USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 891 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 90 SER OG : rot -117:sc= 0.0497 USER MOD Set 1.2: A 93 THR OG1 : rot 180:sc= 0.0459 USER MOD Set 2.1: A 34 GLN : amide:sc= 1.35 K(o=1.6,f=-0.07) USER MOD Set 2.2: A 68 THR OG1 : rot -129:sc= 0.215 USER MOD Set 3.1: A 38 SER OG : rot -67:sc= 0.219 USER MOD Set 3.2: A 45 LYS NZ :NH3+ -166:sc= 0.895 (180deg=-0.054) USER MOD Set 3.3: A 60 SER OG : rot 160:sc= 0.943 USER MOD Set 4.1: A 22 LYS NZ :NH3+ -179:sc= 0.911 (180deg=0) USER MOD Set 4.2: A 77 THR OG1 : rot 167:sc= 0.784 USER MOD Single : A 1 ASP N :NH3+ 151:sc= 0.633 (180deg=0.294) USER MOD Single : A 5 LYS NZ :NH3+ 156:sc= 2.36 (180deg=1.27) USER MOD Single : A 7 GLN : amide:sc= 0.922 K(o=0.92,f=-0.067) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= 0.403 K(o=0.4,f=-3.8!) USER MOD Single : A 15 LYS NZ :NH3+ 173:sc= 0.83 (180deg=0.801) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ -164:sc= -0.0372 (180deg=-0.251) USER MOD Single : A 25 LYS NZ :NH3+ 145:sc= 1.2 (180deg=-0.0751) USER MOD Single : A 27 GLN : amide:sc= -0.0858 X(o=-0.086,f=-0.56) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.00427 USER MOD Single : A 36 GLN : amide:sc= 0.589 K(o=0.59,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -0.0636 K(o=-0.064,f=-1.5) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= 0.755 K(o=0.76,f=-0.17) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot -170:sc= -0.441 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0.0569 USER MOD Single : A 67 HIS : no HD1:sc= -0.2 K(o=-0.2,f=-1.8!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= 1.01 K(o=1,f=-0.004) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot -130:sc= 0.21 USER MOD Single : A 100 THR OG1 : rot 132:sc= 1.21 USER MOD Single : A 101 ASN : amide:sc= 0.553 K(o=0.55,f=0) USER MOD Single : A 103 ASN : amide:sc=-0.000991 X(o=-0.00099,f=-0.00099) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc=-0.00364 USER MOD Single : A 111 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 112 HIS : no HD1:sc= -0.0616 K(o=-0.062,f=-0.86) USER MOD Single : A 113 HIS : no HD1:sc= -0.017 X(o=-0.017,f=-0.017) USER MOD Single : A 114 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 115 HIS : no HD1:sc= -0.0859 X(o=-0.086,f=-0.27) USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 1.343 -1.715 1.145 1.00 0.00 N ATOM 2 CA ASP A 1 0.922 -2.911 0.363 1.00 0.00 C ATOM 3 C ASP A 1 2.137 -3.728 -0.078 1.00 0.00 C ATOM 4 O ASP A 1 3.216 -3.168 -0.293 1.00 0.00 O ATOM 5 CB ASP A 1 0.090 -2.523 -0.877 1.00 0.00 C ATOM 6 CG ASP A 1 -1.215 -1.800 -0.507 1.00 0.00 C ATOM 7 OD1 ASP A 1 -1.152 -0.792 0.240 1.00 0.00 O ATOM 8 OD2 ASP A 1 -2.304 -2.248 -0.937 1.00 0.00 O ATOM 0 H1 ASP A 1 0.645 -0.955 1.019 1.00 0.00 H new ATOM 0 H2 ASP A 1 1.406 -1.964 2.153 1.00 0.00 H new ATOM 0 H3 ASP A 1 2.272 -1.390 0.810 1.00 0.00 H new ATOM 0 HA ASP A 1 0.297 -3.515 1.021 1.00 0.00 H new ATOM 0 HB2 ASP A 1 0.687 -1.880 -1.524 1.00 0.00 H new ATOM 0 HB3 ASP A 1 -0.145 -3.421 -1.448 1.00 0.00 H new ATOM 15 N VAL A 2 1.976 -5.043 -0.255 1.00 0.00 N ATOM 16 CA VAL A 2 2.994 -5.910 -0.881 1.00 0.00 C ATOM 17 C VAL A 2 2.846 -5.892 -2.382 1.00 0.00 C ATOM 18 O VAL A 2 1.742 -5.883 -2.895 1.00 0.00 O ATOM 19 CB VAL A 2 2.822 -7.369 -0.441 1.00 0.00 C ATOM 20 CG1 VAL A 2 3.320 -8.506 -1.346 1.00 0.00 C ATOM 21 CG2 VAL A 2 3.504 -7.565 0.894 1.00 0.00 C ATOM 0 H VAL A 2 1.135 -5.543 0.031 1.00 0.00 H new ATOM 0 HA VAL A 2 3.968 -5.529 -0.573 1.00 0.00 H new ATOM 0 HB VAL A 2 1.737 -7.469 -0.450 1.00 0.00 H new ATOM 0 HG11 VAL A 2 3.113 -9.465 -0.872 1.00 0.00 H new ATOM 0 HG12 VAL A 2 2.807 -8.458 -2.306 1.00 0.00 H new ATOM 0 HG13 VAL A 2 4.394 -8.403 -1.503 1.00 0.00 H new ATOM 0 HG21 VAL A 2 3.386 -8.600 1.214 1.00 0.00 H new ATOM 0 HG22 VAL A 2 4.565 -7.333 0.798 1.00 0.00 H new ATOM 0 HG23 VAL A 2 3.053 -6.903 1.633 1.00 0.00 H new ATOM 31 N ILE A 3 3.972 -6.020 -3.064 1.00 0.00 N ATOM 32 CA ILE A 3 4.093 -6.317 -4.487 1.00 0.00 C ATOM 33 C ILE A 3 4.775 -7.698 -4.491 1.00 0.00 C ATOM 34 O ILE A 3 5.975 -7.793 -4.233 1.00 0.00 O ATOM 35 CB ILE A 3 4.928 -5.247 -5.219 1.00 0.00 C ATOM 36 CG1 ILE A 3 4.304 -3.835 -5.269 1.00 0.00 C ATOM 37 CG2 ILE A 3 5.151 -5.690 -6.673 1.00 0.00 C ATOM 38 CD1 ILE A 3 4.015 -3.116 -3.944 1.00 0.00 C ATOM 0 H ILE A 3 4.882 -5.914 -2.615 1.00 0.00 H new ATOM 0 HA ILE A 3 3.139 -6.318 -5.014 1.00 0.00 H new ATOM 0 HB ILE A 3 5.848 -5.169 -4.640 1.00 0.00 H new ATOM 0 HG12 ILE A 3 4.969 -3.199 -5.853 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.366 -3.906 -5.819 1.00 0.00 H new ATOM 0 HG21 ILE A 3 5.741 -4.937 -7.196 1.00 0.00 H new ATOM 0 HG22 ILE A 3 5.683 -6.641 -6.686 1.00 0.00 H new ATOM 0 HG23 ILE A 3 4.188 -5.806 -7.170 1.00 0.00 H new ATOM 0 HD11 ILE A 3 3.579 -2.138 -4.148 1.00 0.00 H new ATOM 0 HD12 ILE A 3 3.316 -3.708 -3.353 1.00 0.00 H new ATOM 0 HD13 ILE A 3 4.944 -2.990 -3.388 1.00 0.00 H new ATOM 50 N ILE A 4 3.996 -8.781 -4.600 1.00 0.00 N ATOM 51 CA ILE A 4 4.453 -10.160 -4.418 1.00 0.00 C ATOM 52 C ILE A 4 5.462 -10.519 -5.529 1.00 0.00 C ATOM 53 O ILE A 4 5.326 -10.070 -6.679 1.00 0.00 O ATOM 54 CB ILE A 4 3.218 -11.090 -4.444 1.00 0.00 C ATOM 55 CG1 ILE A 4 3.193 -12.185 -3.378 1.00 0.00 C ATOM 56 CG2 ILE A 4 2.984 -11.748 -5.791 1.00 0.00 C ATOM 57 CD1 ILE A 4 4.382 -13.156 -3.353 1.00 0.00 C ATOM 0 H ILE A 4 3.003 -8.718 -4.824 1.00 0.00 H new ATOM 0 HA ILE A 4 4.961 -10.280 -3.461 1.00 0.00 H new ATOM 0 HB ILE A 4 2.414 -10.388 -4.222 1.00 0.00 H new ATOM 0 HG12 ILE A 4 3.125 -11.706 -2.401 1.00 0.00 H new ATOM 0 HG13 ILE A 4 2.282 -12.768 -3.511 1.00 0.00 H new ATOM 0 HG21 ILE A 4 2.102 -12.386 -5.736 1.00 0.00 H new ATOM 0 HG22 ILE A 4 2.830 -10.980 -6.549 1.00 0.00 H new ATOM 0 HG23 ILE A 4 3.852 -12.351 -6.057 1.00 0.00 H new ATOM 0 HD11 ILE A 4 4.242 -13.882 -2.552 1.00 0.00 H new ATOM 0 HD12 ILE A 4 4.446 -13.677 -4.308 1.00 0.00 H new ATOM 0 HD13 ILE A 4 5.303 -12.599 -3.181 1.00 0.00 H new ATOM 69 N LYS A 5 6.453 -11.360 -5.218 1.00 0.00 N ATOM 70 CA LYS A 5 7.524 -11.736 -6.155 1.00 0.00 C ATOM 71 C LYS A 5 7.985 -13.193 -6.026 1.00 0.00 C ATOM 72 O LYS A 5 7.816 -13.792 -4.961 1.00 0.00 O ATOM 73 CB LYS A 5 8.688 -10.770 -5.937 1.00 0.00 C ATOM 74 CG LYS A 5 8.266 -9.382 -6.421 1.00 0.00 C ATOM 75 CD LYS A 5 9.422 -8.467 -6.743 1.00 0.00 C ATOM 76 CE LYS A 5 8.795 -7.084 -6.887 1.00 0.00 C ATOM 77 NZ LYS A 5 9.803 -6.010 -7.080 1.00 0.00 N ATOM 0 H LYS A 5 6.538 -11.804 -4.304 1.00 0.00 H new ATOM 0 HA LYS A 5 7.131 -11.663 -7.169 1.00 0.00 H new ATOM 0 HB2 LYS A 5 8.960 -10.737 -4.882 1.00 0.00 H new ATOM 0 HB3 LYS A 5 9.569 -11.109 -6.482 1.00 0.00 H new ATOM 0 HG2 LYS A 5 7.644 -9.492 -7.310 1.00 0.00 H new ATOM 0 HG3 LYS A 5 7.648 -8.914 -5.655 1.00 0.00 H new ATOM 0 HD2 LYS A 5 10.171 -8.482 -5.951 1.00 0.00 H new ATOM 0 HD3 LYS A 5 9.924 -8.772 -7.661 1.00 0.00 H new ATOM 0 HE2 LYS A 5 8.109 -7.088 -7.734 1.00 0.00 H new ATOM 0 HE3 LYS A 5 8.203 -6.865 -5.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 9.361 -5.202 -7.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 10.166 -5.704 -6.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 10.589 -6.371 -7.658 1.00 0.00 H new ATOM 91 N PRO A 6 8.548 -13.763 -7.103 1.00 0.00 N ATOM 92 CA PRO A 6 8.910 -15.173 -7.157 1.00 0.00 C ATOM 93 C PRO A 6 10.259 -15.461 -6.487 1.00 0.00 C ATOM 94 O PRO A 6 11.201 -14.680 -6.602 1.00 0.00 O ATOM 95 CB PRO A 6 8.942 -15.488 -8.651 1.00 0.00 C ATOM 96 CG PRO A 6 9.342 -14.178 -9.330 1.00 0.00 C ATOM 97 CD PRO A 6 8.753 -13.127 -8.401 1.00 0.00 C ATOM 0 HA PRO A 6 8.202 -15.796 -6.610 1.00 0.00 H new ATOM 0 HB2 PRO A 6 9.658 -16.280 -8.871 1.00 0.00 H new ATOM 0 HB3 PRO A 6 7.969 -15.832 -9.002 1.00 0.00 H new ATOM 0 HG2 PRO A 6 10.424 -14.081 -9.417 1.00 0.00 H new ATOM 0 HG3 PRO A 6 8.933 -14.103 -10.338 1.00 0.00 H new ATOM 0 HD2 PRO A 6 9.426 -12.274 -8.309 1.00 0.00 H new ATOM 0 HD3 PRO A 6 7.811 -12.748 -8.797 1.00 0.00 H new ATOM 105 N GLN A 7 10.377 -16.614 -5.817 1.00 0.00 N ATOM 106 CA GLN A 7 11.612 -17.009 -5.116 1.00 0.00 C ATOM 107 C GLN A 7 12.754 -17.478 -6.048 1.00 0.00 C ATOM 108 O GLN A 7 13.902 -17.579 -5.609 1.00 0.00 O ATOM 109 CB GLN A 7 11.293 -18.031 -4.013 1.00 0.00 C ATOM 110 CG GLN A 7 10.749 -19.388 -4.503 1.00 0.00 C ATOM 111 CD GLN A 7 10.549 -20.384 -3.359 1.00 0.00 C ATOM 112 OE1 GLN A 7 11.414 -20.595 -2.523 1.00 0.00 O ATOM 113 NE2 GLN A 7 9.414 -21.036 -3.260 1.00 0.00 N ATOM 0 H GLN A 7 9.625 -17.299 -5.744 1.00 0.00 H new ATOM 0 HA GLN A 7 12.008 -16.106 -4.651 1.00 0.00 H new ATOM 0 HB2 GLN A 7 12.199 -18.210 -3.435 1.00 0.00 H new ATOM 0 HB3 GLN A 7 10.563 -17.591 -3.334 1.00 0.00 H new ATOM 0 HG2 GLN A 7 9.800 -19.232 -5.015 1.00 0.00 H new ATOM 0 HG3 GLN A 7 11.439 -19.811 -5.233 1.00 0.00 H new ATOM 0 HE21 GLN A 7 8.674 -20.879 -3.945 1.00 0.00 H new ATOM 0 HE22 GLN A 7 9.272 -21.700 -2.498 1.00 0.00 H new ATOM 122 N VAL A 8 12.471 -17.718 -7.337 1.00 0.00 N ATOM 123 CA VAL A 8 13.441 -18.013 -8.415 1.00 0.00 C ATOM 124 C VAL A 8 13.012 -17.351 -9.727 1.00 0.00 C ATOM 125 O VAL A 8 11.830 -17.069 -9.931 1.00 0.00 O ATOM 126 CB VAL A 8 13.619 -19.535 -8.655 1.00 0.00 C ATOM 127 CG1 VAL A 8 14.145 -20.284 -7.428 1.00 0.00 C ATOM 128 CG2 VAL A 8 12.340 -20.234 -9.133 1.00 0.00 C ATOM 0 H VAL A 8 11.510 -17.712 -7.679 1.00 0.00 H new ATOM 0 HA VAL A 8 14.397 -17.606 -8.085 1.00 0.00 H new ATOM 0 HB VAL A 8 14.364 -19.580 -9.449 1.00 0.00 H new ATOM 0 HG11 VAL A 8 14.246 -21.343 -7.664 1.00 0.00 H new ATOM 0 HG12 VAL A 8 15.117 -19.881 -7.145 1.00 0.00 H new ATOM 0 HG13 VAL A 8 13.446 -20.162 -6.600 1.00 0.00 H new ATOM 0 HG21 VAL A 8 12.539 -21.296 -9.280 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.557 -20.112 -8.384 1.00 0.00 H new ATOM 0 HG23 VAL A 8 12.014 -19.792 -10.074 1.00 0.00 H new ATOM 138 N SER A 9 13.957 -17.117 -10.641 1.00 0.00 N ATOM 139 CA SER A 9 13.637 -16.716 -12.018 1.00 0.00 C ATOM 140 C SER A 9 13.233 -17.946 -12.860 1.00 0.00 C ATOM 141 O SER A 9 13.575 -19.089 -12.531 1.00 0.00 O ATOM 142 CB SER A 9 14.837 -15.990 -12.643 1.00 0.00 C ATOM 143 OG SER A 9 15.966 -16.854 -12.737 1.00 0.00 O ATOM 0 H SER A 9 14.956 -17.198 -10.453 1.00 0.00 H new ATOM 0 HA SER A 9 12.790 -16.031 -12.001 1.00 0.00 H new ATOM 0 HB2 SER A 9 14.570 -15.626 -13.635 1.00 0.00 H new ATOM 0 HB3 SER A 9 15.092 -15.117 -12.042 1.00 0.00 H new ATOM 0 HG SER A 9 16.716 -16.369 -13.140 1.00 0.00 H new ATOM 149 N GLY A 10 12.471 -17.732 -13.933 1.00 0.00 N ATOM 150 CA GLY A 10 11.859 -18.793 -14.747 1.00 0.00 C ATOM 151 C GLY A 10 10.623 -18.261 -15.452 1.00 0.00 C ATOM 152 O GLY A 10 10.539 -17.057 -15.694 1.00 0.00 O ATOM 0 H GLY A 10 12.254 -16.795 -14.272 1.00 0.00 H new ATOM 0 HA2 GLY A 10 12.577 -19.159 -15.481 1.00 0.00 H new ATOM 0 HA3 GLY A 10 11.591 -19.639 -14.114 1.00 0.00 H new ATOM 156 N VAL A 11 9.643 -19.110 -15.773 1.00 0.00 N ATOM 157 CA VAL A 11 8.425 -18.688 -16.432 1.00 0.00 C ATOM 158 C VAL A 11 7.179 -19.228 -15.748 1.00 0.00 C ATOM 159 O VAL A 11 7.191 -20.366 -15.297 1.00 0.00 O ATOM 160 CB VAL A 11 8.441 -19.149 -17.884 1.00 0.00 C ATOM 161 CG1 VAL A 11 9.727 -18.868 -18.660 1.00 0.00 C ATOM 162 CG2 VAL A 11 7.934 -20.546 -18.223 1.00 0.00 C ATOM 0 H VAL A 11 9.682 -20.111 -15.578 1.00 0.00 H new ATOM 0 HA VAL A 11 8.388 -17.600 -16.377 1.00 0.00 H new ATOM 0 HB VAL A 11 7.659 -18.475 -18.233 1.00 0.00 H new ATOM 0 HG11 VAL A 11 9.625 -19.239 -19.680 1.00 0.00 H new ATOM 0 HG12 VAL A 11 9.912 -17.794 -18.681 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.563 -19.371 -18.173 1.00 0.00 H new ATOM 0 HG21 VAL A 11 8.015 -20.712 -19.297 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.532 -21.288 -17.695 1.00 0.00 H new ATOM 0 HG23 VAL A 11 6.891 -20.638 -17.920 1.00 0.00 H new ATOM 172 N ILE A 12 6.098 -18.459 -15.704 1.00 0.00 N ATOM 173 CA ILE A 12 4.838 -18.910 -15.078 1.00 0.00 C ATOM 174 C ILE A 12 4.266 -20.152 -15.796 1.00 0.00 C ATOM 175 O ILE A 12 4.300 -20.233 -17.025 1.00 0.00 O ATOM 176 CB ILE A 12 3.769 -17.800 -15.069 1.00 0.00 C ATOM 177 CG1 ILE A 12 4.280 -16.399 -14.692 1.00 0.00 C ATOM 178 CG2 ILE A 12 2.556 -18.143 -14.186 1.00 0.00 C ATOM 179 CD1 ILE A 12 4.968 -16.274 -13.329 1.00 0.00 C ATOM 0 H ILE A 12 6.058 -17.517 -16.092 1.00 0.00 H new ATOM 0 HA ILE A 12 5.084 -19.168 -14.048 1.00 0.00 H new ATOM 0 HB ILE A 12 3.463 -17.758 -16.114 1.00 0.00 H new ATOM 0 HG12 ILE A 12 4.980 -16.071 -15.460 1.00 0.00 H new ATOM 0 HG13 ILE A 12 3.436 -15.709 -14.714 1.00 0.00 H new ATOM 0 HG21 ILE A 12 1.838 -17.324 -14.220 1.00 0.00 H new ATOM 0 HG22 ILE A 12 2.084 -19.054 -14.554 1.00 0.00 H new ATOM 0 HG23 ILE A 12 2.885 -18.294 -13.158 1.00 0.00 H new ATOM 0 HD11 ILE A 12 5.285 -15.243 -13.175 1.00 0.00 H new ATOM 0 HD12 ILE A 12 4.271 -16.561 -12.542 1.00 0.00 H new ATOM 0 HD13 ILE A 12 5.839 -16.929 -13.299 1.00 0.00 H new ATOM 191 N VAL A 13 3.664 -21.069 -15.032 1.00 0.00 N ATOM 192 CA VAL A 13 3.052 -22.330 -15.497 1.00 0.00 C ATOM 193 C VAL A 13 1.585 -22.437 -15.062 1.00 0.00 C ATOM 194 O VAL A 13 0.764 -22.975 -15.804 1.00 0.00 O ATOM 195 CB VAL A 13 3.837 -23.538 -14.939 1.00 0.00 C ATOM 196 CG1 VAL A 13 3.296 -24.890 -15.415 1.00 0.00 C ATOM 197 CG2 VAL A 13 5.309 -23.468 -15.353 1.00 0.00 C ATOM 0 H VAL A 13 3.583 -20.952 -14.022 1.00 0.00 H new ATOM 0 HA VAL A 13 3.090 -22.333 -16.586 1.00 0.00 H new ATOM 0 HB VAL A 13 3.722 -23.475 -13.857 1.00 0.00 H new ATOM 0 HG11 VAL A 13 3.894 -25.693 -14.985 1.00 0.00 H new ATOM 0 HG12 VAL A 13 2.259 -24.999 -15.097 1.00 0.00 H new ATOM 0 HG13 VAL A 13 3.349 -24.941 -16.503 1.00 0.00 H new ATOM 0 HG21 VAL A 13 5.842 -24.329 -14.949 1.00 0.00 H new ATOM 0 HG22 VAL A 13 5.382 -23.474 -16.441 1.00 0.00 H new ATOM 0 HG23 VAL A 13 5.753 -22.551 -14.965 1.00 0.00 H new ATOM 207 N ASN A 14 1.237 -21.897 -13.888 1.00 0.00 N ATOM 208 CA ASN A 14 -0.141 -21.855 -13.385 1.00 0.00 C ATOM 209 C ASN A 14 -0.382 -20.640 -12.479 1.00 0.00 C ATOM 210 O ASN A 14 0.558 -20.088 -11.901 1.00 0.00 O ATOM 211 CB ASN A 14 -0.446 -23.179 -12.647 1.00 0.00 C ATOM 212 CG ASN A 14 -1.928 -23.515 -12.550 1.00 0.00 C ATOM 213 OD1 ASN A 14 -2.796 -22.824 -13.057 1.00 0.00 O ATOM 214 ND2 ASN A 14 -2.269 -24.587 -11.870 1.00 0.00 N ATOM 0 H ASN A 14 1.913 -21.472 -13.253 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.822 -21.746 -14.229 1.00 0.00 H new ATOM 0 HB2 ASN A 14 0.066 -23.993 -13.159 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -0.031 -23.124 -11.641 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -3.253 -24.836 -11.770 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -1.549 -25.170 -11.443 1.00 0.00 H new ATOM 221 N LYS A 15 -1.666 -20.299 -12.316 1.00 0.00 N ATOM 222 CA LYS A 15 -2.230 -19.185 -11.565 1.00 0.00 C ATOM 223 C LYS A 15 -3.252 -19.745 -10.572 1.00 0.00 C ATOM 224 O LYS A 15 -4.402 -20.017 -10.917 1.00 0.00 O ATOM 225 CB LYS A 15 -2.904 -18.199 -12.538 1.00 0.00 C ATOM 226 CG LYS A 15 -1.952 -17.561 -13.555 1.00 0.00 C ATOM 227 CD LYS A 15 -1.222 -16.317 -13.048 1.00 0.00 C ATOM 228 CE LYS A 15 -2.144 -15.090 -12.950 1.00 0.00 C ATOM 229 NZ LYS A 15 -2.683 -14.628 -14.255 1.00 0.00 N ATOM 0 H LYS A 15 -2.403 -20.854 -12.751 1.00 0.00 H new ATOM 0 HA LYS A 15 -1.449 -18.652 -11.023 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -3.694 -18.722 -13.077 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.382 -17.408 -11.961 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -1.213 -18.303 -13.856 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -2.519 -17.295 -14.447 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -0.795 -16.525 -12.067 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -0.391 -16.090 -13.716 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -2.977 -15.328 -12.289 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -1.593 -14.271 -12.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -3.384 -13.877 -14.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -1.907 -14.258 -14.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -3.136 -15.425 -14.745 1.00 0.00 H new ATOM 243 N LEU A 16 -2.797 -19.992 -9.345 1.00 0.00 N ATOM 244 CA LEU A 16 -3.601 -20.610 -8.295 1.00 0.00 C ATOM 245 C LEU A 16 -4.631 -19.662 -7.681 1.00 0.00 C ATOM 246 O LEU A 16 -5.760 -20.058 -7.382 1.00 0.00 O ATOM 247 CB LEU A 16 -2.658 -21.099 -7.204 1.00 0.00 C ATOM 248 CG LEU A 16 -1.869 -22.371 -7.541 1.00 0.00 C ATOM 249 CD1 LEU A 16 -2.592 -23.396 -8.402 1.00 0.00 C ATOM 250 CD2 LEU A 16 -0.539 -22.063 -8.214 1.00 0.00 C ATOM 0 H LEU A 16 -1.847 -19.765 -9.049 1.00 0.00 H new ATOM 0 HA LEU A 16 -4.163 -21.428 -8.746 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.950 -20.302 -6.974 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -3.238 -21.280 -6.299 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.725 -22.817 -6.557 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -1.939 -24.251 -8.575 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.496 -23.728 -7.891 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -2.860 -22.945 -9.357 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -0.018 -22.995 -8.433 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.718 -21.521 -9.142 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.072 -21.453 -7.549 1.00 0.00 H new ATOM 262 N PHE A 17 -4.216 -18.413 -7.492 1.00 0.00 N ATOM 263 CA PHE A 17 -5.044 -17.331 -6.959 1.00 0.00 C ATOM 264 C PHE A 17 -6.035 -16.789 -8.009 1.00 0.00 C ATOM 265 O PHE A 17 -6.075 -17.249 -9.156 1.00 0.00 O ATOM 266 CB PHE A 17 -4.132 -16.234 -6.394 1.00 0.00 C ATOM 267 CG PHE A 17 -3.672 -15.159 -7.369 1.00 0.00 C ATOM 268 CD1 PHE A 17 -2.662 -15.410 -8.315 1.00 0.00 C ATOM 269 CD2 PHE A 17 -4.273 -13.889 -7.329 1.00 0.00 C ATOM 270 CE1 PHE A 17 -2.318 -14.415 -9.246 1.00 0.00 C ATOM 271 CE2 PHE A 17 -3.865 -12.865 -8.197 1.00 0.00 C ATOM 272 CZ PHE A 17 -2.887 -13.133 -9.159 1.00 0.00 C ATOM 0 H PHE A 17 -3.266 -18.115 -7.712 1.00 0.00 H new ATOM 0 HA PHE A 17 -5.662 -17.721 -6.151 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -4.655 -15.746 -5.572 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -3.248 -16.711 -5.971 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -2.153 -16.363 -8.326 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -5.063 -13.698 -6.618 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -1.612 -14.637 -10.033 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -4.302 -11.880 -8.123 1.00 0.00 H new ATOM 0 HZ PHE A 17 -2.568 -12.354 -9.836 1.00 0.00 H new ATOM 282 N LYS A 18 -6.805 -15.761 -7.633 1.00 0.00 N ATOM 283 CA LYS A 18 -7.710 -15.008 -8.527 1.00 0.00 C ATOM 284 C LYS A 18 -7.464 -13.505 -8.436 1.00 0.00 C ATOM 285 O LYS A 18 -7.459 -12.932 -7.349 1.00 0.00 O ATOM 286 CB LYS A 18 -9.165 -15.263 -8.166 1.00 0.00 C ATOM 287 CG LYS A 18 -9.636 -16.714 -8.190 1.00 0.00 C ATOM 288 CD LYS A 18 -9.622 -17.350 -9.589 1.00 0.00 C ATOM 289 CE LYS A 18 -10.185 -18.776 -9.515 1.00 0.00 C ATOM 290 NZ LYS A 18 -10.170 -19.443 -10.843 1.00 0.00 N ATOM 0 H LYS A 18 -6.820 -15.416 -6.673 1.00 0.00 H new ATOM 0 HA LYS A 18 -7.504 -15.354 -9.540 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -9.342 -14.865 -7.167 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -9.790 -14.692 -8.852 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -9.001 -17.303 -7.528 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -10.648 -16.764 -7.789 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -10.216 -16.750 -10.278 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -8.605 -17.370 -9.980 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -9.599 -19.362 -8.807 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -11.206 -18.745 -9.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -10.558 -20.404 -10.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -10.749 -18.897 -11.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -9.192 -19.495 -11.194 1.00 0.00 H new ATOM 304 N ALA A 19 -7.313 -12.871 -9.589 1.00 0.00 N ATOM 305 CA ALA A 19 -7.136 -11.429 -9.728 1.00 0.00 C ATOM 306 C ALA A 19 -8.337 -10.660 -9.146 1.00 0.00 C ATOM 307 O ALA A 19 -9.451 -10.727 -9.669 1.00 0.00 O ATOM 308 CB ALA A 19 -6.881 -11.120 -11.207 1.00 0.00 C ATOM 0 H ALA A 19 -7.310 -13.360 -10.484 1.00 0.00 H new ATOM 0 HA ALA A 19 -6.275 -11.092 -9.151 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -6.745 -10.046 -11.336 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -5.983 -11.642 -11.538 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -7.733 -11.452 -11.800 1.00 0.00 H new ATOM 314 N GLY A 20 -8.101 -9.952 -8.037 1.00 0.00 N ATOM 315 CA GLY A 20 -9.099 -9.132 -7.345 1.00 0.00 C ATOM 316 C GLY A 20 -9.737 -9.774 -6.103 1.00 0.00 C ATOM 317 O GLY A 20 -10.499 -9.097 -5.411 1.00 0.00 O ATOM 0 H GLY A 20 -7.187 -9.933 -7.585 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -8.630 -8.194 -7.047 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -9.891 -8.882 -8.051 1.00 0.00 H new ATOM 321 N ASP A 21 -9.488 -11.059 -5.825 1.00 0.00 N ATOM 322 CA ASP A 21 -10.197 -11.829 -4.786 1.00 0.00 C ATOM 323 C ASP A 21 -9.473 -11.857 -3.414 1.00 0.00 C ATOM 324 O ASP A 21 -8.674 -10.969 -3.096 1.00 0.00 O ATOM 325 CB ASP A 21 -10.460 -13.234 -5.359 1.00 0.00 C ATOM 326 CG ASP A 21 -11.778 -13.834 -4.841 1.00 0.00 C ATOM 327 OD1 ASP A 21 -11.767 -14.494 -3.776 1.00 0.00 O ATOM 328 OD2 ASP A 21 -12.832 -13.627 -5.485 1.00 0.00 O ATOM 0 H ASP A 21 -8.781 -11.603 -6.319 1.00 0.00 H new ATOM 0 HA ASP A 21 -11.139 -11.334 -4.553 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -10.490 -13.181 -6.447 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -9.633 -13.893 -5.094 1.00 0.00 H new ATOM 333 N LYS A 22 -9.773 -12.846 -2.566 1.00 0.00 N ATOM 334 CA LYS A 22 -9.137 -13.085 -1.258 1.00 0.00 C ATOM 335 C LYS A 22 -7.979 -14.088 -1.364 1.00 0.00 C ATOM 336 O LYS A 22 -7.935 -14.912 -2.281 1.00 0.00 O ATOM 337 CB LYS A 22 -10.204 -13.615 -0.283 1.00 0.00 C ATOM 338 CG LYS A 22 -11.326 -12.602 0.019 1.00 0.00 C ATOM 339 CD LYS A 22 -10.873 -11.529 1.019 1.00 0.00 C ATOM 340 CE LYS A 22 -11.920 -10.418 1.176 1.00 0.00 C ATOM 341 NZ LYS A 22 -11.837 -9.419 0.075 1.00 0.00 N ATOM 0 H LYS A 22 -10.496 -13.534 -2.778 1.00 0.00 H new ATOM 0 HA LYS A 22 -8.720 -12.146 -0.895 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -10.646 -14.520 -0.699 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -9.721 -13.898 0.652 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -11.643 -12.124 -0.908 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -12.193 -13.128 0.419 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -10.686 -11.991 1.988 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.930 -11.096 0.685 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -12.917 -10.858 1.193 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -11.777 -9.917 2.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -12.549 -8.676 0.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -10.888 -8.993 0.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -12.016 -9.890 -0.835 1.00 0.00 H new ATOM 355 N VAL A 23 -7.082 -14.067 -0.375 1.00 0.00 N ATOM 356 CA VAL A 23 -6.009 -15.068 -0.163 1.00 0.00 C ATOM 357 C VAL A 23 -5.900 -15.421 1.319 1.00 0.00 C ATOM 358 O VAL A 23 -6.015 -14.551 2.189 1.00 0.00 O ATOM 359 CB VAL A 23 -4.636 -14.588 -0.686 1.00 0.00 C ATOM 360 CG1 VAL A 23 -4.634 -14.446 -2.209 1.00 0.00 C ATOM 361 CG2 VAL A 23 -4.155 -13.256 -0.099 1.00 0.00 C ATOM 0 H VAL A 23 -7.074 -13.330 0.330 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.286 -15.953 -0.736 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.949 -15.368 -0.357 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.653 -14.107 -2.542 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.858 -15.410 -2.665 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.390 -13.719 -2.508 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -3.184 -13.000 -0.524 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.874 -12.472 -0.338 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -4.064 -13.347 0.983 1.00 0.00 H new ATOM 371 N LYS A 24 -5.663 -16.703 1.622 1.00 0.00 N ATOM 372 CA LYS A 24 -5.307 -17.214 2.947 1.00 0.00 C ATOM 373 C LYS A 24 -3.844 -16.874 3.266 1.00 0.00 C ATOM 374 O LYS A 24 -3.038 -16.783 2.338 1.00 0.00 O ATOM 375 CB LYS A 24 -5.601 -18.717 2.903 1.00 0.00 C ATOM 376 CG LYS A 24 -5.250 -19.424 4.199 1.00 0.00 C ATOM 377 CD LYS A 24 -5.970 -18.933 5.448 1.00 0.00 C ATOM 378 CE LYS A 24 -5.560 -19.797 6.648 1.00 0.00 C ATOM 379 NZ LYS A 24 -5.990 -21.221 6.542 1.00 0.00 N ATOM 0 H LYS A 24 -5.717 -17.441 0.920 1.00 0.00 H new ATOM 0 HA LYS A 24 -5.882 -16.758 3.753 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -6.658 -18.869 2.686 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.040 -19.168 2.085 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.460 -20.487 4.078 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.177 -19.328 4.362 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.722 -17.889 5.637 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -7.049 -18.983 5.302 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -4.476 -19.762 6.755 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -5.984 -19.366 7.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -5.927 -21.673 7.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -6.972 -21.263 6.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -5.371 -21.722 5.873 1.00 0.00 H new ATOM 393 N LYS A 25 -3.477 -16.740 4.552 1.00 0.00 N ATOM 394 CA LYS A 25 -2.080 -16.661 5.048 1.00 0.00 C ATOM 395 C LYS A 25 -1.232 -17.838 4.527 1.00 0.00 C ATOM 396 O LYS A 25 -1.154 -18.912 5.117 1.00 0.00 O ATOM 397 CB LYS A 25 -2.033 -16.273 6.541 1.00 0.00 C ATOM 398 CG LYS A 25 -1.125 -16.991 7.538 1.00 0.00 C ATOM 399 CD LYS A 25 0.305 -16.435 7.581 1.00 0.00 C ATOM 400 CE LYS A 25 1.037 -16.640 6.257 1.00 0.00 C ATOM 401 NZ LYS A 25 2.486 -16.328 6.373 1.00 0.00 N ATOM 0 H LYS A 25 -4.163 -16.681 5.305 1.00 0.00 H new ATOM 0 HA LYS A 25 -1.544 -15.820 4.609 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -1.771 -15.216 6.582 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -3.050 -16.364 6.921 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -1.564 -16.918 8.533 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -1.086 -18.050 7.283 1.00 0.00 H new ATOM 0 HD2 LYS A 25 0.274 -15.371 7.817 1.00 0.00 H new ATOM 0 HD3 LYS A 25 0.860 -16.923 8.382 1.00 0.00 H new ATOM 0 HE2 LYS A 25 0.913 -17.672 5.929 1.00 0.00 H new ATOM 0 HE3 LYS A 25 0.589 -16.006 5.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 3.030 -16.973 5.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 2.655 -15.346 6.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 2.788 -16.446 7.361 1.00 0.00 H new ATOM 415 N GLY A 26 -0.630 -17.611 3.356 1.00 0.00 N ATOM 416 CA GLY A 26 0.275 -18.525 2.669 1.00 0.00 C ATOM 417 C GLY A 26 -0.372 -19.433 1.637 1.00 0.00 C ATOM 418 O GLY A 26 0.234 -20.443 1.281 1.00 0.00 O ATOM 0 H GLY A 26 -0.770 -16.742 2.840 1.00 0.00 H new ATOM 0 HA2 GLY A 26 1.051 -17.939 2.176 1.00 0.00 H new ATOM 0 HA3 GLY A 26 0.771 -19.147 3.415 1.00 0.00 H new ATOM 422 N GLN A 27 -1.588 -19.125 1.164 1.00 0.00 N ATOM 423 CA GLN A 27 -2.082 -19.801 -0.034 1.00 0.00 C ATOM 424 C GLN A 27 -1.069 -19.616 -1.167 1.00 0.00 C ATOM 425 O GLN A 27 -0.510 -18.540 -1.391 1.00 0.00 O ATOM 426 CB GLN A 27 -3.521 -19.398 -0.413 1.00 0.00 C ATOM 427 CG GLN A 27 -3.804 -19.257 -1.910 1.00 0.00 C ATOM 428 CD GLN A 27 -5.170 -18.690 -2.284 1.00 0.00 C ATOM 429 OE1 GLN A 27 -5.293 -17.802 -3.112 1.00 0.00 O ATOM 430 NE2 GLN A 27 -6.252 -19.181 -1.730 1.00 0.00 N ATOM 0 H GLN A 27 -2.222 -18.440 1.575 1.00 0.00 H new ATOM 0 HA GLN A 27 -2.166 -20.867 0.176 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -4.205 -20.140 -0.002 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -3.751 -18.449 0.071 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -3.036 -18.618 -2.346 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -3.702 -20.239 -2.373 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -6.177 -19.924 -1.035 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -7.169 -18.820 -1.994 1.00 0.00 H new ATOM 439 N THR A 28 -0.846 -20.708 -1.871 1.00 0.00 N ATOM 440 CA THR A 28 -0.117 -20.803 -3.130 1.00 0.00 C ATOM 441 C THR A 28 -0.792 -19.946 -4.200 1.00 0.00 C ATOM 442 O THR A 28 -2.006 -19.963 -4.355 1.00 0.00 O ATOM 443 CB THR A 28 -0.163 -22.281 -3.502 1.00 0.00 C ATOM 444 OG1 THR A 28 0.433 -23.050 -2.471 1.00 0.00 O ATOM 445 CG2 THR A 28 0.608 -22.603 -4.780 1.00 0.00 C ATOM 0 H THR A 28 -1.191 -21.617 -1.561 1.00 0.00 H new ATOM 0 HA THR A 28 0.908 -20.441 -3.045 1.00 0.00 H new ATOM 0 HB THR A 28 -1.216 -22.519 -3.650 1.00 0.00 H new ATOM 0 HG1 THR A 28 0.401 -24.000 -2.711 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.536 -23.670 -4.989 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.184 -22.041 -5.612 1.00 0.00 H new ATOM 0 HG23 THR A 28 1.655 -22.328 -4.652 1.00 0.00 H new ATOM 453 N LEU A 29 0.017 -19.194 -4.943 1.00 0.00 N ATOM 454 CA LEU A 29 -0.376 -18.141 -5.881 1.00 0.00 C ATOM 455 C LEU A 29 0.082 -18.454 -7.316 1.00 0.00 C ATOM 456 O LEU A 29 -0.704 -18.309 -8.253 1.00 0.00 O ATOM 457 CB LEU A 29 0.233 -16.826 -5.401 1.00 0.00 C ATOM 458 CG LEU A 29 -0.121 -16.379 -3.972 1.00 0.00 C ATOM 459 CD1 LEU A 29 0.264 -14.921 -3.860 1.00 0.00 C ATOM 460 CD2 LEU A 29 -1.568 -16.505 -3.527 1.00 0.00 C ATOM 0 H LEU A 29 1.030 -19.310 -4.905 1.00 0.00 H new ATOM 0 HA LEU A 29 -1.464 -18.072 -5.906 1.00 0.00 H new ATOM 0 HB2 LEU A 29 1.318 -16.908 -5.473 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -0.074 -16.038 -6.089 1.00 0.00 H new ATOM 0 HG LEU A 29 0.422 -17.064 -3.321 1.00 0.00 H new ATOM 0 HD11 LEU A 29 0.030 -14.559 -2.859 1.00 0.00 H new ATOM 0 HD12 LEU A 29 1.333 -14.812 -4.045 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.293 -14.340 -4.595 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -1.665 -16.153 -2.500 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -2.203 -15.904 -4.178 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.876 -17.549 -3.583 1.00 0.00 H new ATOM 472 N PHE A 30 1.310 -18.960 -7.487 1.00 0.00 N ATOM 473 CA PHE A 30 1.906 -19.238 -8.811 1.00 0.00 C ATOM 474 C PHE A 30 2.760 -20.504 -8.823 1.00 0.00 C ATOM 475 O PHE A 30 3.217 -20.996 -7.788 1.00 0.00 O ATOM 476 CB PHE A 30 2.774 -18.048 -9.285 1.00 0.00 C ATOM 477 CG PHE A 30 2.129 -16.679 -9.234 1.00 0.00 C ATOM 478 CD1 PHE A 30 2.166 -15.915 -8.047 1.00 0.00 C ATOM 479 CD2 PHE A 30 1.536 -16.158 -10.391 1.00 0.00 C ATOM 480 CE1 PHE A 30 1.524 -14.666 -7.987 1.00 0.00 C ATOM 481 CE2 PHE A 30 0.909 -14.903 -10.338 1.00 0.00 C ATOM 482 CZ PHE A 30 0.851 -14.187 -9.131 1.00 0.00 C ATOM 0 H PHE A 30 1.927 -19.192 -6.708 1.00 0.00 H new ATOM 0 HA PHE A 30 1.067 -19.388 -9.491 1.00 0.00 H new ATOM 0 HB2 PHE A 30 3.678 -18.022 -8.677 1.00 0.00 H new ATOM 0 HB3 PHE A 30 3.085 -18.240 -10.312 1.00 0.00 H new ATOM 0 HD1 PHE A 30 2.690 -16.292 -7.181 1.00 0.00 H new ATOM 0 HD2 PHE A 30 1.561 -16.716 -11.315 1.00 0.00 H new ATOM 0 HE1 PHE A 30 1.545 -14.082 -7.079 1.00 0.00 H new ATOM 0 HE2 PHE A 30 0.468 -14.485 -11.231 1.00 0.00 H new ATOM 0 HZ PHE A 30 0.289 -13.266 -9.078 1.00 0.00 H new ATOM 492 N ILE A 31 3.027 -20.971 -10.044 1.00 0.00 N ATOM 493 CA ILE A 31 3.965 -22.058 -10.378 1.00 0.00 C ATOM 494 C ILE A 31 4.879 -21.535 -11.476 1.00 0.00 C ATOM 495 O ILE A 31 4.406 -20.849 -12.380 1.00 0.00 O ATOM 496 CB ILE A 31 3.217 -23.323 -10.846 1.00 0.00 C ATOM 497 CG1 ILE A 31 2.182 -23.693 -9.771 1.00 0.00 C ATOM 498 CG2 ILE A 31 4.187 -24.497 -11.133 1.00 0.00 C ATOM 499 CD1 ILE A 31 1.394 -24.971 -10.033 1.00 0.00 C ATOM 0 H ILE A 31 2.575 -20.585 -10.873 1.00 0.00 H new ATOM 0 HA ILE A 31 4.539 -22.346 -9.497 1.00 0.00 H new ATOM 0 HB ILE A 31 2.712 -23.117 -11.790 1.00 0.00 H new ATOM 0 HG12 ILE A 31 2.696 -23.793 -8.815 1.00 0.00 H new ATOM 0 HG13 ILE A 31 1.478 -22.867 -9.669 1.00 0.00 H new ATOM 0 HG21 ILE A 31 3.618 -25.367 -11.460 1.00 0.00 H new ATOM 0 HG22 ILE A 31 4.888 -24.207 -11.916 1.00 0.00 H new ATOM 0 HG23 ILE A 31 4.738 -24.744 -10.226 1.00 0.00 H new ATOM 0 HD11 ILE A 31 0.693 -25.140 -9.216 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.844 -24.874 -10.969 1.00 0.00 H new ATOM 0 HD13 ILE A 31 2.081 -25.814 -10.102 1.00 0.00 H new ATOM 511 N ILE A 32 6.162 -21.864 -11.414 1.00 0.00 N ATOM 512 CA ILE A 32 7.212 -21.459 -12.351 1.00 0.00 C ATOM 513 C ILE A 32 7.987 -22.648 -12.875 1.00 0.00 C ATOM 514 O ILE A 32 8.228 -23.586 -12.122 1.00 0.00 O ATOM 515 CB ILE A 32 8.165 -20.462 -11.644 1.00 0.00 C ATOM 516 CG1 ILE A 32 7.493 -19.086 -11.718 1.00 0.00 C ATOM 517 CG2 ILE A 32 9.601 -20.415 -12.211 1.00 0.00 C ATOM 518 CD1 ILE A 32 8.315 -17.977 -11.058 1.00 0.00 C ATOM 0 H ILE A 32 6.523 -22.456 -10.666 1.00 0.00 H new ATOM 0 HA ILE A 32 6.742 -20.979 -13.210 1.00 0.00 H new ATOM 0 HB ILE A 32 8.311 -20.797 -10.617 1.00 0.00 H new ATOM 0 HG12 ILE A 32 7.321 -18.829 -12.763 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.516 -19.140 -11.238 1.00 0.00 H new ATOM 0 HG21 ILE A 32 10.190 -19.689 -11.651 1.00 0.00 H new ATOM 0 HG22 ILE A 32 10.060 -21.400 -12.122 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.568 -20.123 -13.261 1.00 0.00 H new ATOM 0 HD11 ILE A 32 7.784 -17.029 -11.145 1.00 0.00 H new ATOM 0 HD12 ILE A 32 8.465 -18.213 -10.005 1.00 0.00 H new ATOM 0 HD13 ILE A 32 9.283 -17.897 -11.553 1.00 0.00 H new ATOM 530 N GLU A 33 8.440 -22.586 -14.131 1.00 0.00 N ATOM 531 CA GLU A 33 9.397 -23.548 -14.659 1.00 0.00 C ATOM 532 C GLU A 33 10.815 -22.961 -14.593 1.00 0.00 C ATOM 533 O GLU A 33 11.054 -21.854 -15.086 1.00 0.00 O ATOM 534 CB GLU A 33 9.011 -23.920 -16.094 1.00 0.00 C ATOM 535 CG GLU A 33 9.493 -25.333 -16.388 1.00 0.00 C ATOM 536 CD GLU A 33 9.124 -25.760 -17.823 1.00 0.00 C ATOM 537 OE1 GLU A 33 7.981 -26.230 -18.051 1.00 0.00 O ATOM 538 OE2 GLU A 33 9.972 -25.619 -18.737 1.00 0.00 O ATOM 0 H GLU A 33 8.153 -21.872 -14.801 1.00 0.00 H new ATOM 0 HA GLU A 33 9.381 -24.456 -14.056 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.930 -23.857 -16.221 1.00 0.00 H new ATOM 0 HB3 GLU A 33 9.456 -23.217 -16.798 1.00 0.00 H new ATOM 0 HG2 GLU A 33 10.574 -25.386 -16.256 1.00 0.00 H new ATOM 0 HG3 GLU A 33 9.050 -26.027 -15.674 1.00 0.00 H new ATOM 545 N GLN A 34 11.751 -23.687 -13.970 1.00 0.00 N ATOM 546 CA GLN A 34 13.133 -23.240 -13.730 1.00 0.00 C ATOM 547 C GLN A 34 14.033 -23.215 -14.986 1.00 0.00 C ATOM 548 O GLN A 34 15.226 -22.924 -14.881 1.00 0.00 O ATOM 549 CB GLN A 34 13.768 -24.136 -12.653 1.00 0.00 C ATOM 550 CG GLN A 34 13.060 -24.141 -11.290 1.00 0.00 C ATOM 551 CD GLN A 34 13.904 -24.853 -10.232 1.00 0.00 C ATOM 552 OE1 GLN A 34 14.561 -25.858 -10.470 1.00 0.00 O ATOM 553 NE2 GLN A 34 13.941 -24.337 -9.027 1.00 0.00 N ATOM 0 H GLN A 34 11.567 -24.623 -13.610 1.00 0.00 H new ATOM 0 HA GLN A 34 13.066 -22.203 -13.401 1.00 0.00 H new ATOM 0 HB2 GLN A 34 13.800 -25.158 -13.029 1.00 0.00 H new ATOM 0 HB3 GLN A 34 14.800 -23.819 -12.505 1.00 0.00 H new ATOM 0 HG2 GLN A 34 12.865 -23.116 -10.974 1.00 0.00 H new ATOM 0 HG3 GLN A 34 12.093 -24.636 -11.381 1.00 0.00 H new ATOM 0 HE21 GLN A 34 13.399 -23.500 -8.814 1.00 0.00 H new ATOM 0 HE22 GLN A 34 14.512 -24.773 -8.303 1.00 0.00 H new ATOM 562 N ASP A 35 13.475 -23.521 -16.165 1.00 0.00 N ATOM 563 CA ASP A 35 14.075 -23.517 -17.512 1.00 0.00 C ATOM 564 C ASP A 35 15.274 -24.468 -17.754 1.00 0.00 C ATOM 565 O ASP A 35 15.229 -25.274 -18.689 1.00 0.00 O ATOM 566 CB ASP A 35 14.394 -22.073 -17.922 1.00 0.00 C ATOM 567 CG ASP A 35 14.895 -21.985 -19.375 1.00 0.00 C ATOM 568 OD1 ASP A 35 14.070 -22.132 -20.310 1.00 0.00 O ATOM 569 OD2 ASP A 35 16.111 -21.759 -19.587 1.00 0.00 O ATOM 0 H ASP A 35 12.496 -23.806 -16.207 1.00 0.00 H new ATOM 0 HA ASP A 35 13.313 -23.947 -18.162 1.00 0.00 H new ATOM 0 HB2 ASP A 35 13.501 -21.458 -17.808 1.00 0.00 H new ATOM 0 HB3 ASP A 35 15.150 -21.664 -17.252 1.00 0.00 H new ATOM 574 N GLN A 36 16.328 -24.411 -16.931 1.00 0.00 N ATOM 575 CA GLN A 36 17.539 -25.238 -17.073 1.00 0.00 C ATOM 576 C GLN A 36 18.281 -25.552 -15.761 1.00 0.00 C ATOM 577 O GLN A 36 19.380 -26.108 -15.800 1.00 0.00 O ATOM 578 CB GLN A 36 18.470 -24.614 -18.124 1.00 0.00 C ATOM 579 CG GLN A 36 19.252 -23.370 -17.656 1.00 0.00 C ATOM 580 CD GLN A 36 20.760 -23.554 -17.826 1.00 0.00 C ATOM 581 OE1 GLN A 36 21.401 -22.959 -18.683 1.00 0.00 O ATOM 582 NE2 GLN A 36 21.387 -24.404 -17.038 1.00 0.00 N ATOM 0 H GLN A 36 16.367 -23.778 -16.132 1.00 0.00 H new ATOM 0 HA GLN A 36 17.198 -26.216 -17.412 1.00 0.00 H new ATOM 0 HB2 GLN A 36 19.184 -25.371 -18.448 1.00 0.00 H new ATOM 0 HB3 GLN A 36 17.876 -24.342 -18.996 1.00 0.00 H new ATOM 0 HG2 GLN A 36 18.925 -22.499 -18.225 1.00 0.00 H new ATOM 0 HG3 GLN A 36 19.025 -23.170 -16.609 1.00 0.00 H new ATOM 0 HE21 GLN A 36 20.870 -24.909 -16.318 1.00 0.00 H new ATOM 0 HE22 GLN A 36 22.389 -24.557 -17.148 1.00 0.00 H new ATOM 591 N ALA A 37 17.721 -25.222 -14.596 1.00 0.00 N ATOM 592 CA ALA A 37 18.343 -25.510 -13.299 1.00 0.00 C ATOM 593 C ALA A 37 18.574 -27.021 -13.052 1.00 0.00 C ATOM 594 O ALA A 37 19.645 -27.433 -12.604 1.00 0.00 O ATOM 595 CB ALA A 37 17.428 -24.909 -12.231 1.00 0.00 C ATOM 0 H ALA A 37 16.822 -24.746 -14.523 1.00 0.00 H new ATOM 0 HA ALA A 37 19.339 -25.069 -13.269 1.00 0.00 H new ATOM 0 HB1 ALA A 37 17.849 -25.097 -11.243 1.00 0.00 H new ATOM 0 HB2 ALA A 37 17.341 -23.834 -12.389 1.00 0.00 H new ATOM 0 HB3 ALA A 37 16.441 -25.367 -12.298 1.00 0.00 H new ATOM 601 N SER A 38 17.591 -27.862 -13.399 1.00 0.00 N ATOM 602 CA SER A 38 17.656 -29.331 -13.268 1.00 0.00 C ATOM 603 C SER A 38 18.513 -30.021 -14.332 1.00 0.00 C ATOM 604 O SER A 38 18.777 -31.219 -14.216 1.00 0.00 O ATOM 605 CB SER A 38 16.237 -29.922 -13.292 1.00 0.00 C ATOM 606 OG SER A 38 15.391 -29.265 -12.358 1.00 0.00 O ATOM 0 H SER A 38 16.706 -27.536 -13.788 1.00 0.00 H new ATOM 0 HA SER A 38 18.143 -29.522 -12.312 1.00 0.00 H new ATOM 0 HB2 SER A 38 15.818 -29.829 -14.294 1.00 0.00 H new ATOM 0 HB3 SER A 38 16.280 -30.987 -13.062 1.00 0.00 H new ATOM 0 HG SER A 38 15.695 -29.460 -11.447 1.00 0.00 H new ATOM 612 N LYS A 39 18.963 -29.287 -15.360 1.00 0.00 N ATOM 613 CA LYS A 39 19.635 -29.831 -16.553 1.00 0.00 C ATOM 614 C LYS A 39 20.974 -30.528 -16.265 1.00 0.00 C ATOM 615 O LYS A 39 21.396 -31.380 -17.047 1.00 0.00 O ATOM 616 CB LYS A 39 19.788 -28.692 -17.576 1.00 0.00 C ATOM 617 CG LYS A 39 20.144 -29.174 -18.990 1.00 0.00 C ATOM 618 CD LYS A 39 20.103 -28.047 -20.035 1.00 0.00 C ATOM 619 CE LYS A 39 21.085 -26.922 -19.688 1.00 0.00 C ATOM 620 NZ LYS A 39 21.200 -25.933 -20.792 1.00 0.00 N ATOM 0 H LYS A 39 18.868 -28.272 -15.387 1.00 0.00 H new ATOM 0 HA LYS A 39 19.010 -30.628 -16.956 1.00 0.00 H new ATOM 0 HB2 LYS A 39 18.857 -28.127 -17.618 1.00 0.00 H new ATOM 0 HB3 LYS A 39 20.562 -28.007 -17.230 1.00 0.00 H new ATOM 0 HG2 LYS A 39 21.141 -29.615 -18.978 1.00 0.00 H new ATOM 0 HG3 LYS A 39 19.451 -29.962 -19.285 1.00 0.00 H new ATOM 0 HD2 LYS A 39 20.345 -28.452 -21.018 1.00 0.00 H new ATOM 0 HD3 LYS A 39 19.092 -27.643 -20.096 1.00 0.00 H new ATOM 0 HE2 LYS A 39 20.754 -26.417 -18.780 1.00 0.00 H new ATOM 0 HE3 LYS A 39 22.066 -27.347 -19.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 21.872 -25.187 -20.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 21.539 -26.410 -21.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 20.269 -25.509 -20.976 1.00 0.00 H new ATOM 634 N ASP A 40 21.606 -30.207 -15.133 1.00 0.00 N ATOM 635 CA ASP A 40 22.801 -30.897 -14.620 1.00 0.00 C ATOM 636 C ASP A 40 22.573 -31.549 -13.242 1.00 0.00 C ATOM 637 O ASP A 40 23.224 -32.536 -12.901 1.00 0.00 O ATOM 638 CB ASP A 40 23.959 -29.896 -14.534 1.00 0.00 C ATOM 639 CG ASP A 40 25.289 -30.620 -14.272 1.00 0.00 C ATOM 640 OD1 ASP A 40 25.740 -31.398 -15.145 1.00 0.00 O ATOM 641 OD2 ASP A 40 25.886 -30.447 -13.180 1.00 0.00 O ATOM 0 H ASP A 40 21.297 -29.443 -14.531 1.00 0.00 H new ATOM 0 HA ASP A 40 23.037 -31.703 -15.314 1.00 0.00 H new ATOM 0 HB2 ASP A 40 24.025 -29.329 -15.463 1.00 0.00 H new ATOM 0 HB3 ASP A 40 23.767 -29.179 -13.736 1.00 0.00 H new ATOM 646 N PHE A 41 21.636 -31.017 -12.448 1.00 0.00 N ATOM 647 CA PHE A 41 21.304 -31.526 -11.114 1.00 0.00 C ATOM 648 C PHE A 41 20.668 -32.926 -11.136 1.00 0.00 C ATOM 649 O PHE A 41 20.760 -33.667 -10.156 1.00 0.00 O ATOM 650 CB PHE A 41 20.388 -30.519 -10.403 1.00 0.00 C ATOM 651 CG PHE A 41 20.794 -30.272 -8.964 1.00 0.00 C ATOM 652 CD1 PHE A 41 21.761 -29.288 -8.690 1.00 0.00 C ATOM 653 CD2 PHE A 41 20.222 -31.022 -7.919 1.00 0.00 C ATOM 654 CE1 PHE A 41 22.140 -29.039 -7.357 1.00 0.00 C ATOM 655 CE2 PHE A 41 20.600 -30.764 -6.588 1.00 0.00 C ATOM 656 CZ PHE A 41 21.552 -29.768 -6.308 1.00 0.00 C ATOM 0 H PHE A 41 21.079 -30.207 -12.720 1.00 0.00 H new ATOM 0 HA PHE A 41 22.238 -31.636 -10.564 1.00 0.00 H new ATOM 0 HB2 PHE A 41 20.402 -29.575 -10.947 1.00 0.00 H new ATOM 0 HB3 PHE A 41 19.362 -30.887 -10.429 1.00 0.00 H new ATOM 0 HD1 PHE A 41 22.210 -28.727 -9.497 1.00 0.00 H new ATOM 0 HD2 PHE A 41 19.497 -31.792 -8.138 1.00 0.00 H new ATOM 0 HE1 PHE A 41 22.884 -28.287 -7.140 1.00 0.00 H new ATOM 0 HE2 PHE A 41 20.159 -31.331 -5.782 1.00 0.00 H new ATOM 0 HZ PHE A 41 21.832 -29.562 -5.285 1.00 0.00 H new ATOM 666 N ASN A 42 20.061 -33.311 -12.269 1.00 0.00 N ATOM 667 CA ASN A 42 19.510 -34.648 -12.508 1.00 0.00 C ATOM 668 C ASN A 42 20.498 -35.783 -12.248 1.00 0.00 C ATOM 669 O ASN A 42 20.088 -36.866 -11.810 1.00 0.00 O ATOM 670 CB ASN A 42 19.016 -34.757 -13.962 1.00 0.00 C ATOM 671 CG ASN A 42 20.114 -34.759 -15.026 1.00 0.00 C ATOM 672 OD1 ASN A 42 21.042 -33.970 -15.001 1.00 0.00 O ATOM 673 ND2 ASN A 42 20.058 -35.664 -15.976 1.00 0.00 N ATOM 0 H ASN A 42 19.938 -32.683 -13.063 1.00 0.00 H new ATOM 0 HA ASN A 42 18.692 -34.762 -11.796 1.00 0.00 H new ATOM 0 HB2 ASN A 42 18.433 -35.673 -14.063 1.00 0.00 H new ATOM 0 HB3 ASN A 42 18.340 -33.926 -14.162 1.00 0.00 H new ATOM 0 HD21 ASN A 42 20.789 -35.703 -16.687 1.00 0.00 H new ATOM 0 HD22 ASN A 42 19.284 -36.328 -16.003 1.00 0.00 H new ATOM 680 N ARG A 43 21.792 -35.554 -12.514 1.00 0.00 N ATOM 681 CA ARG A 43 22.782 -36.628 -12.533 1.00 0.00 C ATOM 682 C ARG A 43 22.899 -37.354 -11.189 1.00 0.00 C ATOM 683 O ARG A 43 23.014 -38.577 -11.151 1.00 0.00 O ATOM 684 CB ARG A 43 24.161 -36.080 -12.943 1.00 0.00 C ATOM 685 CG ARG A 43 24.229 -35.558 -14.391 1.00 0.00 C ATOM 686 CD ARG A 43 25.658 -35.153 -14.788 1.00 0.00 C ATOM 687 NE ARG A 43 26.143 -33.981 -14.032 1.00 0.00 N ATOM 688 CZ ARG A 43 26.906 -33.947 -12.955 1.00 0.00 C ATOM 689 NH1 ARG A 43 27.408 -35.022 -12.412 1.00 0.00 N ATOM 690 NH2 ARG A 43 27.181 -32.809 -12.388 1.00 0.00 N ATOM 0 H ARG A 43 22.173 -34.630 -12.719 1.00 0.00 H new ATOM 0 HA ARG A 43 22.435 -37.355 -13.268 1.00 0.00 H new ATOM 0 HB2 ARG A 43 24.435 -35.272 -12.264 1.00 0.00 H new ATOM 0 HB3 ARG A 43 24.904 -36.867 -12.817 1.00 0.00 H new ATOM 0 HG2 ARG A 43 23.868 -36.329 -15.072 1.00 0.00 H new ATOM 0 HG3 ARG A 43 23.565 -34.700 -14.499 1.00 0.00 H new ATOM 0 HD2 ARG A 43 26.331 -35.994 -14.620 1.00 0.00 H new ATOM 0 HD3 ARG A 43 25.686 -34.931 -15.855 1.00 0.00 H new ATOM 0 HE ARG A 43 25.848 -33.073 -14.391 1.00 0.00 H new ATOM 0 HH11 ARG A 43 27.216 -35.937 -12.820 1.00 0.00 H new ATOM 0 HH12 ARG A 43 27.993 -34.947 -11.580 1.00 0.00 H new ATOM 0 HH21 ARG A 43 26.807 -31.943 -12.775 1.00 0.00 H new ATOM 0 HH22 ARG A 43 27.770 -32.783 -11.556 1.00 0.00 H new ATOM 704 N SER A 44 22.822 -36.603 -10.088 1.00 0.00 N ATOM 705 CA SER A 44 22.944 -37.120 -8.717 1.00 0.00 C ATOM 706 C SER A 44 21.634 -37.680 -8.154 1.00 0.00 C ATOM 707 O SER A 44 21.674 -38.515 -7.248 1.00 0.00 O ATOM 708 CB SER A 44 23.477 -36.019 -7.795 1.00 0.00 C ATOM 709 OG SER A 44 24.700 -35.504 -8.304 1.00 0.00 O ATOM 0 H SER A 44 22.670 -35.595 -10.122 1.00 0.00 H new ATOM 0 HA SER A 44 23.643 -37.955 -8.761 1.00 0.00 H new ATOM 0 HB2 SER A 44 22.743 -35.218 -7.711 1.00 0.00 H new ATOM 0 HB3 SER A 44 23.631 -36.417 -6.792 1.00 0.00 H new ATOM 0 HG SER A 44 25.031 -34.800 -7.708 1.00 0.00 H new ATOM 715 N LYS A 45 20.465 -37.298 -8.695 1.00 0.00 N ATOM 716 CA LYS A 45 19.154 -37.874 -8.313 1.00 0.00 C ATOM 717 C LYS A 45 19.058 -39.374 -8.622 1.00 0.00 C ATOM 718 O LYS A 45 18.413 -40.123 -7.886 1.00 0.00 O ATOM 719 CB LYS A 45 18.005 -37.136 -9.022 1.00 0.00 C ATOM 720 CG LYS A 45 17.991 -35.623 -8.762 1.00 0.00 C ATOM 721 CD LYS A 45 16.743 -34.977 -9.378 1.00 0.00 C ATOM 722 CE LYS A 45 16.839 -33.451 -9.292 1.00 0.00 C ATOM 723 NZ LYS A 45 15.630 -32.794 -9.852 1.00 0.00 N ATOM 0 H LYS A 45 20.397 -36.578 -9.414 1.00 0.00 H new ATOM 0 HA LYS A 45 19.066 -37.746 -7.234 1.00 0.00 H new ATOM 0 HB2 LYS A 45 18.080 -37.311 -10.095 1.00 0.00 H new ATOM 0 HB3 LYS A 45 17.056 -37.561 -8.696 1.00 0.00 H new ATOM 0 HG2 LYS A 45 18.012 -35.433 -7.689 1.00 0.00 H new ATOM 0 HG3 LYS A 45 18.887 -35.168 -9.184 1.00 0.00 H new ATOM 0 HD2 LYS A 45 16.642 -35.284 -10.419 1.00 0.00 H new ATOM 0 HD3 LYS A 45 15.851 -35.322 -8.856 1.00 0.00 H new ATOM 0 HE2 LYS A 45 16.967 -33.152 -8.252 1.00 0.00 H new ATOM 0 HE3 LYS A 45 17.722 -33.110 -9.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 15.821 -31.782 -9.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 15.386 -33.234 -10.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 14.836 -32.905 -9.189 1.00 0.00 H new ATOM 737 N ALA A 46 19.744 -39.818 -9.679 1.00 0.00 N ATOM 738 CA ALA A 46 19.916 -41.225 -10.047 1.00 0.00 C ATOM 739 C ALA A 46 20.839 -42.026 -9.094 1.00 0.00 C ATOM 740 O ALA A 46 21.002 -43.235 -9.272 1.00 0.00 O ATOM 741 CB ALA A 46 20.438 -41.269 -11.489 1.00 0.00 C ATOM 0 H ALA A 46 20.212 -39.183 -10.326 1.00 0.00 H new ATOM 0 HA ALA A 46 18.947 -41.717 -9.960 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.577 -42.306 -11.794 1.00 0.00 H new ATOM 0 HB2 ALA A 46 19.718 -40.789 -12.152 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.391 -40.743 -11.547 1.00 0.00 H new ATOM 747 N LEU A 47 21.451 -41.371 -8.095 1.00 0.00 N ATOM 748 CA LEU A 47 22.459 -41.943 -7.198 1.00 0.00 C ATOM 749 C LEU A 47 22.068 -41.887 -5.733 1.00 0.00 C ATOM 750 O LEU A 47 22.107 -42.923 -5.060 1.00 0.00 O ATOM 751 CB LEU A 47 23.810 -41.225 -7.398 1.00 0.00 C ATOM 752 CG LEU A 47 24.393 -41.263 -8.821 1.00 0.00 C ATOM 753 CD1 LEU A 47 25.700 -40.471 -8.843 1.00 0.00 C ATOM 754 CD2 LEU A 47 24.687 -42.687 -9.288 1.00 0.00 C ATOM 0 H LEU A 47 21.248 -40.394 -7.885 1.00 0.00 H new ATOM 0 HA LEU A 47 22.542 -42.997 -7.462 1.00 0.00 H new ATOM 0 HB2 LEU A 47 23.691 -40.182 -7.104 1.00 0.00 H new ATOM 0 HB3 LEU A 47 24.538 -41.667 -6.717 1.00 0.00 H new ATOM 0 HG LEU A 47 23.651 -40.831 -9.492 1.00 0.00 H new ATOM 0 HD11 LEU A 47 26.121 -40.492 -9.848 1.00 0.00 H new ATOM 0 HD12 LEU A 47 25.505 -39.439 -8.553 1.00 0.00 H new ATOM 0 HD13 LEU A 47 26.407 -40.917 -8.144 1.00 0.00 H new ATOM 0 HD21 LEU A 47 25.097 -42.661 -10.298 1.00 0.00 H new ATOM 0 HD22 LEU A 47 25.409 -43.149 -8.615 1.00 0.00 H new ATOM 0 HD23 LEU A 47 23.765 -43.268 -9.285 1.00 0.00 H new ATOM 766 N PHE A 48 21.707 -40.709 -5.227 1.00 0.00 N ATOM 767 CA PHE A 48 21.667 -40.531 -3.783 1.00 0.00 C ATOM 768 C PHE A 48 20.894 -39.289 -3.308 1.00 0.00 C ATOM 769 O PHE A 48 20.718 -38.318 -4.051 1.00 0.00 O ATOM 770 CB PHE A 48 23.153 -40.564 -3.347 1.00 0.00 C ATOM 771 CG PHE A 48 23.695 -39.345 -2.639 1.00 0.00 C ATOM 772 CD1 PHE A 48 24.251 -38.316 -3.423 1.00 0.00 C ATOM 773 CD2 PHE A 48 23.658 -39.235 -1.239 1.00 0.00 C ATOM 774 CE1 PHE A 48 24.787 -37.174 -2.803 1.00 0.00 C ATOM 775 CE2 PHE A 48 24.186 -38.084 -0.620 1.00 0.00 C ATOM 776 CZ PHE A 48 24.753 -37.058 -1.401 1.00 0.00 C ATOM 0 H PHE A 48 21.447 -39.890 -5.777 1.00 0.00 H new ATOM 0 HA PHE A 48 21.090 -41.322 -3.304 1.00 0.00 H new ATOM 0 HB2 PHE A 48 23.293 -41.424 -2.693 1.00 0.00 H new ATOM 0 HB3 PHE A 48 23.761 -40.736 -4.235 1.00 0.00 H new ATOM 0 HD1 PHE A 48 24.266 -38.404 -4.499 1.00 0.00 H new ATOM 0 HD2 PHE A 48 23.229 -40.026 -0.642 1.00 0.00 H new ATOM 0 HE1 PHE A 48 25.224 -36.388 -3.401 1.00 0.00 H new ATOM 0 HE2 PHE A 48 24.156 -37.989 0.455 1.00 0.00 H new ATOM 0 HZ PHE A 48 25.162 -36.180 -0.923 1.00 0.00 H new ATOM 786 N SER A 49 20.425 -39.334 -2.055 1.00 0.00 N ATOM 787 CA SER A 49 19.558 -38.338 -1.408 1.00 0.00 C ATOM 788 C SER A 49 20.159 -36.925 -1.378 1.00 0.00 C ATOM 789 O SER A 49 21.044 -36.622 -0.575 1.00 0.00 O ATOM 790 CB SER A 49 19.233 -38.792 0.023 1.00 0.00 C ATOM 791 OG SER A 49 18.651 -40.090 0.014 1.00 0.00 O ATOM 0 H SER A 49 20.652 -40.108 -1.430 1.00 0.00 H new ATOM 0 HA SER A 49 18.652 -38.276 -2.010 1.00 0.00 H new ATOM 0 HB2 SER A 49 20.142 -38.799 0.624 1.00 0.00 H new ATOM 0 HB3 SER A 49 18.548 -38.083 0.489 1.00 0.00 H new ATOM 0 HG SER A 49 18.451 -40.365 0.933 1.00 0.00 H new ATOM 797 N GLN A 50 19.640 -36.032 -2.229 1.00 0.00 N ATOM 798 CA GLN A 50 20.083 -34.632 -2.316 1.00 0.00 C ATOM 799 C GLN A 50 19.742 -33.784 -1.072 1.00 0.00 C ATOM 800 O GLN A 50 20.227 -32.663 -0.949 1.00 0.00 O ATOM 801 CB GLN A 50 19.549 -33.979 -3.603 1.00 0.00 C ATOM 802 CG GLN A 50 20.038 -34.666 -4.891 1.00 0.00 C ATOM 803 CD GLN A 50 21.561 -34.765 -4.957 1.00 0.00 C ATOM 804 OE1 GLN A 50 22.267 -33.803 -5.220 1.00 0.00 O ATOM 805 NE2 GLN A 50 22.130 -35.919 -4.697 1.00 0.00 N ATOM 0 H GLN A 50 18.893 -36.262 -2.884 1.00 0.00 H new ATOM 0 HA GLN A 50 21.172 -34.660 -2.352 1.00 0.00 H new ATOM 0 HB2 GLN A 50 18.459 -33.995 -3.584 1.00 0.00 H new ATOM 0 HB3 GLN A 50 19.852 -32.932 -3.622 1.00 0.00 H new ATOM 0 HG2 GLN A 50 19.609 -35.666 -4.951 1.00 0.00 H new ATOM 0 HG3 GLN A 50 19.675 -34.111 -5.756 1.00 0.00 H new ATOM 0 HE21 GLN A 50 21.556 -36.732 -4.476 1.00 0.00 H new ATOM 0 HE22 GLN A 50 23.146 -36.002 -4.716 1.00 0.00 H new ATOM 814 N SER A 51 18.973 -34.316 -0.117 1.00 0.00 N ATOM 815 CA SER A 51 18.786 -33.711 1.213 1.00 0.00 C ATOM 816 C SER A 51 20.105 -33.485 1.967 1.00 0.00 C ATOM 817 O SER A 51 20.164 -32.639 2.862 1.00 0.00 O ATOM 818 CB SER A 51 17.846 -34.585 2.052 1.00 0.00 C ATOM 819 OG SER A 51 18.330 -35.916 2.118 1.00 0.00 O ATOM 0 H SER A 51 18.457 -35.187 -0.243 1.00 0.00 H new ATOM 0 HA SER A 51 18.346 -32.727 1.053 1.00 0.00 H new ATOM 0 HB2 SER A 51 17.759 -34.174 3.058 1.00 0.00 H new ATOM 0 HB3 SER A 51 16.847 -34.577 1.616 1.00 0.00 H new ATOM 0 HG SER A 51 17.719 -36.460 2.658 1.00 0.00 H new ATOM 825 N ALA A 52 21.180 -34.197 1.599 1.00 0.00 N ATOM 826 CA ALA A 52 22.533 -34.027 2.134 1.00 0.00 C ATOM 827 C ALA A 52 23.311 -32.809 1.589 1.00 0.00 C ATOM 828 O ALA A 52 24.373 -32.469 2.117 1.00 0.00 O ATOM 829 CB ALA A 52 23.299 -35.327 1.870 1.00 0.00 C ATOM 0 H ALA A 52 21.126 -34.933 0.895 1.00 0.00 H new ATOM 0 HA ALA A 52 22.437 -33.816 3.199 1.00 0.00 H new ATOM 0 HB1 ALA A 52 24.314 -35.236 2.256 1.00 0.00 H new ATOM 0 HB2 ALA A 52 22.794 -36.155 2.368 1.00 0.00 H new ATOM 0 HB3 ALA A 52 23.335 -35.517 0.797 1.00 0.00 H new ATOM 835 N ILE A 53 22.813 -32.153 0.538 1.00 0.00 N ATOM 836 CA ILE A 53 23.419 -30.974 -0.100 1.00 0.00 C ATOM 837 C ILE A 53 22.833 -29.691 0.529 1.00 0.00 C ATOM 838 O ILE A 53 21.768 -29.710 1.145 1.00 0.00 O ATOM 839 CB ILE A 53 23.213 -31.077 -1.635 1.00 0.00 C ATOM 840 CG1 ILE A 53 24.228 -32.024 -2.324 1.00 0.00 C ATOM 841 CG2 ILE A 53 23.299 -29.737 -2.390 1.00 0.00 C ATOM 842 CD1 ILE A 53 24.243 -33.476 -1.831 1.00 0.00 C ATOM 0 H ILE A 53 21.943 -32.437 0.088 1.00 0.00 H new ATOM 0 HA ILE A 53 24.494 -30.931 0.072 1.00 0.00 H new ATOM 0 HB ILE A 53 22.198 -31.468 -1.700 1.00 0.00 H new ATOM 0 HG12 ILE A 53 24.021 -32.028 -3.394 1.00 0.00 H new ATOM 0 HG13 ILE A 53 25.227 -31.608 -2.194 1.00 0.00 H new ATOM 0 HG21 ILE A 53 23.143 -29.909 -3.455 1.00 0.00 H new ATOM 0 HG22 ILE A 53 22.533 -29.058 -2.015 1.00 0.00 H new ATOM 0 HG23 ILE A 53 24.283 -29.294 -2.235 1.00 0.00 H new ATOM 0 HD11 ILE A 53 24.992 -34.041 -2.386 1.00 0.00 H new ATOM 0 HD12 ILE A 53 24.486 -33.497 -0.769 1.00 0.00 H new ATOM 0 HD13 ILE A 53 23.261 -33.923 -1.987 1.00 0.00 H new ATOM 854 N SER A 54 23.554 -28.574 0.399 1.00 0.00 N ATOM 855 CA SER A 54 23.216 -27.260 0.971 1.00 0.00 C ATOM 856 C SER A 54 21.775 -26.799 0.684 1.00 0.00 C ATOM 857 O SER A 54 21.271 -26.904 -0.439 1.00 0.00 O ATOM 858 CB SER A 54 24.207 -26.214 0.458 1.00 0.00 C ATOM 859 OG SER A 54 25.540 -26.600 0.748 1.00 0.00 O ATOM 0 H SER A 54 24.426 -28.556 -0.129 1.00 0.00 H new ATOM 0 HA SER A 54 23.285 -27.368 2.053 1.00 0.00 H new ATOM 0 HB2 SER A 54 24.086 -26.088 -0.618 1.00 0.00 H new ATOM 0 HB3 SER A 54 23.995 -25.249 0.918 1.00 0.00 H new ATOM 0 HG SER A 54 26.159 -25.919 0.410 1.00 0.00 H new ATOM 865 N GLN A 55 21.137 -26.209 1.698 1.00 0.00 N ATOM 866 CA GLN A 55 19.710 -25.839 1.766 1.00 0.00 C ATOM 867 C GLN A 55 19.205 -24.819 0.725 1.00 0.00 C ATOM 868 O GLN A 55 18.021 -24.477 0.692 1.00 0.00 O ATOM 869 CB GLN A 55 19.369 -25.350 3.183 1.00 0.00 C ATOM 870 CG GLN A 55 19.565 -26.453 4.230 1.00 0.00 C ATOM 871 CD GLN A 55 19.039 -26.052 5.609 1.00 0.00 C ATOM 872 OE1 GLN A 55 17.852 -25.821 5.817 1.00 0.00 O ATOM 873 NE2 GLN A 55 19.891 -25.947 6.613 1.00 0.00 N ATOM 0 H GLN A 55 21.632 -25.958 2.554 1.00 0.00 H new ATOM 0 HA GLN A 55 19.183 -26.759 1.513 1.00 0.00 H new ATOM 0 HB2 GLN A 55 19.998 -24.496 3.433 1.00 0.00 H new ATOM 0 HB3 GLN A 55 18.336 -25.004 3.209 1.00 0.00 H new ATOM 0 HG2 GLN A 55 19.055 -27.358 3.899 1.00 0.00 H new ATOM 0 HG3 GLN A 55 20.625 -26.694 4.305 1.00 0.00 H new ATOM 0 HE21 GLN A 55 20.882 -26.134 6.462 1.00 0.00 H new ATOM 0 HE22 GLN A 55 19.558 -25.678 7.539 1.00 0.00 H new ATOM 882 N LYS A 56 20.107 -24.269 -0.082 1.00 0.00 N ATOM 883 CA LYS A 56 19.843 -23.276 -1.140 1.00 0.00 C ATOM 884 C LYS A 56 20.350 -23.719 -2.525 1.00 0.00 C ATOM 885 O LYS A 56 20.109 -23.038 -3.519 1.00 0.00 O ATOM 886 CB LYS A 56 20.354 -21.893 -0.688 1.00 0.00 C ATOM 887 CG LYS A 56 21.671 -21.942 0.109 1.00 0.00 C ATOM 888 CD LYS A 56 22.167 -20.525 0.438 1.00 0.00 C ATOM 889 CE LYS A 56 23.477 -20.595 1.237 1.00 0.00 C ATOM 890 NZ LYS A 56 24.003 -19.240 1.555 1.00 0.00 N ATOM 0 H LYS A 56 21.096 -24.511 -0.019 1.00 0.00 H new ATOM 0 HA LYS A 56 18.766 -23.194 -1.283 1.00 0.00 H new ATOM 0 HB2 LYS A 56 20.496 -21.265 -1.567 1.00 0.00 H new ATOM 0 HB3 LYS A 56 19.588 -21.416 -0.076 1.00 0.00 H new ATOM 0 HG2 LYS A 56 21.521 -22.502 1.032 1.00 0.00 H new ATOM 0 HG3 LYS A 56 22.429 -22.472 -0.467 1.00 0.00 H new ATOM 0 HD2 LYS A 56 22.324 -19.963 -0.483 1.00 0.00 H new ATOM 0 HD3 LYS A 56 21.410 -19.991 1.012 1.00 0.00 H new ATOM 0 HE2 LYS A 56 23.309 -21.146 2.162 1.00 0.00 H new ATOM 0 HE3 LYS A 56 24.222 -21.149 0.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 24.888 -19.329 2.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 24.187 -18.723 0.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 23.303 -18.720 2.121 1.00 0.00 H new ATOM 904 N GLU A 57 21.019 -24.872 -2.587 1.00 0.00 N ATOM 905 CA GLU A 57 21.371 -25.596 -3.819 1.00 0.00 C ATOM 906 C GLU A 57 20.395 -26.750 -4.124 1.00 0.00 C ATOM 907 O GLU A 57 20.026 -26.977 -5.277 1.00 0.00 O ATOM 908 CB GLU A 57 22.779 -26.182 -3.666 1.00 0.00 C ATOM 909 CG GLU A 57 23.867 -25.125 -3.898 1.00 0.00 C ATOM 910 CD GLU A 57 25.281 -25.738 -3.789 1.00 0.00 C ATOM 911 OE1 GLU A 57 25.749 -26.378 -4.760 1.00 0.00 O ATOM 912 OE2 GLU A 57 25.948 -25.560 -2.741 1.00 0.00 O ATOM 0 H GLU A 57 21.346 -25.350 -1.747 1.00 0.00 H new ATOM 0 HA GLU A 57 21.319 -24.884 -4.643 1.00 0.00 H new ATOM 0 HB2 GLU A 57 22.890 -26.604 -2.667 1.00 0.00 H new ATOM 0 HB3 GLU A 57 22.911 -27.000 -4.374 1.00 0.00 H new ATOM 0 HG2 GLU A 57 23.738 -24.678 -4.884 1.00 0.00 H new ATOM 0 HG3 GLU A 57 23.759 -24.323 -3.168 1.00 0.00 H new ATOM 919 N TYR A 58 19.983 -27.481 -3.085 1.00 0.00 N ATOM 920 CA TYR A 58 19.242 -28.745 -3.160 1.00 0.00 C ATOM 921 C TYR A 58 17.796 -28.674 -3.705 1.00 0.00 C ATOM 922 O TYR A 58 17.136 -29.706 -3.850 1.00 0.00 O ATOM 923 CB TYR A 58 19.287 -29.395 -1.759 1.00 0.00 C ATOM 924 CG TYR A 58 18.391 -28.861 -0.648 1.00 0.00 C ATOM 925 CD1 TYR A 58 17.726 -27.620 -0.737 1.00 0.00 C ATOM 926 CD2 TYR A 58 18.244 -29.634 0.520 1.00 0.00 C ATOM 927 CE1 TYR A 58 16.850 -27.208 0.283 1.00 0.00 C ATOM 928 CE2 TYR A 58 17.395 -29.213 1.564 1.00 0.00 C ATOM 929 CZ TYR A 58 16.676 -28.004 1.437 1.00 0.00 C ATOM 930 OH TYR A 58 15.848 -27.596 2.438 1.00 0.00 O ATOM 0 H TYR A 58 20.165 -27.195 -2.123 1.00 0.00 H new ATOM 0 HA TYR A 58 19.741 -29.352 -3.915 1.00 0.00 H new ATOM 0 HB2 TYR A 58 19.055 -30.453 -1.884 1.00 0.00 H new ATOM 0 HB3 TYR A 58 20.316 -29.334 -1.405 1.00 0.00 H new ATOM 0 HD1 TYR A 58 17.891 -26.983 -1.593 1.00 0.00 H new ATOM 0 HD2 TYR A 58 18.789 -30.561 0.617 1.00 0.00 H new ATOM 0 HE1 TYR A 58 16.308 -26.279 0.184 1.00 0.00 H new ATOM 0 HE2 TYR A 58 17.295 -29.812 2.457 1.00 0.00 H new ATOM 0 HH TYR A 58 15.846 -28.265 3.154 1.00 0.00 H new ATOM 940 N ASP A 59 17.280 -27.473 -4.002 1.00 0.00 N ATOM 941 CA ASP A 59 15.862 -27.213 -4.294 1.00 0.00 C ATOM 942 C ASP A 59 15.272 -28.014 -5.472 1.00 0.00 C ATOM 943 O ASP A 59 14.081 -28.330 -5.462 1.00 0.00 O ATOM 944 CB ASP A 59 15.620 -25.708 -4.461 1.00 0.00 C ATOM 945 CG ASP A 59 16.167 -25.150 -5.786 1.00 0.00 C ATOM 946 OD1 ASP A 59 15.445 -25.201 -6.808 1.00 0.00 O ATOM 947 OD2 ASP A 59 17.316 -24.649 -5.797 1.00 0.00 O ATOM 0 H ASP A 59 17.854 -26.631 -4.047 1.00 0.00 H new ATOM 0 HA ASP A 59 15.316 -27.580 -3.425 1.00 0.00 H new ATOM 0 HB2 ASP A 59 14.550 -25.510 -4.405 1.00 0.00 H new ATOM 0 HB3 ASP A 59 16.086 -25.177 -3.631 1.00 0.00 H new ATOM 952 N SER A 60 16.115 -28.431 -6.420 1.00 0.00 N ATOM 953 CA SER A 60 15.739 -29.268 -7.565 1.00 0.00 C ATOM 954 C SER A 60 15.102 -30.612 -7.152 1.00 0.00 C ATOM 955 O SER A 60 14.291 -31.163 -7.897 1.00 0.00 O ATOM 956 CB SER A 60 16.986 -29.487 -8.431 1.00 0.00 C ATOM 957 OG SER A 60 16.674 -30.120 -9.662 1.00 0.00 O ATOM 0 H SER A 60 17.106 -28.190 -6.413 1.00 0.00 H new ATOM 0 HA SER A 60 14.968 -28.748 -8.133 1.00 0.00 H new ATOM 0 HB2 SER A 60 17.464 -28.527 -8.628 1.00 0.00 H new ATOM 0 HB3 SER A 60 17.706 -30.095 -7.883 1.00 0.00 H new ATOM 0 HG SER A 60 17.396 -29.959 -10.305 1.00 0.00 H new ATOM 963 N SER A 61 15.424 -31.132 -5.955 1.00 0.00 N ATOM 964 CA SER A 61 14.852 -32.374 -5.398 1.00 0.00 C ATOM 965 C SER A 61 13.788 -32.156 -4.308 1.00 0.00 C ATOM 966 O SER A 61 13.172 -33.115 -3.840 1.00 0.00 O ATOM 967 CB SER A 61 15.960 -33.282 -4.890 1.00 0.00 C ATOM 968 OG SER A 61 16.828 -33.635 -5.957 1.00 0.00 O ATOM 0 H SER A 61 16.103 -30.693 -5.333 1.00 0.00 H new ATOM 0 HA SER A 61 14.325 -32.852 -6.223 1.00 0.00 H new ATOM 0 HB2 SER A 61 16.523 -32.778 -4.104 1.00 0.00 H new ATOM 0 HB3 SER A 61 15.530 -34.181 -4.448 1.00 0.00 H new ATOM 0 HG SER A 61 17.441 -34.340 -5.660 1.00 0.00 H new ATOM 974 N LEU A 62 13.551 -30.907 -3.893 1.00 0.00 N ATOM 975 CA LEU A 62 12.533 -30.531 -2.897 1.00 0.00 C ATOM 976 C LEU A 62 11.143 -30.272 -3.509 1.00 0.00 C ATOM 977 O LEU A 62 10.166 -30.118 -2.772 1.00 0.00 O ATOM 978 CB LEU A 62 13.017 -29.266 -2.148 1.00 0.00 C ATOM 979 CG LEU A 62 13.764 -29.505 -0.821 1.00 0.00 C ATOM 980 CD1 LEU A 62 12.835 -30.053 0.266 1.00 0.00 C ATOM 981 CD2 LEU A 62 14.951 -30.462 -0.960 1.00 0.00 C ATOM 0 H LEU A 62 14.074 -30.106 -4.248 1.00 0.00 H new ATOM 0 HA LEU A 62 12.416 -31.374 -2.216 1.00 0.00 H new ATOM 0 HB2 LEU A 62 13.672 -28.703 -2.813 1.00 0.00 H new ATOM 0 HB3 LEU A 62 12.151 -28.636 -1.945 1.00 0.00 H new ATOM 0 HG LEU A 62 14.139 -28.523 -0.534 1.00 0.00 H new ATOM 0 HD11 LEU A 62 13.401 -30.207 1.185 1.00 0.00 H new ATOM 0 HD12 LEU A 62 12.031 -29.341 0.451 1.00 0.00 H new ATOM 0 HD13 LEU A 62 12.411 -31.002 -0.062 1.00 0.00 H new ATOM 0 HD21 LEU A 62 15.433 -30.587 0.010 1.00 0.00 H new ATOM 0 HD22 LEU A 62 14.598 -31.429 -1.317 1.00 0.00 H new ATOM 0 HD23 LEU A 62 15.668 -30.052 -1.671 1.00 0.00 H new ATOM 993 N ALA A 63 11.051 -30.216 -4.836 1.00 0.00 N ATOM 994 CA ALA A 63 9.882 -29.742 -5.576 1.00 0.00 C ATOM 995 C ALA A 63 9.547 -30.656 -6.783 1.00 0.00 C ATOM 996 O ALA A 63 9.960 -31.819 -6.825 1.00 0.00 O ATOM 997 CB ALA A 63 10.182 -28.282 -5.950 1.00 0.00 C ATOM 0 H ALA A 63 11.814 -30.509 -5.447 1.00 0.00 H new ATOM 0 HA ALA A 63 8.974 -29.785 -4.974 1.00 0.00 H new ATOM 0 HB1 ALA A 63 9.341 -27.869 -6.508 1.00 0.00 H new ATOM 0 HB2 ALA A 63 10.337 -27.698 -5.043 1.00 0.00 H new ATOM 0 HB3 ALA A 63 11.081 -28.241 -6.565 1.00 0.00 H new ATOM 1003 N THR A 64 8.742 -30.166 -7.725 1.00 0.00 N ATOM 1004 CA THR A 64 8.244 -30.887 -8.910 1.00 0.00 C ATOM 1005 C THR A 64 9.370 -31.146 -9.933 1.00 0.00 C ATOM 1006 O THR A 64 10.537 -30.851 -9.671 1.00 0.00 O ATOM 1007 CB THR A 64 7.076 -30.109 -9.563 1.00 0.00 C ATOM 1008 OG1 THR A 64 6.461 -29.213 -8.655 1.00 0.00 O ATOM 1009 CG2 THR A 64 5.968 -31.040 -10.051 1.00 0.00 C ATOM 0 H THR A 64 8.398 -29.206 -7.686 1.00 0.00 H new ATOM 0 HA THR A 64 7.875 -31.858 -8.579 1.00 0.00 H new ATOM 0 HB THR A 64 7.530 -29.572 -10.396 1.00 0.00 H new ATOM 0 HG1 THR A 64 5.730 -28.740 -9.106 1.00 0.00 H new ATOM 0 HG21 THR A 64 5.170 -30.450 -10.502 1.00 0.00 H new ATOM 0 HG22 THR A 64 6.372 -31.730 -10.792 1.00 0.00 H new ATOM 0 HG23 THR A 64 5.570 -31.605 -9.208 1.00 0.00 H new ATOM 1017 N LEU A 65 9.034 -31.688 -11.112 1.00 0.00 N ATOM 1018 CA LEU A 65 9.979 -32.171 -12.139 1.00 0.00 C ATOM 1019 C LEU A 65 11.116 -31.192 -12.507 1.00 0.00 C ATOM 1020 O LEU A 65 12.235 -31.610 -12.814 1.00 0.00 O ATOM 1021 CB LEU A 65 9.194 -32.534 -13.422 1.00 0.00 C ATOM 1022 CG LEU A 65 8.010 -33.507 -13.251 1.00 0.00 C ATOM 1023 CD1 LEU A 65 7.328 -33.743 -14.596 1.00 0.00 C ATOM 1024 CD2 LEU A 65 8.439 -34.853 -12.669 1.00 0.00 C ATOM 0 H LEU A 65 8.060 -31.808 -11.391 1.00 0.00 H new ATOM 0 HA LEU A 65 10.470 -33.037 -11.695 1.00 0.00 H new ATOM 0 HB2 LEU A 65 8.817 -31.612 -13.864 1.00 0.00 H new ATOM 0 HB3 LEU A 65 9.892 -32.968 -14.138 1.00 0.00 H new ATOM 0 HG LEU A 65 7.318 -33.042 -12.549 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.493 -34.431 -14.465 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.959 -32.795 -14.988 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.044 -34.171 -15.297 1.00 0.00 H new ATOM 0 HD21 LEU A 65 7.568 -35.500 -12.569 1.00 0.00 H new ATOM 0 HD22 LEU A 65 9.165 -35.322 -13.333 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.890 -34.698 -11.689 1.00 0.00 H new ATOM 1036 N ASP A 66 10.797 -29.904 -12.466 1.00 0.00 N ATOM 1037 CA ASP A 66 11.624 -28.747 -12.841 1.00 0.00 C ATOM 1038 C ASP A 66 10.923 -27.407 -12.519 1.00 0.00 C ATOM 1039 O ASP A 66 11.087 -26.409 -13.232 1.00 0.00 O ATOM 1040 CB ASP A 66 12.120 -28.840 -14.305 1.00 0.00 C ATOM 1041 CG ASP A 66 11.042 -29.118 -15.369 1.00 0.00 C ATOM 1042 OD1 ASP A 66 9.858 -28.738 -15.195 1.00 0.00 O ATOM 1043 OD2 ASP A 66 11.382 -29.732 -16.411 1.00 0.00 O ATOM 0 H ASP A 66 9.875 -29.609 -12.143 1.00 0.00 H new ATOM 0 HA ASP A 66 12.519 -28.773 -12.220 1.00 0.00 H new ATOM 0 HB2 ASP A 66 12.619 -27.905 -14.558 1.00 0.00 H new ATOM 0 HB3 ASP A 66 12.871 -29.628 -14.363 1.00 0.00 H new ATOM 1048 N HIS A 67 10.129 -27.374 -11.437 1.00 0.00 N ATOM 1049 CA HIS A 67 9.285 -26.231 -11.079 1.00 0.00 C ATOM 1050 C HIS A 67 9.558 -25.661 -9.685 1.00 0.00 C ATOM 1051 O HIS A 67 10.139 -26.327 -8.824 1.00 0.00 O ATOM 1052 CB HIS A 67 7.800 -26.623 -11.151 1.00 0.00 C ATOM 1053 CG HIS A 67 7.312 -27.195 -12.454 1.00 0.00 C ATOM 1054 ND1 HIS A 67 6.837 -28.499 -12.634 1.00 0.00 N ATOM 1055 CD2 HIS A 67 7.139 -26.501 -13.612 1.00 0.00 C ATOM 1056 CE1 HIS A 67 6.403 -28.560 -13.903 1.00 0.00 C ATOM 1057 NE2 HIS A 67 6.586 -27.379 -14.519 1.00 0.00 N ATOM 0 H HIS A 67 10.057 -28.151 -10.781 1.00 0.00 H new ATOM 0 HA HIS A 67 9.532 -25.456 -11.804 1.00 0.00 H new ATOM 0 HB2 HIS A 67 7.603 -27.352 -10.365 1.00 0.00 H new ATOM 0 HB3 HIS A 67 7.204 -25.739 -10.923 1.00 0.00 H new ATOM 0 HD2 HIS A 67 7.387 -25.464 -13.786 1.00 0.00 H new ATOM 0 HE1 HIS A 67 5.968 -29.434 -14.364 1.00 0.00 H new ATOM 0 HE2 HIS A 67 6.355 -27.169 -15.490 1.00 0.00 H new ATOM 1065 N THR A 68 9.044 -24.453 -9.445 1.00 0.00 N ATOM 1066 CA THR A 68 8.989 -23.817 -8.116 1.00 0.00 C ATOM 1067 C THR A 68 7.636 -23.135 -7.909 1.00 0.00 C ATOM 1068 O THR A 68 7.076 -22.556 -8.839 1.00 0.00 O ATOM 1069 CB THR A 68 10.122 -22.793 -7.969 1.00 0.00 C ATOM 1070 OG1 THR A 68 11.364 -23.405 -8.220 1.00 0.00 O ATOM 1071 CG2 THR A 68 10.225 -22.198 -6.570 1.00 0.00 C ATOM 0 H THR A 68 8.644 -23.872 -10.182 1.00 0.00 H new ATOM 0 HA THR A 68 9.112 -24.589 -7.357 1.00 0.00 H new ATOM 0 HB THR A 68 9.887 -22.004 -8.683 1.00 0.00 H new ATOM 0 HG1 THR A 68 11.981 -23.205 -7.486 1.00 0.00 H new ATOM 0 HG21 THR A 68 11.047 -21.483 -6.538 1.00 0.00 H new ATOM 0 HG22 THR A 68 9.293 -21.691 -6.321 1.00 0.00 H new ATOM 0 HG23 THR A 68 10.409 -22.994 -5.849 1.00 0.00 H new ATOM 1079 N GLU A 69 7.092 -23.197 -6.693 1.00 0.00 N ATOM 1080 CA GLU A 69 5.824 -22.543 -6.328 1.00 0.00 C ATOM 1081 C GLU A 69 6.065 -21.223 -5.579 1.00 0.00 C ATOM 1082 O GLU A 69 7.112 -21.018 -4.958 1.00 0.00 O ATOM 1083 CB GLU A 69 4.952 -23.487 -5.482 1.00 0.00 C ATOM 1084 CG GLU A 69 4.633 -24.807 -6.200 1.00 0.00 C ATOM 1085 CD GLU A 69 3.694 -25.694 -5.362 1.00 0.00 C ATOM 1086 OE1 GLU A 69 4.120 -26.190 -4.290 1.00 0.00 O ATOM 1087 OE2 GLU A 69 2.531 -25.911 -5.774 1.00 0.00 O ATOM 0 H GLU A 69 7.521 -23.708 -5.921 1.00 0.00 H new ATOM 0 HA GLU A 69 5.296 -22.310 -7.253 1.00 0.00 H new ATOM 0 HB2 GLU A 69 5.463 -23.703 -4.544 1.00 0.00 H new ATOM 0 HB3 GLU A 69 4.020 -22.983 -5.228 1.00 0.00 H new ATOM 0 HG2 GLU A 69 4.171 -24.595 -7.164 1.00 0.00 H new ATOM 0 HG3 GLU A 69 5.559 -25.345 -6.402 1.00 0.00 H new ATOM 1094 N ILE A 70 5.081 -20.329 -5.607 1.00 0.00 N ATOM 1095 CA ILE A 70 5.090 -19.028 -4.930 1.00 0.00 C ATOM 1096 C ILE A 70 3.808 -18.944 -4.103 1.00 0.00 C ATOM 1097 O ILE A 70 2.749 -19.306 -4.614 1.00 0.00 O ATOM 1098 CB ILE A 70 5.122 -17.857 -5.949 1.00 0.00 C ATOM 1099 CG1 ILE A 70 6.349 -17.827 -6.890 1.00 0.00 C ATOM 1100 CG2 ILE A 70 5.081 -16.492 -5.230 1.00 0.00 C ATOM 1101 CD1 ILE A 70 6.408 -18.931 -7.950 1.00 0.00 C ATOM 0 H ILE A 70 4.217 -20.495 -6.123 1.00 0.00 H new ATOM 0 HA ILE A 70 5.981 -18.944 -4.307 1.00 0.00 H new ATOM 0 HB ILE A 70 4.236 -18.035 -6.559 1.00 0.00 H new ATOM 0 HG12 ILE A 70 6.370 -16.862 -7.397 1.00 0.00 H new ATOM 0 HG13 ILE A 70 7.251 -17.887 -6.281 1.00 0.00 H new ATOM 0 HG21 ILE A 70 5.105 -15.691 -5.969 1.00 0.00 H new ATOM 0 HG22 ILE A 70 4.166 -16.417 -4.643 1.00 0.00 H new ATOM 0 HG23 ILE A 70 5.944 -16.402 -4.570 1.00 0.00 H new ATOM 0 HD11 ILE A 70 7.309 -18.811 -8.551 1.00 0.00 H new ATOM 0 HD12 ILE A 70 6.426 -19.905 -7.461 1.00 0.00 H new ATOM 0 HD13 ILE A 70 5.531 -18.864 -8.594 1.00 0.00 H new ATOM 1113 N LYS A 71 3.886 -18.425 -2.872 1.00 0.00 N ATOM 1114 CA LYS A 71 2.747 -18.293 -1.947 1.00 0.00 C ATOM 1115 C LYS A 71 2.687 -16.917 -1.268 1.00 0.00 C ATOM 1116 O LYS A 71 3.693 -16.210 -1.178 1.00 0.00 O ATOM 1117 CB LYS A 71 2.745 -19.443 -0.928 1.00 0.00 C ATOM 1118 CG LYS A 71 4.035 -19.590 -0.100 1.00 0.00 C ATOM 1119 CD LYS A 71 3.831 -20.514 1.119 1.00 0.00 C ATOM 1120 CE LYS A 71 3.220 -21.892 0.818 1.00 0.00 C ATOM 1121 NZ LYS A 71 4.105 -22.745 -0.022 1.00 0.00 N ATOM 0 H LYS A 71 4.761 -18.077 -2.480 1.00 0.00 H new ATOM 0 HA LYS A 71 1.836 -18.365 -2.541 1.00 0.00 H new ATOM 0 HB2 LYS A 71 1.908 -19.299 -0.244 1.00 0.00 H new ATOM 0 HB3 LYS A 71 2.565 -20.377 -1.460 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.828 -19.991 -0.731 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.363 -18.608 0.239 1.00 0.00 H new ATOM 0 HD2 LYS A 71 4.796 -20.663 1.604 1.00 0.00 H new ATOM 0 HD3 LYS A 71 3.190 -20.002 1.836 1.00 0.00 H new ATOM 0 HE2 LYS A 71 3.013 -22.405 1.757 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.265 -21.758 0.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 3.643 -23.661 -0.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 4.283 -22.272 -0.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 5.008 -22.899 0.471 1.00 0.00 H new ATOM 1135 N ALA A 72 1.495 -16.547 -0.797 1.00 0.00 N ATOM 1136 CA ALA A 72 1.219 -15.262 -0.153 1.00 0.00 C ATOM 1137 C ALA A 72 2.046 -15.019 1.128 1.00 0.00 C ATOM 1138 O ALA A 72 2.366 -15.968 1.849 1.00 0.00 O ATOM 1139 CB ALA A 72 -0.284 -15.195 0.168 1.00 0.00 C ATOM 0 H ALA A 72 0.673 -17.149 -0.854 1.00 0.00 H new ATOM 0 HA ALA A 72 1.513 -14.475 -0.848 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.511 -14.244 0.649 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -0.857 -15.281 -0.755 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -0.550 -16.013 0.838 1.00 0.00 H new ATOM 1145 N PRO A 73 2.318 -13.753 1.497 1.00 0.00 N ATOM 1146 CA PRO A 73 2.903 -13.407 2.796 1.00 0.00 C ATOM 1147 C PRO A 73 1.925 -13.571 3.962 1.00 0.00 C ATOM 1148 O PRO A 73 2.319 -13.899 5.075 1.00 0.00 O ATOM 1149 CB PRO A 73 3.255 -11.932 2.660 1.00 0.00 C ATOM 1150 CG PRO A 73 2.186 -11.400 1.708 1.00 0.00 C ATOM 1151 CD PRO A 73 2.059 -12.550 0.715 1.00 0.00 C ATOM 0 HA PRO A 73 3.746 -14.061 3.019 1.00 0.00 H new ATOM 0 HB2 PRO A 73 3.226 -11.421 3.623 1.00 0.00 H new ATOM 0 HB3 PRO A 73 4.258 -11.794 2.256 1.00 0.00 H new ATOM 0 HG2 PRO A 73 1.246 -11.196 2.221 1.00 0.00 H new ATOM 0 HG3 PRO A 73 2.493 -10.473 1.224 1.00 0.00 H new ATOM 0 HD2 PRO A 73 1.066 -12.577 0.267 1.00 0.00 H new ATOM 0 HD3 PRO A 73 2.774 -12.448 -0.101 1.00 0.00 H new ATOM 1159 N PHE A 74 0.645 -13.297 3.707 1.00 0.00 N ATOM 1160 CA PHE A 74 -0.411 -13.193 4.718 1.00 0.00 C ATOM 1161 C PHE A 74 -1.834 -13.261 4.147 1.00 0.00 C ATOM 1162 O PHE A 74 -2.070 -13.090 2.951 1.00 0.00 O ATOM 1163 CB PHE A 74 -0.253 -11.883 5.498 1.00 0.00 C ATOM 1164 CG PHE A 74 -0.036 -10.627 4.637 1.00 0.00 C ATOM 1165 CD1 PHE A 74 -1.099 -10.099 3.880 1.00 0.00 C ATOM 1166 CD2 PHE A 74 1.233 -10.027 4.521 1.00 0.00 C ATOM 1167 CE1 PHE A 74 -0.894 -9.002 3.023 1.00 0.00 C ATOM 1168 CE2 PHE A 74 1.425 -8.893 3.706 1.00 0.00 C ATOM 1169 CZ PHE A 74 0.363 -8.391 2.939 1.00 0.00 C ATOM 0 H PHE A 74 0.302 -13.136 2.760 1.00 0.00 H new ATOM 0 HA PHE A 74 -0.289 -14.060 5.367 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -1.143 -11.734 6.110 1.00 0.00 H new ATOM 0 HB3 PHE A 74 0.590 -11.985 6.181 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -2.082 -10.540 3.958 1.00 0.00 H new ATOM 0 HD2 PHE A 74 2.070 -10.441 5.064 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -1.712 -8.628 2.425 1.00 0.00 H new ATOM 0 HE2 PHE A 74 2.390 -8.410 3.672 1.00 0.00 H new ATOM 0 HZ PHE A 74 0.514 -7.541 2.290 1.00 0.00 H new ATOM 1179 N ASP A 75 -2.780 -13.481 5.056 1.00 0.00 N ATOM 1180 CA ASP A 75 -4.229 -13.374 4.838 1.00 0.00 C ATOM 1181 C ASP A 75 -4.641 -11.940 4.466 1.00 0.00 C ATOM 1182 O ASP A 75 -4.269 -10.969 5.144 1.00 0.00 O ATOM 1183 CB ASP A 75 -4.984 -13.830 6.092 1.00 0.00 C ATOM 1184 CG ASP A 75 -6.457 -14.147 5.785 1.00 0.00 C ATOM 1185 OD1 ASP A 75 -7.271 -13.209 5.632 1.00 0.00 O ATOM 1186 OD2 ASP A 75 -6.791 -15.352 5.694 1.00 0.00 O ATOM 0 H ASP A 75 -2.551 -13.752 6.012 1.00 0.00 H new ATOM 0 HA ASP A 75 -4.490 -14.023 4.002 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -4.500 -14.714 6.507 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -4.930 -13.051 6.853 1.00 0.00 H new ATOM 1191 N GLY A 76 -5.406 -11.802 3.391 1.00 0.00 N ATOM 1192 CA GLY A 76 -5.761 -10.501 2.836 1.00 0.00 C ATOM 1193 C GLY A 76 -6.561 -10.568 1.536 1.00 0.00 C ATOM 1194 O GLY A 76 -7.176 -11.581 1.197 1.00 0.00 O ATOM 0 H GLY A 76 -5.799 -12.591 2.878 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -6.340 -9.949 3.577 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -4.847 -9.934 2.658 1.00 0.00 H new ATOM 1198 N THR A 77 -6.515 -9.464 0.795 1.00 0.00 N ATOM 1199 CA THR A 77 -7.069 -9.326 -0.564 1.00 0.00 C ATOM 1200 C THR A 77 -5.912 -9.151 -1.539 1.00 0.00 C ATOM 1201 O THR A 77 -4.799 -8.790 -1.148 1.00 0.00 O ATOM 1202 CB THR A 77 -8.057 -8.143 -0.589 1.00 0.00 C ATOM 1203 OG1 THR A 77 -9.117 -8.420 0.299 1.00 0.00 O ATOM 1204 CG2 THR A 77 -8.716 -7.818 -1.924 1.00 0.00 C ATOM 0 H THR A 77 -6.077 -8.606 1.129 1.00 0.00 H new ATOM 0 HA THR A 77 -7.626 -10.214 -0.863 1.00 0.00 H new ATOM 0 HB THR A 77 -7.437 -7.286 -0.326 1.00 0.00 H new ATOM 0 HG1 THR A 77 -9.636 -7.603 0.453 1.00 0.00 H new ATOM 0 HG21 THR A 77 -9.386 -6.967 -1.801 1.00 0.00 H new ATOM 0 HG22 THR A 77 -7.949 -7.573 -2.658 1.00 0.00 H new ATOM 0 HG23 THR A 77 -9.285 -8.681 -2.268 1.00 0.00 H new ATOM 1212 N ILE A 78 -6.151 -9.456 -2.805 1.00 0.00 N ATOM 1213 CA ILE A 78 -5.105 -9.509 -3.828 1.00 0.00 C ATOM 1214 C ILE A 78 -5.557 -8.753 -5.076 1.00 0.00 C ATOM 1215 O ILE A 78 -6.726 -8.782 -5.452 1.00 0.00 O ATOM 1216 CB ILE A 78 -4.716 -10.988 -4.057 1.00 0.00 C ATOM 1217 CG1 ILE A 78 -3.347 -11.074 -4.751 1.00 0.00 C ATOM 1218 CG2 ILE A 78 -5.776 -11.780 -4.840 1.00 0.00 C ATOM 1219 CD1 ILE A 78 -2.653 -12.418 -4.599 1.00 0.00 C ATOM 0 H ILE A 78 -7.082 -9.676 -3.159 1.00 0.00 H new ATOM 0 HA ILE A 78 -4.196 -8.999 -3.509 1.00 0.00 H new ATOM 0 HB ILE A 78 -4.655 -11.454 -3.074 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -3.477 -10.863 -5.812 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -2.699 -10.296 -4.348 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -5.441 -12.810 -4.966 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -6.717 -11.769 -4.291 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -5.922 -11.323 -5.819 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -1.695 -12.393 -5.118 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -2.488 -12.625 -3.542 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -3.278 -13.201 -5.029 1.00 0.00 H new ATOM 1231 N GLY A 79 -4.631 -8.011 -5.683 1.00 0.00 N ATOM 1232 CA GLY A 79 -4.925 -7.126 -6.810 1.00 0.00 C ATOM 1233 C GLY A 79 -5.031 -7.846 -8.151 1.00 0.00 C ATOM 1234 O GLY A 79 -5.085 -9.076 -8.223 1.00 0.00 O ATOM 0 H GLY A 79 -3.650 -8.007 -5.405 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -5.861 -6.604 -6.614 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.145 -6.368 -6.877 1.00 0.00 H new ATOM 1238 N ASP A 80 -5.068 -7.072 -9.240 1.00 0.00 N ATOM 1239 CA ASP A 80 -4.919 -7.610 -10.587 1.00 0.00 C ATOM 1240 C ASP A 80 -3.511 -8.163 -10.813 1.00 0.00 C ATOM 1241 O ASP A 80 -2.499 -7.518 -10.518 1.00 0.00 O ATOM 1242 CB ASP A 80 -5.262 -6.585 -11.670 1.00 0.00 C ATOM 1243 CG ASP A 80 -4.606 -5.199 -11.491 1.00 0.00 C ATOM 1244 OD1 ASP A 80 -4.785 -4.564 -10.422 1.00 0.00 O ATOM 1245 OD2 ASP A 80 -3.937 -4.715 -12.432 1.00 0.00 O ATOM 0 H ASP A 80 -5.201 -6.061 -9.209 1.00 0.00 H new ATOM 0 HA ASP A 80 -5.636 -8.427 -10.669 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -4.964 -6.989 -12.638 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -6.344 -6.457 -11.698 1.00 0.00 H new ATOM 1250 N ALA A 81 -3.480 -9.366 -11.380 1.00 0.00 N ATOM 1251 CA ALA A 81 -2.269 -10.058 -11.791 1.00 0.00 C ATOM 1252 C ALA A 81 -1.436 -9.226 -12.796 1.00 0.00 C ATOM 1253 O ALA A 81 -1.971 -8.446 -13.588 1.00 0.00 O ATOM 1254 CB ALA A 81 -2.726 -11.371 -12.430 1.00 0.00 C ATOM 0 H ALA A 81 -4.327 -9.901 -11.571 1.00 0.00 H new ATOM 0 HA ALA A 81 -1.619 -10.228 -10.932 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -1.855 -11.937 -12.760 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.284 -11.956 -11.699 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -3.365 -11.156 -13.286 1.00 0.00 H new ATOM 1260 N LEU A 82 -0.126 -9.468 -12.819 1.00 0.00 N ATOM 1261 CA LEU A 82 0.863 -8.798 -13.687 1.00 0.00 C ATOM 1262 C LEU A 82 1.519 -9.771 -14.698 1.00 0.00 C ATOM 1263 O LEU A 82 2.378 -9.373 -15.491 1.00 0.00 O ATOM 1264 CB LEU A 82 1.904 -8.119 -12.791 1.00 0.00 C ATOM 1265 CG LEU A 82 1.485 -6.978 -11.870 1.00 0.00 C ATOM 1266 CD1 LEU A 82 2.668 -6.584 -10.979 1.00 0.00 C ATOM 1267 CD2 LEU A 82 1.119 -5.813 -12.752 1.00 0.00 C ATOM 0 H LEU A 82 0.302 -10.165 -12.210 1.00 0.00 H new ATOM 0 HA LEU A 82 0.356 -8.050 -14.296 1.00 0.00 H new ATOM 0 HB2 LEU A 82 2.350 -8.893 -12.167 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.693 -7.739 -13.440 1.00 0.00 H new ATOM 0 HG LEU A 82 0.648 -7.272 -11.237 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.371 -5.768 -10.320 1.00 0.00 H new ATOM 0 HD12 LEU A 82 2.974 -7.442 -10.380 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.502 -6.261 -11.603 1.00 0.00 H new ATOM 0 HD21 LEU A 82 0.812 -4.970 -12.133 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.982 -5.526 -13.353 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.298 -6.098 -13.410 1.00 0.00 H new ATOM 1279 N VAL A 83 1.114 -11.049 -14.681 1.00 0.00 N ATOM 1280 CA VAL A 83 1.727 -12.192 -15.397 1.00 0.00 C ATOM 1281 C VAL A 83 0.670 -13.206 -15.815 1.00 0.00 C ATOM 1282 O VAL A 83 -0.409 -13.284 -15.221 1.00 0.00 O ATOM 1283 CB VAL A 83 2.789 -12.887 -14.515 1.00 0.00 C ATOM 1284 CG1 VAL A 83 3.876 -11.927 -14.043 1.00 0.00 C ATOM 1285 CG2 VAL A 83 2.213 -13.565 -13.261 1.00 0.00 C ATOM 0 H VAL A 83 0.301 -11.336 -14.136 1.00 0.00 H new ATOM 0 HA VAL A 83 2.209 -11.798 -16.291 1.00 0.00 H new ATOM 0 HB VAL A 83 3.205 -13.648 -15.176 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.596 -12.467 -13.428 1.00 0.00 H new ATOM 0 HG12 VAL A 83 4.385 -11.501 -14.907 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.425 -11.127 -13.456 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.021 -14.030 -12.695 1.00 0.00 H new ATOM 0 HG22 VAL A 83 1.717 -12.819 -12.640 1.00 0.00 H new ATOM 0 HG23 VAL A 83 1.493 -14.327 -13.558 1.00 0.00 H new ATOM 1295 N ASN A 84 1.003 -14.032 -16.797 1.00 0.00 N ATOM 1296 CA ASN A 84 0.169 -15.070 -17.364 1.00 0.00 C ATOM 1297 C ASN A 84 1.005 -16.335 -17.584 1.00 0.00 C ATOM 1298 O ASN A 84 2.232 -16.307 -17.559 1.00 0.00 O ATOM 1299 CB ASN A 84 -0.349 -14.609 -18.734 1.00 0.00 C ATOM 1300 CG ASN A 84 -0.870 -13.187 -18.801 1.00 0.00 C ATOM 1301 OD1 ASN A 84 -2.042 -12.910 -18.596 1.00 0.00 O ATOM 1302 ND2 ASN A 84 -0.018 -12.246 -19.104 1.00 0.00 N ATOM 0 H ASN A 84 1.919 -13.988 -17.243 1.00 0.00 H new ATOM 0 HA ASN A 84 -0.659 -15.272 -16.684 1.00 0.00 H new ATOM 0 HB2 ASN A 84 0.457 -14.714 -19.460 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -1.148 -15.283 -19.044 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -0.330 -11.277 -19.170 1.00 0.00 H new ATOM 0 HD22 ASN A 84 0.960 -12.479 -19.275 1.00 0.00 H new ATOM 1309 N ILE A 85 0.331 -17.439 -17.883 1.00 0.00 N ATOM 1310 CA ILE A 85 0.902 -18.745 -18.206 1.00 0.00 C ATOM 1311 C ILE A 85 1.855 -18.613 -19.407 1.00 0.00 C ATOM 1312 O ILE A 85 1.421 -18.460 -20.551 1.00 0.00 O ATOM 1313 CB ILE A 85 -0.256 -19.727 -18.482 1.00 0.00 C ATOM 1314 CG1 ILE A 85 -1.141 -20.017 -17.239 1.00 0.00 C ATOM 1315 CG2 ILE A 85 0.271 -21.092 -18.973 1.00 0.00 C ATOM 1316 CD1 ILE A 85 -1.965 -18.852 -16.662 1.00 0.00 C ATOM 0 H ILE A 85 -0.689 -17.449 -17.909 1.00 0.00 H new ATOM 0 HA ILE A 85 1.490 -19.132 -17.374 1.00 0.00 H new ATOM 0 HB ILE A 85 -0.856 -19.227 -19.242 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -1.831 -20.820 -17.498 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -0.494 -20.395 -16.447 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -0.569 -21.761 -19.158 1.00 0.00 H new ATOM 0 HG22 ILE A 85 0.835 -20.954 -19.895 1.00 0.00 H new ATOM 0 HG23 ILE A 85 0.920 -21.526 -18.212 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -2.533 -19.200 -15.799 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -1.295 -18.049 -16.355 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -2.652 -18.481 -17.422 1.00 0.00 H new ATOM 1328 N GLY A 86 3.158 -18.618 -19.128 1.00 0.00 N ATOM 1329 CA GLY A 86 4.244 -18.550 -20.104 1.00 0.00 C ATOM 1330 C GLY A 86 5.111 -17.295 -19.966 1.00 0.00 C ATOM 1331 O GLY A 86 6.152 -17.206 -20.623 1.00 0.00 O ATOM 0 H GLY A 86 3.501 -18.672 -18.169 1.00 0.00 H new ATOM 0 HA2 GLY A 86 4.875 -19.432 -19.995 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.822 -18.582 -21.108 1.00 0.00 H new ATOM 1335 N ASP A 87 4.715 -16.327 -19.130 1.00 0.00 N ATOM 1336 CA ASP A 87 5.502 -15.111 -18.916 1.00 0.00 C ATOM 1337 C ASP A 87 6.831 -15.401 -18.204 1.00 0.00 C ATOM 1338 O ASP A 87 6.846 -15.937 -17.097 1.00 0.00 O ATOM 1339 CB ASP A 87 4.694 -14.081 -18.113 1.00 0.00 C ATOM 1340 CG ASP A 87 3.909 -13.122 -19.019 1.00 0.00 C ATOM 1341 OD1 ASP A 87 4.532 -12.439 -19.865 1.00 0.00 O ATOM 1342 OD2 ASP A 87 2.670 -13.032 -18.863 1.00 0.00 O ATOM 0 H ASP A 87 3.851 -16.365 -18.590 1.00 0.00 H new ATOM 0 HA ASP A 87 5.734 -14.703 -19.900 1.00 0.00 H new ATOM 0 HB2 ASP A 87 4.001 -14.602 -17.452 1.00 0.00 H new ATOM 0 HB3 ASP A 87 5.370 -13.507 -17.479 1.00 0.00 H new ATOM 1347 N TYR A 88 7.954 -15.028 -18.823 1.00 0.00 N ATOM 1348 CA TYR A 88 9.266 -15.007 -18.168 1.00 0.00 C ATOM 1349 C TYR A 88 9.280 -13.964 -17.041 1.00 0.00 C ATOM 1350 O TYR A 88 8.821 -12.836 -17.216 1.00 0.00 O ATOM 1351 CB TYR A 88 10.357 -14.740 -19.210 1.00 0.00 C ATOM 1352 CG TYR A 88 11.708 -14.605 -18.537 1.00 0.00 C ATOM 1353 CD1 TYR A 88 12.322 -15.754 -18.015 1.00 0.00 C ATOM 1354 CD2 TYR A 88 12.247 -13.334 -18.261 1.00 0.00 C ATOM 1355 CE1 TYR A 88 13.444 -15.634 -17.185 1.00 0.00 C ATOM 1356 CE2 TYR A 88 13.391 -13.213 -17.452 1.00 0.00 C ATOM 1357 CZ TYR A 88 13.995 -14.366 -16.907 1.00 0.00 C ATOM 1358 OH TYR A 88 15.091 -14.247 -16.111 1.00 0.00 O ATOM 0 H TYR A 88 7.980 -14.730 -19.798 1.00 0.00 H new ATOM 0 HA TYR A 88 9.467 -15.977 -17.714 1.00 0.00 H new ATOM 0 HB2 TYR A 88 10.384 -15.554 -19.934 1.00 0.00 H new ATOM 0 HB3 TYR A 88 10.126 -13.829 -19.763 1.00 0.00 H new ATOM 0 HD1 TYR A 88 11.929 -16.731 -18.253 1.00 0.00 H new ATOM 0 HD2 TYR A 88 11.781 -12.450 -18.671 1.00 0.00 H new ATOM 0 HE1 TYR A 88 13.890 -16.519 -16.755 1.00 0.00 H new ATOM 0 HE2 TYR A 88 13.807 -12.238 -17.248 1.00 0.00 H new ATOM 0 HH TYR A 88 15.334 -13.301 -16.029 1.00 0.00 H new ATOM 1368 N VAL A 89 9.836 -14.345 -15.890 1.00 0.00 N ATOM 1369 CA VAL A 89 9.971 -13.523 -14.685 1.00 0.00 C ATOM 1370 C VAL A 89 11.314 -13.750 -13.988 1.00 0.00 C ATOM 1371 O VAL A 89 11.973 -14.782 -14.130 1.00 0.00 O ATOM 1372 CB VAL A 89 8.834 -13.759 -13.668 1.00 0.00 C ATOM 1373 CG1 VAL A 89 7.468 -13.418 -14.248 1.00 0.00 C ATOM 1374 CG2 VAL A 89 8.772 -15.196 -13.137 1.00 0.00 C ATOM 0 H VAL A 89 10.223 -15.280 -15.766 1.00 0.00 H new ATOM 0 HA VAL A 89 9.912 -12.492 -15.034 1.00 0.00 H new ATOM 0 HB VAL A 89 9.074 -13.091 -12.841 1.00 0.00 H new ATOM 0 HG11 VAL A 89 6.699 -13.599 -13.498 1.00 0.00 H new ATOM 0 HG12 VAL A 89 7.449 -12.368 -14.541 1.00 0.00 H new ATOM 0 HG13 VAL A 89 7.277 -14.042 -15.121 1.00 0.00 H new ATOM 0 HG21 VAL A 89 7.949 -15.287 -12.428 1.00 0.00 H new ATOM 0 HG22 VAL A 89 8.613 -15.884 -13.967 1.00 0.00 H new ATOM 0 HG23 VAL A 89 9.710 -15.440 -12.638 1.00 0.00 H new ATOM 1384 N SER A 90 11.677 -12.769 -13.169 1.00 0.00 N ATOM 1385 CA SER A 90 12.916 -12.707 -12.394 1.00 0.00 C ATOM 1386 C SER A 90 12.617 -12.320 -10.940 1.00 0.00 C ATOM 1387 O SER A 90 11.664 -11.584 -10.659 1.00 0.00 O ATOM 1388 CB SER A 90 13.847 -11.743 -13.116 1.00 0.00 C ATOM 1389 OG SER A 90 14.986 -11.468 -12.317 1.00 0.00 O ATOM 0 H SER A 90 11.086 -11.952 -13.018 1.00 0.00 H new ATOM 0 HA SER A 90 13.411 -13.676 -12.329 1.00 0.00 H new ATOM 0 HB2 SER A 90 14.158 -12.172 -14.069 1.00 0.00 H new ATOM 0 HB3 SER A 90 13.319 -10.816 -13.340 1.00 0.00 H new ATOM 0 HG SER A 90 15.006 -10.514 -12.093 1.00 0.00 H new ATOM 1395 N ALA A 91 13.425 -12.839 -10.011 1.00 0.00 N ATOM 1396 CA ALA A 91 13.149 -12.876 -8.570 1.00 0.00 C ATOM 1397 C ALA A 91 12.866 -11.599 -7.803 1.00 0.00 C ATOM 1398 O ALA A 91 12.209 -11.658 -6.761 1.00 0.00 O ATOM 1399 CB ALA A 91 14.198 -13.760 -7.890 1.00 0.00 C ATOM 0 H ALA A 91 14.323 -13.261 -10.250 1.00 0.00 H new ATOM 0 HA ALA A 91 12.146 -13.300 -8.523 1.00 0.00 H new ATOM 0 HB1 ALA A 91 14.004 -13.796 -6.818 1.00 0.00 H new ATOM 0 HB2 ALA A 91 14.147 -14.768 -8.302 1.00 0.00 H new ATOM 0 HB3 ALA A 91 15.191 -13.347 -8.065 1.00 0.00 H new ATOM 1405 N SER A 92 13.307 -10.456 -8.293 1.00 0.00 N ATOM 1406 CA SER A 92 12.815 -9.175 -7.783 1.00 0.00 C ATOM 1407 C SER A 92 12.433 -8.182 -8.889 1.00 0.00 C ATOM 1408 O SER A 92 11.964 -7.074 -8.605 1.00 0.00 O ATOM 1409 CB SER A 92 13.812 -8.562 -6.788 1.00 0.00 C ATOM 1410 OG SER A 92 15.058 -8.300 -7.424 1.00 0.00 O ATOM 0 H SER A 92 14.000 -10.380 -9.038 1.00 0.00 H new ATOM 0 HA SER A 92 11.888 -9.390 -7.252 1.00 0.00 H new ATOM 0 HB2 SER A 92 13.404 -7.637 -6.380 1.00 0.00 H new ATOM 0 HB3 SER A 92 13.962 -9.242 -5.949 1.00 0.00 H new ATOM 0 HG SER A 92 15.680 -7.908 -6.776 1.00 0.00 H new ATOM 1416 N THR A 93 12.607 -8.575 -10.150 1.00 0.00 N ATOM 1417 CA THR A 93 12.605 -7.638 -11.301 1.00 0.00 C ATOM 1418 C THR A 93 11.309 -7.516 -12.118 1.00 0.00 C ATOM 1419 O THR A 93 11.169 -6.555 -12.877 1.00 0.00 O ATOM 1420 CB THR A 93 13.770 -8.001 -12.249 1.00 0.00 C ATOM 1421 OG1 THR A 93 14.937 -8.308 -11.514 1.00 0.00 O ATOM 1422 CG2 THR A 93 14.188 -6.896 -13.224 1.00 0.00 C ATOM 0 H THR A 93 12.754 -9.549 -10.415 1.00 0.00 H new ATOM 0 HA THR A 93 12.715 -6.656 -10.840 1.00 0.00 H new ATOM 0 HB THR A 93 13.376 -8.844 -12.816 1.00 0.00 H new ATOM 0 HG1 THR A 93 15.662 -8.537 -12.132 1.00 0.00 H new ATOM 0 HG21 THR A 93 15.012 -7.250 -13.844 1.00 0.00 H new ATOM 0 HG22 THR A 93 13.343 -6.633 -13.860 1.00 0.00 H new ATOM 0 HG23 THR A 93 14.508 -6.018 -12.663 1.00 0.00 H new ATOM 1430 N THR A 94 10.346 -8.433 -11.991 1.00 0.00 N ATOM 1431 CA THR A 94 9.230 -8.551 -12.966 1.00 0.00 C ATOM 1432 C THR A 94 7.843 -8.351 -12.380 1.00 0.00 C ATOM 1433 O THR A 94 6.980 -7.797 -13.057 1.00 0.00 O ATOM 1434 CB THR A 94 9.275 -9.892 -13.703 1.00 0.00 C ATOM 1435 OG1 THR A 94 10.584 -10.189 -14.136 1.00 0.00 O ATOM 1436 CG2 THR A 94 8.353 -9.899 -14.923 1.00 0.00 C ATOM 0 H THR A 94 10.306 -9.109 -11.228 1.00 0.00 H new ATOM 0 HA THR A 94 9.395 -7.727 -13.660 1.00 0.00 H new ATOM 0 HB THR A 94 8.938 -10.646 -12.992 1.00 0.00 H new ATOM 0 HG1 THR A 94 10.567 -10.437 -15.084 1.00 0.00 H new ATOM 0 HG21 THR A 94 8.413 -10.868 -15.419 1.00 0.00 H new ATOM 0 HG22 THR A 94 7.327 -9.718 -14.604 1.00 0.00 H new ATOM 0 HG23 THR A 94 8.661 -9.117 -15.616 1.00 0.00 H new ATOM 1444 N GLU A 95 7.698 -8.662 -11.092 1.00 0.00 N ATOM 1445 CA GLU A 95 6.521 -8.433 -10.251 1.00 0.00 C ATOM 1446 C GLU A 95 5.241 -9.151 -10.731 1.00 0.00 C ATOM 1447 O GLU A 95 4.828 -9.084 -11.884 1.00 0.00 O ATOM 1448 CB GLU A 95 6.319 -6.923 -10.042 1.00 0.00 C ATOM 1449 CG GLU A 95 7.601 -6.071 -10.093 1.00 0.00 C ATOM 1450 CD GLU A 95 7.429 -4.657 -9.507 1.00 0.00 C ATOM 1451 OE1 GLU A 95 6.628 -3.857 -10.046 1.00 0.00 O ATOM 1452 OE2 GLU A 95 8.125 -4.341 -8.512 1.00 0.00 O ATOM 0 H GLU A 95 8.451 -9.112 -10.572 1.00 0.00 H new ATOM 0 HA GLU A 95 6.723 -8.898 -9.286 1.00 0.00 H new ATOM 0 HB2 GLU A 95 5.630 -6.557 -10.803 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.839 -6.768 -9.076 1.00 0.00 H new ATOM 0 HG2 GLU A 95 8.391 -6.587 -9.548 1.00 0.00 H new ATOM 0 HG3 GLU A 95 7.930 -5.988 -11.129 1.00 0.00 H new ATOM 1459 N LEU A 96 4.623 -9.903 -9.820 1.00 0.00 N ATOM 1460 CA LEU A 96 3.544 -10.857 -10.160 1.00 0.00 C ATOM 1461 C LEU A 96 2.113 -10.361 -9.925 1.00 0.00 C ATOM 1462 O LEU A 96 1.215 -10.707 -10.691 1.00 0.00 O ATOM 1463 CB LEU A 96 3.724 -12.143 -9.356 1.00 0.00 C ATOM 1464 CG LEU A 96 5.148 -12.732 -9.381 1.00 0.00 C ATOM 1465 CD1 LEU A 96 5.303 -13.748 -8.257 1.00 0.00 C ATOM 1466 CD2 LEU A 96 5.484 -13.367 -10.724 1.00 0.00 C ATOM 0 H LEU A 96 4.849 -9.875 -8.826 1.00 0.00 H new ATOM 0 HA LEU A 96 3.646 -11.006 -11.235 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.446 -11.948 -8.320 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.030 -12.892 -9.737 1.00 0.00 H new ATOM 0 HG LEU A 96 5.851 -11.912 -9.232 1.00 0.00 H new ATOM 0 HD11 LEU A 96 6.311 -14.162 -8.278 1.00 0.00 H new ATOM 0 HD12 LEU A 96 5.131 -13.259 -7.298 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.578 -14.551 -8.390 1.00 0.00 H new ATOM 0 HD21 LEU A 96 6.497 -13.768 -10.694 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.781 -14.173 -10.931 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.415 -12.615 -11.510 1.00 0.00 H new ATOM 1478 N VAL A 97 1.911 -9.579 -8.862 1.00 0.00 N ATOM 1479 CA VAL A 97 0.651 -8.986 -8.374 1.00 0.00 C ATOM 1480 C VAL A 97 0.956 -8.206 -7.074 1.00 0.00 C ATOM 1481 O VAL A 97 2.099 -8.200 -6.621 1.00 0.00 O ATOM 1482 CB VAL A 97 -0.466 -10.037 -8.190 1.00 0.00 C ATOM 1483 CG1 VAL A 97 -0.138 -11.096 -7.166 1.00 0.00 C ATOM 1484 CG2 VAL A 97 -1.799 -9.446 -7.755 1.00 0.00 C ATOM 0 H VAL A 97 2.693 -9.317 -8.262 1.00 0.00 H new ATOM 0 HA VAL A 97 0.260 -8.298 -9.123 1.00 0.00 H new ATOM 0 HB VAL A 97 -0.542 -10.470 -9.187 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.968 -11.799 -7.091 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.763 -11.629 -7.470 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.028 -10.626 -6.197 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.533 -10.244 -7.647 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.676 -8.934 -6.800 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -2.144 -8.735 -8.506 1.00 0.00 H new ATOM 1494 N ARG A 98 -0.042 -7.585 -6.434 1.00 0.00 N ATOM 1495 CA ARG A 98 0.039 -7.012 -5.083 1.00 0.00 C ATOM 1496 C ARG A 98 -0.818 -7.747 -4.049 1.00 0.00 C ATOM 1497 O ARG A 98 -1.915 -8.169 -4.411 1.00 0.00 O ATOM 1498 CB ARG A 98 -0.315 -5.513 -5.138 1.00 0.00 C ATOM 1499 CG ARG A 98 -1.797 -5.294 -5.455 1.00 0.00 C ATOM 1500 CD ARG A 98 -2.112 -3.803 -5.575 1.00 0.00 C ATOM 1501 NE ARG A 98 -3.444 -3.568 -6.174 1.00 0.00 N ATOM 1502 CZ ARG A 98 -3.799 -3.706 -7.445 1.00 0.00 C ATOM 1503 NH1 ARG A 98 -2.966 -4.054 -8.385 1.00 0.00 N ATOM 1504 NH2 ARG A 98 -5.026 -3.530 -7.831 1.00 0.00 N ATOM 0 H ARG A 98 -0.962 -7.463 -6.857 1.00 0.00 H new ATOM 0 HA ARG A 98 1.067 -7.137 -4.743 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -0.074 -5.047 -4.183 1.00 0.00 H new ATOM 0 HB3 ARG A 98 0.296 -5.022 -5.896 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -2.053 -5.800 -6.386 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -2.411 -5.738 -4.671 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -2.071 -3.343 -4.588 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -1.349 -3.318 -6.184 1.00 0.00 H new ATOM 0 HE ARG A 98 -4.177 -3.264 -5.533 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -1.988 -4.235 -8.159 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -3.292 -4.146 -9.347 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -5.744 -3.279 -7.151 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -5.272 -3.642 -8.814 1.00 0.00 H new ATOM 1518 N VAL A 99 -0.398 -7.837 -2.777 1.00 0.00 N ATOM 1519 CA VAL A 99 -1.205 -8.445 -1.699 1.00 0.00 C ATOM 1520 C VAL A 99 -1.443 -7.411 -0.603 1.00 0.00 C ATOM 1521 O VAL A 99 -0.560 -6.605 -0.302 1.00 0.00 O ATOM 1522 CB VAL A 99 -0.561 -9.730 -1.129 1.00 0.00 C ATOM 1523 CG1 VAL A 99 -1.605 -10.565 -0.386 1.00 0.00 C ATOM 1524 CG2 VAL A 99 0.042 -10.628 -2.219 1.00 0.00 C ATOM 0 H VAL A 99 0.509 -7.492 -2.464 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.161 -8.751 -2.123 1.00 0.00 H new ATOM 0 HB VAL A 99 0.233 -9.393 -0.463 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.136 -11.466 0.009 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -2.020 -9.981 0.436 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -2.404 -10.843 -1.073 1.00 0.00 H new ATOM 0 HG21 VAL A 99 0.479 -11.514 -1.759 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.740 -10.929 -2.916 1.00 0.00 H new ATOM 0 HG23 VAL A 99 0.815 -10.079 -2.756 1.00 0.00 H new ATOM 1534 N THR A 100 -2.641 -7.387 -0.030 1.00 0.00 N ATOM 1535 CA THR A 100 -3.074 -6.309 0.868 1.00 0.00 C ATOM 1536 C THR A 100 -3.898 -6.828 2.056 1.00 0.00 C ATOM 1537 O THR A 100 -4.970 -7.411 1.906 1.00 0.00 O ATOM 1538 CB THR A 100 -3.710 -5.170 0.031 1.00 0.00 C ATOM 1539 OG1 THR A 100 -3.558 -3.969 0.742 1.00 0.00 O ATOM 1540 CG2 THR A 100 -5.202 -5.316 -0.265 1.00 0.00 C ATOM 0 H THR A 100 -3.344 -8.112 -0.172 1.00 0.00 H new ATOM 0 HA THR A 100 -2.213 -5.864 1.367 1.00 0.00 H new ATOM 0 HB THR A 100 -3.195 -5.198 -0.929 1.00 0.00 H new ATOM 0 HG1 THR A 100 -3.208 -3.277 0.143 1.00 0.00 H new ATOM 0 HG21 THR A 100 -5.541 -4.465 -0.856 1.00 0.00 H new ATOM 0 HG22 THR A 100 -5.374 -6.236 -0.823 1.00 0.00 H new ATOM 0 HG23 THR A 100 -5.757 -5.351 0.672 1.00 0.00 H new ATOM 1548 N ASN A 101 -3.332 -6.738 3.265 1.00 0.00 N ATOM 1549 CA ASN A 101 -3.864 -7.363 4.482 1.00 0.00 C ATOM 1550 C ASN A 101 -5.192 -6.708 4.914 1.00 0.00 C ATOM 1551 O ASN A 101 -5.305 -5.479 4.998 1.00 0.00 O ATOM 1552 CB ASN A 101 -2.790 -7.270 5.575 1.00 0.00 C ATOM 1553 CG ASN A 101 -3.246 -7.656 6.978 1.00 0.00 C ATOM 1554 OD1 ASN A 101 -3.103 -6.883 7.917 1.00 0.00 O ATOM 1555 ND2 ASN A 101 -3.771 -8.846 7.207 1.00 0.00 N ATOM 0 H ASN A 101 -2.471 -6.216 3.428 1.00 0.00 H new ATOM 0 HA ASN A 101 -4.095 -8.412 4.294 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -1.954 -7.911 5.294 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -2.412 -6.248 5.603 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -4.049 -9.107 8.153 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -3.898 -9.504 6.438 1.00 0.00 H new ATOM 1562 N LEU A 102 -6.185 -7.549 5.212 1.00 0.00 N ATOM 1563 CA LEU A 102 -7.465 -7.150 5.803 1.00 0.00 C ATOM 1564 C LEU A 102 -7.317 -6.801 7.289 1.00 0.00 C ATOM 1565 O LEU A 102 -6.273 -7.043 7.900 1.00 0.00 O ATOM 1566 CB LEU A 102 -8.454 -8.306 5.617 1.00 0.00 C ATOM 1567 CG LEU A 102 -8.887 -8.476 4.152 1.00 0.00 C ATOM 1568 CD1 LEU A 102 -9.413 -9.892 3.937 1.00 0.00 C ATOM 1569 CD2 LEU A 102 -9.977 -7.475 3.761 1.00 0.00 C ATOM 0 H LEU A 102 -6.120 -8.553 5.045 1.00 0.00 H new ATOM 0 HA LEU A 102 -7.830 -6.252 5.304 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -7.997 -9.231 5.968 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -9.334 -8.131 6.235 1.00 0.00 H new ATOM 0 HG LEU A 102 -8.014 -8.292 3.525 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -9.720 -10.012 2.898 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -8.627 -10.611 4.169 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -10.268 -10.066 4.590 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -10.255 -7.629 2.718 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -10.851 -7.623 4.395 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -9.602 -6.460 3.891 1.00 0.00 H new ATOM 1581 N ASN A 103 -8.374 -6.257 7.896 1.00 0.00 N ATOM 1582 CA ASN A 103 -8.366 -5.959 9.325 1.00 0.00 C ATOM 1583 C ASN A 103 -8.136 -7.240 10.168 1.00 0.00 C ATOM 1584 O ASN A 103 -8.624 -8.325 9.827 1.00 0.00 O ATOM 1585 CB ASN A 103 -9.656 -5.243 9.724 1.00 0.00 C ATOM 1586 CG ASN A 103 -9.924 -3.960 8.956 1.00 0.00 C ATOM 1587 OD1 ASN A 103 -9.076 -3.085 8.828 1.00 0.00 O ATOM 1588 ND2 ASN A 103 -11.107 -3.801 8.408 1.00 0.00 N ATOM 0 H ASN A 103 -9.243 -6.015 7.420 1.00 0.00 H new ATOM 0 HA ASN A 103 -7.531 -5.290 9.532 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -10.495 -5.923 9.576 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -9.615 -5.013 10.789 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -11.315 -2.953 7.880 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -11.818 -4.525 8.510 1.00 0.00 H new ATOM 1595 N PRO A 104 -7.444 -7.137 11.316 1.00 0.00 N ATOM 1596 CA PRO A 104 -6.950 -8.298 12.053 1.00 0.00 C ATOM 1597 C PRO A 104 -8.005 -8.992 12.927 1.00 0.00 C ATOM 1598 O PRO A 104 -7.792 -10.085 13.447 1.00 0.00 O ATOM 1599 CB PRO A 104 -5.777 -7.746 12.867 1.00 0.00 C ATOM 1600 CG PRO A 104 -6.209 -6.305 13.180 1.00 0.00 C ATOM 1601 CD PRO A 104 -7.119 -5.909 12.014 1.00 0.00 C ATOM 0 HA PRO A 104 -6.656 -9.098 11.374 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -5.612 -8.323 13.777 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -4.846 -7.773 12.300 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -6.738 -6.248 14.132 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -5.348 -5.641 13.253 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -8.022 -5.417 12.375 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -6.616 -5.206 11.350 1.00 0.00 H new ATOM 1609 N ILE A 105 -9.182 -8.378 13.006 1.00 0.00 N ATOM 1610 CA ILE A 105 -10.424 -8.896 13.607 1.00 0.00 C ATOM 1611 C ILE A 105 -10.975 -10.135 12.912 1.00 0.00 C ATOM 1612 O ILE A 105 -11.776 -10.860 13.508 1.00 0.00 O ATOM 1613 CB ILE A 105 -11.501 -7.792 13.702 1.00 0.00 C ATOM 1614 CG1 ILE A 105 -11.822 -7.173 12.321 1.00 0.00 C ATOM 1615 CG2 ILE A 105 -11.055 -6.715 14.707 1.00 0.00 C ATOM 1616 CD1 ILE A 105 -13.064 -6.269 12.330 1.00 0.00 C ATOM 0 H ILE A 105 -9.310 -7.439 12.628 1.00 0.00 H new ATOM 0 HA ILE A 105 -10.153 -9.213 14.614 1.00 0.00 H new ATOM 0 HB ILE A 105 -12.424 -8.249 14.059 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -10.963 -6.594 11.982 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -11.971 -7.975 11.598 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -11.817 -5.939 14.771 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -10.916 -7.168 15.688 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -10.115 -6.274 14.375 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -13.230 -5.869 11.330 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -13.934 -6.849 12.638 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -12.910 -5.447 13.029 1.00 0.00 H new ATOM 1628 N TYR A 106 -10.544 -10.391 11.677 1.00 0.00 N ATOM 1629 CA TYR A 106 -11.055 -11.509 10.894 1.00 0.00 C ATOM 1630 C TYR A 106 -10.039 -12.106 9.904 1.00 0.00 C ATOM 1631 O TYR A 106 -10.193 -13.262 9.506 1.00 0.00 O ATOM 1632 CB TYR A 106 -12.407 -11.080 10.324 1.00 0.00 C ATOM 1633 CG TYR A 106 -12.440 -10.698 8.865 1.00 0.00 C ATOM 1634 CD1 TYR A 106 -12.698 -11.677 7.892 1.00 0.00 C ATOM 1635 CD2 TYR A 106 -12.249 -9.354 8.501 1.00 0.00 C ATOM 1636 CE1 TYR A 106 -12.837 -11.298 6.540 1.00 0.00 C ATOM 1637 CE2 TYR A 106 -12.397 -8.966 7.154 1.00 0.00 C ATOM 1638 CZ TYR A 106 -12.716 -9.936 6.177 1.00 0.00 C ATOM 1639 OH TYR A 106 -12.929 -9.568 4.884 1.00 0.00 O ATOM 0 H TYR A 106 -9.837 -9.833 11.197 1.00 0.00 H new ATOM 0 HA TYR A 106 -11.222 -12.381 11.527 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -13.114 -11.895 10.478 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -12.767 -10.231 10.906 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -12.790 -12.715 8.177 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -11.990 -8.621 9.251 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -13.035 -12.045 5.785 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -12.267 -7.932 6.870 1.00 0.00 H new ATOM 0 HH TYR A 106 -12.809 -8.599 4.796 1.00 0.00 H new ATOM 1649 N ALA A 107 -8.945 -11.392 9.605 1.00 0.00 N ATOM 1650 CA ALA A 107 -7.783 -11.938 8.896 1.00 0.00 C ATOM 1651 C ALA A 107 -7.039 -13.040 9.666 1.00 0.00 C ATOM 1652 O ALA A 107 -6.187 -13.723 9.098 1.00 0.00 O ATOM 1653 CB ALA A 107 -6.842 -10.787 8.523 1.00 0.00 C ATOM 0 H ALA A 107 -8.842 -10.408 9.852 1.00 0.00 H new ATOM 0 HA ALA A 107 -8.154 -12.430 7.997 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.974 -11.183 7.995 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -7.367 -10.081 7.879 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -6.514 -10.277 9.429 1.00 0.00 H new ATOM 1659 N ASP A 108 -7.361 -13.230 10.949 1.00 0.00 N ATOM 1660 CA ASP A 108 -6.705 -14.214 11.810 1.00 0.00 C ATOM 1661 C ASP A 108 -7.679 -14.841 12.841 1.00 0.00 C ATOM 1662 O ASP A 108 -7.277 -15.259 13.930 1.00 0.00 O ATOM 1663 CB ASP A 108 -5.483 -13.514 12.430 1.00 0.00 C ATOM 1664 CG ASP A 108 -4.512 -14.482 13.130 1.00 0.00 C ATOM 1665 OD1 ASP A 108 -4.144 -15.524 12.533 1.00 0.00 O ATOM 1666 OD2 ASP A 108 -4.078 -14.181 14.268 1.00 0.00 O ATOM 0 H ASP A 108 -8.092 -12.699 11.422 1.00 0.00 H new ATOM 0 HA ASP A 108 -6.368 -15.078 11.238 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -4.947 -12.976 11.648 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.826 -12.771 13.150 1.00 0.00 H new ATOM 1671 N GLY A 109 -8.979 -14.875 12.519 1.00 0.00 N ATOM 1672 CA GLY A 109 -10.037 -15.461 13.366 1.00 0.00 C ATOM 1673 C GLY A 109 -10.128 -16.996 13.303 1.00 0.00 C ATOM 1674 O GLY A 109 -9.392 -17.655 12.564 1.00 0.00 O ATOM 0 H GLY A 109 -9.336 -14.489 11.645 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -9.864 -15.162 14.400 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -10.998 -15.040 13.069 1.00 0.00 H new ATOM 1678 N SER A 110 -11.048 -17.564 14.090 1.00 0.00 N ATOM 1679 CA SER A 110 -11.301 -19.015 14.177 1.00 0.00 C ATOM 1680 C SER A 110 -12.765 -19.328 14.536 1.00 0.00 C ATOM 1681 O SER A 110 -13.506 -18.455 14.993 1.00 0.00 O ATOM 1682 CB SER A 110 -10.349 -19.637 15.214 1.00 0.00 C ATOM 1683 OG SER A 110 -10.417 -21.059 15.175 1.00 0.00 O ATOM 0 H SER A 110 -11.655 -17.018 14.701 1.00 0.00 H new ATOM 0 HA SER A 110 -11.115 -19.450 13.195 1.00 0.00 H new ATOM 0 HB2 SER A 110 -9.327 -19.312 15.017 1.00 0.00 H new ATOM 0 HB3 SER A 110 -10.610 -19.283 16.212 1.00 0.00 H new ATOM 0 HG SER A 110 -9.803 -21.434 15.840 1.00 0.00 H new ATOM 1689 N HIS A 111 -13.186 -20.582 14.337 1.00 0.00 N ATOM 1690 CA HIS A 111 -14.540 -21.089 14.624 1.00 0.00 C ATOM 1691 C HIS A 111 -14.894 -21.144 16.124 1.00 0.00 C ATOM 1692 O HIS A 111 -16.073 -21.219 16.469 1.00 0.00 O ATOM 1693 CB HIS A 111 -14.702 -22.485 14.004 1.00 0.00 C ATOM 1694 CG HIS A 111 -14.546 -22.508 12.503 1.00 0.00 C ATOM 1695 ND1 HIS A 111 -15.449 -21.949 11.590 1.00 0.00 N ATOM 1696 CD2 HIS A 111 -13.508 -23.063 11.813 1.00 0.00 C ATOM 1697 CE1 HIS A 111 -14.933 -22.185 10.371 1.00 0.00 C ATOM 1698 NE2 HIS A 111 -13.768 -22.850 10.476 1.00 0.00 N ATOM 0 H HIS A 111 -12.572 -21.302 13.957 1.00 0.00 H new ATOM 0 HA HIS A 111 -15.233 -20.375 14.179 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -13.966 -23.156 14.447 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -15.686 -22.875 14.263 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -12.651 -23.570 12.232 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -15.389 -21.884 9.440 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -13.178 -23.146 9.699 1.00 0.00 H new ATOM 1706 N HIS A 112 -13.896 -21.099 17.015 1.00 0.00 N ATOM 1707 CA HIS A 112 -14.055 -21.086 18.479 1.00 0.00 C ATOM 1708 C HIS A 112 -12.900 -20.355 19.184 1.00 0.00 C ATOM 1709 O HIS A 112 -11.957 -19.890 18.536 1.00 0.00 O ATOM 1710 CB HIS A 112 -14.190 -22.530 18.997 1.00 0.00 C ATOM 1711 CG HIS A 112 -12.893 -23.305 19.031 1.00 0.00 C ATOM 1712 ND1 HIS A 112 -12.080 -23.472 20.159 1.00 0.00 N ATOM 1713 CD2 HIS A 112 -12.322 -23.954 17.976 1.00 0.00 C ATOM 1714 CE1 HIS A 112 -11.046 -24.230 19.753 1.00 0.00 C ATOM 1715 NE2 HIS A 112 -11.164 -24.532 18.450 1.00 0.00 N ATOM 0 H HIS A 112 -12.918 -21.069 16.728 1.00 0.00 H new ATOM 0 HA HIS A 112 -14.963 -20.531 18.714 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -14.610 -22.505 20.002 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -14.902 -23.064 18.367 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -12.703 -24.005 16.967 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -10.233 -24.551 20.387 1.00 0.00 H new ATOM 0 HE2 HIS A 112 -10.509 -25.093 17.905 1.00 0.00 H new ATOM 1723 N HIS A 113 -12.971 -20.244 20.516 1.00 0.00 N ATOM 1724 CA HIS A 113 -12.009 -19.494 21.344 1.00 0.00 C ATOM 1725 C HIS A 113 -11.464 -20.289 22.553 1.00 0.00 C ATOM 1726 O HIS A 113 -10.528 -19.838 23.215 1.00 0.00 O ATOM 1727 CB HIS A 113 -12.690 -18.176 21.762 1.00 0.00 C ATOM 1728 CG HIS A 113 -11.793 -17.180 22.467 1.00 0.00 C ATOM 1729 ND1 HIS A 113 -11.940 -16.743 23.787 1.00 0.00 N ATOM 1730 CD2 HIS A 113 -10.731 -16.539 21.902 1.00 0.00 C ATOM 1731 CE1 HIS A 113 -10.948 -15.860 23.991 1.00 0.00 C ATOM 1732 NE2 HIS A 113 -10.208 -15.717 22.878 1.00 0.00 N ATOM 0 H HIS A 113 -13.713 -20.681 21.063 1.00 0.00 H new ATOM 0 HA HIS A 113 -11.116 -19.292 20.752 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -13.103 -17.701 20.872 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -13.529 -18.411 22.417 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -10.371 -16.652 20.890 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -10.770 -15.338 24.920 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -9.398 -15.105 22.773 1.00 0.00 H new ATOM 1740 N HIS A 114 -11.999 -21.487 22.837 1.00 0.00 N ATOM 1741 CA HIS A 114 -11.563 -22.348 23.955 1.00 0.00 C ATOM 1742 C HIS A 114 -11.929 -23.837 23.786 1.00 0.00 C ATOM 1743 O HIS A 114 -11.125 -24.702 24.144 1.00 0.00 O ATOM 1744 CB HIS A 114 -12.139 -21.814 25.283 1.00 0.00 C ATOM 1745 CG HIS A 114 -13.647 -21.739 25.343 1.00 0.00 C ATOM 1746 ND1 HIS A 114 -14.492 -22.741 25.830 1.00 0.00 N ATOM 1747 CD2 HIS A 114 -14.413 -20.694 24.912 1.00 0.00 C ATOM 1748 CE1 HIS A 114 -15.745 -22.275 25.686 1.00 0.00 C ATOM 1749 NE2 HIS A 114 -15.726 -21.048 25.136 1.00 0.00 N ATOM 0 H HIS A 114 -12.758 -21.893 22.290 1.00 0.00 H new ATOM 0 HA HIS A 114 -10.474 -22.304 23.962 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -11.790 -22.452 26.095 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -11.734 -20.818 25.463 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -14.059 -19.770 24.480 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -16.639 -22.810 25.971 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -16.543 -20.477 24.921 1.00 0.00 H new ATOM 1757 N HIS A 115 -13.102 -24.147 23.221 1.00 0.00 N ATOM 1758 CA HIS A 115 -13.608 -25.514 23.003 1.00 0.00 C ATOM 1759 C HIS A 115 -14.619 -25.567 21.845 1.00 0.00 C ATOM 1760 O HIS A 115 -15.289 -24.569 21.555 1.00 0.00 O ATOM 1761 CB HIS A 115 -14.256 -26.022 24.305 1.00 0.00 C ATOM 1762 CG HIS A 115 -14.704 -27.462 24.248 1.00 0.00 C ATOM 1763 ND1 HIS A 115 -13.919 -28.540 23.822 1.00 0.00 N ATOM 1764 CD2 HIS A 115 -15.945 -27.926 24.579 1.00 0.00 C ATOM 1765 CE1 HIS A 115 -14.710 -29.627 23.905 1.00 0.00 C ATOM 1766 NE2 HIS A 115 -15.929 -29.287 24.357 1.00 0.00 N ATOM 0 H HIS A 115 -13.749 -23.431 22.891 1.00 0.00 H new ATOM 0 HA HIS A 115 -12.771 -26.156 22.729 1.00 0.00 H new ATOM 0 HB2 HIS A 115 -13.544 -25.906 25.122 1.00 0.00 H new ATOM 0 HB3 HIS A 115 -15.115 -25.394 24.540 1.00 0.00 H new ATOM 0 HD2 HIS A 115 -16.777 -27.341 24.943 1.00 0.00 H new ATOM 0 HE1 HIS A 115 -14.407 -30.631 23.645 1.00 0.00 H new ATOM 0 HE2 HIS A 115 -16.709 -29.926 24.510 1.00 0.00 H new ATOM 1774 N HIS A 116 -14.748 -26.733 21.200 1.00 0.00 N ATOM 1775 CA HIS A 116 -15.621 -26.994 20.040 1.00 0.00 C ATOM 1776 C HIS A 116 -16.139 -28.439 20.015 1.00 0.00 C ATOM 1777 O HIS A 116 -15.318 -29.387 20.045 1.00 0.00 O ATOM 1778 CB HIS A 116 -14.846 -26.641 18.754 1.00 0.00 C ATOM 1779 CG HIS A 116 -15.673 -26.679 17.495 1.00 0.00 C ATOM 1780 ND1 HIS A 116 -15.622 -27.668 16.506 1.00 0.00 N ATOM 1781 CD2 HIS A 116 -16.569 -25.723 17.113 1.00 0.00 C ATOM 1782 CE1 HIS A 116 -16.496 -27.286 15.557 1.00 0.00 C ATOM 1783 NE2 HIS A 116 -17.079 -26.123 15.897 1.00 0.00 N ATOM 1784 OXT HIS A 116 -17.376 -28.620 19.990 1.00 0.00 O ATOM 0 H HIS A 116 -14.224 -27.561 21.483 1.00 0.00 H new ATOM 0 HA HIS A 116 -16.509 -26.366 20.115 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -14.420 -25.644 18.864 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -14.011 -27.334 18.646 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -16.828 -24.827 17.658 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -16.700 -27.836 14.650 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -17.779 -25.623 15.349 1.00 0.00 H new TER 1792 HIS A 116