USER MOD reduce.3.24.130724 H: found=0, std=0, add=1706, rem=0, adj=62 USER MOD reduce.3.24.130724 removed 1707 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 73 THR OG1 : rot 24:sc= -0.204! USER MOD Set 1.2: B 71 GLN : amide:sc= -3.72! C(o=-3.9!,f=-9.1!) USER MOD Set 2.1: B 55 CYS SG : rot 180:sc= 1.07 USER MOD Set 2.2: B 69 THR OG1 : rot 18:sc= -1.88 USER MOD Set 3.1: B 9 ASN : amide:sc= -5.38 K(o=-6.1,f=-7.1!) USER MOD Set 3.2: B 14 SER OG : rot 75:sc= -0.693 USER MOD Set 4.1: B 1 MET CE :methyl -120:sc= -0.289 (180deg=-1.98) USER MOD Set 4.2: B 5 THR OG1 : rot 126:sc= 1.93 USER MOD Set 4.3: B 7 TYR OH : rot -31:sc= 0.319 USER MOD Set 5.1: A 55 CYS SG : rot 180:sc= 1.04 USER MOD Set 5.2: A 69 THR OG1 : rot 62:sc= 1.36 USER MOD Set 6.1: A 25 GLN : amide:sc= -6.87! C(o=-6.3!,f=-14!) USER MOD Set 6.2: A 26 SER OG : rot 64:sc= 0.531 USER MOD Set 7.1: A 9 ASN : amide:sc= -1.76 K(o=-2.1,f=-5.1!) USER MOD Set 7.2: A 14 SER OG : rot 140:sc= -0.334 USER MOD Set 8.1: A 5 THR OG1 : rot 131:sc= 2.07 USER MOD Set 8.2: A 7 TYR OH : rot -52:sc= 1.33 USER MOD Single : A 2 SER OG : rot -29:sc= -5.48! USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=-0.0024) USER MOD Single : A 8 LYS NZ :NH3+ 171:sc= 1.27 (180deg=1.1) USER MOD Single : A 10 LYS NZ :NH3+ -93:sc= -0.791 (180deg=-1.98!) USER MOD Single : A 12 LYS NZ :NH3+ -156:sc= -0.0593 (180deg=-0.382) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 77:sc= -2.14! USER MOD Single : A 31 ASN : amide:sc= -1.43 K(o=-1.4,f=-8!) USER MOD Single : A 33 ASN :FLIP amide:sc= 0.617 F(o=-0.19,f=0.62) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot -174:sc= -3.71! USER MOD Single : A 48 LYS NZ :NH3+ -113:sc= -1.89 (180deg=-3.77!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot -106:sc= 1.25 USER MOD Single : A 53 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 57 THR OG1 : rot -80:sc= -9.16! USER MOD Single : A 59 HIS : no HD1:sc= -0.875 K(o=-0.87,f=-2.6) USER MOD Single : A 67 MET CE :methyl -129:sc= -10.3! (180deg=-12.4!) USER MOD Single : A 70 GLN : amide:sc= -0.0167 X(o=-0.017,f=-0.25) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 MET CE :methyl 138:sc= -6.29 (180deg=-11.2!) USER MOD Single : A 74 SER OG : rot 106:sc= -1.56! USER MOD Single : A 78 LYS NZ :NH3+ 146:sc= -0.945 (180deg=-2.25!) USER MOD Single : A 81 SER OG : rot 92:sc= -5.59! USER MOD Single : A 85 ASN : amide:sc= -0.0983 X(o=-0.098,f=-0.091) USER MOD Single : A 88 SER OG : rot -29:sc= 0.451 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 THR OG1 : rot -15:sc= -1.63 USER MOD Single : B 1 MET N :NH3+ -120:sc= 1.37 (180deg=-0.386) USER MOD Single : B 2 SER OG : rot 176:sc= -1.7! USER MOD Single : B 3 GLN : amide:sc= -0.699 X(o=-0.7,f=-0.61) USER MOD Single : B 8 LYS NZ :NH3+ 156:sc= -3.13! (180deg=-4!) USER MOD Single : B 10 LYS NZ :NH3+ -139:sc= -1.11 (180deg=-4.15!) USER MOD Single : B 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 13 SER OG : rot 180:sc= 0 USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 TYR OH : rot 180:sc= 0 USER MOD Single : B 20 TYR OH : rot 89:sc= -1.39! USER MOD Single : B 25 GLN : amide:sc= -11.5! C(o=-12!,f=-14!) USER MOD Single : B 26 SER OG : rot 140:sc= -0.518 USER MOD Single : B 31 ASN : amide:sc= -9.61! C(o=-9.6!,f=-16!) USER MOD Single : B 33 ASN :FLIP amide:sc= 0 F(o=-0.7,f=0) USER MOD Single : B 34 THR OG1 : rot -166:sc=-0.00153 USER MOD Single : B 41 THR OG1 : rot 180:sc= -3.33! USER MOD Single : B 48 LYS NZ :NH3+ -127:sc= -2.1 (180deg=-5.86!) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 SER OG : rot 54:sc= 0.282 USER MOD Single : B 53 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 57 THR OG1 : rot -35:sc= 0.397 USER MOD Single : B 59 HIS : no HD1:sc= -3.04 K(o=-3,f=-4!) USER MOD Single : B 67 MET CE :methyl 144:sc= -5.73! (180deg=-12.8!) USER MOD Single : B 70 GLN :FLIP amide:sc= -0.0343 F(o=-0.86,f=-0.034) USER MOD Single : B 72 MET CE :methyl -143:sc= -8.8! (180deg=-14.2!) USER MOD Single : B 73 THR OG1 : rot 180:sc= 0 USER MOD Single : B 74 SER OG : rot 62:sc= 0.821 USER MOD Single : B 78 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.12) USER MOD Single : B 81 SER OG : rot 69:sc= -3.34! USER MOD Single : B 85 ASN :FLIP amide:sc= -3.39! C(o=-4.7!,f=-3.4!) USER MOD Single : B 88 SER OG : rot -30:sc= 0.156 USER MOD Single : B 89 THR OG1 : rot 180:sc= 0.00293 USER MOD Single : B 92 ASN :FLIP amide:sc= -1.53! C(o=-2.7!,f=-1.5!) USER MOD Single : B 103 THR OG1 : rot 82:sc= -4.47! USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 2 3.462 8.201 14.139 1.00 0.00 N ATOM 21 CA SER A 2 3.167 7.889 12.746 1.00 0.00 C ATOM 22 C SER A 2 1.744 8.322 12.380 1.00 0.00 C ATOM 23 O SER A 2 0.780 7.648 12.735 1.00 0.00 O ATOM 24 CB SER A 2 3.346 6.380 12.486 1.00 0.00 C ATOM 25 OG SER A 2 4.516 6.134 11.725 1.00 0.00 O ATOM 0 HA SER A 2 3.866 8.441 12.118 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.406 5.848 13.435 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.475 5.992 11.958 1.00 0.00 H new ATOM 0 HG SER A 2 4.701 6.906 11.150 1.00 0.00 H new ATOM 31 N GLN A 3 1.604 9.444 11.665 1.00 0.00 N ATOM 32 CA GLN A 3 0.271 9.906 11.274 1.00 0.00 C ATOM 33 C GLN A 3 0.283 11.151 10.386 1.00 0.00 C ATOM 34 O GLN A 3 -0.443 11.195 9.392 1.00 0.00 O ATOM 35 CB GLN A 3 -0.595 10.165 12.505 1.00 0.00 C ATOM 36 CG GLN A 3 -0.149 11.364 13.328 1.00 0.00 C ATOM 37 CD GLN A 3 -0.767 11.384 14.712 1.00 0.00 C ATOM 38 OE1 GLN A 3 -0.535 10.485 15.521 1.00 0.00 O ATOM 39 NE2 GLN A 3 -1.560 12.412 14.991 1.00 0.00 N ATOM 0 H GLN A 3 2.375 10.034 11.353 1.00 0.00 H new ATOM 0 HA GLN A 3 -0.154 9.098 10.678 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -1.626 10.318 12.187 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -0.585 9.278 13.138 1.00 0.00 H new ATOM 0 HG2 GLN A 3 0.937 11.353 13.419 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -0.416 12.281 12.802 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -1.724 13.134 14.290 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -2.005 12.479 15.906 1.00 0.00 H new ATOM 48 N PHE A 4 1.061 12.179 10.731 1.00 0.00 N ATOM 49 CA PHE A 4 1.059 13.387 9.906 1.00 0.00 C ATOM 50 C PHE A 4 2.381 14.149 9.912 1.00 0.00 C ATOM 51 O PHE A 4 2.427 15.341 10.216 1.00 0.00 O ATOM 52 CB PHE A 4 -0.093 14.303 10.317 1.00 0.00 C ATOM 53 CG PHE A 4 -1.405 13.846 9.752 1.00 0.00 C ATOM 54 CD1 PHE A 4 -1.505 13.498 8.415 1.00 0.00 C ATOM 55 CD2 PHE A 4 -2.528 13.742 10.555 1.00 0.00 C ATOM 56 CE1 PHE A 4 -2.699 13.055 7.886 1.00 0.00 C ATOM 57 CE2 PHE A 4 -3.727 13.297 10.034 1.00 0.00 C ATOM 58 CZ PHE A 4 -3.813 12.952 8.698 1.00 0.00 C ATOM 0 H PHE A 4 1.678 12.202 11.543 1.00 0.00 H new ATOM 0 HA PHE A 4 0.919 13.052 8.878 1.00 0.00 H new ATOM 0 HB2 PHE A 4 -0.159 14.337 11.404 1.00 0.00 H new ATOM 0 HB3 PHE A 4 0.113 15.318 9.979 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -0.636 13.575 7.778 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -2.466 14.012 11.599 1.00 0.00 H new ATOM 0 HE1 PHE A 4 -2.764 12.789 6.841 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -4.597 13.219 10.670 1.00 0.00 H new ATOM 0 HZ PHE A 4 -4.749 12.602 8.289 1.00 0.00 H new ATOM 68 N THR A 5 3.438 13.461 9.514 1.00 0.00 N ATOM 69 CA THR A 5 4.755 14.058 9.401 1.00 0.00 C ATOM 70 C THR A 5 5.221 13.927 7.959 1.00 0.00 C ATOM 71 O THR A 5 4.728 13.075 7.220 1.00 0.00 O ATOM 72 CB THR A 5 5.752 13.353 10.320 1.00 0.00 C ATOM 73 OG1 THR A 5 5.104 12.846 11.473 1.00 0.00 O ATOM 74 CG2 THR A 5 6.890 14.240 10.782 1.00 0.00 C ATOM 0 H THR A 5 3.406 12.474 9.261 1.00 0.00 H new ATOM 0 HA THR A 5 4.700 15.106 9.695 1.00 0.00 H new ATOM 0 HB THR A 5 6.171 12.549 9.715 1.00 0.00 H new ATOM 0 HG1 THR A 5 5.361 11.910 11.608 1.00 0.00 H new ATOM 0 HG21 THR A 5 7.556 13.670 11.430 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.446 14.599 9.916 1.00 0.00 H new ATOM 0 HG23 THR A 5 6.488 15.090 11.333 1.00 0.00 H new ATOM 82 N LEU A 6 6.187 14.734 7.566 1.00 0.00 N ATOM 83 CA LEU A 6 6.725 14.650 6.220 1.00 0.00 C ATOM 84 C LEU A 6 7.918 13.724 6.259 1.00 0.00 C ATOM 85 O LEU A 6 9.060 14.173 6.359 1.00 0.00 O ATOM 86 CB LEU A 6 7.143 16.026 5.706 1.00 0.00 C ATOM 87 CG LEU A 6 7.181 16.161 4.185 1.00 0.00 C ATOM 88 CD1 LEU A 6 7.800 17.488 3.783 1.00 0.00 C ATOM 89 CD2 LEU A 6 7.946 15.004 3.562 1.00 0.00 C ATOM 0 H LEU A 6 6.614 15.451 8.153 1.00 0.00 H new ATOM 0 HA LEU A 6 5.962 14.269 5.541 1.00 0.00 H new ATOM 0 HB2 LEU A 6 6.455 16.771 6.105 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.131 16.261 6.102 1.00 0.00 H new ATOM 0 HG LEU A 6 6.157 16.133 3.813 1.00 0.00 H new ATOM 0 HD11 LEU A 6 7.819 17.566 2.696 1.00 0.00 H new ATOM 0 HD12 LEU A 6 7.208 18.305 4.196 1.00 0.00 H new ATOM 0 HD13 LEU A 6 8.818 17.546 4.168 1.00 0.00 H new ATOM 0 HD21 LEU A 6 7.961 15.119 2.478 1.00 0.00 H new ATOM 0 HD22 LEU A 6 8.968 14.998 3.941 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.458 14.064 3.820 1.00 0.00 H new ATOM 101 N TYR A 7 7.653 12.425 6.243 1.00 0.00 N ATOM 102 CA TYR A 7 8.730 11.463 6.345 1.00 0.00 C ATOM 103 C TYR A 7 9.443 11.209 5.033 1.00 0.00 C ATOM 104 O TYR A 7 8.922 10.546 4.137 1.00 0.00 O ATOM 105 CB TYR A 7 8.233 10.133 6.953 1.00 0.00 C ATOM 106 CG TYR A 7 7.183 10.271 8.041 1.00 0.00 C ATOM 107 CD1 TYR A 7 5.895 10.731 7.766 1.00 0.00 C ATOM 108 CD2 TYR A 7 7.477 9.901 9.348 1.00 0.00 C ATOM 109 CE1 TYR A 7 4.944 10.817 8.763 1.00 0.00 C ATOM 110 CE2 TYR A 7 6.529 9.991 10.350 1.00 0.00 C ATOM 111 CZ TYR A 7 5.265 10.448 10.053 1.00 0.00 C ATOM 112 OH TYR A 7 4.316 10.533 11.046 1.00 0.00 O ATOM 0 H TYR A 7 6.719 12.023 6.162 1.00 0.00 H new ATOM 0 HA TYR A 7 9.464 11.912 7.014 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.824 9.516 6.152 1.00 0.00 H new ATOM 0 HB3 TYR A 7 9.089 9.597 7.363 1.00 0.00 H new ATOM 0 HD1 TYR A 7 5.638 11.024 6.759 1.00 0.00 H new ATOM 0 HD2 TYR A 7 8.465 9.536 9.585 1.00 0.00 H new ATOM 0 HE1 TYR A 7 3.950 11.173 8.533 1.00 0.00 H new ATOM 0 HE2 TYR A 7 6.779 9.704 11.361 1.00 0.00 H new ATOM 0 HH TYR A 7 3.926 11.432 11.050 1.00 0.00 H new ATOM 122 N LYS A 8 10.690 11.689 4.982 1.00 0.00 N ATOM 123 CA LYS A 8 11.569 11.485 3.839 1.00 0.00 C ATOM 124 C LYS A 8 12.453 10.283 4.109 1.00 0.00 C ATOM 125 O LYS A 8 13.108 10.227 5.141 1.00 0.00 O ATOM 126 CB LYS A 8 12.444 12.714 3.598 1.00 0.00 C ATOM 127 CG LYS A 8 13.680 12.437 2.748 1.00 0.00 C ATOM 128 CD LYS A 8 13.650 13.217 1.443 1.00 0.00 C ATOM 129 CE LYS A 8 15.025 13.755 1.083 1.00 0.00 C ATOM 130 NZ LYS A 8 14.947 14.867 0.096 1.00 0.00 N ATOM 0 H LYS A 8 11.113 12.230 5.736 1.00 0.00 H new ATOM 0 HA LYS A 8 10.960 11.318 2.951 1.00 0.00 H new ATOM 0 HB2 LYS A 8 11.845 13.484 3.111 1.00 0.00 H new ATOM 0 HB3 LYS A 8 12.760 13.117 4.560 1.00 0.00 H new ATOM 0 HG2 LYS A 8 14.575 12.702 3.310 1.00 0.00 H new ATOM 0 HG3 LYS A 8 13.743 11.370 2.533 1.00 0.00 H new ATOM 0 HD2 LYS A 8 13.289 12.573 0.641 1.00 0.00 H new ATOM 0 HD3 LYS A 8 12.946 14.044 1.529 1.00 0.00 H new ATOM 0 HE2 LYS A 8 15.525 14.106 1.986 1.00 0.00 H new ATOM 0 HE3 LYS A 8 15.634 12.949 0.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 15.884 15.305 -0.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 14.636 14.494 -0.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 14.266 15.580 0.429 1.00 0.00 H new ATOM 144 N ASN A 9 12.460 9.329 3.184 1.00 0.00 N ATOM 145 CA ASN A 9 13.256 8.110 3.318 1.00 0.00 C ATOM 146 C ASN A 9 14.373 8.263 4.364 1.00 0.00 C ATOM 147 O ASN A 9 15.163 9.205 4.285 1.00 0.00 O ATOM 148 CB ASN A 9 13.856 7.730 1.957 1.00 0.00 C ATOM 149 CG ASN A 9 13.379 6.374 1.474 1.00 0.00 C ATOM 150 OD1 ASN A 9 13.612 5.354 2.123 1.00 0.00 O ATOM 151 ND2 ASN A 9 12.708 6.357 0.329 1.00 0.00 N ATOM 0 H ASN A 9 11.917 9.377 2.322 1.00 0.00 H new ATOM 0 HA ASN A 9 12.593 7.316 3.663 1.00 0.00 H new ATOM 0 HB2 ASN A 9 13.590 8.489 1.221 1.00 0.00 H new ATOM 0 HB3 ASN A 9 14.943 7.725 2.031 1.00 0.00 H new ATOM 0 HD21 ASN A 9 12.362 5.474 -0.046 1.00 0.00 H new ATOM 0 HD22 ASN A 9 12.538 7.227 -0.175 1.00 0.00 H new ATOM 158 N LYS A 10 14.434 7.337 5.352 1.00 0.00 N ATOM 159 CA LYS A 10 15.472 7.386 6.418 1.00 0.00 C ATOM 160 C LYS A 10 16.798 7.807 5.832 1.00 0.00 C ATOM 161 O LYS A 10 17.673 8.341 6.513 1.00 0.00 O ATOM 162 CB LYS A 10 15.670 6.041 7.102 1.00 0.00 C ATOM 163 CG LYS A 10 15.050 4.926 6.343 1.00 0.00 C ATOM 164 CD LYS A 10 15.525 4.917 4.900 1.00 0.00 C ATOM 165 CE LYS A 10 16.586 3.855 4.659 1.00 0.00 C ATOM 166 NZ LYS A 10 16.798 3.600 3.207 1.00 0.00 N ATOM 0 H LYS A 10 13.785 6.554 5.435 1.00 0.00 H new ATOM 0 HA LYS A 10 15.121 8.106 7.157 1.00 0.00 H new ATOM 0 HB2 LYS A 10 16.737 5.849 7.219 1.00 0.00 H new ATOM 0 HB3 LYS A 10 15.241 6.079 8.103 1.00 0.00 H new ATOM 0 HG2 LYS A 10 15.299 3.977 6.817 1.00 0.00 H new ATOM 0 HG3 LYS A 10 13.965 5.022 6.371 1.00 0.00 H new ATOM 0 HD2 LYS A 10 14.676 4.739 4.240 1.00 0.00 H new ATOM 0 HD3 LYS A 10 15.928 5.897 4.644 1.00 0.00 H new ATOM 0 HE2 LYS A 10 17.525 4.171 5.113 1.00 0.00 H new ATOM 0 HE3 LYS A 10 16.290 2.928 5.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 16.193 2.811 2.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 16.554 4.454 2.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 17.795 3.357 3.039 1.00 0.00 H new ATOM 180 N ASP A 11 16.927 7.524 4.553 1.00 0.00 N ATOM 181 CA ASP A 11 18.103 7.812 3.817 1.00 0.00 C ATOM 182 C ASP A 11 17.777 8.801 2.702 1.00 0.00 C ATOM 183 O ASP A 11 17.298 8.414 1.636 1.00 0.00 O ATOM 184 CB ASP A 11 18.626 6.485 3.262 1.00 0.00 C ATOM 185 CG ASP A 11 19.997 6.128 3.803 1.00 0.00 C ATOM 186 OD1 ASP A 11 20.299 6.511 4.953 1.00 0.00 O ATOM 187 OD2 ASP A 11 20.769 5.467 3.077 1.00 0.00 O ATOM 0 H ASP A 11 16.194 7.079 4.001 1.00 0.00 H new ATOM 0 HA ASP A 11 18.868 8.272 4.443 1.00 0.00 H new ATOM 0 HB2 ASP A 11 17.923 5.689 3.509 1.00 0.00 H new ATOM 0 HB3 ASP A 11 18.672 6.543 2.175 1.00 0.00 H new ATOM 192 N LYS A 12 18.015 10.085 2.965 1.00 0.00 N ATOM 193 CA LYS A 12 17.721 11.138 1.994 1.00 0.00 C ATOM 194 C LYS A 12 18.233 10.776 0.598 1.00 0.00 C ATOM 195 O LYS A 12 17.721 11.278 -0.403 1.00 0.00 O ATOM 196 CB LYS A 12 18.312 12.474 2.460 1.00 0.00 C ATOM 197 CG LYS A 12 17.604 13.066 3.676 1.00 0.00 C ATOM 198 CD LYS A 12 18.295 12.665 4.970 1.00 0.00 C ATOM 199 CE LYS A 12 18.295 13.803 5.977 1.00 0.00 C ATOM 200 NZ LYS A 12 19.128 14.950 5.521 1.00 0.00 N ATOM 0 H LYS A 12 18.411 10.421 3.843 1.00 0.00 H new ATOM 0 HA LYS A 12 16.638 11.238 1.928 1.00 0.00 H new ATOM 0 HB2 LYS A 12 19.366 12.332 2.698 1.00 0.00 H new ATOM 0 HB3 LYS A 12 18.264 13.189 1.639 1.00 0.00 H new ATOM 0 HG2 LYS A 12 17.584 14.153 3.594 1.00 0.00 H new ATOM 0 HG3 LYS A 12 16.568 12.729 3.695 1.00 0.00 H new ATOM 0 HD2 LYS A 12 17.792 11.798 5.399 1.00 0.00 H new ATOM 0 HD3 LYS A 12 19.321 12.365 4.758 1.00 0.00 H new ATOM 0 HE2 LYS A 12 17.272 14.141 6.143 1.00 0.00 H new ATOM 0 HE3 LYS A 12 18.670 13.440 6.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 19.438 15.503 6.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 19.961 14.593 5.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 18.568 15.556 4.889 1.00 0.00 H new ATOM 214 N SER A 13 19.224 9.888 0.528 1.00 0.00 N ATOM 215 CA SER A 13 19.765 9.454 -0.757 1.00 0.00 C ATOM 216 C SER A 13 18.669 8.787 -1.584 1.00 0.00 C ATOM 217 O SER A 13 18.634 8.906 -2.809 1.00 0.00 O ATOM 218 CB SER A 13 20.930 8.485 -0.548 1.00 0.00 C ATOM 219 OG SER A 13 22.082 9.164 -0.078 1.00 0.00 O ATOM 0 H SER A 13 19.665 9.458 1.341 1.00 0.00 H new ATOM 0 HA SER A 13 20.134 10.328 -1.294 1.00 0.00 H new ATOM 0 HB2 SER A 13 20.642 7.714 0.167 1.00 0.00 H new ATOM 0 HB3 SER A 13 21.160 7.980 -1.486 1.00 0.00 H new ATOM 0 HG SER A 13 22.811 8.522 0.049 1.00 0.00 H new ATOM 225 N SER A 14 17.761 8.103 -0.891 1.00 0.00 N ATOM 226 CA SER A 14 16.632 7.426 -1.530 1.00 0.00 C ATOM 227 C SER A 14 15.844 8.389 -2.378 1.00 0.00 C ATOM 228 O SER A 14 15.238 8.006 -3.374 1.00 0.00 O ATOM 229 CB SER A 14 15.692 6.866 -0.465 1.00 0.00 C ATOM 230 OG SER A 14 15.112 5.642 -0.883 1.00 0.00 O ATOM 0 H SER A 14 17.785 8.002 0.124 1.00 0.00 H new ATOM 0 HA SER A 14 17.032 6.625 -2.152 1.00 0.00 H new ATOM 0 HB2 SER A 14 16.241 6.712 0.464 1.00 0.00 H new ATOM 0 HB3 SER A 14 14.905 7.590 -0.254 1.00 0.00 H new ATOM 0 HG SER A 14 15.077 5.021 -0.126 1.00 0.00 H new ATOM 236 N ALA A 15 15.819 9.631 -1.947 1.00 0.00 N ATOM 237 CA ALA A 15 15.055 10.643 -2.631 1.00 0.00 C ATOM 238 C ALA A 15 15.337 10.682 -4.125 1.00 0.00 C ATOM 239 O ALA A 15 14.484 11.117 -4.899 1.00 0.00 O ATOM 240 CB ALA A 15 15.299 12.006 -2.003 1.00 0.00 C ATOM 0 H ALA A 15 16.321 9.962 -1.123 1.00 0.00 H new ATOM 0 HA ALA A 15 14.003 10.379 -2.518 1.00 0.00 H new ATOM 0 HB1 ALA A 15 14.715 12.760 -2.531 1.00 0.00 H new ATOM 0 HB2 ALA A 15 14.999 11.983 -0.955 1.00 0.00 H new ATOM 0 HB3 ALA A 15 16.358 12.254 -2.072 1.00 0.00 H new ATOM 246 N LYS A 16 16.512 10.215 -4.545 1.00 0.00 N ATOM 247 CA LYS A 16 16.827 10.203 -5.969 1.00 0.00 C ATOM 248 C LYS A 16 15.659 9.572 -6.711 1.00 0.00 C ATOM 249 O LYS A 16 15.162 10.110 -7.701 1.00 0.00 O ATOM 250 CB LYS A 16 18.112 9.414 -6.234 1.00 0.00 C ATOM 251 CG LYS A 16 19.303 9.901 -5.425 1.00 0.00 C ATOM 252 CD LYS A 16 20.200 10.813 -6.246 1.00 0.00 C ATOM 253 CE LYS A 16 21.371 11.329 -5.425 1.00 0.00 C ATOM 254 NZ LYS A 16 21.113 12.692 -4.886 1.00 0.00 N ATOM 0 H LYS A 16 17.244 9.849 -3.936 1.00 0.00 H new ATOM 0 HA LYS A 16 16.987 11.223 -6.318 1.00 0.00 H new ATOM 0 HB2 LYS A 16 17.936 8.362 -6.008 1.00 0.00 H new ATOM 0 HB3 LYS A 16 18.354 9.476 -7.295 1.00 0.00 H new ATOM 0 HG2 LYS A 16 18.951 10.435 -4.542 1.00 0.00 H new ATOM 0 HG3 LYS A 16 19.878 9.045 -5.072 1.00 0.00 H new ATOM 0 HD2 LYS A 16 20.574 10.271 -7.115 1.00 0.00 H new ATOM 0 HD3 LYS A 16 19.619 11.655 -6.622 1.00 0.00 H new ATOM 0 HE2 LYS A 16 21.566 10.643 -4.600 1.00 0.00 H new ATOM 0 HE3 LYS A 16 22.268 11.347 -6.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 21.935 13.008 -4.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 20.952 13.352 -5.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 20.272 12.670 -4.275 1.00 0.00 H new ATOM 268 N THR A 17 15.196 8.450 -6.173 1.00 0.00 N ATOM 269 CA THR A 17 14.045 7.751 -6.714 1.00 0.00 C ATOM 270 C THR A 17 12.832 7.975 -5.816 1.00 0.00 C ATOM 271 O THR A 17 11.726 8.225 -6.294 1.00 0.00 O ATOM 272 CB THR A 17 14.326 6.255 -6.850 1.00 0.00 C ATOM 273 OG1 THR A 17 15.472 6.020 -7.653 1.00 0.00 O ATOM 274 CG2 THR A 17 13.169 5.495 -7.461 1.00 0.00 C ATOM 0 H THR A 17 15.608 8.004 -5.354 1.00 0.00 H new ATOM 0 HA THR A 17 13.838 8.150 -7.707 1.00 0.00 H new ATOM 0 HB THR A 17 14.489 5.896 -5.834 1.00 0.00 H new ATOM 0 HG1 THR A 17 15.631 5.055 -7.722 1.00 0.00 H new ATOM 0 HG21 THR A 17 13.425 4.438 -7.533 1.00 0.00 H new ATOM 0 HG22 THR A 17 12.285 5.612 -6.834 1.00 0.00 H new ATOM 0 HG23 THR A 17 12.962 5.887 -8.457 1.00 0.00 H new ATOM 282 N TYR A 18 13.055 7.861 -4.503 1.00 0.00 N ATOM 283 CA TYR A 18 11.986 8.027 -3.519 1.00 0.00 C ATOM 284 C TYR A 18 12.437 8.855 -2.328 1.00 0.00 C ATOM 285 O TYR A 18 13.242 8.390 -1.523 1.00 0.00 O ATOM 286 CB TYR A 18 11.578 6.681 -2.979 1.00 0.00 C ATOM 287 CG TYR A 18 11.373 5.619 -4.036 1.00 0.00 C ATOM 288 CD1 TYR A 18 10.392 5.760 -5.009 1.00 0.00 C ATOM 289 CD2 TYR A 18 12.161 4.475 -4.059 1.00 0.00 C ATOM 290 CE1 TYR A 18 10.201 4.790 -5.975 1.00 0.00 C ATOM 291 CE2 TYR A 18 11.977 3.502 -5.022 1.00 0.00 C ATOM 292 CZ TYR A 18 10.996 3.663 -5.977 1.00 0.00 C ATOM 293 OH TYR A 18 10.809 2.696 -6.937 1.00 0.00 O ATOM 0 H TYR A 18 13.968 7.654 -4.099 1.00 0.00 H new ATOM 0 HA TYR A 18 11.164 8.529 -4.029 1.00 0.00 H new ATOM 0 HB2 TYR A 18 12.340 6.338 -2.280 1.00 0.00 H new ATOM 0 HB3 TYR A 18 10.654 6.795 -2.412 1.00 0.00 H new ATOM 0 HD1 TYR A 18 9.768 6.642 -5.011 1.00 0.00 H new ATOM 0 HD2 TYR A 18 12.930 4.344 -3.312 1.00 0.00 H new ATOM 0 HE1 TYR A 18 9.433 4.914 -6.724 1.00 0.00 H new ATOM 0 HE2 TYR A 18 12.599 2.619 -5.027 1.00 0.00 H new ATOM 0 HH TYR A 18 11.451 1.969 -6.798 1.00 0.00 H new ATOM 303 N PRO A 19 11.953 10.092 -2.189 1.00 0.00 N ATOM 304 CA PRO A 19 12.349 10.950 -1.089 1.00 0.00 C ATOM 305 C PRO A 19 11.529 10.767 0.184 1.00 0.00 C ATOM 306 O PRO A 19 12.089 10.793 1.272 1.00 0.00 O ATOM 307 CB PRO A 19 12.149 12.366 -1.639 1.00 0.00 C ATOM 308 CG PRO A 19 11.491 12.207 -2.976 1.00 0.00 C ATOM 309 CD PRO A 19 11.032 10.777 -3.086 1.00 0.00 C ATOM 0 HA PRO A 19 13.369 10.720 -0.782 1.00 0.00 H new ATOM 0 HB2 PRO A 19 11.528 12.960 -0.968 1.00 0.00 H new ATOM 0 HB3 PRO A 19 13.103 12.885 -1.734 1.00 0.00 H new ATOM 0 HG2 PRO A 19 10.646 12.889 -3.071 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.188 12.449 -3.778 1.00 0.00 H new ATOM 0 HD2 PRO A 19 9.994 10.657 -2.775 1.00 0.00 H new ATOM 0 HD3 PRO A 19 11.104 10.403 -4.107 1.00 0.00 H new ATOM 317 N TYR A 20 10.207 10.630 0.070 1.00 0.00 N ATOM 318 CA TYR A 20 9.375 10.505 1.276 1.00 0.00 C ATOM 319 C TYR A 20 8.081 9.752 1.078 1.00 0.00 C ATOM 320 O TYR A 20 7.726 9.313 -0.014 1.00 0.00 O ATOM 321 CB TYR A 20 8.977 11.878 1.839 1.00 0.00 C ATOM 322 CG TYR A 20 9.392 13.039 1.009 1.00 0.00 C ATOM 323 CD1 TYR A 20 9.170 13.053 -0.358 1.00 0.00 C ATOM 324 CD2 TYR A 20 10.008 14.117 1.604 1.00 0.00 C ATOM 325 CE1 TYR A 20 9.557 14.119 -1.129 1.00 0.00 C ATOM 326 CE2 TYR A 20 10.403 15.201 0.849 1.00 0.00 C ATOM 327 CZ TYR A 20 10.178 15.199 -0.518 1.00 0.00 C ATOM 328 OH TYR A 20 10.577 16.274 -1.263 1.00 0.00 O ATOM 0 H TYR A 20 9.698 10.603 -0.814 1.00 0.00 H new ATOM 0 HA TYR A 20 10.016 9.946 1.957 1.00 0.00 H new ATOM 0 HB2 TYR A 20 7.894 11.905 1.960 1.00 0.00 H new ATOM 0 HB3 TYR A 20 9.411 11.987 2.833 1.00 0.00 H new ATOM 0 HD1 TYR A 20 8.683 12.209 -0.825 1.00 0.00 H new ATOM 0 HD2 TYR A 20 10.183 14.114 2.670 1.00 0.00 H new ATOM 0 HE1 TYR A 20 9.381 14.118 -2.195 1.00 0.00 H new ATOM 0 HE2 TYR A 20 10.884 16.045 1.320 1.00 0.00 H new ATOM 0 HH TYR A 20 9.798 16.824 -1.487 1.00 0.00 H new ATOM 338 N PHE A 21 7.370 9.692 2.196 1.00 0.00 N ATOM 339 CA PHE A 21 6.061 9.103 2.298 1.00 0.00 C ATOM 340 C PHE A 21 5.326 9.808 3.416 1.00 0.00 C ATOM 341 O PHE A 21 5.928 10.554 4.189 1.00 0.00 O ATOM 342 CB PHE A 21 6.094 7.615 2.601 1.00 0.00 C ATOM 343 CG PHE A 21 7.388 6.909 2.286 1.00 0.00 C ATOM 344 CD1 PHE A 21 8.516 7.064 3.085 1.00 0.00 C ATOM 345 CD2 PHE A 21 7.466 6.076 1.186 1.00 0.00 C ATOM 346 CE1 PHE A 21 9.691 6.399 2.781 1.00 0.00 C ATOM 347 CE2 PHE A 21 8.637 5.411 0.879 1.00 0.00 C ATOM 348 CZ PHE A 21 9.751 5.574 1.676 1.00 0.00 C ATOM 0 H PHE A 21 7.709 10.068 3.082 1.00 0.00 H new ATOM 0 HA PHE A 21 5.566 9.219 1.334 1.00 0.00 H new ATOM 0 HB2 PHE A 21 5.874 7.474 3.659 1.00 0.00 H new ATOM 0 HB3 PHE A 21 5.293 7.132 2.041 1.00 0.00 H new ATOM 0 HD1 PHE A 21 8.474 7.709 3.950 1.00 0.00 H new ATOM 0 HD2 PHE A 21 6.598 5.943 0.557 1.00 0.00 H new ATOM 0 HE1 PHE A 21 10.561 6.526 3.408 1.00 0.00 H new ATOM 0 HE2 PHE A 21 8.680 4.764 0.015 1.00 0.00 H new ATOM 0 HZ PHE A 21 10.668 5.057 1.436 1.00 0.00 H new ATOM 358 N VAL A 22 4.037 9.576 3.511 1.00 0.00 N ATOM 359 CA VAL A 22 3.251 10.201 4.551 1.00 0.00 C ATOM 360 C VAL A 22 2.612 9.161 5.448 1.00 0.00 C ATOM 361 O VAL A 22 1.696 8.451 5.036 1.00 0.00 O ATOM 362 CB VAL A 22 2.144 11.080 3.977 1.00 0.00 C ATOM 363 CG1 VAL A 22 1.681 12.081 5.028 1.00 0.00 C ATOM 364 CG2 VAL A 22 2.600 11.797 2.715 1.00 0.00 C ATOM 0 H VAL A 22 3.513 8.964 2.886 1.00 0.00 H new ATOM 0 HA VAL A 22 3.940 10.820 5.125 1.00 0.00 H new ATOM 0 HB VAL A 22 1.306 10.439 3.702 1.00 0.00 H new ATOM 0 HG11 VAL A 22 0.891 12.706 4.612 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.301 11.546 5.898 1.00 0.00 H new ATOM 0 HG13 VAL A 22 2.520 12.709 5.327 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.787 12.414 2.333 1.00 0.00 H new ATOM 0 HG22 VAL A 22 3.458 12.429 2.945 1.00 0.00 H new ATOM 0 HG23 VAL A 22 2.883 11.062 1.961 1.00 0.00 H new ATOM 374 N ASP A 23 3.092 9.076 6.676 1.00 0.00 N ATOM 375 CA ASP A 23 2.542 8.112 7.628 1.00 0.00 C ATOM 376 C ASP A 23 1.041 8.344 7.813 1.00 0.00 C ATOM 377 O ASP A 23 0.636 9.357 8.376 1.00 0.00 O ATOM 378 CB ASP A 23 3.264 8.224 8.968 1.00 0.00 C ATOM 379 CG ASP A 23 4.739 7.896 8.849 1.00 0.00 C ATOM 380 OD1 ASP A 23 5.274 7.968 7.722 1.00 0.00 O ATOM 381 OD2 ASP A 23 5.360 7.574 9.882 1.00 0.00 O ATOM 0 H ASP A 23 3.851 9.652 7.039 1.00 0.00 H new ATOM 0 HA ASP A 23 2.692 7.107 7.233 1.00 0.00 H new ATOM 0 HB2 ASP A 23 3.148 9.235 9.359 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.800 7.549 9.687 1.00 0.00 H new ATOM 386 N VAL A 24 0.210 7.417 7.317 1.00 0.00 N ATOM 387 CA VAL A 24 -1.243 7.577 7.428 1.00 0.00 C ATOM 388 C VAL A 24 -1.997 6.257 7.308 1.00 0.00 C ATOM 389 O VAL A 24 -2.087 5.692 6.219 1.00 0.00 O ATOM 390 CB VAL A 24 -1.754 8.563 6.352 1.00 0.00 C ATOM 391 CG1 VAL A 24 -1.258 8.153 4.972 1.00 0.00 C ATOM 392 CG2 VAL A 24 -3.275 8.677 6.376 1.00 0.00 C ATOM 0 H VAL A 24 0.512 6.565 6.844 1.00 0.00 H new ATOM 0 HA VAL A 24 -1.438 7.972 8.425 1.00 0.00 H new ATOM 0 HB VAL A 24 -1.350 9.549 6.583 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -1.628 8.859 4.228 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -0.168 8.153 4.962 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -1.623 7.153 4.737 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -3.599 9.378 5.607 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -3.716 7.699 6.185 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -3.598 9.036 7.353 1.00 0.00 H new ATOM 402 N GLN A 25 -2.581 5.799 8.421 1.00 0.00 N ATOM 403 CA GLN A 25 -3.379 4.570 8.423 1.00 0.00 C ATOM 404 C GLN A 25 -3.628 4.035 9.834 1.00 0.00 C ATOM 405 O GLN A 25 -4.522 4.511 10.534 1.00 0.00 O ATOM 406 CB GLN A 25 -2.743 3.487 7.548 1.00 0.00 C ATOM 407 CG GLN A 25 -3.441 2.135 7.614 1.00 0.00 C ATOM 408 CD GLN A 25 -2.463 0.984 7.753 1.00 0.00 C ATOM 409 OE1 GLN A 25 -1.797 0.841 8.778 1.00 0.00 O ATOM 410 NE2 GLN A 25 -2.369 0.158 6.718 1.00 0.00 N ATOM 0 H GLN A 25 -2.516 6.260 9.329 1.00 0.00 H new ATOM 0 HA GLN A 25 -4.347 4.835 7.998 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -2.738 3.830 6.513 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -1.702 3.360 7.847 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -4.130 2.126 8.458 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -4.038 1.994 6.713 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -2.940 0.314 5.888 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -1.726 -0.633 6.753 1.00 0.00 H new ATOM 419 N SER A 26 -2.855 3.029 10.240 1.00 0.00 N ATOM 420 CA SER A 26 -3.032 2.428 11.566 1.00 0.00 C ATOM 421 C SER A 26 -2.835 3.437 12.679 1.00 0.00 C ATOM 422 O SER A 26 -1.724 3.604 13.166 1.00 0.00 O ATOM 423 CB SER A 26 -2.057 1.288 11.803 1.00 0.00 C ATOM 424 OG SER A 26 -2.421 0.134 11.066 1.00 0.00 O ATOM 0 H SER A 26 -2.109 2.616 9.680 1.00 0.00 H new ATOM 0 HA SER A 26 -4.056 2.055 11.582 1.00 0.00 H new ATOM 0 HB2 SER A 26 -1.053 1.601 11.518 1.00 0.00 H new ATOM 0 HB3 SER A 26 -2.027 1.048 12.866 1.00 0.00 H new ATOM 0 HG SER A 26 -2.362 0.326 10.107 1.00 0.00 H new ATOM 430 N ASP A 27 -3.900 4.083 13.123 1.00 0.00 N ATOM 431 CA ASP A 27 -3.762 5.025 14.221 1.00 0.00 C ATOM 432 C ASP A 27 -3.117 4.304 15.401 1.00 0.00 C ATOM 433 O ASP A 27 -2.366 4.895 16.177 1.00 0.00 O ATOM 434 CB ASP A 27 -5.121 5.604 14.620 1.00 0.00 C ATOM 435 CG ASP A 27 -5.672 6.556 13.577 1.00 0.00 C ATOM 436 OD1 ASP A 27 -4.895 7.387 13.062 1.00 0.00 O ATOM 437 OD2 ASP A 27 -6.881 6.471 13.275 1.00 0.00 O ATOM 0 H ASP A 27 -4.845 3.978 12.753 1.00 0.00 H new ATOM 0 HA ASP A 27 -3.133 5.858 13.908 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -5.829 4.790 14.775 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -5.025 6.128 15.571 1.00 0.00 H new ATOM 442 N LEU A 28 -3.403 3.004 15.502 1.00 0.00 N ATOM 443 CA LEU A 28 -2.840 2.170 16.554 1.00 0.00 C ATOM 444 C LEU A 28 -1.481 1.638 16.133 1.00 0.00 C ATOM 445 O LEU A 28 -0.472 1.848 16.806 1.00 0.00 O ATOM 446 CB LEU A 28 -3.777 1.006 16.886 1.00 0.00 C ATOM 447 CG LEU A 28 -5.130 1.405 17.477 1.00 0.00 C ATOM 448 CD1 LEU A 28 -5.852 2.368 16.550 1.00 0.00 C ATOM 449 CD2 LEU A 28 -5.980 0.171 17.735 1.00 0.00 C ATOM 0 H LEU A 28 -4.025 2.509 14.863 1.00 0.00 H new ATOM 0 HA LEU A 28 -2.721 2.783 17.447 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.952 0.431 15.977 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -3.272 0.344 17.590 1.00 0.00 H new ATOM 0 HG LEU A 28 -4.958 1.909 18.428 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.813 2.641 16.986 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -5.247 3.264 16.414 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -6.015 1.890 15.584 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -6.940 0.472 18.156 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -6.145 -0.360 16.797 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.466 -0.485 18.437 1.00 0.00 H new ATOM 461 N LEU A 29 -1.476 0.960 14.999 1.00 0.00 N ATOM 462 CA LEU A 29 -0.263 0.390 14.432 1.00 0.00 C ATOM 463 C LEU A 29 0.401 1.395 13.499 1.00 0.00 C ATOM 464 O LEU A 29 0.896 1.035 12.430 1.00 0.00 O ATOM 465 CB LEU A 29 -0.613 -0.872 13.655 1.00 0.00 C ATOM 466 CG LEU A 29 -1.291 -1.961 14.480 1.00 0.00 C ATOM 467 CD1 LEU A 29 -2.034 -2.933 13.577 1.00 0.00 C ATOM 468 CD2 LEU A 29 -0.271 -2.695 15.336 1.00 0.00 C ATOM 0 H LEU A 29 -2.314 0.788 14.443 1.00 0.00 H new ATOM 0 HA LEU A 29 0.428 0.145 15.239 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.268 -0.602 12.826 1.00 0.00 H new ATOM 0 HB3 LEU A 29 0.300 -1.280 13.220 1.00 0.00 H new ATOM 0 HG LEU A 29 -2.017 -1.489 15.142 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.511 -3.702 14.185 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -2.794 -2.395 13.011 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.330 -3.400 12.888 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -0.773 -3.468 15.918 1.00 0.00 H new ATOM 0 HD22 LEU A 29 0.480 -3.154 14.693 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.212 -1.989 16.012 1.00 0.00 H new ATOM 480 N ASP A 30 0.369 2.660 13.891 1.00 0.00 N ATOM 481 CA ASP A 30 0.926 3.726 13.070 1.00 0.00 C ATOM 482 C ASP A 30 2.436 3.577 12.894 1.00 0.00 C ATOM 483 O ASP A 30 2.912 3.395 11.781 1.00 0.00 O ATOM 484 CB ASP A 30 0.580 5.086 13.689 1.00 0.00 C ATOM 485 CG ASP A 30 0.806 5.123 15.189 1.00 0.00 C ATOM 486 OD1 ASP A 30 0.154 4.337 15.908 1.00 0.00 O ATOM 487 OD2 ASP A 30 1.635 5.939 15.643 1.00 0.00 O ATOM 0 H ASP A 30 -0.037 2.974 14.773 1.00 0.00 H new ATOM 0 HA ASP A 30 0.482 3.659 12.077 1.00 0.00 H new ATOM 0 HB2 ASP A 30 1.184 5.860 13.216 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -0.463 5.322 13.477 1.00 0.00 H new ATOM 492 N ASN A 31 3.183 3.612 13.985 1.00 0.00 N ATOM 493 CA ASN A 31 4.634 3.434 13.917 1.00 0.00 C ATOM 494 C ASN A 31 5.052 2.274 14.791 1.00 0.00 C ATOM 495 O ASN A 31 6.240 2.029 15.005 1.00 0.00 O ATOM 496 CB ASN A 31 5.376 4.704 14.342 1.00 0.00 C ATOM 497 CG ASN A 31 4.745 5.369 15.550 1.00 0.00 C ATOM 498 OD1 ASN A 31 3.839 4.818 16.175 1.00 0.00 O ATOM 499 ND2 ASN A 31 5.223 6.562 15.886 1.00 0.00 N ATOM 0 H ASN A 31 2.817 3.761 14.925 1.00 0.00 H new ATOM 0 HA ASN A 31 4.898 3.223 12.881 1.00 0.00 H new ATOM 0 HB2 ASN A 31 6.413 4.456 14.568 1.00 0.00 H new ATOM 0 HB3 ASN A 31 5.390 5.408 13.510 1.00 0.00 H new ATOM 0 HD21 ASN A 31 4.838 7.058 16.690 1.00 0.00 H new ATOM 0 HD22 ASN A 31 5.975 6.982 15.340 1.00 0.00 H new ATOM 506 N LEU A 32 4.061 1.561 15.287 1.00 0.00 N ATOM 507 CA LEU A 32 4.306 0.408 16.144 1.00 0.00 C ATOM 508 C LEU A 32 5.300 -0.523 15.487 1.00 0.00 C ATOM 509 O LEU A 32 6.446 -0.647 15.920 1.00 0.00 O ATOM 510 CB LEU A 32 3.017 -0.363 16.400 1.00 0.00 C ATOM 511 CG LEU A 32 2.515 -0.335 17.845 1.00 0.00 C ATOM 512 CD1 LEU A 32 2.094 1.074 18.236 1.00 0.00 C ATOM 513 CD2 LEU A 32 1.359 -1.308 18.025 1.00 0.00 C ATOM 0 H LEU A 32 3.075 1.756 15.114 1.00 0.00 H new ATOM 0 HA LEU A 32 4.701 0.774 17.091 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.237 0.040 15.754 1.00 0.00 H new ATOM 0 HB3 LEU A 32 3.169 -1.401 16.106 1.00 0.00 H new ATOM 0 HG LEU A 32 3.330 -0.644 18.500 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.740 1.075 19.267 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.947 1.747 18.145 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.294 1.411 17.577 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.014 -1.276 19.058 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.541 -1.029 17.360 1.00 0.00 H new ATOM 0 HD23 LEU A 32 1.693 -2.318 17.785 1.00 0.00 H new ATOM 525 N ASN A 33 4.839 -1.181 14.436 1.00 0.00 N ATOM 526 CA ASN A 33 5.666 -2.111 13.708 1.00 0.00 C ATOM 527 C ASN A 33 5.877 -1.660 12.263 1.00 0.00 C ATOM 528 O ASN A 33 6.808 -2.118 11.604 1.00 0.00 O ATOM 529 CB ASN A 33 5.039 -3.506 13.729 1.00 0.00 C ATOM 530 CG ASN A 33 6.066 -4.605 13.539 1.00 0.00 C ATOM 531 OD1 ASN A 33 6.092 -5.557 14.464 1.00 0.00 O flip ATOM 532 ND2 ASN A 33 6.827 -4.598 12.571 1.00 0.00 N flip ATOM 0 H ASN A 33 3.891 -1.083 14.072 1.00 0.00 H new ATOM 0 HA ASN A 33 6.639 -2.143 14.199 1.00 0.00 H new ATOM 0 HB2 ASN A 33 4.523 -3.655 14.677 1.00 0.00 H new ATOM 0 HB3 ASN A 33 4.287 -3.575 12.943 1.00 0.00 H new ATOM 0 HD21 ASN A 33 6.772 -3.846 11.884 1.00 0.00 H new ATOM 0 HD22 ASN A 33 7.513 -5.344 12.456 1.00 0.00 H new ATOM 539 N THR A 34 5.016 -0.755 11.778 1.00 0.00 N ATOM 540 CA THR A 34 5.117 -0.248 10.407 1.00 0.00 C ATOM 541 C THR A 34 4.176 0.929 10.213 1.00 0.00 C ATOM 542 O THR A 34 3.524 1.368 11.155 1.00 0.00 O ATOM 543 CB THR A 34 4.779 -1.330 9.373 1.00 0.00 C ATOM 544 OG1 THR A 34 3.509 -1.898 9.638 1.00 0.00 O ATOM 545 CG2 THR A 34 5.782 -2.462 9.308 1.00 0.00 C ATOM 0 H THR A 34 4.244 -0.361 12.315 1.00 0.00 H new ATOM 0 HA THR A 34 6.150 0.066 10.255 1.00 0.00 H new ATOM 0 HB THR A 34 4.795 -0.810 8.415 1.00 0.00 H new ATOM 0 HG1 THR A 34 3.311 -2.584 8.967 1.00 0.00 H new ATOM 0 HG21 THR A 34 5.469 -3.183 8.553 1.00 0.00 H new ATOM 0 HG22 THR A 34 6.762 -2.065 9.046 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.838 -2.955 10.279 1.00 0.00 H new ATOM 553 N ARG A 35 4.107 1.433 8.985 1.00 0.00 N ATOM 554 CA ARG A 35 3.242 2.563 8.670 1.00 0.00 C ATOM 555 C ARG A 35 2.791 2.525 7.214 1.00 0.00 C ATOM 556 O ARG A 35 3.613 2.329 6.320 1.00 0.00 O ATOM 557 CB ARG A 35 4.006 3.864 8.932 1.00 0.00 C ATOM 558 CG ARG A 35 3.182 4.966 9.576 1.00 0.00 C ATOM 559 CD ARG A 35 1.862 5.186 8.862 1.00 0.00 C ATOM 560 NE ARG A 35 0.739 4.677 9.636 1.00 0.00 N ATOM 561 CZ ARG A 35 -0.064 5.442 10.372 1.00 0.00 C ATOM 562 NH1 ARG A 35 0.119 6.752 10.442 1.00 0.00 N ATOM 563 NH2 ARG A 35 -1.044 4.888 11.055 1.00 0.00 N ATOM 0 H ARG A 35 4.640 1.076 8.192 1.00 0.00 H new ATOM 0 HA ARG A 35 2.355 2.508 9.302 1.00 0.00 H new ATOM 0 HB2 ARG A 35 4.859 3.645 9.574 1.00 0.00 H new ATOM 0 HB3 ARG A 35 4.404 4.232 7.986 1.00 0.00 H new ATOM 0 HG2 ARG A 35 2.991 4.713 10.619 1.00 0.00 H new ATOM 0 HG3 ARG A 35 3.754 5.894 9.573 1.00 0.00 H new ATOM 0 HD2 ARG A 35 1.722 6.251 8.675 1.00 0.00 H new ATOM 0 HD3 ARG A 35 1.887 4.693 7.890 1.00 0.00 H new ATOM 0 HE ARG A 35 0.557 3.674 9.613 1.00 0.00 H new ATOM 0 HH11 ARG A 35 0.884 7.188 9.927 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -0.505 7.324 11.010 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -1.184 3.878 11.018 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -1.663 5.468 11.621 1.00 0.00 H new ATOM 577 N LEU A 36 1.501 2.770 6.961 1.00 0.00 N ATOM 578 CA LEU A 36 1.021 2.811 5.586 1.00 0.00 C ATOM 579 C LEU A 36 1.192 4.233 5.089 1.00 0.00 C ATOM 580 O LEU A 36 0.713 5.175 5.721 1.00 0.00 O ATOM 581 CB LEU A 36 -0.438 2.382 5.487 1.00 0.00 C ATOM 582 CG LEU A 36 -0.997 2.308 4.064 1.00 0.00 C ATOM 583 CD1 LEU A 36 -0.220 1.298 3.234 1.00 0.00 C ATOM 584 CD2 LEU A 36 -2.476 1.954 4.092 1.00 0.00 C ATOM 0 H LEU A 36 0.791 2.938 7.673 1.00 0.00 H new ATOM 0 HA LEU A 36 1.593 2.113 4.974 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -0.545 1.403 5.954 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -1.046 3.079 6.064 1.00 0.00 H new ATOM 0 HG LEU A 36 -0.886 3.288 3.599 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.633 1.261 2.226 1.00 0.00 H new ATOM 0 HD12 LEU A 36 0.828 1.595 3.186 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.297 0.313 3.694 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.858 1.905 3.072 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -2.609 0.986 4.576 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -3.022 2.716 4.648 1.00 0.00 H new ATOM 596 N VAL A 37 1.928 4.404 4.005 1.00 0.00 N ATOM 597 CA VAL A 37 2.201 5.743 3.512 1.00 0.00 C ATOM 598 C VAL A 37 1.948 5.932 2.034 1.00 0.00 C ATOM 599 O VAL A 37 1.948 4.985 1.246 1.00 0.00 O ATOM 600 CB VAL A 37 3.677 6.104 3.746 1.00 0.00 C ATOM 601 CG1 VAL A 37 3.969 6.252 5.233 1.00 0.00 C ATOM 602 CG2 VAL A 37 4.586 5.047 3.119 1.00 0.00 C ATOM 0 H VAL A 37 2.341 3.649 3.458 1.00 0.00 H new ATOM 0 HA VAL A 37 1.513 6.382 4.065 1.00 0.00 H new ATOM 0 HB VAL A 37 3.878 7.062 3.267 1.00 0.00 H new ATOM 0 HG11 VAL A 37 5.019 6.507 5.374 1.00 0.00 H new ATOM 0 HG12 VAL A 37 3.344 7.042 5.650 1.00 0.00 H new ATOM 0 HG13 VAL A 37 3.753 5.312 5.742 1.00 0.00 H new ATOM 0 HG21 VAL A 37 5.628 5.315 3.292 1.00 0.00 H new ATOM 0 HG22 VAL A 37 4.381 4.076 3.571 1.00 0.00 H new ATOM 0 HG23 VAL A 37 4.398 4.995 2.047 1.00 0.00 H new ATOM 612 N ILE A 38 1.840 7.201 1.670 1.00 0.00 N ATOM 613 CA ILE A 38 1.708 7.600 0.292 1.00 0.00 C ATOM 614 C ILE A 38 3.033 8.246 -0.067 1.00 0.00 C ATOM 615 O ILE A 38 3.243 9.436 0.170 1.00 0.00 O ATOM 616 CB ILE A 38 0.563 8.606 0.083 1.00 0.00 C ATOM 617 CG1 ILE A 38 -0.707 8.129 0.793 1.00 0.00 C ATOM 618 CG2 ILE A 38 0.309 8.799 -1.401 1.00 0.00 C ATOM 619 CD1 ILE A 38 -1.239 9.118 1.807 1.00 0.00 C ATOM 0 H ILE A 38 1.842 7.979 2.330 1.00 0.00 H new ATOM 0 HA ILE A 38 1.471 6.740 -0.334 1.00 0.00 H new ATOM 0 HB ILE A 38 0.852 9.564 0.515 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -1.479 7.934 0.048 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -0.500 7.183 1.294 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -0.503 9.513 -1.541 1.00 0.00 H new ATOM 0 HG22 ILE A 38 1.212 9.179 -1.878 1.00 0.00 H new ATOM 0 HG23 ILE A 38 0.035 7.845 -1.850 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -2.139 8.715 2.271 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -0.484 9.295 2.573 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -1.477 10.058 1.308 1.00 0.00 H new ATOM 631 N PRO A 39 3.976 7.443 -0.569 1.00 0.00 N ATOM 632 CA PRO A 39 5.323 7.903 -0.878 1.00 0.00 C ATOM 633 C PRO A 39 5.380 9.209 -1.670 1.00 0.00 C ATOM 634 O PRO A 39 5.137 9.225 -2.872 1.00 0.00 O ATOM 635 CB PRO A 39 5.931 6.759 -1.703 1.00 0.00 C ATOM 636 CG PRO A 39 4.847 5.740 -1.879 1.00 0.00 C ATOM 637 CD PRO A 39 3.839 6.000 -0.801 1.00 0.00 C ATOM 0 HA PRO A 39 5.860 8.128 0.043 1.00 0.00 H new ATOM 0 HB2 PRO A 39 6.283 7.122 -2.669 1.00 0.00 H new ATOM 0 HB3 PRO A 39 6.791 6.326 -1.192 1.00 0.00 H new ATOM 0 HG2 PRO A 39 4.391 5.825 -2.865 1.00 0.00 H new ATOM 0 HG3 PRO A 39 5.248 4.730 -1.800 1.00 0.00 H new ATOM 0 HD2 PRO A 39 2.830 5.735 -1.118 1.00 0.00 H new ATOM 0 HD3 PRO A 39 4.052 5.424 0.099 1.00 0.00 H new ATOM 645 N LEU A 40 5.749 10.293 -0.997 1.00 0.00 N ATOM 646 CA LEU A 40 5.889 11.592 -1.643 1.00 0.00 C ATOM 647 C LEU A 40 7.086 11.582 -2.561 1.00 0.00 C ATOM 648 O LEU A 40 8.008 10.790 -2.378 1.00 0.00 O ATOM 649 CB LEU A 40 6.073 12.683 -0.596 1.00 0.00 C ATOM 650 CG LEU A 40 4.803 13.097 0.117 1.00 0.00 C ATOM 651 CD1 LEU A 40 5.109 13.511 1.548 1.00 0.00 C ATOM 652 CD2 LEU A 40 4.122 14.225 -0.638 1.00 0.00 C ATOM 0 H LEU A 40 5.958 10.297 0.001 1.00 0.00 H new ATOM 0 HA LEU A 40 4.986 11.793 -2.219 1.00 0.00 H new ATOM 0 HB2 LEU A 40 6.794 12.338 0.145 1.00 0.00 H new ATOM 0 HB3 LEU A 40 6.506 13.560 -1.077 1.00 0.00 H new ATOM 0 HG LEU A 40 4.124 12.245 0.148 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.186 13.806 2.047 1.00 0.00 H new ATOM 0 HD12 LEU A 40 5.558 12.673 2.081 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.803 14.352 1.543 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.210 14.514 -0.116 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.794 15.081 -0.696 1.00 0.00 H new ATOM 0 HD23 LEU A 40 3.873 13.890 -1.645 1.00 0.00 H new ATOM 664 N THR A 41 7.076 12.460 -3.546 1.00 0.00 N ATOM 665 CA THR A 41 8.180 12.533 -4.477 1.00 0.00 C ATOM 666 C THR A 41 8.234 13.880 -5.181 1.00 0.00 C ATOM 667 O THR A 41 7.290 14.665 -5.113 1.00 0.00 O ATOM 668 CB THR A 41 8.126 11.367 -5.456 1.00 0.00 C ATOM 669 OG1 THR A 41 8.520 11.753 -6.760 1.00 0.00 O ATOM 670 CG2 THR A 41 6.766 10.703 -5.569 1.00 0.00 C ATOM 0 H THR A 41 6.323 13.125 -3.719 1.00 0.00 H new ATOM 0 HA THR A 41 9.110 12.448 -3.915 1.00 0.00 H new ATOM 0 HB THR A 41 8.825 10.646 -5.032 1.00 0.00 H new ATOM 0 HG1 THR A 41 8.383 11.005 -7.378 1.00 0.00 H new ATOM 0 HG21 THR A 41 6.819 9.884 -6.287 1.00 0.00 H new ATOM 0 HG22 THR A 41 6.469 10.313 -4.595 1.00 0.00 H new ATOM 0 HG23 THR A 41 6.031 11.434 -5.906 1.00 0.00 H new ATOM 678 N PRO A 42 9.362 14.184 -5.837 1.00 0.00 N ATOM 679 CA PRO A 42 9.558 15.461 -6.513 1.00 0.00 C ATOM 680 C PRO A 42 8.931 15.527 -7.886 1.00 0.00 C ATOM 681 O PRO A 42 9.301 14.800 -8.808 1.00 0.00 O ATOM 682 CB PRO A 42 11.080 15.544 -6.573 1.00 0.00 C ATOM 683 CG PRO A 42 11.479 14.140 -6.824 1.00 0.00 C ATOM 684 CD PRO A 42 10.567 13.328 -5.947 1.00 0.00 C ATOM 0 HA PRO A 42 9.079 16.292 -5.995 1.00 0.00 H new ATOM 0 HB2 PRO A 42 11.417 16.208 -7.369 1.00 0.00 H new ATOM 0 HB3 PRO A 42 11.501 15.923 -5.642 1.00 0.00 H new ATOM 0 HG2 PRO A 42 11.359 13.875 -7.874 1.00 0.00 H new ATOM 0 HG3 PRO A 42 12.526 13.973 -6.570 1.00 0.00 H new ATOM 0 HD2 PRO A 42 10.335 12.360 -6.392 1.00 0.00 H new ATOM 0 HD3 PRO A 42 11.013 13.132 -4.972 1.00 0.00 H new ATOM 692 N ILE A 43 7.978 16.437 -7.994 1.00 0.00 N ATOM 693 CA ILE A 43 7.261 16.678 -9.225 1.00 0.00 C ATOM 694 C ILE A 43 8.227 16.971 -10.368 1.00 0.00 C ATOM 695 O ILE A 43 7.908 16.768 -11.540 1.00 0.00 O ATOM 696 CB ILE A 43 6.294 17.863 -9.031 1.00 0.00 C ATOM 697 CG1 ILE A 43 5.011 17.362 -8.392 1.00 0.00 C ATOM 698 CG2 ILE A 43 6.038 18.590 -10.346 1.00 0.00 C ATOM 699 CD1 ILE A 43 3.905 18.388 -8.397 1.00 0.00 C ATOM 0 H ILE A 43 7.681 17.032 -7.221 1.00 0.00 H new ATOM 0 HA ILE A 43 6.695 15.783 -9.482 1.00 0.00 H new ATOM 0 HB ILE A 43 6.748 18.595 -8.363 1.00 0.00 H new ATOM 0 HG12 ILE A 43 4.673 16.471 -8.921 1.00 0.00 H new ATOM 0 HG13 ILE A 43 5.217 17.064 -7.364 1.00 0.00 H new ATOM 0 HG21 ILE A 43 5.352 19.420 -10.175 1.00 0.00 H new ATOM 0 HG22 ILE A 43 6.980 18.972 -10.740 1.00 0.00 H new ATOM 0 HG23 ILE A 43 5.598 17.898 -11.065 1.00 0.00 H new ATOM 0 HD11 ILE A 43 3.016 17.967 -7.926 1.00 0.00 H new ATOM 0 HD12 ILE A 43 4.225 19.271 -7.844 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.673 18.668 -9.425 1.00 0.00 H new ATOM 711 N GLU A 44 9.403 17.459 -10.009 1.00 0.00 N ATOM 712 CA GLU A 44 10.427 17.801 -10.979 1.00 0.00 C ATOM 713 C GLU A 44 11.057 16.556 -11.596 1.00 0.00 C ATOM 714 O GLU A 44 11.052 16.390 -12.816 1.00 0.00 O ATOM 715 CB GLU A 44 11.485 18.657 -10.296 1.00 0.00 C ATOM 716 CG GLU A 44 12.452 19.320 -11.260 1.00 0.00 C ATOM 717 CD GLU A 44 13.774 19.676 -10.609 1.00 0.00 C ATOM 718 OE1 GLU A 44 13.762 20.440 -9.621 1.00 0.00 O ATOM 719 OE2 GLU A 44 14.821 19.192 -11.087 1.00 0.00 O ATOM 0 H GLU A 44 9.673 17.628 -9.040 1.00 0.00 H new ATOM 0 HA GLU A 44 9.967 18.361 -11.794 1.00 0.00 H new ATOM 0 HB2 GLU A 44 10.990 19.428 -9.705 1.00 0.00 H new ATOM 0 HB3 GLU A 44 12.049 18.035 -9.601 1.00 0.00 H new ATOM 0 HG2 GLU A 44 12.634 18.652 -12.102 1.00 0.00 H new ATOM 0 HG3 GLU A 44 11.995 20.224 -11.663 1.00 0.00 H new ATOM 726 N LEU A 45 11.597 15.682 -10.755 1.00 0.00 N ATOM 727 CA LEU A 45 12.227 14.457 -11.236 1.00 0.00 C ATOM 728 C LEU A 45 11.214 13.556 -11.940 1.00 0.00 C ATOM 729 O LEU A 45 11.591 12.648 -12.682 1.00 0.00 O ATOM 730 CB LEU A 45 12.877 13.696 -10.078 1.00 0.00 C ATOM 731 CG LEU A 45 13.686 14.555 -9.103 1.00 0.00 C ATOM 732 CD1 LEU A 45 14.420 13.676 -8.102 1.00 0.00 C ATOM 733 CD2 LEU A 45 14.669 15.439 -9.858 1.00 0.00 C ATOM 0 H LEU A 45 11.612 15.797 -9.742 1.00 0.00 H new ATOM 0 HA LEU A 45 12.996 14.741 -11.954 1.00 0.00 H new ATOM 0 HB2 LEU A 45 12.096 13.180 -9.520 1.00 0.00 H new ATOM 0 HB3 LEU A 45 13.533 12.929 -10.491 1.00 0.00 H new ATOM 0 HG LEU A 45 12.996 15.198 -8.557 1.00 0.00 H new ATOM 0 HD11 LEU A 45 14.990 14.303 -7.417 1.00 0.00 H new ATOM 0 HD12 LEU A 45 13.698 13.085 -7.538 1.00 0.00 H new ATOM 0 HD13 LEU A 45 15.099 13.009 -8.633 1.00 0.00 H new ATOM 0 HD21 LEU A 45 15.235 16.042 -9.148 1.00 0.00 H new ATOM 0 HD22 LEU A 45 15.354 14.814 -10.431 1.00 0.00 H new ATOM 0 HD23 LEU A 45 14.122 16.094 -10.536 1.00 0.00 H new ATOM 745 N LEU A 46 9.928 13.805 -11.703 1.00 0.00 N ATOM 746 CA LEU A 46 8.872 13.007 -12.316 1.00 0.00 C ATOM 747 C LEU A 46 8.082 13.820 -13.339 1.00 0.00 C ATOM 748 O LEU A 46 6.910 13.540 -13.591 1.00 0.00 O ATOM 749 CB LEU A 46 7.928 12.466 -11.241 1.00 0.00 C ATOM 750 CG LEU A 46 8.362 11.145 -10.603 1.00 0.00 C ATOM 751 CD1 LEU A 46 9.597 11.352 -9.739 1.00 0.00 C ATOM 752 CD2 LEU A 46 7.227 10.553 -9.781 1.00 0.00 C ATOM 0 H LEU A 46 9.594 14.551 -11.093 1.00 0.00 H new ATOM 0 HA LEU A 46 9.344 12.173 -12.836 1.00 0.00 H new ATOM 0 HB2 LEU A 46 7.828 13.216 -10.456 1.00 0.00 H new ATOM 0 HB3 LEU A 46 6.940 12.332 -11.681 1.00 0.00 H new ATOM 0 HG LEU A 46 8.613 10.443 -11.398 1.00 0.00 H new ATOM 0 HD11 LEU A 46 9.892 10.402 -9.293 1.00 0.00 H new ATOM 0 HD12 LEU A 46 10.412 11.733 -10.355 1.00 0.00 H new ATOM 0 HD13 LEU A 46 9.373 12.070 -8.950 1.00 0.00 H new ATOM 0 HD21 LEU A 46 7.553 9.614 -9.334 1.00 0.00 H new ATOM 0 HD22 LEU A 46 6.946 11.251 -8.993 1.00 0.00 H new ATOM 0 HD23 LEU A 46 6.368 10.369 -10.426 1.00 0.00 H new ATOM 764 N ASP A 47 8.726 14.825 -13.928 1.00 0.00 N ATOM 765 CA ASP A 47 8.075 15.669 -14.925 1.00 0.00 C ATOM 766 C ASP A 47 7.050 16.571 -14.296 1.00 0.00 C ATOM 767 O ASP A 47 6.045 16.129 -13.739 1.00 0.00 O ATOM 768 CB ASP A 47 7.415 14.833 -16.018 1.00 0.00 C ATOM 769 CG ASP A 47 8.206 13.586 -16.364 1.00 0.00 C ATOM 770 OD1 ASP A 47 9.104 13.673 -17.227 1.00 0.00 O ATOM 771 OD2 ASP A 47 7.927 12.522 -15.771 1.00 0.00 O ATOM 0 H ASP A 47 9.696 15.074 -13.732 1.00 0.00 H new ATOM 0 HA ASP A 47 8.855 16.283 -15.375 1.00 0.00 H new ATOM 0 HB2 ASP A 47 6.415 14.545 -15.694 1.00 0.00 H new ATOM 0 HB3 ASP A 47 7.297 15.443 -16.914 1.00 0.00 H new ATOM 776 N LYS A 48 7.323 17.848 -14.419 1.00 0.00 N ATOM 777 CA LYS A 48 6.455 18.873 -13.902 1.00 0.00 C ATOM 778 C LYS A 48 5.112 18.852 -14.629 1.00 0.00 C ATOM 779 O LYS A 48 4.119 19.397 -14.148 1.00 0.00 O ATOM 780 CB LYS A 48 7.144 20.218 -14.083 1.00 0.00 C ATOM 781 CG LYS A 48 7.297 21.012 -12.795 1.00 0.00 C ATOM 782 CD LYS A 48 8.659 20.784 -12.159 1.00 0.00 C ATOM 783 CE LYS A 48 9.789 21.157 -13.106 1.00 0.00 C ATOM 784 NZ LYS A 48 10.364 19.963 -13.788 1.00 0.00 N ATOM 0 H LYS A 48 8.158 18.205 -14.883 1.00 0.00 H new ATOM 0 HA LYS A 48 6.259 18.698 -12.844 1.00 0.00 H new ATOM 0 HB2 LYS A 48 8.131 20.054 -14.516 1.00 0.00 H new ATOM 0 HB3 LYS A 48 6.576 20.812 -14.799 1.00 0.00 H new ATOM 0 HG2 LYS A 48 7.164 22.074 -13.003 1.00 0.00 H new ATOM 0 HG3 LYS A 48 6.514 20.724 -12.094 1.00 0.00 H new ATOM 0 HD2 LYS A 48 8.738 21.375 -11.246 1.00 0.00 H new ATOM 0 HD3 LYS A 48 8.756 19.737 -11.871 1.00 0.00 H new ATOM 0 HE2 LYS A 48 9.419 21.858 -13.854 1.00 0.00 H new ATOM 0 HE3 LYS A 48 10.574 21.670 -12.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 11.340 19.813 -13.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 9.791 19.125 -13.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 10.363 20.117 -14.817 1.00 0.00 H new ATOM 798 N LYS A 49 5.102 18.213 -15.796 1.00 0.00 N ATOM 799 CA LYS A 49 3.900 18.104 -16.613 1.00 0.00 C ATOM 800 C LYS A 49 3.209 16.762 -16.392 1.00 0.00 C ATOM 801 O LYS A 49 2.554 16.237 -17.292 1.00 0.00 O ATOM 802 CB LYS A 49 4.259 18.263 -18.093 1.00 0.00 C ATOM 803 CG LYS A 49 5.546 17.549 -18.491 1.00 0.00 C ATOM 804 CD LYS A 49 5.412 16.869 -19.845 1.00 0.00 C ATOM 805 CE LYS A 49 6.131 15.530 -19.869 1.00 0.00 C ATOM 806 NZ LYS A 49 5.401 14.522 -20.686 1.00 0.00 N ATOM 0 H LYS A 49 5.922 17.759 -16.199 1.00 0.00 H new ATOM 0 HA LYS A 49 3.214 18.898 -16.317 1.00 0.00 H new ATOM 0 HB2 LYS A 49 3.439 17.880 -18.700 1.00 0.00 H new ATOM 0 HB3 LYS A 49 4.357 19.324 -18.322 1.00 0.00 H new ATOM 0 HG2 LYS A 49 6.366 18.266 -18.523 1.00 0.00 H new ATOM 0 HG3 LYS A 49 5.801 16.807 -17.734 1.00 0.00 H new ATOM 0 HD2 LYS A 49 4.357 16.721 -20.076 1.00 0.00 H new ATOM 0 HD3 LYS A 49 5.821 17.517 -20.621 1.00 0.00 H new ATOM 0 HE2 LYS A 49 7.135 15.664 -20.271 1.00 0.00 H new ATOM 0 HE3 LYS A 49 6.242 15.159 -18.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 5.924 13.623 -20.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 4.452 14.374 -20.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 5.317 14.863 -21.665 1.00 0.00 H new ATOM 820 N ALA A 50 3.363 16.208 -15.194 1.00 0.00 N ATOM 821 CA ALA A 50 2.755 14.925 -14.864 1.00 0.00 C ATOM 822 C ALA A 50 1.362 15.108 -14.263 1.00 0.00 C ATOM 823 O ALA A 50 1.145 16.000 -13.443 1.00 0.00 O ATOM 824 CB ALA A 50 3.647 14.152 -13.904 1.00 0.00 C ATOM 0 H ALA A 50 3.903 16.627 -14.437 1.00 0.00 H new ATOM 0 HA ALA A 50 2.649 14.356 -15.787 1.00 0.00 H new ATOM 0 HB1 ALA A 50 3.182 13.196 -13.665 1.00 0.00 H new ATOM 0 HB2 ALA A 50 4.617 13.978 -14.369 1.00 0.00 H new ATOM 0 HB3 ALA A 50 3.782 14.728 -12.989 1.00 0.00 H new ATOM 830 N PRO A 51 0.396 14.261 -14.663 1.00 0.00 N ATOM 831 CA PRO A 51 -0.977 14.334 -14.158 1.00 0.00 C ATOM 832 C PRO A 51 -1.107 13.752 -12.754 1.00 0.00 C ATOM 833 O PRO A 51 -0.164 13.161 -12.228 1.00 0.00 O ATOM 834 CB PRO A 51 -1.760 13.490 -15.161 1.00 0.00 C ATOM 835 CG PRO A 51 -0.777 12.481 -15.646 1.00 0.00 C ATOM 836 CD PRO A 51 0.566 13.164 -15.638 1.00 0.00 C ATOM 0 HA PRO A 51 -1.331 15.361 -14.073 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -2.620 13.013 -14.692 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -2.141 14.099 -15.981 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -0.771 11.602 -15.001 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -1.033 12.138 -16.648 1.00 0.00 H new ATOM 0 HD2 PRO A 51 1.361 12.481 -15.338 1.00 0.00 H new ATOM 0 HD3 PRO A 51 0.828 13.543 -16.626 1.00 0.00 H new ATOM 844 N SER A 52 -2.279 13.922 -12.151 1.00 0.00 N ATOM 845 CA SER A 52 -2.525 13.412 -10.808 1.00 0.00 C ATOM 846 C SER A 52 -3.866 12.684 -10.733 1.00 0.00 C ATOM 847 O SER A 52 -3.920 11.456 -10.799 1.00 0.00 O ATOM 848 CB SER A 52 -2.488 14.554 -9.790 1.00 0.00 C ATOM 849 OG SER A 52 -1.155 14.926 -9.488 1.00 0.00 O ATOM 0 H SER A 52 -3.072 14.408 -12.570 1.00 0.00 H new ATOM 0 HA SER A 52 -1.736 12.698 -10.569 1.00 0.00 H new ATOM 0 HB2 SER A 52 -3.028 15.415 -10.185 1.00 0.00 H new ATOM 0 HB3 SER A 52 -2.999 14.248 -8.877 1.00 0.00 H new ATOM 0 HG SER A 52 -0.918 14.597 -8.596 1.00 0.00 H new ATOM 855 N HIS A 53 -4.946 13.448 -10.591 1.00 0.00 N ATOM 856 CA HIS A 53 -6.284 12.871 -10.503 1.00 0.00 C ATOM 857 C HIS A 53 -6.394 11.912 -9.318 1.00 0.00 C ATOM 858 O HIS A 53 -7.291 11.070 -9.273 1.00 0.00 O ATOM 859 CB HIS A 53 -6.632 12.139 -11.800 1.00 0.00 C ATOM 860 CG HIS A 53 -8.067 12.279 -12.200 1.00 0.00 C ATOM 861 ND1 HIS A 53 -9.029 11.338 -11.898 1.00 0.00 N ATOM 862 CD2 HIS A 53 -8.705 13.259 -12.883 1.00 0.00 C ATOM 863 CE1 HIS A 53 -10.195 11.732 -12.378 1.00 0.00 C ATOM 864 NE2 HIS A 53 -10.026 12.895 -12.980 1.00 0.00 N ATOM 0 H HIS A 53 -4.921 14.466 -10.535 1.00 0.00 H new ATOM 0 HA HIS A 53 -6.992 13.686 -10.351 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -6.001 12.520 -12.603 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -6.397 11.081 -11.685 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -8.258 14.159 -13.278 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -11.128 11.194 -12.293 1.00 0.00 H new ATOM 0 HE2 HIS A 53 -10.757 13.435 -13.442 1.00 0.00 H new ATOM 873 N LEU A 54 -5.478 12.047 -8.361 1.00 0.00 N ATOM 874 CA LEU A 54 -5.467 11.197 -7.175 1.00 0.00 C ATOM 875 C LEU A 54 -4.300 11.567 -6.266 1.00 0.00 C ATOM 876 O LEU A 54 -4.444 11.627 -5.045 1.00 0.00 O ATOM 877 CB LEU A 54 -5.369 9.721 -7.571 1.00 0.00 C ATOM 878 CG LEU A 54 -5.461 8.731 -6.408 1.00 0.00 C ATOM 879 CD1 LEU A 54 -6.890 8.238 -6.239 1.00 0.00 C ATOM 880 CD2 LEU A 54 -4.513 7.561 -6.627 1.00 0.00 C ATOM 0 H LEU A 54 -4.731 12.741 -8.386 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.401 11.355 -6.635 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.164 9.498 -8.282 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -4.424 9.562 -8.090 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.165 9.245 -5.494 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -6.936 7.535 -5.407 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -7.545 9.085 -6.035 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -7.214 7.741 -7.153 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -4.592 6.867 -5.790 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -4.777 7.047 -7.551 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.490 7.930 -6.697 1.00 0.00 H new ATOM 892 N CYS A 55 -3.145 11.819 -6.874 1.00 0.00 N ATOM 893 CA CYS A 55 -1.949 12.189 -6.127 1.00 0.00 C ATOM 894 C CYS A 55 -1.807 13.710 -6.058 1.00 0.00 C ATOM 895 O CYS A 55 -1.624 14.368 -7.082 1.00 0.00 O ATOM 896 CB CYS A 55 -0.707 11.579 -6.778 1.00 0.00 C ATOM 897 SG CYS A 55 -0.880 9.829 -7.201 1.00 0.00 S ATOM 0 H CYS A 55 -3.012 11.773 -7.884 1.00 0.00 H new ATOM 0 HA CYS A 55 -2.045 11.801 -5.113 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -0.472 12.139 -7.683 1.00 0.00 H new ATOM 0 HB3 CYS A 55 0.140 11.696 -6.102 1.00 0.00 H new ATOM 0 HG CYS A 55 0.220 9.404 -7.747 1.00 0.00 H new ATOM 903 N PRO A 56 -1.893 14.292 -4.849 1.00 0.00 N ATOM 904 CA PRO A 56 -1.780 15.729 -4.654 1.00 0.00 C ATOM 905 C PRO A 56 -0.345 16.173 -4.390 1.00 0.00 C ATOM 906 O PRO A 56 0.548 15.347 -4.206 1.00 0.00 O ATOM 907 CB PRO A 56 -2.648 15.958 -3.422 1.00 0.00 C ATOM 908 CG PRO A 56 -2.506 14.706 -2.615 1.00 0.00 C ATOM 909 CD PRO A 56 -2.114 13.599 -3.570 1.00 0.00 C ATOM 0 HA PRO A 56 -2.085 16.296 -5.533 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -2.315 16.831 -2.860 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -3.688 16.135 -3.698 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -1.749 14.831 -1.840 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -3.442 14.465 -2.111 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -1.214 13.083 -3.235 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -2.899 12.848 -3.654 1.00 0.00 H new ATOM 917 N THR A 57 -0.137 17.484 -4.373 1.00 0.00 N ATOM 918 CA THR A 57 1.183 18.056 -4.134 1.00 0.00 C ATOM 919 C THR A 57 1.178 18.942 -2.921 1.00 0.00 C ATOM 920 O THR A 57 0.129 19.368 -2.439 1.00 0.00 O ATOM 921 CB THR A 57 1.662 18.872 -5.337 1.00 0.00 C ATOM 922 OG1 THR A 57 2.383 18.058 -6.246 1.00 0.00 O ATOM 923 CG2 THR A 57 2.545 20.066 -4.977 1.00 0.00 C ATOM 0 H THR A 57 -0.871 18.176 -4.523 1.00 0.00 H new ATOM 0 HA THR A 57 1.864 17.221 -3.971 1.00 0.00 H new ATOM 0 HB THR A 57 0.747 19.258 -5.787 1.00 0.00 H new ATOM 0 HG1 THR A 57 3.298 17.933 -5.918 1.00 0.00 H new ATOM 0 HG21 THR A 57 2.840 20.588 -5.887 1.00 0.00 H new ATOM 0 HG22 THR A 57 1.991 20.747 -4.331 1.00 0.00 H new ATOM 0 HG23 THR A 57 3.436 19.716 -4.455 1.00 0.00 H new ATOM 931 N ILE A 58 2.374 19.245 -2.457 1.00 0.00 N ATOM 932 CA ILE A 58 2.522 20.116 -1.330 1.00 0.00 C ATOM 933 C ILE A 58 3.446 21.277 -1.621 1.00 0.00 C ATOM 934 O ILE A 58 4.045 21.370 -2.691 1.00 0.00 O ATOM 935 CB ILE A 58 3.107 19.407 -0.111 1.00 0.00 C ATOM 936 CG1 ILE A 58 4.422 18.750 -0.521 1.00 0.00 C ATOM 937 CG2 ILE A 58 2.115 18.410 0.478 1.00 0.00 C ATOM 938 CD1 ILE A 58 4.217 17.442 -1.232 1.00 0.00 C ATOM 0 H ILE A 58 3.250 18.897 -2.848 1.00 0.00 H new ATOM 0 HA ILE A 58 1.509 20.463 -1.124 1.00 0.00 H new ATOM 0 HB ILE A 58 3.307 20.128 0.681 1.00 0.00 H new ATOM 0 HG12 ILE A 58 4.976 19.429 -1.169 1.00 0.00 H new ATOM 0 HG13 ILE A 58 5.034 18.585 0.366 1.00 0.00 H new ATOM 0 HG21 ILE A 58 2.561 17.922 1.344 1.00 0.00 H new ATOM 0 HG22 ILE A 58 1.210 18.935 0.783 1.00 0.00 H new ATOM 0 HG23 ILE A 58 1.864 17.660 -0.272 1.00 0.00 H new ATOM 0 HD11 ILE A 58 5.185 17.018 -1.501 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.688 16.751 -0.576 1.00 0.00 H new ATOM 0 HD13 ILE A 58 3.630 17.607 -2.135 1.00 0.00 H new ATOM 950 N HIS A 59 3.616 22.113 -0.610 1.00 0.00 N ATOM 951 CA HIS A 59 4.539 23.219 -0.683 1.00 0.00 C ATOM 952 C HIS A 59 5.367 23.224 0.582 1.00 0.00 C ATOM 953 O HIS A 59 5.063 23.929 1.544 1.00 0.00 O ATOM 954 CB HIS A 59 3.821 24.545 -0.827 1.00 0.00 C ATOM 955 CG HIS A 59 2.990 24.656 -2.069 1.00 0.00 C ATOM 956 ND1 HIS A 59 1.965 23.784 -2.370 1.00 0.00 N ATOM 957 CD2 HIS A 59 3.038 25.544 -3.090 1.00 0.00 C ATOM 958 CE1 HIS A 59 1.419 24.131 -3.522 1.00 0.00 C ATOM 959 NE2 HIS A 59 2.051 25.196 -3.978 1.00 0.00 N ATOM 0 H HIS A 59 3.118 22.040 0.277 1.00 0.00 H new ATOM 0 HA HIS A 59 5.169 23.095 -1.564 1.00 0.00 H new ATOM 0 HB2 HIS A 59 3.180 24.696 0.042 1.00 0.00 H new ATOM 0 HB3 HIS A 59 4.558 25.348 -0.822 1.00 0.00 H new ATOM 0 HD2 HIS A 59 3.725 26.372 -3.187 1.00 0.00 H new ATOM 0 HE1 HIS A 59 0.596 23.629 -4.008 1.00 0.00 H new ATOM 0 HE2 HIS A 59 1.840 25.682 -4.850 1.00 0.00 H new ATOM 968 N ILE A 60 6.396 22.411 0.577 1.00 0.00 N ATOM 969 CA ILE A 60 7.272 22.279 1.729 1.00 0.00 C ATOM 970 C ILE A 60 8.628 22.942 1.493 1.00 0.00 C ATOM 971 O ILE A 60 8.897 23.463 0.411 1.00 0.00 O ATOM 972 CB ILE A 60 7.461 20.797 2.093 1.00 0.00 C ATOM 973 CG1 ILE A 60 8.146 20.049 0.947 1.00 0.00 C ATOM 974 CG2 ILE A 60 6.107 20.169 2.409 1.00 0.00 C ATOM 975 CD1 ILE A 60 9.211 19.082 1.410 1.00 0.00 C ATOM 0 H ILE A 60 6.653 21.824 -0.217 1.00 0.00 H new ATOM 0 HA ILE A 60 6.794 22.794 2.562 1.00 0.00 H new ATOM 0 HB ILE A 60 8.098 20.725 2.974 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.393 19.503 0.379 1.00 0.00 H new ATOM 0 HG13 ILE A 60 8.595 20.774 0.268 1.00 0.00 H new ATOM 0 HG21 ILE A 60 6.244 19.119 2.667 1.00 0.00 H new ATOM 0 HG22 ILE A 60 5.651 20.692 3.249 1.00 0.00 H new ATOM 0 HG23 ILE A 60 5.457 20.247 1.537 1.00 0.00 H new ATOM 0 HD11 ILE A 60 9.654 18.587 0.546 1.00 0.00 H new ATOM 0 HD12 ILE A 60 9.984 19.625 1.953 1.00 0.00 H new ATOM 0 HD13 ILE A 60 8.764 18.335 2.066 1.00 0.00 H new ATOM 987 N ASP A 61 9.470 22.932 2.524 1.00 0.00 N ATOM 988 CA ASP A 61 10.795 23.546 2.452 1.00 0.00 C ATOM 989 C ASP A 61 11.558 23.116 1.204 1.00 0.00 C ATOM 990 O ASP A 61 12.123 23.950 0.496 1.00 0.00 O ATOM 991 CB ASP A 61 11.607 23.199 3.701 1.00 0.00 C ATOM 992 CG ASP A 61 11.355 24.166 4.842 1.00 0.00 C ATOM 993 OD1 ASP A 61 10.189 24.572 5.030 1.00 0.00 O ATOM 994 OD2 ASP A 61 12.324 24.518 5.547 1.00 0.00 O ATOM 0 H ASP A 61 9.257 22.503 3.424 1.00 0.00 H new ATOM 0 HA ASP A 61 10.650 24.625 2.397 1.00 0.00 H new ATOM 0 HB2 ASP A 61 11.358 22.188 4.024 1.00 0.00 H new ATOM 0 HB3 ASP A 61 12.668 23.202 3.453 1.00 0.00 H new ATOM 999 N GLU A 62 11.575 21.817 0.936 1.00 0.00 N ATOM 1000 CA GLU A 62 12.275 21.294 -0.232 1.00 0.00 C ATOM 1001 C GLU A 62 11.538 21.640 -1.527 1.00 0.00 C ATOM 1002 O GLU A 62 12.008 21.322 -2.619 1.00 0.00 O ATOM 1003 CB GLU A 62 12.447 19.777 -0.118 1.00 0.00 C ATOM 1004 CG GLU A 62 12.826 19.308 1.277 1.00 0.00 C ATOM 1005 CD GLU A 62 13.875 18.214 1.260 1.00 0.00 C ATOM 1006 OE1 GLU A 62 13.527 17.062 0.925 1.00 0.00 O ATOM 1007 OE2 GLU A 62 15.046 18.509 1.580 1.00 0.00 O ATOM 0 H GLU A 62 11.115 21.108 1.508 1.00 0.00 H new ATOM 0 HA GLU A 62 13.258 21.764 -0.265 1.00 0.00 H new ATOM 0 HB2 GLU A 62 11.517 19.292 -0.415 1.00 0.00 H new ATOM 0 HB3 GLU A 62 13.214 19.453 -0.821 1.00 0.00 H new ATOM 0 HG2 GLU A 62 13.200 20.155 1.852 1.00 0.00 H new ATOM 0 HG3 GLU A 62 11.935 18.944 1.788 1.00 0.00 H new ATOM 1014 N GLY A 63 10.383 22.294 -1.404 1.00 0.00 N ATOM 1015 CA GLY A 63 9.615 22.665 -2.578 1.00 0.00 C ATOM 1016 C GLY A 63 8.347 21.849 -2.719 1.00 0.00 C ATOM 1017 O GLY A 63 7.824 21.327 -1.734 1.00 0.00 O ATOM 0 H GLY A 63 9.969 22.572 -0.514 1.00 0.00 H new ATOM 0 HA2 GLY A 63 9.359 23.723 -2.522 1.00 0.00 H new ATOM 0 HA3 GLY A 63 10.230 22.533 -3.468 1.00 0.00 H new ATOM 1021 N ASP A 64 7.850 21.735 -3.946 1.00 0.00 N ATOM 1022 CA ASP A 64 6.635 20.973 -4.207 1.00 0.00 C ATOM 1023 C ASP A 64 6.959 19.506 -4.457 1.00 0.00 C ATOM 1024 O ASP A 64 8.030 19.169 -4.962 1.00 0.00 O ATOM 1025 CB ASP A 64 5.886 21.550 -5.410 1.00 0.00 C ATOM 1026 CG ASP A 64 5.769 23.061 -5.350 1.00 0.00 C ATOM 1027 OD1 ASP A 64 6.819 23.737 -5.336 1.00 0.00 O ATOM 1028 OD2 ASP A 64 4.628 23.567 -5.318 1.00 0.00 O ATOM 0 H ASP A 64 8.269 22.160 -4.773 1.00 0.00 H new ATOM 0 HA ASP A 64 5.999 21.045 -3.325 1.00 0.00 H new ATOM 0 HB2 ASP A 64 6.402 21.265 -6.327 1.00 0.00 H new ATOM 0 HB3 ASP A 64 4.889 21.113 -5.457 1.00 0.00 H new ATOM 1033 N PHE A 65 6.024 18.641 -4.092 1.00 0.00 N ATOM 1034 CA PHE A 65 6.192 17.206 -4.263 1.00 0.00 C ATOM 1035 C PHE A 65 4.833 16.548 -4.454 1.00 0.00 C ATOM 1036 O PHE A 65 3.836 17.249 -4.590 1.00 0.00 O ATOM 1037 CB PHE A 65 6.960 16.632 -3.077 1.00 0.00 C ATOM 1038 CG PHE A 65 8.285 17.316 -2.901 1.00 0.00 C ATOM 1039 CD1 PHE A 65 9.401 16.859 -3.574 1.00 0.00 C ATOM 1040 CD2 PHE A 65 8.403 18.437 -2.096 1.00 0.00 C ATOM 1041 CE1 PHE A 65 10.619 17.500 -3.448 1.00 0.00 C ATOM 1042 CE2 PHE A 65 9.616 19.088 -1.967 1.00 0.00 C ATOM 1043 CZ PHE A 65 10.726 18.618 -2.644 1.00 0.00 C ATOM 0 H PHE A 65 5.135 18.911 -3.672 1.00 0.00 H new ATOM 0 HA PHE A 65 6.779 16.999 -5.158 1.00 0.00 H new ATOM 0 HB2 PHE A 65 6.367 16.744 -2.169 1.00 0.00 H new ATOM 0 HB3 PHE A 65 7.117 15.564 -3.226 1.00 0.00 H new ATOM 0 HD1 PHE A 65 9.321 15.988 -4.208 1.00 0.00 H new ATOM 0 HD2 PHE A 65 7.539 18.806 -1.564 1.00 0.00 H new ATOM 0 HE1 PHE A 65 11.484 17.128 -3.976 1.00 0.00 H new ATOM 0 HE2 PHE A 65 9.696 19.962 -1.338 1.00 0.00 H new ATOM 0 HZ PHE A 65 11.675 19.124 -2.544 1.00 0.00 H new ATOM 1053 N ILE A 66 4.775 15.219 -4.501 1.00 0.00 N ATOM 1054 CA ILE A 66 3.497 14.554 -4.720 1.00 0.00 C ATOM 1055 C ILE A 66 3.414 13.207 -4.018 1.00 0.00 C ATOM 1056 O ILE A 66 4.247 12.329 -4.236 1.00 0.00 O ATOM 1057 CB ILE A 66 3.216 14.340 -6.229 1.00 0.00 C ATOM 1058 CG1 ILE A 66 4.518 14.345 -7.030 1.00 0.00 C ATOM 1059 CG2 ILE A 66 2.261 15.401 -6.755 1.00 0.00 C ATOM 1060 CD1 ILE A 66 5.484 13.278 -6.589 1.00 0.00 C ATOM 0 H ILE A 66 5.576 14.597 -4.393 1.00 0.00 H new ATOM 0 HA ILE A 66 2.745 15.219 -4.296 1.00 0.00 H new ATOM 0 HB ILE A 66 2.745 13.365 -6.350 1.00 0.00 H new ATOM 0 HG12 ILE A 66 4.289 14.206 -8.086 1.00 0.00 H new ATOM 0 HG13 ILE A 66 4.994 15.321 -6.933 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.078 15.232 -7.816 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.319 15.344 -6.210 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.702 16.388 -6.616 1.00 0.00 H new ATOM 0 HD11 ILE A 66 6.388 13.333 -7.195 1.00 0.00 H new ATOM 0 HD12 ILE A 66 5.740 13.430 -5.540 1.00 0.00 H new ATOM 0 HD13 ILE A 66 5.024 12.297 -6.712 1.00 0.00 H new ATOM 1072 N MET A 67 2.384 13.029 -3.199 1.00 0.00 N ATOM 1073 CA MET A 67 2.198 11.764 -2.511 1.00 0.00 C ATOM 1074 C MET A 67 1.868 10.694 -3.537 1.00 0.00 C ATOM 1075 O MET A 67 0.806 10.720 -4.159 1.00 0.00 O ATOM 1076 CB MET A 67 1.080 11.863 -1.476 1.00 0.00 C ATOM 1077 CG MET A 67 1.223 13.046 -0.536 1.00 0.00 C ATOM 1078 SD MET A 67 -0.149 13.189 0.629 1.00 0.00 S ATOM 1079 CE MET A 67 -1.506 12.540 -0.343 1.00 0.00 C ATOM 0 H MET A 67 1.676 13.735 -2.999 1.00 0.00 H new ATOM 0 HA MET A 67 3.116 11.505 -1.984 1.00 0.00 H new ATOM 0 HB2 MET A 67 0.123 11.935 -1.993 1.00 0.00 H new ATOM 0 HB3 MET A 67 1.057 10.945 -0.889 1.00 0.00 H new ATOM 0 HG2 MET A 67 2.156 12.951 0.019 1.00 0.00 H new ATOM 0 HG3 MET A 67 1.292 13.963 -1.122 1.00 0.00 H new ATOM 0 HE1 MET A 67 -2.340 13.242 -0.318 1.00 0.00 H new ATOM 0 HE2 MET A 67 -1.181 12.400 -1.374 1.00 0.00 H new ATOM 0 HE3 MET A 67 -1.824 11.583 0.070 1.00 0.00 H new ATOM 1089 N LEU A 68 2.793 9.771 -3.729 1.00 0.00 N ATOM 1090 CA LEU A 68 2.607 8.707 -4.708 1.00 0.00 C ATOM 1091 C LEU A 68 1.533 7.716 -4.257 1.00 0.00 C ATOM 1092 O LEU A 68 1.840 6.621 -3.787 1.00 0.00 O ATOM 1093 CB LEU A 68 3.935 7.984 -4.975 1.00 0.00 C ATOM 1094 CG LEU A 68 4.126 7.490 -6.411 1.00 0.00 C ATOM 1095 CD1 LEU A 68 5.051 8.427 -7.176 1.00 0.00 C ATOM 1096 CD2 LEU A 68 4.677 6.072 -6.419 1.00 0.00 C ATOM 0 H LEU A 68 3.678 9.733 -3.224 1.00 0.00 H new ATOM 0 HA LEU A 68 2.267 9.163 -5.638 1.00 0.00 H new ATOM 0 HB2 LEU A 68 4.755 8.658 -4.727 1.00 0.00 H new ATOM 0 HB3 LEU A 68 4.009 7.131 -4.301 1.00 0.00 H new ATOM 0 HG LEU A 68 3.155 7.483 -6.906 1.00 0.00 H new ATOM 0 HD11 LEU A 68 5.177 8.062 -8.195 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.618 9.427 -7.200 1.00 0.00 H new ATOM 0 HD13 LEU A 68 6.022 8.464 -6.681 1.00 0.00 H new ATOM 0 HD21 LEU A 68 4.806 5.738 -7.448 1.00 0.00 H new ATOM 0 HD22 LEU A 68 5.639 6.053 -5.908 1.00 0.00 H new ATOM 0 HD23 LEU A 68 3.981 5.408 -5.907 1.00 0.00 H new ATOM 1108 N THR A 69 0.268 8.112 -4.417 1.00 0.00 N ATOM 1109 CA THR A 69 -0.862 7.262 -4.040 1.00 0.00 C ATOM 1110 C THR A 69 -1.090 6.170 -5.083 1.00 0.00 C ATOM 1111 O THR A 69 -1.772 5.180 -4.818 1.00 0.00 O ATOM 1112 CB THR A 69 -2.138 8.102 -3.873 1.00 0.00 C ATOM 1113 OG1 THR A 69 -1.994 9.362 -4.504 1.00 0.00 O ATOM 1114 CG2 THR A 69 -2.517 8.357 -2.425 1.00 0.00 C ATOM 0 H THR A 69 0.001 9.017 -4.805 1.00 0.00 H new ATOM 0 HA THR A 69 -0.624 6.790 -3.087 1.00 0.00 H new ATOM 0 HB THR A 69 -2.928 7.510 -4.336 1.00 0.00 H new ATOM 0 HG1 THR A 69 -1.860 9.233 -5.466 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.427 8.956 -2.387 1.00 0.00 H new ATOM 0 HG22 THR A 69 -2.687 7.406 -1.921 1.00 0.00 H new ATOM 0 HG23 THR A 69 -1.709 8.893 -1.926 1.00 0.00 H new ATOM 1122 N GLN A 70 -0.511 6.353 -6.268 1.00 0.00 N ATOM 1123 CA GLN A 70 -0.649 5.379 -7.345 1.00 0.00 C ATOM 1124 C GLN A 70 -0.003 4.046 -6.969 1.00 0.00 C ATOM 1125 O GLN A 70 -0.241 3.028 -7.619 1.00 0.00 O ATOM 1126 CB GLN A 70 -0.018 5.918 -8.630 1.00 0.00 C ATOM 1127 CG GLN A 70 -0.975 6.740 -9.479 1.00 0.00 C ATOM 1128 CD GLN A 70 -0.691 6.616 -10.963 1.00 0.00 C ATOM 1129 OE1 GLN A 70 -0.569 5.512 -11.493 1.00 0.00 O ATOM 1130 NE2 GLN A 70 -0.584 7.753 -11.642 1.00 0.00 N ATOM 0 H GLN A 70 0.057 7.166 -6.505 1.00 0.00 H new ATOM 0 HA GLN A 70 -1.713 5.210 -7.510 1.00 0.00 H new ATOM 0 HB2 GLN A 70 0.845 6.532 -8.372 1.00 0.00 H new ATOM 0 HB3 GLN A 70 0.353 5.081 -9.222 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -1.998 6.420 -9.281 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -0.907 7.788 -9.186 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -0.693 8.646 -11.161 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -0.393 7.733 -12.644 1.00 0.00 H new ATOM 1139 N GLN A 71 0.811 4.055 -5.915 1.00 0.00 N ATOM 1140 CA GLN A 71 1.479 2.845 -5.456 1.00 0.00 C ATOM 1141 C GLN A 71 1.109 2.561 -4.007 1.00 0.00 C ATOM 1142 O GLN A 71 0.630 1.478 -3.680 1.00 0.00 O ATOM 1143 CB GLN A 71 2.996 2.988 -5.592 1.00 0.00 C ATOM 1144 CG GLN A 71 3.742 1.666 -5.513 1.00 0.00 C ATOM 1145 CD GLN A 71 5.247 1.843 -5.561 1.00 0.00 C ATOM 1146 OE1 GLN A 71 5.890 1.519 -6.560 1.00 0.00 O ATOM 1147 NE2 GLN A 71 5.818 2.358 -4.478 1.00 0.00 N ATOM 0 H GLN A 71 1.022 4.888 -5.365 1.00 0.00 H new ATOM 0 HA GLN A 71 1.151 2.010 -6.076 1.00 0.00 H new ATOM 0 HB2 GLN A 71 3.223 3.467 -6.544 1.00 0.00 H new ATOM 0 HB3 GLN A 71 3.362 3.649 -4.807 1.00 0.00 H new ATOM 0 HG2 GLN A 71 3.469 1.154 -4.590 1.00 0.00 H new ATOM 0 HG3 GLN A 71 3.428 1.026 -6.338 1.00 0.00 H new ATOM 0 HE21 GLN A 71 5.247 2.613 -3.672 1.00 0.00 H new ATOM 0 HE22 GLN A 71 6.828 2.499 -4.452 1.00 0.00 H new ATOM 1156 N MET A 72 1.322 3.554 -3.146 1.00 0.00 N ATOM 1157 CA MET A 72 0.999 3.435 -1.725 1.00 0.00 C ATOM 1158 C MET A 72 1.489 2.111 -1.142 1.00 0.00 C ATOM 1159 O MET A 72 0.944 1.048 -1.438 1.00 0.00 O ATOM 1160 CB MET A 72 -0.508 3.570 -1.526 1.00 0.00 C ATOM 1161 CG MET A 72 -0.899 3.960 -0.110 1.00 0.00 C ATOM 1162 SD MET A 72 -2.049 5.348 -0.060 1.00 0.00 S ATOM 1163 CE MET A 72 -2.300 5.517 1.706 1.00 0.00 C ATOM 0 H MET A 72 1.719 4.456 -3.410 1.00 0.00 H new ATOM 0 HA MET A 72 1.512 4.238 -1.196 1.00 0.00 H new ATOM 0 HB2 MET A 72 -0.893 4.317 -2.220 1.00 0.00 H new ATOM 0 HB3 MET A 72 -0.986 2.624 -1.779 1.00 0.00 H new ATOM 0 HG2 MET A 72 -1.351 3.101 0.387 1.00 0.00 H new ATOM 0 HG3 MET A 72 -0.001 4.217 0.452 1.00 0.00 H new ATOM 0 HE1 MET A 72 -2.297 6.573 1.974 1.00 0.00 H new ATOM 0 HE2 MET A 72 -3.258 5.075 1.981 1.00 0.00 H new ATOM 0 HE3 MET A 72 -1.498 5.005 2.238 1.00 0.00 H new ATOM 1173 N THR A 73 2.519 2.182 -0.309 1.00 0.00 N ATOM 1174 CA THR A 73 3.079 0.986 0.307 1.00 0.00 C ATOM 1175 C THR A 73 3.568 1.268 1.724 1.00 0.00 C ATOM 1176 O THR A 73 4.276 2.247 1.959 1.00 0.00 O ATOM 1177 CB THR A 73 4.235 0.458 -0.543 1.00 0.00 C ATOM 1178 OG1 THR A 73 4.948 -0.551 0.150 1.00 0.00 O ATOM 1179 CG2 THR A 73 5.227 1.534 -0.937 1.00 0.00 C ATOM 0 H THR A 73 2.982 3.052 -0.045 1.00 0.00 H new ATOM 0 HA THR A 73 2.291 0.235 0.364 1.00 0.00 H new ATOM 0 HB THR A 73 3.772 0.063 -1.447 1.00 0.00 H new ATOM 0 HG1 THR A 73 4.365 -0.959 0.824 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.022 1.093 -1.539 1.00 0.00 H new ATOM 0 HG22 THR A 73 4.718 2.304 -1.517 1.00 0.00 H new ATOM 0 HG23 THR A 73 5.656 1.980 -0.040 1.00 0.00 H new ATOM 1187 N SER A 74 3.202 0.400 2.666 1.00 0.00 N ATOM 1188 CA SER A 74 3.631 0.570 4.048 1.00 0.00 C ATOM 1189 C SER A 74 5.118 0.280 4.170 1.00 0.00 C ATOM 1190 O SER A 74 5.565 -0.849 3.966 1.00 0.00 O ATOM 1191 CB SER A 74 2.834 -0.337 4.991 1.00 0.00 C ATOM 1192 OG SER A 74 1.458 -0.340 4.654 1.00 0.00 O ATOM 0 H SER A 74 2.616 -0.418 2.498 1.00 0.00 H new ATOM 0 HA SER A 74 3.443 1.604 4.338 1.00 0.00 H new ATOM 0 HB2 SER A 74 3.226 -1.353 4.941 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.959 0.003 6.019 1.00 0.00 H new ATOM 0 HG SER A 74 1.228 -1.191 4.227 1.00 0.00 H new ATOM 1198 N VAL A 75 5.879 1.313 4.501 1.00 0.00 N ATOM 1199 CA VAL A 75 7.321 1.187 4.651 1.00 0.00 C ATOM 1200 C VAL A 75 7.678 0.922 6.111 1.00 0.00 C ATOM 1201 O VAL A 75 7.320 1.701 6.995 1.00 0.00 O ATOM 1202 CB VAL A 75 8.057 2.441 4.143 1.00 0.00 C ATOM 1203 CG1 VAL A 75 9.436 2.054 3.656 1.00 0.00 C ATOM 1204 CG2 VAL A 75 7.281 3.123 3.024 1.00 0.00 C ATOM 0 H VAL A 75 5.519 2.252 4.672 1.00 0.00 H new ATOM 0 HA VAL A 75 7.645 0.343 4.043 1.00 0.00 H new ATOM 0 HB VAL A 75 8.143 3.148 4.968 1.00 0.00 H new ATOM 0 HG11 VAL A 75 9.957 2.941 3.296 1.00 0.00 H new ATOM 0 HG12 VAL A 75 10.000 1.609 4.476 1.00 0.00 H new ATOM 0 HG13 VAL A 75 9.346 1.332 2.844 1.00 0.00 H new ATOM 0 HG21 VAL A 75 7.827 4.004 2.687 1.00 0.00 H new ATOM 0 HG22 VAL A 75 7.160 2.431 2.191 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.300 3.423 3.392 1.00 0.00 H new ATOM 1214 N PRO A 76 8.372 -0.200 6.385 1.00 0.00 N ATOM 1215 CA PRO A 76 8.760 -0.592 7.740 1.00 0.00 C ATOM 1216 C PRO A 76 9.141 0.586 8.630 1.00 0.00 C ATOM 1217 O PRO A 76 9.926 1.450 8.239 1.00 0.00 O ATOM 1218 CB PRO A 76 9.960 -1.496 7.489 1.00 0.00 C ATOM 1219 CG PRO A 76 9.652 -2.167 6.193 1.00 0.00 C ATOM 1220 CD PRO A 76 8.821 -1.194 5.389 1.00 0.00 C ATOM 0 HA PRO A 76 7.940 -1.067 8.279 1.00 0.00 H new ATOM 0 HB2 PRO A 76 10.885 -0.922 7.430 1.00 0.00 H new ATOM 0 HB3 PRO A 76 10.086 -2.222 8.292 1.00 0.00 H new ATOM 0 HG2 PRO A 76 10.569 -2.424 5.662 1.00 0.00 H new ATOM 0 HG3 PRO A 76 9.108 -3.097 6.358 1.00 0.00 H new ATOM 0 HD2 PRO A 76 9.407 -0.728 4.597 1.00 0.00 H new ATOM 0 HD3 PRO A 76 7.976 -1.690 4.911 1.00 0.00 H new ATOM 1228 N VAL A 77 8.565 0.606 9.832 1.00 0.00 N ATOM 1229 CA VAL A 77 8.818 1.667 10.807 1.00 0.00 C ATOM 1230 C VAL A 77 10.287 2.091 10.823 1.00 0.00 C ATOM 1231 O VAL A 77 10.598 3.283 10.827 1.00 0.00 O ATOM 1232 CB VAL A 77 8.409 1.227 12.227 1.00 0.00 C ATOM 1233 CG1 VAL A 77 9.235 0.032 12.678 1.00 0.00 C ATOM 1234 CG2 VAL A 77 8.548 2.383 13.208 1.00 0.00 C ATOM 0 H VAL A 77 7.913 -0.109 10.156 1.00 0.00 H new ATOM 0 HA VAL A 77 8.211 2.519 10.499 1.00 0.00 H new ATOM 0 HB VAL A 77 7.362 0.925 12.204 1.00 0.00 H new ATOM 0 HG11 VAL A 77 8.931 -0.262 13.682 1.00 0.00 H new ATOM 0 HG12 VAL A 77 9.076 -0.800 11.992 1.00 0.00 H new ATOM 0 HG13 VAL A 77 10.291 0.301 12.683 1.00 0.00 H new ATOM 0 HG21 VAL A 77 8.255 2.052 14.204 1.00 0.00 H new ATOM 0 HG22 VAL A 77 9.584 2.720 13.228 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.905 3.205 12.895 1.00 0.00 H new ATOM 1244 N LYS A 78 11.187 1.110 10.830 1.00 0.00 N ATOM 1245 CA LYS A 78 12.628 1.391 10.842 1.00 0.00 C ATOM 1246 C LYS A 78 12.972 2.437 9.804 1.00 0.00 C ATOM 1247 O LYS A 78 13.522 3.497 10.102 1.00 0.00 O ATOM 1248 CB LYS A 78 13.464 0.152 10.526 1.00 0.00 C ATOM 1249 CG LYS A 78 12.663 -0.996 9.964 1.00 0.00 C ATOM 1250 CD LYS A 78 12.027 -1.795 11.085 1.00 0.00 C ATOM 1251 CE LYS A 78 10.694 -2.393 10.665 1.00 0.00 C ATOM 1252 NZ LYS A 78 9.967 -2.994 11.817 1.00 0.00 N ATOM 0 H LYS A 78 10.950 0.118 10.828 1.00 0.00 H new ATOM 0 HA LYS A 78 12.859 1.739 11.849 1.00 0.00 H new ATOM 0 HB2 LYS A 78 14.243 0.423 9.813 1.00 0.00 H new ATOM 0 HB3 LYS A 78 13.966 -0.178 11.436 1.00 0.00 H new ATOM 0 HG2 LYS A 78 11.890 -0.616 9.296 1.00 0.00 H new ATOM 0 HG3 LYS A 78 13.309 -1.642 9.369 1.00 0.00 H new ATOM 0 HD2 LYS A 78 12.703 -2.593 11.392 1.00 0.00 H new ATOM 0 HD3 LYS A 78 11.880 -1.151 11.952 1.00 0.00 H new ATOM 0 HE2 LYS A 78 10.076 -1.619 10.210 1.00 0.00 H new ATOM 0 HE3 LYS A 78 10.862 -3.155 9.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 8.943 -2.866 11.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 10.185 -4.009 11.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 10.265 -2.527 12.697 1.00 0.00 H new ATOM 1266 N ILE A 79 12.649 2.088 8.572 1.00 0.00 N ATOM 1267 CA ILE A 79 12.909 2.928 7.427 1.00 0.00 C ATOM 1268 C ILE A 79 11.758 3.913 7.172 1.00 0.00 C ATOM 1269 O ILE A 79 11.547 4.365 6.049 1.00 0.00 O ATOM 1270 CB ILE A 79 13.232 2.072 6.182 1.00 0.00 C ATOM 1271 CG1 ILE A 79 13.383 2.968 4.933 1.00 0.00 C ATOM 1272 CG2 ILE A 79 12.176 0.986 6.006 1.00 0.00 C ATOM 1273 CD1 ILE A 79 12.339 2.737 3.878 1.00 0.00 C ATOM 0 H ILE A 79 12.195 1.205 8.341 1.00 0.00 H new ATOM 0 HA ILE A 79 13.789 3.533 7.645 1.00 0.00 H new ATOM 0 HB ILE A 79 14.189 1.570 6.323 1.00 0.00 H new ATOM 0 HG12 ILE A 79 13.345 4.012 5.243 1.00 0.00 H new ATOM 0 HG13 ILE A 79 14.368 2.800 4.496 1.00 0.00 H new ATOM 0 HG21 ILE A 79 12.412 0.388 5.126 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.163 0.345 6.887 1.00 0.00 H new ATOM 0 HG23 ILE A 79 11.197 1.448 5.879 1.00 0.00 H new ATOM 0 HD11 ILE A 79 12.518 3.406 3.036 1.00 0.00 H new ATOM 0 HD12 ILE A 79 12.389 1.703 3.537 1.00 0.00 H new ATOM 0 HD13 ILE A 79 11.351 2.934 4.294 1.00 0.00 H new ATOM 1285 N LEU A 80 11.008 4.244 8.227 1.00 0.00 N ATOM 1286 CA LEU A 80 9.883 5.181 8.120 1.00 0.00 C ATOM 1287 C LEU A 80 10.341 6.589 7.779 1.00 0.00 C ATOM 1288 O LEU A 80 9.853 7.570 8.341 1.00 0.00 O ATOM 1289 CB LEU A 80 9.070 5.193 9.415 1.00 0.00 C ATOM 1290 CG LEU A 80 7.712 5.899 9.334 1.00 0.00 C ATOM 1291 CD1 LEU A 80 7.105 5.772 7.940 1.00 0.00 C ATOM 1292 CD2 LEU A 80 6.767 5.329 10.380 1.00 0.00 C ATOM 0 H LEU A 80 11.159 3.877 9.167 1.00 0.00 H new ATOM 0 HA LEU A 80 9.252 4.833 7.302 1.00 0.00 H new ATOM 0 HB2 LEU A 80 8.906 4.163 9.730 1.00 0.00 H new ATOM 0 HB3 LEU A 80 9.664 5.674 10.192 1.00 0.00 H new ATOM 0 HG LEU A 80 7.866 6.959 9.534 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.142 6.283 7.914 1.00 0.00 H new ATOM 0 HD12 LEU A 80 7.775 6.224 7.209 1.00 0.00 H new ATOM 0 HD13 LEU A 80 6.963 4.718 7.700 1.00 0.00 H new ATOM 0 HD21 LEU A 80 5.804 5.836 10.316 1.00 0.00 H new ATOM 0 HD22 LEU A 80 6.628 4.263 10.202 1.00 0.00 H new ATOM 0 HD23 LEU A 80 7.190 5.479 11.373 1.00 0.00 H new ATOM 1304 N SER A 81 11.229 6.680 6.803 1.00 0.00 N ATOM 1305 CA SER A 81 11.704 7.953 6.314 1.00 0.00 C ATOM 1306 C SER A 81 12.357 8.831 7.383 1.00 0.00 C ATOM 1307 O SER A 81 11.771 9.097 8.430 1.00 0.00 O ATOM 1308 CB SER A 81 10.529 8.686 5.700 1.00 0.00 C ATOM 1309 OG SER A 81 10.489 8.513 4.297 1.00 0.00 O ATOM 0 H SER A 81 11.637 5.873 6.332 1.00 0.00 H new ATOM 0 HA SER A 81 12.487 7.749 5.584 1.00 0.00 H new ATOM 0 HB2 SER A 81 9.601 8.321 6.140 1.00 0.00 H new ATOM 0 HB3 SER A 81 10.598 9.748 5.935 1.00 0.00 H new ATOM 0 HG SER A 81 9.934 7.735 4.079 1.00 0.00 H new ATOM 1315 N GLU A 82 13.562 9.317 7.073 1.00 0.00 N ATOM 1316 CA GLU A 82 14.292 10.216 7.963 1.00 0.00 C ATOM 1317 C GLU A 82 13.621 11.592 7.939 1.00 0.00 C ATOM 1318 O GLU A 82 13.679 12.292 6.928 1.00 0.00 O ATOM 1319 CB GLU A 82 15.771 10.342 7.532 1.00 0.00 C ATOM 1320 CG GLU A 82 16.750 9.855 8.589 1.00 0.00 C ATOM 1321 CD GLU A 82 18.166 10.334 8.337 1.00 0.00 C ATOM 1322 OE1 GLU A 82 18.335 11.325 7.596 1.00 0.00 O ATOM 1323 OE2 GLU A 82 19.106 9.719 8.882 1.00 0.00 O ATOM 0 H GLU A 82 14.053 9.099 6.206 1.00 0.00 H new ATOM 0 HA GLU A 82 14.271 9.808 8.974 1.00 0.00 H new ATOM 0 HB2 GLU A 82 15.925 9.773 6.615 1.00 0.00 H new ATOM 0 HB3 GLU A 82 15.987 11.385 7.300 1.00 0.00 H new ATOM 0 HG2 GLU A 82 16.422 10.201 9.569 1.00 0.00 H new ATOM 0 HG3 GLU A 82 16.738 8.765 8.615 1.00 0.00 H new ATOM 1330 N PRO A 83 12.954 11.994 9.040 1.00 0.00 N ATOM 1331 CA PRO A 83 12.252 13.279 9.122 1.00 0.00 C ATOM 1332 C PRO A 83 12.968 14.428 8.416 1.00 0.00 C ATOM 1333 O PRO A 83 13.968 14.952 8.907 1.00 0.00 O ATOM 1334 CB PRO A 83 12.194 13.519 10.625 1.00 0.00 C ATOM 1335 CG PRO A 83 12.021 12.155 11.193 1.00 0.00 C ATOM 1336 CD PRO A 83 12.806 11.225 10.295 1.00 0.00 C ATOM 0 HA PRO A 83 11.284 13.243 8.623 1.00 0.00 H new ATOM 0 HB2 PRO A 83 13.105 13.992 10.990 1.00 0.00 H new ATOM 0 HB3 PRO A 83 11.365 14.173 10.894 1.00 0.00 H new ATOM 0 HG2 PRO A 83 12.389 12.110 12.218 1.00 0.00 H new ATOM 0 HG3 PRO A 83 10.968 11.874 11.220 1.00 0.00 H new ATOM 0 HD2 PRO A 83 13.774 10.973 10.727 1.00 0.00 H new ATOM 0 HD3 PRO A 83 12.277 10.286 10.130 1.00 0.00 H new ATOM 1344 N VAL A 84 12.424 14.827 7.269 1.00 0.00 N ATOM 1345 CA VAL A 84 12.975 15.930 6.492 1.00 0.00 C ATOM 1346 C VAL A 84 12.221 17.220 6.815 1.00 0.00 C ATOM 1347 O VAL A 84 12.796 18.309 6.828 1.00 0.00 O ATOM 1348 CB VAL A 84 12.872 15.662 4.977 1.00 0.00 C ATOM 1349 CG1 VAL A 84 11.420 15.455 4.566 1.00 0.00 C ATOM 1350 CG2 VAL A 84 13.500 16.801 4.187 1.00 0.00 C ATOM 0 H VAL A 84 11.596 14.398 6.856 1.00 0.00 H new ATOM 0 HA VAL A 84 14.027 16.027 6.759 1.00 0.00 H new ATOM 0 HB VAL A 84 13.422 14.748 4.752 1.00 0.00 H new ATOM 0 HG11 VAL A 84 11.369 15.267 3.494 1.00 0.00 H new ATOM 0 HG12 VAL A 84 11.008 14.601 5.104 1.00 0.00 H new ATOM 0 HG13 VAL A 84 10.843 16.348 4.806 1.00 0.00 H new ATOM 0 HG21 VAL A 84 13.417 16.593 3.120 1.00 0.00 H new ATOM 0 HG22 VAL A 84 12.982 17.732 4.416 1.00 0.00 H new ATOM 0 HG23 VAL A 84 14.552 16.895 4.458 1.00 0.00 H new ATOM 1360 N ASN A 85 10.921 17.073 7.070 1.00 0.00 N ATOM 1361 CA ASN A 85 10.051 18.201 7.392 1.00 0.00 C ATOM 1362 C ASN A 85 8.742 17.702 8.012 1.00 0.00 C ATOM 1363 O ASN A 85 8.702 16.618 8.595 1.00 0.00 O ATOM 1364 CB ASN A 85 9.767 19.020 6.129 1.00 0.00 C ATOM 1365 CG ASN A 85 9.833 20.513 6.382 1.00 0.00 C ATOM 1366 OD1 ASN A 85 10.860 21.037 6.813 1.00 0.00 O ATOM 1367 ND2 ASN A 85 8.733 21.208 6.115 1.00 0.00 N ATOM 0 H ASN A 85 10.444 16.172 7.059 1.00 0.00 H new ATOM 0 HA ASN A 85 10.554 18.840 8.118 1.00 0.00 H new ATOM 0 HB2 ASN A 85 10.488 18.753 5.356 1.00 0.00 H new ATOM 0 HB3 ASN A 85 8.779 18.762 5.746 1.00 0.00 H new ATOM 0 HD21 ASN A 85 8.718 22.217 6.266 1.00 0.00 H new ATOM 0 HD22 ASN A 85 7.904 20.733 5.759 1.00 0.00 H new ATOM 1374 N GLU A 86 7.673 18.486 7.880 1.00 0.00 N ATOM 1375 CA GLU A 86 6.376 18.111 8.421 1.00 0.00 C ATOM 1376 C GLU A 86 5.278 18.838 7.669 1.00 0.00 C ATOM 1377 O GLU A 86 5.334 20.056 7.504 1.00 0.00 O ATOM 1378 CB GLU A 86 6.294 18.439 9.913 1.00 0.00 C ATOM 1379 CG GLU A 86 7.497 17.961 10.710 1.00 0.00 C ATOM 1380 CD GLU A 86 7.341 18.202 12.199 1.00 0.00 C ATOM 1381 OE1 GLU A 86 6.341 17.727 12.777 1.00 0.00 O ATOM 1382 OE2 GLU A 86 8.220 18.867 12.788 1.00 0.00 O ATOM 0 H GLU A 86 7.684 19.386 7.401 1.00 0.00 H new ATOM 0 HA GLU A 86 6.247 17.035 8.300 1.00 0.00 H new ATOM 0 HB2 GLU A 86 6.194 19.518 10.034 1.00 0.00 H new ATOM 0 HB3 GLU A 86 5.392 17.987 10.326 1.00 0.00 H new ATOM 0 HG2 GLU A 86 7.647 16.896 10.531 1.00 0.00 H new ATOM 0 HG3 GLU A 86 8.391 18.473 10.354 1.00 0.00 H new ATOM 1389 N LEU A 87 4.281 18.097 7.201 1.00 0.00 N ATOM 1390 CA LEU A 87 3.194 18.716 6.459 1.00 0.00 C ATOM 1391 C LEU A 87 1.816 18.298 6.958 1.00 0.00 C ATOM 1392 O LEU A 87 1.028 17.677 6.244 1.00 0.00 O ATOM 1393 CB LEU A 87 3.296 18.438 4.978 1.00 0.00 C ATOM 1394 CG LEU A 87 4.079 17.197 4.585 1.00 0.00 C ATOM 1395 CD1 LEU A 87 3.579 15.994 5.376 1.00 0.00 C ATOM 1396 CD2 LEU A 87 3.949 16.978 3.087 1.00 0.00 C ATOM 0 H LEU A 87 4.204 17.087 7.319 1.00 0.00 H new ATOM 0 HA LEU A 87 3.302 19.787 6.632 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.287 18.349 4.575 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.757 19.301 4.497 1.00 0.00 H new ATOM 0 HG LEU A 87 5.135 17.329 4.822 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.146 15.108 5.088 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.711 16.179 6.442 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.522 15.833 5.164 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.509 16.088 2.799 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.899 16.845 2.829 1.00 0.00 H new ATOM 0 HD23 LEU A 87 4.346 17.844 2.557 1.00 0.00 H new ATOM 1408 N SER A 88 1.537 18.688 8.172 1.00 0.00 N ATOM 1409 CA SER A 88 0.251 18.426 8.810 1.00 0.00 C ATOM 1410 C SER A 88 -0.814 19.270 8.163 1.00 0.00 C ATOM 1411 O SER A 88 -1.935 18.825 7.987 1.00 0.00 O ATOM 1412 CB SER A 88 0.305 18.712 10.306 1.00 0.00 C ATOM 1413 OG SER A 88 1.318 17.950 10.939 1.00 0.00 O ATOM 0 H SER A 88 2.193 19.201 8.761 1.00 0.00 H new ATOM 0 HA SER A 88 0.013 17.370 8.680 1.00 0.00 H new ATOM 0 HB2 SER A 88 0.490 19.774 10.469 1.00 0.00 H new ATOM 0 HB3 SER A 88 -0.661 18.484 10.757 1.00 0.00 H new ATOM 0 HG SER A 88 1.456 17.115 10.445 1.00 0.00 H new ATOM 1419 N THR A 89 -0.455 20.486 7.779 1.00 0.00 N ATOM 1420 CA THR A 89 -1.405 21.357 7.114 1.00 0.00 C ATOM 1421 C THR A 89 -1.934 20.652 5.873 1.00 0.00 C ATOM 1422 O THR A 89 -3.044 20.915 5.410 1.00 0.00 O ATOM 1423 CB THR A 89 -0.747 22.678 6.727 1.00 0.00 C ATOM 1424 OG1 THR A 89 -1.735 23.647 6.425 1.00 0.00 O ATOM 1425 CG2 THR A 89 0.177 22.559 5.530 1.00 0.00 C ATOM 0 H THR A 89 0.474 20.885 7.915 1.00 0.00 H new ATOM 0 HA THR A 89 -2.228 21.577 7.794 1.00 0.00 H new ATOM 0 HB THR A 89 -0.149 22.977 7.588 1.00 0.00 H new ATOM 0 HG1 THR A 89 -1.301 24.491 6.180 1.00 0.00 H new ATOM 0 HG21 THR A 89 0.612 23.533 5.308 1.00 0.00 H new ATOM 0 HG22 THR A 89 0.973 21.849 5.754 1.00 0.00 H new ATOM 0 HG23 THR A 89 -0.389 22.209 4.667 1.00 0.00 H new ATOM 1433 N PHE A 90 -1.120 19.734 5.359 1.00 0.00 N ATOM 1434 CA PHE A 90 -1.481 18.952 4.187 1.00 0.00 C ATOM 1435 C PHE A 90 -2.132 17.636 4.614 1.00 0.00 C ATOM 1436 O PHE A 90 -2.362 16.747 3.794 1.00 0.00 O ATOM 1437 CB PHE A 90 -0.235 18.679 3.348 1.00 0.00 C ATOM 1438 CG PHE A 90 0.130 19.796 2.414 1.00 0.00 C ATOM 1439 CD1 PHE A 90 -0.703 20.150 1.363 1.00 0.00 C ATOM 1440 CD2 PHE A 90 1.313 20.494 2.586 1.00 0.00 C ATOM 1441 CE1 PHE A 90 -0.357 21.180 0.508 1.00 0.00 C ATOM 1442 CE2 PHE A 90 1.659 21.514 1.744 1.00 0.00 C ATOM 1443 CZ PHE A 90 0.828 21.864 0.703 1.00 0.00 C ATOM 0 H PHE A 90 -0.200 19.515 5.741 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.196 19.514 3.587 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.605 18.488 4.016 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.393 17.770 2.767 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.630 19.617 1.211 1.00 0.00 H new ATOM 0 HD2 PHE A 90 1.973 20.229 3.398 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -1.010 21.449 -0.309 1.00 0.00 H new ATOM 0 HE2 PHE A 90 2.586 22.047 1.896 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.102 22.672 0.040 1.00 0.00 H new ATOM 1453 N ARG A 91 -2.418 17.525 5.913 1.00 0.00 N ATOM 1454 CA ARG A 91 -3.036 16.332 6.487 1.00 0.00 C ATOM 1455 C ARG A 91 -4.156 15.791 5.607 1.00 0.00 C ATOM 1456 O ARG A 91 -4.147 14.616 5.241 1.00 0.00 O ATOM 1457 CB ARG A 91 -3.585 16.640 7.873 1.00 0.00 C ATOM 1458 CG ARG A 91 -4.318 17.944 7.883 1.00 0.00 C ATOM 1459 CD ARG A 91 -4.276 18.638 9.235 1.00 0.00 C ATOM 1460 NE ARG A 91 -5.560 18.571 9.927 1.00 0.00 N ATOM 1461 CZ ARG A 91 -5.730 18.896 11.207 1.00 0.00 C ATOM 1462 NH1 ARG A 91 -4.701 19.310 11.936 1.00 0.00 N ATOM 1463 NH2 ARG A 91 -6.932 18.807 11.759 1.00 0.00 N ATOM 0 H ARG A 91 -2.227 18.260 6.594 1.00 0.00 H new ATOM 0 HA ARG A 91 -2.262 15.568 6.556 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -4.255 15.840 8.188 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -2.767 16.673 8.593 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -3.887 18.603 7.129 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -5.357 17.773 7.601 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -3.506 18.178 9.855 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -3.993 19.682 9.098 1.00 0.00 H new ATOM 0 HE ARG A 91 -6.374 18.257 9.399 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -3.774 19.381 11.516 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -4.837 19.558 12.916 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -7.726 18.490 11.203 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -7.063 19.056 12.740 1.00 0.00 H new ATOM 1477 N ASN A 92 -5.126 16.641 5.264 1.00 0.00 N ATOM 1478 CA ASN A 92 -6.236 16.200 4.427 1.00 0.00 C ATOM 1479 C ASN A 92 -5.717 15.568 3.150 1.00 0.00 C ATOM 1480 O ASN A 92 -6.123 14.469 2.793 1.00 0.00 O ATOM 1481 CB ASN A 92 -7.179 17.343 4.070 1.00 0.00 C ATOM 1482 CG ASN A 92 -8.536 17.197 4.728 1.00 0.00 C ATOM 1483 OD1 ASN A 92 -8.787 17.751 5.798 1.00 0.00 O ATOM 1484 ND2 ASN A 92 -9.421 16.444 4.082 1.00 0.00 N ATOM 0 H ASN A 92 -5.164 17.620 5.548 1.00 0.00 H new ATOM 0 HA ASN A 92 -6.796 15.466 5.007 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -6.731 18.289 4.374 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -7.305 17.383 2.988 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -10.354 16.306 4.471 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -9.167 16.005 3.197 1.00 0.00 H new ATOM 1491 N GLU A 93 -4.804 16.259 2.467 1.00 0.00 N ATOM 1492 CA GLU A 93 -4.225 15.730 1.236 1.00 0.00 C ATOM 1493 C GLU A 93 -3.955 14.256 1.406 1.00 0.00 C ATOM 1494 O GLU A 93 -4.443 13.416 0.651 1.00 0.00 O ATOM 1495 CB GLU A 93 -2.901 16.414 0.914 1.00 0.00 C ATOM 1496 CG GLU A 93 -2.857 17.049 -0.466 1.00 0.00 C ATOM 1497 CD GLU A 93 -3.252 18.512 -0.446 1.00 0.00 C ATOM 1498 OE1 GLU A 93 -4.003 18.913 0.468 1.00 0.00 O ATOM 1499 OE2 GLU A 93 -2.811 19.258 -1.346 1.00 0.00 O ATOM 0 H GLU A 93 -4.454 17.176 2.743 1.00 0.00 H new ATOM 0 HA GLU A 93 -4.932 15.911 0.426 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.708 17.182 1.663 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -2.097 15.683 0.993 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -1.851 16.953 -0.874 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -3.525 16.505 -1.134 1.00 0.00 H new ATOM 1506 N ILE A 94 -3.165 13.964 2.427 1.00 0.00 N ATOM 1507 CA ILE A 94 -2.803 12.607 2.740 1.00 0.00 C ATOM 1508 C ILE A 94 -4.051 11.782 3.039 1.00 0.00 C ATOM 1509 O ILE A 94 -4.136 10.607 2.684 1.00 0.00 O ATOM 1510 CB ILE A 94 -1.847 12.546 3.940 1.00 0.00 C ATOM 1511 CG1 ILE A 94 -0.686 13.524 3.741 1.00 0.00 C ATOM 1512 CG2 ILE A 94 -1.332 11.128 4.124 1.00 0.00 C ATOM 1513 CD1 ILE A 94 -0.309 14.282 4.995 1.00 0.00 C ATOM 0 H ILE A 94 -2.763 14.662 3.053 1.00 0.00 H new ATOM 0 HA ILE A 94 -2.292 12.192 1.871 1.00 0.00 H new ATOM 0 HB ILE A 94 -2.388 12.836 4.841 1.00 0.00 H new ATOM 0 HG12 ILE A 94 0.184 12.973 3.384 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -0.953 14.238 2.962 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -0.655 11.095 4.977 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -2.172 10.456 4.301 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -0.800 10.815 3.226 1.00 0.00 H new ATOM 0 HD11 ILE A 94 0.520 14.955 4.778 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -1.165 14.861 5.342 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -0.010 13.577 5.770 1.00 0.00 H new ATOM 1525 N ILE A 95 -5.024 12.424 3.685 1.00 0.00 N ATOM 1526 CA ILE A 95 -6.283 11.773 4.027 1.00 0.00 C ATOM 1527 C ILE A 95 -7.183 11.661 2.801 1.00 0.00 C ATOM 1528 O ILE A 95 -7.396 10.565 2.297 1.00 0.00 O ATOM 1529 CB ILE A 95 -7.039 12.534 5.135 1.00 0.00 C ATOM 1530 CG1 ILE A 95 -6.142 12.730 6.355 1.00 0.00 C ATOM 1531 CG2 ILE A 95 -8.311 11.790 5.524 1.00 0.00 C ATOM 1532 CD1 ILE A 95 -6.478 13.968 7.159 1.00 0.00 C ATOM 0 H ILE A 95 -4.961 13.398 3.982 1.00 0.00 H new ATOM 0 HA ILE A 95 -6.034 10.778 4.395 1.00 0.00 H new ATOM 0 HB ILE A 95 -7.318 13.514 4.749 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -6.223 11.855 7.000 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -5.104 12.790 6.027 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -8.831 12.342 6.307 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.960 11.698 4.653 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -8.054 10.796 5.891 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -5.801 14.044 8.010 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -6.370 14.851 6.529 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -7.505 13.902 7.517 1.00 0.00 H new ATOM 1544 N ALA A 96 -7.709 12.797 2.312 1.00 0.00 N ATOM 1545 CA ALA A 96 -8.578 12.781 1.131 1.00 0.00 C ATOM 1546 C ALA A 96 -8.072 11.760 0.116 1.00 0.00 C ATOM 1547 O ALA A 96 -8.848 10.987 -0.443 1.00 0.00 O ATOM 1548 CB ALA A 96 -8.672 14.170 0.516 1.00 0.00 C ATOM 0 H ALA A 96 -7.549 13.722 2.711 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.581 12.485 1.438 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -9.321 14.137 -0.359 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -9.084 14.865 1.248 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -7.678 14.504 0.218 1.00 0.00 H new ATOM 1554 N ALA A 97 -6.751 11.716 -0.056 1.00 0.00 N ATOM 1555 CA ALA A 97 -6.123 10.732 -0.933 1.00 0.00 C ATOM 1556 C ALA A 97 -6.636 9.375 -0.549 1.00 0.00 C ATOM 1557 O ALA A 97 -7.389 8.732 -1.269 1.00 0.00 O ATOM 1558 CB ALA A 97 -4.615 10.768 -0.740 1.00 0.00 C ATOM 0 H ALA A 97 -6.096 12.351 0.401 1.00 0.00 H new ATOM 0 HA ALA A 97 -6.356 10.951 -1.975 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -4.147 10.033 -1.395 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -4.241 11.762 -0.984 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -4.375 10.534 0.297 1.00 0.00 H new ATOM 1564 N ILE A 98 -6.243 8.994 0.636 1.00 0.00 N ATOM 1565 CA ILE A 98 -6.637 7.761 1.239 1.00 0.00 C ATOM 1566 C ILE A 98 -8.160 7.635 1.229 1.00 0.00 C ATOM 1567 O ILE A 98 -8.739 6.726 0.649 1.00 0.00 O ATOM 1568 CB ILE A 98 -6.127 7.810 2.684 1.00 0.00 C ATOM 1569 CG1 ILE A 98 -4.639 7.461 2.724 1.00 0.00 C ATOM 1570 CG2 ILE A 98 -6.932 6.913 3.625 1.00 0.00 C ATOM 1571 CD1 ILE A 98 -4.251 6.652 3.933 1.00 0.00 C ATOM 0 H ILE A 98 -5.622 9.553 1.221 1.00 0.00 H new ATOM 0 HA ILE A 98 -6.229 6.906 0.699 1.00 0.00 H new ATOM 0 HB ILE A 98 -6.264 8.829 3.046 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -4.379 6.904 1.824 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -4.056 8.382 2.709 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -6.527 6.987 4.634 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -7.974 7.232 3.628 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.870 5.879 3.284 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -3.183 6.438 3.900 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -4.481 7.216 4.837 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -4.808 5.715 3.938 1.00 0.00 H new ATOM 1583 N ASP A 99 -8.772 8.582 1.906 1.00 0.00 N ATOM 1584 CA ASP A 99 -10.212 8.680 2.061 1.00 0.00 C ATOM 1585 C ASP A 99 -10.989 8.604 0.740 1.00 0.00 C ATOM 1586 O ASP A 99 -12.169 8.267 0.735 1.00 0.00 O ATOM 1587 CB ASP A 99 -10.507 9.986 2.785 1.00 0.00 C ATOM 1588 CG ASP A 99 -11.684 9.876 3.735 1.00 0.00 C ATOM 1589 OD1 ASP A 99 -11.905 8.775 4.281 1.00 0.00 O ATOM 1590 OD2 ASP A 99 -12.384 10.891 3.932 1.00 0.00 O ATOM 0 H ASP A 99 -8.267 9.331 2.380 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.552 7.817 2.634 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -9.623 10.295 3.343 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -10.710 10.766 2.051 1.00 0.00 H new ATOM 1595 N PHE A 100 -10.344 8.920 -0.371 1.00 0.00 N ATOM 1596 CA PHE A 100 -11.009 8.877 -1.669 1.00 0.00 C ATOM 1597 C PHE A 100 -10.561 7.651 -2.439 1.00 0.00 C ATOM 1598 O PHE A 100 -11.349 6.949 -3.072 1.00 0.00 O ATOM 1599 CB PHE A 100 -10.697 10.146 -2.469 1.00 0.00 C ATOM 1600 CG PHE A 100 -11.223 10.123 -3.877 1.00 0.00 C ATOM 1601 CD1 PHE A 100 -12.581 9.996 -4.120 1.00 0.00 C ATOM 1602 CD2 PHE A 100 -10.359 10.229 -4.957 1.00 0.00 C ATOM 1603 CE1 PHE A 100 -13.069 9.975 -5.413 1.00 0.00 C ATOM 1604 CE2 PHE A 100 -10.842 10.208 -6.252 1.00 0.00 C ATOM 1605 CZ PHE A 100 -12.198 10.081 -6.480 1.00 0.00 C ATOM 0 H PHE A 100 -9.366 9.208 -0.404 1.00 0.00 H new ATOM 0 HA PHE A 100 -12.086 8.822 -1.510 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -11.119 11.005 -1.948 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -9.617 10.289 -2.497 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -13.266 9.912 -3.289 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -9.298 10.329 -4.784 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -14.130 9.876 -5.589 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -10.159 10.291 -7.085 1.00 0.00 H new ATOM 0 HZ PHE A 100 -12.577 10.065 -7.491 1.00 0.00 H new ATOM 1615 N LEU A 101 -9.265 7.437 -2.372 1.00 0.00 N ATOM 1616 CA LEU A 101 -8.595 6.342 -3.040 1.00 0.00 C ATOM 1617 C LEU A 101 -8.870 5.018 -2.348 1.00 0.00 C ATOM 1618 O LEU A 101 -9.067 3.991 -2.997 1.00 0.00 O ATOM 1619 CB LEU A 101 -7.099 6.663 -3.038 1.00 0.00 C ATOM 1620 CG LEU A 101 -6.175 5.706 -2.283 1.00 0.00 C ATOM 1621 CD1 LEU A 101 -5.603 4.653 -3.217 1.00 0.00 C ATOM 1622 CD2 LEU A 101 -5.064 6.496 -1.600 1.00 0.00 C ATOM 0 H LEU A 101 -8.633 8.034 -1.839 1.00 0.00 H new ATOM 0 HA LEU A 101 -8.965 6.237 -4.060 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -6.763 6.709 -4.074 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.969 7.660 -2.616 1.00 0.00 H new ATOM 0 HG LEU A 101 -6.754 5.185 -1.520 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.949 3.985 -2.656 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -6.417 4.078 -3.659 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -5.032 5.140 -4.008 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.408 5.811 -1.063 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -4.488 7.037 -2.351 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.501 7.205 -0.897 1.00 0.00 H new ATOM 1634 N ILE A 102 -8.857 5.051 -1.026 1.00 0.00 N ATOM 1635 CA ILE A 102 -9.076 3.858 -0.241 1.00 0.00 C ATOM 1636 C ILE A 102 -10.553 3.673 0.092 1.00 0.00 C ATOM 1637 O ILE A 102 -11.001 2.548 0.316 1.00 0.00 O ATOM 1638 CB ILE A 102 -8.225 3.865 1.058 1.00 0.00 C ATOM 1639 CG1 ILE A 102 -8.931 4.609 2.198 1.00 0.00 C ATOM 1640 CG2 ILE A 102 -6.847 4.479 0.799 1.00 0.00 C ATOM 1641 CD1 ILE A 102 -9.294 3.718 3.365 1.00 0.00 C ATOM 0 H ILE A 102 -8.696 5.895 -0.477 1.00 0.00 H new ATOM 0 HA ILE A 102 -8.756 3.013 -0.851 1.00 0.00 H new ATOM 0 HB ILE A 102 -8.098 2.827 1.367 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -8.285 5.413 2.552 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -9.837 5.075 1.811 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -6.267 4.474 1.722 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -6.326 3.896 0.040 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.965 5.505 0.450 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -9.790 4.310 4.134 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -9.965 2.929 3.025 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -8.389 3.272 3.778 1.00 0.00 H new ATOM 1653 N THR A 103 -11.317 4.770 0.132 1.00 0.00 N ATOM 1654 CA THR A 103 -12.742 4.654 0.450 1.00 0.00 C ATOM 1655 C THR A 103 -13.622 5.383 -0.557 1.00 0.00 C ATOM 1656 O THR A 103 -14.639 4.847 -1.000 1.00 0.00 O ATOM 1657 CB THR A 103 -13.026 5.163 1.866 1.00 0.00 C ATOM 1658 OG1 THR A 103 -12.915 6.572 1.936 1.00 0.00 O ATOM 1659 CG2 THR A 103 -12.097 4.578 2.905 1.00 0.00 C ATOM 0 H THR A 103 -10.986 5.718 -0.046 1.00 0.00 H new ATOM 0 HA THR A 103 -12.992 3.594 0.395 1.00 0.00 H new ATOM 0 HB THR A 103 -14.045 4.843 2.084 1.00 0.00 H new ATOM 0 HG1 THR A 103 -12.447 6.903 1.141 1.00 0.00 H new ATOM 0 HG21 THR A 103 -12.350 4.979 3.887 1.00 0.00 H new ATOM 0 HG22 THR A 103 -12.202 3.493 2.918 1.00 0.00 H new ATOM 0 HG23 THR A 103 -11.067 4.840 2.661 1.00 0.00 H new ATOM 1667 N GLY A 104 -13.248 6.605 -0.908 1.00 0.00 N ATOM 1668 CA GLY A 104 -14.044 7.370 -1.849 1.00 0.00 C ATOM 1669 C GLY A 104 -15.025 8.282 -1.141 1.00 0.00 C ATOM 1670 O GLY A 104 -15.352 9.362 -1.634 1.00 0.00 O ATOM 0 H GLY A 104 -12.414 7.079 -0.562 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -13.386 7.965 -2.483 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -14.588 6.689 -2.504 1.00 0.00 H new ATOM 1674 N ILE A 105 -15.491 7.842 0.026 1.00 0.00 N ATOM 1675 CA ILE A 105 -16.435 8.613 0.820 1.00 0.00 C ATOM 1676 C ILE A 105 -17.779 8.740 0.110 1.00 0.00 C ATOM 1677 O ILE A 105 -17.935 9.682 -0.695 1.00 0.00 O ATOM 1678 CB ILE A 105 -15.889 10.015 1.128 1.00 0.00 C ATOM 1679 CG1 ILE A 105 -14.499 9.920 1.761 1.00 0.00 C ATOM 1680 CG2 ILE A 105 -16.843 10.780 2.036 1.00 0.00 C ATOM 1681 CD1 ILE A 105 -13.442 10.641 0.964 1.00 0.00 C ATOM 1682 OXT ILE A 105 -18.664 7.895 0.363 1.00 0.00 O ATOM 0 H ILE A 105 -15.226 6.949 0.442 1.00 0.00 H new ATOM 0 HA ILE A 105 -16.578 8.074 1.757 1.00 0.00 H new ATOM 0 HB ILE A 105 -15.804 10.563 0.190 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -14.535 10.336 2.768 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -14.221 8.871 1.859 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -16.435 11.770 2.240 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -17.811 10.880 1.545 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -16.966 10.238 2.973 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -12.478 10.539 1.462 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -13.382 10.209 -0.035 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -13.701 11.697 0.888 1.00 0.00 H new ATOM 1695 N MET B 1 -11.291 -9.813 -14.632 1.00 0.00 N ATOM 1696 CA MET B 1 -11.950 -8.722 -13.868 1.00 0.00 C ATOM 1697 C MET B 1 -10.925 -7.869 -13.127 1.00 0.00 C ATOM 1698 O MET B 1 -9.719 -8.078 -13.259 1.00 0.00 O ATOM 1699 CB MET B 1 -12.933 -9.347 -12.875 1.00 0.00 C ATOM 1700 CG MET B 1 -12.300 -10.389 -11.968 1.00 0.00 C ATOM 1701 SD MET B 1 -12.328 -12.043 -12.684 1.00 0.00 S ATOM 1702 CE MET B 1 -12.517 -13.046 -11.212 1.00 0.00 C ATOM 0 H1 MET B 1 -11.512 -9.711 -15.643 1.00 0.00 H new ATOM 0 H2 MET B 1 -10.261 -9.760 -14.495 1.00 0.00 H new ATOM 0 H3 MET B 1 -11.638 -10.733 -14.293 1.00 0.00 H new ATOM 0 HA MET B 1 -12.479 -8.069 -14.562 1.00 0.00 H new ATOM 0 HB2 MET B 1 -13.367 -8.558 -12.261 1.00 0.00 H new ATOM 0 HB3 MET B 1 -13.752 -9.808 -13.428 1.00 0.00 H new ATOM 0 HG2 MET B 1 -11.268 -10.105 -11.760 1.00 0.00 H new ATOM 0 HG3 MET B 1 -12.826 -10.402 -11.013 1.00 0.00 H new ATOM 0 HE1 MET B 1 -11.668 -13.724 -11.122 1.00 0.00 H new ATOM 0 HE2 MET B 1 -12.560 -12.400 -10.335 1.00 0.00 H new ATOM 0 HE3 MET B 1 -13.438 -13.625 -11.282 1.00 0.00 H new ATOM 1714 N SER B 2 -11.413 -6.909 -12.349 1.00 0.00 N ATOM 1715 CA SER B 2 -10.538 -6.024 -11.587 1.00 0.00 C ATOM 1716 C SER B 2 -11.050 -5.864 -10.155 1.00 0.00 C ATOM 1717 O SER B 2 -11.502 -4.784 -9.775 1.00 0.00 O ATOM 1718 CB SER B 2 -10.459 -4.654 -12.281 1.00 0.00 C ATOM 1719 OG SER B 2 -10.338 -4.805 -13.685 1.00 0.00 O ATOM 0 H SER B 2 -12.409 -6.723 -12.229 1.00 0.00 H new ATOM 0 HA SER B 2 -9.541 -6.463 -11.545 1.00 0.00 H new ATOM 0 HB2 SER B 2 -11.351 -4.072 -12.049 1.00 0.00 H new ATOM 0 HB3 SER B 2 -9.606 -4.096 -11.896 1.00 0.00 H new ATOM 0 HG SER B 2 -10.355 -3.923 -14.112 1.00 0.00 H new ATOM 1725 N GLN B 3 -10.965 -6.946 -9.363 1.00 0.00 N ATOM 1726 CA GLN B 3 -11.412 -6.934 -7.959 1.00 0.00 C ATOM 1727 C GLN B 3 -11.895 -8.315 -7.496 1.00 0.00 C ATOM 1728 O GLN B 3 -12.552 -9.043 -8.240 1.00 0.00 O ATOM 1729 CB GLN B 3 -12.541 -5.908 -7.748 1.00 0.00 C ATOM 1730 CG GLN B 3 -13.382 -6.151 -6.501 1.00 0.00 C ATOM 1731 CD GLN B 3 -14.228 -4.950 -6.126 1.00 0.00 C ATOM 1732 OE1 GLN B 3 -14.909 -4.368 -6.970 1.00 0.00 O ATOM 1733 NE2 GLN B 3 -14.187 -4.572 -4.853 1.00 0.00 N ATOM 0 H GLN B 3 -10.590 -7.843 -9.672 1.00 0.00 H new ATOM 0 HA GLN B 3 -10.546 -6.652 -7.361 1.00 0.00 H new ATOM 0 HB2 GLN B 3 -12.104 -4.911 -7.689 1.00 0.00 H new ATOM 0 HB3 GLN B 3 -13.194 -5.919 -8.621 1.00 0.00 H new ATOM 0 HG2 GLN B 3 -14.031 -7.011 -6.667 1.00 0.00 H new ATOM 0 HG3 GLN B 3 -12.726 -6.403 -5.668 1.00 0.00 H new ATOM 0 HE21 GLN B 3 -13.608 -5.084 -4.187 1.00 0.00 H new ATOM 0 HE22 GLN B 3 -14.734 -3.770 -4.541 1.00 0.00 H new ATOM 1742 N PHE B 4 -11.597 -8.630 -6.236 1.00 0.00 N ATOM 1743 CA PHE B 4 -12.023 -9.882 -5.603 1.00 0.00 C ATOM 1744 C PHE B 4 -11.419 -11.137 -6.231 1.00 0.00 C ATOM 1745 O PHE B 4 -12.067 -12.183 -6.275 1.00 0.00 O ATOM 1746 CB PHE B 4 -13.549 -9.979 -5.616 1.00 0.00 C ATOM 1747 CG PHE B 4 -14.226 -9.101 -4.596 1.00 0.00 C ATOM 1748 CD1 PHE B 4 -13.499 -8.200 -3.827 1.00 0.00 C ATOM 1749 CD2 PHE B 4 -15.596 -9.179 -4.409 1.00 0.00 C ATOM 1750 CE1 PHE B 4 -14.127 -7.396 -2.896 1.00 0.00 C ATOM 1751 CE2 PHE B 4 -16.230 -8.377 -3.479 1.00 0.00 C ATOM 1752 CZ PHE B 4 -15.495 -7.484 -2.721 1.00 0.00 C ATOM 0 H PHE B 4 -11.052 -8.024 -5.622 1.00 0.00 H new ATOM 0 HA PHE B 4 -11.648 -9.845 -4.580 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -13.912 -9.712 -6.609 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -13.839 -11.015 -5.439 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -12.430 -8.128 -3.959 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -16.176 -9.875 -4.997 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -13.550 -6.700 -2.306 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -17.299 -8.448 -3.344 1.00 0.00 H new ATOM 0 HZ PHE B 4 -15.989 -6.857 -1.994 1.00 0.00 H new ATOM 1762 N THR B 5 -10.175 -11.055 -6.678 1.00 0.00 N ATOM 1763 CA THR B 5 -9.501 -12.207 -7.251 1.00 0.00 C ATOM 1764 C THR B 5 -8.254 -12.523 -6.439 1.00 0.00 C ATOM 1765 O THR B 5 -7.698 -11.647 -5.778 1.00 0.00 O ATOM 1766 CB THR B 5 -9.100 -11.934 -8.700 1.00 0.00 C ATOM 1767 OG1 THR B 5 -9.994 -11.019 -9.308 1.00 0.00 O ATOM 1768 CG2 THR B 5 -9.053 -13.178 -9.565 1.00 0.00 C ATOM 0 H THR B 5 -9.614 -10.204 -6.655 1.00 0.00 H new ATOM 0 HA THR B 5 -10.186 -13.054 -7.229 1.00 0.00 H new ATOM 0 HB THR B 5 -8.093 -11.522 -8.640 1.00 0.00 H new ATOM 0 HG1 THR B 5 -9.488 -10.272 -9.690 1.00 0.00 H new ATOM 0 HG21 THR B 5 -8.761 -12.905 -10.579 1.00 0.00 H new ATOM 0 HG22 THR B 5 -8.326 -13.879 -9.155 1.00 0.00 H new ATOM 0 HG23 THR B 5 -10.038 -13.645 -9.584 1.00 0.00 H new ATOM 1776 N LEU B 6 -7.796 -13.759 -6.517 1.00 0.00 N ATOM 1777 CA LEU B 6 -6.585 -14.153 -5.819 1.00 0.00 C ATOM 1778 C LEU B 6 -5.433 -14.001 -6.780 1.00 0.00 C ATOM 1779 O LEU B 6 -5.009 -14.968 -7.414 1.00 0.00 O ATOM 1780 CB LEU B 6 -6.667 -15.594 -5.326 1.00 0.00 C ATOM 1781 CG LEU B 6 -5.898 -15.866 -4.033 1.00 0.00 C ATOM 1782 CD1 LEU B 6 -6.004 -17.329 -3.646 1.00 0.00 C ATOM 1783 CD2 LEU B 6 -4.440 -15.459 -4.188 1.00 0.00 C ATOM 0 H LEU B 6 -8.241 -14.504 -7.053 1.00 0.00 H new ATOM 0 HA LEU B 6 -6.448 -13.521 -4.942 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -7.715 -15.853 -5.172 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -6.287 -16.254 -6.106 1.00 0.00 H new ATOM 0 HG LEU B 6 -6.341 -15.269 -3.236 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -5.450 -17.502 -2.723 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -7.051 -17.590 -3.495 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -5.587 -17.947 -4.441 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -3.906 -15.659 -3.259 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -3.987 -16.031 -4.998 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -4.382 -14.395 -4.418 1.00 0.00 H new ATOM 1795 N TYR B 7 -4.961 -12.775 -6.937 1.00 0.00 N ATOM 1796 CA TYR B 7 -3.902 -12.528 -7.885 1.00 0.00 C ATOM 1797 C TYR B 7 -2.531 -12.902 -7.345 1.00 0.00 C ATOM 1798 O TYR B 7 -1.987 -12.245 -6.460 1.00 0.00 O ATOM 1799 CB TYR B 7 -3.922 -11.062 -8.379 1.00 0.00 C ATOM 1800 CG TYR B 7 -5.301 -10.440 -8.542 1.00 0.00 C ATOM 1801 CD1 TYR B 7 -6.172 -10.269 -7.465 1.00 0.00 C ATOM 1802 CD2 TYR B 7 -5.714 -9.986 -9.790 1.00 0.00 C ATOM 1803 CE1 TYR B 7 -7.405 -9.668 -7.637 1.00 0.00 C ATOM 1804 CE2 TYR B 7 -6.948 -9.391 -9.966 1.00 0.00 C ATOM 1805 CZ TYR B 7 -7.789 -9.233 -8.888 1.00 0.00 C ATOM 1806 OH TYR B 7 -9.016 -8.635 -9.058 1.00 0.00 O ATOM 0 H TYR B 7 -5.290 -11.954 -6.429 1.00 0.00 H new ATOM 0 HA TYR B 7 -4.092 -13.180 -8.737 1.00 0.00 H new ATOM 0 HB2 TYR B 7 -3.350 -10.454 -7.678 1.00 0.00 H new ATOM 0 HB3 TYR B 7 -3.406 -11.014 -9.338 1.00 0.00 H new ATOM 0 HD1 TYR B 7 -5.879 -10.611 -6.483 1.00 0.00 H new ATOM 0 HD2 TYR B 7 -5.056 -10.101 -10.639 1.00 0.00 H new ATOM 0 HE1 TYR B 7 -8.066 -9.539 -6.793 1.00 0.00 H new ATOM 0 HE2 TYR B 7 -7.252 -9.051 -10.945 1.00 0.00 H new ATOM 0 HH TYR B 7 -9.654 -9.009 -8.415 1.00 0.00 H new ATOM 1816 N LYS B 8 -1.965 -13.949 -7.952 1.00 0.00 N ATOM 1817 CA LYS B 8 -0.632 -14.422 -7.618 1.00 0.00 C ATOM 1818 C LYS B 8 0.372 -13.755 -8.529 1.00 0.00 C ATOM 1819 O LYS B 8 0.124 -13.604 -9.714 1.00 0.00 O ATOM 1820 CB LYS B 8 -0.542 -15.943 -7.731 1.00 0.00 C ATOM 1821 CG LYS B 8 0.814 -16.435 -8.194 1.00 0.00 C ATOM 1822 CD LYS B 8 0.883 -16.386 -9.693 1.00 0.00 C ATOM 1823 CE LYS B 8 0.395 -17.679 -10.327 1.00 0.00 C ATOM 1824 NZ LYS B 8 1.086 -17.962 -11.615 1.00 0.00 N ATOM 0 H LYS B 8 -2.423 -14.488 -8.687 1.00 0.00 H new ATOM 0 HA LYS B 8 -0.411 -14.161 -6.583 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -0.769 -16.386 -6.761 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -1.304 -16.293 -8.427 1.00 0.00 H new ATOM 0 HG2 LYS B 8 1.602 -15.818 -7.763 1.00 0.00 H new ATOM 0 HG3 LYS B 8 0.981 -17.454 -7.845 1.00 0.00 H new ATOM 0 HD2 LYS B 8 0.281 -15.554 -10.057 1.00 0.00 H new ATOM 0 HD3 LYS B 8 1.910 -16.195 -10.003 1.00 0.00 H new ATOM 0 HE2 LYS B 8 0.560 -18.506 -9.637 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -0.680 -17.616 -10.498 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 1.052 -18.983 -11.810 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 0.612 -17.447 -12.384 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 2.077 -17.654 -11.552 1.00 0.00 H new ATOM 1838 N ASN B 9 1.494 -13.342 -7.965 1.00 0.00 N ATOM 1839 CA ASN B 9 2.536 -12.667 -8.724 1.00 0.00 C ATOM 1840 C ASN B 9 2.571 -13.133 -10.186 1.00 0.00 C ATOM 1841 O ASN B 9 2.797 -14.311 -10.454 1.00 0.00 O ATOM 1842 CB ASN B 9 3.897 -12.908 -8.065 1.00 0.00 C ATOM 1843 CG ASN B 9 4.401 -11.691 -7.316 1.00 0.00 C ATOM 1844 OD1 ASN B 9 4.249 -11.591 -6.098 1.00 0.00 O ATOM 1845 ND2 ASN B 9 5.006 -10.758 -8.041 1.00 0.00 N ATOM 0 H ASN B 9 1.709 -13.463 -6.975 1.00 0.00 H new ATOM 0 HA ASN B 9 2.311 -11.601 -8.723 1.00 0.00 H new ATOM 0 HB2 ASN B 9 3.820 -13.749 -7.376 1.00 0.00 H new ATOM 0 HB3 ASN B 9 4.623 -13.187 -8.829 1.00 0.00 H new ATOM 0 HD21 ASN B 9 5.367 -9.917 -7.591 1.00 0.00 H new ATOM 0 HD22 ASN B 9 5.110 -10.882 -9.048 1.00 0.00 H new ATOM 1852 N LYS B 10 2.350 -12.190 -11.124 1.00 0.00 N ATOM 1853 CA LYS B 10 2.364 -12.478 -12.579 1.00 0.00 C ATOM 1854 C LYS B 10 3.269 -13.642 -12.882 1.00 0.00 C ATOM 1855 O LYS B 10 2.985 -14.496 -13.720 1.00 0.00 O ATOM 1856 CB LYS B 10 2.870 -11.288 -13.378 1.00 0.00 C ATOM 1857 CG LYS B 10 3.335 -10.169 -12.508 1.00 0.00 C ATOM 1858 CD LYS B 10 4.391 -10.637 -11.515 1.00 0.00 C ATOM 1859 CE LYS B 10 5.805 -10.507 -12.061 1.00 0.00 C ATOM 1860 NZ LYS B 10 6.512 -9.322 -11.501 1.00 0.00 N ATOM 0 H LYS B 10 2.158 -11.214 -10.900 1.00 0.00 H new ATOM 0 HA LYS B 10 1.336 -12.705 -12.861 1.00 0.00 H new ATOM 0 HB2 LYS B 10 3.690 -11.609 -14.021 1.00 0.00 H new ATOM 0 HB3 LYS B 10 2.075 -10.929 -14.031 1.00 0.00 H new ATOM 0 HG2 LYS B 10 3.744 -9.371 -13.127 1.00 0.00 H new ATOM 0 HG3 LYS B 10 2.486 -9.750 -11.968 1.00 0.00 H new ATOM 0 HD2 LYS B 10 4.305 -10.055 -10.597 1.00 0.00 H new ATOM 0 HD3 LYS B 10 4.201 -11.678 -11.252 1.00 0.00 H new ATOM 0 HE2 LYS B 10 6.369 -11.410 -11.826 1.00 0.00 H new ATOM 0 HE3 LYS B 10 5.768 -10.427 -13.147 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 7.056 -8.855 -12.254 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 5.816 -8.655 -11.111 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 7.158 -9.628 -10.746 1.00 0.00 H new ATOM 1874 N ASP B 11 4.380 -13.643 -12.186 1.00 0.00 N ATOM 1875 CA ASP B 11 5.364 -14.650 -12.339 1.00 0.00 C ATOM 1876 C ASP B 11 5.424 -15.491 -11.064 1.00 0.00 C ATOM 1877 O ASP B 11 5.964 -15.057 -10.046 1.00 0.00 O ATOM 1878 CB ASP B 11 6.698 -13.972 -12.654 1.00 0.00 C ATOM 1879 CG ASP B 11 7.448 -14.657 -13.780 1.00 0.00 C ATOM 1880 OD1 ASP B 11 7.020 -14.524 -14.946 1.00 0.00 O ATOM 1881 OD2 ASP B 11 8.463 -15.327 -13.496 1.00 0.00 O ATOM 0 H ASP B 11 4.615 -12.931 -11.494 1.00 0.00 H new ATOM 0 HA ASP B 11 5.122 -15.324 -13.161 1.00 0.00 H new ATOM 0 HB2 ASP B 11 6.518 -12.931 -12.923 1.00 0.00 H new ATOM 0 HB3 ASP B 11 7.319 -13.967 -11.759 1.00 0.00 H new ATOM 1886 N LYS B 12 4.826 -16.681 -11.119 1.00 0.00 N ATOM 1887 CA LYS B 12 4.761 -17.579 -9.962 1.00 0.00 C ATOM 1888 C LYS B 12 6.110 -17.724 -9.247 1.00 0.00 C ATOM 1889 O LYS B 12 6.155 -18.155 -8.095 1.00 0.00 O ATOM 1890 CB LYS B 12 4.225 -18.953 -10.386 1.00 0.00 C ATOM 1891 CG LYS B 12 2.889 -19.313 -9.739 1.00 0.00 C ATOM 1892 CD LYS B 12 3.047 -20.427 -8.716 1.00 0.00 C ATOM 1893 CE LYS B 12 1.713 -20.801 -8.090 1.00 0.00 C ATOM 1894 NZ LYS B 12 0.992 -21.829 -8.891 1.00 0.00 N ATOM 0 H LYS B 12 4.376 -17.049 -11.957 1.00 0.00 H new ATOM 0 HA LYS B 12 4.074 -17.128 -9.246 1.00 0.00 H new ATOM 0 HB2 LYS B 12 4.111 -18.971 -11.470 1.00 0.00 H new ATOM 0 HB3 LYS B 12 4.961 -19.716 -10.130 1.00 0.00 H new ATOM 0 HG2 LYS B 12 2.468 -18.431 -9.256 1.00 0.00 H new ATOM 0 HG3 LYS B 12 2.182 -19.622 -10.509 1.00 0.00 H new ATOM 0 HD2 LYS B 12 3.484 -21.303 -9.195 1.00 0.00 H new ATOM 0 HD3 LYS B 12 3.740 -20.111 -7.936 1.00 0.00 H new ATOM 0 HE2 LYS B 12 1.879 -21.178 -7.081 1.00 0.00 H new ATOM 0 HE3 LYS B 12 1.092 -19.910 -8.000 1.00 0.00 H new ATOM 0 HZ1 LYS B 12 0.088 -22.056 -8.431 1.00 0.00 H new ATOM 0 HZ2 LYS B 12 0.811 -21.460 -9.847 1.00 0.00 H new ATOM 0 HZ3 LYS B 12 1.573 -22.689 -8.956 1.00 0.00 H new ATOM 1908 N SER B 13 7.204 -17.358 -9.913 1.00 0.00 N ATOM 1909 CA SER B 13 8.527 -17.450 -9.300 1.00 0.00 C ATOM 1910 C SER B 13 8.596 -16.574 -8.049 1.00 0.00 C ATOM 1911 O SER B 13 9.227 -16.935 -7.056 1.00 0.00 O ATOM 1912 CB SER B 13 9.607 -17.026 -10.297 1.00 0.00 C ATOM 1913 OG SER B 13 10.039 -18.125 -11.080 1.00 0.00 O ATOM 0 H SER B 13 7.201 -16.999 -10.868 1.00 0.00 H new ATOM 0 HA SER B 13 8.702 -18.487 -9.013 1.00 0.00 H new ATOM 0 HB2 SER B 13 9.218 -16.243 -10.948 1.00 0.00 H new ATOM 0 HB3 SER B 13 10.456 -16.602 -9.760 1.00 0.00 H new ATOM 0 HG SER B 13 10.728 -17.827 -11.710 1.00 0.00 H new ATOM 1919 N SER B 14 7.923 -15.428 -8.108 1.00 0.00 N ATOM 1920 CA SER B 14 7.875 -14.488 -6.987 1.00 0.00 C ATOM 1921 C SER B 14 7.385 -15.160 -5.730 1.00 0.00 C ATOM 1922 O SER B 14 7.758 -14.781 -4.624 1.00 0.00 O ATOM 1923 CB SER B 14 6.910 -13.350 -7.306 1.00 0.00 C ATOM 1924 OG SER B 14 6.842 -13.110 -8.701 1.00 0.00 O ATOM 0 H SER B 14 7.398 -15.124 -8.928 1.00 0.00 H new ATOM 0 HA SER B 14 8.887 -14.114 -6.833 1.00 0.00 H new ATOM 0 HB2 SER B 14 5.917 -13.595 -6.928 1.00 0.00 H new ATOM 0 HB3 SER B 14 7.231 -12.443 -6.794 1.00 0.00 H new ATOM 0 HG SER B 14 6.310 -13.813 -9.128 1.00 0.00 H new ATOM 1930 N ALA B 15 6.504 -16.122 -5.906 1.00 0.00 N ATOM 1931 CA ALA B 15 5.908 -16.802 -4.782 1.00 0.00 C ATOM 1932 C ALA B 15 6.935 -17.299 -3.777 1.00 0.00 C ATOM 1933 O ALA B 15 6.608 -17.476 -2.603 1.00 0.00 O ATOM 1934 CB ALA B 15 5.026 -17.946 -5.257 1.00 0.00 C ATOM 0 H ALA B 15 6.186 -16.449 -6.818 1.00 0.00 H new ATOM 0 HA ALA B 15 5.293 -16.067 -4.262 1.00 0.00 H new ATOM 0 HB1 ALA B 15 4.585 -18.447 -4.395 1.00 0.00 H new ATOM 0 HB2 ALA B 15 4.233 -17.554 -5.894 1.00 0.00 H new ATOM 0 HB3 ALA B 15 5.627 -18.658 -5.823 1.00 0.00 H new ATOM 1940 N LYS B 16 8.179 -17.506 -4.209 1.00 0.00 N ATOM 1941 CA LYS B 16 9.207 -17.956 -3.279 1.00 0.00 C ATOM 1942 C LYS B 16 9.169 -17.052 -2.056 1.00 0.00 C ATOM 1943 O LYS B 16 9.137 -17.515 -0.915 1.00 0.00 O ATOM 1944 CB LYS B 16 10.590 -17.910 -3.934 1.00 0.00 C ATOM 1945 CG LYS B 16 10.831 -19.035 -4.926 1.00 0.00 C ATOM 1946 CD LYS B 16 12.282 -19.486 -4.916 1.00 0.00 C ATOM 1947 CE LYS B 16 12.613 -20.329 -6.137 1.00 0.00 C ATOM 1948 NZ LYS B 16 11.921 -21.647 -6.106 1.00 0.00 N ATOM 0 H LYS B 16 8.491 -17.373 -5.171 1.00 0.00 H new ATOM 0 HA LYS B 16 9.015 -18.989 -2.989 1.00 0.00 H new ATOM 0 HB2 LYS B 16 10.709 -16.955 -4.445 1.00 0.00 H new ATOM 0 HB3 LYS B 16 11.353 -17.953 -3.156 1.00 0.00 H new ATOM 0 HG2 LYS B 16 10.185 -19.879 -4.684 1.00 0.00 H new ATOM 0 HG3 LYS B 16 10.559 -18.702 -5.928 1.00 0.00 H new ATOM 0 HD2 LYS B 16 12.935 -18.614 -4.887 1.00 0.00 H new ATOM 0 HD3 LYS B 16 12.479 -20.061 -4.011 1.00 0.00 H new ATOM 0 HE2 LYS B 16 12.326 -19.789 -7.039 1.00 0.00 H new ATOM 0 HE3 LYS B 16 13.690 -20.486 -6.189 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 12.173 -22.191 -6.956 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 12.214 -22.173 -5.258 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 10.892 -21.498 -6.083 1.00 0.00 H new ATOM 1962 N THR B 17 9.106 -15.752 -2.323 1.00 0.00 N ATOM 1963 CA THR B 17 8.993 -14.750 -1.278 1.00 0.00 C ATOM 1964 C THR B 17 7.571 -14.196 -1.244 1.00 0.00 C ATOM 1965 O THR B 17 6.975 -14.040 -0.179 1.00 0.00 O ATOM 1966 CB THR B 17 9.993 -13.613 -1.493 1.00 0.00 C ATOM 1967 OG1 THR B 17 11.324 -14.092 -1.414 1.00 0.00 O ATOM 1968 CG2 THR B 17 9.844 -12.493 -0.483 1.00 0.00 C ATOM 0 H THR B 17 9.132 -15.368 -3.267 1.00 0.00 H new ATOM 0 HA THR B 17 9.221 -15.224 -0.323 1.00 0.00 H new ATOM 0 HB THR B 17 9.777 -13.219 -2.486 1.00 0.00 H new ATOM 0 HG1 THR B 17 11.948 -13.350 -1.556 1.00 0.00 H new ATOM 0 HG21 THR B 17 10.581 -11.717 -0.689 1.00 0.00 H new ATOM 0 HG22 THR B 17 8.842 -12.070 -0.554 1.00 0.00 H new ATOM 0 HG23 THR B 17 10.001 -12.886 0.522 1.00 0.00 H new ATOM 1976 N TYR B 18 7.047 -13.876 -2.431 1.00 0.00 N ATOM 1977 CA TYR B 18 5.705 -13.308 -2.557 1.00 0.00 C ATOM 1978 C TYR B 18 4.902 -13.983 -3.656 1.00 0.00 C ATOM 1979 O TYR B 18 5.200 -13.805 -4.837 1.00 0.00 O ATOM 1980 CB TYR B 18 5.807 -11.851 -2.925 1.00 0.00 C ATOM 1981 CG TYR B 18 6.716 -11.044 -2.026 1.00 0.00 C ATOM 1982 CD1 TYR B 18 6.617 -11.137 -0.643 1.00 0.00 C ATOM 1983 CD2 TYR B 18 7.673 -10.190 -2.559 1.00 0.00 C ATOM 1984 CE1 TYR B 18 7.446 -10.401 0.183 1.00 0.00 C ATOM 1985 CE2 TYR B 18 8.505 -9.451 -1.740 1.00 0.00 C ATOM 1986 CZ TYR B 18 8.388 -9.560 -0.371 1.00 0.00 C ATOM 1987 OH TYR B 18 9.214 -8.825 0.448 1.00 0.00 O ATOM 0 H TYR B 18 7.534 -14.002 -3.318 1.00 0.00 H new ATOM 0 HA TYR B 18 5.208 -13.455 -1.598 1.00 0.00 H new ATOM 0 HB2 TYR B 18 6.167 -11.772 -3.951 1.00 0.00 H new ATOM 0 HB3 TYR B 18 4.810 -11.412 -2.902 1.00 0.00 H new ATOM 0 HD1 TYR B 18 5.880 -11.795 -0.206 1.00 0.00 H new ATOM 0 HD2 TYR B 18 7.768 -10.102 -3.631 1.00 0.00 H new ATOM 0 HE1 TYR B 18 7.356 -10.484 1.256 1.00 0.00 H new ATOM 0 HE2 TYR B 18 9.244 -8.791 -2.171 1.00 0.00 H new ATOM 0 HH TYR B 18 9.821 -8.284 -0.100 1.00 0.00 H new ATOM 1997 N PRO B 19 3.885 -14.775 -3.309 1.00 0.00 N ATOM 1998 CA PRO B 19 3.081 -15.468 -4.293 1.00 0.00 C ATOM 1999 C PRO B 19 1.893 -14.666 -4.819 1.00 0.00 C ATOM 2000 O PRO B 19 1.551 -14.793 -5.989 1.00 0.00 O ATOM 2001 CB PRO B 19 2.587 -16.709 -3.549 1.00 0.00 C ATOM 2002 CG PRO B 19 2.969 -16.516 -2.115 1.00 0.00 C ATOM 2003 CD PRO B 19 3.455 -15.100 -1.958 1.00 0.00 C ATOM 0 HA PRO B 19 3.673 -15.677 -5.184 1.00 0.00 H new ATOM 0 HB2 PRO B 19 1.508 -16.821 -3.653 1.00 0.00 H new ATOM 0 HB3 PRO B 19 3.042 -17.613 -3.955 1.00 0.00 H new ATOM 0 HG2 PRO B 19 2.115 -16.702 -1.463 1.00 0.00 H new ATOM 0 HG3 PRO B 19 3.748 -17.222 -1.828 1.00 0.00 H new ATOM 0 HD2 PRO B 19 2.665 -14.434 -1.610 1.00 0.00 H new ATOM 0 HD3 PRO B 19 4.273 -15.027 -1.241 1.00 0.00 H new ATOM 2011 N TYR B 20 1.231 -13.873 -3.972 1.00 0.00 N ATOM 2012 CA TYR B 20 0.061 -13.126 -4.451 1.00 0.00 C ATOM 2013 C TYR B 20 -0.230 -11.844 -3.711 1.00 0.00 C ATOM 2014 O TYR B 20 0.428 -11.458 -2.747 1.00 0.00 O ATOM 2015 CB TYR B 20 -1.230 -13.957 -4.380 1.00 0.00 C ATOM 2016 CG TYR B 20 -1.060 -15.333 -3.837 1.00 0.00 C ATOM 2017 CD1 TYR B 20 -0.368 -15.551 -2.658 1.00 0.00 C ATOM 2018 CD2 TYR B 20 -1.589 -16.407 -4.516 1.00 0.00 C ATOM 2019 CE1 TYR B 20 -0.199 -16.816 -2.156 1.00 0.00 C ATOM 2020 CE2 TYR B 20 -1.427 -17.690 -4.031 1.00 0.00 C ATOM 2021 CZ TYR B 20 -0.731 -17.890 -2.850 1.00 0.00 C ATOM 2022 OH TYR B 20 -0.559 -19.161 -2.376 1.00 0.00 O ATOM 0 H TYR B 20 1.470 -13.733 -2.990 1.00 0.00 H new ATOM 0 HA TYR B 20 0.342 -12.889 -5.477 1.00 0.00 H new ATOM 0 HB2 TYR B 20 -1.954 -13.425 -3.762 1.00 0.00 H new ATOM 0 HB3 TYR B 20 -1.655 -14.027 -5.381 1.00 0.00 H new ATOM 0 HD1 TYR B 20 0.047 -14.709 -2.123 1.00 0.00 H new ATOM 0 HD2 TYR B 20 -2.134 -16.245 -5.434 1.00 0.00 H new ATOM 0 HE1 TYR B 20 0.341 -16.972 -1.234 1.00 0.00 H new ATOM 0 HE2 TYR B 20 -1.840 -18.531 -4.568 1.00 0.00 H new ATOM 0 HH TYR B 20 -1.295 -19.386 -1.769 1.00 0.00 H new ATOM 2032 N PHE B 21 -1.302 -11.243 -4.202 1.00 0.00 N ATOM 2033 CA PHE B 21 -1.879 -10.036 -3.683 1.00 0.00 C ATOM 2034 C PHE B 21 -3.341 -10.047 -4.068 1.00 0.00 C ATOM 2035 O PHE B 21 -3.763 -10.873 -4.879 1.00 0.00 O ATOM 2036 CB PHE B 21 -1.222 -8.786 -4.246 1.00 0.00 C ATOM 2037 CG PHE B 21 0.127 -9.002 -4.891 1.00 0.00 C ATOM 2038 CD1 PHE B 21 1.272 -8.957 -4.120 1.00 0.00 C ATOM 2039 CD2 PHE B 21 0.256 -9.230 -6.259 1.00 0.00 C ATOM 2040 CE1 PHE B 21 2.520 -9.134 -4.685 1.00 0.00 C ATOM 2041 CE2 PHE B 21 1.503 -9.410 -6.828 1.00 0.00 C ATOM 2042 CZ PHE B 21 2.635 -9.360 -6.040 1.00 0.00 C ATOM 0 H PHE B 21 -1.808 -11.608 -5.009 1.00 0.00 H new ATOM 0 HA PHE B 21 -1.734 -10.007 -2.603 1.00 0.00 H new ATOM 0 HB2 PHE B 21 -1.892 -8.343 -4.983 1.00 0.00 H new ATOM 0 HB3 PHE B 21 -1.110 -8.060 -3.441 1.00 0.00 H new ATOM 0 HD1 PHE B 21 1.190 -8.780 -3.058 1.00 0.00 H new ATOM 0 HD2 PHE B 21 -0.626 -9.267 -6.881 1.00 0.00 H new ATOM 0 HE1 PHE B 21 3.404 -9.095 -4.066 1.00 0.00 H new ATOM 0 HE2 PHE B 21 1.591 -9.590 -7.889 1.00 0.00 H new ATOM 0 HZ PHE B 21 3.610 -9.498 -6.484 1.00 0.00 H new ATOM 2052 N VAL B 22 -4.117 -9.157 -3.499 1.00 0.00 N ATOM 2053 CA VAL B 22 -5.525 -9.118 -3.815 1.00 0.00 C ATOM 2054 C VAL B 22 -5.981 -7.719 -4.172 1.00 0.00 C ATOM 2055 O VAL B 22 -6.055 -6.836 -3.321 1.00 0.00 O ATOM 2056 CB VAL B 22 -6.359 -9.648 -2.652 1.00 0.00 C ATOM 2057 CG1 VAL B 22 -7.842 -9.556 -2.978 1.00 0.00 C ATOM 2058 CG2 VAL B 22 -5.963 -11.080 -2.318 1.00 0.00 C ATOM 0 H VAL B 22 -3.804 -8.459 -2.824 1.00 0.00 H new ATOM 0 HA VAL B 22 -5.674 -9.759 -4.684 1.00 0.00 H new ATOM 0 HB VAL B 22 -6.164 -9.031 -1.775 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -8.423 -9.938 -2.139 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -8.110 -8.516 -3.162 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -8.056 -10.149 -3.867 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -6.569 -11.440 -1.486 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -6.127 -11.715 -3.188 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -4.910 -11.111 -2.040 1.00 0.00 H new ATOM 2068 N ASP B 23 -6.303 -7.532 -5.442 1.00 0.00 N ATOM 2069 CA ASP B 23 -6.776 -6.234 -5.918 1.00 0.00 C ATOM 2070 C ASP B 23 -8.019 -5.817 -5.132 1.00 0.00 C ATOM 2071 O ASP B 23 -9.078 -6.429 -5.272 1.00 0.00 O ATOM 2072 CB ASP B 23 -7.099 -6.301 -7.413 1.00 0.00 C ATOM 2073 CG ASP B 23 -6.216 -5.393 -8.244 1.00 0.00 C ATOM 2074 OD1 ASP B 23 -4.997 -5.349 -7.980 1.00 0.00 O ATOM 2075 OD2 ASP B 23 -6.744 -4.728 -9.159 1.00 0.00 O ATOM 0 H ASP B 23 -6.248 -8.254 -6.160 1.00 0.00 H new ATOM 0 HA ASP B 23 -5.990 -5.494 -5.765 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -6.985 -7.328 -7.759 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -8.143 -6.027 -7.568 1.00 0.00 H new ATOM 2080 N VAL B 24 -7.887 -4.790 -4.293 1.00 0.00 N ATOM 2081 CA VAL B 24 -9.014 -4.328 -3.485 1.00 0.00 C ATOM 2082 C VAL B 24 -8.842 -2.880 -3.049 1.00 0.00 C ATOM 2083 O VAL B 24 -7.995 -2.571 -2.213 1.00 0.00 O ATOM 2084 CB VAL B 24 -9.207 -5.231 -2.248 1.00 0.00 C ATOM 2085 CG1 VAL B 24 -7.891 -5.409 -1.506 1.00 0.00 C ATOM 2086 CG2 VAL B 24 -10.287 -4.681 -1.322 1.00 0.00 C ATOM 0 H VAL B 24 -7.022 -4.268 -4.156 1.00 0.00 H new ATOM 0 HA VAL B 24 -9.904 -4.387 -4.112 1.00 0.00 H new ATOM 0 HB VAL B 24 -9.540 -6.209 -2.595 1.00 0.00 H new ATOM 0 HG11 VAL B 24 -8.047 -6.048 -0.637 1.00 0.00 H new ATOM 0 HG12 VAL B 24 -7.159 -5.870 -2.169 1.00 0.00 H new ATOM 0 HG13 VAL B 24 -7.523 -4.436 -1.179 1.00 0.00 H new ATOM 0 HG21 VAL B 24 -10.398 -5.340 -0.461 1.00 0.00 H new ATOM 0 HG22 VAL B 24 -10.003 -3.685 -0.982 1.00 0.00 H new ATOM 0 HG23 VAL B 24 -11.233 -4.624 -1.860 1.00 0.00 H new ATOM 2096 N GLN B 25 -9.678 -2.007 -3.614 1.00 0.00 N ATOM 2097 CA GLN B 25 -9.668 -0.581 -3.295 1.00 0.00 C ATOM 2098 C GLN B 25 -10.365 0.219 -4.392 1.00 0.00 C ATOM 2099 O GLN B 25 -11.589 0.349 -4.390 1.00 0.00 O ATOM 2100 CB GLN B 25 -8.242 -0.069 -3.079 1.00 0.00 C ATOM 2101 CG GLN B 25 -8.144 1.436 -2.904 1.00 0.00 C ATOM 2102 CD GLN B 25 -6.712 1.912 -2.765 1.00 0.00 C ATOM 2103 OE1 GLN B 25 -6.269 2.276 -1.676 1.00 0.00 O ATOM 2104 NE2 GLN B 25 -5.979 1.911 -3.873 1.00 0.00 N ATOM 0 H GLN B 25 -10.380 -2.270 -4.305 1.00 0.00 H new ATOM 0 HA GLN B 25 -10.216 -0.444 -2.363 1.00 0.00 H new ATOM 0 HB2 GLN B 25 -7.823 -0.555 -2.198 1.00 0.00 H new ATOM 0 HB3 GLN B 25 -7.628 -0.366 -3.929 1.00 0.00 H new ATOM 0 HG2 GLN B 25 -8.606 1.929 -3.759 1.00 0.00 H new ATOM 0 HG3 GLN B 25 -8.710 1.733 -2.021 1.00 0.00 H new ATOM 0 HE21 GLN B 25 -6.388 1.601 -4.755 1.00 0.00 H new ATOM 0 HE22 GLN B 25 -5.008 2.220 -3.842 1.00 0.00 H new ATOM 2113 N SER B 26 -9.586 0.754 -5.326 1.00 0.00 N ATOM 2114 CA SER B 26 -10.154 1.541 -6.422 1.00 0.00 C ATOM 2115 C SER B 26 -11.141 0.730 -7.233 1.00 0.00 C ATOM 2116 O SER B 26 -10.763 0.109 -8.219 1.00 0.00 O ATOM 2117 CB SER B 26 -9.083 2.043 -7.377 1.00 0.00 C ATOM 2118 OG SER B 26 -8.336 3.105 -6.810 1.00 0.00 O ATOM 0 H SER B 26 -8.571 0.661 -5.350 1.00 0.00 H new ATOM 0 HA SER B 26 -10.655 2.386 -5.950 1.00 0.00 H new ATOM 0 HB2 SER B 26 -8.413 1.224 -7.636 1.00 0.00 H new ATOM 0 HB3 SER B 26 -9.549 2.379 -8.303 1.00 0.00 H new ATOM 0 HG SER B 26 -7.390 2.999 -7.042 1.00 0.00 H new ATOM 2124 N ASP B 27 -12.410 0.754 -6.862 1.00 0.00 N ATOM 2125 CA ASP B 27 -13.399 0.027 -7.638 1.00 0.00 C ATOM 2126 C ASP B 27 -13.330 0.509 -9.084 1.00 0.00 C ATOM 2127 O ASP B 27 -13.550 -0.257 -10.022 1.00 0.00 O ATOM 2128 CB ASP B 27 -14.804 0.232 -7.068 1.00 0.00 C ATOM 2129 CG ASP B 27 -15.669 -1.006 -7.202 1.00 0.00 C ATOM 2130 OD1 ASP B 27 -15.357 -1.858 -8.060 1.00 0.00 O ATOM 2131 OD2 ASP B 27 -16.657 -1.125 -6.447 1.00 0.00 O ATOM 0 H ASP B 27 -12.773 1.255 -6.051 1.00 0.00 H new ATOM 0 HA ASP B 27 -13.183 -1.040 -7.592 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -14.730 0.508 -6.016 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -15.284 1.065 -7.583 1.00 0.00 H new ATOM 2136 N LEU B 28 -12.985 1.788 -9.245 1.00 0.00 N ATOM 2137 CA LEU B 28 -12.842 2.385 -10.563 1.00 0.00 C ATOM 2138 C LEU B 28 -11.444 2.143 -11.104 1.00 0.00 C ATOM 2139 O LEU B 28 -11.264 1.568 -12.177 1.00 0.00 O ATOM 2140 CB LEU B 28 -13.140 3.885 -10.514 1.00 0.00 C ATOM 2141 CG LEU B 28 -14.544 4.253 -10.028 1.00 0.00 C ATOM 2142 CD1 LEU B 28 -15.600 3.501 -10.824 1.00 0.00 C ATOM 2143 CD2 LEU B 28 -14.686 3.961 -8.542 1.00 0.00 C ATOM 0 H LEU B 28 -12.800 2.428 -8.472 1.00 0.00 H new ATOM 0 HA LEU B 28 -13.563 1.914 -11.232 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -12.410 4.364 -9.862 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -12.997 4.301 -11.511 1.00 0.00 H new ATOM 0 HG LEU B 28 -14.694 5.321 -10.185 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -16.591 3.776 -10.464 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -15.513 3.759 -11.879 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -15.454 2.428 -10.700 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -15.690 4.228 -8.213 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -14.516 2.900 -8.362 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -13.954 4.545 -7.985 1.00 0.00 H new ATOM 2155 N LEU B 29 -10.462 2.573 -10.334 1.00 0.00 N ATOM 2156 CA LEU B 29 -9.063 2.402 -10.691 1.00 0.00 C ATOM 2157 C LEU B 29 -8.549 1.075 -10.150 1.00 0.00 C ATOM 2158 O LEU B 29 -7.436 0.991 -9.630 1.00 0.00 O ATOM 2159 CB LEU B 29 -8.246 3.544 -10.100 1.00 0.00 C ATOM 2160 CG LEU B 29 -8.710 4.936 -10.510 1.00 0.00 C ATOM 2161 CD1 LEU B 29 -8.257 5.973 -9.493 1.00 0.00 C ATOM 2162 CD2 LEU B 29 -8.196 5.285 -11.898 1.00 0.00 C ATOM 0 H LEU B 29 -10.609 3.050 -9.445 1.00 0.00 H new ATOM 0 HA LEU B 29 -8.966 2.407 -11.777 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -8.277 3.471 -9.013 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -7.205 3.420 -10.398 1.00 0.00 H new ATOM 0 HG LEU B 29 -9.800 4.939 -10.539 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -8.598 6.961 -9.804 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -8.679 5.734 -8.517 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -7.169 5.969 -9.429 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -8.538 6.283 -12.172 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -7.106 5.262 -11.899 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -8.575 4.561 -12.619 1.00 0.00 H new ATOM 2174 N ASP B 30 -9.385 0.049 -10.237 1.00 0.00 N ATOM 2175 CA ASP B 30 -9.028 -1.263 -9.713 1.00 0.00 C ATOM 2176 C ASP B 30 -7.910 -1.914 -10.522 1.00 0.00 C ATOM 2177 O ASP B 30 -6.832 -2.162 -9.998 1.00 0.00 O ATOM 2178 CB ASP B 30 -10.267 -2.172 -9.685 1.00 0.00 C ATOM 2179 CG ASP B 30 -11.126 -2.029 -10.928 1.00 0.00 C ATOM 2180 OD1 ASP B 30 -10.626 -1.491 -11.937 1.00 0.00 O ATOM 2181 OD2 ASP B 30 -12.299 -2.455 -10.890 1.00 0.00 O ATOM 0 H ASP B 30 -10.310 0.099 -10.663 1.00 0.00 H new ATOM 0 HA ASP B 30 -8.657 -1.126 -8.697 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -9.949 -3.210 -9.585 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -10.866 -1.936 -8.805 1.00 0.00 H new ATOM 2186 N ASN B 31 -8.140 -2.161 -11.801 1.00 0.00 N ATOM 2187 CA ASN B 31 -7.103 -2.753 -12.643 1.00 0.00 C ATOM 2188 C ASN B 31 -6.805 -1.877 -13.839 1.00 0.00 C ATOM 2189 O ASN B 31 -6.086 -2.282 -14.752 1.00 0.00 O ATOM 2190 CB ASN B 31 -7.492 -4.159 -13.100 1.00 0.00 C ATOM 2191 CG ASN B 31 -6.360 -4.870 -13.816 1.00 0.00 C ATOM 2192 OD1 ASN B 31 -5.222 -4.401 -13.822 1.00 0.00 O ATOM 2193 ND2 ASN B 31 -6.668 -6.009 -14.425 1.00 0.00 N ATOM 0 H ASN B 31 -9.020 -1.966 -12.277 1.00 0.00 H new ATOM 0 HA ASN B 31 -6.199 -2.829 -12.038 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -7.797 -4.748 -12.235 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -8.355 -4.096 -13.763 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -5.948 -6.532 -14.923 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -7.625 -6.361 -14.394 1.00 0.00 H new ATOM 2200 N LEU B 32 -7.340 -0.666 -13.822 1.00 0.00 N ATOM 2201 CA LEU B 32 -7.097 0.273 -14.908 1.00 0.00 C ATOM 2202 C LEU B 32 -5.618 0.315 -15.179 1.00 0.00 C ATOM 2203 O LEU B 32 -5.147 0.038 -16.282 1.00 0.00 O ATOM 2204 CB LEU B 32 -7.539 1.677 -14.524 1.00 0.00 C ATOM 2205 CG LEU B 32 -8.604 2.299 -15.427 1.00 0.00 C ATOM 2206 CD1 LEU B 32 -9.302 3.448 -14.715 1.00 0.00 C ATOM 2207 CD2 LEU B 32 -7.984 2.776 -16.731 1.00 0.00 C ATOM 0 H LEU B 32 -7.940 -0.312 -13.077 1.00 0.00 H new ATOM 0 HA LEU B 32 -7.659 -0.054 -15.783 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -7.921 1.653 -13.503 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -6.664 2.327 -14.522 1.00 0.00 H new ATOM 0 HG LEU B 32 -9.348 1.536 -15.659 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.057 3.879 -15.373 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -9.780 3.077 -13.808 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -8.570 4.212 -14.453 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -8.757 3.216 -17.362 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -7.220 3.524 -16.518 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -7.531 1.931 -17.249 1.00 0.00 H new ATOM 2219 N ASN B 33 -4.896 0.663 -14.129 1.00 0.00 N ATOM 2220 CA ASN B 33 -3.466 0.749 -14.192 1.00 0.00 C ATOM 2221 C ASN B 33 -2.821 0.055 -12.990 1.00 0.00 C ATOM 2222 O ASN B 33 -1.698 -0.439 -13.082 1.00 0.00 O ATOM 2223 CB ASN B 33 -3.024 2.212 -14.246 1.00 0.00 C ATOM 2224 CG ASN B 33 -1.713 2.394 -14.986 1.00 0.00 C ATOM 2225 OD1 ASN B 33 -0.604 2.223 -14.276 1.00 0.00 O flip ATOM 2226 ND2 ASN B 33 -1.698 2.683 -16.183 1.00 0.00 N flip ATOM 0 H ASN B 33 -5.292 0.891 -13.217 1.00 0.00 H new ATOM 0 HA ASN B 33 -3.138 0.242 -15.100 1.00 0.00 H new ATOM 0 HB2 ASN B 33 -3.798 2.805 -14.733 1.00 0.00 H new ATOM 0 HB3 ASN B 33 -2.921 2.595 -13.231 1.00 0.00 H new ATOM 0 HD21 ASN B 33 -2.575 2.805 -16.689 1.00 0.00 H new ATOM 0 HD22 ASN B 33 -0.809 2.800 -16.668 1.00 0.00 H new ATOM 2233 N THR B 34 -3.540 0.024 -11.857 1.00 0.00 N ATOM 2234 CA THR B 34 -3.034 -0.604 -10.628 1.00 0.00 C ATOM 2235 C THR B 34 -4.128 -0.655 -9.566 1.00 0.00 C ATOM 2236 O THR B 34 -5.178 -0.030 -9.714 1.00 0.00 O ATOM 2237 CB THR B 34 -1.816 0.152 -10.042 1.00 0.00 C ATOM 2238 OG1 THR B 34 -2.169 0.818 -8.841 1.00 0.00 O ATOM 2239 CG2 THR B 34 -1.208 1.196 -10.958 1.00 0.00 C ATOM 0 H THR B 34 -4.473 0.426 -11.767 1.00 0.00 H new ATOM 0 HA THR B 34 -2.720 -1.612 -10.900 1.00 0.00 H new ATOM 0 HB THR B 34 -1.075 -0.631 -9.884 1.00 0.00 H new ATOM 0 HG1 THR B 34 -1.469 1.462 -8.606 1.00 0.00 H new ATOM 0 HG21 THR B 34 -0.363 1.670 -10.459 1.00 0.00 H new ATOM 0 HG22 THR B 34 -0.866 0.719 -11.877 1.00 0.00 H new ATOM 0 HG23 THR B 34 -1.957 1.950 -11.198 1.00 0.00 H new ATOM 2247 N ARG B 35 -3.853 -1.355 -8.469 1.00 0.00 N ATOM 2248 CA ARG B 35 -4.795 -1.425 -7.359 1.00 0.00 C ATOM 2249 C ARG B 35 -4.085 -1.654 -6.044 1.00 0.00 C ATOM 2250 O ARG B 35 -2.957 -2.132 -6.011 1.00 0.00 O ATOM 2251 CB ARG B 35 -5.837 -2.520 -7.545 1.00 0.00 C ATOM 2252 CG ARG B 35 -7.177 -2.151 -6.930 1.00 0.00 C ATOM 2253 CD ARG B 35 -8.291 -3.091 -7.353 1.00 0.00 C ATOM 2254 NE ARG B 35 -9.602 -2.552 -6.994 1.00 0.00 N ATOM 2255 CZ ARG B 35 -10.591 -3.271 -6.472 1.00 0.00 C ATOM 2256 NH1 ARG B 35 -10.462 -4.579 -6.315 1.00 0.00 N ATOM 2257 NH2 ARG B 35 -11.726 -2.680 -6.124 1.00 0.00 N ATOM 0 H ARG B 35 -2.990 -1.879 -8.326 1.00 0.00 H new ATOM 0 HA ARG B 35 -5.302 -0.460 -7.343 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -5.970 -2.715 -8.609 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -5.475 -3.444 -7.094 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -7.090 -2.162 -5.844 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -7.437 -1.132 -7.218 1.00 0.00 H new ATOM 0 HD2 ARG B 35 -8.244 -3.254 -8.430 1.00 0.00 H new ATOM 0 HD3 ARG B 35 -8.151 -4.062 -6.878 1.00 0.00 H new ATOM 0 HE ARG B 35 -9.769 -1.559 -7.155 1.00 0.00 H new ATOM 0 HH11 ARG B 35 -9.598 -5.044 -6.595 1.00 0.00 H new ATOM 0 HH12 ARG B 35 -11.226 -5.122 -5.914 1.00 0.00 H new ATOM 0 HH21 ARG B 35 -11.839 -1.675 -6.257 1.00 0.00 H new ATOM 0 HH22 ARG B 35 -12.486 -3.230 -5.723 1.00 0.00 H new ATOM 2271 N LEU B 36 -4.782 -1.352 -4.958 1.00 0.00 N ATOM 2272 CA LEU B 36 -4.249 -1.562 -3.628 1.00 0.00 C ATOM 2273 C LEU B 36 -4.460 -3.020 -3.258 1.00 0.00 C ATOM 2274 O LEU B 36 -5.594 -3.498 -3.213 1.00 0.00 O ATOM 2275 CB LEU B 36 -4.948 -0.639 -2.632 1.00 0.00 C ATOM 2276 CG LEU B 36 -4.700 -0.958 -1.156 1.00 0.00 C ATOM 2277 CD1 LEU B 36 -3.245 -0.701 -0.792 1.00 0.00 C ATOM 2278 CD2 LEU B 36 -5.628 -0.138 -0.271 1.00 0.00 C ATOM 0 H LEU B 36 -5.723 -0.959 -4.977 1.00 0.00 H new ATOM 0 HA LEU B 36 -3.184 -1.330 -3.603 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -4.627 0.385 -2.824 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -6.021 -0.677 -2.819 1.00 0.00 H new ATOM 0 HG LEU B 36 -4.913 -2.014 -0.990 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -3.087 -0.933 0.261 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -2.600 -1.332 -1.403 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -3.004 0.347 -0.973 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -5.438 -0.377 0.775 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -5.447 0.924 -0.439 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -6.664 -0.372 -0.515 1.00 0.00 H new ATOM 2290 N VAL B 37 -3.371 -3.741 -3.043 1.00 0.00 N ATOM 2291 CA VAL B 37 -3.465 -5.158 -2.739 1.00 0.00 C ATOM 2292 C VAL B 37 -2.954 -5.517 -1.366 1.00 0.00 C ATOM 2293 O VAL B 37 -2.086 -4.852 -0.802 1.00 0.00 O ATOM 2294 CB VAL B 37 -2.637 -6.002 -3.727 1.00 0.00 C ATOM 2295 CG1 VAL B 37 -3.230 -5.949 -5.123 1.00 0.00 C ATOM 2296 CG2 VAL B 37 -1.183 -5.539 -3.734 1.00 0.00 C ATOM 0 H VAL B 37 -2.421 -3.372 -3.073 1.00 0.00 H new ATOM 0 HA VAL B 37 -4.531 -5.373 -2.807 1.00 0.00 H new ATOM 0 HB VAL B 37 -2.666 -7.040 -3.395 1.00 0.00 H new ATOM 0 HG11 VAL B 37 -2.625 -6.554 -5.799 1.00 0.00 H new ATOM 0 HG12 VAL B 37 -4.248 -6.338 -5.101 1.00 0.00 H new ATOM 0 HG13 VAL B 37 -3.244 -4.917 -5.474 1.00 0.00 H new ATOM 0 HG21 VAL B 37 -0.612 -6.145 -4.437 1.00 0.00 H new ATOM 0 HG22 VAL B 37 -1.136 -4.493 -4.035 1.00 0.00 H new ATOM 0 HG23 VAL B 37 -0.762 -5.648 -2.735 1.00 0.00 H new ATOM 2306 N ILE B 38 -3.438 -6.651 -0.895 1.00 0.00 N ATOM 2307 CA ILE B 38 -2.980 -7.212 0.346 1.00 0.00 C ATOM 2308 C ILE B 38 -2.164 -8.427 -0.054 1.00 0.00 C ATOM 2309 O ILE B 38 -2.700 -9.518 -0.244 1.00 0.00 O ATOM 2310 CB ILE B 38 -4.138 -7.635 1.268 1.00 0.00 C ATOM 2311 CG1 ILE B 38 -5.285 -6.620 1.207 1.00 0.00 C ATOM 2312 CG2 ILE B 38 -3.636 -7.786 2.692 1.00 0.00 C ATOM 2313 CD1 ILE B 38 -6.596 -7.222 0.752 1.00 0.00 C ATOM 0 H ILE B 38 -4.157 -7.201 -1.365 1.00 0.00 H new ATOM 0 HA ILE B 38 -2.408 -6.477 0.913 1.00 0.00 H new ATOM 0 HB ILE B 38 -4.522 -8.595 0.924 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -5.420 -6.176 2.193 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -5.010 -5.812 0.529 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -4.461 -8.085 3.339 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -2.855 -8.546 2.724 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -3.231 -6.835 3.038 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -7.364 -6.449 0.732 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -6.477 -7.641 -0.247 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -6.894 -8.011 1.443 1.00 0.00 H new ATOM 2325 N PRO B 39 -0.857 -8.226 -0.263 1.00 0.00 N ATOM 2326 CA PRO B 39 0.041 -9.273 -0.732 1.00 0.00 C ATOM 2327 C PRO B 39 -0.113 -10.599 0.004 1.00 0.00 C ATOM 2328 O PRO B 39 0.438 -10.789 1.082 1.00 0.00 O ATOM 2329 CB PRO B 39 1.444 -8.690 -0.506 1.00 0.00 C ATOM 2330 CG PRO B 39 1.249 -7.361 0.156 1.00 0.00 C ATOM 2331 CD PRO B 39 -0.159 -6.942 -0.138 1.00 0.00 C ATOM 0 HA PRO B 39 -0.173 -9.522 -1.771 1.00 0.00 H new ATOM 0 HB2 PRO B 39 2.043 -9.351 0.120 1.00 0.00 H new ATOM 0 HB3 PRO B 39 1.975 -8.579 -1.451 1.00 0.00 H new ATOM 0 HG2 PRO B 39 1.415 -7.435 1.231 1.00 0.00 H new ATOM 0 HG3 PRO B 39 1.960 -6.629 -0.227 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -0.575 -6.331 0.663 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -0.224 -6.355 -1.054 1.00 0.00 H new ATOM 2339 N LEU B 40 -0.838 -11.526 -0.610 1.00 0.00 N ATOM 2340 CA LEU B 40 -1.035 -12.850 -0.038 1.00 0.00 C ATOM 2341 C LEU B 40 0.266 -13.607 -0.038 1.00 0.00 C ATOM 2342 O LEU B 40 1.187 -13.272 -0.779 1.00 0.00 O ATOM 2343 CB LEU B 40 -2.076 -13.623 -0.840 1.00 0.00 C ATOM 2344 CG LEU B 40 -3.496 -13.457 -0.344 1.00 0.00 C ATOM 2345 CD1 LEU B 40 -4.490 -13.734 -1.461 1.00 0.00 C ATOM 2346 CD2 LEU B 40 -3.753 -14.368 0.847 1.00 0.00 C ATOM 0 H LEU B 40 -1.301 -11.383 -1.508 1.00 0.00 H new ATOM 0 HA LEU B 40 -1.388 -12.738 0.987 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -2.027 -13.302 -1.880 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -1.819 -14.682 -0.821 1.00 0.00 H new ATOM 0 HG LEU B 40 -3.630 -12.425 -0.020 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -5.505 -13.609 -1.084 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -4.319 -13.037 -2.281 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -4.359 -14.755 -1.820 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -4.779 -14.236 1.191 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -3.600 -15.406 0.551 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -3.064 -14.116 1.653 1.00 0.00 H new ATOM 2358 N THR B 41 0.345 -14.627 0.795 1.00 0.00 N ATOM 2359 CA THR B 41 1.549 -15.421 0.875 1.00 0.00 C ATOM 2360 C THR B 41 1.265 -16.796 1.458 1.00 0.00 C ATOM 2361 O THR B 41 0.131 -17.098 1.827 1.00 0.00 O ATOM 2362 CB THR B 41 2.624 -14.685 1.674 1.00 0.00 C ATOM 2363 OG1 THR B 41 3.037 -15.427 2.808 1.00 0.00 O ATOM 2364 CG2 THR B 41 2.216 -13.311 2.161 1.00 0.00 C ATOM 0 H THR B 41 -0.405 -14.921 1.420 1.00 0.00 H new ATOM 0 HA THR B 41 1.926 -15.572 -0.137 1.00 0.00 H new ATOM 0 HB THR B 41 3.438 -14.568 0.958 1.00 0.00 H new ATOM 0 HG1 THR B 41 3.726 -14.926 3.293 1.00 0.00 H new ATOM 0 HG21 THR B 41 3.039 -12.863 2.718 1.00 0.00 H new ATOM 0 HG22 THR B 41 1.970 -12.680 1.307 1.00 0.00 H new ATOM 0 HG23 THR B 41 1.345 -13.399 2.810 1.00 0.00 H new ATOM 2372 N PRO B 42 2.287 -17.664 1.532 1.00 0.00 N ATOM 2373 CA PRO B 42 2.122 -19.007 2.053 1.00 0.00 C ATOM 2374 C PRO B 42 2.297 -19.081 3.560 1.00 0.00 C ATOM 2375 O PRO B 42 3.414 -19.142 4.074 1.00 0.00 O ATOM 2376 CB PRO B 42 3.217 -19.769 1.327 1.00 0.00 C ATOM 2377 CG PRO B 42 4.329 -18.783 1.210 1.00 0.00 C ATOM 2378 CD PRO B 42 3.680 -17.423 1.097 1.00 0.00 C ATOM 0 HA PRO B 42 1.120 -19.403 1.890 1.00 0.00 H new ATOM 0 HB2 PRO B 42 3.525 -20.653 1.885 1.00 0.00 H new ATOM 0 HB3 PRO B 42 2.883 -20.111 0.348 1.00 0.00 H new ATOM 0 HG2 PRO B 42 4.984 -18.830 2.080 1.00 0.00 H new ATOM 0 HG3 PRO B 42 4.945 -18.994 0.336 1.00 0.00 H new ATOM 0 HD2 PRO B 42 4.176 -16.688 1.731 1.00 0.00 H new ATOM 0 HD3 PRO B 42 3.721 -17.043 0.076 1.00 0.00 H new ATOM 2386 N ILE B 43 1.166 -19.090 4.254 1.00 0.00 N ATOM 2387 CA ILE B 43 1.131 -19.174 5.714 1.00 0.00 C ATOM 2388 C ILE B 43 2.136 -20.207 6.229 1.00 0.00 C ATOM 2389 O ILE B 43 2.641 -20.096 7.346 1.00 0.00 O ATOM 2390 CB ILE B 43 -0.309 -19.509 6.198 1.00 0.00 C ATOM 2391 CG1 ILE B 43 -0.328 -20.320 7.498 1.00 0.00 C ATOM 2392 CG2 ILE B 43 -1.078 -20.253 5.121 1.00 0.00 C ATOM 2393 CD1 ILE B 43 -1.540 -20.029 8.355 1.00 0.00 C ATOM 0 H ILE B 43 0.243 -19.039 3.822 1.00 0.00 H new ATOM 0 HA ILE B 43 1.416 -18.204 6.122 1.00 0.00 H new ATOM 0 HB ILE B 43 -0.792 -18.554 6.403 1.00 0.00 H new ATOM 0 HG12 ILE B 43 -0.306 -21.383 7.258 1.00 0.00 H new ATOM 0 HG13 ILE B 43 0.575 -20.103 8.069 1.00 0.00 H new ATOM 0 HG21 ILE B 43 -2.082 -20.477 5.480 1.00 0.00 H new ATOM 0 HG22 ILE B 43 -1.143 -19.634 4.226 1.00 0.00 H new ATOM 0 HG23 ILE B 43 -0.562 -21.183 4.882 1.00 0.00 H new ATOM 0 HD11 ILE B 43 -1.498 -20.633 9.262 1.00 0.00 H new ATOM 0 HD12 ILE B 43 -1.551 -18.972 8.623 1.00 0.00 H new ATOM 0 HD13 ILE B 43 -2.446 -20.272 7.799 1.00 0.00 H new ATOM 2405 N GLU B 44 2.430 -21.200 5.398 1.00 0.00 N ATOM 2406 CA GLU B 44 3.382 -22.244 5.751 1.00 0.00 C ATOM 2407 C GLU B 44 4.795 -21.678 5.881 1.00 0.00 C ATOM 2408 O GLU B 44 5.438 -21.821 6.921 1.00 0.00 O ATOM 2409 CB GLU B 44 3.359 -23.341 4.686 1.00 0.00 C ATOM 2410 CG GLU B 44 2.290 -24.396 4.919 1.00 0.00 C ATOM 2411 CD GLU B 44 2.869 -25.721 5.378 1.00 0.00 C ATOM 2412 OE1 GLU B 44 3.880 -25.705 6.111 1.00 0.00 O ATOM 2413 OE2 GLU B 44 2.310 -26.774 5.005 1.00 0.00 O ATOM 0 H GLU B 44 2.020 -21.303 4.470 1.00 0.00 H new ATOM 0 HA GLU B 44 3.093 -22.662 6.715 1.00 0.00 H new ATOM 0 HB2 GLU B 44 3.199 -22.884 3.709 1.00 0.00 H new ATOM 0 HB3 GLU B 44 4.335 -23.826 4.655 1.00 0.00 H new ATOM 0 HG2 GLU B 44 1.584 -24.034 5.666 1.00 0.00 H new ATOM 0 HG3 GLU B 44 1.728 -24.549 3.997 1.00 0.00 H new ATOM 2420 N LEU B 45 5.274 -21.040 4.815 1.00 0.00 N ATOM 2421 CA LEU B 45 6.614 -20.458 4.809 1.00 0.00 C ATOM 2422 C LEU B 45 6.742 -19.354 5.854 1.00 0.00 C ATOM 2423 O LEU B 45 7.832 -19.095 6.365 1.00 0.00 O ATOM 2424 CB LEU B 45 6.952 -19.897 3.425 1.00 0.00 C ATOM 2425 CG LEU B 45 6.541 -20.776 2.243 1.00 0.00 C ATOM 2426 CD1 LEU B 45 7.044 -20.179 0.937 1.00 0.00 C ATOM 2427 CD2 LEU B 45 7.069 -22.192 2.422 1.00 0.00 C ATOM 0 H LEU B 45 4.755 -20.913 3.946 1.00 0.00 H new ATOM 0 HA LEU B 45 7.318 -21.253 5.056 1.00 0.00 H new ATOM 0 HB2 LEU B 45 6.470 -18.925 3.318 1.00 0.00 H new ATOM 0 HB3 LEU B 45 8.027 -19.727 3.373 1.00 0.00 H new ATOM 0 HG LEU B 45 5.452 -20.818 2.206 1.00 0.00 H new ATOM 0 HD11 LEU B 45 6.743 -20.817 0.106 1.00 0.00 H new ATOM 0 HD12 LEU B 45 6.618 -19.184 0.804 1.00 0.00 H new ATOM 0 HD13 LEU B 45 8.131 -20.108 0.964 1.00 0.00 H new ATOM 0 HD21 LEU B 45 6.767 -22.803 1.572 1.00 0.00 H new ATOM 0 HD22 LEU B 45 8.157 -22.169 2.484 1.00 0.00 H new ATOM 0 HD23 LEU B 45 6.662 -22.619 3.339 1.00 0.00 H new ATOM 2439 N LEU B 46 5.626 -18.704 6.166 1.00 0.00 N ATOM 2440 CA LEU B 46 5.621 -17.627 7.150 1.00 0.00 C ATOM 2441 C LEU B 46 5.361 -18.160 8.557 1.00 0.00 C ATOM 2442 O LEU B 46 4.984 -17.406 9.454 1.00 0.00 O ATOM 2443 CB LEU B 46 4.563 -16.583 6.786 1.00 0.00 C ATOM 2444 CG LEU B 46 4.762 -15.209 7.426 1.00 0.00 C ATOM 2445 CD1 LEU B 46 6.047 -14.568 6.926 1.00 0.00 C ATOM 2446 CD2 LEU B 46 3.569 -14.310 7.138 1.00 0.00 C ATOM 0 H LEU B 46 4.715 -18.903 5.753 1.00 0.00 H new ATOM 0 HA LEU B 46 6.607 -17.162 7.140 1.00 0.00 H new ATOM 0 HB2 LEU B 46 4.550 -16.464 5.703 1.00 0.00 H new ATOM 0 HB3 LEU B 46 3.584 -16.964 7.077 1.00 0.00 H new ATOM 0 HG LEU B 46 4.842 -15.340 8.505 1.00 0.00 H new ATOM 0 HD11 LEU B 46 6.172 -13.591 7.392 1.00 0.00 H new ATOM 0 HD12 LEU B 46 6.895 -15.203 7.183 1.00 0.00 H new ATOM 0 HD13 LEU B 46 5.997 -14.450 5.844 1.00 0.00 H new ATOM 0 HD21 LEU B 46 3.727 -13.336 7.601 1.00 0.00 H new ATOM 0 HD22 LEU B 46 3.458 -14.186 6.061 1.00 0.00 H new ATOM 0 HD23 LEU B 46 2.665 -14.763 7.546 1.00 0.00 H new ATOM 2458 N ASP B 47 5.562 -19.462 8.747 1.00 0.00 N ATOM 2459 CA ASP B 47 5.347 -20.087 10.047 1.00 0.00 C ATOM 2460 C ASP B 47 3.930 -19.909 10.511 1.00 0.00 C ATOM 2461 O ASP B 47 3.484 -18.811 10.845 1.00 0.00 O ATOM 2462 CB ASP B 47 6.298 -19.528 11.097 1.00 0.00 C ATOM 2463 CG ASP B 47 7.669 -19.200 10.538 1.00 0.00 C ATOM 2464 OD1 ASP B 47 8.043 -19.785 9.500 1.00 0.00 O ATOM 2465 OD2 ASP B 47 8.370 -18.358 11.139 1.00 0.00 O ATOM 0 H ASP B 47 5.873 -20.103 8.017 1.00 0.00 H new ATOM 0 HA ASP B 47 5.547 -21.151 9.922 1.00 0.00 H new ATOM 0 HB2 ASP B 47 5.863 -18.627 11.531 1.00 0.00 H new ATOM 0 HB3 ASP B 47 6.405 -20.252 11.905 1.00 0.00 H new ATOM 2470 N LYS B 48 3.238 -21.020 10.529 1.00 0.00 N ATOM 2471 CA LYS B 48 1.866 -21.064 10.949 1.00 0.00 C ATOM 2472 C LYS B 48 1.724 -20.618 12.402 1.00 0.00 C ATOM 2473 O LYS B 48 0.697 -20.069 12.799 1.00 0.00 O ATOM 2474 CB LYS B 48 1.366 -22.486 10.771 1.00 0.00 C ATOM 2475 CG LYS B 48 0.427 -22.658 9.590 1.00 0.00 C ATOM 2476 CD LYS B 48 1.192 -22.924 8.304 1.00 0.00 C ATOM 2477 CE LYS B 48 2.073 -24.160 8.419 1.00 0.00 C ATOM 2478 NZ LYS B 48 3.494 -23.812 8.701 1.00 0.00 N ATOM 0 H LYS B 48 3.617 -21.925 10.250 1.00 0.00 H new ATOM 0 HA LYS B 48 1.271 -20.379 10.345 1.00 0.00 H new ATOM 0 HB2 LYS B 48 2.221 -23.150 10.644 1.00 0.00 H new ATOM 0 HB3 LYS B 48 0.853 -22.798 11.681 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -0.257 -23.484 9.785 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -0.181 -21.761 9.474 1.00 0.00 H new ATOM 0 HD2 LYS B 48 0.488 -23.054 7.482 1.00 0.00 H new ATOM 0 HD3 LYS B 48 1.809 -22.059 8.062 1.00 0.00 H new ATOM 0 HE2 LYS B 48 1.693 -24.803 9.213 1.00 0.00 H new ATOM 0 HE3 LYS B 48 2.017 -24.732 7.493 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 4.110 -24.272 8.001 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 3.617 -22.781 8.645 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 3.749 -24.140 9.655 1.00 0.00 H new ATOM 2492 N LYS B 49 2.767 -20.862 13.189 1.00 0.00 N ATOM 2493 CA LYS B 49 2.771 -20.491 14.599 1.00 0.00 C ATOM 2494 C LYS B 49 2.816 -18.975 14.768 1.00 0.00 C ATOM 2495 O LYS B 49 2.342 -18.439 15.770 1.00 0.00 O ATOM 2496 CB LYS B 49 3.967 -21.128 15.308 1.00 0.00 C ATOM 2497 CG LYS B 49 5.302 -20.815 14.650 1.00 0.00 C ATOM 2498 CD LYS B 49 6.464 -21.385 15.449 1.00 0.00 C ATOM 2499 CE LYS B 49 6.675 -20.622 16.747 1.00 0.00 C ATOM 2500 NZ LYS B 49 7.049 -21.526 17.869 1.00 0.00 N ATOM 0 H LYS B 49 3.623 -21.317 12.872 1.00 0.00 H new ATOM 0 HA LYS B 49 1.848 -20.859 15.047 1.00 0.00 H new ATOM 0 HB2 LYS B 49 3.991 -20.784 16.342 1.00 0.00 H new ATOM 0 HB3 LYS B 49 3.829 -22.209 15.335 1.00 0.00 H new ATOM 0 HG2 LYS B 49 5.317 -21.226 13.641 1.00 0.00 H new ATOM 0 HG3 LYS B 49 5.418 -19.735 14.556 1.00 0.00 H new ATOM 0 HD2 LYS B 49 6.274 -22.435 15.670 1.00 0.00 H new ATOM 0 HD3 LYS B 49 7.374 -21.344 14.850 1.00 0.00 H new ATOM 0 HE2 LYS B 49 7.457 -19.876 16.606 1.00 0.00 H new ATOM 0 HE3 LYS B 49 5.763 -20.083 17.004 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 7.184 -20.967 18.735 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 6.292 -22.223 18.021 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 7.933 -22.021 17.636 1.00 0.00 H new ATOM 2514 N ALA B 50 3.391 -18.288 13.785 1.00 0.00 N ATOM 2515 CA ALA B 50 3.500 -16.834 13.828 1.00 0.00 C ATOM 2516 C ALA B 50 2.134 -16.181 14.038 1.00 0.00 C ATOM 2517 O ALA B 50 1.121 -16.668 13.536 1.00 0.00 O ATOM 2518 CB ALA B 50 4.142 -16.316 12.550 1.00 0.00 C ATOM 0 H ALA B 50 3.789 -18.716 12.949 1.00 0.00 H new ATOM 0 HA ALA B 50 4.132 -16.569 14.675 1.00 0.00 H new ATOM 0 HB1 ALA B 50 4.217 -15.230 12.595 1.00 0.00 H new ATOM 0 HB2 ALA B 50 5.138 -16.745 12.444 1.00 0.00 H new ATOM 0 HB3 ALA B 50 3.531 -16.602 11.694 1.00 0.00 H new ATOM 2524 N PRO B 51 2.089 -15.063 14.786 1.00 0.00 N ATOM 2525 CA PRO B 51 0.838 -14.345 15.058 1.00 0.00 C ATOM 2526 C PRO B 51 0.085 -13.989 13.781 1.00 0.00 C ATOM 2527 O PRO B 51 0.598 -14.167 12.676 1.00 0.00 O ATOM 2528 CB PRO B 51 1.301 -13.075 15.776 1.00 0.00 C ATOM 2529 CG PRO B 51 2.618 -13.432 16.372 1.00 0.00 C ATOM 2530 CD PRO B 51 3.249 -14.412 15.423 1.00 0.00 C ATOM 0 HA PRO B 51 0.143 -14.949 15.641 1.00 0.00 H new ATOM 0 HB2 PRO B 51 1.395 -12.240 15.082 1.00 0.00 H new ATOM 0 HB3 PRO B 51 0.589 -12.773 16.544 1.00 0.00 H new ATOM 0 HG2 PRO B 51 3.244 -12.548 16.494 1.00 0.00 H new ATOM 0 HG3 PRO B 51 2.492 -13.872 17.361 1.00 0.00 H new ATOM 0 HD2 PRO B 51 3.882 -13.912 14.690 1.00 0.00 H new ATOM 0 HD3 PRO B 51 3.877 -15.132 15.947 1.00 0.00 H new ATOM 2538 N SER B 52 -1.134 -13.485 13.940 1.00 0.00 N ATOM 2539 CA SER B 52 -1.958 -13.103 12.799 1.00 0.00 C ATOM 2540 C SER B 52 -3.033 -12.103 13.214 1.00 0.00 C ATOM 2541 O SER B 52 -4.200 -12.462 13.372 1.00 0.00 O ATOM 2542 CB SER B 52 -2.607 -14.340 12.176 1.00 0.00 C ATOM 2543 OG SER B 52 -3.288 -15.107 13.154 1.00 0.00 O ATOM 0 H SER B 52 -1.573 -13.332 14.848 1.00 0.00 H new ATOM 0 HA SER B 52 -1.313 -12.628 12.059 1.00 0.00 H new ATOM 0 HB2 SER B 52 -3.306 -14.034 11.398 1.00 0.00 H new ATOM 0 HB3 SER B 52 -1.843 -14.952 11.696 1.00 0.00 H new ATOM 0 HG SER B 52 -3.922 -14.535 13.635 1.00 0.00 H new ATOM 2549 N HIS B 53 -2.633 -10.848 13.387 1.00 0.00 N ATOM 2550 CA HIS B 53 -3.563 -9.796 13.782 1.00 0.00 C ATOM 2551 C HIS B 53 -4.349 -9.287 12.577 1.00 0.00 C ATOM 2552 O HIS B 53 -5.515 -9.635 12.393 1.00 0.00 O ATOM 2553 CB HIS B 53 -2.809 -8.640 14.442 1.00 0.00 C ATOM 2554 CG HIS B 53 -2.689 -8.776 15.928 1.00 0.00 C ATOM 2555 ND1 HIS B 53 -3.582 -8.206 16.811 1.00 0.00 N ATOM 2556 CD2 HIS B 53 -1.772 -9.422 16.687 1.00 0.00 C ATOM 2557 CE1 HIS B 53 -3.220 -8.495 18.049 1.00 0.00 C ATOM 2558 NE2 HIS B 53 -2.126 -9.232 18.001 1.00 0.00 N ATOM 0 H HIS B 53 -1.671 -10.534 13.260 1.00 0.00 H new ATOM 0 HA HIS B 53 -4.266 -10.216 14.501 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -1.811 -8.574 14.009 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -3.319 -7.705 14.211 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -0.922 -9.982 16.327 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -3.732 -8.182 18.947 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -1.624 -9.601 18.809 1.00 0.00 H new ATOM 2567 N LEU B 54 -3.702 -8.464 11.758 1.00 0.00 N ATOM 2568 CA LEU B 54 -4.340 -7.910 10.570 1.00 0.00 C ATOM 2569 C LEU B 54 -4.317 -8.917 9.425 1.00 0.00 C ATOM 2570 O LEU B 54 -5.354 -9.236 8.845 1.00 0.00 O ATOM 2571 CB LEU B 54 -3.640 -6.618 10.143 1.00 0.00 C ATOM 2572 CG LEU B 54 -4.073 -5.364 10.905 1.00 0.00 C ATOM 2573 CD1 LEU B 54 -3.937 -5.577 12.404 1.00 0.00 C ATOM 2574 CD2 LEU B 54 -3.255 -4.162 10.458 1.00 0.00 C ATOM 0 H LEU B 54 -2.736 -8.166 11.896 1.00 0.00 H new ATOM 0 HA LEU B 54 -5.378 -7.686 10.815 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -2.565 -6.747 10.268 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -3.821 -6.459 9.080 1.00 0.00 H new ATOM 0 HG LEU B 54 -5.122 -5.169 10.681 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -4.249 -4.675 12.930 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -4.566 -6.412 12.711 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -2.898 -5.797 12.647 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -3.576 -3.278 11.010 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -2.199 -4.348 10.653 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -3.404 -3.997 9.391 1.00 0.00 H new ATOM 2586 N CYS B 55 -3.125 -9.417 9.107 1.00 0.00 N ATOM 2587 CA CYS B 55 -2.962 -10.392 8.033 1.00 0.00 C ATOM 2588 C CYS B 55 -3.850 -11.613 8.267 1.00 0.00 C ATOM 2589 O CYS B 55 -3.550 -12.451 9.117 1.00 0.00 O ATOM 2590 CB CYS B 55 -1.499 -10.828 7.932 1.00 0.00 C ATOM 2591 SG CYS B 55 -0.321 -9.457 7.882 1.00 0.00 S ATOM 0 H CYS B 55 -2.257 -9.162 9.579 1.00 0.00 H new ATOM 0 HA CYS B 55 -3.261 -9.919 7.098 1.00 0.00 H new ATOM 0 HB2 CYS B 55 -1.262 -11.466 8.783 1.00 0.00 H new ATOM 0 HB3 CYS B 55 -1.373 -11.434 7.035 1.00 0.00 H new ATOM 0 HG CYS B 55 0.888 -9.927 7.799 1.00 0.00 H new ATOM 2597 N PRO B 56 -4.964 -11.731 7.520 1.00 0.00 N ATOM 2598 CA PRO B 56 -5.892 -12.838 7.651 1.00 0.00 C ATOM 2599 C PRO B 56 -5.599 -13.964 6.665 1.00 0.00 C ATOM 2600 O PRO B 56 -5.294 -13.719 5.498 1.00 0.00 O ATOM 2601 CB PRO B 56 -7.240 -12.184 7.334 1.00 0.00 C ATOM 2602 CG PRO B 56 -6.927 -10.942 6.544 1.00 0.00 C ATOM 2603 CD PRO B 56 -5.424 -10.798 6.489 1.00 0.00 C ATOM 0 HA PRO B 56 -5.842 -13.308 8.633 1.00 0.00 H new ATOM 0 HB2 PRO B 56 -7.876 -12.860 6.762 1.00 0.00 H new ATOM 0 HB3 PRO B 56 -7.778 -11.938 8.249 1.00 0.00 H new ATOM 0 HG2 PRO B 56 -7.341 -11.014 5.538 1.00 0.00 H new ATOM 0 HG3 PRO B 56 -7.378 -10.067 7.012 1.00 0.00 H new ATOM 0 HD2 PRO B 56 -5.030 -11.057 5.506 1.00 0.00 H new ATOM 0 HD3 PRO B 56 -5.109 -9.776 6.700 1.00 0.00 H new ATOM 2611 N THR B 57 -5.703 -15.198 7.143 1.00 0.00 N ATOM 2612 CA THR B 57 -5.459 -16.368 6.308 1.00 0.00 C ATOM 2613 C THR B 57 -6.560 -16.571 5.318 1.00 0.00 C ATOM 2614 O THR B 57 -7.654 -16.020 5.444 1.00 0.00 O ATOM 2615 CB THR B 57 -5.312 -17.644 7.134 1.00 0.00 C ATOM 2616 OG1 THR B 57 -4.241 -18.433 6.649 1.00 0.00 O ATOM 2617 CG2 THR B 57 -6.560 -18.520 7.145 1.00 0.00 C ATOM 0 H THR B 57 -5.955 -15.415 8.107 1.00 0.00 H new ATOM 0 HA THR B 57 -4.523 -16.172 5.785 1.00 0.00 H new ATOM 0 HB THR B 57 -5.128 -17.300 8.152 1.00 0.00 H new ATOM 0 HG1 THR B 57 -4.190 -18.352 5.674 1.00 0.00 H new ATOM 0 HG21 THR B 57 -6.377 -19.407 7.752 1.00 0.00 H new ATOM 0 HG22 THR B 57 -7.395 -17.959 7.565 1.00 0.00 H new ATOM 0 HG23 THR B 57 -6.802 -18.822 6.126 1.00 0.00 H new ATOM 2625 N ILE B 58 -6.270 -17.410 4.350 1.00 0.00 N ATOM 2626 CA ILE B 58 -7.251 -17.738 3.353 1.00 0.00 C ATOM 2627 C ILE B 58 -7.382 -19.238 3.167 1.00 0.00 C ATOM 2628 O ILE B 58 -6.386 -19.960 3.122 1.00 0.00 O ATOM 2629 CB ILE B 58 -6.986 -17.053 2.005 1.00 0.00 C ATOM 2630 CG1 ILE B 58 -6.586 -15.587 2.263 1.00 0.00 C ATOM 2631 CG2 ILE B 58 -8.218 -17.198 1.121 1.00 0.00 C ATOM 2632 CD1 ILE B 58 -7.251 -14.576 1.368 1.00 0.00 C ATOM 0 H ILE B 58 -5.368 -17.873 4.236 1.00 0.00 H new ATOM 0 HA ILE B 58 -8.198 -17.351 3.731 1.00 0.00 H new ATOM 0 HB ILE B 58 -6.159 -17.522 1.472 1.00 0.00 H new ATOM 0 HG12 ILE B 58 -6.818 -15.340 3.299 1.00 0.00 H new ATOM 0 HG13 ILE B 58 -5.506 -15.496 2.148 1.00 0.00 H new ATOM 0 HG21 ILE B 58 -8.037 -16.713 0.162 1.00 0.00 H new ATOM 0 HG22 ILE B 58 -8.428 -18.255 0.960 1.00 0.00 H new ATOM 0 HG23 ILE B 58 -9.073 -16.729 1.608 1.00 0.00 H new ATOM 0 HD11 ILE B 58 -6.904 -13.576 1.628 1.00 0.00 H new ATOM 0 HD12 ILE B 58 -6.999 -14.788 0.329 1.00 0.00 H new ATOM 0 HD13 ILE B 58 -8.332 -14.630 1.498 1.00 0.00 H new ATOM 2644 N HIS B 59 -8.623 -19.703 3.056 1.00 0.00 N ATOM 2645 CA HIS B 59 -8.885 -21.117 2.872 1.00 0.00 C ATOM 2646 C HIS B 59 -9.629 -21.340 1.578 1.00 0.00 C ATOM 2647 O HIS B 59 -10.857 -21.410 1.541 1.00 0.00 O ATOM 2648 CB HIS B 59 -9.689 -21.687 4.026 1.00 0.00 C ATOM 2649 CG HIS B 59 -9.251 -21.200 5.373 1.00 0.00 C ATOM 2650 ND1 HIS B 59 -8.328 -21.867 6.151 1.00 0.00 N ATOM 2651 CD2 HIS B 59 -9.613 -20.103 6.079 1.00 0.00 C ATOM 2652 CE1 HIS B 59 -8.143 -21.202 7.278 1.00 0.00 C ATOM 2653 NE2 HIS B 59 -8.911 -20.128 7.258 1.00 0.00 N ATOM 0 H HIS B 59 -9.458 -19.118 3.091 1.00 0.00 H new ATOM 0 HA HIS B 59 -7.925 -21.632 2.838 1.00 0.00 H new ATOM 0 HB2 HIS B 59 -10.740 -21.434 3.883 1.00 0.00 H new ATOM 0 HB3 HIS B 59 -9.617 -22.774 4.003 1.00 0.00 H new ATOM 0 HD2 HIS B 59 -10.322 -19.349 5.772 1.00 0.00 H new ATOM 0 HE1 HIS B 59 -7.477 -21.488 8.079 1.00 0.00 H new ATOM 0 HE2 HIS B 59 -8.973 -19.430 7.999 1.00 0.00 H new ATOM 2662 N ILE B 60 -8.860 -21.442 0.525 1.00 0.00 N ATOM 2663 CA ILE B 60 -9.396 -21.650 -0.805 1.00 0.00 C ATOM 2664 C ILE B 60 -8.972 -23.015 -1.352 1.00 0.00 C ATOM 2665 O ILE B 60 -8.511 -23.873 -0.600 1.00 0.00 O ATOM 2666 CB ILE B 60 -8.956 -20.513 -1.752 1.00 0.00 C ATOM 2667 CG1 ILE B 60 -7.451 -20.571 -2.017 1.00 0.00 C ATOM 2668 CG2 ILE B 60 -9.332 -19.162 -1.148 1.00 0.00 C ATOM 2669 CD1 ILE B 60 -7.080 -20.208 -3.437 1.00 0.00 C ATOM 0 H ILE B 60 -7.842 -21.384 0.560 1.00 0.00 H new ATOM 0 HA ILE B 60 -10.484 -21.636 -0.743 1.00 0.00 H new ATOM 0 HB ILE B 60 -9.472 -20.639 -2.704 1.00 0.00 H new ATOM 0 HG12 ILE B 60 -6.942 -19.894 -1.331 1.00 0.00 H new ATOM 0 HG13 ILE B 60 -7.089 -21.576 -1.800 1.00 0.00 H new ATOM 0 HG21 ILE B 60 -9.019 -18.363 -1.820 1.00 0.00 H new ATOM 0 HG22 ILE B 60 -10.412 -19.115 -1.006 1.00 0.00 H new ATOM 0 HG23 ILE B 60 -8.834 -19.042 -0.186 1.00 0.00 H new ATOM 0 HD11 ILE B 60 -5.998 -20.269 -3.557 1.00 0.00 H new ATOM 0 HD12 ILE B 60 -7.562 -20.901 -4.127 1.00 0.00 H new ATOM 0 HD13 ILE B 60 -7.412 -19.192 -3.651 1.00 0.00 H new ATOM 2681 N ASP B 61 -9.149 -23.223 -2.652 1.00 0.00 N ATOM 2682 CA ASP B 61 -8.802 -24.499 -3.274 1.00 0.00 C ATOM 2683 C ASP B 61 -7.292 -24.694 -3.400 1.00 0.00 C ATOM 2684 O ASP B 61 -6.814 -25.824 -3.492 1.00 0.00 O ATOM 2685 CB ASP B 61 -9.453 -24.605 -4.653 1.00 0.00 C ATOM 2686 CG ASP B 61 -10.961 -24.463 -4.594 1.00 0.00 C ATOM 2687 OD1 ASP B 61 -11.467 -23.918 -3.591 1.00 0.00 O ATOM 2688 OD2 ASP B 61 -11.636 -24.897 -5.551 1.00 0.00 O ATOM 0 H ASP B 61 -9.529 -22.528 -3.295 1.00 0.00 H new ATOM 0 HA ASP B 61 -9.181 -25.287 -2.623 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -9.044 -23.833 -5.305 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -9.199 -25.567 -5.099 1.00 0.00 H new ATOM 2693 N GLU B 62 -6.546 -23.598 -3.418 1.00 0.00 N ATOM 2694 CA GLU B 62 -5.094 -23.672 -3.551 1.00 0.00 C ATOM 2695 C GLU B 62 -4.409 -23.949 -2.211 1.00 0.00 C ATOM 2696 O GLU B 62 -3.192 -24.126 -2.160 1.00 0.00 O ATOM 2697 CB GLU B 62 -4.550 -22.381 -4.162 1.00 0.00 C ATOM 2698 CG GLU B 62 -4.797 -22.264 -5.657 1.00 0.00 C ATOM 2699 CD GLU B 62 -4.070 -23.331 -6.453 1.00 0.00 C ATOM 2700 OE1 GLU B 62 -2.840 -23.466 -6.280 1.00 0.00 O ATOM 2701 OE2 GLU B 62 -4.730 -24.031 -7.249 1.00 0.00 O ATOM 0 H GLU B 62 -6.918 -22.651 -3.343 1.00 0.00 H new ATOM 0 HA GLU B 62 -4.871 -24.508 -4.214 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -5.008 -21.530 -3.659 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -3.478 -22.323 -3.974 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -5.867 -22.337 -5.852 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -4.477 -21.280 -5.999 1.00 0.00 H new ATOM 2708 N GLY B 63 -5.186 -24.001 -1.129 1.00 0.00 N ATOM 2709 CA GLY B 63 -4.606 -24.277 0.178 1.00 0.00 C ATOM 2710 C GLY B 63 -4.679 -23.100 1.137 1.00 0.00 C ATOM 2711 O GLY B 63 -5.519 -22.213 0.986 1.00 0.00 O ATOM 0 H GLY B 63 -6.196 -23.859 -1.133 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -5.121 -25.129 0.622 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -3.563 -24.566 0.050 1.00 0.00 H new ATOM 2715 N ASP B 64 -3.794 -23.106 2.137 1.00 0.00 N ATOM 2716 CA ASP B 64 -3.750 -22.048 3.145 1.00 0.00 C ATOM 2717 C ASP B 64 -2.772 -20.942 2.756 1.00 0.00 C ATOM 2718 O ASP B 64 -1.626 -21.210 2.397 1.00 0.00 O ATOM 2719 CB ASP B 64 -3.356 -22.632 4.503 1.00 0.00 C ATOM 2720 CG ASP B 64 -4.158 -23.869 4.856 1.00 0.00 C ATOM 2721 OD1 ASP B 64 -5.234 -23.722 5.472 1.00 0.00 O ATOM 2722 OD2 ASP B 64 -3.710 -24.984 4.516 1.00 0.00 O ATOM 0 H ASP B 64 -3.095 -23.837 2.269 1.00 0.00 H new ATOM 0 HA ASP B 64 -4.746 -21.611 3.210 1.00 0.00 H new ATOM 0 HB2 ASP B 64 -2.295 -22.881 4.494 1.00 0.00 H new ATOM 0 HB3 ASP B 64 -3.500 -21.877 5.276 1.00 0.00 H new ATOM 2727 N PHE B 65 -3.239 -19.700 2.841 1.00 0.00 N ATOM 2728 CA PHE B 65 -2.424 -18.534 2.510 1.00 0.00 C ATOM 2729 C PHE B 65 -2.736 -17.397 3.476 1.00 0.00 C ATOM 2730 O PHE B 65 -3.471 -17.602 4.442 1.00 0.00 O ATOM 2731 CB PHE B 65 -2.661 -18.138 1.058 1.00 0.00 C ATOM 2732 CG PHE B 65 -2.344 -19.274 0.138 1.00 0.00 C ATOM 2733 CD1 PHE B 65 -1.085 -19.850 0.162 1.00 0.00 C ATOM 2734 CD2 PHE B 65 -3.301 -19.794 -0.712 1.00 0.00 C ATOM 2735 CE1 PHE B 65 -0.783 -20.924 -0.654 1.00 0.00 C ATOM 2736 CE2 PHE B 65 -3.009 -20.869 -1.528 1.00 0.00 C ATOM 2737 CZ PHE B 65 -1.748 -21.436 -1.500 1.00 0.00 C ATOM 0 H PHE B 65 -4.188 -19.473 3.139 1.00 0.00 H new ATOM 0 HA PHE B 65 -1.366 -18.773 2.617 1.00 0.00 H new ATOM 0 HB2 PHE B 65 -3.699 -17.835 0.924 1.00 0.00 H new ATOM 0 HB3 PHE B 65 -2.042 -17.277 0.806 1.00 0.00 H new ATOM 0 HD1 PHE B 65 -0.330 -19.455 0.826 1.00 0.00 H new ATOM 0 HD2 PHE B 65 -4.288 -19.355 -0.739 1.00 0.00 H new ATOM 0 HE1 PHE B 65 0.204 -21.362 -0.630 1.00 0.00 H new ATOM 0 HE2 PHE B 65 -3.765 -21.267 -2.188 1.00 0.00 H new ATOM 0 HZ PHE B 65 -1.518 -22.277 -2.138 1.00 0.00 H new ATOM 2747 N ILE B 66 -2.173 -16.210 3.256 1.00 0.00 N ATOM 2748 CA ILE B 66 -2.420 -15.108 4.175 1.00 0.00 C ATOM 2749 C ILE B 66 -2.129 -13.758 3.541 1.00 0.00 C ATOM 2750 O ILE B 66 -0.994 -13.472 3.159 1.00 0.00 O ATOM 2751 CB ILE B 66 -1.578 -15.244 5.472 1.00 0.00 C ATOM 2752 CG1 ILE B 66 -0.459 -16.271 5.287 1.00 0.00 C ATOM 2753 CG2 ILE B 66 -2.456 -15.623 6.654 1.00 0.00 C ATOM 2754 CD1 ILE B 66 0.515 -15.878 4.210 1.00 0.00 C ATOM 0 H ILE B 66 -1.559 -15.992 2.471 1.00 0.00 H new ATOM 0 HA ILE B 66 -3.480 -15.160 4.425 1.00 0.00 H new ATOM 0 HB ILE B 66 -1.126 -14.274 5.680 1.00 0.00 H new ATOM 0 HG12 ILE B 66 0.076 -16.393 6.229 1.00 0.00 H new ATOM 0 HG13 ILE B 66 -0.896 -17.239 5.041 1.00 0.00 H new ATOM 0 HG21 ILE B 66 -1.842 -15.712 7.550 1.00 0.00 H new ATOM 0 HG22 ILE B 66 -3.212 -14.853 6.807 1.00 0.00 H new ATOM 0 HG23 ILE B 66 -2.945 -16.576 6.453 1.00 0.00 H new ATOM 0 HD11 ILE B 66 1.287 -16.642 4.122 1.00 0.00 H new ATOM 0 HD12 ILE B 66 -0.012 -15.783 3.260 1.00 0.00 H new ATOM 0 HD13 ILE B 66 0.976 -14.924 4.467 1.00 0.00 H new ATOM 2766 N MET B 67 -3.152 -12.913 3.453 1.00 0.00 N ATOM 2767 CA MET B 67 -2.971 -11.587 2.890 1.00 0.00 C ATOM 2768 C MET B 67 -2.035 -10.791 3.782 1.00 0.00 C ATOM 2769 O MET B 67 -2.379 -10.448 4.913 1.00 0.00 O ATOM 2770 CB MET B 67 -4.309 -10.860 2.751 1.00 0.00 C ATOM 2771 CG MET B 67 -5.369 -11.659 2.020 1.00 0.00 C ATOM 2772 SD MET B 67 -6.952 -10.802 1.949 1.00 0.00 S ATOM 2773 CE MET B 67 -7.870 -11.682 3.209 1.00 0.00 C ATOM 0 H MET B 67 -4.102 -13.122 3.761 1.00 0.00 H new ATOM 0 HA MET B 67 -2.539 -11.684 1.894 1.00 0.00 H new ATOM 0 HB2 MET B 67 -4.679 -10.608 3.745 1.00 0.00 H new ATOM 0 HB3 MET B 67 -4.148 -9.920 2.223 1.00 0.00 H new ATOM 0 HG2 MET B 67 -5.027 -11.868 1.006 1.00 0.00 H new ATOM 0 HG3 MET B 67 -5.502 -12.620 2.517 1.00 0.00 H new ATOM 0 HE1 MET B 67 -8.524 -10.987 3.735 1.00 0.00 H new ATOM 0 HE2 MET B 67 -8.470 -12.463 2.743 1.00 0.00 H new ATOM 0 HE3 MET B 67 -7.175 -12.133 3.918 1.00 0.00 H new ATOM 2783 N LEU B 68 -0.845 -10.517 3.276 1.00 0.00 N ATOM 2784 CA LEU B 68 0.150 -9.776 4.042 1.00 0.00 C ATOM 2785 C LEU B 68 -0.247 -8.306 4.177 1.00 0.00 C ATOM 2786 O LEU B 68 0.284 -7.440 3.481 1.00 0.00 O ATOM 2787 CB LEU B 68 1.537 -9.910 3.395 1.00 0.00 C ATOM 2788 CG LEU B 68 2.706 -9.997 4.378 1.00 0.00 C ATOM 2789 CD1 LEU B 68 3.040 -11.452 4.678 1.00 0.00 C ATOM 2790 CD2 LEU B 68 3.924 -9.275 3.821 1.00 0.00 C ATOM 0 H LEU B 68 -0.542 -10.794 2.342 1.00 0.00 H new ATOM 0 HA LEU B 68 0.196 -10.203 5.044 1.00 0.00 H new ATOM 0 HB2 LEU B 68 1.543 -10.801 2.767 1.00 0.00 H new ATOM 0 HB3 LEU B 68 1.698 -9.056 2.738 1.00 0.00 H new ATOM 0 HG LEU B 68 2.413 -9.511 5.308 1.00 0.00 H new ATOM 0 HD11 LEU B 68 3.874 -11.497 5.379 1.00 0.00 H new ATOM 0 HD12 LEU B 68 2.171 -11.942 5.116 1.00 0.00 H new ATOM 0 HD13 LEU B 68 3.315 -11.960 3.754 1.00 0.00 H new ATOM 0 HD21 LEU B 68 4.746 -9.347 4.533 1.00 0.00 H new ATOM 0 HD22 LEU B 68 4.219 -9.734 2.878 1.00 0.00 H new ATOM 0 HD23 LEU B 68 3.680 -8.226 3.653 1.00 0.00 H new ATOM 2802 N THR B 69 -1.187 -8.036 5.086 1.00 0.00 N ATOM 2803 CA THR B 69 -1.665 -6.674 5.330 1.00 0.00 C ATOM 2804 C THR B 69 -0.585 -5.821 6.000 1.00 0.00 C ATOM 2805 O THR B 69 -0.727 -4.604 6.114 1.00 0.00 O ATOM 2806 CB THR B 69 -2.916 -6.696 6.221 1.00 0.00 C ATOM 2807 OG1 THR B 69 -2.807 -7.708 7.205 1.00 0.00 O ATOM 2808 CG2 THR B 69 -4.211 -6.933 5.467 1.00 0.00 C ATOM 0 H THR B 69 -1.633 -8.746 5.667 1.00 0.00 H new ATOM 0 HA THR B 69 -1.912 -6.234 4.364 1.00 0.00 H new ATOM 0 HB THR B 69 -2.960 -5.701 6.665 1.00 0.00 H new ATOM 0 HG1 THR B 69 -1.869 -7.975 7.297 1.00 0.00 H new ATOM 0 HG21 THR B 69 -5.045 -6.934 6.168 1.00 0.00 H new ATOM 0 HG22 THR B 69 -4.355 -6.140 4.733 1.00 0.00 H new ATOM 0 HG23 THR B 69 -4.164 -7.895 4.957 1.00 0.00 H new ATOM 2816 N GLN B 70 0.487 -6.468 6.456 1.00 0.00 N ATOM 2817 CA GLN B 70 1.579 -5.770 7.130 1.00 0.00 C ATOM 2818 C GLN B 70 2.370 -4.875 6.174 1.00 0.00 C ATOM 2819 O GLN B 70 3.237 -4.117 6.607 1.00 0.00 O ATOM 2820 CB GLN B 70 2.521 -6.781 7.788 1.00 0.00 C ATOM 2821 CG GLN B 70 3.247 -7.674 6.793 1.00 0.00 C ATOM 2822 CD GLN B 70 4.751 -7.482 6.824 1.00 0.00 C ATOM 2823 OE1 GLN B 70 5.326 -7.133 5.680 1.00 0.00 O flip ATOM 2824 NE2 GLN B 70 5.388 -7.645 7.865 1.00 0.00 N flip ATOM 0 H GLN B 70 0.622 -7.475 6.370 1.00 0.00 H new ATOM 0 HA GLN B 70 1.133 -5.129 7.890 1.00 0.00 H new ATOM 0 HB2 GLN B 70 3.257 -6.243 8.386 1.00 0.00 H new ATOM 0 HB3 GLN B 70 1.948 -7.406 8.474 1.00 0.00 H new ATOM 0 HG2 GLN B 70 3.013 -8.717 7.009 1.00 0.00 H new ATOM 0 HG3 GLN B 70 2.879 -7.466 5.788 1.00 0.00 H new ATOM 0 HE21 GLN B 70 4.904 -7.913 8.722 1.00 0.00 H new ATOM 0 HE22 GLN B 70 6.399 -7.512 7.870 1.00 0.00 H new ATOM 2833 N GLN B 71 2.074 -4.958 4.879 1.00 0.00 N ATOM 2834 CA GLN B 71 2.770 -4.142 3.891 1.00 0.00 C ATOM 2835 C GLN B 71 1.773 -3.355 3.058 1.00 0.00 C ATOM 2836 O GLN B 71 1.805 -2.126 3.034 1.00 0.00 O ATOM 2837 CB GLN B 71 3.635 -5.022 2.986 1.00 0.00 C ATOM 2838 CG GLN B 71 4.983 -4.407 2.648 1.00 0.00 C ATOM 2839 CD GLN B 71 4.892 -3.377 1.538 1.00 0.00 C ATOM 2840 OE1 GLN B 71 4.053 -2.478 1.577 1.00 0.00 O ATOM 2841 NE2 GLN B 71 5.758 -3.505 0.540 1.00 0.00 N ATOM 0 H GLN B 71 1.362 -5.578 4.493 1.00 0.00 H new ATOM 0 HA GLN B 71 3.417 -3.440 4.417 1.00 0.00 H new ATOM 0 HB2 GLN B 71 3.796 -5.983 3.474 1.00 0.00 H new ATOM 0 HB3 GLN B 71 3.093 -5.221 2.061 1.00 0.00 H new ATOM 0 HG2 GLN B 71 5.399 -3.939 3.540 1.00 0.00 H new ATOM 0 HG3 GLN B 71 5.674 -5.196 2.351 1.00 0.00 H new ATOM 0 HE21 GLN B 71 6.437 -4.266 0.548 1.00 0.00 H new ATOM 0 HE22 GLN B 71 5.744 -2.842 -0.235 1.00 0.00 H new ATOM 2850 N MET B 72 0.882 -4.070 2.383 1.00 0.00 N ATOM 2851 CA MET B 72 -0.134 -3.434 1.558 1.00 0.00 C ATOM 2852 C MET B 72 0.501 -2.533 0.504 1.00 0.00 C ATOM 2853 O MET B 72 1.057 -1.482 0.820 1.00 0.00 O ATOM 2854 CB MET B 72 -1.082 -2.627 2.442 1.00 0.00 C ATOM 2855 CG MET B 72 -2.409 -2.308 1.774 1.00 0.00 C ATOM 2856 SD MET B 72 -3.823 -2.614 2.851 1.00 0.00 S ATOM 2857 CE MET B 72 -3.650 -4.372 3.143 1.00 0.00 C ATOM 0 H MET B 72 0.843 -5.089 2.391 1.00 0.00 H new ATOM 0 HA MET B 72 -0.696 -4.211 1.040 1.00 0.00 H new ATOM 0 HB2 MET B 72 -1.271 -3.183 3.361 1.00 0.00 H new ATOM 0 HB3 MET B 72 -0.595 -1.695 2.728 1.00 0.00 H new ATOM 0 HG2 MET B 72 -2.413 -1.263 1.464 1.00 0.00 H new ATOM 0 HG3 MET B 72 -2.510 -2.909 0.870 1.00 0.00 H new ATOM 0 HE1 MET B 72 -4.637 -4.833 3.181 1.00 0.00 H new ATOM 0 HE2 MET B 72 -3.071 -4.820 2.336 1.00 0.00 H new ATOM 0 HE3 MET B 72 -3.137 -4.535 4.091 1.00 0.00 H new ATOM 2867 N THR B 73 0.418 -2.958 -0.749 1.00 0.00 N ATOM 2868 CA THR B 73 0.988 -2.202 -1.859 1.00 0.00 C ATOM 2869 C THR B 73 0.075 -2.273 -3.077 1.00 0.00 C ATOM 2870 O THR B 73 -0.952 -2.943 -3.041 1.00 0.00 O ATOM 2871 CB THR B 73 2.369 -2.760 -2.207 1.00 0.00 C ATOM 2872 OG1 THR B 73 2.326 -4.175 -2.312 1.00 0.00 O ATOM 2873 CG2 THR B 73 3.431 -2.410 -1.188 1.00 0.00 C ATOM 0 H THR B 73 -0.041 -3.826 -1.025 1.00 0.00 H new ATOM 0 HA THR B 73 1.086 -1.158 -1.560 1.00 0.00 H new ATOM 0 HB THR B 73 2.635 -2.299 -3.158 1.00 0.00 H new ATOM 0 HG1 THR B 73 3.218 -4.514 -2.537 1.00 0.00 H new ATOM 0 HG21 THR B 73 4.386 -2.837 -1.496 1.00 0.00 H new ATOM 0 HG22 THR B 73 3.524 -1.326 -1.117 1.00 0.00 H new ATOM 0 HG23 THR B 73 3.150 -2.815 -0.216 1.00 0.00 H new ATOM 2881 N SER B 74 0.451 -1.595 -4.158 1.00 0.00 N ATOM 2882 CA SER B 74 -0.352 -1.622 -5.377 1.00 0.00 C ATOM 2883 C SER B 74 0.263 -2.574 -6.392 1.00 0.00 C ATOM 2884 O SER B 74 1.468 -2.825 -6.371 1.00 0.00 O ATOM 2885 CB SER B 74 -0.510 -0.224 -5.980 1.00 0.00 C ATOM 2886 OG SER B 74 -1.114 0.664 -5.057 1.00 0.00 O ATOM 0 H SER B 74 1.296 -1.027 -4.216 1.00 0.00 H new ATOM 0 HA SER B 74 -1.347 -1.980 -5.113 1.00 0.00 H new ATOM 0 HB2 SER B 74 0.466 0.161 -6.274 1.00 0.00 H new ATOM 0 HB3 SER B 74 -1.116 -0.281 -6.884 1.00 0.00 H new ATOM 0 HG SER B 74 -0.541 0.755 -4.267 1.00 0.00 H new ATOM 2892 N VAL B 75 -0.573 -3.124 -7.265 1.00 0.00 N ATOM 2893 CA VAL B 75 -0.106 -4.074 -8.267 1.00 0.00 C ATOM 2894 C VAL B 75 -0.361 -3.587 -9.685 1.00 0.00 C ATOM 2895 O VAL B 75 -1.378 -3.917 -10.294 1.00 0.00 O ATOM 2896 CB VAL B 75 -0.786 -5.439 -8.086 1.00 0.00 C ATOM 2897 CG1 VAL B 75 -0.204 -6.170 -6.890 1.00 0.00 C ATOM 2898 CG2 VAL B 75 -2.292 -5.259 -7.959 1.00 0.00 C ATOM 0 H VAL B 75 -1.574 -2.929 -7.299 1.00 0.00 H new ATOM 0 HA VAL B 75 0.970 -4.170 -8.120 1.00 0.00 H new ATOM 0 HB VAL B 75 -0.595 -6.053 -8.966 1.00 0.00 H new ATOM 0 HG11 VAL B 75 -0.698 -7.135 -6.778 1.00 0.00 H new ATOM 0 HG12 VAL B 75 0.864 -6.325 -7.043 1.00 0.00 H new ATOM 0 HG13 VAL B 75 -0.359 -5.576 -5.990 1.00 0.00 H new ATOM 0 HG21 VAL B 75 -2.765 -6.233 -7.831 1.00 0.00 H new ATOM 0 HG22 VAL B 75 -2.512 -4.632 -7.095 1.00 0.00 H new ATOM 0 HG23 VAL B 75 -2.679 -4.783 -8.860 1.00 0.00 H new ATOM 2908 N PRO B 76 0.577 -2.806 -10.238 1.00 0.00 N ATOM 2909 CA PRO B 76 0.471 -2.287 -11.598 1.00 0.00 C ATOM 2910 C PRO B 76 -0.099 -3.325 -12.565 1.00 0.00 C ATOM 2911 O PRO B 76 0.430 -4.430 -12.684 1.00 0.00 O ATOM 2912 CB PRO B 76 1.919 -1.965 -11.956 1.00 0.00 C ATOM 2913 CG PRO B 76 2.589 -1.662 -10.655 1.00 0.00 C ATOM 2914 CD PRO B 76 1.821 -2.382 -9.577 1.00 0.00 C ATOM 0 HA PRO B 76 -0.202 -1.432 -11.665 1.00 0.00 H new ATOM 0 HB2 PRO B 76 2.397 -2.807 -12.458 1.00 0.00 H new ATOM 0 HB3 PRO B 76 1.976 -1.115 -12.635 1.00 0.00 H new ATOM 0 HG2 PRO B 76 3.628 -1.991 -10.672 1.00 0.00 H new ATOM 0 HG3 PRO B 76 2.598 -0.588 -10.468 1.00 0.00 H new ATOM 0 HD2 PRO B 76 2.379 -3.236 -9.194 1.00 0.00 H new ATOM 0 HD3 PRO B 76 1.618 -1.728 -8.729 1.00 0.00 H new ATOM 2922 N VAL B 77 -1.189 -2.961 -13.236 1.00 0.00 N ATOM 2923 CA VAL B 77 -1.867 -3.845 -14.189 1.00 0.00 C ATOM 2924 C VAL B 77 -0.905 -4.810 -14.887 1.00 0.00 C ATOM 2925 O VAL B 77 -1.222 -5.984 -15.077 1.00 0.00 O ATOM 2926 CB VAL B 77 -2.608 -3.027 -15.264 1.00 0.00 C ATOM 2927 CG1 VAL B 77 -1.621 -2.219 -16.094 1.00 0.00 C ATOM 2928 CG2 VAL B 77 -3.443 -3.939 -16.151 1.00 0.00 C ATOM 0 H VAL B 77 -1.629 -2.046 -13.137 1.00 0.00 H new ATOM 0 HA VAL B 77 -2.576 -4.430 -13.604 1.00 0.00 H new ATOM 0 HB VAL B 77 -3.282 -2.331 -14.764 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -2.162 -1.648 -16.848 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -1.073 -1.536 -15.445 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -0.920 -2.894 -16.584 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -3.958 -3.342 -16.904 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -2.793 -4.662 -16.644 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -4.177 -4.467 -15.542 1.00 0.00 H new ATOM 2938 N LYS B 78 0.260 -4.305 -15.278 1.00 0.00 N ATOM 2939 CA LYS B 78 1.255 -5.130 -15.971 1.00 0.00 C ATOM 2940 C LYS B 78 1.536 -6.414 -15.220 1.00 0.00 C ATOM 2941 O LYS B 78 1.374 -7.516 -15.743 1.00 0.00 O ATOM 2942 CB LYS B 78 2.595 -4.416 -16.132 1.00 0.00 C ATOM 2943 CG LYS B 78 2.725 -3.162 -15.306 1.00 0.00 C ATOM 2944 CD LYS B 78 2.092 -1.983 -16.021 1.00 0.00 C ATOM 2945 CE LYS B 78 3.129 -1.156 -16.763 1.00 0.00 C ATOM 2946 NZ LYS B 78 3.298 -1.609 -18.172 1.00 0.00 N ATOM 0 H LYS B 78 0.542 -3.336 -15.130 1.00 0.00 H new ATOM 0 HA LYS B 78 0.819 -5.336 -16.949 1.00 0.00 H new ATOM 0 HB2 LYS B 78 3.396 -5.103 -15.859 1.00 0.00 H new ATOM 0 HB3 LYS B 78 2.736 -4.163 -17.183 1.00 0.00 H new ATOM 0 HG2 LYS B 78 2.246 -3.307 -14.338 1.00 0.00 H new ATOM 0 HG3 LYS B 78 3.778 -2.955 -15.113 1.00 0.00 H new ATOM 0 HD2 LYS B 78 1.342 -2.344 -16.725 1.00 0.00 H new ATOM 0 HD3 LYS B 78 1.574 -1.354 -15.298 1.00 0.00 H new ATOM 0 HE2 LYS B 78 2.832 -0.107 -16.752 1.00 0.00 H new ATOM 0 HE3 LYS B 78 4.085 -1.222 -16.244 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 3.882 -0.922 -18.690 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 3.765 -2.538 -18.184 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 2.366 -1.684 -18.627 1.00 0.00 H new ATOM 2960 N ILE B 79 2.002 -6.243 -13.994 1.00 0.00 N ATOM 2961 CA ILE B 79 2.367 -7.361 -13.151 1.00 0.00 C ATOM 2962 C ILE B 79 1.281 -7.682 -12.119 1.00 0.00 C ATOM 2963 O ILE B 79 1.577 -8.231 -11.060 1.00 0.00 O ATOM 2964 CB ILE B 79 3.724 -7.137 -12.435 1.00 0.00 C ATOM 2965 CG1 ILE B 79 3.864 -5.678 -11.996 1.00 0.00 C ATOM 2966 CG2 ILE B 79 4.893 -7.542 -13.341 1.00 0.00 C ATOM 2967 CD1 ILE B 79 2.856 -5.278 -10.943 1.00 0.00 C ATOM 0 H ILE B 79 2.136 -5.330 -13.560 1.00 0.00 H new ATOM 0 HA ILE B 79 2.471 -8.216 -13.819 1.00 0.00 H new ATOM 0 HB ILE B 79 3.749 -7.769 -11.547 1.00 0.00 H new ATOM 0 HG12 ILE B 79 4.870 -5.516 -11.608 1.00 0.00 H new ATOM 0 HG13 ILE B 79 3.749 -5.030 -12.865 1.00 0.00 H new ATOM 0 HG21 ILE B 79 5.834 -7.376 -12.817 1.00 0.00 H new ATOM 0 HG22 ILE B 79 4.804 -8.597 -13.601 1.00 0.00 H new ATOM 0 HG23 ILE B 79 4.873 -6.942 -14.251 1.00 0.00 H new ATOM 0 HD11 ILE B 79 3.007 -4.233 -10.673 1.00 0.00 H new ATOM 0 HD12 ILE B 79 1.848 -5.410 -11.336 1.00 0.00 H new ATOM 0 HD13 ILE B 79 2.986 -5.903 -10.059 1.00 0.00 H new ATOM 2979 N LEU B 80 0.030 -7.321 -12.425 1.00 0.00 N ATOM 2980 CA LEU B 80 -1.104 -7.569 -11.518 1.00 0.00 C ATOM 2981 C LEU B 80 -1.323 -9.047 -11.269 1.00 0.00 C ATOM 2982 O LEU B 80 -2.424 -9.564 -11.452 1.00 0.00 O ATOM 2983 CB LEU B 80 -2.383 -6.940 -12.072 1.00 0.00 C ATOM 2984 CG LEU B 80 -3.344 -6.403 -11.010 1.00 0.00 C ATOM 2985 CD1 LEU B 80 -4.676 -6.021 -11.637 1.00 0.00 C ATOM 2986 CD2 LEU B 80 -3.545 -7.428 -9.900 1.00 0.00 C ATOM 0 H LEU B 80 -0.227 -6.855 -13.295 1.00 0.00 H new ATOM 0 HA LEU B 80 -0.856 -7.104 -10.564 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -2.110 -6.124 -12.741 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -2.906 -7.684 -12.673 1.00 0.00 H new ATOM 0 HG LEU B 80 -2.904 -5.507 -10.571 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -5.346 -5.641 -10.865 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -4.516 -5.249 -12.390 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -5.122 -6.898 -12.105 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -4.232 -7.027 -9.155 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -3.961 -8.343 -10.321 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -2.587 -7.648 -9.430 1.00 0.00 H new ATOM 2998 N SER B 81 -0.278 -9.700 -10.787 1.00 0.00 N ATOM 2999 CA SER B 81 -0.340 -11.097 -10.434 1.00 0.00 C ATOM 3000 C SER B 81 -0.966 -11.973 -11.520 1.00 0.00 C ATOM 3001 O SER B 81 -2.052 -11.690 -12.018 1.00 0.00 O ATOM 3002 CB SER B 81 -1.138 -11.220 -9.151 1.00 0.00 C ATOM 3003 OG SER B 81 -0.303 -11.360 -8.016 1.00 0.00 O ATOM 0 H SER B 81 0.634 -9.271 -10.632 1.00 0.00 H new ATOM 0 HA SER B 81 0.681 -11.457 -10.310 1.00 0.00 H new ATOM 0 HB2 SER B 81 -1.768 -10.339 -9.031 1.00 0.00 H new ATOM 0 HB3 SER B 81 -1.803 -12.081 -9.219 1.00 0.00 H new ATOM 0 HG SER B 81 0.179 -10.521 -7.859 1.00 0.00 H new ATOM 3009 N GLU B 82 -0.286 -13.066 -11.843 1.00 0.00 N ATOM 3010 CA GLU B 82 -0.787 -14.017 -12.827 1.00 0.00 C ATOM 3011 C GLU B 82 -1.813 -14.930 -12.147 1.00 0.00 C ATOM 3012 O GLU B 82 -1.452 -15.765 -11.321 1.00 0.00 O ATOM 3013 CB GLU B 82 0.369 -14.840 -13.428 1.00 0.00 C ATOM 3014 CG GLU B 82 -0.093 -16.033 -14.250 1.00 0.00 C ATOM 3015 CD GLU B 82 1.063 -16.836 -14.813 1.00 0.00 C ATOM 3016 OE1 GLU B 82 1.860 -16.267 -15.589 1.00 0.00 O ATOM 3017 OE2 GLU B 82 1.173 -18.034 -14.478 1.00 0.00 O ATOM 0 H GLU B 82 0.616 -13.316 -11.437 1.00 0.00 H new ATOM 0 HA GLU B 82 -1.264 -13.480 -13.647 1.00 0.00 H new ATOM 0 HB2 GLU B 82 0.977 -14.190 -14.057 1.00 0.00 H new ATOM 0 HB3 GLU B 82 1.010 -15.193 -12.620 1.00 0.00 H new ATOM 0 HG2 GLU B 82 -0.711 -16.680 -13.628 1.00 0.00 H new ATOM 0 HG3 GLU B 82 -0.721 -15.684 -15.070 1.00 0.00 H new ATOM 3024 N PRO B 83 -3.115 -14.761 -12.460 1.00 0.00 N ATOM 3025 CA PRO B 83 -4.197 -15.542 -11.856 1.00 0.00 C ATOM 3026 C PRO B 83 -3.834 -16.985 -11.508 1.00 0.00 C ATOM 3027 O PRO B 83 -3.793 -17.859 -12.373 1.00 0.00 O ATOM 3028 CB PRO B 83 -5.260 -15.495 -12.943 1.00 0.00 C ATOM 3029 CG PRO B 83 -5.129 -14.119 -13.497 1.00 0.00 C ATOM 3030 CD PRO B 83 -3.657 -13.770 -13.415 1.00 0.00 C ATOM 0 HA PRO B 83 -4.495 -15.134 -10.890 1.00 0.00 H new ATOM 0 HB2 PRO B 83 -5.087 -16.253 -13.707 1.00 0.00 H new ATOM 0 HB3 PRO B 83 -6.256 -15.672 -12.538 1.00 0.00 H new ATOM 0 HG2 PRO B 83 -5.482 -14.079 -14.527 1.00 0.00 H new ATOM 0 HG3 PRO B 83 -5.730 -13.411 -12.926 1.00 0.00 H new ATOM 0 HD2 PRO B 83 -3.173 -13.845 -14.389 1.00 0.00 H new ATOM 0 HD3 PRO B 83 -3.506 -12.750 -13.062 1.00 0.00 H new ATOM 3038 N VAL B 84 -3.615 -17.222 -10.216 1.00 0.00 N ATOM 3039 CA VAL B 84 -3.304 -18.555 -9.710 1.00 0.00 C ATOM 3040 C VAL B 84 -4.606 -19.255 -9.319 1.00 0.00 C ATOM 3041 O VAL B 84 -4.768 -20.461 -9.502 1.00 0.00 O ATOM 3042 CB VAL B 84 -2.391 -18.491 -8.470 1.00 0.00 C ATOM 3043 CG1 VAL B 84 -3.043 -17.672 -7.364 1.00 0.00 C ATOM 3044 CG2 VAL B 84 -2.058 -19.892 -7.978 1.00 0.00 C ATOM 0 H VAL B 84 -3.648 -16.500 -9.496 1.00 0.00 H new ATOM 0 HA VAL B 84 -2.784 -19.103 -10.496 1.00 0.00 H new ATOM 0 HB VAL B 84 -1.461 -17.999 -8.754 1.00 0.00 H new ATOM 0 HG11 VAL B 84 -2.382 -17.639 -6.498 1.00 0.00 H new ATOM 0 HG12 VAL B 84 -3.224 -16.658 -7.721 1.00 0.00 H new ATOM 0 HG13 VAL B 84 -3.990 -18.132 -7.081 1.00 0.00 H new ATOM 0 HG21 VAL B 84 -1.413 -19.826 -7.102 1.00 0.00 H new ATOM 0 HG22 VAL B 84 -2.978 -20.413 -7.713 1.00 0.00 H new ATOM 0 HG23 VAL B 84 -1.544 -20.442 -8.767 1.00 0.00 H new ATOM 3054 N ASN B 85 -5.526 -18.457 -8.773 1.00 0.00 N ATOM 3055 CA ASN B 85 -6.833 -18.933 -8.332 1.00 0.00 C ATOM 3056 C ASN B 85 -7.794 -17.749 -8.196 1.00 0.00 C ATOM 3057 O ASN B 85 -7.597 -16.715 -8.835 1.00 0.00 O ATOM 3058 CB ASN B 85 -6.704 -19.673 -6.997 1.00 0.00 C ATOM 3059 CG ASN B 85 -7.573 -20.914 -6.938 1.00 0.00 C ATOM 3060 OD1 ASN B 85 -8.545 -20.913 -6.032 1.00 0.00 O flip ATOM 3061 ND2 ASN B 85 -7.375 -21.862 -7.697 1.00 0.00 N flip ATOM 0 H ASN B 85 -5.382 -17.458 -8.625 1.00 0.00 H new ATOM 0 HA ASN B 85 -7.230 -19.627 -9.073 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -5.663 -19.954 -6.840 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -6.979 -19.001 -6.184 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -6.617 -21.820 -8.378 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -7.969 -22.690 -7.645 1.00 0.00 H new ATOM 3068 N GLU B 86 -8.823 -17.890 -7.361 1.00 0.00 N ATOM 3069 CA GLU B 86 -9.787 -16.818 -7.156 1.00 0.00 C ATOM 3070 C GLU B 86 -10.507 -17.006 -5.833 1.00 0.00 C ATOM 3071 O GLU B 86 -11.037 -18.083 -5.558 1.00 0.00 O ATOM 3072 CB GLU B 86 -10.804 -16.780 -8.298 1.00 0.00 C ATOM 3073 CG GLU B 86 -10.174 -16.692 -9.679 1.00 0.00 C ATOM 3074 CD GLU B 86 -11.201 -16.488 -10.776 1.00 0.00 C ATOM 3075 OE1 GLU B 86 -12.316 -16.019 -10.466 1.00 0.00 O ATOM 3076 OE2 GLU B 86 -10.889 -16.797 -11.945 1.00 0.00 O ATOM 0 H GLU B 86 -9.007 -18.734 -6.819 1.00 0.00 H new ATOM 0 HA GLU B 86 -9.246 -15.872 -7.138 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -11.425 -17.674 -8.249 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -11.465 -15.925 -8.155 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -9.460 -15.869 -9.697 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -9.613 -17.605 -9.877 1.00 0.00 H new ATOM 3083 N LEU B 87 -10.533 -15.963 -5.010 1.00 0.00 N ATOM 3084 CA LEU B 87 -11.206 -16.059 -3.721 1.00 0.00 C ATOM 3085 C LEU B 87 -12.254 -14.970 -3.517 1.00 0.00 C ATOM 3086 O LEU B 87 -12.142 -14.122 -2.631 1.00 0.00 O ATOM 3087 CB LEU B 87 -10.234 -16.047 -2.557 1.00 0.00 C ATOM 3088 CG LEU B 87 -8.878 -15.409 -2.813 1.00 0.00 C ATOM 3089 CD1 LEU B 87 -9.071 -14.034 -3.440 1.00 0.00 C ATOM 3090 CD2 LEU B 87 -8.094 -15.322 -1.506 1.00 0.00 C ATOM 0 H LEU B 87 -10.105 -15.058 -5.207 1.00 0.00 H new ATOM 0 HA LEU B 87 -11.714 -17.023 -3.742 1.00 0.00 H new ATOM 0 HB2 LEU B 87 -10.705 -15.525 -1.724 1.00 0.00 H new ATOM 0 HB3 LEU B 87 -10.072 -17.076 -2.237 1.00 0.00 H new ATOM 0 HG LEU B 87 -8.305 -16.022 -3.509 1.00 0.00 H new ATOM 0 HD11 LEU B 87 -8.098 -13.578 -3.623 1.00 0.00 H new ATOM 0 HD12 LEU B 87 -9.607 -14.136 -4.384 1.00 0.00 H new ATOM 0 HD13 LEU B 87 -9.646 -13.403 -2.763 1.00 0.00 H new ATOM 0 HD21 LEU B 87 -7.123 -14.864 -1.694 1.00 0.00 H new ATOM 0 HD22 LEU B 87 -8.648 -14.716 -0.789 1.00 0.00 H new ATOM 0 HD23 LEU B 87 -7.951 -16.324 -1.100 1.00 0.00 H new ATOM 3102 N SER B 88 -13.281 -15.039 -4.327 1.00 0.00 N ATOM 3103 CA SER B 88 -14.408 -14.105 -4.256 1.00 0.00 C ATOM 3104 C SER B 88 -15.215 -14.359 -3.004 1.00 0.00 C ATOM 3105 O SER B 88 -15.593 -13.427 -2.313 1.00 0.00 O ATOM 3106 CB SER B 88 -15.307 -14.230 -5.476 1.00 0.00 C ATOM 3107 OG SER B 88 -14.571 -14.079 -6.678 1.00 0.00 O ATOM 0 H SER B 88 -13.372 -15.742 -5.061 1.00 0.00 H new ATOM 0 HA SER B 88 -14.002 -13.094 -4.231 1.00 0.00 H new ATOM 0 HB2 SER B 88 -15.800 -15.202 -5.469 1.00 0.00 H new ATOM 0 HB3 SER B 88 -16.092 -13.475 -5.431 1.00 0.00 H new ATOM 0 HG SER B 88 -13.806 -13.487 -6.521 1.00 0.00 H new ATOM 3113 N THR B 89 -15.454 -15.627 -2.694 1.00 0.00 N ATOM 3114 CA THR B 89 -16.188 -15.972 -1.485 1.00 0.00 C ATOM 3115 C THR B 89 -15.469 -15.370 -0.285 1.00 0.00 C ATOM 3116 O THR B 89 -16.063 -15.112 0.762 1.00 0.00 O ATOM 3117 CB THR B 89 -16.279 -17.488 -1.340 1.00 0.00 C ATOM 3118 OG1 THR B 89 -15.038 -18.100 -1.664 1.00 0.00 O ATOM 3119 CG2 THR B 89 -17.343 -18.099 -2.225 1.00 0.00 C ATOM 0 H THR B 89 -15.154 -16.424 -3.255 1.00 0.00 H new ATOM 0 HA THR B 89 -17.201 -15.573 -1.543 1.00 0.00 H new ATOM 0 HB THR B 89 -16.542 -17.671 -0.298 1.00 0.00 H new ATOM 0 HG1 THR B 89 -15.116 -19.072 -1.563 1.00 0.00 H new ATOM 0 HG21 THR B 89 -17.361 -19.179 -2.079 1.00 0.00 H new ATOM 0 HG22 THR B 89 -18.316 -17.681 -1.966 1.00 0.00 H new ATOM 0 HG23 THR B 89 -17.119 -17.878 -3.269 1.00 0.00 H new ATOM 3127 N PHE B 90 -14.176 -15.138 -0.479 1.00 0.00 N ATOM 3128 CA PHE B 90 -13.315 -14.551 0.530 1.00 0.00 C ATOM 3129 C PHE B 90 -13.287 -13.026 0.388 1.00 0.00 C ATOM 3130 O PHE B 90 -12.534 -12.343 1.083 1.00 0.00 O ATOM 3131 CB PHE B 90 -11.913 -15.117 0.343 1.00 0.00 C ATOM 3132 CG PHE B 90 -11.309 -15.709 1.575 1.00 0.00 C ATOM 3133 CD1 PHE B 90 -11.623 -16.999 1.972 1.00 0.00 C ATOM 3134 CD2 PHE B 90 -10.401 -14.985 2.320 1.00 0.00 C ATOM 3135 CE1 PHE B 90 -11.049 -17.548 3.091 1.00 0.00 C ATOM 3136 CE2 PHE B 90 -9.818 -15.534 3.438 1.00 0.00 C ATOM 3137 CZ PHE B 90 -10.146 -16.817 3.825 1.00 0.00 C ATOM 0 H PHE B 90 -13.695 -15.356 -1.352 1.00 0.00 H new ATOM 0 HA PHE B 90 -13.692 -14.790 1.524 1.00 0.00 H new ATOM 0 HB2 PHE B 90 -11.945 -15.882 -0.433 1.00 0.00 H new ATOM 0 HB3 PHE B 90 -11.261 -14.323 -0.019 1.00 0.00 H new ATOM 0 HD1 PHE B 90 -12.327 -17.579 1.394 1.00 0.00 H new ATOM 0 HD2 PHE B 90 -10.146 -13.979 2.023 1.00 0.00 H new ATOM 0 HE1 PHE B 90 -11.306 -18.552 3.394 1.00 0.00 H new ATOM 0 HE2 PHE B 90 -9.104 -14.962 4.012 1.00 0.00 H new ATOM 0 HZ PHE B 90 -9.693 -17.247 4.706 1.00 0.00 H new ATOM 3147 N ARG B 91 -14.101 -12.504 -0.534 1.00 0.00 N ATOM 3148 CA ARG B 91 -14.167 -11.068 -0.797 1.00 0.00 C ATOM 3149 C ARG B 91 -14.152 -10.236 0.479 1.00 0.00 C ATOM 3150 O ARG B 91 -13.341 -9.320 0.612 1.00 0.00 O ATOM 3151 CB ARG B 91 -15.411 -10.726 -1.598 1.00 0.00 C ATOM 3152 CG ARG B 91 -16.612 -11.440 -1.070 1.00 0.00 C ATOM 3153 CD ARG B 91 -17.675 -11.657 -2.136 1.00 0.00 C ATOM 3154 NE ARG B 91 -18.932 -10.991 -1.801 1.00 0.00 N ATOM 3155 CZ ARG B 91 -19.890 -10.727 -2.686 1.00 0.00 C ATOM 3156 NH1 ARG B 91 -19.739 -11.070 -3.959 1.00 0.00 N ATOM 3157 NH2 ARG B 91 -21.001 -10.118 -2.297 1.00 0.00 N ATOM 0 H ARG B 91 -14.728 -13.062 -1.114 1.00 0.00 H new ATOM 0 HA ARG B 91 -13.273 -10.821 -1.370 1.00 0.00 H new ATOM 0 HB2 ARG B 91 -15.582 -9.650 -1.566 1.00 0.00 H new ATOM 0 HB3 ARG B 91 -15.257 -10.993 -2.644 1.00 0.00 H new ATOM 0 HG2 ARG B 91 -16.308 -12.404 -0.663 1.00 0.00 H new ATOM 0 HG3 ARG B 91 -17.039 -10.867 -0.247 1.00 0.00 H new ATOM 0 HD2 ARG B 91 -17.310 -11.283 -3.093 1.00 0.00 H new ATOM 0 HD3 ARG B 91 -17.853 -12.725 -2.258 1.00 0.00 H new ATOM 0 HE ARG B 91 -19.084 -10.712 -0.832 1.00 0.00 H new ATOM 0 HH11 ARG B 91 -18.885 -11.538 -4.263 1.00 0.00 H new ATOM 0 HH12 ARG B 91 -20.476 -10.865 -4.633 1.00 0.00 H new ATOM 0 HH21 ARG B 91 -21.121 -9.852 -1.320 1.00 0.00 H new ATOM 0 HH22 ARG B 91 -21.736 -9.915 -2.975 1.00 0.00 H new ATOM 3171 N ASN B 92 -15.051 -10.534 1.418 1.00 0.00 N ATOM 3172 CA ASN B 92 -15.097 -9.765 2.655 1.00 0.00 C ATOM 3173 C ASN B 92 -13.731 -9.744 3.318 1.00 0.00 C ATOM 3174 O ASN B 92 -13.230 -8.684 3.673 1.00 0.00 O ATOM 3175 CB ASN B 92 -16.143 -10.292 3.635 1.00 0.00 C ATOM 3176 CG ASN B 92 -15.708 -11.559 4.347 1.00 0.00 C ATOM 3177 OD1 ASN B 92 -14.916 -11.395 5.402 1.00 0.00 O flip ATOM 3178 ND2 ASN B 92 -16.077 -12.667 3.956 1.00 0.00 N flip ATOM 0 H ASN B 92 -15.739 -11.283 1.347 1.00 0.00 H new ATOM 0 HA ASN B 92 -15.388 -8.750 2.384 1.00 0.00 H new ATOM 0 HB2 ASN B 92 -16.358 -9.522 4.376 1.00 0.00 H new ATOM 0 HB3 ASN B 92 -17.071 -10.485 3.097 1.00 0.00 H new ATOM 0 HD21 ASN B 92 -16.685 -12.744 3.141 1.00 0.00 H new ATOM 0 HD22 ASN B 92 -15.774 -13.508 4.447 1.00 0.00 H new ATOM 3185 N GLU B 93 -13.115 -10.916 3.462 1.00 0.00 N ATOM 3186 CA GLU B 93 -11.787 -10.998 4.059 1.00 0.00 C ATOM 3187 C GLU B 93 -10.902 -9.950 3.435 1.00 0.00 C ATOM 3188 O GLU B 93 -10.254 -9.155 4.116 1.00 0.00 O ATOM 3189 CB GLU B 93 -11.154 -12.356 3.799 1.00 0.00 C ATOM 3190 CG GLU B 93 -10.496 -12.959 5.028 1.00 0.00 C ATOM 3191 CD GLU B 93 -11.281 -14.123 5.601 1.00 0.00 C ATOM 3192 OE1 GLU B 93 -12.529 -14.070 5.570 1.00 0.00 O ATOM 3193 OE2 GLU B 93 -10.649 -15.087 6.079 1.00 0.00 O ATOM 0 H GLU B 93 -13.510 -11.812 3.176 1.00 0.00 H new ATOM 0 HA GLU B 93 -11.887 -10.845 5.134 1.00 0.00 H new ATOM 0 HB2 GLU B 93 -11.918 -13.041 3.432 1.00 0.00 H new ATOM 0 HB3 GLU B 93 -10.410 -12.257 3.009 1.00 0.00 H new ATOM 0 HG2 GLU B 93 -9.492 -13.296 4.769 1.00 0.00 H new ATOM 0 HG3 GLU B 93 -10.387 -12.189 5.791 1.00 0.00 H new ATOM 3200 N ILE B 94 -10.896 -9.969 2.113 1.00 0.00 N ATOM 3201 CA ILE B 94 -10.114 -9.042 1.343 1.00 0.00 C ATOM 3202 C ILE B 94 -10.471 -7.611 1.739 1.00 0.00 C ATOM 3203 O ILE B 94 -9.615 -6.727 1.776 1.00 0.00 O ATOM 3204 CB ILE B 94 -10.348 -9.263 -0.167 1.00 0.00 C ATOM 3205 CG1 ILE B 94 -9.412 -10.357 -0.687 1.00 0.00 C ATOM 3206 CG2 ILE B 94 -10.165 -7.973 -0.958 1.00 0.00 C ATOM 3207 CD1 ILE B 94 -9.474 -11.645 0.107 1.00 0.00 C ATOM 0 H ILE B 94 -11.435 -10.629 1.553 1.00 0.00 H new ATOM 0 HA ILE B 94 -9.057 -9.211 1.551 1.00 0.00 H new ATOM 0 HB ILE B 94 -11.380 -9.584 -0.307 1.00 0.00 H new ATOM 0 HG12 ILE B 94 -9.660 -10.570 -1.727 1.00 0.00 H new ATOM 0 HG13 ILE B 94 -8.388 -9.982 -0.674 1.00 0.00 H new ATOM 0 HG21 ILE B 94 -10.338 -8.168 -2.016 1.00 0.00 H new ATOM 0 HG22 ILE B 94 -10.876 -7.226 -0.606 1.00 0.00 H new ATOM 0 HG23 ILE B 94 -9.150 -7.601 -0.818 1.00 0.00 H new ATOM 0 HD11 ILE B 94 -8.783 -12.371 -0.322 1.00 0.00 H new ATOM 0 HD12 ILE B 94 -9.196 -11.448 1.142 1.00 0.00 H new ATOM 0 HD13 ILE B 94 -10.487 -12.045 0.073 1.00 0.00 H new ATOM 3219 N ILE B 95 -11.749 -7.408 2.049 1.00 0.00 N ATOM 3220 CA ILE B 95 -12.246 -6.105 2.464 1.00 0.00 C ATOM 3221 C ILE B 95 -12.021 -5.901 3.959 1.00 0.00 C ATOM 3222 O ILE B 95 -11.189 -5.086 4.348 1.00 0.00 O ATOM 3223 CB ILE B 95 -13.746 -5.942 2.148 1.00 0.00 C ATOM 3224 CG1 ILE B 95 -14.026 -6.303 0.688 1.00 0.00 C ATOM 3225 CG2 ILE B 95 -14.200 -4.520 2.444 1.00 0.00 C ATOM 3226 CD1 ILE B 95 -15.441 -6.780 0.444 1.00 0.00 C ATOM 0 H ILE B 95 -12.462 -8.137 2.019 1.00 0.00 H new ATOM 0 HA ILE B 95 -11.691 -5.353 1.903 1.00 0.00 H new ATOM 0 HB ILE B 95 -14.311 -6.623 2.785 1.00 0.00 H new ATOM 0 HG12 ILE B 95 -13.832 -5.431 0.063 1.00 0.00 H new ATOM 0 HG13 ILE B 95 -13.330 -7.081 0.375 1.00 0.00 H new ATOM 0 HG21 ILE B 95 -15.261 -4.422 2.215 1.00 0.00 H new ATOM 0 HG22 ILE B 95 -14.034 -4.297 3.498 1.00 0.00 H new ATOM 0 HG23 ILE B 95 -13.631 -3.821 1.831 1.00 0.00 H new ATOM 0 HD11 ILE B 95 -15.568 -7.018 -0.612 1.00 0.00 H new ATOM 0 HD12 ILE B 95 -15.633 -7.671 1.042 1.00 0.00 H new ATOM 0 HD13 ILE B 95 -16.143 -5.995 0.726 1.00 0.00 H new ATOM 3238 N ALA B 96 -12.755 -6.650 4.799 1.00 0.00 N ATOM 3239 CA ALA B 96 -12.608 -6.541 6.256 1.00 0.00 C ATOM 3240 C ALA B 96 -11.160 -6.235 6.636 1.00 0.00 C ATOM 3241 O ALA B 96 -10.894 -5.308 7.399 1.00 0.00 O ATOM 3242 CB ALA B 96 -13.088 -7.816 6.937 1.00 0.00 C ATOM 0 H ALA B 96 -13.450 -7.332 4.495 1.00 0.00 H new ATOM 0 HA ALA B 96 -13.228 -5.713 6.601 1.00 0.00 H new ATOM 0 HB1 ALA B 96 -12.972 -7.718 8.016 1.00 0.00 H new ATOM 0 HB2 ALA B 96 -14.139 -7.982 6.699 1.00 0.00 H new ATOM 0 HB3 ALA B 96 -12.498 -8.661 6.584 1.00 0.00 H new ATOM 3248 N ALA B 97 -10.224 -6.985 6.051 1.00 0.00 N ATOM 3249 CA ALA B 97 -8.797 -6.752 6.278 1.00 0.00 C ATOM 3250 C ALA B 97 -8.522 -5.282 6.124 1.00 0.00 C ATOM 3251 O ALA B 97 -8.268 -4.561 7.085 1.00 0.00 O ATOM 3252 CB ALA B 97 -7.985 -7.525 5.251 1.00 0.00 C ATOM 0 H ALA B 97 -10.428 -7.758 5.417 1.00 0.00 H new ATOM 0 HA ALA B 97 -8.520 -7.085 7.278 1.00 0.00 H new ATOM 0 HB1 ALA B 97 -6.923 -7.351 5.421 1.00 0.00 H new ATOM 0 HB2 ALA B 97 -8.198 -8.590 5.346 1.00 0.00 H new ATOM 0 HB3 ALA B 97 -8.252 -7.189 4.249 1.00 0.00 H new ATOM 3258 N ILE B 98 -8.641 -4.855 4.892 1.00 0.00 N ATOM 3259 CA ILE B 98 -8.480 -3.483 4.522 1.00 0.00 C ATOM 3260 C ILE B 98 -9.366 -2.622 5.411 1.00 0.00 C ATOM 3261 O ILE B 98 -8.910 -1.809 6.208 1.00 0.00 O ATOM 3262 CB ILE B 98 -8.938 -3.368 3.062 1.00 0.00 C ATOM 3263 CG1 ILE B 98 -7.815 -3.813 2.125 1.00 0.00 C ATOM 3264 CG2 ILE B 98 -9.427 -1.961 2.709 1.00 0.00 C ATOM 3265 CD1 ILE B 98 -7.864 -3.147 0.773 1.00 0.00 C ATOM 0 H ILE B 98 -8.857 -5.469 4.107 1.00 0.00 H new ATOM 0 HA ILE B 98 -7.448 -3.152 4.635 1.00 0.00 H new ATOM 0 HB ILE B 98 -9.793 -4.031 2.933 1.00 0.00 H new ATOM 0 HG12 ILE B 98 -6.854 -3.598 2.593 1.00 0.00 H new ATOM 0 HG13 ILE B 98 -7.870 -4.893 1.992 1.00 0.00 H new ATOM 0 HG21 ILE B 98 -9.739 -1.936 1.665 1.00 0.00 H new ATOM 0 HG22 ILE B 98 -10.271 -1.699 3.346 1.00 0.00 H new ATOM 0 HG23 ILE B 98 -8.619 -1.246 2.864 1.00 0.00 H new ATOM 0 HD11 ILE B 98 -7.039 -3.509 0.159 1.00 0.00 H new ATOM 0 HD12 ILE B 98 -8.810 -3.383 0.285 1.00 0.00 H new ATOM 0 HD13 ILE B 98 -7.779 -2.067 0.896 1.00 0.00 H new ATOM 3277 N ASP B 99 -10.650 -2.850 5.238 1.00 0.00 N ATOM 3278 CA ASP B 99 -11.705 -2.167 5.955 1.00 0.00 C ATOM 3279 C ASP B 99 -11.433 -2.002 7.458 1.00 0.00 C ATOM 3280 O ASP B 99 -11.999 -1.114 8.094 1.00 0.00 O ATOM 3281 CB ASP B 99 -12.997 -2.940 5.724 1.00 0.00 C ATOM 3282 CG ASP B 99 -14.144 -2.046 5.292 1.00 0.00 C ATOM 3283 OD1 ASP B 99 -13.875 -0.967 4.723 1.00 0.00 O ATOM 3284 OD2 ASP B 99 -15.312 -2.425 5.523 1.00 0.00 O ATOM 0 H ASP B 99 -11.000 -3.539 4.572 1.00 0.00 H new ATOM 0 HA ASP B 99 -11.773 -1.150 5.569 1.00 0.00 H new ATOM 0 HB2 ASP B 99 -12.829 -3.702 4.963 1.00 0.00 H new ATOM 0 HB3 ASP B 99 -13.273 -3.461 6.641 1.00 0.00 H new ATOM 3289 N PHE B 100 -10.581 -2.848 8.031 1.00 0.00 N ATOM 3290 CA PHE B 100 -10.269 -2.762 9.452 1.00 0.00 C ATOM 3291 C PHE B 100 -8.890 -2.170 9.647 1.00 0.00 C ATOM 3292 O PHE B 100 -8.642 -1.374 10.552 1.00 0.00 O ATOM 3293 CB PHE B 100 -10.346 -4.152 10.095 1.00 0.00 C ATOM 3294 CG PHE B 100 -9.829 -4.201 11.507 1.00 0.00 C ATOM 3295 CD1 PHE B 100 -10.528 -3.591 12.536 1.00 0.00 C ATOM 3296 CD2 PHE B 100 -8.645 -4.858 11.803 1.00 0.00 C ATOM 3297 CE1 PHE B 100 -10.056 -3.635 13.834 1.00 0.00 C ATOM 3298 CE2 PHE B 100 -8.168 -4.905 13.099 1.00 0.00 C ATOM 3299 CZ PHE B 100 -8.874 -4.293 14.116 1.00 0.00 C ATOM 0 H PHE B 100 -10.097 -3.597 7.535 1.00 0.00 H new ATOM 0 HA PHE B 100 -11.000 -2.113 9.934 1.00 0.00 H new ATOM 0 HB2 PHE B 100 -11.383 -4.488 10.086 1.00 0.00 H new ATOM 0 HB3 PHE B 100 -9.778 -4.855 9.486 1.00 0.00 H new ATOM 0 HD1 PHE B 100 -11.452 -3.075 12.321 1.00 0.00 H new ATOM 0 HD2 PHE B 100 -8.089 -5.339 11.012 1.00 0.00 H new ATOM 0 HE1 PHE B 100 -10.610 -3.156 14.627 1.00 0.00 H new ATOM 0 HE2 PHE B 100 -7.244 -5.420 13.316 1.00 0.00 H new ATOM 0 HZ PHE B 100 -8.503 -4.329 15.130 1.00 0.00 H new ATOM 3309 N LEU B 101 -7.996 -2.619 8.790 1.00 0.00 N ATOM 3310 CA LEU B 101 -6.607 -2.224 8.814 1.00 0.00 C ATOM 3311 C LEU B 101 -6.397 -0.810 8.301 1.00 0.00 C ATOM 3312 O LEU B 101 -5.532 -0.088 8.797 1.00 0.00 O ATOM 3313 CB LEU B 101 -5.828 -3.243 7.991 1.00 0.00 C ATOM 3314 CG LEU B 101 -5.412 -2.842 6.581 1.00 0.00 C ATOM 3315 CD1 LEU B 101 -4.020 -2.227 6.595 1.00 0.00 C ATOM 3316 CD2 LEU B 101 -5.442 -4.062 5.675 1.00 0.00 C ATOM 0 H LEU B 101 -8.220 -3.280 8.046 1.00 0.00 H new ATOM 0 HA LEU B 101 -6.248 -2.211 9.843 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -4.927 -3.504 8.546 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -6.431 -4.148 7.919 1.00 0.00 H new ATOM 0 HG LEU B 101 -6.111 -2.098 6.200 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -3.736 -1.946 5.581 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -4.020 -1.342 7.231 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -3.305 -2.953 6.983 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -5.144 -3.774 4.667 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -4.752 -4.815 6.056 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -6.451 -4.473 5.652 1.00 0.00 H new ATOM 3328 N ILE B 102 -7.176 -0.414 7.306 1.00 0.00 N ATOM 3329 CA ILE B 102 -7.038 0.914 6.750 1.00 0.00 C ATOM 3330 C ILE B 102 -8.239 1.800 7.059 1.00 0.00 C ATOM 3331 O ILE B 102 -8.160 3.019 6.909 1.00 0.00 O ATOM 3332 CB ILE B 102 -6.745 0.871 5.234 1.00 0.00 C ATOM 3333 CG1 ILE B 102 -7.795 0.075 4.452 1.00 0.00 C ATOM 3334 CG2 ILE B 102 -5.377 0.248 5.021 1.00 0.00 C ATOM 3335 CD1 ILE B 102 -9.216 0.551 4.654 1.00 0.00 C ATOM 0 H ILE B 102 -7.900 -0.988 6.875 1.00 0.00 H new ATOM 0 HA ILE B 102 -6.176 1.367 7.240 1.00 0.00 H new ATOM 0 HB ILE B 102 -6.775 1.894 4.859 1.00 0.00 H new ATOM 0 HG12 ILE B 102 -7.555 0.125 3.390 1.00 0.00 H new ATOM 0 HG13 ILE B 102 -7.731 -0.973 4.744 1.00 0.00 H new ATOM 0 HG21 ILE B 102 -5.156 0.211 3.954 1.00 0.00 H new ATOM 0 HG22 ILE B 102 -4.621 0.848 5.527 1.00 0.00 H new ATOM 0 HG23 ILE B 102 -5.370 -0.763 5.428 1.00 0.00 H new ATOM 0 HD11 ILE B 102 -9.894 -0.067 4.065 1.00 0.00 H new ATOM 0 HD12 ILE B 102 -9.479 0.474 5.709 1.00 0.00 H new ATOM 0 HD13 ILE B 102 -9.301 1.589 4.334 1.00 0.00 H new ATOM 3347 N THR B 103 -9.350 1.207 7.507 1.00 0.00 N ATOM 3348 CA THR B 103 -10.525 2.018 7.836 1.00 0.00 C ATOM 3349 C THR B 103 -11.093 1.679 9.214 1.00 0.00 C ATOM 3350 O THR B 103 -11.772 2.503 9.827 1.00 0.00 O ATOM 3351 CB THR B 103 -11.602 1.880 6.764 1.00 0.00 C ATOM 3352 OG1 THR B 103 -11.757 0.532 6.376 1.00 0.00 O ATOM 3353 CG2 THR B 103 -11.303 2.685 5.519 1.00 0.00 C ATOM 0 H THR B 103 -9.460 0.203 7.647 1.00 0.00 H new ATOM 0 HA THR B 103 -10.195 3.056 7.867 1.00 0.00 H new ATOM 0 HB THR B 103 -12.515 2.263 7.219 1.00 0.00 H new ATOM 0 HG1 THR B 103 -12.334 0.071 7.020 1.00 0.00 H new ATOM 0 HG21 THR B 103 -12.105 2.546 4.794 1.00 0.00 H new ATOM 0 HG22 THR B 103 -11.227 3.741 5.778 1.00 0.00 H new ATOM 0 HG23 THR B 103 -10.361 2.349 5.086 1.00 0.00 H new ATOM 3361 N GLY B 104 -10.812 0.477 9.706 1.00 0.00 N ATOM 3362 CA GLY B 104 -11.307 0.081 11.013 1.00 0.00 C ATOM 3363 C GLY B 104 -12.655 -0.614 10.951 1.00 0.00 C ATOM 3364 O GLY B 104 -12.935 -1.506 11.752 1.00 0.00 O ATOM 0 H GLY B 104 -10.253 -0.228 9.226 1.00 0.00 H new ATOM 0 HA2 GLY B 104 -10.583 -0.584 11.483 1.00 0.00 H new ATOM 0 HA3 GLY B 104 -11.388 0.964 11.647 1.00 0.00 H new ATOM 3368 N ILE B 105 -13.492 -0.208 10.001 1.00 0.00 N ATOM 3369 CA ILE B 105 -14.815 -0.801 9.843 1.00 0.00 C ATOM 3370 C ILE B 105 -15.750 -0.354 10.967 1.00 0.00 C ATOM 3371 O ILE B 105 -15.245 0.166 11.984 1.00 0.00 O ATOM 3372 CB ILE B 105 -14.733 -2.351 9.795 1.00 0.00 C ATOM 3373 CG1 ILE B 105 -15.235 -2.863 8.444 1.00 0.00 C ATOM 3374 CG2 ILE B 105 -15.517 -2.995 10.933 1.00 0.00 C ATOM 3375 CD1 ILE B 105 -15.156 -4.367 8.300 1.00 0.00 C ATOM 3376 OXT ILE B 105 -16.978 -0.528 10.818 1.00 0.00 O ATOM 0 H ILE B 105 -13.277 0.529 9.329 1.00 0.00 H new ATOM 0 HA ILE B 105 -15.222 -0.452 8.894 1.00 0.00 H new ATOM 0 HB ILE B 105 -13.687 -2.632 9.919 1.00 0.00 H new ATOM 0 HG12 ILE B 105 -16.269 -2.547 8.306 1.00 0.00 H new ATOM 0 HG13 ILE B 105 -14.651 -2.399 7.649 1.00 0.00 H new ATOM 0 HG21 ILE B 105 -15.434 -4.080 10.864 1.00 0.00 H new ATOM 0 HG22 ILE B 105 -15.112 -2.661 11.888 1.00 0.00 H new ATOM 0 HG23 ILE B 105 -16.566 -2.706 10.862 1.00 0.00 H new ATOM 0 HD11 ILE B 105 -15.528 -4.659 7.318 1.00 0.00 H new ATOM 0 HD12 ILE B 105 -14.120 -4.689 8.405 1.00 0.00 H new ATOM 0 HD13 ILE B 105 -15.763 -4.839 9.073 1.00 0.00 H new