USER MOD reduce.3.24.130724 H: found=0, std=0, add=1316, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1316 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 66 GLN : amide:sc=-0.00396 K(o=-0.87,f=-1.5) USER MOD Set 1.2: B 59 ASN : amide:sc= -0.863 X(o=-0.87,f=-0.86) USER MOD Set 2.1: A 48 SER OG : rot 84:sc= 1.13 USER MOD Set 2.2: B 30 THR OG1 : rot 150:sc= -0.24 USER MOD Set 3.1: A 59 ASN : amide:sc= 0.851 K(o=1.9,f=0.55!) USER MOD Set 3.2: B 66 GLN : amide:sc= 1 K(o=1.9,f=0.55) USER MOD Set 4.1: A 39 ASN : amide:sc= -0.0536 K(o=1.1,f=-0.2) USER MOD Set 4.2: A 43 ASN : amide:sc= 1.17 K(o=1.1,f=-0.033) USER MOD Set 5.1: A 35 MET CE :methyl -115:sc= -0.543 (180deg=-1.75) USER MOD Set 5.2: B 5 SER OG : rot 30:sc= 0.306 USER MOD Set 6.1: A 30 THR OG1 : rot -125:sc= 1.07 USER MOD Set 6.2: B 48 SER OG : rot 143:sc= 0.903 USER MOD Set 7.1: A 3 GLN : amide:sc= 0.506 K(o=1.2,f=0.33) USER MOD Set 7.2: B 39 ASN : amide:sc= 0.654 K(o=1.2,f=0.33) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 145:sc= 1.3 (180deg=0.806) USER MOD Single : A 5 SER OG : rot 130:sc= -0.159 USER MOD Single : A 7 TYR OH : rot 18:sc= 1.23 USER MOD Single : A 8 SER OG : rot 3:sc= 0.544 USER MOD Single : A 11 GLN :FLIP amide:sc= 0 F(o=-0.86,f=0) USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=-0.053) USER MOD Single : A 25 LYS NZ :NH3+ -131:sc= 0.886 (180deg=-0.817!) USER MOD Single : A 26 HIS : no HD1:sc= -0.709! C(o=-0.71!,f=-5!) USER MOD Single : A 27 LYS NZ :NH3+ -172:sc= 1.25 (180deg=1.13) USER MOD Single : A 33 SER OG : rot 75:sc= 1.03 USER MOD Single : A 40 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot -86:sc= 1.15 USER MOD Single : A 46 ASN : amide:sc= -0.248 K(o=-0.25,f=-5!) USER MOD Single : A 47 THR OG1 : rot -85:sc= 1.27 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 GLN : amide:sc= 0.18 K(o=0.18,f=-1.5) USER MOD Single : A 60 SER OG : rot 56:sc= 1.27 USER MOD Single : A 67 SER OG : rot 74:sc= 1.29 USER MOD Single : A 68 SER OG : rot 66:sc= 1.24 USER MOD Single : A 70 ASN : amide:sc= 0.732 K(o=0.73,f=-8.5!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 79 HIS : no HD1:sc=-0.00864 X(o=-0.0086,f=-0.2) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 82 HIS : no HD1:sc=-0.00572 X(o=-0.0057,f=-0.016) USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 170:sc= 1.32 (180deg=0.769) USER MOD Single : B 3 GLN : amide:sc= -1.14 K(o=-1.1,f=-5.9!) USER MOD Single : B 7 TYR OH : rot 6:sc= 1.26 USER MOD Single : B 8 SER OG : rot 180:sc= 0 USER MOD Single : B 11 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : B 14 GLN : amide:sc= -0.384 X(o=-0.38,f=-0.22) USER MOD Single : B 21 ASN : amide:sc=-0.00283 X(o=-0.0028,f=0) USER MOD Single : B 25 LYS NZ :NH3+ -146:sc= 1.35 (180deg=0.934) USER MOD Single : B 26 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 27 LYS NZ :NH3+ 161:sc= -0.0465 (180deg=-0.401) USER MOD Single : B 33 SER OG : rot -79:sc= 0.587 USER MOD Single : B 35 MET CE :methyl 159:sc= -1.11 (180deg=-1.99) USER MOD Single : B 40 MET CE :methyl -159:sc= -0.079 (180deg=-0.181) USER MOD Single : B 42 THR OG1 : rot 93:sc= 1.3 USER MOD Single : B 43 ASN : amide:sc= 0 X(o=0,f=-0.023) USER MOD Single : B 46 ASN : amide:sc= -0.475 K(o=-0.48,f=-2.7) USER MOD Single : B 47 THR OG1 : rot -24:sc= 0.0876 USER MOD Single : B 53 GLN :FLIP amide:sc= 0 F(o=-0.96,f=0) USER MOD Single : B 55 GLN : amide:sc= -1.32 K(o=-1.3,f=-6.1!) USER MOD Single : B 60 SER OG : rot 77:sc= 0.829 USER MOD Single : B 67 SER OG : rot 180:sc= 0 USER MOD Single : B 68 SER OG : rot 89:sc= 1.25 USER MOD Single : B 70 ASN : amide:sc= -0.0914 K(o=-0.091,f=-1.6!) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 75 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 78 HIS : no HD1:sc= 0 X(o=0,f=-0.1) USER MOD Single : B 79 HIS : no HD1:sc=-0.00138 X(o=-0.0014,f=-0.007) USER MOD Single : B 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 81 HIS : no HD1:sc= 0.979 K(o=0.98,f=-4.6!) USER MOD Single : B 82 HIS : no HD1:sc= -0.399 X(o=-0.4,f=0) USER MOD Single : B 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -19.622 -2.475 10.699 1.00 0.00 N ATOM 2 CA MET A 1 -19.399 -1.328 11.606 1.00 0.00 C ATOM 3 C MET A 1 -18.705 -0.208 10.843 1.00 0.00 C ATOM 4 O MET A 1 -18.365 -0.384 9.670 1.00 0.00 O ATOM 5 CB MET A 1 -18.543 -1.756 12.810 1.00 0.00 C ATOM 6 CG MET A 1 -19.232 -2.725 13.760 1.00 0.00 C ATOM 7 SD MET A 1 -19.553 -4.335 13.017 1.00 0.00 S ATOM 8 CE MET A 1 -20.177 -5.233 14.436 1.00 0.00 C ATOM 0 H1 MET A 1 -19.519 -3.363 11.231 1.00 0.00 H new ATOM 0 H2 MET A 1 -20.580 -2.420 10.299 1.00 0.00 H new ATOM 0 H3 MET A 1 -18.923 -2.450 9.929 1.00 0.00 H new ATOM 0 HA MET A 1 -20.361 -0.973 11.976 1.00 0.00 H new ATOM 0 HB2 MET A 1 -17.626 -2.217 12.443 1.00 0.00 H new ATOM 0 HB3 MET A 1 -18.251 -0.866 13.367 1.00 0.00 H new ATOM 0 HG2 MET A 1 -18.612 -2.858 14.647 1.00 0.00 H new ATOM 0 HG3 MET A 1 -20.175 -2.290 14.092 1.00 0.00 H new ATOM 0 HE1 MET A 1 -20.423 -6.253 14.141 1.00 0.00 H new ATOM 0 HE2 MET A 1 -19.416 -5.254 15.216 1.00 0.00 H new ATOM 0 HE3 MET A 1 -21.072 -4.739 14.815 1.00 0.00 H new ATOM 20 N PRO A 2 -18.509 0.972 11.467 1.00 0.00 N ATOM 21 CA PRO A 2 -17.693 2.036 10.876 1.00 0.00 C ATOM 22 C PRO A 2 -16.237 1.601 10.747 1.00 0.00 C ATOM 23 O PRO A 2 -15.882 0.480 11.122 1.00 0.00 O ATOM 24 CB PRO A 2 -17.820 3.194 11.874 1.00 0.00 C ATOM 25 CG PRO A 2 -18.238 2.559 13.154 1.00 0.00 C ATOM 26 CD PRO A 2 -19.077 1.375 12.767 1.00 0.00 C ATOM 0 HA PRO A 2 -18.020 2.302 9.871 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -16.873 3.723 11.987 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -18.555 3.925 11.538 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -17.372 2.250 13.739 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -18.806 3.257 13.770 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -19.007 0.574 13.503 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -20.131 1.639 12.682 1.00 0.00 H new ATOM 34 N GLN A 3 -15.390 2.476 10.235 1.00 0.00 N ATOM 35 CA GLN A 3 -13.983 2.149 10.088 1.00 0.00 C ATOM 36 C GLN A 3 -13.283 2.349 11.423 1.00 0.00 C ATOM 37 O GLN A 3 -12.623 3.365 11.651 1.00 0.00 O ATOM 38 CB GLN A 3 -13.329 3.000 8.996 1.00 0.00 C ATOM 39 CG GLN A 3 -14.032 2.906 7.650 1.00 0.00 C ATOM 40 CD GLN A 3 -14.091 1.489 7.107 1.00 0.00 C ATOM 41 OE1 GLN A 3 -13.196 1.048 6.388 1.00 0.00 O ATOM 42 NE2 GLN A 3 -15.156 0.772 7.439 1.00 0.00 N ATOM 0 H GLN A 3 -15.648 3.410 9.917 1.00 0.00 H new ATOM 0 HA GLN A 3 -13.890 1.106 9.784 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -13.315 4.041 9.318 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -12.291 2.689 8.877 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -15.046 3.294 7.748 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -13.516 3.543 6.932 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -15.876 1.176 8.038 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -15.255 -0.183 7.095 1.00 0.00 H new ATOM 51 N ILE A 4 -13.474 1.382 12.317 1.00 0.00 N ATOM 52 CA ILE A 4 -12.956 1.469 13.674 1.00 0.00 C ATOM 53 C ILE A 4 -11.433 1.426 13.702 1.00 0.00 C ATOM 54 O ILE A 4 -10.812 0.379 13.880 1.00 0.00 O ATOM 55 CB ILE A 4 -13.545 0.370 14.591 1.00 0.00 C ATOM 56 CG1 ILE A 4 -13.433 -1.014 13.939 1.00 0.00 C ATOM 57 CG2 ILE A 4 -14.997 0.686 14.917 1.00 0.00 C ATOM 58 CD1 ILE A 4 -13.957 -2.139 14.805 1.00 0.00 C ATOM 0 H ILE A 4 -13.989 0.523 12.121 1.00 0.00 H new ATOM 0 HA ILE A 4 -13.274 2.436 14.064 1.00 0.00 H new ATOM 0 HB ILE A 4 -12.968 0.352 15.516 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -13.981 -1.007 12.997 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -12.388 -1.209 13.699 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -15.403 -0.093 15.563 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -15.054 1.647 15.428 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -15.576 0.730 13.994 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -13.845 -3.086 14.278 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -13.393 -2.173 15.737 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -15.011 -1.969 15.024 1.00 0.00 H new ATOM 70 N SER A 5 -10.843 2.584 13.487 1.00 0.00 N ATOM 71 CA SER A 5 -9.410 2.731 13.529 1.00 0.00 C ATOM 72 C SER A 5 -8.958 2.933 14.966 1.00 0.00 C ATOM 73 O SER A 5 -9.762 3.272 15.834 1.00 0.00 O ATOM 74 CB SER A 5 -8.989 3.915 12.664 1.00 0.00 C ATOM 75 OG SER A 5 -9.473 3.772 11.342 1.00 0.00 O ATOM 0 H SER A 5 -11.346 3.446 13.279 1.00 0.00 H new ATOM 0 HA SER A 5 -8.939 1.829 13.138 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.370 4.840 13.097 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.902 3.993 12.651 1.00 0.00 H new ATOM 0 HG SER A 5 -9.926 4.597 11.068 1.00 0.00 H new ATOM 81 N ARG A 6 -7.669 2.749 15.214 1.00 0.00 N ATOM 82 CA ARG A 6 -7.134 2.826 16.570 1.00 0.00 C ATOM 83 C ARG A 6 -7.024 4.281 17.021 1.00 0.00 C ATOM 84 O ARG A 6 -6.639 4.571 18.153 1.00 0.00 O ATOM 85 CB ARG A 6 -5.769 2.123 16.660 1.00 0.00 C ATOM 86 CG ARG A 6 -5.836 0.599 16.531 1.00 0.00 C ATOM 87 CD ARG A 6 -6.351 0.168 15.166 1.00 0.00 C ATOM 88 NE ARG A 6 -6.481 -1.282 15.036 1.00 0.00 N ATOM 89 CZ ARG A 6 -7.644 -1.935 15.090 1.00 0.00 C ATOM 90 NH1 ARG A 6 -8.752 -1.304 15.463 1.00 0.00 N ATOM 91 NH2 ARG A 6 -7.692 -3.227 14.804 1.00 0.00 N ATOM 0 H ARG A 6 -6.973 2.545 14.496 1.00 0.00 H new ATOM 0 HA ARG A 6 -7.824 2.311 17.239 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -5.120 2.514 15.877 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -5.306 2.375 17.614 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -4.845 0.177 16.695 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -6.486 0.197 17.308 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -7.321 0.632 14.987 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -5.674 0.537 14.395 1.00 0.00 H new ATOM 0 HE ARG A 6 -5.631 -1.828 14.895 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -8.717 -0.315 15.710 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -9.638 -1.809 15.502 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -6.840 -3.723 14.542 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -8.581 -3.726 14.845 1.00 0.00 H new ATOM 105 N TYR A 7 -7.371 5.190 16.117 1.00 0.00 N ATOM 106 CA TYR A 7 -7.387 6.617 16.416 1.00 0.00 C ATOM 107 C TYR A 7 -8.825 7.128 16.408 1.00 0.00 C ATOM 108 O TYR A 7 -9.458 7.254 17.455 1.00 0.00 O ATOM 109 CB TYR A 7 -6.541 7.400 15.399 1.00 0.00 C ATOM 110 CG TYR A 7 -5.047 7.156 15.501 1.00 0.00 C ATOM 111 CD1 TYR A 7 -4.539 5.878 15.691 1.00 0.00 C ATOM 112 CD2 TYR A 7 -4.145 8.208 15.403 1.00 0.00 C ATOM 113 CE1 TYR A 7 -3.184 5.654 15.788 1.00 0.00 C ATOM 114 CE2 TYR A 7 -2.783 7.990 15.495 1.00 0.00 C ATOM 115 CZ TYR A 7 -2.310 6.709 15.690 1.00 0.00 C ATOM 116 OH TYR A 7 -0.957 6.481 15.785 1.00 0.00 O ATOM 0 H TYR A 7 -7.647 4.961 15.162 1.00 0.00 H new ATOM 0 HA TYR A 7 -6.955 6.770 17.405 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -6.871 7.139 14.394 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -6.732 8.465 15.530 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -5.220 5.043 15.764 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -4.514 9.212 15.253 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -2.810 4.652 15.941 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -2.094 8.817 15.415 1.00 0.00 H new ATOM 0 HH TYR A 7 -0.775 5.529 15.640 1.00 0.00 H new ATOM 126 N SER A 8 -9.341 7.401 15.216 1.00 0.00 N ATOM 127 CA SER A 8 -10.722 7.825 15.048 1.00 0.00 C ATOM 128 C SER A 8 -11.194 7.513 13.635 1.00 0.00 C ATOM 129 O SER A 8 -10.465 7.747 12.669 1.00 0.00 O ATOM 130 CB SER A 8 -10.871 9.326 15.322 1.00 0.00 C ATOM 131 OG SER A 8 -10.572 9.641 16.672 1.00 0.00 O ATOM 0 H SER A 8 -8.816 7.335 14.344 1.00 0.00 H new ATOM 0 HA SER A 8 -11.335 7.279 15.765 1.00 0.00 H new ATOM 0 HB2 SER A 8 -10.208 9.885 14.662 1.00 0.00 H new ATOM 0 HB3 SER A 8 -11.889 9.640 15.091 1.00 0.00 H new ATOM 0 HG SER A 8 -10.292 8.829 17.143 1.00 0.00 H new ATOM 137 N ASP A 9 -12.402 6.973 13.526 1.00 0.00 N ATOM 138 CA ASP A 9 -13.017 6.680 12.230 1.00 0.00 C ATOM 139 C ASP A 9 -13.088 7.938 11.374 1.00 0.00 C ATOM 140 O ASP A 9 -12.683 7.943 10.212 1.00 0.00 O ATOM 141 CB ASP A 9 -14.421 6.104 12.446 1.00 0.00 C ATOM 142 CG ASP A 9 -15.302 6.187 11.213 1.00 0.00 C ATOM 143 OD1 ASP A 9 -15.285 5.251 10.390 1.00 0.00 O ATOM 144 OD2 ASP A 9 -16.042 7.185 11.082 1.00 0.00 O ATOM 0 H ASP A 9 -12.983 6.726 14.327 1.00 0.00 H new ATOM 0 HA ASP A 9 -12.405 5.946 11.706 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -14.335 5.062 12.753 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -14.903 6.638 13.265 1.00 0.00 H new ATOM 149 N GLU A 10 -13.578 9.006 11.988 1.00 0.00 N ATOM 150 CA GLU A 10 -13.748 10.293 11.328 1.00 0.00 C ATOM 151 C GLU A 10 -12.437 10.779 10.714 1.00 0.00 C ATOM 152 O GLU A 10 -12.356 11.033 9.512 1.00 0.00 O ATOM 153 CB GLU A 10 -14.248 11.305 12.354 1.00 0.00 C ATOM 154 CG GLU A 10 -15.425 10.795 13.165 1.00 0.00 C ATOM 155 CD GLU A 10 -15.637 11.579 14.439 1.00 0.00 C ATOM 156 OE1 GLU A 10 -14.757 11.527 15.323 1.00 0.00 O ATOM 157 OE2 GLU A 10 -16.686 12.243 14.567 1.00 0.00 O ATOM 0 H GLU A 10 -13.871 9.004 12.965 1.00 0.00 H new ATOM 0 HA GLU A 10 -14.471 10.184 10.520 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -13.432 11.562 13.030 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -14.538 12.222 11.841 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -16.329 10.845 12.558 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -15.264 9.745 13.411 1.00 0.00 H new ATOM 164 N GLN A 11 -11.411 10.883 11.552 1.00 0.00 N ATOM 165 CA GLN A 11 -10.108 11.389 11.130 1.00 0.00 C ATOM 166 C GLN A 11 -9.543 10.569 9.975 1.00 0.00 C ATOM 167 O GLN A 11 -9.066 11.122 8.983 1.00 0.00 O ATOM 168 CB GLN A 11 -9.134 11.364 12.307 1.00 0.00 C ATOM 169 CG GLN A 11 -7.770 11.950 11.987 1.00 0.00 C ATOM 170 CD GLN A 11 -6.810 11.882 13.159 1.00 0.00 C ATOM 171 OE1 GLN A 11 -7.335 11.973 14.373 1.00 0.00 O flip ATOM 172 NE2 GLN A 11 -5.599 11.764 12.974 1.00 0.00 N flip ATOM 0 H GLN A 11 -11.457 10.621 12.537 1.00 0.00 H new ATOM 0 HA GLN A 11 -10.240 12.415 10.786 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -9.570 11.917 13.139 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -9.007 10.334 12.640 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -7.340 11.416 11.140 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -7.889 12.989 11.681 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -5.232 11.697 12.025 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -4.962 11.733 13.770 1.00 0.00 H new ATOM 181 N VAL A 12 -9.612 9.249 10.102 1.00 0.00 N ATOM 182 CA VAL A 12 -9.063 8.361 9.089 1.00 0.00 C ATOM 183 C VAL A 12 -9.845 8.467 7.783 1.00 0.00 C ATOM 184 O VAL A 12 -9.251 8.482 6.705 1.00 0.00 O ATOM 185 CB VAL A 12 -9.028 6.896 9.579 1.00 0.00 C ATOM 186 CG1 VAL A 12 -8.632 5.945 8.458 1.00 0.00 C ATOM 187 CG2 VAL A 12 -8.065 6.761 10.749 1.00 0.00 C ATOM 0 H VAL A 12 -10.042 8.773 10.895 1.00 0.00 H new ATOM 0 HA VAL A 12 -8.037 8.678 8.903 1.00 0.00 H new ATOM 0 HB VAL A 12 -10.032 6.625 9.907 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -8.617 4.923 8.836 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -9.354 6.020 7.645 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -7.641 6.210 8.089 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -8.047 5.725 11.088 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -7.065 7.057 10.433 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -8.392 7.404 11.566 1.00 0.00 H new ATOM 197 N GLU A 13 -11.165 8.572 7.873 1.00 0.00 N ATOM 198 CA GLU A 13 -11.989 8.689 6.676 1.00 0.00 C ATOM 199 C GLU A 13 -11.746 10.030 5.982 1.00 0.00 C ATOM 200 O GLU A 13 -11.677 10.094 4.754 1.00 0.00 O ATOM 201 CB GLU A 13 -13.473 8.512 7.003 1.00 0.00 C ATOM 202 CG GLU A 13 -14.359 8.516 5.768 1.00 0.00 C ATOM 203 CD GLU A 13 -15.774 8.064 6.051 1.00 0.00 C ATOM 204 OE1 GLU A 13 -16.039 6.847 5.960 1.00 0.00 O ATOM 205 OE2 GLU A 13 -16.635 8.920 6.338 1.00 0.00 O ATOM 0 H GLU A 13 -11.683 8.579 8.751 1.00 0.00 H new ATOM 0 HA GLU A 13 -11.700 7.889 5.994 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -13.611 7.573 7.539 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -13.789 9.312 7.673 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -14.382 9.522 5.348 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -13.921 7.865 5.012 1.00 0.00 H new ATOM 212 N GLN A 14 -11.601 11.095 6.767 1.00 0.00 N ATOM 213 CA GLN A 14 -11.270 12.405 6.214 1.00 0.00 C ATOM 214 C GLN A 14 -9.900 12.375 5.548 1.00 0.00 C ATOM 215 O GLN A 14 -9.709 12.947 4.475 1.00 0.00 O ATOM 216 CB GLN A 14 -11.296 13.491 7.295 1.00 0.00 C ATOM 217 CG GLN A 14 -12.601 14.276 7.359 1.00 0.00 C ATOM 218 CD GLN A 14 -13.777 13.451 7.839 1.00 0.00 C ATOM 219 OE1 GLN A 14 -14.477 12.818 7.048 1.00 0.00 O ATOM 220 NE2 GLN A 14 -14.012 13.462 9.139 1.00 0.00 N ATOM 0 H GLN A 14 -11.707 11.077 7.781 1.00 0.00 H new ATOM 0 HA GLN A 14 -12.027 12.645 5.467 1.00 0.00 H new ATOM 0 HB2 GLN A 14 -11.116 13.027 8.265 1.00 0.00 H new ATOM 0 HB3 GLN A 14 -10.475 14.186 7.116 1.00 0.00 H new ATOM 0 HG2 GLN A 14 -12.470 15.130 8.024 1.00 0.00 H new ATOM 0 HG3 GLN A 14 -12.826 14.674 6.369 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -13.409 13.999 9.762 1.00 0.00 H new ATOM 0 HE22 GLN A 14 -14.797 12.933 9.520 1.00 0.00 H new ATOM 229 N LEU A 15 -8.954 11.699 6.189 1.00 0.00 N ATOM 230 CA LEU A 15 -7.607 11.559 5.649 1.00 0.00 C ATOM 231 C LEU A 15 -7.650 10.709 4.376 1.00 0.00 C ATOM 232 O LEU A 15 -6.964 11.000 3.397 1.00 0.00 O ATOM 233 CB LEU A 15 -6.689 10.919 6.702 1.00 0.00 C ATOM 234 CG LEU A 15 -5.208 11.322 6.644 1.00 0.00 C ATOM 235 CD1 LEU A 15 -4.483 10.838 7.892 1.00 0.00 C ATOM 236 CD2 LEU A 15 -4.530 10.764 5.403 1.00 0.00 C ATOM 0 H LEU A 15 -9.096 11.237 7.087 1.00 0.00 H new ATOM 0 HA LEU A 15 -7.209 12.542 5.397 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -7.074 11.170 7.690 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -6.754 9.836 6.600 1.00 0.00 H new ATOM 0 HG LEU A 15 -5.160 12.410 6.597 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -3.434 11.130 7.839 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -4.940 11.285 8.775 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -4.555 9.752 7.957 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.483 11.068 5.393 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -4.592 9.676 5.413 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -5.028 11.148 4.513 1.00 0.00 H new ATOM 248 N LEU A 16 -8.476 9.668 4.401 1.00 0.00 N ATOM 249 CA LEU A 16 -8.683 8.811 3.241 1.00 0.00 C ATOM 250 C LEU A 16 -9.208 9.625 2.064 1.00 0.00 C ATOM 251 O LEU A 16 -8.648 9.586 0.967 1.00 0.00 O ATOM 252 CB LEU A 16 -9.672 7.693 3.585 1.00 0.00 C ATOM 253 CG LEU A 16 -9.964 6.702 2.456 1.00 0.00 C ATOM 254 CD1 LEU A 16 -8.717 5.907 2.108 1.00 0.00 C ATOM 255 CD2 LEU A 16 -11.102 5.770 2.849 1.00 0.00 C ATOM 0 H LEU A 16 -9.018 9.396 5.222 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.727 8.369 2.961 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.284 7.139 4.440 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.612 8.147 3.899 1.00 0.00 H new ATOM 0 HG LEU A 16 -10.268 7.264 1.573 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.944 5.208 1.303 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.930 6.588 1.785 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.381 5.354 2.985 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -11.298 5.071 2.036 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -10.825 5.215 3.745 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -12.000 6.356 3.048 1.00 0.00 H new ATOM 267 N ALA A 17 -10.280 10.375 2.306 1.00 0.00 N ATOM 268 CA ALA A 17 -10.881 11.214 1.276 1.00 0.00 C ATOM 269 C ALA A 17 -9.893 12.271 0.796 1.00 0.00 C ATOM 270 O ALA A 17 -9.901 12.652 -0.370 1.00 0.00 O ATOM 271 CB ALA A 17 -12.152 11.868 1.795 1.00 0.00 C ATOM 0 H ALA A 17 -10.751 10.418 3.210 1.00 0.00 H new ATOM 0 HA ALA A 17 -11.141 10.580 0.428 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.587 12.490 1.013 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -12.866 11.097 2.084 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -11.916 12.486 2.661 1.00 0.00 H new ATOM 277 N GLU A 18 -9.039 12.728 1.705 1.00 0.00 N ATOM 278 CA GLU A 18 -7.993 13.691 1.376 1.00 0.00 C ATOM 279 C GLU A 18 -7.041 13.104 0.336 1.00 0.00 C ATOM 280 O GLU A 18 -6.770 13.721 -0.694 1.00 0.00 O ATOM 281 CB GLU A 18 -7.215 14.067 2.642 1.00 0.00 C ATOM 282 CG GLU A 18 -6.084 15.052 2.405 1.00 0.00 C ATOM 283 CD GLU A 18 -6.560 16.475 2.207 1.00 0.00 C ATOM 284 OE1 GLU A 18 -7.043 16.804 1.107 1.00 0.00 O ATOM 285 OE2 GLU A 18 -6.438 17.279 3.159 1.00 0.00 O ATOM 0 H GLU A 18 -9.051 12.444 2.685 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.457 14.586 0.961 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -7.907 14.493 3.368 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.805 13.160 3.087 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -5.400 15.020 3.253 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -5.518 14.740 1.527 1.00 0.00 H new ATOM 292 N LEU A 19 -6.551 11.898 0.606 1.00 0.00 N ATOM 293 CA LEU A 19 -5.616 11.228 -0.291 1.00 0.00 C ATOM 294 C LEU A 19 -6.259 10.953 -1.650 1.00 0.00 C ATOM 295 O LEU A 19 -5.633 11.146 -2.695 1.00 0.00 O ATOM 296 CB LEU A 19 -5.121 9.920 0.335 1.00 0.00 C ATOM 297 CG LEU A 19 -4.350 10.080 1.647 1.00 0.00 C ATOM 298 CD1 LEU A 19 -3.946 8.720 2.197 1.00 0.00 C ATOM 299 CD2 LEU A 19 -3.124 10.958 1.445 1.00 0.00 C ATOM 0 H LEU A 19 -6.787 11.363 1.442 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.764 11.890 -0.446 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -5.980 9.272 0.513 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.481 9.410 -0.385 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.004 10.565 2.371 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.399 8.853 3.130 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -4.839 8.122 2.382 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.311 8.209 1.473 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -2.589 11.059 2.390 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.468 10.502 0.704 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.435 11.943 1.097 1.00 0.00 H new ATOM 311 N LEU A 20 -7.510 10.508 -1.632 1.00 0.00 N ATOM 312 CA LEU A 20 -8.250 10.262 -2.865 1.00 0.00 C ATOM 313 C LEU A 20 -8.487 11.568 -3.616 1.00 0.00 C ATOM 314 O LEU A 20 -8.446 11.603 -4.845 1.00 0.00 O ATOM 315 CB LEU A 20 -9.583 9.564 -2.576 1.00 0.00 C ATOM 316 CG LEU A 20 -9.530 8.030 -2.527 1.00 0.00 C ATOM 317 CD1 LEU A 20 -8.575 7.541 -1.448 1.00 0.00 C ATOM 318 CD2 LEU A 20 -10.920 7.461 -2.302 1.00 0.00 C ATOM 0 H LEU A 20 -8.033 10.310 -0.779 1.00 0.00 H new ATOM 0 HA LEU A 20 -7.650 9.603 -3.492 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -9.964 9.927 -1.622 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -10.302 9.861 -3.340 1.00 0.00 H new ATOM 0 HG LEU A 20 -9.155 7.677 -3.488 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -8.562 6.451 -1.441 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -7.572 7.915 -1.653 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -8.906 7.906 -0.476 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -10.867 6.373 -2.270 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -11.317 7.833 -1.358 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -11.575 7.768 -3.117 1.00 0.00 H new ATOM 330 N ASN A 21 -8.719 12.641 -2.865 1.00 0.00 N ATOM 331 CA ASN A 21 -8.896 13.967 -3.446 1.00 0.00 C ATOM 332 C ASN A 21 -7.653 14.373 -4.225 1.00 0.00 C ATOM 333 O ASN A 21 -7.753 14.881 -5.338 1.00 0.00 O ATOM 334 CB ASN A 21 -9.195 15.001 -2.353 1.00 0.00 C ATOM 335 CG ASN A 21 -9.293 16.421 -2.888 1.00 0.00 C ATOM 336 OD1 ASN A 21 -8.301 17.149 -2.942 1.00 0.00 O ATOM 337 ND2 ASN A 21 -10.493 16.829 -3.274 1.00 0.00 N ATOM 0 H ASN A 21 -8.789 12.617 -1.848 1.00 0.00 H new ATOM 0 HA ASN A 21 -9.744 13.931 -4.130 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -10.131 14.739 -1.860 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -8.412 14.957 -1.596 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -10.619 17.776 -3.631 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -11.291 16.196 -3.214 1.00 0.00 H new ATOM 344 N VAL A 22 -6.485 14.127 -3.636 1.00 0.00 N ATOM 345 CA VAL A 22 -5.214 14.425 -4.289 1.00 0.00 C ATOM 346 C VAL A 22 -5.091 13.669 -5.609 1.00 0.00 C ATOM 347 O VAL A 22 -4.757 14.253 -6.642 1.00 0.00 O ATOM 348 CB VAL A 22 -4.016 14.068 -3.380 1.00 0.00 C ATOM 349 CG1 VAL A 22 -2.697 14.345 -4.088 1.00 0.00 C ATOM 350 CG2 VAL A 22 -4.092 14.840 -2.073 1.00 0.00 C ATOM 0 H VAL A 22 -6.393 13.721 -2.705 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.197 15.497 -4.485 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.064 13.002 -3.156 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -1.869 14.086 -3.429 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -2.639 13.745 -4.996 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -2.638 15.402 -4.347 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.241 14.577 -1.445 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -4.072 15.910 -2.281 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.017 14.588 -1.555 1.00 0.00 H new ATOM 360 N LEU A 23 -5.382 12.373 -5.573 1.00 0.00 N ATOM 361 CA LEU A 23 -5.310 11.539 -6.769 1.00 0.00 C ATOM 362 C LEU A 23 -6.252 12.059 -7.849 1.00 0.00 C ATOM 363 O LEU A 23 -5.829 12.333 -8.971 1.00 0.00 O ATOM 364 CB LEU A 23 -5.650 10.083 -6.435 1.00 0.00 C ATOM 365 CG LEU A 23 -4.686 9.391 -5.470 1.00 0.00 C ATOM 366 CD1 LEU A 23 -5.134 7.961 -5.214 1.00 0.00 C ATOM 367 CD2 LEU A 23 -3.266 9.414 -6.022 1.00 0.00 C ATOM 0 H LEU A 23 -5.670 11.877 -4.730 1.00 0.00 H new ATOM 0 HA LEU A 23 -4.289 11.583 -7.147 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -6.652 10.050 -6.007 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -5.681 9.512 -7.363 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.694 9.933 -4.525 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -4.439 7.480 -4.526 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -6.133 7.965 -4.778 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.152 7.411 -6.155 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -2.595 8.917 -5.321 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -3.240 8.895 -6.980 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.946 10.447 -6.160 1.00 0.00 H new ATOM 379 N GLU A 24 -7.518 12.231 -7.493 1.00 0.00 N ATOM 380 CA GLU A 24 -8.534 12.690 -8.437 1.00 0.00 C ATOM 381 C GLU A 24 -8.257 14.109 -8.929 1.00 0.00 C ATOM 382 O GLU A 24 -8.687 14.492 -10.018 1.00 0.00 O ATOM 383 CB GLU A 24 -9.917 12.623 -7.790 1.00 0.00 C ATOM 384 CG GLU A 24 -10.454 11.208 -7.646 1.00 0.00 C ATOM 385 CD GLU A 24 -10.692 10.547 -8.988 1.00 0.00 C ATOM 386 OE1 GLU A 24 -11.644 10.953 -9.692 1.00 0.00 O ATOM 387 OE2 GLU A 24 -9.936 9.623 -9.348 1.00 0.00 O ATOM 0 H GLU A 24 -7.870 12.059 -6.551 1.00 0.00 H new ATOM 0 HA GLU A 24 -8.502 12.028 -9.303 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -9.871 13.087 -6.805 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.616 13.209 -8.386 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -9.749 10.610 -7.069 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.387 11.231 -7.084 1.00 0.00 H new ATOM 394 N LYS A 25 -7.533 14.884 -8.133 1.00 0.00 N ATOM 395 CA LYS A 25 -7.217 16.263 -8.486 1.00 0.00 C ATOM 396 C LYS A 25 -6.185 16.310 -9.617 1.00 0.00 C ATOM 397 O LYS A 25 -6.057 17.317 -10.314 1.00 0.00 O ATOM 398 CB LYS A 25 -6.711 17.010 -7.246 1.00 0.00 C ATOM 399 CG LYS A 25 -6.619 18.519 -7.410 1.00 0.00 C ATOM 400 CD LYS A 25 -6.537 19.224 -6.059 1.00 0.00 C ATOM 401 CE LYS A 25 -5.301 18.813 -5.273 1.00 0.00 C ATOM 402 NZ LYS A 25 -4.057 19.388 -5.848 1.00 0.00 N ATOM 0 H LYS A 25 -7.152 14.581 -7.236 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.121 16.755 -8.845 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -7.373 16.788 -6.409 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -5.726 16.625 -6.983 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -5.741 18.769 -8.006 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.489 18.880 -7.958 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -6.525 20.303 -6.214 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -7.429 18.995 -5.476 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -5.405 19.138 -4.238 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -5.225 17.726 -5.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -3.345 18.638 -5.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -4.264 19.803 -6.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -3.690 20.126 -5.214 1.00 0.00 H new ATOM 416 N HIS A 26 -5.456 15.212 -9.800 1.00 0.00 N ATOM 417 CA HIS A 26 -4.494 15.105 -10.895 1.00 0.00 C ATOM 418 C HIS A 26 -4.994 14.125 -11.949 1.00 0.00 C ATOM 419 O HIS A 26 -4.568 14.178 -13.102 1.00 0.00 O ATOM 420 CB HIS A 26 -3.128 14.635 -10.390 1.00 0.00 C ATOM 421 CG HIS A 26 -2.451 15.581 -9.448 1.00 0.00 C ATOM 422 ND1 HIS A 26 -1.392 16.386 -9.814 1.00 0.00 N ATOM 423 CD2 HIS A 26 -2.666 15.823 -8.135 1.00 0.00 C ATOM 424 CE1 HIS A 26 -0.985 17.075 -8.764 1.00 0.00 C ATOM 425 NE2 HIS A 26 -1.744 16.751 -7.736 1.00 0.00 N ATOM 0 H HIS A 26 -5.512 14.385 -9.206 1.00 0.00 H new ATOM 0 HA HIS A 26 -4.388 16.097 -11.333 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -3.251 13.673 -9.892 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -2.476 14.469 -11.248 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -3.425 15.368 -7.516 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -0.170 17.783 -8.750 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -1.657 17.132 -6.794 1.00 0.00 H new ATOM 434 N LYS A 27 -5.899 13.242 -11.527 1.00 0.00 N ATOM 435 CA LYS A 27 -6.415 12.160 -12.363 1.00 0.00 C ATOM 436 C LYS A 27 -5.320 11.148 -12.666 1.00 0.00 C ATOM 437 O LYS A 27 -4.573 11.276 -13.639 1.00 0.00 O ATOM 438 CB LYS A 27 -7.053 12.692 -13.652 1.00 0.00 C ATOM 439 CG LYS A 27 -8.357 13.438 -13.412 1.00 0.00 C ATOM 440 CD LYS A 27 -9.421 12.515 -12.834 1.00 0.00 C ATOM 441 CE LYS A 27 -10.696 13.270 -12.497 1.00 0.00 C ATOM 442 NZ LYS A 27 -11.787 12.359 -12.061 1.00 0.00 N ATOM 0 H LYS A 27 -6.297 13.258 -10.588 1.00 0.00 H new ATOM 0 HA LYS A 27 -7.202 11.654 -11.803 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -6.348 13.357 -14.151 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -7.238 11.858 -14.329 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -8.183 14.269 -12.729 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -8.713 13.865 -14.350 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -9.645 11.724 -13.550 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -9.035 12.032 -11.936 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -10.491 13.993 -11.707 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -11.023 13.835 -13.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -12.673 12.896 -11.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -11.910 11.603 -12.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -11.542 11.940 -11.141 1.00 0.00 H new ATOM 456 N ALA A 28 -5.221 10.153 -11.800 1.00 0.00 N ATOM 457 CA ALA A 28 -4.203 9.126 -11.915 1.00 0.00 C ATOM 458 C ALA A 28 -4.844 7.747 -12.001 1.00 0.00 C ATOM 459 O ALA A 28 -5.615 7.358 -11.121 1.00 0.00 O ATOM 460 CB ALA A 28 -3.249 9.197 -10.730 1.00 0.00 C ATOM 0 H ALA A 28 -5.843 10.036 -11.000 1.00 0.00 H new ATOM 0 HA ALA A 28 -3.636 9.298 -12.830 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -2.489 8.421 -10.827 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -2.768 10.175 -10.708 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -3.806 9.046 -9.805 1.00 0.00 H new ATOM 466 N PRO A 29 -4.549 7.000 -13.074 1.00 0.00 N ATOM 467 CA PRO A 29 -5.072 5.644 -13.270 1.00 0.00 C ATOM 468 C PRO A 29 -4.550 4.664 -12.218 1.00 0.00 C ATOM 469 O PRO A 29 -3.642 4.988 -11.446 1.00 0.00 O ATOM 470 CB PRO A 29 -4.569 5.257 -14.663 1.00 0.00 C ATOM 471 CG PRO A 29 -4.163 6.539 -15.308 1.00 0.00 C ATOM 472 CD PRO A 29 -3.697 7.424 -14.192 1.00 0.00 C ATOM 0 HA PRO A 29 -6.157 5.611 -13.176 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -3.729 4.566 -14.599 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -5.349 4.758 -15.238 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -3.369 6.376 -16.037 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -4.999 6.990 -15.843 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -2.639 7.279 -13.974 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.832 8.480 -14.428 1.00 0.00 H new ATOM 480 N THR A 30 -5.115 3.464 -12.209 1.00 0.00 N ATOM 481 CA THR A 30 -4.818 2.474 -11.183 1.00 0.00 C ATOM 482 C THR A 30 -3.337 2.092 -11.170 1.00 0.00 C ATOM 483 O THR A 30 -2.689 2.129 -10.122 1.00 0.00 O ATOM 484 CB THR A 30 -5.670 1.209 -11.400 1.00 0.00 C ATOM 485 OG1 THR A 30 -7.020 1.592 -11.697 1.00 0.00 O ATOM 486 CG2 THR A 30 -5.649 0.315 -10.168 1.00 0.00 C ATOM 0 H THR A 30 -5.788 3.151 -12.908 1.00 0.00 H new ATOM 0 HA THR A 30 -5.061 2.924 -10.220 1.00 0.00 H new ATOM 0 HB THR A 30 -5.250 0.647 -12.234 1.00 0.00 H new ATOM 0 HG1 THR A 30 -7.630 1.154 -11.068 1.00 0.00 H new ATOM 0 HG21 THR A 30 -6.259 -0.570 -10.350 1.00 0.00 H new ATOM 0 HG22 THR A 30 -4.624 0.012 -9.956 1.00 0.00 H new ATOM 0 HG23 THR A 30 -6.050 0.862 -9.315 1.00 0.00 H new ATOM 494 N ASP A 31 -2.805 1.747 -12.339 1.00 0.00 N ATOM 495 CA ASP A 31 -1.412 1.323 -12.462 1.00 0.00 C ATOM 496 C ASP A 31 -0.469 2.424 -11.989 1.00 0.00 C ATOM 497 O ASP A 31 0.466 2.175 -11.224 1.00 0.00 O ATOM 498 CB ASP A 31 -1.103 0.953 -13.914 1.00 0.00 C ATOM 499 CG ASP A 31 0.317 0.461 -14.111 1.00 0.00 C ATOM 500 OD1 ASP A 31 0.544 -0.765 -14.000 1.00 0.00 O ATOM 501 OD2 ASP A 31 1.202 1.287 -14.410 1.00 0.00 O ATOM 0 H ASP A 31 -3.320 1.753 -13.219 1.00 0.00 H new ATOM 0 HA ASP A 31 -1.261 0.447 -11.831 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -1.798 0.180 -14.242 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -1.271 1.823 -14.549 1.00 0.00 H new ATOM 506 N LEU A 32 -0.740 3.643 -12.436 1.00 0.00 N ATOM 507 CA LEU A 32 0.051 4.802 -12.044 1.00 0.00 C ATOM 508 C LEU A 32 0.008 5.010 -10.530 1.00 0.00 C ATOM 509 O LEU A 32 1.047 5.181 -9.891 1.00 0.00 O ATOM 510 CB LEU A 32 -0.460 6.056 -12.760 1.00 0.00 C ATOM 511 CG LEU A 32 0.254 7.358 -12.385 1.00 0.00 C ATOM 512 CD1 LEU A 32 1.732 7.279 -12.731 1.00 0.00 C ATOM 513 CD2 LEU A 32 -0.391 8.543 -13.084 1.00 0.00 C ATOM 0 H LEU A 32 -1.507 3.855 -13.074 1.00 0.00 H new ATOM 0 HA LEU A 32 1.086 4.620 -12.334 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.365 5.905 -13.835 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.523 6.169 -12.547 1.00 0.00 H new ATOM 0 HG LEU A 32 0.160 7.499 -11.308 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.220 8.214 -12.457 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.190 6.456 -12.183 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.847 7.111 -13.802 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.131 9.458 -12.805 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.330 8.406 -14.164 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.437 8.616 -12.786 1.00 0.00 H new ATOM 525 N SER A 33 -1.196 4.975 -9.967 1.00 0.00 N ATOM 526 CA SER A 33 -1.386 5.191 -8.537 1.00 0.00 C ATOM 527 C SER A 33 -0.631 4.152 -7.711 1.00 0.00 C ATOM 528 O SER A 33 0.050 4.497 -6.745 1.00 0.00 O ATOM 529 CB SER A 33 -2.877 5.162 -8.192 1.00 0.00 C ATOM 530 OG SER A 33 -3.577 6.163 -8.910 1.00 0.00 O ATOM 0 H SER A 33 -2.058 4.798 -10.482 1.00 0.00 H new ATOM 0 HA SER A 33 -0.981 6.172 -8.289 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.291 4.182 -8.428 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.011 5.315 -7.121 1.00 0.00 H new ATOM 0 HG SER A 33 -3.678 5.885 -9.844 1.00 0.00 H new ATOM 536 N LEU A 34 -0.730 2.889 -8.111 1.00 0.00 N ATOM 537 CA LEU A 34 -0.065 1.809 -7.391 1.00 0.00 C ATOM 538 C LEU A 34 1.449 1.987 -7.418 1.00 0.00 C ATOM 539 O LEU A 34 2.134 1.710 -6.431 1.00 0.00 O ATOM 540 CB LEU A 34 -0.447 0.447 -7.979 1.00 0.00 C ATOM 541 CG LEU A 34 -1.933 0.087 -7.878 1.00 0.00 C ATOM 542 CD1 LEU A 34 -2.194 -1.282 -8.486 1.00 0.00 C ATOM 543 CD2 LEU A 34 -2.393 0.123 -6.428 1.00 0.00 C ATOM 0 H LEU A 34 -1.263 2.588 -8.927 1.00 0.00 H new ATOM 0 HA LEU A 34 -0.398 1.846 -6.354 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -0.155 0.428 -9.029 1.00 0.00 H new ATOM 0 HB3 LEU A 34 0.133 -0.325 -7.473 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.504 0.826 -8.439 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.255 -1.520 -8.405 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.903 -1.275 -9.536 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.612 -2.034 -7.953 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.451 -0.135 -6.375 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -1.815 -0.594 -5.845 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.243 1.124 -6.024 1.00 0.00 H new ATOM 555 N MET A 35 1.966 2.466 -8.544 1.00 0.00 N ATOM 556 CA MET A 35 3.397 2.712 -8.681 1.00 0.00 C ATOM 557 C MET A 35 3.845 3.810 -7.717 1.00 0.00 C ATOM 558 O MET A 35 4.878 3.686 -7.055 1.00 0.00 O ATOM 559 CB MET A 35 3.739 3.110 -10.120 1.00 0.00 C ATOM 560 CG MET A 35 5.231 3.277 -10.368 1.00 0.00 C ATOM 561 SD MET A 35 5.610 3.828 -12.046 1.00 0.00 S ATOM 562 CE MET A 35 4.849 5.448 -12.055 1.00 0.00 C ATOM 0 H MET A 35 1.417 2.691 -9.374 1.00 0.00 H new ATOM 0 HA MET A 35 3.926 1.791 -8.437 1.00 0.00 H new ATOM 0 HB2 MET A 35 3.349 2.353 -10.800 1.00 0.00 H new ATOM 0 HB3 MET A 35 3.233 4.045 -10.360 1.00 0.00 H new ATOM 0 HG2 MET A 35 5.634 3.997 -9.655 1.00 0.00 H new ATOM 0 HG3 MET A 35 5.733 2.328 -10.181 1.00 0.00 H new ATOM 0 HE1 MET A 35 4.027 5.460 -12.771 1.00 0.00 H new ATOM 0 HE2 MET A 35 4.467 5.676 -11.060 1.00 0.00 H new ATOM 0 HE3 MET A 35 5.589 6.196 -12.340 1.00 0.00 H new ATOM 572 N VAL A 36 3.052 4.874 -7.634 1.00 0.00 N ATOM 573 CA VAL A 36 3.354 5.989 -6.747 1.00 0.00 C ATOM 574 C VAL A 36 3.278 5.549 -5.288 1.00 0.00 C ATOM 575 O VAL A 36 4.177 5.839 -4.497 1.00 0.00 O ATOM 576 CB VAL A 36 2.396 7.182 -6.978 1.00 0.00 C ATOM 577 CG1 VAL A 36 2.726 8.333 -6.036 1.00 0.00 C ATOM 578 CG2 VAL A 36 2.461 7.647 -8.425 1.00 0.00 C ATOM 0 H VAL A 36 2.193 4.986 -8.173 1.00 0.00 H new ATOM 0 HA VAL A 36 4.368 6.316 -6.976 1.00 0.00 H new ATOM 0 HB VAL A 36 1.381 6.847 -6.766 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.039 9.160 -6.217 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.626 7.998 -5.004 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.749 8.666 -6.212 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.781 8.486 -8.568 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.478 7.960 -8.661 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.171 6.828 -9.084 1.00 0.00 H new ATOM 588 N LEU A 37 2.213 4.832 -4.944 1.00 0.00 N ATOM 589 CA LEU A 37 2.019 4.348 -3.579 1.00 0.00 C ATOM 590 C LEU A 37 3.160 3.427 -3.155 1.00 0.00 C ATOM 591 O LEU A 37 3.656 3.523 -2.035 1.00 0.00 O ATOM 592 CB LEU A 37 0.680 3.615 -3.454 1.00 0.00 C ATOM 593 CG LEU A 37 -0.562 4.479 -3.690 1.00 0.00 C ATOM 594 CD1 LEU A 37 -1.824 3.639 -3.569 1.00 0.00 C ATOM 595 CD2 LEU A 37 -0.602 5.642 -2.708 1.00 0.00 C ATOM 0 H LEU A 37 1.469 4.572 -5.592 1.00 0.00 H new ATOM 0 HA LEU A 37 2.012 5.213 -2.916 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.669 2.789 -4.165 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.615 3.178 -2.457 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.510 4.885 -4.700 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.698 4.268 -3.739 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.802 2.840 -4.310 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.878 3.206 -2.570 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.492 6.244 -2.893 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.629 5.257 -1.689 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.287 6.259 -2.839 1.00 0.00 H new ATOM 607 N GLY A 38 3.574 2.541 -4.055 1.00 0.00 N ATOM 608 CA GLY A 38 4.674 1.638 -3.762 1.00 0.00 C ATOM 609 C GLY A 38 5.960 2.382 -3.451 1.00 0.00 C ATOM 610 O GLY A 38 6.667 2.053 -2.497 1.00 0.00 O ATOM 0 H GLY A 38 3.167 2.431 -4.984 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.408 1.007 -2.914 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.836 0.977 -4.613 1.00 0.00 H new ATOM 614 N ASN A 39 6.255 3.392 -4.261 1.00 0.00 N ATOM 615 CA ASN A 39 7.438 4.230 -4.064 1.00 0.00 C ATOM 616 C ASN A 39 7.315 5.018 -2.758 1.00 0.00 C ATOM 617 O ASN A 39 8.288 5.198 -2.022 1.00 0.00 O ATOM 618 CB ASN A 39 7.591 5.186 -5.255 1.00 0.00 C ATOM 619 CG ASN A 39 8.841 6.048 -5.189 1.00 0.00 C ATOM 620 OD1 ASN A 39 9.869 5.650 -4.640 1.00 0.00 O ATOM 621 ND2 ASN A 39 8.759 7.241 -5.759 1.00 0.00 N ATOM 0 H ASN A 39 5.688 3.654 -5.067 1.00 0.00 H new ATOM 0 HA ASN A 39 8.323 3.597 -4.000 1.00 0.00 H new ATOM 0 HB2 ASN A 39 7.610 4.604 -6.177 1.00 0.00 H new ATOM 0 HB3 ASN A 39 6.716 5.834 -5.305 1.00 0.00 H new ATOM 0 HD21 ASN A 39 9.565 7.866 -5.753 1.00 0.00 H new ATOM 0 HD22 ASN A 39 7.890 7.535 -6.204 1.00 0.00 H new ATOM 628 N MET A 40 6.099 5.464 -2.475 1.00 0.00 N ATOM 629 CA MET A 40 5.806 6.216 -1.263 1.00 0.00 C ATOM 630 C MET A 40 6.041 5.366 -0.015 1.00 0.00 C ATOM 631 O MET A 40 6.784 5.763 0.881 1.00 0.00 O ATOM 632 CB MET A 40 4.356 6.706 -1.301 1.00 0.00 C ATOM 633 CG MET A 40 3.914 7.441 -0.048 1.00 0.00 C ATOM 634 SD MET A 40 2.194 7.970 -0.136 1.00 0.00 S ATOM 635 CE MET A 40 1.982 8.693 1.484 1.00 0.00 C ATOM 0 H MET A 40 5.290 5.315 -3.078 1.00 0.00 H new ATOM 0 HA MET A 40 6.479 7.072 -1.217 1.00 0.00 H new ATOM 0 HB2 MET A 40 4.230 7.366 -2.159 1.00 0.00 H new ATOM 0 HB3 MET A 40 3.699 5.850 -1.457 1.00 0.00 H new ATOM 0 HG2 MET A 40 4.048 6.792 0.818 1.00 0.00 H new ATOM 0 HG3 MET A 40 4.552 8.311 0.104 1.00 0.00 H new ATOM 0 HE1 MET A 40 0.963 9.068 1.585 1.00 0.00 H new ATOM 0 HE2 MET A 40 2.167 7.937 2.247 1.00 0.00 H new ATOM 0 HE3 MET A 40 2.686 9.516 1.610 1.00 0.00 H new ATOM 645 N VAL A 41 5.411 4.194 0.028 1.00 0.00 N ATOM 646 CA VAL A 41 5.492 3.312 1.190 1.00 0.00 C ATOM 647 C VAL A 41 6.929 2.876 1.473 1.00 0.00 C ATOM 648 O VAL A 41 7.383 2.925 2.617 1.00 0.00 O ATOM 649 CB VAL A 41 4.602 2.058 1.012 1.00 0.00 C ATOM 650 CG1 VAL A 41 4.755 1.108 2.192 1.00 0.00 C ATOM 651 CG2 VAL A 41 3.144 2.456 0.841 1.00 0.00 C ATOM 0 H VAL A 41 4.836 3.832 -0.733 1.00 0.00 H new ATOM 0 HA VAL A 41 5.128 3.889 2.040 1.00 0.00 H new ATOM 0 HB VAL A 41 4.930 1.539 0.111 1.00 0.00 H new ATOM 0 HG11 VAL A 41 4.119 0.236 2.042 1.00 0.00 H new ATOM 0 HG12 VAL A 41 5.795 0.790 2.271 1.00 0.00 H new ATOM 0 HG13 VAL A 41 4.461 1.617 3.110 1.00 0.00 H new ATOM 0 HG21 VAL A 41 2.535 1.561 0.717 1.00 0.00 H new ATOM 0 HG22 VAL A 41 2.810 3.003 1.723 1.00 0.00 H new ATOM 0 HG23 VAL A 41 3.041 3.090 -0.040 1.00 0.00 H new ATOM 661 N THR A 42 7.645 2.476 0.428 1.00 0.00 N ATOM 662 CA THR A 42 9.006 1.976 0.583 1.00 0.00 C ATOM 663 C THR A 42 9.925 3.022 1.210 1.00 0.00 C ATOM 664 O THR A 42 10.679 2.722 2.139 1.00 0.00 O ATOM 665 CB THR A 42 9.586 1.516 -0.766 1.00 0.00 C ATOM 666 OG1 THR A 42 9.269 2.471 -1.785 1.00 0.00 O ATOM 667 CG2 THR A 42 9.038 0.153 -1.149 1.00 0.00 C ATOM 0 H THR A 42 7.306 2.488 -0.534 1.00 0.00 H new ATOM 0 HA THR A 42 8.953 1.120 1.255 1.00 0.00 H new ATOM 0 HB THR A 42 10.669 1.439 -0.668 1.00 0.00 H new ATOM 0 HG1 THR A 42 8.385 2.270 -2.158 1.00 0.00 H new ATOM 0 HG21 THR A 42 9.461 -0.153 -2.106 1.00 0.00 H new ATOM 0 HG22 THR A 42 9.307 -0.575 -0.384 1.00 0.00 H new ATOM 0 HG23 THR A 42 7.953 0.208 -1.233 1.00 0.00 H new ATOM 675 N ASN A 43 9.853 4.251 0.712 1.00 0.00 N ATOM 676 CA ASN A 43 10.657 5.335 1.264 1.00 0.00 C ATOM 677 C ASN A 43 10.154 5.742 2.643 1.00 0.00 C ATOM 678 O ASN A 43 10.943 6.113 3.511 1.00 0.00 O ATOM 679 CB ASN A 43 10.667 6.546 0.330 1.00 0.00 C ATOM 680 CG ASN A 43 11.554 6.332 -0.883 1.00 0.00 C ATOM 681 OD1 ASN A 43 12.752 6.609 -0.843 1.00 0.00 O ATOM 682 ND2 ASN A 43 10.980 5.845 -1.970 1.00 0.00 N ATOM 0 H ASN A 43 9.252 4.521 -0.066 1.00 0.00 H new ATOM 0 HA ASN A 43 11.678 4.967 1.362 1.00 0.00 H new ATOM 0 HB2 ASN A 43 9.649 6.756 0.000 1.00 0.00 H new ATOM 0 HB3 ASN A 43 11.012 7.422 0.879 1.00 0.00 H new ATOM 0 HD21 ASN A 43 11.534 5.687 -2.812 1.00 0.00 H new ATOM 0 HD22 ASN A 43 9.984 5.627 -1.966 1.00 0.00 H new ATOM 689 N LEU A 44 8.842 5.658 2.842 1.00 0.00 N ATOM 690 CA LEU A 44 8.229 5.993 4.125 1.00 0.00 C ATOM 691 C LEU A 44 8.795 5.119 5.242 1.00 0.00 C ATOM 692 O LEU A 44 9.118 5.608 6.326 1.00 0.00 O ATOM 693 CB LEU A 44 6.708 5.816 4.048 1.00 0.00 C ATOM 694 CG LEU A 44 5.941 6.153 5.330 1.00 0.00 C ATOM 695 CD1 LEU A 44 6.065 7.632 5.658 1.00 0.00 C ATOM 696 CD2 LEU A 44 4.479 5.756 5.193 1.00 0.00 C ATOM 0 H LEU A 44 8.179 5.359 2.127 1.00 0.00 H new ATOM 0 HA LEU A 44 8.458 7.035 4.349 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.327 6.443 3.242 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.493 4.782 3.777 1.00 0.00 H new ATOM 0 HG LEU A 44 6.378 5.585 6.151 1.00 0.00 H new ATOM 0 HD11 LEU A 44 5.513 7.849 6.572 1.00 0.00 H new ATOM 0 HD12 LEU A 44 7.115 7.887 5.799 1.00 0.00 H new ATOM 0 HD13 LEU A 44 5.656 8.222 4.838 1.00 0.00 H new ATOM 0 HD21 LEU A 44 3.948 6.002 6.112 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.032 6.297 4.359 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.409 4.684 5.009 1.00 0.00 H new ATOM 708 N ILE A 45 8.920 3.826 4.969 1.00 0.00 N ATOM 709 CA ILE A 45 9.446 2.888 5.952 1.00 0.00 C ATOM 710 C ILE A 45 10.919 3.170 6.242 1.00 0.00 C ATOM 711 O ILE A 45 11.324 3.248 7.397 1.00 0.00 O ATOM 712 CB ILE A 45 9.283 1.423 5.486 1.00 0.00 C ATOM 713 CG1 ILE A 45 7.809 1.113 5.205 1.00 0.00 C ATOM 714 CG2 ILE A 45 9.833 0.468 6.536 1.00 0.00 C ATOM 715 CD1 ILE A 45 7.567 -0.290 4.687 1.00 0.00 C ATOM 0 H ILE A 45 8.665 3.404 4.076 1.00 0.00 H new ATOM 0 HA ILE A 45 8.868 3.027 6.865 1.00 0.00 H new ATOM 0 HB ILE A 45 9.848 1.288 4.564 1.00 0.00 H new ATOM 0 HG12 ILE A 45 7.236 1.256 6.121 1.00 0.00 H new ATOM 0 HG13 ILE A 45 7.429 1.830 4.477 1.00 0.00 H new ATOM 0 HG21 ILE A 45 9.711 -0.559 6.193 1.00 0.00 H new ATOM 0 HG22 ILE A 45 10.891 0.674 6.696 1.00 0.00 H new ATOM 0 HG23 ILE A 45 9.291 0.605 7.472 1.00 0.00 H new ATOM 0 HD11 ILE A 45 6.501 -0.434 4.512 1.00 0.00 H new ATOM 0 HD12 ILE A 45 8.111 -0.432 3.753 1.00 0.00 H new ATOM 0 HD13 ILE A 45 7.915 -1.015 5.423 1.00 0.00 H new ATOM 727 N ASN A 46 11.704 3.359 5.185 1.00 0.00 N ATOM 728 CA ASN A 46 13.151 3.565 5.314 1.00 0.00 C ATOM 729 C ASN A 46 13.493 4.855 6.061 1.00 0.00 C ATOM 730 O ASN A 46 14.559 4.964 6.669 1.00 0.00 O ATOM 731 CB ASN A 46 13.813 3.589 3.931 1.00 0.00 C ATOM 732 CG ASN A 46 13.945 2.208 3.311 1.00 0.00 C ATOM 733 OD1 ASN A 46 14.134 1.212 4.009 1.00 0.00 O ATOM 734 ND2 ASN A 46 13.856 2.139 1.990 1.00 0.00 N ATOM 0 H ASN A 46 11.364 3.374 4.223 1.00 0.00 H new ATOM 0 HA ASN A 46 13.536 2.729 5.897 1.00 0.00 H new ATOM 0 HB2 ASN A 46 13.229 4.225 3.266 1.00 0.00 H new ATOM 0 HB3 ASN A 46 14.802 4.039 4.016 1.00 0.00 H new ATOM 0 HD21 ASN A 46 13.945 1.239 1.519 1.00 0.00 H new ATOM 0 HD22 ASN A 46 13.699 2.986 1.444 1.00 0.00 H new ATOM 741 N THR A 47 12.602 5.835 6.008 1.00 0.00 N ATOM 742 CA THR A 47 12.851 7.115 6.655 1.00 0.00 C ATOM 743 C THR A 47 12.352 7.123 8.097 1.00 0.00 C ATOM 744 O THR A 47 12.927 7.785 8.962 1.00 0.00 O ATOM 745 CB THR A 47 12.197 8.270 5.873 1.00 0.00 C ATOM 746 OG1 THR A 47 10.862 7.911 5.491 1.00 0.00 O ATOM 747 CG2 THR A 47 13.012 8.611 4.633 1.00 0.00 C ATOM 0 H THR A 47 11.705 5.769 5.527 1.00 0.00 H new ATOM 0 HA THR A 47 13.931 7.261 6.663 1.00 0.00 H new ATOM 0 HB THR A 47 12.164 9.146 6.520 1.00 0.00 H new ATOM 0 HG1 THR A 47 10.886 7.408 4.650 1.00 0.00 H new ATOM 0 HG21 THR A 47 12.532 9.429 4.096 1.00 0.00 H new ATOM 0 HG22 THR A 47 14.017 8.912 4.929 1.00 0.00 H new ATOM 0 HG23 THR A 47 13.071 7.737 3.985 1.00 0.00 H new ATOM 755 N SER A 48 11.292 6.373 8.357 1.00 0.00 N ATOM 756 CA SER A 48 10.707 6.327 9.689 1.00 0.00 C ATOM 757 C SER A 48 11.380 5.252 10.540 1.00 0.00 C ATOM 758 O SER A 48 11.615 5.440 11.736 1.00 0.00 O ATOM 759 CB SER A 48 9.208 6.058 9.584 1.00 0.00 C ATOM 760 OG SER A 48 8.589 6.957 8.677 1.00 0.00 O ATOM 0 H SER A 48 10.820 5.790 7.666 1.00 0.00 H new ATOM 0 HA SER A 48 10.865 7.290 10.174 1.00 0.00 H new ATOM 0 HB2 SER A 48 9.042 5.032 9.254 1.00 0.00 H new ATOM 0 HB3 SER A 48 8.748 6.155 10.568 1.00 0.00 H new ATOM 0 HG SER A 48 8.688 6.619 7.762 1.00 0.00 H new ATOM 766 N ILE A 49 11.693 4.129 9.912 1.00 0.00 N ATOM 767 CA ILE A 49 12.325 3.012 10.591 1.00 0.00 C ATOM 768 C ILE A 49 13.725 2.793 10.027 1.00 0.00 C ATOM 769 O ILE A 49 13.910 2.759 8.810 1.00 0.00 O ATOM 770 CB ILE A 49 11.492 1.704 10.457 1.00 0.00 C ATOM 771 CG1 ILE A 49 10.184 1.796 11.256 1.00 0.00 C ATOM 772 CG2 ILE A 49 12.291 0.490 10.910 1.00 0.00 C ATOM 773 CD1 ILE A 49 9.083 2.572 10.563 1.00 0.00 C ATOM 0 H ILE A 49 11.516 3.968 8.920 1.00 0.00 H new ATOM 0 HA ILE A 49 12.385 3.258 11.651 1.00 0.00 H new ATOM 0 HB ILE A 49 11.249 1.584 9.401 1.00 0.00 H new ATOM 0 HG12 ILE A 49 9.827 0.787 11.463 1.00 0.00 H new ATOM 0 HG13 ILE A 49 10.392 2.264 12.218 1.00 0.00 H new ATOM 0 HG21 ILE A 49 11.681 -0.407 10.804 1.00 0.00 H new ATOM 0 HG22 ILE A 49 13.187 0.394 10.296 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.578 0.612 11.954 1.00 0.00 H new ATOM 0 HD11 ILE A 49 8.196 2.588 11.196 1.00 0.00 H new ATOM 0 HD12 ILE A 49 9.417 3.593 10.381 1.00 0.00 H new ATOM 0 HD13 ILE A 49 8.843 2.094 9.613 1.00 0.00 H new ATOM 785 N ALA A 50 14.704 2.669 10.916 1.00 0.00 N ATOM 786 CA ALA A 50 16.084 2.420 10.515 1.00 0.00 C ATOM 787 C ALA A 50 16.180 1.145 9.677 1.00 0.00 C ATOM 788 O ALA A 50 15.373 0.230 9.841 1.00 0.00 O ATOM 789 CB ALA A 50 16.975 2.311 11.745 1.00 0.00 C ATOM 0 H ALA A 50 14.566 2.737 11.924 1.00 0.00 H new ATOM 0 HA ALA A 50 16.424 3.258 9.906 1.00 0.00 H new ATOM 0 HB1 ALA A 50 18.003 2.125 11.434 1.00 0.00 H new ATOM 0 HB2 ALA A 50 16.930 3.242 12.311 1.00 0.00 H new ATOM 0 HB3 ALA A 50 16.631 1.488 12.372 1.00 0.00 H new ATOM 795 N PRO A 51 17.152 1.080 8.754 1.00 0.00 N ATOM 796 CA PRO A 51 17.355 -0.088 7.890 1.00 0.00 C ATOM 797 C PRO A 51 17.670 -1.365 8.671 1.00 0.00 C ATOM 798 O PRO A 51 18.834 -1.717 8.875 1.00 0.00 O ATOM 799 CB PRO A 51 18.542 0.312 7.007 1.00 0.00 C ATOM 800 CG PRO A 51 18.590 1.799 7.078 1.00 0.00 C ATOM 801 CD PRO A 51 18.112 2.153 8.455 1.00 0.00 C ATOM 0 HA PRO A 51 16.452 -0.327 7.329 1.00 0.00 H new ATOM 0 HB2 PRO A 51 19.470 -0.131 7.369 1.00 0.00 H new ATOM 0 HB3 PRO A 51 18.404 -0.030 5.981 1.00 0.00 H new ATOM 0 HG2 PRO A 51 19.602 2.167 6.908 1.00 0.00 H new ATOM 0 HG3 PRO A 51 17.955 2.249 6.315 1.00 0.00 H new ATOM 0 HD2 PRO A 51 18.931 2.175 9.174 1.00 0.00 H new ATOM 0 HD3 PRO A 51 17.641 3.135 8.479 1.00 0.00 H new ATOM 809 N ALA A 52 16.619 -2.023 9.143 1.00 0.00 N ATOM 810 CA ALA A 52 16.739 -3.306 9.819 1.00 0.00 C ATOM 811 C ALA A 52 15.388 -4.016 9.844 1.00 0.00 C ATOM 812 O ALA A 52 15.172 -4.989 9.119 1.00 0.00 O ATOM 813 CB ALA A 52 17.278 -3.124 11.232 1.00 0.00 C ATOM 0 H ALA A 52 15.661 -1.682 9.068 1.00 0.00 H new ATOM 0 HA ALA A 52 17.447 -3.924 9.266 1.00 0.00 H new ATOM 0 HB1 ALA A 52 17.359 -4.096 11.718 1.00 0.00 H new ATOM 0 HB2 ALA A 52 18.262 -2.656 11.189 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.599 -2.489 11.801 1.00 0.00 H new ATOM 819 N GLN A 53 14.463 -3.489 10.644 1.00 0.00 N ATOM 820 CA GLN A 53 13.129 -4.080 10.785 1.00 0.00 C ATOM 821 C GLN A 53 12.249 -3.751 9.585 1.00 0.00 C ATOM 822 O GLN A 53 11.137 -4.262 9.465 1.00 0.00 O ATOM 823 CB GLN A 53 12.443 -3.567 12.051 1.00 0.00 C ATOM 824 CG GLN A 53 13.209 -3.840 13.331 1.00 0.00 C ATOM 825 CD GLN A 53 12.463 -3.337 14.550 1.00 0.00 C ATOM 826 OE1 GLN A 53 11.675 -4.064 15.153 1.00 0.00 O ATOM 827 NE2 GLN A 53 12.699 -2.088 14.919 1.00 0.00 N ATOM 0 H GLN A 53 14.611 -2.651 11.207 1.00 0.00 H new ATOM 0 HA GLN A 53 13.260 -5.160 10.848 1.00 0.00 H new ATOM 0 HB2 GLN A 53 12.289 -2.492 11.956 1.00 0.00 H new ATOM 0 HB3 GLN A 53 11.457 -4.025 12.127 1.00 0.00 H new ATOM 0 HG2 GLN A 53 13.384 -4.911 13.428 1.00 0.00 H new ATOM 0 HG3 GLN A 53 14.186 -3.360 13.279 1.00 0.00 H new ATOM 0 HE21 GLN A 53 13.360 -1.517 14.392 1.00 0.00 H new ATOM 0 HE22 GLN A 53 12.220 -1.697 15.730 1.00 0.00 H new ATOM 836 N ARG A 54 12.759 -2.902 8.705 1.00 0.00 N ATOM 837 CA ARG A 54 12.003 -2.408 7.556 1.00 0.00 C ATOM 838 C ARG A 54 11.393 -3.538 6.719 1.00 0.00 C ATOM 839 O ARG A 54 10.216 -3.485 6.372 1.00 0.00 O ATOM 840 CB ARG A 54 12.902 -1.532 6.686 1.00 0.00 C ATOM 841 CG ARG A 54 14.203 -2.203 6.287 1.00 0.00 C ATOM 842 CD ARG A 54 15.044 -1.293 5.420 1.00 0.00 C ATOM 843 NE ARG A 54 16.319 -1.901 5.052 1.00 0.00 N ATOM 844 CZ ARG A 54 17.192 -1.325 4.228 1.00 0.00 C ATOM 845 NH1 ARG A 54 16.906 -0.150 3.683 1.00 0.00 N ATOM 846 NH2 ARG A 54 18.352 -1.911 3.955 1.00 0.00 N ATOM 0 H ARG A 54 13.708 -2.534 8.764 1.00 0.00 H new ATOM 0 HA ARG A 54 11.172 -1.819 7.943 1.00 0.00 H new ATOM 0 HB2 ARG A 54 12.358 -1.250 5.785 1.00 0.00 H new ATOM 0 HB3 ARG A 54 13.128 -0.611 7.224 1.00 0.00 H new ATOM 0 HG2 ARG A 54 14.763 -2.477 7.181 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.989 -3.127 5.749 1.00 0.00 H new ATOM 0 HD2 ARG A 54 14.489 -1.042 4.516 1.00 0.00 H new ATOM 0 HD3 ARG A 54 15.229 -0.359 5.950 1.00 0.00 H new ATOM 0 HE ARG A 54 16.553 -2.812 5.446 1.00 0.00 H new ATOM 0 HH11 ARG A 54 16.020 0.309 3.896 1.00 0.00 H new ATOM 0 HH12 ARG A 54 17.572 0.295 3.051 1.00 0.00 H new ATOM 0 HH21 ARG A 54 18.581 -2.811 4.378 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.014 -1.462 3.322 1.00 0.00 H new ATOM 860 N GLN A 55 12.182 -4.564 6.414 1.00 0.00 N ATOM 861 CA GLN A 55 11.707 -5.662 5.574 1.00 0.00 C ATOM 862 C GLN A 55 10.669 -6.499 6.320 1.00 0.00 C ATOM 863 O GLN A 55 9.709 -6.992 5.727 1.00 0.00 O ATOM 864 CB GLN A 55 12.880 -6.535 5.119 1.00 0.00 C ATOM 865 CG GLN A 55 12.491 -7.642 4.146 1.00 0.00 C ATOM 866 CD GLN A 55 11.868 -7.109 2.865 1.00 0.00 C ATOM 867 OE1 GLN A 55 10.653 -6.946 2.773 1.00 0.00 O ATOM 868 NE2 GLN A 55 12.695 -6.835 1.868 1.00 0.00 N ATOM 0 H GLN A 55 13.146 -4.659 6.732 1.00 0.00 H new ATOM 0 HA GLN A 55 11.232 -5.238 4.689 1.00 0.00 H new ATOM 0 HB2 GLN A 55 13.631 -5.900 4.649 1.00 0.00 H new ATOM 0 HB3 GLN A 55 13.346 -6.984 5.996 1.00 0.00 H new ATOM 0 HG2 GLN A 55 13.376 -8.229 3.898 1.00 0.00 H new ATOM 0 HG3 GLN A 55 11.787 -8.317 4.633 1.00 0.00 H new ATOM 0 HE21 GLN A 55 13.698 -6.983 1.982 1.00 0.00 H new ATOM 0 HE22 GLN A 55 12.329 -6.476 0.986 1.00 0.00 H new ATOM 877 N ALA A 56 10.859 -6.641 7.626 1.00 0.00 N ATOM 878 CA ALA A 56 9.903 -7.358 8.457 1.00 0.00 C ATOM 879 C ALA A 56 8.567 -6.625 8.470 1.00 0.00 C ATOM 880 O ALA A 56 7.507 -7.241 8.360 1.00 0.00 O ATOM 881 CB ALA A 56 10.442 -7.523 9.872 1.00 0.00 C ATOM 0 H ALA A 56 11.664 -6.270 8.130 1.00 0.00 H new ATOM 0 HA ALA A 56 9.749 -8.352 8.036 1.00 0.00 H new ATOM 0 HB1 ALA A 56 9.714 -8.061 10.478 1.00 0.00 H new ATOM 0 HB2 ALA A 56 11.376 -8.085 9.843 1.00 0.00 H new ATOM 0 HB3 ALA A 56 10.623 -6.541 10.309 1.00 0.00 H new ATOM 887 N ILE A 57 8.630 -5.303 8.580 1.00 0.00 N ATOM 888 CA ILE A 57 7.435 -4.467 8.556 1.00 0.00 C ATOM 889 C ILE A 57 6.770 -4.522 7.184 1.00 0.00 C ATOM 890 O ILE A 57 5.544 -4.551 7.081 1.00 0.00 O ATOM 891 CB ILE A 57 7.767 -3.002 8.918 1.00 0.00 C ATOM 892 CG1 ILE A 57 8.346 -2.930 10.335 1.00 0.00 C ATOM 893 CG2 ILE A 57 6.527 -2.123 8.802 1.00 0.00 C ATOM 894 CD1 ILE A 57 8.766 -1.536 10.755 1.00 0.00 C ATOM 0 H ILE A 57 9.502 -4.784 8.687 1.00 0.00 H new ATOM 0 HA ILE A 57 6.745 -4.858 9.304 1.00 0.00 H new ATOM 0 HB ILE A 57 8.512 -2.630 8.214 1.00 0.00 H new ATOM 0 HG12 ILE A 57 7.603 -3.303 11.040 1.00 0.00 H new ATOM 0 HG13 ILE A 57 9.208 -3.594 10.399 1.00 0.00 H new ATOM 0 HG21 ILE A 57 6.784 -1.096 9.061 1.00 0.00 H new ATOM 0 HG22 ILE A 57 6.152 -2.156 7.779 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.758 -2.488 9.483 1.00 0.00 H new ATOM 0 HD11 ILE A 57 9.165 -1.566 11.769 1.00 0.00 H new ATOM 0 HD12 ILE A 57 9.532 -1.166 10.074 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.903 -0.871 10.725 1.00 0.00 H new ATOM 906 N ALA A 58 7.582 -4.552 6.135 1.00 0.00 N ATOM 907 CA ALA A 58 7.074 -4.664 4.773 1.00 0.00 C ATOM 908 C ALA A 58 6.273 -5.947 4.603 1.00 0.00 C ATOM 909 O ALA A 58 5.147 -5.928 4.100 1.00 0.00 O ATOM 910 CB ALA A 58 8.217 -4.618 3.775 1.00 0.00 C ATOM 0 H ALA A 58 8.599 -4.500 6.201 1.00 0.00 H new ATOM 0 HA ALA A 58 6.413 -3.818 4.583 1.00 0.00 H new ATOM 0 HB1 ALA A 58 7.820 -4.703 2.763 1.00 0.00 H new ATOM 0 HB2 ALA A 58 8.751 -3.674 3.877 1.00 0.00 H new ATOM 0 HB3 ALA A 58 8.901 -5.445 3.967 1.00 0.00 H new ATOM 916 N ASN A 59 6.851 -7.059 5.041 1.00 0.00 N ATOM 917 CA ASN A 59 6.161 -8.341 5.000 1.00 0.00 C ATOM 918 C ASN A 59 4.918 -8.313 5.880 1.00 0.00 C ATOM 919 O ASN A 59 3.905 -8.927 5.554 1.00 0.00 O ATOM 920 CB ASN A 59 7.086 -9.479 5.438 1.00 0.00 C ATOM 921 CG ASN A 59 8.099 -9.855 4.373 1.00 0.00 C ATOM 922 OD1 ASN A 59 7.847 -9.715 3.177 1.00 0.00 O ATOM 923 ND2 ASN A 59 9.250 -10.350 4.799 1.00 0.00 N ATOM 0 H ASN A 59 7.794 -7.098 5.428 1.00 0.00 H new ATOM 0 HA ASN A 59 5.858 -8.520 3.968 1.00 0.00 H new ATOM 0 HB2 ASN A 59 7.612 -9.185 6.346 1.00 0.00 H new ATOM 0 HB3 ASN A 59 6.486 -10.354 5.687 1.00 0.00 H new ATOM 0 HD21 ASN A 59 9.964 -10.630 4.127 1.00 0.00 H new ATOM 0 HD22 ASN A 59 9.423 -10.451 5.799 1.00 0.00 H new ATOM 930 N SER A 60 4.995 -7.584 6.989 1.00 0.00 N ATOM 931 CA SER A 60 3.857 -7.429 7.885 1.00 0.00 C ATOM 932 C SER A 60 2.733 -6.655 7.197 1.00 0.00 C ATOM 933 O SER A 60 1.564 -7.021 7.301 1.00 0.00 O ATOM 934 CB SER A 60 4.278 -6.712 9.169 1.00 0.00 C ATOM 935 OG SER A 60 5.308 -7.419 9.840 1.00 0.00 O ATOM 0 H SER A 60 5.836 -7.091 7.288 1.00 0.00 H new ATOM 0 HA SER A 60 3.490 -8.422 8.143 1.00 0.00 H new ATOM 0 HB2 SER A 60 4.621 -5.705 8.930 1.00 0.00 H new ATOM 0 HB3 SER A 60 3.417 -6.607 9.829 1.00 0.00 H new ATOM 0 HG SER A 60 6.065 -7.551 9.231 1.00 0.00 H new ATOM 941 N PHE A 61 3.098 -5.592 6.485 1.00 0.00 N ATOM 942 CA PHE A 61 2.126 -4.781 5.764 1.00 0.00 C ATOM 943 C PHE A 61 1.476 -5.601 4.657 1.00 0.00 C ATOM 944 O PHE A 61 0.257 -5.590 4.498 1.00 0.00 O ATOM 945 CB PHE A 61 2.794 -3.530 5.176 1.00 0.00 C ATOM 946 CG PHE A 61 1.837 -2.600 4.481 1.00 0.00 C ATOM 947 CD1 PHE A 61 1.022 -1.751 5.213 1.00 0.00 C ATOM 948 CD2 PHE A 61 1.751 -2.575 3.096 1.00 0.00 C ATOM 949 CE1 PHE A 61 0.138 -0.897 4.580 1.00 0.00 C ATOM 950 CE2 PHE A 61 0.868 -1.722 2.457 1.00 0.00 C ATOM 951 CZ PHE A 61 0.061 -0.881 3.201 1.00 0.00 C ATOM 0 H PHE A 61 4.063 -5.273 6.393 1.00 0.00 H new ATOM 0 HA PHE A 61 1.355 -4.461 6.465 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.296 -2.987 5.977 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.564 -3.839 4.469 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.078 -1.757 6.292 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.380 -3.229 2.510 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -0.492 -0.242 5.164 1.00 0.00 H new ATOM 0 HE2 PHE A 61 0.809 -1.713 1.379 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.628 -0.213 2.705 1.00 0.00 H new ATOM 961 N ALA A 62 2.298 -6.326 3.905 1.00 0.00 N ATOM 962 CA ALA A 62 1.801 -7.196 2.847 1.00 0.00 C ATOM 963 C ALA A 62 0.904 -8.285 3.425 1.00 0.00 C ATOM 964 O ALA A 62 -0.141 -8.615 2.858 1.00 0.00 O ATOM 965 CB ALA A 62 2.960 -7.812 2.081 1.00 0.00 C ATOM 0 H ALA A 62 3.313 -6.328 4.010 1.00 0.00 H new ATOM 0 HA ALA A 62 1.209 -6.596 2.156 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.573 -8.459 1.294 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.563 -7.021 1.636 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.576 -8.398 2.763 1.00 0.00 H new ATOM 971 N ARG A 63 1.321 -8.836 4.560 1.00 0.00 N ATOM 972 CA ARG A 63 0.541 -9.848 5.259 1.00 0.00 C ATOM 973 C ARG A 63 -0.802 -9.270 5.685 1.00 0.00 C ATOM 974 O ARG A 63 -1.852 -9.850 5.409 1.00 0.00 O ATOM 975 CB ARG A 63 1.299 -10.352 6.490 1.00 0.00 C ATOM 976 CG ARG A 63 0.683 -11.587 7.124 1.00 0.00 C ATOM 977 CD ARG A 63 0.840 -12.802 6.225 1.00 0.00 C ATOM 978 NE ARG A 63 0.177 -13.983 6.772 1.00 0.00 N ATOM 979 CZ ARG A 63 0.768 -15.168 6.920 1.00 0.00 C ATOM 980 NH1 ARG A 63 2.056 -15.320 6.627 1.00 0.00 N ATOM 981 NH2 ARG A 63 0.069 -16.201 7.369 1.00 0.00 N ATOM 0 H ARG A 63 2.201 -8.596 5.017 1.00 0.00 H new ATOM 0 HA ARG A 63 0.374 -10.685 4.581 1.00 0.00 H new ATOM 0 HB2 ARG A 63 2.327 -10.575 6.206 1.00 0.00 H new ATOM 0 HB3 ARG A 63 1.339 -9.555 7.232 1.00 0.00 H new ATOM 0 HG2 ARG A 63 1.157 -11.780 8.087 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -0.375 -11.410 7.319 1.00 0.00 H new ATOM 0 HD2 ARG A 63 0.428 -12.579 5.241 1.00 0.00 H new ATOM 0 HD3 ARG A 63 1.900 -13.014 6.086 1.00 0.00 H new ATOM 0 HE ARG A 63 -0.798 -13.895 7.058 1.00 0.00 H new ATOM 0 HH11 ARG A 63 2.599 -14.526 6.286 1.00 0.00 H new ATOM 0 HH12 ARG A 63 2.501 -16.230 6.743 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -0.918 -16.087 7.600 1.00 0.00 H new ATOM 0 HH22 ARG A 63 0.518 -17.110 7.484 1.00 0.00 H new ATOM 995 N ALA A 64 -0.756 -8.118 6.346 1.00 0.00 N ATOM 996 CA ALA A 64 -1.960 -7.444 6.816 1.00 0.00 C ATOM 997 C ALA A 64 -2.878 -7.092 5.654 1.00 0.00 C ATOM 998 O ALA A 64 -4.095 -7.223 5.757 1.00 0.00 O ATOM 999 CB ALA A 64 -1.594 -6.192 7.598 1.00 0.00 C ATOM 0 H ALA A 64 0.111 -7.629 6.570 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.495 -8.127 7.476 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -2.503 -5.699 7.943 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.982 -6.466 8.457 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.034 -5.512 6.955 1.00 0.00 H new ATOM 1005 N LEU A 65 -2.285 -6.653 4.549 1.00 0.00 N ATOM 1006 CA LEU A 65 -3.038 -6.322 3.346 1.00 0.00 C ATOM 1007 C LEU A 65 -3.866 -7.517 2.890 1.00 0.00 C ATOM 1008 O LEU A 65 -5.089 -7.436 2.787 1.00 0.00 O ATOM 1009 CB LEU A 65 -2.086 -5.885 2.227 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.761 -5.461 0.921 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -3.608 -4.216 1.134 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -1.721 -5.220 -0.162 1.00 0.00 C ATOM 0 H LEU A 65 -1.278 -6.518 4.462 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.713 -5.498 3.577 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.482 -5.054 2.591 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.402 -6.706 2.013 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.417 -6.269 0.596 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.079 -3.931 0.193 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.378 -4.422 1.878 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -2.975 -3.401 1.484 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.219 -4.919 -1.084 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.040 -4.431 0.157 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.158 -6.137 -0.336 1.00 0.00 H new ATOM 1024 N GLN A 66 -3.195 -8.641 2.666 1.00 0.00 N ATOM 1025 CA GLN A 66 -3.856 -9.854 2.193 1.00 0.00 C ATOM 1026 C GLN A 66 -4.808 -10.423 3.244 1.00 0.00 C ATOM 1027 O GLN A 66 -5.696 -11.211 2.926 1.00 0.00 O ATOM 1028 CB GLN A 66 -2.818 -10.906 1.802 1.00 0.00 C ATOM 1029 CG GLN A 66 -1.955 -10.498 0.620 1.00 0.00 C ATOM 1030 CD GLN A 66 -0.950 -11.565 0.235 1.00 0.00 C ATOM 1031 OE1 GLN A 66 -1.185 -12.759 0.430 1.00 0.00 O ATOM 1032 NE2 GLN A 66 0.180 -11.147 -0.315 1.00 0.00 N ATOM 0 H GLN A 66 -2.189 -8.739 2.805 1.00 0.00 H new ATOM 0 HA GLN A 66 -4.446 -9.587 1.316 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -2.175 -11.106 2.659 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -3.330 -11.838 1.563 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -2.595 -10.282 -0.235 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -1.426 -9.576 0.862 1.00 0.00 H new ATOM 0 HE21 GLN A 66 0.338 -10.150 -0.460 1.00 0.00 H new ATOM 0 HE22 GLN A 66 0.892 -11.822 -0.593 1.00 0.00 H new ATOM 1041 N SER A 67 -4.623 -10.026 4.497 1.00 0.00 N ATOM 1042 CA SER A 67 -5.501 -10.470 5.571 1.00 0.00 C ATOM 1043 C SER A 67 -6.721 -9.559 5.682 1.00 0.00 C ATOM 1044 O SER A 67 -7.754 -9.945 6.228 1.00 0.00 O ATOM 1045 CB SER A 67 -4.743 -10.499 6.897 1.00 0.00 C ATOM 1046 OG SER A 67 -3.575 -11.296 6.791 1.00 0.00 O ATOM 0 H SER A 67 -3.875 -9.399 4.793 1.00 0.00 H new ATOM 0 HA SER A 67 -5.844 -11.478 5.339 1.00 0.00 H new ATOM 0 HB2 SER A 67 -4.471 -9.484 7.188 1.00 0.00 H new ATOM 0 HB3 SER A 67 -5.388 -10.894 7.682 1.00 0.00 H new ATOM 0 HG SER A 67 -2.898 -10.817 6.269 1.00 0.00 H new ATOM 1052 N SER A 68 -6.593 -8.347 5.161 1.00 0.00 N ATOM 1053 CA SER A 68 -7.689 -7.393 5.174 1.00 0.00 C ATOM 1054 C SER A 68 -8.585 -7.605 3.961 1.00 0.00 C ATOM 1055 O SER A 68 -9.773 -7.279 3.991 1.00 0.00 O ATOM 1056 CB SER A 68 -7.146 -5.963 5.198 1.00 0.00 C ATOM 1057 OG SER A 68 -6.319 -5.759 6.334 1.00 0.00 O ATOM 0 H SER A 68 -5.739 -8.002 4.724 1.00 0.00 H new ATOM 0 HA SER A 68 -8.283 -7.551 6.074 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.577 -5.769 4.289 1.00 0.00 H new ATOM 0 HB3 SER A 68 -7.974 -5.254 5.213 1.00 0.00 H new ATOM 0 HG SER A 68 -5.517 -6.317 6.259 1.00 0.00 H new ATOM 1063 N ILE A 69 -8.011 -8.164 2.902 1.00 0.00 N ATOM 1064 CA ILE A 69 -8.768 -8.472 1.700 1.00 0.00 C ATOM 1065 C ILE A 69 -9.593 -9.739 1.905 1.00 0.00 C ATOM 1066 O ILE A 69 -9.134 -10.855 1.640 1.00 0.00 O ATOM 1067 CB ILE A 69 -7.855 -8.631 0.466 1.00 0.00 C ATOM 1068 CG1 ILE A 69 -7.002 -7.373 0.277 1.00 0.00 C ATOM 1069 CG2 ILE A 69 -8.690 -8.905 -0.780 1.00 0.00 C ATOM 1070 CD1 ILE A 69 -6.024 -7.465 -0.873 1.00 0.00 C ATOM 0 H ILE A 69 -7.023 -8.412 2.854 1.00 0.00 H new ATOM 0 HA ILE A 69 -9.435 -7.631 1.511 1.00 0.00 H new ATOM 0 HB ILE A 69 -7.191 -9.480 0.627 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -7.661 -6.520 0.114 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.450 -7.178 1.196 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -8.032 -9.015 -1.642 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -9.261 -9.823 -0.640 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -9.374 -8.074 -0.949 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -5.457 -6.537 -0.943 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.340 -8.297 -0.703 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -6.570 -7.628 -1.802 1.00 0.00 H new ATOM 1082 N ASN A 70 -10.790 -9.547 2.433 1.00 0.00 N ATOM 1083 CA ASN A 70 -11.739 -10.625 2.645 1.00 0.00 C ATOM 1084 C ASN A 70 -13.093 -10.022 2.970 1.00 0.00 C ATOM 1085 O ASN A 70 -13.229 -9.260 3.929 1.00 0.00 O ATOM 1086 CB ASN A 70 -11.286 -11.546 3.787 1.00 0.00 C ATOM 1087 CG ASN A 70 -12.091 -12.837 3.861 1.00 0.00 C ATOM 1088 OD1 ASN A 70 -13.261 -12.887 3.480 1.00 0.00 O ATOM 1089 ND2 ASN A 70 -11.461 -13.893 4.347 1.00 0.00 N ATOM 0 H ASN A 70 -11.132 -8.633 2.728 1.00 0.00 H new ATOM 0 HA ASN A 70 -11.802 -11.228 1.739 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -10.231 -11.788 3.655 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -11.375 -11.013 4.734 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -11.945 -14.788 4.416 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -10.491 -13.812 4.653 1.00 0.00 H new ATOM 1096 N GLU A 71 -14.084 -10.337 2.161 1.00 0.00 N ATOM 1097 CA GLU A 71 -15.414 -9.783 2.341 1.00 0.00 C ATOM 1098 C GLU A 71 -16.418 -10.894 2.607 1.00 0.00 C ATOM 1099 O GLU A 71 -17.631 -10.683 2.507 1.00 0.00 O ATOM 1100 CB GLU A 71 -15.812 -8.984 1.101 1.00 0.00 C ATOM 1101 CG GLU A 71 -14.877 -7.821 0.813 1.00 0.00 C ATOM 1102 CD GLU A 71 -14.295 -7.874 -0.582 1.00 0.00 C ATOM 1103 OE1 GLU A 71 -14.925 -7.312 -1.506 1.00 0.00 O ATOM 1104 OE2 GLU A 71 -13.210 -8.473 -0.757 1.00 0.00 O ATOM 0 H GLU A 71 -13.995 -10.975 1.370 1.00 0.00 H new ATOM 0 HA GLU A 71 -15.409 -9.116 3.203 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -15.830 -9.650 0.238 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -16.825 -8.604 1.231 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -15.419 -6.884 0.941 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -14.066 -7.823 1.541 1.00 0.00 H new ATOM 1111 N ASP A 72 -15.886 -12.066 2.966 1.00 0.00 N ATOM 1112 CA ASP A 72 -16.682 -13.268 3.224 1.00 0.00 C ATOM 1113 C ASP A 72 -17.275 -13.818 1.930 1.00 0.00 C ATOM 1114 O ASP A 72 -16.973 -14.944 1.528 1.00 0.00 O ATOM 1115 CB ASP A 72 -17.792 -13.003 4.249 1.00 0.00 C ATOM 1116 CG ASP A 72 -18.650 -14.225 4.494 1.00 0.00 C ATOM 1117 OD1 ASP A 72 -18.289 -15.044 5.364 1.00 0.00 O ATOM 1118 OD2 ASP A 72 -19.685 -14.383 3.810 1.00 0.00 O ATOM 0 H ASP A 72 -14.883 -12.208 3.086 1.00 0.00 H new ATOM 0 HA ASP A 72 -16.010 -14.016 3.645 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -17.346 -12.681 5.190 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -18.421 -12.185 3.897 1.00 0.00 H new ATOM 1123 N LYS A 73 -18.107 -13.015 1.289 1.00 0.00 N ATOM 1124 CA LYS A 73 -18.733 -13.371 0.029 1.00 0.00 C ATOM 1125 C LYS A 73 -19.454 -12.154 -0.527 1.00 0.00 C ATOM 1126 O LYS A 73 -20.162 -11.465 0.212 1.00 0.00 O ATOM 1127 CB LYS A 73 -19.729 -14.519 0.220 1.00 0.00 C ATOM 1128 CG LYS A 73 -20.404 -14.967 -1.066 1.00 0.00 C ATOM 1129 CD LYS A 73 -21.485 -16.001 -0.794 1.00 0.00 C ATOM 1130 CE LYS A 73 -22.592 -15.427 0.072 1.00 0.00 C ATOM 1131 NZ LYS A 73 -23.621 -16.444 0.407 1.00 0.00 N ATOM 0 H LYS A 73 -18.369 -12.091 1.632 1.00 0.00 H new ATOM 0 HA LYS A 73 -17.962 -13.701 -0.668 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -19.209 -15.369 0.661 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -20.494 -14.209 0.932 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -20.842 -14.104 -1.569 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -19.659 -15.386 -1.743 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -21.903 -16.350 -1.738 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -21.046 -16.868 -0.300 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -22.163 -15.029 0.992 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -23.063 -14.593 -0.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -24.358 -16.010 0.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -24.049 -16.806 -0.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -23.178 -17.229 0.926 1.00 0.00 H new ATOM 1145 N ALA A 74 -19.254 -11.882 -1.809 1.00 0.00 N ATOM 1146 CA ALA A 74 -19.935 -10.779 -2.469 1.00 0.00 C ATOM 1147 C ALA A 74 -21.441 -10.985 -2.416 1.00 0.00 C ATOM 1148 O ALA A 74 -21.948 -12.022 -2.841 1.00 0.00 O ATOM 1149 CB ALA A 74 -19.460 -10.650 -3.910 1.00 0.00 C ATOM 0 H ALA A 74 -18.625 -12.411 -2.413 1.00 0.00 H new ATOM 0 HA ALA A 74 -19.695 -9.854 -1.945 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -19.978 -9.821 -4.391 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -18.386 -10.464 -3.924 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -19.675 -11.573 -4.448 1.00 0.00 H new ATOM 1155 N HIS A 75 -22.142 -10.001 -1.876 1.00 0.00 N ATOM 1156 CA HIS A 75 -23.583 -10.094 -1.701 1.00 0.00 C ATOM 1157 C HIS A 75 -24.288 -9.890 -3.032 1.00 0.00 C ATOM 1158 O HIS A 75 -24.423 -8.764 -3.513 1.00 0.00 O ATOM 1159 CB HIS A 75 -24.078 -9.069 -0.676 1.00 0.00 C ATOM 1160 CG HIS A 75 -23.487 -9.249 0.690 1.00 0.00 C ATOM 1161 ND1 HIS A 75 -24.144 -9.880 1.723 1.00 0.00 N ATOM 1162 CD2 HIS A 75 -22.286 -8.873 1.190 1.00 0.00 C ATOM 1163 CE1 HIS A 75 -23.376 -9.883 2.797 1.00 0.00 C ATOM 1164 NE2 HIS A 75 -22.244 -9.278 2.497 1.00 0.00 N ATOM 0 H HIS A 75 -21.734 -9.125 -1.550 1.00 0.00 H new ATOM 0 HA HIS A 75 -23.817 -11.090 -1.326 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -23.843 -8.067 -1.035 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -25.164 -9.135 -0.604 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -21.506 -8.350 0.656 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -23.631 -10.308 3.756 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -21.462 -9.135 3.136 1.00 0.00 H new ATOM 1173 N LEU A 76 -24.721 -10.987 -3.630 1.00 0.00 N ATOM 1174 CA LEU A 76 -25.329 -10.947 -4.946 1.00 0.00 C ATOM 1175 C LEU A 76 -26.850 -10.993 -4.843 1.00 0.00 C ATOM 1176 O LEU A 76 -27.432 -12.024 -4.509 1.00 0.00 O ATOM 1177 CB LEU A 76 -24.825 -12.119 -5.794 1.00 0.00 C ATOM 1178 CG LEU A 76 -25.250 -12.093 -7.264 1.00 0.00 C ATOM 1179 CD1 LEU A 76 -24.642 -10.891 -7.969 1.00 0.00 C ATOM 1180 CD2 LEU A 76 -24.847 -13.386 -7.959 1.00 0.00 C ATOM 0 H LEU A 76 -24.662 -11.920 -3.221 1.00 0.00 H new ATOM 0 HA LEU A 76 -25.046 -10.010 -5.426 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -23.736 -12.137 -5.748 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -25.179 -13.048 -5.347 1.00 0.00 H new ATOM 0 HG LEU A 76 -26.336 -12.006 -7.310 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -24.953 -10.886 -9.014 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -24.981 -9.975 -7.485 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -23.555 -10.949 -7.915 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -25.157 -13.350 -9.003 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -23.765 -13.506 -7.906 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -25.330 -14.230 -7.466 1.00 0.00 H new ATOM 1192 N GLU A 77 -27.483 -9.863 -5.118 1.00 0.00 N ATOM 1193 CA GLU A 77 -28.940 -9.787 -5.141 1.00 0.00 C ATOM 1194 C GLU A 77 -29.468 -10.164 -6.521 1.00 0.00 C ATOM 1195 O GLU A 77 -30.665 -10.400 -6.701 1.00 0.00 O ATOM 1196 CB GLU A 77 -29.412 -8.374 -4.793 1.00 0.00 C ATOM 1197 CG GLU A 77 -28.929 -7.319 -5.775 1.00 0.00 C ATOM 1198 CD GLU A 77 -29.672 -6.012 -5.628 1.00 0.00 C ATOM 1199 OE1 GLU A 77 -30.742 -5.857 -6.256 1.00 0.00 O ATOM 1200 OE2 GLU A 77 -29.197 -5.134 -4.885 1.00 0.00 O ATOM 0 H GLU A 77 -27.012 -8.983 -5.329 1.00 0.00 H new ATOM 0 HA GLU A 77 -29.325 -10.487 -4.399 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -30.501 -8.360 -4.762 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -29.061 -8.117 -3.793 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -27.863 -7.147 -5.624 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -29.051 -7.691 -6.792 1.00 0.00 H new ATOM 1207 N HIS A 78 -28.559 -10.213 -7.486 1.00 0.00 N ATOM 1208 CA HIS A 78 -28.909 -10.460 -8.875 1.00 0.00 C ATOM 1209 C HIS A 78 -29.422 -11.887 -9.040 1.00 0.00 C ATOM 1210 O HIS A 78 -28.649 -12.845 -8.984 1.00 0.00 O ATOM 1211 CB HIS A 78 -27.683 -10.215 -9.763 1.00 0.00 C ATOM 1212 CG HIS A 78 -28.003 -9.956 -11.202 1.00 0.00 C ATOM 1213 ND1 HIS A 78 -28.469 -8.743 -11.658 1.00 0.00 N ATOM 1214 CD2 HIS A 78 -27.891 -10.748 -12.293 1.00 0.00 C ATOM 1215 CE1 HIS A 78 -28.632 -8.801 -12.965 1.00 0.00 C ATOM 1216 NE2 HIS A 78 -28.286 -10.005 -13.377 1.00 0.00 N ATOM 0 H HIS A 78 -27.560 -10.083 -7.326 1.00 0.00 H new ATOM 0 HA HIS A 78 -29.703 -9.777 -9.178 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -27.128 -9.364 -9.368 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -27.025 -11.082 -9.700 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -27.554 -11.774 -12.308 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -28.989 -7.998 -13.593 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -28.308 -10.331 -14.343 1.00 0.00 H new ATOM 1225 N HIS A 79 -30.730 -12.024 -9.225 1.00 0.00 N ATOM 1226 CA HIS A 79 -31.352 -13.338 -9.307 1.00 0.00 C ATOM 1227 C HIS A 79 -31.115 -13.960 -10.676 1.00 0.00 C ATOM 1228 O HIS A 79 -31.309 -13.320 -11.710 1.00 0.00 O ATOM 1229 CB HIS A 79 -32.858 -13.274 -8.989 1.00 0.00 C ATOM 1230 CG HIS A 79 -33.684 -12.491 -9.971 1.00 0.00 C ATOM 1231 ND1 HIS A 79 -34.244 -13.051 -11.100 1.00 0.00 N ATOM 1232 CD2 HIS A 79 -34.058 -11.190 -9.978 1.00 0.00 C ATOM 1233 CE1 HIS A 79 -34.924 -12.132 -11.755 1.00 0.00 C ATOM 1234 NE2 HIS A 79 -34.829 -10.995 -11.097 1.00 0.00 N ATOM 0 H HIS A 79 -31.378 -11.242 -9.321 1.00 0.00 H new ATOM 0 HA HIS A 79 -30.885 -13.972 -8.553 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -33.247 -14.291 -8.940 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -32.986 -12.836 -7.999 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -33.798 -10.445 -9.241 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -35.467 -12.285 -12.676 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -35.259 -10.112 -11.374 1.00 0.00 H new ATOM 1243 N HIS A 80 -30.678 -15.206 -10.673 1.00 0.00 N ATOM 1244 CA HIS A 80 -30.369 -15.916 -11.899 1.00 0.00 C ATOM 1245 C HIS A 80 -30.495 -17.415 -11.665 1.00 0.00 C ATOM 1246 O HIS A 80 -29.785 -17.975 -10.831 1.00 0.00 O ATOM 1247 CB HIS A 80 -28.943 -15.570 -12.347 1.00 0.00 C ATOM 1248 CG HIS A 80 -28.576 -16.091 -13.701 1.00 0.00 C ATOM 1249 ND1 HIS A 80 -27.827 -17.230 -13.895 1.00 0.00 N ATOM 1250 CD2 HIS A 80 -28.843 -15.604 -14.934 1.00 0.00 C ATOM 1251 CE1 HIS A 80 -27.648 -17.420 -15.187 1.00 0.00 C ATOM 1252 NE2 HIS A 80 -28.254 -16.447 -15.843 1.00 0.00 N ATOM 0 H HIS A 80 -30.528 -15.752 -9.824 1.00 0.00 H new ATOM 0 HA HIS A 80 -31.069 -15.618 -12.680 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -28.828 -14.486 -12.345 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -28.239 -15.967 -11.615 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -29.414 -14.716 -15.161 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -27.098 -18.235 -15.634 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -28.280 -16.340 -16.857 1.00 0.00 H new ATOM 1261 N HIS A 81 -31.412 -18.061 -12.371 1.00 0.00 N ATOM 1262 CA HIS A 81 -31.586 -19.500 -12.217 1.00 0.00 C ATOM 1263 C HIS A 81 -30.796 -20.229 -13.298 1.00 0.00 C ATOM 1264 O HIS A 81 -30.625 -19.715 -14.404 1.00 0.00 O ATOM 1265 CB HIS A 81 -33.075 -19.898 -12.241 1.00 0.00 C ATOM 1266 CG HIS A 81 -33.672 -20.084 -13.609 1.00 0.00 C ATOM 1267 ND1 HIS A 81 -33.970 -21.322 -14.128 1.00 0.00 N ATOM 1268 CD2 HIS A 81 -34.049 -19.187 -14.549 1.00 0.00 C ATOM 1269 CE1 HIS A 81 -34.501 -21.181 -15.325 1.00 0.00 C ATOM 1270 NE2 HIS A 81 -34.565 -19.895 -15.609 1.00 0.00 N ATOM 0 H HIS A 81 -32.038 -17.621 -13.046 1.00 0.00 H new ATOM 0 HA HIS A 81 -31.200 -19.795 -11.241 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -33.194 -20.826 -11.682 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -33.646 -19.133 -11.715 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -33.961 -18.113 -14.480 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -34.829 -21.985 -15.967 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -34.935 -19.493 -16.470 1.00 0.00 H new ATOM 1279 N HIS A 82 -30.318 -21.419 -12.976 1.00 0.00 N ATOM 1280 CA HIS A 82 -29.437 -22.156 -13.869 1.00 0.00 C ATOM 1281 C HIS A 82 -30.183 -23.319 -14.523 1.00 0.00 C ATOM 1282 O HIS A 82 -31.163 -23.824 -13.972 1.00 0.00 O ATOM 1283 CB HIS A 82 -28.225 -22.669 -13.080 1.00 0.00 C ATOM 1284 CG HIS A 82 -27.107 -23.191 -13.930 1.00 0.00 C ATOM 1285 ND1 HIS A 82 -26.727 -24.516 -13.947 1.00 0.00 N ATOM 1286 CD2 HIS A 82 -26.273 -22.553 -14.785 1.00 0.00 C ATOM 1287 CE1 HIS A 82 -25.709 -24.669 -14.776 1.00 0.00 C ATOM 1288 NE2 HIS A 82 -25.417 -23.494 -15.296 1.00 0.00 N ATOM 0 H HIS A 82 -30.526 -21.898 -12.100 1.00 0.00 H new ATOM 0 HA HIS A 82 -29.094 -21.490 -14.661 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -27.844 -21.860 -12.457 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -28.554 -23.461 -12.407 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -26.281 -21.499 -15.021 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -25.203 -25.599 -14.991 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -24.673 -23.314 -15.970 1.00 0.00 H new ATOM 1297 N HIS A 83 -29.739 -23.718 -15.706 1.00 0.00 N ATOM 1298 CA HIS A 83 -30.322 -24.857 -16.398 1.00 0.00 C ATOM 1299 C HIS A 83 -29.600 -26.133 -15.989 1.00 0.00 C ATOM 1300 O HIS A 83 -28.604 -26.487 -16.646 1.00 0.00 O ATOM 1301 CB HIS A 83 -30.237 -24.664 -17.916 1.00 0.00 C ATOM 1302 CG HIS A 83 -30.912 -25.745 -18.710 1.00 0.00 C ATOM 1303 ND1 HIS A 83 -30.245 -26.844 -19.211 1.00 0.00 N ATOM 1304 CD2 HIS A 83 -32.199 -25.880 -19.105 1.00 0.00 C ATOM 1305 CE1 HIS A 83 -31.092 -27.603 -19.881 1.00 0.00 C ATOM 1306 NE2 HIS A 83 -32.284 -27.042 -19.831 1.00 0.00 N ATOM 1307 OXT HIS A 83 -30.019 -26.762 -14.999 1.00 0.00 O ATOM 0 H HIS A 83 -28.974 -23.267 -16.208 1.00 0.00 H new ATOM 0 HA HIS A 83 -31.373 -24.937 -16.120 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -30.684 -23.704 -18.175 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -29.188 -24.615 -18.207 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -33.009 -25.200 -18.889 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -30.850 -28.527 -20.385 1.00 0.00 H new ATOM 0 HE2 HIS A 83 -33.132 -27.411 -20.262 1.00 0.00 H new TER 1316 HIS A 83 ATOM 1317 N MET B 1 19.873 10.461 -10.167 1.00 0.00 N ATOM 1318 CA MET B 1 19.581 9.142 -10.778 1.00 0.00 C ATOM 1319 C MET B 1 18.100 8.827 -10.641 1.00 0.00 C ATOM 1320 O MET B 1 17.643 8.387 -9.584 1.00 0.00 O ATOM 1321 CB MET B 1 20.408 8.026 -10.123 1.00 0.00 C ATOM 1322 CG MET B 1 21.895 8.075 -10.443 1.00 0.00 C ATOM 1323 SD MET B 1 22.718 9.523 -9.751 1.00 0.00 S ATOM 1324 CE MET B 1 24.377 9.298 -10.388 1.00 0.00 C ATOM 0 H1 MET B 1 20.903 10.597 -10.110 1.00 0.00 H new ATOM 0 H2 MET B 1 19.456 11.214 -10.751 1.00 0.00 H new ATOM 0 H3 MET B 1 19.466 10.498 -9.211 1.00 0.00 H new ATOM 0 HA MET B 1 19.852 9.192 -11.833 1.00 0.00 H new ATOM 0 HB2 MET B 1 20.279 8.082 -9.042 1.00 0.00 H new ATOM 0 HB3 MET B 1 20.012 7.062 -10.442 1.00 0.00 H new ATOM 0 HG2 MET B 1 22.373 7.174 -10.059 1.00 0.00 H new ATOM 0 HG3 MET B 1 22.028 8.071 -11.525 1.00 0.00 H new ATOM 0 HE1 MET B 1 25.012 10.116 -10.047 1.00 0.00 H new ATOM 0 HE2 MET B 1 24.780 8.352 -10.027 1.00 0.00 H new ATOM 0 HE3 MET B 1 24.350 9.289 -11.478 1.00 0.00 H new ATOM 1336 N PRO B 2 17.328 9.065 -11.703 1.00 0.00 N ATOM 1337 CA PRO B 2 15.884 8.890 -11.680 1.00 0.00 C ATOM 1338 C PRO B 2 15.453 7.467 -12.000 1.00 0.00 C ATOM 1339 O PRO B 2 16.182 6.710 -12.644 1.00 0.00 O ATOM 1340 CB PRO B 2 15.430 9.842 -12.781 1.00 0.00 C ATOM 1341 CG PRO B 2 16.528 9.795 -13.789 1.00 0.00 C ATOM 1342 CD PRO B 2 17.800 9.535 -13.021 1.00 0.00 C ATOM 0 HA PRO B 2 15.457 9.088 -10.697 1.00 0.00 H new ATOM 0 HB2 PRO B 2 14.480 9.526 -13.213 1.00 0.00 H new ATOM 0 HB3 PRO B 2 15.285 10.852 -12.398 1.00 0.00 H new ATOM 0 HG2 PRO B 2 16.349 9.008 -14.522 1.00 0.00 H new ATOM 0 HG3 PRO B 2 16.591 10.734 -14.339 1.00 0.00 H new ATOM 0 HD2 PRO B 2 18.419 8.786 -13.515 1.00 0.00 H new ATOM 0 HD3 PRO B 2 18.404 10.438 -12.931 1.00 0.00 H new ATOM 1350 N GLN B 3 14.277 7.101 -11.529 1.00 0.00 N ATOM 1351 CA GLN B 3 13.676 5.838 -11.905 1.00 0.00 C ATOM 1352 C GLN B 3 12.827 6.061 -13.142 1.00 0.00 C ATOM 1353 O GLN B 3 11.733 6.615 -13.047 1.00 0.00 O ATOM 1354 CB GLN B 3 12.821 5.281 -10.766 1.00 0.00 C ATOM 1355 CG GLN B 3 13.589 5.030 -9.478 1.00 0.00 C ATOM 1356 CD GLN B 3 14.578 3.883 -9.583 1.00 0.00 C ATOM 1357 OE1 GLN B 3 15.116 3.593 -10.652 1.00 0.00 O ATOM 1358 NE2 GLN B 3 14.822 3.219 -8.466 1.00 0.00 N ATOM 0 H GLN B 3 13.719 7.661 -10.885 1.00 0.00 H new ATOM 0 HA GLN B 3 14.459 5.110 -12.115 1.00 0.00 H new ATOM 0 HB2 GLN B 3 12.008 5.978 -10.562 1.00 0.00 H new ATOM 0 HB3 GLN B 3 12.365 4.346 -11.092 1.00 0.00 H new ATOM 0 HG2 GLN B 3 14.124 5.938 -9.199 1.00 0.00 H new ATOM 0 HG3 GLN B 3 12.881 4.818 -8.676 1.00 0.00 H new ATOM 0 HE21 GLN B 3 14.356 3.490 -7.600 1.00 0.00 H new ATOM 0 HE22 GLN B 3 15.476 2.436 -8.471 1.00 0.00 H new ATOM 1367 N ILE B 4 13.359 5.674 -14.300 1.00 0.00 N ATOM 1368 CA ILE B 4 12.690 5.902 -15.580 1.00 0.00 C ATOM 1369 C ILE B 4 11.259 5.376 -15.535 1.00 0.00 C ATOM 1370 O ILE B 4 11.030 4.166 -15.474 1.00 0.00 O ATOM 1371 CB ILE B 4 13.446 5.249 -16.770 1.00 0.00 C ATOM 1372 CG1 ILE B 4 14.829 5.890 -16.968 1.00 0.00 C ATOM 1373 CG2 ILE B 4 12.632 5.363 -18.054 1.00 0.00 C ATOM 1374 CD1 ILE B 4 15.873 5.446 -15.965 1.00 0.00 C ATOM 0 H ILE B 4 14.258 5.198 -14.378 1.00 0.00 H new ATOM 0 HA ILE B 4 12.683 6.980 -15.743 1.00 0.00 H new ATOM 0 HB ILE B 4 13.586 4.194 -16.533 1.00 0.00 H new ATOM 0 HG12 ILE B 4 15.184 5.656 -17.972 1.00 0.00 H new ATOM 0 HG13 ILE B 4 14.725 6.974 -16.911 1.00 0.00 H new ATOM 0 HG21 ILE B 4 13.180 4.899 -18.874 1.00 0.00 H new ATOM 0 HG22 ILE B 4 11.675 4.857 -17.925 1.00 0.00 H new ATOM 0 HG23 ILE B 4 12.458 6.415 -18.282 1.00 0.00 H new ATOM 0 HD11 ILE B 4 16.818 5.946 -16.178 1.00 0.00 H new ATOM 0 HD12 ILE B 4 15.544 5.705 -14.959 1.00 0.00 H new ATOM 0 HD13 ILE B 4 16.010 4.367 -16.036 1.00 0.00 H new ATOM 1386 N SER B 5 10.311 6.298 -15.540 1.00 0.00 N ATOM 1387 CA SER B 5 8.906 5.958 -15.424 1.00 0.00 C ATOM 1388 C SER B 5 8.315 5.630 -16.789 1.00 0.00 C ATOM 1389 O SER B 5 8.844 6.035 -17.824 1.00 0.00 O ATOM 1390 CB SER B 5 8.151 7.127 -14.780 1.00 0.00 C ATOM 1391 OG SER B 5 6.767 6.842 -14.626 1.00 0.00 O ATOM 0 H SER B 5 10.494 7.298 -15.624 1.00 0.00 H new ATOM 0 HA SER B 5 8.806 5.074 -14.795 1.00 0.00 H new ATOM 0 HB2 SER B 5 8.587 7.348 -13.806 1.00 0.00 H new ATOM 0 HB3 SER B 5 8.272 8.020 -15.394 1.00 0.00 H new ATOM 0 HG SER B 5 6.643 5.878 -14.501 1.00 0.00 H new ATOM 1397 N ARG B 6 7.231 4.867 -16.786 1.00 0.00 N ATOM 1398 CA ARG B 6 6.499 4.576 -18.007 1.00 0.00 C ATOM 1399 C ARG B 6 5.611 5.767 -18.360 1.00 0.00 C ATOM 1400 O ARG B 6 5.165 5.922 -19.498 1.00 0.00 O ATOM 1401 CB ARG B 6 5.645 3.319 -17.820 1.00 0.00 C ATOM 1402 CG ARG B 6 5.140 2.720 -19.121 1.00 0.00 C ATOM 1403 CD ARG B 6 6.289 2.197 -19.971 1.00 0.00 C ATOM 1404 NE ARG B 6 7.104 1.225 -19.239 1.00 0.00 N ATOM 1405 CZ ARG B 6 8.282 0.766 -19.661 1.00 0.00 C ATOM 1406 NH1 ARG B 6 8.772 1.147 -20.834 1.00 0.00 N ATOM 1407 NH2 ARG B 6 8.971 -0.077 -18.904 1.00 0.00 N ATOM 0 H ARG B 6 6.839 4.438 -15.948 1.00 0.00 H new ATOM 0 HA ARG B 6 7.205 4.399 -18.819 1.00 0.00 H new ATOM 0 HB2 ARG B 6 6.231 2.569 -17.289 1.00 0.00 H new ATOM 0 HB3 ARG B 6 4.791 3.562 -17.188 1.00 0.00 H new ATOM 0 HG2 ARG B 6 4.446 1.908 -18.905 1.00 0.00 H new ATOM 0 HG3 ARG B 6 4.585 3.474 -19.680 1.00 0.00 H new ATOM 0 HD2 ARG B 6 5.892 1.733 -20.874 1.00 0.00 H new ATOM 0 HD3 ARG B 6 6.915 3.030 -20.290 1.00 0.00 H new ATOM 0 HE ARG B 6 6.747 0.877 -18.349 1.00 0.00 H new ATOM 0 HH11 ARG B 6 8.246 1.796 -21.420 1.00 0.00 H new ATOM 0 HH12 ARG B 6 9.674 0.791 -21.150 1.00 0.00 H new ATOM 0 HH21 ARG B 6 8.599 -0.373 -18.001 1.00 0.00 H new ATOM 0 HH22 ARG B 6 9.873 -0.430 -19.224 1.00 0.00 H new ATOM 1421 N TYR B 7 5.378 6.611 -17.365 1.00 0.00 N ATOM 1422 CA TYR B 7 4.521 7.776 -17.516 1.00 0.00 C ATOM 1423 C TYR B 7 5.362 9.040 -17.408 1.00 0.00 C ATOM 1424 O TYR B 7 6.574 8.962 -17.215 1.00 0.00 O ATOM 1425 CB TYR B 7 3.433 7.779 -16.435 1.00 0.00 C ATOM 1426 CG TYR B 7 2.620 6.505 -16.383 1.00 0.00 C ATOM 1427 CD1 TYR B 7 3.088 5.389 -15.698 1.00 0.00 C ATOM 1428 CD2 TYR B 7 1.389 6.413 -17.023 1.00 0.00 C ATOM 1429 CE1 TYR B 7 2.355 4.223 -15.647 1.00 0.00 C ATOM 1430 CE2 TYR B 7 0.649 5.246 -16.978 1.00 0.00 C ATOM 1431 CZ TYR B 7 1.138 4.155 -16.290 1.00 0.00 C ATOM 1432 OH TYR B 7 0.413 2.987 -16.246 1.00 0.00 O ATOM 0 H TYR B 7 5.777 6.507 -16.432 1.00 0.00 H new ATOM 0 HA TYR B 7 4.040 7.741 -18.494 1.00 0.00 H new ATOM 0 HB2 TYR B 7 3.900 7.941 -15.463 1.00 0.00 H new ATOM 0 HB3 TYR B 7 2.762 8.620 -16.610 1.00 0.00 H new ATOM 0 HD1 TYR B 7 4.043 5.437 -15.197 1.00 0.00 H new ATOM 0 HD2 TYR B 7 1.005 7.266 -17.563 1.00 0.00 H new ATOM 0 HE1 TYR B 7 2.732 3.368 -15.106 1.00 0.00 H new ATOM 0 HE2 TYR B 7 -0.306 5.189 -17.479 1.00 0.00 H new ATOM 0 HH TYR B 7 0.852 2.352 -15.643 1.00 0.00 H new ATOM 1442 N SER B 8 4.724 10.194 -17.530 1.00 0.00 N ATOM 1443 CA SER B 8 5.422 11.460 -17.391 1.00 0.00 C ATOM 1444 C SER B 8 5.927 11.633 -15.962 1.00 0.00 C ATOM 1445 O SER B 8 5.145 11.587 -15.009 1.00 0.00 O ATOM 1446 CB SER B 8 4.499 12.621 -17.769 1.00 0.00 C ATOM 1447 OG SER B 8 5.155 13.869 -17.614 1.00 0.00 O ATOM 0 H SER B 8 3.726 10.279 -17.725 1.00 0.00 H new ATOM 0 HA SER B 8 6.278 11.460 -18.066 1.00 0.00 H new ATOM 0 HB2 SER B 8 4.170 12.506 -18.802 1.00 0.00 H new ATOM 0 HB3 SER B 8 3.606 12.597 -17.145 1.00 0.00 H new ATOM 0 HG SER B 8 4.544 14.593 -17.864 1.00 0.00 H new ATOM 1453 N ASP B 9 7.235 11.836 -15.823 1.00 0.00 N ATOM 1454 CA ASP B 9 7.863 11.999 -14.511 1.00 0.00 C ATOM 1455 C ASP B 9 7.241 13.161 -13.753 1.00 0.00 C ATOM 1456 O ASP B 9 7.245 13.183 -12.521 1.00 0.00 O ATOM 1457 CB ASP B 9 9.369 12.243 -14.641 1.00 0.00 C ATOM 1458 CG ASP B 9 10.099 11.109 -15.327 1.00 0.00 C ATOM 1459 OD1 ASP B 9 10.156 10.001 -14.761 1.00 0.00 O ATOM 1460 OD2 ASP B 9 10.635 11.336 -16.432 1.00 0.00 O ATOM 0 H ASP B 9 7.885 11.892 -16.607 1.00 0.00 H new ATOM 0 HA ASP B 9 7.697 11.073 -13.961 1.00 0.00 H new ATOM 0 HB2 ASP B 9 9.534 13.164 -15.200 1.00 0.00 H new ATOM 0 HB3 ASP B 9 9.794 12.392 -13.648 1.00 0.00 H new ATOM 1465 N GLU B 10 6.708 14.124 -14.501 1.00 0.00 N ATOM 1466 CA GLU B 10 6.086 15.303 -13.916 1.00 0.00 C ATOM 1467 C GLU B 10 4.948 14.911 -12.981 1.00 0.00 C ATOM 1468 O GLU B 10 5.049 15.077 -11.768 1.00 0.00 O ATOM 1469 CB GLU B 10 5.566 16.236 -15.013 1.00 0.00 C ATOM 1470 CG GLU B 10 6.663 16.815 -15.890 1.00 0.00 C ATOM 1471 CD GLU B 10 7.684 17.595 -15.089 1.00 0.00 C ATOM 1472 OE1 GLU B 10 7.348 18.693 -14.598 1.00 0.00 O ATOM 1473 OE2 GLU B 10 8.819 17.105 -14.929 1.00 0.00 O ATOM 0 H GLU B 10 6.696 14.108 -15.521 1.00 0.00 H new ATOM 0 HA GLU B 10 6.844 15.829 -13.336 1.00 0.00 H new ATOM 0 HB2 GLU B 10 4.862 15.689 -15.640 1.00 0.00 H new ATOM 0 HB3 GLU B 10 5.013 17.053 -14.551 1.00 0.00 H new ATOM 0 HG2 GLU B 10 7.163 16.007 -16.424 1.00 0.00 H new ATOM 0 HG3 GLU B 10 6.218 17.467 -16.642 1.00 0.00 H new ATOM 1480 N GLN B 11 3.880 14.360 -13.546 1.00 0.00 N ATOM 1481 CA GLN B 11 2.696 14.025 -12.764 1.00 0.00 C ATOM 1482 C GLN B 11 3.007 12.972 -11.704 1.00 0.00 C ATOM 1483 O GLN B 11 2.437 13.003 -10.614 1.00 0.00 O ATOM 1484 CB GLN B 11 1.556 13.553 -13.672 1.00 0.00 C ATOM 1485 CG GLN B 11 1.912 12.368 -14.552 1.00 0.00 C ATOM 1486 CD GLN B 11 0.768 11.956 -15.454 1.00 0.00 C ATOM 1487 OE1 GLN B 11 -0.060 11.124 -15.091 1.00 0.00 O ATOM 1488 NE2 GLN B 11 0.701 12.552 -16.632 1.00 0.00 N ATOM 0 H GLN B 11 3.809 14.136 -14.539 1.00 0.00 H new ATOM 0 HA GLN B 11 2.375 14.932 -12.251 1.00 0.00 H new ATOM 0 HB2 GLN B 11 0.699 13.287 -13.053 1.00 0.00 H new ATOM 0 HB3 GLN B 11 1.245 14.383 -14.307 1.00 0.00 H new ATOM 0 HG2 GLN B 11 2.780 12.619 -15.162 1.00 0.00 H new ATOM 0 HG3 GLN B 11 2.198 11.525 -13.923 1.00 0.00 H new ATOM 0 HE21 GLN B 11 1.408 13.238 -16.897 1.00 0.00 H new ATOM 0 HE22 GLN B 11 -0.057 12.326 -17.275 1.00 0.00 H new ATOM 1497 N VAL B 12 3.923 12.060 -12.018 1.00 0.00 N ATOM 1498 CA VAL B 12 4.320 11.021 -11.077 1.00 0.00 C ATOM 1499 C VAL B 12 4.890 11.634 -9.798 1.00 0.00 C ATOM 1500 O VAL B 12 4.444 11.318 -8.692 1.00 0.00 O ATOM 1501 CB VAL B 12 5.368 10.063 -11.688 1.00 0.00 C ATOM 1502 CG1 VAL B 12 5.820 9.029 -10.665 1.00 0.00 C ATOM 1503 CG2 VAL B 12 4.810 9.371 -12.921 1.00 0.00 C ATOM 0 H VAL B 12 4.403 12.021 -12.917 1.00 0.00 H new ATOM 0 HA VAL B 12 3.422 10.450 -10.841 1.00 0.00 H new ATOM 0 HB VAL B 12 6.233 10.657 -11.983 1.00 0.00 H new ATOM 0 HG11 VAL B 12 6.557 8.367 -11.119 1.00 0.00 H new ATOM 0 HG12 VAL B 12 6.265 9.535 -9.808 1.00 0.00 H new ATOM 0 HG13 VAL B 12 4.961 8.444 -10.335 1.00 0.00 H new ATOM 0 HG21 VAL B 12 5.564 8.702 -13.335 1.00 0.00 H new ATOM 0 HG22 VAL B 12 3.926 8.796 -12.647 1.00 0.00 H new ATOM 0 HG23 VAL B 12 4.540 10.119 -13.667 1.00 0.00 H new ATOM 1513 N GLU B 13 5.861 12.527 -9.953 1.00 0.00 N ATOM 1514 CA GLU B 13 6.513 13.125 -8.799 1.00 0.00 C ATOM 1515 C GLU B 13 5.626 14.187 -8.158 1.00 0.00 C ATOM 1516 O GLU B 13 5.663 14.378 -6.944 1.00 0.00 O ATOM 1517 CB GLU B 13 7.873 13.712 -9.178 1.00 0.00 C ATOM 1518 CG GLU B 13 8.672 14.188 -7.977 1.00 0.00 C ATOM 1519 CD GLU B 13 10.123 14.453 -8.303 1.00 0.00 C ATOM 1520 OE1 GLU B 13 10.899 13.483 -8.394 1.00 0.00 O ATOM 1521 OE2 GLU B 13 10.504 15.633 -8.444 1.00 0.00 O ATOM 0 H GLU B 13 6.209 12.849 -10.856 1.00 0.00 H new ATOM 0 HA GLU B 13 6.679 12.335 -8.066 1.00 0.00 H new ATOM 0 HB2 GLU B 13 8.450 12.959 -9.716 1.00 0.00 H new ATOM 0 HB3 GLU B 13 7.724 14.548 -9.862 1.00 0.00 H new ATOM 0 HG2 GLU B 13 8.221 15.099 -7.585 1.00 0.00 H new ATOM 0 HG3 GLU B 13 8.613 13.438 -7.188 1.00 0.00 H new ATOM 1528 N GLN B 14 4.816 14.867 -8.966 1.00 0.00 N ATOM 1529 CA GLN B 14 3.872 15.849 -8.439 1.00 0.00 C ATOM 1530 C GLN B 14 2.882 15.181 -7.490 1.00 0.00 C ATOM 1531 O GLN B 14 2.508 15.758 -6.468 1.00 0.00 O ATOM 1532 CB GLN B 14 3.119 16.559 -9.566 1.00 0.00 C ATOM 1533 CG GLN B 14 3.981 17.499 -10.397 1.00 0.00 C ATOM 1534 CD GLN B 14 4.621 18.599 -9.575 1.00 0.00 C ATOM 1535 OE1 GLN B 14 4.033 19.663 -9.379 1.00 0.00 O ATOM 1536 NE2 GLN B 14 5.837 18.366 -9.114 1.00 0.00 N ATOM 0 H GLN B 14 4.794 14.758 -9.980 1.00 0.00 H new ATOM 0 HA GLN B 14 4.444 16.596 -7.889 1.00 0.00 H new ATOM 0 HB2 GLN B 14 2.681 15.809 -10.224 1.00 0.00 H new ATOM 0 HB3 GLN B 14 2.294 17.126 -9.135 1.00 0.00 H new ATOM 0 HG2 GLN B 14 4.762 16.923 -10.893 1.00 0.00 H new ATOM 0 HG3 GLN B 14 3.369 17.947 -11.180 1.00 0.00 H new ATOM 0 HE21 GLN B 14 6.289 17.471 -9.299 1.00 0.00 H new ATOM 0 HE22 GLN B 14 6.323 19.081 -8.574 1.00 0.00 H new ATOM 1545 N LEU B 15 2.464 13.965 -7.835 1.00 0.00 N ATOM 1546 CA LEU B 15 1.601 13.176 -6.964 1.00 0.00 C ATOM 1547 C LEU B 15 2.294 12.908 -5.639 1.00 0.00 C ATOM 1548 O LEU B 15 1.772 13.241 -4.577 1.00 0.00 O ATOM 1549 CB LEU B 15 1.223 11.846 -7.628 1.00 0.00 C ATOM 1550 CG LEU B 15 0.208 11.943 -8.767 1.00 0.00 C ATOM 1551 CD1 LEU B 15 0.063 10.599 -9.460 1.00 0.00 C ATOM 1552 CD2 LEU B 15 -1.137 12.417 -8.235 1.00 0.00 C ATOM 0 H LEU B 15 2.710 13.506 -8.712 1.00 0.00 H new ATOM 0 HA LEU B 15 0.690 13.747 -6.784 1.00 0.00 H new ATOM 0 HB2 LEU B 15 2.131 11.381 -8.013 1.00 0.00 H new ATOM 0 HB3 LEU B 15 0.823 11.180 -6.864 1.00 0.00 H new ATOM 0 HG LEU B 15 0.568 12.670 -9.496 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -0.663 10.683 -10.269 1.00 0.00 H new ATOM 0 HD12 LEU B 15 1.027 10.294 -9.868 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -0.279 9.854 -8.741 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -1.851 12.482 -9.056 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -1.503 11.710 -7.491 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -1.021 13.399 -7.777 1.00 0.00 H new ATOM 1564 N LEU B 16 3.488 12.329 -5.715 1.00 0.00 N ATOM 1565 CA LEU B 16 4.256 11.980 -4.526 1.00 0.00 C ATOM 1566 C LEU B 16 4.525 13.209 -3.657 1.00 0.00 C ATOM 1567 O LEU B 16 4.339 13.174 -2.440 1.00 0.00 O ATOM 1568 CB LEU B 16 5.580 11.324 -4.929 1.00 0.00 C ATOM 1569 CG LEU B 16 6.474 10.884 -3.766 1.00 0.00 C ATOM 1570 CD1 LEU B 16 5.785 9.810 -2.935 1.00 0.00 C ATOM 1571 CD2 LEU B 16 7.815 10.386 -4.283 1.00 0.00 C ATOM 0 H LEU B 16 3.947 12.090 -6.594 1.00 0.00 H new ATOM 0 HA LEU B 16 3.667 11.274 -3.940 1.00 0.00 H new ATOM 0 HB2 LEU B 16 5.362 10.453 -5.547 1.00 0.00 H new ATOM 0 HB3 LEU B 16 6.139 12.024 -5.550 1.00 0.00 H new ATOM 0 HG LEU B 16 6.653 11.747 -3.125 1.00 0.00 H new ATOM 0 HD11 LEU B 16 6.437 9.511 -2.114 1.00 0.00 H new ATOM 0 HD12 LEU B 16 4.852 10.204 -2.533 1.00 0.00 H new ATOM 0 HD13 LEU B 16 5.572 8.945 -3.563 1.00 0.00 H new ATOM 0 HD21 LEU B 16 8.437 10.078 -3.443 1.00 0.00 H new ATOM 0 HD22 LEU B 16 7.656 9.537 -4.948 1.00 0.00 H new ATOM 0 HD23 LEU B 16 8.314 11.186 -4.830 1.00 0.00 H new ATOM 1583 N ALA B 17 4.950 14.295 -4.295 1.00 0.00 N ATOM 1584 CA ALA B 17 5.264 15.529 -3.586 1.00 0.00 C ATOM 1585 C ALA B 17 4.052 16.057 -2.828 1.00 0.00 C ATOM 1586 O ALA B 17 4.156 16.436 -1.660 1.00 0.00 O ATOM 1587 CB ALA B 17 5.773 16.582 -4.560 1.00 0.00 C ATOM 0 H ALA B 17 5.085 14.345 -5.305 1.00 0.00 H new ATOM 0 HA ALA B 17 6.046 15.308 -2.859 1.00 0.00 H new ATOM 0 HB1 ALA B 17 6.004 17.499 -4.017 1.00 0.00 H new ATOM 0 HB2 ALA B 17 6.673 16.216 -5.054 1.00 0.00 H new ATOM 0 HB3 ALA B 17 5.007 16.786 -5.308 1.00 0.00 H new ATOM 1593 N GLU B 18 2.900 16.064 -3.488 1.00 0.00 N ATOM 1594 CA GLU B 18 1.685 16.574 -2.876 1.00 0.00 C ATOM 1595 C GLU B 18 1.178 15.619 -1.798 1.00 0.00 C ATOM 1596 O GLU B 18 0.666 16.059 -0.768 1.00 0.00 O ATOM 1597 CB GLU B 18 0.612 16.834 -3.937 1.00 0.00 C ATOM 1598 CG GLU B 18 -0.673 17.415 -3.370 1.00 0.00 C ATOM 1599 CD GLU B 18 -1.496 18.151 -4.405 1.00 0.00 C ATOM 1600 OE1 GLU B 18 -2.087 17.500 -5.286 1.00 0.00 O ATOM 1601 OE2 GLU B 18 -1.567 19.395 -4.332 1.00 0.00 O ATOM 0 H GLU B 18 2.784 15.723 -4.442 1.00 0.00 H new ATOM 0 HA GLU B 18 1.917 17.524 -2.395 1.00 0.00 H new ATOM 0 HB2 GLU B 18 1.011 17.518 -4.686 1.00 0.00 H new ATOM 0 HB3 GLU B 18 0.384 15.899 -4.449 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -1.272 16.610 -2.943 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -0.429 18.097 -2.556 1.00 0.00 H new ATOM 1608 N LEU B 19 1.340 14.319 -2.023 1.00 0.00 N ATOM 1609 CA LEU B 19 0.971 13.323 -1.022 1.00 0.00 C ATOM 1610 C LEU B 19 1.768 13.540 0.259 1.00 0.00 C ATOM 1611 O LEU B 19 1.206 13.560 1.353 1.00 0.00 O ATOM 1612 CB LEU B 19 1.200 11.902 -1.547 1.00 0.00 C ATOM 1613 CG LEU B 19 0.238 11.444 -2.644 1.00 0.00 C ATOM 1614 CD1 LEU B 19 0.618 10.060 -3.142 1.00 0.00 C ATOM 1615 CD2 LEU B 19 -1.197 11.452 -2.136 1.00 0.00 C ATOM 0 H LEU B 19 1.723 13.931 -2.885 1.00 0.00 H new ATOM 0 HA LEU B 19 -0.091 13.441 -0.806 1.00 0.00 H new ATOM 0 HB2 LEU B 19 2.219 11.834 -1.929 1.00 0.00 H new ATOM 0 HB3 LEU B 19 1.127 11.208 -0.710 1.00 0.00 H new ATOM 0 HG LEU B 19 0.311 12.143 -3.477 1.00 0.00 H new ATOM 0 HD11 LEU B 19 -0.077 9.750 -3.922 1.00 0.00 H new ATOM 0 HD12 LEU B 19 1.630 10.084 -3.546 1.00 0.00 H new ATOM 0 HD13 LEU B 19 0.575 9.351 -2.315 1.00 0.00 H new ATOM 0 HD21 LEU B 19 -1.866 11.123 -2.931 1.00 0.00 H new ATOM 0 HD22 LEU B 19 -1.285 10.777 -1.285 1.00 0.00 H new ATOM 0 HD23 LEU B 19 -1.468 12.462 -1.828 1.00 0.00 H new ATOM 1627 N LEU B 20 3.078 13.725 0.116 1.00 0.00 N ATOM 1628 CA LEU B 20 3.943 13.996 1.261 1.00 0.00 C ATOM 1629 C LEU B 20 3.528 15.298 1.939 1.00 0.00 C ATOM 1630 O LEU B 20 3.513 15.395 3.165 1.00 0.00 O ATOM 1631 CB LEU B 20 5.408 14.071 0.826 1.00 0.00 C ATOM 1632 CG LEU B 20 5.968 12.789 0.203 1.00 0.00 C ATOM 1633 CD1 LEU B 20 7.411 12.997 -0.236 1.00 0.00 C ATOM 1634 CD2 LEU B 20 5.871 11.631 1.186 1.00 0.00 C ATOM 0 H LEU B 20 3.563 13.692 -0.781 1.00 0.00 H new ATOM 0 HA LEU B 20 3.837 13.178 1.973 1.00 0.00 H new ATOM 0 HB2 LEU B 20 5.516 14.883 0.107 1.00 0.00 H new ATOM 0 HB3 LEU B 20 6.015 14.330 1.693 1.00 0.00 H new ATOM 0 HG LEU B 20 5.372 12.544 -0.676 1.00 0.00 H new ATOM 0 HD11 LEU B 20 7.794 12.076 -0.676 1.00 0.00 H new ATOM 0 HD12 LEU B 20 7.455 13.798 -0.974 1.00 0.00 H new ATOM 0 HD13 LEU B 20 8.019 13.266 0.628 1.00 0.00 H new ATOM 0 HD21 LEU B 20 6.274 10.729 0.726 1.00 0.00 H new ATOM 0 HD22 LEU B 20 6.443 11.867 2.084 1.00 0.00 H new ATOM 0 HD23 LEU B 20 4.827 11.467 1.453 1.00 0.00 H new ATOM 1646 N ASN B 21 3.171 16.285 1.126 1.00 0.00 N ATOM 1647 CA ASN B 21 2.672 17.563 1.625 1.00 0.00 C ATOM 1648 C ASN B 21 1.408 17.366 2.464 1.00 0.00 C ATOM 1649 O ASN B 21 1.216 18.034 3.482 1.00 0.00 O ATOM 1650 CB ASN B 21 2.398 18.508 0.448 1.00 0.00 C ATOM 1651 CG ASN B 21 1.625 19.751 0.848 1.00 0.00 C ATOM 1652 OD1 ASN B 21 2.205 20.740 1.299 1.00 0.00 O ATOM 1653 ND2 ASN B 21 0.313 19.719 0.658 1.00 0.00 N ATOM 0 H ASN B 21 3.218 16.224 0.109 1.00 0.00 H new ATOM 0 HA ASN B 21 3.432 18.008 2.267 1.00 0.00 H new ATOM 0 HB2 ASN B 21 3.346 18.806 0.001 1.00 0.00 H new ATOM 0 HB3 ASN B 21 1.839 17.971 -0.318 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -0.256 20.534 0.888 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -0.128 18.879 0.282 1.00 0.00 H new ATOM 1660 N VAL B 22 0.554 16.442 2.034 1.00 0.00 N ATOM 1661 CA VAL B 22 -0.657 16.107 2.773 1.00 0.00 C ATOM 1662 C VAL B 22 -0.316 15.421 4.096 1.00 0.00 C ATOM 1663 O VAL B 22 -0.941 15.686 5.127 1.00 0.00 O ATOM 1664 CB VAL B 22 -1.585 15.194 1.942 1.00 0.00 C ATOM 1665 CG1 VAL B 22 -2.736 14.668 2.787 1.00 0.00 C ATOM 1666 CG2 VAL B 22 -2.115 15.941 0.729 1.00 0.00 C ATOM 0 H VAL B 22 0.680 15.910 1.173 1.00 0.00 H new ATOM 0 HA VAL B 22 -1.179 17.041 2.980 1.00 0.00 H new ATOM 0 HB VAL B 22 -1.001 14.340 1.600 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -3.373 14.028 2.176 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -2.340 14.093 3.624 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -3.321 15.506 3.167 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -2.767 15.284 0.154 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -2.678 16.815 1.057 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -1.280 16.261 0.105 1.00 0.00 H new ATOM 1676 N LEU B 23 0.681 14.549 4.065 1.00 0.00 N ATOM 1677 CA LEU B 23 1.130 13.871 5.273 1.00 0.00 C ATOM 1678 C LEU B 23 1.707 14.871 6.266 1.00 0.00 C ATOM 1679 O LEU B 23 1.466 14.767 7.466 1.00 0.00 O ATOM 1680 CB LEU B 23 2.162 12.786 4.943 1.00 0.00 C ATOM 1681 CG LEU B 23 1.587 11.384 4.698 1.00 0.00 C ATOM 1682 CD1 LEU B 23 0.909 10.861 5.955 1.00 0.00 C ATOM 1683 CD2 LEU B 23 0.608 11.389 3.534 1.00 0.00 C ATOM 0 H LEU B 23 1.193 14.295 3.220 1.00 0.00 H new ATOM 0 HA LEU B 23 0.266 13.389 5.730 1.00 0.00 H new ATOM 0 HB2 LEU B 23 2.716 13.093 4.056 1.00 0.00 H new ATOM 0 HB3 LEU B 23 2.878 12.728 5.762 1.00 0.00 H new ATOM 0 HG LEU B 23 2.414 10.721 4.443 1.00 0.00 H new ATOM 0 HD11 LEU B 23 0.507 9.866 5.764 1.00 0.00 H new ATOM 0 HD12 LEU B 23 1.636 10.809 6.766 1.00 0.00 H new ATOM 0 HD13 LEU B 23 0.098 11.532 6.237 1.00 0.00 H new ATOM 0 HD21 LEU B 23 0.217 10.383 3.383 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -0.215 12.069 3.754 1.00 0.00 H new ATOM 0 HD23 LEU B 23 1.120 11.718 2.630 1.00 0.00 H new ATOM 1695 N GLU B 24 2.445 15.849 5.759 1.00 0.00 N ATOM 1696 CA GLU B 24 3.002 16.899 6.605 1.00 0.00 C ATOM 1697 C GLU B 24 1.905 17.836 7.109 1.00 0.00 C ATOM 1698 O GLU B 24 2.060 18.479 8.145 1.00 0.00 O ATOM 1699 CB GLU B 24 4.064 17.698 5.853 1.00 0.00 C ATOM 1700 CG GLU B 24 5.269 16.873 5.438 1.00 0.00 C ATOM 1701 CD GLU B 24 6.383 17.727 4.871 1.00 0.00 C ATOM 1702 OE1 GLU B 24 6.264 18.177 3.714 1.00 0.00 O ATOM 1703 OE2 GLU B 24 7.380 17.966 5.588 1.00 0.00 O ATOM 0 H GLU B 24 2.672 15.938 4.769 1.00 0.00 H new ATOM 0 HA GLU B 24 3.469 16.417 7.464 1.00 0.00 H new ATOM 0 HB2 GLU B 24 3.613 18.138 4.964 1.00 0.00 H new ATOM 0 HB3 GLU B 24 4.399 18.523 6.482 1.00 0.00 H new ATOM 0 HG2 GLU B 24 5.642 16.319 6.300 1.00 0.00 H new ATOM 0 HG3 GLU B 24 4.964 16.137 4.694 1.00 0.00 H new ATOM 1710 N LYS B 25 0.802 17.905 6.370 1.00 0.00 N ATOM 1711 CA LYS B 25 -0.341 18.730 6.757 1.00 0.00 C ATOM 1712 C LYS B 25 -0.885 18.276 8.108 1.00 0.00 C ATOM 1713 O LYS B 25 -1.088 19.082 9.016 1.00 0.00 O ATOM 1714 CB LYS B 25 -1.446 18.638 5.699 1.00 0.00 C ATOM 1715 CG LYS B 25 -2.652 19.523 5.987 1.00 0.00 C ATOM 1716 CD LYS B 25 -3.824 19.218 5.059 1.00 0.00 C ATOM 1717 CE LYS B 25 -3.447 19.366 3.592 1.00 0.00 C ATOM 1718 NZ LYS B 25 -4.625 19.208 2.696 1.00 0.00 N ATOM 0 H LYS B 25 0.674 17.397 5.495 1.00 0.00 H new ATOM 0 HA LYS B 25 -0.009 19.765 6.835 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -1.030 18.911 4.729 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -1.778 17.602 5.623 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -2.964 19.384 7.022 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -2.367 20.569 5.878 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -4.176 18.203 5.242 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -4.652 19.888 5.289 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -2.997 20.345 3.430 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -2.693 18.622 3.334 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -4.328 18.752 1.810 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -5.342 18.619 3.166 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -5.029 20.143 2.486 1.00 0.00 H new ATOM 1732 N HIS B 26 -1.104 16.976 8.233 1.00 0.00 N ATOM 1733 CA HIS B 26 -1.645 16.407 9.463 1.00 0.00 C ATOM 1734 C HIS B 26 -0.539 16.002 10.422 1.00 0.00 C ATOM 1735 O HIS B 26 -0.736 16.002 11.636 1.00 0.00 O ATOM 1736 CB HIS B 26 -2.502 15.176 9.160 1.00 0.00 C ATOM 1737 CG HIS B 26 -3.882 15.485 8.683 1.00 0.00 C ATOM 1738 ND1 HIS B 26 -5.003 15.274 9.453 1.00 0.00 N ATOM 1739 CD2 HIS B 26 -4.325 15.965 7.499 1.00 0.00 C ATOM 1740 CE1 HIS B 26 -6.076 15.610 8.765 1.00 0.00 C ATOM 1741 NE2 HIS B 26 -5.692 16.031 7.576 1.00 0.00 N ATOM 0 H HIS B 26 -0.916 16.293 7.499 1.00 0.00 H new ATOM 0 HA HIS B 26 -2.257 17.180 9.928 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -1.997 14.574 8.405 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -2.571 14.566 10.061 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -3.716 16.244 6.652 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -7.096 15.551 9.115 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -6.312 16.354 6.833 1.00 0.00 H new ATOM 1750 N LYS B 27 0.617 15.661 9.864 1.00 0.00 N ATOM 1751 CA LYS B 27 1.707 15.057 10.620 1.00 0.00 C ATOM 1752 C LYS B 27 1.262 13.718 11.191 1.00 0.00 C ATOM 1753 O LYS B 27 0.786 13.629 12.322 1.00 0.00 O ATOM 1754 CB LYS B 27 2.220 15.980 11.731 1.00 0.00 C ATOM 1755 CG LYS B 27 2.942 17.210 11.211 1.00 0.00 C ATOM 1756 CD LYS B 27 4.044 16.827 10.235 1.00 0.00 C ATOM 1757 CE LYS B 27 4.941 18.006 9.909 1.00 0.00 C ATOM 1758 NZ LYS B 27 5.692 18.469 11.103 1.00 0.00 N ATOM 0 H LYS B 27 0.825 15.796 8.874 1.00 0.00 H new ATOM 0 HA LYS B 27 2.539 14.896 9.935 1.00 0.00 H new ATOM 0 HB2 LYS B 27 1.378 16.296 12.348 1.00 0.00 H new ATOM 0 HB3 LYS B 27 2.895 15.418 12.377 1.00 0.00 H new ATOM 0 HG2 LYS B 27 2.230 17.872 10.719 1.00 0.00 H new ATOM 0 HG3 LYS B 27 3.369 17.765 12.046 1.00 0.00 H new ATOM 0 HD2 LYS B 27 4.642 16.021 10.660 1.00 0.00 H new ATOM 0 HD3 LYS B 27 3.599 16.443 9.317 1.00 0.00 H new ATOM 0 HE2 LYS B 27 5.643 17.724 9.124 1.00 0.00 H new ATOM 0 HE3 LYS B 27 4.338 18.825 9.518 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 6.509 19.037 10.801 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 5.070 19.049 11.701 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 6.024 17.646 11.645 1.00 0.00 H new ATOM 1772 N ALA B 28 1.393 12.683 10.380 1.00 0.00 N ATOM 1773 CA ALA B 28 0.916 11.362 10.746 1.00 0.00 C ATOM 1774 C ALA B 28 2.076 10.401 10.962 1.00 0.00 C ATOM 1775 O ALA B 28 2.941 10.258 10.098 1.00 0.00 O ATOM 1776 CB ALA B 28 -0.021 10.830 9.674 1.00 0.00 C ATOM 0 H ALA B 28 1.828 12.733 9.459 1.00 0.00 H new ATOM 0 HA ALA B 28 0.369 11.444 11.685 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -0.373 9.838 9.958 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -0.873 11.502 9.570 1.00 0.00 H new ATOM 0 HB3 ALA B 28 0.510 10.768 8.724 1.00 0.00 H new ATOM 1782 N PRO B 29 2.113 9.743 12.131 1.00 0.00 N ATOM 1783 CA PRO B 29 3.131 8.738 12.445 1.00 0.00 C ATOM 1784 C PRO B 29 3.023 7.517 11.537 1.00 0.00 C ATOM 1785 O PRO B 29 2.038 7.358 10.809 1.00 0.00 O ATOM 1786 CB PRO B 29 2.832 8.352 13.903 1.00 0.00 C ATOM 1787 CG PRO B 29 1.959 9.441 14.426 1.00 0.00 C ATOM 1788 CD PRO B 29 1.179 9.942 13.247 1.00 0.00 C ATOM 0 HA PRO B 29 4.141 9.122 12.299 1.00 0.00 H new ATOM 0 HB2 PRO B 29 2.332 7.385 13.959 1.00 0.00 H new ATOM 0 HB3 PRO B 29 3.750 8.270 14.485 1.00 0.00 H new ATOM 0 HG2 PRO B 29 1.294 9.069 15.205 1.00 0.00 H new ATOM 0 HG3 PRO B 29 2.554 10.240 14.869 1.00 0.00 H new ATOM 0 HD2 PRO B 29 0.255 9.382 13.106 1.00 0.00 H new ATOM 0 HD3 PRO B 29 0.902 10.990 13.361 1.00 0.00 H new ATOM 1796 N THR B 30 4.026 6.654 11.592 1.00 0.00 N ATOM 1797 CA THR B 30 4.070 5.464 10.752 1.00 0.00 C ATOM 1798 C THR B 30 2.858 4.571 11.012 1.00 0.00 C ATOM 1799 O THR B 30 2.227 4.075 10.079 1.00 0.00 O ATOM 1800 CB THR B 30 5.361 4.666 11.008 1.00 0.00 C ATOM 1801 OG1 THR B 30 6.476 5.567 11.089 1.00 0.00 O ATOM 1802 CG2 THR B 30 5.603 3.654 9.897 1.00 0.00 C ATOM 0 H THR B 30 4.827 6.756 12.215 1.00 0.00 H new ATOM 0 HA THR B 30 4.053 5.790 9.712 1.00 0.00 H new ATOM 0 HB THR B 30 5.253 4.127 11.949 1.00 0.00 H new ATOM 0 HG1 THR B 30 7.155 5.194 11.689 1.00 0.00 H new ATOM 0 HG21 THR B 30 6.521 3.103 10.101 1.00 0.00 H new ATOM 0 HG22 THR B 30 4.765 2.959 9.849 1.00 0.00 H new ATOM 0 HG23 THR B 30 5.697 4.175 8.944 1.00 0.00 H new ATOM 1810 N ASP B 31 2.533 4.393 12.285 1.00 0.00 N ATOM 1811 CA ASP B 31 1.372 3.608 12.691 1.00 0.00 C ATOM 1812 C ASP B 31 0.092 4.117 12.026 1.00 0.00 C ATOM 1813 O ASP B 31 -0.649 3.346 11.414 1.00 0.00 O ATOM 1814 CB ASP B 31 1.227 3.647 14.214 1.00 0.00 C ATOM 1815 CG ASP B 31 -0.075 3.044 14.694 1.00 0.00 C ATOM 1816 OD1 ASP B 31 -0.308 1.842 14.453 1.00 0.00 O ATOM 1817 OD2 ASP B 31 -0.864 3.772 15.328 1.00 0.00 O ATOM 0 H ASP B 31 3.063 4.786 13.063 1.00 0.00 H new ATOM 0 HA ASP B 31 1.528 2.579 12.367 1.00 0.00 H new ATOM 0 HB2 ASP B 31 2.060 3.110 14.668 1.00 0.00 H new ATOM 0 HB3 ASP B 31 1.291 4.681 14.554 1.00 0.00 H new ATOM 1822 N LEU B 32 -0.149 5.419 12.127 1.00 0.00 N ATOM 1823 CA LEU B 32 -1.351 6.017 11.560 1.00 0.00 C ATOM 1824 C LEU B 32 -1.346 5.924 10.037 1.00 0.00 C ATOM 1825 O LEU B 32 -2.337 5.514 9.433 1.00 0.00 O ATOM 1826 CB LEU B 32 -1.490 7.481 11.998 1.00 0.00 C ATOM 1827 CG LEU B 32 -2.681 8.237 11.395 1.00 0.00 C ATOM 1828 CD1 LEU B 32 -3.996 7.565 11.762 1.00 0.00 C ATOM 1829 CD2 LEU B 32 -2.679 9.685 11.857 1.00 0.00 C ATOM 0 H LEU B 32 0.471 6.080 12.596 1.00 0.00 H new ATOM 0 HA LEU B 32 -2.207 5.457 11.936 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -1.574 7.511 13.084 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -0.574 8.010 11.734 1.00 0.00 H new ATOM 0 HG LEU B 32 -2.581 8.216 10.310 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -4.824 8.121 11.322 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -4.001 6.544 11.381 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -4.106 7.548 12.846 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -3.530 10.207 11.420 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -2.750 9.720 12.944 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -1.755 10.167 11.538 1.00 0.00 H new ATOM 1841 N SER B 33 -0.226 6.284 9.424 1.00 0.00 N ATOM 1842 CA SER B 33 -0.134 6.308 7.970 1.00 0.00 C ATOM 1843 C SER B 33 -0.346 4.918 7.372 1.00 0.00 C ATOM 1844 O SER B 33 -1.130 4.760 6.440 1.00 0.00 O ATOM 1845 CB SER B 33 1.209 6.897 7.526 1.00 0.00 C ATOM 1846 OG SER B 33 2.281 6.339 8.260 1.00 0.00 O ATOM 0 H SER B 33 0.628 6.562 9.908 1.00 0.00 H new ATOM 0 HA SER B 33 -0.932 6.949 7.595 1.00 0.00 H new ATOM 0 HB2 SER B 33 1.357 6.710 6.462 1.00 0.00 H new ATOM 0 HB3 SER B 33 1.197 7.979 7.661 1.00 0.00 H new ATOM 0 HG SER B 33 2.338 6.773 9.137 1.00 0.00 H new ATOM 1852 N LEU B 34 0.330 3.911 7.925 1.00 0.00 N ATOM 1853 CA LEU B 34 0.192 2.539 7.435 1.00 0.00 C ATOM 1854 C LEU B 34 -1.243 2.041 7.592 1.00 0.00 C ATOM 1855 O LEU B 34 -1.754 1.324 6.732 1.00 0.00 O ATOM 1856 CB LEU B 34 1.154 1.594 8.163 1.00 0.00 C ATOM 1857 CG LEU B 34 2.641 1.828 7.884 1.00 0.00 C ATOM 1858 CD1 LEU B 34 3.487 0.835 8.665 1.00 0.00 C ATOM 1859 CD2 LEU B 34 2.936 1.721 6.394 1.00 0.00 C ATOM 0 H LEU B 34 0.975 4.018 8.708 1.00 0.00 H new ATOM 0 HA LEU B 34 0.445 2.545 6.375 1.00 0.00 H new ATOM 0 HB2 LEU B 34 0.984 1.686 9.236 1.00 0.00 H new ATOM 0 HB3 LEU B 34 0.907 0.569 7.888 1.00 0.00 H new ATOM 0 HG LEU B 34 2.896 2.837 8.209 1.00 0.00 H new ATOM 0 HD11 LEU B 34 4.542 1.013 8.457 1.00 0.00 H new ATOM 0 HD12 LEU B 34 3.302 0.959 9.732 1.00 0.00 H new ATOM 0 HD13 LEU B 34 3.225 -0.180 8.367 1.00 0.00 H new ATOM 0 HD21 LEU B 34 3.999 1.891 6.220 1.00 0.00 H new ATOM 0 HD22 LEU B 34 2.665 0.726 6.040 1.00 0.00 H new ATOM 0 HD23 LEU B 34 2.356 2.469 5.854 1.00 0.00 H new ATOM 1871 N MET B 35 -1.891 2.434 8.684 1.00 0.00 N ATOM 1872 CA MET B 35 -3.279 2.047 8.930 1.00 0.00 C ATOM 1873 C MET B 35 -4.196 2.641 7.863 1.00 0.00 C ATOM 1874 O MET B 35 -5.067 1.955 7.323 1.00 0.00 O ATOM 1875 CB MET B 35 -3.720 2.494 10.330 1.00 0.00 C ATOM 1876 CG MET B 35 -5.142 2.082 10.694 1.00 0.00 C ATOM 1877 SD MET B 35 -5.603 2.567 12.374 1.00 0.00 S ATOM 1878 CE MET B 35 -5.360 4.338 12.285 1.00 0.00 C ATOM 0 H MET B 35 -1.480 3.019 9.412 1.00 0.00 H new ATOM 0 HA MET B 35 -3.350 0.961 8.878 1.00 0.00 H new ATOM 0 HB2 MET B 35 -3.032 2.078 11.066 1.00 0.00 H new ATOM 0 HB3 MET B 35 -3.639 3.579 10.396 1.00 0.00 H new ATOM 0 HG2 MET B 35 -5.838 2.532 9.987 1.00 0.00 H new ATOM 0 HG3 MET B 35 -5.239 1.001 10.593 1.00 0.00 H new ATOM 0 HE1 MET B 35 -5.933 4.824 13.074 1.00 0.00 H new ATOM 0 HE2 MET B 35 -4.302 4.567 12.411 1.00 0.00 H new ATOM 0 HE3 MET B 35 -5.697 4.703 11.315 1.00 0.00 H new ATOM 1888 N VAL B 36 -3.978 3.912 7.545 1.00 0.00 N ATOM 1889 CA VAL B 36 -4.760 4.588 6.518 1.00 0.00 C ATOM 1890 C VAL B 36 -4.443 4.013 5.140 1.00 0.00 C ATOM 1891 O VAL B 36 -5.348 3.721 4.360 1.00 0.00 O ATOM 1892 CB VAL B 36 -4.498 6.111 6.510 1.00 0.00 C ATOM 1893 CG1 VAL B 36 -5.319 6.800 5.429 1.00 0.00 C ATOM 1894 CG2 VAL B 36 -4.804 6.714 7.872 1.00 0.00 C ATOM 0 H VAL B 36 -3.266 4.495 7.984 1.00 0.00 H new ATOM 0 HA VAL B 36 -5.812 4.421 6.752 1.00 0.00 H new ATOM 0 HB VAL B 36 -3.442 6.269 6.289 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -5.116 7.871 5.445 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -5.050 6.394 4.454 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -6.380 6.629 5.613 1.00 0.00 H new ATOM 0 HG21 VAL B 36 -4.613 7.787 7.846 1.00 0.00 H new ATOM 0 HG22 VAL B 36 -5.850 6.537 8.121 1.00 0.00 H new ATOM 0 HG23 VAL B 36 -4.168 6.251 8.626 1.00 0.00 H new ATOM 1904 N LEU B 37 -3.155 3.834 4.856 1.00 0.00 N ATOM 1905 CA LEU B 37 -2.718 3.295 3.571 1.00 0.00 C ATOM 1906 C LEU B 37 -3.274 1.893 3.348 1.00 0.00 C ATOM 1907 O LEU B 37 -3.698 1.558 2.244 1.00 0.00 O ATOM 1908 CB LEU B 37 -1.189 3.270 3.483 1.00 0.00 C ATOM 1909 CG LEU B 37 -0.509 4.643 3.480 1.00 0.00 C ATOM 1910 CD1 LEU B 37 1.004 4.488 3.448 1.00 0.00 C ATOM 1911 CD2 LEU B 37 -0.987 5.476 2.298 1.00 0.00 C ATOM 0 H LEU B 37 -2.395 4.055 5.500 1.00 0.00 H new ATOM 0 HA LEU B 37 -3.104 3.950 2.790 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -0.803 2.694 4.324 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -0.903 2.739 2.575 1.00 0.00 H new ATOM 0 HG LEU B 37 -0.782 5.164 4.398 1.00 0.00 H new ATOM 0 HD11 LEU B 37 1.471 5.473 3.446 1.00 0.00 H new ATOM 0 HD12 LEU B 37 1.332 3.933 4.327 1.00 0.00 H new ATOM 0 HD13 LEU B 37 1.295 3.947 2.548 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -0.493 6.447 2.314 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -0.745 4.961 1.368 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -2.066 5.617 2.365 1.00 0.00 H new ATOM 1923 N GLY B 38 -3.270 1.080 4.400 1.00 0.00 N ATOM 1924 CA GLY B 38 -3.824 -0.260 4.310 1.00 0.00 C ATOM 1925 C GLY B 38 -5.279 -0.244 3.881 1.00 0.00 C ATOM 1926 O GLY B 38 -5.683 -0.994 2.990 1.00 0.00 O ATOM 0 H GLY B 38 -2.892 1.325 5.315 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -3.242 -0.846 3.598 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -3.736 -0.755 5.277 1.00 0.00 H new ATOM 1930 N ASN B 39 -6.060 0.624 4.512 1.00 0.00 N ATOM 1931 CA ASN B 39 -7.468 0.792 4.166 1.00 0.00 C ATOM 1932 C ASN B 39 -7.598 1.334 2.744 1.00 0.00 C ATOM 1933 O ASN B 39 -8.390 0.832 1.941 1.00 0.00 O ATOM 1934 CB ASN B 39 -8.138 1.749 5.160 1.00 0.00 C ATOM 1935 CG ASN B 39 -9.634 1.886 4.942 1.00 0.00 C ATOM 1936 OD1 ASN B 39 -10.088 2.717 4.158 1.00 0.00 O ATOM 1937 ND2 ASN B 39 -10.412 1.085 5.656 1.00 0.00 N ATOM 0 H ASN B 39 -5.741 1.226 5.271 1.00 0.00 H new ATOM 0 HA ASN B 39 -7.965 -0.177 4.218 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -7.956 1.395 6.175 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -7.674 2.732 5.078 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -11.426 1.145 5.565 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -9.997 0.408 6.296 1.00 0.00 H new ATOM 1944 N MET B 40 -6.786 2.343 2.446 1.00 0.00 N ATOM 1945 CA MET B 40 -6.787 3.006 1.146 1.00 0.00 C ATOM 1946 C MET B 40 -6.523 2.021 0.010 1.00 0.00 C ATOM 1947 O MET B 40 -7.325 1.906 -0.915 1.00 0.00 O ATOM 1948 CB MET B 40 -5.725 4.110 1.127 1.00 0.00 C ATOM 1949 CG MET B 40 -5.636 4.860 -0.191 1.00 0.00 C ATOM 1950 SD MET B 40 -4.313 6.083 -0.193 1.00 0.00 S ATOM 1951 CE MET B 40 -4.484 6.769 -1.834 1.00 0.00 C ATOM 0 H MET B 40 -6.105 2.726 3.102 1.00 0.00 H new ATOM 0 HA MET B 40 -7.776 3.438 0.993 1.00 0.00 H new ATOM 0 HB2 MET B 40 -5.941 4.821 1.924 1.00 0.00 H new ATOM 0 HB3 MET B 40 -4.753 3.669 1.348 1.00 0.00 H new ATOM 0 HG2 MET B 40 -5.472 4.149 -1.001 1.00 0.00 H new ATOM 0 HG3 MET B 40 -6.586 5.356 -0.390 1.00 0.00 H new ATOM 0 HE1 MET B 40 -3.550 7.247 -2.128 1.00 0.00 H new ATOM 0 HE2 MET B 40 -4.721 5.972 -2.539 1.00 0.00 H new ATOM 0 HE3 MET B 40 -5.286 7.507 -1.838 1.00 0.00 H new ATOM 1961 N VAL B 41 -5.402 1.313 0.092 1.00 0.00 N ATOM 1962 CA VAL B 41 -4.993 0.388 -0.960 1.00 0.00 C ATOM 1963 C VAL B 41 -6.042 -0.701 -1.178 1.00 0.00 C ATOM 1964 O VAL B 41 -6.441 -0.966 -2.313 1.00 0.00 O ATOM 1965 CB VAL B 41 -3.624 -0.256 -0.641 1.00 0.00 C ATOM 1966 CG1 VAL B 41 -3.243 -1.284 -1.696 1.00 0.00 C ATOM 1967 CG2 VAL B 41 -2.545 0.812 -0.534 1.00 0.00 C ATOM 0 H VAL B 41 -4.757 1.362 0.880 1.00 0.00 H new ATOM 0 HA VAL B 41 -4.898 0.968 -1.878 1.00 0.00 H new ATOM 0 HB VAL B 41 -3.709 -0.768 0.318 1.00 0.00 H new ATOM 0 HG11 VAL B 41 -2.276 -1.721 -1.446 1.00 0.00 H new ATOM 0 HG12 VAL B 41 -3.998 -2.069 -1.728 1.00 0.00 H new ATOM 0 HG13 VAL B 41 -3.181 -0.800 -2.670 1.00 0.00 H new ATOM 0 HG21 VAL B 41 -1.588 0.341 -0.309 1.00 0.00 H new ATOM 0 HG22 VAL B 41 -2.471 1.351 -1.479 1.00 0.00 H new ATOM 0 HG23 VAL B 41 -2.802 1.510 0.263 1.00 0.00 H new ATOM 1977 N THR B 42 -6.506 -1.304 -0.086 1.00 0.00 N ATOM 1978 CA THR B 42 -7.492 -2.375 -0.161 1.00 0.00 C ATOM 1979 C THR B 42 -8.764 -1.902 -0.868 1.00 0.00 C ATOM 1980 O THR B 42 -9.286 -2.582 -1.757 1.00 0.00 O ATOM 1981 CB THR B 42 -7.850 -2.894 1.247 1.00 0.00 C ATOM 1982 OG1 THR B 42 -6.657 -3.261 1.950 1.00 0.00 O ATOM 1983 CG2 THR B 42 -8.783 -4.096 1.166 1.00 0.00 C ATOM 0 H THR B 42 -6.213 -1.067 0.862 1.00 0.00 H new ATOM 0 HA THR B 42 -7.048 -3.187 -0.737 1.00 0.00 H new ATOM 0 HB THR B 42 -8.361 -2.094 1.783 1.00 0.00 H new ATOM 0 HG1 THR B 42 -6.343 -2.500 2.482 1.00 0.00 H new ATOM 0 HG21 THR B 42 -9.019 -4.442 2.172 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.702 -3.809 0.656 1.00 0.00 H new ATOM 0 HG23 THR B 42 -8.296 -4.898 0.612 1.00 0.00 H new ATOM 1991 N ASN B 43 -9.239 -0.720 -0.489 1.00 0.00 N ATOM 1992 CA ASN B 43 -10.467 -0.174 -1.052 1.00 0.00 C ATOM 1993 C ASN B 43 -10.264 0.236 -2.509 1.00 0.00 C ATOM 1994 O ASN B 43 -11.057 -0.127 -3.381 1.00 0.00 O ATOM 1995 CB ASN B 43 -10.940 1.028 -0.228 1.00 0.00 C ATOM 1996 CG ASN B 43 -12.256 1.594 -0.728 1.00 0.00 C ATOM 1997 OD1 ASN B 43 -12.285 2.490 -1.570 1.00 0.00 O ATOM 1998 ND2 ASN B 43 -13.358 1.076 -0.204 1.00 0.00 N ATOM 0 H ASN B 43 -8.791 -0.122 0.206 1.00 0.00 H new ATOM 0 HA ASN B 43 -11.231 -0.951 -1.018 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -11.050 0.729 0.815 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -10.178 1.807 -0.258 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -14.272 1.420 -0.497 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -13.291 0.334 0.492 1.00 0.00 H new ATOM 2005 N LEU B 44 -9.185 0.968 -2.762 1.00 0.00 N ATOM 2006 CA LEU B 44 -8.905 1.507 -4.091 1.00 0.00 C ATOM 2007 C LEU B 44 -8.783 0.399 -5.132 1.00 0.00 C ATOM 2008 O LEU B 44 -9.355 0.494 -6.217 1.00 0.00 O ATOM 2009 CB LEU B 44 -7.619 2.337 -4.062 1.00 0.00 C ATOM 2010 CG LEU B 44 -7.248 3.017 -5.383 1.00 0.00 C ATOM 2011 CD1 LEU B 44 -8.319 4.016 -5.796 1.00 0.00 C ATOM 2012 CD2 LEU B 44 -5.895 3.702 -5.266 1.00 0.00 C ATOM 0 H LEU B 44 -8.484 1.204 -2.060 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.743 2.144 -4.374 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.718 3.103 -3.293 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.795 1.690 -3.762 1.00 0.00 H new ATOM 0 HG LEU B 44 -7.183 2.251 -6.155 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -8.034 4.487 -6.737 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -9.270 3.498 -5.922 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -8.421 4.779 -5.025 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -5.646 4.180 -6.213 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -5.935 4.455 -4.479 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -5.133 2.962 -5.022 1.00 0.00 H new ATOM 2024 N ILE B 45 -8.044 -0.651 -4.801 1.00 0.00 N ATOM 2025 CA ILE B 45 -7.814 -1.743 -5.738 1.00 0.00 C ATOM 2026 C ILE B 45 -9.111 -2.477 -6.063 1.00 0.00 C ATOM 2027 O ILE B 45 -9.468 -2.628 -7.232 1.00 0.00 O ATOM 2028 CB ILE B 45 -6.770 -2.751 -5.195 1.00 0.00 C ATOM 2029 CG1 ILE B 45 -5.401 -2.079 -5.065 1.00 0.00 C ATOM 2030 CG2 ILE B 45 -6.676 -3.974 -6.097 1.00 0.00 C ATOM 2031 CD1 ILE B 45 -4.318 -3.001 -4.546 1.00 0.00 C ATOM 0 H ILE B 45 -7.594 -0.770 -3.893 1.00 0.00 H new ATOM 0 HA ILE B 45 -7.423 -1.295 -6.652 1.00 0.00 H new ATOM 0 HB ILE B 45 -7.095 -3.080 -4.208 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -5.101 -1.693 -6.039 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -5.488 -1.223 -4.396 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -5.937 -4.667 -5.695 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -7.647 -4.467 -6.144 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -6.377 -3.665 -7.099 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -3.377 -2.456 -4.480 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -4.595 -3.367 -3.557 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -4.202 -3.845 -5.226 1.00 0.00 H new ATOM 2043 N ASN B 46 -9.830 -2.894 -5.028 1.00 0.00 N ATOM 2044 CA ASN B 46 -11.012 -3.741 -5.194 1.00 0.00 C ATOM 2045 C ASN B 46 -12.118 -3.033 -5.978 1.00 0.00 C ATOM 2046 O ASN B 46 -12.837 -3.657 -6.757 1.00 0.00 O ATOM 2047 CB ASN B 46 -11.535 -4.184 -3.823 1.00 0.00 C ATOM 2048 CG ASN B 46 -12.641 -5.221 -3.915 1.00 0.00 C ATOM 2049 OD1 ASN B 46 -12.753 -5.945 -4.905 1.00 0.00 O ATOM 2050 ND2 ASN B 46 -13.446 -5.316 -2.869 1.00 0.00 N ATOM 0 H ASN B 46 -9.616 -2.660 -4.059 1.00 0.00 H new ATOM 0 HA ASN B 46 -10.713 -4.617 -5.770 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -10.709 -4.593 -3.240 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -11.906 -3.313 -3.283 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -14.194 -6.009 -2.863 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -13.318 -4.696 -2.069 1.00 0.00 H new ATOM 2057 N THR B 47 -12.242 -1.729 -5.791 1.00 0.00 N ATOM 2058 CA THR B 47 -13.284 -0.976 -6.472 1.00 0.00 C ATOM 2059 C THR B 47 -12.859 -0.621 -7.901 1.00 0.00 C ATOM 2060 O THR B 47 -13.692 -0.267 -8.737 1.00 0.00 O ATOM 2061 CB THR B 47 -13.659 0.312 -5.696 1.00 0.00 C ATOM 2062 OG1 THR B 47 -14.868 0.876 -6.225 1.00 0.00 O ATOM 2063 CG2 THR B 47 -12.546 1.351 -5.770 1.00 0.00 C ATOM 0 H THR B 47 -11.642 -1.174 -5.181 1.00 0.00 H new ATOM 0 HA THR B 47 -14.166 -1.616 -6.515 1.00 0.00 H new ATOM 0 HB THR B 47 -13.806 0.035 -4.652 1.00 0.00 H new ATOM 0 HG1 THR B 47 -14.982 0.591 -7.156 1.00 0.00 H new ATOM 0 HG21 THR B 47 -12.842 2.241 -5.215 1.00 0.00 H new ATOM 0 HG22 THR B 47 -11.635 0.939 -5.336 1.00 0.00 H new ATOM 0 HG23 THR B 47 -12.364 1.616 -6.812 1.00 0.00 H new ATOM 2071 N SER B 48 -11.568 -0.753 -8.189 1.00 0.00 N ATOM 2072 CA SER B 48 -11.033 -0.327 -9.474 1.00 0.00 C ATOM 2073 C SER B 48 -10.788 -1.518 -10.408 1.00 0.00 C ATOM 2074 O SER B 48 -11.225 -1.507 -11.559 1.00 0.00 O ATOM 2075 CB SER B 48 -9.740 0.461 -9.256 1.00 0.00 C ATOM 2076 OG SER B 48 -9.343 1.143 -10.432 1.00 0.00 O ATOM 0 H SER B 48 -10.877 -1.150 -7.552 1.00 0.00 H new ATOM 0 HA SER B 48 -11.771 0.315 -9.956 1.00 0.00 H new ATOM 0 HB2 SER B 48 -9.882 1.179 -8.448 1.00 0.00 H new ATOM 0 HB3 SER B 48 -8.947 -0.218 -8.943 1.00 0.00 H new ATOM 0 HG SER B 48 -8.960 2.013 -10.192 1.00 0.00 H new ATOM 2082 N ILE B 49 -10.090 -2.537 -9.917 1.00 0.00 N ATOM 2083 CA ILE B 49 -9.762 -3.696 -10.726 1.00 0.00 C ATOM 2084 C ILE B 49 -10.823 -4.782 -10.538 1.00 0.00 C ATOM 2085 O ILE B 49 -11.678 -4.668 -9.661 1.00 0.00 O ATOM 2086 CB ILE B 49 -8.362 -4.243 -10.353 1.00 0.00 C ATOM 2087 CG1 ILE B 49 -7.830 -5.169 -11.443 1.00 0.00 C ATOM 2088 CG2 ILE B 49 -8.405 -4.984 -9.025 1.00 0.00 C ATOM 2089 CD1 ILE B 49 -7.635 -4.488 -12.781 1.00 0.00 C ATOM 0 H ILE B 49 -9.742 -2.580 -8.959 1.00 0.00 H new ATOM 0 HA ILE B 49 -9.744 -3.395 -11.774 1.00 0.00 H new ATOM 0 HB ILE B 49 -7.690 -3.390 -10.258 1.00 0.00 H new ATOM 0 HG12 ILE B 49 -6.878 -5.589 -11.117 1.00 0.00 H new ATOM 0 HG13 ILE B 49 -8.521 -6.003 -11.567 1.00 0.00 H new ATOM 0 HG21 ILE B 49 -7.410 -5.359 -8.785 1.00 0.00 H new ATOM 0 HG22 ILE B 49 -8.736 -4.304 -8.240 1.00 0.00 H new ATOM 0 HG23 ILE B 49 -9.100 -5.821 -9.098 1.00 0.00 H new ATOM 0 HD11 ILE B 49 -7.255 -5.209 -13.504 1.00 0.00 H new ATOM 0 HD12 ILE B 49 -8.589 -4.092 -13.130 1.00 0.00 H new ATOM 0 HD13 ILE B 49 -6.921 -3.672 -12.673 1.00 0.00 H new ATOM 2101 N ALA B 50 -10.783 -5.815 -11.374 1.00 0.00 N ATOM 2102 CA ALA B 50 -11.695 -6.943 -11.246 1.00 0.00 C ATOM 2103 C ALA B 50 -11.544 -7.596 -9.875 1.00 0.00 C ATOM 2104 O ALA B 50 -10.460 -8.068 -9.524 1.00 0.00 O ATOM 2105 CB ALA B 50 -11.440 -7.958 -12.351 1.00 0.00 C ATOM 0 H ALA B 50 -10.125 -5.893 -12.150 1.00 0.00 H new ATOM 0 HA ALA B 50 -12.717 -6.576 -11.343 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -12.129 -8.795 -12.242 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -11.593 -7.486 -13.321 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -10.414 -8.321 -12.282 1.00 0.00 H new ATOM 2111 N PRO B 51 -12.636 -7.634 -9.090 1.00 0.00 N ATOM 2112 CA PRO B 51 -12.626 -8.154 -7.711 1.00 0.00 C ATOM 2113 C PRO B 51 -12.048 -9.563 -7.606 1.00 0.00 C ATOM 2114 O PRO B 51 -11.404 -9.910 -6.616 1.00 0.00 O ATOM 2115 CB PRO B 51 -14.107 -8.158 -7.324 1.00 0.00 C ATOM 2116 CG PRO B 51 -14.722 -7.108 -8.179 1.00 0.00 C ATOM 2117 CD PRO B 51 -13.975 -7.155 -9.482 1.00 0.00 C ATOM 0 HA PRO B 51 -11.995 -7.548 -7.061 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -14.561 -9.132 -7.505 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -14.241 -7.935 -6.265 1.00 0.00 H new ATOM 0 HG2 PRO B 51 -15.785 -7.299 -8.330 1.00 0.00 H new ATOM 0 HG3 PRO B 51 -14.637 -6.126 -7.714 1.00 0.00 H new ATOM 0 HD2 PRO B 51 -14.451 -7.829 -10.194 1.00 0.00 H new ATOM 0 HD3 PRO B 51 -13.929 -6.174 -9.954 1.00 0.00 H new ATOM 2125 N ALA B 52 -12.251 -10.365 -8.638 1.00 0.00 N ATOM 2126 CA ALA B 52 -11.764 -11.738 -8.646 1.00 0.00 C ATOM 2127 C ALA B 52 -10.234 -11.790 -8.639 1.00 0.00 C ATOM 2128 O ALA B 52 -9.641 -12.799 -8.268 1.00 0.00 O ATOM 2129 CB ALA B 52 -12.312 -12.481 -9.853 1.00 0.00 C ATOM 0 H ALA B 52 -12.751 -10.090 -9.484 1.00 0.00 H new ATOM 0 HA ALA B 52 -12.117 -12.224 -7.737 1.00 0.00 H new ATOM 0 HB1 ALA B 52 -11.941 -13.506 -9.848 1.00 0.00 H new ATOM 0 HB2 ALA B 52 -13.401 -12.489 -9.812 1.00 0.00 H new ATOM 0 HB3 ALA B 52 -11.987 -11.982 -10.766 1.00 0.00 H new ATOM 2135 N GLN B 53 -9.600 -10.691 -9.033 1.00 0.00 N ATOM 2136 CA GLN B 53 -8.148 -10.650 -9.153 1.00 0.00 C ATOM 2137 C GLN B 53 -7.519 -9.750 -8.097 1.00 0.00 C ATOM 2138 O GLN B 53 -6.307 -9.542 -8.102 1.00 0.00 O ATOM 2139 CB GLN B 53 -7.752 -10.155 -10.542 1.00 0.00 C ATOM 2140 CG GLN B 53 -8.280 -11.023 -11.669 1.00 0.00 C ATOM 2141 CD GLN B 53 -7.882 -10.514 -13.039 1.00 0.00 C ATOM 2142 OE1 GLN B 53 -7.754 -9.203 -13.178 1.00 0.00 O flip ATOM 2143 NE2 GLN B 53 -7.702 -11.295 -13.968 1.00 0.00 N flip ATOM 0 H GLN B 53 -10.069 -9.818 -9.274 1.00 0.00 H new ATOM 0 HA GLN B 53 -7.778 -11.664 -9.000 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -8.120 -9.138 -10.675 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -6.665 -10.111 -10.607 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -7.909 -12.040 -11.542 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -9.367 -11.070 -11.606 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -7.811 -12.298 -13.819 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -7.444 -10.941 -14.889 1.00 0.00 H new ATOM 2152 N ARG B 54 -8.334 -9.233 -7.182 1.00 0.00 N ATOM 2153 CA ARG B 54 -7.847 -8.289 -6.175 1.00 0.00 C ATOM 2154 C ARG B 54 -6.789 -8.939 -5.278 1.00 0.00 C ATOM 2155 O ARG B 54 -5.871 -8.271 -4.800 1.00 0.00 O ATOM 2156 CB ARG B 54 -9.011 -7.728 -5.341 1.00 0.00 C ATOM 2157 CG ARG B 54 -9.658 -8.724 -4.386 1.00 0.00 C ATOM 2158 CD ARG B 54 -11.068 -8.280 -4.012 1.00 0.00 C ATOM 2159 NE ARG B 54 -11.668 -9.076 -2.935 1.00 0.00 N ATOM 2160 CZ ARG B 54 -11.919 -10.385 -2.994 1.00 0.00 C ATOM 2161 NH1 ARG B 54 -11.644 -11.083 -4.089 1.00 0.00 N ATOM 2162 NH2 ARG B 54 -12.484 -10.984 -1.954 1.00 0.00 N ATOM 0 H ARG B 54 -9.329 -9.449 -7.115 1.00 0.00 H new ATOM 0 HA ARG B 54 -7.375 -7.456 -6.695 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -8.648 -6.878 -4.764 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -9.775 -7.350 -6.020 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -9.694 -9.709 -4.851 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -9.051 -8.818 -3.486 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -11.042 -7.234 -3.708 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -11.705 -8.340 -4.895 1.00 0.00 H new ATOM 0 HE ARG B 54 -11.913 -8.590 -2.072 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -11.235 -10.619 -4.900 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -11.841 -12.083 -4.119 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -12.721 -10.444 -1.122 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -12.681 -11.984 -1.987 1.00 0.00 H new ATOM 2176 N GLN B 55 -6.904 -10.249 -5.087 1.00 0.00 N ATOM 2177 CA GLN B 55 -5.945 -10.990 -4.277 1.00 0.00 C ATOM 2178 C GLN B 55 -4.620 -11.130 -5.023 1.00 0.00 C ATOM 2179 O GLN B 55 -3.545 -10.994 -4.438 1.00 0.00 O ATOM 2180 CB GLN B 55 -6.504 -12.373 -3.924 1.00 0.00 C ATOM 2181 CG GLN B 55 -5.657 -13.149 -2.920 1.00 0.00 C ATOM 2182 CD GLN B 55 -5.668 -12.533 -1.530 1.00 0.00 C ATOM 2183 OE1 GLN B 55 -5.799 -11.321 -1.368 1.00 0.00 O ATOM 2184 NE2 GLN B 55 -5.529 -13.369 -0.513 1.00 0.00 N ATOM 0 H GLN B 55 -7.652 -10.819 -5.482 1.00 0.00 H new ATOM 0 HA GLN B 55 -5.769 -10.439 -3.353 1.00 0.00 H new ATOM 0 HB2 GLN B 55 -7.509 -12.254 -3.520 1.00 0.00 H new ATOM 0 HB3 GLN B 55 -6.595 -12.961 -4.838 1.00 0.00 H new ATOM 0 HG2 GLN B 55 -6.023 -14.174 -2.860 1.00 0.00 H new ATOM 0 HG3 GLN B 55 -4.630 -13.198 -3.281 1.00 0.00 H new ATOM 0 HE21 GLN B 55 -5.423 -14.369 -0.685 1.00 0.00 H new ATOM 0 HE22 GLN B 55 -5.528 -13.013 0.443 1.00 0.00 H new ATOM 2193 N ALA B 56 -4.708 -11.374 -6.328 1.00 0.00 N ATOM 2194 CA ALA B 56 -3.522 -11.538 -7.160 1.00 0.00 C ATOM 2195 C ALA B 56 -2.745 -10.230 -7.257 1.00 0.00 C ATOM 2196 O ALA B 56 -1.513 -10.226 -7.347 1.00 0.00 O ATOM 2197 CB ALA B 56 -3.908 -12.031 -8.548 1.00 0.00 C ATOM 0 H ALA B 56 -5.591 -11.462 -6.832 1.00 0.00 H new ATOM 0 HA ALA B 56 -2.879 -12.284 -6.693 1.00 0.00 H new ATOM 0 HB1 ALA B 56 -3.010 -12.148 -9.155 1.00 0.00 H new ATOM 0 HB2 ALA B 56 -4.417 -12.991 -8.465 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -4.573 -11.307 -9.019 1.00 0.00 H new ATOM 2203 N ILE B 57 -3.471 -9.117 -7.233 1.00 0.00 N ATOM 2204 CA ILE B 57 -2.848 -7.801 -7.230 1.00 0.00 C ATOM 2205 C ILE B 57 -2.046 -7.612 -5.946 1.00 0.00 C ATOM 2206 O ILE B 57 -0.909 -7.135 -5.976 1.00 0.00 O ATOM 2207 CB ILE B 57 -3.898 -6.670 -7.355 1.00 0.00 C ATOM 2208 CG1 ILE B 57 -4.749 -6.857 -8.618 1.00 0.00 C ATOM 2209 CG2 ILE B 57 -3.221 -5.306 -7.367 1.00 0.00 C ATOM 2210 CD1 ILE B 57 -3.953 -6.842 -9.908 1.00 0.00 C ATOM 0 H ILE B 57 -4.491 -9.101 -7.215 1.00 0.00 H new ATOM 0 HA ILE B 57 -2.187 -7.745 -8.095 1.00 0.00 H new ATOM 0 HB ILE B 57 -4.555 -6.720 -6.487 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -5.285 -7.803 -8.545 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -5.500 -6.068 -8.658 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -3.977 -4.525 -7.456 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -2.664 -5.168 -6.440 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -2.537 -5.247 -8.214 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -4.627 -6.980 -10.753 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -3.438 -5.886 -10.007 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -3.220 -7.649 -9.893 1.00 0.00 H new ATOM 2222 N ALA B 58 -2.635 -8.020 -4.824 1.00 0.00 N ATOM 2223 CA ALA B 58 -1.964 -7.947 -3.530 1.00 0.00 C ATOM 2224 C ALA B 58 -0.701 -8.803 -3.519 1.00 0.00 C ATOM 2225 O ALA B 58 0.327 -8.402 -2.967 1.00 0.00 O ATOM 2226 CB ALA B 58 -2.909 -8.385 -2.425 1.00 0.00 C ATOM 0 H ALA B 58 -3.579 -8.406 -4.786 1.00 0.00 H new ATOM 0 HA ALA B 58 -1.671 -6.912 -3.355 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.397 -8.326 -1.464 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -3.781 -7.732 -2.412 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -3.227 -9.412 -2.604 1.00 0.00 H new ATOM 2232 N ASN B 59 -0.784 -9.982 -4.130 1.00 0.00 N ATOM 2233 CA ASN B 59 0.370 -10.871 -4.247 1.00 0.00 C ATOM 2234 C ASN B 59 1.497 -10.175 -5.001 1.00 0.00 C ATOM 2235 O ASN B 59 2.647 -10.164 -4.556 1.00 0.00 O ATOM 2236 CB ASN B 59 -0.010 -12.163 -4.982 1.00 0.00 C ATOM 2237 CG ASN B 59 -1.033 -13.006 -4.240 1.00 0.00 C ATOM 2238 OD1 ASN B 59 -1.869 -13.666 -4.859 1.00 0.00 O ATOM 2239 ND2 ASN B 59 -0.968 -13.012 -2.918 1.00 0.00 N ATOM 0 H ASN B 59 -1.639 -10.345 -4.552 1.00 0.00 H new ATOM 0 HA ASN B 59 0.705 -11.122 -3.241 1.00 0.00 H new ATOM 0 HB2 ASN B 59 -0.405 -11.909 -5.965 1.00 0.00 H new ATOM 0 HB3 ASN B 59 0.889 -12.757 -5.144 1.00 0.00 H new ATOM 0 HD21 ASN B 59 -1.624 -13.576 -2.378 1.00 0.00 H new ATOM 0 HD22 ASN B 59 -0.262 -12.453 -2.440 1.00 0.00 H new ATOM 2246 N SER B 60 1.151 -9.580 -6.135 1.00 0.00 N ATOM 2247 CA SER B 60 2.124 -8.894 -6.975 1.00 0.00 C ATOM 2248 C SER B 60 2.702 -7.673 -6.258 1.00 0.00 C ATOM 2249 O SER B 60 3.905 -7.412 -6.324 1.00 0.00 O ATOM 2250 CB SER B 60 1.459 -8.479 -8.288 1.00 0.00 C ATOM 2251 OG SER B 60 0.814 -9.589 -8.897 1.00 0.00 O ATOM 0 H SER B 60 0.197 -9.559 -6.496 1.00 0.00 H new ATOM 0 HA SER B 60 2.948 -9.575 -7.187 1.00 0.00 H new ATOM 0 HB2 SER B 60 0.733 -7.688 -8.100 1.00 0.00 H new ATOM 0 HB3 SER B 60 2.207 -8.069 -8.967 1.00 0.00 H new ATOM 0 HG SER B 60 -0.027 -9.776 -8.429 1.00 0.00 H new ATOM 2257 N PHE B 61 1.838 -6.938 -5.565 1.00 0.00 N ATOM 2258 CA PHE B 61 2.258 -5.761 -4.812 1.00 0.00 C ATOM 2259 C PHE B 61 3.272 -6.147 -3.737 1.00 0.00 C ATOM 2260 O PHE B 61 4.258 -5.441 -3.519 1.00 0.00 O ATOM 2261 CB PHE B 61 1.043 -5.074 -4.177 1.00 0.00 C ATOM 2262 CG PHE B 61 1.378 -3.816 -3.421 1.00 0.00 C ATOM 2263 CD1 PHE B 61 1.619 -2.629 -4.095 1.00 0.00 C ATOM 2264 CD2 PHE B 61 1.448 -3.821 -2.037 1.00 0.00 C ATOM 2265 CE1 PHE B 61 1.923 -1.472 -3.402 1.00 0.00 C ATOM 2266 CE2 PHE B 61 1.752 -2.667 -1.340 1.00 0.00 C ATOM 2267 CZ PHE B 61 1.991 -1.492 -2.024 1.00 0.00 C ATOM 0 H PHE B 61 0.839 -7.138 -5.509 1.00 0.00 H new ATOM 0 HA PHE B 61 2.734 -5.062 -5.500 1.00 0.00 H new ATOM 0 HB2 PHE B 61 0.323 -4.835 -4.960 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.555 -5.774 -3.499 1.00 0.00 H new ATOM 0 HD1 PHE B 61 1.569 -2.608 -5.174 1.00 0.00 H new ATOM 0 HD2 PHE B 61 1.263 -4.738 -1.497 1.00 0.00 H new ATOM 0 HE1 PHE B 61 2.107 -0.553 -3.939 1.00 0.00 H new ATOM 0 HE2 PHE B 61 1.803 -2.684 -0.261 1.00 0.00 H new ATOM 0 HZ PHE B 61 2.231 -0.590 -1.481 1.00 0.00 H new ATOM 2277 N ALA B 62 3.029 -7.280 -3.085 1.00 0.00 N ATOM 2278 CA ALA B 62 3.928 -7.784 -2.056 1.00 0.00 C ATOM 2279 C ALA B 62 5.318 -8.040 -2.627 1.00 0.00 C ATOM 2280 O ALA B 62 6.325 -7.709 -2.002 1.00 0.00 O ATOM 2281 CB ALA B 62 3.366 -9.058 -1.445 1.00 0.00 C ATOM 0 H ALA B 62 2.213 -7.868 -3.253 1.00 0.00 H new ATOM 0 HA ALA B 62 4.014 -7.027 -1.276 1.00 0.00 H new ATOM 0 HB1 ALA B 62 4.047 -9.425 -0.677 1.00 0.00 H new ATOM 0 HB2 ALA B 62 2.394 -8.849 -0.998 1.00 0.00 H new ATOM 0 HB3 ALA B 62 3.253 -9.815 -2.221 1.00 0.00 H new ATOM 2287 N ARG B 63 5.363 -8.618 -3.824 1.00 0.00 N ATOM 2288 CA ARG B 63 6.630 -8.898 -4.491 1.00 0.00 C ATOM 2289 C ARG B 63 7.375 -7.608 -4.823 1.00 0.00 C ATOM 2290 O ARG B 63 8.574 -7.492 -4.567 1.00 0.00 O ATOM 2291 CB ARG B 63 6.400 -9.718 -5.762 1.00 0.00 C ATOM 2292 CG ARG B 63 6.037 -11.166 -5.491 1.00 0.00 C ATOM 2293 CD ARG B 63 7.162 -11.882 -4.763 1.00 0.00 C ATOM 2294 NE ARG B 63 6.851 -13.287 -4.509 1.00 0.00 N ATOM 2295 CZ ARG B 63 7.774 -14.218 -4.264 1.00 0.00 C ATOM 2296 NH1 ARG B 63 9.060 -13.883 -4.216 1.00 0.00 N ATOM 2297 NH2 ARG B 63 7.408 -15.480 -4.070 1.00 0.00 N ATOM 0 H ARG B 63 4.537 -8.901 -4.351 1.00 0.00 H new ATOM 0 HA ARG B 63 7.246 -9.480 -3.805 1.00 0.00 H new ATOM 0 HB2 ARG B 63 5.603 -9.255 -6.344 1.00 0.00 H new ATOM 0 HB3 ARG B 63 7.302 -9.686 -6.374 1.00 0.00 H new ATOM 0 HG2 ARG B 63 5.126 -11.211 -4.894 1.00 0.00 H new ATOM 0 HG3 ARG B 63 5.827 -11.674 -6.432 1.00 0.00 H new ATOM 0 HD2 ARG B 63 8.075 -11.815 -5.354 1.00 0.00 H new ATOM 0 HD3 ARG B 63 7.358 -11.378 -3.816 1.00 0.00 H new ATOM 0 HE ARG B 63 5.872 -13.572 -4.520 1.00 0.00 H new ATOM 0 HH11 ARG B 63 9.341 -12.914 -4.367 1.00 0.00 H new ATOM 0 HH12 ARG B 63 9.766 -14.595 -4.029 1.00 0.00 H new ATOM 0 HH21 ARG B 63 6.422 -15.737 -4.108 1.00 0.00 H new ATOM 0 HH22 ARG B 63 8.113 -16.193 -3.883 1.00 0.00 H new ATOM 2311 N ALA B 64 6.657 -6.639 -5.378 1.00 0.00 N ATOM 2312 CA ALA B 64 7.251 -5.353 -5.725 1.00 0.00 C ATOM 2313 C ALA B 64 7.776 -4.642 -4.481 1.00 0.00 C ATOM 2314 O ALA B 64 8.903 -4.146 -4.464 1.00 0.00 O ATOM 2315 CB ALA B 64 6.232 -4.483 -6.445 1.00 0.00 C ATOM 0 H ALA B 64 5.664 -6.719 -5.597 1.00 0.00 H new ATOM 0 HA ALA B 64 8.094 -5.533 -6.392 1.00 0.00 H new ATOM 0 HB1 ALA B 64 6.686 -3.525 -6.699 1.00 0.00 H new ATOM 0 HB2 ALA B 64 5.906 -4.983 -7.357 1.00 0.00 H new ATOM 0 HB3 ALA B 64 5.373 -4.316 -5.796 1.00 0.00 H new ATOM 2321 N LEU B 65 6.954 -4.620 -3.436 1.00 0.00 N ATOM 2322 CA LEU B 65 7.311 -3.980 -2.173 1.00 0.00 C ATOM 2323 C LEU B 65 8.570 -4.612 -1.580 1.00 0.00 C ATOM 2324 O LEU B 65 9.541 -3.918 -1.266 1.00 0.00 O ATOM 2325 CB LEU B 65 6.145 -4.106 -1.183 1.00 0.00 C ATOM 2326 CG LEU B 65 6.347 -3.423 0.171 1.00 0.00 C ATOM 2327 CD1 LEU B 65 6.426 -1.913 0.005 1.00 0.00 C ATOM 2328 CD2 LEU B 65 5.222 -3.799 1.123 1.00 0.00 C ATOM 0 H LEU B 65 6.026 -5.043 -3.440 1.00 0.00 H new ATOM 0 HA LEU B 65 7.515 -2.926 -2.363 1.00 0.00 H new ATOM 0 HB2 LEU B 65 5.251 -3.691 -1.649 1.00 0.00 H new ATOM 0 HB3 LEU B 65 5.952 -5.165 -1.010 1.00 0.00 H new ATOM 0 HG LEU B 65 7.290 -3.767 0.595 1.00 0.00 H new ATOM 0 HD11 LEU B 65 6.570 -1.447 0.980 1.00 0.00 H new ATOM 0 HD12 LEU B 65 7.264 -1.662 -0.645 1.00 0.00 H new ATOM 0 HD13 LEU B 65 5.500 -1.547 -0.439 1.00 0.00 H new ATOM 0 HD21 LEU B 65 5.378 -3.306 2.083 1.00 0.00 H new ATOM 0 HD22 LEU B 65 4.268 -3.481 0.702 1.00 0.00 H new ATOM 0 HD23 LEU B 65 5.213 -4.879 1.267 1.00 0.00 H new ATOM 2340 N GLN B 66 8.548 -5.936 -1.465 1.00 0.00 N ATOM 2341 CA GLN B 66 9.643 -6.687 -0.861 1.00 0.00 C ATOM 2342 C GLN B 66 10.942 -6.502 -1.648 1.00 0.00 C ATOM 2343 O GLN B 66 12.021 -6.398 -1.066 1.00 0.00 O ATOM 2344 CB GLN B 66 9.270 -8.170 -0.797 1.00 0.00 C ATOM 2345 CG GLN B 66 10.258 -9.030 -0.028 1.00 0.00 C ATOM 2346 CD GLN B 66 9.869 -10.495 -0.024 1.00 0.00 C ATOM 2347 OE1 GLN B 66 10.266 -11.258 -0.904 1.00 0.00 O ATOM 2348 NE2 GLN B 66 9.087 -10.901 0.961 1.00 0.00 N ATOM 0 H GLN B 66 7.774 -6.517 -1.787 1.00 0.00 H new ATOM 0 HA GLN B 66 9.808 -6.308 0.148 1.00 0.00 H new ATOM 0 HB2 GLN B 66 8.287 -8.266 -0.336 1.00 0.00 H new ATOM 0 HB3 GLN B 66 9.185 -8.555 -1.813 1.00 0.00 H new ATOM 0 HG2 GLN B 66 11.249 -8.921 -0.468 1.00 0.00 H new ATOM 0 HG3 GLN B 66 10.324 -8.672 0.999 1.00 0.00 H new ATOM 0 HE21 GLN B 66 8.778 -10.239 1.673 1.00 0.00 H new ATOM 0 HE22 GLN B 66 8.793 -11.876 1.009 1.00 0.00 H new ATOM 2357 N SER B 67 10.827 -6.444 -2.971 1.00 0.00 N ATOM 2358 CA SER B 67 11.989 -6.302 -3.842 1.00 0.00 C ATOM 2359 C SER B 67 12.562 -4.887 -3.775 1.00 0.00 C ATOM 2360 O SER B 67 13.764 -4.688 -3.960 1.00 0.00 O ATOM 2361 CB SER B 67 11.607 -6.653 -5.285 1.00 0.00 C ATOM 2362 OG SER B 67 12.725 -6.582 -6.159 1.00 0.00 O ATOM 0 H SER B 67 9.936 -6.493 -3.466 1.00 0.00 H new ATOM 0 HA SER B 67 12.760 -6.991 -3.497 1.00 0.00 H new ATOM 0 HB2 SER B 67 11.185 -7.658 -5.315 1.00 0.00 H new ATOM 0 HB3 SER B 67 10.831 -5.971 -5.632 1.00 0.00 H new ATOM 0 HG SER B 67 12.444 -6.813 -7.069 1.00 0.00 H new ATOM 2368 N SER B 68 11.706 -3.909 -3.506 1.00 0.00 N ATOM 2369 CA SER B 68 12.138 -2.520 -3.450 1.00 0.00 C ATOM 2370 C SER B 68 12.982 -2.266 -2.204 1.00 0.00 C ATOM 2371 O SER B 68 13.954 -1.509 -2.239 1.00 0.00 O ATOM 2372 CB SER B 68 10.929 -1.586 -3.473 1.00 0.00 C ATOM 2373 OG SER B 68 10.131 -1.812 -4.623 1.00 0.00 O ATOM 0 H SER B 68 10.713 -4.052 -3.324 1.00 0.00 H new ATOM 0 HA SER B 68 12.753 -2.317 -4.327 1.00 0.00 H new ATOM 0 HB2 SER B 68 10.330 -1.739 -2.575 1.00 0.00 H new ATOM 0 HB3 SER B 68 11.266 -0.550 -3.458 1.00 0.00 H new ATOM 0 HG SER B 68 9.466 -2.506 -4.429 1.00 0.00 H new ATOM 2379 N ILE B 69 12.613 -2.907 -1.104 1.00 0.00 N ATOM 2380 CA ILE B 69 13.377 -2.786 0.125 1.00 0.00 C ATOM 2381 C ILE B 69 14.552 -3.759 0.107 1.00 0.00 C ATOM 2382 O ILE B 69 14.452 -4.897 0.568 1.00 0.00 O ATOM 2383 CB ILE B 69 12.501 -3.023 1.374 1.00 0.00 C ATOM 2384 CG1 ILE B 69 11.359 -2.002 1.407 1.00 0.00 C ATOM 2385 CG2 ILE B 69 13.336 -2.929 2.645 1.00 0.00 C ATOM 2386 CD1 ILE B 69 10.454 -2.138 2.611 1.00 0.00 C ATOM 0 H ILE B 69 11.794 -3.512 -1.039 1.00 0.00 H new ATOM 0 HA ILE B 69 13.754 -1.765 0.182 1.00 0.00 H new ATOM 0 HB ILE B 69 12.080 -4.027 1.321 1.00 0.00 H new ATOM 0 HG12 ILE B 69 11.782 -0.997 1.393 1.00 0.00 H new ATOM 0 HG13 ILE B 69 10.762 -2.109 0.501 1.00 0.00 H new ATOM 0 HG21 ILE B 69 12.698 -3.099 3.513 1.00 0.00 H new ATOM 0 HG22 ILE B 69 14.123 -3.682 2.620 1.00 0.00 H new ATOM 0 HG23 ILE B 69 13.784 -1.938 2.713 1.00 0.00 H new ATOM 0 HD11 ILE B 69 9.670 -1.382 2.564 1.00 0.00 H new ATOM 0 HD12 ILE B 69 10.002 -3.130 2.616 1.00 0.00 H new ATOM 0 HD13 ILE B 69 11.037 -2.001 3.522 1.00 0.00 H new ATOM 2398 N ASN B 70 15.651 -3.305 -0.471 1.00 0.00 N ATOM 2399 CA ASN B 70 16.845 -4.122 -0.606 1.00 0.00 C ATOM 2400 C ASN B 70 18.068 -3.222 -0.711 1.00 0.00 C ATOM 2401 O ASN B 70 19.020 -3.352 0.062 1.00 0.00 O ATOM 2402 CB ASN B 70 16.742 -5.006 -1.857 1.00 0.00 C ATOM 2403 CG ASN B 70 17.769 -6.126 -1.890 1.00 0.00 C ATOM 2404 OD1 ASN B 70 18.827 -6.049 -1.268 1.00 0.00 O ATOM 2405 ND2 ASN B 70 17.469 -7.175 -2.640 1.00 0.00 N ATOM 0 H ASN B 70 15.741 -2.365 -0.858 1.00 0.00 H new ATOM 0 HA ASN B 70 16.940 -4.763 0.271 1.00 0.00 H new ATOM 0 HB2 ASN B 70 15.742 -5.438 -1.907 1.00 0.00 H new ATOM 0 HB3 ASN B 70 16.865 -4.384 -2.744 1.00 0.00 H new ATOM 0 HD21 ASN B 70 18.125 -7.952 -2.715 1.00 0.00 H new ATOM 0 HD22 ASN B 70 16.582 -7.206 -3.143 1.00 0.00 H new ATOM 2412 N GLU B 71 18.015 -2.297 -1.674 1.00 0.00 N ATOM 2413 CA GLU B 71 19.106 -1.355 -1.928 1.00 0.00 C ATOM 2414 C GLU B 71 20.359 -2.095 -2.379 1.00 0.00 C ATOM 2415 O GLU B 71 20.320 -3.295 -2.660 1.00 0.00 O ATOM 2416 CB GLU B 71 19.418 -0.519 -0.681 1.00 0.00 C ATOM 2417 CG GLU B 71 18.219 0.222 -0.118 1.00 0.00 C ATOM 2418 CD GLU B 71 18.587 1.082 1.072 1.00 0.00 C ATOM 2419 OE1 GLU B 71 18.894 0.522 2.146 1.00 0.00 O ATOM 2420 OE2 GLU B 71 18.572 2.319 0.937 1.00 0.00 O ATOM 0 H GLU B 71 17.216 -2.181 -2.297 1.00 0.00 H new ATOM 0 HA GLU B 71 18.783 -0.683 -2.723 1.00 0.00 H new ATOM 0 HB2 GLU B 71 19.823 -1.174 0.091 1.00 0.00 H new ATOM 0 HB3 GLU B 71 20.196 0.204 -0.926 1.00 0.00 H new ATOM 0 HG2 GLU B 71 17.783 0.848 -0.896 1.00 0.00 H new ATOM 0 HG3 GLU B 71 17.455 -0.497 0.178 1.00 0.00 H new ATOM 2427 N ASP B 72 21.465 -1.372 -2.461 1.00 0.00 N ATOM 2428 CA ASP B 72 22.744 -1.972 -2.809 1.00 0.00 C ATOM 2429 C ASP B 72 23.839 -1.441 -1.900 1.00 0.00 C ATOM 2430 O ASP B 72 24.612 -0.563 -2.292 1.00 0.00 O ATOM 2431 CB ASP B 72 23.106 -1.721 -4.279 1.00 0.00 C ATOM 2432 CG ASP B 72 22.224 -2.495 -5.236 1.00 0.00 C ATOM 2433 OD1 ASP B 72 22.377 -3.733 -5.323 1.00 0.00 O ATOM 2434 OD2 ASP B 72 21.375 -1.874 -5.907 1.00 0.00 O ATOM 0 H ASP B 72 21.503 -0.367 -2.291 1.00 0.00 H new ATOM 0 HA ASP B 72 22.654 -3.049 -2.669 1.00 0.00 H new ATOM 0 HB2 ASP B 72 23.021 -0.656 -4.493 1.00 0.00 H new ATOM 0 HB3 ASP B 72 24.147 -1.998 -4.445 1.00 0.00 H new ATOM 2439 N LYS B 73 23.855 -1.955 -0.670 1.00 0.00 N ATOM 2440 CA LYS B 73 24.855 -1.602 0.337 1.00 0.00 C ATOM 2441 C LYS B 73 24.615 -0.199 0.895 1.00 0.00 C ATOM 2442 O LYS B 73 24.434 0.768 0.154 1.00 0.00 O ATOM 2443 CB LYS B 73 26.277 -1.734 -0.226 1.00 0.00 C ATOM 2444 CG LYS B 73 27.372 -1.463 0.794 1.00 0.00 C ATOM 2445 CD LYS B 73 28.752 -1.774 0.230 1.00 0.00 C ATOM 2446 CE LYS B 73 29.071 -0.918 -0.987 1.00 0.00 C ATOM 2447 NZ LYS B 73 30.412 -1.226 -1.541 1.00 0.00 N ATOM 0 H LYS B 73 23.168 -2.634 -0.342 1.00 0.00 H new ATOM 0 HA LYS B 73 24.753 -2.307 1.162 1.00 0.00 H new ATOM 0 HB2 LYS B 73 26.407 -2.740 -0.625 1.00 0.00 H new ATOM 0 HB3 LYS B 73 26.392 -1.042 -1.061 1.00 0.00 H new ATOM 0 HG2 LYS B 73 27.332 -0.419 1.103 1.00 0.00 H new ATOM 0 HG3 LYS B 73 27.198 -2.066 1.685 1.00 0.00 H new ATOM 0 HD2 LYS B 73 29.505 -1.607 1.000 1.00 0.00 H new ATOM 0 HD3 LYS B 73 28.804 -2.828 -0.043 1.00 0.00 H new ATOM 0 HE2 LYS B 73 28.314 -1.081 -1.755 1.00 0.00 H new ATOM 0 HE3 LYS B 73 29.024 0.136 -0.712 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 30.593 -0.623 -2.369 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 31.136 -1.046 -0.817 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 30.448 -2.225 -1.827 1.00 0.00 H new ATOM 2461 N ALA B 74 24.598 -0.107 2.215 1.00 0.00 N ATOM 2462 CA ALA B 74 24.397 1.165 2.894 1.00 0.00 C ATOM 2463 C ALA B 74 25.672 2.006 2.869 1.00 0.00 C ATOM 2464 O ALA B 74 26.671 1.626 2.257 1.00 0.00 O ATOM 2465 CB ALA B 74 23.945 0.929 4.329 1.00 0.00 C ATOM 0 H ALA B 74 24.722 -0.902 2.841 1.00 0.00 H new ATOM 0 HA ALA B 74 23.619 1.715 2.365 1.00 0.00 H new ATOM 0 HB1 ALA B 74 23.798 1.888 4.826 1.00 0.00 H new ATOM 0 HB2 ALA B 74 23.007 0.373 4.328 1.00 0.00 H new ATOM 0 HB3 ALA B 74 24.706 0.357 4.861 1.00 0.00 H new ATOM 2471 N HIS B 75 25.629 3.151 3.529 1.00 0.00 N ATOM 2472 CA HIS B 75 26.788 4.024 3.609 1.00 0.00 C ATOM 2473 C HIS B 75 27.348 4.001 5.018 1.00 0.00 C ATOM 2474 O HIS B 75 26.593 4.050 5.988 1.00 0.00 O ATOM 2475 CB HIS B 75 26.422 5.461 3.217 1.00 0.00 C ATOM 2476 CG HIS B 75 25.907 5.594 1.817 1.00 0.00 C ATOM 2477 ND1 HIS B 75 26.715 5.904 0.745 1.00 0.00 N ATOM 2478 CD2 HIS B 75 24.658 5.453 1.314 1.00 0.00 C ATOM 2479 CE1 HIS B 75 25.985 5.946 -0.355 1.00 0.00 C ATOM 2480 NE2 HIS B 75 24.734 5.675 -0.038 1.00 0.00 N ATOM 0 H HIS B 75 24.804 3.498 4.017 1.00 0.00 H new ATOM 0 HA HIS B 75 27.542 3.661 2.910 1.00 0.00 H new ATOM 0 HB2 HIS B 75 25.667 5.835 3.909 1.00 0.00 H new ATOM 0 HB3 HIS B 75 27.302 6.094 3.332 1.00 0.00 H new ATOM 0 HD2 HIS B 75 23.767 5.211 1.873 1.00 0.00 H new ATOM 0 HE1 HIS B 75 26.351 6.165 -1.347 1.00 0.00 H new ATOM 0 HE2 HIS B 75 23.951 5.637 -0.691 1.00 0.00 H new ATOM 2489 N LEU B 76 28.661 3.898 5.130 1.00 0.00 N ATOM 2490 CA LEU B 76 29.316 3.947 6.425 1.00 0.00 C ATOM 2491 C LEU B 76 29.851 5.352 6.672 1.00 0.00 C ATOM 2492 O LEU B 76 30.980 5.676 6.294 1.00 0.00 O ATOM 2493 CB LEU B 76 30.453 2.922 6.503 1.00 0.00 C ATOM 2494 CG LEU B 76 31.174 2.846 7.853 1.00 0.00 C ATOM 2495 CD1 LEU B 76 30.224 2.390 8.948 1.00 0.00 C ATOM 2496 CD2 LEU B 76 32.378 1.921 7.765 1.00 0.00 C ATOM 0 H LEU B 76 29.294 3.780 4.339 1.00 0.00 H new ATOM 0 HA LEU B 76 28.587 3.697 7.196 1.00 0.00 H new ATOM 0 HB2 LEU B 76 30.049 1.937 6.270 1.00 0.00 H new ATOM 0 HB3 LEU B 76 31.186 3.157 5.731 1.00 0.00 H new ATOM 0 HG LEU B 76 31.528 3.845 8.107 1.00 0.00 H new ATOM 0 HD11 LEU B 76 30.758 2.344 9.897 1.00 0.00 H new ATOM 0 HD12 LEU B 76 29.398 3.097 9.031 1.00 0.00 H new ATOM 0 HD13 LEU B 76 29.833 1.402 8.703 1.00 0.00 H new ATOM 0 HD21 LEU B 76 32.877 1.880 8.733 1.00 0.00 H new ATOM 0 HD22 LEU B 76 32.049 0.921 7.484 1.00 0.00 H new ATOM 0 HD23 LEU B 76 33.073 2.298 7.015 1.00 0.00 H new ATOM 2508 N GLU B 77 29.022 6.190 7.274 1.00 0.00 N ATOM 2509 CA GLU B 77 29.386 7.576 7.520 1.00 0.00 C ATOM 2510 C GLU B 77 30.380 7.665 8.669 1.00 0.00 C ATOM 2511 O GLU B 77 31.498 8.160 8.502 1.00 0.00 O ATOM 2512 CB GLU B 77 28.133 8.402 7.815 1.00 0.00 C ATOM 2513 CG GLU B 77 27.096 8.325 6.706 1.00 0.00 C ATOM 2514 CD GLU B 77 25.883 9.189 6.968 1.00 0.00 C ATOM 2515 OE1 GLU B 77 25.903 10.378 6.591 1.00 0.00 O ATOM 2516 OE2 GLU B 77 24.902 8.686 7.553 1.00 0.00 O ATOM 0 H GLU B 77 28.091 5.934 7.602 1.00 0.00 H new ATOM 0 HA GLU B 77 29.863 7.982 6.628 1.00 0.00 H new ATOM 0 HB2 GLU B 77 27.687 8.055 8.747 1.00 0.00 H new ATOM 0 HB3 GLU B 77 28.418 9.443 7.967 1.00 0.00 H new ATOM 0 HG2 GLU B 77 27.555 8.629 5.765 1.00 0.00 H new ATOM 0 HG3 GLU B 77 26.778 7.289 6.585 1.00 0.00 H new ATOM 2523 N HIS B 78 29.980 7.171 9.830 1.00 0.00 N ATOM 2524 CA HIS B 78 30.870 7.131 10.976 1.00 0.00 C ATOM 2525 C HIS B 78 31.575 5.783 10.996 1.00 0.00 C ATOM 2526 O HIS B 78 30.960 4.760 11.297 1.00 0.00 O ATOM 2527 CB HIS B 78 30.089 7.362 12.270 1.00 0.00 C ATOM 2528 CG HIS B 78 30.823 8.201 13.269 1.00 0.00 C ATOM 2529 ND1 HIS B 78 31.186 9.508 13.023 1.00 0.00 N ATOM 2530 CD2 HIS B 78 31.250 7.925 14.523 1.00 0.00 C ATOM 2531 CE1 HIS B 78 31.804 9.998 14.079 1.00 0.00 C ATOM 2532 NE2 HIS B 78 31.855 9.060 15.006 1.00 0.00 N ATOM 0 H HIS B 78 29.048 6.794 10.002 1.00 0.00 H new ATOM 0 HA HIS B 78 31.612 7.926 10.897 1.00 0.00 H new ATOM 0 HB2 HIS B 78 29.140 7.842 12.031 1.00 0.00 H new ATOM 0 HB3 HIS B 78 29.854 6.398 12.720 1.00 0.00 H new ATOM 0 HD2 HIS B 78 31.136 6.987 15.047 1.00 0.00 H new ATOM 0 HE1 HIS B 78 32.201 10.998 14.170 1.00 0.00 H new ATOM 0 HE2 HIS B 78 32.275 9.161 15.930 1.00 0.00 H new ATOM 2541 N HIS B 79 32.862 5.789 10.657 1.00 0.00 N ATOM 2542 CA HIS B 79 33.602 4.549 10.410 1.00 0.00 C ATOM 2543 C HIS B 79 33.618 3.628 11.628 1.00 0.00 C ATOM 2544 O HIS B 79 33.623 2.408 11.473 1.00 0.00 O ATOM 2545 CB HIS B 79 35.036 4.835 9.932 1.00 0.00 C ATOM 2546 CG HIS B 79 35.936 5.480 10.946 1.00 0.00 C ATOM 2547 ND1 HIS B 79 36.778 4.764 11.771 1.00 0.00 N ATOM 2548 CD2 HIS B 79 36.139 6.781 11.248 1.00 0.00 C ATOM 2549 CE1 HIS B 79 37.453 5.596 12.539 1.00 0.00 C ATOM 2550 NE2 HIS B 79 37.084 6.825 12.240 1.00 0.00 N ATOM 0 H HIS B 79 33.416 6.638 10.546 1.00 0.00 H new ATOM 0 HA HIS B 79 33.071 4.028 9.614 1.00 0.00 H new ATOM 0 HB2 HIS B 79 35.489 3.896 9.614 1.00 0.00 H new ATOM 0 HB3 HIS B 79 34.987 5.478 9.054 1.00 0.00 H new ATOM 0 HD2 HIS B 79 35.648 7.628 10.793 1.00 0.00 H new ATOM 0 HE1 HIS B 79 38.183 5.318 13.285 1.00 0.00 H new ATOM 0 HE2 HIS B 79 37.444 7.674 12.677 1.00 0.00 H new ATOM 2559 N HIS B 80 33.621 4.219 12.826 1.00 0.00 N ATOM 2560 CA HIS B 80 33.595 3.463 14.081 1.00 0.00 C ATOM 2561 C HIS B 80 34.906 2.706 14.301 1.00 0.00 C ATOM 2562 O HIS B 80 35.263 1.813 13.536 1.00 0.00 O ATOM 2563 CB HIS B 80 32.402 2.495 14.109 1.00 0.00 C ATOM 2564 CG HIS B 80 32.237 1.762 15.407 1.00 0.00 C ATOM 2565 ND1 HIS B 80 31.762 2.364 16.549 1.00 0.00 N ATOM 2566 CD2 HIS B 80 32.471 0.470 15.735 1.00 0.00 C ATOM 2567 CE1 HIS B 80 31.711 1.477 17.524 1.00 0.00 C ATOM 2568 NE2 HIS B 80 32.135 0.318 17.058 1.00 0.00 N ATOM 0 H HIS B 80 33.641 5.231 12.953 1.00 0.00 H new ATOM 0 HA HIS B 80 33.480 4.178 14.896 1.00 0.00 H new ATOM 0 HB2 HIS B 80 31.490 3.054 13.902 1.00 0.00 H new ATOM 0 HB3 HIS B 80 32.520 1.767 13.306 1.00 0.00 H new ATOM 0 HD2 HIS B 80 32.851 -0.299 15.078 1.00 0.00 H new ATOM 0 HE1 HIS B 80 31.378 1.668 18.534 1.00 0.00 H new ATOM 0 HE2 HIS B 80 32.202 -0.548 17.592 1.00 0.00 H new ATOM 2577 N HIS B 81 35.620 3.075 15.353 1.00 0.00 N ATOM 2578 CA HIS B 81 36.873 2.416 15.698 1.00 0.00 C ATOM 2579 C HIS B 81 36.613 0.956 16.074 1.00 0.00 C ATOM 2580 O HIS B 81 35.701 0.659 16.849 1.00 0.00 O ATOM 2581 CB HIS B 81 37.559 3.159 16.853 1.00 0.00 C ATOM 2582 CG HIS B 81 38.911 2.623 17.208 1.00 0.00 C ATOM 2583 ND1 HIS B 81 40.036 2.891 16.468 1.00 0.00 N ATOM 2584 CD2 HIS B 81 39.313 1.819 18.218 1.00 0.00 C ATOM 2585 CE1 HIS B 81 41.071 2.278 17.002 1.00 0.00 C ATOM 2586 NE2 HIS B 81 40.662 1.618 18.067 1.00 0.00 N ATOM 0 H HIS B 81 35.353 3.830 15.985 1.00 0.00 H new ATOM 0 HA HIS B 81 37.536 2.437 14.833 1.00 0.00 H new ATOM 0 HB2 HIS B 81 37.656 4.212 16.587 1.00 0.00 H new ATOM 0 HB3 HIS B 81 36.918 3.110 17.733 1.00 0.00 H new ATOM 0 HD2 HIS B 81 38.688 1.411 18.999 1.00 0.00 H new ATOM 0 HE1 HIS B 81 42.084 2.310 16.630 1.00 0.00 H new ATOM 0 HE2 HIS B 81 41.251 1.052 18.678 1.00 0.00 H new ATOM 2595 N HIS B 82 37.405 0.052 15.516 1.00 0.00 N ATOM 2596 CA HIS B 82 37.245 -1.373 15.773 1.00 0.00 C ATOM 2597 C HIS B 82 38.026 -1.781 17.023 1.00 0.00 C ATOM 2598 O HIS B 82 37.437 -2.078 18.060 1.00 0.00 O ATOM 2599 CB HIS B 82 37.704 -2.186 14.552 1.00 0.00 C ATOM 2600 CG HIS B 82 37.522 -3.673 14.690 1.00 0.00 C ATOM 2601 ND1 HIS B 82 36.485 -4.370 14.107 1.00 0.00 N ATOM 2602 CD2 HIS B 82 38.269 -4.598 15.337 1.00 0.00 C ATOM 2603 CE1 HIS B 82 36.604 -5.653 14.394 1.00 0.00 C ATOM 2604 NE2 HIS B 82 37.680 -5.819 15.137 1.00 0.00 N ATOM 0 H HIS B 82 38.168 0.281 14.879 1.00 0.00 H new ATOM 0 HA HIS B 82 36.190 -1.582 15.949 1.00 0.00 H new ATOM 0 HB2 HIS B 82 37.153 -1.845 13.676 1.00 0.00 H new ATOM 0 HB3 HIS B 82 38.758 -1.977 14.367 1.00 0.00 H new ATOM 0 HD2 HIS B 82 39.166 -4.408 15.907 1.00 0.00 H new ATOM 0 HE1 HIS B 82 35.932 -6.436 14.074 1.00 0.00 H new ATOM 0 HE2 HIS B 82 38.018 -6.709 15.503 1.00 0.00 H new ATOM 2613 N HIS B 83 39.348 -1.777 16.922 1.00 0.00 N ATOM 2614 CA HIS B 83 40.201 -2.180 18.031 1.00 0.00 C ATOM 2615 C HIS B 83 41.527 -1.445 17.944 1.00 0.00 C ATOM 2616 O HIS B 83 41.798 -0.600 18.815 1.00 0.00 O ATOM 2617 CB HIS B 83 40.436 -3.695 18.015 1.00 0.00 C ATOM 2618 CG HIS B 83 41.112 -4.218 19.247 1.00 0.00 C ATOM 2619 ND1 HIS B 83 42.472 -4.414 19.342 1.00 0.00 N ATOM 2620 CD2 HIS B 83 40.597 -4.597 20.438 1.00 0.00 C ATOM 2621 CE1 HIS B 83 42.763 -4.888 20.538 1.00 0.00 C ATOM 2622 NE2 HIS B 83 41.642 -5.008 21.223 1.00 0.00 N ATOM 2623 OXT HIS B 83 42.271 -1.685 16.972 1.00 0.00 O ATOM 0 H HIS B 83 39.854 -1.498 16.081 1.00 0.00 H new ATOM 0 HA HIS B 83 39.704 -1.924 18.967 1.00 0.00 H new ATOM 0 HB2 HIS B 83 39.477 -4.200 17.896 1.00 0.00 H new ATOM 0 HB3 HIS B 83 41.041 -3.950 17.145 1.00 0.00 H new ATOM 0 HD2 HIS B 83 39.554 -4.579 20.719 1.00 0.00 H new ATOM 0 HE1 HIS B 83 43.751 -5.136 20.896 1.00 0.00 H new ATOM 0 HE2 HIS B 83 41.566 -5.351 22.181 1.00 0.00 H new TER 2632 HIS B 83