USER MOD reduce.3.24.130724 H: found=0, std=0, add=1590, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1589 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 72 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 73 ASN : amide:sc= -0.402 K(o=-0.4,f=-1.2) USER MOD Set 2.1: B 62 CYS SG : rot 36:sc= 0.0455 USER MOD Set 2.2: B 98 ASN : amide:sc= 0.0924 K(o=0.14,f=-1.5!) USER MOD Set 3.1: A 12 GLN : amide:sc= -2.88 K(o=-4.7,f=-10!) USER MOD Set 3.2: A 94 GLN : amide:sc= -1.81 K(o=-4.7,f=-6.1!) USER MOD Set 4.1: A 19 GLN : amide:sc= -1.17 K(o=-3.6,f=-5.2!) USER MOD Set 4.2: A 101 TYR OH : rot 65:sc= -2.41 USER MOD Single : A 1 MET CE :methyl 150:sc= -0.173 (180deg=-0.605) USER MOD Single : A 1 MET N :NH3+ 152:sc= -0.134 (180deg=-0.666) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0.089) USER MOD Single : A 16 ASN : amide:sc= -0.114 K(o=-0.11,f=-2!) USER MOD Single : A 18 MET CE :methyl -146:sc= -4.47! (180deg=-6.34!) USER MOD Single : A 20 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00204) USER MOD Single : A 32 LYS NZ :NH3+ 147:sc= 0.0304 (180deg=-3.26!) USER MOD Single : A 36 SER OG : rot -3:sc= 0.891 USER MOD Single : A 37 THR OG1 : rot 160:sc= -1.28 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HD1:sc= -9.65 K(o=-9.7,f=-11!) USER MOD Single : A 45 LYS NZ :NH3+ 151:sc= -0.128 (180deg=-1.8!) USER MOD Single : A 48 MET CE :methyl -123:sc= -9.99! (180deg=-19.5!) USER MOD Single : A 50 LYS NZ :NH3+ -133:sc= 0.132 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.251 X(o=-0.25,f=-0.29) USER MOD Single : A 54 GLN : amide:sc= -0.835 K(o=-0.83,f=-3.8!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 170:sc= -2.8 USER MOD Single : A 60 GLN : amide:sc= -0.296 K(o=-0.3,f=-2.6!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -0.534 X(o=-0.53,f=-0.28) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 120:sc= -2.03 USER MOD Single : A 74 GLN : amide:sc= 0.781 K(o=0.78,f=-0.39) USER MOD Single : A 76 SER OG : rot -110:sc= -0.147 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -2.72! C(o=-2.7!,f=-11!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 CYS SG : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot -90:sc= 0.424 USER MOD Single : A 103 ASN : amide:sc= -0.194 K(o=-0.19,f=-2!) USER MOD Single : B 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 36 HIS : no HD1:sc= -9.53! C(o=-9.5!,f=-18!) USER MOD Single : B 37 SER OG : rot 160:sc= -0.744 USER MOD Single : B 46 LYS NZ :NH3+ 169:sc= -0.913 (180deg=-0.93) USER MOD Single : B 51 SER OG : rot 180:sc= 0 USER MOD Single : B 54 THR OG1 : rot -58:sc= 0.559 USER MOD Single : B 55 ASN : amide:sc= -0.434 K(o=-0.43,f=-2.2!) USER MOD Single : B 68 HIS : no HE2:sc= -3.47 X(o=-3.5,f=-3.4!) USER MOD Single : B 76 SER OG : rot -64:sc= -0.961 USER MOD Single : B 78 CYS SG : rot 180:sc= 0 USER MOD Single : B 81 THR OG1 : rot 180:sc= 0 USER MOD Single : B 87 TYR OH : rot 180:sc= 0 USER MOD Single : B 88 THR OG1 : rot 180:sc= 0 USER MOD Single : B 93 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : B 96 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0944) USER MOD Single : B 100 GLN : amide:sc= -3.32 X(o=-3.3,f=-3.7!) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 104 MET CE :methyl -160:sc= -9.32! (180deg=-11.4!) USER MOD Single : B 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 108 CYS SG : rot -120:sc= -0.0601 USER MOD Single : B 109 SER OG : rot 180:sc= 0 USER MOD Single : B 110 LYS NZ :NH3+ -161:sc= -1.64 (180deg=-2.34) USER MOD Single : B 113 ASN : amide:sc= -0.115 K(o=-0.12,f=-1.6!) USER MOD Single : B 116 HIS : no HD1:sc= -1.84 K(o=-1.8,f=-1.3) USER MOD Single : B 118 ASN : amide:sc= -1.67 K(o=-1.7,f=-0.35) USER MOD Single : B 121 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.219 27.440 -8.622 1.00 0.00 N ATOM 2 CA MET A 1 2.072 28.215 -8.082 1.00 0.00 C ATOM 3 C MET A 1 1.164 27.335 -7.230 1.00 0.00 C ATOM 4 O MET A 1 0.674 26.303 -7.689 1.00 0.00 O ATOM 5 CB MET A 1 1.285 28.803 -9.256 1.00 0.00 C ATOM 6 CG MET A 1 0.651 27.752 -10.152 1.00 0.00 C ATOM 7 SD MET A 1 -1.091 27.478 -9.775 1.00 0.00 S ATOM 8 CE MET A 1 -1.214 25.707 -10.010 1.00 0.00 C ATOM 0 H1 MET A 1 3.533 27.864 -9.518 1.00 0.00 H new ATOM 0 H2 MET A 1 4.002 27.457 -7.938 1.00 0.00 H new ATOM 0 H3 MET A 1 2.926 26.456 -8.788 1.00 0.00 H new ATOM 0 HA MET A 1 2.449 29.014 -7.443 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.504 29.456 -8.868 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.952 29.424 -9.854 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.749 28.060 -11.193 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.194 26.813 -10.045 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.984 25.305 -9.351 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.476 25.495 -11.047 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.257 25.241 -9.775 1.00 0.00 H new ATOM 20 N ASP A 2 0.944 27.749 -5.986 1.00 0.00 N ATOM 21 CA ASP A 2 0.095 26.997 -5.068 1.00 0.00 C ATOM 22 C ASP A 2 -1.322 26.874 -5.618 1.00 0.00 C ATOM 23 O ASP A 2 -1.771 27.712 -6.399 1.00 0.00 O ATOM 24 CB ASP A 2 0.067 27.674 -3.697 1.00 0.00 C ATOM 25 CG ASP A 2 1.456 27.989 -3.179 1.00 0.00 C ATOM 26 OD1 ASP A 2 2.004 29.047 -3.554 1.00 0.00 O ATOM 27 OD2 ASP A 2 1.996 27.179 -2.397 1.00 0.00 O ATOM 0 H ASP A 2 1.342 28.601 -5.590 1.00 0.00 H new ATOM 0 HA ASP A 2 0.512 25.996 -4.962 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -0.511 28.596 -3.762 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -0.445 27.026 -2.985 1.00 0.00 H new ATOM 32 N LEU A 3 -2.022 25.823 -5.202 1.00 0.00 N ATOM 33 CA LEU A 3 -3.390 25.591 -5.651 1.00 0.00 C ATOM 34 C LEU A 3 -4.381 26.391 -4.810 1.00 0.00 C ATOM 35 O LEU A 3 -5.279 25.829 -4.182 1.00 0.00 O ATOM 36 CB LEU A 3 -3.724 24.099 -5.580 1.00 0.00 C ATOM 37 CG LEU A 3 -2.891 23.207 -6.501 1.00 0.00 C ATOM 38 CD1 LEU A 3 -1.447 23.154 -6.030 1.00 0.00 C ATOM 39 CD2 LEU A 3 -3.485 21.807 -6.569 1.00 0.00 C ATOM 0 H LEU A 3 -1.665 25.120 -4.556 1.00 0.00 H new ATOM 0 HA LEU A 3 -3.471 25.924 -6.686 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -3.590 23.760 -4.553 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -4.778 23.966 -5.825 1.00 0.00 H new ATOM 0 HG LEU A 3 -2.908 23.636 -7.503 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -0.870 22.515 -6.698 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -1.025 24.159 -6.036 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -1.409 22.750 -5.018 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -2.879 21.186 -7.229 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -3.499 21.369 -5.571 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -4.503 21.862 -6.956 1.00 0.00 H new ATOM 51 N SER A 4 -4.209 27.709 -4.802 1.00 0.00 N ATOM 52 CA SER A 4 -5.083 28.593 -4.039 1.00 0.00 C ATOM 53 C SER A 4 -4.965 28.332 -2.538 1.00 0.00 C ATOM 54 O SER A 4 -5.811 28.769 -1.757 1.00 0.00 O ATOM 55 CB SER A 4 -6.536 28.420 -4.484 1.00 0.00 C ATOM 56 OG SER A 4 -6.660 28.565 -5.888 1.00 0.00 O ATOM 0 H SER A 4 -3.471 28.189 -5.316 1.00 0.00 H new ATOM 0 HA SER A 4 -4.768 29.618 -4.233 1.00 0.00 H new ATOM 0 HB2 SER A 4 -6.897 27.436 -4.184 1.00 0.00 H new ATOM 0 HB3 SER A 4 -7.163 29.157 -3.982 1.00 0.00 H new ATOM 0 HG SER A 4 -7.598 28.448 -6.147 1.00 0.00 H new ATOM 62 N ALA A 5 -3.913 27.620 -2.138 1.00 0.00 N ATOM 63 CA ALA A 5 -3.691 27.308 -0.729 1.00 0.00 C ATOM 64 C ALA A 5 -4.914 26.642 -0.103 1.00 0.00 C ATOM 65 O ALA A 5 -5.098 26.682 1.113 1.00 0.00 O ATOM 66 CB ALA A 5 -3.334 28.572 0.035 1.00 0.00 C ATOM 0 H ALA A 5 -3.203 27.249 -2.769 1.00 0.00 H new ATOM 0 HA ALA A 5 -2.861 26.604 -0.669 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -3.170 28.329 1.085 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -2.425 29.005 -0.383 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -4.150 29.290 -0.048 1.00 0.00 H new ATOM 72 N LEU A 6 -5.746 26.026 -0.939 1.00 0.00 N ATOM 73 CA LEU A 6 -6.947 25.350 -0.459 1.00 0.00 C ATOM 74 C LEU A 6 -6.594 24.308 0.599 1.00 0.00 C ATOM 75 O LEU A 6 -7.379 24.037 1.507 1.00 0.00 O ATOM 76 CB LEU A 6 -7.683 24.682 -1.623 1.00 0.00 C ATOM 77 CG LEU A 6 -8.314 25.648 -2.627 1.00 0.00 C ATOM 78 CD1 LEU A 6 -8.267 25.065 -4.032 1.00 0.00 C ATOM 79 CD2 LEU A 6 -9.748 25.967 -2.229 1.00 0.00 C ATOM 0 H LEU A 6 -5.611 25.981 -1.949 1.00 0.00 H new ATOM 0 HA LEU A 6 -7.600 26.097 -0.008 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -6.983 24.036 -2.153 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -8.465 24.040 -1.218 1.00 0.00 H new ATOM 0 HG LEU A 6 -7.740 26.575 -2.621 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -8.720 25.766 -4.732 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -7.230 24.886 -4.317 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -8.817 24.124 -4.054 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -10.182 26.656 -2.954 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -10.333 25.047 -2.207 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -9.758 26.427 -1.241 1.00 0.00 H new ATOM 91 N ARG A 7 -5.403 23.733 0.472 1.00 0.00 N ATOM 92 CA ARG A 7 -4.932 22.724 1.414 1.00 0.00 C ATOM 93 C ARG A 7 -3.428 22.513 1.260 1.00 0.00 C ATOM 94 O ARG A 7 -2.637 23.055 2.030 1.00 0.00 O ATOM 95 CB ARG A 7 -5.680 21.397 1.222 1.00 0.00 C ATOM 96 CG ARG A 7 -6.171 21.148 -0.199 1.00 0.00 C ATOM 97 CD ARG A 7 -7.529 20.465 -0.206 1.00 0.00 C ATOM 98 NE ARG A 7 -8.620 21.415 0.003 1.00 0.00 N ATOM 99 CZ ARG A 7 -9.841 21.065 0.400 1.00 0.00 C ATOM 100 NH1 ARG A 7 -10.134 19.792 0.630 1.00 0.00 N ATOM 101 NH2 ARG A 7 -10.774 21.993 0.567 1.00 0.00 N ATOM 0 H ARG A 7 -4.744 23.949 -0.276 1.00 0.00 H new ATOM 0 HA ARG A 7 -5.135 23.084 2.423 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -5.022 20.578 1.514 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -6.535 21.376 1.897 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -6.236 22.095 -0.734 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -5.449 20.530 -0.732 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -7.672 19.952 -1.157 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -7.556 19.704 0.574 1.00 0.00 H new ATOM 0 HE ARG A 7 -8.435 22.404 -0.165 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -9.421 19.074 0.503 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -11.072 19.531 0.934 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -10.555 22.974 0.391 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -11.710 21.726 0.871 1.00 0.00 H new ATOM 115 N VAL A 8 -3.041 21.729 0.257 1.00 0.00 N ATOM 116 CA VAL A 8 -1.632 21.454 -0.002 1.00 0.00 C ATOM 117 C VAL A 8 -0.994 20.689 1.157 1.00 0.00 C ATOM 118 O VAL A 8 -0.721 19.494 1.046 1.00 0.00 O ATOM 119 CB VAL A 8 -0.846 22.757 -0.253 1.00 0.00 C ATOM 120 CG1 VAL A 8 0.618 22.457 -0.544 1.00 0.00 C ATOM 121 CG2 VAL A 8 -1.470 23.540 -1.398 1.00 0.00 C ATOM 0 H VAL A 8 -3.685 21.273 -0.390 1.00 0.00 H new ATOM 0 HA VAL A 8 -1.587 20.836 -0.899 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.894 23.366 0.650 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.153 23.391 -0.718 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.059 21.939 0.307 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.691 21.826 -1.430 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.904 24.457 -1.563 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -1.453 22.935 -2.304 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -2.501 23.790 -1.148 1.00 0.00 H new ATOM 131 N GLU A 9 -0.757 21.383 2.266 1.00 0.00 N ATOM 132 CA GLU A 9 -0.151 20.765 3.441 1.00 0.00 C ATOM 133 C GLU A 9 -0.956 19.553 3.899 1.00 0.00 C ATOM 134 O GLU A 9 -0.403 18.599 4.446 1.00 0.00 O ATOM 135 CB GLU A 9 -0.044 21.781 4.579 1.00 0.00 C ATOM 136 CG GLU A 9 -1.382 22.370 4.997 1.00 0.00 C ATOM 137 CD GLU A 9 -1.580 23.786 4.491 1.00 0.00 C ATOM 138 OE1 GLU A 9 -0.572 24.506 4.331 1.00 0.00 O ATOM 139 OE2 GLU A 9 -2.744 24.174 4.254 1.00 0.00 O ATOM 0 H GLU A 9 -0.975 22.373 2.376 1.00 0.00 H new ATOM 0 HA GLU A 9 0.849 20.429 3.167 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.417 21.300 5.442 1.00 0.00 H new ATOM 0 HB3 GLU A 9 0.619 22.590 4.272 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -2.186 21.738 4.621 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -1.454 22.363 6.085 1.00 0.00 H new ATOM 146 N GLU A 10 -2.265 19.598 3.671 1.00 0.00 N ATOM 147 CA GLU A 10 -3.144 18.501 4.061 1.00 0.00 C ATOM 148 C GLU A 10 -2.934 17.291 3.155 1.00 0.00 C ATOM 149 O GLU A 10 -2.569 16.211 3.620 1.00 0.00 O ATOM 150 CB GLU A 10 -4.607 18.951 4.006 1.00 0.00 C ATOM 151 CG GLU A 10 -5.367 18.703 5.298 1.00 0.00 C ATOM 152 CD GLU A 10 -5.572 17.228 5.580 1.00 0.00 C ATOM 153 OE1 GLU A 10 -5.473 16.422 4.631 1.00 0.00 O ATOM 154 OE2 GLU A 10 -5.834 16.878 6.751 1.00 0.00 O ATOM 0 H GLU A 10 -2.739 20.380 3.219 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.899 18.213 5.083 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.643 20.015 3.771 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -5.109 18.428 3.192 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.824 19.156 6.127 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -6.337 19.197 5.245 1.00 0.00 H new ATOM 161 N VAL A 11 -3.163 17.481 1.859 1.00 0.00 N ATOM 162 CA VAL A 11 -2.996 16.407 0.890 1.00 0.00 C ATOM 163 C VAL A 11 -1.566 15.879 0.897 1.00 0.00 C ATOM 164 O VAL A 11 -1.338 14.674 0.790 1.00 0.00 O ATOM 165 CB VAL A 11 -3.350 16.876 -0.535 1.00 0.00 C ATOM 166 CG1 VAL A 11 -3.346 15.700 -1.501 1.00 0.00 C ATOM 167 CG2 VAL A 11 -4.700 17.578 -0.546 1.00 0.00 C ATOM 0 H VAL A 11 -3.465 18.369 1.457 1.00 0.00 H new ATOM 0 HA VAL A 11 -3.678 15.608 1.182 1.00 0.00 H new ATOM 0 HB VAL A 11 -2.592 17.588 -0.862 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -3.598 16.050 -2.502 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -2.356 15.244 -1.515 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -4.081 14.962 -1.179 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -4.933 17.902 -1.560 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -5.471 16.890 -0.199 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -4.664 18.446 0.113 1.00 0.00 H new ATOM 177 N GLN A 12 -0.605 16.790 1.027 1.00 0.00 N ATOM 178 CA GLN A 12 0.806 16.417 1.050 1.00 0.00 C ATOM 179 C GLN A 12 1.076 15.366 2.121 1.00 0.00 C ATOM 180 O GLN A 12 1.741 14.361 1.866 1.00 0.00 O ATOM 181 CB GLN A 12 1.676 17.650 1.298 1.00 0.00 C ATOM 182 CG GLN A 12 3.161 17.399 1.091 1.00 0.00 C ATOM 183 CD GLN A 12 3.504 17.099 -0.355 1.00 0.00 C ATOM 184 OE1 GLN A 12 3.760 18.006 -1.147 1.00 0.00 O ATOM 185 NE2 GLN A 12 3.509 15.819 -0.708 1.00 0.00 N ATOM 0 H GLN A 12 -0.778 17.791 1.118 1.00 0.00 H new ATOM 0 HA GLN A 12 1.058 15.991 0.079 1.00 0.00 H new ATOM 0 HB2 GLN A 12 1.355 18.451 0.632 1.00 0.00 H new ATOM 0 HB3 GLN A 12 1.514 18.000 2.318 1.00 0.00 H new ATOM 0 HG2 GLN A 12 3.723 18.273 1.420 1.00 0.00 H new ATOM 0 HG3 GLN A 12 3.475 16.563 1.716 1.00 0.00 H new ATOM 0 HE21 GLN A 12 3.291 15.099 -0.019 1.00 0.00 H new ATOM 0 HE22 GLN A 12 3.731 15.556 -1.668 1.00 0.00 H new ATOM 194 N ASN A 13 0.554 15.601 3.320 1.00 0.00 N ATOM 195 CA ASN A 13 0.737 14.673 4.429 1.00 0.00 C ATOM 196 C ASN A 13 0.144 13.309 4.094 1.00 0.00 C ATOM 197 O ASN A 13 0.639 12.276 4.546 1.00 0.00 O ATOM 198 CB ASN A 13 0.090 15.227 5.699 1.00 0.00 C ATOM 199 CG ASN A 13 0.888 14.899 6.945 1.00 0.00 C ATOM 200 OD1 ASN A 13 1.433 13.804 7.077 1.00 0.00 O ATOM 201 ND2 ASN A 13 0.959 15.849 7.870 1.00 0.00 N ATOM 0 H ASN A 13 0.001 16.427 3.548 1.00 0.00 H new ATOM 0 HA ASN A 13 1.807 14.554 4.600 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -0.011 16.309 5.610 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.916 14.820 5.798 1.00 0.00 H new ATOM 0 HD21 ASN A 13 1.481 15.685 8.731 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.492 16.743 7.720 1.00 0.00 H new ATOM 208 N VAL A 14 -0.922 13.313 3.299 1.00 0.00 N ATOM 209 CA VAL A 14 -1.583 12.077 2.902 1.00 0.00 C ATOM 210 C VAL A 14 -0.697 11.253 1.974 1.00 0.00 C ATOM 211 O VAL A 14 -0.592 10.035 2.120 1.00 0.00 O ATOM 212 CB VAL A 14 -2.925 12.358 2.198 1.00 0.00 C ATOM 213 CG1 VAL A 14 -3.678 11.063 1.940 1.00 0.00 C ATOM 214 CG2 VAL A 14 -3.769 13.319 3.022 1.00 0.00 C ATOM 0 H VAL A 14 -1.345 14.159 2.918 1.00 0.00 H new ATOM 0 HA VAL A 14 -1.772 11.512 3.815 1.00 0.00 H new ATOM 0 HB VAL A 14 -2.717 12.826 1.236 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -4.622 11.284 1.442 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -3.077 10.413 1.305 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -3.876 10.562 2.888 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -4.713 13.506 2.509 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -3.968 12.882 4.000 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.232 14.259 3.147 1.00 0.00 H new ATOM 224 N ILE A 15 -0.062 11.924 1.018 1.00 0.00 N ATOM 225 CA ILE A 15 0.816 11.250 0.067 1.00 0.00 C ATOM 226 C ILE A 15 1.947 10.523 0.785 1.00 0.00 C ATOM 227 O ILE A 15 2.268 9.379 0.459 1.00 0.00 O ATOM 228 CB ILE A 15 1.420 12.242 -0.946 1.00 0.00 C ATOM 229 CG1 ILE A 15 0.328 13.125 -1.556 1.00 0.00 C ATOM 230 CG2 ILE A 15 2.169 11.493 -2.037 1.00 0.00 C ATOM 231 CD1 ILE A 15 -0.833 12.345 -2.137 1.00 0.00 C ATOM 0 H ILE A 15 -0.139 12.932 0.881 1.00 0.00 H new ATOM 0 HA ILE A 15 0.203 10.526 -0.469 1.00 0.00 H new ATOM 0 HB ILE A 15 2.124 12.885 -0.419 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -0.049 13.803 -0.790 1.00 0.00 H new ATOM 0 HG13 ILE A 15 0.768 13.742 -2.340 1.00 0.00 H new ATOM 0 HG21 ILE A 15 2.590 12.207 -2.745 1.00 0.00 H new ATOM 0 HG22 ILE A 15 2.973 10.908 -1.590 1.00 0.00 H new ATOM 0 HG23 ILE A 15 1.482 10.827 -2.559 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.566 13.038 -2.550 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -0.470 11.687 -2.926 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.299 11.749 -1.353 1.00 0.00 H new ATOM 243 N ASN A 16 2.548 11.192 1.763 1.00 0.00 N ATOM 244 CA ASN A 16 3.644 10.609 2.528 1.00 0.00 C ATOM 245 C ASN A 16 3.146 9.465 3.405 1.00 0.00 C ATOM 246 O ASN A 16 3.763 8.401 3.466 1.00 0.00 O ATOM 247 CB ASN A 16 4.314 11.677 3.394 1.00 0.00 C ATOM 248 CG ASN A 16 5.775 11.370 3.662 1.00 0.00 C ATOM 249 OD1 ASN A 16 6.314 10.380 3.169 1.00 0.00 O ATOM 250 ND2 ASN A 16 6.424 12.223 4.446 1.00 0.00 N ATOM 0 H ASN A 16 2.294 12.139 2.045 1.00 0.00 H new ATOM 0 HA ASN A 16 4.375 10.212 1.824 1.00 0.00 H new ATOM 0 HB2 ASN A 16 4.234 12.645 2.900 1.00 0.00 H new ATOM 0 HB3 ASN A 16 3.783 11.758 4.342 1.00 0.00 H new ATOM 0 HD21 ASN A 16 7.409 12.070 4.661 1.00 0.00 H new ATOM 0 HD22 ASN A 16 5.937 13.031 4.833 1.00 0.00 H new ATOM 257 N ALA A 17 2.025 9.691 4.083 1.00 0.00 N ATOM 258 CA ALA A 17 1.444 8.679 4.957 1.00 0.00 C ATOM 259 C ALA A 17 1.124 7.405 4.182 1.00 0.00 C ATOM 260 O ALA A 17 1.216 6.301 4.720 1.00 0.00 O ATOM 261 CB ALA A 17 0.190 9.222 5.630 1.00 0.00 C ATOM 0 H ALA A 17 1.501 10.566 4.044 1.00 0.00 H new ATOM 0 HA ALA A 17 2.176 8.431 5.725 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -0.234 8.457 6.280 1.00 0.00 H new ATOM 0 HB2 ALA A 17 0.446 10.100 6.223 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.541 9.498 4.870 1.00 0.00 H new ATOM 267 N MET A 18 0.749 7.565 2.918 1.00 0.00 N ATOM 268 CA MET A 18 0.416 6.427 2.068 1.00 0.00 C ATOM 269 C MET A 18 1.669 5.638 1.704 1.00 0.00 C ATOM 270 O MET A 18 1.617 4.422 1.519 1.00 0.00 O ATOM 271 CB MET A 18 -0.290 6.901 0.797 1.00 0.00 C ATOM 272 CG MET A 18 -1.198 5.851 0.180 1.00 0.00 C ATOM 273 SD MET A 18 -2.241 6.518 -1.130 1.00 0.00 S ATOM 274 CE MET A 18 -3.165 7.758 -0.227 1.00 0.00 C ATOM 0 H MET A 18 0.668 8.472 2.459 1.00 0.00 H new ATOM 0 HA MET A 18 -0.256 5.773 2.624 1.00 0.00 H new ATOM 0 HB2 MET A 18 -0.879 7.789 1.028 1.00 0.00 H new ATOM 0 HB3 MET A 18 0.460 7.198 0.064 1.00 0.00 H new ATOM 0 HG2 MET A 18 -0.589 5.041 -0.222 1.00 0.00 H new ATOM 0 HG3 MET A 18 -1.829 5.420 0.957 1.00 0.00 H new ATOM 0 HE1 MET A 18 -4.174 7.828 -0.633 1.00 0.00 H new ATOM 0 HE2 MET A 18 -3.216 7.479 0.825 1.00 0.00 H new ATOM 0 HE3 MET A 18 -2.668 8.723 -0.323 1.00 0.00 H new ATOM 284 N GLN A 19 2.794 6.337 1.603 1.00 0.00 N ATOM 285 CA GLN A 19 4.061 5.700 1.262 1.00 0.00 C ATOM 286 C GLN A 19 4.529 4.783 2.386 1.00 0.00 C ATOM 287 O GLN A 19 5.222 3.793 2.145 1.00 0.00 O ATOM 288 CB GLN A 19 5.126 6.761 0.975 1.00 0.00 C ATOM 289 CG GLN A 19 6.243 6.270 0.066 1.00 0.00 C ATOM 290 CD GLN A 19 7.613 6.725 0.529 1.00 0.00 C ATOM 291 OE1 GLN A 19 7.911 6.720 1.723 1.00 0.00 O ATOM 292 NE2 GLN A 19 8.455 7.123 -0.418 1.00 0.00 N ATOM 0 H GLN A 19 2.855 7.344 1.752 1.00 0.00 H new ATOM 0 HA GLN A 19 3.908 5.097 0.367 1.00 0.00 H new ATOM 0 HB2 GLN A 19 4.650 7.628 0.516 1.00 0.00 H new ATOM 0 HB3 GLN A 19 5.557 7.096 1.918 1.00 0.00 H new ATOM 0 HG2 GLN A 19 6.221 5.181 0.024 1.00 0.00 H new ATOM 0 HG3 GLN A 19 6.067 6.631 -0.947 1.00 0.00 H new ATOM 0 HE21 GLN A 19 8.165 7.110 -1.396 1.00 0.00 H new ATOM 0 HE22 GLN A 19 9.391 7.441 -0.167 1.00 0.00 H new ATOM 301 N LYS A 20 4.147 5.116 3.616 1.00 0.00 N ATOM 302 CA LYS A 20 4.529 4.320 4.778 1.00 0.00 C ATOM 303 C LYS A 20 4.071 2.872 4.625 1.00 0.00 C ATOM 304 O LYS A 20 4.739 1.948 5.087 1.00 0.00 O ATOM 305 CB LYS A 20 3.934 4.925 6.052 1.00 0.00 C ATOM 306 CG LYS A 20 4.920 5.000 7.206 1.00 0.00 C ATOM 307 CD LYS A 20 5.106 3.644 7.867 1.00 0.00 C ATOM 308 CE LYS A 20 6.127 3.708 8.992 1.00 0.00 C ATOM 309 NZ LYS A 20 5.599 4.432 10.181 1.00 0.00 N ATOM 0 H LYS A 20 3.574 5.931 3.833 1.00 0.00 H new ATOM 0 HA LYS A 20 5.616 4.329 4.851 1.00 0.00 H new ATOM 0 HB2 LYS A 20 3.568 5.928 5.832 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.073 4.331 6.359 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.881 5.364 6.842 1.00 0.00 H new ATOM 0 HG3 LYS A 20 4.565 5.720 7.943 1.00 0.00 H new ATOM 0 HD2 LYS A 20 4.151 3.296 8.260 1.00 0.00 H new ATOM 0 HD3 LYS A 20 5.429 2.916 7.122 1.00 0.00 H new ATOM 0 HE2 LYS A 20 6.413 2.697 9.280 1.00 0.00 H new ATOM 0 HE3 LYS A 20 7.029 4.205 8.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 6.319 4.439 10.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 5.365 5.410 9.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 4.743 3.953 10.527 1.00 0.00 H new ATOM 323 N ILE A 21 2.928 2.684 3.973 1.00 0.00 N ATOM 324 CA ILE A 21 2.383 1.348 3.758 1.00 0.00 C ATOM 325 C ILE A 21 3.229 0.562 2.757 1.00 0.00 C ATOM 326 O ILE A 21 3.194 -0.668 2.734 1.00 0.00 O ATOM 327 CB ILE A 21 0.922 1.410 3.262 1.00 0.00 C ATOM 328 CG1 ILE A 21 0.048 2.141 4.282 1.00 0.00 C ATOM 329 CG2 ILE A 21 0.380 0.010 3.009 1.00 0.00 C ATOM 330 CD1 ILE A 21 -0.006 3.637 4.070 1.00 0.00 C ATOM 0 H ILE A 21 2.362 3.439 3.585 1.00 0.00 H new ATOM 0 HA ILE A 21 2.405 0.836 4.720 1.00 0.00 H new ATOM 0 HB ILE A 21 0.901 1.961 2.322 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -0.964 1.739 4.235 1.00 0.00 H new ATOM 0 HG13 ILE A 21 0.426 1.938 5.284 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -0.651 0.076 2.660 1.00 0.00 H new ATOM 0 HG22 ILE A 21 0.988 -0.484 2.252 1.00 0.00 H new ATOM 0 HG23 ILE A 21 0.414 -0.566 3.934 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -0.644 4.089 4.830 1.00 0.00 H new ATOM 0 HD12 ILE A 21 0.999 4.052 4.146 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -0.412 3.850 3.081 1.00 0.00 H new ATOM 342 N LEU A 22 3.991 1.278 1.934 1.00 0.00 N ATOM 343 CA LEU A 22 4.845 0.642 0.938 1.00 0.00 C ATOM 344 C LEU A 22 6.312 0.966 1.200 1.00 0.00 C ATOM 345 O LEU A 22 7.077 1.227 0.271 1.00 0.00 O ATOM 346 CB LEU A 22 4.454 1.096 -0.472 1.00 0.00 C ATOM 347 CG LEU A 22 3.250 0.376 -1.085 1.00 0.00 C ATOM 348 CD1 LEU A 22 3.375 -1.131 -0.912 1.00 0.00 C ATOM 349 CD2 LEU A 22 1.957 0.881 -0.464 1.00 0.00 C ATOM 0 H LEU A 22 4.034 2.297 1.938 1.00 0.00 H new ATOM 0 HA LEU A 22 4.707 -0.437 1.013 1.00 0.00 H new ATOM 0 HB2 LEU A 22 4.241 2.165 -0.445 1.00 0.00 H new ATOM 0 HB3 LEU A 22 5.312 0.958 -1.130 1.00 0.00 H new ATOM 0 HG LEU A 22 3.229 0.593 -2.153 1.00 0.00 H new ATOM 0 HD11 LEU A 22 2.508 -1.621 -1.355 1.00 0.00 H new ATOM 0 HD12 LEU A 22 4.282 -1.480 -1.406 1.00 0.00 H new ATOM 0 HD13 LEU A 22 3.425 -1.372 0.150 1.00 0.00 H new ATOM 0 HD21 LEU A 22 1.111 0.359 -0.911 1.00 0.00 H new ATOM 0 HD22 LEU A 22 1.972 0.695 0.610 1.00 0.00 H new ATOM 0 HD23 LEU A 22 1.860 1.951 -0.645 1.00 0.00 H new ATOM 361 N GLU A 23 6.699 0.948 2.471 1.00 0.00 N ATOM 362 CA GLU A 23 8.074 1.241 2.853 1.00 0.00 C ATOM 363 C GLU A 23 8.827 -0.034 3.216 1.00 0.00 C ATOM 364 O GLU A 23 8.301 -1.140 3.084 1.00 0.00 O ATOM 365 CB GLU A 23 8.103 2.218 4.031 1.00 0.00 C ATOM 366 CG GLU A 23 9.207 3.257 3.931 1.00 0.00 C ATOM 367 CD GLU A 23 8.823 4.577 4.572 1.00 0.00 C ATOM 368 OE1 GLU A 23 8.667 4.614 5.810 1.00 0.00 O ATOM 369 OE2 GLU A 23 8.680 5.576 3.834 1.00 0.00 O ATOM 0 H GLU A 23 6.080 0.734 3.253 1.00 0.00 H new ATOM 0 HA GLU A 23 8.569 1.699 1.997 1.00 0.00 H new ATOM 0 HB2 GLU A 23 7.141 2.727 4.094 1.00 0.00 H new ATOM 0 HB3 GLU A 23 8.227 1.655 4.956 1.00 0.00 H new ATOM 0 HG2 GLU A 23 10.107 2.873 4.410 1.00 0.00 H new ATOM 0 HG3 GLU A 23 9.451 3.424 2.882 1.00 0.00 H new ATOM 376 N CYS A 24 10.066 0.130 3.667 1.00 0.00 N ATOM 377 CA CYS A 24 10.905 -1.000 4.046 1.00 0.00 C ATOM 378 C CYS A 24 11.089 -1.050 5.564 1.00 0.00 C ATOM 379 O CYS A 24 11.226 -0.012 6.212 1.00 0.00 O ATOM 380 CB CYS A 24 12.254 -0.882 3.349 1.00 0.00 C ATOM 381 SG CYS A 24 13.218 -2.408 3.312 1.00 0.00 S ATOM 0 H CYS A 24 10.513 1.040 3.779 1.00 0.00 H new ATOM 0 HA CYS A 24 10.419 -1.925 3.736 1.00 0.00 H new ATOM 0 HB2 CYS A 24 12.091 -0.546 2.325 1.00 0.00 H new ATOM 0 HB3 CYS A 24 12.840 -0.110 3.848 1.00 0.00 H new ATOM 386 N PRO A 25 11.064 -2.257 6.160 1.00 0.00 N ATOM 387 CA PRO A 25 11.194 -2.431 7.603 1.00 0.00 C ATOM 388 C PRO A 25 12.624 -2.679 8.090 1.00 0.00 C ATOM 389 O PRO A 25 12.870 -2.674 9.296 1.00 0.00 O ATOM 390 CB PRO A 25 10.339 -3.669 7.842 1.00 0.00 C ATOM 391 CG PRO A 25 10.533 -4.502 6.615 1.00 0.00 C ATOM 392 CD PRO A 25 10.863 -3.552 5.484 1.00 0.00 C ATOM 0 HA PRO A 25 10.896 -1.532 8.143 1.00 0.00 H new ATOM 0 HB2 PRO A 25 10.656 -4.203 8.738 1.00 0.00 H new ATOM 0 HB3 PRO A 25 9.290 -3.406 7.981 1.00 0.00 H new ATOM 0 HG2 PRO A 25 11.338 -5.222 6.761 1.00 0.00 H new ATOM 0 HG3 PRO A 25 9.632 -5.072 6.389 1.00 0.00 H new ATOM 0 HD2 PRO A 25 11.758 -3.866 4.946 1.00 0.00 H new ATOM 0 HD3 PRO A 25 10.054 -3.502 4.755 1.00 0.00 H new ATOM 400 N ILE A 26 13.566 -2.912 7.176 1.00 0.00 N ATOM 401 CA ILE A 26 14.947 -3.176 7.588 1.00 0.00 C ATOM 402 C ILE A 26 15.963 -2.308 6.846 1.00 0.00 C ATOM 403 O ILE A 26 16.999 -1.943 7.404 1.00 0.00 O ATOM 404 CB ILE A 26 15.319 -4.662 7.403 1.00 0.00 C ATOM 405 CG1 ILE A 26 15.211 -5.073 5.935 1.00 0.00 C ATOM 406 CG2 ILE A 26 14.429 -5.542 8.267 1.00 0.00 C ATOM 407 CD1 ILE A 26 16.303 -6.022 5.493 1.00 0.00 C ATOM 0 H ILE A 26 13.406 -2.924 6.169 1.00 0.00 H new ATOM 0 HA ILE A 26 14.991 -2.919 8.646 1.00 0.00 H new ATOM 0 HB ILE A 26 16.354 -4.795 7.718 1.00 0.00 H new ATOM 0 HG12 ILE A 26 14.242 -5.543 5.768 1.00 0.00 H new ATOM 0 HG13 ILE A 26 15.243 -4.179 5.312 1.00 0.00 H new ATOM 0 HG21 ILE A 26 14.704 -6.587 8.126 1.00 0.00 H new ATOM 0 HG22 ILE A 26 14.557 -5.272 9.315 1.00 0.00 H new ATOM 0 HG23 ILE A 26 13.387 -5.399 7.980 1.00 0.00 H new ATOM 0 HD11 ILE A 26 16.164 -6.272 4.441 1.00 0.00 H new ATOM 0 HD12 ILE A 26 17.275 -5.547 5.628 1.00 0.00 H new ATOM 0 HD13 ILE A 26 16.258 -6.932 6.091 1.00 0.00 H new ATOM 419 N CYS A 27 15.675 -1.987 5.594 1.00 0.00 N ATOM 420 CA CYS A 27 16.577 -1.169 4.787 1.00 0.00 C ATOM 421 C CYS A 27 16.036 0.248 4.614 1.00 0.00 C ATOM 422 O CYS A 27 16.764 1.150 4.198 1.00 0.00 O ATOM 423 CB CYS A 27 16.790 -1.809 3.414 1.00 0.00 C ATOM 424 SG CYS A 27 17.092 -3.590 3.464 1.00 0.00 S ATOM 0 H CYS A 27 14.825 -2.279 5.112 1.00 0.00 H new ATOM 0 HA CYS A 27 17.531 -1.112 5.312 1.00 0.00 H new ATOM 0 HB2 CYS A 27 15.912 -1.618 2.797 1.00 0.00 H new ATOM 0 HB3 CYS A 27 17.635 -1.322 2.926 1.00 0.00 H new ATOM 429 N LEU A 28 14.760 0.438 4.926 1.00 0.00 N ATOM 430 CA LEU A 28 14.131 1.746 4.794 1.00 0.00 C ATOM 431 C LEU A 28 14.175 2.222 3.343 1.00 0.00 C ATOM 432 O LEU A 28 14.161 3.424 3.076 1.00 0.00 O ATOM 433 CB LEU A 28 14.824 2.763 5.703 1.00 0.00 C ATOM 434 CG LEU A 28 14.100 3.054 7.019 1.00 0.00 C ATOM 435 CD1 LEU A 28 12.801 3.802 6.759 1.00 0.00 C ATOM 436 CD2 LEU A 28 13.830 1.761 7.775 1.00 0.00 C ATOM 0 H LEU A 28 14.141 -0.296 5.272 1.00 0.00 H new ATOM 0 HA LEU A 28 13.088 1.656 5.097 1.00 0.00 H new ATOM 0 HB2 LEU A 28 15.827 2.401 5.930 1.00 0.00 H new ATOM 0 HB3 LEU A 28 14.939 3.698 5.155 1.00 0.00 H new ATOM 0 HG LEU A 28 14.742 3.685 7.634 1.00 0.00 H new ATOM 0 HD11 LEU A 28 12.300 4.000 7.706 1.00 0.00 H new ATOM 0 HD12 LEU A 28 13.018 4.746 6.259 1.00 0.00 H new ATOM 0 HD13 LEU A 28 12.153 3.196 6.125 1.00 0.00 H new ATOM 0 HD21 LEU A 28 13.315 1.986 8.709 1.00 0.00 H new ATOM 0 HD22 LEU A 28 13.207 1.106 7.165 1.00 0.00 H new ATOM 0 HD23 LEU A 28 14.775 1.263 7.993 1.00 0.00 H new ATOM 448 N GLU A 29 14.230 1.274 2.409 1.00 0.00 N ATOM 449 CA GLU A 29 14.278 1.606 0.989 1.00 0.00 C ATOM 450 C GLU A 29 12.988 1.192 0.288 1.00 0.00 C ATOM 451 O GLU A 29 12.588 0.031 0.348 1.00 0.00 O ATOM 452 CB GLU A 29 15.475 0.924 0.324 1.00 0.00 C ATOM 453 CG GLU A 29 16.753 1.742 0.385 1.00 0.00 C ATOM 454 CD GLU A 29 17.549 1.679 -0.905 1.00 0.00 C ATOM 455 OE1 GLU A 29 17.879 0.557 -1.342 1.00 0.00 O ATOM 456 OE2 GLU A 29 17.841 2.750 -1.475 1.00 0.00 O ATOM 0 H GLU A 29 14.242 0.274 2.610 1.00 0.00 H new ATOM 0 HA GLU A 29 14.388 2.687 0.899 1.00 0.00 H new ATOM 0 HB2 GLU A 29 15.647 -0.039 0.805 1.00 0.00 H new ATOM 0 HB3 GLU A 29 15.233 0.721 -0.719 1.00 0.00 H new ATOM 0 HG2 GLU A 29 16.505 2.781 0.604 1.00 0.00 H new ATOM 0 HG3 GLU A 29 17.372 1.382 1.207 1.00 0.00 H new ATOM 463 N LEU A 30 12.345 2.153 -0.376 1.00 0.00 N ATOM 464 CA LEU A 30 11.094 1.901 -1.095 1.00 0.00 C ATOM 465 C LEU A 30 11.098 0.525 -1.761 1.00 0.00 C ATOM 466 O LEU A 30 11.722 0.329 -2.804 1.00 0.00 O ATOM 467 CB LEU A 30 10.862 2.985 -2.149 1.00 0.00 C ATOM 468 CG LEU A 30 9.416 3.127 -2.625 1.00 0.00 C ATOM 469 CD1 LEU A 30 8.504 3.482 -1.461 1.00 0.00 C ATOM 470 CD2 LEU A 30 9.317 4.178 -3.721 1.00 0.00 C ATOM 0 H LEU A 30 12.671 3.118 -0.431 1.00 0.00 H new ATOM 0 HA LEU A 30 10.284 1.923 -0.366 1.00 0.00 H new ATOM 0 HB2 LEU A 30 11.190 3.942 -1.742 1.00 0.00 H new ATOM 0 HB3 LEU A 30 11.493 2.772 -3.012 1.00 0.00 H new ATOM 0 HG LEU A 30 9.093 2.170 -3.035 1.00 0.00 H new ATOM 0 HD11 LEU A 30 7.479 3.579 -1.818 1.00 0.00 H new ATOM 0 HD12 LEU A 30 8.553 2.696 -0.708 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.826 4.426 -1.021 1.00 0.00 H new ATOM 0 HD21 LEU A 30 8.281 4.266 -4.048 1.00 0.00 H new ATOM 0 HD22 LEU A 30 9.659 5.139 -3.336 1.00 0.00 H new ATOM 0 HD23 LEU A 30 9.940 3.883 -4.565 1.00 0.00 H new ATOM 482 N ILE A 31 10.405 -0.425 -1.140 1.00 0.00 N ATOM 483 CA ILE A 31 10.331 -1.786 -1.658 1.00 0.00 C ATOM 484 C ILE A 31 9.896 -1.805 -3.122 1.00 0.00 C ATOM 485 O ILE A 31 8.972 -1.093 -3.517 1.00 0.00 O ATOM 486 CB ILE A 31 9.364 -2.652 -0.821 1.00 0.00 C ATOM 487 CG1 ILE A 31 7.919 -2.166 -0.977 1.00 0.00 C ATOM 488 CG2 ILE A 31 9.777 -2.634 0.646 1.00 0.00 C ATOM 489 CD1 ILE A 31 6.897 -3.096 -0.360 1.00 0.00 C ATOM 0 H ILE A 31 9.886 -0.276 -0.275 1.00 0.00 H new ATOM 0 HA ILE A 31 11.334 -2.206 -1.586 1.00 0.00 H new ATOM 0 HB ILE A 31 9.417 -3.677 -1.188 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.824 -1.181 -0.520 1.00 0.00 H new ATOM 0 HG13 ILE A 31 7.697 -2.048 -2.038 1.00 0.00 H new ATOM 0 HG21 ILE A 31 9.088 -3.248 1.226 1.00 0.00 H new ATOM 0 HG22 ILE A 31 10.787 -3.031 0.744 1.00 0.00 H new ATOM 0 HG23 ILE A 31 9.752 -1.610 1.019 1.00 0.00 H new ATOM 0 HD11 ILE A 31 5.897 -2.688 -0.509 1.00 0.00 H new ATOM 0 HD12 ILE A 31 6.964 -4.075 -0.834 1.00 0.00 H new ATOM 0 HD13 ILE A 31 7.093 -3.195 0.708 1.00 0.00 H new ATOM 501 N LYS A 32 10.571 -2.626 -3.921 1.00 0.00 N ATOM 502 CA LYS A 32 10.258 -2.743 -5.340 1.00 0.00 C ATOM 503 C LYS A 32 9.677 -4.117 -5.650 1.00 0.00 C ATOM 504 O LYS A 32 8.777 -4.251 -6.479 1.00 0.00 O ATOM 505 CB LYS A 32 11.512 -2.504 -6.182 1.00 0.00 C ATOM 506 CG LYS A 32 12.086 -1.104 -6.038 1.00 0.00 C ATOM 507 CD LYS A 32 11.562 -0.173 -7.118 1.00 0.00 C ATOM 508 CE LYS A 32 10.167 0.335 -6.787 1.00 0.00 C ATOM 509 NZ LYS A 32 10.082 0.860 -5.395 1.00 0.00 N ATOM 0 H LYS A 32 11.339 -3.220 -3.609 1.00 0.00 H new ATOM 0 HA LYS A 32 9.514 -1.986 -5.590 1.00 0.00 H new ATOM 0 HB2 LYS A 32 12.273 -3.230 -5.898 1.00 0.00 H new ATOM 0 HB3 LYS A 32 11.275 -2.684 -7.231 1.00 0.00 H new ATOM 0 HG2 LYS A 32 11.831 -0.704 -5.057 1.00 0.00 H new ATOM 0 HG3 LYS A 32 13.174 -1.149 -6.091 1.00 0.00 H new ATOM 0 HD2 LYS A 32 12.241 0.672 -7.232 1.00 0.00 H new ATOM 0 HD3 LYS A 32 11.542 -0.697 -8.074 1.00 0.00 H new ATOM 0 HE2 LYS A 32 9.891 1.122 -7.489 1.00 0.00 H new ATOM 0 HE3 LYS A 32 9.447 -0.473 -6.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 9.404 1.648 -5.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 9.764 0.103 -4.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 11.019 1.197 -5.093 1.00 0.00 H new ATOM 523 N GLU A 33 10.195 -5.136 -4.972 1.00 0.00 N ATOM 524 CA GLU A 33 9.728 -6.504 -5.166 1.00 0.00 C ATOM 525 C GLU A 33 9.059 -7.027 -3.898 1.00 0.00 C ATOM 526 O GLU A 33 9.680 -7.736 -3.106 1.00 0.00 O ATOM 527 CB GLU A 33 10.894 -7.414 -5.556 1.00 0.00 C ATOM 528 CG GLU A 33 11.390 -7.193 -6.975 1.00 0.00 C ATOM 529 CD GLU A 33 12.452 -6.114 -7.061 1.00 0.00 C ATOM 530 OE1 GLU A 33 13.481 -6.238 -6.363 1.00 0.00 O ATOM 531 OE2 GLU A 33 12.255 -5.146 -7.824 1.00 0.00 O ATOM 0 H GLU A 33 10.940 -5.040 -4.282 1.00 0.00 H new ATOM 0 HA GLU A 33 8.995 -6.504 -5.973 1.00 0.00 H new ATOM 0 HB2 GLU A 33 11.719 -7.251 -4.862 1.00 0.00 H new ATOM 0 HB3 GLU A 33 10.585 -8.454 -5.446 1.00 0.00 H new ATOM 0 HG2 GLU A 33 11.795 -8.127 -7.364 1.00 0.00 H new ATOM 0 HG3 GLU A 33 10.548 -6.921 -7.612 1.00 0.00 H new ATOM 538 N PRO A 34 7.778 -6.678 -3.687 1.00 0.00 N ATOM 539 CA PRO A 34 7.025 -7.110 -2.506 1.00 0.00 C ATOM 540 C PRO A 34 7.143 -8.609 -2.255 1.00 0.00 C ATOM 541 O PRO A 34 7.136 -9.409 -3.191 1.00 0.00 O ATOM 542 CB PRO A 34 5.583 -6.739 -2.851 1.00 0.00 C ATOM 543 CG PRO A 34 5.704 -5.593 -3.795 1.00 0.00 C ATOM 544 CD PRO A 34 6.965 -5.831 -4.581 1.00 0.00 C ATOM 0 HA PRO A 34 7.396 -6.641 -1.594 1.00 0.00 H new ATOM 0 HB2 PRO A 34 5.057 -7.576 -3.310 1.00 0.00 H new ATOM 0 HB3 PRO A 34 5.021 -6.460 -1.959 1.00 0.00 H new ATOM 0 HG2 PRO A 34 4.838 -5.538 -4.455 1.00 0.00 H new ATOM 0 HG3 PRO A 34 5.754 -4.647 -3.255 1.00 0.00 H new ATOM 0 HD2 PRO A 34 6.759 -6.330 -5.528 1.00 0.00 H new ATOM 0 HD3 PRO A 34 7.472 -4.896 -4.818 1.00 0.00 H new ATOM 552 N VAL A 35 7.251 -8.981 -0.984 1.00 0.00 N ATOM 553 CA VAL A 35 7.368 -10.384 -0.604 1.00 0.00 C ATOM 554 C VAL A 35 6.747 -10.631 0.766 1.00 0.00 C ATOM 555 O VAL A 35 7.081 -9.957 1.741 1.00 0.00 O ATOM 556 CB VAL A 35 8.842 -10.840 -0.588 1.00 0.00 C ATOM 557 CG1 VAL A 35 9.639 -10.040 0.431 1.00 0.00 C ATOM 558 CG2 VAL A 35 8.939 -12.331 -0.302 1.00 0.00 C ATOM 0 H VAL A 35 7.260 -8.330 -0.199 1.00 0.00 H new ATOM 0 HA VAL A 35 6.829 -10.966 -1.352 1.00 0.00 H new ATOM 0 HB VAL A 35 9.269 -10.656 -1.574 1.00 0.00 H new ATOM 0 HG11 VAL A 35 10.676 -10.376 0.427 1.00 0.00 H new ATOM 0 HG12 VAL A 35 9.600 -8.982 0.174 1.00 0.00 H new ATOM 0 HG13 VAL A 35 9.213 -10.188 1.423 1.00 0.00 H new ATOM 0 HG21 VAL A 35 9.986 -12.633 -0.295 1.00 0.00 H new ATOM 0 HG22 VAL A 35 8.493 -12.545 0.669 1.00 0.00 H new ATOM 0 HG23 VAL A 35 8.407 -12.885 -1.075 1.00 0.00 H new ATOM 568 N SER A 36 5.839 -11.598 0.833 1.00 0.00 N ATOM 569 CA SER A 36 5.169 -11.931 2.084 1.00 0.00 C ATOM 570 C SER A 36 5.886 -13.066 2.809 1.00 0.00 C ATOM 571 O SER A 36 5.964 -14.186 2.304 1.00 0.00 O ATOM 572 CB SER A 36 3.713 -12.321 1.818 1.00 0.00 C ATOM 573 OG SER A 36 3.618 -13.667 1.384 1.00 0.00 O ATOM 0 H SER A 36 5.550 -12.165 0.036 1.00 0.00 H new ATOM 0 HA SER A 36 5.194 -11.048 2.722 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.125 -12.186 2.726 1.00 0.00 H new ATOM 0 HB3 SER A 36 3.288 -11.661 1.062 1.00 0.00 H new ATOM 0 HG SER A 36 4.517 -14.049 1.305 1.00 0.00 H new ATOM 579 N THR A 37 6.404 -12.771 3.998 1.00 0.00 N ATOM 580 CA THR A 37 7.110 -13.771 4.792 1.00 0.00 C ATOM 581 C THR A 37 6.118 -14.675 5.517 1.00 0.00 C ATOM 582 O THR A 37 4.943 -14.336 5.651 1.00 0.00 O ATOM 583 CB THR A 37 8.041 -13.099 5.804 1.00 0.00 C ATOM 584 OG1 THR A 37 7.323 -12.699 6.958 1.00 0.00 O ATOM 585 CG2 THR A 37 8.748 -11.878 5.254 1.00 0.00 C ATOM 0 H THR A 37 6.348 -11.850 4.432 1.00 0.00 H new ATOM 0 HA THR A 37 7.711 -14.379 4.115 1.00 0.00 H new ATOM 0 HB THR A 37 8.792 -13.851 6.047 1.00 0.00 H new ATOM 0 HG1 THR A 37 7.946 -12.574 7.704 1.00 0.00 H new ATOM 0 HG21 THR A 37 9.391 -11.452 6.024 1.00 0.00 H new ATOM 0 HG22 THR A 37 9.353 -12.165 4.394 1.00 0.00 H new ATOM 0 HG23 THR A 37 8.010 -11.137 4.948 1.00 0.00 H new ATOM 593 N LYS A 38 6.602 -15.826 5.978 1.00 0.00 N ATOM 594 CA LYS A 38 5.762 -16.791 6.687 1.00 0.00 C ATOM 595 C LYS A 38 4.925 -16.125 7.777 1.00 0.00 C ATOM 596 O LYS A 38 3.847 -16.608 8.123 1.00 0.00 O ATOM 597 CB LYS A 38 6.630 -17.890 7.304 1.00 0.00 C ATOM 598 CG LYS A 38 5.893 -19.205 7.504 1.00 0.00 C ATOM 599 CD LYS A 38 6.802 -20.397 7.254 1.00 0.00 C ATOM 600 CE LYS A 38 6.490 -21.545 8.201 1.00 0.00 C ATOM 601 NZ LYS A 38 7.037 -21.304 9.565 1.00 0.00 N ATOM 0 H LYS A 38 7.575 -16.115 5.873 1.00 0.00 H new ATOM 0 HA LYS A 38 5.078 -17.226 5.958 1.00 0.00 H new ATOM 0 HB2 LYS A 38 7.495 -18.061 6.663 1.00 0.00 H new ATOM 0 HB3 LYS A 38 7.009 -17.545 8.266 1.00 0.00 H new ATOM 0 HG2 LYS A 38 5.500 -19.252 8.520 1.00 0.00 H new ATOM 0 HG3 LYS A 38 5.038 -19.250 6.829 1.00 0.00 H new ATOM 0 HD2 LYS A 38 6.688 -20.733 6.223 1.00 0.00 H new ATOM 0 HD3 LYS A 38 7.842 -20.095 7.377 1.00 0.00 H new ATOM 0 HE2 LYS A 38 5.410 -21.682 8.262 1.00 0.00 H new ATOM 0 HE3 LYS A 38 6.907 -22.469 7.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 6.803 -22.109 10.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 8.070 -21.198 9.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 6.620 -20.436 9.958 1.00 0.00 H new ATOM 615 N CYS A 39 5.423 -15.017 8.316 1.00 0.00 N ATOM 616 CA CYS A 39 4.712 -14.296 9.368 1.00 0.00 C ATOM 617 C CYS A 39 3.806 -13.214 8.785 1.00 0.00 C ATOM 618 O CYS A 39 3.350 -12.325 9.505 1.00 0.00 O ATOM 619 CB CYS A 39 5.708 -13.670 10.345 1.00 0.00 C ATOM 620 SG CYS A 39 4.952 -13.020 11.853 1.00 0.00 S ATOM 0 H CYS A 39 6.313 -14.599 8.044 1.00 0.00 H new ATOM 0 HA CYS A 39 4.086 -15.013 9.900 1.00 0.00 H new ATOM 0 HB2 CYS A 39 6.452 -14.418 10.618 1.00 0.00 H new ATOM 0 HB3 CYS A 39 6.238 -12.863 9.840 1.00 0.00 H new ATOM 625 N ASP A 40 3.546 -13.291 7.482 1.00 0.00 N ATOM 626 CA ASP A 40 2.695 -12.313 6.813 1.00 0.00 C ATOM 627 C ASP A 40 3.324 -10.925 6.868 1.00 0.00 C ATOM 628 O ASP A 40 2.637 -9.929 7.097 1.00 0.00 O ATOM 629 CB ASP A 40 1.305 -12.286 7.455 1.00 0.00 C ATOM 630 CG ASP A 40 0.342 -11.381 6.712 1.00 0.00 C ATOM 631 OD1 ASP A 40 -0.122 -11.777 5.621 1.00 0.00 O ATOM 632 OD2 ASP A 40 0.054 -10.277 7.218 1.00 0.00 O ATOM 0 H ASP A 40 3.912 -14.020 6.870 1.00 0.00 H new ATOM 0 HA ASP A 40 2.594 -12.607 5.768 1.00 0.00 H new ATOM 0 HB2 ASP A 40 0.901 -13.298 7.482 1.00 0.00 H new ATOM 0 HB3 ASP A 40 1.392 -11.950 8.488 1.00 0.00 H new ATOM 637 N HIS A 41 4.636 -10.867 6.656 1.00 0.00 N ATOM 638 CA HIS A 41 5.357 -9.596 6.682 1.00 0.00 C ATOM 639 C HIS A 41 5.809 -9.194 5.282 1.00 0.00 C ATOM 640 O HIS A 41 6.084 -10.048 4.440 1.00 0.00 O ATOM 641 CB HIS A 41 6.568 -9.687 7.613 1.00 0.00 C ATOM 642 CG HIS A 41 6.206 -9.795 9.060 1.00 0.00 C ATOM 643 ND1 HIS A 41 7.095 -9.589 10.091 1.00 0.00 N ATOM 644 CD2 HIS A 41 5.019 -10.094 9.646 1.00 0.00 C ATOM 645 CE1 HIS A 41 6.436 -9.769 11.245 1.00 0.00 C ATOM 646 NE2 HIS A 41 5.173 -10.076 11.029 1.00 0.00 N ATOM 0 H HIS A 41 5.220 -11.681 6.465 1.00 0.00 H new ATOM 0 HA HIS A 41 4.675 -8.833 7.057 1.00 0.00 H new ATOM 0 HB2 HIS A 41 7.167 -10.553 7.332 1.00 0.00 H new ATOM 0 HB3 HIS A 41 7.193 -8.806 7.469 1.00 0.00 H new ATOM 0 HD2 HIS A 41 4.100 -10.312 9.122 1.00 0.00 H new ATOM 0 HE1 HIS A 41 6.882 -9.675 12.224 1.00 0.00 H new ATOM 0 HE2 HIS A 41 4.456 -10.262 11.730 1.00 0.00 H new ATOM 654 N ILE A 42 5.881 -7.889 5.041 1.00 0.00 N ATOM 655 CA ILE A 42 6.297 -7.375 3.742 1.00 0.00 C ATOM 656 C ILE A 42 7.769 -6.973 3.746 1.00 0.00 C ATOM 657 O ILE A 42 8.315 -6.581 4.779 1.00 0.00 O ATOM 658 CB ILE A 42 5.446 -6.159 3.321 1.00 0.00 C ATOM 659 CG1 ILE A 42 3.957 -6.496 3.415 1.00 0.00 C ATOM 660 CG2 ILE A 42 5.808 -5.718 1.911 1.00 0.00 C ATOM 661 CD1 ILE A 42 3.553 -7.693 2.582 1.00 0.00 C ATOM 0 H ILE A 42 5.657 -7.169 5.728 1.00 0.00 H new ATOM 0 HA ILE A 42 6.150 -8.182 3.025 1.00 0.00 H new ATOM 0 HB ILE A 42 5.657 -5.334 4.001 1.00 0.00 H new ATOM 0 HG12 ILE A 42 3.701 -6.686 4.457 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.376 -5.630 3.097 1.00 0.00 H new ATOM 0 HG21 ILE A 42 5.198 -4.859 1.630 1.00 0.00 H new ATOM 0 HG22 ILE A 42 6.862 -5.442 1.875 1.00 0.00 H new ATOM 0 HG23 ILE A 42 5.624 -6.537 1.215 1.00 0.00 H new ATOM 0 HD11 ILE A 42 2.484 -7.873 2.698 1.00 0.00 H new ATOM 0 HD12 ILE A 42 3.777 -7.499 1.533 1.00 0.00 H new ATOM 0 HD13 ILE A 42 4.107 -8.571 2.914 1.00 0.00 H new ATOM 673 N PHE A 43 8.402 -7.069 2.582 1.00 0.00 N ATOM 674 CA PHE A 43 9.809 -6.714 2.437 1.00 0.00 C ATOM 675 C PHE A 43 10.131 -6.385 0.981 1.00 0.00 C ATOM 676 O PHE A 43 9.297 -6.575 0.096 1.00 0.00 O ATOM 677 CB PHE A 43 10.700 -7.859 2.921 1.00 0.00 C ATOM 678 CG PHE A 43 10.638 -8.091 4.404 1.00 0.00 C ATOM 679 CD1 PHE A 43 9.691 -8.946 4.946 1.00 0.00 C ATOM 680 CD2 PHE A 43 11.529 -7.457 5.255 1.00 0.00 C ATOM 681 CE1 PHE A 43 9.635 -9.163 6.310 1.00 0.00 C ATOM 682 CE2 PHE A 43 11.476 -7.671 6.619 1.00 0.00 C ATOM 683 CZ PHE A 43 10.528 -8.525 7.147 1.00 0.00 C ATOM 0 H PHE A 43 7.960 -7.391 1.721 1.00 0.00 H new ATOM 0 HA PHE A 43 10.004 -5.832 3.047 1.00 0.00 H new ATOM 0 HB2 PHE A 43 10.409 -8.775 2.407 1.00 0.00 H new ATOM 0 HB3 PHE A 43 11.731 -7.649 2.639 1.00 0.00 H new ATOM 0 HD1 PHE A 43 8.990 -9.448 4.296 1.00 0.00 H new ATOM 0 HD2 PHE A 43 12.273 -6.788 4.848 1.00 0.00 H new ATOM 0 HE1 PHE A 43 8.893 -9.832 6.721 1.00 0.00 H new ATOM 0 HE2 PHE A 43 12.176 -7.171 7.272 1.00 0.00 H new ATOM 0 HZ PHE A 43 10.485 -8.693 8.213 1.00 0.00 H new ATOM 693 N CYS A 44 11.343 -5.893 0.739 1.00 0.00 N ATOM 694 CA CYS A 44 11.764 -5.543 -0.614 1.00 0.00 C ATOM 695 C CYS A 44 12.591 -6.665 -1.235 1.00 0.00 C ATOM 696 O CYS A 44 13.480 -6.417 -2.049 1.00 0.00 O ATOM 697 CB CYS A 44 12.564 -4.237 -0.606 1.00 0.00 C ATOM 698 SG CYS A 44 14.202 -4.364 0.151 1.00 0.00 S ATOM 0 H CYS A 44 12.047 -5.728 1.458 1.00 0.00 H new ATOM 0 HA CYS A 44 10.869 -5.402 -1.220 1.00 0.00 H new ATOM 0 HB2 CYS A 44 12.678 -3.890 -1.633 1.00 0.00 H new ATOM 0 HB3 CYS A 44 11.990 -3.478 -0.075 1.00 0.00 H new ATOM 703 N LYS A 45 12.291 -7.902 -0.845 1.00 0.00 N ATOM 704 CA LYS A 45 13.003 -9.069 -1.363 1.00 0.00 C ATOM 705 C LYS A 45 14.434 -9.123 -0.835 1.00 0.00 C ATOM 706 O LYS A 45 14.807 -10.057 -0.125 1.00 0.00 O ATOM 707 CB LYS A 45 13.012 -9.054 -2.894 1.00 0.00 C ATOM 708 CG LYS A 45 13.386 -10.390 -3.513 1.00 0.00 C ATOM 709 CD LYS A 45 12.189 -11.324 -3.588 1.00 0.00 C ATOM 710 CE LYS A 45 12.579 -12.759 -3.272 1.00 0.00 C ATOM 711 NZ LYS A 45 11.852 -13.735 -4.130 1.00 0.00 N ATOM 0 H LYS A 45 11.558 -8.123 -0.171 1.00 0.00 H new ATOM 0 HA LYS A 45 12.477 -9.959 -1.018 1.00 0.00 H new ATOM 0 HB2 LYS A 45 12.025 -8.761 -3.252 1.00 0.00 H new ATOM 0 HB3 LYS A 45 13.714 -8.295 -3.237 1.00 0.00 H new ATOM 0 HG2 LYS A 45 13.786 -10.229 -4.514 1.00 0.00 H new ATOM 0 HG3 LYS A 45 14.176 -10.856 -2.925 1.00 0.00 H new ATOM 0 HD2 LYS A 45 11.423 -10.992 -2.887 1.00 0.00 H new ATOM 0 HD3 LYS A 45 11.751 -11.276 -4.585 1.00 0.00 H new ATOM 0 HE2 LYS A 45 13.653 -12.882 -3.412 1.00 0.00 H new ATOM 0 HE3 LYS A 45 12.368 -12.970 -2.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 12.437 -14.585 -4.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 10.956 -13.999 -3.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 11.655 -13.304 -5.056 1.00 0.00 H new ATOM 725 N PHE A 46 15.233 -8.121 -1.190 1.00 0.00 N ATOM 726 CA PHE A 46 16.627 -8.056 -0.758 1.00 0.00 C ATOM 727 C PHE A 46 16.759 -8.312 0.743 1.00 0.00 C ATOM 728 O PHE A 46 17.781 -8.819 1.205 1.00 0.00 O ATOM 729 CB PHE A 46 17.228 -6.695 -1.109 1.00 0.00 C ATOM 730 CG PHE A 46 18.637 -6.776 -1.622 1.00 0.00 C ATOM 731 CD1 PHE A 46 18.956 -7.615 -2.677 1.00 0.00 C ATOM 732 CD2 PHE A 46 19.642 -6.014 -1.049 1.00 0.00 C ATOM 733 CE1 PHE A 46 20.252 -7.692 -3.151 1.00 0.00 C ATOM 734 CE2 PHE A 46 20.939 -6.086 -1.519 1.00 0.00 C ATOM 735 CZ PHE A 46 21.245 -6.927 -2.572 1.00 0.00 C ATOM 0 H PHE A 46 14.939 -7.341 -1.777 1.00 0.00 H new ATOM 0 HA PHE A 46 17.174 -8.838 -1.285 1.00 0.00 H new ATOM 0 HB2 PHE A 46 16.603 -6.214 -1.861 1.00 0.00 H new ATOM 0 HB3 PHE A 46 17.208 -6.059 -0.224 1.00 0.00 H new ATOM 0 HD1 PHE A 46 18.184 -8.216 -3.134 1.00 0.00 H new ATOM 0 HD2 PHE A 46 19.409 -5.356 -0.225 1.00 0.00 H new ATOM 0 HE1 PHE A 46 20.488 -8.350 -3.974 1.00 0.00 H new ATOM 0 HE2 PHE A 46 21.713 -5.486 -1.064 1.00 0.00 H new ATOM 0 HZ PHE A 46 22.258 -6.986 -2.941 1.00 0.00 H new ATOM 745 N CYS A 47 15.723 -7.960 1.496 1.00 0.00 N ATOM 746 CA CYS A 47 15.734 -8.156 2.943 1.00 0.00 C ATOM 747 C CYS A 47 15.888 -9.632 3.289 1.00 0.00 C ATOM 748 O CYS A 47 16.581 -9.987 4.242 1.00 0.00 O ATOM 749 CB CYS A 47 14.451 -7.604 3.567 1.00 0.00 C ATOM 750 SG CYS A 47 14.079 -5.897 3.102 1.00 0.00 S ATOM 0 H CYS A 47 14.868 -7.539 1.132 1.00 0.00 H new ATOM 0 HA CYS A 47 16.587 -7.614 3.351 1.00 0.00 H new ATOM 0 HB2 CYS A 47 13.615 -8.239 3.275 1.00 0.00 H new ATOM 0 HB3 CYS A 47 14.533 -7.664 4.652 1.00 0.00 H new ATOM 755 N MET A 48 15.237 -10.489 2.510 1.00 0.00 N ATOM 756 CA MET A 48 15.303 -11.929 2.735 1.00 0.00 C ATOM 757 C MET A 48 16.744 -12.423 2.655 1.00 0.00 C ATOM 758 O MET A 48 17.159 -13.290 3.424 1.00 0.00 O ATOM 759 CB MET A 48 14.442 -12.666 1.709 1.00 0.00 C ATOM 760 CG MET A 48 12.964 -12.688 2.061 1.00 0.00 C ATOM 761 SD MET A 48 12.209 -11.052 1.998 1.00 0.00 S ATOM 762 CE MET A 48 11.289 -11.044 3.534 1.00 0.00 C ATOM 0 H MET A 48 14.658 -10.212 1.717 1.00 0.00 H new ATOM 0 HA MET A 48 14.920 -12.135 3.735 1.00 0.00 H new ATOM 0 HB2 MET A 48 14.568 -12.194 0.735 1.00 0.00 H new ATOM 0 HB3 MET A 48 14.800 -13.691 1.615 1.00 0.00 H new ATOM 0 HG2 MET A 48 12.441 -13.352 1.373 1.00 0.00 H new ATOM 0 HG3 MET A 48 12.839 -13.103 3.061 1.00 0.00 H new ATOM 0 HE1 MET A 48 10.235 -10.857 3.326 1.00 0.00 H new ATOM 0 HE2 MET A 48 11.396 -12.010 4.027 1.00 0.00 H new ATOM 0 HE3 MET A 48 11.675 -10.260 4.185 1.00 0.00 H new ATOM 772 N LEU A 49 17.501 -11.862 1.719 1.00 0.00 N ATOM 773 CA LEU A 49 18.897 -12.240 1.535 1.00 0.00 C ATOM 774 C LEU A 49 19.744 -11.782 2.720 1.00 0.00 C ATOM 775 O LEU A 49 20.534 -12.552 3.265 1.00 0.00 O ATOM 776 CB LEU A 49 19.446 -11.635 0.240 1.00 0.00 C ATOM 777 CG LEU A 49 18.866 -12.224 -1.047 1.00 0.00 C ATOM 778 CD1 LEU A 49 17.733 -11.355 -1.570 1.00 0.00 C ATOM 779 CD2 LEU A 49 19.953 -12.375 -2.101 1.00 0.00 C ATOM 0 H LEU A 49 17.171 -11.143 1.075 1.00 0.00 H new ATOM 0 HA LEU A 49 18.947 -13.327 1.471 1.00 0.00 H new ATOM 0 HB2 LEU A 49 19.255 -10.562 0.249 1.00 0.00 H new ATOM 0 HB3 LEU A 49 20.528 -11.766 0.226 1.00 0.00 H new ATOM 0 HG LEU A 49 18.464 -13.212 -0.822 1.00 0.00 H new ATOM 0 HD11 LEU A 49 17.333 -11.790 -2.486 1.00 0.00 H new ATOM 0 HD12 LEU A 49 16.943 -11.297 -0.821 1.00 0.00 H new ATOM 0 HD13 LEU A 49 18.109 -10.353 -1.778 1.00 0.00 H new ATOM 0 HD21 LEU A 49 19.523 -12.795 -3.010 1.00 0.00 H new ATOM 0 HD22 LEU A 49 20.384 -11.398 -2.322 1.00 0.00 H new ATOM 0 HD23 LEU A 49 20.732 -13.039 -1.728 1.00 0.00 H new ATOM 791 N LYS A 50 19.571 -10.524 3.111 1.00 0.00 N ATOM 792 CA LYS A 50 20.319 -9.961 4.230 1.00 0.00 C ATOM 793 C LYS A 50 19.874 -10.582 5.550 1.00 0.00 C ATOM 794 O LYS A 50 20.692 -10.828 6.437 1.00 0.00 O ATOM 795 CB LYS A 50 20.137 -8.444 4.280 1.00 0.00 C ATOM 796 CG LYS A 50 20.568 -7.737 3.005 1.00 0.00 C ATOM 797 CD LYS A 50 20.027 -6.317 2.945 1.00 0.00 C ATOM 798 CE LYS A 50 20.939 -5.408 2.136 1.00 0.00 C ATOM 799 NZ LYS A 50 20.486 -3.990 2.177 1.00 0.00 N ATOM 0 H LYS A 50 18.920 -9.875 2.670 1.00 0.00 H new ATOM 0 HA LYS A 50 21.374 -10.189 4.080 1.00 0.00 H new ATOM 0 HB2 LYS A 50 19.088 -8.218 4.474 1.00 0.00 H new ATOM 0 HB3 LYS A 50 20.709 -8.045 5.118 1.00 0.00 H new ATOM 0 HG2 LYS A 50 21.656 -7.715 2.950 1.00 0.00 H new ATOM 0 HG3 LYS A 50 20.216 -8.298 2.140 1.00 0.00 H new ATOM 0 HD2 LYS A 50 19.032 -6.324 2.501 1.00 0.00 H new ATOM 0 HD3 LYS A 50 19.922 -5.923 3.956 1.00 0.00 H new ATOM 0 HE2 LYS A 50 21.956 -5.476 2.523 1.00 0.00 H new ATOM 0 HE3 LYS A 50 20.968 -5.750 1.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 20.490 -3.596 1.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 19.523 -3.944 2.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 21.129 -3.437 2.779 1.00 0.00 H new ATOM 813 N LEU A 51 18.575 -10.834 5.674 1.00 0.00 N ATOM 814 CA LEU A 51 18.025 -11.427 6.887 1.00 0.00 C ATOM 815 C LEU A 51 18.427 -12.893 7.007 1.00 0.00 C ATOM 816 O LEU A 51 18.580 -13.417 8.110 1.00 0.00 O ATOM 817 CB LEU A 51 16.499 -11.301 6.895 1.00 0.00 C ATOM 818 CG LEU A 51 15.856 -11.303 8.283 1.00 0.00 C ATOM 819 CD1 LEU A 51 16.051 -9.958 8.964 1.00 0.00 C ATOM 820 CD2 LEU A 51 14.377 -11.644 8.182 1.00 0.00 C ATOM 0 H LEU A 51 17.884 -10.637 4.950 1.00 0.00 H new ATOM 0 HA LEU A 51 18.432 -10.887 7.742 1.00 0.00 H new ATOM 0 HB2 LEU A 51 16.223 -10.378 6.385 1.00 0.00 H new ATOM 0 HB3 LEU A 51 16.079 -12.123 6.316 1.00 0.00 H new ATOM 0 HG LEU A 51 16.344 -12.066 8.889 1.00 0.00 H new ATOM 0 HD11 LEU A 51 15.587 -9.979 9.950 1.00 0.00 H new ATOM 0 HD12 LEU A 51 17.117 -9.754 9.069 1.00 0.00 H new ATOM 0 HD13 LEU A 51 15.589 -9.175 8.362 1.00 0.00 H new ATOM 0 HD21 LEU A 51 13.934 -11.641 9.178 1.00 0.00 H new ATOM 0 HD22 LEU A 51 13.875 -10.904 7.559 1.00 0.00 H new ATOM 0 HD23 LEU A 51 14.261 -12.632 7.736 1.00 0.00 H new ATOM 832 N LEU A 52 18.596 -13.550 5.864 1.00 0.00 N ATOM 833 CA LEU A 52 18.981 -14.956 5.841 1.00 0.00 C ATOM 834 C LEU A 52 20.489 -15.111 6.010 1.00 0.00 C ATOM 835 O LEU A 52 20.960 -16.073 6.619 1.00 0.00 O ATOM 836 CB LEU A 52 18.535 -15.608 4.530 1.00 0.00 C ATOM 837 CG LEU A 52 17.073 -16.055 4.494 1.00 0.00 C ATOM 838 CD1 LEU A 52 16.583 -16.161 3.058 1.00 0.00 C ATOM 839 CD2 LEU A 52 16.905 -17.383 5.216 1.00 0.00 C ATOM 0 H LEU A 52 18.472 -13.131 4.942 1.00 0.00 H new ATOM 0 HA LEU A 52 18.486 -15.455 6.674 1.00 0.00 H new ATOM 0 HB2 LEU A 52 18.704 -14.903 3.716 1.00 0.00 H new ATOM 0 HB3 LEU A 52 19.169 -16.474 4.339 1.00 0.00 H new ATOM 0 HG LEU A 52 16.470 -15.306 5.007 1.00 0.00 H new ATOM 0 HD11 LEU A 52 15.541 -16.480 3.052 1.00 0.00 H new ATOM 0 HD12 LEU A 52 16.668 -15.189 2.572 1.00 0.00 H new ATOM 0 HD13 LEU A 52 17.189 -16.890 2.520 1.00 0.00 H new ATOM 0 HD21 LEU A 52 15.859 -17.686 5.181 1.00 0.00 H new ATOM 0 HD22 LEU A 52 17.519 -18.141 4.730 1.00 0.00 H new ATOM 0 HD23 LEU A 52 17.217 -17.274 6.255 1.00 0.00 H new ATOM 851 N ASN A 53 21.242 -14.160 5.468 1.00 0.00 N ATOM 852 CA ASN A 53 22.697 -14.192 5.558 1.00 0.00 C ATOM 853 C ASN A 53 23.207 -13.292 6.685 1.00 0.00 C ATOM 854 O ASN A 53 24.413 -13.199 6.915 1.00 0.00 O ATOM 855 CB ASN A 53 23.319 -13.762 4.229 1.00 0.00 C ATOM 856 CG ASN A 53 24.814 -14.010 4.182 1.00 0.00 C ATOM 857 OD1 ASN A 53 25.614 -13.082 4.300 1.00 0.00 O ATOM 858 ND2 ASN A 53 25.199 -15.269 4.008 1.00 0.00 N ATOM 0 H ASN A 53 20.869 -13.357 4.962 1.00 0.00 H new ATOM 0 HA ASN A 53 22.993 -15.217 5.781 1.00 0.00 H new ATOM 0 HB2 ASN A 53 22.838 -14.303 3.414 1.00 0.00 H new ATOM 0 HB3 ASN A 53 23.124 -12.702 4.066 1.00 0.00 H new ATOM 0 HD21 ASN A 53 26.192 -15.498 3.968 1.00 0.00 H new ATOM 0 HD22 ASN A 53 24.501 -16.007 3.915 1.00 0.00 H new ATOM 865 N GLN A 54 22.288 -12.629 7.383 1.00 0.00 N ATOM 866 CA GLN A 54 22.657 -11.741 8.480 1.00 0.00 C ATOM 867 C GLN A 54 23.417 -12.501 9.563 1.00 0.00 C ATOM 868 O GLN A 54 24.637 -12.382 9.678 1.00 0.00 O ATOM 869 CB GLN A 54 21.407 -11.086 9.075 1.00 0.00 C ATOM 870 CG GLN A 54 21.318 -9.592 8.807 1.00 0.00 C ATOM 871 CD GLN A 54 22.086 -8.769 9.822 1.00 0.00 C ATOM 872 OE1 GLN A 54 22.935 -9.290 10.545 1.00 0.00 O ATOM 873 NE2 GLN A 54 21.789 -7.476 9.882 1.00 0.00 N ATOM 0 H GLN A 54 21.285 -12.690 7.208 1.00 0.00 H new ATOM 0 HA GLN A 54 23.310 -10.964 8.084 1.00 0.00 H new ATOM 0 HB2 GLN A 54 20.522 -11.574 8.666 1.00 0.00 H new ATOM 0 HB3 GLN A 54 21.396 -11.255 10.152 1.00 0.00 H new ATOM 0 HG2 GLN A 54 21.703 -9.382 7.809 1.00 0.00 H new ATOM 0 HG3 GLN A 54 20.272 -9.287 8.815 1.00 0.00 H new ATOM 0 HE21 GLN A 54 21.078 -7.087 9.263 1.00 0.00 H new ATOM 0 HE22 GLN A 54 22.272 -6.872 10.547 1.00 0.00 H new ATOM 882 N LYS A 55 22.689 -13.282 10.353 1.00 0.00 N ATOM 883 CA LYS A 55 23.295 -14.062 11.426 1.00 0.00 C ATOM 884 C LYS A 55 23.449 -15.524 11.017 1.00 0.00 C ATOM 885 O LYS A 55 23.424 -16.421 11.860 1.00 0.00 O ATOM 886 CB LYS A 55 22.451 -13.963 12.697 1.00 0.00 C ATOM 887 CG LYS A 55 22.543 -12.609 13.383 1.00 0.00 C ATOM 888 CD LYS A 55 21.806 -11.535 12.598 1.00 0.00 C ATOM 889 CE LYS A 55 21.130 -10.535 13.522 1.00 0.00 C ATOM 890 NZ LYS A 55 22.087 -9.512 14.028 1.00 0.00 N ATOM 0 H LYS A 55 21.678 -13.392 10.271 1.00 0.00 H new ATOM 0 HA LYS A 55 24.286 -13.652 11.623 1.00 0.00 H new ATOM 0 HB2 LYS A 55 21.409 -14.165 12.448 1.00 0.00 H new ATOM 0 HB3 LYS A 55 22.768 -14.737 13.395 1.00 0.00 H new ATOM 0 HG2 LYS A 55 22.124 -12.679 14.387 1.00 0.00 H new ATOM 0 HG3 LYS A 55 23.590 -12.326 13.494 1.00 0.00 H new ATOM 0 HD2 LYS A 55 22.507 -11.014 11.946 1.00 0.00 H new ATOM 0 HD3 LYS A 55 21.059 -12.001 11.955 1.00 0.00 H new ATOM 0 HE2 LYS A 55 20.318 -10.040 12.990 1.00 0.00 H new ATOM 0 HE3 LYS A 55 20.684 -11.063 14.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 21.587 -8.849 14.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 22.849 -9.981 14.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 22.494 -8.990 13.226 1.00 0.00 H new ATOM 904 N LYS A 56 23.608 -15.758 9.718 1.00 0.00 N ATOM 905 CA LYS A 56 23.766 -17.111 9.198 1.00 0.00 C ATOM 906 C LYS A 56 22.546 -17.966 9.526 1.00 0.00 C ATOM 907 O LYS A 56 21.796 -17.666 10.454 1.00 0.00 O ATOM 908 CB LYS A 56 25.026 -17.757 9.775 1.00 0.00 C ATOM 909 CG LYS A 56 26.314 -17.243 9.150 1.00 0.00 C ATOM 910 CD LYS A 56 27.439 -17.174 10.171 1.00 0.00 C ATOM 911 CE LYS A 56 28.372 -16.007 9.892 1.00 0.00 C ATOM 912 NZ LYS A 56 29.438 -15.888 10.924 1.00 0.00 N ATOM 0 H LYS A 56 23.631 -15.028 9.006 1.00 0.00 H new ATOM 0 HA LYS A 56 23.862 -17.048 8.114 1.00 0.00 H new ATOM 0 HB2 LYS A 56 25.057 -17.578 10.850 1.00 0.00 H new ATOM 0 HB3 LYS A 56 24.969 -18.836 9.633 1.00 0.00 H new ATOM 0 HG2 LYS A 56 26.607 -17.896 8.328 1.00 0.00 H new ATOM 0 HG3 LYS A 56 26.144 -16.253 8.726 1.00 0.00 H new ATOM 0 HD2 LYS A 56 27.018 -17.074 11.172 1.00 0.00 H new ATOM 0 HD3 LYS A 56 28.005 -18.106 10.155 1.00 0.00 H new ATOM 0 HE2 LYS A 56 28.829 -16.135 8.911 1.00 0.00 H new ATOM 0 HE3 LYS A 56 27.796 -15.082 9.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 30.053 -15.080 10.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 29.003 -15.740 11.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 30.004 -16.760 10.940 1.00 0.00 H new ATOM 926 N GLY A 57 22.356 -19.035 8.759 1.00 0.00 N ATOM 927 CA GLY A 57 21.227 -19.918 8.984 1.00 0.00 C ATOM 928 C GLY A 57 19.898 -19.255 8.671 1.00 0.00 C ATOM 929 O GLY A 57 19.847 -18.298 7.900 1.00 0.00 O ATOM 0 H GLY A 57 22.964 -19.305 7.986 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.339 -20.809 8.367 1.00 0.00 H new ATOM 0 HA3 GLY A 57 21.229 -20.247 10.023 1.00 0.00 H new ATOM 933 N PRO A 58 18.795 -19.750 9.259 1.00 0.00 N ATOM 934 CA PRO A 58 17.459 -19.190 9.031 1.00 0.00 C ATOM 935 C PRO A 58 17.414 -17.682 9.254 1.00 0.00 C ATOM 936 O PRO A 58 18.199 -17.135 10.028 1.00 0.00 O ATOM 937 CB PRO A 58 16.590 -19.908 10.066 1.00 0.00 C ATOM 938 CG PRO A 58 17.297 -21.192 10.328 1.00 0.00 C ATOM 939 CD PRO A 58 18.764 -20.891 10.192 1.00 0.00 C ATOM 0 HA PRO A 58 17.129 -19.335 8.002 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.490 -19.318 10.977 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.583 -20.081 9.686 1.00 0.00 H new ATOM 0 HG2 PRO A 58 17.066 -21.568 11.325 1.00 0.00 H new ATOM 0 HG3 PRO A 58 16.988 -21.960 9.618 1.00 0.00 H new ATOM 0 HD2 PRO A 58 19.212 -20.637 11.152 1.00 0.00 H new ATOM 0 HD3 PRO A 58 19.315 -21.746 9.799 1.00 0.00 H new ATOM 947 N SER A 59 16.489 -17.015 8.571 1.00 0.00 N ATOM 948 CA SER A 59 16.341 -15.569 8.696 1.00 0.00 C ATOM 949 C SER A 59 15.518 -15.214 9.931 1.00 0.00 C ATOM 950 O SER A 59 14.512 -15.859 10.224 1.00 0.00 O ATOM 951 CB SER A 59 15.681 -14.991 7.441 1.00 0.00 C ATOM 952 OG SER A 59 15.042 -16.006 6.687 1.00 0.00 O ATOM 0 H SER A 59 15.831 -17.452 7.926 1.00 0.00 H new ATOM 0 HA SER A 59 17.334 -15.133 8.806 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.952 -14.232 7.726 1.00 0.00 H new ATOM 0 HB3 SER A 59 16.433 -14.496 6.826 1.00 0.00 H new ATOM 0 HG SER A 59 14.496 -15.596 5.984 1.00 0.00 H new ATOM 958 N GLN A 60 15.954 -14.185 10.650 1.00 0.00 N ATOM 959 CA GLN A 60 15.258 -13.746 11.854 1.00 0.00 C ATOM 960 C GLN A 60 14.322 -12.581 11.548 1.00 0.00 C ATOM 961 O GLN A 60 14.768 -11.493 11.183 1.00 0.00 O ATOM 962 CB GLN A 60 16.267 -13.336 12.929 1.00 0.00 C ATOM 963 CG GLN A 60 16.862 -14.513 13.685 1.00 0.00 C ATOM 964 CD GLN A 60 18.326 -14.309 14.021 1.00 0.00 C ATOM 965 OE1 GLN A 60 19.030 -13.557 13.347 1.00 0.00 O ATOM 966 NE2 GLN A 60 18.792 -14.981 15.068 1.00 0.00 N ATOM 0 H GLN A 60 16.785 -13.640 10.420 1.00 0.00 H new ATOM 0 HA GLN A 60 14.661 -14.580 12.223 1.00 0.00 H new ATOM 0 HB2 GLN A 60 17.073 -12.770 12.462 1.00 0.00 H new ATOM 0 HB3 GLN A 60 15.778 -12.669 13.639 1.00 0.00 H new ATOM 0 HG2 GLN A 60 16.300 -14.670 14.606 1.00 0.00 H new ATOM 0 HG3 GLN A 60 16.753 -15.417 13.086 1.00 0.00 H new ATOM 0 HE21 GLN A 60 18.172 -15.593 15.598 1.00 0.00 H new ATOM 0 HE22 GLN A 60 19.770 -14.884 15.342 1.00 0.00 H new ATOM 975 N CYS A 61 13.023 -12.817 11.701 1.00 0.00 N ATOM 976 CA CYS A 61 12.021 -11.789 11.444 1.00 0.00 C ATOM 977 C CYS A 61 12.303 -10.533 12.270 1.00 0.00 C ATOM 978 O CYS A 61 12.270 -10.573 13.500 1.00 0.00 O ATOM 979 CB CYS A 61 10.623 -12.323 11.769 1.00 0.00 C ATOM 980 SG CYS A 61 9.298 -11.109 11.570 1.00 0.00 S ATOM 0 H CYS A 61 12.639 -13.713 12.002 1.00 0.00 H new ATOM 0 HA CYS A 61 12.068 -11.525 10.388 1.00 0.00 H new ATOM 0 HB2 CYS A 61 10.415 -13.179 11.127 1.00 0.00 H new ATOM 0 HB3 CYS A 61 10.615 -12.687 12.797 1.00 0.00 H new ATOM 985 N PRO A 62 12.585 -9.396 11.606 1.00 0.00 N ATOM 986 CA PRO A 62 12.873 -8.135 12.286 1.00 0.00 C ATOM 987 C PRO A 62 11.610 -7.342 12.611 1.00 0.00 C ATOM 988 O PRO A 62 11.588 -6.117 12.491 1.00 0.00 O ATOM 989 CB PRO A 62 13.716 -7.394 11.255 1.00 0.00 C ATOM 990 CG PRO A 62 13.169 -7.840 9.939 1.00 0.00 C ATOM 991 CD PRO A 62 12.654 -9.248 10.139 1.00 0.00 C ATOM 0 HA PRO A 62 13.362 -8.283 13.249 1.00 0.00 H new ATOM 0 HB2 PRO A 62 13.632 -6.314 11.375 1.00 0.00 H new ATOM 0 HB3 PRO A 62 14.773 -7.644 11.352 1.00 0.00 H new ATOM 0 HG2 PRO A 62 12.369 -7.178 9.608 1.00 0.00 H new ATOM 0 HG3 PRO A 62 13.941 -7.816 9.170 1.00 0.00 H new ATOM 0 HD2 PRO A 62 11.676 -9.385 9.677 1.00 0.00 H new ATOM 0 HD3 PRO A 62 13.323 -9.985 9.694 1.00 0.00 H new ATOM 999 N LEU A 63 10.558 -8.044 13.022 1.00 0.00 N ATOM 1000 CA LEU A 63 9.295 -7.400 13.360 1.00 0.00 C ATOM 1001 C LEU A 63 8.743 -7.939 14.676 1.00 0.00 C ATOM 1002 O LEU A 63 8.329 -7.173 15.547 1.00 0.00 O ATOM 1003 CB LEU A 63 8.276 -7.614 12.238 1.00 0.00 C ATOM 1004 CG LEU A 63 8.214 -6.497 11.194 1.00 0.00 C ATOM 1005 CD1 LEU A 63 9.094 -6.833 10.000 1.00 0.00 C ATOM 1006 CD2 LEU A 63 6.778 -6.262 10.749 1.00 0.00 C ATOM 0 H LEU A 63 10.556 -9.058 13.129 1.00 0.00 H new ATOM 0 HA LEU A 63 9.479 -6.332 13.477 1.00 0.00 H new ATOM 0 HB2 LEU A 63 8.508 -8.551 11.731 1.00 0.00 H new ATOM 0 HB3 LEU A 63 7.288 -7.729 12.683 1.00 0.00 H new ATOM 0 HG LEU A 63 8.588 -5.580 11.649 1.00 0.00 H new ATOM 0 HD11 LEU A 63 9.037 -6.027 9.268 1.00 0.00 H new ATOM 0 HD12 LEU A 63 10.126 -6.951 10.330 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.750 -7.762 9.545 1.00 0.00 H new ATOM 0 HD21 LEU A 63 6.753 -5.464 10.007 1.00 0.00 H new ATOM 0 HD22 LEU A 63 6.378 -7.177 10.312 1.00 0.00 H new ATOM 0 HD23 LEU A 63 6.173 -5.976 11.609 1.00 0.00 H new ATOM 1018 N CYS A 64 8.738 -9.262 14.814 1.00 0.00 N ATOM 1019 CA CYS A 64 8.234 -9.901 16.025 1.00 0.00 C ATOM 1020 C CYS A 64 9.175 -11.007 16.494 1.00 0.00 C ATOM 1021 O CYS A 64 8.748 -11.965 17.138 1.00 0.00 O ATOM 1022 CB CYS A 64 6.838 -10.475 15.779 1.00 0.00 C ATOM 1023 SG CYS A 64 6.690 -11.422 14.246 1.00 0.00 S ATOM 0 H CYS A 64 9.077 -9.911 14.104 1.00 0.00 H new ATOM 0 HA CYS A 64 8.178 -9.144 16.807 1.00 0.00 H new ATOM 0 HB2 CYS A 64 6.568 -11.117 16.618 1.00 0.00 H new ATOM 0 HB3 CYS A 64 6.118 -9.656 15.759 1.00 0.00 H new ATOM 1028 N LYS A 65 10.457 -10.867 16.170 1.00 0.00 N ATOM 1029 CA LYS A 65 11.458 -11.854 16.559 1.00 0.00 C ATOM 1030 C LYS A 65 11.080 -13.249 16.067 1.00 0.00 C ATOM 1031 O LYS A 65 11.526 -14.254 16.620 1.00 0.00 O ATOM 1032 CB LYS A 65 11.624 -11.867 18.080 1.00 0.00 C ATOM 1033 CG LYS A 65 13.023 -12.248 18.537 1.00 0.00 C ATOM 1034 CD LYS A 65 14.036 -11.170 18.186 1.00 0.00 C ATOM 1035 CE LYS A 65 15.089 -11.021 19.273 1.00 0.00 C ATOM 1036 NZ LYS A 65 15.607 -9.628 19.356 1.00 0.00 N ATOM 0 H LYS A 65 10.827 -10.079 15.639 1.00 0.00 H new ATOM 0 HA LYS A 65 12.403 -11.573 16.095 1.00 0.00 H new ATOM 0 HB2 LYS A 65 11.379 -10.880 18.472 1.00 0.00 H new ATOM 0 HB3 LYS A 65 10.907 -12.567 18.509 1.00 0.00 H new ATOM 0 HG2 LYS A 65 13.023 -12.412 19.615 1.00 0.00 H new ATOM 0 HG3 LYS A 65 13.315 -13.189 18.071 1.00 0.00 H new ATOM 0 HD2 LYS A 65 14.519 -11.417 17.241 1.00 0.00 H new ATOM 0 HD3 LYS A 65 13.522 -10.219 18.042 1.00 0.00 H new ATOM 0 HE2 LYS A 65 14.662 -11.307 20.234 1.00 0.00 H new ATOM 0 HE3 LYS A 65 15.915 -11.704 19.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 16.322 -9.568 20.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 16.037 -9.363 18.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 14.824 -8.978 19.570 1.00 0.00 H new ATOM 1050 N ASN A 66 10.255 -13.305 15.025 1.00 0.00 N ATOM 1051 CA ASN A 66 9.822 -14.578 14.461 1.00 0.00 C ATOM 1052 C ASN A 66 11.016 -15.390 13.968 1.00 0.00 C ATOM 1053 O ASN A 66 12.165 -15.071 14.277 1.00 0.00 O ATOM 1054 CB ASN A 66 8.838 -14.342 13.312 1.00 0.00 C ATOM 1055 CG ASN A 66 7.697 -15.341 13.313 1.00 0.00 C ATOM 1056 OD1 ASN A 66 6.925 -15.417 14.269 1.00 0.00 O ATOM 1057 ND2 ASN A 66 7.587 -16.114 12.239 1.00 0.00 N ATOM 0 H ASN A 66 9.874 -12.484 14.555 1.00 0.00 H new ATOM 0 HA ASN A 66 9.322 -15.144 15.247 1.00 0.00 H new ATOM 0 HB2 ASN A 66 8.433 -13.333 13.385 1.00 0.00 H new ATOM 0 HB3 ASN A 66 9.370 -14.404 12.363 1.00 0.00 H new ATOM 0 HD21 ASN A 66 6.840 -16.806 12.183 1.00 0.00 H new ATOM 0 HD22 ASN A 66 8.250 -16.016 11.470 1.00 0.00 H new ATOM 1064 N ASP A 67 10.738 -16.440 13.202 1.00 0.00 N ATOM 1065 CA ASP A 67 11.791 -17.296 12.668 1.00 0.00 C ATOM 1066 C ASP A 67 11.481 -17.715 11.236 1.00 0.00 C ATOM 1067 O ASP A 67 10.559 -18.494 10.992 1.00 0.00 O ATOM 1068 CB ASP A 67 11.965 -18.535 13.549 1.00 0.00 C ATOM 1069 CG ASP A 67 12.924 -18.298 14.699 1.00 0.00 C ATOM 1070 OD1 ASP A 67 14.054 -17.830 14.443 1.00 0.00 O ATOM 1071 OD2 ASP A 67 12.547 -18.580 15.854 1.00 0.00 O ATOM 0 H ASP A 67 9.793 -16.718 12.937 1.00 0.00 H new ATOM 0 HA ASP A 67 12.720 -16.726 12.665 1.00 0.00 H new ATOM 0 HB2 ASP A 67 10.995 -18.835 13.945 1.00 0.00 H new ATOM 0 HB3 ASP A 67 12.330 -19.362 12.940 1.00 0.00 H new ATOM 1076 N ILE A 68 12.258 -17.195 10.291 1.00 0.00 N ATOM 1077 CA ILE A 68 12.066 -17.515 8.881 1.00 0.00 C ATOM 1078 C ILE A 68 13.094 -18.539 8.411 1.00 0.00 C ATOM 1079 O ILE A 68 14.257 -18.495 8.815 1.00 0.00 O ATOM 1080 CB ILE A 68 12.171 -16.257 7.996 1.00 0.00 C ATOM 1081 CG1 ILE A 68 11.329 -15.119 8.579 1.00 0.00 C ATOM 1082 CG2 ILE A 68 11.731 -16.571 6.574 1.00 0.00 C ATOM 1083 CD1 ILE A 68 11.993 -13.763 8.475 1.00 0.00 C ATOM 0 H ILE A 68 13.026 -16.550 10.476 1.00 0.00 H new ATOM 0 HA ILE A 68 11.064 -17.933 8.784 1.00 0.00 H new ATOM 0 HB ILE A 68 13.213 -15.937 7.973 1.00 0.00 H new ATOM 0 HG12 ILE A 68 10.370 -15.086 8.062 1.00 0.00 H new ATOM 0 HG13 ILE A 68 11.119 -15.333 9.627 1.00 0.00 H new ATOM 0 HG21 ILE A 68 11.811 -15.673 5.962 1.00 0.00 H new ATOM 0 HG22 ILE A 68 12.370 -17.351 6.159 1.00 0.00 H new ATOM 0 HG23 ILE A 68 10.697 -16.915 6.581 1.00 0.00 H new ATOM 0 HD11 ILE A 68 11.341 -13.004 8.907 1.00 0.00 H new ATOM 0 HD12 ILE A 68 12.939 -13.779 9.016 1.00 0.00 H new ATOM 0 HD13 ILE A 68 12.178 -13.528 7.427 1.00 0.00 H new ATOM 1095 N THR A 69 12.661 -19.464 7.560 1.00 0.00 N ATOM 1096 CA THR A 69 13.549 -20.499 7.042 1.00 0.00 C ATOM 1097 C THR A 69 13.359 -20.685 5.538 1.00 0.00 C ATOM 1098 O THR A 69 13.199 -21.805 5.055 1.00 0.00 O ATOM 1099 CB THR A 69 13.298 -21.823 7.768 1.00 0.00 C ATOM 1100 OG1 THR A 69 11.941 -21.934 8.156 1.00 0.00 O ATOM 1101 CG2 THR A 69 14.147 -21.992 9.011 1.00 0.00 C ATOM 0 H THR A 69 11.703 -19.518 7.215 1.00 0.00 H new ATOM 0 HA THR A 69 14.576 -20.181 7.220 1.00 0.00 H new ATOM 0 HB THR A 69 13.568 -22.601 7.053 1.00 0.00 H new ATOM 0 HG1 THR A 69 11.801 -22.788 8.617 1.00 0.00 H new ATOM 0 HG21 THR A 69 13.921 -22.950 9.479 1.00 0.00 H new ATOM 0 HG22 THR A 69 15.202 -21.961 8.738 1.00 0.00 H new ATOM 0 HG23 THR A 69 13.930 -21.186 9.712 1.00 0.00 H new ATOM 1109 N LYS A 70 13.382 -19.578 4.802 1.00 0.00 N ATOM 1110 CA LYS A 70 13.216 -19.619 3.353 1.00 0.00 C ATOM 1111 C LYS A 70 11.915 -20.319 2.969 1.00 0.00 C ATOM 1112 O LYS A 70 11.106 -20.664 3.830 1.00 0.00 O ATOM 1113 CB LYS A 70 14.403 -20.335 2.705 1.00 0.00 C ATOM 1114 CG LYS A 70 14.828 -19.727 1.378 1.00 0.00 C ATOM 1115 CD LYS A 70 16.337 -19.787 1.196 1.00 0.00 C ATOM 1116 CE LYS A 70 16.840 -18.637 0.338 1.00 0.00 C ATOM 1117 NZ LYS A 70 18.325 -18.637 0.222 1.00 0.00 N ATOM 0 H LYS A 70 13.514 -18.642 5.185 1.00 0.00 H new ATOM 0 HA LYS A 70 13.174 -18.592 2.989 1.00 0.00 H new ATOM 0 HB2 LYS A 70 15.249 -20.314 3.392 1.00 0.00 H new ATOM 0 HB3 LYS A 70 14.144 -21.382 2.549 1.00 0.00 H new ATOM 0 HG2 LYS A 70 14.340 -20.258 0.560 1.00 0.00 H new ATOM 0 HG3 LYS A 70 14.495 -18.690 1.328 1.00 0.00 H new ATOM 0 HD2 LYS A 70 16.824 -19.755 2.171 1.00 0.00 H new ATOM 0 HD3 LYS A 70 16.612 -20.735 0.733 1.00 0.00 H new ATOM 0 HE2 LYS A 70 16.398 -18.706 -0.656 1.00 0.00 H new ATOM 0 HE3 LYS A 70 16.510 -17.692 0.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 18.627 -17.838 -0.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 18.747 -18.545 1.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 18.639 -19.528 -0.212 1.00 0.00 H new ATOM 1131 N ARG A 71 11.723 -20.532 1.669 1.00 0.00 N ATOM 1132 CA ARG A 71 10.524 -21.198 1.164 1.00 0.00 C ATOM 1133 C ARG A 71 9.292 -20.306 1.306 1.00 0.00 C ATOM 1134 O ARG A 71 8.668 -19.933 0.312 1.00 0.00 O ATOM 1135 CB ARG A 71 10.298 -22.523 1.897 1.00 0.00 C ATOM 1136 CG ARG A 71 9.987 -23.686 0.969 1.00 0.00 C ATOM 1137 CD ARG A 71 8.490 -23.923 0.854 1.00 0.00 C ATOM 1138 NE ARG A 71 8.102 -24.331 -0.494 1.00 0.00 N ATOM 1139 CZ ARG A 71 6.951 -24.932 -0.784 1.00 0.00 C ATOM 1140 NH1 ARG A 71 6.071 -25.196 0.175 1.00 0.00 N ATOM 1141 NH2 ARG A 71 6.676 -25.270 -2.037 1.00 0.00 N ATOM 0 H ARG A 71 12.384 -20.252 0.944 1.00 0.00 H new ATOM 0 HA ARG A 71 10.679 -21.399 0.104 1.00 0.00 H new ATOM 0 HB2 ARG A 71 11.187 -22.762 2.480 1.00 0.00 H new ATOM 0 HB3 ARG A 71 9.476 -22.403 2.603 1.00 0.00 H new ATOM 0 HG2 ARG A 71 10.401 -23.485 -0.019 1.00 0.00 H new ATOM 0 HG3 ARG A 71 10.472 -24.589 1.341 1.00 0.00 H new ATOM 0 HD2 ARG A 71 8.189 -24.691 1.566 1.00 0.00 H new ATOM 0 HD3 ARG A 71 7.957 -23.012 1.124 1.00 0.00 H new ATOM 0 HE ARG A 71 8.752 -24.144 -1.258 1.00 0.00 H new ATOM 0 HH11 ARG A 71 6.276 -24.938 1.140 1.00 0.00 H new ATOM 0 HH12 ARG A 71 5.190 -25.657 -0.054 1.00 0.00 H new ATOM 0 HH21 ARG A 71 7.347 -25.069 -2.778 1.00 0.00 H new ATOM 0 HH22 ARG A 71 5.793 -25.731 -2.259 1.00 0.00 H new ATOM 1155 N SER A 72 8.945 -19.971 2.544 1.00 0.00 N ATOM 1156 CA SER A 72 7.785 -19.128 2.814 1.00 0.00 C ATOM 1157 C SER A 72 7.895 -17.786 2.094 1.00 0.00 C ATOM 1158 O SER A 72 6.892 -17.109 1.868 1.00 0.00 O ATOM 1159 CB SER A 72 7.634 -18.900 4.319 1.00 0.00 C ATOM 1160 OG SER A 72 8.360 -19.867 5.057 1.00 0.00 O ATOM 0 H SER A 72 9.451 -20.271 3.378 1.00 0.00 H new ATOM 0 HA SER A 72 6.902 -19.645 2.438 1.00 0.00 H new ATOM 0 HB2 SER A 72 7.987 -17.901 4.576 1.00 0.00 H new ATOM 0 HB3 SER A 72 6.580 -18.945 4.593 1.00 0.00 H new ATOM 0 HG SER A 72 9.031 -19.418 5.613 1.00 0.00 H new ATOM 1166 N LEU A 73 9.117 -17.406 1.737 1.00 0.00 N ATOM 1167 CA LEU A 73 9.354 -16.144 1.046 1.00 0.00 C ATOM 1168 C LEU A 73 8.829 -16.201 -0.384 1.00 0.00 C ATOM 1169 O LEU A 73 9.416 -16.851 -1.248 1.00 0.00 O ATOM 1170 CB LEU A 73 10.848 -15.814 1.041 1.00 0.00 C ATOM 1171 CG LEU A 73 11.434 -15.448 2.406 1.00 0.00 C ATOM 1172 CD1 LEU A 73 10.640 -14.319 3.043 1.00 0.00 C ATOM 1173 CD2 LEU A 73 11.460 -16.664 3.319 1.00 0.00 C ATOM 0 H LEU A 73 9.959 -17.954 1.915 1.00 0.00 H new ATOM 0 HA LEU A 73 8.818 -15.359 1.580 1.00 0.00 H new ATOM 0 HB2 LEU A 73 11.393 -16.672 0.647 1.00 0.00 H new ATOM 0 HB3 LEU A 73 11.019 -14.985 0.355 1.00 0.00 H new ATOM 0 HG LEU A 73 12.459 -15.106 2.259 1.00 0.00 H new ATOM 0 HD11 LEU A 73 11.072 -14.073 4.013 1.00 0.00 H new ATOM 0 HD12 LEU A 73 10.674 -13.441 2.398 1.00 0.00 H new ATOM 0 HD13 LEU A 73 9.604 -14.632 3.176 1.00 0.00 H new ATOM 0 HD21 LEU A 73 11.880 -16.385 4.285 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.445 -17.036 3.458 1.00 0.00 H new ATOM 0 HD23 LEU A 73 12.074 -17.444 2.869 1.00 0.00 H new ATOM 1185 N GLN A 74 7.718 -15.513 -0.627 1.00 0.00 N ATOM 1186 CA GLN A 74 7.110 -15.483 -1.953 1.00 0.00 C ATOM 1187 C GLN A 74 6.817 -14.049 -2.383 1.00 0.00 C ATOM 1188 O GLN A 74 6.105 -13.319 -1.694 1.00 0.00 O ATOM 1189 CB GLN A 74 5.822 -16.307 -1.967 1.00 0.00 C ATOM 1190 CG GLN A 74 4.817 -15.882 -0.908 1.00 0.00 C ATOM 1191 CD GLN A 74 4.112 -17.061 -0.267 1.00 0.00 C ATOM 1192 OE1 GLN A 74 3.271 -17.709 -0.890 1.00 0.00 O ATOM 1193 NE2 GLN A 74 4.452 -17.344 0.985 1.00 0.00 N ATOM 0 H GLN A 74 7.220 -14.968 0.077 1.00 0.00 H new ATOM 0 HA GLN A 74 7.817 -15.918 -2.660 1.00 0.00 H new ATOM 0 HB2 GLN A 74 5.358 -16.225 -2.950 1.00 0.00 H new ATOM 0 HB3 GLN A 74 6.071 -17.358 -1.819 1.00 0.00 H new ATOM 0 HG2 GLN A 74 5.329 -15.306 -0.137 1.00 0.00 H new ATOM 0 HG3 GLN A 74 4.076 -15.222 -1.359 1.00 0.00 H new ATOM 0 HE21 GLN A 74 5.155 -16.779 1.463 1.00 0.00 H new ATOM 0 HE22 GLN A 74 4.011 -18.126 1.469 1.00 0.00 H new ATOM 1202 N GLU A 75 7.369 -13.654 -3.526 1.00 0.00 N ATOM 1203 CA GLU A 75 7.165 -12.308 -4.046 1.00 0.00 C ATOM 1204 C GLU A 75 5.684 -12.030 -4.277 1.00 0.00 C ATOM 1205 O GLU A 75 5.035 -12.698 -5.083 1.00 0.00 O ATOM 1206 CB GLU A 75 7.941 -12.121 -5.352 1.00 0.00 C ATOM 1207 CG GLU A 75 9.365 -11.632 -5.150 1.00 0.00 C ATOM 1208 CD GLU A 75 10.129 -11.504 -6.454 1.00 0.00 C ATOM 1209 OE1 GLU A 75 9.684 -10.730 -7.328 1.00 0.00 O ATOM 1210 OE2 GLU A 75 11.170 -12.177 -6.602 1.00 0.00 O ATOM 0 H GLU A 75 7.960 -14.247 -4.109 1.00 0.00 H new ATOM 0 HA GLU A 75 7.536 -11.600 -3.305 1.00 0.00 H new ATOM 0 HB2 GLU A 75 7.964 -13.069 -5.890 1.00 0.00 H new ATOM 0 HB3 GLU A 75 7.408 -11.410 -5.983 1.00 0.00 H new ATOM 0 HG2 GLU A 75 9.345 -10.664 -4.649 1.00 0.00 H new ATOM 0 HG3 GLU A 75 9.892 -12.322 -4.491 1.00 0.00 H new ATOM 1217 N SER A 76 5.155 -11.040 -3.565 1.00 0.00 N ATOM 1218 CA SER A 76 3.749 -10.673 -3.693 1.00 0.00 C ATOM 1219 C SER A 76 3.564 -9.583 -4.742 1.00 0.00 C ATOM 1220 O SER A 76 4.499 -8.848 -5.061 1.00 0.00 O ATOM 1221 CB SER A 76 3.201 -10.199 -2.345 1.00 0.00 C ATOM 1222 OG SER A 76 3.463 -11.147 -1.325 1.00 0.00 O ATOM 0 H SER A 76 5.678 -10.478 -2.894 1.00 0.00 H new ATOM 0 HA SER A 76 3.196 -11.556 -4.013 1.00 0.00 H new ATOM 0 HB2 SER A 76 3.653 -9.243 -2.081 1.00 0.00 H new ATOM 0 HB3 SER A 76 2.127 -10.033 -2.424 1.00 0.00 H new ATOM 0 HG SER A 76 2.623 -11.569 -1.048 1.00 0.00 H new ATOM 1228 N THR A 77 2.352 -9.485 -5.278 1.00 0.00 N ATOM 1229 CA THR A 77 2.042 -8.484 -6.294 1.00 0.00 C ATOM 1230 C THR A 77 1.055 -7.445 -5.765 1.00 0.00 C ATOM 1231 O THR A 77 0.964 -6.338 -6.295 1.00 0.00 O ATOM 1232 CB THR A 77 1.470 -9.157 -7.542 1.00 0.00 C ATOM 1233 OG1 THR A 77 2.363 -10.140 -8.036 1.00 0.00 O ATOM 1234 CG2 THR A 77 1.186 -8.186 -8.668 1.00 0.00 C ATOM 0 H THR A 77 1.568 -10.086 -5.026 1.00 0.00 H new ATOM 0 HA THR A 77 2.969 -7.972 -6.553 1.00 0.00 H new ATOM 0 HB THR A 77 0.528 -9.604 -7.224 1.00 0.00 H new ATOM 0 HG1 THR A 77 1.978 -10.560 -8.833 1.00 0.00 H new ATOM 0 HG21 THR A 77 0.782 -8.728 -9.523 1.00 0.00 H new ATOM 0 HG22 THR A 77 0.461 -7.444 -8.334 1.00 0.00 H new ATOM 0 HG23 THR A 77 2.110 -7.686 -8.959 1.00 0.00 H new ATOM 1242 N ARG A 78 0.314 -7.808 -4.721 1.00 0.00 N ATOM 1243 CA ARG A 78 -0.667 -6.905 -4.129 1.00 0.00 C ATOM 1244 C ARG A 78 -0.012 -5.602 -3.679 1.00 0.00 C ATOM 1245 O ARG A 78 -0.615 -4.532 -3.768 1.00 0.00 O ATOM 1246 CB ARG A 78 -1.361 -7.577 -2.942 1.00 0.00 C ATOM 1247 CG ARG A 78 -0.399 -8.063 -1.871 1.00 0.00 C ATOM 1248 CD ARG A 78 -1.142 -8.628 -0.671 1.00 0.00 C ATOM 1249 NE ARG A 78 -0.454 -9.778 -0.091 1.00 0.00 N ATOM 1250 CZ ARG A 78 -1.037 -10.662 0.715 1.00 0.00 C ATOM 1251 NH1 ARG A 78 -2.317 -10.532 1.039 1.00 0.00 N ATOM 1252 NH2 ARG A 78 -0.337 -11.680 1.198 1.00 0.00 N ATOM 0 H ARG A 78 0.375 -8.720 -4.269 1.00 0.00 H new ATOM 0 HA ARG A 78 -1.410 -6.671 -4.891 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -2.063 -6.872 -2.496 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -1.945 -8.423 -3.305 1.00 0.00 H new ATOM 0 HG2 ARG A 78 0.256 -8.828 -2.288 1.00 0.00 H new ATOM 0 HG3 ARG A 78 0.238 -7.238 -1.551 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -1.251 -7.851 0.086 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -2.147 -8.922 -0.973 1.00 0.00 H new ATOM 0 HE ARG A 78 0.532 -9.912 -0.317 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -2.860 -9.751 0.670 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -2.758 -11.213 1.657 1.00 0.00 H new ATOM 0 HH21 ARG A 78 0.647 -11.785 0.952 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -0.783 -12.358 1.816 1.00 0.00 H new ATOM 1266 N PHE A 79 1.223 -5.697 -3.196 1.00 0.00 N ATOM 1267 CA PHE A 79 1.952 -4.522 -2.734 1.00 0.00 C ATOM 1268 C PHE A 79 2.988 -4.075 -3.763 1.00 0.00 C ATOM 1269 O PHE A 79 3.951 -3.387 -3.426 1.00 0.00 O ATOM 1270 CB PHE A 79 2.637 -4.813 -1.397 1.00 0.00 C ATOM 1271 CG PHE A 79 1.828 -4.393 -0.204 1.00 0.00 C ATOM 1272 CD1 PHE A 79 0.499 -4.768 -0.084 1.00 0.00 C ATOM 1273 CD2 PHE A 79 2.396 -3.624 0.799 1.00 0.00 C ATOM 1274 CE1 PHE A 79 -0.247 -4.386 1.013 1.00 0.00 C ATOM 1275 CE2 PHE A 79 1.654 -3.237 1.899 1.00 0.00 C ATOM 1276 CZ PHE A 79 0.330 -3.618 2.007 1.00 0.00 C ATOM 0 H PHE A 79 1.738 -6.573 -3.115 1.00 0.00 H new ATOM 0 HA PHE A 79 1.233 -3.714 -2.600 1.00 0.00 H new ATOM 0 HB2 PHE A 79 2.843 -5.881 -1.328 1.00 0.00 H new ATOM 0 HB3 PHE A 79 3.599 -4.301 -1.372 1.00 0.00 H new ATOM 0 HD1 PHE A 79 0.042 -5.366 -0.858 1.00 0.00 H new ATOM 0 HD2 PHE A 79 3.430 -3.324 0.720 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.281 -4.687 1.095 1.00 0.00 H new ATOM 0 HE2 PHE A 79 2.109 -2.637 2.674 1.00 0.00 H new ATOM 0 HZ PHE A 79 -0.252 -3.317 2.865 1.00 0.00 H new ATOM 1286 N SER A 80 2.784 -4.465 -5.018 1.00 0.00 N ATOM 1287 CA SER A 80 3.702 -4.096 -6.090 1.00 0.00 C ATOM 1288 C SER A 80 3.260 -2.798 -6.753 1.00 0.00 C ATOM 1289 O SER A 80 4.006 -1.818 -6.782 1.00 0.00 O ATOM 1290 CB SER A 80 3.783 -5.214 -7.130 1.00 0.00 C ATOM 1291 OG SER A 80 4.371 -4.751 -8.333 1.00 0.00 O ATOM 0 H SER A 80 1.993 -5.035 -5.317 1.00 0.00 H new ATOM 0 HA SER A 80 4.690 -3.946 -5.656 1.00 0.00 H new ATOM 0 HB2 SER A 80 4.367 -6.043 -6.732 1.00 0.00 H new ATOM 0 HB3 SER A 80 2.783 -5.598 -7.334 1.00 0.00 H new ATOM 0 HG SER A 80 4.412 -5.485 -8.981 1.00 0.00 H new ATOM 1297 N GLN A 81 2.041 -2.795 -7.280 1.00 0.00 N ATOM 1298 CA GLN A 81 1.498 -1.613 -7.937 1.00 0.00 C ATOM 1299 C GLN A 81 1.285 -0.487 -6.930 1.00 0.00 C ATOM 1300 O GLN A 81 1.335 0.691 -7.282 1.00 0.00 O ATOM 1301 CB GLN A 81 0.177 -1.953 -8.632 1.00 0.00 C ATOM 1302 CG GLN A 81 0.279 -3.129 -9.589 1.00 0.00 C ATOM 1303 CD GLN A 81 -1.077 -3.689 -9.972 1.00 0.00 C ATOM 1304 OE1 GLN A 81 -2.010 -3.688 -9.170 1.00 0.00 O ATOM 1305 NE2 GLN A 81 -1.191 -4.172 -11.203 1.00 0.00 N ATOM 0 H GLN A 81 1.411 -3.597 -7.265 1.00 0.00 H new ATOM 0 HA GLN A 81 2.216 -1.277 -8.685 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -0.575 -2.175 -7.875 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -0.171 -1.078 -9.181 1.00 0.00 H new ATOM 0 HG2 GLN A 81 0.806 -2.815 -10.490 1.00 0.00 H new ATOM 0 HG3 GLN A 81 0.876 -3.916 -9.129 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -0.390 -4.152 -11.835 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -2.079 -4.563 -11.517 1.00 0.00 H new ATOM 1314 N LEU A 82 1.052 -0.859 -5.674 1.00 0.00 N ATOM 1315 CA LEU A 82 0.838 0.120 -4.614 1.00 0.00 C ATOM 1316 C LEU A 82 2.046 1.040 -4.476 1.00 0.00 C ATOM 1317 O LEU A 82 1.912 2.211 -4.123 1.00 0.00 O ATOM 1318 CB LEU A 82 0.568 -0.588 -3.284 1.00 0.00 C ATOM 1319 CG LEU A 82 -0.661 -1.499 -3.269 1.00 0.00 C ATOM 1320 CD1 LEU A 82 -0.768 -2.230 -1.939 1.00 0.00 C ATOM 1321 CD2 LEU A 82 -1.923 -0.695 -3.539 1.00 0.00 C ATOM 0 H LEU A 82 1.007 -1.830 -5.366 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.030 0.724 -4.879 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.444 -1.182 -3.022 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.451 0.167 -2.506 1.00 0.00 H new ATOM 0 HG LEU A 82 -0.549 -2.240 -4.060 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -1.648 -2.873 -1.947 1.00 0.00 H new ATOM 0 HD12 LEU A 82 0.124 -2.837 -1.785 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -0.857 -1.504 -1.131 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -2.787 -1.359 -3.525 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -2.039 0.069 -2.770 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -1.848 -0.218 -4.516 1.00 0.00 H new ATOM 1333 N VAL A 83 3.227 0.499 -4.756 1.00 0.00 N ATOM 1334 CA VAL A 83 4.463 1.267 -4.664 1.00 0.00 C ATOM 1335 C VAL A 83 4.602 2.227 -5.842 1.00 0.00 C ATOM 1336 O VAL A 83 4.757 3.434 -5.657 1.00 0.00 O ATOM 1337 CB VAL A 83 5.697 0.347 -4.621 1.00 0.00 C ATOM 1338 CG1 VAL A 83 6.952 1.148 -4.312 1.00 0.00 C ATOM 1339 CG2 VAL A 83 5.499 -0.765 -3.599 1.00 0.00 C ATOM 0 H VAL A 83 3.354 -0.470 -5.049 1.00 0.00 H new ATOM 0 HA VAL A 83 4.411 1.836 -3.736 1.00 0.00 H new ATOM 0 HB VAL A 83 5.820 -0.110 -5.603 1.00 0.00 H new ATOM 0 HG11 VAL A 83 7.813 0.480 -4.286 1.00 0.00 H new ATOM 0 HG12 VAL A 83 7.101 1.903 -5.084 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.843 1.637 -3.344 1.00 0.00 H new ATOM 0 HG21 VAL A 83 6.381 -1.405 -3.582 1.00 0.00 H new ATOM 0 HG22 VAL A 83 5.349 -0.329 -2.611 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.626 -1.358 -3.871 1.00 0.00 H new ATOM 1349 N GLU A 84 4.546 1.682 -7.052 1.00 0.00 N ATOM 1350 CA GLU A 84 4.665 2.489 -8.261 1.00 0.00 C ATOM 1351 C GLU A 84 3.563 3.542 -8.324 1.00 0.00 C ATOM 1352 O GLU A 84 3.799 4.678 -8.737 1.00 0.00 O ATOM 1353 CB GLU A 84 4.607 1.598 -9.502 1.00 0.00 C ATOM 1354 CG GLU A 84 5.698 0.540 -9.543 1.00 0.00 C ATOM 1355 CD GLU A 84 5.499 -0.458 -10.668 1.00 0.00 C ATOM 1356 OE1 GLU A 84 5.760 -0.097 -11.835 1.00 0.00 O ATOM 1357 OE2 GLU A 84 5.085 -1.600 -10.381 1.00 0.00 O ATOM 0 H GLU A 84 4.419 0.684 -7.222 1.00 0.00 H new ATOM 0 HA GLU A 84 5.628 2.999 -8.233 1.00 0.00 H new ATOM 0 HB2 GLU A 84 3.635 1.107 -9.541 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.685 2.223 -10.392 1.00 0.00 H new ATOM 0 HG2 GLU A 84 6.667 1.026 -9.660 1.00 0.00 H new ATOM 0 HG3 GLU A 84 5.721 0.009 -8.591 1.00 0.00 H new ATOM 1364 N GLU A 85 2.360 3.157 -7.913 1.00 0.00 N ATOM 1365 CA GLU A 85 1.221 4.068 -7.923 1.00 0.00 C ATOM 1366 C GLU A 85 1.485 5.279 -7.033 1.00 0.00 C ATOM 1367 O GLU A 85 1.170 6.411 -7.399 1.00 0.00 O ATOM 1368 CB GLU A 85 -0.043 3.344 -7.458 1.00 0.00 C ATOM 1369 CG GLU A 85 -0.823 2.694 -8.588 1.00 0.00 C ATOM 1370 CD GLU A 85 -1.544 1.434 -8.150 1.00 0.00 C ATOM 1371 OE1 GLU A 85 -1.740 1.257 -6.929 1.00 0.00 O ATOM 1372 OE2 GLU A 85 -1.914 0.626 -9.027 1.00 0.00 O ATOM 0 H GLU A 85 2.148 2.221 -7.569 1.00 0.00 H new ATOM 0 HA GLU A 85 1.075 4.416 -8.946 1.00 0.00 H new ATOM 0 HB2 GLU A 85 0.233 2.580 -6.732 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -0.690 4.054 -6.943 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -1.549 3.406 -8.980 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -0.141 2.453 -9.404 1.00 0.00 H new ATOM 1379 N LEU A 86 2.065 5.031 -5.863 1.00 0.00 N ATOM 1380 CA LEU A 86 2.372 6.100 -4.921 1.00 0.00 C ATOM 1381 C LEU A 86 3.306 7.129 -5.551 1.00 0.00 C ATOM 1382 O LEU A 86 3.169 8.330 -5.319 1.00 0.00 O ATOM 1383 CB LEU A 86 3.005 5.524 -3.652 1.00 0.00 C ATOM 1384 CG LEU A 86 2.394 6.019 -2.340 1.00 0.00 C ATOM 1385 CD1 LEU A 86 2.403 7.539 -2.288 1.00 0.00 C ATOM 1386 CD2 LEU A 86 0.978 5.485 -2.178 1.00 0.00 C ATOM 0 H LEU A 86 2.332 4.099 -5.545 1.00 0.00 H new ATOM 0 HA LEU A 86 1.439 6.598 -4.658 1.00 0.00 H new ATOM 0 HB2 LEU A 86 2.924 4.438 -3.685 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.068 5.765 -3.653 1.00 0.00 H new ATOM 0 HG LEU A 86 2.999 5.645 -1.514 1.00 0.00 H new ATOM 0 HD11 LEU A 86 1.965 7.873 -1.348 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.429 7.899 -2.358 1.00 0.00 H new ATOM 0 HD13 LEU A 86 1.821 7.935 -3.121 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.558 5.847 -1.239 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.362 5.830 -3.008 1.00 0.00 H new ATOM 0 HD23 LEU A 86 0.999 4.395 -2.170 1.00 0.00 H new ATOM 1398 N LEU A 87 4.253 6.650 -6.350 1.00 0.00 N ATOM 1399 CA LEU A 87 5.209 7.527 -7.016 1.00 0.00 C ATOM 1400 C LEU A 87 4.491 8.528 -7.916 1.00 0.00 C ATOM 1401 O LEU A 87 4.834 9.710 -7.943 1.00 0.00 O ATOM 1402 CB LEU A 87 6.203 6.704 -7.837 1.00 0.00 C ATOM 1403 CG LEU A 87 7.481 6.305 -7.097 1.00 0.00 C ATOM 1404 CD1 LEU A 87 8.342 7.527 -6.823 1.00 0.00 C ATOM 1405 CD2 LEU A 87 7.142 5.585 -5.801 1.00 0.00 C ATOM 0 H LEU A 87 4.379 5.658 -6.552 1.00 0.00 H new ATOM 0 HA LEU A 87 5.753 8.079 -6.250 1.00 0.00 H new ATOM 0 HB2 LEU A 87 5.704 5.799 -8.182 1.00 0.00 H new ATOM 0 HB3 LEU A 87 6.478 7.274 -8.724 1.00 0.00 H new ATOM 0 HG LEU A 87 8.048 5.623 -7.730 1.00 0.00 H new ATOM 0 HD11 LEU A 87 9.247 7.224 -6.296 1.00 0.00 H new ATOM 0 HD12 LEU A 87 8.613 8.000 -7.767 1.00 0.00 H new ATOM 0 HD13 LEU A 87 7.785 8.235 -6.209 1.00 0.00 H new ATOM 0 HD21 LEU A 87 8.063 5.308 -5.287 1.00 0.00 H new ATOM 0 HD22 LEU A 87 6.554 6.244 -5.162 1.00 0.00 H new ATOM 0 HD23 LEU A 87 6.567 4.687 -6.024 1.00 0.00 H new ATOM 1417 N LYS A 88 3.494 8.047 -8.650 1.00 0.00 N ATOM 1418 CA LYS A 88 2.727 8.899 -9.551 1.00 0.00 C ATOM 1419 C LYS A 88 1.922 9.932 -8.767 1.00 0.00 C ATOM 1420 O LYS A 88 1.697 11.046 -9.239 1.00 0.00 O ATOM 1421 CB LYS A 88 1.790 8.053 -10.415 1.00 0.00 C ATOM 1422 CG LYS A 88 2.446 7.513 -11.674 1.00 0.00 C ATOM 1423 CD LYS A 88 2.150 8.392 -12.878 1.00 0.00 C ATOM 1424 CE LYS A 88 0.870 7.964 -13.579 1.00 0.00 C ATOM 1425 NZ LYS A 88 0.873 8.341 -15.020 1.00 0.00 N ATOM 0 H LYS A 88 3.198 7.071 -8.639 1.00 0.00 H new ATOM 0 HA LYS A 88 3.428 9.425 -10.199 1.00 0.00 H new ATOM 0 HB2 LYS A 88 1.418 7.217 -9.822 1.00 0.00 H new ATOM 0 HB3 LYS A 88 0.925 8.655 -10.695 1.00 0.00 H new ATOM 0 HG2 LYS A 88 3.524 7.449 -11.525 1.00 0.00 H new ATOM 0 HG3 LYS A 88 2.090 6.501 -11.865 1.00 0.00 H new ATOM 0 HD2 LYS A 88 2.062 9.430 -12.559 1.00 0.00 H new ATOM 0 HD3 LYS A 88 2.983 8.344 -13.579 1.00 0.00 H new ATOM 0 HE2 LYS A 88 0.749 6.885 -13.486 1.00 0.00 H new ATOM 0 HE3 LYS A 88 0.014 8.424 -13.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -0.016 8.032 -15.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 0.963 9.373 -15.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 1.675 7.881 -15.497 1.00 0.00 H new ATOM 1439 N ILE A 89 1.494 9.553 -7.568 1.00 0.00 N ATOM 1440 CA ILE A 89 0.715 10.445 -6.718 1.00 0.00 C ATOM 1441 C ILE A 89 1.601 11.521 -6.096 1.00 0.00 C ATOM 1442 O ILE A 89 1.157 12.645 -5.861 1.00 0.00 O ATOM 1443 CB ILE A 89 -0.001 9.669 -5.595 1.00 0.00 C ATOM 1444 CG1 ILE A 89 -0.790 8.495 -6.178 1.00 0.00 C ATOM 1445 CG2 ILE A 89 -0.921 10.595 -4.813 1.00 0.00 C ATOM 1446 CD1 ILE A 89 -1.005 7.364 -5.195 1.00 0.00 C ATOM 0 H ILE A 89 1.673 8.634 -7.163 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.033 10.917 -7.354 1.00 0.00 H new ATOM 0 HB ILE A 89 0.751 9.274 -4.912 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -1.759 8.855 -6.523 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -0.263 8.111 -7.051 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -1.419 10.032 -4.024 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -0.335 11.400 -4.370 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.669 11.017 -5.485 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -1.571 6.566 -5.676 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -0.040 6.978 -4.868 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -1.559 7.733 -4.332 1.00 0.00 H new ATOM 1458 N ILE A 90 2.856 11.169 -5.835 1.00 0.00 N ATOM 1459 CA ILE A 90 3.804 12.105 -5.241 1.00 0.00 C ATOM 1460 C ILE A 90 4.357 13.063 -6.292 1.00 0.00 C ATOM 1461 O ILE A 90 4.399 14.275 -6.079 1.00 0.00 O ATOM 1462 CB ILE A 90 4.977 11.367 -4.567 1.00 0.00 C ATOM 1463 CG1 ILE A 90 4.456 10.295 -3.609 1.00 0.00 C ATOM 1464 CG2 ILE A 90 5.871 12.353 -3.830 1.00 0.00 C ATOM 1465 CD1 ILE A 90 5.281 9.026 -3.615 1.00 0.00 C ATOM 0 H ILE A 90 3.240 10.243 -6.025 1.00 0.00 H new ATOM 0 HA ILE A 90 3.260 12.671 -4.485 1.00 0.00 H new ATOM 0 HB ILE A 90 5.568 10.877 -5.341 1.00 0.00 H new ATOM 0 HG12 ILE A 90 4.437 10.701 -2.598 1.00 0.00 H new ATOM 0 HG13 ILE A 90 3.427 10.051 -3.874 1.00 0.00 H new ATOM 0 HG21 ILE A 90 6.695 11.816 -3.359 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.269 13.081 -4.536 1.00 0.00 H new ATOM 0 HG23 ILE A 90 5.291 12.869 -3.065 1.00 0.00 H new ATOM 0 HD11 ILE A 90 4.853 8.311 -2.912 1.00 0.00 H new ATOM 0 HD12 ILE A 90 5.280 8.596 -4.617 1.00 0.00 H new ATOM 0 HD13 ILE A 90 6.305 9.256 -3.320 1.00 0.00 H new ATOM 1477 N CYS A 91 4.779 12.512 -7.425 1.00 0.00 N ATOM 1478 CA CYS A 91 5.329 13.318 -8.509 1.00 0.00 C ATOM 1479 C CYS A 91 4.309 14.339 -9.001 1.00 0.00 C ATOM 1480 O CYS A 91 4.633 15.511 -9.192 1.00 0.00 O ATOM 1481 CB CYS A 91 5.769 12.419 -9.666 1.00 0.00 C ATOM 1482 SG CYS A 91 7.457 11.789 -9.512 1.00 0.00 S ATOM 0 H CYS A 91 4.751 11.511 -7.617 1.00 0.00 H new ATOM 0 HA CYS A 91 6.196 13.856 -8.125 1.00 0.00 H new ATOM 0 HB2 CYS A 91 5.083 11.575 -9.737 1.00 0.00 H new ATOM 0 HB3 CYS A 91 5.685 12.978 -10.598 1.00 0.00 H new ATOM 0 HG CYS A 91 7.735 11.038 -10.536 1.00 0.00 H new ATOM 1488 N ALA A 92 3.077 13.886 -9.205 1.00 0.00 N ATOM 1489 CA ALA A 92 2.010 14.761 -9.674 1.00 0.00 C ATOM 1490 C ALA A 92 1.776 15.913 -8.704 1.00 0.00 C ATOM 1491 O ALA A 92 1.617 17.062 -9.114 1.00 0.00 O ATOM 1492 CB ALA A 92 0.727 13.968 -9.875 1.00 0.00 C ATOM 0 H ALA A 92 2.793 12.918 -9.053 1.00 0.00 H new ATOM 0 HA ALA A 92 2.316 15.184 -10.631 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -0.061 14.634 -10.225 1.00 0.00 H new ATOM 0 HB2 ALA A 92 0.895 13.185 -10.614 1.00 0.00 H new ATOM 0 HB3 ALA A 92 0.427 13.516 -8.930 1.00 0.00 H new ATOM 1498 N PHE A 93 1.757 15.596 -7.412 1.00 0.00 N ATOM 1499 CA PHE A 93 1.542 16.606 -6.380 1.00 0.00 C ATOM 1500 C PHE A 93 2.574 17.725 -6.486 1.00 0.00 C ATOM 1501 O PHE A 93 2.294 18.875 -6.151 1.00 0.00 O ATOM 1502 CB PHE A 93 1.608 15.967 -4.991 1.00 0.00 C ATOM 1503 CG PHE A 93 0.902 16.764 -3.932 1.00 0.00 C ATOM 1504 CD1 PHE A 93 -0.482 16.765 -3.853 1.00 0.00 C ATOM 1505 CD2 PHE A 93 1.623 17.510 -3.012 1.00 0.00 C ATOM 1506 CE1 PHE A 93 -1.133 17.497 -2.879 1.00 0.00 C ATOM 1507 CE2 PHE A 93 0.977 18.243 -2.036 1.00 0.00 C ATOM 1508 CZ PHE A 93 -0.403 18.237 -1.969 1.00 0.00 C ATOM 0 H PHE A 93 1.888 14.649 -7.055 1.00 0.00 H new ATOM 0 HA PHE A 93 0.552 17.036 -6.530 1.00 0.00 H new ATOM 0 HB2 PHE A 93 1.170 14.970 -5.037 1.00 0.00 H new ATOM 0 HB3 PHE A 93 2.653 15.843 -4.706 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -1.058 16.187 -4.561 1.00 0.00 H new ATOM 0 HD2 PHE A 93 2.702 17.518 -3.059 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -2.212 17.491 -2.829 1.00 0.00 H new ATOM 0 HE2 PHE A 93 1.550 18.820 -1.326 1.00 0.00 H new ATOM 0 HZ PHE A 93 -0.910 18.810 -1.207 1.00 0.00 H new ATOM 1518 N GLN A 94 3.768 17.379 -6.955 1.00 0.00 N ATOM 1519 CA GLN A 94 4.842 18.354 -7.105 1.00 0.00 C ATOM 1520 C GLN A 94 4.624 19.216 -8.345 1.00 0.00 C ATOM 1521 O GLN A 94 5.014 20.383 -8.379 1.00 0.00 O ATOM 1522 CB GLN A 94 6.195 17.645 -7.194 1.00 0.00 C ATOM 1523 CG GLN A 94 6.868 17.447 -5.845 1.00 0.00 C ATOM 1524 CD GLN A 94 6.004 16.670 -4.872 1.00 0.00 C ATOM 1525 OE1 GLN A 94 6.139 15.453 -4.740 1.00 0.00 O ATOM 1526 NE2 GLN A 94 5.109 17.369 -4.184 1.00 0.00 N ATOM 0 H GLN A 94 4.016 16.431 -7.238 1.00 0.00 H new ATOM 0 HA GLN A 94 4.836 19.001 -6.228 1.00 0.00 H new ATOM 0 HB2 GLN A 94 6.056 16.673 -7.668 1.00 0.00 H new ATOM 0 HB3 GLN A 94 6.857 18.222 -7.840 1.00 0.00 H new ATOM 0 HG2 GLN A 94 7.812 16.921 -5.988 1.00 0.00 H new ATOM 0 HG3 GLN A 94 7.107 18.420 -5.416 1.00 0.00 H new ATOM 0 HE21 GLN A 94 5.031 18.376 -4.325 1.00 0.00 H new ATOM 0 HE22 GLN A 94 4.500 16.899 -3.515 1.00 0.00 H new ATOM 1535 N LEU A 95 3.997 18.634 -9.361 1.00 0.00 N ATOM 1536 CA LEU A 95 3.726 19.348 -10.603 1.00 0.00 C ATOM 1537 C LEU A 95 2.803 20.537 -10.358 1.00 0.00 C ATOM 1538 O LEU A 95 2.910 21.567 -11.024 1.00 0.00 O ATOM 1539 CB LEU A 95 3.101 18.406 -11.633 1.00 0.00 C ATOM 1540 CG LEU A 95 3.494 18.680 -13.086 1.00 0.00 C ATOM 1541 CD1 LEU A 95 4.969 18.382 -13.305 1.00 0.00 C ATOM 1542 CD2 LEU A 95 2.636 17.856 -14.034 1.00 0.00 C ATOM 0 H LEU A 95 3.667 17.669 -9.349 1.00 0.00 H new ATOM 0 HA LEU A 95 4.674 19.721 -10.991 1.00 0.00 H new ATOM 0 HB2 LEU A 95 3.382 17.383 -11.384 1.00 0.00 H new ATOM 0 HB3 LEU A 95 2.016 18.469 -11.548 1.00 0.00 H new ATOM 0 HG LEU A 95 3.322 19.736 -13.296 1.00 0.00 H new ATOM 0 HD11 LEU A 95 5.230 18.583 -14.344 1.00 0.00 H new ATOM 0 HD12 LEU A 95 5.569 19.015 -12.651 1.00 0.00 H new ATOM 0 HD13 LEU A 95 5.166 17.335 -13.077 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.929 18.063 -15.063 1.00 0.00 H new ATOM 0 HD22 LEU A 95 2.776 16.796 -13.823 1.00 0.00 H new ATOM 0 HD23 LEU A 95 1.587 18.118 -13.896 1.00 0.00 H new ATOM 1554 N ASP A 96 1.895 20.387 -9.398 1.00 0.00 N ATOM 1555 CA ASP A 96 0.953 21.448 -9.065 1.00 0.00 C ATOM 1556 C ASP A 96 1.446 22.261 -7.872 1.00 0.00 C ATOM 1557 O ASP A 96 1.859 23.411 -8.020 1.00 0.00 O ATOM 1558 CB ASP A 96 -0.425 20.859 -8.762 1.00 0.00 C ATOM 1559 CG ASP A 96 -1.171 20.453 -10.018 1.00 0.00 C ATOM 1560 OD1 ASP A 96 -0.551 19.822 -10.899 1.00 0.00 O ATOM 1561 OD2 ASP A 96 -2.376 20.768 -10.120 1.00 0.00 O ATOM 0 H ASP A 96 1.792 19.541 -8.838 1.00 0.00 H new ATOM 0 HA ASP A 96 0.875 22.112 -9.926 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -0.311 19.990 -8.114 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -1.017 21.591 -8.212 1.00 0.00 H new ATOM 1566 N THR A 97 1.398 21.654 -6.690 1.00 0.00 N ATOM 1567 CA THR A 97 1.840 22.321 -5.471 1.00 0.00 C ATOM 1568 C THR A 97 3.307 22.728 -5.573 1.00 0.00 C ATOM 1569 O THR A 97 3.647 23.902 -5.431 1.00 0.00 O ATOM 1570 CB THR A 97 1.635 21.409 -4.261 1.00 0.00 C ATOM 1571 OG1 THR A 97 2.634 20.406 -4.215 1.00 0.00 O ATOM 1572 CG2 THR A 97 0.289 20.717 -4.252 1.00 0.00 C ATOM 0 H THR A 97 1.058 20.703 -6.551 1.00 0.00 H new ATOM 0 HA THR A 97 1.240 23.222 -5.343 1.00 0.00 H new ATOM 0 HB THR A 97 1.693 22.065 -3.393 1.00 0.00 H new ATOM 0 HG1 THR A 97 2.327 19.616 -4.707 1.00 0.00 H new ATOM 0 HG21 THR A 97 0.210 20.086 -3.367 1.00 0.00 H new ATOM 0 HG22 THR A 97 -0.504 21.464 -4.237 1.00 0.00 H new ATOM 0 HG23 THR A 97 0.190 20.102 -5.146 1.00 0.00 H new ATOM 1580 N GLY A 98 4.171 21.748 -5.818 1.00 0.00 N ATOM 1581 CA GLY A 98 5.591 22.024 -5.935 1.00 0.00 C ATOM 1582 C GLY A 98 6.308 21.954 -4.601 1.00 0.00 C ATOM 1583 O GLY A 98 7.328 22.613 -4.402 1.00 0.00 O ATOM 0 H GLY A 98 3.913 20.768 -5.938 1.00 0.00 H new ATOM 0 HA2 GLY A 98 6.041 21.309 -6.624 1.00 0.00 H new ATOM 0 HA3 GLY A 98 5.731 23.015 -6.367 1.00 0.00 H new ATOM 1587 N LEU A 99 5.773 21.153 -3.684 1.00 0.00 N ATOM 1588 CA LEU A 99 6.370 21.000 -2.362 1.00 0.00 C ATOM 1589 C LEU A 99 7.346 19.829 -2.339 1.00 0.00 C ATOM 1590 O LEU A 99 7.343 18.987 -3.236 1.00 0.00 O ATOM 1591 CB LEU A 99 5.280 20.794 -1.309 1.00 0.00 C ATOM 1592 CG LEU A 99 4.519 22.058 -0.907 1.00 0.00 C ATOM 1593 CD1 LEU A 99 3.818 22.664 -2.112 1.00 0.00 C ATOM 1594 CD2 LEU A 99 3.518 21.748 0.196 1.00 0.00 C ATOM 0 H LEU A 99 4.928 20.601 -3.832 1.00 0.00 H new ATOM 0 HA LEU A 99 6.921 21.912 -2.130 1.00 0.00 H new ATOM 0 HB2 LEU A 99 4.565 20.063 -1.687 1.00 0.00 H new ATOM 0 HB3 LEU A 99 5.735 20.363 -0.417 1.00 0.00 H new ATOM 0 HG LEU A 99 5.235 22.786 -0.526 1.00 0.00 H new ATOM 0 HD11 LEU A 99 3.282 23.563 -1.807 1.00 0.00 H new ATOM 0 HD12 LEU A 99 4.557 22.922 -2.871 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.112 21.942 -2.523 1.00 0.00 H new ATOM 0 HD21 LEU A 99 2.985 22.658 0.470 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.805 21.003 -0.158 1.00 0.00 H new ATOM 0 HD23 LEU A 99 4.045 21.360 1.067 1.00 0.00 H new ATOM 1606 N GLU A 100 8.180 19.782 -1.304 1.00 0.00 N ATOM 1607 CA GLU A 100 9.162 18.714 -1.163 1.00 0.00 C ATOM 1608 C GLU A 100 8.509 17.440 -0.638 1.00 0.00 C ATOM 1609 O GLU A 100 7.498 17.491 0.062 1.00 0.00 O ATOM 1610 CB GLU A 100 10.288 19.148 -0.222 1.00 0.00 C ATOM 1611 CG GLU A 100 10.946 20.458 -0.625 1.00 0.00 C ATOM 1612 CD GLU A 100 12.257 20.249 -1.358 1.00 0.00 C ATOM 1613 OE1 GLU A 100 12.984 19.293 -1.014 1.00 0.00 O ATOM 1614 OE2 GLU A 100 12.557 21.043 -2.275 1.00 0.00 O ATOM 0 H GLU A 100 8.195 20.471 -0.552 1.00 0.00 H new ATOM 0 HA GLU A 100 9.580 18.508 -2.148 1.00 0.00 H new ATOM 0 HB2 GLU A 100 9.889 19.247 0.787 1.00 0.00 H new ATOM 0 HB3 GLU A 100 11.046 18.365 -0.190 1.00 0.00 H new ATOM 0 HG2 GLU A 100 10.264 21.023 -1.261 1.00 0.00 H new ATOM 0 HG3 GLU A 100 11.124 21.061 0.266 1.00 0.00 H new ATOM 1621 N TYR A 101 9.093 16.296 -0.983 1.00 0.00 N ATOM 1622 CA TYR A 101 8.569 15.007 -0.547 1.00 0.00 C ATOM 1623 C TYR A 101 9.507 14.351 0.460 1.00 0.00 C ATOM 1624 O TYR A 101 10.715 14.584 0.442 1.00 0.00 O ATOM 1625 CB TYR A 101 8.364 14.083 -1.749 1.00 0.00 C ATOM 1626 CG TYR A 101 7.765 12.743 -1.387 1.00 0.00 C ATOM 1627 CD1 TYR A 101 6.522 12.660 -0.772 1.00 0.00 C ATOM 1628 CD2 TYR A 101 8.441 11.561 -1.663 1.00 0.00 C ATOM 1629 CE1 TYR A 101 5.970 11.437 -0.441 1.00 0.00 C ATOM 1630 CE2 TYR A 101 7.895 10.334 -1.335 1.00 0.00 C ATOM 1631 CZ TYR A 101 6.661 10.277 -0.725 1.00 0.00 C ATOM 1632 OH TYR A 101 6.115 9.058 -0.396 1.00 0.00 O ATOM 0 H TYR A 101 9.930 16.236 -1.563 1.00 0.00 H new ATOM 0 HA TYR A 101 7.608 15.179 -0.062 1.00 0.00 H new ATOM 0 HB2 TYR A 101 7.715 14.579 -2.471 1.00 0.00 H new ATOM 0 HB3 TYR A 101 9.323 13.922 -2.241 1.00 0.00 H new ATOM 0 HD1 TYR A 101 5.978 13.566 -0.549 1.00 0.00 H new ATOM 0 HD2 TYR A 101 9.408 11.601 -2.141 1.00 0.00 H new ATOM 0 HE1 TYR A 101 5.003 11.390 0.037 1.00 0.00 H new ATOM 0 HE2 TYR A 101 8.433 9.424 -1.556 1.00 0.00 H new ATOM 0 HH TYR A 101 5.301 8.912 -0.921 1.00 0.00 H new ATOM 1642 N ALA A 102 8.942 13.528 1.339 1.00 0.00 N ATOM 1643 CA ALA A 102 9.728 12.837 2.354 1.00 0.00 C ATOM 1644 C ALA A 102 10.433 13.830 3.271 1.00 0.00 C ATOM 1645 O ALA A 102 11.403 14.475 2.875 1.00 0.00 O ATOM 1646 CB ALA A 102 10.741 11.911 1.697 1.00 0.00 C ATOM 0 H ALA A 102 7.943 13.324 1.368 1.00 0.00 H new ATOM 0 HA ALA A 102 9.048 12.240 2.962 1.00 0.00 H new ATOM 0 HB1 ALA A 102 11.321 11.402 2.467 1.00 0.00 H new ATOM 0 HB2 ALA A 102 10.218 11.173 1.088 1.00 0.00 H new ATOM 0 HB3 ALA A 102 11.410 12.494 1.065 1.00 0.00 H new ATOM 1652 N ASN A 103 9.940 13.947 4.500 1.00 0.00 N ATOM 1653 CA ASN A 103 10.524 14.861 5.474 1.00 0.00 C ATOM 1654 C ASN A 103 10.467 16.300 4.973 1.00 0.00 C ATOM 1655 O ASN A 103 11.305 16.661 4.120 1.00 0.00 O ATOM 1656 CB ASN A 103 11.972 14.468 5.770 1.00 0.00 C ATOM 1657 CG ASN A 103 12.343 14.680 7.225 1.00 0.00 C ATOM 1658 OD1 ASN A 103 11.484 14.664 8.106 1.00 0.00 O ATOM 1659 ND2 ASN A 103 13.631 14.880 7.484 1.00 0.00 N ATOM 0 H ASN A 103 9.137 13.420 4.845 1.00 0.00 H new ATOM 0 HA ASN A 103 9.942 14.793 6.393 1.00 0.00 H new ATOM 0 HB2 ASN A 103 12.122 13.420 5.509 1.00 0.00 H new ATOM 0 HB3 ASN A 103 12.641 15.053 5.138 1.00 0.00 H new ATOM 0 HD21 ASN A 103 13.941 15.028 8.444 1.00 0.00 H new ATOM 0 HD22 ASN A 103 14.310 14.885 6.722 1.00 0.00 H new TER 1666 ASN A 103 ATOM 1667 N MET B 26 -11.959 34.406 -10.196 1.00 0.00 N ATOM 1668 CA MET B 26 -13.033 35.374 -10.542 1.00 0.00 C ATOM 1669 C MET B 26 -13.478 35.208 -11.992 1.00 0.00 C ATOM 1670 O MET B 26 -14.667 35.289 -12.299 1.00 0.00 O ATOM 1671 CB MET B 26 -12.505 36.791 -10.310 1.00 0.00 C ATOM 1672 CG MET B 26 -13.601 37.818 -10.079 1.00 0.00 C ATOM 1673 SD MET B 26 -12.997 39.305 -9.258 1.00 0.00 S ATOM 1674 CE MET B 26 -12.598 40.332 -10.669 1.00 0.00 C ATOM 0 HA MET B 26 -13.901 35.188 -9.909 1.00 0.00 H new ATOM 0 HB2 MET B 26 -11.837 36.784 -9.449 1.00 0.00 H new ATOM 0 HB3 MET B 26 -11.910 37.094 -11.172 1.00 0.00 H new ATOM 0 HG2 MET B 26 -14.045 38.091 -11.036 1.00 0.00 H new ATOM 0 HG3 MET B 26 -14.392 37.371 -9.477 1.00 0.00 H new ATOM 0 HE1 MET B 26 -12.210 41.290 -10.323 1.00 0.00 H new ATOM 0 HE2 MET B 26 -11.844 39.835 -11.280 1.00 0.00 H new ATOM 0 HE3 MET B 26 -13.496 40.497 -11.264 1.00 0.00 H new ATOM 1686 N GLU B 27 -12.515 34.976 -12.878 1.00 0.00 N ATOM 1687 CA GLU B 27 -12.808 34.799 -14.296 1.00 0.00 C ATOM 1688 C GLU B 27 -12.460 33.383 -14.751 1.00 0.00 C ATOM 1689 O GLU B 27 -11.370 33.139 -15.269 1.00 0.00 O ATOM 1690 CB GLU B 27 -12.031 35.820 -15.130 1.00 0.00 C ATOM 1691 CG GLU B 27 -10.573 35.955 -14.721 1.00 0.00 C ATOM 1692 CD GLU B 27 -9.788 36.855 -15.655 1.00 0.00 C ATOM 1693 OE1 GLU B 27 -10.305 37.934 -16.015 1.00 0.00 O ATOM 1694 OE2 GLU B 27 -8.655 36.481 -16.028 1.00 0.00 O ATOM 0 H GLU B 27 -11.526 34.906 -12.640 1.00 0.00 H new ATOM 0 HA GLU B 27 -13.876 34.957 -14.443 1.00 0.00 H new ATOM 0 HB2 GLU B 27 -12.080 35.532 -16.180 1.00 0.00 H new ATOM 0 HB3 GLU B 27 -12.516 36.792 -15.043 1.00 0.00 H new ATOM 0 HG2 GLU B 27 -10.519 36.353 -13.708 1.00 0.00 H new ATOM 0 HG3 GLU B 27 -10.112 34.968 -14.701 1.00 0.00 H new ATOM 1701 N PRO B 28 -13.387 32.428 -14.562 1.00 0.00 N ATOM 1702 CA PRO B 28 -13.173 31.031 -14.955 1.00 0.00 C ATOM 1703 C PRO B 28 -12.730 30.901 -16.408 1.00 0.00 C ATOM 1704 O PRO B 28 -13.558 30.779 -17.311 1.00 0.00 O ATOM 1705 CB PRO B 28 -14.548 30.389 -14.755 1.00 0.00 C ATOM 1706 CG PRO B 28 -15.213 31.234 -13.724 1.00 0.00 C ATOM 1707 CD PRO B 28 -14.712 32.633 -13.949 1.00 0.00 C ATOM 0 HA PRO B 28 -12.381 30.561 -14.372 1.00 0.00 H new ATOM 0 HB2 PRO B 28 -15.118 30.376 -15.684 1.00 0.00 H new ATOM 0 HB3 PRO B 28 -14.458 29.355 -14.422 1.00 0.00 H new ATOM 0 HG2 PRO B 28 -16.298 31.188 -13.822 1.00 0.00 H new ATOM 0 HG3 PRO B 28 -14.968 30.889 -12.719 1.00 0.00 H new ATOM 0 HD2 PRO B 28 -15.375 33.196 -14.605 1.00 0.00 H new ATOM 0 HD3 PRO B 28 -14.640 33.189 -13.014 1.00 0.00 H new ATOM 1715 N ASP B 29 -11.420 30.927 -16.628 1.00 0.00 N ATOM 1716 CA ASP B 29 -10.868 30.811 -17.973 1.00 0.00 C ATOM 1717 C ASP B 29 -10.244 29.436 -18.188 1.00 0.00 C ATOM 1718 O ASP B 29 -10.242 28.911 -19.302 1.00 0.00 O ATOM 1719 CB ASP B 29 -9.821 31.902 -18.211 1.00 0.00 C ATOM 1720 CG ASP B 29 -9.600 32.176 -19.686 1.00 0.00 C ATOM 1721 OD1 ASP B 29 -10.584 32.499 -20.385 1.00 0.00 O ATOM 1722 OD2 ASP B 29 -8.442 32.068 -20.143 1.00 0.00 O ATOM 0 H ASP B 29 -10.721 31.027 -15.892 1.00 0.00 H new ATOM 0 HA ASP B 29 -11.683 30.936 -18.686 1.00 0.00 H new ATOM 0 HB2 ASP B 29 -10.138 32.820 -17.717 1.00 0.00 H new ATOM 0 HB3 ASP B 29 -8.878 31.603 -17.754 1.00 0.00 H new ATOM 1727 N GLY B 30 -9.715 28.857 -17.115 1.00 0.00 N ATOM 1728 CA GLY B 30 -9.095 27.548 -17.208 1.00 0.00 C ATOM 1729 C GLY B 30 -8.235 27.227 -16.003 1.00 0.00 C ATOM 1730 O GLY B 30 -7.090 26.797 -16.145 1.00 0.00 O ATOM 0 H GLY B 30 -9.705 29.271 -16.183 1.00 0.00 H new ATOM 0 HA2 GLY B 30 -9.870 26.789 -17.310 1.00 0.00 H new ATOM 0 HA3 GLY B 30 -8.484 27.502 -18.109 1.00 0.00 H new ATOM 1734 N ARG B 31 -8.786 27.436 -14.811 1.00 0.00 N ATOM 1735 CA ARG B 31 -8.062 27.166 -13.575 1.00 0.00 C ATOM 1736 C ARG B 31 -8.589 25.904 -12.900 1.00 0.00 C ATOM 1737 O ARG B 31 -9.745 25.847 -12.483 1.00 0.00 O ATOM 1738 CB ARG B 31 -8.178 28.355 -12.620 1.00 0.00 C ATOM 1739 CG ARG B 31 -7.200 28.302 -11.459 1.00 0.00 C ATOM 1740 CD ARG B 31 -5.827 28.818 -11.862 1.00 0.00 C ATOM 1741 NE ARG B 31 -5.820 30.267 -12.046 1.00 0.00 N ATOM 1742 CZ ARG B 31 -4.712 30.991 -12.188 1.00 0.00 C ATOM 1743 NH1 ARG B 31 -3.521 30.404 -12.170 1.00 0.00 N ATOM 1744 NH2 ARG B 31 -4.794 32.304 -12.351 1.00 0.00 N ATOM 0 H ARG B 31 -9.732 27.792 -14.676 1.00 0.00 H new ATOM 0 HA ARG B 31 -7.012 27.011 -13.825 1.00 0.00 H new ATOM 0 HB2 ARG B 31 -8.015 29.276 -13.179 1.00 0.00 H new ATOM 0 HB3 ARG B 31 -9.194 28.396 -12.227 1.00 0.00 H new ATOM 0 HG2 ARG B 31 -7.585 28.897 -10.631 1.00 0.00 H new ATOM 0 HG3 ARG B 31 -7.114 27.276 -11.101 1.00 0.00 H new ATOM 0 HD2 ARG B 31 -5.099 28.546 -11.098 1.00 0.00 H new ATOM 0 HD3 ARG B 31 -5.515 28.333 -12.787 1.00 0.00 H new ATOM 0 HE ARG B 31 -6.717 30.753 -12.067 1.00 0.00 H new ATOM 0 HH11 ARG B 31 -3.452 29.394 -12.047 1.00 0.00 H new ATOM 0 HH12 ARG B 31 -2.675 30.963 -12.279 1.00 0.00 H new ATOM 0 HH21 ARG B 31 -5.706 32.760 -12.368 1.00 0.00 H new ATOM 0 HH22 ARG B 31 -3.945 32.858 -12.460 1.00 0.00 H new ATOM 1758 N GLY B 32 -7.731 24.893 -12.795 1.00 0.00 N ATOM 1759 CA GLY B 32 -8.129 23.646 -12.169 1.00 0.00 C ATOM 1760 C GLY B 32 -7.106 23.148 -11.167 1.00 0.00 C ATOM 1761 O GLY B 32 -5.902 23.204 -11.419 1.00 0.00 O ATOM 0 H GLY B 32 -6.769 24.916 -13.132 1.00 0.00 H new ATOM 0 HA2 GLY B 32 -9.087 23.784 -11.667 1.00 0.00 H new ATOM 0 HA3 GLY B 32 -8.278 22.888 -12.938 1.00 0.00 H new ATOM 1765 N ALA B 33 -7.584 22.660 -10.028 1.00 0.00 N ATOM 1766 CA ALA B 33 -6.703 22.151 -8.984 1.00 0.00 C ATOM 1767 C ALA B 33 -7.177 20.793 -8.478 1.00 0.00 C ATOM 1768 O ALA B 33 -8.350 20.445 -8.613 1.00 0.00 O ATOM 1769 CB ALA B 33 -6.616 23.145 -7.836 1.00 0.00 C ATOM 0 H ALA B 33 -8.578 22.606 -9.804 1.00 0.00 H new ATOM 0 HA ALA B 33 -5.709 22.021 -9.413 1.00 0.00 H new ATOM 0 HB1 ALA B 33 -5.955 22.752 -7.064 1.00 0.00 H new ATOM 0 HB2 ALA B 33 -6.221 24.092 -8.204 1.00 0.00 H new ATOM 0 HB3 ALA B 33 -7.609 23.304 -7.417 1.00 0.00 H new ATOM 1775 N TRP B 34 -6.258 20.030 -7.895 1.00 0.00 N ATOM 1776 CA TRP B 34 -6.582 18.710 -7.366 1.00 0.00 C ATOM 1777 C TRP B 34 -7.103 17.796 -8.471 1.00 0.00 C ATOM 1778 O TRP B 34 -7.922 16.911 -8.223 1.00 0.00 O ATOM 1779 CB TRP B 34 -7.622 18.824 -6.250 1.00 0.00 C ATOM 1780 CG TRP B 34 -7.349 19.941 -5.291 1.00 0.00 C ATOM 1781 CD1 TRP B 34 -8.227 20.905 -4.883 1.00 0.00 C ATOM 1782 CD2 TRP B 34 -6.114 20.213 -4.619 1.00 0.00 C ATOM 1783 NE1 TRP B 34 -7.612 21.759 -3.999 1.00 0.00 N ATOM 1784 CE2 TRP B 34 -6.315 21.355 -3.820 1.00 0.00 C ATOM 1785 CE3 TRP B 34 -4.857 19.601 -4.614 1.00 0.00 C ATOM 1786 CZ2 TRP B 34 -5.307 21.897 -3.027 1.00 0.00 C ATOM 1787 CZ3 TRP B 34 -3.856 20.141 -3.826 1.00 0.00 C ATOM 1788 CH2 TRP B 34 -4.087 21.277 -3.042 1.00 0.00 C ATOM 0 H TRP B 34 -5.282 20.303 -7.777 1.00 0.00 H new ATOM 0 HA TRP B 34 -5.669 18.276 -6.958 1.00 0.00 H new ATOM 0 HB2 TRP B 34 -8.606 18.970 -6.695 1.00 0.00 H new ATOM 0 HB3 TRP B 34 -7.657 17.884 -5.700 1.00 0.00 H new ATOM 0 HD1 TRP B 34 -9.254 20.984 -5.208 1.00 0.00 H new ATOM 0 HE1 TRP B 34 -8.050 22.563 -3.549 1.00 0.00 H new ATOM 0 HE3 TRP B 34 -4.671 18.723 -5.214 1.00 0.00 H new ATOM 0 HZ2 TRP B 34 -5.482 22.775 -2.422 1.00 0.00 H new ATOM 0 HZ3 TRP B 34 -2.880 19.678 -3.816 1.00 0.00 H new ATOM 0 HH2 TRP B 34 -3.285 21.673 -2.436 1.00 0.00 H new ATOM 1799 N ALA B 35 -6.625 18.017 -9.690 1.00 0.00 N ATOM 1800 CA ALA B 35 -7.043 17.213 -10.832 1.00 0.00 C ATOM 1801 C ALA B 35 -6.229 15.926 -10.925 1.00 0.00 C ATOM 1802 O ALA B 35 -6.776 14.827 -10.830 1.00 0.00 O ATOM 1803 CB ALA B 35 -6.911 18.016 -12.118 1.00 0.00 C ATOM 0 H ALA B 35 -5.948 18.746 -9.913 1.00 0.00 H new ATOM 0 HA ALA B 35 -8.089 16.941 -10.691 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -7.226 17.404 -12.963 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -7.540 18.904 -12.059 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -5.872 18.316 -12.255 1.00 0.00 H new ATOM 1809 N HIS B 36 -4.922 16.070 -11.111 1.00 0.00 N ATOM 1810 CA HIS B 36 -4.034 14.919 -11.216 1.00 0.00 C ATOM 1811 C HIS B 36 -4.084 14.074 -9.948 1.00 0.00 C ATOM 1812 O HIS B 36 -3.902 12.857 -9.993 1.00 0.00 O ATOM 1813 CB HIS B 36 -2.598 15.378 -11.481 1.00 0.00 C ATOM 1814 CG HIS B 36 -2.086 16.360 -10.473 1.00 0.00 C ATOM 1815 ND1 HIS B 36 -2.911 16.905 -9.520 1.00 0.00 N ATOM 1816 CD2 HIS B 36 -0.836 16.860 -10.315 1.00 0.00 C ATOM 1817 CE1 HIS B 36 -2.153 17.718 -8.806 1.00 0.00 C ATOM 1818 NE2 HIS B 36 -0.887 17.724 -9.251 1.00 0.00 N ATOM 0 H HIS B 36 -4.454 16.973 -11.192 1.00 0.00 H new ATOM 0 HA HIS B 36 -4.373 14.307 -12.052 1.00 0.00 H new ATOM 0 HB2 HIS B 36 -1.943 14.507 -11.492 1.00 0.00 H new ATOM 0 HB3 HIS B 36 -2.546 15.828 -12.473 1.00 0.00 H new ATOM 0 HD2 HIS B 36 0.033 16.624 -10.912 1.00 0.00 H new ATOM 0 HE1 HIS B 36 -2.507 18.303 -7.970 1.00 0.00 H new ATOM 0 HE2 HIS B 36 -0.112 18.267 -8.871 1.00 0.00 H new ATOM 1826 N SER B 37 -4.332 14.726 -8.817 1.00 0.00 N ATOM 1827 CA SER B 37 -4.407 14.033 -7.536 1.00 0.00 C ATOM 1828 C SER B 37 -5.551 13.024 -7.530 1.00 0.00 C ATOM 1829 O SER B 37 -5.472 11.986 -6.873 1.00 0.00 O ATOM 1830 CB SER B 37 -4.592 15.039 -6.398 1.00 0.00 C ATOM 1831 OG SER B 37 -4.472 14.409 -5.135 1.00 0.00 O ATOM 0 H SER B 37 -4.484 15.733 -8.761 1.00 0.00 H new ATOM 0 HA SER B 37 -3.471 13.495 -7.387 1.00 0.00 H new ATOM 0 HB2 SER B 37 -3.848 15.831 -6.485 1.00 0.00 H new ATOM 0 HB3 SER B 37 -5.571 15.510 -6.481 1.00 0.00 H new ATOM 0 HG SER B 37 -4.273 15.082 -4.451 1.00 0.00 H new ATOM 1837 N ARG B 38 -6.612 13.336 -8.266 1.00 0.00 N ATOM 1838 CA ARG B 38 -7.772 12.457 -8.346 1.00 0.00 C ATOM 1839 C ARG B 38 -7.470 11.237 -9.210 1.00 0.00 C ATOM 1840 O ARG B 38 -7.801 10.108 -8.844 1.00 0.00 O ATOM 1841 CB ARG B 38 -8.974 13.214 -8.914 1.00 0.00 C ATOM 1842 CG ARG B 38 -10.300 12.801 -8.297 1.00 0.00 C ATOM 1843 CD ARG B 38 -10.555 11.312 -8.468 1.00 0.00 C ATOM 1844 NE ARG B 38 -10.597 10.921 -9.875 1.00 0.00 N ATOM 1845 CZ ARG B 38 -11.050 9.747 -10.306 1.00 0.00 C ATOM 1846 NH1 ARG B 38 -11.502 8.845 -9.443 1.00 0.00 N ATOM 1847 NH2 ARG B 38 -11.054 9.473 -11.603 1.00 0.00 N ATOM 0 H ARG B 38 -6.692 14.191 -8.816 1.00 0.00 H new ATOM 0 HA ARG B 38 -8.010 12.117 -7.338 1.00 0.00 H new ATOM 0 HB2 ARG B 38 -8.827 14.283 -8.757 1.00 0.00 H new ATOM 0 HB3 ARG B 38 -9.018 13.053 -9.991 1.00 0.00 H new ATOM 0 HG2 ARG B 38 -10.303 13.052 -7.236 1.00 0.00 H new ATOM 0 HG3 ARG B 38 -11.109 13.365 -8.760 1.00 0.00 H new ATOM 0 HD2 ARG B 38 -9.772 10.750 -7.959 1.00 0.00 H new ATOM 0 HD3 ARG B 38 -11.499 11.049 -7.990 1.00 0.00 H new ATOM 0 HE ARG B 38 -10.259 11.588 -10.568 1.00 0.00 H new ATOM 0 HH11 ARG B 38 -11.503 9.051 -8.444 1.00 0.00 H new ATOM 0 HH12 ARG B 38 -11.848 7.946 -9.779 1.00 0.00 H new ATOM 0 HH21 ARG B 38 -10.710 10.163 -12.271 1.00 0.00 H new ATOM 0 HH22 ARG B 38 -11.401 8.573 -11.933 1.00 0.00 H new ATOM 1861 N ALA B 39 -6.841 11.471 -10.356 1.00 0.00 N ATOM 1862 CA ALA B 39 -6.495 10.391 -11.271 1.00 0.00 C ATOM 1863 C ALA B 39 -5.573 9.378 -10.601 1.00 0.00 C ATOM 1864 O ALA B 39 -5.779 8.169 -10.710 1.00 0.00 O ATOM 1865 CB ALA B 39 -5.841 10.952 -12.526 1.00 0.00 C ATOM 0 H ALA B 39 -6.560 12.399 -10.673 1.00 0.00 H new ATOM 0 HA ALA B 39 -7.414 9.877 -11.551 1.00 0.00 H new ATOM 0 HB1 ALA B 39 -5.588 10.134 -13.201 1.00 0.00 H new ATOM 0 HB2 ALA B 39 -6.532 11.632 -13.024 1.00 0.00 H new ATOM 0 HB3 ALA B 39 -4.934 11.492 -12.253 1.00 0.00 H new ATOM 1871 N ALA B 40 -4.558 9.879 -9.904 1.00 0.00 N ATOM 1872 CA ALA B 40 -3.605 9.018 -9.215 1.00 0.00 C ATOM 1873 C ALA B 40 -4.279 8.256 -8.078 1.00 0.00 C ATOM 1874 O ALA B 40 -3.950 7.101 -7.811 1.00 0.00 O ATOM 1875 CB ALA B 40 -2.441 9.840 -8.685 1.00 0.00 C ATOM 0 H ALA B 40 -4.375 10.877 -9.802 1.00 0.00 H new ATOM 0 HA ALA B 40 -3.225 8.290 -9.931 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -1.736 9.185 -8.173 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -1.938 10.336 -9.515 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -2.813 10.590 -7.987 1.00 0.00 H new ATOM 1881 N LEU B 41 -5.223 8.912 -7.411 1.00 0.00 N ATOM 1882 CA LEU B 41 -5.944 8.296 -6.303 1.00 0.00 C ATOM 1883 C LEU B 41 -6.681 7.043 -6.763 1.00 0.00 C ATOM 1884 O LEU B 41 -6.618 5.999 -6.112 1.00 0.00 O ATOM 1885 CB LEU B 41 -6.935 9.291 -5.696 1.00 0.00 C ATOM 1886 CG LEU B 41 -7.493 8.897 -4.328 1.00 0.00 C ATOM 1887 CD1 LEU B 41 -6.445 9.104 -3.245 1.00 0.00 C ATOM 1888 CD2 LEU B 41 -8.750 9.695 -4.015 1.00 0.00 C ATOM 0 H LEU B 41 -5.506 9.870 -7.618 1.00 0.00 H new ATOM 0 HA LEU B 41 -5.217 8.009 -5.544 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -6.444 10.260 -5.606 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -7.768 9.419 -6.388 1.00 0.00 H new ATOM 0 HG LEU B 41 -7.755 7.839 -4.354 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -6.860 8.819 -2.278 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -5.572 8.489 -3.461 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -6.152 10.153 -3.218 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -9.133 9.402 -3.038 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -8.513 10.759 -4.007 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -9.505 9.497 -4.775 1.00 0.00 H new ATOM 1900 N ASP B 42 -7.379 7.153 -7.888 1.00 0.00 N ATOM 1901 CA ASP B 42 -8.128 6.028 -8.437 1.00 0.00 C ATOM 1902 C ASP B 42 -7.195 4.874 -8.788 1.00 0.00 C ATOM 1903 O ASP B 42 -7.556 3.706 -8.648 1.00 0.00 O ATOM 1904 CB ASP B 42 -8.907 6.464 -9.678 1.00 0.00 C ATOM 1905 CG ASP B 42 -10.239 5.750 -9.805 1.00 0.00 C ATOM 1906 OD1 ASP B 42 -11.009 5.751 -8.821 1.00 0.00 O ATOM 1907 OD2 ASP B 42 -10.512 5.189 -10.886 1.00 0.00 O ATOM 0 H ASP B 42 -7.442 8.010 -8.438 1.00 0.00 H new ATOM 0 HA ASP B 42 -8.831 5.686 -7.677 1.00 0.00 H new ATOM 0 HB2 ASP B 42 -9.077 7.540 -9.637 1.00 0.00 H new ATOM 0 HB3 ASP B 42 -8.307 6.269 -10.567 1.00 0.00 H new ATOM 1912 N ARG B 43 -5.991 5.209 -9.243 1.00 0.00 N ATOM 1913 CA ARG B 43 -5.005 4.201 -9.613 1.00 0.00 C ATOM 1914 C ARG B 43 -4.700 3.279 -8.437 1.00 0.00 C ATOM 1915 O ARG B 43 -4.537 2.071 -8.607 1.00 0.00 O ATOM 1916 CB ARG B 43 -3.717 4.871 -10.097 1.00 0.00 C ATOM 1917 CG ARG B 43 -3.886 5.646 -11.394 1.00 0.00 C ATOM 1918 CD ARG B 43 -2.627 5.589 -12.244 1.00 0.00 C ATOM 1919 NE ARG B 43 -2.620 4.430 -13.134 1.00 0.00 N ATOM 1920 CZ ARG B 43 -3.451 4.282 -14.164 1.00 0.00 C ATOM 1921 NH1 ARG B 43 -4.355 5.214 -14.437 1.00 0.00 N ATOM 1922 NH2 ARG B 43 -3.377 3.197 -14.924 1.00 0.00 N ATOM 0 H ARG B 43 -5.675 6.171 -9.364 1.00 0.00 H new ATOM 0 HA ARG B 43 -5.422 3.602 -10.422 1.00 0.00 H new ATOM 0 HB2 ARG B 43 -3.356 5.548 -9.323 1.00 0.00 H new ATOM 0 HB3 ARG B 43 -2.950 4.109 -10.236 1.00 0.00 H new ATOM 0 HG2 ARG B 43 -4.725 5.237 -11.957 1.00 0.00 H new ATOM 0 HG3 ARG B 43 -4.128 6.685 -11.170 1.00 0.00 H new ATOM 0 HD2 ARG B 43 -2.547 6.501 -12.836 1.00 0.00 H new ATOM 0 HD3 ARG B 43 -1.752 5.553 -11.595 1.00 0.00 H new ATOM 0 HE ARG B 43 -1.939 3.692 -12.956 1.00 0.00 H new ATOM 0 HH11 ARG B 43 -4.417 6.050 -13.856 1.00 0.00 H new ATOM 0 HH12 ARG B 43 -4.988 5.094 -15.228 1.00 0.00 H new ATOM 0 HH21 ARG B 43 -2.684 2.477 -14.719 1.00 0.00 H new ATOM 0 HH22 ARG B 43 -4.013 3.083 -15.713 1.00 0.00 H new ATOM 1936 N LEU B 44 -4.627 3.858 -7.242 1.00 0.00 N ATOM 1937 CA LEU B 44 -4.344 3.087 -6.037 1.00 0.00 C ATOM 1938 C LEU B 44 -5.584 2.331 -5.572 1.00 0.00 C ATOM 1939 O LEU B 44 -5.483 1.261 -4.973 1.00 0.00 O ATOM 1940 CB LEU B 44 -3.846 4.008 -4.922 1.00 0.00 C ATOM 1941 CG LEU B 44 -3.474 3.300 -3.616 1.00 0.00 C ATOM 1942 CD1 LEU B 44 -2.243 3.940 -2.991 1.00 0.00 C ATOM 1943 CD2 LEU B 44 -4.645 3.328 -2.645 1.00 0.00 C ATOM 0 H LEU B 44 -4.760 4.857 -7.083 1.00 0.00 H new ATOM 0 HA LEU B 44 -3.566 2.362 -6.274 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -2.974 4.553 -5.284 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -4.618 4.747 -4.710 1.00 0.00 H new ATOM 0 HG LEU B 44 -3.239 2.260 -3.842 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -1.995 3.423 -2.064 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -1.404 3.867 -3.683 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -2.447 4.989 -2.778 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -4.364 2.821 -1.722 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -4.910 4.362 -2.425 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -5.500 2.821 -3.092 1.00 0.00 H new ATOM 1955 N GLU B 45 -6.756 2.895 -5.851 1.00 0.00 N ATOM 1956 CA GLU B 45 -8.016 2.274 -5.462 1.00 0.00 C ATOM 1957 C GLU B 45 -8.154 0.885 -6.075 1.00 0.00 C ATOM 1958 O GLU B 45 -8.777 -0.003 -5.493 1.00 0.00 O ATOM 1959 CB GLU B 45 -9.194 3.152 -5.888 1.00 0.00 C ATOM 1960 CG GLU B 45 -9.326 4.432 -5.079 1.00 0.00 C ATOM 1961 CD GLU B 45 -10.679 5.092 -5.249 1.00 0.00 C ATOM 1962 OE1 GLU B 45 -11.163 5.171 -6.398 1.00 0.00 O ATOM 1963 OE2 GLU B 45 -11.257 5.533 -4.232 1.00 0.00 O ATOM 0 H GLU B 45 -6.858 3.781 -6.345 1.00 0.00 H new ATOM 0 HA GLU B 45 -8.020 2.172 -4.377 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -9.082 3.408 -6.942 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -10.116 2.578 -5.796 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -9.165 4.209 -4.024 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -8.545 5.130 -5.380 1.00 0.00 H new ATOM 1970 N LYS B 46 -7.569 0.703 -7.255 1.00 0.00 N ATOM 1971 CA LYS B 46 -7.625 -0.580 -7.948 1.00 0.00 C ATOM 1972 C LYS B 46 -7.062 -1.697 -7.075 1.00 0.00 C ATOM 1973 O LYS B 46 -7.486 -2.849 -7.171 1.00 0.00 O ATOM 1974 CB LYS B 46 -6.852 -0.505 -9.266 1.00 0.00 C ATOM 1975 CG LYS B 46 -7.723 -0.159 -10.463 1.00 0.00 C ATOM 1976 CD LYS B 46 -8.136 1.303 -10.446 1.00 0.00 C ATOM 1977 CE LYS B 46 -9.464 1.499 -9.731 1.00 0.00 C ATOM 1978 NZ LYS B 46 -9.911 2.919 -9.767 1.00 0.00 N ATOM 0 H LYS B 46 -7.051 1.428 -7.751 1.00 0.00 H new ATOM 0 HA LYS B 46 -8.670 -0.804 -8.161 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -6.063 0.242 -9.173 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -6.364 -1.463 -9.447 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -7.181 -0.374 -11.384 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -8.612 -0.790 -10.462 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -7.365 1.894 -9.952 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -8.214 1.672 -11.469 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -10.222 0.868 -10.195 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -9.370 1.175 -8.695 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -10.896 2.981 -9.438 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -9.302 3.490 -9.147 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -9.848 3.278 -10.741 1.00 0.00 H new ATOM 1992 N LEU B 47 -6.103 -1.349 -6.223 1.00 0.00 N ATOM 1993 CA LEU B 47 -5.480 -2.321 -5.332 1.00 0.00 C ATOM 1994 C LEU B 47 -6.055 -2.225 -3.921 1.00 0.00 C ATOM 1995 O LEU B 47 -5.454 -2.709 -2.962 1.00 0.00 O ATOM 1996 CB LEU B 47 -3.968 -2.106 -5.290 1.00 0.00 C ATOM 1997 CG LEU B 47 -3.215 -2.572 -6.539 1.00 0.00 C ATOM 1998 CD1 LEU B 47 -2.884 -1.389 -7.436 1.00 0.00 C ATOM 1999 CD2 LEU B 47 -1.947 -3.319 -6.149 1.00 0.00 C ATOM 0 H LEU B 47 -5.740 -0.400 -6.131 1.00 0.00 H new ATOM 0 HA LEU B 47 -5.693 -3.316 -5.722 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -3.771 -1.045 -5.140 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -3.565 -2.631 -4.424 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.859 -3.254 -7.095 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -2.349 -1.740 -8.318 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -3.806 -0.896 -7.743 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -2.259 -0.682 -6.890 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -1.424 -3.643 -7.049 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.300 -2.660 -5.571 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -2.208 -4.190 -5.548 1.00 0.00 H new ATOM 2011 N LEU B 48 -7.221 -1.597 -3.800 1.00 0.00 N ATOM 2012 CA LEU B 48 -7.873 -1.439 -2.505 1.00 0.00 C ATOM 2013 C LEU B 48 -9.275 -2.042 -2.523 1.00 0.00 C ATOM 2014 O LEU B 48 -9.691 -2.696 -1.569 1.00 0.00 O ATOM 2015 CB LEU B 48 -7.944 0.042 -2.125 1.00 0.00 C ATOM 2016 CG LEU B 48 -6.752 0.562 -1.318 1.00 0.00 C ATOM 2017 CD1 LEU B 48 -6.787 0.014 0.100 1.00 0.00 C ATOM 2018 CD2 LEU B 48 -5.443 0.194 -2.003 1.00 0.00 C ATOM 0 H LEU B 48 -7.733 -1.190 -4.583 1.00 0.00 H new ATOM 0 HA LEU B 48 -7.281 -1.970 -1.760 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -8.030 0.632 -3.038 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -8.854 0.210 -1.549 1.00 0.00 H new ATOM 0 HG LEU B 48 -6.819 1.649 -1.266 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -5.932 0.395 0.658 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -7.709 0.329 0.589 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -6.745 -1.075 0.070 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -4.606 0.572 -1.415 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -5.368 -0.890 -2.086 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -5.416 0.637 -2.999 1.00 0.00 H new ATOM 2030 N ARG B 49 -9.997 -1.818 -3.617 1.00 0.00 N ATOM 2031 CA ARG B 49 -11.353 -2.340 -3.760 1.00 0.00 C ATOM 2032 C ARG B 49 -11.376 -3.854 -3.572 1.00 0.00 C ATOM 2033 O ARG B 49 -10.588 -4.578 -4.180 1.00 0.00 O ATOM 2034 CB ARG B 49 -11.919 -1.977 -5.133 1.00 0.00 C ATOM 2035 CG ARG B 49 -11.164 -2.610 -6.291 1.00 0.00 C ATOM 2036 CD ARG B 49 -11.778 -2.234 -7.629 1.00 0.00 C ATOM 2037 NE ARG B 49 -11.775 -3.354 -8.567 1.00 0.00 N ATOM 2038 CZ ARG B 49 -10.669 -3.893 -9.074 1.00 0.00 C ATOM 2039 NH1 ARG B 49 -9.476 -3.418 -8.738 1.00 0.00 N ATOM 2040 NH2 ARG B 49 -10.755 -4.910 -9.920 1.00 0.00 N ATOM 0 H ARG B 49 -9.666 -1.279 -4.417 1.00 0.00 H new ATOM 0 HA ARG B 49 -11.973 -1.886 -2.987 1.00 0.00 H new ATOM 0 HB2 ARG B 49 -12.963 -2.286 -5.179 1.00 0.00 H new ATOM 0 HB3 ARG B 49 -11.902 -0.893 -5.249 1.00 0.00 H new ATOM 0 HG2 ARG B 49 -10.122 -2.291 -6.265 1.00 0.00 H new ATOM 0 HG3 ARG B 49 -11.168 -3.694 -6.180 1.00 0.00 H new ATOM 0 HD2 ARG B 49 -12.802 -1.893 -7.475 1.00 0.00 H new ATOM 0 HD3 ARG B 49 -11.225 -1.399 -8.060 1.00 0.00 H new ATOM 0 HE ARG B 49 -12.673 -3.746 -8.850 1.00 0.00 H new ATOM 0 HH11 ARG B 49 -9.403 -2.636 -8.088 1.00 0.00 H new ATOM 0 HH12 ARG B 49 -8.632 -3.835 -9.130 1.00 0.00 H new ATOM 0 HH21 ARG B 49 -11.669 -5.279 -10.182 1.00 0.00 H new ATOM 0 HH22 ARG B 49 -9.907 -5.323 -10.309 1.00 0.00 H new ATOM 2054 N CYS B 50 -12.283 -4.326 -2.723 1.00 0.00 N ATOM 2055 CA CYS B 50 -12.409 -5.753 -2.452 1.00 0.00 C ATOM 2056 C CYS B 50 -12.737 -6.523 -3.726 1.00 0.00 C ATOM 2057 O CYS B 50 -13.277 -5.965 -4.680 1.00 0.00 O ATOM 2058 CB CYS B 50 -13.489 -6.002 -1.399 1.00 0.00 C ATOM 2059 SG CYS B 50 -13.622 -7.727 -0.874 1.00 0.00 S ATOM 0 H CYS B 50 -12.942 -3.740 -2.210 1.00 0.00 H new ATOM 0 HA CYS B 50 -11.452 -6.109 -2.071 1.00 0.00 H new ATOM 0 HB2 CYS B 50 -13.281 -5.383 -0.527 1.00 0.00 H new ATOM 0 HB3 CYS B 50 -14.451 -5.679 -1.797 1.00 0.00 H new ATOM 2064 N SER B 51 -12.408 -7.811 -3.733 1.00 0.00 N ATOM 2065 CA SER B 51 -12.669 -8.661 -4.889 1.00 0.00 C ATOM 2066 C SER B 51 -14.133 -9.085 -4.932 1.00 0.00 C ATOM 2067 O SER B 51 -14.715 -9.235 -6.006 1.00 0.00 O ATOM 2068 CB SER B 51 -11.768 -9.897 -4.853 1.00 0.00 C ATOM 2069 OG SER B 51 -10.569 -9.676 -5.575 1.00 0.00 O ATOM 0 H SER B 51 -11.960 -8.289 -2.951 1.00 0.00 H new ATOM 0 HA SER B 51 -12.449 -8.086 -5.789 1.00 0.00 H new ATOM 0 HB2 SER B 51 -11.532 -10.149 -3.819 1.00 0.00 H new ATOM 0 HB3 SER B 51 -12.299 -10.750 -5.276 1.00 0.00 H new ATOM 0 HG SER B 51 -10.010 -10.480 -5.535 1.00 0.00 H new ATOM 2075 N ARG B 52 -14.723 -9.277 -3.756 1.00 0.00 N ATOM 2076 CA ARG B 52 -16.120 -9.684 -3.659 1.00 0.00 C ATOM 2077 C ARG B 52 -17.010 -8.490 -3.332 1.00 0.00 C ATOM 2078 O ARG B 52 -17.907 -8.142 -4.099 1.00 0.00 O ATOM 2079 CB ARG B 52 -16.286 -10.766 -2.590 1.00 0.00 C ATOM 2080 CG ARG B 52 -16.134 -12.180 -3.129 1.00 0.00 C ATOM 2081 CD ARG B 52 -14.798 -12.370 -3.827 1.00 0.00 C ATOM 2082 NE ARG B 52 -14.918 -12.255 -5.279 1.00 0.00 N ATOM 2083 CZ ARG B 52 -15.479 -13.182 -6.051 1.00 0.00 C ATOM 2084 NH1 ARG B 52 -15.972 -14.292 -5.517 1.00 0.00 N ATOM 2085 NH2 ARG B 52 -15.547 -12.999 -7.363 1.00 0.00 N ATOM 0 H ARG B 52 -14.255 -9.157 -2.858 1.00 0.00 H new ATOM 0 HA ARG B 52 -16.423 -10.089 -4.625 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -15.549 -10.604 -1.803 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -17.269 -10.664 -2.131 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -16.222 -12.894 -2.310 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -16.944 -12.393 -3.827 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -14.089 -11.627 -3.462 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -14.392 -13.349 -3.573 1.00 0.00 H new ATOM 0 HE ARG B 52 -14.550 -11.415 -5.726 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -15.922 -14.439 -4.509 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -16.401 -14.999 -6.115 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -15.169 -12.148 -7.779 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -15.977 -13.709 -7.955 1.00 0.00 H new ATOM 2099 N CYS B 53 -16.754 -7.863 -2.187 1.00 0.00 N ATOM 2100 CA CYS B 53 -17.530 -6.706 -1.757 1.00 0.00 C ATOM 2101 C CYS B 53 -17.482 -5.592 -2.800 1.00 0.00 C ATOM 2102 O CYS B 53 -18.362 -4.731 -2.839 1.00 0.00 O ATOM 2103 CB CYS B 53 -17.006 -6.185 -0.417 1.00 0.00 C ATOM 2104 SG CYS B 53 -17.530 -7.162 1.011 1.00 0.00 S ATOM 0 H CYS B 53 -16.014 -8.138 -1.541 1.00 0.00 H new ATOM 0 HA CYS B 53 -18.566 -7.022 -1.640 1.00 0.00 H new ATOM 0 HB2 CYS B 53 -15.917 -6.163 -0.449 1.00 0.00 H new ATOM 0 HB3 CYS B 53 -17.342 -5.157 -0.283 1.00 0.00 H new ATOM 2109 N THR B 54 -16.449 -5.615 -3.642 1.00 0.00 N ATOM 2110 CA THR B 54 -16.277 -4.608 -4.690 1.00 0.00 C ATOM 2111 C THR B 54 -16.548 -3.200 -4.161 1.00 0.00 C ATOM 2112 O THR B 54 -17.465 -2.519 -4.619 1.00 0.00 O ATOM 2113 CB THR B 54 -17.195 -4.911 -5.878 1.00 0.00 C ATOM 2114 OG1 THR B 54 -17.090 -3.897 -6.862 1.00 0.00 O ATOM 2115 CG2 THR B 54 -18.655 -5.033 -5.499 1.00 0.00 C ATOM 0 H THR B 54 -15.715 -6.323 -3.619 1.00 0.00 H new ATOM 0 HA THR B 54 -15.240 -4.649 -5.022 1.00 0.00 H new ATOM 0 HB THR B 54 -16.858 -5.874 -6.261 1.00 0.00 H new ATOM 0 HG1 THR B 54 -17.326 -3.032 -6.467 1.00 0.00 H new ATOM 0 HG21 THR B 54 -19.245 -5.248 -6.390 1.00 0.00 H new ATOM 0 HG22 THR B 54 -18.778 -5.842 -4.779 1.00 0.00 H new ATOM 0 HG23 THR B 54 -18.995 -4.097 -5.055 1.00 0.00 H new ATOM 2123 N ASN B 55 -15.742 -2.774 -3.195 1.00 0.00 N ATOM 2124 CA ASN B 55 -15.891 -1.451 -2.603 1.00 0.00 C ATOM 2125 C ASN B 55 -14.686 -1.106 -1.733 1.00 0.00 C ATOM 2126 O ASN B 55 -13.742 -1.889 -1.625 1.00 0.00 O ATOM 2127 CB ASN B 55 -17.173 -1.382 -1.769 1.00 0.00 C ATOM 2128 CG ASN B 55 -17.847 -0.027 -1.855 1.00 0.00 C ATOM 2129 OD1 ASN B 55 -17.688 0.698 -2.837 1.00 0.00 O ATOM 2130 ND2 ASN B 55 -18.605 0.323 -0.822 1.00 0.00 N ATOM 0 H ASN B 55 -14.978 -3.327 -2.805 1.00 0.00 H new ATOM 0 HA ASN B 55 -15.953 -0.724 -3.412 1.00 0.00 H new ATOM 0 HB2 ASN B 55 -17.866 -2.152 -2.109 1.00 0.00 H new ATOM 0 HB3 ASN B 55 -16.938 -1.602 -0.728 1.00 0.00 H new ATOM 0 HD21 ASN B 55 -19.083 1.224 -0.822 1.00 0.00 H new ATOM 0 HD22 ASN B 55 -18.709 -0.309 -0.028 1.00 0.00 H new ATOM 2137 N ILE B 56 -14.725 0.069 -1.114 1.00 0.00 N ATOM 2138 CA ILE B 56 -13.636 0.516 -0.254 1.00 0.00 C ATOM 2139 C ILE B 56 -13.578 -0.307 1.030 1.00 0.00 C ATOM 2140 O ILE B 56 -13.976 0.159 2.098 1.00 0.00 O ATOM 2141 CB ILE B 56 -13.781 2.007 0.108 1.00 0.00 C ATOM 2142 CG1 ILE B 56 -14.028 2.839 -1.150 1.00 0.00 C ATOM 2143 CG2 ILE B 56 -12.540 2.498 0.839 1.00 0.00 C ATOM 2144 CD1 ILE B 56 -12.943 2.693 -2.196 1.00 0.00 C ATOM 0 H ILE B 56 -15.499 0.729 -1.192 1.00 0.00 H new ATOM 0 HA ILE B 56 -12.711 0.376 -0.814 1.00 0.00 H new ATOM 0 HB ILE B 56 -14.639 2.122 0.770 1.00 0.00 H new ATOM 0 HG12 ILE B 56 -14.983 2.548 -1.586 1.00 0.00 H new ATOM 0 HG13 ILE B 56 -14.112 3.889 -0.870 1.00 0.00 H new ATOM 0 HG21 ILE B 56 -12.658 3.553 1.088 1.00 0.00 H new ATOM 0 HG22 ILE B 56 -12.405 1.922 1.755 1.00 0.00 H new ATOM 0 HG23 ILE B 56 -11.667 2.372 0.199 1.00 0.00 H new ATOM 0 HD11 ILE B 56 -13.185 3.312 -3.060 1.00 0.00 H new ATOM 0 HD12 ILE B 56 -11.989 3.012 -1.777 1.00 0.00 H new ATOM 0 HD13 ILE B 56 -12.873 1.650 -2.505 1.00 0.00 H new ATOM 2156 N LEU B 57 -13.082 -1.535 0.917 1.00 0.00 N ATOM 2157 CA LEU B 57 -12.973 -2.429 2.067 1.00 0.00 C ATOM 2158 C LEU B 57 -12.261 -1.746 3.233 1.00 0.00 C ATOM 2159 O LEU B 57 -11.707 -0.657 3.083 1.00 0.00 O ATOM 2160 CB LEU B 57 -12.227 -3.711 1.684 1.00 0.00 C ATOM 2161 CG LEU B 57 -10.951 -3.508 0.861 1.00 0.00 C ATOM 2162 CD1 LEU B 57 -9.790 -3.116 1.763 1.00 0.00 C ATOM 2163 CD2 LEU B 57 -10.617 -4.770 0.075 1.00 0.00 C ATOM 0 H LEU B 57 -12.748 -1.935 0.040 1.00 0.00 H new ATOM 0 HA LEU B 57 -13.984 -2.685 2.382 1.00 0.00 H new ATOM 0 HB2 LEU B 57 -11.969 -4.247 2.597 1.00 0.00 H new ATOM 0 HB3 LEU B 57 -12.905 -4.351 1.119 1.00 0.00 H new ATOM 0 HG LEU B 57 -11.123 -2.697 0.153 1.00 0.00 H new ATOM 0 HD11 LEU B 57 -8.892 -2.976 1.161 1.00 0.00 H new ATOM 0 HD12 LEU B 57 -10.029 -2.186 2.280 1.00 0.00 H new ATOM 0 HD13 LEU B 57 -9.616 -3.904 2.496 1.00 0.00 H new ATOM 0 HD21 LEU B 57 -9.708 -4.608 -0.504 1.00 0.00 H new ATOM 0 HD22 LEU B 57 -10.464 -5.599 0.766 1.00 0.00 H new ATOM 0 HD23 LEU B 57 -11.440 -5.007 -0.600 1.00 0.00 H new ATOM 2175 N ARG B 58 -12.283 -2.396 4.391 1.00 0.00 N ATOM 2176 CA ARG B 58 -11.643 -1.859 5.586 1.00 0.00 C ATOM 2177 C ARG B 58 -11.159 -2.988 6.488 1.00 0.00 C ATOM 2178 O ARG B 58 -11.937 -3.857 6.883 1.00 0.00 O ATOM 2179 CB ARG B 58 -12.614 -0.954 6.350 1.00 0.00 C ATOM 2180 CG ARG B 58 -12.183 0.503 6.388 1.00 0.00 C ATOM 2181 CD ARG B 58 -13.078 1.324 7.304 1.00 0.00 C ATOM 2182 NE ARG B 58 -12.826 1.039 8.714 1.00 0.00 N ATOM 2183 CZ ARG B 58 -11.712 1.388 9.354 1.00 0.00 C ATOM 2184 NH1 ARG B 58 -10.746 2.034 8.713 1.00 0.00 N ATOM 2185 NH2 ARG B 58 -11.564 1.090 10.637 1.00 0.00 N ATOM 0 H ARG B 58 -12.739 -3.298 4.528 1.00 0.00 H new ATOM 0 HA ARG B 58 -10.781 -1.268 5.277 1.00 0.00 H new ATOM 0 HB2 ARG B 58 -13.600 -1.021 5.889 1.00 0.00 H new ATOM 0 HB3 ARG B 58 -12.714 -1.322 7.371 1.00 0.00 H new ATOM 0 HG2 ARG B 58 -11.150 0.570 6.731 1.00 0.00 H new ATOM 0 HG3 ARG B 58 -12.212 0.919 5.381 1.00 0.00 H new ATOM 0 HD2 ARG B 58 -12.916 2.385 7.114 1.00 0.00 H new ATOM 0 HD3 ARG B 58 -14.123 1.115 7.073 1.00 0.00 H new ATOM 0 HE ARG B 58 -13.546 0.543 9.240 1.00 0.00 H new ATOM 0 HH11 ARG B 58 -10.855 2.265 7.726 1.00 0.00 H new ATOM 0 HH12 ARG B 58 -9.894 2.299 9.208 1.00 0.00 H new ATOM 0 HH21 ARG B 58 -12.304 0.593 11.134 1.00 0.00 H new ATOM 0 HH22 ARG B 58 -10.711 1.357 11.127 1.00 0.00 H new ATOM 2199 N GLU B 59 -9.867 -2.977 6.806 1.00 0.00 N ATOM 2200 CA GLU B 59 -9.282 -4.008 7.655 1.00 0.00 C ATOM 2201 C GLU B 59 -9.531 -5.396 7.065 1.00 0.00 C ATOM 2202 O GLU B 59 -10.057 -6.283 7.738 1.00 0.00 O ATOM 2203 CB GLU B 59 -9.863 -3.925 9.068 1.00 0.00 C ATOM 2204 CG GLU B 59 -9.134 -4.797 10.079 1.00 0.00 C ATOM 2205 CD GLU B 59 -9.704 -4.668 11.478 1.00 0.00 C ATOM 2206 OE1 GLU B 59 -10.355 -3.643 11.762 1.00 0.00 O ATOM 2207 OE2 GLU B 59 -9.498 -5.596 12.290 1.00 0.00 O ATOM 0 H GLU B 59 -9.207 -2.267 6.489 1.00 0.00 H new ATOM 0 HA GLU B 59 -8.206 -3.841 7.706 1.00 0.00 H new ATOM 0 HB2 GLU B 59 -9.831 -2.889 9.405 1.00 0.00 H new ATOM 0 HB3 GLU B 59 -10.912 -4.218 9.038 1.00 0.00 H new ATOM 0 HG2 GLU B 59 -9.190 -5.838 9.762 1.00 0.00 H new ATOM 0 HG3 GLU B 59 -8.079 -4.525 10.094 1.00 0.00 H new ATOM 2214 N PRO B 60 -9.158 -5.598 5.789 1.00 0.00 N ATOM 2215 CA PRO B 60 -9.349 -6.880 5.104 1.00 0.00 C ATOM 2216 C PRO B 60 -8.440 -7.975 5.648 1.00 0.00 C ATOM 2217 O PRO B 60 -7.729 -7.776 6.633 1.00 0.00 O ATOM 2218 CB PRO B 60 -8.991 -6.564 3.650 1.00 0.00 C ATOM 2219 CG PRO B 60 -8.070 -5.397 3.731 1.00 0.00 C ATOM 2220 CD PRO B 60 -8.529 -4.591 4.914 1.00 0.00 C ATOM 0 HA PRO B 60 -10.361 -7.262 5.237 1.00 0.00 H new ATOM 0 HB2 PRO B 60 -8.510 -7.415 3.167 1.00 0.00 H new ATOM 0 HB3 PRO B 60 -9.880 -6.327 3.066 1.00 0.00 H new ATOM 0 HG2 PRO B 60 -7.037 -5.722 3.857 1.00 0.00 H new ATOM 0 HG3 PRO B 60 -8.108 -4.805 2.817 1.00 0.00 H new ATOM 0 HD2 PRO B 60 -7.695 -4.093 5.409 1.00 0.00 H new ATOM 0 HD3 PRO B 60 -9.236 -3.815 4.622 1.00 0.00 H new ATOM 2228 N VAL B 61 -8.471 -9.133 4.998 1.00 0.00 N ATOM 2229 CA VAL B 61 -7.655 -10.267 5.411 1.00 0.00 C ATOM 2230 C VAL B 61 -6.911 -10.867 4.222 1.00 0.00 C ATOM 2231 O VAL B 61 -7.422 -10.883 3.102 1.00 0.00 O ATOM 2232 CB VAL B 61 -8.513 -11.362 6.071 1.00 0.00 C ATOM 2233 CG1 VAL B 61 -7.631 -12.452 6.659 1.00 0.00 C ATOM 2234 CG2 VAL B 61 -9.416 -10.760 7.137 1.00 0.00 C ATOM 0 H VAL B 61 -9.055 -9.311 4.181 1.00 0.00 H new ATOM 0 HA VAL B 61 -6.934 -9.893 6.138 1.00 0.00 H new ATOM 0 HB VAL B 61 -9.144 -11.815 5.306 1.00 0.00 H new ATOM 0 HG11 VAL B 61 -8.256 -13.216 7.121 1.00 0.00 H new ATOM 0 HG12 VAL B 61 -7.032 -12.902 5.867 1.00 0.00 H new ATOM 0 HG13 VAL B 61 -6.971 -12.020 7.411 1.00 0.00 H new ATOM 0 HG21 VAL B 61 -10.015 -11.548 7.593 1.00 0.00 H new ATOM 0 HG22 VAL B 61 -8.806 -10.279 7.902 1.00 0.00 H new ATOM 0 HG23 VAL B 61 -10.075 -10.021 6.681 1.00 0.00 H new ATOM 2244 N CYS B 62 -5.702 -11.358 4.474 1.00 0.00 N ATOM 2245 CA CYS B 62 -4.888 -11.959 3.423 1.00 0.00 C ATOM 2246 C CYS B 62 -5.427 -13.332 3.035 1.00 0.00 C ATOM 2247 O CYS B 62 -5.849 -14.109 3.892 1.00 0.00 O ATOM 2248 CB CYS B 62 -3.435 -12.079 3.881 1.00 0.00 C ATOM 2249 SG CYS B 62 -2.640 -10.494 4.242 1.00 0.00 S ATOM 0 H CYS B 62 -5.265 -11.352 5.395 1.00 0.00 H new ATOM 0 HA CYS B 62 -4.933 -11.311 2.548 1.00 0.00 H new ATOM 0 HB2 CYS B 62 -3.397 -12.704 4.773 1.00 0.00 H new ATOM 0 HB3 CYS B 62 -2.863 -12.592 3.108 1.00 0.00 H new ATOM 0 HG CYS B 62 -3.509 -9.683 4.769 1.00 0.00 H new ATOM 2255 N LEU B 63 -5.408 -13.625 1.739 1.00 0.00 N ATOM 2256 CA LEU B 63 -5.893 -14.906 1.239 1.00 0.00 C ATOM 2257 C LEU B 63 -5.051 -16.055 1.785 1.00 0.00 C ATOM 2258 O LEU B 63 -5.546 -16.907 2.521 1.00 0.00 O ATOM 2259 CB LEU B 63 -5.869 -14.923 -0.291 1.00 0.00 C ATOM 2260 CG LEU B 63 -6.775 -15.969 -0.945 1.00 0.00 C ATOM 2261 CD1 LEU B 63 -6.334 -17.372 -0.561 1.00 0.00 C ATOM 2262 CD2 LEU B 63 -8.225 -15.739 -0.549 1.00 0.00 C ATOM 0 H LEU B 63 -5.062 -12.993 1.017 1.00 0.00 H new ATOM 0 HA LEU B 63 -6.920 -15.036 1.580 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -6.159 -13.937 -0.654 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -4.844 -15.096 -0.621 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.693 -15.867 -2.027 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -6.990 -18.102 -1.035 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.309 -17.535 -0.894 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -6.387 -17.486 0.522 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -8.855 -16.492 -1.023 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -8.323 -15.814 0.534 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -8.538 -14.747 -0.874 1.00 0.00 H new ATOM 2274 N GLY B 64 -3.774 -16.070 1.417 1.00 0.00 N ATOM 2275 CA GLY B 64 -2.881 -17.118 1.879 1.00 0.00 C ATOM 2276 C GLY B 64 -1.472 -16.957 1.344 1.00 0.00 C ATOM 2277 O GLY B 64 -0.506 -16.973 2.107 1.00 0.00 O ATOM 0 H GLY B 64 -3.341 -15.376 0.808 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -2.855 -17.115 2.969 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -3.274 -18.087 1.572 1.00 0.00 H new ATOM 2281 N GLY B 65 -1.355 -16.802 0.030 1.00 0.00 N ATOM 2282 CA GLY B 65 -0.049 -16.638 -0.583 1.00 0.00 C ATOM 2283 C GLY B 65 -0.131 -16.464 -2.086 1.00 0.00 C ATOM 2284 O GLY B 65 0.656 -17.052 -2.829 1.00 0.00 O ATOM 0 H GLY B 65 -2.140 -16.787 -0.621 1.00 0.00 H new ATOM 0 HA2 GLY B 65 0.447 -15.771 -0.147 1.00 0.00 H new ATOM 0 HA3 GLY B 65 0.568 -17.507 -0.354 1.00 0.00 H new ATOM 2288 N CYS B 66 -1.084 -15.654 -2.536 1.00 0.00 N ATOM 2289 CA CYS B 66 -1.265 -15.405 -3.963 1.00 0.00 C ATOM 2290 C CYS B 66 -1.131 -13.916 -4.278 1.00 0.00 C ATOM 2291 O CYS B 66 -0.078 -13.460 -4.720 1.00 0.00 O ATOM 2292 CB CYS B 66 -2.626 -15.927 -4.442 1.00 0.00 C ATOM 2293 SG CYS B 66 -3.901 -16.016 -3.160 1.00 0.00 S ATOM 0 H CYS B 66 -1.742 -15.159 -1.934 1.00 0.00 H new ATOM 0 HA CYS B 66 -0.481 -15.943 -4.496 1.00 0.00 H new ATOM 0 HB2 CYS B 66 -2.984 -15.283 -5.246 1.00 0.00 H new ATOM 0 HB3 CYS B 66 -2.489 -16.921 -4.867 1.00 0.00 H new ATOM 2298 N GLU B 67 -2.205 -13.168 -4.046 1.00 0.00 N ATOM 2299 CA GLU B 67 -2.215 -11.731 -4.304 1.00 0.00 C ATOM 2300 C GLU B 67 -3.591 -11.146 -4.010 1.00 0.00 C ATOM 2301 O GLU B 67 -3.711 -10.009 -3.556 1.00 0.00 O ATOM 2302 CB GLU B 67 -1.829 -11.443 -5.758 1.00 0.00 C ATOM 2303 CG GLU B 67 -1.830 -9.964 -6.108 1.00 0.00 C ATOM 2304 CD GLU B 67 -1.938 -9.718 -7.601 1.00 0.00 C ATOM 2305 OE1 GLU B 67 -2.388 -10.633 -8.322 1.00 0.00 O ATOM 2306 OE2 GLU B 67 -1.573 -8.610 -8.048 1.00 0.00 O ATOM 0 H GLU B 67 -3.083 -13.534 -3.678 1.00 0.00 H new ATOM 0 HA GLU B 67 -1.483 -11.263 -3.646 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -0.837 -11.852 -5.949 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -2.522 -11.964 -6.419 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -2.662 -9.475 -5.602 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -0.915 -9.505 -5.733 1.00 0.00 H new ATOM 2313 N HIS B 68 -4.629 -11.934 -4.276 1.00 0.00 N ATOM 2314 CA HIS B 68 -6.003 -11.498 -4.043 1.00 0.00 C ATOM 2315 C HIS B 68 -6.202 -11.053 -2.598 1.00 0.00 C ATOM 2316 O HIS B 68 -5.676 -11.668 -1.670 1.00 0.00 O ATOM 2317 CB HIS B 68 -6.980 -12.626 -4.379 1.00 0.00 C ATOM 2318 CG HIS B 68 -7.135 -12.867 -5.848 1.00 0.00 C ATOM 2319 ND1 HIS B 68 -6.795 -14.071 -6.416 1.00 0.00 N ATOM 2320 CD2 HIS B 68 -7.595 -12.035 -6.814 1.00 0.00 C ATOM 2321 CE1 HIS B 68 -7.053 -13.947 -7.706 1.00 0.00 C ATOM 2322 NE2 HIS B 68 -7.540 -12.730 -7.995 1.00 0.00 N ATOM 0 H HIS B 68 -4.545 -12.878 -4.653 1.00 0.00 H new ATOM 0 HA HIS B 68 -6.200 -10.646 -4.694 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -6.639 -13.545 -3.903 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -7.955 -12.390 -3.953 1.00 0.00 H new ATOM 0 HD1 HIS B 68 -6.421 -14.892 -5.940 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -7.939 -11.020 -6.680 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -6.892 -14.727 -8.436 1.00 0.00 H new ATOM 2330 N ILE B 69 -6.965 -9.981 -2.415 1.00 0.00 N ATOM 2331 CA ILE B 69 -7.237 -9.451 -1.082 1.00 0.00 C ATOM 2332 C ILE B 69 -8.728 -9.193 -0.892 1.00 0.00 C ATOM 2333 O ILE B 69 -9.363 -8.537 -1.718 1.00 0.00 O ATOM 2334 CB ILE B 69 -6.465 -8.142 -0.821 1.00 0.00 C ATOM 2335 CG1 ILE B 69 -5.044 -8.235 -1.384 1.00 0.00 C ATOM 2336 CG2 ILE B 69 -6.428 -7.839 0.670 1.00 0.00 C ATOM 2337 CD1 ILE B 69 -4.908 -7.662 -2.778 1.00 0.00 C ATOM 0 H ILE B 69 -7.407 -9.461 -3.173 1.00 0.00 H new ATOM 0 HA ILE B 69 -6.902 -10.205 -0.369 1.00 0.00 H new ATOM 0 HB ILE B 69 -6.982 -7.328 -1.328 1.00 0.00 H new ATOM 0 HG12 ILE B 69 -4.362 -7.710 -0.716 1.00 0.00 H new ATOM 0 HG13 ILE B 69 -4.735 -9.280 -1.398 1.00 0.00 H new ATOM 0 HG21 ILE B 69 -5.880 -6.912 0.839 1.00 0.00 H new ATOM 0 HG22 ILE B 69 -7.446 -7.732 1.045 1.00 0.00 H new ATOM 0 HG23 ILE B 69 -5.932 -8.655 1.195 1.00 0.00 H new ATOM 0 HD11 ILE B 69 -3.876 -7.762 -3.113 1.00 0.00 H new ATOM 0 HD12 ILE B 69 -5.565 -8.203 -3.459 1.00 0.00 H new ATOM 0 HD13 ILE B 69 -5.186 -6.608 -2.767 1.00 0.00 H new ATOM 2349 N PHE B 70 -9.281 -9.712 0.198 1.00 0.00 N ATOM 2350 CA PHE B 70 -10.699 -9.535 0.493 1.00 0.00 C ATOM 2351 C PHE B 70 -10.898 -9.024 1.915 1.00 0.00 C ATOM 2352 O PHE B 70 -9.973 -9.039 2.726 1.00 0.00 O ATOM 2353 CB PHE B 70 -11.457 -10.853 0.307 1.00 0.00 C ATOM 2354 CG PHE B 70 -10.995 -11.659 -0.876 1.00 0.00 C ATOM 2355 CD1 PHE B 70 -9.753 -12.275 -0.873 1.00 0.00 C ATOM 2356 CD2 PHE B 70 -11.805 -11.798 -1.991 1.00 0.00 C ATOM 2357 CE1 PHE B 70 -9.329 -13.016 -1.960 1.00 0.00 C ATOM 2358 CE2 PHE B 70 -11.386 -12.538 -3.081 1.00 0.00 C ATOM 2359 CZ PHE B 70 -10.148 -13.147 -3.066 1.00 0.00 C ATOM 0 H PHE B 70 -8.770 -10.258 0.892 1.00 0.00 H new ATOM 0 HA PHE B 70 -11.095 -8.796 -0.204 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -11.347 -11.454 1.209 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -12.520 -10.637 0.195 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -9.109 -12.175 -0.012 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -12.775 -11.323 -2.009 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -8.360 -13.492 -1.945 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -12.027 -12.639 -3.944 1.00 0.00 H new ATOM 0 HZ PHE B 70 -9.819 -13.725 -3.917 1.00 0.00 H new ATOM 2369 N CYS B 71 -12.114 -8.577 2.212 1.00 0.00 N ATOM 2370 CA CYS B 71 -12.436 -8.066 3.538 1.00 0.00 C ATOM 2371 C CYS B 71 -12.272 -9.158 4.591 1.00 0.00 C ATOM 2372 O CYS B 71 -11.727 -10.225 4.312 1.00 0.00 O ATOM 2373 CB CYS B 71 -13.867 -7.526 3.566 1.00 0.00 C ATOM 2374 SG CYS B 71 -14.278 -6.451 2.170 1.00 0.00 S ATOM 0 H CYS B 71 -12.892 -8.559 1.552 1.00 0.00 H new ATOM 0 HA CYS B 71 -11.745 -7.254 3.767 1.00 0.00 H new ATOM 0 HB2 CYS B 71 -14.561 -8.366 3.580 1.00 0.00 H new ATOM 0 HB3 CYS B 71 -14.017 -6.973 4.493 1.00 0.00 H new ATOM 2379 N SER B 72 -12.747 -8.884 5.801 1.00 0.00 N ATOM 2380 CA SER B 72 -12.652 -9.845 6.893 1.00 0.00 C ATOM 2381 C SER B 72 -13.944 -10.649 7.029 1.00 0.00 C ATOM 2382 O SER B 72 -14.286 -11.112 8.117 1.00 0.00 O ATOM 2383 CB SER B 72 -12.346 -9.127 8.208 1.00 0.00 C ATOM 2384 OG SER B 72 -13.449 -8.345 8.633 1.00 0.00 O ATOM 0 H SER B 72 -13.201 -8.005 6.050 1.00 0.00 H new ATOM 0 HA SER B 72 -11.839 -10.534 6.664 1.00 0.00 H new ATOM 0 HB2 SER B 72 -12.098 -9.859 8.976 1.00 0.00 H new ATOM 0 HB3 SER B 72 -11.471 -8.489 8.082 1.00 0.00 H new ATOM 0 HG SER B 72 -13.227 -7.898 9.477 1.00 0.00 H new ATOM 2390 N ASN B 73 -14.657 -10.809 5.918 1.00 0.00 N ATOM 2391 CA ASN B 73 -15.911 -11.556 5.917 1.00 0.00 C ATOM 2392 C ASN B 73 -16.230 -12.097 4.526 1.00 0.00 C ATOM 2393 O ASN B 73 -17.388 -12.365 4.206 1.00 0.00 O ATOM 2394 CB ASN B 73 -17.053 -10.663 6.395 1.00 0.00 C ATOM 2395 CG ASN B 73 -17.309 -10.795 7.884 1.00 0.00 C ATOM 2396 OD1 ASN B 73 -16.640 -10.161 8.699 1.00 0.00 O ATOM 2397 ND2 ASN B 73 -18.281 -11.625 8.246 1.00 0.00 N ATOM 0 H ASN B 73 -14.389 -10.432 5.009 1.00 0.00 H new ATOM 0 HA ASN B 73 -15.799 -12.401 6.597 1.00 0.00 H new ATOM 0 HB2 ASN B 73 -16.820 -9.624 6.160 1.00 0.00 H new ATOM 0 HB3 ASN B 73 -17.962 -10.917 5.849 1.00 0.00 H new ATOM 0 HD21 ASN B 73 -18.498 -11.757 9.234 1.00 0.00 H new ATOM 0 HD22 ASN B 73 -18.811 -12.131 7.536 1.00 0.00 H new ATOM 2404 N CYS B 74 -15.199 -12.255 3.704 1.00 0.00 N ATOM 2405 CA CYS B 74 -15.374 -12.763 2.348 1.00 0.00 C ATOM 2406 C CYS B 74 -14.359 -13.859 2.043 1.00 0.00 C ATOM 2407 O CYS B 74 -14.715 -14.935 1.564 1.00 0.00 O ATOM 2408 CB CYS B 74 -15.237 -11.627 1.333 1.00 0.00 C ATOM 2409 SG CYS B 74 -16.147 -10.128 1.773 1.00 0.00 S ATOM 0 H CYS B 74 -14.234 -12.039 3.952 1.00 0.00 H new ATOM 0 HA CYS B 74 -16.375 -13.188 2.273 1.00 0.00 H new ATOM 0 HB2 CYS B 74 -14.181 -11.379 1.222 1.00 0.00 H new ATOM 0 HB3 CYS B 74 -15.585 -11.978 0.362 1.00 0.00 H new ATOM 2414 N VAL B 75 -13.091 -13.576 2.322 1.00 0.00 N ATOM 2415 CA VAL B 75 -12.021 -14.534 2.078 1.00 0.00 C ATOM 2416 C VAL B 75 -12.268 -15.837 2.834 1.00 0.00 C ATOM 2417 O VAL B 75 -11.887 -16.914 2.376 1.00 0.00 O ATOM 2418 CB VAL B 75 -10.650 -13.960 2.490 1.00 0.00 C ATOM 2419 CG1 VAL B 75 -10.621 -13.652 3.979 1.00 0.00 C ATOM 2420 CG2 VAL B 75 -9.528 -14.916 2.111 1.00 0.00 C ATOM 0 H VAL B 75 -12.780 -12.689 2.718 1.00 0.00 H new ATOM 0 HA VAL B 75 -12.012 -14.737 1.007 1.00 0.00 H new ATOM 0 HB VAL B 75 -10.495 -13.027 1.948 1.00 0.00 H new ATOM 0 HG11 VAL B 75 -9.645 -13.248 4.248 1.00 0.00 H new ATOM 0 HG12 VAL B 75 -11.394 -12.920 4.214 1.00 0.00 H new ATOM 0 HG13 VAL B 75 -10.803 -14.567 4.543 1.00 0.00 H new ATOM 0 HG21 VAL B 75 -8.570 -14.490 2.411 1.00 0.00 H new ATOM 0 HG22 VAL B 75 -9.676 -15.870 2.618 1.00 0.00 H new ATOM 0 HG23 VAL B 75 -9.533 -15.073 1.032 1.00 0.00 H new ATOM 2430 N SER B 76 -12.911 -15.729 3.992 1.00 0.00 N ATOM 2431 CA SER B 76 -13.211 -16.896 4.813 1.00 0.00 C ATOM 2432 C SER B 76 -14.176 -17.835 4.095 1.00 0.00 C ATOM 2433 O SER B 76 -15.377 -17.829 4.361 1.00 0.00 O ATOM 2434 CB SER B 76 -13.807 -16.463 6.153 1.00 0.00 C ATOM 2435 OG SER B 76 -13.540 -17.420 7.164 1.00 0.00 O ATOM 0 H SER B 76 -13.235 -14.844 4.383 1.00 0.00 H new ATOM 0 HA SER B 76 -12.278 -17.431 4.993 1.00 0.00 H new ATOM 0 HB2 SER B 76 -13.393 -15.497 6.444 1.00 0.00 H new ATOM 0 HB3 SER B 76 -14.884 -16.330 6.049 1.00 0.00 H new ATOM 0 HG SER B 76 -13.981 -18.266 6.939 1.00 0.00 H new ATOM 2441 N ASP B 77 -13.640 -18.640 3.184 1.00 0.00 N ATOM 2442 CA ASP B 77 -14.451 -19.587 2.427 1.00 0.00 C ATOM 2443 C ASP B 77 -13.620 -20.791 1.999 1.00 0.00 C ATOM 2444 O ASP B 77 -14.041 -21.937 2.159 1.00 0.00 O ATOM 2445 CB ASP B 77 -15.053 -18.904 1.197 1.00 0.00 C ATOM 2446 CG ASP B 77 -16.456 -19.393 0.893 1.00 0.00 C ATOM 2447 OD1 ASP B 77 -17.131 -19.876 1.827 1.00 0.00 O ATOM 2448 OD2 ASP B 77 -16.880 -19.293 -0.278 1.00 0.00 O ATOM 0 H ASP B 77 -12.647 -18.656 2.952 1.00 0.00 H new ATOM 0 HA ASP B 77 -15.258 -19.935 3.072 1.00 0.00 H new ATOM 0 HB2 ASP B 77 -15.074 -17.826 1.357 1.00 0.00 H new ATOM 0 HB3 ASP B 77 -14.413 -19.086 0.334 1.00 0.00 H new ATOM 2453 N CYS B 78 -12.438 -20.523 1.456 1.00 0.00 N ATOM 2454 CA CYS B 78 -11.543 -21.583 1.006 1.00 0.00 C ATOM 2455 C CYS B 78 -10.150 -21.403 1.599 1.00 0.00 C ATOM 2456 O CYS B 78 -9.143 -21.641 0.932 1.00 0.00 O ATOM 2457 CB CYS B 78 -11.463 -21.597 -0.523 1.00 0.00 C ATOM 2458 SG CYS B 78 -12.961 -22.201 -1.334 1.00 0.00 S ATOM 0 H CYS B 78 -12.077 -19.579 1.316 1.00 0.00 H new ATOM 0 HA CYS B 78 -11.945 -22.536 1.349 1.00 0.00 H new ATOM 0 HB2 CYS B 78 -11.254 -20.587 -0.875 1.00 0.00 H new ATOM 0 HB3 CYS B 78 -10.622 -22.220 -0.827 1.00 0.00 H new ATOM 0 HG CYS B 78 -12.798 -22.173 -2.623 1.00 0.00 H new ATOM 2464 N ILE B 79 -10.100 -20.978 2.857 1.00 0.00 N ATOM 2465 CA ILE B 79 -8.831 -20.766 3.542 1.00 0.00 C ATOM 2466 C ILE B 79 -8.173 -22.093 3.900 1.00 0.00 C ATOM 2467 O ILE B 79 -6.947 -22.202 3.926 1.00 0.00 O ATOM 2468 CB ILE B 79 -9.012 -19.932 4.828 1.00 0.00 C ATOM 2469 CG1 ILE B 79 -9.966 -18.762 4.582 1.00 0.00 C ATOM 2470 CG2 ILE B 79 -7.666 -19.423 5.322 1.00 0.00 C ATOM 2471 CD1 ILE B 79 -9.541 -17.869 3.438 1.00 0.00 C ATOM 0 H ILE B 79 -10.924 -20.774 3.423 1.00 0.00 H new ATOM 0 HA ILE B 79 -8.190 -20.217 2.852 1.00 0.00 H new ATOM 0 HB ILE B 79 -9.446 -20.573 5.595 1.00 0.00 H new ATOM 0 HG12 ILE B 79 -10.963 -19.153 4.377 1.00 0.00 H new ATOM 0 HG13 ILE B 79 -10.039 -18.165 5.491 1.00 0.00 H new ATOM 0 HG21 ILE B 79 -7.810 -18.837 6.230 1.00 0.00 H new ATOM 0 HG22 ILE B 79 -7.013 -20.269 5.536 1.00 0.00 H new ATOM 0 HG23 ILE B 79 -7.209 -18.798 4.555 1.00 0.00 H new ATOM 0 HD11 ILE B 79 -10.263 -17.061 3.320 1.00 0.00 H new ATOM 0 HD12 ILE B 79 -8.558 -17.449 3.650 1.00 0.00 H new ATOM 0 HD13 ILE B 79 -9.496 -18.452 2.518 1.00 0.00 H new ATOM 2483 N GLY B 80 -8.996 -23.100 4.173 1.00 0.00 N ATOM 2484 CA GLY B 80 -8.475 -24.407 4.522 1.00 0.00 C ATOM 2485 C GLY B 80 -7.645 -25.016 3.410 1.00 0.00 C ATOM 2486 O GLY B 80 -6.741 -25.813 3.664 1.00 0.00 O ATOM 0 H GLY B 80 -10.014 -23.034 4.159 1.00 0.00 H new ATOM 0 HA2 GLY B 80 -7.866 -24.323 5.422 1.00 0.00 H new ATOM 0 HA3 GLY B 80 -9.304 -25.074 4.759 1.00 0.00 H new ATOM 2490 N THR B 81 -7.949 -24.637 2.172 1.00 0.00 N ATOM 2491 CA THR B 81 -7.223 -25.149 1.015 1.00 0.00 C ATOM 2492 C THR B 81 -6.280 -24.090 0.452 1.00 0.00 C ATOM 2493 O THR B 81 -5.111 -24.366 0.187 1.00 0.00 O ATOM 2494 CB THR B 81 -8.203 -25.608 -0.067 1.00 0.00 C ATOM 2495 OG1 THR B 81 -7.511 -26.203 -1.149 1.00 0.00 O ATOM 2496 CG2 THR B 81 -9.050 -24.484 -0.626 1.00 0.00 C ATOM 0 H THR B 81 -8.693 -23.977 1.945 1.00 0.00 H new ATOM 0 HA THR B 81 -6.627 -26.002 1.339 1.00 0.00 H new ATOM 0 HB THR B 81 -8.860 -26.325 0.425 1.00 0.00 H new ATOM 0 HG1 THR B 81 -8.154 -26.491 -1.830 1.00 0.00 H new ATOM 0 HG21 THR B 81 -9.722 -24.879 -1.388 1.00 0.00 H new ATOM 0 HG22 THR B 81 -9.635 -24.036 0.177 1.00 0.00 H new ATOM 0 HG23 THR B 81 -8.403 -23.727 -1.070 1.00 0.00 H new ATOM 2504 N GLY B 82 -6.797 -22.877 0.274 1.00 0.00 N ATOM 2505 CA GLY B 82 -5.989 -21.797 -0.256 1.00 0.00 C ATOM 2506 C GLY B 82 -6.817 -20.760 -0.986 1.00 0.00 C ATOM 2507 O GLY B 82 -7.687 -20.120 -0.393 1.00 0.00 O ATOM 0 H GLY B 82 -7.762 -22.625 0.488 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -5.448 -21.317 0.560 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -5.242 -22.206 -0.936 1.00 0.00 H new ATOM 2511 N CYS B 83 -6.547 -20.594 -2.274 1.00 0.00 N ATOM 2512 CA CYS B 83 -7.274 -19.627 -3.091 1.00 0.00 C ATOM 2513 C CYS B 83 -8.026 -20.329 -4.221 1.00 0.00 C ATOM 2514 O CYS B 83 -7.473 -21.195 -4.899 1.00 0.00 O ATOM 2515 CB CYS B 83 -6.310 -18.591 -3.671 1.00 0.00 C ATOM 2516 SG CYS B 83 -7.122 -17.261 -4.588 1.00 0.00 S ATOM 0 H CYS B 83 -5.830 -21.116 -2.777 1.00 0.00 H new ATOM 0 HA CYS B 83 -7.999 -19.121 -2.454 1.00 0.00 H new ATOM 0 HB2 CYS B 83 -5.729 -18.155 -2.858 1.00 0.00 H new ATOM 0 HB3 CYS B 83 -5.605 -19.096 -4.332 1.00 0.00 H new ATOM 2521 N PRO B 84 -9.303 -19.965 -4.441 1.00 0.00 N ATOM 2522 CA PRO B 84 -10.123 -20.568 -5.493 1.00 0.00 C ATOM 2523 C PRO B 84 -9.798 -20.019 -6.881 1.00 0.00 C ATOM 2524 O PRO B 84 -10.168 -20.613 -7.893 1.00 0.00 O ATOM 2525 CB PRO B 84 -11.543 -20.181 -5.086 1.00 0.00 C ATOM 2526 CG PRO B 84 -11.385 -18.882 -4.374 1.00 0.00 C ATOM 2527 CD PRO B 84 -10.049 -18.942 -3.680 1.00 0.00 C ATOM 0 HA PRO B 84 -9.958 -21.643 -5.573 1.00 0.00 H new ATOM 0 HB2 PRO B 84 -12.192 -20.081 -5.956 1.00 0.00 H new ATOM 0 HB3 PRO B 84 -11.991 -20.936 -4.440 1.00 0.00 H new ATOM 0 HG2 PRO B 84 -11.423 -18.047 -5.074 1.00 0.00 H new ATOM 0 HG3 PRO B 84 -12.191 -18.732 -3.655 1.00 0.00 H new ATOM 0 HD2 PRO B 84 -9.542 -17.977 -3.703 1.00 0.00 H new ATOM 0 HD3 PRO B 84 -10.155 -19.221 -2.632 1.00 0.00 H new ATOM 2535 N VAL B 85 -9.112 -18.880 -6.924 1.00 0.00 N ATOM 2536 CA VAL B 85 -8.749 -18.258 -8.191 1.00 0.00 C ATOM 2537 C VAL B 85 -7.330 -18.633 -8.607 1.00 0.00 C ATOM 2538 O VAL B 85 -7.128 -19.327 -9.603 1.00 0.00 O ATOM 2539 CB VAL B 85 -8.859 -16.723 -8.115 1.00 0.00 C ATOM 2540 CG1 VAL B 85 -8.683 -16.106 -9.495 1.00 0.00 C ATOM 2541 CG2 VAL B 85 -10.190 -16.313 -7.506 1.00 0.00 C ATOM 0 H VAL B 85 -8.798 -18.371 -6.098 1.00 0.00 H new ATOM 0 HA VAL B 85 -9.452 -18.631 -8.936 1.00 0.00 H new ATOM 0 HB VAL B 85 -8.062 -16.351 -7.472 1.00 0.00 H new ATOM 0 HG11 VAL B 85 -8.764 -15.021 -9.422 1.00 0.00 H new ATOM 0 HG12 VAL B 85 -7.702 -16.371 -9.890 1.00 0.00 H new ATOM 0 HG13 VAL B 85 -9.457 -16.483 -10.164 1.00 0.00 H new ATOM 0 HG21 VAL B 85 -10.250 -15.226 -7.460 1.00 0.00 H new ATOM 0 HG22 VAL B 85 -11.005 -16.696 -8.121 1.00 0.00 H new ATOM 0 HG23 VAL B 85 -10.271 -16.723 -6.499 1.00 0.00 H new ATOM 2551 N CYS B 86 -6.350 -18.167 -7.840 1.00 0.00 N ATOM 2552 CA CYS B 86 -4.949 -18.452 -8.130 1.00 0.00 C ATOM 2553 C CYS B 86 -4.612 -19.916 -7.856 1.00 0.00 C ATOM 2554 O CYS B 86 -3.568 -20.409 -8.282 1.00 0.00 O ATOM 2555 CB CYS B 86 -4.044 -17.544 -7.296 1.00 0.00 C ATOM 2556 SG CYS B 86 -4.492 -15.793 -7.365 1.00 0.00 S ATOM 0 H CYS B 86 -6.500 -17.590 -7.012 1.00 0.00 H new ATOM 0 HA CYS B 86 -4.779 -18.257 -9.189 1.00 0.00 H new ATOM 0 HB2 CYS B 86 -4.072 -17.875 -6.258 1.00 0.00 H new ATOM 0 HB3 CYS B 86 -3.016 -17.659 -7.639 1.00 0.00 H new ATOM 2561 N TYR B 87 -5.497 -20.608 -7.142 1.00 0.00 N ATOM 2562 CA TYR B 87 -5.281 -22.012 -6.816 1.00 0.00 C ATOM 2563 C TYR B 87 -4.026 -22.185 -5.966 1.00 0.00 C ATOM 2564 O TYR B 87 -3.395 -23.242 -5.983 1.00 0.00 O ATOM 2565 CB TYR B 87 -5.164 -22.843 -8.095 1.00 0.00 C ATOM 2566 CG TYR B 87 -6.484 -23.404 -8.576 1.00 0.00 C ATOM 2567 CD1 TYR B 87 -7.509 -22.561 -8.990 1.00 0.00 C ATOM 2568 CD2 TYR B 87 -6.706 -24.775 -8.616 1.00 0.00 C ATOM 2569 CE1 TYR B 87 -8.716 -23.069 -9.430 1.00 0.00 C ATOM 2570 CE2 TYR B 87 -7.910 -25.291 -9.055 1.00 0.00 C ATOM 2571 CZ TYR B 87 -8.911 -24.434 -9.461 1.00 0.00 C ATOM 2572 OH TYR B 87 -10.112 -24.944 -9.899 1.00 0.00 O ATOM 0 H TYR B 87 -6.368 -20.219 -6.780 1.00 0.00 H new ATOM 0 HA TYR B 87 -6.139 -22.362 -6.242 1.00 0.00 H new ATOM 0 HB2 TYR B 87 -4.733 -22.224 -8.882 1.00 0.00 H new ATOM 0 HB3 TYR B 87 -4.471 -23.666 -7.921 1.00 0.00 H new ATOM 0 HD1 TYR B 87 -7.359 -21.492 -8.967 1.00 0.00 H new ATOM 0 HD2 TYR B 87 -5.924 -25.449 -8.298 1.00 0.00 H new ATOM 0 HE1 TYR B 87 -9.503 -22.401 -9.748 1.00 0.00 H new ATOM 0 HE2 TYR B 87 -8.066 -26.359 -9.080 1.00 0.00 H new ATOM 0 HH TYR B 87 -10.086 -25.923 -9.860 1.00 0.00 H new ATOM 2582 N THR B 88 -3.669 -21.140 -5.226 1.00 0.00 N ATOM 2583 CA THR B 88 -2.488 -21.178 -4.371 1.00 0.00 C ATOM 2584 C THR B 88 -2.859 -21.597 -2.949 1.00 0.00 C ATOM 2585 O THR B 88 -3.770 -21.028 -2.346 1.00 0.00 O ATOM 2586 CB THR B 88 -1.805 -19.809 -4.349 1.00 0.00 C ATOM 2587 OG1 THR B 88 -1.473 -19.393 -5.661 1.00 0.00 O ATOM 2588 CG2 THR B 88 -0.537 -19.786 -3.524 1.00 0.00 C ATOM 0 H THR B 88 -4.180 -20.258 -5.201 1.00 0.00 H new ATOM 0 HA THR B 88 -1.797 -21.915 -4.780 1.00 0.00 H new ATOM 0 HB THR B 88 -2.528 -19.133 -3.892 1.00 0.00 H new ATOM 0 HG1 THR B 88 -1.039 -18.515 -5.626 1.00 0.00 H new ATOM 0 HG21 THR B 88 -0.104 -18.786 -3.551 1.00 0.00 H new ATOM 0 HG22 THR B 88 -0.769 -20.053 -2.493 1.00 0.00 H new ATOM 0 HG23 THR B 88 0.176 -20.502 -3.933 1.00 0.00 H new ATOM 2596 N PRO B 89 -2.159 -22.602 -2.389 1.00 0.00 N ATOM 2597 CA PRO B 89 -2.430 -23.087 -1.031 1.00 0.00 C ATOM 2598 C PRO B 89 -2.395 -21.965 0.002 1.00 0.00 C ATOM 2599 O PRO B 89 -1.582 -21.046 -0.095 1.00 0.00 O ATOM 2600 CB PRO B 89 -1.296 -24.084 -0.773 1.00 0.00 C ATOM 2601 CG PRO B 89 -0.863 -24.528 -2.126 1.00 0.00 C ATOM 2602 CD PRO B 89 -1.056 -23.343 -3.030 1.00 0.00 C ATOM 0 HA PRO B 89 -3.425 -23.523 -0.947 1.00 0.00 H new ATOM 0 HB2 PRO B 89 -0.475 -23.617 -0.229 1.00 0.00 H new ATOM 0 HB3 PRO B 89 -1.639 -24.926 -0.172 1.00 0.00 H new ATOM 0 HG2 PRO B 89 0.179 -24.847 -2.117 1.00 0.00 H new ATOM 0 HG3 PRO B 89 -1.454 -25.379 -2.466 1.00 0.00 H new ATOM 0 HD2 PRO B 89 -0.152 -22.738 -3.099 1.00 0.00 H new ATOM 0 HD3 PRO B 89 -1.313 -23.649 -4.044 1.00 0.00 H new ATOM 2610 N ALA B 90 -3.281 -22.048 0.990 1.00 0.00 N ATOM 2611 CA ALA B 90 -3.347 -21.038 2.040 1.00 0.00 C ATOM 2612 C ALA B 90 -2.114 -21.099 2.934 1.00 0.00 C ATOM 2613 O ALA B 90 -1.894 -22.085 3.638 1.00 0.00 O ATOM 2614 CB ALA B 90 -4.613 -21.219 2.867 1.00 0.00 C ATOM 0 H ALA B 90 -3.961 -22.802 1.085 1.00 0.00 H new ATOM 0 HA ALA B 90 -3.373 -20.056 1.568 1.00 0.00 H new ATOM 0 HB1 ALA B 90 -4.650 -20.459 3.647 1.00 0.00 H new ATOM 0 HB2 ALA B 90 -5.486 -21.120 2.222 1.00 0.00 H new ATOM 0 HB3 ALA B 90 -4.610 -22.208 3.324 1.00 0.00 H new ATOM 2620 N TRP B 91 -1.310 -20.041 2.901 1.00 0.00 N ATOM 2621 CA TRP B 91 -0.097 -19.977 3.710 1.00 0.00 C ATOM 2622 C TRP B 91 -0.352 -19.268 5.038 1.00 0.00 C ATOM 2623 O TRP B 91 0.585 -18.848 5.716 1.00 0.00 O ATOM 2624 CB TRP B 91 1.012 -19.256 2.943 1.00 0.00 C ATOM 2625 CG TRP B 91 2.380 -19.796 3.229 1.00 0.00 C ATOM 2626 CD1 TRP B 91 3.142 -19.552 4.334 1.00 0.00 C ATOM 2627 CD2 TRP B 91 3.148 -20.673 2.396 1.00 0.00 C ATOM 2628 NE1 TRP B 91 4.338 -20.222 4.240 1.00 0.00 N ATOM 2629 CE2 TRP B 91 4.365 -20.918 3.060 1.00 0.00 C ATOM 2630 CE3 TRP B 91 2.923 -21.276 1.155 1.00 0.00 C ATOM 2631 CZ2 TRP B 91 5.354 -21.738 2.522 1.00 0.00 C ATOM 2632 CZ3 TRP B 91 3.906 -22.090 0.623 1.00 0.00 C ATOM 2633 CH2 TRP B 91 5.107 -22.316 1.307 1.00 0.00 C ATOM 0 H TRP B 91 -1.476 -19.217 2.323 1.00 0.00 H new ATOM 0 HA TRP B 91 0.216 -20.999 3.923 1.00 0.00 H new ATOM 0 HB2 TRP B 91 0.815 -19.334 1.874 1.00 0.00 H new ATOM 0 HB3 TRP B 91 0.988 -18.196 3.195 1.00 0.00 H new ATOM 0 HD1 TRP B 91 2.848 -18.924 5.162 1.00 0.00 H new ATOM 0 HE1 TRP B 91 5.084 -20.204 4.935 1.00 0.00 H new ATOM 0 HE3 TRP B 91 1.999 -21.109 0.622 1.00 0.00 H new ATOM 0 HZ2 TRP B 91 6.283 -21.911 3.045 1.00 0.00 H new ATOM 0 HZ3 TRP B 91 3.745 -22.559 -0.336 1.00 0.00 H new ATOM 0 HH2 TRP B 91 5.854 -22.960 0.866 1.00 0.00 H new ATOM 2644 N ILE B 92 -1.623 -19.137 5.405 1.00 0.00 N ATOM 2645 CA ILE B 92 -1.994 -18.478 6.651 1.00 0.00 C ATOM 2646 C ILE B 92 -2.723 -19.437 7.585 1.00 0.00 C ATOM 2647 O ILE B 92 -2.489 -19.439 8.793 1.00 0.00 O ATOM 2648 CB ILE B 92 -2.890 -17.251 6.394 1.00 0.00 C ATOM 2649 CG1 ILE B 92 -4.055 -17.626 5.478 1.00 0.00 C ATOM 2650 CG2 ILE B 92 -2.074 -16.118 5.790 1.00 0.00 C ATOM 2651 CD1 ILE B 92 -4.980 -16.468 5.171 1.00 0.00 C ATOM 0 H ILE B 92 -2.413 -19.479 4.857 1.00 0.00 H new ATOM 0 HA ILE B 92 -1.067 -18.150 7.122 1.00 0.00 H new ATOM 0 HB ILE B 92 -3.298 -16.910 7.346 1.00 0.00 H new ATOM 0 HG12 ILE B 92 -3.659 -18.021 4.543 1.00 0.00 H new ATOM 0 HG13 ILE B 92 -4.630 -18.426 5.944 1.00 0.00 H new ATOM 0 HG21 ILE B 92 -2.720 -15.258 5.614 1.00 0.00 H new ATOM 0 HG22 ILE B 92 -1.276 -15.838 6.478 1.00 0.00 H new ATOM 0 HG23 ILE B 92 -1.640 -16.445 4.845 1.00 0.00 H new ATOM 0 HD11 ILE B 92 -5.783 -16.807 4.516 1.00 0.00 H new ATOM 0 HD12 ILE B 92 -5.405 -16.086 6.099 1.00 0.00 H new ATOM 0 HD13 ILE B 92 -4.419 -15.675 4.676 1.00 0.00 H new ATOM 2663 N GLN B 93 -3.611 -20.245 7.017 1.00 0.00 N ATOM 2664 CA GLN B 93 -4.381 -21.206 7.799 1.00 0.00 C ATOM 2665 C GLN B 93 -5.246 -20.502 8.842 1.00 0.00 C ATOM 2666 O GLN B 93 -5.741 -21.130 9.778 1.00 0.00 O ATOM 2667 CB GLN B 93 -3.445 -22.200 8.487 1.00 0.00 C ATOM 2668 CG GLN B 93 -2.804 -23.194 7.533 1.00 0.00 C ATOM 2669 CD GLN B 93 -2.331 -24.453 8.233 1.00 0.00 C ATOM 2670 OE1 GLN B 93 -1.919 -24.414 9.392 1.00 0.00 O ATOM 2671 NE2 GLN B 93 -2.387 -25.578 7.529 1.00 0.00 N ATOM 0 H GLN B 93 -3.816 -20.254 6.018 1.00 0.00 H new ATOM 0 HA GLN B 93 -5.038 -21.744 7.115 1.00 0.00 H new ATOM 0 HB2 GLN B 93 -2.660 -21.648 9.005 1.00 0.00 H new ATOM 0 HB3 GLN B 93 -4.004 -22.747 9.246 1.00 0.00 H new ATOM 0 HG2 GLN B 93 -3.521 -23.462 6.757 1.00 0.00 H new ATOM 0 HG3 GLN B 93 -1.958 -22.720 7.035 1.00 0.00 H new ATOM 0 HE21 GLN B 93 -2.736 -25.563 6.571 1.00 0.00 H new ATOM 0 HE22 GLN B 93 -2.081 -26.457 7.947 1.00 0.00 H new ATOM 2680 N ASP B 94 -5.426 -19.193 8.676 1.00 0.00 N ATOM 2681 CA ASP B 94 -6.232 -18.409 9.604 1.00 0.00 C ATOM 2682 C ASP B 94 -6.668 -17.094 8.966 1.00 0.00 C ATOM 2683 O ASP B 94 -6.392 -16.841 7.793 1.00 0.00 O ATOM 2684 CB ASP B 94 -5.445 -18.130 10.887 1.00 0.00 C ATOM 2685 CG ASP B 94 -6.326 -18.154 12.121 1.00 0.00 C ATOM 2686 OD1 ASP B 94 -7.298 -17.372 12.172 1.00 0.00 O ATOM 2687 OD2 ASP B 94 -6.043 -18.954 13.037 1.00 0.00 O ATOM 0 H ASP B 94 -5.024 -18.655 7.908 1.00 0.00 H new ATOM 0 HA ASP B 94 -7.123 -18.987 9.851 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -4.654 -18.872 10.994 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -4.960 -17.157 10.809 1.00 0.00 H new ATOM 2692 N LEU B 95 -7.350 -16.261 9.744 1.00 0.00 N ATOM 2693 CA LEU B 95 -7.823 -14.972 9.252 1.00 0.00 C ATOM 2694 C LEU B 95 -7.038 -13.827 9.882 1.00 0.00 C ATOM 2695 O LEU B 95 -7.404 -13.318 10.942 1.00 0.00 O ATOM 2696 CB LEU B 95 -9.315 -14.807 9.545 1.00 0.00 C ATOM 2697 CG LEU B 95 -10.249 -15.512 8.561 1.00 0.00 C ATOM 2698 CD1 LEU B 95 -11.684 -15.465 9.062 1.00 0.00 C ATOM 2699 CD2 LEU B 95 -10.145 -14.880 7.181 1.00 0.00 C ATOM 0 H LEU B 95 -7.588 -16.455 10.717 1.00 0.00 H new ATOM 0 HA LEU B 95 -7.667 -14.944 8.174 1.00 0.00 H new ATOM 0 HB2 LEU B 95 -9.517 -15.184 10.548 1.00 0.00 H new ATOM 0 HB3 LEU B 95 -9.553 -13.743 9.550 1.00 0.00 H new ATOM 0 HG LEU B 95 -9.945 -16.556 8.485 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -12.335 -15.971 8.349 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -11.748 -15.963 10.029 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -11.999 -14.427 9.167 1.00 0.00 H new ATOM 0 HD21 LEU B 95 -10.817 -15.394 6.494 1.00 0.00 H new ATOM 0 HD22 LEU B 95 -10.423 -13.828 7.241 1.00 0.00 H new ATOM 0 HD23 LEU B 95 -9.121 -14.964 6.818 1.00 0.00 H new ATOM 2711 N LYS B 96 -5.956 -13.425 9.222 1.00 0.00 N ATOM 2712 CA LYS B 96 -5.118 -12.340 9.716 1.00 0.00 C ATOM 2713 C LYS B 96 -5.674 -10.986 9.289 1.00 0.00 C ATOM 2714 O LYS B 96 -6.772 -10.901 8.740 1.00 0.00 O ATOM 2715 CB LYS B 96 -3.685 -12.500 9.205 1.00 0.00 C ATOM 2716 CG LYS B 96 -3.125 -13.900 9.392 1.00 0.00 C ATOM 2717 CD LYS B 96 -1.629 -13.871 9.664 1.00 0.00 C ATOM 2718 CE LYS B 96 -1.230 -14.918 10.690 1.00 0.00 C ATOM 2719 NZ LYS B 96 -1.645 -16.287 10.279 1.00 0.00 N ATOM 0 H LYS B 96 -5.640 -13.835 8.343 1.00 0.00 H new ATOM 0 HA LYS B 96 -5.115 -12.384 10.805 1.00 0.00 H new ATOM 0 HB2 LYS B 96 -3.655 -12.244 8.146 1.00 0.00 H new ATOM 0 HB3 LYS B 96 -3.042 -11.788 9.723 1.00 0.00 H new ATOM 0 HG2 LYS B 96 -3.637 -14.390 10.220 1.00 0.00 H new ATOM 0 HG3 LYS B 96 -3.322 -14.494 8.499 1.00 0.00 H new ATOM 0 HD2 LYS B 96 -1.086 -14.045 8.735 1.00 0.00 H new ATOM 0 HD3 LYS B 96 -1.342 -12.882 10.021 1.00 0.00 H new ATOM 0 HE2 LYS B 96 -0.150 -14.894 10.832 1.00 0.00 H new ATOM 0 HE3 LYS B 96 -1.683 -14.675 11.651 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 -1.197 -16.988 10.904 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 -2.679 -16.372 10.349 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 -1.349 -16.459 9.297 1.00 0.00 H new ATOM 2733 N ILE B 97 -4.912 -9.929 9.546 1.00 0.00 N ATOM 2734 CA ILE B 97 -5.332 -8.580 9.189 1.00 0.00 C ATOM 2735 C ILE B 97 -4.217 -7.828 8.469 1.00 0.00 C ATOM 2736 O ILE B 97 -3.059 -7.868 8.884 1.00 0.00 O ATOM 2737 CB ILE B 97 -5.753 -7.779 10.433 1.00 0.00 C ATOM 2738 CG1 ILE B 97 -6.732 -8.593 11.283 1.00 0.00 C ATOM 2739 CG2 ILE B 97 -6.371 -6.449 10.027 1.00 0.00 C ATOM 2740 CD1 ILE B 97 -8.055 -8.853 10.598 1.00 0.00 C ATOM 0 H ILE B 97 -4.000 -9.981 10.000 1.00 0.00 H new ATOM 0 HA ILE B 97 -6.188 -8.681 8.521 1.00 0.00 H new ATOM 0 HB ILE B 97 -4.865 -7.574 11.031 1.00 0.00 H new ATOM 0 HG12 ILE B 97 -6.271 -9.547 11.540 1.00 0.00 H new ATOM 0 HG13 ILE B 97 -6.914 -8.065 12.219 1.00 0.00 H new ATOM 0 HG21 ILE B 97 -6.663 -5.896 10.920 1.00 0.00 H new ATOM 0 HG22 ILE B 97 -5.643 -5.867 9.461 1.00 0.00 H new ATOM 0 HG23 ILE B 97 -7.250 -6.630 9.409 1.00 0.00 H new ATOM 0 HD11 ILE B 97 -8.698 -9.435 11.258 1.00 0.00 H new ATOM 0 HD12 ILE B 97 -8.537 -7.903 10.365 1.00 0.00 H new ATOM 0 HD13 ILE B 97 -7.884 -9.409 9.676 1.00 0.00 H new ATOM 2752 N ASN B 98 -4.575 -7.141 7.389 1.00 0.00 N ATOM 2753 CA ASN B 98 -3.606 -6.376 6.613 1.00 0.00 C ATOM 2754 C ASN B 98 -3.341 -5.022 7.263 1.00 0.00 C ATOM 2755 O ASN B 98 -3.910 -4.007 6.861 1.00 0.00 O ATOM 2756 CB ASN B 98 -4.108 -6.179 5.182 1.00 0.00 C ATOM 2757 CG ASN B 98 -3.884 -7.404 4.317 1.00 0.00 C ATOM 2758 OD1 ASN B 98 -4.648 -8.368 4.377 1.00 0.00 O ATOM 2759 ND2 ASN B 98 -2.833 -7.374 3.506 1.00 0.00 N ATOM 0 H ASN B 98 -5.529 -7.098 7.031 1.00 0.00 H new ATOM 0 HA ASN B 98 -2.672 -6.937 6.587 1.00 0.00 H new ATOM 0 HB2 ASN B 98 -5.172 -5.942 5.202 1.00 0.00 H new ATOM 0 HB3 ASN B 98 -3.599 -5.325 4.736 1.00 0.00 H new ATOM 0 HD21 ASN B 98 -2.633 -8.170 2.901 1.00 0.00 H new ATOM 0 HD22 ASN B 98 -2.226 -6.555 3.488 1.00 0.00 H new ATOM 2766 N ARG B 99 -2.477 -5.015 8.273 1.00 0.00 N ATOM 2767 CA ARG B 99 -2.139 -3.787 8.983 1.00 0.00 C ATOM 2768 C ARG B 99 -1.599 -2.728 8.026 1.00 0.00 C ATOM 2769 O ARG B 99 -1.798 -1.531 8.234 1.00 0.00 O ATOM 2770 CB ARG B 99 -1.108 -4.074 10.077 1.00 0.00 C ATOM 2771 CG ARG B 99 -1.636 -4.966 11.190 1.00 0.00 C ATOM 2772 CD ARG B 99 -1.111 -6.388 11.062 1.00 0.00 C ATOM 2773 NE ARG B 99 -0.814 -6.981 12.364 1.00 0.00 N ATOM 2774 CZ ARG B 99 -0.655 -8.287 12.564 1.00 0.00 C ATOM 2775 NH1 ARG B 99 -0.763 -9.139 11.552 1.00 0.00 N ATOM 2776 NH2 ARG B 99 -0.387 -8.743 13.781 1.00 0.00 N ATOM 0 H ARG B 99 -1.998 -5.847 8.618 1.00 0.00 H new ATOM 0 HA ARG B 99 -3.051 -3.402 9.440 1.00 0.00 H new ATOM 0 HB2 ARG B 99 -0.235 -4.546 9.627 1.00 0.00 H new ATOM 0 HB3 ARG B 99 -0.774 -3.130 10.507 1.00 0.00 H new ATOM 0 HG2 ARG B 99 -1.344 -4.555 12.156 1.00 0.00 H new ATOM 0 HG3 ARG B 99 -2.726 -4.976 11.164 1.00 0.00 H new ATOM 0 HD2 ARG B 99 -1.848 -7.001 10.544 1.00 0.00 H new ATOM 0 HD3 ARG B 99 -0.209 -6.388 10.449 1.00 0.00 H new ATOM 0 HE ARG B 99 -0.723 -6.358 13.166 1.00 0.00 H new ATOM 0 HH11 ARG B 99 -0.969 -8.794 10.615 1.00 0.00 H new ATOM 0 HH12 ARG B 99 -0.640 -10.139 11.712 1.00 0.00 H new ATOM 0 HH21 ARG B 99 -0.303 -8.093 14.562 1.00 0.00 H new ATOM 0 HH22 ARG B 99 -0.265 -9.744 13.935 1.00 0.00 H new ATOM 2790 N GLN B 100 -0.915 -3.175 6.978 1.00 0.00 N ATOM 2791 CA GLN B 100 -0.347 -2.261 5.994 1.00 0.00 C ATOM 2792 C GLN B 100 -1.402 -1.825 4.982 1.00 0.00 C ATOM 2793 O GLN B 100 -1.640 -0.632 4.797 1.00 0.00 O ATOM 2794 CB GLN B 100 0.833 -2.916 5.274 1.00 0.00 C ATOM 2795 CG GLN B 100 2.141 -2.817 6.042 1.00 0.00 C ATOM 2796 CD GLN B 100 2.818 -1.470 5.875 1.00 0.00 C ATOM 2797 OE1 GLN B 100 3.728 -1.316 5.062 1.00 0.00 O ATOM 2798 NE2 GLN B 100 2.377 -0.485 6.652 1.00 0.00 N ATOM 0 H GLN B 100 -0.741 -4.162 6.789 1.00 0.00 H new ATOM 0 HA GLN B 100 0.009 -1.376 6.522 1.00 0.00 H new ATOM 0 HB2 GLN B 100 0.603 -3.967 5.097 1.00 0.00 H new ATOM 0 HB3 GLN B 100 0.958 -2.448 4.297 1.00 0.00 H new ATOM 0 HG2 GLN B 100 1.950 -2.994 7.100 1.00 0.00 H new ATOM 0 HG3 GLN B 100 2.816 -3.603 5.704 1.00 0.00 H new ATOM 0 HE21 GLN B 100 1.619 -0.657 7.313 1.00 0.00 H new ATOM 0 HE22 GLN B 100 2.796 0.443 6.587 1.00 0.00 H new ATOM 2807 N LEU B 101 -2.032 -2.796 4.329 1.00 0.00 N ATOM 2808 CA LEU B 101 -3.060 -2.501 3.338 1.00 0.00 C ATOM 2809 C LEU B 101 -4.221 -1.743 3.975 1.00 0.00 C ATOM 2810 O LEU B 101 -4.752 -0.799 3.391 1.00 0.00 O ATOM 2811 CB LEU B 101 -3.564 -3.792 2.688 1.00 0.00 C ATOM 2812 CG LEU B 101 -3.600 -3.771 1.158 1.00 0.00 C ATOM 2813 CD1 LEU B 101 -3.678 -5.186 0.607 1.00 0.00 C ATOM 2814 CD2 LEU B 101 -4.772 -2.938 0.665 1.00 0.00 C ATOM 0 H LEU B 101 -1.850 -3.790 4.467 1.00 0.00 H new ATOM 0 HA LEU B 101 -2.618 -1.871 2.566 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -2.928 -4.616 3.011 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -4.568 -4.000 3.058 1.00 0.00 H new ATOM 0 HG LEU B 101 -2.679 -3.314 0.797 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -3.703 -5.151 -0.482 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -2.805 -5.752 0.932 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -4.582 -5.671 0.975 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -4.782 -2.934 -0.425 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -5.704 -3.366 1.035 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -4.671 -1.916 1.031 1.00 0.00 H new ATOM 2826 N ASP B 102 -4.605 -2.158 5.179 1.00 0.00 N ATOM 2827 CA ASP B 102 -5.699 -1.512 5.895 1.00 0.00 C ATOM 2828 C ASP B 102 -5.394 -0.036 6.121 1.00 0.00 C ATOM 2829 O ASP B 102 -6.224 0.832 5.844 1.00 0.00 O ATOM 2830 CB ASP B 102 -5.940 -2.206 7.237 1.00 0.00 C ATOM 2831 CG ASP B 102 -7.114 -1.615 7.993 1.00 0.00 C ATOM 2832 OD1 ASP B 102 -8.059 -1.131 7.336 1.00 0.00 O ATOM 2833 OD2 ASP B 102 -7.089 -1.637 9.241 1.00 0.00 O ATOM 0 H ASP B 102 -4.175 -2.937 5.678 1.00 0.00 H new ATOM 0 HA ASP B 102 -6.600 -1.594 5.287 1.00 0.00 H new ATOM 0 HB2 ASP B 102 -6.119 -3.268 7.067 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -5.041 -2.128 7.849 1.00 0.00 H new ATOM 2838 N SER B 103 -4.192 0.243 6.617 1.00 0.00 N ATOM 2839 CA SER B 103 -3.771 1.616 6.871 1.00 0.00 C ATOM 2840 C SER B 103 -3.865 2.449 5.597 1.00 0.00 C ATOM 2841 O SER B 103 -4.112 3.653 5.646 1.00 0.00 O ATOM 2842 CB SER B 103 -2.338 1.642 7.407 1.00 0.00 C ATOM 2843 OG SER B 103 -2.324 1.653 8.825 1.00 0.00 O ATOM 0 H SER B 103 -3.494 -0.463 6.851 1.00 0.00 H new ATOM 0 HA SER B 103 -4.437 2.046 7.620 1.00 0.00 H new ATOM 0 HB2 SER B 103 -1.794 0.771 7.042 1.00 0.00 H new ATOM 0 HB3 SER B 103 -1.821 2.523 7.028 1.00 0.00 H new ATOM 0 HG SER B 103 -1.397 1.668 9.143 1.00 0.00 H new ATOM 2849 N MET B 104 -3.672 1.793 4.456 1.00 0.00 N ATOM 2850 CA MET B 104 -3.741 2.467 3.167 1.00 0.00 C ATOM 2851 C MET B 104 -5.180 2.849 2.836 1.00 0.00 C ATOM 2852 O MET B 104 -5.431 3.865 2.190 1.00 0.00 O ATOM 2853 CB MET B 104 -3.172 1.574 2.066 1.00 0.00 C ATOM 2854 CG MET B 104 -3.175 2.229 0.695 1.00 0.00 C ATOM 2855 SD MET B 104 -2.315 1.244 -0.547 1.00 0.00 S ATOM 2856 CE MET B 104 -0.756 2.119 -0.647 1.00 0.00 C ATOM 0 H MET B 104 -3.467 0.795 4.400 1.00 0.00 H new ATOM 0 HA MET B 104 -3.143 3.377 3.227 1.00 0.00 H new ATOM 0 HB2 MET B 104 -2.150 1.296 2.325 1.00 0.00 H new ATOM 0 HB3 MET B 104 -3.751 0.652 2.021 1.00 0.00 H new ATOM 0 HG2 MET B 104 -4.205 2.390 0.376 1.00 0.00 H new ATOM 0 HG3 MET B 104 -2.705 3.210 0.764 1.00 0.00 H new ATOM 0 HE1 MET B 104 -0.262 1.875 -1.587 1.00 0.00 H new ATOM 0 HE2 MET B 104 -0.938 3.193 -0.600 1.00 0.00 H new ATOM 0 HE3 MET B 104 -0.118 1.822 0.186 1.00 0.00 H new ATOM 2866 N ILE B 105 -6.122 2.027 3.291 1.00 0.00 N ATOM 2867 CA ILE B 105 -7.538 2.280 3.049 1.00 0.00 C ATOM 2868 C ILE B 105 -7.948 3.629 3.630 1.00 0.00 C ATOM 2869 O ILE B 105 -8.541 4.459 2.943 1.00 0.00 O ATOM 2870 CB ILE B 105 -8.426 1.174 3.658 1.00 0.00 C ATOM 2871 CG1 ILE B 105 -7.985 -0.203 3.157 1.00 0.00 C ATOM 2872 CG2 ILE B 105 -9.891 1.415 3.319 1.00 0.00 C ATOM 2873 CD1 ILE B 105 -8.640 -1.352 3.891 1.00 0.00 C ATOM 0 H ILE B 105 -5.930 1.182 3.828 1.00 0.00 H new ATOM 0 HA ILE B 105 -7.683 2.286 1.969 1.00 0.00 H new ATOM 0 HB ILE B 105 -8.313 1.203 4.742 1.00 0.00 H new ATOM 0 HG12 ILE B 105 -8.213 -0.284 2.094 1.00 0.00 H new ATOM 0 HG13 ILE B 105 -6.903 -0.288 3.258 1.00 0.00 H new ATOM 0 HG21 ILE B 105 -10.501 0.625 3.757 1.00 0.00 H new ATOM 0 HG22 ILE B 105 -10.203 2.379 3.720 1.00 0.00 H new ATOM 0 HG23 ILE B 105 -10.019 1.414 2.237 1.00 0.00 H new ATOM 0 HD11 ILE B 105 -8.280 -2.297 3.483 1.00 0.00 H new ATOM 0 HD12 ILE B 105 -8.391 -1.296 4.951 1.00 0.00 H new ATOM 0 HD13 ILE B 105 -9.722 -1.292 3.769 1.00 0.00 H new ATOM 2885 N GLN B 106 -7.621 3.841 4.901 1.00 0.00 N ATOM 2886 CA GLN B 106 -7.949 5.094 5.572 1.00 0.00 C ATOM 2887 C GLN B 106 -7.256 6.267 4.888 1.00 0.00 C ATOM 2888 O GLN B 106 -7.776 7.383 4.866 1.00 0.00 O ATOM 2889 CB GLN B 106 -7.540 5.030 7.045 1.00 0.00 C ATOM 2890 CG GLN B 106 -8.631 4.494 7.958 1.00 0.00 C ATOM 2891 CD GLN B 106 -9.578 5.578 8.433 1.00 0.00 C ATOM 2892 OE1 GLN B 106 -9.287 6.297 9.388 1.00 0.00 O ATOM 2893 NE2 GLN B 106 -10.720 5.700 7.767 1.00 0.00 N ATOM 0 H GLN B 106 -7.131 3.164 5.485 1.00 0.00 H new ATOM 0 HA GLN B 106 -9.027 5.244 5.510 1.00 0.00 H new ATOM 0 HB2 GLN B 106 -6.656 4.400 7.141 1.00 0.00 H new ATOM 0 HB3 GLN B 106 -7.257 6.028 7.378 1.00 0.00 H new ATOM 0 HG2 GLN B 106 -9.198 3.727 7.430 1.00 0.00 H new ATOM 0 HG3 GLN B 106 -8.173 4.013 8.822 1.00 0.00 H new ATOM 0 HE21 GLN B 106 -10.920 5.082 6.981 1.00 0.00 H new ATOM 0 HE22 GLN B 106 -11.397 6.412 8.042 1.00 0.00 H new ATOM 2902 N LEU B 107 -6.079 6.004 4.328 1.00 0.00 N ATOM 2903 CA LEU B 107 -5.311 7.033 3.639 1.00 0.00 C ATOM 2904 C LEU B 107 -6.078 7.563 2.430 1.00 0.00 C ATOM 2905 O LEU B 107 -6.244 8.773 2.268 1.00 0.00 O ATOM 2906 CB LEU B 107 -3.955 6.473 3.199 1.00 0.00 C ATOM 2907 CG LEU B 107 -2.742 7.087 3.899 1.00 0.00 C ATOM 2908 CD1 LEU B 107 -2.594 8.552 3.520 1.00 0.00 C ATOM 2909 CD2 LEU B 107 -2.863 6.933 5.408 1.00 0.00 C ATOM 0 H LEU B 107 -5.637 5.085 4.339 1.00 0.00 H new ATOM 0 HA LEU B 107 -5.147 7.859 4.330 1.00 0.00 H new ATOM 0 HB2 LEU B 107 -3.950 5.397 3.374 1.00 0.00 H new ATOM 0 HB3 LEU B 107 -3.849 6.622 2.124 1.00 0.00 H new ATOM 0 HG LEU B 107 -1.848 6.556 3.571 1.00 0.00 H new ATOM 0 HD11 LEU B 107 -1.726 8.973 4.027 1.00 0.00 H new ATOM 0 HD12 LEU B 107 -2.461 8.637 2.442 1.00 0.00 H new ATOM 0 HD13 LEU B 107 -3.489 9.097 3.819 1.00 0.00 H new ATOM 0 HD21 LEU B 107 -1.991 7.375 5.890 1.00 0.00 H new ATOM 0 HD22 LEU B 107 -3.765 7.438 5.754 1.00 0.00 H new ATOM 0 HD23 LEU B 107 -2.920 5.875 5.662 1.00 0.00 H new ATOM 2921 N CYS B 108 -6.545 6.648 1.586 1.00 0.00 N ATOM 2922 CA CYS B 108 -7.296 7.022 0.393 1.00 0.00 C ATOM 2923 C CYS B 108 -8.539 7.823 0.764 1.00 0.00 C ATOM 2924 O CYS B 108 -8.975 8.696 0.012 1.00 0.00 O ATOM 2925 CB CYS B 108 -7.696 5.773 -0.396 1.00 0.00 C ATOM 2926 SG CYS B 108 -8.601 6.122 -1.922 1.00 0.00 S ATOM 0 H CYS B 108 -6.417 5.643 1.706 1.00 0.00 H new ATOM 0 HA CYS B 108 -6.655 7.646 -0.230 1.00 0.00 H new ATOM 0 HB2 CYS B 108 -6.797 5.208 -0.641 1.00 0.00 H new ATOM 0 HB3 CYS B 108 -8.310 5.136 0.240 1.00 0.00 H new ATOM 0 HG CYS B 108 -9.772 5.560 -1.870 1.00 0.00 H new ATOM 2932 N SER B 109 -9.105 7.523 1.928 1.00 0.00 N ATOM 2933 CA SER B 109 -10.296 8.219 2.401 1.00 0.00 C ATOM 2934 C SER B 109 -10.022 9.711 2.558 1.00 0.00 C ATOM 2935 O SER B 109 -10.855 10.546 2.205 1.00 0.00 O ATOM 2936 CB SER B 109 -10.763 7.630 3.733 1.00 0.00 C ATOM 2937 OG SER B 109 -11.749 6.631 3.532 1.00 0.00 O ATOM 0 H SER B 109 -8.758 6.803 2.561 1.00 0.00 H new ATOM 0 HA SER B 109 -11.084 8.087 1.660 1.00 0.00 H new ATOM 0 HB2 SER B 109 -9.912 7.204 4.264 1.00 0.00 H new ATOM 0 HB3 SER B 109 -11.167 8.423 4.363 1.00 0.00 H new ATOM 0 HG SER B 109 -12.030 6.269 4.399 1.00 0.00 H new ATOM 2943 N LYS B 110 -8.848 10.038 3.087 1.00 0.00 N ATOM 2944 CA LYS B 110 -8.461 11.429 3.288 1.00 0.00 C ATOM 2945 C LYS B 110 -8.442 12.182 1.963 1.00 0.00 C ATOM 2946 O LYS B 110 -9.042 13.249 1.834 1.00 0.00 O ATOM 2947 CB LYS B 110 -7.085 11.508 3.951 1.00 0.00 C ATOM 2948 CG LYS B 110 -7.077 11.044 5.398 1.00 0.00 C ATOM 2949 CD LYS B 110 -5.726 11.283 6.052 1.00 0.00 C ATOM 2950 CE LYS B 110 -4.616 10.530 5.336 1.00 0.00 C ATOM 2951 NZ LYS B 110 -3.718 9.824 6.290 1.00 0.00 N ATOM 0 H LYS B 110 -8.148 9.358 3.384 1.00 0.00 H new ATOM 0 HA LYS B 110 -9.198 11.895 3.942 1.00 0.00 H new ATOM 0 HB2 LYS B 110 -6.381 10.902 3.380 1.00 0.00 H new ATOM 0 HB3 LYS B 110 -6.729 12.537 3.907 1.00 0.00 H new ATOM 0 HG2 LYS B 110 -7.851 11.573 5.955 1.00 0.00 H new ATOM 0 HG3 LYS B 110 -7.321 9.983 5.442 1.00 0.00 H new ATOM 0 HD2 LYS B 110 -5.503 12.350 6.049 1.00 0.00 H new ATOM 0 HD3 LYS B 110 -5.765 10.969 7.095 1.00 0.00 H new ATOM 0 HE2 LYS B 110 -5.054 9.807 4.647 1.00 0.00 H new ATOM 0 HE3 LYS B 110 -4.032 11.228 4.737 1.00 0.00 H new ATOM 0 HZ1 LYS B 110 -2.818 9.600 5.819 1.00 0.00 H new ATOM 0 HZ2 LYS B 110 -3.536 10.434 7.112 1.00 0.00 H new ATOM 0 HZ3 LYS B 110 -4.171 8.943 6.606 1.00 0.00 H new ATOM 2965 N LEU B 111 -7.748 11.618 0.979 1.00 0.00 N ATOM 2966 CA LEU B 111 -7.650 12.235 -0.338 1.00 0.00 C ATOM 2967 C LEU B 111 -9.022 12.327 -0.998 1.00 0.00 C ATOM 2968 O LEU B 111 -9.319 13.291 -1.705 1.00 0.00 O ATOM 2969 CB LEU B 111 -6.694 11.437 -1.228 1.00 0.00 C ATOM 2970 CG LEU B 111 -5.243 11.921 -1.214 1.00 0.00 C ATOM 2971 CD1 LEU B 111 -4.286 10.742 -1.304 1.00 0.00 C ATOM 2972 CD2 LEU B 111 -4.997 12.897 -2.354 1.00 0.00 C ATOM 0 H LEU B 111 -7.246 10.735 1.069 1.00 0.00 H new ATOM 0 HA LEU B 111 -7.259 13.245 -0.212 1.00 0.00 H new ATOM 0 HB2 LEU B 111 -6.716 10.393 -0.915 1.00 0.00 H new ATOM 0 HB3 LEU B 111 -7.063 11.470 -2.253 1.00 0.00 H new ATOM 0 HG LEU B 111 -5.061 12.439 -0.272 1.00 0.00 H new ATOM 0 HD11 LEU B 111 -3.259 11.106 -1.293 1.00 0.00 H new ATOM 0 HD12 LEU B 111 -4.445 10.078 -0.454 1.00 0.00 H new ATOM 0 HD13 LEU B 111 -4.467 10.196 -2.230 1.00 0.00 H new ATOM 0 HD21 LEU B 111 -3.960 13.231 -2.329 1.00 0.00 H new ATOM 0 HD22 LEU B 111 -5.196 12.403 -3.305 1.00 0.00 H new ATOM 0 HD23 LEU B 111 -5.658 13.757 -2.246 1.00 0.00 H new ATOM 2984 N ARG B 112 -9.855 11.318 -0.765 1.00 0.00 N ATOM 2985 CA ARG B 112 -11.196 11.286 -1.336 1.00 0.00 C ATOM 2986 C ARG B 112 -12.005 12.502 -0.898 1.00 0.00 C ATOM 2987 O ARG B 112 -12.775 13.062 -1.678 1.00 0.00 O ATOM 2988 CB ARG B 112 -11.918 10.002 -0.922 1.00 0.00 C ATOM 2989 CG ARG B 112 -11.708 8.847 -1.887 1.00 0.00 C ATOM 2990 CD ARG B 112 -12.175 9.201 -3.290 1.00 0.00 C ATOM 2991 NE ARG B 112 -12.809 8.068 -3.959 1.00 0.00 N ATOM 2992 CZ ARG B 112 -14.060 7.676 -3.727 1.00 0.00 C ATOM 2993 NH1 ARG B 112 -14.813 8.323 -2.846 1.00 0.00 N ATOM 2994 NH2 ARG B 112 -14.560 6.635 -4.379 1.00 0.00 N ATOM 0 H ARG B 112 -9.625 10.512 -0.184 1.00 0.00 H new ATOM 0 HA ARG B 112 -11.102 11.309 -2.422 1.00 0.00 H new ATOM 0 HB2 ARG B 112 -11.573 9.704 0.068 1.00 0.00 H new ATOM 0 HB3 ARG B 112 -12.986 10.206 -0.840 1.00 0.00 H new ATOM 0 HG2 ARG B 112 -10.652 8.579 -1.911 1.00 0.00 H new ATOM 0 HG3 ARG B 112 -12.251 7.971 -1.532 1.00 0.00 H new ATOM 0 HD2 ARG B 112 -12.879 10.032 -3.239 1.00 0.00 H new ATOM 0 HD3 ARG B 112 -11.324 9.540 -3.880 1.00 0.00 H new ATOM 0 HE ARG B 112 -12.261 7.547 -4.644 1.00 0.00 H new ATOM 0 HH11 ARG B 112 -14.434 9.125 -2.343 1.00 0.00 H new ATOM 0 HH12 ARG B 112 -15.771 8.018 -2.672 1.00 0.00 H new ATOM 0 HH21 ARG B 112 -13.986 6.135 -5.058 1.00 0.00 H new ATOM 0 HH22 ARG B 112 -15.518 6.334 -4.201 1.00 0.00 H new ATOM 3008 N ASN B 113 -11.824 12.906 0.355 1.00 0.00 N ATOM 3009 CA ASN B 113 -12.536 14.056 0.898 1.00 0.00 C ATOM 3010 C ASN B 113 -11.779 15.349 0.614 1.00 0.00 C ATOM 3011 O ASN B 113 -12.382 16.410 0.448 1.00 0.00 O ATOM 3012 CB ASN B 113 -12.739 13.891 2.406 1.00 0.00 C ATOM 3013 CG ASN B 113 -14.028 13.165 2.740 1.00 0.00 C ATOM 3014 OD1 ASN B 113 -15.009 13.247 2.001 1.00 0.00 O ATOM 3015 ND2 ASN B 113 -14.031 12.449 3.858 1.00 0.00 N ATOM 0 H ASN B 113 -11.190 12.453 1.013 1.00 0.00 H new ATOM 0 HA ASN B 113 -13.509 14.112 0.411 1.00 0.00 H new ATOM 0 HB2 ASN B 113 -11.896 13.341 2.825 1.00 0.00 H new ATOM 0 HB3 ASN B 113 -12.745 14.873 2.879 1.00 0.00 H new ATOM 0 HD21 ASN B 113 -14.870 11.938 4.134 1.00 0.00 H new ATOM 0 HD22 ASN B 113 -13.195 12.409 4.441 1.00 0.00 H new ATOM 3022 N LEU B 114 -10.454 15.254 0.559 1.00 0.00 N ATOM 3023 CA LEU B 114 -9.615 16.417 0.295 1.00 0.00 C ATOM 3024 C LEU B 114 -9.861 16.958 -1.108 1.00 0.00 C ATOM 3025 O LEU B 114 -9.749 18.161 -1.350 1.00 0.00 O ATOM 3026 CB LEU B 114 -8.138 16.054 0.463 1.00 0.00 C ATOM 3027 CG LEU B 114 -7.674 15.885 1.911 1.00 0.00 C ATOM 3028 CD1 LEU B 114 -6.362 15.117 1.964 1.00 0.00 C ATOM 3029 CD2 LEU B 114 -7.529 17.240 2.585 1.00 0.00 C ATOM 0 H LEU B 114 -9.939 14.384 0.694 1.00 0.00 H new ATOM 0 HA LEU B 114 -9.876 17.193 1.014 1.00 0.00 H new ATOM 0 HB2 LEU B 114 -7.944 15.126 -0.075 1.00 0.00 H new ATOM 0 HB3 LEU B 114 -7.533 16.829 -0.008 1.00 0.00 H new ATOM 0 HG LEU B 114 -8.428 15.312 2.451 1.00 0.00 H new ATOM 0 HD11 LEU B 114 -6.047 15.006 3.002 1.00 0.00 H new ATOM 0 HD12 LEU B 114 -6.499 14.131 1.519 1.00 0.00 H new ATOM 0 HD13 LEU B 114 -5.598 15.662 1.409 1.00 0.00 H new ATOM 0 HD21 LEU B 114 -7.198 17.101 3.614 1.00 0.00 H new ATOM 0 HD22 LEU B 114 -6.795 17.838 2.046 1.00 0.00 H new ATOM 0 HD23 LEU B 114 -8.490 17.754 2.579 1.00 0.00 H new ATOM 3041 N LEU B 115 -10.197 16.064 -2.032 1.00 0.00 N ATOM 3042 CA LEU B 115 -10.458 16.453 -3.413 1.00 0.00 C ATOM 3043 C LEU B 115 -11.941 16.735 -3.628 1.00 0.00 C ATOM 3044 O LEU B 115 -12.312 17.572 -4.451 1.00 0.00 O ATOM 3045 CB LEU B 115 -9.993 15.354 -4.371 1.00 0.00 C ATOM 3046 CG LEU B 115 -8.609 14.776 -4.071 1.00 0.00 C ATOM 3047 CD1 LEU B 115 -8.558 13.299 -4.430 1.00 0.00 C ATOM 3048 CD2 LEU B 115 -7.536 15.547 -4.824 1.00 0.00 C ATOM 0 H LEU B 115 -10.295 15.065 -1.850 1.00 0.00 H new ATOM 0 HA LEU B 115 -9.899 17.366 -3.618 1.00 0.00 H new ATOM 0 HB2 LEU B 115 -10.721 14.543 -4.350 1.00 0.00 H new ATOM 0 HB3 LEU B 115 -9.991 15.754 -5.385 1.00 0.00 H new ATOM 0 HG LEU B 115 -8.418 14.875 -3.002 1.00 0.00 H new ATOM 0 HD11 LEU B 115 -7.566 12.905 -4.210 1.00 0.00 H new ATOM 0 HD12 LEU B 115 -9.302 12.757 -3.846 1.00 0.00 H new ATOM 0 HD13 LEU B 115 -8.770 13.175 -5.492 1.00 0.00 H new ATOM 0 HD21 LEU B 115 -6.558 15.123 -4.599 1.00 0.00 H new ATOM 0 HD22 LEU B 115 -7.723 15.479 -5.896 1.00 0.00 H new ATOM 0 HD23 LEU B 115 -7.557 16.593 -4.518 1.00 0.00 H new ATOM 3060 N HIS B 116 -12.787 16.032 -2.882 1.00 0.00 N ATOM 3061 CA HIS B 116 -14.230 16.208 -2.989 1.00 0.00 C ATOM 3062 C HIS B 116 -14.630 17.643 -2.664 1.00 0.00 C ATOM 3063 O HIS B 116 -15.476 18.231 -3.337 1.00 0.00 O ATOM 3064 CB HIS B 116 -14.954 15.240 -2.053 1.00 0.00 C ATOM 3065 CG HIS B 116 -15.248 13.910 -2.676 1.00 0.00 C ATOM 3066 ND1 HIS B 116 -16.273 13.117 -2.221 1.00 0.00 N ATOM 3067 CD2 HIS B 116 -14.628 13.286 -3.706 1.00 0.00 C ATOM 3068 CE1 HIS B 116 -16.255 12.034 -2.979 1.00 0.00 C ATOM 3069 NE2 HIS B 116 -15.276 12.091 -3.894 1.00 0.00 N ATOM 0 H HIS B 116 -12.497 15.335 -2.196 1.00 0.00 H new ATOM 0 HA HIS B 116 -14.521 15.994 -4.017 1.00 0.00 H new ATOM 0 HB2 HIS B 116 -14.346 15.088 -1.161 1.00 0.00 H new ATOM 0 HB3 HIS B 116 -15.890 15.694 -1.727 1.00 0.00 H new ATOM 0 HD2 HIS B 116 -13.786 13.657 -4.271 1.00 0.00 H new ATOM 0 HE1 HIS B 116 -16.942 11.207 -2.875 1.00 0.00 H new ATOM 0 HE2 HIS B 116 -15.056 11.383 -4.594 1.00 0.00 H new ATOM 3077 N ASP B 117 -14.015 18.202 -1.626 1.00 0.00 N ATOM 3078 CA ASP B 117 -14.307 19.570 -1.212 1.00 0.00 C ATOM 3079 C ASP B 117 -13.968 20.558 -2.322 1.00 0.00 C ATOM 3080 O ASP B 117 -12.874 21.123 -2.352 1.00 0.00 O ATOM 3081 CB ASP B 117 -13.523 19.918 0.055 1.00 0.00 C ATOM 3082 CG ASP B 117 -14.193 21.009 0.868 1.00 0.00 C ATOM 3083 OD1 ASP B 117 -14.081 22.190 0.483 1.00 0.00 O ATOM 3084 OD2 ASP B 117 -14.831 20.679 1.889 1.00 0.00 O ATOM 0 H ASP B 117 -13.312 17.729 -1.057 1.00 0.00 H new ATOM 0 HA ASP B 117 -15.374 19.641 -1.002 1.00 0.00 H new ATOM 0 HB2 ASP B 117 -13.416 19.024 0.670 1.00 0.00 H new ATOM 0 HB3 ASP B 117 -12.518 20.238 -0.219 1.00 0.00 H new ATOM 3089 N ASN B 118 -14.914 20.764 -3.233 1.00 0.00 N ATOM 3090 CA ASN B 118 -14.716 21.686 -4.345 1.00 0.00 C ATOM 3091 C ASN B 118 -16.053 22.132 -4.927 1.00 0.00 C ATOM 3092 O ASN B 118 -17.043 21.402 -4.867 1.00 0.00 O ATOM 3093 CB ASN B 118 -13.867 21.028 -5.435 1.00 0.00 C ATOM 3094 CG ASN B 118 -14.528 19.794 -6.017 1.00 0.00 C ATOM 3095 OD1 ASN B 118 -14.209 18.667 -5.637 1.00 0.00 O ATOM 3096 ND2 ASN B 118 -15.456 20.001 -6.945 1.00 0.00 N ATOM 0 H ASN B 118 -15.825 20.305 -3.223 1.00 0.00 H new ATOM 0 HA ASN B 118 -14.193 22.565 -3.967 1.00 0.00 H new ATOM 0 HB2 ASN B 118 -13.683 21.748 -6.232 1.00 0.00 H new ATOM 0 HB3 ASN B 118 -12.896 20.756 -5.021 1.00 0.00 H new ATOM 0 HD21 ASN B 118 -15.935 19.209 -7.372 1.00 0.00 H new ATOM 0 HD22 ASN B 118 -15.689 20.952 -7.230 1.00 0.00 H new ATOM 3103 N GLU B 119 -16.076 23.336 -5.489 1.00 0.00 N ATOM 3104 CA GLU B 119 -17.292 23.881 -6.082 1.00 0.00 C ATOM 3105 C GLU B 119 -17.199 23.887 -7.605 1.00 0.00 C ATOM 3106 O GLU B 119 -16.123 23.696 -8.171 1.00 0.00 O ATOM 3107 CB GLU B 119 -17.543 25.300 -5.569 1.00 0.00 C ATOM 3108 CG GLU B 119 -18.989 25.748 -5.705 1.00 0.00 C ATOM 3109 CD GLU B 119 -19.430 26.649 -4.567 1.00 0.00 C ATOM 3110 OE1 GLU B 119 -19.016 26.396 -3.416 1.00 0.00 O ATOM 3111 OE2 GLU B 119 -20.188 27.606 -4.827 1.00 0.00 O ATOM 0 H GLU B 119 -15.266 23.953 -5.546 1.00 0.00 H new ATOM 0 HA GLU B 119 -18.126 23.244 -5.789 1.00 0.00 H new ATOM 0 HB2 GLU B 119 -17.251 25.355 -4.520 1.00 0.00 H new ATOM 0 HB3 GLU B 119 -16.903 25.993 -6.115 1.00 0.00 H new ATOM 0 HG2 GLU B 119 -19.115 26.275 -6.651 1.00 0.00 H new ATOM 0 HG3 GLU B 119 -19.635 24.871 -5.741 1.00 0.00 H new ATOM 3118 N LEU B 120 -18.334 24.106 -8.259 1.00 0.00 N ATOM 3119 CA LEU B 120 -18.381 24.137 -9.717 1.00 0.00 C ATOM 3120 C LEU B 120 -19.356 25.204 -10.208 1.00 0.00 C ATOM 3121 O LEU B 120 -20.008 25.036 -11.237 1.00 0.00 O ATOM 3122 CB LEU B 120 -18.787 22.768 -10.264 1.00 0.00 C ATOM 3123 CG LEU B 120 -17.639 21.772 -10.436 1.00 0.00 C ATOM 3124 CD1 LEU B 120 -18.178 20.370 -10.675 1.00 0.00 C ATOM 3125 CD2 LEU B 120 -16.732 22.198 -11.581 1.00 0.00 C ATOM 0 H LEU B 120 -19.233 24.265 -7.804 1.00 0.00 H new ATOM 0 HA LEU B 120 -17.385 24.386 -10.082 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -19.529 22.332 -9.595 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -19.273 22.909 -11.230 1.00 0.00 H new ATOM 0 HG LEU B 120 -17.053 21.761 -9.517 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -17.346 19.676 -10.795 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -18.786 20.064 -9.824 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -18.789 20.364 -11.578 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -15.921 21.478 -11.689 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -17.308 22.238 -12.506 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -16.317 23.183 -11.369 1.00 0.00 H new ATOM 3137 N SER B 121 -19.448 26.300 -9.462 1.00 0.00 N ATOM 3138 CA SER B 121 -20.343 27.394 -9.822 1.00 0.00 C ATOM 3139 C SER B 121 -21.791 26.920 -9.865 1.00 0.00 C ATOM 3140 O SER B 121 -22.215 26.274 -10.824 1.00 0.00 O ATOM 3141 CB SER B 121 -19.945 27.982 -11.177 1.00 0.00 C ATOM 3142 OG SER B 121 -18.875 28.901 -11.040 1.00 0.00 O ATOM 0 H SER B 121 -18.915 26.454 -8.606 1.00 0.00 H new ATOM 0 HA SER B 121 -20.256 28.168 -9.059 1.00 0.00 H new ATOM 0 HB2 SER B 121 -19.654 27.179 -11.854 1.00 0.00 H new ATOM 0 HB3 SER B 121 -20.803 28.482 -11.626 1.00 0.00 H new ATOM 0 HG SER B 121 -18.638 29.261 -11.920 1.00 0.00 H new ATOM 3148 N ASP B 122 -22.548 27.245 -8.821 1.00 0.00 N ATOM 3149 CA ASP B 122 -23.949 26.852 -8.740 1.00 0.00 C ATOM 3150 C ASP B 122 -24.775 27.559 -9.809 1.00 0.00 C ATOM 3151 O ASP B 122 -25.761 26.959 -10.287 1.00 0.00 O ATOM 3152 CB ASP B 122 -24.510 27.168 -7.352 1.00 0.00 C ATOM 3153 CG ASP B 122 -25.493 26.119 -6.873 1.00 0.00 C ATOM 3154 OD1 ASP B 122 -26.627 26.084 -7.395 1.00 0.00 O ATOM 3155 OD2 ASP B 122 -25.129 25.330 -5.975 1.00 0.00 O ATOM 0 H ASP B 122 -22.213 27.780 -8.020 1.00 0.00 H new ATOM 0 HA ASP B 122 -24.010 25.777 -8.912 1.00 0.00 H new ATOM 0 HB2 ASP B 122 -23.688 27.244 -6.640 1.00 0.00 H new ATOM 0 HB3 ASP B 122 -25.003 28.140 -7.375 1.00 0.00 H new TER 3160 ASP B 122 HETATM 3161 ZN ZN A 123 14.954 -3.783 2.366 1.00 0.00 ZN HETATM 3162 ZN ZN A 124 6.994 -11.754 11.885 1.00 0.00 ZN HETATM 3163 ZN ZN B 143 -15.330 -8.100 0.776 1.00 0.00 ZN HETATM 3164 ZN ZN B 144 -5.310 -15.764 -5.102 1.00 0.00 ZN