USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1126 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 58 MET CE :methyl -160:sc= -0.154 (180deg=-0.712) USER MOD Set 1.2: B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: B 10 GLN : amide:sc= 0 X(o=-1.2,f=-1.1) USER MOD Set 2.2: B 27 LYS NZ :NH3+ -178:sc= -1.16 (180deg=-1.18) USER MOD Set 3.1: B 14 THR OG1 : rot -171:sc= 0 USER MOD Set 3.2: B 53 ASN :FLIP amide:sc= -0.763 F(o=-1.5,f=-0.76) USER MOD Set 4.1: A 30 SER OG : rot 141:sc= 0.706 USER MOD Set 4.2: B 66 MET CE :methyl -144:sc= -4.05! (180deg=-9.16!) USER MOD Set 5.1: A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 34 HIS : no HD1:sc= -4.84! C(o=-4.8!,f=-6!) USER MOD Single : A 5 THR OG1 : rot 32:sc= 0.0808 USER MOD Single : A 10 GLN : amide:sc= -0.415 X(o=-0.41,f=0) USER MOD Single : A 13 GLN : amide:sc= -0.117 K(o=-0.12,f=-1.8!) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= -0.377 K(o=-0.38,f=-2.7!) USER MOD Single : A 19 HIS : no HD1:sc= -0.255 X(o=-0.26,f=-0.11) USER MOD Single : A 21 LYS NZ :NH3+ -169:sc= -0.0631 (180deg=-0.0865) USER MOD Single : A 22 ASN : amide:sc= -5! C(o=-5!,f=-6.7!) USER MOD Single : A 24 GLN : amide:sc= -0.0995 K(o=-0.1,f=-2.8!) USER MOD Single : A 25 SER OG : rot 180:sc= -1.13 USER MOD Single : A 27 LYS NZ :NH3+ -178:sc=-0.00262 (180deg=-0.0083) USER MOD Single : A 37 GLN : amide:sc= -1.94 K(o=-1.9,f=-4.3!) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc=-0.00524 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -2.59! C(o=-2.6!,f=-3!) USER MOD Single : A 48 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.11 K(o=-0.11,f=-1) USER MOD Single : A 56 SER OG : rot 180:sc= -0.557 USER MOD Single : A 58 MET CE :methyl 162:sc= -0.679 (180deg=-2.24!) USER MOD Single : A 60 LYS NZ :NH3+ 136:sc= -0.442 (180deg=-2.2!) USER MOD Single : A 61 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0243) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 MET CE :methyl -147:sc= -4.75! (180deg=-8.39!) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -0.171 X(o=-0.17,f=-0.097) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -0.719 K(o=-0.72,f=-2.4!) USER MOD Single : B 5 THR OG1 : rot 41:sc= 0.0969 USER MOD Single : B 13 GLN : amide:sc= -0.292 K(o=-0.29,f=-2.2!) USER MOD Single : B 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 19 HIS : no HD1:sc= -0.294 X(o=-0.29,f=-0.11) USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 ASN : amide:sc= -2.36! C(o=-2.4!,f=-3.4!) USER MOD Single : B 24 GLN : amide:sc= -0.224 X(o=-0.22,f=-0.033) USER MOD Single : B 25 SER OG : rot 174:sc= -1.03 USER MOD Single : B 29 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000231) USER MOD Single : B 30 SER OG : rot 128:sc= 0.0664 USER MOD Single : B 34 HIS : no HD1:sc= -4.35! C(o=-4.4!,f=-5.3!) USER MOD Single : B 37 GLN :FLIP amide:sc= -0.944 F(o=-2.4!,f=-0.94) USER MOD Single : B 38 THR OG1 : rot 180:sc= 0 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 ASN : amide:sc= -2.76! C(o=-2.8!,f=-2.8!) USER MOD Single : B 48 GLN : amide:sc= -0.225 K(o=-0.22,f=-2.9!) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 SER OG : rot 177:sc= 0.4 USER MOD Single : B 60 LYS NZ :NH3+ 135:sc= -0.393 (180deg=-0.843) USER MOD Single : B 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 69 ASN : amide:sc= -2.26! C(o=-2.3!,f=-9.3!) USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 SER OG : rot 40:sc= 1.18 USER MOD Single : B 73 ASN : amide:sc= -0.242 K(o=-0.24,f=-1.5) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 5 -9.039 -15.666 -16.224 1.00 0.00 N ATOM 2 CA THR A 5 -9.790 -16.810 -15.737 1.00 0.00 C ATOM 3 C THR A 5 -9.000 -17.543 -14.651 1.00 0.00 C ATOM 4 O THR A 5 -9.520 -17.802 -13.567 1.00 0.00 O ATOM 5 CB THR A 5 -10.137 -17.693 -16.937 1.00 0.00 C ATOM 6 OG1 THR A 5 -11.117 -16.943 -17.649 1.00 0.00 O ATOM 7 CG2 THR A 5 -10.870 -18.973 -16.530 1.00 0.00 C ATOM 0 HA THR A 5 -10.721 -16.500 -15.264 1.00 0.00 H new ATOM 0 HB THR A 5 -9.224 -17.953 -17.472 1.00 0.00 H new ATOM 0 HG1 THR A 5 -10.944 -15.985 -17.533 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.093 -19.563 -17.419 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.240 -19.555 -15.857 1.00 0.00 H new ATOM 0 HG23 THR A 5 -11.800 -18.714 -16.024 1.00 0.00 H new ATOM 15 N GLU A 6 -7.755 -17.858 -14.980 1.00 0.00 N ATOM 16 CA GLU A 6 -6.888 -18.556 -14.047 1.00 0.00 C ATOM 17 C GLU A 6 -5.711 -17.665 -13.647 1.00 0.00 C ATOM 18 O GLU A 6 -4.636 -17.748 -14.238 1.00 0.00 O ATOM 19 CB GLU A 6 -6.398 -19.879 -14.638 1.00 0.00 C ATOM 20 CG GLU A 6 -5.968 -20.848 -13.535 1.00 0.00 C ATOM 21 CD GLU A 6 -5.175 -22.022 -14.113 1.00 0.00 C ATOM 22 OE1 GLU A 6 -5.618 -22.546 -15.158 1.00 0.00 O ATOM 23 OE2 GLU A 6 -4.144 -22.368 -13.498 1.00 0.00 O ATOM 0 H GLU A 6 -7.327 -17.642 -15.880 1.00 0.00 H new ATOM 0 HA GLU A 6 -7.464 -18.788 -13.151 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -7.191 -20.330 -15.234 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -5.560 -19.693 -15.310 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -5.360 -20.321 -12.800 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -6.848 -21.222 -13.011 1.00 0.00 H new ATOM 30 N LEU A 7 -5.955 -16.831 -12.646 1.00 0.00 N ATOM 31 CA LEU A 7 -4.928 -15.925 -12.160 1.00 0.00 C ATOM 32 C LEU A 7 -4.381 -16.446 -10.829 1.00 0.00 C ATOM 33 O LEU A 7 -4.964 -17.345 -10.224 1.00 0.00 O ATOM 34 CB LEU A 7 -5.467 -14.495 -12.085 1.00 0.00 C ATOM 35 CG LEU A 7 -5.853 -13.853 -13.419 1.00 0.00 C ATOM 36 CD1 LEU A 7 -7.298 -14.191 -13.793 1.00 0.00 C ATOM 37 CD2 LEU A 7 -5.605 -12.344 -13.393 1.00 0.00 C ATOM 0 H LEU A 7 -6.849 -16.764 -12.159 1.00 0.00 H new ATOM 0 HA LEU A 7 -4.091 -15.890 -12.857 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.343 -14.491 -11.436 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -4.714 -13.868 -11.607 1.00 0.00 H new ATOM 0 HG LEU A 7 -5.214 -14.271 -14.197 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -7.547 -13.722 -14.745 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -7.408 -15.272 -13.881 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -7.970 -13.820 -13.019 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -5.888 -11.912 -14.353 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -6.202 -11.891 -12.602 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -4.548 -12.152 -13.206 1.00 0.00 H new ATOM 49 N ARG A 8 -3.268 -15.861 -10.413 1.00 0.00 N ATOM 50 CA ARG A 8 -2.637 -16.255 -9.165 1.00 0.00 C ATOM 51 C ARG A 8 -2.217 -15.018 -8.369 1.00 0.00 C ATOM 52 O ARG A 8 -2.908 -14.001 -8.385 1.00 0.00 O ATOM 53 CB ARG A 8 -1.407 -17.129 -9.423 1.00 0.00 C ATOM 54 CG ARG A 8 -1.657 -18.099 -10.579 1.00 0.00 C ATOM 55 CD ARG A 8 -0.598 -19.203 -10.606 1.00 0.00 C ATOM 56 NE ARG A 8 -1.103 -20.371 -11.363 1.00 0.00 N ATOM 57 CZ ARG A 8 -0.401 -21.494 -11.568 1.00 0.00 C ATOM 58 NH1 ARG A 8 0.839 -21.608 -11.075 1.00 0.00 N ATOM 59 NH2 ARG A 8 -0.940 -22.502 -12.267 1.00 0.00 N ATOM 0 H ARG A 8 -2.787 -15.117 -10.918 1.00 0.00 H new ATOM 0 HA ARG A 8 -3.364 -16.830 -8.592 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -0.549 -16.497 -9.653 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -1.158 -17.689 -8.521 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -2.648 -18.543 -10.479 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -1.645 -17.555 -11.524 1.00 0.00 H new ATOM 0 HD2 ARG A 8 0.317 -18.829 -11.066 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -0.345 -19.501 -9.588 1.00 0.00 H new ATOM 0 HE ARG A 8 -2.044 -20.318 -11.753 1.00 0.00 H new ATOM 0 HH11 ARG A 8 1.249 -20.840 -10.543 1.00 0.00 H new ATOM 0 HH12 ARG A 8 1.373 -22.463 -11.231 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -1.884 -22.414 -12.643 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -0.406 -23.357 -12.423 1.00 0.00 H new ATOM 73 N CYS A 9 -1.085 -15.146 -7.691 1.00 0.00 N ATOM 74 CA CYS A 9 -0.565 -14.051 -6.890 1.00 0.00 C ATOM 75 C CYS A 9 0.425 -13.258 -7.746 1.00 0.00 C ATOM 76 O CYS A 9 1.044 -13.807 -8.655 1.00 0.00 O ATOM 77 CB CYS A 9 0.075 -14.552 -5.594 1.00 0.00 C ATOM 78 SG CYS A 9 -1.112 -15.044 -4.292 1.00 0.00 S ATOM 0 H CYS A 9 -0.514 -15.991 -7.680 1.00 0.00 H new ATOM 0 HA CYS A 9 -1.384 -13.399 -6.585 1.00 0.00 H new ATOM 0 HB2 CYS A 9 0.712 -15.405 -5.826 1.00 0.00 H new ATOM 0 HB3 CYS A 9 0.722 -13.769 -5.199 1.00 0.00 H new ATOM 83 N GLN A 10 0.543 -11.978 -7.424 1.00 0.00 N ATOM 84 CA GLN A 10 1.447 -11.104 -8.152 1.00 0.00 C ATOM 85 C GLN A 10 2.822 -11.085 -7.481 1.00 0.00 C ATOM 86 O GLN A 10 3.692 -10.304 -7.863 1.00 0.00 O ATOM 87 CB GLN A 10 0.872 -9.690 -8.263 1.00 0.00 C ATOM 88 CG GLN A 10 1.405 -8.977 -9.508 1.00 0.00 C ATOM 89 CD GLN A 10 0.744 -7.609 -9.681 1.00 0.00 C ATOM 90 OE1 GLN A 10 0.179 -7.290 -10.715 1.00 0.00 O ATOM 91 NE2 GLN A 10 0.845 -6.820 -8.615 1.00 0.00 N ATOM 0 H GLN A 10 0.028 -11.525 -6.669 1.00 0.00 H new ATOM 0 HA GLN A 10 1.563 -11.494 -9.163 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -0.216 -9.738 -8.305 1.00 0.00 H new ATOM 0 HB3 GLN A 10 1.131 -9.117 -7.373 1.00 0.00 H new ATOM 0 HG2 GLN A 10 2.485 -8.855 -9.427 1.00 0.00 H new ATOM 0 HG3 GLN A 10 1.218 -9.589 -10.390 1.00 0.00 H new ATOM 0 HE21 GLN A 10 1.332 -7.149 -7.781 1.00 0.00 H new ATOM 0 HE22 GLN A 10 0.436 -5.886 -8.631 1.00 0.00 H new ATOM 100 N CYS A 11 2.975 -11.954 -6.493 1.00 0.00 N ATOM 101 CA CYS A 11 4.229 -12.047 -5.766 1.00 0.00 C ATOM 102 C CYS A 11 4.700 -13.502 -5.803 1.00 0.00 C ATOM 103 O CYS A 11 4.046 -14.384 -5.248 1.00 0.00 O ATOM 104 CB CYS A 11 4.092 -11.528 -4.333 1.00 0.00 C ATOM 105 SG CYS A 11 4.794 -9.862 -4.049 1.00 0.00 S ATOM 0 H CYS A 11 2.251 -12.600 -6.179 1.00 0.00 H new ATOM 0 HA CYS A 11 4.976 -11.412 -6.243 1.00 0.00 H new ATOM 0 HB2 CYS A 11 3.035 -11.512 -4.067 1.00 0.00 H new ATOM 0 HB3 CYS A 11 4.579 -12.232 -3.659 1.00 0.00 H new ATOM 110 N LEU A 12 5.830 -13.709 -6.463 1.00 0.00 N ATOM 111 CA LEU A 12 6.395 -15.042 -6.581 1.00 0.00 C ATOM 112 C LEU A 12 7.289 -15.320 -5.371 1.00 0.00 C ATOM 113 O LEU A 12 7.490 -16.474 -4.995 1.00 0.00 O ATOM 114 CB LEU A 12 7.110 -15.205 -7.924 1.00 0.00 C ATOM 115 CG LEU A 12 6.348 -14.707 -9.154 1.00 0.00 C ATOM 116 CD1 LEU A 12 7.313 -14.239 -10.244 1.00 0.00 C ATOM 117 CD2 LEU A 12 5.377 -15.774 -9.666 1.00 0.00 C ATOM 0 H LEU A 12 6.370 -12.975 -6.922 1.00 0.00 H new ATOM 0 HA LEU A 12 5.605 -15.793 -6.574 1.00 0.00 H new ATOM 0 HB2 LEU A 12 8.062 -14.677 -7.873 1.00 0.00 H new ATOM 0 HB3 LEU A 12 7.338 -16.261 -8.066 1.00 0.00 H new ATOM 0 HG LEU A 12 5.751 -13.843 -8.860 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.746 -13.890 -11.107 1.00 0.00 H new ATOM 0 HD12 LEU A 12 7.928 -13.425 -9.861 1.00 0.00 H new ATOM 0 HD13 LEU A 12 7.954 -15.068 -10.543 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.848 -15.395 -10.540 1.00 0.00 H new ATOM 0 HD22 LEU A 12 5.933 -16.671 -9.939 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.658 -16.017 -8.884 1.00 0.00 H new ATOM 129 N GLN A 13 7.803 -14.243 -4.794 1.00 0.00 N ATOM 130 CA GLN A 13 8.671 -14.357 -3.635 1.00 0.00 C ATOM 131 C GLN A 13 8.272 -13.333 -2.570 1.00 0.00 C ATOM 132 O GLN A 13 7.351 -12.544 -2.777 1.00 0.00 O ATOM 133 CB GLN A 13 10.139 -14.192 -4.031 1.00 0.00 C ATOM 134 CG GLN A 13 11.048 -15.025 -3.125 1.00 0.00 C ATOM 135 CD GLN A 13 12.279 -15.519 -3.888 1.00 0.00 C ATOM 136 OE1 GLN A 13 12.516 -15.166 -5.031 1.00 0.00 O ATOM 137 NE2 GLN A 13 13.046 -16.355 -3.194 1.00 0.00 N ATOM 0 H GLN A 13 7.635 -13.287 -5.108 1.00 0.00 H new ATOM 0 HA GLN A 13 8.553 -15.355 -3.214 1.00 0.00 H new ATOM 0 HB2 GLN A 13 10.276 -14.497 -5.069 1.00 0.00 H new ATOM 0 HB3 GLN A 13 10.421 -13.141 -3.967 1.00 0.00 H new ATOM 0 HG2 GLN A 13 11.362 -14.427 -2.270 1.00 0.00 H new ATOM 0 HG3 GLN A 13 10.493 -15.877 -2.732 1.00 0.00 H new ATOM 0 HE21 GLN A 13 12.790 -16.610 -2.240 1.00 0.00 H new ATOM 0 HE22 GLN A 13 13.891 -16.741 -3.616 1.00 0.00 H new ATOM 146 N THR A 14 8.984 -13.378 -1.454 1.00 0.00 N ATOM 147 CA THR A 14 8.716 -12.464 -0.357 1.00 0.00 C ATOM 148 C THR A 14 9.943 -12.343 0.549 1.00 0.00 C ATOM 149 O THR A 14 10.813 -13.213 0.540 1.00 0.00 O ATOM 150 CB THR A 14 7.466 -12.958 0.375 1.00 0.00 C ATOM 151 OG1 THR A 14 7.664 -14.365 0.489 1.00 0.00 O ATOM 152 CG2 THR A 14 6.200 -12.828 -0.474 1.00 0.00 C ATOM 0 H THR A 14 9.747 -14.034 -1.286 1.00 0.00 H new ATOM 0 HA THR A 14 8.520 -11.456 -0.721 1.00 0.00 H new ATOM 0 HB THR A 14 7.342 -12.396 1.300 1.00 0.00 H new ATOM 0 HG1 THR A 14 6.900 -14.766 0.954 1.00 0.00 H new ATOM 0 HG21 THR A 14 5.343 -13.192 0.093 1.00 0.00 H new ATOM 0 HG22 THR A 14 6.043 -11.782 -0.736 1.00 0.00 H new ATOM 0 HG23 THR A 14 6.310 -13.417 -1.384 1.00 0.00 H new ATOM 160 N LEU A 15 9.973 -11.259 1.309 1.00 0.00 N ATOM 161 CA LEU A 15 11.079 -11.013 2.219 1.00 0.00 C ATOM 162 C LEU A 15 10.540 -10.877 3.644 1.00 0.00 C ATOM 163 O LEU A 15 9.546 -10.191 3.873 1.00 0.00 O ATOM 164 CB LEU A 15 11.897 -9.807 1.753 1.00 0.00 C ATOM 165 CG LEU A 15 12.376 -9.841 0.301 1.00 0.00 C ATOM 166 CD1 LEU A 15 12.242 -8.465 -0.354 1.00 0.00 C ATOM 167 CD2 LEU A 15 13.804 -10.383 0.207 1.00 0.00 C ATOM 0 H LEU A 15 9.249 -10.540 1.314 1.00 0.00 H new ATOM 0 HA LEU A 15 11.769 -11.857 2.218 1.00 0.00 H new ATOM 0 HB2 LEU A 15 11.296 -8.909 1.895 1.00 0.00 H new ATOM 0 HB3 LEU A 15 12.769 -9.713 2.400 1.00 0.00 H new ATOM 0 HG LEU A 15 11.734 -10.525 -0.254 1.00 0.00 H new ATOM 0 HD11 LEU A 15 12.590 -8.518 -1.386 1.00 0.00 H new ATOM 0 HD12 LEU A 15 11.197 -8.155 -0.338 1.00 0.00 H new ATOM 0 HD13 LEU A 15 12.844 -7.741 0.195 1.00 0.00 H new ATOM 0 HD21 LEU A 15 14.120 -10.397 -0.836 1.00 0.00 H new ATOM 0 HD22 LEU A 15 14.474 -9.743 0.781 1.00 0.00 H new ATOM 0 HD23 LEU A 15 13.836 -11.396 0.609 1.00 0.00 H new ATOM 179 N GLN A 16 11.221 -11.543 4.566 1.00 0.00 N ATOM 180 CA GLN A 16 10.823 -11.506 5.963 1.00 0.00 C ATOM 181 C GLN A 16 11.735 -10.561 6.749 1.00 0.00 C ATOM 182 O GLN A 16 12.516 -11.004 7.590 1.00 0.00 O ATOM 183 CB GLN A 16 10.831 -12.909 6.573 1.00 0.00 C ATOM 184 CG GLN A 16 10.761 -12.844 8.099 1.00 0.00 C ATOM 185 CD GLN A 16 9.663 -13.763 8.638 1.00 0.00 C ATOM 186 OE1 GLN A 16 9.053 -14.533 7.915 1.00 0.00 O ATOM 187 NE2 GLN A 16 9.447 -13.640 9.945 1.00 0.00 N ATOM 0 H GLN A 16 12.046 -12.111 4.372 1.00 0.00 H new ATOM 0 HA GLN A 16 9.803 -11.127 6.020 1.00 0.00 H new ATOM 0 HB2 GLN A 16 9.985 -13.480 6.191 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.735 -13.436 6.269 1.00 0.00 H new ATOM 0 HG2 GLN A 16 11.723 -13.133 8.523 1.00 0.00 H new ATOM 0 HG3 GLN A 16 10.569 -11.818 8.414 1.00 0.00 H new ATOM 0 HE21 GLN A 16 9.994 -12.975 10.492 1.00 0.00 H new ATOM 0 HE22 GLN A 16 8.734 -14.211 10.400 1.00 0.00 H new ATOM 196 N GLY A 17 11.605 -9.278 6.447 1.00 0.00 N ATOM 197 CA GLY A 17 12.407 -8.267 7.115 1.00 0.00 C ATOM 198 C GLY A 17 13.446 -7.673 6.161 1.00 0.00 C ATOM 199 O GLY A 17 14.453 -8.311 5.859 1.00 0.00 O ATOM 0 H GLY A 17 10.956 -8.915 5.749 1.00 0.00 H new ATOM 0 HA2 GLY A 17 11.760 -7.475 7.492 1.00 0.00 H new ATOM 0 HA3 GLY A 17 12.909 -8.707 7.977 1.00 0.00 H new ATOM 203 N ILE A 18 13.165 -6.458 5.714 1.00 0.00 N ATOM 204 CA ILE A 18 14.062 -5.771 4.801 1.00 0.00 C ATOM 205 C ILE A 18 14.308 -4.348 5.309 1.00 0.00 C ATOM 206 O ILE A 18 13.527 -3.824 6.101 1.00 0.00 O ATOM 207 CB ILE A 18 13.519 -5.828 3.372 1.00 0.00 C ATOM 208 CG1 ILE A 18 13.790 -7.193 2.737 1.00 0.00 C ATOM 209 CG2 ILE A 18 14.078 -4.682 2.526 1.00 0.00 C ATOM 210 CD1 ILE A 18 15.241 -7.299 2.262 1.00 0.00 C ATOM 0 H ILE A 18 12.329 -5.932 5.967 1.00 0.00 H new ATOM 0 HA ILE A 18 15.030 -6.271 4.770 1.00 0.00 H new ATOM 0 HB ILE A 18 12.437 -5.700 3.413 1.00 0.00 H new ATOM 0 HG12 ILE A 18 13.582 -7.982 3.460 1.00 0.00 H new ATOM 0 HG13 ILE A 18 13.116 -7.346 1.894 1.00 0.00 H new ATOM 0 HG21 ILE A 18 13.676 -4.746 1.515 1.00 0.00 H new ATOM 0 HG22 ILE A 18 13.792 -3.729 2.970 1.00 0.00 H new ATOM 0 HG23 ILE A 18 15.165 -4.753 2.489 1.00 0.00 H new ATOM 0 HD11 ILE A 18 15.407 -8.279 1.815 1.00 0.00 H new ATOM 0 HD12 ILE A 18 15.439 -6.524 1.522 1.00 0.00 H new ATOM 0 HD13 ILE A 18 15.912 -7.170 3.111 1.00 0.00 H new ATOM 222 N HIS A 19 15.398 -3.764 4.832 1.00 0.00 N ATOM 223 CA HIS A 19 15.756 -2.413 5.227 1.00 0.00 C ATOM 224 C HIS A 19 14.764 -1.420 4.620 1.00 0.00 C ATOM 225 O HIS A 19 14.420 -1.521 3.443 1.00 0.00 O ATOM 226 CB HIS A 19 17.207 -2.105 4.853 1.00 0.00 C ATOM 227 CG HIS A 19 17.992 -1.422 5.948 1.00 0.00 C ATOM 228 ND1 HIS A 19 19.375 -1.442 6.004 1.00 0.00 N ATOM 229 CD2 HIS A 19 17.574 -0.698 7.026 1.00 0.00 C ATOM 230 CE1 HIS A 19 19.761 -0.760 7.072 1.00 0.00 C ATOM 231 NE2 HIS A 19 18.643 -0.300 7.704 1.00 0.00 N ATOM 0 H HIS A 19 16.044 -4.202 4.176 1.00 0.00 H new ATOM 0 HA HIS A 19 15.693 -2.319 6.311 1.00 0.00 H new ATOM 0 HB2 HIS A 19 17.708 -3.036 4.587 1.00 0.00 H new ATOM 0 HB3 HIS A 19 17.216 -1.473 3.965 1.00 0.00 H new ATOM 0 HD2 HIS A 19 16.547 -0.485 7.284 1.00 0.00 H new ATOM 0 HE1 HIS A 19 20.781 -0.597 7.387 1.00 0.00 H new ATOM 0 HE2 HIS A 19 18.631 0.258 8.558 1.00 0.00 H new ATOM 239 N LEU A 20 14.330 -0.483 5.451 1.00 0.00 N ATOM 240 CA LEU A 20 13.384 0.528 5.011 1.00 0.00 C ATOM 241 C LEU A 20 14.145 1.682 4.355 1.00 0.00 C ATOM 242 O LEU A 20 13.562 2.722 4.053 1.00 0.00 O ATOM 243 CB LEU A 20 12.487 0.963 6.171 1.00 0.00 C ATOM 244 CG LEU A 20 11.844 2.345 6.040 1.00 0.00 C ATOM 245 CD1 LEU A 20 11.068 2.467 4.727 1.00 0.00 C ATOM 246 CD2 LEU A 20 10.967 2.660 7.254 1.00 0.00 C ATOM 0 H LEU A 20 14.616 -0.403 6.427 1.00 0.00 H new ATOM 0 HA LEU A 20 12.713 0.119 4.256 1.00 0.00 H new ATOM 0 HB2 LEU A 20 11.694 0.225 6.287 1.00 0.00 H new ATOM 0 HB3 LEU A 20 13.077 0.944 7.087 1.00 0.00 H new ATOM 0 HG LEU A 20 12.640 3.090 6.015 1.00 0.00 H new ATOM 0 HD11 LEU A 20 10.621 3.459 4.659 1.00 0.00 H new ATOM 0 HD12 LEU A 20 11.747 2.317 3.888 1.00 0.00 H new ATOM 0 HD13 LEU A 20 10.282 1.712 4.697 1.00 0.00 H new ATOM 0 HD21 LEU A 20 10.522 3.648 7.135 1.00 0.00 H new ATOM 0 HD22 LEU A 20 10.177 1.914 7.335 1.00 0.00 H new ATOM 0 HD23 LEU A 20 11.577 2.643 8.157 1.00 0.00 H new ATOM 258 N LYS A 21 15.435 1.460 4.155 1.00 0.00 N ATOM 259 CA LYS A 21 16.282 2.468 3.540 1.00 0.00 C ATOM 260 C LYS A 21 16.296 2.262 2.024 1.00 0.00 C ATOM 261 O LYS A 21 16.556 3.197 1.269 1.00 0.00 O ATOM 262 CB LYS A 21 17.674 2.458 4.175 1.00 0.00 C ATOM 263 CG LYS A 21 18.734 2.937 3.181 1.00 0.00 C ATOM 264 CD LYS A 21 18.479 4.386 2.763 1.00 0.00 C ATOM 265 CE LYS A 21 18.798 4.595 1.281 1.00 0.00 C ATOM 266 NZ LYS A 21 17.778 5.459 0.648 1.00 0.00 N ATOM 0 H LYS A 21 15.915 0.596 4.408 1.00 0.00 H new ATOM 0 HA LYS A 21 15.881 3.465 3.722 1.00 0.00 H new ATOM 0 HB2 LYS A 21 17.680 3.100 5.056 1.00 0.00 H new ATOM 0 HB3 LYS A 21 17.916 1.450 4.513 1.00 0.00 H new ATOM 0 HG2 LYS A 21 19.723 2.853 3.631 1.00 0.00 H new ATOM 0 HG3 LYS A 21 18.729 2.295 2.301 1.00 0.00 H new ATOM 0 HD2 LYS A 21 17.438 4.645 2.954 1.00 0.00 H new ATOM 0 HD3 LYS A 21 19.091 5.055 3.368 1.00 0.00 H new ATOM 0 HE2 LYS A 21 19.783 5.049 1.176 1.00 0.00 H new ATOM 0 HE3 LYS A 21 18.834 3.632 0.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 17.900 5.440 -0.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 16.829 5.111 0.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 17.887 6.434 0.992 1.00 0.00 H new ATOM 280 N ASN A 22 16.013 1.031 1.624 1.00 0.00 N ATOM 281 CA ASN A 22 15.989 0.690 0.212 1.00 0.00 C ATOM 282 C ASN A 22 14.572 0.881 -0.331 1.00 0.00 C ATOM 283 O ASN A 22 14.390 1.380 -1.441 1.00 0.00 O ATOM 284 CB ASN A 22 16.387 -0.771 -0.008 1.00 0.00 C ATOM 285 CG ASN A 22 17.778 -0.872 -0.636 1.00 0.00 C ATOM 286 OD1 ASN A 22 18.167 -0.079 -1.477 1.00 0.00 O ATOM 287 ND2 ASN A 22 18.504 -1.890 -0.182 1.00 0.00 N ATOM 0 H ASN A 22 15.798 0.257 2.253 1.00 0.00 H new ATOM 0 HA ASN A 22 16.697 1.339 -0.304 1.00 0.00 H new ATOM 0 HB2 ASN A 22 16.374 -1.302 0.944 1.00 0.00 H new ATOM 0 HB3 ASN A 22 15.656 -1.257 -0.654 1.00 0.00 H new ATOM 0 HD21 ASN A 22 19.447 -2.043 -0.539 1.00 0.00 H new ATOM 0 HD22 ASN A 22 18.118 -2.517 0.523 1.00 0.00 H new ATOM 294 N ILE A 23 13.603 0.474 0.476 1.00 0.00 N ATOM 295 CA ILE A 23 12.207 0.595 0.090 1.00 0.00 C ATOM 296 C ILE A 23 11.866 2.071 -0.117 1.00 0.00 C ATOM 297 O ILE A 23 12.117 2.899 0.757 1.00 0.00 O ATOM 298 CB ILE A 23 11.307 -0.107 1.109 1.00 0.00 C ATOM 299 CG1 ILE A 23 11.158 -1.593 0.777 1.00 0.00 C ATOM 300 CG2 ILE A 23 9.952 0.594 1.219 1.00 0.00 C ATOM 301 CD1 ILE A 23 11.443 -2.461 2.005 1.00 0.00 C ATOM 0 H ILE A 23 13.757 0.060 1.395 1.00 0.00 H new ATOM 0 HA ILE A 23 12.029 0.090 -0.860 1.00 0.00 H new ATOM 0 HB ILE A 23 11.783 -0.042 2.087 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.149 -1.789 0.415 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.843 -1.860 -0.028 1.00 0.00 H new ATOM 0 HG21 ILE A 23 9.332 0.075 1.950 1.00 0.00 H new ATOM 0 HG22 ILE A 23 10.101 1.626 1.537 1.00 0.00 H new ATOM 0 HG23 ILE A 23 9.456 0.582 0.248 1.00 0.00 H new ATOM 0 HD11 ILE A 23 11.330 -3.513 1.741 1.00 0.00 H new ATOM 0 HD12 ILE A 23 12.461 -2.281 2.350 1.00 0.00 H new ATOM 0 HD13 ILE A 23 10.741 -2.209 2.800 1.00 0.00 H new ATOM 313 N GLN A 24 11.299 2.357 -1.280 1.00 0.00 N ATOM 314 CA GLN A 24 10.920 3.719 -1.614 1.00 0.00 C ATOM 315 C GLN A 24 9.398 3.837 -1.717 1.00 0.00 C ATOM 316 O GLN A 24 8.851 4.936 -1.642 1.00 0.00 O ATOM 317 CB GLN A 24 11.595 4.174 -2.910 1.00 0.00 C ATOM 318 CG GLN A 24 12.181 5.579 -2.759 1.00 0.00 C ATOM 319 CD GLN A 24 11.893 6.430 -3.997 1.00 0.00 C ATOM 320 OE1 GLN A 24 12.785 6.854 -4.712 1.00 0.00 O ATOM 321 NE2 GLN A 24 10.599 6.655 -4.210 1.00 0.00 N ATOM 0 H GLN A 24 11.093 1.668 -2.003 1.00 0.00 H new ATOM 0 HA GLN A 24 11.262 4.377 -0.815 1.00 0.00 H new ATOM 0 HB2 GLN A 24 12.386 3.473 -3.178 1.00 0.00 H new ATOM 0 HB3 GLN A 24 10.871 4.164 -3.724 1.00 0.00 H new ATOM 0 HG2 GLN A 24 11.759 6.060 -1.877 1.00 0.00 H new ATOM 0 HG3 GLN A 24 13.258 5.513 -2.601 1.00 0.00 H new ATOM 0 HE21 GLN A 24 9.903 6.270 -3.572 1.00 0.00 H new ATOM 0 HE22 GLN A 24 10.303 7.212 -5.012 1.00 0.00 H new ATOM 330 N SER A 25 8.758 2.690 -1.888 1.00 0.00 N ATOM 331 CA SER A 25 7.310 2.651 -2.003 1.00 0.00 C ATOM 332 C SER A 25 6.786 1.285 -1.554 1.00 0.00 C ATOM 333 O SER A 25 7.519 0.297 -1.580 1.00 0.00 O ATOM 334 CB SER A 25 6.863 2.946 -3.436 1.00 0.00 C ATOM 335 OG SER A 25 7.936 3.424 -4.242 1.00 0.00 O ATOM 0 H SER A 25 9.215 1.780 -1.950 1.00 0.00 H new ATOM 0 HA SER A 25 6.895 3.423 -1.356 1.00 0.00 H new ATOM 0 HB2 SER A 25 6.451 2.040 -3.881 1.00 0.00 H new ATOM 0 HB3 SER A 25 6.063 3.686 -3.421 1.00 0.00 H new ATOM 0 HG SER A 25 7.611 3.599 -5.150 1.00 0.00 H new ATOM 341 N VAL A 26 5.523 1.273 -1.154 1.00 0.00 N ATOM 342 CA VAL A 26 4.893 0.045 -0.701 1.00 0.00 C ATOM 343 C VAL A 26 3.575 -0.154 -1.451 1.00 0.00 C ATOM 344 O VAL A 26 2.777 0.775 -1.569 1.00 0.00 O ATOM 345 CB VAL A 26 4.718 0.077 0.819 1.00 0.00 C ATOM 346 CG1 VAL A 26 3.733 -1.000 1.280 1.00 0.00 C ATOM 347 CG2 VAL A 26 6.064 -0.071 1.530 1.00 0.00 C ATOM 0 H VAL A 26 4.919 2.095 -1.134 1.00 0.00 H new ATOM 0 HA VAL A 26 5.526 -0.814 -0.924 1.00 0.00 H new ATOM 0 HB VAL A 26 4.303 1.048 1.088 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.627 -0.956 2.364 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.763 -0.830 0.813 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.107 -1.982 0.992 1.00 0.00 H new ATOM 0 HG21 VAL A 26 5.910 -0.045 2.609 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.520 -1.021 1.251 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.722 0.747 1.237 1.00 0.00 H new ATOM 357 N LYS A 27 3.386 -1.371 -1.939 1.00 0.00 N ATOM 358 CA LYS A 27 2.178 -1.704 -2.675 1.00 0.00 C ATOM 359 C LYS A 27 1.516 -2.926 -2.034 1.00 0.00 C ATOM 360 O LYS A 27 2.143 -3.975 -1.898 1.00 0.00 O ATOM 361 CB LYS A 27 2.489 -1.882 -4.162 1.00 0.00 C ATOM 362 CG LYS A 27 1.224 -1.724 -5.009 1.00 0.00 C ATOM 363 CD LYS A 27 0.278 -2.909 -4.807 1.00 0.00 C ATOM 364 CE LYS A 27 -0.121 -3.527 -6.149 1.00 0.00 C ATOM 365 NZ LYS A 27 -1.512 -3.161 -6.495 1.00 0.00 N ATOM 0 H LYS A 27 4.050 -2.139 -1.839 1.00 0.00 H new ATOM 0 HA LYS A 27 1.460 -0.886 -2.619 1.00 0.00 H new ATOM 0 HB2 LYS A 27 3.233 -1.148 -4.472 1.00 0.00 H new ATOM 0 HB3 LYS A 27 2.924 -2.867 -4.331 1.00 0.00 H new ATOM 0 HG2 LYS A 27 0.715 -0.798 -4.740 1.00 0.00 H new ATOM 0 HG3 LYS A 27 1.494 -1.645 -6.062 1.00 0.00 H new ATOM 0 HD2 LYS A 27 0.761 -3.663 -4.185 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -0.614 -2.580 -4.274 1.00 0.00 H new ATOM 0 HE2 LYS A 27 0.557 -3.183 -6.930 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -0.026 -4.612 -6.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -1.778 -3.616 -7.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -2.153 -3.481 -5.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -1.584 -2.128 -6.596 1.00 0.00 H new ATOM 379 N VAL A 28 0.259 -2.748 -1.657 1.00 0.00 N ATOM 380 CA VAL A 28 -0.495 -3.823 -1.034 1.00 0.00 C ATOM 381 C VAL A 28 -1.669 -4.206 -1.937 1.00 0.00 C ATOM 382 O VAL A 28 -2.555 -3.391 -2.189 1.00 0.00 O ATOM 383 CB VAL A 28 -0.933 -3.408 0.372 1.00 0.00 C ATOM 384 CG1 VAL A 28 -2.030 -4.334 0.900 1.00 0.00 C ATOM 385 CG2 VAL A 28 0.260 -3.371 1.329 1.00 0.00 C ATOM 0 H VAL A 28 -0.257 -1.875 -1.771 1.00 0.00 H new ATOM 0 HA VAL A 28 0.128 -4.709 -0.917 1.00 0.00 H new ATOM 0 HB VAL A 28 -1.345 -2.401 0.311 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.323 -4.017 1.901 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.894 -4.289 0.237 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.655 -5.357 0.939 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -0.079 -3.073 2.321 1.00 0.00 H new ATOM 0 HG22 VAL A 28 0.714 -4.360 1.382 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.995 -2.653 0.966 1.00 0.00 H new ATOM 395 N LYS A 29 -1.638 -5.448 -2.399 1.00 0.00 N ATOM 396 CA LYS A 29 -2.688 -5.950 -3.268 1.00 0.00 C ATOM 397 C LYS A 29 -3.314 -7.196 -2.638 1.00 0.00 C ATOM 398 O LYS A 29 -2.846 -8.311 -2.864 1.00 0.00 O ATOM 399 CB LYS A 29 -2.150 -6.179 -4.682 1.00 0.00 C ATOM 400 CG LYS A 29 -3.291 -6.249 -5.699 1.00 0.00 C ATOM 401 CD LYS A 29 -3.872 -7.662 -5.776 1.00 0.00 C ATOM 402 CE LYS A 29 -4.241 -8.025 -7.215 1.00 0.00 C ATOM 403 NZ LYS A 29 -3.820 -9.410 -7.525 1.00 0.00 N ATOM 0 H LYS A 29 -0.902 -6.121 -2.187 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.483 -5.211 -3.371 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -1.468 -5.372 -4.950 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -1.575 -7.105 -4.711 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -4.075 -5.545 -5.420 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -2.926 -5.948 -6.681 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -3.147 -8.379 -5.391 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.756 -7.731 -5.142 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -5.317 -7.925 -7.357 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -3.763 -7.330 -7.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -4.078 -9.640 -8.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -2.790 -9.494 -7.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.296 -10.071 -6.878 1.00 0.00 H new ATOM 417 N SER A 30 -4.362 -6.964 -1.862 1.00 0.00 N ATOM 418 CA SER A 30 -5.056 -8.054 -1.198 1.00 0.00 C ATOM 419 C SER A 30 -5.348 -9.175 -2.197 1.00 0.00 C ATOM 420 O SER A 30 -5.107 -9.023 -3.394 1.00 0.00 O ATOM 421 CB SER A 30 -6.355 -7.568 -0.552 1.00 0.00 C ATOM 422 OG SER A 30 -6.299 -7.627 0.871 1.00 0.00 O ATOM 0 H SER A 30 -4.747 -6.038 -1.678 1.00 0.00 H new ATOM 0 HA SER A 30 -4.411 -8.439 -0.408 1.00 0.00 H new ATOM 0 HB2 SER A 30 -6.554 -6.543 -0.865 1.00 0.00 H new ATOM 0 HB3 SER A 30 -7.186 -8.177 -0.908 1.00 0.00 H new ATOM 0 HG SER A 30 -6.739 -6.837 1.249 1.00 0.00 H new ATOM 428 N PRO A 31 -5.877 -10.305 -1.656 1.00 0.00 N ATOM 429 CA PRO A 31 -6.204 -11.451 -2.487 1.00 0.00 C ATOM 430 C PRO A 31 -7.480 -11.198 -3.292 1.00 0.00 C ATOM 431 O PRO A 31 -8.156 -10.189 -3.091 1.00 0.00 O ATOM 432 CB PRO A 31 -6.334 -12.615 -1.519 1.00 0.00 C ATOM 433 CG PRO A 31 -6.534 -11.995 -0.146 1.00 0.00 C ATOM 434 CD PRO A 31 -6.176 -10.521 -0.243 1.00 0.00 C ATOM 0 HA PRO A 31 -5.441 -11.658 -3.237 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -7.177 -13.253 -1.786 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -5.442 -13.241 -1.539 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -7.567 -12.116 0.181 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -5.906 -12.493 0.593 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -7.001 -9.890 0.088 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -5.318 -10.280 0.385 1.00 0.00 H new ATOM 442 N GLY A 32 -7.773 -12.131 -4.186 1.00 0.00 N ATOM 443 CA GLY A 32 -8.956 -12.021 -5.022 1.00 0.00 C ATOM 444 C GLY A 32 -9.576 -13.397 -5.277 1.00 0.00 C ATOM 445 O GLY A 32 -9.316 -14.345 -4.539 1.00 0.00 O ATOM 0 H GLY A 32 -7.211 -12.967 -4.350 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -9.687 -11.372 -4.540 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -8.693 -11.555 -5.972 1.00 0.00 H new ATOM 449 N PRO A 33 -10.406 -13.462 -6.353 1.00 0.00 N ATOM 450 CA PRO A 33 -11.065 -14.706 -6.715 1.00 0.00 C ATOM 451 C PRO A 33 -10.082 -15.677 -7.370 1.00 0.00 C ATOM 452 O PRO A 33 -10.466 -16.771 -7.782 1.00 0.00 O ATOM 453 CB PRO A 33 -12.200 -14.295 -7.639 1.00 0.00 C ATOM 454 CG PRO A 33 -11.853 -12.899 -8.130 1.00 0.00 C ATOM 455 CD PRO A 33 -10.737 -12.359 -7.250 1.00 0.00 C ATOM 0 HA PRO A 33 -11.449 -15.246 -5.850 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -12.296 -14.990 -8.473 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -13.154 -14.298 -7.111 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -11.536 -12.929 -9.173 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -12.727 -12.249 -8.081 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -9.874 -12.059 -7.844 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -11.062 -11.480 -6.694 1.00 0.00 H new ATOM 463 N HIS A 34 -8.833 -15.242 -7.448 1.00 0.00 N ATOM 464 CA HIS A 34 -7.792 -16.060 -8.046 1.00 0.00 C ATOM 465 C HIS A 34 -6.806 -16.509 -6.965 1.00 0.00 C ATOM 466 O HIS A 34 -6.530 -17.699 -6.827 1.00 0.00 O ATOM 467 CB HIS A 34 -7.111 -15.316 -9.197 1.00 0.00 C ATOM 468 CG HIS A 34 -7.049 -13.819 -9.010 1.00 0.00 C ATOM 469 ND1 HIS A 34 -8.176 -13.017 -9.008 1.00 0.00 N ATOM 470 CD2 HIS A 34 -5.985 -12.989 -8.817 1.00 0.00 C ATOM 471 CE1 HIS A 34 -7.796 -11.761 -8.822 1.00 0.00 C ATOM 472 NE2 HIS A 34 -6.437 -11.746 -8.705 1.00 0.00 N ATOM 0 H HIS A 34 -8.519 -14.334 -7.107 1.00 0.00 H new ATOM 0 HA HIS A 34 -8.234 -16.957 -8.480 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -6.097 -15.699 -9.314 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -7.644 -15.534 -10.123 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -4.950 -13.292 -8.764 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -8.447 -10.901 -8.772 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -5.863 -10.916 -8.556 1.00 0.00 H new ATOM 480 N CYS A 35 -6.302 -15.531 -6.227 1.00 0.00 N ATOM 481 CA CYS A 35 -5.353 -15.810 -5.163 1.00 0.00 C ATOM 482 C CYS A 35 -6.015 -15.467 -3.827 1.00 0.00 C ATOM 483 O CYS A 35 -6.482 -14.346 -3.631 1.00 0.00 O ATOM 484 CB CYS A 35 -4.041 -15.048 -5.361 1.00 0.00 C ATOM 485 SG CYS A 35 -2.532 -16.080 -5.262 1.00 0.00 S ATOM 0 H CYS A 35 -6.533 -14.545 -6.345 1.00 0.00 H new ATOM 0 HA CYS A 35 -5.089 -16.867 -5.176 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -4.065 -14.557 -6.334 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -3.977 -14.262 -4.609 1.00 0.00 H new ATOM 490 N ALA A 36 -6.034 -16.454 -2.942 1.00 0.00 N ATOM 491 CA ALA A 36 -6.631 -16.271 -1.630 1.00 0.00 C ATOM 492 C ALA A 36 -5.549 -15.842 -0.637 1.00 0.00 C ATOM 493 O ALA A 36 -5.690 -16.049 0.567 1.00 0.00 O ATOM 494 CB ALA A 36 -7.334 -17.562 -1.205 1.00 0.00 C ATOM 0 H ALA A 36 -5.646 -17.382 -3.108 1.00 0.00 H new ATOM 0 HA ALA A 36 -7.384 -15.483 -1.657 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.782 -17.425 -0.221 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -8.113 -17.807 -1.927 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -6.609 -18.375 -1.164 1.00 0.00 H new ATOM 500 N GLN A 37 -4.494 -15.252 -1.180 1.00 0.00 N ATOM 501 CA GLN A 37 -3.389 -14.792 -0.357 1.00 0.00 C ATOM 502 C GLN A 37 -2.985 -13.371 -0.755 1.00 0.00 C ATOM 503 O GLN A 37 -3.262 -12.933 -1.871 1.00 0.00 O ATOM 504 CB GLN A 37 -2.198 -15.747 -0.454 1.00 0.00 C ATOM 505 CG GLN A 37 -2.654 -17.204 -0.346 1.00 0.00 C ATOM 506 CD GLN A 37 -2.477 -17.933 -1.680 1.00 0.00 C ATOM 507 OE1 GLN A 37 -2.175 -17.343 -2.704 1.00 0.00 O ATOM 508 NE2 GLN A 37 -2.682 -19.245 -1.610 1.00 0.00 N ATOM 0 H GLN A 37 -4.381 -15.082 -2.179 1.00 0.00 H new ATOM 0 HA GLN A 37 -3.718 -14.778 0.682 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -1.680 -15.593 -1.401 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -1.484 -15.526 0.339 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -2.080 -17.712 0.429 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -3.701 -17.240 -0.044 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -2.933 -19.675 -0.720 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -2.589 -19.821 -2.447 1.00 0.00 H new ATOM 517 N THR A 38 -2.338 -12.689 0.179 1.00 0.00 N ATOM 518 CA THR A 38 -1.894 -11.327 -0.062 1.00 0.00 C ATOM 519 C THR A 38 -0.566 -11.325 -0.822 1.00 0.00 C ATOM 520 O THR A 38 0.137 -12.334 -0.853 1.00 0.00 O ATOM 521 CB THR A 38 -1.823 -10.608 1.287 1.00 0.00 C ATOM 522 OG1 THR A 38 -3.073 -10.904 1.904 1.00 0.00 O ATOM 523 CG2 THR A 38 -1.832 -9.085 1.140 1.00 0.00 C ATOM 0 H THR A 38 -2.111 -13.054 1.104 1.00 0.00 H new ATOM 0 HA THR A 38 -2.597 -10.788 -0.698 1.00 0.00 H new ATOM 0 HB THR A 38 -0.921 -10.916 1.816 1.00 0.00 H new ATOM 0 HG1 THR A 38 -3.112 -10.478 2.786 1.00 0.00 H new ATOM 0 HG21 THR A 38 -1.780 -8.624 2.126 1.00 0.00 H new ATOM 0 HG22 THR A 38 -0.973 -8.772 0.547 1.00 0.00 H new ATOM 0 HG23 THR A 38 -2.750 -8.773 0.642 1.00 0.00 H new ATOM 531 N GLU A 39 -0.263 -10.180 -1.415 1.00 0.00 N ATOM 532 CA GLU A 39 0.969 -10.033 -2.173 1.00 0.00 C ATOM 533 C GLU A 39 1.502 -8.605 -2.047 1.00 0.00 C ATOM 534 O GLU A 39 1.319 -7.788 -2.948 1.00 0.00 O ATOM 535 CB GLU A 39 0.758 -10.413 -3.640 1.00 0.00 C ATOM 536 CG GLU A 39 -0.636 -10.002 -4.118 1.00 0.00 C ATOM 537 CD GLU A 39 -1.653 -11.118 -3.867 1.00 0.00 C ATOM 538 OE1 GLU A 39 -1.377 -12.249 -4.321 1.00 0.00 O ATOM 539 OE2 GLU A 39 -2.682 -10.814 -3.226 1.00 0.00 O ATOM 0 H GLU A 39 -0.849 -9.345 -1.386 1.00 0.00 H new ATOM 0 HA GLU A 39 1.712 -10.715 -1.759 1.00 0.00 H new ATOM 0 HB2 GLU A 39 1.515 -9.929 -4.257 1.00 0.00 H new ATOM 0 HB3 GLU A 39 0.886 -11.488 -3.763 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -0.950 -9.096 -3.600 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -0.605 -9.766 -5.182 1.00 0.00 H new ATOM 546 N VAL A 40 2.152 -8.347 -0.922 1.00 0.00 N ATOM 547 CA VAL A 40 2.714 -7.032 -0.666 1.00 0.00 C ATOM 548 C VAL A 40 3.947 -6.828 -1.549 1.00 0.00 C ATOM 549 O VAL A 40 4.897 -7.607 -1.484 1.00 0.00 O ATOM 550 CB VAL A 40 3.014 -6.871 0.825 1.00 0.00 C ATOM 551 CG1 VAL A 40 3.663 -5.516 1.111 1.00 0.00 C ATOM 552 CG2 VAL A 40 1.748 -7.061 1.663 1.00 0.00 C ATOM 0 H VAL A 40 2.302 -9.027 -0.177 1.00 0.00 H new ATOM 0 HA VAL A 40 1.996 -6.254 -0.925 1.00 0.00 H new ATOM 0 HB VAL A 40 3.723 -7.648 1.109 1.00 0.00 H new ATOM 0 HG11 VAL A 40 3.866 -5.428 2.178 1.00 0.00 H new ATOM 0 HG12 VAL A 40 4.598 -5.436 0.556 1.00 0.00 H new ATOM 0 HG13 VAL A 40 2.989 -4.717 0.802 1.00 0.00 H new ATOM 0 HG21 VAL A 40 1.989 -6.941 2.719 1.00 0.00 H new ATOM 0 HG22 VAL A 40 1.005 -6.317 1.374 1.00 0.00 H new ATOM 0 HG23 VAL A 40 1.346 -8.060 1.494 1.00 0.00 H new ATOM 562 N ILE A 41 3.892 -5.778 -2.355 1.00 0.00 N ATOM 563 CA ILE A 41 4.992 -5.462 -3.250 1.00 0.00 C ATOM 564 C ILE A 41 5.488 -4.044 -2.961 1.00 0.00 C ATOM 565 O ILE A 41 4.747 -3.077 -3.129 1.00 0.00 O ATOM 566 CB ILE A 41 4.579 -5.684 -4.706 1.00 0.00 C ATOM 567 CG1 ILE A 41 3.782 -6.982 -4.859 1.00 0.00 C ATOM 568 CG2 ILE A 41 5.795 -5.646 -5.633 1.00 0.00 C ATOM 569 CD1 ILE A 41 2.390 -6.706 -5.430 1.00 0.00 C ATOM 0 H ILE A 41 3.102 -5.135 -2.407 1.00 0.00 H new ATOM 0 HA ILE A 41 5.831 -6.135 -3.075 1.00 0.00 H new ATOM 0 HB ILE A 41 3.922 -4.866 -5.003 1.00 0.00 H new ATOM 0 HG12 ILE A 41 4.319 -7.667 -5.515 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.691 -7.473 -3.890 1.00 0.00 H new ATOM 0 HG21 ILE A 41 5.473 -5.807 -6.662 1.00 0.00 H new ATOM 0 HG22 ILE A 41 6.283 -4.675 -5.553 1.00 0.00 H new ATOM 0 HG23 ILE A 41 6.496 -6.430 -5.346 1.00 0.00 H new ATOM 0 HD11 ILE A 41 1.845 -7.645 -5.529 1.00 0.00 H new ATOM 0 HD12 ILE A 41 1.847 -6.040 -4.760 1.00 0.00 H new ATOM 0 HD13 ILE A 41 2.485 -6.237 -6.409 1.00 0.00 H new ATOM 581 N ALA A 42 6.739 -3.965 -2.530 1.00 0.00 N ATOM 582 CA ALA A 42 7.343 -2.682 -2.216 1.00 0.00 C ATOM 583 C ALA A 42 8.368 -2.327 -3.295 1.00 0.00 C ATOM 584 O ALA A 42 9.104 -3.194 -3.765 1.00 0.00 O ATOM 585 CB ALA A 42 7.963 -2.738 -0.818 1.00 0.00 C ATOM 0 H ALA A 42 7.350 -4.769 -2.391 1.00 0.00 H new ATOM 0 HA ALA A 42 6.589 -1.895 -2.207 1.00 0.00 H new ATOM 0 HB1 ALA A 42 8.416 -1.775 -0.582 1.00 0.00 H new ATOM 0 HB2 ALA A 42 7.188 -2.963 -0.085 1.00 0.00 H new ATOM 0 HB3 ALA A 42 8.727 -3.515 -0.790 1.00 0.00 H new ATOM 591 N THR A 43 8.383 -1.053 -3.656 1.00 0.00 N ATOM 592 CA THR A 43 9.306 -0.573 -4.671 1.00 0.00 C ATOM 593 C THR A 43 10.634 -0.162 -4.032 1.00 0.00 C ATOM 594 O THR A 43 10.651 0.428 -2.953 1.00 0.00 O ATOM 595 CB THR A 43 8.621 0.562 -5.434 1.00 0.00 C ATOM 596 OG1 THR A 43 7.611 -0.092 -6.198 1.00 0.00 O ATOM 597 CG2 THR A 43 9.534 1.194 -6.487 1.00 0.00 C ATOM 0 H THR A 43 7.771 -0.338 -3.264 1.00 0.00 H new ATOM 0 HA THR A 43 9.554 -1.359 -5.384 1.00 0.00 H new ATOM 0 HB THR A 43 8.295 1.327 -4.730 1.00 0.00 H new ATOM 0 HG1 THR A 43 7.116 0.572 -6.723 1.00 0.00 H new ATOM 0 HG21 THR A 43 8.999 1.994 -6.999 1.00 0.00 H new ATOM 0 HG22 THR A 43 10.420 1.603 -6.002 1.00 0.00 H new ATOM 0 HG23 THR A 43 9.834 0.436 -7.211 1.00 0.00 H new ATOM 605 N LEU A 44 11.714 -0.489 -4.726 1.00 0.00 N ATOM 606 CA LEU A 44 13.043 -0.161 -4.241 1.00 0.00 C ATOM 607 C LEU A 44 13.420 1.246 -4.710 1.00 0.00 C ATOM 608 O LEU A 44 12.928 1.714 -5.735 1.00 0.00 O ATOM 609 CB LEU A 44 14.047 -1.238 -4.657 1.00 0.00 C ATOM 610 CG LEU A 44 14.968 -1.761 -3.553 1.00 0.00 C ATOM 611 CD1 LEU A 44 15.593 -3.100 -3.948 1.00 0.00 C ATOM 612 CD2 LEU A 44 16.027 -0.720 -3.184 1.00 0.00 C ATOM 0 H LEU A 44 11.695 -0.978 -5.621 1.00 0.00 H new ATOM 0 HA LEU A 44 13.058 -0.149 -3.151 1.00 0.00 H new ATOM 0 HB2 LEU A 44 13.494 -2.081 -5.071 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.666 -0.838 -5.460 1.00 0.00 H new ATOM 0 HG LEU A 44 14.366 -1.938 -2.662 1.00 0.00 H new ATOM 0 HD11 LEU A 44 16.243 -3.449 -3.146 1.00 0.00 H new ATOM 0 HD12 LEU A 44 14.805 -3.833 -4.121 1.00 0.00 H new ATOM 0 HD13 LEU A 44 16.177 -2.974 -4.859 1.00 0.00 H new ATOM 0 HD21 LEU A 44 16.669 -1.117 -2.397 1.00 0.00 H new ATOM 0 HD22 LEU A 44 16.630 -0.488 -4.062 1.00 0.00 H new ATOM 0 HD23 LEU A 44 15.537 0.187 -2.830 1.00 0.00 H new ATOM 624 N LYS A 45 14.290 1.879 -3.937 1.00 0.00 N ATOM 625 CA LYS A 45 14.739 3.223 -4.261 1.00 0.00 C ATOM 626 C LYS A 45 15.768 3.154 -5.392 1.00 0.00 C ATOM 627 O LYS A 45 16.277 4.182 -5.836 1.00 0.00 O ATOM 628 CB LYS A 45 15.250 3.934 -3.007 1.00 0.00 C ATOM 629 CG LYS A 45 15.542 5.409 -3.293 1.00 0.00 C ATOM 630 CD LYS A 45 17.033 5.633 -3.552 1.00 0.00 C ATOM 631 CE LYS A 45 17.572 6.778 -2.692 1.00 0.00 C ATOM 632 NZ LYS A 45 18.147 7.841 -3.547 1.00 0.00 N ATOM 0 H LYS A 45 14.696 1.487 -3.088 1.00 0.00 H new ATOM 0 HA LYS A 45 13.906 3.826 -4.624 1.00 0.00 H new ATOM 0 HB2 LYS A 45 14.509 3.854 -2.212 1.00 0.00 H new ATOM 0 HB3 LYS A 45 16.155 3.443 -2.650 1.00 0.00 H new ATOM 0 HG2 LYS A 45 14.966 5.736 -4.158 1.00 0.00 H new ATOM 0 HG3 LYS A 45 15.221 6.017 -2.448 1.00 0.00 H new ATOM 0 HD2 LYS A 45 17.585 4.719 -3.334 1.00 0.00 H new ATOM 0 HD3 LYS A 45 17.193 5.859 -4.606 1.00 0.00 H new ATOM 0 HE2 LYS A 45 16.770 7.190 -2.080 1.00 0.00 H new ATOM 0 HE3 LYS A 45 18.333 6.401 -2.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 18.508 8.611 -2.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 18.926 7.448 -4.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 17.411 8.212 -4.181 1.00 0.00 H new ATOM 646 N ASN A 46 16.043 1.932 -5.824 1.00 0.00 N ATOM 647 CA ASN A 46 17.002 1.715 -6.894 1.00 0.00 C ATOM 648 C ASN A 46 16.252 1.401 -8.190 1.00 0.00 C ATOM 649 O ASN A 46 16.856 1.328 -9.259 1.00 0.00 O ATOM 650 CB ASN A 46 17.920 0.532 -6.580 1.00 0.00 C ATOM 651 CG ASN A 46 18.178 -0.309 -7.832 1.00 0.00 C ATOM 652 OD1 ASN A 46 18.785 0.133 -8.794 1.00 0.00 O ATOM 653 ND2 ASN A 46 17.685 -1.542 -7.767 1.00 0.00 N ATOM 0 H ASN A 46 15.619 1.082 -5.453 1.00 0.00 H new ATOM 0 HA ASN A 46 17.602 2.619 -6.997 1.00 0.00 H new ATOM 0 HB2 ASN A 46 18.866 0.897 -6.181 1.00 0.00 H new ATOM 0 HB3 ASN A 46 17.467 -0.089 -5.807 1.00 0.00 H new ATOM 0 HD21 ASN A 46 17.805 -2.181 -8.553 1.00 0.00 H new ATOM 0 HD22 ASN A 46 17.187 -1.849 -6.931 1.00 0.00 H new ATOM 660 N GLY A 47 14.946 1.223 -8.052 1.00 0.00 N ATOM 661 CA GLY A 47 14.107 0.918 -9.198 1.00 0.00 C ATOM 662 C GLY A 47 13.637 -0.537 -9.162 1.00 0.00 C ATOM 663 O GLY A 47 12.842 -0.958 -10.001 1.00 0.00 O ATOM 0 H GLY A 47 14.449 1.284 -7.164 1.00 0.00 H new ATOM 0 HA2 GLY A 47 13.243 1.583 -9.208 1.00 0.00 H new ATOM 0 HA3 GLY A 47 14.661 1.102 -10.118 1.00 0.00 H new ATOM 667 N GLN A 48 14.148 -1.267 -8.181 1.00 0.00 N ATOM 668 CA GLN A 48 13.791 -2.666 -8.025 1.00 0.00 C ATOM 669 C GLN A 48 12.542 -2.801 -7.152 1.00 0.00 C ATOM 670 O GLN A 48 11.907 -1.803 -6.812 1.00 0.00 O ATOM 671 CB GLN A 48 14.956 -3.468 -7.441 1.00 0.00 C ATOM 672 CG GLN A 48 15.834 -4.048 -8.552 1.00 0.00 C ATOM 673 CD GLN A 48 16.934 -4.940 -7.973 1.00 0.00 C ATOM 674 OE1 GLN A 48 16.852 -5.424 -6.856 1.00 0.00 O ATOM 675 NE2 GLN A 48 17.964 -5.129 -8.792 1.00 0.00 N ATOM 0 H GLN A 48 14.807 -0.915 -7.486 1.00 0.00 H new ATOM 0 HA GLN A 48 13.569 -3.075 -9.010 1.00 0.00 H new ATOM 0 HB2 GLN A 48 15.556 -2.827 -6.796 1.00 0.00 H new ATOM 0 HB3 GLN A 48 14.570 -4.275 -6.818 1.00 0.00 H new ATOM 0 HG2 GLN A 48 15.219 -4.625 -9.242 1.00 0.00 H new ATOM 0 HG3 GLN A 48 16.283 -3.237 -9.126 1.00 0.00 H new ATOM 0 HE21 GLN A 48 17.969 -4.694 -9.715 1.00 0.00 H new ATOM 0 HE22 GLN A 48 18.750 -5.709 -8.498 1.00 0.00 H new ATOM 684 N LYS A 49 12.225 -4.042 -6.815 1.00 0.00 N ATOM 685 CA LYS A 49 11.063 -4.320 -5.988 1.00 0.00 C ATOM 686 C LYS A 49 11.368 -5.504 -5.068 1.00 0.00 C ATOM 687 O LYS A 49 12.085 -6.426 -5.454 1.00 0.00 O ATOM 688 CB LYS A 49 9.822 -4.522 -6.859 1.00 0.00 C ATOM 689 CG LYS A 49 9.604 -3.326 -7.790 1.00 0.00 C ATOM 690 CD LYS A 49 8.402 -3.557 -8.707 1.00 0.00 C ATOM 691 CE LYS A 49 7.348 -2.465 -8.514 1.00 0.00 C ATOM 692 NZ LYS A 49 6.064 -2.870 -9.128 1.00 0.00 N ATOM 0 H LYS A 49 12.753 -4.867 -7.100 1.00 0.00 H new ATOM 0 HA LYS A 49 10.839 -3.467 -5.347 1.00 0.00 H new ATOM 0 HB2 LYS A 49 9.932 -5.432 -7.449 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.946 -4.658 -6.224 1.00 0.00 H new ATOM 0 HG2 LYS A 49 9.447 -2.424 -7.198 1.00 0.00 H new ATOM 0 HG3 LYS A 49 10.498 -3.161 -8.391 1.00 0.00 H new ATOM 0 HD2 LYS A 49 8.730 -3.571 -9.746 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.963 -4.532 -8.498 1.00 0.00 H new ATOM 0 HE2 LYS A 49 7.205 -2.273 -7.451 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.694 -1.534 -8.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 5.360 -2.118 -8.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 6.201 -3.030 -10.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 5.727 -3.747 -8.682 1.00 0.00 H new ATOM 706 N ALA A 50 10.808 -5.440 -3.869 1.00 0.00 N ATOM 707 CA ALA A 50 11.011 -6.496 -2.891 1.00 0.00 C ATOM 708 C ALA A 50 9.661 -6.900 -2.296 1.00 0.00 C ATOM 709 O ALA A 50 9.040 -6.124 -1.572 1.00 0.00 O ATOM 710 CB ALA A 50 11.999 -6.020 -1.824 1.00 0.00 C ATOM 0 H ALA A 50 10.214 -4.674 -3.552 1.00 0.00 H new ATOM 0 HA ALA A 50 11.441 -7.379 -3.363 1.00 0.00 H new ATOM 0 HB1 ALA A 50 12.152 -6.812 -1.090 1.00 0.00 H new ATOM 0 HB2 ALA A 50 12.951 -5.773 -2.294 1.00 0.00 H new ATOM 0 HB3 ALA A 50 11.599 -5.136 -1.326 1.00 0.00 H new ATOM 716 N CYS A 51 9.246 -8.115 -2.625 1.00 0.00 N ATOM 717 CA CYS A 51 7.980 -8.632 -2.132 1.00 0.00 C ATOM 718 C CYS A 51 8.122 -8.899 -0.632 1.00 0.00 C ATOM 719 O CYS A 51 9.137 -9.430 -0.186 1.00 0.00 O ATOM 720 CB CYS A 51 7.545 -9.884 -2.896 1.00 0.00 C ATOM 721 SG CYS A 51 6.638 -9.558 -4.451 1.00 0.00 S ATOM 0 H CYS A 51 9.764 -8.756 -3.226 1.00 0.00 H new ATOM 0 HA CYS A 51 7.194 -7.895 -2.296 1.00 0.00 H new ATOM 0 HB2 CYS A 51 8.430 -10.478 -3.126 1.00 0.00 H new ATOM 0 HB3 CYS A 51 6.915 -10.489 -2.244 1.00 0.00 H new ATOM 726 N LEU A 52 7.088 -8.518 0.104 1.00 0.00 N ATOM 727 CA LEU A 52 7.085 -8.709 1.544 1.00 0.00 C ATOM 728 C LEU A 52 6.160 -9.876 1.897 1.00 0.00 C ATOM 729 O LEU A 52 5.346 -10.297 1.077 1.00 0.00 O ATOM 730 CB LEU A 52 6.727 -7.404 2.257 1.00 0.00 C ATOM 731 CG LEU A 52 7.706 -6.244 2.065 1.00 0.00 C ATOM 732 CD1 LEU A 52 7.073 -4.916 2.484 1.00 0.00 C ATOM 733 CD2 LEU A 52 9.021 -6.509 2.801 1.00 0.00 C ATOM 0 H LEU A 52 6.247 -8.078 -0.270 1.00 0.00 H new ATOM 0 HA LEU A 52 8.082 -8.974 1.895 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.743 -7.084 1.914 1.00 0.00 H new ATOM 0 HB3 LEU A 52 6.641 -7.608 3.324 1.00 0.00 H new ATOM 0 HG LEU A 52 7.940 -6.168 1.003 1.00 0.00 H new ATOM 0 HD11 LEU A 52 7.790 -4.109 2.337 1.00 0.00 H new ATOM 0 HD12 LEU A 52 6.187 -4.728 1.878 1.00 0.00 H new ATOM 0 HD13 LEU A 52 6.790 -4.963 3.536 1.00 0.00 H new ATOM 0 HD21 LEU A 52 9.699 -5.669 2.648 1.00 0.00 H new ATOM 0 HD22 LEU A 52 8.824 -6.627 3.867 1.00 0.00 H new ATOM 0 HD23 LEU A 52 9.478 -7.419 2.413 1.00 0.00 H new ATOM 745 N ASN A 53 6.317 -10.365 3.118 1.00 0.00 N ATOM 746 CA ASN A 53 5.506 -11.475 3.590 1.00 0.00 C ATOM 747 C ASN A 53 4.342 -10.933 4.423 1.00 0.00 C ATOM 748 O ASN A 53 4.546 -10.431 5.527 1.00 0.00 O ATOM 749 CB ASN A 53 6.323 -12.417 4.476 1.00 0.00 C ATOM 750 CG ASN A 53 5.804 -13.853 4.375 1.00 0.00 C ATOM 751 OD1 ASN A 53 5.419 -14.328 3.320 1.00 0.00 O ATOM 752 ND2 ASN A 53 5.815 -14.514 5.529 1.00 0.00 N ATOM 0 H ASN A 53 6.994 -10.013 3.795 1.00 0.00 H new ATOM 0 HA ASN A 53 5.145 -12.022 2.719 1.00 0.00 H new ATOM 0 HB2 ASN A 53 7.371 -12.384 4.179 1.00 0.00 H new ATOM 0 HB3 ASN A 53 6.275 -12.081 5.512 1.00 0.00 H new ATOM 0 HD21 ASN A 53 5.488 -15.479 5.567 1.00 0.00 H new ATOM 0 HD22 ASN A 53 6.151 -14.056 6.376 1.00 0.00 H new ATOM 759 N PRO A 54 3.116 -11.057 3.847 1.00 0.00 N ATOM 760 CA PRO A 54 1.920 -10.586 4.524 1.00 0.00 C ATOM 761 C PRO A 54 1.522 -11.534 5.657 1.00 0.00 C ATOM 762 O PRO A 54 0.361 -11.925 5.765 1.00 0.00 O ATOM 763 CB PRO A 54 0.865 -10.486 3.435 1.00 0.00 C ATOM 764 CG PRO A 54 1.371 -11.342 2.285 1.00 0.00 C ATOM 765 CD PRO A 54 2.838 -11.647 2.541 1.00 0.00 C ATOM 0 HA PRO A 54 2.064 -9.621 5.010 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -0.101 -10.844 3.793 1.00 0.00 H new ATOM 0 HB3 PRO A 54 0.725 -9.452 3.120 1.00 0.00 H new ATOM 0 HG2 PRO A 54 0.796 -12.265 2.215 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.250 -10.818 1.337 1.00 0.00 H new ATOM 0 HD2 PRO A 54 3.025 -12.721 2.544 1.00 0.00 H new ATOM 0 HD3 PRO A 54 3.473 -11.215 1.768 1.00 0.00 H new ATOM 773 N ALA A 55 2.508 -11.876 6.473 1.00 0.00 N ATOM 774 CA ALA A 55 2.276 -12.771 7.594 1.00 0.00 C ATOM 775 C ALA A 55 3.455 -12.684 8.564 1.00 0.00 C ATOM 776 O ALA A 55 3.773 -13.655 9.250 1.00 0.00 O ATOM 777 CB ALA A 55 2.051 -14.193 7.075 1.00 0.00 C ATOM 0 H ALA A 55 3.470 -11.549 6.380 1.00 0.00 H new ATOM 0 HA ALA A 55 1.379 -12.478 8.139 1.00 0.00 H new ATOM 0 HB1 ALA A 55 1.877 -14.864 7.916 1.00 0.00 H new ATOM 0 HB2 ALA A 55 1.184 -14.206 6.415 1.00 0.00 H new ATOM 0 HB3 ALA A 55 2.932 -14.523 6.524 1.00 0.00 H new ATOM 783 N SER A 56 4.073 -11.512 8.591 1.00 0.00 N ATOM 784 CA SER A 56 5.211 -11.286 9.466 1.00 0.00 C ATOM 785 C SER A 56 4.965 -10.051 10.335 1.00 0.00 C ATOM 786 O SER A 56 4.312 -9.103 9.902 1.00 0.00 O ATOM 787 CB SER A 56 6.501 -11.120 8.660 1.00 0.00 C ATOM 788 OG SER A 56 7.574 -10.639 9.464 1.00 0.00 O ATOM 0 H SER A 56 3.807 -10.709 8.021 1.00 0.00 H new ATOM 0 HA SER A 56 5.327 -12.158 10.110 1.00 0.00 H new ATOM 0 HB2 SER A 56 6.779 -12.077 8.219 1.00 0.00 H new ATOM 0 HB3 SER A 56 6.327 -10.428 7.836 1.00 0.00 H new ATOM 0 HG SER A 56 8.380 -10.548 8.914 1.00 0.00 H new ATOM 794 N PRO A 57 5.516 -10.104 11.577 1.00 0.00 N ATOM 795 CA PRO A 57 5.363 -9.001 12.511 1.00 0.00 C ATOM 796 C PRO A 57 6.264 -7.826 12.124 1.00 0.00 C ATOM 797 O PRO A 57 6.070 -6.708 12.599 1.00 0.00 O ATOM 798 CB PRO A 57 5.703 -9.587 13.872 1.00 0.00 C ATOM 799 CG PRO A 57 6.479 -10.864 13.593 1.00 0.00 C ATOM 800 CD PRO A 57 6.295 -11.210 12.124 1.00 0.00 C ATOM 0 HA PRO A 57 4.355 -8.587 12.511 1.00 0.00 H new ATOM 0 HB2 PRO A 57 6.298 -8.889 14.460 1.00 0.00 H new ATOM 0 HB3 PRO A 57 4.799 -9.796 14.444 1.00 0.00 H new ATOM 0 HG2 PRO A 57 7.535 -10.727 13.823 1.00 0.00 H new ATOM 0 HG3 PRO A 57 6.118 -11.676 14.224 1.00 0.00 H new ATOM 0 HD2 PRO A 57 7.255 -11.307 11.617 1.00 0.00 H new ATOM 0 HD3 PRO A 57 5.773 -12.159 12.003 1.00 0.00 H new ATOM 808 N MET A 58 7.229 -8.120 11.266 1.00 0.00 N ATOM 809 CA MET A 58 8.161 -7.102 10.810 1.00 0.00 C ATOM 810 C MET A 58 7.682 -6.467 9.503 1.00 0.00 C ATOM 811 O MET A 58 8.029 -5.327 9.199 1.00 0.00 O ATOM 812 CB MET A 58 9.540 -7.730 10.598 1.00 0.00 C ATOM 813 CG MET A 58 10.645 -6.679 10.721 1.00 0.00 C ATOM 814 SD MET A 58 10.657 -5.997 12.371 1.00 0.00 S ATOM 815 CE MET A 58 10.561 -7.500 13.329 1.00 0.00 C ATOM 0 H MET A 58 7.386 -9.049 10.874 1.00 0.00 H new ATOM 0 HA MET A 58 8.220 -6.323 11.570 1.00 0.00 H new ATOM 0 HB2 MET A 58 9.701 -8.520 11.332 1.00 0.00 H new ATOM 0 HB3 MET A 58 9.584 -8.196 9.614 1.00 0.00 H new ATOM 0 HG2 MET A 58 11.612 -7.128 10.497 1.00 0.00 H new ATOM 0 HG3 MET A 58 10.486 -5.885 9.991 1.00 0.00 H new ATOM 0 HE1 MET A 58 10.874 -7.299 14.353 1.00 0.00 H new ATOM 0 HE2 MET A 58 9.535 -7.867 13.329 1.00 0.00 H new ATOM 0 HE3 MET A 58 11.215 -8.253 12.891 1.00 0.00 H new ATOM 825 N VAL A 59 6.891 -7.233 8.765 1.00 0.00 N ATOM 826 CA VAL A 59 6.361 -6.759 7.498 1.00 0.00 C ATOM 827 C VAL A 59 5.296 -5.693 7.762 1.00 0.00 C ATOM 828 O VAL A 59 4.913 -4.955 6.855 1.00 0.00 O ATOM 829 CB VAL A 59 5.836 -7.939 6.677 1.00 0.00 C ATOM 830 CG1 VAL A 59 4.831 -7.469 5.624 1.00 0.00 C ATOM 831 CG2 VAL A 59 6.987 -8.711 6.030 1.00 0.00 C ATOM 0 H VAL A 59 6.605 -8.178 9.020 1.00 0.00 H new ATOM 0 HA VAL A 59 7.148 -6.292 6.905 1.00 0.00 H new ATOM 0 HB VAL A 59 5.318 -8.616 7.356 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.473 -8.327 5.054 1.00 0.00 H new ATOM 0 HG12 VAL A 59 3.988 -6.983 6.116 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.314 -6.762 4.950 1.00 0.00 H new ATOM 0 HG21 VAL A 59 6.587 -9.544 5.452 1.00 0.00 H new ATOM 0 HG22 VAL A 59 7.545 -8.047 5.370 1.00 0.00 H new ATOM 0 HG23 VAL A 59 7.651 -9.093 6.806 1.00 0.00 H new ATOM 841 N LYS A 60 4.847 -5.647 9.008 1.00 0.00 N ATOM 842 CA LYS A 60 3.833 -4.684 9.402 1.00 0.00 C ATOM 843 C LYS A 60 4.507 -3.490 10.082 1.00 0.00 C ATOM 844 O LYS A 60 3.831 -2.584 10.567 1.00 0.00 O ATOM 845 CB LYS A 60 2.761 -5.356 10.262 1.00 0.00 C ATOM 846 CG LYS A 60 2.325 -6.689 9.651 1.00 0.00 C ATOM 847 CD LYS A 60 1.481 -6.466 8.394 1.00 0.00 C ATOM 848 CE LYS A 60 0.045 -6.082 8.759 1.00 0.00 C ATOM 849 NZ LYS A 60 -0.094 -4.611 8.837 1.00 0.00 N ATOM 0 H LYS A 60 5.167 -6.261 9.757 1.00 0.00 H new ATOM 0 HA LYS A 60 3.311 -4.300 8.525 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.147 -5.522 11.268 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.899 -4.696 10.357 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.204 -7.284 9.402 1.00 0.00 H new ATOM 0 HG3 LYS A 60 1.751 -7.258 10.382 1.00 0.00 H new ATOM 0 HD2 LYS A 60 1.928 -5.680 7.786 1.00 0.00 H new ATOM 0 HD3 LYS A 60 1.476 -7.373 7.789 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -0.644 -6.479 8.014 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -0.226 -6.530 9.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -0.971 -4.319 8.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -0.128 -4.318 9.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 0.720 -4.160 8.372 1.00 0.00 H new ATOM 863 N LYS A 61 5.832 -3.528 10.096 1.00 0.00 N ATOM 864 CA LYS A 61 6.604 -2.460 10.708 1.00 0.00 C ATOM 865 C LYS A 61 7.455 -1.774 9.637 1.00 0.00 C ATOM 866 O LYS A 61 7.969 -0.678 9.856 1.00 0.00 O ATOM 867 CB LYS A 61 7.417 -2.996 11.888 1.00 0.00 C ATOM 868 CG LYS A 61 6.498 -3.463 13.019 1.00 0.00 C ATOM 869 CD LYS A 61 6.949 -2.891 14.364 1.00 0.00 C ATOM 870 CE LYS A 61 6.047 -3.380 15.499 1.00 0.00 C ATOM 871 NZ LYS A 61 4.734 -2.698 15.447 1.00 0.00 N ATOM 0 H LYS A 61 6.390 -4.281 9.694 1.00 0.00 H new ATOM 0 HA LYS A 61 5.942 -1.701 11.125 1.00 0.00 H new ATOM 0 HB2 LYS A 61 8.042 -3.825 11.557 1.00 0.00 H new ATOM 0 HB3 LYS A 61 8.087 -2.219 12.256 1.00 0.00 H new ATOM 0 HG2 LYS A 61 5.474 -3.151 12.812 1.00 0.00 H new ATOM 0 HG3 LYS A 61 6.497 -4.552 13.065 1.00 0.00 H new ATOM 0 HD2 LYS A 61 7.980 -3.186 14.561 1.00 0.00 H new ATOM 0 HD3 LYS A 61 6.931 -1.802 14.324 1.00 0.00 H new ATOM 0 HE2 LYS A 61 5.907 -4.458 15.422 1.00 0.00 H new ATOM 0 HE3 LYS A 61 6.525 -3.189 16.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 4.159 -2.990 16.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 4.876 -1.668 15.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 4.243 -2.956 14.567 1.00 0.00 H new ATOM 885 N ILE A 62 7.577 -2.447 8.502 1.00 0.00 N ATOM 886 CA ILE A 62 8.357 -1.915 7.397 1.00 0.00 C ATOM 887 C ILE A 62 7.430 -1.164 6.440 1.00 0.00 C ATOM 888 O ILE A 62 7.890 -0.379 5.613 1.00 0.00 O ATOM 889 CB ILE A 62 9.162 -3.029 6.725 1.00 0.00 C ATOM 890 CG1 ILE A 62 10.033 -3.767 7.744 1.00 0.00 C ATOM 891 CG2 ILE A 62 9.985 -2.482 5.557 1.00 0.00 C ATOM 892 CD1 ILE A 62 10.243 -5.225 7.331 1.00 0.00 C ATOM 0 H ILE A 62 7.149 -3.356 8.324 1.00 0.00 H new ATOM 0 HA ILE A 62 9.092 -1.196 7.760 1.00 0.00 H new ATOM 0 HB ILE A 62 8.462 -3.756 6.313 1.00 0.00 H new ATOM 0 HG12 ILE A 62 10.998 -3.268 7.832 1.00 0.00 H new ATOM 0 HG13 ILE A 62 9.562 -3.728 8.726 1.00 0.00 H new ATOM 0 HG21 ILE A 62 10.548 -3.294 5.097 1.00 0.00 H new ATOM 0 HG22 ILE A 62 9.318 -2.038 4.818 1.00 0.00 H new ATOM 0 HG23 ILE A 62 10.677 -1.723 5.923 1.00 0.00 H new ATOM 0 HD11 ILE A 62 10.865 -5.727 8.072 1.00 0.00 H new ATOM 0 HD12 ILE A 62 9.278 -5.728 7.267 1.00 0.00 H new ATOM 0 HD13 ILE A 62 10.736 -5.261 6.359 1.00 0.00 H new ATOM 904 N ILE A 63 6.140 -1.431 6.584 1.00 0.00 N ATOM 905 CA ILE A 63 5.144 -0.789 5.743 1.00 0.00 C ATOM 906 C ILE A 63 4.613 0.459 6.450 1.00 0.00 C ATOM 907 O ILE A 63 4.664 1.558 5.898 1.00 0.00 O ATOM 908 CB ILE A 63 4.051 -1.786 5.352 1.00 0.00 C ATOM 909 CG1 ILE A 63 4.549 -2.751 4.273 1.00 0.00 C ATOM 910 CG2 ILE A 63 2.774 -1.060 4.925 1.00 0.00 C ATOM 911 CD1 ILE A 63 3.814 -4.090 4.354 1.00 0.00 C ATOM 0 H ILE A 63 5.762 -2.083 7.271 1.00 0.00 H new ATOM 0 HA ILE A 63 5.592 -0.458 4.806 1.00 0.00 H new ATOM 0 HB ILE A 63 3.804 -2.383 6.230 1.00 0.00 H new ATOM 0 HG12 ILE A 63 4.400 -2.309 3.288 1.00 0.00 H new ATOM 0 HG13 ILE A 63 5.621 -2.912 4.391 1.00 0.00 H new ATOM 0 HG21 ILE A 63 2.013 -1.792 4.652 1.00 0.00 H new ATOM 0 HG22 ILE A 63 2.410 -0.448 5.750 1.00 0.00 H new ATOM 0 HG23 ILE A 63 2.988 -0.422 4.067 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.187 -4.757 3.577 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.985 -4.541 5.332 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.746 -3.928 4.211 1.00 0.00 H new ATOM 923 N GLU A 64 4.116 0.249 7.660 1.00 0.00 N ATOM 924 CA GLU A 64 3.576 1.344 8.447 1.00 0.00 C ATOM 925 C GLU A 64 4.596 2.480 8.546 1.00 0.00 C ATOM 926 O GLU A 64 4.227 3.653 8.540 1.00 0.00 O ATOM 927 CB GLU A 64 3.154 0.864 9.837 1.00 0.00 C ATOM 928 CG GLU A 64 1.974 -0.107 9.747 1.00 0.00 C ATOM 929 CD GLU A 64 1.855 -0.944 11.022 1.00 0.00 C ATOM 930 OE1 GLU A 64 2.348 -0.464 12.065 1.00 0.00 O ATOM 931 OE2 GLU A 64 1.273 -2.046 10.924 1.00 0.00 O ATOM 0 H GLU A 64 4.076 -0.663 8.114 1.00 0.00 H new ATOM 0 HA GLU A 64 2.687 1.723 7.944 1.00 0.00 H new ATOM 0 HB2 GLU A 64 3.995 0.375 10.328 1.00 0.00 H new ATOM 0 HB3 GLU A 64 2.879 1.720 10.453 1.00 0.00 H new ATOM 0 HG2 GLU A 64 1.051 0.450 9.586 1.00 0.00 H new ATOM 0 HG3 GLU A 64 2.104 -0.764 8.887 1.00 0.00 H new ATOM 938 N LYS A 65 5.860 2.092 8.636 1.00 0.00 N ATOM 939 CA LYS A 65 6.936 3.063 8.736 1.00 0.00 C ATOM 940 C LYS A 65 7.095 3.782 7.394 1.00 0.00 C ATOM 941 O LYS A 65 7.341 4.986 7.357 1.00 0.00 O ATOM 942 CB LYS A 65 8.219 2.392 9.230 1.00 0.00 C ATOM 943 CG LYS A 65 8.391 2.582 10.738 1.00 0.00 C ATOM 944 CD LYS A 65 9.869 2.723 11.108 1.00 0.00 C ATOM 945 CE LYS A 65 10.499 1.355 11.380 1.00 0.00 C ATOM 946 NZ LYS A 65 11.935 1.365 11.021 1.00 0.00 N ATOM 0 H LYS A 65 6.163 1.118 8.642 1.00 0.00 H new ATOM 0 HA LYS A 65 6.695 3.823 9.479 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.191 1.328 8.995 1.00 0.00 H new ATOM 0 HB3 LYS A 65 9.078 2.812 8.707 1.00 0.00 H new ATOM 0 HG2 LYS A 65 7.845 3.469 11.061 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.960 1.732 11.267 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.404 3.220 10.299 1.00 0.00 H new ATOM 0 HD3 LYS A 65 9.968 3.355 11.991 1.00 0.00 H new ATOM 0 HE2 LYS A 65 10.383 1.098 12.433 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.980 0.588 10.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 12.347 0.429 11.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 12.039 1.590 10.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 12.430 2.083 11.588 1.00 0.00 H new ATOM 960 N MET A 66 6.947 3.012 6.326 1.00 0.00 N ATOM 961 CA MET A 66 7.071 3.560 4.986 1.00 0.00 C ATOM 962 C MET A 66 6.109 4.732 4.782 1.00 0.00 C ATOM 963 O MET A 66 6.454 5.716 4.128 1.00 0.00 O ATOM 964 CB MET A 66 6.771 2.468 3.957 1.00 0.00 C ATOM 965 CG MET A 66 7.983 2.213 3.059 1.00 0.00 C ATOM 966 SD MET A 66 8.556 3.750 2.355 1.00 0.00 S ATOM 967 CE MET A 66 7.310 4.000 1.101 1.00 0.00 C ATOM 0 H MET A 66 6.742 2.013 6.361 1.00 0.00 H new ATOM 0 HA MET A 66 8.090 3.924 4.856 1.00 0.00 H new ATOM 0 HB2 MET A 66 6.493 1.547 4.469 1.00 0.00 H new ATOM 0 HB3 MET A 66 5.917 2.763 3.347 1.00 0.00 H new ATOM 0 HG2 MET A 66 8.782 1.748 3.636 1.00 0.00 H new ATOM 0 HG3 MET A 66 7.717 1.516 2.264 1.00 0.00 H new ATOM 0 HE1 MET A 66 7.755 4.498 0.240 1.00 0.00 H new ATOM 0 HE2 MET A 66 6.905 3.036 0.793 1.00 0.00 H new ATOM 0 HE3 MET A 66 6.508 4.618 1.503 1.00 0.00 H new ATOM 977 N LEU A 67 4.922 4.588 5.353 1.00 0.00 N ATOM 978 CA LEU A 67 3.908 5.623 5.241 1.00 0.00 C ATOM 979 C LEU A 67 4.366 6.865 6.009 1.00 0.00 C ATOM 980 O LEU A 67 3.828 7.953 5.813 1.00 0.00 O ATOM 981 CB LEU A 67 2.547 5.089 5.691 1.00 0.00 C ATOM 982 CG LEU A 67 1.801 4.216 4.680 1.00 0.00 C ATOM 983 CD1 LEU A 67 2.676 3.053 4.209 1.00 0.00 C ATOM 984 CD2 LEU A 67 0.465 3.735 5.250 1.00 0.00 C ATOM 0 H LEU A 67 4.640 3.771 5.894 1.00 0.00 H new ATOM 0 HA LEU A 67 3.780 5.921 4.200 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.690 4.511 6.604 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.912 5.938 5.946 1.00 0.00 H new ATOM 0 HG LEU A 67 1.576 4.825 3.804 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.122 2.448 3.491 1.00 0.00 H new ATOM 0 HD12 LEU A 67 3.577 3.444 3.736 1.00 0.00 H new ATOM 0 HD13 LEU A 67 2.954 2.437 5.064 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.044 3.117 4.511 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.644 3.149 6.152 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.158 4.596 5.494 1.00 0.00 H new ATOM 996 N LYS A 68 5.354 6.659 6.868 1.00 0.00 N ATOM 997 CA LYS A 68 5.890 7.749 7.666 1.00 0.00 C ATOM 998 C LYS A 68 7.195 8.241 7.038 1.00 0.00 C ATOM 999 O LYS A 68 7.551 9.411 7.173 1.00 0.00 O ATOM 1000 CB LYS A 68 6.034 7.321 9.128 1.00 0.00 C ATOM 1001 CG LYS A 68 4.727 7.537 9.894 1.00 0.00 C ATOM 1002 CD LYS A 68 3.615 6.643 9.344 1.00 0.00 C ATOM 1003 CE LYS A 68 2.274 6.965 10.007 1.00 0.00 C ATOM 1004 NZ LYS A 68 1.316 5.855 9.805 1.00 0.00 N ATOM 0 H LYS A 68 5.797 5.754 7.029 1.00 0.00 H new ATOM 0 HA LYS A 68 5.200 8.593 7.671 1.00 0.00 H new ATOM 0 HB2 LYS A 68 6.319 6.270 9.177 1.00 0.00 H new ATOM 0 HB3 LYS A 68 6.835 7.890 9.600 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.881 7.322 10.951 1.00 0.00 H new ATOM 0 HG3 LYS A 68 4.427 8.582 9.821 1.00 0.00 H new ATOM 0 HD2 LYS A 68 3.534 6.780 8.266 1.00 0.00 H new ATOM 0 HD3 LYS A 68 3.867 5.596 9.515 1.00 0.00 H new ATOM 0 HE2 LYS A 68 2.421 7.137 11.073 1.00 0.00 H new ATOM 0 HE3 LYS A 68 1.867 7.885 9.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 0.411 6.090 10.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 1.163 5.710 8.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 1.700 4.984 10.225 1.00 0.00 H new ATOM 1018 N ASN A 69 7.874 7.324 6.364 1.00 0.00 N ATOM 1019 CA ASN A 69 9.132 7.650 5.715 1.00 0.00 C ATOM 1020 C ASN A 69 10.148 8.087 6.772 1.00 0.00 C ATOM 1021 O ASN A 69 11.023 7.312 7.155 1.00 0.00 O ATOM 1022 CB ASN A 69 8.957 8.801 4.723 1.00 0.00 C ATOM 1023 CG ASN A 69 10.312 9.296 4.212 1.00 0.00 C ATOM 1024 OD1 ASN A 69 11.131 8.540 3.715 1.00 0.00 O ATOM 1025 ND2 ASN A 69 10.502 10.604 4.362 1.00 0.00 N ATOM 0 H ASN A 69 7.576 6.355 6.254 1.00 0.00 H new ATOM 0 HA ASN A 69 9.477 6.764 5.182 1.00 0.00 H new ATOM 0 HB2 ASN A 69 8.346 8.472 3.883 1.00 0.00 H new ATOM 0 HB3 ASN A 69 8.424 9.621 5.203 1.00 0.00 H new ATOM 0 HD21 ASN A 69 11.375 11.031 4.053 1.00 0.00 H new ATOM 0 HD22 ASN A 69 9.775 11.180 4.786 1.00 0.00 H new ATOM 1032 N GLY A 70 9.998 9.328 7.214 1.00 0.00 N ATOM 1033 CA GLY A 70 10.892 9.877 8.219 1.00 0.00 C ATOM 1034 C GLY A 70 12.053 10.631 7.567 1.00 0.00 C ATOM 1035 O GLY A 70 11.876 11.746 7.077 1.00 0.00 O ATOM 0 H GLY A 70 9.271 9.968 6.894 1.00 0.00 H new ATOM 0 HA2 GLY A 70 10.339 10.550 8.874 1.00 0.00 H new ATOM 0 HA3 GLY A 70 11.281 9.073 8.843 1.00 0.00 H new ATOM 1039 N LYS A 71 13.214 9.993 7.582 1.00 0.00 N ATOM 1040 CA LYS A 71 14.403 10.590 6.998 1.00 0.00 C ATOM 1041 C LYS A 71 14.265 10.606 5.475 1.00 0.00 C ATOM 1042 O LYS A 71 13.202 10.293 4.941 1.00 0.00 O ATOM 1043 CB LYS A 71 15.660 9.872 7.494 1.00 0.00 C ATOM 1044 CG LYS A 71 16.125 10.443 8.835 1.00 0.00 C ATOM 1045 CD LYS A 71 17.604 10.831 8.784 1.00 0.00 C ATOM 1046 CE LYS A 71 18.121 11.205 10.174 1.00 0.00 C ATOM 1047 NZ LYS A 71 19.600 11.164 10.205 1.00 0.00 N ATOM 0 H LYS A 71 13.357 9.069 7.989 1.00 0.00 H new ATOM 0 HA LYS A 71 14.507 11.626 7.320 1.00 0.00 H new ATOM 0 HB2 LYS A 71 15.457 8.806 7.599 1.00 0.00 H new ATOM 0 HB3 LYS A 71 16.456 9.973 6.756 1.00 0.00 H new ATOM 0 HG2 LYS A 71 15.525 11.317 9.090 1.00 0.00 H new ATOM 0 HG3 LYS A 71 15.966 9.706 9.623 1.00 0.00 H new ATOM 0 HD2 LYS A 71 18.188 10.001 8.386 1.00 0.00 H new ATOM 0 HD3 LYS A 71 17.740 11.671 8.103 1.00 0.00 H new ATOM 0 HE2 LYS A 71 17.773 12.203 10.442 1.00 0.00 H new ATOM 0 HE3 LYS A 71 17.717 10.517 10.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 19.935 11.420 11.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 19.926 10.205 9.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 19.981 11.838 9.511 1.00 0.00 H new ATOM 1061 N SER A 72 15.355 10.975 4.818 1.00 0.00 N ATOM 1062 CA SER A 72 15.368 11.037 3.366 1.00 0.00 C ATOM 1063 C SER A 72 16.762 11.431 2.872 1.00 0.00 C ATOM 1064 O SER A 72 17.045 12.612 2.680 1.00 0.00 O ATOM 1065 CB SER A 72 14.322 12.026 2.847 1.00 0.00 C ATOM 1066 OG SER A 72 13.686 11.556 1.661 1.00 0.00 O ATOM 0 H SER A 72 16.235 11.234 5.264 1.00 0.00 H new ATOM 0 HA SER A 72 15.118 10.049 2.979 1.00 0.00 H new ATOM 0 HB2 SER A 72 13.571 12.197 3.618 1.00 0.00 H new ATOM 0 HB3 SER A 72 14.798 12.986 2.647 1.00 0.00 H new ATOM 0 HG SER A 72 13.024 12.214 1.362 1.00 0.00 H new ATOM 1072 N ASN A 73 17.595 10.419 2.681 1.00 0.00 N ATOM 1073 CA ASN A 73 18.952 10.644 2.213 1.00 0.00 C ATOM 1074 C ASN A 73 18.910 11.205 0.791 1.00 0.00 C ATOM 1075 O ASN A 73 17.864 11.187 0.143 1.00 0.00 O ATOM 1076 CB ASN A 73 19.749 9.338 2.183 1.00 0.00 C ATOM 1077 CG ASN A 73 21.113 9.544 1.523 1.00 0.00 C ATOM 1078 OD1 ASN A 73 21.227 9.764 0.328 1.00 0.00 O ATOM 1079 ND2 ASN A 73 22.140 9.460 2.364 1.00 0.00 N ATOM 0 H ASN A 73 17.356 9.440 2.842 1.00 0.00 H new ATOM 0 HA ASN A 73 19.432 11.343 2.897 1.00 0.00 H new ATOM 0 HB2 ASN A 73 19.885 8.967 3.199 1.00 0.00 H new ATOM 0 HB3 ASN A 73 19.189 8.578 1.639 1.00 0.00 H new ATOM 0 HD21 ASN A 73 23.092 9.582 2.020 1.00 0.00 H new ATOM 0 HD22 ASN A 73 21.975 9.273 3.353 1.00 0.00 H new TER 1086 ASN A 73 ATOM 1087 N THR B 5 14.275 15.269 -13.335 1.00 0.00 N ATOM 1088 CA THR B 5 14.887 16.444 -12.739 1.00 0.00 C ATOM 1089 C THR B 5 13.863 17.211 -11.900 1.00 0.00 C ATOM 1090 O THR B 5 14.077 17.444 -10.712 1.00 0.00 O ATOM 1091 CB THR B 5 15.500 17.280 -13.864 1.00 0.00 C ATOM 1092 OG1 THR B 5 16.591 16.489 -14.329 1.00 0.00 O ATOM 1093 CG2 THR B 5 16.161 18.560 -13.348 1.00 0.00 C ATOM 0 HA THR B 5 15.684 16.168 -12.049 1.00 0.00 H new ATOM 0 HB THR B 5 14.727 17.537 -14.588 1.00 0.00 H new ATOM 0 HG1 THR B 5 16.320 15.548 -14.366 1.00 0.00 H new ATOM 0 HG21 THR B 5 16.580 19.116 -14.186 1.00 0.00 H new ATOM 0 HG22 THR B 5 15.417 19.174 -12.840 1.00 0.00 H new ATOM 0 HG23 THR B 5 16.957 18.302 -12.649 1.00 0.00 H new ATOM 1101 N GLU B 6 12.771 17.583 -12.553 1.00 0.00 N ATOM 1102 CA GLU B 6 11.713 18.319 -11.882 1.00 0.00 C ATOM 1103 C GLU B 6 10.448 17.463 -11.788 1.00 0.00 C ATOM 1104 O GLU B 6 9.550 17.582 -12.620 1.00 0.00 O ATOM 1105 CB GLU B 6 11.427 19.642 -12.597 1.00 0.00 C ATOM 1106 CG GLU B 6 10.747 20.638 -11.655 1.00 0.00 C ATOM 1107 CD GLU B 6 11.106 22.078 -12.028 1.00 0.00 C ATOM 1108 OE1 GLU B 6 12.285 22.440 -11.825 1.00 0.00 O ATOM 1109 OE2 GLU B 6 10.193 22.784 -12.509 1.00 0.00 O ATOM 0 H GLU B 6 12.597 17.388 -13.539 1.00 0.00 H new ATOM 0 HA GLU B 6 12.046 18.554 -10.871 1.00 0.00 H new ATOM 0 HB2 GLU B 6 12.359 20.067 -12.970 1.00 0.00 H new ATOM 0 HB3 GLU B 6 10.790 19.461 -13.463 1.00 0.00 H new ATOM 0 HG2 GLU B 6 9.666 20.506 -11.699 1.00 0.00 H new ATOM 0 HG3 GLU B 6 11.051 20.438 -10.628 1.00 0.00 H new ATOM 1116 N LEU B 7 10.418 16.620 -10.766 1.00 0.00 N ATOM 1117 CA LEU B 7 9.278 15.744 -10.552 1.00 0.00 C ATOM 1118 C LEU B 7 8.444 16.277 -9.385 1.00 0.00 C ATOM 1119 O LEU B 7 8.896 17.143 -8.638 1.00 0.00 O ATOM 1120 CB LEU B 7 9.741 14.298 -10.367 1.00 0.00 C ATOM 1121 CG LEU B 7 10.467 13.668 -11.558 1.00 0.00 C ATOM 1122 CD1 LEU B 7 11.971 13.939 -11.489 1.00 0.00 C ATOM 1123 CD2 LEU B 7 10.158 12.173 -11.661 1.00 0.00 C ATOM 0 H LEU B 7 11.164 16.525 -10.077 1.00 0.00 H new ATOM 0 HA LEU B 7 8.632 15.737 -11.430 1.00 0.00 H new ATOM 0 HB2 LEU B 7 10.402 14.257 -9.501 1.00 0.00 H new ATOM 0 HB3 LEU B 7 8.870 13.686 -10.133 1.00 0.00 H new ATOM 0 HG LEU B 7 10.097 14.136 -12.470 1.00 0.00 H new ATOM 0 HD11 LEU B 7 12.463 13.481 -12.347 1.00 0.00 H new ATOM 0 HD12 LEU B 7 12.148 15.014 -11.501 1.00 0.00 H new ATOM 0 HD13 LEU B 7 12.375 13.515 -10.570 1.00 0.00 H new ATOM 0 HD21 LEU B 7 10.686 11.750 -12.516 1.00 0.00 H new ATOM 0 HD22 LEU B 7 10.482 11.671 -10.749 1.00 0.00 H new ATOM 0 HD23 LEU B 7 9.085 12.031 -11.792 1.00 0.00 H new ATOM 1135 N ARG B 8 7.240 15.737 -9.266 1.00 0.00 N ATOM 1136 CA ARG B 8 6.338 16.147 -8.203 1.00 0.00 C ATOM 1137 C ARG B 8 5.705 14.921 -7.541 1.00 0.00 C ATOM 1138 O ARG B 8 6.345 13.877 -7.420 1.00 0.00 O ATOM 1139 CB ARG B 8 5.231 17.056 -8.740 1.00 0.00 C ATOM 1140 CG ARG B 8 5.793 18.078 -9.730 1.00 0.00 C ATOM 1141 CD ARG B 8 4.732 19.111 -10.113 1.00 0.00 C ATOM 1142 NE ARG B 8 5.302 20.095 -11.060 1.00 0.00 N ATOM 1143 CZ ARG B 8 6.010 21.171 -10.690 1.00 0.00 C ATOM 1144 NH1 ARG B 8 6.239 21.408 -9.391 1.00 0.00 N ATOM 1145 NH2 ARG B 8 6.489 22.010 -11.619 1.00 0.00 N ATOM 0 H ARG B 8 6.868 15.019 -9.888 1.00 0.00 H new ATOM 0 HA ARG B 8 6.922 16.700 -7.468 1.00 0.00 H new ATOM 0 HB2 ARG B 8 4.466 16.453 -9.229 1.00 0.00 H new ATOM 0 HB3 ARG B 8 4.747 17.574 -7.912 1.00 0.00 H new ATOM 0 HG2 ARG B 8 6.653 18.581 -9.289 1.00 0.00 H new ATOM 0 HG3 ARG B 8 6.147 17.566 -10.625 1.00 0.00 H new ATOM 0 HD2 ARG B 8 3.874 18.613 -10.566 1.00 0.00 H new ATOM 0 HD3 ARG B 8 4.370 19.621 -9.220 1.00 0.00 H new ATOM 0 HE ARG B 8 5.146 19.945 -12.057 1.00 0.00 H new ATOM 0 HH11 ARG B 8 5.874 20.769 -8.684 1.00 0.00 H new ATOM 0 HH12 ARG B 8 6.778 22.227 -9.109 1.00 0.00 H new ATOM 0 HH21 ARG B 8 6.315 21.830 -12.608 1.00 0.00 H new ATOM 0 HH22 ARG B 8 7.028 22.829 -11.337 1.00 0.00 H new ATOM 1159 N CYS B 9 4.457 15.088 -7.129 1.00 0.00 N ATOM 1160 CA CYS B 9 3.731 14.008 -6.483 1.00 0.00 C ATOM 1161 C CYS B 9 2.975 13.227 -7.559 1.00 0.00 C ATOM 1162 O CYS B 9 2.682 13.760 -8.628 1.00 0.00 O ATOM 1163 CB CYS B 9 2.794 14.530 -5.391 1.00 0.00 C ATOM 1164 SG CYS B 9 3.614 15.509 -4.080 1.00 0.00 S ATOM 0 H CYS B 9 3.930 15.955 -7.230 1.00 0.00 H new ATOM 0 HA CYS B 9 4.433 13.344 -5.980 1.00 0.00 H new ATOM 0 HB2 CYS B 9 2.024 15.145 -5.856 1.00 0.00 H new ATOM 0 HB3 CYS B 9 2.289 13.682 -4.929 1.00 0.00 H new ATOM 1169 N GLN B 10 2.679 11.976 -7.238 1.00 0.00 N ATOM 1170 CA GLN B 10 1.962 11.115 -8.164 1.00 0.00 C ATOM 1171 C GLN B 10 0.455 11.347 -8.045 1.00 0.00 C ATOM 1172 O GLN B 10 -0.326 10.784 -8.811 1.00 0.00 O ATOM 1173 CB GLN B 10 2.311 9.644 -7.928 1.00 0.00 C ATOM 1174 CG GLN B 10 2.385 8.879 -9.251 1.00 0.00 C ATOM 1175 CD GLN B 10 1.339 7.764 -9.299 1.00 0.00 C ATOM 1176 OE1 GLN B 10 0.200 7.962 -9.688 1.00 0.00 O ATOM 1177 NE2 GLN B 10 1.788 6.583 -8.883 1.00 0.00 N ATOM 0 H GLN B 10 2.923 11.538 -6.350 1.00 0.00 H new ATOM 0 HA GLN B 10 2.270 11.369 -9.178 1.00 0.00 H new ATOM 0 HB2 GLN B 10 3.266 9.572 -7.408 1.00 0.00 H new ATOM 0 HB3 GLN B 10 1.561 9.188 -7.281 1.00 0.00 H new ATOM 0 HG2 GLN B 10 2.227 9.567 -10.082 1.00 0.00 H new ATOM 0 HG3 GLN B 10 3.381 8.454 -9.374 1.00 0.00 H new ATOM 0 HE21 GLN B 10 2.754 6.486 -8.570 1.00 0.00 H new ATOM 0 HE22 GLN B 10 1.166 5.774 -8.877 1.00 0.00 H new ATOM 1186 N CYS B 11 0.090 12.177 -7.078 1.00 0.00 N ATOM 1187 CA CYS B 11 -1.310 12.490 -6.849 1.00 0.00 C ATOM 1188 C CYS B 11 -1.409 13.951 -6.406 1.00 0.00 C ATOM 1189 O CYS B 11 -0.739 14.364 -5.461 1.00 0.00 O ATOM 1190 CB CYS B 11 -1.942 11.540 -5.829 1.00 0.00 C ATOM 1191 SG CYS B 11 -3.304 10.507 -6.483 1.00 0.00 S ATOM 0 H CYS B 11 0.740 12.642 -6.444 1.00 0.00 H new ATOM 0 HA CYS B 11 -1.872 12.353 -7.773 1.00 0.00 H new ATOM 0 HB2 CYS B 11 -1.166 10.885 -5.434 1.00 0.00 H new ATOM 0 HB3 CYS B 11 -2.320 12.127 -4.992 1.00 0.00 H new ATOM 1196 N LEU B 12 -2.251 14.693 -7.110 1.00 0.00 N ATOM 1197 CA LEU B 12 -2.447 16.099 -6.801 1.00 0.00 C ATOM 1198 C LEU B 12 -3.542 16.237 -5.742 1.00 0.00 C ATOM 1199 O LEU B 12 -3.614 17.249 -5.046 1.00 0.00 O ATOM 1200 CB LEU B 12 -2.724 16.895 -8.079 1.00 0.00 C ATOM 1201 CG LEU B 12 -1.813 16.588 -9.270 1.00 0.00 C ATOM 1202 CD1 LEU B 12 -2.522 16.887 -10.593 1.00 0.00 C ATOM 1203 CD2 LEU B 12 -0.484 17.335 -9.150 1.00 0.00 C ATOM 0 H LEU B 12 -2.805 14.347 -7.893 1.00 0.00 H new ATOM 0 HA LEU B 12 -1.538 16.526 -6.377 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -3.756 16.714 -8.380 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.641 17.957 -7.847 1.00 0.00 H new ATOM 0 HG LEU B 12 -1.585 15.522 -9.261 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -1.853 16.661 -11.423 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -3.419 16.273 -10.672 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -2.799 17.941 -10.627 1.00 0.00 H new ATOM 0 HD21 LEU B 12 0.145 17.099 -10.009 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -0.671 18.408 -9.121 1.00 0.00 H new ATOM 0 HD23 LEU B 12 0.023 17.030 -8.235 1.00 0.00 H new ATOM 1215 N GLN B 13 -4.369 15.205 -5.653 1.00 0.00 N ATOM 1216 CA GLN B 13 -5.457 15.198 -4.691 1.00 0.00 C ATOM 1217 C GLN B 13 -5.519 13.850 -3.970 1.00 0.00 C ATOM 1218 O GLN B 13 -4.850 12.898 -4.368 1.00 0.00 O ATOM 1219 CB GLN B 13 -6.790 15.520 -5.368 1.00 0.00 C ATOM 1220 CG GLN B 13 -7.716 16.286 -4.421 1.00 0.00 C ATOM 1221 CD GLN B 13 -7.969 17.706 -4.931 1.00 0.00 C ATOM 1222 OE1 GLN B 13 -7.288 18.208 -5.810 1.00 0.00 O ATOM 1223 NE2 GLN B 13 -8.984 18.323 -4.332 1.00 0.00 N ATOM 0 H GLN B 13 -4.307 14.368 -6.232 1.00 0.00 H new ATOM 0 HA GLN B 13 -5.267 15.975 -3.951 1.00 0.00 H new ATOM 0 HB2 GLN B 13 -6.612 16.112 -6.266 1.00 0.00 H new ATOM 0 HB3 GLN B 13 -7.273 14.596 -5.686 1.00 0.00 H new ATOM 0 HG2 GLN B 13 -8.664 15.756 -4.326 1.00 0.00 H new ATOM 0 HG3 GLN B 13 -7.272 16.327 -3.426 1.00 0.00 H new ATOM 0 HE21 GLN B 13 -9.513 17.844 -3.603 1.00 0.00 H new ATOM 0 HE22 GLN B 13 -9.233 19.275 -4.602 1.00 0.00 H new ATOM 1232 N THR B 14 -6.329 13.812 -2.922 1.00 0.00 N ATOM 1233 CA THR B 14 -6.488 12.597 -2.142 1.00 0.00 C ATOM 1234 C THR B 14 -7.895 12.526 -1.544 1.00 0.00 C ATOM 1235 O THR B 14 -8.616 13.523 -1.525 1.00 0.00 O ATOM 1236 CB THR B 14 -5.378 12.562 -1.090 1.00 0.00 C ATOM 1237 OG1 THR B 14 -5.251 13.919 -0.674 1.00 0.00 O ATOM 1238 CG2 THR B 14 -4.012 12.226 -1.691 1.00 0.00 C ATOM 0 H THR B 14 -6.882 14.604 -2.595 1.00 0.00 H new ATOM 0 HA THR B 14 -6.391 11.710 -2.768 1.00 0.00 H new ATOM 0 HB THR B 14 -5.627 11.828 -0.324 1.00 0.00 H new ATOM 0 HG1 THR B 14 -4.462 14.013 -0.100 1.00 0.00 H new ATOM 0 HG21 THR B 14 -3.260 12.214 -0.902 1.00 0.00 H new ATOM 0 HG22 THR B 14 -4.055 11.246 -2.166 1.00 0.00 H new ATOM 0 HG23 THR B 14 -3.746 12.978 -2.434 1.00 0.00 H new ATOM 1246 N LEU B 15 -8.243 11.339 -1.070 1.00 0.00 N ATOM 1247 CA LEU B 15 -9.550 11.126 -0.474 1.00 0.00 C ATOM 1248 C LEU B 15 -9.434 11.228 1.049 1.00 0.00 C ATOM 1249 O LEU B 15 -8.341 11.116 1.600 1.00 0.00 O ATOM 1250 CB LEU B 15 -10.150 9.804 -0.957 1.00 0.00 C ATOM 1251 CG LEU B 15 -10.506 9.732 -2.443 1.00 0.00 C ATOM 1252 CD1 LEU B 15 -10.535 8.282 -2.930 1.00 0.00 C ATOM 1253 CD2 LEU B 15 -11.821 10.459 -2.728 1.00 0.00 C ATOM 0 H LEU B 15 -7.642 10.515 -1.087 1.00 0.00 H new ATOM 0 HA LEU B 15 -10.246 11.902 -0.794 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -9.444 9.004 -0.734 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -11.051 9.604 -0.378 1.00 0.00 H new ATOM 0 HG LEU B 15 -9.727 10.245 -3.006 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -10.791 8.259 -3.989 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -9.554 7.829 -2.783 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -11.281 7.723 -2.365 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -12.050 10.392 -3.791 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -12.624 9.997 -2.154 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -11.727 11.507 -2.442 1.00 0.00 H new ATOM 1265 N GLN B 16 -10.577 11.441 1.684 1.00 0.00 N ATOM 1266 CA GLN B 16 -10.617 11.560 3.132 1.00 0.00 C ATOM 1267 C GLN B 16 -10.916 10.202 3.768 1.00 0.00 C ATOM 1268 O GLN B 16 -10.773 10.034 4.978 1.00 0.00 O ATOM 1269 CB GLN B 16 -11.644 12.608 3.567 1.00 0.00 C ATOM 1270 CG GLN B 16 -12.054 12.400 5.027 1.00 0.00 C ATOM 1271 CD GLN B 16 -12.736 13.649 5.588 1.00 0.00 C ATOM 1272 OE1 GLN B 16 -13.946 13.798 5.549 1.00 0.00 O ATOM 1273 NE2 GLN B 16 -11.894 14.536 6.111 1.00 0.00 N ATOM 0 H GLN B 16 -11.482 11.534 1.223 1.00 0.00 H new ATOM 0 HA GLN B 16 -9.638 11.893 3.477 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -11.226 13.607 3.442 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -12.524 12.548 2.926 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -12.730 11.548 5.101 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -11.174 12.162 5.625 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -10.891 14.349 6.111 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -12.251 15.403 6.512 1.00 0.00 H new ATOM 1282 N GLY B 17 -11.326 9.266 2.924 1.00 0.00 N ATOM 1283 CA GLY B 17 -11.646 7.927 3.389 1.00 0.00 C ATOM 1284 C GLY B 17 -12.929 7.412 2.736 1.00 0.00 C ATOM 1285 O GLY B 17 -14.030 7.736 3.180 1.00 0.00 O ATOM 0 H GLY B 17 -11.444 9.409 1.921 1.00 0.00 H new ATOM 0 HA2 GLY B 17 -10.821 7.252 3.160 1.00 0.00 H new ATOM 0 HA3 GLY B 17 -11.762 7.933 4.473 1.00 0.00 H new ATOM 1289 N ILE B 18 -12.746 6.618 1.691 1.00 0.00 N ATOM 1290 CA ILE B 18 -13.876 6.054 0.972 1.00 0.00 C ATOM 1291 C ILE B 18 -14.093 4.609 1.423 1.00 0.00 C ATOM 1292 O ILE B 18 -13.207 4.002 2.023 1.00 0.00 O ATOM 1293 CB ILE B 18 -13.679 6.205 -0.538 1.00 0.00 C ATOM 1294 CG1 ILE B 18 -14.118 7.592 -1.013 1.00 0.00 C ATOM 1295 CG2 ILE B 18 -14.394 5.086 -1.298 1.00 0.00 C ATOM 1296 CD1 ILE B 18 -14.299 7.619 -2.532 1.00 0.00 C ATOM 0 H ILE B 18 -11.832 6.352 1.325 1.00 0.00 H new ATOM 0 HA ILE B 18 -14.789 6.601 1.207 1.00 0.00 H new ATOM 0 HB ILE B 18 -12.615 6.113 -0.755 1.00 0.00 H new ATOM 0 HG12 ILE B 18 -15.054 7.868 -0.527 1.00 0.00 H new ATOM 0 HG13 ILE B 18 -13.375 8.333 -0.718 1.00 0.00 H new ATOM 0 HG21 ILE B 18 -14.238 5.216 -2.369 1.00 0.00 H new ATOM 0 HG22 ILE B 18 -13.992 4.121 -0.988 1.00 0.00 H new ATOM 0 HG23 ILE B 18 -15.461 5.122 -1.079 1.00 0.00 H new ATOM 0 HD11 ILE B 18 -14.611 8.616 -2.844 1.00 0.00 H new ATOM 0 HD12 ILE B 18 -13.355 7.367 -3.015 1.00 0.00 H new ATOM 0 HD13 ILE B 18 -15.060 6.894 -2.821 1.00 0.00 H new ATOM 1308 N HIS B 19 -15.276 4.098 1.117 1.00 0.00 N ATOM 1309 CA HIS B 19 -15.621 2.735 1.483 1.00 0.00 C ATOM 1310 C HIS B 19 -14.524 1.782 1.004 1.00 0.00 C ATOM 1311 O HIS B 19 -14.053 1.890 -0.127 1.00 0.00 O ATOM 1312 CB HIS B 19 -17.005 2.361 0.949 1.00 0.00 C ATOM 1313 CG HIS B 19 -17.861 1.604 1.936 1.00 0.00 C ATOM 1314 ND1 HIS B 19 -19.220 1.415 1.758 1.00 0.00 N ATOM 1315 CD2 HIS B 19 -17.537 0.992 3.110 1.00 0.00 C ATOM 1316 CE1 HIS B 19 -19.683 0.719 2.786 1.00 0.00 C ATOM 1317 NE2 HIS B 19 -18.638 0.458 3.623 1.00 0.00 N ATOM 0 H HIS B 19 -16.009 4.604 0.619 1.00 0.00 H new ATOM 0 HA HIS B 19 -15.680 2.651 2.568 1.00 0.00 H new ATOM 0 HB2 HIS B 19 -17.527 3.271 0.654 1.00 0.00 H new ATOM 0 HB3 HIS B 19 -16.885 1.757 0.050 1.00 0.00 H new ATOM 0 HD2 HIS B 19 -16.551 0.949 3.548 1.00 0.00 H new ATOM 0 HE1 HIS B 19 -20.708 0.412 2.935 1.00 0.00 H new ATOM 0 HE2 HIS B 19 -18.694 -0.062 4.499 1.00 0.00 H new ATOM 1325 N LEU B 20 -14.149 0.870 1.889 1.00 0.00 N ATOM 1326 CA LEU B 20 -13.116 -0.101 1.571 1.00 0.00 C ATOM 1327 C LEU B 20 -13.742 -1.278 0.820 1.00 0.00 C ATOM 1328 O LEU B 20 -13.078 -2.282 0.567 1.00 0.00 O ATOM 1329 CB LEU B 20 -12.358 -0.512 2.835 1.00 0.00 C ATOM 1330 CG LEU B 20 -11.128 -1.396 2.623 1.00 0.00 C ATOM 1331 CD1 LEU B 20 -10.095 -0.695 1.738 1.00 0.00 C ATOM 1332 CD2 LEU B 20 -10.531 -1.836 3.961 1.00 0.00 C ATOM 0 H LEU B 20 -14.542 0.783 2.826 1.00 0.00 H new ATOM 0 HA LEU B 20 -12.370 0.340 0.910 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -12.045 0.392 3.357 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -13.049 -1.038 3.494 1.00 0.00 H new ATOM 0 HG LEU B 20 -11.443 -2.298 2.099 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -9.230 -1.345 1.603 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -10.538 -0.474 0.767 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -9.780 0.234 2.213 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -9.658 -2.463 3.781 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -10.235 -0.957 4.534 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -11.274 -2.401 4.523 1.00 0.00 H new ATOM 1344 N LYS B 21 -15.014 -1.116 0.485 1.00 0.00 N ATOM 1345 CA LYS B 21 -15.737 -2.152 -0.232 1.00 0.00 C ATOM 1346 C LYS B 21 -15.409 -2.059 -1.723 1.00 0.00 C ATOM 1347 O LYS B 21 -15.609 -3.018 -2.467 1.00 0.00 O ATOM 1348 CB LYS B 21 -17.234 -2.071 0.075 1.00 0.00 C ATOM 1349 CG LYS B 21 -18.062 -2.626 -1.085 1.00 0.00 C ATOM 1350 CD LYS B 21 -17.826 -4.128 -1.259 1.00 0.00 C ATOM 1351 CE LYS B 21 -18.625 -4.931 -0.231 1.00 0.00 C ATOM 1352 NZ LYS B 21 -18.512 -6.381 -0.505 1.00 0.00 N ATOM 0 H LYS B 21 -15.562 -0.282 0.697 1.00 0.00 H new ATOM 0 HA LYS B 21 -15.419 -3.139 0.103 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -17.453 -2.631 0.984 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -17.515 -1.035 0.264 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -19.120 -2.439 -0.903 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -17.800 -2.104 -2.005 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -18.114 -4.431 -2.266 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -16.764 -4.348 -1.152 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -18.259 -4.715 0.773 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -19.672 -4.630 -0.260 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 -19.060 -6.912 0.202 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 -18.883 -6.585 -1.455 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 -17.513 -6.667 -0.455 1.00 0.00 H new ATOM 1366 N ASN B 22 -14.910 -0.896 -2.115 1.00 0.00 N ATOM 1367 CA ASN B 22 -14.553 -0.665 -3.504 1.00 0.00 C ATOM 1368 C ASN B 22 -13.049 -0.884 -3.682 1.00 0.00 C ATOM 1369 O ASN B 22 -12.616 -1.468 -4.675 1.00 0.00 O ATOM 1370 CB ASN B 22 -14.875 0.770 -3.925 1.00 0.00 C ATOM 1371 CG ASN B 22 -16.199 0.834 -4.689 1.00 0.00 C ATOM 1372 OD1 ASN B 22 -16.415 0.138 -5.667 1.00 0.00 O ATOM 1373 ND2 ASN B 22 -17.070 1.706 -4.189 1.00 0.00 N ATOM 0 H ASN B 22 -14.745 -0.103 -1.495 1.00 0.00 H new ATOM 0 HA ASN B 22 -15.127 -1.358 -4.119 1.00 0.00 H new ATOM 0 HB2 ASN B 22 -14.929 1.408 -3.043 1.00 0.00 H new ATOM 0 HB3 ASN B 22 -14.071 1.158 -4.550 1.00 0.00 H new ATOM 0 HD21 ASN B 22 -17.983 1.823 -4.628 1.00 0.00 H new ATOM 0 HD22 ASN B 22 -16.825 2.258 -3.367 1.00 0.00 H new ATOM 1380 N ILE B 23 -12.294 -0.403 -2.706 1.00 0.00 N ATOM 1381 CA ILE B 23 -10.847 -0.539 -2.742 1.00 0.00 C ATOM 1382 C ILE B 23 -10.481 -2.022 -2.837 1.00 0.00 C ATOM 1383 O ILE B 23 -10.960 -2.835 -2.049 1.00 0.00 O ATOM 1384 CB ILE B 23 -10.212 0.176 -1.548 1.00 0.00 C ATOM 1385 CG1 ILE B 23 -10.038 1.669 -1.832 1.00 0.00 C ATOM 1386 CG2 ILE B 23 -8.893 -0.489 -1.149 1.00 0.00 C ATOM 1387 CD1 ILE B 23 -10.465 2.510 -0.627 1.00 0.00 C ATOM 0 H ILE B 23 -12.656 0.082 -1.885 1.00 0.00 H new ATOM 0 HA ILE B 23 -10.440 -0.052 -3.628 1.00 0.00 H new ATOM 0 HB ILE B 23 -10.888 0.087 -0.698 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -8.996 1.878 -2.075 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -10.630 1.949 -2.703 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -8.462 0.039 -0.298 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -9.077 -1.528 -0.876 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -8.198 -0.452 -1.988 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -10.331 3.567 -0.855 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -11.514 2.317 -0.402 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -9.854 2.245 0.236 1.00 0.00 H new ATOM 1399 N GLN B 24 -9.634 -2.328 -3.810 1.00 0.00 N ATOM 1400 CA GLN B 24 -9.198 -3.698 -4.018 1.00 0.00 C ATOM 1401 C GLN B 24 -7.704 -3.831 -3.720 1.00 0.00 C ATOM 1402 O GLN B 24 -7.212 -4.930 -3.471 1.00 0.00 O ATOM 1403 CB GLN B 24 -9.517 -4.165 -5.440 1.00 0.00 C ATOM 1404 CG GLN B 24 -10.110 -5.575 -5.435 1.00 0.00 C ATOM 1405 CD GLN B 24 -9.011 -6.631 -5.300 1.00 0.00 C ATOM 1406 OE1 GLN B 24 -8.990 -7.429 -4.378 1.00 0.00 O ATOM 1407 NE2 GLN B 24 -8.101 -6.591 -6.270 1.00 0.00 N ATOM 0 H GLN B 24 -9.239 -1.651 -4.462 1.00 0.00 H new ATOM 0 HA GLN B 24 -9.745 -4.341 -3.328 1.00 0.00 H new ATOM 0 HB2 GLN B 24 -10.219 -3.473 -5.905 1.00 0.00 H new ATOM 0 HB3 GLN B 24 -8.609 -4.151 -6.043 1.00 0.00 H new ATOM 0 HG2 GLN B 24 -10.817 -5.673 -4.611 1.00 0.00 H new ATOM 0 HG3 GLN B 24 -10.669 -5.742 -6.356 1.00 0.00 H new ATOM 0 HE21 GLN B 24 -8.178 -5.896 -7.013 1.00 0.00 H new ATOM 0 HE22 GLN B 24 -7.327 -7.255 -6.270 1.00 0.00 H new ATOM 1416 N SER B 25 -7.023 -2.694 -3.754 1.00 0.00 N ATOM 1417 CA SER B 25 -5.594 -2.670 -3.490 1.00 0.00 C ATOM 1418 C SER B 25 -5.178 -1.284 -2.993 1.00 0.00 C ATOM 1419 O SER B 25 -5.836 -0.290 -3.292 1.00 0.00 O ATOM 1420 CB SER B 25 -4.797 -3.047 -4.740 1.00 0.00 C ATOM 1421 OG SER B 25 -5.562 -3.842 -5.642 1.00 0.00 O ATOM 0 H SER B 25 -7.434 -1.784 -3.960 1.00 0.00 H new ATOM 0 HA SER B 25 -5.376 -3.407 -2.717 1.00 0.00 H new ATOM 0 HB2 SER B 25 -4.467 -2.140 -5.247 1.00 0.00 H new ATOM 0 HB3 SER B 25 -3.900 -3.593 -4.447 1.00 0.00 H new ATOM 0 HG SER B 25 -5.054 -3.980 -6.468 1.00 0.00 H new ATOM 1427 N VAL B 26 -4.086 -1.264 -2.242 1.00 0.00 N ATOM 1428 CA VAL B 26 -3.574 -0.016 -1.700 1.00 0.00 C ATOM 1429 C VAL B 26 -2.087 0.108 -2.035 1.00 0.00 C ATOM 1430 O VAL B 26 -1.321 -0.834 -1.835 1.00 0.00 O ATOM 1431 CB VAL B 26 -3.857 0.057 -0.198 1.00 0.00 C ATOM 1432 CG1 VAL B 26 -3.034 1.166 0.461 1.00 0.00 C ATOM 1433 CG2 VAL B 26 -5.351 0.248 0.071 1.00 0.00 C ATOM 0 H VAL B 26 -3.542 -2.091 -1.996 1.00 0.00 H new ATOM 0 HA VAL B 26 -4.081 0.835 -2.154 1.00 0.00 H new ATOM 0 HB VAL B 26 -3.557 -0.892 0.246 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -3.254 1.197 1.528 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -1.972 0.967 0.315 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -3.289 2.125 0.010 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -5.524 0.297 1.146 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -5.689 1.175 -0.393 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -5.906 -0.591 -0.348 1.00 0.00 H new ATOM 1443 N LYS B 27 -1.722 1.277 -2.541 1.00 0.00 N ATOM 1444 CA LYS B 27 -0.340 1.537 -2.906 1.00 0.00 C ATOM 1445 C LYS B 27 0.131 2.821 -2.221 1.00 0.00 C ATOM 1446 O LYS B 27 -0.509 3.864 -2.343 1.00 0.00 O ATOM 1447 CB LYS B 27 -0.183 1.557 -4.427 1.00 0.00 C ATOM 1448 CG LYS B 27 1.294 1.558 -4.826 1.00 0.00 C ATOM 1449 CD LYS B 27 1.948 2.904 -4.504 1.00 0.00 C ATOM 1450 CE LYS B 27 2.734 3.433 -5.705 1.00 0.00 C ATOM 1451 NZ LYS B 27 2.067 4.623 -6.278 1.00 0.00 N ATOM 0 H LYS B 27 -2.360 2.055 -2.707 1.00 0.00 H new ATOM 0 HA LYS B 27 0.306 0.733 -2.553 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -0.679 0.688 -4.859 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -0.674 2.440 -4.835 1.00 0.00 H new ATOM 0 HG2 LYS B 27 1.817 0.760 -4.299 1.00 0.00 H new ATOM 0 HG3 LYS B 27 1.387 1.350 -5.892 1.00 0.00 H new ATOM 0 HD2 LYS B 27 1.182 3.626 -4.220 1.00 0.00 H new ATOM 0 HD3 LYS B 27 2.615 2.793 -3.649 1.00 0.00 H new ATOM 0 HE2 LYS B 27 3.748 3.690 -5.399 1.00 0.00 H new ATOM 0 HE3 LYS B 27 2.817 2.655 -6.464 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 2.595 4.949 -7.113 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 1.096 4.376 -6.557 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 2.040 5.382 -5.567 1.00 0.00 H new ATOM 1465 N VAL B 28 1.248 2.704 -1.517 1.00 0.00 N ATOM 1466 CA VAL B 28 1.812 3.843 -0.814 1.00 0.00 C ATOM 1467 C VAL B 28 3.147 4.224 -1.457 1.00 0.00 C ATOM 1468 O VAL B 28 4.043 3.390 -1.577 1.00 0.00 O ATOM 1469 CB VAL B 28 1.936 3.527 0.678 1.00 0.00 C ATOM 1470 CG1 VAL B 28 3.118 4.274 1.300 1.00 0.00 C ATOM 1471 CG2 VAL B 28 0.635 3.847 1.417 1.00 0.00 C ATOM 0 H VAL B 28 1.777 1.838 -1.419 1.00 0.00 H new ATOM 0 HA VAL B 28 1.153 4.707 -0.897 1.00 0.00 H new ATOM 0 HB VAL B 28 2.124 2.458 0.779 1.00 0.00 H new ATOM 0 HG11 VAL B 28 3.184 4.032 2.361 1.00 0.00 H new ATOM 0 HG12 VAL B 28 4.040 3.975 0.802 1.00 0.00 H new ATOM 0 HG13 VAL B 28 2.973 5.348 1.181 1.00 0.00 H new ATOM 0 HG21 VAL B 28 0.751 3.613 2.475 1.00 0.00 H new ATOM 0 HG22 VAL B 28 0.403 4.906 1.303 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -0.176 3.250 1.000 1.00 0.00 H new ATOM 1481 N LYS B 29 3.237 5.484 -1.855 1.00 0.00 N ATOM 1482 CA LYS B 29 4.447 5.986 -2.483 1.00 0.00 C ATOM 1483 C LYS B 29 4.960 7.196 -1.698 1.00 0.00 C ATOM 1484 O LYS B 29 4.644 8.336 -2.033 1.00 0.00 O ATOM 1485 CB LYS B 29 4.202 6.274 -3.965 1.00 0.00 C ATOM 1486 CG LYS B 29 5.522 6.355 -4.734 1.00 0.00 C ATOM 1487 CD LYS B 29 6.143 7.749 -4.612 1.00 0.00 C ATOM 1488 CE LYS B 29 6.477 8.323 -5.990 1.00 0.00 C ATOM 1489 NZ LYS B 29 7.602 7.581 -6.602 1.00 0.00 N ATOM 0 H LYS B 29 2.491 6.173 -1.755 1.00 0.00 H new ATOM 0 HA LYS B 29 5.232 5.230 -2.454 1.00 0.00 H new ATOM 0 HB2 LYS B 29 3.576 5.491 -4.392 1.00 0.00 H new ATOM 0 HB3 LYS B 29 3.657 7.212 -4.071 1.00 0.00 H new ATOM 0 HG2 LYS B 29 6.217 5.608 -4.350 1.00 0.00 H new ATOM 0 HG3 LYS B 29 5.350 6.120 -5.784 1.00 0.00 H new ATOM 0 HD2 LYS B 29 5.452 8.415 -4.095 1.00 0.00 H new ATOM 0 HD3 LYS B 29 7.048 7.696 -4.007 1.00 0.00 H new ATOM 0 HE2 LYS B 29 5.601 8.265 -6.636 1.00 0.00 H new ATOM 0 HE3 LYS B 29 6.736 9.378 -5.898 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 7.827 7.994 -7.529 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 8.436 7.643 -5.984 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 7.335 6.583 -6.723 1.00 0.00 H new ATOM 1503 N SER B 30 5.744 6.905 -0.671 1.00 0.00 N ATOM 1504 CA SER B 30 6.304 7.954 0.164 1.00 0.00 C ATOM 1505 C SER B 30 6.891 9.063 -0.712 1.00 0.00 C ATOM 1506 O SER B 30 6.951 8.927 -1.933 1.00 0.00 O ATOM 1507 CB SER B 30 7.375 7.398 1.104 1.00 0.00 C ATOM 1508 OG SER B 30 6.967 7.452 2.469 1.00 0.00 O ATOM 0 H SER B 30 6.005 5.958 -0.398 1.00 0.00 H new ATOM 0 HA SER B 30 5.502 8.368 0.775 1.00 0.00 H new ATOM 0 HB2 SER B 30 7.596 6.366 0.832 1.00 0.00 H new ATOM 0 HB3 SER B 30 8.297 7.965 0.979 1.00 0.00 H new ATOM 0 HG SER B 30 7.068 6.566 2.876 1.00 0.00 H new ATOM 1514 N PRO B 31 7.320 10.163 -0.037 1.00 0.00 N ATOM 1515 CA PRO B 31 7.900 11.293 -0.741 1.00 0.00 C ATOM 1516 C PRO B 31 9.324 10.979 -1.204 1.00 0.00 C ATOM 1517 O PRO B 31 9.839 9.892 -0.946 1.00 0.00 O ATOM 1518 CB PRO B 31 7.838 12.446 0.247 1.00 0.00 C ATOM 1519 CG PRO B 31 7.656 11.812 1.617 1.00 0.00 C ATOM 1520 CD PRO B 31 7.264 10.358 1.408 1.00 0.00 C ATOM 0 HA PRO B 31 7.361 11.540 -1.656 1.00 0.00 H new ATOM 0 HB2 PRO B 31 8.750 13.041 0.210 1.00 0.00 H new ATOM 0 HB3 PRO B 31 7.011 13.116 0.014 1.00 0.00 H new ATOM 0 HG2 PRO B 31 8.578 11.880 2.195 1.00 0.00 H new ATOM 0 HG3 PRO B 31 6.886 12.338 2.182 1.00 0.00 H new ATOM 0 HD2 PRO B 31 7.948 9.685 1.925 1.00 0.00 H new ATOM 0 HD3 PRO B 31 6.265 10.157 1.796 1.00 0.00 H new ATOM 1528 N GLY B 32 9.920 11.950 -1.880 1.00 0.00 N ATOM 1529 CA GLY B 32 11.275 11.791 -2.382 1.00 0.00 C ATOM 1530 C GLY B 32 11.974 13.146 -2.512 1.00 0.00 C ATOM 1531 O GLY B 32 11.590 14.112 -1.855 1.00 0.00 O ATOM 0 H GLY B 32 9.490 12.850 -2.092 1.00 0.00 H new ATOM 0 HA2 GLY B 32 11.843 11.148 -1.709 1.00 0.00 H new ATOM 0 HA3 GLY B 32 11.251 11.295 -3.353 1.00 0.00 H new ATOM 1535 N PRO B 33 13.016 13.173 -3.386 1.00 0.00 N ATOM 1536 CA PRO B 33 13.772 14.393 -3.610 1.00 0.00 C ATOM 1537 C PRO B 33 12.980 15.380 -4.470 1.00 0.00 C ATOM 1538 O PRO B 33 13.464 16.467 -4.780 1.00 0.00 O ATOM 1539 CB PRO B 33 15.066 13.939 -4.267 1.00 0.00 C ATOM 1540 CG PRO B 33 14.791 12.545 -4.808 1.00 0.00 C ATOM 1541 CD PRO B 33 13.499 12.048 -4.181 1.00 0.00 C ATOM 0 HA PRO B 33 13.978 14.935 -2.687 1.00 0.00 H new ATOM 0 HB2 PRO B 33 15.357 14.619 -5.068 1.00 0.00 H new ATOM 0 HB3 PRO B 33 15.885 13.925 -3.548 1.00 0.00 H new ATOM 0 HG2 PRO B 33 14.704 12.567 -5.894 1.00 0.00 H new ATOM 0 HG3 PRO B 33 15.615 11.873 -4.568 1.00 0.00 H new ATOM 0 HD2 PRO B 33 12.774 11.761 -4.943 1.00 0.00 H new ATOM 0 HD3 PRO B 33 13.673 11.170 -3.559 1.00 0.00 H new ATOM 1549 N HIS B 34 11.774 14.965 -4.831 1.00 0.00 N ATOM 1550 CA HIS B 34 10.909 15.799 -5.648 1.00 0.00 C ATOM 1551 C HIS B 34 9.650 16.161 -4.859 1.00 0.00 C ATOM 1552 O HIS B 34 9.358 17.339 -4.656 1.00 0.00 O ATOM 1553 CB HIS B 34 10.597 15.114 -6.981 1.00 0.00 C ATOM 1554 CG HIS B 34 10.482 13.612 -6.888 1.00 0.00 C ATOM 1555 ND1 HIS B 34 11.555 12.795 -6.578 1.00 0.00 N ATOM 1556 CD2 HIS B 34 9.409 12.788 -7.065 1.00 0.00 C ATOM 1557 CE1 HIS B 34 11.137 11.538 -6.574 1.00 0.00 C ATOM 1558 NE2 HIS B 34 9.807 11.536 -6.876 1.00 0.00 N ATOM 0 H HIS B 34 11.376 14.062 -4.573 1.00 0.00 H new ATOM 0 HA HIS B 34 11.421 16.729 -5.894 1.00 0.00 H new ATOM 0 HB2 HIS B 34 9.663 15.516 -7.374 1.00 0.00 H new ATOM 0 HB3 HIS B 34 11.379 15.364 -7.698 1.00 0.00 H new ATOM 0 HD2 HIS B 34 8.406 13.101 -7.316 1.00 0.00 H new ATOM 0 HE1 HIS B 34 11.743 10.668 -6.368 1.00 0.00 H new ATOM 0 HE2 HIS B 34 9.215 10.708 -6.945 1.00 0.00 H new ATOM 1566 N CYS B 35 8.938 15.128 -4.435 1.00 0.00 N ATOM 1567 CA CYS B 35 7.716 15.323 -3.673 1.00 0.00 C ATOM 1568 C CYS B 35 8.027 15.074 -2.195 1.00 0.00 C ATOM 1569 O CYS B 35 8.356 13.954 -1.807 1.00 0.00 O ATOM 1570 CB CYS B 35 6.585 14.425 -4.177 1.00 0.00 C ATOM 1571 SG CYS B 35 5.035 14.526 -3.208 1.00 0.00 S ATOM 0 H CYS B 35 9.184 14.153 -4.605 1.00 0.00 H new ATOM 0 HA CYS B 35 7.363 16.346 -3.802 1.00 0.00 H new ATOM 0 HB2 CYS B 35 6.367 14.686 -5.213 1.00 0.00 H new ATOM 0 HB3 CYS B 35 6.932 13.392 -4.175 1.00 0.00 H new ATOM 1576 N ALA B 36 7.913 16.137 -1.412 1.00 0.00 N ATOM 1577 CA ALA B 36 8.178 16.047 0.014 1.00 0.00 C ATOM 1578 C ALA B 36 6.876 15.730 0.751 1.00 0.00 C ATOM 1579 O ALA B 36 6.738 16.034 1.935 1.00 0.00 O ATOM 1580 CB ALA B 36 8.818 17.350 0.496 1.00 0.00 C ATOM 0 H ALA B 36 7.641 17.064 -1.738 1.00 0.00 H new ATOM 0 HA ALA B 36 8.880 15.240 0.224 1.00 0.00 H new ATOM 0 HB1 ALA B 36 9.017 17.284 1.566 1.00 0.00 H new ATOM 0 HB2 ALA B 36 9.754 17.515 -0.038 1.00 0.00 H new ATOM 0 HB3 ALA B 36 8.140 18.181 0.304 1.00 0.00 H new ATOM 1586 N GLN B 37 5.953 15.121 0.021 1.00 0.00 N ATOM 1587 CA GLN B 37 4.666 14.759 0.591 1.00 0.00 C ATOM 1588 C GLN B 37 4.298 13.326 0.200 1.00 0.00 C ATOM 1589 O GLN B 37 4.770 12.814 -0.814 1.00 0.00 O ATOM 1590 CB GLN B 37 3.578 15.742 0.157 1.00 0.00 C ATOM 1591 CG GLN B 37 4.099 17.181 0.179 1.00 0.00 C ATOM 1592 CD GLN B 37 4.187 17.711 1.612 1.00 0.00 C ATOM 1593 OE1 GLN B 37 5.398 18.137 1.958 1.00 0.00 O flip ATOM 1594 NE2 GLN B 37 3.219 17.731 2.354 1.00 0.00 N flip ATOM 0 H GLN B 37 6.071 14.869 -0.960 1.00 0.00 H new ATOM 0 HA GLN B 37 4.743 14.811 1.677 1.00 0.00 H new ATOM 0 HB2 GLN B 37 3.235 15.491 -0.847 1.00 0.00 H new ATOM 0 HB3 GLN B 37 2.717 15.653 0.819 1.00 0.00 H new ATOM 0 HG2 GLN B 37 5.083 17.223 -0.289 1.00 0.00 H new ATOM 0 HG3 GLN B 37 3.439 17.819 -0.409 1.00 0.00 H new ATOM 0 HE21 GLN B 37 2.317 17.388 2.024 1.00 0.00 H new ATOM 0 HE22 GLN B 37 3.312 18.091 3.304 1.00 0.00 H new ATOM 1603 N THR B 38 3.457 12.719 1.025 1.00 0.00 N ATOM 1604 CA THR B 38 3.020 11.356 0.779 1.00 0.00 C ATOM 1605 C THR B 38 1.869 11.339 -0.230 1.00 0.00 C ATOM 1606 O THR B 38 1.160 12.332 -0.385 1.00 0.00 O ATOM 1607 CB THR B 38 2.656 10.725 2.125 1.00 0.00 C ATOM 1608 OG1 THR B 38 3.669 11.194 3.012 1.00 0.00 O ATOM 1609 CG2 THR B 38 2.834 9.206 2.126 1.00 0.00 C ATOM 0 H THR B 38 3.067 13.147 1.865 1.00 0.00 H new ATOM 0 HA THR B 38 3.815 10.761 0.329 1.00 0.00 H new ATOM 0 HB THR B 38 1.623 10.969 2.374 1.00 0.00 H new ATOM 0 HG1 THR B 38 3.510 10.834 3.910 1.00 0.00 H new ATOM 0 HG21 THR B 38 2.562 8.808 3.104 1.00 0.00 H new ATOM 0 HG22 THR B 38 2.192 8.764 1.364 1.00 0.00 H new ATOM 0 HG23 THR B 38 3.874 8.961 1.911 1.00 0.00 H new ATOM 1617 N GLU B 39 1.720 10.200 -0.890 1.00 0.00 N ATOM 1618 CA GLU B 39 0.669 10.041 -1.880 1.00 0.00 C ATOM 1619 C GLU B 39 0.215 8.581 -1.942 1.00 0.00 C ATOM 1620 O GLU B 39 0.834 7.763 -2.622 1.00 0.00 O ATOM 1621 CB GLU B 39 1.130 10.531 -3.254 1.00 0.00 C ATOM 1622 CG GLU B 39 2.616 10.239 -3.469 1.00 0.00 C ATOM 1623 CD GLU B 39 3.477 11.422 -3.019 1.00 0.00 C ATOM 1624 OE1 GLU B 39 2.955 12.556 -3.071 1.00 0.00 O ATOM 1625 OE2 GLU B 39 4.638 11.164 -2.633 1.00 0.00 O ATOM 0 H GLU B 39 2.310 9.378 -0.758 1.00 0.00 H new ATOM 0 HA GLU B 39 -0.181 10.653 -1.580 1.00 0.00 H new ATOM 0 HB2 GLU B 39 0.543 10.044 -4.033 1.00 0.00 H new ATOM 0 HB3 GLU B 39 0.950 11.602 -3.341 1.00 0.00 H new ATOM 0 HG2 GLU B 39 2.899 9.346 -2.912 1.00 0.00 H new ATOM 0 HG3 GLU B 39 2.801 10.030 -4.523 1.00 0.00 H new ATOM 1632 N VAL B 40 -0.861 8.297 -1.223 1.00 0.00 N ATOM 1633 CA VAL B 40 -1.404 6.950 -1.188 1.00 0.00 C ATOM 1634 C VAL B 40 -2.362 6.761 -2.366 1.00 0.00 C ATOM 1635 O VAL B 40 -3.277 7.560 -2.562 1.00 0.00 O ATOM 1636 CB VAL B 40 -2.064 6.687 0.167 1.00 0.00 C ATOM 1637 CG1 VAL B 40 -2.647 5.274 0.227 1.00 0.00 C ATOM 1638 CG2 VAL B 40 -1.077 6.922 1.312 1.00 0.00 C ATOM 0 H VAL B 40 -1.371 8.977 -0.660 1.00 0.00 H new ATOM 0 HA VAL B 40 -0.607 6.214 -1.295 1.00 0.00 H new ATOM 0 HB VAL B 40 -2.886 7.394 0.283 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -3.110 5.113 1.200 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -3.396 5.156 -0.556 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -1.850 4.545 0.079 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -1.571 6.728 2.264 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -0.225 6.251 1.202 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -0.730 7.955 1.287 1.00 0.00 H new ATOM 1648 N ILE B 41 -2.120 5.698 -3.120 1.00 0.00 N ATOM 1649 CA ILE B 41 -2.949 5.394 -4.273 1.00 0.00 C ATOM 1650 C ILE B 41 -3.484 3.965 -4.149 1.00 0.00 C ATOM 1651 O ILE B 41 -2.712 3.008 -4.142 1.00 0.00 O ATOM 1652 CB ILE B 41 -2.179 5.651 -5.570 1.00 0.00 C ATOM 1653 CG1 ILE B 41 -1.511 7.027 -5.547 1.00 0.00 C ATOM 1654 CG2 ILE B 41 -3.085 5.473 -6.790 1.00 0.00 C ATOM 1655 CD1 ILE B 41 0.010 6.900 -5.655 1.00 0.00 C ATOM 0 H ILE B 41 -1.361 5.037 -2.954 1.00 0.00 H new ATOM 0 HA ILE B 41 -3.813 6.057 -4.306 1.00 0.00 H new ATOM 0 HB ILE B 41 -1.384 4.909 -5.649 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -1.888 7.632 -6.371 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -1.772 7.546 -4.625 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -2.513 5.661 -7.699 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -3.473 4.454 -6.810 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -3.916 6.176 -6.732 1.00 0.00 H new ATOM 0 HD11 ILE B 41 0.460 7.892 -5.636 1.00 0.00 H new ATOM 0 HD12 ILE B 41 0.387 6.315 -4.816 1.00 0.00 H new ATOM 0 HD13 ILE B 41 0.268 6.402 -6.590 1.00 0.00 H new ATOM 1667 N ALA B 42 -4.802 3.867 -4.053 1.00 0.00 N ATOM 1668 CA ALA B 42 -5.449 2.572 -3.929 1.00 0.00 C ATOM 1669 C ALA B 42 -6.158 2.234 -5.241 1.00 0.00 C ATOM 1670 O ALA B 42 -6.682 3.120 -5.914 1.00 0.00 O ATOM 1671 CB ALA B 42 -6.407 2.592 -2.736 1.00 0.00 C ATOM 0 H ALA B 42 -5.439 4.663 -4.059 1.00 0.00 H new ATOM 0 HA ALA B 42 -4.712 1.791 -3.742 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -6.892 1.621 -2.643 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -5.849 2.808 -1.825 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -7.163 3.362 -2.889 1.00 0.00 H new ATOM 1677 N THR B 43 -6.153 0.949 -5.565 1.00 0.00 N ATOM 1678 CA THR B 43 -6.790 0.483 -6.785 1.00 0.00 C ATOM 1679 C THR B 43 -8.225 0.035 -6.500 1.00 0.00 C ATOM 1680 O THR B 43 -8.470 -0.712 -5.554 1.00 0.00 O ATOM 1681 CB THR B 43 -5.916 -0.623 -7.382 1.00 0.00 C ATOM 1682 OG1 THR B 43 -4.753 0.062 -7.838 1.00 0.00 O ATOM 1683 CG2 THR B 43 -6.518 -1.223 -8.654 1.00 0.00 C ATOM 0 H THR B 43 -5.718 0.216 -5.004 1.00 0.00 H new ATOM 0 HA THR B 43 -6.872 1.285 -7.519 1.00 0.00 H new ATOM 0 HB THR B 43 -5.772 -1.411 -6.642 1.00 0.00 H new ATOM 0 HG1 THR B 43 -4.131 -0.581 -8.238 1.00 0.00 H new ATOM 0 HG21 THR B 43 -5.859 -2.002 -9.036 1.00 0.00 H new ATOM 0 HG22 THR B 43 -7.494 -1.652 -8.427 1.00 0.00 H new ATOM 0 HG23 THR B 43 -6.631 -0.442 -9.406 1.00 0.00 H new ATOM 1691 N LEU B 44 -9.136 0.512 -7.336 1.00 0.00 N ATOM 1692 CA LEU B 44 -10.540 0.170 -7.186 1.00 0.00 C ATOM 1693 C LEU B 44 -10.783 -1.231 -7.749 1.00 0.00 C ATOM 1694 O LEU B 44 -10.089 -1.664 -8.667 1.00 0.00 O ATOM 1695 CB LEU B 44 -11.424 1.248 -7.817 1.00 0.00 C ATOM 1696 CG LEU B 44 -12.587 1.750 -6.958 1.00 0.00 C ATOM 1697 CD1 LEU B 44 -13.096 3.103 -7.460 1.00 0.00 C ATOM 1698 CD2 LEU B 44 -13.705 0.708 -6.887 1.00 0.00 C ATOM 0 H LEU B 44 -8.929 1.132 -8.119 1.00 0.00 H new ATOM 0 HA LEU B 44 -10.814 0.142 -6.131 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -10.795 2.100 -8.075 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.830 0.857 -8.750 1.00 0.00 H new ATOM 0 HG LEU B 44 -12.221 1.901 -5.942 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -13.922 3.437 -6.832 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -12.289 3.834 -7.417 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -13.440 3.003 -8.489 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -14.519 1.089 -6.271 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -14.075 0.503 -7.891 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -13.318 -0.212 -6.448 1.00 0.00 H new ATOM 1710 N LYS B 45 -11.771 -1.902 -7.174 1.00 0.00 N ATOM 1711 CA LYS B 45 -12.114 -3.246 -7.608 1.00 0.00 C ATOM 1712 C LYS B 45 -12.852 -3.173 -8.946 1.00 0.00 C ATOM 1713 O LYS B 45 -13.176 -4.202 -9.537 1.00 0.00 O ATOM 1714 CB LYS B 45 -12.895 -3.978 -6.514 1.00 0.00 C ATOM 1715 CG LYS B 45 -13.072 -5.457 -6.864 1.00 0.00 C ATOM 1716 CD LYS B 45 -14.434 -5.707 -7.516 1.00 0.00 C ATOM 1717 CE LYS B 45 -15.301 -6.617 -6.643 1.00 0.00 C ATOM 1718 NZ LYS B 45 -16.644 -6.783 -7.242 1.00 0.00 N ATOM 0 H LYS B 45 -12.344 -1.540 -6.412 1.00 0.00 H new ATOM 0 HA LYS B 45 -11.212 -3.835 -7.773 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -12.370 -3.886 -5.563 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -13.872 -3.512 -6.385 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -12.278 -5.772 -7.541 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -12.980 -6.061 -5.962 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -14.944 -4.757 -7.676 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -14.294 -6.163 -8.496 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -14.822 -7.590 -6.534 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -15.392 -6.193 -5.643 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -17.220 -7.403 -6.637 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -17.105 -5.854 -7.324 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -16.553 -7.208 -8.187 1.00 0.00 H new ATOM 1732 N ASN B 46 -13.095 -1.947 -9.385 1.00 0.00 N ATOM 1733 CA ASN B 46 -13.789 -1.726 -10.643 1.00 0.00 C ATOM 1734 C ASN B 46 -12.765 -1.420 -11.738 1.00 0.00 C ATOM 1735 O ASN B 46 -13.112 -1.356 -12.916 1.00 0.00 O ATOM 1736 CB ASN B 46 -14.745 -0.536 -10.543 1.00 0.00 C ATOM 1737 CG ASN B 46 -14.715 0.300 -11.824 1.00 0.00 C ATOM 1738 OD1 ASN B 46 -15.108 -0.140 -12.892 1.00 0.00 O ATOM 1739 ND2 ASN B 46 -14.229 1.527 -11.658 1.00 0.00 N ATOM 0 H ASN B 46 -12.824 -1.096 -8.892 1.00 0.00 H new ATOM 0 HA ASN B 46 -14.358 -2.626 -10.877 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -15.759 -0.893 -10.361 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -14.469 0.086 -9.692 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -14.168 2.163 -12.453 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -13.917 1.832 -10.736 1.00 0.00 H new ATOM 1746 N GLY B 47 -11.525 -1.238 -11.309 1.00 0.00 N ATOM 1747 CA GLY B 47 -10.448 -0.940 -12.239 1.00 0.00 C ATOM 1748 C GLY B 47 -9.985 0.511 -12.094 1.00 0.00 C ATOM 1749 O GLY B 47 -8.997 0.915 -12.705 1.00 0.00 O ATOM 0 H GLY B 47 -11.242 -1.291 -10.331 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -9.610 -1.613 -12.058 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -10.785 -1.118 -13.260 1.00 0.00 H new ATOM 1753 N GLN B 48 -10.720 1.255 -11.280 1.00 0.00 N ATOM 1754 CA GLN B 48 -10.397 2.652 -11.047 1.00 0.00 C ATOM 1755 C GLN B 48 -9.372 2.779 -9.919 1.00 0.00 C ATOM 1756 O GLN B 48 -8.840 1.777 -9.443 1.00 0.00 O ATOM 1757 CB GLN B 48 -11.657 3.462 -10.736 1.00 0.00 C ATOM 1758 CG GLN B 48 -12.311 3.975 -12.021 1.00 0.00 C ATOM 1759 CD GLN B 48 -13.671 4.612 -11.728 1.00 0.00 C ATOM 1760 OE1 GLN B 48 -14.278 4.392 -10.693 1.00 0.00 O ATOM 1761 NE2 GLN B 48 -14.113 5.411 -12.695 1.00 0.00 N ATOM 0 H GLN B 48 -11.538 0.916 -10.774 1.00 0.00 H new ATOM 0 HA GLN B 48 -9.958 3.060 -11.958 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -12.365 2.842 -10.186 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -11.403 4.304 -10.092 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -11.658 4.706 -12.499 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -12.435 3.151 -12.724 1.00 0.00 H new ATOM 0 HE21 GLN B 48 -13.554 5.551 -13.536 1.00 0.00 H new ATOM 0 HE22 GLN B 48 -15.011 5.884 -12.595 1.00 0.00 H new ATOM 1770 N LYS B 49 -9.125 4.019 -9.523 1.00 0.00 N ATOM 1771 CA LYS B 49 -8.173 4.290 -8.460 1.00 0.00 C ATOM 1772 C LYS B 49 -8.668 5.474 -7.627 1.00 0.00 C ATOM 1773 O LYS B 49 -9.264 6.407 -8.162 1.00 0.00 O ATOM 1774 CB LYS B 49 -6.769 4.486 -9.035 1.00 0.00 C ATOM 1775 CG LYS B 49 -6.347 3.281 -9.877 1.00 0.00 C ATOM 1776 CD LYS B 49 -5.002 3.533 -10.561 1.00 0.00 C ATOM 1777 CE LYS B 49 -3.875 2.783 -9.847 1.00 0.00 C ATOM 1778 NZ LYS B 49 -2.558 3.191 -10.387 1.00 0.00 N ATOM 0 H LYS B 49 -9.568 4.848 -9.920 1.00 0.00 H new ATOM 0 HA LYS B 49 -8.100 3.436 -7.787 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -6.746 5.388 -9.647 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -6.057 4.634 -8.223 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -6.277 2.397 -9.243 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -7.108 3.074 -10.629 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -5.054 3.214 -11.602 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -4.787 4.602 -10.566 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -3.915 2.987 -8.777 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -4.009 1.708 -9.972 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -1.804 2.673 -9.892 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -2.517 2.974 -11.403 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -2.426 4.213 -10.246 1.00 0.00 H new ATOM 1792 N ALA B 50 -8.402 5.397 -6.331 1.00 0.00 N ATOM 1793 CA ALA B 50 -8.813 6.451 -5.419 1.00 0.00 C ATOM 1794 C ALA B 50 -7.666 6.760 -4.454 1.00 0.00 C ATOM 1795 O ALA B 50 -7.285 5.913 -3.646 1.00 0.00 O ATOM 1796 CB ALA B 50 -10.090 6.027 -4.691 1.00 0.00 C ATOM 0 H ALA B 50 -7.907 4.621 -5.891 1.00 0.00 H new ATOM 0 HA ALA B 50 -9.039 7.366 -5.966 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -10.398 6.818 -4.007 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -10.881 5.848 -5.419 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -9.901 5.113 -4.128 1.00 0.00 H new ATOM 1802 N CYS B 51 -7.149 7.974 -4.568 1.00 0.00 N ATOM 1803 CA CYS B 51 -6.055 8.405 -3.716 1.00 0.00 C ATOM 1804 C CYS B 51 -6.617 8.698 -2.323 1.00 0.00 C ATOM 1805 O CYS B 51 -7.727 9.211 -2.193 1.00 0.00 O ATOM 1806 CB CYS B 51 -5.323 9.614 -4.302 1.00 0.00 C ATOM 1807 SG CYS B 51 -3.694 9.239 -5.045 1.00 0.00 S ATOM 0 H CYS B 51 -7.468 8.673 -5.238 1.00 0.00 H new ATOM 0 HA CYS B 51 -5.311 7.611 -3.647 1.00 0.00 H new ATOM 0 HB2 CYS B 51 -5.957 10.071 -5.062 1.00 0.00 H new ATOM 0 HB3 CYS B 51 -5.185 10.355 -3.514 1.00 0.00 H new ATOM 1812 N LEU B 52 -5.824 8.359 -1.317 1.00 0.00 N ATOM 1813 CA LEU B 52 -6.229 8.579 0.061 1.00 0.00 C ATOM 1814 C LEU B 52 -5.351 9.669 0.678 1.00 0.00 C ATOM 1815 O LEU B 52 -4.312 10.023 0.122 1.00 0.00 O ATOM 1816 CB LEU B 52 -6.214 7.263 0.841 1.00 0.00 C ATOM 1817 CG LEU B 52 -7.093 6.142 0.282 1.00 0.00 C ATOM 1818 CD1 LEU B 52 -6.660 4.781 0.830 1.00 0.00 C ATOM 1819 CD2 LEU B 52 -8.573 6.422 0.546 1.00 0.00 C ATOM 0 H LEU B 52 -4.904 7.934 -1.429 1.00 0.00 H new ATOM 0 HA LEU B 52 -7.258 8.936 0.103 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -5.186 6.903 0.888 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -6.527 7.467 1.865 1.00 0.00 H new ATOM 0 HG LEU B 52 -6.960 6.111 -0.799 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -7.301 4.002 0.417 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -5.625 4.587 0.547 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -6.745 4.783 1.917 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -9.175 5.610 0.139 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -8.743 6.496 1.620 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -8.857 7.359 0.068 1.00 0.00 H new ATOM 1831 N ASN B 53 -5.800 10.171 1.819 1.00 0.00 N ATOM 1832 CA ASN B 53 -5.068 11.214 2.518 1.00 0.00 C ATOM 1833 C ASN B 53 -4.220 10.583 3.624 1.00 0.00 C ATOM 1834 O ASN B 53 -4.755 9.970 4.548 1.00 0.00 O ATOM 1835 CB ASN B 53 -6.023 12.217 3.168 1.00 0.00 C ATOM 1836 CG ASN B 53 -5.291 13.507 3.543 1.00 0.00 C ATOM 1837 OD1 ASN B 53 -5.578 13.957 4.761 1.00 0.00 O flip ATOM 1838 ND2 ASN B 53 -4.518 14.058 2.777 1.00 0.00 N flip ATOM 0 H ASN B 53 -6.662 9.875 2.277 1.00 0.00 H new ATOM 0 HA ASN B 53 -4.442 11.731 1.791 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -6.839 12.444 2.482 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -6.469 11.775 4.059 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -4.342 13.659 1.855 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -4.047 14.918 3.059 1.00 0.00 H new ATOM 1845 N PRO B 54 -2.878 10.757 3.491 1.00 0.00 N ATOM 1846 CA PRO B 54 -1.951 10.212 4.468 1.00 0.00 C ATOM 1847 C PRO B 54 -1.966 11.036 5.757 1.00 0.00 C ATOM 1848 O PRO B 54 -1.219 10.747 6.691 1.00 0.00 O ATOM 1849 CB PRO B 54 -0.599 10.218 3.774 1.00 0.00 C ATOM 1850 CG PRO B 54 -0.731 11.190 2.613 1.00 0.00 C ATOM 1851 CD PRO B 54 -2.210 11.476 2.410 1.00 0.00 C ATOM 0 HA PRO B 54 -2.217 9.203 4.783 1.00 0.00 H new ATOM 0 HB2 PRO B 54 0.190 10.531 4.458 1.00 0.00 H new ATOM 0 HB3 PRO B 54 -0.337 9.221 3.421 1.00 0.00 H new ATOM 0 HG2 PRO B 54 -0.189 12.112 2.824 1.00 0.00 H new ATOM 0 HG3 PRO B 54 -0.297 10.765 1.708 1.00 0.00 H new ATOM 0 HD2 PRO B 54 -2.417 12.545 2.458 1.00 0.00 H new ATOM 0 HD3 PRO B 54 -2.550 11.129 1.434 1.00 0.00 H new ATOM 1859 N ALA B 55 -2.823 12.046 5.766 1.00 0.00 N ATOM 1860 CA ALA B 55 -2.944 12.914 6.925 1.00 0.00 C ATOM 1861 C ALA B 55 -4.308 12.692 7.583 1.00 0.00 C ATOM 1862 O ALA B 55 -4.800 13.556 8.307 1.00 0.00 O ATOM 1863 CB ALA B 55 -2.733 14.368 6.499 1.00 0.00 C ATOM 0 H ALA B 55 -3.440 12.283 4.989 1.00 0.00 H new ATOM 0 HA ALA B 55 -2.178 12.676 7.663 1.00 0.00 H new ATOM 0 HB1 ALA B 55 -2.824 15.019 7.369 1.00 0.00 H new ATOM 0 HB2 ALA B 55 -1.740 14.479 6.065 1.00 0.00 H new ATOM 0 HB3 ALA B 55 -3.485 14.643 5.760 1.00 0.00 H new ATOM 1869 N SER B 56 -4.880 11.529 7.307 1.00 0.00 N ATOM 1870 CA SER B 56 -6.177 11.183 7.863 1.00 0.00 C ATOM 1871 C SER B 56 -6.058 9.924 8.724 1.00 0.00 C ATOM 1872 O SER B 56 -5.340 8.991 8.370 1.00 0.00 O ATOM 1873 CB SER B 56 -7.212 10.972 6.756 1.00 0.00 C ATOM 1874 OG SER B 56 -8.344 10.238 7.216 1.00 0.00 O ATOM 0 H SER B 56 -4.469 10.815 6.706 1.00 0.00 H new ATOM 0 HA SER B 56 -6.514 12.012 8.486 1.00 0.00 H new ATOM 0 HB2 SER B 56 -7.538 11.940 6.375 1.00 0.00 H new ATOM 0 HB3 SER B 56 -6.750 10.441 5.924 1.00 0.00 H new ATOM 0 HG SER B 56 -9.006 10.174 6.497 1.00 0.00 H new ATOM 1880 N PRO B 57 -6.792 9.940 9.869 1.00 0.00 N ATOM 1881 CA PRO B 57 -6.775 8.811 10.784 1.00 0.00 C ATOM 1882 C PRO B 57 -7.598 7.646 10.232 1.00 0.00 C ATOM 1883 O PRO B 57 -7.554 6.540 10.770 1.00 0.00 O ATOM 1884 CB PRO B 57 -7.323 9.358 12.093 1.00 0.00 C ATOM 1885 CG PRO B 57 -8.057 10.640 11.734 1.00 0.00 C ATOM 1886 CD PRO B 57 -7.654 11.028 10.321 1.00 0.00 C ATOM 0 HA PRO B 57 -5.776 8.400 10.927 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -7.996 8.642 12.564 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -6.518 9.554 12.802 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -9.135 10.493 11.797 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -7.803 11.435 12.435 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -8.526 11.136 9.676 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -7.127 11.982 10.307 1.00 0.00 H new ATOM 1894 N MET B 58 -8.329 7.932 9.165 1.00 0.00 N ATOM 1895 CA MET B 58 -9.160 6.921 8.533 1.00 0.00 C ATOM 1896 C MET B 58 -8.388 6.182 7.439 1.00 0.00 C ATOM 1897 O MET B 58 -8.827 5.136 6.963 1.00 0.00 O ATOM 1898 CB MET B 58 -10.398 7.584 7.926 1.00 0.00 C ATOM 1899 CG MET B 58 -11.577 6.610 7.885 1.00 0.00 C ATOM 1900 SD MET B 58 -12.880 7.182 8.964 1.00 0.00 S ATOM 1901 CE MET B 58 -12.000 7.224 10.516 1.00 0.00 C ATOM 0 H MET B 58 -8.363 8.850 8.722 1.00 0.00 H new ATOM 0 HA MET B 58 -9.459 6.198 9.291 1.00 0.00 H new ATOM 0 HB2 MET B 58 -10.668 8.463 8.511 1.00 0.00 H new ATOM 0 HB3 MET B 58 -10.172 7.930 6.917 1.00 0.00 H new ATOM 0 HG2 MET B 58 -11.951 6.522 6.865 1.00 0.00 H new ATOM 0 HG3 MET B 58 -11.249 5.617 8.192 1.00 0.00 H new ATOM 0 HE1 MET B 58 -12.714 7.210 11.340 1.00 0.00 H new ATOM 0 HE2 MET B 58 -11.346 6.355 10.587 1.00 0.00 H new ATOM 0 HE3 MET B 58 -11.401 8.133 10.570 1.00 0.00 H new ATOM 1911 N VAL B 59 -7.251 6.754 7.071 1.00 0.00 N ATOM 1912 CA VAL B 59 -6.414 6.162 6.041 1.00 0.00 C ATOM 1913 C VAL B 59 -5.568 5.046 6.657 1.00 0.00 C ATOM 1914 O VAL B 59 -5.030 4.203 5.941 1.00 0.00 O ATOM 1915 CB VAL B 59 -5.573 7.246 5.364 1.00 0.00 C ATOM 1916 CG1 VAL B 59 -4.283 6.658 4.787 1.00 0.00 C ATOM 1917 CG2 VAL B 59 -6.378 7.969 4.283 1.00 0.00 C ATOM 0 H VAL B 59 -6.890 7.621 7.468 1.00 0.00 H new ATOM 0 HA VAL B 59 -7.028 5.711 5.261 1.00 0.00 H new ATOM 0 HB VAL B 59 -5.297 7.979 6.122 1.00 0.00 H new ATOM 0 HG11 VAL B 59 -3.703 7.449 4.311 1.00 0.00 H new ATOM 0 HG12 VAL B 59 -3.696 6.211 5.589 1.00 0.00 H new ATOM 0 HG13 VAL B 59 -4.529 5.895 4.049 1.00 0.00 H new ATOM 0 HG21 VAL B 59 -5.757 8.734 3.818 1.00 0.00 H new ATOM 0 HG22 VAL B 59 -6.698 7.252 3.527 1.00 0.00 H new ATOM 0 HG23 VAL B 59 -7.254 8.437 4.733 1.00 0.00 H new ATOM 1927 N LYS B 60 -5.477 5.077 7.979 1.00 0.00 N ATOM 1928 CA LYS B 60 -4.705 4.078 8.699 1.00 0.00 C ATOM 1929 C LYS B 60 -5.631 2.939 9.131 1.00 0.00 C ATOM 1930 O LYS B 60 -5.200 2.009 9.811 1.00 0.00 O ATOM 1931 CB LYS B 60 -3.942 4.723 9.857 1.00 0.00 C ATOM 1932 CG LYS B 60 -2.975 5.794 9.348 1.00 0.00 C ATOM 1933 CD LYS B 60 -3.736 6.986 8.763 1.00 0.00 C ATOM 1934 CE LYS B 60 -2.910 8.269 8.870 1.00 0.00 C ATOM 1935 NZ LYS B 60 -3.211 8.976 10.135 1.00 0.00 N ATOM 0 H LYS B 60 -5.925 5.778 8.570 1.00 0.00 H new ATOM 0 HA LYS B 60 -3.945 3.643 8.050 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -4.647 5.169 10.558 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -3.389 3.959 10.403 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -2.337 6.131 10.165 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -2.321 5.367 8.588 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -3.977 6.791 7.718 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -4.681 7.113 9.290 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -1.848 8.029 8.825 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -3.127 8.920 8.023 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -2.323 9.287 10.579 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -3.807 9.805 9.936 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -3.714 8.334 10.780 1.00 0.00 H new ATOM 1949 N LYS B 61 -6.885 3.049 8.717 1.00 0.00 N ATOM 1950 CA LYS B 61 -7.875 2.040 9.053 1.00 0.00 C ATOM 1951 C LYS B 61 -8.386 1.386 7.768 1.00 0.00 C ATOM 1952 O LYS B 61 -8.998 0.319 7.810 1.00 0.00 O ATOM 1953 CB LYS B 61 -8.982 2.643 9.919 1.00 0.00 C ATOM 1954 CG LYS B 61 -10.074 3.274 9.053 1.00 0.00 C ATOM 1955 CD LYS B 61 -11.306 2.369 8.978 1.00 0.00 C ATOM 1956 CE LYS B 61 -12.572 3.133 9.370 1.00 0.00 C ATOM 1957 NZ LYS B 61 -12.648 3.291 10.839 1.00 0.00 N ATOM 0 H LYS B 61 -7.238 3.821 8.152 1.00 0.00 H new ATOM 0 HA LYS B 61 -7.426 1.251 9.656 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -9.416 1.869 10.551 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -8.559 3.397 10.583 1.00 0.00 H new ATOM 0 HG2 LYS B 61 -10.355 4.243 9.465 1.00 0.00 H new ATOM 0 HG3 LYS B 61 -9.689 3.454 8.049 1.00 0.00 H new ATOM 0 HD2 LYS B 61 -11.412 1.976 7.967 1.00 0.00 H new ATOM 0 HD3 LYS B 61 -11.174 1.513 9.640 1.00 0.00 H new ATOM 0 HE2 LYS B 61 -12.575 4.113 8.892 1.00 0.00 H new ATOM 0 HE3 LYS B 61 -13.452 2.600 9.010 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 -13.513 3.812 11.088 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 -12.667 2.353 11.288 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 -11.817 3.819 11.175 1.00 0.00 H new ATOM 1971 N ILE B 62 -8.117 2.053 6.655 1.00 0.00 N ATOM 1972 CA ILE B 62 -8.543 1.550 5.360 1.00 0.00 C ATOM 1973 C ILE B 62 -7.443 0.661 4.776 1.00 0.00 C ATOM 1974 O ILE B 62 -7.691 -0.114 3.853 1.00 0.00 O ATOM 1975 CB ILE B 62 -8.950 2.706 4.444 1.00 0.00 C ATOM 1976 CG1 ILE B 62 -10.115 3.496 5.043 1.00 0.00 C ATOM 1977 CG2 ILE B 62 -9.263 2.204 3.033 1.00 0.00 C ATOM 1978 CD1 ILE B 62 -10.053 4.967 4.626 1.00 0.00 C ATOM 0 H ILE B 62 -7.609 2.937 6.623 1.00 0.00 H new ATOM 0 HA ILE B 62 -9.433 0.929 5.466 1.00 0.00 H new ATOM 0 HB ILE B 62 -8.105 3.390 4.362 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -11.060 3.061 4.716 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -10.089 3.421 6.130 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -9.549 3.046 2.403 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -8.380 1.721 2.614 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -10.083 1.487 3.075 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -10.893 5.505 5.066 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -9.118 5.405 4.975 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -10.104 5.040 3.540 1.00 0.00 H new ATOM 1990 N ILE B 63 -6.252 0.802 5.338 1.00 0.00 N ATOM 1991 CA ILE B 63 -5.113 0.022 4.885 1.00 0.00 C ATOM 1992 C ILE B 63 -4.997 -1.245 5.736 1.00 0.00 C ATOM 1993 O ILE B 63 -5.042 -2.356 5.210 1.00 0.00 O ATOM 1994 CB ILE B 63 -3.845 0.877 4.880 1.00 0.00 C ATOM 1995 CG1 ILE B 63 -3.836 1.838 3.689 1.00 0.00 C ATOM 1996 CG2 ILE B 63 -2.592 0.000 4.919 1.00 0.00 C ATOM 1997 CD1 ILE B 63 -3.021 3.094 4.004 1.00 0.00 C ATOM 0 H ILE B 63 -6.051 1.445 6.104 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.257 -0.298 3.853 1.00 0.00 H new ATOM 0 HB ILE B 63 -3.840 1.486 5.784 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -3.417 1.337 2.816 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -4.858 2.118 3.435 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -1.705 0.633 4.915 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -2.601 -0.607 5.825 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -2.577 -0.652 4.046 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -3.031 3.760 3.141 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -3.457 3.605 4.862 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -1.993 2.813 4.234 1.00 0.00 H new ATOM 2009 N GLU B 64 -4.851 -1.034 7.036 1.00 0.00 N ATOM 2010 CA GLU B 64 -4.729 -2.145 7.964 1.00 0.00 C ATOM 2011 C GLU B 64 -5.853 -3.157 7.733 1.00 0.00 C ATOM 2012 O GLU B 64 -5.655 -4.359 7.899 1.00 0.00 O ATOM 2013 CB GLU B 64 -4.725 -1.651 9.413 1.00 0.00 C ATOM 2014 CG GLU B 64 -3.476 -0.816 9.703 1.00 0.00 C ATOM 2015 CD GLU B 64 -3.705 0.114 10.896 1.00 0.00 C ATOM 2016 OE1 GLU B 64 -4.619 -0.195 11.690 1.00 0.00 O ATOM 2017 OE2 GLU B 64 -2.960 1.114 10.988 1.00 0.00 O ATOM 0 H GLU B 64 -4.814 -0.111 7.468 1.00 0.00 H new ATOM 0 HA GLU B 64 -3.776 -2.642 7.781 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -5.618 -1.054 9.600 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -4.763 -2.503 10.092 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -2.632 -1.475 9.908 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -3.215 -0.228 8.823 1.00 0.00 H new ATOM 2024 N LYS B 65 -7.009 -2.632 7.354 1.00 0.00 N ATOM 2025 CA LYS B 65 -8.166 -3.474 7.099 1.00 0.00 C ATOM 2026 C LYS B 65 -7.971 -4.211 5.772 1.00 0.00 C ATOM 2027 O LYS B 65 -8.351 -5.374 5.643 1.00 0.00 O ATOM 2028 CB LYS B 65 -9.453 -2.650 7.162 1.00 0.00 C ATOM 2029 CG LYS B 65 -9.920 -2.470 8.608 1.00 0.00 C ATOM 2030 CD LYS B 65 -11.424 -2.200 8.669 1.00 0.00 C ATOM 2031 CE LYS B 65 -12.156 -3.334 9.389 1.00 0.00 C ATOM 2032 NZ LYS B 65 -13.227 -2.792 10.256 1.00 0.00 N ATOM 0 H LYS B 65 -7.169 -1.634 7.217 1.00 0.00 H new ATOM 0 HA LYS B 65 -8.264 -4.233 7.875 1.00 0.00 H new ATOM 0 HB2 LYS B 65 -9.287 -1.674 6.706 1.00 0.00 H new ATOM 0 HB3 LYS B 65 -10.234 -3.144 6.583 1.00 0.00 H new ATOM 0 HG2 LYS B 65 -9.684 -3.365 9.184 1.00 0.00 H new ATOM 0 HG3 LYS B 65 -9.380 -1.643 9.068 1.00 0.00 H new ATOM 0 HD2 LYS B 65 -11.607 -1.258 9.186 1.00 0.00 H new ATOM 0 HD3 LYS B 65 -11.819 -2.091 7.659 1.00 0.00 H new ATOM 0 HE2 LYS B 65 -12.584 -4.020 8.658 1.00 0.00 H new ATOM 0 HE3 LYS B 65 -11.450 -3.907 9.989 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 -13.714 -3.575 10.737 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 -12.811 -2.155 10.965 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 -13.910 -2.265 9.676 1.00 0.00 H new ATOM 2046 N MET B 66 -7.380 -3.504 4.820 1.00 0.00 N ATOM 2047 CA MET B 66 -7.131 -4.076 3.508 1.00 0.00 C ATOM 2048 C MET B 66 -6.232 -5.310 3.610 1.00 0.00 C ATOM 2049 O MET B 66 -6.478 -6.318 2.950 1.00 0.00 O ATOM 2050 CB MET B 66 -6.463 -3.030 2.613 1.00 0.00 C ATOM 2051 CG MET B 66 -7.376 -2.643 1.448 1.00 0.00 C ATOM 2052 SD MET B 66 -7.601 -4.039 0.358 1.00 0.00 S ATOM 2053 CE MET B 66 -5.899 -4.392 -0.048 1.00 0.00 C ATOM 0 H MET B 66 -7.066 -2.540 4.931 1.00 0.00 H new ATOM 0 HA MET B 66 -8.085 -4.379 3.077 1.00 0.00 H new ATOM 0 HB2 MET B 66 -6.222 -2.144 3.200 1.00 0.00 H new ATOM 0 HB3 MET B 66 -5.522 -3.423 2.228 1.00 0.00 H new ATOM 0 HG2 MET B 66 -8.341 -2.308 1.828 1.00 0.00 H new ATOM 0 HG3 MET B 66 -6.943 -1.808 0.898 1.00 0.00 H new ATOM 0 HE1 MET B 66 -5.833 -4.720 -1.085 1.00 0.00 H new ATOM 0 HE2 MET B 66 -5.299 -3.492 0.087 1.00 0.00 H new ATOM 0 HE3 MET B 66 -5.525 -5.179 0.606 1.00 0.00 H new ATOM 2063 N LEU B 67 -5.208 -5.189 4.443 1.00 0.00 N ATOM 2064 CA LEU B 67 -4.271 -6.282 4.640 1.00 0.00 C ATOM 2065 C LEU B 67 -4.985 -7.442 5.336 1.00 0.00 C ATOM 2066 O LEU B 67 -4.485 -8.566 5.350 1.00 0.00 O ATOM 2067 CB LEU B 67 -3.025 -5.793 5.382 1.00 0.00 C ATOM 2068 CG LEU B 67 -1.991 -5.048 4.537 1.00 0.00 C ATOM 2069 CD1 LEU B 67 -2.596 -3.788 3.914 1.00 0.00 C ATOM 2070 CD2 LEU B 67 -0.736 -4.736 5.355 1.00 0.00 C ATOM 0 H LEU B 67 -5.007 -4.351 4.989 1.00 0.00 H new ATOM 0 HA LEU B 67 -3.916 -6.656 3.680 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -3.343 -5.137 6.193 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -2.538 -6.654 5.841 1.00 0.00 H new ATOM 0 HG LEU B 67 -1.688 -5.699 3.717 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -1.839 -3.277 3.318 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -3.435 -4.065 3.275 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -2.945 -3.123 4.704 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -0.017 -4.206 4.730 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -1.004 -4.113 6.209 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -0.292 -5.666 5.710 1.00 0.00 H new ATOM 2082 N LYS B 68 -6.145 -7.130 5.897 1.00 0.00 N ATOM 2083 CA LYS B 68 -6.933 -8.132 6.593 1.00 0.00 C ATOM 2084 C LYS B 68 -8.080 -8.591 5.690 1.00 0.00 C ATOM 2085 O LYS B 68 -8.567 -9.712 5.820 1.00 0.00 O ATOM 2086 CB LYS B 68 -7.395 -7.602 7.952 1.00 0.00 C ATOM 2087 CG LYS B 68 -6.372 -7.925 9.043 1.00 0.00 C ATOM 2088 CD LYS B 68 -6.886 -7.498 10.420 1.00 0.00 C ATOM 2089 CE LYS B 68 -7.635 -8.642 11.104 1.00 0.00 C ATOM 2090 NZ LYS B 68 -8.080 -8.235 12.456 1.00 0.00 N ATOM 0 H LYS B 68 -6.557 -6.197 5.883 1.00 0.00 H new ATOM 0 HA LYS B 68 -6.326 -9.011 6.809 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -7.543 -6.524 7.895 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -8.358 -8.042 8.210 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -6.162 -8.995 9.045 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -5.432 -7.416 8.828 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -6.049 -7.183 11.043 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -7.547 -6.638 10.315 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -8.497 -8.931 10.503 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -6.988 -9.517 11.175 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -8.587 -9.023 12.907 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -7.252 -7.981 13.032 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -8.714 -7.414 12.380 1.00 0.00 H new ATOM 2104 N ASN B 69 -8.478 -7.699 4.794 1.00 0.00 N ATOM 2105 CA ASN B 69 -9.558 -7.998 3.869 1.00 0.00 C ATOM 2106 C ASN B 69 -10.841 -8.263 4.659 1.00 0.00 C ATOM 2107 O ASN B 69 -11.709 -7.396 4.750 1.00 0.00 O ATOM 2108 CB ASN B 69 -9.245 -9.247 3.042 1.00 0.00 C ATOM 2109 CG ASN B 69 -10.467 -9.691 2.236 1.00 0.00 C ATOM 2110 OD1 ASN B 69 -11.517 -10.005 2.773 1.00 0.00 O ATOM 2111 ND2 ASN B 69 -10.274 -9.699 0.920 1.00 0.00 N ATOM 0 H ASN B 69 -8.072 -6.769 4.689 1.00 0.00 H new ATOM 0 HA ASN B 69 -9.677 -7.144 3.202 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -8.414 -9.042 2.367 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -8.927 -10.054 3.702 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -11.030 -9.980 0.295 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -9.370 -9.424 0.535 1.00 0.00 H new ATOM 2118 N GLY B 70 -10.921 -9.466 5.211 1.00 0.00 N ATOM 2119 CA GLY B 70 -12.083 -9.856 5.990 1.00 0.00 C ATOM 2120 C GLY B 70 -11.715 -10.917 7.030 1.00 0.00 C ATOM 2121 O GLY B 70 -10.962 -11.844 6.736 1.00 0.00 O ATOM 0 H GLY B 70 -10.199 -10.183 5.134 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -12.501 -8.982 6.489 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -12.856 -10.244 5.327 1.00 0.00 H new ATOM 2125 N LYS B 71 -12.264 -10.745 8.223 1.00 0.00 N ATOM 2126 CA LYS B 71 -12.003 -11.676 9.308 1.00 0.00 C ATOM 2127 C LYS B 71 -13.321 -12.310 9.758 1.00 0.00 C ATOM 2128 O LYS B 71 -13.478 -13.529 9.705 1.00 0.00 O ATOM 2129 CB LYS B 71 -11.237 -10.983 10.436 1.00 0.00 C ATOM 2130 CG LYS B 71 -10.168 -11.908 11.022 1.00 0.00 C ATOM 2131 CD LYS B 71 -10.569 -12.395 12.416 1.00 0.00 C ATOM 2132 CE LYS B 71 -10.006 -13.791 12.692 1.00 0.00 C ATOM 2133 NZ LYS B 71 -8.785 -13.701 13.524 1.00 0.00 N ATOM 0 H LYS B 71 -12.889 -9.975 8.463 1.00 0.00 H new ATOM 0 HA LYS B 71 -11.359 -12.487 8.968 1.00 0.00 H new ATOM 0 HB2 LYS B 71 -10.769 -10.074 10.058 1.00 0.00 H new ATOM 0 HB3 LYS B 71 -11.931 -10.681 11.220 1.00 0.00 H new ATOM 0 HG2 LYS B 71 -10.021 -12.763 10.362 1.00 0.00 H new ATOM 0 HG3 LYS B 71 -9.216 -11.380 11.077 1.00 0.00 H new ATOM 0 HD2 LYS B 71 -10.203 -11.696 13.168 1.00 0.00 H new ATOM 0 HD3 LYS B 71 -11.656 -12.414 12.500 1.00 0.00 H new ATOM 0 HE2 LYS B 71 -10.755 -14.398 13.200 1.00 0.00 H new ATOM 0 HE3 LYS B 71 -9.776 -14.290 11.750 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 -8.415 -14.657 13.702 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 -8.066 -13.139 13.025 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 -9.015 -13.244 14.430 1.00 0.00 H new ATOM 2147 N SER B 72 -14.235 -11.454 10.192 1.00 0.00 N ATOM 2148 CA SER B 72 -15.534 -11.915 10.651 1.00 0.00 C ATOM 2149 C SER B 72 -16.465 -10.721 10.872 1.00 0.00 C ATOM 2150 O SER B 72 -16.539 -10.183 11.976 1.00 0.00 O ATOM 2151 CB SER B 72 -15.405 -12.732 11.938 1.00 0.00 C ATOM 2152 OG SER B 72 -14.939 -11.942 13.028 1.00 0.00 O ATOM 0 H SER B 72 -14.101 -10.444 10.235 1.00 0.00 H new ATOM 0 HA SER B 72 -15.958 -12.561 9.883 1.00 0.00 H new ATOM 0 HB2 SER B 72 -16.373 -13.164 12.191 1.00 0.00 H new ATOM 0 HB3 SER B 72 -14.719 -13.562 11.773 1.00 0.00 H new ATOM 0 HG SER B 72 -15.363 -11.059 12.997 1.00 0.00 H new ATOM 2158 N ASN B 73 -17.151 -10.341 9.805 1.00 0.00 N ATOM 2159 CA ASN B 73 -18.074 -9.220 9.868 1.00 0.00 C ATOM 2160 C ASN B 73 -17.422 -8.071 10.639 1.00 0.00 C ATOM 2161 O ASN B 73 -16.650 -7.298 10.073 1.00 0.00 O ATOM 2162 CB ASN B 73 -19.362 -9.608 10.597 1.00 0.00 C ATOM 2163 CG ASN B 73 -20.291 -8.402 10.750 1.00 0.00 C ATOM 2164 OD1 ASN B 73 -20.149 -7.389 10.084 1.00 0.00 O ATOM 2165 ND2 ASN B 73 -21.246 -8.566 11.661 1.00 0.00 N ATOM 0 H ASN B 73 -17.087 -10.789 8.891 1.00 0.00 H new ATOM 0 HA ASN B 73 -18.313 -8.922 8.847 1.00 0.00 H new ATOM 0 HB2 ASN B 73 -19.873 -10.397 10.045 1.00 0.00 H new ATOM 0 HB3 ASN B 73 -19.120 -10.012 11.580 1.00 0.00 H new ATOM 0 HD21 ASN B 73 -21.917 -7.818 11.837 1.00 0.00 H new ATOM 0 HD22 ASN B 73 -21.308 -9.440 12.183 1.00 0.00 H new TER 2172 ASN B 73