USER MOD reduce.3.24.130724 H: found=0, std=0, add=1316, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1316 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 48 SER OG : rot 99:sc= 1.05 USER MOD Set 1.2: B 30 THR OG1 : rot -167:sc= 1.24 USER MOD Set 2.1: A 42 THR OG1 : rot 86:sc= 1.25 USER MOD Set 2.2: B 68 SER OG : rot 180:sc= -0.0866 USER MOD Set 3.1: A 39 ASN : amide:sc= 0.135 K(o=0.29,f=-1.2) USER MOD Set 3.2: A 43 ASN : amide:sc= 0.152 K(o=0.29,f=-0.75) USER MOD Single : A 1 MET CE :methyl -144:sc= 0 (180deg=-1.11) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= -0.0438 X(o=-0.044,f=-0.082) USER MOD Single : A 5 SER OG : rot 180:sc= 0.00726 USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0.19 K(o=0.19,f=-3.7!) USER MOD Single : A 14 GLN : amide:sc= -1.9! C(o=-1.9!,f=-7.1!) USER MOD Single : A 21 ASN : amide:sc=-0.00591 X(o=-0.0059,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= 0.837 K(o=0.84,f=-6.2!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 75:sc= -1.14 USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl -136:sc=-0.00569 (180deg=-1.67!) USER MOD Single : A 46 ASN : amide:sc= 0.828 K(o=0.83,f=-7.5!) USER MOD Single : A 47 THR OG1 : rot -67:sc= 1.19 USER MOD Single : A 53 GLN : amide:sc= -2.22! C(o=-2.2!,f=-7.8!) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 ASN : amide:sc= 1.21 K(o=1.2,f=-0.16) USER MOD Single : A 60 SER OG : rot 16:sc= -0.784 USER MOD Single : A 66 GLN : amide:sc=-0.00104 X(o=-0.001,f=-0.28) USER MOD Single : A 67 SER OG : rot 53:sc= 1.22 USER MOD Single : A 68 SER OG : rot 70:sc= 0.839 USER MOD Single : A 70 ASN : amide:sc= -0.287 K(o=-0.29,f=-1.5) USER MOD Single : A 73 LYS NZ :NH3+ 166:sc= 1.71 (180deg=1.46) USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=-0.0089) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=-0.0049) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=-0.0076) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 82 HIS : no HD1:sc= -0.0558 X(o=-0.056,f=0) USER MOD Single : A 83 HIS : no HE2:sc= 0.041 X(o=0.041,f=-0.46) USER MOD Single : B 1 MET CE :methyl -160:sc= -0.123 (180deg=-0.634) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 GLN : amide:sc= -1.58! C(o=-1.6!,f=-6.3!) USER MOD Single : B 5 SER OG : rot -58:sc= 0.431 USER MOD Single : B 7 TYR OH : rot 130:sc= -1.14 USER MOD Single : B 8 SER OG : rot 180:sc= 0 USER MOD Single : B 11 GLN : amide:sc= -0.533 K(o=-0.53,f=-3.1!) USER MOD Single : B 14 GLN : amide:sc= -0.0127 X(o=-0.013,f=-0.021) USER MOD Single : B 21 ASN : amide:sc= -0.0495 X(o=-0.05,f=0) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 HIS : no HD1:sc= 0 X(o=0,f=-0.0059) USER MOD Single : B 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 SER OG : rot 180:sc= -0.622 USER MOD Single : B 35 MET CE :methyl -152:sc= -0.172 (180deg=-1.43) USER MOD Single : B 39 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : B 40 MET CE :methyl -142:sc= 0 (180deg=-1.47!) USER MOD Single : B 42 THR OG1 : rot 74:sc= 1.14 USER MOD Single : B 43 ASN : amide:sc= 0 X(o=0,f=-0.0091) USER MOD Single : B 46 ASN : amide:sc= 0 X(o=0,f=-0.036) USER MOD Single : B 47 THR OG1 : rot -32:sc= 0.595 USER MOD Single : B 48 SER OG : rot 180:sc= 0 USER MOD Single : B 53 GLN : amide:sc= -0.0568 X(o=-0.057,f=0) USER MOD Single : B 55 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : B 59 ASN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : B 60 SER OG : rot -81:sc= 1.17 USER MOD Single : B 66 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : B 67 SER OG : rot 80:sc= 0.967 USER MOD Single : B 70 ASN : amide:sc= -0.0887 X(o=-0.089,f=-0.058) USER MOD Single : B 73 LYS NZ :NH3+ 167:sc= -0.0217 (180deg=-0.243) USER MOD Single : B 75 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 78 HIS : no HD1:sc=-0.00794 X(o=-0.0079,f=-0.013) USER MOD Single : B 79 HIS : no HD1:sc= -0.149 X(o=-0.15,f=-0.01) USER MOD Single : B 80 HIS : no HE2:sc= -0.175 K(o=-0.18,f=-2.5) USER MOD Single : B 81 HIS : no HD1:sc=-0.00748 X(o=-0.0075,f=0) USER MOD Single : B 82 HIS : no HD1:sc=-0.00121 X(o=-0.0012,f=0) USER MOD Single : B 83 HIS : no HD1:sc= 0 X(o=0,f=-0.07) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -14.862 -5.271 22.465 1.00 0.00 N ATOM 2 CA MET A 1 -14.839 -4.847 21.046 1.00 0.00 C ATOM 3 C MET A 1 -13.433 -5.016 20.476 1.00 0.00 C ATOM 4 O MET A 1 -12.473 -4.481 21.027 1.00 0.00 O ATOM 5 CB MET A 1 -15.282 -3.384 20.932 1.00 0.00 C ATOM 6 CG MET A 1 -15.460 -2.902 19.502 1.00 0.00 C ATOM 7 SD MET A 1 -16.739 -3.814 18.615 1.00 0.00 S ATOM 8 CE MET A 1 -16.815 -2.889 17.081 1.00 0.00 C ATOM 0 H1 MET A 1 -15.822 -5.153 22.847 1.00 0.00 H new ATOM 0 H2 MET A 1 -14.582 -6.270 22.533 1.00 0.00 H new ATOM 0 H3 MET A 1 -14.198 -4.687 23.013 1.00 0.00 H new ATOM 0 HA MET A 1 -15.528 -5.470 20.476 1.00 0.00 H new ATOM 0 HB2 MET A 1 -16.223 -3.257 21.467 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.545 -2.752 21.429 1.00 0.00 H new ATOM 0 HG2 MET A 1 -15.714 -1.842 19.509 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.514 -3.000 18.969 1.00 0.00 H new ATOM 0 HE1 MET A 1 -17.846 -2.852 16.729 1.00 0.00 H new ATOM 0 HE2 MET A 1 -16.452 -1.875 17.249 1.00 0.00 H new ATOM 0 HE3 MET A 1 -16.193 -3.377 16.331 1.00 0.00 H new ATOM 20 N PRO A 2 -13.294 -5.765 19.364 1.00 0.00 N ATOM 21 CA PRO A 2 -11.990 -6.056 18.746 1.00 0.00 C ATOM 22 C PRO A 2 -11.277 -4.811 18.215 1.00 0.00 C ATOM 23 O PRO A 2 -10.077 -4.848 17.930 1.00 0.00 O ATOM 24 CB PRO A 2 -12.338 -7.001 17.587 1.00 0.00 C ATOM 25 CG PRO A 2 -13.692 -7.527 17.910 1.00 0.00 C ATOM 26 CD PRO A 2 -14.392 -6.417 18.635 1.00 0.00 C ATOM 0 HA PRO A 2 -11.299 -6.479 19.475 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -12.337 -6.473 16.634 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -11.611 -7.809 17.505 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -14.231 -7.805 17.004 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -13.628 -8.421 18.530 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -14.885 -5.731 17.946 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -15.159 -6.795 19.311 1.00 0.00 H new ATOM 34 N GLN A 3 -12.014 -3.714 18.082 1.00 0.00 N ATOM 35 CA GLN A 3 -11.442 -2.473 17.581 1.00 0.00 C ATOM 36 C GLN A 3 -10.659 -1.760 18.680 1.00 0.00 C ATOM 37 O GLN A 3 -11.182 -0.878 19.362 1.00 0.00 O ATOM 38 CB GLN A 3 -12.536 -1.553 17.028 1.00 0.00 C ATOM 39 CG GLN A 3 -13.361 -2.181 15.913 1.00 0.00 C ATOM 40 CD GLN A 3 -12.525 -2.579 14.711 1.00 0.00 C ATOM 41 OE1 GLN A 3 -12.014 -3.696 14.640 1.00 0.00 O ATOM 42 NE2 GLN A 3 -12.380 -1.669 13.762 1.00 0.00 N ATOM 0 H GLN A 3 -13.006 -3.660 18.314 1.00 0.00 H new ATOM 0 HA GLN A 3 -10.757 -2.721 16.770 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -13.202 -1.265 17.842 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -12.075 -0.639 16.655 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -13.874 -3.061 16.300 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -14.130 -1.477 15.597 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -12.821 -0.755 13.861 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -11.827 -1.882 12.932 1.00 0.00 H new ATOM 51 N ILE A 4 -9.413 -2.174 18.863 1.00 0.00 N ATOM 52 CA ILE A 4 -8.530 -1.564 19.850 1.00 0.00 C ATOM 53 C ILE A 4 -7.466 -0.745 19.122 1.00 0.00 C ATOM 54 O ILE A 4 -6.503 -0.251 19.718 1.00 0.00 O ATOM 55 CB ILE A 4 -7.862 -2.640 20.744 1.00 0.00 C ATOM 56 CG1 ILE A 4 -8.900 -3.675 21.194 1.00 0.00 C ATOM 57 CG2 ILE A 4 -7.205 -2.001 21.963 1.00 0.00 C ATOM 58 CD1 ILE A 4 -8.319 -4.800 22.026 1.00 0.00 C ATOM 0 H ILE A 4 -8.987 -2.937 18.336 1.00 0.00 H new ATOM 0 HA ILE A 4 -9.118 -0.915 20.500 1.00 0.00 H new ATOM 0 HB ILE A 4 -7.091 -3.139 20.156 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -9.675 -3.171 21.771 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -9.383 -4.099 20.313 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -6.743 -2.776 22.575 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -6.443 -1.294 21.637 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -7.959 -1.476 22.550 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -9.113 -5.492 22.307 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -7.564 -5.330 21.445 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -7.861 -4.388 22.926 1.00 0.00 H new ATOM 70 N SER A 5 -7.672 -0.605 17.816 1.00 0.00 N ATOM 71 CA SER A 5 -6.767 0.133 16.951 1.00 0.00 C ATOM 72 C SER A 5 -6.535 1.547 17.480 1.00 0.00 C ATOM 73 O SER A 5 -7.476 2.252 17.852 1.00 0.00 O ATOM 74 CB SER A 5 -7.351 0.182 15.539 1.00 0.00 C ATOM 75 OG SER A 5 -7.766 -1.110 15.122 1.00 0.00 O ATOM 0 H SER A 5 -8.475 -1.003 17.329 1.00 0.00 H new ATOM 0 HA SER A 5 -5.803 -0.376 16.931 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.198 0.867 15.514 1.00 0.00 H new ATOM 0 HB3 SER A 5 -6.606 0.571 14.845 1.00 0.00 H new ATOM 0 HG SER A 5 -8.138 -1.058 14.217 1.00 0.00 H new ATOM 81 N ARG A 6 -5.276 1.958 17.496 1.00 0.00 N ATOM 82 CA ARG A 6 -4.886 3.243 18.062 1.00 0.00 C ATOM 83 C ARG A 6 -5.047 4.366 17.039 1.00 0.00 C ATOM 84 O ARG A 6 -4.405 5.413 17.133 1.00 0.00 O ATOM 85 CB ARG A 6 -3.438 3.155 18.552 1.00 0.00 C ATOM 86 CG ARG A 6 -3.087 4.155 19.643 1.00 0.00 C ATOM 87 CD ARG A 6 -4.106 4.136 20.775 1.00 0.00 C ATOM 88 NE ARG A 6 -4.599 2.788 21.056 1.00 0.00 N ATOM 89 CZ ARG A 6 -5.291 2.459 22.141 1.00 0.00 C ATOM 90 NH1 ARG A 6 -5.435 3.322 23.138 1.00 0.00 N ATOM 91 NH2 ARG A 6 -5.812 1.246 22.245 1.00 0.00 N ATOM 0 H ARG A 6 -4.499 1.415 17.120 1.00 0.00 H new ATOM 0 HA ARG A 6 -5.539 3.476 18.903 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -3.253 2.148 18.925 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -2.770 3.309 17.705 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -2.098 3.928 20.040 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -3.036 5.157 19.216 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -3.653 4.550 21.676 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -4.946 4.781 20.516 1.00 0.00 H new ATOM 0 HE ARG A 6 -4.399 2.054 20.376 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -5.012 4.248 23.076 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -5.968 3.059 23.967 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -5.681 0.569 21.494 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -6.344 0.989 23.076 1.00 0.00 H new ATOM 105 N TYR A 7 -5.923 4.139 16.074 1.00 0.00 N ATOM 106 CA TYR A 7 -6.200 5.114 15.037 1.00 0.00 C ATOM 107 C TYR A 7 -7.664 5.510 15.106 1.00 0.00 C ATOM 108 O TYR A 7 -8.543 4.649 15.033 1.00 0.00 O ATOM 109 CB TYR A 7 -5.890 4.526 13.659 1.00 0.00 C ATOM 110 CG TYR A 7 -4.598 3.743 13.609 1.00 0.00 C ATOM 111 CD1 TYR A 7 -3.372 4.389 13.542 1.00 0.00 C ATOM 112 CD2 TYR A 7 -4.609 2.355 13.636 1.00 0.00 C ATOM 113 CE1 TYR A 7 -2.192 3.673 13.502 1.00 0.00 C ATOM 114 CE2 TYR A 7 -3.436 1.631 13.597 1.00 0.00 C ATOM 115 CZ TYR A 7 -2.229 2.292 13.532 1.00 0.00 C ATOM 116 OH TYR A 7 -1.058 1.569 13.493 1.00 0.00 O ATOM 0 H TYR A 7 -6.460 3.276 15.989 1.00 0.00 H new ATOM 0 HA TYR A 7 -5.571 5.991 15.191 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -6.711 3.875 13.359 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -5.842 5.336 12.931 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -3.340 5.468 13.521 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -5.553 1.833 13.688 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -1.245 4.190 13.448 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -3.463 0.552 13.617 1.00 0.00 H new ATOM 0 HH TYR A 7 -1.264 0.611 13.523 1.00 0.00 H new ATOM 126 N SER A 8 -7.932 6.793 15.268 1.00 0.00 N ATOM 127 CA SER A 8 -9.301 7.265 15.356 1.00 0.00 C ATOM 128 C SER A 8 -9.963 7.234 13.988 1.00 0.00 C ATOM 129 O SER A 8 -9.349 7.616 12.991 1.00 0.00 O ATOM 130 CB SER A 8 -9.334 8.680 15.928 1.00 0.00 C ATOM 131 OG SER A 8 -8.732 8.714 17.210 1.00 0.00 O ATOM 0 H SER A 8 -7.224 7.523 15.341 1.00 0.00 H new ATOM 0 HA SER A 8 -9.855 6.604 16.023 1.00 0.00 H new ATOM 0 HB2 SER A 8 -8.811 9.362 15.257 1.00 0.00 H new ATOM 0 HB3 SER A 8 -10.365 9.027 15.995 1.00 0.00 H new ATOM 0 HG SER A 8 -8.760 9.629 17.561 1.00 0.00 H new ATOM 137 N ASP A 9 -11.209 6.770 13.946 1.00 0.00 N ATOM 138 CA ASP A 9 -11.963 6.705 12.696 1.00 0.00 C ATOM 139 C ASP A 9 -12.061 8.091 12.072 1.00 0.00 C ATOM 140 O ASP A 9 -12.018 8.235 10.850 1.00 0.00 O ATOM 141 CB ASP A 9 -13.364 6.130 12.935 1.00 0.00 C ATOM 142 CG ASP A 9 -14.250 7.050 13.753 1.00 0.00 C ATOM 143 OD1 ASP A 9 -14.034 7.158 14.980 1.00 0.00 O ATOM 144 OD2 ASP A 9 -15.159 7.672 13.172 1.00 0.00 O ATOM 0 H ASP A 9 -11.719 6.433 14.763 1.00 0.00 H new ATOM 0 HA ASP A 9 -11.435 6.043 12.009 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -13.840 5.936 11.974 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -13.275 5.171 13.446 1.00 0.00 H new ATOM 149 N GLU A 10 -12.170 9.102 12.936 1.00 0.00 N ATOM 150 CA GLU A 10 -12.162 10.500 12.522 1.00 0.00 C ATOM 151 C GLU A 10 -10.967 10.767 11.614 1.00 0.00 C ATOM 152 O GLU A 10 -11.110 11.222 10.479 1.00 0.00 O ATOM 153 CB GLU A 10 -12.059 11.404 13.756 1.00 0.00 C ATOM 154 CG GLU A 10 -13.020 11.047 14.879 1.00 0.00 C ATOM 155 CD GLU A 10 -12.786 11.887 16.120 1.00 0.00 C ATOM 156 OE1 GLU A 10 -11.857 11.567 16.893 1.00 0.00 O ATOM 157 OE2 GLU A 10 -13.520 12.877 16.321 1.00 0.00 O ATOM 0 H GLU A 10 -12.266 8.971 13.943 1.00 0.00 H new ATOM 0 HA GLU A 10 -13.086 10.712 11.983 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.040 11.360 14.139 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -12.241 12.435 13.452 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -14.045 11.186 14.536 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.908 9.992 15.130 1.00 0.00 H new ATOM 164 N GLN A 11 -9.788 10.450 12.135 1.00 0.00 N ATOM 165 CA GLN A 11 -8.535 10.649 11.425 1.00 0.00 C ATOM 166 C GLN A 11 -8.504 9.828 10.145 1.00 0.00 C ATOM 167 O GLN A 11 -8.319 10.363 9.057 1.00 0.00 O ATOM 168 CB GLN A 11 -7.363 10.235 12.316 1.00 0.00 C ATOM 169 CG GLN A 11 -7.284 10.989 13.631 1.00 0.00 C ATOM 170 CD GLN A 11 -6.357 10.315 14.624 1.00 0.00 C ATOM 171 OE1 GLN A 11 -6.211 9.090 14.624 1.00 0.00 O ATOM 172 NE2 GLN A 11 -5.726 11.106 15.474 1.00 0.00 N ATOM 0 H GLN A 11 -9.676 10.046 13.065 1.00 0.00 H new ATOM 0 HA GLN A 11 -8.451 11.705 11.169 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -7.440 9.168 12.526 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -6.433 10.386 11.767 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -6.937 12.005 13.445 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -8.282 11.067 14.063 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -5.876 12.114 15.440 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -5.089 10.708 16.165 1.00 0.00 H new ATOM 181 N VAL A 12 -8.710 8.525 10.294 1.00 0.00 N ATOM 182 CA VAL A 12 -8.576 7.583 9.189 1.00 0.00 C ATOM 183 C VAL A 12 -9.441 7.968 7.993 1.00 0.00 C ATOM 184 O VAL A 12 -8.930 8.168 6.891 1.00 0.00 O ATOM 185 CB VAL A 12 -8.941 6.151 9.627 1.00 0.00 C ATOM 186 CG1 VAL A 12 -8.776 5.169 8.476 1.00 0.00 C ATOM 187 CG2 VAL A 12 -8.094 5.732 10.816 1.00 0.00 C ATOM 0 H VAL A 12 -8.973 8.093 11.180 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.529 7.619 8.888 1.00 0.00 H new ATOM 0 HB VAL A 12 -9.989 6.142 9.926 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -9.040 4.166 8.812 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -9.429 5.460 7.653 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -7.740 5.177 8.137 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -8.362 4.719 11.115 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -7.040 5.762 10.540 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -8.271 6.414 11.647 1.00 0.00 H new ATOM 197 N GLU A 13 -10.742 8.090 8.214 1.00 0.00 N ATOM 198 CA GLU A 13 -11.676 8.288 7.116 1.00 0.00 C ATOM 199 C GLU A 13 -11.558 9.684 6.515 1.00 0.00 C ATOM 200 O GLU A 13 -11.728 9.858 5.310 1.00 0.00 O ATOM 201 CB GLU A 13 -13.109 8.013 7.575 1.00 0.00 C ATOM 202 CG GLU A 13 -13.293 6.612 8.135 1.00 0.00 C ATOM 203 CD GLU A 13 -14.744 6.246 8.353 1.00 0.00 C ATOM 204 OE1 GLU A 13 -15.332 6.677 9.367 1.00 0.00 O ATOM 205 OE2 GLU A 13 -15.302 5.504 7.519 1.00 0.00 O ATOM 0 H GLU A 13 -11.173 8.056 9.138 1.00 0.00 H new ATOM 0 HA GLU A 13 -11.418 7.576 6.332 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -13.388 8.742 8.336 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -13.788 8.155 6.734 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -12.842 5.892 7.452 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -12.758 6.532 9.081 1.00 0.00 H new ATOM 212 N GLN A 14 -11.240 10.674 7.339 1.00 0.00 N ATOM 213 CA GLN A 14 -11.122 12.043 6.854 1.00 0.00 C ATOM 214 C GLN A 14 -9.796 12.250 6.125 1.00 0.00 C ATOM 215 O GLN A 14 -9.740 12.938 5.103 1.00 0.00 O ATOM 216 CB GLN A 14 -11.266 13.039 8.010 1.00 0.00 C ATOM 217 CG GLN A 14 -11.227 14.502 7.584 1.00 0.00 C ATOM 218 CD GLN A 14 -12.361 14.892 6.648 1.00 0.00 C ATOM 219 OE1 GLN A 14 -12.848 14.086 5.855 1.00 0.00 O ATOM 220 NE2 GLN A 14 -12.793 16.138 6.738 1.00 0.00 N ATOM 0 H GLN A 14 -11.061 10.557 8.336 1.00 0.00 H new ATOM 0 HA GLN A 14 -11.929 12.222 6.144 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -12.208 12.847 8.525 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -10.467 12.861 8.730 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -11.267 15.132 8.473 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -10.275 14.704 7.093 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -12.366 16.779 7.407 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -13.554 16.459 6.139 1.00 0.00 H new ATOM 229 N LEU A 15 -8.736 11.640 6.640 1.00 0.00 N ATOM 230 CA LEU A 15 -7.424 11.751 6.016 1.00 0.00 C ATOM 231 C LEU A 15 -7.404 10.988 4.697 1.00 0.00 C ATOM 232 O LEU A 15 -6.884 11.476 3.698 1.00 0.00 O ATOM 233 CB LEU A 15 -6.331 11.223 6.949 1.00 0.00 C ATOM 234 CG LEU A 15 -4.895 11.421 6.457 1.00 0.00 C ATOM 235 CD1 LEU A 15 -4.571 12.901 6.332 1.00 0.00 C ATOM 236 CD2 LEU A 15 -3.911 10.738 7.397 1.00 0.00 C ATOM 0 H LEU A 15 -8.758 11.067 7.483 1.00 0.00 H new ATOM 0 HA LEU A 15 -7.226 12.805 5.819 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -6.436 11.712 7.917 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -6.498 10.158 7.110 1.00 0.00 H new ATOM 0 HG LEU A 15 -4.804 10.966 5.471 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.546 13.021 5.981 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -5.255 13.364 5.621 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -4.680 13.381 7.305 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -2.895 10.889 7.032 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -4.005 11.165 8.395 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -4.127 9.670 7.437 1.00 0.00 H new ATOM 248 N LEU A 16 -7.994 9.797 4.697 1.00 0.00 N ATOM 249 CA LEU A 16 -8.075 8.983 3.491 1.00 0.00 C ATOM 250 C LEU A 16 -8.877 9.722 2.425 1.00 0.00 C ATOM 251 O LEU A 16 -8.527 9.702 1.244 1.00 0.00 O ATOM 252 CB LEU A 16 -8.713 7.622 3.814 1.00 0.00 C ATOM 253 CG LEU A 16 -8.545 6.525 2.754 1.00 0.00 C ATOM 254 CD1 LEU A 16 -8.742 5.156 3.386 1.00 0.00 C ATOM 255 CD2 LEU A 16 -9.531 6.708 1.606 1.00 0.00 C ATOM 0 H LEU A 16 -8.423 9.374 5.520 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.071 8.804 3.107 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.291 7.260 4.751 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -9.779 7.775 3.982 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.535 6.600 2.351 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.621 4.384 2.626 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -8.003 5.009 4.174 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -9.743 5.092 3.812 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -9.386 5.915 0.872 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -10.550 6.664 1.991 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -9.363 7.675 1.133 1.00 0.00 H new ATOM 267 N ALA A 17 -9.939 10.396 2.853 1.00 0.00 N ATOM 268 CA ALA A 17 -10.753 11.193 1.947 1.00 0.00 C ATOM 269 C ALA A 17 -9.928 12.324 1.343 1.00 0.00 C ATOM 270 O ALA A 17 -10.082 12.649 0.170 1.00 0.00 O ATOM 271 CB ALA A 17 -11.972 11.745 2.669 1.00 0.00 C ATOM 0 H ALA A 17 -10.255 10.405 3.823 1.00 0.00 H new ATOM 0 HA ALA A 17 -11.098 10.550 1.138 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.568 12.338 1.975 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -12.573 10.920 3.051 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -11.650 12.373 3.499 1.00 0.00 H new ATOM 277 N GLU A 18 -9.042 12.904 2.148 1.00 0.00 N ATOM 278 CA GLU A 18 -8.154 13.962 1.680 1.00 0.00 C ATOM 279 C GLU A 18 -7.163 13.410 0.655 1.00 0.00 C ATOM 280 O GLU A 18 -6.978 13.988 -0.415 1.00 0.00 O ATOM 281 CB GLU A 18 -7.401 14.590 2.859 1.00 0.00 C ATOM 282 CG GLU A 18 -6.417 15.679 2.454 1.00 0.00 C ATOM 283 CD GLU A 18 -7.093 16.967 2.021 1.00 0.00 C ATOM 284 OE1 GLU A 18 -7.813 16.961 1.003 1.00 0.00 O ATOM 285 OE2 GLU A 18 -6.886 18.000 2.692 1.00 0.00 O ATOM 0 H GLU A 18 -8.920 12.658 3.130 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.758 14.733 1.202 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -8.125 15.010 3.557 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.862 13.807 3.391 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -5.753 15.889 3.292 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -5.794 15.312 1.638 1.00 0.00 H new ATOM 292 N LEU A 19 -6.537 12.283 0.986 1.00 0.00 N ATOM 293 CA LEU A 19 -5.607 11.624 0.071 1.00 0.00 C ATOM 294 C LEU A 19 -6.299 11.264 -1.239 1.00 0.00 C ATOM 295 O LEU A 19 -5.751 11.469 -2.323 1.00 0.00 O ATOM 296 CB LEU A 19 -5.014 10.361 0.710 1.00 0.00 C ATOM 297 CG LEU A 19 -3.731 10.561 1.531 1.00 0.00 C ATOM 298 CD1 LEU A 19 -2.624 11.141 0.665 1.00 0.00 C ATOM 299 CD2 LEU A 19 -3.979 11.453 2.736 1.00 0.00 C ATOM 0 H LEU A 19 -6.656 11.807 1.880 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.798 12.323 -0.140 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -5.770 9.916 1.357 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.807 9.640 -0.081 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.416 9.583 1.894 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.724 11.275 1.266 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.412 10.460 -0.159 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.941 12.105 0.267 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.052 11.575 3.296 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.331 12.429 2.400 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.733 10.997 3.378 1.00 0.00 H new ATOM 311 N LEU A 20 -7.513 10.739 -1.134 1.00 0.00 N ATOM 312 CA LEU A 20 -8.301 10.396 -2.311 1.00 0.00 C ATOM 313 C LEU A 20 -8.682 11.668 -3.068 1.00 0.00 C ATOM 314 O LEU A 20 -8.702 11.685 -4.295 1.00 0.00 O ATOM 315 CB LEU A 20 -9.559 9.622 -1.900 1.00 0.00 C ATOM 316 CG LEU A 20 -9.949 8.448 -2.811 1.00 0.00 C ATOM 317 CD1 LEU A 20 -10.189 8.909 -4.241 1.00 0.00 C ATOM 318 CD2 LEU A 20 -8.881 7.366 -2.772 1.00 0.00 C ATOM 0 H LEU A 20 -7.974 10.541 -0.246 1.00 0.00 H new ATOM 0 HA LEU A 20 -7.704 9.761 -2.966 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -9.414 9.240 -0.889 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -10.395 10.320 -1.860 1.00 0.00 H new ATOM 0 HG LEU A 20 -10.884 8.032 -2.435 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -10.463 8.053 -4.858 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -10.997 9.641 -4.257 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -9.280 9.364 -4.634 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -9.174 6.542 -3.423 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -7.932 7.779 -3.114 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -8.771 7.000 -1.751 1.00 0.00 H new ATOM 330 N ASN A 21 -8.967 12.730 -2.322 1.00 0.00 N ATOM 331 CA ASN A 21 -9.297 14.030 -2.903 1.00 0.00 C ATOM 332 C ASN A 21 -8.144 14.565 -3.747 1.00 0.00 C ATOM 333 O ASN A 21 -8.357 15.145 -4.813 1.00 0.00 O ATOM 334 CB ASN A 21 -9.662 15.030 -1.795 1.00 0.00 C ATOM 335 CG ASN A 21 -9.719 16.463 -2.287 1.00 0.00 C ATOM 336 OD1 ASN A 21 -10.725 16.904 -2.844 1.00 0.00 O ATOM 337 ND2 ASN A 21 -8.658 17.216 -2.038 1.00 0.00 N ATOM 0 H ASN A 21 -8.976 12.716 -1.302 1.00 0.00 H new ATOM 0 HA ASN A 21 -10.159 13.900 -3.558 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -10.629 14.758 -1.372 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -8.930 14.956 -0.991 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -8.655 18.199 -2.310 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -7.844 16.813 -1.574 1.00 0.00 H new ATOM 344 N VAL A 22 -6.920 14.366 -3.271 1.00 0.00 N ATOM 345 CA VAL A 22 -5.736 14.755 -4.026 1.00 0.00 C ATOM 346 C VAL A 22 -5.572 13.850 -5.244 1.00 0.00 C ATOM 347 O VAL A 22 -5.162 14.294 -6.319 1.00 0.00 O ATOM 348 CB VAL A 22 -4.460 14.696 -3.157 1.00 0.00 C ATOM 349 CG1 VAL A 22 -3.240 15.140 -3.953 1.00 0.00 C ATOM 350 CG2 VAL A 22 -4.623 15.555 -1.911 1.00 0.00 C ATOM 0 H VAL A 22 -6.722 13.938 -2.367 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.875 15.786 -4.351 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.307 13.662 -2.849 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -2.354 15.090 -3.320 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -3.108 14.484 -4.813 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -3.383 16.165 -4.296 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.715 15.501 -1.311 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -4.804 16.589 -2.203 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.467 15.190 -1.325 1.00 0.00 H new ATOM 360 N LEU A 23 -5.917 12.582 -5.072 1.00 0.00 N ATOM 361 CA LEU A 23 -5.862 11.624 -6.161 1.00 0.00 C ATOM 362 C LEU A 23 -6.857 11.998 -7.258 1.00 0.00 C ATOM 363 O LEU A 23 -6.481 12.118 -8.421 1.00 0.00 O ATOM 364 CB LEU A 23 -6.149 10.208 -5.648 1.00 0.00 C ATOM 365 CG LEU A 23 -6.059 9.103 -6.704 1.00 0.00 C ATOM 366 CD1 LEU A 23 -4.651 9.020 -7.276 1.00 0.00 C ATOM 367 CD2 LEU A 23 -6.472 7.766 -6.110 1.00 0.00 C ATOM 0 H LEU A 23 -6.239 12.194 -4.185 1.00 0.00 H new ATOM 0 HA LEU A 23 -4.857 11.645 -6.582 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -5.447 9.980 -4.846 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.148 10.192 -5.212 1.00 0.00 H new ATOM 0 HG LEU A 23 -6.744 9.348 -7.516 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.608 8.229 -8.024 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.390 9.972 -7.739 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -3.945 8.800 -6.475 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.402 6.991 -6.874 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -5.811 7.517 -5.280 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.499 7.829 -5.750 1.00 0.00 H new ATOM 379 N GLU A 24 -8.117 12.211 -6.882 1.00 0.00 N ATOM 380 CA GLU A 24 -9.161 12.534 -7.853 1.00 0.00 C ATOM 381 C GLU A 24 -8.998 13.958 -8.381 1.00 0.00 C ATOM 382 O GLU A 24 -9.592 14.325 -9.392 1.00 0.00 O ATOM 383 CB GLU A 24 -10.557 12.341 -7.248 1.00 0.00 C ATOM 384 CG GLU A 24 -10.867 13.258 -6.073 1.00 0.00 C ATOM 385 CD GLU A 24 -12.261 13.038 -5.527 1.00 0.00 C ATOM 386 OE1 GLU A 24 -13.231 13.504 -6.159 1.00 0.00 O ATOM 387 OE2 GLU A 24 -12.402 12.387 -4.467 1.00 0.00 O ATOM 0 H GLU A 24 -8.439 12.166 -5.915 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.056 11.846 -8.691 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -11.302 12.504 -8.026 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.658 11.306 -6.922 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -10.138 13.089 -5.281 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -10.762 14.296 -6.387 1.00 0.00 H new ATOM 394 N LYS A 25 -8.190 14.751 -7.687 1.00 0.00 N ATOM 395 CA LYS A 25 -7.821 16.084 -8.152 1.00 0.00 C ATOM 396 C LYS A 25 -7.115 15.990 -9.502 1.00 0.00 C ATOM 397 O LYS A 25 -7.286 16.840 -10.376 1.00 0.00 O ATOM 398 CB LYS A 25 -6.905 16.751 -7.121 1.00 0.00 C ATOM 399 CG LYS A 25 -6.363 18.111 -7.535 1.00 0.00 C ATOM 400 CD LYS A 25 -5.285 18.584 -6.570 1.00 0.00 C ATOM 401 CE LYS A 25 -4.645 19.884 -7.029 1.00 0.00 C ATOM 402 NZ LYS A 25 -5.559 21.049 -6.888 1.00 0.00 N ATOM 0 H LYS A 25 -7.774 14.491 -6.792 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.722 16.686 -8.272 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -7.455 16.864 -6.186 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -6.065 16.087 -6.919 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -5.953 18.052 -8.543 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.175 18.837 -7.563 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -5.719 18.723 -5.580 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -4.518 17.815 -6.477 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -3.740 20.064 -6.449 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -4.342 19.788 -8.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -5.076 21.911 -7.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -6.412 20.892 -7.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -5.829 21.160 -5.890 1.00 0.00 H new ATOM 416 N HIS A 26 -6.329 14.935 -9.669 1.00 0.00 N ATOM 417 CA HIS A 26 -5.596 14.715 -10.909 1.00 0.00 C ATOM 418 C HIS A 26 -6.249 13.609 -11.728 1.00 0.00 C ATOM 419 O HIS A 26 -6.192 13.622 -12.956 1.00 0.00 O ATOM 420 CB HIS A 26 -4.135 14.346 -10.617 1.00 0.00 C ATOM 421 CG HIS A 26 -3.352 15.432 -9.938 1.00 0.00 C ATOM 422 ND1 HIS A 26 -2.479 16.263 -10.606 1.00 0.00 N ATOM 423 CD2 HIS A 26 -3.310 15.817 -8.640 1.00 0.00 C ATOM 424 CE1 HIS A 26 -1.934 17.106 -9.751 1.00 0.00 C ATOM 425 NE2 HIS A 26 -2.421 16.857 -8.553 1.00 0.00 N ATOM 0 H HIS A 26 -6.182 14.217 -8.960 1.00 0.00 H new ATOM 0 HA HIS A 26 -5.619 15.642 -11.482 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -4.115 13.453 -9.992 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -3.642 14.089 -11.555 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -3.872 15.385 -7.825 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -1.211 17.871 -9.992 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -2.176 17.357 -7.698 1.00 0.00 H new ATOM 434 N LYS A 27 -6.879 12.667 -11.025 1.00 0.00 N ATOM 435 CA LYS A 27 -7.470 11.474 -11.631 1.00 0.00 C ATOM 436 C LYS A 27 -6.417 10.659 -12.367 1.00 0.00 C ATOM 437 O LYS A 27 -6.167 10.848 -13.560 1.00 0.00 O ATOM 438 CB LYS A 27 -8.648 11.812 -12.550 1.00 0.00 C ATOM 439 CG LYS A 27 -9.885 12.260 -11.789 1.00 0.00 C ATOM 440 CD LYS A 27 -11.114 12.327 -12.683 1.00 0.00 C ATOM 441 CE LYS A 27 -10.974 13.376 -13.774 1.00 0.00 C ATOM 442 NZ LYS A 27 -12.230 13.524 -14.559 1.00 0.00 N ATOM 0 H LYS A 27 -6.994 12.711 -10.012 1.00 0.00 H new ATOM 0 HA LYS A 27 -7.867 10.866 -10.818 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -8.348 12.600 -13.241 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -8.895 10.937 -13.152 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -10.073 11.571 -10.966 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -9.704 13.240 -11.349 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -11.283 11.351 -13.139 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -11.991 12.551 -12.076 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -10.710 14.334 -13.326 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -10.158 13.100 -14.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -12.097 14.248 -15.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -12.469 12.616 -15.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.003 13.812 -13.926 1.00 0.00 H new ATOM 456 N ALA A 28 -5.782 9.770 -11.630 1.00 0.00 N ATOM 457 CA ALA A 28 -4.750 8.915 -12.183 1.00 0.00 C ATOM 458 C ALA A 28 -5.283 7.504 -12.376 1.00 0.00 C ATOM 459 O ALA A 28 -6.051 7.009 -11.547 1.00 0.00 O ATOM 460 CB ALA A 28 -3.536 8.904 -11.268 1.00 0.00 C ATOM 0 H ALA A 28 -5.965 9.620 -10.638 1.00 0.00 H new ATOM 0 HA ALA A 28 -4.451 9.307 -13.155 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -2.767 8.259 -11.692 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -3.146 9.917 -11.169 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -3.824 8.528 -10.286 1.00 0.00 H new ATOM 466 N PRO A 29 -4.902 6.847 -13.482 1.00 0.00 N ATOM 467 CA PRO A 29 -5.294 5.462 -13.756 1.00 0.00 C ATOM 468 C PRO A 29 -4.736 4.495 -12.716 1.00 0.00 C ATOM 469 O PRO A 29 -3.782 4.822 -12.005 1.00 0.00 O ATOM 470 CB PRO A 29 -4.687 5.176 -15.133 1.00 0.00 C ATOM 471 CG PRO A 29 -3.605 6.187 -15.296 1.00 0.00 C ATOM 472 CD PRO A 29 -4.070 7.408 -14.559 1.00 0.00 C ATOM 0 HA PRO A 29 -6.376 5.331 -13.724 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -4.291 4.162 -15.187 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -5.435 5.268 -15.921 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -2.663 5.820 -14.889 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -3.432 6.408 -16.349 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -3.233 7.984 -14.164 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -4.641 8.076 -15.204 1.00 0.00 H new ATOM 480 N THR A 30 -5.316 3.300 -12.651 1.00 0.00 N ATOM 481 CA THR A 30 -4.926 2.305 -11.659 1.00 0.00 C ATOM 482 C THR A 30 -3.441 1.938 -11.791 1.00 0.00 C ATOM 483 O THR A 30 -2.786 1.593 -10.806 1.00 0.00 O ATOM 484 CB THR A 30 -5.799 1.039 -11.790 1.00 0.00 C ATOM 485 OG1 THR A 30 -7.185 1.414 -11.865 1.00 0.00 O ATOM 486 CG2 THR A 30 -5.595 0.104 -10.608 1.00 0.00 C ATOM 0 H THR A 30 -6.062 2.997 -13.278 1.00 0.00 H new ATOM 0 HA THR A 30 -5.081 2.742 -10.673 1.00 0.00 H new ATOM 0 HB THR A 30 -5.502 0.516 -12.699 1.00 0.00 H new ATOM 0 HG1 THR A 30 -7.738 0.609 -11.950 1.00 0.00 H new ATOM 0 HG21 THR A 30 -6.223 -0.778 -10.729 1.00 0.00 H new ATOM 0 HG22 THR A 30 -4.549 -0.199 -10.560 1.00 0.00 H new ATOM 0 HG23 THR A 30 -5.866 0.618 -9.686 1.00 0.00 H new ATOM 494 N ASP A 31 -2.915 2.029 -13.011 1.00 0.00 N ATOM 495 CA ASP A 31 -1.493 1.790 -13.260 1.00 0.00 C ATOM 496 C ASP A 31 -0.646 2.771 -12.464 1.00 0.00 C ATOM 497 O ASP A 31 0.275 2.383 -11.747 1.00 0.00 O ATOM 498 CB ASP A 31 -1.156 1.958 -14.746 1.00 0.00 C ATOM 499 CG ASP A 31 -1.990 1.089 -15.659 1.00 0.00 C ATOM 500 OD1 ASP A 31 -3.117 1.504 -16.003 1.00 0.00 O ATOM 501 OD2 ASP A 31 -1.516 0.006 -16.053 1.00 0.00 O ATOM 0 H ASP A 31 -3.453 2.267 -13.845 1.00 0.00 H new ATOM 0 HA ASP A 31 -1.276 0.767 -12.953 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -1.295 3.002 -15.025 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -0.102 1.725 -14.899 1.00 0.00 H new ATOM 506 N LEU A 32 -0.985 4.049 -12.584 1.00 0.00 N ATOM 507 CA LEU A 32 -0.189 5.113 -11.991 1.00 0.00 C ATOM 508 C LEU A 32 -0.388 5.177 -10.483 1.00 0.00 C ATOM 509 O LEU A 32 0.564 5.405 -9.740 1.00 0.00 O ATOM 510 CB LEU A 32 -0.544 6.460 -12.626 1.00 0.00 C ATOM 511 CG LEU A 32 0.250 7.659 -12.096 1.00 0.00 C ATOM 512 CD1 LEU A 32 1.739 7.473 -12.352 1.00 0.00 C ATOM 513 CD2 LEU A 32 -0.240 8.947 -12.736 1.00 0.00 C ATOM 0 H LEU A 32 -1.810 4.373 -13.089 1.00 0.00 H new ATOM 0 HA LEU A 32 0.861 4.893 -12.185 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.389 6.389 -13.703 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.606 6.649 -12.469 1.00 0.00 H new ATOM 0 HG LEU A 32 0.092 7.724 -11.020 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.285 8.335 -11.968 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.085 6.571 -11.848 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.915 7.380 -13.424 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.335 9.788 -12.348 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.112 8.888 -13.817 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.295 9.091 -12.503 1.00 0.00 H new ATOM 525 N SER A 33 -1.619 4.966 -10.032 1.00 0.00 N ATOM 526 CA SER A 33 -1.926 5.040 -8.611 1.00 0.00 C ATOM 527 C SER A 33 -1.105 4.017 -7.829 1.00 0.00 C ATOM 528 O SER A 33 -0.488 4.348 -6.817 1.00 0.00 O ATOM 529 CB SER A 33 -3.427 4.830 -8.380 1.00 0.00 C ATOM 530 OG SER A 33 -3.885 3.654 -9.023 1.00 0.00 O ATOM 0 H SER A 33 -2.417 4.743 -10.628 1.00 0.00 H new ATOM 0 HA SER A 33 -1.659 6.033 -8.248 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.627 4.764 -7.311 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.979 5.691 -8.755 1.00 0.00 H new ATOM 0 HG SER A 33 -3.589 2.868 -8.517 1.00 0.00 H new ATOM 536 N LEU A 34 -1.071 2.783 -8.324 1.00 0.00 N ATOM 537 CA LEU A 34 -0.299 1.728 -7.683 1.00 0.00 C ATOM 538 C LEU A 34 1.197 1.989 -7.837 1.00 0.00 C ATOM 539 O LEU A 34 1.988 1.669 -6.950 1.00 0.00 O ATOM 540 CB LEU A 34 -0.657 0.361 -8.275 1.00 0.00 C ATOM 541 CG LEU A 34 -2.120 -0.061 -8.110 1.00 0.00 C ATOM 542 CD1 LEU A 34 -2.359 -1.414 -8.758 1.00 0.00 C ATOM 543 CD2 LEU A 34 -2.506 -0.103 -6.638 1.00 0.00 C ATOM 0 H LEU A 34 -1.569 2.491 -9.165 1.00 0.00 H new ATOM 0 HA LEU A 34 -0.546 1.724 -6.621 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -0.416 0.370 -9.338 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.023 -0.395 -7.811 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.747 0.679 -8.608 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.404 -1.699 -8.631 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.125 -1.355 -9.821 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.720 -2.161 -8.287 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.549 -0.405 -6.544 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.872 -0.820 -6.116 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.374 0.886 -6.199 1.00 0.00 H new ATOM 555 N MET A 35 1.572 2.584 -8.964 1.00 0.00 N ATOM 556 CA MET A 35 2.968 2.914 -9.235 1.00 0.00 C ATOM 557 C MET A 35 3.483 3.955 -8.243 1.00 0.00 C ATOM 558 O MET A 35 4.545 3.777 -7.640 1.00 0.00 O ATOM 559 CB MET A 35 3.114 3.433 -10.669 1.00 0.00 C ATOM 560 CG MET A 35 4.527 3.852 -11.042 1.00 0.00 C ATOM 561 SD MET A 35 4.643 4.429 -12.748 1.00 0.00 S ATOM 562 CE MET A 35 6.362 4.921 -12.824 1.00 0.00 C ATOM 0 H MET A 35 0.926 2.849 -9.708 1.00 0.00 H new ATOM 0 HA MET A 35 3.565 2.009 -9.120 1.00 0.00 H new ATOM 0 HB2 MET A 35 2.784 2.657 -11.359 1.00 0.00 H new ATOM 0 HB3 MET A 35 2.447 4.285 -10.804 1.00 0.00 H new ATOM 0 HG2 MET A 35 4.858 4.644 -10.370 1.00 0.00 H new ATOM 0 HG3 MET A 35 5.203 3.009 -10.899 1.00 0.00 H new ATOM 0 HE1 MET A 35 6.588 5.301 -13.820 1.00 0.00 H new ATOM 0 HE2 MET A 35 6.550 5.701 -12.087 1.00 0.00 H new ATOM 0 HE3 MET A 35 6.996 4.061 -12.611 1.00 0.00 H new ATOM 572 N VAL A 36 2.725 5.032 -8.071 1.00 0.00 N ATOM 573 CA VAL A 36 3.102 6.094 -7.149 1.00 0.00 C ATOM 574 C VAL A 36 3.127 5.578 -5.714 1.00 0.00 C ATOM 575 O VAL A 36 4.095 5.800 -4.986 1.00 0.00 O ATOM 576 CB VAL A 36 2.145 7.306 -7.242 1.00 0.00 C ATOM 577 CG1 VAL A 36 2.506 8.372 -6.218 1.00 0.00 C ATOM 578 CG2 VAL A 36 2.165 7.895 -8.642 1.00 0.00 C ATOM 0 H VAL A 36 1.844 5.192 -8.560 1.00 0.00 H new ATOM 0 HA VAL A 36 4.101 6.424 -7.436 1.00 0.00 H new ATOM 0 HB VAL A 36 1.137 6.952 -7.023 1.00 0.00 H new ATOM 0 HG11 VAL A 36 1.816 9.211 -6.308 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.437 7.951 -5.215 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.524 8.719 -6.397 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.486 8.746 -8.688 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.176 8.223 -8.884 1.00 0.00 H new ATOM 0 HG23 VAL A 36 1.848 7.138 -9.360 1.00 0.00 H new ATOM 588 N LEU A 37 2.072 4.871 -5.323 1.00 0.00 N ATOM 589 CA LEU A 37 1.968 4.345 -3.968 1.00 0.00 C ATOM 590 C LEU A 37 3.091 3.354 -3.673 1.00 0.00 C ATOM 591 O LEU A 37 3.632 3.338 -2.572 1.00 0.00 O ATOM 592 CB LEU A 37 0.605 3.687 -3.747 1.00 0.00 C ATOM 593 CG LEU A 37 -0.593 4.641 -3.800 1.00 0.00 C ATOM 594 CD1 LEU A 37 -1.893 3.873 -3.617 1.00 0.00 C ATOM 595 CD2 LEU A 37 -0.459 5.729 -2.743 1.00 0.00 C ATOM 0 H LEU A 37 1.278 4.650 -5.924 1.00 0.00 H new ATOM 0 HA LEU A 37 2.066 5.183 -3.278 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.466 2.912 -4.501 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.612 3.190 -2.777 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.610 5.118 -4.780 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.734 4.566 -3.657 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.994 3.134 -4.412 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.885 3.368 -2.651 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.319 6.396 -2.797 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.415 5.272 -1.754 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.453 6.298 -2.920 1.00 0.00 H new ATOM 607 N GLY A 38 3.446 2.543 -4.664 1.00 0.00 N ATOM 608 CA GLY A 38 4.534 1.595 -4.498 1.00 0.00 C ATOM 609 C GLY A 38 5.834 2.273 -4.112 1.00 0.00 C ATOM 610 O GLY A 38 6.490 1.878 -3.144 1.00 0.00 O ATOM 0 H GLY A 38 2.999 2.525 -5.581 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.265 0.867 -3.732 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.677 1.043 -5.427 1.00 0.00 H new ATOM 614 N ASN A 39 6.197 3.306 -4.859 1.00 0.00 N ATOM 615 CA ASN A 39 7.406 4.069 -4.576 1.00 0.00 C ATOM 616 C ASN A 39 7.258 4.817 -3.251 1.00 0.00 C ATOM 617 O ASN A 39 8.177 4.844 -2.429 1.00 0.00 O ATOM 618 CB ASN A 39 7.682 5.058 -5.716 1.00 0.00 C ATOM 619 CG ASN A 39 8.995 5.805 -5.548 1.00 0.00 C ATOM 620 OD1 ASN A 39 9.046 6.867 -4.928 1.00 0.00 O ATOM 621 ND2 ASN A 39 10.065 5.263 -6.110 1.00 0.00 N ATOM 0 H ASN A 39 5.671 3.636 -5.668 1.00 0.00 H new ATOM 0 HA ASN A 39 8.248 3.381 -4.497 1.00 0.00 H new ATOM 0 HB2 ASN A 39 7.696 4.518 -6.663 1.00 0.00 H new ATOM 0 HB3 ASN A 39 6.865 5.778 -5.771 1.00 0.00 H new ATOM 0 HD21 ASN A 39 10.970 5.727 -6.037 1.00 0.00 H new ATOM 0 HD22 ASN A 39 9.984 4.381 -6.616 1.00 0.00 H new ATOM 628 N MET A 40 6.078 5.396 -3.048 1.00 0.00 N ATOM 629 CA MET A 40 5.774 6.172 -1.848 1.00 0.00 C ATOM 630 C MET A 40 5.940 5.334 -0.580 1.00 0.00 C ATOM 631 O MET A 40 6.637 5.738 0.354 1.00 0.00 O ATOM 632 CB MET A 40 4.345 6.714 -1.939 1.00 0.00 C ATOM 633 CG MET A 40 3.919 7.567 -0.755 1.00 0.00 C ATOM 634 SD MET A 40 2.256 8.233 -0.962 1.00 0.00 S ATOM 635 CE MET A 40 2.079 9.186 0.542 1.00 0.00 C ATOM 0 H MET A 40 5.305 5.341 -3.711 1.00 0.00 H new ATOM 0 HA MET A 40 6.479 7.001 -1.789 1.00 0.00 H new ATOM 0 HB2 MET A 40 4.251 7.306 -2.850 1.00 0.00 H new ATOM 0 HB3 MET A 40 3.656 5.874 -2.032 1.00 0.00 H new ATOM 0 HG2 MET A 40 3.959 6.969 0.155 1.00 0.00 H new ATOM 0 HG3 MET A 40 4.625 8.388 -0.628 1.00 0.00 H new ATOM 0 HE1 MET A 40 1.093 9.009 0.971 1.00 0.00 H new ATOM 0 HE2 MET A 40 2.845 8.884 1.256 1.00 0.00 H new ATOM 0 HE3 MET A 40 2.192 10.246 0.316 1.00 0.00 H new ATOM 645 N VAL A 41 5.305 4.167 -0.558 1.00 0.00 N ATOM 646 CA VAL A 41 5.370 3.278 0.598 1.00 0.00 C ATOM 647 C VAL A 41 6.800 2.796 0.832 1.00 0.00 C ATOM 648 O VAL A 41 7.256 2.731 1.975 1.00 0.00 O ATOM 649 CB VAL A 41 4.419 2.067 0.437 1.00 0.00 C ATOM 650 CG1 VAL A 41 4.562 1.102 1.604 1.00 0.00 C ATOM 651 CG2 VAL A 41 2.977 2.535 0.317 1.00 0.00 C ATOM 0 H VAL A 41 4.738 3.814 -1.329 1.00 0.00 H new ATOM 0 HA VAL A 41 5.045 3.850 1.467 1.00 0.00 H new ATOM 0 HB VAL A 41 4.696 1.542 -0.477 1.00 0.00 H new ATOM 0 HG11 VAL A 41 3.883 0.261 1.466 1.00 0.00 H new ATOM 0 HG12 VAL A 41 5.588 0.736 1.650 1.00 0.00 H new ATOM 0 HG13 VAL A 41 4.318 1.616 2.533 1.00 0.00 H new ATOM 0 HG21 VAL A 41 2.322 1.671 0.204 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.698 3.087 1.214 1.00 0.00 H new ATOM 0 HG23 VAL A 41 2.876 3.183 -0.554 1.00 0.00 H new ATOM 661 N THR A 42 7.508 2.489 -0.255 1.00 0.00 N ATOM 662 CA THR A 42 8.903 2.067 -0.170 1.00 0.00 C ATOM 663 C THR A 42 9.742 3.118 0.555 1.00 0.00 C ATOM 664 O THR A 42 10.455 2.808 1.512 1.00 0.00 O ATOM 665 CB THR A 42 9.503 1.818 -1.573 1.00 0.00 C ATOM 666 OG1 THR A 42 8.784 0.775 -2.246 1.00 0.00 O ATOM 667 CG2 THR A 42 10.974 1.439 -1.477 1.00 0.00 C ATOM 0 H THR A 42 7.137 2.525 -1.204 1.00 0.00 H new ATOM 0 HA THR A 42 8.924 1.133 0.392 1.00 0.00 H new ATOM 0 HB THR A 42 9.415 2.743 -2.142 1.00 0.00 H new ATOM 0 HG1 THR A 42 8.002 1.156 -2.698 1.00 0.00 H new ATOM 0 HG21 THR A 42 11.372 1.269 -2.477 1.00 0.00 H new ATOM 0 HG22 THR A 42 11.527 2.247 -0.999 1.00 0.00 H new ATOM 0 HG23 THR A 42 11.077 0.529 -0.886 1.00 0.00 H new ATOM 675 N ASN A 43 9.634 4.364 0.102 1.00 0.00 N ATOM 676 CA ASN A 43 10.385 5.467 0.694 1.00 0.00 C ATOM 677 C ASN A 43 10.048 5.624 2.169 1.00 0.00 C ATOM 678 O ASN A 43 10.944 5.716 3.009 1.00 0.00 O ATOM 679 CB ASN A 43 10.092 6.780 -0.036 1.00 0.00 C ATOM 680 CG ASN A 43 10.613 6.793 -1.460 1.00 0.00 C ATOM 681 OD1 ASN A 43 11.639 6.186 -1.768 1.00 0.00 O ATOM 682 ND2 ASN A 43 9.909 7.491 -2.336 1.00 0.00 N ATOM 0 H ASN A 43 9.032 4.636 -0.675 1.00 0.00 H new ATOM 0 HA ASN A 43 11.445 5.232 0.594 1.00 0.00 H new ATOM 0 HB2 ASN A 43 9.016 6.951 -0.047 1.00 0.00 H new ATOM 0 HB3 ASN A 43 10.541 7.605 0.517 1.00 0.00 H new ATOM 0 HD21 ASN A 43 10.211 7.541 -3.309 1.00 0.00 H new ATOM 0 HD22 ASN A 43 9.064 7.979 -2.038 1.00 0.00 H new ATOM 689 N LEU A 44 8.756 5.643 2.478 1.00 0.00 N ATOM 690 CA LEU A 44 8.298 5.862 3.843 1.00 0.00 C ATOM 691 C LEU A 44 8.803 4.765 4.777 1.00 0.00 C ATOM 692 O LEU A 44 9.419 5.053 5.802 1.00 0.00 O ATOM 693 CB LEU A 44 6.769 5.937 3.887 1.00 0.00 C ATOM 694 CG LEU A 44 6.171 6.296 5.251 1.00 0.00 C ATOM 695 CD1 LEU A 44 6.695 7.641 5.731 1.00 0.00 C ATOM 696 CD2 LEU A 44 4.653 6.319 5.175 1.00 0.00 C ATOM 0 H LEU A 44 8.007 5.509 1.799 1.00 0.00 H new ATOM 0 HA LEU A 44 8.707 6.812 4.187 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.437 6.675 3.157 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.365 4.974 3.573 1.00 0.00 H new ATOM 0 HG LEU A 44 6.474 5.533 5.968 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.258 7.877 6.701 1.00 0.00 H new ATOM 0 HD12 LEU A 44 7.780 7.597 5.823 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.423 8.415 5.013 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.244 6.576 6.152 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.337 7.062 4.443 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.289 5.336 4.876 1.00 0.00 H new ATOM 708 N ILE A 45 8.562 3.511 4.412 1.00 0.00 N ATOM 709 CA ILE A 45 8.971 2.382 5.244 1.00 0.00 C ATOM 710 C ILE A 45 10.484 2.356 5.436 1.00 0.00 C ATOM 711 O ILE A 45 10.973 2.224 6.558 1.00 0.00 O ATOM 712 CB ILE A 45 8.504 1.031 4.649 1.00 0.00 C ATOM 713 CG1 ILE A 45 6.979 0.919 4.720 1.00 0.00 C ATOM 714 CG2 ILE A 45 9.158 -0.141 5.373 1.00 0.00 C ATOM 715 CD1 ILE A 45 6.441 -0.399 4.202 1.00 0.00 C ATOM 0 H ILE A 45 8.087 3.249 3.548 1.00 0.00 H new ATOM 0 HA ILE A 45 8.491 2.519 6.213 1.00 0.00 H new ATOM 0 HB ILE A 45 8.811 0.995 3.604 1.00 0.00 H new ATOM 0 HG12 ILE A 45 6.662 1.050 5.755 1.00 0.00 H new ATOM 0 HG13 ILE A 45 6.537 1.733 4.146 1.00 0.00 H new ATOM 0 HG21 ILE A 45 8.813 -1.078 4.935 1.00 0.00 H new ATOM 0 HG22 ILE A 45 10.241 -0.072 5.273 1.00 0.00 H new ATOM 0 HG23 ILE A 45 8.888 -0.113 6.429 1.00 0.00 H new ATOM 0 HD11 ILE A 45 5.354 -0.406 4.284 1.00 0.00 H new ATOM 0 HD12 ILE A 45 6.727 -0.524 3.158 1.00 0.00 H new ATOM 0 HD13 ILE A 45 6.854 -1.218 4.791 1.00 0.00 H new ATOM 727 N ASN A 46 11.220 2.517 4.345 1.00 0.00 N ATOM 728 CA ASN A 46 12.674 2.389 4.379 1.00 0.00 C ATOM 729 C ASN A 46 13.322 3.467 5.248 1.00 0.00 C ATOM 730 O ASN A 46 14.299 3.200 5.943 1.00 0.00 O ATOM 731 CB ASN A 46 13.252 2.454 2.962 1.00 0.00 C ATOM 732 CG ASN A 46 14.743 2.182 2.937 1.00 0.00 C ATOM 733 OD1 ASN A 46 15.260 1.424 3.754 1.00 0.00 O ATOM 734 ND2 ASN A 46 15.446 2.794 1.998 1.00 0.00 N ATOM 0 H ASN A 46 10.837 2.736 3.426 1.00 0.00 H new ATOM 0 HA ASN A 46 12.900 1.418 4.821 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.742 1.727 2.330 1.00 0.00 H new ATOM 0 HB3 ASN A 46 13.057 3.439 2.537 1.00 0.00 H new ATOM 0 HD21 ASN A 46 16.453 2.643 1.935 1.00 0.00 H new ATOM 0 HD22 ASN A 46 14.981 3.416 1.337 1.00 0.00 H new ATOM 741 N THR A 47 12.777 4.676 5.220 1.00 0.00 N ATOM 742 CA THR A 47 13.410 5.798 5.908 1.00 0.00 C ATOM 743 C THR A 47 12.859 6.013 7.317 1.00 0.00 C ATOM 744 O THR A 47 13.573 6.491 8.203 1.00 0.00 O ATOM 745 CB THR A 47 13.265 7.102 5.097 1.00 0.00 C ATOM 746 OG1 THR A 47 11.882 7.374 4.836 1.00 0.00 O ATOM 747 CG2 THR A 47 14.024 7.003 3.782 1.00 0.00 C ATOM 0 H THR A 47 11.909 4.906 4.736 1.00 0.00 H new ATOM 0 HA THR A 47 14.465 5.539 5.997 1.00 0.00 H new ATOM 0 HB THR A 47 13.686 7.917 5.686 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.524 6.694 4.229 1.00 0.00 H new ATOM 0 HG21 THR A 47 13.909 7.933 3.225 1.00 0.00 H new ATOM 0 HG22 THR A 47 15.081 6.829 3.984 1.00 0.00 H new ATOM 0 HG23 THR A 47 13.626 6.176 3.194 1.00 0.00 H new ATOM 755 N SER A 48 11.599 5.667 7.531 1.00 0.00 N ATOM 756 CA SER A 48 10.961 5.910 8.817 1.00 0.00 C ATOM 757 C SER A 48 11.148 4.725 9.761 1.00 0.00 C ATOM 758 O SER A 48 11.294 4.905 10.971 1.00 0.00 O ATOM 759 CB SER A 48 9.470 6.204 8.623 1.00 0.00 C ATOM 760 OG SER A 48 8.863 6.626 9.834 1.00 0.00 O ATOM 0 H SER A 48 11.001 5.220 6.836 1.00 0.00 H new ATOM 0 HA SER A 48 11.438 6.779 9.270 1.00 0.00 H new ATOM 0 HB2 SER A 48 9.346 6.976 7.864 1.00 0.00 H new ATOM 0 HB3 SER A 48 8.967 5.310 8.254 1.00 0.00 H new ATOM 0 HG SER A 48 8.795 7.604 9.842 1.00 0.00 H new ATOM 766 N ILE A 49 11.150 3.518 9.215 1.00 0.00 N ATOM 767 CA ILE A 49 11.294 2.320 10.030 1.00 0.00 C ATOM 768 C ILE A 49 12.766 1.948 10.169 1.00 0.00 C ATOM 769 O ILE A 49 13.534 2.072 9.213 1.00 0.00 O ATOM 770 CB ILE A 49 10.505 1.134 9.427 1.00 0.00 C ATOM 771 CG1 ILE A 49 9.013 1.480 9.372 1.00 0.00 C ATOM 772 CG2 ILE A 49 10.733 -0.140 10.232 1.00 0.00 C ATOM 773 CD1 ILE A 49 8.156 0.403 8.742 1.00 0.00 C ATOM 0 H ILE A 49 11.054 3.342 8.215 1.00 0.00 H new ATOM 0 HA ILE A 49 10.884 2.536 11.017 1.00 0.00 H new ATOM 0 HB ILE A 49 10.865 0.954 8.414 1.00 0.00 H new ATOM 0 HG12 ILE A 49 8.656 1.668 10.385 1.00 0.00 H new ATOM 0 HG13 ILE A 49 8.885 2.406 8.812 1.00 0.00 H new ATOM 0 HG21 ILE A 49 10.167 -0.958 9.787 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.794 -0.388 10.227 1.00 0.00 H new ATOM 0 HG23 ILE A 49 10.401 0.014 11.259 1.00 0.00 H new ATOM 0 HD11 ILE A 49 7.114 0.722 8.740 1.00 0.00 H new ATOM 0 HD12 ILE A 49 8.484 0.230 7.717 1.00 0.00 H new ATOM 0 HD13 ILE A 49 8.252 -0.520 9.315 1.00 0.00 H new ATOM 785 N ALA A 50 13.150 1.516 11.369 1.00 0.00 N ATOM 786 CA ALA A 50 14.527 1.134 11.654 1.00 0.00 C ATOM 787 C ALA A 50 15.011 0.054 10.685 1.00 0.00 C ATOM 788 O ALA A 50 14.249 -0.835 10.301 1.00 0.00 O ATOM 789 CB ALA A 50 14.653 0.661 13.097 1.00 0.00 C ATOM 0 H ALA A 50 12.518 1.422 12.164 1.00 0.00 H new ATOM 0 HA ALA A 50 15.161 2.010 11.517 1.00 0.00 H new ATOM 0 HB1 ALA A 50 15.686 0.378 13.298 1.00 0.00 H new ATOM 0 HB2 ALA A 50 14.359 1.466 13.771 1.00 0.00 H new ATOM 0 HB3 ALA A 50 14.004 -0.200 13.256 1.00 0.00 H new ATOM 795 N PRO A 51 16.295 0.120 10.287 1.00 0.00 N ATOM 796 CA PRO A 51 16.869 -0.758 9.251 1.00 0.00 C ATOM 797 C PRO A 51 16.728 -2.250 9.554 1.00 0.00 C ATOM 798 O PRO A 51 16.784 -3.080 8.642 1.00 0.00 O ATOM 799 CB PRO A 51 18.349 -0.362 9.225 1.00 0.00 C ATOM 800 CG PRO A 51 18.385 1.018 9.782 1.00 0.00 C ATOM 801 CD PRO A 51 17.291 1.072 10.808 1.00 0.00 C ATOM 0 HA PRO A 51 16.349 -0.627 8.302 1.00 0.00 H new ATOM 0 HB2 PRO A 51 18.952 -1.046 9.823 1.00 0.00 H new ATOM 0 HB3 PRO A 51 18.748 -0.389 8.211 1.00 0.00 H new ATOM 0 HG2 PRO A 51 19.354 1.233 10.232 1.00 0.00 H new ATOM 0 HG3 PRO A 51 18.225 1.760 9.000 1.00 0.00 H new ATOM 0 HD2 PRO A 51 17.650 0.780 11.795 1.00 0.00 H new ATOM 0 HD3 PRO A 51 16.877 2.076 10.903 1.00 0.00 H new ATOM 809 N ALA A 52 16.529 -2.586 10.818 1.00 0.00 N ATOM 810 CA ALA A 52 16.462 -3.978 11.238 1.00 0.00 C ATOM 811 C ALA A 52 15.190 -4.663 10.742 1.00 0.00 C ATOM 812 O ALA A 52 15.238 -5.541 9.878 1.00 0.00 O ATOM 813 CB ALA A 52 16.557 -4.071 12.753 1.00 0.00 C ATOM 0 H ALA A 52 16.411 -1.912 11.574 1.00 0.00 H new ATOM 0 HA ALA A 52 17.308 -4.500 10.791 1.00 0.00 H new ATOM 0 HB1 ALA A 52 16.506 -5.116 13.057 1.00 0.00 H new ATOM 0 HB2 ALA A 52 17.502 -3.642 13.085 1.00 0.00 H new ATOM 0 HB3 ALA A 52 15.731 -3.521 13.204 1.00 0.00 H new ATOM 819 N GLN A 53 14.047 -4.229 11.258 1.00 0.00 N ATOM 820 CA GLN A 53 12.782 -4.914 11.010 1.00 0.00 C ATOM 821 C GLN A 53 12.012 -4.311 9.836 1.00 0.00 C ATOM 822 O GLN A 53 10.802 -4.509 9.722 1.00 0.00 O ATOM 823 CB GLN A 53 11.902 -4.925 12.272 1.00 0.00 C ATOM 824 CG GLN A 53 11.590 -3.552 12.853 1.00 0.00 C ATOM 825 CD GLN A 53 12.752 -2.956 13.623 1.00 0.00 C ATOM 826 OE1 GLN A 53 13.584 -2.248 13.061 1.00 0.00 O ATOM 827 NE2 GLN A 53 12.826 -3.253 14.909 1.00 0.00 N ATOM 0 H GLN A 53 13.969 -3.404 11.852 1.00 0.00 H new ATOM 0 HA GLN A 53 13.033 -5.941 10.744 1.00 0.00 H new ATOM 0 HB2 GLN A 53 10.962 -5.425 12.037 1.00 0.00 H new ATOM 0 HB3 GLN A 53 12.398 -5.522 13.037 1.00 0.00 H new ATOM 0 HG2 GLN A 53 11.312 -2.876 12.044 1.00 0.00 H new ATOM 0 HG3 GLN A 53 10.726 -3.631 13.513 1.00 0.00 H new ATOM 0 HE21 GLN A 53 12.114 -3.845 15.338 1.00 0.00 H new ATOM 0 HE22 GLN A 53 13.595 -2.890 15.473 1.00 0.00 H new ATOM 836 N ARG A 54 12.717 -3.605 8.953 1.00 0.00 N ATOM 837 CA ARG A 54 12.106 -3.079 7.728 1.00 0.00 C ATOM 838 C ARG A 54 11.377 -4.185 6.968 1.00 0.00 C ATOM 839 O ARG A 54 10.224 -4.028 6.569 1.00 0.00 O ATOM 840 CB ARG A 54 13.161 -2.460 6.806 1.00 0.00 C ATOM 841 CG ARG A 54 13.722 -1.134 7.293 1.00 0.00 C ATOM 842 CD ARG A 54 14.799 -0.608 6.353 1.00 0.00 C ATOM 843 NE ARG A 54 15.928 -1.536 6.246 1.00 0.00 N ATOM 844 CZ ARG A 54 17.013 -1.317 5.499 1.00 0.00 C ATOM 845 NH1 ARG A 54 17.126 -0.207 4.783 1.00 0.00 N ATOM 846 NH2 ARG A 54 17.990 -2.213 5.470 1.00 0.00 N ATOM 0 H ARG A 54 13.707 -3.384 9.060 1.00 0.00 H new ATOM 0 HA ARG A 54 11.394 -2.310 8.027 1.00 0.00 H new ATOM 0 HB2 ARG A 54 13.983 -3.167 6.689 1.00 0.00 H new ATOM 0 HB3 ARG A 54 12.722 -2.314 5.819 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.917 -0.403 7.372 1.00 0.00 H new ATOM 0 HG3 ARG A 54 14.138 -1.258 8.293 1.00 0.00 H new ATOM 0 HD2 ARG A 54 14.370 -0.442 5.365 1.00 0.00 H new ATOM 0 HD3 ARG A 54 15.155 0.358 6.712 1.00 0.00 H new ATOM 0 HE ARG A 54 15.882 -2.406 6.777 1.00 0.00 H new ATOM 0 HH11 ARG A 54 16.380 0.489 4.800 1.00 0.00 H new ATOM 0 HH12 ARG A 54 17.959 -0.049 4.216 1.00 0.00 H new ATOM 0 HH21 ARG A 54 17.913 -3.070 6.018 1.00 0.00 H new ATOM 0 HH22 ARG A 54 18.819 -2.046 4.899 1.00 0.00 H new ATOM 860 N GLN A 55 12.057 -5.310 6.792 1.00 0.00 N ATOM 861 CA GLN A 55 11.507 -6.428 6.038 1.00 0.00 C ATOM 862 C GLN A 55 10.398 -7.124 6.824 1.00 0.00 C ATOM 863 O GLN A 55 9.382 -7.522 6.256 1.00 0.00 O ATOM 864 CB GLN A 55 12.616 -7.421 5.684 1.00 0.00 C ATOM 865 CG GLN A 55 13.719 -6.818 4.827 1.00 0.00 C ATOM 866 CD GLN A 55 14.827 -7.806 4.510 1.00 0.00 C ATOM 867 OE1 GLN A 55 15.808 -7.916 5.248 1.00 0.00 O ATOM 868 NE2 GLN A 55 14.682 -8.528 3.410 1.00 0.00 N ATOM 0 H GLN A 55 12.993 -5.473 7.163 1.00 0.00 H new ATOM 0 HA GLN A 55 11.074 -6.040 5.116 1.00 0.00 H new ATOM 0 HB2 GLN A 55 13.053 -7.809 6.604 1.00 0.00 H new ATOM 0 HB3 GLN A 55 12.179 -8.269 5.156 1.00 0.00 H new ATOM 0 HG2 GLN A 55 13.289 -6.451 3.895 1.00 0.00 H new ATOM 0 HG3 GLN A 55 14.144 -5.957 5.343 1.00 0.00 H new ATOM 0 HE21 GLN A 55 13.855 -8.407 2.826 1.00 0.00 H new ATOM 0 HE22 GLN A 55 15.398 -9.206 3.147 1.00 0.00 H new ATOM 877 N ALA A 56 10.591 -7.253 8.132 1.00 0.00 N ATOM 878 CA ALA A 56 9.606 -7.902 8.997 1.00 0.00 C ATOM 879 C ALA A 56 8.257 -7.187 8.937 1.00 0.00 C ATOM 880 O ALA A 56 7.206 -7.825 8.833 1.00 0.00 O ATOM 881 CB ALA A 56 10.113 -7.956 10.433 1.00 0.00 C ATOM 0 H ALA A 56 11.421 -6.917 8.620 1.00 0.00 H new ATOM 0 HA ALA A 56 9.463 -8.920 8.635 1.00 0.00 H new ATOM 0 HB1 ALA A 56 9.368 -8.442 11.064 1.00 0.00 H new ATOM 0 HB2 ALA A 56 11.044 -8.522 10.469 1.00 0.00 H new ATOM 0 HB3 ALA A 56 10.290 -6.943 10.795 1.00 0.00 H new ATOM 887 N ILE A 57 8.289 -5.861 8.992 1.00 0.00 N ATOM 888 CA ILE A 57 7.066 -5.074 8.936 1.00 0.00 C ATOM 889 C ILE A 57 6.477 -5.094 7.527 1.00 0.00 C ATOM 890 O ILE A 57 5.259 -5.092 7.354 1.00 0.00 O ATOM 891 CB ILE A 57 7.306 -3.621 9.402 1.00 0.00 C ATOM 892 CG1 ILE A 57 7.814 -3.622 10.849 1.00 0.00 C ATOM 893 CG2 ILE A 57 6.031 -2.791 9.282 1.00 0.00 C ATOM 894 CD1 ILE A 57 8.074 -2.243 11.412 1.00 0.00 C ATOM 0 H ILE A 57 9.144 -5.312 9.075 1.00 0.00 H new ATOM 0 HA ILE A 57 6.349 -5.528 9.620 1.00 0.00 H new ATOM 0 HB ILE A 57 8.060 -3.167 8.759 1.00 0.00 H new ATOM 0 HG12 ILE A 57 7.083 -4.128 11.479 1.00 0.00 H new ATOM 0 HG13 ILE A 57 8.735 -4.203 10.899 1.00 0.00 H new ATOM 0 HG21 ILE A 57 6.227 -1.772 9.616 1.00 0.00 H new ATOM 0 HG22 ILE A 57 5.704 -2.775 8.242 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.250 -3.232 9.901 1.00 0.00 H new ATOM 0 HD11 ILE A 57 8.430 -2.330 12.438 1.00 0.00 H new ATOM 0 HD12 ILE A 57 8.828 -1.739 10.807 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.151 -1.664 11.397 1.00 0.00 H new ATOM 906 N ALA A 58 7.344 -5.148 6.521 1.00 0.00 N ATOM 907 CA ALA A 58 6.893 -5.230 5.136 1.00 0.00 C ATOM 908 C ALA A 58 6.126 -6.529 4.891 1.00 0.00 C ATOM 909 O ALA A 58 5.137 -6.550 4.160 1.00 0.00 O ATOM 910 CB ALA A 58 8.074 -5.124 4.181 1.00 0.00 C ATOM 0 H ALA A 58 8.357 -5.137 6.637 1.00 0.00 H new ATOM 0 HA ALA A 58 6.220 -4.394 4.949 1.00 0.00 H new ATOM 0 HB1 ALA A 58 7.717 -5.187 3.153 1.00 0.00 H new ATOM 0 HB2 ALA A 58 8.579 -4.170 4.332 1.00 0.00 H new ATOM 0 HB3 ALA A 58 8.772 -5.939 4.374 1.00 0.00 H new ATOM 916 N ASN A 59 6.585 -7.610 5.513 1.00 0.00 N ATOM 917 CA ASN A 59 5.927 -8.908 5.383 1.00 0.00 C ATOM 918 C ASN A 59 4.595 -8.931 6.122 1.00 0.00 C ATOM 919 O ASN A 59 3.590 -9.405 5.588 1.00 0.00 O ATOM 920 CB ASN A 59 6.824 -10.034 5.904 1.00 0.00 C ATOM 921 CG ASN A 59 7.876 -10.465 4.902 1.00 0.00 C ATOM 922 OD1 ASN A 59 7.640 -11.346 4.078 1.00 0.00 O ATOM 923 ND2 ASN A 59 9.047 -9.856 4.968 1.00 0.00 N ATOM 0 H ASN A 59 7.410 -7.614 6.113 1.00 0.00 H new ATOM 0 HA ASN A 59 5.739 -9.068 4.321 1.00 0.00 H new ATOM 0 HB2 ASN A 59 7.315 -9.705 6.820 1.00 0.00 H new ATOM 0 HB3 ASN A 59 6.205 -10.893 6.165 1.00 0.00 H new ATOM 0 HD21 ASN A 59 9.793 -10.113 4.321 1.00 0.00 H new ATOM 0 HD22 ASN A 59 9.205 -9.129 5.666 1.00 0.00 H new ATOM 930 N SER A 60 4.585 -8.411 7.342 1.00 0.00 N ATOM 931 CA SER A 60 3.369 -8.388 8.141 1.00 0.00 C ATOM 932 C SER A 60 2.315 -7.490 7.498 1.00 0.00 C ATOM 933 O SER A 60 1.139 -7.851 7.432 1.00 0.00 O ATOM 934 CB SER A 60 3.681 -7.940 9.570 1.00 0.00 C ATOM 935 OG SER A 60 4.546 -6.816 9.584 1.00 0.00 O ATOM 0 H SER A 60 5.401 -8.002 7.797 1.00 0.00 H new ATOM 0 HA SER A 60 2.961 -9.398 8.183 1.00 0.00 H new ATOM 0 HB2 SER A 60 2.753 -7.693 10.086 1.00 0.00 H new ATOM 0 HB3 SER A 60 4.142 -8.762 10.118 1.00 0.00 H new ATOM 0 HG SER A 60 4.560 -6.403 8.695 1.00 0.00 H new ATOM 941 N PHE A 61 2.747 -6.334 6.999 1.00 0.00 N ATOM 942 CA PHE A 61 1.859 -5.426 6.282 1.00 0.00 C ATOM 943 C PHE A 61 1.302 -6.106 5.035 1.00 0.00 C ATOM 944 O PHE A 61 0.129 -5.945 4.696 1.00 0.00 O ATOM 945 CB PHE A 61 2.605 -4.141 5.901 1.00 0.00 C ATOM 946 CG PHE A 61 1.784 -3.173 5.093 1.00 0.00 C ATOM 947 CD1 PHE A 61 0.789 -2.418 5.694 1.00 0.00 C ATOM 948 CD2 PHE A 61 2.009 -3.018 3.734 1.00 0.00 C ATOM 949 CE1 PHE A 61 0.032 -1.529 4.955 1.00 0.00 C ATOM 950 CE2 PHE A 61 1.256 -2.130 2.989 1.00 0.00 C ATOM 951 CZ PHE A 61 0.266 -1.385 3.601 1.00 0.00 C ATOM 0 H PHE A 61 3.709 -6.005 7.079 1.00 0.00 H new ATOM 0 HA PHE A 61 1.027 -5.163 6.936 1.00 0.00 H new ATOM 0 HB2 PHE A 61 2.941 -3.645 6.811 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.498 -4.406 5.334 1.00 0.00 H new ATOM 0 HD1 PHE A 61 0.603 -2.526 6.752 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.782 -3.598 3.252 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -0.741 -0.948 5.435 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.441 -2.019 1.931 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.324 -0.691 3.021 1.00 0.00 H new ATOM 961 N ALA A 62 2.153 -6.879 4.369 1.00 0.00 N ATOM 962 CA ALA A 62 1.758 -7.613 3.175 1.00 0.00 C ATOM 963 C ALA A 62 0.592 -8.550 3.466 1.00 0.00 C ATOM 964 O ALA A 62 -0.393 -8.582 2.730 1.00 0.00 O ATOM 965 CB ALA A 62 2.934 -8.403 2.632 1.00 0.00 C ATOM 0 H ALA A 62 3.127 -7.013 4.639 1.00 0.00 H new ATOM 0 HA ALA A 62 1.436 -6.889 2.426 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.626 -8.947 1.739 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.745 -7.720 2.379 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.277 -9.110 3.387 1.00 0.00 H new ATOM 971 N ARG A 63 0.702 -9.307 4.550 1.00 0.00 N ATOM 972 CA ARG A 63 -0.346 -10.243 4.923 1.00 0.00 C ATOM 973 C ARG A 63 -1.561 -9.511 5.477 1.00 0.00 C ATOM 974 O ARG A 63 -2.690 -9.954 5.287 1.00 0.00 O ATOM 975 CB ARG A 63 0.163 -11.283 5.924 1.00 0.00 C ATOM 976 CG ARG A 63 0.811 -12.491 5.263 1.00 0.00 C ATOM 977 CD ARG A 63 2.148 -12.149 4.620 1.00 0.00 C ATOM 978 NE ARG A 63 2.302 -12.774 3.305 1.00 0.00 N ATOM 979 CZ ARG A 63 2.631 -14.053 3.110 1.00 0.00 C ATOM 980 NH1 ARG A 63 2.832 -14.868 4.139 1.00 0.00 N ATOM 981 NH2 ARG A 63 2.763 -14.512 1.875 1.00 0.00 N ATOM 0 H ARG A 63 1.502 -9.290 5.182 1.00 0.00 H new ATOM 0 HA ARG A 63 -0.649 -10.771 4.019 1.00 0.00 H new ATOM 0 HB2 ARG A 63 0.885 -10.812 6.591 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -0.669 -11.619 6.542 1.00 0.00 H new ATOM 0 HG2 ARG A 63 0.958 -13.274 6.007 1.00 0.00 H new ATOM 0 HG3 ARG A 63 0.138 -12.893 4.505 1.00 0.00 H new ATOM 0 HD2 ARG A 63 2.235 -11.067 4.519 1.00 0.00 H new ATOM 0 HD3 ARG A 63 2.958 -12.475 5.273 1.00 0.00 H new ATOM 0 HE ARG A 63 2.147 -12.192 2.481 1.00 0.00 H new ATOM 0 HH11 ARG A 63 2.735 -14.519 5.093 1.00 0.00 H new ATOM 0 HH12 ARG A 63 3.083 -15.843 3.976 1.00 0.00 H new ATOM 0 HH21 ARG A 63 2.614 -13.890 1.081 1.00 0.00 H new ATOM 0 HH22 ARG A 63 3.014 -15.488 1.718 1.00 0.00 H new ATOM 995 N ALA A 64 -1.332 -8.386 6.145 1.00 0.00 N ATOM 996 CA ALA A 64 -2.427 -7.559 6.647 1.00 0.00 C ATOM 997 C ALA A 64 -3.271 -7.041 5.487 1.00 0.00 C ATOM 998 O ALA A 64 -4.501 -7.020 5.559 1.00 0.00 O ATOM 999 CB ALA A 64 -1.885 -6.401 7.475 1.00 0.00 C ATOM 0 H ALA A 64 -0.401 -8.025 6.352 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.060 -8.171 7.290 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -2.714 -5.796 7.841 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.320 -6.792 8.321 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.232 -5.786 6.856 1.00 0.00 H new ATOM 1005 N LEU A 65 -2.597 -6.643 4.415 1.00 0.00 N ATOM 1006 CA LEU A 65 -3.266 -6.187 3.203 1.00 0.00 C ATOM 1007 C LEU A 65 -4.114 -7.311 2.609 1.00 0.00 C ATOM 1008 O LEU A 65 -5.287 -7.122 2.293 1.00 0.00 O ATOM 1009 CB LEU A 65 -2.223 -5.716 2.183 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.787 -5.141 0.882 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -3.545 -3.853 1.150 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -1.669 -4.901 -0.119 1.00 0.00 C ATOM 0 H LEU A 65 -1.579 -6.627 4.361 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.923 -5.354 3.453 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.597 -4.958 2.653 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.575 -6.557 1.937 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.483 -5.866 0.459 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -3.938 -3.460 0.212 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.370 -4.052 1.834 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -2.872 -3.121 1.596 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.086 -4.492 -1.039 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.951 -4.195 0.299 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.166 -5.844 -0.336 1.00 0.00 H new ATOM 1024 N GLN A 66 -3.513 -8.489 2.496 1.00 0.00 N ATOM 1025 CA GLN A 66 -4.187 -9.650 1.924 1.00 0.00 C ATOM 1026 C GLN A 66 -5.310 -10.144 2.837 1.00 0.00 C ATOM 1027 O GLN A 66 -6.255 -10.780 2.380 1.00 0.00 O ATOM 1028 CB GLN A 66 -3.173 -10.765 1.666 1.00 0.00 C ATOM 1029 CG GLN A 66 -2.104 -10.376 0.659 1.00 0.00 C ATOM 1030 CD GLN A 66 -1.001 -11.406 0.533 1.00 0.00 C ATOM 1031 OE1 GLN A 66 -1.225 -12.604 0.707 1.00 0.00 O ATOM 1032 NE2 GLN A 66 0.202 -10.942 0.229 1.00 0.00 N ATOM 0 H GLN A 66 -2.554 -8.667 2.795 1.00 0.00 H new ATOM 0 HA GLN A 66 -4.638 -9.354 0.977 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -2.695 -11.039 2.607 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -3.698 -11.650 1.306 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -2.569 -10.229 -0.316 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -1.669 -9.421 0.952 1.00 0.00 H new ATOM 0 HE21 GLN A 66 0.343 -9.941 0.093 1.00 0.00 H new ATOM 0 HE22 GLN A 66 0.987 -11.586 0.131 1.00 0.00 H new ATOM 1041 N SER A 67 -5.207 -9.842 4.125 1.00 0.00 N ATOM 1042 CA SER A 67 -6.253 -10.196 5.078 1.00 0.00 C ATOM 1043 C SER A 67 -7.434 -9.239 4.955 1.00 0.00 C ATOM 1044 O SER A 67 -8.555 -9.568 5.347 1.00 0.00 O ATOM 1045 CB SER A 67 -5.709 -10.171 6.508 1.00 0.00 C ATOM 1046 OG SER A 67 -4.645 -11.097 6.669 1.00 0.00 O ATOM 0 H SER A 67 -4.411 -9.353 4.534 1.00 0.00 H new ATOM 0 HA SER A 67 -6.593 -11.206 4.850 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.360 -9.167 6.750 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.510 -10.408 7.209 1.00 0.00 H new ATOM 0 HG SER A 67 -3.966 -10.938 5.980 1.00 0.00 H new ATOM 1052 N SER A 68 -7.172 -8.058 4.413 1.00 0.00 N ATOM 1053 CA SER A 68 -8.212 -7.064 4.201 1.00 0.00 C ATOM 1054 C SER A 68 -8.940 -7.335 2.888 1.00 0.00 C ATOM 1055 O SER A 68 -10.112 -6.989 2.724 1.00 0.00 O ATOM 1056 CB SER A 68 -7.602 -5.662 4.196 1.00 0.00 C ATOM 1057 OG SER A 68 -6.887 -5.420 5.396 1.00 0.00 O ATOM 0 H SER A 68 -6.243 -7.765 4.111 1.00 0.00 H new ATOM 0 HA SER A 68 -8.934 -7.127 5.015 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.934 -5.554 3.341 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.390 -4.918 4.081 1.00 0.00 H new ATOM 0 HG SER A 68 -6.076 -5.970 5.410 1.00 0.00 H new ATOM 1063 N ILE A 69 -8.238 -7.962 1.955 1.00 0.00 N ATOM 1064 CA ILE A 69 -8.829 -8.340 0.684 1.00 0.00 C ATOM 1065 C ILE A 69 -9.477 -9.716 0.796 1.00 0.00 C ATOM 1066 O ILE A 69 -8.801 -10.745 0.775 1.00 0.00 O ATOM 1067 CB ILE A 69 -7.787 -8.332 -0.457 1.00 0.00 C ATOM 1068 CG1 ILE A 69 -7.220 -6.920 -0.636 1.00 0.00 C ATOM 1069 CG2 ILE A 69 -8.409 -8.829 -1.756 1.00 0.00 C ATOM 1070 CD1 ILE A 69 -6.188 -6.814 -1.737 1.00 0.00 C ATOM 0 H ILE A 69 -7.256 -8.219 2.057 1.00 0.00 H new ATOM 0 HA ILE A 69 -9.592 -7.600 0.439 1.00 0.00 H new ATOM 0 HB ILE A 69 -6.973 -9.007 -0.193 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -8.039 -6.234 -0.851 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.771 -6.597 0.303 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -7.659 -8.816 -2.547 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -8.774 -9.847 -1.619 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -9.240 -8.180 -2.033 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -5.832 -5.786 -1.805 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.350 -7.474 -1.515 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -6.637 -7.105 -2.686 1.00 0.00 H new ATOM 1082 N ASN A 70 -10.793 -9.718 0.947 1.00 0.00 N ATOM 1083 CA ASN A 70 -11.547 -10.953 1.111 1.00 0.00 C ATOM 1084 C ASN A 70 -11.476 -11.804 -0.155 1.00 0.00 C ATOM 1085 O ASN A 70 -11.525 -11.285 -1.278 1.00 0.00 O ATOM 1086 CB ASN A 70 -13.007 -10.639 1.463 1.00 0.00 C ATOM 1087 CG ASN A 70 -13.817 -11.880 1.793 1.00 0.00 C ATOM 1088 OD1 ASN A 70 -13.281 -12.885 2.258 1.00 0.00 O ATOM 1089 ND2 ASN A 70 -15.121 -11.816 1.564 1.00 0.00 N ATOM 0 H ASN A 70 -11.364 -8.873 0.959 1.00 0.00 H new ATOM 0 HA ASN A 70 -11.103 -11.521 1.928 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -13.032 -9.959 2.314 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -13.473 -10.119 0.626 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -15.716 -12.618 1.774 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -15.530 -10.965 1.177 1.00 0.00 H new ATOM 1096 N GLU A 71 -11.362 -13.114 0.040 1.00 0.00 N ATOM 1097 CA GLU A 71 -11.262 -14.072 -1.060 1.00 0.00 C ATOM 1098 C GLU A 71 -12.545 -14.108 -1.887 1.00 0.00 C ATOM 1099 O GLU A 71 -12.553 -14.614 -3.011 1.00 0.00 O ATOM 1100 CB GLU A 71 -10.979 -15.470 -0.510 1.00 0.00 C ATOM 1101 CG GLU A 71 -11.980 -15.912 0.549 1.00 0.00 C ATOM 1102 CD GLU A 71 -11.884 -17.387 0.864 1.00 0.00 C ATOM 1103 OE1 GLU A 71 -10.992 -17.778 1.642 1.00 0.00 O ATOM 1104 OE2 GLU A 71 -12.713 -18.162 0.338 1.00 0.00 O ATOM 0 H GLU A 71 -11.336 -13.543 0.965 1.00 0.00 H new ATOM 0 HA GLU A 71 -10.444 -13.752 -1.705 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -10.990 -16.186 -1.332 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -9.976 -15.489 -0.083 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.815 -15.339 1.461 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.989 -15.683 0.207 1.00 0.00 H new ATOM 1111 N ASP A 72 -13.618 -13.567 -1.306 1.00 0.00 N ATOM 1112 CA ASP A 72 -14.943 -13.569 -1.921 1.00 0.00 C ATOM 1113 C ASP A 72 -15.484 -14.994 -1.943 1.00 0.00 C ATOM 1114 O ASP A 72 -14.977 -15.859 -1.231 1.00 0.00 O ATOM 1115 CB ASP A 72 -14.893 -12.981 -3.335 1.00 0.00 C ATOM 1116 CG ASP A 72 -16.165 -12.252 -3.707 1.00 0.00 C ATOM 1117 OD1 ASP A 72 -17.126 -12.910 -4.157 1.00 0.00 O ATOM 1118 OD2 ASP A 72 -16.210 -11.011 -3.546 1.00 0.00 O ATOM 0 H ASP A 72 -13.590 -13.114 -0.392 1.00 0.00 H new ATOM 0 HA ASP A 72 -15.611 -12.941 -1.331 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -14.050 -12.294 -3.409 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -14.715 -13.783 -4.052 1.00 0.00 H new ATOM 1123 N LYS A 73 -16.510 -15.248 -2.734 1.00 0.00 N ATOM 1124 CA LYS A 73 -17.084 -16.585 -2.813 1.00 0.00 C ATOM 1125 C LYS A 73 -17.331 -16.979 -4.259 1.00 0.00 C ATOM 1126 O LYS A 73 -18.084 -16.316 -4.973 1.00 0.00 O ATOM 1127 CB LYS A 73 -18.386 -16.665 -2.006 1.00 0.00 C ATOM 1128 CG LYS A 73 -18.189 -16.644 -0.491 1.00 0.00 C ATOM 1129 CD LYS A 73 -18.033 -18.047 0.099 1.00 0.00 C ATOM 1130 CE LYS A 73 -16.708 -18.713 -0.265 1.00 0.00 C ATOM 1131 NZ LYS A 73 -15.533 -17.980 0.285 1.00 0.00 N ATOM 0 H LYS A 73 -16.963 -14.554 -3.328 1.00 0.00 H new ATOM 0 HA LYS A 73 -16.369 -17.286 -2.383 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -19.027 -15.830 -2.289 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -18.914 -17.579 -2.279 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -17.306 -16.052 -0.251 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -19.041 -16.150 -0.024 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -18.116 -17.988 1.184 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -18.854 -18.673 -0.250 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -16.703 -19.736 0.112 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -16.620 -18.772 -1.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -14.687 -18.582 0.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -15.380 -17.109 -0.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -15.710 -17.737 1.281 1.00 0.00 H new ATOM 1145 N ALA A 74 -16.685 -18.062 -4.678 1.00 0.00 N ATOM 1146 CA ALA A 74 -16.813 -18.571 -6.041 1.00 0.00 C ATOM 1147 C ALA A 74 -18.146 -19.284 -6.246 1.00 0.00 C ATOM 1148 O ALA A 74 -18.464 -19.720 -7.351 1.00 0.00 O ATOM 1149 CB ALA A 74 -15.657 -19.508 -6.361 1.00 0.00 C ATOM 0 H ALA A 74 -16.061 -18.610 -4.086 1.00 0.00 H new ATOM 0 HA ALA A 74 -16.782 -17.721 -6.722 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -15.763 -19.882 -7.380 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -14.715 -18.968 -6.268 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -15.665 -20.346 -5.664 1.00 0.00 H new ATOM 1155 N HIS A 75 -18.909 -19.419 -5.175 1.00 0.00 N ATOM 1156 CA HIS A 75 -20.249 -19.978 -5.252 1.00 0.00 C ATOM 1157 C HIS A 75 -21.252 -18.998 -4.677 1.00 0.00 C ATOM 1158 O HIS A 75 -21.154 -18.606 -3.513 1.00 0.00 O ATOM 1159 CB HIS A 75 -20.335 -21.315 -4.514 1.00 0.00 C ATOM 1160 CG HIS A 75 -20.170 -22.501 -5.411 1.00 0.00 C ATOM 1161 ND1 HIS A 75 -21.217 -23.325 -5.760 1.00 0.00 N ATOM 1162 CD2 HIS A 75 -19.077 -23.001 -6.035 1.00 0.00 C ATOM 1163 CE1 HIS A 75 -20.777 -24.280 -6.556 1.00 0.00 C ATOM 1164 NE2 HIS A 75 -19.483 -24.107 -6.738 1.00 0.00 N ATOM 0 H HIS A 75 -18.621 -19.147 -4.235 1.00 0.00 H new ATOM 0 HA HIS A 75 -20.483 -20.158 -6.301 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -19.568 -21.344 -3.740 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -21.299 -21.382 -4.010 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -18.074 -22.604 -5.988 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -21.375 -25.070 -6.986 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -18.881 -24.700 -7.309 1.00 0.00 H new ATOM 1173 N LEU A 76 -22.201 -18.589 -5.503 1.00 0.00 N ATOM 1174 CA LEU A 76 -23.210 -17.628 -5.092 1.00 0.00 C ATOM 1175 C LEU A 76 -24.288 -18.326 -4.267 1.00 0.00 C ATOM 1176 O LEU A 76 -25.289 -18.808 -4.801 1.00 0.00 O ATOM 1177 CB LEU A 76 -23.822 -16.947 -6.324 1.00 0.00 C ATOM 1178 CG LEU A 76 -24.357 -15.522 -6.115 1.00 0.00 C ATOM 1179 CD1 LEU A 76 -24.775 -14.915 -7.445 1.00 0.00 C ATOM 1180 CD2 LEU A 76 -25.529 -15.505 -5.145 1.00 0.00 C ATOM 0 H LEU A 76 -22.293 -18.910 -6.467 1.00 0.00 H new ATOM 0 HA LEU A 76 -22.744 -16.861 -4.473 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -23.067 -16.918 -7.110 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -24.639 -17.570 -6.689 1.00 0.00 H new ATOM 0 HG LEU A 76 -23.553 -14.925 -5.684 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -25.152 -13.905 -7.282 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -23.915 -14.878 -8.114 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -25.558 -15.526 -7.894 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -25.883 -14.482 -5.020 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -26.336 -16.123 -5.539 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -25.209 -15.898 -4.180 1.00 0.00 H new ATOM 1192 N GLU A 77 -24.058 -18.409 -2.968 1.00 0.00 N ATOM 1193 CA GLU A 77 -25.033 -18.989 -2.064 1.00 0.00 C ATOM 1194 C GLU A 77 -25.975 -17.903 -1.571 1.00 0.00 C ATOM 1195 O GLU A 77 -25.726 -17.266 -0.547 1.00 0.00 O ATOM 1196 CB GLU A 77 -24.336 -19.666 -0.883 1.00 0.00 C ATOM 1197 CG GLU A 77 -24.836 -21.075 -0.615 1.00 0.00 C ATOM 1198 CD GLU A 77 -24.569 -22.011 -1.775 1.00 0.00 C ATOM 1199 OE1 GLU A 77 -23.469 -22.595 -1.832 1.00 0.00 O ATOM 1200 OE2 GLU A 77 -25.464 -22.184 -2.632 1.00 0.00 O ATOM 0 H GLU A 77 -23.204 -18.082 -2.517 1.00 0.00 H new ATOM 0 HA GLU A 77 -25.606 -19.747 -2.598 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -23.263 -19.699 -1.074 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -24.482 -19.060 0.011 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -24.354 -21.465 0.282 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -25.907 -21.046 -0.414 1.00 0.00 H new ATOM 1207 N HIS A 78 -27.043 -17.676 -2.322 1.00 0.00 N ATOM 1208 CA HIS A 78 -27.940 -16.562 -2.054 1.00 0.00 C ATOM 1209 C HIS A 78 -28.964 -16.904 -0.976 1.00 0.00 C ATOM 1210 O HIS A 78 -29.324 -16.047 -0.166 1.00 0.00 O ATOM 1211 CB HIS A 78 -28.656 -16.130 -3.337 1.00 0.00 C ATOM 1212 CG HIS A 78 -29.483 -14.893 -3.169 1.00 0.00 C ATOM 1213 ND1 HIS A 78 -30.855 -14.884 -3.271 1.00 0.00 N ATOM 1214 CD2 HIS A 78 -29.122 -13.619 -2.897 1.00 0.00 C ATOM 1215 CE1 HIS A 78 -31.300 -13.659 -3.067 1.00 0.00 C ATOM 1216 NE2 HIS A 78 -30.268 -12.870 -2.834 1.00 0.00 N ATOM 0 H HIS A 78 -27.309 -18.249 -3.122 1.00 0.00 H new ATOM 0 HA HIS A 78 -27.331 -15.736 -1.686 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -27.915 -15.959 -4.118 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -29.297 -16.943 -3.678 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -28.114 -13.257 -2.755 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -32.336 -13.353 -3.087 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -30.315 -11.870 -2.640 1.00 0.00 H new ATOM 1225 N HIS A 79 -29.443 -18.137 -0.969 1.00 0.00 N ATOM 1226 CA HIS A 79 -30.452 -18.539 0.001 1.00 0.00 C ATOM 1227 C HIS A 79 -29.970 -19.717 0.834 1.00 0.00 C ATOM 1228 O HIS A 79 -29.912 -20.851 0.356 1.00 0.00 O ATOM 1229 CB HIS A 79 -31.766 -18.898 -0.699 1.00 0.00 C ATOM 1230 CG HIS A 79 -32.912 -19.091 0.248 1.00 0.00 C ATOM 1231 ND1 HIS A 79 -33.420 -20.328 0.581 1.00 0.00 N ATOM 1232 CD2 HIS A 79 -33.658 -18.190 0.926 1.00 0.00 C ATOM 1233 CE1 HIS A 79 -34.427 -20.175 1.421 1.00 0.00 C ATOM 1234 NE2 HIS A 79 -34.594 -18.888 1.648 1.00 0.00 N ATOM 0 H HIS A 79 -29.154 -18.871 -1.616 1.00 0.00 H new ATOM 0 HA HIS A 79 -30.627 -17.693 0.666 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -32.019 -18.109 -1.408 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -31.624 -19.812 -1.276 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -33.539 -17.117 0.904 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -35.016 -20.972 1.851 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -35.301 -18.478 2.259 1.00 0.00 H new ATOM 1243 N HIS A 80 -29.629 -19.437 2.080 1.00 0.00 N ATOM 1244 CA HIS A 80 -29.217 -20.473 3.012 1.00 0.00 C ATOM 1245 C HIS A 80 -30.413 -21.350 3.369 1.00 0.00 C ATOM 1246 O HIS A 80 -31.488 -20.844 3.684 1.00 0.00 O ATOM 1247 CB HIS A 80 -28.615 -19.839 4.275 1.00 0.00 C ATOM 1248 CG HIS A 80 -28.223 -20.826 5.338 1.00 0.00 C ATOM 1249 ND1 HIS A 80 -28.681 -20.754 6.636 1.00 0.00 N ATOM 1250 CD2 HIS A 80 -27.402 -21.903 5.292 1.00 0.00 C ATOM 1251 CE1 HIS A 80 -28.159 -21.742 7.340 1.00 0.00 C ATOM 1252 NE2 HIS A 80 -27.384 -22.453 6.549 1.00 0.00 N ATOM 0 H HIS A 80 -29.629 -18.495 2.472 1.00 0.00 H new ATOM 0 HA HIS A 80 -28.454 -21.095 2.544 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -27.736 -19.259 3.992 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -29.337 -19.139 4.695 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -26.863 -22.261 4.428 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -28.338 -21.934 8.388 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -26.855 -23.280 6.826 1.00 0.00 H new ATOM 1261 N HIS A 81 -30.228 -22.660 3.300 1.00 0.00 N ATOM 1262 CA HIS A 81 -31.305 -23.598 3.600 1.00 0.00 C ATOM 1263 C HIS A 81 -31.709 -23.506 5.067 1.00 0.00 C ATOM 1264 O HIS A 81 -30.916 -23.800 5.965 1.00 0.00 O ATOM 1265 CB HIS A 81 -30.898 -25.032 3.249 1.00 0.00 C ATOM 1266 CG HIS A 81 -30.712 -25.255 1.778 1.00 0.00 C ATOM 1267 ND1 HIS A 81 -31.684 -25.804 0.969 1.00 0.00 N ATOM 1268 CD2 HIS A 81 -29.658 -24.999 0.969 1.00 0.00 C ATOM 1269 CE1 HIS A 81 -31.235 -25.873 -0.271 1.00 0.00 C ATOM 1270 NE2 HIS A 81 -30.011 -25.390 -0.297 1.00 0.00 N ATOM 0 H HIS A 81 -29.345 -23.099 3.040 1.00 0.00 H new ATOM 0 HA HIS A 81 -32.164 -23.327 2.986 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -29.970 -25.275 3.766 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -31.659 -25.719 3.620 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -28.714 -24.567 1.265 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -31.780 -26.260 -1.120 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -29.420 -25.318 -1.125 1.00 0.00 H new ATOM 1279 N HIS A 82 -32.942 -23.083 5.297 1.00 0.00 N ATOM 1280 CA HIS A 82 -33.456 -22.895 6.645 1.00 0.00 C ATOM 1281 C HIS A 82 -34.010 -24.201 7.199 1.00 0.00 C ATOM 1282 O HIS A 82 -35.080 -24.652 6.793 1.00 0.00 O ATOM 1283 CB HIS A 82 -34.545 -21.812 6.646 1.00 0.00 C ATOM 1284 CG HIS A 82 -35.137 -21.524 7.996 1.00 0.00 C ATOM 1285 ND1 HIS A 82 -34.711 -20.489 8.797 1.00 0.00 N ATOM 1286 CD2 HIS A 82 -36.140 -22.132 8.676 1.00 0.00 C ATOM 1287 CE1 HIS A 82 -35.422 -20.473 9.909 1.00 0.00 C ATOM 1288 NE2 HIS A 82 -36.295 -21.457 9.861 1.00 0.00 N ATOM 0 H HIS A 82 -33.611 -22.861 4.560 1.00 0.00 H new ATOM 0 HA HIS A 82 -32.635 -22.574 7.286 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -34.123 -20.891 6.244 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -35.344 -22.118 5.971 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -36.711 -22.988 8.347 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -35.307 -19.771 10.721 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -36.976 -21.681 10.586 1.00 0.00 H new ATOM 1297 N HIS A 83 -33.268 -24.810 8.108 1.00 0.00 N ATOM 1298 CA HIS A 83 -33.726 -26.007 8.794 1.00 0.00 C ATOM 1299 C HIS A 83 -32.985 -26.144 10.114 1.00 0.00 C ATOM 1300 O HIS A 83 -32.115 -27.031 10.227 1.00 0.00 O ATOM 1301 CB HIS A 83 -33.504 -27.259 7.936 1.00 0.00 C ATOM 1302 CG HIS A 83 -34.295 -28.445 8.399 1.00 0.00 C ATOM 1303 ND1 HIS A 83 -33.936 -29.225 9.477 1.00 0.00 N ATOM 1304 CD2 HIS A 83 -35.446 -28.976 7.924 1.00 0.00 C ATOM 1305 CE1 HIS A 83 -34.833 -30.179 9.646 1.00 0.00 C ATOM 1306 NE2 HIS A 83 -35.762 -30.052 8.716 1.00 0.00 N ATOM 1307 OXT HIS A 83 -33.245 -25.331 11.020 1.00 0.00 O ATOM 0 H HIS A 83 -32.340 -24.493 8.390 1.00 0.00 H new ATOM 0 HA HIS A 83 -34.796 -25.913 8.978 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -33.770 -27.035 6.903 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -32.444 -27.513 7.944 1.00 0.00 H new ATOM 0 HD1 HIS A 83 -33.107 -29.087 10.054 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -36.012 -28.619 7.077 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -34.811 -30.936 10.416 1.00 0.00 H new TER 1316 HIS A 83 ATOM 1317 N MET B 1 19.163 -2.041 -19.414 1.00 0.00 N ATOM 1318 CA MET B 1 18.541 -1.077 -18.480 1.00 0.00 C ATOM 1319 C MET B 1 17.053 -0.926 -18.778 1.00 0.00 C ATOM 1320 O MET B 1 16.673 -0.374 -19.810 1.00 0.00 O ATOM 1321 CB MET B 1 19.237 0.285 -18.586 1.00 0.00 C ATOM 1322 CG MET B 1 18.658 1.343 -17.662 1.00 0.00 C ATOM 1323 SD MET B 1 19.515 2.926 -17.796 1.00 0.00 S ATOM 1324 CE MET B 1 21.157 2.477 -17.234 1.00 0.00 C ATOM 0 H1 MET B 1 20.176 -2.131 -19.196 1.00 0.00 H new ATOM 0 H2 MET B 1 18.703 -2.968 -19.313 1.00 0.00 H new ATOM 0 H3 MET B 1 19.048 -1.702 -20.390 1.00 0.00 H new ATOM 0 HA MET B 1 18.656 -1.457 -17.465 1.00 0.00 H new ATOM 0 HB2 MET B 1 20.296 0.160 -18.361 1.00 0.00 H new ATOM 0 HB3 MET B 1 19.169 0.638 -19.615 1.00 0.00 H new ATOM 0 HG2 MET B 1 17.603 1.485 -17.894 1.00 0.00 H new ATOM 0 HG3 MET B 1 18.713 0.990 -16.632 1.00 0.00 H new ATOM 0 HE1 MET B 1 21.693 3.374 -16.922 1.00 0.00 H new ATOM 0 HE2 MET B 1 21.078 1.790 -16.392 1.00 0.00 H new ATOM 0 HE3 MET B 1 21.700 1.994 -18.046 1.00 0.00 H new ATOM 1336 N PRO B 2 16.190 -1.442 -17.886 1.00 0.00 N ATOM 1337 CA PRO B 2 14.738 -1.290 -18.011 1.00 0.00 C ATOM 1338 C PRO B 2 14.323 0.170 -17.872 1.00 0.00 C ATOM 1339 O PRO B 2 14.594 0.805 -16.855 1.00 0.00 O ATOM 1340 CB PRO B 2 14.176 -2.126 -16.850 1.00 0.00 C ATOM 1341 CG PRO B 2 15.305 -2.995 -16.408 1.00 0.00 C ATOM 1342 CD PRO B 2 16.556 -2.218 -16.691 1.00 0.00 C ATOM 0 HA PRO B 2 14.369 -1.614 -18.984 1.00 0.00 H new ATOM 0 HB2 PRO B 2 13.830 -1.488 -16.037 1.00 0.00 H new ATOM 0 HB3 PRO B 2 13.323 -2.723 -17.172 1.00 0.00 H new ATOM 0 HG2 PRO B 2 15.224 -3.232 -15.347 1.00 0.00 H new ATOM 0 HG3 PRO B 2 15.303 -3.942 -16.947 1.00 0.00 H new ATOM 0 HD2 PRO B 2 16.829 -1.572 -15.857 1.00 0.00 H new ATOM 0 HD3 PRO B 2 17.406 -2.874 -16.878 1.00 0.00 H new ATOM 1350 N GLN B 3 13.678 0.698 -18.900 1.00 0.00 N ATOM 1351 CA GLN B 3 13.327 2.109 -18.938 1.00 0.00 C ATOM 1352 C GLN B 3 11.836 2.283 -19.228 1.00 0.00 C ATOM 1353 O GLN B 3 11.337 3.404 -19.336 1.00 0.00 O ATOM 1354 CB GLN B 3 14.175 2.810 -20.010 1.00 0.00 C ATOM 1355 CG GLN B 3 14.153 4.333 -19.948 1.00 0.00 C ATOM 1356 CD GLN B 3 14.804 4.888 -18.693 1.00 0.00 C ATOM 1357 OE1 GLN B 3 14.757 4.282 -17.624 1.00 0.00 O ATOM 1358 NE2 GLN B 3 15.424 6.049 -18.814 1.00 0.00 N ATOM 0 H GLN B 3 13.386 0.169 -19.722 1.00 0.00 H new ATOM 0 HA GLN B 3 13.532 2.560 -17.967 1.00 0.00 H new ATOM 0 HB2 GLN B 3 15.207 2.471 -19.916 1.00 0.00 H new ATOM 0 HB3 GLN B 3 13.825 2.495 -20.993 1.00 0.00 H new ATOM 0 HG2 GLN B 3 14.665 4.734 -20.823 1.00 0.00 H new ATOM 0 HG3 GLN B 3 13.120 4.678 -19.997 1.00 0.00 H new ATOM 0 HE21 GLN B 3 15.444 6.525 -19.716 1.00 0.00 H new ATOM 0 HE22 GLN B 3 15.883 6.469 -18.005 1.00 0.00 H new ATOM 1367 N ILE B 4 11.128 1.163 -19.335 1.00 0.00 N ATOM 1368 CA ILE B 4 9.704 1.180 -19.649 1.00 0.00 C ATOM 1369 C ILE B 4 8.904 1.955 -18.598 1.00 0.00 C ATOM 1370 O ILE B 4 8.775 1.536 -17.446 1.00 0.00 O ATOM 1371 CB ILE B 4 9.133 -0.252 -19.812 1.00 0.00 C ATOM 1372 CG1 ILE B 4 7.610 -0.201 -19.998 1.00 0.00 C ATOM 1373 CG2 ILE B 4 9.513 -1.134 -18.628 1.00 0.00 C ATOM 1374 CD1 ILE B 4 6.972 -1.559 -20.190 1.00 0.00 C ATOM 0 H ILE B 4 11.519 0.229 -19.208 1.00 0.00 H new ATOM 0 HA ILE B 4 9.601 1.695 -20.604 1.00 0.00 H new ATOM 0 HB ILE B 4 9.573 -0.696 -20.705 1.00 0.00 H new ATOM 0 HG12 ILE B 4 7.163 0.280 -19.128 1.00 0.00 H new ATOM 0 HG13 ILE B 4 7.380 0.424 -20.861 1.00 0.00 H new ATOM 0 HG21 ILE B 4 9.099 -2.132 -18.770 1.00 0.00 H new ATOM 0 HG22 ILE B 4 10.599 -1.199 -18.556 1.00 0.00 H new ATOM 0 HG23 ILE B 4 9.114 -0.703 -17.710 1.00 0.00 H new ATOM 0 HD11 ILE B 4 5.896 -1.441 -20.315 1.00 0.00 H new ATOM 0 HD12 ILE B 4 7.390 -2.035 -21.077 1.00 0.00 H new ATOM 0 HD13 ILE B 4 7.170 -2.181 -19.317 1.00 0.00 H new ATOM 1386 N SER B 5 8.391 3.105 -19.008 1.00 0.00 N ATOM 1387 CA SER B 5 7.592 3.948 -18.140 1.00 0.00 C ATOM 1388 C SER B 5 6.799 4.956 -18.966 1.00 0.00 C ATOM 1389 O SER B 5 7.366 5.878 -19.549 1.00 0.00 O ATOM 1390 CB SER B 5 8.490 4.659 -17.120 1.00 0.00 C ATOM 1391 OG SER B 5 9.705 5.095 -17.717 1.00 0.00 O ATOM 0 H SER B 5 8.518 3.477 -19.949 1.00 0.00 H new ATOM 0 HA SER B 5 6.884 3.324 -17.594 1.00 0.00 H new ATOM 0 HB2 SER B 5 7.961 5.515 -16.700 1.00 0.00 H new ATOM 0 HB3 SER B 5 8.710 3.984 -16.293 1.00 0.00 H new ATOM 0 HG SER B 5 10.174 4.326 -18.104 1.00 0.00 H new ATOM 1397 N ARG B 6 5.485 4.754 -19.036 1.00 0.00 N ATOM 1398 CA ARG B 6 4.617 5.636 -19.810 1.00 0.00 C ATOM 1399 C ARG B 6 4.392 6.946 -19.070 1.00 0.00 C ATOM 1400 O ARG B 6 4.085 7.973 -19.675 1.00 0.00 O ATOM 1401 CB ARG B 6 3.261 4.976 -20.072 1.00 0.00 C ATOM 1402 CG ARG B 6 3.344 3.619 -20.753 1.00 0.00 C ATOM 1403 CD ARG B 6 1.957 3.064 -21.036 1.00 0.00 C ATOM 1404 NE ARG B 6 1.997 1.682 -21.513 1.00 0.00 N ATOM 1405 CZ ARG B 6 0.973 1.073 -22.110 1.00 0.00 C ATOM 1406 NH1 ARG B 6 -0.150 1.738 -22.351 1.00 0.00 N ATOM 1407 NH2 ARG B 6 1.084 -0.196 -22.472 1.00 0.00 N ATOM 0 H ARG B 6 5.000 3.989 -18.567 1.00 0.00 H new ATOM 0 HA ARG B 6 5.111 5.832 -20.762 1.00 0.00 H new ATOM 0 HB2 ARG B 6 2.737 4.861 -19.123 1.00 0.00 H new ATOM 0 HB3 ARG B 6 2.659 5.643 -20.690 1.00 0.00 H new ATOM 0 HG2 ARG B 6 3.900 3.710 -21.686 1.00 0.00 H new ATOM 0 HG3 ARG B 6 3.895 2.924 -20.120 1.00 0.00 H new ATOM 0 HD2 ARG B 6 1.356 3.115 -20.128 1.00 0.00 H new ATOM 0 HD3 ARG B 6 1.464 3.689 -21.781 1.00 0.00 H new ATOM 0 HE ARG B 6 2.859 1.153 -21.381 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -0.231 2.718 -22.079 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -0.932 1.269 -22.808 1.00 0.00 H new ATOM 0 HH21 ARG B 6 1.951 -0.703 -22.294 1.00 0.00 H new ATOM 0 HH22 ARG B 6 0.303 -0.666 -22.929 1.00 0.00 H new ATOM 1421 N TYR B 7 4.545 6.898 -17.756 1.00 0.00 N ATOM 1422 CA TYR B 7 4.278 8.049 -16.914 1.00 0.00 C ATOM 1423 C TYR B 7 5.563 8.816 -16.638 1.00 0.00 C ATOM 1424 O TYR B 7 6.506 8.285 -16.044 1.00 0.00 O ATOM 1425 CB TYR B 7 3.614 7.601 -15.612 1.00 0.00 C ATOM 1426 CG TYR B 7 2.359 6.791 -15.848 1.00 0.00 C ATOM 1427 CD1 TYR B 7 1.178 7.406 -16.244 1.00 0.00 C ATOM 1428 CD2 TYR B 7 2.361 5.410 -15.696 1.00 0.00 C ATOM 1429 CE1 TYR B 7 0.035 6.669 -16.480 1.00 0.00 C ATOM 1430 CE2 TYR B 7 1.221 4.667 -15.935 1.00 0.00 C ATOM 1431 CZ TYR B 7 0.062 5.302 -16.325 1.00 0.00 C ATOM 1432 OH TYR B 7 -1.075 4.565 -16.570 1.00 0.00 O ATOM 0 H TYR B 7 4.854 6.069 -17.249 1.00 0.00 H new ATOM 0 HA TYR B 7 3.594 8.719 -17.435 1.00 0.00 H new ATOM 0 HB2 TYR B 7 4.322 7.007 -15.033 1.00 0.00 H new ATOM 0 HB3 TYR B 7 3.369 8.478 -15.013 1.00 0.00 H new ATOM 0 HD1 TYR B 7 1.154 8.478 -16.369 1.00 0.00 H new ATOM 0 HD2 TYR B 7 3.267 4.910 -15.387 1.00 0.00 H new ATOM 0 HE1 TYR B 7 -0.876 7.163 -16.785 1.00 0.00 H new ATOM 0 HE2 TYR B 7 1.238 3.594 -15.817 1.00 0.00 H new ATOM 0 HH TYR B 7 -0.859 3.820 -17.169 1.00 0.00 H new ATOM 1442 N SER B 8 5.590 10.059 -17.093 1.00 0.00 N ATOM 1443 CA SER B 8 6.762 10.908 -16.975 1.00 0.00 C ATOM 1444 C SER B 8 7.029 11.298 -15.522 1.00 0.00 C ATOM 1445 O SER B 8 6.107 11.353 -14.702 1.00 0.00 O ATOM 1446 CB SER B 8 6.568 12.157 -17.832 1.00 0.00 C ATOM 1447 OG SER B 8 6.252 11.806 -19.170 1.00 0.00 O ATOM 0 H SER B 8 4.798 10.507 -17.555 1.00 0.00 H new ATOM 0 HA SER B 8 7.630 10.350 -17.327 1.00 0.00 H new ATOM 0 HB2 SER B 8 5.770 12.770 -17.414 1.00 0.00 H new ATOM 0 HB3 SER B 8 7.476 12.760 -17.814 1.00 0.00 H new ATOM 0 HG SER B 8 6.130 12.620 -19.702 1.00 0.00 H new ATOM 1453 N ASP B 9 8.295 11.584 -15.222 1.00 0.00 N ATOM 1454 CA ASP B 9 8.727 11.910 -13.860 1.00 0.00 C ATOM 1455 C ASP B 9 7.962 13.099 -13.281 1.00 0.00 C ATOM 1456 O ASP B 9 7.570 13.069 -12.116 1.00 0.00 O ATOM 1457 CB ASP B 9 10.240 12.179 -13.816 1.00 0.00 C ATOM 1458 CG ASP B 9 10.694 13.274 -14.767 1.00 0.00 C ATOM 1459 OD1 ASP B 9 10.705 14.453 -14.366 1.00 0.00 O ATOM 1460 OD2 ASP B 9 11.055 12.953 -15.921 1.00 0.00 O ATOM 0 H ASP B 9 9.048 11.597 -15.910 1.00 0.00 H new ATOM 0 HA ASP B 9 8.503 11.042 -13.240 1.00 0.00 H new ATOM 0 HB2 ASP B 9 10.522 12.453 -12.799 1.00 0.00 H new ATOM 0 HB3 ASP B 9 10.771 11.258 -14.057 1.00 0.00 H new ATOM 1465 N GLU B 10 7.732 14.126 -14.097 1.00 0.00 N ATOM 1466 CA GLU B 10 7.022 15.326 -13.649 1.00 0.00 C ATOM 1467 C GLU B 10 5.649 14.974 -13.085 1.00 0.00 C ATOM 1468 O GLU B 10 5.227 15.511 -12.062 1.00 0.00 O ATOM 1469 CB GLU B 10 6.850 16.313 -14.805 1.00 0.00 C ATOM 1470 CG GLU B 10 8.152 16.770 -15.435 1.00 0.00 C ATOM 1471 CD GLU B 10 7.923 17.790 -16.532 1.00 0.00 C ATOM 1472 OE1 GLU B 10 7.729 17.384 -17.696 1.00 0.00 O ATOM 1473 OE2 GLU B 10 7.919 19.002 -16.234 1.00 0.00 O ATOM 0 H GLU B 10 8.027 14.153 -15.073 1.00 0.00 H new ATOM 0 HA GLU B 10 7.621 15.786 -12.863 1.00 0.00 H new ATOM 0 HB2 GLU B 10 6.231 15.850 -15.574 1.00 0.00 H new ATOM 0 HB3 GLU B 10 6.308 17.187 -14.443 1.00 0.00 H new ATOM 0 HG2 GLU B 10 8.795 17.201 -14.667 1.00 0.00 H new ATOM 0 HG3 GLU B 10 8.679 15.908 -15.845 1.00 0.00 H new ATOM 1480 N GLN B 11 4.970 14.058 -13.759 1.00 0.00 N ATOM 1481 CA GLN B 11 3.619 13.666 -13.388 1.00 0.00 C ATOM 1482 C GLN B 11 3.620 12.917 -12.057 1.00 0.00 C ATOM 1483 O GLN B 11 2.814 13.204 -11.168 1.00 0.00 O ATOM 1484 CB GLN B 11 3.029 12.792 -14.494 1.00 0.00 C ATOM 1485 CG GLN B 11 1.548 12.496 -14.337 1.00 0.00 C ATOM 1486 CD GLN B 11 1.026 11.631 -15.460 1.00 0.00 C ATOM 1487 OE1 GLN B 11 1.011 10.406 -15.361 1.00 0.00 O ATOM 1488 NE2 GLN B 11 0.618 12.259 -16.550 1.00 0.00 N ATOM 0 H GLN B 11 5.338 13.568 -14.574 1.00 0.00 H new ATOM 0 HA GLN B 11 3.007 14.560 -13.267 1.00 0.00 H new ATOM 0 HB2 GLN B 11 3.189 13.284 -15.453 1.00 0.00 H new ATOM 0 HB3 GLN B 11 3.574 11.849 -14.525 1.00 0.00 H new ATOM 0 HG2 GLN B 11 1.376 11.996 -13.384 1.00 0.00 H new ATOM 0 HG3 GLN B 11 0.991 13.433 -14.311 1.00 0.00 H new ATOM 0 HE21 GLN B 11 0.646 13.278 -16.592 1.00 0.00 H new ATOM 0 HE22 GLN B 11 0.275 11.725 -17.348 1.00 0.00 H new ATOM 1497 N VAL B 12 4.540 11.969 -11.926 1.00 0.00 N ATOM 1498 CA VAL B 12 4.658 11.172 -10.712 1.00 0.00 C ATOM 1499 C VAL B 12 5.055 12.050 -9.529 1.00 0.00 C ATOM 1500 O VAL B 12 4.434 11.995 -8.466 1.00 0.00 O ATOM 1501 CB VAL B 12 5.698 10.040 -10.886 1.00 0.00 C ATOM 1502 CG1 VAL B 12 5.784 9.176 -9.635 1.00 0.00 C ATOM 1503 CG2 VAL B 12 5.365 9.189 -12.102 1.00 0.00 C ATOM 0 H VAL B 12 5.218 11.733 -12.650 1.00 0.00 H new ATOM 0 HA VAL B 12 3.683 10.725 -10.517 1.00 0.00 H new ATOM 0 HB VAL B 12 6.673 10.501 -11.043 1.00 0.00 H new ATOM 0 HG11 VAL B 12 6.523 8.389 -9.786 1.00 0.00 H new ATOM 0 HG12 VAL B 12 6.080 9.793 -8.786 1.00 0.00 H new ATOM 0 HG13 VAL B 12 4.811 8.727 -9.435 1.00 0.00 H new ATOM 0 HG21 VAL B 12 6.108 8.398 -12.207 1.00 0.00 H new ATOM 0 HG22 VAL B 12 4.378 8.745 -11.976 1.00 0.00 H new ATOM 0 HG23 VAL B 12 5.370 9.813 -12.995 1.00 0.00 H new ATOM 1513 N GLU B 13 6.078 12.873 -9.731 1.00 0.00 N ATOM 1514 CA GLU B 13 6.588 13.743 -8.678 1.00 0.00 C ATOM 1515 C GLU B 13 5.525 14.723 -8.201 1.00 0.00 C ATOM 1516 O GLU B 13 5.378 14.938 -7.001 1.00 0.00 O ATOM 1517 CB GLU B 13 7.813 14.514 -9.160 1.00 0.00 C ATOM 1518 CG GLU B 13 9.040 13.646 -9.378 1.00 0.00 C ATOM 1519 CD GLU B 13 10.249 14.450 -9.803 1.00 0.00 C ATOM 1520 OE1 GLU B 13 10.232 15.689 -9.645 1.00 0.00 O ATOM 1521 OE2 GLU B 13 11.232 13.849 -10.284 1.00 0.00 O ATOM 0 H GLU B 13 6.573 12.956 -10.619 1.00 0.00 H new ATOM 0 HA GLU B 13 6.871 13.105 -7.841 1.00 0.00 H new ATOM 0 HB2 GLU B 13 7.567 15.020 -10.094 1.00 0.00 H new ATOM 0 HB3 GLU B 13 8.053 15.288 -8.431 1.00 0.00 H new ATOM 0 HG2 GLU B 13 9.270 13.109 -8.458 1.00 0.00 H new ATOM 0 HG3 GLU B 13 8.821 12.896 -10.138 1.00 0.00 H new ATOM 1528 N GLN B 14 4.790 15.313 -9.139 1.00 0.00 N ATOM 1529 CA GLN B 14 3.750 16.281 -8.800 1.00 0.00 C ATOM 1530 C GLN B 14 2.726 15.668 -7.851 1.00 0.00 C ATOM 1531 O GLN B 14 2.433 16.226 -6.792 1.00 0.00 O ATOM 1532 CB GLN B 14 3.048 16.782 -10.066 1.00 0.00 C ATOM 1533 CG GLN B 14 1.955 17.805 -9.795 1.00 0.00 C ATOM 1534 CD GLN B 14 2.494 19.102 -9.223 1.00 0.00 C ATOM 1535 OE1 GLN B 14 2.628 19.257 -8.010 1.00 0.00 O ATOM 1536 NE2 GLN B 14 2.797 20.048 -10.095 1.00 0.00 N ATOM 0 H GLN B 14 4.894 15.139 -10.139 1.00 0.00 H new ATOM 0 HA GLN B 14 4.228 17.124 -8.301 1.00 0.00 H new ATOM 0 HB2 GLN B 14 3.790 17.224 -10.732 1.00 0.00 H new ATOM 0 HB3 GLN B 14 2.615 15.931 -10.592 1.00 0.00 H new ATOM 0 HG2 GLN B 14 1.423 18.016 -10.722 1.00 0.00 H new ATOM 0 HG3 GLN B 14 1.230 17.380 -9.101 1.00 0.00 H new ATOM 0 HE21 GLN B 14 2.672 19.881 -11.093 1.00 0.00 H new ATOM 0 HE22 GLN B 14 3.156 20.945 -9.770 1.00 0.00 H new ATOM 1545 N LEU B 15 2.201 14.509 -8.232 1.00 0.00 N ATOM 1546 CA LEU B 15 1.189 13.829 -7.435 1.00 0.00 C ATOM 1547 C LEU B 15 1.769 13.430 -6.080 1.00 0.00 C ATOM 1548 O LEU B 15 1.172 13.694 -5.036 1.00 0.00 O ATOM 1549 CB LEU B 15 0.676 12.591 -8.180 1.00 0.00 C ATOM 1550 CG LEU B 15 -0.842 12.373 -8.136 1.00 0.00 C ATOM 1551 CD1 LEU B 15 -1.224 11.152 -8.954 1.00 0.00 C ATOM 1552 CD2 LEU B 15 -1.335 12.226 -6.706 1.00 0.00 C ATOM 0 H LEU B 15 2.460 14.021 -9.089 1.00 0.00 H new ATOM 0 HA LEU B 15 0.353 14.509 -7.270 1.00 0.00 H new ATOM 0 HB2 LEU B 15 0.985 12.663 -9.223 1.00 0.00 H new ATOM 0 HB3 LEU B 15 1.164 11.710 -7.763 1.00 0.00 H new ATOM 0 HG LEU B 15 -1.321 13.252 -8.569 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -2.304 11.010 -8.913 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -0.916 11.297 -9.989 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -0.727 10.271 -8.547 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -2.414 12.073 -6.707 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -0.847 11.370 -6.239 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -1.097 13.130 -6.145 1.00 0.00 H new ATOM 1564 N LEU B 16 2.952 12.827 -6.111 1.00 0.00 N ATOM 1565 CA LEU B 16 3.617 12.360 -4.900 1.00 0.00 C ATOM 1566 C LEU B 16 3.893 13.516 -3.941 1.00 0.00 C ATOM 1567 O LEU B 16 3.682 13.394 -2.733 1.00 0.00 O ATOM 1568 CB LEU B 16 4.929 11.658 -5.259 1.00 0.00 C ATOM 1569 CG LEU B 16 5.718 11.099 -4.074 1.00 0.00 C ATOM 1570 CD1 LEU B 16 4.912 10.032 -3.351 1.00 0.00 C ATOM 1571 CD2 LEU B 16 7.052 10.536 -4.537 1.00 0.00 C ATOM 0 H LEU B 16 3.474 12.649 -6.969 1.00 0.00 H new ATOM 0 HA LEU B 16 2.953 11.654 -4.401 1.00 0.00 H new ATOM 0 HB2 LEU B 16 4.708 10.840 -5.945 1.00 0.00 H new ATOM 0 HB3 LEU B 16 5.563 12.363 -5.797 1.00 0.00 H new ATOM 0 HG LEU B 16 5.912 11.914 -3.377 1.00 0.00 H new ATOM 0 HD11 LEU B 16 5.490 9.646 -2.511 1.00 0.00 H new ATOM 0 HD12 LEU B 16 3.982 10.465 -2.983 1.00 0.00 H new ATOM 0 HD13 LEU B 16 4.685 9.218 -4.040 1.00 0.00 H new ATOM 0 HD21 LEU B 16 7.598 10.143 -3.680 1.00 0.00 H new ATOM 0 HD22 LEU B 16 6.879 9.735 -5.255 1.00 0.00 H new ATOM 0 HD23 LEU B 16 7.636 11.326 -5.009 1.00 0.00 H new ATOM 1583 N ALA B 17 4.352 14.635 -4.490 1.00 0.00 N ATOM 1584 CA ALA B 17 4.688 15.807 -3.692 1.00 0.00 C ATOM 1585 C ALA B 17 3.484 16.297 -2.899 1.00 0.00 C ATOM 1586 O ALA B 17 3.599 16.606 -1.711 1.00 0.00 O ATOM 1587 CB ALA B 17 5.222 16.924 -4.577 1.00 0.00 C ATOM 0 H ALA B 17 4.501 14.755 -5.492 1.00 0.00 H new ATOM 0 HA ALA B 17 5.466 15.515 -2.986 1.00 0.00 H new ATOM 0 HB1 ALA B 17 5.467 17.790 -3.962 1.00 0.00 H new ATOM 0 HB2 ALA B 17 6.118 16.581 -5.094 1.00 0.00 H new ATOM 0 HB3 ALA B 17 4.464 17.202 -5.309 1.00 0.00 H new ATOM 1593 N GLU B 18 2.328 16.352 -3.551 1.00 0.00 N ATOM 1594 CA GLU B 18 1.116 16.819 -2.896 1.00 0.00 C ATOM 1595 C GLU B 18 0.636 15.806 -1.860 1.00 0.00 C ATOM 1596 O GLU B 18 0.158 16.188 -0.793 1.00 0.00 O ATOM 1597 CB GLU B 18 0.016 17.108 -3.918 1.00 0.00 C ATOM 1598 CG GLU B 18 0.423 18.134 -4.966 1.00 0.00 C ATOM 1599 CD GLU B 18 -0.748 18.654 -5.774 1.00 0.00 C ATOM 1600 OE1 GLU B 18 -1.445 17.844 -6.412 1.00 0.00 O ATOM 1601 OE2 GLU B 18 -0.963 19.887 -5.785 1.00 0.00 O ATOM 0 H GLU B 18 2.207 16.080 -4.527 1.00 0.00 H new ATOM 0 HA GLU B 18 1.351 17.750 -2.381 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -0.260 16.179 -4.417 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -0.871 17.465 -3.395 1.00 0.00 H new ATOM 0 HG2 GLU B 18 0.917 18.971 -4.473 1.00 0.00 H new ATOM 0 HG3 GLU B 18 1.152 17.686 -5.641 1.00 0.00 H new ATOM 1608 N LEU B 19 0.789 14.519 -2.166 1.00 0.00 N ATOM 1609 CA LEU B 19 0.418 13.460 -1.227 1.00 0.00 C ATOM 1610 C LEU B 19 1.250 13.559 0.048 1.00 0.00 C ATOM 1611 O LEU B 19 0.715 13.552 1.161 1.00 0.00 O ATOM 1612 CB LEU B 19 0.612 12.076 -1.859 1.00 0.00 C ATOM 1613 CG LEU B 19 -0.240 11.791 -3.096 1.00 0.00 C ATOM 1614 CD1 LEU B 19 0.085 10.417 -3.660 1.00 0.00 C ATOM 1615 CD2 LEU B 19 -1.721 11.897 -2.768 1.00 0.00 C ATOM 0 H LEU B 19 1.166 14.184 -3.053 1.00 0.00 H new ATOM 0 HA LEU B 19 -0.635 13.589 -0.979 1.00 0.00 H new ATOM 0 HB2 LEU B 19 1.662 11.963 -2.129 1.00 0.00 H new ATOM 0 HB3 LEU B 19 0.393 11.318 -1.106 1.00 0.00 H new ATOM 0 HG LEU B 19 -0.005 12.540 -3.852 1.00 0.00 H new ATOM 0 HD11 LEU B 19 -0.530 10.230 -4.540 1.00 0.00 H new ATOM 0 HD12 LEU B 19 1.138 10.378 -3.939 1.00 0.00 H new ATOM 0 HD13 LEU B 19 -0.119 9.657 -2.906 1.00 0.00 H new ATOM 0 HD21 LEU B 19 -2.308 11.690 -3.663 1.00 0.00 H new ATOM 0 HD22 LEU B 19 -1.975 11.174 -1.993 1.00 0.00 H new ATOM 0 HD23 LEU B 19 -1.944 12.903 -2.413 1.00 0.00 H new ATOM 1627 N LEU B 20 2.564 13.662 -0.124 1.00 0.00 N ATOM 1628 CA LEU B 20 3.476 13.800 1.004 1.00 0.00 C ATOM 1629 C LEU B 20 3.189 15.089 1.762 1.00 0.00 C ATOM 1630 O LEU B 20 3.240 15.123 2.990 1.00 0.00 O ATOM 1631 CB LEU B 20 4.930 13.784 0.526 1.00 0.00 C ATOM 1632 CG LEU B 20 5.379 12.491 -0.157 1.00 0.00 C ATOM 1633 CD1 LEU B 20 6.821 12.612 -0.623 1.00 0.00 C ATOM 1634 CD2 LEU B 20 5.223 11.306 0.785 1.00 0.00 C ATOM 0 H LEU B 20 3.021 13.652 -1.036 1.00 0.00 H new ATOM 0 HA LEU B 20 3.322 12.955 1.675 1.00 0.00 H new ATOM 0 HB2 LEU B 20 5.076 14.612 -0.168 1.00 0.00 H new ATOM 0 HB3 LEU B 20 5.579 13.967 1.382 1.00 0.00 H new ATOM 0 HG LEU B 20 4.745 12.323 -1.028 1.00 0.00 H new ATOM 0 HD11 LEU B 20 7.126 11.684 -1.107 1.00 0.00 H new ATOM 0 HD12 LEU B 20 6.907 13.436 -1.331 1.00 0.00 H new ATOM 0 HD13 LEU B 20 7.466 12.803 0.235 1.00 0.00 H new ATOM 0 HD21 LEU B 20 5.547 10.396 0.281 1.00 0.00 H new ATOM 0 HD22 LEU B 20 5.833 11.465 1.674 1.00 0.00 H new ATOM 0 HD23 LEU B 20 4.177 11.207 1.075 1.00 0.00 H new ATOM 1646 N ASN B 21 2.869 16.139 1.013 1.00 0.00 N ATOM 1647 CA ASN B 21 2.526 17.435 1.593 1.00 0.00 C ATOM 1648 C ASN B 21 1.349 17.311 2.551 1.00 0.00 C ATOM 1649 O ASN B 21 1.363 17.889 3.633 1.00 0.00 O ATOM 1650 CB ASN B 21 2.206 18.444 0.485 1.00 0.00 C ATOM 1651 CG ASN B 21 1.572 19.721 1.007 1.00 0.00 C ATOM 1652 OD1 ASN B 21 2.264 20.661 1.396 1.00 0.00 O ATOM 1653 ND2 ASN B 21 0.247 19.771 0.993 1.00 0.00 N ATOM 0 H ASN B 21 2.840 16.118 -0.006 1.00 0.00 H new ATOM 0 HA ASN B 21 3.387 17.792 2.159 1.00 0.00 H new ATOM 0 HB2 ASN B 21 3.124 18.693 -0.048 1.00 0.00 H new ATOM 0 HB3 ASN B 21 1.534 17.981 -0.237 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -0.235 20.611 1.313 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -0.290 18.969 0.663 1.00 0.00 H new ATOM 1660 N VAL B 22 0.339 16.544 2.157 1.00 0.00 N ATOM 1661 CA VAL B 22 -0.844 16.352 2.991 1.00 0.00 C ATOM 1662 C VAL B 22 -0.476 15.690 4.316 1.00 0.00 C ATOM 1663 O VAL B 22 -0.887 16.145 5.387 1.00 0.00 O ATOM 1664 CB VAL B 22 -1.913 15.500 2.273 1.00 0.00 C ATOM 1665 CG1 VAL B 22 -3.083 15.206 3.197 1.00 0.00 C ATOM 1666 CG2 VAL B 22 -2.398 16.200 1.015 1.00 0.00 C ATOM 0 H VAL B 22 0.314 16.045 1.267 1.00 0.00 H new ATOM 0 HA VAL B 22 -1.260 17.341 3.186 1.00 0.00 H new ATOM 0 HB VAL B 22 -1.454 14.553 1.990 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -3.822 14.605 2.668 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -2.728 14.659 4.071 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -3.539 16.143 3.516 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -3.151 15.584 0.523 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -2.834 17.163 1.280 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -1.558 16.356 0.338 1.00 0.00 H new ATOM 1676 N LEU B 23 0.314 14.626 4.238 1.00 0.00 N ATOM 1677 CA LEU B 23 0.733 13.896 5.429 1.00 0.00 C ATOM 1678 C LEU B 23 1.625 14.761 6.317 1.00 0.00 C ATOM 1679 O LEU B 23 1.483 14.761 7.541 1.00 0.00 O ATOM 1680 CB LEU B 23 1.467 12.614 5.036 1.00 0.00 C ATOM 1681 CG LEU B 23 0.642 11.616 4.219 1.00 0.00 C ATOM 1682 CD1 LEU B 23 1.482 10.401 3.862 1.00 0.00 C ATOM 1683 CD2 LEU B 23 -0.606 11.199 4.982 1.00 0.00 C ATOM 0 H LEU B 23 0.678 14.249 3.363 1.00 0.00 H new ATOM 0 HA LEU B 23 -0.161 13.633 5.995 1.00 0.00 H new ATOM 0 HB2 LEU B 23 2.354 12.883 4.463 1.00 0.00 H new ATOM 0 HB3 LEU B 23 1.812 12.119 5.944 1.00 0.00 H new ATOM 0 HG LEU B 23 0.329 12.103 3.295 1.00 0.00 H new ATOM 0 HD11 LEU B 23 0.881 9.701 3.281 1.00 0.00 H new ATOM 0 HD12 LEU B 23 2.344 10.715 3.273 1.00 0.00 H new ATOM 0 HD13 LEU B 23 1.824 9.914 4.775 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -1.178 10.490 4.384 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -0.318 10.731 5.923 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -1.218 12.078 5.187 1.00 0.00 H new ATOM 1695 N GLU B 24 2.530 15.506 5.692 1.00 0.00 N ATOM 1696 CA GLU B 24 3.445 16.380 6.419 1.00 0.00 C ATOM 1697 C GLU B 24 2.700 17.550 7.054 1.00 0.00 C ATOM 1698 O GLU B 24 2.937 17.887 8.212 1.00 0.00 O ATOM 1699 CB GLU B 24 4.544 16.890 5.482 1.00 0.00 C ATOM 1700 CG GLU B 24 5.477 17.899 6.128 1.00 0.00 C ATOM 1701 CD GLU B 24 6.685 18.206 5.272 1.00 0.00 C ATOM 1702 OE1 GLU B 24 6.545 18.924 4.264 1.00 0.00 O ATOM 1703 OE2 GLU B 24 7.791 17.740 5.617 1.00 0.00 O ATOM 0 H GLU B 24 2.650 15.522 4.679 1.00 0.00 H new ATOM 0 HA GLU B 24 3.905 15.801 7.220 1.00 0.00 H new ATOM 0 HB2 GLU B 24 5.130 16.042 5.128 1.00 0.00 H new ATOM 0 HB3 GLU B 24 4.081 17.345 4.607 1.00 0.00 H new ATOM 0 HG2 GLU B 24 4.930 18.822 6.322 1.00 0.00 H new ATOM 0 HG3 GLU B 24 5.808 17.516 7.093 1.00 0.00 H new ATOM 1710 N LYS B 25 1.794 18.154 6.293 1.00 0.00 N ATOM 1711 CA LYS B 25 1.006 19.286 6.772 1.00 0.00 C ATOM 1712 C LYS B 25 0.167 18.887 7.984 1.00 0.00 C ATOM 1713 O LYS B 25 0.018 19.657 8.932 1.00 0.00 O ATOM 1714 CB LYS B 25 0.105 19.809 5.648 1.00 0.00 C ATOM 1715 CG LYS B 25 -0.706 21.039 6.022 1.00 0.00 C ATOM 1716 CD LYS B 25 -1.501 21.573 4.838 1.00 0.00 C ATOM 1717 CE LYS B 25 -2.534 20.571 4.347 1.00 0.00 C ATOM 1718 NZ LYS B 25 -3.334 21.110 3.216 1.00 0.00 N ATOM 0 H LYS B 25 1.585 17.876 5.334 1.00 0.00 H new ATOM 0 HA LYS B 25 1.688 20.079 7.078 1.00 0.00 H new ATOM 0 HB2 LYS B 25 0.723 20.045 4.782 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -0.578 19.015 5.346 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -1.388 20.791 6.836 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -0.038 21.817 6.392 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -2.001 22.498 5.125 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -0.819 21.818 4.024 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -2.032 19.656 4.033 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -3.200 20.304 5.168 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -4.027 20.397 2.910 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -3.834 21.969 3.523 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -2.702 21.341 2.423 1.00 0.00 H new ATOM 1732 N HIS B 26 -0.370 17.672 7.950 1.00 0.00 N ATOM 1733 CA HIS B 26 -1.144 17.150 9.072 1.00 0.00 C ATOM 1734 C HIS B 26 -0.225 16.693 10.197 1.00 0.00 C ATOM 1735 O HIS B 26 -0.642 16.623 11.352 1.00 0.00 O ATOM 1736 CB HIS B 26 -2.037 15.987 8.629 1.00 0.00 C ATOM 1737 CG HIS B 26 -3.353 16.417 8.060 1.00 0.00 C ATOM 1738 ND1 HIS B 26 -4.556 16.114 8.655 1.00 0.00 N ATOM 1739 CD2 HIS B 26 -3.654 17.120 6.943 1.00 0.00 C ATOM 1740 CE1 HIS B 26 -5.541 16.611 7.931 1.00 0.00 C ATOM 1741 NE2 HIS B 26 -5.022 17.227 6.887 1.00 0.00 N ATOM 0 H HIS B 26 -0.284 17.032 7.161 1.00 0.00 H new ATOM 0 HA HIS B 26 -1.778 17.957 9.439 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -1.505 15.397 7.883 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -2.217 15.334 9.483 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -2.950 17.522 6.229 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -6.594 16.527 8.156 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -5.550 17.705 6.157 1.00 0.00 H new ATOM 1750 N LYS B 27 1.026 16.403 9.842 1.00 0.00 N ATOM 1751 CA LYS B 27 2.015 15.882 10.781 1.00 0.00 C ATOM 1752 C LYS B 27 1.478 14.623 11.457 1.00 0.00 C ATOM 1753 O LYS B 27 1.336 14.552 12.679 1.00 0.00 O ATOM 1754 CB LYS B 27 2.409 16.954 11.811 1.00 0.00 C ATOM 1755 CG LYS B 27 3.567 16.555 12.722 1.00 0.00 C ATOM 1756 CD LYS B 27 4.829 16.217 11.936 1.00 0.00 C ATOM 1757 CE LYS B 27 5.342 17.410 11.143 1.00 0.00 C ATOM 1758 NZ LYS B 27 6.601 17.093 10.418 1.00 0.00 N ATOM 0 H LYS B 27 1.382 16.523 8.894 1.00 0.00 H new ATOM 0 HA LYS B 27 2.918 15.614 10.233 1.00 0.00 H new ATOM 0 HB2 LYS B 27 2.677 17.868 11.282 1.00 0.00 H new ATOM 0 HB3 LYS B 27 1.540 17.185 12.427 1.00 0.00 H new ATOM 0 HG2 LYS B 27 3.780 17.370 13.414 1.00 0.00 H new ATOM 0 HG3 LYS B 27 3.274 15.694 13.323 1.00 0.00 H new ATOM 0 HD2 LYS B 27 5.604 15.878 12.623 1.00 0.00 H new ATOM 0 HD3 LYS B 27 4.622 15.391 11.256 1.00 0.00 H new ATOM 0 HE2 LYS B 27 4.581 17.726 10.429 1.00 0.00 H new ATOM 0 HE3 LYS B 27 5.513 18.248 11.818 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 6.918 17.931 9.890 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 7.335 16.816 11.101 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 6.432 16.310 9.755 1.00 0.00 H new ATOM 1772 N ALA B 28 1.154 13.638 10.634 1.00 0.00 N ATOM 1773 CA ALA B 28 0.614 12.379 11.119 1.00 0.00 C ATOM 1774 C ALA B 28 1.727 11.358 11.304 1.00 0.00 C ATOM 1775 O ALA B 28 2.682 11.330 10.527 1.00 0.00 O ATOM 1776 CB ALA B 28 -0.440 11.852 10.155 1.00 0.00 C ATOM 0 H ALA B 28 1.257 13.688 9.620 1.00 0.00 H new ATOM 0 HA ALA B 28 0.144 12.552 12.087 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -0.837 10.908 10.530 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -1.249 12.577 10.069 1.00 0.00 H new ATOM 0 HB3 ALA B 28 0.010 11.693 9.175 1.00 0.00 H new ATOM 1782 N PRO B 29 1.625 10.513 12.343 1.00 0.00 N ATOM 1783 CA PRO B 29 2.628 9.480 12.620 1.00 0.00 C ATOM 1784 C PRO B 29 2.688 8.423 11.519 1.00 0.00 C ATOM 1785 O PRO B 29 1.697 8.183 10.822 1.00 0.00 O ATOM 1786 CB PRO B 29 2.149 8.854 13.935 1.00 0.00 C ATOM 1787 CG PRO B 29 0.696 9.172 14.010 1.00 0.00 C ATOM 1788 CD PRO B 29 0.529 10.500 13.329 1.00 0.00 C ATOM 0 HA PRO B 29 3.634 9.896 12.675 1.00 0.00 H new ATOM 0 HB2 PRO B 29 2.318 7.777 13.943 1.00 0.00 H new ATOM 0 HB3 PRO B 29 2.688 9.268 14.788 1.00 0.00 H new ATOM 0 HG2 PRO B 29 0.102 8.403 13.517 1.00 0.00 H new ATOM 0 HG3 PRO B 29 0.360 9.219 15.046 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -0.446 10.587 12.849 1.00 0.00 H new ATOM 0 HD3 PRO B 29 0.612 11.327 14.034 1.00 0.00 H new ATOM 1796 N THR B 30 3.850 7.791 11.379 1.00 0.00 N ATOM 1797 CA THR B 30 4.051 6.748 10.379 1.00 0.00 C ATOM 1798 C THR B 30 3.013 5.641 10.535 1.00 0.00 C ATOM 1799 O THR B 30 2.527 5.087 9.548 1.00 0.00 O ATOM 1800 CB THR B 30 5.456 6.137 10.510 1.00 0.00 C ATOM 1801 OG1 THR B 30 6.415 7.179 10.739 1.00 0.00 O ATOM 1802 CG2 THR B 30 5.832 5.365 9.253 1.00 0.00 C ATOM 0 H THR B 30 4.672 7.985 11.951 1.00 0.00 H new ATOM 0 HA THR B 30 3.943 7.207 9.396 1.00 0.00 H new ATOM 0 HB THR B 30 5.454 5.445 11.353 1.00 0.00 H new ATOM 0 HG1 THR B 30 7.320 6.822 10.623 1.00 0.00 H new ATOM 0 HG21 THR B 30 6.830 4.943 9.370 1.00 0.00 H new ATOM 0 HG22 THR B 30 5.114 4.561 9.092 1.00 0.00 H new ATOM 0 HG23 THR B 30 5.822 6.038 8.396 1.00 0.00 H new ATOM 1810 N ASP B 31 2.680 5.343 11.786 1.00 0.00 N ATOM 1811 CA ASP B 31 1.677 4.339 12.117 1.00 0.00 C ATOM 1812 C ASP B 31 0.386 4.610 11.364 1.00 0.00 C ATOM 1813 O ASP B 31 -0.119 3.762 10.629 1.00 0.00 O ATOM 1814 CB ASP B 31 1.382 4.364 13.617 1.00 0.00 C ATOM 1815 CG ASP B 31 2.630 4.305 14.471 1.00 0.00 C ATOM 1816 OD1 ASP B 31 3.321 5.343 14.595 1.00 0.00 O ATOM 1817 OD2 ASP B 31 2.910 3.234 15.043 1.00 0.00 O ATOM 0 H ASP B 31 3.099 5.792 12.600 1.00 0.00 H new ATOM 0 HA ASP B 31 2.069 3.363 11.832 1.00 0.00 H new ATOM 0 HB2 ASP B 31 0.828 5.272 13.857 1.00 0.00 H new ATOM 0 HB3 ASP B 31 0.738 3.522 13.868 1.00 0.00 H new ATOM 1822 N LEU B 32 -0.132 5.814 11.550 1.00 0.00 N ATOM 1823 CA LEU B 32 -1.382 6.216 10.936 1.00 0.00 C ATOM 1824 C LEU B 32 -1.222 6.334 9.427 1.00 0.00 C ATOM 1825 O LEU B 32 -2.096 5.920 8.674 1.00 0.00 O ATOM 1826 CB LEU B 32 -1.848 7.545 11.533 1.00 0.00 C ATOM 1827 CG LEU B 32 -3.201 8.061 11.036 1.00 0.00 C ATOM 1828 CD1 LEU B 32 -4.302 7.049 11.319 1.00 0.00 C ATOM 1829 CD2 LEU B 32 -3.522 9.394 11.690 1.00 0.00 C ATOM 0 H LEU B 32 0.301 6.534 12.128 1.00 0.00 H new ATOM 0 HA LEU B 32 -2.136 5.455 11.138 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -1.897 7.437 12.617 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -1.092 8.301 11.322 1.00 0.00 H new ATOM 0 HG LEU B 32 -3.143 8.204 9.957 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -5.254 7.437 10.957 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -4.075 6.112 10.810 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -4.366 6.872 12.393 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -4.486 9.753 11.330 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -3.562 9.268 12.772 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -2.748 10.119 11.438 1.00 0.00 H new ATOM 1841 N SER B 33 -0.090 6.880 8.998 1.00 0.00 N ATOM 1842 CA SER B 33 0.188 7.064 7.581 1.00 0.00 C ATOM 1843 C SER B 33 0.110 5.733 6.830 1.00 0.00 C ATOM 1844 O SER B 33 -0.647 5.599 5.867 1.00 0.00 O ATOM 1845 CB SER B 33 1.569 7.703 7.400 1.00 0.00 C ATOM 1846 OG SER B 33 1.833 7.988 6.038 1.00 0.00 O ATOM 0 H SER B 33 0.653 7.204 9.617 1.00 0.00 H new ATOM 0 HA SER B 33 -0.568 7.728 7.163 1.00 0.00 H new ATOM 0 HB2 SER B 33 1.625 8.622 7.983 1.00 0.00 H new ATOM 0 HB3 SER B 33 2.335 7.032 7.788 1.00 0.00 H new ATOM 0 HG SER B 33 2.720 8.396 5.955 1.00 0.00 H new ATOM 1852 N LEU B 34 0.868 4.744 7.296 1.00 0.00 N ATOM 1853 CA LEU B 34 0.903 3.435 6.654 1.00 0.00 C ATOM 1854 C LEU B 34 -0.464 2.763 6.693 1.00 0.00 C ATOM 1855 O LEU B 34 -0.881 2.125 5.726 1.00 0.00 O ATOM 1856 CB LEU B 34 1.940 2.534 7.329 1.00 0.00 C ATOM 1857 CG LEU B 34 3.398 2.942 7.116 1.00 0.00 C ATOM 1858 CD1 LEU B 34 4.324 2.046 7.925 1.00 0.00 C ATOM 1859 CD2 LEU B 34 3.752 2.879 5.637 1.00 0.00 C ATOM 0 H LEU B 34 1.467 4.825 8.118 1.00 0.00 H new ATOM 0 HA LEU B 34 1.183 3.587 5.612 1.00 0.00 H new ATOM 0 HB2 LEU B 34 1.738 2.515 8.400 1.00 0.00 H new ATOM 0 HB3 LEU B 34 1.807 1.517 6.961 1.00 0.00 H new ATOM 0 HG LEU B 34 3.527 3.968 7.460 1.00 0.00 H new ATOM 0 HD11 LEU B 34 5.358 2.350 7.762 1.00 0.00 H new ATOM 0 HD12 LEU B 34 4.082 2.135 8.984 1.00 0.00 H new ATOM 0 HD13 LEU B 34 4.196 1.011 7.609 1.00 0.00 H new ATOM 0 HD21 LEU B 34 4.793 3.172 5.499 1.00 0.00 H new ATOM 0 HD22 LEU B 34 3.610 1.862 5.272 1.00 0.00 H new ATOM 0 HD23 LEU B 34 3.107 3.558 5.079 1.00 0.00 H new ATOM 1871 N MET B 35 -1.162 2.916 7.810 1.00 0.00 N ATOM 1872 CA MET B 35 -2.467 2.292 7.980 1.00 0.00 C ATOM 1873 C MET B 35 -3.479 2.910 7.015 1.00 0.00 C ATOM 1874 O MET B 35 -4.214 2.195 6.329 1.00 0.00 O ATOM 1875 CB MET B 35 -2.934 2.437 9.432 1.00 0.00 C ATOM 1876 CG MET B 35 -3.932 1.373 9.876 1.00 0.00 C ATOM 1877 SD MET B 35 -5.552 1.532 9.100 1.00 0.00 S ATOM 1878 CE MET B 35 -6.063 3.128 9.725 1.00 0.00 C ATOM 0 H MET B 35 -0.848 3.465 8.610 1.00 0.00 H new ATOM 0 HA MET B 35 -2.386 1.229 7.751 1.00 0.00 H new ATOM 0 HB2 MET B 35 -2.064 2.399 10.087 1.00 0.00 H new ATOM 0 HB3 MET B 35 -3.387 3.420 9.560 1.00 0.00 H new ATOM 0 HG2 MET B 35 -3.525 0.388 9.649 1.00 0.00 H new ATOM 0 HG3 MET B 35 -4.050 1.427 10.958 1.00 0.00 H new ATOM 0 HE1 MET B 35 -7.151 3.167 9.776 1.00 0.00 H new ATOM 0 HE2 MET B 35 -5.647 3.279 10.721 1.00 0.00 H new ATOM 0 HE3 MET B 35 -5.703 3.912 9.059 1.00 0.00 H new ATOM 1888 N VAL B 36 -3.493 4.240 6.944 1.00 0.00 N ATOM 1889 CA VAL B 36 -4.384 4.947 6.030 1.00 0.00 C ATOM 1890 C VAL B 36 -4.081 4.570 4.583 1.00 0.00 C ATOM 1891 O VAL B 36 -4.992 4.264 3.813 1.00 0.00 O ATOM 1892 CB VAL B 36 -4.286 6.481 6.204 1.00 0.00 C ATOM 1893 CG1 VAL B 36 -5.058 7.209 5.111 1.00 0.00 C ATOM 1894 CG2 VAL B 36 -4.806 6.894 7.572 1.00 0.00 C ATOM 0 H VAL B 36 -2.898 4.847 7.508 1.00 0.00 H new ATOM 0 HA VAL B 36 -5.402 4.644 6.274 1.00 0.00 H new ATOM 0 HB VAL B 36 -3.235 6.760 6.124 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -4.971 8.285 5.259 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -4.648 6.943 4.137 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -6.108 6.921 5.154 1.00 0.00 H new ATOM 0 HG21 VAL B 36 -4.730 7.976 7.679 1.00 0.00 H new ATOM 0 HG22 VAL B 36 -5.849 6.592 7.671 1.00 0.00 H new ATOM 0 HG23 VAL B 36 -4.213 6.411 8.348 1.00 0.00 H new ATOM 1904 N LEU B 37 -2.799 4.571 4.226 1.00 0.00 N ATOM 1905 CA LEU B 37 -2.384 4.192 2.879 1.00 0.00 C ATOM 1906 C LEU B 37 -2.807 2.761 2.568 1.00 0.00 C ATOM 1907 O LEU B 37 -3.325 2.481 1.490 1.00 0.00 O ATOM 1908 CB LEU B 37 -0.868 4.340 2.718 1.00 0.00 C ATOM 1909 CG LEU B 37 -0.341 5.775 2.796 1.00 0.00 C ATOM 1910 CD1 LEU B 37 1.175 5.792 2.668 1.00 0.00 C ATOM 1911 CD2 LEU B 37 -0.985 6.644 1.722 1.00 0.00 C ATOM 0 H LEU B 37 -2.033 4.829 4.848 1.00 0.00 H new ATOM 0 HA LEU B 37 -2.876 4.862 2.173 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -0.377 3.747 3.490 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -0.578 3.915 1.757 1.00 0.00 H new ATOM 0 HG LEU B 37 -0.607 6.188 3.769 1.00 0.00 H new ATOM 0 HD11 LEU B 37 1.533 6.820 2.725 1.00 0.00 H new ATOM 0 HD12 LEU B 37 1.615 5.208 3.477 1.00 0.00 H new ATOM 0 HD13 LEU B 37 1.464 5.360 1.710 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -0.597 7.660 1.795 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -0.754 6.237 0.738 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -2.066 6.657 1.864 1.00 0.00 H new ATOM 1923 N GLY B 38 -2.600 1.864 3.525 1.00 0.00 N ATOM 1924 CA GLY B 38 -2.987 0.477 3.346 1.00 0.00 C ATOM 1925 C GLY B 38 -4.476 0.315 3.104 1.00 0.00 C ATOM 1926 O GLY B 38 -4.892 -0.423 2.208 1.00 0.00 O ATOM 0 H GLY B 38 -2.169 2.074 4.425 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -2.438 0.056 2.504 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -2.702 -0.093 4.230 1.00 0.00 H new ATOM 1930 N ASN B 39 -5.283 1.015 3.892 1.00 0.00 N ATOM 1931 CA ASN B 39 -6.731 0.960 3.735 1.00 0.00 C ATOM 1932 C ASN B 39 -7.142 1.626 2.425 1.00 0.00 C ATOM 1933 O ASN B 39 -8.068 1.177 1.752 1.00 0.00 O ATOM 1934 CB ASN B 39 -7.425 1.637 4.920 1.00 0.00 C ATOM 1935 CG ASN B 39 -8.922 1.383 4.948 1.00 0.00 C ATOM 1936 OD1 ASN B 39 -9.709 2.137 4.374 1.00 0.00 O ATOM 1937 ND2 ASN B 39 -9.328 0.319 5.626 1.00 0.00 N ATOM 0 H ASN B 39 -4.961 1.625 4.643 1.00 0.00 H new ATOM 0 HA ASN B 39 -7.040 -0.085 3.709 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -6.982 1.277 5.849 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -7.244 2.711 4.876 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -10.323 0.101 5.685 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -8.646 -0.282 6.088 1.00 0.00 H new ATOM 1944 N MET B 40 -6.425 2.684 2.065 1.00 0.00 N ATOM 1945 CA MET B 40 -6.655 3.395 0.811 1.00 0.00 C ATOM 1946 C MET B 40 -6.400 2.475 -0.380 1.00 0.00 C ATOM 1947 O MET B 40 -7.192 2.428 -1.322 1.00 0.00 O ATOM 1948 CB MET B 40 -5.747 4.626 0.735 1.00 0.00 C ATOM 1949 CG MET B 40 -5.888 5.427 -0.548 1.00 0.00 C ATOM 1950 SD MET B 40 -4.815 6.873 -0.573 1.00 0.00 S ATOM 1951 CE MET B 40 -5.147 7.524 -2.205 1.00 0.00 C ATOM 0 H MET B 40 -5.671 3.073 2.631 1.00 0.00 H new ATOM 0 HA MET B 40 -7.695 3.719 0.778 1.00 0.00 H new ATOM 0 HB2 MET B 40 -5.965 5.277 1.582 1.00 0.00 H new ATOM 0 HB3 MET B 40 -4.710 4.305 0.838 1.00 0.00 H new ATOM 0 HG2 MET B 40 -5.653 4.789 -1.400 1.00 0.00 H new ATOM 0 HG3 MET B 40 -6.924 5.744 -0.663 1.00 0.00 H new ATOM 0 HE1 MET B 40 -4.224 7.908 -2.638 1.00 0.00 H new ATOM 0 HE2 MET B 40 -5.543 6.731 -2.839 1.00 0.00 H new ATOM 0 HE3 MET B 40 -5.877 8.330 -2.134 1.00 0.00 H new ATOM 1961 N VAL B 41 -5.294 1.740 -0.327 1.00 0.00 N ATOM 1962 CA VAL B 41 -4.974 0.762 -1.360 1.00 0.00 C ATOM 1963 C VAL B 41 -6.058 -0.310 -1.427 1.00 0.00 C ATOM 1964 O VAL B 41 -6.536 -0.655 -2.508 1.00 0.00 O ATOM 1965 CB VAL B 41 -3.602 0.092 -1.114 1.00 0.00 C ATOM 1966 CG1 VAL B 41 -3.322 -0.987 -2.150 1.00 0.00 C ATOM 1967 CG2 VAL B 41 -2.491 1.131 -1.127 1.00 0.00 C ATOM 0 H VAL B 41 -4.604 1.803 0.421 1.00 0.00 H new ATOM 0 HA VAL B 41 -4.925 1.297 -2.308 1.00 0.00 H new ATOM 0 HB VAL B 41 -3.633 -0.379 -0.132 1.00 0.00 H new ATOM 0 HG11 VAL B 41 -2.351 -1.439 -1.951 1.00 0.00 H new ATOM 0 HG12 VAL B 41 -4.096 -1.752 -2.097 1.00 0.00 H new ATOM 0 HG13 VAL B 41 -3.318 -0.543 -3.146 1.00 0.00 H new ATOM 0 HG21 VAL B 41 -1.533 0.641 -0.952 1.00 0.00 H new ATOM 0 HG22 VAL B 41 -2.472 1.631 -2.095 1.00 0.00 H new ATOM 0 HG23 VAL B 41 -2.671 1.866 -0.343 1.00 0.00 H new ATOM 1977 N THR B 42 -6.460 -0.809 -0.262 1.00 0.00 N ATOM 1978 CA THR B 42 -7.507 -1.819 -0.175 1.00 0.00 C ATOM 1979 C THR B 42 -8.811 -1.307 -0.792 1.00 0.00 C ATOM 1980 O THR B 42 -9.497 -2.034 -1.511 1.00 0.00 O ATOM 1981 CB THR B 42 -7.759 -2.230 1.291 1.00 0.00 C ATOM 1982 OG1 THR B 42 -6.532 -2.655 1.898 1.00 0.00 O ATOM 1983 CG2 THR B 42 -8.780 -3.356 1.375 1.00 0.00 C ATOM 0 H THR B 42 -6.073 -0.528 0.639 1.00 0.00 H new ATOM 0 HA THR B 42 -7.167 -2.691 -0.733 1.00 0.00 H new ATOM 0 HB THR B 42 -8.152 -1.363 1.822 1.00 0.00 H new ATOM 0 HG1 THR B 42 -5.966 -1.874 2.072 1.00 0.00 H new ATOM 0 HG21 THR B 42 -8.939 -3.626 2.419 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.723 -3.026 0.938 1.00 0.00 H new ATOM 0 HG23 THR B 42 -8.411 -4.223 0.828 1.00 0.00 H new ATOM 1991 N ASN B 43 -9.133 -0.047 -0.517 1.00 0.00 N ATOM 1992 CA ASN B 43 -10.337 0.577 -1.054 1.00 0.00 C ATOM 1993 C ASN B 43 -10.253 0.669 -2.577 1.00 0.00 C ATOM 1994 O ASN B 43 -11.197 0.312 -3.284 1.00 0.00 O ATOM 1995 CB ASN B 43 -10.519 1.976 -0.455 1.00 0.00 C ATOM 1996 CG ASN B 43 -11.873 2.585 -0.773 1.00 0.00 C ATOM 1997 OD1 ASN B 43 -12.053 3.228 -1.807 1.00 0.00 O ATOM 1998 ND2 ASN B 43 -12.829 2.405 0.126 1.00 0.00 N ATOM 0 H ASN B 43 -8.574 0.564 0.078 1.00 0.00 H new ATOM 0 HA ASN B 43 -11.196 -0.038 -0.786 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -10.396 1.921 0.627 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -9.734 2.632 -0.832 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -13.754 2.806 -0.026 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -12.640 1.865 0.971 1.00 0.00 H new ATOM 2005 N LEU B 44 -9.102 1.123 -3.070 1.00 0.00 N ATOM 2006 CA LEU B 44 -8.872 1.260 -4.505 1.00 0.00 C ATOM 2007 C LEU B 44 -9.001 -0.089 -5.207 1.00 0.00 C ATOM 2008 O LEU B 44 -9.681 -0.210 -6.223 1.00 0.00 O ATOM 2009 CB LEU B 44 -7.484 1.854 -4.763 1.00 0.00 C ATOM 2010 CG LEU B 44 -7.132 2.081 -6.235 1.00 0.00 C ATOM 2011 CD1 LEU B 44 -8.057 3.118 -6.857 1.00 0.00 C ATOM 2012 CD2 LEU B 44 -5.680 2.511 -6.371 1.00 0.00 C ATOM 0 H LEU B 44 -8.310 1.404 -2.491 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.629 1.932 -4.909 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.412 2.807 -4.238 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.737 1.192 -4.326 1.00 0.00 H new ATOM 0 HG LEU B 44 -7.267 1.141 -6.770 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.789 3.264 -7.903 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -9.088 2.771 -6.792 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -7.957 4.062 -6.322 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -5.444 2.669 -7.423 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -5.522 3.439 -5.821 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -5.031 1.734 -5.966 1.00 0.00 H new ATOM 2024 N ILE B 45 -8.348 -1.105 -4.654 1.00 0.00 N ATOM 2025 CA ILE B 45 -8.408 -2.449 -5.215 1.00 0.00 C ATOM 2026 C ILE B 45 -9.846 -2.967 -5.220 1.00 0.00 C ATOM 2027 O ILE B 45 -10.290 -3.602 -6.176 1.00 0.00 O ATOM 2028 CB ILE B 45 -7.504 -3.427 -4.426 1.00 0.00 C ATOM 2029 CG1 ILE B 45 -6.040 -2.985 -4.513 1.00 0.00 C ATOM 2030 CG2 ILE B 45 -7.661 -4.846 -4.951 1.00 0.00 C ATOM 2031 CD1 ILE B 45 -5.088 -3.874 -3.741 1.00 0.00 C ATOM 0 H ILE B 45 -7.771 -1.023 -3.817 1.00 0.00 H new ATOM 0 HA ILE B 45 -8.045 -2.393 -6.241 1.00 0.00 H new ATOM 0 HB ILE B 45 -7.812 -3.413 -3.381 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -5.737 -2.966 -5.560 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -5.955 -1.965 -4.138 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -7.017 -5.517 -4.383 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -8.699 -5.161 -4.843 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -7.380 -4.878 -6.004 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -4.071 -3.498 -3.850 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -5.364 -3.874 -2.687 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -5.143 -4.891 -4.130 1.00 0.00 H new ATOM 2043 N ASN B 46 -10.575 -2.646 -4.162 1.00 0.00 N ATOM 2044 CA ASN B 46 -11.948 -3.112 -3.985 1.00 0.00 C ATOM 2045 C ASN B 46 -12.881 -2.561 -5.062 1.00 0.00 C ATOM 2046 O ASN B 46 -13.723 -3.289 -5.593 1.00 0.00 O ATOM 2047 CB ASN B 46 -12.456 -2.706 -2.596 1.00 0.00 C ATOM 2048 CG ASN B 46 -13.869 -3.181 -2.315 1.00 0.00 C ATOM 2049 OD1 ASN B 46 -14.845 -2.490 -2.610 1.00 0.00 O ATOM 2050 ND2 ASN B 46 -13.988 -4.360 -1.726 1.00 0.00 N ATOM 0 H ASN B 46 -10.235 -2.057 -3.402 1.00 0.00 H new ATOM 0 HA ASN B 46 -11.946 -4.198 -4.076 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -11.786 -3.111 -1.838 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -12.420 -1.620 -2.506 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -14.913 -4.726 -1.500 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -13.155 -4.902 -1.498 1.00 0.00 H new ATOM 2057 N THR B 47 -12.719 -1.286 -5.399 1.00 0.00 N ATOM 2058 CA THR B 47 -13.669 -0.609 -6.277 1.00 0.00 C ATOM 2059 C THR B 47 -13.106 -0.368 -7.683 1.00 0.00 C ATOM 2060 O THR B 47 -13.724 0.323 -8.494 1.00 0.00 O ATOM 2061 CB THR B 47 -14.117 0.737 -5.658 1.00 0.00 C ATOM 2062 OG1 THR B 47 -15.220 1.284 -6.396 1.00 0.00 O ATOM 2063 CG2 THR B 47 -12.971 1.745 -5.628 1.00 0.00 C ATOM 0 H THR B 47 -11.945 -0.703 -5.081 1.00 0.00 H new ATOM 0 HA THR B 47 -14.528 -1.273 -6.377 1.00 0.00 H new ATOM 0 HB THR B 47 -14.429 0.540 -4.632 1.00 0.00 H new ATOM 0 HG1 THR B 47 -15.141 1.029 -7.339 1.00 0.00 H new ATOM 0 HG21 THR B 47 -13.320 2.679 -5.187 1.00 0.00 H new ATOM 0 HG22 THR B 47 -12.151 1.346 -5.031 1.00 0.00 H new ATOM 0 HG23 THR B 47 -12.623 1.931 -6.644 1.00 0.00 H new ATOM 2071 N SER B 48 -11.948 -0.936 -7.986 1.00 0.00 N ATOM 2072 CA SER B 48 -11.348 -0.742 -9.301 1.00 0.00 C ATOM 2073 C SER B 48 -10.806 -2.051 -9.870 1.00 0.00 C ATOM 2074 O SER B 48 -11.120 -2.423 -11.002 1.00 0.00 O ATOM 2075 CB SER B 48 -10.236 0.308 -9.230 1.00 0.00 C ATOM 2076 OG SER B 48 -10.733 1.542 -8.738 1.00 0.00 O ATOM 0 H SER B 48 -11.411 -1.527 -7.351 1.00 0.00 H new ATOM 0 HA SER B 48 -12.130 -0.387 -9.972 1.00 0.00 H new ATOM 0 HB2 SER B 48 -9.434 -0.049 -8.583 1.00 0.00 H new ATOM 0 HB3 SER B 48 -9.805 0.454 -10.221 1.00 0.00 H new ATOM 0 HG SER B 48 -10.004 2.196 -8.700 1.00 0.00 H new ATOM 2082 N ILE B 49 -10.006 -2.755 -9.082 1.00 0.00 N ATOM 2083 CA ILE B 49 -9.378 -3.984 -9.545 1.00 0.00 C ATOM 2084 C ILE B 49 -10.356 -5.151 -9.449 1.00 0.00 C ATOM 2085 O ILE B 49 -10.981 -5.367 -8.408 1.00 0.00 O ATOM 2086 CB ILE B 49 -8.096 -4.297 -8.740 1.00 0.00 C ATOM 2087 CG1 ILE B 49 -7.105 -3.133 -8.864 1.00 0.00 C ATOM 2088 CG2 ILE B 49 -7.460 -5.598 -9.219 1.00 0.00 C ATOM 2089 CD1 ILE B 49 -5.818 -3.335 -8.093 1.00 0.00 C ATOM 0 H ILE B 49 -9.777 -2.497 -8.122 1.00 0.00 H new ATOM 0 HA ILE B 49 -9.097 -3.841 -10.588 1.00 0.00 H new ATOM 0 HB ILE B 49 -8.364 -4.421 -7.691 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -6.866 -2.983 -9.917 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -7.587 -2.220 -8.514 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -6.559 -5.798 -8.638 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -8.166 -6.418 -9.088 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -7.199 -5.509 -10.274 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -5.171 -2.469 -8.232 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -6.044 -3.453 -7.033 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -5.311 -4.228 -8.458 1.00 0.00 H new ATOM 2101 N ALA B 50 -10.498 -5.882 -10.549 1.00 0.00 N ATOM 2102 CA ALA B 50 -11.414 -7.013 -10.618 1.00 0.00 C ATOM 2103 C ALA B 50 -11.112 -8.044 -9.532 1.00 0.00 C ATOM 2104 O ALA B 50 -9.947 -8.332 -9.242 1.00 0.00 O ATOM 2105 CB ALA B 50 -11.349 -7.659 -11.994 1.00 0.00 C ATOM 0 H ALA B 50 -9.984 -5.708 -11.413 1.00 0.00 H new ATOM 0 HA ALA B 50 -12.423 -6.638 -10.448 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -12.038 -8.503 -12.033 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -11.628 -6.928 -12.753 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -10.335 -8.010 -12.184 1.00 0.00 H new ATOM 2111 N PRO B 51 -12.167 -8.617 -8.923 1.00 0.00 N ATOM 2112 CA PRO B 51 -12.038 -9.606 -7.842 1.00 0.00 C ATOM 2113 C PRO B 51 -11.201 -10.817 -8.247 1.00 0.00 C ATOM 2114 O PRO B 51 -10.632 -11.500 -7.396 1.00 0.00 O ATOM 2115 CB PRO B 51 -13.485 -10.030 -7.565 1.00 0.00 C ATOM 2116 CG PRO B 51 -14.317 -8.899 -8.059 1.00 0.00 C ATOM 2117 CD PRO B 51 -13.581 -8.330 -9.237 1.00 0.00 C ATOM 0 HA PRO B 51 -11.527 -9.186 -6.976 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -13.731 -10.957 -8.083 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -13.649 -10.206 -6.502 1.00 0.00 H new ATOM 0 HG2 PRO B 51 -15.310 -9.242 -8.348 1.00 0.00 H new ATOM 0 HG3 PRO B 51 -14.453 -8.146 -7.283 1.00 0.00 H new ATOM 0 HD2 PRO B 51 -13.890 -8.801 -10.170 1.00 0.00 H new ATOM 0 HD3 PRO B 51 -13.760 -7.260 -9.345 1.00 0.00 H new ATOM 2125 N ALA B 52 -11.122 -11.055 -9.551 1.00 0.00 N ATOM 2126 CA ALA B 52 -10.400 -12.198 -10.102 1.00 0.00 C ATOM 2127 C ALA B 52 -8.953 -12.245 -9.632 1.00 0.00 C ATOM 2128 O ALA B 52 -8.470 -13.276 -9.166 1.00 0.00 O ATOM 2129 CB ALA B 52 -10.432 -12.141 -11.620 1.00 0.00 C ATOM 0 H ALA B 52 -11.557 -10.461 -10.257 1.00 0.00 H new ATOM 0 HA ALA B 52 -10.897 -13.100 -9.745 1.00 0.00 H new ATOM 0 HB1 ALA B 52 -9.892 -12.996 -12.028 1.00 0.00 H new ATOM 0 HB2 ALA B 52 -11.466 -12.168 -11.963 1.00 0.00 H new ATOM 0 HB3 ALA B 52 -9.961 -11.219 -11.959 1.00 0.00 H new ATOM 2135 N GLN B 53 -8.273 -11.115 -9.744 1.00 0.00 N ATOM 2136 CA GLN B 53 -6.833 -11.074 -9.543 1.00 0.00 C ATOM 2137 C GLN B 53 -6.433 -10.041 -8.500 1.00 0.00 C ATOM 2138 O GLN B 53 -5.269 -9.655 -8.421 1.00 0.00 O ATOM 2139 CB GLN B 53 -6.145 -10.773 -10.873 1.00 0.00 C ATOM 2140 CG GLN B 53 -6.763 -9.601 -11.617 1.00 0.00 C ATOM 2141 CD GLN B 53 -6.038 -9.286 -12.906 1.00 0.00 C ATOM 2142 OE1 GLN B 53 -6.352 -9.831 -13.960 1.00 0.00 O ATOM 2143 NE2 GLN B 53 -5.066 -8.396 -12.826 1.00 0.00 N ATOM 0 H GLN B 53 -8.694 -10.215 -9.973 1.00 0.00 H new ATOM 0 HA GLN B 53 -6.515 -12.048 -9.171 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -5.091 -10.563 -10.690 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -6.188 -11.660 -11.506 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -7.807 -9.824 -11.836 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -6.753 -8.721 -10.974 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -4.839 -7.968 -11.928 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -4.542 -8.136 -13.662 1.00 0.00 H new ATOM 2152 N ARG B 54 -7.384 -9.618 -7.678 1.00 0.00 N ATOM 2153 CA ARG B 54 -7.111 -8.584 -6.687 1.00 0.00 C ATOM 2154 C ARG B 54 -6.176 -9.090 -5.591 1.00 0.00 C ATOM 2155 O ARG B 54 -5.457 -8.309 -4.967 1.00 0.00 O ATOM 2156 CB ARG B 54 -8.410 -8.042 -6.081 1.00 0.00 C ATOM 2157 CG ARG B 54 -9.256 -9.067 -5.343 1.00 0.00 C ATOM 2158 CD ARG B 54 -10.501 -8.413 -4.763 1.00 0.00 C ATOM 2159 NE ARG B 54 -11.379 -9.367 -4.084 1.00 0.00 N ATOM 2160 CZ ARG B 54 -12.707 -9.244 -4.042 1.00 0.00 C ATOM 2161 NH1 ARG B 54 -13.297 -8.208 -4.631 1.00 0.00 N ATOM 2162 NH2 ARG B 54 -13.439 -10.149 -3.402 1.00 0.00 N ATOM 0 H ARG B 54 -8.341 -9.970 -7.676 1.00 0.00 H new ATOM 0 HA ARG B 54 -6.608 -7.766 -7.203 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -8.162 -7.235 -5.392 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -9.010 -7.606 -6.879 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -9.543 -9.868 -6.024 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -8.671 -9.522 -4.544 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -10.203 -7.636 -4.059 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -11.055 -7.923 -5.564 1.00 0.00 H new ATOM 0 HE ARG B 54 -10.953 -10.168 -3.618 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -12.734 -7.508 -5.115 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -14.312 -8.113 -4.599 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -12.986 -10.939 -2.942 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -14.454 -10.054 -3.370 1.00 0.00 H new ATOM 2176 N GLN B 55 -6.164 -10.401 -5.378 1.00 0.00 N ATOM 2177 CA GLN B 55 -5.288 -10.995 -4.379 1.00 0.00 C ATOM 2178 C GLN B 55 -3.877 -11.129 -4.939 1.00 0.00 C ATOM 2179 O GLN B 55 -2.893 -10.893 -4.237 1.00 0.00 O ATOM 2180 CB GLN B 55 -5.816 -12.361 -3.929 1.00 0.00 C ATOM 2181 CG GLN B 55 -5.009 -12.977 -2.798 1.00 0.00 C ATOM 2182 CD GLN B 55 -5.580 -14.295 -2.307 1.00 0.00 C ATOM 2183 OE1 GLN B 55 -6.892 -14.457 -2.410 1.00 0.00 O flip ATOM 2184 NE2 GLN B 55 -4.847 -15.163 -1.835 1.00 0.00 N flip ATOM 0 H GLN B 55 -6.748 -11.069 -5.882 1.00 0.00 H new ATOM 0 HA GLN B 55 -5.264 -10.340 -3.508 1.00 0.00 H new ATOM 0 HB2 GLN B 55 -6.853 -12.254 -3.610 1.00 0.00 H new ATOM 0 HB3 GLN B 55 -5.813 -13.042 -4.780 1.00 0.00 H new ATOM 0 HG2 GLN B 55 -3.985 -13.135 -3.135 1.00 0.00 H new ATOM 0 HG3 GLN B 55 -4.966 -12.274 -1.966 1.00 0.00 H new ATOM 0 HE21 GLN B 55 -3.842 -15.003 -1.772 1.00 0.00 H new ATOM 0 HE22 GLN B 55 -5.245 -16.043 -1.507 1.00 0.00 H new ATOM 2193 N ALA B 56 -3.788 -11.495 -6.215 1.00 0.00 N ATOM 2194 CA ALA B 56 -2.505 -11.590 -6.899 1.00 0.00 C ATOM 2195 C ALA B 56 -1.837 -10.223 -6.974 1.00 0.00 C ATOM 2196 O ALA B 56 -0.621 -10.110 -6.829 1.00 0.00 O ATOM 2197 CB ALA B 56 -2.685 -12.171 -8.293 1.00 0.00 C ATOM 0 H ALA B 56 -4.592 -11.731 -6.796 1.00 0.00 H new ATOM 0 HA ALA B 56 -1.860 -12.258 -6.328 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -1.716 -12.234 -8.789 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -3.120 -13.167 -8.218 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -3.348 -11.528 -8.872 1.00 0.00 H new ATOM 2203 N ILE B 57 -2.641 -9.188 -7.202 1.00 0.00 N ATOM 2204 CA ILE B 57 -2.141 -7.817 -7.208 1.00 0.00 C ATOM 2205 C ILE B 57 -1.553 -7.461 -5.846 1.00 0.00 C ATOM 2206 O ILE B 57 -0.453 -6.921 -5.757 1.00 0.00 O ATOM 2207 CB ILE B 57 -3.251 -6.801 -7.566 1.00 0.00 C ATOM 2208 CG1 ILE B 57 -3.769 -7.050 -8.986 1.00 0.00 C ATOM 2209 CG2 ILE B 57 -2.747 -5.369 -7.429 1.00 0.00 C ATOM 2210 CD1 ILE B 57 -2.699 -6.951 -10.055 1.00 0.00 C ATOM 0 H ILE B 57 -3.641 -9.273 -7.385 1.00 0.00 H new ATOM 0 HA ILE B 57 -1.366 -7.760 -7.972 1.00 0.00 H new ATOM 0 HB ILE B 57 -4.074 -6.940 -6.864 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -4.221 -8.041 -9.029 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -4.557 -6.330 -9.206 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -3.547 -4.675 -7.687 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -2.430 -5.192 -6.401 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -1.903 -5.215 -8.101 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -3.143 -7.140 -11.033 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -2.262 -5.952 -10.041 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -1.921 -7.690 -9.861 1.00 0.00 H new ATOM 2222 N ALA B 58 -2.284 -7.792 -4.789 1.00 0.00 N ATOM 2223 CA ALA B 58 -1.832 -7.518 -3.430 1.00 0.00 C ATOM 2224 C ALA B 58 -0.523 -8.241 -3.123 1.00 0.00 C ATOM 2225 O ALA B 58 0.379 -7.679 -2.504 1.00 0.00 O ATOM 2226 CB ALA B 58 -2.902 -7.923 -2.426 1.00 0.00 C ATOM 0 H ALA B 58 -3.193 -8.251 -4.846 1.00 0.00 H new ATOM 0 HA ALA B 58 -1.652 -6.446 -3.348 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.551 -7.713 -1.416 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -3.814 -7.358 -2.618 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -3.108 -8.989 -2.524 1.00 0.00 H new ATOM 2232 N ASN B 59 -0.424 -9.488 -3.565 1.00 0.00 N ATOM 2233 CA ASN B 59 0.763 -10.295 -3.310 1.00 0.00 C ATOM 2234 C ASN B 59 1.956 -9.786 -4.118 1.00 0.00 C ATOM 2235 O ASN B 59 3.061 -9.654 -3.589 1.00 0.00 O ATOM 2236 CB ASN B 59 0.495 -11.767 -3.636 1.00 0.00 C ATOM 2237 CG ASN B 59 1.666 -12.668 -3.280 1.00 0.00 C ATOM 2238 OD1 ASN B 59 2.436 -12.382 -2.362 1.00 0.00 O ATOM 2239 ND2 ASN B 59 1.805 -13.768 -4.000 1.00 0.00 N ATOM 0 H ASN B 59 -1.150 -9.963 -4.101 1.00 0.00 H new ATOM 0 HA ASN B 59 1.004 -10.209 -2.250 1.00 0.00 H new ATOM 0 HB2 ASN B 59 -0.391 -12.099 -3.096 1.00 0.00 H new ATOM 0 HB3 ASN B 59 0.276 -11.866 -4.699 1.00 0.00 H new ATOM 0 HD21 ASN B 59 2.570 -14.413 -3.803 1.00 0.00 H new ATOM 0 HD22 ASN B 59 1.147 -13.971 -4.753 1.00 0.00 H new ATOM 2246 N SER B 60 1.730 -9.487 -5.393 1.00 0.00 N ATOM 2247 CA SER B 60 2.799 -8.999 -6.256 1.00 0.00 C ATOM 2248 C SER B 60 3.267 -7.612 -5.816 1.00 0.00 C ATOM 2249 O SER B 60 4.460 -7.312 -5.858 1.00 0.00 O ATOM 2250 CB SER B 60 2.352 -8.983 -7.723 1.00 0.00 C ATOM 2251 OG SER B 60 1.116 -8.306 -7.885 1.00 0.00 O ATOM 0 H SER B 60 0.822 -9.573 -5.849 1.00 0.00 H new ATOM 0 HA SER B 60 3.642 -9.684 -6.166 1.00 0.00 H new ATOM 0 HB2 SER B 60 3.116 -8.498 -8.331 1.00 0.00 H new ATOM 0 HB3 SER B 60 2.257 -10.006 -8.086 1.00 0.00 H new ATOM 0 HG SER B 60 0.379 -8.911 -7.656 1.00 0.00 H new ATOM 2257 N PHE B 61 2.325 -6.775 -5.387 1.00 0.00 N ATOM 2258 CA PHE B 61 2.652 -5.458 -4.847 1.00 0.00 C ATOM 2259 C PHE B 61 3.543 -5.606 -3.620 1.00 0.00 C ATOM 2260 O PHE B 61 4.563 -4.928 -3.490 1.00 0.00 O ATOM 2261 CB PHE B 61 1.371 -4.697 -4.481 1.00 0.00 C ATOM 2262 CG PHE B 61 1.611 -3.316 -3.931 1.00 0.00 C ATOM 2263 CD1 PHE B 61 1.777 -2.236 -4.783 1.00 0.00 C ATOM 2264 CD2 PHE B 61 1.657 -3.097 -2.563 1.00 0.00 C ATOM 2265 CE1 PHE B 61 1.990 -0.965 -4.281 1.00 0.00 C ATOM 2266 CE2 PHE B 61 1.869 -1.829 -2.056 1.00 0.00 C ATOM 2267 CZ PHE B 61 2.035 -0.761 -2.916 1.00 0.00 C ATOM 0 H PHE B 61 1.327 -6.986 -5.403 1.00 0.00 H new ATOM 0 HA PHE B 61 3.187 -4.890 -5.608 1.00 0.00 H new ATOM 0 HB2 PHE B 61 0.742 -4.619 -5.368 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.814 -5.277 -3.745 1.00 0.00 H new ATOM 0 HD1 PHE B 61 1.740 -2.388 -5.852 1.00 0.00 H new ATOM 0 HD2 PHE B 61 1.526 -3.927 -1.885 1.00 0.00 H new ATOM 0 HE1 PHE B 61 2.121 -0.132 -4.956 1.00 0.00 H new ATOM 0 HE2 PHE B 61 1.905 -1.673 -0.988 1.00 0.00 H new ATOM 0 HZ PHE B 61 2.200 0.231 -2.522 1.00 0.00 H new ATOM 2277 N ALA B 62 3.152 -6.509 -2.730 1.00 0.00 N ATOM 2278 CA ALA B 62 3.923 -6.789 -1.527 1.00 0.00 C ATOM 2279 C ALA B 62 5.309 -7.316 -1.875 1.00 0.00 C ATOM 2280 O ALA B 62 6.308 -6.914 -1.276 1.00 0.00 O ATOM 2281 CB ALA B 62 3.180 -7.786 -0.658 1.00 0.00 C ATOM 0 H ALA B 62 2.300 -7.063 -2.820 1.00 0.00 H new ATOM 0 HA ALA B 62 4.048 -5.858 -0.974 1.00 0.00 H new ATOM 0 HB1 ALA B 62 3.763 -7.991 0.240 1.00 0.00 H new ATOM 0 HB2 ALA B 62 2.212 -7.372 -0.376 1.00 0.00 H new ATOM 0 HB3 ALA B 62 3.031 -8.712 -1.213 1.00 0.00 H new ATOM 2287 N ARG B 63 5.360 -8.223 -2.840 1.00 0.00 N ATOM 2288 CA ARG B 63 6.617 -8.778 -3.308 1.00 0.00 C ATOM 2289 C ARG B 63 7.510 -7.688 -3.895 1.00 0.00 C ATOM 2290 O ARG B 63 8.719 -7.662 -3.649 1.00 0.00 O ATOM 2291 CB ARG B 63 6.352 -9.866 -4.349 1.00 0.00 C ATOM 2292 CG ARG B 63 7.616 -10.545 -4.838 1.00 0.00 C ATOM 2293 CD ARG B 63 8.389 -11.147 -3.678 1.00 0.00 C ATOM 2294 NE ARG B 63 9.753 -11.504 -4.061 1.00 0.00 N ATOM 2295 CZ ARG B 63 10.458 -12.484 -3.495 1.00 0.00 C ATOM 2296 NH1 ARG B 63 9.937 -13.204 -2.509 1.00 0.00 N ATOM 2297 NH2 ARG B 63 11.694 -12.726 -3.907 1.00 0.00 N ATOM 0 H ARG B 63 4.536 -8.591 -3.316 1.00 0.00 H new ATOM 0 HA ARG B 63 7.137 -9.219 -2.457 1.00 0.00 H new ATOM 0 HB2 ARG B 63 5.687 -10.616 -3.920 1.00 0.00 H new ATOM 0 HB3 ARG B 63 5.831 -9.427 -5.200 1.00 0.00 H new ATOM 0 HG2 ARG B 63 7.361 -11.326 -5.555 1.00 0.00 H new ATOM 0 HG3 ARG B 63 8.242 -9.823 -5.362 1.00 0.00 H new ATOM 0 HD2 ARG B 63 8.418 -10.436 -2.853 1.00 0.00 H new ATOM 0 HD3 ARG B 63 7.869 -12.034 -3.316 1.00 0.00 H new ATOM 0 HE ARG B 63 10.194 -10.969 -4.809 1.00 0.00 H new ATOM 0 HH11 ARG B 63 8.992 -13.009 -2.180 1.00 0.00 H new ATOM 0 HH12 ARG B 63 10.482 -13.952 -2.081 1.00 0.00 H new ATOM 0 HH21 ARG B 63 12.102 -12.164 -4.654 1.00 0.00 H new ATOM 0 HH22 ARG B 63 12.237 -13.475 -3.477 1.00 0.00 H new ATOM 2311 N ALA B 64 6.909 -6.787 -4.662 1.00 0.00 N ATOM 2312 CA ALA B 64 7.638 -5.673 -5.249 1.00 0.00 C ATOM 2313 C ALA B 64 8.191 -4.762 -4.161 1.00 0.00 C ATOM 2314 O ALA B 64 9.322 -4.297 -4.246 1.00 0.00 O ATOM 2315 CB ALA B 64 6.740 -4.889 -6.197 1.00 0.00 C ATOM 0 H ALA B 64 5.915 -6.807 -4.892 1.00 0.00 H new ATOM 0 HA ALA B 64 8.476 -6.073 -5.820 1.00 0.00 H new ATOM 0 HB1 ALA B 64 7.301 -4.059 -6.627 1.00 0.00 H new ATOM 0 HB2 ALA B 64 6.393 -5.545 -6.995 1.00 0.00 H new ATOM 0 HB3 ALA B 64 5.882 -4.501 -5.648 1.00 0.00 H new ATOM 2321 N LEU B 65 7.383 -4.528 -3.134 1.00 0.00 N ATOM 2322 CA LEU B 65 7.787 -3.704 -2.000 1.00 0.00 C ATOM 2323 C LEU B 65 9.035 -4.279 -1.330 1.00 0.00 C ATOM 2324 O LEU B 65 10.011 -3.567 -1.093 1.00 0.00 O ATOM 2325 CB LEU B 65 6.641 -3.617 -0.987 1.00 0.00 C ATOM 2326 CG LEU B 65 6.905 -2.733 0.232 1.00 0.00 C ATOM 2327 CD1 LEU B 65 7.051 -1.279 -0.181 1.00 0.00 C ATOM 2328 CD2 LEU B 65 5.788 -2.888 1.250 1.00 0.00 C ATOM 0 H LEU B 65 6.436 -4.901 -3.063 1.00 0.00 H new ATOM 0 HA LEU B 65 8.023 -2.704 -2.364 1.00 0.00 H new ATOM 0 HB2 LEU B 65 5.754 -3.244 -1.499 1.00 0.00 H new ATOM 0 HB3 LEU B 65 6.409 -4.624 -0.640 1.00 0.00 H new ATOM 0 HG LEU B 65 7.840 -3.052 0.692 1.00 0.00 H new ATOM 0 HD11 LEU B 65 7.238 -0.667 0.701 1.00 0.00 H new ATOM 0 HD12 LEU B 65 7.886 -1.180 -0.875 1.00 0.00 H new ATOM 0 HD13 LEU B 65 6.134 -0.945 -0.666 1.00 0.00 H new ATOM 0 HD21 LEU B 65 5.991 -2.252 2.112 1.00 0.00 H new ATOM 0 HD22 LEU B 65 4.840 -2.595 0.798 1.00 0.00 H new ATOM 0 HD23 LEU B 65 5.731 -3.928 1.572 1.00 0.00 H new ATOM 2340 N GLN B 66 9.004 -5.579 -1.058 1.00 0.00 N ATOM 2341 CA GLN B 66 10.115 -6.256 -0.391 1.00 0.00 C ATOM 2342 C GLN B 66 11.371 -6.273 -1.260 1.00 0.00 C ATOM 2343 O GLN B 66 12.485 -6.379 -0.753 1.00 0.00 O ATOM 2344 CB GLN B 66 9.720 -7.690 -0.026 1.00 0.00 C ATOM 2345 CG GLN B 66 8.640 -7.776 1.040 1.00 0.00 C ATOM 2346 CD GLN B 66 8.241 -9.204 1.357 1.00 0.00 C ATOM 2347 OE1 GLN B 66 9.045 -10.132 1.232 1.00 0.00 O ATOM 2348 NE2 GLN B 66 6.999 -9.393 1.774 1.00 0.00 N ATOM 0 H GLN B 66 8.220 -6.189 -1.289 1.00 0.00 H new ATOM 0 HA GLN B 66 10.341 -5.697 0.517 1.00 0.00 H new ATOM 0 HB2 GLN B 66 9.373 -8.201 -0.924 1.00 0.00 H new ATOM 0 HB3 GLN B 66 10.605 -8.223 0.322 1.00 0.00 H new ATOM 0 HG2 GLN B 66 8.995 -7.292 1.950 1.00 0.00 H new ATOM 0 HG3 GLN B 66 7.762 -7.223 0.706 1.00 0.00 H new ATOM 0 HE21 GLN B 66 6.365 -8.599 1.864 1.00 0.00 H new ATOM 0 HE22 GLN B 66 6.676 -10.332 2.005 1.00 0.00 H new ATOM 2357 N SER B 67 11.188 -6.166 -2.570 1.00 0.00 N ATOM 2358 CA SER B 67 12.311 -6.196 -3.497 1.00 0.00 C ATOM 2359 C SER B 67 12.751 -4.781 -3.866 1.00 0.00 C ATOM 2360 O SER B 67 13.773 -4.584 -4.528 1.00 0.00 O ATOM 2361 CB SER B 67 11.922 -6.977 -4.749 1.00 0.00 C ATOM 2362 OG SER B 67 11.386 -8.244 -4.400 1.00 0.00 O ATOM 0 H SER B 67 10.276 -6.058 -3.013 1.00 0.00 H new ATOM 0 HA SER B 67 13.152 -6.692 -3.012 1.00 0.00 H new ATOM 0 HB2 SER B 67 11.189 -6.412 -5.324 1.00 0.00 H new ATOM 0 HB3 SER B 67 12.795 -7.109 -5.388 1.00 0.00 H new ATOM 0 HG SER B 67 10.448 -8.141 -4.136 1.00 0.00 H new ATOM 2368 N SER B 68 11.968 -3.802 -3.439 1.00 0.00 N ATOM 2369 CA SER B 68 12.280 -2.405 -3.689 1.00 0.00 C ATOM 2370 C SER B 68 13.085 -1.843 -2.519 1.00 0.00 C ATOM 2371 O SER B 68 13.887 -0.921 -2.681 1.00 0.00 O ATOM 2372 CB SER B 68 10.985 -1.611 -3.897 1.00 0.00 C ATOM 2373 OG SER B 68 11.243 -0.302 -4.383 1.00 0.00 O ATOM 0 H SER B 68 11.106 -3.952 -2.914 1.00 0.00 H new ATOM 0 HA SER B 68 12.881 -2.320 -4.595 1.00 0.00 H new ATOM 0 HB2 SER B 68 10.343 -2.140 -4.601 1.00 0.00 H new ATOM 0 HB3 SER B 68 10.441 -1.548 -2.954 1.00 0.00 H new ATOM 0 HG SER B 68 10.395 0.175 -4.505 1.00 0.00 H new ATOM 2379 N ILE B 69 12.867 -2.413 -1.340 1.00 0.00 N ATOM 2380 CA ILE B 69 13.612 -2.027 -0.152 1.00 0.00 C ATOM 2381 C ILE B 69 14.856 -2.895 -0.014 1.00 0.00 C ATOM 2382 O ILE B 69 14.762 -4.109 0.161 1.00 0.00 O ATOM 2383 CB ILE B 69 12.751 -2.161 1.124 1.00 0.00 C ATOM 2384 CG1 ILE B 69 11.468 -1.334 0.991 1.00 0.00 C ATOM 2385 CG2 ILE B 69 13.542 -1.728 2.351 1.00 0.00 C ATOM 2386 CD1 ILE B 69 10.503 -1.509 2.144 1.00 0.00 C ATOM 0 H ILE B 69 12.177 -3.147 -1.183 1.00 0.00 H new ATOM 0 HA ILE B 69 13.899 -0.981 -0.265 1.00 0.00 H new ATOM 0 HB ILE B 69 12.476 -3.208 1.247 1.00 0.00 H new ATOM 0 HG12 ILE B 69 11.734 -0.280 0.909 1.00 0.00 H new ATOM 0 HG13 ILE B 69 10.965 -1.609 0.064 1.00 0.00 H new ATOM 0 HG21 ILE B 69 12.919 -1.829 3.240 1.00 0.00 H new ATOM 0 HG22 ILE B 69 14.427 -2.357 2.454 1.00 0.00 H new ATOM 0 HG23 ILE B 69 13.847 -0.688 2.239 1.00 0.00 H new ATOM 0 HD11 ILE B 69 9.620 -0.892 1.977 1.00 0.00 H new ATOM 0 HD12 ILE B 69 10.206 -2.555 2.214 1.00 0.00 H new ATOM 0 HD13 ILE B 69 10.987 -1.206 3.073 1.00 0.00 H new ATOM 2398 N ASN B 70 16.022 -2.273 -0.104 1.00 0.00 N ATOM 2399 CA ASN B 70 17.277 -3.007 -0.022 1.00 0.00 C ATOM 2400 C ASN B 70 17.629 -3.323 1.432 1.00 0.00 C ATOM 2401 O ASN B 70 17.455 -2.491 2.326 1.00 0.00 O ATOM 2402 CB ASN B 70 18.419 -2.232 -0.698 1.00 0.00 C ATOM 2403 CG ASN B 70 18.713 -0.896 -0.039 1.00 0.00 C ATOM 2404 OD1 ASN B 70 19.497 -0.821 0.905 1.00 0.00 O ATOM 2405 ND2 ASN B 70 18.114 0.173 -0.550 1.00 0.00 N ATOM 0 H ASN B 70 16.126 -1.267 -0.233 1.00 0.00 H new ATOM 0 HA ASN B 70 17.146 -3.948 -0.556 1.00 0.00 H new ATOM 0 HB2 ASN B 70 19.322 -2.843 -0.683 1.00 0.00 H new ATOM 0 HB3 ASN B 70 18.165 -2.065 -1.745 1.00 0.00 H new ATOM 0 HD21 ASN B 70 18.298 1.097 -0.159 1.00 0.00 H new ATOM 0 HD22 ASN B 70 17.469 0.071 -1.334 1.00 0.00 H new ATOM 2412 N GLU B 71 18.113 -4.536 1.658 1.00 0.00 N ATOM 2413 CA GLU B 71 18.468 -4.990 2.995 1.00 0.00 C ATOM 2414 C GLU B 71 19.870 -4.522 3.378 1.00 0.00 C ATOM 2415 O GLU B 71 20.709 -4.271 2.510 1.00 0.00 O ATOM 2416 CB GLU B 71 18.360 -6.517 3.074 1.00 0.00 C ATOM 2417 CG GLU B 71 19.058 -7.237 1.931 1.00 0.00 C ATOM 2418 CD GLU B 71 18.761 -8.721 1.909 1.00 0.00 C ATOM 2419 OE1 GLU B 71 17.686 -9.109 1.410 1.00 0.00 O ATOM 2420 OE2 GLU B 71 19.606 -9.509 2.375 1.00 0.00 O ATOM 0 H GLU B 71 18.270 -5.229 0.926 1.00 0.00 H new ATOM 0 HA GLU B 71 17.769 -4.553 3.708 1.00 0.00 H new ATOM 0 HB2 GLU B 71 18.786 -6.855 4.019 1.00 0.00 H new ATOM 0 HB3 GLU B 71 17.307 -6.798 3.080 1.00 0.00 H new ATOM 0 HG2 GLU B 71 18.748 -6.794 0.984 1.00 0.00 H new ATOM 0 HG3 GLU B 71 20.134 -7.087 2.016 1.00 0.00 H new ATOM 2427 N ASP B 72 20.112 -4.393 4.676 1.00 0.00 N ATOM 2428 CA ASP B 72 21.402 -3.926 5.176 1.00 0.00 C ATOM 2429 C ASP B 72 22.220 -5.114 5.672 1.00 0.00 C ATOM 2430 O ASP B 72 21.658 -6.106 6.139 1.00 0.00 O ATOM 2431 CB ASP B 72 21.192 -2.917 6.312 1.00 0.00 C ATOM 2432 CG ASP B 72 22.375 -1.986 6.502 1.00 0.00 C ATOM 2433 OD1 ASP B 72 23.500 -2.470 6.740 1.00 0.00 O ATOM 2434 OD2 ASP B 72 22.183 -0.754 6.407 1.00 0.00 O ATOM 0 H ASP B 72 19.431 -4.605 5.405 1.00 0.00 H new ATOM 0 HA ASP B 72 21.943 -3.433 4.368 1.00 0.00 H new ATOM 0 HB2 ASP B 72 20.300 -2.325 6.105 1.00 0.00 H new ATOM 0 HB3 ASP B 72 21.008 -3.457 7.241 1.00 0.00 H new ATOM 2439 N LYS B 73 23.539 -5.025 5.572 1.00 0.00 N ATOM 2440 CA LYS B 73 24.393 -6.138 5.957 1.00 0.00 C ATOM 2441 C LYS B 73 25.241 -5.802 7.182 1.00 0.00 C ATOM 2442 O LYS B 73 24.712 -5.697 8.290 1.00 0.00 O ATOM 2443 CB LYS B 73 25.270 -6.591 4.786 1.00 0.00 C ATOM 2444 CG LYS B 73 24.485 -7.267 3.673 1.00 0.00 C ATOM 2445 CD LYS B 73 23.686 -8.446 4.208 1.00 0.00 C ATOM 2446 CE LYS B 73 22.932 -9.172 3.105 1.00 0.00 C ATOM 2447 NZ LYS B 73 23.855 -9.745 2.094 1.00 0.00 N ATOM 0 H LYS B 73 24.036 -4.202 5.231 1.00 0.00 H new ATOM 0 HA LYS B 73 23.742 -6.968 6.231 1.00 0.00 H new ATOM 0 HB2 LYS B 73 25.794 -5.727 4.378 1.00 0.00 H new ATOM 0 HB3 LYS B 73 26.030 -7.280 5.155 1.00 0.00 H new ATOM 0 HG2 LYS B 73 23.811 -6.547 3.209 1.00 0.00 H new ATOM 0 HG3 LYS B 73 25.169 -7.609 2.896 1.00 0.00 H new ATOM 0 HD2 LYS B 73 24.359 -9.144 4.706 1.00 0.00 H new ATOM 0 HD3 LYS B 73 22.979 -8.094 4.959 1.00 0.00 H new ATOM 0 HE2 LYS B 73 22.329 -9.969 3.540 1.00 0.00 H new ATOM 0 HE3 LYS B 73 22.244 -8.481 2.619 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 23.335 -10.410 1.487 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 24.249 -8.980 1.511 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 24.628 -10.247 2.575 1.00 0.00 H new ATOM 2461 N ALA B 74 26.543 -5.615 6.991 1.00 0.00 N ATOM 2462 CA ALA B 74 27.442 -5.418 8.123 1.00 0.00 C ATOM 2463 C ALA B 74 28.758 -4.767 7.708 1.00 0.00 C ATOM 2464 O ALA B 74 29.188 -3.788 8.317 1.00 0.00 O ATOM 2465 CB ALA B 74 27.712 -6.748 8.810 1.00 0.00 C ATOM 0 H ALA B 74 26.995 -5.596 6.077 1.00 0.00 H new ATOM 0 HA ALA B 74 26.948 -4.739 8.818 1.00 0.00 H new ATOM 0 HB1 ALA B 74 28.384 -6.592 9.654 1.00 0.00 H new ATOM 0 HB2 ALA B 74 26.773 -7.170 9.167 1.00 0.00 H new ATOM 0 HB3 ALA B 74 28.173 -7.436 8.102 1.00 0.00 H new ATOM 2471 N HIS B 75 29.407 -5.321 6.692 1.00 0.00 N ATOM 2472 CA HIS B 75 30.705 -4.816 6.261 1.00 0.00 C ATOM 2473 C HIS B 75 30.572 -3.652 5.295 1.00 0.00 C ATOM 2474 O HIS B 75 30.112 -3.814 4.164 1.00 0.00 O ATOM 2475 CB HIS B 75 31.542 -5.921 5.612 1.00 0.00 C ATOM 2476 CG HIS B 75 32.322 -6.746 6.588 1.00 0.00 C ATOM 2477 ND1 HIS B 75 33.695 -6.840 6.560 1.00 0.00 N ATOM 2478 CD2 HIS B 75 31.915 -7.525 7.615 1.00 0.00 C ATOM 2479 CE1 HIS B 75 34.097 -7.644 7.527 1.00 0.00 C ATOM 2480 NE2 HIS B 75 33.036 -8.073 8.183 1.00 0.00 N ATOM 0 H HIS B 75 29.059 -6.115 6.154 1.00 0.00 H new ATOM 0 HA HIS B 75 31.211 -4.462 7.159 1.00 0.00 H new ATOM 0 HB2 HIS B 75 30.882 -6.576 5.044 1.00 0.00 H new ATOM 0 HB3 HIS B 75 32.233 -5.469 4.900 1.00 0.00 H new ATOM 0 HD2 HIS B 75 30.895 -7.686 7.930 1.00 0.00 H new ATOM 0 HE1 HIS B 75 35.122 -7.906 7.744 1.00 0.00 H new ATOM 0 HE2 HIS B 75 33.048 -8.708 8.981 1.00 0.00 H new ATOM 2489 N LEU B 76 30.966 -2.477 5.755 1.00 0.00 N ATOM 2490 CA LEU B 76 31.115 -1.332 4.878 1.00 0.00 C ATOM 2491 C LEU B 76 32.563 -1.257 4.436 1.00 0.00 C ATOM 2492 O LEU B 76 33.442 -0.896 5.223 1.00 0.00 O ATOM 2493 CB LEU B 76 30.704 -0.023 5.566 1.00 0.00 C ATOM 2494 CG LEU B 76 29.198 0.185 5.758 1.00 0.00 C ATOM 2495 CD1 LEU B 76 28.640 -0.773 6.797 1.00 0.00 C ATOM 2496 CD2 LEU B 76 28.913 1.625 6.153 1.00 0.00 C ATOM 0 H LEU B 76 31.189 -2.292 6.733 1.00 0.00 H new ATOM 0 HA LEU B 76 30.456 -1.459 4.019 1.00 0.00 H new ATOM 0 HB2 LEU B 76 31.185 0.018 6.543 1.00 0.00 H new ATOM 0 HB3 LEU B 76 31.095 0.810 4.983 1.00 0.00 H new ATOM 0 HG LEU B 76 28.702 -0.025 4.810 1.00 0.00 H new ATOM 0 HD11 LEU B 76 27.570 -0.602 6.912 1.00 0.00 H new ATOM 0 HD12 LEU B 76 28.811 -1.800 6.474 1.00 0.00 H new ATOM 0 HD13 LEU B 76 29.139 -0.605 7.752 1.00 0.00 H new ATOM 0 HD21 LEU B 76 27.840 1.760 6.286 1.00 0.00 H new ATOM 0 HD22 LEU B 76 29.426 1.855 7.087 1.00 0.00 H new ATOM 0 HD23 LEU B 76 29.268 2.294 5.369 1.00 0.00 H new ATOM 2508 N GLU B 77 32.805 -1.632 3.188 1.00 0.00 N ATOM 2509 CA GLU B 77 34.159 -1.733 2.661 1.00 0.00 C ATOM 2510 C GLU B 77 34.913 -0.418 2.808 1.00 0.00 C ATOM 2511 O GLU B 77 36.105 -0.425 3.114 1.00 0.00 O ATOM 2512 CB GLU B 77 34.127 -2.186 1.200 1.00 0.00 C ATOM 2513 CG GLU B 77 33.488 -3.553 1.026 1.00 0.00 C ATOM 2514 CD GLU B 77 33.542 -4.059 -0.397 1.00 0.00 C ATOM 2515 OE1 GLU B 77 34.602 -4.574 -0.808 1.00 0.00 O ATOM 2516 OE2 GLU B 77 32.520 -3.959 -1.108 1.00 0.00 O ATOM 0 H GLU B 77 32.076 -1.873 2.517 1.00 0.00 H new ATOM 0 HA GLU B 77 34.695 -2.482 3.245 1.00 0.00 H new ATOM 0 HB2 GLU B 77 33.577 -1.454 0.609 1.00 0.00 H new ATOM 0 HB3 GLU B 77 35.144 -2.212 0.809 1.00 0.00 H new ATOM 0 HG2 GLU B 77 33.991 -4.267 1.678 1.00 0.00 H new ATOM 0 HG3 GLU B 77 32.448 -3.504 1.348 1.00 0.00 H new ATOM 2523 N HIS B 78 34.202 0.696 2.602 1.00 0.00 N ATOM 2524 CA HIS B 78 34.749 2.044 2.786 1.00 0.00 C ATOM 2525 C HIS B 78 35.904 2.300 1.815 1.00 0.00 C ATOM 2526 O HIS B 78 35.719 2.934 0.779 1.00 0.00 O ATOM 2527 CB HIS B 78 35.196 2.249 4.242 1.00 0.00 C ATOM 2528 CG HIS B 78 35.433 3.680 4.613 1.00 0.00 C ATOM 2529 ND1 HIS B 78 34.578 4.400 5.420 1.00 0.00 N ATOM 2530 CD2 HIS B 78 36.440 4.525 4.291 1.00 0.00 C ATOM 2531 CE1 HIS B 78 35.049 5.623 5.573 1.00 0.00 C ATOM 2532 NE2 HIS B 78 36.178 5.726 4.898 1.00 0.00 N ATOM 0 H HIS B 78 33.227 0.688 2.302 1.00 0.00 H new ATOM 0 HA HIS B 78 33.963 2.767 2.567 1.00 0.00 H new ATOM 0 HB2 HIS B 78 34.438 1.834 4.906 1.00 0.00 H new ATOM 0 HB3 HIS B 78 36.112 1.684 4.412 1.00 0.00 H new ATOM 0 HD2 HIS B 78 37.293 4.295 3.670 1.00 0.00 H new ATOM 0 HE1 HIS B 78 34.588 6.408 6.154 1.00 0.00 H new ATOM 0 HE2 HIS B 78 36.760 6.562 4.838 1.00 0.00 H new ATOM 2541 N HIS B 79 37.089 1.816 2.156 1.00 0.00 N ATOM 2542 CA HIS B 79 38.207 1.828 1.232 1.00 0.00 C ATOM 2543 C HIS B 79 38.188 0.505 0.482 1.00 0.00 C ATOM 2544 O HIS B 79 38.594 -0.525 1.019 1.00 0.00 O ATOM 2545 CB HIS B 79 39.528 2.009 1.985 1.00 0.00 C ATOM 2546 CG HIS B 79 40.600 2.677 1.181 1.00 0.00 C ATOM 2547 ND1 HIS B 79 41.885 2.190 1.077 1.00 0.00 N ATOM 2548 CD2 HIS B 79 40.578 3.825 0.464 1.00 0.00 C ATOM 2549 CE1 HIS B 79 42.606 3.013 0.335 1.00 0.00 C ATOM 2550 NE2 HIS B 79 41.836 4.013 -0.049 1.00 0.00 N ATOM 0 H HIS B 79 37.299 1.410 3.068 1.00 0.00 H new ATOM 0 HA HIS B 79 38.120 2.661 0.535 1.00 0.00 H new ATOM 0 HB2 HIS B 79 39.344 2.596 2.885 1.00 0.00 H new ATOM 0 HB3 HIS B 79 39.887 1.032 2.309 1.00 0.00 H new ATOM 0 HD2 HIS B 79 39.726 4.474 0.322 1.00 0.00 H new ATOM 0 HE1 HIS B 79 43.649 2.888 0.085 1.00 0.00 H new ATOM 0 HE2 HIS B 79 42.128 4.797 -0.632 1.00 0.00 H new ATOM 2559 N HIS B 80 37.695 0.539 -0.750 1.00 0.00 N ATOM 2560 CA HIS B 80 37.302 -0.674 -1.474 1.00 0.00 C ATOM 2561 C HIS B 80 38.502 -1.474 -2.003 1.00 0.00 C ATOM 2562 O HIS B 80 38.397 -2.136 -3.036 1.00 0.00 O ATOM 2563 CB HIS B 80 36.381 -0.290 -2.638 1.00 0.00 C ATOM 2564 CG HIS B 80 35.424 -1.370 -3.041 1.00 0.00 C ATOM 2565 ND1 HIS B 80 35.776 -2.441 -3.833 1.00 0.00 N ATOM 2566 CD2 HIS B 80 34.117 -1.542 -2.747 1.00 0.00 C ATOM 2567 CE1 HIS B 80 34.727 -3.219 -4.009 1.00 0.00 C ATOM 2568 NE2 HIS B 80 33.707 -2.698 -3.360 1.00 0.00 N ATOM 0 H HIS B 80 37.555 1.401 -1.277 1.00 0.00 H new ATOM 0 HA HIS B 80 36.782 -1.320 -0.767 1.00 0.00 H new ATOM 0 HB2 HIS B 80 35.814 0.599 -2.361 1.00 0.00 H new ATOM 0 HB3 HIS B 80 36.993 -0.022 -3.499 1.00 0.00 H new ATOM 0 HD1 HIS B 80 36.704 -2.606 -4.223 1.00 0.00 H new ATOM 0 HD2 HIS B 80 33.507 -0.889 -2.141 1.00 0.00 H new ATOM 0 HE1 HIS B 80 34.707 -4.130 -4.588 1.00 0.00 H new ATOM 2577 N HIS B 81 39.620 -1.439 -1.278 1.00 0.00 N ATOM 2578 CA HIS B 81 40.821 -2.197 -1.642 1.00 0.00 C ATOM 2579 C HIS B 81 41.396 -1.724 -2.974 1.00 0.00 C ATOM 2580 O HIS B 81 40.833 -0.850 -3.637 1.00 0.00 O ATOM 2581 CB HIS B 81 40.523 -3.701 -1.719 1.00 0.00 C ATOM 2582 CG HIS B 81 40.313 -4.374 -0.392 1.00 0.00 C ATOM 2583 ND1 HIS B 81 40.731 -5.660 -0.141 1.00 0.00 N ATOM 2584 CD2 HIS B 81 39.714 -3.948 0.747 1.00 0.00 C ATOM 2585 CE1 HIS B 81 40.399 -6.001 1.088 1.00 0.00 C ATOM 2586 NE2 HIS B 81 39.782 -4.981 1.650 1.00 0.00 N ATOM 0 H HIS B 81 39.721 -0.888 -0.426 1.00 0.00 H new ATOM 0 HA HIS B 81 41.559 -2.020 -0.860 1.00 0.00 H new ATOM 0 HB2 HIS B 81 39.632 -3.849 -2.330 1.00 0.00 H new ATOM 0 HB3 HIS B 81 41.348 -4.194 -2.233 1.00 0.00 H new ATOM 0 HD2 HIS B 81 39.267 -2.979 0.913 1.00 0.00 H new ATOM 0 HE1 HIS B 81 40.599 -6.954 1.555 1.00 0.00 H new ATOM 0 HE2 HIS B 81 39.415 -4.962 2.601 1.00 0.00 H new ATOM 2595 N HIS B 82 42.532 -2.283 -3.351 1.00 0.00 N ATOM 2596 CA HIS B 82 43.108 -2.013 -4.657 1.00 0.00 C ATOM 2597 C HIS B 82 42.922 -3.237 -5.539 1.00 0.00 C ATOM 2598 O HIS B 82 43.037 -3.171 -6.759 1.00 0.00 O ATOM 2599 CB HIS B 82 44.593 -1.658 -4.538 1.00 0.00 C ATOM 2600 CG HIS B 82 45.146 -0.972 -5.752 1.00 0.00 C ATOM 2601 ND1 HIS B 82 45.262 0.396 -5.846 1.00 0.00 N ATOM 2602 CD2 HIS B 82 45.613 -1.467 -6.924 1.00 0.00 C ATOM 2603 CE1 HIS B 82 45.773 0.716 -7.019 1.00 0.00 C ATOM 2604 NE2 HIS B 82 45.995 -0.395 -7.692 1.00 0.00 N ATOM 0 H HIS B 82 43.073 -2.926 -2.773 1.00 0.00 H new ATOM 0 HA HIS B 82 42.600 -1.158 -5.103 1.00 0.00 H new ATOM 0 HB2 HIS B 82 44.735 -1.014 -3.670 1.00 0.00 H new ATOM 0 HB3 HIS B 82 45.162 -2.569 -4.355 1.00 0.00 H new ATOM 0 HD2 HIS B 82 45.673 -2.509 -7.202 1.00 0.00 H new ATOM 0 HE1 HIS B 82 45.975 1.718 -7.368 1.00 0.00 H new ATOM 0 HE2 HIS B 82 46.387 -0.450 -8.632 1.00 0.00 H new ATOM 2613 N HIS B 83 42.635 -4.357 -4.897 1.00 0.00 N ATOM 2614 CA HIS B 83 42.363 -5.596 -5.599 1.00 0.00 C ATOM 2615 C HIS B 83 40.888 -5.942 -5.459 1.00 0.00 C ATOM 2616 O HIS B 83 40.515 -6.539 -4.428 1.00 0.00 O ATOM 2617 CB HIS B 83 43.228 -6.729 -5.041 1.00 0.00 C ATOM 2618 CG HIS B 83 43.122 -8.013 -5.810 1.00 0.00 C ATOM 2619 ND1 HIS B 83 42.185 -8.986 -5.536 1.00 0.00 N ATOM 2620 CD2 HIS B 83 43.856 -8.482 -6.845 1.00 0.00 C ATOM 2621 CE1 HIS B 83 42.350 -9.997 -6.368 1.00 0.00 C ATOM 2622 NE2 HIS B 83 43.355 -9.716 -7.171 1.00 0.00 N ATOM 2623 OXT HIS B 83 40.110 -5.605 -6.372 1.00 0.00 O ATOM 0 H HIS B 83 42.585 -4.431 -3.881 1.00 0.00 H new ATOM 0 HA HIS B 83 42.606 -5.469 -6.654 1.00 0.00 H new ATOM 0 HB2 HIS B 83 44.269 -6.407 -5.033 1.00 0.00 H new ATOM 0 HB3 HIS B 83 42.943 -6.913 -4.005 1.00 0.00 H new ATOM 0 HD2 HIS B 83 44.682 -7.979 -7.325 1.00 0.00 H new ATOM 0 HE1 HIS B 83 41.760 -10.902 -6.387 1.00 0.00 H new ATOM 0 HE2 HIS B 83 43.705 -10.319 -7.916 1.00 0.00 H new TER 2632 HIS B 83