707 C6 U B 152 16.965 -2.182 8.328 1.00 0.00 C ATOM 0 H5' U B 152 14.078 -0.891 7.296 1.00 0.00 H new ATOM 0 H5'' U B 152 12.389 -0.642 7.690 1.00 0.00 H new ATOM 0 H4' U B 152 12.177 -2.796 7.825 1.00 0.00 H new ATOM 0 H3' U B 152 12.609 -2.390 10.442 1.00 0.00 H new ATOM 0 H2' U B 152 15.096 -2.330 10.353 1.00 0.00 H new ATOM 0 HO2' U B 152 15.850 -4.191 11.248 1.00 0.00 H new ATOM 0 HO3' U B 152 12.923 -4.952 10.298 1.00 0.00 H new ATOM 0 H1' U B 152 15.037 -4.888 8.718 1.00 0.00 H new ATOM 0 H3 U B 152 19.344 -5.006 7.662 1.00 0.00 H new ATOM 0 H5 U B 152 18.588 -0.877 7.983 1.00 0.00 H new ATOM 0 H6 U B 152 16.277 -1.372 8.519 1.00 0.00 H new TER 1719 U B 152