USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=32 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 61 LYS NZ :NH3+ -148:sc=-0.00869 (180deg=0) USER MOD Set 1.2: B 65 LYS NZ :NH3+ -165:sc= 0.43 (180deg=0.499) USER MOD Set 2.1: B 46 ASN :FLIP amide:sc= -2.56! C(o=-2.6!,f=-2.1!) USER MOD Set 2.2: B 48 GLN :FLIP amide:sc= 0.499 F(o=-2.6,f=-2.1) USER MOD Set 3.1: A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: B 43 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 43 THR OG1 : rot -160:sc= 0 USER MOD Set 4.2: B 27 LYS NZ :NH3+ -135:sc= -1.9 (180deg=-3.4!) USER MOD Set 5.1: A 66 MET CE :methyl -145:sc= -5.34 (180deg=-8.4!) USER MOD Set 5.2: B 30 SER OG : rot 135:sc= 0.856 USER MOD Set 6.1: A 46 ASN : amide:sc= -2.89! C(o=-3!,f=-3!) USER MOD Set 6.2: A 48 GLN : amide:sc= -0.144 K(o=-3,f=-5.2!) USER MOD Set 7.1: A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 7.2: A 34 HIS : no HE2:sc= -4.94! C(o=-4.9!,f=-6.6!) USER MOD Set 8.1: A 19 HIS : no HD1:sc= -1.12! C(o=-0.2!,f=-5.1!) USER MOD Set 8.2: A 21 LYS NZ :NH3+ -146:sc= 0.921 (180deg=0) USER MOD Single : A 5 THR OG1 : rot -29:sc= 0.651 USER MOD Single : A 10 GLN : amide:sc= -0.333 X(o=-0.33,f=-0.11) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= -0.0267 X(o=-0.027,f=0) USER MOD Single : A 22 ASN : amide:sc= -3.65! C(o=-3.6!,f=-4.6!) USER MOD Single : A 24 GLN : amide:sc= -0.694 X(o=-0.69,f=-0.61) USER MOD Single : A 25 SER OG : rot 180:sc= -0.356 USER MOD Single : A 30 SER OG : rot 180:sc= -1.05 USER MOD Single : A 37 GLN : amide:sc= -0.377 K(o=-0.38,f=-2!) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 150:sc= -0.0153 (180deg=-0.969) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN :FLIP amide:sc= -2.63 F(o=-4.5!,f=-2.6) USER MOD Single : A 56 SER OG : rot 180:sc= -0.193 USER MOD Single : A 58 MET CE :methyl -173:sc= -1.9 (180deg=-2.29) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -2.09! C(o=-2.1!,f=-7.3!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 51:sc= 0.203 USER MOD Single : A 73 ASN : amide:sc= 0.106 K(o=0.11,f=-1.4) USER MOD Single : B 5 THR OG1 : rot -19:sc= 0.0995 USER MOD Single : B 10 GLN : amide:sc= -0.0101 X(o=-0.01,f=0) USER MOD Single : B 13 GLN : amide:sc= -0.268 K(o=-0.27,f=-1.1) USER MOD Single : B 14 THR OG1 : rot 180:sc= 0 USER MOD Single : B 16 GLN : amide:sc= -0.0128 X(o=-0.013,f=0) USER MOD Single : B 19 HIS : no HD1:sc= -2.12! C(o=-2.1!,f=-2!) USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 ASN : amide:sc= -0.173 K(o=-0.17,f=-0.69) USER MOD Single : B 24 GLN : amide:sc= 0.66 K(o=0.66,f=-0.015) USER MOD Single : B 25 SER OG : rot 178:sc= -0.854 USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 HIS : no HD1:sc= -4.62! C(o=-4.6!,f=-6.1!) USER MOD Single : B 37 GLN : amide:sc= -0.0495 K(o=-0.049,f=-0.88) USER MOD Single : B 38 THR OG1 : rot 180:sc= 0 USER MOD Single : B 45 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.3) USER MOD Single : B 49 LYS NZ :NH3+ -126:sc= 1.11 (180deg=-1.42) USER MOD Single : B 53 ASN : amide:sc= -1.19 K(o=-1.2,f=-2.2) USER MOD Single : B 56 SER OG : rot 180:sc= -1.01 USER MOD Single : B 58 MET CE :methyl -170:sc= -1.33 (180deg=-2.04) USER MOD Single : B 60 LYS NZ :NH3+ 150:sc= -0.596 (180deg=-2.75!) USER MOD Single : B 66 MET CE :methyl -148:sc= -3.83! (180deg=-8.47!) USER MOD Single : B 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 69 ASN : amide:sc= -1.47! C(o=-1.5!,f=-4.9!) 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=-0.081) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 5 -11.620 -17.160 -15.907 1.00 0.00 N ATOM 2 CA THR A 5 -11.178 -16.507 -14.686 1.00 0.00 C ATOM 3 C THR A 5 -10.133 -17.365 -13.971 1.00 0.00 C ATOM 4 O THR A 5 -10.355 -17.810 -12.845 1.00 0.00 O ATOM 5 CB THR A 5 -12.414 -16.216 -13.832 1.00 0.00 C ATOM 6 OG1 THR A 5 -13.149 -17.436 -13.858 1.00 0.00 O ATOM 7 CG2 THR A 5 -13.353 -15.201 -14.487 1.00 0.00 C ATOM 0 HA THR A 5 -10.683 -15.560 -14.900 1.00 0.00 H new ATOM 0 HB THR A 5 -12.101 -15.844 -12.856 1.00 0.00 H new ATOM 0 HG1 THR A 5 -12.971 -17.907 -14.698 1.00 0.00 H new ATOM 0 HG21 THR A 5 -14.213 -15.031 -13.840 1.00 0.00 H new ATOM 0 HG22 THR A 5 -12.823 -14.261 -14.641 1.00 0.00 H new ATOM 0 HG23 THR A 5 -13.693 -15.587 -15.448 1.00 0.00 H new ATOM 15 N GLU A 6 -9.016 -17.571 -14.652 1.00 0.00 N ATOM 16 CA GLU A 6 -7.936 -18.368 -14.096 1.00 0.00 C ATOM 17 C GLU A 6 -6.733 -17.479 -13.772 1.00 0.00 C ATOM 18 O GLU A 6 -5.696 -17.569 -14.427 1.00 0.00 O ATOM 19 CB GLU A 6 -7.541 -19.499 -15.048 1.00 0.00 C ATOM 20 CG GLU A 6 -6.829 -20.625 -14.296 1.00 0.00 C ATOM 21 CD GLU A 6 -7.836 -21.628 -13.729 1.00 0.00 C ATOM 22 OE1 GLU A 6 -8.729 -21.174 -12.981 1.00 0.00 O ATOM 23 OE2 GLU A 6 -7.690 -22.825 -14.056 1.00 0.00 O ATOM 0 H GLU A 6 -8.835 -17.200 -15.585 1.00 0.00 H new ATOM 0 HA GLU A 6 -8.287 -18.824 -13.170 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -8.430 -19.892 -15.541 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -6.889 -19.110 -15.830 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -6.140 -21.137 -14.968 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -6.232 -20.206 -13.486 1.00 0.00 H new ATOM 30 N LEU A 7 -6.913 -16.641 -12.762 1.00 0.00 N ATOM 31 CA LEU A 7 -5.855 -15.736 -12.343 1.00 0.00 C ATOM 32 C LEU A 7 -5.245 -16.243 -11.035 1.00 0.00 C ATOM 33 O LEU A 7 -5.819 -17.105 -10.370 1.00 0.00 O ATOM 34 CB LEU A 7 -6.379 -14.301 -12.262 1.00 0.00 C ATOM 35 CG LEU A 7 -6.885 -13.697 -13.573 1.00 0.00 C ATOM 36 CD1 LEU A 7 -8.363 -14.025 -13.793 1.00 0.00 C ATOM 37 CD2 LEU A 7 -6.619 -12.191 -13.621 1.00 0.00 C ATOM 0 H LEU A 7 -7.775 -16.569 -12.221 1.00 0.00 H new ATOM 0 HA LEU A 7 -5.054 -15.717 -13.082 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -7.190 -14.272 -11.535 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -5.582 -13.665 -11.876 1.00 0.00 H new ATOM 0 HG LEU A 7 -6.329 -14.149 -14.395 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -8.698 -13.584 -14.732 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -8.494 -15.106 -13.833 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -8.952 -13.619 -12.971 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.988 -11.786 -14.563 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.132 -11.704 -12.791 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -5.547 -12.008 -13.543 1.00 0.00 H new ATOM 49 N ARG A 8 -4.089 -15.687 -10.704 1.00 0.00 N ATOM 50 CA ARG A 8 -3.394 -16.072 -9.487 1.00 0.00 C ATOM 51 C ARG A 8 -2.869 -14.832 -8.760 1.00 0.00 C ATOM 52 O ARG A 8 -3.510 -13.782 -8.775 1.00 0.00 O ATOM 53 CB ARG A 8 -2.224 -17.009 -9.794 1.00 0.00 C ATOM 54 CG ARG A 8 -2.576 -17.974 -10.928 1.00 0.00 C ATOM 55 CD ARG A 8 -1.699 -19.226 -10.874 1.00 0.00 C ATOM 56 NE ARG A 8 -2.408 -20.311 -10.160 1.00 0.00 N ATOM 57 CZ ARG A 8 -1.836 -21.463 -9.786 1.00 0.00 C ATOM 58 NH1 ARG A 8 -0.543 -21.688 -10.055 1.00 0.00 N ATOM 59 NH2 ARG A 8 -2.557 -22.391 -9.142 1.00 0.00 N ATOM 0 H ARG A 8 -3.616 -14.973 -11.257 1.00 0.00 H new ATOM 0 HA ARG A 8 -4.107 -16.596 -8.850 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -1.347 -16.423 -10.070 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -1.962 -17.574 -8.899 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -3.626 -18.258 -10.856 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -2.446 -17.475 -11.888 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -1.448 -19.548 -11.885 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -0.760 -19.000 -10.369 1.00 0.00 H new ATOM 0 HE ARG A 8 -3.394 -20.173 -9.939 1.00 0.00 H new ATOM 0 HH11 ARG A 8 0.006 -20.982 -10.545 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -0.108 -22.565 -9.770 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -3.541 -22.220 -8.937 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -2.121 -23.268 -8.857 1.00 0.00 H new ATOM 73 N CYS A 9 -1.709 -14.995 -8.142 1.00 0.00 N ATOM 74 CA CYS A 9 -1.091 -13.902 -7.411 1.00 0.00 C ATOM 75 C CYS A 9 -0.073 -13.224 -8.331 1.00 0.00 C ATOM 76 O CYS A 9 0.250 -13.746 -9.396 1.00 0.00 O ATOM 77 CB CYS A 9 -0.451 -14.383 -6.108 1.00 0.00 C ATOM 78 SG CYS A 9 -1.627 -14.674 -4.736 1.00 0.00 S ATOM 0 H CYS A 9 -1.181 -15.867 -8.132 1.00 0.00 H new ATOM 0 HA CYS A 9 -1.853 -13.180 -7.119 1.00 0.00 H new ATOM 0 HB2 CYS A 9 0.091 -15.308 -6.306 1.00 0.00 H new ATOM 0 HB3 CYS A 9 0.284 -13.645 -5.787 1.00 0.00 H new ATOM 83 N GLN A 10 0.404 -12.071 -7.884 1.00 0.00 N ATOM 84 CA GLN A 10 1.379 -11.317 -8.654 1.00 0.00 C ATOM 85 C GLN A 10 2.790 -11.573 -8.120 1.00 0.00 C ATOM 86 O GLN A 10 3.769 -11.091 -8.688 1.00 0.00 O ATOM 87 CB GLN A 10 1.051 -9.822 -8.640 1.00 0.00 C ATOM 88 CG GLN A 10 1.779 -9.090 -9.768 1.00 0.00 C ATOM 89 CD GLN A 10 2.596 -7.917 -9.223 1.00 0.00 C ATOM 90 OE1 GLN A 10 3.738 -7.698 -9.592 1.00 0.00 O ATOM 91 NE2 GLN A 10 1.949 -7.177 -8.327 1.00 0.00 N ATOM 0 H GLN A 10 0.134 -11.641 -6.999 1.00 0.00 H new ATOM 0 HA GLN A 10 1.336 -11.656 -9.689 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -0.025 -9.681 -8.745 1.00 0.00 H new ATOM 0 HB3 GLN A 10 1.336 -9.393 -7.680 1.00 0.00 H new ATOM 0 HG2 GLN A 10 2.437 -9.784 -10.291 1.00 0.00 H new ATOM 0 HG3 GLN A 10 1.055 -8.726 -10.497 1.00 0.00 H new ATOM 0 HE21 GLN A 10 0.993 -7.416 -8.063 1.00 0.00 H new ATOM 0 HE22 GLN A 10 2.408 -6.370 -7.904 1.00 0.00 H new ATOM 100 N CYS A 11 2.849 -12.331 -7.035 1.00 0.00 N ATOM 101 CA CYS A 11 4.124 -12.657 -6.418 1.00 0.00 C ATOM 102 C CYS A 11 4.056 -14.098 -5.908 1.00 0.00 C ATOM 103 O CYS A 11 3.133 -14.459 -5.179 1.00 0.00 O ATOM 104 CB CYS A 11 4.481 -11.673 -5.303 1.00 0.00 C ATOM 105 SG CYS A 11 6.101 -10.845 -5.499 1.00 0.00 S ATOM 0 H CYS A 11 2.035 -12.729 -6.567 1.00 0.00 H new ATOM 0 HA CYS A 11 4.921 -12.571 -7.157 1.00 0.00 H new ATOM 0 HB2 CYS A 11 3.704 -10.911 -5.248 1.00 0.00 H new ATOM 0 HB3 CYS A 11 4.474 -12.205 -4.352 1.00 0.00 H new ATOM 110 N LEU A 12 5.045 -14.882 -6.311 1.00 0.00 N ATOM 111 CA LEU A 12 5.109 -16.275 -5.903 1.00 0.00 C ATOM 112 C LEU A 12 6.068 -16.412 -4.719 1.00 0.00 C ATOM 113 O LEU A 12 6.094 -17.445 -4.053 1.00 0.00 O ATOM 114 CB LEU A 12 5.471 -17.165 -7.094 1.00 0.00 C ATOM 115 CG LEU A 12 4.777 -16.832 -8.416 1.00 0.00 C ATOM 116 CD1 LEU A 12 5.630 -17.270 -9.608 1.00 0.00 C ATOM 117 CD2 LEU A 12 3.371 -17.434 -8.464 1.00 0.00 C ATOM 0 H LEU A 12 5.808 -14.579 -6.916 1.00 0.00 H new ATOM 0 HA LEU A 12 4.132 -16.618 -5.563 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.549 -17.110 -7.249 1.00 0.00 H new ATOM 0 HB3 LEU A 12 5.238 -18.198 -6.834 1.00 0.00 H new ATOM 0 HG LEU A 12 4.666 -15.750 -8.481 1.00 0.00 H new ATOM 0 HD11 LEU A 12 5.114 -17.022 -10.535 1.00 0.00 H new ATOM 0 HD12 LEU A 12 6.590 -16.754 -9.578 1.00 0.00 H new ATOM 0 HD13 LEU A 12 5.795 -18.346 -9.561 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.900 -17.182 -9.414 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.436 -18.518 -8.367 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.775 -17.031 -7.645 1.00 0.00 H new ATOM 129 N GLN A 13 6.834 -15.354 -4.493 1.00 0.00 N ATOM 130 CA GLN A 13 7.792 -15.343 -3.401 1.00 0.00 C ATOM 131 C GLN A 13 7.640 -14.065 -2.574 1.00 0.00 C ATOM 132 O GLN A 13 6.905 -13.157 -2.958 1.00 0.00 O ATOM 133 CB GLN A 13 9.222 -15.491 -3.925 1.00 0.00 C ATOM 134 CG GLN A 13 10.074 -16.324 -2.966 1.00 0.00 C ATOM 135 CD GLN A 13 10.487 -17.650 -3.610 1.00 0.00 C ATOM 136 OE1 GLN A 13 11.488 -17.748 -4.301 1.00 0.00 O ATOM 137 NE2 GLN A 13 9.663 -18.659 -3.347 1.00 0.00 N ATOM 0 H GLN A 13 6.810 -14.499 -5.048 1.00 0.00 H new ATOM 0 HA GLN A 13 7.587 -16.196 -2.755 1.00 0.00 H new ATOM 0 HB2 GLN A 13 9.206 -15.964 -4.907 1.00 0.00 H new ATOM 0 HB3 GLN A 13 9.670 -14.506 -4.053 1.00 0.00 H new ATOM 0 HG2 GLN A 13 10.963 -15.761 -2.681 1.00 0.00 H new ATOM 0 HG3 GLN A 13 9.514 -16.519 -2.052 1.00 0.00 H new ATOM 0 HE21 GLN A 13 8.842 -18.508 -2.761 1.00 0.00 H new ATOM 0 HE22 GLN A 13 9.851 -19.585 -3.732 1.00 0.00 H new ATOM 146 N THR A 14 8.348 -14.035 -1.454 1.00 0.00 N ATOM 147 CA THR A 14 8.301 -12.883 -0.570 1.00 0.00 C ATOM 148 C THR A 14 9.528 -12.861 0.343 1.00 0.00 C ATOM 149 O THR A 14 10.233 -13.862 0.465 1.00 0.00 O ATOM 150 CB THR A 14 6.975 -12.927 0.194 1.00 0.00 C ATOM 151 OG1 THR A 14 6.838 -14.294 0.572 1.00 0.00 O ATOM 152 CG2 THR A 14 5.769 -12.668 -0.711 1.00 0.00 C ATOM 0 H THR A 14 8.957 -14.790 -1.139 1.00 0.00 H new ATOM 0 HA THR A 14 8.337 -11.950 -1.133 1.00 0.00 H new ATOM 0 HB THR A 14 6.993 -12.188 0.995 1.00 0.00 H new ATOM 0 HG1 THR A 14 6.005 -14.413 1.074 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.854 -12.710 -0.119 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.861 -11.682 -1.167 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.731 -13.427 -1.493 1.00 0.00 H new ATOM 160 N LEU A 15 9.745 -11.710 0.962 1.00 0.00 N ATOM 161 CA LEU A 15 10.875 -11.545 1.860 1.00 0.00 C ATOM 162 C LEU A 15 10.362 -11.366 3.291 1.00 0.00 C ATOM 163 O LEU A 15 9.180 -11.095 3.501 1.00 0.00 O ATOM 164 CB LEU A 15 11.776 -10.404 1.384 1.00 0.00 C ATOM 165 CG LEU A 15 12.265 -10.495 -0.063 1.00 0.00 C ATOM 166 CD1 LEU A 15 12.003 -9.188 -0.814 1.00 0.00 C ATOM 167 CD2 LEU A 15 13.739 -10.903 -0.120 1.00 0.00 C ATOM 0 H LEU A 15 9.157 -10.883 0.859 1.00 0.00 H new ATOM 0 HA LEU A 15 11.500 -12.438 1.853 1.00 0.00 H new ATOM 0 HB2 LEU A 15 11.235 -9.465 1.506 1.00 0.00 H new ATOM 0 HB3 LEU A 15 12.646 -10.357 2.039 1.00 0.00 H new ATOM 0 HG LEU A 15 11.695 -11.276 -0.567 1.00 0.00 H new ATOM 0 HD11 LEU A 15 12.360 -9.280 -1.840 1.00 0.00 H new ATOM 0 HD12 LEU A 15 10.933 -8.980 -0.820 1.00 0.00 H new ATOM 0 HD13 LEU A 15 12.529 -8.372 -0.318 1.00 0.00 H new ATOM 0 HD21 LEU A 15 14.061 -10.960 -1.160 1.00 0.00 H new ATOM 0 HD22 LEU A 15 14.342 -10.163 0.406 1.00 0.00 H new ATOM 0 HD23 LEU A 15 13.866 -11.877 0.353 1.00 0.00 H new ATOM 179 N GLN A 16 11.275 -11.526 4.237 1.00 0.00 N ATOM 180 CA GLN A 16 10.929 -11.385 5.642 1.00 0.00 C ATOM 181 C GLN A 16 10.922 -9.909 6.042 1.00 0.00 C ATOM 182 O GLN A 16 10.395 -9.549 7.093 1.00 0.00 O ATOM 183 CB GLN A 16 11.887 -12.188 6.525 1.00 0.00 C ATOM 184 CG GLN A 16 11.849 -11.688 7.970 1.00 0.00 C ATOM 185 CD GLN A 16 12.379 -12.753 8.933 1.00 0.00 C ATOM 186 OE1 GLN A 16 13.521 -13.176 8.864 1.00 0.00 O ATOM 187 NE2 GLN A 16 11.487 -13.161 9.831 1.00 0.00 N ATOM 0 H GLN A 16 12.254 -11.752 4.059 1.00 0.00 H new ATOM 0 HA GLN A 16 9.926 -11.786 5.791 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.617 -13.244 6.494 1.00 0.00 H new ATOM 0 HB3 GLN A 16 12.902 -12.107 6.135 1.00 0.00 H new ATOM 0 HG2 GLN A 16 12.447 -10.781 8.061 1.00 0.00 H new ATOM 0 HG3 GLN A 16 10.827 -11.424 8.241 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.547 -12.765 9.833 1.00 0.00 H new ATOM 0 HE22 GLN A 16 11.743 -13.870 10.518 1.00 0.00 H new ATOM 196 N GLY A 17 11.513 -9.093 5.181 1.00 0.00 N ATOM 197 CA GLY A 17 11.582 -7.663 5.432 1.00 0.00 C ATOM 198 C GLY A 17 12.998 -7.133 5.198 1.00 0.00 C ATOM 199 O GLY A 17 13.876 -7.306 6.041 1.00 0.00 O ATOM 0 H GLY A 17 11.948 -9.395 4.309 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.882 -7.141 4.779 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.277 -7.455 6.458 1.00 0.00 H new ATOM 203 N ILE A 18 13.175 -6.496 4.050 1.00 0.00 N ATOM 204 CA ILE A 18 14.469 -5.939 3.695 1.00 0.00 C ATOM 205 C ILE A 18 14.609 -4.548 4.316 1.00 0.00 C ATOM 206 O ILE A 18 13.618 -3.946 4.728 1.00 0.00 O ATOM 207 CB ILE A 18 14.662 -5.957 2.177 1.00 0.00 C ATOM 208 CG1 ILE A 18 15.191 -7.314 1.707 1.00 0.00 C ATOM 209 CG2 ILE A 18 15.560 -4.804 1.725 1.00 0.00 C ATOM 210 CD1 ILE A 18 14.158 -8.034 0.839 1.00 0.00 C ATOM 0 H ILE A 18 12.444 -6.353 3.354 1.00 0.00 H new ATOM 0 HA ILE A 18 15.272 -6.553 4.103 1.00 0.00 H new ATOM 0 HB ILE A 18 13.689 -5.811 1.707 1.00 0.00 H new ATOM 0 HG12 ILE A 18 16.112 -7.173 1.141 1.00 0.00 H new ATOM 0 HG13 ILE A 18 15.439 -7.931 2.571 1.00 0.00 H new ATOM 0 HG21 ILE A 18 15.681 -4.840 0.642 1.00 0.00 H new ATOM 0 HG22 ILE A 18 15.104 -3.855 2.008 1.00 0.00 H new ATOM 0 HG23 ILE A 18 16.536 -4.894 2.202 1.00 0.00 H new ATOM 0 HD11 ILE A 18 14.559 -8.995 0.518 1.00 0.00 H new ATOM 0 HD12 ILE A 18 13.247 -8.195 1.415 1.00 0.00 H new ATOM 0 HD13 ILE A 18 13.931 -7.426 -0.036 1.00 0.00 H new ATOM 222 N HIS A 19 15.847 -4.078 4.365 1.00 0.00 N ATOM 223 CA HIS A 19 16.129 -2.769 4.929 1.00 0.00 C ATOM 224 C HIS A 19 15.138 -1.746 4.371 1.00 0.00 C ATOM 225 O HIS A 19 14.830 -1.760 3.180 1.00 0.00 O ATOM 226 CB HIS A 19 17.587 -2.376 4.687 1.00 0.00 C ATOM 227 CG HIS A 19 18.254 -1.726 5.876 1.00 0.00 C ATOM 228 ND1 HIS A 19 19.568 -1.978 6.230 1.00 0.00 N ATOM 229 CD2 HIS A 19 17.774 -0.832 6.788 1.00 0.00 C ATOM 230 CE1 HIS A 19 19.856 -1.263 7.307 1.00 0.00 C ATOM 231 NE2 HIS A 19 18.743 -0.554 7.652 1.00 0.00 N ATOM 0 H HIS A 19 16.666 -4.581 4.023 1.00 0.00 H new ATOM 0 HA HIS A 19 15.997 -2.798 6.011 1.00 0.00 H new ATOM 0 HB2 HIS A 19 18.151 -3.266 4.409 1.00 0.00 H new ATOM 0 HB3 HIS A 19 17.632 -1.692 3.839 1.00 0.00 H new ATOM 0 HD2 HIS A 19 16.776 -0.420 6.804 1.00 0.00 H new ATOM 0 HE1 HIS A 19 20.805 -1.245 7.822 1.00 0.00 H new ATOM 0 HE2 HIS A 19 18.668 0.085 8.444 1.00 0.00 H new ATOM 239 N LEU A 20 14.666 -0.882 5.258 1.00 0.00 N ATOM 240 CA LEU A 20 13.717 0.147 4.869 1.00 0.00 C ATOM 241 C LEU A 20 14.476 1.347 4.301 1.00 0.00 C ATOM 242 O LEU A 20 13.883 2.391 4.032 1.00 0.00 O ATOM 243 CB LEU A 20 12.798 0.499 6.041 1.00 0.00 C ATOM 244 CG LEU A 20 11.495 1.216 5.680 1.00 0.00 C ATOM 245 CD1 LEU A 20 11.726 2.719 5.510 1.00 0.00 C ATOM 246 CD2 LEU A 20 10.850 0.591 4.442 1.00 0.00 C ATOM 0 H LEU A 20 14.923 -0.874 6.245 1.00 0.00 H new ATOM 0 HA LEU A 20 13.062 -0.219 4.079 1.00 0.00 H new ATOM 0 HB2 LEU A 20 12.549 -0.421 6.570 1.00 0.00 H new ATOM 0 HB3 LEU A 20 13.354 1.127 6.737 1.00 0.00 H new ATOM 0 HG LEU A 20 10.795 1.089 6.506 1.00 0.00 H new ATOM 0 HD11 LEU A 20 10.785 3.205 5.254 1.00 0.00 H new ATOM 0 HD12 LEU A 20 12.108 3.136 6.442 1.00 0.00 H new ATOM 0 HD13 LEU A 20 12.450 2.888 4.713 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.926 1.119 4.207 1.00 0.00 H new ATOM 0 HD22 LEU A 20 11.535 0.666 3.598 1.00 0.00 H new ATOM 0 HD23 LEU A 20 10.629 -0.458 4.638 1.00 0.00 H new ATOM 258 N LYS A 21 15.777 1.159 4.135 1.00 0.00 N ATOM 259 CA LYS A 21 16.624 2.214 3.604 1.00 0.00 C ATOM 260 C LYS A 21 16.637 2.130 2.076 1.00 0.00 C ATOM 261 O LYS A 21 17.132 3.035 1.406 1.00 0.00 O ATOM 262 CB LYS A 21 18.016 2.152 4.235 1.00 0.00 C ATOM 263 CG LYS A 21 18.804 0.951 3.708 1.00 0.00 C ATOM 264 CD LYS A 21 20.299 1.267 3.630 1.00 0.00 C ATOM 265 CE LYS A 21 21.121 -0.010 3.444 1.00 0.00 C ATOM 266 NZ LYS A 21 21.634 -0.491 4.746 1.00 0.00 N ATOM 0 H LYS A 21 16.265 0.292 4.359 1.00 0.00 H new ATOM 0 HA LYS A 21 16.224 3.193 3.867 1.00 0.00 H new ATOM 0 HB2 LYS A 21 18.559 3.072 4.017 1.00 0.00 H new ATOM 0 HB3 LYS A 21 17.925 2.084 5.319 1.00 0.00 H new ATOM 0 HG2 LYS A 21 18.644 0.092 4.360 1.00 0.00 H new ATOM 0 HG3 LYS A 21 18.435 0.675 2.720 1.00 0.00 H new ATOM 0 HD2 LYS A 21 20.487 1.949 2.801 1.00 0.00 H new ATOM 0 HD3 LYS A 21 20.614 1.777 4.540 1.00 0.00 H new ATOM 0 HE2 LYS A 21 20.505 -0.782 2.982 1.00 0.00 H new ATOM 0 HE3 LYS A 21 21.953 0.182 2.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 22.568 -0.928 4.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 21.718 0.310 5.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 20.977 -1.194 5.140 1.00 0.00 H new ATOM 280 N ASN A 22 16.086 1.037 1.570 1.00 0.00 N ATOM 281 CA ASN A 22 16.028 0.823 0.134 1.00 0.00 C ATOM 282 C ASN A 22 14.589 1.014 -0.347 1.00 0.00 C ATOM 283 O ASN A 22 14.358 1.572 -1.419 1.00 0.00 O ATOM 284 CB ASN A 22 16.465 -0.597 -0.230 1.00 0.00 C ATOM 285 CG ASN A 22 17.895 -0.609 -0.775 1.00 0.00 C ATOM 286 OD1 ASN A 22 18.289 0.225 -1.573 1.00 0.00 O ATOM 287 ND2 ASN A 22 18.646 -1.598 -0.300 1.00 0.00 N ATOM 0 H ASN A 22 15.675 0.289 2.129 1.00 0.00 H new ATOM 0 HA ASN A 22 16.699 1.538 -0.341 1.00 0.00 H new ATOM 0 HB2 ASN A 22 16.402 -1.237 0.650 1.00 0.00 H new ATOM 0 HB3 ASN A 22 15.785 -1.011 -0.975 1.00 0.00 H new ATOM 0 HD21 ASN A 22 19.616 -1.692 -0.602 1.00 0.00 H new ATOM 0 HD22 ASN A 22 18.252 -2.262 0.367 1.00 0.00 H new ATOM 294 N ILE A 23 13.658 0.539 0.468 1.00 0.00 N ATOM 295 CA ILE A 23 12.247 0.650 0.138 1.00 0.00 C ATOM 296 C ILE A 23 11.882 2.126 -0.032 1.00 0.00 C ATOM 297 O ILE A 23 12.201 2.951 0.823 1.00 0.00 O ATOM 298 CB ILE A 23 11.395 -0.078 1.179 1.00 0.00 C ATOM 299 CG1 ILE A 23 11.219 -1.552 0.810 1.00 0.00 C ATOM 300 CG2 ILE A 23 10.052 0.627 1.379 1.00 0.00 C ATOM 301 CD1 ILE A 23 11.521 -2.457 2.006 1.00 0.00 C ATOM 0 H ILE A 23 13.853 0.077 1.356 1.00 0.00 H new ATOM 0 HA ILE A 23 12.038 0.158 -0.812 1.00 0.00 H new ATOM 0 HB ILE A 23 11.921 -0.046 2.133 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.199 -1.725 0.467 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.881 -1.805 -0.018 1.00 0.00 H new ATOM 0 HG21 ILE A 23 9.466 0.089 2.124 1.00 0.00 H new ATOM 0 HG22 ILE A 23 10.224 1.648 1.721 1.00 0.00 H new ATOM 0 HG23 ILE A 23 9.508 0.647 0.435 1.00 0.00 H new ATOM 0 HD11 ILE A 23 11.388 -3.499 1.716 1.00 0.00 H new ATOM 0 HD12 ILE A 23 12.549 -2.299 2.331 1.00 0.00 H new ATOM 0 HD13 ILE A 23 10.841 -2.218 2.824 1.00 0.00 H new ATOM 313 N GLN A 24 11.219 2.414 -1.143 1.00 0.00 N ATOM 314 CA GLN A 24 10.808 3.776 -1.436 1.00 0.00 C ATOM 315 C GLN A 24 9.281 3.881 -1.438 1.00 0.00 C ATOM 316 O GLN A 24 8.729 4.954 -1.201 1.00 0.00 O ATOM 317 CB GLN A 24 11.391 4.250 -2.769 1.00 0.00 C ATOM 318 CG GLN A 24 12.011 5.642 -2.632 1.00 0.00 C ATOM 319 CD GLN A 24 10.967 6.734 -2.874 1.00 0.00 C ATOM 320 OE1 GLN A 24 10.626 7.509 -1.996 1.00 0.00 O ATOM 321 NE2 GLN A 24 10.481 6.752 -4.112 1.00 0.00 N ATOM 0 H GLN A 24 10.957 1.727 -1.850 1.00 0.00 H new ATOM 0 HA GLN A 24 11.197 4.428 -0.654 1.00 0.00 H new ATOM 0 HB2 GLN A 24 12.147 3.543 -3.111 1.00 0.00 H new ATOM 0 HB3 GLN A 24 10.607 4.270 -3.526 1.00 0.00 H new ATOM 0 HG2 GLN A 24 12.438 5.757 -1.636 1.00 0.00 H new ATOM 0 HG3 GLN A 24 12.829 5.751 -3.344 1.00 0.00 H new ATOM 0 HE21 GLN A 24 10.810 6.074 -4.799 1.00 0.00 H new ATOM 0 HE22 GLN A 24 9.779 7.444 -4.374 1.00 0.00 H new ATOM 330 N SER A 25 8.643 2.752 -1.707 1.00 0.00 N ATOM 331 CA SER A 25 7.191 2.703 -1.742 1.00 0.00 C ATOM 332 C SER A 25 6.703 1.318 -1.310 1.00 0.00 C ATOM 333 O SER A 25 7.483 0.368 -1.264 1.00 0.00 O ATOM 334 CB SER A 25 6.662 3.040 -3.137 1.00 0.00 C ATOM 335 OG SER A 25 7.665 3.629 -3.960 1.00 0.00 O ATOM 0 H SER A 25 9.105 1.864 -1.903 1.00 0.00 H new ATOM 0 HA SER A 25 6.807 3.450 -1.047 1.00 0.00 H new ATOM 0 HB2 SER A 25 6.290 2.133 -3.613 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.818 3.724 -3.049 1.00 0.00 H new ATOM 0 HG SER A 25 7.289 3.828 -4.843 1.00 0.00 H new ATOM 341 N VAL A 26 5.416 1.249 -1.003 1.00 0.00 N ATOM 342 CA VAL A 26 4.816 -0.003 -0.576 1.00 0.00 C ATOM 343 C VAL A 26 3.545 -0.258 -1.389 1.00 0.00 C ATOM 344 O VAL A 26 2.726 0.643 -1.566 1.00 0.00 O ATOM 345 CB VAL A 26 4.564 0.025 0.933 1.00 0.00 C ATOM 346 CG1 VAL A 26 3.603 -1.091 1.350 1.00 0.00 C ATOM 347 CG2 VAL A 26 5.879 -0.066 1.710 1.00 0.00 C ATOM 0 H VAL A 26 4.773 2.040 -1.042 1.00 0.00 H new ATOM 0 HA VAL A 26 5.495 -0.835 -0.764 1.00 0.00 H new ATOM 0 HB VAL A 26 4.096 0.979 1.176 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.441 -1.048 2.427 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.651 -0.963 0.835 1.00 0.00 H new ATOM 0 HG13 VAL A 26 4.031 -2.058 1.086 1.00 0.00 H new ATOM 0 HG21 VAL A 26 5.672 -0.044 2.780 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.387 -0.997 1.458 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.516 0.778 1.447 1.00 0.00 H new ATOM 357 N LYS A 27 3.420 -1.489 -1.862 1.00 0.00 N ATOM 358 CA LYS A 27 2.263 -1.874 -2.652 1.00 0.00 C ATOM 359 C LYS A 27 1.591 -3.087 -2.007 1.00 0.00 C ATOM 360 O LYS A 27 2.221 -4.128 -1.828 1.00 0.00 O ATOM 361 CB LYS A 27 2.661 -2.095 -4.113 1.00 0.00 C ATOM 362 CG LYS A 27 1.467 -2.574 -4.940 1.00 0.00 C ATOM 363 CD LYS A 27 0.256 -1.662 -4.733 1.00 0.00 C ATOM 364 CE LYS A 27 -0.939 -2.141 -5.560 1.00 0.00 C ATOM 365 NZ LYS A 27 -0.822 -1.672 -6.959 1.00 0.00 N ATOM 0 H LYS A 27 4.101 -2.233 -1.713 1.00 0.00 H new ATOM 0 HA LYS A 27 1.526 -1.071 -2.665 1.00 0.00 H new ATOM 0 HB2 LYS A 27 3.049 -1.167 -4.532 1.00 0.00 H new ATOM 0 HB3 LYS A 27 3.464 -2.830 -4.168 1.00 0.00 H new ATOM 0 HG2 LYS A 27 1.736 -2.593 -5.996 1.00 0.00 H new ATOM 0 HG3 LYS A 27 1.210 -3.595 -4.658 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -0.013 -1.642 -3.677 1.00 0.00 H new ATOM 0 HD3 LYS A 27 0.513 -0.641 -5.016 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -0.991 -3.230 -5.538 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -1.865 -1.769 -5.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -1.641 -2.006 -7.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -0.795 -0.632 -6.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 0.052 -2.048 -7.379 1.00 0.00 H new ATOM 379 N VAL A 28 0.320 -2.913 -1.676 1.00 0.00 N ATOM 380 CA VAL A 28 -0.445 -3.981 -1.055 1.00 0.00 C ATOM 381 C VAL A 28 -1.573 -4.408 -1.995 1.00 0.00 C ATOM 382 O VAL A 28 -2.431 -3.600 -2.349 1.00 0.00 O ATOM 383 CB VAL A 28 -0.949 -3.533 0.319 1.00 0.00 C ATOM 384 CG1 VAL A 28 -2.108 -4.413 0.791 1.00 0.00 C ATOM 385 CG2 VAL A 28 0.187 -3.525 1.344 1.00 0.00 C ATOM 0 H VAL A 28 -0.199 -2.048 -1.826 1.00 0.00 H new ATOM 0 HA VAL A 28 0.185 -4.854 -0.887 1.00 0.00 H new ATOM 0 HB VAL A 28 -1.321 -2.513 0.224 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.447 -4.074 1.770 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.930 -4.345 0.078 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.774 -5.448 0.862 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -0.198 -3.203 2.311 1.00 0.00 H new ATOM 0 HG22 VAL A 28 0.602 -4.529 1.435 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.967 -2.838 1.017 1.00 0.00 H new ATOM 395 N LYS A 29 -1.536 -5.678 -2.374 1.00 0.00 N ATOM 396 CA LYS A 29 -2.545 -6.222 -3.266 1.00 0.00 C ATOM 397 C LYS A 29 -3.195 -7.443 -2.611 1.00 0.00 C ATOM 398 O LYS A 29 -2.770 -8.574 -2.841 1.00 0.00 O ATOM 399 CB LYS A 29 -1.943 -6.510 -4.643 1.00 0.00 C ATOM 400 CG LYS A 29 -3.036 -6.620 -5.708 1.00 0.00 C ATOM 401 CD LYS A 29 -3.646 -8.023 -5.725 1.00 0.00 C ATOM 402 CE LYS A 29 -3.653 -8.601 -7.141 1.00 0.00 C ATOM 403 NZ LYS A 29 -4.676 -9.663 -7.263 1.00 0.00 N ATOM 0 H LYS A 29 -0.823 -6.345 -2.079 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.337 -5.492 -3.436 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -1.247 -5.716 -4.912 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -1.371 -7.437 -4.607 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -3.815 -5.883 -5.512 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -2.618 -6.389 -6.688 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -3.079 -8.678 -5.064 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.665 -7.985 -5.339 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -3.855 -7.809 -7.862 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -2.670 -9.006 -7.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -4.667 -10.044 -8.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -4.466 -10.426 -6.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -5.615 -9.266 -7.056 1.00 0.00 H new ATOM 417 N SER A 30 -4.213 -7.172 -1.808 1.00 0.00 N ATOM 418 CA SER A 30 -4.925 -8.234 -1.118 1.00 0.00 C ATOM 419 C SER A 30 -5.359 -9.308 -2.118 1.00 0.00 C ATOM 420 O SER A 30 -5.179 -9.148 -3.324 1.00 0.00 O ATOM 421 CB SER A 30 -6.140 -7.685 -0.368 1.00 0.00 C ATOM 422 OG SER A 30 -7.367 -8.131 -0.939 1.00 0.00 O ATOM 0 H SER A 30 -4.562 -6.232 -1.620 1.00 0.00 H new ATOM 0 HA SER A 30 -4.251 -8.679 -0.386 1.00 0.00 H new ATOM 0 HB2 SER A 30 -6.092 -7.995 0.676 1.00 0.00 H new ATOM 0 HB3 SER A 30 -6.110 -6.595 -0.378 1.00 0.00 H new ATOM 0 HG SER A 30 -8.118 -7.760 -0.431 1.00 0.00 H new ATOM 428 N PRO A 31 -5.937 -10.408 -1.565 1.00 0.00 N ATOM 429 CA PRO A 31 -6.398 -11.508 -2.394 1.00 0.00 C ATOM 430 C PRO A 31 -7.698 -11.144 -3.115 1.00 0.00 C ATOM 431 O PRO A 31 -8.322 -10.130 -2.804 1.00 0.00 O ATOM 432 CB PRO A 31 -6.557 -12.681 -1.440 1.00 0.00 C ATOM 433 CG PRO A 31 -6.627 -12.077 -0.047 1.00 0.00 C ATOM 434 CD PRO A 31 -6.167 -10.632 -0.140 1.00 0.00 C ATOM 0 HA PRO A 31 -5.698 -11.754 -3.193 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -7.460 -13.249 -1.666 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -5.717 -13.371 -1.525 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -7.644 -12.129 0.341 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -5.994 -12.635 0.643 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -6.922 -9.950 0.251 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -5.258 -10.468 0.439 1.00 0.00 H new ATOM 442 N GLY A 32 -8.068 -11.991 -4.064 1.00 0.00 N ATOM 443 CA GLY A 32 -9.282 -11.772 -4.832 1.00 0.00 C ATOM 444 C GLY A 32 -9.994 -13.094 -5.121 1.00 0.00 C ATOM 445 O GLY A 32 -9.767 -14.089 -4.435 1.00 0.00 O ATOM 0 H GLY A 32 -7.548 -12.831 -4.319 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -9.949 -11.108 -4.282 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -9.038 -11.274 -5.770 1.00 0.00 H new ATOM 449 N PRO A 33 -10.864 -13.062 -6.167 1.00 0.00 N ATOM 450 CA PRO A 33 -11.611 -14.246 -6.556 1.00 0.00 C ATOM 451 C PRO A 33 -10.713 -15.244 -7.289 1.00 0.00 C ATOM 452 O PRO A 33 -11.174 -16.301 -7.717 1.00 0.00 O ATOM 453 CB PRO A 33 -12.750 -13.727 -7.418 1.00 0.00 C ATOM 454 CG PRO A 33 -12.335 -12.333 -7.862 1.00 0.00 C ATOM 455 CD PRO A 33 -11.158 -11.901 -7.002 1.00 0.00 C ATOM 0 HA PRO A 33 -11.998 -14.800 -5.700 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -12.917 -14.377 -8.277 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -13.683 -13.696 -6.855 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -12.057 -12.335 -8.916 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -13.165 -11.635 -7.752 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -10.299 -11.626 -7.615 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -11.409 -11.030 -6.396 1.00 0.00 H new ATOM 463 N HIS A 34 -9.447 -14.873 -7.412 1.00 0.00 N ATOM 464 CA HIS A 34 -8.480 -15.723 -8.086 1.00 0.00 C ATOM 465 C HIS A 34 -7.442 -16.219 -7.078 1.00 0.00 C ATOM 466 O HIS A 34 -7.160 -17.415 -7.008 1.00 0.00 O ATOM 467 CB HIS A 34 -7.851 -14.993 -9.275 1.00 0.00 C ATOM 468 CG HIS A 34 -7.708 -13.503 -9.075 1.00 0.00 C ATOM 469 ND1 HIS A 34 -8.796 -12.655 -8.959 1.00 0.00 N ATOM 470 CD2 HIS A 34 -6.596 -12.720 -8.971 1.00 0.00 C ATOM 471 CE1 HIS A 34 -8.347 -11.419 -8.794 1.00 0.00 C ATOM 472 NE2 HIS A 34 -6.983 -11.462 -8.803 1.00 0.00 N ATOM 0 H HIS A 34 -9.068 -13.995 -7.056 1.00 0.00 H new ATOM 0 HA HIS A 34 -8.983 -16.598 -8.496 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -6.867 -15.419 -9.471 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -8.459 -15.174 -10.162 1.00 0.00 H new ATOM 0 HD1 HIS A 34 -9.776 -12.934 -8.994 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -5.574 -13.065 -9.018 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -8.954 -10.534 -8.674 1.00 0.00 H new ATOM 480 N CYS A 35 -6.900 -15.275 -6.322 1.00 0.00 N ATOM 481 CA CYS A 35 -5.899 -15.602 -5.321 1.00 0.00 C ATOM 482 C CYS A 35 -6.495 -15.328 -3.938 1.00 0.00 C ATOM 483 O CYS A 35 -6.957 -14.222 -3.665 1.00 0.00 O ATOM 484 CB CYS A 35 -4.600 -14.825 -5.546 1.00 0.00 C ATOM 485 SG CYS A 35 -3.096 -15.861 -5.657 1.00 0.00 S ATOM 0 H CYS A 35 -7.135 -14.284 -6.383 1.00 0.00 H new ATOM 0 HA CYS A 35 -5.634 -16.656 -5.399 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -4.694 -14.246 -6.465 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -4.474 -14.112 -4.731 1.00 0.00 H new ATOM 490 N ALA A 36 -6.466 -16.356 -3.103 1.00 0.00 N ATOM 491 CA ALA A 36 -6.997 -16.241 -1.755 1.00 0.00 C ATOM 492 C ALA A 36 -5.850 -15.969 -0.780 1.00 0.00 C ATOM 493 O ALA A 36 -5.961 -16.257 0.410 1.00 0.00 O ATOM 494 CB ALA A 36 -7.774 -17.511 -1.402 1.00 0.00 C ATOM 0 H ALA A 36 -6.083 -17.273 -3.334 1.00 0.00 H new ATOM 0 HA ALA A 36 -7.692 -15.404 -1.687 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -8.172 -17.425 -0.391 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -8.596 -17.642 -2.106 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -7.108 -18.372 -1.457 1.00 0.00 H new ATOM 500 N GLN A 37 -4.774 -15.418 -1.322 1.00 0.00 N ATOM 501 CA GLN A 37 -3.607 -15.105 -0.515 1.00 0.00 C ATOM 502 C GLN A 37 -3.154 -13.666 -0.772 1.00 0.00 C ATOM 503 O GLN A 37 -3.483 -13.083 -1.805 1.00 0.00 O ATOM 504 CB GLN A 37 -2.471 -16.093 -0.785 1.00 0.00 C ATOM 505 CG GLN A 37 -2.987 -17.534 -0.786 1.00 0.00 C ATOM 506 CD GLN A 37 -2.617 -18.248 -2.088 1.00 0.00 C ATOM 507 OE1 GLN A 37 -1.757 -17.818 -2.839 1.00 0.00 O ATOM 508 NE2 GLN A 37 -3.313 -19.359 -2.312 1.00 0.00 N ATOM 0 H GLN A 37 -4.686 -15.180 -2.310 1.00 0.00 H new ATOM 0 HA GLN A 37 -3.882 -15.197 0.536 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -2.009 -15.868 -1.746 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -1.698 -15.980 -0.025 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -2.567 -18.075 0.062 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -4.070 -17.536 -0.661 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -4.019 -19.662 -1.641 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -3.141 -19.908 -3.154 1.00 0.00 H new ATOM 517 N THR A 38 -2.407 -13.134 0.184 1.00 0.00 N ATOM 518 CA THR A 38 -1.906 -11.775 0.073 1.00 0.00 C ATOM 519 C THR A 38 -0.547 -11.763 -0.630 1.00 0.00 C ATOM 520 O THR A 38 0.157 -12.771 -0.645 1.00 0.00 O ATOM 521 CB THR A 38 -1.868 -11.169 1.478 1.00 0.00 C ATOM 522 OG1 THR A 38 -3.076 -11.621 2.083 1.00 0.00 O ATOM 523 CG2 THR A 38 -2.006 -9.645 1.462 1.00 0.00 C ATOM 0 H THR A 38 -2.137 -13.620 1.039 1.00 0.00 H new ATOM 0 HA THR A 38 -2.562 -11.161 -0.544 1.00 0.00 H new ATOM 0 HB THR A 38 -0.933 -11.443 1.967 1.00 0.00 H new ATOM 0 HG1 THR A 38 -3.133 -11.276 2.998 1.00 0.00 H new ATOM 0 HG21 THR A 38 -1.973 -9.266 2.483 1.00 0.00 H new ATOM 0 HG22 THR A 38 -1.187 -9.212 0.887 1.00 0.00 H new ATOM 0 HG23 THR A 38 -2.956 -9.370 1.004 1.00 0.00 H new ATOM 531 N GLU A 39 -0.220 -10.610 -1.197 1.00 0.00 N ATOM 532 CA GLU A 39 1.042 -10.454 -1.900 1.00 0.00 C ATOM 533 C GLU A 39 1.575 -9.031 -1.722 1.00 0.00 C ATOM 534 O GLU A 39 1.552 -8.234 -2.659 1.00 0.00 O ATOM 535 CB GLU A 39 0.890 -10.801 -3.382 1.00 0.00 C ATOM 536 CG GLU A 39 -0.505 -10.432 -3.892 1.00 0.00 C ATOM 537 CD GLU A 39 -1.399 -11.670 -3.988 1.00 0.00 C ATOM 538 OE1 GLU A 39 -1.490 -12.385 -2.967 1.00 0.00 O ATOM 539 OE2 GLU A 39 -1.971 -11.874 -5.081 1.00 0.00 O ATOM 0 H GLU A 39 -0.807 -9.776 -1.184 1.00 0.00 H new ATOM 0 HA GLU A 39 1.764 -11.148 -1.470 1.00 0.00 H new ATOM 0 HB2 GLU A 39 1.645 -10.271 -3.962 1.00 0.00 H new ATOM 0 HB3 GLU A 39 1.065 -11.867 -3.529 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -0.960 -9.702 -3.222 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -0.425 -9.960 -4.871 1.00 0.00 H new ATOM 546 N VAL A 40 2.044 -8.756 -0.514 1.00 0.00 N ATOM 547 CA VAL A 40 2.583 -7.443 -0.201 1.00 0.00 C ATOM 548 C VAL A 40 3.840 -7.200 -1.039 1.00 0.00 C ATOM 549 O VAL A 40 4.691 -8.080 -1.158 1.00 0.00 O ATOM 550 CB VAL A 40 2.835 -7.326 1.303 1.00 0.00 C ATOM 551 CG1 VAL A 40 3.262 -5.905 1.678 1.00 0.00 C ATOM 552 CG2 VAL A 40 1.603 -7.756 2.101 1.00 0.00 C ATOM 0 H VAL A 40 2.062 -9.420 0.260 1.00 0.00 H new ATOM 0 HA VAL A 40 1.865 -6.664 -0.458 1.00 0.00 H new ATOM 0 HB VAL A 40 3.652 -8.001 1.559 1.00 0.00 H new ATOM 0 HG11 VAL A 40 3.435 -5.849 2.753 1.00 0.00 H new ATOM 0 HG12 VAL A 40 4.180 -5.649 1.149 1.00 0.00 H new ATOM 0 HG13 VAL A 40 2.476 -5.203 1.400 1.00 0.00 H new ATOM 0 HG21 VAL A 40 1.809 -7.663 3.167 1.00 0.00 H new ATOM 0 HG22 VAL A 40 0.759 -7.119 1.838 1.00 0.00 H new ATOM 0 HG23 VAL A 40 1.362 -8.793 1.867 1.00 0.00 H new ATOM 562 N ILE A 41 3.918 -6.001 -1.597 1.00 0.00 N ATOM 563 CA ILE A 41 5.057 -5.631 -2.420 1.00 0.00 C ATOM 564 C ILE A 41 5.580 -4.264 -1.974 1.00 0.00 C ATOM 565 O ILE A 41 4.838 -3.468 -1.401 1.00 0.00 O ATOM 566 CB ILE A 41 4.688 -5.693 -3.904 1.00 0.00 C ATOM 567 CG1 ILE A 41 3.993 -7.014 -4.241 1.00 0.00 C ATOM 568 CG2 ILE A 41 5.916 -5.450 -4.784 1.00 0.00 C ATOM 569 CD1 ILE A 41 2.541 -6.777 -4.661 1.00 0.00 C ATOM 0 H ILE A 41 3.211 -5.273 -1.495 1.00 0.00 H new ATOM 0 HA ILE A 41 5.871 -6.344 -2.287 1.00 0.00 H new ATOM 0 HB ILE A 41 3.978 -4.893 -4.114 1.00 0.00 H new ATOM 0 HG12 ILE A 41 4.530 -7.517 -5.045 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.022 -7.676 -3.375 1.00 0.00 H new ATOM 0 HG21 ILE A 41 5.627 -5.499 -5.834 1.00 0.00 H new ATOM 0 HG22 ILE A 41 6.330 -4.465 -4.567 1.00 0.00 H new ATOM 0 HG23 ILE A 41 6.667 -6.212 -4.578 1.00 0.00 H new ATOM 0 HD11 ILE A 41 2.070 -7.731 -4.895 1.00 0.00 H new ATOM 0 HD12 ILE A 41 2.000 -6.296 -3.846 1.00 0.00 H new ATOM 0 HD13 ILE A 41 2.517 -6.135 -5.541 1.00 0.00 H new ATOM 581 N ALA A 42 6.855 -4.035 -2.253 1.00 0.00 N ATOM 582 CA ALA A 42 7.487 -2.778 -1.887 1.00 0.00 C ATOM 583 C ALA A 42 8.439 -2.347 -3.004 1.00 0.00 C ATOM 584 O ALA A 42 9.227 -3.152 -3.498 1.00 0.00 O ATOM 585 CB ALA A 42 8.199 -2.938 -0.543 1.00 0.00 C ATOM 0 H ALA A 42 7.467 -4.698 -2.728 1.00 0.00 H new ATOM 0 HA ALA A 42 6.741 -1.992 -1.769 1.00 0.00 H new ATOM 0 HB1 ALA A 42 8.673 -1.996 -0.268 1.00 0.00 H new ATOM 0 HB2 ALA A 42 7.474 -3.216 0.222 1.00 0.00 H new ATOM 0 HB3 ALA A 42 8.958 -3.716 -0.624 1.00 0.00 H new ATOM 591 N THR A 43 8.335 -1.078 -3.370 1.00 0.00 N ATOM 592 CA THR A 43 9.177 -0.530 -4.419 1.00 0.00 C ATOM 593 C THR A 43 10.527 -0.092 -3.846 1.00 0.00 C ATOM 594 O THR A 43 10.588 0.474 -2.756 1.00 0.00 O ATOM 595 CB THR A 43 8.408 0.606 -5.098 1.00 0.00 C ATOM 596 OG1 THR A 43 7.354 -0.055 -5.793 1.00 0.00 O ATOM 597 CG2 THR A 43 9.219 1.282 -6.206 1.00 0.00 C ATOM 0 H THR A 43 7.680 -0.413 -2.958 1.00 0.00 H new ATOM 0 HA THR A 43 9.408 -1.282 -5.173 1.00 0.00 H new ATOM 0 HB THR A 43 8.124 1.348 -4.352 1.00 0.00 H new ATOM 0 HG1 THR A 43 7.007 0.532 -6.497 1.00 0.00 H new ATOM 0 HG21 THR A 43 8.627 2.080 -6.655 1.00 0.00 H new ATOM 0 HG22 THR A 43 10.133 1.701 -5.784 1.00 0.00 H new ATOM 0 HG23 THR A 43 9.475 0.547 -6.969 1.00 0.00 H new ATOM 605 N LEU A 44 11.575 -0.371 -4.607 1.00 0.00 N ATOM 606 CA LEU A 44 12.920 -0.013 -4.189 1.00 0.00 C ATOM 607 C LEU A 44 13.236 1.407 -4.664 1.00 0.00 C ATOM 608 O LEU A 44 12.721 1.852 -5.688 1.00 0.00 O ATOM 609 CB LEU A 44 13.926 -1.060 -4.669 1.00 0.00 C ATOM 610 CG LEU A 44 14.916 -1.570 -3.620 1.00 0.00 C ATOM 611 CD1 LEU A 44 15.538 -2.899 -4.052 1.00 0.00 C ATOM 612 CD2 LEU A 44 15.979 -0.513 -3.311 1.00 0.00 C ATOM 0 H LEU A 44 11.520 -0.841 -5.511 1.00 0.00 H new ATOM 0 HA LEU A 44 12.993 -0.009 -3.101 1.00 0.00 H new ATOM 0 HB2 LEU A 44 13.373 -1.913 -5.062 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.492 -0.637 -5.499 1.00 0.00 H new ATOM 0 HG LEU A 44 14.369 -1.757 -2.696 1.00 0.00 H new ATOM 0 HD11 LEU A 44 16.238 -3.239 -3.288 1.00 0.00 H new ATOM 0 HD12 LEU A 44 14.752 -3.643 -4.181 1.00 0.00 H new ATOM 0 HD13 LEU A 44 16.068 -2.763 -4.995 1.00 0.00 H new ATOM 0 HD21 LEU A 44 16.670 -0.900 -2.563 1.00 0.00 H new ATOM 0 HD22 LEU A 44 16.528 -0.272 -4.221 1.00 0.00 H new ATOM 0 HD23 LEU A 44 15.497 0.387 -2.929 1.00 0.00 H new ATOM 624 N LYS A 45 14.082 2.078 -3.896 1.00 0.00 N ATOM 625 CA LYS A 45 14.473 3.438 -4.225 1.00 0.00 C ATOM 626 C LYS A 45 15.437 3.414 -5.412 1.00 0.00 C ATOM 627 O LYS A 45 15.834 4.464 -5.916 1.00 0.00 O ATOM 628 CB LYS A 45 15.034 4.148 -2.991 1.00 0.00 C ATOM 629 CG LYS A 45 15.997 5.267 -3.393 1.00 0.00 C ATOM 630 CD LYS A 45 15.275 6.347 -4.201 1.00 0.00 C ATOM 631 CE LYS A 45 14.954 7.562 -3.329 1.00 0.00 C ATOM 632 NZ LYS A 45 13.790 8.298 -3.873 1.00 0.00 N ATOM 0 H LYS A 45 14.507 1.705 -3.047 1.00 0.00 H new ATOM 0 HA LYS A 45 13.604 4.020 -4.531 1.00 0.00 H new ATOM 0 HB2 LYS A 45 14.216 4.562 -2.402 1.00 0.00 H new ATOM 0 HB3 LYS A 45 15.552 3.428 -2.357 1.00 0.00 H new ATOM 0 HG2 LYS A 45 16.439 5.710 -2.500 1.00 0.00 H new ATOM 0 HG3 LYS A 45 16.816 4.853 -3.982 1.00 0.00 H new ATOM 0 HD2 LYS A 45 15.897 6.653 -5.042 1.00 0.00 H new ATOM 0 HD3 LYS A 45 14.353 5.940 -4.617 1.00 0.00 H new ATOM 0 HE2 LYS A 45 14.744 7.240 -2.309 1.00 0.00 H new ATOM 0 HE3 LYS A 45 15.820 8.222 -3.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 13.276 8.758 -3.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 14.119 9.020 -4.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 13.157 7.633 -4.362 1.00 0.00 H new ATOM 646 N ASN A 46 15.786 2.205 -5.826 1.00 0.00 N ATOM 647 CA ASN A 46 16.696 2.030 -6.944 1.00 0.00 C ATOM 648 C ASN A 46 15.892 1.710 -8.206 1.00 0.00 C ATOM 649 O ASN A 46 16.444 1.663 -9.304 1.00 0.00 O ATOM 650 CB ASN A 46 17.662 0.870 -6.693 1.00 0.00 C ATOM 651 CG ASN A 46 17.891 0.060 -7.971 1.00 0.00 C ATOM 652 OD1 ASN A 46 18.450 0.534 -8.946 1.00 0.00 O ATOM 653 ND2 ASN A 46 17.428 -1.185 -7.912 1.00 0.00 N ATOM 0 H ASN A 46 15.454 1.336 -5.406 1.00 0.00 H new ATOM 0 HA ASN A 46 17.264 2.953 -7.063 1.00 0.00 H new ATOM 0 HB2 ASN A 46 18.613 1.257 -6.328 1.00 0.00 H new ATOM 0 HB3 ASN A 46 17.262 0.221 -5.914 1.00 0.00 H new ATOM 0 HD21 ASN A 46 17.531 -1.806 -8.714 1.00 0.00 H new ATOM 0 HD22 ASN A 46 16.970 -1.519 -7.064 1.00 0.00 H new ATOM 660 N GLY A 47 14.599 1.498 -8.007 1.00 0.00 N ATOM 661 CA GLY A 47 13.713 1.184 -9.114 1.00 0.00 C ATOM 662 C GLY A 47 13.287 -0.285 -9.076 1.00 0.00 C ATOM 663 O GLY A 47 12.423 -0.705 -9.845 1.00 0.00 O ATOM 0 H GLY A 47 14.144 1.538 -7.095 1.00 0.00 H new ATOM 0 HA2 GLY A 47 12.831 1.823 -9.071 1.00 0.00 H new ATOM 0 HA3 GLY A 47 14.215 1.396 -10.058 1.00 0.00 H new ATOM 667 N GLN A 48 13.913 -1.027 -8.174 1.00 0.00 N ATOM 668 CA GLN A 48 13.610 -2.440 -8.026 1.00 0.00 C ATOM 669 C GLN A 48 12.385 -2.629 -7.128 1.00 0.00 C ATOM 670 O GLN A 48 11.739 -1.656 -6.742 1.00 0.00 O ATOM 671 CB GLN A 48 14.816 -3.204 -7.476 1.00 0.00 C ATOM 672 CG GLN A 48 15.725 -3.683 -8.609 1.00 0.00 C ATOM 673 CD GLN A 48 17.008 -4.308 -8.057 1.00 0.00 C ATOM 674 OE1 GLN A 48 17.457 -4.002 -6.965 1.00 0.00 O ATOM 675 NE2 GLN A 48 17.569 -5.198 -8.869 1.00 0.00 N ATOM 0 H GLN A 48 14.629 -0.676 -7.538 1.00 0.00 H new ATOM 0 HA GLN A 48 13.381 -2.848 -9.010 1.00 0.00 H new ATOM 0 HB2 GLN A 48 15.380 -2.562 -6.799 1.00 0.00 H new ATOM 0 HB3 GLN A 48 14.474 -4.059 -6.893 1.00 0.00 H new ATOM 0 HG2 GLN A 48 15.195 -4.413 -9.221 1.00 0.00 H new ATOM 0 HG3 GLN A 48 15.975 -2.844 -9.258 1.00 0.00 H new ATOM 0 HE21 GLN A 48 17.140 -5.407 -9.770 1.00 0.00 H new ATOM 0 HE22 GLN A 48 18.428 -5.672 -8.591 1.00 0.00 H new ATOM 684 N LYS A 49 12.103 -3.887 -6.824 1.00 0.00 N ATOM 685 CA LYS A 49 10.967 -4.215 -5.979 1.00 0.00 C ATOM 686 C LYS A 49 11.316 -5.426 -5.111 1.00 0.00 C ATOM 687 O LYS A 49 12.024 -6.329 -5.554 1.00 0.00 O ATOM 688 CB LYS A 49 9.708 -4.408 -6.826 1.00 0.00 C ATOM 689 CG LYS A 49 9.452 -3.189 -7.714 1.00 0.00 C ATOM 690 CD LYS A 49 8.125 -3.325 -8.463 1.00 0.00 C ATOM 691 CE LYS A 49 8.070 -2.371 -9.658 1.00 0.00 C ATOM 692 NZ LYS A 49 6.667 -2.031 -9.985 1.00 0.00 N ATOM 0 H LYS A 49 12.641 -4.691 -7.147 1.00 0.00 H new ATOM 0 HA LYS A 49 10.744 -3.390 -5.302 1.00 0.00 H new ATOM 0 HB2 LYS A 49 9.816 -5.298 -7.446 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.850 -4.575 -6.175 1.00 0.00 H new ATOM 0 HG2 LYS A 49 9.438 -2.286 -7.103 1.00 0.00 H new ATOM 0 HG3 LYS A 49 10.267 -3.078 -8.429 1.00 0.00 H new ATOM 0 HD2 LYS A 49 8.001 -4.352 -8.807 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.298 -3.113 -7.786 1.00 0.00 H new ATOM 0 HE2 LYS A 49 8.627 -1.462 -9.431 1.00 0.00 H new ATOM 0 HE3 LYS A 49 8.550 -2.832 -10.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 6.647 -1.383 -10.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 6.145 -2.899 -10.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 6.221 -1.572 -9.165 1.00 0.00 H new ATOM 706 N ALA A 50 10.803 -5.406 -3.890 1.00 0.00 N ATOM 707 CA ALA A 50 11.051 -6.491 -2.956 1.00 0.00 C ATOM 708 C ALA A 50 9.730 -6.918 -2.313 1.00 0.00 C ATOM 709 O ALA A 50 9.133 -6.160 -1.550 1.00 0.00 O ATOM 710 CB ALA A 50 12.086 -6.046 -1.920 1.00 0.00 C ATOM 0 H ALA A 50 10.216 -4.655 -3.526 1.00 0.00 H new ATOM 0 HA ALA A 50 11.460 -7.358 -3.475 1.00 0.00 H new ATOM 0 HB1 ALA A 50 12.272 -6.860 -1.219 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.015 -5.782 -2.424 1.00 0.00 H new ATOM 0 HB3 ALA A 50 11.708 -5.179 -1.378 1.00 0.00 H new ATOM 716 N CYS A 51 9.311 -8.130 -2.646 1.00 0.00 N ATOM 717 CA CYS A 51 8.071 -8.667 -2.111 1.00 0.00 C ATOM 718 C CYS A 51 8.292 -9.006 -0.636 1.00 0.00 C ATOM 719 O CYS A 51 9.331 -9.552 -0.269 1.00 0.00 O ATOM 720 CB CYS A 51 7.589 -9.879 -2.910 1.00 0.00 C ATOM 721 SG CYS A 51 6.201 -9.542 -4.053 1.00 0.00 S ATOM 0 H CYS A 51 9.808 -8.756 -3.280 1.00 0.00 H new ATOM 0 HA CYS A 51 7.281 -7.921 -2.197 1.00 0.00 H new ATOM 0 HB2 CYS A 51 8.427 -10.274 -3.485 1.00 0.00 H new ATOM 0 HB3 CYS A 51 7.285 -10.659 -2.212 1.00 0.00 H new ATOM 726 N LEU A 52 7.297 -8.668 0.171 1.00 0.00 N ATOM 727 CA LEU A 52 7.369 -8.930 1.599 1.00 0.00 C ATOM 728 C LEU A 52 6.287 -9.942 1.982 1.00 0.00 C ATOM 729 O LEU A 52 5.365 -10.194 1.208 1.00 0.00 O ATOM 730 CB LEU A 52 7.294 -7.622 2.388 1.00 0.00 C ATOM 731 CG LEU A 52 8.291 -6.535 1.981 1.00 0.00 C ATOM 732 CD1 LEU A 52 7.776 -5.147 2.365 1.00 0.00 C ATOM 733 CD2 LEU A 52 9.677 -6.815 2.566 1.00 0.00 C ATOM 0 H LEU A 52 6.436 -8.215 -0.137 1.00 0.00 H new ATOM 0 HA LEU A 52 8.330 -9.376 1.857 1.00 0.00 H new ATOM 0 HB2 LEU A 52 6.286 -7.218 2.289 1.00 0.00 H new ATOM 0 HB3 LEU A 52 7.444 -7.848 3.444 1.00 0.00 H new ATOM 0 HG LEU A 52 8.391 -6.552 0.896 1.00 0.00 H new ATOM 0 HD11 LEU A 52 8.504 -4.393 2.065 1.00 0.00 H new ATOM 0 HD12 LEU A 52 6.828 -4.958 1.861 1.00 0.00 H new ATOM 0 HD13 LEU A 52 7.629 -5.099 3.444 1.00 0.00 H new ATOM 0 HD21 LEU A 52 10.366 -6.027 2.261 1.00 0.00 H new ATOM 0 HD22 LEU A 52 9.614 -6.842 3.654 1.00 0.00 H new ATOM 0 HD23 LEU A 52 10.039 -7.776 2.200 1.00 0.00 H new ATOM 745 N ASN A 53 6.436 -10.495 3.177 1.00 0.00 N ATOM 746 CA ASN A 53 5.483 -11.473 3.673 1.00 0.00 C ATOM 747 C ASN A 53 4.506 -10.788 4.630 1.00 0.00 C ATOM 748 O ASN A 53 4.920 -10.190 5.623 1.00 0.00 O ATOM 749 CB ASN A 53 6.191 -12.591 4.441 1.00 0.00 C ATOM 750 CG ASN A 53 5.233 -13.747 4.734 1.00 0.00 C ATOM 751 OD1 ASN A 53 5.274 -14.178 5.992 1.00 0.00 O flip ATOM 752 ND2 ASN A 53 4.504 -14.217 3.876 1.00 0.00 N flip ATOM 0 H ASN A 53 7.203 -10.284 3.816 1.00 0.00 H new ATOM 0 HA ASN A 53 4.960 -11.898 2.816 1.00 0.00 H new ATOM 0 HB2 ASN A 53 7.039 -12.955 3.861 1.00 0.00 H new ATOM 0 HB3 ASN A 53 6.590 -12.198 5.376 1.00 0.00 H new ATOM 0 HD21 ASN A 53 4.522 -13.839 2.929 1.00 0.00 H new ATOM 0 HD22 ASN A 53 3.877 -14.988 4.106 1.00 0.00 H new ATOM 759 N PRO A 54 3.194 -10.901 4.290 1.00 0.00 N ATOM 760 CA PRO A 54 2.155 -10.299 5.108 1.00 0.00 C ATOM 761 C PRO A 54 1.928 -11.106 6.388 1.00 0.00 C ATOM 762 O PRO A 54 1.153 -10.701 7.252 1.00 0.00 O ATOM 763 CB PRO A 54 0.928 -10.250 4.211 1.00 0.00 C ATOM 764 CG PRO A 54 1.191 -11.242 3.090 1.00 0.00 C ATOM 765 CD PRO A 54 2.668 -11.601 3.122 1.00 0.00 C ATOM 0 HA PRO A 54 2.419 -9.300 5.455 1.00 0.00 H new ATOM 0 HB2 PRO A 54 0.028 -10.517 4.765 1.00 0.00 H new ATOM 0 HB3 PRO A 54 0.773 -9.246 3.816 1.00 0.00 H new ATOM 0 HG2 PRO A 54 0.578 -12.134 3.218 1.00 0.00 H new ATOM 0 HG3 PRO A 54 0.924 -10.808 2.126 1.00 0.00 H new ATOM 0 HD2 PRO A 54 2.812 -12.678 3.208 1.00 0.00 H new ATOM 0 HD3 PRO A 54 3.173 -11.284 2.209 1.00 0.00 H new ATOM 773 N ALA A 55 2.618 -12.234 6.468 1.00 0.00 N ATOM 774 CA ALA A 55 2.501 -13.102 7.627 1.00 0.00 C ATOM 775 C ALA A 55 3.712 -12.893 8.539 1.00 0.00 C ATOM 776 O ALA A 55 4.036 -13.755 9.355 1.00 0.00 O ATOM 777 CB ALA A 55 2.363 -14.555 7.166 1.00 0.00 C ATOM 0 H ALA A 55 3.260 -12.567 5.749 1.00 0.00 H new ATOM 0 HA ALA A 55 1.608 -12.856 8.202 1.00 0.00 H new ATOM 0 HB1 ALA A 55 2.275 -15.206 8.036 1.00 0.00 H new ATOM 0 HB2 ALA A 55 1.473 -14.657 6.545 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.243 -14.838 6.588 1.00 0.00 H new ATOM 783 N SER A 56 4.347 -11.742 8.371 1.00 0.00 N ATOM 784 CA SER A 56 5.515 -11.408 9.169 1.00 0.00 C ATOM 785 C SER A 56 5.258 -10.124 9.960 1.00 0.00 C ATOM 786 O SER A 56 4.597 -9.211 9.470 1.00 0.00 O ATOM 787 CB SER A 56 6.756 -11.250 8.289 1.00 0.00 C ATOM 788 OG SER A 56 7.836 -10.643 8.994 1.00 0.00 O ATOM 0 H SER A 56 4.075 -11.029 7.694 1.00 0.00 H new ATOM 0 HA SER A 56 5.699 -12.226 9.866 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.067 -12.228 7.922 1.00 0.00 H new ATOM 0 HB3 SER A 56 6.507 -10.646 7.416 1.00 0.00 H new ATOM 0 HG SER A 56 8.610 -10.561 8.399 1.00 0.00 H new ATOM 794 N PRO A 57 5.809 -10.095 11.203 1.00 0.00 N ATOM 795 CA PRO A 57 5.646 -8.938 12.067 1.00 0.00 C ATOM 796 C PRO A 57 6.536 -7.782 11.608 1.00 0.00 C ATOM 797 O PRO A 57 6.093 -6.635 11.558 1.00 0.00 O ATOM 798 CB PRO A 57 5.991 -9.437 13.461 1.00 0.00 C ATOM 799 CG PRO A 57 6.779 -10.721 13.262 1.00 0.00 C ATOM 800 CD PRO A 57 6.598 -11.159 11.817 1.00 0.00 C ATOM 0 HA PRO A 57 4.634 -8.533 12.043 1.00 0.00 H new ATOM 0 HB2 PRO A 57 6.579 -8.698 14.006 1.00 0.00 H new ATOM 0 HB3 PRO A 57 5.089 -9.619 14.045 1.00 0.00 H new ATOM 0 HG2 PRO A 57 7.834 -10.560 13.483 1.00 0.00 H new ATOM 0 HG3 PRO A 57 6.426 -11.495 13.943 1.00 0.00 H new ATOM 0 HD2 PRO A 57 7.559 -11.279 11.316 1.00 0.00 H new ATOM 0 HD3 PRO A 57 6.085 -12.119 11.755 1.00 0.00 H new ATOM 808 N MET A 58 7.775 -8.123 11.285 1.00 0.00 N ATOM 809 CA MET A 58 8.731 -7.127 10.832 1.00 0.00 C ATOM 810 C MET A 58 8.232 -6.423 9.569 1.00 0.00 C ATOM 811 O MET A 58 8.639 -5.298 9.279 1.00 0.00 O ATOM 812 CB MET A 58 10.074 -7.802 10.544 1.00 0.00 C ATOM 813 CG MET A 58 11.149 -6.765 10.214 1.00 0.00 C ATOM 814 SD MET A 58 12.244 -6.555 11.608 1.00 0.00 S ATOM 815 CE MET A 58 11.047 -6.265 12.900 1.00 0.00 C ATOM 0 H MET A 58 8.139 -9.075 11.328 1.00 0.00 H new ATOM 0 HA MET A 58 8.850 -6.381 11.618 1.00 0.00 H new ATOM 0 HB2 MET A 58 10.383 -8.389 11.409 1.00 0.00 H new ATOM 0 HB3 MET A 58 9.965 -8.496 9.711 1.00 0.00 H new ATOM 0 HG2 MET A 58 11.717 -7.084 9.340 1.00 0.00 H new ATOM 0 HG3 MET A 58 10.682 -5.813 9.961 1.00 0.00 H new ATOM 0 HE1 MET A 58 11.564 -5.990 13.820 1.00 0.00 H new ATOM 0 HE2 MET A 58 10.380 -5.456 12.603 1.00 0.00 H new ATOM 0 HE3 MET A 58 10.466 -7.172 13.068 1.00 0.00 H new ATOM 825 N VAL A 59 7.358 -7.113 8.851 1.00 0.00 N ATOM 826 CA VAL A 59 6.799 -6.567 7.626 1.00 0.00 C ATOM 827 C VAL A 59 5.745 -5.515 7.975 1.00 0.00 C ATOM 828 O VAL A 59 5.326 -4.741 7.116 1.00 0.00 O ATOM 829 CB VAL A 59 6.249 -7.697 6.753 1.00 0.00 C ATOM 830 CG1 VAL A 59 5.203 -7.170 5.769 1.00 0.00 C ATOM 831 CG2 VAL A 59 7.379 -8.421 6.018 1.00 0.00 C ATOM 0 H VAL A 59 7.023 -8.045 9.094 1.00 0.00 H new ATOM 0 HA VAL A 59 7.573 -6.070 7.042 1.00 0.00 H new ATOM 0 HB VAL A 59 5.759 -8.418 7.407 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.828 -7.993 5.161 1.00 0.00 H new ATOM 0 HG12 VAL A 59 4.377 -6.722 6.321 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.657 -6.419 5.123 1.00 0.00 H new ATOM 0 HG21 VAL A 59 6.961 -9.219 5.405 1.00 0.00 H new ATOM 0 HG22 VAL A 59 7.910 -7.714 5.381 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.072 -8.846 6.744 1.00 0.00 H new ATOM 841 N LYS A 60 5.347 -5.520 9.239 1.00 0.00 N ATOM 842 CA LYS A 60 4.349 -4.575 9.713 1.00 0.00 C ATOM 843 C LYS A 60 5.052 -3.389 10.377 1.00 0.00 C ATOM 844 O LYS A 60 4.397 -2.494 10.908 1.00 0.00 O ATOM 845 CB LYS A 60 3.336 -5.276 10.620 1.00 0.00 C ATOM 846 CG LYS A 60 2.914 -6.624 10.032 1.00 0.00 C ATOM 847 CD LYS A 60 1.903 -6.436 8.899 1.00 0.00 C ATOM 848 CE LYS A 60 0.480 -6.315 9.449 1.00 0.00 C ATOM 849 NZ LYS A 60 -0.477 -6.042 8.354 1.00 0.00 N ATOM 0 H LYS A 60 5.697 -6.163 9.949 1.00 0.00 H new ATOM 0 HA LYS A 60 3.772 -4.178 8.878 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.770 -5.426 11.608 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.459 -4.642 10.750 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.791 -7.152 9.658 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.478 -7.245 10.814 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.153 -5.542 8.328 1.00 0.00 H new ATOM 0 HD3 LYS A 60 1.961 -7.280 8.212 1.00 0.00 H new ATOM 0 HE2 LYS A 60 0.202 -7.236 9.961 1.00 0.00 H new ATOM 0 HE3 LYS A 60 0.436 -5.514 10.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -1.438 -5.963 8.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -0.220 -5.151 7.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -0.447 -6.820 7.664 1.00 0.00 H new ATOM 863 N LYS A 61 6.375 -3.421 10.324 1.00 0.00 N ATOM 864 CA LYS A 61 7.173 -2.359 10.913 1.00 0.00 C ATOM 865 C LYS A 61 7.979 -1.662 9.815 1.00 0.00 C ATOM 866 O LYS A 61 8.507 -0.572 10.025 1.00 0.00 O ATOM 867 CB LYS A 61 8.034 -2.906 12.054 1.00 0.00 C ATOM 868 CG LYS A 61 7.162 -3.492 13.167 1.00 0.00 C ATOM 869 CD LYS A 61 7.656 -3.042 14.543 1.00 0.00 C ATOM 870 CE LYS A 61 6.800 -3.648 15.657 1.00 0.00 C ATOM 871 NZ LYS A 61 7.659 -4.272 16.689 1.00 0.00 N ATOM 0 H LYS A 61 6.915 -4.165 9.882 1.00 0.00 H new ATOM 0 HA LYS A 61 6.528 -1.604 11.363 1.00 0.00 H new ATOM 0 HB2 LYS A 61 8.706 -3.674 11.671 1.00 0.00 H new ATOM 0 HB3 LYS A 61 8.658 -2.109 12.458 1.00 0.00 H new ATOM 0 HG2 LYS A 61 6.128 -3.178 13.027 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.175 -4.580 13.110 1.00 0.00 H new ATOM 0 HD2 LYS A 61 8.696 -3.340 14.675 1.00 0.00 H new ATOM 0 HD3 LYS A 61 7.626 -1.954 14.607 1.00 0.00 H new ATOM 0 HE2 LYS A 61 6.181 -2.874 16.110 1.00 0.00 H new ATOM 0 HE3 LYS A 61 6.123 -4.393 15.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 7.063 -4.679 17.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 8.231 -5.024 16.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 8.287 -3.552 17.100 1.00 0.00 H new ATOM 885 N ILE A 62 8.047 -2.321 8.667 1.00 0.00 N ATOM 886 CA ILE A 62 8.779 -1.778 7.535 1.00 0.00 C ATOM 887 C ILE A 62 7.816 -0.999 6.637 1.00 0.00 C ATOM 888 O ILE A 62 8.246 -0.214 5.794 1.00 0.00 O ATOM 889 CB ILE A 62 9.538 -2.889 6.806 1.00 0.00 C ATOM 890 CG1 ILE A 62 10.447 -3.655 7.769 1.00 0.00 C ATOM 891 CG2 ILE A 62 10.311 -2.330 5.610 1.00 0.00 C ATOM 892 CD1 ILE A 62 10.627 -5.105 7.316 1.00 0.00 C ATOM 0 H ILE A 62 7.607 -3.225 8.497 1.00 0.00 H new ATOM 0 HA ILE A 62 9.539 -1.074 7.874 1.00 0.00 H new ATOM 0 HB ILE A 62 8.811 -3.601 6.415 1.00 0.00 H new ATOM 0 HG12 ILE A 62 11.419 -3.164 7.825 1.00 0.00 H new ATOM 0 HG13 ILE A 62 10.021 -3.634 8.772 1.00 0.00 H new ATOM 0 HG21 ILE A 62 10.842 -3.140 5.109 1.00 0.00 H new ATOM 0 HG22 ILE A 62 9.615 -1.866 4.912 1.00 0.00 H new ATOM 0 HG23 ILE A 62 11.028 -1.586 5.956 1.00 0.00 H new ATOM 0 HD11 ILE A 62 11.277 -5.627 8.018 1.00 0.00 H new ATOM 0 HD12 ILE A 62 9.656 -5.599 7.284 1.00 0.00 H new ATOM 0 HD13 ILE A 62 11.076 -5.123 6.323 1.00 0.00 H new ATOM 904 N ILE A 63 6.531 -1.243 6.849 1.00 0.00 N ATOM 905 CA ILE A 63 5.504 -0.574 6.069 1.00 0.00 C ATOM 906 C ILE A 63 5.050 0.687 6.807 1.00 0.00 C ATOM 907 O ILE A 63 5.075 1.782 6.246 1.00 0.00 O ATOM 908 CB ILE A 63 4.363 -1.541 5.744 1.00 0.00 C ATOM 909 CG1 ILE A 63 4.787 -2.549 4.673 1.00 0.00 C ATOM 910 CG2 ILE A 63 3.097 -0.780 5.345 1.00 0.00 C ATOM 911 CD1 ILE A 63 3.962 -3.833 4.772 1.00 0.00 C ATOM 0 H ILE A 63 6.178 -1.895 7.550 1.00 0.00 H new ATOM 0 HA ILE A 63 5.904 -0.254 5.107 1.00 0.00 H new ATOM 0 HB ILE A 63 4.128 -2.108 6.645 1.00 0.00 H new ATOM 0 HG12 ILE A 63 4.663 -2.108 3.684 1.00 0.00 H new ATOM 0 HG13 ILE A 63 5.845 -2.783 4.787 1.00 0.00 H new ATOM 0 HG21 ILE A 63 2.302 -1.490 5.119 1.00 0.00 H new ATOM 0 HG22 ILE A 63 2.786 -0.136 6.167 1.00 0.00 H new ATOM 0 HG23 ILE A 63 3.301 -0.171 4.464 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.283 -4.532 4.000 1.00 0.00 H new ATOM 0 HD12 ILE A 63 4.107 -4.284 5.754 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.907 -3.599 4.633 1.00 0.00 H new ATOM 923 N GLU A 64 4.644 0.491 8.053 1.00 0.00 N ATOM 924 CA GLU A 64 4.185 1.599 8.873 1.00 0.00 C ATOM 925 C GLU A 64 5.237 2.710 8.902 1.00 0.00 C ATOM 926 O GLU A 64 4.896 3.892 8.930 1.00 0.00 O ATOM 927 CB GLU A 64 3.845 1.129 10.289 1.00 0.00 C ATOM 928 CG GLU A 64 2.622 0.210 10.282 1.00 0.00 C ATOM 929 CD GLU A 64 2.571 -0.644 11.551 1.00 0.00 C ATOM 930 OE1 GLU A 64 3.545 -0.560 12.331 1.00 0.00 O ATOM 931 OE2 GLU A 64 1.560 -1.361 11.712 1.00 0.00 O ATOM 0 H GLU A 64 4.623 -0.418 8.514 1.00 0.00 H new ATOM 0 HA GLU A 64 3.274 2.000 8.430 1.00 0.00 H new ATOM 0 HB2 GLU A 64 4.698 0.602 10.716 1.00 0.00 H new ATOM 0 HB3 GLU A 64 3.652 1.992 10.926 1.00 0.00 H new ATOM 0 HG2 GLU A 64 1.714 0.808 10.205 1.00 0.00 H new ATOM 0 HG3 GLU A 64 2.653 -0.437 9.405 1.00 0.00 H new ATOM 938 N LYS A 65 6.494 2.291 8.894 1.00 0.00 N ATOM 939 CA LYS A 65 7.597 3.236 8.919 1.00 0.00 C ATOM 940 C LYS A 65 7.684 3.948 7.568 1.00 0.00 C ATOM 941 O LYS A 65 7.985 5.139 7.508 1.00 0.00 O ATOM 942 CB LYS A 65 8.894 2.535 9.328 1.00 0.00 C ATOM 943 CG LYS A 65 9.278 2.888 10.767 1.00 0.00 C ATOM 944 CD LYS A 65 10.468 3.849 10.796 1.00 0.00 C ATOM 945 CE LYS A 65 10.017 5.271 11.137 1.00 0.00 C ATOM 946 NZ LYS A 65 10.007 5.474 12.603 1.00 0.00 N ATOM 0 H LYS A 65 6.773 1.310 8.871 1.00 0.00 H new ATOM 0 HA LYS A 65 7.424 4.003 9.674 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.773 1.456 9.234 1.00 0.00 H new ATOM 0 HB3 LYS A 65 9.698 2.826 8.652 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.426 3.342 11.274 1.00 0.00 H new ATOM 0 HG3 LYS A 65 9.527 1.979 11.314 1.00 0.00 H new ATOM 0 HD2 LYS A 65 11.197 3.509 11.532 1.00 0.00 H new ATOM 0 HD3 LYS A 65 10.967 3.845 9.827 1.00 0.00 H new ATOM 0 HE2 LYS A 65 10.686 5.993 10.668 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.021 5.450 10.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 9.699 6.444 12.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 9.351 4.797 13.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 10.964 5.324 12.981 1.00 0.00 H new ATOM 960 N MET A 66 7.414 3.189 6.516 1.00 0.00 N ATOM 961 CA MET A 66 7.458 3.733 5.169 1.00 0.00 C ATOM 962 C MET A 66 6.581 4.981 5.054 1.00 0.00 C ATOM 963 O MET A 66 6.959 5.951 4.398 1.00 0.00 O ATOM 964 CB MET A 66 6.973 2.675 4.175 1.00 0.00 C ATOM 965 CG MET A 66 8.020 2.424 3.088 1.00 0.00 C ATOM 966 SD MET A 66 8.215 3.885 2.080 1.00 0.00 S ATOM 967 CE MET A 66 6.512 4.184 1.635 1.00 0.00 C ATOM 0 H MET A 66 7.164 2.202 6.569 1.00 0.00 H new ATOM 0 HA MET A 66 8.487 4.012 4.943 1.00 0.00 H new ATOM 0 HB2 MET A 66 6.761 1.745 4.703 1.00 0.00 H new ATOM 0 HB3 MET A 66 6.039 3.002 3.717 1.00 0.00 H new ATOM 0 HG2 MET A 66 8.973 2.157 3.544 1.00 0.00 H new ATOM 0 HG3 MET A 66 7.717 1.581 2.467 1.00 0.00 H new ATOM 0 HE1 MET A 66 6.465 4.581 0.621 1.00 0.00 H new ATOM 0 HE2 MET A 66 5.953 3.249 1.685 1.00 0.00 H new ATOM 0 HE3 MET A 66 6.076 4.905 2.327 1.00 0.00 H new ATOM 977 N LEU A 67 5.427 4.917 5.701 1.00 0.00 N ATOM 978 CA LEU A 67 4.493 6.030 5.679 1.00 0.00 C ATOM 979 C LEU A 67 5.091 7.207 6.453 1.00 0.00 C ATOM 980 O LEU A 67 4.609 8.333 6.347 1.00 0.00 O ATOM 981 CB LEU A 67 3.121 5.589 6.192 1.00 0.00 C ATOM 982 CG LEU A 67 2.285 4.743 5.230 1.00 0.00 C ATOM 983 CD1 LEU A 67 3.063 3.509 4.769 1.00 0.00 C ATOM 984 CD2 LEU A 67 0.939 4.372 5.855 1.00 0.00 C ATOM 0 H LEU A 67 5.117 4.111 6.244 1.00 0.00 H new ATOM 0 HA LEU A 67 4.330 6.370 4.656 1.00 0.00 H new ATOM 0 HB2 LEU A 67 3.264 5.022 7.112 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.549 6.480 6.452 1.00 0.00 H new ATOM 0 HG LEU A 67 2.074 5.341 4.343 1.00 0.00 H new ATOM 0 HD11 LEU A 67 2.447 2.924 4.086 1.00 0.00 H new ATOM 0 HD12 LEU A 67 3.973 3.823 4.258 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.324 2.899 5.634 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.364 3.771 5.151 1.00 0.00 H new ATOM 0 HD22 LEU A 67 1.107 3.800 6.768 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.385 5.280 6.093 1.00 0.00 H new ATOM 996 N LYS A 68 6.132 6.904 7.215 1.00 0.00 N ATOM 997 CA LYS A 68 6.800 7.923 8.007 1.00 0.00 C ATOM 998 C LYS A 68 8.134 8.281 7.348 1.00 0.00 C ATOM 999 O LYS A 68 8.707 9.333 7.631 1.00 0.00 O ATOM 1000 CB LYS A 68 6.936 7.467 9.462 1.00 0.00 C ATOM 1001 CG LYS A 68 6.319 8.491 10.417 1.00 0.00 C ATOM 1002 CD LYS A 68 7.256 8.779 11.591 1.00 0.00 C ATOM 1003 CE LYS A 68 6.468 8.959 12.890 1.00 0.00 C ATOM 1004 NZ LYS A 68 6.370 7.674 13.619 1.00 0.00 N ATOM 0 H LYS A 68 6.529 5.968 7.301 1.00 0.00 H new ATOM 0 HA LYS A 68 6.203 8.835 8.037 1.00 0.00 H new ATOM 0 HB2 LYS A 68 6.446 6.502 9.592 1.00 0.00 H new ATOM 0 HB3 LYS A 68 7.989 7.325 9.706 1.00 0.00 H new ATOM 0 HG2 LYS A 68 6.110 9.415 9.879 1.00 0.00 H new ATOM 0 HG3 LYS A 68 5.366 8.117 10.791 1.00 0.00 H new ATOM 0 HD2 LYS A 68 7.967 7.960 11.703 1.00 0.00 H new ATOM 0 HD3 LYS A 68 7.836 9.679 11.386 1.00 0.00 H new ATOM 0 HE2 LYS A 68 6.956 9.704 13.518 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.469 9.335 12.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 5.832 7.814 14.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 5.884 6.973 13.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 7.325 7.331 13.848 1.00 0.00 H new ATOM 1018 N ASN A 69 8.589 7.387 6.483 1.00 0.00 N ATOM 1019 CA ASN A 69 9.845 7.596 5.782 1.00 0.00 C ATOM 1020 C ASN A 69 10.988 7.646 6.797 1.00 0.00 C ATOM 1021 O ASN A 69 11.749 6.688 6.927 1.00 0.00 O ATOM 1022 CB ASN A 69 9.834 8.921 5.017 1.00 0.00 C ATOM 1023 CG ASN A 69 11.195 9.193 4.373 1.00 0.00 C ATOM 1024 OD1 ASN A 69 12.243 8.941 4.945 1.00 0.00 O ATOM 1025 ND2 ASN A 69 11.121 9.721 3.154 1.00 0.00 N ATOM 0 H ASN A 69 8.111 6.516 6.251 1.00 0.00 H new ATOM 0 HA ASN A 69 9.980 6.774 5.079 1.00 0.00 H new ATOM 0 HB2 ASN A 69 9.062 8.895 4.248 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.580 9.735 5.696 1.00 0.00 H new ATOM 0 HD21 ASN A 69 11.975 9.940 2.640 1.00 0.00 H new ATOM 0 HD22 ASN A 69 10.211 9.907 2.733 1.00 0.00 H new ATOM 1032 N GLY A 70 11.074 8.771 7.490 1.00 0.00 N ATOM 1033 CA GLY A 70 12.112 8.958 8.489 1.00 0.00 C ATOM 1034 C GLY A 70 13.003 10.152 8.138 1.00 0.00 C ATOM 1035 O GLY A 70 12.506 11.213 7.764 1.00 0.00 O ATOM 0 H GLY A 70 10.441 9.563 7.379 1.00 0.00 H new ATOM 0 HA2 GLY A 70 11.657 9.115 9.467 1.00 0.00 H new ATOM 0 HA3 GLY A 70 12.719 8.056 8.561 1.00 0.00 H new ATOM 1039 N LYS A 71 14.304 9.938 8.272 1.00 0.00 N ATOM 1040 CA LYS A 71 15.268 10.983 7.974 1.00 0.00 C ATOM 1041 C LYS A 71 15.098 11.428 6.520 1.00 0.00 C ATOM 1042 O LYS A 71 14.746 12.576 6.255 1.00 0.00 O ATOM 1043 CB LYS A 71 16.685 10.517 8.312 1.00 0.00 C ATOM 1044 CG LYS A 71 17.364 11.486 9.282 1.00 0.00 C ATOM 1045 CD LYS A 71 18.885 11.325 9.244 1.00 0.00 C ATOM 1046 CE LYS A 71 19.321 10.060 9.987 1.00 0.00 C ATOM 1047 NZ LYS A 71 20.645 9.606 9.504 1.00 0.00 N ATOM 0 H LYS A 71 14.712 9.057 8.583 1.00 0.00 H new ATOM 0 HA LYS A 71 15.087 11.857 8.599 1.00 0.00 H new ATOM 0 HB2 LYS A 71 16.649 9.521 8.753 1.00 0.00 H new ATOM 0 HB3 LYS A 71 17.274 10.439 7.398 1.00 0.00 H new ATOM 0 HG2 LYS A 71 17.097 12.511 9.024 1.00 0.00 H new ATOM 0 HG3 LYS A 71 17.001 11.307 10.294 1.00 0.00 H new ATOM 0 HD2 LYS A 71 19.224 11.278 8.209 1.00 0.00 H new ATOM 0 HD3 LYS A 71 19.358 12.197 9.695 1.00 0.00 H new ATOM 0 HE2 LYS A 71 19.366 10.257 11.058 1.00 0.00 H new ATOM 0 HE3 LYS A 71 18.583 9.271 9.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 20.926 8.747 10.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 20.591 9.398 8.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 21.349 10.354 9.668 1.00 0.00 H new ATOM 1061 N SER A 72 15.357 10.495 5.615 1.00 0.00 N ATOM 1062 CA SER A 72 15.237 10.777 4.194 1.00 0.00 C ATOM 1063 C SER A 72 15.331 9.476 3.393 1.00 0.00 C ATOM 1064 O SER A 72 14.337 9.011 2.839 1.00 0.00 O ATOM 1065 CB SER A 72 16.313 11.762 3.735 1.00 0.00 C ATOM 1066 OG SER A 72 15.786 13.069 3.525 1.00 0.00 O ATOM 0 H SER A 72 15.649 9.544 5.838 1.00 0.00 H new ATOM 0 HA SER A 72 14.264 11.236 4.017 1.00 0.00 H new ATOM 0 HB2 SER A 72 17.106 11.807 4.482 1.00 0.00 H new ATOM 0 HB3 SER A 72 16.765 11.401 2.811 1.00 0.00 H new ATOM 0 HG SER A 72 15.280 13.349 4.316 1.00 0.00 H new ATOM 1072 N ASN A 73 16.536 8.927 3.358 1.00 0.00 N ATOM 1073 CA ASN A 73 16.774 7.689 2.635 1.00 0.00 C ATOM 1074 C ASN A 73 15.893 6.584 3.220 1.00 0.00 C ATOM 1075 O ASN A 73 16.111 5.404 2.951 1.00 0.00 O ATOM 1076 CB ASN A 73 18.233 7.248 2.762 1.00 0.00 C ATOM 1077 CG ASN A 73 18.670 7.216 4.228 1.00 0.00 C ATOM 1078 OD1 ASN A 73 18.944 8.233 4.844 1.00 0.00 O ATOM 1079 ND2 ASN A 73 18.721 5.994 4.751 1.00 0.00 N ATOM 0 H ASN A 73 17.358 9.317 3.819 1.00 0.00 H new ATOM 0 HA ASN A 73 16.540 7.862 1.585 1.00 0.00 H new ATOM 0 HB2 ASN A 73 18.358 6.260 2.320 1.00 0.00 H new ATOM 0 HB3 ASN A 73 18.873 7.930 2.203 1.00 0.00 H new ATOM 0 HD21 ASN A 73 19.002 5.867 5.723 1.00 0.00 H new ATOM 0 HD22 ASN A 73 18.479 5.184 4.180 1.00 0.00 H new TER 1086 ASN A 73 ATOM 1087 N THR B 5 15.194 16.015 -11.934 1.00 0.00 N ATOM 1088 CA THR B 5 15.480 16.802 -10.746 1.00 0.00 C ATOM 1089 C THR B 5 14.269 17.658 -10.369 1.00 0.00 C ATOM 1090 O THR B 5 14.177 18.150 -9.246 1.00 0.00 O ATOM 1091 CB THR B 5 16.743 17.623 -11.016 1.00 0.00 C ATOM 1092 OG1 THR B 5 17.007 18.271 -9.774 1.00 0.00 O ATOM 1093 CG2 THR B 5 16.496 18.775 -11.992 1.00 0.00 C ATOM 0 HA THR B 5 15.668 16.162 -9.884 1.00 0.00 H new ATOM 0 HB THR B 5 17.521 16.972 -11.414 1.00 0.00 H new ATOM 0 HG1 THR B 5 16.195 18.271 -9.226 1.00 0.00 H new ATOM 0 HG21 THR B 5 17.424 19.325 -12.148 1.00 0.00 H new ATOM 0 HG22 THR B 5 16.145 18.376 -12.944 1.00 0.00 H new ATOM 0 HG23 THR B 5 15.742 19.446 -11.580 1.00 0.00 H new ATOM 1101 N GLU B 6 13.369 17.808 -11.330 1.00 0.00 N ATOM 1102 CA GLU B 6 12.167 18.595 -11.113 1.00 0.00 C ATOM 1103 C GLU B 6 10.929 17.697 -11.157 1.00 0.00 C ATOM 1104 O GLU B 6 10.168 17.729 -12.124 1.00 0.00 O ATOM 1105 CB GLU B 6 12.060 19.726 -12.137 1.00 0.00 C ATOM 1106 CG GLU B 6 11.133 20.835 -11.635 1.00 0.00 C ATOM 1107 CD GLU B 6 10.447 21.548 -12.803 1.00 0.00 C ATOM 1108 OE1 GLU B 6 9.645 20.875 -13.486 1.00 0.00 O ATOM 1109 OE2 GLU B 6 10.741 22.749 -12.986 1.00 0.00 O ATOM 0 H GLU B 6 13.448 17.398 -12.261 1.00 0.00 H new ATOM 0 HA GLU B 6 12.228 19.049 -10.124 1.00 0.00 H new ATOM 0 HB2 GLU B 6 13.050 20.137 -12.335 1.00 0.00 H new ATOM 0 HB3 GLU B 6 11.684 19.332 -13.081 1.00 0.00 H new ATOM 0 HG2 GLU B 6 10.380 20.411 -10.970 1.00 0.00 H new ATOM 0 HG3 GLU B 6 11.705 21.555 -11.050 1.00 0.00 H new ATOM 1116 N LEU B 7 10.765 16.916 -10.099 1.00 0.00 N ATOM 1117 CA LEU B 7 9.633 16.011 -10.005 1.00 0.00 C ATOM 1118 C LEU B 7 8.645 16.543 -8.965 1.00 0.00 C ATOM 1119 O LEU B 7 8.972 17.448 -8.199 1.00 0.00 O ATOM 1120 CB LEU B 7 10.109 14.584 -9.726 1.00 0.00 C ATOM 1121 CG LEU B 7 10.955 13.933 -10.823 1.00 0.00 C ATOM 1122 CD1 LEU B 7 12.437 14.270 -10.645 1.00 0.00 C ATOM 1123 CD2 LEU B 7 10.713 12.423 -10.878 1.00 0.00 C ATOM 0 H LEU B 7 11.398 16.892 -9.299 1.00 0.00 H new ATOM 0 HA LEU B 7 9.102 15.966 -10.956 1.00 0.00 H new ATOM 0 HB2 LEU B 7 10.688 14.589 -8.803 1.00 0.00 H new ATOM 0 HB3 LEU B 7 9.234 13.958 -9.550 1.00 0.00 H new ATOM 0 HG LEU B 7 10.645 14.344 -11.784 1.00 0.00 H new ATOM 0 HD11 LEU B 7 13.016 13.795 -11.437 1.00 0.00 H new ATOM 0 HD12 LEU B 7 12.573 15.350 -10.694 1.00 0.00 H new ATOM 0 HD13 LEU B 7 12.779 13.905 -9.677 1.00 0.00 H new ATOM 0 HD21 LEU B 7 11.326 11.985 -11.666 1.00 0.00 H new ATOM 0 HD22 LEU B 7 10.980 11.977 -9.920 1.00 0.00 H new ATOM 0 HD23 LEU B 7 9.661 12.231 -11.088 1.00 0.00 H new ATOM 1135 N ARG B 8 7.455 15.959 -8.972 1.00 0.00 N ATOM 1136 CA ARG B 8 6.417 16.364 -8.039 1.00 0.00 C ATOM 1137 C ARG B 8 5.740 15.133 -7.433 1.00 0.00 C ATOM 1138 O ARG B 8 6.391 14.119 -7.187 1.00 0.00 O ATOM 1139 CB ARG B 8 5.363 17.230 -8.731 1.00 0.00 C ATOM 1140 CG ARG B 8 6.012 18.203 -9.716 1.00 0.00 C ATOM 1141 CD ARG B 8 4.984 19.192 -10.268 1.00 0.00 C ATOM 1142 NE ARG B 8 5.018 19.185 -11.748 1.00 0.00 N ATOM 1143 CZ ARG B 8 6.103 19.487 -12.476 1.00 0.00 C ATOM 1144 NH1 ARG B 8 7.247 19.821 -11.865 1.00 0.00 N ATOM 1145 NH2 ARG B 8 6.042 19.454 -13.814 1.00 0.00 N ATOM 0 H ARG B 8 7.187 15.209 -9.609 1.00 0.00 H new ATOM 0 HA ARG B 8 6.889 16.949 -7.249 1.00 0.00 H new ATOM 0 HB2 ARG B 8 4.653 16.593 -9.258 1.00 0.00 H new ATOM 0 HB3 ARG B 8 4.797 17.787 -7.984 1.00 0.00 H new ATOM 0 HG2 ARG B 8 6.815 18.747 -9.219 1.00 0.00 H new ATOM 0 HG3 ARG B 8 6.464 17.647 -10.537 1.00 0.00 H new ATOM 0 HD2 ARG B 8 3.987 18.926 -9.918 1.00 0.00 H new ATOM 0 HD3 ARG B 8 5.195 20.194 -9.896 1.00 0.00 H new ATOM 0 HE ARG B 8 4.163 18.935 -12.245 1.00 0.00 H new ATOM 0 HH11 ARG B 8 7.293 19.846 -10.846 1.00 0.00 H new ATOM 0 HH12 ARG B 8 8.072 20.051 -12.418 1.00 0.00 H new ATOM 0 HH21 ARG B 8 5.170 19.199 -14.279 1.00 0.00 H new ATOM 0 HH22 ARG B 8 6.867 19.684 -14.368 1.00 0.00 H new ATOM 1159 N CYS B 9 4.440 15.262 -7.211 1.00 0.00 N ATOM 1160 CA CYS B 9 3.667 14.173 -6.638 1.00 0.00 C ATOM 1161 C CYS B 9 2.982 13.418 -7.780 1.00 0.00 C ATOM 1162 O CYS B 9 2.886 13.927 -8.895 1.00 0.00 O ATOM 1163 CB CYS B 9 2.660 14.678 -5.603 1.00 0.00 C ATOM 1164 SG CYS B 9 3.370 15.048 -3.958 1.00 0.00 S ATOM 0 H CYS B 9 3.903 16.104 -7.418 1.00 0.00 H new ATOM 0 HA CYS B 9 4.331 13.495 -6.102 1.00 0.00 H new ATOM 0 HB2 CYS B 9 2.185 15.580 -5.989 1.00 0.00 H new ATOM 0 HB3 CYS B 9 1.876 13.930 -5.485 1.00 0.00 H new ATOM 1169 N GLN B 10 2.525 12.216 -7.461 1.00 0.00 N ATOM 1170 CA GLN B 10 1.853 11.386 -8.446 1.00 0.00 C ATOM 1171 C GLN B 10 0.342 11.621 -8.395 1.00 0.00 C ATOM 1172 O GLN B 10 -0.402 11.076 -9.209 1.00 0.00 O ATOM 1173 CB GLN B 10 2.185 9.907 -8.235 1.00 0.00 C ATOM 1174 CG GLN B 10 1.755 9.071 -9.442 1.00 0.00 C ATOM 1175 CD GLN B 10 0.855 7.911 -9.013 1.00 0.00 C ATOM 1176 OE1 GLN B 10 -0.300 7.814 -9.394 1.00 0.00 O ATOM 1177 NE2 GLN B 10 1.447 7.039 -8.201 1.00 0.00 N ATOM 0 H GLN B 10 2.607 11.797 -6.535 1.00 0.00 H new ATOM 0 HA GLN B 10 2.212 11.668 -9.436 1.00 0.00 H new ATOM 0 HB2 GLN B 10 3.256 9.791 -8.071 1.00 0.00 H new ATOM 0 HB3 GLN B 10 1.684 9.542 -7.338 1.00 0.00 H new ATOM 0 HG2 GLN B 10 1.225 9.702 -10.156 1.00 0.00 H new ATOM 0 HG3 GLN B 10 2.636 8.683 -9.952 1.00 0.00 H new ATOM 0 HE21 GLN B 10 2.418 7.180 -7.921 1.00 0.00 H new ATOM 0 HE22 GLN B 10 0.930 6.229 -7.859 1.00 0.00 H new ATOM 1186 N CYS B 11 -0.067 12.433 -7.431 1.00 0.00 N ATOM 1187 CA CYS B 11 -1.475 12.747 -7.264 1.00 0.00 C ATOM 1188 C CYS B 11 -1.592 14.196 -6.788 1.00 0.00 C ATOM 1189 O CYS B 11 -0.838 14.630 -5.918 1.00 0.00 O ATOM 1190 CB CYS B 11 -2.161 11.774 -6.302 1.00 0.00 C ATOM 1191 SG CYS B 11 -3.620 10.912 -6.994 1.00 0.00 S ATOM 0 H CYS B 11 0.553 12.883 -6.757 1.00 0.00 H new ATOM 0 HA CYS B 11 -1.990 12.637 -8.218 1.00 0.00 H new ATOM 0 HB2 CYS B 11 -1.434 11.028 -5.982 1.00 0.00 H new ATOM 0 HB3 CYS B 11 -2.469 12.322 -5.411 1.00 0.00 H new ATOM 1196 N LEU B 12 -2.542 14.905 -7.379 1.00 0.00 N ATOM 1197 CA LEU B 12 -2.766 16.297 -7.027 1.00 0.00 C ATOM 1198 C LEU B 12 -3.933 16.387 -6.041 1.00 0.00 C ATOM 1199 O LEU B 12 -4.127 17.416 -5.396 1.00 0.00 O ATOM 1200 CB LEU B 12 -2.959 17.144 -8.286 1.00 0.00 C ATOM 1201 CG LEU B 12 -2.009 16.845 -9.447 1.00 0.00 C ATOM 1202 CD1 LEU B 12 -2.665 17.170 -10.791 1.00 0.00 C ATOM 1203 CD2 LEU B 12 -0.677 17.576 -9.269 1.00 0.00 C ATOM 0 H LEU B 12 -3.166 14.542 -8.100 1.00 0.00 H new ATOM 0 HA LEU B 12 -1.890 16.709 -6.525 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -3.982 17.011 -8.636 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -2.850 18.194 -8.014 1.00 0.00 H new ATOM 0 HG LEU B 12 -1.793 15.777 -9.444 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -1.968 16.948 -11.599 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -3.565 16.567 -10.912 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -2.930 18.227 -10.820 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -0.021 17.346 -10.108 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -0.854 18.651 -9.231 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -0.206 17.253 -8.341 1.00 0.00 H new ATOM 1215 N GLN B 13 -4.679 15.295 -5.955 1.00 0.00 N ATOM 1216 CA GLN B 13 -5.821 15.238 -5.059 1.00 0.00 C ATOM 1217 C GLN B 13 -5.842 13.904 -4.310 1.00 0.00 C ATOM 1218 O GLN B 13 -5.072 12.999 -4.626 1.00 0.00 O ATOM 1219 CB GLN B 13 -7.129 15.460 -5.821 1.00 0.00 C ATOM 1220 CG GLN B 13 -8.152 16.194 -4.953 1.00 0.00 C ATOM 1221 CD GLN B 13 -8.484 17.568 -5.539 1.00 0.00 C ATOM 1222 OE1 GLN B 13 -8.464 17.780 -6.741 1.00 0.00 O ATOM 1223 NE2 GLN B 13 -8.788 18.486 -4.627 1.00 0.00 N ATOM 0 H GLN B 13 -4.515 14.443 -6.491 1.00 0.00 H new ATOM 0 HA GLN B 13 -5.725 16.041 -4.328 1.00 0.00 H new ATOM 0 HB2 GLN B 13 -6.934 16.037 -6.725 1.00 0.00 H new ATOM 0 HB3 GLN B 13 -7.537 14.500 -6.137 1.00 0.00 H new ATOM 0 HG2 GLN B 13 -9.062 15.599 -4.875 1.00 0.00 H new ATOM 0 HG3 GLN B 13 -7.760 16.311 -3.943 1.00 0.00 H new ATOM 0 HE21 GLN B 13 -8.786 18.241 -3.637 1.00 0.00 H new ATOM 0 HE22 GLN B 13 -9.024 19.435 -4.917 1.00 0.00 H new ATOM 1232 N THR B 14 -6.733 13.824 -3.332 1.00 0.00 N ATOM 1233 CA THR B 14 -6.864 12.616 -2.536 1.00 0.00 C ATOM 1234 C THR B 14 -8.290 12.484 -1.998 1.00 0.00 C ATOM 1235 O THR B 14 -9.058 13.446 -2.021 1.00 0.00 O ATOM 1236 CB THR B 14 -5.801 12.656 -1.437 1.00 0.00 C ATOM 1237 OG1 THR B 14 -5.700 14.037 -1.102 1.00 0.00 O ATOM 1238 CG2 THR B 14 -4.408 12.295 -1.956 1.00 0.00 C ATOM 0 H THR B 14 -7.371 14.577 -3.073 1.00 0.00 H new ATOM 0 HA THR B 14 -6.694 11.724 -3.140 1.00 0.00 H new ATOM 0 HB THR B 14 -6.079 11.969 -0.638 1.00 0.00 H new ATOM 0 HG1 THR B 14 -5.033 14.154 -0.394 1.00 0.00 H new ATOM 0 HG21 THR B 14 -3.691 12.339 -1.136 1.00 0.00 H new ATOM 0 HG22 THR B 14 -4.424 11.287 -2.370 1.00 0.00 H new ATOM 0 HG23 THR B 14 -4.114 13.002 -2.732 1.00 0.00 H new ATOM 1246 N LEU B 15 -8.603 11.286 -1.527 1.00 0.00 N ATOM 1247 CA LEU B 15 -9.923 11.016 -0.984 1.00 0.00 C ATOM 1248 C LEU B 15 -9.855 11.036 0.545 1.00 0.00 C ATOM 1249 O LEU B 15 -8.800 11.301 1.119 1.00 0.00 O ATOM 1250 CB LEU B 15 -10.483 9.713 -1.558 1.00 0.00 C ATOM 1251 CG LEU B 15 -10.706 9.689 -3.072 1.00 0.00 C ATOM 1252 CD1 LEU B 15 -10.529 8.275 -3.629 1.00 0.00 C ATOM 1253 CD2 LEU B 15 -12.069 10.282 -3.434 1.00 0.00 C ATOM 0 H LEU B 15 -7.964 10.491 -1.510 1.00 0.00 H new ATOM 0 HA LEU B 15 -10.624 11.795 -1.282 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -9.802 8.902 -1.298 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -11.433 9.501 -1.067 1.00 0.00 H new ATOM 0 HG LEU B 15 -9.948 10.317 -3.540 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -10.693 8.285 -4.707 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -9.518 7.925 -3.419 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -11.250 7.606 -3.159 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -12.203 10.253 -4.515 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -12.857 9.701 -2.955 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -12.119 11.315 -3.090 1.00 0.00 H new ATOM 1265 N GLN B 16 -10.994 10.751 1.159 1.00 0.00 N ATOM 1266 CA GLN B 16 -11.077 10.733 2.610 1.00 0.00 C ATOM 1267 C GLN B 16 -10.820 9.320 3.138 1.00 0.00 C ATOM 1268 O GLN B 16 -10.580 9.133 4.330 1.00 0.00 O ATOM 1269 CB GLN B 16 -12.431 11.259 3.088 1.00 0.00 C ATOM 1270 CG GLN B 16 -12.710 10.826 4.529 1.00 0.00 C ATOM 1271 CD GLN B 16 -13.754 11.734 5.182 1.00 0.00 C ATOM 1272 OE1 GLN B 16 -14.905 11.788 4.782 1.00 0.00 O ATOM 1273 NE2 GLN B 16 -13.289 12.443 6.207 1.00 0.00 N ATOM 0 H GLN B 16 -11.867 10.531 0.679 1.00 0.00 H new ATOM 0 HA GLN B 16 -10.307 11.394 3.007 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -12.446 12.347 3.022 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -13.220 10.889 2.434 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -13.062 9.794 4.541 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -11.786 10.854 5.106 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -12.314 12.350 6.491 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -13.908 13.079 6.709 1.00 0.00 H new ATOM 1282 N GLY B 17 -10.880 8.361 2.225 1.00 0.00 N ATOM 1283 CA GLY B 17 -10.656 6.971 2.584 1.00 0.00 C ATOM 1284 C GLY B 17 -11.497 6.038 1.711 1.00 0.00 C ATOM 1285 O GLY B 17 -11.055 4.944 1.361 1.00 0.00 O ATOM 0 H GLY B 17 -11.081 8.520 1.238 1.00 0.00 H new ATOM 0 HA2 GLY B 17 -9.600 6.728 2.470 1.00 0.00 H new ATOM 0 HA3 GLY B 17 -10.907 6.818 3.634 1.00 0.00 H new ATOM 1289 N ILE B 18 -12.693 6.503 1.384 1.00 0.00 N ATOM 1290 CA ILE B 18 -13.599 5.724 0.558 1.00 0.00 C ATOM 1291 C ILE B 18 -13.826 4.357 1.207 1.00 0.00 C ATOM 1292 O ILE B 18 -13.071 3.952 2.089 1.00 0.00 O ATOM 1293 CB ILE B 18 -13.080 5.643 -0.879 1.00 0.00 C ATOM 1294 CG1 ILE B 18 -13.393 6.928 -1.649 1.00 0.00 C ATOM 1295 CG2 ILE B 18 -13.623 4.402 -1.590 1.00 0.00 C ATOM 1296 CD1 ILE B 18 -14.901 7.177 -1.710 1.00 0.00 C ATOM 0 H ILE B 18 -13.056 7.410 1.676 1.00 0.00 H new ATOM 0 HA ILE B 18 -14.571 6.213 0.494 1.00 0.00 H new ATOM 0 HB ILE B 18 -11.995 5.545 -0.844 1.00 0.00 H new ATOM 0 HG12 ILE B 18 -12.900 7.773 -1.168 1.00 0.00 H new ATOM 0 HG13 ILE B 18 -12.991 6.858 -2.660 1.00 0.00 H new ATOM 0 HG21 ILE B 18 -13.238 4.369 -2.609 1.00 0.00 H new ATOM 0 HG22 ILE B 18 -13.306 3.508 -1.054 1.00 0.00 H new ATOM 0 HG23 ILE B 18 -14.712 4.444 -1.614 1.00 0.00 H new ATOM 0 HD11 ILE B 18 -15.096 8.096 -2.263 1.00 0.00 H new ATOM 0 HD12 ILE B 18 -15.388 6.341 -2.213 1.00 0.00 H new ATOM 0 HD13 ILE B 18 -15.295 7.271 -0.698 1.00 0.00 H new ATOM 1308 N HIS B 19 -14.870 3.684 0.745 1.00 0.00 N ATOM 1309 CA HIS B 19 -15.207 2.372 1.270 1.00 0.00 C ATOM 1310 C HIS B 19 -14.140 1.360 0.844 1.00 0.00 C ATOM 1311 O HIS B 19 -13.699 1.365 -0.304 1.00 0.00 O ATOM 1312 CB HIS B 19 -16.617 1.961 0.844 1.00 0.00 C ATOM 1313 CG HIS B 19 -17.445 1.362 1.956 1.00 0.00 C ATOM 1314 ND1 HIS B 19 -18.817 1.205 1.868 1.00 0.00 N ATOM 1315 CD2 HIS B 19 -17.081 0.885 3.181 1.00 0.00 C ATOM 1316 CE1 HIS B 19 -19.249 0.657 2.994 1.00 0.00 C ATOM 1317 NE2 HIS B 19 -18.171 0.460 3.807 1.00 0.00 N ATOM 0 H HIS B 19 -15.494 4.023 0.013 1.00 0.00 H new ATOM 0 HA HIS B 19 -15.215 2.404 2.360 1.00 0.00 H new ATOM 0 HB2 HIS B 19 -17.135 2.835 0.449 1.00 0.00 H new ATOM 0 HB3 HIS B 19 -16.544 1.239 0.030 1.00 0.00 H new ATOM 0 HD2 HIS B 19 -16.076 0.858 3.575 1.00 0.00 H new ATOM 0 HE1 HIS B 19 -20.274 0.410 3.227 1.00 0.00 H new ATOM 0 HE2 HIS B 19 -18.199 0.053 4.742 1.00 0.00 H new ATOM 1325 N LEU B 20 -13.758 0.518 1.792 1.00 0.00 N ATOM 1326 CA LEU B 20 -12.752 -0.498 1.530 1.00 0.00 C ATOM 1327 C LEU B 20 -13.403 -1.682 0.813 1.00 0.00 C ATOM 1328 O LEU B 20 -12.747 -2.687 0.544 1.00 0.00 O ATOM 1329 CB LEU B 20 -12.030 -0.883 2.823 1.00 0.00 C ATOM 1330 CG LEU B 20 -10.647 -1.516 2.655 1.00 0.00 C ATOM 1331 CD1 LEU B 20 -9.803 -0.733 1.648 1.00 0.00 C ATOM 1332 CD2 LEU B 20 -9.942 -1.658 4.005 1.00 0.00 C ATOM 0 H LEU B 20 -14.127 0.518 2.743 1.00 0.00 H new ATOM 0 HA LEU B 20 -11.981 -0.108 0.866 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -11.926 0.011 3.438 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -12.662 -1.579 3.375 1.00 0.00 H new ATOM 0 HG LEU B 20 -10.778 -2.520 2.252 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -8.825 -1.205 1.548 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -10.304 -0.727 0.680 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -9.677 0.292 1.997 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -8.961 -2.110 3.858 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -9.823 -0.674 4.459 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -10.538 -2.291 4.662 1.00 0.00 H new ATOM 1344 N LYS B 21 -14.686 -1.524 0.523 1.00 0.00 N ATOM 1345 CA LYS B 21 -15.434 -2.567 -0.158 1.00 0.00 C ATOM 1346 C LYS B 21 -15.206 -2.450 -1.666 1.00 0.00 C ATOM 1347 O LYS B 21 -15.503 -3.379 -2.416 1.00 0.00 O ATOM 1348 CB LYS B 21 -16.909 -2.521 0.247 1.00 0.00 C ATOM 1349 CG LYS B 21 -17.605 -1.299 -0.356 1.00 0.00 C ATOM 1350 CD LYS B 21 -19.046 -1.629 -0.751 1.00 0.00 C ATOM 1351 CE LYS B 21 -19.168 -1.823 -2.264 1.00 0.00 C ATOM 1352 NZ LYS B 21 -20.552 -1.547 -2.711 1.00 0.00 N ATOM 0 H LYS B 21 -15.227 -0.689 0.747 1.00 0.00 H new ATOM 0 HA LYS B 21 -15.076 -3.551 0.143 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -17.410 -3.430 -0.086 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -16.991 -2.491 1.334 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -17.600 -0.481 0.364 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -17.053 -0.957 -1.232 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -19.370 -2.534 -0.237 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -19.708 -0.826 -0.429 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -18.474 -1.159 -2.779 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -18.890 -2.843 -2.530 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 -20.618 -1.683 -3.740 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 -21.207 -2.198 -2.233 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 -20.804 -0.566 -2.475 1.00 0.00 H new ATOM 1366 N ASN B 22 -14.682 -1.301 -2.066 1.00 0.00 N ATOM 1367 CA ASN B 22 -14.411 -1.050 -3.471 1.00 0.00 C ATOM 1368 C ASN B 22 -12.914 -1.217 -3.736 1.00 0.00 C ATOM 1369 O ASN B 22 -12.518 -1.750 -4.771 1.00 0.00 O ATOM 1370 CB ASN B 22 -14.804 0.376 -3.862 1.00 0.00 C ATOM 1371 CG ASN B 22 -16.072 0.381 -4.719 1.00 0.00 C ATOM 1372 OD1 ASN B 22 -16.178 -0.309 -5.720 1.00 0.00 O ATOM 1373 ND2 ASN B 22 -17.024 1.194 -4.271 1.00 0.00 N ATOM 0 H ASN B 22 -14.438 -0.533 -1.441 1.00 0.00 H new ATOM 0 HA ASN B 22 -14.995 -1.759 -4.058 1.00 0.00 H new ATOM 0 HB2 ASN B 22 -14.966 0.972 -2.964 1.00 0.00 H new ATOM 0 HB3 ASN B 22 -13.987 0.844 -4.412 1.00 0.00 H new ATOM 0 HD21 ASN B 22 -17.909 1.268 -4.773 1.00 0.00 H new ATOM 0 HD22 ASN B 22 -16.869 1.744 -3.426 1.00 0.00 H new ATOM 1380 N ILE B 23 -12.121 -0.752 -2.781 1.00 0.00 N ATOM 1381 CA ILE B 23 -10.676 -0.843 -2.898 1.00 0.00 C ATOM 1382 C ILE B 23 -10.275 -2.309 -3.076 1.00 0.00 C ATOM 1383 O ILE B 23 -10.824 -3.191 -2.417 1.00 0.00 O ATOM 1384 CB ILE B 23 -9.998 -0.160 -1.709 1.00 0.00 C ATOM 1385 CG1 ILE B 23 -9.898 1.351 -1.929 1.00 0.00 C ATOM 1386 CG2 ILE B 23 -8.634 -0.789 -1.420 1.00 0.00 C ATOM 1387 CD1 ILE B 23 -10.241 2.116 -0.649 1.00 0.00 C ATOM 0 H ILE B 23 -12.452 -0.311 -1.923 1.00 0.00 H new ATOM 0 HA ILE B 23 -10.331 -0.308 -3.782 1.00 0.00 H new ATOM 0 HB ILE B 23 -10.618 -0.316 -0.826 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -8.889 1.609 -2.252 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -10.575 1.651 -2.729 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -8.174 -0.285 -0.570 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -8.763 -1.846 -1.189 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -7.992 -0.685 -2.295 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -10.162 3.187 -0.833 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -11.259 1.875 -0.342 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -9.547 1.832 0.142 1.00 0.00 H new ATOM 1399 N GLN B 24 -9.320 -2.524 -3.969 1.00 0.00 N ATOM 1400 CA GLN B 24 -8.839 -3.868 -4.241 1.00 0.00 C ATOM 1401 C GLN B 24 -7.372 -4.000 -3.828 1.00 0.00 C ATOM 1402 O GLN B 24 -6.900 -5.100 -3.543 1.00 0.00 O ATOM 1403 CB GLN B 24 -9.028 -4.230 -5.716 1.00 0.00 C ATOM 1404 CG GLN B 24 -9.428 -5.698 -5.873 1.00 0.00 C ATOM 1405 CD GLN B 24 -8.291 -6.513 -6.492 1.00 0.00 C ATOM 1406 OE1 GLN B 24 -8.281 -6.817 -7.673 1.00 0.00 O ATOM 1407 NE2 GLN B 24 -7.335 -6.849 -5.630 1.00 0.00 N ATOM 0 H GLN B 24 -8.866 -1.790 -4.513 1.00 0.00 H new ATOM 0 HA GLN B 24 -9.427 -4.570 -3.650 1.00 0.00 H new ATOM 0 HB2 GLN B 24 -9.794 -3.592 -6.156 1.00 0.00 H new ATOM 0 HB3 GLN B 24 -8.104 -4.041 -6.262 1.00 0.00 H new ATOM 0 HG2 GLN B 24 -9.690 -6.113 -4.900 1.00 0.00 H new ATOM 0 HG3 GLN B 24 -10.316 -5.771 -6.500 1.00 0.00 H new ATOM 0 HE21 GLN B 24 -7.405 -6.562 -4.654 1.00 0.00 H new ATOM 0 HE22 GLN B 24 -6.532 -7.394 -5.945 1.00 0.00 H new ATOM 1416 N SER B 25 -6.691 -2.864 -3.810 1.00 0.00 N ATOM 1417 CA SER B 25 -5.286 -2.839 -3.437 1.00 0.00 C ATOM 1418 C SER B 25 -4.924 -1.471 -2.856 1.00 0.00 C ATOM 1419 O SER B 25 -5.647 -0.496 -3.055 1.00 0.00 O ATOM 1420 CB SER B 25 -4.392 -3.161 -4.636 1.00 0.00 C ATOM 1421 OG SER B 25 -5.081 -3.917 -5.628 1.00 0.00 O ATOM 0 H SER B 25 -7.085 -1.954 -4.048 1.00 0.00 H new ATOM 0 HA SER B 25 -5.119 -3.604 -2.679 1.00 0.00 H new ATOM 0 HB2 SER B 25 -4.027 -2.233 -5.076 1.00 0.00 H new ATOM 0 HB3 SER B 25 -3.518 -3.718 -4.298 1.00 0.00 H new ATOM 0 HG SER B 25 -4.487 -4.074 -6.391 1.00 0.00 H new ATOM 1427 N VAL B 26 -3.803 -1.442 -2.149 1.00 0.00 N ATOM 1428 CA VAL B 26 -3.336 -0.209 -1.538 1.00 0.00 C ATOM 1429 C VAL B 26 -1.891 0.053 -1.970 1.00 0.00 C ATOM 1430 O VAL B 26 -1.051 -0.843 -1.914 1.00 0.00 O ATOM 1431 CB VAL B 26 -3.502 -0.283 -0.019 1.00 0.00 C ATOM 1432 CG1 VAL B 26 -2.679 0.805 0.676 1.00 0.00 C ATOM 1433 CG2 VAL B 26 -4.977 -0.191 0.377 1.00 0.00 C ATOM 0 H VAL B 26 -3.205 -2.252 -1.986 1.00 0.00 H new ATOM 0 HA VAL B 26 -3.935 0.637 -1.876 1.00 0.00 H new ATOM 0 HB VAL B 26 -3.126 -1.251 0.312 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -2.815 0.730 1.755 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -1.624 0.675 0.433 1.00 0.00 H new ATOM 0 HG13 VAL B 26 -3.011 1.786 0.336 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -5.067 -0.246 1.462 1.00 0.00 H new ATOM 0 HG22 VAL B 26 -5.390 0.755 0.026 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -5.527 -1.016 -0.075 1.00 0.00 H new ATOM 1443 N LYS B 27 -1.647 1.286 -2.389 1.00 0.00 N ATOM 1444 CA LYS B 27 -0.319 1.677 -2.830 1.00 0.00 C ATOM 1445 C LYS B 27 0.158 2.870 -1.999 1.00 0.00 C ATOM 1446 O LYS B 27 -0.500 3.908 -1.963 1.00 0.00 O ATOM 1447 CB LYS B 27 -0.309 1.935 -4.338 1.00 0.00 C ATOM 1448 CG LYS B 27 1.073 2.392 -4.807 1.00 0.00 C ATOM 1449 CD LYS B 27 2.170 1.480 -4.255 1.00 0.00 C ATOM 1450 CE LYS B 27 3.289 1.284 -5.280 1.00 0.00 C ATOM 1451 NZ LYS B 27 4.557 0.933 -4.602 1.00 0.00 N ATOM 0 H LYS B 27 -2.346 2.027 -2.432 1.00 0.00 H new ATOM 0 HA LYS B 27 0.391 0.867 -2.664 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -0.595 1.026 -4.868 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -1.050 2.695 -4.585 1.00 0.00 H new ATOM 0 HG2 LYS B 27 1.109 2.392 -5.896 1.00 0.00 H new ATOM 0 HG3 LYS B 27 1.250 3.417 -4.482 1.00 0.00 H new ATOM 0 HD2 LYS B 27 2.580 1.911 -3.342 1.00 0.00 H new ATOM 0 HD3 LYS B 27 1.744 0.513 -3.988 1.00 0.00 H new ATOM 0 HE2 LYS B 27 3.014 0.496 -5.981 1.00 0.00 H new ATOM 0 HE3 LYS B 27 3.421 2.196 -5.862 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 5.335 1.490 -5.010 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 4.477 1.142 -3.586 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 4.751 -0.080 -4.732 1.00 0.00 H new ATOM 1465 N VAL B 28 1.299 2.681 -1.353 1.00 0.00 N ATOM 1466 CA VAL B 28 1.872 3.729 -0.525 1.00 0.00 C ATOM 1467 C VAL B 28 3.160 4.239 -1.175 1.00 0.00 C ATOM 1468 O VAL B 28 4.121 3.487 -1.332 1.00 0.00 O ATOM 1469 CB VAL B 28 2.085 3.213 0.899 1.00 0.00 C ATOM 1470 CG1 VAL B 28 3.504 3.515 1.386 1.00 0.00 C ATOM 1471 CG2 VAL B 28 1.042 3.795 1.855 1.00 0.00 C ATOM 0 H VAL B 28 1.842 1.818 -1.386 1.00 0.00 H new ATOM 0 HA VAL B 28 1.188 4.574 -0.451 1.00 0.00 H new ATOM 0 HB VAL B 28 1.959 2.130 0.885 1.00 0.00 H new ATOM 0 HG11 VAL B 28 3.628 3.138 2.401 1.00 0.00 H new ATOM 0 HG12 VAL B 28 4.225 3.031 0.728 1.00 0.00 H new ATOM 0 HG13 VAL B 28 3.670 4.592 1.377 1.00 0.00 H new ATOM 0 HG21 VAL B 28 1.216 3.412 2.861 1.00 0.00 H new ATOM 0 HG22 VAL B 28 1.121 4.882 1.862 1.00 0.00 H new ATOM 0 HG23 VAL B 28 0.044 3.506 1.525 1.00 0.00 H new ATOM 1481 N LYS B 29 3.139 5.514 -1.535 1.00 0.00 N ATOM 1482 CA LYS B 29 4.293 6.133 -2.164 1.00 0.00 C ATOM 1483 C LYS B 29 4.721 7.353 -1.346 1.00 0.00 C ATOM 1484 O LYS B 29 4.247 8.463 -1.584 1.00 0.00 O ATOM 1485 CB LYS B 29 3.998 6.450 -3.631 1.00 0.00 C ATOM 1486 CG LYS B 29 5.287 6.486 -4.455 1.00 0.00 C ATOM 1487 CD LYS B 29 5.950 7.862 -4.375 1.00 0.00 C ATOM 1488 CE LYS B 29 6.722 8.174 -5.659 1.00 0.00 C ATOM 1489 NZ LYS B 29 5.932 9.071 -6.533 1.00 0.00 N ATOM 0 H LYS B 29 2.341 6.135 -1.403 1.00 0.00 H new ATOM 0 HA LYS B 29 5.137 5.443 -2.174 1.00 0.00 H new ATOM 0 HB2 LYS B 29 3.322 5.699 -4.040 1.00 0.00 H new ATOM 0 HB3 LYS B 29 3.489 7.411 -3.704 1.00 0.00 H new ATOM 0 HG2 LYS B 29 5.977 5.724 -4.091 1.00 0.00 H new ATOM 0 HG3 LYS B 29 5.065 6.245 -5.495 1.00 0.00 H new ATOM 0 HD2 LYS B 29 5.191 8.626 -4.208 1.00 0.00 H new ATOM 0 HD3 LYS B 29 6.628 7.894 -3.522 1.00 0.00 H new ATOM 0 HE2 LYS B 29 7.675 8.643 -5.413 1.00 0.00 H new ATOM 0 HE3 LYS B 29 6.949 7.248 -6.188 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 6.470 9.273 -7.400 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 5.034 8.610 -6.782 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 5.737 9.961 -6.031 1.00 0.00 H new ATOM 1503 N SER B 30 5.612 7.106 -0.397 1.00 0.00 N ATOM 1504 CA SER B 30 6.110 8.171 0.458 1.00 0.00 C ATOM 1505 C SER B 30 6.688 9.301 -0.396 1.00 0.00 C ATOM 1506 O SER B 30 6.808 9.165 -1.612 1.00 0.00 O ATOM 1507 CB SER B 30 7.167 7.647 1.431 1.00 0.00 C ATOM 1508 OG SER B 30 6.724 7.705 2.784 1.00 0.00 O ATOM 0 H SER B 30 6.002 6.184 -0.201 1.00 0.00 H new ATOM 0 HA SER B 30 5.276 8.557 1.044 1.00 0.00 H new ATOM 0 HB2 SER B 30 7.416 6.617 1.175 1.00 0.00 H new ATOM 0 HB3 SER B 30 8.080 8.232 1.323 1.00 0.00 H new ATOM 0 HG SER B 30 6.936 6.861 3.234 1.00 0.00 H new ATOM 1514 N PRO B 31 7.039 10.420 0.293 1.00 0.00 N ATOM 1515 CA PRO B 31 7.602 11.573 -0.389 1.00 0.00 C ATOM 1516 C PRO B 31 9.057 11.318 -0.787 1.00 0.00 C ATOM 1517 O PRO B 31 9.608 10.258 -0.496 1.00 0.00 O ATOM 1518 CB PRO B 31 7.446 12.724 0.591 1.00 0.00 C ATOM 1519 CG PRO B 31 7.231 12.085 1.954 1.00 0.00 C ATOM 1520 CD PRO B 31 6.911 10.616 1.734 1.00 0.00 C ATOM 0 HA PRO B 31 7.095 11.796 -1.328 1.00 0.00 H new ATOM 0 HB2 PRO B 31 8.332 13.358 0.593 1.00 0.00 H new ATOM 0 HB3 PRO B 31 6.601 13.357 0.319 1.00 0.00 H new ATOM 0 HG2 PRO B 31 8.123 12.193 2.571 1.00 0.00 H new ATOM 0 HG3 PRO B 31 6.415 12.578 2.483 1.00 0.00 H new ATOM 0 HD2 PRO B 31 7.600 9.974 2.284 1.00 0.00 H new ATOM 0 HD3 PRO B 31 5.906 10.374 2.079 1.00 0.00 H new ATOM 1528 N GLY B 32 9.639 12.309 -1.446 1.00 0.00 N ATOM 1529 CA GLY B 32 11.019 12.207 -1.887 1.00 0.00 C ATOM 1530 C GLY B 32 11.677 13.586 -1.956 1.00 0.00 C ATOM 1531 O GLY B 32 11.185 14.543 -1.360 1.00 0.00 O ATOM 0 H GLY B 32 9.179 13.187 -1.685 1.00 0.00 H new ATOM 0 HA2 GLY B 32 11.577 11.568 -1.202 1.00 0.00 H new ATOM 0 HA3 GLY B 32 11.057 11.733 -2.868 1.00 0.00 H new ATOM 1535 N PRO B 33 12.809 13.646 -2.707 1.00 0.00 N ATOM 1536 CA PRO B 33 13.540 14.893 -2.862 1.00 0.00 C ATOM 1537 C PRO B 33 12.813 15.839 -3.819 1.00 0.00 C ATOM 1538 O PRO B 33 13.292 16.938 -4.094 1.00 0.00 O ATOM 1539 CB PRO B 33 14.915 14.483 -3.362 1.00 0.00 C ATOM 1540 CG PRO B 33 14.757 13.074 -3.911 1.00 0.00 C ATOM 1541 CD PRO B 33 13.421 12.533 -3.427 1.00 0.00 C ATOM 0 HA PRO B 33 13.620 15.452 -1.930 1.00 0.00 H new ATOM 0 HB2 PRO B 33 15.269 15.166 -4.135 1.00 0.00 H new ATOM 0 HB3 PRO B 33 15.647 14.508 -2.555 1.00 0.00 H new ATOM 0 HG2 PRO B 33 14.794 13.082 -5.000 1.00 0.00 H new ATOM 0 HG3 PRO B 33 15.573 12.437 -3.569 1.00 0.00 H new ATOM 0 HD2 PRO B 33 12.798 12.211 -4.262 1.00 0.00 H new ATOM 0 HD3 PRO B 33 13.556 11.668 -2.778 1.00 0.00 H new ATOM 1549 N HIS B 34 11.667 15.379 -4.299 1.00 0.00 N ATOM 1550 CA HIS B 34 10.869 16.171 -5.220 1.00 0.00 C ATOM 1551 C HIS B 34 9.577 16.611 -4.530 1.00 0.00 C ATOM 1552 O HIS B 34 9.230 17.791 -4.548 1.00 0.00 O ATOM 1553 CB HIS B 34 10.617 15.403 -6.519 1.00 0.00 C ATOM 1554 CG HIS B 34 10.508 13.908 -6.338 1.00 0.00 C ATOM 1555 ND1 HIS B 34 11.577 13.120 -5.950 1.00 0.00 N ATOM 1556 CD2 HIS B 34 9.446 13.066 -6.494 1.00 0.00 C ATOM 1557 CE1 HIS B 34 11.167 11.862 -5.880 1.00 0.00 C ATOM 1558 NE2 HIS B 34 9.846 11.831 -6.218 1.00 0.00 N ATOM 0 H HIS B 34 11.272 14.468 -4.067 1.00 0.00 H new ATOM 0 HA HIS B 34 11.415 17.072 -5.500 1.00 0.00 H new ATOM 0 HB2 HIS B 34 9.698 15.771 -6.974 1.00 0.00 H new ATOM 0 HB3 HIS B 34 11.426 15.616 -7.218 1.00 0.00 H new ATOM 0 HD2 HIS B 34 8.449 13.355 -6.792 1.00 0.00 H new ATOM 0 HE1 HIS B 34 11.772 11.011 -5.604 1.00 0.00 H new ATOM 0 HE2 HIS B 34 9.261 10.996 -6.253 1.00 0.00 H new ATOM 1566 N CYS B 35 8.898 15.639 -3.939 1.00 0.00 N ATOM 1567 CA CYS B 35 7.651 15.911 -3.244 1.00 0.00 C ATOM 1568 C CYS B 35 7.838 15.561 -1.767 1.00 0.00 C ATOM 1569 O CYS B 35 8.180 14.428 -1.431 1.00 0.00 O ATOM 1570 CB CYS B 35 6.479 15.150 -3.867 1.00 0.00 C ATOM 1571 SG CYS B 35 5.062 16.196 -4.365 1.00 0.00 S ATOM 0 H CYS B 35 9.188 14.661 -3.927 1.00 0.00 H new ATOM 0 HA CYS B 35 7.403 16.968 -3.337 1.00 0.00 H new ATOM 0 HB2 CYS B 35 6.839 14.610 -4.743 1.00 0.00 H new ATOM 0 HB3 CYS B 35 6.129 14.404 -3.154 1.00 0.00 H new ATOM 1576 N ALA B 36 7.605 16.555 -0.922 1.00 0.00 N ATOM 1577 CA ALA B 36 7.743 16.367 0.512 1.00 0.00 C ATOM 1578 C ALA B 36 6.390 15.964 1.102 1.00 0.00 C ATOM 1579 O ALA B 36 6.138 16.174 2.287 1.00 0.00 O ATOM 1580 CB ALA B 36 8.297 17.646 1.144 1.00 0.00 C ATOM 0 H ALA B 36 7.321 17.493 -1.204 1.00 0.00 H new ATOM 0 HA ALA B 36 8.449 15.565 0.727 1.00 0.00 H new ATOM 0 HB1 ALA B 36 8.400 17.505 2.220 1.00 0.00 H new ATOM 0 HB2 ALA B 36 9.272 17.872 0.712 1.00 0.00 H new ATOM 0 HB3 ALA B 36 7.614 18.473 0.951 1.00 0.00 H new ATOM 1586 N GLN B 37 5.554 15.392 0.247 1.00 0.00 N ATOM 1587 CA GLN B 37 4.233 14.958 0.668 1.00 0.00 C ATOM 1588 C GLN B 37 4.013 13.491 0.296 1.00 0.00 C ATOM 1589 O GLN B 37 4.633 12.984 -0.638 1.00 0.00 O ATOM 1590 CB GLN B 37 3.145 15.847 0.063 1.00 0.00 C ATOM 1591 CG GLN B 37 3.591 17.310 0.022 1.00 0.00 C ATOM 1592 CD GLN B 37 3.687 17.894 1.433 1.00 0.00 C ATOM 1593 OE1 GLN B 37 2.964 17.515 2.340 1.00 0.00 O ATOM 1594 NE2 GLN B 37 4.617 18.835 1.568 1.00 0.00 N ATOM 0 H GLN B 37 5.766 15.219 -0.736 1.00 0.00 H new ATOM 0 HA GLN B 37 4.170 15.051 1.752 1.00 0.00 H new ATOM 0 HB2 GLN B 37 2.911 15.506 -0.946 1.00 0.00 H new ATOM 0 HB3 GLN B 37 2.230 15.758 0.649 1.00 0.00 H new ATOM 0 HG2 GLN B 37 4.559 17.385 -0.473 1.00 0.00 H new ATOM 0 HG3 GLN B 37 2.885 17.893 -0.569 1.00 0.00 H new ATOM 0 HE21 GLN B 37 5.189 19.106 0.768 1.00 0.00 H new ATOM 0 HE22 GLN B 37 4.759 19.286 2.472 1.00 0.00 H new ATOM 1603 N THR B 38 3.128 12.850 1.045 1.00 0.00 N ATOM 1604 CA THR B 38 2.818 11.450 0.805 1.00 0.00 C ATOM 1605 C THR B 38 1.848 11.313 -0.371 1.00 0.00 C ATOM 1606 O THR B 38 1.231 12.292 -0.789 1.00 0.00 O ATOM 1607 CB THR B 38 2.281 10.855 2.108 1.00 0.00 C ATOM 1608 OG1 THR B 38 3.305 11.126 3.061 1.00 0.00 O ATOM 1609 CG2 THR B 38 2.206 9.327 2.066 1.00 0.00 C ATOM 0 H THR B 38 2.616 13.274 1.818 1.00 0.00 H new ATOM 0 HA THR B 38 3.709 10.891 0.518 1.00 0.00 H new ATOM 0 HB THR B 38 1.291 11.262 2.312 1.00 0.00 H new ATOM 0 HG1 THR B 38 3.038 10.775 3.936 1.00 0.00 H new ATOM 0 HG21 THR B 38 1.819 8.956 3.015 1.00 0.00 H new ATOM 0 HG22 THR B 38 1.544 9.017 1.258 1.00 0.00 H new ATOM 0 HG23 THR B 38 3.202 8.918 1.896 1.00 0.00 H new ATOM 1617 N GLU B 39 1.743 10.090 -0.870 1.00 0.00 N ATOM 1618 CA GLU B 39 0.859 9.812 -1.989 1.00 0.00 C ATOM 1619 C GLU B 39 0.221 8.430 -1.831 1.00 0.00 C ATOM 1620 O GLU B 39 0.614 7.481 -2.508 1.00 0.00 O ATOM 1621 CB GLU B 39 1.606 9.923 -3.320 1.00 0.00 C ATOM 1622 CG GLU B 39 1.552 11.352 -3.862 1.00 0.00 C ATOM 1623 CD GLU B 39 2.872 12.085 -3.612 1.00 0.00 C ATOM 1624 OE1 GLU B 39 3.014 12.632 -2.497 1.00 0.00 O ATOM 1625 OE2 GLU B 39 3.708 12.081 -4.540 1.00 0.00 O ATOM 0 H GLU B 39 2.255 9.281 -0.520 1.00 0.00 H new ATOM 0 HA GLU B 39 0.065 10.559 -1.993 1.00 0.00 H new ATOM 0 HB2 GLU B 39 2.644 9.621 -3.184 1.00 0.00 H new ATOM 0 HB3 GLU B 39 1.167 9.238 -4.046 1.00 0.00 H new ATOM 0 HG2 GLU B 39 1.341 11.331 -4.931 1.00 0.00 H new ATOM 0 HG3 GLU B 39 0.735 11.894 -3.386 1.00 0.00 H new ATOM 1632 N VAL B 40 -0.751 8.361 -0.934 1.00 0.00 N ATOM 1633 CA VAL B 40 -1.446 7.111 -0.679 1.00 0.00 C ATOM 1634 C VAL B 40 -2.443 6.847 -1.809 1.00 0.00 C ATOM 1635 O VAL B 40 -3.296 7.685 -2.098 1.00 0.00 O ATOM 1636 CB VAL B 40 -2.105 7.151 0.702 1.00 0.00 C ATOM 1637 CG1 VAL B 40 -2.756 5.808 1.038 1.00 0.00 C ATOM 1638 CG2 VAL B 40 -1.097 7.557 1.778 1.00 0.00 C ATOM 0 H VAL B 40 -1.074 9.150 -0.375 1.00 0.00 H new ATOM 0 HA VAL B 40 -0.742 6.279 -0.665 1.00 0.00 H new ATOM 0 HB VAL B 40 -2.891 7.906 0.677 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -3.217 5.864 2.024 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -3.518 5.577 0.294 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -1.997 5.025 1.036 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -1.591 7.578 2.750 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -0.280 6.836 1.801 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -0.701 8.547 1.551 1.00 0.00 H new ATOM 1648 N ILE B 41 -2.302 5.679 -2.419 1.00 0.00 N ATOM 1649 CA ILE B 41 -3.180 5.294 -3.511 1.00 0.00 C ATOM 1650 C ILE B 41 -3.791 3.925 -3.209 1.00 0.00 C ATOM 1651 O ILE B 41 -3.265 3.172 -2.392 1.00 0.00 O ATOM 1652 CB ILE B 41 -2.432 5.354 -4.845 1.00 0.00 C ATOM 1653 CG1 ILE B 41 -1.269 6.346 -4.778 1.00 0.00 C ATOM 1654 CG2 ILE B 41 -3.389 5.669 -5.996 1.00 0.00 C ATOM 1655 CD1 ILE B 41 -1.778 7.774 -4.572 1.00 0.00 C ATOM 0 H ILE B 41 -1.593 4.987 -2.178 1.00 0.00 H new ATOM 0 HA ILE B 41 -4.007 5.999 -3.603 1.00 0.00 H new ATOM 0 HB ILE B 41 -2.005 4.371 -5.042 1.00 0.00 H new ATOM 0 HG12 ILE B 41 -0.600 6.073 -3.962 1.00 0.00 H new ATOM 0 HG13 ILE B 41 -0.687 6.293 -5.698 1.00 0.00 H new ATOM 0 HG21 ILE B 41 -2.832 5.706 -6.932 1.00 0.00 H new ATOM 0 HG22 ILE B 41 -4.152 4.893 -6.058 1.00 0.00 H new ATOM 0 HG23 ILE B 41 -3.866 6.633 -5.819 1.00 0.00 H new ATOM 0 HD11 ILE B 41 -0.931 8.459 -4.528 1.00 0.00 H new ATOM 0 HD12 ILE B 41 -2.427 8.052 -5.402 1.00 0.00 H new ATOM 0 HD13 ILE B 41 -2.339 7.829 -3.639 1.00 0.00 H new ATOM 1667 N ALA B 42 -4.895 3.643 -3.886 1.00 0.00 N ATOM 1668 CA ALA B 42 -5.584 2.377 -3.701 1.00 0.00 C ATOM 1669 C ALA B 42 -6.238 1.960 -5.020 1.00 0.00 C ATOM 1670 O ALA B 42 -6.992 2.729 -5.614 1.00 0.00 O ATOM 1671 CB ALA B 42 -6.599 2.510 -2.564 1.00 0.00 C ATOM 0 H ALA B 42 -5.329 4.270 -4.563 1.00 0.00 H new ATOM 0 HA ALA B 42 -4.880 1.594 -3.420 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -7.116 1.561 -2.425 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -6.081 2.779 -1.644 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -7.324 3.285 -2.812 1.00 0.00 H new ATOM 1677 N THR B 43 -5.926 0.743 -5.439 1.00 0.00 N ATOM 1678 CA THR B 43 -6.474 0.214 -6.677 1.00 0.00 C ATOM 1679 C THR B 43 -7.925 -0.226 -6.473 1.00 0.00 C ATOM 1680 O THR B 43 -8.239 -0.908 -5.498 1.00 0.00 O ATOM 1681 CB THR B 43 -5.558 -0.915 -7.155 1.00 0.00 C ATOM 1682 OG1 THR B 43 -4.352 -0.251 -7.524 1.00 0.00 O ATOM 1683 CG2 THR B 43 -6.046 -1.553 -8.457 1.00 0.00 C ATOM 0 H THR B 43 -5.301 0.108 -4.944 1.00 0.00 H new ATOM 0 HA THR B 43 -6.505 0.978 -7.454 1.00 0.00 H new ATOM 0 HB THR B 43 -5.489 -1.679 -6.380 1.00 0.00 H new ATOM 0 HG1 THR B 43 -3.701 -0.910 -7.844 1.00 0.00 H new ATOM 0 HG21 THR B 43 -5.361 -2.348 -8.752 1.00 0.00 H new ATOM 0 HG22 THR B 43 -7.042 -1.970 -8.307 1.00 0.00 H new ATOM 0 HG23 THR B 43 -6.083 -0.797 -9.241 1.00 0.00 H new ATOM 1691 N LEU B 44 -8.770 0.181 -7.408 1.00 0.00 N ATOM 1692 CA LEU B 44 -10.180 -0.162 -7.343 1.00 0.00 C ATOM 1693 C LEU B 44 -10.378 -1.589 -7.859 1.00 0.00 C ATOM 1694 O LEU B 44 -9.627 -2.052 -8.716 1.00 0.00 O ATOM 1695 CB LEU B 44 -11.021 0.881 -8.082 1.00 0.00 C ATOM 1696 CG LEU B 44 -12.241 1.415 -7.329 1.00 0.00 C ATOM 1697 CD1 LEU B 44 -12.706 2.750 -7.916 1.00 0.00 C ATOM 1698 CD2 LEU B 44 -13.365 0.378 -7.301 1.00 0.00 C ATOM 0 H LEU B 44 -8.505 0.745 -8.215 1.00 0.00 H new ATOM 0 HA LEU B 44 -10.528 -0.144 -6.310 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -10.378 1.724 -8.336 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.361 0.445 -9.022 1.00 0.00 H new ATOM 0 HG LEU B 44 -11.950 1.602 -6.295 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -13.574 3.108 -7.363 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -11.901 3.481 -7.840 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -12.974 2.613 -8.964 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -14.220 0.783 -6.760 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -13.663 0.136 -8.321 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -13.014 -0.525 -6.802 1.00 0.00 H new ATOM 1710 N LYS B 45 -11.392 -2.245 -7.316 1.00 0.00 N ATOM 1711 CA LYS B 45 -11.698 -3.610 -7.711 1.00 0.00 C ATOM 1712 C LYS B 45 -12.362 -3.601 -9.089 1.00 0.00 C ATOM 1713 O LYS B 45 -12.675 -4.656 -9.639 1.00 0.00 O ATOM 1714 CB LYS B 45 -12.530 -4.306 -6.632 1.00 0.00 C ATOM 1715 CG LYS B 45 -13.365 -5.440 -7.231 1.00 0.00 C ATOM 1716 CD LYS B 45 -12.469 -6.511 -7.856 1.00 0.00 C ATOM 1717 CE LYS B 45 -12.279 -7.692 -6.902 1.00 0.00 C ATOM 1718 NZ LYS B 45 -12.949 -8.900 -7.433 1.00 0.00 N ATOM 0 H LYS B 45 -12.013 -1.857 -6.606 1.00 0.00 H new ATOM 0 HA LYS B 45 -10.783 -4.195 -7.802 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -11.872 -4.703 -5.859 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -13.186 -3.582 -6.150 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -13.986 -5.888 -6.455 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -14.040 -5.039 -7.987 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -12.911 -6.860 -8.789 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -11.499 -6.080 -8.104 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -11.216 -7.889 -6.765 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -12.686 -7.444 -5.922 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -13.018 -9.617 -6.683 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -13.903 -8.651 -7.763 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -12.397 -9.282 -8.227 1.00 0.00 H new ATOM 1732 N ASN B 46 -12.557 -2.397 -9.609 1.00 0.00 N ATOM 1733 CA ASN B 46 -13.178 -2.237 -10.913 1.00 0.00 C ATOM 1734 C ASN B 46 -12.093 -1.986 -11.962 1.00 0.00 C ATOM 1735 O ASN B 46 -12.370 -1.995 -13.160 1.00 0.00 O ATOM 1736 CB ASN B 46 -14.133 -1.042 -10.925 1.00 0.00 C ATOM 1737 CG ASN B 46 -14.027 -0.269 -12.241 1.00 0.00 C ATOM 1738 OD1 ASN B 46 -13.576 0.974 -12.104 1.00 0.00 O flip ATOM 1739 ND2 ASN B 46 -14.336 -0.768 -13.310 1.00 0.00 N flip ATOM 0 H ASN B 46 -12.296 -1.524 -9.151 1.00 0.00 H new ATOM 0 HA ASN B 46 -13.736 -3.147 -11.135 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -15.157 -1.389 -10.784 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -13.903 -0.380 -10.090 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -14.676 -1.729 -13.345 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -14.255 -0.224 -14.169 1.00 0.00 H new ATOM 1746 N GLY B 47 -10.881 -1.768 -11.473 1.00 0.00 N ATOM 1747 CA GLY B 47 -9.753 -1.515 -12.354 1.00 0.00 C ATOM 1748 C GLY B 47 -9.327 -0.046 -12.291 1.00 0.00 C ATOM 1749 O GLY B 47 -8.401 0.365 -12.988 1.00 0.00 O ATOM 0 H GLY B 47 -10.655 -1.761 -10.478 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -8.916 -2.153 -12.071 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -10.021 -1.776 -13.378 1.00 0.00 H new ATOM 1753 N GLN B 48 -10.024 0.703 -11.449 1.00 0.00 N ATOM 1754 CA GLN B 48 -9.729 2.117 -11.287 1.00 0.00 C ATOM 1755 C GLN B 48 -8.813 2.332 -10.081 1.00 0.00 C ATOM 1756 O GLN B 48 -8.304 1.373 -9.504 1.00 0.00 O ATOM 1757 CB GLN B 48 -11.016 2.933 -11.150 1.00 0.00 C ATOM 1758 CG GLN B 48 -11.523 3.390 -12.519 1.00 0.00 C ATOM 1759 CD GLN B 48 -12.728 4.323 -12.374 1.00 0.00 C ATOM 1760 OE1 GLN B 48 -12.468 5.592 -12.675 1.00 0.00 O flip ATOM 1761 NE2 GLN B 48 -13.820 3.917 -12.013 1.00 0.00 N flip ATOM 0 H GLN B 48 -10.791 0.358 -10.872 1.00 0.00 H new ATOM 0 HA GLN B 48 -9.210 2.465 -12.180 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -11.781 2.333 -10.657 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -10.835 3.801 -10.517 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -10.724 3.903 -13.054 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -11.801 2.522 -13.116 1.00 0.00 H new ATOM 0 HE21 GLN B 48 -13.951 2.929 -11.797 1.00 0.00 H new ATOM 0 HE22 GLN B 48 -14.602 4.566 -11.927 1.00 0.00 H new ATOM 1770 N LYS B 49 -8.630 3.599 -9.735 1.00 0.00 N ATOM 1771 CA LYS B 49 -7.784 3.953 -8.609 1.00 0.00 C ATOM 1772 C LYS B 49 -8.400 5.140 -7.867 1.00 0.00 C ATOM 1773 O LYS B 49 -9.034 5.998 -8.479 1.00 0.00 O ATOM 1774 CB LYS B 49 -6.347 4.197 -9.074 1.00 0.00 C ATOM 1775 CG LYS B 49 -5.775 2.956 -9.764 1.00 0.00 C ATOM 1776 CD LYS B 49 -5.938 3.050 -11.283 1.00 0.00 C ATOM 1777 CE LYS B 49 -6.124 1.663 -11.901 1.00 0.00 C ATOM 1778 NZ LYS B 49 -6.317 1.769 -13.364 1.00 0.00 N ATOM 0 H LYS B 49 -9.054 4.393 -10.216 1.00 0.00 H new ATOM 0 HA LYS B 49 -7.729 3.127 -7.900 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -6.322 5.043 -9.761 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -5.724 4.462 -8.219 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -4.719 2.850 -9.514 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -6.281 2.064 -9.395 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -6.797 3.677 -11.522 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -5.062 3.531 -11.717 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -5.253 1.043 -11.687 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -6.985 1.170 -11.450 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -7.193 1.278 -13.635 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -6.384 2.771 -13.634 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -5.510 1.333 -13.853 1.00 0.00 H new ATOM 1792 N ALA B 50 -8.192 5.152 -6.558 1.00 0.00 N ATOM 1793 CA ALA B 50 -8.719 6.220 -5.726 1.00 0.00 C ATOM 1794 C ALA B 50 -7.630 6.694 -4.762 1.00 0.00 C ATOM 1795 O ALA B 50 -7.235 5.960 -3.857 1.00 0.00 O ATOM 1796 CB ALA B 50 -9.971 5.728 -4.996 1.00 0.00 C ATOM 0 H ALA B 50 -7.666 4.439 -6.053 1.00 0.00 H new ATOM 0 HA ALA B 50 -9.012 7.074 -6.337 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -10.367 6.529 -4.372 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -10.724 5.431 -5.726 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -9.715 4.873 -4.370 1.00 0.00 H new ATOM 1802 N CYS B 51 -7.177 7.918 -4.987 1.00 0.00 N ATOM 1803 CA CYS B 51 -6.141 8.499 -4.150 1.00 0.00 C ATOM 1804 C CYS B 51 -6.736 8.764 -2.765 1.00 0.00 C ATOM 1805 O CYS B 51 -7.881 9.200 -2.651 1.00 0.00 O ATOM 1806 CB CYS B 51 -5.555 9.768 -4.772 1.00 0.00 C ATOM 1807 SG CYS B 51 -4.007 9.516 -5.714 1.00 0.00 S ATOM 0 H CYS B 51 -7.509 8.524 -5.737 1.00 0.00 H new ATOM 0 HA CYS B 51 -5.309 7.801 -4.060 1.00 0.00 H new ATOM 0 HB2 CYS B 51 -6.300 10.208 -5.435 1.00 0.00 H new ATOM 0 HB3 CYS B 51 -5.367 10.491 -3.979 1.00 0.00 H new ATOM 1812 N LEU B 52 -5.932 8.491 -1.748 1.00 0.00 N ATOM 1813 CA LEU B 52 -6.365 8.695 -0.376 1.00 0.00 C ATOM 1814 C LEU B 52 -5.545 9.825 0.250 1.00 0.00 C ATOM 1815 O LEU B 52 -4.483 10.182 -0.259 1.00 0.00 O ATOM 1816 CB LEU B 52 -6.300 7.382 0.407 1.00 0.00 C ATOM 1817 CG LEU B 52 -7.113 6.220 -0.166 1.00 0.00 C ATOM 1818 CD1 LEU B 52 -6.599 4.879 0.362 1.00 0.00 C ATOM 1819 CD2 LEU B 52 -8.607 6.408 0.106 1.00 0.00 C ATOM 0 H LEU B 52 -4.983 8.130 -1.847 1.00 0.00 H new ATOM 0 HA LEU B 52 -7.410 9.005 -0.348 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -5.257 7.072 0.473 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -6.641 7.571 1.425 1.00 0.00 H new ATOM 0 HG LEU B 52 -6.982 6.213 -1.248 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -7.194 4.069 -0.061 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -5.555 4.751 0.075 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -6.681 4.860 1.449 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -9.161 5.568 -0.312 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -8.778 6.456 1.181 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -8.948 7.334 -0.357 1.00 0.00 H new ATOM 1831 N ASN B 53 -6.068 10.357 1.345 1.00 0.00 N ATOM 1832 CA ASN B 53 -5.398 11.439 2.046 1.00 0.00 C ATOM 1833 C ASN B 53 -4.542 10.858 3.172 1.00 0.00 C ATOM 1834 O ASN B 53 -5.064 10.238 4.097 1.00 0.00 O ATOM 1835 CB ASN B 53 -6.411 12.401 2.670 1.00 0.00 C ATOM 1836 CG ASN B 53 -5.734 13.702 3.107 1.00 0.00 C ATOM 1837 OD1 ASN B 53 -4.791 14.177 2.495 1.00 0.00 O ATOM 1838 ND2 ASN B 53 -6.266 14.249 4.195 1.00 0.00 N ATOM 0 H ASN B 53 -6.949 10.059 1.764 1.00 0.00 H new ATOM 0 HA ASN B 53 -4.784 11.979 1.325 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -7.200 12.621 1.951 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -6.886 11.928 3.529 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -5.885 15.119 4.566 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -7.055 13.798 4.659 1.00 0.00 H new ATOM 1845 N PRO B 54 -3.206 11.085 3.054 1.00 0.00 N ATOM 1846 CA PRO B 54 -2.272 10.591 4.052 1.00 0.00 C ATOM 1847 C PRO B 54 -2.337 11.432 5.328 1.00 0.00 C ATOM 1848 O PRO B 54 -1.607 11.173 6.284 1.00 0.00 O ATOM 1849 CB PRO B 54 -0.911 10.641 3.376 1.00 0.00 C ATOM 1850 CG PRO B 54 -1.066 11.591 2.199 1.00 0.00 C ATOM 1851 CD PRO B 54 -2.552 11.815 1.972 1.00 0.00 C ATOM 0 HA PRO B 54 -2.503 9.577 4.378 1.00 0.00 H new ATOM 0 HB2 PRO B 54 -0.145 10.995 4.066 1.00 0.00 H new ATOM 0 HB3 PRO B 54 -0.605 9.650 3.041 1.00 0.00 H new ATOM 0 HG2 PRO B 54 -0.564 12.537 2.404 1.00 0.00 H new ATOM 0 HG3 PRO B 54 -0.603 11.171 1.306 1.00 0.00 H new ATOM 0 HD2 PRO B 54 -2.802 12.876 2.002 1.00 0.00 H new ATOM 0 HD3 PRO B 54 -2.864 11.442 0.997 1.00 0.00 H new ATOM 1859 N ALA B 55 -3.218 12.421 5.303 1.00 0.00 N ATOM 1860 CA ALA B 55 -3.389 13.301 6.446 1.00 0.00 C ATOM 1861 C ALA B 55 -4.710 12.973 7.144 1.00 0.00 C ATOM 1862 O ALA B 55 -5.127 13.685 8.057 1.00 0.00 O ATOM 1863 CB ALA B 55 -3.319 14.758 5.983 1.00 0.00 C ATOM 0 H ALA B 55 -3.822 12.632 4.508 1.00 0.00 H new ATOM 0 HA ALA B 55 -2.588 13.150 7.170 1.00 0.00 H new ATOM 0 HB1 ALA B 55 -3.447 15.419 6.840 1.00 0.00 H new ATOM 0 HB2 ALA B 55 -2.350 14.947 5.521 1.00 0.00 H new ATOM 0 HB3 ALA B 55 -4.110 14.948 5.257 1.00 0.00 H new ATOM 1869 N SER B 56 -5.332 11.896 6.689 1.00 0.00 N ATOM 1870 CA SER B 56 -6.597 11.465 7.259 1.00 0.00 C ATOM 1871 C SER B 56 -6.386 10.219 8.120 1.00 0.00 C ATOM 1872 O SER B 56 -5.542 9.380 7.809 1.00 0.00 O ATOM 1873 CB SER B 56 -7.627 11.185 6.163 1.00 0.00 C ATOM 1874 OG SER B 56 -8.908 10.869 6.702 1.00 0.00 O ATOM 0 H SER B 56 -4.983 11.308 5.932 1.00 0.00 H new ATOM 0 HA SER B 56 -6.982 12.270 7.885 1.00 0.00 H new ATOM 0 HB2 SER B 56 -7.712 12.057 5.514 1.00 0.00 H new ATOM 0 HB3 SER B 56 -7.281 10.358 5.543 1.00 0.00 H new ATOM 0 HG SER B 56 -9.538 10.698 5.971 1.00 0.00 H new ATOM 1880 N PRO B 57 -7.187 10.135 9.216 1.00 0.00 N ATOM 1881 CA PRO B 57 -7.096 9.005 10.125 1.00 0.00 C ATOM 1882 C PRO B 57 -7.740 7.758 9.516 1.00 0.00 C ATOM 1883 O PRO B 57 -7.159 6.674 9.553 1.00 0.00 O ATOM 1884 CB PRO B 57 -7.786 9.468 11.398 1.00 0.00 C ATOM 1885 CG PRO B 57 -8.641 10.660 10.999 1.00 0.00 C ATOM 1886 CD PRO B 57 -8.198 11.110 9.617 1.00 0.00 C ATOM 0 HA PRO B 57 -6.066 8.712 10.330 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -8.399 8.672 11.822 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -7.056 9.748 12.158 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -9.696 10.387 10.991 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -8.526 11.470 11.719 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -9.034 11.124 8.918 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -7.787 12.119 9.642 1.00 0.00 H new ATOM 1894 N MET B 58 -8.931 7.953 8.970 1.00 0.00 N ATOM 1895 CA MET B 58 -9.660 6.857 8.353 1.00 0.00 C ATOM 1896 C MET B 58 -8.847 6.226 7.222 1.00 0.00 C ATOM 1897 O MET B 58 -9.112 5.094 6.819 1.00 0.00 O ATOM 1898 CB MET B 58 -10.989 7.376 7.800 1.00 0.00 C ATOM 1899 CG MET B 58 -12.123 6.389 8.083 1.00 0.00 C ATOM 1900 SD MET B 58 -13.064 6.930 9.501 1.00 0.00 S ATOM 1901 CE MET B 58 -11.756 7.058 10.710 1.00 0.00 C ATOM 0 H MET B 58 -9.410 8.853 8.942 1.00 0.00 H new ATOM 0 HA MET B 58 -9.844 6.095 9.110 1.00 0.00 H new ATOM 0 HB2 MET B 58 -11.222 8.341 8.249 1.00 0.00 H new ATOM 0 HB3 MET B 58 -10.902 7.537 6.725 1.00 0.00 H new ATOM 0 HG2 MET B 58 -12.774 6.311 7.212 1.00 0.00 H new ATOM 0 HG3 MET B 58 -11.714 5.395 8.265 1.00 0.00 H new ATOM 0 HE1 MET B 58 -12.188 7.212 11.699 1.00 0.00 H new ATOM 0 HE2 MET B 58 -11.169 6.139 10.710 1.00 0.00 H new ATOM 0 HE3 MET B 58 -11.111 7.900 10.460 1.00 0.00 H new ATOM 1911 N VAL B 59 -7.874 6.985 6.740 1.00 0.00 N ATOM 1912 CA VAL B 59 -7.020 6.514 5.663 1.00 0.00 C ATOM 1913 C VAL B 59 -5.947 5.586 6.237 1.00 0.00 C ATOM 1914 O VAL B 59 -5.223 4.931 5.488 1.00 0.00 O ATOM 1915 CB VAL B 59 -6.435 7.704 4.900 1.00 0.00 C ATOM 1916 CG1 VAL B 59 -5.180 7.296 4.126 1.00 0.00 C ATOM 1917 CG2 VAL B 59 -7.478 8.323 3.966 1.00 0.00 C ATOM 0 H VAL B 59 -7.658 7.924 7.076 1.00 0.00 H new ATOM 0 HA VAL B 59 -7.598 5.936 4.942 1.00 0.00 H new ATOM 0 HB VAL B 59 -6.147 8.461 5.630 1.00 0.00 H new ATOM 0 HG11 VAL B 59 -4.784 8.160 3.593 1.00 0.00 H new ATOM 0 HG12 VAL B 59 -4.428 6.924 4.822 1.00 0.00 H new ATOM 0 HG13 VAL B 59 -5.432 6.513 3.411 1.00 0.00 H new ATOM 0 HG21 VAL B 59 -7.036 9.167 3.436 1.00 0.00 H new ATOM 0 HG22 VAL B 59 -7.811 7.576 3.246 1.00 0.00 H new ATOM 0 HG23 VAL B 59 -8.331 8.668 4.551 1.00 0.00 H new ATOM 1927 N LYS B 60 -5.879 5.559 7.560 1.00 0.00 N ATOM 1928 CA LYS B 60 -4.907 4.723 8.242 1.00 0.00 C ATOM 1929 C LYS B 60 -5.611 3.488 8.809 1.00 0.00 C ATOM 1930 O LYS B 60 -4.989 2.668 9.482 1.00 0.00 O ATOM 1931 CB LYS B 60 -4.146 5.534 9.293 1.00 0.00 C ATOM 1932 CG LYS B 60 -3.786 6.922 8.760 1.00 0.00 C ATOM 1933 CD LYS B 60 -2.716 6.830 7.670 1.00 0.00 C ATOM 1934 CE LYS B 60 -1.312 6.865 8.276 1.00 0.00 C ATOM 1935 NZ LYS B 60 -0.725 5.507 8.304 1.00 0.00 N ATOM 0 H LYS B 60 -6.482 6.103 8.178 1.00 0.00 H new ATOM 0 HA LYS B 60 -4.153 4.366 7.541 1.00 0.00 H new ATOM 0 HB2 LYS B 60 -4.754 5.632 10.192 1.00 0.00 H new ATOM 0 HB3 LYS B 60 -3.238 5.004 9.579 1.00 0.00 H new ATOM 0 HG2 LYS B 60 -4.678 7.404 8.360 1.00 0.00 H new ATOM 0 HG3 LYS B 60 -3.425 7.547 9.577 1.00 0.00 H new ATOM 0 HD2 LYS B 60 -2.848 5.909 7.102 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -2.834 7.656 6.969 1.00 0.00 H new ATOM 0 HE2 LYS B 60 -0.675 7.531 7.694 1.00 0.00 H new ATOM 0 HE3 LYS B 60 -1.356 7.269 9.287 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 0.309 5.574 8.218 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 -0.968 5.042 9.202 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -1.103 4.949 7.512 1.00 0.00 H new ATOM 1949 N LYS B 61 -6.900 3.395 8.517 1.00 0.00 N ATOM 1950 CA LYS B 61 -7.696 2.275 8.989 1.00 0.00 C ATOM 1951 C LYS B 61 -8.260 1.514 7.788 1.00 0.00 C ATOM 1952 O LYS B 61 -8.721 0.381 7.927 1.00 0.00 O ATOM 1953 CB LYS B 61 -8.766 2.755 9.971 1.00 0.00 C ATOM 1954 CG LYS B 61 -9.999 3.274 9.228 1.00 0.00 C ATOM 1955 CD LYS B 61 -11.129 2.244 9.253 1.00 0.00 C ATOM 1956 CE LYS B 61 -12.328 2.764 10.050 1.00 0.00 C ATOM 1957 NZ LYS B 61 -13.516 1.913 9.813 1.00 0.00 N ATOM 0 H LYS B 61 -7.413 4.077 7.959 1.00 0.00 H new ATOM 0 HA LYS B 61 -7.075 1.574 9.547 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -9.053 1.936 10.631 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -8.358 3.545 10.602 1.00 0.00 H new ATOM 0 HG2 LYS B 61 -10.339 4.203 9.685 1.00 0.00 H new ATOM 0 HG3 LYS B 61 -9.735 3.505 8.196 1.00 0.00 H new ATOM 0 HD2 LYS B 61 -11.438 2.013 8.234 1.00 0.00 H new ATOM 0 HD3 LYS B 61 -10.769 1.315 9.695 1.00 0.00 H new ATOM 0 HE2 LYS B 61 -12.088 2.776 11.113 1.00 0.00 H new ATOM 0 HE3 LYS B 61 -12.546 3.792 9.761 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 -14.376 2.495 9.868 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 -13.451 1.480 8.869 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 -13.557 1.165 10.535 1.00 0.00 H new ATOM 1971 N ILE B 62 -8.206 2.165 6.636 1.00 0.00 N ATOM 1972 CA ILE B 62 -8.706 1.564 5.411 1.00 0.00 C ATOM 1973 C ILE B 62 -7.568 0.813 4.716 1.00 0.00 C ATOM 1974 O ILE B 62 -7.812 -0.020 3.844 1.00 0.00 O ATOM 1975 CB ILE B 62 -9.374 2.621 4.529 1.00 0.00 C ATOM 1976 CG1 ILE B 62 -10.540 3.288 5.261 1.00 0.00 C ATOM 1977 CG2 ILE B 62 -9.805 2.023 3.189 1.00 0.00 C ATOM 1978 CD1 ILE B 62 -10.745 4.723 4.773 1.00 0.00 C ATOM 0 H ILE B 62 -7.823 3.104 6.525 1.00 0.00 H new ATOM 0 HA ILE B 62 -9.482 0.832 5.635 1.00 0.00 H new ATOM 0 HB ILE B 62 -8.642 3.399 4.314 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -11.452 2.712 5.101 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -10.348 3.289 6.334 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -10.277 2.795 2.581 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -8.931 1.633 2.667 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -10.514 1.214 3.363 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -11.580 5.174 5.309 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -9.840 5.302 4.957 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -10.961 4.717 3.705 1.00 0.00 H new ATOM 1990 N ILE B 63 -6.351 1.134 5.128 1.00 0.00 N ATOM 1991 CA ILE B 63 -5.175 0.500 4.556 1.00 0.00 C ATOM 1992 C ILE B 63 -4.768 -0.690 5.427 1.00 0.00 C ATOM 1993 O ILE B 63 -4.670 -1.816 4.940 1.00 0.00 O ATOM 1994 CB ILE B 63 -4.058 1.525 4.354 1.00 0.00 C ATOM 1995 CG1 ILE B 63 -4.371 2.453 3.178 1.00 0.00 C ATOM 1996 CG2 ILE B 63 -2.702 0.834 4.194 1.00 0.00 C ATOM 1997 CD1 ILE B 63 -3.691 3.812 3.356 1.00 0.00 C ATOM 0 H ILE B 63 -6.153 1.825 5.852 1.00 0.00 H new ATOM 0 HA ILE B 63 -5.399 0.108 3.564 1.00 0.00 H new ATOM 0 HB ILE B 63 -3.999 2.147 5.248 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -4.036 1.994 2.248 1.00 0.00 H new ATOM 0 HG13 ILE B 63 -5.449 2.590 3.095 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -1.925 1.585 4.052 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -2.483 0.251 5.088 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -2.730 0.173 3.328 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -3.930 4.452 2.507 1.00 0.00 H new ATOM 0 HD12 ILE B 63 -4.047 4.279 4.274 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -2.611 3.674 3.414 1.00 0.00 H new ATOM 2009 N GLU B 64 -4.542 -0.401 6.700 1.00 0.00 N ATOM 2010 CA GLU B 64 -4.148 -1.433 7.643 1.00 0.00 C ATOM 2011 C GLU B 64 -5.152 -2.588 7.617 1.00 0.00 C ATOM 2012 O GLU B 64 -4.774 -3.748 7.775 1.00 0.00 O ATOM 2013 CB GLU B 64 -4.007 -0.861 9.055 1.00 0.00 C ATOM 2014 CG GLU B 64 -2.867 0.157 9.123 1.00 0.00 C ATOM 2015 CD GLU B 64 -3.056 1.114 10.302 1.00 0.00 C ATOM 2016 OE1 GLU B 64 -4.053 0.925 11.032 1.00 0.00 O ATOM 2017 OE2 GLU B 64 -2.199 2.012 10.447 1.00 0.00 O ATOM 0 H GLU B 64 -4.624 0.534 7.100 1.00 0.00 H new ATOM 0 HA GLU B 64 -3.173 -1.818 7.343 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -4.942 -0.386 9.354 1.00 0.00 H new ATOM 0 HB3 GLU B 64 -3.820 -1.669 9.762 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -1.915 -0.364 9.222 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -2.825 0.724 8.193 1.00 0.00 H new ATOM 2024 N LYS B 65 -6.412 -2.230 7.417 1.00 0.00 N ATOM 2025 CA LYS B 65 -7.473 -3.222 7.369 1.00 0.00 C ATOM 2026 C LYS B 65 -7.363 -4.016 6.066 1.00 0.00 C ATOM 2027 O LYS B 65 -7.675 -5.206 6.032 1.00 0.00 O ATOM 2028 CB LYS B 65 -8.836 -2.558 7.570 1.00 0.00 C ATOM 2029 CG LYS B 65 -9.099 -2.284 9.053 1.00 0.00 C ATOM 2030 CD LYS B 65 -10.579 -1.989 9.302 1.00 0.00 C ATOM 2031 CE LYS B 65 -10.799 -1.445 10.715 1.00 0.00 C ATOM 2032 NZ LYS B 65 -12.185 -0.947 10.868 1.00 0.00 N ATOM 0 H LYS B 65 -6.722 -1.267 7.286 1.00 0.00 H new ATOM 0 HA LYS B 65 -7.367 -3.934 8.188 1.00 0.00 H new ATOM 0 HB2 LYS B 65 -8.875 -1.623 7.011 1.00 0.00 H new ATOM 0 HB3 LYS B 65 -9.620 -3.201 7.171 1.00 0.00 H new ATOM 0 HG2 LYS B 65 -8.792 -3.146 9.646 1.00 0.00 H new ATOM 0 HG3 LYS B 65 -8.495 -1.438 9.383 1.00 0.00 H new ATOM 0 HD2 LYS B 65 -10.938 -1.265 8.570 1.00 0.00 H new ATOM 0 HD3 LYS B 65 -11.163 -2.899 9.164 1.00 0.00 H new ATOM 0 HE2 LYS B 65 -10.605 -2.229 11.447 1.00 0.00 H new ATOM 0 HE3 LYS B 65 -10.092 -0.639 10.915 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 -12.250 -0.360 11.724 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 -12.443 -0.378 10.037 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 -12.836 -1.753 10.951 1.00 0.00 H new ATOM 2046 N MET B 66 -6.918 -3.327 5.025 1.00 0.00 N ATOM 2047 CA MET B 66 -6.762 -3.954 3.724 1.00 0.00 C ATOM 2048 C MET B 66 -5.750 -5.099 3.784 1.00 0.00 C ATOM 2049 O MET B 66 -5.939 -6.134 3.146 1.00 0.00 O ATOM 2050 CB MET B 66 -6.294 -2.911 2.707 1.00 0.00 C ATOM 2051 CG MET B 66 -7.323 -2.735 1.589 1.00 0.00 C ATOM 2052 SD MET B 66 -7.348 -4.185 0.548 1.00 0.00 S ATOM 2053 CE MET B 66 -5.608 -4.330 0.178 1.00 0.00 C ATOM 0 H MET B 66 -6.661 -2.341 5.057 1.00 0.00 H new ATOM 0 HA MET B 66 -7.726 -4.363 3.421 1.00 0.00 H new ATOM 0 HB2 MET B 66 -6.130 -1.957 3.208 1.00 0.00 H new ATOM 0 HB3 MET B 66 -5.338 -3.216 2.281 1.00 0.00 H new ATOM 0 HG2 MET B 66 -8.312 -2.567 2.017 1.00 0.00 H new ATOM 0 HG3 MET B 66 -7.079 -1.855 0.994 1.00 0.00 H new ATOM 0 HE1 MET B 66 -5.482 -4.750 -0.820 1.00 0.00 H new ATOM 0 HE2 MET B 66 -5.144 -3.344 0.218 1.00 0.00 H new ATOM 0 HE3 MET B 66 -5.134 -4.984 0.909 1.00 0.00 H new ATOM 2063 N LEU B 67 -4.696 -4.875 4.556 1.00 0.00 N ATOM 2064 CA LEU B 67 -3.653 -5.876 4.708 1.00 0.00 C ATOM 2065 C LEU B 67 -4.204 -7.065 5.497 1.00 0.00 C ATOM 2066 O LEU B 67 -3.606 -8.140 5.506 1.00 0.00 O ATOM 2067 CB LEU B 67 -2.400 -5.254 5.327 1.00 0.00 C ATOM 2068 CG LEU B 67 -1.530 -4.420 4.385 1.00 0.00 C ATOM 2069 CD1 LEU B 67 -2.356 -3.335 3.691 1.00 0.00 C ATOM 2070 CD2 LEU B 67 -0.324 -3.836 5.125 1.00 0.00 C ATOM 0 H LEU B 67 -4.542 -4.015 5.083 1.00 0.00 H new ATOM 0 HA LEU B 67 -3.344 -6.256 3.734 1.00 0.00 H new ATOM 0 HB2 LEU B 67 -2.706 -4.623 6.161 1.00 0.00 H new ATOM 0 HB3 LEU B 67 -1.788 -6.055 5.741 1.00 0.00 H new ATOM 0 HG LEU B 67 -1.143 -5.078 3.606 1.00 0.00 H new ATOM 0 HD11 LEU B 67 -1.713 -2.757 3.027 1.00 0.00 H new ATOM 0 HD12 LEU B 67 -3.153 -3.800 3.110 1.00 0.00 H new ATOM 0 HD13 LEU B 67 -2.792 -2.674 4.440 1.00 0.00 H new ATOM 0 HD21 LEU B 67 0.278 -3.248 4.432 1.00 0.00 H new ATOM 0 HD22 LEU B 67 -0.670 -3.197 5.938 1.00 0.00 H new ATOM 0 HD23 LEU B 67 0.280 -4.647 5.533 1.00 0.00 H new ATOM 2082 N LYS B 68 -5.339 -6.832 6.141 1.00 0.00 N ATOM 2083 CA LYS B 68 -5.977 -7.871 6.932 1.00 0.00 C ATOM 2084 C LYS B 68 -7.161 -8.445 6.152 1.00 0.00 C ATOM 2085 O LYS B 68 -7.505 -9.615 6.309 1.00 0.00 O ATOM 2086 CB LYS B 68 -6.353 -7.336 8.315 1.00 0.00 C ATOM 2087 CG LYS B 68 -5.461 -7.945 9.399 1.00 0.00 C ATOM 2088 CD LYS B 68 -6.236 -8.133 10.705 1.00 0.00 C ATOM 2089 CE LYS B 68 -5.791 -7.116 11.758 1.00 0.00 C ATOM 2090 NZ LYS B 68 -6.848 -6.103 11.979 1.00 0.00 N ATOM 0 H LYS B 68 -5.833 -5.940 6.131 1.00 0.00 H new ATOM 0 HA LYS B 68 -5.284 -8.693 7.111 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -6.257 -6.250 8.327 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -7.397 -7.566 8.526 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -5.075 -8.906 9.060 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -4.600 -7.299 9.572 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -7.304 -8.024 10.517 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -6.081 -9.144 11.082 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -5.567 -7.627 12.694 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -4.872 -6.627 11.435 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -6.530 -5.420 12.696 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -7.042 -5.603 11.088 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -7.715 -6.573 12.308 1.00 0.00 H new ATOM 2104 N ASN B 69 -7.753 -7.593 5.327 1.00 0.00 N ATOM 2105 CA ASN B 69 -8.892 -8.001 4.522 1.00 0.00 C ATOM 2106 C ASN B 69 -10.040 -8.419 5.443 1.00 0.00 C ATOM 2107 O ASN B 69 -10.981 -7.656 5.653 1.00 0.00 O ATOM 2108 CB ASN B 69 -8.539 -9.196 3.634 1.00 0.00 C ATOM 2109 CG ASN B 69 -9.791 -9.776 2.972 1.00 0.00 C ATOM 2110 OD1 ASN B 69 -10.876 -9.223 3.046 1.00 0.00 O ATOM 2111 ND2 ASN B 69 -9.580 -10.916 2.321 1.00 0.00 N ATOM 0 H ASN B 69 -7.465 -6.623 5.199 1.00 0.00 H new ATOM 0 HA ASN B 69 -9.180 -7.158 3.894 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -7.828 -8.887 2.868 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -8.049 -9.965 4.231 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -10.352 -11.381 1.844 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -8.646 -11.325 2.299 1.00 0.00 H new ATOM 2118 N GLY B 70 -9.923 -9.630 5.969 1.00 0.00 N ATOM 2119 CA GLY B 70 -10.939 -10.158 6.863 1.00 0.00 C ATOM 2120 C GLY B 70 -12.334 -10.022 6.250 1.00 0.00 C ATOM 2121 O GLY B 70 -12.469 -9.837 5.041 1.00 0.00 O ATOM 0 H GLY B 70 -9.140 -10.260 5.793 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -10.732 -11.207 7.075 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -10.903 -9.627 7.814 1.00 0.00 H new ATOM 2125 N LYS B 71 -13.336 -10.120 7.111 1.00 0.00 N ATOM 2126 CA LYS B 71 -14.716 -10.010 6.669 1.00 0.00 C ATOM 2127 C LYS B 71 -15.442 -8.975 7.531 1.00 0.00 C ATOM 2128 O LYS B 71 -16.006 -8.014 7.011 1.00 0.00 O ATOM 2129 CB LYS B 71 -15.387 -11.384 6.661 1.00 0.00 C ATOM 2130 CG LYS B 71 -16.197 -11.592 5.380 1.00 0.00 C ATOM 2131 CD LYS B 71 -16.699 -13.034 5.276 1.00 0.00 C ATOM 2132 CE LYS B 71 -16.665 -13.524 3.827 1.00 0.00 C ATOM 2133 NZ LYS B 71 -15.948 -14.815 3.733 1.00 0.00 N ATOM 0 H LYS B 71 -13.220 -10.274 8.113 1.00 0.00 H new ATOM 0 HA LYS B 71 -14.759 -9.654 5.640 1.00 0.00 H new ATOM 0 HB2 LYS B 71 -14.629 -12.163 6.747 1.00 0.00 H new ATOM 0 HB3 LYS B 71 -16.041 -11.478 7.528 1.00 0.00 H new ATOM 0 HG2 LYS B 71 -17.044 -10.906 5.366 1.00 0.00 H new ATOM 0 HG3 LYS B 71 -15.580 -11.354 4.513 1.00 0.00 H new ATOM 0 HD2 LYS B 71 -16.082 -13.683 5.898 1.00 0.00 H new ATOM 0 HD3 LYS B 71 -17.717 -13.097 5.661 1.00 0.00 H new ATOM 0 HE2 LYS B 71 -17.682 -13.638 3.452 1.00 0.00 H new ATOM 0 HE3 LYS B 71 -16.174 -12.782 3.197 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 -15.934 -15.133 2.743 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 -14.972 -14.696 4.072 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 -16.433 -15.525 4.318 1.00 0.00 H new ATOM 2147 N SER B 72 -15.405 -9.208 8.835 1.00 0.00 N ATOM 2148 CA SER B 72 -16.053 -8.308 9.775 1.00 0.00 C ATOM 2149 C SER B 72 -15.727 -6.857 9.419 1.00 0.00 C ATOM 2150 O SER B 72 -16.628 -6.033 9.268 1.00 0.00 O ATOM 2151 CB SER B 72 -15.625 -8.612 11.212 1.00 0.00 C ATOM 2152 OG SER B 72 -16.735 -8.955 12.038 1.00 0.00 O ATOM 0 H SER B 72 -14.937 -10.007 9.263 1.00 0.00 H new ATOM 0 HA SER B 72 -17.130 -8.458 9.706 1.00 0.00 H new ATOM 0 HB2 SER B 72 -14.907 -9.432 11.211 1.00 0.00 H new ATOM 0 HB3 SER B 72 -15.116 -7.743 11.630 1.00 0.00 H new ATOM 0 HG SER B 72 -16.421 -9.144 12.947 1.00 0.00 H new ATOM 2158 N ASN B 73 -14.435 -6.587 9.294 1.00 0.00 N ATOM 2159 CA ASN B 73 -13.979 -5.249 8.959 1.00 0.00 C ATOM 2160 C ASN B 73 -14.578 -4.248 9.948 1.00 0.00 C ATOM 2161 O ASN B 73 -13.852 -3.475 10.572 1.00 0.00 O ATOM 2162 CB ASN B 73 -14.428 -4.851 7.552 1.00 0.00 C ATOM 2163 CG ASN B 73 -13.817 -3.509 7.141 1.00 0.00 C ATOM 2164 OD1 ASN B 73 -14.346 -2.446 7.420 1.00 0.00 O ATOM 2165 ND2 ASN B 73 -12.678 -3.618 6.464 1.00 0.00 N ATOM 0 H ASN B 73 -13.690 -7.273 9.419 1.00 0.00 H new ATOM 0 HA ASN B 73 -12.890 -5.242 9.005 1.00 0.00 H new ATOM 0 HB2 ASN B 73 -14.133 -5.622 6.840 1.00 0.00 H new ATOM 0 HB3 ASN B 73 -15.515 -4.785 7.518 1.00 0.00 H new ATOM 0 HD21 ASN B 73 -12.192 -2.780 6.144 1.00 0.00 H new ATOM 0 HD22 ASN B 73 -12.290 -4.540 6.264 1.00 0.00 H new TER 2172 ASN B 73