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: B 69 THR OG1 : rot 130:sc= -7.7! USER MOD Set 1.2: B 72 MET CE :methyl -100:sc= -7.84! (180deg=-12.4!) USER MOD Set 2.1: A 34 THR OG1 : rot -144:sc= -0.0733 USER MOD Set 2.2: A 74 SER OG : rot -18:sc= -0.595! USER MOD Set 2.3: B 70 GLN : amide:sc= -0.271 X(o=-6.1,f=-6.2) USER MOD Set 2.4: B 71 GLN : amide:sc= -5.12! C(o=-6.1!,f=-9.9!) USER MOD Set 3.1: B 25 GLN :FLIP amide:sc= -5.76! C(o=-8.7!,f=-5.8!) USER MOD Set 3.2: B 26 SER OG : rot -86:sc=-0.00185 USER MOD Set 4.1: B 10 LYS NZ :NH3+ -104:sc= 1.16 (180deg=-0.581) USER MOD Set 4.2: B 14 SER OG : rot -160:sc= 0.829 USER MOD Set 5.1: B 5 THR OG1 : rot 140:sc= 1.84 USER MOD Set 5.2: B 7 TYR OH : rot -32:sc= 2.1 USER MOD Set 6.1: A 55 CYS SG : rot -19:sc= 1.41 USER MOD Set 6.2: A 69 THR OG1 : rot -146:sc= -0.97! USER MOD Set 7.1: A 25 GLN :FLIP amide:sc= -8.54! C(o=-11!,f=-8.5!) USER MOD Set 7.2: A 26 SER OG : rot 150:sc=-0.00193 USER MOD Set 8.1: A 9 ASN : amide:sc= -5.14! C(o=-5!,f=-5.9!) USER MOD Set 8.2: A 10 LYS NZ :NH3+ 167:sc= -0.981! (180deg=-1.25!) USER MOD Set 8.3: A 14 SER OG : rot 83:sc= 1.08 USER MOD Set 9.1: A 8 LYS NZ :NH3+ -178:sc= 0.767 (180deg=0.605) USER MOD Set 9.2: A 20 TYR OH : rot 80:sc= -0.217! USER MOD Set10.1: A 5 THR OG1 : rot 130:sc= 1.9 USER MOD Set10.2: A 7 TYR OH : rot -33:sc= 0.956 USER MOD Single : A 2 SER OG : rot 53:sc= 0.856 USER MOD Single : A 3 GLN : amide:sc=-0.00219 X(o=-0.0022,f=-0.35) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 31 ASN : amide:sc= -8.18! C(o=-8.2!,f=-22!) USER MOD Single : A 33 ASN : amide:sc=-0.00621 X(o=-0.0062,f=-0.26) USER MOD Single : A 41 THR OG1 : rot 180:sc= -4.72! USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.162) USER MOD Single : A 52 SER OG : rot 180:sc=-0.00846 USER MOD Single : A 53 HIS : no HD1:sc=-0.000716 X(o=-0.00072,f=-0.012) USER MOD Single : A 57 THR OG1 : rot -5:sc= -1.73! USER MOD Single : A 59 HIS :FLIP no HE2:sc= -0.567 F(o=-1.7,f=-0.57) USER MOD Single : A 67 MET CE :methyl -126:sc= -6.41! (180deg=-6.98!) USER MOD Single : A 70 GLN : amide:sc= -0.0218 X(o=-0.022,f=-0.19) USER MOD Single : A 71 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 72 MET CE :methyl -164:sc= -4.35! (180deg=-6.8!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot -75:sc= -6.2! USER MOD Single : A 85 ASN : amide:sc= 0.196 K(o=0.2,f=-3!) USER MOD Single : A 88 SER OG : rot 180:sc= 0.112 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.00773 USER MOD Single : A 92 ASN :FLIP amide:sc= -1.63 F(o=-2.9!,f=-1.6) USER MOD Single : A 103 THR OG1 : rot 180:sc= -0.287 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -168:sc= -0.0491 (180deg=-0.211) USER MOD Single : B 2 SER OG : rot 66:sc= -0.525! USER MOD Single : B 3 GLN : amide:sc= -0.372 K(o=-0.37,f=-2.3) USER MOD Single : B 8 LYS NZ :NH3+ -142:sc= -0.382 (180deg=-1.15) USER MOD Single : B 9 ASN : amide:sc= -17.8! C(o=-18!,f=-23!) USER MOD Single : B 12 LYS NZ :NH3+ -133:sc= 0.441 (180deg=0.0135) USER MOD Single : B 13 SER OG : rot 96:sc= 1.12 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 39:sc= -4.66! USER MOD Single : B 31 ASN :FLIP amide:sc= -1.85 F(o=-3.2!,f=-1.8) USER MOD Single : B 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 34 THR OG1 : rot 177:sc= 0 USER MOD Single : B 41 THR OG1 : rot 180:sc= -3.91! USER MOD Single : B 48 LYS NZ :NH3+ -167:sc= -0.051 (180deg=-0.282) USER MOD Single : B 49 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00706) USER MOD Single : B 52 SER OG : rot -179:sc= 0 USER MOD Single : B 53 HIS : no HD1:sc= -1.38 K(o=-1.4,f=-2.2) USER MOD Single : B 55 CYS SG : rot 170:sc= -0.978 USER MOD Single : B 57 THR OG1 : rot 127:sc= -9.97! USER MOD Single : B 59 HIS : no HD1:sc= -1.34 K(o=-1.3,f=-3.3!) USER MOD Single : B 67 MET CE :methyl 137:sc= -11.6! (180deg=-18.8!) USER MOD Single : B 73 THR OG1 : rot 180:sc= 0 USER MOD Single : B 74 SER OG : rot -21:sc= -2.25! USER MOD Single : B 78 LYS NZ :NH3+ 179:sc= -0.729 (180deg=-0.768) USER MOD Single : B 81 SER OG : rot -153:sc= -2.96! USER MOD Single : B 85 ASN : amide:sc= -0.199 K(o=-0.2,f=-0.72) USER MOD Single : B 88 SER OG : rot -26:sc= 1.16 USER MOD Single : B 89 THR OG1 : rot 180:sc= 0 USER MOD Single : B 92 ASN :FLIP amide:sc= -1.43 F(o=-2.6!,f=-1.4) USER MOD Single : B 103 THR OG1 : rot 180:sc= -0.165 USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 2 4.262 8.523 15.050 1.00 0.00 N ATOM 21 CA SER A 2 4.047 7.568 13.969 1.00 0.00 C ATOM 22 C SER A 2 2.794 7.926 13.170 1.00 0.00 C ATOM 23 O SER A 2 1.797 7.210 13.232 1.00 0.00 O ATOM 24 CB SER A 2 3.916 6.147 14.539 1.00 0.00 C ATOM 25 OG SER A 2 2.731 6.015 15.304 1.00 0.00 O ATOM 0 HA SER A 2 4.907 7.608 13.300 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.910 5.423 13.724 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.782 5.919 15.161 1.00 0.00 H new ATOM 0 HG SER A 2 1.962 6.305 14.769 1.00 0.00 H new ATOM 31 N GLN A 3 2.857 9.036 12.418 1.00 0.00 N ATOM 32 CA GLN A 3 1.726 9.495 11.592 1.00 0.00 C ATOM 33 C GLN A 3 1.746 11.016 11.395 1.00 0.00 C ATOM 34 O GLN A 3 2.035 11.775 12.320 1.00 0.00 O ATOM 35 CB GLN A 3 0.380 9.086 12.215 1.00 0.00 C ATOM 36 CG GLN A 3 -0.824 9.801 11.619 1.00 0.00 C ATOM 37 CD GLN A 3 -2.030 8.894 11.479 1.00 0.00 C ATOM 38 OE1 GLN A 3 -2.309 8.073 12.353 1.00 0.00 O ATOM 39 NE2 GLN A 3 -2.754 9.037 10.375 1.00 0.00 N ATOM 0 H GLN A 3 3.681 9.635 12.364 1.00 0.00 H new ATOM 0 HA GLN A 3 1.836 9.014 10.620 1.00 0.00 H new ATOM 0 HB2 GLN A 3 0.247 8.011 12.093 1.00 0.00 H new ATOM 0 HB3 GLN A 3 0.413 9.284 13.286 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -1.085 10.652 12.248 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -0.558 10.199 10.640 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -2.487 9.730 9.676 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -3.577 8.454 10.226 1.00 0.00 H new ATOM 48 N PHE A 4 1.389 11.437 10.184 1.00 0.00 N ATOM 49 CA PHE A 4 1.300 12.854 9.822 1.00 0.00 C ATOM 50 C PHE A 4 2.649 13.574 9.767 1.00 0.00 C ATOM 51 O PHE A 4 2.745 14.751 10.115 1.00 0.00 O ATOM 52 CB PHE A 4 0.337 13.581 10.763 1.00 0.00 C ATOM 53 CG PHE A 4 -1.101 13.203 10.532 1.00 0.00 C ATOM 54 CD1 PHE A 4 -1.585 13.029 9.243 1.00 0.00 C ATOM 55 CD2 PHE A 4 -1.963 13.008 11.598 1.00 0.00 C ATOM 56 CE1 PHE A 4 -2.900 12.667 9.022 1.00 0.00 C ATOM 57 CE2 PHE A 4 -3.281 12.649 11.384 1.00 0.00 C ATOM 58 CZ PHE A 4 -3.750 12.478 10.095 1.00 0.00 C ATOM 0 H PHE A 4 1.152 10.803 9.421 1.00 0.00 H new ATOM 0 HA PHE A 4 0.914 12.880 8.803 1.00 0.00 H new ATOM 0 HB2 PHE A 4 0.606 13.356 11.795 1.00 0.00 H new ATOM 0 HB3 PHE A 4 0.451 14.657 10.631 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -0.925 13.179 8.401 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -1.602 13.138 12.608 1.00 0.00 H new ATOM 0 HE1 PHE A 4 -3.262 12.532 8.014 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -3.944 12.502 12.224 1.00 0.00 H new ATOM 0 HZ PHE A 4 -4.779 12.197 9.927 1.00 0.00 H new ATOM 68 N THR A 5 3.671 12.886 9.274 1.00 0.00 N ATOM 69 CA THR A 5 4.990 13.480 9.108 1.00 0.00 C ATOM 70 C THR A 5 5.363 13.414 7.636 1.00 0.00 C ATOM 71 O THR A 5 4.853 12.570 6.902 1.00 0.00 O ATOM 72 CB THR A 5 6.050 12.732 9.924 1.00 0.00 C ATOM 73 OG1 THR A 5 5.504 12.233 11.132 1.00 0.00 O ATOM 74 CG2 THR A 5 7.262 13.575 10.281 1.00 0.00 C ATOM 0 H THR A 5 3.610 11.911 8.981 1.00 0.00 H new ATOM 0 HA THR A 5 4.956 14.511 9.461 1.00 0.00 H new ATOM 0 HB THR A 5 6.377 11.922 9.273 1.00 0.00 H new ATOM 0 HG1 THR A 5 5.725 11.283 11.223 1.00 0.00 H new ATOM 0 HG21 THR A 5 7.966 12.975 10.858 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.745 13.923 9.368 1.00 0.00 H new ATOM 0 HG23 THR A 5 6.946 14.433 10.874 1.00 0.00 H new ATOM 82 N LEU A 6 6.267 14.274 7.208 1.00 0.00 N ATOM 83 CA LEU A 6 6.711 14.254 5.827 1.00 0.00 C ATOM 84 C LEU A 6 7.921 13.356 5.738 1.00 0.00 C ATOM 85 O LEU A 6 9.058 13.829 5.750 1.00 0.00 O ATOM 86 CB LEU A 6 7.055 15.655 5.334 1.00 0.00 C ATOM 87 CG LEU A 6 6.883 15.858 3.830 1.00 0.00 C ATOM 88 CD1 LEU A 6 7.143 17.304 3.457 1.00 0.00 C ATOM 89 CD2 LEU A 6 7.811 14.931 3.058 1.00 0.00 C ATOM 0 H LEU A 6 6.705 14.989 7.789 1.00 0.00 H new ATOM 0 HA LEU A 6 5.908 13.878 5.193 1.00 0.00 H new ATOM 0 HB2 LEU A 6 6.428 16.375 5.859 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.088 15.877 5.602 1.00 0.00 H new ATOM 0 HG LEU A 6 5.855 15.614 3.564 1.00 0.00 H new ATOM 0 HD11 LEU A 6 7.016 17.431 2.382 1.00 0.00 H new ATOM 0 HD12 LEU A 6 6.439 17.948 3.984 1.00 0.00 H new ATOM 0 HD13 LEU A 6 8.161 17.574 3.737 1.00 0.00 H new ATOM 0 HD21 LEU A 6 7.675 15.089 1.988 1.00 0.00 H new ATOM 0 HD22 LEU A 6 8.845 15.144 3.328 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.578 13.895 3.304 1.00 0.00 H new ATOM 101 N TYR A 7 7.681 12.053 5.704 1.00 0.00 N ATOM 102 CA TYR A 7 8.782 11.115 5.679 1.00 0.00 C ATOM 103 C TYR A 7 9.389 10.963 4.294 1.00 0.00 C ATOM 104 O TYR A 7 8.835 10.311 3.415 1.00 0.00 O ATOM 105 CB TYR A 7 8.349 9.746 6.241 1.00 0.00 C ATOM 106 CG TYR A 7 7.425 9.795 7.445 1.00 0.00 C ATOM 107 CD1 TYR A 7 6.110 10.252 7.351 1.00 0.00 C ATOM 108 CD2 TYR A 7 7.867 9.335 8.681 1.00 0.00 C ATOM 109 CE1 TYR A 7 5.276 10.249 8.454 1.00 0.00 C ATOM 110 CE2 TYR A 7 7.040 9.337 9.787 1.00 0.00 C ATOM 111 CZ TYR A 7 5.746 9.792 9.670 1.00 0.00 C ATOM 112 OH TYR A 7 4.918 9.787 10.772 1.00 0.00 O ATOM 0 H TYR A 7 6.752 11.632 5.693 1.00 0.00 H new ATOM 0 HA TYR A 7 9.561 11.527 6.321 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.853 9.188 5.447 1.00 0.00 H new ATOM 0 HB3 TYR A 7 9.243 9.186 6.514 1.00 0.00 H new ATOM 0 HD1 TYR A 7 5.738 10.613 6.403 1.00 0.00 H new ATOM 0 HD2 TYR A 7 8.878 8.969 8.778 1.00 0.00 H new ATOM 0 HE1 TYR A 7 4.260 10.603 8.365 1.00 0.00 H new ATOM 0 HE2 TYR A 7 7.407 8.983 10.739 1.00 0.00 H new ATOM 0 HH TYR A 7 4.300 10.546 10.720 1.00 0.00 H new ATOM 122 N LYS A 8 10.576 11.548 4.149 1.00 0.00 N ATOM 123 CA LYS A 8 11.344 11.481 2.919 1.00 0.00 C ATOM 124 C LYS A 8 11.783 10.043 2.670 1.00 0.00 C ATOM 125 O LYS A 8 10.972 9.181 2.332 1.00 0.00 O ATOM 126 CB LYS A 8 12.549 12.422 3.028 1.00 0.00 C ATOM 127 CG LYS A 8 13.435 12.459 1.794 1.00 0.00 C ATOM 128 CD LYS A 8 13.663 13.884 1.325 1.00 0.00 C ATOM 129 CE LYS A 8 14.183 13.927 -0.102 1.00 0.00 C ATOM 130 NZ LYS A 8 13.811 15.193 -0.791 1.00 0.00 N ATOM 0 H LYS A 8 11.030 12.084 4.889 1.00 0.00 H new ATOM 0 HA LYS A 8 10.734 11.798 2.074 1.00 0.00 H new ATOM 0 HB2 LYS A 8 12.189 13.431 3.231 1.00 0.00 H new ATOM 0 HB3 LYS A 8 13.153 12.121 3.884 1.00 0.00 H new ATOM 0 HG2 LYS A 8 14.393 11.989 2.017 1.00 0.00 H new ATOM 0 HG3 LYS A 8 12.974 11.880 0.994 1.00 0.00 H new ATOM 0 HD2 LYS A 8 12.729 14.443 1.390 1.00 0.00 H new ATOM 0 HD3 LYS A 8 14.375 14.376 1.987 1.00 0.00 H new ATOM 0 HE2 LYS A 8 15.268 13.822 -0.096 1.00 0.00 H new ATOM 0 HE3 LYS A 8 13.784 13.080 -0.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 14.155 15.168 -1.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 12.776 15.298 -0.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 14.241 15.998 -0.293 1.00 0.00 H new ATOM 144 N ASN A 9 13.055 9.783 2.854 1.00 0.00 N ATOM 145 CA ASN A 9 13.599 8.457 2.671 1.00 0.00 C ATOM 146 C ASN A 9 14.840 8.328 3.550 1.00 0.00 C ATOM 147 O ASN A 9 15.773 9.118 3.400 1.00 0.00 O ATOM 148 CB ASN A 9 13.951 8.222 1.192 1.00 0.00 C ATOM 149 CG ASN A 9 13.214 7.035 0.604 1.00 0.00 C ATOM 150 OD1 ASN A 9 12.263 7.198 -0.161 1.00 0.00 O ATOM 151 ND2 ASN A 9 13.652 5.832 0.956 1.00 0.00 N ATOM 0 H ASN A 9 13.742 10.483 3.134 1.00 0.00 H new ATOM 0 HA ASN A 9 12.864 7.705 2.957 1.00 0.00 H new ATOM 0 HB2 ASN A 9 13.710 9.117 0.618 1.00 0.00 H new ATOM 0 HB3 ASN A 9 15.025 8.062 1.098 1.00 0.00 H new ATOM 0 HD21 ASN A 9 13.197 4.996 0.589 1.00 0.00 H new ATOM 0 HD22 ASN A 9 14.444 5.744 1.593 1.00 0.00 H new ATOM 158 N LYS A 10 14.848 7.357 4.486 1.00 0.00 N ATOM 159 CA LYS A 10 15.994 7.159 5.400 1.00 0.00 C ATOM 160 C LYS A 10 17.277 7.500 4.681 1.00 0.00 C ATOM 161 O LYS A 10 18.235 8.016 5.257 1.00 0.00 O ATOM 162 CB LYS A 10 16.083 5.724 5.896 1.00 0.00 C ATOM 163 CG LYS A 10 15.140 4.822 5.179 1.00 0.00 C ATOM 164 CD LYS A 10 15.368 4.891 3.682 1.00 0.00 C ATOM 165 CE LYS A 10 16.511 3.984 3.255 1.00 0.00 C ATOM 166 NZ LYS A 10 16.500 3.726 1.788 1.00 0.00 N ATOM 0 H LYS A 10 14.080 6.701 4.629 1.00 0.00 H new ATOM 0 HA LYS A 10 15.845 7.812 6.260 1.00 0.00 H new ATOM 0 HB2 LYS A 10 17.102 5.359 5.766 1.00 0.00 H new ATOM 0 HB3 LYS A 10 15.868 5.697 6.964 1.00 0.00 H new ATOM 0 HG2 LYS A 10 15.274 3.797 5.526 1.00 0.00 H new ATOM 0 HG3 LYS A 10 14.113 5.104 5.409 1.00 0.00 H new ATOM 0 HD2 LYS A 10 14.456 4.601 3.159 1.00 0.00 H new ATOM 0 HD3 LYS A 10 15.589 5.918 3.393 1.00 0.00 H new ATOM 0 HE2 LYS A 10 17.460 4.440 3.536 1.00 0.00 H new ATOM 0 HE3 LYS A 10 16.442 3.037 3.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 17.403 3.295 1.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 15.719 3.080 1.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 16.370 4.623 1.279 1.00 0.00 H new ATOM 180 N ASP A 11 17.250 7.213 3.394 1.00 0.00 N ATOM 181 CA ASP A 11 18.336 7.469 2.521 1.00 0.00 C ATOM 182 C ASP A 11 17.870 8.450 1.449 1.00 0.00 C ATOM 183 O ASP A 11 17.331 8.047 0.418 1.00 0.00 O ATOM 184 CB ASP A 11 18.790 6.144 1.909 1.00 0.00 C ATOM 185 CG ASP A 11 20.159 5.716 2.399 1.00 0.00 C ATOM 186 OD1 ASP A 11 21.051 6.584 2.501 1.00 0.00 O ATOM 187 OD2 ASP A 11 20.339 4.513 2.683 1.00 0.00 O ATOM 0 H ASP A 11 16.446 6.786 2.934 1.00 0.00 H new ATOM 0 HA ASP A 11 19.180 7.910 3.051 1.00 0.00 H new ATOM 0 HB2 ASP A 11 18.063 5.368 2.150 1.00 0.00 H new ATOM 0 HB3 ASP A 11 18.809 6.237 0.823 1.00 0.00 H new ATOM 192 N LYS A 12 18.048 9.744 1.715 1.00 0.00 N ATOM 193 CA LYS A 12 17.609 10.790 0.790 1.00 0.00 C ATOM 194 C LYS A 12 18.017 10.489 -0.658 1.00 0.00 C ATOM 195 O LYS A 12 17.446 11.049 -1.593 1.00 0.00 O ATOM 196 CB LYS A 12 18.144 12.159 1.235 1.00 0.00 C ATOM 197 CG LYS A 12 17.442 12.719 2.473 1.00 0.00 C ATOM 198 CD LYS A 12 18.125 12.260 3.752 1.00 0.00 C ATOM 199 CE LYS A 12 18.180 13.374 4.785 1.00 0.00 C ATOM 200 NZ LYS A 12 19.516 14.029 4.827 1.00 0.00 N ATOM 0 H LYS A 12 18.493 10.094 2.564 1.00 0.00 H new ATOM 0 HA LYS A 12 16.520 10.813 0.816 1.00 0.00 H new ATOM 0 HB2 LYS A 12 19.211 12.073 1.441 1.00 0.00 H new ATOM 0 HB3 LYS A 12 18.034 12.867 0.414 1.00 0.00 H new ATOM 0 HG2 LYS A 12 17.440 13.808 2.431 1.00 0.00 H new ATOM 0 HG3 LYS A 12 16.400 12.398 2.479 1.00 0.00 H new ATOM 0 HD2 LYS A 12 17.589 11.405 4.165 1.00 0.00 H new ATOM 0 HD3 LYS A 12 19.136 11.923 3.525 1.00 0.00 H new ATOM 0 HE2 LYS A 12 17.418 14.119 4.556 1.00 0.00 H new ATOM 0 HE3 LYS A 12 17.944 12.968 5.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 19.511 14.782 5.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 20.241 13.324 5.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 19.731 14.439 3.896 1.00 0.00 H new ATOM 214 N SER A 13 18.984 9.589 -0.847 1.00 0.00 N ATOM 215 CA SER A 13 19.420 9.216 -2.190 1.00 0.00 C ATOM 216 C SER A 13 18.252 8.611 -2.971 1.00 0.00 C ATOM 217 O SER A 13 18.128 8.809 -4.180 1.00 0.00 O ATOM 218 CB SER A 13 20.576 8.217 -2.118 1.00 0.00 C ATOM 219 OG SER A 13 21.154 8.013 -3.396 1.00 0.00 O ATOM 0 H SER A 13 19.475 9.110 -0.093 1.00 0.00 H new ATOM 0 HA SER A 13 19.766 10.112 -2.705 1.00 0.00 H new ATOM 0 HB2 SER A 13 21.335 8.583 -1.426 1.00 0.00 H new ATOM 0 HB3 SER A 13 20.216 7.267 -1.722 1.00 0.00 H new ATOM 0 HG SER A 13 21.891 7.372 -3.323 1.00 0.00 H new ATOM 225 N SER A 14 17.386 7.893 -2.256 1.00 0.00 N ATOM 226 CA SER A 14 16.202 7.272 -2.853 1.00 0.00 C ATOM 227 C SER A 14 15.374 8.298 -3.578 1.00 0.00 C ATOM 228 O SER A 14 14.687 7.988 -4.547 1.00 0.00 O ATOM 229 CB SER A 14 15.331 6.652 -1.763 1.00 0.00 C ATOM 230 OG SER A 14 16.118 6.184 -0.681 1.00 0.00 O ATOM 0 H SER A 14 17.483 7.726 -1.255 1.00 0.00 H new ATOM 0 HA SER A 14 16.543 6.508 -3.552 1.00 0.00 H new ATOM 0 HB2 SER A 14 14.615 7.390 -1.402 1.00 0.00 H new ATOM 0 HB3 SER A 14 14.755 5.826 -2.180 1.00 0.00 H new ATOM 0 HG SER A 14 16.326 6.930 -0.081 1.00 0.00 H new ATOM 236 N ALA A 15 15.413 9.513 -3.075 1.00 0.00 N ATOM 237 CA ALA A 15 14.630 10.578 -3.644 1.00 0.00 C ATOM 238 C ALA A 15 14.815 10.692 -5.150 1.00 0.00 C ATOM 239 O ALA A 15 13.918 11.166 -5.847 1.00 0.00 O ATOM 240 CB ALA A 15 14.959 11.895 -2.963 1.00 0.00 C ATOM 0 H ALA A 15 15.981 9.784 -2.272 1.00 0.00 H new ATOM 0 HA ALA A 15 13.581 10.338 -3.470 1.00 0.00 H new ATOM 0 HB1 ALA A 15 14.360 12.692 -3.403 1.00 0.00 H new ATOM 0 HB2 ALA A 15 14.737 11.820 -1.899 1.00 0.00 H new ATOM 0 HB3 ALA A 15 16.017 12.120 -3.098 1.00 0.00 H new ATOM 246 N LYS A 16 15.963 10.246 -5.662 1.00 0.00 N ATOM 247 CA LYS A 16 16.203 10.303 -7.100 1.00 0.00 C ATOM 248 C LYS A 16 14.984 9.743 -7.816 1.00 0.00 C ATOM 249 O LYS A 16 14.458 10.343 -8.753 1.00 0.00 O ATOM 250 CB LYS A 16 17.451 9.500 -7.473 1.00 0.00 C ATOM 251 CG LYS A 16 18.745 10.284 -7.327 1.00 0.00 C ATOM 252 CD LYS A 16 18.861 11.370 -8.384 1.00 0.00 C ATOM 253 CE LYS A 16 20.027 12.303 -8.098 1.00 0.00 C ATOM 254 NZ LYS A 16 21.228 11.956 -8.907 1.00 0.00 N ATOM 0 H LYS A 16 16.726 9.849 -5.113 1.00 0.00 H new ATOM 0 HA LYS A 16 16.370 11.337 -7.401 1.00 0.00 H new ATOM 0 HB2 LYS A 16 17.502 8.611 -6.845 1.00 0.00 H new ATOM 0 HB3 LYS A 16 17.358 9.157 -8.504 1.00 0.00 H new ATOM 0 HG2 LYS A 16 18.789 10.734 -6.335 1.00 0.00 H new ATOM 0 HG3 LYS A 16 19.594 9.605 -7.407 1.00 0.00 H new ATOM 0 HD2 LYS A 16 18.992 10.912 -9.365 1.00 0.00 H new ATOM 0 HD3 LYS A 16 17.935 11.944 -8.421 1.00 0.00 H new ATOM 0 HE2 LYS A 16 19.731 13.330 -8.311 1.00 0.00 H new ATOM 0 HE3 LYS A 16 20.277 12.257 -7.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 22.000 12.615 -8.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 21.527 10.985 -8.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 20.997 12.025 -9.919 1.00 0.00 H new ATOM 268 N THR A 17 14.514 8.607 -7.315 1.00 0.00 N ATOM 269 CA THR A 17 13.323 7.967 -7.840 1.00 0.00 C ATOM 270 C THR A 17 12.157 8.186 -6.881 1.00 0.00 C ATOM 271 O THR A 17 11.038 8.481 -7.300 1.00 0.00 O ATOM 272 CB THR A 17 13.549 6.470 -8.054 1.00 0.00 C ATOM 273 OG1 THR A 17 14.605 6.240 -8.974 1.00 0.00 O ATOM 274 CG2 THR A 17 12.318 5.758 -8.575 1.00 0.00 C ATOM 0 H THR A 17 14.948 8.109 -6.538 1.00 0.00 H new ATOM 0 HA THR A 17 13.091 8.415 -8.806 1.00 0.00 H new ATOM 0 HB THR A 17 13.799 6.070 -7.071 1.00 0.00 H new ATOM 0 HG1 THR A 17 14.731 5.275 -9.093 1.00 0.00 H new ATOM 0 HG21 THR A 17 12.539 4.699 -8.707 1.00 0.00 H new ATOM 0 HG22 THR A 17 11.502 5.872 -7.861 1.00 0.00 H new ATOM 0 HG23 THR A 17 12.026 6.190 -9.532 1.00 0.00 H new ATOM 282 N TYR A 18 12.432 8.016 -5.585 1.00 0.00 N ATOM 283 CA TYR A 18 11.404 8.173 -4.557 1.00 0.00 C ATOM 284 C TYR A 18 11.944 8.865 -3.320 1.00 0.00 C ATOM 285 O TYR A 18 12.736 8.279 -2.582 1.00 0.00 O ATOM 286 CB TYR A 18 10.918 6.818 -4.117 1.00 0.00 C ATOM 287 CG TYR A 18 10.535 5.895 -5.252 1.00 0.00 C ATOM 288 CD1 TYR A 18 9.692 6.326 -6.270 1.00 0.00 C ATOM 289 CD2 TYR A 18 11.016 4.593 -5.306 1.00 0.00 C ATOM 290 CE1 TYR A 18 9.340 5.485 -7.308 1.00 0.00 C ATOM 291 CE2 TYR A 18 10.669 3.746 -6.342 1.00 0.00 C ATOM 292 CZ TYR A 18 9.831 4.196 -7.339 1.00 0.00 C ATOM 293 OH TYR A 18 9.482 3.356 -8.372 1.00 0.00 O ATOM 0 H TYR A 18 13.354 7.771 -5.225 1.00 0.00 H new ATOM 0 HA TYR A 18 10.605 8.771 -4.996 1.00 0.00 H new ATOM 0 HB2 TYR A 18 11.698 6.341 -3.523 1.00 0.00 H new ATOM 0 HB3 TYR A 18 10.055 6.949 -3.464 1.00 0.00 H new ATOM 0 HD1 TYR A 18 9.306 7.334 -6.249 1.00 0.00 H new ATOM 0 HD2 TYR A 18 11.672 4.236 -4.526 1.00 0.00 H new ATOM 0 HE1 TYR A 18 8.684 5.835 -8.091 1.00 0.00 H new ATOM 0 HE2 TYR A 18 11.053 2.737 -6.370 1.00 0.00 H new ATOM 0 HH TYR A 18 9.913 2.485 -8.245 1.00 0.00 H new ATOM 303 N PRO A 19 11.557 10.118 -3.066 1.00 0.00 N ATOM 304 CA PRO A 19 12.047 10.847 -1.916 1.00 0.00 C ATOM 305 C PRO A 19 11.259 10.615 -0.634 1.00 0.00 C ATOM 306 O PRO A 19 11.860 10.425 0.409 1.00 0.00 O ATOM 307 CB PRO A 19 11.925 12.317 -2.333 1.00 0.00 C ATOM 308 CG PRO A 19 11.263 12.317 -3.673 1.00 0.00 C ATOM 309 CD PRO A 19 10.667 10.947 -3.871 1.00 0.00 C ATOM 0 HA PRO A 19 13.058 10.520 -1.673 1.00 0.00 H new ATOM 0 HB2 PRO A 19 11.337 12.880 -1.608 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.906 12.790 -2.383 1.00 0.00 H new ATOM 0 HG2 PRO A 19 10.490 13.084 -3.721 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.984 12.541 -4.459 1.00 0.00 H new ATOM 0 HD2 PRO A 19 9.635 10.896 -3.524 1.00 0.00 H new ATOM 0 HD3 PRO A 19 10.666 10.649 -4.919 1.00 0.00 H new ATOM 317 N TYR A 20 9.924 10.687 -0.682 1.00 0.00 N ATOM 318 CA TYR A 20 9.145 10.546 0.554 1.00 0.00 C ATOM 319 C TYR A 20 7.942 9.639 0.467 1.00 0.00 C ATOM 320 O TYR A 20 7.592 9.083 -0.572 1.00 0.00 O ATOM 321 CB TYR A 20 8.638 11.909 1.044 1.00 0.00 C ATOM 322 CG TYR A 20 9.242 13.061 0.316 1.00 0.00 C ATOM 323 CD1 TYR A 20 9.005 13.230 -1.037 1.00 0.00 C ATOM 324 CD2 TYR A 20 10.060 13.955 0.975 1.00 0.00 C ATOM 325 CE1 TYR A 20 9.570 14.263 -1.738 1.00 0.00 C ATOM 326 CE2 TYR A 20 10.636 15.009 0.288 1.00 0.00 C ATOM 327 CZ TYR A 20 10.390 15.159 -1.072 1.00 0.00 C ATOM 328 OH TYR A 20 10.975 16.193 -1.762 1.00 0.00 O ATOM 0 H TYR A 20 9.376 10.836 -1.529 1.00 0.00 H new ATOM 0 HA TYR A 20 9.855 10.090 1.244 1.00 0.00 H new ATOM 0 HB2 TYR A 20 7.554 11.947 0.933 1.00 0.00 H new ATOM 0 HB3 TYR A 20 8.853 12.008 2.108 1.00 0.00 H new ATOM 0 HD1 TYR A 20 8.361 12.533 -1.552 1.00 0.00 H new ATOM 0 HD2 TYR A 20 10.252 13.832 2.031 1.00 0.00 H new ATOM 0 HE1 TYR A 20 9.379 14.377 -2.795 1.00 0.00 H new ATOM 0 HE2 TYR A 20 11.273 15.711 0.805 1.00 0.00 H new ATOM 0 HH TYR A 20 10.324 16.916 -1.881 1.00 0.00 H new ATOM 338 N PHE A 21 7.309 9.575 1.627 1.00 0.00 N ATOM 339 CA PHE A 21 6.096 8.843 1.873 1.00 0.00 C ATOM 340 C PHE A 21 5.406 9.525 3.030 1.00 0.00 C ATOM 341 O PHE A 21 6.004 10.370 3.698 1.00 0.00 O ATOM 342 CB PHE A 21 6.358 7.386 2.240 1.00 0.00 C ATOM 343 CG PHE A 21 7.736 6.878 1.882 1.00 0.00 C ATOM 344 CD1 PHE A 21 8.826 7.039 2.741 1.00 0.00 C ATOM 345 CD2 PHE A 21 7.939 6.229 0.676 1.00 0.00 C ATOM 346 CE1 PHE A 21 10.075 6.562 2.391 1.00 0.00 C ATOM 347 CE2 PHE A 21 9.187 5.750 0.326 1.00 0.00 C ATOM 348 CZ PHE A 21 10.255 5.917 1.184 1.00 0.00 C ATOM 0 H PHE A 21 7.651 10.059 2.457 1.00 0.00 H new ATOM 0 HA PHE A 21 5.491 8.837 0.967 1.00 0.00 H new ATOM 0 HB2 PHE A 21 6.209 7.264 3.313 1.00 0.00 H new ATOM 0 HB3 PHE A 21 5.616 6.762 1.742 1.00 0.00 H new ATOM 0 HD1 PHE A 21 8.691 7.541 3.688 1.00 0.00 H new ATOM 0 HD2 PHE A 21 7.109 6.095 -0.002 1.00 0.00 H new ATOM 0 HE1 PHE A 21 10.911 6.694 3.062 1.00 0.00 H new ATOM 0 HE2 PHE A 21 9.327 5.245 -0.619 1.00 0.00 H new ATOM 0 HZ PHE A 21 11.231 5.543 0.911 1.00 0.00 H new ATOM 358 N VAL A 22 4.169 9.180 3.276 1.00 0.00 N ATOM 359 CA VAL A 22 3.451 9.794 4.365 1.00 0.00 C ATOM 360 C VAL A 22 2.773 8.764 5.239 1.00 0.00 C ATOM 361 O VAL A 22 1.816 8.113 4.830 1.00 0.00 O ATOM 362 CB VAL A 22 2.417 10.786 3.851 1.00 0.00 C ATOM 363 CG1 VAL A 22 1.646 11.382 5.016 1.00 0.00 C ATOM 364 CG2 VAL A 22 3.080 11.880 3.024 1.00 0.00 C ATOM 0 H VAL A 22 3.642 8.486 2.745 1.00 0.00 H new ATOM 0 HA VAL A 22 4.187 10.327 4.967 1.00 0.00 H new ATOM 0 HB VAL A 22 1.718 10.257 3.204 1.00 0.00 H new ATOM 0 HG11 VAL A 22 0.908 12.091 4.640 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.139 10.586 5.562 1.00 0.00 H new ATOM 0 HG13 VAL A 22 2.336 11.897 5.684 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.321 12.577 2.668 1.00 0.00 H new ATOM 0 HG22 VAL A 22 3.803 12.415 3.640 1.00 0.00 H new ATOM 0 HG23 VAL A 22 3.591 11.433 2.171 1.00 0.00 H new ATOM 374 N ASP A 23 3.269 8.637 6.455 1.00 0.00 N ATOM 375 CA ASP A 23 2.697 7.692 7.406 1.00 0.00 C ATOM 376 C ASP A 23 1.228 8.015 7.653 1.00 0.00 C ATOM 377 O ASP A 23 0.899 9.049 8.235 1.00 0.00 O ATOM 378 CB ASP A 23 3.472 7.723 8.717 1.00 0.00 C ATOM 379 CG ASP A 23 4.916 7.313 8.528 1.00 0.00 C ATOM 380 OD1 ASP A 23 5.376 7.275 7.367 1.00 0.00 O ATOM 381 OD2 ASP A 23 5.588 7.034 9.540 1.00 0.00 O ATOM 0 H ASP A 23 4.062 9.171 6.810 1.00 0.00 H new ATOM 0 HA ASP A 23 2.768 6.689 6.984 1.00 0.00 H new ATOM 0 HB2 ASP A 23 3.432 8.727 9.139 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.996 7.056 9.436 1.00 0.00 H new ATOM 386 N VAL A 24 0.347 7.135 7.189 1.00 0.00 N ATOM 387 CA VAL A 24 -1.086 7.343 7.342 1.00 0.00 C ATOM 388 C VAL A 24 -1.844 6.028 7.287 1.00 0.00 C ATOM 389 O VAL A 24 -2.233 5.572 6.212 1.00 0.00 O ATOM 390 CB VAL A 24 -1.614 8.296 6.249 1.00 0.00 C ATOM 391 CG1 VAL A 24 -1.157 7.838 4.868 1.00 0.00 C ATOM 392 CG2 VAL A 24 -3.132 8.421 6.310 1.00 0.00 C ATOM 0 H VAL A 24 0.600 6.273 6.705 1.00 0.00 H new ATOM 0 HA VAL A 24 -1.251 7.794 8.321 1.00 0.00 H new ATOM 0 HB VAL A 24 -1.195 9.285 6.435 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -1.540 8.524 4.112 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -0.068 7.828 4.830 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -1.536 6.835 4.673 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -3.473 9.099 5.528 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -3.584 7.440 6.163 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -3.426 8.813 7.284 1.00 0.00 H new ATOM 402 N GLN A 25 -2.062 5.420 8.450 1.00 0.00 N ATOM 403 CA GLN A 25 -2.783 4.161 8.500 1.00 0.00 C ATOM 404 C GLN A 25 -2.994 3.664 9.925 1.00 0.00 C ATOM 405 O GLN A 25 -3.611 4.346 10.744 1.00 0.00 O ATOM 406 CB GLN A 25 -2.039 3.113 7.690 1.00 0.00 C ATOM 407 CG GLN A 25 -2.935 1.992 7.179 1.00 0.00 C ATOM 408 CD GLN A 25 -2.452 0.614 7.596 1.00 0.00 C ATOM 409 OE1 GLN A 25 -1.142 0.401 7.551 1.00 0.00 O flip ATOM 410 NE2 GLN A 25 -3.247 -0.249 7.964 1.00 0.00 N flip ATOM 0 H GLN A 25 -1.753 5.775 9.355 1.00 0.00 H new ATOM 0 HA GLN A 25 -3.770 4.334 8.072 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -1.556 3.597 6.841 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -1.248 2.684 8.305 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -3.948 2.145 7.552 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -2.985 2.040 6.091 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -4.246 -0.046 7.985 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -2.907 -1.168 8.249 1.00 0.00 H new ATOM 419 N SER A 26 -2.493 2.461 10.212 1.00 0.00 N ATOM 420 CA SER A 26 -2.654 1.877 11.546 1.00 0.00 C ATOM 421 C SER A 26 -2.236 2.838 12.636 1.00 0.00 C ATOM 422 O SER A 26 -1.053 3.077 12.830 1.00 0.00 O ATOM 423 CB SER A 26 -1.836 0.608 11.715 1.00 0.00 C ATOM 424 OG SER A 26 -2.380 -0.463 10.964 1.00 0.00 O ATOM 0 H SER A 26 -1.980 1.879 9.550 1.00 0.00 H new ATOM 0 HA SER A 26 -3.716 1.649 11.636 1.00 0.00 H new ATOM 0 HB2 SER A 26 -0.809 0.791 11.399 1.00 0.00 H new ATOM 0 HB3 SER A 26 -1.801 0.334 12.769 1.00 0.00 H new ATOM 0 HG SER A 26 -1.660 -1.069 10.690 1.00 0.00 H new ATOM 430 N ASP A 27 -3.193 3.347 13.389 1.00 0.00 N ATOM 431 CA ASP A 27 -2.855 4.220 14.495 1.00 0.00 C ATOM 432 C ASP A 27 -2.196 3.363 15.568 1.00 0.00 C ATOM 433 O ASP A 27 -1.271 3.793 16.256 1.00 0.00 O ATOM 434 CB ASP A 27 -4.100 4.917 15.048 1.00 0.00 C ATOM 435 CG ASP A 27 -3.828 6.353 15.451 1.00 0.00 C ATOM 436 OD1 ASP A 27 -2.941 6.984 14.839 1.00 0.00 O ATOM 437 OD2 ASP A 27 -4.503 6.847 16.379 1.00 0.00 O ATOM 0 H ASP A 27 -4.190 3.176 13.259 1.00 0.00 H new ATOM 0 HA ASP A 27 -2.176 5.004 14.161 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -4.889 4.897 14.296 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -4.469 4.364 15.912 1.00 0.00 H new ATOM 442 N LEU A 28 -2.682 2.125 15.670 1.00 0.00 N ATOM 443 CA LEU A 28 -2.155 1.155 16.617 1.00 0.00 C ATOM 444 C LEU A 28 -0.964 0.399 16.041 1.00 0.00 C ATOM 445 O LEU A 28 -0.329 -0.398 16.733 1.00 0.00 O ATOM 446 CB LEU A 28 -3.244 0.161 17.017 1.00 0.00 C ATOM 447 CG LEU A 28 -4.479 0.777 17.679 1.00 0.00 C ATOM 448 CD1 LEU A 28 -4.073 1.669 18.842 1.00 0.00 C ATOM 449 CD2 LEU A 28 -5.292 1.562 16.661 1.00 0.00 C ATOM 0 H LEU A 28 -3.450 1.772 15.098 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.819 1.705 17.496 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.562 -0.382 16.127 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.812 -0.571 17.700 1.00 0.00 H new ATOM 0 HG LEU A 28 -5.100 -0.030 18.067 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -4.964 2.098 19.300 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -3.533 1.079 19.582 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.430 2.471 18.478 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -6.166 1.993 17.148 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -4.679 2.360 16.243 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.614 0.896 15.861 1.00 0.00 H new ATOM 461 N LEU A 29 -0.680 0.634 14.770 1.00 0.00 N ATOM 462 CA LEU A 29 0.416 -0.042 14.096 1.00 0.00 C ATOM 463 C LEU A 29 1.008 0.852 13.019 1.00 0.00 C ATOM 464 O LEU A 29 1.382 0.383 11.944 1.00 0.00 O ATOM 465 CB LEU A 29 -0.097 -1.334 13.469 1.00 0.00 C ATOM 466 CG LEU A 29 -0.566 -2.394 14.466 1.00 0.00 C ATOM 467 CD1 LEU A 29 -1.391 -3.461 13.761 1.00 0.00 C ATOM 468 CD2 LEU A 29 0.623 -3.019 15.182 1.00 0.00 C ATOM 0 H LEU A 29 -1.195 1.290 14.183 1.00 0.00 H new ATOM 0 HA LEU A 29 1.194 -0.271 14.824 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -0.925 -1.093 12.802 1.00 0.00 H new ATOM 0 HB3 LEU A 29 0.695 -1.761 12.853 1.00 0.00 H new ATOM 0 HG LEU A 29 -1.197 -1.910 15.212 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.716 -4.207 14.486 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -2.264 -3.000 13.298 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.785 -3.941 12.993 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.269 -3.771 15.887 1.00 0.00 H new ATOM 0 HD22 LEU A 29 1.282 -3.488 14.452 1.00 0.00 H new ATOM 0 HD23 LEU A 29 1.171 -2.246 15.721 1.00 0.00 H new ATOM 480 N ASP A 30 1.062 2.144 13.302 1.00 0.00 N ATOM 481 CA ASP A 30 1.579 3.105 12.340 1.00 0.00 C ATOM 482 C ASP A 30 3.082 2.954 12.153 1.00 0.00 C ATOM 483 O ASP A 30 3.544 2.685 11.055 1.00 0.00 O ATOM 484 CB ASP A 30 1.231 4.533 12.768 1.00 0.00 C ATOM 485 CG ASP A 30 0.751 5.376 11.603 1.00 0.00 C ATOM 486 OD1 ASP A 30 1.569 5.671 10.706 1.00 0.00 O ATOM 487 OD2 ASP A 30 -0.443 5.742 11.587 1.00 0.00 O ATOM 0 H ASP A 30 0.756 2.550 14.186 1.00 0.00 H new ATOM 0 HA ASP A 30 1.104 2.902 11.380 1.00 0.00 H new ATOM 0 HB2 ASP A 30 0.458 4.503 13.536 1.00 0.00 H new ATOM 0 HB3 ASP A 30 2.108 5.001 13.216 1.00 0.00 H new ATOM 492 N ASN A 31 3.854 3.102 13.218 1.00 0.00 N ATOM 493 CA ASN A 31 5.301 2.955 13.099 1.00 0.00 C ATOM 494 C ASN A 31 5.826 1.858 14.001 1.00 0.00 C ATOM 495 O ASN A 31 7.036 1.697 14.157 1.00 0.00 O ATOM 496 CB ASN A 31 6.013 4.274 13.400 1.00 0.00 C ATOM 497 CG ASN A 31 7.499 4.204 13.112 1.00 0.00 C ATOM 498 OD1 ASN A 31 7.952 3.366 12.333 1.00 0.00 O ATOM 499 ND2 ASN A 31 8.267 5.086 13.742 1.00 0.00 N ATOM 0 H ASN A 31 3.516 3.319 14.156 1.00 0.00 H new ATOM 0 HA ASN A 31 5.512 2.673 12.068 1.00 0.00 H new ATOM 0 HB2 ASN A 31 5.567 5.070 12.803 1.00 0.00 H new ATOM 0 HB3 ASN A 31 5.860 4.536 14.447 1.00 0.00 H new ATOM 0 HD21 ASN A 31 9.275 5.086 13.588 1.00 0.00 H new ATOM 0 HD22 ASN A 31 7.848 5.763 14.380 1.00 0.00 H new ATOM 506 N LEU A 32 4.918 1.073 14.559 1.00 0.00 N ATOM 507 CA LEU A 32 5.318 -0.042 15.401 1.00 0.00 C ATOM 508 C LEU A 32 6.292 -0.892 14.627 1.00 0.00 C ATOM 509 O LEU A 32 7.432 -1.114 15.036 1.00 0.00 O ATOM 510 CB LEU A 32 4.121 -0.910 15.757 1.00 0.00 C ATOM 511 CG LEU A 32 3.788 -0.991 17.247 1.00 0.00 C ATOM 512 CD1 LEU A 32 3.424 0.383 17.788 1.00 0.00 C ATOM 513 CD2 LEU A 32 2.654 -1.977 17.485 1.00 0.00 C ATOM 0 H LEU A 32 3.911 1.185 14.446 1.00 0.00 H new ATOM 0 HA LEU A 32 5.761 0.350 16.316 1.00 0.00 H new ATOM 0 HB2 LEU A 32 3.248 -0.529 15.227 1.00 0.00 H new ATOM 0 HB3 LEU A 32 4.303 -1.919 15.388 1.00 0.00 H new ATOM 0 HG LEU A 32 4.671 -1.346 17.779 1.00 0.00 H new ATOM 0 HD11 LEU A 32 3.190 0.306 18.850 1.00 0.00 H new ATOM 0 HD12 LEU A 32 4.265 1.063 17.650 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.556 0.767 17.252 1.00 0.00 H new ATOM 0 HD21 LEU A 32 2.429 -2.023 18.551 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.768 -1.650 16.941 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.951 -2.965 17.134 1.00 0.00 H new ATOM 525 N ASN A 33 5.808 -1.359 13.487 1.00 0.00 N ATOM 526 CA ASN A 33 6.594 -2.186 12.610 1.00 0.00 C ATOM 527 C ASN A 33 6.560 -1.655 11.173 1.00 0.00 C ATOM 528 O ASN A 33 7.514 -1.833 10.416 1.00 0.00 O ATOM 529 CB ASN A 33 6.085 -3.628 12.643 1.00 0.00 C ATOM 530 CG ASN A 33 6.548 -4.376 13.878 1.00 0.00 C ATOM 531 OD1 ASN A 33 7.730 -4.356 14.223 1.00 0.00 O ATOM 532 ND2 ASN A 33 5.617 -5.043 14.550 1.00 0.00 N ATOM 0 H ASN A 33 4.863 -1.172 13.152 1.00 0.00 H new ATOM 0 HA ASN A 33 7.626 -2.161 12.961 1.00 0.00 H new ATOM 0 HB2 ASN A 33 4.996 -3.627 12.609 1.00 0.00 H new ATOM 0 HB3 ASN A 33 6.431 -4.153 11.753 1.00 0.00 H new ATOM 0 HD21 ASN A 33 5.870 -5.566 15.388 1.00 0.00 H new ATOM 0 HD22 ASN A 33 4.649 -5.032 14.228 1.00 0.00 H new ATOM 539 N THR A 34 5.451 -1.002 10.802 1.00 0.00 N ATOM 540 CA THR A 34 5.290 -0.448 9.453 1.00 0.00 C ATOM 541 C THR A 34 4.035 0.420 9.377 1.00 0.00 C ATOM 542 O THR A 34 3.232 0.440 10.308 1.00 0.00 O ATOM 543 CB THR A 34 5.231 -1.553 8.378 1.00 0.00 C ATOM 544 OG1 THR A 34 4.000 -1.513 7.675 1.00 0.00 O ATOM 545 CG2 THR A 34 5.396 -2.962 8.911 1.00 0.00 C ATOM 0 H THR A 34 4.653 -0.845 11.417 1.00 0.00 H new ATOM 0 HA THR A 34 6.167 0.167 9.251 1.00 0.00 H new ATOM 0 HB THR A 34 6.079 -1.335 7.728 1.00 0.00 H new ATOM 0 HG1 THR A 34 3.714 -2.426 7.464 1.00 0.00 H new ATOM 0 HG21 THR A 34 5.341 -3.672 8.086 1.00 0.00 H new ATOM 0 HG22 THR A 34 6.364 -3.053 9.404 1.00 0.00 H new ATOM 0 HG23 THR A 34 4.602 -3.176 9.627 1.00 0.00 H new ATOM 553 N ARG A 35 3.859 1.120 8.256 1.00 0.00 N ATOM 554 CA ARG A 35 2.686 1.969 8.069 1.00 0.00 C ATOM 555 C ARG A 35 2.317 2.111 6.599 1.00 0.00 C ATOM 556 O ARG A 35 3.145 1.892 5.719 1.00 0.00 O ATOM 557 CB ARG A 35 2.926 3.351 8.684 1.00 0.00 C ATOM 558 CG ARG A 35 3.404 4.419 7.708 1.00 0.00 C ATOM 559 CD ARG A 35 4.794 4.134 7.139 1.00 0.00 C ATOM 560 NE ARG A 35 5.585 3.193 7.939 1.00 0.00 N ATOM 561 CZ ARG A 35 5.958 3.401 9.203 1.00 0.00 C ATOM 562 NH1 ARG A 35 5.541 4.472 9.863 1.00 0.00 N ATOM 563 NH2 ARG A 35 6.744 2.525 9.812 1.00 0.00 N ATOM 0 H ARG A 35 4.509 1.115 7.470 1.00 0.00 H new ATOM 0 HA ARG A 35 1.851 1.487 8.577 1.00 0.00 H new ATOM 0 HB2 ARG A 35 1.999 3.692 9.146 1.00 0.00 H new ATOM 0 HB3 ARG A 35 3.663 3.254 9.481 1.00 0.00 H new ATOM 0 HG2 ARG A 35 2.691 4.497 6.887 1.00 0.00 H new ATOM 0 HG3 ARG A 35 3.416 5.385 8.213 1.00 0.00 H new ATOM 0 HD2 ARG A 35 4.688 3.737 6.130 1.00 0.00 H new ATOM 0 HD3 ARG A 35 5.341 5.073 7.056 1.00 0.00 H new ATOM 0 HE ARG A 35 5.870 2.318 7.498 1.00 0.00 H new ATOM 0 HH11 ARG A 35 4.929 5.147 9.405 1.00 0.00 H new ATOM 0 HH12 ARG A 35 5.832 4.621 10.829 1.00 0.00 H new ATOM 0 HH21 ARG A 35 7.063 1.694 9.314 1.00 0.00 H new ATOM 0 HH22 ARG A 35 7.030 2.682 10.778 1.00 0.00 H new ATOM 577 N LEU A 36 1.078 2.522 6.344 1.00 0.00 N ATOM 578 CA LEU A 36 0.623 2.737 4.977 1.00 0.00 C ATOM 579 C LEU A 36 0.975 4.155 4.554 1.00 0.00 C ATOM 580 O LEU A 36 0.461 5.119 5.120 1.00 0.00 O ATOM 581 CB LEU A 36 -0.887 2.524 4.866 1.00 0.00 C ATOM 582 CG LEU A 36 -1.397 2.139 3.476 1.00 0.00 C ATOM 583 CD1 LEU A 36 -0.494 1.102 2.824 1.00 0.00 C ATOM 584 CD2 LEU A 36 -2.827 1.626 3.560 1.00 0.00 C ATOM 0 H LEU A 36 0.377 2.711 7.061 1.00 0.00 H new ATOM 0 HA LEU A 36 1.117 2.019 4.323 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.179 1.745 5.570 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -1.389 3.440 5.178 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.382 3.033 2.852 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.883 0.849 1.838 1.00 0.00 H new ATOM 0 HD12 LEU A 36 0.513 1.508 2.724 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.464 0.205 3.443 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -3.176 1.356 2.563 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -2.862 0.749 4.206 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -3.469 2.405 3.971 1.00 0.00 H new ATOM 596 N VAL A 37 1.869 4.288 3.583 1.00 0.00 N ATOM 597 CA VAL A 37 2.286 5.610 3.137 1.00 0.00 C ATOM 598 C VAL A 37 1.933 5.893 1.697 1.00 0.00 C ATOM 599 O VAL A 37 1.838 4.992 0.863 1.00 0.00 O ATOM 600 CB VAL A 37 3.810 5.816 3.258 1.00 0.00 C ATOM 601 CG1 VAL A 37 4.231 5.922 4.716 1.00 0.00 C ATOM 602 CG2 VAL A 37 4.563 4.698 2.549 1.00 0.00 C ATOM 0 H VAL A 37 2.313 3.510 3.096 1.00 0.00 H new ATOM 0 HA VAL A 37 1.745 6.289 3.796 1.00 0.00 H new ATOM 0 HB VAL A 37 4.065 6.756 2.770 1.00 0.00 H new ATOM 0 HG11 VAL A 37 5.310 6.067 4.774 1.00 0.00 H new ATOM 0 HG12 VAL A 37 3.726 6.769 5.180 1.00 0.00 H new ATOM 0 HG13 VAL A 37 3.959 5.006 5.241 1.00 0.00 H new ATOM 0 HG21 VAL A 37 5.636 4.863 2.647 1.00 0.00 H new ATOM 0 HG22 VAL A 37 4.301 3.740 2.999 1.00 0.00 H new ATOM 0 HG23 VAL A 37 4.292 4.689 1.493 1.00 0.00 H new ATOM 612 N ILE A 38 1.838 7.178 1.407 1.00 0.00 N ATOM 613 CA ILE A 38 1.608 7.642 0.064 1.00 0.00 C ATOM 614 C ILE A 38 2.924 8.256 -0.370 1.00 0.00 C ATOM 615 O ILE A 38 3.200 9.424 -0.097 1.00 0.00 O ATOM 616 CB ILE A 38 0.487 8.695 -0.015 1.00 0.00 C ATOM 617 CG1 ILE A 38 -0.617 8.397 1.004 1.00 0.00 C ATOM 618 CG2 ILE A 38 -0.083 8.739 -1.420 1.00 0.00 C ATOM 619 CD1 ILE A 38 -0.669 9.391 2.143 1.00 0.00 C ATOM 0 H ILE A 38 1.919 7.923 2.099 1.00 0.00 H new ATOM 0 HA ILE A 38 1.286 6.820 -0.575 1.00 0.00 H new ATOM 0 HB ILE A 38 0.910 9.670 0.226 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -1.580 8.390 0.493 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -0.465 7.397 1.411 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -0.875 9.486 -1.468 1.00 0.00 H new ATOM 0 HG22 ILE A 38 0.706 9.001 -2.125 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -0.490 7.761 -1.678 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -1.473 9.119 2.827 1.00 0.00 H new ATOM 0 HD12 ILE A 38 0.281 9.381 2.678 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -0.852 10.390 1.746 1.00 0.00 H new ATOM 631 N PRO A 39 3.790 7.445 -0.989 1.00 0.00 N ATOM 632 CA PRO A 39 5.122 7.875 -1.388 1.00 0.00 C ATOM 633 C PRO A 39 5.139 9.190 -2.155 1.00 0.00 C ATOM 634 O PRO A 39 4.846 9.234 -3.345 1.00 0.00 O ATOM 635 CB PRO A 39 5.642 6.729 -2.263 1.00 0.00 C ATOM 636 CG PRO A 39 4.488 5.800 -2.456 1.00 0.00 C ATOM 637 CD PRO A 39 3.575 6.024 -1.289 1.00 0.00 C ATOM 0 HA PRO A 39 5.740 8.071 -0.512 1.00 0.00 H new ATOM 0 HB2 PRO A 39 6.006 7.103 -3.220 1.00 0.00 H new ATOM 0 HB3 PRO A 39 6.477 6.219 -1.782 1.00 0.00 H new ATOM 0 HG2 PRO A 39 3.976 6.004 -3.396 1.00 0.00 H new ATOM 0 HG3 PRO A 39 4.824 4.764 -2.495 1.00 0.00 H new ATOM 0 HD2 PRO A 39 2.535 5.815 -1.541 1.00 0.00 H new ATOM 0 HD3 PRO A 39 3.833 5.387 -0.443 1.00 0.00 H new ATOM 645 N LEU A 40 5.517 10.254 -1.463 1.00 0.00 N ATOM 646 CA LEU A 40 5.616 11.574 -2.068 1.00 0.00 C ATOM 647 C LEU A 40 6.802 11.628 -3.005 1.00 0.00 C ATOM 648 O LEU A 40 7.701 10.794 -2.929 1.00 0.00 O ATOM 649 CB LEU A 40 5.777 12.633 -0.979 1.00 0.00 C ATOM 650 CG LEU A 40 4.531 13.441 -0.679 1.00 0.00 C ATOM 651 CD1 LEU A 40 4.654 14.127 0.673 1.00 0.00 C ATOM 652 CD2 LEU A 40 4.278 14.458 -1.778 1.00 0.00 C ATOM 0 H LEU A 40 5.762 10.228 -0.473 1.00 0.00 H new ATOM 0 HA LEU A 40 4.705 11.771 -2.633 1.00 0.00 H new ATOM 0 HB2 LEU A 40 6.102 12.142 -0.062 1.00 0.00 H new ATOM 0 HB3 LEU A 40 6.573 13.317 -1.274 1.00 0.00 H new ATOM 0 HG LEU A 40 3.679 12.762 -0.641 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.750 14.703 0.872 1.00 0.00 H new ATOM 0 HD12 LEU A 40 4.785 13.376 1.452 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.515 14.795 0.665 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.379 15.029 -1.545 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.129 15.135 -1.850 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.144 13.941 -2.728 1.00 0.00 H new ATOM 664 N THR A 41 6.805 12.618 -3.877 1.00 0.00 N ATOM 665 CA THR A 41 7.892 12.788 -4.818 1.00 0.00 C ATOM 666 C THR A 41 7.938 14.223 -5.322 1.00 0.00 C ATOM 667 O THR A 41 7.035 15.009 -5.042 1.00 0.00 O ATOM 668 CB THR A 41 7.790 11.775 -5.958 1.00 0.00 C ATOM 669 OG1 THR A 41 7.980 12.383 -7.223 1.00 0.00 O ATOM 670 CG2 THR A 41 6.479 11.015 -6.014 1.00 0.00 C ATOM 0 H THR A 41 6.066 13.317 -3.952 1.00 0.00 H new ATOM 0 HA THR A 41 8.835 12.593 -4.307 1.00 0.00 H new ATOM 0 HB THR A 41 8.587 11.065 -5.737 1.00 0.00 H new ATOM 0 HG1 THR A 41 7.909 11.704 -7.926 1.00 0.00 H new ATOM 0 HG21 THR A 41 6.497 10.320 -6.853 1.00 0.00 H new ATOM 0 HG22 THR A 41 6.340 10.460 -5.086 1.00 0.00 H new ATOM 0 HG23 THR A 41 5.656 11.718 -6.143 1.00 0.00 H new ATOM 678 N PRO A 42 9.000 14.606 -6.047 1.00 0.00 N ATOM 679 CA PRO A 42 9.149 15.964 -6.537 1.00 0.00 C ATOM 680 C PRO A 42 8.525 16.179 -7.900 1.00 0.00 C ATOM 681 O PRO A 42 8.955 15.610 -8.904 1.00 0.00 O ATOM 682 CB PRO A 42 10.665 16.107 -6.586 1.00 0.00 C ATOM 683 CG PRO A 42 11.125 14.765 -7.034 1.00 0.00 C ATOM 684 CD PRO A 42 10.162 13.772 -6.427 1.00 0.00 C ATOM 0 HA PRO A 42 8.644 16.700 -5.912 1.00 0.00 H new ATOM 0 HB2 PRO A 42 10.972 16.889 -7.280 1.00 0.00 H new ATOM 0 HB3 PRO A 42 11.076 16.367 -5.610 1.00 0.00 H new ATOM 0 HG2 PRO A 42 11.124 14.695 -8.122 1.00 0.00 H new ATOM 0 HG3 PRO A 42 12.145 14.572 -6.703 1.00 0.00 H new ATOM 0 HD2 PRO A 42 9.883 12.996 -7.140 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.595 13.270 -5.562 1.00 0.00 H new ATOM 692 N ILE A 43 7.513 17.030 -7.913 1.00 0.00 N ATOM 693 CA ILE A 43 6.803 17.379 -9.127 1.00 0.00 C ATOM 694 C ILE A 43 7.772 17.837 -10.212 1.00 0.00 C ATOM 695 O ILE A 43 7.463 17.798 -11.403 1.00 0.00 O ATOM 696 CB ILE A 43 5.782 18.494 -8.828 1.00 0.00 C ATOM 697 CG1 ILE A 43 4.552 17.874 -8.175 1.00 0.00 C ATOM 698 CG2 ILE A 43 5.438 19.275 -10.089 1.00 0.00 C ATOM 699 CD1 ILE A 43 3.352 18.788 -8.147 1.00 0.00 C ATOM 0 H ILE A 43 7.161 17.499 -7.078 1.00 0.00 H new ATOM 0 HA ILE A 43 6.280 16.494 -9.489 1.00 0.00 H new ATOM 0 HB ILE A 43 6.215 19.215 -8.134 1.00 0.00 H new ATOM 0 HG12 ILE A 43 4.289 16.961 -8.710 1.00 0.00 H new ATOM 0 HG13 ILE A 43 4.801 17.585 -7.154 1.00 0.00 H new ATOM 0 HG21 ILE A 43 4.716 20.055 -9.848 1.00 0.00 H new ATOM 0 HG22 ILE A 43 6.342 19.730 -10.493 1.00 0.00 H new ATOM 0 HG23 ILE A 43 5.009 18.600 -10.830 1.00 0.00 H new ATOM 0 HD11 ILE A 43 2.517 18.277 -7.668 1.00 0.00 H new ATOM 0 HD12 ILE A 43 3.595 19.691 -7.587 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.076 19.057 -9.166 1.00 0.00 H new ATOM 711 N GLU A 44 8.937 18.284 -9.776 1.00 0.00 N ATOM 712 CA GLU A 44 9.969 18.775 -10.668 1.00 0.00 C ATOM 713 C GLU A 44 10.761 17.642 -11.327 1.00 0.00 C ATOM 714 O GLU A 44 11.712 17.896 -12.066 1.00 0.00 O ATOM 715 CB GLU A 44 10.889 19.681 -9.864 1.00 0.00 C ATOM 716 CG GLU A 44 11.632 20.705 -10.704 1.00 0.00 C ATOM 717 CD GLU A 44 12.961 21.106 -10.095 1.00 0.00 C ATOM 718 OE1 GLU A 44 13.649 20.225 -9.538 1.00 0.00 O ATOM 719 OE2 GLU A 44 13.313 22.302 -10.173 1.00 0.00 O ATOM 0 H GLU A 44 9.193 18.316 -8.789 1.00 0.00 H new ATOM 0 HA GLU A 44 9.500 19.327 -11.483 1.00 0.00 H new ATOM 0 HB2 GLU A 44 10.300 20.203 -9.109 1.00 0.00 H new ATOM 0 HB3 GLU A 44 11.615 19.066 -9.333 1.00 0.00 H new ATOM 0 HG2 GLU A 44 11.802 20.297 -11.701 1.00 0.00 H new ATOM 0 HG3 GLU A 44 11.009 21.592 -10.824 1.00 0.00 H new ATOM 726 N LEU A 45 10.362 16.398 -11.075 1.00 0.00 N ATOM 727 CA LEU A 45 11.039 15.250 -11.668 1.00 0.00 C ATOM 728 C LEU A 45 10.190 14.651 -12.783 1.00 0.00 C ATOM 729 O LEU A 45 10.706 14.256 -13.829 1.00 0.00 O ATOM 730 CB LEU A 45 11.330 14.187 -10.607 1.00 0.00 C ATOM 731 CG LEU A 45 12.692 14.313 -9.922 1.00 0.00 C ATOM 732 CD1 LEU A 45 12.898 13.178 -8.931 1.00 0.00 C ATOM 733 CD2 LEU A 45 13.807 14.330 -10.956 1.00 0.00 C ATOM 0 H LEU A 45 9.578 16.161 -10.468 1.00 0.00 H new ATOM 0 HA LEU A 45 11.985 15.593 -12.087 1.00 0.00 H new ATOM 0 HB2 LEU A 45 10.552 14.233 -9.845 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.264 13.203 -11.072 1.00 0.00 H new ATOM 0 HG LEU A 45 12.717 15.255 -9.374 1.00 0.00 H new ATOM 0 HD11 LEU A 45 13.872 13.284 -8.454 1.00 0.00 H new ATOM 0 HD12 LEU A 45 12.116 13.211 -8.172 1.00 0.00 H new ATOM 0 HD13 LEU A 45 12.853 12.224 -9.456 1.00 0.00 H new ATOM 0 HD21 LEU A 45 14.769 14.420 -10.452 1.00 0.00 H new ATOM 0 HD22 LEU A 45 13.784 13.404 -11.531 1.00 0.00 H new ATOM 0 HD23 LEU A 45 13.668 15.178 -11.627 1.00 0.00 H new ATOM 745 N LEU A 46 8.883 14.593 -12.552 1.00 0.00 N ATOM 746 CA LEU A 46 7.954 14.050 -13.534 1.00 0.00 C ATOM 747 C LEU A 46 7.171 15.173 -14.209 1.00 0.00 C ATOM 748 O LEU A 46 5.948 15.105 -14.337 1.00 0.00 O ATOM 749 CB LEU A 46 6.994 13.062 -12.866 1.00 0.00 C ATOM 750 CG LEU A 46 7.452 11.602 -12.883 1.00 0.00 C ATOM 751 CD1 LEU A 46 6.951 10.871 -11.647 1.00 0.00 C ATOM 752 CD2 LEU A 46 6.970 10.908 -14.148 1.00 0.00 C ATOM 0 H LEU A 46 8.443 14.917 -11.691 1.00 0.00 H new ATOM 0 HA LEU A 46 8.527 13.522 -14.296 1.00 0.00 H new ATOM 0 HB2 LEU A 46 6.844 13.368 -11.831 1.00 0.00 H new ATOM 0 HB3 LEU A 46 6.025 13.129 -13.361 1.00 0.00 H new ATOM 0 HG LEU A 46 8.542 11.582 -12.874 1.00 0.00 H new ATOM 0 HD11 LEU A 46 7.286 9.834 -11.676 1.00 0.00 H new ATOM 0 HD12 LEU A 46 7.345 11.355 -10.753 1.00 0.00 H new ATOM 0 HD13 LEU A 46 5.862 10.899 -11.624 1.00 0.00 H new ATOM 0 HD21 LEU A 46 7.304 9.871 -14.144 1.00 0.00 H new ATOM 0 HD22 LEU A 46 5.881 10.938 -14.187 1.00 0.00 H new ATOM 0 HD23 LEU A 46 7.379 11.417 -15.021 1.00 0.00 H new ATOM 764 N ASP A 47 7.888 16.209 -14.636 1.00 0.00 N ATOM 765 CA ASP A 47 7.269 17.356 -15.297 1.00 0.00 C ATOM 766 C ASP A 47 6.521 18.216 -14.315 1.00 0.00 C ATOM 767 O ASP A 47 5.524 17.811 -13.718 1.00 0.00 O ATOM 768 CB ASP A 47 6.334 16.916 -16.421 1.00 0.00 C ATOM 769 CG ASP A 47 6.836 15.688 -17.157 1.00 0.00 C ATOM 770 OD1 ASP A 47 7.765 15.827 -17.980 1.00 0.00 O ATOM 771 OD2 ASP A 47 6.299 14.587 -16.910 1.00 0.00 O ATOM 0 H ASP A 47 8.901 16.278 -14.536 1.00 0.00 H new ATOM 0 HA ASP A 47 8.076 17.946 -15.731 1.00 0.00 H new ATOM 0 HB2 ASP A 47 5.348 16.707 -16.006 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.215 17.735 -17.130 1.00 0.00 H new ATOM 776 N LYS A 48 7.030 19.418 -14.172 1.00 0.00 N ATOM 777 CA LYS A 48 6.466 20.402 -13.288 1.00 0.00 C ATOM 778 C LYS A 48 5.162 20.950 -13.859 1.00 0.00 C ATOM 779 O LYS A 48 5.054 22.137 -14.168 1.00 0.00 O ATOM 780 CB LYS A 48 7.492 21.509 -13.112 1.00 0.00 C ATOM 781 CG LYS A 48 8.230 21.450 -11.785 1.00 0.00 C ATOM 782 CD LYS A 48 7.643 22.404 -10.762 1.00 0.00 C ATOM 783 CE LYS A 48 7.618 23.837 -11.273 1.00 0.00 C ATOM 784 NZ LYS A 48 7.717 24.825 -10.163 1.00 0.00 N ATOM 0 H LYS A 48 7.857 19.740 -14.674 1.00 0.00 H new ATOM 0 HA LYS A 48 6.231 19.956 -12.322 1.00 0.00 H new ATOM 0 HB2 LYS A 48 8.217 21.453 -13.924 1.00 0.00 H new ATOM 0 HB3 LYS A 48 6.992 22.474 -13.197 1.00 0.00 H new ATOM 0 HG2 LYS A 48 8.192 20.433 -11.395 1.00 0.00 H new ATOM 0 HG3 LYS A 48 9.281 21.692 -11.944 1.00 0.00 H new ATOM 0 HD2 LYS A 48 6.630 22.090 -10.512 1.00 0.00 H new ATOM 0 HD3 LYS A 48 8.228 22.356 -9.843 1.00 0.00 H new ATOM 0 HE2 LYS A 48 8.443 23.989 -11.969 1.00 0.00 H new ATOM 0 HE3 LYS A 48 6.697 24.008 -11.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 7.696 25.789 -10.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 6.916 24.698 -9.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 8.608 24.679 -9.647 1.00 0.00 H new ATOM 798 N LYS A 49 4.177 20.070 -14.012 1.00 0.00 N ATOM 799 CA LYS A 49 2.886 20.460 -14.562 1.00 0.00 C ATOM 800 C LYS A 49 1.913 19.283 -14.555 1.00 0.00 C ATOM 801 O LYS A 49 1.117 19.118 -15.480 1.00 0.00 O ATOM 802 CB LYS A 49 3.063 20.979 -15.991 1.00 0.00 C ATOM 803 CG LYS A 49 4.026 20.149 -16.829 1.00 0.00 C ATOM 804 CD LYS A 49 3.340 18.929 -17.420 1.00 0.00 C ATOM 805 CE LYS A 49 4.077 18.413 -18.645 1.00 0.00 C ATOM 806 NZ LYS A 49 3.940 16.938 -18.797 1.00 0.00 N ATOM 0 H LYS A 49 4.249 19.084 -13.763 1.00 0.00 H new ATOM 0 HA LYS A 49 2.473 21.252 -13.938 1.00 0.00 H new ATOM 0 HB2 LYS A 49 2.091 20.999 -16.484 1.00 0.00 H new ATOM 0 HB3 LYS A 49 3.422 22.007 -15.953 1.00 0.00 H new ATOM 0 HG2 LYS A 49 4.434 20.763 -17.632 1.00 0.00 H new ATOM 0 HG3 LYS A 49 4.867 19.832 -16.212 1.00 0.00 H new ATOM 0 HD2 LYS A 49 3.286 18.141 -16.668 1.00 0.00 H new ATOM 0 HD3 LYS A 49 2.315 19.182 -17.691 1.00 0.00 H new ATOM 0 HE2 LYS A 49 3.690 18.907 -19.536 1.00 0.00 H new ATOM 0 HE3 LYS A 49 5.133 18.673 -18.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.636 16.594 -19.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 4.107 16.477 -17.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 2.981 16.711 -19.129 1.00 0.00 H new ATOM 820 N ALA A 50 1.985 18.467 -13.509 1.00 0.00 N ATOM 821 CA ALA A 50 1.112 17.305 -13.386 1.00 0.00 C ATOM 822 C ALA A 50 -0.092 17.609 -12.495 1.00 0.00 C ATOM 823 O ALA A 50 0.068 17.987 -11.335 1.00 0.00 O ATOM 824 CB ALA A 50 1.891 16.121 -12.834 1.00 0.00 C ATOM 0 H ALA A 50 2.638 18.588 -12.735 1.00 0.00 H new ATOM 0 HA ALA A 50 0.740 17.055 -14.379 1.00 0.00 H new ATOM 0 HB1 ALA A 50 1.229 15.259 -12.746 1.00 0.00 H new ATOM 0 HB2 ALA A 50 2.713 15.880 -13.508 1.00 0.00 H new ATOM 0 HB3 ALA A 50 2.290 16.374 -11.851 1.00 0.00 H new ATOM 830 N PRO A 51 -1.320 17.445 -13.023 1.00 0.00 N ATOM 831 CA PRO A 51 -2.547 17.704 -12.260 1.00 0.00 C ATOM 832 C PRO A 51 -2.596 16.907 -10.961 1.00 0.00 C ATOM 833 O PRO A 51 -1.752 16.045 -10.718 1.00 0.00 O ATOM 834 CB PRO A 51 -3.664 17.253 -13.206 1.00 0.00 C ATOM 835 CG PRO A 51 -3.066 17.329 -14.568 1.00 0.00 C ATOM 836 CD PRO A 51 -1.611 16.996 -14.398 1.00 0.00 C ATOM 0 HA PRO A 51 -2.625 18.749 -11.960 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -3.993 16.240 -12.975 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.538 17.899 -13.122 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -3.551 16.627 -15.247 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -3.192 18.324 -14.995 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -1.425 15.929 -14.521 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -0.991 17.514 -15.130 1.00 0.00 H new ATOM 844 N SER A 52 -3.591 17.200 -10.129 1.00 0.00 N ATOM 845 CA SER A 52 -3.747 16.509 -8.855 1.00 0.00 C ATOM 846 C SER A 52 -4.575 15.236 -9.022 1.00 0.00 C ATOM 847 O SER A 52 -4.026 14.141 -9.142 1.00 0.00 O ATOM 848 CB SER A 52 -4.401 17.433 -7.825 1.00 0.00 C ATOM 849 OG SER A 52 -4.823 16.708 -6.683 1.00 0.00 O ATOM 0 H SER A 52 -4.300 17.910 -10.314 1.00 0.00 H new ATOM 0 HA SER A 52 -2.756 16.228 -8.498 1.00 0.00 H new ATOM 0 HB2 SER A 52 -3.695 18.208 -7.527 1.00 0.00 H new ATOM 0 HB3 SER A 52 -5.256 17.937 -8.276 1.00 0.00 H new ATOM 0 HG SER A 52 -5.236 17.322 -6.040 1.00 0.00 H new ATOM 855 N HIS A 53 -5.898 15.386 -9.029 1.00 0.00 N ATOM 856 CA HIS A 53 -6.799 14.248 -9.181 1.00 0.00 C ATOM 857 C HIS A 53 -6.618 13.251 -8.037 1.00 0.00 C ATOM 858 O HIS A 53 -7.377 13.261 -7.068 1.00 0.00 O ATOM 859 CB HIS A 53 -6.560 13.557 -10.526 1.00 0.00 C ATOM 860 CG HIS A 53 -7.440 14.067 -11.625 1.00 0.00 C ATOM 861 ND1 HIS A 53 -6.950 14.669 -12.765 1.00 0.00 N ATOM 862 CD2 HIS A 53 -8.788 14.063 -11.755 1.00 0.00 C ATOM 863 CE1 HIS A 53 -7.957 15.013 -13.547 1.00 0.00 C ATOM 864 NE2 HIS A 53 -9.083 14.656 -12.958 1.00 0.00 N ATOM 0 H HIS A 53 -6.369 16.285 -8.931 1.00 0.00 H new ATOM 0 HA HIS A 53 -7.823 14.620 -9.151 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -5.517 13.692 -10.814 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -6.723 12.486 -10.409 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -9.499 13.667 -11.045 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -7.873 15.503 -14.506 1.00 0.00 H new ATOM 0 HE2 HIS A 53 -10.020 14.798 -13.335 1.00 0.00 H new ATOM 873 N LEU A 54 -5.607 12.394 -8.154 1.00 0.00 N ATOM 874 CA LEU A 54 -5.326 11.396 -7.129 1.00 0.00 C ATOM 875 C LEU A 54 -4.088 11.785 -6.327 1.00 0.00 C ATOM 876 O LEU A 54 -4.089 11.729 -5.097 1.00 0.00 O ATOM 877 CB LEU A 54 -5.130 10.021 -7.769 1.00 0.00 C ATOM 878 CG LEU A 54 -5.316 8.831 -6.825 1.00 0.00 C ATOM 879 CD1 LEU A 54 -6.702 8.227 -6.993 1.00 0.00 C ATOM 880 CD2 LEU A 54 -4.243 7.780 -7.070 1.00 0.00 C ATOM 0 H LEU A 54 -4.969 12.372 -8.950 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.177 11.350 -6.450 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -5.831 9.920 -8.597 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -4.127 9.975 -8.193 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.218 9.189 -5.800 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -6.816 7.382 -6.314 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -7.457 8.980 -6.765 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.828 7.886 -8.020 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -4.392 6.942 -6.389 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -4.308 7.427 -8.099 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.259 8.217 -6.897 1.00 0.00 H new ATOM 892 N CYS A 55 -3.038 12.189 -7.035 1.00 0.00 N ATOM 893 CA CYS A 55 -1.793 12.602 -6.396 1.00 0.00 C ATOM 894 C CYS A 55 -1.714 14.126 -6.332 1.00 0.00 C ATOM 895 O CYS A 55 -1.501 14.783 -7.351 1.00 0.00 O ATOM 896 CB CYS A 55 -0.592 12.049 -7.168 1.00 0.00 C ATOM 897 SG CYS A 55 -0.728 10.296 -7.587 1.00 0.00 S ATOM 0 H CYS A 55 -3.025 12.239 -8.054 1.00 0.00 H new ATOM 0 HA CYS A 55 -1.774 12.204 -5.382 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -0.469 12.623 -8.087 1.00 0.00 H new ATOM 0 HB3 CYS A 55 0.309 12.201 -6.574 1.00 0.00 H new ATOM 0 HG CYS A 55 -1.612 9.733 -6.817 1.00 0.00 H new ATOM 903 N PRO A 56 -1.900 14.715 -5.138 1.00 0.00 N ATOM 904 CA PRO A 56 -1.867 16.154 -4.954 1.00 0.00 C ATOM 905 C PRO A 56 -0.510 16.657 -4.476 1.00 0.00 C ATOM 906 O PRO A 56 0.177 15.985 -3.707 1.00 0.00 O ATOM 907 CB PRO A 56 -2.923 16.357 -3.871 1.00 0.00 C ATOM 908 CG PRO A 56 -2.906 15.095 -3.057 1.00 0.00 C ATOM 909 CD PRO A 56 -2.177 14.040 -3.863 1.00 0.00 C ATOM 0 HA PRO A 56 -2.048 16.700 -5.880 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -2.692 17.226 -3.254 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -3.906 16.529 -4.308 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -2.406 15.261 -2.103 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -3.922 14.771 -2.832 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -1.259 13.721 -3.370 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -2.789 13.149 -4.005 1.00 0.00 H new ATOM 917 N THR A 57 -0.139 17.849 -4.925 1.00 0.00 N ATOM 918 CA THR A 57 1.127 18.451 -4.532 1.00 0.00 C ATOM 919 C THR A 57 1.090 18.901 -3.110 1.00 0.00 C ATOM 920 O THR A 57 0.028 19.020 -2.500 1.00 0.00 O ATOM 921 CB THR A 57 1.507 19.657 -5.383 1.00 0.00 C ATOM 922 OG1 THR A 57 2.911 19.694 -5.594 1.00 0.00 O ATOM 923 CG2 THR A 57 1.105 20.988 -4.760 1.00 0.00 C ATOM 0 H THR A 57 -0.697 18.418 -5.562 1.00 0.00 H new ATOM 0 HA THR A 57 1.871 17.667 -4.676 1.00 0.00 H new ATOM 0 HB THR A 57 0.963 19.533 -6.319 1.00 0.00 H new ATOM 0 HG1 THR A 57 3.339 18.981 -5.075 1.00 0.00 H new ATOM 0 HG21 THR A 57 1.405 21.803 -5.418 1.00 0.00 H new ATOM 0 HG22 THR A 57 0.024 21.013 -4.621 1.00 0.00 H new ATOM 0 HG23 THR A 57 1.597 21.101 -3.794 1.00 0.00 H new ATOM 931 N ILE A 58 2.264 19.193 -2.601 1.00 0.00 N ATOM 932 CA ILE A 58 2.362 19.683 -1.258 1.00 0.00 C ATOM 933 C ILE A 58 3.051 21.034 -1.198 1.00 0.00 C ATOM 934 O ILE A 58 4.049 21.268 -1.880 1.00 0.00 O ATOM 935 CB ILE A 58 3.035 18.680 -0.316 1.00 0.00 C ATOM 936 CG1 ILE A 58 2.463 17.276 -0.604 1.00 0.00 C ATOM 937 CG2 ILE A 58 2.837 19.139 1.120 1.00 0.00 C ATOM 938 CD1 ILE A 58 2.015 16.495 0.606 1.00 0.00 C ATOM 0 H ILE A 58 3.152 19.099 -3.095 1.00 0.00 H new ATOM 0 HA ILE A 58 1.338 19.815 -0.907 1.00 0.00 H new ATOM 0 HB ILE A 58 4.111 18.626 -0.479 1.00 0.00 H new ATOM 0 HG12 ILE A 58 1.615 17.380 -1.281 1.00 0.00 H new ATOM 0 HG13 ILE A 58 3.221 16.695 -1.129 1.00 0.00 H new ATOM 0 HG21 ILE A 58 3.313 18.430 1.797 1.00 0.00 H new ATOM 0 HG22 ILE A 58 3.285 20.124 1.252 1.00 0.00 H new ATOM 0 HG23 ILE A 58 1.771 19.192 1.341 1.00 0.00 H new ATOM 0 HD11 ILE A 58 1.631 15.525 0.291 1.00 0.00 H new ATOM 0 HD12 ILE A 58 2.860 16.350 1.279 1.00 0.00 H new ATOM 0 HD13 ILE A 58 1.230 17.045 1.124 1.00 0.00 H new ATOM 950 N HIS A 59 2.507 21.926 -0.372 1.00 0.00 N ATOM 951 CA HIS A 59 3.067 23.251 -0.223 1.00 0.00 C ATOM 952 C HIS A 59 3.730 23.376 1.124 1.00 0.00 C ATOM 953 O HIS A 59 3.148 23.855 2.097 1.00 0.00 O ATOM 954 CB HIS A 59 2.002 24.323 -0.369 1.00 0.00 C ATOM 955 CG HIS A 59 1.036 24.072 -1.486 1.00 0.00 C ATOM 956 ND1 HIS A 59 -0.317 24.004 -1.489 1.00 0.00 N flip ATOM 957 CD2 HIS A 59 1.431 23.853 -2.789 1.00 0.00 C flip ATOM 958 CE1 HIS A 59 -0.708 23.749 -2.780 1.00 0.00 C flip ATOM 959 NE2 HIS A 59 0.365 23.663 -3.545 1.00 0.00 N flip ATOM 0 H HIS A 59 1.681 21.748 0.199 1.00 0.00 H new ATOM 0 HA HIS A 59 3.804 23.395 -1.013 1.00 0.00 H new ATOM 0 HB2 HIS A 59 1.448 24.401 0.567 1.00 0.00 H new ATOM 0 HB3 HIS A 59 2.489 25.285 -0.532 1.00 0.00 H new ATOM 0 HD1 HIS A 59 -0.931 24.121 -0.683 1.00 0.00 H new ATOM 0 HD2 HIS A 59 2.453 23.839 -3.137 1.00 0.00 H new ATOM 0 HE1 HIS A 59 -1.728 23.637 -3.116 1.00 0.00 H new ATOM 968 N ILE A 60 4.955 22.930 1.148 1.00 0.00 N ATOM 969 CA ILE A 60 5.770 22.953 2.344 1.00 0.00 C ATOM 970 C ILE A 60 7.057 23.742 2.096 1.00 0.00 C ATOM 971 O ILE A 60 7.191 24.407 1.069 1.00 0.00 O ATOM 972 CB ILE A 60 6.091 21.516 2.802 1.00 0.00 C ATOM 973 CG1 ILE A 60 6.995 20.815 1.786 1.00 0.00 C ATOM 974 CG2 ILE A 60 4.795 20.730 2.986 1.00 0.00 C ATOM 975 CD1 ILE A 60 8.109 20.021 2.426 1.00 0.00 C ATOM 0 H ILE A 60 5.426 22.535 0.334 1.00 0.00 H new ATOM 0 HA ILE A 60 5.212 23.449 3.138 1.00 0.00 H new ATOM 0 HB ILE A 60 6.619 21.563 3.754 1.00 0.00 H new ATOM 0 HG12 ILE A 60 6.390 20.149 1.171 1.00 0.00 H new ATOM 0 HG13 ILE A 60 7.427 21.561 1.119 1.00 0.00 H new ATOM 0 HG21 ILE A 60 5.028 19.715 3.310 1.00 0.00 H new ATOM 0 HG22 ILE A 60 4.177 21.219 3.739 1.00 0.00 H new ATOM 0 HG23 ILE A 60 4.254 20.694 2.040 1.00 0.00 H new ATOM 0 HD11 ILE A 60 8.712 19.550 1.650 1.00 0.00 H new ATOM 0 HD12 ILE A 60 8.736 20.687 3.019 1.00 0.00 H new ATOM 0 HD13 ILE A 60 7.684 19.253 3.072 1.00 0.00 H new ATOM 987 N ASP A 61 7.991 23.681 3.036 1.00 0.00 N ATOM 988 CA ASP A 61 9.249 24.413 2.901 1.00 0.00 C ATOM 989 C ASP A 61 10.169 23.774 1.866 1.00 0.00 C ATOM 990 O ASP A 61 10.689 24.454 0.981 1.00 0.00 O ATOM 991 CB ASP A 61 9.962 24.499 4.251 1.00 0.00 C ATOM 992 CG ASP A 61 9.426 25.622 5.117 1.00 0.00 C ATOM 993 OD1 ASP A 61 8.228 25.953 4.986 1.00 0.00 O ATOM 994 OD2 ASP A 61 10.203 26.171 5.926 1.00 0.00 O ATOM 0 H ASP A 61 7.905 23.137 3.895 1.00 0.00 H new ATOM 0 HA ASP A 61 9.006 25.418 2.556 1.00 0.00 H new ATOM 0 HB2 ASP A 61 9.850 23.552 4.779 1.00 0.00 H new ATOM 0 HB3 ASP A 61 11.029 24.648 4.086 1.00 0.00 H new ATOM 999 N GLU A 62 10.373 22.470 1.985 1.00 0.00 N ATOM 1000 CA GLU A 62 11.241 21.740 1.065 1.00 0.00 C ATOM 1001 C GLU A 62 10.859 21.989 -0.399 1.00 0.00 C ATOM 1002 O GLU A 62 11.664 21.751 -1.299 1.00 0.00 O ATOM 1003 CB GLU A 62 11.202 20.242 1.375 1.00 0.00 C ATOM 1004 CG GLU A 62 12.537 19.541 1.178 1.00 0.00 C ATOM 1005 CD GLU A 62 13.054 19.652 -0.242 1.00 0.00 C ATOM 1006 OE1 GLU A 62 13.753 20.642 -0.544 1.00 0.00 O ATOM 1007 OE2 GLU A 62 12.763 18.747 -1.053 1.00 0.00 O ATOM 0 H GLU A 62 9.949 21.892 2.711 1.00 0.00 H new ATOM 0 HA GLU A 62 12.256 22.110 1.208 1.00 0.00 H new ATOM 0 HB2 GLU A 62 10.877 20.102 2.406 1.00 0.00 H new ATOM 0 HB3 GLU A 62 10.455 19.768 0.738 1.00 0.00 H new ATOM 0 HG2 GLU A 62 13.271 19.968 1.862 1.00 0.00 H new ATOM 0 HG3 GLU A 62 12.432 18.488 1.440 1.00 0.00 H new ATOM 1014 N GLY A 63 9.641 22.480 -0.639 1.00 0.00 N ATOM 1015 CA GLY A 63 9.218 22.754 -2.007 1.00 0.00 C ATOM 1016 C GLY A 63 7.972 21.989 -2.424 1.00 0.00 C ATOM 1017 O GLY A 63 7.218 21.503 -1.580 1.00 0.00 O ATOM 0 H GLY A 63 8.948 22.691 0.079 1.00 0.00 H new ATOM 0 HA2 GLY A 63 9.031 23.823 -2.113 1.00 0.00 H new ATOM 0 HA3 GLY A 63 10.032 22.504 -2.687 1.00 0.00 H new ATOM 1021 N ASP A 64 7.755 21.893 -3.738 1.00 0.00 N ATOM 1022 CA ASP A 64 6.591 21.196 -4.287 1.00 0.00 C ATOM 1023 C ASP A 64 6.867 19.704 -4.462 1.00 0.00 C ATOM 1024 O ASP A 64 7.961 19.308 -4.861 1.00 0.00 O ATOM 1025 CB ASP A 64 6.191 21.811 -5.629 1.00 0.00 C ATOM 1026 CG ASP A 64 5.358 23.067 -5.463 1.00 0.00 C ATOM 1027 OD1 ASP A 64 4.164 22.947 -5.117 1.00 0.00 O ATOM 1028 OD2 ASP A 64 5.900 24.172 -5.679 1.00 0.00 O ATOM 0 H ASP A 64 8.374 22.292 -4.444 1.00 0.00 H new ATOM 0 HA ASP A 64 5.770 21.309 -3.578 1.00 0.00 H new ATOM 0 HB2 ASP A 64 7.089 22.047 -6.200 1.00 0.00 H new ATOM 0 HB3 ASP A 64 5.628 21.079 -6.208 1.00 0.00 H new ATOM 1033 N PHE A 65 5.863 18.887 -4.153 1.00 0.00 N ATOM 1034 CA PHE A 65 5.976 17.432 -4.254 1.00 0.00 C ATOM 1035 C PHE A 65 4.632 16.822 -4.634 1.00 0.00 C ATOM 1036 O PHE A 65 3.697 17.552 -4.937 1.00 0.00 O ATOM 1037 CB PHE A 65 6.487 16.869 -2.934 1.00 0.00 C ATOM 1038 CG PHE A 65 7.677 17.628 -2.429 1.00 0.00 C ATOM 1039 CD1 PHE A 65 8.874 17.588 -3.122 1.00 0.00 C ATOM 1040 CD2 PHE A 65 7.592 18.405 -1.288 1.00 0.00 C ATOM 1041 CE1 PHE A 65 9.966 18.311 -2.688 1.00 0.00 C ATOM 1042 CE2 PHE A 65 8.683 19.126 -0.844 1.00 0.00 C ATOM 1043 CZ PHE A 65 9.872 19.080 -1.546 1.00 0.00 C ATOM 0 H PHE A 65 4.952 19.211 -3.827 1.00 0.00 H new ATOM 0 HA PHE A 65 6.688 17.175 -5.038 1.00 0.00 H new ATOM 0 HB2 PHE A 65 5.691 16.905 -2.191 1.00 0.00 H new ATOM 0 HB3 PHE A 65 6.753 15.820 -3.065 1.00 0.00 H new ATOM 0 HD1 PHE A 65 8.954 16.984 -4.013 1.00 0.00 H new ATOM 0 HD2 PHE A 65 6.663 18.448 -0.739 1.00 0.00 H new ATOM 0 HE1 PHE A 65 10.893 18.275 -3.241 1.00 0.00 H new ATOM 0 HE2 PHE A 65 8.607 19.725 0.051 1.00 0.00 H new ATOM 0 HZ PHE A 65 10.726 19.645 -1.202 1.00 0.00 H new ATOM 1053 N ILE A 66 4.525 15.491 -4.638 1.00 0.00 N ATOM 1054 CA ILE A 66 3.265 14.852 -5.006 1.00 0.00 C ATOM 1055 C ILE A 66 3.138 13.459 -4.412 1.00 0.00 C ATOM 1056 O ILE A 66 3.925 12.566 -4.719 1.00 0.00 O ATOM 1057 CB ILE A 66 3.078 14.757 -6.540 1.00 0.00 C ATOM 1058 CG1 ILE A 66 4.428 14.764 -7.255 1.00 0.00 C ATOM 1059 CG2 ILE A 66 2.199 15.893 -7.042 1.00 0.00 C ATOM 1060 CD1 ILE A 66 5.349 13.666 -6.793 1.00 0.00 C ATOM 0 H ILE A 66 5.279 14.849 -4.396 1.00 0.00 H new ATOM 0 HA ILE A 66 2.485 15.492 -4.594 1.00 0.00 H new ATOM 0 HB ILE A 66 2.582 13.813 -6.764 1.00 0.00 H new ATOM 0 HG12 ILE A 66 4.264 14.665 -8.328 1.00 0.00 H new ATOM 0 HG13 ILE A 66 4.912 15.727 -7.094 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.079 15.810 -8.122 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.222 15.836 -6.563 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.666 16.848 -6.801 1.00 0.00 H new ATOM 0 HD11 ILE A 66 6.290 13.727 -7.339 1.00 0.00 H new ATOM 0 HD12 ILE A 66 5.541 13.777 -5.726 1.00 0.00 H new ATOM 0 HD13 ILE A 66 4.883 12.698 -6.979 1.00 0.00 H new ATOM 1072 N MET A 67 2.127 13.267 -3.575 1.00 0.00 N ATOM 1073 CA MET A 67 1.900 11.967 -2.968 1.00 0.00 C ATOM 1074 C MET A 67 1.613 10.941 -4.050 1.00 0.00 C ATOM 1075 O MET A 67 0.570 10.990 -4.702 1.00 0.00 O ATOM 1076 CB MET A 67 0.729 12.029 -1.990 1.00 0.00 C ATOM 1077 CG MET A 67 1.032 12.814 -0.730 1.00 0.00 C ATOM 1078 SD MET A 67 -0.304 12.726 0.474 1.00 0.00 S ATOM 1079 CE MET A 67 -1.560 13.699 -0.349 1.00 0.00 C ATOM 0 H MET A 67 1.458 13.988 -3.304 1.00 0.00 H new ATOM 0 HA MET A 67 2.796 11.676 -2.419 1.00 0.00 H new ATOM 0 HB2 MET A 67 -0.128 12.479 -2.491 1.00 0.00 H new ATOM 0 HB3 MET A 67 0.442 11.014 -1.715 1.00 0.00 H new ATOM 0 HG2 MET A 67 1.949 12.433 -0.280 1.00 0.00 H new ATOM 0 HG3 MET A 67 1.214 13.857 -0.990 1.00 0.00 H new ATOM 0 HE1 MET A 67 -1.902 14.490 0.318 1.00 0.00 H new ATOM 0 HE2 MET A 67 -1.143 14.142 -1.253 1.00 0.00 H new ATOM 0 HE3 MET A 67 -2.401 13.058 -0.614 1.00 0.00 H new ATOM 1089 N LEU A 68 2.540 10.017 -4.245 1.00 0.00 N ATOM 1090 CA LEU A 68 2.367 8.990 -5.262 1.00 0.00 C ATOM 1091 C LEU A 68 1.356 7.945 -4.792 1.00 0.00 C ATOM 1092 O LEU A 68 1.726 6.850 -4.368 1.00 0.00 O ATOM 1093 CB LEU A 68 3.714 8.339 -5.605 1.00 0.00 C ATOM 1094 CG LEU A 68 3.868 7.897 -7.063 1.00 0.00 C ATOM 1095 CD1 LEU A 68 4.807 8.837 -7.807 1.00 0.00 C ATOM 1096 CD2 LEU A 68 4.377 6.465 -7.138 1.00 0.00 C ATOM 0 H LEU A 68 3.412 9.956 -3.719 1.00 0.00 H new ATOM 0 HA LEU A 68 1.979 9.456 -6.168 1.00 0.00 H new ATOM 0 HB2 LEU A 68 4.511 9.044 -5.369 1.00 0.00 H new ATOM 0 HB3 LEU A 68 3.855 7.471 -4.961 1.00 0.00 H new ATOM 0 HG LEU A 68 2.889 7.937 -7.540 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.906 8.509 -8.842 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.402 9.849 -7.784 1.00 0.00 H new ATOM 0 HD13 LEU A 68 5.786 8.827 -7.328 1.00 0.00 H new ATOM 0 HD21 LEU A 68 4.480 6.170 -8.182 1.00 0.00 H new ATOM 0 HD22 LEU A 68 5.347 6.397 -6.645 1.00 0.00 H new ATOM 0 HD23 LEU A 68 3.670 5.801 -6.641 1.00 0.00 H new ATOM 1108 N THR A 69 0.073 8.303 -4.872 1.00 0.00 N ATOM 1109 CA THR A 69 -1.012 7.415 -4.457 1.00 0.00 C ATOM 1110 C THR A 69 -1.173 6.246 -5.430 1.00 0.00 C ATOM 1111 O THR A 69 -1.875 5.278 -5.137 1.00 0.00 O ATOM 1112 CB THR A 69 -2.333 8.192 -4.372 1.00 0.00 C ATOM 1113 OG1 THR A 69 -2.365 9.227 -5.339 1.00 0.00 O ATOM 1114 CG2 THR A 69 -2.591 8.828 -3.017 1.00 0.00 C ATOM 0 H THR A 69 -0.240 9.208 -5.223 1.00 0.00 H new ATOM 0 HA THR A 69 -0.758 7.018 -3.474 1.00 0.00 H new ATOM 0 HB THR A 69 -3.108 7.446 -4.551 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.860 9.993 -4.982 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.543 9.358 -3.039 1.00 0.00 H new ATOM 0 HG22 THR A 69 -2.625 8.053 -2.252 1.00 0.00 H new ATOM 0 HG23 THR A 69 -1.790 9.531 -2.786 1.00 0.00 H new ATOM 1122 N GLN A 70 -0.527 6.344 -6.590 1.00 0.00 N ATOM 1123 CA GLN A 70 -0.611 5.298 -7.605 1.00 0.00 C ATOM 1124 C GLN A 70 0.208 4.064 -7.224 1.00 0.00 C ATOM 1125 O GLN A 70 0.196 3.062 -7.939 1.00 0.00 O ATOM 1126 CB GLN A 70 -0.136 5.836 -8.956 1.00 0.00 C ATOM 1127 CG GLN A 70 1.205 6.549 -8.889 1.00 0.00 C ATOM 1128 CD GLN A 70 2.082 6.255 -10.090 1.00 0.00 C ATOM 1129 OE1 GLN A 70 2.297 5.097 -10.448 1.00 0.00 O ATOM 1130 NE2 GLN A 70 2.594 7.306 -10.720 1.00 0.00 N ATOM 0 H GLN A 70 0.060 7.137 -6.850 1.00 0.00 H new ATOM 0 HA GLN A 70 -1.656 4.996 -7.676 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -0.063 5.009 -9.662 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -0.885 6.524 -9.347 1.00 0.00 H new ATOM 0 HG2 GLN A 70 1.038 7.624 -8.820 1.00 0.00 H new ATOM 0 HG3 GLN A 70 1.727 6.249 -7.980 1.00 0.00 H new ATOM 0 HE21 GLN A 70 2.389 8.249 -10.389 1.00 0.00 H new ATOM 0 HE22 GLN A 70 3.192 7.170 -11.535 1.00 0.00 H new ATOM 1139 N GLN A 71 0.917 4.133 -6.099 1.00 0.00 N ATOM 1140 CA GLN A 71 1.730 3.011 -5.645 1.00 0.00 C ATOM 1141 C GLN A 71 1.366 2.628 -4.219 1.00 0.00 C ATOM 1142 O GLN A 71 0.801 1.562 -3.979 1.00 0.00 O ATOM 1143 CB GLN A 71 3.217 3.360 -5.732 1.00 0.00 C ATOM 1144 CG GLN A 71 4.135 2.180 -5.458 1.00 0.00 C ATOM 1145 CD GLN A 71 5.603 2.546 -5.570 1.00 0.00 C ATOM 1146 OE1 GLN A 71 5.959 3.549 -6.188 1.00 0.00 O ATOM 1147 NE2 GLN A 71 6.463 1.730 -4.972 1.00 0.00 N ATOM 0 H GLN A 71 0.944 4.950 -5.489 1.00 0.00 H new ATOM 0 HA GLN A 71 1.530 2.159 -6.295 1.00 0.00 H new ATOM 0 HB2 GLN A 71 3.432 3.754 -6.725 1.00 0.00 H new ATOM 0 HB3 GLN A 71 3.438 4.155 -5.019 1.00 0.00 H new ATOM 0 HG2 GLN A 71 3.936 1.794 -4.458 1.00 0.00 H new ATOM 0 HG3 GLN A 71 3.909 1.378 -6.161 1.00 0.00 H new ATOM 0 HE21 GLN A 71 6.123 0.909 -4.470 1.00 0.00 H new ATOM 0 HE22 GLN A 71 7.464 1.924 -5.014 1.00 0.00 H new ATOM 1156 N MET A 72 1.688 3.504 -3.274 1.00 0.00 N ATOM 1157 CA MET A 72 1.389 3.254 -1.871 1.00 0.00 C ATOM 1158 C MET A 72 1.995 1.930 -1.412 1.00 0.00 C ATOM 1159 O MET A 72 1.512 0.856 -1.769 1.00 0.00 O ATOM 1160 CB MET A 72 -0.122 3.247 -1.649 1.00 0.00 C ATOM 1161 CG MET A 72 -0.518 3.454 -0.197 1.00 0.00 C ATOM 1162 SD MET A 72 -1.910 2.420 0.299 1.00 0.00 S ATOM 1163 CE MET A 72 -3.141 2.910 -0.906 1.00 0.00 C ATOM 0 H MET A 72 2.156 4.392 -3.455 1.00 0.00 H new ATOM 0 HA MET A 72 1.832 4.055 -1.279 1.00 0.00 H new ATOM 0 HB2 MET A 72 -0.575 4.030 -2.257 1.00 0.00 H new ATOM 0 HB3 MET A 72 -0.529 2.298 -1.997 1.00 0.00 H new ATOM 0 HG2 MET A 72 0.337 3.237 0.443 1.00 0.00 H new ATOM 0 HG3 MET A 72 -0.775 4.502 -0.041 1.00 0.00 H new ATOM 0 HE1 MET A 72 -4.126 2.585 -0.572 1.00 0.00 H new ATOM 0 HE2 MET A 72 -3.133 3.995 -1.014 1.00 0.00 H new ATOM 0 HE3 MET A 72 -2.913 2.449 -1.867 1.00 0.00 H new ATOM 1173 N THR A 73 3.057 2.018 -0.623 1.00 0.00 N ATOM 1174 CA THR A 73 3.738 0.831 -0.118 1.00 0.00 C ATOM 1175 C THR A 73 4.165 1.027 1.332 1.00 0.00 C ATOM 1176 O THR A 73 4.704 2.072 1.690 1.00 0.00 O ATOM 1177 CB THR A 73 4.959 0.515 -0.985 1.00 0.00 C ATOM 1178 OG1 THR A 73 5.831 -0.381 -0.318 1.00 0.00 O ATOM 1179 CG2 THR A 73 5.763 1.744 -1.360 1.00 0.00 C ATOM 0 H THR A 73 3.467 2.900 -0.318 1.00 0.00 H new ATOM 0 HA THR A 73 3.042 -0.007 -0.162 1.00 0.00 H new ATOM 0 HB THR A 73 4.558 0.071 -1.896 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.604 -0.571 -0.889 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.614 1.449 -1.974 1.00 0.00 H new ATOM 0 HG22 THR A 73 5.133 2.434 -1.921 1.00 0.00 H new ATOM 0 HG23 THR A 73 6.122 2.234 -0.455 1.00 0.00 H new ATOM 1187 N SER A 74 3.921 0.018 2.163 1.00 0.00 N ATOM 1188 CA SER A 74 4.281 0.094 3.574 1.00 0.00 C ATOM 1189 C SER A 74 5.792 0.035 3.759 1.00 0.00 C ATOM 1190 O SER A 74 6.428 -0.977 3.464 1.00 0.00 O ATOM 1191 CB SER A 74 3.606 -1.034 4.362 1.00 0.00 C ATOM 1192 OG SER A 74 4.471 -2.147 4.511 1.00 0.00 O ATOM 0 H SER A 74 3.478 -0.858 1.885 1.00 0.00 H new ATOM 0 HA SER A 74 3.928 1.051 3.958 1.00 0.00 H new ATOM 0 HB2 SER A 74 3.309 -0.667 5.345 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.695 -1.344 3.849 1.00 0.00 H new ATOM 0 HG SER A 74 5.191 -2.093 3.848 1.00 0.00 H new ATOM 1198 N VAL A 75 6.356 1.129 4.258 1.00 0.00 N ATOM 1199 CA VAL A 75 7.790 1.211 4.496 1.00 0.00 C ATOM 1200 C VAL A 75 8.110 0.879 5.954 1.00 0.00 C ATOM 1201 O VAL A 75 7.807 1.657 6.858 1.00 0.00 O ATOM 1202 CB VAL A 75 8.343 2.611 4.147 1.00 0.00 C ATOM 1203 CG1 VAL A 75 7.467 3.705 4.736 1.00 0.00 C ATOM 1204 CG2 VAL A 75 9.776 2.762 4.622 1.00 0.00 C ATOM 0 H VAL A 75 5.839 1.973 4.506 1.00 0.00 H new ATOM 0 HA VAL A 75 8.272 0.481 3.845 1.00 0.00 H new ATOM 0 HB VAL A 75 8.331 2.713 3.062 1.00 0.00 H new ATOM 0 HG11 VAL A 75 7.878 4.680 4.476 1.00 0.00 H new ATOM 0 HG12 VAL A 75 6.457 3.618 4.335 1.00 0.00 H new ATOM 0 HG13 VAL A 75 7.436 3.602 5.821 1.00 0.00 H new ATOM 0 HG21 VAL A 75 10.142 3.756 4.364 1.00 0.00 H new ATOM 0 HG22 VAL A 75 9.817 2.629 5.703 1.00 0.00 H new ATOM 0 HG23 VAL A 75 10.400 2.009 4.140 1.00 0.00 H new ATOM 1214 N PRO A 76 8.724 -0.291 6.202 1.00 0.00 N ATOM 1215 CA PRO A 76 9.077 -0.728 7.556 1.00 0.00 C ATOM 1216 C PRO A 76 9.767 0.361 8.370 1.00 0.00 C ATOM 1217 O PRO A 76 10.666 1.045 7.879 1.00 0.00 O ATOM 1218 CB PRO A 76 10.028 -1.897 7.304 1.00 0.00 C ATOM 1219 CG PRO A 76 9.581 -2.460 6.001 1.00 0.00 C ATOM 1220 CD PRO A 76 9.116 -1.285 5.184 1.00 0.00 C ATOM 0 HA PRO A 76 8.196 -0.989 8.142 1.00 0.00 H new ATOM 0 HB2 PRO A 76 11.065 -1.564 7.259 1.00 0.00 H new ATOM 0 HB3 PRO A 76 9.966 -2.639 8.100 1.00 0.00 H new ATOM 0 HG2 PRO A 76 10.395 -2.985 5.502 1.00 0.00 H new ATOM 0 HG3 PRO A 76 8.776 -3.181 6.142 1.00 0.00 H new ATOM 0 HD2 PRO A 76 9.908 -0.907 4.538 1.00 0.00 H new ATOM 0 HD3 PRO A 76 8.278 -1.551 4.539 1.00 0.00 H new ATOM 1228 N VAL A 77 9.328 0.511 9.620 1.00 0.00 N ATOM 1229 CA VAL A 77 9.875 1.511 10.544 1.00 0.00 C ATOM 1230 C VAL A 77 11.355 1.804 10.287 1.00 0.00 C ATOM 1231 O VAL A 77 11.763 2.965 10.227 1.00 0.00 O ATOM 1232 CB VAL A 77 9.712 1.053 12.008 1.00 0.00 C ATOM 1233 CG1 VAL A 77 10.401 -0.286 12.227 1.00 0.00 C ATOM 1234 CG2 VAL A 77 10.258 2.101 12.968 1.00 0.00 C ATOM 0 H VAL A 77 8.583 -0.057 10.023 1.00 0.00 H new ATOM 0 HA VAL A 77 9.308 2.425 10.368 1.00 0.00 H new ATOM 0 HB VAL A 77 8.648 0.931 12.211 1.00 0.00 H new ATOM 0 HG11 VAL A 77 10.276 -0.594 13.265 1.00 0.00 H new ATOM 0 HG12 VAL A 77 9.958 -1.035 11.570 1.00 0.00 H new ATOM 0 HG13 VAL A 77 11.463 -0.190 12.003 1.00 0.00 H new ATOM 0 HG21 VAL A 77 10.132 1.755 13.994 1.00 0.00 H new ATOM 0 HG22 VAL A 77 11.317 2.262 12.767 1.00 0.00 H new ATOM 0 HG23 VAL A 77 9.716 3.037 12.831 1.00 0.00 H new ATOM 1244 N LYS A 78 12.156 0.749 10.147 1.00 0.00 N ATOM 1245 CA LYS A 78 13.597 0.904 9.908 1.00 0.00 C ATOM 1246 C LYS A 78 13.863 1.945 8.842 1.00 0.00 C ATOM 1247 O LYS A 78 14.554 2.940 9.061 1.00 0.00 O ATOM 1248 CB LYS A 78 14.245 -0.395 9.434 1.00 0.00 C ATOM 1249 CG LYS A 78 13.255 -1.434 8.975 1.00 0.00 C ATOM 1250 CD LYS A 78 12.710 -2.208 10.160 1.00 0.00 C ATOM 1251 CE LYS A 78 13.427 -3.537 10.343 1.00 0.00 C ATOM 1252 NZ LYS A 78 12.500 -4.693 10.196 1.00 0.00 N ATOM 0 H LYS A 78 11.838 -0.219 10.194 1.00 0.00 H new ATOM 0 HA LYS A 78 14.025 1.205 10.864 1.00 0.00 H new ATOM 0 HB2 LYS A 78 14.929 -0.172 8.616 1.00 0.00 H new ATOM 0 HB3 LYS A 78 14.843 -0.809 10.246 1.00 0.00 H new ATOM 0 HG2 LYS A 78 12.436 -0.953 8.439 1.00 0.00 H new ATOM 0 HG3 LYS A 78 13.735 -2.118 8.276 1.00 0.00 H new ATOM 0 HD2 LYS A 78 12.816 -1.610 11.065 1.00 0.00 H new ATOM 0 HD3 LYS A 78 11.644 -2.386 10.019 1.00 0.00 H new ATOM 0 HE2 LYS A 78 14.230 -3.620 9.611 1.00 0.00 H new ATOM 0 HE3 LYS A 78 13.891 -3.567 11.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 13.027 -5.580 10.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 11.748 -4.628 10.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 12.077 -4.680 9.246 1.00 0.00 H new ATOM 1266 N ILE A 79 13.313 1.667 7.674 1.00 0.00 N ATOM 1267 CA ILE A 79 13.469 2.515 6.517 1.00 0.00 C ATOM 1268 C ILE A 79 12.354 3.573 6.435 1.00 0.00 C ATOM 1269 O ILE A 79 12.029 4.073 5.362 1.00 0.00 O ATOM 1270 CB ILE A 79 13.561 1.664 5.237 1.00 0.00 C ATOM 1271 CG1 ILE A 79 13.650 2.572 3.993 1.00 0.00 C ATOM 1272 CG2 ILE A 79 12.397 0.678 5.185 1.00 0.00 C ATOM 1273 CD1 ILE A 79 12.727 2.182 2.879 1.00 0.00 C ATOM 0 H ILE A 79 12.742 0.839 7.505 1.00 0.00 H new ATOM 0 HA ILE A 79 14.405 3.064 6.617 1.00 0.00 H new ATOM 0 HB ILE A 79 14.476 1.071 5.248 1.00 0.00 H new ATOM 0 HG12 ILE A 79 13.430 3.598 4.289 1.00 0.00 H new ATOM 0 HG13 ILE A 79 14.675 2.560 3.621 1.00 0.00 H new ATOM 0 HG21 ILE A 79 12.468 0.079 4.277 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.436 0.023 6.056 1.00 0.00 H new ATOM 0 HG23 ILE A 79 11.455 1.227 5.185 1.00 0.00 H new ATOM 0 HD11 ILE A 79 12.853 2.871 2.044 1.00 0.00 H new ATOM 0 HD12 ILE A 79 12.960 1.169 2.552 1.00 0.00 H new ATOM 0 HD13 ILE A 79 11.696 2.222 3.230 1.00 0.00 H new ATOM 1285 N LEU A 80 11.769 3.909 7.587 1.00 0.00 N ATOM 1286 CA LEU A 80 10.695 4.908 7.664 1.00 0.00 C ATOM 1287 C LEU A 80 11.174 6.307 7.307 1.00 0.00 C ATOM 1288 O LEU A 80 10.907 7.272 8.022 1.00 0.00 O ATOM 1289 CB LEU A 80 10.086 4.911 9.064 1.00 0.00 C ATOM 1290 CG LEU A 80 8.948 5.909 9.284 1.00 0.00 C ATOM 1291 CD1 LEU A 80 8.080 6.038 8.034 1.00 0.00 C ATOM 1292 CD2 LEU A 80 8.113 5.479 10.479 1.00 0.00 C ATOM 0 H LEU A 80 12.022 3.501 8.487 1.00 0.00 H new ATOM 0 HA LEU A 80 9.940 4.626 6.930 1.00 0.00 H new ATOM 0 HB2 LEU A 80 9.715 3.910 9.282 1.00 0.00 H new ATOM 0 HB3 LEU A 80 10.876 5.122 9.785 1.00 0.00 H new ATOM 0 HG LEU A 80 9.379 6.890 9.487 1.00 0.00 H new ATOM 0 HD11 LEU A 80 7.279 6.754 8.219 1.00 0.00 H new ATOM 0 HD12 LEU A 80 8.691 6.385 7.201 1.00 0.00 H new ATOM 0 HD13 LEU A 80 7.649 5.067 7.788 1.00 0.00 H new ATOM 0 HD21 LEU A 80 7.303 6.192 10.633 1.00 0.00 H new ATOM 0 HD22 LEU A 80 7.695 4.490 10.294 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.741 5.446 11.369 1.00 0.00 H new ATOM 1304 N SER A 81 11.824 6.417 6.163 1.00 0.00 N ATOM 1305 CA SER A 81 12.278 7.695 5.662 1.00 0.00 C ATOM 1306 C SER A 81 13.150 8.475 6.642 1.00 0.00 C ATOM 1307 O SER A 81 12.950 8.433 7.853 1.00 0.00 O ATOM 1308 CB SER A 81 11.061 8.533 5.309 1.00 0.00 C ATOM 1309 OG SER A 81 11.167 9.840 5.849 1.00 0.00 O ATOM 0 H SER A 81 12.050 5.626 5.560 1.00 0.00 H new ATOM 0 HA SER A 81 12.903 7.490 4.793 1.00 0.00 H new ATOM 0 HB2 SER A 81 10.958 8.591 4.225 1.00 0.00 H new ATOM 0 HB3 SER A 81 10.161 8.051 5.690 1.00 0.00 H new ATOM 0 HG SER A 81 11.002 9.809 6.815 1.00 0.00 H new ATOM 1315 N GLU A 82 14.079 9.243 6.078 1.00 0.00 N ATOM 1316 CA GLU A 82 14.943 10.114 6.862 1.00 0.00 C ATOM 1317 C GLU A 82 14.287 11.497 6.916 1.00 0.00 C ATOM 1318 O GLU A 82 14.405 12.277 5.971 1.00 0.00 O ATOM 1319 CB GLU A 82 16.356 10.219 6.252 1.00 0.00 C ATOM 1320 CG GLU A 82 17.458 10.012 7.276 1.00 0.00 C ATOM 1321 CD GLU A 82 18.639 10.937 7.058 1.00 0.00 C ATOM 1322 OE1 GLU A 82 19.511 10.602 6.229 1.00 0.00 O ATOM 1323 OE2 GLU A 82 18.692 11.998 7.716 1.00 0.00 O ATOM 0 H GLU A 82 14.251 9.278 5.073 1.00 0.00 H new ATOM 0 HA GLU A 82 15.061 9.699 7.863 1.00 0.00 H new ATOM 0 HB2 GLU A 82 16.460 9.478 5.459 1.00 0.00 H new ATOM 0 HB3 GLU A 82 16.475 11.199 5.790 1.00 0.00 H new ATOM 0 HG2 GLU A 82 17.055 10.173 8.276 1.00 0.00 H new ATOM 0 HG3 GLU A 82 17.799 8.978 7.233 1.00 0.00 H new ATOM 1330 N PRO A 83 13.555 11.808 8.009 1.00 0.00 N ATOM 1331 CA PRO A 83 12.843 13.073 8.181 1.00 0.00 C ATOM 1332 C PRO A 83 13.446 14.259 7.436 1.00 0.00 C ATOM 1333 O PRO A 83 14.514 14.762 7.784 1.00 0.00 O ATOM 1334 CB PRO A 83 12.923 13.258 9.686 1.00 0.00 C ATOM 1335 CG PRO A 83 12.711 11.876 10.206 1.00 0.00 C ATOM 1336 CD PRO A 83 13.329 10.938 9.183 1.00 0.00 C ATOM 0 HA PRO A 83 11.836 13.036 7.766 1.00 0.00 H new ATOM 0 HB2 PRO A 83 13.888 13.661 9.992 1.00 0.00 H new ATOM 0 HB3 PRO A 83 12.160 13.947 10.049 1.00 0.00 H new ATOM 0 HG2 PRO A 83 13.180 11.751 11.182 1.00 0.00 H new ATOM 0 HG3 PRO A 83 11.649 11.667 10.334 1.00 0.00 H new ATOM 0 HD2 PRO A 83 14.261 10.505 9.547 1.00 0.00 H new ATOM 0 HD3 PRO A 83 12.663 10.108 8.945 1.00 0.00 H new ATOM 1344 N VAL A 84 12.718 14.706 6.417 1.00 0.00 N ATOM 1345 CA VAL A 84 13.120 15.846 5.606 1.00 0.00 C ATOM 1346 C VAL A 84 12.380 17.097 6.081 1.00 0.00 C ATOM 1347 O VAL A 84 12.938 18.194 6.128 1.00 0.00 O ATOM 1348 CB VAL A 84 12.789 15.614 4.120 1.00 0.00 C ATOM 1349 CG1 VAL A 84 11.298 15.352 3.935 1.00 0.00 C ATOM 1350 CG2 VAL A 84 13.237 16.800 3.278 1.00 0.00 C ATOM 0 H VAL A 84 11.833 14.287 6.132 1.00 0.00 H new ATOM 0 HA VAL A 84 14.197 15.974 5.713 1.00 0.00 H new ATOM 0 HB VAL A 84 13.334 14.732 3.782 1.00 0.00 H new ATOM 0 HG11 VAL A 84 11.085 15.191 2.878 1.00 0.00 H new ATOM 0 HG12 VAL A 84 11.011 14.467 4.502 1.00 0.00 H new ATOM 0 HG13 VAL A 84 10.731 16.211 4.292 1.00 0.00 H new ATOM 0 HG21 VAL A 84 12.994 16.616 2.232 1.00 0.00 H new ATOM 0 HG22 VAL A 84 12.725 17.701 3.616 1.00 0.00 H new ATOM 0 HG23 VAL A 84 14.314 16.934 3.382 1.00 0.00 H new ATOM 1360 N ASN A 85 11.106 16.902 6.426 1.00 0.00 N ATOM 1361 CA ASN A 85 10.237 17.977 6.897 1.00 0.00 C ATOM 1362 C ASN A 85 8.996 17.388 7.574 1.00 0.00 C ATOM 1363 O ASN A 85 9.035 16.261 8.069 1.00 0.00 O ATOM 1364 CB ASN A 85 9.832 18.877 5.726 1.00 0.00 C ATOM 1365 CG ASN A 85 9.809 20.345 6.106 1.00 0.00 C ATOM 1366 OD1 ASN A 85 8.797 20.860 6.582 1.00 0.00 O ATOM 1367 ND2 ASN A 85 10.929 21.027 5.897 1.00 0.00 N ATOM 0 H ASN A 85 10.649 15.991 6.386 1.00 0.00 H new ATOM 0 HA ASN A 85 10.779 18.579 7.626 1.00 0.00 H new ATOM 0 HB2 ASN A 85 10.528 18.729 4.900 1.00 0.00 H new ATOM 0 HB3 ASN A 85 8.846 18.582 5.368 1.00 0.00 H new ATOM 0 HD21 ASN A 85 10.974 22.018 6.133 1.00 0.00 H new ATOM 0 HD22 ASN A 85 11.744 20.560 5.500 1.00 0.00 H new ATOM 1374 N GLU A 86 7.896 18.140 7.588 1.00 0.00 N ATOM 1375 CA GLU A 86 6.660 17.673 8.196 1.00 0.00 C ATOM 1376 C GLU A 86 5.484 18.410 7.587 1.00 0.00 C ATOM 1377 O GLU A 86 5.551 19.620 7.370 1.00 0.00 O ATOM 1378 CB GLU A 86 6.681 17.891 9.709 1.00 0.00 C ATOM 1379 CG GLU A 86 7.167 16.684 10.496 1.00 0.00 C ATOM 1380 CD GLU A 86 7.417 17.003 11.957 1.00 0.00 C ATOM 1381 OE1 GLU A 86 6.435 17.072 12.726 1.00 0.00 O ATOM 1382 OE2 GLU A 86 8.594 17.186 12.332 1.00 0.00 O ATOM 0 H GLU A 86 7.840 19.075 7.184 1.00 0.00 H new ATOM 0 HA GLU A 86 6.561 16.604 8.005 1.00 0.00 H new ATOM 0 HB2 GLU A 86 7.322 18.743 9.935 1.00 0.00 H new ATOM 0 HB3 GLU A 86 5.677 18.151 10.043 1.00 0.00 H new ATOM 0 HG2 GLU A 86 6.428 15.886 10.423 1.00 0.00 H new ATOM 0 HG3 GLU A 86 8.087 16.309 10.047 1.00 0.00 H new ATOM 1389 N LEU A 87 4.405 17.691 7.309 1.00 0.00 N ATOM 1390 CA LEU A 87 3.237 18.329 6.723 1.00 0.00 C ATOM 1391 C LEU A 87 1.929 17.864 7.356 1.00 0.00 C ATOM 1392 O LEU A 87 1.069 17.273 6.702 1.00 0.00 O ATOM 1393 CB LEU A 87 3.174 18.124 5.225 1.00 0.00 C ATOM 1394 CG LEU A 87 3.959 16.940 4.681 1.00 0.00 C ATOM 1395 CD1 LEU A 87 3.588 15.683 5.459 1.00 0.00 C ATOM 1396 CD2 LEU A 87 3.682 16.778 3.190 1.00 0.00 C ATOM 0 H LEU A 87 4.315 16.689 7.475 1.00 0.00 H new ATOM 0 HA LEU A 87 3.353 19.393 6.931 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.129 18.005 4.938 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.537 19.030 4.739 1.00 0.00 H new ATOM 0 HG LEU A 87 5.028 17.113 4.805 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.150 14.835 5.069 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.827 15.824 6.513 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.520 15.491 5.352 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.247 15.929 2.805 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.617 16.606 3.034 1.00 0.00 H new ATOM 0 HD23 LEU A 87 3.984 17.683 2.663 1.00 0.00 H new ATOM 1408 N SER A 88 1.789 18.171 8.620 1.00 0.00 N ATOM 1409 CA SER A 88 0.584 17.838 9.383 1.00 0.00 C ATOM 1410 C SER A 88 -0.578 18.684 8.918 1.00 0.00 C ATOM 1411 O SER A 88 -1.681 18.186 8.758 1.00 0.00 O ATOM 1412 CB SER A 88 0.801 18.034 10.878 1.00 0.00 C ATOM 1413 OG SER A 88 1.913 18.876 11.130 1.00 0.00 O ATOM 0 H SER A 88 2.501 18.660 9.162 1.00 0.00 H new ATOM 0 HA SER A 88 0.359 16.786 9.208 1.00 0.00 H new ATOM 0 HB2 SER A 88 -0.094 18.467 11.324 1.00 0.00 H new ATOM 0 HB3 SER A 88 0.959 17.067 11.355 1.00 0.00 H new ATOM 0 HG SER A 88 2.028 18.986 12.097 1.00 0.00 H new ATOM 1419 N THR A 89 -0.324 19.961 8.667 1.00 0.00 N ATOM 1420 CA THR A 89 -1.369 20.845 8.172 1.00 0.00 C ATOM 1421 C THR A 89 -1.933 20.261 6.884 1.00 0.00 C ATOM 1422 O THR A 89 -3.069 20.531 6.493 1.00 0.00 O ATOM 1423 CB THR A 89 -0.802 22.238 7.916 1.00 0.00 C ATOM 1424 OG1 THR A 89 0.450 22.157 7.250 1.00 0.00 O ATOM 1425 CG2 THR A 89 -0.602 23.030 9.188 1.00 0.00 C ATOM 0 H THR A 89 0.586 20.404 8.796 1.00 0.00 H new ATOM 0 HA THR A 89 -2.162 20.931 8.915 1.00 0.00 H new ATOM 0 HB THR A 89 -1.538 22.750 7.296 1.00 0.00 H new ATOM 0 HG1 THR A 89 0.796 23.060 7.093 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.197 24.012 8.945 1.00 0.00 H new ATOM 0 HG22 THR A 89 -1.558 23.148 9.697 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.094 22.502 9.840 1.00 0.00 H new ATOM 1433 N PHE A 90 -1.106 19.439 6.246 1.00 0.00 N ATOM 1434 CA PHE A 90 -1.454 18.765 5.010 1.00 0.00 C ATOM 1435 C PHE A 90 -2.103 17.409 5.299 1.00 0.00 C ATOM 1436 O PHE A 90 -2.402 16.646 4.380 1.00 0.00 O ATOM 1437 CB PHE A 90 -0.176 18.566 4.205 1.00 0.00 C ATOM 1438 CG PHE A 90 -0.211 19.140 2.826 1.00 0.00 C ATOM 1439 CD1 PHE A 90 -0.050 20.501 2.619 1.00 0.00 C ATOM 1440 CD2 PHE A 90 -0.383 18.316 1.731 1.00 0.00 C ATOM 1441 CE1 PHE A 90 -0.059 21.023 1.351 1.00 0.00 C ATOM 1442 CE2 PHE A 90 -0.391 18.836 0.458 1.00 0.00 C ATOM 1443 CZ PHE A 90 -0.228 20.194 0.270 1.00 0.00 C ATOM 0 H PHE A 90 -0.167 19.223 6.580 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.169 19.367 4.450 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.654 19.015 4.750 1.00 0.00 H new ATOM 0 HB3 PHE A 90 0.030 17.498 4.134 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.084 21.158 3.466 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -0.512 17.254 1.876 1.00 0.00 H new ATOM 0 HE1 PHE A 90 0.067 22.085 1.203 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.524 18.184 -0.392 1.00 0.00 H new ATOM 0 HZ PHE A 90 -0.233 20.605 -0.729 1.00 0.00 H new ATOM 1453 N ARG A 91 -2.298 17.108 6.586 1.00 0.00 N ATOM 1454 CA ARG A 91 -2.885 15.839 7.012 1.00 0.00 C ATOM 1455 C ARG A 91 -4.066 15.420 6.144 1.00 0.00 C ATOM 1456 O ARG A 91 -4.118 14.281 5.683 1.00 0.00 O ATOM 1457 CB ARG A 91 -3.329 15.916 8.463 1.00 0.00 C ATOM 1458 CG ARG A 91 -4.051 17.193 8.741 1.00 0.00 C ATOM 1459 CD ARG A 91 -3.957 17.610 10.200 1.00 0.00 C ATOM 1460 NE ARG A 91 -5.270 17.675 10.837 1.00 0.00 N ATOM 1461 CZ ARG A 91 -5.453 17.727 12.154 1.00 0.00 C ATOM 1462 NH1 ARG A 91 -4.411 17.722 12.977 1.00 0.00 N ATOM 1463 NH2 ARG A 91 -6.681 17.784 12.651 1.00 0.00 N ATOM 0 H ARG A 91 -2.055 17.733 7.355 1.00 0.00 H new ATOM 0 HA ARG A 91 -2.106 15.085 6.902 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.978 15.071 8.692 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -2.460 15.837 9.116 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -3.639 17.983 8.113 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -5.100 17.081 8.465 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -3.327 16.902 10.739 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -3.473 18.584 10.268 1.00 0.00 H new ATOM 0 HE ARG A 91 -6.095 17.681 10.237 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -3.464 17.678 12.601 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -4.558 17.762 13.986 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -7.485 17.788 12.024 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -6.821 17.824 13.661 1.00 0.00 H new ATOM 1477 N ASN A 92 -5.023 16.321 5.918 1.00 0.00 N ATOM 1478 CA ASN A 92 -6.177 15.964 5.100 1.00 0.00 C ATOM 1479 C ASN A 92 -5.722 15.455 3.743 1.00 0.00 C ATOM 1480 O ASN A 92 -6.159 14.400 3.297 1.00 0.00 O ATOM 1481 CB ASN A 92 -7.157 17.121 4.919 1.00 0.00 C ATOM 1482 CG ASN A 92 -6.711 18.121 3.868 1.00 0.00 C ATOM 1483 OD1 ASN A 92 -6.937 17.778 2.603 1.00 0.00 O flip ATOM 1484 ND2 ASN A 92 -6.175 19.182 4.186 1.00 0.00 N flip ATOM 0 H ASN A 92 -5.023 17.275 6.279 1.00 0.00 H new ATOM 0 HA ASN A 92 -6.708 15.175 5.633 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -8.133 16.723 4.642 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -7.282 17.636 5.872 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -6.023 19.401 5.170 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -5.883 19.842 3.465 1.00 0.00 H new ATOM 1491 N GLU A 93 -4.821 16.197 3.097 1.00 0.00 N ATOM 1492 CA GLU A 93 -4.292 15.781 1.803 1.00 0.00 C ATOM 1493 C GLU A 93 -3.938 14.319 1.876 1.00 0.00 C ATOM 1494 O GLU A 93 -4.334 13.508 1.040 1.00 0.00 O ATOM 1495 CB GLU A 93 -3.023 16.551 1.459 1.00 0.00 C ATOM 1496 CG GLU A 93 -3.027 17.138 0.058 1.00 0.00 C ATOM 1497 CD GLU A 93 -3.343 18.620 0.047 1.00 0.00 C ATOM 1498 OE1 GLU A 93 -3.043 19.299 1.052 1.00 0.00 O ATOM 1499 OE2 GLU A 93 -3.890 19.103 -0.967 1.00 0.00 O ATOM 0 H GLU A 93 -4.447 17.079 3.446 1.00 0.00 H new ATOM 0 HA GLU A 93 -5.048 15.974 1.042 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.890 17.357 2.181 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -2.166 15.886 1.563 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -2.053 16.975 -0.403 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -3.760 16.610 -0.551 1.00 0.00 H new ATOM 1506 N ILE A 94 -3.181 14.009 2.914 1.00 0.00 N ATOM 1507 CA ILE A 94 -2.744 12.665 3.162 1.00 0.00 C ATOM 1508 C ILE A 94 -3.957 11.751 3.310 1.00 0.00 C ATOM 1509 O ILE A 94 -3.969 10.622 2.820 1.00 0.00 O ATOM 1510 CB ILE A 94 -1.868 12.612 4.430 1.00 0.00 C ATOM 1511 CG1 ILE A 94 -0.451 13.092 4.108 1.00 0.00 C ATOM 1512 CG2 ILE A 94 -1.842 11.211 5.029 1.00 0.00 C ATOM 1513 CD1 ILE A 94 -0.397 14.402 3.349 1.00 0.00 C ATOM 0 H ILE A 94 -2.857 14.688 3.603 1.00 0.00 H new ATOM 0 HA ILE A 94 -2.144 12.322 2.319 1.00 0.00 H new ATOM 0 HB ILE A 94 -2.305 13.277 5.175 1.00 0.00 H new ATOM 0 HG12 ILE A 94 0.104 13.202 5.040 1.00 0.00 H new ATOM 0 HG13 ILE A 94 0.056 12.325 3.523 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -1.216 11.208 5.921 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -2.855 10.911 5.296 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -1.436 10.511 4.299 1.00 0.00 H new ATOM 0 HD11 ILE A 94 0.642 14.671 3.161 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -0.921 14.294 2.400 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -0.873 15.185 3.940 1.00 0.00 H new ATOM 1525 N ILE A 95 -4.985 12.272 3.978 1.00 0.00 N ATOM 1526 CA ILE A 95 -6.222 11.535 4.182 1.00 0.00 C ATOM 1527 C ILE A 95 -7.020 11.484 2.884 1.00 0.00 C ATOM 1528 O ILE A 95 -7.118 10.429 2.266 1.00 0.00 O ATOM 1529 CB ILE A 95 -7.086 12.166 5.295 1.00 0.00 C ATOM 1530 CG1 ILE A 95 -6.322 12.173 6.621 1.00 0.00 C ATOM 1531 CG2 ILE A 95 -8.403 11.417 5.443 1.00 0.00 C ATOM 1532 CD1 ILE A 95 -6.053 10.789 7.171 1.00 0.00 C ATOM 0 H ILE A 95 -4.981 13.206 4.387 1.00 0.00 H new ATOM 0 HA ILE A 95 -5.956 10.525 4.492 1.00 0.00 H new ATOM 0 HB ILE A 95 -7.309 13.196 5.016 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -5.373 12.690 6.481 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -6.891 12.743 7.356 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -8.997 11.878 6.232 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.953 11.460 4.503 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -8.203 10.377 5.700 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -5.508 10.871 8.112 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -6.999 10.276 7.343 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -5.458 10.222 6.455 1.00 0.00 H new ATOM 1544 N ALA A 96 -7.579 12.630 2.461 1.00 0.00 N ATOM 1545 CA ALA A 96 -8.355 12.689 1.214 1.00 0.00 C ATOM 1546 C ALA A 96 -7.783 11.731 0.168 1.00 0.00 C ATOM 1547 O ALA A 96 -8.515 10.941 -0.425 1.00 0.00 O ATOM 1548 CB ALA A 96 -8.395 14.116 0.679 1.00 0.00 C ATOM 0 H ALA A 96 -7.509 13.518 2.958 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.376 12.375 1.431 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -8.973 14.142 -0.245 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -8.861 14.769 1.417 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -7.379 14.459 0.481 1.00 0.00 H new ATOM 1554 N ALA A 97 -6.462 11.767 -0.008 1.00 0.00 N ATOM 1555 CA ALA A 97 -5.778 10.857 -0.930 1.00 0.00 C ATOM 1556 C ALA A 97 -6.258 9.454 -0.672 1.00 0.00 C ATOM 1557 O ALA A 97 -6.950 8.839 -1.478 1.00 0.00 O ATOM 1558 CB ALA A 97 -4.281 10.921 -0.679 1.00 0.00 C ATOM 0 H ALA A 97 -5.843 12.417 0.476 1.00 0.00 H new ATOM 0 HA ALA A 97 -5.991 11.144 -1.960 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -3.768 10.245 -1.363 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.928 11.939 -0.842 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -4.071 10.625 0.349 1.00 0.00 H new ATOM 1564 N ILE A 98 -5.900 8.990 0.497 1.00 0.00 N ATOM 1565 CA ILE A 98 -6.270 7.694 0.977 1.00 0.00 C ATOM 1566 C ILE A 98 -7.786 7.521 0.919 1.00 0.00 C ATOM 1567 O ILE A 98 -8.320 6.562 0.377 1.00 0.00 O ATOM 1568 CB ILE A 98 -5.824 7.617 2.440 1.00 0.00 C ATOM 1569 CG1 ILE A 98 -4.339 7.241 2.521 1.00 0.00 C ATOM 1570 CG2 ILE A 98 -6.703 6.660 3.251 1.00 0.00 C ATOM 1571 CD1 ILE A 98 -3.963 6.500 3.783 1.00 0.00 C ATOM 0 H ILE A 98 -5.328 9.521 1.155 1.00 0.00 H new ATOM 0 HA ILE A 98 -5.807 6.918 0.368 1.00 0.00 H new ATOM 0 HB ILE A 98 -5.948 8.603 2.889 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -4.083 6.624 1.659 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -3.740 8.149 2.452 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -6.355 6.633 4.284 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -7.737 7.005 3.226 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.644 5.660 2.822 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -2.898 6.269 3.766 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -4.186 7.122 4.650 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -4.534 5.573 3.845 1.00 0.00 H new ATOM 1583 N ASP A 99 -8.442 8.472 1.548 1.00 0.00 N ATOM 1584 CA ASP A 99 -9.885 8.515 1.684 1.00 0.00 C ATOM 1585 C ASP A 99 -10.655 8.531 0.358 1.00 0.00 C ATOM 1586 O ASP A 99 -11.823 8.153 0.325 1.00 0.00 O ATOM 1587 CB ASP A 99 -10.232 9.737 2.523 1.00 0.00 C ATOM 1588 CG ASP A 99 -11.324 9.458 3.538 1.00 0.00 C ATOM 1589 OD1 ASP A 99 -11.985 8.404 3.426 1.00 0.00 O ATOM 1590 OD2 ASP A 99 -11.518 10.294 4.446 1.00 0.00 O ATOM 0 H ASP A 99 -7.973 9.261 1.993 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.198 7.589 2.166 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -9.338 10.082 3.043 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -10.551 10.546 1.865 1.00 0.00 H new ATOM 1595 N PHE A 100 -10.031 8.970 -0.727 1.00 0.00 N ATOM 1596 CA PHE A 100 -10.720 9.012 -2.013 1.00 0.00 C ATOM 1597 C PHE A 100 -10.256 7.872 -2.896 1.00 0.00 C ATOM 1598 O PHE A 100 -11.037 7.236 -3.603 1.00 0.00 O ATOM 1599 CB PHE A 100 -10.474 10.358 -2.705 1.00 0.00 C ATOM 1600 CG PHE A 100 -10.930 10.402 -4.138 1.00 0.00 C ATOM 1601 CD1 PHE A 100 -12.280 10.452 -4.447 1.00 0.00 C ATOM 1602 CD2 PHE A 100 -10.008 10.393 -5.174 1.00 0.00 C ATOM 1603 CE1 PHE A 100 -12.702 10.492 -5.763 1.00 0.00 C ATOM 1604 CE2 PHE A 100 -10.425 10.433 -6.491 1.00 0.00 C ATOM 1605 CZ PHE A 100 -11.774 10.482 -6.785 1.00 0.00 C ATOM 0 H PHE A 100 -9.065 9.297 -0.746 1.00 0.00 H new ATOM 0 HA PHE A 100 -11.790 8.902 -1.838 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -10.987 11.141 -2.147 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -9.409 10.585 -2.666 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -13.010 10.460 -3.651 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -8.952 10.354 -4.949 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -13.757 10.531 -5.991 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -9.697 10.426 -7.289 1.00 0.00 H new ATOM 0 HZ PHE A 100 -12.102 10.512 -7.813 1.00 0.00 H new ATOM 1615 N LEU A 101 -8.963 7.650 -2.843 1.00 0.00 N ATOM 1616 CA LEU A 101 -8.304 6.622 -3.618 1.00 0.00 C ATOM 1617 C LEU A 101 -8.463 5.259 -2.965 1.00 0.00 C ATOM 1618 O LEU A 101 -8.633 4.243 -3.639 1.00 0.00 O ATOM 1619 CB LEU A 101 -6.828 7.006 -3.711 1.00 0.00 C ATOM 1620 CG LEU A 101 -5.818 5.996 -3.148 1.00 0.00 C ATOM 1621 CD1 LEU A 101 -5.221 5.130 -4.246 1.00 0.00 C ATOM 1622 CD2 LEU A 101 -4.725 6.712 -2.361 1.00 0.00 C ATOM 0 H LEU A 101 -8.329 8.187 -2.251 1.00 0.00 H new ATOM 0 HA LEU A 101 -8.749 6.550 -4.610 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -6.587 7.180 -4.760 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.689 7.953 -3.190 1.00 0.00 H new ATOM 0 HG LEU A 101 -6.354 5.334 -2.468 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.511 4.428 -3.810 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -6.016 4.578 -4.747 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -4.707 5.763 -4.970 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.019 5.979 -1.970 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -4.201 7.407 -3.017 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.173 7.262 -1.533 1.00 0.00 H new ATOM 1634 N ILE A 102 -8.367 5.251 -1.646 1.00 0.00 N ATOM 1635 CA ILE A 102 -8.455 4.026 -0.880 1.00 0.00 C ATOM 1636 C ILE A 102 -9.857 3.814 -0.315 1.00 0.00 C ATOM 1637 O ILE A 102 -10.234 2.688 0.009 1.00 0.00 O ATOM 1638 CB ILE A 102 -7.426 4.032 0.271 1.00 0.00 C ATOM 1639 CG1 ILE A 102 -6.076 4.544 -0.241 1.00 0.00 C ATOM 1640 CG2 ILE A 102 -7.281 2.647 0.877 1.00 0.00 C ATOM 1641 CD1 ILE A 102 -4.983 4.551 0.808 1.00 0.00 C ATOM 0 H ILE A 102 -8.227 6.089 -1.082 1.00 0.00 H new ATOM 0 HA ILE A 102 -8.234 3.203 -1.559 1.00 0.00 H new ATOM 0 HB ILE A 102 -7.783 4.701 1.054 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.758 3.924 -1.079 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -6.204 5.556 -0.624 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -6.551 2.678 1.685 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -8.243 2.319 1.270 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.945 1.948 0.111 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -4.059 4.926 0.368 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -5.278 5.195 1.637 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -4.824 3.537 1.175 1.00 0.00 H new ATOM 1653 N THR A 103 -10.635 4.894 -0.195 1.00 0.00 N ATOM 1654 CA THR A 103 -11.992 4.778 0.336 1.00 0.00 C ATOM 1655 C THR A 103 -13.021 5.336 -0.638 1.00 0.00 C ATOM 1656 O THR A 103 -14.129 4.810 -0.748 1.00 0.00 O ATOM 1657 CB THR A 103 -12.107 5.480 1.691 1.00 0.00 C ATOM 1658 OG1 THR A 103 -10.914 5.324 2.440 1.00 0.00 O ATOM 1659 CG2 THR A 103 -13.249 4.960 2.537 1.00 0.00 C ATOM 0 H THR A 103 -10.354 5.840 -0.453 1.00 0.00 H new ATOM 0 HA THR A 103 -12.200 3.717 0.474 1.00 0.00 H new ATOM 0 HB THR A 103 -12.294 6.529 1.459 1.00 0.00 H new ATOM 0 HG1 THR A 103 -11.007 5.781 3.302 1.00 0.00 H new ATOM 0 HG21 THR A 103 -13.275 5.499 3.484 1.00 0.00 H new ATOM 0 HG22 THR A 103 -14.191 5.109 2.008 1.00 0.00 H new ATOM 0 HG23 THR A 103 -13.105 3.897 2.729 1.00 0.00 H new ATOM 1667 N GLY A 104 -12.653 6.391 -1.349 1.00 0.00 N ATOM 1668 CA GLY A 104 -13.565 6.980 -2.306 1.00 0.00 C ATOM 1669 C GLY A 104 -14.838 7.494 -1.663 1.00 0.00 C ATOM 1670 O GLY A 104 -15.939 7.148 -2.090 1.00 0.00 O ATOM 0 H GLY A 104 -11.744 6.848 -1.281 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -13.065 7.801 -2.820 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -13.819 6.238 -3.063 1.00 0.00 H new ATOM 1674 N ILE A 105 -14.690 8.322 -0.634 1.00 0.00 N ATOM 1675 CA ILE A 105 -15.841 8.882 0.065 1.00 0.00 C ATOM 1676 C ILE A 105 -16.057 10.343 -0.314 1.00 0.00 C ATOM 1677 O ILE A 105 -17.161 10.865 -0.050 1.00 0.00 O ATOM 1678 CB ILE A 105 -15.688 8.777 1.597 1.00 0.00 C ATOM 1679 CG1 ILE A 105 -14.247 9.075 2.023 1.00 0.00 C ATOM 1680 CG2 ILE A 105 -16.110 7.397 2.077 1.00 0.00 C ATOM 1681 CD1 ILE A 105 -13.732 10.412 1.535 1.00 0.00 C ATOM 1682 OXT ILE A 105 -15.121 10.954 -0.872 1.00 0.00 O ATOM 0 H ILE A 105 -13.786 8.620 -0.266 1.00 0.00 H new ATOM 0 HA ILE A 105 -16.707 8.295 -0.242 1.00 0.00 H new ATOM 0 HB ILE A 105 -16.339 9.521 2.057 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -14.186 9.047 3.111 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -13.596 8.286 1.647 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -15.997 7.338 3.159 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -17.153 7.222 1.811 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -15.484 6.640 1.605 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -12.706 10.553 1.875 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -13.760 10.437 0.446 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -14.359 11.210 1.932 1.00 0.00 H new ATOM 1695 N MET B 1 -11.502 -9.408 -13.107 1.00 0.00 N ATOM 1696 CA MET B 1 -10.181 -9.157 -13.742 1.00 0.00 C ATOM 1697 C MET B 1 -9.425 -8.046 -13.021 1.00 0.00 C ATOM 1698 O MET B 1 -8.194 -8.046 -12.979 1.00 0.00 O ATOM 1699 CB MET B 1 -10.409 -8.777 -15.206 1.00 0.00 C ATOM 1700 CG MET B 1 -10.384 -9.964 -16.154 1.00 0.00 C ATOM 1701 SD MET B 1 -12.035 -10.567 -16.556 1.00 0.00 S ATOM 1702 CE MET B 1 -12.494 -9.444 -17.875 1.00 0.00 C ATOM 0 H1 MET B 1 -11.904 -10.291 -13.480 1.00 0.00 H new ATOM 0 H2 MET B 1 -11.382 -9.490 -12.077 1.00 0.00 H new ATOM 0 H3 MET B 1 -12.145 -8.618 -13.319 1.00 0.00 H new ATOM 0 HA MET B 1 -9.575 -10.061 -13.678 1.00 0.00 H new ATOM 0 HB2 MET B 1 -11.370 -8.271 -15.296 1.00 0.00 H new ATOM 0 HB3 MET B 1 -9.644 -8.063 -15.511 1.00 0.00 H new ATOM 0 HG2 MET B 1 -9.872 -9.679 -17.073 1.00 0.00 H new ATOM 0 HG3 MET B 1 -9.806 -10.771 -15.704 1.00 0.00 H new ATOM 0 HE1 MET B 1 -13.495 -9.690 -18.230 1.00 0.00 H new ATOM 0 HE2 MET B 1 -12.483 -8.420 -17.501 1.00 0.00 H new ATOM 0 HE3 MET B 1 -11.784 -9.538 -18.697 1.00 0.00 H new ATOM 1714 N SER B 2 -10.168 -7.102 -12.455 1.00 0.00 N ATOM 1715 CA SER B 2 -9.567 -5.985 -11.735 1.00 0.00 C ATOM 1716 C SER B 2 -10.199 -5.831 -10.350 1.00 0.00 C ATOM 1717 O SER B 2 -10.911 -4.860 -10.100 1.00 0.00 O ATOM 1718 CB SER B 2 -9.732 -4.688 -12.547 1.00 0.00 C ATOM 1719 OG SER B 2 -11.099 -4.334 -12.662 1.00 0.00 O ATOM 0 H SER B 2 -11.188 -7.088 -12.481 1.00 0.00 H new ATOM 0 HA SER B 2 -8.504 -6.187 -11.603 1.00 0.00 H new ATOM 0 HB2 SER B 2 -9.182 -3.880 -12.065 1.00 0.00 H new ATOM 0 HB3 SER B 2 -9.301 -4.818 -13.540 1.00 0.00 H new ATOM 0 HG SER B 2 -11.452 -4.101 -11.778 1.00 0.00 H new ATOM 1725 N GLN B 3 -9.915 -6.798 -9.456 1.00 0.00 N ATOM 1726 CA GLN B 3 -10.429 -6.797 -8.070 1.00 0.00 C ATOM 1727 C GLN B 3 -11.152 -8.103 -7.715 1.00 0.00 C ATOM 1728 O GLN B 3 -11.936 -8.633 -8.502 1.00 0.00 O ATOM 1729 CB GLN B 3 -11.382 -5.620 -7.813 1.00 0.00 C ATOM 1730 CG GLN B 3 -11.946 -5.587 -6.401 1.00 0.00 C ATOM 1731 CD GLN B 3 -12.723 -4.318 -6.113 1.00 0.00 C ATOM 1732 OE1 GLN B 3 -12.241 -3.426 -5.414 1.00 0.00 O ATOM 1733 NE2 GLN B 3 -13.934 -4.229 -6.652 1.00 0.00 N ATOM 0 H GLN B 3 -9.324 -7.601 -9.672 1.00 0.00 H new ATOM 0 HA GLN B 3 -9.550 -6.696 -7.433 1.00 0.00 H new ATOM 0 HB2 GLN B 3 -10.853 -4.687 -8.005 1.00 0.00 H new ATOM 0 HB3 GLN B 3 -12.207 -5.670 -8.523 1.00 0.00 H new ATOM 0 HG2 GLN B 3 -12.597 -6.449 -6.254 1.00 0.00 H new ATOM 0 HG3 GLN B 3 -11.129 -5.679 -5.685 1.00 0.00 H new ATOM 0 HE21 GLN B 3 -14.295 -4.992 -7.225 1.00 0.00 H new ATOM 0 HE22 GLN B 3 -14.503 -3.398 -6.493 1.00 0.00 H new ATOM 1742 N PHE B 4 -10.904 -8.574 -6.491 1.00 0.00 N ATOM 1743 CA PHE B 4 -11.540 -9.778 -5.942 1.00 0.00 C ATOM 1744 C PHE B 4 -11.047 -11.093 -6.548 1.00 0.00 C ATOM 1745 O PHE B 4 -11.804 -12.060 -6.634 1.00 0.00 O ATOM 1746 CB PHE B 4 -13.062 -9.673 -6.054 1.00 0.00 C ATOM 1747 CG PHE B 4 -13.632 -8.617 -5.150 1.00 0.00 C ATOM 1748 CD1 PHE B 4 -13.159 -8.478 -3.855 1.00 0.00 C ATOM 1749 CD2 PHE B 4 -14.618 -7.753 -5.596 1.00 0.00 C ATOM 1750 CE1 PHE B 4 -13.658 -7.498 -3.020 1.00 0.00 C ATOM 1751 CE2 PHE B 4 -15.126 -6.772 -4.765 1.00 0.00 C ATOM 1752 CZ PHE B 4 -14.644 -6.644 -3.475 1.00 0.00 C ATOM 0 H PHE B 4 -10.251 -8.128 -5.846 1.00 0.00 H new ATOM 0 HA PHE B 4 -11.242 -9.814 -4.894 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -13.333 -9.449 -7.086 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -13.509 -10.637 -5.809 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -12.390 -9.145 -3.494 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -14.994 -7.847 -6.604 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -13.278 -7.399 -2.014 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -15.898 -6.107 -5.123 1.00 0.00 H new ATOM 0 HZ PHE B 4 -15.038 -5.877 -2.824 1.00 0.00 H new ATOM 1762 N THR B 5 -9.774 -11.150 -6.917 1.00 0.00 N ATOM 1763 CA THR B 5 -9.192 -12.371 -7.450 1.00 0.00 C ATOM 1764 C THR B 5 -8.031 -12.810 -6.568 1.00 0.00 C ATOM 1765 O THR B 5 -7.454 -12.001 -5.841 1.00 0.00 O ATOM 1766 CB THR B 5 -8.692 -12.161 -8.875 1.00 0.00 C ATOM 1767 OG1 THR B 5 -9.456 -11.170 -9.538 1.00 0.00 O ATOM 1768 CG2 THR B 5 -8.725 -13.414 -9.724 1.00 0.00 C ATOM 0 H THR B 5 -9.126 -10.364 -6.856 1.00 0.00 H new ATOM 0 HA THR B 5 -9.963 -13.141 -7.463 1.00 0.00 H new ATOM 0 HB THR B 5 -7.653 -11.851 -8.765 1.00 0.00 H new ATOM 0 HG1 THR B 5 -8.863 -10.606 -10.077 1.00 0.00 H new ATOM 0 HG21 THR B 5 -8.355 -13.186 -10.724 1.00 0.00 H new ATOM 0 HG22 THR B 5 -8.095 -14.178 -9.269 1.00 0.00 H new ATOM 0 HG23 THR B 5 -9.749 -13.781 -9.791 1.00 0.00 H new ATOM 1776 N LEU B 6 -7.669 -14.078 -6.658 1.00 0.00 N ATOM 1777 CA LEU B 6 -6.551 -14.603 -5.893 1.00 0.00 C ATOM 1778 C LEU B 6 -5.299 -14.480 -6.733 1.00 0.00 C ATOM 1779 O LEU B 6 -4.839 -15.456 -7.325 1.00 0.00 O ATOM 1780 CB LEU B 6 -6.788 -16.067 -5.521 1.00 0.00 C ATOM 1781 CG LEU B 6 -6.140 -16.520 -4.213 1.00 0.00 C ATOM 1782 CD1 LEU B 6 -6.737 -17.840 -3.757 1.00 0.00 C ATOM 1783 CD2 LEU B 6 -4.632 -16.647 -4.373 1.00 0.00 C ATOM 0 H LEU B 6 -8.133 -14.764 -7.254 1.00 0.00 H new ATOM 0 HA LEU B 6 -6.444 -14.035 -4.969 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -7.862 -16.239 -5.454 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -6.415 -16.696 -6.329 1.00 0.00 H new ATOM 0 HG LEU B 6 -6.340 -15.765 -3.453 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -6.265 -18.150 -2.824 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -7.809 -17.719 -3.599 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -6.566 -18.600 -4.520 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -4.192 -16.971 -3.430 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -4.409 -17.380 -5.148 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -4.214 -15.681 -4.656 1.00 0.00 H new ATOM 1795 N TYR B 7 -4.772 -13.268 -6.824 1.00 0.00 N ATOM 1796 CA TYR B 7 -3.601 -13.042 -7.648 1.00 0.00 C ATOM 1797 C TYR B 7 -2.316 -13.459 -6.965 1.00 0.00 C ATOM 1798 O TYR B 7 -1.904 -12.870 -5.968 1.00 0.00 O ATOM 1799 CB TYR B 7 -3.511 -11.572 -8.076 1.00 0.00 C ATOM 1800 CG TYR B 7 -4.818 -10.923 -8.482 1.00 0.00 C ATOM 1801 CD1 TYR B 7 -5.796 -10.606 -7.541 1.00 0.00 C ATOM 1802 CD2 TYR B 7 -5.051 -10.581 -9.808 1.00 0.00 C ATOM 1803 CE1 TYR B 7 -6.962 -9.974 -7.918 1.00 0.00 C ATOM 1804 CE2 TYR B 7 -6.214 -9.941 -10.188 1.00 0.00 C ATOM 1805 CZ TYR B 7 -7.166 -9.639 -9.240 1.00 0.00 C ATOM 1806 OH TYR B 7 -8.325 -8.999 -9.614 1.00 0.00 O ATOM 0 H TYR B 7 -5.131 -12.441 -6.346 1.00 0.00 H new ATOM 0 HA TYR B 7 -3.720 -13.670 -8.531 1.00 0.00 H new ATOM 0 HB2 TYR B 7 -3.083 -10.999 -7.253 1.00 0.00 H new ATOM 0 HB3 TYR B 7 -2.815 -11.498 -8.912 1.00 0.00 H new ATOM 0 HD1 TYR B 7 -5.638 -10.859 -6.503 1.00 0.00 H new ATOM 0 HD2 TYR B 7 -4.309 -10.820 -10.555 1.00 0.00 H new ATOM 0 HE1 TYR B 7 -7.714 -9.742 -7.179 1.00 0.00 H new ATOM 0 HE2 TYR B 7 -6.376 -9.679 -11.223 1.00 0.00 H new ATOM 0 HH TYR B 7 -9.061 -9.290 -9.036 1.00 0.00 H new ATOM 1816 N LYS B 8 -1.670 -14.466 -7.558 1.00 0.00 N ATOM 1817 CA LYS B 8 -0.401 -14.981 -7.065 1.00 0.00 C ATOM 1818 C LYS B 8 0.760 -14.382 -7.835 1.00 0.00 C ATOM 1819 O LYS B 8 0.860 -14.549 -9.043 1.00 0.00 O ATOM 1820 CB LYS B 8 -0.360 -16.502 -7.177 1.00 0.00 C ATOM 1821 CG LYS B 8 1.041 -17.084 -7.072 1.00 0.00 C ATOM 1822 CD LYS B 8 1.161 -18.047 -5.902 1.00 0.00 C ATOM 1823 CE LYS B 8 2.077 -19.214 -6.232 1.00 0.00 C ATOM 1824 NZ LYS B 8 2.351 -20.061 -5.038 1.00 0.00 N ATOM 0 H LYS B 8 -2.015 -14.943 -8.391 1.00 0.00 H new ATOM 0 HA LYS B 8 -0.311 -14.698 -6.016 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -0.983 -16.932 -6.393 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -0.797 -16.799 -8.130 1.00 0.00 H new ATOM 0 HG2 LYS B 8 1.290 -17.603 -7.998 1.00 0.00 H new ATOM 0 HG3 LYS B 8 1.763 -16.276 -6.955 1.00 0.00 H new ATOM 0 HD2 LYS B 8 1.546 -17.516 -5.031 1.00 0.00 H new ATOM 0 HD3 LYS B 8 0.173 -18.423 -5.636 1.00 0.00 H new ATOM 0 HE2 LYS B 8 1.621 -19.823 -7.012 1.00 0.00 H new ATOM 0 HE3 LYS B 8 3.018 -18.835 -6.632 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 3.340 -20.381 -5.059 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 2.184 -19.507 -4.174 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 1.720 -20.888 -5.047 1.00 0.00 H new ATOM 1838 N ASN B 9 1.633 -13.706 -7.096 1.00 0.00 N ATOM 1839 CA ASN B 9 2.831 -13.061 -7.626 1.00 0.00 C ATOM 1840 C ASN B 9 2.941 -13.123 -9.152 1.00 0.00 C ATOM 1841 O ASN B 9 2.959 -14.205 -9.737 1.00 0.00 O ATOM 1842 CB ASN B 9 4.079 -13.689 -7.000 1.00 0.00 C ATOM 1843 CG ASN B 9 3.991 -15.198 -6.885 1.00 0.00 C ATOM 1844 OD1 ASN B 9 4.371 -15.768 -5.869 1.00 0.00 O ATOM 1845 ND2 ASN B 9 3.501 -15.858 -7.923 1.00 0.00 N ATOM 0 H ASN B 9 1.526 -13.588 -6.089 1.00 0.00 H new ATOM 0 HA ASN B 9 2.752 -12.007 -7.361 1.00 0.00 H new ATOM 0 HB2 ASN B 9 4.950 -13.426 -7.600 1.00 0.00 H new ATOM 0 HB3 ASN B 9 4.234 -13.263 -6.009 1.00 0.00 H new ATOM 0 HD21 ASN B 9 3.430 -16.875 -7.893 1.00 0.00 H new ATOM 0 HD22 ASN B 9 3.194 -15.349 -8.752 1.00 0.00 H new ATOM 1852 N LYS B 10 3.034 -11.947 -9.783 1.00 0.00 N ATOM 1853 CA LYS B 10 3.166 -11.832 -11.250 1.00 0.00 C ATOM 1854 C LYS B 10 3.809 -13.073 -11.842 1.00 0.00 C ATOM 1855 O LYS B 10 3.389 -13.592 -12.876 1.00 0.00 O ATOM 1856 CB LYS B 10 4.029 -10.637 -11.630 1.00 0.00 C ATOM 1857 CG LYS B 10 4.637 -9.965 -10.436 1.00 0.00 C ATOM 1858 CD LYS B 10 5.490 -10.944 -9.651 1.00 0.00 C ATOM 1859 CE LYS B 10 6.286 -10.252 -8.557 1.00 0.00 C ATOM 1860 NZ LYS B 10 7.546 -10.980 -8.241 1.00 0.00 N ATOM 0 H LYS B 10 3.021 -11.049 -9.299 1.00 0.00 H new ATOM 0 HA LYS B 10 2.158 -11.708 -11.645 1.00 0.00 H new ATOM 0 HB2 LYS B 10 4.822 -10.965 -12.302 1.00 0.00 H new ATOM 0 HB3 LYS B 10 3.424 -9.916 -12.180 1.00 0.00 H new ATOM 0 HG2 LYS B 10 5.246 -9.120 -10.758 1.00 0.00 H new ATOM 0 HG3 LYS B 10 3.850 -9.565 -9.796 1.00 0.00 H new ATOM 0 HD2 LYS B 10 4.851 -11.708 -9.207 1.00 0.00 H new ATOM 0 HD3 LYS B 10 6.173 -11.455 -10.329 1.00 0.00 H new ATOM 0 HE2 LYS B 10 6.523 -9.235 -8.869 1.00 0.00 H new ATOM 0 HE3 LYS B 10 5.676 -10.175 -7.657 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 7.433 -11.497 -7.346 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 7.759 -11.653 -9.005 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 8.327 -10.299 -8.151 1.00 0.00 H new ATOM 1874 N ASP B 11 4.853 -13.518 -11.161 1.00 0.00 N ATOM 1875 CA ASP B 11 5.612 -14.670 -11.562 1.00 0.00 C ATOM 1876 C ASP B 11 5.624 -15.700 -10.427 1.00 0.00 C ATOM 1877 O ASP B 11 6.073 -15.411 -9.317 1.00 0.00 O ATOM 1878 CB ASP B 11 7.022 -14.203 -11.958 1.00 0.00 C ATOM 1879 CG ASP B 11 8.028 -14.292 -10.824 1.00 0.00 C ATOM 1880 OD1 ASP B 11 7.791 -13.669 -9.768 1.00 0.00 O ATOM 1881 OD2 ASP B 11 9.053 -14.985 -10.994 1.00 0.00 O ATOM 0 H ASP B 11 5.193 -13.078 -10.306 1.00 0.00 H new ATOM 0 HA ASP B 11 5.163 -15.161 -12.425 1.00 0.00 H new ATOM 0 HB2 ASP B 11 7.375 -14.806 -12.795 1.00 0.00 H new ATOM 0 HB3 ASP B 11 6.970 -13.172 -12.308 1.00 0.00 H new ATOM 1886 N LYS B 12 5.093 -16.891 -10.704 1.00 0.00 N ATOM 1887 CA LYS B 12 5.001 -17.961 -9.704 1.00 0.00 C ATOM 1888 C LYS B 12 6.314 -18.184 -8.939 1.00 0.00 C ATOM 1889 O LYS B 12 6.318 -18.844 -7.900 1.00 0.00 O ATOM 1890 CB LYS B 12 4.529 -19.262 -10.365 1.00 0.00 C ATOM 1891 CG LYS B 12 3.061 -19.591 -10.087 1.00 0.00 C ATOM 1892 CD LYS B 12 2.926 -20.739 -9.100 1.00 0.00 C ATOM 1893 CE LYS B 12 1.497 -21.254 -9.037 1.00 0.00 C ATOM 1894 NZ LYS B 12 1.343 -22.345 -8.036 1.00 0.00 N ATOM 0 H LYS B 12 4.717 -17.142 -11.618 1.00 0.00 H new ATOM 0 HA LYS B 12 4.267 -17.643 -8.964 1.00 0.00 H new ATOM 0 HB2 LYS B 12 4.679 -19.188 -11.442 1.00 0.00 H new ATOM 0 HB3 LYS B 12 5.150 -20.085 -10.013 1.00 0.00 H new ATOM 0 HG2 LYS B 12 2.558 -18.709 -9.692 1.00 0.00 H new ATOM 0 HG3 LYS B 12 2.562 -19.851 -11.020 1.00 0.00 H new ATOM 0 HD2 LYS B 12 3.594 -21.550 -9.390 1.00 0.00 H new ATOM 0 HD3 LYS B 12 3.238 -20.408 -8.110 1.00 0.00 H new ATOM 0 HE2 LYS B 12 0.826 -20.433 -8.785 1.00 0.00 H new ATOM 0 HE3 LYS B 12 1.199 -21.619 -10.020 1.00 0.00 H new ATOM 0 HZ1 LYS B 12 0.810 -23.132 -8.459 1.00 0.00 H new ATOM 0 HZ2 LYS B 12 2.282 -22.682 -7.742 1.00 0.00 H new ATOM 0 HZ3 LYS B 12 0.829 -21.985 -7.207 1.00 0.00 H new ATOM 1908 N SER B 13 7.421 -17.636 -9.438 1.00 0.00 N ATOM 1909 CA SER B 13 8.714 -17.791 -8.768 1.00 0.00 C ATOM 1910 C SER B 13 8.752 -17.014 -7.448 1.00 0.00 C ATOM 1911 O SER B 13 9.383 -17.441 -6.481 1.00 0.00 O ATOM 1912 CB SER B 13 9.844 -17.317 -9.683 1.00 0.00 C ATOM 1913 OG SER B 13 9.481 -17.437 -11.048 1.00 0.00 O ATOM 0 H SER B 13 7.451 -17.085 -10.296 1.00 0.00 H new ATOM 0 HA SER B 13 8.851 -18.849 -8.545 1.00 0.00 H new ATOM 0 HB2 SER B 13 10.086 -16.278 -9.458 1.00 0.00 H new ATOM 0 HB3 SER B 13 10.742 -17.903 -9.490 1.00 0.00 H new ATOM 0 HG SER B 13 9.132 -16.580 -11.370 1.00 0.00 H new ATOM 1919 N SER B 14 8.070 -15.872 -7.422 1.00 0.00 N ATOM 1920 CA SER B 14 8.008 -15.015 -6.233 1.00 0.00 C ATOM 1921 C SER B 14 7.526 -15.762 -5.020 1.00 0.00 C ATOM 1922 O SER B 14 7.913 -15.459 -3.893 1.00 0.00 O ATOM 1923 CB SER B 14 7.014 -13.884 -6.462 1.00 0.00 C ATOM 1924 OG SER B 14 7.494 -12.660 -5.933 1.00 0.00 O ATOM 0 H SER B 14 7.545 -15.512 -8.219 1.00 0.00 H new ATOM 0 HA SER B 14 9.020 -14.647 -6.065 1.00 0.00 H new ATOM 0 HB2 SER B 14 6.827 -13.772 -7.530 1.00 0.00 H new ATOM 0 HB3 SER B 14 6.061 -14.135 -5.996 1.00 0.00 H new ATOM 0 HG SER B 14 6.744 -12.043 -5.803 1.00 0.00 H new ATOM 1930 N ALA B 15 6.615 -16.679 -5.248 1.00 0.00 N ATOM 1931 CA ALA B 15 6.000 -17.399 -4.163 1.00 0.00 C ATOM 1932 C ALA B 15 7.011 -17.980 -3.184 1.00 0.00 C ATOM 1933 O ALA B 15 6.668 -18.236 -2.030 1.00 0.00 O ATOM 1934 CB ALA B 15 5.076 -18.480 -4.702 1.00 0.00 C ATOM 0 H ALA B 15 6.285 -16.943 -6.176 1.00 0.00 H new ATOM 0 HA ALA B 15 5.411 -16.677 -3.597 1.00 0.00 H new ATOM 0 HB1 ALA B 15 4.619 -19.016 -3.870 1.00 0.00 H new ATOM 0 HB2 ALA B 15 4.297 -18.022 -5.311 1.00 0.00 H new ATOM 0 HB3 ALA B 15 5.650 -19.178 -5.312 1.00 0.00 H new ATOM 1940 N LYS B 16 8.259 -18.161 -3.612 1.00 0.00 N ATOM 1941 CA LYS B 16 9.272 -18.676 -2.701 1.00 0.00 C ATOM 1942 C LYS B 16 9.257 -17.819 -1.442 1.00 0.00 C ATOM 1943 O LYS B 16 9.224 -18.326 -0.320 1.00 0.00 O ATOM 1944 CB LYS B 16 10.656 -18.643 -3.353 1.00 0.00 C ATOM 1945 CG LYS B 16 11.052 -19.957 -4.006 1.00 0.00 C ATOM 1946 CD LYS B 16 12.034 -19.739 -5.146 1.00 0.00 C ATOM 1947 CE LYS B 16 12.069 -20.932 -6.087 1.00 0.00 C ATOM 1948 NZ LYS B 16 12.692 -22.125 -5.449 1.00 0.00 N ATOM 0 H LYS B 16 8.585 -17.964 -4.558 1.00 0.00 H new ATOM 0 HA LYS B 16 9.052 -19.714 -2.452 1.00 0.00 H new ATOM 0 HB2 LYS B 16 10.676 -17.853 -4.104 1.00 0.00 H new ATOM 0 HB3 LYS B 16 11.398 -18.384 -2.598 1.00 0.00 H new ATOM 0 HG2 LYS B 16 11.499 -20.615 -3.260 1.00 0.00 H new ATOM 0 HG3 LYS B 16 10.162 -20.460 -4.383 1.00 0.00 H new ATOM 0 HD2 LYS B 16 11.755 -18.844 -5.702 1.00 0.00 H new ATOM 0 HD3 LYS B 16 13.031 -19.565 -4.741 1.00 0.00 H new ATOM 0 HE2 LYS B 16 11.054 -21.177 -6.401 1.00 0.00 H new ATOM 0 HE3 LYS B 16 12.626 -20.669 -6.986 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 12.697 -22.917 -6.123 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 13.669 -21.900 -5.172 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 12.146 -22.392 -4.605 1.00 0.00 H new ATOM 1962 N THR B 17 9.223 -16.506 -1.657 1.00 0.00 N ATOM 1963 CA THR B 17 9.144 -15.542 -0.571 1.00 0.00 C ATOM 1964 C THR B 17 7.734 -14.959 -0.493 1.00 0.00 C ATOM 1965 O THR B 17 7.143 -14.868 0.584 1.00 0.00 O ATOM 1966 CB THR B 17 10.163 -14.418 -0.763 1.00 0.00 C ATOM 1967 OG1 THR B 17 11.482 -14.934 -0.782 1.00 0.00 O ATOM 1968 CG2 THR B 17 10.095 -13.363 0.322 1.00 0.00 C ATOM 0 H THR B 17 9.249 -16.085 -2.586 1.00 0.00 H new ATOM 0 HA THR B 17 9.374 -16.057 0.362 1.00 0.00 H new ATOM 0 HB THR B 17 9.910 -13.954 -1.716 1.00 0.00 H new ATOM 0 HG1 THR B 17 12.119 -14.200 -0.907 1.00 0.00 H new ATOM 0 HG21 THR B 17 10.843 -12.594 0.129 1.00 0.00 H new ATOM 0 HG22 THR B 17 9.103 -12.911 0.329 1.00 0.00 H new ATOM 0 HG23 THR B 17 10.290 -13.824 1.290 1.00 0.00 H new ATOM 1976 N TYR B 18 7.212 -14.549 -1.652 1.00 0.00 N ATOM 1977 CA TYR B 18 5.879 -13.951 -1.739 1.00 0.00 C ATOM 1978 C TYR B 18 5.037 -14.630 -2.803 1.00 0.00 C ATOM 1979 O TYR B 18 5.357 -14.542 -3.985 1.00 0.00 O ATOM 1980 CB TYR B 18 6.000 -12.501 -2.136 1.00 0.00 C ATOM 1981 CG TYR B 18 6.984 -11.708 -1.306 1.00 0.00 C ATOM 1982 CD1 TYR B 18 6.782 -11.523 0.056 1.00 0.00 C ATOM 1983 CD2 TYR B 18 8.115 -11.145 -1.884 1.00 0.00 C ATOM 1984 CE1 TYR B 18 7.679 -10.798 0.818 1.00 0.00 C ATOM 1985 CE2 TYR B 18 9.016 -10.419 -1.128 1.00 0.00 C ATOM 1986 CZ TYR B 18 8.794 -10.249 0.222 1.00 0.00 C ATOM 1987 OH TYR B 18 9.689 -9.527 0.977 1.00 0.00 O ATOM 0 H TYR B 18 7.696 -14.621 -2.547 1.00 0.00 H new ATOM 0 HA TYR B 18 5.408 -14.065 -0.762 1.00 0.00 H new ATOM 0 HB2 TYR B 18 6.299 -12.447 -3.183 1.00 0.00 H new ATOM 0 HB3 TYR B 18 5.019 -12.033 -2.060 1.00 0.00 H new ATOM 0 HD1 TYR B 18 5.910 -11.952 0.527 1.00 0.00 H new ATOM 0 HD2 TYR B 18 8.293 -11.277 -2.941 1.00 0.00 H new ATOM 0 HE1 TYR B 18 7.507 -10.662 1.876 1.00 0.00 H new ATOM 0 HE2 TYR B 18 9.890 -9.987 -1.593 1.00 0.00 H new ATOM 0 HH TYR B 18 10.419 -9.210 0.405 1.00 0.00 H new ATOM 1997 N PRO B 19 3.961 -15.329 -2.427 1.00 0.00 N ATOM 1998 CA PRO B 19 3.127 -16.019 -3.389 1.00 0.00 C ATOM 1999 C PRO B 19 2.032 -15.165 -4.024 1.00 0.00 C ATOM 2000 O PRO B 19 1.820 -15.257 -5.226 1.00 0.00 O ATOM 2001 CB PRO B 19 2.508 -17.164 -2.583 1.00 0.00 C ATOM 2002 CG PRO B 19 2.888 -16.925 -1.154 1.00 0.00 C ATOM 2003 CD PRO B 19 3.485 -15.544 -1.066 1.00 0.00 C ATOM 0 HA PRO B 19 3.727 -16.336 -4.242 1.00 0.00 H new ATOM 0 HB2 PRO B 19 1.424 -17.180 -2.700 1.00 0.00 H new ATOM 0 HB3 PRO B 19 2.880 -18.128 -2.928 1.00 0.00 H new ATOM 0 HG2 PRO B 19 2.015 -17.007 -0.507 1.00 0.00 H new ATOM 0 HG3 PRO B 19 3.605 -17.674 -0.818 1.00 0.00 H new ATOM 0 HD2 PRO B 19 2.746 -14.799 -0.770 1.00 0.00 H new ATOM 0 HD3 PRO B 19 4.295 -15.496 -0.339 1.00 0.00 H new ATOM 2011 N TYR B 20 1.309 -14.360 -3.246 1.00 0.00 N ATOM 2012 CA TYR B 20 0.232 -13.565 -3.848 1.00 0.00 C ATOM 2013 C TYR B 20 -0.085 -12.274 -3.142 1.00 0.00 C ATOM 2014 O TYR B 20 0.455 -11.927 -2.093 1.00 0.00 O ATOM 2015 CB TYR B 20 -1.097 -14.335 -3.920 1.00 0.00 C ATOM 2016 CG TYR B 20 -1.098 -15.666 -3.266 1.00 0.00 C ATOM 2017 CD1 TYR B 20 -0.523 -15.844 -2.021 1.00 0.00 C ATOM 2018 CD2 TYR B 20 -1.683 -16.740 -3.903 1.00 0.00 C ATOM 2019 CE1 TYR B 20 -0.519 -17.067 -1.409 1.00 0.00 C ATOM 2020 CE2 TYR B 20 -1.692 -17.982 -3.305 1.00 0.00 C ATOM 2021 CZ TYR B 20 -1.107 -18.143 -2.059 1.00 0.00 C ATOM 2022 OH TYR B 20 -1.116 -19.376 -1.471 1.00 0.00 O ATOM 0 H TYR B 20 1.437 -14.240 -2.241 1.00 0.00 H new ATOM 0 HA TYR B 20 0.637 -13.346 -4.836 1.00 0.00 H new ATOM 0 HB2 TYR B 20 -1.876 -13.724 -3.464 1.00 0.00 H new ATOM 0 HB3 TYR B 20 -1.366 -14.464 -4.968 1.00 0.00 H new ATOM 0 HD1 TYR B 20 -0.068 -15.001 -1.522 1.00 0.00 H new ATOM 0 HD2 TYR B 20 -2.136 -16.608 -4.874 1.00 0.00 H new ATOM 0 HE1 TYR B 20 -0.066 -17.193 -0.437 1.00 0.00 H new ATOM 0 HE2 TYR B 20 -2.151 -18.823 -3.803 1.00 0.00 H new ATOM 0 HH TYR B 20 -1.282 -19.279 -0.510 1.00 0.00 H new ATOM 2032 N PHE B 21 -1.054 -11.625 -3.763 1.00 0.00 N ATOM 2033 CA PHE B 21 -1.640 -10.397 -3.314 1.00 0.00 C ATOM 2034 C PHE B 21 -3.077 -10.416 -3.786 1.00 0.00 C ATOM 2035 O PHE B 21 -3.452 -11.272 -4.589 1.00 0.00 O ATOM 2036 CB PHE B 21 -0.922 -9.174 -3.868 1.00 0.00 C ATOM 2037 CG PHE B 21 0.449 -9.448 -4.444 1.00 0.00 C ATOM 2038 CD1 PHE B 21 1.492 -9.838 -3.619 1.00 0.00 C ATOM 2039 CD2 PHE B 21 0.698 -9.308 -5.804 1.00 0.00 C ATOM 2040 CE1 PHE B 21 2.751 -10.085 -4.133 1.00 0.00 C ATOM 2041 CE2 PHE B 21 1.956 -9.555 -6.322 1.00 0.00 C ATOM 2042 CZ PHE B 21 2.983 -9.943 -5.485 1.00 0.00 C ATOM 0 H PHE B 21 -1.465 -11.964 -4.633 1.00 0.00 H new ATOM 0 HA PHE B 21 -1.564 -10.324 -2.229 1.00 0.00 H new ATOM 0 HB2 PHE B 21 -1.543 -8.726 -4.644 1.00 0.00 H new ATOM 0 HB3 PHE B 21 -0.825 -8.436 -3.072 1.00 0.00 H new ATOM 0 HD1 PHE B 21 1.319 -9.951 -2.559 1.00 0.00 H new ATOM 0 HD2 PHE B 21 -0.100 -9.003 -6.464 1.00 0.00 H new ATOM 0 HE1 PHE B 21 3.553 -10.389 -3.476 1.00 0.00 H new ATOM 0 HE2 PHE B 21 2.135 -9.444 -7.381 1.00 0.00 H new ATOM 0 HZ PHE B 21 3.966 -10.135 -5.888 1.00 0.00 H new ATOM 2052 N VAL B 22 -3.886 -9.511 -3.296 1.00 0.00 N ATOM 2053 CA VAL B 22 -5.275 -9.495 -3.695 1.00 0.00 C ATOM 2054 C VAL B 22 -5.725 -8.113 -4.123 1.00 0.00 C ATOM 2055 O VAL B 22 -5.678 -7.160 -3.351 1.00 0.00 O ATOM 2056 CB VAL B 22 -6.165 -9.988 -2.560 1.00 0.00 C ATOM 2057 CG1 VAL B 22 -7.621 -9.969 -2.991 1.00 0.00 C ATOM 2058 CG2 VAL B 22 -5.747 -11.382 -2.117 1.00 0.00 C ATOM 0 H VAL B 22 -3.616 -8.786 -2.631 1.00 0.00 H new ATOM 0 HA VAL B 22 -5.368 -10.164 -4.550 1.00 0.00 H new ATOM 0 HB VAL B 22 -6.049 -9.318 -1.708 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -8.247 -10.323 -2.172 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -7.909 -8.951 -3.254 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -7.753 -10.619 -3.856 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -6.395 -11.716 -1.306 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -5.832 -12.072 -2.957 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -4.714 -11.359 -1.770 1.00 0.00 H new ATOM 2068 N ASP B 23 -6.172 -8.021 -5.362 1.00 0.00 N ATOM 2069 CA ASP B 23 -6.646 -6.750 -5.910 1.00 0.00 C ATOM 2070 C ASP B 23 -7.790 -6.177 -5.072 1.00 0.00 C ATOM 2071 O ASP B 23 -8.908 -6.692 -5.109 1.00 0.00 O ATOM 2072 CB ASP B 23 -7.109 -6.950 -7.350 1.00 0.00 C ATOM 2073 CG ASP B 23 -5.949 -7.054 -8.320 1.00 0.00 C ATOM 2074 OD1 ASP B 23 -4.788 -7.019 -7.859 1.00 0.00 O ATOM 2075 OD2 ASP B 23 -6.198 -7.156 -9.540 1.00 0.00 O ATOM 0 H ASP B 23 -6.219 -8.806 -6.012 1.00 0.00 H new ATOM 0 HA ASP B 23 -5.820 -6.040 -5.886 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -7.713 -7.855 -7.412 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -7.750 -6.118 -7.642 1.00 0.00 H new ATOM 2080 N VAL B 24 -7.512 -5.113 -4.312 1.00 0.00 N ATOM 2081 CA VAL B 24 -8.541 -4.498 -3.472 1.00 0.00 C ATOM 2082 C VAL B 24 -8.232 -3.043 -3.133 1.00 0.00 C ATOM 2083 O VAL B 24 -7.286 -2.750 -2.404 1.00 0.00 O ATOM 2084 CB VAL B 24 -8.763 -5.311 -2.180 1.00 0.00 C ATOM 2085 CG1 VAL B 24 -7.434 -5.689 -1.544 1.00 0.00 C ATOM 2086 CG2 VAL B 24 -9.646 -4.556 -1.193 1.00 0.00 C ATOM 0 H VAL B 24 -6.597 -4.666 -4.262 1.00 0.00 H new ATOM 0 HA VAL B 24 -9.460 -4.506 -4.058 1.00 0.00 H new ATOM 0 HB VAL B 24 -9.283 -6.230 -2.451 1.00 0.00 H new ATOM 0 HG11 VAL B 24 -7.616 -6.262 -0.635 1.00 0.00 H new ATOM 0 HG12 VAL B 24 -6.855 -6.292 -2.243 1.00 0.00 H new ATOM 0 HG13 VAL B 24 -6.878 -4.784 -1.298 1.00 0.00 H new ATOM 0 HG21 VAL B 24 -9.783 -5.157 -0.294 1.00 0.00 H new ATOM 0 HG22 VAL B 24 -9.171 -3.611 -0.929 1.00 0.00 H new ATOM 0 HG23 VAL B 24 -10.616 -4.360 -1.649 1.00 0.00 H new ATOM 2096 N GLN B 25 -9.078 -2.150 -3.649 1.00 0.00 N ATOM 2097 CA GLN B 25 -8.970 -0.711 -3.408 1.00 0.00 C ATOM 2098 C GLN B 25 -9.766 0.071 -4.453 1.00 0.00 C ATOM 2099 O GLN B 25 -10.979 0.233 -4.320 1.00 0.00 O ATOM 2100 CB GLN B 25 -7.510 -0.239 -3.375 1.00 0.00 C ATOM 2101 CG GLN B 25 -7.357 1.271 -3.254 1.00 0.00 C ATOM 2102 CD GLN B 25 -6.519 1.872 -4.366 1.00 0.00 C ATOM 2103 OE1 GLN B 25 -7.170 2.579 -5.280 1.00 0.00 O flip ATOM 2104 NE2 GLN B 25 -5.300 1.706 -4.400 1.00 0.00 N flip ATOM 0 H GLN B 25 -9.862 -2.407 -4.249 1.00 0.00 H new ATOM 0 HA GLN B 25 -9.395 -0.515 -2.424 1.00 0.00 H new ATOM 0 HB2 GLN B 25 -7.003 -0.715 -2.536 1.00 0.00 H new ATOM 0 HB3 GLN B 25 -7.008 -0.574 -4.283 1.00 0.00 H new ATOM 0 HG2 GLN B 25 -8.344 1.733 -3.261 1.00 0.00 H new ATOM 0 HG3 GLN B 25 -6.900 1.509 -2.293 1.00 0.00 H new ATOM 0 HE21 GLN B 25 -4.840 1.154 -3.676 1.00 0.00 H new ATOM 0 HE22 GLN B 25 -4.750 2.120 -5.152 1.00 0.00 H new ATOM 2113 N SER B 26 -9.088 0.553 -5.490 1.00 0.00 N ATOM 2114 CA SER B 26 -9.761 1.313 -6.545 1.00 0.00 C ATOM 2115 C SER B 26 -10.671 0.433 -7.375 1.00 0.00 C ATOM 2116 O SER B 26 -10.215 -0.217 -8.311 1.00 0.00 O ATOM 2117 CB SER B 26 -8.771 1.967 -7.499 1.00 0.00 C ATOM 2118 OG SER B 26 -7.574 1.214 -7.597 1.00 0.00 O ATOM 0 H SER B 26 -8.084 0.434 -5.625 1.00 0.00 H new ATOM 0 HA SER B 26 -10.341 2.077 -6.027 1.00 0.00 H new ATOM 0 HB2 SER B 26 -9.224 2.064 -8.486 1.00 0.00 H new ATOM 0 HB3 SER B 26 -8.542 2.975 -7.153 1.00 0.00 H new ATOM 0 HG SER B 26 -6.965 1.473 -6.874 1.00 0.00 H new ATOM 2124 N ASP B 27 -11.960 0.443 -7.081 1.00 0.00 N ATOM 2125 CA ASP B 27 -12.890 -0.333 -7.881 1.00 0.00 C ATOM 2126 C ASP B 27 -12.872 0.223 -9.300 1.00 0.00 C ATOM 2127 O ASP B 27 -13.067 -0.503 -10.274 1.00 0.00 O ATOM 2128 CB ASP B 27 -14.302 -0.273 -7.294 1.00 0.00 C ATOM 2129 CG ASP B 27 -15.299 -1.078 -8.105 1.00 0.00 C ATOM 2130 OD1 ASP B 27 -15.054 -2.284 -8.320 1.00 0.00 O ATOM 2131 OD2 ASP B 27 -16.325 -0.503 -8.524 1.00 0.00 O ATOM 0 H ASP B 27 -12.379 0.967 -6.313 1.00 0.00 H new ATOM 0 HA ASP B 27 -12.588 -1.380 -7.885 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -14.283 -0.647 -6.271 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -14.630 0.766 -7.248 1.00 0.00 H new ATOM 2136 N LEU B 28 -12.603 1.528 -9.396 1.00 0.00 N ATOM 2137 CA LEU B 28 -12.516 2.207 -10.678 1.00 0.00 C ATOM 2138 C LEU B 28 -11.117 2.074 -11.252 1.00 0.00 C ATOM 2139 O LEU B 28 -10.925 1.578 -12.362 1.00 0.00 O ATOM 2140 CB LEU B 28 -12.884 3.684 -10.528 1.00 0.00 C ATOM 2141 CG LEU B 28 -14.108 3.961 -9.652 1.00 0.00 C ATOM 2142 CD1 LEU B 28 -13.855 5.153 -8.741 1.00 0.00 C ATOM 2143 CD2 LEU B 28 -15.339 4.197 -10.514 1.00 0.00 C ATOM 0 H LEU B 28 -12.442 2.133 -8.591 1.00 0.00 H new ATOM 0 HA LEU B 28 -13.223 1.739 -11.363 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -12.029 4.215 -10.109 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -13.064 4.100 -11.519 1.00 0.00 H new ATOM 0 HG LEU B 28 -14.289 3.086 -9.028 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -14.736 5.334 -8.126 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -13.000 4.944 -8.098 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -13.647 6.036 -9.346 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -16.199 4.392 -9.874 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -15.169 5.055 -11.165 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -15.532 3.313 -11.122 1.00 0.00 H new ATOM 2155 N LEU B 29 -10.143 2.507 -10.469 1.00 0.00 N ATOM 2156 CA LEU B 29 -8.743 2.435 -10.856 1.00 0.00 C ATOM 2157 C LEU B 29 -8.160 1.079 -10.475 1.00 0.00 C ATOM 2158 O LEU B 29 -6.989 0.977 -10.108 1.00 0.00 O ATOM 2159 CB LEU B 29 -7.965 3.543 -10.153 1.00 0.00 C ATOM 2160 CG LEU B 29 -8.405 4.957 -10.512 1.00 0.00 C ATOM 2161 CD1 LEU B 29 -7.878 5.958 -9.496 1.00 0.00 C ATOM 2162 CD2 LEU B 29 -7.942 5.321 -11.915 1.00 0.00 C ATOM 0 H LEU B 29 -10.300 2.918 -9.549 1.00 0.00 H new ATOM 0 HA LEU B 29 -8.665 2.561 -11.936 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -8.063 3.409 -9.076 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -6.907 3.434 -10.393 1.00 0.00 H new ATOM 0 HG LEU B 29 -9.494 4.992 -10.491 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -8.204 6.961 -9.771 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -8.263 5.710 -8.507 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -6.789 5.922 -9.481 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -8.266 6.334 -12.154 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -6.855 5.266 -11.965 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -8.374 4.624 -12.633 1.00 0.00 H new ATOM 2174 N ASP B 30 -8.994 0.046 -10.528 1.00 0.00 N ATOM 2175 CA ASP B 30 -8.568 -1.293 -10.149 1.00 0.00 C ATOM 2176 C ASP B 30 -7.431 -1.802 -11.033 1.00 0.00 C ATOM 2177 O ASP B 30 -6.342 -2.070 -10.541 1.00 0.00 O ATOM 2178 CB ASP B 30 -9.758 -2.260 -10.191 1.00 0.00 C ATOM 2179 CG ASP B 30 -10.664 -2.022 -11.385 1.00 0.00 C ATOM 2180 OD1 ASP B 30 -10.188 -1.452 -12.389 1.00 0.00 O ATOM 2181 OD2 ASP B 30 -11.852 -2.403 -11.314 1.00 0.00 O ATOM 0 H ASP B 30 -9.966 0.112 -10.829 1.00 0.00 H new ATOM 0 HA ASP B 30 -8.187 -1.242 -9.129 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -9.387 -3.285 -10.220 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -10.338 -2.156 -9.274 1.00 0.00 H new ATOM 2186 N ASN B 31 -7.661 -1.911 -12.330 1.00 0.00 N ATOM 2187 CA ASN B 31 -6.607 -2.364 -13.237 1.00 0.00 C ATOM 2188 C ASN B 31 -6.344 -1.331 -14.313 1.00 0.00 C ATOM 2189 O ASN B 31 -5.541 -1.550 -15.221 1.00 0.00 O ATOM 2190 CB ASN B 31 -6.947 -3.725 -13.859 1.00 0.00 C ATOM 2191 CG ASN B 31 -7.823 -3.616 -15.098 1.00 0.00 C ATOM 2192 OD1 ASN B 31 -9.017 -3.057 -14.938 1.00 0.00 O flip ATOM 2193 ND2 ASN B 31 -7.427 -4.030 -16.187 1.00 0.00 N flip ATOM 0 H ASN B 31 -8.552 -1.697 -12.779 1.00 0.00 H new ATOM 0 HA ASN B 31 -5.697 -2.488 -12.650 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -6.022 -4.239 -14.120 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -7.455 -4.340 -13.116 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -6.502 -4.453 -16.266 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -8.023 -3.950 -17.011 1.00 0.00 H new ATOM 2200 N LEU B 32 -7.014 -0.198 -14.196 1.00 0.00 N ATOM 2201 CA LEU B 32 -6.840 0.886 -15.152 1.00 0.00 C ATOM 2202 C LEU B 32 -5.367 1.159 -15.340 1.00 0.00 C ATOM 2203 O LEU B 32 -4.808 0.974 -16.421 1.00 0.00 O ATOM 2204 CB LEU B 32 -7.501 2.164 -14.652 1.00 0.00 C ATOM 2205 CG LEU B 32 -8.652 2.686 -15.513 1.00 0.00 C ATOM 2206 CD1 LEU B 32 -9.670 3.420 -14.655 1.00 0.00 C ATOM 2207 CD2 LEU B 32 -8.124 3.595 -16.613 1.00 0.00 C ATOM 0 H LEU B 32 -7.683 -0.003 -13.451 1.00 0.00 H new ATOM 0 HA LEU B 32 -7.301 0.585 -16.093 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -7.874 1.989 -13.643 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -6.741 2.942 -14.580 1.00 0.00 H new ATOM 0 HG LEU B 32 -9.148 1.834 -15.979 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.482 3.784 -15.285 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -10.071 2.739 -13.904 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -9.188 4.263 -14.160 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -8.956 3.958 -17.216 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -7.603 4.442 -16.166 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -7.433 3.037 -17.246 1.00 0.00 H new ATOM 2219 N ASN B 33 -4.749 1.609 -14.260 1.00 0.00 N ATOM 2220 CA ASN B 33 -3.342 1.920 -14.273 1.00 0.00 C ATOM 2221 C ASN B 33 -2.581 1.130 -13.207 1.00 0.00 C ATOM 2222 O ASN B 33 -1.375 0.934 -13.330 1.00 0.00 O ATOM 2223 CB ASN B 33 -3.130 3.419 -14.058 1.00 0.00 C ATOM 2224 CG ASN B 33 -3.273 4.214 -15.341 1.00 0.00 C ATOM 2225 OD1 ASN B 33 -2.366 4.241 -16.173 1.00 0.00 O ATOM 2226 ND2 ASN B 33 -4.418 4.867 -15.509 1.00 0.00 N ATOM 0 H ASN B 33 -5.208 1.765 -13.363 1.00 0.00 H new ATOM 0 HA ASN B 33 -2.950 1.634 -15.249 1.00 0.00 H new ATOM 0 HB2 ASN B 33 -3.851 3.784 -13.326 1.00 0.00 H new ATOM 0 HB3 ASN B 33 -2.138 3.586 -13.639 1.00 0.00 H new ATOM 0 HD21 ASN B 33 -4.572 5.418 -16.353 1.00 0.00 H new ATOM 0 HD22 ASN B 33 -5.143 4.817 -14.794 1.00 0.00 H new ATOM 2233 N THR B 34 -3.294 0.672 -12.167 1.00 0.00 N ATOM 2234 CA THR B 34 -2.675 -0.096 -11.078 1.00 0.00 C ATOM 2235 C THR B 34 -3.744 -0.670 -10.160 1.00 0.00 C ATOM 2236 O THR B 34 -4.931 -0.418 -10.349 1.00 0.00 O ATOM 2237 CB THR B 34 -1.733 0.772 -10.234 1.00 0.00 C ATOM 2238 OG1 THR B 34 -2.420 1.896 -9.715 1.00 0.00 O ATOM 2239 CG2 THR B 34 -0.519 1.284 -10.978 1.00 0.00 C ATOM 0 H THR B 34 -4.297 0.820 -12.058 1.00 0.00 H new ATOM 0 HA THR B 34 -2.101 -0.897 -11.543 1.00 0.00 H new ATOM 0 HB THR B 34 -1.385 0.108 -9.443 1.00 0.00 H new ATOM 0 HG1 THR B 34 -1.818 2.408 -9.136 1.00 0.00 H new ATOM 0 HG21 THR B 34 0.091 1.888 -10.306 1.00 0.00 H new ATOM 0 HG22 THR B 34 0.068 0.440 -11.342 1.00 0.00 H new ATOM 0 HG23 THR B 34 -0.840 1.893 -11.823 1.00 0.00 H new ATOM 2247 N ARG B 35 -3.313 -1.421 -9.148 1.00 0.00 N ATOM 2248 CA ARG B 35 -4.236 -2.013 -8.185 1.00 0.00 C ATOM 2249 C ARG B 35 -3.581 -2.191 -6.821 1.00 0.00 C ATOM 2250 O ARG B 35 -2.415 -2.578 -6.733 1.00 0.00 O ATOM 2251 CB ARG B 35 -4.717 -3.379 -8.675 1.00 0.00 C ATOM 2252 CG ARG B 35 -5.839 -3.962 -7.831 1.00 0.00 C ATOM 2253 CD ARG B 35 -7.122 -4.113 -8.634 1.00 0.00 C ATOM 2254 NE ARG B 35 -8.319 -3.943 -7.814 1.00 0.00 N ATOM 2255 CZ ARG B 35 -8.618 -2.824 -7.163 1.00 0.00 C ATOM 2256 NH1 ARG B 35 -7.795 -1.786 -7.199 1.00 0.00 N ATOM 2257 NH2 ARG B 35 -9.746 -2.742 -6.473 1.00 0.00 N ATOM 0 H ARG B 35 -2.330 -1.633 -8.975 1.00 0.00 H new ATOM 0 HA ARG B 35 -5.080 -1.330 -8.089 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -5.058 -3.287 -9.706 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -3.876 -4.073 -8.678 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -5.536 -4.934 -7.442 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -6.021 -3.318 -6.971 1.00 0.00 H new ATOM 0 HD2 ARG B 35 -7.131 -3.379 -9.440 1.00 0.00 H new ATOM 0 HD3 ARG B 35 -7.141 -5.098 -9.100 1.00 0.00 H new ATOM 0 HE ARG B 35 -8.963 -4.730 -7.737 1.00 0.00 H new ATOM 0 HH11 ARG B 35 -6.925 -1.843 -7.729 1.00 0.00 H new ATOM 0 HH12 ARG B 35 -8.031 -0.930 -6.697 1.00 0.00 H new ATOM 0 HH21 ARG B 35 -10.384 -3.537 -6.442 1.00 0.00 H new ATOM 0 HH22 ARG B 35 -9.977 -1.883 -5.973 1.00 0.00 H new ATOM 2271 N LEU B 36 -4.343 -1.955 -5.755 1.00 0.00 N ATOM 2272 CA LEU B 36 -3.821 -2.147 -4.409 1.00 0.00 C ATOM 2273 C LEU B 36 -3.953 -3.618 -4.058 1.00 0.00 C ATOM 2274 O LEU B 36 -4.751 -4.325 -4.673 1.00 0.00 O ATOM 2275 CB LEU B 36 -4.583 -1.296 -3.399 1.00 0.00 C ATOM 2276 CG LEU B 36 -3.885 -1.103 -2.052 1.00 0.00 C ATOM 2277 CD1 LEU B 36 -2.460 -0.610 -2.252 1.00 0.00 C ATOM 2278 CD2 LEU B 36 -4.669 -0.133 -1.181 1.00 0.00 C ATOM 0 H LEU B 36 -5.311 -1.635 -5.798 1.00 0.00 H new ATOM 0 HA LEU B 36 -2.776 -1.838 -4.375 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -4.766 -0.316 -3.839 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -5.557 -1.754 -3.223 1.00 0.00 H new ATOM 0 HG LEU B 36 -3.845 -2.067 -1.545 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -1.981 -0.479 -1.282 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -1.901 -1.340 -2.837 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -2.476 0.343 -2.781 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -4.158 -0.007 -0.226 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -4.741 0.831 -1.684 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -5.670 -0.527 -1.008 1.00 0.00 H new ATOM 2290 N VAL B 37 -3.175 -4.104 -3.099 1.00 0.00 N ATOM 2291 CA VAL B 37 -3.262 -5.514 -2.761 1.00 0.00 C ATOM 2292 C VAL B 37 -2.872 -5.845 -1.336 1.00 0.00 C ATOM 2293 O VAL B 37 -2.038 -5.182 -0.721 1.00 0.00 O ATOM 2294 CB VAL B 37 -2.361 -6.367 -3.670 1.00 0.00 C ATOM 2295 CG1 VAL B 37 -2.883 -6.374 -5.100 1.00 0.00 C ATOM 2296 CG2 VAL B 37 -0.920 -5.869 -3.617 1.00 0.00 C ATOM 0 H VAL B 37 -2.500 -3.563 -2.559 1.00 0.00 H new ATOM 0 HA VAL B 37 -4.318 -5.745 -2.898 1.00 0.00 H new ATOM 0 HB VAL B 37 -2.380 -7.393 -3.303 1.00 0.00 H new ATOM 0 HG11 VAL B 37 -2.229 -6.984 -5.723 1.00 0.00 H new ATOM 0 HG12 VAL B 37 -3.891 -6.789 -5.117 1.00 0.00 H new ATOM 0 HG13 VAL B 37 -2.904 -5.354 -5.485 1.00 0.00 H new ATOM 0 HG21 VAL B 37 -0.298 -6.485 -4.266 1.00 0.00 H new ATOM 0 HG22 VAL B 37 -0.881 -4.833 -3.953 1.00 0.00 H new ATOM 0 HG23 VAL B 37 -0.550 -5.933 -2.594 1.00 0.00 H new ATOM 2306 N ILE B 38 -3.428 -6.955 -0.871 1.00 0.00 N ATOM 2307 CA ILE B 38 -3.100 -7.496 0.427 1.00 0.00 C ATOM 2308 C ILE B 38 -2.284 -8.746 0.142 1.00 0.00 C ATOM 2309 O ILE B 38 -2.834 -9.827 -0.070 1.00 0.00 O ATOM 2310 CB ILE B 38 -4.354 -7.872 1.248 1.00 0.00 C ATOM 2311 CG1 ILE B 38 -5.520 -6.925 0.942 1.00 0.00 C ATOM 2312 CG2 ILE B 38 -4.035 -7.853 2.734 1.00 0.00 C ATOM 2313 CD1 ILE B 38 -6.878 -7.576 1.090 1.00 0.00 C ATOM 0 H ILE B 38 -4.118 -7.501 -1.388 1.00 0.00 H new ATOM 0 HA ILE B 38 -2.563 -6.756 1.021 1.00 0.00 H new ATOM 0 HB ILE B 38 -4.655 -8.880 0.963 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -5.464 -6.064 1.608 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -5.415 -6.548 -0.075 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -4.927 -8.120 3.301 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -3.243 -8.571 2.945 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -3.706 -6.855 3.023 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -7.657 -6.849 0.859 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -6.954 -8.420 0.404 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -7.003 -7.928 2.114 1.00 0.00 H new ATOM 2325 N PRO B 39 -0.957 -8.592 0.052 1.00 0.00 N ATOM 2326 CA PRO B 39 -0.056 -9.683 -0.303 1.00 0.00 C ATOM 2327 C PRO B 39 -0.263 -10.967 0.502 1.00 0.00 C ATOM 2328 O PRO B 39 0.308 -11.133 1.572 1.00 0.00 O ATOM 2329 CB PRO B 39 1.345 -9.117 -0.047 1.00 0.00 C ATOM 2330 CG PRO B 39 1.158 -7.753 0.541 1.00 0.00 C ATOM 2331 CD PRO B 39 -0.236 -7.320 0.200 1.00 0.00 C ATOM 0 HA PRO B 39 -0.233 -9.989 -1.334 1.00 0.00 H new ATOM 0 HB2 PRO B 39 1.903 -9.759 0.635 1.00 0.00 H new ATOM 0 HB3 PRO B 39 1.916 -9.064 -0.974 1.00 0.00 H new ATOM 0 HG2 PRO B 39 1.302 -7.775 1.621 1.00 0.00 H new ATOM 0 HG3 PRO B 39 1.890 -7.054 0.136 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -0.669 -6.701 0.986 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -0.262 -6.733 -0.718 1.00 0.00 H new ATOM 2339 N LEU B 40 -1.048 -11.893 -0.041 1.00 0.00 N ATOM 2340 CA LEU B 40 -1.284 -13.177 0.617 1.00 0.00 C ATOM 2341 C LEU B 40 0.005 -13.965 0.694 1.00 0.00 C ATOM 2342 O LEU B 40 0.908 -13.777 -0.120 1.00 0.00 O ATOM 2343 CB LEU B 40 -2.325 -13.987 -0.152 1.00 0.00 C ATOM 2344 CG LEU B 40 -3.764 -13.537 0.040 1.00 0.00 C ATOM 2345 CD1 LEU B 40 -4.642 -14.082 -1.076 1.00 0.00 C ATOM 2346 CD2 LEU B 40 -4.283 -13.980 1.400 1.00 0.00 C ATOM 0 H LEU B 40 -1.531 -11.780 -0.932 1.00 0.00 H new ATOM 0 HA LEU B 40 -1.654 -12.984 1.624 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -2.085 -13.942 -1.214 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -2.244 -15.032 0.149 1.00 0.00 H new ATOM 0 HG LEU B 40 -3.797 -12.448 0.001 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -5.670 -13.751 -0.925 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -4.280 -13.714 -2.036 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -4.606 -15.171 -1.068 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -5.315 -13.650 1.521 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -4.240 -15.067 1.470 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -3.667 -13.541 2.185 1.00 0.00 H new ATOM 2358 N THR B 41 0.095 -14.842 1.679 1.00 0.00 N ATOM 2359 CA THR B 41 1.288 -15.645 1.844 1.00 0.00 C ATOM 2360 C THR B 41 1.018 -16.896 2.668 1.00 0.00 C ATOM 2361 O THR B 41 -0.007 -17.001 3.337 1.00 0.00 O ATOM 2362 CB THR B 41 2.407 -14.793 2.428 1.00 0.00 C ATOM 2363 OG1 THR B 41 3.320 -15.568 3.185 1.00 0.00 O ATOM 2364 CG2 THR B 41 1.934 -13.656 3.314 1.00 0.00 C ATOM 0 H THR B 41 -0.637 -15.013 2.369 1.00 0.00 H new ATOM 0 HA THR B 41 1.610 -15.998 0.864 1.00 0.00 H new ATOM 0 HB THR B 41 2.888 -14.366 1.548 1.00 0.00 H new ATOM 0 HG1 THR B 41 4.024 -14.988 3.542 1.00 0.00 H new ATOM 0 HG21 THR B 41 2.796 -13.102 3.686 1.00 0.00 H new ATOM 0 HG22 THR B 41 1.294 -12.987 2.738 1.00 0.00 H new ATOM 0 HG23 THR B 41 1.371 -14.060 4.155 1.00 0.00 H new ATOM 2372 N PRO B 42 1.923 -17.884 2.605 1.00 0.00 N ATOM 2373 CA PRO B 42 1.759 -19.149 3.320 1.00 0.00 C ATOM 2374 C PRO B 42 1.960 -19.032 4.810 1.00 0.00 C ATOM 2375 O PRO B 42 3.061 -18.790 5.305 1.00 0.00 O ATOM 2376 CB PRO B 42 2.825 -20.026 2.666 1.00 0.00 C ATOM 2377 CG PRO B 42 3.905 -19.062 2.365 1.00 0.00 C ATOM 2378 CD PRO B 42 3.171 -17.879 1.811 1.00 0.00 C ATOM 0 HA PRO B 42 0.746 -19.545 3.244 1.00 0.00 H new ATOM 0 HB2 PRO B 42 3.164 -20.817 3.335 1.00 0.00 H new ATOM 0 HB3 PRO B 42 2.452 -20.510 1.763 1.00 0.00 H new ATOM 0 HG2 PRO B 42 4.471 -18.801 3.259 1.00 0.00 H new ATOM 0 HG3 PRO B 42 4.616 -19.467 1.645 1.00 0.00 H new ATOM 0 HD2 PRO B 42 3.733 -16.954 1.942 1.00 0.00 H new ATOM 0 HD3 PRO B 42 2.975 -17.985 0.744 1.00 0.00 H new ATOM 2386 N ILE B 43 0.858 -19.235 5.510 1.00 0.00 N ATOM 2387 CA ILE B 43 0.819 -19.194 6.953 1.00 0.00 C ATOM 2388 C ILE B 43 2.005 -19.942 7.548 1.00 0.00 C ATOM 2389 O ILE B 43 2.619 -19.503 8.521 1.00 0.00 O ATOM 2390 CB ILE B 43 -0.500 -19.827 7.431 1.00 0.00 C ATOM 2391 CG1 ILE B 43 -1.574 -18.761 7.490 1.00 0.00 C ATOM 2392 CG2 ILE B 43 -0.323 -20.547 8.759 1.00 0.00 C ATOM 2393 CD1 ILE B 43 -2.875 -19.256 8.073 1.00 0.00 C ATOM 0 H ILE B 43 -0.046 -19.436 5.082 1.00 0.00 H new ATOM 0 HA ILE B 43 0.876 -18.157 7.285 1.00 0.00 H new ATOM 0 HB ILE B 43 -0.813 -20.589 6.717 1.00 0.00 H new ATOM 0 HG12 ILE B 43 -1.212 -17.923 8.086 1.00 0.00 H new ATOM 0 HG13 ILE B 43 -1.755 -18.382 6.484 1.00 0.00 H new ATOM 0 HG21 ILE B 43 -1.274 -20.982 9.067 1.00 0.00 H new ATOM 0 HG22 ILE B 43 0.419 -21.338 8.648 1.00 0.00 H new ATOM 0 HG23 ILE B 43 0.013 -19.838 9.515 1.00 0.00 H new ATOM 0 HD11 ILE B 43 -3.601 -18.443 8.086 1.00 0.00 H new ATOM 0 HD12 ILE B 43 -3.259 -20.075 7.464 1.00 0.00 H new ATOM 0 HD13 ILE B 43 -2.707 -19.609 9.091 1.00 0.00 H new ATOM 2405 N GLU B 44 2.308 -21.075 6.943 1.00 0.00 N ATOM 2406 CA GLU B 44 3.407 -21.922 7.371 1.00 0.00 C ATOM 2407 C GLU B 44 4.714 -21.139 7.466 1.00 0.00 C ATOM 2408 O GLU B 44 5.464 -21.281 8.432 1.00 0.00 O ATOM 2409 CB GLU B 44 3.543 -23.072 6.382 1.00 0.00 C ATOM 2410 CG GLU B 44 3.167 -24.426 6.963 1.00 0.00 C ATOM 2411 CD GLU B 44 4.019 -24.807 8.159 1.00 0.00 C ATOM 2412 OE1 GLU B 44 4.730 -23.927 8.688 1.00 0.00 O ATOM 2413 OE2 GLU B 44 3.976 -25.987 8.567 1.00 0.00 O ATOM 0 H GLU B 44 1.797 -21.436 6.137 1.00 0.00 H new ATOM 0 HA GLU B 44 3.194 -22.308 8.368 1.00 0.00 H new ATOM 0 HB2 GLU B 44 2.913 -22.871 5.516 1.00 0.00 H new ATOM 0 HB3 GLU B 44 4.572 -23.113 6.025 1.00 0.00 H new ATOM 0 HG2 GLU B 44 2.118 -24.411 7.259 1.00 0.00 H new ATOM 0 HG3 GLU B 44 3.269 -25.189 6.191 1.00 0.00 H new ATOM 2420 N LEU B 45 4.981 -20.312 6.461 1.00 0.00 N ATOM 2421 CA LEU B 45 6.198 -19.509 6.439 1.00 0.00 C ATOM 2422 C LEU B 45 6.167 -18.437 7.525 1.00 0.00 C ATOM 2423 O LEU B 45 7.212 -17.979 7.987 1.00 0.00 O ATOM 2424 CB LEU B 45 6.381 -18.856 5.068 1.00 0.00 C ATOM 2425 CG LEU B 45 6.614 -19.830 3.911 1.00 0.00 C ATOM 2426 CD1 LEU B 45 6.890 -19.071 2.622 1.00 0.00 C ATOM 2427 CD2 LEU B 45 7.763 -20.774 4.232 1.00 0.00 C ATOM 0 H LEU B 45 4.373 -20.180 5.653 1.00 0.00 H new ATOM 0 HA LEU B 45 7.041 -20.172 6.634 1.00 0.00 H new ATOM 0 HB2 LEU B 45 5.497 -18.258 4.847 1.00 0.00 H new ATOM 0 HB3 LEU B 45 7.226 -18.169 5.120 1.00 0.00 H new ATOM 0 HG LEU B 45 5.710 -20.423 3.773 1.00 0.00 H new ATOM 0 HD11 LEU B 45 7.053 -19.780 1.810 1.00 0.00 H new ATOM 0 HD12 LEU B 45 6.036 -18.436 2.384 1.00 0.00 H new ATOM 0 HD13 LEU B 45 7.778 -18.452 2.747 1.00 0.00 H new ATOM 0 HD21 LEU B 45 7.914 -21.460 3.398 1.00 0.00 H new ATOM 0 HD22 LEU B 45 8.673 -20.197 4.397 1.00 0.00 H new ATOM 0 HD23 LEU B 45 7.526 -21.343 5.131 1.00 0.00 H new ATOM 2439 N LEU B 46 4.963 -18.040 7.928 1.00 0.00 N ATOM 2440 CA LEU B 46 4.802 -17.020 8.958 1.00 0.00 C ATOM 2441 C LEU B 46 4.164 -17.606 10.215 1.00 0.00 C ATOM 2442 O LEU B 46 3.318 -16.971 10.846 1.00 0.00 O ATOM 2443 CB LEU B 46 3.949 -15.864 8.430 1.00 0.00 C ATOM 2444 CG LEU B 46 4.345 -14.479 8.943 1.00 0.00 C ATOM 2445 CD1 LEU B 46 5.467 -13.898 8.097 1.00 0.00 C ATOM 2446 CD2 LEU B 46 3.141 -13.549 8.948 1.00 0.00 C ATOM 0 H LEU B 46 4.087 -18.409 7.558 1.00 0.00 H new ATOM 0 HA LEU B 46 5.792 -16.645 9.219 1.00 0.00 H new ATOM 0 HB2 LEU B 46 4.003 -15.860 7.341 1.00 0.00 H new ATOM 0 HB3 LEU B 46 2.908 -16.049 8.697 1.00 0.00 H new ATOM 0 HG LEU B 46 4.705 -14.580 9.967 1.00 0.00 H new ATOM 0 HD11 LEU B 46 5.736 -12.912 8.477 1.00 0.00 H new ATOM 0 HD12 LEU B 46 6.336 -14.554 8.145 1.00 0.00 H new ATOM 0 HD13 LEU B 46 5.135 -13.810 7.063 1.00 0.00 H new ATOM 0 HD21 LEU B 46 3.441 -12.568 9.316 1.00 0.00 H new ATOM 0 HD22 LEU B 46 2.751 -13.453 7.935 1.00 0.00 H new ATOM 0 HD23 LEU B 46 2.367 -13.959 9.597 1.00 0.00 H new ATOM 2458 N ASP B 47 4.574 -18.821 10.573 1.00 0.00 N ATOM 2459 CA ASP B 47 4.046 -19.496 11.752 1.00 0.00 C ATOM 2460 C ASP B 47 2.678 -20.069 11.484 1.00 0.00 C ATOM 2461 O ASP B 47 1.734 -19.367 11.122 1.00 0.00 O ATOM 2462 CB ASP B 47 4.004 -18.563 12.964 1.00 0.00 C ATOM 2463 CG ASP B 47 5.199 -17.631 13.026 1.00 0.00 C ATOM 2464 OD1 ASP B 47 6.281 -18.020 12.539 1.00 0.00 O ATOM 2465 OD2 ASP B 47 5.052 -16.512 13.561 1.00 0.00 O ATOM 0 H ASP B 47 5.273 -19.358 10.060 1.00 0.00 H new ATOM 0 HA ASP B 47 4.725 -20.317 11.983 1.00 0.00 H new ATOM 0 HB2 ASP B 47 3.089 -17.972 12.931 1.00 0.00 H new ATOM 0 HB3 ASP B 47 3.966 -19.159 13.876 1.00 0.00 H new ATOM 2470 N LYS B 48 2.607 -21.371 11.659 1.00 0.00 N ATOM 2471 CA LYS B 48 1.394 -22.123 11.443 1.00 0.00 C ATOM 2472 C LYS B 48 0.589 -22.254 12.734 1.00 0.00 C ATOM 2473 O LYS B 48 -0.103 -23.250 12.948 1.00 0.00 O ATOM 2474 CB LYS B 48 1.782 -23.496 10.912 1.00 0.00 C ATOM 2475 CG LYS B 48 1.245 -23.795 9.522 1.00 0.00 C ATOM 2476 CD LYS B 48 -0.266 -23.944 9.521 1.00 0.00 C ATOM 2477 CE LYS B 48 -0.716 -25.090 10.413 1.00 0.00 C ATOM 2478 NZ LYS B 48 -0.049 -26.371 10.049 1.00 0.00 N ATOM 0 H LYS B 48 3.398 -21.941 11.958 1.00 0.00 H new ATOM 0 HA LYS B 48 0.761 -21.603 10.723 1.00 0.00 H new ATOM 0 HB2 LYS B 48 2.869 -23.574 10.895 1.00 0.00 H new ATOM 0 HB3 LYS B 48 1.419 -24.257 11.602 1.00 0.00 H new ATOM 0 HG2 LYS B 48 1.532 -22.993 8.841 1.00 0.00 H new ATOM 0 HG3 LYS B 48 1.701 -24.711 9.146 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -0.724 -23.015 9.862 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -0.615 -24.116 8.503 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -0.496 -24.849 11.453 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -1.797 -25.208 10.335 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -0.534 -27.161 10.521 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -0.092 -26.504 9.018 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 0.945 -26.343 10.353 1.00 0.00 H new ATOM 2492 N LYS B 49 0.690 -21.246 13.596 1.00 0.00 N ATOM 2493 CA LYS B 49 -0.022 -21.252 14.867 1.00 0.00 C ATOM 2494 C LYS B 49 -0.471 -19.845 15.249 1.00 0.00 C ATOM 2495 O LYS B 49 -1.640 -19.619 15.565 1.00 0.00 O ATOM 2496 CB LYS B 49 0.870 -21.829 15.968 1.00 0.00 C ATOM 2497 CG LYS B 49 2.306 -21.330 15.912 1.00 0.00 C ATOM 2498 CD LYS B 49 3.230 -22.198 16.751 1.00 0.00 C ATOM 2499 CE LYS B 49 4.661 -22.144 16.240 1.00 0.00 C ATOM 2500 NZ LYS B 49 4.850 -22.984 15.025 1.00 0.00 N ATOM 0 H LYS B 49 1.259 -20.415 13.436 1.00 0.00 H new ATOM 0 HA LYS B 49 -0.908 -21.878 14.756 1.00 0.00 H new ATOM 0 HB2 LYS B 49 0.444 -21.576 16.939 1.00 0.00 H new ATOM 0 HB3 LYS B 49 0.869 -22.916 15.893 1.00 0.00 H new ATOM 0 HG2 LYS B 49 2.650 -21.324 14.878 1.00 0.00 H new ATOM 0 HG3 LYS B 49 2.349 -20.301 16.268 1.00 0.00 H new ATOM 0 HD2 LYS B 49 3.200 -21.866 17.789 1.00 0.00 H new ATOM 0 HD3 LYS B 49 2.876 -23.229 16.736 1.00 0.00 H new ATOM 0 HE2 LYS B 49 4.926 -21.112 16.012 1.00 0.00 H new ATOM 0 HE3 LYS B 49 5.339 -22.482 17.024 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 5.852 -22.974 14.748 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 4.557 -23.961 15.229 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 4.272 -22.605 14.248 1.00 0.00 H new ATOM 2514 N ALA B 50 0.466 -18.902 15.221 1.00 0.00 N ATOM 2515 CA ALA B 50 0.173 -17.515 15.566 1.00 0.00 C ATOM 2516 C ALA B 50 -1.001 -16.974 14.749 1.00 0.00 C ATOM 2517 O ALA B 50 -0.864 -16.712 13.554 1.00 0.00 O ATOM 2518 CB ALA B 50 1.406 -16.650 15.353 1.00 0.00 C ATOM 0 H ALA B 50 1.437 -19.074 14.962 1.00 0.00 H new ATOM 0 HA ALA B 50 -0.109 -17.482 16.618 1.00 0.00 H new ATOM 0 HB1 ALA B 50 1.175 -15.617 15.614 1.00 0.00 H new ATOM 0 HB2 ALA B 50 2.217 -17.011 15.985 1.00 0.00 H new ATOM 0 HB3 ALA B 50 1.710 -16.701 14.308 1.00 0.00 H new ATOM 2524 N PRO B 51 -2.175 -16.795 15.383 1.00 0.00 N ATOM 2525 CA PRO B 51 -3.368 -16.281 14.702 1.00 0.00 C ATOM 2526 C PRO B 51 -3.126 -14.917 14.064 1.00 0.00 C ATOM 2527 O PRO B 51 -2.080 -14.302 14.271 1.00 0.00 O ATOM 2528 CB PRO B 51 -4.408 -16.168 15.822 1.00 0.00 C ATOM 2529 CG PRO B 51 -3.933 -17.100 16.883 1.00 0.00 C ATOM 2530 CD PRO B 51 -2.433 -17.078 16.806 1.00 0.00 C ATOM 0 HA PRO B 51 -3.677 -16.932 13.884 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -4.477 -15.146 16.196 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -5.401 -16.445 15.468 1.00 0.00 H new ATOM 0 HG2 PRO B 51 -4.279 -16.782 17.866 1.00 0.00 H new ATOM 0 HG3 PRO B 51 -4.318 -18.107 16.720 1.00 0.00 H new ATOM 0 HD2 PRO B 51 -2.007 -16.311 17.453 1.00 0.00 H new ATOM 0 HD3 PRO B 51 -2.000 -18.030 17.113 1.00 0.00 H new ATOM 2538 N SER B 52 -4.098 -14.450 13.288 1.00 0.00 N ATOM 2539 CA SER B 52 -3.989 -13.158 12.621 1.00 0.00 C ATOM 2540 C SER B 52 -5.309 -12.396 12.689 1.00 0.00 C ATOM 2541 O SER B 52 -6.354 -12.908 12.288 1.00 0.00 O ATOM 2542 CB SER B 52 -3.572 -13.347 11.162 1.00 0.00 C ATOM 2543 OG SER B 52 -2.241 -13.826 11.070 1.00 0.00 O ATOM 0 H SER B 52 -4.970 -14.947 13.105 1.00 0.00 H new ATOM 0 HA SER B 52 -3.227 -12.575 13.138 1.00 0.00 H new ATOM 0 HB2 SER B 52 -4.249 -14.049 10.675 1.00 0.00 H new ATOM 0 HB3 SER B 52 -3.658 -12.400 10.630 1.00 0.00 H new ATOM 0 HG SER B 52 -1.993 -13.925 10.127 1.00 0.00 H new ATOM 2549 N HIS B 53 -5.253 -11.170 13.199 1.00 0.00 N ATOM 2550 CA HIS B 53 -6.445 -10.337 13.319 1.00 0.00 C ATOM 2551 C HIS B 53 -6.603 -9.437 12.098 1.00 0.00 C ATOM 2552 O HIS B 53 -7.666 -9.398 11.477 1.00 0.00 O ATOM 2553 CB HIS B 53 -6.374 -9.486 14.589 1.00 0.00 C ATOM 2554 CG HIS B 53 -5.069 -8.772 14.759 1.00 0.00 C ATOM 2555 ND1 HIS B 53 -4.854 -7.482 14.321 1.00 0.00 N ATOM 2556 CD2 HIS B 53 -3.906 -9.174 15.326 1.00 0.00 C ATOM 2557 CE1 HIS B 53 -3.616 -7.122 14.609 1.00 0.00 C ATOM 2558 NE2 HIS B 53 -3.020 -8.130 15.219 1.00 0.00 N ATOM 0 H HIS B 53 -4.396 -10.731 13.536 1.00 0.00 H new ATOM 0 HA HIS B 53 -7.313 -10.994 13.380 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -7.180 -8.753 14.571 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -6.544 -10.126 15.455 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -3.712 -10.136 15.778 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -3.168 -6.166 14.384 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -2.057 -8.133 15.556 1.00 0.00 H new ATOM 2567 N LEU B 54 -5.540 -8.717 11.758 1.00 0.00 N ATOM 2568 CA LEU B 54 -5.560 -7.819 10.609 1.00 0.00 C ATOM 2569 C LEU B 54 -5.394 -8.599 9.309 1.00 0.00 C ATOM 2570 O LEU B 54 -5.935 -8.218 8.272 1.00 0.00 O ATOM 2571 CB LEU B 54 -4.449 -6.773 10.732 1.00 0.00 C ATOM 2572 CG LEU B 54 -4.716 -5.453 9.998 1.00 0.00 C ATOM 2573 CD1 LEU B 54 -5.245 -4.401 10.962 1.00 0.00 C ATOM 2574 CD2 LEU B 54 -3.455 -4.953 9.302 1.00 0.00 C ATOM 0 H LEU B 54 -4.653 -8.738 12.262 1.00 0.00 H new ATOM 0 HA LEU B 54 -6.526 -7.314 10.591 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -4.289 -6.558 11.788 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -3.523 -7.202 10.350 1.00 0.00 H new ATOM 0 HG LEU B 54 -5.475 -5.637 9.237 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -5.428 -3.472 10.422 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -6.176 -4.751 11.408 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -4.510 -4.225 11.748 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -3.670 -4.016 8.789 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -2.671 -4.790 10.042 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -3.121 -5.695 8.577 1.00 0.00 H new ATOM 2586 N CYS B 55 -4.639 -9.691 9.376 1.00 0.00 N ATOM 2587 CA CYS B 55 -4.393 -10.532 8.208 1.00 0.00 C ATOM 2588 C CYS B 55 -5.307 -11.756 8.213 1.00 0.00 C ATOM 2589 O CYS B 55 -5.053 -12.720 8.936 1.00 0.00 O ATOM 2590 CB CYS B 55 -2.930 -10.981 8.189 1.00 0.00 C ATOM 2591 SG CYS B 55 -1.740 -9.620 8.118 1.00 0.00 S ATOM 0 H CYS B 55 -4.185 -10.016 10.230 1.00 0.00 H new ATOM 0 HA CYS B 55 -4.607 -9.946 7.314 1.00 0.00 H new ATOM 0 HB2 CYS B 55 -2.732 -11.576 9.081 1.00 0.00 H new ATOM 0 HB3 CYS B 55 -2.772 -11.632 7.329 1.00 0.00 H new ATOM 0 HG CYS B 55 -0.541 -10.081 8.320 1.00 0.00 H new ATOM 2597 N PRO B 56 -6.391 -11.739 7.415 1.00 0.00 N ATOM 2598 CA PRO B 56 -7.332 -12.857 7.353 1.00 0.00 C ATOM 2599 C PRO B 56 -6.851 -13.989 6.449 1.00 0.00 C ATOM 2600 O PRO B 56 -6.617 -13.789 5.258 1.00 0.00 O ATOM 2601 CB PRO B 56 -8.588 -12.210 6.776 1.00 0.00 C ATOM 2602 CG PRO B 56 -8.076 -11.124 5.893 1.00 0.00 C ATOM 2603 CD PRO B 56 -6.795 -10.632 6.519 1.00 0.00 C ATOM 0 HA PRO B 56 -7.474 -13.326 8.327 1.00 0.00 H new ATOM 0 HB2 PRO B 56 -9.184 -12.930 6.215 1.00 0.00 H new ATOM 0 HB3 PRO B 56 -9.228 -11.813 7.564 1.00 0.00 H new ATOM 0 HG2 PRO B 56 -7.897 -11.496 4.884 1.00 0.00 H new ATOM 0 HG3 PRO B 56 -8.803 -10.316 5.810 1.00 0.00 H new ATOM 0 HD2 PRO B 56 -6.034 -10.429 5.766 1.00 0.00 H new ATOM 0 HD3 PRO B 56 -6.950 -9.706 7.072 1.00 0.00 H new ATOM 2611 N THR B 57 -6.721 -15.181 7.023 1.00 0.00 N ATOM 2612 CA THR B 57 -6.285 -16.356 6.273 1.00 0.00 C ATOM 2613 C THR B 57 -7.365 -16.820 5.344 1.00 0.00 C ATOM 2614 O THR B 57 -8.536 -16.474 5.507 1.00 0.00 O ATOM 2615 CB THR B 57 -5.955 -17.517 7.209 1.00 0.00 C ATOM 2616 OG1 THR B 57 -4.699 -17.328 7.828 1.00 0.00 O ATOM 2617 CG2 THR B 57 -5.936 -18.882 6.527 1.00 0.00 C ATOM 0 H THR B 57 -6.912 -15.360 8.009 1.00 0.00 H new ATOM 0 HA THR B 57 -5.397 -16.063 5.713 1.00 0.00 H new ATOM 0 HB THR B 57 -6.762 -17.516 7.941 1.00 0.00 H new ATOM 0 HG1 THR B 57 -4.798 -17.408 8.800 1.00 0.00 H new ATOM 0 HG21 THR B 57 -5.694 -19.652 7.260 1.00 0.00 H new ATOM 0 HG22 THR B 57 -6.916 -19.087 6.096 1.00 0.00 H new ATOM 0 HG23 THR B 57 -5.185 -18.884 5.737 1.00 0.00 H new ATOM 2625 N ILE B 58 -6.978 -17.654 4.396 1.00 0.00 N ATOM 2626 CA ILE B 58 -7.936 -18.202 3.497 1.00 0.00 C ATOM 2627 C ILE B 58 -7.877 -19.709 3.424 1.00 0.00 C ATOM 2628 O ILE B 58 -6.949 -20.345 3.919 1.00 0.00 O ATOM 2629 CB ILE B 58 -7.783 -17.690 2.065 1.00 0.00 C ATOM 2630 CG1 ILE B 58 -6.410 -18.087 1.537 1.00 0.00 C ATOM 2631 CG2 ILE B 58 -8.002 -16.185 1.992 1.00 0.00 C ATOM 2632 CD1 ILE B 58 -5.322 -17.203 2.076 1.00 0.00 C ATOM 0 H ILE B 58 -6.016 -17.955 4.242 1.00 0.00 H new ATOM 0 HA ILE B 58 -8.889 -17.876 3.912 1.00 0.00 H new ATOM 0 HB ILE B 58 -8.546 -18.146 1.435 1.00 0.00 H new ATOM 0 HG12 ILE B 58 -6.203 -19.122 1.808 1.00 0.00 H new ATOM 0 HG13 ILE B 58 -6.412 -18.036 0.448 1.00 0.00 H new ATOM 0 HG21 ILE B 58 -7.887 -15.850 0.961 1.00 0.00 H new ATOM 0 HG22 ILE B 58 -9.007 -15.946 2.341 1.00 0.00 H new ATOM 0 HG23 ILE B 58 -7.270 -15.680 2.622 1.00 0.00 H new ATOM 0 HD11 ILE B 58 -4.361 -17.522 1.673 1.00 0.00 H new ATOM 0 HD12 ILE B 58 -5.513 -16.171 1.783 1.00 0.00 H new ATOM 0 HD13 ILE B 58 -5.301 -17.274 3.164 1.00 0.00 H new ATOM 2644 N HIS B 59 -8.847 -20.252 2.712 1.00 0.00 N ATOM 2645 CA HIS B 59 -8.900 -21.669 2.449 1.00 0.00 C ATOM 2646 C HIS B 59 -9.154 -21.836 0.971 1.00 0.00 C ATOM 2647 O HIS B 59 -10.291 -21.988 0.524 1.00 0.00 O ATOM 2648 CB HIS B 59 -9.994 -22.354 3.243 1.00 0.00 C ATOM 2649 CG HIS B 59 -10.112 -21.876 4.657 1.00 0.00 C ATOM 2650 ND1 HIS B 59 -10.353 -20.559 4.989 1.00 0.00 N ATOM 2651 CD2 HIS B 59 -10.021 -22.546 5.830 1.00 0.00 C ATOM 2652 CE1 HIS B 59 -10.404 -20.440 6.304 1.00 0.00 C ATOM 2653 NE2 HIS B 59 -10.206 -21.631 6.837 1.00 0.00 N ATOM 0 H HIS B 59 -9.616 -19.721 2.303 1.00 0.00 H new ATOM 0 HA HIS B 59 -7.960 -22.131 2.750 1.00 0.00 H new ATOM 0 HB2 HIS B 59 -10.947 -22.199 2.737 1.00 0.00 H new ATOM 0 HB3 HIS B 59 -9.807 -23.428 3.248 1.00 0.00 H new ATOM 0 HD2 HIS B 59 -9.837 -23.603 5.951 1.00 0.00 H new ATOM 0 HE1 HIS B 59 -10.578 -19.524 6.850 1.00 0.00 H new ATOM 0 HE2 HIS B 59 -10.193 -21.838 7.836 1.00 0.00 H new ATOM 2662 N ILE B 60 -8.081 -21.756 0.223 1.00 0.00 N ATOM 2663 CA ILE B 60 -8.146 -21.841 -1.223 1.00 0.00 C ATOM 2664 C ILE B 60 -7.530 -23.135 -1.752 1.00 0.00 C ATOM 2665 O ILE B 60 -6.986 -23.935 -0.992 1.00 0.00 O ATOM 2666 CB ILE B 60 -7.444 -20.619 -1.836 1.00 0.00 C ATOM 2667 CG1 ILE B 60 -6.018 -20.505 -1.286 1.00 0.00 C ATOM 2668 CG2 ILE B 60 -8.244 -19.357 -1.512 1.00 0.00 C ATOM 2669 CD1 ILE B 60 -4.969 -20.249 -2.345 1.00 0.00 C ATOM 0 H ILE B 60 -7.139 -21.631 0.594 1.00 0.00 H new ATOM 0 HA ILE B 60 -9.196 -21.849 -1.516 1.00 0.00 H new ATOM 0 HB ILE B 60 -7.389 -20.736 -2.918 1.00 0.00 H new ATOM 0 HG12 ILE B 60 -5.985 -19.698 -0.554 1.00 0.00 H new ATOM 0 HG13 ILE B 60 -5.769 -21.425 -0.757 1.00 0.00 H new ATOM 0 HG21 ILE B 60 -7.747 -18.490 -1.946 1.00 0.00 H new ATOM 0 HG22 ILE B 60 -9.248 -19.446 -1.928 1.00 0.00 H new ATOM 0 HG23 ILE B 60 -8.308 -19.235 -0.431 1.00 0.00 H new ATOM 0 HD11 ILE B 60 -3.987 -20.181 -1.876 1.00 0.00 H new ATOM 0 HD12 ILE B 60 -4.971 -21.067 -3.065 1.00 0.00 H new ATOM 0 HD13 ILE B 60 -5.191 -19.314 -2.859 1.00 0.00 H new ATOM 2681 N ASP B 61 -7.645 -23.339 -3.063 1.00 0.00 N ATOM 2682 CA ASP B 61 -7.127 -24.542 -3.713 1.00 0.00 C ATOM 2683 C ASP B 61 -5.686 -24.840 -3.310 1.00 0.00 C ATOM 2684 O ASP B 61 -5.313 -25.999 -3.131 1.00 0.00 O ATOM 2685 CB ASP B 61 -7.220 -24.400 -5.233 1.00 0.00 C ATOM 2686 CG ASP B 61 -7.590 -25.704 -5.914 1.00 0.00 C ATOM 2687 OD1 ASP B 61 -8.798 -26.010 -5.993 1.00 0.00 O ATOM 2688 OD2 ASP B 61 -6.672 -26.418 -6.367 1.00 0.00 O ATOM 0 H ASP B 61 -8.096 -22.682 -3.700 1.00 0.00 H new ATOM 0 HA ASP B 61 -7.742 -25.379 -3.382 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -7.963 -23.641 -5.480 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -6.264 -24.049 -5.622 1.00 0.00 H new ATOM 2693 N GLU B 62 -4.877 -23.796 -3.170 1.00 0.00 N ATOM 2694 CA GLU B 62 -3.479 -23.970 -2.791 1.00 0.00 C ATOM 2695 C GLU B 62 -3.336 -24.206 -1.288 1.00 0.00 C ATOM 2696 O GLU B 62 -2.226 -24.372 -0.782 1.00 0.00 O ATOM 2697 CB GLU B 62 -2.659 -22.748 -3.211 1.00 0.00 C ATOM 2698 CG GLU B 62 -2.132 -22.829 -4.634 1.00 0.00 C ATOM 2699 CD GLU B 62 -0.659 -23.185 -4.690 1.00 0.00 C ATOM 2700 OE1 GLU B 62 -0.266 -24.186 -4.055 1.00 0.00 O ATOM 2701 OE2 GLU B 62 0.101 -22.463 -5.370 1.00 0.00 O ATOM 0 H GLU B 62 -5.162 -22.827 -3.312 1.00 0.00 H new ATOM 0 HA GLU B 62 -3.100 -24.851 -3.309 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -3.276 -21.855 -3.111 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -1.818 -22.632 -2.527 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -2.704 -23.574 -5.187 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -2.290 -21.872 -5.131 1.00 0.00 H new ATOM 2708 N GLY B 63 -4.461 -24.219 -0.575 1.00 0.00 N ATOM 2709 CA GLY B 63 -4.428 -24.434 0.859 1.00 0.00 C ATOM 2710 C GLY B 63 -4.760 -23.177 1.637 1.00 0.00 C ATOM 2711 O GLY B 63 -5.644 -22.414 1.247 1.00 0.00 O ATOM 0 H GLY B 63 -5.393 -24.084 -0.967 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -5.136 -25.219 1.123 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -3.438 -24.787 1.148 1.00 0.00 H new ATOM 2715 N ASP B 64 -4.049 -22.958 2.737 1.00 0.00 N ATOM 2716 CA ASP B 64 -4.274 -21.781 3.568 1.00 0.00 C ATOM 2717 C ASP B 64 -3.107 -20.808 3.454 1.00 0.00 C ATOM 2718 O ASP B 64 -1.958 -21.208 3.265 1.00 0.00 O ATOM 2719 CB ASP B 64 -4.472 -22.188 5.030 1.00 0.00 C ATOM 2720 CG ASP B 64 -5.779 -22.922 5.256 1.00 0.00 C ATOM 2721 OD1 ASP B 64 -6.674 -22.822 4.390 1.00 0.00 O ATOM 2722 OD2 ASP B 64 -5.908 -23.597 6.298 1.00 0.00 O ATOM 0 H ASP B 64 -3.313 -23.579 3.074 1.00 0.00 H new ATOM 0 HA ASP B 64 -5.177 -21.285 3.213 1.00 0.00 H new ATOM 0 HB2 ASP B 64 -3.643 -22.824 5.342 1.00 0.00 H new ATOM 0 HB3 ASP B 64 -4.445 -21.298 5.658 1.00 0.00 H new ATOM 2727 N PHE B 65 -3.423 -19.527 3.563 1.00 0.00 N ATOM 2728 CA PHE B 65 -2.433 -18.463 3.469 1.00 0.00 C ATOM 2729 C PHE B 65 -2.904 -17.274 4.302 1.00 0.00 C ATOM 2730 O PHE B 65 -3.888 -17.400 5.026 1.00 0.00 O ATOM 2731 CB PHE B 65 -2.188 -18.115 1.997 1.00 0.00 C ATOM 2732 CG PHE B 65 -1.843 -19.341 1.199 1.00 0.00 C ATOM 2733 CD1 PHE B 65 -0.528 -19.749 1.074 1.00 0.00 C ATOM 2734 CD2 PHE B 65 -2.837 -20.108 0.615 1.00 0.00 C ATOM 2735 CE1 PHE B 65 -0.204 -20.900 0.380 1.00 0.00 C ATOM 2736 CE2 PHE B 65 -2.522 -21.257 -0.088 1.00 0.00 C ATOM 2737 CZ PHE B 65 -1.203 -21.655 -0.204 1.00 0.00 C ATOM 0 H PHE B 65 -4.374 -19.194 3.719 1.00 0.00 H new ATOM 0 HA PHE B 65 -1.473 -18.782 3.875 1.00 0.00 H new ATOM 0 HB2 PHE B 65 -3.078 -17.644 1.579 1.00 0.00 H new ATOM 0 HB3 PHE B 65 -1.378 -17.389 1.922 1.00 0.00 H new ATOM 0 HD1 PHE B 65 0.257 -19.160 1.525 1.00 0.00 H new ATOM 0 HD2 PHE B 65 -3.870 -19.806 0.709 1.00 0.00 H new ATOM 0 HE1 PHE B 65 0.828 -21.208 0.295 1.00 0.00 H new ATOM 0 HE2 PHE B 65 -3.306 -21.843 -0.546 1.00 0.00 H new ATOM 0 HZ PHE B 65 -0.954 -22.553 -0.749 1.00 0.00 H new ATOM 2747 N ILE B 66 -2.214 -16.136 4.253 1.00 0.00 N ATOM 2748 CA ILE B 66 -2.634 -15.006 5.077 1.00 0.00 C ATOM 2749 C ILE B 66 -2.493 -13.675 4.363 1.00 0.00 C ATOM 2750 O ILE B 66 -1.412 -13.302 3.910 1.00 0.00 O ATOM 2751 CB ILE B 66 -1.861 -14.938 6.420 1.00 0.00 C ATOM 2752 CG1 ILE B 66 -0.579 -15.763 6.354 1.00 0.00 C ATOM 2753 CG2 ILE B 66 -2.738 -15.407 7.573 1.00 0.00 C ATOM 2754 CD1 ILE B 66 0.376 -15.264 5.303 1.00 0.00 C ATOM 0 H ILE B 66 -1.391 -15.974 3.673 1.00 0.00 H new ATOM 0 HA ILE B 66 -3.690 -15.183 5.280 1.00 0.00 H new ATOM 0 HB ILE B 66 -1.588 -13.898 6.597 1.00 0.00 H new ATOM 0 HG12 ILE B 66 -0.087 -15.742 7.326 1.00 0.00 H new ATOM 0 HG13 ILE B 66 -0.831 -16.803 6.147 1.00 0.00 H new ATOM 0 HG21 ILE B 66 -2.175 -15.351 8.505 1.00 0.00 H new ATOM 0 HG22 ILE B 66 -3.619 -14.769 7.642 1.00 0.00 H new ATOM 0 HG23 ILE B 66 -3.048 -16.437 7.398 1.00 0.00 H new ATOM 0 HD11 ILE B 66 1.271 -15.887 5.299 1.00 0.00 H new ATOM 0 HD12 ILE B 66 -0.103 -15.311 4.325 1.00 0.00 H new ATOM 0 HD13 ILE B 66 0.653 -14.233 5.523 1.00 0.00 H new ATOM 2766 N MET B 67 -3.599 -12.947 4.295 1.00 0.00 N ATOM 2767 CA MET B 67 -3.609 -11.640 3.673 1.00 0.00 C ATOM 2768 C MET B 67 -2.635 -10.727 4.400 1.00 0.00 C ATOM 2769 O MET B 67 -2.880 -10.343 5.542 1.00 0.00 O ATOM 2770 CB MET B 67 -5.017 -11.052 3.756 1.00 0.00 C ATOM 2771 CG MET B 67 -5.666 -10.802 2.414 1.00 0.00 C ATOM 2772 SD MET B 67 -7.316 -11.517 2.287 1.00 0.00 S ATOM 2773 CE MET B 67 -6.972 -13.243 2.613 1.00 0.00 C ATOM 0 H MET B 67 -4.501 -13.245 4.666 1.00 0.00 H new ATOM 0 HA MET B 67 -3.312 -11.730 2.628 1.00 0.00 H new ATOM 0 HB2 MET B 67 -5.648 -11.730 4.331 1.00 0.00 H new ATOM 0 HB3 MET B 67 -4.974 -10.112 4.307 1.00 0.00 H new ATOM 0 HG2 MET B 67 -5.727 -9.728 2.240 1.00 0.00 H new ATOM 0 HG3 MET B 67 -5.035 -11.217 1.628 1.00 0.00 H new ATOM 0 HE1 MET B 67 -7.732 -13.645 3.283 1.00 0.00 H new ATOM 0 HE2 MET B 67 -6.983 -13.800 1.676 1.00 0.00 H new ATOM 0 HE3 MET B 67 -5.991 -13.337 3.079 1.00 0.00 H new ATOM 2783 N LEU B 68 -1.539 -10.370 3.749 1.00 0.00 N ATOM 2784 CA LEU B 68 -0.566 -9.492 4.382 1.00 0.00 C ATOM 2785 C LEU B 68 -1.000 -8.041 4.218 1.00 0.00 C ATOM 2786 O LEU B 68 -0.470 -7.307 3.384 1.00 0.00 O ATOM 2787 CB LEU B 68 0.837 -9.717 3.802 1.00 0.00 C ATOM 2788 CG LEU B 68 1.982 -9.711 4.818 1.00 0.00 C ATOM 2789 CD1 LEU B 68 1.654 -10.605 6.005 1.00 0.00 C ATOM 2790 CD2 LEU B 68 3.275 -10.163 4.155 1.00 0.00 C ATOM 0 H LEU B 68 -1.303 -10.667 2.802 1.00 0.00 H new ATOM 0 HA LEU B 68 -0.521 -9.726 5.446 1.00 0.00 H new ATOM 0 HB2 LEU B 68 0.845 -10.673 3.278 1.00 0.00 H new ATOM 0 HB3 LEU B 68 1.031 -8.944 3.058 1.00 0.00 H new ATOM 0 HG LEU B 68 2.112 -8.693 5.184 1.00 0.00 H new ATOM 0 HD11 LEU B 68 2.481 -10.586 6.714 1.00 0.00 H new ATOM 0 HD12 LEU B 68 0.749 -10.244 6.493 1.00 0.00 H new ATOM 0 HD13 LEU B 68 1.497 -11.626 5.659 1.00 0.00 H new ATOM 0 HD21 LEU B 68 4.082 -10.154 4.888 1.00 0.00 H new ATOM 0 HD22 LEU B 68 3.150 -11.173 3.765 1.00 0.00 H new ATOM 0 HD23 LEU B 68 3.521 -9.486 3.337 1.00 0.00 H new ATOM 2802 N THR B 69 -1.979 -7.644 5.028 1.00 0.00 N ATOM 2803 CA THR B 69 -2.512 -6.287 4.995 1.00 0.00 C ATOM 2804 C THR B 69 -1.596 -5.327 5.751 1.00 0.00 C ATOM 2805 O THR B 69 -1.792 -4.113 5.718 1.00 0.00 O ATOM 2806 CB THR B 69 -3.927 -6.268 5.589 1.00 0.00 C ATOM 2807 OG1 THR B 69 -4.474 -4.960 5.581 1.00 0.00 O ATOM 2808 CG2 THR B 69 -3.983 -6.783 7.007 1.00 0.00 C ATOM 0 H THR B 69 -2.421 -8.249 5.720 1.00 0.00 H new ATOM 0 HA THR B 69 -2.562 -5.955 3.958 1.00 0.00 H new ATOM 0 HB THR B 69 -4.510 -6.932 4.951 1.00 0.00 H new ATOM 0 HG1 THR B 69 -5.369 -4.982 5.183 1.00 0.00 H new ATOM 0 HG21 THR B 69 -5.011 -6.743 7.368 1.00 0.00 H new ATOM 0 HG22 THR B 69 -3.628 -7.813 7.034 1.00 0.00 H new ATOM 0 HG23 THR B 69 -3.350 -6.165 7.644 1.00 0.00 H new ATOM 2816 N GLN B 70 -0.583 -5.878 6.417 1.00 0.00 N ATOM 2817 CA GLN B 70 0.373 -5.069 7.161 1.00 0.00 C ATOM 2818 C GLN B 70 1.598 -4.760 6.301 1.00 0.00 C ATOM 2819 O GLN B 70 2.632 -4.324 6.808 1.00 0.00 O ATOM 2820 CB GLN B 70 0.801 -5.791 8.440 1.00 0.00 C ATOM 2821 CG GLN B 70 1.530 -7.100 8.184 1.00 0.00 C ATOM 2822 CD GLN B 70 2.424 -7.505 9.340 1.00 0.00 C ATOM 2823 OE1 GLN B 70 2.303 -8.606 9.877 1.00 0.00 O ATOM 2824 NE2 GLN B 70 3.328 -6.614 9.730 1.00 0.00 N ATOM 0 H GLN B 70 -0.405 -6.882 6.455 1.00 0.00 H new ATOM 0 HA GLN B 70 -0.111 -4.130 7.431 1.00 0.00 H new ATOM 0 HB2 GLN B 70 1.447 -5.132 9.020 1.00 0.00 H new ATOM 0 HB3 GLN B 70 -0.081 -5.989 9.048 1.00 0.00 H new ATOM 0 HG2 GLN B 70 0.800 -7.888 8.001 1.00 0.00 H new ATOM 0 HG3 GLN B 70 2.132 -7.006 7.280 1.00 0.00 H new ATOM 0 HE21 GLN B 70 3.394 -5.713 9.256 1.00 0.00 H new ATOM 0 HE22 GLN B 70 3.957 -6.831 10.503 1.00 0.00 H new ATOM 2833 N GLN B 71 1.470 -4.983 4.993 1.00 0.00 N ATOM 2834 CA GLN B 71 2.554 -4.725 4.056 1.00 0.00 C ATOM 2835 C GLN B 71 1.982 -4.386 2.685 1.00 0.00 C ATOM 2836 O GLN B 71 2.618 -4.614 1.656 1.00 0.00 O ATOM 2837 CB GLN B 71 3.478 -5.942 3.954 1.00 0.00 C ATOM 2838 CG GLN B 71 4.913 -5.652 4.364 1.00 0.00 C ATOM 2839 CD GLN B 71 5.038 -5.286 5.830 1.00 0.00 C ATOM 2840 OE1 GLN B 71 5.621 -4.258 6.177 1.00 0.00 O ATOM 2841 NE2 GLN B 71 4.492 -6.128 6.699 1.00 0.00 N ATOM 0 H GLN B 71 0.620 -5.344 4.560 1.00 0.00 H new ATOM 0 HA GLN B 71 3.137 -3.879 4.420 1.00 0.00 H new ATOM 0 HB2 GLN B 71 3.084 -6.741 4.582 1.00 0.00 H new ATOM 0 HB3 GLN B 71 3.469 -6.310 2.928 1.00 0.00 H new ATOM 0 HG2 GLN B 71 5.530 -6.527 4.158 1.00 0.00 H new ATOM 0 HG3 GLN B 71 5.303 -4.836 3.755 1.00 0.00 H new ATOM 0 HE21 GLN B 71 4.018 -6.968 6.367 1.00 0.00 H new ATOM 0 HE22 GLN B 71 4.546 -5.935 7.699 1.00 0.00 H new ATOM 2850 N MET B 72 0.766 -3.844 2.690 1.00 0.00 N ATOM 2851 CA MET B 72 0.070 -3.466 1.466 1.00 0.00 C ATOM 2852 C MET B 72 1.008 -2.776 0.482 1.00 0.00 C ATOM 2853 O MET B 72 1.937 -2.074 0.882 1.00 0.00 O ATOM 2854 CB MET B 72 -1.101 -2.552 1.815 1.00 0.00 C ATOM 2855 CG MET B 72 -2.111 -2.393 0.689 1.00 0.00 C ATOM 2856 SD MET B 72 -3.795 -2.785 1.201 1.00 0.00 S ATOM 2857 CE MET B 72 -3.592 -4.472 1.767 1.00 0.00 C ATOM 0 H MET B 72 0.238 -3.656 3.542 1.00 0.00 H new ATOM 0 HA MET B 72 -0.301 -4.370 0.983 1.00 0.00 H new ATOM 0 HB2 MET B 72 -1.610 -2.948 2.694 1.00 0.00 H new ATOM 0 HB3 MET B 72 -0.715 -1.569 2.086 1.00 0.00 H new ATOM 0 HG2 MET B 72 -2.078 -1.368 0.319 1.00 0.00 H new ATOM 0 HG3 MET B 72 -1.828 -3.041 -0.141 1.00 0.00 H new ATOM 0 HE1 MET B 72 -3.929 -5.159 0.991 1.00 0.00 H new ATOM 0 HE2 MET B 72 -2.540 -4.659 1.985 1.00 0.00 H new ATOM 0 HE3 MET B 72 -4.183 -4.626 2.670 1.00 0.00 H new ATOM 2867 N THR B 73 0.768 -2.992 -0.808 1.00 0.00 N ATOM 2868 CA THR B 73 1.605 -2.398 -1.842 1.00 0.00 C ATOM 2869 C THR B 73 0.965 -2.536 -3.222 1.00 0.00 C ATOM 2870 O THR B 73 0.897 -3.632 -3.777 1.00 0.00 O ATOM 2871 CB THR B 73 2.985 -3.064 -1.837 1.00 0.00 C ATOM 2872 OG1 THR B 73 3.676 -2.798 -3.045 1.00 0.00 O ATOM 2873 CG2 THR B 73 2.927 -4.570 -1.660 1.00 0.00 C ATOM 0 H THR B 73 0.005 -3.571 -1.160 1.00 0.00 H new ATOM 0 HA THR B 73 1.711 -1.335 -1.625 1.00 0.00 H new ATOM 0 HB THR B 73 3.507 -2.636 -0.981 1.00 0.00 H new ATOM 0 HG1 THR B 73 4.555 -3.231 -3.021 1.00 0.00 H new ATOM 0 HG21 THR B 73 3.938 -4.976 -1.666 1.00 0.00 H new ATOM 0 HG22 THR B 73 2.446 -4.807 -0.711 1.00 0.00 H new ATOM 0 HG23 THR B 73 2.354 -5.010 -2.476 1.00 0.00 H new ATOM 2881 N SER B 74 0.509 -1.415 -3.779 1.00 0.00 N ATOM 2882 CA SER B 74 -0.110 -1.420 -5.101 1.00 0.00 C ATOM 2883 C SER B 74 0.938 -1.673 -6.174 1.00 0.00 C ATOM 2884 O SER B 74 1.838 -0.861 -6.385 1.00 0.00 O ATOM 2885 CB SER B 74 -0.844 -0.100 -5.359 1.00 0.00 C ATOM 2886 OG SER B 74 -0.076 0.769 -6.168 1.00 0.00 O ATOM 0 H SER B 74 0.557 -0.497 -3.337 1.00 0.00 H new ATOM 0 HA SER B 74 -0.842 -2.227 -5.138 1.00 0.00 H new ATOM 0 HB2 SER B 74 -1.799 -0.302 -5.844 1.00 0.00 H new ATOM 0 HB3 SER B 74 -1.066 0.386 -4.409 1.00 0.00 H new ATOM 0 HG SER B 74 0.867 0.507 -6.126 1.00 0.00 H new ATOM 2892 N VAL B 75 0.814 -2.810 -6.847 1.00 0.00 N ATOM 2893 CA VAL B 75 1.750 -3.177 -7.895 1.00 0.00 C ATOM 2894 C VAL B 75 1.155 -2.892 -9.272 1.00 0.00 C ATOM 2895 O VAL B 75 -0.011 -3.197 -9.527 1.00 0.00 O ATOM 2896 CB VAL B 75 2.161 -4.666 -7.775 1.00 0.00 C ATOM 2897 CG1 VAL B 75 1.288 -5.577 -8.632 1.00 0.00 C ATOM 2898 CG2 VAL B 75 3.641 -4.838 -8.082 1.00 0.00 C ATOM 0 H VAL B 75 0.073 -3.492 -6.684 1.00 0.00 H new ATOM 0 HA VAL B 75 2.647 -2.569 -7.775 1.00 0.00 H new ATOM 0 HB VAL B 75 1.995 -4.974 -6.743 1.00 0.00 H new ATOM 0 HG11 VAL B 75 1.615 -6.610 -8.514 1.00 0.00 H new ATOM 0 HG12 VAL B 75 0.249 -5.487 -8.316 1.00 0.00 H new ATOM 0 HG13 VAL B 75 1.376 -5.286 -9.679 1.00 0.00 H new ATOM 0 HG21 VAL B 75 3.911 -5.890 -7.993 1.00 0.00 H new ATOM 0 HG22 VAL B 75 3.844 -4.496 -9.097 1.00 0.00 H new ATOM 0 HG23 VAL B 75 4.229 -4.251 -7.377 1.00 0.00 H new ATOM 2908 N PRO B 76 1.945 -2.299 -10.179 1.00 0.00 N ATOM 2909 CA PRO B 76 1.487 -1.971 -11.529 1.00 0.00 C ATOM 2910 C PRO B 76 0.710 -3.111 -12.183 1.00 0.00 C ATOM 2911 O PRO B 76 1.225 -4.213 -12.352 1.00 0.00 O ATOM 2912 CB PRO B 76 2.787 -1.697 -12.278 1.00 0.00 C ATOM 2913 CG PRO B 76 3.714 -1.180 -11.233 1.00 0.00 C ATOM 2914 CD PRO B 76 3.348 -1.895 -9.959 1.00 0.00 C ATOM 0 HA PRO B 76 0.791 -1.132 -11.533 1.00 0.00 H new ATOM 0 HB2 PRO B 76 3.177 -2.603 -12.742 1.00 0.00 H new ATOM 0 HB3 PRO B 76 2.640 -0.968 -13.075 1.00 0.00 H new ATOM 0 HG2 PRO B 76 4.752 -1.372 -11.503 1.00 0.00 H new ATOM 0 HG3 PRO B 76 3.609 -0.101 -11.118 1.00 0.00 H new ATOM 0 HD2 PRO B 76 3.991 -2.758 -9.784 1.00 0.00 H new ATOM 0 HD3 PRO B 76 3.446 -1.243 -9.091 1.00 0.00 H new ATOM 2922 N VAL B 77 -0.538 -2.820 -12.542 1.00 0.00 N ATOM 2923 CA VAL B 77 -1.436 -3.790 -13.181 1.00 0.00 C ATOM 2924 C VAL B 77 -0.693 -4.812 -14.047 1.00 0.00 C ATOM 2925 O VAL B 77 -1.064 -5.983 -14.098 1.00 0.00 O ATOM 2926 CB VAL B 77 -2.461 -3.062 -14.069 1.00 0.00 C ATOM 2927 CG1 VAL B 77 -1.743 -2.265 -15.150 1.00 0.00 C ATOM 2928 CG2 VAL B 77 -3.442 -4.049 -14.684 1.00 0.00 C ATOM 0 H VAL B 77 -0.960 -1.903 -12.399 1.00 0.00 H new ATOM 0 HA VAL B 77 -1.930 -4.325 -12.370 1.00 0.00 H new ATOM 0 HB VAL B 77 -3.030 -2.370 -13.448 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -2.477 -1.754 -15.773 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -1.087 -1.530 -14.685 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -1.151 -2.941 -15.767 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -4.157 -3.511 -15.307 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -2.898 -4.770 -15.295 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -3.975 -4.574 -13.891 1.00 0.00 H new ATOM 2938 N LYS B 78 0.338 -4.349 -14.742 1.00 0.00 N ATOM 2939 CA LYS B 78 1.124 -5.209 -15.634 1.00 0.00 C ATOM 2940 C LYS B 78 1.420 -6.567 -15.020 1.00 0.00 C ATOM 2941 O LYS B 78 1.093 -7.611 -15.584 1.00 0.00 O ATOM 2942 CB LYS B 78 2.468 -4.577 -15.989 1.00 0.00 C ATOM 2943 CG LYS B 78 2.822 -3.392 -15.128 1.00 0.00 C ATOM 2944 CD LYS B 78 2.234 -2.122 -15.710 1.00 0.00 C ATOM 2945 CE LYS B 78 3.246 -1.377 -16.566 1.00 0.00 C ATOM 2946 NZ LYS B 78 3.975 -2.292 -17.487 1.00 0.00 N ATOM 0 H LYS B 78 0.655 -3.380 -14.709 1.00 0.00 H new ATOM 0 HA LYS B 78 0.508 -5.330 -16.525 1.00 0.00 H new ATOM 0 HB2 LYS B 78 3.250 -5.330 -15.896 1.00 0.00 H new ATOM 0 HB3 LYS B 78 2.449 -4.265 -17.033 1.00 0.00 H new ATOM 0 HG2 LYS B 78 2.446 -3.544 -14.116 1.00 0.00 H new ATOM 0 HG3 LYS B 78 3.905 -3.298 -15.055 1.00 0.00 H new ATOM 0 HD2 LYS B 78 1.359 -2.368 -16.312 1.00 0.00 H new ATOM 0 HD3 LYS B 78 1.893 -1.475 -14.902 1.00 0.00 H new ATOM 0 HE2 LYS B 78 2.735 -0.609 -17.147 1.00 0.00 H new ATOM 0 HE3 LYS B 78 3.961 -0.866 -15.921 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 4.643 -1.743 -18.065 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 4.497 -3.000 -16.932 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 3.294 -2.773 -18.109 1.00 0.00 H new ATOM 2960 N ILE B 79 2.091 -6.529 -13.879 1.00 0.00 N ATOM 2961 CA ILE B 79 2.501 -7.744 -13.192 1.00 0.00 C ATOM 2962 C ILE B 79 1.457 -8.239 -12.191 1.00 0.00 C ATOM 2963 O ILE B 79 1.799 -8.955 -11.252 1.00 0.00 O ATOM 2964 CB ILE B 79 3.860 -7.581 -12.458 1.00 0.00 C ATOM 2965 CG1 ILE B 79 4.106 -6.118 -12.068 1.00 0.00 C ATOM 2966 CG2 ILE B 79 5.009 -8.129 -13.306 1.00 0.00 C ATOM 2967 CD1 ILE B 79 3.102 -5.613 -11.055 1.00 0.00 C ATOM 0 H ILE B 79 2.364 -5.666 -13.408 1.00 0.00 H new ATOM 0 HA ILE B 79 2.609 -8.487 -13.982 1.00 0.00 H new ATOM 0 HB ILE B 79 3.817 -8.165 -11.538 1.00 0.00 H new ATOM 0 HG12 ILE B 79 5.112 -6.018 -11.659 1.00 0.00 H new ATOM 0 HG13 ILE B 79 4.062 -5.495 -12.961 1.00 0.00 H new ATOM 0 HG21 ILE B 79 5.949 -8.003 -12.770 1.00 0.00 H new ATOM 0 HG22 ILE B 79 4.843 -9.188 -13.503 1.00 0.00 H new ATOM 0 HG23 ILE B 79 5.055 -7.587 -14.251 1.00 0.00 H new ATOM 0 HD11 ILE B 79 3.321 -4.573 -10.813 1.00 0.00 H new ATOM 0 HD12 ILE B 79 2.097 -5.685 -11.471 1.00 0.00 H new ATOM 0 HD13 ILE B 79 3.164 -6.217 -10.150 1.00 0.00 H new ATOM 2979 N LEU B 80 0.186 -7.872 -12.384 1.00 0.00 N ATOM 2980 CA LEU B 80 -0.876 -8.319 -11.473 1.00 0.00 C ATOM 2981 C LEU B 80 -0.686 -9.782 -11.120 1.00 0.00 C ATOM 2982 O LEU B 80 -1.068 -10.672 -11.879 1.00 0.00 O ATOM 2983 CB LEU B 80 -2.261 -8.105 -12.086 1.00 0.00 C ATOM 2984 CG LEU B 80 -3.341 -7.661 -11.095 1.00 0.00 C ATOM 2985 CD1 LEU B 80 -3.142 -8.331 -9.740 1.00 0.00 C ATOM 2986 CD2 LEU B 80 -3.335 -6.147 -10.946 1.00 0.00 C ATOM 0 H LEU B 80 -0.131 -7.277 -13.149 1.00 0.00 H new ATOM 0 HA LEU B 80 -0.810 -7.720 -10.565 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -2.182 -7.357 -12.875 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -2.581 -9.034 -12.558 1.00 0.00 H new ATOM 0 HG LEU B 80 -4.311 -7.968 -11.487 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -3.921 -8.000 -9.053 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -3.197 -9.413 -9.858 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -2.165 -8.059 -9.340 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -4.108 -5.848 -10.238 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -2.362 -5.821 -10.579 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -3.531 -5.685 -11.914 1.00 0.00 H new ATOM 2998 N SER B 81 -0.064 -10.000 -9.963 1.00 0.00 N ATOM 2999 CA SER B 81 0.237 -11.333 -9.452 1.00 0.00 C ATOM 3000 C SER B 81 -0.396 -12.443 -10.283 1.00 0.00 C ATOM 3001 O SER B 81 -1.619 -12.550 -10.363 1.00 0.00 O ATOM 3002 CB SER B 81 -0.198 -11.448 -7.995 1.00 0.00 C ATOM 3003 OG SER B 81 -1.109 -10.422 -7.651 1.00 0.00 O ATOM 0 H SER B 81 0.248 -9.248 -9.349 1.00 0.00 H new ATOM 0 HA SER B 81 1.317 -11.464 -9.523 1.00 0.00 H new ATOM 0 HB2 SER B 81 -0.661 -12.420 -7.826 1.00 0.00 H new ATOM 0 HB3 SER B 81 0.676 -11.394 -7.346 1.00 0.00 H new ATOM 0 HG SER B 81 -1.042 -10.233 -6.692 1.00 0.00 H new ATOM 3009 N GLU B 82 0.451 -13.271 -10.896 1.00 0.00 N ATOM 3010 CA GLU B 82 -0.022 -14.385 -11.721 1.00 0.00 C ATOM 3011 C GLU B 82 -1.220 -15.082 -11.067 1.00 0.00 C ATOM 3012 O GLU B 82 -1.053 -15.883 -10.148 1.00 0.00 O ATOM 3013 CB GLU B 82 1.108 -15.393 -11.946 1.00 0.00 C ATOM 3014 CG GLU B 82 1.204 -15.888 -13.380 1.00 0.00 C ATOM 3015 CD GLU B 82 1.510 -17.371 -13.465 1.00 0.00 C ATOM 3016 OE1 GLU B 82 2.619 -17.773 -13.053 1.00 0.00 O ATOM 3017 OE2 GLU B 82 0.642 -18.129 -13.944 1.00 0.00 O ATOM 0 H GLU B 82 1.466 -13.192 -10.837 1.00 0.00 H new ATOM 0 HA GLU B 82 -0.341 -13.983 -12.683 1.00 0.00 H new ATOM 0 HB2 GLU B 82 2.055 -14.933 -11.665 1.00 0.00 H new ATOM 0 HB3 GLU B 82 0.959 -16.247 -11.285 1.00 0.00 H new ATOM 0 HG2 GLU B 82 0.265 -15.684 -13.895 1.00 0.00 H new ATOM 0 HG3 GLU B 82 1.981 -15.330 -13.902 1.00 0.00 H new ATOM 3024 N PRO B 83 -2.448 -14.773 -11.526 1.00 0.00 N ATOM 3025 CA PRO B 83 -3.674 -15.359 -10.972 1.00 0.00 C ATOM 3026 C PRO B 83 -3.591 -16.868 -10.767 1.00 0.00 C ATOM 3027 O PRO B 83 -3.922 -17.646 -11.662 1.00 0.00 O ATOM 3028 CB PRO B 83 -4.724 -15.023 -12.028 1.00 0.00 C ATOM 3029 CG PRO B 83 -4.253 -13.741 -12.615 1.00 0.00 C ATOM 3030 CD PRO B 83 -2.747 -13.815 -12.613 1.00 0.00 C ATOM 0 HA PRO B 83 -3.889 -14.966 -9.978 1.00 0.00 H new ATOM 0 HB2 PRO B 83 -4.793 -15.805 -12.784 1.00 0.00 H new ATOM 0 HB3 PRO B 83 -5.715 -14.918 -11.586 1.00 0.00 H new ATOM 0 HG2 PRO B 83 -4.636 -13.610 -13.627 1.00 0.00 H new ATOM 0 HG3 PRO B 83 -4.603 -12.891 -12.029 1.00 0.00 H new ATOM 0 HD2 PRO B 83 -2.361 -14.163 -13.571 1.00 0.00 H new ATOM 0 HD3 PRO B 83 -2.298 -12.840 -12.423 1.00 0.00 H new ATOM 3038 N VAL B 84 -3.176 -17.275 -9.571 1.00 0.00 N ATOM 3039 CA VAL B 84 -3.084 -18.690 -9.237 1.00 0.00 C ATOM 3040 C VAL B 84 -4.489 -19.280 -9.101 1.00 0.00 C ATOM 3041 O VAL B 84 -4.748 -20.412 -9.510 1.00 0.00 O ATOM 3042 CB VAL B 84 -2.330 -18.909 -7.911 1.00 0.00 C ATOM 3043 CG1 VAL B 84 -2.990 -18.123 -6.786 1.00 0.00 C ATOM 3044 CG2 VAL B 84 -2.265 -20.391 -7.567 1.00 0.00 C ATOM 0 H VAL B 84 -2.899 -16.645 -8.819 1.00 0.00 H new ATOM 0 HA VAL B 84 -2.536 -19.184 -10.039 1.00 0.00 H new ATOM 0 HB VAL B 84 -1.310 -18.544 -8.032 1.00 0.00 H new ATOM 0 HG11 VAL B 84 -2.444 -18.289 -5.857 1.00 0.00 H new ATOM 0 HG12 VAL B 84 -2.978 -17.060 -7.029 1.00 0.00 H new ATOM 0 HG13 VAL B 84 -4.021 -18.456 -6.666 1.00 0.00 H new ATOM 0 HG21 VAL B 84 -1.729 -20.523 -6.627 1.00 0.00 H new ATOM 0 HG22 VAL B 84 -3.276 -20.786 -7.466 1.00 0.00 H new ATOM 0 HG23 VAL B 84 -1.744 -20.926 -8.361 1.00 0.00 H new ATOM 3054 N ASN B 85 -5.386 -18.488 -8.510 1.00 0.00 N ATOM 3055 CA ASN B 85 -6.773 -18.894 -8.292 1.00 0.00 C ATOM 3056 C ASN B 85 -7.683 -17.664 -8.213 1.00 0.00 C ATOM 3057 O ASN B 85 -7.372 -16.620 -8.786 1.00 0.00 O ATOM 3058 CB ASN B 85 -6.879 -19.722 -7.008 1.00 0.00 C ATOM 3059 CG ASN B 85 -7.867 -20.864 -7.137 1.00 0.00 C ATOM 3060 OD1 ASN B 85 -8.916 -20.868 -6.493 1.00 0.00 O ATOM 3061 ND2 ASN B 85 -7.536 -21.842 -7.971 1.00 0.00 N ATOM 0 H ASN B 85 -5.171 -17.550 -8.171 1.00 0.00 H new ATOM 0 HA ASN B 85 -7.097 -19.507 -9.133 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -5.897 -20.122 -6.754 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -7.182 -19.074 -6.185 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -8.162 -22.638 -8.098 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -6.656 -21.798 -8.485 1.00 0.00 H new ATOM 3068 N GLU B 86 -8.803 -17.785 -7.499 1.00 0.00 N ATOM 3069 CA GLU B 86 -9.739 -16.681 -7.350 1.00 0.00 C ATOM 3070 C GLU B 86 -10.551 -16.856 -6.079 1.00 0.00 C ATOM 3071 O GLU B 86 -11.133 -17.917 -5.852 1.00 0.00 O ATOM 3072 CB GLU B 86 -10.671 -16.596 -8.559 1.00 0.00 C ATOM 3073 CG GLU B 86 -11.215 -17.944 -9.005 1.00 0.00 C ATOM 3074 CD GLU B 86 -12.390 -17.813 -9.954 1.00 0.00 C ATOM 3075 OE1 GLU B 86 -13.243 -16.931 -9.724 1.00 0.00 O ATOM 3076 OE2 GLU B 86 -12.456 -18.593 -10.928 1.00 0.00 O ATOM 0 H GLU B 86 -9.080 -18.640 -7.016 1.00 0.00 H new ATOM 0 HA GLU B 86 -9.171 -15.753 -7.286 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -11.506 -15.939 -8.318 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -10.134 -16.138 -9.389 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -10.420 -18.509 -9.492 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -11.522 -18.516 -8.129 1.00 0.00 H new ATOM 3083 N LEU B 87 -10.588 -15.823 -5.244 1.00 0.00 N ATOM 3084 CA LEU B 87 -11.339 -15.914 -3.999 1.00 0.00 C ATOM 3085 C LEU B 87 -12.311 -14.753 -3.800 1.00 0.00 C ATOM 3086 O LEU B 87 -12.214 -13.984 -2.843 1.00 0.00 O ATOM 3087 CB LEU B 87 -10.428 -16.020 -2.794 1.00 0.00 C ATOM 3088 CG LEU B 87 -9.020 -15.471 -2.955 1.00 0.00 C ATOM 3089 CD1 LEU B 87 -9.074 -14.063 -3.536 1.00 0.00 C ATOM 3090 CD2 LEU B 87 -8.311 -15.496 -1.605 1.00 0.00 C ATOM 0 H LEU B 87 -10.118 -14.932 -5.402 1.00 0.00 H new ATOM 0 HA LEU B 87 -11.924 -16.830 -4.086 1.00 0.00 H new ATOM 0 HB2 LEU B 87 -10.903 -15.501 -1.961 1.00 0.00 H new ATOM 0 HB3 LEU B 87 -10.354 -17.071 -2.514 1.00 0.00 H new ATOM 0 HG LEU B 87 -8.454 -16.093 -3.649 1.00 0.00 H new ATOM 0 HD11 LEU B 87 -8.061 -13.677 -3.648 1.00 0.00 H new ATOM 0 HD12 LEU B 87 -9.562 -14.090 -4.510 1.00 0.00 H new ATOM 0 HD13 LEU B 87 -9.638 -13.414 -2.866 1.00 0.00 H new ATOM 0 HD21 LEU B 87 -7.301 -15.103 -1.717 1.00 0.00 H new ATOM 0 HD22 LEU B 87 -8.862 -14.882 -0.893 1.00 0.00 H new ATOM 0 HD23 LEU B 87 -8.263 -16.521 -1.238 1.00 0.00 H new ATOM 3102 N SER B 88 -13.259 -14.671 -4.699 1.00 0.00 N ATOM 3103 CA SER B 88 -14.307 -13.647 -4.655 1.00 0.00 C ATOM 3104 C SER B 88 -15.264 -13.913 -3.517 1.00 0.00 C ATOM 3105 O SER B 88 -15.650 -12.994 -2.811 1.00 0.00 O ATOM 3106 CB SER B 88 -15.074 -13.585 -5.969 1.00 0.00 C ATOM 3107 OG SER B 88 -14.203 -13.364 -7.064 1.00 0.00 O ATOM 0 H SER B 88 -13.338 -15.309 -5.491 1.00 0.00 H new ATOM 0 HA SER B 88 -13.820 -12.685 -4.494 1.00 0.00 H new ATOM 0 HB2 SER B 88 -15.620 -14.517 -6.118 1.00 0.00 H new ATOM 0 HB3 SER B 88 -15.814 -12.786 -5.923 1.00 0.00 H new ATOM 0 HG SER B 88 -13.401 -12.893 -6.754 1.00 0.00 H new ATOM 3113 N THR B 89 -15.636 -15.172 -3.317 1.00 0.00 N ATOM 3114 CA THR B 89 -16.529 -15.502 -2.218 1.00 0.00 C ATOM 3115 C THR B 89 -15.894 -15.026 -0.916 1.00 0.00 C ATOM 3116 O THR B 89 -16.577 -14.736 0.067 1.00 0.00 O ATOM 3117 CB THR B 89 -16.805 -17.005 -2.166 1.00 0.00 C ATOM 3118 OG1 THR B 89 -17.939 -17.269 -1.359 1.00 0.00 O ATOM 3119 CG2 THR B 89 -15.646 -17.814 -1.621 1.00 0.00 C ATOM 0 H THR B 89 -15.340 -15.964 -3.888 1.00 0.00 H new ATOM 0 HA THR B 89 -17.486 -15.002 -2.367 1.00 0.00 H new ATOM 0 HB THR B 89 -16.973 -17.308 -3.200 1.00 0.00 H new ATOM 0 HG1 THR B 89 -18.106 -18.234 -1.335 1.00 0.00 H new ATOM 0 HG21 THR B 89 -15.912 -18.871 -1.613 1.00 0.00 H new ATOM 0 HG22 THR B 89 -14.770 -17.665 -2.252 1.00 0.00 H new ATOM 0 HG23 THR B 89 -15.421 -17.489 -0.605 1.00 0.00 H new ATOM 3127 N PHE B 90 -14.567 -14.921 -0.951 1.00 0.00 N ATOM 3128 CA PHE B 90 -13.783 -14.449 0.179 1.00 0.00 C ATOM 3129 C PHE B 90 -13.563 -12.941 0.061 1.00 0.00 C ATOM 3130 O PHE B 90 -12.770 -12.356 0.798 1.00 0.00 O ATOM 3131 CB PHE B 90 -12.437 -15.163 0.183 1.00 0.00 C ATOM 3132 CG PHE B 90 -12.370 -16.385 1.051 1.00 0.00 C ATOM 3133 CD1 PHE B 90 -13.497 -17.148 1.316 1.00 0.00 C ATOM 3134 CD2 PHE B 90 -11.162 -16.777 1.592 1.00 0.00 C ATOM 3135 CE1 PHE B 90 -13.408 -18.279 2.106 1.00 0.00 C ATOM 3136 CE2 PHE B 90 -11.068 -17.892 2.379 1.00 0.00 C ATOM 3137 CZ PHE B 90 -12.188 -18.650 2.640 1.00 0.00 C ATOM 0 H PHE B 90 -14.007 -15.163 -1.769 1.00 0.00 H new ATOM 0 HA PHE B 90 -14.315 -14.660 1.107 1.00 0.00 H new ATOM 0 HB2 PHE B 90 -12.191 -15.448 -0.840 1.00 0.00 H new ATOM 0 HB3 PHE B 90 -11.671 -14.460 0.511 1.00 0.00 H new ATOM 0 HD1 PHE B 90 -14.451 -16.857 0.902 1.00 0.00 H new ATOM 0 HD2 PHE B 90 -10.276 -16.193 1.390 1.00 0.00 H new ATOM 0 HE1 PHE B 90 -14.289 -18.871 2.305 1.00 0.00 H new ATOM 0 HE2 PHE B 90 -10.114 -18.178 2.796 1.00 0.00 H new ATOM 0 HZ PHE B 90 -12.113 -19.531 3.260 1.00 0.00 H new ATOM 3147 N ARG B 91 -14.265 -12.325 -0.892 1.00 0.00 N ATOM 3148 CA ARG B 91 -14.158 -10.892 -1.149 1.00 0.00 C ATOM 3149 C ARG B 91 -14.100 -10.084 0.138 1.00 0.00 C ATOM 3150 O ARG B 91 -13.247 -9.212 0.280 1.00 0.00 O ATOM 3151 CB ARG B 91 -15.331 -10.417 -1.990 1.00 0.00 C ATOM 3152 CG ARG B 91 -16.614 -11.001 -1.495 1.00 0.00 C ATOM 3153 CD ARG B 91 -17.655 -11.152 -2.591 1.00 0.00 C ATOM 3154 NE ARG B 91 -18.733 -10.173 -2.464 1.00 0.00 N ATOM 3155 CZ ARG B 91 -19.564 -9.853 -3.453 1.00 0.00 C ATOM 3156 NH1 ARG B 91 -19.445 -10.431 -4.642 1.00 0.00 N ATOM 3157 NH2 ARG B 91 -20.517 -8.953 -3.253 1.00 0.00 N ATOM 0 H ARG B 91 -14.922 -12.807 -1.505 1.00 0.00 H new ATOM 0 HA ARG B 91 -13.226 -10.733 -1.691 1.00 0.00 H new ATOM 0 HB2 ARG B 91 -15.387 -9.329 -1.961 1.00 0.00 H new ATOM 0 HB3 ARG B 91 -15.176 -10.701 -3.031 1.00 0.00 H new ATOM 0 HG2 ARG B 91 -16.416 -11.977 -1.051 1.00 0.00 H new ATOM 0 HG3 ARG B 91 -17.015 -10.367 -0.704 1.00 0.00 H new ATOM 0 HD2 ARG B 91 -17.176 -11.039 -3.564 1.00 0.00 H new ATOM 0 HD3 ARG B 91 -18.073 -12.158 -2.557 1.00 0.00 H new ATOM 0 HE ARG B 91 -18.856 -9.708 -1.565 1.00 0.00 H new ATOM 0 HH11 ARG B 91 -18.714 -11.124 -4.801 1.00 0.00 H new ATOM 0 HH12 ARG B 91 -20.085 -10.182 -5.396 1.00 0.00 H new ATOM 0 HH21 ARG B 91 -20.613 -8.506 -2.341 1.00 0.00 H new ATOM 0 HH22 ARG B 91 -21.154 -8.708 -4.011 1.00 0.00 H new ATOM 3171 N ASN B 92 -14.997 -10.363 1.086 1.00 0.00 N ATOM 3172 CA ASN B 92 -14.980 -9.620 2.337 1.00 0.00 C ATOM 3173 C ASN B 92 -13.621 -9.761 2.998 1.00 0.00 C ATOM 3174 O ASN B 92 -13.013 -8.771 3.391 1.00 0.00 O ATOM 3175 CB ASN B 92 -16.085 -10.050 3.301 1.00 0.00 C ATOM 3176 CG ASN B 92 -15.710 -11.257 4.141 1.00 0.00 C ATOM 3177 OD1 ASN B 92 -14.913 -11.021 5.179 1.00 0.00 O flip ATOM 3178 ND2 ASN B 92 -16.129 -12.381 3.864 1.00 0.00 N flip ATOM 0 H ASN B 92 -15.722 -11.077 1.012 1.00 0.00 H new ATOM 0 HA ASN B 92 -15.170 -8.575 2.093 1.00 0.00 H new ATOM 0 HB2 ASN B 92 -16.327 -9.217 3.961 1.00 0.00 H new ATOM 0 HB3 ASN B 92 -16.986 -10.277 2.732 1.00 0.00 H new ATOM 0 HD21 ASN B 92 -16.739 -12.513 3.057 1.00 0.00 H new ATOM 0 HD22 ASN B 92 -15.866 -13.180 4.441 1.00 0.00 H new ATOM 3185 N GLU B 93 -13.130 -11.000 3.087 1.00 0.00 N ATOM 3186 CA GLU B 93 -11.814 -11.248 3.664 1.00 0.00 C ATOM 3187 C GLU B 93 -10.862 -10.213 3.130 1.00 0.00 C ATOM 3188 O GLU B 93 -10.059 -9.623 3.854 1.00 0.00 O ATOM 3189 CB GLU B 93 -11.286 -12.614 3.246 1.00 0.00 C ATOM 3190 CG GLU B 93 -10.803 -13.468 4.407 1.00 0.00 C ATOM 3191 CD GLU B 93 -11.331 -14.889 4.345 1.00 0.00 C ATOM 3192 OE1 GLU B 93 -12.555 -15.075 4.511 1.00 0.00 O ATOM 3193 OE2 GLU B 93 -10.520 -15.814 4.131 1.00 0.00 O ATOM 0 H GLU B 93 -13.621 -11.836 2.770 1.00 0.00 H new ATOM 0 HA GLU B 93 -11.896 -11.207 4.750 1.00 0.00 H new ATOM 0 HB2 GLU B 93 -12.073 -13.150 2.716 1.00 0.00 H new ATOM 0 HB3 GLU B 93 -10.465 -12.476 2.543 1.00 0.00 H new ATOM 0 HG2 GLU B 93 -9.713 -13.489 4.409 1.00 0.00 H new ATOM 0 HG3 GLU B 93 -11.115 -13.009 5.345 1.00 0.00 H new ATOM 3200 N ILE B 94 -10.981 -10.012 1.830 1.00 0.00 N ATOM 3201 CA ILE B 94 -10.164 -9.066 1.133 1.00 0.00 C ATOM 3202 C ILE B 94 -10.590 -7.645 1.505 1.00 0.00 C ATOM 3203 O ILE B 94 -9.756 -6.785 1.782 1.00 0.00 O ATOM 3204 CB ILE B 94 -10.269 -9.273 -0.392 1.00 0.00 C ATOM 3205 CG1 ILE B 94 -9.439 -10.484 -0.826 1.00 0.00 C ATOM 3206 CG2 ILE B 94 -9.825 -8.028 -1.143 1.00 0.00 C ATOM 3207 CD1 ILE B 94 -9.723 -11.743 -0.035 1.00 0.00 C ATOM 0 H ILE B 94 -11.650 -10.505 1.238 1.00 0.00 H new ATOM 0 HA ILE B 94 -9.125 -9.218 1.426 1.00 0.00 H new ATOM 0 HB ILE B 94 -11.314 -9.461 -0.637 1.00 0.00 H new ATOM 0 HG12 ILE B 94 -9.627 -10.681 -1.881 1.00 0.00 H new ATOM 0 HG13 ILE B 94 -8.381 -10.239 -0.731 1.00 0.00 H new ATOM 0 HG21 ILE B 94 -9.909 -8.201 -2.216 1.00 0.00 H new ATOM 0 HG22 ILE B 94 -10.459 -7.187 -0.860 1.00 0.00 H new ATOM 0 HG23 ILE B 94 -8.789 -7.802 -0.892 1.00 0.00 H new ATOM 0 HD11 ILE B 94 -9.095 -12.554 -0.404 1.00 0.00 H new ATOM 0 HD12 ILE B 94 -9.507 -11.567 1.019 1.00 0.00 H new ATOM 0 HD13 ILE B 94 -10.772 -12.016 -0.150 1.00 0.00 H new ATOM 3219 N ILE B 95 -11.906 -7.417 1.519 1.00 0.00 N ATOM 3220 CA ILE B 95 -12.457 -6.113 1.870 1.00 0.00 C ATOM 3221 C ILE B 95 -12.076 -5.750 3.298 1.00 0.00 C ATOM 3222 O ILE B 95 -11.355 -4.778 3.521 1.00 0.00 O ATOM 3223 CB ILE B 95 -13.994 -6.079 1.726 1.00 0.00 C ATOM 3224 CG1 ILE B 95 -14.400 -6.429 0.293 1.00 0.00 C ATOM 3225 CG2 ILE B 95 -14.538 -4.710 2.112 1.00 0.00 C ATOM 3226 CD1 ILE B 95 -15.753 -7.099 0.194 1.00 0.00 C ATOM 0 H ILE B 95 -12.607 -8.122 1.291 1.00 0.00 H new ATOM 0 HA ILE B 95 -12.035 -5.386 1.176 1.00 0.00 H new ATOM 0 HB ILE B 95 -14.421 -6.821 2.401 1.00 0.00 H new ATOM 0 HG12 ILE B 95 -14.410 -5.518 -0.306 1.00 0.00 H new ATOM 0 HG13 ILE B 95 -13.646 -7.086 -0.139 1.00 0.00 H new ATOM 0 HG21 ILE B 95 -15.623 -4.706 2.004 1.00 0.00 H new ATOM 0 HG22 ILE B 95 -14.276 -4.493 3.147 1.00 0.00 H new ATOM 0 HG23 ILE B 95 -14.106 -3.950 1.461 1.00 0.00 H new ATOM 0 HD11 ILE B 95 -15.975 -7.318 -0.850 1.00 0.00 H new ATOM 0 HD12 ILE B 95 -15.742 -8.027 0.765 1.00 0.00 H new ATOM 0 HD13 ILE B 95 -16.518 -6.435 0.596 1.00 0.00 H new ATOM 3238 N ALA B 96 -12.549 -6.546 4.266 1.00 0.00 N ATOM 3239 CA ALA B 96 -12.229 -6.307 5.675 1.00 0.00 C ATOM 3240 C ALA B 96 -10.775 -5.859 5.830 1.00 0.00 C ATOM 3241 O ALA B 96 -10.458 -5.045 6.691 1.00 0.00 O ATOM 3242 CB ALA B 96 -12.502 -7.557 6.503 1.00 0.00 C ATOM 0 H ALA B 96 -13.149 -7.354 4.099 1.00 0.00 H new ATOM 0 HA ALA B 96 -12.870 -5.506 6.043 1.00 0.00 H new ATOM 0 HB1 ALA B 96 -12.259 -7.362 7.547 1.00 0.00 H new ATOM 0 HB2 ALA B 96 -13.555 -7.826 6.420 1.00 0.00 H new ATOM 0 HB3 ALA B 96 -11.888 -8.379 6.135 1.00 0.00 H new ATOM 3248 N ALA B 97 -9.903 -6.361 4.954 1.00 0.00 N ATOM 3249 CA ALA B 97 -8.496 -5.966 4.957 1.00 0.00 C ATOM 3250 C ALA B 97 -8.403 -4.463 4.942 1.00 0.00 C ATOM 3251 O ALA B 97 -8.095 -3.829 5.941 1.00 0.00 O ATOM 3252 CB ALA B 97 -7.797 -6.532 3.730 1.00 0.00 C ATOM 0 H ALA B 97 -10.147 -7.041 4.234 1.00 0.00 H new ATOM 0 HA ALA B 97 -8.013 -6.355 5.853 1.00 0.00 H new ATOM 0 HB1 ALA B 97 -6.749 -6.234 3.739 1.00 0.00 H new ATOM 0 HB2 ALA B 97 -7.865 -7.620 3.742 1.00 0.00 H new ATOM 0 HB3 ALA B 97 -8.276 -6.148 2.829 1.00 0.00 H new ATOM 3258 N ILE B 98 -8.708 -3.907 3.795 1.00 0.00 N ATOM 3259 CA ILE B 98 -8.699 -2.486 3.596 1.00 0.00 C ATOM 3260 C ILE B 98 -9.537 -1.795 4.664 1.00 0.00 C ATOM 3261 O ILE B 98 -9.130 -0.820 5.289 1.00 0.00 O ATOM 3262 CB ILE B 98 -9.342 -2.197 2.229 1.00 0.00 C ATOM 3263 CG1 ILE B 98 -8.319 -2.280 1.098 1.00 0.00 C ATOM 3264 CG2 ILE B 98 -10.041 -0.841 2.211 1.00 0.00 C ATOM 3265 CD1 ILE B 98 -7.669 -3.633 0.969 1.00 0.00 C ATOM 0 H ILE B 98 -8.972 -4.439 2.966 1.00 0.00 H new ATOM 0 HA ILE B 98 -7.674 -2.119 3.648 1.00 0.00 H new ATOM 0 HB ILE B 98 -10.094 -2.969 2.066 1.00 0.00 H new ATOM 0 HG12 ILE B 98 -8.810 -2.031 0.157 1.00 0.00 H new ATOM 0 HG13 ILE B 98 -7.546 -1.529 1.263 1.00 0.00 H new ATOM 0 HG21 ILE B 98 -10.483 -0.672 1.229 1.00 0.00 H new ATOM 0 HG22 ILE B 98 -10.824 -0.825 2.969 1.00 0.00 H new ATOM 0 HG23 ILE B 98 -9.316 -0.055 2.422 1.00 0.00 H new ATOM 0 HD11 ILE B 98 -6.955 -3.617 0.146 1.00 0.00 H new ATOM 0 HD12 ILE B 98 -7.149 -3.877 1.896 1.00 0.00 H new ATOM 0 HD13 ILE B 98 -8.432 -4.386 0.772 1.00 0.00 H new ATOM 3277 N ASP B 99 -10.739 -2.314 4.800 1.00 0.00 N ATOM 3278 CA ASP B 99 -11.741 -1.799 5.712 1.00 0.00 C ATOM 3279 C ASP B 99 -11.339 -1.881 7.188 1.00 0.00 C ATOM 3280 O ASP B 99 -11.847 -1.126 8.013 1.00 0.00 O ATOM 3281 CB ASP B 99 -13.028 -2.565 5.450 1.00 0.00 C ATOM 3282 CG ASP B 99 -14.260 -1.681 5.497 1.00 0.00 C ATOM 3283 OD1 ASP B 99 -14.103 -0.441 5.474 1.00 0.00 O ATOM 3284 OD2 ASP B 99 -15.381 -2.227 5.555 1.00 0.00 O ATOM 0 H ASP B 99 -11.055 -3.125 4.268 1.00 0.00 H new ATOM 0 HA ASP B 99 -11.866 -0.733 5.523 1.00 0.00 H new ATOM 0 HB2 ASP B 99 -12.968 -3.044 4.473 1.00 0.00 H new ATOM 0 HB3 ASP B 99 -13.129 -3.360 6.189 1.00 0.00 H new ATOM 3289 N PHE B 100 -10.434 -2.785 7.523 1.00 0.00 N ATOM 3290 CA PHE B 100 -9.984 -2.930 8.903 1.00 0.00 C ATOM 3291 C PHE B 100 -8.604 -2.321 9.058 1.00 0.00 C ATOM 3292 O PHE B 100 -8.297 -1.640 10.036 1.00 0.00 O ATOM 3293 CB PHE B 100 -9.964 -4.408 9.301 1.00 0.00 C ATOM 3294 CG PHE B 100 -9.487 -4.652 10.704 1.00 0.00 C ATOM 3295 CD1 PHE B 100 -10.035 -3.955 11.769 1.00 0.00 C ATOM 3296 CD2 PHE B 100 -8.493 -5.583 10.957 1.00 0.00 C ATOM 3297 CE1 PHE B 100 -9.599 -4.180 13.060 1.00 0.00 C ATOM 3298 CE2 PHE B 100 -8.053 -5.813 12.247 1.00 0.00 C ATOM 3299 CZ PHE B 100 -8.606 -5.111 13.300 1.00 0.00 C ATOM 0 H PHE B 100 -9.996 -3.429 6.864 1.00 0.00 H new ATOM 0 HA PHE B 100 -10.677 -2.406 9.561 1.00 0.00 H new ATOM 0 HB2 PHE B 100 -10.968 -4.817 9.192 1.00 0.00 H new ATOM 0 HB3 PHE B 100 -9.321 -4.952 8.609 1.00 0.00 H new ATOM 0 HD1 PHE B 100 -10.812 -3.227 11.587 1.00 0.00 H new ATOM 0 HD2 PHE B 100 -8.057 -6.135 10.138 1.00 0.00 H new ATOM 0 HE1 PHE B 100 -10.033 -3.629 13.881 1.00 0.00 H new ATOM 0 HE2 PHE B 100 -7.277 -6.541 12.431 1.00 0.00 H new ATOM 0 HZ PHE B 100 -8.263 -5.289 14.309 1.00 0.00 H new ATOM 3309 N LEU B 101 -7.788 -2.594 8.060 1.00 0.00 N ATOM 3310 CA LEU B 101 -6.421 -2.122 7.994 1.00 0.00 C ATOM 3311 C LEU B 101 -6.379 -0.635 7.682 1.00 0.00 C ATOM 3312 O LEU B 101 -5.612 0.120 8.278 1.00 0.00 O ATOM 3313 CB LEU B 101 -5.699 -2.925 6.901 1.00 0.00 C ATOM 3314 CG LEU B 101 -5.104 -2.126 5.728 1.00 0.00 C ATOM 3315 CD1 LEU B 101 -3.604 -1.930 5.883 1.00 0.00 C ATOM 3316 CD2 LEU B 101 -5.430 -2.801 4.393 1.00 0.00 C ATOM 0 H LEU B 101 -8.062 -3.161 7.258 1.00 0.00 H new ATOM 0 HA LEU B 101 -5.928 -2.265 8.955 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -4.893 -3.489 7.371 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -6.402 -3.652 6.494 1.00 0.00 H new ATOM 0 HG LEU B 101 -5.564 -1.138 5.737 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -3.222 -1.362 5.035 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -3.402 -1.386 6.806 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -3.112 -2.902 5.920 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -5.000 -2.220 3.577 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -5.011 -3.807 4.382 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -6.511 -2.857 4.268 1.00 0.00 H new ATOM 3328 N ILE B 102 -7.190 -0.234 6.715 1.00 0.00 N ATOM 3329 CA ILE B 102 -7.225 1.147 6.282 1.00 0.00 C ATOM 3330 C ILE B 102 -8.336 1.936 6.968 1.00 0.00 C ATOM 3331 O ILE B 102 -8.255 3.160 7.072 1.00 0.00 O ATOM 3332 CB ILE B 102 -7.399 1.242 4.753 1.00 0.00 C ATOM 3333 CG1 ILE B 102 -6.529 0.185 4.058 1.00 0.00 C ATOM 3334 CG2 ILE B 102 -7.040 2.640 4.270 1.00 0.00 C ATOM 3335 CD1 ILE B 102 -6.558 0.259 2.547 1.00 0.00 C ATOM 0 H ILE B 102 -7.833 -0.850 6.217 1.00 0.00 H new ATOM 0 HA ILE B 102 -6.269 1.586 6.566 1.00 0.00 H new ATOM 0 HB ILE B 102 -8.442 1.050 4.500 1.00 0.00 H new ATOM 0 HG12 ILE B 102 -5.499 0.297 4.397 1.00 0.00 H new ATOM 0 HG13 ILE B 102 -6.861 -0.805 4.369 1.00 0.00 H new ATOM 0 HG21 ILE B 102 -7.167 2.695 3.189 1.00 0.00 H new ATOM 0 HG22 ILE B 102 -7.693 3.369 4.749 1.00 0.00 H new ATOM 0 HG23 ILE B 102 -6.003 2.858 4.525 1.00 0.00 H new ATOM 0 HD11 ILE B 102 -5.919 -0.520 2.132 1.00 0.00 H new ATOM 0 HD12 ILE B 102 -7.580 0.116 2.195 1.00 0.00 H new ATOM 0 HD13 ILE B 102 -6.197 1.235 2.224 1.00 0.00 H new ATOM 3347 N THR B 103 -9.378 1.246 7.437 1.00 0.00 N ATOM 3348 CA THR B 103 -10.482 1.934 8.106 1.00 0.00 C ATOM 3349 C THR B 103 -10.640 1.467 9.545 1.00 0.00 C ATOM 3350 O THR B 103 -10.952 2.263 10.431 1.00 0.00 O ATOM 3351 CB THR B 103 -11.791 1.740 7.336 1.00 0.00 C ATOM 3352 OG1 THR B 103 -11.548 1.648 5.944 1.00 0.00 O ATOM 3353 CG2 THR B 103 -12.782 2.863 7.554 1.00 0.00 C ATOM 0 H THR B 103 -9.480 0.233 7.368 1.00 0.00 H new ATOM 0 HA THR B 103 -10.242 2.997 8.123 1.00 0.00 H new ATOM 0 HB THR B 103 -12.219 0.815 7.723 1.00 0.00 H new ATOM 0 HG1 THR B 103 -12.397 1.523 5.471 1.00 0.00 H new ATOM 0 HG21 THR B 103 -13.688 2.665 6.981 1.00 0.00 H new ATOM 0 HG22 THR B 103 -13.030 2.929 8.613 1.00 0.00 H new ATOM 0 HG23 THR B 103 -12.343 3.805 7.225 1.00 0.00 H new ATOM 3361 N GLY B 104 -10.417 0.183 9.779 1.00 0.00 N ATOM 3362 CA GLY B 104 -10.536 -0.343 11.122 1.00 0.00 C ATOM 3363 C GLY B 104 -11.945 -0.226 11.671 1.00 0.00 C ATOM 3364 O GLY B 104 -12.144 0.255 12.786 1.00 0.00 O ATOM 0 H GLY B 104 -10.157 -0.500 9.068 1.00 0.00 H new ATOM 0 HA2 GLY B 104 -10.234 -1.390 11.126 1.00 0.00 H new ATOM 0 HA3 GLY B 104 -9.848 0.190 11.779 1.00 0.00 H new ATOM 3368 N ILE B 105 -12.924 -0.665 10.887 1.00 0.00 N ATOM 3369 CA ILE B 105 -14.319 -0.604 11.304 1.00 0.00 C ATOM 3370 C ILE B 105 -14.829 -1.978 11.725 1.00 0.00 C ATOM 3371 O ILE B 105 -16.062 -2.177 11.723 1.00 0.00 O ATOM 3372 CB ILE B 105 -15.226 -0.051 10.184 1.00 0.00 C ATOM 3373 CG1 ILE B 105 -14.813 -0.611 8.819 1.00 0.00 C ATOM 3374 CG2 ILE B 105 -15.180 1.470 10.170 1.00 0.00 C ATOM 3375 CD1 ILE B 105 -14.795 -2.124 8.764 1.00 0.00 C ATOM 3376 OXT ILE B 105 -13.991 -2.845 12.052 1.00 0.00 O ATOM 0 H ILE B 105 -12.777 -1.066 9.961 1.00 0.00 H new ATOM 0 HA ILE B 105 -14.360 0.074 12.157 1.00 0.00 H new ATOM 0 HB ILE B 105 -16.249 -0.369 10.385 1.00 0.00 H new ATOM 0 HG12 ILE B 105 -15.499 -0.236 8.059 1.00 0.00 H new ATOM 0 HG13 ILE B 105 -13.822 -0.235 8.566 1.00 0.00 H new ATOM 0 HG21 ILE B 105 -15.824 1.846 9.375 1.00 0.00 H new ATOM 0 HG22 ILE B 105 -15.526 1.853 11.130 1.00 0.00 H new ATOM 0 HG23 ILE B 105 -14.156 1.801 9.995 1.00 0.00 H new ATOM 0 HD11 ILE B 105 -14.494 -2.448 7.768 1.00 0.00 H new ATOM 0 HD12 ILE B 105 -14.087 -2.506 9.500 1.00 0.00 H new ATOM 0 HD13 ILE B 105 -15.791 -2.508 8.985 1.00 0.00 H new