USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=26 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 46 ASN : amide:sc= -4.93! C(o=-6.7!,f=-3.6!) USER MOD Set 1.2: B 48 GLN : amide:sc= -1.73 K(o=-6.7,f=-5.9!) USER MOD Set 2.1: B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: B 34 HIS : no HD1:sc= -12.5! C(o=-12!,f=-14!) USER MOD Set 3.1: A 43 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: B 27 LYS NZ :NH3+ -113:sc= -0.0362 (180deg=-0.72) USER MOD Set 4.1: A 14 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 53 ASN : amide:sc= -0.0908 K(o=-0.091,f=-1.6!) USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.846 USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN : amide:sc= -2.63! X(o=-2.6!,f=-2.3) USER MOD Single : A 19 HIS : no HD1:sc= -0.273 X(o=-0.27,f=-0.013) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= -3.19! C(o=-3.2!,f=-4.6!) USER MOD Single : A 24 GLN : amide:sc= 0.533 K(o=0.53,f=-0.21) USER MOD Single : A 25 SER OG : rot 180:sc= -1.25 USER MOD Single : A 27 LYS NZ :NH3+ -148:sc= -0.203 (180deg=-0.842) USER MOD Single : A 29 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.241) USER MOD Single : A 30 SER OG : rot 180:sc= -0.9 USER MOD Single : A 34 HIS : no HD1:sc= -12.4! C(o=-12!,f=-13!) USER MOD Single : A 37 GLN : amide:sc= -2.1 K(o=-2.1,f=-3.5!) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -2.49! C(o=-2.5!,f=-2.8!) USER MOD Single : A 48 GLN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 175:sc= -0.0236 USER MOD Single : A 58 MET CE :methyl 154:sc= -0.603 (180deg=-2.08!) USER MOD Single : A 60 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.066) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 161:sc= -0.187 (180deg=-0.678) USER MOD Single : A 66 MET CE :methyl -148:sc= -5.86! (180deg=-9.81!) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -0.783 K(o=-0.78,f=-0.11) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0.05 USER MOD Single : A 73 ASN : amide:sc= -0.45 K(o=-0.45,f=-3.5!) USER MOD Single : B 5 THR OG1 : rot -48:sc= 0.738 USER MOD Single : B 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 13 GLN : amide:sc= -0.111 K(o=-0.11,f=-1.2) USER MOD Single : B 14 THR OG1 : rot 180:sc= 0 USER MOD Single : B 16 GLN : amide:sc=-0.00547 X(o=-0.0055,f=0) USER MOD Single : B 19 HIS : no HD1:sc= -0.383 X(o=-0.38,f=-0.2) USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 ASN : amide:sc= -1.54 K(o=-1.5,f=-2.5!) USER MOD Single : B 24 GLN : amide:sc= 0.752 K(o=0.75,f=0) USER MOD Single : B 25 SER OG : rot 180:sc= -0.928 USER MOD Single : B 30 SER OG : rot 180:sc= -0.302 USER MOD Single : B 37 GLN : amide:sc= -0.761 K(o=-0.76,f=-1.8) 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 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 ASN : amide:sc= -0.574 K(o=-0.57,f=-3.1!) USER MOD Single : B 56 SER OG : rot -170:sc= 0.193 USER MOD Single : B 58 MET CE :methyl -150:sc= -0.3 (180deg=-1.36!) USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 LYS NZ :NH3+ 162:sc=-0.00605 (180deg=-0.162) USER MOD Single : B 66 MET CE :methyl -154:sc= -4.58! (180deg=-8.84!) USER MOD Single : B 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 69 ASN : amide:sc= -0.156 X(o=-0.16,f=-0.16) USER MOD Single : B 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 SER OG : rot 180:sc= 0 USER MOD Single : B 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 5 -10.018 -17.029 -17.681 1.00 0.00 N ATOM 2 CA THR A 5 -9.460 -16.074 -16.739 1.00 0.00 C ATOM 3 C THR A 5 -9.111 -16.768 -15.421 1.00 0.00 C ATOM 4 O THR A 5 -9.797 -16.582 -14.417 1.00 0.00 O ATOM 5 CB THR A 5 -10.462 -14.930 -16.577 1.00 0.00 C ATOM 6 OG1 THR A 5 -9.884 -14.102 -15.571 1.00 0.00 O ATOM 7 CG2 THR A 5 -11.785 -15.392 -15.963 1.00 0.00 C ATOM 0 HA THR A 5 -8.524 -15.655 -17.107 1.00 0.00 H new ATOM 0 HB THR A 5 -10.652 -14.475 -17.549 1.00 0.00 H new ATOM 0 HG1 THR A 5 -10.469 -13.333 -15.404 1.00 0.00 H new ATOM 0 HG21 THR A 5 -12.460 -14.541 -15.870 1.00 0.00 H new ATOM 0 HG22 THR A 5 -12.240 -16.147 -16.604 1.00 0.00 H new ATOM 0 HG23 THR A 5 -11.600 -15.817 -14.977 1.00 0.00 H new ATOM 15 N GLU A 6 -8.044 -17.552 -15.466 1.00 0.00 N ATOM 16 CA GLU A 6 -7.596 -18.275 -14.288 1.00 0.00 C ATOM 17 C GLU A 6 -6.217 -17.775 -13.852 1.00 0.00 C ATOM 18 O GLU A 6 -5.196 -18.340 -14.242 1.00 0.00 O ATOM 19 CB GLU A 6 -7.577 -19.783 -14.543 1.00 0.00 C ATOM 20 CG GLU A 6 -7.633 -20.563 -13.228 1.00 0.00 C ATOM 21 CD GLU A 6 -8.910 -21.402 -13.143 1.00 0.00 C ATOM 22 OE1 GLU A 6 -9.083 -22.262 -14.033 1.00 0.00 O ATOM 23 OE2 GLU A 6 -9.682 -21.165 -12.190 1.00 0.00 O ATOM 0 H GLU A 6 -7.476 -17.702 -16.300 1.00 0.00 H new ATOM 0 HA GLU A 6 -8.302 -18.086 -13.480 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -8.424 -20.060 -15.170 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -6.674 -20.051 -15.091 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -6.761 -21.212 -13.148 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -7.592 -19.870 -12.388 1.00 0.00 H new ATOM 30 N LEU A 7 -6.231 -16.721 -13.050 1.00 0.00 N ATOM 31 CA LEU A 7 -4.994 -16.139 -12.557 1.00 0.00 C ATOM 32 C LEU A 7 -4.788 -16.550 -11.097 1.00 0.00 C ATOM 33 O LEU A 7 -5.647 -17.201 -10.505 1.00 0.00 O ATOM 34 CB LEU A 7 -4.990 -14.624 -12.776 1.00 0.00 C ATOM 35 CG LEU A 7 -6.363 -13.964 -12.923 1.00 0.00 C ATOM 36 CD1 LEU A 7 -7.058 -14.426 -14.205 1.00 0.00 C ATOM 37 CD2 LEU A 7 -7.225 -14.210 -11.683 1.00 0.00 C ATOM 0 H LEU A 7 -7.079 -16.255 -12.729 1.00 0.00 H new ATOM 0 HA LEU A 7 -4.142 -16.522 -13.119 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -4.472 -14.157 -11.938 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -4.407 -14.408 -13.671 1.00 0.00 H new ATOM 0 HG LEU A 7 -6.218 -12.887 -13.005 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -8.032 -13.942 -14.286 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -6.447 -14.158 -15.067 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -7.191 -15.507 -14.177 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -8.195 -13.731 -11.813 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.366 -15.282 -11.545 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -6.729 -13.793 -10.807 1.00 0.00 H new ATOM 49 N ARG A 8 -3.644 -16.152 -10.560 1.00 0.00 N ATOM 50 CA ARG A 8 -3.314 -16.471 -9.181 1.00 0.00 C ATOM 51 C ARG A 8 -2.731 -15.244 -8.477 1.00 0.00 C ATOM 52 O ARG A 8 -3.155 -14.118 -8.733 1.00 0.00 O ATOM 53 CB ARG A 8 -2.306 -17.620 -9.108 1.00 0.00 C ATOM 54 CG ARG A 8 -2.658 -18.723 -10.108 1.00 0.00 C ATOM 55 CD ARG A 8 -1.701 -19.910 -9.974 1.00 0.00 C ATOM 56 NE ARG A 8 -2.459 -21.180 -10.030 1.00 0.00 N ATOM 57 CZ ARG A 8 -3.135 -21.604 -11.106 1.00 0.00 C ATOM 58 NH1 ARG A 8 -3.152 -20.863 -12.222 1.00 0.00 N ATOM 59 NH2 ARG A 8 -3.795 -22.770 -11.065 1.00 0.00 N ATOM 0 H ARG A 8 -2.934 -15.612 -11.055 1.00 0.00 H new ATOM 0 HA ARG A 8 -4.233 -16.777 -8.682 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -1.304 -17.243 -9.315 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -2.290 -18.031 -8.099 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -3.682 -19.056 -9.942 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -2.612 -18.327 -11.123 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -0.961 -19.883 -10.774 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -1.156 -19.844 -9.033 1.00 0.00 H new ATOM 0 HE ARG A 8 -2.467 -21.769 -9.197 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -2.650 -19.976 -12.253 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -3.667 -21.186 -13.041 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -3.782 -23.334 -10.215 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -4.310 -23.094 -11.884 1.00 0.00 H new ATOM 73 N CYS A 9 -1.769 -15.504 -7.605 1.00 0.00 N ATOM 74 CA CYS A 9 -1.123 -14.435 -6.863 1.00 0.00 C ATOM 75 C CYS A 9 -0.217 -13.662 -7.823 1.00 0.00 C ATOM 76 O CYS A 9 0.210 -14.197 -8.845 1.00 0.00 O ATOM 77 CB CYS A 9 -0.351 -14.970 -5.655 1.00 0.00 C ATOM 78 SG CYS A 9 -1.381 -15.800 -4.391 1.00 0.00 S ATOM 0 H CYS A 9 -1.421 -16.440 -7.395 1.00 0.00 H new ATOM 0 HA CYS A 9 -1.879 -13.762 -6.458 1.00 0.00 H new ATOM 0 HB2 CYS A 9 0.404 -15.673 -6.007 1.00 0.00 H new ATOM 0 HB3 CYS A 9 0.179 -14.142 -5.185 1.00 0.00 H new ATOM 83 N GLN A 10 0.050 -12.416 -7.461 1.00 0.00 N ATOM 84 CA GLN A 10 0.897 -11.564 -8.278 1.00 0.00 C ATOM 85 C GLN A 10 2.355 -11.677 -7.827 1.00 0.00 C ATOM 86 O GLN A 10 3.247 -11.099 -8.447 1.00 0.00 O ATOM 87 CB GLN A 10 0.421 -10.111 -8.233 1.00 0.00 C ATOM 88 CG GLN A 10 1.094 -9.279 -9.326 1.00 0.00 C ATOM 89 CD GLN A 10 0.275 -8.026 -9.645 1.00 0.00 C ATOM 90 OE1 GLN A 10 -0.496 -7.981 -10.590 1.00 0.00 O ATOM 91 NE2 GLN A 10 0.483 -7.016 -8.806 1.00 0.00 N ATOM 0 H GLN A 10 -0.306 -11.976 -6.612 1.00 0.00 H new ATOM 0 HA GLN A 10 0.829 -11.902 -9.312 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -0.661 -10.075 -8.358 1.00 0.00 H new ATOM 0 HB3 GLN A 10 0.643 -9.682 -7.256 1.00 0.00 H new ATOM 0 HG2 GLN A 10 2.095 -8.991 -9.004 1.00 0.00 H new ATOM 0 HG3 GLN A 10 1.210 -9.881 -10.227 1.00 0.00 H new ATOM 0 HE21 GLN A 10 1.143 -7.121 -8.035 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -0.017 -6.136 -8.933 1.00 0.00 H new ATOM 100 N CYS A 11 2.552 -12.425 -6.751 1.00 0.00 N ATOM 101 CA CYS A 11 3.886 -12.621 -6.210 1.00 0.00 C ATOM 102 C CYS A 11 3.991 -14.060 -5.700 1.00 0.00 C ATOM 103 O CYS A 11 3.227 -14.471 -4.829 1.00 0.00 O ATOM 104 CB CYS A 11 4.208 -11.603 -5.115 1.00 0.00 C ATOM 105 SG CYS A 11 5.648 -10.529 -5.464 1.00 0.00 S ATOM 0 H CYS A 11 1.810 -12.902 -6.239 1.00 0.00 H new ATOM 0 HA CYS A 11 4.626 -12.459 -6.994 1.00 0.00 H new ATOM 0 HB2 CYS A 11 3.333 -10.973 -4.956 1.00 0.00 H new ATOM 0 HB3 CYS A 11 4.389 -12.138 -4.183 1.00 0.00 H new ATOM 110 N LEU A 12 4.944 -14.786 -6.266 1.00 0.00 N ATOM 111 CA LEU A 12 5.159 -16.170 -5.879 1.00 0.00 C ATOM 112 C LEU A 12 6.195 -16.226 -4.755 1.00 0.00 C ATOM 113 O LEU A 12 6.337 -17.250 -4.088 1.00 0.00 O ATOM 114 CB LEU A 12 5.530 -17.016 -7.100 1.00 0.00 C ATOM 115 CG LEU A 12 4.744 -16.726 -8.380 1.00 0.00 C ATOM 116 CD1 LEU A 12 5.586 -17.031 -9.621 1.00 0.00 C ATOM 117 CD2 LEU A 12 3.413 -17.480 -8.390 1.00 0.00 C ATOM 0 H LEU A 12 5.576 -14.442 -6.989 1.00 0.00 H new ATOM 0 HA LEU A 12 4.239 -16.603 -5.487 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.590 -16.873 -7.308 1.00 0.00 H new ATOM 0 HB3 LEU A 12 5.394 -18.067 -6.844 1.00 0.00 H new ATOM 0 HG LEU A 12 4.510 -15.662 -8.403 1.00 0.00 H new ATOM 0 HD11 LEU A 12 5.004 -16.816 -10.517 1.00 0.00 H new ATOM 0 HD12 LEU A 12 6.483 -16.411 -9.614 1.00 0.00 H new ATOM 0 HD13 LEU A 12 5.872 -18.083 -9.617 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.875 -17.256 -9.311 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.602 -18.552 -8.332 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.813 -17.170 -7.534 1.00 0.00 H new ATOM 129 N GLN A 13 6.892 -15.113 -4.580 1.00 0.00 N ATOM 130 CA GLN A 13 7.911 -15.023 -3.547 1.00 0.00 C ATOM 131 C GLN A 13 7.657 -13.806 -2.656 1.00 0.00 C ATOM 132 O GLN A 13 6.780 -12.993 -2.945 1.00 0.00 O ATOM 133 CB GLN A 13 9.311 -14.970 -4.162 1.00 0.00 C ATOM 134 CG GLN A 13 10.310 -15.765 -3.319 1.00 0.00 C ATOM 135 CD GLN A 13 11.232 -16.603 -4.207 1.00 0.00 C ATOM 136 OE1 GLN A 13 10.968 -17.755 -4.508 1.00 0.00 O ATOM 137 NE2 GLN A 13 12.326 -15.961 -4.609 1.00 0.00 N ATOM 0 H GLN A 13 6.772 -14.266 -5.136 1.00 0.00 H new ATOM 0 HA GLN A 13 7.855 -15.919 -2.929 1.00 0.00 H new ATOM 0 HB2 GLN A 13 9.283 -15.372 -5.175 1.00 0.00 H new ATOM 0 HB3 GLN A 13 9.639 -13.933 -4.240 1.00 0.00 H new ATOM 0 HG2 GLN A 13 10.905 -15.082 -2.713 1.00 0.00 H new ATOM 0 HG3 GLN A 13 9.773 -16.416 -2.630 1.00 0.00 H new ATOM 0 HE21 GLN A 13 12.486 -14.996 -4.320 1.00 0.00 H new ATOM 0 HE22 GLN A 13 13.004 -16.434 -5.206 1.00 0.00 H new ATOM 146 N THR A 14 8.440 -13.718 -1.591 1.00 0.00 N ATOM 147 CA THR A 14 8.311 -12.614 -0.656 1.00 0.00 C ATOM 148 C THR A 14 9.582 -12.475 0.184 1.00 0.00 C ATOM 149 O THR A 14 10.417 -13.378 0.207 1.00 0.00 O ATOM 150 CB THR A 14 7.052 -12.848 0.182 1.00 0.00 C ATOM 151 OG1 THR A 14 7.049 -14.254 0.418 1.00 0.00 O ATOM 152 CG2 THR A 14 5.767 -12.601 -0.610 1.00 0.00 C ATOM 0 H THR A 14 9.167 -14.394 -1.355 1.00 0.00 H new ATOM 0 HA THR A 14 8.199 -11.664 -1.179 1.00 0.00 H new ATOM 0 HB THR A 14 7.071 -12.196 1.055 1.00 0.00 H new ATOM 0 HG1 THR A 14 6.266 -14.494 0.957 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.904 -12.781 0.031 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.749 -11.569 -0.962 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.731 -13.276 -1.465 1.00 0.00 H new ATOM 160 N LEU A 15 9.689 -11.336 0.853 1.00 0.00 N ATOM 161 CA LEU A 15 10.845 -11.067 1.692 1.00 0.00 C ATOM 162 C LEU A 15 10.419 -11.089 3.162 1.00 0.00 C ATOM 163 O LEU A 15 9.275 -10.772 3.485 1.00 0.00 O ATOM 164 CB LEU A 15 11.523 -9.763 1.268 1.00 0.00 C ATOM 165 CG LEU A 15 11.979 -9.688 -0.191 1.00 0.00 C ATOM 166 CD1 LEU A 15 11.788 -8.278 -0.753 1.00 0.00 C ATOM 167 CD2 LEU A 15 13.422 -10.174 -0.340 1.00 0.00 C ATOM 0 H LEU A 15 8.995 -10.589 0.831 1.00 0.00 H new ATOM 0 HA LEU A 15 11.597 -11.846 1.566 1.00 0.00 H new ATOM 0 HB2 LEU A 15 10.833 -8.940 1.455 1.00 0.00 H new ATOM 0 HB3 LEU A 15 12.391 -9.603 1.908 1.00 0.00 H new ATOM 0 HG LEU A 15 11.352 -10.357 -0.780 1.00 0.00 H new ATOM 0 HD11 LEU A 15 12.120 -8.252 -1.791 1.00 0.00 H new ATOM 0 HD12 LEU A 15 10.734 -8.006 -0.702 1.00 0.00 H new ATOM 0 HD13 LEU A 15 12.374 -7.570 -0.167 1.00 0.00 H new ATOM 0 HD21 LEU A 15 13.721 -10.110 -1.386 1.00 0.00 H new ATOM 0 HD22 LEU A 15 14.080 -9.550 0.264 1.00 0.00 H new ATOM 0 HD23 LEU A 15 13.494 -11.209 -0.004 1.00 0.00 H new ATOM 179 N GLN A 16 11.362 -11.467 4.012 1.00 0.00 N ATOM 180 CA GLN A 16 11.099 -11.535 5.440 1.00 0.00 C ATOM 181 C GLN A 16 11.229 -10.146 6.070 1.00 0.00 C ATOM 182 O GLN A 16 10.784 -9.928 7.196 1.00 0.00 O ATOM 183 CB GLN A 16 12.033 -12.536 6.123 1.00 0.00 C ATOM 184 CG GLN A 16 12.020 -12.349 7.641 1.00 0.00 C ATOM 185 CD GLN A 16 13.101 -11.359 8.081 1.00 0.00 C ATOM 186 OE1 GLN A 16 14.268 -11.486 7.748 1.00 0.00 O ATOM 187 NE2 GLN A 16 12.648 -10.369 8.845 1.00 0.00 N ATOM 0 H GLN A 16 12.309 -11.729 3.740 1.00 0.00 H new ATOM 0 HA GLN A 16 10.077 -11.885 5.585 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.727 -13.552 5.875 1.00 0.00 H new ATOM 0 HB3 GLN A 16 13.048 -12.408 5.746 1.00 0.00 H new ATOM 0 HG2 GLN A 16 11.041 -11.989 7.958 1.00 0.00 H new ATOM 0 HG3 GLN A 16 12.180 -13.309 8.131 1.00 0.00 H new ATOM 0 HE21 GLN A 16 11.658 -10.323 9.086 1.00 0.00 H new ATOM 0 HE22 GLN A 16 13.291 -9.656 9.190 1.00 0.00 H new ATOM 196 N GLY A 17 11.839 -9.244 5.315 1.00 0.00 N ATOM 197 CA GLY A 17 12.033 -7.883 5.786 1.00 0.00 C ATOM 198 C GLY A 17 13.345 -7.301 5.256 1.00 0.00 C ATOM 199 O GLY A 17 14.418 -7.611 5.770 1.00 0.00 O ATOM 0 H GLY A 17 12.205 -9.429 4.381 1.00 0.00 H new ATOM 0 HA2 GLY A 17 11.198 -7.260 5.464 1.00 0.00 H new ATOM 0 HA3 GLY A 17 12.039 -7.869 6.876 1.00 0.00 H new ATOM 203 N ILE A 18 13.216 -6.468 4.234 1.00 0.00 N ATOM 204 CA ILE A 18 14.378 -5.840 3.628 1.00 0.00 C ATOM 205 C ILE A 18 14.551 -4.434 4.206 1.00 0.00 C ATOM 206 O ILE A 18 13.588 -3.827 4.671 1.00 0.00 O ATOM 207 CB ILE A 18 14.268 -5.869 2.102 1.00 0.00 C ATOM 208 CG1 ILE A 18 14.768 -7.202 1.542 1.00 0.00 C ATOM 209 CG2 ILE A 18 14.995 -4.677 1.478 1.00 0.00 C ATOM 210 CD1 ILE A 18 16.291 -7.303 1.642 1.00 0.00 C ATOM 0 H ILE A 18 12.324 -6.213 3.810 1.00 0.00 H new ATOM 0 HA ILE A 18 15.283 -6.398 3.869 1.00 0.00 H new ATOM 0 HB ILE A 18 13.215 -5.781 1.833 1.00 0.00 H new ATOM 0 HG12 ILE A 18 14.309 -8.025 2.089 1.00 0.00 H new ATOM 0 HG13 ILE A 18 14.461 -7.301 0.501 1.00 0.00 H new ATOM 0 HG21 ILE A 18 14.902 -4.721 0.393 1.00 0.00 H new ATOM 0 HG22 ILE A 18 14.553 -3.750 1.843 1.00 0.00 H new ATOM 0 HG23 ILE A 18 16.049 -4.709 1.753 1.00 0.00 H new ATOM 0 HD11 ILE A 18 16.620 -8.260 1.237 1.00 0.00 H new ATOM 0 HD12 ILE A 18 16.747 -6.493 1.074 1.00 0.00 H new ATOM 0 HD13 ILE A 18 16.593 -7.228 2.687 1.00 0.00 H new ATOM 222 N HIS A 19 15.786 -3.957 4.157 1.00 0.00 N ATOM 223 CA HIS A 19 16.098 -2.633 4.669 1.00 0.00 C ATOM 224 C HIS A 19 15.060 -1.630 4.164 1.00 0.00 C ATOM 225 O HIS A 19 14.650 -1.685 3.005 1.00 0.00 O ATOM 226 CB HIS A 19 17.531 -2.236 4.311 1.00 0.00 C ATOM 227 CG HIS A 19 18.251 -1.483 5.404 1.00 0.00 C ATOM 228 ND1 HIS A 19 19.473 -1.887 5.913 1.00 0.00 N ATOM 229 CD2 HIS A 19 17.910 -0.348 6.078 1.00 0.00 C ATOM 230 CE1 HIS A 19 19.840 -1.027 6.851 1.00 0.00 C ATOM 231 NE2 HIS A 19 18.870 -0.074 6.953 1.00 0.00 N ATOM 0 H HIS A 19 16.583 -4.464 3.771 1.00 0.00 H new ATOM 0 HA HIS A 19 16.046 -2.638 5.758 1.00 0.00 H new ATOM 0 HB2 HIS A 19 18.097 -3.136 4.070 1.00 0.00 H new ATOM 0 HB3 HIS A 19 17.513 -1.621 3.411 1.00 0.00 H new ATOM 0 HD2 HIS A 19 17.011 0.230 5.926 1.00 0.00 H new ATOM 0 HE1 HIS A 19 20.748 -1.073 7.433 1.00 0.00 H new ATOM 0 HE2 HIS A 19 18.880 0.718 7.595 1.00 0.00 H new ATOM 239 N LEU A 20 14.665 -0.735 5.057 1.00 0.00 N ATOM 240 CA LEU A 20 13.683 0.280 4.716 1.00 0.00 C ATOM 241 C LEU A 20 14.395 1.486 4.100 1.00 0.00 C ATOM 242 O LEU A 20 13.794 2.546 3.930 1.00 0.00 O ATOM 243 CB LEU A 20 12.827 0.629 5.935 1.00 0.00 C ATOM 244 CG LEU A 20 11.684 1.617 5.693 1.00 0.00 C ATOM 245 CD1 LEU A 20 10.740 1.108 4.602 1.00 0.00 C ATOM 246 CD2 LEU A 20 10.942 1.928 6.994 1.00 0.00 C ATOM 0 H LEU A 20 15.007 -0.692 6.017 1.00 0.00 H new ATOM 0 HA LEU A 20 12.989 -0.099 3.966 1.00 0.00 H new ATOM 0 HB2 LEU A 20 12.405 -0.294 6.333 1.00 0.00 H new ATOM 0 HB3 LEU A 20 13.479 1.040 6.706 1.00 0.00 H new ATOM 0 HG LEU A 20 12.113 2.553 5.336 1.00 0.00 H new ATOM 0 HD11 LEU A 20 9.937 1.829 4.450 1.00 0.00 H new ATOM 0 HD12 LEU A 20 11.294 0.981 3.672 1.00 0.00 H new ATOM 0 HD13 LEU A 20 10.316 0.151 4.906 1.00 0.00 H new ATOM 0 HD21 LEU A 20 10.135 2.632 6.793 1.00 0.00 H new ATOM 0 HD22 LEU A 20 10.527 1.008 7.405 1.00 0.00 H new ATOM 0 HD23 LEU A 20 11.635 2.366 7.712 1.00 0.00 H new ATOM 258 N LYS A 21 15.665 1.285 3.782 1.00 0.00 N ATOM 259 CA LYS A 21 16.465 2.342 3.189 1.00 0.00 C ATOM 260 C LYS A 21 16.370 2.254 1.664 1.00 0.00 C ATOM 261 O LYS A 21 16.652 3.225 0.964 1.00 0.00 O ATOM 262 CB LYS A 21 17.899 2.291 3.719 1.00 0.00 C ATOM 263 CG LYS A 21 18.877 2.907 2.716 1.00 0.00 C ATOM 264 CD LYS A 21 18.626 4.408 2.557 1.00 0.00 C ATOM 265 CE LYS A 21 19.359 4.959 1.332 1.00 0.00 C ATOM 266 NZ LYS A 21 19.411 6.437 1.382 1.00 0.00 N ATOM 0 H LYS A 21 16.160 0.405 3.924 1.00 0.00 H new ATOM 0 HA LYS A 21 16.078 3.319 3.477 1.00 0.00 H new ATOM 0 HB2 LYS A 21 17.959 2.826 4.667 1.00 0.00 H new ATOM 0 HB3 LYS A 21 18.180 1.257 3.918 1.00 0.00 H new ATOM 0 HG2 LYS A 21 19.901 2.739 3.051 1.00 0.00 H new ATOM 0 HG3 LYS A 21 18.772 2.413 1.750 1.00 0.00 H new ATOM 0 HD2 LYS A 21 17.556 4.593 2.459 1.00 0.00 H new ATOM 0 HD3 LYS A 21 18.960 4.933 3.452 1.00 0.00 H new ATOM 0 HE2 LYS A 21 20.370 4.555 1.293 1.00 0.00 H new ATOM 0 HE3 LYS A 21 18.852 4.637 0.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 19.912 6.795 0.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 18.443 6.818 1.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 19.915 6.738 2.241 1.00 0.00 H new ATOM 280 N ASN A 22 15.971 1.080 1.195 1.00 0.00 N ATOM 281 CA ASN A 22 15.835 0.853 -0.233 1.00 0.00 C ATOM 282 C ASN A 22 14.374 1.054 -0.640 1.00 0.00 C ATOM 283 O ASN A 22 14.091 1.663 -1.671 1.00 0.00 O ATOM 284 CB ASN A 22 16.236 -0.577 -0.604 1.00 0.00 C ATOM 285 CG ASN A 22 17.650 -0.616 -1.185 1.00 0.00 C ATOM 286 OD1 ASN A 22 17.991 0.109 -2.106 1.00 0.00 O ATOM 287 ND2 ASN A 22 18.452 -1.500 -0.599 1.00 0.00 N ATOM 0 H ASN A 22 15.738 0.277 1.779 1.00 0.00 H new ATOM 0 HA ASN A 22 16.487 1.557 -0.750 1.00 0.00 H new ATOM 0 HB2 ASN A 22 16.184 -1.214 0.279 1.00 0.00 H new ATOM 0 HB3 ASN A 22 15.530 -0.980 -1.330 1.00 0.00 H new ATOM 0 HD21 ASN A 22 19.416 -1.602 -0.916 1.00 0.00 H new ATOM 0 HD22 ASN A 22 18.103 -2.076 0.167 1.00 0.00 H new ATOM 294 N ILE A 23 13.484 0.531 0.190 1.00 0.00 N ATOM 295 CA ILE A 23 12.059 0.646 -0.071 1.00 0.00 C ATOM 296 C ILE A 23 11.691 2.123 -0.229 1.00 0.00 C ATOM 297 O ILE A 23 12.020 2.944 0.626 1.00 0.00 O ATOM 298 CB ILE A 23 11.256 -0.074 1.014 1.00 0.00 C ATOM 299 CG1 ILE A 23 11.052 -1.548 0.658 1.00 0.00 C ATOM 300 CG2 ILE A 23 9.929 0.640 1.279 1.00 0.00 C ATOM 301 CD1 ILE A 23 11.422 -2.453 1.835 1.00 0.00 C ATOM 0 H ILE A 23 13.722 0.026 1.044 1.00 0.00 H new ATOM 0 HA ILE A 23 11.802 0.151 -1.008 1.00 0.00 H new ATOM 0 HB ILE A 23 11.829 -0.043 1.940 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.013 -1.717 0.377 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.662 -1.804 -0.208 1.00 0.00 H new ATOM 0 HG21 ILE A 23 9.378 0.108 2.054 1.00 0.00 H new ATOM 0 HG22 ILE A 23 10.124 1.661 1.608 1.00 0.00 H new ATOM 0 HG23 ILE A 23 9.338 0.661 0.363 1.00 0.00 H new ATOM 0 HD11 ILE A 23 11.268 -3.495 1.555 1.00 0.00 H new ATOM 0 HD12 ILE A 23 12.469 -2.299 2.098 1.00 0.00 H new ATOM 0 HD13 ILE A 23 10.794 -2.211 2.692 1.00 0.00 H new ATOM 313 N GLN A 24 11.014 2.417 -1.329 1.00 0.00 N ATOM 314 CA GLN A 24 10.599 3.780 -1.611 1.00 0.00 C ATOM 315 C GLN A 24 9.072 3.885 -1.592 1.00 0.00 C ATOM 316 O GLN A 24 8.523 4.976 -1.453 1.00 0.00 O ATOM 317 CB GLN A 24 11.164 4.261 -2.949 1.00 0.00 C ATOM 318 CG GLN A 24 11.626 5.717 -2.858 1.00 0.00 C ATOM 319 CD GLN A 24 10.728 6.630 -3.694 1.00 0.00 C ATOM 320 OE1 GLN A 24 11.164 7.294 -4.621 1.00 0.00 O ATOM 321 NE2 GLN A 24 9.452 6.627 -3.317 1.00 0.00 N ATOM 0 H GLN A 24 10.742 1.734 -2.036 1.00 0.00 H new ATOM 0 HA GLN A 24 10.999 4.428 -0.831 1.00 0.00 H new ATOM 0 HB2 GLN A 24 12.001 3.628 -3.243 1.00 0.00 H new ATOM 0 HB3 GLN A 24 10.404 4.165 -3.724 1.00 0.00 H new ATOM 0 HG2 GLN A 24 11.613 6.042 -1.818 1.00 0.00 H new ATOM 0 HG3 GLN A 24 12.656 5.798 -3.205 1.00 0.00 H new ATOM 0 HE21 GLN A 24 9.153 6.048 -2.532 1.00 0.00 H new ATOM 0 HE22 GLN A 24 8.772 7.204 -3.813 1.00 0.00 H new ATOM 330 N SER A 25 8.430 2.734 -1.733 1.00 0.00 N ATOM 331 CA SER A 25 6.978 2.682 -1.734 1.00 0.00 C ATOM 332 C SER A 25 6.504 1.303 -1.272 1.00 0.00 C ATOM 333 O SER A 25 7.258 0.333 -1.326 1.00 0.00 O ATOM 334 CB SER A 25 6.417 3.000 -3.121 1.00 0.00 C ATOM 335 OG SER A 25 7.402 3.569 -3.979 1.00 0.00 O ATOM 0 H SER A 25 8.889 1.830 -1.847 1.00 0.00 H new ATOM 0 HA SER A 25 6.608 3.437 -1.041 1.00 0.00 H new ATOM 0 HB2 SER A 25 6.027 2.087 -3.572 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.579 3.690 -3.023 1.00 0.00 H new ATOM 0 HG SER A 25 7.004 3.756 -4.855 1.00 0.00 H new ATOM 341 N VAL A 26 5.256 1.260 -0.828 1.00 0.00 N ATOM 342 CA VAL A 26 4.672 0.016 -0.357 1.00 0.00 C ATOM 343 C VAL A 26 3.318 -0.196 -1.036 1.00 0.00 C ATOM 344 O VAL A 26 2.518 0.733 -1.138 1.00 0.00 O ATOM 345 CB VAL A 26 4.580 0.026 1.171 1.00 0.00 C ATOM 346 CG1 VAL A 26 3.676 -1.101 1.673 1.00 0.00 C ATOM 347 CG2 VAL A 26 5.970 -0.062 1.804 1.00 0.00 C ATOM 0 H VAL A 26 4.633 2.067 -0.785 1.00 0.00 H new ATOM 0 HA VAL A 26 5.306 -0.829 -0.625 1.00 0.00 H new ATOM 0 HB VAL A 26 4.133 0.973 1.474 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.628 -1.071 2.762 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.674 -0.975 1.262 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.081 -2.061 1.354 1.00 0.00 H new ATOM 0 HG21 VAL A 26 5.876 -0.053 2.890 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.455 -0.986 1.489 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.570 0.790 1.484 1.00 0.00 H new ATOM 357 N LYS A 27 3.102 -1.425 -1.483 1.00 0.00 N ATOM 358 CA LYS A 27 1.858 -1.770 -2.150 1.00 0.00 C ATOM 359 C LYS A 27 1.332 -3.092 -1.585 1.00 0.00 C ATOM 360 O LYS A 27 2.055 -4.086 -1.546 1.00 0.00 O ATOM 361 CB LYS A 27 2.049 -1.783 -3.668 1.00 0.00 C ATOM 362 CG LYS A 27 0.756 -1.392 -4.386 1.00 0.00 C ATOM 363 CD LYS A 27 -0.271 -2.525 -4.322 1.00 0.00 C ATOM 364 CE LYS A 27 -0.464 -3.168 -5.696 1.00 0.00 C ATOM 365 NZ LYS A 27 -0.955 -2.169 -6.672 1.00 0.00 N ATOM 0 H LYS A 27 3.767 -2.193 -1.396 1.00 0.00 H new ATOM 0 HA LYS A 27 1.098 -1.013 -1.954 1.00 0.00 H new ATOM 0 HB2 LYS A 27 2.846 -1.092 -3.944 1.00 0.00 H new ATOM 0 HB3 LYS A 27 2.362 -2.776 -3.990 1.00 0.00 H new ATOM 0 HG2 LYS A 27 0.340 -0.493 -3.930 1.00 0.00 H new ATOM 0 HG3 LYS A 27 0.972 -1.151 -5.427 1.00 0.00 H new ATOM 0 HD2 LYS A 27 0.058 -3.279 -3.607 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -1.224 -2.137 -3.961 1.00 0.00 H new ATOM 0 HE2 LYS A 27 0.479 -3.590 -6.042 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -1.174 -3.992 -5.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -1.569 -2.637 -7.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -1.495 -1.433 -6.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -0.146 -1.734 -7.160 1.00 0.00 H new ATOM 379 N VAL A 28 0.077 -3.060 -1.162 1.00 0.00 N ATOM 380 CA VAL A 28 -0.554 -4.242 -0.601 1.00 0.00 C ATOM 381 C VAL A 28 -1.724 -4.662 -1.494 1.00 0.00 C ATOM 382 O VAL A 28 -2.752 -3.989 -1.535 1.00 0.00 O ATOM 383 CB VAL A 28 -0.973 -3.976 0.846 1.00 0.00 C ATOM 384 CG1 VAL A 28 -1.788 -5.144 1.405 1.00 0.00 C ATOM 385 CG2 VAL A 28 0.246 -3.687 1.725 1.00 0.00 C ATOM 0 H VAL A 28 -0.520 -2.234 -1.197 1.00 0.00 H new ATOM 0 HA VAL A 28 0.150 -5.074 -0.573 1.00 0.00 H new ATOM 0 HB VAL A 28 -1.609 -3.091 0.853 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.073 -4.929 2.435 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.685 -5.283 0.802 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.187 -6.053 1.377 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -0.079 -3.501 2.749 1.00 0.00 H new ATOM 0 HG22 VAL A 28 0.918 -4.545 1.708 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.768 -2.809 1.345 1.00 0.00 H new ATOM 395 N LYS A 29 -1.527 -5.774 -2.187 1.00 0.00 N ATOM 396 CA LYS A 29 -2.553 -6.293 -3.077 1.00 0.00 C ATOM 397 C LYS A 29 -3.248 -7.481 -2.409 1.00 0.00 C ATOM 398 O LYS A 29 -2.863 -8.630 -2.623 1.00 0.00 O ATOM 399 CB LYS A 29 -1.958 -6.619 -4.448 1.00 0.00 C ATOM 400 CG LYS A 29 -3.049 -6.688 -5.518 1.00 0.00 C ATOM 401 CD LYS A 29 -3.732 -8.057 -5.518 1.00 0.00 C ATOM 402 CE LYS A 29 -4.041 -8.516 -6.944 1.00 0.00 C ATOM 403 NZ LYS A 29 -3.161 -9.641 -7.329 1.00 0.00 N ATOM 0 H LYS A 29 -0.673 -6.330 -2.151 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.317 -5.538 -3.259 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -1.225 -5.860 -4.720 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -1.429 -7.571 -4.402 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -3.789 -5.908 -5.338 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -2.614 -6.495 -6.499 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -3.089 -8.788 -5.028 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.655 -8.007 -4.940 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -5.085 -8.822 -7.016 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -3.904 -7.686 -7.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -3.132 -9.720 -8.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -2.201 -9.470 -6.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -3.530 -10.525 -6.924 1.00 0.00 H new ATOM 417 N SER A 30 -4.259 -7.164 -1.615 1.00 0.00 N ATOM 418 CA SER A 30 -5.011 -8.191 -0.914 1.00 0.00 C ATOM 419 C SER A 30 -5.355 -9.333 -1.873 1.00 0.00 C ATOM 420 O SER A 30 -5.155 -9.216 -3.081 1.00 0.00 O ATOM 421 CB SER A 30 -6.287 -7.615 -0.297 1.00 0.00 C ATOM 422 OG SER A 30 -7.461 -8.212 -0.841 1.00 0.00 O ATOM 0 H SER A 30 -4.576 -6.210 -1.441 1.00 0.00 H new ATOM 0 HA SER A 30 -4.391 -8.577 -0.105 1.00 0.00 H new ATOM 0 HB2 SER A 30 -6.269 -7.769 0.782 1.00 0.00 H new ATOM 0 HB3 SER A 30 -6.317 -6.538 -0.465 1.00 0.00 H new ATOM 0 HG SER A 30 -8.253 -7.818 -0.420 1.00 0.00 H new ATOM 428 N PRO A 31 -5.880 -10.440 -1.283 1.00 0.00 N ATOM 429 CA PRO A 31 -6.253 -11.603 -2.071 1.00 0.00 C ATOM 430 C PRO A 31 -7.554 -11.351 -2.837 1.00 0.00 C ATOM 431 O PRO A 31 -8.302 -10.432 -2.510 1.00 0.00 O ATOM 432 CB PRO A 31 -6.364 -12.739 -1.068 1.00 0.00 C ATOM 433 CG PRO A 31 -6.505 -12.080 0.294 1.00 0.00 C ATOM 434 CD PRO A 31 -6.131 -10.615 0.145 1.00 0.00 C ATOM 0 HA PRO A 31 -5.521 -11.842 -2.842 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -7.225 -13.371 -1.287 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -5.482 -13.379 -1.103 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -7.527 -12.177 0.661 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -5.857 -12.567 1.022 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -6.935 -9.964 0.488 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -5.248 -10.370 0.735 1.00 0.00 H new ATOM 442 N GLY A 32 -7.783 -12.185 -3.840 1.00 0.00 N ATOM 443 CA GLY A 32 -8.980 -12.065 -4.655 1.00 0.00 C ATOM 444 C GLY A 32 -9.624 -13.434 -4.888 1.00 0.00 C ATOM 445 O GLY A 32 -9.415 -14.363 -4.110 1.00 0.00 O ATOM 0 H GLY A 32 -7.160 -12.947 -4.107 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -9.693 -11.402 -4.165 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -8.728 -11.610 -5.613 1.00 0.00 H new ATOM 449 N PRO A 33 -10.416 -13.516 -5.990 1.00 0.00 N ATOM 450 CA PRO A 33 -11.092 -14.755 -6.336 1.00 0.00 C ATOM 451 C PRO A 33 -10.109 -15.771 -6.922 1.00 0.00 C ATOM 452 O PRO A 33 -10.496 -16.887 -7.266 1.00 0.00 O ATOM 453 CB PRO A 33 -12.182 -14.349 -7.314 1.00 0.00 C ATOM 454 CG PRO A 33 -11.783 -12.978 -7.837 1.00 0.00 C ATOM 455 CD PRO A 33 -10.687 -12.436 -6.935 1.00 0.00 C ATOM 0 HA PRO A 33 -11.521 -15.257 -5.469 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -12.264 -15.069 -8.128 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -13.154 -14.312 -6.822 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -11.430 -13.050 -8.866 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -12.641 -12.306 -7.841 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -9.796 -12.177 -7.507 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -11.009 -11.531 -6.420 1.00 0.00 H new ATOM 463 N HIS A 34 -8.858 -15.347 -7.019 1.00 0.00 N ATOM 464 CA HIS A 34 -7.817 -16.206 -7.558 1.00 0.00 C ATOM 465 C HIS A 34 -6.763 -16.474 -6.482 1.00 0.00 C ATOM 466 O HIS A 34 -6.438 -17.626 -6.200 1.00 0.00 O ATOM 467 CB HIS A 34 -7.222 -15.604 -8.833 1.00 0.00 C ATOM 468 CG HIS A 34 -7.272 -14.096 -8.881 1.00 0.00 C ATOM 469 ND1 HIS A 34 -8.456 -13.388 -8.996 1.00 0.00 N ATOM 470 CD2 HIS A 34 -6.273 -13.169 -8.829 1.00 0.00 C ATOM 471 CE1 HIS A 34 -8.171 -12.094 -9.011 1.00 0.00 C ATOM 472 NE2 HIS A 34 -6.817 -11.961 -8.908 1.00 0.00 N ATOM 0 H HIS A 34 -8.541 -14.420 -6.734 1.00 0.00 H new ATOM 0 HA HIS A 34 -8.246 -17.166 -7.844 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -6.185 -15.926 -8.925 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -7.757 -16.003 -9.695 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -5.218 -13.382 -8.739 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -8.884 -11.287 -9.091 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -6.307 -11.078 -8.894 1.00 0.00 H new ATOM 480 N CYS A 35 -6.260 -15.390 -5.909 1.00 0.00 N ATOM 481 CA CYS A 35 -5.250 -15.493 -4.870 1.00 0.00 C ATOM 482 C CYS A 35 -5.941 -15.348 -3.512 1.00 0.00 C ATOM 483 O CYS A 35 -6.596 -14.341 -3.249 1.00 0.00 O ATOM 484 CB CYS A 35 -4.138 -14.460 -5.057 1.00 0.00 C ATOM 485 SG CYS A 35 -2.802 -14.535 -3.808 1.00 0.00 S ATOM 0 H CYS A 35 -6.533 -14.436 -6.145 1.00 0.00 H new ATOM 0 HA CYS A 35 -4.764 -16.467 -4.928 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -3.700 -14.594 -6.046 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -4.580 -13.464 -5.037 1.00 0.00 H new ATOM 490 N ALA A 36 -5.772 -16.370 -2.686 1.00 0.00 N ATOM 491 CA ALA A 36 -6.372 -16.369 -1.362 1.00 0.00 C ATOM 492 C ALA A 36 -5.311 -15.989 -0.327 1.00 0.00 C ATOM 493 O ALA A 36 -5.430 -16.338 0.846 1.00 0.00 O ATOM 494 CB ALA A 36 -6.994 -17.739 -1.083 1.00 0.00 C ATOM 0 H ALA A 36 -5.228 -17.204 -2.908 1.00 0.00 H new ATOM 0 HA ALA A 36 -7.171 -15.630 -1.303 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.444 -17.739 -0.090 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -7.760 -17.949 -1.829 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -6.221 -18.506 -1.131 1.00 0.00 H new ATOM 500 N GLN A 37 -4.297 -15.278 -0.799 1.00 0.00 N ATOM 501 CA GLN A 37 -3.217 -14.847 0.071 1.00 0.00 C ATOM 502 C GLN A 37 -2.784 -13.423 -0.286 1.00 0.00 C ATOM 503 O GLN A 37 -3.006 -12.965 -1.406 1.00 0.00 O ATOM 504 CB GLN A 37 -2.033 -15.814 -0.004 1.00 0.00 C ATOM 505 CG GLN A 37 -2.510 -17.267 0.035 1.00 0.00 C ATOM 506 CD GLN A 37 -2.598 -17.853 -1.376 1.00 0.00 C ATOM 507 OE1 GLN A 37 -1.748 -17.630 -2.223 1.00 0.00 O ATOM 508 NE2 GLN A 37 -3.670 -18.612 -1.581 1.00 0.00 N ATOM 0 H GLN A 37 -4.201 -14.990 -1.773 1.00 0.00 H new ATOM 0 HA GLN A 37 -3.582 -14.849 1.098 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -1.471 -15.636 -0.921 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -1.353 -15.628 0.828 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -1.825 -17.863 0.638 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -3.486 -17.320 0.516 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -4.343 -18.758 -0.829 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -3.819 -19.048 -2.491 1.00 0.00 H new ATOM 517 N THR A 38 -2.174 -12.763 0.687 1.00 0.00 N ATOM 518 CA THR A 38 -1.709 -11.400 0.489 1.00 0.00 C ATOM 519 C THR A 38 -0.510 -11.379 -0.462 1.00 0.00 C ATOM 520 O THR A 38 0.094 -12.417 -0.728 1.00 0.00 O ATOM 521 CB THR A 38 -1.404 -10.801 1.864 1.00 0.00 C ATOM 522 OG1 THR A 38 -2.630 -10.930 2.578 1.00 0.00 O ATOM 523 CG2 THR A 38 -1.165 -9.291 1.804 1.00 0.00 C ATOM 0 H THR A 38 -1.991 -13.146 1.614 1.00 0.00 H new ATOM 0 HA THR A 38 -2.473 -10.786 0.013 1.00 0.00 H new ATOM 0 HB THR A 38 -0.527 -11.291 2.287 1.00 0.00 H new ATOM 0 HG1 THR A 38 -2.522 -10.567 3.482 1.00 0.00 H new ATOM 0 HG21 THR A 38 -0.953 -8.916 2.805 1.00 0.00 H new ATOM 0 HG22 THR A 38 -0.317 -9.082 1.151 1.00 0.00 H new ATOM 0 HG23 THR A 38 -2.054 -8.797 1.412 1.00 0.00 H new ATOM 531 N GLU A 39 -0.203 -10.185 -0.948 1.00 0.00 N ATOM 532 CA GLU A 39 0.913 -10.015 -1.864 1.00 0.00 C ATOM 533 C GLU A 39 1.472 -8.595 -1.760 1.00 0.00 C ATOM 534 O GLU A 39 1.221 -7.760 -2.628 1.00 0.00 O ATOM 535 CB GLU A 39 0.496 -10.337 -3.300 1.00 0.00 C ATOM 536 CG GLU A 39 0.213 -11.831 -3.467 1.00 0.00 C ATOM 537 CD GLU A 39 1.427 -12.669 -3.060 1.00 0.00 C ATOM 538 OE1 GLU A 39 2.532 -12.085 -3.021 1.00 0.00 O ATOM 539 OE2 GLU A 39 1.223 -13.873 -2.796 1.00 0.00 O ATOM 0 H GLU A 39 -0.707 -9.327 -0.725 1.00 0.00 H new ATOM 0 HA GLU A 39 1.700 -10.715 -1.583 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -0.393 -9.763 -3.561 1.00 0.00 H new ATOM 0 HB3 GLU A 39 1.285 -10.034 -3.988 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -0.647 -12.112 -2.859 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -0.047 -12.042 -4.504 1.00 0.00 H new ATOM 546 N VAL A 40 2.220 -8.364 -0.691 1.00 0.00 N ATOM 547 CA VAL A 40 2.817 -7.059 -0.463 1.00 0.00 C ATOM 548 C VAL A 40 3.936 -6.830 -1.481 1.00 0.00 C ATOM 549 O VAL A 40 4.842 -7.652 -1.608 1.00 0.00 O ATOM 550 CB VAL A 40 3.295 -6.948 0.986 1.00 0.00 C ATOM 551 CG1 VAL A 40 3.913 -5.575 1.256 1.00 0.00 C ATOM 552 CG2 VAL A 40 2.154 -7.238 1.963 1.00 0.00 C ATOM 0 H VAL A 40 2.426 -9.059 0.027 1.00 0.00 H new ATOM 0 HA VAL A 40 2.079 -6.271 -0.609 1.00 0.00 H new ATOM 0 HB VAL A 40 4.069 -7.700 1.142 1.00 0.00 H new ATOM 0 HG11 VAL A 40 4.244 -5.523 2.293 1.00 0.00 H new ATOM 0 HG12 VAL A 40 4.766 -5.423 0.594 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.170 -4.799 1.073 1.00 0.00 H new ATOM 0 HG21 VAL A 40 2.520 -7.152 2.986 1.00 0.00 H new ATOM 0 HG22 VAL A 40 1.348 -6.521 1.805 1.00 0.00 H new ATOM 0 HG23 VAL A 40 1.779 -8.248 1.795 1.00 0.00 H new ATOM 562 N ILE A 41 3.836 -5.709 -2.180 1.00 0.00 N ATOM 563 CA ILE A 41 4.829 -5.362 -3.183 1.00 0.00 C ATOM 564 C ILE A 41 5.309 -3.929 -2.944 1.00 0.00 C ATOM 565 O ILE A 41 4.589 -2.973 -3.230 1.00 0.00 O ATOM 566 CB ILE A 41 4.275 -5.598 -4.589 1.00 0.00 C ATOM 567 CG1 ILE A 41 3.587 -6.962 -4.686 1.00 0.00 C ATOM 568 CG2 ILE A 41 5.370 -5.434 -5.645 1.00 0.00 C ATOM 569 CD1 ILE A 41 2.085 -6.801 -4.931 1.00 0.00 C ATOM 0 H ILE A 41 3.083 -5.029 -2.072 1.00 0.00 H new ATOM 0 HA ILE A 41 5.701 -6.010 -3.096 1.00 0.00 H new ATOM 0 HB ILE A 41 3.518 -4.840 -4.789 1.00 0.00 H new ATOM 0 HG12 ILE A 41 4.031 -7.541 -5.496 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.751 -7.523 -3.766 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.949 -5.607 -6.635 1.00 0.00 H new ATOM 0 HG22 ILE A 41 5.776 -4.424 -5.595 1.00 0.00 H new ATOM 0 HG23 ILE A 41 6.166 -6.154 -5.458 1.00 0.00 H new ATOM 0 HD11 ILE A 41 1.619 -7.784 -4.996 1.00 0.00 H new ATOM 0 HD12 ILE A 41 1.640 -6.243 -4.108 1.00 0.00 H new ATOM 0 HD13 ILE A 41 1.924 -6.261 -5.864 1.00 0.00 H new ATOM 581 N ALA A 42 6.522 -3.824 -2.422 1.00 0.00 N ATOM 582 CA ALA A 42 7.107 -2.524 -2.142 1.00 0.00 C ATOM 583 C ALA A 42 8.031 -2.126 -3.294 1.00 0.00 C ATOM 584 O ALA A 42 8.764 -2.961 -3.823 1.00 0.00 O ATOM 585 CB ALA A 42 7.837 -2.572 -0.798 1.00 0.00 C ATOM 0 H ALA A 42 7.116 -4.619 -2.185 1.00 0.00 H new ATOM 0 HA ALA A 42 6.331 -1.762 -2.065 1.00 0.00 H new ATOM 0 HB1 ALA A 42 8.276 -1.597 -0.587 1.00 0.00 H new ATOM 0 HB2 ALA A 42 7.130 -2.830 -0.009 1.00 0.00 H new ATOM 0 HB3 ALA A 42 8.625 -3.324 -0.839 1.00 0.00 H new ATOM 591 N THR A 43 7.967 -0.851 -3.649 1.00 0.00 N ATOM 592 CA THR A 43 8.790 -0.332 -4.728 1.00 0.00 C ATOM 593 C THR A 43 10.153 0.112 -4.194 1.00 0.00 C ATOM 594 O THR A 43 10.229 0.820 -3.191 1.00 0.00 O ATOM 595 CB THR A 43 8.012 0.790 -5.418 1.00 0.00 C ATOM 596 OG1 THR A 43 6.965 0.113 -6.109 1.00 0.00 O ATOM 597 CG2 THR A 43 8.818 1.463 -6.531 1.00 0.00 C ATOM 0 H THR A 43 7.358 -0.162 -3.208 1.00 0.00 H new ATOM 0 HA THR A 43 9.003 -1.103 -5.469 1.00 0.00 H new ATOM 0 HB THR A 43 7.720 1.536 -4.679 1.00 0.00 H new ATOM 0 HG1 THR A 43 6.410 0.767 -6.583 1.00 0.00 H new ATOM 0 HG21 THR A 43 8.220 2.251 -6.988 1.00 0.00 H new ATOM 0 HG22 THR A 43 9.727 1.894 -6.112 1.00 0.00 H new ATOM 0 HG23 THR A 43 9.082 0.724 -7.287 1.00 0.00 H new ATOM 605 N LEU A 44 11.195 -0.321 -4.889 1.00 0.00 N ATOM 606 CA LEU A 44 12.551 0.024 -4.497 1.00 0.00 C ATOM 607 C LEU A 44 12.863 1.450 -4.956 1.00 0.00 C ATOM 608 O LEU A 44 12.329 1.912 -5.963 1.00 0.00 O ATOM 609 CB LEU A 44 13.541 -1.020 -5.017 1.00 0.00 C ATOM 610 CG LEU A 44 14.553 -1.550 -3.999 1.00 0.00 C ATOM 611 CD1 LEU A 44 15.180 -2.860 -4.480 1.00 0.00 C ATOM 612 CD2 LEU A 44 15.611 -0.493 -3.678 1.00 0.00 C ATOM 0 H LEU A 44 11.127 -0.907 -5.721 1.00 0.00 H new ATOM 0 HA LEU A 44 12.649 0.010 -3.412 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.975 -1.864 -5.410 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.090 -0.587 -5.853 1.00 0.00 H new ATOM 0 HG LEU A 44 14.023 -1.768 -3.072 1.00 0.00 H new ATOM 0 HD11 LEU A 44 15.895 -3.215 -3.738 1.00 0.00 H new ATOM 0 HD12 LEU A 44 14.399 -3.608 -4.618 1.00 0.00 H new ATOM 0 HD13 LEU A 44 15.693 -2.692 -5.427 1.00 0.00 H new ATOM 0 HD21 LEU A 44 16.318 -0.895 -2.952 1.00 0.00 H new ATOM 0 HD22 LEU A 44 16.142 -0.221 -4.590 1.00 0.00 H new ATOM 0 HD23 LEU A 44 15.128 0.391 -3.263 1.00 0.00 H new ATOM 624 N LYS A 45 13.726 2.107 -4.195 1.00 0.00 N ATOM 625 CA LYS A 45 14.115 3.471 -4.512 1.00 0.00 C ATOM 626 C LYS A 45 15.067 3.460 -5.710 1.00 0.00 C ATOM 627 O LYS A 45 15.467 4.515 -6.199 1.00 0.00 O ATOM 628 CB LYS A 45 14.691 4.164 -3.276 1.00 0.00 C ATOM 629 CG LYS A 45 15.010 5.632 -3.568 1.00 0.00 C ATOM 630 CD LYS A 45 16.468 5.801 -3.999 1.00 0.00 C ATOM 631 CE LYS A 45 17.254 6.613 -2.968 1.00 0.00 C ATOM 632 NZ LYS A 45 17.478 7.992 -3.457 1.00 0.00 N ATOM 0 H LYS A 45 14.167 1.721 -3.360 1.00 0.00 H new ATOM 0 HA LYS A 45 13.244 4.058 -4.802 1.00 0.00 H new ATOM 0 HB2 LYS A 45 13.978 4.100 -2.454 1.00 0.00 H new ATOM 0 HB3 LYS A 45 15.596 3.649 -2.955 1.00 0.00 H new ATOM 0 HG2 LYS A 45 14.350 6.002 -4.352 1.00 0.00 H new ATOM 0 HG3 LYS A 45 14.818 6.233 -2.679 1.00 0.00 H new ATOM 0 HD2 LYS A 45 16.930 4.822 -4.124 1.00 0.00 H new ATOM 0 HD3 LYS A 45 16.509 6.299 -4.968 1.00 0.00 H new ATOM 0 HE2 LYS A 45 16.709 6.639 -2.025 1.00 0.00 H new ATOM 0 HE3 LYS A 45 18.211 6.131 -2.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 18.013 8.530 -2.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 18.017 7.962 -4.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 16.561 8.454 -3.624 1.00 0.00 H new ATOM 646 N ASN A 46 15.402 2.255 -6.148 1.00 0.00 N ATOM 647 CA ASN A 46 16.300 2.093 -7.279 1.00 0.00 C ATOM 648 C ASN A 46 15.477 1.838 -8.544 1.00 0.00 C ATOM 649 O ASN A 46 16.015 1.845 -9.650 1.00 0.00 O ATOM 650 CB ASN A 46 17.234 0.899 -7.074 1.00 0.00 C ATOM 651 CG ASN A 46 17.433 0.128 -8.380 1.00 0.00 C ATOM 652 OD1 ASN A 46 17.987 0.625 -9.347 1.00 0.00 O ATOM 653 ND2 ASN A 46 16.952 -1.112 -8.355 1.00 0.00 N ATOM 0 H ASN A 46 15.068 1.382 -5.740 1.00 0.00 H new ATOM 0 HA ASN A 46 16.893 3.003 -7.372 1.00 0.00 H new ATOM 0 HB2 ASN A 46 18.198 1.246 -6.702 1.00 0.00 H new ATOM 0 HB3 ASN A 46 16.820 0.235 -6.315 1.00 0.00 H new ATOM 0 HD21 ASN A 46 17.036 -1.708 -9.178 1.00 0.00 H new ATOM 0 HD22 ASN A 46 16.499 -1.466 -7.513 1.00 0.00 H new ATOM 660 N GLY A 47 14.187 1.618 -8.338 1.00 0.00 N ATOM 661 CA GLY A 47 13.285 1.361 -9.448 1.00 0.00 C ATOM 662 C GLY A 47 12.803 -0.091 -9.438 1.00 0.00 C ATOM 663 O GLY A 47 11.891 -0.451 -10.181 1.00 0.00 O ATOM 0 H GLY A 47 13.745 1.612 -7.419 1.00 0.00 H new ATOM 0 HA2 GLY A 47 12.429 2.033 -9.388 1.00 0.00 H new ATOM 0 HA3 GLY A 47 13.792 1.573 -10.390 1.00 0.00 H new ATOM 667 N GLN A 48 13.437 -0.886 -8.588 1.00 0.00 N ATOM 668 CA GLN A 48 13.084 -2.290 -8.471 1.00 0.00 C ATOM 669 C GLN A 48 11.917 -2.465 -7.497 1.00 0.00 C ATOM 670 O GLN A 48 11.323 -1.484 -7.052 1.00 0.00 O ATOM 671 CB GLN A 48 14.290 -3.125 -8.037 1.00 0.00 C ATOM 672 CG GLN A 48 15.104 -3.583 -9.248 1.00 0.00 C ATOM 673 CD GLN A 48 16.276 -4.468 -8.818 1.00 0.00 C ATOM 674 OE1 GLN A 48 16.678 -4.495 -7.666 1.00 0.00 O ATOM 675 NE2 GLN A 48 16.800 -5.189 -9.805 1.00 0.00 N ATOM 0 H GLN A 48 14.193 -0.584 -7.974 1.00 0.00 H new ATOM 0 HA GLN A 48 12.770 -2.648 -9.452 1.00 0.00 H new ATOM 0 HB2 GLN A 48 14.922 -2.538 -7.370 1.00 0.00 H new ATOM 0 HB3 GLN A 48 13.951 -3.994 -7.472 1.00 0.00 H new ATOM 0 HG2 GLN A 48 14.462 -4.133 -9.936 1.00 0.00 H new ATOM 0 HG3 GLN A 48 15.479 -2.714 -9.788 1.00 0.00 H new ATOM 0 HE21 GLN A 48 16.416 -5.119 -10.747 1.00 0.00 H new ATOM 0 HE22 GLN A 48 17.586 -5.812 -9.620 1.00 0.00 H new ATOM 684 N LYS A 49 11.623 -3.721 -7.195 1.00 0.00 N ATOM 685 CA LYS A 49 10.538 -4.037 -6.282 1.00 0.00 C ATOM 686 C LYS A 49 10.934 -5.239 -5.422 1.00 0.00 C ATOM 687 O LYS A 49 11.657 -6.123 -5.880 1.00 0.00 O ATOM 688 CB LYS A 49 9.230 -4.235 -7.051 1.00 0.00 C ATOM 689 CG LYS A 49 8.827 -2.956 -7.786 1.00 0.00 C ATOM 690 CD LYS A 49 9.305 -2.984 -9.239 1.00 0.00 C ATOM 691 CE LYS A 49 8.677 -1.845 -10.046 1.00 0.00 C ATOM 692 NZ LYS A 49 7.953 -2.381 -11.220 1.00 0.00 N ATOM 0 H LYS A 49 12.118 -4.532 -7.567 1.00 0.00 H new ATOM 0 HA LYS A 49 10.358 -3.204 -5.602 1.00 0.00 H new ATOM 0 HB2 LYS A 49 9.344 -5.049 -7.767 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.439 -4.527 -6.360 1.00 0.00 H new ATOM 0 HG2 LYS A 49 7.743 -2.843 -7.758 1.00 0.00 H new ATOM 0 HG3 LYS A 49 9.251 -2.091 -7.277 1.00 0.00 H new ATOM 0 HD2 LYS A 49 10.391 -2.900 -9.270 1.00 0.00 H new ATOM 0 HD3 LYS A 49 9.046 -3.941 -9.692 1.00 0.00 H new ATOM 0 HE2 LYS A 49 7.991 -1.279 -9.415 1.00 0.00 H new ATOM 0 HE3 LYS A 49 9.453 -1.153 -10.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 7.533 -1.596 -11.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 8.616 -2.901 -11.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 7.200 -3.023 -10.900 1.00 0.00 H new ATOM 706 N ALA A 50 10.442 -5.234 -4.192 1.00 0.00 N ATOM 707 CA ALA A 50 10.736 -6.313 -3.264 1.00 0.00 C ATOM 708 C ALA A 50 9.455 -6.709 -2.527 1.00 0.00 C ATOM 709 O ALA A 50 8.917 -5.927 -1.746 1.00 0.00 O ATOM 710 CB ALA A 50 11.847 -5.875 -2.307 1.00 0.00 C ATOM 0 H ALA A 50 9.842 -4.500 -3.816 1.00 0.00 H new ATOM 0 HA ALA A 50 11.094 -7.192 -3.799 1.00 0.00 H new ATOM 0 HB1 ALA A 50 12.068 -6.684 -1.611 1.00 0.00 H new ATOM 0 HB2 ALA A 50 12.744 -5.632 -2.877 1.00 0.00 H new ATOM 0 HB3 ALA A 50 11.522 -4.996 -1.750 1.00 0.00 H new ATOM 716 N CYS A 51 9.004 -7.924 -2.803 1.00 0.00 N ATOM 717 CA CYS A 51 7.796 -8.434 -2.177 1.00 0.00 C ATOM 718 C CYS A 51 8.115 -8.765 -0.718 1.00 0.00 C ATOM 719 O CYS A 51 9.186 -9.289 -0.416 1.00 0.00 O ATOM 720 CB CYS A 51 7.237 -9.644 -2.928 1.00 0.00 C ATOM 721 SG CYS A 51 5.738 -9.304 -3.922 1.00 0.00 S ATOM 0 H CYS A 51 9.454 -8.570 -3.452 1.00 0.00 H new ATOM 0 HA CYS A 51 7.015 -7.674 -2.214 1.00 0.00 H new ATOM 0 HB2 CYS A 51 8.012 -10.035 -3.587 1.00 0.00 H new ATOM 0 HB3 CYS A 51 7.007 -10.428 -2.206 1.00 0.00 H new ATOM 726 N LEU A 52 7.165 -8.447 0.150 1.00 0.00 N ATOM 727 CA LEU A 52 7.331 -8.705 1.570 1.00 0.00 C ATOM 728 C LEU A 52 6.447 -9.885 1.977 1.00 0.00 C ATOM 729 O LEU A 52 5.497 -10.224 1.273 1.00 0.00 O ATOM 730 CB LEU A 52 7.070 -7.433 2.379 1.00 0.00 C ATOM 731 CG LEU A 52 8.007 -6.256 2.100 1.00 0.00 C ATOM 732 CD1 LEU A 52 7.408 -4.944 2.612 1.00 0.00 C ATOM 733 CD2 LEU A 52 9.400 -6.514 2.679 1.00 0.00 C ATOM 0 H LEU A 52 6.277 -8.013 -0.103 1.00 0.00 H new ATOM 0 HA LEU A 52 8.361 -8.988 1.788 1.00 0.00 H new ATOM 0 HB2 LEU A 52 6.046 -7.110 2.190 1.00 0.00 H new ATOM 0 HB3 LEU A 52 7.135 -7.680 3.439 1.00 0.00 H new ATOM 0 HG LEU A 52 8.120 -6.159 1.020 1.00 0.00 H new ATOM 0 HD11 LEU A 52 8.094 -4.124 2.401 1.00 0.00 H new ATOM 0 HD12 LEU A 52 6.457 -4.759 2.113 1.00 0.00 H new ATOM 0 HD13 LEU A 52 7.246 -5.013 3.688 1.00 0.00 H new ATOM 0 HD21 LEU A 52 10.046 -5.662 2.467 1.00 0.00 H new ATOM 0 HD22 LEU A 52 9.326 -6.653 3.758 1.00 0.00 H new ATOM 0 HD23 LEU A 52 9.822 -7.411 2.226 1.00 0.00 H new ATOM 745 N ASN A 53 6.791 -10.477 3.111 1.00 0.00 N ATOM 746 CA ASN A 53 6.040 -11.612 3.620 1.00 0.00 C ATOM 747 C ASN A 53 4.896 -11.108 4.501 1.00 0.00 C ATOM 748 O ASN A 53 5.132 -10.549 5.571 1.00 0.00 O ATOM 749 CB ASN A 53 6.927 -12.523 4.471 1.00 0.00 C ATOM 750 CG ASN A 53 6.392 -13.956 4.480 1.00 0.00 C ATOM 751 OD1 ASN A 53 5.764 -14.418 3.542 1.00 0.00 O ATOM 752 ND2 ASN A 53 6.676 -14.632 5.590 1.00 0.00 N ATOM 0 H ASN A 53 7.580 -10.192 3.692 1.00 0.00 H new ATOM 0 HA ASN A 53 5.660 -12.174 2.767 1.00 0.00 H new ATOM 0 HB2 ASN A 53 7.945 -12.513 4.081 1.00 0.00 H new ATOM 0 HB3 ASN A 53 6.973 -12.142 5.491 1.00 0.00 H new ATOM 0 HD21 ASN A 53 6.363 -15.597 5.693 1.00 0.00 H new ATOM 0 HD22 ASN A 53 7.206 -14.185 6.338 1.00 0.00 H new ATOM 759 N PRO A 54 3.648 -11.328 4.007 1.00 0.00 N ATOM 760 CA PRO A 54 2.467 -10.902 4.738 1.00 0.00 C ATOM 761 C PRO A 54 2.196 -11.824 5.928 1.00 0.00 C ATOM 762 O PRO A 54 1.072 -12.289 6.114 1.00 0.00 O ATOM 763 CB PRO A 54 1.345 -10.910 3.712 1.00 0.00 C ATOM 764 CG PRO A 54 1.835 -11.780 2.566 1.00 0.00 C ATOM 765 CD PRO A 54 3.330 -11.986 2.743 1.00 0.00 C ATOM 0 HA PRO A 54 2.579 -9.911 5.178 1.00 0.00 H new ATOM 0 HB2 PRO A 54 0.426 -11.310 4.141 1.00 0.00 H new ATOM 0 HB3 PRO A 54 1.123 -9.900 3.368 1.00 0.00 H new ATOM 0 HG2 PRO A 54 1.315 -12.738 2.565 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.626 -11.303 1.608 1.00 0.00 H new ATOM 0 HD2 PRO A 54 3.583 -13.046 2.774 1.00 0.00 H new ATOM 0 HD3 PRO A 54 3.891 -11.549 1.917 1.00 0.00 H new ATOM 773 N ALA A 55 3.244 -12.063 6.702 1.00 0.00 N ATOM 774 CA ALA A 55 3.134 -12.922 7.868 1.00 0.00 C ATOM 775 C ALA A 55 4.389 -12.770 8.730 1.00 0.00 C ATOM 776 O ALA A 55 4.805 -13.714 9.399 1.00 0.00 O ATOM 777 CB ALA A 55 2.907 -14.367 7.418 1.00 0.00 C ATOM 0 H ALA A 55 4.174 -11.676 6.544 1.00 0.00 H new ATOM 0 HA ALA A 55 2.279 -12.632 8.478 1.00 0.00 H new ATOM 0 HB1 ALA A 55 2.824 -15.012 8.293 1.00 0.00 H new ATOM 0 HB2 ALA A 55 1.988 -14.426 6.835 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.747 -14.693 6.805 1.00 0.00 H new ATOM 783 N SER A 56 4.956 -11.574 8.685 1.00 0.00 N ATOM 784 CA SER A 56 6.156 -11.285 9.453 1.00 0.00 C ATOM 785 C SER A 56 5.912 -10.089 10.375 1.00 0.00 C ATOM 786 O SER A 56 5.123 -9.202 10.052 1.00 0.00 O ATOM 787 CB SER A 56 7.347 -11.012 8.533 1.00 0.00 C ATOM 788 OG SER A 56 8.321 -10.178 9.154 1.00 0.00 O ATOM 0 H SER A 56 4.607 -10.793 8.129 1.00 0.00 H new ATOM 0 HA SER A 56 6.393 -12.160 10.058 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.808 -11.957 8.247 1.00 0.00 H new ATOM 0 HB3 SER A 56 6.996 -10.539 7.616 1.00 0.00 H new ATOM 0 HG SER A 56 9.105 -10.100 8.571 1.00 0.00 H new ATOM 794 N PRO A 57 6.622 -10.102 11.535 1.00 0.00 N ATOM 795 CA PRO A 57 6.490 -9.029 12.506 1.00 0.00 C ATOM 796 C PRO A 57 7.220 -7.770 12.033 1.00 0.00 C ATOM 797 O PRO A 57 6.832 -6.656 12.381 1.00 0.00 O ATOM 798 CB PRO A 57 7.058 -9.595 13.797 1.00 0.00 C ATOM 799 CG PRO A 57 7.907 -10.789 13.391 1.00 0.00 C ATOM 800 CD PRO A 57 7.566 -11.136 11.951 1.00 0.00 C ATOM 0 HA PRO A 57 5.456 -8.713 12.646 1.00 0.00 H new ATOM 0 HB2 PRO A 57 7.657 -8.850 14.320 1.00 0.00 H new ATOM 0 HB3 PRO A 57 6.260 -9.896 14.476 1.00 0.00 H new ATOM 0 HG2 PRO A 57 8.967 -10.553 13.486 1.00 0.00 H new ATOM 0 HG3 PRO A 57 7.709 -11.638 14.045 1.00 0.00 H new ATOM 0 HD2 PRO A 57 8.456 -11.136 11.322 1.00 0.00 H new ATOM 0 HD3 PRO A 57 7.124 -12.129 11.877 1.00 0.00 H new ATOM 808 N MET A 58 8.264 -7.989 11.247 1.00 0.00 N ATOM 809 CA MET A 58 9.051 -6.886 10.723 1.00 0.00 C ATOM 810 C MET A 58 8.402 -6.296 9.470 1.00 0.00 C ATOM 811 O MET A 58 8.628 -5.133 9.138 1.00 0.00 O ATOM 812 CB MET A 58 10.459 -7.379 10.385 1.00 0.00 C ATOM 813 CG MET A 58 11.432 -6.206 10.247 1.00 0.00 C ATOM 814 SD MET A 58 11.592 -5.358 11.810 1.00 0.00 S ATOM 815 CE MET A 58 11.863 -6.751 12.892 1.00 0.00 C ATOM 0 H MET A 58 8.583 -8.914 10.960 1.00 0.00 H new ATOM 0 HA MET A 58 9.102 -6.107 11.484 1.00 0.00 H new ATOM 0 HB2 MET A 58 10.808 -8.056 11.165 1.00 0.00 H new ATOM 0 HB3 MET A 58 10.436 -7.948 9.456 1.00 0.00 H new ATOM 0 HG2 MET A 58 12.406 -6.568 9.919 1.00 0.00 H new ATOM 0 HG3 MET A 58 11.075 -5.515 9.484 1.00 0.00 H new ATOM 0 HE1 MET A 58 12.422 -6.427 13.770 1.00 0.00 H new ATOM 0 HE2 MET A 58 10.903 -7.161 13.204 1.00 0.00 H new ATOM 0 HE3 MET A 58 12.430 -7.517 12.364 1.00 0.00 H new ATOM 825 N VAL A 59 7.608 -7.125 8.807 1.00 0.00 N ATOM 826 CA VAL A 59 6.925 -6.699 7.597 1.00 0.00 C ATOM 827 C VAL A 59 5.841 -5.682 7.960 1.00 0.00 C ATOM 828 O VAL A 59 5.340 -4.968 7.092 1.00 0.00 O ATOM 829 CB VAL A 59 6.375 -7.917 6.851 1.00 0.00 C ATOM 830 CG1 VAL A 59 5.122 -7.552 6.053 1.00 0.00 C ATOM 831 CG2 VAL A 59 7.443 -8.532 5.944 1.00 0.00 C ATOM 0 H VAL A 59 7.423 -8.089 9.085 1.00 0.00 H new ATOM 0 HA VAL A 59 7.621 -6.205 6.919 1.00 0.00 H new ATOM 0 HB VAL A 59 6.093 -8.665 7.592 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.752 -8.435 5.533 1.00 0.00 H new ATOM 0 HG12 VAL A 59 4.353 -7.182 6.732 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.367 -6.778 5.325 1.00 0.00 H new ATOM 0 HG21 VAL A 59 7.027 -9.396 5.425 1.00 0.00 H new ATOM 0 HG22 VAL A 59 7.769 -7.792 5.213 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.295 -8.847 6.547 1.00 0.00 H new ATOM 841 N LYS A 60 5.512 -5.647 9.242 1.00 0.00 N ATOM 842 CA LYS A 60 4.497 -4.728 9.730 1.00 0.00 C ATOM 843 C LYS A 60 5.178 -3.514 10.365 1.00 0.00 C ATOM 844 O LYS A 60 4.509 -2.641 10.916 1.00 0.00 O ATOM 845 CB LYS A 60 3.528 -5.450 10.668 1.00 0.00 C ATOM 846 CG LYS A 60 3.071 -6.781 10.067 1.00 0.00 C ATOM 847 CD LYS A 60 2.187 -6.554 8.839 1.00 0.00 C ATOM 848 CE LYS A 60 0.789 -6.086 9.249 1.00 0.00 C ATOM 849 NZ LYS A 60 0.609 -4.651 8.935 1.00 0.00 N ATOM 0 H LYS A 60 5.930 -6.240 9.959 1.00 0.00 H new ATOM 0 HA LYS A 60 3.889 -4.358 8.905 1.00 0.00 H new ATOM 0 HB2 LYS A 60 4.011 -5.628 11.629 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.662 -4.817 10.859 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.941 -7.376 9.788 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.521 -7.352 10.815 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.647 -5.811 8.188 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.112 -7.478 8.265 1.00 0.00 H new ATOM 0 HE2 LYS A 60 0.035 -6.676 8.728 1.00 0.00 H new ATOM 0 HE3 LYS A 60 0.642 -6.252 10.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -0.206 -4.279 9.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 1.465 -4.126 9.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 0.441 -4.537 7.915 1.00 0.00 H new ATOM 863 N LYS A 61 6.499 -3.497 10.267 1.00 0.00 N ATOM 864 CA LYS A 61 7.277 -2.404 10.824 1.00 0.00 C ATOM 865 C LYS A 61 8.028 -1.691 9.698 1.00 0.00 C ATOM 866 O LYS A 61 8.511 -0.575 9.879 1.00 0.00 O ATOM 867 CB LYS A 61 8.187 -2.912 11.944 1.00 0.00 C ATOM 868 CG LYS A 61 7.367 -3.508 13.090 1.00 0.00 C ATOM 869 CD LYS A 61 7.918 -3.066 14.447 1.00 0.00 C ATOM 870 CE LYS A 61 7.097 -3.661 15.593 1.00 0.00 C ATOM 871 NZ LYS A 61 5.892 -2.841 15.847 1.00 0.00 N ATOM 0 H LYS A 61 7.050 -4.223 9.810 1.00 0.00 H new ATOM 0 HA LYS A 61 6.621 -1.666 11.286 1.00 0.00 H new ATOM 0 HB2 LYS A 61 8.869 -3.666 11.550 1.00 0.00 H new ATOM 0 HB3 LYS A 61 8.800 -2.093 12.319 1.00 0.00 H new ATOM 0 HG2 LYS A 61 6.326 -3.197 12.997 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.381 -4.596 13.025 1.00 0.00 H new ATOM 0 HD2 LYS A 61 8.958 -3.378 14.540 1.00 0.00 H new ATOM 0 HD3 LYS A 61 7.904 -1.978 14.512 1.00 0.00 H new ATOM 0 HE2 LYS A 61 6.804 -4.682 15.347 1.00 0.00 H new ATOM 0 HE3 LYS A 61 7.706 -3.713 16.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 5.346 -3.259 16.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 6.178 -1.874 16.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 5.304 -2.813 14.990 1.00 0.00 H new ATOM 885 N ILE A 62 8.101 -2.366 8.559 1.00 0.00 N ATOM 886 CA ILE A 62 8.784 -1.810 7.404 1.00 0.00 C ATOM 887 C ILE A 62 7.771 -1.078 6.521 1.00 0.00 C ATOM 888 O ILE A 62 8.151 -0.282 5.663 1.00 0.00 O ATOM 889 CB ILE A 62 9.565 -2.901 6.668 1.00 0.00 C ATOM 890 CG1 ILE A 62 10.541 -3.608 7.611 1.00 0.00 C ATOM 891 CG2 ILE A 62 10.270 -2.333 5.434 1.00 0.00 C ATOM 892 CD1 ILE A 62 10.808 -5.042 7.149 1.00 0.00 C ATOM 0 H ILE A 62 7.699 -3.292 8.412 1.00 0.00 H new ATOM 0 HA ILE A 62 9.525 -1.074 7.717 1.00 0.00 H new ATOM 0 HB ILE A 62 8.856 -3.651 6.317 1.00 0.00 H new ATOM 0 HG12 ILE A 62 11.479 -3.054 7.651 1.00 0.00 H new ATOM 0 HG13 ILE A 62 10.133 -3.618 8.622 1.00 0.00 H new ATOM 0 HG21 ILE A 62 10.818 -3.129 4.929 1.00 0.00 H new ATOM 0 HG22 ILE A 62 9.530 -1.914 4.753 1.00 0.00 H new ATOM 0 HG23 ILE A 62 10.966 -1.551 5.740 1.00 0.00 H new ATOM 0 HD11 ILE A 62 11.505 -5.522 7.836 1.00 0.00 H new ATOM 0 HD12 ILE A 62 9.872 -5.600 7.133 1.00 0.00 H new ATOM 0 HD13 ILE A 62 11.238 -5.027 6.148 1.00 0.00 H new ATOM 904 N ILE A 63 6.502 -1.372 6.763 1.00 0.00 N ATOM 905 CA ILE A 63 5.432 -0.751 6.001 1.00 0.00 C ATOM 906 C ILE A 63 4.928 0.484 6.750 1.00 0.00 C ATOM 907 O ILE A 63 4.921 1.586 6.203 1.00 0.00 O ATOM 908 CB ILE A 63 4.335 -1.771 5.689 1.00 0.00 C ATOM 909 CG1 ILE A 63 4.777 -2.731 4.583 1.00 0.00 C ATOM 910 CG2 ILE A 63 3.017 -1.072 5.348 1.00 0.00 C ATOM 911 CD1 ILE A 63 4.074 -4.083 4.718 1.00 0.00 C ATOM 0 H ILE A 63 6.191 -2.032 7.476 1.00 0.00 H new ATOM 0 HA ILE A 63 5.802 -0.409 5.034 1.00 0.00 H new ATOM 0 HB ILE A 63 4.161 -2.369 6.584 1.00 0.00 H new ATOM 0 HG12 ILE A 63 4.554 -2.297 3.609 1.00 0.00 H new ATOM 0 HG13 ILE A 63 5.857 -2.872 4.629 1.00 0.00 H new ATOM 0 HG21 ILE A 63 2.254 -1.820 5.130 1.00 0.00 H new ATOM 0 HG22 ILE A 63 2.698 -0.464 6.195 1.00 0.00 H new ATOM 0 HG23 ILE A 63 3.159 -0.434 4.476 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.406 -4.747 3.920 1.00 0.00 H new ATOM 0 HD12 ILE A 63 4.319 -4.526 5.683 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.996 -3.941 4.647 1.00 0.00 H new ATOM 923 N GLU A 64 4.520 0.259 7.990 1.00 0.00 N ATOM 924 CA GLU A 64 4.016 1.340 8.820 1.00 0.00 C ATOM 925 C GLU A 64 5.015 2.499 8.846 1.00 0.00 C ATOM 926 O GLU A 64 4.619 3.664 8.862 1.00 0.00 O ATOM 927 CB GLU A 64 3.711 0.848 10.236 1.00 0.00 C ATOM 928 CG GLU A 64 2.540 -0.137 10.234 1.00 0.00 C ATOM 929 CD GLU A 64 2.558 -1.013 11.489 1.00 0.00 C ATOM 930 OE1 GLU A 64 3.197 -0.582 12.473 1.00 0.00 O ATOM 931 OE2 GLU A 64 1.932 -2.093 11.435 1.00 0.00 O ATOM 0 H GLU A 64 4.528 -0.656 8.440 1.00 0.00 H new ATOM 0 HA GLU A 64 3.083 1.699 8.387 1.00 0.00 H new ATOM 0 HB2 GLU A 64 4.595 0.367 10.656 1.00 0.00 H new ATOM 0 HB3 GLU A 64 3.475 1.697 10.877 1.00 0.00 H new ATOM 0 HG2 GLU A 64 1.599 0.411 10.182 1.00 0.00 H new ATOM 0 HG3 GLU A 64 2.591 -0.767 9.346 1.00 0.00 H new ATOM 938 N LYS A 65 6.290 2.140 8.849 1.00 0.00 N ATOM 939 CA LYS A 65 7.348 3.136 8.873 1.00 0.00 C ATOM 940 C LYS A 65 7.380 3.871 7.532 1.00 0.00 C ATOM 941 O LYS A 65 7.630 5.075 7.485 1.00 0.00 O ATOM 942 CB LYS A 65 8.683 2.491 9.253 1.00 0.00 C ATOM 943 CG LYS A 65 8.979 2.681 10.742 1.00 0.00 C ATOM 944 CD LYS A 65 10.186 3.598 10.947 1.00 0.00 C ATOM 945 CE LYS A 65 9.742 5.041 11.195 1.00 0.00 C ATOM 946 NZ LYS A 65 9.751 5.345 12.644 1.00 0.00 N ATOM 0 H LYS A 65 6.615 1.173 8.835 1.00 0.00 H new ATOM 0 HA LYS A 65 7.151 3.883 9.642 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.658 1.427 9.016 1.00 0.00 H new ATOM 0 HB3 LYS A 65 9.485 2.930 8.660 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.107 3.105 11.239 1.00 0.00 H new ATOM 0 HG3 LYS A 65 9.170 1.713 11.205 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.776 3.245 11.793 1.00 0.00 H new ATOM 0 HD3 LYS A 65 10.831 3.558 10.069 1.00 0.00 H new ATOM 0 HE2 LYS A 65 10.406 5.727 10.669 1.00 0.00 H new ATOM 0 HE3 LYS A 65 8.741 5.194 10.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 9.767 6.376 12.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 8.897 4.949 13.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 10.595 4.924 13.082 1.00 0.00 H new ATOM 960 N MET A 66 7.124 3.117 6.473 1.00 0.00 N ATOM 961 CA MET A 66 7.120 3.682 5.134 1.00 0.00 C ATOM 962 C MET A 66 6.121 4.835 5.029 1.00 0.00 C ATOM 963 O MET A 66 6.412 5.859 4.413 1.00 0.00 O ATOM 964 CB MET A 66 6.754 2.595 4.122 1.00 0.00 C ATOM 965 CG MET A 66 7.883 2.384 3.111 1.00 0.00 C ATOM 966 SD MET A 66 8.105 3.857 2.128 1.00 0.00 S ATOM 967 CE MET A 66 6.419 4.144 1.616 1.00 0.00 C ATOM 0 H MET A 66 6.918 2.119 6.515 1.00 0.00 H new ATOM 0 HA MET A 66 8.116 4.069 4.920 1.00 0.00 H new ATOM 0 HB2 MET A 66 6.550 1.661 4.645 1.00 0.00 H new ATOM 0 HB3 MET A 66 5.840 2.874 3.598 1.00 0.00 H new ATOM 0 HG2 MET A 66 8.809 2.142 3.633 1.00 0.00 H new ATOM 0 HG3 MET A 66 7.650 1.537 2.465 1.00 0.00 H new ATOM 0 HE1 MET A 66 6.412 4.601 0.626 1.00 0.00 H new ATOM 0 HE2 MET A 66 5.883 3.196 1.582 1.00 0.00 H new ATOM 0 HE3 MET A 66 5.931 4.811 2.327 1.00 0.00 H new ATOM 977 N LEU A 67 4.963 4.631 5.640 1.00 0.00 N ATOM 978 CA LEU A 67 3.919 5.641 5.622 1.00 0.00 C ATOM 979 C LEU A 67 4.384 6.863 6.416 1.00 0.00 C ATOM 980 O LEU A 67 3.804 7.942 6.299 1.00 0.00 O ATOM 981 CB LEU A 67 2.596 5.053 6.119 1.00 0.00 C ATOM 982 CG LEU A 67 1.837 4.174 5.123 1.00 0.00 C ATOM 983 CD1 LEU A 67 2.736 3.061 4.579 1.00 0.00 C ATOM 984 CD2 LEU A 67 0.554 3.621 5.746 1.00 0.00 C ATOM 0 H LEU A 67 4.725 3.781 6.151 1.00 0.00 H new ATOM 0 HA LEU A 67 3.730 5.975 4.602 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.796 4.464 7.014 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.945 5.875 6.417 1.00 0.00 H new ATOM 0 HG LEU A 67 1.542 4.794 4.276 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.173 2.450 3.873 1.00 0.00 H new ATOM 0 HD12 LEU A 67 3.595 3.502 4.073 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.082 2.437 5.403 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.034 3.000 5.017 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.804 3.021 6.621 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.091 4.447 6.044 1.00 0.00 H new ATOM 996 N LYS A 68 5.427 6.654 7.206 1.00 0.00 N ATOM 997 CA LYS A 68 5.977 7.725 8.019 1.00 0.00 C ATOM 998 C LYS A 68 7.233 8.279 7.343 1.00 0.00 C ATOM 999 O LYS A 68 7.549 9.460 7.483 1.00 0.00 O ATOM 1000 CB LYS A 68 6.211 7.244 9.453 1.00 0.00 C ATOM 1001 CG LYS A 68 7.123 8.210 10.213 1.00 0.00 C ATOM 1002 CD LYS A 68 6.526 8.570 11.575 1.00 0.00 C ATOM 1003 CE LYS A 68 6.987 7.586 12.652 1.00 0.00 C ATOM 1004 NZ LYS A 68 7.544 8.314 13.815 1.00 0.00 N ATOM 0 H LYS A 68 5.906 5.758 7.300 1.00 0.00 H new ATOM 0 HA LYS A 68 5.267 8.548 8.096 1.00 0.00 H new ATOM 0 HB2 LYS A 68 5.256 7.156 9.971 1.00 0.00 H new ATOM 0 HB3 LYS A 68 6.659 6.250 9.439 1.00 0.00 H new ATOM 0 HG2 LYS A 68 8.105 7.757 10.350 1.00 0.00 H new ATOM 0 HG3 LYS A 68 7.270 9.116 9.625 1.00 0.00 H new ATOM 0 HD2 LYS A 68 6.823 9.582 11.850 1.00 0.00 H new ATOM 0 HD3 LYS A 68 5.438 8.563 11.513 1.00 0.00 H new ATOM 0 HE2 LYS A 68 6.148 6.967 12.971 1.00 0.00 H new ATOM 0 HE3 LYS A 68 7.741 6.914 12.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 7.852 7.631 14.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 8.357 8.886 13.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 6.814 8.937 14.217 1.00 0.00 H new ATOM 1018 N ASN A 69 7.916 7.400 6.625 1.00 0.00 N ATOM 1019 CA ASN A 69 9.131 7.786 5.927 1.00 0.00 C ATOM 1020 C ASN A 69 10.173 8.252 6.946 1.00 0.00 C ATOM 1021 O ASN A 69 11.091 7.507 7.285 1.00 0.00 O ATOM 1022 CB ASN A 69 8.866 8.941 4.959 1.00 0.00 C ATOM 1023 CG ASN A 69 10.177 9.500 4.402 1.00 0.00 C ATOM 1024 OD1 ASN A 69 10.926 8.827 3.713 1.00 0.00 O ATOM 1025 ND2 ASN A 69 10.410 10.766 4.737 1.00 0.00 N ATOM 0 H ASN A 69 7.651 6.422 6.511 1.00 0.00 H new ATOM 0 HA ASN A 69 9.488 6.921 5.368 1.00 0.00 H new ATOM 0 HB2 ASN A 69 8.236 8.596 4.139 1.00 0.00 H new ATOM 0 HB3 ASN A 69 8.318 9.732 5.472 1.00 0.00 H new ATOM 0 HD21 ASN A 69 11.258 11.231 4.414 1.00 0.00 H new ATOM 0 HD22 ASN A 69 9.740 11.272 5.317 1.00 0.00 H new ATOM 1032 N GLY A 70 9.995 9.482 7.405 1.00 0.00 N ATOM 1033 CA GLY A 70 10.909 10.057 8.378 1.00 0.00 C ATOM 1034 C GLY A 70 10.708 11.569 8.493 1.00 0.00 C ATOM 1035 O GLY A 70 9.582 12.039 8.650 1.00 0.00 O ATOM 0 H GLY A 70 9.232 10.096 7.121 1.00 0.00 H new ATOM 0 HA2 GLY A 70 10.751 9.591 9.350 1.00 0.00 H new ATOM 0 HA3 GLY A 70 11.937 9.845 8.086 1.00 0.00 H new ATOM 1039 N LYS A 71 11.817 12.289 8.409 1.00 0.00 N ATOM 1040 CA LYS A 71 11.777 13.739 8.502 1.00 0.00 C ATOM 1041 C LYS A 71 10.884 14.292 7.389 1.00 0.00 C ATOM 1042 O LYS A 71 10.210 13.533 6.694 1.00 0.00 O ATOM 1043 CB LYS A 71 13.194 14.315 8.497 1.00 0.00 C ATOM 1044 CG LYS A 71 13.777 14.349 9.912 1.00 0.00 C ATOM 1045 CD LYS A 71 15.234 13.885 9.915 1.00 0.00 C ATOM 1046 CE LYS A 71 15.347 12.437 10.396 1.00 0.00 C ATOM 1047 NZ LYS A 71 16.740 12.130 10.793 1.00 0.00 N ATOM 0 H LYS A 71 12.749 11.896 8.278 1.00 0.00 H new ATOM 0 HA LYS A 71 11.335 14.049 9.449 1.00 0.00 H new ATOM 0 HB2 LYS A 71 13.833 13.713 7.851 1.00 0.00 H new ATOM 0 HB3 LYS A 71 13.179 15.323 8.081 1.00 0.00 H new ATOM 0 HG2 LYS A 71 13.713 15.361 10.311 1.00 0.00 H new ATOM 0 HG3 LYS A 71 13.186 13.710 10.568 1.00 0.00 H new ATOM 0 HD2 LYS A 71 15.649 13.972 8.911 1.00 0.00 H new ATOM 0 HD3 LYS A 71 15.825 14.534 10.561 1.00 0.00 H new ATOM 0 HE2 LYS A 71 14.678 12.275 11.241 1.00 0.00 H new ATOM 0 HE3 LYS A 71 15.030 11.759 9.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 16.799 11.143 11.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 17.371 12.265 9.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 17.029 12.765 11.564 1.00 0.00 H new ATOM 1061 N SER A 72 10.908 15.610 7.255 1.00 0.00 N ATOM 1062 CA SER A 72 10.110 16.273 6.238 1.00 0.00 C ATOM 1063 C SER A 72 10.205 15.509 4.916 1.00 0.00 C ATOM 1064 O SER A 72 9.210 14.969 4.434 1.00 0.00 O ATOM 1065 CB SER A 72 10.557 17.724 6.046 1.00 0.00 C ATOM 1066 OG SER A 72 11.962 17.825 5.831 1.00 0.00 O ATOM 0 H SER A 72 11.467 16.236 7.834 1.00 0.00 H new ATOM 0 HA SER A 72 9.072 16.282 6.571 1.00 0.00 H new ATOM 0 HB2 SER A 72 10.028 18.157 5.197 1.00 0.00 H new ATOM 0 HB3 SER A 72 10.282 18.308 6.924 1.00 0.00 H new ATOM 0 HG SER A 72 12.208 18.766 5.711 1.00 0.00 H new ATOM 1072 N ASN A 73 11.411 15.487 4.368 1.00 0.00 N ATOM 1073 CA ASN A 73 11.649 14.798 3.111 1.00 0.00 C ATOM 1074 C ASN A 73 11.065 13.385 3.190 1.00 0.00 C ATOM 1075 O ASN A 73 10.772 12.773 2.165 1.00 0.00 O ATOM 1076 CB ASN A 73 13.147 14.674 2.826 1.00 0.00 C ATOM 1077 CG ASN A 73 13.504 15.315 1.483 1.00 0.00 C ATOM 1078 OD1 ASN A 73 12.673 15.891 0.800 1.00 0.00 O ATOM 1079 ND2 ASN A 73 14.783 15.182 1.143 1.00 0.00 N ATOM 0 H ASN A 73 12.234 15.935 4.771 1.00 0.00 H new ATOM 0 HA ASN A 73 11.177 15.375 2.316 1.00 0.00 H new ATOM 0 HB2 ASN A 73 13.714 15.154 3.624 1.00 0.00 H new ATOM 0 HB3 ASN A 73 13.434 13.622 2.819 1.00 0.00 H new ATOM 0 HD21 ASN A 73 15.121 15.574 0.264 1.00 0.00 H new ATOM 0 HD22 ASN A 73 15.426 14.688 1.761 1.00 0.00 H new TER 1086 ASN A 73 ATOM 1087 N THR B 5 16.921 14.539 -13.069 1.00 0.00 N ATOM 1088 CA THR B 5 15.502 14.234 -12.998 1.00 0.00 C ATOM 1089 C THR B 5 14.807 15.158 -11.997 1.00 0.00 C ATOM 1090 O THR B 5 15.086 15.106 -10.800 1.00 0.00 O ATOM 1091 CB THR B 5 15.354 12.749 -12.659 1.00 0.00 C ATOM 1092 OG1 THR B 5 16.410 12.497 -11.736 1.00 0.00 O ATOM 1093 CG2 THR B 5 15.674 11.842 -13.848 1.00 0.00 C ATOM 0 HA THR B 5 15.010 14.415 -13.954 1.00 0.00 H new ATOM 0 HB THR B 5 14.337 12.554 -12.318 1.00 0.00 H new ATOM 0 HG1 THR B 5 17.247 12.867 -12.087 1.00 0.00 H new ATOM 0 HG21 THR B 5 15.553 10.800 -13.553 1.00 0.00 H new ATOM 0 HG22 THR B 5 14.995 12.067 -14.671 1.00 0.00 H new ATOM 0 HG23 THR B 5 16.702 12.012 -14.169 1.00 0.00 H new ATOM 1101 N GLU B 6 13.915 15.984 -12.524 1.00 0.00 N ATOM 1102 CA GLU B 6 13.177 16.919 -11.691 1.00 0.00 C ATOM 1103 C GLU B 6 11.687 16.573 -11.696 1.00 0.00 C ATOM 1104 O GLU B 6 10.921 17.123 -12.486 1.00 0.00 O ATOM 1105 CB GLU B 6 13.407 18.361 -12.149 1.00 0.00 C ATOM 1106 CG GLU B 6 13.105 19.350 -11.021 1.00 0.00 C ATOM 1107 CD GLU B 6 14.363 19.651 -10.204 1.00 0.00 C ATOM 1108 OE1 GLU B 6 14.939 18.678 -9.670 1.00 0.00 O ATOM 1109 OE2 GLU B 6 14.720 20.846 -10.132 1.00 0.00 O ATOM 0 H GLU B 6 13.687 16.025 -13.517 1.00 0.00 H new ATOM 0 HA GLU B 6 13.546 16.834 -10.669 1.00 0.00 H new ATOM 0 HB2 GLU B 6 14.440 18.482 -12.477 1.00 0.00 H new ATOM 0 HB3 GLU B 6 12.772 18.579 -13.008 1.00 0.00 H new ATOM 0 HG2 GLU B 6 12.709 20.275 -11.440 1.00 0.00 H new ATOM 0 HG3 GLU B 6 12.334 18.940 -10.369 1.00 0.00 H new ATOM 1116 N LEU B 7 11.320 15.665 -10.804 1.00 0.00 N ATOM 1117 CA LEU B 7 9.935 15.239 -10.696 1.00 0.00 C ATOM 1118 C LEU B 7 9.306 15.875 -9.455 1.00 0.00 C ATOM 1119 O LEU B 7 9.988 16.553 -8.688 1.00 0.00 O ATOM 1120 CB LEU B 7 9.840 13.712 -10.720 1.00 0.00 C ATOM 1121 CG LEU B 7 11.092 12.955 -10.270 1.00 0.00 C ATOM 1122 CD1 LEU B 7 12.230 13.131 -11.277 1.00 0.00 C ATOM 1123 CD2 LEU B 7 11.506 13.372 -8.858 1.00 0.00 C ATOM 0 H LEU B 7 11.958 15.212 -10.149 1.00 0.00 H new ATOM 0 HA LEU B 7 9.362 15.584 -11.557 1.00 0.00 H new ATOM 0 HB2 LEU B 7 9.008 13.409 -10.084 1.00 0.00 H new ATOM 0 HB3 LEU B 7 9.595 13.399 -11.735 1.00 0.00 H new ATOM 0 HG LEU B 7 10.855 11.892 -10.235 1.00 0.00 H new ATOM 0 HD11 LEU B 7 13.108 12.583 -10.934 1.00 0.00 H new ATOM 0 HD12 LEU B 7 11.919 12.746 -12.248 1.00 0.00 H new ATOM 0 HD13 LEU B 7 12.475 14.189 -11.368 1.00 0.00 H new ATOM 0 HD21 LEU B 7 12.398 12.820 -8.562 1.00 0.00 H new ATOM 0 HD22 LEU B 7 11.719 14.441 -8.842 1.00 0.00 H new ATOM 0 HD23 LEU B 7 10.696 13.153 -8.162 1.00 0.00 H new ATOM 1135 N ARG B 8 8.013 15.632 -9.295 1.00 0.00 N ATOM 1136 CA ARG B 8 7.285 16.173 -8.160 1.00 0.00 C ATOM 1137 C ARG B 8 6.379 15.101 -7.551 1.00 0.00 C ATOM 1138 O ARG B 8 6.746 13.928 -7.503 1.00 0.00 O ATOM 1139 CB ARG B 8 6.434 17.375 -8.573 1.00 0.00 C ATOM 1140 CG ARG B 8 7.165 18.235 -9.607 1.00 0.00 C ATOM 1141 CD ARG B 8 6.227 19.281 -10.212 1.00 0.00 C ATOM 1142 NE ARG B 8 6.215 20.498 -9.371 1.00 0.00 N ATOM 1143 CZ ARG B 8 5.447 20.653 -8.284 1.00 0.00 C ATOM 1144 NH1 ARG B 8 4.622 19.669 -7.901 1.00 0.00 N ATOM 1145 NH2 ARG B 8 5.502 21.793 -7.581 1.00 0.00 N ATOM 0 H ARG B 8 7.451 15.068 -9.933 1.00 0.00 H new ATOM 0 HA ARG B 8 8.017 16.498 -7.421 1.00 0.00 H new ATOM 0 HB2 ARG B 8 5.487 17.029 -8.987 1.00 0.00 H new ATOM 0 HB3 ARG B 8 6.198 17.977 -7.695 1.00 0.00 H new ATOM 0 HG2 ARG B 8 8.014 18.731 -9.137 1.00 0.00 H new ATOM 0 HG3 ARG B 8 7.564 17.599 -10.397 1.00 0.00 H new ATOM 0 HD2 ARG B 8 6.551 19.531 -11.222 1.00 0.00 H new ATOM 0 HD3 ARG B 8 5.219 18.874 -10.292 1.00 0.00 H new ATOM 0 HE ARG B 8 6.830 21.268 -9.635 1.00 0.00 H new ATOM 0 HH11 ARG B 8 4.579 18.802 -8.437 1.00 0.00 H new ATOM 0 HH12 ARG B 8 4.037 19.787 -7.074 1.00 0.00 H new ATOM 0 HH21 ARG B 8 6.129 22.543 -7.873 1.00 0.00 H new ATOM 0 HH22 ARG B 8 4.917 21.911 -6.754 1.00 0.00 H new ATOM 1159 N CYS B 9 5.213 15.542 -7.103 1.00 0.00 N ATOM 1160 CA CYS B 9 4.251 14.634 -6.500 1.00 0.00 C ATOM 1161 C CYS B 9 3.561 13.852 -7.619 1.00 0.00 C ATOM 1162 O CYS B 9 3.633 14.237 -8.785 1.00 0.00 O ATOM 1163 CB CYS B 9 3.246 15.379 -5.620 1.00 0.00 C ATOM 1164 SG CYS B 9 3.989 16.357 -4.263 1.00 0.00 S ATOM 0 H CYS B 9 4.912 16.516 -7.145 1.00 0.00 H new ATOM 0 HA CYS B 9 4.768 13.939 -5.839 1.00 0.00 H new ATOM 0 HB2 CYS B 9 2.658 16.046 -6.250 1.00 0.00 H new ATOM 0 HB3 CYS B 9 2.554 14.655 -5.190 1.00 0.00 H new ATOM 1169 N GLN B 10 2.908 12.769 -7.225 1.00 0.00 N ATOM 1170 CA GLN B 10 2.205 11.930 -8.180 1.00 0.00 C ATOM 1171 C GLN B 10 0.693 12.088 -8.014 1.00 0.00 C ATOM 1172 O GLN B 10 -0.082 11.540 -8.797 1.00 0.00 O ATOM 1173 CB GLN B 10 2.622 10.465 -8.034 1.00 0.00 C ATOM 1174 CG GLN B 10 2.787 9.802 -9.403 1.00 0.00 C ATOM 1175 CD GLN B 10 1.752 8.693 -9.603 1.00 0.00 C ATOM 1176 OE1 GLN B 10 0.802 8.823 -10.357 1.00 0.00 O ATOM 1177 NE2 GLN B 10 1.989 7.597 -8.888 1.00 0.00 N ATOM 0 H GLN B 10 2.851 12.453 -6.257 1.00 0.00 H new ATOM 0 HA GLN B 10 2.476 12.253 -9.185 1.00 0.00 H new ATOM 0 HB2 GLN B 10 3.559 10.404 -7.481 1.00 0.00 H new ATOM 0 HB3 GLN B 10 1.873 9.926 -7.453 1.00 0.00 H new ATOM 0 HG2 GLN B 10 2.680 10.550 -10.189 1.00 0.00 H new ATOM 0 HG3 GLN B 10 3.791 9.388 -9.492 1.00 0.00 H new ATOM 0 HE21 GLN B 10 2.803 7.554 -8.275 1.00 0.00 H new ATOM 0 HE22 GLN B 10 1.356 6.799 -8.952 1.00 0.00 H new ATOM 1186 N CYS B 11 0.317 12.841 -6.990 1.00 0.00 N ATOM 1187 CA CYS B 11 -1.089 13.078 -6.712 1.00 0.00 C ATOM 1188 C CYS B 11 -1.239 14.506 -6.182 1.00 0.00 C ATOM 1189 O CYS B 11 -0.462 14.942 -5.335 1.00 0.00 O ATOM 1190 CB CYS B 11 -1.655 12.045 -5.735 1.00 0.00 C ATOM 1191 SG CYS B 11 -3.083 11.093 -6.368 1.00 0.00 S ATOM 0 H CYS B 11 0.962 13.295 -6.343 1.00 0.00 H new ATOM 0 HA CYS B 11 -1.667 12.968 -7.629 1.00 0.00 H new ATOM 0 HB2 CYS B 11 -0.862 11.348 -5.466 1.00 0.00 H new ATOM 0 HB3 CYS B 11 -1.954 12.556 -4.820 1.00 0.00 H new ATOM 1196 N LEU B 12 -2.244 15.194 -6.704 1.00 0.00 N ATOM 1197 CA LEU B 12 -2.506 16.563 -6.294 1.00 0.00 C ATOM 1198 C LEU B 12 -3.739 16.593 -5.389 1.00 0.00 C ATOM 1199 O LEU B 12 -3.987 17.584 -4.704 1.00 0.00 O ATOM 1200 CB LEU B 12 -2.619 17.475 -7.517 1.00 0.00 C ATOM 1201 CG LEU B 12 -1.593 17.240 -8.627 1.00 0.00 C ATOM 1202 CD1 LEU B 12 -2.173 17.602 -9.996 1.00 0.00 C ATOM 1203 CD2 LEU B 12 -0.291 17.990 -8.339 1.00 0.00 C ATOM 0 H LEU B 12 -2.886 14.829 -7.407 1.00 0.00 H new ATOM 0 HA LEU B 12 -1.672 16.952 -5.710 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -3.616 17.359 -7.941 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.533 18.509 -7.183 1.00 0.00 H new ATOM 0 HG LEU B 12 -1.353 16.177 -8.650 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -1.423 17.426 -10.767 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -3.050 16.985 -10.194 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -2.460 18.653 -10.003 1.00 0.00 H new ATOM 0 HD21 LEU B 12 0.421 17.806 -9.144 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -0.494 19.059 -8.272 1.00 0.00 H new ATOM 0 HD23 LEU B 12 0.129 17.641 -7.396 1.00 0.00 H new ATOM 1215 N GLN B 13 -4.480 15.494 -5.415 1.00 0.00 N ATOM 1216 CA GLN B 13 -5.681 15.382 -4.605 1.00 0.00 C ATOM 1217 C GLN B 13 -5.724 14.022 -3.905 1.00 0.00 C ATOM 1218 O GLN B 13 -4.981 13.111 -4.265 1.00 0.00 O ATOM 1219 CB GLN B 13 -6.936 15.602 -5.452 1.00 0.00 C ATOM 1220 CG GLN B 13 -8.137 15.951 -4.571 1.00 0.00 C ATOM 1221 CD GLN B 13 -8.995 17.039 -5.219 1.00 0.00 C ATOM 1222 OE1 GLN B 13 -8.936 17.284 -6.413 1.00 0.00 O ATOM 1223 NE2 GLN B 13 -9.793 17.678 -4.367 1.00 0.00 N ATOM 0 H GLN B 13 -4.271 14.674 -5.984 1.00 0.00 H new ATOM 0 HA GLN B 13 -5.656 16.161 -3.843 1.00 0.00 H new ATOM 0 HB2 GLN B 13 -6.760 16.405 -6.168 1.00 0.00 H new ATOM 0 HB3 GLN B 13 -7.152 14.703 -6.029 1.00 0.00 H new ATOM 0 HG2 GLN B 13 -8.741 15.059 -4.403 1.00 0.00 H new ATOM 0 HG3 GLN B 13 -7.790 16.290 -3.595 1.00 0.00 H new ATOM 0 HE21 GLN B 13 -9.793 17.423 -3.379 1.00 0.00 H new ATOM 0 HE22 GLN B 13 -10.404 18.423 -4.702 1.00 0.00 H new ATOM 1232 N THR B 14 -6.601 13.929 -2.916 1.00 0.00 N ATOM 1233 CA THR B 14 -6.751 12.696 -2.162 1.00 0.00 C ATOM 1234 C THR B 14 -8.178 12.568 -1.626 1.00 0.00 C ATOM 1235 O THR B 14 -8.930 13.541 -1.616 1.00 0.00 O ATOM 1236 CB THR B 14 -5.685 12.681 -1.065 1.00 0.00 C ATOM 1237 OG1 THR B 14 -5.631 14.032 -0.615 1.00 0.00 O ATOM 1238 CG2 THR B 14 -4.282 12.414 -1.614 1.00 0.00 C ATOM 0 H THR B 14 -7.215 14.688 -2.619 1.00 0.00 H new ATOM 0 HA THR B 14 -6.598 11.823 -2.796 1.00 0.00 H new ATOM 0 HB THR B 14 -5.936 11.920 -0.326 1.00 0.00 H new ATOM 0 HG1 THR B 14 -4.965 14.112 0.099 1.00 0.00 H new ATOM 0 HG21 THR B 14 -3.564 12.414 -0.794 1.00 0.00 H new ATOM 0 HG22 THR B 14 -4.264 11.444 -2.112 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.016 13.193 -2.328 1.00 0.00 H new ATOM 1246 N LEU B 15 -8.508 11.360 -1.193 1.00 0.00 N ATOM 1247 CA LEU B 15 -9.831 11.093 -0.657 1.00 0.00 C ATOM 1248 C LEU B 15 -9.740 10.944 0.863 1.00 0.00 C ATOM 1249 O LEU B 15 -8.735 10.463 1.384 1.00 0.00 O ATOM 1250 CB LEU B 15 -10.459 9.886 -1.356 1.00 0.00 C ATOM 1251 CG LEU B 15 -10.683 10.026 -2.863 1.00 0.00 C ATOM 1252 CD1 LEU B 15 -10.445 8.695 -3.579 1.00 0.00 C ATOM 1253 CD2 LEU B 15 -12.071 10.596 -3.161 1.00 0.00 C ATOM 0 H LEU B 15 -7.881 10.555 -1.203 1.00 0.00 H new ATOM 0 HA LEU B 15 -10.499 11.931 -0.857 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -9.822 9.019 -1.182 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -11.419 9.676 -0.884 1.00 0.00 H new ATOM 0 HG LEU B 15 -9.953 10.736 -3.252 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -10.611 8.823 -4.649 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -9.420 8.368 -3.407 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -11.135 7.945 -3.192 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -12.204 10.685 -4.239 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -12.833 9.930 -2.755 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -12.167 11.580 -2.701 1.00 0.00 H new ATOM 1265 N GLN B 16 -10.804 11.365 1.532 1.00 0.00 N ATOM 1266 CA GLN B 16 -10.856 11.285 2.982 1.00 0.00 C ATOM 1267 C GLN B 16 -10.919 9.823 3.430 1.00 0.00 C ATOM 1268 O GLN B 16 -10.743 9.524 4.611 1.00 0.00 O ATOM 1269 CB GLN B 16 -12.043 12.078 3.532 1.00 0.00 C ATOM 1270 CG GLN B 16 -12.351 11.673 4.975 1.00 0.00 C ATOM 1271 CD GLN B 16 -13.042 12.812 5.728 1.00 0.00 C ATOM 1272 OE1 GLN B 16 -14.140 13.232 5.400 1.00 0.00 O ATOM 1273 NE2 GLN B 16 -12.341 13.286 6.754 1.00 0.00 N ATOM 0 H GLN B 16 -11.636 11.762 1.097 1.00 0.00 H new ATOM 0 HA GLN B 16 -9.946 11.730 3.385 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -11.824 13.145 3.489 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -12.920 11.907 2.907 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -12.989 10.789 4.980 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -11.427 11.402 5.486 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -11.428 12.889 6.974 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -12.717 14.046 7.320 1.00 0.00 H new ATOM 1282 N GLY B 17 -11.168 8.951 2.464 1.00 0.00 N ATOM 1283 CA GLY B 17 -11.256 7.528 2.745 1.00 0.00 C ATOM 1284 C GLY B 17 -12.503 6.918 2.102 1.00 0.00 C ATOM 1285 O GLY B 17 -13.612 7.089 2.606 1.00 0.00 O ATOM 0 H GLY B 17 -11.312 9.202 1.486 1.00 0.00 H new ATOM 0 HA2 GLY B 17 -10.365 7.024 2.370 1.00 0.00 H new ATOM 0 HA3 GLY B 17 -11.283 7.368 3.823 1.00 0.00 H new ATOM 1289 N ILE B 18 -12.279 6.219 0.999 1.00 0.00 N ATOM 1290 CA ILE B 18 -13.371 5.582 0.282 1.00 0.00 C ATOM 1291 C ILE B 18 -13.695 4.240 0.942 1.00 0.00 C ATOM 1292 O ILE B 18 -12.876 3.694 1.679 1.00 0.00 O ATOM 1293 CB ILE B 18 -13.041 5.472 -1.208 1.00 0.00 C ATOM 1294 CG1 ILE B 18 -13.379 6.771 -1.942 1.00 0.00 C ATOM 1295 CG2 ILE B 18 -13.736 4.261 -1.834 1.00 0.00 C ATOM 1296 CD1 ILE B 18 -12.887 6.726 -3.390 1.00 0.00 C ATOM 0 H ILE B 18 -11.358 6.080 0.584 1.00 0.00 H new ATOM 0 HA ILE B 18 -14.273 6.192 0.341 1.00 0.00 H new ATOM 0 HB ILE B 18 -11.967 5.316 -1.310 1.00 0.00 H new ATOM 0 HG12 ILE B 18 -14.457 6.933 -1.925 1.00 0.00 H new ATOM 0 HG13 ILE B 18 -12.922 7.615 -1.425 1.00 0.00 H new ATOM 0 HG21 ILE B 18 -13.485 4.205 -2.893 1.00 0.00 H new ATOM 0 HG22 ILE B 18 -13.403 3.352 -1.334 1.00 0.00 H new ATOM 0 HG23 ILE B 18 -14.815 4.363 -1.721 1.00 0.00 H new ATOM 0 HD11 ILE B 18 -13.140 7.661 -3.889 1.00 0.00 H new ATOM 0 HD12 ILE B 18 -11.806 6.589 -3.403 1.00 0.00 H new ATOM 0 HD13 ILE B 18 -13.364 5.896 -3.911 1.00 0.00 H new ATOM 1308 N HIS B 19 -14.890 3.748 0.653 1.00 0.00 N ATOM 1309 CA HIS B 19 -15.332 2.480 1.209 1.00 0.00 C ATOM 1310 C HIS B 19 -14.288 1.401 0.918 1.00 0.00 C ATOM 1311 O HIS B 19 -13.607 1.450 -0.105 1.00 0.00 O ATOM 1312 CB HIS B 19 -16.724 2.115 0.688 1.00 0.00 C ATOM 1313 CG HIS B 19 -17.599 1.426 1.708 1.00 0.00 C ATOM 1314 ND1 HIS B 19 -18.824 0.867 1.389 1.00 0.00 N ATOM 1315 CD2 HIS B 19 -17.413 1.210 3.042 1.00 0.00 C ATOM 1316 CE1 HIS B 19 -19.344 0.342 2.489 1.00 0.00 C ATOM 1317 NE2 HIS B 19 -18.468 0.557 3.512 1.00 0.00 N ATOM 0 H HIS B 19 -15.566 4.204 0.041 1.00 0.00 H new ATOM 0 HA HIS B 19 -15.424 2.565 2.292 1.00 0.00 H new ATOM 0 HB2 HIS B 19 -17.224 3.023 0.349 1.00 0.00 H new ATOM 0 HB3 HIS B 19 -16.617 1.466 -0.182 1.00 0.00 H new ATOM 0 HD2 HIS B 19 -16.553 1.518 3.618 1.00 0.00 H new ATOM 0 HE1 HIS B 19 -20.294 -0.166 2.562 1.00 0.00 H new ATOM 0 HE2 HIS B 19 -18.602 0.264 4.480 1.00 0.00 H new ATOM 1325 N LEU B 20 -14.194 0.450 1.836 1.00 0.00 N ATOM 1326 CA LEU B 20 -13.245 -0.640 1.692 1.00 0.00 C ATOM 1327 C LEU B 20 -13.898 -1.779 0.907 1.00 0.00 C ATOM 1328 O LEU B 20 -13.378 -2.893 0.873 1.00 0.00 O ATOM 1329 CB LEU B 20 -12.705 -1.065 3.058 1.00 0.00 C ATOM 1330 CG LEU B 20 -11.527 -2.042 3.040 1.00 0.00 C ATOM 1331 CD1 LEU B 20 -10.198 -1.295 2.908 1.00 0.00 C ATOM 1332 CD2 LEU B 20 -11.553 -2.954 4.268 1.00 0.00 C ATOM 0 H LEU B 20 -14.761 0.412 2.683 1.00 0.00 H new ATOM 0 HA LEU B 20 -12.376 -0.315 1.119 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -12.401 -0.170 3.601 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -13.519 -1.519 3.623 1.00 0.00 H new ATOM 0 HG LEU B 20 -11.626 -2.681 2.163 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -9.377 -2.012 2.898 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -10.192 -0.724 1.980 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -10.077 -0.617 3.752 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -10.706 -3.638 4.231 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -11.491 -2.349 5.172 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -12.481 -3.526 4.277 1.00 0.00 H new ATOM 1344 N LYS B 21 -15.029 -1.460 0.294 1.00 0.00 N ATOM 1345 CA LYS B 21 -15.759 -2.443 -0.488 1.00 0.00 C ATOM 1346 C LYS B 21 -15.442 -2.246 -1.971 1.00 0.00 C ATOM 1347 O LYS B 21 -15.889 -3.022 -2.814 1.00 0.00 O ATOM 1348 CB LYS B 21 -17.254 -2.382 -0.166 1.00 0.00 C ATOM 1349 CG LYS B 21 -17.526 -2.852 1.265 1.00 0.00 C ATOM 1350 CD LYS B 21 -17.883 -4.340 1.294 1.00 0.00 C ATOM 1351 CE LYS B 21 -19.396 -4.538 1.405 1.00 0.00 C ATOM 1352 NZ LYS B 21 -19.712 -5.949 1.720 1.00 0.00 N ATOM 0 H LYS B 21 -15.457 -0.535 0.323 1.00 0.00 H new ATOM 0 HA LYS B 21 -15.440 -3.451 -0.224 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -17.616 -1.362 -0.292 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -17.807 -3.005 -0.869 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -16.647 -2.673 1.884 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -18.342 -2.270 1.694 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -17.515 -4.824 0.389 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -17.387 -4.820 2.137 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -19.798 -3.887 2.181 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -19.876 -4.252 0.469 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 -20.743 -6.066 1.792 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 -19.345 -6.564 0.965 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 -19.270 -6.210 2.624 1.00 0.00 H new ATOM 1366 N ASN B 22 -14.672 -1.203 -2.245 1.00 0.00 N ATOM 1367 CA ASN B 22 -14.289 -0.893 -3.613 1.00 0.00 C ATOM 1368 C ASN B 22 -12.776 -1.058 -3.764 1.00 0.00 C ATOM 1369 O ASN B 22 -12.300 -1.552 -4.785 1.00 0.00 O ATOM 1370 CB ASN B 22 -14.646 0.550 -3.971 1.00 0.00 C ATOM 1371 CG ASN B 22 -15.933 0.608 -4.798 1.00 0.00 C ATOM 1372 OD1 ASN B 22 -16.074 -0.043 -5.820 1.00 0.00 O ATOM 1373 ND2 ASN B 22 -16.860 1.422 -4.300 1.00 0.00 N ATOM 0 H ASN B 22 -14.303 -0.562 -1.543 1.00 0.00 H new ATOM 0 HA ASN B 22 -14.826 -1.572 -4.276 1.00 0.00 H new ATOM 0 HB2 ASN B 22 -14.769 1.135 -3.059 1.00 0.00 H new ATOM 0 HB3 ASN B 22 -13.828 1.002 -4.532 1.00 0.00 H new ATOM 0 HD21 ASN B 22 -17.754 1.530 -4.779 1.00 0.00 H new ATOM 0 HD22 ASN B 22 -16.677 1.938 -3.439 1.00 0.00 H new ATOM 1380 N ILE B 23 -12.061 -0.633 -2.732 1.00 0.00 N ATOM 1381 CA ILE B 23 -10.611 -0.727 -2.737 1.00 0.00 C ATOM 1382 C ILE B 23 -10.199 -2.195 -2.870 1.00 0.00 C ATOM 1383 O ILE B 23 -10.687 -3.049 -2.132 1.00 0.00 O ATOM 1384 CB ILE B 23 -10.025 -0.034 -1.505 1.00 0.00 C ATOM 1385 CG1 ILE B 23 -9.671 1.423 -1.813 1.00 0.00 C ATOM 1386 CG2 ILE B 23 -8.827 -0.811 -0.956 1.00 0.00 C ATOM 1387 CD1 ILE B 23 -10.502 2.382 -0.959 1.00 0.00 C ATOM 0 H ILE B 23 -12.459 -0.223 -1.887 1.00 0.00 H new ATOM 0 HA ILE B 23 -10.199 -0.200 -3.598 1.00 0.00 H new ATOM 0 HB ILE B 23 -10.786 -0.023 -0.725 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -8.610 1.590 -1.626 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -9.845 1.628 -2.869 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -8.430 -0.297 -0.081 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -9.143 -1.815 -0.674 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -8.053 -0.875 -1.721 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -10.231 3.410 -1.198 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -11.561 2.229 -1.166 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -10.307 2.191 0.096 1.00 0.00 H new ATOM 1399 N GLN B 24 -9.306 -2.443 -3.816 1.00 0.00 N ATOM 1400 CA GLN B 24 -8.823 -3.792 -4.055 1.00 0.00 C ATOM 1401 C GLN B 24 -7.348 -3.905 -3.665 1.00 0.00 C ATOM 1402 O GLN B 24 -6.868 -4.993 -3.348 1.00 0.00 O ATOM 1403 CB GLN B 24 -9.038 -4.201 -5.514 1.00 0.00 C ATOM 1404 CG GLN B 24 -9.659 -5.595 -5.607 1.00 0.00 C ATOM 1405 CD GLN B 24 -8.683 -6.590 -6.239 1.00 0.00 C ATOM 1406 OE1 GLN B 24 -8.939 -7.176 -7.278 1.00 0.00 O ATOM 1407 NE2 GLN B 24 -7.552 -6.746 -5.557 1.00 0.00 N ATOM 0 H GLN B 24 -8.904 -1.732 -4.427 1.00 0.00 H new ATOM 0 HA GLN B 24 -9.396 -4.478 -3.432 1.00 0.00 H new ATOM 0 HB2 GLN B 24 -9.687 -3.477 -6.007 1.00 0.00 H new ATOM 0 HB3 GLN B 24 -8.085 -4.187 -6.043 1.00 0.00 H new ATOM 0 HG2 GLN B 24 -9.940 -5.939 -4.612 1.00 0.00 H new ATOM 0 HG3 GLN B 24 -10.573 -5.551 -6.199 1.00 0.00 H new ATOM 0 HE21 GLN B 24 -7.401 -6.224 -4.694 1.00 0.00 H new ATOM 0 HE22 GLN B 24 -6.836 -7.387 -5.897 1.00 0.00 H new ATOM 1416 N SER B 25 -6.671 -2.768 -3.701 1.00 0.00 N ATOM 1417 CA SER B 25 -5.260 -2.725 -3.355 1.00 0.00 C ATOM 1418 C SER B 25 -4.893 -1.339 -2.822 1.00 0.00 C ATOM 1419 O SER B 25 -5.635 -0.378 -3.019 1.00 0.00 O ATOM 1420 CB SER B 25 -4.386 -3.078 -4.561 1.00 0.00 C ATOM 1421 OG SER B 25 -5.163 -3.510 -5.675 1.00 0.00 O ATOM 0 H SER B 25 -7.073 -1.868 -3.965 1.00 0.00 H new ATOM 0 HA SER B 25 -5.076 -3.466 -2.577 1.00 0.00 H new ATOM 0 HB2 SER B 25 -3.794 -2.208 -4.847 1.00 0.00 H new ATOM 0 HB3 SER B 25 -3.684 -3.864 -4.282 1.00 0.00 H new ATOM 0 HG SER B 25 -4.569 -3.724 -6.425 1.00 0.00 H new ATOM 1427 N VAL B 26 -3.749 -1.280 -2.156 1.00 0.00 N ATOM 1428 CA VAL B 26 -3.275 -0.028 -1.592 1.00 0.00 C ATOM 1429 C VAL B 26 -1.833 0.216 -2.042 1.00 0.00 C ATOM 1430 O VAL B 26 -1.027 -0.712 -2.082 1.00 0.00 O ATOM 1431 CB VAL B 26 -3.432 -0.046 -0.070 1.00 0.00 C ATOM 1432 CG1 VAL B 26 -2.754 1.169 0.565 1.00 0.00 C ATOM 1433 CG2 VAL B 26 -4.907 -0.122 0.328 1.00 0.00 C ATOM 0 H VAL B 26 -3.136 -2.079 -1.994 1.00 0.00 H new ATOM 0 HA VAL B 26 -3.875 0.806 -1.957 1.00 0.00 H new ATOM 0 HB VAL B 26 -2.937 -0.941 0.308 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -2.880 1.132 1.647 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -1.691 1.160 0.323 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -3.207 2.082 0.178 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -4.990 -0.133 1.415 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -5.436 0.745 -0.067 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -5.347 -1.032 -0.079 1.00 0.00 H new ATOM 1443 N LYS B 27 -1.552 1.468 -2.369 1.00 0.00 N ATOM 1444 CA LYS B 27 -0.222 1.845 -2.815 1.00 0.00 C ATOM 1445 C LYS B 27 0.236 3.086 -2.046 1.00 0.00 C ATOM 1446 O LYS B 27 -0.409 4.132 -2.108 1.00 0.00 O ATOM 1447 CB LYS B 27 -0.194 2.018 -4.335 1.00 0.00 C ATOM 1448 CG LYS B 27 1.198 2.434 -4.814 1.00 0.00 C ATOM 1449 CD LYS B 27 2.288 1.662 -4.068 1.00 0.00 C ATOM 1450 CE LYS B 27 3.561 1.559 -4.911 1.00 0.00 C ATOM 1451 NZ LYS B 27 3.352 0.647 -6.057 1.00 0.00 N ATOM 0 H LYS B 27 -2.223 2.235 -2.334 1.00 0.00 H new ATOM 0 HA LYS B 27 0.492 1.051 -2.596 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -0.484 1.084 -4.816 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -0.925 2.770 -4.632 1.00 0.00 H new ATOM 0 HG2 LYS B 27 1.287 2.253 -5.885 1.00 0.00 H new ATOM 0 HG3 LYS B 27 1.335 3.504 -4.660 1.00 0.00 H new ATOM 0 HD2 LYS B 27 2.511 2.161 -3.125 1.00 0.00 H new ATOM 0 HD3 LYS B 27 1.928 0.663 -3.823 1.00 0.00 H new ATOM 0 HE2 LYS B 27 3.846 2.547 -5.272 1.00 0.00 H new ATOM 0 HE3 LYS B 27 4.384 1.196 -4.295 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 3.940 -0.202 -5.937 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 2.350 0.371 -6.103 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 3.618 1.131 -6.938 1.00 0.00 H new ATOM 1465 N VAL B 28 1.346 2.930 -1.340 1.00 0.00 N ATOM 1466 CA VAL B 28 1.898 4.025 -0.560 1.00 0.00 C ATOM 1467 C VAL B 28 3.214 4.483 -1.192 1.00 0.00 C ATOM 1468 O VAL B 28 4.191 3.736 -1.211 1.00 0.00 O ATOM 1469 CB VAL B 28 2.053 3.600 0.901 1.00 0.00 C ATOM 1470 CG1 VAL B 28 3.027 4.521 1.639 1.00 0.00 C ATOM 1471 CG2 VAL B 28 0.696 3.559 1.607 1.00 0.00 C ATOM 0 H VAL B 28 1.879 2.061 -1.292 1.00 0.00 H new ATOM 0 HA VAL B 28 1.220 4.878 -0.566 1.00 0.00 H new ATOM 0 HB VAL B 28 2.468 2.592 0.915 1.00 0.00 H new ATOM 0 HG11 VAL B 28 3.119 4.197 2.676 1.00 0.00 H new ATOM 0 HG12 VAL B 28 4.004 4.479 1.157 1.00 0.00 H new ATOM 0 HG13 VAL B 28 2.653 5.544 1.611 1.00 0.00 H new ATOM 0 HG21 VAL B 28 0.835 3.254 2.644 1.00 0.00 H new ATOM 0 HG22 VAL B 28 0.241 4.549 1.578 1.00 0.00 H new ATOM 0 HG23 VAL B 28 0.045 2.845 1.103 1.00 0.00 H new ATOM 1481 N LYS B 29 3.196 5.709 -1.696 1.00 0.00 N ATOM 1482 CA LYS B 29 4.376 6.275 -2.327 1.00 0.00 C ATOM 1483 C LYS B 29 4.882 7.451 -1.489 1.00 0.00 C ATOM 1484 O LYS B 29 4.627 8.608 -1.819 1.00 0.00 O ATOM 1485 CB LYS B 29 4.081 6.640 -3.783 1.00 0.00 C ATOM 1486 CG LYS B 29 5.370 6.694 -4.607 1.00 0.00 C ATOM 1487 CD LYS B 29 6.169 7.960 -4.291 1.00 0.00 C ATOM 1488 CE LYS B 29 6.964 8.425 -5.513 1.00 0.00 C ATOM 1489 NZ LYS B 29 6.616 9.822 -5.856 1.00 0.00 N ATOM 0 H LYS B 29 2.383 6.325 -1.680 1.00 0.00 H new ATOM 0 HA LYS B 29 5.179 5.539 -2.363 1.00 0.00 H new ATOM 0 HB2 LYS B 29 3.400 5.907 -4.215 1.00 0.00 H new ATOM 0 HB3 LYS B 29 3.578 7.606 -3.825 1.00 0.00 H new ATOM 0 HG2 LYS B 29 5.978 5.814 -4.397 1.00 0.00 H new ATOM 0 HG3 LYS B 29 5.128 6.668 -5.670 1.00 0.00 H new ATOM 0 HD2 LYS B 29 5.492 8.752 -3.971 1.00 0.00 H new ATOM 0 HD3 LYS B 29 6.849 7.768 -3.462 1.00 0.00 H new ATOM 0 HE2 LYS B 29 8.032 8.349 -5.310 1.00 0.00 H new ATOM 0 HE3 LYS B 29 6.754 7.773 -6.361 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 7.164 10.122 -6.687 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 5.600 9.884 -6.070 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 6.839 10.443 -5.052 1.00 0.00 H new ATOM 1503 N SER B 30 5.591 7.114 -0.422 1.00 0.00 N ATOM 1504 CA SER B 30 6.135 8.127 0.466 1.00 0.00 C ATOM 1505 C SER B 30 6.765 9.256 -0.353 1.00 0.00 C ATOM 1506 O SER B 30 6.934 9.129 -1.565 1.00 0.00 O ATOM 1507 CB SER B 30 7.167 7.525 1.422 1.00 0.00 C ATOM 1508 OG SER B 30 8.477 8.033 1.181 1.00 0.00 O ATOM 0 H SER B 30 5.801 6.153 -0.152 1.00 0.00 H new ATOM 0 HA SER B 30 5.319 8.532 1.064 1.00 0.00 H new ATOM 0 HB2 SER B 30 6.878 7.741 2.451 1.00 0.00 H new ATOM 0 HB3 SER B 30 7.173 6.440 1.313 1.00 0.00 H new ATOM 0 HG SER B 30 9.107 7.626 1.812 1.00 0.00 H new ATOM 1514 N PRO B 31 7.104 10.363 0.360 1.00 0.00 N ATOM 1515 CA PRO B 31 7.712 11.514 -0.287 1.00 0.00 C ATOM 1516 C PRO B 31 9.179 11.241 -0.626 1.00 0.00 C ATOM 1517 O PRO B 31 9.708 10.180 -0.299 1.00 0.00 O ATOM 1518 CB PRO B 31 7.533 12.658 0.696 1.00 0.00 C ATOM 1519 CG PRO B 31 7.251 12.011 2.043 1.00 0.00 C ATOM 1520 CD PRO B 31 6.919 10.549 1.797 1.00 0.00 C ATOM 0 HA PRO B 31 7.248 11.753 -1.244 1.00 0.00 H new ATOM 0 HB2 PRO B 31 8.428 13.278 0.741 1.00 0.00 H new ATOM 0 HB3 PRO B 31 6.711 13.307 0.395 1.00 0.00 H new ATOM 0 HG2 PRO B 31 8.117 12.101 2.698 1.00 0.00 H new ATOM 0 HG3 PRO B 31 6.421 12.512 2.541 1.00 0.00 H new ATOM 0 HD2 PRO B 31 7.575 9.892 2.369 1.00 0.00 H new ATOM 0 HD3 PRO B 31 5.897 10.319 2.098 1.00 0.00 H new ATOM 1528 N GLY B 32 9.793 12.217 -1.278 1.00 0.00 N ATOM 1529 CA GLY B 32 11.189 12.095 -1.665 1.00 0.00 C ATOM 1530 C GLY B 32 11.846 13.471 -1.786 1.00 0.00 C ATOM 1531 O GLY B 32 11.369 14.444 -1.205 1.00 0.00 O ATOM 0 H GLY B 32 9.350 13.095 -1.548 1.00 0.00 H new ATOM 0 HA2 GLY B 32 11.724 11.496 -0.928 1.00 0.00 H new ATOM 0 HA3 GLY B 32 11.262 11.568 -2.617 1.00 0.00 H new ATOM 1535 N PRO B 33 12.960 13.510 -2.566 1.00 0.00 N ATOM 1536 CA PRO B 33 13.687 14.750 -2.771 1.00 0.00 C ATOM 1537 C PRO B 33 12.938 15.672 -3.736 1.00 0.00 C ATOM 1538 O PRO B 33 13.413 16.762 -4.054 1.00 0.00 O ATOM 1539 CB PRO B 33 15.050 14.325 -3.294 1.00 0.00 C ATOM 1540 CG PRO B 33 14.877 12.903 -3.801 1.00 0.00 C ATOM 1541 CD PRO B 33 13.553 12.377 -3.271 1.00 0.00 C ATOM 0 HA PRO B 33 13.790 15.333 -1.856 1.00 0.00 H new ATOM 0 HB2 PRO B 33 15.385 14.986 -4.093 1.00 0.00 H new ATOM 0 HB3 PRO B 33 15.802 14.370 -2.506 1.00 0.00 H new ATOM 0 HG2 PRO B 33 14.887 12.882 -4.891 1.00 0.00 H new ATOM 0 HG3 PRO B 33 15.701 12.274 -3.463 1.00 0.00 H new ATOM 0 HD2 PRO B 33 12.910 12.034 -4.082 1.00 0.00 H new ATOM 0 HD3 PRO B 33 13.703 11.529 -2.603 1.00 0.00 H new ATOM 1549 N HIS B 34 11.780 15.202 -4.173 1.00 0.00 N ATOM 1550 CA HIS B 34 10.960 15.971 -5.095 1.00 0.00 C ATOM 1551 C HIS B 34 9.656 16.377 -4.406 1.00 0.00 C ATOM 1552 O HIS B 34 9.301 17.555 -4.386 1.00 0.00 O ATOM 1553 CB HIS B 34 10.728 15.195 -6.393 1.00 0.00 C ATOM 1554 CG HIS B 34 10.652 13.698 -6.208 1.00 0.00 C ATOM 1555 ND1 HIS B 34 11.732 12.939 -5.791 1.00 0.00 N ATOM 1556 CD2 HIS B 34 9.616 12.829 -6.387 1.00 0.00 C ATOM 1557 CE1 HIS B 34 11.351 11.671 -5.726 1.00 0.00 C ATOM 1558 NE2 HIS B 34 10.040 11.605 -6.096 1.00 0.00 N ATOM 0 H HIS B 34 11.389 14.298 -3.906 1.00 0.00 H new ATOM 0 HA HIS B 34 11.482 16.886 -5.375 1.00 0.00 H new ATOM 0 HB2 HIS B 34 9.802 15.542 -6.851 1.00 0.00 H new ATOM 0 HB3 HIS B 34 11.534 15.424 -7.090 1.00 0.00 H new ATOM 0 HD2 HIS B 34 8.620 13.092 -6.711 1.00 0.00 H new ATOM 0 HE1 HIS B 34 11.970 10.837 -5.432 1.00 0.00 H new ATOM 0 HE2 HIS B 34 9.478 10.755 -6.142 1.00 0.00 H new ATOM 1566 N CYS B 35 8.978 15.380 -3.857 1.00 0.00 N ATOM 1567 CA CYS B 35 7.721 15.618 -3.169 1.00 0.00 C ATOM 1568 C CYS B 35 7.933 15.352 -1.677 1.00 0.00 C ATOM 1569 O CYS B 35 8.308 14.247 -1.287 1.00 0.00 O ATOM 1570 CB CYS B 35 6.589 14.766 -3.746 1.00 0.00 C ATOM 1571 SG CYS B 35 4.941 15.084 -3.018 1.00 0.00 S ATOM 0 H CYS B 35 9.276 14.405 -3.875 1.00 0.00 H new ATOM 0 HA CYS B 35 7.415 16.654 -3.313 1.00 0.00 H new ATOM 0 HB2 CYS B 35 6.535 14.939 -4.821 1.00 0.00 H new ATOM 0 HB3 CYS B 35 6.836 13.714 -3.604 1.00 0.00 H new ATOM 1576 N ALA B 36 7.682 16.383 -0.883 1.00 0.00 N ATOM 1577 CA ALA B 36 7.841 16.274 0.557 1.00 0.00 C ATOM 1578 C ALA B 36 6.491 15.926 1.189 1.00 0.00 C ATOM 1579 O ALA B 36 6.260 16.210 2.363 1.00 0.00 O ATOM 1580 CB ALA B 36 8.423 17.578 1.107 1.00 0.00 C ATOM 0 H ALA B 36 7.370 17.297 -1.210 1.00 0.00 H new ATOM 0 HA ALA B 36 8.539 15.475 0.807 1.00 0.00 H new ATOM 0 HB1 ALA B 36 8.542 17.496 2.187 1.00 0.00 H new ATOM 0 HB2 ALA B 36 9.394 17.765 0.648 1.00 0.00 H new ATOM 0 HB3 ALA B 36 7.748 18.403 0.878 1.00 0.00 H new ATOM 1586 N GLN B 37 5.636 15.315 0.382 1.00 0.00 N ATOM 1587 CA GLN B 37 4.316 14.925 0.848 1.00 0.00 C ATOM 1588 C GLN B 37 4.009 13.487 0.428 1.00 0.00 C ATOM 1589 O GLN B 37 4.532 13.004 -0.575 1.00 0.00 O ATOM 1590 CB GLN B 37 3.245 15.888 0.330 1.00 0.00 C ATOM 1591 CG GLN B 37 3.770 17.325 0.295 1.00 0.00 C ATOM 1592 CD GLN B 37 3.977 17.867 1.711 1.00 0.00 C ATOM 1593 OE1 GLN B 37 3.403 17.390 2.677 1.00 0.00 O ATOM 1594 NE2 GLN B 37 4.825 18.889 1.781 1.00 0.00 N ATOM 0 H GLN B 37 5.831 15.081 -0.591 1.00 0.00 H new ATOM 0 HA GLN B 37 4.307 14.975 1.937 1.00 0.00 H new ATOM 0 HB2 GLN B 37 2.933 15.587 -0.670 1.00 0.00 H new ATOM 0 HB3 GLN B 37 2.363 15.835 0.969 1.00 0.00 H new ATOM 0 HG2 GLN B 37 4.712 17.359 -0.253 1.00 0.00 H new ATOM 0 HG3 GLN B 37 3.066 17.960 -0.242 1.00 0.00 H new ATOM 0 HE21 GLN B 37 5.272 19.240 0.934 1.00 0.00 H new ATOM 0 HE22 GLN B 37 5.029 19.322 2.682 1.00 0.00 H new ATOM 1603 N THR B 38 3.162 12.842 1.217 1.00 0.00 N ATOM 1604 CA THR B 38 2.778 11.468 0.939 1.00 0.00 C ATOM 1605 C THR B 38 1.763 11.418 -0.204 1.00 0.00 C ATOM 1606 O THR B 38 1.106 12.415 -0.500 1.00 0.00 O ATOM 1607 CB THR B 38 2.261 10.850 2.239 1.00 0.00 C ATOM 1608 OG1 THR B 38 3.215 11.251 3.219 1.00 0.00 O ATOM 1609 CG2 THR B 38 2.348 9.322 2.237 1.00 0.00 C ATOM 0 H THR B 38 2.731 13.245 2.049 1.00 0.00 H new ATOM 0 HA THR B 38 3.631 10.880 0.599 1.00 0.00 H new ATOM 0 HB THR B 38 1.226 11.154 2.398 1.00 0.00 H new ATOM 0 HG1 THR B 38 2.955 10.894 4.094 1.00 0.00 H new ATOM 0 HG21 THR B 38 1.968 8.935 3.183 1.00 0.00 H new ATOM 0 HG22 THR B 38 1.751 8.925 1.416 1.00 0.00 H new ATOM 0 HG23 THR B 38 3.387 9.017 2.111 1.00 0.00 H new ATOM 1617 N GLU B 39 1.666 10.247 -0.816 1.00 0.00 N ATOM 1618 CA GLU B 39 0.741 10.054 -1.920 1.00 0.00 C ATOM 1619 C GLU B 39 0.192 8.626 -1.909 1.00 0.00 C ATOM 1620 O GLU B 39 0.696 7.757 -2.618 1.00 0.00 O ATOM 1621 CB GLU B 39 1.411 10.373 -3.258 1.00 0.00 C ATOM 1622 CG GLU B 39 1.015 11.767 -3.750 1.00 0.00 C ATOM 1623 CD GLU B 39 1.788 12.853 -2.999 1.00 0.00 C ATOM 1624 OE1 GLU B 39 2.966 12.591 -2.676 1.00 0.00 O ATOM 1625 OE2 GLU B 39 1.181 13.921 -2.764 1.00 0.00 O ATOM 0 H GLU B 39 2.213 9.422 -0.568 1.00 0.00 H new ATOM 0 HA GLU B 39 -0.093 10.744 -1.795 1.00 0.00 H new ATOM 0 HB2 GLU B 39 2.494 10.316 -3.149 1.00 0.00 H new ATOM 0 HB3 GLU B 39 1.125 9.627 -3.999 1.00 0.00 H new ATOM 0 HG2 GLU B 39 1.212 11.849 -4.819 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -0.056 11.915 -3.611 1.00 0.00 H new ATOM 1632 N VAL B 40 -0.835 8.427 -1.096 1.00 0.00 N ATOM 1633 CA VAL B 40 -1.459 7.120 -0.983 1.00 0.00 C ATOM 1634 C VAL B 40 -2.364 6.885 -2.193 1.00 0.00 C ATOM 1635 O VAL B 40 -3.210 7.720 -2.511 1.00 0.00 O ATOM 1636 CB VAL B 40 -2.201 7.007 0.350 1.00 0.00 C ATOM 1637 CG1 VAL B 40 -2.834 5.623 0.510 1.00 0.00 C ATOM 1638 CG2 VAL B 40 -1.272 7.324 1.524 1.00 0.00 C ATOM 0 H VAL B 40 -1.251 9.150 -0.509 1.00 0.00 H new ATOM 0 HA VAL B 40 -0.703 6.335 -0.986 1.00 0.00 H new ATOM 0 HB VAL B 40 -3.004 7.744 0.350 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -3.355 5.570 1.466 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -3.543 5.451 -0.300 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -2.055 4.861 0.478 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -1.825 7.236 2.459 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -0.438 6.622 1.528 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -0.890 8.340 1.422 1.00 0.00 H new ATOM 1648 N ILE B 41 -2.157 5.745 -2.835 1.00 0.00 N ATOM 1649 CA ILE B 41 -2.944 5.390 -4.004 1.00 0.00 C ATOM 1650 C ILE B 41 -3.599 4.026 -3.777 1.00 0.00 C ATOM 1651 O ILE B 41 -2.919 3.000 -3.774 1.00 0.00 O ATOM 1652 CB ILE B 41 -2.086 5.458 -5.269 1.00 0.00 C ATOM 1653 CG1 ILE B 41 -1.231 6.727 -5.284 1.00 0.00 C ATOM 1654 CG2 ILE B 41 -2.951 5.334 -6.525 1.00 0.00 C ATOM 1655 CD1 ILE B 41 0.258 6.383 -5.355 1.00 0.00 C ATOM 0 H ILE B 41 -1.455 5.055 -2.568 1.00 0.00 H new ATOM 0 HA ILE B 41 -3.749 6.110 -4.154 1.00 0.00 H new ATOM 0 HB ILE B 41 -1.402 4.609 -5.264 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -1.506 7.345 -6.138 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -1.430 7.315 -4.388 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -2.317 5.385 -7.410 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -3.478 4.380 -6.511 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -3.675 6.148 -6.550 1.00 0.00 H new ATOM 0 HD11 ILE B 41 0.844 7.302 -5.364 1.00 0.00 H new ATOM 0 HD12 ILE B 41 0.535 5.785 -4.487 1.00 0.00 H new ATOM 0 HD13 ILE B 41 0.458 5.816 -6.264 1.00 0.00 H new ATOM 1667 N ALA B 42 -4.910 4.058 -3.593 1.00 0.00 N ATOM 1668 CA ALA B 42 -5.664 2.837 -3.367 1.00 0.00 C ATOM 1669 C ALA B 42 -6.275 2.367 -4.688 1.00 0.00 C ATOM 1670 O ALA B 42 -6.939 3.138 -5.379 1.00 0.00 O ATOM 1671 CB ALA B 42 -6.723 3.083 -2.290 1.00 0.00 C ATOM 0 H ALA B 42 -5.470 4.911 -3.596 1.00 0.00 H new ATOM 0 HA ALA B 42 -5.009 2.044 -3.006 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -7.289 2.167 -2.120 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -6.236 3.386 -1.363 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -7.400 3.872 -2.619 1.00 0.00 H new ATOM 1677 N THR B 43 -6.029 1.103 -5.001 1.00 0.00 N ATOM 1678 CA THR B 43 -6.547 0.520 -6.227 1.00 0.00 C ATOM 1679 C THR B 43 -8.017 0.135 -6.056 1.00 0.00 C ATOM 1680 O THR B 43 -8.416 -0.353 -4.999 1.00 0.00 O ATOM 1681 CB THR B 43 -5.650 -0.660 -6.606 1.00 0.00 C ATOM 1682 OG1 THR B 43 -4.427 -0.050 -7.011 1.00 0.00 O ATOM 1683 CG2 THR B 43 -6.137 -1.387 -7.860 1.00 0.00 C ATOM 0 H THR B 43 -5.477 0.466 -4.426 1.00 0.00 H new ATOM 0 HA THR B 43 -6.526 1.239 -7.046 1.00 0.00 H new ATOM 0 HB THR B 43 -5.605 -1.363 -5.774 1.00 0.00 H new ATOM 0 HG1 THR B 43 -3.786 -0.744 -7.272 1.00 0.00 H new ATOM 0 HG21 THR B 43 -5.465 -2.215 -8.084 1.00 0.00 H new ATOM 0 HG22 THR B 43 -7.143 -1.771 -7.690 1.00 0.00 H new ATOM 0 HG23 THR B 43 -6.151 -0.693 -8.701 1.00 0.00 H new ATOM 1691 N LEU B 44 -8.784 0.369 -7.110 1.00 0.00 N ATOM 1692 CA LEU B 44 -10.202 0.053 -7.090 1.00 0.00 C ATOM 1693 C LEU B 44 -10.411 -1.370 -7.614 1.00 0.00 C ATOM 1694 O LEU B 44 -9.628 -1.855 -8.429 1.00 0.00 O ATOM 1695 CB LEU B 44 -10.999 1.112 -7.853 1.00 0.00 C ATOM 1696 CG LEU B 44 -12.228 1.674 -7.136 1.00 0.00 C ATOM 1697 CD1 LEU B 44 -12.717 2.958 -7.810 1.00 0.00 C ATOM 1698 CD2 LEU B 44 -13.334 0.622 -7.037 1.00 0.00 C ATOM 0 H LEU B 44 -8.450 0.774 -7.984 1.00 0.00 H new ATOM 0 HA LEU B 44 -10.582 0.076 -6.069 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -10.331 1.940 -8.089 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.322 0.682 -8.801 1.00 0.00 H new ATOM 0 HG LEU B 44 -11.939 1.935 -6.118 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -13.591 3.337 -7.281 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -11.925 3.707 -7.785 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -12.983 2.747 -8.846 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -14.196 1.048 -6.523 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -13.628 0.307 -8.038 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -12.968 -0.240 -6.479 1.00 0.00 H new ATOM 1710 N LYS B 45 -11.470 -1.997 -7.124 1.00 0.00 N ATOM 1711 CA LYS B 45 -11.791 -3.354 -7.532 1.00 0.00 C ATOM 1712 C LYS B 45 -12.356 -3.334 -8.954 1.00 0.00 C ATOM 1713 O LYS B 45 -12.608 -4.385 -9.540 1.00 0.00 O ATOM 1714 CB LYS B 45 -12.719 -4.016 -6.511 1.00 0.00 C ATOM 1715 CG LYS B 45 -12.929 -5.495 -6.840 1.00 0.00 C ATOM 1716 CD LYS B 45 -14.244 -5.708 -7.593 1.00 0.00 C ATOM 1717 CE LYS B 45 -15.055 -6.845 -6.969 1.00 0.00 C ATOM 1718 NZ LYS B 45 -15.832 -6.353 -5.810 1.00 0.00 N ATOM 0 H LYS B 45 -12.117 -1.590 -6.448 1.00 0.00 H new ATOM 0 HA LYS B 45 -10.891 -3.968 -7.554 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -12.295 -3.919 -5.512 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -13.680 -3.502 -6.501 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -12.097 -5.859 -7.443 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -12.934 -6.079 -5.920 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -14.829 -4.788 -7.578 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -14.036 -5.936 -8.638 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -15.730 -7.269 -7.713 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -14.386 -7.645 -6.652 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -16.376 -7.138 -5.399 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -15.182 -5.970 -5.094 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -16.484 -5.605 -6.121 1.00 0.00 H new ATOM 1732 N ASN B 46 -12.537 -2.126 -9.467 1.00 0.00 N ATOM 1733 CA ASN B 46 -13.067 -1.955 -10.809 1.00 0.00 C ATOM 1734 C ASN B 46 -11.911 -1.725 -11.784 1.00 0.00 C ATOM 1735 O ASN B 46 -12.111 -1.712 -12.998 1.00 0.00 O ATOM 1736 CB ASN B 46 -13.997 -0.742 -10.884 1.00 0.00 C ATOM 1737 CG ASN B 46 -13.802 0.018 -12.197 1.00 0.00 C ATOM 1738 OD1 ASN B 46 -14.074 -0.478 -13.278 1.00 0.00 O ATOM 1739 ND2 ASN B 46 -13.317 1.247 -12.044 1.00 0.00 N ATOM 0 H ASN B 46 -12.326 -1.256 -8.978 1.00 0.00 H new ATOM 0 HA ASN B 46 -13.626 -2.854 -11.068 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -15.034 -1.068 -10.799 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -13.802 -0.077 -10.042 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -13.151 1.835 -12.861 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -13.111 1.601 -11.110 1.00 0.00 H new ATOM 1746 N GLY B 47 -10.727 -1.549 -11.217 1.00 0.00 N ATOM 1747 CA GLY B 47 -9.538 -1.321 -12.021 1.00 0.00 C ATOM 1748 C GLY B 47 -9.070 0.131 -11.907 1.00 0.00 C ATOM 1749 O GLY B 47 -7.984 0.475 -12.371 1.00 0.00 O ATOM 0 H GLY B 47 -10.565 -1.560 -10.210 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -8.741 -1.990 -11.696 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -9.749 -1.558 -13.064 1.00 0.00 H new ATOM 1753 N GLN B 48 -9.913 0.944 -11.287 1.00 0.00 N ATOM 1754 CA GLN B 48 -9.599 2.351 -11.106 1.00 0.00 C ATOM 1755 C GLN B 48 -8.731 2.546 -9.860 1.00 0.00 C ATOM 1756 O GLN B 48 -8.326 1.574 -9.224 1.00 0.00 O ATOM 1757 CB GLN B 48 -10.874 3.192 -11.022 1.00 0.00 C ATOM 1758 CG GLN B 48 -11.398 3.534 -12.418 1.00 0.00 C ATOM 1759 CD GLN B 48 -12.814 4.110 -12.346 1.00 0.00 C ATOM 1760 OE1 GLN B 48 -13.499 4.019 -11.341 1.00 0.00 O ATOM 1761 NE2 GLN B 48 -13.213 4.705 -13.466 1.00 0.00 N ATOM 0 H GLN B 48 -10.813 0.655 -10.904 1.00 0.00 H new ATOM 0 HA GLN B 48 -9.035 2.691 -11.975 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -11.637 2.647 -10.467 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -10.673 4.110 -10.470 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -10.732 4.254 -12.894 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -11.397 2.639 -13.040 1.00 0.00 H new ATOM 0 HE21 GLN B 48 -12.589 4.746 -14.272 1.00 0.00 H new ATOM 0 HE22 GLN B 48 -14.143 5.120 -13.519 1.00 0.00 H new ATOM 1770 N LYS B 49 -8.472 3.807 -9.550 1.00 0.00 N ATOM 1771 CA LYS B 49 -7.660 4.141 -8.392 1.00 0.00 C ATOM 1772 C LYS B 49 -8.209 5.411 -7.739 1.00 0.00 C ATOM 1773 O LYS B 49 -8.682 6.314 -8.428 1.00 0.00 O ATOM 1774 CB LYS B 49 -6.184 4.240 -8.783 1.00 0.00 C ATOM 1775 CG LYS B 49 -5.710 2.953 -9.462 1.00 0.00 C ATOM 1776 CD LYS B 49 -5.924 3.021 -10.975 1.00 0.00 C ATOM 1777 CE LYS B 49 -5.725 1.647 -11.619 1.00 0.00 C ATOM 1778 NZ LYS B 49 -4.288 1.299 -11.662 1.00 0.00 N ATOM 0 H LYS B 49 -8.810 4.610 -10.080 1.00 0.00 H new ATOM 0 HA LYS B 49 -7.716 3.348 -7.646 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -6.038 5.085 -9.455 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -5.581 4.431 -7.895 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -4.654 2.792 -9.247 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -6.252 2.101 -9.052 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -6.929 3.384 -11.188 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -5.228 3.736 -11.413 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -6.272 0.892 -11.055 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -6.135 1.649 -12.629 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -4.170 0.364 -12.102 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -3.775 2.011 -12.220 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -3.907 1.277 -10.695 1.00 0.00 H new ATOM 1792 N ALA B 50 -8.128 5.440 -6.416 1.00 0.00 N ATOM 1793 CA ALA B 50 -8.611 6.585 -5.662 1.00 0.00 C ATOM 1794 C ALA B 50 -7.565 6.981 -4.619 1.00 0.00 C ATOM 1795 O ALA B 50 -7.328 6.246 -3.661 1.00 0.00 O ATOM 1796 CB ALA B 50 -9.964 6.247 -5.032 1.00 0.00 C ATOM 0 H ALA B 50 -7.735 4.690 -5.848 1.00 0.00 H new ATOM 0 HA ALA B 50 -8.762 7.442 -6.319 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -10.327 7.105 -4.466 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -10.679 6.001 -5.817 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -9.851 5.394 -4.363 1.00 0.00 H new ATOM 1802 N CYS B 51 -6.966 8.142 -4.840 1.00 0.00 N ATOM 1803 CA CYS B 51 -5.950 8.645 -3.931 1.00 0.00 C ATOM 1804 C CYS B 51 -6.599 8.873 -2.564 1.00 0.00 C ATOM 1805 O CYS B 51 -7.716 9.381 -2.480 1.00 0.00 O ATOM 1806 CB CYS B 51 -5.290 9.917 -4.468 1.00 0.00 C ATOM 1807 SG CYS B 51 -3.604 9.681 -5.140 1.00 0.00 S ATOM 0 H CYS B 51 -7.165 8.749 -5.635 1.00 0.00 H new ATOM 0 HA CYS B 51 -5.149 7.912 -3.835 1.00 0.00 H new ATOM 0 HB2 CYS B 51 -5.923 10.335 -5.251 1.00 0.00 H new ATOM 0 HB3 CYS B 51 -5.246 10.654 -3.666 1.00 0.00 H new ATOM 1812 N LEU B 52 -5.871 8.485 -1.527 1.00 0.00 N ATOM 1813 CA LEU B 52 -6.361 8.640 -0.168 1.00 0.00 C ATOM 1814 C LEU B 52 -5.534 9.709 0.549 1.00 0.00 C ATOM 1815 O LEU B 52 -4.409 10.002 0.147 1.00 0.00 O ATOM 1816 CB LEU B 52 -6.379 7.290 0.552 1.00 0.00 C ATOM 1817 CG LEU B 52 -7.224 6.193 -0.099 1.00 0.00 C ATOM 1818 CD1 LEU B 52 -6.821 4.811 0.417 1.00 0.00 C ATOM 1819 CD2 LEU B 52 -8.718 6.464 0.094 1.00 0.00 C ATOM 0 H LEU B 52 -4.945 8.063 -1.601 1.00 0.00 H new ATOM 0 HA LEU B 52 -7.394 8.986 -0.173 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -5.353 6.931 0.633 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -6.743 7.447 1.567 1.00 0.00 H new ATOM 0 HG LEU B 52 -7.031 6.205 -1.172 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -7.437 4.050 -0.062 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -5.772 4.628 0.185 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -6.966 4.769 1.496 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -9.296 5.669 -0.378 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -8.947 6.496 1.159 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -8.976 7.420 -0.361 1.00 0.00 H new ATOM 1831 N ASN B 53 -6.124 10.262 1.598 1.00 0.00 N ATOM 1832 CA ASN B 53 -5.456 11.292 2.375 1.00 0.00 C ATOM 1833 C ASN B 53 -4.683 10.639 3.523 1.00 0.00 C ATOM 1834 O ASN B 53 -5.276 10.004 4.394 1.00 0.00 O ATOM 1835 CB ASN B 53 -6.467 12.268 2.981 1.00 0.00 C ATOM 1836 CG ASN B 53 -5.764 13.501 3.552 1.00 0.00 C ATOM 1837 OD1 ASN B 53 -4.718 13.922 3.088 1.00 0.00 O ATOM 1838 ND2 ASN B 53 -6.397 14.055 4.583 1.00 0.00 N ATOM 0 H ASN B 53 -7.057 10.016 1.928 1.00 0.00 H new ATOM 0 HA ASN B 53 -4.785 11.835 1.709 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -7.184 12.574 2.219 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -7.032 11.770 3.769 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -6.009 14.883 5.034 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -7.270 13.651 4.922 1.00 0.00 H new ATOM 1845 N PRO B 54 -3.336 10.821 3.485 1.00 0.00 N ATOM 1846 CA PRO B 54 -2.476 10.257 4.511 1.00 0.00 C ATOM 1847 C PRO B 54 -2.582 11.052 5.814 1.00 0.00 C ATOM 1848 O PRO B 54 -1.987 10.678 6.824 1.00 0.00 O ATOM 1849 CB PRO B 54 -1.079 10.283 3.912 1.00 0.00 C ATOM 1850 CG PRO B 54 -1.136 11.281 2.766 1.00 0.00 C ATOM 1851 CD PRO B 54 -2.599 11.567 2.469 1.00 0.00 C ATOM 0 HA PRO B 54 -2.759 9.241 4.784 1.00 0.00 H new ATOM 0 HB2 PRO B 54 -0.341 10.584 4.655 1.00 0.00 H new ATOM 0 HB3 PRO B 54 -0.788 9.295 3.555 1.00 0.00 H new ATOM 0 HG2 PRO B 54 -0.614 12.200 3.034 1.00 0.00 H new ATOM 0 HG3 PRO B 54 -0.639 10.878 1.884 1.00 0.00 H new ATOM 0 HD2 PRO B 54 -2.814 12.634 2.528 1.00 0.00 H new ATOM 0 HD3 PRO B 54 -2.870 11.242 1.465 1.00 0.00 H new ATOM 1859 N ALA B 55 -3.344 12.134 5.749 1.00 0.00 N ATOM 1860 CA ALA B 55 -3.535 12.984 6.912 1.00 0.00 C ATOM 1861 C ALA B 55 -4.953 12.790 7.453 1.00 0.00 C ATOM 1862 O ALA B 55 -5.517 13.694 8.067 1.00 0.00 O ATOM 1863 CB ALA B 55 -3.251 14.439 6.532 1.00 0.00 C ATOM 0 H ALA B 55 -3.836 12.441 4.910 1.00 0.00 H new ATOM 0 HA ALA B 55 -2.839 12.711 7.705 1.00 0.00 H new ATOM 0 HB1 ALA B 55 -3.394 15.077 7.404 1.00 0.00 H new ATOM 0 HB2 ALA B 55 -2.223 14.529 6.181 1.00 0.00 H new ATOM 0 HB3 ALA B 55 -3.933 14.748 5.740 1.00 0.00 H new ATOM 1869 N SER B 56 -5.489 11.603 7.205 1.00 0.00 N ATOM 1870 CA SER B 56 -6.830 11.278 7.659 1.00 0.00 C ATOM 1871 C SER B 56 -6.795 10.032 8.545 1.00 0.00 C ATOM 1872 O SER B 56 -6.004 9.120 8.309 1.00 0.00 O ATOM 1873 CB SER B 56 -7.776 11.062 6.476 1.00 0.00 C ATOM 1874 OG SER B 56 -8.996 10.444 6.874 1.00 0.00 O ATOM 0 H SER B 56 -5.018 10.855 6.695 1.00 0.00 H new ATOM 0 HA SER B 56 -7.207 12.119 8.241 1.00 0.00 H new ATOM 0 HB2 SER B 56 -7.992 12.021 6.005 1.00 0.00 H new ATOM 0 HB3 SER B 56 -7.284 10.443 5.726 1.00 0.00 H new ATOM 0 HG SER B 56 -9.502 10.177 6.078 1.00 0.00 H new ATOM 1880 N PRO B 57 -7.685 10.032 9.573 1.00 0.00 N ATOM 1881 CA PRO B 57 -7.763 8.912 10.496 1.00 0.00 C ATOM 1882 C PRO B 57 -8.460 7.714 9.847 1.00 0.00 C ATOM 1883 O PRO B 57 -8.168 6.566 10.179 1.00 0.00 O ATOM 1884 CB PRO B 57 -8.510 9.450 11.705 1.00 0.00 C ATOM 1885 CG PRO B 57 -9.226 10.703 11.229 1.00 0.00 C ATOM 1886 CD PRO B 57 -8.638 11.094 9.884 1.00 0.00 C ATOM 0 HA PRO B 57 -6.782 8.536 10.785 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -9.220 8.715 12.084 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -7.822 9.679 12.519 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -10.297 10.520 11.139 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -9.101 11.511 11.950 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -9.412 11.168 9.120 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -8.146 12.065 9.934 1.00 0.00 H new ATOM 1894 N MET B 58 -9.368 8.023 8.932 1.00 0.00 N ATOM 1895 CA MET B 58 -10.108 6.986 8.234 1.00 0.00 C ATOM 1896 C MET B 58 -9.223 6.277 7.207 1.00 0.00 C ATOM 1897 O MET B 58 -9.474 5.125 6.856 1.00 0.00 O ATOM 1898 CB MET B 58 -11.314 7.608 7.526 1.00 0.00 C ATOM 1899 CG MET B 58 -12.399 6.561 7.268 1.00 0.00 C ATOM 1900 SD MET B 58 -13.909 7.029 8.096 1.00 0.00 S ATOM 1901 CE MET B 58 -13.308 7.191 9.769 1.00 0.00 C ATOM 0 H MET B 58 -9.607 8.976 8.658 1.00 0.00 H new ATOM 0 HA MET B 58 -10.444 6.251 8.965 1.00 0.00 H new ATOM 0 HB2 MET B 58 -11.721 8.416 8.135 1.00 0.00 H new ATOM 0 HB3 MET B 58 -10.997 8.049 6.581 1.00 0.00 H new ATOM 0 HG2 MET B 58 -12.577 6.466 6.197 1.00 0.00 H new ATOM 0 HG3 MET B 58 -12.067 5.586 7.624 1.00 0.00 H new ATOM 0 HE1 MET B 58 -14.109 6.951 10.468 1.00 0.00 H new ATOM 0 HE2 MET B 58 -12.474 6.506 9.924 1.00 0.00 H new ATOM 0 HE3 MET B 58 -12.973 8.214 9.938 1.00 0.00 H new ATOM 1911 N VAL B 59 -8.206 6.995 6.753 1.00 0.00 N ATOM 1912 CA VAL B 59 -7.283 6.450 5.773 1.00 0.00 C ATOM 1913 C VAL B 59 -6.363 5.435 6.456 1.00 0.00 C ATOM 1914 O VAL B 59 -5.573 4.764 5.793 1.00 0.00 O ATOM 1915 CB VAL B 59 -6.518 7.583 5.087 1.00 0.00 C ATOM 1916 CG1 VAL B 59 -5.162 7.097 4.573 1.00 0.00 C ATOM 1917 CG2 VAL B 59 -7.346 8.196 3.955 1.00 0.00 C ATOM 0 H VAL B 59 -8.001 7.950 7.046 1.00 0.00 H new ATOM 0 HA VAL B 59 -7.826 5.922 4.989 1.00 0.00 H new ATOM 0 HB VAL B 59 -6.335 8.361 5.828 1.00 0.00 H new ATOM 0 HG11 VAL B 59 -4.639 7.922 4.090 1.00 0.00 H new ATOM 0 HG12 VAL B 59 -4.566 6.730 5.409 1.00 0.00 H new ATOM 0 HG13 VAL B 59 -5.313 6.292 3.854 1.00 0.00 H new ATOM 0 HG21 VAL B 59 -6.780 8.999 3.484 1.00 0.00 H new ATOM 0 HG22 VAL B 59 -7.574 7.429 3.214 1.00 0.00 H new ATOM 0 HG23 VAL B 59 -8.275 8.597 4.360 1.00 0.00 H new ATOM 1927 N LYS B 60 -6.495 5.356 7.772 1.00 0.00 N ATOM 1928 CA LYS B 60 -5.685 4.435 8.551 1.00 0.00 C ATOM 1929 C LYS B 60 -6.518 3.199 8.899 1.00 0.00 C ATOM 1930 O LYS B 60 -6.050 2.311 9.610 1.00 0.00 O ATOM 1931 CB LYS B 60 -5.094 5.142 9.772 1.00 0.00 C ATOM 1932 CG LYS B 60 -4.498 6.497 9.385 1.00 0.00 C ATOM 1933 CD LYS B 60 -3.164 6.322 8.657 1.00 0.00 C ATOM 1934 CE LYS B 60 -2.056 5.919 9.631 1.00 0.00 C ATOM 1935 NZ LYS B 60 -1.406 7.120 10.202 1.00 0.00 N ATOM 0 H LYS B 60 -7.151 5.915 8.318 1.00 0.00 H new ATOM 0 HA LYS B 60 -4.831 4.091 7.967 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -5.869 5.283 10.525 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -4.323 4.516 10.221 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -5.197 7.036 8.746 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -4.351 7.103 10.279 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -3.266 5.562 7.882 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -2.893 7.252 8.158 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -2.472 5.308 10.432 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -1.315 5.308 9.116 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -0.656 6.829 10.861 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -0.992 7.688 9.436 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -2.113 7.688 10.711 1.00 0.00 H new ATOM 1949 N LYS B 61 -7.738 3.182 8.382 1.00 0.00 N ATOM 1950 CA LYS B 61 -8.640 2.071 8.629 1.00 0.00 C ATOM 1951 C LYS B 61 -9.003 1.408 7.299 1.00 0.00 C ATOM 1952 O LYS B 61 -9.512 0.288 7.277 1.00 0.00 O ATOM 1953 CB LYS B 61 -9.854 2.535 9.436 1.00 0.00 C ATOM 1954 CG LYS B 61 -10.945 3.087 8.516 1.00 0.00 C ATOM 1955 CD LYS B 61 -12.084 2.078 8.350 1.00 0.00 C ATOM 1956 CE LYS B 61 -13.444 2.778 8.373 1.00 0.00 C ATOM 1957 NZ LYS B 61 -14.537 1.784 8.461 1.00 0.00 N ATOM 0 H LYS B 61 -8.123 3.921 7.793 1.00 0.00 H new ATOM 0 HA LYS B 61 -8.151 1.313 9.240 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -10.250 1.701 10.016 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -9.550 3.303 10.148 1.00 0.00 H new ATOM 0 HG2 LYS B 61 -11.336 4.018 8.927 1.00 0.00 H new ATOM 0 HG3 LYS B 61 -10.519 3.323 7.541 1.00 0.00 H new ATOM 0 HD2 LYS B 61 -11.964 1.540 7.410 1.00 0.00 H new ATOM 0 HD3 LYS B 61 -12.038 1.338 9.149 1.00 0.00 H new ATOM 0 HE2 LYS B 61 -13.495 3.459 9.222 1.00 0.00 H new ATOM 0 HE3 LYS B 61 -13.565 3.381 7.473 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 -15.453 2.276 8.476 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 -14.497 1.150 7.637 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 -14.430 1.226 9.332 1.00 0.00 H new ATOM 1971 N ILE B 62 -8.726 2.127 6.221 1.00 0.00 N ATOM 1972 CA ILE B 62 -9.017 1.623 4.890 1.00 0.00 C ATOM 1973 C ILE B 62 -7.800 0.860 4.361 1.00 0.00 C ATOM 1974 O ILE B 62 -7.911 0.094 3.405 1.00 0.00 O ATOM 1975 CB ILE B 62 -9.474 2.760 3.974 1.00 0.00 C ATOM 1976 CG1 ILE B 62 -10.752 3.412 4.507 1.00 0.00 C ATOM 1977 CG2 ILE B 62 -9.638 2.272 2.533 1.00 0.00 C ATOM 1978 CD1 ILE B 62 -10.811 4.893 4.125 1.00 0.00 C ATOM 0 H ILE B 62 -8.303 3.055 6.243 1.00 0.00 H new ATOM 0 HA ILE B 62 -9.847 0.918 4.923 1.00 0.00 H new ATOM 0 HB ILE B 62 -8.699 3.526 3.968 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -11.623 2.894 4.106 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -10.792 3.310 5.592 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -9.964 3.100 1.903 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -8.685 1.891 2.167 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -10.383 1.477 2.501 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -11.729 5.333 4.515 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -9.951 5.412 4.548 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -10.796 4.990 3.039 1.00 0.00 H new ATOM 1990 N ILE B 63 -6.668 1.095 5.007 1.00 0.00 N ATOM 1991 CA ILE B 63 -5.432 0.439 4.614 1.00 0.00 C ATOM 1992 C ILE B 63 -5.222 -0.804 5.480 1.00 0.00 C ATOM 1993 O ILE B 63 -5.077 -1.910 4.960 1.00 0.00 O ATOM 1994 CB ILE B 63 -4.263 1.426 4.662 1.00 0.00 C ATOM 1995 CG1 ILE B 63 -4.306 2.384 3.469 1.00 0.00 C ATOM 1996 CG2 ILE B 63 -2.926 0.688 4.757 1.00 0.00 C ATOM 1997 CD1 ILE B 63 -3.676 3.732 3.826 1.00 0.00 C ATOM 0 H ILE B 63 -6.580 1.730 5.800 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.492 0.101 3.579 1.00 0.00 H new ATOM 0 HB ILE B 63 -4.362 2.030 5.564 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -3.776 1.943 2.625 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -5.339 2.533 3.155 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -2.112 1.412 4.790 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -2.909 0.082 5.663 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -2.803 0.044 3.887 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -3.719 4.394 2.961 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -4.223 4.181 4.655 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -2.636 3.582 4.117 1.00 0.00 H new ATOM 2009 N GLU B 64 -5.213 -0.583 6.786 1.00 0.00 N ATOM 2010 CA GLU B 64 -5.023 -1.672 7.729 1.00 0.00 C ATOM 2011 C GLU B 64 -6.058 -2.772 7.484 1.00 0.00 C ATOM 2012 O GLU B 64 -5.777 -3.951 7.693 1.00 0.00 O ATOM 2013 CB GLU B 64 -5.091 -1.166 9.172 1.00 0.00 C ATOM 2014 CG GLU B 64 -3.939 -0.205 9.470 1.00 0.00 C ATOM 2015 CD GLU B 64 -4.262 0.681 10.675 1.00 0.00 C ATOM 2016 OE1 GLU B 64 -5.268 0.374 11.352 1.00 0.00 O ATOM 2017 OE2 GLU B 64 -3.497 1.645 10.892 1.00 0.00 O ATOM 0 H GLU B 64 -5.334 0.335 7.214 1.00 0.00 H new ATOM 0 HA GLU B 64 -4.030 -2.093 7.573 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -6.043 -0.662 9.340 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -5.052 -2.011 9.860 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -3.029 -0.772 9.665 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -3.746 0.418 8.597 1.00 0.00 H new ATOM 2024 N LYS B 65 -7.234 -2.347 7.046 1.00 0.00 N ATOM 2025 CA LYS B 65 -8.312 -3.281 6.771 1.00 0.00 C ATOM 2026 C LYS B 65 -8.035 -3.998 5.447 1.00 0.00 C ATOM 2027 O LYS B 65 -8.398 -5.161 5.279 1.00 0.00 O ATOM 2028 CB LYS B 65 -9.664 -2.566 6.812 1.00 0.00 C ATOM 2029 CG LYS B 65 -10.017 -2.142 8.239 1.00 0.00 C ATOM 2030 CD LYS B 65 -10.539 -3.329 9.050 1.00 0.00 C ATOM 2031 CE LYS B 65 -11.370 -2.853 10.244 1.00 0.00 C ATOM 2032 NZ LYS B 65 -12.692 -2.363 9.793 1.00 0.00 N ATOM 0 H LYS B 65 -7.464 -1.368 6.875 1.00 0.00 H new ATOM 0 HA LYS B 65 -8.359 -4.047 7.545 1.00 0.00 H new ATOM 0 HB2 LYS B 65 -9.636 -1.689 6.165 1.00 0.00 H new ATOM 0 HB3 LYS B 65 -10.440 -3.225 6.422 1.00 0.00 H new ATOM 0 HG2 LYS B 65 -9.136 -1.723 8.726 1.00 0.00 H new ATOM 0 HG3 LYS B 65 -10.771 -1.355 8.212 1.00 0.00 H new ATOM 0 HD2 LYS B 65 -11.146 -3.971 8.412 1.00 0.00 H new ATOM 0 HD3 LYS B 65 -9.701 -3.930 9.402 1.00 0.00 H new ATOM 0 HE2 LYS B 65 -11.501 -3.671 10.953 1.00 0.00 H new ATOM 0 HE3 LYS B 65 -10.841 -2.058 10.769 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 -13.345 -2.333 10.602 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 -12.591 -1.408 9.394 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 -13.070 -3.004 9.066 1.00 0.00 H new ATOM 2046 N MET B 66 -7.394 -3.273 4.542 1.00 0.00 N ATOM 2047 CA MET B 66 -7.064 -3.825 3.239 1.00 0.00 C ATOM 2048 C MET B 66 -6.052 -4.966 3.367 1.00 0.00 C ATOM 2049 O MET B 66 -6.119 -5.946 2.626 1.00 0.00 O ATOM 2050 CB MET B 66 -6.482 -2.724 2.350 1.00 0.00 C ATOM 2051 CG MET B 66 -7.403 -2.434 1.163 1.00 0.00 C ATOM 2052 SD MET B 66 -7.574 -3.895 0.153 1.00 0.00 S ATOM 2053 CE MET B 66 -5.862 -4.198 -0.248 1.00 0.00 C ATOM 0 H MET B 66 -7.094 -2.309 4.685 1.00 0.00 H new ATOM 0 HA MET B 66 -7.976 -4.221 2.792 1.00 0.00 H new ATOM 0 HB2 MET B 66 -6.340 -1.816 2.936 1.00 0.00 H new ATOM 0 HB3 MET B 66 -5.499 -3.026 1.987 1.00 0.00 H new ATOM 0 HG2 MET B 66 -8.381 -2.113 1.521 1.00 0.00 H new ATOM 0 HG3 MET B 66 -6.997 -1.616 0.568 1.00 0.00 H new ATOM 0 HE1 MET B 66 -5.800 -4.742 -1.191 1.00 0.00 H new ATOM 0 HE2 MET B 66 -5.337 -3.248 -0.342 1.00 0.00 H new ATOM 0 HE3 MET B 66 -5.402 -4.790 0.543 1.00 0.00 H new ATOM 2063 N LEU B 67 -5.138 -4.801 4.312 1.00 0.00 N ATOM 2064 CA LEU B 67 -4.114 -5.805 4.546 1.00 0.00 C ATOM 2065 C LEU B 67 -4.749 -7.031 5.205 1.00 0.00 C ATOM 2066 O LEU B 67 -4.147 -8.103 5.240 1.00 0.00 O ATOM 2067 CB LEU B 67 -2.953 -5.209 5.345 1.00 0.00 C ATOM 2068 CG LEU B 67 -1.958 -4.360 4.551 1.00 0.00 C ATOM 2069 CD1 LEU B 67 -2.663 -3.189 3.864 1.00 0.00 C ATOM 2070 CD2 LEU B 67 -0.804 -3.892 5.440 1.00 0.00 C ATOM 0 H LEU B 67 -5.085 -3.987 4.925 1.00 0.00 H new ATOM 0 HA LEU B 67 -3.683 -6.138 3.602 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -3.366 -4.595 6.145 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -2.407 -6.025 5.818 1.00 0.00 H new ATOM 0 HG LEU B 67 -1.528 -4.983 3.766 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -1.933 -2.602 3.307 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -3.420 -3.571 3.180 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -3.138 -2.559 4.616 1.00 0.00 H new ATOM 0 HD21 LEU B 67 -0.112 -3.291 4.851 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -1.197 -3.292 6.261 1.00 0.00 H new ATOM 0 HD23 LEU B 67 -0.280 -4.759 5.842 1.00 0.00 H new ATOM 2082 N LYS B 68 -5.957 -6.831 5.712 1.00 0.00 N ATOM 2083 CA LYS B 68 -6.680 -7.907 6.368 1.00 0.00 C ATOM 2084 C LYS B 68 -7.766 -8.434 5.428 1.00 0.00 C ATOM 2085 O LYS B 68 -8.129 -9.608 5.488 1.00 0.00 O ATOM 2086 CB LYS B 68 -7.214 -7.445 7.726 1.00 0.00 C ATOM 2087 CG LYS B 68 -6.187 -7.695 8.832 1.00 0.00 C ATOM 2088 CD LYS B 68 -6.718 -8.699 9.857 1.00 0.00 C ATOM 2089 CE LYS B 68 -6.258 -10.119 9.521 1.00 0.00 C ATOM 2090 NZ LYS B 68 -5.999 -10.886 10.760 1.00 0.00 N ATOM 0 H LYS B 68 -6.453 -5.940 5.682 1.00 0.00 H new ATOM 0 HA LYS B 68 -6.010 -8.740 6.581 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -7.457 -6.383 7.683 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -8.138 -7.974 7.957 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -5.262 -8.071 8.396 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -5.947 -6.755 9.329 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -6.370 -8.426 10.853 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -7.807 -8.661 9.878 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -7.020 -10.623 8.926 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -5.353 -10.081 8.914 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -5.688 -11.847 10.514 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -5.256 -10.412 11.313 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -6.871 -10.938 11.325 1.00 0.00 H new ATOM 2104 N ASN B 69 -8.255 -7.540 4.581 1.00 0.00 N ATOM 2105 CA ASN B 69 -9.293 -7.899 3.629 1.00 0.00 C ATOM 2106 C ASN B 69 -10.542 -8.349 4.389 1.00 0.00 C ATOM 2107 O ASN B 69 -11.497 -7.586 4.528 1.00 0.00 O ATOM 2108 CB ASN B 69 -8.842 -9.055 2.734 1.00 0.00 C ATOM 2109 CG ASN B 69 -10.011 -9.597 1.908 1.00 0.00 C ATOM 2110 OD1 ASN B 69 -10.391 -10.752 2.007 1.00 0.00 O ATOM 2111 ND2 ASN B 69 -10.557 -8.702 1.091 1.00 0.00 N ATOM 0 H ASN B 69 -7.952 -6.567 4.534 1.00 0.00 H new ATOM 0 HA ASN B 69 -9.502 -7.025 3.012 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -8.048 -8.716 2.069 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -8.425 -9.853 3.348 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -11.343 -8.966 0.498 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -10.190 -7.751 1.058 1.00 0.00 H new ATOM 2118 N GLY B 70 -10.496 -9.586 4.861 1.00 0.00 N ATOM 2119 CA GLY B 70 -11.612 -10.146 5.603 1.00 0.00 C ATOM 2120 C GLY B 70 -11.123 -11.119 6.678 1.00 0.00 C ATOM 2121 O GLY B 70 -10.154 -11.847 6.466 1.00 0.00 O ATOM 0 H GLY B 70 -9.703 -10.216 4.744 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -12.184 -9.343 6.068 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -12.285 -10.663 4.919 1.00 0.00 H new ATOM 2125 N LYS B 71 -11.816 -11.101 7.807 1.00 0.00 N ATOM 2126 CA LYS B 71 -11.464 -11.973 8.915 1.00 0.00 C ATOM 2127 C LYS B 71 -11.700 -13.428 8.508 1.00 0.00 C ATOM 2128 O LYS B 71 -12.001 -13.711 7.349 1.00 0.00 O ATOM 2129 CB LYS B 71 -12.216 -11.559 10.182 1.00 0.00 C ATOM 2130 CG LYS B 71 -11.455 -10.470 10.940 1.00 0.00 C ATOM 2131 CD LYS B 71 -12.149 -9.114 10.795 1.00 0.00 C ATOM 2132 CE LYS B 71 -11.822 -8.201 11.979 1.00 0.00 C ATOM 2133 NZ LYS B 71 -11.368 -6.876 11.502 1.00 0.00 N ATOM 0 H LYS B 71 -12.619 -10.496 7.978 1.00 0.00 H new ATOM 0 HA LYS B 71 -10.405 -11.876 9.154 1.00 0.00 H new ATOM 0 HB2 LYS B 71 -13.209 -11.196 9.918 1.00 0.00 H new ATOM 0 HB3 LYS B 71 -12.355 -12.427 10.827 1.00 0.00 H new ATOM 0 HG2 LYS B 71 -11.386 -10.736 11.995 1.00 0.00 H new ATOM 0 HG3 LYS B 71 -10.435 -10.403 10.561 1.00 0.00 H new ATOM 0 HD2 LYS B 71 -11.834 -8.638 9.866 1.00 0.00 H new ATOM 0 HD3 LYS B 71 -13.227 -9.259 10.730 1.00 0.00 H new ATOM 0 HE2 LYS B 71 -12.703 -8.085 12.610 1.00 0.00 H new ATOM 0 HE3 LYS B 71 -11.047 -8.658 12.595 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 -11.150 -6.269 12.318 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 -10.515 -6.991 10.919 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 -12.119 -6.435 10.934 1.00 0.00 H new ATOM 2147 N SER B 72 -11.554 -14.313 9.483 1.00 0.00 N ATOM 2148 CA SER B 72 -11.747 -15.733 9.240 1.00 0.00 C ATOM 2149 C SER B 72 -10.966 -16.163 7.997 1.00 0.00 C ATOM 2150 O SER B 72 -11.506 -16.172 6.892 1.00 0.00 O ATOM 2151 CB SER B 72 -13.231 -16.066 9.075 1.00 0.00 C ATOM 2152 OG SER B 72 -13.587 -17.268 9.754 1.00 0.00 O ATOM 0 H SER B 72 -11.304 -14.075 10.443 1.00 0.00 H new ATOM 0 HA SER B 72 -11.372 -16.282 10.104 1.00 0.00 H new ATOM 0 HB2 SER B 72 -13.832 -15.241 9.458 1.00 0.00 H new ATOM 0 HB3 SER B 72 -13.465 -16.165 8.015 1.00 0.00 H new ATOM 0 HG SER B 72 -14.542 -17.445 9.626 1.00 0.00 H new ATOM 2158 N ASN B 73 -9.706 -16.508 8.219 1.00 0.00 N ATOM 2159 CA ASN B 73 -8.844 -16.937 7.131 1.00 0.00 C ATOM 2160 C ASN B 73 -9.486 -18.130 6.419 1.00 0.00 C ATOM 2161 O ASN B 73 -8.959 -18.618 5.420 1.00 0.00 O ATOM 2162 CB ASN B 73 -7.476 -17.378 7.653 1.00 0.00 C ATOM 2163 CG ASN B 73 -6.677 -16.182 8.175 1.00 0.00 C ATOM 2164 OD1 ASN B 73 -6.090 -15.419 7.426 1.00 0.00 O ATOM 2165 ND2 ASN B 73 -6.686 -16.063 9.500 1.00 0.00 N ATOM 0 H ASN B 73 -9.261 -16.499 9.137 1.00 0.00 H new ATOM 0 HA ASN B 73 -8.715 -16.095 6.450 1.00 0.00 H new ATOM 0 HB2 ASN B 73 -7.606 -18.109 8.451 1.00 0.00 H new ATOM 0 HB3 ASN B 73 -6.920 -17.871 6.856 1.00 0.00 H new ATOM 0 HD21 ASN B 73 -6.181 -15.298 9.947 1.00 0.00 H new ATOM 0 HD22 ASN B 73 -7.198 -16.737 10.069 1.00 0.00 H new TER 2172 ASN B 73