USER MOD reduce.3.24.130724 H: found=0, std=0, add=1450, rem=0, adj=55 USER MOD reduce.3.24.130724 removed 1453 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: B 24 CYS SG : rot 150:sc= -1.22 USER MOD Set 1.2: B 41 HIS : no HE2:sc= -5.93! C(o=-7.2!,f=-12!) USER MOD Set 2.1: A 67 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: B 53 THR OG1 : rot 60:sc= -0.141 USER MOD Set 2.3: B 55 HIS : no HE2:sc= -2.19! C(o=-2.3!,f=-5.8!) USER MOD Set 3.1: A 55 HIS : no HE2:sc= -0.558 K(o=-1.1,f=-2.8) USER MOD Set 3.2: A 88 SER OG : rot 116:sc= -0.535 USER MOD Set 4.1: A 43 LYS NZ :NH3+ 162:sc= -0.0673 (180deg=-0.726) USER MOD Set 4.2: A 53 THR OG1 : rot -110:sc= -0.031 USER MOD Set 4.3: B 67 THR OG1 : rot 135:sc= 0.0938 USER MOD Set 5.1: A 14 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 17 MET CE :methyl -165:sc= 0 (180deg=-0.077) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= -0.4 K(o=-0.4,f=-2.9) USER MOD Single : A 13 MET CE :methyl 144:sc= -2.14! (180deg=-2.31!) USER MOD Single : A 18 GLN : amide:sc= -2.19! K(o=-2.2!,f=-1.3) USER MOD Single : A 19 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.18) USER MOD Single : A 21 SER OG : rot -85:sc= 0.0178 USER MOD Single : A 24 CYS SG : rot 73:sc= -0.166 USER MOD Single : A 26 THR OG1 : rot 68:sc= -1.52! USER MOD Single : A 27 GLN : amide:sc= -0.529 K(o=-0.53,f=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -0.658 X(o=-0.66,f=-0.63) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HE2:sc= -9.22! C(o=-9.2!,f=-18!) USER MOD Single : A 44 LYS NZ :NH3+ 132:sc=-0.00497 (180deg=-0.488) USER MOD Single : A 48 LYS NZ :NH3+ 169:sc=-0.00892 (180deg=-0.194) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= -1.65 X(o=-1.6,f=-1.4) USER MOD Single : A 56 CYS SG : rot 35:sc= -2.92 USER MOD Single : A 61 ASN : amide:sc= -3.57 K(o=-3.6,f=-5.2!) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HE2:sc= -4.62! K(o=-4.6!,f=-5.2) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 166:sc= -0.0457 (180deg=-0.29) USER MOD Single : A 72 HIS : no HE2:sc= -4.4! C(o=-4.4!,f=-13!) USER MOD Single : A 75 TYR OH : rot 150:sc= -4.92! USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -0.573 K(o=-0.57,f=0) USER MOD Single : A 87 LYS NZ :NH3+ 155:sc= -2.01! (180deg=-3.67!) USER MOD Single : B 9 LYS NZ :NH3+ 135:sc= -0.0267 (180deg=-0.233) USER MOD Single : B 10 ASN : amide:sc= -4.44! C(o=-4.4!,f=-8.1!) USER MOD Single : B 13 MET CE :methyl 144:sc= -4.91! (180deg=-5.22!) USER MOD Single : B 14 SER OG : rot 117:sc= 0.00131 USER MOD Single : B 17 MET CE :methyl -132:sc= -3.35 (180deg=-7.69!) USER MOD Single : B 18 GLN : amide:sc= -4.15! K(o=-4.2!,f=-1.9) USER MOD Single : B 19 GLN : amide:sc= -0.778 K(o=-0.78,f=-0.0025) USER MOD Single : B 21 SER OG : rot -160:sc= -0.697 USER MOD Single : B 26 THR OG1 : rot 68:sc= 0.293 USER MOD Single : B 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 ASN : amide:sc= -1.66! K(o=-1.7!,f=0.25) USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 LYS NZ :NH3+ -131:sc= -3.87! (180deg=-7.65!) USER MOD Single : B 44 LYS NZ :NH3+ -167:sc= -0.0275 (180deg=-0.226) USER MOD Single : B 48 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0649) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 TYR OH : rot 180:sc= 0 USER MOD Single : B 51 ASN : amide:sc= -1.58 X(o=-1.6,f=-1.2) USER MOD Single : B 56 CYS SG : rot 36:sc= -1.76 USER MOD Single : B 61 ASN : amide:sc= -1.85 K(o=-1.9,f=-0.22) USER MOD Single : B 64 SER OG : rot -140:sc= -0.0112 USER MOD Single : B 65 TYR OH : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HE2:sc= -3.77 K(o=-3.8,f=-7.6!) USER MOD Single : B 70 THR OG1 : rot 180:sc= 0 USER MOD Single : B 71 LYS NZ :NH3+ -162:sc= -0.0906 (180deg=-0.409) USER MOD Single : B 72 HIS : no HD1:sc= -4.98! C(o=-5!,f=-5!) USER MOD Single : B 75 TYR OH : rot -130:sc= -5.98! USER MOD Single : B 77 TYR OH : rot 0:sc= -2.34 USER MOD Single : B 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 88 SER OG : rot 180:sc= 0 USER MOD Single : C 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 1 MET N :NH3+ 165:sc= 0.0176 (180deg=-0.271) USER MOD Single : C 2 LYS NZ :NH3+ 166:sc= -0.0566 (180deg=-0.291) USER MOD Single : C 4 THR OG1 : rot 129:sc= 0.582 USER MOD Single : C 7 GLN : amide:sc= -4.3 K(o=-4.3,f=-14!) USER MOD Single : D 4 THR OG1 : rot 114:sc= 0.945 USER MOD Single : D 7 GLN : amide:sc= -1.19 K(o=-1.2,f=0) USER MOD ----------------------------------------------------------------- ATOM 89 N ALA A 6 -13.670 -6.059 -13.123 1.00 0.00 N ATOM 90 CA ALA A 6 -12.598 -6.186 -12.141 1.00 0.00 C ATOM 91 C ALA A 6 -12.620 -7.564 -11.485 1.00 0.00 C ATOM 92 O ALA A 6 -13.639 -7.983 -10.938 1.00 0.00 O ATOM 93 CB ALA A 6 -12.712 -5.093 -11.089 1.00 0.00 C ATOM 0 HA ALA A 6 -11.646 -6.074 -12.659 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -11.906 -5.201 -10.363 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -12.640 -4.117 -11.569 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -13.672 -5.177 -10.580 1.00 0.00 H new ATOM 99 N VAL A 7 -11.494 -8.270 -11.542 1.00 0.00 N ATOM 100 CA VAL A 7 -11.408 -9.594 -10.954 1.00 0.00 C ATOM 101 C VAL A 7 -11.141 -9.535 -9.457 1.00 0.00 C ATOM 102 O VAL A 7 -10.309 -8.761 -8.990 1.00 0.00 O ATOM 103 CB VAL A 7 -10.313 -10.432 -11.621 1.00 0.00 C ATOM 104 CG1 VAL A 7 -10.649 -10.693 -13.081 1.00 0.00 C ATOM 105 CG2 VAL A 7 -8.960 -9.753 -11.489 1.00 0.00 C ATOM 0 H VAL A 7 -10.636 -7.946 -11.988 1.00 0.00 H new ATOM 0 HA VAL A 7 -12.377 -10.065 -11.121 1.00 0.00 H new ATOM 0 HB VAL A 7 -10.260 -11.393 -11.109 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -9.858 -11.290 -13.535 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -11.594 -11.233 -13.146 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -10.736 -9.744 -13.610 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -8.197 -10.365 -11.970 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -8.995 -8.775 -11.969 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -8.716 -9.631 -10.434 1.00 0.00 H new ATOM 115 N ILE A 8 -11.852 -10.374 -8.715 1.00 0.00 N ATOM 116 CA ILE A 8 -11.701 -10.441 -7.265 1.00 0.00 C ATOM 117 C ILE A 8 -10.635 -11.462 -6.881 1.00 0.00 C ATOM 118 O ILE A 8 -10.495 -12.498 -7.528 1.00 0.00 O ATOM 119 CB ILE A 8 -13.035 -10.801 -6.570 1.00 0.00 C ATOM 120 CG1 ILE A 8 -14.077 -9.703 -6.802 1.00 0.00 C ATOM 121 CG2 ILE A 8 -12.822 -11.020 -5.077 1.00 0.00 C ATOM 122 CD1 ILE A 8 -14.453 -9.511 -8.255 1.00 0.00 C ATOM 0 H ILE A 8 -12.543 -11.021 -9.095 1.00 0.00 H new ATOM 0 HA ILE A 8 -11.392 -9.452 -6.927 1.00 0.00 H new ATOM 0 HB ILE A 8 -13.405 -11.729 -7.006 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -14.975 -9.942 -6.233 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -13.692 -8.762 -6.409 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -13.773 -11.272 -4.607 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -12.115 -11.836 -4.926 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -12.426 -10.109 -4.628 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -15.195 -8.717 -8.337 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -13.566 -9.240 -8.828 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -14.869 -10.438 -8.649 1.00 0.00 H new ATOM 134 N LYS A 9 -9.883 -11.160 -5.827 1.00 0.00 N ATOM 135 CA LYS A 9 -8.829 -12.057 -5.367 1.00 0.00 C ATOM 136 C LYS A 9 -8.835 -12.197 -3.847 1.00 0.00 C ATOM 137 O LYS A 9 -8.681 -13.298 -3.319 1.00 0.00 O ATOM 138 CB LYS A 9 -7.462 -11.555 -5.837 1.00 0.00 C ATOM 139 CG LYS A 9 -7.309 -11.534 -7.348 1.00 0.00 C ATOM 140 CD LYS A 9 -7.449 -12.926 -7.941 1.00 0.00 C ATOM 141 CE LYS A 9 -7.298 -12.907 -9.453 1.00 0.00 C ATOM 142 NZ LYS A 9 -7.435 -14.267 -10.045 1.00 0.00 N ATOM 0 H LYS A 9 -9.983 -10.306 -5.278 1.00 0.00 H new ATOM 0 HA LYS A 9 -9.021 -13.040 -5.798 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -7.301 -10.549 -5.450 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -6.685 -12.189 -5.410 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.061 -10.875 -7.782 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.335 -11.122 -7.610 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -6.696 -13.584 -7.508 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -8.423 -13.338 -7.677 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -8.050 -12.247 -9.884 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -6.324 -12.494 -9.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -7.325 -14.209 -11.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -6.701 -14.892 -9.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -8.374 -14.652 -9.818 1.00 0.00 H new ATOM 156 N ASN A 10 -9.004 -11.080 -3.144 1.00 0.00 N ATOM 157 CA ASN A 10 -9.014 -11.100 -1.687 1.00 0.00 C ATOM 158 C ASN A 10 -10.304 -10.504 -1.126 1.00 0.00 C ATOM 159 O ASN A 10 -10.273 -9.697 -0.195 1.00 0.00 O ATOM 160 CB ASN A 10 -7.808 -10.335 -1.144 1.00 0.00 C ATOM 161 CG ASN A 10 -6.504 -10.805 -1.758 1.00 0.00 C ATOM 162 OD1 ASN A 10 -6.309 -10.720 -2.970 1.00 0.00 O ATOM 163 ND2 ASN A 10 -5.607 -11.309 -0.922 1.00 0.00 N ATOM 0 H ASN A 10 -9.135 -10.157 -3.557 1.00 0.00 H new ATOM 0 HA ASN A 10 -8.959 -12.141 -1.368 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -7.937 -9.271 -1.341 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -7.762 -10.455 -0.062 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -4.712 -11.646 -1.277 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -5.812 -11.360 0.076 1.00 0.00 H new ATOM 170 N ALA A 11 -11.438 -10.913 -1.687 1.00 0.00 N ATOM 171 CA ALA A 11 -12.733 -10.423 -1.228 1.00 0.00 C ATOM 172 C ALA A 11 -12.963 -10.792 0.234 1.00 0.00 C ATOM 173 O ALA A 11 -12.592 -11.881 0.670 1.00 0.00 O ATOM 174 CB ALA A 11 -13.848 -10.982 -2.099 1.00 0.00 C ATOM 0 H ALA A 11 -11.486 -11.580 -2.457 1.00 0.00 H new ATOM 0 HA ALA A 11 -12.738 -9.336 -1.310 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -14.809 -10.608 -1.745 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -13.695 -10.669 -3.132 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -13.840 -12.071 -2.045 1.00 0.00 H new ATOM 180 N ASP A 12 -13.567 -9.881 0.993 1.00 0.00 N ATOM 181 CA ASP A 12 -13.825 -10.129 2.407 1.00 0.00 C ATOM 182 C ASP A 12 -14.744 -9.064 3.007 1.00 0.00 C ATOM 183 O ASP A 12 -14.412 -8.442 4.017 1.00 0.00 O ATOM 184 CB ASP A 12 -12.506 -10.180 3.182 1.00 0.00 C ATOM 185 CG ASP A 12 -12.708 -10.484 4.654 1.00 0.00 C ATOM 186 OD1 ASP A 12 -13.260 -11.559 4.969 1.00 0.00 O ATOM 187 OD2 ASP A 12 -12.316 -9.647 5.492 1.00 0.00 O ATOM 0 H ASP A 12 -13.884 -8.972 0.656 1.00 0.00 H new ATOM 0 HA ASP A 12 -14.331 -11.091 2.489 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -11.860 -10.940 2.743 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -11.991 -9.225 3.079 1.00 0.00 H new ATOM 192 N MET A 13 -15.903 -8.864 2.387 1.00 0.00 N ATOM 193 CA MET A 13 -16.867 -7.883 2.875 1.00 0.00 C ATOM 194 C MET A 13 -18.192 -7.990 2.125 1.00 0.00 C ATOM 195 O MET A 13 -18.379 -8.878 1.295 1.00 0.00 O ATOM 196 CB MET A 13 -16.310 -6.462 2.742 1.00 0.00 C ATOM 197 CG MET A 13 -15.956 -6.072 1.315 1.00 0.00 C ATOM 198 SD MET A 13 -15.709 -4.295 1.118 1.00 0.00 S ATOM 199 CE MET A 13 -14.435 -3.975 2.335 1.00 0.00 C ATOM 0 H MET A 13 -16.197 -9.366 1.549 1.00 0.00 H new ATOM 0 HA MET A 13 -17.047 -8.097 3.929 1.00 0.00 H new ATOM 0 HB2 MET A 13 -17.044 -5.756 3.130 1.00 0.00 H new ATOM 0 HB3 MET A 13 -15.420 -6.371 3.365 1.00 0.00 H new ATOM 0 HG2 MET A 13 -15.049 -6.596 1.014 1.00 0.00 H new ATOM 0 HG3 MET A 13 -16.751 -6.400 0.645 1.00 0.00 H new ATOM 0 HE1 MET A 13 -13.756 -3.210 1.958 1.00 0.00 H new ATOM 0 HE2 MET A 13 -14.895 -3.628 3.260 1.00 0.00 H new ATOM 0 HE3 MET A 13 -13.878 -4.892 2.528 1.00 0.00 H new ATOM 209 N SER A 14 -19.108 -7.076 2.433 1.00 0.00 N ATOM 210 CA SER A 14 -20.424 -7.055 1.799 1.00 0.00 C ATOM 211 C SER A 14 -20.309 -6.997 0.282 1.00 0.00 C ATOM 212 O SER A 14 -19.340 -6.468 -0.262 1.00 0.00 O ATOM 213 CB SER A 14 -21.239 -5.866 2.310 1.00 0.00 C ATOM 214 OG SER A 14 -21.432 -5.941 3.710 1.00 0.00 O ATOM 0 H SER A 14 -18.963 -6.337 3.121 1.00 0.00 H new ATOM 0 HA SER A 14 -20.936 -7.980 2.063 1.00 0.00 H new ATOM 0 HB2 SER A 14 -20.727 -4.937 2.060 1.00 0.00 H new ATOM 0 HB3 SER A 14 -22.206 -5.842 1.808 1.00 0.00 H new ATOM 0 HG SER A 14 -21.954 -5.168 4.010 1.00 0.00 H new ATOM 220 N GLU A 15 -21.309 -7.550 -0.391 1.00 0.00 N ATOM 221 CA GLU A 15 -21.335 -7.575 -1.848 1.00 0.00 C ATOM 222 C GLU A 15 -21.437 -6.169 -2.424 1.00 0.00 C ATOM 223 O GLU A 15 -20.743 -5.828 -3.380 1.00 0.00 O ATOM 224 CB GLU A 15 -22.501 -8.434 -2.347 1.00 0.00 C ATOM 225 CG GLU A 15 -22.416 -9.892 -1.920 1.00 0.00 C ATOM 226 CD GLU A 15 -22.711 -10.097 -0.447 1.00 0.00 C ATOM 227 OE1 GLU A 15 -23.828 -9.749 -0.011 1.00 0.00 O ATOM 228 OE2 GLU A 15 -21.826 -10.608 0.271 1.00 0.00 O ATOM 0 H GLU A 15 -22.117 -7.989 0.051 1.00 0.00 H new ATOM 0 HA GLU A 15 -20.398 -8.014 -2.190 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -23.436 -8.011 -1.978 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -22.536 -8.385 -3.435 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -23.119 -10.479 -2.511 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -21.419 -10.272 -2.141 1.00 0.00 H new ATOM 235 N GLU A 16 -22.305 -5.358 -1.839 1.00 0.00 N ATOM 236 CA GLU A 16 -22.499 -3.988 -2.300 1.00 0.00 C ATOM 237 C GLU A 16 -21.213 -3.177 -2.172 1.00 0.00 C ATOM 238 O GLU A 16 -20.865 -2.408 -3.068 1.00 0.00 O ATOM 239 CB GLU A 16 -23.621 -3.315 -1.509 1.00 0.00 C ATOM 240 CG GLU A 16 -23.357 -3.249 -0.013 1.00 0.00 C ATOM 241 CD GLU A 16 -24.485 -2.582 0.750 1.00 0.00 C ATOM 242 OE1 GLU A 16 -25.624 -3.090 0.691 1.00 0.00 O ATOM 243 OE2 GLU A 16 -24.228 -1.550 1.406 1.00 0.00 O ATOM 0 H GLU A 16 -22.887 -5.623 -1.044 1.00 0.00 H new ATOM 0 HA GLU A 16 -22.777 -4.025 -3.353 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -23.766 -2.304 -1.889 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -24.551 -3.856 -1.682 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -23.211 -4.259 0.371 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -22.431 -2.703 0.165 1.00 0.00 H new ATOM 250 N MET A 17 -20.514 -3.346 -1.055 1.00 0.00 N ATOM 251 CA MET A 17 -19.272 -2.619 -0.819 1.00 0.00 C ATOM 252 C MET A 17 -18.247 -2.912 -1.908 1.00 0.00 C ATOM 253 O MET A 17 -17.679 -1.996 -2.500 1.00 0.00 O ATOM 254 CB MET A 17 -18.697 -2.974 0.553 1.00 0.00 C ATOM 255 CG MET A 17 -19.587 -2.556 1.711 1.00 0.00 C ATOM 256 SD MET A 17 -18.890 -2.991 3.316 1.00 0.00 S ATOM 257 CE MET A 17 -20.144 -2.342 4.417 1.00 0.00 C ATOM 0 H MET A 17 -20.785 -3.978 -0.301 1.00 0.00 H new ATOM 0 HA MET A 17 -19.499 -1.553 -0.843 1.00 0.00 H new ATOM 0 HB2 MET A 17 -18.533 -4.050 0.602 1.00 0.00 H new ATOM 0 HB3 MET A 17 -17.723 -2.498 0.664 1.00 0.00 H new ATOM 0 HG2 MET A 17 -19.748 -1.479 1.669 1.00 0.00 H new ATOM 0 HG3 MET A 17 -20.563 -3.029 1.603 1.00 0.00 H new ATOM 0 HE1 MET A 17 -19.747 -2.290 5.431 1.00 0.00 H new ATOM 0 HE2 MET A 17 -20.435 -1.344 4.089 1.00 0.00 H new ATOM 0 HE3 MET A 17 -21.015 -2.997 4.402 1.00 0.00 H new ATOM 267 N GLN A 18 -18.016 -4.192 -2.168 1.00 0.00 N ATOM 268 CA GLN A 18 -17.058 -4.592 -3.191 1.00 0.00 C ATOM 269 C GLN A 18 -17.461 -4.065 -4.562 1.00 0.00 C ATOM 270 O GLN A 18 -16.614 -3.621 -5.337 1.00 0.00 O ATOM 271 CB GLN A 18 -16.905 -6.115 -3.222 1.00 0.00 C ATOM 272 CG GLN A 18 -18.220 -6.869 -3.279 1.00 0.00 C ATOM 273 CD GLN A 18 -18.020 -8.368 -3.200 1.00 0.00 C ATOM 274 OE1 GLN A 18 -17.541 -8.995 -4.144 1.00 0.00 O ATOM 275 NE2 GLN A 18 -18.363 -8.945 -2.055 1.00 0.00 N ATOM 0 H GLN A 18 -18.475 -4.967 -1.689 1.00 0.00 H new ATOM 0 HA GLN A 18 -16.094 -4.153 -2.935 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -16.302 -6.391 -4.087 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -16.355 -6.432 -2.336 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -18.859 -6.545 -2.458 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -18.740 -6.621 -4.204 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -18.757 -8.384 -1.299 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -18.233 -9.949 -1.931 1.00 0.00 H new ATOM 284 N GLN A 19 -18.754 -4.103 -4.856 1.00 0.00 N ATOM 285 CA GLN A 19 -19.254 -3.614 -6.135 1.00 0.00 C ATOM 286 C GLN A 19 -19.079 -2.104 -6.243 1.00 0.00 C ATOM 287 O GLN A 19 -18.701 -1.585 -7.295 1.00 0.00 O ATOM 288 CB GLN A 19 -20.725 -3.989 -6.318 1.00 0.00 C ATOM 289 CG GLN A 19 -20.959 -5.486 -6.444 1.00 0.00 C ATOM 290 CD GLN A 19 -20.258 -6.087 -7.646 1.00 0.00 C ATOM 291 OE1 GLN A 19 -20.523 -5.708 -8.786 1.00 0.00 O ATOM 292 NE2 GLN A 19 -19.356 -7.028 -7.395 1.00 0.00 N ATOM 0 H GLN A 19 -19.473 -4.465 -4.230 1.00 0.00 H new ATOM 0 HA GLN A 19 -18.673 -4.087 -6.927 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -21.296 -3.610 -5.470 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -21.110 -3.493 -7.209 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -20.609 -5.982 -5.539 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -22.029 -5.678 -6.519 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -19.168 -7.311 -6.433 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -18.850 -7.468 -8.164 1.00 0.00 H new ATOM 301 N ASP A 20 -19.354 -1.403 -5.150 1.00 0.00 N ATOM 302 CA ASP A 20 -19.225 0.049 -5.119 1.00 0.00 C ATOM 303 C ASP A 20 -17.776 0.467 -5.303 1.00 0.00 C ATOM 304 O ASP A 20 -17.487 1.435 -6.000 1.00 0.00 O ATOM 305 CB ASP A 20 -19.776 0.607 -3.807 1.00 0.00 C ATOM 306 CG ASP A 20 -19.718 2.121 -3.751 1.00 0.00 C ATOM 307 OD1 ASP A 20 -20.328 2.771 -4.626 1.00 0.00 O ATOM 308 OD2 ASP A 20 -19.067 2.659 -2.830 1.00 0.00 O ATOM 0 H ASP A 20 -19.668 -1.817 -4.272 1.00 0.00 H new ATOM 0 HA ASP A 20 -19.807 0.459 -5.944 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -20.809 0.281 -3.682 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -19.209 0.194 -2.973 1.00 0.00 H new ATOM 313 N SER A 21 -16.864 -0.269 -4.685 1.00 0.00 N ATOM 314 CA SER A 21 -15.447 0.039 -4.804 1.00 0.00 C ATOM 315 C SER A 21 -14.976 -0.191 -6.233 1.00 0.00 C ATOM 316 O SER A 21 -14.263 0.635 -6.804 1.00 0.00 O ATOM 317 CB SER A 21 -14.626 -0.811 -3.833 1.00 0.00 C ATOM 318 OG SER A 21 -13.243 -0.529 -3.948 1.00 0.00 O ATOM 0 H SER A 21 -17.077 -1.077 -4.101 1.00 0.00 H new ATOM 0 HA SER A 21 -15.301 1.089 -4.550 1.00 0.00 H new ATOM 0 HB2 SER A 21 -14.955 -0.620 -2.811 1.00 0.00 H new ATOM 0 HB3 SER A 21 -14.802 -1.868 -4.033 1.00 0.00 H new ATOM 0 HG SER A 21 -12.860 -1.063 -4.675 1.00 0.00 H new ATOM 324 N VAL A 22 -15.392 -1.311 -6.812 1.00 0.00 N ATOM 325 CA VAL A 22 -15.023 -1.640 -8.181 1.00 0.00 C ATOM 326 C VAL A 22 -15.619 -0.627 -9.147 1.00 0.00 C ATOM 327 O VAL A 22 -14.946 -0.152 -10.063 1.00 0.00 O ATOM 328 CB VAL A 22 -15.499 -3.055 -8.568 1.00 0.00 C ATOM 329 CG1 VAL A 22 -15.072 -3.400 -9.986 1.00 0.00 C ATOM 330 CG2 VAL A 22 -14.972 -4.084 -7.580 1.00 0.00 C ATOM 0 H VAL A 22 -15.984 -2.005 -6.355 1.00 0.00 H new ATOM 0 HA VAL A 22 -13.935 -1.611 -8.243 1.00 0.00 H new ATOM 0 HB VAL A 22 -16.588 -3.071 -8.531 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -15.419 -4.402 -10.237 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -15.506 -2.681 -10.682 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -13.985 -3.364 -10.058 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -15.318 -5.076 -7.869 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -13.882 -4.065 -7.581 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -15.338 -3.849 -6.580 1.00 0.00 H new ATOM 340 N GLU A 23 -16.886 -0.298 -8.931 1.00 0.00 N ATOM 341 CA GLU A 23 -17.582 0.664 -9.769 1.00 0.00 C ATOM 342 C GLU A 23 -16.970 2.051 -9.612 1.00 0.00 C ATOM 343 O GLU A 23 -16.709 2.744 -10.595 1.00 0.00 O ATOM 344 CB GLU A 23 -19.067 0.698 -9.408 1.00 0.00 C ATOM 345 CG GLU A 23 -19.869 1.684 -10.235 1.00 0.00 C ATOM 346 CD GLU A 23 -21.337 1.702 -9.860 1.00 0.00 C ATOM 347 OE1 GLU A 23 -21.648 2.003 -8.689 1.00 0.00 O ATOM 348 OE2 GLU A 23 -22.178 1.414 -10.739 1.00 0.00 O ATOM 0 H GLU A 23 -17.453 -0.687 -8.178 1.00 0.00 H new ATOM 0 HA GLU A 23 -17.479 0.357 -10.810 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -19.487 -0.299 -9.538 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -19.170 0.952 -8.353 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -19.453 2.683 -10.106 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -19.771 1.431 -11.291 1.00 0.00 H new ATOM 355 N CYS A 24 -16.741 2.444 -8.365 1.00 0.00 N ATOM 356 CA CYS A 24 -16.154 3.749 -8.074 1.00 0.00 C ATOM 357 C CYS A 24 -14.720 3.832 -8.587 1.00 0.00 C ATOM 358 O CYS A 24 -14.257 4.905 -8.977 1.00 0.00 O ATOM 359 CB CYS A 24 -16.193 4.037 -6.572 1.00 0.00 C ATOM 360 SG CYS A 24 -17.858 4.278 -5.908 1.00 0.00 S ATOM 0 H CYS A 24 -16.951 1.881 -7.541 1.00 0.00 H new ATOM 0 HA CYS A 24 -16.748 4.503 -8.591 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -15.719 3.211 -6.042 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -15.600 4.929 -6.369 1.00 0.00 H new ATOM 0 HG CYS A 24 -18.479 3.136 -5.868 1.00 0.00 H new ATOM 366 N ALA A 25 -14.023 2.701 -8.596 1.00 0.00 N ATOM 367 CA ALA A 25 -12.652 2.660 -9.074 1.00 0.00 C ATOM 368 C ALA A 25 -12.627 2.851 -10.579 1.00 0.00 C ATOM 369 O ALA A 25 -11.764 3.546 -11.120 1.00 0.00 O ATOM 370 CB ALA A 25 -11.994 1.343 -8.690 1.00 0.00 C ATOM 0 H ALA A 25 -14.387 1.803 -8.277 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.089 3.469 -8.607 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -10.967 1.329 -9.056 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -11.994 1.239 -7.605 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.549 0.516 -9.134 1.00 0.00 H new ATOM 376 N THR A 26 -13.592 2.232 -11.253 1.00 0.00 N ATOM 377 CA THR A 26 -13.691 2.333 -12.697 1.00 0.00 C ATOM 378 C THR A 26 -13.866 3.786 -13.116 1.00 0.00 C ATOM 379 O THR A 26 -13.145 4.293 -13.980 1.00 0.00 O ATOM 380 CB THR A 26 -14.856 1.489 -13.217 1.00 0.00 C ATOM 381 OG1 THR A 26 -14.685 0.128 -12.861 1.00 0.00 O ATOM 382 CG2 THR A 26 -15.018 1.551 -14.720 1.00 0.00 C ATOM 0 H THR A 26 -14.314 1.657 -10.819 1.00 0.00 H new ATOM 0 HA THR A 26 -12.767 1.952 -13.132 1.00 0.00 H new ATOM 0 HB THR A 26 -15.748 1.912 -12.754 1.00 0.00 H new ATOM 0 HG1 THR A 26 -14.774 0.030 -11.890 1.00 0.00 H new ATOM 0 HG21 THR A 26 -15.862 0.930 -15.021 1.00 0.00 H new ATOM 0 HG22 THR A 26 -15.199 2.582 -15.024 1.00 0.00 H new ATOM 0 HG23 THR A 26 -14.110 1.186 -15.199 1.00 0.00 H new ATOM 390 N GLN A 27 -14.813 4.463 -12.476 1.00 0.00 N ATOM 391 CA GLN A 27 -15.059 5.866 -12.769 1.00 0.00 C ATOM 392 C GLN A 27 -13.781 6.654 -12.536 1.00 0.00 C ATOM 393 O GLN A 27 -13.362 7.450 -13.375 1.00 0.00 O ATOM 394 CB GLN A 27 -16.185 6.414 -11.889 1.00 0.00 C ATOM 395 CG GLN A 27 -17.508 5.689 -12.071 1.00 0.00 C ATOM 396 CD GLN A 27 -18.611 6.268 -11.207 1.00 0.00 C ATOM 397 OE1 GLN A 27 -18.968 7.438 -11.339 1.00 0.00 O ATOM 398 NE2 GLN A 27 -19.155 5.448 -10.314 1.00 0.00 N ATOM 0 H GLN A 27 -15.417 4.065 -11.757 1.00 0.00 H new ATOM 0 HA GLN A 27 -15.366 5.965 -13.810 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -15.884 6.346 -10.844 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -16.326 7.472 -12.111 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -17.806 5.741 -13.118 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -17.377 4.634 -11.829 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -18.827 4.485 -10.240 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -19.900 5.782 -9.703 1.00 0.00 H new ATOM 407 N ALA A 28 -13.149 6.396 -11.393 1.00 0.00 N ATOM 408 CA ALA A 28 -11.899 7.047 -11.031 1.00 0.00 C ATOM 409 C ALA A 28 -10.933 7.051 -12.207 1.00 0.00 C ATOM 410 O ALA A 28 -10.286 8.060 -12.493 1.00 0.00 O ATOM 411 CB ALA A 28 -11.274 6.333 -9.847 1.00 0.00 C ATOM 0 H ALA A 28 -13.490 5.733 -10.697 1.00 0.00 H new ATOM 0 HA ALA A 28 -12.111 8.081 -10.759 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -10.338 6.823 -9.579 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -11.958 6.368 -8.999 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.076 5.294 -10.111 1.00 0.00 H new ATOM 417 N LEU A 29 -10.850 5.916 -12.892 1.00 0.00 N ATOM 418 CA LEU A 29 -9.975 5.790 -14.047 1.00 0.00 C ATOM 419 C LEU A 29 -10.405 6.757 -15.136 1.00 0.00 C ATOM 420 O LEU A 29 -9.588 7.474 -15.711 1.00 0.00 O ATOM 421 CB LEU A 29 -9.990 4.358 -14.578 1.00 0.00 C ATOM 422 CG LEU A 29 -9.221 3.355 -13.723 1.00 0.00 C ATOM 423 CD1 LEU A 29 -9.582 1.931 -14.113 1.00 0.00 C ATOM 424 CD2 LEU A 29 -7.724 3.581 -13.864 1.00 0.00 C ATOM 0 H LEU A 29 -11.378 5.073 -12.667 1.00 0.00 H new ATOM 0 HA LEU A 29 -8.958 6.033 -13.739 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -11.025 4.026 -14.661 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -9.572 4.353 -15.585 1.00 0.00 H new ATOM 0 HG LEU A 29 -9.500 3.505 -12.680 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -9.023 1.231 -13.492 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -10.651 1.773 -13.966 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -9.332 1.766 -15.161 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -7.187 2.859 -13.249 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -7.434 3.456 -14.907 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -7.476 4.591 -13.537 1.00 0.00 H new ATOM 436 N GLU A 30 -11.702 6.776 -15.402 1.00 0.00 N ATOM 437 CA GLU A 30 -12.263 7.659 -16.413 1.00 0.00 C ATOM 438 C GLU A 30 -12.171 9.119 -15.977 1.00 0.00 C ATOM 439 O GLU A 30 -12.077 10.021 -16.810 1.00 0.00 O ATOM 440 CB GLU A 30 -13.722 7.290 -16.690 1.00 0.00 C ATOM 441 CG GLU A 30 -13.904 5.867 -17.195 1.00 0.00 C ATOM 442 CD GLU A 30 -15.357 5.523 -17.463 1.00 0.00 C ATOM 443 OE1 GLU A 30 -16.224 6.398 -17.253 1.00 0.00 O ATOM 444 OE2 GLU A 30 -15.628 4.378 -17.882 1.00 0.00 O ATOM 0 H GLU A 30 -12.388 6.187 -14.930 1.00 0.00 H new ATOM 0 HA GLU A 30 -11.683 7.535 -17.327 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -14.301 7.419 -15.775 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.130 7.983 -17.426 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -13.328 5.734 -18.111 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -13.499 5.171 -16.461 1.00 0.00 H new ATOM 451 N LYS A 31 -12.211 9.349 -14.666 1.00 0.00 N ATOM 452 CA LYS A 31 -12.146 10.700 -14.124 1.00 0.00 C ATOM 453 C LYS A 31 -10.715 11.216 -14.077 1.00 0.00 C ATOM 454 O LYS A 31 -10.470 12.403 -14.291 1.00 0.00 O ATOM 455 CB LYS A 31 -12.758 10.760 -12.721 1.00 0.00 C ATOM 456 CG LYS A 31 -14.177 10.213 -12.631 1.00 0.00 C ATOM 457 CD LYS A 31 -15.026 10.649 -13.814 1.00 0.00 C ATOM 458 CE LYS A 31 -16.465 10.179 -13.673 1.00 0.00 C ATOM 459 NZ LYS A 31 -17.304 10.605 -14.826 1.00 0.00 N ATOM 0 H LYS A 31 -12.288 8.616 -13.961 1.00 0.00 H new ATOM 0 HA LYS A 31 -12.723 11.339 -14.793 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -12.121 10.200 -12.036 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -12.758 11.796 -12.382 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -14.145 9.124 -12.588 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -14.640 10.555 -11.705 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -15.004 11.736 -13.898 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -14.601 10.250 -14.735 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -16.485 9.092 -13.591 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -16.888 10.576 -12.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -18.278 10.265 -14.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -17.306 11.643 -14.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -16.916 10.205 -15.704 1.00 0.00 H new ATOM 473 N TYR A 32 -9.771 10.332 -13.774 1.00 0.00 N ATOM 474 CA TYR A 32 -8.375 10.735 -13.679 1.00 0.00 C ATOM 475 C TYR A 32 -7.443 9.761 -14.395 1.00 0.00 C ATOM 476 O TYR A 32 -6.486 10.178 -15.047 1.00 0.00 O ATOM 477 CB TYR A 32 -7.958 10.863 -12.213 1.00 0.00 C ATOM 478 CG TYR A 32 -8.780 11.863 -11.430 1.00 0.00 C ATOM 479 CD1 TYR A 32 -8.837 13.197 -11.815 1.00 0.00 C ATOM 480 CD2 TYR A 32 -9.498 11.472 -10.307 1.00 0.00 C ATOM 481 CE1 TYR A 32 -9.586 14.113 -11.101 1.00 0.00 C ATOM 482 CE2 TYR A 32 -10.250 12.383 -9.588 1.00 0.00 C ATOM 483 CZ TYR A 32 -10.289 13.701 -9.989 1.00 0.00 C ATOM 484 OH TYR A 32 -11.036 14.612 -9.276 1.00 0.00 O ATOM 0 H TYR A 32 -9.945 9.343 -13.592 1.00 0.00 H new ATOM 0 HA TYR A 32 -8.287 11.703 -14.173 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -8.039 9.887 -11.735 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -6.909 11.154 -12.167 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -8.287 13.523 -12.686 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -9.468 10.440 -9.990 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -9.620 15.146 -11.413 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -10.803 12.064 -8.717 1.00 0.00 H new ATOM 0 HH TYR A 32 -11.470 14.160 -8.522 1.00 0.00 H new ATOM 494 N ASN A 33 -7.712 8.467 -14.258 1.00 0.00 N ATOM 495 CA ASN A 33 -6.879 7.444 -14.884 1.00 0.00 C ATOM 496 C ASN A 33 -5.497 7.416 -14.237 1.00 0.00 C ATOM 497 O ASN A 33 -4.476 7.374 -14.924 1.00 0.00 O ATOM 498 CB ASN A 33 -6.749 7.694 -16.390 1.00 0.00 C ATOM 499 CG ASN A 33 -5.957 6.607 -17.090 1.00 0.00 C ATOM 500 OD1 ASN A 33 -6.335 5.435 -17.066 1.00 0.00 O ATOM 501 ND2 ASN A 33 -4.853 6.990 -17.721 1.00 0.00 N ATOM 0 H ASN A 33 -8.498 8.101 -13.721 1.00 0.00 H new ATOM 0 HA ASN A 33 -7.359 6.477 -14.735 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -7.743 7.757 -16.832 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -6.265 8.656 -16.555 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -4.281 6.302 -18.211 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -4.577 7.972 -17.715 1.00 0.00 H new ATOM 508 N ILE A 34 -5.475 7.441 -12.908 1.00 0.00 N ATOM 509 CA ILE A 34 -4.224 7.419 -12.158 1.00 0.00 C ATOM 510 C ILE A 34 -4.405 6.695 -10.827 1.00 0.00 C ATOM 511 O ILE A 34 -5.270 7.049 -10.027 1.00 0.00 O ATOM 512 CB ILE A 34 -3.707 8.850 -11.890 1.00 0.00 C ATOM 513 CG1 ILE A 34 -3.486 9.594 -13.209 1.00 0.00 C ATOM 514 CG2 ILE A 34 -2.418 8.811 -11.082 1.00 0.00 C ATOM 515 CD1 ILE A 34 -2.424 8.970 -14.088 1.00 0.00 C ATOM 0 H ILE A 34 -6.312 7.477 -12.327 1.00 0.00 H new ATOM 0 HA ILE A 34 -3.492 6.886 -12.765 1.00 0.00 H new ATOM 0 HB ILE A 34 -4.461 9.384 -11.311 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -4.427 9.628 -13.759 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -3.206 10.625 -12.992 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -2.070 9.828 -10.903 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -2.602 8.318 -10.128 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -1.658 8.259 -11.635 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -2.323 9.551 -15.005 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -1.472 8.961 -13.557 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -2.711 7.948 -14.336 1.00 0.00 H new ATOM 527 N GLU A 35 -3.586 5.676 -10.600 1.00 0.00 N ATOM 528 CA GLU A 35 -3.652 4.888 -9.373 1.00 0.00 C ATOM 529 C GLU A 35 -3.701 5.774 -8.128 1.00 0.00 C ATOM 530 O GLU A 35 -4.489 5.531 -7.215 1.00 0.00 O ATOM 531 CB GLU A 35 -2.450 3.945 -9.296 1.00 0.00 C ATOM 532 CG GLU A 35 -1.113 4.657 -9.412 1.00 0.00 C ATOM 533 CD GLU A 35 0.061 3.698 -9.420 1.00 0.00 C ATOM 534 OE1 GLU A 35 0.104 2.820 -10.308 1.00 0.00 O ATOM 535 OE2 GLU A 35 0.940 3.829 -8.543 1.00 0.00 O ATOM 0 H GLU A 35 -2.863 5.373 -11.253 1.00 0.00 H new ATOM 0 HA GLU A 35 -4.574 4.308 -9.401 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -2.483 3.403 -8.351 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -2.528 3.204 -10.091 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -1.099 5.249 -10.327 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -1.003 5.353 -8.580 1.00 0.00 H new ATOM 542 N LYS A 36 -2.851 6.792 -8.094 1.00 0.00 N ATOM 543 CA LYS A 36 -2.796 7.703 -6.953 1.00 0.00 C ATOM 544 C LYS A 36 -4.116 8.452 -6.765 1.00 0.00 C ATOM 545 O LYS A 36 -4.734 8.382 -5.704 1.00 0.00 O ATOM 546 CB LYS A 36 -1.665 8.713 -7.141 1.00 0.00 C ATOM 547 CG LYS A 36 -1.521 9.682 -5.980 1.00 0.00 C ATOM 548 CD LYS A 36 -0.576 10.822 -6.319 1.00 0.00 C ATOM 549 CE LYS A 36 -1.133 11.693 -7.433 1.00 0.00 C ATOM 550 NZ LYS A 36 -0.235 12.838 -7.746 1.00 0.00 N ATOM 0 H LYS A 36 -2.191 7.009 -8.840 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.613 7.102 -6.062 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -0.726 8.175 -7.274 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.841 9.278 -8.056 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -2.499 10.085 -5.718 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.150 9.149 -5.104 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -0.404 11.430 -5.431 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.390 10.418 -6.620 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -1.276 11.089 -8.329 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -2.114 12.070 -7.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -0.651 13.407 -8.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -0.118 13.430 -6.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 0.693 12.479 -8.048 1.00 0.00 H new ATOM 564 N ASP A 37 -4.528 9.180 -7.797 1.00 0.00 N ATOM 565 CA ASP A 37 -5.762 9.960 -7.745 1.00 0.00 C ATOM 566 C ASP A 37 -6.971 9.084 -7.434 1.00 0.00 C ATOM 567 O ASP A 37 -7.794 9.425 -6.584 1.00 0.00 O ATOM 568 CB ASP A 37 -5.980 10.691 -9.071 1.00 0.00 C ATOM 569 CG ASP A 37 -4.846 11.642 -9.401 1.00 0.00 C ATOM 570 OD1 ASP A 37 -4.602 12.573 -8.603 1.00 0.00 O ATOM 571 OD2 ASP A 37 -4.203 11.456 -10.455 1.00 0.00 O ATOM 0 H ASP A 37 -4.025 9.247 -8.682 1.00 0.00 H new ATOM 0 HA ASP A 37 -5.658 10.687 -6.940 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -6.082 9.960 -9.873 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -6.916 11.248 -9.026 1.00 0.00 H new ATOM 576 N ILE A 38 -7.078 7.959 -8.130 1.00 0.00 N ATOM 577 CA ILE A 38 -8.191 7.036 -7.933 1.00 0.00 C ATOM 578 C ILE A 38 -8.320 6.622 -6.469 1.00 0.00 C ATOM 579 O ILE A 38 -9.397 6.716 -5.876 1.00 0.00 O ATOM 580 CB ILE A 38 -8.018 5.775 -8.805 1.00 0.00 C ATOM 581 CG1 ILE A 38 -8.040 6.151 -10.289 1.00 0.00 C ATOM 582 CG2 ILE A 38 -9.096 4.746 -8.492 1.00 0.00 C ATOM 583 CD1 ILE A 38 -7.870 4.969 -11.216 1.00 0.00 C ATOM 0 H ILE A 38 -6.406 7.662 -8.838 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.099 7.560 -8.230 1.00 0.00 H new ATOM 0 HB ILE A 38 -7.052 5.327 -8.575 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -8.984 6.647 -10.516 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -7.246 6.872 -10.484 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -8.953 3.866 -9.119 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.030 4.458 -7.443 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -10.078 5.176 -8.689 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -7.896 5.311 -12.251 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.913 4.486 -11.017 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -8.678 4.257 -11.049 1.00 0.00 H new ATOM 595 N ALA A 39 -7.218 6.158 -5.899 1.00 0.00 N ATOM 596 CA ALA A 39 -7.196 5.718 -4.511 1.00 0.00 C ATOM 597 C ALA A 39 -7.506 6.859 -3.547 1.00 0.00 C ATOM 598 O ALA A 39 -8.009 6.634 -2.447 1.00 0.00 O ATOM 599 CB ALA A 39 -5.843 5.104 -4.181 1.00 0.00 C ATOM 0 H ALA A 39 -6.322 6.076 -6.379 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.976 4.966 -4.390 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.835 4.778 -3.141 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.664 4.248 -4.831 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -5.060 5.846 -4.334 1.00 0.00 H new ATOM 605 N ALA A 40 -7.182 8.081 -3.955 1.00 0.00 N ATOM 606 CA ALA A 40 -7.407 9.248 -3.110 1.00 0.00 C ATOM 607 C ALA A 40 -8.891 9.547 -2.911 1.00 0.00 C ATOM 608 O ALA A 40 -9.368 9.640 -1.779 1.00 0.00 O ATOM 609 CB ALA A 40 -6.703 10.461 -3.699 1.00 0.00 C ATOM 0 H ALA A 40 -6.764 8.289 -4.862 1.00 0.00 H new ATOM 0 HA ALA A 40 -6.991 9.022 -2.128 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.877 11.328 -3.061 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.633 10.265 -3.762 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -7.095 10.660 -4.696 1.00 0.00 H new ATOM 615 N HIS A 41 -9.614 9.720 -4.011 1.00 0.00 N ATOM 616 CA HIS A 41 -11.036 10.038 -3.943 1.00 0.00 C ATOM 617 C HIS A 41 -11.838 8.887 -3.329 1.00 0.00 C ATOM 618 O HIS A 41 -12.653 9.102 -2.433 1.00 0.00 O ATOM 619 CB HIS A 41 -11.568 10.392 -5.338 1.00 0.00 C ATOM 620 CG HIS A 41 -12.208 9.251 -6.067 1.00 0.00 C ATOM 621 ND1 HIS A 41 -13.412 8.704 -5.684 1.00 0.00 N ATOM 622 CD2 HIS A 41 -11.814 8.560 -7.162 1.00 0.00 C ATOM 623 CE1 HIS A 41 -13.734 7.730 -6.511 1.00 0.00 C ATOM 624 NE2 HIS A 41 -12.784 7.621 -7.420 1.00 0.00 N ATOM 0 H HIS A 41 -9.241 9.646 -4.958 1.00 0.00 H new ATOM 0 HA HIS A 41 -11.158 10.904 -3.293 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -12.295 11.199 -5.242 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -10.744 10.775 -5.940 1.00 0.00 H new ATOM 0 HD1 HIS A 41 -13.968 9.006 -4.884 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -10.907 8.717 -7.727 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -14.626 7.123 -6.454 1.00 0.00 H new ATOM 633 N ILE A 42 -11.609 7.670 -3.817 1.00 0.00 N ATOM 634 CA ILE A 42 -12.326 6.504 -3.308 1.00 0.00 C ATOM 635 C ILE A 42 -12.108 6.337 -1.806 1.00 0.00 C ATOM 636 O ILE A 42 -13.045 6.039 -1.065 1.00 0.00 O ATOM 637 CB ILE A 42 -11.908 5.207 -4.041 1.00 0.00 C ATOM 638 CG1 ILE A 42 -12.311 5.278 -5.513 1.00 0.00 C ATOM 639 CG2 ILE A 42 -12.533 3.986 -3.379 1.00 0.00 C ATOM 640 CD1 ILE A 42 -11.988 4.017 -6.283 1.00 0.00 C ATOM 0 H ILE A 42 -10.938 7.467 -4.558 1.00 0.00 H new ATOM 0 HA ILE A 42 -13.385 6.679 -3.497 1.00 0.00 H new ATOM 0 HB ILE A 42 -10.824 5.112 -3.978 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -13.381 5.473 -5.581 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -11.804 6.121 -5.981 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -12.225 3.086 -3.911 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -12.203 3.925 -2.342 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -13.619 4.072 -3.409 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -12.300 4.134 -7.321 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -10.914 3.833 -6.245 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -12.517 3.174 -5.839 1.00 0.00 H new ATOM 652 N LYS A 43 -10.874 6.527 -1.362 1.00 0.00 N ATOM 653 CA LYS A 43 -10.548 6.392 0.053 1.00 0.00 C ATOM 654 C LYS A 43 -11.350 7.385 0.893 1.00 0.00 C ATOM 655 O LYS A 43 -11.909 7.024 1.929 1.00 0.00 O ATOM 656 CB LYS A 43 -9.042 6.603 0.263 1.00 0.00 C ATOM 657 CG LYS A 43 -8.556 6.347 1.686 1.00 0.00 C ATOM 658 CD LYS A 43 -8.901 7.493 2.627 1.00 0.00 C ATOM 659 CE LYS A 43 -8.265 7.298 3.994 1.00 0.00 C ATOM 660 NZ LYS A 43 -6.782 7.207 3.910 1.00 0.00 N ATOM 0 H LYS A 43 -10.084 6.774 -1.957 1.00 0.00 H new ATOM 0 HA LYS A 43 -10.814 5.386 0.377 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -8.499 5.946 -0.416 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -8.790 7.627 -0.014 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.002 5.425 2.060 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -7.476 6.198 1.678 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -8.560 8.435 2.196 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -9.983 7.565 2.734 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -8.541 8.128 4.644 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -8.659 6.390 4.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -6.370 7.380 4.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -6.510 6.258 3.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -6.428 7.919 3.240 1.00 0.00 H new ATOM 674 N LYS A 44 -11.393 8.635 0.446 1.00 0.00 N ATOM 675 CA LYS A 44 -12.115 9.682 1.169 1.00 0.00 C ATOM 676 C LYS A 44 -13.626 9.474 1.146 1.00 0.00 C ATOM 677 O LYS A 44 -14.284 9.563 2.183 1.00 0.00 O ATOM 678 CB LYS A 44 -11.772 11.056 0.590 1.00 0.00 C ATOM 679 CG LYS A 44 -10.296 11.408 0.694 1.00 0.00 C ATOM 680 CD LYS A 44 -10.006 12.769 0.083 1.00 0.00 C ATOM 681 CE LYS A 44 -8.529 13.120 0.181 1.00 0.00 C ATOM 682 NZ LYS A 44 -7.671 12.128 -0.527 1.00 0.00 N ATOM 0 H LYS A 44 -10.939 8.950 -0.411 1.00 0.00 H new ATOM 0 HA LYS A 44 -11.795 9.628 2.210 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -12.071 11.085 -0.458 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.356 11.816 1.109 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -9.993 11.405 1.741 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -9.702 10.647 0.188 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -10.313 12.773 -0.963 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -10.597 13.531 0.592 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -8.363 14.111 -0.243 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -8.237 13.169 1.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -6.989 12.628 -1.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -7.157 11.553 0.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -8.267 11.510 -1.114 1.00 0.00 H new ATOM 696 N GLU A 45 -14.179 9.219 -0.032 1.00 0.00 N ATOM 697 CA GLU A 45 -15.620 9.023 -0.164 1.00 0.00 C ATOM 698 C GLU A 45 -16.121 7.906 0.745 1.00 0.00 C ATOM 699 O GLU A 45 -17.131 8.060 1.431 1.00 0.00 O ATOM 700 CB GLU A 45 -15.992 8.718 -1.616 1.00 0.00 C ATOM 701 CG GLU A 45 -15.712 9.865 -2.572 1.00 0.00 C ATOM 702 CD GLU A 45 -16.183 9.573 -3.984 1.00 0.00 C ATOM 703 OE1 GLU A 45 -15.724 8.568 -4.567 1.00 0.00 O ATOM 704 OE2 GLU A 45 -17.010 10.349 -4.507 1.00 0.00 O ATOM 0 H GLU A 45 -13.658 9.143 -0.905 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.103 9.951 0.142 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -15.439 7.838 -1.946 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.051 8.466 -1.665 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.205 10.766 -2.207 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -14.642 10.070 -2.585 1.00 0.00 H new ATOM 711 N PHE A 46 -15.424 6.778 0.740 1.00 0.00 N ATOM 712 CA PHE A 46 -15.820 5.637 1.556 1.00 0.00 C ATOM 713 C PHE A 46 -15.688 5.909 3.051 1.00 0.00 C ATOM 714 O PHE A 46 -16.571 5.542 3.826 1.00 0.00 O ATOM 715 CB PHE A 46 -15.018 4.399 1.171 1.00 0.00 C ATOM 716 CG PHE A 46 -15.492 3.749 -0.100 1.00 0.00 C ATOM 717 CD1 PHE A 46 -15.461 4.432 -1.305 1.00 0.00 C ATOM 718 CD2 PHE A 46 -15.967 2.450 -0.085 1.00 0.00 C ATOM 719 CE1 PHE A 46 -15.896 3.827 -2.471 1.00 0.00 C ATOM 720 CE2 PHE A 46 -16.405 1.840 -1.242 1.00 0.00 C ATOM 721 CZ PHE A 46 -16.368 2.528 -2.438 1.00 0.00 C ATOM 0 H PHE A 46 -14.584 6.628 0.182 1.00 0.00 H new ATOM 0 HA PHE A 46 -16.877 5.459 1.356 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -13.969 4.675 1.060 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -15.072 3.674 1.983 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -15.094 5.447 -1.335 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -15.995 1.905 0.847 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -15.867 4.369 -3.405 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -16.776 0.826 -1.212 1.00 0.00 H new ATOM 0 HZ PHE A 46 -16.707 2.052 -3.346 1.00 0.00 H new ATOM 731 N ASP A 47 -14.597 6.542 3.466 1.00 0.00 N ATOM 732 CA ASP A 47 -14.409 6.828 4.884 1.00 0.00 C ATOM 733 C ASP A 47 -15.442 7.837 5.372 1.00 0.00 C ATOM 734 O ASP A 47 -15.836 7.824 6.533 1.00 0.00 O ATOM 735 CB ASP A 47 -12.992 7.330 5.175 1.00 0.00 C ATOM 736 CG ASP A 47 -12.652 8.607 4.441 1.00 0.00 C ATOM 737 OD1 ASP A 47 -13.439 9.573 4.526 1.00 0.00 O ATOM 738 OD2 ASP A 47 -11.584 8.645 3.798 1.00 0.00 O ATOM 0 H ASP A 47 -13.844 6.861 2.857 1.00 0.00 H new ATOM 0 HA ASP A 47 -14.549 5.894 5.428 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -12.885 7.495 6.247 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -12.275 6.557 4.898 1.00 0.00 H new ATOM 743 N LYS A 48 -15.877 8.712 4.475 1.00 0.00 N ATOM 744 CA LYS A 48 -16.866 9.728 4.815 1.00 0.00 C ATOM 745 C LYS A 48 -18.264 9.115 4.921 1.00 0.00 C ATOM 746 O LYS A 48 -19.029 9.428 5.833 1.00 0.00 O ATOM 747 CB LYS A 48 -16.860 10.833 3.757 1.00 0.00 C ATOM 748 CG LYS A 48 -17.248 12.200 4.299 1.00 0.00 C ATOM 749 CD LYS A 48 -18.582 12.162 5.021 1.00 0.00 C ATOM 750 CE LYS A 48 -18.913 13.511 5.632 1.00 0.00 C ATOM 751 NZ LYS A 48 -19.009 14.581 4.601 1.00 0.00 N ATOM 0 H LYS A 48 -15.561 8.739 3.506 1.00 0.00 H new ATOM 0 HA LYS A 48 -16.604 10.153 5.784 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -15.865 10.896 3.316 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -17.548 10.561 2.956 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -16.475 12.553 4.982 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -17.299 12.915 3.478 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -19.368 11.873 4.323 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -18.554 11.403 5.802 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -19.857 13.442 6.173 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -18.147 13.777 6.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -19.415 15.438 5.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -18.060 14.794 4.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -19.619 14.259 3.822 1.00 0.00 H new ATOM 765 N LYS A 49 -18.593 8.249 3.969 1.00 0.00 N ATOM 766 CA LYS A 49 -19.904 7.602 3.931 1.00 0.00 C ATOM 767 C LYS A 49 -20.014 6.445 4.920 1.00 0.00 C ATOM 768 O LYS A 49 -20.926 6.403 5.744 1.00 0.00 O ATOM 769 CB LYS A 49 -20.196 7.095 2.517 1.00 0.00 C ATOM 770 CG LYS A 49 -20.170 8.186 1.461 1.00 0.00 C ATOM 771 CD LYS A 49 -20.483 7.631 0.079 1.00 0.00 C ATOM 772 CE LYS A 49 -21.873 7.015 0.027 1.00 0.00 C ATOM 773 NZ LYS A 49 -22.197 6.493 -1.330 1.00 0.00 N ATOM 0 H LYS A 49 -17.969 7.977 3.210 1.00 0.00 H new ATOM 0 HA LYS A 49 -20.639 8.353 4.221 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -19.464 6.331 2.256 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -21.175 6.615 2.507 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -20.895 8.959 1.717 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -19.189 8.660 1.450 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -20.410 8.429 -0.660 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -19.741 6.879 -0.189 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -21.939 6.205 0.753 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -22.613 7.762 0.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -23.152 6.081 -1.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -22.159 7.271 -2.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -21.506 5.762 -1.595 1.00 0.00 H new ATOM 787 N TYR A 50 -19.095 5.498 4.810 1.00 0.00 N ATOM 788 CA TYR A 50 -19.097 4.320 5.671 1.00 0.00 C ATOM 789 C TYR A 50 -18.383 4.568 6.997 1.00 0.00 C ATOM 790 O TYR A 50 -18.523 3.781 7.931 1.00 0.00 O ATOM 791 CB TYR A 50 -18.461 3.137 4.941 1.00 0.00 C ATOM 792 CG TYR A 50 -19.220 2.725 3.700 1.00 0.00 C ATOM 793 CD1 TYR A 50 -19.384 3.607 2.640 1.00 0.00 C ATOM 794 CD2 TYR A 50 -19.781 1.459 3.591 1.00 0.00 C ATOM 795 CE1 TYR A 50 -20.085 3.244 1.509 1.00 0.00 C ATOM 796 CE2 TYR A 50 -20.482 1.085 2.459 1.00 0.00 C ATOM 797 CZ TYR A 50 -20.632 1.981 1.422 1.00 0.00 C ATOM 798 OH TYR A 50 -21.331 1.614 0.295 1.00 0.00 O ATOM 0 H TYR A 50 -18.334 5.521 4.131 1.00 0.00 H new ATOM 0 HA TYR A 50 -20.137 4.090 5.905 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -17.439 3.396 4.665 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -18.402 2.288 5.622 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -18.954 4.596 2.702 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -19.668 0.756 4.403 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -20.205 3.945 0.696 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -20.910 0.096 2.388 1.00 0.00 H new ATOM 0 HH TYR A 50 -21.650 0.692 0.393 1.00 0.00 H new ATOM 808 N ASN A 51 -17.611 5.655 7.060 1.00 0.00 N ATOM 809 CA ASN A 51 -16.851 6.024 8.263 1.00 0.00 C ATOM 810 C ASN A 51 -15.430 5.475 8.177 1.00 0.00 C ATOM 811 O ASN A 51 -15.218 4.354 7.712 1.00 0.00 O ATOM 812 CB ASN A 51 -17.525 5.528 9.549 1.00 0.00 C ATOM 813 CG ASN A 51 -18.970 5.977 9.655 1.00 0.00 C ATOM 814 OD1 ASN A 51 -19.262 7.172 9.658 1.00 0.00 O ATOM 815 ND2 ASN A 51 -19.884 5.017 9.743 1.00 0.00 N ATOM 0 H ASN A 51 -17.493 6.305 6.282 1.00 0.00 H new ATOM 0 HA ASN A 51 -16.822 7.113 8.306 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -17.482 4.439 9.582 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -16.969 5.895 10.412 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -20.872 5.259 9.817 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -19.598 4.038 9.737 1.00 0.00 H new ATOM 822 N PRO A 52 -14.429 6.262 8.611 1.00 0.00 N ATOM 823 CA PRO A 52 -13.024 5.846 8.564 1.00 0.00 C ATOM 824 C PRO A 52 -12.753 4.584 9.386 1.00 0.00 C ATOM 825 O PRO A 52 -13.597 4.166 10.176 1.00 0.00 O ATOM 826 CB PRO A 52 -12.264 7.040 9.156 1.00 0.00 C ATOM 827 CG PRO A 52 -13.199 8.193 9.040 1.00 0.00 C ATOM 828 CD PRO A 52 -14.579 7.617 9.171 1.00 0.00 C ATOM 0 HA PRO A 52 -12.720 5.594 7.548 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.991 6.857 10.195 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -11.338 7.227 8.612 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -13.008 8.931 9.819 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -13.077 8.701 8.083 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -14.908 7.590 10.210 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -15.314 8.202 8.619 1.00 0.00 H new ATOM 836 N THR A 53 -11.576 3.972 9.197 1.00 0.00 N ATOM 837 CA THR A 53 -10.568 4.462 8.260 1.00 0.00 C ATOM 838 C THR A 53 -10.347 3.465 7.130 1.00 0.00 C ATOM 839 O THR A 53 -10.214 2.268 7.373 1.00 0.00 O ATOM 840 CB THR A 53 -9.255 4.712 8.999 1.00 0.00 C ATOM 841 OG1 THR A 53 -8.295 5.298 8.136 1.00 0.00 O ATOM 842 CG2 THR A 53 -8.646 3.452 9.576 1.00 0.00 C ATOM 0 H THR A 53 -11.300 3.124 9.692 1.00 0.00 H new ATOM 0 HA THR A 53 -10.924 5.397 7.826 1.00 0.00 H new ATOM 0 HB THR A 53 -9.508 5.384 9.819 1.00 0.00 H new ATOM 0 HG1 THR A 53 -7.585 4.649 7.948 1.00 0.00 H new ATOM 0 HG21 THR A 53 -7.716 3.699 10.088 1.00 0.00 H new ATOM 0 HG22 THR A 53 -9.342 3.003 10.285 1.00 0.00 H new ATOM 0 HG23 THR A 53 -8.441 2.746 8.772 1.00 0.00 H new ATOM 850 N TRP A 54 -10.319 3.963 5.897 1.00 0.00 N ATOM 851 CA TRP A 54 -10.126 3.105 4.735 1.00 0.00 C ATOM 852 C TRP A 54 -8.713 3.178 4.183 1.00 0.00 C ATOM 853 O TRP A 54 -8.170 4.261 3.960 1.00 0.00 O ATOM 854 CB TRP A 54 -11.118 3.468 3.635 1.00 0.00 C ATOM 855 CG TRP A 54 -12.533 3.213 4.027 1.00 0.00 C ATOM 856 CD1 TRP A 54 -13.222 3.828 5.029 1.00 0.00 C ATOM 857 CD2 TRP A 54 -13.422 2.257 3.448 1.00 0.00 C ATOM 858 NE1 TRP A 54 -14.496 3.328 5.097 1.00 0.00 N ATOM 859 CE2 TRP A 54 -14.644 2.357 4.137 1.00 0.00 C ATOM 860 CE3 TRP A 54 -13.307 1.331 2.407 1.00 0.00 C ATOM 861 CZ2 TRP A 54 -15.742 1.560 3.820 1.00 0.00 C ATOM 862 CZ3 TRP A 54 -14.397 0.540 2.097 1.00 0.00 C ATOM 863 CH2 TRP A 54 -15.600 0.660 2.801 1.00 0.00 C ATOM 0 H TRP A 54 -10.427 4.953 5.678 1.00 0.00 H new ATOM 0 HA TRP A 54 -10.298 2.082 5.071 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -11.001 4.521 3.379 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -10.885 2.894 2.738 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -12.823 4.596 5.674 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -15.217 3.628 5.753 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -12.383 1.236 1.855 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -16.673 1.650 4.360 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -14.319 -0.183 1.298 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -16.434 0.028 2.534 1.00 0.00 H new ATOM 874 N HIS A 55 -8.138 2.011 3.933 1.00 0.00 N ATOM 875 CA HIS A 55 -6.803 1.917 3.369 1.00 0.00 C ATOM 876 C HIS A 55 -6.923 1.561 1.892 1.00 0.00 C ATOM 877 O HIS A 55 -7.636 0.623 1.536 1.00 0.00 O ATOM 878 CB HIS A 55 -5.992 0.853 4.110 1.00 0.00 C ATOM 879 CG HIS A 55 -6.174 0.897 5.595 1.00 0.00 C ATOM 880 ND1 HIS A 55 -5.912 2.017 6.356 1.00 0.00 N ATOM 881 CD2 HIS A 55 -6.610 -0.049 6.460 1.00 0.00 C ATOM 882 CE1 HIS A 55 -6.178 1.757 7.624 1.00 0.00 C ATOM 883 NE2 HIS A 55 -6.603 0.511 7.712 1.00 0.00 N ATOM 0 H HIS A 55 -8.581 1.110 4.114 1.00 0.00 H new ATOM 0 HA HIS A 55 -6.287 2.871 3.475 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -6.280 -0.133 3.745 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -4.935 0.984 3.876 1.00 0.00 H new ATOM 0 HD1 HIS A 55 -5.567 2.907 5.996 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -6.908 -1.057 6.211 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -6.067 2.447 8.448 1.00 0.00 H new ATOM 892 N CYS A 56 -6.258 2.318 1.029 1.00 0.00 N ATOM 893 CA CYS A 56 -6.348 2.062 -0.404 1.00 0.00 C ATOM 894 C CYS A 56 -4.978 2.026 -1.068 1.00 0.00 C ATOM 895 O CYS A 56 -4.067 2.764 -0.695 1.00 0.00 O ATOM 896 CB CYS A 56 -7.221 3.122 -1.076 1.00 0.00 C ATOM 897 SG CYS A 56 -7.530 2.817 -2.831 1.00 0.00 S ATOM 0 H CYS A 56 -5.660 3.102 1.289 1.00 0.00 H new ATOM 0 HA CYS A 56 -6.802 1.079 -0.528 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -8.176 3.176 -0.554 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -6.742 4.095 -0.966 1.00 0.00 H new ATOM 0 HG CYS A 56 -7.635 1.538 -3.037 1.00 0.00 H new ATOM 903 N ILE A 57 -4.850 1.152 -2.060 1.00 0.00 N ATOM 904 CA ILE A 57 -3.610 0.992 -2.801 1.00 0.00 C ATOM 905 C ILE A 57 -3.909 0.540 -4.228 1.00 0.00 C ATOM 906 O ILE A 57 -4.785 -0.295 -4.449 1.00 0.00 O ATOM 907 CB ILE A 57 -2.685 -0.038 -2.126 1.00 0.00 C ATOM 908 CG1 ILE A 57 -2.443 0.339 -0.664 1.00 0.00 C ATOM 909 CG2 ILE A 57 -1.364 -0.141 -2.873 1.00 0.00 C ATOM 910 CD1 ILE A 57 -1.538 -0.627 0.070 1.00 0.00 C ATOM 0 H ILE A 57 -5.602 0.537 -2.371 1.00 0.00 H new ATOM 0 HA ILE A 57 -3.104 1.957 -2.816 1.00 0.00 H new ATOM 0 HB ILE A 57 -3.174 -1.011 -2.157 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -2.005 1.336 -0.623 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -3.401 0.390 -0.147 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -0.724 -0.873 -2.381 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -1.550 -0.454 -3.900 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -0.870 0.830 -2.874 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -1.412 -0.296 1.101 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -1.984 -1.622 0.061 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -0.566 -0.660 -0.422 1.00 0.00 H new ATOM 922 N VAL A 58 -3.190 1.102 -5.193 1.00 0.00 N ATOM 923 CA VAL A 58 -3.400 0.756 -6.593 1.00 0.00 C ATOM 924 C VAL A 58 -2.110 0.888 -7.392 1.00 0.00 C ATOM 925 O VAL A 58 -1.366 1.855 -7.234 1.00 0.00 O ATOM 926 CB VAL A 58 -4.483 1.652 -7.231 1.00 0.00 C ATOM 927 CG1 VAL A 58 -4.752 1.243 -8.674 1.00 0.00 C ATOM 928 CG2 VAL A 58 -5.763 1.603 -6.411 1.00 0.00 C ATOM 0 H VAL A 58 -2.460 1.796 -5.032 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.732 -0.282 -6.619 1.00 0.00 H new ATOM 0 HB VAL A 58 -4.114 2.678 -7.237 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -5.519 1.891 -9.099 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.835 1.337 -9.256 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.095 0.209 -8.701 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -6.516 2.240 -6.874 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -6.130 0.577 -6.370 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -5.561 1.956 -5.400 1.00 0.00 H new ATOM 938 N GLY A 59 -1.851 -0.094 -8.249 1.00 0.00 N ATOM 939 CA GLY A 59 -0.648 -0.069 -9.059 1.00 0.00 C ATOM 940 C GLY A 59 -0.508 -1.303 -9.931 1.00 0.00 C ATOM 941 O GLY A 59 -1.460 -1.717 -10.593 1.00 0.00 O ATOM 0 H GLY A 59 -2.452 -0.905 -8.397 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -0.658 0.819 -9.691 1.00 0.00 H new ATOM 0 HA3 GLY A 59 0.223 0.013 -8.408 1.00 0.00 H new ATOM 945 N ARG A 60 0.686 -1.888 -9.933 1.00 0.00 N ATOM 946 CA ARG A 60 0.953 -3.081 -10.734 1.00 0.00 C ATOM 947 C ARG A 60 2.358 -3.616 -10.463 1.00 0.00 C ATOM 948 O ARG A 60 3.091 -3.963 -11.386 1.00 0.00 O ATOM 949 CB ARG A 60 0.791 -2.758 -12.222 1.00 0.00 C ATOM 950 CG ARG A 60 0.888 -3.973 -13.131 1.00 0.00 C ATOM 951 CD ARG A 60 0.797 -3.574 -14.595 1.00 0.00 C ATOM 952 NE ARG A 60 1.856 -2.640 -14.971 1.00 0.00 N ATOM 953 CZ ARG A 60 2.010 -2.148 -16.198 1.00 0.00 C ATOM 954 NH1 ARG A 60 1.179 -2.502 -17.171 1.00 0.00 N ATOM 955 NH2 ARG A 60 2.997 -1.301 -16.455 1.00 0.00 N ATOM 0 H ARG A 60 1.484 -1.557 -9.390 1.00 0.00 H new ATOM 0 HA ARG A 60 0.235 -3.851 -10.454 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -0.175 -2.277 -12.376 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.555 -2.037 -12.513 1.00 0.00 H new ATOM 0 HG2 ARG A 60 1.830 -4.491 -12.951 1.00 0.00 H new ATOM 0 HG3 ARG A 60 0.088 -4.674 -12.892 1.00 0.00 H new ATOM 0 HD2 ARG A 60 0.860 -4.465 -15.219 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -0.174 -3.119 -14.788 1.00 0.00 H new ATOM 0 HE ARG A 60 2.516 -2.348 -14.250 1.00 0.00 H new ATOM 0 HH11 ARG A 60 0.418 -3.154 -16.980 1.00 0.00 H new ATOM 0 HH12 ARG A 60 1.301 -2.122 -18.110 1.00 0.00 H new ATOM 0 HH21 ARG A 60 3.639 -1.026 -15.712 1.00 0.00 H new ATOM 0 HH22 ARG A 60 3.114 -0.925 -17.396 1.00 0.00 H new ATOM 969 N ASN A 61 2.718 -3.672 -9.182 1.00 0.00 N ATOM 970 CA ASN A 61 4.028 -4.153 -8.740 1.00 0.00 C ATOM 971 C ASN A 61 4.296 -3.668 -7.320 1.00 0.00 C ATOM 972 O ASN A 61 4.937 -2.634 -7.128 1.00 0.00 O ATOM 973 CB ASN A 61 5.149 -3.660 -9.667 1.00 0.00 C ATOM 974 CG ASN A 61 6.537 -4.133 -9.250 1.00 0.00 C ATOM 975 OD1 ASN A 61 7.542 -3.658 -9.780 1.00 0.00 O ATOM 976 ND2 ASN A 61 6.612 -5.088 -8.321 1.00 0.00 N ATOM 0 H ASN A 61 2.107 -3.384 -8.417 1.00 0.00 H new ATOM 0 HA ASN A 61 4.016 -5.243 -8.769 1.00 0.00 H new ATOM 0 HB2 ASN A 61 4.947 -4.003 -10.682 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.137 -2.570 -9.690 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.522 -5.446 -8.030 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.760 -5.460 -7.902 1.00 0.00 H new ATOM 983 N PHE A 62 3.793 -4.392 -6.323 1.00 0.00 N ATOM 984 CA PHE A 62 3.988 -3.974 -4.935 1.00 0.00 C ATOM 985 C PHE A 62 3.560 -5.035 -3.927 1.00 0.00 C ATOM 986 O PHE A 62 2.495 -5.638 -4.044 1.00 0.00 O ATOM 987 CB PHE A 62 3.196 -2.698 -4.669 1.00 0.00 C ATOM 988 CG PHE A 62 1.707 -2.903 -4.684 1.00 0.00 C ATOM 989 CD1 PHE A 62 1.064 -3.331 -5.833 1.00 0.00 C ATOM 990 CD2 PHE A 62 0.950 -2.674 -3.545 1.00 0.00 C ATOM 991 CE1 PHE A 62 -0.304 -3.525 -5.850 1.00 0.00 C ATOM 992 CE2 PHE A 62 -0.417 -2.868 -3.555 1.00 0.00 C ATOM 993 CZ PHE A 62 -1.046 -3.293 -4.709 1.00 0.00 C ATOM 0 H PHE A 62 3.259 -5.252 -6.444 1.00 0.00 H new ATOM 0 HA PHE A 62 5.057 -3.808 -4.805 1.00 0.00 H new ATOM 0 HB2 PHE A 62 3.489 -2.293 -3.701 1.00 0.00 H new ATOM 0 HB3 PHE A 62 3.460 -1.953 -5.419 1.00 0.00 H new ATOM 0 HD1 PHE A 62 1.639 -3.516 -6.728 1.00 0.00 H new ATOM 0 HD2 PHE A 62 1.435 -2.340 -2.640 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.792 -3.858 -6.754 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -0.995 -2.687 -2.660 1.00 0.00 H new ATOM 0 HZ PHE A 62 -2.115 -3.443 -4.719 1.00 0.00 H new ATOM 1003 N GLY A 63 4.391 -5.209 -2.907 1.00 0.00 N ATOM 1004 CA GLY A 63 4.091 -6.146 -1.838 1.00 0.00 C ATOM 1005 C GLY A 63 3.815 -5.405 -0.546 1.00 0.00 C ATOM 1006 O GLY A 63 4.541 -4.470 -0.212 1.00 0.00 O ATOM 0 H GLY A 63 5.276 -4.713 -2.800 1.00 0.00 H new ATOM 0 HA2 GLY A 63 3.226 -6.751 -2.109 1.00 0.00 H new ATOM 0 HA3 GLY A 63 4.928 -6.830 -1.700 1.00 0.00 H new ATOM 1010 N SER A 64 2.759 -5.777 0.176 1.00 0.00 N ATOM 1011 CA SER A 64 2.434 -5.062 1.409 1.00 0.00 C ATOM 1012 C SER A 64 1.630 -5.893 2.406 1.00 0.00 C ATOM 1013 O SER A 64 0.882 -6.800 2.038 1.00 0.00 O ATOM 1014 CB SER A 64 1.657 -3.790 1.074 1.00 0.00 C ATOM 1015 OG SER A 64 0.489 -4.086 0.328 1.00 0.00 O ATOM 0 H SER A 64 2.131 -6.545 -0.061 1.00 0.00 H new ATOM 0 HA SER A 64 3.385 -4.827 1.888 1.00 0.00 H new ATOM 0 HB2 SER A 64 1.383 -3.275 1.995 1.00 0.00 H new ATOM 0 HB3 SER A 64 2.293 -3.111 0.506 1.00 0.00 H new ATOM 0 HG SER A 64 0.009 -3.255 0.128 1.00 0.00 H new ATOM 1021 N TYR A 65 1.788 -5.528 3.680 1.00 0.00 N ATOM 1022 CA TYR A 65 1.085 -6.169 4.788 1.00 0.00 C ATOM 1023 C TYR A 65 0.318 -5.118 5.585 1.00 0.00 C ATOM 1024 O TYR A 65 0.793 -3.995 5.759 1.00 0.00 O ATOM 1025 CB TYR A 65 2.063 -6.904 5.705 1.00 0.00 C ATOM 1026 CG TYR A 65 2.457 -8.276 5.208 1.00 0.00 C ATOM 1027 CD1 TYR A 65 1.498 -9.261 5.011 1.00 0.00 C ATOM 1028 CD2 TYR A 65 3.783 -8.590 4.949 1.00 0.00 C ATOM 1029 CE1 TYR A 65 1.848 -10.520 4.568 1.00 0.00 C ATOM 1030 CE2 TYR A 65 4.143 -9.848 4.503 1.00 0.00 C ATOM 1031 CZ TYR A 65 3.172 -10.810 4.316 1.00 0.00 C ATOM 1032 OH TYR A 65 3.526 -12.063 3.874 1.00 0.00 O ATOM 0 H TYR A 65 2.411 -4.775 3.971 1.00 0.00 H new ATOM 0 HA TYR A 65 0.387 -6.899 4.378 1.00 0.00 H new ATOM 0 HB2 TYR A 65 2.962 -6.299 5.821 1.00 0.00 H new ATOM 0 HB3 TYR A 65 1.615 -7.002 6.694 1.00 0.00 H new ATOM 0 HD1 TYR A 65 0.460 -9.038 5.208 1.00 0.00 H new ATOM 0 HD2 TYR A 65 4.546 -7.840 5.098 1.00 0.00 H new ATOM 0 HE1 TYR A 65 1.089 -11.274 4.420 1.00 0.00 H new ATOM 0 HE2 TYR A 65 5.179 -10.077 4.302 1.00 0.00 H new ATOM 0 HH TYR A 65 4.496 -12.102 3.743 1.00 0.00 H new ATOM 1042 N VAL A 66 -0.874 -5.473 6.049 1.00 0.00 N ATOM 1043 CA VAL A 66 -1.710 -4.541 6.804 1.00 0.00 C ATOM 1044 C VAL A 66 -2.719 -5.284 7.671 1.00 0.00 C ATOM 1045 O VAL A 66 -3.003 -6.449 7.434 1.00 0.00 O ATOM 1046 CB VAL A 66 -2.497 -3.615 5.855 1.00 0.00 C ATOM 1047 CG1 VAL A 66 -3.198 -2.510 6.628 1.00 0.00 C ATOM 1048 CG2 VAL A 66 -1.591 -3.029 4.783 1.00 0.00 C ATOM 0 H VAL A 66 -1.285 -6.397 5.917 1.00 0.00 H new ATOM 0 HA VAL A 66 -1.039 -3.955 7.433 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.258 -4.219 5.360 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.745 -1.872 5.934 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.894 -2.951 7.342 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.458 -1.914 7.163 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -2.174 -2.380 4.129 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.797 -2.450 5.254 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.152 -3.836 4.196 1.00 0.00 H new ATOM 1058 N THR A 67 -3.274 -4.595 8.662 1.00 0.00 N ATOM 1059 CA THR A 67 -4.279 -5.184 9.543 1.00 0.00 C ATOM 1060 C THR A 67 -5.602 -4.455 9.357 1.00 0.00 C ATOM 1061 O THR A 67 -5.620 -3.297 8.937 1.00 0.00 O ATOM 1062 CB THR A 67 -3.830 -5.116 11.004 1.00 0.00 C ATOM 1063 OG1 THR A 67 -2.610 -5.811 11.185 1.00 0.00 O ATOM 1064 CG2 THR A 67 -4.839 -5.698 11.968 1.00 0.00 C ATOM 0 H THR A 67 -3.045 -3.625 8.877 1.00 0.00 H new ATOM 0 HA THR A 67 -4.406 -6.235 9.283 1.00 0.00 H new ATOM 0 HB THR A 67 -3.716 -4.054 11.223 1.00 0.00 H new ATOM 0 HG1 THR A 67 -2.338 -5.755 12.125 1.00 0.00 H new ATOM 0 HG21 THR A 67 -4.458 -5.618 12.986 1.00 0.00 H new ATOM 0 HG22 THR A 67 -5.777 -5.149 11.888 1.00 0.00 H new ATOM 0 HG23 THR A 67 -5.010 -6.747 11.726 1.00 0.00 H new ATOM 1072 N HIS A 68 -6.713 -5.132 9.629 1.00 0.00 N ATOM 1073 CA HIS A 68 -8.019 -4.515 9.434 1.00 0.00 C ATOM 1074 C HIS A 68 -9.148 -5.314 10.072 1.00 0.00 C ATOM 1075 O HIS A 68 -9.087 -6.539 10.176 1.00 0.00 O ATOM 1076 CB HIS A 68 -8.270 -4.380 7.940 1.00 0.00 C ATOM 1077 CG HIS A 68 -8.129 -5.682 7.221 1.00 0.00 C ATOM 1078 ND1 HIS A 68 -9.077 -6.680 7.277 1.00 0.00 N ATOM 1079 CD2 HIS A 68 -7.115 -6.172 6.467 1.00 0.00 C ATOM 1080 CE1 HIS A 68 -8.656 -7.726 6.590 1.00 0.00 C ATOM 1081 NE2 HIS A 68 -7.468 -7.444 6.087 1.00 0.00 N ATOM 0 H HIS A 68 -6.737 -6.090 9.979 1.00 0.00 H new ATOM 0 HA HIS A 68 -8.007 -3.540 9.922 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -9.272 -3.984 7.777 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -7.570 -3.658 7.520 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -9.967 -6.620 7.773 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -6.200 -5.658 6.212 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -9.192 -8.655 6.461 1.00 0.00 H new ATOM 1090 N GLU A 69 -10.186 -4.594 10.484 1.00 0.00 N ATOM 1091 CA GLU A 69 -11.358 -5.197 11.103 1.00 0.00 C ATOM 1092 C GLU A 69 -12.023 -6.197 10.158 1.00 0.00 C ATOM 1093 O GLU A 69 -12.132 -5.952 8.956 1.00 0.00 O ATOM 1094 CB GLU A 69 -12.349 -4.097 11.494 1.00 0.00 C ATOM 1095 CG GLU A 69 -13.642 -4.619 12.092 1.00 0.00 C ATOM 1096 CD GLU A 69 -14.587 -3.508 12.506 1.00 0.00 C ATOM 1097 OE1 GLU A 69 -14.230 -2.323 12.326 1.00 0.00 O ATOM 1098 OE2 GLU A 69 -15.686 -3.822 13.011 1.00 0.00 O ATOM 0 H GLU A 69 -10.237 -3.579 10.398 1.00 0.00 H new ATOM 0 HA GLU A 69 -11.044 -5.738 11.995 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -11.872 -3.430 12.212 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -12.583 -3.501 10.611 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -14.140 -5.262 11.366 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -13.412 -5.237 12.960 1.00 0.00 H new ATOM 1105 N THR A 70 -12.463 -7.327 10.709 1.00 0.00 N ATOM 1106 CA THR A 70 -13.116 -8.368 9.916 1.00 0.00 C ATOM 1107 C THR A 70 -14.328 -7.822 9.168 1.00 0.00 C ATOM 1108 O THR A 70 -14.995 -6.904 9.640 1.00 0.00 O ATOM 1109 CB THR A 70 -13.541 -9.533 10.807 1.00 0.00 C ATOM 1110 OG1 THR A 70 -14.438 -9.095 11.811 1.00 0.00 O ATOM 1111 CG2 THR A 70 -12.381 -10.219 11.493 1.00 0.00 C ATOM 0 H THR A 70 -12.379 -7.545 11.702 1.00 0.00 H new ATOM 0 HA THR A 70 -12.392 -8.722 9.182 1.00 0.00 H new ATOM 0 HB THR A 70 -14.017 -10.249 10.137 1.00 0.00 H new ATOM 0 HG1 THR A 70 -14.700 -9.856 12.370 1.00 0.00 H new ATOM 0 HG21 THR A 70 -12.755 -11.036 12.110 1.00 0.00 H new ATOM 0 HG22 THR A 70 -11.697 -10.614 10.742 1.00 0.00 H new ATOM 0 HG23 THR A 70 -11.854 -9.501 12.122 1.00 0.00 H new ATOM 1119 N LYS A 71 -14.596 -8.393 7.995 1.00 0.00 N ATOM 1120 CA LYS A 71 -15.719 -7.965 7.163 1.00 0.00 C ATOM 1121 C LYS A 71 -15.496 -6.551 6.648 1.00 0.00 C ATOM 1122 O LYS A 71 -16.435 -5.764 6.525 1.00 0.00 O ATOM 1123 CB LYS A 71 -17.037 -8.042 7.934 1.00 0.00 C ATOM 1124 CG LYS A 71 -17.435 -9.455 8.326 1.00 0.00 C ATOM 1125 CD LYS A 71 -17.552 -10.359 7.109 1.00 0.00 C ATOM 1126 CE LYS A 71 -17.967 -11.768 7.502 1.00 0.00 C ATOM 1127 NZ LYS A 71 -19.285 -11.787 8.193 1.00 0.00 N ATOM 0 H LYS A 71 -14.048 -9.156 7.598 1.00 0.00 H new ATOM 0 HA LYS A 71 -15.780 -8.644 6.312 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -16.956 -7.434 8.835 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -17.830 -7.607 7.325 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -16.696 -9.864 9.015 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -18.387 -9.432 8.856 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -18.282 -9.944 6.414 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -16.597 -10.392 6.585 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -18.015 -12.394 6.611 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -17.209 -12.201 8.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -19.642 -12.763 8.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -19.176 -11.419 9.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -19.960 -11.192 7.671 1.00 0.00 H new ATOM 1141 N HIS A 72 -14.244 -6.245 6.344 1.00 0.00 N ATOM 1142 CA HIS A 72 -13.871 -4.930 5.832 1.00 0.00 C ATOM 1143 C HIS A 72 -12.549 -5.019 5.077 1.00 0.00 C ATOM 1144 O HIS A 72 -11.583 -4.331 5.408 1.00 0.00 O ATOM 1145 CB HIS A 72 -13.756 -3.910 6.970 1.00 0.00 C ATOM 1146 CG HIS A 72 -15.025 -3.714 7.743 1.00 0.00 C ATOM 1147 ND1 HIS A 72 -15.510 -4.634 8.646 1.00 0.00 N ATOM 1148 CD2 HIS A 72 -15.916 -2.694 7.735 1.00 0.00 C ATOM 1149 CE1 HIS A 72 -16.642 -4.190 9.161 1.00 0.00 C ATOM 1150 NE2 HIS A 72 -16.912 -3.014 8.626 1.00 0.00 N ATOM 0 H HIS A 72 -13.462 -6.893 6.443 1.00 0.00 H new ATOM 0 HA HIS A 72 -14.653 -4.595 5.150 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -12.971 -4.232 7.655 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -13.444 -2.952 6.555 1.00 0.00 H new ATOM 0 HD1 HIS A 72 -15.064 -5.521 8.881 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -15.855 -1.796 7.139 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -17.245 -4.703 9.896 1.00 0.00 H new ATOM 1159 N PHE A 73 -12.512 -5.885 4.069 1.00 0.00 N ATOM 1160 CA PHE A 73 -11.308 -6.083 3.270 1.00 0.00 C ATOM 1161 C PHE A 73 -11.655 -6.557 1.863 1.00 0.00 C ATOM 1162 O PHE A 73 -12.543 -7.390 1.681 1.00 0.00 O ATOM 1163 CB PHE A 73 -10.388 -7.090 3.966 1.00 0.00 C ATOM 1164 CG PHE A 73 -9.228 -7.543 3.126 1.00 0.00 C ATOM 1165 CD1 PHE A 73 -8.321 -6.629 2.615 1.00 0.00 C ATOM 1166 CD2 PHE A 73 -9.048 -8.888 2.848 1.00 0.00 C ATOM 1167 CE1 PHE A 73 -7.256 -7.048 1.842 1.00 0.00 C ATOM 1168 CE2 PHE A 73 -7.984 -9.312 2.076 1.00 0.00 C ATOM 1169 CZ PHE A 73 -7.087 -8.392 1.573 1.00 0.00 C ATOM 0 H PHE A 73 -13.304 -6.462 3.786 1.00 0.00 H new ATOM 0 HA PHE A 73 -10.790 -5.129 3.179 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -10.006 -6.643 4.884 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -10.975 -7.961 4.257 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -8.448 -5.577 2.823 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -9.747 -9.613 3.239 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -6.556 -6.326 1.448 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.854 -10.363 1.866 1.00 0.00 H new ATOM 0 HZ PHE A 73 -6.254 -8.722 0.970 1.00 0.00 H new ATOM 1179 N ILE A 74 -10.955 -6.015 0.866 1.00 0.00 N ATOM 1180 CA ILE A 74 -11.208 -6.388 -0.520 1.00 0.00 C ATOM 1181 C ILE A 74 -10.043 -6.015 -1.435 1.00 0.00 C ATOM 1182 O ILE A 74 -9.423 -4.962 -1.282 1.00 0.00 O ATOM 1183 CB ILE A 74 -12.492 -5.716 -1.044 1.00 0.00 C ATOM 1184 CG1 ILE A 74 -12.750 -6.110 -2.500 1.00 0.00 C ATOM 1185 CG2 ILE A 74 -12.390 -4.204 -0.910 1.00 0.00 C ATOM 1186 CD1 ILE A 74 -13.997 -5.484 -3.079 1.00 0.00 C ATOM 0 H ILE A 74 -10.216 -5.323 0.993 1.00 0.00 H new ATOM 0 HA ILE A 74 -11.327 -7.471 -0.534 1.00 0.00 H new ATOM 0 HB ILE A 74 -13.333 -6.061 -0.442 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -11.892 -5.818 -3.105 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -12.833 -7.195 -2.566 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -13.304 -3.743 -1.284 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -12.253 -3.940 0.139 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -11.539 -3.844 -1.488 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -14.119 -5.806 -4.113 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -14.864 -5.796 -2.497 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -13.909 -4.398 -3.045 1.00 0.00 H new ATOM 1198 N TYR A 75 -9.772 -6.890 -2.397 1.00 0.00 N ATOM 1199 CA TYR A 75 -8.704 -6.683 -3.369 1.00 0.00 C ATOM 1200 C TYR A 75 -9.168 -7.187 -4.730 1.00 0.00 C ATOM 1201 O TYR A 75 -9.797 -8.242 -4.821 1.00 0.00 O ATOM 1202 CB TYR A 75 -7.435 -7.421 -2.935 1.00 0.00 C ATOM 1203 CG TYR A 75 -6.205 -7.047 -3.730 1.00 0.00 C ATOM 1204 CD1 TYR A 75 -6.132 -7.284 -5.096 1.00 0.00 C ATOM 1205 CD2 TYR A 75 -5.113 -6.452 -3.109 1.00 0.00 C ATOM 1206 CE1 TYR A 75 -5.008 -6.939 -5.821 1.00 0.00 C ATOM 1207 CE2 TYR A 75 -3.986 -6.103 -3.827 1.00 0.00 C ATOM 1208 CZ TYR A 75 -3.938 -6.350 -5.183 1.00 0.00 C ATOM 1209 OH TYR A 75 -2.817 -6.008 -5.901 1.00 0.00 O ATOM 0 H TYR A 75 -10.286 -7.762 -2.525 1.00 0.00 H new ATOM 0 HA TYR A 75 -8.473 -5.620 -3.432 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -7.250 -7.216 -1.881 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -7.602 -8.494 -3.026 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -6.968 -7.746 -5.600 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -5.146 -6.259 -2.047 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -4.968 -7.130 -6.883 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -3.147 -5.639 -3.329 1.00 0.00 H new ATOM 0 HH TYR A 75 -2.388 -5.231 -5.486 1.00 0.00 H new ATOM 1219 N PHE A 76 -8.883 -6.433 -5.787 1.00 0.00 N ATOM 1220 CA PHE A 76 -9.313 -6.833 -7.122 1.00 0.00 C ATOM 1221 C PHE A 76 -8.618 -6.026 -8.214 1.00 0.00 C ATOM 1222 O PHE A 76 -8.413 -4.820 -8.080 1.00 0.00 O ATOM 1223 CB PHE A 76 -10.832 -6.673 -7.243 1.00 0.00 C ATOM 1224 CG PHE A 76 -11.310 -5.260 -7.050 1.00 0.00 C ATOM 1225 CD1 PHE A 76 -11.037 -4.285 -7.996 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -12.028 -4.906 -5.917 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -11.472 -2.985 -7.818 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -12.466 -3.607 -5.736 1.00 0.00 C ATOM 1229 CZ PHE A 76 -12.187 -2.646 -6.689 1.00 0.00 C ATOM 0 H PHE A 76 -8.365 -5.555 -5.748 1.00 0.00 H new ATOM 0 HA PHE A 76 -9.036 -7.878 -7.261 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -11.148 -7.023 -8.226 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -11.316 -7.314 -6.506 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -10.478 -4.544 -8.883 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -12.247 -5.653 -5.168 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -11.252 -2.235 -8.563 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -13.026 -3.344 -4.851 1.00 0.00 H new ATOM 0 HZ PHE A 76 -12.529 -1.631 -6.550 1.00 0.00 H new ATOM 1239 N TYR A 77 -8.277 -6.703 -9.307 1.00 0.00 N ATOM 1240 CA TYR A 77 -7.629 -6.057 -10.442 1.00 0.00 C ATOM 1241 C TYR A 77 -8.684 -5.481 -11.381 1.00 0.00 C ATOM 1242 O TYR A 77 -9.810 -5.973 -11.430 1.00 0.00 O ATOM 1243 CB TYR A 77 -6.738 -7.048 -11.196 1.00 0.00 C ATOM 1244 CG TYR A 77 -5.614 -7.624 -10.363 1.00 0.00 C ATOM 1245 CD1 TYR A 77 -5.878 -8.447 -9.275 1.00 0.00 C ATOM 1246 CD2 TYR A 77 -4.288 -7.342 -10.665 1.00 0.00 C ATOM 1247 CE1 TYR A 77 -4.852 -8.973 -8.514 1.00 0.00 C ATOM 1248 CE2 TYR A 77 -3.256 -7.866 -9.908 1.00 0.00 C ATOM 1249 CZ TYR A 77 -3.544 -8.680 -8.833 1.00 0.00 C ATOM 1250 OH TYR A 77 -2.520 -9.202 -8.077 1.00 0.00 O ATOM 0 H TYR A 77 -8.440 -7.702 -9.430 1.00 0.00 H new ATOM 0 HA TYR A 77 -7.000 -5.249 -10.068 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -7.356 -7.865 -11.568 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -6.312 -6.548 -12.066 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -6.902 -8.679 -9.020 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -4.059 -6.703 -11.505 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -5.074 -9.612 -7.672 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -2.230 -7.639 -10.158 1.00 0.00 H new ATOM 0 HH TYR A 77 -1.660 -8.899 -8.437 1.00 0.00 H new ATOM 1260 N LEU A 78 -8.326 -4.436 -12.118 1.00 0.00 N ATOM 1261 CA LEU A 78 -9.268 -3.807 -13.039 1.00 0.00 C ATOM 1262 C LEU A 78 -8.555 -2.966 -14.095 1.00 0.00 C ATOM 1263 O LEU A 78 -7.596 -2.252 -13.797 1.00 0.00 O ATOM 1264 CB LEU A 78 -10.257 -2.934 -12.263 1.00 0.00 C ATOM 1265 CG LEU A 78 -11.296 -2.208 -13.122 1.00 0.00 C ATOM 1266 CD1 LEU A 78 -12.169 -3.205 -13.868 1.00 0.00 C ATOM 1267 CD2 LEU A 78 -12.148 -1.288 -12.259 1.00 0.00 C ATOM 0 H LEU A 78 -7.400 -4.009 -12.098 1.00 0.00 H new ATOM 0 HA LEU A 78 -9.806 -4.603 -13.554 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -10.780 -3.560 -11.540 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -9.695 -2.192 -11.696 1.00 0.00 H new ATOM 0 HG LEU A 78 -10.770 -1.601 -13.859 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -12.900 -2.668 -14.472 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -11.546 -3.821 -14.516 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -12.688 -3.842 -13.151 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.882 -0.779 -12.884 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.664 -1.876 -11.500 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -11.510 -0.549 -11.774 1.00 0.00 H new ATOM 1279 N GLY A 79 -9.037 -3.068 -15.333 1.00 0.00 N ATOM 1280 CA GLY A 79 -8.458 -2.328 -16.438 1.00 0.00 C ATOM 1281 C GLY A 79 -7.064 -2.802 -16.766 1.00 0.00 C ATOM 1282 O GLY A 79 -6.829 -3.383 -17.826 1.00 0.00 O ATOM 0 H GLY A 79 -9.828 -3.658 -15.589 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -9.093 -2.433 -17.317 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.431 -1.267 -16.190 1.00 0.00 H new ATOM 1286 N GLN A 80 -6.143 -2.569 -15.846 1.00 0.00 N ATOM 1287 CA GLN A 80 -4.763 -2.986 -16.020 1.00 0.00 C ATOM 1288 C GLN A 80 -3.935 -2.580 -14.805 1.00 0.00 C ATOM 1289 O GLN A 80 -2.769 -2.207 -14.930 1.00 0.00 O ATOM 1290 CB GLN A 80 -4.174 -2.375 -17.297 1.00 0.00 C ATOM 1291 CG GLN A 80 -2.790 -2.899 -17.652 1.00 0.00 C ATOM 1292 CD GLN A 80 -2.275 -2.334 -18.961 1.00 0.00 C ATOM 1293 OE1 GLN A 80 -2.871 -2.542 -20.019 1.00 0.00 O ATOM 1294 NE2 GLN A 80 -1.162 -1.613 -18.898 1.00 0.00 N ATOM 0 H GLN A 80 -6.329 -2.090 -14.965 1.00 0.00 H new ATOM 0 HA GLN A 80 -4.736 -4.072 -16.115 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -4.851 -2.573 -18.128 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -4.122 -1.293 -17.179 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -2.093 -2.648 -16.852 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -2.822 -3.987 -17.717 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -0.700 -1.465 -18.001 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -0.769 -1.207 -19.747 1.00 0.00 H new ATOM 1303 N VAL A 81 -4.550 -2.655 -13.628 1.00 0.00 N ATOM 1304 CA VAL A 81 -3.876 -2.294 -12.385 1.00 0.00 C ATOM 1305 C VAL A 81 -4.579 -2.917 -11.185 1.00 0.00 C ATOM 1306 O VAL A 81 -5.807 -2.897 -11.091 1.00 0.00 O ATOM 1307 CB VAL A 81 -3.824 -0.764 -12.191 1.00 0.00 C ATOM 1308 CG1 VAL A 81 -3.009 -0.107 -13.293 1.00 0.00 C ATOM 1309 CG2 VAL A 81 -5.230 -0.182 -12.141 1.00 0.00 C ATOM 0 H VAL A 81 -5.515 -2.963 -13.509 1.00 0.00 H new ATOM 0 HA VAL A 81 -2.858 -2.678 -12.455 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.334 -0.558 -11.239 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.986 0.971 -13.135 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.992 -0.498 -13.275 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -3.464 -0.323 -14.260 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -5.172 0.898 -12.004 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -5.748 -0.402 -13.074 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -5.778 -0.625 -11.309 1.00 0.00 H new ATOM 1319 N ALA A 82 -3.792 -3.468 -10.267 1.00 0.00 N ATOM 1320 CA ALA A 82 -4.340 -4.093 -9.071 1.00 0.00 C ATOM 1321 C ALA A 82 -4.917 -3.045 -8.127 1.00 0.00 C ATOM 1322 O ALA A 82 -4.263 -2.050 -7.814 1.00 0.00 O ATOM 1323 CB ALA A 82 -3.268 -4.912 -8.365 1.00 0.00 C ATOM 0 H ALA A 82 -2.774 -3.494 -10.329 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.148 -4.760 -9.373 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -3.691 -5.373 -7.473 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -2.902 -5.689 -9.037 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -2.442 -4.261 -8.079 1.00 0.00 H new ATOM 1329 N ILE A 83 -6.147 -3.273 -7.679 1.00 0.00 N ATOM 1330 CA ILE A 83 -6.813 -2.348 -6.773 1.00 0.00 C ATOM 1331 C ILE A 83 -7.021 -2.981 -5.402 1.00 0.00 C ATOM 1332 O ILE A 83 -7.327 -4.168 -5.294 1.00 0.00 O ATOM 1333 CB ILE A 83 -8.174 -1.888 -7.335 1.00 0.00 C ATOM 1334 CG1 ILE A 83 -7.990 -1.270 -8.721 1.00 0.00 C ATOM 1335 CG2 ILE A 83 -8.834 -0.892 -6.389 1.00 0.00 C ATOM 1336 CD1 ILE A 83 -9.286 -0.809 -9.355 1.00 0.00 C ATOM 0 H ILE A 83 -6.702 -4.091 -7.929 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.164 -1.478 -6.672 1.00 0.00 H new ATOM 0 HB ILE A 83 -8.826 -2.757 -7.425 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -7.311 -0.421 -8.644 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -7.515 -2.001 -9.375 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.793 -0.579 -6.802 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.993 -1.362 -5.419 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.189 -0.022 -6.269 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -9.079 -0.381 -10.336 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.960 -1.659 -9.464 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -9.753 -0.055 -8.722 1.00 0.00 H new ATOM 1348 N LEU A 84 -6.853 -2.179 -4.357 1.00 0.00 N ATOM 1349 CA LEU A 84 -7.020 -2.658 -2.991 1.00 0.00 C ATOM 1350 C LEU A 84 -7.771 -1.637 -2.146 1.00 0.00 C ATOM 1351 O LEU A 84 -7.565 -0.430 -2.282 1.00 0.00 O ATOM 1352 CB LEU A 84 -5.658 -2.953 -2.360 1.00 0.00 C ATOM 1353 CG LEU A 84 -5.705 -3.398 -0.897 1.00 0.00 C ATOM 1354 CD1 LEU A 84 -6.541 -4.663 -0.749 1.00 0.00 C ATOM 1355 CD2 LEU A 84 -4.297 -3.619 -0.364 1.00 0.00 C ATOM 0 H LEU A 84 -6.601 -1.193 -4.430 1.00 0.00 H new ATOM 0 HA LEU A 84 -7.604 -3.578 -3.025 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.164 -3.729 -2.944 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -5.040 -2.058 -2.432 1.00 0.00 H new ATOM 0 HG LEU A 84 -6.175 -2.609 -0.310 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -6.563 -4.964 0.298 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -7.557 -4.470 -1.092 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.102 -5.461 -1.347 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -4.348 -3.935 0.678 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -3.802 -4.390 -0.954 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -3.731 -2.690 -0.434 1.00 0.00 H new ATOM 1367 N LEU A 85 -8.646 -2.127 -1.274 1.00 0.00 N ATOM 1368 CA LEU A 85 -9.429 -1.258 -0.409 1.00 0.00 C ATOM 1369 C LEU A 85 -9.925 -2.029 0.808 1.00 0.00 C ATOM 1370 O LEU A 85 -10.397 -3.160 0.690 1.00 0.00 O ATOM 1371 CB LEU A 85 -10.614 -0.667 -1.173 1.00 0.00 C ATOM 1372 CG LEU A 85 -11.476 0.311 -0.372 1.00 0.00 C ATOM 1373 CD1 LEU A 85 -10.652 1.510 0.068 1.00 0.00 C ATOM 1374 CD2 LEU A 85 -12.676 0.758 -1.194 1.00 0.00 C ATOM 0 H LEU A 85 -8.829 -3.123 -1.149 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.789 -0.442 -0.073 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -10.237 -0.155 -2.058 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -11.246 -1.484 -1.522 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.841 -0.199 0.519 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -11.281 2.195 0.636 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -9.825 1.173 0.693 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -10.258 2.023 -0.810 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -13.279 1.453 -0.610 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -12.331 1.252 -2.103 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -13.279 -0.110 -1.459 1.00 0.00 H new ATOM 1386 N PHE A 86 -9.804 -1.416 1.978 1.00 0.00 N ATOM 1387 CA PHE A 86 -10.232 -2.054 3.213 1.00 0.00 C ATOM 1388 C PHE A 86 -10.135 -1.091 4.392 1.00 0.00 C ATOM 1389 O PHE A 86 -9.091 -0.480 4.623 1.00 0.00 O ATOM 1390 CB PHE A 86 -9.379 -3.296 3.473 1.00 0.00 C ATOM 1391 CG PHE A 86 -7.908 -3.016 3.615 1.00 0.00 C ATOM 1392 CD1 PHE A 86 -7.174 -2.503 2.558 1.00 0.00 C ATOM 1393 CD2 PHE A 86 -7.262 -3.276 4.810 1.00 0.00 C ATOM 1394 CE1 PHE A 86 -5.821 -2.255 2.692 1.00 0.00 C ATOM 1395 CE2 PHE A 86 -5.911 -3.029 4.952 1.00 0.00 C ATOM 1396 CZ PHE A 86 -5.189 -2.517 3.892 1.00 0.00 C ATOM 0 H PHE A 86 -9.414 -0.481 2.097 1.00 0.00 H new ATOM 0 HA PHE A 86 -11.276 -2.348 3.106 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -9.734 -3.783 4.381 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -9.526 -4.001 2.655 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -7.665 -2.295 1.619 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -7.821 -3.677 5.642 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -5.259 -1.857 1.860 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -5.419 -3.236 5.891 1.00 0.00 H new ATOM 0 HZ PHE A 86 -4.132 -2.322 4.001 1.00 0.00 H new ATOM 1406 N LYS A 87 -11.232 -0.957 5.133 1.00 0.00 N ATOM 1407 CA LYS A 87 -11.265 -0.062 6.283 1.00 0.00 C ATOM 1408 C LYS A 87 -10.996 -0.803 7.583 1.00 0.00 C ATOM 1409 O LYS A 87 -10.955 -2.033 7.619 1.00 0.00 O ATOM 1410 CB LYS A 87 -12.603 0.671 6.384 1.00 0.00 C ATOM 1411 CG LYS A 87 -13.796 -0.246 6.599 1.00 0.00 C ATOM 1412 CD LYS A 87 -15.059 0.539 6.931 1.00 0.00 C ATOM 1413 CE LYS A 87 -15.124 0.923 8.404 1.00 0.00 C ATOM 1414 NZ LYS A 87 -14.066 1.898 8.784 1.00 0.00 N ATOM 0 H LYS A 87 -12.105 -1.455 4.958 1.00 0.00 H new ATOM 0 HA LYS A 87 -10.471 0.669 6.128 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -12.553 1.385 7.207 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -12.760 1.247 5.472 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -13.963 -0.842 5.702 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -13.578 -0.943 7.408 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -15.096 1.441 6.320 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -15.934 -0.057 6.673 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -16.103 1.350 8.622 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -15.024 0.026 9.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -14.376 2.440 9.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.189 1.387 9.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.893 2.549 7.991 1.00 0.00 H new ATOM 1428 N SER A 88 -10.812 -0.035 8.649 1.00 0.00 N ATOM 1429 CA SER A 88 -10.547 -0.598 9.965 1.00 0.00 C ATOM 1430 C SER A 88 -11.144 0.280 11.057 1.00 0.00 C ATOM 1431 O SER A 88 -10.933 1.493 11.079 1.00 0.00 O ATOM 1432 CB SER A 88 -9.039 -0.733 10.180 1.00 0.00 C ATOM 1433 OG SER A 88 -8.446 -1.517 9.160 1.00 0.00 O ATOM 0 H SER A 88 -10.842 0.984 8.627 1.00 0.00 H new ATOM 0 HA SER A 88 -11.011 -1.583 10.017 1.00 0.00 H new ATOM 0 HB2 SER A 88 -8.581 0.256 10.195 1.00 0.00 H new ATOM 0 HB3 SER A 88 -8.846 -1.189 11.151 1.00 0.00 H new ATOM 0 HG SER A 88 -7.823 -0.964 8.643 1.00 0.00 H new ATOM 1536 N ALA B 6 19.130 3.595 2.851 1.00 0.00 N ATOM 1537 CA ALA B 6 17.750 4.001 2.610 1.00 0.00 C ATOM 1538 C ALA B 6 17.584 5.508 2.760 1.00 0.00 C ATOM 1539 O ALA B 6 17.922 6.078 3.798 1.00 0.00 O ATOM 1540 CB ALA B 6 16.811 3.276 3.565 1.00 0.00 C ATOM 0 HA ALA B 6 17.496 3.731 1.585 1.00 0.00 H new ATOM 0 HB1 ALA B 6 15.785 3.589 3.374 1.00 0.00 H new ATOM 0 HB2 ALA B 6 16.897 2.200 3.413 1.00 0.00 H new ATOM 0 HB3 ALA B 6 17.079 3.519 4.593 1.00 0.00 H new ATOM 1546 N VAL B 7 17.055 6.152 1.723 1.00 0.00 N ATOM 1547 CA VAL B 7 16.843 7.585 1.753 1.00 0.00 C ATOM 1548 C VAL B 7 15.465 7.930 2.297 1.00 0.00 C ATOM 1549 O VAL B 7 14.467 7.317 1.924 1.00 0.00 O ATOM 1550 CB VAL B 7 16.985 8.205 0.360 1.00 0.00 C ATOM 1551 CG1 VAL B 7 18.406 8.054 -0.156 1.00 0.00 C ATOM 1552 CG2 VAL B 7 15.983 7.591 -0.609 1.00 0.00 C ATOM 0 H VAL B 7 16.768 5.699 0.855 1.00 0.00 H new ATOM 0 HA VAL B 7 17.609 7.995 2.411 1.00 0.00 H new ATOM 0 HB VAL B 7 16.768 9.270 0.438 1.00 0.00 H new ATOM 0 HG11 VAL B 7 18.483 8.502 -1.147 1.00 0.00 H new ATOM 0 HG12 VAL B 7 19.095 8.556 0.523 1.00 0.00 H new ATOM 0 HG13 VAL B 7 18.661 6.996 -0.215 1.00 0.00 H new ATOM 0 HG21 VAL B 7 16.102 8.046 -1.592 1.00 0.00 H new ATOM 0 HG22 VAL B 7 16.159 6.518 -0.682 1.00 0.00 H new ATOM 0 HG23 VAL B 7 14.970 7.769 -0.247 1.00 0.00 H new ATOM 1562 N ILE B 8 15.420 8.931 3.165 1.00 0.00 N ATOM 1563 CA ILE B 8 14.161 9.372 3.750 1.00 0.00 C ATOM 1564 C ILE B 8 13.416 10.297 2.795 1.00 0.00 C ATOM 1565 O ILE B 8 13.961 11.292 2.322 1.00 0.00 O ATOM 1566 CB ILE B 8 14.382 10.080 5.108 1.00 0.00 C ATOM 1567 CG1 ILE B 8 14.841 9.070 6.162 1.00 0.00 C ATOM 1568 CG2 ILE B 8 13.110 10.782 5.569 1.00 0.00 C ATOM 1569 CD1 ILE B 8 16.153 8.395 5.833 1.00 0.00 C ATOM 0 H ILE B 8 16.239 9.452 3.479 1.00 0.00 H new ATOM 0 HA ILE B 8 13.556 8.483 3.926 1.00 0.00 H new ATOM 0 HB ILE B 8 15.159 10.833 4.978 1.00 0.00 H new ATOM 0 HG12 ILE B 8 14.936 9.579 7.121 1.00 0.00 H new ATOM 0 HG13 ILE B 8 14.071 8.308 6.280 1.00 0.00 H new ATOM 0 HG21 ILE B 8 13.291 11.272 6.526 1.00 0.00 H new ATOM 0 HG22 ILE B 8 12.817 11.527 4.829 1.00 0.00 H new ATOM 0 HG23 ILE B 8 12.311 10.050 5.682 1.00 0.00 H new ATOM 0 HD11 ILE B 8 16.411 7.694 6.627 1.00 0.00 H new ATOM 0 HD12 ILE B 8 16.059 7.856 4.890 1.00 0.00 H new ATOM 0 HD13 ILE B 8 16.937 9.147 5.744 1.00 0.00 H new ATOM 1581 N LYS B 9 12.166 9.952 2.514 1.00 0.00 N ATOM 1582 CA LYS B 9 11.337 10.738 1.612 1.00 0.00 C ATOM 1583 C LYS B 9 10.340 11.592 2.390 1.00 0.00 C ATOM 1584 O LYS B 9 10.012 12.707 1.981 1.00 0.00 O ATOM 1585 CB LYS B 9 10.595 9.815 0.645 1.00 0.00 C ATOM 1586 CG LYS B 9 9.838 10.553 -0.444 1.00 0.00 C ATOM 1587 CD LYS B 9 10.780 11.361 -1.323 1.00 0.00 C ATOM 1588 CE LYS B 9 10.028 12.088 -2.425 1.00 0.00 C ATOM 1589 NZ LYS B 9 9.014 13.030 -1.878 1.00 0.00 N ATOM 0 H LYS B 9 11.703 9.129 2.900 1.00 0.00 H new ATOM 0 HA LYS B 9 11.987 11.405 1.045 1.00 0.00 H new ATOM 0 HB2 LYS B 9 11.312 9.137 0.181 1.00 0.00 H new ATOM 0 HB3 LYS B 9 9.894 9.200 1.209 1.00 0.00 H new ATOM 0 HG2 LYS B 9 9.289 9.838 -1.057 1.00 0.00 H new ATOM 0 HG3 LYS B 9 9.101 11.216 0.008 1.00 0.00 H new ATOM 0 HD2 LYS B 9 11.320 12.084 -0.711 1.00 0.00 H new ATOM 0 HD3 LYS B 9 11.525 10.699 -1.765 1.00 0.00 H new ATOM 0 HE2 LYS B 9 10.736 12.637 -3.046 1.00 0.00 H new ATOM 0 HE3 LYS B 9 9.536 11.360 -3.070 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 9.072 13.936 -2.386 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 8.064 12.626 -1.999 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 9.197 13.188 -0.866 1.00 0.00 H new ATOM 1603 N ASN B 10 9.858 11.060 3.508 1.00 0.00 N ATOM 1604 CA ASN B 10 8.890 11.771 4.340 1.00 0.00 C ATOM 1605 C ASN B 10 8.760 11.117 5.713 1.00 0.00 C ATOM 1606 O ASN B 10 7.665 10.746 6.139 1.00 0.00 O ATOM 1607 CB ASN B 10 7.530 11.828 3.641 1.00 0.00 C ATOM 1608 CG ASN B 10 7.044 10.461 3.206 1.00 0.00 C ATOM 1609 OD1 ASN B 10 6.865 9.563 4.024 1.00 0.00 O ATOM 1610 ND2 ASN B 10 6.825 10.299 1.905 1.00 0.00 N ATOM 0 H ASN B 10 10.121 10.139 3.860 1.00 0.00 H new ATOM 0 HA ASN B 10 9.251 12.789 4.487 1.00 0.00 H new ATOM 0 HB2 ASN B 10 6.797 12.273 4.314 1.00 0.00 H new ATOM 0 HB3 ASN B 10 7.600 12.479 2.770 1.00 0.00 H new ATOM 0 HD21 ASN B 10 6.495 9.401 1.551 1.00 0.00 H new ATOM 0 HD22 ASN B 10 6.987 11.073 1.260 1.00 0.00 H new ATOM 1617 N ALA B 11 9.890 10.982 6.401 1.00 0.00 N ATOM 1618 CA ALA B 11 9.922 10.377 7.728 1.00 0.00 C ATOM 1619 C ALA B 11 9.083 11.169 8.728 1.00 0.00 C ATOM 1620 O ALA B 11 8.972 12.392 8.634 1.00 0.00 O ATOM 1621 CB ALA B 11 11.357 10.263 8.217 1.00 0.00 C ATOM 0 H ALA B 11 10.801 11.286 6.058 1.00 0.00 H new ATOM 0 HA ALA B 11 9.489 9.380 7.650 1.00 0.00 H new ATOM 0 HB1 ALA B 11 11.369 9.810 9.208 1.00 0.00 H new ATOM 0 HB2 ALA B 11 11.928 9.641 7.527 1.00 0.00 H new ATOM 0 HB3 ALA B 11 11.805 11.256 8.266 1.00 0.00 H new ATOM 1627 N ASP B 12 8.499 10.456 9.687 1.00 0.00 N ATOM 1628 CA ASP B 12 7.668 11.071 10.719 1.00 0.00 C ATOM 1629 C ASP B 12 7.583 10.159 11.939 1.00 0.00 C ATOM 1630 O ASP B 12 6.539 9.568 12.218 1.00 0.00 O ATOM 1631 CB ASP B 12 6.262 11.353 10.179 1.00 0.00 C ATOM 1632 CG ASP B 12 6.276 12.281 8.980 1.00 0.00 C ATOM 1633 OD1 ASP B 12 6.756 13.425 9.120 1.00 0.00 O ATOM 1634 OD2 ASP B 12 5.806 11.861 7.901 1.00 0.00 O ATOM 0 H ASP B 12 8.587 9.443 9.771 1.00 0.00 H new ATOM 0 HA ASP B 12 8.126 12.016 11.012 1.00 0.00 H new ATOM 0 HB2 ASP B 12 5.788 10.412 9.901 1.00 0.00 H new ATOM 0 HB3 ASP B 12 5.655 11.795 10.969 1.00 0.00 H new ATOM 1639 N MET B 13 8.698 10.038 12.655 1.00 0.00 N ATOM 1640 CA MET B 13 8.761 9.182 13.834 1.00 0.00 C ATOM 1641 C MET B 13 10.110 9.335 14.536 1.00 0.00 C ATOM 1642 O MET B 13 11.069 9.830 13.948 1.00 0.00 O ATOM 1643 CB MET B 13 8.537 7.724 13.429 1.00 0.00 C ATOM 1644 CG MET B 13 8.458 6.761 14.603 1.00 0.00 C ATOM 1645 SD MET B 13 8.262 5.044 14.083 1.00 0.00 S ATOM 1646 CE MET B 13 6.668 5.102 13.269 1.00 0.00 C ATOM 0 H MET B 13 9.569 10.522 12.439 1.00 0.00 H new ATOM 0 HA MET B 13 7.977 9.483 14.529 1.00 0.00 H new ATOM 0 HB2 MET B 13 7.614 7.655 12.853 1.00 0.00 H new ATOM 0 HB3 MET B 13 9.347 7.412 12.770 1.00 0.00 H new ATOM 0 HG2 MET B 13 9.362 6.853 15.205 1.00 0.00 H new ATOM 0 HG3 MET B 13 7.620 7.041 15.242 1.00 0.00 H new ATOM 0 HE1 MET B 13 6.673 4.429 12.411 1.00 0.00 H new ATOM 0 HE2 MET B 13 5.891 4.793 13.968 1.00 0.00 H new ATOM 0 HE3 MET B 13 6.469 6.119 12.931 1.00 0.00 H new ATOM 1656 N SER B 14 10.174 8.916 15.798 1.00 0.00 N ATOM 1657 CA SER B 14 11.404 9.013 16.585 1.00 0.00 C ATOM 1658 C SER B 14 12.623 8.544 15.787 1.00 0.00 C ATOM 1659 O SER B 14 12.552 7.567 15.044 1.00 0.00 O ATOM 1660 CB SER B 14 11.276 8.193 17.869 1.00 0.00 C ATOM 1661 OG SER B 14 10.209 8.668 18.673 1.00 0.00 O ATOM 0 H SER B 14 9.387 8.505 16.300 1.00 0.00 H new ATOM 0 HA SER B 14 11.552 10.063 16.838 1.00 0.00 H new ATOM 0 HB2 SER B 14 11.109 7.145 17.620 1.00 0.00 H new ATOM 0 HB3 SER B 14 12.209 8.243 18.431 1.00 0.00 H new ATOM 0 HG SER B 14 9.530 7.967 18.764 1.00 0.00 H new ATOM 1667 N GLU B 15 13.736 9.260 15.950 1.00 0.00 N ATOM 1668 CA GLU B 15 14.982 8.945 15.248 1.00 0.00 C ATOM 1669 C GLU B 15 15.352 7.475 15.372 1.00 0.00 C ATOM 1670 O GLU B 15 15.649 6.815 14.376 1.00 0.00 O ATOM 1671 CB GLU B 15 16.118 9.812 15.792 1.00 0.00 C ATOM 1672 CG GLU B 15 15.878 11.305 15.623 1.00 0.00 C ATOM 1673 CD GLU B 15 17.016 12.148 16.169 1.00 0.00 C ATOM 1674 OE1 GLU B 15 17.995 11.565 16.681 1.00 0.00 O ATOM 1675 OE2 GLU B 15 16.927 13.390 16.084 1.00 0.00 O ATOM 0 H GLU B 15 13.800 10.069 16.568 1.00 0.00 H new ATOM 0 HA GLU B 15 14.826 9.158 14.190 1.00 0.00 H new ATOM 0 HB2 GLU B 15 16.257 9.592 16.851 1.00 0.00 H new ATOM 0 HB3 GLU B 15 17.045 9.542 15.286 1.00 0.00 H new ATOM 0 HG2 GLU B 15 15.741 11.529 14.565 1.00 0.00 H new ATOM 0 HG3 GLU B 15 14.953 11.579 16.130 1.00 0.00 H new ATOM 1682 N GLU B 16 15.337 6.965 16.591 1.00 0.00 N ATOM 1683 CA GLU B 16 15.680 5.570 16.828 1.00 0.00 C ATOM 1684 C GLU B 16 14.693 4.644 16.130 1.00 0.00 C ATOM 1685 O GLU B 16 15.082 3.632 15.549 1.00 0.00 O ATOM 1686 CB GLU B 16 15.709 5.274 18.330 1.00 0.00 C ATOM 1687 CG GLU B 16 14.381 5.529 19.025 1.00 0.00 C ATOM 1688 CD GLU B 16 14.432 5.232 20.513 1.00 0.00 C ATOM 1689 OE1 GLU B 16 15.507 4.826 21.002 1.00 0.00 O ATOM 1690 OE2 GLU B 16 13.395 5.406 21.188 1.00 0.00 O ATOM 0 H GLU B 16 15.092 7.491 17.430 1.00 0.00 H new ATOM 0 HA GLU B 16 16.673 5.390 16.415 1.00 0.00 H new ATOM 0 HB2 GLU B 16 15.995 4.233 18.482 1.00 0.00 H new ATOM 0 HB3 GLU B 16 16.479 5.888 18.798 1.00 0.00 H new ATOM 0 HG2 GLU B 16 14.091 6.569 18.876 1.00 0.00 H new ATOM 0 HG3 GLU B 16 13.609 4.914 18.562 1.00 0.00 H new ATOM 1697 N MET B 17 13.415 4.995 16.193 1.00 0.00 N ATOM 1698 CA MET B 17 12.379 4.190 15.565 1.00 0.00 C ATOM 1699 C MET B 17 12.539 4.176 14.049 1.00 0.00 C ATOM 1700 O MET B 17 12.508 3.116 13.425 1.00 0.00 O ATOM 1701 CB MET B 17 10.996 4.708 15.955 1.00 0.00 C ATOM 1702 CG MET B 17 10.747 4.693 17.454 1.00 0.00 C ATOM 1703 SD MET B 17 9.128 5.352 17.903 1.00 0.00 S ATOM 1704 CE MET B 17 8.045 4.161 17.119 1.00 0.00 C ATOM 0 H MET B 17 13.073 5.829 16.671 1.00 0.00 H new ATOM 0 HA MET B 17 12.481 3.165 15.922 1.00 0.00 H new ATOM 0 HB2 MET B 17 10.880 5.727 15.585 1.00 0.00 H new ATOM 0 HB3 MET B 17 10.236 4.101 15.462 1.00 0.00 H new ATOM 0 HG2 MET B 17 10.832 3.670 17.821 1.00 0.00 H new ATOM 0 HG3 MET B 17 11.522 5.276 17.952 1.00 0.00 H new ATOM 0 HE1 MET B 17 7.273 4.686 16.556 1.00 0.00 H new ATOM 0 HE2 MET B 17 8.624 3.533 16.442 1.00 0.00 H new ATOM 0 HE3 MET B 17 7.578 3.537 17.881 1.00 0.00 H new ATOM 1714 N GLN B 18 12.724 5.353 13.459 1.00 0.00 N ATOM 1715 CA GLN B 18 12.903 5.453 12.016 1.00 0.00 C ATOM 1716 C GLN B 18 14.217 4.808 11.600 1.00 0.00 C ATOM 1717 O GLN B 18 14.290 4.131 10.575 1.00 0.00 O ATOM 1718 CB GLN B 18 12.864 6.913 11.566 1.00 0.00 C ATOM 1719 CG GLN B 18 13.910 7.787 12.231 1.00 0.00 C ATOM 1720 CD GLN B 18 13.774 9.241 11.837 1.00 0.00 C ATOM 1721 OE1 GLN B 18 14.054 9.619 10.700 1.00 0.00 O ATOM 1722 NE2 GLN B 18 13.317 10.060 12.773 1.00 0.00 N ATOM 0 H GLN B 18 12.754 6.244 13.954 1.00 0.00 H new ATOM 0 HA GLN B 18 12.083 4.922 11.532 1.00 0.00 H new ATOM 0 HB2 GLN B 18 13.003 6.954 10.486 1.00 0.00 H new ATOM 0 HB3 GLN B 18 11.876 7.322 11.776 1.00 0.00 H new ATOM 0 HG2 GLN B 18 13.822 7.696 13.314 1.00 0.00 H new ATOM 0 HG3 GLN B 18 14.904 7.431 11.961 1.00 0.00 H new ATOM 0 HE21 GLN B 18 13.098 9.701 13.702 1.00 0.00 H new ATOM 0 HE22 GLN B 18 13.184 11.050 12.564 1.00 0.00 H new ATOM 1731 N GLN B 19 15.249 5.013 12.411 1.00 0.00 N ATOM 1732 CA GLN B 19 16.557 4.441 12.133 1.00 0.00 C ATOM 1733 C GLN B 19 16.521 2.923 12.270 1.00 0.00 C ATOM 1734 O GLN B 19 17.134 2.204 11.481 1.00 0.00 O ATOM 1735 CB GLN B 19 17.610 5.044 13.066 1.00 0.00 C ATOM 1736 CG GLN B 19 18.057 6.437 12.655 1.00 0.00 C ATOM 1737 CD GLN B 19 19.132 6.998 13.564 1.00 0.00 C ATOM 1738 OE1 GLN B 19 20.188 6.391 13.743 1.00 0.00 O ATOM 1739 NE2 GLN B 19 18.871 8.166 14.136 1.00 0.00 N ATOM 0 H GLN B 19 15.203 5.570 13.264 1.00 0.00 H new ATOM 0 HA GLN B 19 16.828 4.682 11.105 1.00 0.00 H new ATOM 0 HB2 GLN B 19 17.207 5.084 14.078 1.00 0.00 H new ATOM 0 HB3 GLN B 19 18.478 4.386 13.094 1.00 0.00 H new ATOM 0 HG2 GLN B 19 18.431 6.407 11.632 1.00 0.00 H new ATOM 0 HG3 GLN B 19 17.197 7.106 12.660 1.00 0.00 H new ATOM 0 HE21 GLN B 19 17.982 8.633 13.959 1.00 0.00 H new ATOM 0 HE22 GLN B 19 19.559 8.597 14.753 1.00 0.00 H new ATOM 1748 N ASP B 20 15.788 2.443 13.269 1.00 0.00 N ATOM 1749 CA ASP B 20 15.659 1.008 13.500 1.00 0.00 C ATOM 1750 C ASP B 20 14.855 0.362 12.385 1.00 0.00 C ATOM 1751 O ASP B 20 15.146 -0.755 11.967 1.00 0.00 O ATOM 1752 CB ASP B 20 14.998 0.741 14.854 1.00 0.00 C ATOM 1753 CG ASP B 20 14.867 -0.740 15.153 1.00 0.00 C ATOM 1754 OD1 ASP B 20 15.908 -1.427 15.211 1.00 0.00 O ATOM 1755 OD2 ASP B 20 13.725 -1.211 15.330 1.00 0.00 O ATOM 0 H ASP B 20 15.275 3.025 13.931 1.00 0.00 H new ATOM 0 HA ASP B 20 16.657 0.569 13.509 1.00 0.00 H new ATOM 0 HB2 ASP B 20 15.583 1.217 15.641 1.00 0.00 H new ATOM 0 HB3 ASP B 20 14.010 1.201 14.869 1.00 0.00 H new ATOM 1760 N SER B 21 13.846 1.074 11.899 1.00 0.00 N ATOM 1761 CA SER B 21 13.015 0.565 10.818 1.00 0.00 C ATOM 1762 C SER B 21 13.829 0.472 9.533 1.00 0.00 C ATOM 1763 O SER B 21 13.735 -0.506 8.793 1.00 0.00 O ATOM 1764 CB SER B 21 11.796 1.466 10.607 1.00 0.00 C ATOM 1765 OG SER B 21 10.971 0.974 9.566 1.00 0.00 O ATOM 0 H SER B 21 13.585 2.001 12.235 1.00 0.00 H new ATOM 0 HA SER B 21 12.665 -0.431 11.089 1.00 0.00 H new ATOM 0 HB2 SER B 21 11.222 1.528 11.531 1.00 0.00 H new ATOM 0 HB3 SER B 21 12.125 2.477 10.367 1.00 0.00 H new ATOM 0 HG SER B 21 10.396 1.696 9.235 1.00 0.00 H new ATOM 1771 N VAL B 22 14.640 1.496 9.285 1.00 0.00 N ATOM 1772 CA VAL B 22 15.485 1.530 8.100 1.00 0.00 C ATOM 1773 C VAL B 22 16.514 0.410 8.147 1.00 0.00 C ATOM 1774 O VAL B 22 16.679 -0.341 7.186 1.00 0.00 O ATOM 1775 CB VAL B 22 16.211 2.883 7.961 1.00 0.00 C ATOM 1776 CG1 VAL B 22 17.064 2.913 6.702 1.00 0.00 C ATOM 1777 CG2 VAL B 22 15.211 4.029 7.963 1.00 0.00 C ATOM 0 H VAL B 22 14.729 2.312 9.890 1.00 0.00 H new ATOM 0 HA VAL B 22 14.836 1.395 7.235 1.00 0.00 H new ATOM 0 HB VAL B 22 16.872 3.005 8.819 1.00 0.00 H new ATOM 0 HG11 VAL B 22 17.566 3.877 6.626 1.00 0.00 H new ATOM 0 HG12 VAL B 22 17.809 2.119 6.748 1.00 0.00 H new ATOM 0 HG13 VAL B 22 16.429 2.765 5.829 1.00 0.00 H new ATOM 0 HG21 VAL B 22 15.742 4.976 7.864 1.00 0.00 H new ATOM 0 HG22 VAL B 22 14.521 3.911 7.128 1.00 0.00 H new ATOM 0 HG23 VAL B 22 14.652 4.023 8.899 1.00 0.00 H new ATOM 1787 N GLU B 23 17.192 0.293 9.281 1.00 0.00 N ATOM 1788 CA GLU B 23 18.189 -0.745 9.469 1.00 0.00 C ATOM 1789 C GLU B 23 17.519 -2.111 9.466 1.00 0.00 C ATOM 1790 O GLU B 23 18.013 -3.062 8.862 1.00 0.00 O ATOM 1791 CB GLU B 23 18.939 -0.520 10.782 1.00 0.00 C ATOM 1792 CG GLU B 23 19.906 -1.634 11.128 1.00 0.00 C ATOM 1793 CD GLU B 23 20.955 -1.853 10.056 1.00 0.00 C ATOM 1794 OE1 GLU B 23 20.573 -2.151 8.905 1.00 0.00 O ATOM 1795 OE2 GLU B 23 22.156 -1.728 10.368 1.00 0.00 O ATOM 0 H GLU B 23 17.067 0.908 10.085 1.00 0.00 H new ATOM 0 HA GLU B 23 18.906 -0.705 8.649 1.00 0.00 H new ATOM 0 HB2 GLU B 23 19.488 0.420 10.721 1.00 0.00 H new ATOM 0 HB3 GLU B 23 18.215 -0.414 11.590 1.00 0.00 H new ATOM 0 HG2 GLU B 23 20.400 -1.401 12.071 1.00 0.00 H new ATOM 0 HG3 GLU B 23 19.349 -2.559 11.280 1.00 0.00 H new ATOM 1802 N CYS B 24 16.380 -2.191 10.142 1.00 0.00 N ATOM 1803 CA CYS B 24 15.617 -3.430 10.220 1.00 0.00 C ATOM 1804 C CYS B 24 15.186 -3.882 8.828 1.00 0.00 C ATOM 1805 O CYS B 24 15.121 -5.079 8.545 1.00 0.00 O ATOM 1806 CB CYS B 24 14.392 -3.242 11.116 1.00 0.00 C ATOM 1807 SG CYS B 24 13.377 -4.725 11.303 1.00 0.00 S ATOM 0 H CYS B 24 15.963 -1.409 10.646 1.00 0.00 H new ATOM 0 HA CYS B 24 16.255 -4.201 10.653 1.00 0.00 H new ATOM 0 HB2 CYS B 24 14.723 -2.915 12.102 1.00 0.00 H new ATOM 0 HB3 CYS B 24 13.775 -2.442 10.706 1.00 0.00 H new ATOM 0 HG CYS B 24 12.802 -4.713 12.469 1.00 0.00 H new ATOM 1813 N ALA B 25 14.906 -2.915 7.957 1.00 0.00 N ATOM 1814 CA ALA B 25 14.497 -3.213 6.597 1.00 0.00 C ATOM 1815 C ALA B 25 15.667 -3.781 5.819 1.00 0.00 C ATOM 1816 O ALA B 25 15.516 -4.715 5.030 1.00 0.00 O ATOM 1817 CB ALA B 25 13.958 -1.962 5.916 1.00 0.00 C ATOM 0 H ALA B 25 14.957 -1.920 8.174 1.00 0.00 H new ATOM 0 HA ALA B 25 13.700 -3.956 6.624 1.00 0.00 H new ATOM 0 HB1 ALA B 25 13.656 -2.204 4.897 1.00 0.00 H new ATOM 0 HB2 ALA B 25 13.097 -1.588 6.470 1.00 0.00 H new ATOM 0 HB3 ALA B 25 14.734 -1.197 5.892 1.00 0.00 H new ATOM 1823 N THR B 26 16.843 -3.213 6.058 1.00 0.00 N ATOM 1824 CA THR B 26 18.051 -3.663 5.391 1.00 0.00 C ATOM 1825 C THR B 26 18.305 -5.130 5.704 1.00 0.00 C ATOM 1826 O THR B 26 18.580 -5.934 4.811 1.00 0.00 O ATOM 1827 CB THR B 26 19.248 -2.811 5.820 1.00 0.00 C ATOM 1828 OG1 THR B 26 19.024 -1.444 5.523 1.00 0.00 O ATOM 1829 CG2 THR B 26 20.543 -3.218 5.153 1.00 0.00 C ATOM 0 H THR B 26 16.982 -2.440 6.709 1.00 0.00 H new ATOM 0 HA THR B 26 17.918 -3.552 4.315 1.00 0.00 H new ATOM 0 HB THR B 26 19.345 -2.972 6.894 1.00 0.00 H new ATOM 0 HG1 THR B 26 18.306 -1.099 6.094 1.00 0.00 H new ATOM 0 HG21 THR B 26 21.350 -2.574 5.502 1.00 0.00 H new ATOM 0 HG22 THR B 26 20.772 -4.254 5.404 1.00 0.00 H new ATOM 0 HG23 THR B 26 20.442 -3.120 4.072 1.00 0.00 H new ATOM 1837 N GLN B 27 18.182 -5.476 6.980 1.00 0.00 N ATOM 1838 CA GLN B 27 18.369 -6.846 7.420 1.00 0.00 C ATOM 1839 C GLN B 27 17.347 -7.747 6.740 1.00 0.00 C ATOM 1840 O GLN B 27 17.649 -8.876 6.359 1.00 0.00 O ATOM 1841 CB GLN B 27 18.226 -6.937 8.939 1.00 0.00 C ATOM 1842 CG GLN B 27 18.404 -8.344 9.479 1.00 0.00 C ATOM 1843 CD GLN B 27 18.259 -8.413 10.986 1.00 0.00 C ATOM 1844 OE1 GLN B 27 17.214 -8.073 11.538 1.00 0.00 O ATOM 1845 NE2 GLN B 27 19.314 -8.857 11.662 1.00 0.00 N ATOM 0 H GLN B 27 17.953 -4.821 7.728 1.00 0.00 H new ATOM 0 HA GLN B 27 19.372 -7.175 7.146 1.00 0.00 H new ATOM 0 HB2 GLN B 27 18.961 -6.281 9.405 1.00 0.00 H new ATOM 0 HB3 GLN B 27 17.242 -6.568 9.226 1.00 0.00 H new ATOM 0 HG2 GLN B 27 17.669 -9.002 9.017 1.00 0.00 H new ATOM 0 HG3 GLN B 27 19.388 -8.716 9.195 1.00 0.00 H new ATOM 0 HE21 GLN B 27 20.162 -9.129 11.164 1.00 0.00 H new ATOM 0 HE22 GLN B 27 19.276 -8.926 12.679 1.00 0.00 H new ATOM 1854 N ALA B 28 16.134 -7.223 6.583 1.00 0.00 N ATOM 1855 CA ALA B 28 15.055 -7.960 5.938 1.00 0.00 C ATOM 1856 C ALA B 28 15.477 -8.440 4.556 1.00 0.00 C ATOM 1857 O ALA B 28 15.288 -9.606 4.208 1.00 0.00 O ATOM 1858 CB ALA B 28 13.815 -7.089 5.830 1.00 0.00 C ATOM 0 H ALA B 28 15.875 -6.287 6.895 1.00 0.00 H new ATOM 0 HA ALA B 28 14.825 -8.832 6.550 1.00 0.00 H new ATOM 0 HB1 ALA B 28 13.016 -7.651 5.346 1.00 0.00 H new ATOM 0 HB2 ALA B 28 13.494 -6.788 6.827 1.00 0.00 H new ATOM 0 HB3 ALA B 28 14.044 -6.202 5.239 1.00 0.00 H new ATOM 1864 N LEU B 29 16.057 -7.535 3.774 1.00 0.00 N ATOM 1865 CA LEU B 29 16.509 -7.873 2.431 1.00 0.00 C ATOM 1866 C LEU B 29 17.574 -8.959 2.475 1.00 0.00 C ATOM 1867 O LEU B 29 17.522 -9.929 1.721 1.00 0.00 O ATOM 1868 CB LEU B 29 17.052 -6.633 1.725 1.00 0.00 C ATOM 1869 CG LEU B 29 15.982 -5.643 1.283 1.00 0.00 C ATOM 1870 CD1 LEU B 29 16.606 -4.310 0.902 1.00 0.00 C ATOM 1871 CD2 LEU B 29 15.187 -6.211 0.117 1.00 0.00 C ATOM 0 H LEU B 29 16.224 -6.566 4.046 1.00 0.00 H new ATOM 0 HA LEU B 29 15.654 -8.252 1.871 1.00 0.00 H new ATOM 0 HB2 LEU B 29 17.747 -6.124 2.393 1.00 0.00 H new ATOM 0 HB3 LEU B 29 17.622 -6.948 0.851 1.00 0.00 H new ATOM 0 HG LEU B 29 15.303 -5.475 2.119 1.00 0.00 H new ATOM 0 HD11 LEU B 29 15.824 -3.618 0.590 1.00 0.00 H new ATOM 0 HD12 LEU B 29 17.134 -3.897 1.761 1.00 0.00 H new ATOM 0 HD13 LEU B 29 17.308 -4.458 0.082 1.00 0.00 H new ATOM 0 HD21 LEU B 29 14.426 -5.493 -0.189 1.00 0.00 H new ATOM 0 HD22 LEU B 29 15.858 -6.407 -0.720 1.00 0.00 H new ATOM 0 HD23 LEU B 29 14.707 -7.141 0.422 1.00 0.00 H new ATOM 1883 N GLU B 30 18.539 -8.784 3.364 1.00 0.00 N ATOM 1884 CA GLU B 30 19.625 -9.744 3.517 1.00 0.00 C ATOM 1885 C GLU B 30 19.104 -11.102 3.985 1.00 0.00 C ATOM 1886 O GLU B 30 19.663 -12.143 3.638 1.00 0.00 O ATOM 1887 CB GLU B 30 20.663 -9.216 4.509 1.00 0.00 C ATOM 1888 CG GLU B 30 21.292 -7.898 4.087 1.00 0.00 C ATOM 1889 CD GLU B 30 22.320 -7.396 5.083 1.00 0.00 C ATOM 1890 OE1 GLU B 30 22.543 -8.078 6.106 1.00 0.00 O ATOM 1891 OE2 GLU B 30 22.903 -6.318 4.840 1.00 0.00 O ATOM 0 H GLU B 30 18.594 -7.983 3.994 1.00 0.00 H new ATOM 0 HA GLU B 30 20.093 -9.876 2.541 1.00 0.00 H new ATOM 0 HB2 GLU B 30 20.191 -9.088 5.483 1.00 0.00 H new ATOM 0 HB3 GLU B 30 21.449 -9.961 4.631 1.00 0.00 H new ATOM 0 HG2 GLU B 30 21.765 -8.021 3.113 1.00 0.00 H new ATOM 0 HG3 GLU B 30 20.510 -7.148 3.969 1.00 0.00 H new ATOM 1898 N LYS B 31 18.040 -11.085 4.782 1.00 0.00 N ATOM 1899 CA LYS B 31 17.459 -12.311 5.307 1.00 0.00 C ATOM 1900 C LYS B 31 16.493 -12.951 4.318 1.00 0.00 C ATOM 1901 O LYS B 31 16.476 -14.172 4.160 1.00 0.00 O ATOM 1902 CB LYS B 31 16.742 -12.038 6.631 1.00 0.00 C ATOM 1903 CG LYS B 31 17.678 -11.618 7.754 1.00 0.00 C ATOM 1904 CD LYS B 31 16.916 -11.348 9.042 1.00 0.00 C ATOM 1905 CE LYS B 31 16.170 -12.584 9.521 1.00 0.00 C ATOM 1906 NZ LYS B 31 15.433 -12.330 10.790 1.00 0.00 N ATOM 0 H LYS B 31 17.564 -10.233 5.077 1.00 0.00 H new ATOM 0 HA LYS B 31 18.278 -13.011 5.476 1.00 0.00 H new ATOM 0 HB2 LYS B 31 15.998 -11.256 6.477 1.00 0.00 H new ATOM 0 HB3 LYS B 31 16.203 -12.935 6.935 1.00 0.00 H new ATOM 0 HG2 LYS B 31 18.418 -12.400 7.925 1.00 0.00 H new ATOM 0 HG3 LYS B 31 18.224 -10.722 7.458 1.00 0.00 H new ATOM 0 HD2 LYS B 31 17.611 -11.020 9.815 1.00 0.00 H new ATOM 0 HD3 LYS B 31 16.209 -10.534 8.883 1.00 0.00 H new ATOM 0 HE2 LYS B 31 15.468 -12.905 8.752 1.00 0.00 H new ATOM 0 HE3 LYS B 31 16.877 -13.400 9.669 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 14.938 -13.196 11.083 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 16.105 -12.048 11.531 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 14.740 -11.568 10.643 1.00 0.00 H new ATOM 1920 N TYR B 32 15.678 -12.132 3.665 1.00 0.00 N ATOM 1921 CA TYR B 32 14.704 -12.649 2.709 1.00 0.00 C ATOM 1922 C TYR B 32 14.936 -12.102 1.303 1.00 0.00 C ATOM 1923 O TYR B 32 14.918 -12.851 0.328 1.00 0.00 O ATOM 1924 CB TYR B 32 13.282 -12.319 3.162 1.00 0.00 C ATOM 1925 CG TYR B 32 12.945 -12.839 4.543 1.00 0.00 C ATOM 1926 CD1 TYR B 32 13.584 -12.337 5.668 1.00 0.00 C ATOM 1927 CD2 TYR B 32 11.987 -13.830 4.719 1.00 0.00 C ATOM 1928 CE1 TYR B 32 13.279 -12.808 6.932 1.00 0.00 C ATOM 1929 CE2 TYR B 32 11.677 -14.306 5.978 1.00 0.00 C ATOM 1930 CZ TYR B 32 12.325 -13.792 7.081 1.00 0.00 C ATOM 1931 OH TYR B 32 12.019 -14.263 8.336 1.00 0.00 O ATOM 0 H TYR B 32 15.670 -11.118 3.777 1.00 0.00 H new ATOM 0 HA TYR B 32 14.833 -13.731 2.674 1.00 0.00 H new ATOM 0 HB2 TYR B 32 13.148 -11.237 3.149 1.00 0.00 H new ATOM 0 HB3 TYR B 32 12.576 -12.737 2.444 1.00 0.00 H new ATOM 0 HD1 TYR B 32 14.332 -11.566 5.555 1.00 0.00 H new ATOM 0 HD2 TYR B 32 11.477 -14.235 3.857 1.00 0.00 H new ATOM 0 HE1 TYR B 32 13.785 -12.407 7.798 1.00 0.00 H new ATOM 0 HE2 TYR B 32 10.930 -15.077 6.098 1.00 0.00 H new ATOM 0 HH TYR B 32 11.326 -14.953 8.267 1.00 0.00 H new ATOM 1941 N ASN B 33 15.143 -10.793 1.203 1.00 0.00 N ATOM 1942 CA ASN B 33 15.364 -10.150 -0.089 1.00 0.00 C ATOM 1943 C ASN B 33 14.088 -10.194 -0.930 1.00 0.00 C ATOM 1944 O ASN B 33 14.119 -10.536 -2.111 1.00 0.00 O ATOM 1945 CB ASN B 33 16.512 -10.834 -0.841 1.00 0.00 C ATOM 1946 CG ASN B 33 16.979 -10.040 -2.047 1.00 0.00 C ATOM 1947 OD1 ASN B 33 16.214 -9.790 -2.979 1.00 0.00 O ATOM 1948 ND2 ASN B 33 18.244 -9.637 -2.035 1.00 0.00 N ATOM 0 H ASN B 33 15.162 -10.157 2.000 1.00 0.00 H new ATOM 0 HA ASN B 33 15.634 -9.109 0.088 1.00 0.00 H new ATOM 0 HB2 ASN B 33 17.351 -10.979 -0.160 1.00 0.00 H new ATOM 0 HB3 ASN B 33 16.190 -11.823 -1.165 1.00 0.00 H new ATOM 0 HD21 ASN B 33 18.615 -9.099 -2.818 1.00 0.00 H new ATOM 0 HD22 ASN B 33 18.845 -9.866 -1.243 1.00 0.00 H new ATOM 1955 N ILE B 34 12.963 -9.848 -0.308 1.00 0.00 N ATOM 1956 CA ILE B 34 11.673 -9.846 -0.989 1.00 0.00 C ATOM 1957 C ILE B 34 10.747 -8.795 -0.385 1.00 0.00 C ATOM 1958 O ILE B 34 10.529 -8.767 0.823 1.00 0.00 O ATOM 1959 CB ILE B 34 10.989 -11.229 -0.907 1.00 0.00 C ATOM 1960 CG1 ILE B 34 11.871 -12.308 -1.542 1.00 0.00 C ATOM 1961 CG2 ILE B 34 9.625 -11.195 -1.584 1.00 0.00 C ATOM 1962 CD1 ILE B 34 12.103 -12.110 -3.025 1.00 0.00 C ATOM 0 H ILE B 34 12.920 -9.564 0.671 1.00 0.00 H new ATOM 0 HA ILE B 34 11.862 -9.609 -2.036 1.00 0.00 H new ATOM 0 HB ILE B 34 10.847 -11.475 0.145 1.00 0.00 H new ATOM 0 HG12 ILE B 34 12.834 -12.324 -1.032 1.00 0.00 H new ATOM 0 HG13 ILE B 34 11.409 -13.282 -1.382 1.00 0.00 H new ATOM 0 HG21 ILE B 34 9.160 -12.178 -1.515 1.00 0.00 H new ATOM 0 HG22 ILE B 34 8.992 -10.459 -1.089 1.00 0.00 H new ATOM 0 HG23 ILE B 34 9.746 -10.923 -2.633 1.00 0.00 H new ATOM 0 HD11 ILE B 34 12.736 -12.912 -3.405 1.00 0.00 H new ATOM 0 HD12 ILE B 34 11.147 -12.124 -3.548 1.00 0.00 H new ATOM 0 HD13 ILE B 34 12.594 -11.151 -3.192 1.00 0.00 H new ATOM 1974 N GLU B 35 10.205 -7.932 -1.238 1.00 0.00 N ATOM 1975 CA GLU B 35 9.307 -6.866 -0.798 1.00 0.00 C ATOM 1976 C GLU B 35 8.257 -7.374 0.189 1.00 0.00 C ATOM 1977 O GLU B 35 8.011 -6.748 1.221 1.00 0.00 O ATOM 1978 CB GLU B 35 8.621 -6.230 -2.009 1.00 0.00 C ATOM 1979 CG GLU B 35 7.868 -7.228 -2.872 1.00 0.00 C ATOM 1980 CD GLU B 35 7.245 -6.588 -4.098 1.00 0.00 C ATOM 1981 OE1 GLU B 35 7.993 -5.997 -4.904 1.00 0.00 O ATOM 1982 OE2 GLU B 35 6.010 -6.682 -4.255 1.00 0.00 O ATOM 0 H GLU B 35 10.372 -7.949 -2.244 1.00 0.00 H new ATOM 0 HA GLU B 35 9.910 -6.119 -0.282 1.00 0.00 H new ATOM 0 HB2 GLU B 35 7.927 -5.464 -1.663 1.00 0.00 H new ATOM 0 HB3 GLU B 35 9.371 -5.727 -2.619 1.00 0.00 H new ATOM 0 HG2 GLU B 35 8.550 -8.018 -3.186 1.00 0.00 H new ATOM 0 HG3 GLU B 35 7.086 -7.700 -2.277 1.00 0.00 H new ATOM 1989 N LYS B 36 7.639 -8.503 -0.132 1.00 0.00 N ATOM 1990 CA LYS B 36 6.613 -9.080 0.732 1.00 0.00 C ATOM 1991 C LYS B 36 7.197 -9.512 2.075 1.00 0.00 C ATOM 1992 O LYS B 36 6.749 -9.070 3.131 1.00 0.00 O ATOM 1993 CB LYS B 36 5.969 -10.283 0.045 1.00 0.00 C ATOM 1994 CG LYS B 36 4.881 -10.946 0.873 1.00 0.00 C ATOM 1995 CD LYS B 36 4.428 -12.258 0.254 1.00 0.00 C ATOM 1996 CE LYS B 36 5.561 -13.273 0.198 1.00 0.00 C ATOM 1997 NZ LYS B 36 5.112 -14.576 -0.363 1.00 0.00 N ATOM 0 H LYS B 36 7.828 -9.037 -0.980 1.00 0.00 H new ATOM 0 HA LYS B 36 5.860 -8.314 0.916 1.00 0.00 H new ATOM 0 HB2 LYS B 36 5.545 -9.963 -0.907 1.00 0.00 H new ATOM 0 HB3 LYS B 36 6.741 -11.018 -0.181 1.00 0.00 H new ATOM 0 HG2 LYS B 36 5.251 -11.128 1.882 1.00 0.00 H new ATOM 0 HG3 LYS B 36 4.029 -10.272 0.962 1.00 0.00 H new ATOM 0 HD2 LYS B 36 3.600 -12.667 0.833 1.00 0.00 H new ATOM 0 HD3 LYS B 36 4.053 -12.075 -0.753 1.00 0.00 H new ATOM 0 HE2 LYS B 36 6.374 -12.877 -0.411 1.00 0.00 H new ATOM 0 HE3 LYS B 36 5.960 -13.428 1.201 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 5.913 -15.239 -0.384 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 4.354 -14.967 0.232 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 4.755 -14.433 -1.329 1.00 0.00 H new ATOM 2011 N ASP B 37 8.193 -10.389 2.021 1.00 0.00 N ATOM 2012 CA ASP B 37 8.838 -10.904 3.228 1.00 0.00 C ATOM 2013 C ASP B 37 9.321 -9.778 4.143 1.00 0.00 C ATOM 2014 O ASP B 37 9.118 -9.826 5.355 1.00 0.00 O ATOM 2015 CB ASP B 37 10.011 -11.811 2.856 1.00 0.00 C ATOM 2016 CG ASP B 37 9.560 -13.074 2.146 1.00 0.00 C ATOM 2017 OD1 ASP B 37 8.775 -13.841 2.741 1.00 0.00 O ATOM 2018 OD2 ASP B 37 9.994 -13.296 0.997 1.00 0.00 O ATOM 0 H ASP B 37 8.574 -10.761 1.151 1.00 0.00 H new ATOM 0 HA ASP B 37 8.091 -11.480 3.775 1.00 0.00 H new ATOM 0 HB2 ASP B 37 10.702 -11.263 2.215 1.00 0.00 H new ATOM 0 HB3 ASP B 37 10.560 -12.080 3.759 1.00 0.00 H new ATOM 2023 N ILE B 38 9.962 -8.768 3.561 1.00 0.00 N ATOM 2024 CA ILE B 38 10.471 -7.637 4.335 1.00 0.00 C ATOM 2025 C ILE B 38 9.399 -7.095 5.278 1.00 0.00 C ATOM 2026 O ILE B 38 9.616 -6.973 6.486 1.00 0.00 O ATOM 2027 CB ILE B 38 10.950 -6.501 3.399 1.00 0.00 C ATOM 2028 CG1 ILE B 38 12.126 -6.974 2.543 1.00 0.00 C ATOM 2029 CG2 ILE B 38 11.344 -5.261 4.190 1.00 0.00 C ATOM 2030 CD1 ILE B 38 12.519 -5.989 1.465 1.00 0.00 C ATOM 0 H ILE B 38 10.142 -8.708 2.559 1.00 0.00 H new ATOM 0 HA ILE B 38 11.315 -7.996 4.924 1.00 0.00 H new ATOM 0 HB ILE B 38 10.119 -6.236 2.746 1.00 0.00 H new ATOM 0 HG12 ILE B 38 12.985 -7.157 3.188 1.00 0.00 H new ATOM 0 HG13 ILE B 38 11.868 -7.926 2.079 1.00 0.00 H new ATOM 0 HG21 ILE B 38 11.676 -4.482 3.504 1.00 0.00 H new ATOM 0 HG22 ILE B 38 10.485 -4.903 4.757 1.00 0.00 H new ATOM 0 HG23 ILE B 38 12.154 -5.509 4.876 1.00 0.00 H new ATOM 0 HD11 ILE B 38 13.359 -6.388 0.896 1.00 0.00 H new ATOM 0 HD12 ILE B 38 11.674 -5.824 0.797 1.00 0.00 H new ATOM 0 HD13 ILE B 38 12.808 -5.044 1.924 1.00 0.00 H new ATOM 2042 N ALA B 39 8.245 -6.770 4.713 1.00 0.00 N ATOM 2043 CA ALA B 39 7.131 -6.235 5.480 1.00 0.00 C ATOM 2044 C ALA B 39 6.583 -7.252 6.477 1.00 0.00 C ATOM 2045 O ALA B 39 5.965 -6.882 7.472 1.00 0.00 O ATOM 2046 CB ALA B 39 6.026 -5.778 4.540 1.00 0.00 C ATOM 0 H ALA B 39 8.056 -6.869 3.716 1.00 0.00 H new ATOM 0 HA ALA B 39 7.502 -5.384 6.051 1.00 0.00 H new ATOM 0 HB1 ALA B 39 5.195 -5.379 5.122 1.00 0.00 H new ATOM 0 HB2 ALA B 39 6.410 -5.003 3.877 1.00 0.00 H new ATOM 0 HB3 ALA B 39 5.680 -6.624 3.947 1.00 0.00 H new ATOM 2052 N ALA B 40 6.790 -8.534 6.197 1.00 0.00 N ATOM 2053 CA ALA B 40 6.287 -9.592 7.067 1.00 0.00 C ATOM 2054 C ALA B 40 7.005 -9.627 8.414 1.00 0.00 C ATOM 2055 O ALA B 40 6.387 -9.439 9.464 1.00 0.00 O ATOM 2056 CB ALA B 40 6.407 -10.939 6.369 1.00 0.00 C ATOM 0 H ALA B 40 7.300 -8.865 5.378 1.00 0.00 H new ATOM 0 HA ALA B 40 5.238 -9.377 7.270 1.00 0.00 H new ATOM 0 HB1 ALA B 40 6.030 -11.724 7.025 1.00 0.00 H new ATOM 0 HB2 ALA B 40 5.824 -10.925 5.448 1.00 0.00 H new ATOM 0 HB3 ALA B 40 7.453 -11.135 6.134 1.00 0.00 H new ATOM 2062 N HIS B 41 8.306 -9.890 8.380 1.00 0.00 N ATOM 2063 CA HIS B 41 9.097 -9.977 9.602 1.00 0.00 C ATOM 2064 C HIS B 41 9.158 -8.631 10.327 1.00 0.00 C ATOM 2065 O HIS B 41 8.977 -8.564 11.543 1.00 0.00 O ATOM 2066 CB HIS B 41 10.508 -10.486 9.277 1.00 0.00 C ATOM 2067 CG HIS B 41 11.554 -9.416 9.219 1.00 0.00 C ATOM 2068 ND1 HIS B 41 12.065 -8.810 10.345 1.00 0.00 N ATOM 2069 CD2 HIS B 41 12.182 -8.843 8.167 1.00 0.00 C ATOM 2070 CE1 HIS B 41 12.965 -7.912 9.991 1.00 0.00 C ATOM 2071 NE2 HIS B 41 13.056 -7.912 8.675 1.00 0.00 N ATOM 0 H HIS B 41 8.835 -10.046 7.522 1.00 0.00 H new ATOM 0 HA HIS B 41 8.611 -10.685 10.273 1.00 0.00 H new ATOM 0 HB2 HIS B 41 10.798 -11.220 10.029 1.00 0.00 H new ATOM 0 HB3 HIS B 41 10.482 -11.004 8.318 1.00 0.00 H new ATOM 0 HD1 HIS B 41 11.790 -9.022 11.304 1.00 0.00 H new ATOM 0 HD2 HIS B 41 12.026 -9.074 7.124 1.00 0.00 H new ATOM 0 HE1 HIS B 41 13.530 -7.284 10.664 1.00 0.00 H new ATOM 2080 N ILE B 42 9.423 -7.562 9.579 1.00 0.00 N ATOM 2081 CA ILE B 42 9.515 -6.228 10.163 1.00 0.00 C ATOM 2082 C ILE B 42 8.209 -5.833 10.847 1.00 0.00 C ATOM 2083 O ILE B 42 8.214 -5.320 11.966 1.00 0.00 O ATOM 2084 CB ILE B 42 9.876 -5.174 9.098 1.00 0.00 C ATOM 2085 CG1 ILE B 42 11.195 -5.534 8.424 1.00 0.00 C ATOM 2086 CG2 ILE B 42 9.960 -3.787 9.721 1.00 0.00 C ATOM 2087 CD1 ILE B 42 11.541 -4.623 7.271 1.00 0.00 C ATOM 0 H ILE B 42 9.577 -7.594 8.571 1.00 0.00 H new ATOM 0 HA ILE B 42 10.309 -6.261 10.909 1.00 0.00 H new ATOM 0 HB ILE B 42 9.089 -5.163 8.344 1.00 0.00 H new ATOM 0 HG12 ILE B 42 11.996 -5.495 9.163 1.00 0.00 H new ATOM 0 HG13 ILE B 42 11.143 -6.562 8.064 1.00 0.00 H new ATOM 0 HG21 ILE B 42 10.216 -3.058 8.952 1.00 0.00 H new ATOM 0 HG22 ILE B 42 8.997 -3.527 10.162 1.00 0.00 H new ATOM 0 HG23 ILE B 42 10.727 -3.782 10.496 1.00 0.00 H new ATOM 0 HD11 ILE B 42 12.491 -4.933 6.835 1.00 0.00 H new ATOM 0 HD12 ILE B 42 10.758 -4.680 6.514 1.00 0.00 H new ATOM 0 HD13 ILE B 42 11.624 -3.597 7.630 1.00 0.00 H new ATOM 2099 N LYS B 43 7.093 -6.074 10.169 1.00 0.00 N ATOM 2100 CA LYS B 43 5.781 -5.744 10.713 1.00 0.00 C ATOM 2101 C LYS B 43 5.558 -6.427 12.059 1.00 0.00 C ATOM 2102 O LYS B 43 5.158 -5.788 13.032 1.00 0.00 O ATOM 2103 CB LYS B 43 4.689 -6.166 9.729 1.00 0.00 C ATOM 2104 CG LYS B 43 3.275 -5.940 10.239 1.00 0.00 C ATOM 2105 CD LYS B 43 2.227 -6.327 9.202 1.00 0.00 C ATOM 2106 CE LYS B 43 2.194 -7.829 8.944 1.00 0.00 C ATOM 2107 NZ LYS B 43 3.409 -8.314 8.231 1.00 0.00 N ATOM 0 H LYS B 43 7.070 -6.497 9.241 1.00 0.00 H new ATOM 0 HA LYS B 43 5.736 -4.666 10.865 1.00 0.00 H new ATOM 0 HB2 LYS B 43 4.821 -5.615 8.798 1.00 0.00 H new ATOM 0 HB3 LYS B 43 4.815 -7.223 9.494 1.00 0.00 H new ATOM 0 HG2 LYS B 43 3.119 -6.523 11.147 1.00 0.00 H new ATOM 0 HG3 LYS B 43 3.150 -4.891 10.508 1.00 0.00 H new ATOM 0 HD2 LYS B 43 1.245 -5.997 9.541 1.00 0.00 H new ATOM 0 HD3 LYS B 43 2.434 -5.805 8.268 1.00 0.00 H new ATOM 0 HE2 LYS B 43 2.100 -8.355 9.894 1.00 0.00 H new ATOM 0 HE3 LYS B 43 1.310 -8.074 8.355 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 3.125 -8.907 7.425 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 3.957 -7.500 7.886 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 3.994 -8.873 8.884 1.00 0.00 H new ATOM 2121 N LYS B 44 5.817 -7.729 12.106 1.00 0.00 N ATOM 2122 CA LYS B 44 5.640 -8.497 13.333 1.00 0.00 C ATOM 2123 C LYS B 44 6.594 -8.027 14.426 1.00 0.00 C ATOM 2124 O LYS B 44 6.213 -7.924 15.593 1.00 0.00 O ATOM 2125 CB LYS B 44 5.850 -9.987 13.063 1.00 0.00 C ATOM 2126 CG LYS B 44 4.884 -10.565 12.042 1.00 0.00 C ATOM 2127 CD LYS B 44 5.152 -12.040 11.794 1.00 0.00 C ATOM 2128 CE LYS B 44 4.190 -12.616 10.767 1.00 0.00 C ATOM 2129 NZ LYS B 44 2.770 -12.497 11.203 1.00 0.00 N ATOM 0 H LYS B 44 6.150 -8.274 11.310 1.00 0.00 H new ATOM 0 HA LYS B 44 4.620 -8.336 13.681 1.00 0.00 H new ATOM 0 HB2 LYS B 44 6.871 -10.144 12.714 1.00 0.00 H new ATOM 0 HB3 LYS B 44 5.746 -10.535 13.999 1.00 0.00 H new ATOM 0 HG2 LYS B 44 3.860 -10.434 12.393 1.00 0.00 H new ATOM 0 HG3 LYS B 44 4.972 -10.016 11.105 1.00 0.00 H new ATOM 0 HD2 LYS B 44 6.177 -12.171 11.448 1.00 0.00 H new ATOM 0 HD3 LYS B 44 5.059 -12.590 12.730 1.00 0.00 H new ATOM 0 HE2 LYS B 44 4.322 -12.099 9.817 1.00 0.00 H new ATOM 0 HE3 LYS B 44 4.429 -13.665 10.595 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 2.169 -13.088 10.593 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 2.682 -12.815 12.189 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 2.467 -11.505 11.131 1.00 0.00 H new ATOM 2143 N GLU B 45 7.837 -7.750 14.048 1.00 0.00 N ATOM 2144 CA GLU B 45 8.843 -7.301 15.006 1.00 0.00 C ATOM 2145 C GLU B 45 8.373 -6.056 15.754 1.00 0.00 C ATOM 2146 O GLU B 45 8.378 -6.024 16.985 1.00 0.00 O ATOM 2147 CB GLU B 45 10.165 -7.011 14.291 1.00 0.00 C ATOM 2148 CG GLU B 45 11.276 -6.563 15.226 1.00 0.00 C ATOM 2149 CD GLU B 45 11.609 -7.605 16.276 1.00 0.00 C ATOM 2150 OE1 GLU B 45 11.998 -8.729 15.895 1.00 0.00 O ATOM 2151 OE2 GLU B 45 11.482 -7.296 17.480 1.00 0.00 O ATOM 0 H GLU B 45 8.172 -7.828 13.088 1.00 0.00 H new ATOM 0 HA GLU B 45 8.996 -8.100 15.732 1.00 0.00 H new ATOM 0 HB2 GLU B 45 10.487 -7.908 13.761 1.00 0.00 H new ATOM 0 HB3 GLU B 45 10.000 -6.239 13.539 1.00 0.00 H new ATOM 0 HG2 GLU B 45 12.170 -6.342 14.643 1.00 0.00 H new ATOM 0 HG3 GLU B 45 10.980 -5.637 15.719 1.00 0.00 H new ATOM 2158 N PHE B 46 7.962 -5.034 15.010 1.00 0.00 N ATOM 2159 CA PHE B 46 7.486 -3.798 15.618 1.00 0.00 C ATOM 2160 C PHE B 46 6.130 -4.005 16.284 1.00 0.00 C ATOM 2161 O PHE B 46 5.889 -3.523 17.391 1.00 0.00 O ATOM 2162 CB PHE B 46 7.403 -2.678 14.578 1.00 0.00 C ATOM 2163 CG PHE B 46 8.743 -2.150 14.148 1.00 0.00 C ATOM 2164 CD1 PHE B 46 9.652 -2.961 13.485 1.00 0.00 C ATOM 2165 CD2 PHE B 46 9.097 -0.838 14.412 1.00 0.00 C ATOM 2166 CE1 PHE B 46 10.884 -2.470 13.091 1.00 0.00 C ATOM 2167 CE2 PHE B 46 10.325 -0.339 14.023 1.00 0.00 C ATOM 2168 CZ PHE B 46 11.220 -1.156 13.360 1.00 0.00 C ATOM 0 H PHE B 46 7.949 -5.037 13.990 1.00 0.00 H new ATOM 0 HA PHE B 46 8.203 -3.505 16.385 1.00 0.00 H new ATOM 0 HB2 PHE B 46 6.870 -3.047 13.702 1.00 0.00 H new ATOM 0 HB3 PHE B 46 6.814 -1.857 14.987 1.00 0.00 H new ATOM 0 HD1 PHE B 46 9.395 -3.988 13.274 1.00 0.00 H new ATOM 0 HD2 PHE B 46 8.402 -0.194 14.930 1.00 0.00 H new ATOM 0 HE1 PHE B 46 11.582 -3.112 12.574 1.00 0.00 H new ATOM 0 HE2 PHE B 46 10.585 0.687 14.237 1.00 0.00 H new ATOM 0 HZ PHE B 46 12.180 -0.769 13.052 1.00 0.00 H new ATOM 2178 N ASP B 47 5.250 -4.731 15.604 1.00 0.00 N ATOM 2179 CA ASP B 47 3.919 -5.015 16.125 1.00 0.00 C ATOM 2180 C ASP B 47 4.003 -5.708 17.482 1.00 0.00 C ATOM 2181 O ASP B 47 3.229 -5.415 18.391 1.00 0.00 O ATOM 2182 CB ASP B 47 3.151 -5.891 15.128 1.00 0.00 C ATOM 2183 CG ASP B 47 1.769 -6.276 15.621 1.00 0.00 C ATOM 2184 OD1 ASP B 47 1.418 -5.901 16.756 1.00 0.00 O ATOM 2185 OD2 ASP B 47 1.041 -6.958 14.868 1.00 0.00 O ATOM 0 H ASP B 47 5.436 -5.135 14.686 1.00 0.00 H new ATOM 0 HA ASP B 47 3.388 -4.072 16.259 1.00 0.00 H new ATOM 0 HB2 ASP B 47 3.058 -5.359 14.181 1.00 0.00 H new ATOM 0 HB3 ASP B 47 3.725 -6.796 14.930 1.00 0.00 H new ATOM 2190 N LYS B 48 4.944 -6.634 17.604 1.00 0.00 N ATOM 2191 CA LYS B 48 5.135 -7.385 18.833 1.00 0.00 C ATOM 2192 C LYS B 48 5.899 -6.585 19.886 1.00 0.00 C ATOM 2193 O LYS B 48 5.538 -6.587 21.063 1.00 0.00 O ATOM 2194 CB LYS B 48 5.880 -8.683 18.525 1.00 0.00 C ATOM 2195 CG LYS B 48 6.208 -9.487 19.763 1.00 0.00 C ATOM 2196 CD LYS B 48 4.960 -9.740 20.590 1.00 0.00 C ATOM 2197 CE LYS B 48 5.297 -10.346 21.936 1.00 0.00 C ATOM 2198 NZ LYS B 48 5.998 -11.653 21.801 1.00 0.00 N ATOM 0 H LYS B 48 5.592 -6.884 16.857 1.00 0.00 H new ATOM 0 HA LYS B 48 4.150 -7.605 19.245 1.00 0.00 H new ATOM 0 HB2 LYS B 48 5.275 -9.292 17.854 1.00 0.00 H new ATOM 0 HB3 LYS B 48 6.804 -8.448 17.996 1.00 0.00 H new ATOM 0 HG2 LYS B 48 6.658 -10.437 19.476 1.00 0.00 H new ATOM 0 HG3 LYS B 48 6.945 -8.954 20.363 1.00 0.00 H new ATOM 0 HD2 LYS B 48 4.424 -8.803 20.736 1.00 0.00 H new ATOM 0 HD3 LYS B 48 4.292 -10.408 20.047 1.00 0.00 H new ATOM 0 HE2 LYS B 48 5.925 -9.654 22.498 1.00 0.00 H new ATOM 0 HE3 LYS B 48 4.381 -10.484 22.511 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 6.089 -12.096 22.737 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 5.451 -12.277 21.174 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 6.944 -11.499 21.397 1.00 0.00 H new ATOM 2212 N LYS B 49 6.966 -5.927 19.463 1.00 0.00 N ATOM 2213 CA LYS B 49 7.800 -5.149 20.374 1.00 0.00 C ATOM 2214 C LYS B 49 7.144 -3.840 20.792 1.00 0.00 C ATOM 2215 O LYS B 49 6.871 -3.612 21.969 1.00 0.00 O ATOM 2216 CB LYS B 49 9.153 -4.856 19.724 1.00 0.00 C ATOM 2217 CG LYS B 49 9.984 -6.100 19.473 1.00 0.00 C ATOM 2218 CD LYS B 49 10.218 -6.868 20.760 1.00 0.00 C ATOM 2219 CE LYS B 49 11.078 -8.100 20.531 1.00 0.00 C ATOM 2220 NZ LYS B 49 11.310 -8.859 21.791 1.00 0.00 N ATOM 0 H LYS B 49 7.278 -5.914 18.492 1.00 0.00 H new ATOM 0 HA LYS B 49 7.936 -5.750 21.273 1.00 0.00 H new ATOM 0 HB2 LYS B 49 8.989 -4.341 18.778 1.00 0.00 H new ATOM 0 HB3 LYS B 49 9.715 -4.176 20.364 1.00 0.00 H new ATOM 0 HG2 LYS B 49 9.477 -6.740 18.751 1.00 0.00 H new ATOM 0 HG3 LYS B 49 10.941 -5.819 19.034 1.00 0.00 H new ATOM 0 HD2 LYS B 49 10.701 -6.218 21.489 1.00 0.00 H new ATOM 0 HD3 LYS B 49 9.260 -7.167 21.185 1.00 0.00 H new ATOM 0 HE2 LYS B 49 10.595 -8.749 19.800 1.00 0.00 H new ATOM 0 HE3 LYS B 49 12.036 -7.800 20.107 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 11.901 -9.691 21.591 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 11.794 -8.248 22.480 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 10.398 -9.168 22.183 1.00 0.00 H new ATOM 2234 N TYR B 50 6.920 -2.979 19.817 1.00 0.00 N ATOM 2235 CA TYR B 50 6.323 -1.671 20.063 1.00 0.00 C ATOM 2236 C TYR B 50 4.808 -1.748 20.221 1.00 0.00 C ATOM 2237 O TYR B 50 4.187 -0.794 20.687 1.00 0.00 O ATOM 2238 CB TYR B 50 6.700 -0.706 18.939 1.00 0.00 C ATOM 2239 CG TYR B 50 8.184 -0.412 18.882 1.00 0.00 C ATOM 2240 CD1 TYR B 50 9.108 -1.435 18.711 1.00 0.00 C ATOM 2241 CD2 TYR B 50 8.662 0.887 19.011 1.00 0.00 C ATOM 2242 CE1 TYR B 50 10.463 -1.177 18.671 1.00 0.00 C ATOM 2243 CE2 TYR B 50 10.018 1.154 18.968 1.00 0.00 C ATOM 2244 CZ TYR B 50 10.913 0.120 18.799 1.00 0.00 C ATOM 2245 OH TYR B 50 12.264 0.382 18.760 1.00 0.00 O ATOM 0 H TYR B 50 7.143 -3.160 18.838 1.00 0.00 H new ATOM 0 HA TYR B 50 6.721 -1.298 21.007 1.00 0.00 H new ATOM 0 HB2 TYR B 50 6.382 -1.127 17.985 1.00 0.00 H new ATOM 0 HB3 TYR B 50 6.155 0.229 19.073 1.00 0.00 H new ATOM 0 HD1 TYR B 50 8.759 -2.452 18.607 1.00 0.00 H new ATOM 0 HD2 TYR B 50 7.964 1.700 19.147 1.00 0.00 H new ATOM 0 HE1 TYR B 50 11.167 -1.986 18.540 1.00 0.00 H new ATOM 0 HE2 TYR B 50 10.374 2.169 19.066 1.00 0.00 H new ATOM 0 HH TYR B 50 12.414 1.345 18.863 1.00 0.00 H new ATOM 2255 N ASN B 51 4.222 -2.881 19.824 1.00 0.00 N ATOM 2256 CA ASN B 51 2.773 -3.098 19.908 1.00 0.00 C ATOM 2257 C ASN B 51 2.106 -2.710 18.598 1.00 0.00 C ATOM 2258 O ASN B 51 2.541 -1.776 17.926 1.00 0.00 O ATOM 2259 CB ASN B 51 2.138 -2.322 21.070 1.00 0.00 C ATOM 2260 CG ASN B 51 2.822 -2.599 22.395 1.00 0.00 C ATOM 2261 OD1 ASN B 51 2.876 -3.741 22.852 1.00 0.00 O ATOM 2262 ND2 ASN B 51 3.348 -1.552 23.020 1.00 0.00 N ATOM 0 H ASN B 51 4.736 -3.672 19.436 1.00 0.00 H new ATOM 0 HA ASN B 51 2.615 -4.160 20.097 1.00 0.00 H new ATOM 0 HB2 ASN B 51 2.184 -1.254 20.857 1.00 0.00 H new ATOM 0 HB3 ASN B 51 1.083 -2.587 21.147 1.00 0.00 H new ATOM 0 HD21 ASN B 51 3.820 -1.677 23.916 1.00 0.00 H new ATOM 0 HD22 ASN B 51 3.280 -0.623 22.604 1.00 0.00 H new ATOM 2269 N PRO B 52 1.043 -3.428 18.206 1.00 0.00 N ATOM 2270 CA PRO B 52 0.334 -3.152 16.957 1.00 0.00 C ATOM 2271 C PRO B 52 -0.296 -1.758 16.936 1.00 0.00 C ATOM 2272 O PRO B 52 -0.336 -1.079 17.962 1.00 0.00 O ATOM 2273 CB PRO B 52 -0.756 -4.231 16.902 1.00 0.00 C ATOM 2274 CG PRO B 52 -0.892 -4.728 18.303 1.00 0.00 C ATOM 2275 CD PRO B 52 0.458 -4.561 18.942 1.00 0.00 C ATOM 0 HA PRO B 52 1.011 -3.173 16.103 1.00 0.00 H new ATOM 0 HB2 PRO B 52 -1.698 -3.820 16.538 1.00 0.00 H new ATOM 0 HB3 PRO B 52 -0.477 -5.038 16.224 1.00 0.00 H new ATOM 0 HG2 PRO B 52 -1.651 -4.163 18.844 1.00 0.00 H new ATOM 0 HG3 PRO B 52 -1.202 -5.773 18.317 1.00 0.00 H new ATOM 0 HD2 PRO B 52 0.375 -4.349 20.008 1.00 0.00 H new ATOM 0 HD3 PRO B 52 1.064 -5.461 18.843 1.00 0.00 H new ATOM 2283 N THR B 53 -0.788 -1.323 15.767 1.00 0.00 N ATOM 2284 CA THR B 53 -0.748 -2.119 14.543 1.00 0.00 C ATOM 2285 C THR B 53 0.083 -1.428 13.470 1.00 0.00 C ATOM 2286 O THR B 53 -0.291 -0.369 12.967 1.00 0.00 O ATOM 2287 CB THR B 53 -2.170 -2.346 14.035 1.00 0.00 C ATOM 2288 OG1 THR B 53 -2.174 -3.208 12.913 1.00 0.00 O ATOM 2289 CG2 THR B 53 -2.874 -1.065 13.635 1.00 0.00 C ATOM 0 H THR B 53 -1.224 -0.408 15.649 1.00 0.00 H new ATOM 0 HA THR B 53 -0.282 -3.078 14.768 1.00 0.00 H new ATOM 0 HB THR B 53 -2.707 -2.791 14.873 1.00 0.00 H new ATOM 0 HG1 THR B 53 -1.786 -4.073 13.163 1.00 0.00 H new ATOM 0 HG21 THR B 53 -3.879 -1.297 13.283 1.00 0.00 H new ATOM 0 HG22 THR B 53 -2.935 -0.399 14.496 1.00 0.00 H new ATOM 0 HG23 THR B 53 -2.315 -0.576 12.837 1.00 0.00 H new ATOM 2297 N TRP B 54 1.217 -2.029 13.128 1.00 0.00 N ATOM 2298 CA TRP B 54 2.105 -1.463 12.122 1.00 0.00 C ATOM 2299 C TRP B 54 1.773 -1.950 10.723 1.00 0.00 C ATOM 2300 O TRP B 54 1.738 -3.152 10.454 1.00 0.00 O ATOM 2301 CB TRP B 54 3.554 -1.794 12.455 1.00 0.00 C ATOM 2302 CG TRP B 54 3.952 -1.309 13.807 1.00 0.00 C ATOM 2303 CD1 TRP B 54 3.419 -1.699 14.999 1.00 0.00 C ATOM 2304 CD2 TRP B 54 4.946 -0.327 14.109 1.00 0.00 C ATOM 2305 NE1 TRP B 54 4.032 -1.035 16.029 1.00 0.00 N ATOM 2306 CE2 TRP B 54 4.974 -0.184 15.509 1.00 0.00 C ATOM 2307 CE3 TRP B 54 5.820 0.441 13.334 1.00 0.00 C ATOM 2308 CZ2 TRP B 54 5.841 0.694 16.150 1.00 0.00 C ATOM 2309 CZ3 TRP B 54 6.679 1.316 13.973 1.00 0.00 C ATOM 2310 CH2 TRP B 54 6.685 1.435 15.369 1.00 0.00 C ATOM 0 H TRP B 54 1.542 -2.907 13.533 1.00 0.00 H new ATOM 0 HA TRP B 54 1.962 -0.383 12.136 1.00 0.00 H new ATOM 0 HB2 TRP B 54 3.699 -2.873 12.402 1.00 0.00 H new ATOM 0 HB3 TRP B 54 4.207 -1.348 11.705 1.00 0.00 H new ATOM 0 HD1 TRP B 54 2.628 -2.426 15.115 1.00 0.00 H new ATOM 0 HE1 TRP B 54 3.822 -1.154 17.020 1.00 0.00 H new ATOM 0 HE3 TRP B 54 5.824 0.353 12.258 1.00 0.00 H new ATOM 0 HZ2 TRP B 54 5.848 0.788 17.226 1.00 0.00 H new ATOM 0 HZ3 TRP B 54 7.357 1.918 13.386 1.00 0.00 H new ATOM 0 HH2 TRP B 54 7.370 2.126 15.838 1.00 0.00 H new ATOM 2321 N HIS B 55 1.561 -0.997 9.829 1.00 0.00 N ATOM 2322 CA HIS B 55 1.262 -1.293 8.440 1.00 0.00 C ATOM 2323 C HIS B 55 2.524 -1.095 7.613 1.00 0.00 C ATOM 2324 O HIS B 55 3.214 -0.086 7.767 1.00 0.00 O ATOM 2325 CB HIS B 55 0.139 -0.385 7.944 1.00 0.00 C ATOM 2326 CG HIS B 55 -1.023 -0.325 8.888 1.00 0.00 C ATOM 2327 ND1 HIS B 55 -1.724 -1.442 9.292 1.00 0.00 N ATOM 2328 CD2 HIS B 55 -1.601 0.725 9.518 1.00 0.00 C ATOM 2329 CE1 HIS B 55 -2.680 -1.081 10.128 1.00 0.00 C ATOM 2330 NE2 HIS B 55 -2.628 0.228 10.282 1.00 0.00 N ATOM 0 H HIS B 55 1.592 -0.001 10.046 1.00 0.00 H new ATOM 0 HA HIS B 55 0.928 -2.326 8.341 1.00 0.00 H new ATOM 0 HB2 HIS B 55 0.531 0.621 7.794 1.00 0.00 H new ATOM 0 HB3 HIS B 55 -0.206 -0.740 6.973 1.00 0.00 H new ATOM 0 HD1 HIS B 55 -1.534 -2.398 8.992 1.00 0.00 H new ATOM 0 HD2 HIS B 55 -1.308 1.761 9.435 1.00 0.00 H new ATOM 0 HE1 HIS B 55 -3.385 -1.745 10.605 1.00 0.00 H new ATOM 2339 N CYS B 56 2.848 -2.059 6.762 1.00 0.00 N ATOM 2340 CA CYS B 56 4.059 -1.966 5.954 1.00 0.00 C ATOM 2341 C CYS B 56 3.777 -2.184 4.473 1.00 0.00 C ATOM 2342 O CYS B 56 2.854 -2.910 4.101 1.00 0.00 O ATOM 2343 CB CYS B 56 5.098 -2.976 6.440 1.00 0.00 C ATOM 2344 SG CYS B 56 6.689 -2.861 5.589 1.00 0.00 S ATOM 0 H CYS B 56 2.298 -2.905 6.613 1.00 0.00 H new ATOM 0 HA CYS B 56 4.450 -0.955 6.071 1.00 0.00 H new ATOM 0 HB2 CYS B 56 5.258 -2.832 7.509 1.00 0.00 H new ATOM 0 HB3 CYS B 56 4.700 -3.982 6.310 1.00 0.00 H new ATOM 0 HG CYS B 56 6.948 -1.616 5.319 1.00 0.00 H new ATOM 2350 N ILE B 57 4.589 -1.546 3.639 1.00 0.00 N ATOM 2351 CA ILE B 57 4.457 -1.651 2.194 1.00 0.00 C ATOM 2352 C ILE B 57 5.830 -1.558 1.535 1.00 0.00 C ATOM 2353 O ILE B 57 6.690 -0.802 1.986 1.00 0.00 O ATOM 2354 CB ILE B 57 3.549 -0.541 1.633 1.00 0.00 C ATOM 2355 CG1 ILE B 57 2.208 -0.531 2.371 1.00 0.00 C ATOM 2356 CG2 ILE B 57 3.338 -0.730 0.137 1.00 0.00 C ATOM 2357 CD1 ILE B 57 1.242 0.512 1.858 1.00 0.00 C ATOM 0 H ILE B 57 5.354 -0.944 3.945 1.00 0.00 H new ATOM 0 HA ILE B 57 4.004 -2.617 1.971 1.00 0.00 H new ATOM 0 HB ILE B 57 4.037 0.421 1.789 1.00 0.00 H new ATOM 0 HG12 ILE B 57 1.747 -1.515 2.283 1.00 0.00 H new ATOM 0 HG13 ILE B 57 2.388 -0.357 3.432 1.00 0.00 H new ATOM 0 HG21 ILE B 57 2.694 0.063 -0.243 1.00 0.00 H new ATOM 0 HG22 ILE B 57 4.300 -0.692 -0.374 1.00 0.00 H new ATOM 0 HG23 ILE B 57 2.869 -1.697 -0.045 1.00 0.00 H new ATOM 0 HD11 ILE B 57 0.314 0.460 2.428 1.00 0.00 H new ATOM 0 HD12 ILE B 57 1.682 1.503 1.971 1.00 0.00 H new ATOM 0 HD13 ILE B 57 1.032 0.326 0.805 1.00 0.00 H new ATOM 2369 N VAL B 58 6.036 -2.332 0.474 1.00 0.00 N ATOM 2370 CA VAL B 58 7.315 -2.332 -0.226 1.00 0.00 C ATOM 2371 C VAL B 58 7.152 -2.794 -1.669 1.00 0.00 C ATOM 2372 O VAL B 58 6.446 -3.762 -1.946 1.00 0.00 O ATOM 2373 CB VAL B 58 8.341 -3.245 0.478 1.00 0.00 C ATOM 2374 CG1 VAL B 58 9.690 -3.194 -0.227 1.00 0.00 C ATOM 2375 CG2 VAL B 58 8.482 -2.863 1.945 1.00 0.00 C ATOM 0 H VAL B 58 5.338 -2.964 0.082 1.00 0.00 H new ATOM 0 HA VAL B 58 7.681 -1.306 -0.214 1.00 0.00 H new ATOM 0 HB VAL B 58 7.974 -4.270 0.426 1.00 0.00 H new ATOM 0 HG11 VAL B 58 10.395 -3.846 0.289 1.00 0.00 H new ATOM 0 HG12 VAL B 58 9.575 -3.528 -1.258 1.00 0.00 H new ATOM 0 HG13 VAL B 58 10.067 -2.171 -0.217 1.00 0.00 H new ATOM 0 HG21 VAL B 58 9.210 -3.518 2.423 1.00 0.00 H new ATOM 0 HG22 VAL B 58 8.819 -1.829 2.021 1.00 0.00 H new ATOM 0 HG23 VAL B 58 7.518 -2.967 2.442 1.00 0.00 H new ATOM 2385 N GLY B 59 7.814 -2.094 -2.584 1.00 0.00 N ATOM 2386 CA GLY B 59 7.731 -2.446 -3.988 1.00 0.00 C ATOM 2387 C GLY B 59 8.605 -1.565 -4.858 1.00 0.00 C ATOM 2388 O GLY B 59 9.752 -1.280 -4.510 1.00 0.00 O ATOM 0 H GLY B 59 8.406 -1.290 -2.378 1.00 0.00 H new ATOM 0 HA2 GLY B 59 8.027 -3.487 -4.117 1.00 0.00 H new ATOM 0 HA3 GLY B 59 6.696 -2.366 -4.319 1.00 0.00 H new ATOM 2392 N ARG B 60 8.066 -1.133 -5.993 1.00 0.00 N ATOM 2393 CA ARG B 60 8.820 -0.277 -6.911 1.00 0.00 C ATOM 2394 C ARG B 60 7.928 0.283 -8.019 1.00 0.00 C ATOM 2395 O ARG B 60 8.390 0.493 -9.140 1.00 0.00 O ATOM 2396 CB ARG B 60 9.965 -1.073 -7.539 1.00 0.00 C ATOM 2397 CG ARG B 60 9.492 -2.273 -8.345 1.00 0.00 C ATOM 2398 CD ARG B 60 10.650 -2.993 -9.021 1.00 0.00 C ATOM 2399 NE ARG B 60 11.611 -3.522 -8.055 1.00 0.00 N ATOM 2400 CZ ARG B 60 12.715 -4.181 -8.398 1.00 0.00 C ATOM 2401 NH1 ARG B 60 13.005 -4.387 -9.678 1.00 0.00 N ATOM 2402 NH2 ARG B 60 13.535 -4.635 -7.459 1.00 0.00 N ATOM 0 H ARG B 60 7.119 -1.357 -6.300 1.00 0.00 H new ATOM 0 HA ARG B 60 9.216 0.560 -6.335 1.00 0.00 H new ATOM 0 HB2 ARG B 60 10.544 -0.414 -8.187 1.00 0.00 H new ATOM 0 HB3 ARG B 60 10.636 -1.415 -6.751 1.00 0.00 H new ATOM 0 HG2 ARG B 60 8.966 -2.967 -7.689 1.00 0.00 H new ATOM 0 HG3 ARG B 60 8.778 -1.945 -9.100 1.00 0.00 H new ATOM 0 HD2 ARG B 60 10.262 -3.810 -9.630 1.00 0.00 H new ATOM 0 HD3 ARG B 60 11.158 -2.305 -9.697 1.00 0.00 H new ATOM 0 HE ARG B 60 11.425 -3.378 -7.063 1.00 0.00 H new ATOM 0 HH11 ARG B 60 12.380 -4.039 -10.405 1.00 0.00 H new ATOM 0 HH12 ARG B 60 13.853 -4.893 -9.934 1.00 0.00 H new ATOM 0 HH21 ARG B 60 13.319 -4.479 -6.474 1.00 0.00 H new ATOM 0 HH22 ARG B 60 14.381 -5.140 -7.722 1.00 0.00 H new ATOM 2416 N ASN B 61 6.659 0.527 -7.695 1.00 0.00 N ATOM 2417 CA ASN B 61 5.689 1.067 -8.652 1.00 0.00 C ATOM 2418 C ASN B 61 4.276 0.838 -8.134 1.00 0.00 C ATOM 2419 O ASN B 61 3.631 -0.145 -8.498 1.00 0.00 O ATOM 2420 CB ASN B 61 5.838 0.408 -10.033 1.00 0.00 C ATOM 2421 CG ASN B 61 4.849 0.931 -11.069 1.00 0.00 C ATOM 2422 OD1 ASN B 61 4.719 0.356 -12.150 1.00 0.00 O ATOM 2423 ND2 ASN B 61 4.166 2.034 -10.769 1.00 0.00 N ATOM 0 H ASN B 61 6.273 0.357 -6.766 1.00 0.00 H new ATOM 0 HA ASN B 61 5.880 2.135 -8.759 1.00 0.00 H new ATOM 0 HB2 ASN B 61 6.853 0.571 -10.397 1.00 0.00 H new ATOM 0 HB3 ASN B 61 5.706 -0.669 -9.928 1.00 0.00 H new ATOM 0 HD21 ASN B 61 3.511 2.428 -11.444 1.00 0.00 H new ATOM 0 HD22 ASN B 61 4.298 2.485 -9.864 1.00 0.00 H new ATOM 2430 N PHE B 62 3.804 1.722 -7.264 1.00 0.00 N ATOM 2431 CA PHE B 62 2.472 1.559 -6.696 1.00 0.00 C ATOM 2432 C PHE B 62 2.011 2.787 -5.917 1.00 0.00 C ATOM 2433 O PHE B 62 2.774 3.385 -5.157 1.00 0.00 O ATOM 2434 CB PHE B 62 2.476 0.346 -5.768 1.00 0.00 C ATOM 2435 CG PHE B 62 3.381 0.516 -4.577 1.00 0.00 C ATOM 2436 CD1 PHE B 62 2.990 1.300 -3.502 1.00 0.00 C ATOM 2437 CD2 PHE B 62 4.628 -0.090 -4.540 1.00 0.00 C ATOM 2438 CE1 PHE B 62 3.823 1.473 -2.413 1.00 0.00 C ATOM 2439 CE2 PHE B 62 5.464 0.079 -3.452 1.00 0.00 C ATOM 2440 CZ PHE B 62 5.061 0.861 -2.388 1.00 0.00 C ATOM 0 H PHE B 62 4.313 2.545 -6.941 1.00 0.00 H new ATOM 0 HA PHE B 62 1.775 1.420 -7.522 1.00 0.00 H new ATOM 0 HB2 PHE B 62 1.460 0.158 -5.421 1.00 0.00 H new ATOM 0 HB3 PHE B 62 2.788 -0.534 -6.331 1.00 0.00 H new ATOM 0 HD1 PHE B 62 2.023 1.781 -3.516 1.00 0.00 H new ATOM 0 HD2 PHE B 62 4.950 -0.701 -5.371 1.00 0.00 H new ATOM 0 HE1 PHE B 62 3.506 2.086 -1.582 1.00 0.00 H new ATOM 0 HE2 PHE B 62 6.432 -0.400 -3.434 1.00 0.00 H new ATOM 0 HZ PHE B 62 5.713 0.994 -1.537 1.00 0.00 H new ATOM 2450 N GLY B 63 0.738 3.127 -6.089 1.00 0.00 N ATOM 2451 CA GLY B 63 0.159 4.250 -5.370 1.00 0.00 C ATOM 2452 C GLY B 63 -0.484 3.778 -4.083 1.00 0.00 C ATOM 2453 O GLY B 63 -1.142 2.739 -4.073 1.00 0.00 O ATOM 0 H GLY B 63 0.094 2.644 -6.715 1.00 0.00 H new ATOM 0 HA2 GLY B 63 0.932 4.986 -5.149 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -0.584 4.746 -5.995 1.00 0.00 H new ATOM 2457 N SER B 64 -0.282 4.503 -2.985 1.00 0.00 N ATOM 2458 CA SER B 64 -0.849 4.073 -1.709 1.00 0.00 C ATOM 2459 C SER B 64 -1.387 5.227 -0.867 1.00 0.00 C ATOM 2460 O SER B 64 -0.841 6.334 -0.865 1.00 0.00 O ATOM 2461 CB SER B 64 0.202 3.303 -0.905 1.00 0.00 C ATOM 2462 OG SER B 64 -0.295 2.924 0.368 1.00 0.00 O ATOM 0 H SER B 64 0.256 5.369 -2.951 1.00 0.00 H new ATOM 0 HA SER B 64 -1.697 3.431 -1.948 1.00 0.00 H new ATOM 0 HB2 SER B 64 0.506 2.414 -1.458 1.00 0.00 H new ATOM 0 HB3 SER B 64 1.092 3.921 -0.781 1.00 0.00 H new ATOM 0 HG SER B 64 0.408 3.037 1.041 1.00 0.00 H new ATOM 2468 N TYR B 65 -2.455 4.925 -0.129 1.00 0.00 N ATOM 2469 CA TYR B 65 -3.099 5.879 0.767 1.00 0.00 C ATOM 2470 C TYR B 65 -3.480 5.183 2.070 1.00 0.00 C ATOM 2471 O TYR B 65 -3.984 4.061 2.058 1.00 0.00 O ATOM 2472 CB TYR B 65 -4.339 6.498 0.120 1.00 0.00 C ATOM 2473 CG TYR B 65 -4.032 7.697 -0.747 1.00 0.00 C ATOM 2474 CD1 TYR B 65 -3.307 7.567 -1.924 1.00 0.00 C ATOM 2475 CD2 TYR B 65 -4.462 8.964 -0.377 1.00 0.00 C ATOM 2476 CE1 TYR B 65 -3.020 8.669 -2.709 1.00 0.00 C ATOM 2477 CE2 TYR B 65 -4.181 10.069 -1.154 1.00 0.00 C ATOM 2478 CZ TYR B 65 -3.459 9.916 -2.319 1.00 0.00 C ATOM 2479 OH TYR B 65 -3.177 11.017 -3.098 1.00 0.00 O ATOM 0 H TYR B 65 -2.898 4.006 -0.138 1.00 0.00 H new ATOM 0 HA TYR B 65 -2.393 6.683 0.976 1.00 0.00 H new ATOM 0 HB2 TYR B 65 -4.840 5.741 -0.484 1.00 0.00 H new ATOM 0 HB3 TYR B 65 -5.037 6.795 0.902 1.00 0.00 H new ATOM 0 HD1 TYR B 65 -2.962 6.591 -2.231 1.00 0.00 H new ATOM 0 HD2 TYR B 65 -5.027 9.087 0.535 1.00 0.00 H new ATOM 0 HE1 TYR B 65 -2.455 8.553 -3.622 1.00 0.00 H new ATOM 0 HE2 TYR B 65 -4.524 11.047 -0.852 1.00 0.00 H new ATOM 0 HH TYR B 65 -3.559 11.818 -2.682 1.00 0.00 H new ATOM 2489 N VAL B 66 -3.206 5.841 3.192 1.00 0.00 N ATOM 2490 CA VAL B 66 -3.487 5.268 4.507 1.00 0.00 C ATOM 2491 C VAL B 66 -3.613 6.362 5.562 1.00 0.00 C ATOM 2492 O VAL B 66 -3.279 7.507 5.304 1.00 0.00 O ATOM 2493 CB VAL B 66 -2.345 4.322 4.930 1.00 0.00 C ATOM 2494 CG1 VAL B 66 -2.669 3.611 6.235 1.00 0.00 C ATOM 2495 CG2 VAL B 66 -2.042 3.313 3.831 1.00 0.00 C ATOM 0 H VAL B 66 -2.790 6.772 3.219 1.00 0.00 H new ATOM 0 HA VAL B 66 -4.426 4.720 4.434 1.00 0.00 H new ATOM 0 HB VAL B 66 -1.456 4.931 5.093 1.00 0.00 H new ATOM 0 HG11 VAL B 66 -1.844 2.952 6.505 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -2.818 4.348 7.024 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -3.578 3.022 6.113 1.00 0.00 H new ATOM 0 HG21 VAL B 66 -1.233 2.657 4.152 1.00 0.00 H new ATOM 0 HG22 VAL B 66 -2.933 2.718 3.627 1.00 0.00 H new ATOM 0 HG23 VAL B 66 -1.743 3.840 2.925 1.00 0.00 H new ATOM 2505 N THR B 67 -4.082 6.001 6.754 1.00 0.00 N ATOM 2506 CA THR B 67 -4.222 6.958 7.848 1.00 0.00 C ATOM 2507 C THR B 67 -3.391 6.498 9.042 1.00 0.00 C ATOM 2508 O THR B 67 -3.247 5.298 9.276 1.00 0.00 O ATOM 2509 CB THR B 67 -5.691 7.113 8.249 1.00 0.00 C ATOM 2510 OG1 THR B 67 -6.464 7.565 7.151 1.00 0.00 O ATOM 2511 CG2 THR B 67 -5.901 8.084 9.390 1.00 0.00 C ATOM 0 H THR B 67 -4.372 5.051 6.987 1.00 0.00 H new ATOM 0 HA THR B 67 -3.859 7.930 7.513 1.00 0.00 H new ATOM 0 HB THR B 67 -6.008 6.122 8.575 1.00 0.00 H new ATOM 0 HG1 THR B 67 -7.287 7.036 7.091 1.00 0.00 H new ATOM 0 HG21 THR B 67 -6.964 8.147 9.624 1.00 0.00 H new ATOM 0 HG22 THR B 67 -5.356 7.737 10.268 1.00 0.00 H new ATOM 0 HG23 THR B 67 -5.534 9.069 9.102 1.00 0.00 H new ATOM 2519 N HIS B 68 -2.816 7.446 9.775 1.00 0.00 N ATOM 2520 CA HIS B 68 -1.971 7.105 10.914 1.00 0.00 C ATOM 2521 C HIS B 68 -1.801 8.283 11.869 1.00 0.00 C ATOM 2522 O HIS B 68 -1.706 9.434 11.445 1.00 0.00 O ATOM 2523 CB HIS B 68 -0.609 6.666 10.393 1.00 0.00 C ATOM 2524 CG HIS B 68 0.029 7.709 9.535 1.00 0.00 C ATOM 2525 ND1 HIS B 68 0.672 8.814 10.049 1.00 0.00 N ATOM 2526 CD2 HIS B 68 0.073 7.842 8.189 1.00 0.00 C ATOM 2527 CE1 HIS B 68 1.083 9.582 9.058 1.00 0.00 C ATOM 2528 NE2 HIS B 68 0.735 9.014 7.918 1.00 0.00 N ATOM 0 H HIS B 68 -2.918 8.446 9.603 1.00 0.00 H new ATOM 0 HA HIS B 68 -2.449 6.300 11.472 1.00 0.00 H new ATOM 0 HB2 HIS B 68 0.045 6.441 11.235 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -0.720 5.745 9.821 1.00 0.00 H new ATOM 0 HD1 HIS B 68 0.809 9.008 11.041 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -0.336 7.155 7.463 1.00 0.00 H new ATOM 0 HE1 HIS B 68 1.614 10.517 9.162 1.00 0.00 H new ATOM 2537 N GLU B 69 -1.753 7.979 13.163 1.00 0.00 N ATOM 2538 CA GLU B 69 -1.584 9.003 14.190 1.00 0.00 C ATOM 2539 C GLU B 69 -0.217 9.674 14.072 1.00 0.00 C ATOM 2540 O GLU B 69 0.741 9.073 13.585 1.00 0.00 O ATOM 2541 CB GLU B 69 -1.734 8.387 15.581 1.00 0.00 C ATOM 2542 CG GLU B 69 -0.659 7.363 15.903 1.00 0.00 C ATOM 2543 CD GLU B 69 -0.786 6.802 17.305 1.00 0.00 C ATOM 2544 OE1 GLU B 69 -0.710 7.593 18.270 1.00 0.00 O ATOM 2545 OE2 GLU B 69 -0.963 5.573 17.440 1.00 0.00 O ATOM 0 H GLU B 69 -1.829 7.029 13.526 1.00 0.00 H new ATOM 0 HA GLU B 69 -2.357 9.758 14.043 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -1.705 9.181 16.327 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -2.712 7.913 15.657 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -0.714 6.546 15.183 1.00 0.00 H new ATOM 0 HG3 GLU B 69 0.322 7.824 15.788 1.00 0.00 H new ATOM 2552 N THR B 70 -0.135 10.925 14.518 1.00 0.00 N ATOM 2553 CA THR B 70 1.114 11.680 14.462 1.00 0.00 C ATOM 2554 C THR B 70 2.231 10.984 15.231 1.00 0.00 C ATOM 2555 O THR B 70 1.985 10.255 16.192 1.00 0.00 O ATOM 2556 CB THR B 70 0.919 13.091 15.016 1.00 0.00 C ATOM 2557 OG1 THR B 70 0.345 13.048 16.310 1.00 0.00 O ATOM 2558 CG2 THR B 70 0.043 13.966 14.149 1.00 0.00 C ATOM 0 H THR B 70 -0.919 11.437 14.922 1.00 0.00 H new ATOM 0 HA THR B 70 1.404 11.738 13.413 1.00 0.00 H new ATOM 0 HB THR B 70 1.917 13.527 15.042 1.00 0.00 H new ATOM 0 HG1 THR B 70 0.230 13.961 16.647 1.00 0.00 H new ATOM 0 HG21 THR B 70 -0.051 14.952 14.604 1.00 0.00 H new ATOM 0 HG22 THR B 70 0.492 14.064 13.160 1.00 0.00 H new ATOM 0 HG23 THR B 70 -0.944 13.514 14.056 1.00 0.00 H new ATOM 2566 N LYS B 71 3.464 11.226 14.796 1.00 0.00 N ATOM 2567 CA LYS B 71 4.640 10.641 15.431 1.00 0.00 C ATOM 2568 C LYS B 71 4.633 9.125 15.308 1.00 0.00 C ATOM 2569 O LYS B 71 5.032 8.412 16.227 1.00 0.00 O ATOM 2570 CB LYS B 71 4.715 11.061 16.899 1.00 0.00 C ATOM 2571 CG LYS B 71 4.766 12.568 17.085 1.00 0.00 C ATOM 2572 CD LYS B 71 5.911 13.183 16.295 1.00 0.00 C ATOM 2573 CE LYS B 71 5.894 14.701 16.375 1.00 0.00 C ATOM 2574 NZ LYS B 71 4.621 15.270 15.855 1.00 0.00 N ATOM 0 H LYS B 71 3.675 11.828 14.000 1.00 0.00 H new ATOM 0 HA LYS B 71 5.525 11.014 14.915 1.00 0.00 H new ATOM 0 HB2 LYS B 71 3.849 10.664 17.429 1.00 0.00 H new ATOM 0 HB3 LYS B 71 5.599 10.614 17.354 1.00 0.00 H new ATOM 0 HG2 LYS B 71 3.822 13.008 16.764 1.00 0.00 H new ATOM 0 HG3 LYS B 71 4.884 12.802 18.143 1.00 0.00 H new ATOM 0 HD2 LYS B 71 6.860 12.808 16.678 1.00 0.00 H new ATOM 0 HD3 LYS B 71 5.843 12.872 15.252 1.00 0.00 H new ATOM 0 HE2 LYS B 71 6.034 15.012 17.410 1.00 0.00 H new ATOM 0 HE3 LYS B 71 6.731 15.104 15.805 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 4.754 16.279 15.640 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 4.343 14.765 14.989 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 3.875 15.164 16.572 1.00 0.00 H new ATOM 2588 N HIS B 72 4.191 8.651 14.149 1.00 0.00 N ATOM 2589 CA HIS B 72 4.134 7.223 13.863 1.00 0.00 C ATOM 2590 C HIS B 72 3.954 6.999 12.367 1.00 0.00 C ATOM 2591 O HIS B 72 2.900 6.552 11.915 1.00 0.00 O ATOM 2592 CB HIS B 72 2.991 6.558 14.637 1.00 0.00 C ATOM 2593 CG HIS B 72 3.239 6.464 16.112 1.00 0.00 C ATOM 2594 ND1 HIS B 72 4.287 5.752 16.654 1.00 0.00 N ATOM 2595 CD2 HIS B 72 2.568 7.000 17.161 1.00 0.00 C ATOM 2596 CE1 HIS B 72 4.252 5.853 17.971 1.00 0.00 C ATOM 2597 NE2 HIS B 72 3.219 6.604 18.304 1.00 0.00 N ATOM 0 H HIS B 72 3.864 9.242 13.385 1.00 0.00 H new ATOM 0 HA HIS B 72 5.072 6.769 14.182 1.00 0.00 H new ATOM 0 HB2 HIS B 72 2.073 7.120 14.467 1.00 0.00 H new ATOM 0 HB3 HIS B 72 2.829 5.556 14.240 1.00 0.00 H new ATOM 0 HD2 HIS B 72 1.687 7.622 17.108 1.00 0.00 H new ATOM 0 HE1 HIS B 72 4.950 5.398 18.658 1.00 0.00 H new ATOM 0 HE2 HIS B 72 2.948 6.850 19.256 1.00 0.00 H new ATOM 2606 N PHE B 73 4.994 7.318 11.601 1.00 0.00 N ATOM 2607 CA PHE B 73 4.954 7.161 10.154 1.00 0.00 C ATOM 2608 C PHE B 73 6.318 7.446 9.532 1.00 0.00 C ATOM 2609 O PHE B 73 7.022 8.363 9.949 1.00 0.00 O ATOM 2610 CB PHE B 73 3.879 8.073 9.555 1.00 0.00 C ATOM 2611 CG PHE B 73 3.956 8.212 8.061 1.00 0.00 C ATOM 2612 CD1 PHE B 73 4.876 9.071 7.481 1.00 0.00 C ATOM 2613 CD2 PHE B 73 3.119 7.479 7.239 1.00 0.00 C ATOM 2614 CE1 PHE B 73 4.956 9.201 6.110 1.00 0.00 C ATOM 2615 CE2 PHE B 73 3.194 7.602 5.865 1.00 0.00 C ATOM 2616 CZ PHE B 73 4.113 8.464 5.298 1.00 0.00 C ATOM 0 H PHE B 73 5.874 7.687 11.961 1.00 0.00 H new ATOM 0 HA PHE B 73 4.699 6.126 9.927 1.00 0.00 H new ATOM 0 HB2 PHE B 73 2.897 7.684 9.823 1.00 0.00 H new ATOM 0 HB3 PHE B 73 3.964 9.062 10.006 1.00 0.00 H new ATOM 0 HD1 PHE B 73 5.539 9.646 8.111 1.00 0.00 H new ATOM 0 HD2 PHE B 73 2.399 6.803 7.676 1.00 0.00 H new ATOM 0 HE1 PHE B 73 5.675 9.877 5.672 1.00 0.00 H new ATOM 0 HE2 PHE B 73 2.534 7.025 5.234 1.00 0.00 H new ATOM 0 HZ PHE B 73 4.173 8.562 4.224 1.00 0.00 H new ATOM 2626 N ILE B 74 6.689 6.642 8.535 1.00 0.00 N ATOM 2627 CA ILE B 74 7.974 6.806 7.868 1.00 0.00 C ATOM 2628 C ILE B 74 7.995 6.132 6.496 1.00 0.00 C ATOM 2629 O ILE B 74 7.411 5.065 6.301 1.00 0.00 O ATOM 2630 CB ILE B 74 9.121 6.233 8.723 1.00 0.00 C ATOM 2631 CG1 ILE B 74 10.467 6.433 8.020 1.00 0.00 C ATOM 2632 CG2 ILE B 74 8.881 4.758 9.008 1.00 0.00 C ATOM 2633 CD1 ILE B 74 11.641 5.864 8.784 1.00 0.00 C ATOM 0 H ILE B 74 6.119 5.876 8.176 1.00 0.00 H new ATOM 0 HA ILE B 74 8.118 7.878 7.735 1.00 0.00 H new ATOM 0 HB ILE B 74 9.148 6.769 9.672 1.00 0.00 H new ATOM 0 HG12 ILE B 74 10.425 5.968 7.035 1.00 0.00 H new ATOM 0 HG13 ILE B 74 10.630 7.499 7.862 1.00 0.00 H new ATOM 0 HG21 ILE B 74 9.699 4.366 9.613 1.00 0.00 H new ATOM 0 HG22 ILE B 74 7.942 4.640 9.548 1.00 0.00 H new ATOM 0 HG23 ILE B 74 8.830 4.209 8.068 1.00 0.00 H new ATOM 0 HD11 ILE B 74 12.560 6.043 8.225 1.00 0.00 H new ATOM 0 HD12 ILE B 74 11.709 6.347 9.759 1.00 0.00 H new ATOM 0 HD13 ILE B 74 11.502 4.791 8.919 1.00 0.00 H new ATOM 2645 N TYR B 75 8.689 6.769 5.558 1.00 0.00 N ATOM 2646 CA TYR B 75 8.825 6.257 4.198 1.00 0.00 C ATOM 2647 C TYR B 75 10.238 6.528 3.694 1.00 0.00 C ATOM 2648 O TYR B 75 10.808 7.582 3.976 1.00 0.00 O ATOM 2649 CB TYR B 75 7.800 6.916 3.272 1.00 0.00 C ATOM 2650 CG TYR B 75 7.848 6.409 1.848 1.00 0.00 C ATOM 2651 CD1 TYR B 75 7.658 5.064 1.561 1.00 0.00 C ATOM 2652 CD2 TYR B 75 8.082 7.278 0.791 1.00 0.00 C ATOM 2653 CE1 TYR B 75 7.703 4.600 0.260 1.00 0.00 C ATOM 2654 CE2 TYR B 75 8.127 6.823 -0.511 1.00 0.00 C ATOM 2655 CZ TYR B 75 7.937 5.482 -0.772 1.00 0.00 C ATOM 2656 OH TYR B 75 7.984 5.023 -2.069 1.00 0.00 O ATOM 0 H TYR B 75 9.172 7.653 5.718 1.00 0.00 H new ATOM 0 HA TYR B 75 8.641 5.183 4.202 1.00 0.00 H new ATOM 0 HB2 TYR B 75 6.801 6.748 3.674 1.00 0.00 H new ATOM 0 HB3 TYR B 75 7.966 7.993 3.270 1.00 0.00 H new ATOM 0 HD1 TYR B 75 7.472 4.370 2.367 1.00 0.00 H new ATOM 0 HD2 TYR B 75 8.231 8.329 0.991 1.00 0.00 H new ATOM 0 HE1 TYR B 75 7.555 3.550 0.053 1.00 0.00 H new ATOM 0 HE2 TYR B 75 8.310 7.513 -1.321 1.00 0.00 H new ATOM 0 HH TYR B 75 8.796 5.357 -2.505 1.00 0.00 H new ATOM 2666 N PHE B 76 10.817 5.574 2.973 1.00 0.00 N ATOM 2667 CA PHE B 76 12.176 5.737 2.471 1.00 0.00 C ATOM 2668 C PHE B 76 12.508 4.703 1.399 1.00 0.00 C ATOM 2669 O PHE B 76 12.116 3.541 1.495 1.00 0.00 O ATOM 2670 CB PHE B 76 13.166 5.641 3.634 1.00 0.00 C ATOM 2671 CG PHE B 76 13.069 4.355 4.408 1.00 0.00 C ATOM 2672 CD1 PHE B 76 13.446 3.153 3.834 1.00 0.00 C ATOM 2673 CD2 PHE B 76 12.592 4.350 5.710 1.00 0.00 C ATOM 2674 CE1 PHE B 76 13.353 1.970 4.543 1.00 0.00 C ATOM 2675 CE2 PHE B 76 12.496 3.171 6.423 1.00 0.00 C ATOM 2676 CZ PHE B 76 12.877 1.979 5.839 1.00 0.00 C ATOM 0 H PHE B 76 10.373 4.690 2.725 1.00 0.00 H new ATOM 0 HA PHE B 76 12.254 6.720 2.007 1.00 0.00 H new ATOM 0 HB2 PHE B 76 14.179 5.745 3.246 1.00 0.00 H new ATOM 0 HB3 PHE B 76 12.997 6.477 4.313 1.00 0.00 H new ATOM 0 HD1 PHE B 76 13.817 3.139 2.820 1.00 0.00 H new ATOM 0 HD2 PHE B 76 12.292 5.279 6.172 1.00 0.00 H new ATOM 0 HE1 PHE B 76 13.652 1.040 4.084 1.00 0.00 H new ATOM 0 HE2 PHE B 76 12.123 3.181 7.437 1.00 0.00 H new ATOM 0 HZ PHE B 76 12.803 1.056 6.395 1.00 0.00 H new ATOM 2686 N TYR B 77 13.234 5.145 0.377 1.00 0.00 N ATOM 2687 CA TYR B 77 13.628 4.270 -0.722 1.00 0.00 C ATOM 2688 C TYR B 77 14.934 3.550 -0.393 1.00 0.00 C ATOM 2689 O TYR B 77 15.820 4.120 0.241 1.00 0.00 O ATOM 2690 CB TYR B 77 13.789 5.080 -2.010 1.00 0.00 C ATOM 2691 CG TYR B 77 13.863 4.229 -3.255 1.00 0.00 C ATOM 2692 CD1 TYR B 77 12.789 3.436 -3.636 1.00 0.00 C ATOM 2693 CD2 TYR B 77 15.003 4.215 -4.050 1.00 0.00 C ATOM 2694 CE1 TYR B 77 12.846 2.653 -4.772 1.00 0.00 C ATOM 2695 CE2 TYR B 77 15.069 3.435 -5.189 1.00 0.00 C ATOM 2696 CZ TYR B 77 13.987 2.656 -5.546 1.00 0.00 C ATOM 2697 OH TYR B 77 14.047 1.877 -6.680 1.00 0.00 O ATOM 0 H TYR B 77 13.562 6.107 0.287 1.00 0.00 H new ATOM 0 HA TYR B 77 12.846 3.525 -0.866 1.00 0.00 H new ATOM 0 HB2 TYR B 77 12.951 5.771 -2.102 1.00 0.00 H new ATOM 0 HB3 TYR B 77 14.694 5.684 -1.939 1.00 0.00 H new ATOM 0 HD1 TYR B 77 11.893 3.431 -3.033 1.00 0.00 H new ATOM 0 HD2 TYR B 77 15.851 4.824 -3.773 1.00 0.00 H new ATOM 0 HE1 TYR B 77 12.001 2.041 -5.053 1.00 0.00 H new ATOM 0 HE2 TYR B 77 15.962 3.435 -5.796 1.00 0.00 H new ATOM 0 HH TYR B 77 13.203 1.390 -6.787 1.00 0.00 H new ATOM 2707 N LEU B 78 15.050 2.297 -0.824 1.00 0.00 N ATOM 2708 CA LEU B 78 16.252 1.509 -0.566 1.00 0.00 C ATOM 2709 C LEU B 78 16.250 0.209 -1.364 1.00 0.00 C ATOM 2710 O LEU B 78 15.201 -0.398 -1.584 1.00 0.00 O ATOM 2711 CB LEU B 78 16.373 1.195 0.925 1.00 0.00 C ATOM 2712 CG LEU B 78 17.620 0.398 1.320 1.00 0.00 C ATOM 2713 CD1 LEU B 78 18.881 1.149 0.918 1.00 0.00 C ATOM 2714 CD2 LEU B 78 17.619 0.109 2.816 1.00 0.00 C ATOM 0 H LEU B 78 14.328 1.806 -1.352 1.00 0.00 H new ATOM 0 HA LEU B 78 17.108 2.104 -0.883 1.00 0.00 H new ATOM 0 HB2 LEU B 78 16.369 2.133 1.480 1.00 0.00 H new ATOM 0 HB3 LEU B 78 15.490 0.637 1.236 1.00 0.00 H new ATOM 0 HG LEU B 78 17.604 -0.554 0.789 1.00 0.00 H new ATOM 0 HD11 LEU B 78 19.758 0.569 1.206 1.00 0.00 H new ATOM 0 HD12 LEU B 78 18.885 1.301 -0.161 1.00 0.00 H new ATOM 0 HD13 LEU B 78 18.905 2.116 1.421 1.00 0.00 H new ATOM 0 HD21 LEU B 78 18.512 -0.458 3.078 1.00 0.00 H new ATOM 0 HD22 LEU B 78 17.611 1.049 3.368 1.00 0.00 H new ATOM 0 HD23 LEU B 78 16.733 -0.471 3.074 1.00 0.00 H new ATOM 2726 N GLY B 79 17.436 -0.213 -1.795 1.00 0.00 N ATOM 2727 CA GLY B 79 17.561 -1.440 -2.562 1.00 0.00 C ATOM 2728 C GLY B 79 16.704 -1.431 -3.808 1.00 0.00 C ATOM 2729 O GLY B 79 16.079 -2.434 -4.149 1.00 0.00 O ATOM 0 H GLY B 79 18.315 0.275 -1.626 1.00 0.00 H new ATOM 0 HA2 GLY B 79 18.604 -1.585 -2.843 1.00 0.00 H new ATOM 0 HA3 GLY B 79 17.279 -2.287 -1.936 1.00 0.00 H new ATOM 2733 N GLN B 80 16.670 -0.290 -4.486 1.00 0.00 N ATOM 2734 CA GLN B 80 15.879 -0.146 -5.701 1.00 0.00 C ATOM 2735 C GLN B 80 14.428 -0.545 -5.449 1.00 0.00 C ATOM 2736 O GLN B 80 13.772 -1.115 -6.321 1.00 0.00 O ATOM 2737 CB GLN B 80 16.469 -0.998 -6.826 1.00 0.00 C ATOM 2738 CG GLN B 80 17.897 -0.626 -7.187 1.00 0.00 C ATOM 2739 CD GLN B 80 18.457 -1.482 -8.308 1.00 0.00 C ATOM 2740 OE1 GLN B 80 17.921 -1.502 -9.416 1.00 0.00 O ATOM 2741 NE2 GLN B 80 19.540 -2.195 -8.022 1.00 0.00 N ATOM 0 H GLN B 80 17.182 0.549 -4.214 1.00 0.00 H new ATOM 0 HA GLN B 80 15.904 0.901 -6.002 1.00 0.00 H new ATOM 0 HB2 GLN B 80 16.440 -2.047 -6.530 1.00 0.00 H new ATOM 0 HB3 GLN B 80 15.842 -0.899 -7.712 1.00 0.00 H new ATOM 0 HG2 GLN B 80 17.932 0.422 -7.483 1.00 0.00 H new ATOM 0 HG3 GLN B 80 18.529 -0.729 -6.305 1.00 0.00 H new ATOM 0 HE21 GLN B 80 19.950 -2.147 -7.089 1.00 0.00 H new ATOM 0 HE22 GLN B 80 19.962 -2.790 -8.735 1.00 0.00 H new ATOM 2750 N VAL B 81 13.937 -0.238 -4.252 1.00 0.00 N ATOM 2751 CA VAL B 81 12.565 -0.564 -3.883 1.00 0.00 C ATOM 2752 C VAL B 81 12.077 0.324 -2.743 1.00 0.00 C ATOM 2753 O VAL B 81 12.766 0.502 -1.739 1.00 0.00 O ATOM 2754 CB VAL B 81 12.426 -2.039 -3.461 1.00 0.00 C ATOM 2755 CG1 VAL B 81 12.752 -2.964 -4.623 1.00 0.00 C ATOM 2756 CG2 VAL B 81 13.320 -2.345 -2.268 1.00 0.00 C ATOM 0 H VAL B 81 14.469 0.236 -3.522 1.00 0.00 H new ATOM 0 HA VAL B 81 11.953 -0.389 -4.768 1.00 0.00 H new ATOM 0 HB VAL B 81 11.391 -2.211 -3.166 1.00 0.00 H new ATOM 0 HG11 VAL B 81 12.648 -4.001 -4.303 1.00 0.00 H new ATOM 0 HG12 VAL B 81 12.067 -2.768 -5.448 1.00 0.00 H new ATOM 0 HG13 VAL B 81 13.776 -2.787 -4.952 1.00 0.00 H new ATOM 0 HG21 VAL B 81 13.206 -3.392 -1.987 1.00 0.00 H new ATOM 0 HG22 VAL B 81 14.359 -2.152 -2.533 1.00 0.00 H new ATOM 0 HG23 VAL B 81 13.036 -1.711 -1.428 1.00 0.00 H new ATOM 2766 N ALA B 82 10.882 0.879 -2.910 1.00 0.00 N ATOM 2767 CA ALA B 82 10.293 1.751 -1.900 1.00 0.00 C ATOM 2768 C ALA B 82 9.893 0.967 -0.656 1.00 0.00 C ATOM 2769 O ALA B 82 9.435 -0.171 -0.750 1.00 0.00 O ATOM 2770 CB ALA B 82 9.089 2.482 -2.472 1.00 0.00 C ATOM 0 H ALA B 82 10.301 0.740 -3.737 1.00 0.00 H new ATOM 0 HA ALA B 82 11.047 2.482 -1.608 1.00 0.00 H new ATOM 0 HB1 ALA B 82 8.659 3.129 -1.707 1.00 0.00 H new ATOM 0 HB2 ALA B 82 9.401 3.085 -3.325 1.00 0.00 H new ATOM 0 HB3 ALA B 82 8.342 1.756 -2.795 1.00 0.00 H new ATOM 2776 N ILE B 83 10.067 1.587 0.507 1.00 0.00 N ATOM 2777 CA ILE B 83 9.719 0.955 1.774 1.00 0.00 C ATOM 2778 C ILE B 83 8.879 1.898 2.632 1.00 0.00 C ATOM 2779 O ILE B 83 9.193 3.080 2.758 1.00 0.00 O ATOM 2780 CB ILE B 83 10.980 0.539 2.561 1.00 0.00 C ATOM 2781 CG1 ILE B 83 11.847 -0.394 1.713 1.00 0.00 C ATOM 2782 CG2 ILE B 83 10.598 -0.133 3.873 1.00 0.00 C ATOM 2783 CD1 ILE B 83 13.115 -0.840 2.409 1.00 0.00 C ATOM 0 H ILE B 83 10.448 2.529 0.598 1.00 0.00 H new ATOM 0 HA ILE B 83 9.141 0.061 1.542 1.00 0.00 H new ATOM 0 HB ILE B 83 11.555 1.435 2.793 1.00 0.00 H new ATOM 0 HG12 ILE B 83 11.263 -1.273 1.442 1.00 0.00 H new ATOM 0 HG13 ILE B 83 12.111 0.112 0.784 1.00 0.00 H new ATOM 0 HG21 ILE B 83 11.501 -0.418 4.412 1.00 0.00 H new ATOM 0 HG22 ILE B 83 10.016 0.560 4.481 1.00 0.00 H new ATOM 0 HG23 ILE B 83 10.003 -1.022 3.666 1.00 0.00 H new ATOM 0 HD11 ILE B 83 13.680 -1.499 1.749 1.00 0.00 H new ATOM 0 HD12 ILE B 83 13.720 0.032 2.656 1.00 0.00 H new ATOM 0 HD13 ILE B 83 12.859 -1.375 3.324 1.00 0.00 H new ATOM 2795 N LEU B 84 7.806 1.367 3.212 1.00 0.00 N ATOM 2796 CA LEU B 84 6.915 2.166 4.047 1.00 0.00 C ATOM 2797 C LEU B 84 6.521 1.408 5.312 1.00 0.00 C ATOM 2798 O LEU B 84 6.395 0.184 5.301 1.00 0.00 O ATOM 2799 CB LEU B 84 5.663 2.555 3.260 1.00 0.00 C ATOM 2800 CG LEU B 84 4.663 3.430 4.019 1.00 0.00 C ATOM 2801 CD1 LEU B 84 5.317 4.732 4.461 1.00 0.00 C ATOM 2802 CD2 LEU B 84 3.442 3.708 3.155 1.00 0.00 C ATOM 0 H LEU B 84 7.533 0.389 3.119 1.00 0.00 H new ATOM 0 HA LEU B 84 7.448 3.069 4.342 1.00 0.00 H new ATOM 0 HB2 LEU B 84 5.970 3.082 2.357 1.00 0.00 H new ATOM 0 HB3 LEU B 84 5.156 1.644 2.941 1.00 0.00 H new ATOM 0 HG LEU B 84 4.340 2.893 4.911 1.00 0.00 H new ATOM 0 HD11 LEU B 84 4.590 5.340 4.999 1.00 0.00 H new ATOM 0 HD12 LEU B 84 6.161 4.512 5.115 1.00 0.00 H new ATOM 0 HD13 LEU B 84 5.670 5.278 3.586 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.739 4.331 3.708 1.00 0.00 H new ATOM 0 HD22 LEU B 84 3.749 4.226 2.246 1.00 0.00 H new ATOM 0 HD23 LEU B 84 2.961 2.766 2.891 1.00 0.00 H new ATOM 2814 N LEU B 85 6.332 2.147 6.402 1.00 0.00 N ATOM 2815 CA LEU B 85 5.958 1.547 7.679 1.00 0.00 C ATOM 2816 C LEU B 85 5.365 2.592 8.622 1.00 0.00 C ATOM 2817 O LEU B 85 5.807 3.743 8.646 1.00 0.00 O ATOM 2818 CB LEU B 85 7.175 0.889 8.331 1.00 0.00 C ATOM 2819 CG LEU B 85 6.901 0.211 9.674 1.00 0.00 C ATOM 2820 CD1 LEU B 85 5.864 -0.891 9.514 1.00 0.00 C ATOM 2821 CD2 LEU B 85 8.192 -0.346 10.259 1.00 0.00 C ATOM 0 H LEU B 85 6.432 3.162 6.426 1.00 0.00 H new ATOM 0 HA LEU B 85 5.200 0.788 7.486 1.00 0.00 H new ATOM 0 HB2 LEU B 85 7.581 0.147 7.643 1.00 0.00 H new ATOM 0 HB3 LEU B 85 7.946 1.646 8.474 1.00 0.00 H new ATOM 0 HG LEU B 85 6.503 0.955 10.364 1.00 0.00 H new ATOM 0 HD11 LEU B 85 5.682 -1.362 10.480 1.00 0.00 H new ATOM 0 HD12 LEU B 85 4.934 -0.464 9.137 1.00 0.00 H new ATOM 0 HD13 LEU B 85 6.232 -1.637 8.810 1.00 0.00 H new ATOM 0 HD21 LEU B 85 7.981 -0.826 11.215 1.00 0.00 H new ATOM 0 HD22 LEU B 85 8.617 -1.078 9.572 1.00 0.00 H new ATOM 0 HD23 LEU B 85 8.903 0.466 10.410 1.00 0.00 H new ATOM 2833 N PHE B 86 4.359 2.185 9.396 1.00 0.00 N ATOM 2834 CA PHE B 86 3.705 3.087 10.339 1.00 0.00 C ATOM 2835 C PHE B 86 2.604 2.373 11.119 1.00 0.00 C ATOM 2836 O PHE B 86 1.785 1.658 10.545 1.00 0.00 O ATOM 2837 CB PHE B 86 3.140 4.307 9.604 1.00 0.00 C ATOM 2838 CG PHE B 86 2.181 3.975 8.496 1.00 0.00 C ATOM 2839 CD1 PHE B 86 0.911 3.493 8.770 1.00 0.00 C ATOM 2840 CD2 PHE B 86 2.555 4.153 7.173 1.00 0.00 C ATOM 2841 CE1 PHE B 86 0.035 3.196 7.744 1.00 0.00 C ATOM 2842 CE2 PHE B 86 1.684 3.856 6.147 1.00 0.00 C ATOM 2843 CZ PHE B 86 0.422 3.377 6.432 1.00 0.00 C ATOM 0 H PHE B 86 3.981 1.238 9.387 1.00 0.00 H new ATOM 0 HA PHE B 86 4.454 3.425 11.056 1.00 0.00 H new ATOM 0 HB2 PHE B 86 2.634 4.949 10.326 1.00 0.00 H new ATOM 0 HB3 PHE B 86 3.968 4.883 9.191 1.00 0.00 H new ATOM 0 HD1 PHE B 86 0.603 3.348 9.795 1.00 0.00 H new ATOM 0 HD2 PHE B 86 3.541 4.529 6.943 1.00 0.00 H new ATOM 0 HE1 PHE B 86 -0.953 2.822 7.969 1.00 0.00 H new ATOM 0 HE2 PHE B 86 1.989 3.998 5.121 1.00 0.00 H new ATOM 0 HZ PHE B 86 -0.262 3.144 5.629 1.00 0.00 H new ATOM 2853 N LYS B 87 2.600 2.564 12.437 1.00 0.00 N ATOM 2854 CA LYS B 87 1.606 1.930 13.301 1.00 0.00 C ATOM 2855 C LYS B 87 0.331 2.754 13.395 1.00 0.00 C ATOM 2856 O LYS B 87 0.350 3.975 13.243 1.00 0.00 O ATOM 2857 CB LYS B 87 2.170 1.703 14.702 1.00 0.00 C ATOM 2858 CG LYS B 87 2.551 2.982 15.424 1.00 0.00 C ATOM 2859 CD LYS B 87 3.009 2.697 16.845 1.00 0.00 C ATOM 2860 CE LYS B 87 1.887 2.109 17.686 1.00 0.00 C ATOM 2861 NZ LYS B 87 2.319 1.855 19.089 1.00 0.00 N ATOM 0 H LYS B 87 3.273 3.152 12.929 1.00 0.00 H new ATOM 0 HA LYS B 87 1.361 0.969 12.850 1.00 0.00 H new ATOM 0 HB2 LYS B 87 1.432 1.167 15.298 1.00 0.00 H new ATOM 0 HB3 LYS B 87 3.049 1.062 14.630 1.00 0.00 H new ATOM 0 HG2 LYS B 87 3.347 3.488 14.877 1.00 0.00 H new ATOM 0 HG3 LYS B 87 1.697 3.660 15.443 1.00 0.00 H new ATOM 0 HD2 LYS B 87 3.851 2.005 16.825 1.00 0.00 H new ATOM 0 HD3 LYS B 87 3.365 3.619 17.305 1.00 0.00 H new ATOM 0 HE2 LYS B 87 1.037 2.792 17.686 1.00 0.00 H new ATOM 0 HE3 LYS B 87 1.547 1.176 17.236 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 1.526 1.454 19.629 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 3.114 1.184 19.091 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 2.620 2.749 19.527 1.00 0.00 H new ATOM 2875 N SER B 88 -0.779 2.070 13.658 1.00 0.00 N ATOM 2876 CA SER B 88 -2.069 2.730 13.787 1.00 0.00 C ATOM 2877 C SER B 88 -2.730 2.372 15.115 1.00 0.00 C ATOM 2878 O SER B 88 -2.942 1.198 15.419 1.00 0.00 O ATOM 2879 CB SER B 88 -2.985 2.338 12.628 1.00 0.00 C ATOM 2880 OG SER B 88 -4.243 2.984 12.730 1.00 0.00 O ATOM 0 H SER B 88 -0.808 1.058 13.786 1.00 0.00 H new ATOM 0 HA SER B 88 -1.903 3.807 13.760 1.00 0.00 H new ATOM 0 HB2 SER B 88 -2.513 2.602 11.682 1.00 0.00 H new ATOM 0 HB3 SER B 88 -3.127 1.257 12.622 1.00 0.00 H new ATOM 0 HG SER B 88 -4.810 2.718 11.976 1.00 0.00 H new ATOM 2886 N GLY B 89 -3.051 3.392 15.902 1.00 0.00 N ATOM 2887 CA GLY B 89 -3.684 3.166 17.188 1.00 0.00 C ATOM 2888 C GLY B 89 -3.974 4.459 17.926 1.00 0.00 C ATOM 2889 O GLY B 89 -4.217 5.484 17.254 1.00 0.00 O ATOM 2890 OXT GLY B 89 -3.959 4.447 19.175 1.00 0.00 O ATOM 0 H GLY B 89 -2.884 4.372 15.673 1.00 0.00 H new ATOM 0 HA2 GLY B 89 -4.615 2.619 17.040 1.00 0.00 H new ATOM 0 HA3 GLY B 89 -3.039 2.538 17.802 1.00 0.00 H new ATOM 2895 N MET C 1 -9.544 -7.824 12.799 1.00 0.00 N ATOM 2896 CA MET C 1 -8.143 -7.342 12.677 1.00 0.00 C ATOM 2897 C MET C 1 -7.296 -8.310 11.858 1.00 0.00 C ATOM 2898 O MET C 1 -6.168 -8.632 12.231 1.00 0.00 O ATOM 2899 CB MET C 1 -7.558 -7.185 14.081 1.00 0.00 C ATOM 2900 CG MET C 1 -7.517 -8.484 14.872 1.00 0.00 C ATOM 2901 SD MET C 1 -6.818 -8.270 16.520 1.00 0.00 S ATOM 2902 CE MET C 1 -6.912 -9.945 17.148 1.00 0.00 C ATOM 0 H1 MET C 1 -10.028 -7.298 13.555 1.00 0.00 H new ATOM 0 H2 MET C 1 -10.043 -7.673 11.899 1.00 0.00 H new ATOM 0 H3 MET C 1 -9.543 -8.838 13.029 1.00 0.00 H new ATOM 0 HA MET C 1 -8.138 -6.383 12.158 1.00 0.00 H new ATOM 0 HB2 MET C 1 -6.547 -6.785 14.002 1.00 0.00 H new ATOM 0 HB3 MET C 1 -8.148 -6.452 14.632 1.00 0.00 H new ATOM 0 HG2 MET C 1 -8.527 -8.884 14.959 1.00 0.00 H new ATOM 0 HG3 MET C 1 -6.928 -9.220 14.324 1.00 0.00 H new ATOM 0 HE1 MET C 1 -6.515 -9.976 18.163 1.00 0.00 H new ATOM 0 HE2 MET C 1 -7.951 -10.273 17.155 1.00 0.00 H new ATOM 0 HE3 MET C 1 -6.327 -10.606 16.509 1.00 0.00 H new ATOM 2914 N LYS C 2 -7.846 -8.768 10.737 1.00 0.00 N ATOM 2915 CA LYS C 2 -7.136 -9.695 9.865 1.00 0.00 C ATOM 2916 C LYS C 2 -5.989 -8.996 9.153 1.00 0.00 C ATOM 2917 O LYS C 2 -6.153 -7.903 8.610 1.00 0.00 O ATOM 2918 CB LYS C 2 -8.090 -10.313 8.844 1.00 0.00 C ATOM 2919 CG LYS C 2 -9.141 -11.212 9.466 1.00 0.00 C ATOM 2920 CD LYS C 2 -8.509 -12.396 10.182 1.00 0.00 C ATOM 2921 CE LYS C 2 -9.562 -13.308 10.789 1.00 0.00 C ATOM 2922 NZ LYS C 2 -10.476 -13.864 9.755 1.00 0.00 N ATOM 0 H LYS C 2 -8.779 -8.512 10.413 1.00 0.00 H new ATOM 0 HA LYS C 2 -6.725 -10.492 10.485 1.00 0.00 H new ATOM 0 HB2 LYS C 2 -8.586 -9.515 8.292 1.00 0.00 H new ATOM 0 HB3 LYS C 2 -7.512 -10.889 8.121 1.00 0.00 H new ATOM 0 HG2 LYS C 2 -9.742 -10.637 10.171 1.00 0.00 H new ATOM 0 HG3 LYS C 2 -9.817 -11.573 8.691 1.00 0.00 H new ATOM 0 HD2 LYS C 2 -7.897 -12.962 9.480 1.00 0.00 H new ATOM 0 HD3 LYS C 2 -7.843 -12.035 10.966 1.00 0.00 H new ATOM 0 HE2 LYS C 2 -9.073 -14.125 11.319 1.00 0.00 H new ATOM 0 HE3 LYS C 2 -10.142 -12.753 11.526 1.00 0.00 H new ATOM 0 HZ1 LYS C 2 -11.020 -14.652 10.160 1.00 0.00 H new ATOM 0 HZ2 LYS C 2 -11.129 -13.121 9.433 1.00 0.00 H new ATOM 0 HZ3 LYS C 2 -9.918 -14.208 8.947 1.00 0.00 H new ATOM 2936 N ASP C 3 -4.827 -9.630 9.163 1.00 0.00 N ATOM 2937 CA ASP C 3 -3.648 -9.066 8.524 1.00 0.00 C ATOM 2938 C ASP C 3 -3.600 -9.425 7.042 1.00 0.00 C ATOM 2939 O ASP C 3 -3.363 -10.579 6.683 1.00 0.00 O ATOM 2940 CB ASP C 3 -2.384 -9.559 9.228 1.00 0.00 C ATOM 2941 CG ASP C 3 -1.132 -8.874 8.718 1.00 0.00 C ATOM 2942 OD1 ASP C 3 -0.826 -9.015 7.516 1.00 0.00 O ATOM 2943 OD2 ASP C 3 -0.462 -8.195 9.522 1.00 0.00 O ATOM 0 H ASP C 3 -4.675 -10.536 9.607 1.00 0.00 H new ATOM 0 HA ASP C 3 -3.703 -7.981 8.606 1.00 0.00 H new ATOM 0 HB2 ASP C 3 -2.478 -9.386 10.300 1.00 0.00 H new ATOM 0 HB3 ASP C 3 -2.289 -10.636 9.086 1.00 0.00 H new ATOM 2948 N THR C 4 -3.819 -8.432 6.184 1.00 0.00 N ATOM 2949 CA THR C 4 -3.793 -8.647 4.748 1.00 0.00 C ATOM 2950 C THR C 4 -2.357 -8.738 4.242 1.00 0.00 C ATOM 2951 O THR C 4 -1.471 -8.046 4.738 1.00 0.00 O ATOM 2952 CB THR C 4 -4.525 -7.512 4.030 1.00 0.00 C ATOM 2953 OG1 THR C 4 -4.674 -7.801 2.651 1.00 0.00 O ATOM 2954 CG2 THR C 4 -3.815 -6.181 4.136 1.00 0.00 C ATOM 0 H THR C 4 -4.016 -7.471 6.463 1.00 0.00 H new ATOM 0 HA THR C 4 -4.298 -9.589 4.535 1.00 0.00 H new ATOM 0 HB THR C 4 -5.492 -7.436 4.528 1.00 0.00 H new ATOM 0 HG1 THR C 4 -5.610 -7.676 2.390 1.00 0.00 H new ATOM 0 HG21 THR C 4 -4.387 -5.420 3.605 1.00 0.00 H new ATOM 0 HG22 THR C 4 -3.723 -5.900 5.185 1.00 0.00 H new ATOM 0 HG23 THR C 4 -2.822 -6.262 3.694 1.00 0.00 H new ATOM 2962 N GLY C 5 -2.140 -9.586 3.247 1.00 0.00 N ATOM 2963 CA GLY C 5 -0.814 -9.744 2.684 1.00 0.00 C ATOM 2964 C GLY C 5 -0.871 -10.089 1.213 1.00 0.00 C ATOM 2965 O GLY C 5 -1.541 -11.046 0.823 1.00 0.00 O ATOM 0 H GLY C 5 -2.860 -10.168 2.819 1.00 0.00 H new ATOM 0 HA2 GLY C 5 -0.248 -8.822 2.820 1.00 0.00 H new ATOM 0 HA3 GLY C 5 -0.281 -10.528 3.222 1.00 0.00 H new ATOM 2969 N ILE C 6 -0.178 -9.308 0.392 1.00 0.00 N ATOM 2970 CA ILE C 6 -0.175 -9.538 -1.047 1.00 0.00 C ATOM 2971 C ILE C 6 0.985 -8.835 -1.738 1.00 0.00 C ATOM 2972 O ILE C 6 1.464 -7.799 -1.279 1.00 0.00 O ATOM 2973 CB ILE C 6 -1.493 -9.070 -1.697 1.00 0.00 C ATOM 2974 CG1 ILE C 6 -1.887 -7.681 -1.185 1.00 0.00 C ATOM 2975 CG2 ILE C 6 -2.610 -10.070 -1.443 1.00 0.00 C ATOM 2976 CD1 ILE C 6 -0.953 -6.578 -1.630 1.00 0.00 C ATOM 0 H ILE C 6 0.386 -8.514 0.696 1.00 0.00 H new ATOM 0 HA ILE C 6 -0.065 -10.614 -1.178 1.00 0.00 H new ATOM 0 HB ILE C 6 -1.333 -9.007 -2.773 1.00 0.00 H new ATOM 0 HG12 ILE C 6 -2.896 -7.450 -1.528 1.00 0.00 H new ATOM 0 HG13 ILE C 6 -1.917 -7.701 -0.096 1.00 0.00 H new ATOM 0 HG21 ILE C 6 -3.528 -9.716 -1.912 1.00 0.00 H new ATOM 0 HG22 ILE C 6 -2.336 -11.037 -1.865 1.00 0.00 H new ATOM 0 HG23 ILE C 6 -2.768 -10.175 -0.370 1.00 0.00 H new ATOM 0 HD11 ILE C 6 -1.298 -5.625 -1.228 1.00 0.00 H new ATOM 0 HD12 ILE C 6 0.053 -6.784 -1.264 1.00 0.00 H new ATOM 0 HD13 ILE C 6 -0.940 -6.529 -2.719 1.00 0.00 H new ATOM 2988 N GLN C 7 1.424 -9.408 -2.856 1.00 0.00 N ATOM 2989 CA GLN C 7 2.519 -8.840 -3.630 1.00 0.00 C ATOM 2990 C GLN C 7 2.221 -8.919 -5.122 1.00 0.00 C ATOM 2991 O GLN C 7 2.062 -10.003 -5.681 1.00 0.00 O ATOM 2992 CB GLN C 7 3.832 -9.564 -3.317 1.00 0.00 C ATOM 2993 CG GLN C 7 3.797 -11.055 -3.616 1.00 0.00 C ATOM 2994 CD GLN C 7 5.132 -11.732 -3.372 1.00 0.00 C ATOM 2995 OE1 GLN C 7 5.658 -11.713 -2.260 1.00 0.00 O ATOM 2996 NE2 GLN C 7 5.688 -12.336 -4.416 1.00 0.00 N ATOM 0 H GLN C 7 1.036 -10.267 -3.245 1.00 0.00 H new ATOM 0 HA GLN C 7 2.623 -7.791 -3.351 1.00 0.00 H new ATOM 0 HB2 GLN C 7 4.635 -9.106 -3.894 1.00 0.00 H new ATOM 0 HB3 GLN C 7 4.074 -9.420 -2.264 1.00 0.00 H new ATOM 0 HG2 GLN C 7 3.036 -11.528 -2.996 1.00 0.00 H new ATOM 0 HG3 GLN C 7 3.502 -11.206 -4.654 1.00 0.00 H new ATOM 0 HE21 GLN C 7 5.217 -12.327 -5.321 1.00 0.00 H new ATOM 0 HE22 GLN C 7 6.586 -12.809 -4.313 1.00 0.00 H new ATOM 3005 N VAL C 8 2.149 -7.758 -5.762 1.00 0.00 N ATOM 3006 CA VAL C 8 1.874 -7.688 -7.189 1.00 0.00 C ATOM 3007 C VAL C 8 3.173 -7.644 -7.984 1.00 0.00 C ATOM 3008 O VAL C 8 4.123 -6.965 -7.597 1.00 0.00 O ATOM 3009 CB VAL C 8 1.023 -6.455 -7.542 1.00 0.00 C ATOM 3010 CG1 VAL C 8 0.662 -6.453 -9.021 1.00 0.00 C ATOM 3011 CG2 VAL C 8 -0.229 -6.409 -6.681 1.00 0.00 C ATOM 0 H VAL C 8 2.278 -6.851 -5.313 1.00 0.00 H new ATOM 0 HA VAL C 8 1.313 -8.585 -7.452 1.00 0.00 H new ATOM 0 HB VAL C 8 1.613 -5.561 -7.338 1.00 0.00 H new ATOM 0 HG11 VAL C 8 0.061 -5.573 -9.248 1.00 0.00 H new ATOM 0 HG12 VAL C 8 1.574 -6.433 -9.618 1.00 0.00 H new ATOM 0 HG13 VAL C 8 0.093 -7.352 -9.258 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -0.819 -5.531 -6.944 1.00 0.00 H new ATOM 0 HG22 VAL C 8 -0.821 -7.308 -6.851 1.00 0.00 H new ATOM 0 HG23 VAL C 8 0.054 -6.355 -5.630 1.00 0.00 H new ATOM 3222 N ASP D 3 -3.844 11.253 6.550 1.00 0.00 N ATOM 3223 CA ASP D 3 -3.757 10.190 5.559 1.00 0.00 C ATOM 3224 C ASP D 3 -2.504 10.327 4.698 1.00 0.00 C ATOM 3225 O ASP D 3 -2.310 11.341 4.029 1.00 0.00 O ATOM 3226 CB ASP D 3 -5.001 10.196 4.669 1.00 0.00 C ATOM 3227 CG ASP D 3 -5.174 11.507 3.926 1.00 0.00 C ATOM 3228 OD1 ASP D 3 -5.300 12.555 4.593 1.00 0.00 O ATOM 3229 OD2 ASP D 3 -5.183 11.485 2.678 1.00 0.00 O ATOM 0 HA ASP D 3 -3.697 9.242 6.094 1.00 0.00 H new ATOM 0 HB2 ASP D 3 -4.934 9.380 3.950 1.00 0.00 H new ATOM 0 HB3 ASP D 3 -5.883 10.009 5.281 1.00 0.00 H new ATOM 3234 N THR D 4 -1.665 9.292 4.704 1.00 0.00 N ATOM 3235 CA THR D 4 -0.450 9.297 3.908 1.00 0.00 C ATOM 3236 C THR D 4 -0.782 9.084 2.440 1.00 0.00 C ATOM 3237 O THR D 4 -1.742 8.391 2.107 1.00 0.00 O ATOM 3238 CB THR D 4 0.506 8.206 4.385 1.00 0.00 C ATOM 3239 OG1 THR D 4 1.723 8.263 3.664 1.00 0.00 O ATOM 3240 CG2 THR D 4 -0.054 6.809 4.224 1.00 0.00 C ATOM 0 H THR D 4 -1.809 8.444 5.252 1.00 0.00 H new ATOM 0 HA THR D 4 0.034 10.266 4.027 1.00 0.00 H new ATOM 0 HB THR D 4 0.662 8.398 5.446 1.00 0.00 H new ATOM 0 HG1 THR D 4 2.451 8.515 4.270 1.00 0.00 H new ATOM 0 HG21 THR D 4 0.675 6.081 4.582 1.00 0.00 H new ATOM 0 HG22 THR D 4 -0.973 6.717 4.803 1.00 0.00 H new ATOM 0 HG23 THR D 4 -0.267 6.622 3.172 1.00 0.00 H new ATOM 3248 N GLY D 5 0.019 9.674 1.565 1.00 0.00 N ATOM 3249 CA GLY D 5 -0.206 9.527 0.142 1.00 0.00 C ATOM 3250 C GLY D 5 1.086 9.578 -0.642 1.00 0.00 C ATOM 3251 O GLY D 5 1.871 10.515 -0.496 1.00 0.00 O ATOM 0 H GLY D 5 0.821 10.252 1.815 1.00 0.00 H new ATOM 0 HA2 GLY D 5 -0.710 8.580 -0.050 1.00 0.00 H new ATOM 0 HA3 GLY D 5 -0.872 10.318 -0.204 1.00 0.00 H new ATOM 3255 N ILE D 6 1.312 8.568 -1.474 1.00 0.00 N ATOM 3256 CA ILE D 6 2.528 8.505 -2.274 1.00 0.00 C ATOM 3257 C ILE D 6 2.358 7.598 -3.488 1.00 0.00 C ATOM 3258 O ILE D 6 1.763 6.524 -3.402 1.00 0.00 O ATOM 3259 CB ILE D 6 3.732 8.025 -1.434 1.00 0.00 C ATOM 3260 CG1 ILE D 6 3.384 6.758 -0.647 1.00 0.00 C ATOM 3261 CG2 ILE D 6 4.200 9.125 -0.493 1.00 0.00 C ATOM 3262 CD1 ILE D 6 3.301 5.512 -1.499 1.00 0.00 C ATOM 0 H ILE D 6 0.672 7.785 -1.612 1.00 0.00 H new ATOM 0 HA ILE D 6 2.724 9.519 -2.623 1.00 0.00 H new ATOM 0 HB ILE D 6 4.545 7.785 -2.119 1.00 0.00 H new ATOM 0 HG12 ILE D 6 4.134 6.606 0.129 1.00 0.00 H new ATOM 0 HG13 ILE D 6 2.429 6.906 -0.143 1.00 0.00 H new ATOM 0 HG21 ILE D 6 5.049 8.768 0.090 1.00 0.00 H new ATOM 0 HG22 ILE D 6 4.500 9.997 -1.074 1.00 0.00 H new ATOM 0 HG23 ILE D 6 3.387 9.399 0.179 1.00 0.00 H new ATOM 0 HD11 ILE D 6 3.051 4.657 -0.870 1.00 0.00 H new ATOM 0 HD12 ILE D 6 2.530 5.642 -2.259 1.00 0.00 H new ATOM 0 HD13 ILE D 6 4.262 5.337 -1.983 1.00 0.00 H new ATOM 3274 N GLN D 7 2.886 8.048 -4.622 1.00 0.00 N ATOM 3275 CA GLN D 7 2.803 7.288 -5.864 1.00 0.00 C ATOM 3276 C GLN D 7 4.187 6.805 -6.283 1.00 0.00 C ATOM 3277 O GLN D 7 4.904 7.498 -7.005 1.00 0.00 O ATOM 3278 CB GLN D 7 2.189 8.147 -6.971 1.00 0.00 C ATOM 3279 CG GLN D 7 1.998 7.404 -8.281 1.00 0.00 C ATOM 3280 CD GLN D 7 1.496 8.303 -9.394 1.00 0.00 C ATOM 3281 OE1 GLN D 7 2.139 9.293 -9.745 1.00 0.00 O ATOM 3282 NE2 GLN D 7 0.344 7.962 -9.958 1.00 0.00 N ATOM 0 H GLN D 7 3.377 8.938 -4.706 1.00 0.00 H new ATOM 0 HA GLN D 7 2.165 6.420 -5.698 1.00 0.00 H new ATOM 0 HB2 GLN D 7 1.224 8.525 -6.633 1.00 0.00 H new ATOM 0 HB3 GLN D 7 2.828 9.013 -7.144 1.00 0.00 H new ATOM 0 HG2 GLN D 7 2.945 6.955 -8.581 1.00 0.00 H new ATOM 0 HG3 GLN D 7 1.291 6.588 -8.132 1.00 0.00 H new ATOM 0 HE21 GLN D 7 -0.156 7.133 -9.636 1.00 0.00 H new ATOM 0 HE22 GLN D 7 -0.041 8.529 -10.713 1.00 0.00 H new ATOM 3291 N VAL D 8 4.563 5.619 -5.815 1.00 0.00 N ATOM 3292 CA VAL D 8 5.866 5.049 -6.131 1.00 0.00 C ATOM 3293 C VAL D 8 5.956 4.642 -7.600 1.00 0.00 C ATOM 3294 O VAL D 8 5.014 4.082 -8.158 1.00 0.00 O ATOM 3295 CB VAL D 8 6.170 3.822 -5.250 1.00 0.00 C ATOM 3296 CG1 VAL D 8 7.565 3.285 -5.537 1.00 0.00 C ATOM 3297 CG2 VAL D 8 6.015 4.170 -3.779 1.00 0.00 C ATOM 0 H VAL D 8 3.982 5.034 -5.215 1.00 0.00 H new ATOM 0 HA VAL D 8 6.604 5.826 -5.931 1.00 0.00 H new ATOM 0 HB VAL D 8 5.451 3.039 -5.492 1.00 0.00 H new ATOM 0 HG11 VAL D 8 7.759 2.419 -4.904 1.00 0.00 H new ATOM 0 HG12 VAL D 8 7.634 2.992 -6.585 1.00 0.00 H new ATOM 0 HG13 VAL D 8 8.303 4.059 -5.328 1.00 0.00 H new ATOM 0 HG21 VAL D 8 6.234 3.291 -3.172 1.00 0.00 H new ATOM 0 HG22 VAL D 8 6.707 4.971 -3.520 1.00 0.00 H new ATOM 0 HG23 VAL D 8 4.993 4.497 -3.588 1.00 0.00 H new ATOM 3307 N ASP D 9 7.102 4.927 -8.215 1.00 0.00 N ATOM 3308 CA ASP D 9 7.330 4.589 -9.615 1.00 0.00 C ATOM 3309 C ASP D 9 8.822 4.440 -9.890 1.00 0.00 C ATOM 3310 O ASP D 9 9.605 5.350 -9.617 1.00 0.00 O ATOM 3311 CB ASP D 9 6.749 5.662 -10.540 1.00 0.00 C ATOM 3312 CG ASP D 9 5.257 5.856 -10.359 1.00 0.00 C ATOM 3313 OD1 ASP D 9 4.849 6.334 -9.280 1.00 0.00 O ATOM 3314 OD2 ASP D 9 4.497 5.532 -11.295 1.00 0.00 O ATOM 0 H ASP D 9 7.889 5.393 -7.762 1.00 0.00 H new ATOM 0 HA ASP D 9 6.828 3.642 -9.814 1.00 0.00 H new ATOM 0 HB2 ASP D 9 7.258 6.608 -10.354 1.00 0.00 H new ATOM 0 HB3 ASP D 9 6.951 5.389 -11.576 1.00 0.00 H new