USER MOD reduce.3.24.130724 H: found=0, std=0, add=1028, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1026 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 30 GLN : amide:sc= -0.701 X(o=0.27,f=0.076) USER MOD Set 1.2: A 120 ASN : amide:sc= 0.976 K(o=0.27,f=-2.5!) USER MOD Set 2.1: A 74 SER OG : rot 51:sc= 0.562 USER MOD Set 2.2: A 75 GLN : amide:sc= -0.0138 X(o=0.55,f=0.55) USER MOD Set 3.1: A 32 GLN : amide:sc= -0.41 K(o=-0.41,f=0.79) USER MOD Set 3.2: A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 3 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 9 GLN : amide:sc= -0.372 X(o=-0.37,f=-0.46) USER MOD Single : A 12 LYS NZ :NH3+ 146:sc= 0.984 (180deg=-0.0496) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 18 LYS NZ :NH3+ 171:sc= 0.0683 (180deg=-0.162) USER MOD Single : A 20 LYS NZ :NH3+ -139:sc= -0.97 (180deg=-3.17!) USER MOD Single : A 23 GLN : amide:sc= -0.648 K(o=-0.65,f=0) USER MOD Single : A 26 HIS : no HD1:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 MET CE :methyl -166:sc= 0 (180deg=-0.0601) USER MOD Single : A 38 GLN : amide:sc= -0.0521 X(o=-0.052,f=-0.39) USER MOD Single : A 40 CYS SG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 43 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 45 ASN : amide:sc= 0.0146 K(o=0.015,f=-1.5) USER MOD Single : A 47 MET CE :methyl 168:sc= -0.0118 (180deg=-0.197) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -139:sc= 0.926 (180deg=-0.551) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot -107:sc= 0.116 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ -142:sc= -2.6! (180deg=-4.28!) USER MOD Single : A 63 ASN : amide:sc= -0.603 K(o=-0.6,f=-7.4!) USER MOD Single : A 64 SER OG : rot 160:sc= -0.229 USER MOD Single : A 65 SER OG : rot 180:sc= -0.194 USER MOD Single : A 71 GLN : amide:sc= -0.308 X(o=-0.31,f=-0.16) USER MOD Single : A 72 SER OG : rot 89:sc= 0.838 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 MET CE :methyl 163:sc= -1.56 (180deg=-2.07!) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 GLN : amide:sc= -1.41 K(o=-1.4,f=-0.0059) USER MOD Single : A 89 MET CE :methyl -130:sc= -0.44 (180deg=-4.18!) USER MOD Single : A 90 GLN : amide:sc= -0.0144 K(o=-0.014,f=-2.4!) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -0.0118 K(o=-0.012,f=-0.78) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 MET CE :methyl -144:sc= 0 (180deg=-0.92) USER MOD Single : A 104 ASN : amide:sc= -0.818 K(o=-0.82,f=-0.0077) USER MOD Single : A 109 ASN : amide:sc= -0.0864 X(o=-0.086,f=-0.36!) USER MOD Single : A 110 LYS NZ :NH3+ -149:sc= 1.98 (180deg=0.156) USER MOD Single : A 111 THR OG1 : rot -50:sc= -1.63! USER MOD Single : A 112 MET CE :methyl -129:sc= -0.666 (180deg=-1.37) USER MOD Single : A 116 SER OG : rot -6:sc= -0.482 USER MOD Single : A 118 ASN : amide:sc= -1.04 K(o=-1,f=-1.6) USER MOD Single : A 128 THR OG1 : rot -69:sc= 0.718 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 1.215 0.971 1.000 1.00 0.00 N ATOM 2 CA PRO A 1 2.099 1.088 -0.188 1.00 0.00 C ATOM 3 C PRO A 1 2.034 -0.183 -1.066 1.00 0.00 C ATOM 4 O PRO A 1 2.048 -0.095 -2.294 1.00 0.00 O ATOM 5 CB PRO A 1 3.529 1.352 0.311 1.00 0.00 C ATOM 6 CG PRO A 1 3.491 0.822 1.711 1.00 0.00 C ATOM 7 CD PRO A 1 2.069 1.060 2.209 1.00 0.00 C ATOM 0 H2 PRO A 1 0.709 0.085 0.984 1.00 0.00 H new ATOM 0 H3 PRO A 1 0.516 1.714 1.000 1.00 0.00 H new ATOM 0 HA PRO A 1 1.767 1.913 -0.818 1.00 0.00 H new ATOM 0 HB2 PRO A 1 4.272 0.836 -0.297 1.00 0.00 H new ATOM 0 HB3 PRO A 1 3.777 2.413 0.286 1.00 0.00 H new ATOM 0 HG2 PRO A 1 3.741 -0.239 1.734 1.00 0.00 H new ATOM 0 HG3 PRO A 1 4.217 1.334 2.342 1.00 0.00 H new ATOM 0 HD2 PRO A 1 1.781 0.315 2.950 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.977 2.036 2.686 1.00 0.00 H new ATOM 15 N GLN A 2 1.958 -1.361 -0.415 1.00 0.00 N ATOM 16 CA GLN A 2 2.173 -2.666 -1.077 1.00 0.00 C ATOM 17 C GLN A 2 0.898 -3.256 -1.701 1.00 0.00 C ATOM 18 O GLN A 2 0.987 -4.249 -2.428 1.00 0.00 O ATOM 19 CB GLN A 2 2.797 -3.655 -0.069 1.00 0.00 C ATOM 20 CG GLN A 2 4.106 -3.147 0.570 1.00 0.00 C ATOM 21 CD GLN A 2 4.722 -4.128 1.568 1.00 0.00 C ATOM 22 OE1 GLN A 2 4.019 -4.903 2.222 1.00 0.00 O ATOM 23 NE2 GLN A 2 6.036 -4.080 1.717 1.00 0.00 N ATOM 0 H GLN A 2 1.747 -1.436 0.580 1.00 0.00 H new ATOM 0 HA GLN A 2 2.856 -2.496 -1.909 1.00 0.00 H new ATOM 0 HB2 GLN A 2 2.074 -3.860 0.720 1.00 0.00 H new ATOM 0 HB3 GLN A 2 2.993 -4.600 -0.575 1.00 0.00 H new ATOM 0 HG2 GLN A 2 4.830 -2.942 -0.219 1.00 0.00 H new ATOM 0 HG3 GLN A 2 3.910 -2.202 1.076 1.00 0.00 H new ATOM 0 HE21 GLN A 2 6.589 -3.428 1.161 1.00 0.00 H new ATOM 0 HE22 GLN A 2 6.496 -4.695 2.388 1.00 0.00 H new ATOM 32 N GLN A 3 -0.280 -2.641 -1.446 1.00 0.00 N ATOM 33 CA GLN A 3 -1.567 -3.133 -2.004 1.00 0.00 C ATOM 34 C GLN A 3 -1.555 -3.094 -3.540 1.00 0.00 C ATOM 35 O GLN A 3 -2.255 -3.866 -4.184 1.00 0.00 O ATOM 36 CB GLN A 3 -2.778 -2.320 -1.474 1.00 0.00 C ATOM 37 CG GLN A 3 -2.853 -0.861 -1.970 1.00 0.00 C ATOM 38 CD GLN A 3 -4.127 -0.123 -1.550 1.00 0.00 C ATOM 39 OE1 GLN A 3 -5.182 -0.733 -1.364 1.00 0.00 O ATOM 40 NE2 GLN A 3 -4.048 1.193 -1.445 1.00 0.00 N ATOM 0 H GLN A 3 -0.369 -1.809 -0.862 1.00 0.00 H new ATOM 0 HA GLN A 3 -1.676 -4.166 -1.672 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -3.695 -2.833 -1.763 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -2.745 -2.316 -0.385 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -1.988 -0.315 -1.592 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -2.784 -0.854 -3.058 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -3.158 1.665 -1.606 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -4.877 1.736 -1.203 1.00 0.00 H new ATOM 49 N LEU A 4 -0.728 -2.189 -4.088 1.00 0.00 N ATOM 50 CA LEU A 4 -0.576 -1.979 -5.537 1.00 0.00 C ATOM 51 C LEU A 4 -0.069 -3.244 -6.255 1.00 0.00 C ATOM 52 O LEU A 4 -0.592 -3.593 -7.316 1.00 0.00 O ATOM 53 CB LEU A 4 0.376 -0.776 -5.815 1.00 0.00 C ATOM 54 CG LEU A 4 -0.215 0.657 -5.631 1.00 0.00 C ATOM 55 CD1 LEU A 4 -1.469 0.844 -6.492 1.00 0.00 C ATOM 56 CD2 LEU A 4 -0.482 0.997 -4.152 1.00 0.00 C ATOM 0 H LEU A 4 -0.137 -1.574 -3.529 1.00 0.00 H new ATOM 0 HA LEU A 4 -1.564 -1.752 -5.938 1.00 0.00 H new ATOM 0 HB2 LEU A 4 1.242 -0.871 -5.160 1.00 0.00 H new ATOM 0 HB3 LEU A 4 0.740 -0.863 -6.839 1.00 0.00 H new ATOM 0 HG LEU A 4 0.539 1.365 -5.976 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -1.863 1.850 -6.347 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -1.214 0.702 -7.542 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -2.223 0.113 -6.200 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -0.892 2.004 -4.079 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -1.194 0.284 -3.738 1.00 0.00 H new ATOM 0 HD23 LEU A 4 0.452 0.944 -3.592 1.00 0.00 H new ATOM 68 N VAL A 5 0.939 -3.928 -5.676 1.00 0.00 N ATOM 69 CA VAL A 5 1.456 -5.179 -6.254 1.00 0.00 C ATOM 70 C VAL A 5 0.488 -6.337 -5.949 1.00 0.00 C ATOM 71 O VAL A 5 0.151 -7.099 -6.845 1.00 0.00 O ATOM 72 CB VAL A 5 2.929 -5.518 -5.780 1.00 0.00 C ATOM 73 CG1 VAL A 5 3.032 -5.777 -4.260 1.00 0.00 C ATOM 74 CG2 VAL A 5 3.527 -6.698 -6.591 1.00 0.00 C ATOM 0 H VAL A 5 1.405 -3.636 -4.817 1.00 0.00 H new ATOM 0 HA VAL A 5 1.517 -5.038 -7.333 1.00 0.00 H new ATOM 0 HB VAL A 5 3.525 -4.628 -5.982 1.00 0.00 H new ATOM 0 HG11 VAL A 5 4.066 -6.004 -3.999 1.00 0.00 H new ATOM 0 HG12 VAL A 5 2.707 -4.890 -3.717 1.00 0.00 H new ATOM 0 HG13 VAL A 5 2.396 -6.621 -3.991 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.538 -6.905 -6.241 1.00 0.00 H new ATOM 0 HG22 VAL A 5 2.907 -7.584 -6.455 1.00 0.00 H new ATOM 0 HG23 VAL A 5 3.556 -6.435 -7.648 1.00 0.00 H new ATOM 84 N GLU A 6 -0.028 -6.382 -4.703 1.00 0.00 N ATOM 85 CA GLU A 6 -0.875 -7.494 -4.202 1.00 0.00 C ATOM 86 C GLU A 6 -2.177 -7.635 -5.021 1.00 0.00 C ATOM 87 O GLU A 6 -2.608 -8.755 -5.324 1.00 0.00 O ATOM 88 CB GLU A 6 -1.186 -7.277 -2.697 1.00 0.00 C ATOM 89 CG GLU A 6 0.063 -7.267 -1.797 1.00 0.00 C ATOM 90 CD GLU A 6 -0.246 -6.955 -0.322 1.00 0.00 C ATOM 91 OE1 GLU A 6 -0.419 -5.767 0.019 1.00 0.00 O ATOM 92 OE2 GLU A 6 -0.332 -7.892 0.500 1.00 0.00 O ATOM 0 H GLU A 6 0.129 -5.649 -4.012 1.00 0.00 H new ATOM 0 HA GLU A 6 -0.322 -8.426 -4.321 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -1.715 -6.331 -2.578 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -1.860 -8.064 -2.358 1.00 0.00 H new ATOM 0 HG2 GLU A 6 0.554 -8.238 -1.860 1.00 0.00 H new ATOM 0 HG3 GLU A 6 0.769 -6.528 -2.176 1.00 0.00 H new ATOM 99 N ARG A 7 -2.766 -6.488 -5.407 1.00 0.00 N ATOM 100 CA ARG A 7 -3.971 -6.462 -6.264 1.00 0.00 C ATOM 101 C ARG A 7 -3.608 -6.838 -7.708 1.00 0.00 C ATOM 102 O ARG A 7 -4.343 -7.574 -8.366 1.00 0.00 O ATOM 103 CB ARG A 7 -4.671 -5.066 -6.240 1.00 0.00 C ATOM 104 CG ARG A 7 -3.835 -3.891 -6.849 1.00 0.00 C ATOM 105 CD ARG A 7 -4.613 -3.030 -7.861 1.00 0.00 C ATOM 106 NE ARG A 7 -5.702 -2.265 -7.236 1.00 0.00 N ATOM 107 CZ ARG A 7 -6.931 -2.063 -7.749 1.00 0.00 C ATOM 108 NH1 ARG A 7 -7.340 -2.687 -8.858 1.00 0.00 N ATOM 109 NH2 ARG A 7 -7.766 -1.270 -7.104 1.00 0.00 N ATOM 0 H ARG A 7 -2.428 -5.564 -5.139 1.00 0.00 H new ATOM 0 HA ARG A 7 -4.671 -7.195 -5.863 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -5.613 -5.140 -6.783 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -4.917 -4.819 -5.207 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -3.481 -3.252 -6.040 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -2.953 -4.302 -7.339 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -3.925 -2.341 -8.350 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -5.026 -3.674 -8.638 1.00 0.00 H new ATOM 0 HE ARG A 7 -5.508 -1.847 -6.326 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -6.716 -3.335 -9.338 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -8.276 -2.515 -9.224 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -7.476 -0.823 -6.234 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -8.701 -1.104 -7.476 1.00 0.00 H new ATOM 123 N LEU A 8 -2.434 -6.354 -8.161 1.00 0.00 N ATOM 124 CA LEU A 8 -1.997 -6.462 -9.562 1.00 0.00 C ATOM 125 C LEU A 8 -1.752 -7.936 -9.915 1.00 0.00 C ATOM 126 O LEU A 8 -2.164 -8.377 -10.964 1.00 0.00 O ATOM 127 CB LEU A 8 -0.720 -5.590 -9.784 1.00 0.00 C ATOM 128 CG LEU A 8 -0.445 -5.043 -11.237 1.00 0.00 C ATOM 129 CD1 LEU A 8 0.629 -3.927 -11.217 1.00 0.00 C ATOM 130 CD2 LEU A 8 -0.042 -6.153 -12.238 1.00 0.00 C ATOM 0 H LEU A 8 -1.762 -5.876 -7.561 1.00 0.00 H new ATOM 0 HA LEU A 8 -2.775 -6.086 -10.226 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -0.777 -4.735 -9.110 1.00 0.00 H new ATOM 0 HB3 LEU A 8 0.145 -6.179 -9.479 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.390 -4.627 -11.586 1.00 0.00 H new ATOM 0 HD11 LEU A 8 0.799 -3.568 -12.232 1.00 0.00 H new ATOM 0 HD12 LEU A 8 0.285 -3.102 -10.593 1.00 0.00 H new ATOM 0 HD13 LEU A 8 1.560 -4.325 -10.812 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.133 -5.712 -13.219 1.00 0.00 H new ATOM 0 HD22 LEU A 8 0.869 -6.642 -11.892 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -0.844 -6.888 -12.309 1.00 0.00 H new ATOM 142 N GLN A 9 -1.122 -8.689 -8.989 1.00 0.00 N ATOM 143 CA GLN A 9 -0.800 -10.122 -9.186 1.00 0.00 C ATOM 144 C GLN A 9 -2.102 -10.949 -9.299 1.00 0.00 C ATOM 145 O GLN A 9 -2.284 -11.740 -10.237 1.00 0.00 O ATOM 146 CB GLN A 9 0.073 -10.658 -8.018 1.00 0.00 C ATOM 147 CG GLN A 9 1.338 -9.839 -7.691 1.00 0.00 C ATOM 148 CD GLN A 9 2.311 -9.674 -8.853 1.00 0.00 C ATOM 149 OE1 GLN A 9 3.194 -10.506 -9.066 1.00 0.00 O ATOM 150 NE2 GLN A 9 2.161 -8.595 -9.614 1.00 0.00 N ATOM 0 H GLN A 9 -0.822 -8.324 -8.085 1.00 0.00 H new ATOM 0 HA GLN A 9 -0.233 -10.222 -10.112 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -0.545 -10.709 -7.122 1.00 0.00 H new ATOM 0 HB3 GLN A 9 0.375 -11.678 -8.255 1.00 0.00 H new ATOM 0 HG2 GLN A 9 1.035 -8.850 -7.346 1.00 0.00 H new ATOM 0 HG3 GLN A 9 1.860 -10.319 -6.863 1.00 0.00 H new ATOM 0 HE21 GLN A 9 1.419 -7.926 -9.409 1.00 0.00 H new ATOM 0 HE22 GLN A 9 2.788 -8.436 -10.403 1.00 0.00 H new ATOM 159 N GLU A 10 -3.008 -10.690 -8.338 1.00 0.00 N ATOM 160 CA GLU A 10 -4.332 -11.333 -8.241 1.00 0.00 C ATOM 161 C GLU A 10 -5.153 -11.130 -9.534 1.00 0.00 C ATOM 162 O GLU A 10 -5.806 -12.057 -10.017 1.00 0.00 O ATOM 163 CB GLU A 10 -5.078 -10.756 -7.007 1.00 0.00 C ATOM 164 CG GLU A 10 -6.494 -11.312 -6.750 1.00 0.00 C ATOM 165 CD GLU A 10 -6.531 -12.829 -6.510 1.00 0.00 C ATOM 166 OE1 GLU A 10 -6.199 -13.273 -5.393 1.00 0.00 O ATOM 167 OE2 GLU A 10 -6.879 -13.589 -7.440 1.00 0.00 O ATOM 0 H GLU A 10 -2.837 -10.015 -7.593 1.00 0.00 H new ATOM 0 HA GLU A 10 -4.201 -12.408 -8.117 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.471 -10.941 -6.121 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -5.150 -9.675 -7.124 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -6.921 -10.806 -5.884 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -7.128 -11.073 -7.604 1.00 0.00 H new ATOM 174 N GLU A 11 -5.077 -9.912 -10.088 1.00 0.00 N ATOM 175 CA GLU A 11 -5.785 -9.532 -11.322 1.00 0.00 C ATOM 176 C GLU A 11 -5.077 -10.068 -12.582 1.00 0.00 C ATOM 177 O GLU A 11 -5.739 -10.571 -13.487 1.00 0.00 O ATOM 178 CB GLU A 11 -5.936 -7.985 -11.384 1.00 0.00 C ATOM 179 CG GLU A 11 -7.011 -7.415 -10.432 1.00 0.00 C ATOM 180 CD GLU A 11 -6.938 -5.890 -10.265 1.00 0.00 C ATOM 181 OE1 GLU A 11 -7.365 -5.149 -11.184 1.00 0.00 O ATOM 182 OE2 GLU A 11 -6.435 -5.428 -9.215 1.00 0.00 O ATOM 0 H GLU A 11 -4.519 -9.156 -9.691 1.00 0.00 H new ATOM 0 HA GLU A 11 -6.775 -9.988 -11.299 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -4.976 -7.528 -11.145 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -6.181 -7.696 -12.406 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -7.998 -7.684 -10.809 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -6.904 -7.885 -9.454 1.00 0.00 H new ATOM 189 N LYS A 12 -3.732 -10.007 -12.609 1.00 0.00 N ATOM 190 CA LYS A 12 -2.944 -10.258 -13.841 1.00 0.00 C ATOM 191 C LYS A 12 -2.841 -11.740 -14.165 1.00 0.00 C ATOM 192 O LYS A 12 -2.490 -12.074 -15.282 1.00 0.00 O ATOM 193 CB LYS A 12 -1.516 -9.644 -13.764 1.00 0.00 C ATOM 194 CG LYS A 12 -0.508 -10.454 -12.918 1.00 0.00 C ATOM 195 CD LYS A 12 0.908 -9.849 -12.920 1.00 0.00 C ATOM 196 CE LYS A 12 1.928 -10.758 -12.221 1.00 0.00 C ATOM 197 NZ LYS A 12 1.991 -12.106 -12.838 1.00 0.00 N ATOM 0 H LYS A 12 -3.163 -9.786 -11.792 1.00 0.00 H new ATOM 0 HA LYS A 12 -3.491 -9.763 -14.644 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -1.123 -9.545 -14.776 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -1.590 -8.638 -13.351 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -0.870 -10.513 -11.891 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -0.461 -11.474 -13.299 1.00 0.00 H new ATOM 0 HD2 LYS A 12 1.225 -9.674 -13.948 1.00 0.00 H new ATOM 0 HD3 LYS A 12 0.888 -8.879 -12.423 1.00 0.00 H new ATOM 0 HE2 LYS A 12 2.914 -10.295 -12.262 1.00 0.00 H new ATOM 0 HE3 LYS A 12 1.665 -10.854 -11.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 2.966 -12.466 -12.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 1.357 -12.752 -12.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 1.695 -12.046 -13.833 1.00 0.00 H new ATOM 211 N ARG A 13 -3.123 -12.614 -13.165 1.00 0.00 N ATOM 212 CA ARG A 13 -2.965 -14.088 -13.274 1.00 0.00 C ATOM 213 C ARG A 13 -3.503 -14.696 -14.610 1.00 0.00 C ATOM 214 O ARG A 13 -2.934 -15.668 -15.125 1.00 0.00 O ATOM 215 CB ARG A 13 -3.651 -14.782 -12.066 1.00 0.00 C ATOM 216 CG ARG A 13 -5.184 -14.570 -11.994 1.00 0.00 C ATOM 217 CD ARG A 13 -5.878 -15.484 -10.961 1.00 0.00 C ATOM 218 NE ARG A 13 -5.482 -15.195 -9.567 1.00 0.00 N ATOM 219 CZ ARG A 13 -5.068 -16.106 -8.661 1.00 0.00 C ATOM 220 NH1 ARG A 13 -4.808 -17.358 -9.017 1.00 0.00 N ATOM 221 NH2 ARG A 13 -4.906 -15.742 -7.404 1.00 0.00 N ATOM 0 H ARG A 13 -3.469 -12.314 -12.254 1.00 0.00 H new ATOM 0 HA ARG A 13 -1.891 -14.276 -13.270 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -3.446 -15.852 -12.112 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -3.201 -14.411 -11.145 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -5.389 -13.529 -11.744 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -5.616 -14.752 -12.978 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -6.958 -15.373 -11.055 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -5.643 -16.524 -11.190 1.00 0.00 H new ATOM 0 HE ARG A 13 -5.525 -14.222 -9.263 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -4.920 -17.646 -9.989 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -4.496 -18.033 -8.318 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -5.093 -14.779 -7.124 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -4.594 -16.423 -6.712 1.00 0.00 H new ATOM 235 N ILE A 14 -4.569 -14.085 -15.182 1.00 0.00 N ATOM 236 CA ILE A 14 -5.245 -14.586 -16.417 1.00 0.00 C ATOM 237 C ILE A 14 -4.380 -14.414 -17.687 1.00 0.00 C ATOM 238 O ILE A 14 -4.764 -14.880 -18.760 1.00 0.00 O ATOM 239 CB ILE A 14 -6.664 -13.913 -16.666 1.00 0.00 C ATOM 240 CG1 ILE A 14 -6.566 -12.481 -17.316 1.00 0.00 C ATOM 241 CG2 ILE A 14 -7.487 -13.876 -15.360 1.00 0.00 C ATOM 242 CD1 ILE A 14 -5.878 -11.423 -16.487 1.00 0.00 C ATOM 0 H ILE A 14 -4.988 -13.234 -14.807 1.00 0.00 H new ATOM 0 HA ILE A 14 -5.391 -15.650 -16.232 1.00 0.00 H new ATOM 0 HB ILE A 14 -7.183 -14.540 -17.392 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -6.038 -12.570 -18.266 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -7.575 -12.137 -17.543 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -8.454 -13.412 -15.552 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -7.638 -14.892 -14.996 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -6.950 -13.298 -14.608 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -5.870 -10.480 -17.034 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -6.414 -11.292 -15.547 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -4.853 -11.732 -16.281 1.00 0.00 H new ATOM 254 N GLU A 15 -3.231 -13.737 -17.547 1.00 0.00 N ATOM 255 CA GLU A 15 -2.319 -13.419 -18.654 1.00 0.00 C ATOM 256 C GLU A 15 -1.752 -14.693 -19.318 1.00 0.00 C ATOM 257 O GLU A 15 -1.514 -14.718 -20.529 1.00 0.00 O ATOM 258 CB GLU A 15 -1.162 -12.514 -18.160 1.00 0.00 C ATOM 259 CG GLU A 15 -0.207 -13.175 -17.145 1.00 0.00 C ATOM 260 CD GLU A 15 1.002 -12.303 -16.775 1.00 0.00 C ATOM 261 OE1 GLU A 15 1.778 -11.944 -17.682 1.00 0.00 O ATOM 262 OE2 GLU A 15 1.188 -11.979 -15.583 1.00 0.00 O ATOM 0 H GLU A 15 -2.904 -13.389 -16.645 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.897 -12.883 -19.407 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -0.582 -12.188 -19.023 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -1.589 -11.620 -17.706 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -0.763 -13.413 -16.238 1.00 0.00 H new ATOM 0 HG3 GLU A 15 0.150 -14.119 -17.557 1.00 0.00 H new ATOM 269 N ALA A 16 -1.605 -15.760 -18.506 1.00 0.00 N ATOM 270 CA ALA A 16 -1.145 -17.085 -18.964 1.00 0.00 C ATOM 271 C ALA A 16 -2.163 -17.758 -19.914 1.00 0.00 C ATOM 272 O ALA A 16 -1.883 -18.814 -20.484 1.00 0.00 O ATOM 273 CB ALA A 16 -0.862 -17.979 -17.746 1.00 0.00 C ATOM 0 H ALA A 16 -1.804 -15.725 -17.506 1.00 0.00 H new ATOM 0 HA ALA A 16 -0.227 -16.946 -19.535 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -0.522 -18.958 -18.084 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -0.089 -17.520 -17.129 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -1.774 -18.094 -17.160 1.00 0.00 H new ATOM 279 N GLN A 17 -3.343 -17.137 -20.044 1.00 0.00 N ATOM 280 CA GLN A 17 -4.409 -17.563 -20.947 1.00 0.00 C ATOM 281 C GLN A 17 -4.586 -16.527 -22.082 1.00 0.00 C ATOM 282 O GLN A 17 -4.434 -16.864 -23.261 1.00 0.00 O ATOM 283 CB GLN A 17 -5.710 -17.727 -20.122 1.00 0.00 C ATOM 284 CG GLN A 17 -6.959 -18.150 -20.922 1.00 0.00 C ATOM 285 CD GLN A 17 -8.207 -18.338 -20.048 1.00 0.00 C ATOM 286 OE1 GLN A 17 -8.118 -18.714 -18.880 1.00 0.00 O ATOM 287 NE2 GLN A 17 -9.381 -18.081 -20.608 1.00 0.00 N ATOM 0 H GLN A 17 -3.584 -16.303 -19.508 1.00 0.00 H new ATOM 0 HA GLN A 17 -4.159 -18.517 -21.412 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -5.533 -18.467 -19.342 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -5.924 -16.782 -19.623 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -7.167 -17.397 -21.682 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -6.747 -19.082 -21.446 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -9.426 -17.771 -21.579 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -10.239 -18.194 -20.068 1.00 0.00 H new ATOM 296 N LYS A 18 -4.900 -15.263 -21.712 1.00 0.00 N ATOM 297 CA LYS A 18 -5.295 -14.201 -22.671 1.00 0.00 C ATOM 298 C LYS A 18 -4.092 -13.458 -23.288 1.00 0.00 C ATOM 299 O LYS A 18 -4.026 -13.308 -24.508 1.00 0.00 O ATOM 300 CB LYS A 18 -6.250 -13.172 -21.999 1.00 0.00 C ATOM 301 CG LYS A 18 -6.680 -11.954 -22.881 1.00 0.00 C ATOM 302 CD LYS A 18 -7.818 -12.238 -23.908 1.00 0.00 C ATOM 303 CE LYS A 18 -7.447 -13.143 -25.106 1.00 0.00 C ATOM 304 NZ LYS A 18 -6.380 -12.575 -25.986 1.00 0.00 N ATOM 0 H LYS A 18 -4.887 -14.950 -20.741 1.00 0.00 H new ATOM 0 HA LYS A 18 -5.813 -14.713 -23.482 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -7.149 -13.698 -21.678 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -5.766 -12.791 -21.100 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -7.001 -11.147 -22.223 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -5.806 -11.594 -23.424 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -8.652 -12.697 -23.377 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -8.174 -11.284 -24.297 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -7.116 -14.111 -24.729 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -8.341 -13.322 -25.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -6.077 -13.295 -26.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -6.753 -11.747 -26.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -5.567 -12.288 -25.405 1.00 0.00 H new ATOM 318 N ARG A 19 -3.135 -13.020 -22.444 1.00 0.00 N ATOM 319 CA ARG A 19 -2.036 -12.092 -22.859 1.00 0.00 C ATOM 320 C ARG A 19 -1.083 -12.752 -23.883 1.00 0.00 C ATOM 321 O ARG A 19 -0.266 -12.073 -24.517 1.00 0.00 O ATOM 322 CB ARG A 19 -1.265 -11.613 -21.604 1.00 0.00 C ATOM 323 CG ARG A 19 -0.171 -10.542 -21.816 1.00 0.00 C ATOM 324 CD ARG A 19 0.586 -10.229 -20.512 1.00 0.00 C ATOM 325 NE ARG A 19 1.656 -9.231 -20.693 1.00 0.00 N ATOM 326 CZ ARG A 19 2.424 -8.734 -19.705 1.00 0.00 C ATOM 327 NH1 ARG A 19 2.316 -9.188 -18.459 1.00 0.00 N ATOM 328 NH2 ARG A 19 3.329 -7.806 -19.986 1.00 0.00 N ATOM 0 H ARG A 19 -3.092 -13.291 -21.461 1.00 0.00 H new ATOM 0 HA ARG A 19 -2.480 -11.230 -23.356 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -1.990 -11.220 -20.891 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -0.801 -12.483 -21.139 1.00 0.00 H new ATOM 0 HG2 ARG A 19 0.535 -10.888 -22.571 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -0.626 -9.629 -22.200 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -0.121 -9.865 -19.766 1.00 0.00 H new ATOM 0 HD3 ARG A 19 1.018 -11.149 -20.119 1.00 0.00 H new ATOM 0 HE ARG A 19 1.828 -8.891 -21.639 1.00 0.00 H new ATOM 0 HH11 ARG A 19 1.644 -9.923 -18.241 1.00 0.00 H new ATOM 0 HH12 ARG A 19 2.905 -8.801 -17.722 1.00 0.00 H new ATOM 0 HH21 ARG A 19 3.439 -7.474 -20.944 1.00 0.00 H new ATOM 0 HH22 ARG A 19 3.915 -7.424 -19.244 1.00 0.00 H new ATOM 342 N LYS A 20 -1.235 -14.082 -24.058 1.00 0.00 N ATOM 343 CA LYS A 20 -0.506 -14.868 -25.084 1.00 0.00 C ATOM 344 C LYS A 20 -0.743 -14.270 -26.492 1.00 0.00 C ATOM 345 O LYS A 20 0.152 -14.237 -27.349 1.00 0.00 O ATOM 346 CB LYS A 20 -0.975 -16.343 -25.049 1.00 0.00 C ATOM 347 CG LYS A 20 -0.794 -17.059 -23.692 1.00 0.00 C ATOM 348 CD LYS A 20 -1.327 -18.521 -23.692 1.00 0.00 C ATOM 349 CE LYS A 20 -0.463 -19.522 -24.500 1.00 0.00 C ATOM 350 NZ LYS A 20 -0.499 -19.297 -25.972 1.00 0.00 N ATOM 0 H LYS A 20 -1.868 -14.646 -23.491 1.00 0.00 H new ATOM 0 HA LYS A 20 0.561 -14.827 -24.864 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -2.029 -16.379 -25.323 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -0.429 -16.899 -25.811 1.00 0.00 H new ATOM 0 HG2 LYS A 20 0.264 -17.065 -23.431 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -1.310 -16.491 -22.918 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -1.395 -18.869 -22.661 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -2.339 -18.525 -24.097 1.00 0.00 H new ATOM 0 HE2 LYS A 20 0.569 -19.455 -24.157 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -0.804 -20.535 -24.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -0.553 -20.213 -26.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -1.332 -18.725 -26.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 0.363 -18.796 -26.268 1.00 0.00 H new ATOM 364 N GLU A 21 -1.983 -13.808 -26.690 1.00 0.00 N ATOM 365 CA GLU A 21 -2.412 -13.031 -27.847 1.00 0.00 C ATOM 366 C GLU A 21 -2.879 -11.656 -27.318 1.00 0.00 C ATOM 367 O GLU A 21 -3.899 -11.556 -26.634 1.00 0.00 O ATOM 368 CB GLU A 21 -3.530 -13.830 -28.592 1.00 0.00 C ATOM 369 CG GLU A 21 -4.053 -13.211 -29.906 1.00 0.00 C ATOM 370 CD GLU A 21 -5.017 -12.032 -29.702 1.00 0.00 C ATOM 371 OE1 GLU A 21 -5.945 -12.159 -28.863 1.00 0.00 O ATOM 372 OE2 GLU A 21 -4.836 -10.972 -30.339 1.00 0.00 O ATOM 0 H GLU A 21 -2.737 -13.973 -26.023 1.00 0.00 H new ATOM 0 HA GLU A 21 -1.616 -12.861 -28.572 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -3.149 -14.827 -28.811 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -4.373 -13.953 -27.912 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -3.204 -12.874 -30.500 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -4.559 -13.985 -30.484 1.00 0.00 H new ATOM 379 N ARG A 22 -2.113 -10.608 -27.632 1.00 0.00 N ATOM 380 CA ARG A 22 -2.346 -9.228 -27.141 1.00 0.00 C ATOM 381 C ARG A 22 -2.506 -8.249 -28.328 1.00 0.00 C ATOM 382 O ARG A 22 -2.405 -7.023 -28.160 1.00 0.00 O ATOM 383 CB ARG A 22 -1.172 -8.815 -26.181 1.00 0.00 C ATOM 384 CG ARG A 22 0.263 -9.232 -26.627 1.00 0.00 C ATOM 385 CD ARG A 22 0.757 -8.528 -27.904 1.00 0.00 C ATOM 386 NE ARG A 22 2.065 -9.027 -28.363 1.00 0.00 N ATOM 387 CZ ARG A 22 2.570 -8.841 -29.601 1.00 0.00 C ATOM 388 NH1 ARG A 22 1.890 -8.170 -30.523 1.00 0.00 N ATOM 389 NH2 ARG A 22 3.749 -9.343 -29.905 1.00 0.00 N ATOM 0 H ARG A 22 -1.299 -10.685 -28.242 1.00 0.00 H new ATOM 0 HA ARG A 22 -3.276 -9.188 -26.574 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -1.192 -7.732 -26.062 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -1.364 -9.247 -25.199 1.00 0.00 H new ATOM 0 HG2 ARG A 22 0.959 -9.019 -25.816 1.00 0.00 H new ATOM 0 HG3 ARG A 22 0.282 -10.310 -26.789 1.00 0.00 H new ATOM 0 HD2 ARG A 22 0.022 -8.667 -28.697 1.00 0.00 H new ATOM 0 HD3 ARG A 22 0.827 -7.456 -27.718 1.00 0.00 H new ATOM 0 HE ARG A 22 2.631 -9.552 -27.696 1.00 0.00 H new ATOM 0 HH11 ARG A 22 0.972 -7.786 -30.301 1.00 0.00 H new ATOM 0 HH12 ARG A 22 2.286 -8.038 -31.454 1.00 0.00 H new ATOM 0 HH21 ARG A 22 4.275 -9.869 -29.207 1.00 0.00 H new ATOM 0 HH22 ARG A 22 4.136 -9.206 -30.839 1.00 0.00 H new ATOM 403 N GLN A 23 -2.809 -8.820 -29.502 1.00 0.00 N ATOM 404 CA GLN A 23 -2.705 -8.137 -30.810 1.00 0.00 C ATOM 405 C GLN A 23 -4.038 -7.482 -31.219 1.00 0.00 C ATOM 406 O GLN A 23 -5.039 -7.570 -30.490 1.00 0.00 O ATOM 407 CB GLN A 23 -2.270 -9.182 -31.874 1.00 0.00 C ATOM 408 CG GLN A 23 -1.011 -9.983 -31.487 1.00 0.00 C ATOM 409 CD GLN A 23 -0.610 -11.026 -32.527 1.00 0.00 C ATOM 410 OE1 GLN A 23 0.159 -10.738 -33.446 1.00 0.00 O ATOM 411 NE2 GLN A 23 -1.137 -12.235 -32.406 1.00 0.00 N ATOM 0 H GLN A 23 -3.138 -9.782 -29.577 1.00 0.00 H new ATOM 0 HA GLN A 23 -1.967 -7.338 -30.735 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -3.092 -9.877 -32.044 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -2.086 -8.669 -32.818 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -0.181 -9.292 -31.339 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -1.186 -10.481 -30.533 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -1.770 -12.440 -31.633 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -0.910 -12.961 -33.086 1.00 0.00 H new ATOM 420 N GLU A 24 -4.040 -6.815 -32.391 1.00 0.00 N ATOM 421 CA GLU A 24 -5.267 -6.286 -33.000 1.00 0.00 C ATOM 422 C GLU A 24 -6.012 -7.441 -33.703 1.00 0.00 C ATOM 423 O GLU A 24 -5.606 -7.937 -34.757 1.00 0.00 O ATOM 424 CB GLU A 24 -4.981 -5.067 -33.944 1.00 0.00 C ATOM 425 CG GLU A 24 -4.051 -5.299 -35.171 1.00 0.00 C ATOM 426 CD GLU A 24 -2.566 -5.486 -34.815 1.00 0.00 C ATOM 427 OE1 GLU A 24 -1.882 -4.470 -34.557 1.00 0.00 O ATOM 428 OE2 GLU A 24 -2.091 -6.641 -34.729 1.00 0.00 O ATOM 0 H GLU A 24 -3.196 -6.631 -32.934 1.00 0.00 H new ATOM 0 HA GLU A 24 -5.916 -5.885 -32.221 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -5.938 -4.699 -34.314 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -4.546 -4.271 -33.340 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -4.396 -6.180 -35.712 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -4.146 -4.451 -35.849 1.00 0.00 H new ATOM 435 N ALA A 25 -7.095 -7.885 -33.060 1.00 0.00 N ATOM 436 CA ALA A 25 -7.880 -9.054 -33.475 1.00 0.00 C ATOM 437 C ALA A 25 -9.358 -8.783 -33.146 1.00 0.00 C ATOM 438 O ALA A 25 -9.734 -7.628 -32.977 1.00 0.00 O ATOM 439 CB ALA A 25 -7.329 -10.306 -32.766 1.00 0.00 C ATOM 0 H ALA A 25 -7.459 -7.435 -32.220 1.00 0.00 H new ATOM 0 HA ALA A 25 -7.803 -9.233 -34.547 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -7.907 -11.179 -33.069 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -6.284 -10.449 -33.040 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -7.406 -10.176 -31.686 1.00 0.00 H new ATOM 445 N HIS A 26 -10.198 -9.831 -33.012 1.00 0.00 N ATOM 446 CA HIS A 26 -11.655 -9.657 -32.740 1.00 0.00 C ATOM 447 C HIS A 26 -11.941 -9.200 -31.277 1.00 0.00 C ATOM 448 O HIS A 26 -13.099 -9.073 -30.876 1.00 0.00 O ATOM 449 CB HIS A 26 -12.425 -10.967 -33.059 1.00 0.00 C ATOM 450 CG HIS A 26 -12.173 -12.083 -32.074 1.00 0.00 C ATOM 451 ND1 HIS A 26 -11.079 -12.912 -32.145 1.00 0.00 N ATOM 452 CD2 HIS A 26 -12.870 -12.482 -30.986 1.00 0.00 C ATOM 453 CE1 HIS A 26 -11.112 -13.757 -31.139 1.00 0.00 C ATOM 454 NE2 HIS A 26 -12.185 -13.522 -30.423 1.00 0.00 N ATOM 0 H HIS A 26 -9.902 -10.804 -33.086 1.00 0.00 H new ATOM 0 HA HIS A 26 -12.009 -8.862 -33.396 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -13.493 -10.752 -33.083 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -12.146 -11.307 -34.056 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -13.796 -12.057 -30.628 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -10.376 -14.520 -30.935 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -12.463 -14.031 -29.584 1.00 0.00 H new ATOM 463 N LEU A 27 -10.870 -8.920 -30.504 1.00 0.00 N ATOM 464 CA LEU A 27 -10.954 -8.542 -29.076 1.00 0.00 C ATOM 465 C LEU A 27 -11.254 -7.027 -28.893 1.00 0.00 C ATOM 466 O LEU A 27 -11.043 -6.482 -27.816 1.00 0.00 O ATOM 467 CB LEU A 27 -9.640 -8.963 -28.337 1.00 0.00 C ATOM 468 CG LEU A 27 -9.353 -10.505 -28.212 1.00 0.00 C ATOM 469 CD1 LEU A 27 -10.525 -11.262 -27.553 1.00 0.00 C ATOM 470 CD2 LEU A 27 -8.962 -11.140 -29.563 1.00 0.00 C ATOM 0 H LEU A 27 -9.913 -8.950 -30.857 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.792 -9.078 -28.629 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.798 -8.503 -28.854 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.666 -8.541 -27.332 1.00 0.00 H new ATOM 0 HG LEU A 27 -8.491 -10.602 -27.552 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.282 -12.323 -27.488 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.696 -10.867 -26.552 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -11.425 -11.132 -28.153 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.774 -12.205 -29.424 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -9.774 -11.005 -30.277 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.061 -10.659 -29.944 1.00 0.00 H new ATOM 482 N TYR A 28 -11.795 -6.407 -29.958 1.00 0.00 N ATOM 483 CA TYR A 28 -12.277 -5.004 -30.055 1.00 0.00 C ATOM 484 C TYR A 28 -13.489 -4.645 -29.144 1.00 0.00 C ATOM 485 O TYR A 28 -14.302 -3.824 -29.561 1.00 0.00 O ATOM 486 CB TYR A 28 -12.515 -4.582 -31.543 1.00 0.00 C ATOM 487 CG TYR A 28 -11.284 -3.939 -32.208 1.00 0.00 C ATOM 488 CD1 TYR A 28 -11.074 -2.558 -32.153 1.00 0.00 C ATOM 489 CD2 TYR A 28 -10.334 -4.703 -32.862 1.00 0.00 C ATOM 490 CE1 TYR A 28 -9.965 -1.980 -32.734 1.00 0.00 C ATOM 491 CE2 TYR A 28 -9.222 -4.133 -33.446 1.00 0.00 C ATOM 492 CZ TYR A 28 -9.040 -2.774 -33.381 1.00 0.00 C ATOM 493 OH TYR A 28 -7.928 -2.196 -33.960 1.00 0.00 O ATOM 0 H TYR A 28 -11.919 -6.903 -30.840 1.00 0.00 H new ATOM 0 HA TYR A 28 -11.461 -4.406 -29.649 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -12.810 -5.460 -32.118 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -13.347 -3.880 -31.584 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -11.794 -1.932 -31.646 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -10.466 -5.773 -32.917 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -9.821 -0.911 -32.683 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -8.497 -4.753 -33.952 1.00 0.00 H new ATOM 0 HH TYR A 28 -7.376 -2.892 -34.374 1.00 0.00 H new ATOM 503 N MET A 29 -13.648 -5.323 -27.971 1.00 0.00 N ATOM 504 CA MET A 29 -14.801 -5.149 -27.033 1.00 0.00 C ATOM 505 C MET A 29 -15.250 -3.679 -26.911 1.00 0.00 C ATOM 506 O MET A 29 -14.433 -2.768 -26.764 1.00 0.00 O ATOM 507 CB MET A 29 -14.456 -5.666 -25.608 1.00 0.00 C ATOM 508 CG MET A 29 -13.249 -4.981 -24.927 1.00 0.00 C ATOM 509 SD MET A 29 -13.381 -4.927 -23.121 1.00 0.00 S ATOM 510 CE MET A 29 -14.615 -3.635 -22.895 1.00 0.00 C ATOM 0 H MET A 29 -12.972 -6.014 -27.645 1.00 0.00 H new ATOM 0 HA MET A 29 -15.615 -5.734 -27.461 1.00 0.00 H new ATOM 0 HB2 MET A 29 -15.332 -5.537 -24.972 1.00 0.00 H new ATOM 0 HB3 MET A 29 -14.259 -6.736 -25.666 1.00 0.00 H new ATOM 0 HG2 MET A 29 -12.337 -5.511 -25.202 1.00 0.00 H new ATOM 0 HG3 MET A 29 -13.155 -3.964 -25.308 1.00 0.00 H new ATOM 0 HE1 MET A 29 -14.621 -3.316 -21.853 1.00 0.00 H new ATOM 0 HE2 MET A 29 -14.373 -2.785 -23.533 1.00 0.00 H new ATOM 0 HE3 MET A 29 -15.599 -4.021 -23.162 1.00 0.00 H new ATOM 520 N GLN A 30 -16.552 -3.482 -26.941 1.00 0.00 N ATOM 521 CA GLN A 30 -17.152 -2.165 -26.943 1.00 0.00 C ATOM 522 C GLN A 30 -17.267 -1.676 -25.500 1.00 0.00 C ATOM 523 O GLN A 30 -17.571 -2.457 -24.586 1.00 0.00 O ATOM 524 CB GLN A 30 -18.535 -2.217 -27.645 1.00 0.00 C ATOM 525 CG GLN A 30 -18.475 -2.409 -29.186 1.00 0.00 C ATOM 526 CD GLN A 30 -17.951 -3.769 -29.674 1.00 0.00 C ATOM 527 OE1 GLN A 30 -17.278 -3.856 -30.693 1.00 0.00 O ATOM 528 NE2 GLN A 30 -18.273 -4.850 -28.967 1.00 0.00 N ATOM 0 H GLN A 30 -17.231 -4.242 -26.965 1.00 0.00 H new ATOM 0 HA GLN A 30 -16.530 -1.463 -27.499 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -19.116 -3.032 -27.213 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -19.072 -1.294 -27.428 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -19.476 -2.261 -29.590 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -17.843 -1.626 -29.606 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -18.835 -4.757 -28.121 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -17.958 -5.771 -29.272 1.00 0.00 H new ATOM 537 N VAL A 31 -16.966 -0.393 -25.300 1.00 0.00 N ATOM 538 CA VAL A 31 -16.939 0.230 -23.978 1.00 0.00 C ATOM 539 C VAL A 31 -17.817 1.499 -24.014 1.00 0.00 C ATOM 540 O VAL A 31 -17.691 2.342 -24.910 1.00 0.00 O ATOM 541 CB VAL A 31 -15.458 0.532 -23.524 1.00 0.00 C ATOM 542 CG1 VAL A 31 -14.750 1.580 -24.409 1.00 0.00 C ATOM 543 CG2 VAL A 31 -15.387 0.882 -22.017 1.00 0.00 C ATOM 0 H VAL A 31 -16.732 0.248 -26.058 1.00 0.00 H new ATOM 0 HA VAL A 31 -17.347 -0.453 -23.233 1.00 0.00 H new ATOM 0 HB VAL A 31 -14.897 -0.391 -23.669 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -13.736 1.741 -24.042 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -14.711 1.221 -25.437 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -15.302 2.519 -24.373 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -14.353 1.084 -21.739 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -15.995 1.765 -21.819 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -15.763 0.044 -21.431 1.00 0.00 H new ATOM 553 N GLN A 32 -18.761 1.568 -23.070 1.00 0.00 N ATOM 554 CA GLN A 32 -19.692 2.685 -22.919 1.00 0.00 C ATOM 555 C GLN A 32 -19.039 3.785 -22.089 1.00 0.00 C ATOM 556 O GLN A 32 -18.762 3.585 -20.911 1.00 0.00 O ATOM 557 CB GLN A 32 -21.012 2.173 -22.268 1.00 0.00 C ATOM 558 CG GLN A 32 -22.094 1.819 -23.294 1.00 0.00 C ATOM 559 CD GLN A 32 -23.403 1.288 -22.703 1.00 0.00 C ATOM 560 OE1 GLN A 32 -24.080 0.469 -23.320 1.00 0.00 O ATOM 561 NE2 GLN A 32 -23.788 1.771 -21.527 1.00 0.00 N ATOM 0 H GLN A 32 -18.900 0.833 -22.377 1.00 0.00 H new ATOM 0 HA GLN A 32 -19.939 3.106 -23.893 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -20.793 1.294 -21.662 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -21.397 2.937 -21.593 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -22.315 2.707 -23.886 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -21.693 1.071 -23.978 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -23.204 2.450 -21.039 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -24.667 1.463 -21.112 1.00 0.00 H new ATOM 570 N ILE A 33 -18.764 4.930 -22.729 1.00 0.00 N ATOM 571 CA ILE A 33 -18.129 6.088 -22.077 1.00 0.00 C ATOM 572 C ILE A 33 -19.107 7.271 -22.120 1.00 0.00 C ATOM 573 O ILE A 33 -19.821 7.433 -23.107 1.00 0.00 O ATOM 574 CB ILE A 33 -16.784 6.520 -22.790 1.00 0.00 C ATOM 575 CG1 ILE A 33 -15.924 5.286 -23.206 1.00 0.00 C ATOM 576 CG2 ILE A 33 -15.961 7.481 -21.884 1.00 0.00 C ATOM 577 CD1 ILE A 33 -15.439 4.450 -22.055 1.00 0.00 C ATOM 0 H ILE A 33 -18.975 5.081 -23.715 1.00 0.00 H new ATOM 0 HA ILE A 33 -17.887 5.802 -21.053 1.00 0.00 H new ATOM 0 HB ILE A 33 -17.058 7.051 -23.702 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -16.513 4.657 -23.873 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -15.062 5.635 -23.775 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -15.041 7.764 -22.395 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -16.549 8.374 -21.673 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -15.716 6.978 -20.948 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -14.850 3.615 -22.435 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -14.821 5.061 -21.397 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -16.294 4.067 -21.497 1.00 0.00 H new ATOM 589 N VAL A 34 -19.149 8.082 -21.053 1.00 0.00 N ATOM 590 CA VAL A 34 -19.964 9.316 -21.015 1.00 0.00 C ATOM 591 C VAL A 34 -19.092 10.519 -20.624 1.00 0.00 C ATOM 592 O VAL A 34 -18.506 10.541 -19.532 1.00 0.00 O ATOM 593 CB VAL A 34 -21.217 9.199 -20.057 1.00 0.00 C ATOM 594 CG1 VAL A 34 -22.474 8.748 -20.848 1.00 0.00 C ATOM 595 CG2 VAL A 34 -20.926 8.244 -18.864 1.00 0.00 C ATOM 0 H VAL A 34 -18.625 7.908 -20.195 1.00 0.00 H new ATOM 0 HA VAL A 34 -20.357 9.467 -22.020 1.00 0.00 H new ATOM 0 HB VAL A 34 -21.419 10.187 -19.643 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -23.324 8.674 -20.169 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -22.694 9.477 -21.628 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -22.288 7.775 -21.303 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -21.806 8.184 -18.223 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -20.685 7.251 -19.243 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -20.083 8.627 -18.288 1.00 0.00 H new ATOM 605 N ALA A 35 -19.005 11.491 -21.557 1.00 0.00 N ATOM 606 CA ALA A 35 -18.355 12.793 -21.350 1.00 0.00 C ATOM 607 C ALA A 35 -18.712 13.762 -22.492 1.00 0.00 C ATOM 608 O ALA A 35 -19.146 13.343 -23.571 1.00 0.00 O ATOM 609 CB ALA A 35 -16.829 12.661 -21.207 1.00 0.00 C ATOM 0 H ALA A 35 -19.395 11.385 -22.494 1.00 0.00 H new ATOM 0 HA ALA A 35 -18.733 13.200 -20.412 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -16.391 13.648 -21.056 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -16.597 12.026 -20.352 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -16.416 12.216 -22.112 1.00 0.00 H new ATOM 615 N GLU A 36 -18.538 15.063 -22.220 1.00 0.00 N ATOM 616 CA GLU A 36 -18.739 16.158 -23.186 1.00 0.00 C ATOM 617 C GLU A 36 -17.360 16.747 -23.539 1.00 0.00 C ATOM 618 O GLU A 36 -16.589 17.102 -22.636 1.00 0.00 O ATOM 619 CB GLU A 36 -19.652 17.236 -22.548 1.00 0.00 C ATOM 620 CG GLU A 36 -19.730 18.584 -23.293 1.00 0.00 C ATOM 621 CD GLU A 36 -20.479 19.678 -22.510 1.00 0.00 C ATOM 622 OE1 GLU A 36 -20.195 19.852 -21.313 1.00 0.00 O ATOM 623 OE2 GLU A 36 -21.343 20.370 -23.084 1.00 0.00 O ATOM 0 H GLU A 36 -18.246 15.394 -21.300 1.00 0.00 H new ATOM 0 HA GLU A 36 -19.219 15.795 -24.095 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -20.660 16.829 -22.468 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -19.303 17.424 -21.533 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -18.719 18.930 -23.508 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -20.225 18.432 -24.252 1.00 0.00 H new ATOM 630 N ASP A 37 -17.052 16.828 -24.844 1.00 0.00 N ATOM 631 CA ASP A 37 -15.789 17.410 -25.354 1.00 0.00 C ATOM 632 C ASP A 37 -15.733 18.940 -25.116 1.00 0.00 C ATOM 633 O ASP A 37 -14.650 19.514 -24.938 1.00 0.00 O ATOM 634 CB ASP A 37 -15.648 17.082 -26.866 1.00 0.00 C ATOM 635 CG ASP A 37 -14.413 17.717 -27.548 1.00 0.00 C ATOM 636 OD1 ASP A 37 -13.287 17.202 -27.375 1.00 0.00 O ATOM 637 OD2 ASP A 37 -14.568 18.734 -28.270 1.00 0.00 O ATOM 0 H ASP A 37 -17.671 16.492 -25.582 1.00 0.00 H new ATOM 0 HA ASP A 37 -14.955 16.969 -24.808 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -15.598 16.000 -26.987 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -16.546 17.419 -27.383 1.00 0.00 H new ATOM 642 N GLN A 38 -16.918 19.577 -25.098 1.00 0.00 N ATOM 643 CA GLN A 38 -17.056 21.041 -24.977 1.00 0.00 C ATOM 644 C GLN A 38 -16.592 21.549 -23.591 1.00 0.00 C ATOM 645 O GLN A 38 -15.790 22.486 -23.510 1.00 0.00 O ATOM 646 CB GLN A 38 -18.524 21.463 -25.260 1.00 0.00 C ATOM 647 CG GLN A 38 -18.746 22.988 -25.352 1.00 0.00 C ATOM 648 CD GLN A 38 -17.984 23.646 -26.507 1.00 0.00 C ATOM 649 OE1 GLN A 38 -17.766 23.037 -27.560 1.00 0.00 O ATOM 650 NE2 GLN A 38 -17.569 24.888 -26.320 1.00 0.00 N ATOM 0 H GLN A 38 -17.811 19.089 -25.167 1.00 0.00 H new ATOM 0 HA GLN A 38 -16.407 21.503 -25.721 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -18.847 21.005 -26.195 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -19.162 21.063 -24.472 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -19.811 23.186 -25.470 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -18.438 23.450 -24.414 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -17.765 25.364 -25.439 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -17.053 25.370 -27.056 1.00 0.00 H new ATOM 659 N PHE A 39 -17.112 20.937 -22.503 1.00 0.00 N ATOM 660 CA PHE A 39 -16.702 21.275 -21.118 1.00 0.00 C ATOM 661 C PHE A 39 -16.300 19.994 -20.349 1.00 0.00 C ATOM 662 O PHE A 39 -15.105 19.729 -20.135 1.00 0.00 O ATOM 663 CB PHE A 39 -17.849 22.013 -20.359 1.00 0.00 C ATOM 664 CG PHE A 39 -18.349 23.307 -21.007 1.00 0.00 C ATOM 665 CD1 PHE A 39 -17.595 24.476 -20.943 1.00 0.00 C ATOM 666 CD2 PHE A 39 -19.575 23.355 -21.675 1.00 0.00 C ATOM 667 CE1 PHE A 39 -18.047 25.647 -21.519 1.00 0.00 C ATOM 668 CE2 PHE A 39 -20.026 24.530 -22.250 1.00 0.00 C ATOM 669 CZ PHE A 39 -19.260 25.675 -22.175 1.00 0.00 C ATOM 0 H PHE A 39 -17.819 20.204 -22.557 1.00 0.00 H new ATOM 0 HA PHE A 39 -15.842 21.942 -21.175 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -18.692 21.329 -20.259 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -17.504 22.243 -19.351 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -16.642 24.467 -20.435 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -20.179 22.462 -21.744 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -17.449 26.544 -21.456 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -20.979 24.551 -22.758 1.00 0.00 H new ATOM 0 HZ PHE A 39 -19.609 26.591 -22.629 1.00 0.00 H new ATOM 679 N CYS A 40 -17.319 19.189 -19.972 1.00 0.00 N ATOM 680 CA CYS A 40 -17.163 18.031 -19.059 1.00 0.00 C ATOM 681 C CYS A 40 -18.442 17.183 -19.056 1.00 0.00 C ATOM 682 O CYS A 40 -19.485 17.683 -19.468 1.00 0.00 O ATOM 683 CB CYS A 40 -16.871 18.532 -17.635 1.00 0.00 C ATOM 684 SG CYS A 40 -18.166 19.594 -16.952 1.00 0.00 S ATOM 0 H CYS A 40 -18.278 19.324 -20.293 1.00 0.00 H new ATOM 0 HA CYS A 40 -16.332 17.416 -19.406 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -16.736 17.672 -16.979 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -15.929 19.081 -17.639 1.00 0.00 H new ATOM 0 HG CYS A 40 -17.834 19.965 -15.751 1.00 0.00 H new ATOM 690 N GLY A 41 -18.341 15.936 -18.523 1.00 0.00 N ATOM 691 CA GLY A 41 -19.410 14.912 -18.580 1.00 0.00 C ATOM 692 C GLY A 41 -20.827 15.419 -18.290 1.00 0.00 C ATOM 693 O GLY A 41 -21.292 15.389 -17.150 1.00 0.00 O ATOM 0 H GLY A 41 -17.504 15.614 -18.037 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -19.401 14.458 -19.571 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -19.172 14.124 -17.866 1.00 0.00 H new ATOM 697 N HIS A 42 -21.499 15.894 -19.351 1.00 0.00 N ATOM 698 CA HIS A 42 -22.850 16.468 -19.283 1.00 0.00 C ATOM 699 C HIS A 42 -23.761 15.739 -20.288 1.00 0.00 C ATOM 700 O HIS A 42 -23.422 15.610 -21.470 1.00 0.00 O ATOM 701 CB HIS A 42 -22.795 17.994 -19.590 1.00 0.00 C ATOM 702 CG HIS A 42 -24.115 18.721 -19.474 1.00 0.00 C ATOM 703 ND1 HIS A 42 -24.550 19.648 -20.402 1.00 0.00 N ATOM 704 CD2 HIS A 42 -25.084 18.672 -18.528 1.00 0.00 C ATOM 705 CE1 HIS A 42 -25.722 20.126 -20.036 1.00 0.00 C ATOM 706 NE2 HIS A 42 -26.065 19.555 -18.903 1.00 0.00 N ATOM 0 H HIS A 42 -21.112 15.889 -20.295 1.00 0.00 H new ATOM 0 HA HIS A 42 -23.256 16.338 -18.280 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -22.081 18.460 -18.911 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -22.410 18.132 -20.600 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -25.084 18.053 -17.643 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -26.302 20.861 -20.575 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -26.924 19.739 -18.385 1.00 0.00 H new ATOM 715 N GLN A 43 -24.912 15.257 -19.798 1.00 0.00 N ATOM 716 CA GLN A 43 -25.944 14.598 -20.624 1.00 0.00 C ATOM 717 C GLN A 43 -26.899 15.657 -21.205 1.00 0.00 C ATOM 718 O GLN A 43 -26.697 16.863 -20.986 1.00 0.00 O ATOM 719 CB GLN A 43 -26.711 13.569 -19.748 1.00 0.00 C ATOM 720 CG GLN A 43 -25.808 12.498 -19.091 1.00 0.00 C ATOM 721 CD GLN A 43 -26.560 11.550 -18.149 1.00 0.00 C ATOM 722 OE1 GLN A 43 -27.568 11.918 -17.543 1.00 0.00 O ATOM 723 NE2 GLN A 43 -26.049 10.341 -17.983 1.00 0.00 N ATOM 0 H GLN A 43 -25.159 15.312 -18.810 1.00 0.00 H new ATOM 0 HA GLN A 43 -25.480 14.071 -21.458 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -27.249 14.104 -18.966 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -27.458 13.070 -20.364 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -25.327 11.912 -19.874 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -25.015 12.997 -18.533 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -25.213 10.065 -18.499 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -26.491 9.685 -17.339 1.00 0.00 H new ATOM 732 N GLY A 44 -27.911 15.208 -21.969 1.00 0.00 N ATOM 733 CA GLY A 44 -28.914 16.104 -22.553 1.00 0.00 C ATOM 734 C GLY A 44 -28.357 16.907 -23.725 1.00 0.00 C ATOM 735 O GLY A 44 -27.682 17.916 -23.520 1.00 0.00 O ATOM 0 H GLY A 44 -28.052 14.223 -22.195 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -29.769 15.519 -22.890 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -29.278 16.788 -21.786 1.00 0.00 H new ATOM 739 N ASN A 45 -28.596 16.420 -24.950 1.00 0.00 N ATOM 740 CA ASN A 45 -28.200 17.097 -26.206 1.00 0.00 C ATOM 741 C ASN A 45 -29.451 17.262 -27.091 1.00 0.00 C ATOM 742 O ASN A 45 -30.396 16.475 -26.972 1.00 0.00 O ATOM 743 CB ASN A 45 -27.084 16.290 -26.929 1.00 0.00 C ATOM 744 CG ASN A 45 -27.504 14.865 -27.279 1.00 0.00 C ATOM 745 OD1 ASN A 45 -27.378 13.948 -26.464 1.00 0.00 O ATOM 746 ND2 ASN A 45 -28.008 14.669 -28.484 1.00 0.00 N ATOM 0 H ASN A 45 -29.076 15.533 -25.105 1.00 0.00 H new ATOM 0 HA ASN A 45 -27.790 18.083 -25.989 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -26.800 16.813 -27.842 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -26.199 16.255 -26.293 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -28.308 13.736 -28.766 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -28.098 15.451 -29.133 1.00 0.00 H new ATOM 753 N ASP A 46 -29.465 18.292 -27.961 1.00 0.00 N ATOM 754 CA ASP A 46 -30.629 18.586 -28.840 1.00 0.00 C ATOM 755 C ASP A 46 -30.420 17.945 -30.215 1.00 0.00 C ATOM 756 O ASP A 46 -31.215 17.111 -30.656 1.00 0.00 O ATOM 757 CB ASP A 46 -30.840 20.118 -28.989 1.00 0.00 C ATOM 758 CG ASP A 46 -30.962 20.835 -27.637 1.00 0.00 C ATOM 759 OD1 ASP A 46 -31.996 20.671 -26.951 1.00 0.00 O ATOM 760 OD2 ASP A 46 -30.010 21.540 -27.230 1.00 0.00 O ATOM 0 H ASP A 46 -28.685 18.939 -28.078 1.00 0.00 H new ATOM 0 HA ASP A 46 -31.523 18.164 -28.380 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -30.005 20.543 -29.547 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -31.741 20.301 -29.575 1.00 0.00 H new ATOM 765 N MET A 47 -29.329 18.348 -30.877 1.00 0.00 N ATOM 766 CA MET A 47 -28.927 17.814 -32.199 1.00 0.00 C ATOM 767 C MET A 47 -28.010 16.583 -31.998 1.00 0.00 C ATOM 768 O MET A 47 -27.596 16.297 -30.867 1.00 0.00 O ATOM 769 CB MET A 47 -28.212 18.951 -33.009 1.00 0.00 C ATOM 770 CG MET A 47 -27.894 18.623 -34.477 1.00 0.00 C ATOM 771 SD MET A 47 -29.364 18.196 -35.445 1.00 0.00 S ATOM 772 CE MET A 47 -30.307 19.728 -35.397 1.00 0.00 C ATOM 0 H MET A 47 -28.692 19.057 -30.515 1.00 0.00 H new ATOM 0 HA MET A 47 -29.799 17.488 -32.767 1.00 0.00 H new ATOM 0 HB2 MET A 47 -28.840 19.841 -32.982 1.00 0.00 H new ATOM 0 HB3 MET A 47 -27.281 19.203 -32.502 1.00 0.00 H new ATOM 0 HG2 MET A 47 -27.401 19.480 -34.936 1.00 0.00 H new ATOM 0 HG3 MET A 47 -27.189 17.792 -34.513 1.00 0.00 H new ATOM 0 HE1 MET A 47 -31.121 19.677 -36.120 1.00 0.00 H new ATOM 0 HE2 MET A 47 -30.718 19.871 -34.398 1.00 0.00 H new ATOM 0 HE3 MET A 47 -29.654 20.565 -35.644 1.00 0.00 H new ATOM 782 N TYR A 48 -27.716 15.838 -33.081 1.00 0.00 N ATOM 783 CA TYR A 48 -26.777 14.700 -33.048 1.00 0.00 C ATOM 784 C TYR A 48 -25.320 15.238 -33.037 1.00 0.00 C ATOM 785 O TYR A 48 -24.582 15.103 -34.019 1.00 0.00 O ATOM 786 CB TYR A 48 -27.040 13.754 -34.269 1.00 0.00 C ATOM 787 CG TYR A 48 -26.542 12.290 -34.136 1.00 0.00 C ATOM 788 CD1 TYR A 48 -25.362 11.951 -33.452 1.00 0.00 C ATOM 789 CD2 TYR A 48 -27.266 11.238 -34.712 1.00 0.00 C ATOM 790 CE1 TYR A 48 -24.936 10.639 -33.353 1.00 0.00 C ATOM 791 CE2 TYR A 48 -26.839 9.925 -34.612 1.00 0.00 C ATOM 792 CZ TYR A 48 -25.678 9.633 -33.931 1.00 0.00 C ATOM 793 OH TYR A 48 -25.254 8.324 -33.824 1.00 0.00 O ATOM 0 H TYR A 48 -28.122 16.008 -34.001 1.00 0.00 H new ATOM 0 HA TYR A 48 -26.930 14.114 -32.142 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -28.113 13.733 -34.458 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -26.570 14.195 -35.148 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -24.775 12.733 -32.993 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -28.179 11.456 -35.247 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -24.024 10.404 -32.824 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -27.414 9.132 -35.067 1.00 0.00 H new ATOM 0 HH TYR A 48 -25.888 7.736 -34.285 1.00 0.00 H new ATOM 803 N ASP A 49 -24.946 15.886 -31.930 1.00 0.00 N ATOM 804 CA ASP A 49 -23.582 16.352 -31.681 1.00 0.00 C ATOM 805 C ASP A 49 -22.814 15.180 -31.082 1.00 0.00 C ATOM 806 O ASP A 49 -22.999 14.883 -29.914 1.00 0.00 O ATOM 807 CB ASP A 49 -23.588 17.555 -30.688 1.00 0.00 C ATOM 808 CG ASP A 49 -24.505 18.708 -31.116 1.00 0.00 C ATOM 809 OD1 ASP A 49 -24.068 19.559 -31.921 1.00 0.00 O ATOM 810 OD2 ASP A 49 -25.664 18.776 -30.646 1.00 0.00 O ATOM 0 H ASP A 49 -25.593 16.104 -31.172 1.00 0.00 H new ATOM 0 HA ASP A 49 -23.117 16.693 -32.606 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -23.900 17.201 -29.705 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -22.571 17.932 -30.583 1.00 0.00 H new ATOM 815 N GLU A 50 -21.991 14.499 -31.890 1.00 0.00 N ATOM 816 CA GLU A 50 -21.287 13.263 -31.476 1.00 0.00 C ATOM 817 C GLU A 50 -20.345 13.489 -30.270 1.00 0.00 C ATOM 818 O GLU A 50 -20.041 12.558 -29.522 1.00 0.00 O ATOM 819 CB GLU A 50 -20.511 12.669 -32.669 1.00 0.00 C ATOM 820 CG GLU A 50 -21.413 12.251 -33.850 1.00 0.00 C ATOM 821 CD GLU A 50 -20.654 11.505 -34.958 1.00 0.00 C ATOM 822 OE1 GLU A 50 -20.395 10.295 -34.793 1.00 0.00 O ATOM 823 OE2 GLU A 50 -20.292 12.122 -35.986 1.00 0.00 O ATOM 0 H GLU A 50 -21.790 14.783 -32.849 1.00 0.00 H new ATOM 0 HA GLU A 50 -22.047 12.553 -31.150 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -19.785 13.402 -33.020 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -19.948 11.800 -32.328 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -22.216 11.615 -33.478 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -21.880 13.140 -34.274 1.00 0.00 H new ATOM 830 N GLU A 51 -19.919 14.741 -30.085 1.00 0.00 N ATOM 831 CA GLU A 51 -19.035 15.155 -28.974 1.00 0.00 C ATOM 832 C GLU A 51 -19.834 15.464 -27.687 1.00 0.00 C ATOM 833 O GLU A 51 -19.249 15.785 -26.646 1.00 0.00 O ATOM 834 CB GLU A 51 -18.248 16.409 -29.424 1.00 0.00 C ATOM 835 CG GLU A 51 -17.508 16.258 -30.764 1.00 0.00 C ATOM 836 CD GLU A 51 -16.455 15.135 -30.767 1.00 0.00 C ATOM 837 OE1 GLU A 51 -15.310 15.390 -30.338 1.00 0.00 O ATOM 838 OE2 GLU A 51 -16.761 13.997 -31.201 1.00 0.00 O ATOM 0 H GLU A 51 -20.176 15.509 -30.704 1.00 0.00 H new ATOM 0 HA GLU A 51 -18.355 14.336 -28.739 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -18.940 17.248 -29.499 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -17.523 16.663 -28.651 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -18.236 16.063 -31.551 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -17.020 17.202 -31.008 1.00 0.00 H new ATOM 845 N LYS A 52 -21.169 15.370 -27.775 1.00 0.00 N ATOM 846 CA LYS A 52 -22.088 15.788 -26.705 1.00 0.00 C ATOM 847 C LYS A 52 -23.236 14.759 -26.497 1.00 0.00 C ATOM 848 O LYS A 52 -24.018 14.871 -25.532 1.00 0.00 O ATOM 849 CB LYS A 52 -22.635 17.208 -27.045 1.00 0.00 C ATOM 850 CG LYS A 52 -23.615 17.804 -26.015 1.00 0.00 C ATOM 851 CD LYS A 52 -23.022 17.881 -24.596 1.00 0.00 C ATOM 852 CE LYS A 52 -24.088 18.085 -23.519 1.00 0.00 C ATOM 853 NZ LYS A 52 -25.042 16.952 -23.483 1.00 0.00 N ATOM 0 H LYS A 52 -21.645 14.999 -28.597 1.00 0.00 H new ATOM 0 HA LYS A 52 -21.547 15.829 -25.759 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -21.790 17.888 -27.153 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -23.134 17.164 -28.013 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -23.907 18.804 -26.336 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -24.522 17.199 -25.992 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -22.472 16.964 -24.387 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -22.305 18.701 -24.551 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -23.609 18.191 -22.546 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -24.628 19.012 -23.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -26.007 17.315 -23.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -24.991 16.426 -24.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -24.799 16.318 -22.695 1.00 0.00 H new ATOM 867 N VAL A 53 -23.336 13.749 -27.388 1.00 0.00 N ATOM 868 CA VAL A 53 -24.330 12.657 -27.248 1.00 0.00 C ATOM 869 C VAL A 53 -24.045 11.799 -25.991 1.00 0.00 C ATOM 870 O VAL A 53 -23.068 12.028 -25.267 1.00 0.00 O ATOM 871 CB VAL A 53 -24.415 11.737 -28.534 1.00 0.00 C ATOM 872 CG1 VAL A 53 -25.051 12.483 -29.737 1.00 0.00 C ATOM 873 CG2 VAL A 53 -23.028 11.153 -28.896 1.00 0.00 C ATOM 0 H VAL A 53 -22.742 13.665 -28.213 1.00 0.00 H new ATOM 0 HA VAL A 53 -25.300 13.140 -27.133 1.00 0.00 H new ATOM 0 HB VAL A 53 -25.073 10.902 -28.294 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -25.091 11.817 -30.599 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -26.061 12.799 -29.476 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -24.449 13.358 -29.982 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -23.118 10.526 -29.783 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -22.331 11.967 -29.096 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -22.657 10.554 -28.064 1.00 0.00 H new ATOM 883 N LYS A 54 -24.917 10.809 -25.743 1.00 0.00 N ATOM 884 CA LYS A 54 -24.842 9.935 -24.555 1.00 0.00 C ATOM 885 C LYS A 54 -23.697 8.897 -24.718 1.00 0.00 C ATOM 886 O LYS A 54 -22.677 9.205 -25.347 1.00 0.00 O ATOM 887 CB LYS A 54 -26.227 9.260 -24.300 1.00 0.00 C ATOM 888 CG LYS A 54 -27.444 10.226 -24.165 1.00 0.00 C ATOM 889 CD LYS A 54 -28.111 10.580 -25.523 1.00 0.00 C ATOM 890 CE LYS A 54 -28.687 9.340 -26.235 1.00 0.00 C ATOM 891 NZ LYS A 54 -29.355 9.688 -27.510 1.00 0.00 N ATOM 0 H LYS A 54 -25.698 10.589 -26.361 1.00 0.00 H new ATOM 0 HA LYS A 54 -24.605 10.534 -23.676 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -26.427 8.567 -25.117 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -26.157 8.666 -23.389 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -28.188 9.770 -23.512 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -27.115 11.145 -23.681 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -28.909 11.303 -25.355 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -27.377 11.060 -26.171 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -27.884 8.629 -26.430 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -29.400 8.843 -25.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -29.727 8.824 -27.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -30.138 10.346 -27.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -28.669 10.138 -28.149 1.00 0.00 H new ATOM 905 N TYR A 55 -23.859 7.700 -24.102 1.00 0.00 N ATOM 906 CA TYR A 55 -22.862 6.611 -24.101 1.00 0.00 C ATOM 907 C TYR A 55 -22.196 6.368 -25.466 1.00 0.00 C ATOM 908 O TYR A 55 -22.739 5.682 -26.344 1.00 0.00 O ATOM 909 CB TYR A 55 -23.508 5.307 -23.581 1.00 0.00 C ATOM 910 CG TYR A 55 -23.574 5.234 -22.064 1.00 0.00 C ATOM 911 CD1 TYR A 55 -22.394 5.201 -21.338 1.00 0.00 C ATOM 912 CD2 TYR A 55 -24.777 5.216 -21.364 1.00 0.00 C ATOM 913 CE1 TYR A 55 -22.399 5.143 -19.978 1.00 0.00 C ATOM 914 CE2 TYR A 55 -24.792 5.157 -19.987 1.00 0.00 C ATOM 915 CZ TYR A 55 -23.600 5.127 -19.296 1.00 0.00 C ATOM 916 OH TYR A 55 -23.611 5.078 -17.919 1.00 0.00 O ATOM 0 H TYR A 55 -24.705 7.464 -23.583 1.00 0.00 H new ATOM 0 HA TYR A 55 -22.062 6.931 -23.433 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -24.516 5.222 -23.986 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -22.941 4.454 -23.955 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -21.450 5.222 -21.863 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -25.710 5.249 -21.907 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -21.467 5.110 -19.434 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -25.731 5.134 -19.454 1.00 0.00 H new ATOM 0 HH TYR A 55 -24.537 5.074 -17.599 1.00 0.00 H new ATOM 926 N THR A 56 -21.026 6.999 -25.632 1.00 0.00 N ATOM 927 CA THR A 56 -20.190 6.852 -26.809 1.00 0.00 C ATOM 928 C THR A 56 -19.482 5.483 -26.751 1.00 0.00 C ATOM 929 O THR A 56 -18.876 5.108 -25.733 1.00 0.00 O ATOM 930 CB THR A 56 -19.193 8.052 -26.930 1.00 0.00 C ATOM 931 OG1 THR A 56 -18.603 8.090 -28.240 1.00 0.00 O ATOM 932 CG2 THR A 56 -18.084 8.032 -25.879 1.00 0.00 C ATOM 0 H THR A 56 -20.636 7.634 -24.935 1.00 0.00 H new ATOM 0 HA THR A 56 -20.799 6.875 -27.713 1.00 0.00 H new ATOM 0 HB THR A 56 -19.787 8.949 -26.756 1.00 0.00 H new ATOM 0 HG1 THR A 56 -17.669 7.798 -28.187 1.00 0.00 H new ATOM 0 HG21 THR A 56 -17.431 8.892 -26.023 1.00 0.00 H new ATOM 0 HG22 THR A 56 -18.526 8.074 -24.883 1.00 0.00 H new ATOM 0 HG23 THR A 56 -17.504 7.115 -25.980 1.00 0.00 H new ATOM 940 N VAL A 57 -19.637 4.715 -27.828 1.00 0.00 N ATOM 941 CA VAL A 57 -19.213 3.319 -27.890 1.00 0.00 C ATOM 942 C VAL A 57 -17.879 3.223 -28.643 1.00 0.00 C ATOM 943 O VAL A 57 -17.832 3.419 -29.864 1.00 0.00 O ATOM 944 CB VAL A 57 -20.315 2.442 -28.592 1.00 0.00 C ATOM 945 CG1 VAL A 57 -19.914 0.954 -28.621 1.00 0.00 C ATOM 946 CG2 VAL A 57 -21.697 2.635 -27.913 1.00 0.00 C ATOM 0 H VAL A 57 -20.065 5.049 -28.691 1.00 0.00 H new ATOM 0 HA VAL A 57 -19.075 2.939 -26.878 1.00 0.00 H new ATOM 0 HB VAL A 57 -20.398 2.781 -29.625 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -20.696 0.376 -29.112 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -18.979 0.840 -29.170 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -19.782 0.593 -27.601 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -22.440 2.018 -28.418 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -21.632 2.341 -26.865 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -21.991 3.683 -27.978 1.00 0.00 H new ATOM 956 N PHE A 58 -16.788 2.972 -27.900 1.00 0.00 N ATOM 957 CA PHE A 58 -15.453 2.759 -28.492 1.00 0.00 C ATOM 958 C PHE A 58 -15.137 1.262 -28.489 1.00 0.00 C ATOM 959 O PHE A 58 -15.267 0.592 -27.466 1.00 0.00 O ATOM 960 CB PHE A 58 -14.352 3.548 -27.716 1.00 0.00 C ATOM 961 CG PHE A 58 -14.559 5.065 -27.658 1.00 0.00 C ATOM 962 CD1 PHE A 58 -15.046 5.772 -28.763 1.00 0.00 C ATOM 963 CD2 PHE A 58 -14.269 5.782 -26.498 1.00 0.00 C ATOM 964 CE1 PHE A 58 -15.236 7.140 -28.704 1.00 0.00 C ATOM 965 CE2 PHE A 58 -14.460 7.150 -26.442 1.00 0.00 C ATOM 966 CZ PHE A 58 -14.945 7.828 -27.544 1.00 0.00 C ATOM 0 H PHE A 58 -16.803 2.911 -26.882 1.00 0.00 H new ATOM 0 HA PHE A 58 -15.461 3.133 -29.516 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -14.302 3.164 -26.697 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -13.387 3.346 -28.180 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -15.277 5.241 -29.675 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -13.890 5.261 -25.631 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -15.612 7.670 -29.566 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -14.230 7.690 -25.535 1.00 0.00 H new ATOM 0 HZ PHE A 58 -15.096 8.896 -27.497 1.00 0.00 H new ATOM 976 N LYS A 59 -14.740 0.747 -29.650 1.00 0.00 N ATOM 977 CA LYS A 59 -14.297 -0.641 -29.799 1.00 0.00 C ATOM 978 C LYS A 59 -12.794 -0.695 -29.481 1.00 0.00 C ATOM 979 O LYS A 59 -11.976 -0.138 -30.218 1.00 0.00 O ATOM 980 CB LYS A 59 -14.632 -1.224 -31.218 1.00 0.00 C ATOM 981 CG LYS A 59 -14.525 -0.241 -32.405 1.00 0.00 C ATOM 982 CD LYS A 59 -15.811 0.612 -32.591 1.00 0.00 C ATOM 983 CE LYS A 59 -15.603 1.773 -33.564 1.00 0.00 C ATOM 984 NZ LYS A 59 -16.870 2.479 -33.872 1.00 0.00 N ATOM 0 H LYS A 59 -14.716 1.281 -30.519 1.00 0.00 H new ATOM 0 HA LYS A 59 -14.840 -1.277 -29.100 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -13.965 -2.064 -31.409 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -15.647 -1.622 -31.194 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -13.674 0.421 -32.248 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -14.329 -0.801 -33.319 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -16.617 -0.025 -32.956 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -16.127 1.004 -31.624 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -14.890 2.479 -33.138 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -15.165 1.396 -34.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -16.681 3.258 -34.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -17.543 1.813 -34.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -17.276 2.862 -32.995 1.00 0.00 H new ATOM 998 N VAL A 60 -12.452 -1.321 -28.340 1.00 0.00 N ATOM 999 CA VAL A 60 -11.084 -1.350 -27.780 1.00 0.00 C ATOM 1000 C VAL A 60 -10.661 -2.795 -27.444 1.00 0.00 C ATOM 1001 O VAL A 60 -11.501 -3.657 -27.163 1.00 0.00 O ATOM 1002 CB VAL A 60 -10.976 -0.444 -26.488 1.00 0.00 C ATOM 1003 CG1 VAL A 60 -11.125 1.060 -26.835 1.00 0.00 C ATOM 1004 CG2 VAL A 60 -12.024 -0.871 -25.425 1.00 0.00 C ATOM 0 H VAL A 60 -13.128 -1.830 -27.770 1.00 0.00 H new ATOM 0 HA VAL A 60 -10.410 -0.952 -28.539 1.00 0.00 H new ATOM 0 HB VAL A 60 -9.981 -0.589 -26.066 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -11.046 1.653 -25.924 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -10.337 1.353 -27.529 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -12.097 1.232 -27.297 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -11.931 -0.234 -24.546 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -13.026 -0.770 -25.841 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.852 -1.909 -25.141 1.00 0.00 H new ATOM 1014 N LEU A 61 -9.343 -3.039 -27.464 1.00 0.00 N ATOM 1015 CA LEU A 61 -8.755 -4.372 -27.250 1.00 0.00 C ATOM 1016 C LEU A 61 -8.663 -4.718 -25.744 1.00 0.00 C ATOM 1017 O LEU A 61 -7.874 -4.111 -25.014 1.00 0.00 O ATOM 1018 CB LEU A 61 -7.362 -4.427 -27.930 1.00 0.00 C ATOM 1019 CG LEU A 61 -7.357 -4.340 -29.490 1.00 0.00 C ATOM 1020 CD1 LEU A 61 -5.922 -4.157 -30.033 1.00 0.00 C ATOM 1021 CD2 LEU A 61 -8.038 -5.584 -30.114 1.00 0.00 C ATOM 0 H LEU A 61 -8.648 -2.311 -27.630 1.00 0.00 H new ATOM 0 HA LEU A 61 -9.403 -5.123 -27.702 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -6.756 -3.610 -27.538 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.873 -5.356 -27.636 1.00 0.00 H new ATOM 0 HG LEU A 61 -7.934 -3.462 -29.780 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -5.949 -4.100 -31.121 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.496 -3.238 -29.632 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -5.307 -5.005 -29.730 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -8.022 -5.501 -31.201 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -7.501 -6.483 -29.811 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -9.070 -5.645 -29.770 1.00 0.00 H new ATOM 1033 N LYS A 62 -9.489 -5.702 -25.298 1.00 0.00 N ATOM 1034 CA LYS A 62 -9.457 -6.246 -23.914 1.00 0.00 C ATOM 1035 C LYS A 62 -8.103 -6.909 -23.585 1.00 0.00 C ATOM 1036 O LYS A 62 -7.640 -6.884 -22.438 1.00 0.00 O ATOM 1037 CB LYS A 62 -10.616 -7.261 -23.676 1.00 0.00 C ATOM 1038 CG LYS A 62 -10.785 -8.346 -24.773 1.00 0.00 C ATOM 1039 CD LYS A 62 -11.608 -9.577 -24.303 1.00 0.00 C ATOM 1040 CE LYS A 62 -13.003 -9.228 -23.738 1.00 0.00 C ATOM 1041 NZ LYS A 62 -13.930 -8.703 -24.752 1.00 0.00 N ATOM 0 H LYS A 62 -10.196 -6.140 -25.889 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.591 -5.397 -23.244 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -10.451 -7.758 -22.720 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -11.550 -6.706 -23.590 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.273 -7.902 -25.640 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -9.800 -8.680 -25.098 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -11.729 -10.261 -25.143 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -11.041 -10.108 -23.538 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -13.437 -10.120 -23.287 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.891 -8.491 -22.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -14.510 -7.947 -24.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -13.388 -8.321 -25.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -14.549 -9.469 -25.086 1.00 0.00 H new ATOM 1055 N ASN A 63 -7.487 -7.478 -24.623 1.00 0.00 N ATOM 1056 CA ASN A 63 -6.206 -8.205 -24.534 1.00 0.00 C ATOM 1057 C ASN A 63 -4.995 -7.245 -24.538 1.00 0.00 C ATOM 1058 O ASN A 63 -3.862 -7.670 -24.288 1.00 0.00 O ATOM 1059 CB ASN A 63 -6.109 -9.225 -25.703 1.00 0.00 C ATOM 1060 CG ASN A 63 -6.174 -8.596 -27.107 1.00 0.00 C ATOM 1061 OD1 ASN A 63 -6.758 -7.533 -27.307 1.00 0.00 O ATOM 1062 ND2 ASN A 63 -5.618 -9.272 -28.092 1.00 0.00 N ATOM 0 H ASN A 63 -7.866 -7.449 -25.569 1.00 0.00 H new ATOM 0 HA ASN A 63 -6.180 -8.739 -23.584 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -5.174 -9.778 -25.609 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -6.918 -9.949 -25.605 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -5.667 -8.915 -29.046 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -5.139 -10.152 -27.900 1.00 0.00 H new ATOM 1069 N SER A 64 -5.243 -5.959 -24.835 1.00 0.00 N ATOM 1070 CA SER A 64 -4.216 -4.904 -24.786 1.00 0.00 C ATOM 1071 C SER A 64 -4.289 -4.172 -23.435 1.00 0.00 C ATOM 1072 O SER A 64 -5.278 -4.302 -22.695 1.00 0.00 O ATOM 1073 CB SER A 64 -4.426 -3.920 -25.957 1.00 0.00 C ATOM 1074 OG SER A 64 -3.399 -2.945 -26.025 1.00 0.00 O ATOM 0 H SER A 64 -6.163 -5.620 -25.117 1.00 0.00 H new ATOM 0 HA SER A 64 -3.226 -5.350 -24.883 1.00 0.00 H new ATOM 0 HB2 SER A 64 -4.461 -4.475 -26.894 1.00 0.00 H new ATOM 0 HB3 SER A 64 -5.390 -3.423 -25.844 1.00 0.00 H new ATOM 0 HG SER A 64 -3.376 -2.556 -26.924 1.00 0.00 H new ATOM 1080 N SER A 65 -3.232 -3.394 -23.127 1.00 0.00 N ATOM 1081 CA SER A 65 -3.122 -2.651 -21.861 1.00 0.00 C ATOM 1082 C SER A 65 -4.148 -1.501 -21.795 1.00 0.00 C ATOM 1083 O SER A 65 -4.541 -0.938 -22.826 1.00 0.00 O ATOM 1084 CB SER A 65 -1.681 -2.113 -21.669 1.00 0.00 C ATOM 1085 OG SER A 65 -1.279 -1.287 -22.752 1.00 0.00 O ATOM 0 H SER A 65 -2.434 -3.265 -23.749 1.00 0.00 H new ATOM 0 HA SER A 65 -3.345 -3.341 -21.047 1.00 0.00 H new ATOM 0 HB2 SER A 65 -1.625 -1.547 -20.739 1.00 0.00 H new ATOM 0 HB3 SER A 65 -0.990 -2.950 -21.574 1.00 0.00 H new ATOM 0 HG SER A 65 -0.367 -0.964 -22.596 1.00 0.00 H new ATOM 1091 N LEU A 66 -4.559 -1.163 -20.560 1.00 0.00 N ATOM 1092 CA LEU A 66 -5.505 -0.061 -20.276 1.00 0.00 C ATOM 1093 C LEU A 66 -4.854 1.297 -20.645 1.00 0.00 C ATOM 1094 O LEU A 66 -5.556 2.266 -20.922 1.00 0.00 O ATOM 1095 CB LEU A 66 -5.916 -0.122 -18.775 1.00 0.00 C ATOM 1096 CG LEU A 66 -7.198 0.647 -18.284 1.00 0.00 C ATOM 1097 CD1 LEU A 66 -6.989 2.157 -18.167 1.00 0.00 C ATOM 1098 CD2 LEU A 66 -8.434 0.323 -19.137 1.00 0.00 C ATOM 0 H LEU A 66 -4.243 -1.649 -19.721 1.00 0.00 H new ATOM 0 HA LEU A 66 -6.406 -0.165 -20.881 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -6.048 -1.173 -18.516 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -5.072 0.246 -18.191 1.00 0.00 H new ATOM 0 HG LEU A 66 -7.385 0.279 -17.275 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -7.911 2.626 -17.824 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -6.191 2.360 -17.453 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -6.716 2.563 -19.141 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -9.293 0.878 -18.759 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -8.246 0.607 -20.172 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.641 -0.746 -19.086 1.00 0.00 H new ATOM 1110 N ALA A 67 -3.501 1.335 -20.665 1.00 0.00 N ATOM 1111 CA ALA A 67 -2.716 2.517 -21.102 1.00 0.00 C ATOM 1112 C ALA A 67 -3.162 3.018 -22.490 1.00 0.00 C ATOM 1113 O ALA A 67 -3.166 4.227 -22.757 1.00 0.00 O ATOM 1114 CB ALA A 67 -1.217 2.170 -21.120 1.00 0.00 C ATOM 0 H ALA A 67 -2.921 0.547 -20.378 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.896 3.321 -20.389 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.646 3.041 -21.441 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -0.899 1.877 -20.119 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.043 1.346 -21.812 1.00 0.00 H new ATOM 1120 N GLU A 68 -3.575 2.064 -23.341 1.00 0.00 N ATOM 1121 CA GLU A 68 -4.038 2.339 -24.709 1.00 0.00 C ATOM 1122 C GLU A 68 -5.452 2.944 -24.692 1.00 0.00 C ATOM 1123 O GLU A 68 -5.760 3.837 -25.484 1.00 0.00 O ATOM 1124 CB GLU A 68 -4.006 1.047 -25.560 1.00 0.00 C ATOM 1125 CG GLU A 68 -2.712 0.216 -25.418 1.00 0.00 C ATOM 1126 CD GLU A 68 -1.419 1.013 -25.668 1.00 0.00 C ATOM 1127 OE1 GLU A 68 -1.056 1.216 -26.847 1.00 0.00 O ATOM 1128 OE2 GLU A 68 -0.747 1.427 -24.695 1.00 0.00 O ATOM 0 H GLU A 68 -3.597 1.074 -23.096 1.00 0.00 H new ATOM 0 HA GLU A 68 -3.363 3.066 -25.162 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -4.855 0.423 -25.282 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -4.137 1.315 -26.608 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -2.675 -0.209 -24.415 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.751 -0.619 -26.117 1.00 0.00 H new ATOM 1135 N PHE A 69 -6.289 2.450 -23.767 1.00 0.00 N ATOM 1136 CA PHE A 69 -7.640 2.991 -23.525 1.00 0.00 C ATOM 1137 C PHE A 69 -7.563 4.472 -23.072 1.00 0.00 C ATOM 1138 O PHE A 69 -8.290 5.321 -23.599 1.00 0.00 O ATOM 1139 CB PHE A 69 -8.345 2.107 -22.467 1.00 0.00 C ATOM 1140 CG PHE A 69 -9.703 2.606 -21.984 1.00 0.00 C ATOM 1141 CD1 PHE A 69 -10.858 2.367 -22.719 1.00 0.00 C ATOM 1142 CD2 PHE A 69 -9.824 3.302 -20.778 1.00 0.00 C ATOM 1143 CE1 PHE A 69 -12.084 2.804 -22.265 1.00 0.00 C ATOM 1144 CE2 PHE A 69 -11.054 3.734 -20.329 1.00 0.00 C ATOM 1145 CZ PHE A 69 -12.182 3.485 -21.071 1.00 0.00 C ATOM 0 H PHE A 69 -6.050 1.663 -23.164 1.00 0.00 H new ATOM 0 HA PHE A 69 -8.220 2.971 -24.448 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -8.473 1.108 -22.883 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -7.686 2.011 -21.604 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -10.794 1.833 -23.656 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -8.941 3.504 -20.189 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -12.972 2.612 -22.848 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -11.130 4.268 -19.394 1.00 0.00 H new ATOM 0 HZ PHE A 69 -13.146 3.823 -20.719 1.00 0.00 H new ATOM 1155 N VAL A 70 -6.645 4.753 -22.123 1.00 0.00 N ATOM 1156 CA VAL A 70 -6.453 6.098 -21.536 1.00 0.00 C ATOM 1157 C VAL A 70 -6.004 7.114 -22.603 1.00 0.00 C ATOM 1158 O VAL A 70 -6.652 8.144 -22.787 1.00 0.00 O ATOM 1159 CB VAL A 70 -5.402 6.075 -20.361 1.00 0.00 C ATOM 1160 CG1 VAL A 70 -5.100 7.483 -19.832 1.00 0.00 C ATOM 1161 CG2 VAL A 70 -5.862 5.172 -19.210 1.00 0.00 C ATOM 0 H VAL A 70 -6.013 4.050 -21.740 1.00 0.00 H new ATOM 0 HA VAL A 70 -7.419 6.405 -21.135 1.00 0.00 H new ATOM 0 HB VAL A 70 -4.483 5.665 -20.779 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -4.371 7.420 -19.024 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -4.696 8.095 -20.638 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -6.018 7.936 -19.458 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.113 5.181 -18.419 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -6.810 5.539 -18.816 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -5.991 4.153 -19.576 1.00 0.00 H new ATOM 1171 N GLN A 71 -4.909 6.787 -23.315 1.00 0.00 N ATOM 1172 CA GLN A 71 -4.292 7.699 -24.307 1.00 0.00 C ATOM 1173 C GLN A 71 -5.274 8.014 -25.465 1.00 0.00 C ATOM 1174 O GLN A 71 -5.384 9.164 -25.887 1.00 0.00 O ATOM 1175 CB GLN A 71 -2.955 7.106 -24.840 1.00 0.00 C ATOM 1176 CG GLN A 71 -3.109 5.784 -25.602 1.00 0.00 C ATOM 1177 CD GLN A 71 -1.791 5.148 -26.040 1.00 0.00 C ATOM 1178 OE1 GLN A 71 -1.304 5.384 -27.143 1.00 0.00 O ATOM 1179 NE2 GLN A 71 -1.190 4.357 -25.161 1.00 0.00 N ATOM 0 H GLN A 71 -4.428 5.892 -23.223 1.00 0.00 H new ATOM 0 HA GLN A 71 -4.065 8.641 -23.808 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -2.483 7.837 -25.496 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -2.280 6.950 -23.999 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -3.647 5.076 -24.971 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -3.725 5.957 -26.484 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -1.622 4.182 -24.254 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -0.296 3.924 -25.392 1.00 0.00 H new ATOM 1188 N SER A 72 -6.030 6.993 -25.921 1.00 0.00 N ATOM 1189 CA SER A 72 -7.046 7.154 -26.980 1.00 0.00 C ATOM 1190 C SER A 72 -8.185 8.077 -26.515 1.00 0.00 C ATOM 1191 O SER A 72 -8.602 8.984 -27.241 1.00 0.00 O ATOM 1192 CB SER A 72 -7.607 5.778 -27.384 1.00 0.00 C ATOM 1193 OG SER A 72 -6.593 4.960 -27.945 1.00 0.00 O ATOM 0 H SER A 72 -5.953 6.039 -25.567 1.00 0.00 H new ATOM 0 HA SER A 72 -6.570 7.614 -27.846 1.00 0.00 H new ATOM 0 HB2 SER A 72 -8.035 5.285 -26.511 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.414 5.908 -28.105 1.00 0.00 H new ATOM 0 HG SER A 72 -6.148 4.455 -27.232 1.00 0.00 H new ATOM 1199 N LEU A 73 -8.639 7.851 -25.275 1.00 0.00 N ATOM 1200 CA LEU A 73 -9.741 8.613 -24.662 1.00 0.00 C ATOM 1201 C LEU A 73 -9.318 10.079 -24.392 1.00 0.00 C ATOM 1202 O LEU A 73 -10.136 11.009 -24.458 1.00 0.00 O ATOM 1203 CB LEU A 73 -10.223 7.903 -23.350 1.00 0.00 C ATOM 1204 CG LEU A 73 -11.738 7.546 -23.270 1.00 0.00 C ATOM 1205 CD1 LEU A 73 -12.102 6.945 -21.892 1.00 0.00 C ATOM 1206 CD2 LEU A 73 -12.602 8.756 -23.598 1.00 0.00 C ATOM 0 H LEU A 73 -8.252 7.132 -24.664 1.00 0.00 H new ATOM 0 HA LEU A 73 -10.578 8.641 -25.360 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -9.649 6.984 -23.228 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -9.979 8.546 -22.504 1.00 0.00 H new ATOM 0 HG LEU A 73 -11.942 6.782 -24.020 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.165 6.707 -21.868 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -11.523 6.036 -21.727 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -11.875 7.668 -21.108 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -13.654 8.479 -23.535 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.394 9.555 -22.887 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -12.377 9.101 -24.607 1.00 0.00 H new ATOM 1218 N SER A 74 -8.021 10.259 -24.106 1.00 0.00 N ATOM 1219 CA SER A 74 -7.424 11.565 -23.808 1.00 0.00 C ATOM 1220 C SER A 74 -7.412 12.462 -25.043 1.00 0.00 C ATOM 1221 O SER A 74 -7.736 13.650 -24.968 1.00 0.00 O ATOM 1222 CB SER A 74 -5.989 11.369 -23.268 1.00 0.00 C ATOM 1223 OG SER A 74 -5.339 12.602 -23.004 1.00 0.00 O ATOM 0 H SER A 74 -7.350 9.491 -24.075 1.00 0.00 H new ATOM 0 HA SER A 74 -8.031 12.058 -23.048 1.00 0.00 H new ATOM 0 HB2 SER A 74 -6.025 10.777 -22.353 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.405 10.801 -23.992 1.00 0.00 H new ATOM 0 HG SER A 74 -5.916 13.163 -22.445 1.00 0.00 H new ATOM 1229 N GLN A 75 -7.048 11.866 -26.178 1.00 0.00 N ATOM 1230 CA GLN A 75 -6.918 12.583 -27.448 1.00 0.00 C ATOM 1231 C GLN A 75 -8.304 12.866 -28.067 1.00 0.00 C ATOM 1232 O GLN A 75 -8.489 13.887 -28.718 1.00 0.00 O ATOM 1233 CB GLN A 75 -6.027 11.774 -28.430 1.00 0.00 C ATOM 1234 CG GLN A 75 -4.612 11.444 -27.913 1.00 0.00 C ATOM 1235 CD GLN A 75 -3.776 12.671 -27.555 1.00 0.00 C ATOM 1236 OE1 GLN A 75 -3.051 13.212 -28.393 1.00 0.00 O ATOM 1237 NE2 GLN A 75 -3.883 13.122 -26.312 1.00 0.00 N ATOM 0 H GLN A 75 -6.834 10.871 -26.244 1.00 0.00 H new ATOM 0 HA GLN A 75 -6.439 13.543 -27.256 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -6.535 10.840 -28.671 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -5.935 12.336 -29.359 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -4.698 10.807 -27.033 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -4.085 10.868 -28.673 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -4.494 12.646 -25.648 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -3.355 13.944 -26.021 1.00 0.00 H new ATOM 1246 N THR A 76 -9.284 11.962 -27.843 1.00 0.00 N ATOM 1247 CA THR A 76 -10.606 12.062 -28.499 1.00 0.00 C ATOM 1248 C THR A 76 -11.543 13.067 -27.777 1.00 0.00 C ATOM 1249 O THR A 76 -12.344 13.737 -28.432 1.00 0.00 O ATOM 1250 CB THR A 76 -11.291 10.650 -28.652 1.00 0.00 C ATOM 1251 OG1 THR A 76 -12.390 10.724 -29.582 1.00 0.00 O ATOM 1252 CG2 THR A 76 -11.801 10.069 -27.325 1.00 0.00 C ATOM 0 H THR A 76 -9.186 11.162 -27.218 1.00 0.00 H new ATOM 0 HA THR A 76 -10.428 12.452 -29.501 1.00 0.00 H new ATOM 0 HB THR A 76 -10.515 9.981 -29.024 1.00 0.00 H new ATOM 0 HG1 THR A 76 -12.805 9.841 -29.669 1.00 0.00 H new ATOM 0 HG21 THR A 76 -12.260 9.097 -27.506 1.00 0.00 H new ATOM 0 HG22 THR A 76 -10.966 9.953 -26.634 1.00 0.00 H new ATOM 0 HG23 THR A 76 -12.539 10.744 -26.892 1.00 0.00 H new ATOM 1260 N MET A 77 -11.432 13.179 -26.431 1.00 0.00 N ATOM 1261 CA MET A 77 -12.327 14.056 -25.618 1.00 0.00 C ATOM 1262 C MET A 77 -11.602 15.286 -25.060 1.00 0.00 C ATOM 1263 O MET A 77 -12.256 16.224 -24.593 1.00 0.00 O ATOM 1264 CB MET A 77 -12.967 13.268 -24.448 1.00 0.00 C ATOM 1265 CG MET A 77 -13.820 12.079 -24.878 1.00 0.00 C ATOM 1266 SD MET A 77 -14.892 11.515 -23.552 1.00 0.00 S ATOM 1267 CE MET A 77 -15.718 10.128 -24.306 1.00 0.00 C ATOM 0 H MET A 77 -10.735 12.677 -25.881 1.00 0.00 H new ATOM 0 HA MET A 77 -13.106 14.403 -26.297 1.00 0.00 H new ATOM 0 HB2 MET A 77 -12.174 12.911 -23.790 1.00 0.00 H new ATOM 0 HB3 MET A 77 -13.585 13.949 -23.863 1.00 0.00 H new ATOM 0 HG2 MET A 77 -14.425 12.358 -25.741 1.00 0.00 H new ATOM 0 HG3 MET A 77 -13.172 11.262 -25.194 1.00 0.00 H new ATOM 0 HE1 MET A 77 -16.172 9.510 -23.531 1.00 0.00 H new ATOM 0 HE2 MET A 77 -16.493 10.490 -24.982 1.00 0.00 H new ATOM 0 HE3 MET A 77 -14.995 9.535 -24.866 1.00 0.00 H new ATOM 1277 N GLY A 78 -10.263 15.267 -25.089 1.00 0.00 N ATOM 1278 CA GLY A 78 -9.461 16.368 -24.550 1.00 0.00 C ATOM 1279 C GLY A 78 -9.267 16.301 -23.038 1.00 0.00 C ATOM 1280 O GLY A 78 -8.767 17.256 -22.430 1.00 0.00 O ATOM 0 H GLY A 78 -9.715 14.501 -25.480 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -8.484 16.365 -25.033 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -9.940 17.313 -24.805 1.00 0.00 H new ATOM 1284 N PHE A 79 -9.659 15.169 -22.429 1.00 0.00 N ATOM 1285 CA PHE A 79 -9.492 14.929 -20.982 1.00 0.00 C ATOM 1286 C PHE A 79 -8.039 14.490 -20.717 1.00 0.00 C ATOM 1287 O PHE A 79 -7.557 13.594 -21.408 1.00 0.00 O ATOM 1288 CB PHE A 79 -10.510 13.852 -20.482 1.00 0.00 C ATOM 1289 CG PHE A 79 -11.926 14.378 -20.227 1.00 0.00 C ATOM 1290 CD1 PHE A 79 -12.578 15.197 -21.154 1.00 0.00 C ATOM 1291 CD2 PHE A 79 -12.602 14.055 -19.048 1.00 0.00 C ATOM 1292 CE1 PHE A 79 -13.846 15.685 -20.898 1.00 0.00 C ATOM 1293 CE2 PHE A 79 -13.865 14.547 -18.800 1.00 0.00 C ATOM 1294 CZ PHE A 79 -14.488 15.354 -19.720 1.00 0.00 C ATOM 0 H PHE A 79 -10.100 14.394 -22.924 1.00 0.00 H new ATOM 0 HA PHE A 79 -9.695 15.846 -20.429 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -10.562 13.051 -21.220 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -10.129 13.412 -19.560 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -12.085 15.451 -22.081 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -12.129 13.411 -18.321 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -14.334 16.325 -21.618 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -14.367 14.297 -17.877 1.00 0.00 H new ATOM 0 HZ PHE A 79 -15.481 15.730 -19.523 1.00 0.00 H new ATOM 1304 N PRO A 80 -7.320 15.116 -19.731 1.00 0.00 N ATOM 1305 CA PRO A 80 -5.902 14.789 -19.440 1.00 0.00 C ATOM 1306 C PRO A 80 -5.735 13.317 -19.034 1.00 0.00 C ATOM 1307 O PRO A 80 -6.414 12.850 -18.118 1.00 0.00 O ATOM 1308 CB PRO A 80 -5.527 15.753 -18.279 1.00 0.00 C ATOM 1309 CG PRO A 80 -6.838 16.159 -17.681 1.00 0.00 C ATOM 1310 CD PRO A 80 -7.828 16.174 -18.820 1.00 0.00 C ATOM 0 HA PRO A 80 -5.256 14.915 -20.309 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -4.893 15.258 -17.543 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -4.975 16.618 -18.646 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -7.147 15.458 -16.905 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -6.766 17.141 -17.214 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -8.839 15.957 -18.476 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -7.860 17.146 -19.312 1.00 0.00 H new ATOM 1318 N GLN A 81 -4.826 12.607 -19.731 1.00 0.00 N ATOM 1319 CA GLN A 81 -4.579 11.169 -19.520 1.00 0.00 C ATOM 1320 C GLN A 81 -4.119 10.865 -18.078 1.00 0.00 C ATOM 1321 O GLN A 81 -4.344 9.767 -17.563 1.00 0.00 O ATOM 1322 CB GLN A 81 -3.554 10.630 -20.552 1.00 0.00 C ATOM 1323 CG GLN A 81 -2.178 11.311 -20.543 1.00 0.00 C ATOM 1324 CD GLN A 81 -1.177 10.599 -21.453 1.00 0.00 C ATOM 1325 OE1 GLN A 81 -0.497 9.663 -21.031 1.00 0.00 O ATOM 1326 NE2 GLN A 81 -1.091 11.022 -22.706 1.00 0.00 N ATOM 0 H GLN A 81 -4.241 13.017 -20.459 1.00 0.00 H new ATOM 0 HA GLN A 81 -5.527 10.653 -19.671 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -3.412 9.564 -20.373 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -3.983 10.732 -21.549 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -2.285 12.347 -20.864 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -1.791 11.331 -19.524 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -1.669 11.800 -23.022 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -0.447 10.569 -23.354 1.00 0.00 H new ATOM 1335 N ASP A 82 -3.497 11.869 -17.436 1.00 0.00 N ATOM 1336 CA ASP A 82 -3.030 11.781 -16.043 1.00 0.00 C ATOM 1337 C ASP A 82 -4.225 11.729 -15.075 1.00 0.00 C ATOM 1338 O ASP A 82 -4.169 11.065 -14.036 1.00 0.00 O ATOM 1339 CB ASP A 82 -2.153 13.011 -15.712 1.00 0.00 C ATOM 1340 CG ASP A 82 -1.028 13.234 -16.736 1.00 0.00 C ATOM 1341 OD1 ASP A 82 -1.259 13.954 -17.736 1.00 0.00 O ATOM 1342 OD2 ASP A 82 0.079 12.685 -16.558 1.00 0.00 O ATOM 0 H ASP A 82 -3.303 12.770 -17.873 1.00 0.00 H new ATOM 0 HA ASP A 82 -2.445 10.869 -15.928 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -2.783 13.900 -15.671 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -1.716 12.884 -14.721 1.00 0.00 H new ATOM 1347 N GLN A 83 -5.325 12.404 -15.463 1.00 0.00 N ATOM 1348 CA GLN A 83 -6.535 12.538 -14.630 1.00 0.00 C ATOM 1349 C GLN A 83 -7.716 11.718 -15.174 1.00 0.00 C ATOM 1350 O GLN A 83 -8.813 11.832 -14.629 1.00 0.00 O ATOM 1351 CB GLN A 83 -6.956 14.028 -14.508 1.00 0.00 C ATOM 1352 CG GLN A 83 -5.939 14.947 -13.809 1.00 0.00 C ATOM 1353 CD GLN A 83 -6.457 16.368 -13.558 1.00 0.00 C ATOM 1354 OE1 GLN A 83 -5.699 17.335 -13.630 1.00 0.00 O ATOM 1355 NE2 GLN A 83 -7.735 16.499 -13.201 1.00 0.00 N ATOM 0 H GLN A 83 -5.399 12.873 -16.366 1.00 0.00 H new ATOM 0 HA GLN A 83 -6.278 12.145 -13.646 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -7.144 14.418 -15.508 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -7.899 14.078 -13.964 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -5.655 14.500 -12.856 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -5.036 15.002 -14.417 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -8.337 15.677 -13.151 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -8.110 17.421 -12.978 1.00 0.00 H new ATOM 1364 N ILE A 84 -7.511 10.909 -16.247 1.00 0.00 N ATOM 1365 CA ILE A 84 -8.563 9.981 -16.723 1.00 0.00 C ATOM 1366 C ILE A 84 -8.819 8.928 -15.636 1.00 0.00 C ATOM 1367 O ILE A 84 -8.089 7.935 -15.508 1.00 0.00 O ATOM 1368 CB ILE A 84 -8.248 9.305 -18.127 1.00 0.00 C ATOM 1369 CG1 ILE A 84 -8.232 10.389 -19.256 1.00 0.00 C ATOM 1370 CG2 ILE A 84 -9.250 8.167 -18.468 1.00 0.00 C ATOM 1371 CD1 ILE A 84 -8.368 9.865 -20.678 1.00 0.00 C ATOM 0 H ILE A 84 -6.646 10.882 -16.786 1.00 0.00 H new ATOM 0 HA ILE A 84 -9.463 10.570 -16.901 1.00 0.00 H new ATOM 0 HB ILE A 84 -7.261 8.848 -18.059 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -9.043 11.093 -19.069 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -7.300 10.949 -19.183 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -8.995 7.735 -19.436 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -9.198 7.394 -17.701 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -10.261 8.572 -18.507 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -8.345 10.701 -21.377 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -7.544 9.186 -20.896 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -9.313 9.332 -20.781 1.00 0.00 H new ATOM 1383 N ARG A 85 -9.798 9.251 -14.783 1.00 0.00 N ATOM 1384 CA ARG A 85 -10.242 8.399 -13.684 1.00 0.00 C ATOM 1385 C ARG A 85 -11.438 7.576 -14.149 1.00 0.00 C ATOM 1386 O ARG A 85 -12.483 8.117 -14.530 1.00 0.00 O ATOM 1387 CB ARG A 85 -10.583 9.268 -12.445 1.00 0.00 C ATOM 1388 CG ARG A 85 -9.334 9.793 -11.707 1.00 0.00 C ATOM 1389 CD ARG A 85 -9.643 10.920 -10.706 1.00 0.00 C ATOM 1390 NE ARG A 85 -8.459 11.262 -9.889 1.00 0.00 N ATOM 1391 CZ ARG A 85 -8.053 12.503 -9.566 1.00 0.00 C ATOM 1392 NH1 ARG A 85 -8.629 13.583 -10.099 1.00 0.00 N ATOM 1393 NH2 ARG A 85 -7.054 12.649 -8.714 1.00 0.00 N ATOM 0 H ARG A 85 -10.311 10.130 -14.842 1.00 0.00 H new ATOM 0 HA ARG A 85 -9.447 7.713 -13.390 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -11.193 10.114 -12.760 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -11.186 8.681 -11.752 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -8.860 8.967 -11.177 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -8.614 10.156 -12.440 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -9.981 11.804 -11.246 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -10.460 10.614 -10.053 1.00 0.00 H new ATOM 0 HE ARG A 85 -7.899 10.485 -9.538 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -9.393 13.477 -10.766 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -8.305 14.515 -9.839 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -6.603 11.828 -8.312 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -6.734 13.583 -8.459 1.00 0.00 H new ATOM 1407 N LEU A 86 -11.242 6.268 -14.132 1.00 0.00 N ATOM 1408 CA LEU A 86 -12.211 5.297 -14.610 1.00 0.00 C ATOM 1409 C LEU A 86 -13.143 4.911 -13.459 1.00 0.00 C ATOM 1410 O LEU A 86 -12.683 4.430 -12.426 1.00 0.00 O ATOM 1411 CB LEU A 86 -11.460 4.043 -15.134 1.00 0.00 C ATOM 1412 CG LEU A 86 -10.782 4.128 -16.534 1.00 0.00 C ATOM 1413 CD1 LEU A 86 -9.610 5.129 -16.574 1.00 0.00 C ATOM 1414 CD2 LEU A 86 -10.337 2.719 -16.973 1.00 0.00 C ATOM 0 H LEU A 86 -10.385 5.843 -13.777 1.00 0.00 H new ATOM 0 HA LEU A 86 -12.802 5.724 -15.421 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -10.691 3.786 -14.406 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -12.168 3.215 -15.156 1.00 0.00 H new ATOM 0 HG LEU A 86 -11.519 4.511 -17.240 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -9.178 5.144 -17.575 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -9.973 6.125 -16.321 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.849 4.827 -15.855 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -9.862 2.776 -17.953 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -9.627 2.319 -16.249 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -11.206 2.064 -17.029 1.00 0.00 H new ATOM 1426 N TRP A 87 -14.450 5.138 -13.636 1.00 0.00 N ATOM 1427 CA TRP A 87 -15.466 4.767 -12.636 1.00 0.00 C ATOM 1428 C TRP A 87 -16.452 3.783 -13.273 1.00 0.00 C ATOM 1429 O TRP A 87 -17.274 4.194 -14.087 1.00 0.00 O ATOM 1430 CB TRP A 87 -16.213 6.036 -12.137 1.00 0.00 C ATOM 1431 CG TRP A 87 -15.371 6.931 -11.268 1.00 0.00 C ATOM 1432 CD1 TRP A 87 -14.487 7.895 -11.662 1.00 0.00 C ATOM 1433 CD2 TRP A 87 -15.337 6.922 -9.840 1.00 0.00 C ATOM 1434 NE1 TRP A 87 -13.919 8.492 -10.563 1.00 0.00 N ATOM 1435 CE2 TRP A 87 -14.433 7.905 -9.434 1.00 0.00 C ATOM 1436 CE3 TRP A 87 -16.013 6.174 -8.867 1.00 0.00 C ATOM 1437 CZ2 TRP A 87 -14.164 8.154 -8.094 1.00 0.00 C ATOM 1438 CZ3 TRP A 87 -15.741 6.425 -7.539 1.00 0.00 C ATOM 1439 CH2 TRP A 87 -14.833 7.408 -7.164 1.00 0.00 C ATOM 0 H TRP A 87 -14.834 5.581 -14.470 1.00 0.00 H new ATOM 0 HA TRP A 87 -14.985 4.296 -11.779 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -16.561 6.605 -12.999 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -17.098 5.730 -11.579 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -14.267 8.151 -12.688 1.00 0.00 H new ATOM 0 HE1 TRP A 87 -13.231 9.245 -10.583 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -16.731 5.418 -9.151 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -13.452 8.910 -7.798 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -16.242 5.847 -6.777 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -14.652 7.587 -6.114 1.00 0.00 H new ATOM 1450 N PRO A 88 -16.410 2.466 -12.903 1.00 0.00 N ATOM 1451 CA PRO A 88 -17.308 1.454 -13.509 1.00 0.00 C ATOM 1452 C PRO A 88 -18.744 1.587 -12.977 1.00 0.00 C ATOM 1453 O PRO A 88 -18.979 2.291 -11.980 1.00 0.00 O ATOM 1454 CB PRO A 88 -16.649 0.118 -13.090 1.00 0.00 C ATOM 1455 CG PRO A 88 -15.996 0.420 -11.772 1.00 0.00 C ATOM 1456 CD PRO A 88 -15.510 1.856 -11.878 1.00 0.00 C ATOM 0 HA PRO A 88 -17.411 1.553 -14.590 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -17.389 -0.677 -12.994 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -15.919 -0.214 -13.828 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -16.701 0.304 -10.949 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -15.167 -0.261 -11.580 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -15.584 2.374 -10.922 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -14.465 1.902 -12.185 1.00 0.00 H new ATOM 1464 N MET A 89 -19.705 0.950 -13.666 1.00 0.00 N ATOM 1465 CA MET A 89 -21.100 0.829 -13.183 1.00 0.00 C ATOM 1466 C MET A 89 -21.180 -0.189 -12.000 1.00 0.00 C ATOM 1467 O MET A 89 -21.904 -1.196 -12.027 1.00 0.00 O ATOM 1468 CB MET A 89 -22.060 0.467 -14.369 1.00 0.00 C ATOM 1469 CG MET A 89 -21.990 -0.971 -14.970 1.00 0.00 C ATOM 1470 SD MET A 89 -20.520 -1.344 -15.966 1.00 0.00 S ATOM 1471 CE MET A 89 -19.336 -1.975 -14.784 1.00 0.00 C ATOM 0 H MET A 89 -19.543 0.505 -14.569 1.00 0.00 H new ATOM 0 HA MET A 89 -21.434 1.790 -12.792 1.00 0.00 H new ATOM 0 HB2 MET A 89 -23.083 0.636 -14.031 1.00 0.00 H new ATOM 0 HB3 MET A 89 -21.870 1.174 -15.177 1.00 0.00 H new ATOM 0 HG2 MET A 89 -22.042 -1.689 -14.151 1.00 0.00 H new ATOM 0 HG3 MET A 89 -22.874 -1.129 -15.589 1.00 0.00 H new ATOM 0 HE1 MET A 89 -18.386 -1.454 -14.907 1.00 0.00 H new ATOM 0 HE2 MET A 89 -19.710 -1.814 -13.773 1.00 0.00 H new ATOM 0 HE3 MET A 89 -19.189 -3.042 -14.951 1.00 0.00 H new ATOM 1481 N GLN A 90 -20.443 0.128 -10.931 1.00 0.00 N ATOM 1482 CA GLN A 90 -20.200 -0.794 -9.811 1.00 0.00 C ATOM 1483 C GLN A 90 -21.458 -0.918 -8.941 1.00 0.00 C ATOM 1484 O GLN A 90 -22.105 0.093 -8.645 1.00 0.00 O ATOM 1485 CB GLN A 90 -18.984 -0.302 -8.960 1.00 0.00 C ATOM 1486 CG GLN A 90 -18.555 -1.263 -7.830 1.00 0.00 C ATOM 1487 CD GLN A 90 -18.190 -2.666 -8.327 1.00 0.00 C ATOM 1488 OE1 GLN A 90 -19.040 -3.559 -8.394 1.00 0.00 O ATOM 1489 NE2 GLN A 90 -16.933 -2.861 -8.717 1.00 0.00 N ATOM 0 H GLN A 90 -19.994 1.037 -10.815 1.00 0.00 H new ATOM 0 HA GLN A 90 -19.963 -1.780 -10.212 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -18.135 -0.142 -9.624 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -19.232 0.664 -8.521 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -17.699 -0.837 -7.307 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -19.364 -1.342 -7.104 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -16.254 -2.103 -8.649 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -16.648 -3.769 -9.084 1.00 0.00 H new ATOM 1498 N ALA A 91 -21.778 -2.160 -8.535 1.00 0.00 N ATOM 1499 CA ALA A 91 -22.964 -2.464 -7.726 1.00 0.00 C ATOM 1500 C ALA A 91 -22.775 -1.957 -6.284 1.00 0.00 C ATOM 1501 O ALA A 91 -22.321 -2.687 -5.395 1.00 0.00 O ATOM 1502 CB ALA A 91 -23.264 -3.972 -7.780 1.00 0.00 C ATOM 0 H ALA A 91 -21.217 -2.981 -8.761 1.00 0.00 H new ATOM 0 HA ALA A 91 -23.828 -1.943 -8.137 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -24.146 -4.189 -7.177 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -23.448 -4.270 -8.812 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -22.411 -4.527 -7.389 1.00 0.00 H new ATOM 1508 N ARG A 92 -23.082 -0.664 -6.090 1.00 0.00 N ATOM 1509 CA ARG A 92 -22.965 0.031 -4.793 1.00 0.00 C ATOM 1510 C ARG A 92 -24.279 0.728 -4.405 1.00 0.00 C ATOM 1511 O ARG A 92 -24.432 1.130 -3.254 1.00 0.00 O ATOM 1512 CB ARG A 92 -21.805 1.075 -4.847 1.00 0.00 C ATOM 1513 CG ARG A 92 -20.386 0.471 -4.950 1.00 0.00 C ATOM 1514 CD ARG A 92 -20.032 -0.408 -3.736 1.00 0.00 C ATOM 1515 NE ARG A 92 -18.677 -0.980 -3.843 1.00 0.00 N ATOM 1516 CZ ARG A 92 -18.277 -2.146 -3.304 1.00 0.00 C ATOM 1517 NH1 ARG A 92 -19.141 -2.928 -2.656 1.00 0.00 N ATOM 1518 NH2 ARG A 92 -17.016 -2.526 -3.439 1.00 0.00 N ATOM 0 H ARG A 92 -23.423 -0.062 -6.839 1.00 0.00 H new ATOM 0 HA ARG A 92 -22.745 -0.718 -4.033 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -21.967 1.731 -5.702 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -21.855 1.697 -3.953 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -20.313 -0.125 -5.860 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -19.657 1.276 -5.037 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -20.103 0.186 -2.825 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -20.760 -1.215 -3.648 1.00 0.00 H new ATOM 0 HE ARG A 92 -17.985 -0.447 -4.370 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -20.117 -2.644 -2.565 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -18.826 -3.810 -2.251 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -16.357 -1.936 -3.948 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -16.703 -3.408 -3.034 1.00 0.00 H new ATOM 1532 N SER A 93 -25.217 0.856 -5.363 1.00 0.00 N ATOM 1533 CA SER A 93 -26.475 1.612 -5.179 1.00 0.00 C ATOM 1534 C SER A 93 -27.476 0.836 -4.291 1.00 0.00 C ATOM 1535 O SER A 93 -28.424 0.221 -4.789 1.00 0.00 O ATOM 1536 CB SER A 93 -27.083 1.943 -6.565 1.00 0.00 C ATOM 1537 OG SER A 93 -28.273 2.708 -6.448 1.00 0.00 O ATOM 0 H SER A 93 -25.125 0.438 -6.289 1.00 0.00 H new ATOM 0 HA SER A 93 -26.254 2.545 -4.660 1.00 0.00 H new ATOM 0 HB2 SER A 93 -26.354 2.493 -7.160 1.00 0.00 H new ATOM 0 HB3 SER A 93 -27.297 1.017 -7.099 1.00 0.00 H new ATOM 0 HG SER A 93 -28.628 2.900 -7.341 1.00 0.00 H new ATOM 1543 N ASN A 94 -27.200 0.834 -2.973 1.00 0.00 N ATOM 1544 CA ASN A 94 -28.054 0.252 -1.924 1.00 0.00 C ATOM 1545 C ASN A 94 -27.856 1.070 -0.635 1.00 0.00 C ATOM 1546 O ASN A 94 -26.784 0.993 -0.019 1.00 0.00 O ATOM 1547 CB ASN A 94 -27.704 -1.255 -1.668 1.00 0.00 C ATOM 1548 CG ASN A 94 -28.319 -2.232 -2.682 1.00 0.00 C ATOM 1549 OD1 ASN A 94 -29.427 -2.022 -3.176 1.00 0.00 O ATOM 1550 ND2 ASN A 94 -27.611 -3.305 -3.013 1.00 0.00 N ATOM 0 H ASN A 94 -26.348 1.252 -2.598 1.00 0.00 H new ATOM 0 HA ASN A 94 -29.095 0.290 -2.246 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -26.620 -1.371 -1.682 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -28.041 -1.529 -0.668 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -27.983 -3.973 -3.688 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -26.695 -3.461 -2.593 1.00 0.00 H new ATOM 1557 N GLY A 95 -28.886 1.848 -0.245 1.00 0.00 N ATOM 1558 CA GLY A 95 -28.844 2.681 0.965 1.00 0.00 C ATOM 1559 C GLY A 95 -27.884 3.862 0.845 1.00 0.00 C ATOM 1560 O GLY A 95 -28.301 4.991 0.559 1.00 0.00 O ATOM 0 H GLY A 95 -29.764 1.914 -0.760 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -29.846 3.055 1.177 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -28.548 2.064 1.814 1.00 0.00 H new ATOM 1564 N THR A 96 -26.593 3.584 1.070 1.00 0.00 N ATOM 1565 CA THR A 96 -25.501 4.547 0.911 1.00 0.00 C ATOM 1566 C THR A 96 -24.373 3.867 0.124 1.00 0.00 C ATOM 1567 O THR A 96 -23.829 2.848 0.575 1.00 0.00 O ATOM 1568 CB THR A 96 -24.974 5.041 2.300 1.00 0.00 C ATOM 1569 OG1 THR A 96 -26.069 5.575 3.062 1.00 0.00 O ATOM 1570 CG2 THR A 96 -23.871 6.118 2.171 1.00 0.00 C ATOM 0 H THR A 96 -26.275 2.664 1.374 1.00 0.00 H new ATOM 0 HA THR A 96 -25.865 5.422 0.373 1.00 0.00 H new ATOM 0 HB THR A 96 -24.533 4.181 2.804 1.00 0.00 H new ATOM 0 HG1 THR A 96 -25.742 5.883 3.933 1.00 0.00 H new ATOM 0 HG21 THR A 96 -23.543 6.424 3.165 1.00 0.00 H new ATOM 0 HG22 THR A 96 -23.025 5.708 1.620 1.00 0.00 H new ATOM 0 HG23 THR A 96 -24.267 6.982 1.638 1.00 0.00 H new ATOM 1578 N LYS A 97 -24.047 4.407 -1.054 1.00 0.00 N ATOM 1579 CA LYS A 97 -23.007 3.840 -1.919 1.00 0.00 C ATOM 1580 C LYS A 97 -21.614 4.323 -1.494 1.00 0.00 C ATOM 1581 O LYS A 97 -21.459 5.422 -0.942 1.00 0.00 O ATOM 1582 CB LYS A 97 -23.265 4.190 -3.410 1.00 0.00 C ATOM 1583 CG LYS A 97 -23.112 5.679 -3.800 1.00 0.00 C ATOM 1584 CD LYS A 97 -23.266 5.904 -5.321 1.00 0.00 C ATOM 1585 CE LYS A 97 -23.037 7.368 -5.733 1.00 0.00 C ATOM 1586 NZ LYS A 97 -23.305 7.576 -7.179 1.00 0.00 N ATOM 0 H LYS A 97 -24.492 5.243 -1.433 1.00 0.00 H new ATOM 0 HA LYS A 97 -23.045 2.756 -1.810 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -22.580 3.604 -4.023 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -24.275 3.871 -3.667 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -23.859 6.270 -3.270 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -22.134 6.038 -3.479 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -22.558 5.267 -5.851 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -24.265 5.596 -5.630 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -23.685 8.018 -5.145 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -22.010 7.654 -5.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -23.141 8.574 -7.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -22.669 6.974 -7.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -24.293 7.327 -7.388 1.00 0.00 H new ATOM 1600 N ARG A 98 -20.611 3.477 -1.748 1.00 0.00 N ATOM 1601 CA ARG A 98 -19.197 3.831 -1.602 1.00 0.00 C ATOM 1602 C ARG A 98 -18.426 3.182 -2.769 1.00 0.00 C ATOM 1603 O ARG A 98 -17.895 2.074 -2.629 1.00 0.00 O ATOM 1604 CB ARG A 98 -18.654 3.391 -0.211 1.00 0.00 C ATOM 1605 CG ARG A 98 -17.201 3.830 0.111 1.00 0.00 C ATOM 1606 CD ARG A 98 -16.986 5.358 -0.005 1.00 0.00 C ATOM 1607 NE ARG A 98 -17.942 6.132 0.819 1.00 0.00 N ATOM 1608 CZ ARG A 98 -17.942 7.464 0.964 1.00 0.00 C ATOM 1609 NH1 ARG A 98 -16.976 8.210 0.450 1.00 0.00 N ATOM 1610 NH2 ARG A 98 -18.906 8.045 1.655 1.00 0.00 N ATOM 0 H ARG A 98 -20.760 2.519 -2.064 1.00 0.00 H new ATOM 0 HA ARG A 98 -19.064 4.912 -1.644 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -19.314 3.790 0.559 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -18.709 2.304 -0.147 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -16.947 3.510 1.121 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -16.516 3.321 -0.567 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -15.968 5.602 0.300 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -17.086 5.657 -1.048 1.00 0.00 H new ATOM 0 HE ARG A 98 -18.661 5.607 1.318 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -16.214 7.772 -0.067 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -16.994 9.223 0.571 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -19.645 7.480 2.074 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -18.912 9.059 1.769 1.00 0.00 H new ATOM 1624 N PRO A 99 -18.449 3.818 -3.983 1.00 0.00 N ATOM 1625 CA PRO A 99 -17.709 3.320 -5.155 1.00 0.00 C ATOM 1626 C PRO A 99 -16.227 3.744 -5.122 1.00 0.00 C ATOM 1627 O PRO A 99 -15.829 4.620 -4.340 1.00 0.00 O ATOM 1628 CB PRO A 99 -18.480 3.958 -6.336 1.00 0.00 C ATOM 1629 CG PRO A 99 -18.947 5.279 -5.798 1.00 0.00 C ATOM 1630 CD PRO A 99 -19.209 5.061 -4.315 1.00 0.00 C ATOM 0 HA PRO A 99 -17.667 2.232 -5.213 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -17.838 4.087 -7.208 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -19.319 3.335 -6.647 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -18.193 6.051 -5.951 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -19.851 5.610 -6.309 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -18.864 5.908 -3.722 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -20.273 4.942 -4.113 1.00 0.00 H new ATOM 1638 N ALA A 100 -15.422 3.102 -5.972 1.00 0.00 N ATOM 1639 CA ALA A 100 -13.980 3.367 -6.092 1.00 0.00 C ATOM 1640 C ALA A 100 -13.582 3.346 -7.571 1.00 0.00 C ATOM 1641 O ALA A 100 -14.155 2.584 -8.364 1.00 0.00 O ATOM 1642 CB ALA A 100 -13.174 2.330 -5.286 1.00 0.00 C ATOM 0 H ALA A 100 -15.754 2.374 -6.605 1.00 0.00 H new ATOM 0 HA ALA A 100 -13.756 4.352 -5.682 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -12.109 2.540 -5.385 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -13.458 2.385 -4.235 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -13.384 1.330 -5.667 1.00 0.00 H new ATOM 1648 N MET A 101 -12.612 4.197 -7.931 1.00 0.00 N ATOM 1649 CA MET A 101 -12.069 4.268 -9.293 1.00 0.00 C ATOM 1650 C MET A 101 -11.048 3.138 -9.496 1.00 0.00 C ATOM 1651 O MET A 101 -10.566 2.539 -8.518 1.00 0.00 O ATOM 1652 CB MET A 101 -11.401 5.659 -9.548 1.00 0.00 C ATOM 1653 CG MET A 101 -10.029 5.891 -8.860 1.00 0.00 C ATOM 1654 SD MET A 101 -10.059 5.741 -7.050 1.00 0.00 S ATOM 1655 CE MET A 101 -11.017 7.174 -6.562 1.00 0.00 C ATOM 0 H MET A 101 -12.181 4.857 -7.284 1.00 0.00 H new ATOM 0 HA MET A 101 -12.884 4.149 -10.007 1.00 0.00 H new ATOM 0 HB2 MET A 101 -11.272 5.787 -10.623 1.00 0.00 H new ATOM 0 HB3 MET A 101 -12.088 6.437 -9.215 1.00 0.00 H new ATOM 0 HG2 MET A 101 -9.311 5.175 -9.259 1.00 0.00 H new ATOM 0 HG3 MET A 101 -9.668 6.885 -9.124 1.00 0.00 H new ATOM 0 HE1 MET A 101 -10.621 7.576 -5.629 1.00 0.00 H new ATOM 0 HE2 MET A 101 -10.955 7.935 -7.340 1.00 0.00 H new ATOM 0 HE3 MET A 101 -12.058 6.884 -6.420 1.00 0.00 H new ATOM 1665 N LEU A 102 -10.730 2.834 -10.765 1.00 0.00 N ATOM 1666 CA LEU A 102 -9.616 1.937 -11.092 1.00 0.00 C ATOM 1667 C LEU A 102 -8.306 2.711 -10.887 1.00 0.00 C ATOM 1668 O LEU A 102 -8.164 3.837 -11.384 1.00 0.00 O ATOM 1669 CB LEU A 102 -9.727 1.363 -12.542 1.00 0.00 C ATOM 1670 CG LEU A 102 -10.964 0.439 -12.845 1.00 0.00 C ATOM 1671 CD1 LEU A 102 -11.223 -0.566 -11.713 1.00 0.00 C ATOM 1672 CD2 LEU A 102 -12.225 1.245 -13.166 1.00 0.00 C ATOM 0 H LEU A 102 -11.229 3.197 -11.577 1.00 0.00 H new ATOM 0 HA LEU A 102 -9.643 1.071 -10.431 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -9.750 2.201 -13.239 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.820 0.797 -12.754 1.00 0.00 H new ATOM 0 HG LEU A 102 -10.708 -0.131 -13.738 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -12.086 -1.183 -11.965 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -10.347 -1.202 -11.584 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -11.420 -0.027 -10.786 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -13.051 0.563 -13.368 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -12.477 1.879 -12.316 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -12.046 1.867 -14.043 1.00 0.00 H new ATOM 1684 N ASP A 103 -7.390 2.113 -10.099 1.00 0.00 N ATOM 1685 CA ASP A 103 -6.147 2.762 -9.654 1.00 0.00 C ATOM 1686 C ASP A 103 -5.265 3.091 -10.863 1.00 0.00 C ATOM 1687 O ASP A 103 -4.997 2.206 -11.662 1.00 0.00 O ATOM 1688 CB ASP A 103 -5.383 1.830 -8.684 1.00 0.00 C ATOM 1689 CG ASP A 103 -4.199 2.543 -8.020 1.00 0.00 C ATOM 1690 OD1 ASP A 103 -3.124 2.646 -8.639 1.00 0.00 O ATOM 1691 OD2 ASP A 103 -4.358 3.032 -6.888 1.00 0.00 O ATOM 0 H ASP A 103 -7.496 1.159 -9.753 1.00 0.00 H new ATOM 0 HA ASP A 103 -6.398 3.687 -9.135 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -6.066 1.467 -7.916 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -5.022 0.957 -9.228 1.00 0.00 H new ATOM 1696 N ASN A 104 -4.784 4.349 -10.954 1.00 0.00 N ATOM 1697 CA ASN A 104 -4.099 4.847 -12.164 1.00 0.00 C ATOM 1698 C ASN A 104 -2.701 4.204 -12.357 1.00 0.00 C ATOM 1699 O ASN A 104 -2.155 4.214 -13.465 1.00 0.00 O ATOM 1700 CB ASN A 104 -3.999 6.397 -12.159 1.00 0.00 C ATOM 1701 CG ASN A 104 -3.596 6.998 -13.520 1.00 0.00 C ATOM 1702 OD1 ASN A 104 -2.891 8.011 -13.585 1.00 0.00 O ATOM 1703 ND2 ASN A 104 -4.065 6.401 -14.615 1.00 0.00 N ATOM 0 H ASN A 104 -4.858 5.037 -10.205 1.00 0.00 H new ATOM 0 HA ASN A 104 -4.711 4.547 -13.015 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -4.961 6.813 -11.859 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -3.271 6.703 -11.407 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -3.844 6.779 -15.536 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -4.645 5.566 -14.532 1.00 0.00 H new ATOM 1710 N GLU A 105 -2.117 3.667 -11.272 1.00 0.00 N ATOM 1711 CA GLU A 105 -0.864 2.896 -11.355 1.00 0.00 C ATOM 1712 C GLU A 105 -1.155 1.459 -11.814 1.00 0.00 C ATOM 1713 O GLU A 105 -0.391 0.878 -12.595 1.00 0.00 O ATOM 1714 CB GLU A 105 -0.125 2.866 -9.994 1.00 0.00 C ATOM 1715 CG GLU A 105 1.279 2.225 -10.046 1.00 0.00 C ATOM 1716 CD GLU A 105 1.852 1.872 -8.666 1.00 0.00 C ATOM 1717 OE1 GLU A 105 2.100 2.792 -7.859 1.00 0.00 O ATOM 1718 OE2 GLU A 105 2.079 0.675 -8.391 1.00 0.00 O ATOM 0 H GLU A 105 -2.492 3.753 -10.327 1.00 0.00 H new ATOM 0 HA GLU A 105 -0.220 3.390 -12.083 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -0.032 3.886 -9.622 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -0.735 2.319 -9.275 1.00 0.00 H new ATOM 0 HG2 GLU A 105 1.233 1.320 -10.652 1.00 0.00 H new ATOM 0 HG3 GLU A 105 1.962 2.910 -10.548 1.00 0.00 H new ATOM 1725 N ALA A 106 -2.271 0.905 -11.325 1.00 0.00 N ATOM 1726 CA ALA A 106 -2.649 -0.495 -11.580 1.00 0.00 C ATOM 1727 C ALA A 106 -3.141 -0.695 -13.011 1.00 0.00 C ATOM 1728 O ALA A 106 -2.666 -1.593 -13.717 1.00 0.00 O ATOM 1729 CB ALA A 106 -3.738 -0.946 -10.603 1.00 0.00 C ATOM 0 H ALA A 106 -2.938 1.411 -10.742 1.00 0.00 H new ATOM 0 HA ALA A 106 -1.754 -1.100 -11.435 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -4.004 -1.983 -10.808 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -3.368 -0.861 -9.581 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.619 -0.315 -10.724 1.00 0.00 H new ATOM 1735 N ASP A 107 -4.067 0.177 -13.429 1.00 0.00 N ATOM 1736 CA ASP A 107 -4.916 -0.056 -14.598 1.00 0.00 C ATOM 1737 C ASP A 107 -4.095 -0.123 -15.898 1.00 0.00 C ATOM 1738 O ASP A 107 -4.079 -1.161 -16.574 1.00 0.00 O ATOM 1739 CB ASP A 107 -6.101 0.978 -14.670 1.00 0.00 C ATOM 1740 CG ASP A 107 -5.765 2.485 -14.736 1.00 0.00 C ATOM 1741 OD1 ASP A 107 -4.584 2.872 -14.680 1.00 0.00 O ATOM 1742 OD2 ASP A 107 -6.718 3.294 -14.833 1.00 0.00 O ATOM 0 H ASP A 107 -4.247 1.066 -12.963 1.00 0.00 H new ATOM 0 HA ASP A 107 -5.375 -1.038 -14.482 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -6.700 0.734 -15.547 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -6.734 0.818 -13.797 1.00 0.00 H new ATOM 1747 N GLY A 108 -3.320 0.932 -16.170 1.00 0.00 N ATOM 1748 CA GLY A 108 -2.583 1.082 -17.433 1.00 0.00 C ATOM 1749 C GLY A 108 -1.342 0.200 -17.515 1.00 0.00 C ATOM 1750 O GLY A 108 -0.735 0.054 -18.581 1.00 0.00 O ATOM 0 H GLY A 108 -3.185 1.708 -15.521 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -3.247 0.842 -18.264 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -2.288 2.125 -17.552 1.00 0.00 H new ATOM 1754 N ASN A 109 -1.009 -0.425 -16.382 1.00 0.00 N ATOM 1755 CA ASN A 109 0.204 -1.248 -16.218 1.00 0.00 C ATOM 1756 C ASN A 109 -0.023 -2.621 -16.881 1.00 0.00 C ATOM 1757 O ASN A 109 0.890 -3.214 -17.469 1.00 0.00 O ATOM 1758 CB ASN A 109 0.501 -1.400 -14.694 1.00 0.00 C ATOM 1759 CG ASN A 109 1.855 -2.030 -14.334 1.00 0.00 C ATOM 1760 OD1 ASN A 109 2.417 -2.847 -15.065 1.00 0.00 O ATOM 1761 ND2 ASN A 109 2.395 -1.654 -13.179 1.00 0.00 N ATOM 0 H ASN A 109 -1.579 -0.376 -15.538 1.00 0.00 H new ATOM 0 HA ASN A 109 1.061 -0.775 -16.697 1.00 0.00 H new ATOM 0 HB2 ASN A 109 0.447 -0.414 -14.233 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -0.289 -2.004 -14.248 1.00 0.00 H new ATOM 0 HD21 ASN A 109 3.290 -2.043 -12.884 1.00 0.00 H new ATOM 0 HD22 ASN A 109 1.914 -0.976 -12.588 1.00 0.00 H new ATOM 1768 N LYS A 110 -1.282 -3.073 -16.833 1.00 0.00 N ATOM 1769 CA LYS A 110 -1.701 -4.398 -17.306 1.00 0.00 C ATOM 1770 C LYS A 110 -2.896 -4.267 -18.278 1.00 0.00 C ATOM 1771 O LYS A 110 -3.289 -3.149 -18.635 1.00 0.00 O ATOM 1772 CB LYS A 110 -1.996 -5.316 -16.076 1.00 0.00 C ATOM 1773 CG LYS A 110 -2.775 -4.668 -14.893 1.00 0.00 C ATOM 1774 CD LYS A 110 -4.222 -4.229 -15.237 1.00 0.00 C ATOM 1775 CE LYS A 110 -5.055 -3.905 -13.993 1.00 0.00 C ATOM 1776 NZ LYS A 110 -5.219 -5.087 -13.112 1.00 0.00 N ATOM 0 H LYS A 110 -2.052 -2.519 -16.458 1.00 0.00 H new ATOM 0 HA LYS A 110 -0.901 -4.871 -17.875 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -2.562 -6.180 -16.424 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -1.046 -5.690 -15.694 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -2.811 -5.378 -14.067 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -2.219 -3.799 -14.542 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -4.187 -3.352 -15.884 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -4.713 -5.022 -15.801 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -4.576 -3.100 -13.435 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -6.036 -3.541 -14.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -6.133 -5.029 -12.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -5.189 -5.954 -13.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -4.450 -5.108 -12.412 1.00 0.00 H new ATOM 1790 N THR A 111 -3.472 -5.416 -18.687 1.00 0.00 N ATOM 1791 CA THR A 111 -4.561 -5.466 -19.686 1.00 0.00 C ATOM 1792 C THR A 111 -5.896 -4.989 -19.086 1.00 0.00 C ATOM 1793 O THR A 111 -6.119 -5.101 -17.875 1.00 0.00 O ATOM 1794 CB THR A 111 -4.719 -6.910 -20.275 1.00 0.00 C ATOM 1795 OG1 THR A 111 -5.031 -7.838 -19.232 1.00 0.00 O ATOM 1796 CG2 THR A 111 -3.444 -7.382 -20.983 1.00 0.00 C ATOM 0 H THR A 111 -3.197 -6.333 -18.336 1.00 0.00 H new ATOM 0 HA THR A 111 -4.289 -4.788 -20.495 1.00 0.00 H new ATOM 0 HB THR A 111 -5.529 -6.870 -21.004 1.00 0.00 H new ATOM 0 HG1 THR A 111 -4.392 -7.731 -18.497 1.00 0.00 H new ATOM 0 HG21 THR A 111 -3.597 -8.387 -21.376 1.00 0.00 H new ATOM 0 HG22 THR A 111 -3.211 -6.703 -21.803 1.00 0.00 H new ATOM 0 HG23 THR A 111 -2.616 -7.392 -20.274 1.00 0.00 H new ATOM 1804 N MET A 112 -6.785 -4.459 -19.948 1.00 0.00 N ATOM 1805 CA MET A 112 -8.080 -3.897 -19.512 1.00 0.00 C ATOM 1806 C MET A 112 -9.142 -4.988 -19.284 1.00 0.00 C ATOM 1807 O MET A 112 -10.259 -4.680 -18.852 1.00 0.00 O ATOM 1808 CB MET A 112 -8.593 -2.828 -20.516 1.00 0.00 C ATOM 1809 CG MET A 112 -9.024 -3.331 -21.896 1.00 0.00 C ATOM 1810 SD MET A 112 -9.641 -2.012 -22.974 1.00 0.00 S ATOM 1811 CE MET A 112 -11.027 -1.353 -22.034 1.00 0.00 C ATOM 0 H MET A 112 -6.630 -4.408 -20.955 1.00 0.00 H new ATOM 0 HA MET A 112 -7.906 -3.412 -18.552 1.00 0.00 H new ATOM 0 HB2 MET A 112 -9.440 -2.313 -20.062 1.00 0.00 H new ATOM 0 HB3 MET A 112 -7.806 -2.086 -20.655 1.00 0.00 H new ATOM 0 HG2 MET A 112 -8.178 -3.820 -22.378 1.00 0.00 H new ATOM 0 HG3 MET A 112 -9.801 -4.086 -21.774 1.00 0.00 H new ATOM 0 HE1 MET A 112 -11.911 -1.311 -22.670 1.00 0.00 H new ATOM 0 HE2 MET A 112 -11.226 -1.998 -21.179 1.00 0.00 H new ATOM 0 HE3 MET A 112 -10.784 -0.350 -21.683 1.00 0.00 H new ATOM 1821 N ILE A 113 -8.783 -6.261 -19.558 1.00 0.00 N ATOM 1822 CA ILE A 113 -9.674 -7.422 -19.332 1.00 0.00 C ATOM 1823 C ILE A 113 -9.911 -7.643 -17.829 1.00 0.00 C ATOM 1824 O ILE A 113 -11.003 -8.046 -17.400 1.00 0.00 O ATOM 1825 CB ILE A 113 -9.114 -8.750 -19.996 1.00 0.00 C ATOM 1826 CG1 ILE A 113 -10.192 -9.878 -19.976 1.00 0.00 C ATOM 1827 CG2 ILE A 113 -7.800 -9.242 -19.348 1.00 0.00 C ATOM 1828 CD1 ILE A 113 -11.499 -9.497 -20.624 1.00 0.00 C ATOM 0 H ILE A 113 -7.872 -6.513 -19.940 1.00 0.00 H new ATOM 0 HA ILE A 113 -10.623 -7.189 -19.814 1.00 0.00 H new ATOM 0 HB ILE A 113 -8.879 -8.501 -21.031 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -9.791 -10.757 -20.482 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -10.382 -10.165 -18.942 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -7.468 -10.153 -19.846 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.034 -8.473 -19.450 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -7.970 -9.447 -18.291 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -12.192 -10.337 -20.567 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -11.926 -8.639 -20.105 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -11.326 -9.240 -21.669 1.00 0.00 H new ATOM 1840 N GLU A 114 -8.876 -7.313 -17.056 1.00 0.00 N ATOM 1841 CA GLU A 114 -8.821 -7.534 -15.598 1.00 0.00 C ATOM 1842 C GLU A 114 -9.796 -6.596 -14.864 1.00 0.00 C ATOM 1843 O GLU A 114 -10.295 -6.904 -13.777 1.00 0.00 O ATOM 1844 CB GLU A 114 -7.357 -7.320 -15.104 1.00 0.00 C ATOM 1845 CG GLU A 114 -6.301 -7.842 -16.110 1.00 0.00 C ATOM 1846 CD GLU A 114 -4.843 -7.782 -15.648 1.00 0.00 C ATOM 1847 OE1 GLU A 114 -4.590 -7.445 -14.475 1.00 0.00 O ATOM 1848 OE2 GLU A 114 -3.941 -8.065 -16.477 1.00 0.00 O ATOM 0 H GLU A 114 -8.032 -6.876 -17.426 1.00 0.00 H new ATOM 0 HA GLU A 114 -9.127 -8.557 -15.376 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -7.190 -6.257 -14.927 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -7.223 -7.827 -14.148 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -6.541 -8.877 -16.353 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -6.393 -7.268 -17.032 1.00 0.00 H new ATOM 1855 N LEU A 115 -10.037 -5.440 -15.492 1.00 0.00 N ATOM 1856 CA LEU A 115 -10.939 -4.399 -14.991 1.00 0.00 C ATOM 1857 C LEU A 115 -12.368 -4.604 -15.516 1.00 0.00 C ATOM 1858 O LEU A 115 -13.337 -4.438 -14.774 1.00 0.00 O ATOM 1859 CB LEU A 115 -10.403 -3.028 -15.437 1.00 0.00 C ATOM 1860 CG LEU A 115 -8.906 -2.764 -15.094 1.00 0.00 C ATOM 1861 CD1 LEU A 115 -8.436 -1.458 -15.727 1.00 0.00 C ATOM 1862 CD2 LEU A 115 -8.652 -2.784 -13.566 1.00 0.00 C ATOM 0 H LEU A 115 -9.601 -5.198 -16.382 1.00 0.00 H new ATOM 0 HA LEU A 115 -10.977 -4.452 -13.903 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.535 -2.936 -16.515 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -11.009 -2.249 -14.974 1.00 0.00 H new ATOM 0 HG LEU A 115 -8.316 -3.577 -15.518 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -7.389 -1.289 -15.477 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -8.546 -1.518 -16.810 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -9.037 -0.632 -15.347 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -7.596 -2.596 -13.370 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.253 -2.011 -13.087 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.927 -3.759 -13.164 1.00 0.00 H new ATOM 1874 N SER A 116 -12.470 -4.943 -16.822 1.00 0.00 N ATOM 1875 CA SER A 116 -13.764 -5.105 -17.517 1.00 0.00 C ATOM 1876 C SER A 116 -14.520 -6.331 -17.011 1.00 0.00 C ATOM 1877 O SER A 116 -15.744 -6.384 -17.111 1.00 0.00 O ATOM 1878 CB SER A 116 -13.555 -5.204 -19.050 1.00 0.00 C ATOM 1879 OG SER A 116 -12.731 -6.304 -19.390 1.00 0.00 O ATOM 0 H SER A 116 -11.661 -5.111 -17.419 1.00 0.00 H new ATOM 0 HA SER A 116 -14.365 -4.222 -17.299 1.00 0.00 H new ATOM 0 HB2 SER A 116 -14.521 -5.305 -19.544 1.00 0.00 H new ATOM 0 HB3 SER A 116 -13.104 -4.282 -19.417 1.00 0.00 H new ATOM 0 HG SER A 116 -12.385 -6.719 -18.572 1.00 0.00 H new ATOM 1885 N ASP A 117 -13.758 -7.321 -16.492 1.00 0.00 N ATOM 1886 CA ASP A 117 -14.299 -8.578 -15.951 1.00 0.00 C ATOM 1887 C ASP A 117 -14.984 -9.393 -17.081 1.00 0.00 C ATOM 1888 O ASP A 117 -15.947 -10.131 -16.851 1.00 0.00 O ATOM 1889 CB ASP A 117 -15.250 -8.281 -14.741 1.00 0.00 C ATOM 1890 CG ASP A 117 -15.555 -9.518 -13.880 1.00 0.00 C ATOM 1891 OD1 ASP A 117 -14.654 -9.948 -13.124 1.00 0.00 O ATOM 1892 OD2 ASP A 117 -16.685 -10.056 -13.946 1.00 0.00 O ATOM 0 H ASP A 117 -12.741 -7.264 -16.439 1.00 0.00 H new ATOM 0 HA ASP A 117 -13.488 -9.196 -15.565 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -14.796 -7.514 -14.113 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -16.187 -7.871 -15.118 1.00 0.00 H new ATOM 1897 N ASN A 118 -14.429 -9.243 -18.309 1.00 0.00 N ATOM 1898 CA ASN A 118 -14.909 -9.917 -19.545 1.00 0.00 C ATOM 1899 C ASN A 118 -16.275 -9.367 -20.015 1.00 0.00 C ATOM 1900 O ASN A 118 -17.022 -10.055 -20.725 1.00 0.00 O ATOM 1901 CB ASN A 118 -14.931 -11.475 -19.386 1.00 0.00 C ATOM 1902 CG ASN A 118 -13.541 -12.097 -19.211 1.00 0.00 C ATOM 1903 OD1 ASN A 118 -12.911 -12.532 -20.177 1.00 0.00 O ATOM 1904 ND2 ASN A 118 -13.046 -12.122 -17.979 1.00 0.00 N ATOM 0 H ASN A 118 -13.622 -8.641 -18.473 1.00 0.00 H new ATOM 0 HA ASN A 118 -14.190 -9.685 -20.331 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -15.546 -11.735 -18.525 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -15.408 -11.914 -20.262 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -12.118 -12.510 -17.810 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -13.594 -11.754 -17.202 1.00 0.00 H new ATOM 1911 N GLU A 119 -16.573 -8.099 -19.667 1.00 0.00 N ATOM 1912 CA GLU A 119 -17.820 -7.424 -20.101 1.00 0.00 C ATOM 1913 C GLU A 119 -17.727 -6.888 -21.538 1.00 0.00 C ATOM 1914 O GLU A 119 -16.656 -6.473 -21.998 1.00 0.00 O ATOM 1915 CB GLU A 119 -18.205 -6.265 -19.143 1.00 0.00 C ATOM 1916 CG GLU A 119 -18.910 -6.726 -17.863 1.00 0.00 C ATOM 1917 CD GLU A 119 -19.348 -5.571 -16.949 1.00 0.00 C ATOM 1918 OE1 GLU A 119 -20.371 -4.927 -17.264 1.00 0.00 O ATOM 1919 OE2 GLU A 119 -18.694 -5.313 -15.915 1.00 0.00 O ATOM 0 H GLU A 119 -15.968 -7.518 -19.086 1.00 0.00 H new ATOM 0 HA GLU A 119 -18.598 -8.187 -20.071 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -17.303 -5.716 -18.872 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -18.855 -5.569 -19.673 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -19.786 -7.316 -18.133 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -18.242 -7.384 -17.307 1.00 0.00 H new ATOM 1926 N ASN A 120 -18.890 -6.908 -22.214 1.00 0.00 N ATOM 1927 CA ASN A 120 -19.077 -6.325 -23.541 1.00 0.00 C ATOM 1928 C ASN A 120 -20.598 -6.078 -23.760 1.00 0.00 C ATOM 1929 O ASN A 120 -21.351 -7.034 -23.961 1.00 0.00 O ATOM 1930 CB ASN A 120 -18.491 -7.240 -24.645 1.00 0.00 C ATOM 1931 CG ASN A 120 -18.576 -6.635 -26.042 1.00 0.00 C ATOM 1932 OD1 ASN A 120 -18.547 -5.421 -26.202 1.00 0.00 O ATOM 1933 ND2 ASN A 120 -18.686 -7.472 -27.058 1.00 0.00 N ATOM 0 H ASN A 120 -19.736 -7.339 -21.841 1.00 0.00 H new ATOM 0 HA ASN A 120 -18.540 -5.378 -23.603 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -17.448 -7.454 -24.413 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -19.021 -8.192 -24.637 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -18.750 -7.112 -28.010 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -18.707 -8.478 -26.890 1.00 0.00 H new ATOM 1940 N PRO A 121 -21.091 -4.794 -23.702 1.00 0.00 N ATOM 1941 CA PRO A 121 -20.264 -3.600 -23.446 1.00 0.00 C ATOM 1942 C PRO A 121 -20.048 -3.304 -21.948 1.00 0.00 C ATOM 1943 O PRO A 121 -20.927 -3.540 -21.113 1.00 0.00 O ATOM 1944 CB PRO A 121 -21.057 -2.483 -24.158 1.00 0.00 C ATOM 1945 CG PRO A 121 -22.495 -2.883 -23.985 1.00 0.00 C ATOM 1946 CD PRO A 121 -22.522 -4.413 -23.918 1.00 0.00 C ATOM 0 HA PRO A 121 -19.244 -3.716 -23.813 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -20.859 -1.508 -23.713 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -20.787 -2.413 -25.212 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -22.911 -2.449 -23.076 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -23.100 -2.521 -24.817 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -23.156 -4.765 -23.104 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -22.915 -4.845 -24.838 1.00 0.00 H new ATOM 1954 N TRP A 122 -18.849 -2.801 -21.637 1.00 0.00 N ATOM 1955 CA TRP A 122 -18.457 -2.423 -20.280 1.00 0.00 C ATOM 1956 C TRP A 122 -18.764 -0.931 -20.076 1.00 0.00 C ATOM 1957 O TRP A 122 -18.171 -0.077 -20.733 1.00 0.00 O ATOM 1958 CB TRP A 122 -16.952 -2.740 -20.072 1.00 0.00 C ATOM 1959 CG TRP A 122 -16.413 -2.416 -18.696 1.00 0.00 C ATOM 1960 CD1 TRP A 122 -17.030 -2.638 -17.498 1.00 0.00 C ATOM 1961 CD2 TRP A 122 -15.126 -1.858 -18.380 1.00 0.00 C ATOM 1962 NE1 TRP A 122 -16.225 -2.236 -16.466 1.00 0.00 N ATOM 1963 CE2 TRP A 122 -15.046 -1.771 -16.977 1.00 0.00 C ATOM 1964 CE3 TRP A 122 -14.027 -1.449 -19.147 1.00 0.00 C ATOM 1965 CZ2 TRP A 122 -13.930 -1.260 -16.325 1.00 0.00 C ATOM 1966 CZ3 TRP A 122 -12.911 -0.950 -18.499 1.00 0.00 C ATOM 1967 CH2 TRP A 122 -12.864 -0.874 -17.100 1.00 0.00 C ATOM 0 H TRP A 122 -18.117 -2.644 -22.330 1.00 0.00 H new ATOM 0 HA TRP A 122 -19.019 -2.992 -19.539 1.00 0.00 H new ATOM 0 HB2 TRP A 122 -16.789 -3.800 -20.269 1.00 0.00 H new ATOM 0 HB3 TRP A 122 -16.374 -2.186 -20.812 1.00 0.00 H new ATOM 0 HD1 TRP A 122 -18.013 -3.069 -17.381 1.00 0.00 H new ATOM 0 HE1 TRP A 122 -16.466 -2.277 -15.476 1.00 0.00 H new ATOM 0 HE3 TRP A 122 -14.051 -1.522 -20.224 1.00 0.00 H new ATOM 0 HZ2 TRP A 122 -13.902 -1.170 -15.249 1.00 0.00 H new ATOM 0 HZ3 TRP A 122 -12.064 -0.614 -19.079 1.00 0.00 H new ATOM 0 HH2 TRP A 122 -11.970 -0.504 -16.621 1.00 0.00 H new ATOM 1978 N THR A 123 -19.715 -0.639 -19.186 1.00 0.00 N ATOM 1979 CA THR A 123 -20.151 0.732 -18.896 1.00 0.00 C ATOM 1980 C THR A 123 -19.200 1.391 -17.884 1.00 0.00 C ATOM 1981 O THR A 123 -18.888 0.809 -16.834 1.00 0.00 O ATOM 1982 CB THR A 123 -21.615 0.745 -18.355 1.00 0.00 C ATOM 1983 OG1 THR A 123 -22.508 0.213 -19.348 1.00 0.00 O ATOM 1984 CG2 THR A 123 -22.077 2.149 -17.922 1.00 0.00 C ATOM 0 H THR A 123 -20.207 -1.348 -18.643 1.00 0.00 H new ATOM 0 HA THR A 123 -20.125 1.303 -19.824 1.00 0.00 H new ATOM 0 HB THR A 123 -21.635 0.117 -17.464 1.00 0.00 H new ATOM 0 HG1 THR A 123 -23.425 0.222 -19.002 1.00 0.00 H new ATOM 0 HG21 THR A 123 -23.102 2.098 -17.555 1.00 0.00 H new ATOM 0 HG22 THR A 123 -21.426 2.518 -17.130 1.00 0.00 H new ATOM 0 HG23 THR A 123 -22.031 2.826 -18.775 1.00 0.00 H new ATOM 1992 N ILE A 124 -18.754 2.608 -18.207 1.00 0.00 N ATOM 1993 CA ILE A 124 -17.829 3.367 -17.372 1.00 0.00 C ATOM 1994 C ILE A 124 -18.125 4.877 -17.511 1.00 0.00 C ATOM 1995 O ILE A 124 -18.747 5.329 -18.481 1.00 0.00 O ATOM 1996 CB ILE A 124 -16.322 3.014 -17.754 1.00 0.00 C ATOM 1997 CG1 ILE A 124 -15.459 2.767 -16.491 1.00 0.00 C ATOM 1998 CG2 ILE A 124 -15.648 4.090 -18.645 1.00 0.00 C ATOM 1999 CD1 ILE A 124 -14.045 2.338 -16.773 1.00 0.00 C ATOM 0 H ILE A 124 -19.028 3.094 -19.061 1.00 0.00 H new ATOM 0 HA ILE A 124 -17.968 3.094 -16.326 1.00 0.00 H new ATOM 0 HB ILE A 124 -16.378 2.095 -18.338 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -15.436 3.681 -15.898 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -15.942 2.004 -15.881 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -14.625 3.789 -18.868 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -16.207 4.194 -19.575 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -15.638 5.044 -18.119 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -13.516 2.188 -15.832 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -14.053 1.405 -17.337 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -13.540 3.109 -17.355 1.00 0.00 H new ATOM 2011 N PHE A 125 -17.673 5.637 -16.515 1.00 0.00 N ATOM 2012 CA PHE A 125 -17.747 7.104 -16.485 1.00 0.00 C ATOM 2013 C PHE A 125 -16.324 7.667 -16.590 1.00 0.00 C ATOM 2014 O PHE A 125 -15.405 7.163 -15.928 1.00 0.00 O ATOM 2015 CB PHE A 125 -18.439 7.574 -15.173 1.00 0.00 C ATOM 2016 CG PHE A 125 -18.407 9.089 -14.939 1.00 0.00 C ATOM 2017 CD1 PHE A 125 -19.130 9.955 -15.756 1.00 0.00 C ATOM 2018 CD2 PHE A 125 -17.640 9.645 -13.905 1.00 0.00 C ATOM 2019 CE1 PHE A 125 -19.083 11.324 -15.562 1.00 0.00 C ATOM 2020 CE2 PHE A 125 -17.593 11.016 -13.715 1.00 0.00 C ATOM 2021 CZ PHE A 125 -18.318 11.853 -14.537 1.00 0.00 C ATOM 0 H PHE A 125 -17.233 5.243 -15.683 1.00 0.00 H new ATOM 0 HA PHE A 125 -18.340 7.470 -17.323 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -19.478 7.244 -15.188 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -17.960 7.079 -14.328 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -19.737 9.552 -16.553 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -17.079 8.996 -13.249 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -19.644 11.980 -16.211 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -16.988 11.430 -12.922 1.00 0.00 H new ATOM 0 HZ PHE A 125 -18.289 12.921 -14.381 1.00 0.00 H new ATOM 2031 N LEU A 126 -16.155 8.702 -17.427 1.00 0.00 N ATOM 2032 CA LEU A 126 -14.879 9.404 -17.589 1.00 0.00 C ATOM 2033 C LEU A 126 -14.861 10.588 -16.599 1.00 0.00 C ATOM 2034 O LEU A 126 -15.664 11.522 -16.725 1.00 0.00 O ATOM 2035 CB LEU A 126 -14.702 9.916 -19.052 1.00 0.00 C ATOM 2036 CG LEU A 126 -13.235 9.990 -19.623 1.00 0.00 C ATOM 2037 CD1 LEU A 126 -13.164 10.892 -20.863 1.00 0.00 C ATOM 2038 CD2 LEU A 126 -12.172 10.408 -18.576 1.00 0.00 C ATOM 0 H LEU A 126 -16.904 9.074 -18.011 1.00 0.00 H new ATOM 0 HA LEU A 126 -14.054 8.722 -17.383 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -15.286 9.270 -19.708 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -15.138 10.913 -19.115 1.00 0.00 H new ATOM 0 HG LEU A 126 -12.985 8.969 -19.913 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -12.139 10.922 -21.233 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -13.818 10.495 -21.639 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -13.484 11.900 -20.599 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -11.189 10.436 -19.046 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -12.415 11.396 -18.185 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -12.163 9.687 -17.759 1.00 0.00 H new ATOM 2050 N GLU A 127 -13.960 10.524 -15.615 1.00 0.00 N ATOM 2051 CA GLU A 127 -13.755 11.600 -14.628 1.00 0.00 C ATOM 2052 C GLU A 127 -12.421 12.327 -14.905 1.00 0.00 C ATOM 2053 O GLU A 127 -11.507 11.751 -15.502 1.00 0.00 O ATOM 2054 CB GLU A 127 -13.777 11.003 -13.195 1.00 0.00 C ATOM 2055 CG GLU A 127 -13.621 12.020 -12.047 1.00 0.00 C ATOM 2056 CD GLU A 127 -14.791 13.020 -11.963 1.00 0.00 C ATOM 2057 OE1 GLU A 127 -14.729 14.095 -12.604 1.00 0.00 O ATOM 2058 OE2 GLU A 127 -15.779 12.736 -11.259 1.00 0.00 O ATOM 0 H GLU A 127 -13.346 9.721 -15.476 1.00 0.00 H new ATOM 0 HA GLU A 127 -14.561 12.329 -14.712 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -14.717 10.469 -13.058 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -12.977 10.267 -13.115 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -13.541 11.483 -11.102 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -12.689 12.570 -12.181 1.00 0.00 H new ATOM 2065 N THR A 128 -12.340 13.599 -14.473 1.00 0.00 N ATOM 2066 CA THR A 128 -11.151 14.444 -14.619 1.00 0.00 C ATOM 2067 C THR A 128 -10.555 14.693 -13.202 1.00 0.00 C ATOM 2068 O THR A 128 -9.801 13.840 -12.706 1.00 0.00 O ATOM 2069 CB THR A 128 -11.545 15.800 -15.322 1.00 0.00 C ATOM 2070 OG1 THR A 128 -12.566 15.555 -16.281 1.00 0.00 O ATOM 2071 CG2 THR A 128 -10.365 16.477 -16.032 1.00 0.00 C ATOM 2072 OXT THR A 128 -10.885 15.719 -12.567 1.00 0.00 O ATOM 0 H THR A 128 -13.114 14.072 -14.006 1.00 0.00 H new ATOM 0 HA THR A 128 -10.402 13.955 -15.242 1.00 0.00 H new ATOM 0 HB THR A 128 -11.887 16.472 -14.535 1.00 0.00 H new ATOM 0 HG1 THR A 128 -12.195 15.046 -17.031 1.00 0.00 H new ATOM 0 HG21 THR A 128 -10.702 17.404 -16.495 1.00 0.00 H new ATOM 0 HG22 THR A 128 -9.582 16.698 -15.307 1.00 0.00 H new ATOM 0 HG23 THR A 128 -9.971 15.811 -16.799 1.00 0.00 H new TER 2080 THR A 128