USER MOD reduce.3.24.130724 H: found=0, std=0, add=1763, rem=0, adj=66 USER MOD reduce.3.24.130724 removed 1766 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 22 SER OG : rot -39:sc= 0.025 USER MOD Set 1.2: B 68 HIS : no HE2:sc= -1.09 X(o=-1.1,f=-0.6) USER MOD Set 2.1: A 98 THR OG1 : rot 180:sc= -0.0752 USER MOD Set 2.2: A 100 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 75 HIS : no HD1:sc= -1.34 K(o=-6,f=-9.8) USER MOD Set 3.2: A 77 ASN :FLIP amide:sc= -4.67! C(o=-12!,f=-6!) USER MOD Set 4.1: A 70 THR OG1 : rot -65:sc= -0.121 USER MOD Set 4.2: A 71 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 32 HIS : no HD1:sc= -0.135 X(o=-0.35,f=-0.49) USER MOD Set 5.2: A 55 HIS :FLIP no HE2:sc= -0.217 F(o=-1.1,f=-0.35) USER MOD Set 6.1: A 20 GLN : amide:sc= -0.172 K(o=-0.38,f=-1.2!) USER MOD Set 6.2: A 107 CYS SG : rot 140:sc= -0.203 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN :FLIP amide:sc= -1.95! C(o=-3.8!,f=-2!) USER MOD Single : A 8 LYS NZ :NH3+ -147:sc= -0.229 (180deg=-1.52!) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 21 CYS SG : rot 180:sc= -1.4 USER MOD Single : A 30 MET CE :methyl -139:sc= -0.303 (180deg=-1.41!) USER MOD Single : A 34 GLN :FLIP amide:sc= 0 F(o=-3.8!,f=0) USER MOD Single : A 36 THR OG1 : rot -69:sc= 1.18 USER MOD Single : A 38 MET CE :methyl 168:sc= -1.42 (180deg=-2.15) USER MOD Single : A 41 ASN :FLIP amide:sc= -0.0614 F(o=-1.4,f=-0.061) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot 30:sc= -0.1 USER MOD Single : A 46 GLN :FLIP amide:sc= 0 F(o=-1.2!,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0.00349 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 155:sc= -0.0519 (180deg=-0.379) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 ASN :FLIP amide:sc= -1.14 F(o=-2.7,f=-1.1) USER MOD Single : A 80 SER OG : rot 180:sc= 0.0269 USER MOD Single : A 81 ASN : amide:sc= -0.0372 X(o=-0.037,f=-0.029) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 85 CYS SG : rot 43:sc= 0.125 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 GLN : amide:sc= -0.411 K(o=-0.41,f=-2.8!) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 157:sc= -3.61! (180deg=-5.06!) USER MOD Single : A 105 SER OG : rot -170:sc= 0 USER MOD Single : A 108 SER OG : rot 97:sc= 1.13 USER MOD Single : A 111 CYS SG : rot -35:sc= 0.0437 USER MOD Single : A 114 ASN : amide:sc= -0.159 X(o=-0.16,f=-0.4) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ 144:sc= 0.195 (180deg=-0.00279) USER MOD Single : A 129 THR OG1 : rot 180:sc= -0.215 USER MOD Single : A 133 LYS NZ :NH3+ -156:sc= -2.11 (180deg=-3.76!) USER MOD Single : A 134 TYR OH : rot -5:sc=-0.00822 USER MOD Single : A 135 ASN :FLIP amide:sc= -1.27 F(o=-3.8!,f=-1.3) USER MOD Single : A 138 SER OG : rot 77:sc= 1.1 USER MOD Single : A 142 THR OG1 : rot -42:sc= 1.32 USER MOD Single : A 143 GLN : amide:sc= -0.445 K(o=-0.45,f=-3.6!) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -100:sc= 0.0842 (180deg=0.0532) USER MOD Single : B 2 GLN : amide:sc= -0.21 X(o=-0.21,f=-0.0059) USER MOD Single : B 6 LYS NZ :NH3+ 152:sc= -2.63! (180deg=-4.53!) USER MOD Single : B 7 THR OG1 : rot 80:sc= 0.197 USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot 180:sc= -0.5 USER MOD Single : B 14 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 180:sc= 0.0215 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 25 ASN :FLIP amide:sc= -0.0491 F(o=-1.1,f=-0.049) USER MOD Single : B 27 LYS NZ :NH3+ 172:sc= -14! (180deg=-14.5!) USER MOD Single : B 29 LYS NZ :NH3+ 172:sc= 0.387 (180deg=0.354) USER MOD Single : B 31 GLN :FLIP amide:sc= -5.73! C(o=-7.7!,f=-5.7!) USER MOD Single : B 33 LYS NZ :NH3+ -133:sc= 0.588 (180deg=-2.93!) USER MOD Single : B 40 GLN : amide:sc= -4.82 K(o=-4.8,f=-6!) USER MOD Single : B 41 GLN :FLIP amide:sc= -1.12 F(o=-1.7,f=-1.1) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 GLN :FLIP amide:sc= 0.0829 F(o=-1.1,f=0.083) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot 130:sc= 0.16 USER MOD Single : B 60 ASN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : B 62 GLN :FLIP amide:sc= -0.0349 F(o=-1.6!,f=-0.035) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot 82:sc= 0.514 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 19.105 17.276 -2.317 1.00 0.00 N ATOM 2 CA ALA A 2 18.291 16.033 -2.201 1.00 0.00 C ATOM 3 C ALA A 2 16.832 16.407 -1.967 1.00 0.00 C ATOM 4 O ALA A 2 15.923 15.744 -2.466 1.00 0.00 O ATOM 5 CB ALA A 2 18.809 15.193 -1.032 1.00 0.00 C ATOM 0 HA ALA A 2 18.370 15.453 -3.120 1.00 0.00 H new ATOM 0 HB1 ALA A 2 18.214 14.283 -0.946 1.00 0.00 H new ATOM 0 HB2 ALA A 2 19.852 14.930 -1.207 1.00 0.00 H new ATOM 0 HB3 ALA A 2 18.730 15.767 -0.109 1.00 0.00 H new ATOM 13 N LEU A 3 16.615 17.472 -1.203 1.00 0.00 N ATOM 14 CA LEU A 3 15.260 17.924 -0.907 1.00 0.00 C ATOM 15 C LEU A 3 14.587 18.459 -2.167 1.00 0.00 C ATOM 16 O LEU A 3 13.367 18.378 -2.312 1.00 0.00 O ATOM 17 CB LEU A 3 15.295 19.020 0.162 1.00 0.00 C ATOM 18 CG LEU A 3 15.753 18.425 1.501 1.00 0.00 C ATOM 19 CD1 LEU A 3 16.294 19.541 2.398 1.00 0.00 C ATOM 20 CD2 LEU A 3 14.571 17.744 2.201 1.00 0.00 C ATOM 0 H LEU A 3 17.353 18.035 -0.780 1.00 0.00 H new ATOM 0 HA LEU A 3 14.687 17.075 -0.535 1.00 0.00 H new ATOM 0 HB2 LEU A 3 15.973 19.817 -0.143 1.00 0.00 H new ATOM 0 HB3 LEU A 3 14.307 19.466 0.271 1.00 0.00 H new ATOM 0 HG LEU A 3 16.536 17.690 1.315 1.00 0.00 H new ATOM 0 HD11 LEU A 3 16.619 19.118 3.349 1.00 0.00 H new ATOM 0 HD12 LEU A 3 17.139 20.024 1.908 1.00 0.00 H new ATOM 0 HD13 LEU A 3 15.510 20.276 2.577 1.00 0.00 H new ATOM 0 HD21 LEU A 3 14.903 17.324 3.150 1.00 0.00 H new ATOM 0 HD22 LEU A 3 13.785 18.477 2.384 1.00 0.00 H new ATOM 0 HD23 LEU A 3 14.183 16.946 1.567 1.00 0.00 H new ATOM 32 N LYS A 4 15.388 19.005 -3.076 1.00 0.00 N ATOM 33 CA LYS A 4 14.854 19.548 -4.320 1.00 0.00 C ATOM 34 C LYS A 4 14.449 18.421 -5.267 1.00 0.00 C ATOM 35 O LYS A 4 13.417 18.501 -5.933 1.00 0.00 O ATOM 36 CB LYS A 4 15.897 20.446 -4.996 1.00 0.00 C ATOM 37 CG LYS A 4 17.251 19.717 -5.078 1.00 0.00 C ATOM 38 CD LYS A 4 18.361 20.603 -4.500 1.00 0.00 C ATOM 39 CE LYS A 4 18.305 20.566 -2.971 1.00 0.00 C ATOM 40 NZ LYS A 4 19.043 21.737 -2.418 1.00 0.00 N ATOM 0 H LYS A 4 16.400 19.083 -2.977 1.00 0.00 H new ATOM 0 HA LYS A 4 13.971 20.142 -4.084 1.00 0.00 H new ATOM 0 HB2 LYS A 4 15.560 20.718 -5.997 1.00 0.00 H new ATOM 0 HB3 LYS A 4 16.008 21.374 -4.434 1.00 0.00 H new ATOM 0 HG2 LYS A 4 17.201 18.777 -4.528 1.00 0.00 H new ATOM 0 HG3 LYS A 4 17.477 19.468 -6.115 1.00 0.00 H new ATOM 0 HD2 LYS A 4 19.334 20.256 -4.847 1.00 0.00 H new ATOM 0 HD3 LYS A 4 18.243 21.627 -4.853 1.00 0.00 H new ATOM 0 HE2 LYS A 4 17.269 20.584 -2.634 1.00 0.00 H new ATOM 0 HE3 LYS A 4 18.744 19.639 -2.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 19.005 21.712 -1.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 20.035 21.701 -2.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 18.605 22.616 -2.759 1.00 0.00 H new ATOM 54 N ARG A 5 15.261 17.368 -5.317 1.00 0.00 N ATOM 55 CA ARG A 5 14.961 16.230 -6.181 1.00 0.00 C ATOM 56 C ARG A 5 13.689 15.533 -5.707 1.00 0.00 C ATOM 57 O ARG A 5 12.810 15.212 -6.506 1.00 0.00 O ATOM 58 CB ARG A 5 16.130 15.229 -6.170 1.00 0.00 C ATOM 59 CG ARG A 5 17.195 15.625 -7.211 1.00 0.00 C ATOM 60 CD ARG A 5 18.347 16.361 -6.523 1.00 0.00 C ATOM 61 NE ARG A 5 19.345 16.765 -7.506 1.00 0.00 N ATOM 62 CZ ARG A 5 20.382 17.521 -7.162 1.00 0.00 C ATOM 63 NH1 ARG A 5 20.521 17.914 -5.925 1.00 0.00 N ATOM 64 NH2 ARG A 5 21.261 17.872 -8.061 1.00 0.00 N ATOM 0 H ARG A 5 16.121 17.279 -4.777 1.00 0.00 H new ATOM 0 HA ARG A 5 14.814 16.596 -7.197 1.00 0.00 H new ATOM 0 HB2 ARG A 5 16.579 15.197 -5.177 1.00 0.00 H new ATOM 0 HB3 ARG A 5 15.759 14.227 -6.385 1.00 0.00 H new ATOM 0 HG2 ARG A 5 17.571 14.735 -7.716 1.00 0.00 H new ATOM 0 HG3 ARG A 5 16.750 16.262 -7.975 1.00 0.00 H new ATOM 0 HD2 ARG A 5 17.967 17.238 -5.999 1.00 0.00 H new ATOM 0 HD3 ARG A 5 18.805 15.715 -5.774 1.00 0.00 H new ATOM 0 HE ARG A 5 19.245 16.462 -8.475 1.00 0.00 H new ATOM 0 HH11 ARG A 5 19.834 17.641 -5.223 1.00 0.00 H new ATOM 0 HH12 ARG A 5 21.317 18.494 -5.661 1.00 0.00 H new ATOM 0 HH21 ARG A 5 21.152 17.566 -9.028 1.00 0.00 H new ATOM 0 HH22 ARG A 5 22.057 18.452 -7.797 1.00 0.00 H new ATOM 78 N ILE A 6 13.601 15.303 -4.401 1.00 0.00 N ATOM 79 CA ILE A 6 12.434 14.644 -3.828 1.00 0.00 C ATOM 80 C ILE A 6 11.183 15.489 -4.042 1.00 0.00 C ATOM 81 O ILE A 6 10.135 14.976 -4.433 1.00 0.00 O ATOM 82 CB ILE A 6 12.648 14.414 -2.331 1.00 0.00 C ATOM 83 CG1 ILE A 6 13.853 13.490 -2.124 1.00 0.00 C ATOM 84 CG2 ILE A 6 11.399 13.764 -1.731 1.00 0.00 C ATOM 85 CD1 ILE A 6 14.326 13.581 -0.672 1.00 0.00 C ATOM 0 H ILE A 6 14.319 15.561 -3.724 1.00 0.00 H new ATOM 0 HA ILE A 6 12.299 13.684 -4.327 1.00 0.00 H new ATOM 0 HB ILE A 6 12.833 15.369 -1.839 1.00 0.00 H new ATOM 0 HG12 ILE A 6 13.582 12.462 -2.365 1.00 0.00 H new ATOM 0 HG13 ILE A 6 14.661 13.773 -2.799 1.00 0.00 H new ATOM 0 HG21 ILE A 6 11.551 13.600 -0.664 1.00 0.00 H new ATOM 0 HG22 ILE A 6 10.541 14.420 -1.879 1.00 0.00 H new ATOM 0 HG23 ILE A 6 11.214 12.809 -2.222 1.00 0.00 H new ATOM 0 HD11 ILE A 6 15.183 12.923 -0.527 1.00 0.00 H new ATOM 0 HD12 ILE A 6 14.614 14.608 -0.447 1.00 0.00 H new ATOM 0 HD13 ILE A 6 13.518 13.277 -0.006 1.00 0.00 H new ATOM 97 N ASN A 7 11.301 16.788 -3.784 1.00 0.00 N ATOM 98 CA ASN A 7 10.171 17.694 -3.954 1.00 0.00 C ATOM 99 C ASN A 7 9.579 17.552 -5.352 1.00 0.00 C ATOM 100 O ASN A 7 8.381 17.752 -5.553 1.00 0.00 O ATOM 101 CB ASN A 7 10.621 19.139 -3.734 1.00 0.00 C ATOM 102 CG ASN A 7 10.888 19.383 -2.253 1.00 0.00 C ATOM 103 OD1 ASN A 7 10.711 18.411 -1.400 1.00 0.00 O flip ATOM 104 ND2 ASN A 7 11.268 20.487 -1.863 1.00 0.00 N flip ATOM 0 H ASN A 7 12.159 17.233 -3.459 1.00 0.00 H new ATOM 0 HA ASN A 7 9.409 17.436 -3.219 1.00 0.00 H new ATOM 0 HB2 ASN A 7 11.523 19.340 -4.312 1.00 0.00 H new ATOM 0 HB3 ASN A 7 9.854 19.826 -4.092 1.00 0.00 H new ATOM 0 HD21 ASN A 7 11.405 21.245 -2.532 1.00 0.00 H new ATOM 0 HD22 ASN A 7 11.445 20.644 -0.871 1.00 0.00 H new ATOM 111 N LYS A 8 10.426 17.204 -6.315 1.00 0.00 N ATOM 112 CA LYS A 8 9.975 17.038 -7.691 1.00 0.00 C ATOM 113 C LYS A 8 9.033 15.843 -7.804 1.00 0.00 C ATOM 114 O LYS A 8 8.095 15.853 -8.602 1.00 0.00 O ATOM 115 CB LYS A 8 11.180 16.835 -8.615 1.00 0.00 C ATOM 116 CG LYS A 8 10.786 17.175 -10.056 1.00 0.00 C ATOM 117 CD LYS A 8 11.995 16.993 -10.982 1.00 0.00 C ATOM 118 CE LYS A 8 12.863 18.255 -10.960 1.00 0.00 C ATOM 119 NZ LYS A 8 12.045 19.432 -11.371 1.00 0.00 N ATOM 0 H LYS A 8 11.421 17.033 -6.170 1.00 0.00 H new ATOM 0 HA LYS A 8 9.438 17.938 -7.991 1.00 0.00 H new ATOM 0 HB2 LYS A 8 12.007 17.468 -8.295 1.00 0.00 H new ATOM 0 HB3 LYS A 8 11.527 15.803 -8.556 1.00 0.00 H new ATOM 0 HG2 LYS A 8 9.968 16.532 -10.380 1.00 0.00 H new ATOM 0 HG3 LYS A 8 10.425 18.202 -10.111 1.00 0.00 H new ATOM 0 HD2 LYS A 8 12.582 16.132 -10.663 1.00 0.00 H new ATOM 0 HD3 LYS A 8 11.658 16.790 -11.999 1.00 0.00 H new ATOM 0 HE2 LYS A 8 13.268 18.412 -9.960 1.00 0.00 H new ATOM 0 HE3 LYS A 8 13.712 18.136 -11.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 12.645 20.110 -11.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 11.271 19.118 -11.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 11.648 19.891 -10.526 1.00 0.00 H new ATOM 133 N GLU A 9 9.288 14.816 -7.000 1.00 0.00 N ATOM 134 CA GLU A 9 8.453 13.620 -7.019 1.00 0.00 C ATOM 135 C GLU A 9 7.073 13.928 -6.444 1.00 0.00 C ATOM 136 O GLU A 9 6.051 13.597 -7.045 1.00 0.00 O ATOM 137 CB GLU A 9 9.123 12.503 -6.205 1.00 0.00 C ATOM 138 CG GLU A 9 8.968 11.165 -6.933 1.00 0.00 C ATOM 139 CD GLU A 9 9.294 10.015 -5.986 1.00 0.00 C ATOM 140 OE1 GLU A 9 9.487 10.277 -4.811 1.00 0.00 O ATOM 141 OE2 GLU A 9 9.347 8.888 -6.452 1.00 0.00 O ATOM 0 H GLU A 9 10.059 14.787 -6.333 1.00 0.00 H new ATOM 0 HA GLU A 9 8.336 13.290 -8.051 1.00 0.00 H new ATOM 0 HB2 GLU A 9 10.180 12.729 -6.062 1.00 0.00 H new ATOM 0 HB3 GLU A 9 8.673 12.442 -5.214 1.00 0.00 H new ATOM 0 HG2 GLU A 9 7.950 11.061 -7.307 1.00 0.00 H new ATOM 0 HG3 GLU A 9 9.630 11.133 -7.798 1.00 0.00 H new ATOM 148 N LEU A 10 7.055 14.565 -5.278 1.00 0.00 N ATOM 149 CA LEU A 10 5.797 14.917 -4.629 1.00 0.00 C ATOM 150 C LEU A 10 4.901 15.682 -5.600 1.00 0.00 C ATOM 151 O LEU A 10 3.680 15.708 -5.447 1.00 0.00 O ATOM 152 CB LEU A 10 6.079 15.775 -3.386 1.00 0.00 C ATOM 153 CG LEU A 10 5.101 15.414 -2.262 1.00 0.00 C ATOM 154 CD1 LEU A 10 5.438 16.232 -1.013 1.00 0.00 C ATOM 155 CD2 LEU A 10 3.667 15.726 -2.705 1.00 0.00 C ATOM 0 H LEU A 10 7.891 14.847 -4.766 1.00 0.00 H new ATOM 0 HA LEU A 10 5.285 14.004 -4.326 1.00 0.00 H new ATOM 0 HB2 LEU A 10 7.104 15.617 -3.051 1.00 0.00 H new ATOM 0 HB3 LEU A 10 5.984 16.832 -3.635 1.00 0.00 H new ATOM 0 HG LEU A 10 5.185 14.351 -2.037 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.744 15.977 -0.213 1.00 0.00 H new ATOM 0 HD12 LEU A 10 6.456 16.008 -0.695 1.00 0.00 H new ATOM 0 HD13 LEU A 10 5.354 17.295 -1.241 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.974 15.468 -1.904 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.579 16.788 -2.932 1.00 0.00 H new ATOM 0 HD23 LEU A 10 3.426 15.144 -3.594 1.00 0.00 H new ATOM 167 N SER A 11 5.518 16.303 -6.600 1.00 0.00 N ATOM 168 CA SER A 11 4.770 17.066 -7.592 1.00 0.00 C ATOM 169 C SER A 11 3.833 16.152 -8.376 1.00 0.00 C ATOM 170 O SER A 11 2.693 16.515 -8.663 1.00 0.00 O ATOM 171 CB SER A 11 5.735 17.757 -8.555 1.00 0.00 C ATOM 172 OG SER A 11 5.037 18.758 -9.282 1.00 0.00 O ATOM 0 H SER A 11 6.528 16.293 -6.744 1.00 0.00 H new ATOM 0 HA SER A 11 4.175 17.817 -7.072 1.00 0.00 H new ATOM 0 HB2 SER A 11 6.562 18.203 -8.002 1.00 0.00 H new ATOM 0 HB3 SER A 11 6.167 17.028 -9.241 1.00 0.00 H new ATOM 0 HG SER A 11 5.654 19.204 -9.899 1.00 0.00 H new ATOM 178 N ASP A 12 4.323 14.965 -8.719 1.00 0.00 N ATOM 179 CA ASP A 12 3.521 14.007 -9.471 1.00 0.00 C ATOM 180 C ASP A 12 2.516 13.315 -8.556 1.00 0.00 C ATOM 181 O ASP A 12 1.386 13.037 -8.955 1.00 0.00 O ATOM 182 CB ASP A 12 4.429 12.960 -10.119 1.00 0.00 C ATOM 183 CG ASP A 12 5.281 13.609 -11.205 1.00 0.00 C ATOM 184 OD1 ASP A 12 6.351 14.094 -10.879 1.00 0.00 O ATOM 185 OD2 ASP A 12 4.849 13.611 -12.346 1.00 0.00 O ATOM 0 H ASP A 12 5.264 14.645 -8.490 1.00 0.00 H new ATOM 0 HA ASP A 12 2.978 14.546 -10.247 1.00 0.00 H new ATOM 0 HB2 ASP A 12 5.071 12.506 -9.364 1.00 0.00 H new ATOM 0 HB3 ASP A 12 3.826 12.159 -10.548 1.00 0.00 H new ATOM 190 N LEU A 13 2.937 13.040 -7.326 1.00 0.00 N ATOM 191 CA LEU A 13 2.066 12.380 -6.360 1.00 0.00 C ATOM 192 C LEU A 13 0.883 13.275 -6.008 1.00 0.00 C ATOM 193 O LEU A 13 -0.272 12.914 -6.237 1.00 0.00 O ATOM 194 CB LEU A 13 2.854 12.049 -5.089 1.00 0.00 C ATOM 195 CG LEU A 13 2.039 11.094 -4.205 1.00 0.00 C ATOM 196 CD1 LEU A 13 2.322 9.645 -4.610 1.00 0.00 C ATOM 197 CD2 LEU A 13 2.434 11.294 -2.739 1.00 0.00 C ATOM 0 H LEU A 13 3.869 13.262 -6.976 1.00 0.00 H new ATOM 0 HA LEU A 13 1.690 11.459 -6.806 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.808 11.592 -5.351 1.00 0.00 H new ATOM 0 HB3 LEU A 13 3.079 12.964 -4.541 1.00 0.00 H new ATOM 0 HG LEU A 13 0.977 11.305 -4.333 1.00 0.00 H new ATOM 0 HD11 LEU A 13 1.741 8.971 -3.980 1.00 0.00 H new ATOM 0 HD12 LEU A 13 2.042 9.498 -5.653 1.00 0.00 H new ATOM 0 HD13 LEU A 13 3.384 9.433 -4.486 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.856 10.616 -2.111 1.00 0.00 H new ATOM 0 HD22 LEU A 13 3.497 11.084 -2.617 1.00 0.00 H new ATOM 0 HD23 LEU A 13 2.231 12.324 -2.445 1.00 0.00 H new ATOM 209 N ALA A 14 1.177 14.445 -5.449 1.00 0.00 N ATOM 210 CA ALA A 14 0.129 15.384 -5.069 1.00 0.00 C ATOM 211 C ALA A 14 -0.813 15.640 -6.241 1.00 0.00 C ATOM 212 O ALA A 14 -1.987 15.955 -6.050 1.00 0.00 O ATOM 213 CB ALA A 14 0.751 16.706 -4.614 1.00 0.00 C ATOM 0 H ALA A 14 2.126 14.763 -5.251 1.00 0.00 H new ATOM 0 HA ALA A 14 -0.441 14.949 -4.248 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -0.039 17.402 -4.332 1.00 0.00 H new ATOM 0 HB2 ALA A 14 1.400 16.527 -3.757 1.00 0.00 H new ATOM 0 HB3 ALA A 14 1.336 17.132 -5.429 1.00 0.00 H new ATOM 219 N ARG A 15 -0.288 15.502 -7.454 1.00 0.00 N ATOM 220 CA ARG A 15 -1.091 15.721 -8.652 1.00 0.00 C ATOM 221 C ARG A 15 -2.294 14.781 -8.667 1.00 0.00 C ATOM 222 O ARG A 15 -3.391 15.166 -9.074 1.00 0.00 O ATOM 223 CB ARG A 15 -0.231 15.488 -9.904 1.00 0.00 C ATOM 224 CG ARG A 15 -0.489 16.598 -10.932 1.00 0.00 C ATOM 225 CD ARG A 15 0.053 17.937 -10.412 1.00 0.00 C ATOM 226 NE ARG A 15 -1.038 18.756 -9.894 1.00 0.00 N ATOM 227 CZ ARG A 15 -1.758 19.532 -10.699 1.00 0.00 C ATOM 228 NH1 ARG A 15 -1.494 19.571 -11.976 1.00 0.00 N ATOM 229 NH2 ARG A 15 -2.728 20.256 -10.210 1.00 0.00 N ATOM 0 H ARG A 15 0.682 15.242 -7.633 1.00 0.00 H new ATOM 0 HA ARG A 15 -1.452 16.749 -8.648 1.00 0.00 H new ATOM 0 HB2 ARG A 15 0.824 15.471 -9.632 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -0.464 14.516 -10.340 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -0.010 16.346 -11.878 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -1.558 16.681 -11.128 1.00 0.00 H new ATOM 0 HD2 ARG A 15 0.788 17.760 -9.627 1.00 0.00 H new ATOM 0 HD3 ARG A 15 0.565 18.467 -11.215 1.00 0.00 H new ATOM 0 HE ARG A 15 -1.252 18.733 -8.897 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -0.735 19.006 -12.357 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -2.047 20.166 -12.593 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -2.933 20.226 -9.211 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -3.281 20.851 -10.827 1.00 0.00 H new ATOM 243 N ASP A 16 -2.079 13.547 -8.223 1.00 0.00 N ATOM 244 CA ASP A 16 -3.150 12.558 -8.192 1.00 0.00 C ATOM 245 C ASP A 16 -2.687 11.289 -7.476 1.00 0.00 C ATOM 246 O ASP A 16 -2.223 10.344 -8.114 1.00 0.00 O ATOM 247 CB ASP A 16 -3.575 12.208 -9.619 1.00 0.00 C ATOM 248 CG ASP A 16 -4.912 11.474 -9.600 1.00 0.00 C ATOM 249 OD1 ASP A 16 -5.902 12.097 -9.252 1.00 0.00 O ATOM 250 OD2 ASP A 16 -4.926 10.302 -9.936 1.00 0.00 O ATOM 0 H ASP A 16 -1.179 13.210 -7.882 1.00 0.00 H new ATOM 0 HA ASP A 16 -3.996 12.982 -7.651 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -3.658 13.116 -10.216 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -2.815 11.585 -10.091 1.00 0.00 H new ATOM 255 N PRO A 17 -2.801 11.250 -6.172 1.00 0.00 N ATOM 256 CA PRO A 17 -2.379 10.067 -5.366 1.00 0.00 C ATOM 257 C PRO A 17 -2.879 8.752 -5.974 1.00 0.00 C ATOM 258 O PRO A 17 -4.048 8.645 -6.345 1.00 0.00 O ATOM 259 CB PRO A 17 -3.024 10.322 -4.001 1.00 0.00 C ATOM 260 CG PRO A 17 -3.131 11.807 -3.896 1.00 0.00 C ATOM 261 CD PRO A 17 -3.342 12.325 -5.321 1.00 0.00 C ATOM 0 HA PRO A 17 -1.295 9.961 -5.318 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -4.004 9.850 -3.933 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -2.416 9.912 -3.194 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -3.963 12.092 -3.252 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -2.228 12.232 -3.458 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -4.397 12.506 -5.528 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -2.818 13.267 -5.486 1.00 0.00 H new ATOM 269 N PRO A 18 -2.032 7.753 -6.084 1.00 0.00 N ATOM 270 CA PRO A 18 -2.432 6.436 -6.662 1.00 0.00 C ATOM 271 C PRO A 18 -3.694 5.881 -6.004 1.00 0.00 C ATOM 272 O PRO A 18 -3.775 5.779 -4.780 1.00 0.00 O ATOM 273 CB PRO A 18 -1.231 5.526 -6.380 1.00 0.00 C ATOM 274 CG PRO A 18 -0.063 6.440 -6.209 1.00 0.00 C ATOM 275 CD PRO A 18 -0.613 7.768 -5.684 1.00 0.00 C ATOM 0 HA PRO A 18 -2.670 6.515 -7.723 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -1.395 4.928 -5.483 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -1.066 4.829 -7.202 1.00 0.00 H new ATOM 0 HG2 PRO A 18 0.659 6.018 -5.510 1.00 0.00 H new ATOM 0 HG3 PRO A 18 0.457 6.584 -7.156 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -0.505 7.844 -4.602 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -0.085 8.617 -6.118 1.00 0.00 H new ATOM 283 N ALA A 19 -4.674 5.525 -6.828 1.00 0.00 N ATOM 284 CA ALA A 19 -5.929 4.981 -6.323 1.00 0.00 C ATOM 285 C ALA A 19 -5.753 3.535 -5.868 1.00 0.00 C ATOM 286 O ALA A 19 -6.410 3.086 -4.929 1.00 0.00 O ATOM 287 CB ALA A 19 -7.000 5.046 -7.414 1.00 0.00 C ATOM 0 H ALA A 19 -4.624 5.603 -7.844 1.00 0.00 H new ATOM 0 HA ALA A 19 -6.240 5.579 -5.467 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -7.935 4.638 -7.031 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -7.152 6.083 -7.713 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -6.677 4.463 -8.276 1.00 0.00 H new ATOM 293 N GLN A 20 -4.870 2.808 -6.546 1.00 0.00 N ATOM 294 CA GLN A 20 -4.626 1.410 -6.208 1.00 0.00 C ATOM 295 C GLN A 20 -3.684 1.290 -5.013 1.00 0.00 C ATOM 296 O GLN A 20 -4.018 0.657 -4.012 1.00 0.00 O ATOM 297 CB GLN A 20 -4.020 0.683 -7.410 1.00 0.00 C ATOM 298 CG GLN A 20 -4.083 -0.828 -7.179 1.00 0.00 C ATOM 299 CD GLN A 20 -3.405 -1.560 -8.332 1.00 0.00 C ATOM 300 OE1 GLN A 20 -2.579 -0.980 -9.037 1.00 0.00 O ATOM 301 NE2 GLN A 20 -3.707 -2.808 -8.568 1.00 0.00 N ATOM 0 H GLN A 20 -4.316 3.160 -7.326 1.00 0.00 H new ATOM 0 HA GLN A 20 -5.580 0.954 -5.944 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -4.563 0.945 -8.318 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -2.986 0.997 -7.554 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -3.594 -1.081 -6.239 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -5.121 -1.148 -7.094 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -4.392 -3.287 -7.983 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -3.258 -3.305 -9.338 1.00 0.00 H new ATOM 310 N CYS A 21 -2.503 1.894 -5.127 1.00 0.00 N ATOM 311 CA CYS A 21 -1.516 1.840 -4.050 1.00 0.00 C ATOM 312 C CYS A 21 -1.199 3.240 -3.535 1.00 0.00 C ATOM 313 O CYS A 21 -0.155 3.808 -3.856 1.00 0.00 O ATOM 314 CB CYS A 21 -0.231 1.182 -4.557 1.00 0.00 C ATOM 315 SG CYS A 21 -0.645 -0.331 -5.460 1.00 0.00 S ATOM 0 H CYS A 21 -2.207 2.423 -5.948 1.00 0.00 H new ATOM 0 HA CYS A 21 -1.933 1.252 -3.232 1.00 0.00 H new ATOM 0 HB2 CYS A 21 0.311 1.870 -5.207 1.00 0.00 H new ATOM 0 HB3 CYS A 21 0.427 0.950 -3.719 1.00 0.00 H new ATOM 0 HG CYS A 21 0.446 -0.890 -5.893 1.00 0.00 H new ATOM 321 N SER A 22 -2.103 3.790 -2.732 1.00 0.00 N ATOM 322 CA SER A 22 -1.904 5.123 -2.177 1.00 0.00 C ATOM 323 C SER A 22 -0.608 5.176 -1.374 1.00 0.00 C ATOM 324 O SER A 22 -0.261 4.224 -0.675 1.00 0.00 O ATOM 325 CB SER A 22 -3.082 5.495 -1.276 1.00 0.00 C ATOM 326 OG SER A 22 -4.298 5.138 -1.921 1.00 0.00 O ATOM 0 H SER A 22 -2.974 3.338 -2.453 1.00 0.00 H new ATOM 0 HA SER A 22 -1.840 5.835 -2.999 1.00 0.00 H new ATOM 0 HB2 SER A 22 -3.000 4.980 -0.319 1.00 0.00 H new ATOM 0 HB3 SER A 22 -3.069 6.564 -1.064 1.00 0.00 H new ATOM 0 HG SER A 22 -4.229 5.331 -2.879 1.00 0.00 H new ATOM 332 N ALA A 23 0.104 6.294 -1.480 1.00 0.00 N ATOM 333 CA ALA A 23 1.362 6.459 -0.759 1.00 0.00 C ATOM 334 C ALA A 23 1.648 7.936 -0.510 1.00 0.00 C ATOM 335 O ALA A 23 0.904 8.807 -0.963 1.00 0.00 O ATOM 336 CB ALA A 23 2.508 5.844 -1.564 1.00 0.00 C ATOM 0 H ALA A 23 -0.166 7.093 -2.053 1.00 0.00 H new ATOM 0 HA ALA A 23 1.278 5.951 0.202 1.00 0.00 H new ATOM 0 HB1 ALA A 23 3.444 5.971 -1.020 1.00 0.00 H new ATOM 0 HB2 ALA A 23 2.317 4.782 -1.715 1.00 0.00 H new ATOM 0 HB3 ALA A 23 2.581 6.341 -2.531 1.00 0.00 H new ATOM 342 N GLY A 24 2.729 8.211 0.212 1.00 0.00 N ATOM 343 CA GLY A 24 3.104 9.587 0.515 1.00 0.00 C ATOM 344 C GLY A 24 4.255 9.630 1.516 1.00 0.00 C ATOM 345 O GLY A 24 4.636 8.606 2.083 1.00 0.00 O ATOM 0 H GLY A 24 3.357 7.505 0.596 1.00 0.00 H new ATOM 0 HA2 GLY A 24 3.395 10.099 -0.402 1.00 0.00 H new ATOM 0 HA3 GLY A 24 2.245 10.122 0.920 1.00 0.00 H new ATOM 349 N PRO A 25 4.808 10.792 1.737 1.00 0.00 N ATOM 350 CA PRO A 25 5.941 10.979 2.690 1.00 0.00 C ATOM 351 C PRO A 25 5.489 10.874 4.146 1.00 0.00 C ATOM 352 O PRO A 25 4.381 11.281 4.493 1.00 0.00 O ATOM 353 CB PRO A 25 6.450 12.388 2.370 1.00 0.00 C ATOM 354 CG PRO A 25 5.271 13.112 1.804 1.00 0.00 C ATOM 355 CD PRO A 25 4.410 12.059 1.101 1.00 0.00 C ATOM 0 HA PRO A 25 6.706 10.211 2.579 1.00 0.00 H new ATOM 0 HB2 PRO A 25 6.824 12.884 3.265 1.00 0.00 H new ATOM 0 HB3 PRO A 25 7.273 12.357 1.656 1.00 0.00 H new ATOM 0 HG2 PRO A 25 4.707 13.611 2.592 1.00 0.00 H new ATOM 0 HG3 PRO A 25 5.590 13.884 1.103 1.00 0.00 H new ATOM 0 HD2 PRO A 25 3.347 12.257 1.237 1.00 0.00 H new ATOM 0 HD3 PRO A 25 4.597 12.043 0.027 1.00 0.00 H new ATOM 363 N VAL A 26 6.356 10.323 4.990 1.00 0.00 N ATOM 364 CA VAL A 26 6.037 10.168 6.405 1.00 0.00 C ATOM 365 C VAL A 26 6.234 11.486 7.146 1.00 0.00 C ATOM 366 O VAL A 26 7.070 12.306 6.764 1.00 0.00 O ATOM 367 CB VAL A 26 6.932 9.094 7.028 1.00 0.00 C ATOM 368 CG1 VAL A 26 6.362 8.678 8.385 1.00 0.00 C ATOM 369 CG2 VAL A 26 6.983 7.874 6.104 1.00 0.00 C ATOM 0 H VAL A 26 7.278 9.979 4.722 1.00 0.00 H new ATOM 0 HA VAL A 26 4.993 9.867 6.491 1.00 0.00 H new ATOM 0 HB VAL A 26 7.937 9.493 7.162 1.00 0.00 H new ATOM 0 HG11 VAL A 26 7.000 7.913 8.828 1.00 0.00 H new ATOM 0 HG12 VAL A 26 6.323 9.545 9.044 1.00 0.00 H new ATOM 0 HG13 VAL A 26 5.357 8.279 8.250 1.00 0.00 H new ATOM 0 HG21 VAL A 26 7.620 7.109 6.547 1.00 0.00 H new ATOM 0 HG22 VAL A 26 5.977 7.476 5.971 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.388 8.168 5.136 1.00 0.00 H new ATOM 379 N GLY A 27 5.460 11.683 8.208 1.00 0.00 N ATOM 380 CA GLY A 27 5.560 12.905 8.997 1.00 0.00 C ATOM 381 C GLY A 27 6.886 12.958 9.746 1.00 0.00 C ATOM 382 O GLY A 27 7.264 13.997 10.286 1.00 0.00 O ATOM 0 H GLY A 27 4.762 11.018 8.540 1.00 0.00 H new ATOM 0 HA2 GLY A 27 5.471 13.773 8.344 1.00 0.00 H new ATOM 0 HA3 GLY A 27 4.734 12.954 9.707 1.00 0.00 H new ATOM 386 N ASP A 28 7.589 11.830 9.774 1.00 0.00 N ATOM 387 CA ASP A 28 8.874 11.759 10.460 1.00 0.00 C ATOM 388 C ASP A 28 9.924 12.579 9.718 1.00 0.00 C ATOM 389 O ASP A 28 10.564 13.457 10.296 1.00 0.00 O ATOM 390 CB ASP A 28 9.335 10.304 10.556 1.00 0.00 C ATOM 391 CG ASP A 28 10.549 10.202 11.473 1.00 0.00 C ATOM 392 OD1 ASP A 28 10.520 10.810 12.530 1.00 0.00 O ATOM 393 OD2 ASP A 28 11.489 9.518 11.105 1.00 0.00 O ATOM 0 H ASP A 28 7.293 10.959 9.333 1.00 0.00 H new ATOM 0 HA ASP A 28 8.752 12.168 11.463 1.00 0.00 H new ATOM 0 HB2 ASP A 28 8.526 9.682 10.939 1.00 0.00 H new ATOM 0 HB3 ASP A 28 9.585 9.927 9.564 1.00 0.00 H new ATOM 398 N ASP A 29 10.096 12.287 8.433 1.00 0.00 N ATOM 399 CA ASP A 29 11.071 13.004 7.620 1.00 0.00 C ATOM 400 C ASP A 29 10.907 12.645 6.147 1.00 0.00 C ATOM 401 O ASP A 29 10.578 11.508 5.808 1.00 0.00 O ATOM 402 CB ASP A 29 12.488 12.656 8.078 1.00 0.00 C ATOM 403 CG ASP A 29 13.487 13.645 7.486 1.00 0.00 C ATOM 404 OD1 ASP A 29 13.083 14.757 7.187 1.00 0.00 O ATOM 405 OD2 ASP A 29 14.640 13.276 7.340 1.00 0.00 O ATOM 0 H ASP A 29 9.577 11.564 7.935 1.00 0.00 H new ATOM 0 HA ASP A 29 10.903 14.074 7.742 1.00 0.00 H new ATOM 0 HB2 ASP A 29 12.543 12.679 9.166 1.00 0.00 H new ATOM 0 HB3 ASP A 29 12.740 11.642 7.767 1.00 0.00 H new ATOM 410 N MET A 30 11.136 13.622 5.276 1.00 0.00 N ATOM 411 CA MET A 30 11.009 13.398 3.841 1.00 0.00 C ATOM 412 C MET A 30 12.032 12.371 3.365 1.00 0.00 C ATOM 413 O MET A 30 11.902 11.810 2.277 1.00 0.00 O ATOM 414 CB MET A 30 11.215 14.713 3.087 1.00 0.00 C ATOM 415 CG MET A 30 10.286 15.784 3.663 1.00 0.00 C ATOM 416 SD MET A 30 8.562 15.279 3.433 1.00 0.00 S ATOM 417 CE MET A 30 8.539 15.348 1.624 1.00 0.00 C ATOM 0 H MET A 30 11.409 14.570 5.536 1.00 0.00 H new ATOM 0 HA MET A 30 10.008 13.016 3.640 1.00 0.00 H new ATOM 0 HB2 MET A 30 12.253 15.034 3.171 1.00 0.00 H new ATOM 0 HB3 MET A 30 11.010 14.572 2.026 1.00 0.00 H new ATOM 0 HG2 MET A 30 10.495 15.929 4.723 1.00 0.00 H new ATOM 0 HG3 MET A 30 10.465 16.739 3.169 1.00 0.00 H new ATOM 0 HE1 MET A 30 7.599 15.786 1.289 1.00 0.00 H new ATOM 0 HE2 MET A 30 9.370 15.960 1.273 1.00 0.00 H new ATOM 0 HE3 MET A 30 8.635 14.340 1.220 1.00 0.00 H new ATOM 427 N PHE A 31 13.049 12.131 4.185 1.00 0.00 N ATOM 428 CA PHE A 31 14.088 11.170 3.835 1.00 0.00 C ATOM 429 C PHE A 31 13.566 9.742 3.973 1.00 0.00 C ATOM 430 O PHE A 31 14.328 8.781 3.874 1.00 0.00 O ATOM 431 CB PHE A 31 15.306 11.363 4.743 1.00 0.00 C ATOM 432 CG PHE A 31 16.126 12.534 4.253 1.00 0.00 C ATOM 433 CD1 PHE A 31 15.719 13.843 4.540 1.00 0.00 C ATOM 434 CD2 PHE A 31 17.292 12.311 3.511 1.00 0.00 C ATOM 435 CE1 PHE A 31 16.479 14.927 4.086 1.00 0.00 C ATOM 436 CE2 PHE A 31 18.052 13.395 3.056 1.00 0.00 C ATOM 437 CZ PHE A 31 17.645 14.704 3.344 1.00 0.00 C ATOM 0 H PHE A 31 13.176 12.585 5.090 1.00 0.00 H new ATOM 0 HA PHE A 31 14.379 11.339 2.798 1.00 0.00 H new ATOM 0 HB2 PHE A 31 14.983 11.537 5.769 1.00 0.00 H new ATOM 0 HB3 PHE A 31 15.914 10.458 4.749 1.00 0.00 H new ATOM 0 HD1 PHE A 31 14.819 14.016 5.111 1.00 0.00 H new ATOM 0 HD2 PHE A 31 17.606 11.302 3.289 1.00 0.00 H new ATOM 0 HE1 PHE A 31 16.166 15.936 4.308 1.00 0.00 H new ATOM 0 HE2 PHE A 31 18.951 13.222 2.483 1.00 0.00 H new ATOM 0 HZ PHE A 31 18.231 15.541 2.994 1.00 0.00 H new ATOM 447 N HIS A 32 12.262 9.611 4.200 1.00 0.00 N ATOM 448 CA HIS A 32 11.650 8.294 4.348 1.00 0.00 C ATOM 449 C HIS A 32 10.217 8.307 3.825 1.00 0.00 C ATOM 450 O HIS A 32 9.376 9.064 4.309 1.00 0.00 O ATOM 451 CB HIS A 32 11.655 7.879 5.823 1.00 0.00 C ATOM 452 CG HIS A 32 13.016 7.359 6.199 1.00 0.00 C ATOM 453 ND1 HIS A 32 13.798 7.967 7.170 1.00 0.00 N ATOM 454 CD2 HIS A 32 13.746 6.289 5.745 1.00 0.00 C ATOM 455 CE1 HIS A 32 14.941 7.264 7.267 1.00 0.00 C ATOM 456 NE2 HIS A 32 14.961 6.231 6.421 1.00 0.00 N ATOM 0 H HIS A 32 11.613 10.394 4.285 1.00 0.00 H new ATOM 0 HA HIS A 32 12.229 7.577 3.767 1.00 0.00 H new ATOM 0 HB2 HIS A 32 11.394 8.731 6.451 1.00 0.00 H new ATOM 0 HB3 HIS A 32 10.901 7.112 5.997 1.00 0.00 H new ATOM 0 HD2 HIS A 32 13.426 5.597 4.980 1.00 0.00 H new ATOM 0 HE1 HIS A 32 15.745 7.506 7.947 1.00 0.00 H new ATOM 0 HE2 HIS A 32 15.707 5.546 6.297 1.00 0.00 H new ATOM 465 N TRP A 33 9.947 7.458 2.836 1.00 0.00 N ATOM 466 CA TRP A 33 8.612 7.367 2.250 1.00 0.00 C ATOM 467 C TRP A 33 7.980 6.021 2.594 1.00 0.00 C ATOM 468 O TRP A 33 8.665 5.102 3.044 1.00 0.00 O ATOM 469 CB TRP A 33 8.695 7.521 0.727 1.00 0.00 C ATOM 470 CG TRP A 33 8.775 8.971 0.364 1.00 0.00 C ATOM 471 CD1 TRP A 33 9.640 9.862 0.899 1.00 0.00 C ATOM 472 CD2 TRP A 33 7.977 9.709 -0.607 1.00 0.00 C ATOM 473 NE1 TRP A 33 9.421 11.101 0.323 1.00 0.00 N ATOM 474 CE2 TRP A 33 8.406 11.057 -0.612 1.00 0.00 C ATOM 475 CE3 TRP A 33 6.931 9.343 -1.473 1.00 0.00 C ATOM 476 CZ2 TRP A 33 7.819 12.009 -1.447 1.00 0.00 C ATOM 477 CZ3 TRP A 33 6.338 10.298 -2.315 1.00 0.00 C ATOM 478 CH2 TRP A 33 6.781 11.628 -2.301 1.00 0.00 C ATOM 0 H TRP A 33 10.633 6.825 2.425 1.00 0.00 H new ATOM 0 HA TRP A 33 7.995 8.168 2.658 1.00 0.00 H new ATOM 0 HB2 TRP A 33 9.570 6.993 0.347 1.00 0.00 H new ATOM 0 HB3 TRP A 33 7.821 7.068 0.259 1.00 0.00 H new ATOM 0 HD1 TRP A 33 10.381 9.642 1.653 1.00 0.00 H new ATOM 0 HE1 TRP A 33 9.945 11.943 0.560 1.00 0.00 H new ATOM 0 HE3 TRP A 33 6.582 8.321 -1.491 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 8.164 13.032 -1.433 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 5.536 10.006 -2.977 1.00 0.00 H new ATOM 0 HH2 TRP A 33 6.320 12.358 -2.950 1.00 0.00 H new ATOM 489 N GLN A 34 6.674 5.911 2.380 1.00 0.00 N ATOM 490 CA GLN A 34 5.963 4.669 2.671 1.00 0.00 C ATOM 491 C GLN A 34 4.830 4.453 1.674 1.00 0.00 C ATOM 492 O GLN A 34 4.148 5.399 1.279 1.00 0.00 O ATOM 493 CB GLN A 34 5.391 4.711 4.093 1.00 0.00 C ATOM 494 CG GLN A 34 6.509 4.462 5.109 1.00 0.00 C ATOM 495 CD GLN A 34 5.913 4.243 6.496 1.00 0.00 C ATOM 496 OE1 GLN A 34 5.892 5.228 7.351 1.00 0.00 O flip ATOM 497 NE2 GLN A 34 5.453 3.145 6.808 1.00 0.00 N flip ATOM 0 H GLN A 34 6.089 6.659 2.009 1.00 0.00 H new ATOM 0 HA GLN A 34 6.669 3.843 2.588 1.00 0.00 H new ATOM 0 HB2 GLN A 34 4.927 5.679 4.280 1.00 0.00 H new ATOM 0 HB3 GLN A 34 4.612 3.957 4.204 1.00 0.00 H new ATOM 0 HG2 GLN A 34 7.093 3.591 4.813 1.00 0.00 H new ATOM 0 HG3 GLN A 34 7.191 5.312 5.127 1.00 0.00 H new ATOM 0 HE21 GLN A 34 5.470 2.376 6.138 1.00 0.00 H new ATOM 0 HE22 GLN A 34 5.055 3.004 7.736 1.00 0.00 H new ATOM 506 N ALA A 35 4.633 3.199 1.276 1.00 0.00 N ATOM 507 CA ALA A 35 3.578 2.856 0.327 1.00 0.00 C ATOM 508 C ALA A 35 2.655 1.800 0.926 1.00 0.00 C ATOM 509 O ALA A 35 2.922 1.272 2.006 1.00 0.00 O ATOM 510 CB ALA A 35 4.193 2.324 -0.968 1.00 0.00 C ATOM 0 H ALA A 35 5.189 2.405 1.595 1.00 0.00 H new ATOM 0 HA ALA A 35 2.999 3.753 0.109 1.00 0.00 H new ATOM 0 HB1 ALA A 35 3.399 2.070 -1.671 1.00 0.00 H new ATOM 0 HB2 ALA A 35 4.835 3.088 -1.406 1.00 0.00 H new ATOM 0 HB3 ALA A 35 4.784 1.434 -0.751 1.00 0.00 H new ATOM 516 N THR A 36 1.569 1.496 0.224 1.00 0.00 N ATOM 517 CA THR A 36 0.616 0.501 0.706 1.00 0.00 C ATOM 518 C THR A 36 0.023 -0.288 -0.453 1.00 0.00 C ATOM 519 O THR A 36 -0.186 0.245 -1.543 1.00 0.00 O ATOM 520 CB THR A 36 -0.506 1.188 1.487 1.00 0.00 C ATOM 521 OG1 THR A 36 0.057 2.139 2.380 1.00 0.00 O ATOM 522 CG2 THR A 36 -1.293 0.143 2.280 1.00 0.00 C ATOM 0 H THR A 36 1.327 1.919 -0.672 1.00 0.00 H new ATOM 0 HA THR A 36 1.146 -0.190 1.362 1.00 0.00 H new ATOM 0 HB THR A 36 -1.177 1.693 0.792 1.00 0.00 H new ATOM 0 HG1 THR A 36 0.550 1.672 3.087 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.092 0.634 2.836 1.00 0.00 H new ATOM 0 HG22 THR A 36 -1.723 -0.586 1.594 1.00 0.00 H new ATOM 0 HG23 THR A 36 -0.625 -0.364 2.976 1.00 0.00 H new ATOM 530 N ILE A 37 -0.243 -1.565 -0.204 1.00 0.00 N ATOM 531 CA ILE A 37 -0.811 -2.438 -1.222 1.00 0.00 C ATOM 532 C ILE A 37 -1.800 -3.411 -0.586 1.00 0.00 C ATOM 533 O ILE A 37 -1.696 -3.727 0.599 1.00 0.00 O ATOM 534 CB ILE A 37 0.310 -3.217 -1.916 1.00 0.00 C ATOM 535 CG1 ILE A 37 1.391 -3.572 -0.893 1.00 0.00 C ATOM 536 CG2 ILE A 37 0.924 -2.360 -3.025 1.00 0.00 C ATOM 537 CD1 ILE A 37 2.359 -4.587 -1.504 1.00 0.00 C ATOM 0 H ILE A 37 -0.074 -2.018 0.694 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.338 -1.831 -1.958 1.00 0.00 H new ATOM 0 HB ILE A 37 -0.100 -4.130 -2.349 1.00 0.00 H new ATOM 0 HG12 ILE A 37 1.931 -2.674 -0.592 1.00 0.00 H new ATOM 0 HG13 ILE A 37 0.934 -3.985 0.006 1.00 0.00 H new ATOM 0 HG21 ILE A 37 1.721 -2.918 -3.517 1.00 0.00 H new ATOM 0 HG22 ILE A 37 0.156 -2.105 -3.755 1.00 0.00 H new ATOM 0 HG23 ILE A 37 1.333 -1.446 -2.594 1.00 0.00 H new ATOM 0 HD11 ILE A 37 3.129 -4.840 -0.775 1.00 0.00 H new ATOM 0 HD12 ILE A 37 1.813 -5.488 -1.783 1.00 0.00 H new ATOM 0 HD13 ILE A 37 2.826 -4.157 -2.390 1.00 0.00 H new ATOM 549 N MET A 38 -2.761 -3.878 -1.378 1.00 0.00 N ATOM 550 CA MET A 38 -3.767 -4.811 -0.876 1.00 0.00 C ATOM 551 C MET A 38 -3.963 -5.970 -1.847 1.00 0.00 C ATOM 552 O MET A 38 -3.990 -5.777 -3.063 1.00 0.00 O ATOM 553 CB MET A 38 -5.098 -4.086 -0.678 1.00 0.00 C ATOM 554 CG MET A 38 -6.067 -4.996 0.076 1.00 0.00 C ATOM 555 SD MET A 38 -7.569 -4.071 0.484 1.00 0.00 S ATOM 556 CE MET A 38 -7.880 -4.837 2.093 1.00 0.00 C ATOM 0 H MET A 38 -2.865 -3.629 -2.362 1.00 0.00 H new ATOM 0 HA MET A 38 -3.419 -5.206 0.078 1.00 0.00 H new ATOM 0 HB2 MET A 38 -4.942 -3.162 -0.121 1.00 0.00 H new ATOM 0 HB3 MET A 38 -5.520 -3.808 -1.644 1.00 0.00 H new ATOM 0 HG2 MET A 38 -6.316 -5.865 -0.534 1.00 0.00 H new ATOM 0 HG3 MET A 38 -5.598 -5.369 0.986 1.00 0.00 H new ATOM 0 HE1 MET A 38 -8.643 -4.268 2.625 1.00 0.00 H new ATOM 0 HE2 MET A 38 -8.226 -5.861 1.948 1.00 0.00 H new ATOM 0 HE3 MET A 38 -6.959 -4.844 2.677 1.00 0.00 H new ATOM 566 N GLY A 39 -4.104 -7.173 -1.299 1.00 0.00 N ATOM 567 CA GLY A 39 -4.304 -8.362 -2.121 1.00 0.00 C ATOM 568 C GLY A 39 -5.250 -8.067 -3.287 1.00 0.00 C ATOM 569 O GLY A 39 -6.461 -7.962 -3.093 1.00 0.00 O ATOM 0 H GLY A 39 -4.084 -7.350 -0.295 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.345 -8.709 -2.505 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -4.713 -9.167 -1.510 1.00 0.00 H new ATOM 573 N PRO A 40 -4.732 -7.932 -4.486 1.00 0.00 N ATOM 574 CA PRO A 40 -5.568 -7.646 -5.692 1.00 0.00 C ATOM 575 C PRO A 40 -6.751 -8.607 -5.820 1.00 0.00 C ATOM 576 O PRO A 40 -7.523 -8.525 -6.775 1.00 0.00 O ATOM 577 CB PRO A 40 -4.594 -7.819 -6.863 1.00 0.00 C ATOM 578 CG PRO A 40 -3.238 -7.579 -6.287 1.00 0.00 C ATOM 579 CD PRO A 40 -3.301 -8.032 -4.827 1.00 0.00 C ATOM 0 HA PRO A 40 -6.016 -6.653 -5.648 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -4.668 -8.818 -7.292 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -4.812 -7.112 -7.664 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -2.479 -8.138 -6.834 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -2.968 -6.525 -6.355 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -2.932 -9.051 -4.709 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -2.692 -7.396 -4.185 1.00 0.00 H new ATOM 587 N ASN A 41 -6.884 -9.514 -4.855 1.00 0.00 N ATOM 588 CA ASN A 41 -7.972 -10.489 -4.866 1.00 0.00 C ATOM 589 C ASN A 41 -7.613 -11.673 -5.758 1.00 0.00 C ATOM 590 O ASN A 41 -8.487 -12.308 -6.348 1.00 0.00 O ATOM 591 CB ASN A 41 -9.268 -9.836 -5.364 1.00 0.00 C ATOM 592 CG ASN A 41 -10.479 -10.532 -4.748 1.00 0.00 C ATOM 593 OD1 ASN A 41 -10.343 -11.721 -4.229 1.00 0.00 O flip ATOM 594 ND2 ASN A 41 -11.578 -9.976 -4.741 1.00 0.00 N flip ATOM 0 H ASN A 41 -6.254 -9.594 -4.057 1.00 0.00 H new ATOM 0 HA ASN A 41 -8.125 -10.847 -3.848 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -9.275 -8.778 -5.102 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -9.319 -9.895 -6.451 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -11.682 -9.046 -5.147 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -12.384 -10.445 -4.329 1.00 0.00 H new ATOM 601 N ASP A 42 -6.318 -11.963 -5.849 1.00 0.00 N ATOM 602 CA ASP A 42 -5.844 -13.073 -6.668 1.00 0.00 C ATOM 603 C ASP A 42 -4.763 -13.855 -5.929 1.00 0.00 C ATOM 604 O ASP A 42 -4.478 -15.005 -6.263 1.00 0.00 O ATOM 605 CB ASP A 42 -5.280 -12.543 -7.988 1.00 0.00 C ATOM 606 CG ASP A 42 -6.418 -12.073 -8.889 1.00 0.00 C ATOM 607 OD1 ASP A 42 -7.121 -12.921 -9.413 1.00 0.00 O ATOM 608 OD2 ASP A 42 -6.570 -10.872 -9.041 1.00 0.00 O ATOM 0 H ASP A 42 -5.581 -11.447 -5.368 1.00 0.00 H new ATOM 0 HA ASP A 42 -6.684 -13.737 -6.873 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -4.594 -11.719 -7.795 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -4.708 -13.324 -8.488 1.00 0.00 H new ATOM 613 N SER A 43 -4.166 -13.223 -4.921 1.00 0.00 N ATOM 614 CA SER A 43 -3.117 -13.869 -4.138 1.00 0.00 C ATOM 615 C SER A 43 -3.668 -14.335 -2.789 1.00 0.00 C ATOM 616 O SER A 43 -4.550 -13.692 -2.220 1.00 0.00 O ATOM 617 CB SER A 43 -1.965 -12.891 -3.907 1.00 0.00 C ATOM 618 OG SER A 43 -1.284 -12.670 -5.135 1.00 0.00 O ATOM 0 H SER A 43 -4.389 -12.271 -4.629 1.00 0.00 H new ATOM 0 HA SER A 43 -2.755 -14.736 -4.691 1.00 0.00 H new ATOM 0 HB2 SER A 43 -2.346 -11.948 -3.514 1.00 0.00 H new ATOM 0 HB3 SER A 43 -1.276 -13.291 -3.163 1.00 0.00 H new ATOM 0 HG SER A 43 -0.546 -12.042 -4.991 1.00 0.00 H new ATOM 624 N PRO A 44 -3.168 -15.429 -2.269 1.00 0.00 N ATOM 625 CA PRO A 44 -3.624 -15.976 -0.960 1.00 0.00 C ATOM 626 C PRO A 44 -3.854 -14.879 0.079 1.00 0.00 C ATOM 627 O PRO A 44 -4.751 -14.982 0.916 1.00 0.00 O ATOM 628 CB PRO A 44 -2.475 -16.892 -0.541 1.00 0.00 C ATOM 629 CG PRO A 44 -1.853 -17.357 -1.819 1.00 0.00 C ATOM 630 CD PRO A 44 -2.113 -16.267 -2.867 1.00 0.00 C ATOM 0 HA PRO A 44 -4.583 -16.489 -1.040 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -1.752 -16.359 0.077 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -2.838 -17.734 0.048 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -0.783 -17.521 -1.690 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -2.285 -18.307 -2.135 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -1.212 -15.688 -3.070 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -2.436 -16.696 -3.815 1.00 0.00 H new ATOM 638 N TYR A 45 -3.032 -13.837 0.023 1.00 0.00 N ATOM 639 CA TYR A 45 -3.148 -12.731 0.966 1.00 0.00 C ATOM 640 C TYR A 45 -4.387 -11.891 0.670 1.00 0.00 C ATOM 641 O TYR A 45 -4.313 -10.664 0.597 1.00 0.00 O ATOM 642 CB TYR A 45 -1.901 -11.848 0.889 1.00 0.00 C ATOM 643 CG TYR A 45 -0.719 -12.597 1.458 1.00 0.00 C ATOM 644 CD1 TYR A 45 -0.685 -12.920 2.819 1.00 0.00 C ATOM 645 CD2 TYR A 45 0.344 -12.969 0.624 1.00 0.00 C ATOM 646 CE1 TYR A 45 0.409 -13.615 3.348 1.00 0.00 C ATOM 647 CE2 TYR A 45 1.438 -13.664 1.153 1.00 0.00 C ATOM 648 CZ TYR A 45 1.470 -13.987 2.515 1.00 0.00 C ATOM 649 OH TYR A 45 2.549 -14.672 3.036 1.00 0.00 O ATOM 0 H TYR A 45 -2.282 -13.735 -0.661 1.00 0.00 H new ATOM 0 HA TYR A 45 -3.241 -13.147 1.969 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -1.704 -11.568 -0.146 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -2.062 -10.924 1.444 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -1.504 -12.633 3.462 1.00 0.00 H new ATOM 0 HD2 TYR A 45 0.319 -12.720 -0.427 1.00 0.00 H new ATOM 0 HE1 TYR A 45 0.434 -13.864 4.399 1.00 0.00 H new ATOM 0 HE2 TYR A 45 2.257 -13.951 0.511 1.00 0.00 H new ATOM 0 HH TYR A 45 2.254 -15.218 3.795 1.00 0.00 H new ATOM 659 N GLN A 46 -5.524 -12.558 0.504 1.00 0.00 N ATOM 660 CA GLN A 46 -6.773 -11.860 0.220 1.00 0.00 C ATOM 661 C GLN A 46 -7.296 -11.164 1.474 1.00 0.00 C ATOM 662 O GLN A 46 -7.600 -11.814 2.474 1.00 0.00 O ATOM 663 CB GLN A 46 -7.822 -12.850 -0.290 1.00 0.00 C ATOM 664 CG GLN A 46 -7.243 -13.656 -1.454 1.00 0.00 C ATOM 665 CD GLN A 46 -8.350 -14.447 -2.143 1.00 0.00 C ATOM 666 OE1 GLN A 46 -9.536 -14.500 -1.601 1.00 0.00 O flip ATOM 667 NE2 GLN A 46 -8.129 -15.031 -3.204 1.00 0.00 N flip ATOM 0 H GLN A 46 -5.607 -13.573 0.561 1.00 0.00 H new ATOM 0 HA GLN A 46 -6.580 -11.109 -0.546 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -8.126 -13.520 0.514 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -8.715 -12.315 -0.613 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -6.765 -12.986 -2.169 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -6.473 -14.335 -1.089 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -7.201 -14.988 -3.626 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -8.874 -15.557 -3.661 1.00 0.00 H new ATOM 676 N GLY A 47 -7.400 -9.840 1.412 1.00 0.00 N ATOM 677 CA GLY A 47 -7.890 -9.065 2.549 1.00 0.00 C ATOM 678 C GLY A 47 -6.740 -8.608 3.440 1.00 0.00 C ATOM 679 O GLY A 47 -6.784 -7.520 4.015 1.00 0.00 O ATOM 0 H GLY A 47 -7.154 -9.284 0.593 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -8.443 -8.197 2.190 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.587 -9.668 3.131 1.00 0.00 H new ATOM 683 N GLY A 48 -5.714 -9.444 3.552 1.00 0.00 N ATOM 684 CA GLY A 48 -4.559 -9.114 4.380 1.00 0.00 C ATOM 685 C GLY A 48 -3.878 -7.841 3.888 1.00 0.00 C ATOM 686 O GLY A 48 -3.557 -7.714 2.706 1.00 0.00 O ATOM 0 H GLY A 48 -5.658 -10.349 3.084 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -4.875 -8.985 5.415 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -3.848 -9.940 4.364 1.00 0.00 H new ATOM 690 N VAL A 49 -3.659 -6.902 4.805 1.00 0.00 N ATOM 691 CA VAL A 49 -3.013 -5.639 4.458 1.00 0.00 C ATOM 692 C VAL A 49 -1.504 -5.733 4.665 1.00 0.00 C ATOM 693 O VAL A 49 -1.036 -6.410 5.580 1.00 0.00 O ATOM 694 CB VAL A 49 -3.575 -4.510 5.325 1.00 0.00 C ATOM 695 CG1 VAL A 49 -5.082 -4.388 5.096 1.00 0.00 C ATOM 696 CG2 VAL A 49 -3.310 -4.820 6.800 1.00 0.00 C ATOM 0 H VAL A 49 -3.917 -6.990 5.788 1.00 0.00 H new ATOM 0 HA VAL A 49 -3.213 -5.428 3.408 1.00 0.00 H new ATOM 0 HB VAL A 49 -3.090 -3.572 5.055 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.480 -3.583 5.714 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.274 -4.167 4.046 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -5.568 -5.326 5.364 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -3.710 -4.016 7.418 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -3.795 -5.759 7.067 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -2.236 -4.906 6.967 1.00 0.00 H new ATOM 706 N PHE A 50 -0.749 -5.048 3.809 1.00 0.00 N ATOM 707 CA PHE A 50 0.710 -5.058 3.905 1.00 0.00 C ATOM 708 C PHE A 50 1.259 -3.636 3.816 1.00 0.00 C ATOM 709 O PHE A 50 0.623 -2.750 3.247 1.00 0.00 O ATOM 710 CB PHE A 50 1.301 -5.908 2.776 1.00 0.00 C ATOM 711 CG PHE A 50 1.157 -7.373 3.118 1.00 0.00 C ATOM 712 CD1 PHE A 50 -0.100 -7.985 3.055 1.00 0.00 C ATOM 713 CD2 PHE A 50 2.279 -8.116 3.502 1.00 0.00 C ATOM 714 CE1 PHE A 50 -0.235 -9.341 3.377 1.00 0.00 C ATOM 715 CE2 PHE A 50 2.145 -9.472 3.823 1.00 0.00 C ATOM 716 CZ PHE A 50 0.888 -10.084 3.760 1.00 0.00 C ATOM 0 H PHE A 50 -1.120 -4.482 3.046 1.00 0.00 H new ATOM 0 HA PHE A 50 0.992 -5.486 4.867 1.00 0.00 H new ATOM 0 HB2 PHE A 50 0.790 -5.691 1.838 1.00 0.00 H new ATOM 0 HB3 PHE A 50 2.352 -5.659 2.632 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -0.966 -7.412 2.758 1.00 0.00 H new ATOM 0 HD2 PHE A 50 3.249 -7.643 3.551 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -1.205 -9.813 3.330 1.00 0.00 H new ATOM 0 HE2 PHE A 50 3.011 -10.045 4.119 1.00 0.00 H new ATOM 0 HZ PHE A 50 0.784 -11.130 4.007 1.00 0.00 H new ATOM 726 N PHE A 51 2.444 -3.427 4.384 1.00 0.00 N ATOM 727 CA PHE A 51 3.071 -2.107 4.365 1.00 0.00 C ATOM 728 C PHE A 51 4.574 -2.234 4.124 1.00 0.00 C ATOM 729 O PHE A 51 5.204 -3.195 4.566 1.00 0.00 O ATOM 730 CB PHE A 51 2.813 -1.392 5.701 1.00 0.00 C ATOM 731 CG PHE A 51 2.150 -0.055 5.450 1.00 0.00 C ATOM 732 CD1 PHE A 51 2.765 0.883 4.612 1.00 0.00 C ATOM 733 CD2 PHE A 51 0.923 0.246 6.056 1.00 0.00 C ATOM 734 CE1 PHE A 51 2.153 2.121 4.379 1.00 0.00 C ATOM 735 CE2 PHE A 51 0.312 1.483 5.822 1.00 0.00 C ATOM 736 CZ PHE A 51 0.927 2.421 4.984 1.00 0.00 C ATOM 0 H PHE A 51 2.986 -4.148 4.860 1.00 0.00 H new ATOM 0 HA PHE A 51 2.637 -1.523 3.553 1.00 0.00 H new ATOM 0 HB2 PHE A 51 2.178 -2.009 6.337 1.00 0.00 H new ATOM 0 HB3 PHE A 51 3.753 -1.247 6.234 1.00 0.00 H new ATOM 0 HD1 PHE A 51 3.711 0.652 4.145 1.00 0.00 H new ATOM 0 HD2 PHE A 51 0.449 -0.477 6.704 1.00 0.00 H new ATOM 0 HE1 PHE A 51 2.627 2.844 3.732 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -0.634 1.714 6.288 1.00 0.00 H new ATOM 0 HZ PHE A 51 0.455 3.376 4.804 1.00 0.00 H new ATOM 746 N LEU A 52 5.142 -1.258 3.421 1.00 0.00 N ATOM 747 CA LEU A 52 6.572 -1.267 3.126 1.00 0.00 C ATOM 748 C LEU A 52 7.160 0.130 3.300 1.00 0.00 C ATOM 749 O LEU A 52 6.426 1.107 3.449 1.00 0.00 O ATOM 750 CB LEU A 52 6.811 -1.752 1.692 1.00 0.00 C ATOM 751 CG LEU A 52 5.818 -1.068 0.738 1.00 0.00 C ATOM 752 CD1 LEU A 52 6.480 -0.851 -0.626 1.00 0.00 C ATOM 753 CD2 LEU A 52 4.578 -1.954 0.560 1.00 0.00 C ATOM 0 H LEU A 52 4.637 -0.455 3.047 1.00 0.00 H new ATOM 0 HA LEU A 52 7.064 -1.947 3.822 1.00 0.00 H new ATOM 0 HB2 LEU A 52 7.834 -1.528 1.389 1.00 0.00 H new ATOM 0 HB3 LEU A 52 6.693 -2.834 1.640 1.00 0.00 H new ATOM 0 HG LEU A 52 5.523 -0.107 1.159 1.00 0.00 H new ATOM 0 HD11 LEU A 52 5.774 -0.366 -1.300 1.00 0.00 H new ATOM 0 HD12 LEU A 52 7.360 -0.219 -0.507 1.00 0.00 H new ATOM 0 HD13 LEU A 52 6.778 -1.813 -1.043 1.00 0.00 H new ATOM 0 HD21 LEU A 52 3.876 -1.466 -0.117 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.875 -2.916 0.143 1.00 0.00 H new ATOM 0 HD23 LEU A 52 4.100 -2.110 1.527 1.00 0.00 H new ATOM 765 N THR A 53 8.488 0.217 3.284 1.00 0.00 N ATOM 766 CA THR A 53 9.168 1.500 3.444 1.00 0.00 C ATOM 767 C THR A 53 10.169 1.724 2.314 1.00 0.00 C ATOM 768 O THR A 53 10.581 0.781 1.639 1.00 0.00 O ATOM 769 CB THR A 53 9.899 1.538 4.788 1.00 0.00 C ATOM 770 OG1 THR A 53 8.988 1.217 5.829 1.00 0.00 O ATOM 771 CG2 THR A 53 10.474 2.936 5.023 1.00 0.00 C ATOM 0 H THR A 53 9.112 -0.581 3.163 1.00 0.00 H new ATOM 0 HA THR A 53 8.419 2.292 3.412 1.00 0.00 H new ATOM 0 HB THR A 53 10.712 0.812 4.779 1.00 0.00 H new ATOM 0 HG1 THR A 53 9.455 1.239 6.690 1.00 0.00 H new ATOM 0 HG21 THR A 53 10.994 2.959 5.981 1.00 0.00 H new ATOM 0 HG22 THR A 53 11.174 3.180 4.224 1.00 0.00 H new ATOM 0 HG23 THR A 53 9.664 3.666 5.032 1.00 0.00 H new ATOM 779 N ILE A 54 10.556 2.982 2.117 1.00 0.00 N ATOM 780 CA ILE A 54 11.509 3.332 1.067 1.00 0.00 C ATOM 781 C ILE A 54 12.520 4.352 1.584 1.00 0.00 C ATOM 782 O ILE A 54 12.148 5.336 2.224 1.00 0.00 O ATOM 783 CB ILE A 54 10.766 3.915 -0.139 1.00 0.00 C ATOM 784 CG1 ILE A 54 9.660 2.943 -0.587 1.00 0.00 C ATOM 785 CG2 ILE A 54 11.752 4.136 -1.289 1.00 0.00 C ATOM 786 CD1 ILE A 54 8.329 3.338 0.059 1.00 0.00 C ATOM 0 H ILE A 54 10.226 3.774 2.669 1.00 0.00 H new ATOM 0 HA ILE A 54 12.039 2.429 0.765 1.00 0.00 H new ATOM 0 HB ILE A 54 10.316 4.867 0.141 1.00 0.00 H new ATOM 0 HG12 ILE A 54 9.567 2.959 -1.673 1.00 0.00 H new ATOM 0 HG13 ILE A 54 9.923 1.923 -0.305 1.00 0.00 H new ATOM 0 HG21 ILE A 54 11.223 4.551 -2.147 1.00 0.00 H new ATOM 0 HG22 ILE A 54 12.531 4.830 -0.972 1.00 0.00 H new ATOM 0 HG23 ILE A 54 12.205 3.185 -1.567 1.00 0.00 H new ATOM 0 HD11 ILE A 54 7.550 2.647 -0.262 1.00 0.00 H new ATOM 0 HD12 ILE A 54 8.425 3.298 1.144 1.00 0.00 H new ATOM 0 HD13 ILE A 54 8.063 4.350 -0.245 1.00 0.00 H new ATOM 798 N HIS A 55 13.798 4.110 1.305 1.00 0.00 N ATOM 799 CA HIS A 55 14.859 5.013 1.749 1.00 0.00 C ATOM 800 C HIS A 55 15.501 5.717 0.556 1.00 0.00 C ATOM 801 O HIS A 55 15.508 5.190 -0.556 1.00 0.00 O ATOM 802 CB HIS A 55 15.927 4.226 2.510 1.00 0.00 C ATOM 803 CG HIS A 55 16.960 5.176 3.051 1.00 0.00 C ATOM 804 ND1 HIS A 55 16.855 6.283 3.857 1.00 0.00 N flip ATOM 805 CD2 HIS A 55 18.310 5.038 2.772 1.00 0.00 C flip ATOM 806 CE1 HIS A 55 18.118 6.825 4.075 1.00 0.00 C flip ATOM 807 NE2 HIS A 55 18.958 6.037 3.399 1.00 0.00 N flip ATOM 0 H HIS A 55 14.124 3.301 0.776 1.00 0.00 H new ATOM 0 HA HIS A 55 14.419 5.763 2.406 1.00 0.00 H new ATOM 0 HB2 HIS A 55 15.469 3.667 3.326 1.00 0.00 H new ATOM 0 HB3 HIS A 55 16.398 3.498 1.849 1.00 0.00 H new ATOM 0 HD1 HIS A 55 15.984 6.652 4.238 1.00 0.00 H new ATOM 0 HD2 HIS A 55 18.760 4.269 2.162 1.00 0.00 H new ATOM 0 HE1 HIS A 55 18.366 7.696 4.664 1.00 0.00 H new ATOM 816 N PHE A 56 16.041 6.910 0.798 1.00 0.00 N ATOM 817 CA PHE A 56 16.689 7.682 -0.262 1.00 0.00 C ATOM 818 C PHE A 56 18.152 7.953 0.096 1.00 0.00 C ATOM 819 O PHE A 56 18.462 8.278 1.242 1.00 0.00 O ATOM 820 CB PHE A 56 15.962 9.014 -0.454 1.00 0.00 C ATOM 821 CG PHE A 56 14.493 8.759 -0.694 1.00 0.00 C ATOM 822 CD1 PHE A 56 13.669 8.366 0.367 1.00 0.00 C ATOM 823 CD2 PHE A 56 13.955 8.916 -1.977 1.00 0.00 C ATOM 824 CE1 PHE A 56 12.307 8.130 0.146 1.00 0.00 C ATOM 825 CE2 PHE A 56 12.593 8.681 -2.198 1.00 0.00 C ATOM 826 CZ PHE A 56 11.769 8.288 -1.137 1.00 0.00 C ATOM 0 H PHE A 56 16.043 7.361 1.713 1.00 0.00 H new ATOM 0 HA PHE A 56 16.647 7.105 -1.186 1.00 0.00 H new ATOM 0 HB2 PHE A 56 16.093 9.642 0.427 1.00 0.00 H new ATOM 0 HB3 PHE A 56 16.390 9.555 -1.298 1.00 0.00 H new ATOM 0 HD1 PHE A 56 14.084 8.245 1.357 1.00 0.00 H new ATOM 0 HD2 PHE A 56 14.591 9.218 -2.796 1.00 0.00 H new ATOM 0 HE1 PHE A 56 11.672 7.826 0.965 1.00 0.00 H new ATOM 0 HE2 PHE A 56 12.178 8.803 -3.187 1.00 0.00 H new ATOM 0 HZ PHE A 56 10.718 8.107 -1.308 1.00 0.00 H new ATOM 836 N PRO A 57 19.052 7.833 -0.850 1.00 0.00 N ATOM 837 CA PRO A 57 20.503 8.078 -0.610 1.00 0.00 C ATOM 838 C PRO A 57 20.831 9.569 -0.562 1.00 0.00 C ATOM 839 O PRO A 57 20.418 10.332 -1.435 1.00 0.00 O ATOM 840 CB PRO A 57 21.174 7.412 -1.812 1.00 0.00 C ATOM 841 CG PRO A 57 20.173 7.526 -2.914 1.00 0.00 C ATOM 842 CD PRO A 57 18.795 7.450 -2.252 1.00 0.00 C ATOM 0 HA PRO A 57 20.838 7.684 0.349 1.00 0.00 H new ATOM 0 HB2 PRO A 57 22.108 7.911 -2.072 1.00 0.00 H new ATOM 0 HB3 PRO A 57 21.417 6.370 -1.603 1.00 0.00 H new ATOM 0 HG2 PRO A 57 20.294 8.465 -3.453 1.00 0.00 H new ATOM 0 HG3 PRO A 57 20.301 6.723 -3.640 1.00 0.00 H new ATOM 0 HD2 PRO A 57 18.086 8.127 -2.727 1.00 0.00 H new ATOM 0 HD3 PRO A 57 18.373 6.447 -2.321 1.00 0.00 H new ATOM 850 N THR A 58 21.578 9.976 0.459 1.00 0.00 N ATOM 851 CA THR A 58 21.954 11.377 0.598 1.00 0.00 C ATOM 852 C THR A 58 22.650 11.865 -0.668 1.00 0.00 C ATOM 853 O THR A 58 22.930 13.054 -0.817 1.00 0.00 O ATOM 854 CB THR A 58 22.887 11.554 1.799 1.00 0.00 C ATOM 855 OG1 THR A 58 23.888 10.546 1.769 1.00 0.00 O ATOM 856 CG2 THR A 58 22.083 11.438 3.095 1.00 0.00 C ATOM 0 H THR A 58 21.931 9.363 1.194 1.00 0.00 H new ATOM 0 HA THR A 58 21.050 11.965 0.756 1.00 0.00 H new ATOM 0 HB THR A 58 23.357 12.537 1.753 1.00 0.00 H new ATOM 0 HG1 THR A 58 24.488 10.658 2.536 1.00 0.00 H new ATOM 0 HG21 THR A 58 22.749 11.564 3.949 1.00 0.00 H new ATOM 0 HG22 THR A 58 21.314 12.211 3.117 1.00 0.00 H new ATOM 0 HG23 THR A 58 21.612 10.456 3.144 1.00 0.00 H new ATOM 864 N ASP A 59 22.925 10.934 -1.579 1.00 0.00 N ATOM 865 CA ASP A 59 23.589 11.272 -2.834 1.00 0.00 C ATOM 866 C ASP A 59 22.561 11.531 -3.932 1.00 0.00 C ATOM 867 O ASP A 59 22.868 11.420 -5.119 1.00 0.00 O ATOM 868 CB ASP A 59 24.515 10.129 -3.256 1.00 0.00 C ATOM 869 CG ASP A 59 25.529 10.628 -4.281 1.00 0.00 C ATOM 870 OD1 ASP A 59 25.139 10.835 -5.418 1.00 0.00 O ATOM 871 OD2 ASP A 59 26.680 10.794 -3.913 1.00 0.00 O ATOM 0 H ASP A 59 22.699 9.945 -1.472 1.00 0.00 H new ATOM 0 HA ASP A 59 24.175 12.178 -2.682 1.00 0.00 H new ATOM 0 HB2 ASP A 59 25.034 9.730 -2.384 1.00 0.00 H new ATOM 0 HB3 ASP A 59 23.929 9.313 -3.680 1.00 0.00 H new ATOM 876 N TYR A 60 21.343 11.877 -3.527 1.00 0.00 N ATOM 877 CA TYR A 60 20.275 12.154 -4.483 1.00 0.00 C ATOM 878 C TYR A 60 19.787 10.857 -5.133 1.00 0.00 C ATOM 879 O TYR A 60 20.548 9.897 -5.255 1.00 0.00 O ATOM 880 CB TYR A 60 20.782 13.119 -5.563 1.00 0.00 C ATOM 881 CG TYR A 60 21.777 14.081 -4.957 1.00 0.00 C ATOM 882 CD1 TYR A 60 21.474 14.738 -3.757 1.00 0.00 C ATOM 883 CD2 TYR A 60 23.001 14.318 -5.594 1.00 0.00 C ATOM 884 CE1 TYR A 60 22.395 15.630 -3.196 1.00 0.00 C ATOM 885 CE2 TYR A 60 23.922 15.210 -5.032 1.00 0.00 C ATOM 886 CZ TYR A 60 23.619 15.866 -3.833 1.00 0.00 C ATOM 887 OH TYR A 60 24.527 16.746 -3.279 1.00 0.00 O ATOM 0 H TYR A 60 21.071 11.972 -2.548 1.00 0.00 H new ATOM 0 HA TYR A 60 19.441 12.612 -3.951 1.00 0.00 H new ATOM 0 HB2 TYR A 60 21.249 12.560 -6.374 1.00 0.00 H new ATOM 0 HB3 TYR A 60 19.946 13.669 -5.995 1.00 0.00 H new ATOM 0 HD1 TYR A 60 20.530 14.556 -3.265 1.00 0.00 H new ATOM 0 HD2 TYR A 60 23.235 13.812 -6.519 1.00 0.00 H new ATOM 0 HE1 TYR A 60 22.161 16.137 -2.271 1.00 0.00 H new ATOM 0 HE2 TYR A 60 24.866 15.392 -5.523 1.00 0.00 H new ATOM 0 HH TYR A 60 25.325 16.794 -3.847 1.00 0.00 H new ATOM 897 N PRO A 61 18.543 10.808 -5.551 1.00 0.00 N ATOM 898 CA PRO A 61 17.963 9.595 -6.196 1.00 0.00 C ATOM 899 C PRO A 61 18.875 9.040 -7.288 1.00 0.00 C ATOM 900 O PRO A 61 18.770 7.871 -7.660 1.00 0.00 O ATOM 901 CB PRO A 61 16.618 10.072 -6.778 1.00 0.00 C ATOM 902 CG PRO A 61 16.578 11.559 -6.588 1.00 0.00 C ATOM 903 CD PRO A 61 17.552 11.886 -5.461 1.00 0.00 C ATOM 0 HA PRO A 61 17.841 8.778 -5.485 1.00 0.00 H new ATOM 0 HB2 PRO A 61 16.538 9.813 -7.834 1.00 0.00 H new ATOM 0 HB3 PRO A 61 15.782 9.593 -6.268 1.00 0.00 H new ATOM 0 HG2 PRO A 61 16.862 12.074 -7.506 1.00 0.00 H new ATOM 0 HG3 PRO A 61 15.570 11.889 -6.336 1.00 0.00 H new ATOM 0 HD2 PRO A 61 18.010 12.866 -5.596 1.00 0.00 H new ATOM 0 HD3 PRO A 61 17.056 11.897 -4.491 1.00 0.00 H new ATOM 911 N PHE A 62 19.772 9.882 -7.791 1.00 0.00 N ATOM 912 CA PHE A 62 20.699 9.454 -8.832 1.00 0.00 C ATOM 913 C PHE A 62 21.330 8.118 -8.451 1.00 0.00 C ATOM 914 O PHE A 62 21.922 7.436 -9.288 1.00 0.00 O ATOM 915 CB PHE A 62 21.795 10.508 -9.026 1.00 0.00 C ATOM 916 CG PHE A 62 21.297 11.596 -9.951 1.00 0.00 C ATOM 917 CD1 PHE A 62 20.193 12.375 -9.584 1.00 0.00 C ATOM 918 CD2 PHE A 62 21.939 11.826 -11.174 1.00 0.00 C ATOM 919 CE1 PHE A 62 19.731 13.383 -10.439 1.00 0.00 C ATOM 920 CE2 PHE A 62 21.477 12.834 -12.029 1.00 0.00 C ATOM 921 CZ PHE A 62 20.373 13.612 -11.662 1.00 0.00 C ATOM 0 H PHE A 62 19.876 10.854 -7.499 1.00 0.00 H new ATOM 0 HA PHE A 62 20.149 9.336 -9.766 1.00 0.00 H new ATOM 0 HB2 PHE A 62 22.076 10.936 -8.064 1.00 0.00 H new ATOM 0 HB3 PHE A 62 22.689 10.044 -9.442 1.00 0.00 H new ATOM 0 HD1 PHE A 62 19.697 12.198 -8.641 1.00 0.00 H new ATOM 0 HD2 PHE A 62 22.791 11.226 -11.458 1.00 0.00 H new ATOM 0 HE1 PHE A 62 18.880 13.984 -10.155 1.00 0.00 H new ATOM 0 HE2 PHE A 62 21.973 13.011 -12.972 1.00 0.00 H new ATOM 0 HZ PHE A 62 20.016 14.389 -12.322 1.00 0.00 H new ATOM 931 N LYS A 63 21.192 7.754 -7.179 1.00 0.00 N ATOM 932 CA LYS A 63 21.744 6.498 -6.679 1.00 0.00 C ATOM 933 C LYS A 63 20.607 5.519 -6.359 1.00 0.00 C ATOM 934 O LYS A 63 19.620 5.902 -5.730 1.00 0.00 O ATOM 935 CB LYS A 63 22.569 6.771 -5.410 1.00 0.00 C ATOM 936 CG LYS A 63 24.064 6.588 -5.701 1.00 0.00 C ATOM 937 CD LYS A 63 24.554 7.710 -6.622 1.00 0.00 C ATOM 938 CE LYS A 63 25.897 7.315 -7.238 1.00 0.00 C ATOM 939 NZ LYS A 63 26.333 8.370 -8.197 1.00 0.00 N ATOM 0 H LYS A 63 20.704 8.310 -6.477 1.00 0.00 H new ATOM 0 HA LYS A 63 22.387 6.057 -7.441 1.00 0.00 H new ATOM 0 HB2 LYS A 63 22.381 7.785 -5.056 1.00 0.00 H new ATOM 0 HB3 LYS A 63 22.260 6.093 -4.614 1.00 0.00 H new ATOM 0 HG2 LYS A 63 24.629 6.597 -4.769 1.00 0.00 H new ATOM 0 HG3 LYS A 63 24.237 5.619 -6.169 1.00 0.00 H new ATOM 0 HD2 LYS A 63 23.822 7.895 -7.408 1.00 0.00 H new ATOM 0 HD3 LYS A 63 24.659 8.637 -6.059 1.00 0.00 H new ATOM 0 HE2 LYS A 63 26.645 7.188 -6.455 1.00 0.00 H new ATOM 0 HE3 LYS A 63 25.807 6.357 -7.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 27.246 8.102 -8.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 25.622 8.470 -8.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 26.435 9.275 -7.695 1.00 0.00 H new ATOM 953 N PRO A 64 20.717 4.275 -6.767 1.00 0.00 N ATOM 954 CA PRO A 64 19.659 3.256 -6.495 1.00 0.00 C ATOM 955 C PRO A 64 19.293 3.194 -5.006 1.00 0.00 C ATOM 956 O PRO A 64 20.138 2.868 -4.172 1.00 0.00 O ATOM 957 CB PRO A 64 20.292 1.933 -6.945 1.00 0.00 C ATOM 958 CG PRO A 64 21.362 2.307 -7.918 1.00 0.00 C ATOM 959 CD PRO A 64 21.843 3.706 -7.530 1.00 0.00 C ATOM 0 HA PRO A 64 18.730 3.488 -7.016 1.00 0.00 H new ATOM 0 HB2 PRO A 64 20.707 1.389 -6.097 1.00 0.00 H new ATOM 0 HB3 PRO A 64 19.551 1.282 -7.409 1.00 0.00 H new ATOM 0 HG2 PRO A 64 22.184 1.592 -7.882 1.00 0.00 H new ATOM 0 HG3 PRO A 64 20.977 2.300 -8.938 1.00 0.00 H new ATOM 0 HD2 PRO A 64 22.751 3.663 -6.928 1.00 0.00 H new ATOM 0 HD3 PRO A 64 22.072 4.307 -8.410 1.00 0.00 H new ATOM 967 N PRO A 65 18.064 3.495 -4.656 1.00 0.00 N ATOM 968 CA PRO A 65 17.609 3.463 -3.237 1.00 0.00 C ATOM 969 C PRO A 65 17.341 2.041 -2.751 1.00 0.00 C ATOM 970 O PRO A 65 17.360 1.093 -3.536 1.00 0.00 O ATOM 971 CB PRO A 65 16.322 4.290 -3.256 1.00 0.00 C ATOM 972 CG PRO A 65 15.776 4.132 -4.638 1.00 0.00 C ATOM 973 CD PRO A 65 16.974 3.897 -5.566 1.00 0.00 C ATOM 0 HA PRO A 65 18.362 3.854 -2.553 1.00 0.00 H new ATOM 0 HB2 PRO A 65 15.613 3.933 -2.509 1.00 0.00 H new ATOM 0 HB3 PRO A 65 16.523 5.337 -3.029 1.00 0.00 H new ATOM 0 HG2 PRO A 65 15.081 3.294 -4.685 1.00 0.00 H new ATOM 0 HG3 PRO A 65 15.223 5.022 -4.939 1.00 0.00 H new ATOM 0 HD2 PRO A 65 16.762 3.120 -6.301 1.00 0.00 H new ATOM 0 HD3 PRO A 65 17.231 4.799 -6.121 1.00 0.00 H new ATOM 981 N LYS A 66 17.090 1.901 -1.452 1.00 0.00 N ATOM 982 CA LYS A 66 16.816 0.591 -0.866 1.00 0.00 C ATOM 983 C LYS A 66 15.355 0.488 -0.442 1.00 0.00 C ATOM 984 O LYS A 66 14.844 1.349 0.275 1.00 0.00 O ATOM 985 CB LYS A 66 17.716 0.363 0.352 1.00 0.00 C ATOM 986 CG LYS A 66 19.187 0.332 -0.088 1.00 0.00 C ATOM 987 CD LYS A 66 20.012 -0.496 0.907 1.00 0.00 C ATOM 988 CE LYS A 66 19.972 -1.974 0.506 1.00 0.00 C ATOM 989 NZ LYS A 66 20.804 -2.181 -0.712 1.00 0.00 N ATOM 0 H LYS A 66 17.071 2.674 -0.787 1.00 0.00 H new ATOM 0 HA LYS A 66 17.021 -0.170 -1.619 1.00 0.00 H new ATOM 0 HB2 LYS A 66 17.562 1.157 1.083 1.00 0.00 H new ATOM 0 HB3 LYS A 66 17.453 -0.576 0.840 1.00 0.00 H new ATOM 0 HG2 LYS A 66 19.268 -0.097 -1.087 1.00 0.00 H new ATOM 0 HG3 LYS A 66 19.580 1.347 -0.144 1.00 0.00 H new ATOM 0 HD2 LYS A 66 21.043 -0.141 0.924 1.00 0.00 H new ATOM 0 HD3 LYS A 66 19.616 -0.372 1.915 1.00 0.00 H new ATOM 0 HE2 LYS A 66 20.343 -2.593 1.322 1.00 0.00 H new ATOM 0 HE3 LYS A 66 18.944 -2.282 0.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 21.128 -3.168 -0.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 20.238 -1.972 -1.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 21.628 -1.547 -0.682 1.00 0.00 H new ATOM 1003 N VAL A 67 14.687 -0.571 -0.891 1.00 0.00 N ATOM 1004 CA VAL A 67 13.282 -0.782 -0.554 1.00 0.00 C ATOM 1005 C VAL A 67 13.148 -1.877 0.502 1.00 0.00 C ATOM 1006 O VAL A 67 13.488 -3.035 0.257 1.00 0.00 O ATOM 1007 CB VAL A 67 12.499 -1.174 -1.811 1.00 0.00 C ATOM 1008 CG1 VAL A 67 12.181 0.080 -2.629 1.00 0.00 C ATOM 1009 CG2 VAL A 67 13.341 -2.131 -2.660 1.00 0.00 C ATOM 0 H VAL A 67 15.093 -1.293 -1.486 1.00 0.00 H new ATOM 0 HA VAL A 67 12.875 0.146 -0.151 1.00 0.00 H new ATOM 0 HB VAL A 67 11.570 -1.664 -1.519 1.00 0.00 H new ATOM 0 HG11 VAL A 67 11.624 -0.200 -3.523 1.00 0.00 H new ATOM 0 HG12 VAL A 67 11.582 0.764 -2.028 1.00 0.00 H new ATOM 0 HG13 VAL A 67 13.110 0.570 -2.919 1.00 0.00 H new ATOM 0 HG21 VAL A 67 12.784 -2.410 -3.554 1.00 0.00 H new ATOM 0 HG22 VAL A 67 14.270 -1.639 -2.950 1.00 0.00 H new ATOM 0 HG23 VAL A 67 13.569 -3.026 -2.081 1.00 0.00 H new ATOM 1019 N ALA A 68 12.652 -1.502 1.678 1.00 0.00 N ATOM 1020 CA ALA A 68 12.477 -2.457 2.769 1.00 0.00 C ATOM 1021 C ALA A 68 11.004 -2.816 2.940 1.00 0.00 C ATOM 1022 O ALA A 68 10.123 -2.099 2.465 1.00 0.00 O ATOM 1023 CB ALA A 68 13.012 -1.862 4.073 1.00 0.00 C ATOM 0 H ALA A 68 12.365 -0.549 1.900 1.00 0.00 H new ATOM 0 HA ALA A 68 13.033 -3.362 2.525 1.00 0.00 H new ATOM 0 HB1 ALA A 68 12.878 -2.580 4.882 1.00 0.00 H new ATOM 0 HB2 ALA A 68 14.072 -1.635 3.961 1.00 0.00 H new ATOM 0 HB3 ALA A 68 12.467 -0.947 4.306 1.00 0.00 H new ATOM 1029 N PHE A 69 10.746 -3.930 3.621 1.00 0.00 N ATOM 1030 CA PHE A 69 9.376 -4.381 3.852 1.00 0.00 C ATOM 1031 C PHE A 69 9.155 -4.673 5.335 1.00 0.00 C ATOM 1032 O PHE A 69 9.713 -5.625 5.880 1.00 0.00 O ATOM 1033 CB PHE A 69 9.099 -5.645 3.026 1.00 0.00 C ATOM 1034 CG PHE A 69 7.687 -5.608 2.483 1.00 0.00 C ATOM 1035 CD1 PHE A 69 6.610 -5.374 3.347 1.00 0.00 C ATOM 1036 CD2 PHE A 69 7.457 -5.809 1.116 1.00 0.00 C ATOM 1037 CE1 PHE A 69 5.304 -5.342 2.844 1.00 0.00 C ATOM 1038 CE2 PHE A 69 6.151 -5.776 0.614 1.00 0.00 C ATOM 1039 CZ PHE A 69 5.075 -5.543 1.478 1.00 0.00 C ATOM 0 H PHE A 69 11.464 -4.534 4.021 1.00 0.00 H new ATOM 0 HA PHE A 69 8.690 -3.591 3.545 1.00 0.00 H new ATOM 0 HB2 PHE A 69 9.812 -5.716 2.204 1.00 0.00 H new ATOM 0 HB3 PHE A 69 9.236 -6.532 3.645 1.00 0.00 H new ATOM 0 HD1 PHE A 69 6.787 -5.218 4.401 1.00 0.00 H new ATOM 0 HD2 PHE A 69 8.287 -5.989 0.449 1.00 0.00 H new ATOM 0 HE1 PHE A 69 4.473 -5.162 3.510 1.00 0.00 H new ATOM 0 HE2 PHE A 69 5.974 -5.930 -0.440 1.00 0.00 H new ATOM 0 HZ PHE A 69 4.067 -5.518 1.090 1.00 0.00 H new ATOM 1049 N THR A 70 8.338 -3.848 5.982 1.00 0.00 N ATOM 1050 CA THR A 70 8.052 -4.028 7.401 1.00 0.00 C ATOM 1051 C THR A 70 7.316 -5.344 7.637 1.00 0.00 C ATOM 1052 O THR A 70 7.680 -6.120 8.521 1.00 0.00 O ATOM 1053 CB THR A 70 7.201 -2.865 7.915 1.00 0.00 C ATOM 1054 OG1 THR A 70 5.844 -3.074 7.548 1.00 0.00 O ATOM 1055 CG2 THR A 70 7.700 -1.555 7.305 1.00 0.00 C ATOM 0 H THR A 70 7.865 -3.054 5.550 1.00 0.00 H new ATOM 0 HA THR A 70 8.998 -4.052 7.942 1.00 0.00 H new ATOM 0 HB THR A 70 7.280 -2.810 9.001 1.00 0.00 H new ATOM 0 HG1 THR A 70 5.761 -3.044 6.572 1.00 0.00 H new ATOM 0 HG21 THR A 70 7.092 -0.728 7.672 1.00 0.00 H new ATOM 0 HG22 THR A 70 8.740 -1.395 7.588 1.00 0.00 H new ATOM 0 HG23 THR A 70 7.623 -1.607 6.219 1.00 0.00 H new ATOM 1063 N THR A 71 6.279 -5.587 6.842 1.00 0.00 N ATOM 1064 CA THR A 71 5.496 -6.812 6.973 1.00 0.00 C ATOM 1065 C THR A 71 6.142 -7.948 6.186 1.00 0.00 C ATOM 1066 O THR A 71 6.582 -7.760 5.052 1.00 0.00 O ATOM 1067 CB THR A 71 4.073 -6.577 6.460 1.00 0.00 C ATOM 1068 OG1 THR A 71 3.565 -5.371 7.013 1.00 0.00 O ATOM 1069 CG2 THR A 71 3.179 -7.747 6.873 1.00 0.00 C ATOM 0 H THR A 71 5.962 -4.957 6.105 1.00 0.00 H new ATOM 0 HA THR A 71 5.462 -7.090 8.026 1.00 0.00 H new ATOM 0 HB THR A 71 4.087 -6.501 5.373 1.00 0.00 H new ATOM 0 HG1 THR A 71 2.655 -5.218 6.684 1.00 0.00 H new ATOM 0 HG21 THR A 71 2.166 -7.578 6.507 1.00 0.00 H new ATOM 0 HG22 THR A 71 3.569 -8.671 6.447 1.00 0.00 H new ATOM 0 HG23 THR A 71 3.163 -7.827 7.960 1.00 0.00 H new ATOM 1077 N ARG A 72 6.197 -9.128 6.797 1.00 0.00 N ATOM 1078 CA ARG A 72 6.794 -10.290 6.145 1.00 0.00 C ATOM 1079 C ARG A 72 5.809 -10.920 5.164 1.00 0.00 C ATOM 1080 O ARG A 72 4.774 -11.451 5.564 1.00 0.00 O ATOM 1081 CB ARG A 72 7.204 -11.328 7.196 1.00 0.00 C ATOM 1082 CG ARG A 72 8.568 -10.955 7.785 1.00 0.00 C ATOM 1083 CD ARG A 72 8.922 -11.922 8.916 1.00 0.00 C ATOM 1084 NE ARG A 72 9.392 -13.189 8.368 1.00 0.00 N ATOM 1085 CZ ARG A 72 10.163 -14.004 9.081 1.00 0.00 C ATOM 1086 NH1 ARG A 72 10.510 -13.678 10.296 1.00 0.00 N ATOM 1087 NH2 ARG A 72 10.574 -15.130 8.566 1.00 0.00 N ATOM 0 H ARG A 72 5.839 -9.305 7.735 1.00 0.00 H new ATOM 0 HA ARG A 72 7.676 -9.960 5.596 1.00 0.00 H new ATOM 0 HB2 ARG A 72 6.456 -11.374 7.987 1.00 0.00 H new ATOM 0 HB3 ARG A 72 7.251 -12.319 6.744 1.00 0.00 H new ATOM 0 HG2 ARG A 72 9.333 -10.992 7.009 1.00 0.00 H new ATOM 0 HG3 ARG A 72 8.545 -9.932 8.161 1.00 0.00 H new ATOM 0 HD2 ARG A 72 9.692 -11.484 9.551 1.00 0.00 H new ATOM 0 HD3 ARG A 72 8.049 -12.092 9.546 1.00 0.00 H new ATOM 0 HE ARG A 72 9.124 -13.455 7.420 1.00 0.00 H new ATOM 0 HH11 ARG A 72 10.190 -12.797 10.699 1.00 0.00 H new ATOM 0 HH12 ARG A 72 11.102 -14.304 10.843 1.00 0.00 H new ATOM 0 HH21 ARG A 72 10.304 -15.385 7.616 1.00 0.00 H new ATOM 0 HH22 ARG A 72 11.166 -15.755 9.113 1.00 0.00 H new ATOM 1101 N ILE A 73 6.145 -10.860 3.878 1.00 0.00 N ATOM 1102 CA ILE A 73 5.290 -11.432 2.840 1.00 0.00 C ATOM 1103 C ILE A 73 5.970 -12.638 2.201 1.00 0.00 C ATOM 1104 O ILE A 73 7.112 -12.552 1.751 1.00 0.00 O ATOM 1105 CB ILE A 73 4.993 -10.380 1.770 1.00 0.00 C ATOM 1106 CG1 ILE A 73 4.069 -10.980 0.707 1.00 0.00 C ATOM 1107 CG2 ILE A 73 6.301 -9.932 1.114 1.00 0.00 C ATOM 1108 CD1 ILE A 73 3.642 -9.886 -0.273 1.00 0.00 C ATOM 0 H ILE A 73 6.999 -10.423 3.530 1.00 0.00 H new ATOM 0 HA ILE A 73 4.354 -11.754 3.297 1.00 0.00 H new ATOM 0 HB ILE A 73 4.507 -9.521 2.232 1.00 0.00 H new ATOM 0 HG12 ILE A 73 4.582 -11.781 0.174 1.00 0.00 H new ATOM 0 HG13 ILE A 73 3.192 -11.422 1.180 1.00 0.00 H new ATOM 0 HG21 ILE A 73 6.088 -9.182 0.352 1.00 0.00 H new ATOM 0 HG22 ILE A 73 6.959 -9.504 1.870 1.00 0.00 H new ATOM 0 HG23 ILE A 73 6.789 -10.790 0.652 1.00 0.00 H new ATOM 0 HD11 ILE A 73 2.984 -10.312 -1.030 1.00 0.00 H new ATOM 0 HD12 ILE A 73 3.113 -9.100 0.267 1.00 0.00 H new ATOM 0 HD13 ILE A 73 4.524 -9.464 -0.755 1.00 0.00 H new ATOM 1120 N TYR A 74 5.263 -13.762 2.171 1.00 0.00 N ATOM 1121 CA TYR A 74 5.812 -14.981 1.590 1.00 0.00 C ATOM 1122 C TYR A 74 5.780 -14.913 0.064 1.00 0.00 C ATOM 1123 O TYR A 74 4.761 -15.209 -0.560 1.00 0.00 O ATOM 1124 CB TYR A 74 5.010 -16.196 2.079 1.00 0.00 C ATOM 1125 CG TYR A 74 5.939 -17.367 2.310 1.00 0.00 C ATOM 1126 CD1 TYR A 74 6.932 -17.287 3.294 1.00 0.00 C ATOM 1127 CD2 TYR A 74 5.805 -18.532 1.544 1.00 0.00 C ATOM 1128 CE1 TYR A 74 7.792 -18.371 3.511 1.00 0.00 C ATOM 1129 CE2 TYR A 74 6.665 -19.615 1.761 1.00 0.00 C ATOM 1130 CZ TYR A 74 7.658 -19.535 2.744 1.00 0.00 C ATOM 1131 OH TYR A 74 8.506 -20.603 2.957 1.00 0.00 O ATOM 0 H TYR A 74 4.316 -13.854 2.539 1.00 0.00 H new ATOM 0 HA TYR A 74 6.850 -15.082 1.908 1.00 0.00 H new ATOM 0 HB2 TYR A 74 4.486 -15.949 3.002 1.00 0.00 H new ATOM 0 HB3 TYR A 74 4.251 -16.462 1.343 1.00 0.00 H new ATOM 0 HD1 TYR A 74 7.035 -16.389 3.886 1.00 0.00 H new ATOM 0 HD2 TYR A 74 5.038 -18.595 0.786 1.00 0.00 H new ATOM 0 HE1 TYR A 74 8.558 -18.309 4.270 1.00 0.00 H new ATOM 0 HE2 TYR A 74 6.562 -20.513 1.170 1.00 0.00 H new ATOM 0 HH TYR A 74 8.277 -21.331 2.342 1.00 0.00 H new ATOM 1141 N HIS A 75 6.905 -14.522 -0.529 1.00 0.00 N ATOM 1142 CA HIS A 75 7.000 -14.421 -1.983 1.00 0.00 C ATOM 1143 C HIS A 75 8.456 -14.605 -2.429 1.00 0.00 C ATOM 1144 O HIS A 75 9.345 -13.903 -1.950 1.00 0.00 O ATOM 1145 CB HIS A 75 6.482 -13.050 -2.444 1.00 0.00 C ATOM 1146 CG HIS A 75 5.564 -13.218 -3.626 1.00 0.00 C ATOM 1147 ND1 HIS A 75 6.038 -13.509 -4.896 1.00 0.00 N ATOM 1148 CD2 HIS A 75 4.199 -13.137 -3.745 1.00 0.00 C ATOM 1149 CE1 HIS A 75 4.975 -13.590 -5.717 1.00 0.00 C ATOM 1150 NE2 HIS A 75 3.829 -13.372 -5.066 1.00 0.00 N ATOM 0 H HIS A 75 7.758 -14.271 -0.029 1.00 0.00 H new ATOM 0 HA HIS A 75 6.391 -15.204 -2.434 1.00 0.00 H new ATOM 0 HB2 HIS A 75 5.952 -12.559 -1.628 1.00 0.00 H new ATOM 0 HB3 HIS A 75 7.320 -12.407 -2.712 1.00 0.00 H new ATOM 0 HD2 HIS A 75 3.516 -12.923 -2.936 1.00 0.00 H new ATOM 0 HE1 HIS A 75 5.040 -13.805 -6.773 1.00 0.00 H new ATOM 0 HE2 HIS A 75 2.886 -13.377 -5.454 1.00 0.00 H new ATOM 1159 N PRO A 76 8.720 -15.530 -3.322 1.00 0.00 N ATOM 1160 CA PRO A 76 10.103 -15.794 -3.818 1.00 0.00 C ATOM 1161 C PRO A 76 10.883 -14.514 -4.127 1.00 0.00 C ATOM 1162 O PRO A 76 12.044 -14.378 -3.742 1.00 0.00 O ATOM 1163 CB PRO A 76 9.876 -16.609 -5.093 1.00 0.00 C ATOM 1164 CG PRO A 76 8.574 -17.311 -4.886 1.00 0.00 C ATOM 1165 CD PRO A 76 7.736 -16.426 -3.959 1.00 0.00 C ATOM 0 HA PRO A 76 10.706 -16.307 -3.068 1.00 0.00 H new ATOM 0 HB2 PRO A 76 9.840 -15.964 -5.971 1.00 0.00 H new ATOM 0 HB3 PRO A 76 10.685 -17.321 -5.254 1.00 0.00 H new ATOM 0 HG2 PRO A 76 8.064 -17.467 -5.836 1.00 0.00 H new ATOM 0 HG3 PRO A 76 8.731 -18.295 -4.443 1.00 0.00 H new ATOM 0 HD2 PRO A 76 6.988 -15.863 -4.516 1.00 0.00 H new ATOM 0 HD3 PRO A 76 7.201 -17.020 -3.218 1.00 0.00 H new ATOM 1173 N ASN A 77 10.245 -13.591 -4.839 1.00 0.00 N ATOM 1174 CA ASN A 77 10.898 -12.339 -5.212 1.00 0.00 C ATOM 1175 C ASN A 77 11.050 -11.404 -4.013 1.00 0.00 C ATOM 1176 O ASN A 77 11.705 -10.366 -4.112 1.00 0.00 O ATOM 1177 CB ASN A 77 10.092 -11.642 -6.310 1.00 0.00 C ATOM 1178 CG ASN A 77 8.603 -11.721 -5.995 1.00 0.00 C ATOM 1179 OD1 ASN A 77 8.199 -11.581 -4.763 1.00 0.00 O flip ATOM 1180 ND2 ASN A 77 7.786 -11.916 -6.895 1.00 0.00 N flip ATOM 0 H ASN A 77 9.284 -13.684 -5.168 1.00 0.00 H new ATOM 0 HA ASN A 77 11.896 -12.579 -5.580 1.00 0.00 H new ATOM 0 HB2 ASN A 77 10.400 -10.600 -6.392 1.00 0.00 H new ATOM 0 HB3 ASN A 77 10.293 -12.111 -7.273 1.00 0.00 H new ATOM 0 HD21 ASN A 77 8.104 -12.025 -7.858 1.00 0.00 H new ATOM 0 HD22 ASN A 77 6.791 -11.968 -6.678 1.00 0.00 H new ATOM 1187 N ILE A 78 10.446 -11.768 -2.884 1.00 0.00 N ATOM 1188 CA ILE A 78 10.531 -10.938 -1.681 1.00 0.00 C ATOM 1189 C ILE A 78 10.968 -11.767 -0.477 1.00 0.00 C ATOM 1190 O ILE A 78 10.362 -12.790 -0.160 1.00 0.00 O ATOM 1191 CB ILE A 78 9.174 -10.293 -1.389 1.00 0.00 C ATOM 1192 CG1 ILE A 78 8.785 -9.362 -2.547 1.00 0.00 C ATOM 1193 CG2 ILE A 78 9.265 -9.485 -0.093 1.00 0.00 C ATOM 1194 CD1 ILE A 78 7.261 -9.245 -2.623 1.00 0.00 C ATOM 0 H ILE A 78 9.898 -12.621 -2.775 1.00 0.00 H new ATOM 0 HA ILE A 78 11.274 -10.161 -1.860 1.00 0.00 H new ATOM 0 HB ILE A 78 8.418 -11.071 -1.282 1.00 0.00 H new ATOM 0 HG12 ILE A 78 9.228 -8.377 -2.400 1.00 0.00 H new ATOM 0 HG13 ILE A 78 9.177 -9.751 -3.487 1.00 0.00 H new ATOM 0 HG21 ILE A 78 8.300 -9.025 0.117 1.00 0.00 H new ATOM 0 HG22 ILE A 78 9.539 -10.146 0.729 1.00 0.00 H new ATOM 0 HG23 ILE A 78 10.022 -8.708 -0.201 1.00 0.00 H new ATOM 0 HD11 ILE A 78 6.987 -8.584 -3.445 1.00 0.00 H new ATOM 0 HD12 ILE A 78 6.828 -10.231 -2.791 1.00 0.00 H new ATOM 0 HD13 ILE A 78 6.880 -8.836 -1.687 1.00 0.00 H new ATOM 1206 N ASN A 79 12.023 -11.313 0.193 1.00 0.00 N ATOM 1207 CA ASN A 79 12.537 -12.013 1.366 1.00 0.00 C ATOM 1208 C ASN A 79 11.875 -11.489 2.636 1.00 0.00 C ATOM 1209 O ASN A 79 11.233 -10.438 2.626 1.00 0.00 O ATOM 1210 CB ASN A 79 14.052 -11.819 1.464 1.00 0.00 C ATOM 1211 CG ASN A 79 14.639 -12.797 2.476 1.00 0.00 C ATOM 1212 OD1 ASN A 79 14.215 -14.031 2.499 1.00 0.00 O flip ATOM 1213 ND2 ASN A 79 15.508 -12.427 3.267 1.00 0.00 N flip ATOM 0 H ASN A 79 12.537 -10.467 -0.055 1.00 0.00 H new ATOM 0 HA ASN A 79 12.310 -13.074 1.262 1.00 0.00 H new ATOM 0 HB2 ASN A 79 14.511 -11.974 0.488 1.00 0.00 H new ATOM 0 HB3 ASN A 79 14.277 -10.795 1.763 1.00 0.00 H new ATOM 0 HD21 ASN A 79 15.838 -11.462 3.247 1.00 0.00 H new ATOM 0 HD22 ASN A 79 15.897 -13.086 3.942 1.00 0.00 H new ATOM 1220 N SER A 80 12.037 -12.227 3.730 1.00 0.00 N ATOM 1221 CA SER A 80 11.452 -11.826 5.004 1.00 0.00 C ATOM 1222 C SER A 80 12.226 -10.655 5.601 1.00 0.00 C ATOM 1223 O SER A 80 11.699 -9.902 6.421 1.00 0.00 O ATOM 1224 CB SER A 80 11.470 -13.002 5.981 1.00 0.00 C ATOM 1225 OG SER A 80 12.751 -13.618 5.950 1.00 0.00 O ATOM 0 H SER A 80 12.565 -13.099 3.760 1.00 0.00 H new ATOM 0 HA SER A 80 10.422 -11.517 4.829 1.00 0.00 H new ATOM 0 HB2 SER A 80 11.245 -12.655 6.990 1.00 0.00 H new ATOM 0 HB3 SER A 80 10.699 -13.725 5.713 1.00 0.00 H new ATOM 0 HG SER A 80 12.767 -14.371 6.576 1.00 0.00 H new ATOM 1231 N ASN A 81 13.479 -10.508 5.184 1.00 0.00 N ATOM 1232 CA ASN A 81 14.318 -9.425 5.683 1.00 0.00 C ATOM 1233 C ASN A 81 13.877 -8.090 5.090 1.00 0.00 C ATOM 1234 O ASN A 81 14.330 -7.029 5.519 1.00 0.00 O ATOM 1235 CB ASN A 81 15.782 -9.689 5.322 1.00 0.00 C ATOM 1236 CG ASN A 81 16.694 -8.798 6.158 1.00 0.00 C ATOM 1237 OD1 ASN A 81 17.377 -7.927 5.619 1.00 0.00 O ATOM 1238 ND2 ASN A 81 16.746 -8.964 7.452 1.00 0.00 N ATOM 0 H ASN A 81 13.933 -11.120 4.507 1.00 0.00 H new ATOM 0 HA ASN A 81 14.215 -9.380 6.767 1.00 0.00 H new ATOM 0 HB2 ASN A 81 16.025 -10.737 5.496 1.00 0.00 H new ATOM 0 HB3 ASN A 81 15.944 -9.496 4.261 1.00 0.00 H new ATOM 0 HD21 ASN A 81 17.353 -8.371 8.018 1.00 0.00 H new ATOM 0 HD22 ASN A 81 16.179 -9.686 7.897 1.00 0.00 H new ATOM 1245 N GLY A 82 12.990 -8.153 4.101 1.00 0.00 N ATOM 1246 CA GLY A 82 12.489 -6.945 3.452 1.00 0.00 C ATOM 1247 C GLY A 82 13.239 -6.671 2.154 1.00 0.00 C ATOM 1248 O GLY A 82 13.289 -5.535 1.682 1.00 0.00 O ATOM 0 H GLY A 82 12.605 -9.023 3.733 1.00 0.00 H new ATOM 0 HA2 GLY A 82 11.424 -7.054 3.245 1.00 0.00 H new ATOM 0 HA3 GLY A 82 12.597 -6.095 4.125 1.00 0.00 H new ATOM 1252 N SER A 83 13.821 -7.720 1.579 1.00 0.00 N ATOM 1253 CA SER A 83 14.566 -7.582 0.332 1.00 0.00 C ATOM 1254 C SER A 83 13.628 -7.692 -0.866 1.00 0.00 C ATOM 1255 O SER A 83 12.747 -8.552 -0.900 1.00 0.00 O ATOM 1256 CB SER A 83 15.638 -8.669 0.242 1.00 0.00 C ATOM 1257 OG SER A 83 16.289 -8.791 1.500 1.00 0.00 O ATOM 0 H SER A 83 13.792 -8.668 1.954 1.00 0.00 H new ATOM 0 HA SER A 83 15.041 -6.601 0.320 1.00 0.00 H new ATOM 0 HB2 SER A 83 15.186 -9.620 -0.040 1.00 0.00 H new ATOM 0 HB3 SER A 83 16.363 -8.418 -0.533 1.00 0.00 H new ATOM 0 HG SER A 83 16.976 -9.488 1.447 1.00 0.00 H new ATOM 1263 N ILE A 84 13.821 -6.815 -1.848 1.00 0.00 N ATOM 1264 CA ILE A 84 12.986 -6.821 -3.045 1.00 0.00 C ATOM 1265 C ILE A 84 13.838 -6.621 -4.294 1.00 0.00 C ATOM 1266 O ILE A 84 14.640 -5.689 -4.367 1.00 0.00 O ATOM 1267 CB ILE A 84 11.939 -5.710 -2.957 1.00 0.00 C ATOM 1268 CG1 ILE A 84 11.270 -5.749 -1.580 1.00 0.00 C ATOM 1269 CG2 ILE A 84 10.881 -5.920 -4.042 1.00 0.00 C ATOM 1270 CD1 ILE A 84 10.172 -4.686 -1.514 1.00 0.00 C ATOM 0 H ILE A 84 14.544 -6.095 -1.839 1.00 0.00 H new ATOM 0 HA ILE A 84 12.486 -7.787 -3.111 1.00 0.00 H new ATOM 0 HB ILE A 84 12.421 -4.743 -3.101 1.00 0.00 H new ATOM 0 HG12 ILE A 84 10.846 -6.736 -1.398 1.00 0.00 H new ATOM 0 HG13 ILE A 84 12.010 -5.571 -0.800 1.00 0.00 H new ATOM 0 HG21 ILE A 84 10.134 -5.128 -3.980 1.00 0.00 H new ATOM 0 HG22 ILE A 84 11.356 -5.895 -5.023 1.00 0.00 H new ATOM 0 HG23 ILE A 84 10.398 -6.886 -3.897 1.00 0.00 H new ATOM 0 HD11 ILE A 84 9.696 -4.715 -0.534 1.00 0.00 H new ATOM 0 HD12 ILE A 84 10.609 -3.701 -1.677 1.00 0.00 H new ATOM 0 HD13 ILE A 84 9.427 -4.884 -2.285 1.00 0.00 H new ATOM 1282 N CYS A 85 13.660 -7.502 -5.274 1.00 0.00 N ATOM 1283 CA CYS A 85 14.418 -7.418 -6.520 1.00 0.00 C ATOM 1284 C CYS A 85 13.546 -6.867 -7.644 1.00 0.00 C ATOM 1285 O CYS A 85 12.591 -7.514 -8.075 1.00 0.00 O ATOM 1286 CB CYS A 85 14.935 -8.804 -6.908 1.00 0.00 C ATOM 1287 SG CYS A 85 13.586 -10.005 -6.793 1.00 0.00 S ATOM 0 H CYS A 85 13.001 -8.279 -5.231 1.00 0.00 H new ATOM 0 HA CYS A 85 15.260 -6.743 -6.366 1.00 0.00 H new ATOM 0 HB2 CYS A 85 15.333 -8.784 -7.922 1.00 0.00 H new ATOM 0 HB3 CYS A 85 15.753 -9.096 -6.250 1.00 0.00 H new ATOM 0 HG CYS A 85 12.503 -9.491 -7.297 1.00 0.00 H new ATOM 1293 N LEU A 86 13.881 -5.669 -8.117 1.00 0.00 N ATOM 1294 CA LEU A 86 13.123 -5.038 -9.195 1.00 0.00 C ATOM 1295 C LEU A 86 14.068 -4.421 -10.222 1.00 0.00 C ATOM 1296 O LEU A 86 15.179 -4.010 -9.889 1.00 0.00 O ATOM 1297 CB LEU A 86 12.205 -3.952 -8.625 1.00 0.00 C ATOM 1298 CG LEU A 86 11.041 -4.601 -7.864 1.00 0.00 C ATOM 1299 CD1 LEU A 86 10.409 -3.570 -6.926 1.00 0.00 C ATOM 1300 CD2 LEU A 86 9.981 -5.101 -8.855 1.00 0.00 C ATOM 0 H LEU A 86 14.668 -5.118 -7.773 1.00 0.00 H new ATOM 0 HA LEU A 86 12.519 -5.802 -9.685 1.00 0.00 H new ATOM 0 HB2 LEU A 86 12.769 -3.300 -7.958 1.00 0.00 H new ATOM 0 HB3 LEU A 86 11.821 -3.328 -9.432 1.00 0.00 H new ATOM 0 HG LEU A 86 11.419 -5.444 -7.286 1.00 0.00 H new ATOM 0 HD11 LEU A 86 9.582 -4.029 -6.385 1.00 0.00 H new ATOM 0 HD12 LEU A 86 11.157 -3.218 -6.215 1.00 0.00 H new ATOM 0 HD13 LEU A 86 10.037 -2.727 -7.509 1.00 0.00 H new ATOM 0 HD21 LEU A 86 9.158 -5.560 -8.307 1.00 0.00 H new ATOM 0 HD22 LEU A 86 9.604 -4.261 -9.439 1.00 0.00 H new ATOM 0 HD23 LEU A 86 10.427 -5.837 -9.524 1.00 0.00 H new ATOM 1312 N ASP A 87 13.620 -4.366 -11.473 1.00 0.00 N ATOM 1313 CA ASP A 87 14.437 -3.803 -12.544 1.00 0.00 C ATOM 1314 C ASP A 87 14.599 -2.296 -12.373 1.00 0.00 C ATOM 1315 O ASP A 87 15.716 -1.778 -12.386 1.00 0.00 O ATOM 1316 CB ASP A 87 13.792 -4.097 -13.899 1.00 0.00 C ATOM 1317 CG ASP A 87 14.788 -3.823 -15.021 1.00 0.00 C ATOM 1318 OD1 ASP A 87 15.951 -3.619 -14.717 1.00 0.00 O ATOM 1319 OD2 ASP A 87 14.372 -3.822 -16.168 1.00 0.00 O ATOM 0 H ASP A 87 12.703 -4.701 -11.769 1.00 0.00 H new ATOM 0 HA ASP A 87 15.423 -4.265 -12.498 1.00 0.00 H new ATOM 0 HB2 ASP A 87 13.465 -5.136 -13.938 1.00 0.00 H new ATOM 0 HB3 ASP A 87 12.904 -3.478 -14.030 1.00 0.00 H new ATOM 1324 N ILE A 88 13.480 -1.596 -12.220 1.00 0.00 N ATOM 1325 CA ILE A 88 13.515 -0.147 -12.054 1.00 0.00 C ATOM 1326 C ILE A 88 14.453 0.244 -10.917 1.00 0.00 C ATOM 1327 O ILE A 88 14.790 1.417 -10.755 1.00 0.00 O ATOM 1328 CB ILE A 88 12.107 0.391 -11.775 1.00 0.00 C ATOM 1329 CG1 ILE A 88 11.441 -0.426 -10.657 1.00 0.00 C ATOM 1330 CG2 ILE A 88 11.264 0.282 -13.047 1.00 0.00 C ATOM 1331 CD1 ILE A 88 12.057 -0.076 -9.295 1.00 0.00 C ATOM 0 H ILE A 88 12.545 -2.004 -12.207 1.00 0.00 H new ATOM 0 HA ILE A 88 13.887 0.292 -12.980 1.00 0.00 H new ATOM 0 HB ILE A 88 12.179 1.433 -11.463 1.00 0.00 H new ATOM 0 HG12 ILE A 88 10.370 -0.225 -10.641 1.00 0.00 H new ATOM 0 HG13 ILE A 88 11.563 -1.491 -10.855 1.00 0.00 H new ATOM 0 HG21 ILE A 88 10.262 0.664 -12.853 1.00 0.00 H new ATOM 0 HG22 ILE A 88 11.727 0.867 -13.842 1.00 0.00 H new ATOM 0 HG23 ILE A 88 11.202 -0.762 -13.354 1.00 0.00 H new ATOM 0 HD11 ILE A 88 11.573 -0.664 -8.515 1.00 0.00 H new ATOM 0 HD12 ILE A 88 13.124 -0.300 -9.310 1.00 0.00 H new ATOM 0 HD13 ILE A 88 11.912 0.985 -9.092 1.00 0.00 H new ATOM 1343 N LEU A 89 14.869 -0.743 -10.131 1.00 0.00 N ATOM 1344 CA LEU A 89 15.767 -0.487 -9.010 1.00 0.00 C ATOM 1345 C LEU A 89 17.204 -0.331 -9.502 1.00 0.00 C ATOM 1346 O LEU A 89 17.966 0.483 -8.978 1.00 0.00 O ATOM 1347 CB LEU A 89 15.683 -1.646 -8.003 1.00 0.00 C ATOM 1348 CG LEU A 89 15.606 -1.101 -6.569 1.00 0.00 C ATOM 1349 CD1 LEU A 89 14.163 -0.705 -6.244 1.00 0.00 C ATOM 1350 CD2 LEU A 89 16.065 -2.183 -5.588 1.00 0.00 C ATOM 0 H LEU A 89 14.602 -1.720 -10.247 1.00 0.00 H new ATOM 0 HA LEU A 89 15.463 0.439 -8.522 1.00 0.00 H new ATOM 0 HB2 LEU A 89 14.806 -2.258 -8.214 1.00 0.00 H new ATOM 0 HB3 LEU A 89 16.555 -2.292 -8.108 1.00 0.00 H new ATOM 0 HG LEU A 89 16.251 -0.227 -6.481 1.00 0.00 H new ATOM 0 HD11 LEU A 89 14.112 -0.319 -5.226 1.00 0.00 H new ATOM 0 HD12 LEU A 89 13.831 0.065 -6.941 1.00 0.00 H new ATOM 0 HD13 LEU A 89 13.517 -1.578 -6.333 1.00 0.00 H new ATOM 0 HD21 LEU A 89 16.011 -1.798 -4.570 1.00 0.00 H new ATOM 0 HD22 LEU A 89 15.419 -3.056 -5.680 1.00 0.00 H new ATOM 0 HD23 LEU A 89 17.093 -2.467 -5.814 1.00 0.00 H new ATOM 1362 N ARG A 90 17.568 -1.118 -10.509 1.00 0.00 N ATOM 1363 CA ARG A 90 18.916 -1.063 -11.063 1.00 0.00 C ATOM 1364 C ARG A 90 19.111 0.205 -11.888 1.00 0.00 C ATOM 1365 O ARG A 90 18.321 1.145 -11.798 1.00 0.00 O ATOM 1366 CB ARG A 90 19.169 -2.290 -11.942 1.00 0.00 C ATOM 1367 CG ARG A 90 19.087 -3.555 -11.085 1.00 0.00 C ATOM 1368 CD ARG A 90 19.611 -4.749 -11.885 1.00 0.00 C ATOM 1369 NE ARG A 90 18.710 -5.050 -12.991 1.00 0.00 N ATOM 1370 CZ ARG A 90 19.110 -5.787 -14.022 1.00 0.00 C ATOM 1371 NH1 ARG A 90 20.328 -6.254 -14.057 1.00 0.00 N ATOM 1372 NH2 ARG A 90 18.285 -6.044 -15.000 1.00 0.00 N ATOM 0 H ARG A 90 16.953 -1.798 -10.956 1.00 0.00 H new ATOM 0 HA ARG A 90 19.626 -1.054 -10.236 1.00 0.00 H new ATOM 0 HB2 ARG A 90 18.434 -2.333 -12.745 1.00 0.00 H new ATOM 0 HB3 ARG A 90 20.150 -2.219 -12.412 1.00 0.00 H new ATOM 0 HG2 ARG A 90 19.673 -3.429 -10.175 1.00 0.00 H new ATOM 0 HG3 ARG A 90 18.056 -3.733 -10.779 1.00 0.00 H new ATOM 0 HD2 ARG A 90 20.608 -4.530 -12.268 1.00 0.00 H new ATOM 0 HD3 ARG A 90 19.703 -5.619 -11.235 1.00 0.00 H new ATOM 0 HE ARG A 90 17.756 -4.689 -12.973 1.00 0.00 H new ATOM 0 HH11 ARG A 90 20.973 -6.053 -13.293 1.00 0.00 H new ATOM 0 HH12 ARG A 90 20.635 -6.820 -14.848 1.00 0.00 H new ATOM 0 HH21 ARG A 90 17.333 -5.679 -14.973 1.00 0.00 H new ATOM 0 HH22 ARG A 90 18.592 -6.610 -15.791 1.00 0.00 H new ATOM 1386 N SER A 91 20.171 0.224 -12.690 1.00 0.00 N ATOM 1387 CA SER A 91 20.468 1.382 -13.528 1.00 0.00 C ATOM 1388 C SER A 91 19.194 1.935 -14.159 1.00 0.00 C ATOM 1389 O SER A 91 19.105 3.126 -14.458 1.00 0.00 O ATOM 1390 CB SER A 91 21.455 0.990 -14.627 1.00 0.00 C ATOM 1391 OG SER A 91 22.731 0.750 -14.047 1.00 0.00 O ATOM 0 H SER A 91 20.836 -0.545 -12.778 1.00 0.00 H new ATOM 0 HA SER A 91 20.910 2.155 -12.899 1.00 0.00 H new ATOM 0 HB2 SER A 91 21.104 0.098 -15.145 1.00 0.00 H new ATOM 0 HB3 SER A 91 21.524 1.784 -15.370 1.00 0.00 H new ATOM 0 HG SER A 91 23.367 0.497 -14.748 1.00 0.00 H new ATOM 1397 N GLN A 92 18.210 1.065 -14.360 1.00 0.00 N ATOM 1398 CA GLN A 92 16.946 1.482 -14.956 1.00 0.00 C ATOM 1399 C GLN A 92 16.299 2.582 -14.122 1.00 0.00 C ATOM 1400 O GLN A 92 15.259 3.126 -14.493 1.00 0.00 O ATOM 1401 CB GLN A 92 15.995 0.288 -15.056 1.00 0.00 C ATOM 1402 CG GLN A 92 16.556 -0.731 -16.049 1.00 0.00 C ATOM 1403 CD GLN A 92 16.493 -0.168 -17.465 1.00 0.00 C ATOM 1404 OE1 GLN A 92 15.886 0.878 -17.691 1.00 0.00 O ATOM 1405 NE2 GLN A 92 17.087 -0.804 -18.436 1.00 0.00 N ATOM 0 H GLN A 92 18.262 0.075 -14.121 1.00 0.00 H new ATOM 0 HA GLN A 92 17.147 1.869 -15.955 1.00 0.00 H new ATOM 0 HB2 GLN A 92 15.870 -0.174 -14.077 1.00 0.00 H new ATOM 0 HB3 GLN A 92 15.009 0.621 -15.379 1.00 0.00 H new ATOM 0 HG2 GLN A 92 17.587 -0.973 -15.791 1.00 0.00 H new ATOM 0 HG3 GLN A 92 15.986 -1.659 -15.992 1.00 0.00 H new ATOM 0 HE21 GLN A 92 17.590 -1.671 -18.246 1.00 0.00 H new ATOM 0 HE22 GLN A 92 17.049 -0.435 -19.386 1.00 0.00 H new ATOM 1414 N TRP A 93 16.922 2.905 -12.994 1.00 0.00 N ATOM 1415 CA TRP A 93 16.400 3.942 -12.112 1.00 0.00 C ATOM 1416 C TRP A 93 16.622 5.323 -12.721 1.00 0.00 C ATOM 1417 O TRP A 93 17.732 5.855 -12.688 1.00 0.00 O ATOM 1418 CB TRP A 93 17.093 3.865 -10.750 1.00 0.00 C ATOM 1419 CG TRP A 93 16.559 4.938 -9.857 1.00 0.00 C ATOM 1420 CD1 TRP A 93 17.005 6.214 -9.824 1.00 0.00 C ATOM 1421 CD2 TRP A 93 15.490 4.852 -8.870 1.00 0.00 C ATOM 1422 NE1 TRP A 93 16.276 6.918 -8.883 1.00 0.00 N ATOM 1423 CE2 TRP A 93 15.330 6.122 -8.268 1.00 0.00 C ATOM 1424 CE3 TRP A 93 14.652 3.806 -8.445 1.00 0.00 C ATOM 1425 CZ2 TRP A 93 14.372 6.347 -7.278 1.00 0.00 C ATOM 1426 CZ3 TRP A 93 13.687 4.028 -7.449 1.00 0.00 C ATOM 1427 CH2 TRP A 93 13.547 5.296 -6.867 1.00 0.00 C ATOM 0 H TRP A 93 17.784 2.467 -12.670 1.00 0.00 H new ATOM 0 HA TRP A 93 15.330 3.781 -11.984 1.00 0.00 H new ATOM 0 HB2 TRP A 93 16.926 2.886 -10.300 1.00 0.00 H new ATOM 0 HB3 TRP A 93 18.170 3.981 -10.871 1.00 0.00 H new ATOM 0 HD1 TRP A 93 17.800 6.617 -10.433 1.00 0.00 H new ATOM 0 HE1 TRP A 93 16.420 7.905 -8.669 1.00 0.00 H new ATOM 0 HE3 TRP A 93 14.751 2.826 -8.887 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 14.269 7.326 -6.833 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 13.049 3.217 -7.129 1.00 0.00 H new ATOM 0 HH2 TRP A 93 12.803 5.460 -6.102 1.00 0.00 H new ATOM 1438 N SER A 94 15.559 5.901 -13.275 1.00 0.00 N ATOM 1439 CA SER A 94 15.652 7.222 -13.887 1.00 0.00 C ATOM 1440 C SER A 94 15.445 8.317 -12.837 1.00 0.00 C ATOM 1441 O SER A 94 14.382 8.393 -12.220 1.00 0.00 O ATOM 1442 CB SER A 94 14.596 7.369 -14.979 1.00 0.00 C ATOM 1443 OG SER A 94 14.524 6.164 -15.730 1.00 0.00 O ATOM 0 H SER A 94 14.631 5.479 -13.312 1.00 0.00 H new ATOM 0 HA SER A 94 16.646 7.327 -14.322 1.00 0.00 H new ATOM 0 HB2 SER A 94 13.626 7.592 -14.535 1.00 0.00 H new ATOM 0 HB3 SER A 94 14.847 8.204 -15.633 1.00 0.00 H new ATOM 0 HG SER A 94 13.845 6.255 -16.431 1.00 0.00 H new ATOM 1449 N PRO A 95 16.423 9.163 -12.624 1.00 0.00 N ATOM 1450 CA PRO A 95 16.320 10.268 -11.626 1.00 0.00 C ATOM 1451 C PRO A 95 15.033 11.076 -11.786 1.00 0.00 C ATOM 1452 O PRO A 95 14.729 11.940 -10.963 1.00 0.00 O ATOM 1453 CB PRO A 95 17.545 11.143 -11.916 1.00 0.00 C ATOM 1454 CG PRO A 95 18.534 10.242 -12.579 1.00 0.00 C ATOM 1455 CD PRO A 95 17.730 9.160 -13.303 1.00 0.00 C ATOM 0 HA PRO A 95 16.293 9.887 -10.605 1.00 0.00 H new ATOM 0 HB2 PRO A 95 17.284 11.981 -12.562 1.00 0.00 H new ATOM 0 HB3 PRO A 95 17.953 11.564 -10.997 1.00 0.00 H new ATOM 0 HG2 PRO A 95 19.154 10.799 -13.282 1.00 0.00 H new ATOM 0 HG3 PRO A 95 19.206 9.798 -11.844 1.00 0.00 H new ATOM 0 HD2 PRO A 95 17.627 9.384 -14.365 1.00 0.00 H new ATOM 0 HD3 PRO A 95 18.215 8.187 -13.228 1.00 0.00 H new ATOM 1463 N ALA A 96 14.287 10.800 -12.854 1.00 0.00 N ATOM 1464 CA ALA A 96 13.042 11.521 -13.117 1.00 0.00 C ATOM 1465 C ALA A 96 11.833 10.593 -13.026 1.00 0.00 C ATOM 1466 O ALA A 96 10.819 10.822 -13.686 1.00 0.00 O ATOM 1467 CB ALA A 96 13.093 12.151 -14.509 1.00 0.00 C ATOM 0 H ALA A 96 14.520 10.088 -13.547 1.00 0.00 H new ATOM 0 HA ALA A 96 12.937 12.298 -12.360 1.00 0.00 H new ATOM 0 HB1 ALA A 96 12.163 12.687 -14.700 1.00 0.00 H new ATOM 0 HB2 ALA A 96 13.930 12.847 -14.563 1.00 0.00 H new ATOM 0 HB3 ALA A 96 13.222 11.369 -15.258 1.00 0.00 H new ATOM 1473 N LEU A 97 11.939 9.552 -12.205 1.00 0.00 N ATOM 1474 CA LEU A 97 10.836 8.607 -12.039 1.00 0.00 C ATOM 1475 C LEU A 97 10.124 8.852 -10.713 1.00 0.00 C ATOM 1476 O LEU A 97 10.726 9.340 -9.757 1.00 0.00 O ATOM 1477 CB LEU A 97 11.359 7.167 -12.095 1.00 0.00 C ATOM 1478 CG LEU A 97 12.152 6.841 -10.818 1.00 0.00 C ATOM 1479 CD1 LEU A 97 11.196 6.450 -9.674 1.00 0.00 C ATOM 1480 CD2 LEU A 97 13.118 5.680 -11.103 1.00 0.00 C ATOM 0 H LEU A 97 12.768 9.341 -11.649 1.00 0.00 H new ATOM 0 HA LEU A 97 10.126 8.756 -12.852 1.00 0.00 H new ATOM 0 HB2 LEU A 97 10.525 6.473 -12.201 1.00 0.00 H new ATOM 0 HB3 LEU A 97 11.995 7.037 -12.970 1.00 0.00 H new ATOM 0 HG LEU A 97 12.714 7.724 -10.515 1.00 0.00 H new ATOM 0 HD11 LEU A 97 11.774 6.223 -8.778 1.00 0.00 H new ATOM 0 HD12 LEU A 97 10.518 7.278 -9.468 1.00 0.00 H new ATOM 0 HD13 LEU A 97 10.619 5.572 -9.966 1.00 0.00 H new ATOM 0 HD21 LEU A 97 13.682 5.446 -10.200 1.00 0.00 H new ATOM 0 HD22 LEU A 97 12.551 4.803 -11.414 1.00 0.00 H new ATOM 0 HD23 LEU A 97 13.807 5.967 -11.897 1.00 0.00 H new ATOM 1492 N THR A 98 8.837 8.518 -10.663 1.00 0.00 N ATOM 1493 CA THR A 98 8.052 8.713 -9.447 1.00 0.00 C ATOM 1494 C THR A 98 7.871 7.397 -8.700 1.00 0.00 C ATOM 1495 O THR A 98 7.972 6.318 -9.284 1.00 0.00 O ATOM 1496 CB THR A 98 6.683 9.299 -9.797 1.00 0.00 C ATOM 1497 OG1 THR A 98 5.927 9.473 -8.607 1.00 0.00 O ATOM 1498 CG2 THR A 98 5.946 8.348 -10.738 1.00 0.00 C ATOM 0 H THR A 98 8.319 8.114 -11.443 1.00 0.00 H new ATOM 0 HA THR A 98 8.590 9.407 -8.801 1.00 0.00 H new ATOM 0 HB THR A 98 6.814 10.263 -10.289 1.00 0.00 H new ATOM 0 HG1 THR A 98 5.050 9.850 -8.829 1.00 0.00 H new ATOM 0 HG21 THR A 98 4.971 8.766 -10.987 1.00 0.00 H new ATOM 0 HG22 THR A 98 6.528 8.215 -11.650 1.00 0.00 H new ATOM 0 HG23 THR A 98 5.813 7.383 -10.249 1.00 0.00 H new ATOM 1506 N ILE A 99 7.605 7.498 -7.402 1.00 0.00 N ATOM 1507 CA ILE A 99 7.412 6.316 -6.570 1.00 0.00 C ATOM 1508 C ILE A 99 6.095 5.623 -6.913 1.00 0.00 C ATOM 1509 O ILE A 99 5.918 4.436 -6.644 1.00 0.00 O ATOM 1510 CB ILE A 99 7.412 6.723 -5.091 1.00 0.00 C ATOM 1511 CG1 ILE A 99 7.608 5.479 -4.208 1.00 0.00 C ATOM 1512 CG2 ILE A 99 6.079 7.395 -4.743 1.00 0.00 C ATOM 1513 CD1 ILE A 99 9.092 5.311 -3.874 1.00 0.00 C ATOM 0 H ILE A 99 7.518 8.384 -6.904 1.00 0.00 H new ATOM 0 HA ILE A 99 8.229 5.620 -6.759 1.00 0.00 H new ATOM 0 HB ILE A 99 8.229 7.422 -4.912 1.00 0.00 H new ATOM 0 HG12 ILE A 99 7.028 5.578 -3.290 1.00 0.00 H new ATOM 0 HG13 ILE A 99 7.239 4.593 -4.725 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.080 7.684 -3.692 1.00 0.00 H new ATOM 0 HG22 ILE A 99 5.946 8.282 -5.363 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.261 6.698 -4.927 1.00 0.00 H new ATOM 0 HD11 ILE A 99 9.227 4.429 -3.248 1.00 0.00 H new ATOM 0 HD12 ILE A 99 9.661 5.192 -4.796 1.00 0.00 H new ATOM 0 HD13 ILE A 99 9.447 6.192 -3.339 1.00 0.00 H new ATOM 1525 N SER A 100 5.172 6.376 -7.501 1.00 0.00 N ATOM 1526 CA SER A 100 3.870 5.829 -7.867 1.00 0.00 C ATOM 1527 C SER A 100 4.018 4.565 -8.711 1.00 0.00 C ATOM 1528 O SER A 100 3.392 3.545 -8.426 1.00 0.00 O ATOM 1529 CB SER A 100 3.068 6.872 -8.645 1.00 0.00 C ATOM 1530 OG SER A 100 3.003 8.074 -7.890 1.00 0.00 O ATOM 0 H SER A 100 5.299 7.361 -7.733 1.00 0.00 H new ATOM 0 HA SER A 100 3.344 5.569 -6.949 1.00 0.00 H new ATOM 0 HB2 SER A 100 3.536 7.061 -9.611 1.00 0.00 H new ATOM 0 HB3 SER A 100 2.063 6.500 -8.845 1.00 0.00 H new ATOM 0 HG SER A 100 2.491 8.745 -8.387 1.00 0.00 H new ATOM 1536 N LYS A 101 4.838 4.639 -9.756 1.00 0.00 N ATOM 1537 CA LYS A 101 5.040 3.490 -10.634 1.00 0.00 C ATOM 1538 C LYS A 101 5.686 2.329 -9.878 1.00 0.00 C ATOM 1539 O LYS A 101 5.368 1.166 -10.125 1.00 0.00 O ATOM 1540 CB LYS A 101 5.910 3.891 -11.836 1.00 0.00 C ATOM 1541 CG LYS A 101 7.397 3.748 -11.493 1.00 0.00 C ATOM 1542 CD LYS A 101 8.244 4.444 -12.568 1.00 0.00 C ATOM 1543 CE LYS A 101 9.593 3.733 -12.710 1.00 0.00 C ATOM 1544 NZ LYS A 101 9.442 2.563 -13.619 1.00 0.00 N ATOM 0 H LYS A 101 5.368 5.472 -10.014 1.00 0.00 H new ATOM 0 HA LYS A 101 4.066 3.160 -10.994 1.00 0.00 H new ATOM 0 HB2 LYS A 101 5.667 3.264 -12.694 1.00 0.00 H new ATOM 0 HB3 LYS A 101 5.694 4.920 -12.122 1.00 0.00 H new ATOM 0 HG2 LYS A 101 7.599 4.187 -10.516 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.666 2.694 -11.430 1.00 0.00 H new ATOM 0 HD2 LYS A 101 7.716 4.435 -13.522 1.00 0.00 H new ATOM 0 HD3 LYS A 101 8.400 5.489 -12.300 1.00 0.00 H new ATOM 0 HE2 LYS A 101 10.339 4.421 -13.106 1.00 0.00 H new ATOM 0 HE3 LYS A 101 9.948 3.405 -11.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 10.367 2.318 -14.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 9.074 1.752 -13.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 8.779 2.801 -14.384 1.00 0.00 H new ATOM 1558 N VAL A 102 6.592 2.651 -8.962 1.00 0.00 N ATOM 1559 CA VAL A 102 7.273 1.621 -8.184 1.00 0.00 C ATOM 1560 C VAL A 102 6.261 0.688 -7.523 1.00 0.00 C ATOM 1561 O VAL A 102 6.515 -0.506 -7.368 1.00 0.00 O ATOM 1562 CB VAL A 102 8.153 2.266 -7.112 1.00 0.00 C ATOM 1563 CG1 VAL A 102 8.964 1.183 -6.398 1.00 0.00 C ATOM 1564 CG2 VAL A 102 9.107 3.264 -7.771 1.00 0.00 C ATOM 0 H VAL A 102 6.871 3.607 -8.741 1.00 0.00 H new ATOM 0 HA VAL A 102 7.898 1.039 -8.861 1.00 0.00 H new ATOM 0 HB VAL A 102 7.524 2.785 -6.389 1.00 0.00 H new ATOM 0 HG11 VAL A 102 9.591 1.642 -5.634 1.00 0.00 H new ATOM 0 HG12 VAL A 102 8.286 0.470 -5.930 1.00 0.00 H new ATOM 0 HG13 VAL A 102 9.594 0.664 -7.121 1.00 0.00 H new ATOM 0 HG21 VAL A 102 9.735 3.725 -7.009 1.00 0.00 H new ATOM 0 HG22 VAL A 102 9.736 2.744 -8.493 1.00 0.00 H new ATOM 0 HG23 VAL A 102 8.531 4.036 -8.281 1.00 0.00 H new ATOM 1574 N LEU A 103 5.115 1.239 -7.136 1.00 0.00 N ATOM 1575 CA LEU A 103 4.076 0.441 -6.494 1.00 0.00 C ATOM 1576 C LEU A 103 3.491 -0.569 -7.477 1.00 0.00 C ATOM 1577 O LEU A 103 3.311 -1.741 -7.145 1.00 0.00 O ATOM 1578 CB LEU A 103 2.961 1.350 -5.971 1.00 0.00 C ATOM 1579 CG LEU A 103 3.572 2.605 -5.344 1.00 0.00 C ATOM 1580 CD1 LEU A 103 2.477 3.407 -4.637 1.00 0.00 C ATOM 1581 CD2 LEU A 103 4.644 2.200 -4.328 1.00 0.00 C ATOM 0 H LEU A 103 4.883 2.225 -7.254 1.00 0.00 H new ATOM 0 HA LEU A 103 4.525 -0.097 -5.659 1.00 0.00 H new ATOM 0 HB2 LEU A 103 2.292 1.627 -6.786 1.00 0.00 H new ATOM 0 HB3 LEU A 103 2.361 0.818 -5.233 1.00 0.00 H new ATOM 0 HG LEU A 103 4.025 3.216 -6.125 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.912 4.301 -4.190 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.714 3.697 -5.360 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.024 2.795 -3.857 1.00 0.00 H new ATOM 0 HD21 LEU A 103 5.079 3.094 -3.882 1.00 0.00 H new ATOM 0 HD22 LEU A 103 4.193 1.588 -3.547 1.00 0.00 H new ATOM 0 HD23 LEU A 103 5.425 1.629 -4.831 1.00 0.00 H new ATOM 1593 N LEU A 104 3.197 -0.107 -8.689 1.00 0.00 N ATOM 1594 CA LEU A 104 2.633 -0.979 -9.713 1.00 0.00 C ATOM 1595 C LEU A 104 3.586 -2.131 -10.015 1.00 0.00 C ATOM 1596 O LEU A 104 3.156 -3.262 -10.240 1.00 0.00 O ATOM 1597 CB LEU A 104 2.367 -0.179 -10.994 1.00 0.00 C ATOM 1598 CG LEU A 104 1.067 0.625 -10.852 1.00 0.00 C ATOM 1599 CD1 LEU A 104 -0.143 -0.320 -10.847 1.00 0.00 C ATOM 1600 CD2 LEU A 104 1.100 1.422 -9.544 1.00 0.00 C ATOM 0 H LEU A 104 3.339 0.859 -8.984 1.00 0.00 H new ATOM 0 HA LEU A 104 1.693 -1.388 -9.342 1.00 0.00 H new ATOM 0 HB2 LEU A 104 3.201 0.495 -11.191 1.00 0.00 H new ATOM 0 HB3 LEU A 104 2.295 -0.855 -11.846 1.00 0.00 H new ATOM 0 HG LEU A 104 0.978 1.309 -11.696 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -1.059 0.262 -10.746 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -0.171 -0.881 -11.781 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -0.060 -1.014 -10.010 1.00 0.00 H new ATOM 0 HD21 LEU A 104 0.177 1.993 -9.443 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.197 0.736 -8.702 1.00 0.00 H new ATOM 0 HD23 LEU A 104 1.950 2.105 -9.555 1.00 0.00 H new ATOM 1612 N SER A 105 4.882 -1.836 -10.018 1.00 0.00 N ATOM 1613 CA SER A 105 5.886 -2.856 -10.293 1.00 0.00 C ATOM 1614 C SER A 105 5.660 -4.077 -9.404 1.00 0.00 C ATOM 1615 O SER A 105 5.652 -5.211 -9.882 1.00 0.00 O ATOM 1616 CB SER A 105 7.287 -2.286 -10.054 1.00 0.00 C ATOM 1617 OG SER A 105 7.847 -1.885 -11.297 1.00 0.00 O ATOM 0 H SER A 105 5.259 -0.906 -9.835 1.00 0.00 H new ATOM 0 HA SER A 105 5.798 -3.163 -11.335 1.00 0.00 H new ATOM 0 HB2 SER A 105 7.236 -1.436 -9.374 1.00 0.00 H new ATOM 0 HB3 SER A 105 7.921 -3.035 -9.581 1.00 0.00 H new ATOM 0 HG SER A 105 8.795 -1.668 -11.174 1.00 0.00 H new ATOM 1623 N ILE A 106 5.477 -3.835 -8.110 1.00 0.00 N ATOM 1624 CA ILE A 106 5.251 -4.923 -7.166 1.00 0.00 C ATOM 1625 C ILE A 106 3.868 -5.532 -7.373 1.00 0.00 C ATOM 1626 O ILE A 106 3.734 -6.742 -7.557 1.00 0.00 O ATOM 1627 CB ILE A 106 5.372 -4.405 -5.732 1.00 0.00 C ATOM 1628 CG1 ILE A 106 6.755 -3.782 -5.530 1.00 0.00 C ATOM 1629 CG2 ILE A 106 5.189 -5.565 -4.752 1.00 0.00 C ATOM 1630 CD1 ILE A 106 6.778 -3.000 -4.216 1.00 0.00 C ATOM 0 H ILE A 106 5.481 -2.904 -7.694 1.00 0.00 H new ATOM 0 HA ILE A 106 6.005 -5.691 -7.339 1.00 0.00 H new ATOM 0 HB ILE A 106 4.604 -3.653 -5.552 1.00 0.00 H new ATOM 0 HG12 ILE A 106 7.517 -4.561 -5.515 1.00 0.00 H new ATOM 0 HG13 ILE A 106 6.992 -3.120 -6.363 1.00 0.00 H new ATOM 0 HG21 ILE A 106 5.275 -5.195 -3.730 1.00 0.00 H new ATOM 0 HG22 ILE A 106 4.204 -6.010 -4.895 1.00 0.00 H new ATOM 0 HG23 ILE A 106 5.957 -6.318 -4.932 1.00 0.00 H new ATOM 0 HD11 ILE A 106 7.764 -2.557 -4.074 1.00 0.00 H new ATOM 0 HD12 ILE A 106 6.027 -2.211 -4.249 1.00 0.00 H new ATOM 0 HD13 ILE A 106 6.560 -3.674 -3.388 1.00 0.00 H new ATOM 1642 N CYS A 107 2.843 -4.687 -7.340 1.00 0.00 N ATOM 1643 CA CYS A 107 1.473 -5.154 -7.524 1.00 0.00 C ATOM 1644 C CYS A 107 1.363 -6.012 -8.781 1.00 0.00 C ATOM 1645 O CYS A 107 0.649 -7.014 -8.798 1.00 0.00 O ATOM 1646 CB CYS A 107 0.525 -3.959 -7.636 1.00 0.00 C ATOM 1647 SG CYS A 107 -1.187 -4.535 -7.520 1.00 0.00 S ATOM 0 H CYS A 107 2.933 -3.682 -7.189 1.00 0.00 H new ATOM 0 HA CYS A 107 1.196 -5.758 -6.660 1.00 0.00 H new ATOM 0 HB2 CYS A 107 0.733 -3.241 -6.843 1.00 0.00 H new ATOM 0 HB3 CYS A 107 0.683 -3.443 -8.583 1.00 0.00 H new ATOM 0 HG CYS A 107 -1.878 -3.700 -6.803 1.00 0.00 H new ATOM 1653 N SER A 108 2.074 -5.611 -9.829 1.00 0.00 N ATOM 1654 CA SER A 108 2.047 -6.352 -11.085 1.00 0.00 C ATOM 1655 C SER A 108 2.897 -7.614 -10.981 1.00 0.00 C ATOM 1656 O SER A 108 2.614 -8.620 -11.633 1.00 0.00 O ATOM 1657 CB SER A 108 2.574 -5.474 -12.220 1.00 0.00 C ATOM 1658 OG SER A 108 1.965 -4.192 -12.143 1.00 0.00 O ATOM 0 H SER A 108 2.671 -4.784 -9.835 1.00 0.00 H new ATOM 0 HA SER A 108 1.016 -6.637 -11.294 1.00 0.00 H new ATOM 0 HB2 SER A 108 3.658 -5.380 -12.149 1.00 0.00 H new ATOM 0 HB3 SER A 108 2.357 -5.935 -13.183 1.00 0.00 H new ATOM 0 HG SER A 108 2.565 -3.572 -11.678 1.00 0.00 H new ATOM 1664 N LEU A 109 3.938 -7.555 -10.157 1.00 0.00 N ATOM 1665 CA LEU A 109 4.822 -8.701 -9.976 1.00 0.00 C ATOM 1666 C LEU A 109 4.051 -9.886 -9.403 1.00 0.00 C ATOM 1667 O LEU A 109 4.313 -11.037 -9.752 1.00 0.00 O ATOM 1668 CB LEU A 109 5.972 -8.329 -9.036 1.00 0.00 C ATOM 1669 CG LEU A 109 7.052 -9.418 -9.076 1.00 0.00 C ATOM 1670 CD1 LEU A 109 7.895 -9.277 -10.349 1.00 0.00 C ATOM 1671 CD2 LEU A 109 7.958 -9.276 -7.851 1.00 0.00 C ATOM 0 H LEU A 109 4.189 -6.733 -9.608 1.00 0.00 H new ATOM 0 HA LEU A 109 5.227 -8.984 -10.948 1.00 0.00 H new ATOM 0 HB2 LEU A 109 6.399 -7.370 -9.331 1.00 0.00 H new ATOM 0 HB3 LEU A 109 5.598 -8.212 -8.019 1.00 0.00 H new ATOM 0 HG LEU A 109 6.573 -10.397 -9.072 1.00 0.00 H new ATOM 0 HD11 LEU A 109 8.659 -10.055 -10.368 1.00 0.00 H new ATOM 0 HD12 LEU A 109 7.253 -9.378 -11.224 1.00 0.00 H new ATOM 0 HD13 LEU A 109 8.374 -8.298 -10.362 1.00 0.00 H new ATOM 0 HD21 LEU A 109 8.727 -10.048 -7.876 1.00 0.00 H new ATOM 0 HD22 LEU A 109 8.430 -8.294 -7.859 1.00 0.00 H new ATOM 0 HD23 LEU A 109 7.363 -9.385 -6.944 1.00 0.00 H new ATOM 1683 N LEU A 110 3.097 -9.596 -8.524 1.00 0.00 N ATOM 1684 CA LEU A 110 2.292 -10.648 -7.913 1.00 0.00 C ATOM 1685 C LEU A 110 1.344 -11.256 -8.942 1.00 0.00 C ATOM 1686 O LEU A 110 1.023 -12.443 -8.880 1.00 0.00 O ATOM 1687 CB LEU A 110 1.479 -10.078 -6.747 1.00 0.00 C ATOM 1688 CG LEU A 110 2.408 -9.325 -5.787 1.00 0.00 C ATOM 1689 CD1 LEU A 110 1.570 -8.601 -4.728 1.00 0.00 C ATOM 1690 CD2 LEU A 110 3.354 -10.315 -5.097 1.00 0.00 C ATOM 0 H LEU A 110 2.864 -8.650 -8.221 1.00 0.00 H new ATOM 0 HA LEU A 110 2.962 -11.424 -7.542 1.00 0.00 H new ATOM 0 HB2 LEU A 110 0.708 -9.406 -7.123 1.00 0.00 H new ATOM 0 HB3 LEU A 110 0.970 -10.884 -6.218 1.00 0.00 H new ATOM 0 HG LEU A 110 2.994 -8.599 -6.350 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.230 -8.066 -4.045 1.00 0.00 H new ATOM 0 HD12 LEU A 110 0.900 -7.893 -5.216 1.00 0.00 H new ATOM 0 HD13 LEU A 110 0.983 -9.329 -4.169 1.00 0.00 H new ATOM 0 HD21 LEU A 110 4.012 -9.775 -4.416 1.00 0.00 H new ATOM 0 HD22 LEU A 110 2.771 -11.045 -4.536 1.00 0.00 H new ATOM 0 HD23 LEU A 110 3.953 -10.830 -5.848 1.00 0.00 H new ATOM 1702 N CYS A 111 0.900 -10.435 -9.888 1.00 0.00 N ATOM 1703 CA CYS A 111 -0.010 -10.901 -10.927 1.00 0.00 C ATOM 1704 C CYS A 111 0.737 -11.743 -11.956 1.00 0.00 C ATOM 1705 O CYS A 111 0.126 -12.388 -12.807 1.00 0.00 O ATOM 1706 CB CYS A 111 -0.666 -9.706 -11.622 1.00 0.00 C ATOM 1707 SG CYS A 111 -2.103 -10.270 -12.566 1.00 0.00 S ATOM 0 H CYS A 111 1.154 -9.449 -9.956 1.00 0.00 H new ATOM 0 HA CYS A 111 -0.779 -11.516 -10.460 1.00 0.00 H new ATOM 0 HB2 CYS A 111 -0.971 -8.965 -10.883 1.00 0.00 H new ATOM 0 HB3 CYS A 111 0.050 -9.220 -12.285 1.00 0.00 H new ATOM 0 HG CYS A 111 -1.864 -11.449 -13.058 1.00 0.00 H new ATOM 1713 N ASP A 112 2.063 -11.731 -11.870 1.00 0.00 N ATOM 1714 CA ASP A 112 2.888 -12.496 -12.798 1.00 0.00 C ATOM 1715 C ASP A 112 4.261 -12.769 -12.190 1.00 0.00 C ATOM 1716 O ASP A 112 5.261 -12.181 -12.602 1.00 0.00 O ATOM 1717 CB ASP A 112 3.052 -11.724 -14.108 1.00 0.00 C ATOM 1718 CG ASP A 112 3.588 -12.649 -15.195 1.00 0.00 C ATOM 1719 OD1 ASP A 112 4.043 -13.729 -14.855 1.00 0.00 O ATOM 1720 OD2 ASP A 112 3.536 -12.265 -16.352 1.00 0.00 O ATOM 0 H ASP A 112 2.587 -11.203 -11.172 1.00 0.00 H new ATOM 0 HA ASP A 112 2.395 -13.447 -12.997 1.00 0.00 H new ATOM 0 HB2 ASP A 112 2.094 -11.305 -14.415 1.00 0.00 H new ATOM 0 HB3 ASP A 112 3.734 -10.886 -13.963 1.00 0.00 H new ATOM 1725 N PRO A 113 4.320 -13.643 -11.221 1.00 0.00 N ATOM 1726 CA PRO A 113 5.594 -14.005 -10.534 1.00 0.00 C ATOM 1727 C PRO A 113 6.725 -14.287 -11.522 1.00 0.00 C ATOM 1728 O PRO A 113 6.557 -14.146 -12.733 1.00 0.00 O ATOM 1729 CB PRO A 113 5.229 -15.261 -9.739 1.00 0.00 C ATOM 1730 CG PRO A 113 3.762 -15.147 -9.483 1.00 0.00 C ATOM 1731 CD PRO A 113 3.172 -14.385 -10.672 1.00 0.00 C ATOM 0 HA PRO A 113 5.968 -13.194 -9.909 1.00 0.00 H new ATOM 0 HB2 PRO A 113 5.462 -16.165 -10.302 1.00 0.00 H new ATOM 0 HB3 PRO A 113 5.789 -15.313 -8.805 1.00 0.00 H new ATOM 0 HG2 PRO A 113 3.307 -16.133 -9.389 1.00 0.00 H new ATOM 0 HG3 PRO A 113 3.571 -14.618 -8.549 1.00 0.00 H new ATOM 0 HD2 PRO A 113 2.745 -15.064 -11.410 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.374 -13.712 -10.359 1.00 0.00 H new ATOM 1739 N ASN A 114 7.878 -14.686 -10.992 1.00 0.00 N ATOM 1740 CA ASN A 114 9.036 -14.986 -11.829 1.00 0.00 C ATOM 1741 C ASN A 114 9.840 -16.141 -11.237 1.00 0.00 C ATOM 1742 O ASN A 114 10.891 -15.930 -10.632 1.00 0.00 O ATOM 1743 CB ASN A 114 9.930 -13.749 -11.942 1.00 0.00 C ATOM 1744 CG ASN A 114 9.271 -12.711 -12.845 1.00 0.00 C ATOM 1745 OD1 ASN A 114 8.543 -11.842 -12.365 1.00 0.00 O ATOM 1746 ND2 ASN A 114 9.483 -12.750 -14.132 1.00 0.00 N ATOM 0 H ASN A 114 8.035 -14.809 -9.992 1.00 0.00 H new ATOM 0 HA ASN A 114 8.682 -15.273 -12.819 1.00 0.00 H new ATOM 0 HB2 ASN A 114 10.105 -13.325 -10.953 1.00 0.00 H new ATOM 0 HB3 ASN A 114 10.903 -14.029 -12.345 1.00 0.00 H new ATOM 0 HD21 ASN A 114 9.045 -12.060 -14.742 1.00 0.00 H new ATOM 0 HD22 ASN A 114 10.087 -13.471 -14.528 1.00 0.00 H new ATOM 1753 N PRO A 115 9.366 -17.349 -11.397 1.00 0.00 N ATOM 1754 CA PRO A 115 10.054 -18.559 -10.865 1.00 0.00 C ATOM 1755 C PRO A 115 11.242 -18.969 -11.733 1.00 0.00 C ATOM 1756 O PRO A 115 11.219 -20.013 -12.384 1.00 0.00 O ATOM 1757 CB PRO A 115 8.957 -19.625 -10.880 1.00 0.00 C ATOM 1758 CG PRO A 115 8.034 -19.223 -11.985 1.00 0.00 C ATOM 1759 CD PRO A 115 8.121 -17.696 -12.104 1.00 0.00 C ATOM 0 HA PRO A 115 10.479 -18.397 -9.874 1.00 0.00 H new ATOM 0 HB2 PRO A 115 9.374 -20.617 -11.056 1.00 0.00 H new ATOM 0 HB3 PRO A 115 8.434 -19.665 -9.925 1.00 0.00 H new ATOM 0 HG2 PRO A 115 8.322 -19.700 -12.922 1.00 0.00 H new ATOM 0 HG3 PRO A 115 7.013 -19.536 -11.768 1.00 0.00 H new ATOM 0 HD2 PRO A 115 8.153 -17.379 -13.146 1.00 0.00 H new ATOM 0 HD3 PRO A 115 7.257 -17.211 -11.650 1.00 0.00 H new ATOM 1767 N ASP A 116 12.279 -18.137 -11.734 1.00 0.00 N ATOM 1768 CA ASP A 116 13.475 -18.416 -12.522 1.00 0.00 C ATOM 1769 C ASP A 116 14.687 -17.722 -11.911 1.00 0.00 C ATOM 1770 O ASP A 116 15.806 -18.233 -11.975 1.00 0.00 O ATOM 1771 CB ASP A 116 13.278 -17.933 -13.960 1.00 0.00 C ATOM 1772 CG ASP A 116 11.898 -18.343 -14.465 1.00 0.00 C ATOM 1773 OD1 ASP A 116 11.759 -19.477 -14.893 1.00 0.00 O ATOM 1774 OD2 ASP A 116 11.001 -17.517 -14.415 1.00 0.00 O ATOM 0 H ASP A 116 12.316 -17.268 -11.201 1.00 0.00 H new ATOM 0 HA ASP A 116 13.647 -19.492 -12.523 1.00 0.00 H new ATOM 0 HB2 ASP A 116 13.384 -16.849 -14.006 1.00 0.00 H new ATOM 0 HB3 ASP A 116 14.050 -18.356 -14.603 1.00 0.00 H new ATOM 1779 N ASP A 117 14.456 -16.555 -11.317 1.00 0.00 N ATOM 1780 CA ASP A 117 15.532 -15.792 -10.692 1.00 0.00 C ATOM 1781 C ASP A 117 15.061 -15.192 -9.370 1.00 0.00 C ATOM 1782 O ASP A 117 15.104 -13.977 -9.178 1.00 0.00 O ATOM 1783 CB ASP A 117 15.990 -14.672 -11.628 1.00 0.00 C ATOM 1784 CG ASP A 117 16.808 -15.253 -12.776 1.00 0.00 C ATOM 1785 OD1 ASP A 117 16.474 -16.335 -13.228 1.00 0.00 O ATOM 1786 OD2 ASP A 117 17.758 -14.606 -13.188 1.00 0.00 O ATOM 0 H ASP A 117 13.536 -16.118 -11.255 1.00 0.00 H new ATOM 0 HA ASP A 117 16.367 -16.466 -10.498 1.00 0.00 H new ATOM 0 HB2 ASP A 117 15.124 -14.139 -12.021 1.00 0.00 H new ATOM 0 HB3 ASP A 117 16.587 -13.947 -11.076 1.00 0.00 H new ATOM 1791 N PRO A 118 14.614 -16.021 -8.465 1.00 0.00 N ATOM 1792 CA PRO A 118 14.121 -15.570 -7.131 1.00 0.00 C ATOM 1793 C PRO A 118 15.261 -15.109 -6.224 1.00 0.00 C ATOM 1794 O PRO A 118 16.418 -15.058 -6.643 1.00 0.00 O ATOM 1795 CB PRO A 118 13.432 -16.815 -6.561 1.00 0.00 C ATOM 1796 CG PRO A 118 14.101 -17.972 -7.229 1.00 0.00 C ATOM 1797 CD PRO A 118 14.529 -17.484 -8.615 1.00 0.00 C ATOM 0 HA PRO A 118 13.457 -14.709 -7.207 1.00 0.00 H new ATOM 0 HB2 PRO A 118 13.544 -16.866 -5.478 1.00 0.00 H new ATOM 0 HB3 PRO A 118 12.362 -16.804 -6.770 1.00 0.00 H new ATOM 0 HG2 PRO A 118 14.963 -18.308 -6.652 1.00 0.00 H new ATOM 0 HG3 PRO A 118 13.421 -18.820 -7.309 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.487 -17.912 -8.911 1.00 0.00 H new ATOM 0 HD3 PRO A 118 13.805 -17.766 -9.379 1.00 0.00 H new ATOM 1805 N LEU A 119 14.923 -14.775 -4.981 1.00 0.00 N ATOM 1806 CA LEU A 119 15.920 -14.318 -4.016 1.00 0.00 C ATOM 1807 C LEU A 119 15.903 -15.210 -2.777 1.00 0.00 C ATOM 1808 O LEU A 119 16.621 -14.960 -1.809 1.00 0.00 O ATOM 1809 CB LEU A 119 15.626 -12.865 -3.615 1.00 0.00 C ATOM 1810 CG LEU A 119 16.937 -12.130 -3.299 1.00 0.00 C ATOM 1811 CD1 LEU A 119 17.546 -11.582 -4.593 1.00 0.00 C ATOM 1812 CD2 LEU A 119 16.653 -10.967 -2.343 1.00 0.00 C ATOM 0 H LEU A 119 13.970 -14.812 -4.619 1.00 0.00 H new ATOM 0 HA LEU A 119 16.907 -14.373 -4.475 1.00 0.00 H new ATOM 0 HB2 LEU A 119 15.100 -12.356 -4.423 1.00 0.00 H new ATOM 0 HB3 LEU A 119 14.970 -12.845 -2.745 1.00 0.00 H new ATOM 0 HG LEU A 119 17.636 -12.826 -2.834 1.00 0.00 H new ATOM 0 HD11 LEU A 119 18.476 -11.061 -4.365 1.00 0.00 H new ATOM 0 HD12 LEU A 119 17.750 -12.406 -5.277 1.00 0.00 H new ATOM 0 HD13 LEU A 119 16.846 -10.888 -5.059 1.00 0.00 H new ATOM 0 HD21 LEU A 119 17.583 -10.445 -2.118 1.00 0.00 H new ATOM 0 HD22 LEU A 119 15.952 -10.275 -2.810 1.00 0.00 H new ATOM 0 HD23 LEU A 119 16.221 -11.352 -1.419 1.00 0.00 H new ATOM 1824 N VAL A 120 15.077 -16.252 -2.817 1.00 0.00 N ATOM 1825 CA VAL A 120 14.967 -17.181 -1.696 1.00 0.00 C ATOM 1826 C VAL A 120 14.690 -18.596 -2.201 1.00 0.00 C ATOM 1827 O VAL A 120 13.540 -19.033 -2.244 1.00 0.00 O ATOM 1828 CB VAL A 120 13.832 -16.741 -0.768 1.00 0.00 C ATOM 1829 CG1 VAL A 120 13.976 -17.439 0.586 1.00 0.00 C ATOM 1830 CG2 VAL A 120 13.895 -15.226 -0.567 1.00 0.00 C ATOM 0 H VAL A 120 14.476 -16.474 -3.611 1.00 0.00 H new ATOM 0 HA VAL A 120 15.910 -17.178 -1.149 1.00 0.00 H new ATOM 0 HB VAL A 120 12.875 -17.010 -1.215 1.00 0.00 H new ATOM 0 HG11 VAL A 120 13.167 -17.124 1.245 1.00 0.00 H new ATOM 0 HG12 VAL A 120 13.930 -18.519 0.445 1.00 0.00 H new ATOM 0 HG13 VAL A 120 14.933 -17.172 1.033 1.00 0.00 H new ATOM 0 HG21 VAL A 120 13.087 -14.913 0.094 1.00 0.00 H new ATOM 0 HG22 VAL A 120 14.853 -14.958 -0.121 1.00 0.00 H new ATOM 0 HG23 VAL A 120 13.790 -14.727 -1.530 1.00 0.00 H new ATOM 1840 N PRO A 121 15.715 -19.312 -2.587 1.00 0.00 N ATOM 1841 CA PRO A 121 15.575 -20.704 -3.106 1.00 0.00 C ATOM 1842 C PRO A 121 14.672 -21.565 -2.224 1.00 0.00 C ATOM 1843 O PRO A 121 14.085 -22.542 -2.689 1.00 0.00 O ATOM 1844 CB PRO A 121 17.012 -21.232 -3.107 1.00 0.00 C ATOM 1845 CG PRO A 121 17.870 -20.019 -3.259 1.00 0.00 C ATOM 1846 CD PRO A 121 17.123 -18.874 -2.571 1.00 0.00 C ATOM 0 HA PRO A 121 15.105 -20.730 -4.089 1.00 0.00 H new ATOM 0 HB2 PRO A 121 17.238 -21.762 -2.182 1.00 0.00 H new ATOM 0 HB3 PRO A 121 17.174 -21.935 -3.924 1.00 0.00 H new ATOM 0 HG2 PRO A 121 18.848 -20.175 -2.803 1.00 0.00 H new ATOM 0 HG3 PRO A 121 18.042 -19.794 -4.312 1.00 0.00 H new ATOM 0 HD2 PRO A 121 17.481 -18.717 -1.554 1.00 0.00 H new ATOM 0 HD3 PRO A 121 17.255 -17.933 -3.104 1.00 0.00 H new ATOM 1854 N GLU A 122 14.566 -21.198 -0.951 1.00 0.00 N ATOM 1855 CA GLU A 122 13.730 -21.948 -0.019 1.00 0.00 C ATOM 1856 C GLU A 122 12.254 -21.753 -0.348 1.00 0.00 C ATOM 1857 O GLU A 122 11.508 -22.721 -0.497 1.00 0.00 O ATOM 1858 CB GLU A 122 14.001 -21.489 1.415 1.00 0.00 C ATOM 1859 CG GLU A 122 13.411 -22.505 2.396 1.00 0.00 C ATOM 1860 CD GLU A 122 13.337 -21.898 3.793 1.00 0.00 C ATOM 1861 OE1 GLU A 122 14.376 -21.514 4.306 1.00 0.00 O ATOM 1862 OE2 GLU A 122 12.244 -21.825 4.329 1.00 0.00 O ATOM 0 H GLU A 122 15.043 -20.394 -0.543 1.00 0.00 H new ATOM 0 HA GLU A 122 13.975 -23.006 -0.112 1.00 0.00 H new ATOM 0 HB2 GLU A 122 15.074 -21.389 1.580 1.00 0.00 H new ATOM 0 HB3 GLU A 122 13.560 -20.507 1.583 1.00 0.00 H new ATOM 0 HG2 GLU A 122 12.416 -22.805 2.067 1.00 0.00 H new ATOM 0 HG3 GLU A 122 14.025 -23.405 2.414 1.00 0.00 H new ATOM 1869 N ILE A 123 11.838 -20.496 -0.461 1.00 0.00 N ATOM 1870 CA ILE A 123 10.448 -20.187 -0.773 1.00 0.00 C ATOM 1871 C ILE A 123 10.112 -20.617 -2.197 1.00 0.00 C ATOM 1872 O ILE A 123 9.042 -21.168 -2.455 1.00 0.00 O ATOM 1873 CB ILE A 123 10.197 -18.687 -0.618 1.00 0.00 C ATOM 1874 CG1 ILE A 123 10.513 -18.263 0.818 1.00 0.00 C ATOM 1875 CG2 ILE A 123 8.731 -18.380 -0.928 1.00 0.00 C ATOM 1876 CD1 ILE A 123 10.484 -16.736 0.920 1.00 0.00 C ATOM 0 H ILE A 123 12.439 -19.680 -0.342 1.00 0.00 H new ATOM 0 HA ILE A 123 9.809 -20.734 -0.079 1.00 0.00 H new ATOM 0 HB ILE A 123 10.837 -18.139 -1.309 1.00 0.00 H new ATOM 0 HG12 ILE A 123 9.786 -18.697 1.505 1.00 0.00 H new ATOM 0 HG13 ILE A 123 11.493 -18.639 1.112 1.00 0.00 H new ATOM 0 HG21 ILE A 123 8.552 -17.310 -0.817 1.00 0.00 H new ATOM 0 HG22 ILE A 123 8.504 -18.682 -1.950 1.00 0.00 H new ATOM 0 HG23 ILE A 123 8.090 -18.928 -0.237 1.00 0.00 H new ATOM 0 HD11 ILE A 123 10.709 -16.435 1.943 1.00 0.00 H new ATOM 0 HD12 ILE A 123 11.228 -16.312 0.245 1.00 0.00 H new ATOM 0 HD13 ILE A 123 9.494 -16.372 0.644 1.00 0.00 H new ATOM 1888 N ALA A 124 11.035 -20.359 -3.119 1.00 0.00 N ATOM 1889 CA ALA A 124 10.828 -20.722 -4.515 1.00 0.00 C ATOM 1890 C ALA A 124 10.563 -22.218 -4.646 1.00 0.00 C ATOM 1891 O ALA A 124 9.716 -22.640 -5.432 1.00 0.00 O ATOM 1892 CB ALA A 124 12.059 -20.345 -5.341 1.00 0.00 C ATOM 0 H ALA A 124 11.927 -19.903 -2.926 1.00 0.00 H new ATOM 0 HA ALA A 124 9.961 -20.177 -4.888 1.00 0.00 H new ATOM 0 HB1 ALA A 124 11.896 -20.620 -6.383 1.00 0.00 H new ATOM 0 HB2 ALA A 124 12.229 -19.271 -5.271 1.00 0.00 H new ATOM 0 HB3 ALA A 124 12.931 -20.876 -4.958 1.00 0.00 H new ATOM 1898 N ARG A 125 11.291 -23.015 -3.870 1.00 0.00 N ATOM 1899 CA ARG A 125 11.128 -24.464 -3.909 1.00 0.00 C ATOM 1900 C ARG A 125 9.669 -24.845 -3.662 1.00 0.00 C ATOM 1901 O ARG A 125 9.155 -25.790 -4.260 1.00 0.00 O ATOM 1902 CB ARG A 125 12.024 -25.117 -2.843 1.00 0.00 C ATOM 1903 CG ARG A 125 13.229 -25.797 -3.506 1.00 0.00 C ATOM 1904 CD ARG A 125 12.810 -27.160 -4.064 1.00 0.00 C ATOM 1905 NE ARG A 125 13.970 -27.862 -4.601 1.00 0.00 N ATOM 1906 CZ ARG A 125 14.806 -28.521 -3.804 1.00 0.00 C ATOM 1907 NH1 ARG A 125 14.597 -28.545 -2.516 1.00 0.00 N ATOM 1908 NH2 ARG A 125 15.836 -29.143 -4.310 1.00 0.00 N ATOM 0 H ARG A 125 11.995 -22.685 -3.210 1.00 0.00 H new ATOM 0 HA ARG A 125 11.420 -24.822 -4.896 1.00 0.00 H new ATOM 0 HB2 ARG A 125 12.367 -24.363 -2.135 1.00 0.00 H new ATOM 0 HB3 ARG A 125 11.451 -25.850 -2.275 1.00 0.00 H new ATOM 0 HG2 ARG A 125 13.618 -25.169 -4.308 1.00 0.00 H new ATOM 0 HG3 ARG A 125 14.033 -25.922 -2.781 1.00 0.00 H new ATOM 0 HD2 ARG A 125 12.347 -27.756 -3.278 1.00 0.00 H new ATOM 0 HD3 ARG A 125 12.062 -27.027 -4.846 1.00 0.00 H new ATOM 0 HE ARG A 125 14.143 -27.847 -5.606 1.00 0.00 H new ATOM 0 HH11 ARG A 125 13.792 -28.058 -2.121 1.00 0.00 H new ATOM 0 HH12 ARG A 125 15.238 -29.050 -1.905 1.00 0.00 H new ATOM 0 HH21 ARG A 125 16.000 -29.124 -5.317 1.00 0.00 H new ATOM 0 HH22 ARG A 125 16.477 -29.648 -3.699 1.00 0.00 H new ATOM 1922 N ILE A 126 9.010 -24.106 -2.776 1.00 0.00 N ATOM 1923 CA ILE A 126 7.614 -24.380 -2.458 1.00 0.00 C ATOM 1924 C ILE A 126 6.712 -24.039 -3.641 1.00 0.00 C ATOM 1925 O ILE A 126 5.954 -24.881 -4.120 1.00 0.00 O ATOM 1926 CB ILE A 126 7.186 -23.561 -1.239 1.00 0.00 C ATOM 1927 CG1 ILE A 126 8.266 -23.648 -0.156 1.00 0.00 C ATOM 1928 CG2 ILE A 126 5.866 -24.108 -0.692 1.00 0.00 C ATOM 1929 CD1 ILE A 126 8.607 -25.115 0.122 1.00 0.00 C ATOM 0 H ILE A 126 9.416 -23.319 -2.269 1.00 0.00 H new ATOM 0 HA ILE A 126 7.516 -25.443 -2.238 1.00 0.00 H new ATOM 0 HB ILE A 126 7.052 -22.520 -1.532 1.00 0.00 H new ATOM 0 HG12 ILE A 126 9.159 -23.112 -0.477 1.00 0.00 H new ATOM 0 HG13 ILE A 126 7.917 -23.167 0.758 1.00 0.00 H new ATOM 0 HG21 ILE A 126 5.562 -23.524 0.177 1.00 0.00 H new ATOM 0 HG22 ILE A 126 5.097 -24.041 -1.462 1.00 0.00 H new ATOM 0 HG23 ILE A 126 5.997 -25.150 -0.400 1.00 0.00 H new ATOM 0 HD11 ILE A 126 9.376 -25.170 0.893 1.00 0.00 H new ATOM 0 HD12 ILE A 126 7.713 -25.638 0.462 1.00 0.00 H new ATOM 0 HD13 ILE A 126 8.975 -25.582 -0.791 1.00 0.00 H new ATOM 1941 N TYR A 127 6.798 -22.796 -4.100 1.00 0.00 N ATOM 1942 CA TYR A 127 5.984 -22.341 -5.223 1.00 0.00 C ATOM 1943 C TYR A 127 6.265 -23.164 -6.478 1.00 0.00 C ATOM 1944 O TYR A 127 5.382 -23.355 -7.315 1.00 0.00 O ATOM 1945 CB TYR A 127 6.272 -20.865 -5.507 1.00 0.00 C ATOM 1946 CG TYR A 127 5.197 -20.304 -6.407 1.00 0.00 C ATOM 1947 CD1 TYR A 127 4.044 -19.738 -5.851 1.00 0.00 C ATOM 1948 CD2 TYR A 127 5.355 -20.350 -7.798 1.00 0.00 C ATOM 1949 CE1 TYR A 127 3.047 -19.218 -6.686 1.00 0.00 C ATOM 1950 CE2 TYR A 127 4.358 -19.829 -8.632 1.00 0.00 C ATOM 1951 CZ TYR A 127 3.204 -19.264 -8.076 1.00 0.00 C ATOM 1952 OH TYR A 127 2.222 -18.752 -8.899 1.00 0.00 O ATOM 0 H TYR A 127 7.421 -22.086 -3.714 1.00 0.00 H new ATOM 0 HA TYR A 127 4.935 -22.469 -4.954 1.00 0.00 H new ATOM 0 HB2 TYR A 127 6.308 -20.305 -4.573 1.00 0.00 H new ATOM 0 HB3 TYR A 127 7.248 -20.759 -5.980 1.00 0.00 H new ATOM 0 HD1 TYR A 127 3.923 -19.702 -4.778 1.00 0.00 H new ATOM 0 HD2 TYR A 127 6.245 -20.787 -8.227 1.00 0.00 H new ATOM 0 HE1 TYR A 127 2.157 -18.782 -6.257 1.00 0.00 H new ATOM 0 HE2 TYR A 127 4.479 -19.863 -9.705 1.00 0.00 H new ATOM 0 HH TYR A 127 2.489 -18.863 -9.835 1.00 0.00 H new ATOM 1962 N LYS A 128 7.500 -23.634 -6.613 1.00 0.00 N ATOM 1963 CA LYS A 128 7.884 -24.418 -7.784 1.00 0.00 C ATOM 1964 C LYS A 128 6.897 -25.557 -8.034 1.00 0.00 C ATOM 1965 O LYS A 128 6.174 -25.550 -9.030 1.00 0.00 O ATOM 1966 CB LYS A 128 9.294 -24.992 -7.591 1.00 0.00 C ATOM 1967 CG LYS A 128 9.953 -25.222 -8.958 1.00 0.00 C ATOM 1968 CD LYS A 128 10.631 -23.931 -9.431 1.00 0.00 C ATOM 1969 CE LYS A 128 10.818 -23.975 -10.949 1.00 0.00 C ATOM 1970 NZ LYS A 128 11.553 -22.758 -11.395 1.00 0.00 N ATOM 0 H LYS A 128 8.247 -23.489 -5.934 1.00 0.00 H new ATOM 0 HA LYS A 128 7.873 -23.757 -8.651 1.00 0.00 H new ATOM 0 HB2 LYS A 128 9.898 -24.306 -6.997 1.00 0.00 H new ATOM 0 HB3 LYS A 128 9.242 -25.931 -7.039 1.00 0.00 H new ATOM 0 HG2 LYS A 128 10.687 -26.025 -8.888 1.00 0.00 H new ATOM 0 HG3 LYS A 128 9.204 -25.538 -9.684 1.00 0.00 H new ATOM 0 HD2 LYS A 128 10.026 -23.068 -9.154 1.00 0.00 H new ATOM 0 HD3 LYS A 128 11.597 -23.814 -8.939 1.00 0.00 H new ATOM 0 HE2 LYS A 128 11.371 -24.871 -11.232 1.00 0.00 H new ATOM 0 HE3 LYS A 128 9.848 -24.029 -11.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 12.189 -23.005 -12.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 10.873 -22.039 -11.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 12.111 -22.380 -10.603 1.00 0.00 H new ATOM 1984 N THR A 129 6.878 -26.539 -7.136 1.00 0.00 N ATOM 1985 CA THR A 129 5.980 -27.684 -7.287 1.00 0.00 C ATOM 1986 C THR A 129 4.829 -27.620 -6.287 1.00 0.00 C ATOM 1987 O THR A 129 3.682 -27.903 -6.632 1.00 0.00 O ATOM 1988 CB THR A 129 6.759 -28.984 -7.079 1.00 0.00 C ATOM 1989 OG1 THR A 129 6.954 -29.200 -5.688 1.00 0.00 O ATOM 1990 CG2 THR A 129 8.117 -28.886 -7.777 1.00 0.00 C ATOM 0 H THR A 129 7.467 -26.567 -6.304 1.00 0.00 H new ATOM 0 HA THR A 129 5.565 -27.656 -8.294 1.00 0.00 H new ATOM 0 HB THR A 129 6.196 -29.816 -7.501 1.00 0.00 H new ATOM 0 HG1 THR A 129 7.451 -30.033 -5.553 1.00 0.00 H new ATOM 0 HG21 THR A 129 8.671 -29.813 -7.628 1.00 0.00 H new ATOM 0 HG22 THR A 129 7.967 -28.721 -8.844 1.00 0.00 H new ATOM 0 HG23 THR A 129 8.683 -28.054 -7.357 1.00 0.00 H new ATOM 1998 N ASP A 130 5.140 -27.252 -5.049 1.00 0.00 N ATOM 1999 CA ASP A 130 4.117 -27.164 -4.011 1.00 0.00 C ATOM 2000 C ASP A 130 3.385 -25.828 -4.086 1.00 0.00 C ATOM 2001 O ASP A 130 3.714 -24.888 -3.363 1.00 0.00 O ATOM 2002 CB ASP A 130 4.759 -27.320 -2.632 1.00 0.00 C ATOM 2003 CG ASP A 130 5.180 -28.769 -2.414 1.00 0.00 C ATOM 2004 OD1 ASP A 130 6.208 -29.153 -2.948 1.00 0.00 O ATOM 2005 OD2 ASP A 130 4.469 -29.473 -1.716 1.00 0.00 O ATOM 0 H ASP A 130 6.082 -27.012 -4.741 1.00 0.00 H new ATOM 0 HA ASP A 130 3.397 -27.966 -4.170 1.00 0.00 H new ATOM 0 HB2 ASP A 130 5.626 -26.664 -2.549 1.00 0.00 H new ATOM 0 HB3 ASP A 130 4.055 -27.017 -1.857 1.00 0.00 H new ATOM 2010 N ARG A 131 2.387 -25.754 -4.962 1.00 0.00 N ATOM 2011 CA ARG A 131 1.610 -24.529 -5.123 1.00 0.00 C ATOM 2012 C ARG A 131 0.393 -24.543 -4.203 1.00 0.00 C ATOM 2013 O ARG A 131 0.106 -23.559 -3.522 1.00 0.00 O ATOM 2014 CB ARG A 131 1.151 -24.389 -6.578 1.00 0.00 C ATOM 2015 CG ARG A 131 2.332 -23.953 -7.456 1.00 0.00 C ATOM 2016 CD ARG A 131 2.418 -22.425 -7.487 1.00 0.00 C ATOM 2017 NE ARG A 131 1.349 -21.876 -8.315 1.00 0.00 N ATOM 2018 CZ ARG A 131 1.466 -21.814 -9.637 1.00 0.00 C ATOM 2019 NH1 ARG A 131 2.552 -22.248 -10.217 1.00 0.00 N ATOM 2020 NH2 ARG A 131 0.496 -21.318 -10.356 1.00 0.00 N ATOM 0 H ARG A 131 2.099 -26.522 -5.568 1.00 0.00 H new ATOM 0 HA ARG A 131 2.242 -23.682 -4.858 1.00 0.00 H new ATOM 0 HB2 ARG A 131 0.751 -25.338 -6.936 1.00 0.00 H new ATOM 0 HB3 ARG A 131 0.346 -23.658 -6.646 1.00 0.00 H new ATOM 0 HG2 ARG A 131 3.260 -24.371 -7.067 1.00 0.00 H new ATOM 0 HG3 ARG A 131 2.208 -24.340 -8.467 1.00 0.00 H new ATOM 0 HD2 ARG A 131 2.343 -22.029 -6.474 1.00 0.00 H new ATOM 0 HD3 ARG A 131 3.387 -22.116 -7.879 1.00 0.00 H new ATOM 0 HE ARG A 131 0.497 -21.534 -7.871 1.00 0.00 H new ATOM 0 HH11 ARG A 131 3.311 -22.635 -9.655 1.00 0.00 H new ATOM 0 HH12 ARG A 131 2.642 -22.201 -11.232 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -0.352 -20.978 -9.903 1.00 0.00 H new ATOM 0 HH22 ARG A 131 0.586 -21.271 -11.371 1.00 0.00 H new ATOM 2034 N ASP A 132 -0.319 -25.665 -4.189 1.00 0.00 N ATOM 2035 CA ASP A 132 -1.505 -25.796 -3.350 1.00 0.00 C ATOM 2036 C ASP A 132 -1.157 -25.541 -1.886 1.00 0.00 C ATOM 2037 O ASP A 132 -1.907 -24.881 -1.166 1.00 0.00 O ATOM 2038 CB ASP A 132 -2.099 -27.198 -3.498 1.00 0.00 C ATOM 2039 CG ASP A 132 -3.505 -27.233 -2.909 1.00 0.00 C ATOM 2040 OD1 ASP A 132 -3.810 -26.369 -2.104 1.00 0.00 O ATOM 2041 OD2 ASP A 132 -4.256 -28.123 -3.272 1.00 0.00 O ATOM 0 H ASP A 132 -0.098 -26.491 -4.745 1.00 0.00 H new ATOM 0 HA ASP A 132 -2.237 -25.056 -3.672 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -2.130 -27.480 -4.550 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -1.465 -27.926 -2.991 1.00 0.00 H new ATOM 2046 N LYS A 133 -0.018 -26.069 -1.452 1.00 0.00 N ATOM 2047 CA LYS A 133 0.416 -25.893 -0.071 1.00 0.00 C ATOM 2048 C LYS A 133 0.948 -24.480 0.149 1.00 0.00 C ATOM 2049 O LYS A 133 0.848 -23.934 1.247 1.00 0.00 O ATOM 2050 CB LYS A 133 1.508 -26.909 0.269 1.00 0.00 C ATOM 2051 CG LYS A 133 1.771 -26.889 1.777 1.00 0.00 C ATOM 2052 CD LYS A 133 2.836 -27.938 2.136 1.00 0.00 C ATOM 2053 CE LYS A 133 4.229 -27.301 2.111 1.00 0.00 C ATOM 2054 NZ LYS A 133 4.560 -26.877 0.721 1.00 0.00 N ATOM 0 H LYS A 133 0.617 -26.618 -2.031 1.00 0.00 H new ATOM 0 HA LYS A 133 -0.443 -26.052 0.581 1.00 0.00 H new ATOM 0 HB2 LYS A 133 1.202 -27.907 -0.044 1.00 0.00 H new ATOM 0 HB3 LYS A 133 2.423 -26.671 -0.274 1.00 0.00 H new ATOM 0 HG2 LYS A 133 2.106 -25.898 2.083 1.00 0.00 H new ATOM 0 HG3 LYS A 133 0.848 -27.095 2.319 1.00 0.00 H new ATOM 0 HD2 LYS A 133 2.633 -28.350 3.125 1.00 0.00 H new ATOM 0 HD3 LYS A 133 2.794 -28.767 1.430 1.00 0.00 H new ATOM 0 HE2 LYS A 133 4.259 -26.442 2.781 1.00 0.00 H new ATOM 0 HE3 LYS A 133 4.972 -28.013 2.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 5.593 -26.831 0.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 4.168 -27.564 0.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 4.150 -25.939 0.537 1.00 0.00 H new ATOM 2068 N TYR A 134 1.512 -23.894 -0.902 1.00 0.00 N ATOM 2069 CA TYR A 134 2.056 -22.544 -0.808 1.00 0.00 C ATOM 2070 C TYR A 134 1.055 -21.609 -0.137 1.00 0.00 C ATOM 2071 O TYR A 134 1.412 -20.836 0.751 1.00 0.00 O ATOM 2072 CB TYR A 134 2.392 -22.017 -2.204 1.00 0.00 C ATOM 2073 CG TYR A 134 3.194 -20.744 -2.081 1.00 0.00 C ATOM 2074 CD1 TYR A 134 2.549 -19.536 -1.791 1.00 0.00 C ATOM 2075 CD2 TYR A 134 4.583 -20.772 -2.257 1.00 0.00 C ATOM 2076 CE1 TYR A 134 3.293 -18.355 -1.676 1.00 0.00 C ATOM 2077 CE2 TYR A 134 5.327 -19.591 -2.142 1.00 0.00 C ATOM 2078 CZ TYR A 134 4.682 -18.383 -1.851 1.00 0.00 C ATOM 2079 OH TYR A 134 5.415 -17.220 -1.738 1.00 0.00 O ATOM 0 H TYR A 134 1.604 -24.328 -1.821 1.00 0.00 H new ATOM 0 HA TYR A 134 2.964 -22.580 -0.206 1.00 0.00 H new ATOM 0 HB2 TYR A 134 2.958 -22.764 -2.760 1.00 0.00 H new ATOM 0 HB3 TYR A 134 1.476 -21.830 -2.764 1.00 0.00 H new ATOM 0 HD1 TYR A 134 1.478 -19.515 -1.656 1.00 0.00 H new ATOM 0 HD2 TYR A 134 5.080 -21.704 -2.481 1.00 0.00 H new ATOM 0 HE1 TYR A 134 2.795 -17.423 -1.452 1.00 0.00 H new ATOM 0 HE2 TYR A 134 6.398 -19.612 -2.278 1.00 0.00 H new ATOM 0 HH TYR A 134 4.807 -16.461 -1.613 1.00 0.00 H new ATOM 2089 N ASN A 135 -0.200 -21.687 -0.569 1.00 0.00 N ATOM 2090 CA ASN A 135 -1.245 -20.843 -0.002 1.00 0.00 C ATOM 2091 C ASN A 135 -1.402 -21.114 1.491 1.00 0.00 C ATOM 2092 O ASN A 135 -1.646 -20.197 2.275 1.00 0.00 O ATOM 2093 CB ASN A 135 -2.572 -21.107 -0.714 1.00 0.00 C ATOM 2094 CG ASN A 135 -2.410 -20.894 -2.215 1.00 0.00 C ATOM 2095 OD1 ASN A 135 -1.269 -20.469 -2.685 1.00 0.00 O flip ATOM 2096 ND2 ASN A 135 -3.347 -21.119 -2.980 1.00 0.00 N flip ATOM 0 H ASN A 135 -0.516 -22.320 -1.303 1.00 0.00 H new ATOM 0 HA ASN A 135 -0.960 -19.800 -0.141 1.00 0.00 H new ATOM 0 HB2 ASN A 135 -2.903 -22.126 -0.517 1.00 0.00 H new ATOM 0 HB3 ASN A 135 -3.342 -20.441 -0.325 1.00 0.00 H new ATOM 0 HD21 ASN A 135 -4.238 -21.451 -2.611 1.00 0.00 H new ATOM 0 HD22 ASN A 135 -3.233 -20.973 -3.983 1.00 0.00 H new ATOM 2103 N ARG A 136 -1.261 -22.378 1.876 1.00 0.00 N ATOM 2104 CA ARG A 136 -1.390 -22.759 3.279 1.00 0.00 C ATOM 2105 C ARG A 136 -0.456 -21.924 4.150 1.00 0.00 C ATOM 2106 O ARG A 136 -0.869 -21.374 5.170 1.00 0.00 O ATOM 2107 CB ARG A 136 -1.057 -24.245 3.449 1.00 0.00 C ATOM 2108 CG ARG A 136 -1.601 -24.750 4.792 1.00 0.00 C ATOM 2109 CD ARG A 136 -3.039 -25.246 4.615 1.00 0.00 C ATOM 2110 NE ARG A 136 -3.044 -26.566 3.994 1.00 0.00 N ATOM 2111 CZ ARG A 136 -4.166 -27.100 3.523 1.00 0.00 C ATOM 2112 NH1 ARG A 136 -5.289 -26.442 3.611 1.00 0.00 N ATOM 2113 NH2 ARG A 136 -4.144 -28.283 2.972 1.00 0.00 N ATOM 0 H ARG A 136 -1.059 -23.151 1.242 1.00 0.00 H new ATOM 0 HA ARG A 136 -2.418 -22.578 3.592 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -1.491 -24.820 2.631 1.00 0.00 H new ATOM 0 HB3 ARG A 136 0.022 -24.393 3.405 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -0.972 -25.556 5.170 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -1.571 -23.950 5.531 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -3.538 -25.290 5.583 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -3.600 -24.544 3.998 1.00 0.00 H new ATOM 0 HE ARG A 136 -2.171 -27.088 3.920 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -5.306 -25.517 4.041 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -6.150 -26.852 3.249 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -3.266 -28.797 2.903 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -5.005 -28.693 2.610 1.00 0.00 H new ATOM 2127 N ILE A 137 0.804 -21.833 3.738 1.00 0.00 N ATOM 2128 CA ILE A 137 1.788 -21.059 4.487 1.00 0.00 C ATOM 2129 C ILE A 137 1.476 -19.568 4.388 1.00 0.00 C ATOM 2130 O ILE A 137 1.765 -18.801 5.306 1.00 0.00 O ATOM 2131 CB ILE A 137 3.195 -21.337 3.942 1.00 0.00 C ATOM 2132 CG1 ILE A 137 3.676 -22.703 4.441 1.00 0.00 C ATOM 2133 CG2 ILE A 137 4.165 -20.253 4.424 1.00 0.00 C ATOM 2134 CD1 ILE A 137 2.651 -23.777 4.074 1.00 0.00 C ATOM 0 H ILE A 137 1.166 -22.281 2.897 1.00 0.00 H new ATOM 0 HA ILE A 137 1.745 -21.356 5.535 1.00 0.00 H new ATOM 0 HB ILE A 137 3.162 -21.333 2.852 1.00 0.00 H new ATOM 0 HG12 ILE A 137 4.643 -22.943 3.998 1.00 0.00 H new ATOM 0 HG13 ILE A 137 3.818 -22.677 5.521 1.00 0.00 H new ATOM 0 HG21 ILE A 137 5.162 -20.457 4.033 1.00 0.00 H new ATOM 0 HG22 ILE A 137 3.828 -19.279 4.069 1.00 0.00 H new ATOM 0 HG23 ILE A 137 4.196 -20.251 5.514 1.00 0.00 H new ATOM 0 HD11 ILE A 137 2.997 -24.747 4.431 1.00 0.00 H new ATOM 0 HD12 ILE A 137 1.694 -23.540 4.538 1.00 0.00 H new ATOM 0 HD13 ILE A 137 2.531 -23.810 2.991 1.00 0.00 H new ATOM 2146 N SER A 138 0.891 -19.165 3.265 1.00 0.00 N ATOM 2147 CA SER A 138 0.551 -17.763 3.051 1.00 0.00 C ATOM 2148 C SER A 138 -0.632 -17.348 3.922 1.00 0.00 C ATOM 2149 O SER A 138 -0.505 -16.477 4.782 1.00 0.00 O ATOM 2150 CB SER A 138 0.209 -17.532 1.580 1.00 0.00 C ATOM 2151 OG SER A 138 1.211 -18.126 0.765 1.00 0.00 O ATOM 0 H SER A 138 0.644 -19.785 2.494 1.00 0.00 H new ATOM 0 HA SER A 138 1.414 -17.157 3.328 1.00 0.00 H new ATOM 0 HB2 SER A 138 -0.766 -17.962 1.350 1.00 0.00 H new ATOM 0 HB3 SER A 138 0.143 -16.464 1.374 1.00 0.00 H new ATOM 0 HG SER A 138 1.072 -19.095 0.730 1.00 0.00 H new ATOM 2157 N ARG A 139 -1.784 -17.969 3.688 1.00 0.00 N ATOM 2158 CA ARG A 139 -2.983 -17.645 4.454 1.00 0.00 C ATOM 2159 C ARG A 139 -2.724 -17.785 5.951 1.00 0.00 C ATOM 2160 O ARG A 139 -3.384 -17.141 6.766 1.00 0.00 O ATOM 2161 CB ARG A 139 -4.137 -18.566 4.043 1.00 0.00 C ATOM 2162 CG ARG A 139 -3.686 -20.036 4.109 1.00 0.00 C ATOM 2163 CD ARG A 139 -4.538 -20.797 5.129 1.00 0.00 C ATOM 2164 NE ARG A 139 -5.913 -20.908 4.654 1.00 0.00 N ATOM 2165 CZ ARG A 139 -6.706 -21.892 5.065 1.00 0.00 C ATOM 2166 NH1 ARG A 139 -6.259 -22.781 5.909 1.00 0.00 N ATOM 2167 NH2 ARG A 139 -7.931 -21.969 4.623 1.00 0.00 N ATOM 0 H ARG A 139 -1.913 -18.693 2.981 1.00 0.00 H new ATOM 0 HA ARG A 139 -3.253 -16.611 4.241 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -4.991 -18.409 4.702 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -4.465 -18.323 3.032 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -3.780 -20.499 3.127 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -2.634 -20.091 4.388 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -4.121 -21.791 5.293 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -4.518 -20.280 6.089 1.00 0.00 H new ATOM 0 HE ARG A 139 -6.272 -20.218 3.994 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -5.301 -22.721 6.253 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -6.868 -23.536 6.224 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -8.279 -21.274 3.962 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -8.540 -22.724 4.938 1.00 0.00 H new ATOM 2181 N GLU A 140 -1.759 -18.627 6.308 1.00 0.00 N ATOM 2182 CA GLU A 140 -1.426 -18.835 7.713 1.00 0.00 C ATOM 2183 C GLU A 140 -0.704 -17.613 8.272 1.00 0.00 C ATOM 2184 O GLU A 140 -1.070 -17.092 9.325 1.00 0.00 O ATOM 2185 CB GLU A 140 -0.535 -20.074 7.865 1.00 0.00 C ATOM 2186 CG GLU A 140 -1.406 -21.320 8.047 1.00 0.00 C ATOM 2187 CD GLU A 140 -2.050 -21.308 9.430 1.00 0.00 C ATOM 2188 OE1 GLU A 140 -1.433 -21.811 10.353 1.00 0.00 O ATOM 2189 OE2 GLU A 140 -3.151 -20.795 9.544 1.00 0.00 O ATOM 0 H GLU A 140 -1.199 -19.171 5.652 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.351 -18.987 8.270 1.00 0.00 H new ATOM 0 HB2 GLU A 140 0.099 -20.187 6.986 1.00 0.00 H new ATOM 0 HB3 GLU A 140 0.128 -19.954 8.722 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -2.178 -21.350 7.278 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -0.800 -22.218 7.926 1.00 0.00 H new ATOM 2196 N TRP A 141 0.325 -17.165 7.561 1.00 0.00 N ATOM 2197 CA TRP A 141 1.096 -16.006 7.995 1.00 0.00 C ATOM 2198 C TRP A 141 0.259 -14.735 7.895 1.00 0.00 C ATOM 2199 O TRP A 141 0.604 -13.708 8.474 1.00 0.00 O ATOM 2200 CB TRP A 141 2.353 -15.863 7.132 1.00 0.00 C ATOM 2201 CG TRP A 141 3.370 -16.876 7.554 1.00 0.00 C ATOM 2202 CD1 TRP A 141 3.126 -18.194 7.738 1.00 0.00 C ATOM 2203 CD2 TRP A 141 4.784 -16.677 7.847 1.00 0.00 C ATOM 2204 NE1 TRP A 141 4.300 -18.817 8.124 1.00 0.00 N ATOM 2205 CE2 TRP A 141 5.350 -17.924 8.205 1.00 0.00 C ATOM 2206 CE3 TRP A 141 5.623 -15.547 7.836 1.00 0.00 C ATOM 2207 CZ2 TRP A 141 6.698 -18.046 8.541 1.00 0.00 C ATOM 2208 CZ3 TRP A 141 6.982 -15.667 8.174 1.00 0.00 C ATOM 2209 CH2 TRP A 141 7.518 -16.914 8.525 1.00 0.00 C ATOM 0 H TRP A 141 0.643 -17.584 6.687 1.00 0.00 H new ATOM 0 HA TRP A 141 1.384 -16.154 9.036 1.00 0.00 H new ATOM 0 HB2 TRP A 141 2.102 -16.001 6.080 1.00 0.00 H new ATOM 0 HB3 TRP A 141 2.763 -14.858 7.232 1.00 0.00 H new ATOM 0 HD1 TRP A 141 2.171 -18.681 7.605 1.00 0.00 H new ATOM 0 HE1 TRP A 141 4.380 -19.814 8.324 1.00 0.00 H new ATOM 0 HE3 TRP A 141 5.220 -14.582 7.566 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 7.106 -19.009 8.812 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 7.617 -14.793 8.163 1.00 0.00 H new ATOM 0 HH2 TRP A 141 8.563 -17.000 8.783 1.00 0.00 H new ATOM 2220 N THR A 142 -0.839 -14.806 7.156 1.00 0.00 N ATOM 2221 CA THR A 142 -1.706 -13.646 6.993 1.00 0.00 C ATOM 2222 C THR A 142 -2.350 -13.258 8.322 1.00 0.00 C ATOM 2223 O THR A 142 -2.505 -12.076 8.628 1.00 0.00 O ATOM 2224 CB THR A 142 -2.799 -13.952 5.966 1.00 0.00 C ATOM 2225 OG1 THR A 142 -2.203 -14.458 4.780 1.00 0.00 O ATOM 2226 CG2 THR A 142 -3.574 -12.673 5.644 1.00 0.00 C ATOM 0 H THR A 142 -1.149 -15.644 6.664 1.00 0.00 H new ATOM 0 HA THR A 142 -1.098 -12.812 6.643 1.00 0.00 H new ATOM 0 HB THR A 142 -3.484 -14.695 6.375 1.00 0.00 H new ATOM 0 HG1 THR A 142 -1.400 -13.937 4.570 1.00 0.00 H new ATOM 0 HG21 THR A 142 -4.352 -12.893 4.913 1.00 0.00 H new ATOM 0 HG22 THR A 142 -4.031 -12.286 6.554 1.00 0.00 H new ATOM 0 HG23 THR A 142 -2.892 -11.927 5.235 1.00 0.00 H new ATOM 2234 N GLN A 143 -2.739 -14.261 9.099 1.00 0.00 N ATOM 2235 CA GLN A 143 -3.385 -14.017 10.385 1.00 0.00 C ATOM 2236 C GLN A 143 -2.383 -13.593 11.461 1.00 0.00 C ATOM 2237 O GLN A 143 -2.731 -12.847 12.376 1.00 0.00 O ATOM 2238 CB GLN A 143 -4.115 -15.281 10.842 1.00 0.00 C ATOM 2239 CG GLN A 143 -5.102 -14.928 11.958 1.00 0.00 C ATOM 2240 CD GLN A 143 -6.336 -14.253 11.369 1.00 0.00 C ATOM 2241 OE1 GLN A 143 -6.355 -13.913 10.186 1.00 0.00 O ATOM 2242 NE2 GLN A 143 -7.376 -14.036 12.128 1.00 0.00 N ATOM 0 H GLN A 143 -2.620 -15.246 8.864 1.00 0.00 H new ATOM 0 HA GLN A 143 -4.093 -13.199 10.247 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -4.645 -15.731 10.002 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -3.397 -16.020 11.198 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -5.393 -15.830 12.496 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -4.625 -14.266 12.680 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -7.360 -14.318 13.108 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -8.205 -13.585 11.741 1.00 0.00 H new ATOM 2251 N LYS A 144 -1.152 -14.094 11.374 1.00 0.00 N ATOM 2252 CA LYS A 144 -0.137 -13.772 12.382 1.00 0.00 C ATOM 2253 C LYS A 144 0.850 -12.701 11.907 1.00 0.00 C ATOM 2254 O LYS A 144 1.534 -12.089 12.727 1.00 0.00 O ATOM 2255 CB LYS A 144 0.630 -15.038 12.783 1.00 0.00 C ATOM 2256 CG LYS A 144 1.049 -15.822 11.542 1.00 0.00 C ATOM 2257 CD LYS A 144 1.553 -17.206 11.963 1.00 0.00 C ATOM 2258 CE LYS A 144 2.335 -17.849 10.814 1.00 0.00 C ATOM 2259 NZ LYS A 144 3.111 -19.011 11.333 1.00 0.00 N ATOM 0 H LYS A 144 -0.834 -14.715 10.630 1.00 0.00 H new ATOM 0 HA LYS A 144 -0.667 -13.367 13.244 1.00 0.00 H new ATOM 0 HB2 LYS A 144 1.511 -14.768 13.365 1.00 0.00 H new ATOM 0 HB3 LYS A 144 0.005 -15.662 13.422 1.00 0.00 H new ATOM 0 HG2 LYS A 144 0.205 -15.922 10.859 1.00 0.00 H new ATOM 0 HG3 LYS A 144 1.831 -15.285 11.006 1.00 0.00 H new ATOM 0 HD2 LYS A 144 2.190 -17.118 12.843 1.00 0.00 H new ATOM 0 HD3 LYS A 144 0.711 -17.840 12.241 1.00 0.00 H new ATOM 0 HE2 LYS A 144 1.650 -18.175 10.031 1.00 0.00 H new ATOM 0 HE3 LYS A 144 3.009 -17.119 10.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 3.643 -19.449 10.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 3.774 -18.686 12.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 2.458 -19.710 11.742 1.00 0.00 H new ATOM 2273 N TYR A 145 0.938 -12.477 10.596 1.00 0.00 N ATOM 2274 CA TYR A 145 1.872 -11.472 10.072 1.00 0.00 C ATOM 2275 C TYR A 145 1.181 -10.492 9.124 1.00 0.00 C ATOM 2276 O TYR A 145 1.843 -9.816 8.337 1.00 0.00 O ATOM 2277 CB TYR A 145 3.036 -12.155 9.340 1.00 0.00 C ATOM 2278 CG TYR A 145 4.001 -12.738 10.348 1.00 0.00 C ATOM 2279 CD1 TYR A 145 4.696 -11.893 11.223 1.00 0.00 C ATOM 2280 CD2 TYR A 145 4.201 -14.123 10.408 1.00 0.00 C ATOM 2281 CE1 TYR A 145 5.589 -12.433 12.156 1.00 0.00 C ATOM 2282 CE2 TYR A 145 5.093 -14.662 11.342 1.00 0.00 C ATOM 2283 CZ TYR A 145 5.787 -13.817 12.216 1.00 0.00 C ATOM 2284 OH TYR A 145 6.668 -14.348 13.136 1.00 0.00 O ATOM 0 H TYR A 145 0.389 -12.964 9.888 1.00 0.00 H new ATOM 0 HA TYR A 145 2.252 -10.910 10.925 1.00 0.00 H new ATOM 0 HB2 TYR A 145 2.657 -12.942 8.688 1.00 0.00 H new ATOM 0 HB3 TYR A 145 3.551 -11.435 8.704 1.00 0.00 H new ATOM 0 HD1 TYR A 145 4.543 -10.825 11.178 1.00 0.00 H new ATOM 0 HD2 TYR A 145 3.667 -14.775 9.733 1.00 0.00 H new ATOM 0 HE1 TYR A 145 6.125 -11.781 12.830 1.00 0.00 H new ATOM 0 HE2 TYR A 145 5.246 -15.730 11.388 1.00 0.00 H new ATOM 0 HH TYR A 145 6.687 -15.324 13.045 1.00 0.00 H new ATOM 2294 N ALA A 146 -0.143 -10.404 9.204 1.00 0.00 N ATOM 2295 CA ALA A 146 -0.881 -9.483 8.342 1.00 0.00 C ATOM 2296 C ALA A 146 -2.253 -9.162 8.931 1.00 0.00 C ATOM 2297 O ALA A 146 -3.167 -8.758 8.212 1.00 0.00 O ATOM 2298 CB ALA A 146 -1.040 -10.083 6.942 1.00 0.00 C ATOM 0 H ALA A 146 -0.720 -10.948 9.845 1.00 0.00 H new ATOM 0 HA ALA A 146 -0.313 -8.555 8.272 1.00 0.00 H new ATOM 0 HB1 ALA A 146 -1.591 -9.388 6.309 1.00 0.00 H new ATOM 0 HB2 ALA A 146 -0.056 -10.265 6.510 1.00 0.00 H new ATOM 0 HB3 ALA A 146 -1.586 -11.024 7.009 1.00 0.00 H new ATOM 2304 N MET A 147 -2.386 -9.337 10.243 1.00 0.00 N ATOM 2305 CA MET A 147 -3.650 -9.055 10.922 1.00 0.00 C ATOM 2306 C MET A 147 -3.390 -8.509 12.323 1.00 0.00 C ATOM 2307 O MET A 147 -3.146 -9.308 13.213 1.00 0.00 O ATOM 2308 CB MET A 147 -4.493 -10.331 11.019 1.00 0.00 C ATOM 2309 CG MET A 147 -5.179 -10.605 9.678 1.00 0.00 C ATOM 2310 SD MET A 147 -6.445 -9.347 9.376 1.00 0.00 S ATOM 2311 CE MET A 147 -7.061 -10.016 7.812 1.00 0.00 C ATOM 2312 OXT MET A 147 -3.439 -7.301 12.485 1.00 0.00 O ATOM 0 H MET A 147 -1.641 -9.670 10.855 1.00 0.00 H new ATOM 0 HA MET A 147 -4.193 -8.308 10.343 1.00 0.00 H new ATOM 0 HB2 MET A 147 -3.860 -11.175 11.293 1.00 0.00 H new ATOM 0 HB3 MET A 147 -5.241 -10.225 11.805 1.00 0.00 H new ATOM 0 HG2 MET A 147 -4.444 -10.596 8.873 1.00 0.00 H new ATOM 0 HG3 MET A 147 -5.632 -11.597 9.685 1.00 0.00 H new ATOM 0 HE1 MET A 147 -7.865 -9.383 7.437 1.00 0.00 H new ATOM 0 HE2 MET A 147 -6.251 -10.043 7.084 1.00 0.00 H new ATOM 0 HE3 MET A 147 -7.439 -11.026 7.972 1.00 0.00 H new ATOM 2323 N MET B 1 -19.997 19.866 5.439 1.00 0.00 N ATOM 2324 CA MET B 1 -18.719 19.420 4.816 1.00 0.00 C ATOM 2325 C MET B 1 -19.012 18.349 3.771 1.00 0.00 C ATOM 2326 O MET B 1 -20.055 17.695 3.811 1.00 0.00 O ATOM 2327 CB MET B 1 -17.795 18.857 5.899 1.00 0.00 C ATOM 2328 CG MET B 1 -16.560 18.230 5.248 1.00 0.00 C ATOM 2329 SD MET B 1 -15.344 17.826 6.526 1.00 0.00 S ATOM 2330 CE MET B 1 -14.482 19.416 6.527 1.00 0.00 C ATOM 0 H1 MET B 1 -20.299 20.763 5.007 1.00 0.00 H new ATOM 0 H2 MET B 1 -20.729 19.143 5.285 1.00 0.00 H new ATOM 0 H3 MET B 1 -19.856 20.004 6.460 1.00 0.00 H new ATOM 0 HA MET B 1 -18.229 20.266 4.333 1.00 0.00 H new ATOM 0 HB2 MET B 1 -17.494 19.651 6.583 1.00 0.00 H new ATOM 0 HB3 MET B 1 -18.325 18.110 6.491 1.00 0.00 H new ATOM 0 HG2 MET B 1 -16.841 17.330 4.701 1.00 0.00 H new ATOM 0 HG3 MET B 1 -16.127 18.921 4.524 1.00 0.00 H new ATOM 0 HE1 MET B 1 -13.674 19.391 7.258 1.00 0.00 H new ATOM 0 HE2 MET B 1 -14.069 19.607 5.536 1.00 0.00 H new ATOM 0 HE3 MET B 1 -15.183 20.210 6.787 1.00 0.00 H new ATOM 2342 N GLN B 2 -18.082 18.175 2.838 1.00 0.00 N ATOM 2343 CA GLN B 2 -18.243 17.180 1.784 1.00 0.00 C ATOM 2344 C GLN B 2 -16.893 16.839 1.166 1.00 0.00 C ATOM 2345 O GLN B 2 -16.072 17.722 0.920 1.00 0.00 O ATOM 2346 CB GLN B 2 -19.182 17.712 0.700 1.00 0.00 C ATOM 2347 CG GLN B 2 -19.604 16.564 -0.219 1.00 0.00 C ATOM 2348 CD GLN B 2 -20.204 17.119 -1.506 1.00 0.00 C ATOM 2349 OE1 GLN B 2 -21.312 16.745 -1.888 1.00 0.00 O ATOM 2350 NE2 GLN B 2 -19.532 17.996 -2.201 1.00 0.00 N ATOM 0 H GLN B 2 -17.213 18.707 2.790 1.00 0.00 H new ATOM 0 HA GLN B 2 -18.671 16.278 2.222 1.00 0.00 H new ATOM 0 HB2 GLN B 2 -20.060 18.168 1.157 1.00 0.00 H new ATOM 0 HB3 GLN B 2 -18.683 18.490 0.122 1.00 0.00 H new ATOM 0 HG2 GLN B 2 -18.743 15.937 -0.450 1.00 0.00 H new ATOM 0 HG3 GLN B 2 -20.332 15.931 0.288 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -18.614 18.304 -1.882 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -19.925 18.373 -3.063 1.00 0.00 H new ATOM 2359 N ILE B 3 -16.670 15.553 0.911 1.00 0.00 N ATOM 2360 CA ILE B 3 -15.413 15.108 0.315 1.00 0.00 C ATOM 2361 C ILE B 3 -15.641 13.891 -0.576 1.00 0.00 C ATOM 2362 O ILE B 3 -16.703 13.270 -0.537 1.00 0.00 O ATOM 2363 CB ILE B 3 -14.383 14.774 1.404 1.00 0.00 C ATOM 2364 CG1 ILE B 3 -14.768 13.475 2.132 1.00 0.00 C ATOM 2365 CG2 ILE B 3 -14.309 15.922 2.414 1.00 0.00 C ATOM 2366 CD1 ILE B 3 -16.179 13.585 2.717 1.00 0.00 C ATOM 0 H ILE B 3 -17.337 14.806 1.105 1.00 0.00 H new ATOM 0 HA ILE B 3 -15.024 15.923 -0.296 1.00 0.00 H new ATOM 0 HB ILE B 3 -13.410 14.637 0.931 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -14.720 12.635 1.439 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -14.053 13.272 2.929 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -13.577 15.682 3.185 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -14.010 16.837 1.903 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -15.287 16.066 2.874 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -16.434 12.657 3.228 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -16.215 14.412 3.426 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -16.893 13.765 1.913 1.00 0.00 H new ATOM 2378 N PHE B 4 -14.637 13.560 -1.384 1.00 0.00 N ATOM 2379 CA PHE B 4 -14.736 12.420 -2.289 1.00 0.00 C ATOM 2380 C PHE B 4 -14.150 11.166 -1.648 1.00 0.00 C ATOM 2381 O PHE B 4 -13.194 11.239 -0.877 1.00 0.00 O ATOM 2382 CB PHE B 4 -13.989 12.723 -3.590 1.00 0.00 C ATOM 2383 CG PHE B 4 -14.649 13.887 -4.289 1.00 0.00 C ATOM 2384 CD1 PHE B 4 -15.702 13.661 -5.184 1.00 0.00 C ATOM 2385 CD2 PHE B 4 -14.208 15.193 -4.042 1.00 0.00 C ATOM 2386 CE1 PHE B 4 -16.313 14.741 -5.832 1.00 0.00 C ATOM 2387 CE2 PHE B 4 -14.820 16.272 -4.690 1.00 0.00 C ATOM 2388 CZ PHE B 4 -15.873 16.047 -5.585 1.00 0.00 C ATOM 0 H PHE B 4 -13.750 14.062 -1.430 1.00 0.00 H new ATOM 0 HA PHE B 4 -15.790 12.244 -2.503 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -12.946 12.957 -3.377 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -13.994 11.846 -4.237 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -16.043 12.654 -5.374 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -13.396 15.367 -3.352 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -17.124 14.567 -6.523 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -14.480 17.279 -4.500 1.00 0.00 H new ATOM 0 HZ PHE B 4 -16.345 16.880 -6.084 1.00 0.00 H new ATOM 2398 N VAL B 5 -14.733 10.016 -1.978 1.00 0.00 N ATOM 2399 CA VAL B 5 -14.269 8.741 -1.437 1.00 0.00 C ATOM 2400 C VAL B 5 -13.905 7.786 -2.569 1.00 0.00 C ATOM 2401 O VAL B 5 -14.782 7.202 -3.207 1.00 0.00 O ATOM 2402 CB VAL B 5 -15.363 8.116 -0.571 1.00 0.00 C ATOM 2403 CG1 VAL B 5 -14.904 6.743 -0.078 1.00 0.00 C ATOM 2404 CG2 VAL B 5 -15.638 9.022 0.631 1.00 0.00 C ATOM 0 H VAL B 5 -15.526 9.941 -2.616 1.00 0.00 H new ATOM 0 HA VAL B 5 -13.383 8.922 -0.828 1.00 0.00 H new ATOM 0 HB VAL B 5 -16.273 8.004 -1.160 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -15.685 6.298 0.539 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -14.706 6.097 -0.933 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -13.994 6.854 0.512 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -16.418 8.578 1.250 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -14.727 9.133 1.219 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -15.965 10.001 0.281 1.00 0.00 H new ATOM 2414 N LYS B 6 -12.608 7.635 -2.815 1.00 0.00 N ATOM 2415 CA LYS B 6 -12.136 6.750 -3.875 1.00 0.00 C ATOM 2416 C LYS B 6 -12.073 5.308 -3.379 1.00 0.00 C ATOM 2417 O LYS B 6 -11.712 5.053 -2.230 1.00 0.00 O ATOM 2418 CB LYS B 6 -10.746 7.192 -4.342 1.00 0.00 C ATOM 2419 CG LYS B 6 -10.383 6.477 -5.651 1.00 0.00 C ATOM 2420 CD LYS B 6 -10.949 7.254 -6.844 1.00 0.00 C ATOM 2421 CE LYS B 6 -10.460 6.619 -8.148 1.00 0.00 C ATOM 2422 NZ LYS B 6 -9.051 7.032 -8.402 1.00 0.00 N ATOM 0 H LYS B 6 -11.868 8.111 -2.298 1.00 0.00 H new ATOM 0 HA LYS B 6 -12.835 6.806 -4.709 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -10.729 8.272 -4.490 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -10.006 6.964 -3.575 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -9.300 6.393 -5.741 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -10.782 5.463 -5.644 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -12.038 7.248 -6.811 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -10.634 8.296 -6.795 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -10.526 5.533 -8.084 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -11.096 6.929 -8.977 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -8.568 6.296 -8.956 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -9.042 7.927 -8.932 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -8.558 7.161 -7.495 1.00 0.00 H new ATOM 2436 N THR B 7 -12.425 4.370 -4.254 1.00 0.00 N ATOM 2437 CA THR B 7 -12.406 2.951 -3.901 1.00 0.00 C ATOM 2438 C THR B 7 -11.478 2.182 -4.837 1.00 0.00 C ATOM 2439 O THR B 7 -11.157 2.649 -5.930 1.00 0.00 O ATOM 2440 CB THR B 7 -13.823 2.373 -3.994 1.00 0.00 C ATOM 2441 OG1 THR B 7 -14.755 3.334 -3.518 1.00 0.00 O ATOM 2442 CG2 THR B 7 -13.921 1.103 -3.145 1.00 0.00 C ATOM 0 H THR B 7 -12.726 4.564 -5.209 1.00 0.00 H new ATOM 0 HA THR B 7 -12.039 2.851 -2.880 1.00 0.00 H new ATOM 0 HB THR B 7 -14.046 2.129 -5.033 1.00 0.00 H new ATOM 0 HG1 THR B 7 -14.929 3.996 -4.219 1.00 0.00 H new ATOM 0 HG21 THR B 7 -14.930 0.696 -3.214 1.00 0.00 H new ATOM 0 HG22 THR B 7 -13.206 0.365 -3.510 1.00 0.00 H new ATOM 0 HG23 THR B 7 -13.697 1.342 -2.105 1.00 0.00 H new ATOM 2450 N LEU B 8 -11.051 1.002 -4.401 1.00 0.00 N ATOM 2451 CA LEU B 8 -10.160 0.177 -5.208 1.00 0.00 C ATOM 2452 C LEU B 8 -10.866 -0.290 -6.478 1.00 0.00 C ATOM 2453 O LEU B 8 -10.221 -0.619 -7.473 1.00 0.00 O ATOM 2454 CB LEU B 8 -9.700 -1.040 -4.398 1.00 0.00 C ATOM 2455 CG LEU B 8 -8.422 -1.627 -5.016 1.00 0.00 C ATOM 2456 CD1 LEU B 8 -7.194 -0.926 -4.428 1.00 0.00 C ATOM 2457 CD2 LEU B 8 -8.345 -3.124 -4.705 1.00 0.00 C ATOM 0 H LEU B 8 -11.305 0.598 -3.500 1.00 0.00 H new ATOM 0 HA LEU B 8 -9.293 0.776 -5.488 1.00 0.00 H new ATOM 0 HB2 LEU B 8 -9.514 -0.750 -3.364 1.00 0.00 H new ATOM 0 HB3 LEU B 8 -10.486 -1.795 -4.381 1.00 0.00 H new ATOM 0 HG LEU B 8 -8.444 -1.476 -6.095 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -6.290 -1.345 -4.869 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -7.244 0.140 -4.648 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -7.173 -1.073 -3.348 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -7.438 -3.541 -5.144 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -8.326 -3.271 -3.625 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -9.216 -3.628 -5.125 1.00 0.00 H new ATOM 2469 N THR B 9 -12.195 -0.317 -6.435 1.00 0.00 N ATOM 2470 CA THR B 9 -12.978 -0.747 -7.588 1.00 0.00 C ATOM 2471 C THR B 9 -13.093 0.381 -8.609 1.00 0.00 C ATOM 2472 O THR B 9 -13.746 0.232 -9.642 1.00 0.00 O ATOM 2473 CB THR B 9 -14.377 -1.175 -7.140 1.00 0.00 C ATOM 2474 OG1 THR B 9 -15.101 -0.035 -6.699 1.00 0.00 O ATOM 2475 CG2 THR B 9 -14.262 -2.182 -5.995 1.00 0.00 C ATOM 0 H THR B 9 -12.748 -0.049 -5.621 1.00 0.00 H new ATOM 0 HA THR B 9 -12.470 -1.593 -8.052 1.00 0.00 H new ATOM 0 HB THR B 9 -14.901 -1.637 -7.977 1.00 0.00 H new ATOM 0 HG1 THR B 9 -15.998 -0.307 -6.413 1.00 0.00 H new ATOM 0 HG21 THR B 9 -15.259 -2.486 -5.677 1.00 0.00 H new ATOM 0 HG22 THR B 9 -13.707 -3.057 -6.334 1.00 0.00 H new ATOM 0 HG23 THR B 9 -13.738 -1.722 -5.157 1.00 0.00 H new ATOM 2483 N GLY B 10 -12.454 1.508 -8.313 1.00 0.00 N ATOM 2484 CA GLY B 10 -12.490 2.656 -9.212 1.00 0.00 C ATOM 2485 C GLY B 10 -13.725 3.511 -8.953 1.00 0.00 C ATOM 2486 O GLY B 10 -13.969 4.494 -9.652 1.00 0.00 O ATOM 0 H GLY B 10 -11.908 1.651 -7.463 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -11.591 3.258 -9.076 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -12.491 2.313 -10.247 1.00 0.00 H new ATOM 2490 N LYS B 11 -14.502 3.130 -7.943 1.00 0.00 N ATOM 2491 CA LYS B 11 -15.710 3.871 -7.602 1.00 0.00 C ATOM 2492 C LYS B 11 -15.357 5.166 -6.877 1.00 0.00 C ATOM 2493 O LYS B 11 -14.520 5.178 -5.974 1.00 0.00 O ATOM 2494 CB LYS B 11 -16.617 3.014 -6.710 1.00 0.00 C ATOM 2495 CG LYS B 11 -17.953 3.735 -6.465 1.00 0.00 C ATOM 2496 CD LYS B 11 -18.945 3.389 -7.580 1.00 0.00 C ATOM 2497 CE LYS B 11 -20.049 4.449 -7.632 1.00 0.00 C ATOM 2498 NZ LYS B 11 -21.036 4.086 -8.688 1.00 0.00 N ATOM 0 H LYS B 11 -14.318 2.320 -7.352 1.00 0.00 H new ATOM 0 HA LYS B 11 -16.236 4.116 -8.525 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -16.797 2.049 -7.183 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -16.122 2.816 -5.759 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -18.362 3.442 -5.498 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -17.793 4.813 -6.430 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -18.428 3.340 -8.538 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -19.379 2.405 -7.402 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -20.545 4.520 -6.664 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -19.618 5.428 -7.842 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -21.786 4.805 -8.724 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -20.557 4.039 -9.610 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -21.455 3.160 -8.468 1.00 0.00 H new ATOM 2512 N THR B 12 -16.011 6.252 -7.276 1.00 0.00 N ATOM 2513 CA THR B 12 -15.776 7.554 -6.660 1.00 0.00 C ATOM 2514 C THR B 12 -17.107 8.233 -6.361 1.00 0.00 C ATOM 2515 O THR B 12 -17.807 8.676 -7.272 1.00 0.00 O ATOM 2516 CB THR B 12 -14.946 8.436 -7.598 1.00 0.00 C ATOM 2517 OG1 THR B 12 -13.892 7.666 -8.159 1.00 0.00 O ATOM 2518 CG2 THR B 12 -14.361 9.612 -6.814 1.00 0.00 C ATOM 0 H THR B 12 -16.707 6.257 -8.022 1.00 0.00 H new ATOM 0 HA THR B 12 -15.228 7.410 -5.728 1.00 0.00 H new ATOM 0 HB THR B 12 -15.583 8.817 -8.396 1.00 0.00 H new ATOM 0 HG1 THR B 12 -13.361 8.228 -8.761 1.00 0.00 H new ATOM 0 HG21 THR B 12 -13.771 10.238 -7.483 1.00 0.00 H new ATOM 0 HG22 THR B 12 -15.171 10.202 -6.385 1.00 0.00 H new ATOM 0 HG23 THR B 12 -13.724 9.235 -6.014 1.00 0.00 H new ATOM 2526 N ILE B 13 -17.458 8.299 -5.080 1.00 0.00 N ATOM 2527 CA ILE B 13 -18.718 8.914 -4.669 1.00 0.00 C ATOM 2528 C ILE B 13 -18.491 9.900 -3.527 1.00 0.00 C ATOM 2529 O ILE B 13 -17.646 9.677 -2.660 1.00 0.00 O ATOM 2530 CB ILE B 13 -19.694 7.827 -4.220 1.00 0.00 C ATOM 2531 CG1 ILE B 13 -21.068 8.447 -3.956 1.00 0.00 C ATOM 2532 CG2 ILE B 13 -19.177 7.173 -2.938 1.00 0.00 C ATOM 2533 CD1 ILE B 13 -22.046 7.348 -3.536 1.00 0.00 C ATOM 0 H ILE B 13 -16.892 7.937 -4.312 1.00 0.00 H new ATOM 0 HA ILE B 13 -19.134 9.456 -5.518 1.00 0.00 H new ATOM 0 HB ILE B 13 -19.780 7.074 -5.004 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -20.995 9.203 -3.174 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -21.431 8.950 -4.852 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -19.874 6.398 -2.618 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -18.200 6.728 -3.125 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -19.089 7.926 -2.155 1.00 0.00 H new ATOM 0 HD11 ILE B 13 -23.026 7.786 -3.347 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -22.126 6.609 -4.333 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -21.683 6.865 -2.629 1.00 0.00 H new ATOM 2545 N THR B 14 -19.254 10.988 -3.532 1.00 0.00 N ATOM 2546 CA THR B 14 -19.130 12.000 -2.490 1.00 0.00 C ATOM 2547 C THR B 14 -19.780 11.517 -1.199 1.00 0.00 C ATOM 2548 O THR B 14 -20.779 10.797 -1.226 1.00 0.00 O ATOM 2549 CB THR B 14 -19.790 13.305 -2.940 1.00 0.00 C ATOM 2550 OG1 THR B 14 -21.135 13.047 -3.318 1.00 0.00 O ATOM 2551 CG2 THR B 14 -19.024 13.881 -4.131 1.00 0.00 C ATOM 0 H THR B 14 -19.959 11.191 -4.240 1.00 0.00 H new ATOM 0 HA THR B 14 -18.070 12.178 -2.308 1.00 0.00 H new ATOM 0 HB THR B 14 -19.774 14.023 -2.120 1.00 0.00 H new ATOM 0 HG1 THR B 14 -21.560 13.882 -3.605 1.00 0.00 H new ATOM 0 HG21 THR B 14 -19.495 14.811 -4.451 1.00 0.00 H new ATOM 0 HG22 THR B 14 -17.992 14.078 -3.839 1.00 0.00 H new ATOM 0 HG23 THR B 14 -19.038 13.165 -4.953 1.00 0.00 H new ATOM 2559 N LEU B 15 -19.205 11.918 -0.069 1.00 0.00 N ATOM 2560 CA LEU B 15 -19.729 11.524 1.236 1.00 0.00 C ATOM 2561 C LEU B 15 -20.072 12.763 2.058 1.00 0.00 C ATOM 2562 O LEU B 15 -19.223 13.630 2.275 1.00 0.00 O ATOM 2563 CB LEU B 15 -18.674 10.682 1.974 1.00 0.00 C ATOM 2564 CG LEU B 15 -19.327 9.785 3.038 1.00 0.00 C ATOM 2565 CD1 LEU B 15 -20.085 10.641 4.059 1.00 0.00 C ATOM 2566 CD2 LEU B 15 -20.293 8.794 2.373 1.00 0.00 C ATOM 0 H LEU B 15 -18.378 12.514 -0.030 1.00 0.00 H new ATOM 0 HA LEU B 15 -20.635 10.934 1.098 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -18.130 10.066 1.258 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -17.945 11.340 2.446 1.00 0.00 H new ATOM 0 HG LEU B 15 -18.544 9.229 3.553 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -20.543 9.994 4.807 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -19.391 11.325 4.547 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -20.861 11.213 3.550 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -20.750 8.164 3.136 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -21.071 9.344 1.843 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -19.745 8.170 1.667 1.00 0.00 H new ATOM 2578 N GLU B 16 -21.317 12.836 2.520 1.00 0.00 N ATOM 2579 CA GLU B 16 -21.759 13.967 3.328 1.00 0.00 C ATOM 2580 C GLU B 16 -21.392 13.734 4.789 1.00 0.00 C ATOM 2581 O GLU B 16 -21.735 12.703 5.366 1.00 0.00 O ATOM 2582 CB GLU B 16 -23.274 14.145 3.199 1.00 0.00 C ATOM 2583 CG GLU B 16 -23.641 14.354 1.728 1.00 0.00 C ATOM 2584 CD GLU B 16 -25.064 14.891 1.616 1.00 0.00 C ATOM 2585 OE1 GLU B 16 -25.919 14.403 2.337 1.00 0.00 O ATOM 2586 OE2 GLU B 16 -25.279 15.781 0.809 1.00 0.00 O ATOM 0 H GLU B 16 -22.033 12.130 2.350 1.00 0.00 H new ATOM 0 HA GLU B 16 -21.263 14.870 2.972 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -23.788 13.268 3.592 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -23.602 14.999 3.791 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -22.943 15.052 1.266 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -23.555 13.412 1.186 1.00 0.00 H new ATOM 2593 N VAL B 17 -20.682 14.689 5.380 1.00 0.00 N ATOM 2594 CA VAL B 17 -20.264 14.562 6.772 1.00 0.00 C ATOM 2595 C VAL B 17 -20.166 15.933 7.436 1.00 0.00 C ATOM 2596 O VAL B 17 -20.323 16.962 6.779 1.00 0.00 O ATOM 2597 CB VAL B 17 -18.905 13.860 6.831 1.00 0.00 C ATOM 2598 CG1 VAL B 17 -17.846 14.743 6.167 1.00 0.00 C ATOM 2599 CG2 VAL B 17 -18.514 13.602 8.290 1.00 0.00 C ATOM 0 H VAL B 17 -20.386 15.551 4.923 1.00 0.00 H new ATOM 0 HA VAL B 17 -21.008 13.973 7.309 1.00 0.00 H new ATOM 0 HB VAL B 17 -18.970 12.908 6.304 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -16.878 14.244 6.209 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -18.119 14.919 5.127 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -17.786 15.696 6.692 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -17.546 13.102 8.324 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -18.452 14.551 8.823 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -19.266 12.969 8.762 1.00 0.00 H new ATOM 2609 N GLU B 18 -19.904 15.937 8.741 1.00 0.00 N ATOM 2610 CA GLU B 18 -19.782 17.185 9.491 1.00 0.00 C ATOM 2611 C GLU B 18 -18.517 17.163 10.355 1.00 0.00 C ATOM 2612 O GLU B 18 -18.156 16.121 10.900 1.00 0.00 O ATOM 2613 CB GLU B 18 -21.009 17.376 10.386 1.00 0.00 C ATOM 2614 CG GLU B 18 -22.238 17.646 9.516 1.00 0.00 C ATOM 2615 CD GLU B 18 -23.508 17.507 10.349 1.00 0.00 C ATOM 2616 OE1 GLU B 18 -23.846 16.387 10.695 1.00 0.00 O ATOM 2617 OE2 GLU B 18 -24.123 18.523 10.629 1.00 0.00 O ATOM 0 H GLU B 18 -19.773 15.094 9.299 1.00 0.00 H new ATOM 0 HA GLU B 18 -19.716 18.012 8.784 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -21.170 16.487 10.995 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -20.846 18.207 11.072 1.00 0.00 H new ATOM 0 HG2 GLU B 18 -22.180 18.648 9.091 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -22.263 16.946 8.680 1.00 0.00 H new ATOM 2624 N PRO B 19 -17.840 18.279 10.489 1.00 0.00 N ATOM 2625 CA PRO B 19 -16.594 18.368 11.308 1.00 0.00 C ATOM 2626 C PRO B 19 -16.727 17.672 12.664 1.00 0.00 C ATOM 2627 O PRO B 19 -15.760 17.109 13.179 1.00 0.00 O ATOM 2628 CB PRO B 19 -16.391 19.874 11.493 1.00 0.00 C ATOM 2629 CG PRO B 19 -17.048 20.512 10.313 1.00 0.00 C ATOM 2630 CD PRO B 19 -18.181 19.577 9.876 1.00 0.00 C ATOM 0 HA PRO B 19 -15.756 17.869 10.820 1.00 0.00 H new ATOM 0 HB2 PRO B 19 -16.838 20.219 12.425 1.00 0.00 H new ATOM 0 HB3 PRO B 19 -15.331 20.125 11.536 1.00 0.00 H new ATOM 0 HG2 PRO B 19 -17.438 21.496 10.573 1.00 0.00 H new ATOM 0 HG3 PRO B 19 -16.332 20.656 9.504 1.00 0.00 H new ATOM 0 HD2 PRO B 19 -19.150 19.938 10.221 1.00 0.00 H new ATOM 0 HD3 PRO B 19 -18.238 19.501 8.790 1.00 0.00 H new ATOM 2638 N SER B 20 -17.924 17.723 13.241 1.00 0.00 N ATOM 2639 CA SER B 20 -18.164 17.102 14.543 1.00 0.00 C ATOM 2640 C SER B 20 -18.492 15.620 14.391 1.00 0.00 C ATOM 2641 O SER B 20 -18.853 14.953 15.360 1.00 0.00 O ATOM 2642 CB SER B 20 -19.317 17.810 15.253 1.00 0.00 C ATOM 2643 OG SER B 20 -20.415 17.931 14.359 1.00 0.00 O ATOM 0 H SER B 20 -18.738 18.183 12.833 1.00 0.00 H new ATOM 0 HA SER B 20 -17.254 17.196 15.136 1.00 0.00 H new ATOM 0 HB2 SER B 20 -19.614 17.248 16.138 1.00 0.00 H new ATOM 0 HB3 SER B 20 -19.000 18.796 15.593 1.00 0.00 H new ATOM 0 HG SER B 20 -21.157 18.383 14.812 1.00 0.00 H new ATOM 2649 N ASP B 21 -18.366 15.112 13.171 1.00 0.00 N ATOM 2650 CA ASP B 21 -18.653 13.706 12.907 1.00 0.00 C ATOM 2651 C ASP B 21 -17.448 12.839 13.258 1.00 0.00 C ATOM 2652 O ASP B 21 -16.308 13.194 12.959 1.00 0.00 O ATOM 2653 CB ASP B 21 -19.006 13.515 11.432 1.00 0.00 C ATOM 2654 CG ASP B 21 -19.692 12.169 11.228 1.00 0.00 C ATOM 2655 OD1 ASP B 21 -19.208 11.191 11.774 1.00 0.00 O ATOM 2656 OD2 ASP B 21 -20.692 12.135 10.530 1.00 0.00 O ATOM 0 H ASP B 21 -18.070 15.647 12.355 1.00 0.00 H new ATOM 0 HA ASP B 21 -19.498 13.404 13.526 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -19.661 14.320 11.100 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -18.103 13.568 10.824 1.00 0.00 H new ATOM 2661 N THR B 22 -17.707 11.699 13.892 1.00 0.00 N ATOM 2662 CA THR B 22 -16.633 10.787 14.276 1.00 0.00 C ATOM 2663 C THR B 22 -16.431 9.721 13.205 1.00 0.00 C ATOM 2664 O THR B 22 -17.395 9.219 12.627 1.00 0.00 O ATOM 2665 CB THR B 22 -16.969 10.116 15.611 1.00 0.00 C ATOM 2666 OG1 THR B 22 -17.527 11.078 16.495 1.00 0.00 O ATOM 2667 CG2 THR B 22 -15.696 9.531 16.226 1.00 0.00 C ATOM 0 H THR B 22 -18.643 11.386 14.149 1.00 0.00 H new ATOM 0 HA THR B 22 -15.712 11.361 14.381 1.00 0.00 H new ATOM 0 HB THR B 22 -17.689 9.315 15.444 1.00 0.00 H new ATOM 0 HG1 THR B 22 -17.744 10.650 17.349 1.00 0.00 H new ATOM 0 HG21 THR B 22 -15.937 9.054 17.176 1.00 0.00 H new ATOM 0 HG22 THR B 22 -15.270 8.793 15.547 1.00 0.00 H new ATOM 0 HG23 THR B 22 -14.973 10.329 16.394 1.00 0.00 H new ATOM 2675 N ILE B 23 -15.173 9.379 12.946 1.00 0.00 N ATOM 2676 CA ILE B 23 -14.857 8.370 11.940 1.00 0.00 C ATOM 2677 C ILE B 23 -15.815 7.186 12.046 1.00 0.00 C ATOM 2678 O ILE B 23 -16.398 6.759 11.051 1.00 0.00 O ATOM 2679 CB ILE B 23 -13.418 7.880 12.123 1.00 0.00 C ATOM 2680 CG1 ILE B 23 -12.445 9.065 12.023 1.00 0.00 C ATOM 2681 CG2 ILE B 23 -13.083 6.849 11.044 1.00 0.00 C ATOM 2682 CD1 ILE B 23 -12.636 9.802 10.692 1.00 0.00 C ATOM 0 H ILE B 23 -14.361 9.782 13.414 1.00 0.00 H new ATOM 0 HA ILE B 23 -14.965 8.823 10.955 1.00 0.00 H new ATOM 0 HB ILE B 23 -13.321 7.419 13.106 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -12.611 9.751 12.853 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -11.418 8.709 12.105 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -12.058 6.503 11.177 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -13.765 6.003 11.125 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -13.186 7.306 10.060 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -11.940 10.639 10.636 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -12.446 9.116 9.866 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -13.658 10.175 10.626 1.00 0.00 H new ATOM 2694 N GLU B 24 -15.973 6.661 13.256 1.00 0.00 N ATOM 2695 CA GLU B 24 -16.862 5.524 13.473 1.00 0.00 C ATOM 2696 C GLU B 24 -18.221 5.766 12.821 1.00 0.00 C ATOM 2697 O GLU B 24 -18.830 4.844 12.279 1.00 0.00 O ATOM 2698 CB GLU B 24 -17.050 5.286 14.974 1.00 0.00 C ATOM 2699 CG GLU B 24 -15.820 4.574 15.539 1.00 0.00 C ATOM 2700 CD GLU B 24 -15.829 3.108 15.122 1.00 0.00 C ATOM 2701 OE1 GLU B 24 -15.307 2.811 14.059 1.00 0.00 O ATOM 2702 OE2 GLU B 24 -16.357 2.302 15.870 1.00 0.00 O ATOM 0 H GLU B 24 -15.502 7.000 14.095 1.00 0.00 H new ATOM 0 HA GLU B 24 -16.408 4.644 13.018 1.00 0.00 H new ATOM 0 HB2 GLU B 24 -17.200 6.236 15.487 1.00 0.00 H new ATOM 0 HB3 GLU B 24 -17.942 4.685 15.148 1.00 0.00 H new ATOM 0 HG2 GLU B 24 -14.912 5.058 15.179 1.00 0.00 H new ATOM 0 HG3 GLU B 24 -15.812 4.651 16.626 1.00 0.00 H new ATOM 2709 N ASN B 25 -18.692 7.008 12.877 1.00 0.00 N ATOM 2710 CA ASN B 25 -19.983 7.350 12.287 1.00 0.00 C ATOM 2711 C ASN B 25 -19.856 7.526 10.775 1.00 0.00 C ATOM 2712 O ASN B 25 -20.710 7.070 10.015 1.00 0.00 O ATOM 2713 CB ASN B 25 -20.521 8.641 12.914 1.00 0.00 C ATOM 2714 CG ASN B 25 -21.254 8.327 14.215 1.00 0.00 C ATOM 2715 OD1 ASN B 25 -21.086 7.166 14.785 1.00 0.00 O flip ATOM 2716 ND2 ASN B 25 -22.002 9.163 14.724 1.00 0.00 N flip ATOM 0 H ASN B 25 -18.206 7.788 13.320 1.00 0.00 H new ATOM 0 HA ASN B 25 -20.678 6.534 12.486 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -19.699 9.330 13.108 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -21.196 9.138 12.218 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -22.132 10.070 14.277 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -22.491 8.948 15.593 1.00 0.00 H new ATOM 2723 N VAL B 26 -18.789 8.192 10.345 1.00 0.00 N ATOM 2724 CA VAL B 26 -18.571 8.422 8.921 1.00 0.00 C ATOM 2725 C VAL B 26 -18.634 7.107 8.150 1.00 0.00 C ATOM 2726 O VAL B 26 -19.249 7.032 7.086 1.00 0.00 O ATOM 2727 CB VAL B 26 -17.209 9.084 8.699 1.00 0.00 C ATOM 2728 CG1 VAL B 26 -17.049 9.443 7.219 1.00 0.00 C ATOM 2729 CG2 VAL B 26 -17.117 10.359 9.544 1.00 0.00 C ATOM 0 H VAL B 26 -18.068 8.578 10.955 1.00 0.00 H new ATOM 0 HA VAL B 26 -19.357 9.082 8.555 1.00 0.00 H new ATOM 0 HB VAL B 26 -16.419 8.393 8.993 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -16.079 9.914 7.062 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -17.114 8.537 6.616 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -17.840 10.133 6.924 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -16.147 10.831 9.386 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -17.908 11.049 9.250 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -17.230 10.106 10.598 1.00 0.00 H new ATOM 2739 N LYS B 27 -17.999 6.073 8.690 1.00 0.00 N ATOM 2740 CA LYS B 27 -17.998 4.770 8.036 1.00 0.00 C ATOM 2741 C LYS B 27 -19.422 4.244 7.913 1.00 0.00 C ATOM 2742 O LYS B 27 -19.754 3.536 6.963 1.00 0.00 O ATOM 2743 CB LYS B 27 -17.147 3.777 8.832 1.00 0.00 C ATOM 2744 CG LYS B 27 -15.720 4.319 8.987 1.00 0.00 C ATOM 2745 CD LYS B 27 -14.994 4.309 7.627 1.00 0.00 C ATOM 2746 CE LYS B 27 -14.722 5.746 7.160 1.00 0.00 C ATOM 2747 NZ LYS B 27 -15.943 6.581 7.341 1.00 0.00 N ATOM 0 H LYS B 27 -17.484 6.110 9.569 1.00 0.00 H new ATOM 0 HA LYS B 27 -17.572 4.883 7.039 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -17.590 3.610 9.814 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -17.126 2.813 8.323 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -15.750 5.334 9.384 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -15.169 3.712 9.706 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -14.055 3.763 7.712 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -15.600 3.787 6.887 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -13.894 6.171 7.727 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -14.424 5.746 6.112 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -15.713 7.577 7.152 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -16.681 6.264 6.680 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -16.288 6.485 8.317 1.00 0.00 H new ATOM 2761 N ALA B 28 -20.262 4.603 8.877 1.00 0.00 N ATOM 2762 CA ALA B 28 -21.653 4.170 8.862 1.00 0.00 C ATOM 2763 C ALA B 28 -22.372 4.765 7.657 1.00 0.00 C ATOM 2764 O ALA B 28 -23.332 4.188 7.145 1.00 0.00 O ATOM 2765 CB ALA B 28 -22.352 4.612 10.149 1.00 0.00 C ATOM 0 H ALA B 28 -20.007 5.188 9.673 1.00 0.00 H new ATOM 0 HA ALA B 28 -21.682 3.083 8.794 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -23.391 4.284 10.130 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -21.848 4.169 11.008 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -22.316 5.699 10.228 1.00 0.00 H new ATOM 2771 N LYS B 29 -21.898 5.923 7.209 1.00 0.00 N ATOM 2772 CA LYS B 29 -22.501 6.593 6.063 1.00 0.00 C ATOM 2773 C LYS B 29 -22.220 5.812 4.779 1.00 0.00 C ATOM 2774 O LYS B 29 -23.142 5.456 4.047 1.00 0.00 O ATOM 2775 CB LYS B 29 -21.936 8.019 5.941 1.00 0.00 C ATOM 2776 CG LYS B 29 -23.074 9.048 5.984 1.00 0.00 C ATOM 2777 CD LYS B 29 -23.563 9.219 7.429 1.00 0.00 C ATOM 2778 CE LYS B 29 -22.723 10.288 8.138 1.00 0.00 C ATOM 2779 NZ LYS B 29 -22.803 10.087 9.613 1.00 0.00 N ATOM 0 H LYS B 29 -21.104 6.414 7.619 1.00 0.00 H new ATOM 0 HA LYS B 29 -23.580 6.642 6.212 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -21.233 8.210 6.752 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -21.381 8.119 5.008 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -22.728 10.004 5.592 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -23.897 8.722 5.348 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -24.614 9.506 7.435 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -23.488 8.271 7.963 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -21.686 10.228 7.808 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -23.084 11.282 7.876 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -22.130 10.723 10.087 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -23.767 10.298 9.940 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -22.567 9.100 9.842 1.00 0.00 H new ATOM 2793 N ILE B 30 -20.942 5.549 4.515 1.00 0.00 N ATOM 2794 CA ILE B 30 -20.558 4.811 3.316 1.00 0.00 C ATOM 2795 C ILE B 30 -21.254 3.455 3.275 1.00 0.00 C ATOM 2796 O ILE B 30 -21.723 3.017 2.225 1.00 0.00 O ATOM 2797 CB ILE B 30 -19.042 4.603 3.283 1.00 0.00 C ATOM 2798 CG1 ILE B 30 -18.336 5.963 3.287 1.00 0.00 C ATOM 2799 CG2 ILE B 30 -18.662 3.836 2.014 1.00 0.00 C ATOM 2800 CD1 ILE B 30 -16.831 5.766 3.503 1.00 0.00 C ATOM 0 H ILE B 30 -20.163 5.833 5.109 1.00 0.00 H new ATOM 0 HA ILE B 30 -20.862 5.395 2.447 1.00 0.00 H new ATOM 0 HB ILE B 30 -18.735 4.034 4.160 1.00 0.00 H new ATOM 0 HG12 ILE B 30 -18.513 6.478 2.343 1.00 0.00 H new ATOM 0 HG13 ILE B 30 -18.746 6.594 4.076 1.00 0.00 H new ATOM 0 HG21 ILE B 30 -17.583 3.687 1.989 1.00 0.00 H new ATOM 0 HG22 ILE B 30 -19.162 2.868 2.011 1.00 0.00 H new ATOM 0 HG23 ILE B 30 -18.970 4.407 1.138 1.00 0.00 H new ATOM 0 HD11 ILE B 30 -16.334 6.736 3.505 1.00 0.00 H new ATOM 0 HD12 ILE B 30 -16.662 5.270 4.459 1.00 0.00 H new ATOM 0 HD13 ILE B 30 -16.425 5.152 2.699 1.00 0.00 H new ATOM 2812 N GLN B 31 -21.314 2.794 4.426 1.00 0.00 N ATOM 2813 CA GLN B 31 -21.953 1.487 4.511 1.00 0.00 C ATOM 2814 C GLN B 31 -23.346 1.529 3.893 1.00 0.00 C ATOM 2815 O GLN B 31 -23.689 0.696 3.058 1.00 0.00 O ATOM 2816 CB GLN B 31 -22.054 1.052 5.975 1.00 0.00 C ATOM 2817 CG GLN B 31 -20.660 0.696 6.506 1.00 0.00 C ATOM 2818 CD GLN B 31 -20.610 0.890 8.017 1.00 0.00 C ATOM 2819 OE1 GLN B 31 -19.689 1.656 8.537 1.00 0.00 O flip ATOM 2820 NE2 GLN B 31 -21.432 0.332 8.744 1.00 0.00 N flip ATOM 0 H GLN B 31 -20.931 3.139 5.306 1.00 0.00 H new ATOM 0 HA GLN B 31 -21.346 0.769 3.959 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -22.488 1.853 6.573 1.00 0.00 H new ATOM 0 HB3 GLN B 31 -22.718 0.192 6.064 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -20.420 -0.337 6.256 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -19.908 1.323 6.026 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -22.151 -0.266 8.336 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -21.394 0.468 9.754 1.00 0.00 H new ATOM 2829 N ASP B 32 -24.145 2.503 4.314 1.00 0.00 N ATOM 2830 CA ASP B 32 -25.502 2.644 3.797 1.00 0.00 C ATOM 2831 C ASP B 32 -25.494 3.233 2.387 1.00 0.00 C ATOM 2832 O ASP B 32 -26.398 2.974 1.593 1.00 0.00 O ATOM 2833 CB ASP B 32 -26.319 3.547 4.722 1.00 0.00 C ATOM 2834 CG ASP B 32 -27.796 3.470 4.352 1.00 0.00 C ATOM 2835 OD1 ASP B 32 -28.115 2.761 3.412 1.00 0.00 O ATOM 2836 OD2 ASP B 32 -28.587 4.120 5.015 1.00 0.00 O ATOM 0 H ASP B 32 -23.880 3.203 5.007 1.00 0.00 H new ATOM 0 HA ASP B 32 -25.954 1.653 3.756 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -26.179 3.242 5.759 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -25.969 4.576 4.642 1.00 0.00 H new ATOM 2841 N LYS B 33 -24.479 4.039 2.089 1.00 0.00 N ATOM 2842 CA LYS B 33 -24.378 4.674 0.777 1.00 0.00 C ATOM 2843 C LYS B 33 -23.991 3.660 -0.300 1.00 0.00 C ATOM 2844 O LYS B 33 -24.152 3.924 -1.492 1.00 0.00 O ATOM 2845 CB LYS B 33 -23.337 5.806 0.830 1.00 0.00 C ATOM 2846 CG LYS B 33 -23.782 6.984 -0.048 1.00 0.00 C ATOM 2847 CD LYS B 33 -22.972 8.229 0.322 1.00 0.00 C ATOM 2848 CE LYS B 33 -23.289 9.362 -0.657 1.00 0.00 C ATOM 2849 NZ LYS B 33 -22.912 10.666 -0.043 1.00 0.00 N ATOM 0 H LYS B 33 -23.720 4.267 2.731 1.00 0.00 H new ATOM 0 HA LYS B 33 -25.354 5.085 0.518 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -23.206 6.140 1.859 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -22.370 5.436 0.490 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -23.637 6.742 -1.101 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -24.846 7.174 0.092 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -23.208 8.539 1.340 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -21.906 8.002 0.297 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -22.744 9.215 -1.589 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -24.351 9.357 -0.905 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -23.688 11.347 -0.170 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -22.731 10.532 0.972 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -22.053 11.031 -0.502 1.00 0.00 H new ATOM 2863 N GLU B 34 -23.481 2.504 0.120 1.00 0.00 N ATOM 2864 CA GLU B 34 -23.077 1.466 -0.830 1.00 0.00 C ATOM 2865 C GLU B 34 -23.692 0.119 -0.458 1.00 0.00 C ATOM 2866 O GLU B 34 -24.075 -0.660 -1.330 1.00 0.00 O ATOM 2867 CB GLU B 34 -21.551 1.344 -0.850 1.00 0.00 C ATOM 2868 CG GLU B 34 -20.952 2.529 -1.609 1.00 0.00 C ATOM 2869 CD GLU B 34 -21.229 2.385 -3.102 1.00 0.00 C ATOM 2870 OE1 GLU B 34 -21.751 1.353 -3.491 1.00 0.00 O ATOM 2871 OE2 GLU B 34 -20.914 3.308 -3.835 1.00 0.00 O ATOM 0 H GLU B 34 -23.338 2.262 1.101 1.00 0.00 H new ATOM 0 HA GLU B 34 -23.435 1.751 -1.820 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -21.165 1.319 0.169 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -21.257 0.408 -1.326 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -21.379 3.461 -1.240 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -19.877 2.579 -1.433 1.00 0.00 H new ATOM 2878 N GLY B 35 -23.781 -0.149 0.841 1.00 0.00 N ATOM 2879 CA GLY B 35 -24.350 -1.406 1.319 1.00 0.00 C ATOM 2880 C GLY B 35 -23.249 -2.384 1.719 1.00 0.00 C ATOM 2881 O GLY B 35 -23.496 -3.579 1.883 1.00 0.00 O ATOM 0 H GLY B 35 -23.469 0.483 1.578 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -25.000 -1.214 2.173 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -24.970 -1.849 0.540 1.00 0.00 H new ATOM 2885 N ILE B 36 -22.034 -1.867 1.872 1.00 0.00 N ATOM 2886 CA ILE B 36 -20.894 -2.699 2.253 1.00 0.00 C ATOM 2887 C ILE B 36 -20.678 -2.642 3.768 1.00 0.00 C ATOM 2888 O ILE B 36 -20.305 -1.597 4.301 1.00 0.00 O ATOM 2889 CB ILE B 36 -19.633 -2.200 1.543 1.00 0.00 C ATOM 2890 CG1 ILE B 36 -19.904 -2.076 0.039 1.00 0.00 C ATOM 2891 CG2 ILE B 36 -18.488 -3.192 1.770 1.00 0.00 C ATOM 2892 CD1 ILE B 36 -18.811 -1.223 -0.609 1.00 0.00 C ATOM 0 H ILE B 36 -21.812 -0.880 1.739 1.00 0.00 H new ATOM 0 HA ILE B 36 -21.098 -3.729 1.960 1.00 0.00 H new ATOM 0 HB ILE B 36 -19.357 -1.226 1.946 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -19.928 -3.065 -0.419 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -20.881 -1.623 -0.129 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -17.591 -2.835 1.264 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -18.290 -3.281 2.838 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -18.767 -4.167 1.370 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -19.004 -1.135 -1.678 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -18.809 -0.231 -0.158 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -17.841 -1.695 -0.453 1.00 0.00 H new ATOM 2904 N PRO B 37 -20.900 -3.728 4.472 1.00 0.00 N ATOM 2905 CA PRO B 37 -20.714 -3.764 5.954 1.00 0.00 C ATOM 2906 C PRO B 37 -19.340 -3.236 6.377 1.00 0.00 C ATOM 2907 O PRO B 37 -18.381 -3.290 5.607 1.00 0.00 O ATOM 2908 CB PRO B 37 -20.859 -5.248 6.312 1.00 0.00 C ATOM 2909 CG PRO B 37 -21.647 -5.856 5.198 1.00 0.00 C ATOM 2910 CD PRO B 37 -21.353 -5.027 3.946 1.00 0.00 C ATOM 0 HA PRO B 37 -21.435 -3.127 6.467 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -19.884 -5.725 6.408 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -21.370 -5.373 7.267 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -21.364 -6.898 5.047 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -22.713 -5.846 5.427 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -20.587 -5.496 3.329 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -22.241 -4.917 3.323 1.00 0.00 H new ATOM 2918 N PRO B 38 -19.234 -2.732 7.580 1.00 0.00 N ATOM 2919 CA PRO B 38 -17.954 -2.183 8.120 1.00 0.00 C ATOM 2920 C PRO B 38 -16.950 -3.281 8.468 1.00 0.00 C ATOM 2921 O PRO B 38 -15.800 -3.001 8.804 1.00 0.00 O ATOM 2922 CB PRO B 38 -18.392 -1.425 9.374 1.00 0.00 C ATOM 2923 CG PRO B 38 -19.625 -2.126 9.828 1.00 0.00 C ATOM 2924 CD PRO B 38 -20.324 -2.629 8.565 1.00 0.00 C ATOM 0 HA PRO B 38 -17.438 -1.557 7.392 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -17.618 -1.448 10.141 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -18.591 -0.376 9.154 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -19.379 -2.955 10.492 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -20.272 -1.451 10.388 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -20.806 -3.592 8.731 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -21.099 -1.938 8.234 1.00 0.00 H new ATOM 2932 N ASP B 39 -17.401 -4.528 8.401 1.00 0.00 N ATOM 2933 CA ASP B 39 -16.543 -5.662 8.728 1.00 0.00 C ATOM 2934 C ASP B 39 -15.322 -5.725 7.812 1.00 0.00 C ATOM 2935 O ASP B 39 -14.352 -6.421 8.116 1.00 0.00 O ATOM 2936 CB ASP B 39 -17.338 -6.963 8.611 1.00 0.00 C ATOM 2937 CG ASP B 39 -16.529 -8.123 9.180 1.00 0.00 C ATOM 2938 OD1 ASP B 39 -15.425 -7.881 9.640 1.00 0.00 O ATOM 2939 OD2 ASP B 39 -17.025 -9.237 9.148 1.00 0.00 O ATOM 0 H ASP B 39 -18.350 -4.780 8.125 1.00 0.00 H new ATOM 0 HA ASP B 39 -16.192 -5.531 9.752 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -18.283 -6.871 9.147 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -17.582 -7.157 7.566 1.00 0.00 H new ATOM 2944 N GLN B 40 -15.367 -5.009 6.688 1.00 0.00 N ATOM 2945 CA GLN B 40 -14.245 -5.017 5.749 1.00 0.00 C ATOM 2946 C GLN B 40 -13.827 -3.600 5.358 1.00 0.00 C ATOM 2947 O GLN B 40 -12.664 -3.358 5.035 1.00 0.00 O ATOM 2948 CB GLN B 40 -14.620 -5.800 4.487 1.00 0.00 C ATOM 2949 CG GLN B 40 -15.981 -5.323 3.961 1.00 0.00 C ATOM 2950 CD GLN B 40 -17.112 -6.096 4.635 1.00 0.00 C ATOM 2951 OE1 GLN B 40 -16.865 -7.069 5.347 1.00 0.00 O ATOM 2952 NE2 GLN B 40 -18.347 -5.719 4.449 1.00 0.00 N ATOM 0 H GLN B 40 -16.155 -4.425 6.408 1.00 0.00 H new ATOM 0 HA GLN B 40 -13.404 -5.497 6.248 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -13.856 -5.661 3.722 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -14.659 -6.867 4.709 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -16.098 -4.256 4.151 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -16.030 -5.462 2.881 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -18.551 -4.912 3.859 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -19.109 -6.231 4.894 1.00 0.00 H new ATOM 2961 N GLN B 41 -14.775 -2.669 5.374 1.00 0.00 N ATOM 2962 CA GLN B 41 -14.474 -1.290 4.999 1.00 0.00 C ATOM 2963 C GLN B 41 -13.618 -0.599 6.056 1.00 0.00 C ATOM 2964 O GLN B 41 -13.988 -0.531 7.228 1.00 0.00 O ATOM 2965 CB GLN B 41 -15.769 -0.498 4.801 1.00 0.00 C ATOM 2966 CG GLN B 41 -16.474 -0.963 3.525 1.00 0.00 C ATOM 2967 CD GLN B 41 -17.492 0.083 3.085 1.00 0.00 C ATOM 2968 OE1 GLN B 41 -17.406 0.600 1.890 1.00 0.00 O flip ATOM 2969 NE2 GLN B 41 -18.388 0.439 3.850 1.00 0.00 N flip ATOM 0 H GLN B 41 -15.745 -2.839 5.638 1.00 0.00 H new ATOM 0 HA GLN B 41 -13.914 -1.320 4.064 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -16.425 -0.636 5.660 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -15.548 0.567 4.737 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -15.742 -1.127 2.734 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -16.972 -1.917 3.701 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -18.453 0.033 4.784 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -19.066 1.140 3.550 1.00 0.00 H new ATOM 2978 N ARG B 42 -12.479 -0.071 5.619 1.00 0.00 N ATOM 2979 CA ARG B 42 -11.568 0.640 6.510 1.00 0.00 C ATOM 2980 C ARG B 42 -10.907 1.788 5.751 1.00 0.00 C ATOM 2981 O ARG B 42 -10.301 1.580 4.700 1.00 0.00 O ATOM 2982 CB ARG B 42 -10.503 -0.315 7.058 1.00 0.00 C ATOM 2983 CG ARG B 42 -9.590 -0.783 5.923 1.00 0.00 C ATOM 2984 CD ARG B 42 -8.807 -2.019 6.372 1.00 0.00 C ATOM 2985 NE ARG B 42 -7.891 -1.671 7.454 1.00 0.00 N ATOM 2986 CZ ARG B 42 -8.254 -1.769 8.731 1.00 0.00 C ATOM 2987 NH1 ARG B 42 -9.449 -2.193 9.042 1.00 0.00 N ATOM 2988 NH2 ARG B 42 -7.413 -1.444 9.674 1.00 0.00 N ATOM 0 H ARG B 42 -12.164 -0.122 4.650 1.00 0.00 H new ATOM 0 HA ARG B 42 -12.133 1.042 7.351 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -9.914 0.185 7.827 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -10.980 -1.174 7.530 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -10.183 -1.017 5.039 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -8.902 0.015 5.644 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -9.497 -2.794 6.705 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -8.248 -2.430 5.531 1.00 0.00 H new ATOM 0 HE ARG B 42 -6.952 -1.345 7.226 1.00 0.00 H new ATOM 0 HH11 ARG B 42 -10.107 -2.450 8.306 1.00 0.00 H new ATOM 0 HH12 ARG B 42 -9.725 -2.267 10.021 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -6.478 -1.115 9.433 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -7.690 -1.519 10.653 1.00 0.00 H new ATOM 3002 N LEU B 43 -11.051 3.002 6.274 1.00 0.00 N ATOM 3003 CA LEU B 43 -10.485 4.177 5.618 1.00 0.00 C ATOM 3004 C LEU B 43 -9.030 4.396 6.026 1.00 0.00 C ATOM 3005 O LEU B 43 -8.625 4.070 7.143 1.00 0.00 O ATOM 3006 CB LEU B 43 -11.319 5.416 5.973 1.00 0.00 C ATOM 3007 CG LEU B 43 -11.534 6.277 4.721 1.00 0.00 C ATOM 3008 CD1 LEU B 43 -12.609 5.642 3.825 1.00 0.00 C ATOM 3009 CD2 LEU B 43 -11.981 7.681 5.142 1.00 0.00 C ATOM 0 H LEU B 43 -11.550 3.198 7.142 1.00 0.00 H new ATOM 0 HA LEU B 43 -10.510 4.011 4.541 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -12.281 5.112 6.385 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -10.812 5.998 6.743 1.00 0.00 H new ATOM 0 HG LEU B 43 -10.599 6.341 4.164 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -12.755 6.260 2.939 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -12.289 4.645 3.524 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -13.547 5.571 4.376 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -12.135 8.295 4.255 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -12.913 7.613 5.702 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -11.213 8.135 5.769 1.00 0.00 H new ATOM 3021 N ILE B 44 -8.253 4.958 5.103 1.00 0.00 N ATOM 3022 CA ILE B 44 -6.842 5.231 5.353 1.00 0.00 C ATOM 3023 C ILE B 44 -6.442 6.563 4.724 1.00 0.00 C ATOM 3024 O ILE B 44 -6.823 6.865 3.592 1.00 0.00 O ATOM 3025 CB ILE B 44 -5.985 4.107 4.764 1.00 0.00 C ATOM 3026 CG1 ILE B 44 -6.545 2.755 5.213 1.00 0.00 C ATOM 3027 CG2 ILE B 44 -4.542 4.249 5.253 1.00 0.00 C ATOM 3028 CD1 ILE B 44 -5.621 1.634 4.731 1.00 0.00 C ATOM 0 H ILE B 44 -8.578 5.233 4.176 1.00 0.00 H new ATOM 0 HA ILE B 44 -6.680 5.285 6.430 1.00 0.00 H new ATOM 0 HB ILE B 44 -6.004 4.169 3.676 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -6.631 2.728 6.299 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -7.548 2.613 4.810 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -3.935 3.448 4.832 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -4.143 5.212 4.935 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -4.519 4.188 6.341 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -6.020 0.671 5.051 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -5.557 1.657 3.643 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -4.627 1.774 5.156 1.00 0.00 H new ATOM 3040 N PHE B 45 -5.673 7.356 5.467 1.00 0.00 N ATOM 3041 CA PHE B 45 -5.224 8.658 4.979 1.00 0.00 C ATOM 3042 C PHE B 45 -3.715 8.652 4.761 1.00 0.00 C ATOM 3043 O PHE B 45 -2.945 8.409 5.690 1.00 0.00 O ATOM 3044 CB PHE B 45 -5.590 9.747 5.989 1.00 0.00 C ATOM 3045 CG PHE B 45 -5.320 11.109 5.390 1.00 0.00 C ATOM 3046 CD1 PHE B 45 -6.061 11.548 4.286 1.00 0.00 C ATOM 3047 CD2 PHE B 45 -4.332 11.936 5.941 1.00 0.00 C ATOM 3048 CE1 PHE B 45 -5.816 12.811 3.734 1.00 0.00 C ATOM 3049 CE2 PHE B 45 -4.086 13.199 5.388 1.00 0.00 C ATOM 3050 CZ PHE B 45 -4.829 13.636 4.284 1.00 0.00 C ATOM 0 H PHE B 45 -5.349 7.121 6.405 1.00 0.00 H new ATOM 0 HA PHE B 45 -5.718 8.862 4.029 1.00 0.00 H new ATOM 0 HB2 PHE B 45 -6.641 9.662 6.265 1.00 0.00 H new ATOM 0 HB3 PHE B 45 -5.009 9.619 6.903 1.00 0.00 H new ATOM 0 HD1 PHE B 45 -6.822 10.912 3.860 1.00 0.00 H new ATOM 0 HD2 PHE B 45 -3.760 11.599 6.793 1.00 0.00 H new ATOM 0 HE1 PHE B 45 -6.389 13.149 2.883 1.00 0.00 H new ATOM 0 HE2 PHE B 45 -3.324 13.836 5.813 1.00 0.00 H new ATOM 0 HZ PHE B 45 -4.640 14.610 3.857 1.00 0.00 H new ATOM 3060 N ALA B 46 -3.299 8.919 3.527 1.00 0.00 N ATOM 3061 CA ALA B 46 -1.878 8.940 3.201 1.00 0.00 C ATOM 3062 C ALA B 46 -1.229 7.610 3.566 1.00 0.00 C ATOM 3063 O ALA B 46 -0.043 7.555 3.892 1.00 0.00 O ATOM 3064 CB ALA B 46 -1.184 10.074 3.957 1.00 0.00 C ATOM 0 H ALA B 46 -3.919 9.122 2.743 1.00 0.00 H new ATOM 0 HA ALA B 46 -1.772 9.103 2.129 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -0.123 10.082 3.707 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -1.631 11.027 3.674 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -1.303 9.922 5.030 1.00 0.00 H new ATOM 3070 N GLY B 47 -2.016 6.539 3.511 1.00 0.00 N ATOM 3071 CA GLY B 47 -1.511 5.211 3.839 1.00 0.00 C ATOM 3072 C GLY B 47 -1.667 4.922 5.328 1.00 0.00 C ATOM 3073 O GLY B 47 -1.650 3.766 5.752 1.00 0.00 O ATOM 0 H GLY B 47 -3.000 6.565 3.244 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -2.049 4.460 3.260 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -0.460 5.138 3.558 1.00 0.00 H new ATOM 3077 N LYS B 48 -1.820 5.980 6.119 1.00 0.00 N ATOM 3078 CA LYS B 48 -1.978 5.830 7.562 1.00 0.00 C ATOM 3079 C LYS B 48 -3.448 5.642 7.925 1.00 0.00 C ATOM 3080 O LYS B 48 -4.304 6.423 7.511 1.00 0.00 O ATOM 3081 CB LYS B 48 -1.426 7.066 8.276 1.00 0.00 C ATOM 3082 CG LYS B 48 0.071 7.197 7.985 1.00 0.00 C ATOM 3083 CD LYS B 48 0.539 8.613 8.329 1.00 0.00 C ATOM 3084 CE LYS B 48 0.308 8.881 9.818 1.00 0.00 C ATOM 3085 NZ LYS B 48 1.091 10.078 10.234 1.00 0.00 N ATOM 0 H LYS B 48 -1.838 6.945 5.788 1.00 0.00 H new ATOM 0 HA LYS B 48 -1.424 4.947 7.881 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -1.952 7.959 7.939 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -1.593 6.984 9.350 1.00 0.00 H new ATOM 0 HG2 LYS B 48 0.631 6.466 8.569 1.00 0.00 H new ATOM 0 HG3 LYS B 48 0.268 6.983 6.934 1.00 0.00 H new ATOM 0 HD2 LYS B 48 1.596 8.726 8.088 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -0.005 9.343 7.729 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -0.753 9.043 10.009 1.00 0.00 H new ATOM 0 HE3 LYS B 48 0.609 8.014 10.406 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 0.935 10.261 11.246 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 2.103 9.907 10.066 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 0.783 10.904 9.681 1.00 0.00 H new ATOM 3099 N GLN B 49 -3.731 4.600 8.700 1.00 0.00 N ATOM 3100 CA GLN B 49 -5.101 4.316 9.114 1.00 0.00 C ATOM 3101 C GLN B 49 -5.670 5.481 9.917 1.00 0.00 C ATOM 3102 O GLN B 49 -4.986 6.055 10.765 1.00 0.00 O ATOM 3103 CB GLN B 49 -5.137 3.044 9.963 1.00 0.00 C ATOM 3104 CG GLN B 49 -4.722 1.846 9.106 1.00 0.00 C ATOM 3105 CD GLN B 49 -4.392 0.655 10.001 1.00 0.00 C ATOM 3106 OE1 GLN B 49 -5.304 0.185 10.808 1.00 0.00 O flip ATOM 3107 NE2 GLN B 49 -3.275 0.140 9.964 1.00 0.00 N flip ATOM 0 H GLN B 49 -3.036 3.942 9.052 1.00 0.00 H new ATOM 0 HA GLN B 49 -5.709 4.174 8.220 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -4.466 3.144 10.816 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -6.139 2.889 10.363 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -5.526 1.584 8.419 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -3.856 2.106 8.498 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -2.564 0.509 9.333 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -3.060 -0.656 10.565 1.00 0.00 H new ATOM 3116 N LEU B 50 -6.925 5.825 9.646 1.00 0.00 N ATOM 3117 CA LEU B 50 -7.574 6.925 10.353 1.00 0.00 C ATOM 3118 C LEU B 50 -8.109 6.453 11.702 1.00 0.00 C ATOM 3119 O LEU B 50 -8.867 5.486 11.775 1.00 0.00 O ATOM 3120 CB LEU B 50 -8.727 7.482 9.509 1.00 0.00 C ATOM 3121 CG LEU B 50 -8.173 8.402 8.411 1.00 0.00 C ATOM 3122 CD1 LEU B 50 -9.140 8.426 7.225 1.00 0.00 C ATOM 3123 CD2 LEU B 50 -8.012 9.824 8.960 1.00 0.00 C ATOM 0 H LEU B 50 -7.509 5.363 8.949 1.00 0.00 H new ATOM 0 HA LEU B 50 -6.836 7.710 10.522 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -9.289 6.663 9.060 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -9.420 8.035 10.143 1.00 0.00 H new ATOM 0 HG LEU B 50 -7.203 8.026 8.085 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -8.745 9.079 6.447 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -9.254 7.417 6.828 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -10.110 8.799 7.554 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -7.619 10.474 8.178 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -8.981 10.199 9.290 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -7.322 9.812 9.803 1.00 0.00 H new ATOM 3135 N GLU B 51 -7.710 7.142 12.767 1.00 0.00 N ATOM 3136 CA GLU B 51 -8.158 6.784 14.108 1.00 0.00 C ATOM 3137 C GLU B 51 -9.681 6.705 14.154 1.00 0.00 C ATOM 3138 O GLU B 51 -10.372 7.699 13.932 1.00 0.00 O ATOM 3139 CB GLU B 51 -7.663 7.824 15.119 1.00 0.00 C ATOM 3140 CG GLU B 51 -6.226 7.496 15.535 1.00 0.00 C ATOM 3141 CD GLU B 51 -6.221 6.336 16.526 1.00 0.00 C ATOM 3142 OE1 GLU B 51 -6.250 5.201 16.079 1.00 0.00 O ATOM 3143 OE2 GLU B 51 -6.190 6.600 17.716 1.00 0.00 O ATOM 0 H GLU B 51 -7.082 7.945 12.728 1.00 0.00 H new ATOM 0 HA GLU B 51 -7.746 5.808 14.365 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -7.706 8.821 14.681 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -8.312 7.832 15.994 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -5.635 7.237 14.657 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -5.760 8.372 15.986 1.00 0.00 H new ATOM 3150 N ASP B 52 -10.196 5.514 14.441 1.00 0.00 N ATOM 3151 CA ASP B 52 -11.638 5.310 14.512 1.00 0.00 C ATOM 3152 C ASP B 52 -12.268 6.231 15.555 1.00 0.00 C ATOM 3153 O ASP B 52 -13.358 6.766 15.346 1.00 0.00 O ATOM 3154 CB ASP B 52 -11.940 3.853 14.868 1.00 0.00 C ATOM 3155 CG ASP B 52 -11.646 2.953 13.674 1.00 0.00 C ATOM 3156 OD1 ASP B 52 -11.936 3.363 12.562 1.00 0.00 O ATOM 3157 OD2 ASP B 52 -11.134 1.866 13.887 1.00 0.00 O ATOM 0 H ASP B 52 -9.640 4.680 14.627 1.00 0.00 H new ATOM 0 HA ASP B 52 -12.064 5.546 13.537 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -11.337 3.546 15.722 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -12.985 3.751 15.162 1.00 0.00 H new ATOM 3162 N GLY B 53 -11.579 6.404 16.680 1.00 0.00 N ATOM 3163 CA GLY B 53 -12.085 7.254 17.754 1.00 0.00 C ATOM 3164 C GLY B 53 -11.569 8.684 17.624 1.00 0.00 C ATOM 3165 O GLY B 53 -10.915 9.200 18.529 1.00 0.00 O ATOM 0 H GLY B 53 -10.676 5.971 16.871 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -13.175 7.256 17.735 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -11.783 6.843 18.718 1.00 0.00 H new ATOM 3169 N ARG B 54 -11.876 9.324 16.498 1.00 0.00 N ATOM 3170 CA ARG B 54 -11.443 10.700 16.265 1.00 0.00 C ATOM 3171 C ARG B 54 -12.470 11.442 15.412 1.00 0.00 C ATOM 3172 O ARG B 54 -13.329 10.826 14.783 1.00 0.00 O ATOM 3173 CB ARG B 54 -10.075 10.713 15.561 1.00 0.00 C ATOM 3174 CG ARG B 54 -8.952 10.901 16.591 1.00 0.00 C ATOM 3175 CD ARG B 54 -8.787 12.388 16.913 1.00 0.00 C ATOM 3176 NE ARG B 54 -7.700 12.578 17.868 1.00 0.00 N ATOM 3177 CZ ARG B 54 -6.434 12.628 17.467 1.00 0.00 C ATOM 3178 NH1 ARG B 54 -6.146 12.515 16.199 1.00 0.00 N ATOM 3179 NH2 ARG B 54 -5.479 12.791 18.342 1.00 0.00 N ATOM 0 H ARG B 54 -12.419 8.916 15.737 1.00 0.00 H new ATOM 0 HA ARG B 54 -11.354 11.203 17.228 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -9.928 9.779 15.018 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -10.043 11.518 14.826 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -9.183 10.346 17.500 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -8.017 10.498 16.201 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -8.580 12.945 15.999 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -9.716 12.784 17.324 1.00 0.00 H new ATOM 0 HE ARG B 54 -7.916 12.674 18.860 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -6.893 12.388 15.516 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -5.174 12.553 15.891 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -5.705 12.880 19.333 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -4.507 12.829 18.035 1.00 0.00 H new ATOM 3193 N THR B 55 -12.372 12.770 15.398 1.00 0.00 N ATOM 3194 CA THR B 55 -13.296 13.593 14.620 1.00 0.00 C ATOM 3195 C THR B 55 -12.547 14.343 13.523 1.00 0.00 C ATOM 3196 O THR B 55 -11.361 14.642 13.660 1.00 0.00 O ATOM 3197 CB THR B 55 -13.999 14.598 15.536 1.00 0.00 C ATOM 3198 OG1 THR B 55 -13.032 15.265 16.335 1.00 0.00 O ATOM 3199 CG2 THR B 55 -14.992 13.863 16.438 1.00 0.00 C ATOM 0 H THR B 55 -11.667 13.297 15.913 1.00 0.00 H new ATOM 0 HA THR B 55 -14.038 12.940 14.160 1.00 0.00 H new ATOM 0 HB THR B 55 -14.536 15.328 14.930 1.00 0.00 H new ATOM 0 HG1 THR B 55 -13.480 15.910 16.921 1.00 0.00 H new ATOM 0 HG21 THR B 55 -15.492 14.580 17.089 1.00 0.00 H new ATOM 0 HG22 THR B 55 -15.734 13.353 15.823 1.00 0.00 H new ATOM 0 HG23 THR B 55 -14.459 13.131 17.045 1.00 0.00 H new ATOM 3207 N LEU B 56 -13.248 14.644 12.434 1.00 0.00 N ATOM 3208 CA LEU B 56 -12.637 15.360 11.320 1.00 0.00 C ATOM 3209 C LEU B 56 -12.060 16.690 11.795 1.00 0.00 C ATOM 3210 O LEU B 56 -11.052 17.163 11.270 1.00 0.00 O ATOM 3211 CB LEU B 56 -13.678 15.611 10.223 1.00 0.00 C ATOM 3212 CG LEU B 56 -13.875 14.341 9.383 1.00 0.00 C ATOM 3213 CD1 LEU B 56 -12.615 14.054 8.551 1.00 0.00 C ATOM 3214 CD2 LEU B 56 -14.158 13.155 10.310 1.00 0.00 C ATOM 0 H LEU B 56 -14.231 14.406 12.300 1.00 0.00 H new ATOM 0 HA LEU B 56 -11.829 14.749 10.917 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -14.625 15.911 10.671 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -13.354 16.432 9.584 1.00 0.00 H new ATOM 0 HG LEU B 56 -14.718 14.489 8.708 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -12.767 13.151 7.960 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -12.419 14.895 7.885 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -11.764 13.912 9.217 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -14.298 12.253 9.714 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -13.317 13.015 10.989 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -15.061 13.352 10.888 1.00 0.00 H new ATOM 3226 N SER B 57 -12.704 17.287 12.792 1.00 0.00 N ATOM 3227 CA SER B 57 -12.241 18.560 13.330 1.00 0.00 C ATOM 3228 C SER B 57 -10.775 18.462 13.738 1.00 0.00 C ATOM 3229 O SER B 57 -10.036 19.444 13.677 1.00 0.00 O ATOM 3230 CB SER B 57 -13.087 18.954 14.541 1.00 0.00 C ATOM 3231 OG SER B 57 -12.894 20.335 14.819 1.00 0.00 O ATOM 0 H SER B 57 -13.541 16.914 13.240 1.00 0.00 H new ATOM 0 HA SER B 57 -12.342 19.321 12.557 1.00 0.00 H new ATOM 0 HB2 SER B 57 -14.140 18.755 14.344 1.00 0.00 H new ATOM 0 HB3 SER B 57 -12.806 18.354 15.406 1.00 0.00 H new ATOM 0 HG SER B 57 -13.436 20.592 15.594 1.00 0.00 H new ATOM 3237 N ASP B 58 -10.361 17.267 14.150 1.00 0.00 N ATOM 3238 CA ASP B 58 -8.979 17.046 14.562 1.00 0.00 C ATOM 3239 C ASP B 58 -8.104 16.745 13.350 1.00 0.00 C ATOM 3240 O ASP B 58 -6.993 17.260 13.230 1.00 0.00 O ATOM 3241 CB ASP B 58 -8.910 15.878 15.548 1.00 0.00 C ATOM 3242 CG ASP B 58 -9.577 16.267 16.863 1.00 0.00 C ATOM 3243 OD1 ASP B 58 -10.464 17.105 16.830 1.00 0.00 O ATOM 3244 OD2 ASP B 58 -9.192 15.722 17.884 1.00 0.00 O ATOM 0 H ASP B 58 -10.958 16.442 14.207 1.00 0.00 H new ATOM 0 HA ASP B 58 -8.612 17.951 15.046 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -9.404 15.004 15.124 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -7.871 15.602 15.725 1.00 0.00 H new ATOM 3249 N TYR B 59 -8.616 15.910 12.450 1.00 0.00 N ATOM 3250 CA TYR B 59 -7.874 15.552 11.246 1.00 0.00 C ATOM 3251 C TYR B 59 -7.913 16.701 10.242 1.00 0.00 C ATOM 3252 O TYR B 59 -7.169 16.707 9.262 1.00 0.00 O ATOM 3253 CB TYR B 59 -8.479 14.289 10.614 1.00 0.00 C ATOM 3254 CG TYR B 59 -7.759 13.061 11.126 1.00 0.00 C ATOM 3255 CD1 TYR B 59 -6.397 12.886 10.854 1.00 0.00 C ATOM 3256 CD2 TYR B 59 -8.454 12.097 11.868 1.00 0.00 C ATOM 3257 CE1 TYR B 59 -5.729 11.749 11.323 1.00 0.00 C ATOM 3258 CE2 TYR B 59 -7.785 10.960 12.338 1.00 0.00 C ATOM 3259 CZ TYR B 59 -6.423 10.786 12.065 1.00 0.00 C ATOM 3260 OH TYR B 59 -5.764 9.665 12.528 1.00 0.00 O ATOM 0 H TYR B 59 -9.534 15.472 12.530 1.00 0.00 H new ATOM 0 HA TYR B 59 -6.837 15.355 11.518 1.00 0.00 H new ATOM 0 HB2 TYR B 59 -9.540 14.225 10.853 1.00 0.00 H new ATOM 0 HB3 TYR B 59 -8.400 14.341 9.528 1.00 0.00 H new ATOM 0 HD1 TYR B 59 -5.861 13.629 10.282 1.00 0.00 H new ATOM 0 HD2 TYR B 59 -9.505 12.231 12.077 1.00 0.00 H new ATOM 0 HE1 TYR B 59 -4.678 11.615 11.112 1.00 0.00 H new ATOM 0 HE2 TYR B 59 -8.320 10.217 12.911 1.00 0.00 H new ATOM 0 HH TYR B 59 -5.947 9.549 13.484 1.00 0.00 H new ATOM 3270 N ASN B 60 -8.788 17.670 10.498 1.00 0.00 N ATOM 3271 CA ASN B 60 -8.928 18.826 9.617 1.00 0.00 C ATOM 3272 C ASN B 60 -9.572 18.421 8.292 1.00 0.00 C ATOM 3273 O ASN B 60 -10.778 18.590 8.107 1.00 0.00 O ATOM 3274 CB ASN B 60 -7.559 19.466 9.361 1.00 0.00 C ATOM 3275 CG ASN B 60 -7.738 20.892 8.850 1.00 0.00 C ATOM 3276 OD1 ASN B 60 -7.785 21.117 7.640 1.00 0.00 O ATOM 3277 ND2 ASN B 60 -7.842 21.873 9.703 1.00 0.00 N ATOM 0 H ASN B 60 -9.410 17.678 11.307 1.00 0.00 H new ATOM 0 HA ASN B 60 -9.574 19.554 10.108 1.00 0.00 H new ATOM 0 HB2 ASN B 60 -6.973 19.471 10.280 1.00 0.00 H new ATOM 0 HB3 ASN B 60 -7.003 18.877 8.632 1.00 0.00 H new ATOM 0 HD21 ASN B 60 -7.963 22.829 9.369 1.00 0.00 H new ATOM 0 HD22 ASN B 60 -7.803 21.684 10.705 1.00 0.00 H new ATOM 3284 N ILE B 61 -8.766 17.887 7.376 1.00 0.00 N ATOM 3285 CA ILE B 61 -9.271 17.462 6.071 1.00 0.00 C ATOM 3286 C ILE B 61 -10.382 18.391 5.587 1.00 0.00 C ATOM 3287 O ILE B 61 -11.563 18.137 5.827 1.00 0.00 O ATOM 3288 CB ILE B 61 -9.806 16.032 6.158 1.00 0.00 C ATOM 3289 CG1 ILE B 61 -8.705 15.107 6.679 1.00 0.00 C ATOM 3290 CG2 ILE B 61 -10.244 15.565 4.770 1.00 0.00 C ATOM 3291 CD1 ILE B 61 -9.303 13.740 7.018 1.00 0.00 C ATOM 0 H ILE B 61 -7.766 17.739 7.512 1.00 0.00 H new ATOM 0 HA ILE B 61 -8.447 17.503 5.359 1.00 0.00 H new ATOM 0 HB ILE B 61 -10.658 16.005 6.837 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -7.923 14.997 5.928 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -8.239 15.541 7.564 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -10.625 14.546 4.833 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -11.028 16.223 4.395 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -9.392 15.593 4.091 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -8.518 13.081 7.389 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -10.070 13.858 7.784 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -9.748 13.305 6.123 1.00 0.00 H new ATOM 3303 N GLN B 62 -9.999 19.467 4.907 1.00 0.00 N ATOM 3304 CA GLN B 62 -10.978 20.422 4.398 1.00 0.00 C ATOM 3305 C GLN B 62 -11.800 19.803 3.272 1.00 0.00 C ATOM 3306 O GLN B 62 -11.556 18.668 2.864 1.00 0.00 O ATOM 3307 CB GLN B 62 -10.267 21.676 3.885 1.00 0.00 C ATOM 3308 CG GLN B 62 -9.537 22.361 5.042 1.00 0.00 C ATOM 3309 CD GLN B 62 -9.164 23.788 4.653 1.00 0.00 C ATOM 3310 OE1 GLN B 62 -9.454 24.224 3.458 1.00 0.00 O flip ATOM 3311 NE2 GLN B 62 -8.595 24.524 5.459 1.00 0.00 N flip ATOM 0 H GLN B 62 -9.028 19.699 4.697 1.00 0.00 H new ATOM 0 HA GLN B 62 -11.649 20.693 5.213 1.00 0.00 H new ATOM 0 HB2 GLN B 62 -9.558 21.409 3.101 1.00 0.00 H new ATOM 0 HB3 GLN B 62 -10.990 22.361 3.442 1.00 0.00 H new ATOM 0 HG2 GLN B 62 -10.172 22.371 5.928 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -8.639 21.799 5.300 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -8.370 24.180 6.393 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -8.349 25.478 5.193 1.00 0.00 H new ATOM 3320 N LYS B 63 -12.777 20.556 2.776 1.00 0.00 N ATOM 3321 CA LYS B 63 -13.632 20.072 1.698 1.00 0.00 C ATOM 3322 C LYS B 63 -12.795 19.700 0.476 1.00 0.00 C ATOM 3323 O LYS B 63 -11.669 20.170 0.318 1.00 0.00 O ATOM 3324 CB LYS B 63 -14.653 21.151 1.316 1.00 0.00 C ATOM 3325 CG LYS B 63 -15.872 20.500 0.654 1.00 0.00 C ATOM 3326 CD LYS B 63 -16.733 21.575 -0.022 1.00 0.00 C ATOM 3327 CE LYS B 63 -16.145 21.936 -1.391 1.00 0.00 C ATOM 3328 NZ LYS B 63 -17.168 22.668 -2.191 1.00 0.00 N ATOM 0 H LYS B 63 -12.995 21.498 3.101 1.00 0.00 H new ATOM 0 HA LYS B 63 -14.158 19.183 2.046 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -14.961 21.704 2.204 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -14.198 21.870 0.635 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -15.548 19.765 -0.082 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -16.460 19.966 1.400 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -17.754 21.213 -0.140 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -16.781 22.463 0.608 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -15.255 22.553 -1.266 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -15.835 21.032 -1.916 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -16.771 22.914 -3.120 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -18.005 22.064 -2.321 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -17.443 23.537 -1.691 1.00 0.00 H new ATOM 3342 N GLU B 64 -13.356 18.855 -0.384 1.00 0.00 N ATOM 3343 CA GLU B 64 -12.655 18.426 -1.591 1.00 0.00 C ATOM 3344 C GLU B 64 -11.416 17.610 -1.233 1.00 0.00 C ATOM 3345 O GLU B 64 -10.332 17.844 -1.767 1.00 0.00 O ATOM 3346 CB GLU B 64 -12.247 19.646 -2.421 1.00 0.00 C ATOM 3347 CG GLU B 64 -11.951 19.213 -3.859 1.00 0.00 C ATOM 3348 CD GLU B 64 -11.218 20.327 -4.599 1.00 0.00 C ATOM 3349 OE1 GLU B 64 -10.151 20.708 -4.148 1.00 0.00 O ATOM 3350 OE2 GLU B 64 -11.736 20.783 -5.605 1.00 0.00 O ATOM 0 H GLU B 64 -14.288 18.456 -0.269 1.00 0.00 H new ATOM 0 HA GLU B 64 -13.329 17.800 -2.176 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -13.045 20.389 -2.411 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -11.367 20.118 -1.984 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -11.345 18.307 -3.857 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -12.881 18.974 -4.374 1.00 0.00 H new ATOM 3357 N SER B 65 -11.587 16.650 -0.328 1.00 0.00 N ATOM 3358 CA SER B 65 -10.477 15.800 0.095 1.00 0.00 C ATOM 3359 C SER B 65 -10.598 14.413 -0.527 1.00 0.00 C ATOM 3360 O SER B 65 -11.703 13.930 -0.778 1.00 0.00 O ATOM 3361 CB SER B 65 -10.467 15.677 1.619 1.00 0.00 C ATOM 3362 OG SER B 65 -10.072 16.919 2.186 1.00 0.00 O ATOM 0 H SER B 65 -12.477 16.442 0.124 1.00 0.00 H new ATOM 0 HA SER B 65 -9.546 16.256 -0.240 1.00 0.00 H new ATOM 0 HB2 SER B 65 -11.457 15.398 1.980 1.00 0.00 H new ATOM 0 HB3 SER B 65 -9.781 14.888 1.928 1.00 0.00 H new ATOM 0 HG SER B 65 -10.845 17.521 2.226 1.00 0.00 H new ATOM 3368 N THR B 66 -9.456 13.776 -0.773 1.00 0.00 N ATOM 3369 CA THR B 66 -9.443 12.442 -1.368 1.00 0.00 C ATOM 3370 C THR B 66 -9.053 11.394 -0.329 1.00 0.00 C ATOM 3371 O THR B 66 -7.899 11.325 0.095 1.00 0.00 O ATOM 3372 CB THR B 66 -8.450 12.400 -2.533 1.00 0.00 C ATOM 3373 OG1 THR B 66 -8.589 13.580 -3.312 1.00 0.00 O ATOM 3374 CG2 THR B 66 -8.731 11.175 -3.404 1.00 0.00 C ATOM 0 H THR B 66 -8.532 14.159 -0.571 1.00 0.00 H new ATOM 0 HA THR B 66 -10.445 12.219 -1.734 1.00 0.00 H new ATOM 0 HB THR B 66 -7.434 12.338 -2.143 1.00 0.00 H new ATOM 0 HG1 THR B 66 -7.953 13.557 -4.057 1.00 0.00 H new ATOM 0 HG21 THR B 66 -8.023 11.147 -4.232 1.00 0.00 H new ATOM 0 HG22 THR B 66 -8.624 10.271 -2.805 1.00 0.00 H new ATOM 0 HG23 THR B 66 -9.746 11.233 -3.796 1.00 0.00 H new ATOM 3382 N LEU B 67 -10.024 10.580 0.076 1.00 0.00 N ATOM 3383 CA LEU B 67 -9.777 9.534 1.066 1.00 0.00 C ATOM 3384 C LEU B 67 -9.736 8.165 0.393 1.00 0.00 C ATOM 3385 O LEU B 67 -10.387 7.946 -0.628 1.00 0.00 O ATOM 3386 CB LEU B 67 -10.879 9.555 2.128 1.00 0.00 C ATOM 3387 CG LEU B 67 -10.859 10.902 2.865 1.00 0.00 C ATOM 3388 CD1 LEU B 67 -12.264 11.234 3.375 1.00 0.00 C ATOM 3389 CD2 LEU B 67 -9.893 10.828 4.055 1.00 0.00 C ATOM 0 H LEU B 67 -10.985 10.623 -0.264 1.00 0.00 H new ATOM 0 HA LEU B 67 -8.814 9.721 1.540 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -11.851 9.399 1.661 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -10.731 8.739 2.836 1.00 0.00 H new ATOM 0 HG LEU B 67 -10.529 11.679 2.176 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -12.245 12.191 3.897 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -12.952 11.295 2.532 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -12.596 10.454 4.059 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -9.882 11.786 4.575 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -10.220 10.047 4.741 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -8.890 10.599 3.696 1.00 0.00 H new ATOM 3401 N HIS B 68 -8.961 7.247 0.967 1.00 0.00 N ATOM 3402 CA HIS B 68 -8.840 5.904 0.407 1.00 0.00 C ATOM 3403 C HIS B 68 -9.796 4.937 1.099 1.00 0.00 C ATOM 3404 O HIS B 68 -10.004 5.013 2.310 1.00 0.00 O ATOM 3405 CB HIS B 68 -7.403 5.404 0.565 1.00 0.00 C ATOM 3406 CG HIS B 68 -6.449 6.473 0.106 1.00 0.00 C ATOM 3407 ND1 HIS B 68 -5.517 7.047 0.957 1.00 0.00 N ATOM 3408 CD2 HIS B 68 -6.272 7.084 -1.111 1.00 0.00 C ATOM 3409 CE1 HIS B 68 -4.828 7.959 0.247 1.00 0.00 C ATOM 3410 NE2 HIS B 68 -5.247 8.021 -1.020 1.00 0.00 N ATOM 0 H HIS B 68 -8.412 7.407 1.812 1.00 0.00 H new ATOM 0 HA HIS B 68 -9.099 5.950 -0.651 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -7.207 5.149 1.607 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -7.256 4.495 -0.018 1.00 0.00 H new ATOM 0 HD1 HIS B 68 -5.379 6.819 1.942 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -6.842 6.870 -2.003 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -4.033 8.567 0.652 1.00 0.00 H new ATOM 3419 N LEU B 69 -10.374 4.027 0.318 1.00 0.00 N ATOM 3420 CA LEU B 69 -11.309 3.040 0.855 1.00 0.00 C ATOM 3421 C LEU B 69 -10.912 1.636 0.403 1.00 0.00 C ATOM 3422 O LEU B 69 -11.011 1.305 -0.778 1.00 0.00 O ATOM 3423 CB LEU B 69 -12.730 3.352 0.372 1.00 0.00 C ATOM 3424 CG LEU B 69 -13.753 2.756 1.346 1.00 0.00 C ATOM 3425 CD1 LEU B 69 -15.168 3.079 0.860 1.00 0.00 C ATOM 3426 CD2 LEU B 69 -13.576 1.235 1.417 1.00 0.00 C ATOM 0 H LEU B 69 -10.212 3.952 -0.686 1.00 0.00 H new ATOM 0 HA LEU B 69 -11.278 3.085 1.944 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -12.870 4.430 0.298 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -12.883 2.942 -0.626 1.00 0.00 H new ATOM 0 HG LEU B 69 -13.598 3.185 2.336 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -15.896 2.656 1.552 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -15.299 4.160 0.813 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -15.319 2.652 -0.131 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -14.305 0.816 2.110 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -13.727 0.804 0.427 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -12.569 1.002 1.764 1.00 0.00 H new ATOM 3438 N VAL B 70 -10.467 0.815 1.351 1.00 0.00 N ATOM 3439 CA VAL B 70 -10.060 -0.555 1.044 1.00 0.00 C ATOM 3440 C VAL B 70 -10.921 -1.552 1.817 1.00 0.00 C ATOM 3441 O VAL B 70 -11.221 -1.346 2.992 1.00 0.00 O ATOM 3442 CB VAL B 70 -8.583 -0.755 1.407 1.00 0.00 C ATOM 3443 CG1 VAL B 70 -7.700 -0.338 0.228 1.00 0.00 C ATOM 3444 CG2 VAL B 70 -8.238 0.104 2.627 1.00 0.00 C ATOM 0 H VAL B 70 -10.379 1.072 2.334 1.00 0.00 H new ATOM 0 HA VAL B 70 -10.195 -0.728 -0.024 1.00 0.00 H new ATOM 0 HB VAL B 70 -8.408 -1.806 1.636 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -6.652 -0.482 0.490 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -7.943 -0.947 -0.642 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -7.875 0.712 -0.004 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -7.189 -0.037 2.886 1.00 0.00 H new ATOM 0 HG22 VAL B 70 -8.417 1.154 2.395 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -8.863 -0.193 3.469 1.00 0.00 H new ATOM 3454 N LEU B 71 -11.318 -2.630 1.146 1.00 0.00 N ATOM 3455 CA LEU B 71 -12.148 -3.655 1.774 1.00 0.00 C ATOM 3456 C LEU B 71 -11.286 -4.813 2.272 1.00 0.00 C ATOM 3457 O LEU B 71 -10.570 -5.443 1.494 1.00 0.00 O ATOM 3458 CB LEU B 71 -13.176 -4.182 0.767 1.00 0.00 C ATOM 3459 CG LEU B 71 -14.355 -3.210 0.668 1.00 0.00 C ATOM 3460 CD1 LEU B 71 -13.836 -1.794 0.402 1.00 0.00 C ATOM 3461 CD2 LEU B 71 -15.270 -3.641 -0.481 1.00 0.00 C ATOM 0 H LEU B 71 -11.080 -2.816 0.172 1.00 0.00 H new ATOM 0 HA LEU B 71 -12.664 -3.208 2.624 1.00 0.00 H new ATOM 0 HB2 LEU B 71 -12.711 -4.303 -0.211 1.00 0.00 H new ATOM 0 HB3 LEU B 71 -13.529 -5.166 1.076 1.00 0.00 H new ATOM 0 HG LEU B 71 -14.912 -3.219 1.605 1.00 0.00 H new ATOM 0 HD11 LEU B 71 -14.678 -1.105 0.332 1.00 0.00 H new ATOM 0 HD12 LEU B 71 -13.182 -1.487 1.218 1.00 0.00 H new ATOM 0 HD13 LEU B 71 -13.278 -1.781 -0.534 1.00 0.00 H new ATOM 0 HD21 LEU B 71 -16.111 -2.951 -0.555 1.00 0.00 H new ATOM 0 HD22 LEU B 71 -14.709 -3.631 -1.416 1.00 0.00 H new ATOM 0 HD23 LEU B 71 -15.642 -4.648 -0.292 1.00 0.00 H new ATOM 3473 N ARG B 72 -11.364 -5.091 3.571 1.00 0.00 N ATOM 3474 CA ARG B 72 -10.590 -6.180 4.158 1.00 0.00 C ATOM 3475 C ARG B 72 -11.357 -7.493 4.046 1.00 0.00 C ATOM 3476 O ARG B 72 -12.073 -7.887 4.967 1.00 0.00 O ATOM 3477 CB ARG B 72 -10.293 -5.879 5.630 1.00 0.00 C ATOM 3478 CG ARG B 72 -9.126 -6.748 6.106 1.00 0.00 C ATOM 3479 CD ARG B 72 -8.946 -6.579 7.616 1.00 0.00 C ATOM 3480 NE ARG B 72 -9.998 -7.291 8.332 1.00 0.00 N ATOM 3481 CZ ARG B 72 -10.198 -7.098 9.632 1.00 0.00 C ATOM 3482 NH1 ARG B 72 -9.446 -6.258 10.290 1.00 0.00 N ATOM 3483 NH2 ARG B 72 -11.145 -7.748 10.250 1.00 0.00 N ATOM 0 H ARG B 72 -11.950 -4.582 4.232 1.00 0.00 H new ATOM 0 HA ARG B 72 -9.650 -6.271 3.614 1.00 0.00 H new ATOM 0 HB2 ARG B 72 -10.048 -4.824 5.754 1.00 0.00 H new ATOM 0 HB3 ARG B 72 -11.177 -6.075 6.237 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -9.317 -7.794 5.867 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -8.211 -6.464 5.586 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -7.970 -6.958 7.918 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -8.971 -5.521 7.876 1.00 0.00 H new ATOM 0 HE ARG B 72 -10.591 -7.949 7.826 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -8.705 -5.750 9.807 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -9.599 -6.110 11.287 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -11.732 -8.405 9.736 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -11.298 -7.600 11.247 1.00 0.00 H new ATOM 3497 N LEU B 73 -11.206 -8.163 2.908 1.00 0.00 N ATOM 3498 CA LEU B 73 -11.892 -9.429 2.679 1.00 0.00 C ATOM 3499 C LEU B 73 -11.626 -10.402 3.824 1.00 0.00 C ATOM 3500 O LEU B 73 -10.478 -10.734 4.116 1.00 0.00 O ATOM 3501 CB LEU B 73 -11.423 -10.049 1.358 1.00 0.00 C ATOM 3502 CG LEU B 73 -11.784 -9.120 0.184 1.00 0.00 C ATOM 3503 CD1 LEU B 73 -10.547 -8.331 -0.257 1.00 0.00 C ATOM 3504 CD2 LEU B 73 -12.291 -9.956 -0.995 1.00 0.00 C ATOM 0 H LEU B 73 -10.618 -7.853 2.134 1.00 0.00 H new ATOM 0 HA LEU B 73 -12.963 -9.233 2.628 1.00 0.00 H new ATOM 0 HB2 LEU B 73 -10.346 -10.212 1.385 1.00 0.00 H new ATOM 0 HB3 LEU B 73 -11.890 -11.024 1.218 1.00 0.00 H new ATOM 0 HG LEU B 73 -12.561 -8.427 0.507 1.00 0.00 H new ATOM 0 HD11 LEU B 73 -10.810 -7.676 -1.088 1.00 0.00 H new ATOM 0 HD12 LEU B 73 -10.182 -7.731 0.577 1.00 0.00 H new ATOM 0 HD13 LEU B 73 -9.768 -9.024 -0.574 1.00 0.00 H new ATOM 0 HD21 LEU B 73 -12.546 -9.297 -1.825 1.00 0.00 H new ATOM 0 HD22 LEU B 73 -11.513 -10.651 -1.309 1.00 0.00 H new ATOM 0 HD23 LEU B 73 -13.176 -10.515 -0.691 1.00 0.00 H new