USER MOD reduce.3.24.130724 H: found=0, std=0, add=1978, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1974 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 20 ASN : amide:sc= -0.37 K(o=-3.8,f=-8.8!) USER MOD Set 1.2: A 125 ASN : amide:sc= -0.897 K(o=-3.8,f=-6.9!) USER MOD Set 1.3: B 20 ASN : amide:sc= -1.85 K(o=-3.8,f=-9.4!) USER MOD Set 1.4: B 125 ASN : amide:sc= -0.731 K(o=-3.8,f=-7.9!) USER MOD Set 2.1: B 90 THR OG1 : rot -62:sc= 0.72 USER MOD Set 2.2: B 119 ASN : amide:sc= 0.621 K(o=1.3,f=-1) USER MOD Set 3.1: B 28 THR OG1 : rot 180:sc= 0.243 USER MOD Set 3.2: B 73 SER OG : rot -54:sc= 0.256 USER MOD Set 4.1: A 90 THR OG1 : rot -69:sc= 0.702 USER MOD Set 4.2: A 119 ASN : amide:sc= 0.63 K(o=1.3,f=-1) USER MOD Set 5.1: A 28 THR OG1 : rot 180:sc= 0.236 USER MOD Set 5.2: A 73 SER OG : rot -55:sc= 0.249 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 3 SER OG : rot -81:sc= -0.918 USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 THR OG1 : rot 135:sc= 1.16 USER MOD Single : A 12 GLN : amide:sc= -1.02 K(o=-1,f=-0.37) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -0.0113 X(o=-0.011,f=-0.13) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 TYR OH : rot 15:sc= -2.6! USER MOD Single : A 26 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.351) USER MOD Single : A 27 HIS : no HE2:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 29 TYR OH : rot 40:sc= 0.172 USER MOD Single : A 30 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 160:sc= -0.449 USER MOD Single : A 35 ASN : amide:sc= -4.83! C(o=-4.8!,f=-5!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.108 USER MOD Single : A 48 THR OG1 : rot 120:sc= -0.285 USER MOD Single : A 49 ASN : amide:sc=-0.00424 K(o=-0.0042,f=-0.59) USER MOD Single : A 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 180:sc= -0.0039 USER MOD Single : A 59 CYS SG : rot 143:sc= 0.729 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 MET CE :methyl -172:sc= -1.31 (180deg=-1.71) USER MOD Single : A 74 CYS SG : rot 180:sc= -0.361 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -0.029 K(o=-0.029,f=-1.1!) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.19 K(o=-0.19,f=-1.9!) USER MOD Single : A 86 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 THR OG1 : rot -150:sc= -0.585 USER MOD Single : A 95 ASN : amide:sc= -0.812 K(o=-0.81,f=-1.4!) USER MOD Single : A 96 THR OG1 : rot 160:sc= -0.0017 USER MOD Single : A 102 LYS NZ :NH3+ 152:sc= -0.142 (180deg=-0.552) USER MOD Single : A 103 GLN : amide:sc= -0.0245 X(o=-0.025,f=-0.29) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 MET CE :methyl -166:sc= -0.235 (180deg=-0.279) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : B 3 SER OG : rot 180:sc= -0.901 USER MOD Single : B 10 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 11 THR OG1 : rot 124:sc= 1.11 USER MOD Single : B 12 GLN : amide:sc= -1.16 K(o=-1.2,f=-0.38) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 15 GLN : amide:sc=-0.00402 X(o=-0.004,f=-0.14) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 23 TYR OH : rot 11:sc= -2.66! USER MOD Single : B 26 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.364) USER MOD Single : B 27 HIS : no HE2:sc= 0 K(o=0,f=-0.79) USER MOD Single : B 29 TYR OH : rot 40:sc= 0.152 USER MOD Single : B 30 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 THR OG1 : rot 160:sc= -0.462 USER MOD Single : B 35 ASN : amide:sc= -4.94! C(o=-4.9!,f=-5!) USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 47 THR OG1 : rot 180:sc= -0.11 USER MOD Single : B 48 THR OG1 : rot 120:sc= -0.271 USER MOD Single : B 49 ASN : amide:sc= -0.02 K(o=-0.02,f=-0.6) USER MOD Single : B 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 54 SER OG : rot 180:sc= 0 USER MOD Single : B 59 CYS SG : rot 142:sc= 0.75 USER MOD Single : B 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 70 MET CE :methyl -170:sc= -1.33 (180deg=-1.72) USER MOD Single : B 74 CYS SG : rot 180:sc= -0.329 USER MOD Single : B 76 THR OG1 : rot 180:sc= 0 USER MOD Single : B 78 ASN : amide:sc= -0.0261 K(o=-0.026,f=-1.1) USER MOD Single : B 81 THR OG1 : rot 180:sc= 0 USER MOD Single : B 85 ASN : amide:sc= -0.206 K(o=-0.21,f=-1.9!) USER MOD Single : B 86 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 94 THR OG1 : rot -150:sc= -0.547 USER MOD Single : B 95 ASN : amide:sc= -0.806 X(o=-0.81,f=-1.2!) USER MOD Single : B 96 THR OG1 : rot 160:sc= 0 USER MOD Single : B 102 LYS NZ :NH3+ 153:sc= -0.107 (180deg=-0.503) USER MOD Single : B 103 GLN : amide:sc= -0.0437 X(o=-0.044,f=-0.26) USER MOD Single : B 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 114 MET CE :methyl -166:sc= -0.217 (180deg=-0.305) USER MOD Single : B 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 124 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -43.783 7.047 -6.563 1.00 0.00 N ATOM 2 CA ALA A 1 -43.450 7.880 -5.378 1.00 0.00 C ATOM 3 C ALA A 1 -41.971 7.762 -5.025 1.00 0.00 C ATOM 4 O ALA A 1 -41.175 8.648 -5.338 1.00 0.00 O ATOM 5 CB ALA A 1 -44.308 7.474 -4.190 1.00 0.00 C ATOM 0 H1 ALA A 1 -44.795 7.145 -6.783 1.00 0.00 H new ATOM 0 H2 ALA A 1 -43.220 7.362 -7.378 1.00 0.00 H new ATOM 0 H3 ALA A 1 -43.568 6.050 -6.358 1.00 0.00 H new ATOM 0 HA ALA A 1 -43.659 8.921 -5.626 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -44.053 8.092 -3.329 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -45.361 7.612 -4.437 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -44.126 6.426 -3.951 1.00 0.00 H new ATOM 13 N GLN A 2 -41.609 6.661 -4.374 1.00 0.00 N ATOM 14 CA GLN A 2 -40.225 6.426 -3.979 1.00 0.00 C ATOM 15 C GLN A 2 -39.793 7.404 -2.891 1.00 0.00 C ATOM 16 O GLN A 2 -39.875 8.620 -3.069 1.00 0.00 O ATOM 17 CB GLN A 2 -39.299 6.553 -5.190 1.00 0.00 C ATOM 18 CG GLN A 2 -38.090 5.634 -5.131 1.00 0.00 C ATOM 19 CD GLN A 2 -37.058 5.958 -6.193 1.00 0.00 C ATOM 20 OE1 GLN A 2 -37.398 6.407 -7.289 1.00 0.00 O ATOM 21 NE2 GLN A 2 -35.790 5.734 -5.874 1.00 0.00 N ATOM 0 H GLN A 2 -42.255 5.918 -4.109 1.00 0.00 H new ATOM 0 HA GLN A 2 -40.156 5.414 -3.580 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -39.866 6.335 -6.095 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -38.957 7.585 -5.269 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -37.629 5.710 -4.146 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -38.417 4.601 -5.251 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -35.554 5.361 -4.954 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -35.051 5.935 -6.548 1.00 0.00 H new ATOM 30 N SER A 3 -39.332 6.867 -1.766 1.00 0.00 N ATOM 31 CA SER A 3 -38.885 7.695 -0.651 1.00 0.00 C ATOM 32 C SER A 3 -37.591 8.421 -1.003 1.00 0.00 C ATOM 33 O SER A 3 -37.514 9.647 -0.925 1.00 0.00 O ATOM 34 CB SER A 3 -38.682 6.839 0.600 1.00 0.00 C ATOM 35 OG SER A 3 -37.355 6.346 0.670 1.00 0.00 O ATOM 0 H SER A 3 -39.258 5.863 -1.602 1.00 0.00 H new ATOM 0 HA SER A 3 -39.656 8.439 -0.449 1.00 0.00 H new ATOM 0 HB2 SER A 3 -38.901 7.431 1.489 1.00 0.00 H new ATOM 0 HB3 SER A 3 -39.383 6.005 0.592 1.00 0.00 H new ATOM 0 HG SER A 3 -37.269 5.556 0.096 1.00 0.00 H new ATOM 41 N VAL A 4 -36.578 7.655 -1.392 1.00 0.00 N ATOM 42 CA VAL A 4 -35.287 8.224 -1.759 1.00 0.00 C ATOM 43 C VAL A 4 -34.296 7.130 -2.153 1.00 0.00 C ATOM 44 O VAL A 4 -34.228 6.081 -1.511 1.00 0.00 O ATOM 45 CB VAL A 4 -34.690 9.054 -0.606 1.00 0.00 C ATOM 46 CG1 VAL A 4 -34.543 8.205 0.646 1.00 0.00 C ATOM 47 CG2 VAL A 4 -33.351 9.652 -1.014 1.00 0.00 C ATOM 0 H VAL A 4 -36.626 6.638 -1.461 1.00 0.00 H new ATOM 0 HA VAL A 4 -35.460 8.878 -2.614 1.00 0.00 H new ATOM 0 HB VAL A 4 -35.374 9.872 -0.382 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -34.120 8.810 1.448 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -35.521 7.832 0.950 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -33.882 7.363 0.439 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -32.945 10.234 -0.187 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -32.657 8.851 -1.268 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -33.490 10.300 -1.880 1.00 0.00 H new ATOM 57 N PRO A 5 -33.510 7.360 -3.221 1.00 0.00 N ATOM 58 CA PRO A 5 -32.522 6.390 -3.699 1.00 0.00 C ATOM 59 C PRO A 5 -31.260 6.373 -2.840 1.00 0.00 C ATOM 60 O PRO A 5 -31.042 7.271 -2.025 1.00 0.00 O ATOM 61 CB PRO A 5 -32.203 6.889 -5.107 1.00 0.00 C ATOM 62 CG PRO A 5 -32.410 8.362 -5.035 1.00 0.00 C ATOM 63 CD PRO A 5 -33.525 8.584 -4.047 1.00 0.00 C ATOM 0 HA PRO A 5 -32.899 5.368 -3.665 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -31.180 6.645 -5.392 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -32.858 6.432 -5.848 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -31.499 8.867 -4.714 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -32.671 8.766 -6.013 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -33.354 9.476 -3.444 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -34.484 8.717 -4.548 1.00 0.00 H new ATOM 71 N PRO A 6 -30.407 5.348 -3.011 1.00 0.00 N ATOM 72 CA PRO A 6 -29.163 5.220 -2.247 1.00 0.00 C ATOM 73 C PRO A 6 -28.118 6.247 -2.670 1.00 0.00 C ATOM 74 O PRO A 6 -27.562 6.166 -3.765 1.00 0.00 O ATOM 75 CB PRO A 6 -28.687 3.805 -2.578 1.00 0.00 C ATOM 76 CG PRO A 6 -29.269 3.516 -3.918 1.00 0.00 C ATOM 77 CD PRO A 6 -30.590 4.234 -3.961 1.00 0.00 C ATOM 0 HA PRO A 6 -29.318 5.393 -1.182 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -27.599 3.747 -2.598 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -29.031 3.087 -1.833 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -28.610 3.864 -4.713 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -29.403 2.444 -4.062 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -30.818 4.595 -4.964 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -31.411 3.582 -3.662 1.00 0.00 H new ATOM 85 N GLY A 7 -27.855 7.212 -1.795 1.00 0.00 N ATOM 86 CA GLY A 7 -26.876 8.241 -2.095 1.00 0.00 C ATOM 87 C GLY A 7 -25.487 7.675 -2.310 1.00 0.00 C ATOM 88 O GLY A 7 -25.035 6.817 -1.552 1.00 0.00 O ATOM 0 H GLY A 7 -28.303 7.300 -0.883 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -27.186 8.784 -2.988 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -26.849 8.962 -1.278 1.00 0.00 H new ATOM 92 N ASP A 8 -24.807 8.157 -3.346 1.00 0.00 N ATOM 93 CA ASP A 8 -23.459 7.695 -3.661 1.00 0.00 C ATOM 94 C ASP A 8 -22.569 7.716 -2.423 1.00 0.00 C ATOM 95 O ASP A 8 -22.785 8.505 -1.505 1.00 0.00 O ATOM 96 CB ASP A 8 -22.845 8.566 -4.758 1.00 0.00 C ATOM 97 CG ASP A 8 -22.956 7.931 -6.130 1.00 0.00 C ATOM 98 OD1 ASP A 8 -23.881 7.116 -6.333 1.00 0.00 O ATOM 99 OD2 ASP A 8 -22.119 8.248 -7.001 1.00 0.00 O ATOM 0 H ASP A 8 -25.168 8.868 -3.982 1.00 0.00 H new ATOM 0 HA ASP A 8 -23.529 6.667 -4.016 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -23.342 9.536 -4.768 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -21.795 8.748 -4.529 1.00 0.00 H new ATOM 104 N ILE A 9 -21.567 6.842 -2.406 1.00 0.00 N ATOM 105 CA ILE A 9 -20.643 6.761 -1.281 1.00 0.00 C ATOM 106 C ILE A 9 -19.217 7.083 -1.714 1.00 0.00 C ATOM 107 O ILE A 9 -18.819 6.785 -2.840 1.00 0.00 O ATOM 108 CB ILE A 9 -20.668 5.364 -0.626 1.00 0.00 C ATOM 109 CG1 ILE A 9 -20.150 4.299 -1.599 1.00 0.00 C ATOM 110 CG2 ILE A 9 -22.076 5.023 -0.164 1.00 0.00 C ATOM 111 CD1 ILE A 9 -19.588 3.074 -0.911 1.00 0.00 C ATOM 0 H ILE A 9 -21.375 6.181 -3.158 1.00 0.00 H new ATOM 0 HA ILE A 9 -20.973 7.500 -0.551 1.00 0.00 H new ATOM 0 HB ILE A 9 -20.010 5.380 0.243 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -20.963 3.995 -2.258 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -19.377 4.739 -2.229 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -22.079 4.035 0.296 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -22.409 5.763 0.564 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -22.751 5.026 -1.020 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -19.240 2.363 -1.661 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -18.754 3.366 -0.273 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -20.365 2.610 -0.303 1.00 0.00 H new ATOM 123 N ASN A 10 -18.452 7.690 -0.814 1.00 0.00 N ATOM 124 CA ASN A 10 -17.069 8.046 -1.106 1.00 0.00 C ATOM 125 C ASN A 10 -16.147 6.853 -0.871 1.00 0.00 C ATOM 126 O ASN A 10 -16.330 6.094 0.082 1.00 0.00 O ATOM 127 CB ASN A 10 -16.629 9.227 -0.241 1.00 0.00 C ATOM 128 CG ASN A 10 -16.603 10.530 -1.016 1.00 0.00 C ATOM 129 OD1 ASN A 10 -15.746 10.739 -1.874 1.00 0.00 O ATOM 130 ND2 ASN A 10 -17.545 11.417 -0.716 1.00 0.00 N ATOM 0 H ASN A 10 -18.766 7.945 0.122 1.00 0.00 H new ATOM 0 HA ASN A 10 -17.004 8.335 -2.155 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -17.306 9.325 0.608 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -15.637 9.028 0.164 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -17.577 12.312 -1.204 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -18.237 11.203 0.002 1.00 0.00 H new ATOM 137 N THR A 11 -15.160 6.690 -1.744 1.00 0.00 N ATOM 138 CA THR A 11 -14.216 5.585 -1.628 1.00 0.00 C ATOM 139 C THR A 11 -12.777 6.070 -1.784 1.00 0.00 C ATOM 140 O THR A 11 -12.483 6.915 -2.630 1.00 0.00 O ATOM 141 CB THR A 11 -14.523 4.515 -2.677 1.00 0.00 C ATOM 142 OG1 THR A 11 -15.146 5.089 -3.812 1.00 0.00 O ATOM 143 CG2 THR A 11 -15.428 3.416 -2.163 1.00 0.00 C ATOM 0 H THR A 11 -14.993 7.307 -2.538 1.00 0.00 H new ATOM 0 HA THR A 11 -14.324 5.154 -0.633 1.00 0.00 H new ATOM 0 HB THR A 11 -13.558 4.078 -2.935 1.00 0.00 H new ATOM 0 HG1 THR A 11 -14.735 4.731 -4.627 1.00 0.00 H new ATOM 0 HG21 THR A 11 -15.606 2.690 -2.957 1.00 0.00 H new ATOM 0 HG22 THR A 11 -14.953 2.919 -1.317 1.00 0.00 H new ATOM 0 HG23 THR A 11 -16.378 3.846 -1.845 1.00 0.00 H new ATOM 151 N GLN A 12 -11.887 5.528 -0.959 1.00 0.00 N ATOM 152 CA GLN A 12 -10.477 5.900 -1.000 1.00 0.00 C ATOM 153 C GLN A 12 -9.587 4.660 -0.875 1.00 0.00 C ATOM 154 O GLN A 12 -9.526 4.047 0.191 1.00 0.00 O ATOM 155 CB GLN A 12 -10.161 6.878 0.133 1.00 0.00 C ATOM 156 CG GLN A 12 -11.148 8.030 0.236 1.00 0.00 C ATOM 157 CD GLN A 12 -10.587 9.213 1.001 1.00 0.00 C ATOM 158 OE1 GLN A 12 -10.604 10.344 0.518 1.00 0.00 O ATOM 159 NE2 GLN A 12 -10.083 8.955 2.203 1.00 0.00 N ATOM 0 H GLN A 12 -12.117 4.829 -0.253 1.00 0.00 H new ATOM 0 HA GLN A 12 -10.276 6.379 -1.958 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -10.150 6.335 1.078 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -9.159 7.281 -0.015 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -11.431 8.352 -0.766 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -12.057 7.682 0.728 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -10.090 8.001 2.565 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -9.690 9.711 2.764 1.00 0.00 H new ATOM 168 N PRO A 13 -8.883 4.260 -1.957 1.00 0.00 N ATOM 169 CA PRO A 13 -8.914 4.948 -3.258 1.00 0.00 C ATOM 170 C PRO A 13 -10.297 4.940 -3.893 1.00 0.00 C ATOM 171 O PRO A 13 -11.194 4.219 -3.456 1.00 0.00 O ATOM 172 CB PRO A 13 -7.929 4.148 -4.118 1.00 0.00 C ATOM 173 CG PRO A 13 -7.822 2.822 -3.450 1.00 0.00 C ATOM 174 CD PRO A 13 -7.992 3.089 -1.983 1.00 0.00 C ATOM 0 HA PRO A 13 -8.654 6.002 -3.158 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -8.291 4.046 -5.141 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -6.959 4.643 -4.171 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -8.588 2.138 -3.814 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -6.857 2.358 -3.654 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -8.432 2.236 -1.467 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -7.038 3.297 -1.498 1.00 0.00 H new ATOM 182 N SER A 14 -10.460 5.754 -4.930 1.00 0.00 N ATOM 183 CA SER A 14 -11.731 5.864 -5.645 1.00 0.00 C ATOM 184 C SER A 14 -12.359 4.492 -5.881 1.00 0.00 C ATOM 185 O SER A 14 -13.396 4.167 -5.303 1.00 0.00 O ATOM 186 CB SER A 14 -11.525 6.576 -6.982 1.00 0.00 C ATOM 187 OG SER A 14 -11.438 7.980 -6.805 1.00 0.00 O ATOM 0 H SER A 14 -9.722 6.353 -5.299 1.00 0.00 H new ATOM 0 HA SER A 14 -12.412 6.447 -5.025 1.00 0.00 H new ATOM 0 HB2 SER A 14 -10.615 6.209 -7.456 1.00 0.00 H new ATOM 0 HB3 SER A 14 -12.351 6.342 -7.653 1.00 0.00 H new ATOM 0 HG SER A 14 -11.305 8.412 -7.675 1.00 0.00 H new ATOM 193 N GLN A 15 -11.727 3.693 -6.734 1.00 0.00 N ATOM 194 CA GLN A 15 -12.228 2.361 -7.044 1.00 0.00 C ATOM 195 C GLN A 15 -11.155 1.515 -7.719 1.00 0.00 C ATOM 196 O GLN A 15 -11.425 0.813 -8.693 1.00 0.00 O ATOM 197 CB GLN A 15 -13.460 2.454 -7.945 1.00 0.00 C ATOM 198 CG GLN A 15 -13.338 3.509 -9.032 1.00 0.00 C ATOM 199 CD GLN A 15 -13.405 2.920 -10.427 1.00 0.00 C ATOM 200 OE1 GLN A 15 -14.301 2.135 -10.741 1.00 0.00 O ATOM 201 NE2 GLN A 15 -12.452 3.293 -11.274 1.00 0.00 N ATOM 0 H GLN A 15 -10.868 3.945 -7.222 1.00 0.00 H new ATOM 0 HA GLN A 15 -12.505 1.880 -6.106 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -13.635 1.484 -8.410 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -14.333 2.675 -7.331 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -14.136 4.242 -8.913 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -12.395 4.042 -8.912 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -11.729 3.946 -10.972 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -12.444 2.927 -12.226 1.00 0.00 H new ATOM 210 N LYS A 16 -9.934 1.584 -7.196 1.00 0.00 N ATOM 211 CA LYS A 16 -8.824 0.821 -7.752 1.00 0.00 C ATOM 212 C LYS A 16 -7.700 0.667 -6.732 1.00 0.00 C ATOM 213 O LYS A 16 -7.178 1.654 -6.214 1.00 0.00 O ATOM 214 CB LYS A 16 -8.291 1.500 -9.016 1.00 0.00 C ATOM 215 CG LYS A 16 -7.310 0.641 -9.798 1.00 0.00 C ATOM 216 CD LYS A 16 -7.505 0.800 -11.298 1.00 0.00 C ATOM 217 CE LYS A 16 -6.587 1.869 -11.869 1.00 0.00 C ATOM 218 NZ LYS A 16 -5.369 1.281 -12.494 1.00 0.00 N ATOM 0 H LYS A 16 -9.690 2.159 -6.390 1.00 0.00 H new ATOM 0 HA LYS A 16 -9.194 -0.171 -8.009 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -9.130 1.758 -9.662 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -7.803 2.434 -8.739 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -6.290 0.917 -9.531 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -7.440 -0.405 -9.522 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -7.311 -0.151 -11.794 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -8.543 1.061 -11.505 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -7.129 2.454 -12.612 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -6.292 2.556 -11.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -4.770 2.043 -12.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -4.837 0.744 -11.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -5.648 0.645 -13.268 1.00 0.00 H new ATOM 232 N ILE A 17 -7.333 -0.579 -6.452 1.00 0.00 N ATOM 233 CA ILE A 17 -6.269 -0.867 -5.498 1.00 0.00 C ATOM 234 C ILE A 17 -5.276 -1.866 -6.080 1.00 0.00 C ATOM 235 O ILE A 17 -5.632 -2.686 -6.926 1.00 0.00 O ATOM 236 CB ILE A 17 -6.833 -1.427 -4.178 1.00 0.00 C ATOM 237 CG1 ILE A 17 -5.714 -1.597 -3.149 1.00 0.00 C ATOM 238 CG2 ILE A 17 -7.540 -2.749 -4.424 1.00 0.00 C ATOM 239 CD1 ILE A 17 -6.206 -1.616 -1.719 1.00 0.00 C ATOM 0 H ILE A 17 -7.757 -1.406 -6.873 1.00 0.00 H new ATOM 0 HA ILE A 17 -5.760 0.074 -5.292 1.00 0.00 H new ATOM 0 HB ILE A 17 -7.559 -0.718 -3.781 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -5.181 -2.526 -3.354 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -4.996 -0.785 -3.267 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -7.933 -3.132 -3.482 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.361 -2.598 -5.125 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -6.834 -3.467 -4.841 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -5.359 -1.740 -1.044 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -6.713 -0.677 -1.496 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -6.901 -2.445 -1.584 1.00 0.00 H new ATOM 251 N VAL A 18 -4.028 -1.792 -5.629 1.00 0.00 N ATOM 252 CA VAL A 18 -2.989 -2.690 -6.119 1.00 0.00 C ATOM 253 C VAL A 18 -2.092 -3.177 -4.985 1.00 0.00 C ATOM 254 O VAL A 18 -1.185 -2.468 -4.551 1.00 0.00 O ATOM 255 CB VAL A 18 -2.118 -2.004 -7.189 1.00 0.00 C ATOM 256 CG1 VAL A 18 -1.492 -0.733 -6.634 1.00 0.00 C ATOM 257 CG2 VAL A 18 -1.046 -2.955 -7.700 1.00 0.00 C ATOM 0 H VAL A 18 -3.712 -1.122 -4.928 1.00 0.00 H new ATOM 0 HA VAL A 18 -3.497 -3.546 -6.563 1.00 0.00 H new ATOM 0 HB VAL A 18 -2.757 -1.731 -8.029 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -0.881 -0.262 -7.404 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -2.279 -0.045 -6.325 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.868 -0.980 -5.775 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -0.442 -2.451 -8.455 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -0.408 -3.263 -6.872 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -1.518 -3.833 -8.140 1.00 0.00 H new ATOM 267 N PHE A 19 -2.347 -4.394 -4.516 1.00 0.00 N ATOM 268 CA PHE A 19 -1.554 -4.978 -3.439 1.00 0.00 C ATOM 269 C PHE A 19 -0.068 -4.935 -3.783 1.00 0.00 C ATOM 270 O PHE A 19 0.383 -5.603 -4.713 1.00 0.00 O ATOM 271 CB PHE A 19 -1.988 -6.423 -3.182 1.00 0.00 C ATOM 272 CG PHE A 19 -3.117 -6.546 -2.197 1.00 0.00 C ATOM 273 CD1 PHE A 19 -4.433 -6.434 -2.615 1.00 0.00 C ATOM 274 CD2 PHE A 19 -2.861 -6.774 -0.854 1.00 0.00 C ATOM 275 CE1 PHE A 19 -5.473 -6.547 -1.713 1.00 0.00 C ATOM 276 CE2 PHE A 19 -3.897 -6.888 0.053 1.00 0.00 C ATOM 277 CZ PHE A 19 -5.205 -6.775 -0.377 1.00 0.00 C ATOM 0 H PHE A 19 -3.095 -4.994 -4.864 1.00 0.00 H new ATOM 0 HA PHE A 19 -1.721 -4.392 -2.535 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.290 -6.876 -4.126 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.133 -6.991 -2.815 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -4.648 -6.256 -3.658 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.840 -6.864 -0.513 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -6.495 -6.457 -2.052 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -3.685 -7.065 1.097 1.00 0.00 H new ATOM 0 HZ PHE A 19 -6.017 -6.865 0.330 1.00 0.00 H new ATOM 287 N ASN A 20 0.687 -4.140 -3.032 1.00 0.00 N ATOM 288 CA ASN A 20 2.122 -4.004 -3.264 1.00 0.00 C ATOM 289 C ASN A 20 2.898 -5.159 -2.634 1.00 0.00 C ATOM 290 O ASN A 20 2.675 -5.512 -1.476 1.00 0.00 O ATOM 291 CB ASN A 20 2.624 -2.674 -2.699 1.00 0.00 C ATOM 292 CG ASN A 20 2.388 -1.514 -3.646 1.00 0.00 C ATOM 293 OD1 ASN A 20 3.315 -1.025 -4.292 1.00 0.00 O ATOM 294 ND2 ASN A 20 1.141 -1.065 -3.734 1.00 0.00 N ATOM 0 H ASN A 20 0.330 -3.580 -2.258 1.00 0.00 H new ATOM 0 HA ASN A 20 2.290 -4.027 -4.341 1.00 0.00 H new ATOM 0 HB2 ASN A 20 2.123 -2.473 -1.752 1.00 0.00 H new ATOM 0 HB3 ASN A 20 3.690 -2.753 -2.485 1.00 0.00 H new ATOM 0 HD21 ASN A 20 0.922 -0.286 -4.355 1.00 0.00 H new ATOM 0 HD22 ASN A 20 0.402 -1.499 -3.181 1.00 0.00 H new ATOM 301 N ALA A 21 3.815 -5.737 -3.406 1.00 0.00 N ATOM 302 CA ALA A 21 4.635 -6.847 -2.928 1.00 0.00 C ATOM 303 C ALA A 21 5.249 -6.523 -1.564 1.00 0.00 C ATOM 304 O ALA A 21 5.173 -5.384 -1.105 1.00 0.00 O ATOM 305 CB ALA A 21 5.725 -7.157 -3.944 1.00 0.00 C ATOM 0 H ALA A 21 4.009 -5.454 -4.367 1.00 0.00 H new ATOM 0 HA ALA A 21 4.000 -7.725 -2.810 1.00 0.00 H new ATOM 0 HB1 ALA A 21 6.334 -7.986 -3.583 1.00 0.00 H new ATOM 0 HB2 ALA A 21 5.269 -7.430 -4.895 1.00 0.00 H new ATOM 0 HB3 ALA A 21 6.354 -6.278 -4.082 1.00 0.00 H new ATOM 311 N PRO A 22 5.867 -7.515 -0.889 1.00 0.00 N ATOM 312 CA PRO A 22 5.990 -8.894 -1.385 1.00 0.00 C ATOM 313 C PRO A 22 4.698 -9.687 -1.245 1.00 0.00 C ATOM 314 O PRO A 22 3.763 -9.263 -0.565 1.00 0.00 O ATOM 315 CB PRO A 22 7.075 -9.488 -0.489 1.00 0.00 C ATOM 316 CG PRO A 22 6.946 -8.746 0.795 1.00 0.00 C ATOM 317 CD PRO A 22 6.503 -7.352 0.433 1.00 0.00 C ATOM 0 HA PRO A 22 6.223 -8.923 -2.450 1.00 0.00 H new ATOM 0 HB2 PRO A 22 6.929 -10.559 -0.345 1.00 0.00 H new ATOM 0 HB3 PRO A 22 8.065 -9.357 -0.925 1.00 0.00 H new ATOM 0 HG2 PRO A 22 6.220 -9.227 1.451 1.00 0.00 H new ATOM 0 HG3 PRO A 22 7.895 -8.726 1.330 1.00 0.00 H new ATOM 0 HD2 PRO A 22 5.803 -6.952 1.167 1.00 0.00 H new ATOM 0 HD3 PRO A 22 7.347 -6.663 0.389 1.00 0.00 H new ATOM 325 N TYR A 23 4.658 -10.843 -1.895 1.00 0.00 N ATOM 326 CA TYR A 23 3.486 -11.710 -1.852 1.00 0.00 C ATOM 327 C TYR A 23 3.812 -13.036 -1.177 1.00 0.00 C ATOM 328 O TYR A 23 3.234 -14.072 -1.506 1.00 0.00 O ATOM 329 CB TYR A 23 2.960 -11.952 -3.266 1.00 0.00 C ATOM 330 CG TYR A 23 2.633 -10.675 -4.000 1.00 0.00 C ATOM 331 CD1 TYR A 23 2.121 -9.580 -3.319 1.00 0.00 C ATOM 332 CD2 TYR A 23 2.840 -10.562 -5.368 1.00 0.00 C ATOM 333 CE1 TYR A 23 1.822 -8.406 -3.979 1.00 0.00 C ATOM 334 CE2 TYR A 23 2.546 -9.389 -6.036 1.00 0.00 C ATOM 335 CZ TYR A 23 2.037 -8.314 -5.338 1.00 0.00 C ATOM 336 OH TYR A 23 1.744 -7.146 -6.001 1.00 0.00 O ATOM 0 H TYR A 23 5.427 -11.204 -2.461 1.00 0.00 H new ATOM 0 HA TYR A 23 2.714 -11.212 -1.265 1.00 0.00 H new ATOM 0 HB2 TYR A 23 3.704 -12.511 -3.834 1.00 0.00 H new ATOM 0 HB3 TYR A 23 2.066 -12.574 -3.214 1.00 0.00 H new ATOM 0 HD1 TYR A 23 1.954 -9.648 -2.254 1.00 0.00 H new ATOM 0 HD2 TYR A 23 3.236 -11.403 -5.918 1.00 0.00 H new ATOM 0 HE1 TYR A 23 1.422 -7.564 -3.434 1.00 0.00 H new ATOM 0 HE2 TYR A 23 2.714 -9.314 -7.100 1.00 0.00 H new ATOM 0 HH TYR A 23 1.625 -6.422 -5.351 1.00 0.00 H new ATOM 346 N ASP A 24 4.736 -12.992 -0.226 1.00 0.00 N ATOM 347 CA ASP A 24 5.137 -14.186 0.507 1.00 0.00 C ATOM 348 C ASP A 24 4.524 -14.209 1.908 1.00 0.00 C ATOM 349 O ASP A 24 4.848 -15.080 2.717 1.00 0.00 O ATOM 350 CB ASP A 24 6.660 -14.257 0.607 1.00 0.00 C ATOM 351 CG ASP A 24 7.199 -15.638 0.288 1.00 0.00 C ATOM 352 OD1 ASP A 24 6.729 -16.615 0.906 1.00 0.00 O ATOM 353 OD2 ASP A 24 8.089 -15.741 -0.581 1.00 0.00 O ATOM 0 H ASP A 24 5.223 -12.141 0.056 1.00 0.00 H new ATOM 0 HA ASP A 24 4.770 -15.054 -0.041 1.00 0.00 H new ATOM 0 HB2 ASP A 24 7.100 -13.532 -0.077 1.00 0.00 H new ATOM 0 HB3 ASP A 24 6.968 -13.974 1.613 1.00 0.00 H new ATOM 358 N ASP A 25 3.641 -13.254 2.196 1.00 0.00 N ATOM 359 CA ASP A 25 2.998 -13.182 3.503 1.00 0.00 C ATOM 360 C ASP A 25 1.603 -12.578 3.392 1.00 0.00 C ATOM 361 O ASP A 25 1.145 -12.247 2.299 1.00 0.00 O ATOM 362 CB ASP A 25 3.850 -12.356 4.470 1.00 0.00 C ATOM 363 CG ASP A 25 5.312 -12.755 4.437 1.00 0.00 C ATOM 364 OD1 ASP A 25 5.644 -13.841 4.958 1.00 0.00 O ATOM 365 OD2 ASP A 25 6.125 -11.982 3.889 1.00 0.00 O ATOM 0 H ASP A 25 3.357 -12.523 1.544 1.00 0.00 H new ATOM 0 HA ASP A 25 2.904 -14.197 3.889 1.00 0.00 H new ATOM 0 HB2 ASP A 25 3.759 -11.299 4.219 1.00 0.00 H new ATOM 0 HB3 ASP A 25 3.466 -12.477 5.483 1.00 0.00 H new ATOM 370 N LYS A 26 0.932 -12.436 4.530 1.00 0.00 N ATOM 371 CA LYS A 26 -0.412 -11.871 4.560 1.00 0.00 C ATOM 372 C LYS A 26 -0.371 -10.382 4.884 1.00 0.00 C ATOM 373 O LYS A 26 -0.098 -9.992 6.019 1.00 0.00 O ATOM 374 CB LYS A 26 -1.274 -12.605 5.588 1.00 0.00 C ATOM 375 CG LYS A 26 -1.105 -14.115 5.554 1.00 0.00 C ATOM 376 CD LYS A 26 -2.072 -14.806 6.501 1.00 0.00 C ATOM 377 CE LYS A 26 -1.434 -15.069 7.856 1.00 0.00 C ATOM 378 NZ LYS A 26 -1.577 -13.905 8.774 1.00 0.00 N ATOM 0 H LYS A 26 1.297 -12.704 5.444 1.00 0.00 H new ATOM 0 HA LYS A 26 -0.853 -11.996 3.571 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -1.025 -12.242 6.585 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.322 -12.361 5.413 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.267 -14.477 4.539 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -0.081 -14.374 5.825 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -2.961 -14.188 6.630 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -2.400 -15.749 6.063 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -1.894 -15.947 8.309 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.377 -15.297 7.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -1.415 -14.214 9.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -0.880 -13.176 8.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -2.536 -13.512 8.689 1.00 0.00 H new ATOM 392 N HIS A 27 -0.646 -9.557 3.881 1.00 0.00 N ATOM 393 CA HIS A 27 -0.643 -8.109 4.059 1.00 0.00 C ATOM 394 C HIS A 27 -2.056 -7.546 3.953 1.00 0.00 C ATOM 395 O HIS A 27 -2.804 -7.889 3.037 1.00 0.00 O ATOM 396 CB HIS A 27 0.265 -7.448 3.020 1.00 0.00 C ATOM 397 CG HIS A 27 1.715 -7.765 3.209 1.00 0.00 C ATOM 398 ND1 HIS A 27 2.336 -7.819 4.437 1.00 0.00 N ATOM 399 CD2 HIS A 27 2.674 -8.053 2.293 1.00 0.00 C ATOM 400 CE1 HIS A 27 3.623 -8.131 4.235 1.00 0.00 C ATOM 401 NE2 HIS A 27 3.880 -8.284 2.950 1.00 0.00 N ATOM 0 H HIS A 27 -0.874 -9.865 2.936 1.00 0.00 H new ATOM 0 HA HIS A 27 -0.259 -7.890 5.055 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -0.042 -7.768 2.024 1.00 0.00 H new ATOM 0 HB3 HIS A 27 0.128 -6.367 3.064 1.00 0.00 H new ATOM 0 HD1 HIS A 27 1.894 -7.651 5.341 1.00 0.00 H new ATOM 0 HD2 HIS A 27 2.525 -8.096 1.224 1.00 0.00 H new ATOM 0 HE1 HIS A 27 4.355 -8.243 5.021 1.00 0.00 H new ATOM 409 N THR A 28 -2.417 -6.686 4.899 1.00 0.00 N ATOM 410 CA THR A 28 -3.743 -6.079 4.915 1.00 0.00 C ATOM 411 C THR A 28 -3.680 -4.610 4.510 1.00 0.00 C ATOM 412 O THR A 28 -2.810 -3.866 4.965 1.00 0.00 O ATOM 413 CB THR A 28 -4.369 -6.209 6.304 1.00 0.00 C ATOM 414 OG1 THR A 28 -4.501 -7.571 6.669 1.00 0.00 O ATOM 415 CG2 THR A 28 -5.738 -5.572 6.408 1.00 0.00 C ATOM 0 H THR A 28 -1.810 -6.393 5.665 1.00 0.00 H new ATOM 0 HA THR A 28 -4.363 -6.608 4.191 1.00 0.00 H new ATOM 0 HB THR A 28 -3.690 -5.683 6.975 1.00 0.00 H new ATOM 0 HG1 THR A 28 -4.902 -7.633 7.561 1.00 0.00 H new ATOM 0 HG21 THR A 28 -6.123 -5.701 7.419 1.00 0.00 H new ATOM 0 HG22 THR A 28 -5.663 -4.508 6.181 1.00 0.00 H new ATOM 0 HG23 THR A 28 -6.415 -6.047 5.698 1.00 0.00 H new ATOM 423 N TYR A 29 -4.610 -4.196 3.656 1.00 0.00 N ATOM 424 CA TYR A 29 -4.667 -2.817 3.192 1.00 0.00 C ATOM 425 C TYR A 29 -5.967 -2.154 3.635 1.00 0.00 C ATOM 426 O TYR A 29 -7.058 -2.629 3.320 1.00 0.00 O ATOM 427 CB TYR A 29 -4.540 -2.763 1.669 1.00 0.00 C ATOM 428 CG TYR A 29 -3.156 -3.109 1.168 1.00 0.00 C ATOM 429 CD1 TYR A 29 -2.587 -4.347 1.441 1.00 0.00 C ATOM 430 CD2 TYR A 29 -2.416 -2.198 0.426 1.00 0.00 C ATOM 431 CE1 TYR A 29 -1.321 -4.667 0.989 1.00 0.00 C ATOM 432 CE2 TYR A 29 -1.149 -2.510 -0.032 1.00 0.00 C ATOM 433 CZ TYR A 29 -0.607 -3.745 0.253 1.00 0.00 C ATOM 434 OH TYR A 29 0.655 -4.061 -0.198 1.00 0.00 O ATOM 0 H TYR A 29 -5.337 -4.799 3.271 1.00 0.00 H new ATOM 0 HA TYR A 29 -3.833 -2.272 3.634 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -5.261 -3.451 1.227 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -4.803 -1.763 1.325 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -3.144 -5.072 2.016 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -2.837 -1.229 0.203 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -0.893 -5.634 1.211 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -0.588 -1.790 -0.609 1.00 0.00 H new ATOM 0 HH TYR A 29 0.670 -4.993 -0.502 1.00 0.00 H new ATOM 444 N HIS A 30 -5.842 -1.060 4.378 1.00 0.00 N ATOM 445 CA HIS A 30 -7.004 -0.336 4.877 1.00 0.00 C ATOM 446 C HIS A 30 -7.734 0.391 3.751 1.00 0.00 C ATOM 447 O HIS A 30 -7.127 0.793 2.758 1.00 0.00 O ATOM 448 CB HIS A 30 -6.581 0.663 5.955 1.00 0.00 C ATOM 449 CG HIS A 30 -6.711 0.133 7.348 1.00 0.00 C ATOM 450 ND1 HIS A 30 -5.710 -0.546 8.007 1.00 0.00 N ATOM 451 CD2 HIS A 30 -7.756 0.193 8.213 1.00 0.00 C ATOM 452 CE1 HIS A 30 -6.167 -0.871 9.224 1.00 0.00 C ATOM 453 NE2 HIS A 30 -7.404 -0.444 9.399 1.00 0.00 N ATOM 0 H HIS A 30 -4.946 -0.655 4.648 1.00 0.00 H new ATOM 0 HA HIS A 30 -7.690 -1.065 5.309 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -5.545 0.955 5.782 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -7.186 1.565 5.860 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -8.709 0.661 8.012 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -5.598 -1.412 9.965 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -7.982 -0.558 10.232 1.00 0.00 H new ATOM 461 N ILE A 31 -9.042 0.560 3.920 1.00 0.00 N ATOM 462 CA ILE A 31 -9.867 1.244 2.932 1.00 0.00 C ATOM 463 C ILE A 31 -10.784 2.258 3.605 1.00 0.00 C ATOM 464 O ILE A 31 -11.125 2.115 4.780 1.00 0.00 O ATOM 465 CB ILE A 31 -10.723 0.250 2.125 1.00 0.00 C ATOM 466 CG1 ILE A 31 -9.879 -0.950 1.691 1.00 0.00 C ATOM 467 CG2 ILE A 31 -11.335 0.939 0.914 1.00 0.00 C ATOM 468 CD1 ILE A 31 -10.657 -1.982 0.902 1.00 0.00 C ATOM 0 H ILE A 31 -9.555 0.230 4.737 1.00 0.00 H new ATOM 0 HA ILE A 31 -9.190 1.758 2.250 1.00 0.00 H new ATOM 0 HB ILE A 31 -11.531 -0.110 2.762 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -9.043 -0.597 1.087 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -9.455 -1.425 2.576 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -11.937 0.223 0.354 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -11.966 1.764 1.245 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -10.541 1.324 0.274 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -9.996 -2.804 0.627 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -11.477 -2.363 1.511 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -11.059 -1.522 -0.001 1.00 0.00 H new ATOM 480 N LYS A 32 -11.176 3.286 2.861 1.00 0.00 N ATOM 481 CA LYS A 32 -12.049 4.325 3.399 1.00 0.00 C ATOM 482 C LYS A 32 -13.382 4.372 2.657 1.00 0.00 C ATOM 483 O LYS A 32 -13.425 4.323 1.429 1.00 0.00 O ATOM 484 CB LYS A 32 -11.359 5.688 3.320 1.00 0.00 C ATOM 485 CG LYS A 32 -11.581 6.554 4.550 1.00 0.00 C ATOM 486 CD LYS A 32 -10.265 7.059 5.122 1.00 0.00 C ATOM 487 CE LYS A 32 -10.414 8.450 5.716 1.00 0.00 C ATOM 488 NZ LYS A 32 -9.214 8.850 6.501 1.00 0.00 N ATOM 0 H LYS A 32 -10.905 3.423 1.887 1.00 0.00 H new ATOM 0 HA LYS A 32 -12.251 4.083 4.442 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -10.289 5.537 3.181 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -11.723 6.220 2.441 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -12.215 7.402 4.290 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -12.112 5.980 5.309 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.912 6.370 5.890 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.509 7.076 4.337 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -10.581 9.171 4.915 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -11.294 8.478 6.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -9.355 9.804 6.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -9.069 8.177 7.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -8.378 8.848 5.882 1.00 0.00 H new ATOM 502 N ILE A 33 -14.467 4.475 3.419 1.00 0.00 N ATOM 503 CA ILE A 33 -15.807 4.537 2.846 1.00 0.00 C ATOM 504 C ILE A 33 -16.708 5.443 3.680 1.00 0.00 C ATOM 505 O ILE A 33 -16.907 5.207 4.871 1.00 0.00 O ATOM 506 CB ILE A 33 -16.451 3.141 2.756 1.00 0.00 C ATOM 507 CG1 ILE A 33 -15.555 2.189 1.961 1.00 0.00 C ATOM 508 CG2 ILE A 33 -17.828 3.236 2.117 1.00 0.00 C ATOM 509 CD1 ILE A 33 -16.031 0.753 1.986 1.00 0.00 C ATOM 0 H ILE A 33 -14.444 4.517 4.438 1.00 0.00 H new ATOM 0 HA ILE A 33 -15.704 4.943 1.840 1.00 0.00 H new ATOM 0 HB ILE A 33 -16.564 2.744 3.765 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -15.504 2.529 0.927 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -14.542 2.235 2.362 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -18.272 2.242 2.060 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -18.465 3.884 2.720 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -17.735 3.651 1.113 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -15.350 0.134 1.403 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -16.055 0.396 3.015 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -17.032 0.694 1.558 1.00 0.00 H new ATOM 521 N THR A 34 -17.246 6.483 3.051 1.00 0.00 N ATOM 522 CA THR A 34 -18.120 7.422 3.745 1.00 0.00 C ATOM 523 C THR A 34 -19.515 7.428 3.133 1.00 0.00 C ATOM 524 O THR A 34 -19.690 7.122 1.953 1.00 0.00 O ATOM 525 CB THR A 34 -17.524 8.830 3.702 1.00 0.00 C ATOM 526 OG1 THR A 34 -16.300 8.878 4.415 1.00 0.00 O ATOM 527 CG2 THR A 34 -18.438 9.886 4.287 1.00 0.00 C ATOM 0 H THR A 34 -17.093 6.696 2.065 1.00 0.00 H new ATOM 0 HA THR A 34 -18.204 7.100 4.783 1.00 0.00 H new ATOM 0 HB THR A 34 -17.375 9.048 2.645 1.00 0.00 H new ATOM 0 HG1 THR A 34 -15.782 9.657 4.123 1.00 0.00 H new ATOM 0 HG21 THR A 34 -17.954 10.861 4.225 1.00 0.00 H new ATOM 0 HG22 THR A 34 -19.373 9.909 3.727 1.00 0.00 H new ATOM 0 HG23 THR A 34 -18.646 9.650 5.331 1.00 0.00 H new ATOM 535 N ASN A 35 -20.506 7.779 3.945 1.00 0.00 N ATOM 536 CA ASN A 35 -21.889 7.828 3.485 1.00 0.00 C ATOM 537 C ASN A 35 -22.266 9.237 3.040 1.00 0.00 C ATOM 538 O ASN A 35 -22.879 9.994 3.792 1.00 0.00 O ATOM 539 CB ASN A 35 -22.835 7.358 4.594 1.00 0.00 C ATOM 540 CG ASN A 35 -24.297 7.503 4.214 1.00 0.00 C ATOM 541 OD1 ASN A 35 -25.136 7.844 5.047 1.00 0.00 O ATOM 542 ND2 ASN A 35 -24.609 7.242 2.950 1.00 0.00 N ATOM 0 H ASN A 35 -20.378 8.034 4.924 1.00 0.00 H new ATOM 0 HA ASN A 35 -21.985 7.160 2.629 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -22.626 6.314 4.827 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -22.640 7.932 5.500 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -25.576 7.321 2.637 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -23.881 6.962 2.292 1.00 0.00 H new ATOM 549 N ALA A 36 -21.895 9.580 1.811 1.00 0.00 N ATOM 550 CA ALA A 36 -22.194 10.896 1.261 1.00 0.00 C ATOM 551 C ALA A 36 -23.701 11.117 1.129 1.00 0.00 C ATOM 552 O ALA A 36 -24.156 12.249 0.966 1.00 0.00 O ATOM 553 CB ALA A 36 -21.514 11.068 -0.089 1.00 0.00 C ATOM 0 H ALA A 36 -21.386 8.964 1.177 1.00 0.00 H new ATOM 0 HA ALA A 36 -21.807 11.644 1.953 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -21.745 12.055 -0.490 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -20.435 10.969 0.032 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -21.874 10.304 -0.778 1.00 0.00 H new ATOM 559 N GLY A 37 -24.470 10.032 1.199 1.00 0.00 N ATOM 560 CA GLY A 37 -25.914 10.139 1.083 1.00 0.00 C ATOM 561 C GLY A 37 -26.520 11.035 2.146 1.00 0.00 C ATOM 562 O GLY A 37 -25.854 11.928 2.669 1.00 0.00 O ATOM 0 H GLY A 37 -24.119 9.084 1.334 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -26.168 10.529 0.097 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -26.355 9.145 1.156 1.00 0.00 H new ATOM 566 N GLY A 38 -27.788 10.797 2.465 1.00 0.00 N ATOM 567 CA GLY A 38 -28.462 11.597 3.470 1.00 0.00 C ATOM 568 C GLY A 38 -28.886 10.785 4.678 1.00 0.00 C ATOM 569 O GLY A 38 -29.139 11.339 5.748 1.00 0.00 O ATOM 0 H GLY A 38 -28.360 10.064 2.045 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -27.800 12.401 3.792 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -29.340 12.066 3.026 1.00 0.00 H new ATOM 573 N ARG A 39 -28.964 9.469 4.510 1.00 0.00 N ATOM 574 CA ARG A 39 -29.360 8.584 5.599 1.00 0.00 C ATOM 575 C ARG A 39 -28.411 7.395 5.710 1.00 0.00 C ATOM 576 O ARG A 39 -27.608 7.143 4.811 1.00 0.00 O ATOM 577 CB ARG A 39 -30.792 8.089 5.385 1.00 0.00 C ATOM 578 CG ARG A 39 -31.846 8.983 6.017 1.00 0.00 C ATOM 579 CD ARG A 39 -33.229 8.355 5.939 1.00 0.00 C ATOM 580 NE ARG A 39 -33.352 7.189 6.809 1.00 0.00 N ATOM 581 CZ ARG A 39 -33.366 7.259 8.137 1.00 0.00 C ATOM 582 NH1 ARG A 39 -33.264 8.435 8.741 1.00 0.00 N ATOM 583 NH2 ARG A 39 -33.481 6.155 8.860 1.00 0.00 N ATOM 0 H ARG A 39 -28.759 8.993 3.632 1.00 0.00 H new ATOM 0 HA ARG A 39 -29.312 9.151 6.529 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -30.985 8.014 4.315 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -30.885 7.084 5.797 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -31.588 9.170 7.059 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -31.855 9.949 5.513 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -33.979 9.095 6.217 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -33.436 8.062 4.910 1.00 0.00 H new ATOM 0 HE ARG A 39 -33.432 6.270 6.374 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -33.175 9.287 8.187 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -33.275 8.488 9.760 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -33.559 5.249 8.398 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -33.491 6.211 9.878 1.00 0.00 H new ATOM 597 N ARG A 40 -28.509 6.666 6.819 1.00 0.00 N ATOM 598 CA ARG A 40 -27.660 5.502 7.048 1.00 0.00 C ATOM 599 C ARG A 40 -27.675 4.574 5.838 1.00 0.00 C ATOM 600 O ARG A 40 -28.541 4.686 4.970 1.00 0.00 O ATOM 601 CB ARG A 40 -28.126 4.743 8.292 1.00 0.00 C ATOM 602 CG ARG A 40 -28.297 5.629 9.516 1.00 0.00 C ATOM 603 CD ARG A 40 -28.106 4.843 10.804 1.00 0.00 C ATOM 604 NE ARG A 40 -26.697 4.572 11.074 1.00 0.00 N ATOM 605 CZ ARG A 40 -26.275 3.778 12.052 1.00 0.00 C ATOM 606 NH1 ARG A 40 -27.151 3.182 12.850 1.00 0.00 N ATOM 607 NH2 ARG A 40 -24.977 3.580 12.234 1.00 0.00 N ATOM 0 H ARG A 40 -29.168 6.862 7.573 1.00 0.00 H new ATOM 0 HA ARG A 40 -26.639 5.851 7.204 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -29.074 4.252 8.074 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -27.405 3.958 8.520 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -27.578 6.447 9.478 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -29.290 6.077 9.506 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -28.534 5.401 11.637 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -28.651 3.901 10.738 1.00 0.00 H new ATOM 0 HE ARG A 40 -25.998 5.017 10.479 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -28.150 3.333 12.713 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -26.825 2.573 13.600 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -24.301 4.038 11.623 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -24.655 2.970 12.985 1.00 0.00 H new ATOM 621 N ILE A 41 -26.712 3.659 5.783 1.00 0.00 N ATOM 622 CA ILE A 41 -26.623 2.719 4.672 1.00 0.00 C ATOM 623 C ILE A 41 -25.860 1.457 5.058 1.00 0.00 C ATOM 624 O ILE A 41 -24.771 1.527 5.630 1.00 0.00 O ATOM 625 CB ILE A 41 -25.927 3.354 3.454 1.00 0.00 C ATOM 626 CG1 ILE A 41 -24.541 3.872 3.842 1.00 0.00 C ATOM 627 CG2 ILE A 41 -26.776 4.477 2.881 1.00 0.00 C ATOM 628 CD1 ILE A 41 -23.768 4.456 2.680 1.00 0.00 C ATOM 0 H ILE A 41 -25.986 3.549 6.491 1.00 0.00 H new ATOM 0 HA ILE A 41 -27.649 2.455 4.414 1.00 0.00 H new ATOM 0 HB ILE A 41 -25.807 2.589 2.686 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -24.649 4.633 4.615 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -23.965 3.055 4.277 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -26.269 4.914 2.021 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -27.742 4.080 2.569 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -26.927 5.243 3.641 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -22.795 4.803 3.028 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -23.628 3.692 1.915 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -24.323 5.294 2.258 1.00 0.00 H new ATOM 640 N GLY A 42 -26.430 0.305 4.724 1.00 0.00 N ATOM 641 CA GLY A 42 -25.784 -0.958 5.022 1.00 0.00 C ATOM 642 C GLY A 42 -24.964 -1.450 3.846 1.00 0.00 C ATOM 643 O GLY A 42 -25.518 -1.839 2.819 1.00 0.00 O ATOM 0 H GLY A 42 -27.330 0.224 4.251 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -25.140 -0.842 5.894 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -26.538 -1.702 5.279 1.00 0.00 H new ATOM 647 N TRP A 43 -23.642 -1.413 3.987 1.00 0.00 N ATOM 648 CA TRP A 43 -22.750 -1.838 2.915 1.00 0.00 C ATOM 649 C TRP A 43 -22.233 -3.256 3.131 1.00 0.00 C ATOM 650 O TRP A 43 -22.234 -3.770 4.249 1.00 0.00 O ATOM 651 CB TRP A 43 -21.569 -0.872 2.799 1.00 0.00 C ATOM 652 CG TRP A 43 -20.814 -0.702 4.081 1.00 0.00 C ATOM 653 CD1 TRP A 43 -21.039 0.236 5.046 1.00 0.00 C ATOM 654 CD2 TRP A 43 -19.708 -1.492 4.536 1.00 0.00 C ATOM 655 NE1 TRP A 43 -20.141 0.078 6.075 1.00 0.00 N ATOM 656 CE2 TRP A 43 -19.315 -0.975 5.786 1.00 0.00 C ATOM 657 CE3 TRP A 43 -19.015 -2.585 4.011 1.00 0.00 C ATOM 658 CZ2 TRP A 43 -18.258 -1.516 6.515 1.00 0.00 C ATOM 659 CZ3 TRP A 43 -17.967 -3.120 4.736 1.00 0.00 C ATOM 660 CH2 TRP A 43 -17.598 -2.586 5.976 1.00 0.00 C ATOM 0 H TRP A 43 -23.167 -1.094 4.831 1.00 0.00 H new ATOM 0 HA TRP A 43 -23.326 -1.830 1.990 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -20.887 -1.234 2.029 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -21.935 0.100 2.469 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -21.810 0.992 5.007 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -20.097 0.652 6.917 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -19.293 -3.005 3.056 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -17.970 -1.105 7.471 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -17.423 -3.965 4.339 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -16.775 -3.028 6.518 1.00 0.00 H new ATOM 671 N ALA A 44 -21.785 -3.870 2.043 1.00 0.00 N ATOM 672 CA ALA A 44 -21.250 -5.225 2.080 1.00 0.00 C ATOM 673 C ALA A 44 -20.089 -5.365 1.102 1.00 0.00 C ATOM 674 O ALA A 44 -19.996 -4.619 0.127 1.00 0.00 O ATOM 675 CB ALA A 44 -22.340 -6.237 1.761 1.00 0.00 C ATOM 0 H ALA A 44 -21.782 -3.446 1.115 1.00 0.00 H new ATOM 0 HA ALA A 44 -20.880 -5.423 3.086 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -21.923 -7.243 1.793 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -23.141 -6.153 2.495 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -22.738 -6.041 0.766 1.00 0.00 H new ATOM 681 N ILE A 45 -19.202 -6.315 1.370 1.00 0.00 N ATOM 682 CA ILE A 45 -18.045 -6.536 0.512 1.00 0.00 C ATOM 683 C ILE A 45 -18.073 -7.922 -0.121 1.00 0.00 C ATOM 684 O ILE A 45 -18.296 -8.924 0.560 1.00 0.00 O ATOM 685 CB ILE A 45 -16.728 -6.369 1.293 1.00 0.00 C ATOM 686 CG1 ILE A 45 -16.758 -5.076 2.110 1.00 0.00 C ATOM 687 CG2 ILE A 45 -15.543 -6.374 0.339 1.00 0.00 C ATOM 688 CD1 ILE A 45 -16.863 -3.827 1.262 1.00 0.00 C ATOM 0 H ILE A 45 -19.261 -6.943 2.172 1.00 0.00 H new ATOM 0 HA ILE A 45 -18.094 -5.784 -0.276 1.00 0.00 H new ATOM 0 HB ILE A 45 -16.618 -7.208 1.980 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -17.603 -5.110 2.798 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -15.854 -5.018 2.717 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -14.619 -6.255 0.905 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -15.517 -7.319 -0.204 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -15.643 -5.552 -0.369 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -16.879 -2.949 1.908 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -16.005 -3.769 0.592 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -17.780 -3.862 0.675 1.00 0.00 H new ATOM 700 N LYS A 46 -17.839 -7.971 -1.428 1.00 0.00 N ATOM 701 CA LYS A 46 -17.830 -9.232 -2.160 1.00 0.00 C ATOM 702 C LYS A 46 -16.489 -9.443 -2.856 1.00 0.00 C ATOM 703 O LYS A 46 -15.812 -8.484 -3.225 1.00 0.00 O ATOM 704 CB LYS A 46 -18.962 -9.258 -3.188 1.00 0.00 C ATOM 705 CG LYS A 46 -20.237 -9.902 -2.670 1.00 0.00 C ATOM 706 CD LYS A 46 -20.090 -11.410 -2.546 1.00 0.00 C ATOM 707 CE LYS A 46 -21.067 -12.141 -3.451 1.00 0.00 C ATOM 708 NZ LYS A 46 -21.824 -13.194 -2.715 1.00 0.00 N ATOM 0 H LYS A 46 -17.653 -7.150 -2.003 1.00 0.00 H new ATOM 0 HA LYS A 46 -17.981 -10.041 -1.446 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -19.181 -8.237 -3.501 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -18.626 -9.798 -4.073 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -20.490 -9.479 -1.698 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -21.062 -9.670 -3.343 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -19.070 -11.699 -2.801 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -20.257 -11.709 -1.511 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -21.767 -11.426 -3.883 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -20.524 -12.596 -4.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -22.480 -13.670 -3.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -21.158 -13.891 -2.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -22.362 -12.757 -1.940 1.00 0.00 H new ATOM 722 N THR A 47 -16.109 -10.705 -3.031 1.00 0.00 N ATOM 723 CA THR A 47 -14.848 -11.040 -3.681 1.00 0.00 C ATOM 724 C THR A 47 -14.994 -12.290 -4.543 1.00 0.00 C ATOM 725 O THR A 47 -15.848 -13.137 -4.286 1.00 0.00 O ATOM 726 CB THR A 47 -13.750 -11.252 -2.637 1.00 0.00 C ATOM 727 OG1 THR A 47 -13.988 -12.433 -1.892 1.00 0.00 O ATOM 728 CG2 THR A 47 -13.628 -10.106 -1.656 1.00 0.00 C ATOM 0 H THR A 47 -16.657 -11.512 -2.732 1.00 0.00 H new ATOM 0 HA THR A 47 -14.570 -10.206 -4.326 1.00 0.00 H new ATOM 0 HB THR A 47 -12.822 -11.324 -3.204 1.00 0.00 H new ATOM 0 HG1 THR A 47 -13.274 -12.552 -1.231 1.00 0.00 H new ATOM 0 HG21 THR A 47 -12.832 -10.320 -0.943 1.00 0.00 H new ATOM 0 HG22 THR A 47 -13.395 -9.188 -2.196 1.00 0.00 H new ATOM 0 HG23 THR A 47 -14.570 -9.983 -1.121 1.00 0.00 H new ATOM 736 N THR A 48 -14.154 -12.398 -5.567 1.00 0.00 N ATOM 737 CA THR A 48 -14.189 -13.543 -6.469 1.00 0.00 C ATOM 738 C THR A 48 -13.922 -14.841 -5.714 1.00 0.00 C ATOM 739 O THR A 48 -14.578 -15.856 -5.951 1.00 0.00 O ATOM 740 CB THR A 48 -13.158 -13.370 -7.585 1.00 0.00 C ATOM 741 OG1 THR A 48 -12.029 -12.653 -7.121 1.00 0.00 O ATOM 742 CG2 THR A 48 -13.703 -12.638 -8.792 1.00 0.00 C ATOM 0 H THR A 48 -13.440 -11.706 -5.793 1.00 0.00 H new ATOM 0 HA THR A 48 -15.186 -13.597 -6.907 1.00 0.00 H new ATOM 0 HB THR A 48 -12.885 -14.382 -7.885 1.00 0.00 H new ATOM 0 HG1 THR A 48 -11.227 -13.209 -7.215 1.00 0.00 H new ATOM 0 HG21 THR A 48 -12.922 -12.549 -9.547 1.00 0.00 H new ATOM 0 HG22 THR A 48 -14.545 -13.194 -9.205 1.00 0.00 H new ATOM 0 HG23 THR A 48 -14.036 -11.644 -8.495 1.00 0.00 H new ATOM 750 N ASN A 49 -12.956 -14.800 -4.804 1.00 0.00 N ATOM 751 CA ASN A 49 -12.599 -15.973 -4.013 1.00 0.00 C ATOM 752 C ASN A 49 -12.510 -15.624 -2.531 1.00 0.00 C ATOM 753 O ASN A 49 -11.649 -14.847 -2.118 1.00 0.00 O ATOM 754 CB ASN A 49 -11.267 -16.552 -4.494 1.00 0.00 C ATOM 755 CG ASN A 49 -11.401 -17.292 -5.810 1.00 0.00 C ATOM 756 OD1 ASN A 49 -12.360 -18.034 -6.025 1.00 0.00 O ATOM 757 ND2 ASN A 49 -10.434 -17.095 -6.699 1.00 0.00 N ATOM 0 H ASN A 49 -12.405 -13.967 -4.595 1.00 0.00 H new ATOM 0 HA ASN A 49 -13.381 -16.721 -4.145 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -10.542 -15.745 -4.606 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -10.874 -17.231 -3.737 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -10.468 -17.568 -7.602 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -9.658 -16.471 -6.478 1.00 0.00 H new ATOM 764 N MET A 50 -13.404 -16.204 -1.738 1.00 0.00 N ATOM 765 CA MET A 50 -13.424 -15.955 -0.301 1.00 0.00 C ATOM 766 C MET A 50 -12.616 -17.009 0.452 1.00 0.00 C ATOM 767 O MET A 50 -12.805 -17.208 1.651 1.00 0.00 O ATOM 768 CB MET A 50 -14.864 -15.938 0.215 1.00 0.00 C ATOM 769 CG MET A 50 -15.477 -14.548 0.264 1.00 0.00 C ATOM 770 SD MET A 50 -16.177 -14.154 1.879 1.00 0.00 S ATOM 771 CE MET A 50 -14.889 -13.112 2.559 1.00 0.00 C ATOM 0 H MET A 50 -14.123 -16.849 -2.065 1.00 0.00 H new ATOM 0 HA MET A 50 -12.968 -14.981 -0.124 1.00 0.00 H new ATOM 0 HB2 MET A 50 -15.477 -16.574 -0.423 1.00 0.00 H new ATOM 0 HB3 MET A 50 -14.888 -16.372 1.215 1.00 0.00 H new ATOM 0 HG2 MET A 50 -14.715 -13.810 0.013 1.00 0.00 H new ATOM 0 HG3 MET A 50 -16.257 -14.472 -0.494 1.00 0.00 H new ATOM 0 HE1 MET A 50 -15.175 -12.786 3.559 1.00 0.00 H new ATOM 0 HE2 MET A 50 -13.957 -13.674 2.613 1.00 0.00 H new ATOM 0 HE3 MET A 50 -14.750 -12.240 1.919 1.00 0.00 H new ATOM 781 N ARG A 51 -11.714 -17.683 -0.257 1.00 0.00 N ATOM 782 CA ARG A 51 -10.880 -18.713 0.352 1.00 0.00 C ATOM 783 C ARG A 51 -9.516 -18.149 0.736 1.00 0.00 C ATOM 784 O ARG A 51 -8.905 -18.584 1.712 1.00 0.00 O ATOM 785 CB ARG A 51 -10.708 -19.893 -0.605 1.00 0.00 C ATOM 786 CG ARG A 51 -10.163 -19.499 -1.968 1.00 0.00 C ATOM 787 CD ARG A 51 -9.601 -20.701 -2.710 1.00 0.00 C ATOM 788 NE ARG A 51 -10.568 -21.265 -3.649 1.00 0.00 N ATOM 789 CZ ARG A 51 -10.257 -22.167 -4.573 1.00 0.00 C ATOM 790 NH1 ARG A 51 -9.011 -22.608 -4.678 1.00 0.00 N ATOM 791 NH2 ARG A 51 -11.190 -22.629 -5.393 1.00 0.00 N ATOM 0 H ARG A 51 -11.543 -17.534 -1.251 1.00 0.00 H new ATOM 0 HA ARG A 51 -11.377 -19.061 1.257 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -10.036 -20.622 -0.152 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -11.671 -20.386 -0.737 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -10.956 -19.042 -2.560 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -9.383 -18.748 -1.846 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -8.701 -20.406 -3.250 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -9.305 -21.465 -1.991 1.00 0.00 H new ATOM 0 HE ARG A 51 -11.536 -20.948 -3.592 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -8.290 -22.255 -4.049 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -8.773 -23.301 -5.388 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -12.150 -22.292 -5.315 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -10.949 -23.322 -6.102 1.00 0.00 H new ATOM 805 N ARG A 52 -9.046 -17.177 -0.038 1.00 0.00 N ATOM 806 CA ARG A 52 -7.755 -16.549 0.220 1.00 0.00 C ATOM 807 C ARG A 52 -7.927 -15.087 0.630 1.00 0.00 C ATOM 808 O ARG A 52 -7.027 -14.491 1.220 1.00 0.00 O ATOM 809 CB ARG A 52 -6.862 -16.641 -1.019 1.00 0.00 C ATOM 810 CG ARG A 52 -7.610 -16.447 -2.328 1.00 0.00 C ATOM 811 CD ARG A 52 -6.700 -16.667 -3.525 1.00 0.00 C ATOM 812 NE ARG A 52 -6.932 -15.683 -4.578 1.00 0.00 N ATOM 813 CZ ARG A 52 -6.564 -15.858 -5.844 1.00 0.00 C ATOM 814 NH1 ARG A 52 -5.951 -16.976 -6.208 1.00 0.00 N ATOM 815 NH2 ARG A 52 -6.807 -14.916 -6.744 1.00 0.00 N ATOM 0 H ARG A 52 -9.540 -16.806 -0.850 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.281 -17.083 1.043 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -6.076 -15.890 -0.946 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -6.372 -17.615 -1.032 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -8.450 -17.140 -2.375 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -8.026 -15.440 -2.365 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -5.660 -16.615 -3.204 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -6.861 -17.669 -3.923 1.00 0.00 H new ATOM 0 HE ARG A 52 -7.402 -14.813 -4.329 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -5.762 -17.702 -5.517 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -5.669 -17.110 -7.179 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -7.277 -14.054 -6.466 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -6.524 -15.053 -7.714 1.00 0.00 H new ATOM 829 N LEU A 53 -9.087 -14.513 0.316 1.00 0.00 N ATOM 830 CA LEU A 53 -9.368 -13.122 0.655 1.00 0.00 C ATOM 831 C LEU A 53 -10.390 -13.032 1.784 1.00 0.00 C ATOM 832 O LEU A 53 -11.426 -13.695 1.750 1.00 0.00 O ATOM 833 CB LEU A 53 -9.881 -12.371 -0.574 1.00 0.00 C ATOM 834 CG LEU A 53 -9.138 -12.674 -1.875 1.00 0.00 C ATOM 835 CD1 LEU A 53 -9.917 -12.147 -3.071 1.00 0.00 C ATOM 836 CD2 LEU A 53 -7.741 -12.073 -1.839 1.00 0.00 C ATOM 0 H LEU A 53 -9.845 -14.990 -0.172 1.00 0.00 H new ATOM 0 HA LEU A 53 -8.440 -12.662 0.993 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -10.936 -12.609 -0.712 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -9.819 -11.300 -0.379 1.00 0.00 H new ATOM 0 HG LEU A 53 -9.046 -13.755 -1.977 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -9.372 -12.372 -3.988 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -10.897 -12.623 -3.105 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -10.040 -11.068 -2.978 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -7.224 -12.297 -2.772 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -7.813 -10.993 -1.714 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -7.183 -12.498 -1.004 1.00 0.00 H new ATOM 848 N SER A 54 -10.092 -12.206 2.783 1.00 0.00 N ATOM 849 CA SER A 54 -10.989 -12.030 3.920 1.00 0.00 C ATOM 850 C SER A 54 -11.012 -10.576 4.380 1.00 0.00 C ATOM 851 O SER A 54 -10.051 -10.086 4.972 1.00 0.00 O ATOM 852 CB SER A 54 -10.566 -12.934 5.078 1.00 0.00 C ATOM 853 OG SER A 54 -9.839 -14.057 4.610 1.00 0.00 O ATOM 0 H SER A 54 -9.238 -11.649 2.828 1.00 0.00 H new ATOM 0 HA SER A 54 -11.993 -12.307 3.599 1.00 0.00 H new ATOM 0 HB2 SER A 54 -9.954 -12.368 5.780 1.00 0.00 H new ATOM 0 HB3 SER A 54 -11.449 -13.270 5.623 1.00 0.00 H new ATOM 0 HG SER A 54 -9.579 -14.618 5.370 1.00 0.00 H new ATOM 859 N VAL A 55 -12.119 -9.894 4.106 1.00 0.00 N ATOM 860 CA VAL A 55 -12.272 -8.500 4.493 1.00 0.00 C ATOM 861 C VAL A 55 -13.120 -8.372 5.753 1.00 0.00 C ATOM 862 O VAL A 55 -14.230 -8.898 5.823 1.00 0.00 O ATOM 863 CB VAL A 55 -12.921 -7.671 3.367 1.00 0.00 C ATOM 864 CG1 VAL A 55 -11.874 -7.218 2.362 1.00 0.00 C ATOM 865 CG2 VAL A 55 -14.025 -8.461 2.680 1.00 0.00 C ATOM 0 H VAL A 55 -12.923 -10.286 3.617 1.00 0.00 H new ATOM 0 HA VAL A 55 -11.271 -8.114 4.688 1.00 0.00 H new ATOM 0 HB VAL A 55 -13.370 -6.784 3.814 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.353 -6.635 1.576 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -11.128 -6.604 2.866 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -11.390 -8.090 1.923 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -14.468 -7.855 1.889 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -13.607 -9.371 2.249 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -14.792 -8.724 3.409 1.00 0.00 H new ATOM 875 N ASP A 56 -12.589 -7.669 6.749 1.00 0.00 N ATOM 876 CA ASP A 56 -13.300 -7.473 8.007 1.00 0.00 C ATOM 877 C ASP A 56 -13.292 -5.998 8.415 1.00 0.00 C ATOM 878 O ASP A 56 -12.239 -5.359 8.411 1.00 0.00 O ATOM 879 CB ASP A 56 -12.663 -8.320 9.110 1.00 0.00 C ATOM 880 CG ASP A 56 -13.109 -9.768 9.060 1.00 0.00 C ATOM 881 OD1 ASP A 56 -14.319 -10.022 9.231 1.00 0.00 O ATOM 882 OD2 ASP A 56 -12.248 -10.647 8.849 1.00 0.00 O ATOM 0 H ASP A 56 -11.671 -7.227 6.709 1.00 0.00 H new ATOM 0 HA ASP A 56 -14.334 -7.787 7.865 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -11.578 -8.274 9.018 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -12.919 -7.898 10.082 1.00 0.00 H new ATOM 887 N PRO A 57 -14.462 -5.426 8.774 1.00 0.00 N ATOM 888 CA PRO A 57 -15.747 -6.136 8.797 1.00 0.00 C ATOM 889 C PRO A 57 -16.281 -6.399 7.391 1.00 0.00 C ATOM 890 O PRO A 57 -16.135 -5.564 6.498 1.00 0.00 O ATOM 891 CB PRO A 57 -16.687 -5.182 9.552 1.00 0.00 C ATOM 892 CG PRO A 57 -15.818 -4.091 10.089 1.00 0.00 C ATOM 893 CD PRO A 57 -14.619 -4.030 9.189 1.00 0.00 C ATOM 0 HA PRO A 57 -15.657 -7.116 9.266 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -17.452 -4.781 8.888 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -17.205 -5.701 10.358 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -16.348 -3.139 10.096 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -15.523 -4.299 11.117 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -14.784 -3.370 8.338 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -13.737 -3.661 9.712 1.00 0.00 H new ATOM 901 N PRO A 58 -16.914 -7.566 7.173 1.00 0.00 N ATOM 902 CA PRO A 58 -17.472 -7.926 5.865 1.00 0.00 C ATOM 903 C PRO A 58 -18.634 -7.021 5.470 1.00 0.00 C ATOM 904 O PRO A 58 -18.850 -6.747 4.290 1.00 0.00 O ATOM 905 CB PRO A 58 -17.956 -9.366 6.062 1.00 0.00 C ATOM 906 CG PRO A 58 -18.167 -9.502 7.531 1.00 0.00 C ATOM 907 CD PRO A 58 -17.138 -8.618 8.179 1.00 0.00 C ATOM 0 HA PRO A 58 -16.739 -7.820 5.065 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -18.878 -9.552 5.512 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -17.219 -10.083 5.701 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -19.175 -9.197 7.811 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.048 -10.538 7.848 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -17.499 -8.204 9.121 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -16.221 -9.164 8.401 1.00 0.00 H new ATOM 915 N CYS A 59 -19.375 -6.556 6.469 1.00 0.00 N ATOM 916 CA CYS A 59 -20.514 -5.676 6.238 1.00 0.00 C ATOM 917 C CYS A 59 -20.653 -4.673 7.377 1.00 0.00 C ATOM 918 O CYS A 59 -19.842 -4.657 8.303 1.00 0.00 O ATOM 919 CB CYS A 59 -21.800 -6.496 6.104 1.00 0.00 C ATOM 920 SG CYS A 59 -21.999 -7.769 7.373 1.00 0.00 S ATOM 0 H CYS A 59 -19.206 -6.775 7.451 1.00 0.00 H new ATOM 0 HA CYS A 59 -20.344 -5.130 5.310 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -22.655 -5.821 6.145 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -21.815 -6.971 5.123 1.00 0.00 H new ATOM 0 HG CYS A 59 -23.253 -7.859 7.705 1.00 0.00 H new ATOM 926 N GLY A 60 -21.683 -3.838 7.307 1.00 0.00 N ATOM 927 CA GLY A 60 -21.899 -2.847 8.344 1.00 0.00 C ATOM 928 C GLY A 60 -22.866 -1.761 7.919 1.00 0.00 C ATOM 929 O GLY A 60 -23.502 -1.862 6.870 1.00 0.00 O ATOM 0 H GLY A 60 -22.370 -3.829 6.553 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -22.281 -3.339 9.238 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -20.945 -2.394 8.613 1.00 0.00 H new ATOM 933 N VAL A 61 -22.976 -0.719 8.737 1.00 0.00 N ATOM 934 CA VAL A 61 -23.870 0.394 8.446 1.00 0.00 C ATOM 935 C VAL A 61 -23.318 1.695 9.020 1.00 0.00 C ATOM 936 O VAL A 61 -22.954 1.759 10.194 1.00 0.00 O ATOM 937 CB VAL A 61 -25.277 0.150 9.020 1.00 0.00 C ATOM 938 CG1 VAL A 61 -25.227 0.058 10.538 1.00 0.00 C ATOM 939 CG2 VAL A 61 -26.234 1.245 8.575 1.00 0.00 C ATOM 0 H VAL A 61 -22.455 -0.623 9.609 1.00 0.00 H new ATOM 0 HA VAL A 61 -23.940 0.474 7.361 1.00 0.00 H new ATOM 0 HB VAL A 61 -25.646 -0.800 8.634 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -26.231 -0.115 10.925 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -24.578 -0.767 10.831 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -24.836 0.990 10.946 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -27.223 1.055 8.991 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -25.872 2.211 8.928 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -26.294 1.256 7.487 1.00 0.00 H new ATOM 949 N LEU A 62 -23.254 2.729 8.188 1.00 0.00 N ATOM 950 CA LEU A 62 -22.740 4.022 8.624 1.00 0.00 C ATOM 951 C LEU A 62 -23.746 5.135 8.349 1.00 0.00 C ATOM 952 O LEU A 62 -24.572 5.029 7.442 1.00 0.00 O ATOM 953 CB LEU A 62 -21.415 4.330 7.926 1.00 0.00 C ATOM 954 CG LEU A 62 -21.517 4.581 6.420 1.00 0.00 C ATOM 955 CD1 LEU A 62 -20.494 5.618 5.982 1.00 0.00 C ATOM 956 CD2 LEU A 62 -21.326 3.283 5.651 1.00 0.00 C ATOM 0 H LEU A 62 -23.550 2.697 7.212 1.00 0.00 H new ATOM 0 HA LEU A 62 -22.573 3.971 9.700 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -20.970 5.208 8.395 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -20.732 3.498 8.094 1.00 0.00 H new ATOM 0 HG LEU A 62 -22.512 4.967 6.201 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -20.581 5.784 4.908 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -20.676 6.554 6.510 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -19.491 5.260 6.214 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -21.402 3.479 4.581 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -20.343 2.868 5.875 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -22.096 2.570 5.944 1.00 0.00 H new ATOM 968 N ASP A 63 -23.669 6.198 9.141 1.00 0.00 N ATOM 969 CA ASP A 63 -24.570 7.334 8.988 1.00 0.00 C ATOM 970 C ASP A 63 -23.987 8.367 8.027 1.00 0.00 C ATOM 971 O ASP A 63 -22.813 8.297 7.662 1.00 0.00 O ATOM 972 CB ASP A 63 -24.839 7.978 10.350 1.00 0.00 C ATOM 973 CG ASP A 63 -23.567 8.211 11.140 1.00 0.00 C ATOM 974 OD1 ASP A 63 -22.820 9.154 10.800 1.00 0.00 O ATOM 975 OD2 ASP A 63 -23.316 7.451 12.100 1.00 0.00 O ATOM 0 H ASP A 63 -22.991 6.297 9.897 1.00 0.00 H new ATOM 0 HA ASP A 63 -25.510 6.971 8.571 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -25.352 8.928 10.204 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -25.509 7.339 10.925 1.00 0.00 H new ATOM 980 N PRO A 64 -24.803 9.345 7.598 1.00 0.00 N ATOM 981 CA PRO A 64 -24.359 10.392 6.674 1.00 0.00 C ATOM 982 C PRO A 64 -23.234 11.240 7.260 1.00 0.00 C ATOM 983 O PRO A 64 -23.307 11.677 8.409 1.00 0.00 O ATOM 984 CB PRO A 64 -25.615 11.247 6.457 1.00 0.00 C ATOM 985 CG PRO A 64 -26.753 10.381 6.878 1.00 0.00 C ATOM 986 CD PRO A 64 -26.217 9.506 7.973 1.00 0.00 C ATOM 0 HA PRO A 64 -23.954 9.972 5.753 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -25.576 12.162 7.049 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -25.713 11.546 5.413 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -27.591 10.981 7.232 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -27.119 9.783 6.043 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -26.325 9.972 8.953 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -26.736 8.548 8.016 1.00 0.00 H new ATOM 994 N LYS A 65 -22.197 11.473 6.459 1.00 0.00 N ATOM 995 CA LYS A 65 -21.050 12.276 6.886 1.00 0.00 C ATOM 996 C LYS A 65 -20.109 11.485 7.798 1.00 0.00 C ATOM 997 O LYS A 65 -19.218 12.061 8.422 1.00 0.00 O ATOM 998 CB LYS A 65 -21.516 13.548 7.601 1.00 0.00 C ATOM 999 CG LYS A 65 -20.444 14.622 7.693 1.00 0.00 C ATOM 1000 CD LYS A 65 -21.049 15.991 7.959 1.00 0.00 C ATOM 1001 CE LYS A 65 -20.188 17.104 7.382 1.00 0.00 C ATOM 1002 NZ LYS A 65 -18.889 17.226 8.098 1.00 0.00 N ATOM 0 H LYS A 65 -22.126 11.116 5.506 1.00 0.00 H new ATOM 0 HA LYS A 65 -20.498 12.550 5.987 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -22.381 13.954 7.076 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -21.846 13.289 8.607 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -19.744 14.371 8.490 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -19.874 14.649 6.764 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -22.047 16.039 7.524 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -21.162 16.137 9.033 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -20.004 16.910 6.325 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -20.727 18.049 7.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -18.331 17.995 7.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -19.064 17.436 9.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -18.363 16.332 8.018 1.00 0.00 H new ATOM 1016 N GLU A 66 -20.301 10.170 7.874 1.00 0.00 N ATOM 1017 CA GLU A 66 -19.453 9.330 8.708 1.00 0.00 C ATOM 1018 C GLU A 66 -18.533 8.472 7.832 1.00 0.00 C ATOM 1019 O GLU A 66 -18.932 8.008 6.762 1.00 0.00 O ATOM 1020 CB GLU A 66 -20.333 8.473 9.647 1.00 0.00 C ATOM 1021 CG GLU A 66 -19.858 7.041 9.869 1.00 0.00 C ATOM 1022 CD GLU A 66 -18.610 6.965 10.727 1.00 0.00 C ATOM 1023 OE1 GLU A 66 -18.013 8.026 11.003 1.00 0.00 O ATOM 1024 OE2 GLU A 66 -18.230 5.843 11.125 1.00 0.00 O ATOM 0 H GLU A 66 -21.032 9.668 7.371 1.00 0.00 H new ATOM 0 HA GLU A 66 -18.813 9.954 9.332 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -20.393 8.971 10.615 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -21.344 8.443 9.241 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -20.655 6.467 10.342 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -19.660 6.575 8.904 1.00 0.00 H new ATOM 1031 N LYS A 67 -17.303 8.274 8.297 1.00 0.00 N ATOM 1032 CA LYS A 67 -16.322 7.480 7.564 1.00 0.00 C ATOM 1033 C LYS A 67 -16.253 6.056 8.102 1.00 0.00 C ATOM 1034 O LYS A 67 -16.685 5.779 9.220 1.00 0.00 O ATOM 1035 CB LYS A 67 -14.941 8.134 7.653 1.00 0.00 C ATOM 1036 CG LYS A 67 -14.944 9.614 7.312 1.00 0.00 C ATOM 1037 CD LYS A 67 -13.634 10.276 7.707 1.00 0.00 C ATOM 1038 CE LYS A 67 -13.871 11.587 8.441 1.00 0.00 C ATOM 1039 NZ LYS A 67 -13.542 11.479 9.890 1.00 0.00 N ATOM 0 H LYS A 67 -16.961 8.653 9.180 1.00 0.00 H new ATOM 0 HA LYS A 67 -16.636 7.438 6.521 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -14.551 8.003 8.663 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -14.259 7.616 6.979 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -15.110 9.742 6.242 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -15.771 10.105 7.824 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -13.061 9.601 8.342 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -13.035 10.460 6.815 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -13.264 12.371 7.988 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -14.913 11.884 8.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -13.717 12.393 10.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -14.138 10.748 10.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -12.541 11.221 10.000 1.00 0.00 H new ATOM 1053 N VAL A 68 -15.704 5.161 7.291 1.00 0.00 N ATOM 1054 CA VAL A 68 -15.570 3.760 7.673 1.00 0.00 C ATOM 1055 C VAL A 68 -14.187 3.223 7.313 1.00 0.00 C ATOM 1056 O VAL A 68 -13.630 3.566 6.271 1.00 0.00 O ATOM 1057 CB VAL A 68 -16.640 2.887 6.989 1.00 0.00 C ATOM 1058 CG1 VAL A 68 -16.554 1.451 7.482 1.00 0.00 C ATOM 1059 CG2 VAL A 68 -18.028 3.458 7.229 1.00 0.00 C ATOM 0 H VAL A 68 -15.343 5.380 6.362 1.00 0.00 H new ATOM 0 HA VAL A 68 -15.707 3.711 8.753 1.00 0.00 H new ATOM 0 HB VAL A 68 -16.452 2.889 5.915 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -17.317 0.850 6.988 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -15.568 1.046 7.252 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -16.714 1.426 8.560 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -18.770 2.828 6.739 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -18.229 3.489 8.300 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -18.082 4.467 6.821 1.00 0.00 H new ATOM 1069 N LEU A 69 -13.639 2.381 8.184 1.00 0.00 N ATOM 1070 CA LEU A 69 -12.321 1.799 7.957 1.00 0.00 C ATOM 1071 C LEU A 69 -12.407 0.279 7.849 1.00 0.00 C ATOM 1072 O LEU A 69 -12.823 -0.398 8.788 1.00 0.00 O ATOM 1073 CB LEU A 69 -11.368 2.189 9.089 1.00 0.00 C ATOM 1074 CG LEU A 69 -10.830 3.620 9.016 1.00 0.00 C ATOM 1075 CD1 LEU A 69 -10.192 4.018 10.338 1.00 0.00 C ATOM 1076 CD2 LEU A 69 -9.831 3.756 7.878 1.00 0.00 C ATOM 0 H LEU A 69 -14.087 2.087 9.052 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.936 2.190 7.015 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -11.885 2.059 10.040 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -10.524 1.499 9.088 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.665 4.293 8.822 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.815 5.038 10.268 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.936 3.960 11.133 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -9.367 3.341 10.562 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.459 4.780 7.841 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.998 3.073 8.042 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -10.319 3.513 6.934 1.00 0.00 H new ATOM 1088 N MET A 70 -12.010 -0.248 6.695 1.00 0.00 N ATOM 1089 CA MET A 70 -12.040 -1.688 6.460 1.00 0.00 C ATOM 1090 C MET A 70 -10.629 -2.248 6.340 1.00 0.00 C ATOM 1091 O MET A 70 -9.683 -1.518 6.046 1.00 0.00 O ATOM 1092 CB MET A 70 -12.834 -2.001 5.191 1.00 0.00 C ATOM 1093 CG MET A 70 -14.093 -1.163 5.035 1.00 0.00 C ATOM 1094 SD MET A 70 -15.155 -1.746 3.701 1.00 0.00 S ATOM 1095 CE MET A 70 -13.948 -2.039 2.412 1.00 0.00 C ATOM 0 H MET A 70 -11.664 0.300 5.908 1.00 0.00 H new ATOM 0 HA MET A 70 -12.528 -2.160 7.312 1.00 0.00 H new ATOM 0 HB2 MET A 70 -12.193 -1.843 4.324 1.00 0.00 H new ATOM 0 HB3 MET A 70 -13.109 -3.056 5.196 1.00 0.00 H new ATOM 0 HG2 MET A 70 -14.652 -1.176 5.971 1.00 0.00 H new ATOM 0 HG3 MET A 70 -13.814 -0.127 4.845 1.00 0.00 H new ATOM 0 HE1 MET A 70 -14.461 -2.267 1.478 1.00 0.00 H new ATOM 0 HE2 MET A 70 -13.333 -1.149 2.280 1.00 0.00 H new ATOM 0 HE3 MET A 70 -13.313 -2.880 2.692 1.00 0.00 H new ATOM 1105 N ALA A 71 -10.495 -3.547 6.573 1.00 0.00 N ATOM 1106 CA ALA A 71 -9.198 -4.208 6.493 1.00 0.00 C ATOM 1107 C ALA A 71 -9.250 -5.415 5.562 1.00 0.00 C ATOM 1108 O ALA A 71 -9.745 -6.478 5.935 1.00 0.00 O ATOM 1109 CB ALA A 71 -8.732 -4.629 7.879 1.00 0.00 C ATOM 0 H ALA A 71 -11.269 -4.165 6.819 1.00 0.00 H new ATOM 0 HA ALA A 71 -8.483 -3.496 6.081 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -7.762 -5.121 7.803 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -8.643 -3.749 8.516 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -9.456 -5.319 8.312 1.00 0.00 H new ATOM 1115 N VAL A 72 -8.734 -5.244 4.349 1.00 0.00 N ATOM 1116 CA VAL A 72 -8.720 -6.321 3.365 1.00 0.00 C ATOM 1117 C VAL A 72 -7.464 -7.174 3.513 1.00 0.00 C ATOM 1118 O VAL A 72 -6.359 -6.728 3.204 1.00 0.00 O ATOM 1119 CB VAL A 72 -8.790 -5.771 1.928 1.00 0.00 C ATOM 1120 CG1 VAL A 72 -7.638 -4.816 1.663 1.00 0.00 C ATOM 1121 CG2 VAL A 72 -8.791 -6.910 0.920 1.00 0.00 C ATOM 0 H VAL A 72 -8.320 -4.370 4.024 1.00 0.00 H new ATOM 0 HA VAL A 72 -9.601 -6.936 3.550 1.00 0.00 H new ATOM 0 HB VAL A 72 -9.722 -5.217 1.817 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -7.706 -4.439 0.643 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -7.689 -3.982 2.363 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -6.692 -5.342 1.793 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -8.841 -6.502 -0.090 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -7.878 -7.495 1.031 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -9.655 -7.551 1.096 1.00 0.00 H new ATOM 1131 N SER A 73 -7.640 -8.401 3.994 1.00 0.00 N ATOM 1132 CA SER A 73 -6.518 -9.312 4.188 1.00 0.00 C ATOM 1133 C SER A 73 -6.283 -10.173 2.951 1.00 0.00 C ATOM 1134 O SER A 73 -7.211 -10.788 2.425 1.00 0.00 O ATOM 1135 CB SER A 73 -6.766 -10.206 5.404 1.00 0.00 C ATOM 1136 OG SER A 73 -6.980 -9.432 6.572 1.00 0.00 O ATOM 0 H SER A 73 -8.547 -8.786 4.256 1.00 0.00 H new ATOM 0 HA SER A 73 -5.625 -8.710 4.359 1.00 0.00 H new ATOM 0 HB2 SER A 73 -7.633 -10.841 5.221 1.00 0.00 H new ATOM 0 HB3 SER A 73 -5.912 -10.867 5.553 1.00 0.00 H new ATOM 0 HG SER A 73 -6.228 -8.816 6.699 1.00 0.00 H new ATOM 1142 N CYS A 74 -5.035 -10.214 2.496 1.00 0.00 N ATOM 1143 CA CYS A 74 -4.671 -11.002 1.325 1.00 0.00 C ATOM 1144 C CYS A 74 -3.720 -12.131 1.710 1.00 0.00 C ATOM 1145 O CYS A 74 -2.956 -12.010 2.668 1.00 0.00 O ATOM 1146 CB CYS A 74 -4.021 -10.111 0.264 1.00 0.00 C ATOM 1147 SG CYS A 74 -3.417 -11.008 -1.184 1.00 0.00 S ATOM 0 H CYS A 74 -4.257 -9.709 2.922 1.00 0.00 H new ATOM 0 HA CYS A 74 -5.581 -11.438 0.912 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -4.745 -9.364 -0.061 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -3.189 -9.572 0.717 1.00 0.00 H new ATOM 0 HG CYS A 74 -2.887 -10.169 -2.024 1.00 0.00 H new ATOM 1153 N ASP A 75 -3.773 -13.227 0.962 1.00 0.00 N ATOM 1154 CA ASP A 75 -2.915 -14.376 1.231 1.00 0.00 C ATOM 1155 C ASP A 75 -1.839 -14.521 0.160 1.00 0.00 C ATOM 1156 O ASP A 75 -2.013 -14.076 -0.974 1.00 0.00 O ATOM 1157 CB ASP A 75 -3.751 -15.655 1.306 1.00 0.00 C ATOM 1158 CG ASP A 75 -3.855 -16.195 2.719 1.00 0.00 C ATOM 1159 OD1 ASP A 75 -2.859 -16.101 3.466 1.00 0.00 O ATOM 1160 OD2 ASP A 75 -4.934 -16.713 3.079 1.00 0.00 O ATOM 0 H ASP A 75 -4.400 -13.345 0.166 1.00 0.00 H new ATOM 0 HA ASP A 75 -2.424 -14.212 2.190 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -4.751 -15.455 0.922 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -3.308 -16.414 0.661 1.00 0.00 H new ATOM 1165 N THR A 76 -0.728 -15.149 0.531 1.00 0.00 N ATOM 1166 CA THR A 76 0.378 -15.358 -0.394 1.00 0.00 C ATOM 1167 C THR A 76 -0.080 -16.151 -1.614 1.00 0.00 C ATOM 1168 O THR A 76 -1.115 -16.815 -1.581 1.00 0.00 O ATOM 1169 CB THR A 76 1.521 -16.095 0.305 1.00 0.00 C ATOM 1170 OG1 THR A 76 1.278 -17.489 0.332 1.00 0.00 O ATOM 1171 CG2 THR A 76 1.750 -15.640 1.731 1.00 0.00 C ATOM 0 H THR A 76 -0.570 -15.522 1.467 1.00 0.00 H new ATOM 0 HA THR A 76 0.733 -14.382 -0.726 1.00 0.00 H new ATOM 0 HB THR A 76 2.411 -15.860 -0.279 1.00 0.00 H new ATOM 0 HG1 THR A 76 2.022 -17.942 0.782 1.00 0.00 H new ATOM 0 HG21 THR A 76 2.575 -16.205 2.165 1.00 0.00 H new ATOM 0 HG22 THR A 76 1.994 -14.578 1.739 1.00 0.00 H new ATOM 0 HG23 THR A 76 0.846 -15.809 2.317 1.00 0.00 H new ATOM 1179 N PHE A 77 0.698 -16.077 -2.690 1.00 0.00 N ATOM 1180 CA PHE A 77 0.369 -16.791 -3.919 1.00 0.00 C ATOM 1181 C PHE A 77 1.497 -16.668 -4.940 1.00 0.00 C ATOM 1182 O PHE A 77 2.610 -16.265 -4.604 1.00 0.00 O ATOM 1183 CB PHE A 77 -0.940 -16.257 -4.512 1.00 0.00 C ATOM 1184 CG PHE A 77 -0.808 -14.903 -5.154 1.00 0.00 C ATOM 1185 CD1 PHE A 77 -0.262 -13.840 -4.454 1.00 0.00 C ATOM 1186 CD2 PHE A 77 -1.232 -14.697 -6.457 1.00 0.00 C ATOM 1187 CE1 PHE A 77 -0.140 -12.595 -5.042 1.00 0.00 C ATOM 1188 CE2 PHE A 77 -1.113 -13.455 -7.050 1.00 0.00 C ATOM 1189 CZ PHE A 77 -0.565 -12.402 -6.342 1.00 0.00 C ATOM 0 H PHE A 77 1.558 -15.531 -2.736 1.00 0.00 H new ATOM 0 HA PHE A 77 0.242 -17.845 -3.674 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -1.308 -16.966 -5.254 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -1.690 -16.203 -3.723 1.00 0.00 H new ATOM 0 HD1 PHE A 77 0.072 -13.985 -3.437 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -1.660 -15.516 -7.015 1.00 0.00 H new ATOM 0 HE1 PHE A 77 0.287 -11.774 -4.485 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -1.448 -13.307 -8.066 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.469 -11.431 -6.804 1.00 0.00 H new ATOM 1199 N ASN A 78 1.199 -17.017 -6.188 1.00 0.00 N ATOM 1200 CA ASN A 78 2.186 -16.944 -7.257 1.00 0.00 C ATOM 1201 C ASN A 78 1.703 -16.036 -8.383 1.00 0.00 C ATOM 1202 O ASN A 78 1.165 -16.505 -9.385 1.00 0.00 O ATOM 1203 CB ASN A 78 2.479 -18.340 -7.806 1.00 0.00 C ATOM 1204 CG ASN A 78 3.299 -19.180 -6.846 1.00 0.00 C ATOM 1205 OD1 ASN A 78 4.104 -18.656 -6.075 1.00 0.00 O ATOM 1206 ND2 ASN A 78 3.099 -20.491 -6.888 1.00 0.00 N ATOM 0 H ASN A 78 0.282 -17.353 -6.483 1.00 0.00 H new ATOM 0 HA ASN A 78 3.102 -16.524 -6.842 1.00 0.00 H new ATOM 0 HB2 ASN A 78 1.538 -18.849 -8.017 1.00 0.00 H new ATOM 0 HB3 ASN A 78 3.012 -18.250 -8.752 1.00 0.00 H new ATOM 0 HD21 ASN A 78 3.622 -21.107 -6.266 1.00 0.00 H new ATOM 0 HD22 ASN A 78 2.422 -20.883 -7.543 1.00 0.00 H new ATOM 1213 N ALA A 79 1.899 -14.733 -8.209 1.00 0.00 N ATOM 1214 CA ALA A 79 1.485 -13.757 -9.209 1.00 0.00 C ATOM 1215 C ALA A 79 2.129 -14.046 -10.563 1.00 0.00 C ATOM 1216 O ALA A 79 1.627 -13.618 -11.602 1.00 0.00 O ATOM 1217 CB ALA A 79 1.831 -12.349 -8.746 1.00 0.00 C ATOM 0 H ALA A 79 2.342 -14.329 -7.384 1.00 0.00 H new ATOM 0 HA ALA A 79 0.404 -13.834 -9.329 1.00 0.00 H new ATOM 0 HB1 ALA A 79 1.516 -11.630 -9.502 1.00 0.00 H new ATOM 0 HB2 ALA A 79 1.317 -12.138 -7.808 1.00 0.00 H new ATOM 0 HB3 ALA A 79 2.908 -12.270 -8.596 1.00 0.00 H new ATOM 1223 N ALA A 80 3.244 -14.772 -10.544 1.00 0.00 N ATOM 1224 CA ALA A 80 3.954 -15.114 -11.770 1.00 0.00 C ATOM 1225 C ALA A 80 3.006 -15.689 -12.817 1.00 0.00 C ATOM 1226 O ALA A 80 3.089 -15.349 -13.996 1.00 0.00 O ATOM 1227 CB ALA A 80 5.073 -16.100 -11.475 1.00 0.00 C ATOM 0 H ALA A 80 3.674 -15.134 -9.693 1.00 0.00 H new ATOM 0 HA ALA A 80 4.386 -14.198 -12.174 1.00 0.00 H new ATOM 0 HB1 ALA A 80 5.594 -16.346 -12.400 1.00 0.00 H new ATOM 0 HB2 ALA A 80 5.775 -15.654 -10.771 1.00 0.00 H new ATOM 0 HB3 ALA A 80 4.653 -17.008 -11.042 1.00 0.00 H new ATOM 1233 N THR A 81 2.110 -16.569 -12.380 1.00 0.00 N ATOM 1234 CA THR A 81 1.153 -17.193 -13.285 1.00 0.00 C ATOM 1235 C THR A 81 -0.214 -17.344 -12.623 1.00 0.00 C ATOM 1236 O THR A 81 -0.863 -18.382 -12.749 1.00 0.00 O ATOM 1237 CB THR A 81 1.667 -18.560 -13.734 1.00 0.00 C ATOM 1238 OG1 THR A 81 1.822 -19.429 -12.626 1.00 0.00 O ATOM 1239 CG2 THR A 81 2.997 -18.484 -14.448 1.00 0.00 C ATOM 0 H THR A 81 2.027 -16.865 -11.407 1.00 0.00 H new ATOM 0 HA THR A 81 1.042 -16.546 -14.155 1.00 0.00 H new ATOM 0 HB THR A 81 0.917 -18.941 -14.427 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.150 -20.299 -12.936 1.00 0.00 H new ATOM 0 HG21 THR A 81 3.310 -19.486 -14.742 1.00 0.00 H new ATOM 0 HG22 THR A 81 2.898 -17.859 -15.336 1.00 0.00 H new ATOM 0 HG23 THR A 81 3.744 -18.052 -13.782 1.00 0.00 H new ATOM 1247 N GLU A 82 -0.646 -16.302 -11.921 1.00 0.00 N ATOM 1248 CA GLU A 82 -1.937 -16.323 -11.241 1.00 0.00 C ATOM 1249 C GLU A 82 -2.839 -15.176 -11.705 1.00 0.00 C ATOM 1250 O GLU A 82 -3.920 -14.971 -11.152 1.00 0.00 O ATOM 1251 CB GLU A 82 -1.738 -16.245 -9.727 1.00 0.00 C ATOM 1252 CG GLU A 82 -1.299 -17.559 -9.102 1.00 0.00 C ATOM 1253 CD GLU A 82 -2.453 -18.522 -8.898 1.00 0.00 C ATOM 1254 OE1 GLU A 82 -3.535 -18.282 -9.474 1.00 0.00 O ATOM 1255 OE2 GLU A 82 -2.273 -19.517 -8.164 1.00 0.00 O ATOM 0 H GLU A 82 -0.123 -15.434 -11.808 1.00 0.00 H new ATOM 0 HA GLU A 82 -2.428 -17.262 -11.496 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -0.993 -15.481 -9.506 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -2.671 -15.925 -9.262 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -0.548 -18.027 -9.739 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -0.823 -17.359 -8.142 1.00 0.00 H new ATOM 1262 N ASP A 83 -2.398 -14.432 -12.719 1.00 0.00 N ATOM 1263 CA ASP A 83 -3.180 -13.317 -13.240 1.00 0.00 C ATOM 1264 C ASP A 83 -3.341 -12.223 -12.188 1.00 0.00 C ATOM 1265 O ASP A 83 -3.545 -12.508 -11.009 1.00 0.00 O ATOM 1266 CB ASP A 83 -4.556 -13.801 -13.700 1.00 0.00 C ATOM 1267 CG ASP A 83 -4.996 -13.147 -14.994 1.00 0.00 C ATOM 1268 OD1 ASP A 83 -4.649 -11.967 -15.211 1.00 0.00 O ATOM 1269 OD2 ASP A 83 -5.688 -13.814 -15.791 1.00 0.00 O ATOM 0 H ASP A 83 -1.507 -14.582 -13.193 1.00 0.00 H new ATOM 0 HA ASP A 83 -2.644 -12.900 -14.093 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -4.532 -14.883 -13.833 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -5.290 -13.592 -12.922 1.00 0.00 H new ATOM 1274 N LEU A 84 -3.248 -10.971 -12.624 1.00 0.00 N ATOM 1275 CA LEU A 84 -3.386 -9.835 -11.721 1.00 0.00 C ATOM 1276 C LEU A 84 -4.623 -9.010 -12.066 1.00 0.00 C ATOM 1277 O LEU A 84 -4.693 -7.820 -11.760 1.00 0.00 O ATOM 1278 CB LEU A 84 -2.140 -8.950 -11.784 1.00 0.00 C ATOM 1279 CG LEU A 84 -0.840 -9.683 -12.121 1.00 0.00 C ATOM 1280 CD1 LEU A 84 0.270 -8.688 -12.423 1.00 0.00 C ATOM 1281 CD2 LEU A 84 -0.436 -10.604 -10.979 1.00 0.00 C ATOM 0 H LEU A 84 -3.078 -10.718 -13.597 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.499 -10.223 -10.709 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.304 -8.171 -12.529 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.019 -8.451 -10.823 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.008 -10.291 -13.010 1.00 0.00 H new ATOM 0 HD11 LEU A 84 1.187 -9.227 -12.661 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.018 -8.069 -13.273 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.437 -8.054 -11.552 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.491 -11.117 -11.236 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.286 -10.016 -10.073 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.223 -11.339 -10.809 1.00 0.00 H new ATOM 1293 N ASN A 85 -5.596 -9.651 -12.706 1.00 0.00 N ATOM 1294 CA ASN A 85 -6.829 -8.977 -13.092 1.00 0.00 C ATOM 1295 C ASN A 85 -8.027 -9.904 -12.924 1.00 0.00 C ATOM 1296 O ASN A 85 -9.028 -9.777 -13.628 1.00 0.00 O ATOM 1297 CB ASN A 85 -6.740 -8.496 -14.541 1.00 0.00 C ATOM 1298 CG ASN A 85 -7.761 -7.422 -14.860 1.00 0.00 C ATOM 1299 OD1 ASN A 85 -8.350 -6.823 -13.959 1.00 0.00 O ATOM 1300 ND2 ASN A 85 -7.975 -7.171 -16.146 1.00 0.00 N ATOM 0 H ASN A 85 -5.554 -10.636 -12.968 1.00 0.00 H new ATOM 0 HA ASN A 85 -6.964 -8.115 -12.439 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -5.739 -8.109 -14.731 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -6.887 -9.343 -15.211 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -8.650 -6.457 -16.421 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -7.464 -7.692 -16.859 1.00 0.00 H new ATOM 1307 N ASN A 86 -7.917 -10.839 -11.985 1.00 0.00 N ATOM 1308 CA ASN A 86 -8.991 -11.790 -11.724 1.00 0.00 C ATOM 1309 C ASN A 86 -9.688 -11.479 -10.404 1.00 0.00 C ATOM 1310 O ASN A 86 -10.875 -11.760 -10.237 1.00 0.00 O ATOM 1311 CB ASN A 86 -8.441 -13.218 -11.700 1.00 0.00 C ATOM 1312 CG ASN A 86 -8.787 -13.992 -12.956 1.00 0.00 C ATOM 1313 OD1 ASN A 86 -9.395 -15.062 -12.893 1.00 0.00 O ATOM 1314 ND2 ASN A 86 -8.400 -13.456 -14.108 1.00 0.00 N ATOM 0 H ASN A 86 -7.095 -10.958 -11.393 1.00 0.00 H new ATOM 0 HA ASN A 86 -9.722 -11.702 -12.528 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -7.358 -13.185 -11.584 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -8.839 -13.743 -10.832 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -8.604 -13.933 -14.986 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -7.899 -12.568 -14.114 1.00 0.00 H new ATOM 1321 N ASP A 87 -8.945 -10.897 -9.468 1.00 0.00 N ATOM 1322 CA ASP A 87 -9.495 -10.548 -8.163 1.00 0.00 C ATOM 1323 C ASP A 87 -10.139 -9.166 -8.196 1.00 0.00 C ATOM 1324 O ASP A 87 -9.512 -8.189 -8.607 1.00 0.00 O ATOM 1325 CB ASP A 87 -8.398 -10.586 -7.097 1.00 0.00 C ATOM 1326 CG ASP A 87 -8.939 -10.339 -5.702 1.00 0.00 C ATOM 1327 OD1 ASP A 87 -10.137 -10.008 -5.580 1.00 0.00 O ATOM 1328 OD2 ASP A 87 -8.164 -10.477 -4.732 1.00 0.00 O ATOM 0 H ASP A 87 -7.961 -10.657 -9.589 1.00 0.00 H new ATOM 0 HA ASP A 87 -10.262 -11.281 -7.912 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -7.902 -11.556 -7.125 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -7.643 -9.835 -7.329 1.00 0.00 H new ATOM 1333 N ARG A 88 -11.393 -9.090 -7.763 1.00 0.00 N ATOM 1334 CA ARG A 88 -12.118 -7.825 -7.746 1.00 0.00 C ATOM 1335 C ARG A 88 -13.072 -7.752 -6.558 1.00 0.00 C ATOM 1336 O ARG A 88 -13.732 -8.733 -6.214 1.00 0.00 O ATOM 1337 CB ARG A 88 -12.897 -7.643 -9.051 1.00 0.00 C ATOM 1338 CG ARG A 88 -14.000 -8.671 -9.252 1.00 0.00 C ATOM 1339 CD ARG A 88 -13.586 -9.744 -10.245 1.00 0.00 C ATOM 1340 NE ARG A 88 -13.550 -9.239 -11.615 1.00 0.00 N ATOM 1341 CZ ARG A 88 -13.381 -10.014 -12.681 1.00 0.00 C ATOM 1342 NH1 ARG A 88 -13.236 -11.325 -12.533 1.00 0.00 N ATOM 1343 NH2 ARG A 88 -13.356 -9.482 -13.894 1.00 0.00 N ATOM 0 H ARG A 88 -11.928 -9.888 -7.420 1.00 0.00 H new ATOM 0 HA ARG A 88 -11.388 -7.022 -7.648 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -13.335 -6.645 -9.066 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -12.203 -7.699 -9.889 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -14.246 -9.134 -8.296 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -14.902 -8.173 -9.607 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -12.602 -10.128 -9.974 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -14.282 -10.581 -10.185 1.00 0.00 H new ATOM 0 HE ARG A 88 -13.661 -8.236 -11.762 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -13.254 -11.738 -11.601 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -13.106 -11.919 -13.352 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -13.467 -8.475 -14.012 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -13.226 -10.080 -14.710 1.00 0.00 H new ATOM 1357 N ILE A 89 -13.141 -6.579 -5.937 1.00 0.00 N ATOM 1358 CA ILE A 89 -14.018 -6.366 -4.792 1.00 0.00 C ATOM 1359 C ILE A 89 -15.211 -5.498 -5.183 1.00 0.00 C ATOM 1360 O ILE A 89 -15.042 -4.378 -5.663 1.00 0.00 O ATOM 1361 CB ILE A 89 -13.266 -5.698 -3.623 1.00 0.00 C ATOM 1362 CG1 ILE A 89 -12.082 -6.564 -3.189 1.00 0.00 C ATOM 1363 CG2 ILE A 89 -14.208 -5.455 -2.453 1.00 0.00 C ATOM 1364 CD1 ILE A 89 -11.208 -5.914 -2.138 1.00 0.00 C ATOM 0 H ILE A 89 -12.598 -5.759 -6.209 1.00 0.00 H new ATOM 0 HA ILE A 89 -14.370 -7.345 -4.468 1.00 0.00 H new ATOM 0 HB ILE A 89 -12.884 -4.735 -3.961 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -12.458 -7.511 -2.802 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -11.473 -6.796 -4.063 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -13.661 -4.983 -1.637 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -15.021 -4.802 -2.770 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -14.618 -6.406 -2.113 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -10.389 -6.586 -1.879 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -10.802 -4.981 -2.529 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -11.802 -5.707 -1.248 1.00 0.00 H new ATOM 1376 N THR A 90 -16.414 -6.024 -4.983 1.00 0.00 N ATOM 1377 CA THR A 90 -17.626 -5.292 -5.327 1.00 0.00 C ATOM 1378 C THR A 90 -18.395 -4.867 -4.080 1.00 0.00 C ATOM 1379 O THR A 90 -18.844 -5.704 -3.297 1.00 0.00 O ATOM 1380 CB THR A 90 -18.523 -6.146 -6.226 1.00 0.00 C ATOM 1381 OG1 THR A 90 -17.825 -6.552 -7.389 1.00 0.00 O ATOM 1382 CG2 THR A 90 -19.781 -5.430 -6.670 1.00 0.00 C ATOM 0 H THR A 90 -16.575 -6.950 -4.586 1.00 0.00 H new ATOM 0 HA THR A 90 -17.328 -4.391 -5.864 1.00 0.00 H new ATOM 0 HB THR A 90 -18.809 -7.004 -5.618 1.00 0.00 H new ATOM 0 HG1 THR A 90 -17.664 -5.774 -7.962 1.00 0.00 H new ATOM 0 HG21 THR A 90 -20.371 -6.091 -7.304 1.00 0.00 H new ATOM 0 HG22 THR A 90 -20.367 -5.148 -5.795 1.00 0.00 H new ATOM 0 HG23 THR A 90 -19.512 -4.535 -7.231 1.00 0.00 H new ATOM 1390 N ILE A 91 -18.550 -3.557 -3.910 1.00 0.00 N ATOM 1391 CA ILE A 91 -19.272 -3.009 -2.770 1.00 0.00 C ATOM 1392 C ILE A 91 -20.776 -3.032 -3.020 1.00 0.00 C ATOM 1393 O ILE A 91 -21.225 -3.008 -4.166 1.00 0.00 O ATOM 1394 CB ILE A 91 -18.838 -1.560 -2.475 1.00 0.00 C ATOM 1395 CG1 ILE A 91 -17.324 -1.410 -2.641 1.00 0.00 C ATOM 1396 CG2 ILE A 91 -19.266 -1.149 -1.074 1.00 0.00 C ATOM 1397 CD1 ILE A 91 -16.525 -2.480 -1.930 1.00 0.00 C ATOM 0 H ILE A 91 -18.183 -2.854 -4.551 1.00 0.00 H new ATOM 0 HA ILE A 91 -19.034 -3.634 -1.910 1.00 0.00 H new ATOM 0 HB ILE A 91 -19.329 -0.901 -3.191 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -17.080 -1.432 -3.703 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -17.021 -0.433 -2.265 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -18.951 -0.123 -0.884 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -20.351 -1.217 -0.990 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -18.803 -1.812 -0.343 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -15.461 -2.308 -2.093 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -16.739 -2.444 -0.862 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -16.799 -3.459 -2.322 1.00 0.00 H new ATOM 1409 N GLU A 92 -21.550 -3.078 -1.942 1.00 0.00 N ATOM 1410 CA GLU A 92 -23.004 -3.103 -2.050 1.00 0.00 C ATOM 1411 C GLU A 92 -23.653 -2.432 -0.845 1.00 0.00 C ATOM 1412 O GLU A 92 -23.750 -3.026 0.230 1.00 0.00 O ATOM 1413 CB GLU A 92 -23.502 -4.544 -2.176 1.00 0.00 C ATOM 1414 CG GLU A 92 -23.621 -5.024 -3.613 1.00 0.00 C ATOM 1415 CD GLU A 92 -24.197 -6.424 -3.714 1.00 0.00 C ATOM 1416 OE1 GLU A 92 -24.160 -7.155 -2.702 1.00 0.00 O ATOM 1417 OE2 GLU A 92 -24.686 -6.786 -4.804 1.00 0.00 O ATOM 0 H GLU A 92 -21.196 -3.099 -0.985 1.00 0.00 H new ATOM 0 HA GLU A 92 -23.285 -2.548 -2.945 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -22.821 -5.203 -1.637 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -24.475 -4.627 -1.693 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -24.253 -4.334 -4.172 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -22.637 -5.005 -4.081 1.00 0.00 H new ATOM 1424 N TRP A 93 -24.099 -1.193 -1.030 1.00 0.00 N ATOM 1425 CA TRP A 93 -24.741 -0.447 0.047 1.00 0.00 C ATOM 1426 C TRP A 93 -26.149 -0.013 -0.352 1.00 0.00 C ATOM 1427 O TRP A 93 -26.377 0.428 -1.478 1.00 0.00 O ATOM 1428 CB TRP A 93 -23.898 0.776 0.427 1.00 0.00 C ATOM 1429 CG TRP A 93 -23.945 1.877 -0.589 1.00 0.00 C ATOM 1430 CD1 TRP A 93 -24.686 3.022 -0.524 1.00 0.00 C ATOM 1431 CD2 TRP A 93 -23.219 1.937 -1.822 1.00 0.00 C ATOM 1432 NE1 TRP A 93 -24.466 3.789 -1.642 1.00 0.00 N ATOM 1433 CE2 TRP A 93 -23.569 3.145 -2.454 1.00 0.00 C ATOM 1434 CE3 TRP A 93 -22.306 1.087 -2.454 1.00 0.00 C ATOM 1435 CZ2 TRP A 93 -23.039 3.522 -3.685 1.00 0.00 C ATOM 1436 CZ3 TRP A 93 -21.781 1.463 -3.676 1.00 0.00 C ATOM 1437 CH2 TRP A 93 -22.148 2.672 -4.280 1.00 0.00 C ATOM 0 H TRP A 93 -24.028 -0.686 -1.912 1.00 0.00 H new ATOM 0 HA TRP A 93 -24.819 -1.104 0.913 1.00 0.00 H new ATOM 0 HB2 TRP A 93 -24.245 1.162 1.385 1.00 0.00 H new ATOM 0 HB3 TRP A 93 -22.863 0.464 0.565 1.00 0.00 H new ATOM 0 HD1 TRP A 93 -25.348 3.286 0.287 1.00 0.00 H new ATOM 0 HE1 TRP A 93 -24.900 4.691 -1.836 1.00 0.00 H new ATOM 0 HE3 TRP A 93 -22.016 0.153 -1.995 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 -23.322 4.453 -4.154 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 -21.076 0.814 -4.173 1.00 0.00 H new ATOM 0 HH2 TRP A 93 -21.719 2.938 -5.235 1.00 0.00 H new ATOM 1448 N THR A 94 -27.089 -0.140 0.581 1.00 0.00 N ATOM 1449 CA THR A 94 -28.474 0.240 0.326 1.00 0.00 C ATOM 1450 C THR A 94 -29.040 1.054 1.484 1.00 0.00 C ATOM 1451 O THR A 94 -28.650 0.867 2.637 1.00 0.00 O ATOM 1452 CB THR A 94 -29.333 -1.004 0.095 1.00 0.00 C ATOM 1453 OG1 THR A 94 -30.710 -0.688 0.202 1.00 0.00 O ATOM 1454 CG2 THR A 94 -29.039 -2.122 1.071 1.00 0.00 C ATOM 0 H THR A 94 -26.916 -0.503 1.519 1.00 0.00 H new ATOM 0 HA THR A 94 -28.493 0.859 -0.571 1.00 0.00 H new ATOM 0 HB THR A 94 -29.084 -1.347 -0.909 1.00 0.00 H new ATOM 0 HG1 THR A 94 -31.201 -1.472 0.525 1.00 0.00 H new ATOM 0 HG21 THR A 94 -29.682 -2.974 0.852 1.00 0.00 H new ATOM 0 HG22 THR A 94 -27.995 -2.422 0.977 1.00 0.00 H new ATOM 0 HG23 THR A 94 -29.228 -1.777 2.087 1.00 0.00 H new ATOM 1462 N ASN A 95 -29.960 1.961 1.171 1.00 0.00 N ATOM 1463 CA ASN A 95 -30.581 2.804 2.186 1.00 0.00 C ATOM 1464 C ASN A 95 -31.312 1.959 3.225 1.00 0.00 C ATOM 1465 O ASN A 95 -31.898 0.927 2.899 1.00 0.00 O ATOM 1466 CB ASN A 95 -31.553 3.789 1.535 1.00 0.00 C ATOM 1467 CG ASN A 95 -30.955 5.174 1.379 1.00 0.00 C ATOM 1468 OD1 ASN A 95 -30.167 5.619 2.212 1.00 0.00 O ATOM 1469 ND2 ASN A 95 -31.329 5.862 0.306 1.00 0.00 N ATOM 0 H ASN A 95 -30.292 2.131 0.222 1.00 0.00 H new ATOM 0 HA ASN A 95 -29.792 3.362 2.691 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -31.848 3.411 0.556 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -32.459 3.853 2.138 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -30.960 6.799 0.147 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -31.985 5.453 -0.359 1.00 0.00 H new ATOM 1476 N THR A 96 -31.274 2.405 4.477 1.00 0.00 N ATOM 1477 CA THR A 96 -31.933 1.690 5.565 1.00 0.00 C ATOM 1478 C THR A 96 -33.401 2.094 5.676 1.00 0.00 C ATOM 1479 O THR A 96 -33.770 3.220 5.342 1.00 0.00 O ATOM 1480 CB THR A 96 -31.221 1.967 6.891 1.00 0.00 C ATOM 1481 OG1 THR A 96 -31.315 3.339 7.233 1.00 0.00 O ATOM 1482 CG2 THR A 96 -29.754 1.598 6.875 1.00 0.00 C ATOM 0 H THR A 96 -30.794 3.258 4.763 1.00 0.00 H new ATOM 0 HA THR A 96 -31.882 0.624 5.344 1.00 0.00 H new ATOM 0 HB THR A 96 -31.727 1.340 7.625 1.00 0.00 H new ATOM 0 HG1 THR A 96 -31.153 3.449 8.193 1.00 0.00 H new ATOM 0 HG21 THR A 96 -29.312 1.821 7.846 1.00 0.00 H new ATOM 0 HG22 THR A 96 -29.649 0.534 6.664 1.00 0.00 H new ATOM 0 HG23 THR A 96 -29.243 2.173 6.103 1.00 0.00 H new ATOM 1490 N PRO A 97 -34.259 1.179 6.157 1.00 0.00 N ATOM 1491 CA PRO A 97 -35.690 1.450 6.319 1.00 0.00 C ATOM 1492 C PRO A 97 -35.956 2.495 7.394 1.00 0.00 C ATOM 1493 O PRO A 97 -35.086 2.795 8.211 1.00 0.00 O ATOM 1494 CB PRO A 97 -36.271 0.095 6.734 1.00 0.00 C ATOM 1495 CG PRO A 97 -35.123 -0.646 7.330 1.00 0.00 C ATOM 1496 CD PRO A 97 -33.901 -0.186 6.586 1.00 0.00 C ATOM 0 HA PRO A 97 -36.134 1.853 5.409 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -37.080 0.216 7.454 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -36.683 -0.438 5.877 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -35.033 -0.435 8.396 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -35.259 -1.723 7.229 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -33.017 -0.188 7.224 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -33.682 -0.831 5.735 1.00 0.00 H new ATOM 1504 N ASP A 98 -37.161 3.049 7.385 1.00 0.00 N ATOM 1505 CA ASP A 98 -37.546 4.067 8.357 1.00 0.00 C ATOM 1506 C ASP A 98 -37.165 3.653 9.776 1.00 0.00 C ATOM 1507 O ASP A 98 -37.670 2.661 10.302 1.00 0.00 O ATOM 1508 CB ASP A 98 -39.051 4.330 8.282 1.00 0.00 C ATOM 1509 CG ASP A 98 -39.468 4.936 6.956 1.00 0.00 C ATOM 1510 OD1 ASP A 98 -38.604 5.530 6.277 1.00 0.00 O ATOM 1511 OD2 ASP A 98 -40.659 4.819 6.598 1.00 0.00 O ATOM 0 H ASP A 98 -37.891 2.811 6.714 1.00 0.00 H new ATOM 0 HA ASP A 98 -37.006 4.981 8.111 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -39.588 3.394 8.435 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -39.340 5.000 9.091 1.00 0.00 H new ATOM 1516 N GLY A 99 -36.270 4.422 10.388 1.00 0.00 N ATOM 1517 CA GLY A 99 -35.836 4.125 11.741 1.00 0.00 C ATOM 1518 C GLY A 99 -35.365 2.693 11.903 1.00 0.00 C ATOM 1519 O GLY A 99 -35.744 2.013 12.857 1.00 0.00 O ATOM 0 H GLY A 99 -35.837 5.246 9.971 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -35.028 4.802 12.016 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -36.658 4.313 12.432 1.00 0.00 H new ATOM 1523 N ALA A 100 -34.535 2.233 10.973 1.00 0.00 N ATOM 1524 CA ALA A 100 -34.012 0.874 11.024 1.00 0.00 C ATOM 1525 C ALA A 100 -33.115 0.676 12.241 1.00 0.00 C ATOM 1526 O ALA A 100 -32.479 1.617 12.714 1.00 0.00 O ATOM 1527 CB ALA A 100 -33.250 0.552 9.747 1.00 0.00 C ATOM 0 H ALA A 100 -34.211 2.781 10.176 1.00 0.00 H new ATOM 0 HA ALA A 100 -34.856 0.190 11.112 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -32.865 -0.466 9.800 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -33.919 0.643 8.891 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -32.419 1.248 9.634 1.00 0.00 H new ATOM 1533 N ALA A 101 -33.069 -0.553 12.743 1.00 0.00 N ATOM 1534 CA ALA A 101 -32.249 -0.873 13.905 1.00 0.00 C ATOM 1535 C ALA A 101 -30.790 -0.528 13.662 1.00 0.00 C ATOM 1536 O ALA A 101 -30.369 -0.308 12.528 1.00 0.00 O ATOM 1537 CB ALA A 101 -32.382 -2.345 14.260 1.00 0.00 C ATOM 0 H ALA A 101 -33.590 -1.344 12.363 1.00 0.00 H new ATOM 0 HA ALA A 101 -32.607 -0.271 14.740 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -31.763 -2.567 15.130 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -33.423 -2.572 14.488 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -32.055 -2.954 13.417 1.00 0.00 H new ATOM 1543 N LYS A 102 -30.025 -0.489 14.742 1.00 0.00 N ATOM 1544 CA LYS A 102 -28.603 -0.179 14.660 1.00 0.00 C ATOM 1545 C LYS A 102 -27.788 -1.449 14.470 1.00 0.00 C ATOM 1546 O LYS A 102 -27.086 -1.897 15.376 1.00 0.00 O ATOM 1547 CB LYS A 102 -28.142 0.560 15.918 1.00 0.00 C ATOM 1548 CG LYS A 102 -29.034 1.731 16.299 1.00 0.00 C ATOM 1549 CD LYS A 102 -28.689 2.266 17.680 1.00 0.00 C ATOM 1550 CE LYS A 102 -29.940 2.621 18.467 1.00 0.00 C ATOM 1551 NZ LYS A 102 -30.787 1.426 18.732 1.00 0.00 N ATOM 0 H LYS A 102 -30.364 -0.668 15.687 1.00 0.00 H new ATOM 0 HA LYS A 102 -28.445 0.468 13.797 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -28.106 -0.144 16.750 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -27.126 0.923 15.764 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -28.927 2.527 15.562 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -30.078 1.417 16.279 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -28.113 1.520 18.227 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -28.056 3.148 17.582 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -29.655 3.081 19.413 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -30.519 3.361 17.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -31.328 1.571 19.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -31.445 1.284 17.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -30.181 0.587 18.834 1.00 0.00 H new ATOM 1565 N GLN A 103 -27.892 -2.023 13.280 1.00 0.00 N ATOM 1566 CA GLN A 103 -27.172 -3.247 12.950 1.00 0.00 C ATOM 1567 C GLN A 103 -27.434 -3.660 11.506 1.00 0.00 C ATOM 1568 O GLN A 103 -28.555 -3.544 11.009 1.00 0.00 O ATOM 1569 CB GLN A 103 -27.583 -4.376 13.898 1.00 0.00 C ATOM 1570 CG GLN A 103 -26.423 -4.964 14.683 1.00 0.00 C ATOM 1571 CD GLN A 103 -26.117 -6.395 14.289 1.00 0.00 C ATOM 1572 OE1 GLN A 103 -27.019 -7.226 14.175 1.00 0.00 O ATOM 1573 NE2 GLN A 103 -24.840 -6.692 14.077 1.00 0.00 N ATOM 0 H GLN A 103 -28.471 -1.659 12.523 1.00 0.00 H new ATOM 0 HA GLN A 103 -26.105 -3.054 13.066 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -28.329 -3.999 14.597 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -28.059 -5.169 13.321 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -25.536 -4.351 14.527 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -26.653 -4.926 15.748 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -24.125 -5.973 14.183 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -24.575 -7.640 13.808 1.00 0.00 H new ATOM 1582 N PHE A 104 -26.394 -4.145 10.835 1.00 0.00 N ATOM 1583 CA PHE A 104 -26.513 -4.577 9.447 1.00 0.00 C ATOM 1584 C PHE A 104 -27.533 -5.702 9.313 1.00 0.00 C ATOM 1585 O PHE A 104 -27.384 -6.765 9.916 1.00 0.00 O ATOM 1586 CB PHE A 104 -25.154 -5.038 8.918 1.00 0.00 C ATOM 1587 CG PHE A 104 -25.210 -5.608 7.530 1.00 0.00 C ATOM 1588 CD1 PHE A 104 -25.127 -4.780 6.423 1.00 0.00 C ATOM 1589 CD2 PHE A 104 -25.347 -6.973 7.333 1.00 0.00 C ATOM 1590 CE1 PHE A 104 -25.179 -5.303 5.144 1.00 0.00 C ATOM 1591 CE2 PHE A 104 -25.399 -7.502 6.058 1.00 0.00 C ATOM 1592 CZ PHE A 104 -25.315 -6.666 4.961 1.00 0.00 C ATOM 0 H PHE A 104 -25.459 -4.249 11.230 1.00 0.00 H new ATOM 0 HA PHE A 104 -26.857 -3.728 8.856 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -24.465 -4.194 8.927 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -24.746 -5.790 9.594 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -25.020 -3.714 6.560 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -25.414 -7.631 8.187 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -25.113 -4.647 4.289 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -25.505 -8.568 5.919 1.00 0.00 H new ATOM 0 HZ PHE A 104 -25.356 -7.077 3.963 1.00 0.00 H new ATOM 1602 N ARG A 105 -28.571 -5.462 8.518 1.00 0.00 N ATOM 1603 CA ARG A 105 -29.617 -6.455 8.305 1.00 0.00 C ATOM 1604 C ARG A 105 -29.429 -7.170 6.972 1.00 0.00 C ATOM 1605 O ARG A 105 -28.803 -6.640 6.054 1.00 0.00 O ATOM 1606 CB ARG A 105 -30.996 -5.794 8.354 1.00 0.00 C ATOM 1607 CG ARG A 105 -32.028 -6.596 9.128 1.00 0.00 C ATOM 1608 CD ARG A 105 -32.056 -6.197 10.595 1.00 0.00 C ATOM 1609 NE ARG A 105 -32.856 -7.118 11.398 1.00 0.00 N ATOM 1610 CZ ARG A 105 -32.823 -7.156 12.726 1.00 0.00 C ATOM 1611 NH1 ARG A 105 -32.031 -6.331 13.397 1.00 0.00 N ATOM 1612 NH2 ARG A 105 -33.583 -8.021 13.386 1.00 0.00 N ATOM 0 H ARG A 105 -28.710 -4.588 8.011 1.00 0.00 H new ATOM 0 HA ARG A 105 -29.548 -7.194 9.104 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -30.901 -4.807 8.807 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -31.354 -5.644 7.335 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -33.014 -6.443 8.689 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -31.803 -7.659 9.043 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -31.038 -6.169 10.982 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -32.460 -5.189 10.689 1.00 0.00 H new ATOM 0 HE ARG A 105 -33.474 -7.768 10.913 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -31.445 -5.665 12.894 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -32.008 -6.363 14.416 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -34.193 -8.658 12.874 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -33.557 -8.049 14.405 1.00 0.00 H new ATOM 1626 N ARG A 106 -29.975 -8.376 6.875 1.00 0.00 N ATOM 1627 CA ARG A 106 -29.870 -9.171 5.657 1.00 0.00 C ATOM 1628 C ARG A 106 -31.083 -8.954 4.756 1.00 0.00 C ATOM 1629 O ARG A 106 -30.998 -9.102 3.538 1.00 0.00 O ATOM 1630 CB ARG A 106 -29.735 -10.654 6.003 1.00 0.00 C ATOM 1631 CG ARG A 106 -29.076 -11.478 4.910 1.00 0.00 C ATOM 1632 CD ARG A 106 -29.684 -12.868 4.817 1.00 0.00 C ATOM 1633 NE ARG A 106 -29.370 -13.520 3.550 1.00 0.00 N ATOM 1634 CZ ARG A 106 -28.190 -14.065 3.276 1.00 0.00 C ATOM 1635 NH1 ARG A 106 -27.219 -14.037 4.178 1.00 0.00 N ATOM 1636 NH2 ARG A 106 -27.980 -14.639 2.099 1.00 0.00 N ATOM 0 H ARG A 106 -30.496 -8.826 7.627 1.00 0.00 H new ATOM 0 HA ARG A 106 -28.980 -8.848 5.118 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -29.155 -10.753 6.920 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -30.725 -11.062 6.207 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -29.184 -10.968 3.953 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -28.007 -11.560 5.109 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -29.316 -13.480 5.640 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -30.766 -12.798 4.930 1.00 0.00 H new ATOM 0 HE ARG A 106 -30.097 -13.559 2.835 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -27.377 -13.596 5.084 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -26.314 -14.456 3.966 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -28.725 -14.662 1.403 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -27.073 -15.057 1.890 1.00 0.00 H new ATOM 1650 N GLU A 107 -32.211 -8.605 5.366 1.00 0.00 N ATOM 1651 CA GLU A 107 -33.443 -8.370 4.621 1.00 0.00 C ATOM 1652 C GLU A 107 -33.312 -7.159 3.697 1.00 0.00 C ATOM 1653 O GLU A 107 -34.097 -6.995 2.763 1.00 0.00 O ATOM 1654 CB GLU A 107 -34.613 -8.164 5.586 1.00 0.00 C ATOM 1655 CG GLU A 107 -34.506 -6.891 6.410 1.00 0.00 C ATOM 1656 CD GLU A 107 -35.781 -6.070 6.381 1.00 0.00 C ATOM 1657 OE1 GLU A 107 -36.404 -5.978 5.303 1.00 0.00 O ATOM 1658 OE2 GLU A 107 -36.156 -5.520 7.439 1.00 0.00 O ATOM 0 H GLU A 107 -32.298 -8.479 6.374 1.00 0.00 H new ATOM 0 HA GLU A 107 -33.633 -9.249 4.005 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -35.542 -8.141 5.017 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -34.672 -9.019 6.260 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -34.268 -7.149 7.442 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -33.680 -6.287 6.034 1.00 0.00 H new ATOM 1665 N TRP A 108 -32.321 -6.311 3.962 1.00 0.00 N ATOM 1666 CA TRP A 108 -32.099 -5.120 3.150 1.00 0.00 C ATOM 1667 C TRP A 108 -31.752 -5.485 1.706 1.00 0.00 C ATOM 1668 O TRP A 108 -31.822 -4.639 0.813 1.00 0.00 O ATOM 1669 CB TRP A 108 -30.982 -4.269 3.756 1.00 0.00 C ATOM 1670 CG TRP A 108 -31.347 -3.668 5.079 1.00 0.00 C ATOM 1671 CD1 TRP A 108 -32.594 -3.597 5.631 1.00 0.00 C ATOM 1672 CD2 TRP A 108 -30.457 -3.053 6.018 1.00 0.00 C ATOM 1673 NE1 TRP A 108 -32.534 -2.975 6.855 1.00 0.00 N ATOM 1674 CE2 TRP A 108 -31.233 -2.632 7.115 1.00 0.00 C ATOM 1675 CE3 TRP A 108 -29.079 -2.817 6.038 1.00 0.00 C ATOM 1676 CZ2 TRP A 108 -30.676 -1.990 8.219 1.00 0.00 C ATOM 1677 CZ3 TRP A 108 -28.529 -2.179 7.134 1.00 0.00 C ATOM 1678 CH2 TRP A 108 -29.326 -1.773 8.211 1.00 0.00 C ATOM 0 H TRP A 108 -31.661 -6.427 4.731 1.00 0.00 H new ATOM 0 HA TRP A 108 -33.025 -4.546 3.140 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -30.091 -4.885 3.878 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -30.725 -3.470 3.060 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -33.496 -3.975 5.172 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -33.328 -2.798 7.470 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -28.456 -3.127 5.212 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -31.288 -1.675 9.051 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -27.466 -1.990 7.160 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -28.865 -1.278 9.053 1.00 0.00 H new ATOM 1689 N PHE A 109 -31.378 -6.742 1.479 1.00 0.00 N ATOM 1690 CA PHE A 109 -31.024 -7.200 0.139 1.00 0.00 C ATOM 1691 C PHE A 109 -31.842 -8.424 -0.256 1.00 0.00 C ATOM 1692 O PHE A 109 -31.293 -9.435 -0.695 1.00 0.00 O ATOM 1693 CB PHE A 109 -29.532 -7.529 0.067 1.00 0.00 C ATOM 1694 CG PHE A 109 -28.656 -6.501 0.726 1.00 0.00 C ATOM 1695 CD1 PHE A 109 -28.643 -6.366 2.105 1.00 0.00 C ATOM 1696 CD2 PHE A 109 -27.845 -5.672 -0.033 1.00 0.00 C ATOM 1697 CE1 PHE A 109 -27.838 -5.423 2.715 1.00 0.00 C ATOM 1698 CE2 PHE A 109 -27.038 -4.727 0.571 1.00 0.00 C ATOM 1699 CZ PHE A 109 -27.035 -4.602 1.946 1.00 0.00 C ATOM 0 H PHE A 109 -31.313 -7.458 2.202 1.00 0.00 H new ATOM 0 HA PHE A 109 -31.248 -6.395 -0.560 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -29.359 -8.497 0.538 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -29.240 -7.626 -0.979 1.00 0.00 H new ATOM 0 HD1 PHE A 109 -29.269 -7.005 2.710 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -27.844 -5.766 -1.109 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -27.836 -5.328 3.791 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -26.410 -4.087 -0.032 1.00 0.00 H new ATOM 0 HZ PHE A 109 -26.406 -3.863 2.420 1.00 0.00 H new ATOM 1709 N GLN A 110 -33.159 -8.329 -0.101 1.00 0.00 N ATOM 1710 CA GLN A 110 -34.050 -9.431 -0.447 1.00 0.00 C ATOM 1711 C GLN A 110 -35.235 -8.937 -1.269 1.00 0.00 C ATOM 1712 O GLN A 110 -36.296 -9.562 -1.286 1.00 0.00 O ATOM 1713 CB GLN A 110 -34.547 -10.132 0.821 1.00 0.00 C ATOM 1714 CG GLN A 110 -35.533 -9.306 1.630 1.00 0.00 C ATOM 1715 CD GLN A 110 -36.757 -10.100 2.044 1.00 0.00 C ATOM 1716 OE1 GLN A 110 -37.830 -9.960 1.456 1.00 0.00 O ATOM 1717 NE2 GLN A 110 -36.602 -10.940 3.060 1.00 0.00 N ATOM 0 H GLN A 110 -33.632 -7.501 0.261 1.00 0.00 H new ATOM 0 HA GLN A 110 -33.487 -10.144 -1.050 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -35.019 -11.075 0.543 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -33.691 -10.377 1.449 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -35.035 -8.922 2.520 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -35.846 -8.443 1.043 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -35.695 -11.024 3.518 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -37.390 -11.501 3.382 1.00 0.00 H new ATOM 1726 N GLY A 111 -35.048 -7.812 -1.953 1.00 0.00 N ATOM 1727 CA GLY A 111 -36.110 -7.253 -2.768 1.00 0.00 C ATOM 1728 C GLY A 111 -35.635 -6.868 -4.155 1.00 0.00 C ATOM 1729 O GLY A 111 -34.509 -7.183 -4.543 1.00 0.00 O ATOM 0 H GLY A 111 -34.179 -7.278 -1.957 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -36.919 -7.979 -2.853 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -36.521 -6.374 -2.271 1.00 0.00 H new ATOM 1733 N ASP A 112 -36.494 -6.186 -4.905 1.00 0.00 N ATOM 1734 CA ASP A 112 -36.154 -5.757 -6.258 1.00 0.00 C ATOM 1735 C ASP A 112 -35.863 -4.260 -6.290 1.00 0.00 C ATOM 1736 O ASP A 112 -36.464 -3.486 -5.546 1.00 0.00 O ATOM 1737 CB ASP A 112 -37.294 -6.090 -7.222 1.00 0.00 C ATOM 1738 CG ASP A 112 -36.964 -7.267 -8.121 1.00 0.00 C ATOM 1739 OD1 ASP A 112 -35.913 -7.223 -8.795 1.00 0.00 O ATOM 1740 OD2 ASP A 112 -37.756 -8.232 -8.150 1.00 0.00 O ATOM 0 H ASP A 112 -37.430 -5.918 -4.600 1.00 0.00 H new ATOM 0 HA ASP A 112 -35.258 -6.292 -6.572 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -38.196 -6.313 -6.651 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -37.514 -5.217 -7.836 1.00 0.00 H new ATOM 1745 N GLY A 113 -34.937 -3.861 -7.154 1.00 0.00 N ATOM 1746 CA GLY A 113 -34.583 -2.458 -7.260 1.00 0.00 C ATOM 1747 C GLY A 113 -33.830 -1.962 -6.042 1.00 0.00 C ATOM 1748 O GLY A 113 -33.597 -2.719 -5.099 1.00 0.00 O ATOM 0 H GLY A 113 -34.426 -4.482 -7.782 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -33.972 -2.306 -8.149 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -35.489 -1.866 -7.391 1.00 0.00 H new ATOM 1752 N MET A 114 -33.449 -0.690 -6.058 1.00 0.00 N ATOM 1753 CA MET A 114 -32.719 -0.100 -4.941 1.00 0.00 C ATOM 1754 C MET A 114 -31.411 -0.840 -4.696 1.00 0.00 C ATOM 1755 O MET A 114 -31.221 -1.963 -5.161 1.00 0.00 O ATOM 1756 CB MET A 114 -33.576 -0.125 -3.674 1.00 0.00 C ATOM 1757 CG MET A 114 -34.413 1.130 -3.483 1.00 0.00 C ATOM 1758 SD MET A 114 -34.793 1.453 -1.750 1.00 0.00 S ATOM 1759 CE MET A 114 -34.978 3.234 -1.769 1.00 0.00 C ATOM 0 H MET A 114 -33.633 -0.049 -6.829 1.00 0.00 H new ATOM 0 HA MET A 114 -32.489 0.935 -5.196 1.00 0.00 H new ATOM 0 HB2 MET A 114 -34.237 -0.991 -3.709 1.00 0.00 H new ATOM 0 HB3 MET A 114 -32.927 -0.254 -2.808 1.00 0.00 H new ATOM 0 HG2 MET A 114 -33.880 1.985 -3.900 1.00 0.00 H new ATOM 0 HG3 MET A 114 -35.343 1.031 -4.043 1.00 0.00 H new ATOM 0 HE1 MET A 114 -34.967 3.612 -0.747 1.00 0.00 H new ATOM 0 HE2 MET A 114 -34.156 3.679 -2.329 1.00 0.00 H new ATOM 0 HE3 MET A 114 -35.924 3.497 -2.243 1.00 0.00 H new ATOM 1769 N VAL A 115 -30.511 -0.196 -3.959 1.00 0.00 N ATOM 1770 CA VAL A 115 -29.208 -0.776 -3.638 1.00 0.00 C ATOM 1771 C VAL A 115 -28.224 -0.587 -4.788 1.00 0.00 C ATOM 1772 O VAL A 115 -28.437 -1.091 -5.890 1.00 0.00 O ATOM 1773 CB VAL A 115 -29.311 -2.282 -3.312 1.00 0.00 C ATOM 1774 CG1 VAL A 115 -28.066 -2.761 -2.583 1.00 0.00 C ATOM 1775 CG2 VAL A 115 -30.561 -2.565 -2.493 1.00 0.00 C ATOM 0 H VAL A 115 -30.661 0.735 -3.570 1.00 0.00 H new ATOM 0 HA VAL A 115 -28.846 -0.250 -2.755 1.00 0.00 H new ATOM 0 HB VAL A 115 -29.385 -2.833 -4.250 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -28.160 -3.824 -2.363 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -27.191 -2.596 -3.211 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -27.954 -2.206 -1.651 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -30.618 -3.631 -2.272 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -30.520 -2.003 -1.560 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -31.443 -2.264 -3.059 1.00 0.00 H new ATOM 1785 N ARG A 116 -27.145 0.143 -4.521 1.00 0.00 N ATOM 1786 CA ARG A 116 -26.125 0.400 -5.532 1.00 0.00 C ATOM 1787 C ARG A 116 -24.896 -0.471 -5.294 1.00 0.00 C ATOM 1788 O ARG A 116 -24.568 -0.800 -4.154 1.00 0.00 O ATOM 1789 CB ARG A 116 -25.729 1.877 -5.526 1.00 0.00 C ATOM 1790 CG ARG A 116 -25.962 2.574 -6.856 1.00 0.00 C ATOM 1791 CD ARG A 116 -25.283 3.934 -6.899 1.00 0.00 C ATOM 1792 NE ARG A 116 -25.779 4.757 -7.999 1.00 0.00 N ATOM 1793 CZ ARG A 116 -26.953 5.380 -7.980 1.00 0.00 C ATOM 1794 NH1 ARG A 116 -27.745 5.276 -6.923 1.00 0.00 N ATOM 1795 NH2 ARG A 116 -27.335 6.109 -9.021 1.00 0.00 N ATOM 0 H ARG A 116 -26.955 0.567 -3.613 1.00 0.00 H new ATOM 0 HA ARG A 116 -26.543 0.150 -6.507 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -26.295 2.393 -4.751 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -24.675 1.961 -5.261 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -25.582 1.951 -7.666 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -27.032 2.695 -7.022 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -25.449 4.452 -5.955 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -24.206 3.799 -7.004 1.00 0.00 H new ATOM 0 HE ARG A 116 -25.192 4.859 -8.827 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -27.454 4.717 -6.121 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -28.645 5.755 -6.911 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -26.728 6.191 -9.836 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -28.236 6.587 -9.006 1.00 0.00 H new ATOM 1809 N ARG A 117 -24.220 -0.844 -6.377 1.00 0.00 N ATOM 1810 CA ARG A 117 -23.029 -1.679 -6.280 1.00 0.00 C ATOM 1811 C ARG A 117 -21.901 -1.132 -7.147 1.00 0.00 C ATOM 1812 O ARG A 117 -22.126 -0.682 -8.271 1.00 0.00 O ATOM 1813 CB ARG A 117 -23.353 -3.117 -6.694 1.00 0.00 C ATOM 1814 CG ARG A 117 -23.994 -3.225 -8.069 1.00 0.00 C ATOM 1815 CD ARG A 117 -24.413 -4.654 -8.374 1.00 0.00 C ATOM 1816 NE ARG A 117 -25.480 -5.111 -7.488 1.00 0.00 N ATOM 1817 CZ ARG A 117 -26.135 -6.256 -7.655 1.00 0.00 C ATOM 1818 NH1 ARG A 117 -25.831 -7.054 -8.668 1.00 0.00 N ATOM 1819 NH2 ARG A 117 -27.094 -6.603 -6.807 1.00 0.00 N ATOM 0 H ARG A 117 -24.476 -0.582 -7.329 1.00 0.00 H new ATOM 0 HA ARG A 117 -22.698 -1.670 -5.241 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -22.435 -3.705 -6.683 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -24.022 -3.557 -5.955 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -24.864 -2.570 -8.119 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -23.292 -2.880 -8.828 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -24.748 -4.721 -9.409 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -23.551 -5.314 -8.274 1.00 0.00 H new ATOM 0 HE ARG A 117 -25.737 -4.519 -6.698 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -25.093 -6.790 -9.321 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -26.335 -7.932 -8.794 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -27.330 -5.991 -6.026 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -27.596 -7.482 -6.936 1.00 0.00 H new ATOM 1833 N LYS A 118 -20.685 -1.179 -6.613 1.00 0.00 N ATOM 1834 CA LYS A 118 -19.509 -0.694 -7.328 1.00 0.00 C ATOM 1835 C LYS A 118 -18.446 -1.779 -7.402 1.00 0.00 C ATOM 1836 O LYS A 118 -18.525 -2.791 -6.711 1.00 0.00 O ATOM 1837 CB LYS A 118 -18.941 0.547 -6.638 1.00 0.00 C ATOM 1838 CG LYS A 118 -19.699 1.823 -6.961 1.00 0.00 C ATOM 1839 CD LYS A 118 -19.163 3.004 -6.169 1.00 0.00 C ATOM 1840 CE LYS A 118 -17.791 3.431 -6.668 1.00 0.00 C ATOM 1841 NZ LYS A 118 -17.882 4.274 -7.893 1.00 0.00 N ATOM 0 H LYS A 118 -20.487 -1.550 -5.684 1.00 0.00 H new ATOM 0 HA LYS A 118 -19.809 -0.428 -8.341 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -18.953 0.390 -5.559 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -17.898 0.670 -6.931 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -19.622 2.033 -8.028 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -20.757 1.685 -6.739 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -19.857 3.841 -6.247 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -19.101 2.738 -5.114 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -17.276 3.985 -5.883 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -17.191 2.546 -6.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -16.926 4.544 -8.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -18.351 3.737 -8.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -18.433 5.131 -7.685 1.00 0.00 H new ATOM 1855 N ASN A 119 -17.454 -1.558 -8.251 1.00 0.00 N ATOM 1856 CA ASN A 119 -16.368 -2.518 -8.421 1.00 0.00 C ATOM 1857 C ASN A 119 -15.018 -1.879 -8.118 1.00 0.00 C ATOM 1858 O ASN A 119 -14.839 -0.672 -8.281 1.00 0.00 O ATOM 1859 CB ASN A 119 -16.374 -3.079 -9.843 1.00 0.00 C ATOM 1860 CG ASN A 119 -17.296 -4.273 -9.990 1.00 0.00 C ATOM 1861 OD1 ASN A 119 -16.916 -5.406 -9.692 1.00 0.00 O ATOM 1862 ND2 ASN A 119 -18.517 -4.026 -10.451 1.00 0.00 N ATOM 0 H ASN A 119 -17.376 -0.724 -8.833 1.00 0.00 H new ATOM 0 HA ASN A 119 -16.526 -3.333 -7.715 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -16.683 -2.298 -10.537 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -15.361 -3.370 -10.120 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -19.181 -4.791 -10.570 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -18.790 -3.072 -10.686 1.00 0.00 H new ATOM 1869 N LEU A 120 -14.070 -2.700 -7.678 1.00 0.00 N ATOM 1870 CA LEU A 120 -12.732 -2.221 -7.352 1.00 0.00 C ATOM 1871 C LEU A 120 -11.675 -3.232 -7.793 1.00 0.00 C ATOM 1872 O LEU A 120 -11.284 -4.109 -7.023 1.00 0.00 O ATOM 1873 CB LEU A 120 -12.612 -1.964 -5.848 1.00 0.00 C ATOM 1874 CG LEU A 120 -13.198 -0.634 -5.372 1.00 0.00 C ATOM 1875 CD1 LEU A 120 -14.638 -0.815 -4.921 1.00 0.00 C ATOM 1876 CD2 LEU A 120 -12.352 -0.053 -4.248 1.00 0.00 C ATOM 0 H LEU A 120 -14.204 -3.702 -7.539 1.00 0.00 H new ATOM 0 HA LEU A 120 -12.564 -1.286 -7.887 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -13.109 -2.775 -5.315 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -11.558 -2.000 -5.571 1.00 0.00 H new ATOM 0 HG LEU A 120 -13.188 0.066 -6.207 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -15.037 0.142 -4.586 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -15.236 -1.186 -5.753 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -14.675 -1.531 -4.100 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -12.782 0.893 -3.921 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -12.330 -0.751 -3.411 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -11.336 0.115 -4.607 1.00 0.00 H new ATOM 1888 N PRO A 121 -11.202 -3.123 -9.046 1.00 0.00 N ATOM 1889 CA PRO A 121 -10.189 -4.033 -9.589 1.00 0.00 C ATOM 1890 C PRO A 121 -8.960 -4.145 -8.693 1.00 0.00 C ATOM 1891 O PRO A 121 -8.513 -3.158 -8.107 1.00 0.00 O ATOM 1892 CB PRO A 121 -9.816 -3.394 -10.928 1.00 0.00 C ATOM 1893 CG PRO A 121 -11.014 -2.597 -11.316 1.00 0.00 C ATOM 1894 CD PRO A 121 -11.620 -2.106 -10.030 1.00 0.00 C ATOM 0 HA PRO A 121 -10.568 -5.051 -9.676 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -8.934 -2.761 -10.832 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -9.585 -4.151 -11.677 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -10.736 -1.763 -11.960 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -11.724 -3.207 -11.874 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -11.252 -1.115 -9.765 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -12.706 -2.035 -10.098 1.00 0.00 H new ATOM 1902 N ILE A 122 -8.416 -5.354 -8.597 1.00 0.00 N ATOM 1903 CA ILE A 122 -7.235 -5.602 -7.779 1.00 0.00 C ATOM 1904 C ILE A 122 -6.007 -5.831 -8.655 1.00 0.00 C ATOM 1905 O ILE A 122 -6.082 -6.512 -9.678 1.00 0.00 O ATOM 1906 CB ILE A 122 -7.433 -6.824 -6.860 1.00 0.00 C ATOM 1907 CG1 ILE A 122 -8.822 -6.788 -6.219 1.00 0.00 C ATOM 1908 CG2 ILE A 122 -6.351 -6.865 -5.791 1.00 0.00 C ATOM 1909 CD1 ILE A 122 -8.967 -5.733 -5.144 1.00 0.00 C ATOM 0 H ILE A 122 -8.776 -6.179 -9.077 1.00 0.00 H new ATOM 0 HA ILE A 122 -7.082 -4.717 -7.161 1.00 0.00 H new ATOM 0 HB ILE A 122 -7.355 -7.729 -7.462 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -9.566 -6.609 -6.995 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -9.040 -7.765 -5.789 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -6.505 -7.733 -5.151 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -5.372 -6.934 -6.266 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -6.399 -5.957 -5.189 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -9.977 -5.766 -4.735 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -8.247 -5.923 -4.348 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -8.782 -4.748 -5.573 1.00 0.00 H new ATOM 1921 N GLU A 123 -4.879 -5.256 -8.252 1.00 0.00 N ATOM 1922 CA GLU A 123 -3.640 -5.400 -9.008 1.00 0.00 C ATOM 1923 C GLU A 123 -2.481 -5.787 -8.100 1.00 0.00 C ATOM 1924 O GLU A 123 -2.529 -5.582 -6.890 1.00 0.00 O ATOM 1925 CB GLU A 123 -3.315 -4.100 -9.745 1.00 0.00 C ATOM 1926 CG GLU A 123 -4.235 -3.824 -10.922 1.00 0.00 C ATOM 1927 CD GLU A 123 -3.528 -3.953 -12.257 1.00 0.00 C ATOM 1928 OE1 GLU A 123 -3.479 -5.078 -12.797 1.00 0.00 O ATOM 1929 OE2 GLU A 123 -3.022 -2.929 -12.762 1.00 0.00 O ATOM 0 H GLU A 123 -4.797 -4.688 -7.409 1.00 0.00 H new ATOM 0 HA GLU A 123 -3.783 -6.199 -9.736 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -3.377 -3.268 -9.043 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -2.285 -4.141 -10.101 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -5.076 -4.517 -10.892 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -4.647 -2.819 -10.829 1.00 0.00 H new ATOM 1936 N TYR A 124 -1.439 -6.353 -8.698 1.00 0.00 N ATOM 1937 CA TYR A 124 -0.264 -6.776 -7.946 1.00 0.00 C ATOM 1938 C TYR A 124 0.999 -6.105 -8.478 1.00 0.00 C ATOM 1939 O TYR A 124 1.427 -6.370 -9.602 1.00 0.00 O ATOM 1940 CB TYR A 124 -0.116 -8.296 -8.009 1.00 0.00 C ATOM 1941 CG TYR A 124 -1.234 -9.042 -7.318 1.00 0.00 C ATOM 1942 CD1 TYR A 124 -1.198 -9.271 -5.948 1.00 0.00 C ATOM 1943 CD2 TYR A 124 -2.326 -9.516 -8.033 1.00 0.00 C ATOM 1944 CE1 TYR A 124 -2.218 -9.953 -5.311 1.00 0.00 C ATOM 1945 CE2 TYR A 124 -3.351 -10.197 -7.404 1.00 0.00 C ATOM 1946 CZ TYR A 124 -3.292 -10.413 -6.043 1.00 0.00 C ATOM 1947 OH TYR A 124 -4.309 -11.090 -5.412 1.00 0.00 O ATOM 0 H TYR A 124 -1.384 -6.529 -9.701 1.00 0.00 H new ATOM 0 HA TYR A 124 -0.400 -6.473 -6.908 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -0.075 -8.606 -9.053 1.00 0.00 H new ATOM 0 HB3 TYR A 124 0.834 -8.579 -7.555 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -0.359 -8.910 -5.371 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -2.375 -9.350 -9.099 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -2.174 -10.125 -4.246 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -4.194 -10.558 -7.975 1.00 0.00 H new ATOM 0 HH TYR A 124 -4.990 -11.345 -6.069 1.00 0.00 H new ATOM 1957 N ASN A 125 1.592 -5.239 -7.663 1.00 0.00 N ATOM 1958 CA ASN A 125 2.808 -4.533 -8.049 1.00 0.00 C ATOM 1959 C ASN A 125 4.045 -5.260 -7.534 1.00 0.00 C ATOM 1960 O ASN A 125 4.508 -5.009 -6.421 1.00 0.00 O ATOM 1961 CB ASN A 125 2.787 -3.099 -7.516 1.00 0.00 C ATOM 1962 CG ASN A 125 3.932 -2.265 -8.055 1.00 0.00 C ATOM 1963 OD1 ASN A 125 4.467 -2.546 -9.128 1.00 0.00 O ATOM 1964 ND2 ASN A 125 4.315 -1.233 -7.314 1.00 0.00 N ATOM 0 H ASN A 125 1.250 -5.009 -6.730 1.00 0.00 H new ATOM 0 HA ASN A 125 2.849 -4.506 -9.138 1.00 0.00 H new ATOM 0 HB2 ASN A 125 1.841 -2.629 -7.784 1.00 0.00 H new ATOM 0 HB3 ASN A 125 2.836 -3.118 -6.427 1.00 0.00 H new ATOM 0 HD21 ASN A 125 5.081 -0.636 -7.627 1.00 0.00 H new ATOM 0 HD22 ASN A 125 3.844 -1.036 -6.431 1.00 0.00 H new ATOM 1971 N LEU A 126 4.575 -6.165 -8.350 1.00 0.00 N ATOM 1972 CA LEU A 126 5.758 -6.931 -7.979 1.00 0.00 C ATOM 1973 C LEU A 126 7.002 -6.049 -7.986 1.00 0.00 C ATOM 1974 O LEU A 126 7.900 -6.289 -7.154 1.00 0.00 O ATOM 1975 CB LEU A 126 5.945 -8.109 -8.937 1.00 0.00 C ATOM 1976 CG LEU A 126 4.776 -9.094 -8.986 1.00 0.00 C ATOM 1977 CD1 LEU A 126 4.726 -9.797 -10.333 1.00 0.00 C ATOM 1978 CD2 LEU A 126 4.887 -10.107 -7.856 1.00 0.00 C ATOM 1979 OXT LEU A 126 7.066 -5.127 -8.825 1.00 0.00 O ATOM 0 H LEU A 126 4.203 -6.386 -9.274 1.00 0.00 H new ATOM 0 HA LEU A 126 5.614 -7.312 -6.968 1.00 0.00 H new ATOM 0 HB2 LEU A 126 6.114 -7.718 -9.941 1.00 0.00 H new ATOM 0 HB3 LEU A 126 6.846 -8.652 -8.650 1.00 0.00 H new ATOM 0 HG LEU A 126 3.849 -8.536 -8.858 1.00 0.00 H new ATOM 0 HD11 LEU A 126 3.888 -10.494 -10.349 1.00 0.00 H new ATOM 0 HD12 LEU A 126 4.599 -9.058 -11.124 1.00 0.00 H new ATOM 0 HD13 LEU A 126 5.655 -10.344 -10.493 1.00 0.00 H new ATOM 0 HD21 LEU A 126 4.047 -10.800 -7.905 1.00 0.00 H new ATOM 0 HD22 LEU A 126 5.821 -10.660 -7.954 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.872 -9.587 -6.898 1.00 0.00 H new TER 1991 LEU A 126 ATOM 1992 N ALA B 1 43.861 -6.903 -6.494 1.00 0.00 N ATOM 1993 CA ALA B 1 43.523 -7.743 -5.316 1.00 0.00 C ATOM 1994 C ALA B 1 42.042 -7.632 -4.971 1.00 0.00 C ATOM 1995 O ALA B 1 41.251 -8.518 -5.293 1.00 0.00 O ATOM 1996 CB ALA B 1 44.374 -7.341 -4.121 1.00 0.00 C ATOM 0 H1 ALA B 1 44.874 -6.997 -6.708 1.00 0.00 H new ATOM 0 H2 ALA B 1 43.304 -7.216 -7.315 1.00 0.00 H new ATOM 0 H3 ALA B 1 43.642 -5.908 -6.285 1.00 0.00 H new ATOM 0 HA ALA B 1 43.735 -8.782 -5.568 1.00 0.00 H new ATOM 0 HB1 ALA B 1 44.116 -7.964 -3.265 1.00 0.00 H new ATOM 0 HB2 ALA B 1 45.428 -7.475 -4.363 1.00 0.00 H new ATOM 0 HB3 ALA B 1 44.188 -6.295 -3.877 1.00 0.00 H new ATOM 2004 N GLN B 2 41.675 -6.536 -4.316 1.00 0.00 N ATOM 2005 CA GLN B 2 40.287 -6.308 -3.927 1.00 0.00 C ATOM 2006 C GLN B 2 39.854 -7.292 -2.845 1.00 0.00 C ATOM 2007 O GLN B 2 39.940 -8.507 -3.026 1.00 0.00 O ATOM 2008 CB GLN B 2 39.369 -6.434 -5.144 1.00 0.00 C ATOM 2009 CG GLN B 2 38.156 -5.519 -5.086 1.00 0.00 C ATOM 2010 CD GLN B 2 37.131 -5.840 -6.156 1.00 0.00 C ATOM 2011 OE1 GLN B 2 37.478 -6.278 -7.253 1.00 0.00 O ATOM 2012 NE2 GLN B 2 35.859 -5.624 -5.841 1.00 0.00 N ATOM 0 H GLN B 2 42.318 -5.792 -4.043 1.00 0.00 H new ATOM 0 HA GLN B 2 40.210 -5.298 -3.524 1.00 0.00 H new ATOM 0 HB2 GLN B 2 39.940 -6.210 -6.045 1.00 0.00 H new ATOM 0 HB3 GLN B 2 39.031 -7.467 -5.229 1.00 0.00 H new ATOM 0 HG2 GLN B 2 37.689 -5.603 -4.105 1.00 0.00 H new ATOM 0 HG3 GLN B 2 38.480 -4.484 -5.198 1.00 0.00 H new ATOM 0 HE21 GLN B 2 35.617 -5.260 -4.920 1.00 0.00 H new ATOM 0 HE22 GLN B 2 35.125 -5.822 -6.520 1.00 0.00 H new ATOM 2021 N SER B 3 39.384 -6.761 -1.721 1.00 0.00 N ATOM 2022 CA SER B 3 38.935 -7.594 -0.612 1.00 0.00 C ATOM 2023 C SER B 3 37.646 -8.324 -0.973 1.00 0.00 C ATOM 2024 O SER B 3 37.573 -9.551 -0.899 1.00 0.00 O ATOM 2025 CB SER B 3 38.720 -6.743 0.640 1.00 0.00 C ATOM 2026 OG SER B 3 37.392 -6.254 0.704 1.00 0.00 O ATOM 0 H SER B 3 39.304 -5.758 -1.554 1.00 0.00 H new ATOM 0 HA SER B 3 39.708 -8.335 -0.408 1.00 0.00 H new ATOM 0 HB2 SER B 3 38.935 -7.337 1.528 1.00 0.00 H new ATOM 0 HB3 SER B 3 39.419 -5.907 0.639 1.00 0.00 H new ATOM 0 HG SER B 3 37.281 -5.715 1.515 1.00 0.00 H new ATOM 2032 N VAL B 4 36.631 -7.561 -1.366 1.00 0.00 N ATOM 2033 CA VAL B 4 35.345 -8.134 -1.743 1.00 0.00 C ATOM 2034 C VAL B 4 34.352 -7.043 -2.137 1.00 0.00 C ATOM 2035 O VAL B 4 34.276 -5.998 -1.490 1.00 0.00 O ATOM 2036 CB VAL B 4 34.743 -8.972 -0.598 1.00 0.00 C ATOM 2037 CG1 VAL B 4 34.587 -8.129 0.658 1.00 0.00 C ATOM 2038 CG2 VAL B 4 33.409 -9.572 -1.016 1.00 0.00 C ATOM 0 H VAL B 4 36.675 -6.544 -1.431 1.00 0.00 H new ATOM 0 HA VAL B 4 35.528 -8.783 -2.599 1.00 0.00 H new ATOM 0 HB VAL B 4 35.428 -9.790 -0.375 1.00 0.00 H new ATOM 0 HG11 VAL B 4 34.161 -8.739 1.455 1.00 0.00 H new ATOM 0 HG12 VAL B 4 35.563 -7.756 0.969 1.00 0.00 H new ATOM 0 HG13 VAL B 4 33.926 -7.287 0.452 1.00 0.00 H new ATOM 0 HG21 VAL B 4 33.001 -10.160 -0.194 1.00 0.00 H new ATOM 0 HG22 VAL B 4 32.714 -8.772 -1.270 1.00 0.00 H new ATOM 0 HG23 VAL B 4 33.555 -10.215 -1.884 1.00 0.00 H new ATOM 2048 N PRO B 5 33.574 -7.271 -3.210 1.00 0.00 N ATOM 2049 CA PRO B 5 32.584 -6.302 -3.688 1.00 0.00 C ATOM 2050 C PRO B 5 31.318 -6.296 -2.835 1.00 0.00 C ATOM 2051 O PRO B 5 31.100 -7.198 -2.027 1.00 0.00 O ATOM 2052 CB PRO B 5 32.274 -6.797 -5.099 1.00 0.00 C ATOM 2053 CG PRO B 5 32.488 -8.269 -5.036 1.00 0.00 C ATOM 2054 CD PRO B 5 33.598 -8.491 -4.042 1.00 0.00 C ATOM 0 HA PRO B 5 32.956 -5.278 -3.647 1.00 0.00 H new ATOM 0 HB2 PRO B 5 31.251 -6.557 -5.387 1.00 0.00 H new ATOM 0 HB3 PRO B 5 32.930 -6.332 -5.835 1.00 0.00 H new ATOM 0 HG2 PRO B 5 31.578 -8.781 -4.724 1.00 0.00 H new ATOM 0 HG3 PRO B 5 32.757 -8.665 -6.015 1.00 0.00 H new ATOM 0 HD2 PRO B 5 33.427 -9.386 -3.444 1.00 0.00 H new ATOM 0 HD3 PRO B 5 34.560 -8.618 -4.538 1.00 0.00 H new ATOM 2062 N PRO B 6 30.463 -5.272 -3.007 1.00 0.00 N ATOM 2063 CA PRO B 6 29.213 -5.153 -2.249 1.00 0.00 C ATOM 2064 C PRO B 6 28.173 -6.182 -2.681 1.00 0.00 C ATOM 2065 O PRO B 6 27.623 -6.100 -3.779 1.00 0.00 O ATOM 2066 CB PRO B 6 28.733 -3.738 -2.578 1.00 0.00 C ATOM 2067 CG PRO B 6 29.323 -3.441 -3.913 1.00 0.00 C ATOM 2068 CD PRO B 6 30.647 -4.154 -3.951 1.00 0.00 C ATOM 0 HA PRO B 6 29.363 -5.330 -1.184 1.00 0.00 H new ATOM 0 HB2 PRO B 6 27.645 -3.685 -2.605 1.00 0.00 H new ATOM 0 HB3 PRO B 6 29.068 -3.021 -1.828 1.00 0.00 H new ATOM 0 HG2 PRO B 6 28.670 -3.788 -4.714 1.00 0.00 H new ATOM 0 HG3 PRO B 6 29.454 -2.368 -4.051 1.00 0.00 H new ATOM 0 HD2 PRO B 6 30.882 -4.510 -4.954 1.00 0.00 H new ATOM 0 HD3 PRO B 6 31.464 -3.500 -3.645 1.00 0.00 H new ATOM 2076 N GLY B 7 27.910 -7.151 -1.810 1.00 0.00 N ATOM 2077 CA GLY B 7 26.937 -8.183 -2.120 1.00 0.00 C ATOM 2078 C GLY B 7 25.547 -7.623 -2.343 1.00 0.00 C ATOM 2079 O GLY B 7 25.087 -6.768 -1.585 1.00 0.00 O ATOM 0 H GLY B 7 28.353 -7.240 -0.896 1.00 0.00 H new ATOM 0 HA2 GLY B 7 27.256 -8.722 -3.013 1.00 0.00 H new ATOM 0 HA3 GLY B 7 26.907 -8.906 -1.305 1.00 0.00 H new ATOM 2083 N ASP B 8 24.875 -8.104 -3.383 1.00 0.00 N ATOM 2084 CA ASP B 8 23.526 -7.646 -3.704 1.00 0.00 C ATOM 2085 C ASP B 8 22.630 -7.676 -2.470 1.00 0.00 C ATOM 2086 O ASP B 8 22.844 -8.470 -1.554 1.00 0.00 O ATOM 2087 CB ASP B 8 22.921 -8.515 -4.808 1.00 0.00 C ATOM 2088 CG ASP B 8 23.036 -7.873 -6.176 1.00 0.00 C ATOM 2089 OD1 ASP B 8 23.962 -7.058 -6.374 1.00 0.00 O ATOM 2090 OD2 ASP B 8 22.201 -8.186 -7.051 1.00 0.00 O ATOM 0 H ASP B 8 25.242 -8.812 -4.019 1.00 0.00 H new ATOM 0 HA ASP B 8 23.594 -6.616 -4.055 1.00 0.00 H new ATOM 0 HB2 ASP B 8 23.422 -9.483 -4.821 1.00 0.00 H new ATOM 0 HB3 ASP B 8 21.871 -8.703 -4.585 1.00 0.00 H new ATOM 2095 N ILE B 9 21.625 -6.806 -2.454 1.00 0.00 N ATOM 2096 CA ILE B 9 20.695 -6.735 -1.334 1.00 0.00 C ATOM 2097 C ILE B 9 19.273 -7.060 -1.776 1.00 0.00 C ATOM 2098 O ILE B 9 18.878 -6.756 -2.901 1.00 0.00 O ATOM 2099 CB ILE B 9 20.710 -5.339 -0.675 1.00 0.00 C ATOM 2100 CG1 ILE B 9 20.191 -4.275 -1.647 1.00 0.00 C ATOM 2101 CG2 ILE B 9 22.114 -4.991 -0.203 1.00 0.00 C ATOM 2102 CD1 ILE B 9 19.618 -3.053 -0.959 1.00 0.00 C ATOM 0 H ILE B 9 21.434 -6.141 -3.204 1.00 0.00 H new ATOM 0 HA ILE B 9 21.024 -7.476 -0.605 1.00 0.00 H new ATOM 0 HB ILE B 9 20.048 -5.361 0.191 1.00 0.00 H new ATOM 0 HG12 ILE B 9 21.005 -3.965 -2.302 1.00 0.00 H new ATOM 0 HG13 ILE B 9 19.423 -4.718 -2.281 1.00 0.00 H new ATOM 0 HG21 ILE B 9 22.108 -4.004 0.259 1.00 0.00 H new ATOM 0 HG22 ILE B 9 22.447 -5.731 0.525 1.00 0.00 H new ATOM 0 HG23 ILE B 9 22.794 -4.989 -1.055 1.00 0.00 H new ATOM 0 HD11 ILE B 9 19.270 -2.343 -1.709 1.00 0.00 H new ATOM 0 HD12 ILE B 9 18.782 -3.350 -0.326 1.00 0.00 H new ATOM 0 HD13 ILE B 9 20.389 -2.585 -0.346 1.00 0.00 H new ATOM 2114 N ASN B 10 18.504 -7.675 -0.883 1.00 0.00 N ATOM 2115 CA ASN B 10 17.123 -8.035 -1.184 1.00 0.00 C ATOM 2116 C ASN B 10 16.196 -6.847 -0.947 1.00 0.00 C ATOM 2117 O ASN B 10 16.369 -6.095 0.011 1.00 0.00 O ATOM 2118 CB ASN B 10 16.682 -9.222 -0.327 1.00 0.00 C ATOM 2119 CG ASN B 10 16.666 -10.523 -1.107 1.00 0.00 C ATOM 2120 OD1 ASN B 10 15.810 -10.733 -1.967 1.00 0.00 O ATOM 2121 ND2 ASN B 10 17.611 -11.405 -0.808 1.00 0.00 N ATOM 0 H ASN B 10 18.813 -7.934 0.054 1.00 0.00 H new ATOM 0 HA ASN B 10 17.065 -8.319 -2.235 1.00 0.00 H new ATOM 0 HB2 ASN B 10 17.354 -9.321 0.526 1.00 0.00 H new ATOM 0 HB3 ASN B 10 15.686 -9.029 0.072 1.00 0.00 H new ATOM 0 HD21 ASN B 10 17.648 -12.299 -1.298 1.00 0.00 H new ATOM 0 HD22 ASN B 10 18.301 -11.189 -0.088 1.00 0.00 H new ATOM 2128 N THR B 11 15.213 -6.683 -1.827 1.00 0.00 N ATOM 2129 CA THR B 11 14.264 -5.583 -1.710 1.00 0.00 C ATOM 2130 C THR B 11 12.830 -6.077 -1.875 1.00 0.00 C ATOM 2131 O THR B 11 12.546 -6.923 -2.723 1.00 0.00 O ATOM 2132 CB THR B 11 14.568 -4.506 -2.753 1.00 0.00 C ATOM 2133 OG1 THR B 11 15.198 -5.072 -3.889 1.00 0.00 O ATOM 2134 CG2 THR B 11 15.466 -3.405 -2.232 1.00 0.00 C ATOM 0 H THR B 11 15.054 -7.296 -2.626 1.00 0.00 H new ATOM 0 HA THR B 11 14.367 -5.154 -0.713 1.00 0.00 H new ATOM 0 HB THR B 11 13.602 -4.073 -3.011 1.00 0.00 H new ATOM 0 HG1 THR B 11 14.683 -4.851 -4.693 1.00 0.00 H new ATOM 0 HG21 THR B 11 15.642 -2.675 -3.022 1.00 0.00 H new ATOM 0 HG22 THR B 11 14.987 -2.915 -1.385 1.00 0.00 H new ATOM 0 HG23 THR B 11 16.417 -3.831 -1.914 1.00 0.00 H new ATOM 2142 N GLN B 12 11.931 -5.539 -1.058 1.00 0.00 N ATOM 2143 CA GLN B 12 10.523 -5.918 -1.106 1.00 0.00 C ATOM 2144 C GLN B 12 9.629 -4.682 -0.980 1.00 0.00 C ATOM 2145 O GLN B 12 9.559 -4.076 0.089 1.00 0.00 O ATOM 2146 CB GLN B 12 10.204 -6.905 0.019 1.00 0.00 C ATOM 2147 CG GLN B 12 11.195 -8.052 0.123 1.00 0.00 C ATOM 2148 CD GLN B 12 10.634 -9.239 0.881 1.00 0.00 C ATOM 2149 OE1 GLN B 12 10.658 -10.369 0.394 1.00 0.00 O ATOM 2150 NE2 GLN B 12 10.124 -8.987 2.081 1.00 0.00 N ATOM 0 H GLN B 12 12.153 -4.837 -0.352 1.00 0.00 H new ATOM 0 HA GLN B 12 10.328 -6.395 -2.067 1.00 0.00 H new ATOM 0 HB2 GLN B 12 10.183 -6.368 0.967 1.00 0.00 H new ATOM 0 HB3 GLN B 12 9.205 -7.312 -0.139 1.00 0.00 H new ATOM 0 HG2 GLN B 12 11.485 -8.369 -0.879 1.00 0.00 H new ATOM 0 HG3 GLN B 12 12.099 -7.702 0.621 1.00 0.00 H new ATOM 0 HE21 GLN B 12 10.125 -8.034 2.446 1.00 0.00 H new ATOM 0 HE22 GLN B 12 9.731 -9.746 2.638 1.00 0.00 H new ATOM 2159 N PRO B 13 8.929 -4.279 -2.063 1.00 0.00 N ATOM 2160 CA PRO B 13 8.969 -4.958 -3.368 1.00 0.00 C ATOM 2161 C PRO B 13 10.356 -4.941 -3.995 1.00 0.00 C ATOM 2162 O PRO B 13 11.246 -4.217 -3.551 1.00 0.00 O ATOM 2163 CB PRO B 13 7.986 -4.158 -4.228 1.00 0.00 C ATOM 2164 CG PRO B 13 7.869 -2.836 -3.552 1.00 0.00 C ATOM 2165 CD PRO B 13 8.033 -3.111 -2.085 1.00 0.00 C ATOM 0 HA PRO B 13 8.712 -6.013 -3.276 1.00 0.00 H new ATOM 0 HB2 PRO B 13 8.353 -4.048 -5.248 1.00 0.00 H new ATOM 0 HB3 PRO B 13 7.019 -4.657 -4.289 1.00 0.00 H new ATOM 0 HG2 PRO B 13 8.633 -2.146 -3.908 1.00 0.00 H new ATOM 0 HG3 PRO B 13 6.903 -2.376 -3.758 1.00 0.00 H new ATOM 0 HD2 PRO B 13 8.468 -2.260 -1.561 1.00 0.00 H new ATOM 0 HD3 PRO B 13 7.078 -3.326 -1.606 1.00 0.00 H new ATOM 2173 N SER B 14 10.527 -5.753 -5.035 1.00 0.00 N ATOM 2174 CA SER B 14 11.803 -5.854 -5.743 1.00 0.00 C ATOM 2175 C SER B 14 12.427 -4.478 -5.970 1.00 0.00 C ATOM 2176 O SER B 14 13.460 -4.152 -5.386 1.00 0.00 O ATOM 2177 CB SER B 14 11.605 -6.561 -7.084 1.00 0.00 C ATOM 2178 OG SER B 14 11.530 -7.966 -6.914 1.00 0.00 O ATOM 0 H SER B 14 9.793 -6.355 -5.409 1.00 0.00 H new ATOM 0 HA SER B 14 12.484 -6.436 -5.122 1.00 0.00 H new ATOM 0 HB2 SER B 14 10.692 -6.200 -7.558 1.00 0.00 H new ATOM 0 HB3 SER B 14 12.430 -6.316 -7.753 1.00 0.00 H new ATOM 0 HG SER B 14 11.402 -8.395 -7.786 1.00 0.00 H new ATOM 2184 N GLN B 15 11.795 -3.678 -6.821 1.00 0.00 N ATOM 2185 CA GLN B 15 12.292 -2.341 -7.122 1.00 0.00 C ATOM 2186 C GLN B 15 11.219 -1.497 -7.800 1.00 0.00 C ATOM 2187 O GLN B 15 11.494 -0.788 -8.768 1.00 0.00 O ATOM 2188 CB GLN B 15 13.531 -2.426 -8.017 1.00 0.00 C ATOM 2189 CG GLN B 15 13.418 -3.476 -9.110 1.00 0.00 C ATOM 2190 CD GLN B 15 13.488 -2.878 -10.501 1.00 0.00 C ATOM 2191 OE1 GLN B 15 14.382 -2.089 -10.807 1.00 0.00 O ATOM 2192 NE2 GLN B 15 12.541 -3.253 -11.353 1.00 0.00 N ATOM 0 H GLN B 15 10.939 -3.931 -7.314 1.00 0.00 H new ATOM 0 HA GLN B 15 12.561 -1.862 -6.181 1.00 0.00 H new ATOM 0 HB2 GLN B 15 13.706 -1.453 -8.476 1.00 0.00 H new ATOM 0 HB3 GLN B 15 14.401 -2.648 -7.399 1.00 0.00 H new ATOM 0 HG2 GLN B 15 14.219 -4.206 -8.992 1.00 0.00 H new ATOM 0 HG3 GLN B 15 12.477 -4.014 -8.996 1.00 0.00 H new ATOM 0 HE21 GLN B 15 11.819 -3.910 -11.056 1.00 0.00 H new ATOM 0 HE22 GLN B 15 12.536 -2.884 -12.304 1.00 0.00 H new ATOM 2201 N LYS B 16 9.997 -1.573 -7.285 1.00 0.00 N ATOM 2202 CA LYS B 16 8.885 -0.812 -7.845 1.00 0.00 C ATOM 2203 C LYS B 16 7.755 -0.665 -6.831 1.00 0.00 C ATOM 2204 O LYS B 16 7.228 -1.655 -6.324 1.00 0.00 O ATOM 2205 CB LYS B 16 8.363 -1.488 -9.113 1.00 0.00 C ATOM 2206 CG LYS B 16 7.380 -0.632 -9.897 1.00 0.00 C ATOM 2207 CD LYS B 16 7.582 -0.781 -11.397 1.00 0.00 C ATOM 2208 CE LYS B 16 6.674 -1.854 -11.977 1.00 0.00 C ATOM 2209 NZ LYS B 16 5.458 -1.271 -12.607 1.00 0.00 N ATOM 0 H LYS B 16 9.751 -2.152 -6.482 1.00 0.00 H new ATOM 0 HA LYS B 16 9.252 0.183 -8.096 1.00 0.00 H new ATOM 0 HB2 LYS B 16 9.207 -1.738 -9.755 1.00 0.00 H new ATOM 0 HB3 LYS B 16 7.879 -2.427 -8.842 1.00 0.00 H new ATOM 0 HG2 LYS B 16 6.360 -0.916 -9.636 1.00 0.00 H new ATOM 0 HG3 LYS B 16 7.501 0.414 -9.615 1.00 0.00 H new ATOM 0 HD2 LYS B 16 7.382 0.171 -11.889 1.00 0.00 H new ATOM 0 HD3 LYS B 16 8.622 -1.033 -11.602 1.00 0.00 H new ATOM 0 HE2 LYS B 16 7.224 -2.434 -12.718 1.00 0.00 H new ATOM 0 HE3 LYS B 16 6.378 -2.545 -11.188 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 4.865 -2.035 -12.990 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 4.919 -0.739 -11.894 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 5.739 -0.631 -13.377 1.00 0.00 H new ATOM 2223 N ILE B 17 7.385 0.579 -6.543 1.00 0.00 N ATOM 2224 CA ILE B 17 6.315 0.859 -5.594 1.00 0.00 C ATOM 2225 C ILE B 17 5.320 1.856 -6.178 1.00 0.00 C ATOM 2226 O ILE B 17 5.677 2.682 -7.018 1.00 0.00 O ATOM 2227 CB ILE B 17 6.868 1.415 -4.269 1.00 0.00 C ATOM 2228 CG1 ILE B 17 5.741 1.574 -3.246 1.00 0.00 C ATOM 2229 CG2 ILE B 17 7.572 2.743 -4.503 1.00 0.00 C ATOM 2230 CD1 ILE B 17 6.225 1.586 -1.813 1.00 0.00 C ATOM 0 H ILE B 17 7.811 1.409 -6.954 1.00 0.00 H new ATOM 0 HA ILE B 17 5.809 -0.086 -5.395 1.00 0.00 H new ATOM 0 HB ILE B 17 7.595 0.707 -3.871 1.00 0.00 H new ATOM 0 HG12 ILE B 17 5.206 2.502 -3.448 1.00 0.00 H new ATOM 0 HG13 ILE B 17 5.028 0.760 -3.374 1.00 0.00 H new ATOM 0 HG21 ILE B 17 7.957 3.122 -3.556 1.00 0.00 H new ATOM 0 HG22 ILE B 17 8.398 2.599 -5.199 1.00 0.00 H new ATOM 0 HG23 ILE B 17 6.866 3.460 -4.921 1.00 0.00 H new ATOM 0 HD11 ILE B 17 5.374 1.702 -1.142 1.00 0.00 H new ATOM 0 HD12 ILE B 17 6.735 0.648 -1.593 1.00 0.00 H new ATOM 0 HD13 ILE B 17 6.916 2.417 -1.669 1.00 0.00 H new ATOM 2242 N VAL B 18 4.069 1.771 -5.736 1.00 0.00 N ATOM 2243 CA VAL B 18 3.027 2.667 -6.225 1.00 0.00 C ATOM 2244 C VAL B 18 2.122 3.145 -5.095 1.00 0.00 C ATOM 2245 O VAL B 18 1.215 2.431 -4.669 1.00 0.00 O ATOM 2246 CB VAL B 18 2.165 1.982 -7.304 1.00 0.00 C ATOM 2247 CG1 VAL B 18 1.543 0.705 -6.759 1.00 0.00 C ATOM 2248 CG2 VAL B 18 1.091 2.930 -7.816 1.00 0.00 C ATOM 0 H VAL B 18 3.753 1.093 -5.042 1.00 0.00 H new ATOM 0 HA VAL B 18 3.534 3.528 -6.660 1.00 0.00 H new ATOM 0 HB VAL B 18 2.810 1.717 -8.142 1.00 0.00 H new ATOM 0 HG11 VAL B 18 0.938 0.235 -7.535 1.00 0.00 H new ATOM 0 HG12 VAL B 18 2.332 0.020 -6.449 1.00 0.00 H new ATOM 0 HG13 VAL B 18 0.913 0.944 -5.902 1.00 0.00 H new ATOM 0 HG21 VAL B 18 0.494 2.427 -8.577 1.00 0.00 H new ATOM 0 HG22 VAL B 18 0.447 3.231 -6.990 1.00 0.00 H new ATOM 0 HG23 VAL B 18 1.561 3.813 -8.249 1.00 0.00 H new ATOM 2258 N PHE B 19 2.368 4.362 -4.618 1.00 0.00 N ATOM 2259 CA PHE B 19 1.566 4.938 -3.544 1.00 0.00 C ATOM 2260 C PHE B 19 0.083 4.890 -3.897 1.00 0.00 C ATOM 2261 O PHE B 19 -0.366 5.560 -4.825 1.00 0.00 O ATOM 2262 CB PHE B 19 1.992 6.383 -3.278 1.00 0.00 C ATOM 2263 CG PHE B 19 3.115 6.507 -2.289 1.00 0.00 C ATOM 2264 CD1 PHE B 19 4.434 6.404 -2.702 1.00 0.00 C ATOM 2265 CD2 PHE B 19 2.852 6.728 -0.947 1.00 0.00 C ATOM 2266 CE1 PHE B 19 5.469 6.518 -1.794 1.00 0.00 C ATOM 2267 CE2 PHE B 19 3.884 6.843 -0.034 1.00 0.00 C ATOM 2268 CZ PHE B 19 5.193 6.738 -0.458 1.00 0.00 C ATOM 0 H PHE B 19 3.115 4.967 -4.958 1.00 0.00 H new ATOM 0 HA PHE B 19 1.730 4.349 -2.642 1.00 0.00 H new ATOM 0 HB2 PHE B 19 2.295 6.842 -4.219 1.00 0.00 H new ATOM 0 HB3 PHE B 19 1.133 6.945 -2.911 1.00 0.00 H new ATOM 0 HD1 PHE B 19 4.655 6.233 -3.745 1.00 0.00 H new ATOM 0 HD2 PHE B 19 1.829 6.811 -0.610 1.00 0.00 H new ATOM 0 HE1 PHE B 19 6.493 6.435 -2.128 1.00 0.00 H new ATOM 0 HE2 PHE B 19 3.666 7.015 1.010 1.00 0.00 H new ATOM 0 HZ PHE B 19 6.001 6.828 0.253 1.00 0.00 H new ATOM 2278 N ASN B 20 -0.672 4.088 -3.153 1.00 0.00 N ATOM 2279 CA ASN B 20 -2.104 3.946 -3.390 1.00 0.00 C ATOM 2280 C ASN B 20 -2.887 5.095 -2.761 1.00 0.00 C ATOM 2281 O ASN B 20 -2.672 5.444 -1.600 1.00 0.00 O ATOM 2282 CB ASN B 20 -2.602 2.612 -2.833 1.00 0.00 C ATOM 2283 CG ASN B 20 -2.359 1.458 -3.788 1.00 0.00 C ATOM 2284 OD1 ASN B 20 -3.282 0.976 -4.443 1.00 0.00 O ATOM 2285 ND2 ASN B 20 -1.112 1.010 -3.869 1.00 0.00 N ATOM 0 H ASN B 20 -0.315 3.526 -2.380 1.00 0.00 H new ATOM 0 HA ASN B 20 -2.268 3.971 -4.467 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -2.102 2.408 -1.886 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -3.669 2.686 -2.621 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -0.888 0.235 -4.494 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -0.378 1.440 -3.307 1.00 0.00 H new ATOM 2292 N ALA B 21 -3.802 5.673 -3.534 1.00 0.00 N ATOM 2293 CA ALA B 21 -4.629 6.777 -3.057 1.00 0.00 C ATOM 2294 C ALA B 21 -5.251 6.445 -1.699 1.00 0.00 C ATOM 2295 O ALA B 21 -5.173 5.303 -1.245 1.00 0.00 O ATOM 2296 CB ALA B 21 -5.712 7.092 -4.078 1.00 0.00 C ATOM 0 H ALA B 21 -3.990 5.394 -4.497 1.00 0.00 H new ATOM 0 HA ALA B 21 -3.996 7.656 -2.930 1.00 0.00 H new ATOM 0 HB1 ALA B 21 -6.325 7.917 -3.715 1.00 0.00 H new ATOM 0 HB2 ALA B 21 -5.249 7.373 -5.024 1.00 0.00 H new ATOM 0 HB3 ALA B 21 -6.338 6.212 -4.227 1.00 0.00 H new ATOM 2302 N PRO B 22 -5.878 7.431 -1.023 1.00 0.00 N ATOM 2303 CA PRO B 22 -6.004 8.811 -1.515 1.00 0.00 C ATOM 2304 C PRO B 22 -4.715 9.609 -1.364 1.00 0.00 C ATOM 2305 O PRO B 22 -3.782 9.186 -0.683 1.00 0.00 O ATOM 2306 CB PRO B 22 -7.096 9.397 -0.621 1.00 0.00 C ATOM 2307 CG PRO B 22 -6.973 8.648 0.659 1.00 0.00 C ATOM 2308 CD PRO B 22 -6.523 7.259 0.293 1.00 0.00 C ATOM 0 HA PRO B 22 -6.231 8.844 -2.581 1.00 0.00 H new ATOM 0 HB2 PRO B 22 -6.953 10.467 -0.470 1.00 0.00 H new ATOM 0 HB3 PRO B 22 -8.084 9.267 -1.064 1.00 0.00 H new ATOM 0 HG2 PRO B 22 -6.254 9.128 1.323 1.00 0.00 H new ATOM 0 HG3 PRO B 22 -7.926 8.622 1.187 1.00 0.00 H new ATOM 0 HD2 PRO B 22 -5.827 6.857 1.030 1.00 0.00 H new ATOM 0 HD3 PRO B 22 -7.364 6.568 0.239 1.00 0.00 H new ATOM 2316 N TYR B 23 -4.678 10.769 -2.009 1.00 0.00 N ATOM 2317 CA TYR B 23 -3.509 11.640 -1.957 1.00 0.00 C ATOM 2318 C TYR B 23 -3.842 12.962 -1.277 1.00 0.00 C ATOM 2319 O TYR B 23 -3.267 14.002 -1.599 1.00 0.00 O ATOM 2320 CB TYR B 23 -2.977 11.891 -3.367 1.00 0.00 C ATOM 2321 CG TYR B 23 -2.640 10.618 -4.105 1.00 0.00 C ATOM 2322 CD1 TYR B 23 -2.128 9.522 -3.424 1.00 0.00 C ATOM 2323 CD2 TYR B 23 -2.840 10.508 -5.474 1.00 0.00 C ATOM 2324 CE1 TYR B 23 -1.822 8.351 -4.087 1.00 0.00 C ATOM 2325 CE2 TYR B 23 -2.537 9.339 -6.145 1.00 0.00 C ATOM 2326 CZ TYR B 23 -2.028 8.264 -5.448 1.00 0.00 C ATOM 2327 OH TYR B 23 -1.726 7.098 -6.114 1.00 0.00 O ATOM 0 H TYR B 23 -5.446 11.129 -2.576 1.00 0.00 H new ATOM 0 HA TYR B 23 -2.738 11.141 -1.369 1.00 0.00 H new ATOM 0 HB2 TYR B 23 -3.721 12.449 -3.936 1.00 0.00 H new ATOM 0 HB3 TYR B 23 -2.086 12.517 -3.307 1.00 0.00 H new ATOM 0 HD1 TYR B 23 -1.967 9.587 -2.358 1.00 0.00 H new ATOM 0 HD2 TYR B 23 -3.238 11.349 -6.023 1.00 0.00 H new ATOM 0 HE1 TYR B 23 -1.423 7.507 -3.543 1.00 0.00 H new ATOM 0 HE2 TYR B 23 -2.698 9.268 -7.211 1.00 0.00 H new ATOM 0 HH TYR B 23 -1.544 6.388 -5.464 1.00 0.00 H new ATOM 2337 N ASP B 24 -4.771 12.912 -0.330 1.00 0.00 N ATOM 2338 CA ASP B 24 -5.180 14.100 0.406 1.00 0.00 C ATOM 2339 C ASP B 24 -4.575 14.119 1.811 1.00 0.00 C ATOM 2340 O ASP B 24 -4.907 14.983 2.622 1.00 0.00 O ATOM 2341 CB ASP B 24 -6.704 14.164 0.499 1.00 0.00 C ATOM 2342 CG ASP B 24 -7.249 15.543 0.182 1.00 0.00 C ATOM 2343 OD1 ASP B 24 -6.788 16.521 0.808 1.00 0.00 O ATOM 2344 OD2 ASP B 24 -8.135 15.645 -0.692 1.00 0.00 O ATOM 0 H ASP B 24 -5.256 12.058 -0.054 1.00 0.00 H new ATOM 0 HA ASP B 24 -4.813 14.971 -0.136 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -7.137 13.439 -0.190 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -7.016 13.876 1.503 1.00 0.00 H new ATOM 2349 N ASP B 25 -3.688 13.165 2.099 1.00 0.00 N ATOM 2350 CA ASP B 25 -3.052 13.090 3.409 1.00 0.00 C ATOM 2351 C ASP B 25 -1.653 12.492 3.302 1.00 0.00 C ATOM 2352 O ASP B 25 -1.189 12.168 2.209 1.00 0.00 O ATOM 2353 CB ASP B 25 -3.905 12.256 4.367 1.00 0.00 C ATOM 2354 CG ASP B 25 -5.368 12.652 4.332 1.00 0.00 C ATOM 2355 OD1 ASP B 25 -5.704 13.733 4.859 1.00 0.00 O ATOM 2356 OD2 ASP B 25 -6.179 11.881 3.775 1.00 0.00 O ATOM 0 H ASP B 25 -3.397 12.439 1.445 1.00 0.00 H new ATOM 0 HA ASP B 25 -2.965 14.103 3.801 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -3.811 11.201 4.109 1.00 0.00 H new ATOM 0 HB3 ASP B 25 -3.524 12.371 5.382 1.00 0.00 H new ATOM 2361 N LYS B 26 -0.989 12.351 4.443 1.00 0.00 N ATOM 2362 CA LYS B 26 0.357 11.791 4.478 1.00 0.00 C ATOM 2363 C LYS B 26 0.319 10.300 4.797 1.00 0.00 C ATOM 2364 O LYS B 26 0.036 9.903 5.927 1.00 0.00 O ATOM 2365 CB LYS B 26 1.209 12.525 5.516 1.00 0.00 C ATOM 2366 CG LYS B 26 1.031 14.034 5.488 1.00 0.00 C ATOM 2367 CD LYS B 26 1.991 14.726 6.442 1.00 0.00 C ATOM 2368 CE LYS B 26 1.346 14.977 7.796 1.00 0.00 C ATOM 2369 NZ LYS B 26 1.492 13.808 8.706 1.00 0.00 N ATOM 0 H LYS B 26 -1.360 12.616 5.355 1.00 0.00 H new ATOM 0 HA LYS B 26 0.804 11.921 3.492 1.00 0.00 H new ATOM 0 HB2 LYS B 26 0.955 12.155 6.510 1.00 0.00 H new ATOM 0 HB3 LYS B 26 2.259 12.288 5.346 1.00 0.00 H new ATOM 0 HG2 LYS B 26 1.195 14.402 4.475 1.00 0.00 H new ATOM 0 HG3 LYS B 26 0.005 14.285 5.757 1.00 0.00 H new ATOM 0 HD2 LYS B 26 2.883 14.113 6.571 1.00 0.00 H new ATOM 0 HD3 LYS B 26 2.315 15.673 6.011 1.00 0.00 H new ATOM 0 HE2 LYS B 26 1.799 15.855 8.257 1.00 0.00 H new ATOM 0 HE3 LYS B 26 0.288 15.200 7.658 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 1.358 14.115 9.690 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 0.778 13.091 8.467 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 2.442 13.400 8.597 1.00 0.00 H new ATOM 2383 N HIS B 27 0.605 9.479 3.791 1.00 0.00 N ATOM 2384 CA HIS B 27 0.604 8.032 3.964 1.00 0.00 C ATOM 2385 C HIS B 27 2.020 7.474 3.861 1.00 0.00 C ATOM 2386 O HIS B 27 2.768 7.816 2.947 1.00 0.00 O ATOM 2387 CB HIS B 27 -0.295 7.373 2.916 1.00 0.00 C ATOM 2388 CG HIS B 27 -1.749 7.683 3.097 1.00 0.00 C ATOM 2389 ND1 HIS B 27 -2.378 7.725 4.322 1.00 0.00 N ATOM 2390 CD2 HIS B 27 -2.704 7.972 2.176 1.00 0.00 C ATOM 2391 CE1 HIS B 27 -3.666 8.029 4.112 1.00 0.00 C ATOM 2392 NE2 HIS B 27 -3.915 8.190 2.827 1.00 0.00 N ATOM 0 H HIS B 27 0.840 9.792 2.849 1.00 0.00 H new ATOM 0 HA HIS B 27 0.215 7.808 4.957 1.00 0.00 H new ATOM 0 HB2 HIS B 27 0.017 7.699 1.924 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -0.154 6.293 2.955 1.00 0.00 H new ATOM 0 HD1 HIS B 27 -1.941 7.555 5.228 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -2.549 8.024 1.108 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -4.404 8.129 4.894 1.00 0.00 H new ATOM 2400 N THR B 28 2.382 6.614 4.809 1.00 0.00 N ATOM 2401 CA THR B 28 3.709 6.012 4.827 1.00 0.00 C ATOM 2402 C THR B 28 3.652 4.544 4.415 1.00 0.00 C ATOM 2403 O THR B 28 2.781 3.797 4.860 1.00 0.00 O ATOM 2404 CB THR B 28 4.328 6.136 6.220 1.00 0.00 C ATOM 2405 OG1 THR B 28 4.451 7.497 6.595 1.00 0.00 O ATOM 2406 CG2 THR B 28 5.698 5.503 6.326 1.00 0.00 C ATOM 0 H THR B 28 1.775 6.319 5.574 1.00 0.00 H new ATOM 0 HA THR B 28 4.330 6.547 4.109 1.00 0.00 H new ATOM 0 HB THR B 28 3.649 5.603 6.886 1.00 0.00 H new ATOM 0 HG1 THR B 28 4.847 7.555 7.489 1.00 0.00 H new ATOM 0 HG21 THR B 28 6.079 5.627 7.340 1.00 0.00 H new ATOM 0 HG22 THR B 28 5.627 4.441 6.093 1.00 0.00 H new ATOM 0 HG23 THR B 28 6.377 5.985 5.622 1.00 0.00 H new ATOM 2414 N TYR B 29 4.590 4.139 3.565 1.00 0.00 N ATOM 2415 CA TYR B 29 4.654 2.760 3.094 1.00 0.00 C ATOM 2416 C TYR B 29 5.954 2.101 3.543 1.00 0.00 C ATOM 2417 O TYR B 29 7.045 2.585 3.240 1.00 0.00 O ATOM 2418 CB TYR B 29 4.536 2.714 1.570 1.00 0.00 C ATOM 2419 CG TYR B 29 3.154 3.057 1.064 1.00 0.00 C ATOM 2420 CD1 TYR B 29 2.580 4.292 1.339 1.00 0.00 C ATOM 2421 CD2 TYR B 29 2.422 2.146 0.312 1.00 0.00 C ATOM 2422 CE1 TYR B 29 1.315 4.608 0.881 1.00 0.00 C ATOM 2423 CE2 TYR B 29 1.157 2.456 -0.150 1.00 0.00 C ATOM 2424 CZ TYR B 29 0.609 3.687 0.137 1.00 0.00 C ATOM 2425 OH TYR B 29 -0.650 3.999 -0.321 1.00 0.00 O ATOM 0 H TYR B 29 5.317 4.747 3.188 1.00 0.00 H new ATOM 0 HA TYR B 29 3.819 2.209 3.527 1.00 0.00 H new ATOM 0 HB2 TYR B 29 5.256 3.408 1.136 1.00 0.00 H new ATOM 0 HB3 TYR B 29 4.805 1.717 1.222 1.00 0.00 H new ATOM 0 HD1 TYR B 29 3.131 5.017 1.920 1.00 0.00 H new ATOM 0 HD2 TYR B 29 2.849 1.180 0.085 1.00 0.00 H new ATOM 0 HE1 TYR B 29 0.882 5.572 1.105 1.00 0.00 H new ATOM 0 HE2 TYR B 29 0.601 1.737 -0.733 1.00 0.00 H new ATOM 0 HH TYR B 29 -0.667 4.932 -0.622 1.00 0.00 H new ATOM 2435 N HIS B 30 5.829 1.000 4.276 1.00 0.00 N ATOM 2436 CA HIS B 30 6.992 0.278 4.779 1.00 0.00 C ATOM 2437 C HIS B 30 7.732 -0.441 3.654 1.00 0.00 C ATOM 2438 O HIS B 30 7.131 -0.843 2.658 1.00 0.00 O ATOM 2439 CB HIS B 30 6.567 -0.728 5.850 1.00 0.00 C ATOM 2440 CG HIS B 30 6.688 -0.202 7.246 1.00 0.00 C ATOM 2441 ND1 HIS B 30 5.680 0.469 7.903 1.00 0.00 N ATOM 2442 CD2 HIS B 30 7.729 -0.258 8.116 1.00 0.00 C ATOM 2443 CE1 HIS B 30 6.130 0.793 9.124 1.00 0.00 C ATOM 2444 NE2 HIS B 30 7.368 0.373 9.303 1.00 0.00 N ATOM 0 H HIS B 30 4.933 0.588 4.535 1.00 0.00 H new ATOM 0 HA HIS B 30 7.672 1.008 5.219 1.00 0.00 H new ATOM 0 HB2 HIS B 30 5.533 -1.023 5.670 1.00 0.00 H new ATOM 0 HB3 HIS B 30 7.176 -1.627 5.755 1.00 0.00 H new ATOM 0 HD2 HIS B 30 8.685 -0.719 7.918 1.00 0.00 H new ATOM 0 HE1 HIS B 30 5.554 1.328 9.865 1.00 0.00 H new ATOM 0 HE2 HIS B 30 7.942 0.487 10.139 1.00 0.00 H new ATOM 2452 N ILE B 31 9.039 -0.604 3.831 1.00 0.00 N ATOM 2453 CA ILE B 31 9.872 -1.279 2.844 1.00 0.00 C ATOM 2454 C ILE B 31 10.791 -2.292 3.518 1.00 0.00 C ATOM 2455 O ILE B 31 11.127 -2.152 4.693 1.00 0.00 O ATOM 2456 CB ILE B 31 10.728 -0.279 2.044 1.00 0.00 C ATOM 2457 CG1 ILE B 31 9.882 0.919 1.611 1.00 0.00 C ATOM 2458 CG2 ILE B 31 11.349 -0.961 0.835 1.00 0.00 C ATOM 2459 CD1 ILE B 31 10.659 1.956 0.830 1.00 0.00 C ATOM 0 H ILE B 31 9.546 -0.276 4.653 1.00 0.00 H new ATOM 0 HA ILE B 31 9.200 -1.792 2.157 1.00 0.00 H new ATOM 0 HB ILE B 31 11.532 0.082 2.685 1.00 0.00 H new ATOM 0 HG12 ILE B 31 9.050 0.565 1.002 1.00 0.00 H new ATOM 0 HG13 ILE B 31 9.452 1.389 2.496 1.00 0.00 H new ATOM 0 HG21 ILE B 31 11.951 -0.241 0.280 1.00 0.00 H new ATOM 0 HG22 ILE B 31 11.982 -1.784 1.167 1.00 0.00 H new ATOM 0 HG23 ILE B 31 10.560 -1.348 0.190 1.00 0.00 H new ATOM 0 HD11 ILE B 31 9.996 2.777 0.556 1.00 0.00 H new ATOM 0 HD12 ILE B 31 11.475 2.338 1.444 1.00 0.00 H new ATOM 0 HD13 ILE B 31 11.067 1.501 -0.073 1.00 0.00 H new ATOM 2471 N LYS B 32 11.189 -3.317 2.771 1.00 0.00 N ATOM 2472 CA LYS B 32 12.064 -4.353 3.309 1.00 0.00 C ATOM 2473 C LYS B 32 13.401 -4.391 2.574 1.00 0.00 C ATOM 2474 O LYS B 32 13.450 -4.338 1.345 1.00 0.00 O ATOM 2475 CB LYS B 32 11.382 -5.719 3.221 1.00 0.00 C ATOM 2476 CG LYS B 32 11.600 -6.588 4.450 1.00 0.00 C ATOM 2477 CD LYS B 32 10.284 -7.101 5.009 1.00 0.00 C ATOM 2478 CE LYS B 32 10.436 -8.493 5.602 1.00 0.00 C ATOM 2479 NZ LYS B 32 9.232 -8.901 6.376 1.00 0.00 N ATOM 0 H LYS B 32 10.921 -3.452 1.796 1.00 0.00 H new ATOM 0 HA LYS B 32 12.259 -4.114 4.354 1.00 0.00 H new ATOM 0 HB2 LYS B 32 10.312 -5.573 3.075 1.00 0.00 H new ATOM 0 HB3 LYS B 32 11.755 -6.246 2.343 1.00 0.00 H new ATOM 0 HG2 LYS B 32 12.240 -7.431 4.192 1.00 0.00 H new ATOM 0 HG3 LYS B 32 12.122 -6.014 5.215 1.00 0.00 H new ATOM 0 HD2 LYS B 32 9.921 -6.416 5.775 1.00 0.00 H new ATOM 0 HD3 LYS B 32 9.534 -7.121 4.218 1.00 0.00 H new ATOM 0 HE2 LYS B 32 10.614 -9.211 4.802 1.00 0.00 H new ATOM 0 HE3 LYS B 32 11.311 -8.517 6.252 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 9.375 -9.855 6.764 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 9.077 -8.230 7.156 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 8.401 -8.903 5.750 1.00 0.00 H new ATOM 2493 N ILE B 33 14.482 -4.493 3.341 1.00 0.00 N ATOM 2494 CA ILE B 33 15.826 -4.548 2.776 1.00 0.00 C ATOM 2495 C ILE B 33 16.725 -5.452 3.610 1.00 0.00 C ATOM 2496 O ILE B 33 16.918 -5.219 4.803 1.00 0.00 O ATOM 2497 CB ILE B 33 16.465 -3.150 2.692 1.00 0.00 C ATOM 2498 CG1 ILE B 33 15.570 -2.198 1.897 1.00 0.00 C ATOM 2499 CG2 ILE B 33 17.846 -3.238 2.060 1.00 0.00 C ATOM 2500 CD1 ILE B 33 16.038 -0.760 1.931 1.00 0.00 C ATOM 0 H ILE B 33 14.453 -4.539 4.360 1.00 0.00 H new ATOM 0 HA ILE B 33 15.730 -4.952 1.768 1.00 0.00 H new ATOM 0 HB ILE B 33 16.571 -2.756 3.703 1.00 0.00 H new ATOM 0 HG12 ILE B 33 15.527 -2.533 0.861 1.00 0.00 H new ATOM 0 HG13 ILE B 33 14.555 -2.251 2.292 1.00 0.00 H new ATOM 0 HG21 ILE B 33 18.286 -2.242 2.007 1.00 0.00 H new ATOM 0 HG22 ILE B 33 18.482 -3.884 2.665 1.00 0.00 H new ATOM 0 HG23 ILE B 33 17.760 -3.651 1.055 1.00 0.00 H new ATOM 0 HD11 ILE B 33 15.357 -0.142 1.347 1.00 0.00 H new ATOM 0 HD12 ILE B 33 16.055 -0.407 2.962 1.00 0.00 H new ATOM 0 HD13 ILE B 33 17.041 -0.694 1.509 1.00 0.00 H new ATOM 2512 N THR B 34 17.272 -6.486 2.979 1.00 0.00 N ATOM 2513 CA THR B 34 18.146 -7.425 3.674 1.00 0.00 C ATOM 2514 C THR B 34 19.544 -7.423 3.069 1.00 0.00 C ATOM 2515 O THR B 34 19.723 -7.114 1.891 1.00 0.00 O ATOM 2516 CB THR B 34 17.555 -8.835 3.623 1.00 0.00 C ATOM 2517 OG1 THR B 34 16.328 -8.890 4.329 1.00 0.00 O ATOM 2518 CG2 THR B 34 18.469 -9.890 4.208 1.00 0.00 C ATOM 0 H THR B 34 17.126 -6.695 1.991 1.00 0.00 H new ATOM 0 HA THR B 34 18.224 -7.108 4.714 1.00 0.00 H new ATOM 0 HB THR B 34 17.412 -9.049 2.564 1.00 0.00 H new ATOM 0 HG1 THR B 34 15.814 -9.670 4.032 1.00 0.00 H new ATOM 0 HG21 THR B 34 17.988 -10.866 4.140 1.00 0.00 H new ATOM 0 HG22 THR B 34 19.407 -9.908 3.653 1.00 0.00 H new ATOM 0 HG23 THR B 34 18.671 -9.657 5.254 1.00 0.00 H new ATOM 2526 N ASN B 35 20.534 -7.774 3.885 1.00 0.00 N ATOM 2527 CA ASN B 35 21.919 -7.816 3.432 1.00 0.00 C ATOM 2528 C ASN B 35 22.303 -9.221 2.983 1.00 0.00 C ATOM 2529 O ASN B 35 22.918 -9.978 3.734 1.00 0.00 O ATOM 2530 CB ASN B 35 22.857 -7.346 4.547 1.00 0.00 C ATOM 2531 CG ASN B 35 24.321 -7.483 4.174 1.00 0.00 C ATOM 2532 OD1 ASN B 35 25.156 -7.827 5.011 1.00 0.00 O ATOM 2533 ND2 ASN B 35 24.639 -7.216 2.913 1.00 0.00 N ATOM 0 H ASN B 35 20.402 -8.033 4.863 1.00 0.00 H new ATOM 0 HA ASN B 35 22.017 -7.145 2.579 1.00 0.00 H new ATOM 0 HB2 ASN B 35 22.642 -6.304 4.782 1.00 0.00 H new ATOM 0 HB3 ASN B 35 22.660 -7.924 5.450 1.00 0.00 H new ATOM 0 HD21 ASN B 35 25.608 -7.293 2.604 1.00 0.00 H new ATOM 0 HD22 ASN B 35 23.914 -6.934 2.253 1.00 0.00 H new ATOM 2540 N ALA B 36 21.939 -9.560 1.752 1.00 0.00 N ATOM 2541 CA ALA B 36 22.247 -10.872 1.197 1.00 0.00 C ATOM 2542 C ALA B 36 23.754 -11.086 1.071 1.00 0.00 C ATOM 2543 O ALA B 36 24.216 -12.215 0.902 1.00 0.00 O ATOM 2544 CB ALA B 36 21.575 -11.041 -0.157 1.00 0.00 C ATOM 0 H ALA B 36 21.430 -8.944 1.119 1.00 0.00 H new ATOM 0 HA ALA B 36 21.860 -11.625 1.884 1.00 0.00 H new ATOM 0 HB1 ALA B 36 21.813 -12.025 -0.561 1.00 0.00 H new ATOM 0 HB2 ALA B 36 20.495 -10.947 -0.041 1.00 0.00 H new ATOM 0 HB3 ALA B 36 21.935 -10.272 -0.840 1.00 0.00 H new ATOM 2550 N GLY B 37 24.520 -9.999 1.152 1.00 0.00 N ATOM 2551 CA GLY B 37 25.964 -10.099 1.042 1.00 0.00 C ATOM 2552 C GLY B 37 26.568 -10.998 2.104 1.00 0.00 C ATOM 2553 O GLY B 37 25.902 -11.898 2.616 1.00 0.00 O ATOM 0 H GLY B 37 24.165 -9.053 1.292 1.00 0.00 H new ATOM 0 HA2 GLY B 37 26.224 -10.483 0.055 1.00 0.00 H new ATOM 0 HA3 GLY B 37 26.401 -9.104 1.122 1.00 0.00 H new ATOM 2557 N GLY B 38 27.832 -10.755 2.432 1.00 0.00 N ATOM 2558 CA GLY B 38 28.507 -11.559 3.434 1.00 0.00 C ATOM 2559 C GLY B 38 28.921 -10.751 4.649 1.00 0.00 C ATOM 2560 O GLY B 38 29.174 -11.310 5.716 1.00 0.00 O ATOM 0 H GLY B 38 28.402 -10.015 2.022 1.00 0.00 H new ATOM 0 HA2 GLY B 38 27.849 -12.369 3.748 1.00 0.00 H new ATOM 0 HA3 GLY B 38 29.390 -12.019 2.991 1.00 0.00 H new ATOM 2564 N ARG B 39 28.993 -9.433 4.488 1.00 0.00 N ATOM 2565 CA ARG B 39 29.381 -8.551 5.584 1.00 0.00 C ATOM 2566 C ARG B 39 28.426 -7.367 5.694 1.00 0.00 C ATOM 2567 O ARG B 39 27.626 -7.115 4.792 1.00 0.00 O ATOM 2568 CB ARG B 39 30.812 -8.051 5.378 1.00 0.00 C ATOM 2569 CG ARG B 39 31.867 -8.941 6.014 1.00 0.00 C ATOM 2570 CD ARG B 39 33.247 -8.308 5.943 1.00 0.00 C ATOM 2571 NE ARG B 39 33.361 -7.147 6.820 1.00 0.00 N ATOM 2572 CZ ARG B 39 33.366 -7.224 8.147 1.00 0.00 C ATOM 2573 NH1 ARG B 39 33.266 -8.402 8.745 1.00 0.00 N ATOM 2574 NH2 ARG B 39 33.473 -6.121 8.875 1.00 0.00 N ATOM 0 H ARG B 39 28.788 -8.953 3.612 1.00 0.00 H new ATOM 0 HA ARG B 39 29.332 -9.120 6.512 1.00 0.00 H new ATOM 0 HB2 ARG B 39 31.010 -7.974 4.309 1.00 0.00 H new ATOM 0 HB3 ARG B 39 30.900 -7.046 5.791 1.00 0.00 H new ATOM 0 HG2 ARG B 39 31.605 -9.130 7.055 1.00 0.00 H new ATOM 0 HG3 ARG B 39 31.882 -9.907 5.509 1.00 0.00 H new ATOM 0 HD2 ARG B 39 33.999 -9.047 6.219 1.00 0.00 H new ATOM 0 HD3 ARG B 39 33.456 -8.009 4.916 1.00 0.00 H new ATOM 0 HE ARG B 39 33.441 -6.225 6.391 1.00 0.00 H new ATOM 0 HH11 ARG B 39 33.185 -9.252 8.187 1.00 0.00 H new ATOM 0 HH12 ARG B 39 33.270 -8.459 9.763 1.00 0.00 H new ATOM 0 HH21 ARG B 39 33.551 -5.213 8.417 1.00 0.00 H new ATOM 0 HH22 ARG B 39 33.477 -6.180 9.893 1.00 0.00 H new ATOM 2588 N ARG B 40 28.517 -6.641 6.805 1.00 0.00 N ATOM 2589 CA ARG B 40 27.663 -5.481 7.034 1.00 0.00 C ATOM 2590 C ARG B 40 27.679 -4.547 5.829 1.00 0.00 C ATOM 2591 O ARG B 40 28.550 -4.652 4.964 1.00 0.00 O ATOM 2592 CB ARG B 40 28.118 -4.727 8.286 1.00 0.00 C ATOM 2593 CG ARG B 40 28.284 -5.620 9.505 1.00 0.00 C ATOM 2594 CD ARG B 40 28.084 -4.843 10.796 1.00 0.00 C ATOM 2595 NE ARG B 40 26.673 -4.575 11.060 1.00 0.00 N ATOM 2596 CZ ARG B 40 26.244 -3.786 12.039 1.00 0.00 C ATOM 2597 NH1 ARG B 40 27.113 -3.191 12.844 1.00 0.00 N ATOM 2598 NH2 ARG B 40 24.944 -3.591 12.214 1.00 0.00 N ATOM 0 H ARG B 40 29.174 -6.836 7.560 1.00 0.00 H new ATOM 0 HA ARG B 40 26.643 -5.835 7.182 1.00 0.00 H new ATOM 0 HB2 ARG B 40 29.066 -4.231 8.077 1.00 0.00 H new ATOM 0 HB3 ARG B 40 27.393 -3.946 8.514 1.00 0.00 H new ATOM 0 HG2 ARG B 40 27.567 -6.439 9.457 1.00 0.00 H new ATOM 0 HG3 ARG B 40 29.279 -6.066 9.498 1.00 0.00 H new ATOM 0 HD2 ARG B 40 28.508 -5.406 11.627 1.00 0.00 H new ATOM 0 HD3 ARG B 40 28.628 -3.900 10.740 1.00 0.00 H new ATOM 0 HE ARG B 40 25.978 -5.018 10.459 1.00 0.00 H new ATOM 0 HH11 ARG B 40 28.114 -3.338 12.713 1.00 0.00 H new ATOM 0 HH12 ARG B 40 26.781 -2.586 13.595 1.00 0.00 H new ATOM 0 HH21 ARG B 40 24.272 -4.047 11.597 1.00 0.00 H new ATOM 0 HH22 ARG B 40 24.616 -2.985 12.966 1.00 0.00 H new ATOM 2612 N ILE B 41 26.711 -3.637 5.771 1.00 0.00 N ATOM 2613 CA ILE B 41 26.623 -2.693 4.664 1.00 0.00 C ATOM 2614 C ILE B 41 25.853 -1.437 5.053 1.00 0.00 C ATOM 2615 O ILE B 41 24.761 -1.514 5.619 1.00 0.00 O ATOM 2616 CB ILE B 41 25.937 -3.326 3.439 1.00 0.00 C ATOM 2617 CG1 ILE B 41 24.550 -3.848 3.817 1.00 0.00 C ATOM 2618 CG2 ILE B 41 26.792 -4.444 2.866 1.00 0.00 C ATOM 2619 CD1 ILE B 41 23.787 -4.434 2.650 1.00 0.00 C ATOM 0 H ILE B 41 25.980 -3.534 6.475 1.00 0.00 H new ATOM 0 HA ILE B 41 27.648 -2.423 4.411 1.00 0.00 H new ATOM 0 HB ILE B 41 25.821 -2.559 2.673 1.00 0.00 H new ATOM 0 HG12 ILE B 41 24.655 -4.609 4.591 1.00 0.00 H new ATOM 0 HG13 ILE B 41 23.969 -3.033 4.248 1.00 0.00 H new ATOM 0 HG21 ILE B 41 26.291 -4.879 2.001 1.00 0.00 H new ATOM 0 HG22 ILE B 41 27.759 -4.043 2.561 1.00 0.00 H new ATOM 0 HG23 ILE B 41 26.941 -5.213 3.624 1.00 0.00 H new ATOM 0 HD11 ILE B 41 22.813 -4.784 2.991 1.00 0.00 H new ATOM 0 HD12 ILE B 41 23.650 -3.670 1.884 1.00 0.00 H new ATOM 0 HD13 ILE B 41 24.347 -5.270 2.232 1.00 0.00 H new ATOM 2631 N GLY B 42 26.422 -0.281 4.727 1.00 0.00 N ATOM 2632 CA GLY B 42 25.771 0.979 5.026 1.00 0.00 C ATOM 2633 C GLY B 42 24.954 1.474 3.850 1.00 0.00 C ATOM 2634 O GLY B 42 25.512 1.871 2.826 1.00 0.00 O ATOM 0 H GLY B 42 27.325 -0.195 4.260 1.00 0.00 H new ATOM 0 HA2 GLY B 42 25.124 0.858 5.895 1.00 0.00 H new ATOM 0 HA3 GLY B 42 26.522 1.724 5.289 1.00 0.00 H new ATOM 2638 N TRP B 43 23.631 1.429 3.983 1.00 0.00 N ATOM 2639 CA TRP B 43 22.743 1.854 2.908 1.00 0.00 C ATOM 2640 C TRP B 43 22.219 3.269 3.129 1.00 0.00 C ATOM 2641 O TRP B 43 22.211 3.779 4.249 1.00 0.00 O ATOM 2642 CB TRP B 43 21.568 0.882 2.782 1.00 0.00 C ATOM 2643 CG TRP B 43 20.806 0.705 4.060 1.00 0.00 C ATOM 2644 CD1 TRP B 43 21.030 -0.235 5.024 1.00 0.00 C ATOM 2645 CD2 TRP B 43 19.695 1.487 4.511 1.00 0.00 C ATOM 2646 NE1 TRP B 43 20.127 -0.086 6.047 1.00 0.00 N ATOM 2647 CE2 TRP B 43 19.297 0.965 5.757 1.00 0.00 C ATOM 2648 CE3 TRP B 43 18.999 2.579 3.986 1.00 0.00 C ATOM 2649 CZ2 TRP B 43 18.235 1.498 6.484 1.00 0.00 C ATOM 2650 CZ3 TRP B 43 17.945 3.107 4.708 1.00 0.00 C ATOM 2651 CH2 TRP B 43 17.572 2.566 5.945 1.00 0.00 C ATOM 0 H TRP B 43 23.152 1.103 4.823 1.00 0.00 H new ATOM 0 HA TRP B 43 23.323 1.853 1.985 1.00 0.00 H new ATOM 0 HB2 TRP B 43 20.889 1.242 2.009 1.00 0.00 H new ATOM 0 HB3 TRP B 43 21.941 -0.088 2.452 1.00 0.00 H new ATOM 0 HD1 TRP B 43 21.805 -0.986 4.987 1.00 0.00 H new ATOM 0 HE1 TRP B 43 20.081 -0.664 6.886 1.00 0.00 H new ATOM 0 HE3 TRP B 43 19.280 3.003 3.033 1.00 0.00 H new ATOM 0 HZ2 TRP B 43 17.946 1.083 7.438 1.00 0.00 H new ATOM 0 HZ3 TRP B 43 17.400 3.951 4.312 1.00 0.00 H new ATOM 0 HH2 TRP B 43 16.744 3.001 6.484 1.00 0.00 H new ATOM 2662 N ALA B 44 21.775 3.888 2.040 1.00 0.00 N ATOM 2663 CA ALA B 44 21.233 5.240 2.081 1.00 0.00 C ATOM 2664 C ALA B 44 20.077 5.380 1.097 1.00 0.00 C ATOM 2665 O ALA B 44 19.991 4.639 0.119 1.00 0.00 O ATOM 2666 CB ALA B 44 22.322 6.257 1.769 1.00 0.00 C ATOM 0 H ALA B 44 21.781 3.469 1.110 1.00 0.00 H new ATOM 0 HA ALA B 44 20.857 5.432 3.086 1.00 0.00 H new ATOM 0 HB1 ALA B 44 21.902 7.262 1.803 1.00 0.00 H new ATOM 0 HB2 ALA B 44 23.121 6.172 2.506 1.00 0.00 H new ATOM 0 HB3 ALA B 44 22.724 6.066 0.774 1.00 0.00 H new ATOM 2672 N ILE B 45 19.184 6.325 1.365 1.00 0.00 N ATOM 2673 CA ILE B 45 18.031 6.544 0.501 1.00 0.00 C ATOM 2674 C ILE B 45 18.056 7.934 -0.126 1.00 0.00 C ATOM 2675 O ILE B 45 18.270 8.934 0.560 1.00 0.00 O ATOM 2676 CB ILE B 45 16.710 6.367 1.274 1.00 0.00 C ATOM 2677 CG1 ILE B 45 16.741 5.071 2.085 1.00 0.00 C ATOM 2678 CG2 ILE B 45 15.531 6.372 0.315 1.00 0.00 C ATOM 2679 CD1 ILE B 45 16.860 3.827 1.232 1.00 0.00 C ATOM 0 H ILE B 45 19.236 6.949 2.170 1.00 0.00 H new ATOM 0 HA ILE B 45 18.089 5.796 -0.290 1.00 0.00 H new ATOM 0 HB ILE B 45 16.593 7.203 1.964 1.00 0.00 H new ATOM 0 HG12 ILE B 45 17.580 5.107 2.780 1.00 0.00 H new ATOM 0 HG13 ILE B 45 15.833 5.005 2.684 1.00 0.00 H new ATOM 0 HG21 ILE B 45 14.605 6.246 0.876 1.00 0.00 H new ATOM 0 HG22 ILE B 45 15.503 7.320 -0.223 1.00 0.00 H new ATOM 0 HG23 ILE B 45 15.638 5.554 -0.397 1.00 0.00 H new ATOM 0 HD11 ILE B 45 16.876 2.946 1.874 1.00 0.00 H new ATOM 0 HD12 ILE B 45 16.008 3.767 0.555 1.00 0.00 H new ATOM 0 HD13 ILE B 45 17.782 3.870 0.652 1.00 0.00 H new ATOM 2691 N LYS B 46 17.829 7.988 -1.435 1.00 0.00 N ATOM 2692 CA LYS B 46 17.818 9.252 -2.162 1.00 0.00 C ATOM 2693 C LYS B 46 16.481 9.461 -2.865 1.00 0.00 C ATOM 2694 O LYS B 46 15.811 8.500 -3.245 1.00 0.00 O ATOM 2695 CB LYS B 46 18.957 9.288 -3.183 1.00 0.00 C ATOM 2696 CG LYS B 46 20.227 9.935 -2.655 1.00 0.00 C ATOM 2697 CD LYS B 46 20.073 11.442 -2.524 1.00 0.00 C ATOM 2698 CE LYS B 46 21.050 12.182 -3.422 1.00 0.00 C ATOM 2699 NZ LYS B 46 21.800 13.232 -2.679 1.00 0.00 N ATOM 0 H LYS B 46 17.650 7.168 -2.015 1.00 0.00 H new ATOM 0 HA LYS B 46 17.961 10.059 -1.443 1.00 0.00 H new ATOM 0 HB2 LYS B 46 19.182 8.270 -3.499 1.00 0.00 H new ATOM 0 HB3 LYS B 46 18.624 9.830 -4.068 1.00 0.00 H new ATOM 0 HG2 LYS B 46 20.477 9.508 -1.684 1.00 0.00 H new ATOM 0 HG3 LYS B 46 21.057 9.710 -3.325 1.00 0.00 H new ATOM 0 HD2 LYS B 46 19.053 11.728 -2.781 1.00 0.00 H new ATOM 0 HD3 LYS B 46 20.235 11.737 -1.487 1.00 0.00 H new ATOM 0 HE2 LYS B 46 21.754 11.472 -3.856 1.00 0.00 H new ATOM 0 HE3 LYS B 46 20.508 12.640 -4.249 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 22.456 13.714 -3.326 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 21.131 13.924 -2.286 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 22.338 12.792 -1.905 1.00 0.00 H new ATOM 2713 N THR B 47 16.096 10.722 -3.034 1.00 0.00 N ATOM 2714 CA THR B 47 14.838 11.055 -3.691 1.00 0.00 C ATOM 2715 C THR B 47 14.983 12.310 -4.546 1.00 0.00 C ATOM 2716 O THR B 47 15.834 13.159 -4.280 1.00 0.00 O ATOM 2717 CB THR B 47 13.734 11.257 -2.652 1.00 0.00 C ATOM 2718 OG1 THR B 47 13.959 12.436 -1.903 1.00 0.00 O ATOM 2719 CG2 THR B 47 13.613 10.107 -1.676 1.00 0.00 C ATOM 0 H THR B 47 16.637 11.529 -2.725 1.00 0.00 H new ATOM 0 HA THR B 47 14.568 10.224 -4.343 1.00 0.00 H new ATOM 0 HB THR B 47 12.809 11.325 -3.224 1.00 0.00 H new ATOM 0 HG1 THR B 47 13.241 12.548 -1.245 1.00 0.00 H new ATOM 0 HG21 THR B 47 12.812 10.315 -0.967 1.00 0.00 H new ATOM 0 HG22 THR B 47 13.387 9.190 -2.220 1.00 0.00 H new ATOM 0 HG23 THR B 47 14.553 9.987 -1.137 1.00 0.00 H new ATOM 2727 N THR B 48 14.148 12.417 -5.573 1.00 0.00 N ATOM 2728 CA THR B 48 14.183 13.566 -6.470 1.00 0.00 C ATOM 2729 C THR B 48 13.907 14.859 -5.711 1.00 0.00 C ATOM 2730 O THR B 48 14.558 15.878 -5.941 1.00 0.00 O ATOM 2731 CB THR B 48 13.159 13.392 -7.592 1.00 0.00 C ATOM 2732 OG1 THR B 48 12.029 12.670 -7.134 1.00 0.00 O ATOM 2733 CG2 THR B 48 13.711 12.664 -8.799 1.00 0.00 C ATOM 0 H THR B 48 13.438 11.722 -5.805 1.00 0.00 H new ATOM 0 HA THR B 48 15.181 13.627 -6.903 1.00 0.00 H new ATOM 0 HB THR B 48 12.886 14.404 -7.892 1.00 0.00 H new ATOM 0 HG1 THR B 48 11.226 13.223 -7.232 1.00 0.00 H new ATOM 0 HG21 THR B 48 12.933 12.575 -9.557 1.00 0.00 H new ATOM 0 HG22 THR B 48 14.553 13.223 -9.207 1.00 0.00 H new ATOM 0 HG23 THR B 48 14.045 11.670 -8.503 1.00 0.00 H new ATOM 2741 N ASN B 49 12.935 14.810 -4.806 1.00 0.00 N ATOM 2742 CA ASN B 49 12.570 15.977 -4.012 1.00 0.00 C ATOM 2743 C ASN B 49 12.474 15.621 -2.533 1.00 0.00 C ATOM 2744 O ASN B 49 11.612 14.842 -2.126 1.00 0.00 O ATOM 2745 CB ASN B 49 11.238 16.553 -4.496 1.00 0.00 C ATOM 2746 CG ASN B 49 11.373 17.303 -5.808 1.00 0.00 C ATOM 2747 OD1 ASN B 49 12.331 18.049 -6.013 1.00 0.00 O ATOM 2748 ND2 ASN B 49 10.412 17.109 -6.703 1.00 0.00 N ATOM 0 H ASN B 49 12.386 13.974 -4.604 1.00 0.00 H new ATOM 0 HA ASN B 49 13.350 16.728 -4.137 1.00 0.00 H new ATOM 0 HB2 ASN B 49 10.518 15.744 -4.616 1.00 0.00 H new ATOM 0 HB3 ASN B 49 10.839 17.225 -3.736 1.00 0.00 H new ATOM 0 HD21 ASN B 49 10.449 17.587 -7.603 1.00 0.00 H new ATOM 0 HD22 ASN B 49 9.636 16.482 -6.491 1.00 0.00 H new ATOM 2755 N MET B 50 13.362 16.200 -1.731 1.00 0.00 N ATOM 2756 CA MET B 50 13.374 15.945 -0.295 1.00 0.00 C ATOM 2757 C MET B 50 12.558 16.993 0.457 1.00 0.00 C ATOM 2758 O MET B 50 12.739 17.187 1.660 1.00 0.00 O ATOM 2759 CB MET B 50 14.812 15.933 0.229 1.00 0.00 C ATOM 2760 CG MET B 50 15.432 14.547 0.275 1.00 0.00 C ATOM 2761 SD MET B 50 16.122 14.148 1.892 1.00 0.00 S ATOM 2762 CE MET B 50 14.835 13.098 2.562 1.00 0.00 C ATOM 0 H MET B 50 14.082 16.848 -2.051 1.00 0.00 H new ATOM 0 HA MET B 50 12.920 14.969 -0.124 1.00 0.00 H new ATOM 0 HB2 MET B 50 15.425 16.575 -0.403 1.00 0.00 H new ATOM 0 HB3 MET B 50 14.828 16.362 1.231 1.00 0.00 H new ATOM 0 HG2 MET B 50 14.676 13.806 0.014 1.00 0.00 H new ATOM 0 HG3 MET B 50 16.218 14.479 -0.478 1.00 0.00 H new ATOM 0 HE1 MET B 50 15.117 12.770 3.562 1.00 0.00 H new ATOM 0 HE2 MET B 50 13.900 13.656 2.613 1.00 0.00 H new ATOM 0 HE3 MET B 50 14.703 12.228 1.918 1.00 0.00 H new ATOM 2772 N ARG B 51 11.657 17.666 -0.254 1.00 0.00 N ATOM 2773 CA ARG B 51 10.817 18.690 0.355 1.00 0.00 C ATOM 2774 C ARG B 51 9.453 18.120 0.729 1.00 0.00 C ATOM 2775 O ARG B 51 8.836 18.549 1.704 1.00 0.00 O ATOM 2776 CB ARG B 51 10.645 19.874 -0.596 1.00 0.00 C ATOM 2777 CG ARG B 51 10.110 19.485 -1.964 1.00 0.00 C ATOM 2778 CD ARG B 51 9.547 20.688 -2.705 1.00 0.00 C ATOM 2779 NE ARG B 51 10.514 21.260 -3.636 1.00 0.00 N ATOM 2780 CZ ARG B 51 10.203 22.165 -4.557 1.00 0.00 C ATOM 2781 NH1 ARG B 51 8.956 22.602 -4.666 1.00 0.00 N ATOM 2782 NH2 ARG B 51 11.139 22.635 -5.372 1.00 0.00 N ATOM 0 H ARG B 51 11.491 17.520 -1.250 1.00 0.00 H new ATOM 0 HA ARG B 51 11.310 19.035 1.264 1.00 0.00 H new ATOM 0 HB2 ARG B 51 9.967 20.597 -0.143 1.00 0.00 H new ATOM 0 HB3 ARG B 51 11.607 20.372 -0.720 1.00 0.00 H new ATOM 0 HG2 ARG B 51 10.908 19.034 -2.553 1.00 0.00 H new ATOM 0 HG3 ARG B 51 9.332 18.730 -1.850 1.00 0.00 H new ATOM 0 HD2 ARG B 51 8.651 20.391 -3.250 1.00 0.00 H new ATOM 0 HD3 ARG B 51 9.244 21.448 -1.985 1.00 0.00 H new ATOM 0 HE ARG B 51 11.483 20.947 -3.576 1.00 0.00 H new ATOM 0 HH11 ARG B 51 8.233 22.243 -4.042 1.00 0.00 H new ATOM 0 HH12 ARG B 51 8.719 23.297 -5.374 1.00 0.00 H new ATOM 0 HH21 ARG B 51 12.100 22.301 -5.292 1.00 0.00 H new ATOM 0 HH22 ARG B 51 10.898 23.330 -6.079 1.00 0.00 H new ATOM 2796 N ARG B 52 8.992 17.149 -0.051 1.00 0.00 N ATOM 2797 CA ARG B 52 7.702 16.515 0.198 1.00 0.00 C ATOM 2798 C ARG B 52 7.877 15.052 0.604 1.00 0.00 C ATOM 2799 O ARG B 52 6.977 14.450 1.187 1.00 0.00 O ATOM 2800 CB ARG B 52 6.814 16.610 -1.044 1.00 0.00 C ATOM 2801 CG ARG B 52 7.570 16.426 -2.350 1.00 0.00 C ATOM 2802 CD ARG B 52 6.666 16.649 -3.553 1.00 0.00 C ATOM 2803 NE ARG B 52 6.909 15.669 -4.608 1.00 0.00 N ATOM 2804 CZ ARG B 52 6.547 15.847 -5.875 1.00 0.00 C ATOM 2805 NH1 ARG B 52 5.933 16.965 -6.240 1.00 0.00 N ATOM 2806 NH2 ARG B 52 6.799 14.909 -6.778 1.00 0.00 N ATOM 0 H ARG B 52 9.492 16.783 -0.861 1.00 0.00 H new ATOM 0 HA ARG B 52 7.222 17.044 1.021 1.00 0.00 H new ATOM 0 HB2 ARG B 52 6.030 15.855 -0.978 1.00 0.00 H new ATOM 0 HB3 ARG B 52 6.320 17.582 -1.054 1.00 0.00 H new ATOM 0 HG2 ARG B 52 8.407 17.123 -2.388 1.00 0.00 H new ATOM 0 HG3 ARG B 52 7.990 15.421 -2.390 1.00 0.00 H new ATOM 0 HD2 ARG B 52 5.624 16.593 -3.239 1.00 0.00 H new ATOM 0 HD3 ARG B 52 6.827 17.653 -3.946 1.00 0.00 H new ATOM 0 HE ARG B 52 7.382 14.800 -4.359 1.00 0.00 H new ATOM 0 HH11 ARG B 52 5.738 17.689 -5.548 1.00 0.00 H new ATOM 0 HH12 ARG B 52 5.656 17.101 -7.212 1.00 0.00 H new ATOM 0 HH21 ARG B 52 7.272 14.048 -6.501 1.00 0.00 H new ATOM 0 HH22 ARG B 52 6.520 15.048 -7.749 1.00 0.00 H new ATOM 2820 N LEU B 53 9.041 14.484 0.292 1.00 0.00 N ATOM 2821 CA LEU B 53 9.325 13.093 0.627 1.00 0.00 C ATOM 2822 C LEU B 53 10.342 13.002 1.761 1.00 0.00 C ATOM 2823 O LEU B 53 11.375 13.671 1.736 1.00 0.00 O ATOM 2824 CB LEU B 53 9.849 12.348 -0.604 1.00 0.00 C ATOM 2825 CG LEU B 53 9.111 12.656 -1.908 1.00 0.00 C ATOM 2826 CD1 LEU B 53 9.899 12.139 -3.102 1.00 0.00 C ATOM 2827 CD2 LEU B 53 7.716 12.050 -1.884 1.00 0.00 C ATOM 0 H LEU B 53 9.800 14.966 -0.191 1.00 0.00 H new ATOM 0 HA LEU B 53 8.396 12.628 0.958 1.00 0.00 H new ATOM 0 HB2 LEU B 53 10.904 12.590 -0.735 1.00 0.00 H new ATOM 0 HB3 LEU B 53 9.789 11.276 -0.414 1.00 0.00 H new ATOM 0 HG LEU B 53 9.015 13.738 -2.004 1.00 0.00 H new ATOM 0 HD11 LEU B 53 9.359 12.367 -4.021 1.00 0.00 H new ATOM 0 HD12 LEU B 53 10.877 12.619 -3.128 1.00 0.00 H new ATOM 0 HD13 LEU B 53 10.026 11.060 -3.014 1.00 0.00 H new ATOM 0 HD21 LEU B 53 7.204 12.278 -2.819 1.00 0.00 H new ATOM 0 HD22 LEU B 53 7.791 10.969 -1.766 1.00 0.00 H new ATOM 0 HD23 LEU B 53 7.152 12.468 -1.050 1.00 0.00 H new ATOM 2839 N SER B 54 10.043 12.171 2.754 1.00 0.00 N ATOM 2840 CA SER B 54 10.933 11.995 3.896 1.00 0.00 C ATOM 2841 C SER B 54 10.960 10.540 4.350 1.00 0.00 C ATOM 2842 O SER B 54 9.999 10.044 4.938 1.00 0.00 O ATOM 2843 CB SER B 54 10.498 12.893 5.055 1.00 0.00 C ATOM 2844 OG SER B 54 9.765 14.011 4.588 1.00 0.00 O ATOM 0 H SER B 54 9.192 11.609 2.791 1.00 0.00 H new ATOM 0 HA SER B 54 11.938 12.278 3.583 1.00 0.00 H new ATOM 0 HB2 SER B 54 9.888 12.320 5.753 1.00 0.00 H new ATOM 0 HB3 SER B 54 11.376 13.234 5.604 1.00 0.00 H new ATOM 0 HG SER B 54 9.498 14.568 5.349 1.00 0.00 H new ATOM 2850 N VAL B 55 12.070 9.863 4.078 1.00 0.00 N ATOM 2851 CA VAL B 55 12.228 8.467 4.459 1.00 0.00 C ATOM 2852 C VAL B 55 13.069 8.339 5.725 1.00 0.00 C ATOM 2853 O VAL B 55 14.175 8.872 5.803 1.00 0.00 O ATOM 2854 CB VAL B 55 12.887 7.647 3.336 1.00 0.00 C ATOM 2855 CG1 VAL B 55 11.848 7.194 2.321 1.00 0.00 C ATOM 2856 CG2 VAL B 55 13.992 8.442 2.657 1.00 0.00 C ATOM 0 H VAL B 55 12.875 10.261 3.594 1.00 0.00 H new ATOM 0 HA VAL B 55 11.228 8.074 4.644 1.00 0.00 H new ATOM 0 HB VAL B 55 13.337 6.761 3.784 1.00 0.00 H new ATOM 0 HG11 VAL B 55 12.335 6.616 1.535 1.00 0.00 H new ATOM 0 HG12 VAL B 55 11.101 6.575 2.817 1.00 0.00 H new ATOM 0 HG13 VAL B 55 11.363 8.066 1.882 1.00 0.00 H new ATOM 0 HG21 VAL B 55 14.441 7.840 1.867 1.00 0.00 H new ATOM 0 HG22 VAL B 55 13.574 9.352 2.226 1.00 0.00 H new ATOM 0 HG23 VAL B 55 14.754 8.705 3.390 1.00 0.00 H new ATOM 2866 N ASP B 56 12.537 7.629 6.714 1.00 0.00 N ATOM 2867 CA ASP B 56 13.243 7.432 7.975 1.00 0.00 C ATOM 2868 C ASP B 56 13.239 5.954 8.377 1.00 0.00 C ATOM 2869 O ASP B 56 12.188 5.310 8.366 1.00 0.00 O ATOM 2870 CB ASP B 56 12.596 8.272 9.079 1.00 0.00 C ATOM 2871 CG ASP B 56 13.034 9.723 9.033 1.00 0.00 C ATOM 2872 OD1 ASP B 56 14.243 9.983 9.204 1.00 0.00 O ATOM 2873 OD2 ASP B 56 12.168 10.598 8.827 1.00 0.00 O ATOM 0 H ASP B 56 11.622 7.181 6.667 1.00 0.00 H new ATOM 0 HA ASP B 56 14.276 7.751 7.840 1.00 0.00 H new ATOM 0 HB2 ASP B 56 11.511 8.219 8.983 1.00 0.00 H new ATOM 0 HB3 ASP B 56 12.851 7.849 10.051 1.00 0.00 H new ATOM 2878 N PRO B 57 14.409 5.386 8.739 1.00 0.00 N ATOM 2879 CA PRO B 57 15.691 6.100 8.772 1.00 0.00 C ATOM 2880 C PRO B 57 16.232 6.370 7.369 1.00 0.00 C ATOM 2881 O PRO B 57 16.095 5.537 6.474 1.00 0.00 O ATOM 2882 CB PRO B 57 16.631 5.147 9.529 1.00 0.00 C ATOM 2883 CG PRO B 57 15.764 4.047 10.052 1.00 0.00 C ATOM 2884 CD PRO B 57 14.569 3.987 9.149 1.00 0.00 C ATOM 0 HA PRO B 57 15.594 7.078 9.244 1.00 0.00 H new ATOM 0 HB2 PRO B 57 17.404 4.755 8.868 1.00 0.00 H new ATOM 0 HB3 PRO B 57 17.139 5.664 10.343 1.00 0.00 H new ATOM 0 HG2 PRO B 57 16.299 3.097 10.052 1.00 0.00 H new ATOM 0 HG3 PRO B 57 15.464 4.244 11.081 1.00 0.00 H new ATOM 0 HD2 PRO B 57 14.738 3.331 8.295 1.00 0.00 H new ATOM 0 HD3 PRO B 57 13.687 3.613 9.668 1.00 0.00 H new ATOM 2892 N PRO B 58 16.860 7.540 7.158 1.00 0.00 N ATOM 2893 CA PRO B 58 17.423 7.908 5.855 1.00 0.00 C ATOM 2894 C PRO B 58 18.590 7.008 5.463 1.00 0.00 C ATOM 2895 O PRO B 58 18.813 6.738 4.284 1.00 0.00 O ATOM 2896 CB PRO B 58 17.901 9.348 6.060 1.00 0.00 C ATOM 2897 CG PRO B 58 18.102 9.480 7.530 1.00 0.00 C ATOM 2898 CD PRO B 58 17.074 8.591 8.170 1.00 0.00 C ATOM 0 HA PRO B 58 16.695 7.804 5.051 1.00 0.00 H new ATOM 0 HB2 PRO B 58 18.826 9.538 5.516 1.00 0.00 H new ATOM 0 HB3 PRO B 58 17.164 10.064 5.696 1.00 0.00 H new ATOM 0 HG2 PRO B 58 19.110 9.178 7.815 1.00 0.00 H new ATOM 0 HG3 PRO B 58 17.977 10.515 7.850 1.00 0.00 H new ATOM 0 HD2 PRO B 58 17.431 8.176 9.112 1.00 0.00 H new ATOM 0 HD3 PRO B 58 16.154 9.132 8.389 1.00 0.00 H new ATOM 2906 N CYS B 59 19.329 6.544 6.465 1.00 0.00 N ATOM 2907 CA CYS B 59 20.474 5.670 6.237 1.00 0.00 C ATOM 2908 C CYS B 59 20.609 4.662 7.374 1.00 0.00 C ATOM 2909 O CYS B 59 19.792 4.640 8.294 1.00 0.00 O ATOM 2910 CB CYS B 59 21.756 6.494 6.113 1.00 0.00 C ATOM 2911 SG CYS B 59 21.942 7.765 7.387 1.00 0.00 S ATOM 0 H CYS B 59 19.154 6.760 7.447 1.00 0.00 H new ATOM 0 HA CYS B 59 20.313 5.128 5.305 1.00 0.00 H new ATOM 0 HB2 CYS B 59 22.613 5.822 6.157 1.00 0.00 H new ATOM 0 HB3 CYS B 59 21.775 6.971 5.133 1.00 0.00 H new ATOM 0 HG CYS B 59 23.190 7.845 7.741 1.00 0.00 H new ATOM 2917 N GLY B 60 21.643 3.831 7.306 1.00 0.00 N ATOM 2918 CA GLY B 60 21.859 2.837 8.340 1.00 0.00 C ATOM 2919 C GLY B 60 22.832 1.757 7.915 1.00 0.00 C ATOM 2920 O GLY B 60 23.472 1.866 6.871 1.00 0.00 O ATOM 0 H GLY B 60 22.334 3.828 6.555 1.00 0.00 H new ATOM 0 HA2 GLY B 60 22.236 3.328 9.238 1.00 0.00 H new ATOM 0 HA3 GLY B 60 20.906 2.379 8.603 1.00 0.00 H new ATOM 2924 N VAL B 61 22.941 0.712 8.728 1.00 0.00 N ATOM 2925 CA VAL B 61 23.841 -0.396 8.438 1.00 0.00 C ATOM 2926 C VAL B 61 23.292 -1.701 9.003 1.00 0.00 C ATOM 2927 O VAL B 61 22.921 -1.773 10.174 1.00 0.00 O ATOM 2928 CB VAL B 61 25.244 -0.146 9.020 1.00 0.00 C ATOM 2929 CG1 VAL B 61 25.187 -0.062 10.536 1.00 0.00 C ATOM 2930 CG2 VAL B 61 26.209 -1.234 8.575 1.00 0.00 C ATOM 0 H VAL B 61 22.415 0.610 9.596 1.00 0.00 H new ATOM 0 HA VAL B 61 23.917 -0.473 7.353 1.00 0.00 H new ATOM 0 HB VAL B 61 25.609 0.808 8.640 1.00 0.00 H new ATOM 0 HG11 VAL B 61 26.188 0.115 10.929 1.00 0.00 H new ATOM 0 HG12 VAL B 61 24.532 0.758 10.831 1.00 0.00 H new ATOM 0 HG13 VAL B 61 24.800 -0.998 10.938 1.00 0.00 H new ATOM 0 HG21 VAL B 61 27.195 -1.040 8.996 1.00 0.00 H new ATOM 0 HG22 VAL B 61 25.850 -2.203 8.922 1.00 0.00 H new ATOM 0 HG23 VAL B 61 26.274 -1.240 7.487 1.00 0.00 H new ATOM 2940 N LEU B 62 23.238 -2.732 8.165 1.00 0.00 N ATOM 2941 CA LEU B 62 22.728 -4.029 8.591 1.00 0.00 C ATOM 2942 C LEU B 62 23.739 -5.136 8.316 1.00 0.00 C ATOM 2943 O LEU B 62 24.569 -5.023 7.415 1.00 0.00 O ATOM 2944 CB LEU B 62 21.406 -4.340 7.885 1.00 0.00 C ATOM 2945 CG LEU B 62 21.516 -4.583 6.379 1.00 0.00 C ATOM 2946 CD1 LEU B 62 20.502 -5.623 5.931 1.00 0.00 C ATOM 2947 CD2 LEU B 62 21.322 -3.282 5.615 1.00 0.00 C ATOM 0 H LEU B 62 23.540 -2.694 7.191 1.00 0.00 H new ATOM 0 HA LEU B 62 22.556 -3.984 9.666 1.00 0.00 H new ATOM 0 HB2 LEU B 62 20.963 -5.222 8.348 1.00 0.00 H new ATOM 0 HB3 LEU B 62 20.718 -3.512 8.054 1.00 0.00 H new ATOM 0 HG LEU B 62 22.514 -4.963 6.163 1.00 0.00 H new ATOM 0 HD11 LEU B 62 20.595 -5.783 4.857 1.00 0.00 H new ATOM 0 HD12 LEU B 62 20.687 -6.561 6.455 1.00 0.00 H new ATOM 0 HD13 LEU B 62 19.496 -5.272 6.160 1.00 0.00 H new ATOM 0 HD21 LEU B 62 21.403 -3.473 4.545 1.00 0.00 H new ATOM 0 HD22 LEU B 62 20.336 -2.873 5.837 1.00 0.00 H new ATOM 0 HD23 LEU B 62 22.087 -2.566 5.915 1.00 0.00 H new ATOM 2959 N ASP B 63 23.662 -6.204 9.102 1.00 0.00 N ATOM 2960 CA ASP B 63 24.569 -7.335 8.951 1.00 0.00 C ATOM 2961 C ASP B 63 23.994 -8.367 7.983 1.00 0.00 C ATOM 2962 O ASP B 63 22.822 -8.301 7.613 1.00 0.00 O ATOM 2963 CB ASP B 63 24.832 -7.983 10.312 1.00 0.00 C ATOM 2964 CG ASP B 63 23.555 -8.227 11.093 1.00 0.00 C ATOM 2965 OD1 ASP B 63 22.815 -9.169 10.741 1.00 0.00 O ATOM 2966 OD2 ASP B 63 23.296 -7.475 12.056 1.00 0.00 O ATOM 0 H ASP B 63 22.979 -6.310 9.852 1.00 0.00 H new ATOM 0 HA ASP B 63 25.510 -6.967 8.542 1.00 0.00 H new ATOM 0 HB2 ASP B 63 25.352 -8.930 10.166 1.00 0.00 H new ATOM 0 HB3 ASP B 63 25.494 -7.342 10.894 1.00 0.00 H new ATOM 2971 N PRO B 64 24.816 -9.338 7.554 1.00 0.00 N ATOM 2972 CA PRO B 64 24.380 -10.384 6.623 1.00 0.00 C ATOM 2973 C PRO B 64 23.256 -11.238 7.200 1.00 0.00 C ATOM 2974 O PRO B 64 23.325 -11.680 8.347 1.00 0.00 O ATOM 2975 CB PRO B 64 25.640 -11.233 6.408 1.00 0.00 C ATOM 2976 CG PRO B 64 26.773 -10.366 6.840 1.00 0.00 C ATOM 2977 CD PRO B 64 26.229 -9.495 7.933 1.00 0.00 C ATOM 0 HA PRO B 64 23.978 -9.962 5.702 1.00 0.00 H new ATOM 0 HB2 PRO B 64 25.601 -12.151 6.994 1.00 0.00 H new ATOM 0 HB3 PRO B 64 25.744 -11.526 5.363 1.00 0.00 H new ATOM 0 HG2 PRO B 64 27.610 -10.966 7.198 1.00 0.00 H new ATOM 0 HG3 PRO B 64 27.144 -9.765 6.010 1.00 0.00 H new ATOM 0 HD2 PRO B 64 26.335 -9.962 8.912 1.00 0.00 H new ATOM 0 HD3 PRO B 64 26.744 -8.535 7.979 1.00 0.00 H new ATOM 2985 N LYS B 65 22.224 -11.472 6.393 1.00 0.00 N ATOM 2986 CA LYS B 65 21.078 -12.280 6.809 1.00 0.00 C ATOM 2987 C LYS B 65 20.131 -11.499 7.721 1.00 0.00 C ATOM 2988 O LYS B 65 19.239 -12.081 8.338 1.00 0.00 O ATOM 2989 CB LYS B 65 21.547 -13.555 7.520 1.00 0.00 C ATOM 2990 CG LYS B 65 20.479 -14.634 7.602 1.00 0.00 C ATOM 2991 CD LYS B 65 21.089 -16.002 7.864 1.00 0.00 C ATOM 2992 CE LYS B 65 20.234 -17.114 7.277 1.00 0.00 C ATOM 2993 NZ LYS B 65 18.931 -17.246 7.985 1.00 0.00 N ATOM 0 H LYS B 65 22.157 -11.111 5.441 1.00 0.00 H new ATOM 0 HA LYS B 65 20.531 -12.550 5.906 1.00 0.00 H new ATOM 0 HB2 LYS B 65 22.416 -13.954 6.996 1.00 0.00 H new ATOM 0 HB3 LYS B 65 21.872 -13.300 8.529 1.00 0.00 H new ATOM 0 HG2 LYS B 65 19.774 -14.390 8.397 1.00 0.00 H new ATOM 0 HG3 LYS B 65 19.913 -14.659 6.671 1.00 0.00 H new ATOM 0 HD2 LYS B 65 22.089 -16.044 7.433 1.00 0.00 H new ATOM 0 HD3 LYS B 65 21.198 -16.154 8.938 1.00 0.00 H new ATOM 0 HE2 LYS B 65 20.054 -16.914 6.221 1.00 0.00 H new ATOM 0 HE3 LYS B 65 20.776 -18.058 7.335 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 18.378 -18.015 7.554 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 19.101 -17.462 8.988 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 18.402 -16.354 7.908 1.00 0.00 H new ATOM 3007 N GLU B 66 20.315 -10.182 7.801 1.00 0.00 N ATOM 3008 CA GLU B 66 19.460 -9.349 8.636 1.00 0.00 C ATOM 3009 C GLU B 66 18.541 -8.491 7.759 1.00 0.00 C ATOM 3010 O GLU B 66 18.943 -8.021 6.693 1.00 0.00 O ATOM 3011 CB GLU B 66 20.332 -8.494 9.583 1.00 0.00 C ATOM 3012 CG GLU B 66 19.851 -7.065 9.811 1.00 0.00 C ATOM 3013 CD GLU B 66 18.598 -6.997 10.663 1.00 0.00 C ATOM 3014 OE1 GLU B 66 18.003 -8.064 10.930 1.00 0.00 O ATOM 3015 OE2 GLU B 66 18.210 -5.880 11.062 1.00 0.00 O ATOM 0 H GLU B 66 21.044 -9.674 7.300 1.00 0.00 H new ATOM 0 HA GLU B 66 18.819 -9.978 9.254 1.00 0.00 H new ATOM 0 HB2 GLU B 66 20.390 -8.997 10.548 1.00 0.00 H new ATOM 0 HB3 GLU B 66 21.345 -8.458 9.182 1.00 0.00 H new ATOM 0 HG2 GLU B 66 20.644 -6.492 10.292 1.00 0.00 H new ATOM 0 HG3 GLU B 66 19.656 -6.594 8.848 1.00 0.00 H new ATOM 3022 N LYS B 67 17.307 -8.300 8.219 1.00 0.00 N ATOM 3023 CA LYS B 67 16.327 -7.507 7.484 1.00 0.00 C ATOM 3024 C LYS B 67 16.251 -6.086 8.026 1.00 0.00 C ATOM 3025 O LYS B 67 16.676 -5.811 9.148 1.00 0.00 O ATOM 3026 CB LYS B 67 14.949 -8.165 7.562 1.00 0.00 C ATOM 3027 CG LYS B 67 14.959 -9.645 7.213 1.00 0.00 C ATOM 3028 CD LYS B 67 13.650 -10.315 7.600 1.00 0.00 C ATOM 3029 CE LYS B 67 13.887 -11.627 8.328 1.00 0.00 C ATOM 3030 NZ LYS B 67 13.553 -11.528 9.775 1.00 0.00 N ATOM 0 H LYS B 67 16.962 -8.684 9.099 1.00 0.00 H new ATOM 0 HA LYS B 67 16.647 -7.461 6.443 1.00 0.00 H new ATOM 0 HB2 LYS B 67 14.553 -8.041 8.570 1.00 0.00 H new ATOM 0 HB3 LYS B 67 14.269 -7.646 6.886 1.00 0.00 H new ATOM 0 HG2 LYS B 67 15.130 -9.767 6.143 1.00 0.00 H new ATOM 0 HG3 LYS B 67 15.786 -10.136 7.726 1.00 0.00 H new ATOM 0 HD2 LYS B 67 13.072 -9.645 8.236 1.00 0.00 H new ATOM 0 HD3 LYS B 67 13.055 -10.497 6.705 1.00 0.00 H new ATOM 0 HE2 LYS B 67 13.284 -12.411 7.869 1.00 0.00 H new ATOM 0 HE3 LYS B 67 14.931 -11.921 8.216 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 13.729 -12.444 10.235 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 14.146 -10.798 10.219 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 12.551 -11.273 9.883 1.00 0.00 H new ATOM 3044 N VAL B 68 15.703 -5.188 7.218 1.00 0.00 N ATOM 3045 CA VAL B 68 15.562 -3.790 7.603 1.00 0.00 C ATOM 3046 C VAL B 68 14.180 -3.257 7.239 1.00 0.00 C ATOM 3047 O VAL B 68 13.629 -3.596 6.191 1.00 0.00 O ATOM 3048 CB VAL B 68 16.633 -2.911 6.932 1.00 0.00 C ATOM 3049 CG1 VAL B 68 16.539 -1.478 7.430 1.00 0.00 C ATOM 3050 CG2 VAL B 68 18.022 -3.479 7.177 1.00 0.00 C ATOM 0 H VAL B 68 15.347 -5.405 6.287 1.00 0.00 H new ATOM 0 HA VAL B 68 15.693 -3.745 8.684 1.00 0.00 H new ATOM 0 HB VAL B 68 16.452 -2.909 5.857 1.00 0.00 H new ATOM 0 HG11 VAL B 68 17.304 -0.873 6.944 1.00 0.00 H new ATOM 0 HG12 VAL B 68 15.554 -1.075 7.195 1.00 0.00 H new ATOM 0 HG13 VAL B 68 16.691 -1.457 8.509 1.00 0.00 H new ATOM 0 HG21 VAL B 68 18.765 -2.844 6.695 1.00 0.00 H new ATOM 0 HG22 VAL B 68 18.216 -3.515 8.249 1.00 0.00 H new ATOM 0 HG23 VAL B 68 18.082 -4.486 6.763 1.00 0.00 H new ATOM 3060 N LEU B 69 13.622 -2.424 8.112 1.00 0.00 N ATOM 3061 CA LEU B 69 12.303 -1.845 7.880 1.00 0.00 C ATOM 3062 C LEU B 69 12.383 -0.325 7.778 1.00 0.00 C ATOM 3063 O LEU B 69 12.791 0.350 8.723 1.00 0.00 O ATOM 3064 CB LEU B 69 11.344 -2.243 9.004 1.00 0.00 C ATOM 3065 CG LEU B 69 10.815 -3.677 8.925 1.00 0.00 C ATOM 3066 CD1 LEU B 69 10.173 -4.081 10.243 1.00 0.00 C ATOM 3067 CD2 LEU B 69 9.821 -3.814 7.781 1.00 0.00 C ATOM 0 H LEU B 69 14.062 -2.135 8.986 1.00 0.00 H new ATOM 0 HA LEU B 69 11.926 -2.233 6.934 1.00 0.00 H new ATOM 0 HB2 LEU B 69 11.853 -2.111 9.959 1.00 0.00 H new ATOM 0 HB3 LEU B 69 10.496 -1.558 8.998 1.00 0.00 H new ATOM 0 HG LEU B 69 11.654 -4.346 8.733 1.00 0.00 H new ATOM 0 HD11 LEU B 69 9.802 -5.103 10.169 1.00 0.00 H new ATOM 0 HD12 LEU B 69 10.912 -4.020 11.042 1.00 0.00 H new ATOM 0 HD13 LEU B 69 9.343 -3.410 10.465 1.00 0.00 H new ATOM 0 HD21 LEU B 69 9.454 -4.840 7.738 1.00 0.00 H new ATOM 0 HD22 LEU B 69 8.983 -3.136 7.944 1.00 0.00 H new ATOM 0 HD23 LEU B 69 10.312 -3.565 6.840 1.00 0.00 H new ATOM 3079 N MET B 70 11.990 0.206 6.626 1.00 0.00 N ATOM 3080 CA MET B 70 12.016 1.646 6.396 1.00 0.00 C ATOM 3081 C MET B 70 10.603 2.202 6.270 1.00 0.00 C ATOM 3082 O MET B 70 9.662 1.470 5.965 1.00 0.00 O ATOM 3083 CB MET B 70 12.817 1.969 5.133 1.00 0.00 C ATOM 3084 CG MET B 70 14.076 1.131 4.980 1.00 0.00 C ATOM 3085 SD MET B 70 15.144 1.724 3.655 1.00 0.00 S ATOM 3086 CE MET B 70 13.941 2.020 2.361 1.00 0.00 C ATOM 0 H MET B 70 11.649 -0.340 5.835 1.00 0.00 H new ATOM 0 HA MET B 70 12.498 2.116 7.253 1.00 0.00 H new ATOM 0 HB2 MET B 70 12.181 1.817 4.261 1.00 0.00 H new ATOM 0 HB3 MET B 70 13.092 3.024 5.147 1.00 0.00 H new ATOM 0 HG2 MET B 70 14.630 1.138 5.919 1.00 0.00 H new ATOM 0 HG3 MET B 70 13.798 0.096 4.782 1.00 0.00 H new ATOM 0 HE1 MET B 70 14.458 2.220 1.422 1.00 0.00 H new ATOM 0 HE2 MET B 70 13.307 1.141 2.246 1.00 0.00 H new ATOM 0 HE3 MET B 70 13.325 2.880 2.626 1.00 0.00 H new ATOM 3096 N ALA B 71 10.462 3.499 6.509 1.00 0.00 N ATOM 3097 CA ALA B 71 9.163 4.155 6.424 1.00 0.00 C ATOM 3098 C ALA B 71 9.214 5.367 5.498 1.00 0.00 C ATOM 3099 O ALA B 71 9.699 6.431 5.881 1.00 0.00 O ATOM 3100 CB ALA B 71 8.691 4.568 7.810 1.00 0.00 C ATOM 0 H ALA B 71 11.231 4.118 6.763 1.00 0.00 H new ATOM 0 HA ALA B 71 8.452 3.443 6.005 1.00 0.00 H new ATOM 0 HB1 ALA B 71 7.720 5.057 7.733 1.00 0.00 H new ATOM 0 HB2 ALA B 71 8.604 3.685 8.443 1.00 0.00 H new ATOM 0 HB3 ALA B 71 9.411 5.259 8.249 1.00 0.00 H new ATOM 3106 N VAL B 72 8.707 5.197 4.281 1.00 0.00 N ATOM 3107 CA VAL B 72 8.692 6.280 3.304 1.00 0.00 C ATOM 3108 C VAL B 72 7.432 7.127 3.449 1.00 0.00 C ATOM 3109 O VAL B 72 6.331 6.678 3.134 1.00 0.00 O ATOM 3110 CB VAL B 72 8.772 5.740 1.863 1.00 0.00 C ATOM 3111 CG1 VAL B 72 7.623 4.782 1.586 1.00 0.00 C ATOM 3112 CG2 VAL B 72 8.774 6.885 0.862 1.00 0.00 C ATOM 0 H VAL B 72 8.302 4.322 3.948 1.00 0.00 H new ATOM 0 HA VAL B 72 9.569 6.897 3.499 1.00 0.00 H new ATOM 0 HB VAL B 72 9.707 5.191 1.753 1.00 0.00 H new ATOM 0 HG11 VAL B 72 7.697 4.411 0.564 1.00 0.00 H new ATOM 0 HG12 VAL B 72 7.673 3.943 2.281 1.00 0.00 H new ATOM 0 HG13 VAL B 72 6.675 5.304 1.715 1.00 0.00 H new ATOM 0 HG21 VAL B 72 8.831 6.484 -0.150 1.00 0.00 H new ATOM 0 HG22 VAL B 72 7.858 7.465 0.971 1.00 0.00 H new ATOM 0 HG23 VAL B 72 9.635 7.528 1.046 1.00 0.00 H new ATOM 3122 N SER B 73 7.600 8.353 3.935 1.00 0.00 N ATOM 3123 CA SER B 73 6.471 9.258 4.127 1.00 0.00 C ATOM 3124 C SER B 73 6.240 10.122 2.892 1.00 0.00 C ATOM 3125 O SER B 73 7.168 10.743 2.373 1.00 0.00 O ATOM 3126 CB SER B 73 6.708 10.147 5.349 1.00 0.00 C ATOM 3127 OG SER B 73 6.920 9.369 6.514 1.00 0.00 O ATOM 0 H SER B 73 8.504 8.742 4.202 1.00 0.00 H new ATOM 0 HA SER B 73 5.580 8.652 4.291 1.00 0.00 H new ATOM 0 HB2 SER B 73 7.572 10.788 5.174 1.00 0.00 H new ATOM 0 HB3 SER B 73 5.850 10.803 5.497 1.00 0.00 H new ATOM 0 HG SER B 73 6.178 8.739 6.626 1.00 0.00 H new ATOM 3133 N CYS B 74 4.994 10.161 2.432 1.00 0.00 N ATOM 3134 CA CYS B 74 4.633 10.953 1.263 1.00 0.00 C ATOM 3135 C CYS B 74 3.675 12.076 1.648 1.00 0.00 C ATOM 3136 O CYS B 74 2.907 11.950 2.601 1.00 0.00 O ATOM 3137 CB CYS B 74 3.994 10.062 0.195 1.00 0.00 C ATOM 3138 SG CYS B 74 3.393 10.961 -1.255 1.00 0.00 S ATOM 0 H CYS B 74 4.216 9.652 2.852 1.00 0.00 H new ATOM 0 HA CYS B 74 5.542 11.397 0.857 1.00 0.00 H new ATOM 0 HB2 CYS B 74 4.724 9.320 -0.128 1.00 0.00 H new ATOM 0 HB3 CYS B 74 3.162 9.517 0.642 1.00 0.00 H new ATOM 0 HG CYS B 74 2.872 10.122 -2.101 1.00 0.00 H new ATOM 3144 N ASP B 75 3.727 13.176 0.903 1.00 0.00 N ATOM 3145 CA ASP B 75 2.864 14.320 1.174 1.00 0.00 C ATOM 3146 C ASP B 75 1.793 14.465 0.099 1.00 0.00 C ATOM 3147 O ASP B 75 1.975 14.026 -1.037 1.00 0.00 O ATOM 3148 CB ASP B 75 3.695 15.602 1.260 1.00 0.00 C ATOM 3149 CG ASP B 75 3.789 16.136 2.676 1.00 0.00 C ATOM 3150 OD1 ASP B 75 2.787 16.039 3.416 1.00 0.00 O ATOM 3151 OD2 ASP B 75 4.866 16.651 3.047 1.00 0.00 O ATOM 0 H ASP B 75 4.356 13.299 0.109 1.00 0.00 H new ATOM 0 HA ASP B 75 2.369 14.150 2.130 1.00 0.00 H new ATOM 0 HB2 ASP B 75 4.698 15.408 0.881 1.00 0.00 H new ATOM 0 HB3 ASP B 75 3.253 16.362 0.616 1.00 0.00 H new ATOM 3156 N THR B 76 0.678 15.088 0.466 1.00 0.00 N ATOM 3157 CA THR B 76 -0.423 15.297 -0.464 1.00 0.00 C ATOM 3158 C THR B 76 0.036 16.098 -1.679 1.00 0.00 C ATOM 3159 O THR B 76 1.067 16.768 -1.637 1.00 0.00 O ATOM 3160 CB THR B 76 -1.574 16.023 0.231 1.00 0.00 C ATOM 3161 OG1 THR B 76 -1.339 17.420 0.265 1.00 0.00 O ATOM 3162 CG2 THR B 76 -1.808 15.561 1.653 1.00 0.00 C ATOM 0 H THR B 76 0.514 15.457 1.403 1.00 0.00 H new ATOM 0 HA THR B 76 -0.769 14.321 -0.803 1.00 0.00 H new ATOM 0 HB THR B 76 -2.460 15.785 -0.358 1.00 0.00 H new ATOM 0 HG1 THR B 76 -2.088 17.867 0.712 1.00 0.00 H new ATOM 0 HG21 THR B 76 -2.639 16.119 2.085 1.00 0.00 H new ATOM 0 HG22 THR B 76 -2.045 14.497 1.656 1.00 0.00 H new ATOM 0 HG23 THR B 76 -0.909 15.734 2.244 1.00 0.00 H new ATOM 3170 N PHE B 77 -0.734 16.023 -2.759 1.00 0.00 N ATOM 3171 CA PHE B 77 -0.403 16.743 -3.983 1.00 0.00 C ATOM 3172 C PHE B 77 -1.524 16.620 -5.010 1.00 0.00 C ATOM 3173 O PHE B 77 -2.638 16.211 -4.683 1.00 0.00 O ATOM 3174 CB PHE B 77 0.912 16.218 -4.568 1.00 0.00 C ATOM 3175 CG PHE B 77 0.790 14.867 -5.218 1.00 0.00 C ATOM 3176 CD1 PHE B 77 0.246 13.798 -4.525 1.00 0.00 C ATOM 3177 CD2 PHE B 77 1.220 14.669 -6.521 1.00 0.00 C ATOM 3178 CE1 PHE B 77 0.132 12.555 -5.120 1.00 0.00 C ATOM 3179 CE2 PHE B 77 1.108 13.429 -7.120 1.00 0.00 C ATOM 3180 CZ PHE B 77 0.564 12.371 -6.419 1.00 0.00 C ATOM 0 H PHE B 77 -1.591 15.472 -2.812 1.00 0.00 H new ATOM 0 HA PHE B 77 -0.284 17.798 -3.735 1.00 0.00 H new ATOM 0 HB2 PHE B 77 1.283 16.932 -5.303 1.00 0.00 H new ATOM 0 HB3 PHE B 77 1.656 16.163 -3.773 1.00 0.00 H new ATOM 0 HD1 PHE B 77 -0.093 13.937 -3.509 1.00 0.00 H new ATOM 0 HD2 PHE B 77 1.647 15.493 -7.074 1.00 0.00 H new ATOM 0 HE1 PHE B 77 -0.294 11.729 -4.570 1.00 0.00 H new ATOM 0 HE2 PHE B 77 1.446 13.287 -8.136 1.00 0.00 H new ATOM 0 HZ PHE B 77 0.476 11.401 -6.886 1.00 0.00 H new ATOM 3190 N ASN B 78 -1.220 16.975 -6.254 1.00 0.00 N ATOM 3191 CA ASN B 78 -2.201 16.903 -7.331 1.00 0.00 C ATOM 3192 C ASN B 78 -1.708 16.002 -8.457 1.00 0.00 C ATOM 3193 O ASN B 78 -1.168 16.477 -9.456 1.00 0.00 O ATOM 3194 CB ASN B 78 -2.496 18.301 -7.875 1.00 0.00 C ATOM 3195 CG ASN B 78 -3.325 19.132 -6.917 1.00 0.00 C ATOM 3196 OD1 ASN B 78 -4.132 18.600 -6.154 1.00 0.00 O ATOM 3197 ND2 ASN B 78 -3.130 20.445 -6.952 1.00 0.00 N ATOM 0 H ASN B 78 -0.302 17.315 -6.541 1.00 0.00 H new ATOM 0 HA ASN B 78 -3.118 16.477 -6.924 1.00 0.00 H new ATOM 0 HB2 ASN B 78 -1.556 18.815 -8.077 1.00 0.00 H new ATOM 0 HB3 ASN B 78 -3.023 18.214 -8.825 1.00 0.00 H new ATOM 0 HD21 ASN B 78 -3.660 21.056 -6.330 1.00 0.00 H new ATOM 0 HD22 ASN B 78 -2.451 20.843 -7.601 1.00 0.00 H new ATOM 3204 N ALA B 79 -1.899 14.698 -8.289 1.00 0.00 N ATOM 3205 CA ALA B 79 -1.475 13.729 -9.292 1.00 0.00 C ATOM 3206 C ALA B 79 -2.114 14.021 -10.648 1.00 0.00 C ATOM 3207 O ALA B 79 -1.603 13.600 -11.687 1.00 0.00 O ATOM 3208 CB ALA B 79 -1.817 12.318 -8.839 1.00 0.00 C ATOM 0 H ALA B 79 -2.344 14.288 -7.468 1.00 0.00 H new ATOM 0 HA ALA B 79 -0.394 13.812 -9.405 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -1.495 11.604 -9.597 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -1.307 12.104 -7.900 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -2.894 12.233 -8.695 1.00 0.00 H new ATOM 3214 N ALA B 80 -3.232 14.740 -10.632 1.00 0.00 N ATOM 3215 CA ALA B 80 -3.937 15.084 -11.861 1.00 0.00 C ATOM 3216 C ALA B 80 -2.987 15.671 -12.900 1.00 0.00 C ATOM 3217 O ALA B 80 -3.063 15.337 -14.082 1.00 0.00 O ATOM 3218 CB ALA B 80 -5.063 16.064 -11.567 1.00 0.00 C ATOM 0 H ALA B 80 -3.669 15.095 -9.782 1.00 0.00 H new ATOM 0 HA ALA B 80 -4.360 14.167 -12.271 1.00 0.00 H new ATOM 0 HB1 ALA B 80 -5.581 16.312 -12.494 1.00 0.00 H new ATOM 0 HB2 ALA B 80 -5.766 15.611 -10.868 1.00 0.00 H new ATOM 0 HB3 ALA B 80 -4.650 16.972 -11.128 1.00 0.00 H new ATOM 3224 N THR B 81 -2.096 16.551 -12.454 1.00 0.00 N ATOM 3225 CA THR B 81 -1.137 17.184 -13.351 1.00 0.00 C ATOM 3226 C THR B 81 0.224 17.339 -12.682 1.00 0.00 C ATOM 3227 O THR B 81 0.868 18.381 -12.797 1.00 0.00 O ATOM 3228 CB THR B 81 -1.658 18.549 -13.799 1.00 0.00 C ATOM 3229 OG1 THR B 81 -1.820 19.415 -12.690 1.00 0.00 O ATOM 3230 CG2 THR B 81 -2.984 18.467 -14.520 1.00 0.00 C ATOM 0 H THR B 81 -2.019 16.841 -11.479 1.00 0.00 H new ATOM 0 HA THR B 81 -1.016 16.542 -14.223 1.00 0.00 H new ATOM 0 HB THR B 81 -0.908 18.936 -14.489 1.00 0.00 H new ATOM 0 HG1 THR B 81 -2.153 20.284 -12.999 1.00 0.00 H new ATOM 0 HG21 THR B 81 -3.301 19.468 -14.813 1.00 0.00 H new ATOM 0 HG22 THR B 81 -2.877 17.846 -15.409 1.00 0.00 H new ATOM 0 HG23 THR B 81 -3.731 18.028 -13.859 1.00 0.00 H new ATOM 3238 N GLU B 82 0.658 16.296 -11.983 1.00 0.00 N ATOM 3239 CA GLU B 82 1.946 16.318 -11.296 1.00 0.00 C ATOM 3240 C GLU B 82 2.853 15.176 -11.761 1.00 0.00 C ATOM 3241 O GLU B 82 3.934 14.974 -11.206 1.00 0.00 O ATOM 3242 CB GLU B 82 1.739 16.231 -9.784 1.00 0.00 C ATOM 3243 CG GLU B 82 1.289 17.539 -9.154 1.00 0.00 C ATOM 3244 CD GLU B 82 2.437 18.508 -8.943 1.00 0.00 C ATOM 3245 OE1 GLU B 82 3.521 18.278 -9.517 1.00 0.00 O ATOM 3246 OE2 GLU B 82 2.250 19.496 -8.203 1.00 0.00 O ATOM 0 H GLU B 82 0.138 15.425 -11.877 1.00 0.00 H new ATOM 0 HA GLU B 82 2.436 17.260 -11.543 1.00 0.00 H new ATOM 0 HB2 GLU B 82 0.997 15.461 -9.571 1.00 0.00 H new ATOM 0 HB3 GLU B 82 2.671 15.914 -9.316 1.00 0.00 H new ATOM 0 HG2 GLU B 82 0.537 18.005 -9.790 1.00 0.00 H new ATOM 0 HG3 GLU B 82 0.812 17.332 -8.196 1.00 0.00 H new ATOM 3253 N ASP B 83 2.418 14.433 -12.777 1.00 0.00 N ATOM 3254 CA ASP B 83 3.206 13.322 -13.299 1.00 0.00 C ATOM 3255 C ASP B 83 3.365 12.226 -12.250 1.00 0.00 C ATOM 3256 O ASP B 83 3.555 12.508 -11.067 1.00 0.00 O ATOM 3257 CB ASP B 83 4.583 13.812 -13.751 1.00 0.00 C ATOM 3258 CG ASP B 83 5.031 13.166 -15.047 1.00 0.00 C ATOM 3259 OD1 ASP B 83 4.684 11.988 -15.274 1.00 0.00 O ATOM 3260 OD2 ASP B 83 5.730 13.837 -15.835 1.00 0.00 O ATOM 0 H ASP B 83 1.528 14.580 -13.252 1.00 0.00 H new ATOM 0 HA ASP B 83 2.676 12.907 -14.156 1.00 0.00 H new ATOM 0 HB2 ASP B 83 4.556 14.894 -13.878 1.00 0.00 H new ATOM 0 HB3 ASP B 83 5.315 13.600 -12.971 1.00 0.00 H new ATOM 3265 N LEU B 84 3.286 10.975 -12.692 1.00 0.00 N ATOM 3266 CA LEU B 84 3.423 9.836 -11.792 1.00 0.00 C ATOM 3267 C LEU B 84 4.665 9.020 -12.133 1.00 0.00 C ATOM 3268 O LEU B 84 4.741 7.829 -11.828 1.00 0.00 O ATOM 3269 CB LEU B 84 2.181 8.946 -11.868 1.00 0.00 C ATOM 3270 CG LEU B 84 0.881 9.675 -12.210 1.00 0.00 C ATOM 3271 CD1 LEU B 84 -0.224 8.678 -12.519 1.00 0.00 C ATOM 3272 CD2 LEU B 84 0.470 10.593 -11.069 1.00 0.00 C ATOM 0 H LEU B 84 3.128 10.725 -13.668 1.00 0.00 H new ATOM 0 HA LEU B 84 3.527 10.219 -10.777 1.00 0.00 H new ATOM 0 HB2 LEU B 84 2.353 8.172 -12.616 1.00 0.00 H new ATOM 0 HB3 LEU B 84 2.055 8.441 -10.910 1.00 0.00 H new ATOM 0 HG LEU B 84 1.050 10.285 -13.098 1.00 0.00 H new ATOM 0 HD11 LEU B 84 -1.141 9.215 -12.760 1.00 0.00 H new ATOM 0 HD12 LEU B 84 0.069 8.061 -13.368 1.00 0.00 H new ATOM 0 HD13 LEU B 84 -0.393 8.042 -11.650 1.00 0.00 H new ATOM 0 HD21 LEU B 84 -0.457 11.104 -11.329 1.00 0.00 H new ATOM 0 HD22 LEU B 84 0.318 10.004 -10.165 1.00 0.00 H new ATOM 0 HD23 LEU B 84 1.254 11.330 -10.895 1.00 0.00 H new ATOM 3284 N ASN B 85 5.638 9.666 -12.767 1.00 0.00 N ATOM 3285 CA ASN B 85 6.878 9.000 -13.149 1.00 0.00 C ATOM 3286 C ASN B 85 8.070 9.932 -12.968 1.00 0.00 C ATOM 3287 O ASN B 85 9.075 9.813 -13.669 1.00 0.00 O ATOM 3288 CB ASN B 85 6.800 8.529 -14.603 1.00 0.00 C ATOM 3289 CG ASN B 85 7.825 7.459 -14.919 1.00 0.00 C ATOM 3290 OD1 ASN B 85 8.411 6.857 -14.018 1.00 0.00 O ATOM 3291 ND2 ASN B 85 8.049 7.214 -16.205 1.00 0.00 N ATOM 0 H ASN B 85 5.592 10.651 -13.027 1.00 0.00 H new ATOM 0 HA ASN B 85 7.013 8.134 -12.501 1.00 0.00 H new ATOM 0 HB2 ASN B 85 5.801 8.142 -14.804 1.00 0.00 H new ATOM 0 HB3 ASN B 85 6.951 9.380 -15.267 1.00 0.00 H new ATOM 0 HD21 ASN B 85 8.728 6.504 -16.478 1.00 0.00 H new ATOM 0 HD22 ASN B 85 7.542 7.736 -16.920 1.00 0.00 H new ATOM 3298 N ASN B 86 7.950 10.862 -12.026 1.00 0.00 N ATOM 3299 CA ASN B 86 9.019 11.816 -11.755 1.00 0.00 C ATOM 3300 C ASN B 86 9.710 11.503 -10.433 1.00 0.00 C ATOM 3301 O ASN B 86 10.895 11.790 -10.257 1.00 0.00 O ATOM 3302 CB ASN B 86 8.463 13.241 -11.732 1.00 0.00 C ATOM 3303 CG ASN B 86 8.816 14.019 -12.984 1.00 0.00 C ATOM 3304 OD1 ASN B 86 9.422 15.089 -12.914 1.00 0.00 O ATOM 3305 ND2 ASN B 86 8.438 13.485 -14.139 1.00 0.00 N ATOM 0 H ASN B 86 7.124 10.975 -11.438 1.00 0.00 H new ATOM 0 HA ASN B 86 9.756 11.734 -12.554 1.00 0.00 H new ATOM 0 HB2 ASN B 86 7.379 13.203 -11.624 1.00 0.00 H new ATOM 0 HB3 ASN B 86 8.852 13.766 -10.859 1.00 0.00 H new ATOM 0 HD21 ASN B 86 8.648 13.963 -15.015 1.00 0.00 H new ATOM 0 HD22 ASN B 86 7.938 12.596 -14.150 1.00 0.00 H new ATOM 3312 N ASP B 87 8.964 10.913 -9.505 1.00 0.00 N ATOM 3313 CA ASP B 87 9.508 10.561 -8.198 1.00 0.00 C ATOM 3314 C ASP B 87 10.158 9.182 -8.235 1.00 0.00 C ATOM 3315 O ASP B 87 9.539 8.205 -8.653 1.00 0.00 O ATOM 3316 CB ASP B 87 8.407 10.589 -7.138 1.00 0.00 C ATOM 3317 CG ASP B 87 8.941 10.338 -5.742 1.00 0.00 C ATOM 3318 OD1 ASP B 87 10.141 10.013 -5.616 1.00 0.00 O ATOM 3319 OD2 ASP B 87 8.161 10.465 -4.775 1.00 0.00 O ATOM 0 H ASP B 87 7.982 10.669 -9.633 1.00 0.00 H new ATOM 0 HA ASP B 87 10.269 11.297 -7.939 1.00 0.00 H new ATOM 0 HB2 ASP B 87 7.906 11.557 -7.164 1.00 0.00 H new ATOM 0 HB3 ASP B 87 7.657 9.836 -7.378 1.00 0.00 H new ATOM 3324 N ARG B 88 11.412 9.110 -7.796 1.00 0.00 N ATOM 3325 CA ARG B 88 12.141 7.846 -7.782 1.00 0.00 C ATOM 3326 C ARG B 88 13.089 7.771 -6.590 1.00 0.00 C ATOM 3327 O ARG B 88 13.744 8.753 -6.239 1.00 0.00 O ATOM 3328 CB ARG B 88 12.925 7.673 -9.084 1.00 0.00 C ATOM 3329 CG ARG B 88 14.027 8.704 -9.276 1.00 0.00 C ATOM 3330 CD ARG B 88 13.616 9.781 -10.267 1.00 0.00 C ATOM 3331 NE ARG B 88 13.588 9.283 -11.638 1.00 0.00 N ATOM 3332 CZ ARG B 88 13.422 10.063 -12.702 1.00 0.00 C ATOM 3333 NH1 ARG B 88 13.274 11.371 -12.550 1.00 0.00 N ATOM 3334 NH2 ARG B 88 13.406 9.535 -13.919 1.00 0.00 N ATOM 0 H ARG B 88 11.942 9.908 -7.447 1.00 0.00 H new ATOM 0 HA ARG B 88 11.414 7.039 -7.691 1.00 0.00 H new ATOM 0 HB2 ARG B 88 13.365 6.676 -9.103 1.00 0.00 H new ATOM 0 HB3 ARG B 88 12.234 7.732 -9.925 1.00 0.00 H new ATOM 0 HG2 ARG B 88 14.268 9.163 -8.317 1.00 0.00 H new ATOM 0 HG3 ARG B 88 14.932 8.209 -9.629 1.00 0.00 H new ATOM 0 HD2 ARG B 88 12.630 10.162 -10.000 1.00 0.00 H new ATOM 0 HD3 ARG B 88 14.310 10.619 -10.200 1.00 0.00 H new ATOM 0 HE ARG B 88 13.702 8.281 -11.789 1.00 0.00 H new ATOM 0 HH11 ARG B 88 13.287 11.781 -11.616 1.00 0.00 H new ATOM 0 HH12 ARG B 88 13.147 11.968 -13.367 1.00 0.00 H new ATOM 0 HH21 ARG B 88 13.521 8.529 -14.040 1.00 0.00 H new ATOM 0 HH22 ARG B 88 13.278 10.135 -14.734 1.00 0.00 H new ATOM 3348 N ILE B 89 13.162 6.595 -5.975 1.00 0.00 N ATOM 3349 CA ILE B 89 14.034 6.382 -4.826 1.00 0.00 C ATOM 3350 C ILE B 89 15.230 5.519 -5.212 1.00 0.00 C ATOM 3351 O ILE B 89 15.067 4.397 -5.691 1.00 0.00 O ATOM 3352 CB ILE B 89 13.277 5.707 -3.663 1.00 0.00 C ATOM 3353 CG1 ILE B 89 12.087 6.566 -3.233 1.00 0.00 C ATOM 3354 CG2 ILE B 89 14.212 5.464 -2.489 1.00 0.00 C ATOM 3355 CD1 ILE B 89 11.212 5.908 -2.189 1.00 0.00 C ATOM 0 H ILE B 89 12.626 5.773 -6.254 1.00 0.00 H new ATOM 0 HA ILE B 89 14.381 7.362 -4.497 1.00 0.00 H new ATOM 0 HB ILE B 89 12.901 4.743 -4.007 1.00 0.00 H new ATOM 0 HG12 ILE B 89 12.456 7.514 -2.841 1.00 0.00 H new ATOM 0 HG13 ILE B 89 11.481 6.798 -4.109 1.00 0.00 H new ATOM 0 HG21 ILE B 89 13.661 4.987 -1.678 1.00 0.00 H new ATOM 0 HG22 ILE B 89 15.029 4.815 -2.803 1.00 0.00 H new ATOM 0 HG23 ILE B 89 14.616 6.415 -2.143 1.00 0.00 H new ATOM 0 HD11 ILE B 89 10.389 6.574 -1.932 1.00 0.00 H new ATOM 0 HD12 ILE B 89 10.813 4.974 -2.585 1.00 0.00 H new ATOM 0 HD13 ILE B 89 11.803 5.701 -1.297 1.00 0.00 H new ATOM 3367 N THR B 90 16.431 6.049 -5.009 1.00 0.00 N ATOM 3368 CA THR B 90 17.648 5.324 -5.348 1.00 0.00 C ATOM 3369 C THR B 90 18.411 4.895 -4.097 1.00 0.00 C ATOM 3370 O THR B 90 18.847 5.731 -3.305 1.00 0.00 O ATOM 3371 CB THR B 90 18.546 6.186 -6.236 1.00 0.00 C ATOM 3372 OG1 THR B 90 17.852 6.597 -7.400 1.00 0.00 O ATOM 3373 CG2 THR B 90 19.807 5.478 -6.678 1.00 0.00 C ATOM 0 H THR B 90 16.587 6.976 -4.612 1.00 0.00 H new ATOM 0 HA THR B 90 17.358 4.425 -5.891 1.00 0.00 H new ATOM 0 HB THR B 90 18.827 7.041 -5.621 1.00 0.00 H new ATOM 0 HG1 THR B 90 17.601 5.809 -7.926 1.00 0.00 H new ATOM 0 HG21 THR B 90 20.398 6.145 -7.305 1.00 0.00 H new ATOM 0 HG22 THR B 90 20.389 5.192 -5.802 1.00 0.00 H new ATOM 0 HG23 THR B 90 19.543 4.586 -7.246 1.00 0.00 H new ATOM 3381 N ILE B 91 18.573 3.585 -3.933 1.00 0.00 N ATOM 3382 CA ILE B 91 19.291 3.036 -2.788 1.00 0.00 C ATOM 3383 C ILE B 91 20.796 3.066 -3.030 1.00 0.00 C ATOM 3384 O ILE B 91 21.251 3.048 -4.174 1.00 0.00 O ATOM 3385 CB ILE B 91 18.861 1.584 -2.500 1.00 0.00 C ATOM 3386 CG1 ILE B 91 17.350 1.427 -2.676 1.00 0.00 C ATOM 3387 CG2 ILE B 91 19.283 1.173 -1.097 1.00 0.00 C ATOM 3388 CD1 ILE B 91 16.541 2.491 -1.967 1.00 0.00 C ATOM 0 H ILE B 91 18.216 2.883 -4.581 1.00 0.00 H new ATOM 0 HA ILE B 91 19.045 3.657 -1.927 1.00 0.00 H new ATOM 0 HB ILE B 91 19.358 0.928 -3.214 1.00 0.00 H new ATOM 0 HG12 ILE B 91 17.113 1.451 -3.740 1.00 0.00 H new ATOM 0 HG13 ILE B 91 17.050 0.447 -2.305 1.00 0.00 H new ATOM 0 HG21 ILE B 91 18.972 0.145 -0.910 1.00 0.00 H new ATOM 0 HG22 ILE B 91 20.367 1.246 -1.007 1.00 0.00 H new ATOM 0 HG23 ILE B 91 18.813 1.833 -0.368 1.00 0.00 H new ATOM 0 HD11 ILE B 91 15.479 2.314 -2.137 1.00 0.00 H new ATOM 0 HD12 ILE B 91 16.748 2.453 -0.898 1.00 0.00 H new ATOM 0 HD13 ILE B 91 16.812 3.473 -2.355 1.00 0.00 H new ATOM 3400 N GLU B 92 21.564 3.111 -1.948 1.00 0.00 N ATOM 3401 CA GLU B 92 23.019 3.142 -2.048 1.00 0.00 C ATOM 3402 C GLU B 92 23.665 2.469 -0.842 1.00 0.00 C ATOM 3403 O GLU B 92 23.753 3.059 0.234 1.00 0.00 O ATOM 3404 CB GLU B 92 23.510 4.586 -2.164 1.00 0.00 C ATOM 3405 CG GLU B 92 23.636 5.072 -3.598 1.00 0.00 C ATOM 3406 CD GLU B 92 24.204 6.475 -3.692 1.00 0.00 C ATOM 3407 OE1 GLU B 92 24.159 7.202 -2.677 1.00 0.00 O ATOM 3408 OE2 GLU B 92 24.695 6.845 -4.779 1.00 0.00 O ATOM 0 H GLU B 92 21.205 3.127 -0.993 1.00 0.00 H new ATOM 0 HA GLU B 92 23.308 2.592 -2.944 1.00 0.00 H new ATOM 0 HB2 GLU B 92 22.822 5.239 -1.627 1.00 0.00 H new ATOM 0 HB3 GLU B 92 24.480 4.672 -1.674 1.00 0.00 H new ATOM 0 HG2 GLU B 92 24.276 4.387 -4.155 1.00 0.00 H new ATOM 0 HG3 GLU B 92 22.655 5.049 -4.073 1.00 0.00 H new ATOM 3415 N TRP B 93 24.116 1.233 -1.031 1.00 0.00 N ATOM 3416 CA TRP B 93 24.755 0.485 0.047 1.00 0.00 C ATOM 3417 C TRP B 93 26.166 0.057 -0.345 1.00 0.00 C ATOM 3418 O TRP B 93 26.403 -0.380 -1.472 1.00 0.00 O ATOM 3419 CB TRP B 93 23.916 -0.743 0.417 1.00 0.00 C ATOM 3420 CG TRP B 93 23.971 -1.838 -0.605 1.00 0.00 C ATOM 3421 CD1 TRP B 93 24.717 -2.980 -0.542 1.00 0.00 C ATOM 3422 CD2 TRP B 93 23.251 -1.895 -1.842 1.00 0.00 C ATOM 3423 NE1 TRP B 93 24.504 -3.744 -1.664 1.00 0.00 N ATOM 3424 CE2 TRP B 93 23.609 -3.099 -2.477 1.00 0.00 C ATOM 3425 CE3 TRP B 93 22.339 -1.046 -2.474 1.00 0.00 C ATOM 3426 CZ2 TRP B 93 23.087 -3.473 -3.713 1.00 0.00 C ATOM 3427 CZ3 TRP B 93 21.821 -1.418 -3.701 1.00 0.00 C ATOM 3428 CH2 TRP B 93 22.196 -2.623 -4.308 1.00 0.00 C ATOM 0 H TRP B 93 24.052 0.730 -1.916 1.00 0.00 H new ATOM 0 HA TRP B 93 24.825 1.140 0.915 1.00 0.00 H new ATOM 0 HB2 TRP B 93 24.261 -1.133 1.374 1.00 0.00 H new ATOM 0 HB3 TRP B 93 22.879 -0.436 0.553 1.00 0.00 H new ATOM 0 HD1 TRP B 93 25.378 -3.244 0.271 1.00 0.00 H new ATOM 0 HE1 TRP B 93 24.941 -4.645 -1.860 1.00 0.00 H new ATOM 0 HE3 TRP B 93 22.044 -0.115 -2.012 1.00 0.00 H new ATOM 0 HZ2 TRP B 93 23.375 -4.401 -4.185 1.00 0.00 H new ATOM 0 HZ3 TRP B 93 21.116 -0.769 -4.199 1.00 0.00 H new ATOM 0 HH2 TRP B 93 21.773 -2.887 -5.266 1.00 0.00 H new ATOM 3439 N THR B 94 27.100 0.186 0.592 1.00 0.00 N ATOM 3440 CA THR B 94 28.488 -0.189 0.342 1.00 0.00 C ATOM 3441 C THR B 94 29.051 -1.006 1.501 1.00 0.00 C ATOM 3442 O THR B 94 28.655 -0.825 2.652 1.00 0.00 O ATOM 3443 CB THR B 94 29.343 1.059 0.121 1.00 0.00 C ATOM 3444 OG1 THR B 94 30.721 0.749 0.232 1.00 0.00 O ATOM 3445 CG2 THR B 94 29.042 2.174 1.100 1.00 0.00 C ATOM 0 H THR B 94 26.922 0.546 1.529 1.00 0.00 H new ATOM 0 HA THR B 94 28.514 -0.804 -0.557 1.00 0.00 H new ATOM 0 HB THR B 94 29.095 1.404 -0.883 1.00 0.00 H new ATOM 0 HG1 THR B 94 31.207 1.534 0.561 1.00 0.00 H new ATOM 0 HG21 THR B 94 29.684 3.029 0.887 1.00 0.00 H new ATOM 0 HG22 THR B 94 27.998 2.471 1.003 1.00 0.00 H new ATOM 0 HG23 THR B 94 29.227 1.826 2.116 1.00 0.00 H new ATOM 3453 N ASN B 95 29.978 -1.905 1.188 1.00 0.00 N ATOM 3454 CA ASN B 95 30.597 -2.751 2.203 1.00 0.00 C ATOM 3455 C ASN B 95 31.320 -1.908 3.248 1.00 0.00 C ATOM 3456 O ASN B 95 31.906 -0.874 2.929 1.00 0.00 O ATOM 3457 CB ASN B 95 31.575 -3.730 1.552 1.00 0.00 C ATOM 3458 CG ASN B 95 30.980 -5.114 1.382 1.00 0.00 C ATOM 3459 OD1 ASN B 95 30.185 -5.565 2.205 1.00 0.00 O ATOM 3460 ND2 ASN B 95 31.363 -5.796 0.308 1.00 0.00 N ATOM 0 H ASN B 95 30.317 -2.067 0.240 1.00 0.00 H new ATOM 0 HA ASN B 95 29.808 -3.314 2.702 1.00 0.00 H new ATOM 0 HB2 ASN B 95 31.876 -3.345 0.578 1.00 0.00 H new ATOM 0 HB3 ASN B 95 32.477 -3.797 2.161 1.00 0.00 H new ATOM 0 HD21 ASN B 95 30.995 -6.732 0.141 1.00 0.00 H new ATOM 0 HD22 ASN B 95 32.025 -5.383 -0.349 1.00 0.00 H new ATOM 3467 N THR B 96 31.274 -2.358 4.498 1.00 0.00 N ATOM 3468 CA THR B 96 31.925 -1.646 5.593 1.00 0.00 C ATOM 3469 C THR B 96 33.393 -2.046 5.709 1.00 0.00 C ATOM 3470 O THR B 96 33.769 -3.168 5.370 1.00 0.00 O ATOM 3471 CB THR B 96 31.208 -1.931 6.914 1.00 0.00 C ATOM 3472 OG1 THR B 96 31.309 -3.303 7.252 1.00 0.00 O ATOM 3473 CG2 THR B 96 29.739 -1.572 6.890 1.00 0.00 C ATOM 0 H THR B 96 30.793 -3.213 4.778 1.00 0.00 H new ATOM 0 HA THR B 96 31.871 -0.579 5.377 1.00 0.00 H new ATOM 0 HB THR B 96 31.705 -1.303 7.653 1.00 0.00 H new ATOM 0 HG1 THR B 96 31.143 -3.417 8.211 1.00 0.00 H new ATOM 0 HG21 THR B 96 29.293 -1.800 7.858 1.00 0.00 H new ATOM 0 HG22 THR B 96 29.628 -0.508 6.681 1.00 0.00 H new ATOM 0 HG23 THR B 96 29.236 -2.149 6.114 1.00 0.00 H new ATOM 3481 N PRO B 97 34.246 -1.130 6.199 1.00 0.00 N ATOM 3482 CA PRO B 97 35.678 -1.394 6.368 1.00 0.00 C ATOM 3483 C PRO B 97 35.942 -2.443 7.440 1.00 0.00 C ATOM 3484 O PRO B 97 35.070 -2.750 8.251 1.00 0.00 O ATOM 3485 CB PRO B 97 36.249 -0.038 6.791 1.00 0.00 C ATOM 3486 CG PRO B 97 35.096 0.694 7.385 1.00 0.00 C ATOM 3487 CD PRO B 97 33.880 0.231 6.635 1.00 0.00 C ATOM 0 HA PRO B 97 36.130 -1.790 5.459 1.00 0.00 H new ATOM 0 HB2 PRO B 97 37.056 -0.157 7.514 1.00 0.00 H new ATOM 0 HB3 PRO B 97 36.662 0.500 5.938 1.00 0.00 H new ATOM 0 HG2 PRO B 97 35.003 0.478 8.449 1.00 0.00 H new ATOM 0 HG3 PRO B 97 35.227 1.772 7.289 1.00 0.00 H new ATOM 0 HD2 PRO B 97 32.994 0.225 7.270 1.00 0.00 H new ATOM 0 HD3 PRO B 97 33.660 0.879 5.787 1.00 0.00 H new ATOM 3495 N ASP B 98 37.150 -2.992 7.434 1.00 0.00 N ATOM 3496 CA ASP B 98 37.535 -4.014 8.404 1.00 0.00 C ATOM 3497 C ASP B 98 37.142 -3.606 9.823 1.00 0.00 C ATOM 3498 O ASP B 98 37.641 -2.616 10.357 1.00 0.00 O ATOM 3499 CB ASP B 98 39.041 -4.266 8.338 1.00 0.00 C ATOM 3500 CG ASP B 98 39.470 -4.867 7.014 1.00 0.00 C ATOM 3501 OD1 ASP B 98 38.613 -5.463 6.328 1.00 0.00 O ATOM 3502 OD2 ASP B 98 40.662 -4.742 6.663 1.00 0.00 O ATOM 0 H ASP B 98 37.883 -2.747 6.768 1.00 0.00 H new ATOM 0 HA ASP B 98 37.004 -4.931 8.151 1.00 0.00 H new ATOM 0 HB2 ASP B 98 39.571 -3.327 8.496 1.00 0.00 H new ATOM 0 HB3 ASP B 98 39.330 -4.935 9.148 1.00 0.00 H new ATOM 3507 N GLY B 99 36.248 -4.382 10.427 1.00 0.00 N ATOM 3508 CA GLY B 99 35.805 -4.092 11.778 1.00 0.00 C ATOM 3509 C GLY B 99 35.327 -2.663 11.945 1.00 0.00 C ATOM 3510 O GLY B 99 35.699 -1.986 12.903 1.00 0.00 O ATOM 0 H GLY B 99 35.822 -5.207 10.005 1.00 0.00 H new ATOM 0 HA2 GLY B 99 34.998 -4.774 12.045 1.00 0.00 H new ATOM 0 HA3 GLY B 99 36.624 -4.280 12.472 1.00 0.00 H new ATOM 3514 N ALA B 100 34.501 -2.202 11.011 1.00 0.00 N ATOM 3515 CA ALA B 100 33.972 -0.844 11.065 1.00 0.00 C ATOM 3516 C ALA B 100 33.069 -0.656 12.279 1.00 0.00 C ATOM 3517 O ALA B 100 32.433 -1.602 12.744 1.00 0.00 O ATOM 3518 CB ALA B 100 33.215 -0.521 9.786 1.00 0.00 C ATOM 0 H ALA B 100 34.184 -2.748 10.209 1.00 0.00 H new ATOM 0 HA ALA B 100 34.812 -0.156 11.159 1.00 0.00 H new ATOM 0 HB1 ALA B 100 32.826 0.496 9.840 1.00 0.00 H new ATOM 0 HB2 ALA B 100 33.888 -0.607 8.933 1.00 0.00 H new ATOM 0 HB3 ALA B 100 32.388 -1.220 9.666 1.00 0.00 H new ATOM 3524 N ALA B 101 33.015 0.571 12.786 1.00 0.00 N ATOM 3525 CA ALA B 101 32.188 0.883 13.945 1.00 0.00 C ATOM 3526 C ALA B 101 30.731 0.535 13.695 1.00 0.00 C ATOM 3527 O ALA B 101 30.315 0.320 12.555 1.00 0.00 O ATOM 3528 CB ALA B 101 32.314 2.354 14.309 1.00 0.00 C ATOM 0 H ALA B 101 33.534 1.365 12.412 1.00 0.00 H new ATOM 0 HA ALA B 101 32.545 0.277 14.778 1.00 0.00 H new ATOM 0 HB1 ALA B 101 31.690 2.569 15.176 1.00 0.00 H new ATOM 0 HB2 ALA B 101 33.353 2.583 14.544 1.00 0.00 H new ATOM 0 HB3 ALA B 101 31.989 2.966 13.468 1.00 0.00 H new ATOM 3534 N LYS B 102 29.960 0.487 14.770 1.00 0.00 N ATOM 3535 CA LYS B 102 28.539 0.172 14.679 1.00 0.00 C ATOM 3536 C LYS B 102 27.720 1.439 14.489 1.00 0.00 C ATOM 3537 O LYS B 102 27.009 1.879 15.393 1.00 0.00 O ATOM 3538 CB LYS B 102 28.075 -0.576 15.931 1.00 0.00 C ATOM 3539 CG LYS B 102 28.968 -1.745 16.310 1.00 0.00 C ATOM 3540 CD LYS B 102 28.620 -2.289 17.686 1.00 0.00 C ATOM 3541 CE LYS B 102 29.869 -2.642 18.478 1.00 0.00 C ATOM 3542 NZ LYS B 102 30.710 -1.444 18.753 1.00 0.00 N ATOM 0 H LYS B 102 30.293 0.662 15.718 1.00 0.00 H new ATOM 0 HA LYS B 102 28.387 -0.471 13.812 1.00 0.00 H new ATOM 0 HB2 LYS B 102 28.033 0.123 16.766 1.00 0.00 H new ATOM 0 HB3 LYS B 102 27.061 -0.942 15.770 1.00 0.00 H new ATOM 0 HG2 LYS B 102 28.866 -2.537 15.568 1.00 0.00 H new ATOM 0 HG3 LYS B 102 30.011 -1.427 16.296 1.00 0.00 H new ATOM 0 HD2 LYS B 102 28.037 -1.549 18.234 1.00 0.00 H new ATOM 0 HD3 LYS B 102 27.993 -3.174 17.580 1.00 0.00 H new ATOM 0 HE2 LYS B 102 29.581 -3.108 19.421 1.00 0.00 H new ATOM 0 HE3 LYS B 102 30.454 -3.377 17.925 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 31.259 -1.598 19.623 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 31.360 -1.286 17.956 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 30.099 -0.611 18.872 1.00 0.00 H new ATOM 3556 N GLN B 103 27.830 2.019 13.301 1.00 0.00 N ATOM 3557 CA GLN B 103 27.105 3.241 12.974 1.00 0.00 C ATOM 3558 C GLN B 103 27.374 3.662 11.533 1.00 0.00 C ATOM 3559 O GLN B 103 28.497 3.551 11.042 1.00 0.00 O ATOM 3560 CB GLN B 103 27.507 4.366 13.928 1.00 0.00 C ATOM 3561 CG GLN B 103 26.340 4.949 14.708 1.00 0.00 C ATOM 3562 CD GLN B 103 26.034 6.381 14.315 1.00 0.00 C ATOM 3563 OE1 GLN B 103 26.935 7.214 14.209 1.00 0.00 O ATOM 3564 NE2 GLN B 103 24.758 6.676 14.100 1.00 0.00 N ATOM 0 H GLN B 103 28.416 1.662 12.546 1.00 0.00 H new ATOM 0 HA GLN B 103 26.039 3.043 13.084 1.00 0.00 H new ATOM 0 HB2 GLN B 103 28.250 3.987 14.630 1.00 0.00 H new ATOM 0 HB3 GLN B 103 27.985 5.162 13.357 1.00 0.00 H new ATOM 0 HG2 GLN B 103 25.455 4.334 14.544 1.00 0.00 H new ATOM 0 HG3 GLN B 103 26.564 4.908 15.774 1.00 0.00 H new ATOM 0 HE21 GLN B 103 24.044 5.954 14.199 1.00 0.00 H new ATOM 0 HE22 GLN B 103 24.491 7.624 13.836 1.00 0.00 H new ATOM 3573 N PHE B 104 26.334 4.144 10.858 1.00 0.00 N ATOM 3574 CA PHE B 104 26.458 4.582 9.473 1.00 0.00 C ATOM 3575 C PHE B 104 27.477 5.711 9.348 1.00 0.00 C ATOM 3576 O PHE B 104 27.323 6.770 9.958 1.00 0.00 O ATOM 3577 CB PHE B 104 25.101 5.042 8.939 1.00 0.00 C ATOM 3578 CG PHE B 104 25.163 5.620 7.554 1.00 0.00 C ATOM 3579 CD1 PHE B 104 25.090 4.796 6.442 1.00 0.00 C ATOM 3580 CD2 PHE B 104 25.293 6.986 7.364 1.00 0.00 C ATOM 3581 CE1 PHE B 104 25.146 5.324 5.166 1.00 0.00 C ATOM 3582 CE2 PHE B 104 25.351 7.520 6.090 1.00 0.00 C ATOM 3583 CZ PHE B 104 25.276 6.687 4.990 1.00 0.00 C ATOM 0 H PHE B 104 25.397 4.241 11.248 1.00 0.00 H new ATOM 0 HA PHE B 104 26.806 3.736 8.880 1.00 0.00 H new ATOM 0 HB2 PHE B 104 24.414 4.196 8.940 1.00 0.00 H new ATOM 0 HB3 PHE B 104 24.688 5.789 9.617 1.00 0.00 H new ATOM 0 HD1 PHE B 104 24.988 3.729 6.574 1.00 0.00 H new ATOM 0 HD2 PHE B 104 25.350 7.641 8.221 1.00 0.00 H new ATOM 0 HE1 PHE B 104 25.088 4.671 4.308 1.00 0.00 H new ATOM 0 HE2 PHE B 104 25.455 8.586 5.955 1.00 0.00 H new ATOM 0 HZ PHE B 104 25.319 7.102 3.994 1.00 0.00 H new ATOM 3593 N ARG B 105 28.519 5.478 8.557 1.00 0.00 N ATOM 3594 CA ARG B 105 29.562 6.477 8.354 1.00 0.00 C ATOM 3595 C ARG B 105 29.379 7.197 7.023 1.00 0.00 C ATOM 3596 O ARG B 105 28.759 6.668 6.099 1.00 0.00 O ATOM 3597 CB ARG B 105 30.944 5.822 8.407 1.00 0.00 C ATOM 3598 CG ARG B 105 31.967 6.627 9.194 1.00 0.00 C ATOM 3599 CD ARG B 105 31.986 6.224 10.659 1.00 0.00 C ATOM 3600 NE ARG B 105 32.778 7.144 11.470 1.00 0.00 N ATOM 3601 CZ ARG B 105 32.740 7.175 12.798 1.00 0.00 C ATOM 3602 NH1 ARG B 105 31.948 6.342 13.459 1.00 0.00 N ATOM 3603 NH2 ARG B 105 33.493 8.038 13.465 1.00 0.00 N ATOM 0 H ARG B 105 28.664 4.607 8.046 1.00 0.00 H new ATOM 0 HA ARG B 105 29.484 7.211 9.156 1.00 0.00 H new ATOM 0 HB2 ARG B 105 30.851 4.832 8.853 1.00 0.00 H new ATOM 0 HB3 ARG B 105 31.309 5.680 7.390 1.00 0.00 H new ATOM 0 HG2 ARG B 105 32.957 6.480 8.762 1.00 0.00 H new ATOM 0 HG3 ARG B 105 31.737 7.689 9.111 1.00 0.00 H new ATOM 0 HD2 ARG B 105 30.965 6.193 11.039 1.00 0.00 H new ATOM 0 HD3 ARG B 105 32.392 5.217 10.753 1.00 0.00 H new ATOM 0 HE ARG B 105 33.395 7.800 10.991 1.00 0.00 H new ATOM 0 HH11 ARG B 105 31.367 5.677 12.948 1.00 0.00 H new ATOM 0 HH12 ARG B 105 31.919 6.366 14.478 1.00 0.00 H new ATOM 0 HH21 ARG B 105 34.103 8.680 12.959 1.00 0.00 H new ATOM 0 HH22 ARG B 105 33.462 8.060 14.484 1.00 0.00 H new ATOM 3617 N ARG B 106 29.921 8.406 6.934 1.00 0.00 N ATOM 3618 CA ARG B 106 29.818 9.205 5.719 1.00 0.00 C ATOM 3619 C ARG B 106 31.037 9.000 4.825 1.00 0.00 C ATOM 3620 O ARG B 106 30.959 9.156 3.607 1.00 0.00 O ATOM 3621 CB ARG B 106 29.674 10.687 6.072 1.00 0.00 C ATOM 3622 CG ARG B 106 29.018 11.512 4.977 1.00 0.00 C ATOM 3623 CD ARG B 106 29.621 12.904 4.894 1.00 0.00 C ATOM 3624 NE ARG B 106 29.309 13.562 3.628 1.00 0.00 N ATOM 3625 CZ ARG B 106 28.128 14.104 3.351 1.00 0.00 C ATOM 3626 NH1 ARG B 106 27.151 14.068 4.249 1.00 0.00 N ATOM 3627 NH2 ARG B 106 27.921 14.683 2.177 1.00 0.00 N ATOM 0 H ARG B 106 30.437 8.855 7.690 1.00 0.00 H new ATOM 0 HA ARG B 106 28.933 8.879 5.173 1.00 0.00 H new ATOM 0 HB2 ARG B 106 29.087 10.779 6.986 1.00 0.00 H new ATOM 0 HB3 ARG B 106 30.661 11.099 6.284 1.00 0.00 H new ATOM 0 HG2 ARG B 106 29.135 11.006 4.019 1.00 0.00 H new ATOM 0 HG3 ARG B 106 27.948 11.588 5.169 1.00 0.00 H new ATOM 0 HD2 ARG B 106 29.248 13.510 5.719 1.00 0.00 H new ATOM 0 HD3 ARG B 106 30.703 12.838 5.011 1.00 0.00 H new ATOM 0 HE ARG B 106 30.039 13.608 2.917 1.00 0.00 H new ATOM 0 HH11 ARG B 106 27.306 13.624 5.154 1.00 0.00 H new ATOM 0 HH12 ARG B 106 26.245 14.485 4.034 1.00 0.00 H new ATOM 0 HH21 ARG B 106 28.669 14.713 1.484 1.00 0.00 H new ATOM 0 HH22 ARG B 106 27.014 15.099 1.966 1.00 0.00 H new ATOM 3641 N GLU B 107 32.163 8.650 5.438 1.00 0.00 N ATOM 3642 CA GLU B 107 33.400 8.424 4.698 1.00 0.00 C ATOM 3643 C GLU B 107 33.278 7.218 3.768 1.00 0.00 C ATOM 3644 O GLU B 107 34.065 7.062 2.835 1.00 0.00 O ATOM 3645 CB GLU B 107 34.566 8.219 5.667 1.00 0.00 C ATOM 3646 CG GLU B 107 34.459 6.942 6.484 1.00 0.00 C ATOM 3647 CD GLU B 107 35.737 6.127 6.461 1.00 0.00 C ATOM 3648 OE1 GLU B 107 36.371 6.047 5.388 1.00 0.00 O ATOM 3649 OE2 GLU B 107 36.105 5.569 7.516 1.00 0.00 O ATOM 0 H GLU B 107 32.245 8.517 6.446 1.00 0.00 H new ATOM 0 HA GLU B 107 33.590 9.307 4.087 1.00 0.00 H new ATOM 0 HB2 GLU B 107 35.498 8.203 5.103 1.00 0.00 H new ATOM 0 HB3 GLU B 107 34.619 9.071 6.345 1.00 0.00 H new ATOM 0 HG2 GLU B 107 34.212 7.194 7.515 1.00 0.00 H new ATOM 0 HG3 GLU B 107 33.639 6.336 6.099 1.00 0.00 H new ATOM 3656 N TRP B 108 32.292 6.364 4.026 1.00 0.00 N ATOM 3657 CA TRP B 108 32.078 5.175 3.209 1.00 0.00 C ATOM 3658 C TRP B 108 31.739 5.544 1.765 1.00 0.00 C ATOM 3659 O TRP B 108 31.817 4.702 0.869 1.00 0.00 O ATOM 3660 CB TRP B 108 30.960 4.320 3.806 1.00 0.00 C ATOM 3661 CG TRP B 108 31.319 3.715 5.128 1.00 0.00 C ATOM 3662 CD1 TRP B 108 32.563 3.648 5.686 1.00 0.00 C ATOM 3663 CD2 TRP B 108 30.428 3.089 6.058 1.00 0.00 C ATOM 3664 NE1 TRP B 108 32.500 3.020 6.906 1.00 0.00 N ATOM 3665 CE2 TRP B 108 31.199 2.668 7.157 1.00 0.00 C ATOM 3666 CE3 TRP B 108 29.051 2.845 6.069 1.00 0.00 C ATOM 3667 CZ2 TRP B 108 30.640 2.017 8.254 1.00 0.00 C ATOM 3668 CZ3 TRP B 108 28.497 2.199 7.158 1.00 0.00 C ATOM 3669 CH2 TRP B 108 29.291 1.792 8.238 1.00 0.00 C ATOM 0 H TRP B 108 31.629 6.473 4.794 1.00 0.00 H new ATOM 0 HA TRP B 108 33.006 4.603 3.202 1.00 0.00 H new ATOM 0 HB2 TRP B 108 30.067 4.934 3.926 1.00 0.00 H new ATOM 0 HB3 TRP B 108 30.708 3.523 3.106 1.00 0.00 H new ATOM 0 HD1 TRP B 108 33.465 4.033 5.234 1.00 0.00 H new ATOM 0 HE1 TRP B 108 33.292 2.844 7.524 1.00 0.00 H new ATOM 0 HE3 TRP B 108 28.431 3.156 5.241 1.00 0.00 H new ATOM 0 HZ2 TRP B 108 31.250 1.701 9.087 1.00 0.00 H new ATOM 0 HZ3 TRP B 108 27.435 2.005 7.177 1.00 0.00 H new ATOM 0 HH2 TRP B 108 28.828 1.290 9.075 1.00 0.00 H new ATOM 3680 N PHE B 109 31.360 6.801 1.539 1.00 0.00 N ATOM 3681 CA PHE B 109 31.011 7.262 0.201 1.00 0.00 C ATOM 3682 C PHE B 109 31.827 8.493 -0.185 1.00 0.00 C ATOM 3683 O PHE B 109 31.273 9.502 -0.623 1.00 0.00 O ATOM 3684 CB PHE B 109 29.517 7.585 0.122 1.00 0.00 C ATOM 3685 CG PHE B 109 28.642 6.552 0.772 1.00 0.00 C ATOM 3686 CD1 PHE B 109 28.623 6.408 2.150 1.00 0.00 C ATOM 3687 CD2 PHE B 109 27.837 5.726 0.004 1.00 0.00 C ATOM 3688 CE1 PHE B 109 27.818 5.460 2.751 1.00 0.00 C ATOM 3689 CE2 PHE B 109 27.030 4.774 0.599 1.00 0.00 C ATOM 3690 CZ PHE B 109 27.020 4.641 1.975 1.00 0.00 C ATOM 0 H PHE B 109 31.288 7.515 2.264 1.00 0.00 H new ATOM 0 HA PHE B 109 31.242 6.460 -0.500 1.00 0.00 H new ATOM 0 HB2 PHE B 109 29.337 8.550 0.595 1.00 0.00 H new ATOM 0 HB3 PHE B 109 29.230 7.685 -0.925 1.00 0.00 H new ATOM 0 HD1 PHE B 109 29.245 7.045 2.762 1.00 0.00 H new ATOM 0 HD2 PHE B 109 27.840 5.827 -1.071 1.00 0.00 H new ATOM 0 HE1 PHE B 109 27.812 5.359 3.826 1.00 0.00 H new ATOM 0 HE2 PHE B 109 26.408 4.135 -0.010 1.00 0.00 H new ATOM 0 HZ PHE B 109 26.390 3.899 2.442 1.00 0.00 H new ATOM 3700 N GLN B 110 33.142 8.403 -0.024 1.00 0.00 N ATOM 3701 CA GLN B 110 34.030 9.510 -0.360 1.00 0.00 C ATOM 3702 C GLN B 110 35.222 9.025 -1.179 1.00 0.00 C ATOM 3703 O GLN B 110 36.280 9.655 -1.187 1.00 0.00 O ATOM 3704 CB GLN B 110 34.517 10.209 0.912 1.00 0.00 C ATOM 3705 CG GLN B 110 35.502 9.384 1.724 1.00 0.00 C ATOM 3706 CD GLN B 110 36.719 10.181 2.149 1.00 0.00 C ATOM 3707 OE1 GLN B 110 37.796 10.048 1.568 1.00 0.00 O ATOM 3708 NE2 GLN B 110 36.554 11.015 3.169 1.00 0.00 N ATOM 0 H GLN B 110 33.617 7.576 0.337 1.00 0.00 H new ATOM 0 HA GLN B 110 33.466 10.223 -0.962 1.00 0.00 H new ATOM 0 HB2 GLN B 110 34.986 11.154 0.639 1.00 0.00 H new ATOM 0 HB3 GLN B 110 33.656 10.449 1.536 1.00 0.00 H new ATOM 0 HG2 GLN B 110 35.000 8.994 2.610 1.00 0.00 H new ATOM 0 HG3 GLN B 110 35.823 8.525 1.135 1.00 0.00 H new ATOM 0 HE21 GLN B 110 35.643 11.093 3.621 1.00 0.00 H new ATOM 0 HE22 GLN B 110 37.338 11.577 3.500 1.00 0.00 H new ATOM 3717 N GLY B 111 35.044 7.902 -1.867 1.00 0.00 N ATOM 3718 CA GLY B 111 36.112 7.352 -2.680 1.00 0.00 C ATOM 3719 C GLY B 111 35.644 6.970 -4.071 1.00 0.00 C ATOM 3720 O GLY B 111 34.519 7.278 -4.461 1.00 0.00 O ATOM 0 H GLY B 111 34.178 7.363 -1.876 1.00 0.00 H new ATOM 0 HA2 GLY B 111 36.917 8.082 -2.759 1.00 0.00 H new ATOM 0 HA3 GLY B 111 36.526 6.473 -2.185 1.00 0.00 H new ATOM 3724 N ASP B 112 36.510 6.296 -4.820 1.00 0.00 N ATOM 3725 CA ASP B 112 36.180 5.870 -6.175 1.00 0.00 C ATOM 3726 C ASP B 112 35.894 4.372 -6.214 1.00 0.00 C ATOM 3727 O ASP B 112 36.493 3.596 -5.469 1.00 0.00 O ATOM 3728 CB ASP B 112 37.322 6.210 -7.133 1.00 0.00 C ATOM 3729 CG ASP B 112 36.993 7.388 -8.029 1.00 0.00 C ATOM 3730 OD1 ASP B 112 35.947 7.343 -8.708 1.00 0.00 O ATOM 3731 OD2 ASP B 112 37.782 8.356 -8.050 1.00 0.00 O ATOM 0 H ASP B 112 37.446 6.033 -4.512 1.00 0.00 H new ATOM 0 HA ASP B 112 35.283 6.403 -6.491 1.00 0.00 H new ATOM 0 HB2 ASP B 112 38.220 6.434 -6.558 1.00 0.00 H new ATOM 0 HB3 ASP B 112 37.547 5.340 -7.749 1.00 0.00 H new ATOM 3736 N GLY B 113 34.974 3.971 -7.085 1.00 0.00 N ATOM 3737 CA GLY B 113 34.626 2.568 -7.198 1.00 0.00 C ATOM 3738 C GLY B 113 33.869 2.063 -5.987 1.00 0.00 C ATOM 3739 O GLY B 113 33.626 2.814 -5.043 1.00 0.00 O ATOM 0 H GLY B 113 34.464 4.592 -7.713 1.00 0.00 H new ATOM 0 HA2 GLY B 113 34.020 2.417 -8.091 1.00 0.00 H new ATOM 0 HA3 GLY B 113 35.535 1.980 -7.327 1.00 0.00 H new ATOM 3743 N MET B 114 33.495 0.788 -6.010 1.00 0.00 N ATOM 3744 CA MET B 114 32.761 0.191 -4.900 1.00 0.00 C ATOM 3745 C MET B 114 31.448 0.923 -4.659 1.00 0.00 C ATOM 3746 O MET B 114 31.255 2.047 -5.123 1.00 0.00 O ATOM 3747 CB MET B 114 33.613 0.215 -3.629 1.00 0.00 C ATOM 3748 CG MET B 114 34.456 -1.036 -3.437 1.00 0.00 C ATOM 3749 SD MET B 114 34.827 -1.364 -1.704 1.00 0.00 S ATOM 3750 CE MET B 114 35.019 -3.144 -1.731 1.00 0.00 C ATOM 0 H MET B 114 33.687 0.150 -6.782 1.00 0.00 H new ATOM 0 HA MET B 114 32.535 -0.843 -5.160 1.00 0.00 H new ATOM 0 HB2 MET B 114 34.270 1.084 -3.658 1.00 0.00 H new ATOM 0 HB3 MET B 114 32.959 0.338 -2.766 1.00 0.00 H new ATOM 0 HG2 MET B 114 33.931 -1.892 -3.860 1.00 0.00 H new ATOM 0 HG3 MET B 114 35.389 -0.929 -3.990 1.00 0.00 H new ATOM 0 HE1 MET B 114 35.004 -3.527 -0.711 1.00 0.00 H new ATOM 0 HE2 MET B 114 34.202 -3.590 -2.298 1.00 0.00 H new ATOM 0 HE3 MET B 114 35.969 -3.400 -2.201 1.00 0.00 H new ATOM 3760 N VAL B 115 30.549 0.273 -3.929 1.00 0.00 N ATOM 3761 CA VAL B 115 29.241 0.848 -3.613 1.00 0.00 C ATOM 3762 C VAL B 115 28.264 0.659 -4.769 1.00 0.00 C ATOM 3763 O VAL B 115 28.480 1.169 -5.868 1.00 0.00 O ATOM 3764 CB VAL B 115 29.339 2.351 -3.280 1.00 0.00 C ATOM 3765 CG1 VAL B 115 28.086 2.823 -2.556 1.00 0.00 C ATOM 3766 CG2 VAL B 115 30.583 2.634 -2.450 1.00 0.00 C ATOM 0 H VAL B 115 30.701 -0.658 -3.542 1.00 0.00 H new ATOM 0 HA VAL B 115 28.874 0.318 -2.734 1.00 0.00 H new ATOM 0 HB VAL B 115 29.420 2.906 -4.215 1.00 0.00 H new ATOM 0 HG11 VAL B 115 28.175 3.886 -2.330 1.00 0.00 H new ATOM 0 HG12 VAL B 115 27.215 2.659 -3.191 1.00 0.00 H new ATOM 0 HG13 VAL B 115 27.969 2.263 -1.628 1.00 0.00 H new ATOM 0 HG21 VAL B 115 30.635 3.699 -2.225 1.00 0.00 H new ATOM 0 HG22 VAL B 115 30.536 2.068 -1.520 1.00 0.00 H new ATOM 0 HG23 VAL B 115 31.470 2.338 -3.011 1.00 0.00 H new ATOM 3776 N ARG B 116 27.187 -0.076 -4.511 1.00 0.00 N ATOM 3777 CA ARG B 116 26.173 -0.332 -5.528 1.00 0.00 C ATOM 3778 C ARG B 116 24.939 0.531 -5.293 1.00 0.00 C ATOM 3779 O ARG B 116 24.600 0.850 -4.151 1.00 0.00 O ATOM 3780 CB ARG B 116 25.783 -1.811 -5.530 1.00 0.00 C ATOM 3781 CG ARG B 116 26.025 -2.502 -6.862 1.00 0.00 C ATOM 3782 CD ARG B 116 25.353 -3.864 -6.914 1.00 0.00 C ATOM 3783 NE ARG B 116 25.858 -4.681 -8.015 1.00 0.00 N ATOM 3784 CZ ARG B 116 27.033 -5.301 -7.992 1.00 0.00 C ATOM 3785 NH1 ARG B 116 27.819 -5.197 -6.929 1.00 0.00 N ATOM 3786 NH2 ARG B 116 27.422 -6.024 -9.033 1.00 0.00 N ATOM 0 H ARG B 116 26.994 -0.505 -3.606 1.00 0.00 H new ATOM 0 HA ARG B 116 26.595 -0.075 -6.499 1.00 0.00 H new ATOM 0 HB2 ARG B 116 26.347 -2.328 -4.754 1.00 0.00 H new ATOM 0 HB3 ARG B 116 24.728 -1.900 -5.270 1.00 0.00 H new ATOM 0 HG2 ARG B 116 25.646 -1.877 -7.671 1.00 0.00 H new ATOM 0 HG3 ARG B 116 27.097 -2.618 -7.023 1.00 0.00 H new ATOM 0 HD2 ARG B 116 25.517 -4.385 -5.971 1.00 0.00 H new ATOM 0 HD3 ARG B 116 24.276 -3.733 -7.023 1.00 0.00 H new ATOM 0 HE ARG B 116 25.277 -4.781 -8.847 1.00 0.00 H new ATOM 0 HH11 ARG B 116 27.522 -4.640 -6.128 1.00 0.00 H new ATOM 0 HH12 ARG B 116 28.721 -5.674 -6.913 1.00 0.00 H new ATOM 0 HH21 ARG B 116 26.819 -6.104 -9.852 1.00 0.00 H new ATOM 0 HH22 ARG B 116 28.324 -6.500 -9.015 1.00 0.00 H new ATOM 3800 N ARG B 117 24.270 0.909 -6.378 1.00 0.00 N ATOM 3801 CA ARG B 117 23.073 1.738 -6.284 1.00 0.00 C ATOM 3802 C ARG B 117 21.951 1.188 -7.159 1.00 0.00 C ATOM 3803 O ARG B 117 22.184 0.742 -8.283 1.00 0.00 O ATOM 3804 CB ARG B 117 23.394 3.178 -6.691 1.00 0.00 C ATOM 3805 CG ARG B 117 24.038 3.295 -8.063 1.00 0.00 C ATOM 3806 CD ARG B 117 24.453 4.727 -8.360 1.00 0.00 C ATOM 3807 NE ARG B 117 25.512 5.185 -7.467 1.00 0.00 N ATOM 3808 CZ ARG B 117 26.165 6.331 -7.626 1.00 0.00 C ATOM 3809 NH1 ARG B 117 25.866 7.133 -8.639 1.00 0.00 N ATOM 3810 NH2 ARG B 117 27.118 6.677 -6.771 1.00 0.00 N ATOM 0 H ARG B 117 24.535 0.655 -7.330 1.00 0.00 H new ATOM 0 HA ARG B 117 22.735 1.724 -5.248 1.00 0.00 H new ATOM 0 HB2 ARG B 117 22.474 3.763 -6.680 1.00 0.00 H new ATOM 0 HB3 ARG B 117 24.060 3.617 -5.948 1.00 0.00 H new ATOM 0 HG2 ARG B 117 24.910 2.644 -8.114 1.00 0.00 H new ATOM 0 HG3 ARG B 117 23.339 2.952 -8.825 1.00 0.00 H new ATOM 0 HD2 ARG B 117 24.793 4.799 -9.393 1.00 0.00 H new ATOM 0 HD3 ARG B 117 23.588 5.383 -8.263 1.00 0.00 H new ATOM 0 HE ARG B 117 25.765 4.592 -6.676 1.00 0.00 H new ATOM 0 HH11 ARG B 117 25.133 6.871 -9.298 1.00 0.00 H new ATOM 0 HH12 ARG B 117 26.369 8.012 -8.759 1.00 0.00 H new ATOM 0 HH21 ARG B 117 27.350 6.063 -5.990 1.00 0.00 H new ATOM 0 HH22 ARG B 117 27.619 7.557 -6.894 1.00 0.00 H new ATOM 3824 N LYS B 118 20.732 1.230 -6.632 1.00 0.00 N ATOM 3825 CA LYS B 118 19.562 0.744 -7.355 1.00 0.00 C ATOM 3826 C LYS B 118 18.494 1.824 -7.432 1.00 0.00 C ATOM 3827 O LYS B 118 18.567 2.834 -6.737 1.00 0.00 O ATOM 3828 CB LYS B 118 18.996 -0.504 -6.673 1.00 0.00 C ATOM 3829 CG LYS B 118 19.761 -1.775 -7.001 1.00 0.00 C ATOM 3830 CD LYS B 118 19.226 -2.964 -6.218 1.00 0.00 C ATOM 3831 CE LYS B 118 17.859 -3.395 -6.724 1.00 0.00 C ATOM 3832 NZ LYS B 118 17.959 -4.235 -7.950 1.00 0.00 N ATOM 0 H LYS B 118 20.528 1.597 -5.703 1.00 0.00 H new ATOM 0 HA LYS B 118 19.869 0.485 -8.368 1.00 0.00 H new ATOM 0 HB2 LYS B 118 19.004 -0.353 -5.593 1.00 0.00 H new ATOM 0 HB3 LYS B 118 17.955 -0.630 -6.970 1.00 0.00 H new ATOM 0 HG2 LYS B 118 19.689 -1.979 -8.069 1.00 0.00 H new ATOM 0 HG3 LYS B 118 20.818 -1.634 -6.774 1.00 0.00 H new ATOM 0 HD2 LYS B 118 19.924 -3.797 -6.298 1.00 0.00 H new ATOM 0 HD3 LYS B 118 19.159 -2.705 -5.161 1.00 0.00 H new ATOM 0 HE2 LYS B 118 17.342 -3.953 -5.943 1.00 0.00 H new ATOM 0 HE3 LYS B 118 17.256 -2.512 -6.937 1.00 0.00 H new ATOM 0 HZ1 LYS B 118 17.005 -4.508 -8.263 1.00 0.00 H new ATOM 0 HZ2 LYS B 118 18.429 -3.694 -8.704 1.00 0.00 H new ATOM 0 HZ3 LYS B 118 18.513 -5.090 -7.741 1.00 0.00 H new ATOM 3846 N ASN B 119 17.508 1.603 -8.288 1.00 0.00 N ATOM 3847 CA ASN B 119 16.421 2.561 -8.461 1.00 0.00 C ATOM 3848 C ASN B 119 15.070 1.916 -8.170 1.00 0.00 C ATOM 3849 O ASN B 119 14.895 0.709 -8.342 1.00 0.00 O ATOM 3850 CB ASN B 119 16.434 3.128 -9.882 1.00 0.00 C ATOM 3851 CG ASN B 119 17.352 4.328 -10.017 1.00 0.00 C ATOM 3852 OD1 ASN B 119 16.964 5.457 -9.716 1.00 0.00 O ATOM 3853 ND2 ASN B 119 18.576 4.088 -10.470 1.00 0.00 N ATOM 0 H ASN B 119 17.436 0.771 -8.874 1.00 0.00 H new ATOM 0 HA ASN B 119 16.573 3.374 -7.751 1.00 0.00 H new ATOM 0 HB2 ASN B 119 16.751 2.351 -10.577 1.00 0.00 H new ATOM 0 HB3 ASN B 119 15.421 3.415 -10.165 1.00 0.00 H new ATOM 0 HD21 ASN B 119 19.238 4.856 -10.581 1.00 0.00 H new ATOM 0 HD22 ASN B 119 18.854 3.136 -10.707 1.00 0.00 H new ATOM 3860 N LEU B 120 14.117 2.730 -7.727 1.00 0.00 N ATOM 3861 CA LEU B 120 12.778 2.245 -7.411 1.00 0.00 C ATOM 3862 C LEU B 120 11.719 3.250 -7.853 1.00 0.00 C ATOM 3863 O LEU B 120 11.318 4.123 -7.082 1.00 0.00 O ATOM 3864 CB LEU B 120 12.652 1.979 -5.909 1.00 0.00 C ATOM 3865 CG LEU B 120 13.241 0.650 -5.435 1.00 0.00 C ATOM 3866 CD1 LEU B 120 14.677 0.836 -4.975 1.00 0.00 C ATOM 3867 CD2 LEU B 120 12.393 0.063 -4.316 1.00 0.00 C ATOM 0 H LEU B 120 14.248 3.731 -7.578 1.00 0.00 H new ATOM 0 HA LEU B 120 12.617 1.313 -7.953 1.00 0.00 H new ATOM 0 HB2 LEU B 120 13.143 2.789 -5.370 1.00 0.00 H new ATOM 0 HB3 LEU B 120 11.597 2.009 -5.638 1.00 0.00 H new ATOM 0 HG LEU B 120 13.238 -0.047 -6.273 1.00 0.00 H new ATOM 0 HD11 LEU B 120 15.079 -0.121 -4.641 1.00 0.00 H new ATOM 0 HD12 LEU B 120 15.278 1.214 -5.802 1.00 0.00 H new ATOM 0 HD13 LEU B 120 14.706 1.549 -4.151 1.00 0.00 H new ATOM 0 HD21 LEU B 120 12.825 -0.883 -3.990 1.00 0.00 H new ATOM 0 HD22 LEU B 120 12.366 0.758 -3.477 1.00 0.00 H new ATOM 0 HD23 LEU B 120 11.379 -0.108 -4.679 1.00 0.00 H new ATOM 3879 N PRO B 121 11.252 3.144 -9.109 1.00 0.00 N ATOM 3880 CA PRO B 121 10.237 4.052 -9.655 1.00 0.00 C ATOM 3881 C PRO B 121 9.003 4.155 -8.765 1.00 0.00 C ATOM 3882 O PRO B 121 8.554 3.163 -8.190 1.00 0.00 O ATOM 3883 CB PRO B 121 9.875 3.414 -10.998 1.00 0.00 C ATOM 3884 CG PRO B 121 11.081 2.631 -11.383 1.00 0.00 C ATOM 3885 CD PRO B 121 11.679 2.135 -10.096 1.00 0.00 C ATOM 0 HA PRO B 121 10.610 5.073 -9.737 1.00 0.00 H new ATOM 0 HB2 PRO B 121 8.999 2.772 -10.908 1.00 0.00 H new ATOM 0 HB3 PRO B 121 9.640 4.172 -11.745 1.00 0.00 H new ATOM 0 HG2 PRO B 121 10.815 1.800 -12.036 1.00 0.00 H new ATOM 0 HG3 PRO B 121 11.791 3.251 -11.930 1.00 0.00 H new ATOM 0 HD2 PRO B 121 11.312 1.141 -9.839 1.00 0.00 H new ATOM 0 HD3 PRO B 121 12.765 2.068 -10.157 1.00 0.00 H new ATOM 3893 N ILE B 122 8.456 5.362 -8.662 1.00 0.00 N ATOM 3894 CA ILE B 122 7.270 5.603 -7.848 1.00 0.00 C ATOM 3895 C ILE B 122 6.046 5.830 -8.730 1.00 0.00 C ATOM 3896 O ILE B 122 6.124 6.517 -9.749 1.00 0.00 O ATOM 3897 CB ILE B 122 7.458 6.821 -6.925 1.00 0.00 C ATOM 3898 CG1 ILE B 122 8.844 6.788 -6.277 1.00 0.00 C ATOM 3899 CG2 ILE B 122 6.370 6.855 -5.862 1.00 0.00 C ATOM 3900 CD1 ILE B 122 8.986 5.730 -5.205 1.00 0.00 C ATOM 0 H ILE B 122 8.817 6.191 -9.134 1.00 0.00 H new ATOM 0 HA ILE B 122 7.118 4.716 -7.233 1.00 0.00 H new ATOM 0 HB ILE B 122 7.379 7.728 -7.525 1.00 0.00 H new ATOM 0 HG12 ILE B 122 9.593 6.614 -7.049 1.00 0.00 H new ATOM 0 HG13 ILE B 122 9.056 7.765 -5.842 1.00 0.00 H new ATOM 0 HG21 ILE B 122 6.518 7.722 -5.218 1.00 0.00 H new ATOM 0 HG22 ILE B 122 5.394 6.922 -6.342 1.00 0.00 H new ATOM 0 HG23 ILE B 122 6.418 5.946 -5.263 1.00 0.00 H new ATOM 0 HD11 ILE B 122 9.993 5.765 -4.790 1.00 0.00 H new ATOM 0 HD12 ILE B 122 8.261 5.915 -4.413 1.00 0.00 H new ATOM 0 HD13 ILE B 122 8.806 4.746 -5.639 1.00 0.00 H new ATOM 3912 N GLU B 123 4.917 5.249 -8.337 1.00 0.00 N ATOM 3913 CA GLU B 123 3.681 5.390 -9.100 1.00 0.00 C ATOM 3914 C GLU B 123 2.515 5.767 -8.197 1.00 0.00 C ATOM 3915 O GLU B 123 2.557 5.555 -6.987 1.00 0.00 O ATOM 3916 CB GLU B 123 3.368 4.090 -9.844 1.00 0.00 C ATOM 3917 CG GLU B 123 4.297 3.823 -11.017 1.00 0.00 C ATOM 3918 CD GLU B 123 3.598 3.954 -12.356 1.00 0.00 C ATOM 3919 OE1 GLU B 123 3.555 5.080 -12.896 1.00 0.00 O ATOM 3920 OE2 GLU B 123 3.094 2.932 -12.865 1.00 0.00 O ATOM 0 H GLU B 123 4.832 4.677 -7.497 1.00 0.00 H new ATOM 0 HA GLU B 123 3.823 6.193 -9.824 1.00 0.00 H new ATOM 0 HB2 GLU B 123 3.430 3.256 -9.144 1.00 0.00 H new ATOM 0 HB3 GLU B 123 2.340 4.126 -10.206 1.00 0.00 H new ATOM 0 HG2 GLU B 123 5.134 4.520 -10.979 1.00 0.00 H new ATOM 0 HG3 GLU B 123 4.713 2.820 -10.925 1.00 0.00 H new ATOM 3927 N TYR B 124 1.475 6.332 -8.796 1.00 0.00 N ATOM 3928 CA TYR B 124 0.295 6.746 -8.048 1.00 0.00 C ATOM 3929 C TYR B 124 -0.963 6.073 -8.590 1.00 0.00 C ATOM 3930 O TYR B 124 -1.390 6.343 -9.713 1.00 0.00 O ATOM 3931 CB TYR B 124 0.141 8.267 -8.107 1.00 0.00 C ATOM 3932 CG TYR B 124 1.253 9.015 -7.404 1.00 0.00 C ATOM 3933 CD1 TYR B 124 1.207 9.241 -6.034 1.00 0.00 C ATOM 3934 CD2 TYR B 124 2.349 9.494 -8.112 1.00 0.00 C ATOM 3935 CE1 TYR B 124 2.222 9.924 -5.389 1.00 0.00 C ATOM 3936 CE2 TYR B 124 3.367 10.177 -7.474 1.00 0.00 C ATOM 3937 CZ TYR B 124 3.299 10.390 -6.114 1.00 0.00 C ATOM 3938 OH TYR B 124 4.311 11.069 -5.475 1.00 0.00 O ATOM 0 H TYR B 124 1.424 6.514 -9.798 1.00 0.00 H new ATOM 0 HA TYR B 124 0.427 6.438 -7.011 1.00 0.00 H new ATOM 0 HB2 TYR B 124 0.106 8.580 -9.150 1.00 0.00 H new ATOM 0 HB3 TYR B 124 -0.813 8.545 -7.659 1.00 0.00 H new ATOM 0 HD1 TYR B 124 0.365 8.877 -5.464 1.00 0.00 H new ATOM 0 HD2 TYR B 124 2.406 9.330 -9.178 1.00 0.00 H new ATOM 0 HE1 TYR B 124 2.172 10.092 -4.323 1.00 0.00 H new ATOM 0 HE2 TYR B 124 4.212 10.542 -8.039 1.00 0.00 H new ATOM 0 HH TYR B 124 4.994 11.328 -6.128 1.00 0.00 H new ATOM 3948 N ASN B 125 -1.556 5.199 -7.781 1.00 0.00 N ATOM 3949 CA ASN B 125 -2.769 4.490 -8.178 1.00 0.00 C ATOM 3950 C ASN B 125 -4.010 5.211 -7.667 1.00 0.00 C ATOM 3951 O ASN B 125 -4.479 4.951 -6.558 1.00 0.00 O ATOM 3952 CB ASN B 125 -2.745 3.054 -7.650 1.00 0.00 C ATOM 3953 CG ASN B 125 -3.884 2.218 -8.202 1.00 0.00 C ATOM 3954 OD1 ASN B 125 -4.412 2.501 -9.277 1.00 0.00 O ATOM 3955 ND2 ASN B 125 -4.271 1.181 -7.465 1.00 0.00 N ATOM 0 H ASN B 125 -1.217 4.965 -6.848 1.00 0.00 H new ATOM 0 HA ASN B 125 -2.806 4.467 -9.267 1.00 0.00 H new ATOM 0 HB2 ASN B 125 -1.795 2.589 -7.913 1.00 0.00 H new ATOM 0 HB3 ASN B 125 -2.802 3.069 -6.562 1.00 0.00 H new ATOM 0 HD21 ASN B 125 -5.034 0.584 -7.785 1.00 0.00 H new ATOM 0 HD22 ASN B 125 -3.805 0.983 -6.580 1.00 0.00 H new ATOM 3962 N LEU B 126 -4.538 6.118 -8.482 1.00 0.00 N ATOM 3963 CA LEU B 126 -5.726 6.878 -8.113 1.00 0.00 C ATOM 3964 C LEU B 126 -6.969 5.993 -8.130 1.00 0.00 C ATOM 3965 O LEU B 126 -7.872 6.227 -7.299 1.00 0.00 O ATOM 3966 CB LEU B 126 -5.914 8.059 -9.065 1.00 0.00 C ATOM 3967 CG LEU B 126 -4.750 9.050 -9.104 1.00 0.00 C ATOM 3968 CD1 LEU B 126 -4.696 9.760 -10.448 1.00 0.00 C ATOM 3969 CD2 LEU B 126 -4.871 10.057 -7.971 1.00 0.00 C ATOM 3970 OXT LEU B 126 -7.028 5.075 -8.974 1.00 0.00 O ATOM 0 H LEU B 126 -4.162 6.345 -9.403 1.00 0.00 H new ATOM 0 HA LEU B 126 -5.586 7.254 -7.099 1.00 0.00 H new ATOM 0 HB2 LEU B 126 -6.076 7.673 -10.071 1.00 0.00 H new ATOM 0 HB3 LEU B 126 -6.819 8.596 -8.780 1.00 0.00 H new ATOM 0 HG LEU B 126 -3.821 8.495 -8.974 1.00 0.00 H new ATOM 0 HD11 LEU B 126 -3.861 10.461 -10.456 1.00 0.00 H new ATOM 0 HD12 LEU B 126 -4.561 9.026 -11.242 1.00 0.00 H new ATOM 0 HD13 LEU B 126 -5.627 10.303 -10.610 1.00 0.00 H new ATOM 0 HD21 LEU B 126 -4.035 10.755 -8.014 1.00 0.00 H new ATOM 0 HD22 LEU B 126 -5.807 10.606 -8.071 1.00 0.00 H new ATOM 0 HD23 LEU B 126 -4.858 9.533 -7.015 1.00 0.00 H new TER 3982 LEU B 126