USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 891 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 112 HIS : no HD1:sc= 0.0831 K(o=0.49,f=-5!) USER MOD Set 1.2: A 114 HIS : no HD1:sc= 0.411 K(o=0.49,f=-1.7) USER MOD Set 2.1: A 90 SER OG : rot -117:sc= 0.49 USER MOD Set 2.2: A 93 THR OG1 : rot 180:sc= 0.466 USER MOD Set 3.1: A 34 GLN : amide:sc= 0.628 K(o=1.2,f=-0.17) USER MOD Set 3.2: A 68 THR OG1 : rot -140:sc= 0.561 USER MOD Set 4.1: A 44 SER OG : rot 150:sc= 0.357 USER MOD Set 4.2: A 51 SER OG : rot 178:sc= 0.39 USER MOD Set 5.1: A 25 LYS NZ :NH3+ 172:sc= 3.68 (180deg=2.28) USER MOD Set 5.2: A 111 HIS : no HD1:sc= 0.977 K(o=4.7,f=-3.5) USER MOD Single : A 1 ASP N :NH3+ 174:sc= 0.268 (180deg=0.254) USER MOD Single : A 5 LYS NZ :NH3+ 162:sc= 2.1 (180deg=1.6) USER MOD Single : A 7 GLN : amide:sc= 1.81 K(o=1.8,f=-4.1!) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= 0.35 K(o=0.35,f=-3.7!) USER MOD Single : A 15 LYS NZ :NH3+ 170:sc= 0.908 (180deg=0.876) USER MOD Single : A 18 LYS NZ :NH3+ -132:sc= 0.9 (180deg=-0.0318) USER MOD Single : A 22 LYS NZ :NH3+ -161:sc= 0.95 (180deg=0.733) USER MOD Single : A 24 LYS NZ :NH3+ 165:sc= 1.24 (180deg=1.2) USER MOD Single : A 27 GLN : amide:sc= -0.342 K(o=-0.34,f=-5.1!) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0.734 K(o=0.73,f=-0.45) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ -155:sc= 0.821 (180deg=0.293) USER MOD Single : A 42 ASN : amide:sc= 0.802 K(o=0.8,f=-0.19) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 LYS NZ :NH3+ 157:sc= 2.18 (180deg=1.47) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 83:sc= 0.0301 USER MOD Single : A 61 SER OG : rot 180:sc= 0.00142 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HD1:sc= 0.577 K(o=0.58,f=-2.2!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 80:sc= 0 USER MOD Single : A 84 ASN : amide:sc= 0.933 K(o=0.93,f=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot -140:sc= 0.193 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.0498 X(o=-0.05,f=-0.05) USER MOD Single : A 103 ASN : amide:sc= -0.0342 X(o=-0.034,f=-0.053) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 113 HIS : no HD1:sc=-0.00777 X(o=-0.0078,f=-0.0078) USER MOD Single : A 115 HIS : no HD1:sc= 0.976 K(o=0.98,f=-3!) USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 1.230 -1.916 1.125 1.00 0.00 N ATOM 2 CA ASP A 1 1.321 -3.289 1.689 1.00 0.00 C ATOM 3 C ASP A 1 2.334 -4.139 0.910 1.00 0.00 C ATOM 4 O ASP A 1 3.527 -4.028 1.196 1.00 0.00 O ATOM 5 CB ASP A 1 -0.063 -3.946 1.828 1.00 0.00 C ATOM 6 CG ASP A 1 -0.908 -3.314 2.947 1.00 0.00 C ATOM 7 OD1 ASP A 1 -0.820 -2.076 3.129 1.00 0.00 O ATOM 8 OD2 ASP A 1 -1.628 -4.062 3.652 1.00 0.00 O ATOM 0 H1 ASP A 1 0.468 -1.394 1.603 1.00 0.00 H new ATOM 0 H2 ASP A 1 2.133 -1.420 1.270 1.00 0.00 H new ATOM 0 H3 ASP A 1 1.026 -1.972 0.107 1.00 0.00 H new ATOM 0 HA ASP A 1 1.705 -3.215 2.706 1.00 0.00 H new ATOM 0 HB2 ASP A 1 -0.598 -3.861 0.882 1.00 0.00 H new ATOM 0 HB3 ASP A 1 0.062 -5.010 2.029 1.00 0.00 H new ATOM 15 N VAL A 2 1.914 -4.951 -0.072 1.00 0.00 N ATOM 16 CA VAL A 2 2.787 -5.877 -0.826 1.00 0.00 C ATOM 17 C VAL A 2 2.593 -5.807 -2.320 1.00 0.00 C ATOM 18 O VAL A 2 1.484 -5.623 -2.798 1.00 0.00 O ATOM 19 CB VAL A 2 2.556 -7.333 -0.396 1.00 0.00 C ATOM 20 CG1 VAL A 2 2.844 -8.471 -1.396 1.00 0.00 C ATOM 21 CG2 VAL A 2 3.408 -7.617 0.814 1.00 0.00 C ATOM 0 H VAL A 2 0.940 -4.987 -0.374 1.00 0.00 H new ATOM 0 HA VAL A 2 3.802 -5.555 -0.592 1.00 0.00 H new ATOM 0 HB VAL A 2 1.477 -7.359 -0.246 1.00 0.00 H new ATOM 0 HG11 VAL A 2 2.627 -9.431 -0.927 1.00 0.00 H new ATOM 0 HG12 VAL A 2 2.216 -8.348 -2.278 1.00 0.00 H new ATOM 0 HG13 VAL A 2 3.893 -8.440 -1.690 1.00 0.00 H new ATOM 0 HG21 VAL A 2 3.255 -8.648 1.132 1.00 0.00 H new ATOM 0 HG22 VAL A 2 4.458 -7.466 0.563 1.00 0.00 H new ATOM 0 HG23 VAL A 2 3.128 -6.942 1.623 1.00 0.00 H new ATOM 31 N ILE A 3 3.689 -6.087 -3.016 1.00 0.00 N ATOM 32 CA ILE A 3 3.834 -6.424 -4.425 1.00 0.00 C ATOM 33 C ILE A 3 4.645 -7.733 -4.438 1.00 0.00 C ATOM 34 O ILE A 3 5.848 -7.741 -4.165 1.00 0.00 O ATOM 35 CB ILE A 3 4.433 -5.231 -5.206 1.00 0.00 C ATOM 36 CG1 ILE A 3 3.266 -4.337 -5.684 1.00 0.00 C ATOM 37 CG2 ILE A 3 5.328 -5.639 -6.385 1.00 0.00 C ATOM 38 CD1 ILE A 3 2.547 -4.842 -6.940 1.00 0.00 C ATOM 0 H ILE A 3 4.598 -6.082 -2.553 1.00 0.00 H new ATOM 0 HA ILE A 3 2.895 -6.600 -4.949 1.00 0.00 H new ATOM 0 HB ILE A 3 5.094 -4.689 -4.530 1.00 0.00 H new ATOM 0 HG12 ILE A 3 2.539 -4.249 -4.876 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.649 -3.335 -5.879 1.00 0.00 H new ATOM 0 HG21 ILE A 3 5.708 -4.745 -6.880 1.00 0.00 H new ATOM 0 HG22 ILE A 3 6.164 -6.234 -6.018 1.00 0.00 H new ATOM 0 HG23 ILE A 3 4.748 -6.228 -7.095 1.00 0.00 H new ATOM 0 HD11 ILE A 3 1.744 -4.153 -7.201 1.00 0.00 H new ATOM 0 HD12 ILE A 3 3.256 -4.903 -7.766 1.00 0.00 H new ATOM 0 HD13 ILE A 3 2.129 -5.830 -6.747 1.00 0.00 H new ATOM 50 N ILE A 4 3.953 -8.865 -4.594 1.00 0.00 N ATOM 51 CA ILE A 4 4.484 -10.222 -4.462 1.00 0.00 C ATOM 52 C ILE A 4 5.477 -10.534 -5.602 1.00 0.00 C ATOM 53 O ILE A 4 5.332 -10.054 -6.737 1.00 0.00 O ATOM 54 CB ILE A 4 3.275 -11.198 -4.460 1.00 0.00 C ATOM 55 CG1 ILE A 4 3.328 -12.329 -3.427 1.00 0.00 C ATOM 56 CG2 ILE A 4 3.006 -11.822 -5.823 1.00 0.00 C ATOM 57 CD1 ILE A 4 4.577 -13.218 -3.410 1.00 0.00 C ATOM 0 H ILE A 4 2.960 -8.858 -4.827 1.00 0.00 H new ATOM 0 HA ILE A 4 5.043 -10.331 -3.533 1.00 0.00 H new ATOM 0 HB ILE A 4 2.460 -10.532 -4.175 1.00 0.00 H new ATOM 0 HG12 ILE A 4 3.218 -11.885 -2.437 1.00 0.00 H new ATOM 0 HG13 ILE A 4 2.461 -12.971 -3.587 1.00 0.00 H new ATOM 0 HG21 ILE A 4 2.150 -12.493 -5.753 1.00 0.00 H new ATOM 0 HG22 ILE A 4 2.793 -11.036 -6.547 1.00 0.00 H new ATOM 0 HG23 ILE A 4 3.882 -12.384 -6.145 1.00 0.00 H new ATOM 0 HD11 ILE A 4 4.476 -13.973 -2.630 1.00 0.00 H new ATOM 0 HD12 ILE A 4 4.688 -13.708 -4.377 1.00 0.00 H new ATOM 0 HD13 ILE A 4 5.457 -12.606 -3.210 1.00 0.00 H new ATOM 69 N LYS A 5 6.473 -11.378 -5.313 1.00 0.00 N ATOM 70 CA LYS A 5 7.535 -11.803 -6.245 1.00 0.00 C ATOM 71 C LYS A 5 7.956 -13.258 -6.045 1.00 0.00 C ATOM 72 O LYS A 5 7.777 -13.802 -4.951 1.00 0.00 O ATOM 73 CB LYS A 5 8.722 -10.863 -6.051 1.00 0.00 C ATOM 74 CG LYS A 5 8.356 -9.458 -6.535 1.00 0.00 C ATOM 75 CD LYS A 5 9.568 -8.629 -6.904 1.00 0.00 C ATOM 76 CE LYS A 5 9.006 -7.255 -7.280 1.00 0.00 C ATOM 77 NZ LYS A 5 10.032 -6.188 -7.356 1.00 0.00 N ATOM 0 H LYS A 5 6.570 -11.802 -4.391 1.00 0.00 H new ATOM 0 HA LYS A 5 7.153 -11.747 -7.264 1.00 0.00 H new ATOM 0 HB2 LYS A 5 9.005 -10.833 -4.999 1.00 0.00 H new ATOM 0 HB3 LYS A 5 9.585 -11.234 -6.603 1.00 0.00 H new ATOM 0 HG2 LYS A 5 7.699 -9.537 -7.401 1.00 0.00 H new ATOM 0 HG3 LYS A 5 7.795 -8.945 -5.754 1.00 0.00 H new ATOM 0 HD2 LYS A 5 10.265 -8.556 -6.070 1.00 0.00 H new ATOM 0 HD3 LYS A 5 10.113 -9.074 -7.736 1.00 0.00 H new ATOM 0 HE2 LYS A 5 8.502 -7.331 -8.244 1.00 0.00 H new ATOM 0 HE3 LYS A 5 8.252 -6.969 -6.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 9.656 -5.383 -7.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 10.279 -5.875 -6.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 10.881 -6.556 -7.830 1.00 0.00 H new ATOM 91 N PRO A 6 8.517 -13.885 -7.091 1.00 0.00 N ATOM 92 CA PRO A 6 8.947 -15.275 -7.039 1.00 0.00 C ATOM 93 C PRO A 6 10.306 -15.431 -6.329 1.00 0.00 C ATOM 94 O PRO A 6 11.088 -14.487 -6.258 1.00 0.00 O ATOM 95 CB PRO A 6 9.000 -15.682 -8.515 1.00 0.00 C ATOM 96 CG PRO A 6 9.391 -14.403 -9.253 1.00 0.00 C ATOM 97 CD PRO A 6 8.752 -13.307 -8.416 1.00 0.00 C ATOM 0 HA PRO A 6 8.277 -15.909 -6.458 1.00 0.00 H new ATOM 0 HB2 PRO A 6 9.729 -16.475 -8.682 1.00 0.00 H new ATOM 0 HB3 PRO A 6 8.036 -16.058 -8.857 1.00 0.00 H new ATOM 0 HG2 PRO A 6 10.473 -14.286 -9.310 1.00 0.00 H new ATOM 0 HG3 PRO A 6 9.016 -14.398 -10.276 1.00 0.00 H new ATOM 0 HD2 PRO A 6 9.406 -12.437 -8.350 1.00 0.00 H new ATOM 0 HD3 PRO A 6 7.817 -12.970 -8.865 1.00 0.00 H new ATOM 105 N GLN A 7 10.623 -16.633 -5.834 1.00 0.00 N ATOM 106 CA GLN A 7 11.913 -16.922 -5.184 1.00 0.00 C ATOM 107 C GLN A 7 12.987 -17.489 -6.136 1.00 0.00 C ATOM 108 O GLN A 7 14.149 -17.611 -5.749 1.00 0.00 O ATOM 109 CB GLN A 7 11.713 -17.747 -3.908 1.00 0.00 C ATOM 110 CG GLN A 7 11.508 -19.250 -4.093 1.00 0.00 C ATOM 111 CD GLN A 7 10.138 -19.637 -4.634 1.00 0.00 C ATOM 112 OE1 GLN A 7 9.764 -19.318 -5.752 1.00 0.00 O ATOM 113 NE2 GLN A 7 9.334 -20.333 -3.860 1.00 0.00 N ATOM 0 H GLN A 7 9.994 -17.435 -5.871 1.00 0.00 H new ATOM 0 HA GLN A 7 12.332 -15.963 -4.879 1.00 0.00 H new ATOM 0 HB2 GLN A 7 12.581 -17.598 -3.266 1.00 0.00 H new ATOM 0 HB3 GLN A 7 10.850 -17.348 -3.375 1.00 0.00 H new ATOM 0 HG2 GLN A 7 12.273 -19.628 -4.772 1.00 0.00 H new ATOM 0 HG3 GLN A 7 11.660 -19.746 -3.134 1.00 0.00 H new ATOM 0 HE21 GLN A 7 9.636 -20.605 -2.924 1.00 0.00 H new ATOM 0 HE22 GLN A 7 8.409 -20.601 -4.195 1.00 0.00 H new ATOM 122 N VAL A 8 12.607 -17.782 -7.386 1.00 0.00 N ATOM 123 CA VAL A 8 13.499 -18.164 -8.499 1.00 0.00 C ATOM 124 C VAL A 8 13.076 -17.449 -9.782 1.00 0.00 C ATOM 125 O VAL A 8 11.912 -17.069 -9.932 1.00 0.00 O ATOM 126 CB VAL A 8 13.516 -19.696 -8.752 1.00 0.00 C ATOM 127 CG1 VAL A 8 13.982 -20.475 -7.523 1.00 0.00 C ATOM 128 CG2 VAL A 8 12.158 -20.265 -9.195 1.00 0.00 C ATOM 0 H VAL A 8 11.627 -17.760 -7.666 1.00 0.00 H new ATOM 0 HA VAL A 8 14.506 -17.863 -8.211 1.00 0.00 H new ATOM 0 HB VAL A 8 14.225 -19.824 -9.570 1.00 0.00 H new ATOM 0 HG11 VAL A 8 13.978 -21.542 -7.746 1.00 0.00 H new ATOM 0 HG12 VAL A 8 14.992 -20.164 -7.256 1.00 0.00 H new ATOM 0 HG13 VAL A 8 13.309 -20.276 -6.689 1.00 0.00 H new ATOM 0 HG21 VAL A 8 12.248 -21.340 -9.353 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.413 -20.072 -8.423 1.00 0.00 H new ATOM 0 HG23 VAL A 8 11.849 -19.787 -10.124 1.00 0.00 H new ATOM 138 N SER A 9 14.011 -17.261 -10.715 1.00 0.00 N ATOM 139 CA SER A 9 13.677 -16.809 -12.069 1.00 0.00 C ATOM 140 C SER A 9 13.208 -17.993 -12.943 1.00 0.00 C ATOM 141 O SER A 9 13.530 -19.150 -12.663 1.00 0.00 O ATOM 142 CB SER A 9 14.888 -16.106 -12.693 1.00 0.00 C ATOM 143 OG SER A 9 16.018 -16.960 -12.807 1.00 0.00 O ATOM 0 H SER A 9 15.007 -17.415 -10.559 1.00 0.00 H new ATOM 0 HA SER A 9 12.853 -16.098 -12.012 1.00 0.00 H new ATOM 0 HB2 SER A 9 14.618 -15.734 -13.681 1.00 0.00 H new ATOM 0 HB3 SER A 9 15.152 -15.239 -12.087 1.00 0.00 H new ATOM 0 HG SER A 9 16.762 -16.466 -13.211 1.00 0.00 H new ATOM 149 N GLY A 10 12.425 -17.725 -13.989 1.00 0.00 N ATOM 150 CA GLY A 10 11.815 -18.739 -14.858 1.00 0.00 C ATOM 151 C GLY A 10 10.591 -18.169 -15.544 1.00 0.00 C ATOM 152 O GLY A 10 10.516 -16.962 -15.745 1.00 0.00 O ATOM 0 H GLY A 10 12.190 -16.772 -14.265 1.00 0.00 H new ATOM 0 HA2 GLY A 10 12.537 -19.072 -15.603 1.00 0.00 H new ATOM 0 HA3 GLY A 10 11.537 -19.614 -14.270 1.00 0.00 H new ATOM 156 N VAL A 11 9.606 -18.996 -15.892 1.00 0.00 N ATOM 157 CA VAL A 11 8.386 -18.559 -16.533 1.00 0.00 C ATOM 158 C VAL A 11 7.144 -19.146 -15.881 1.00 0.00 C ATOM 159 O VAL A 11 7.187 -20.294 -15.462 1.00 0.00 O ATOM 160 CB VAL A 11 8.425 -18.961 -18.001 1.00 0.00 C ATOM 161 CG1 VAL A 11 9.690 -18.594 -18.773 1.00 0.00 C ATOM 162 CG2 VAL A 11 8.012 -20.377 -18.383 1.00 0.00 C ATOM 0 H VAL A 11 9.643 -20.002 -15.730 1.00 0.00 H new ATOM 0 HA VAL A 11 8.326 -17.476 -16.428 1.00 0.00 H new ATOM 0 HB VAL A 11 7.610 -18.310 -18.319 1.00 0.00 H new ATOM 0 HG11 VAL A 11 9.597 -18.932 -19.805 1.00 0.00 H new ATOM 0 HG12 VAL A 11 9.825 -17.513 -18.756 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.551 -19.075 -18.309 1.00 0.00 H new ATOM 0 HG21 VAL A 11 8.096 -20.502 -19.463 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.664 -21.093 -17.883 1.00 0.00 H new ATOM 0 HG23 VAL A 11 6.980 -20.550 -18.077 1.00 0.00 H new ATOM 172 N ILE A 12 6.030 -18.418 -15.827 1.00 0.00 N ATOM 173 CA ILE A 12 4.791 -18.914 -15.196 1.00 0.00 C ATOM 174 C ILE A 12 4.246 -20.172 -15.903 1.00 0.00 C ATOM 175 O ILE A 12 4.293 -20.277 -17.126 1.00 0.00 O ATOM 176 CB ILE A 12 3.710 -17.820 -15.183 1.00 0.00 C ATOM 177 CG1 ILE A 12 4.195 -16.415 -14.768 1.00 0.00 C ATOM 178 CG2 ILE A 12 2.486 -18.203 -14.341 1.00 0.00 C ATOM 179 CD1 ILE A 12 4.903 -16.301 -13.414 1.00 0.00 C ATOM 0 H ILE A 12 5.952 -17.477 -16.213 1.00 0.00 H new ATOM 0 HA ILE A 12 5.044 -19.185 -14.171 1.00 0.00 H new ATOM 0 HB ILE A 12 3.425 -17.754 -16.233 1.00 0.00 H new ATOM 0 HG12 ILE A 12 4.874 -16.049 -15.538 1.00 0.00 H new ATOM 0 HG13 ILE A 12 3.334 -15.747 -14.758 1.00 0.00 H new ATOM 0 HG21 ILE A 12 1.757 -17.393 -14.369 1.00 0.00 H new ATOM 0 HG22 ILE A 12 2.036 -19.110 -14.745 1.00 0.00 H new ATOM 0 HG23 ILE A 12 2.794 -18.378 -13.310 1.00 0.00 H new ATOM 0 HD11 ILE A 12 5.193 -15.265 -13.241 1.00 0.00 H new ATOM 0 HD12 ILE A 12 4.228 -16.626 -12.622 1.00 0.00 H new ATOM 0 HD13 ILE A 12 5.792 -16.932 -13.414 1.00 0.00 H new ATOM 191 N VAL A 13 3.638 -21.082 -15.138 1.00 0.00 N ATOM 192 CA VAL A 13 3.053 -22.364 -15.579 1.00 0.00 C ATOM 193 C VAL A 13 1.588 -22.491 -15.147 1.00 0.00 C ATOM 194 O VAL A 13 0.768 -23.027 -15.896 1.00 0.00 O ATOM 195 CB VAL A 13 3.837 -23.553 -14.987 1.00 0.00 C ATOM 196 CG1 VAL A 13 3.329 -24.911 -15.479 1.00 0.00 C ATOM 197 CG2 VAL A 13 5.327 -23.472 -15.323 1.00 0.00 C ATOM 0 H VAL A 13 3.531 -20.941 -14.133 1.00 0.00 H new ATOM 0 HA VAL A 13 3.111 -22.380 -16.667 1.00 0.00 H new ATOM 0 HB VAL A 13 3.681 -23.480 -13.911 1.00 0.00 H new ATOM 0 HG11 VAL A 13 3.921 -25.707 -15.027 1.00 0.00 H new ATOM 0 HG12 VAL A 13 2.283 -25.032 -15.197 1.00 0.00 H new ATOM 0 HG13 VAL A 13 3.421 -24.962 -16.564 1.00 0.00 H new ATOM 0 HG21 VAL A 13 5.845 -24.327 -14.888 1.00 0.00 H new ATOM 0 HG22 VAL A 13 5.457 -23.481 -16.405 1.00 0.00 H new ATOM 0 HG23 VAL A 13 5.742 -22.551 -14.915 1.00 0.00 H new ATOM 207 N ASN A 14 1.237 -21.976 -13.962 1.00 0.00 N ATOM 208 CA ASN A 14 -0.127 -21.989 -13.437 1.00 0.00 C ATOM 209 C ASN A 14 -0.387 -20.759 -12.557 1.00 0.00 C ATOM 210 O ASN A 14 0.545 -20.173 -11.995 1.00 0.00 O ATOM 211 CB ASN A 14 -0.368 -23.293 -12.643 1.00 0.00 C ATOM 212 CG ASN A 14 -1.837 -23.700 -12.537 1.00 0.00 C ATOM 213 OD1 ASN A 14 -2.744 -23.036 -13.015 1.00 0.00 O ATOM 214 ND2 ASN A 14 -2.115 -24.802 -11.878 1.00 0.00 N ATOM 0 H ASN A 14 1.907 -21.532 -13.334 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.825 -21.951 -14.273 1.00 0.00 H new ATOM 0 HB2 ASN A 14 0.188 -24.102 -13.117 1.00 0.00 H new ATOM 0 HB3 ASN A 14 0.038 -23.174 -11.638 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -3.084 -25.099 -11.768 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -1.361 -25.360 -11.477 1.00 0.00 H new ATOM 221 N LYS A 15 -1.675 -20.441 -12.400 1.00 0.00 N ATOM 222 CA LYS A 15 -2.247 -19.324 -11.660 1.00 0.00 C ATOM 223 C LYS A 15 -3.251 -19.899 -10.665 1.00 0.00 C ATOM 224 O LYS A 15 -4.408 -20.157 -10.995 1.00 0.00 O ATOM 225 CB LYS A 15 -2.933 -18.360 -12.643 1.00 0.00 C ATOM 226 CG LYS A 15 -1.983 -17.703 -13.659 1.00 0.00 C ATOM 227 CD LYS A 15 -1.267 -16.452 -13.150 1.00 0.00 C ATOM 228 CE LYS A 15 -2.213 -15.250 -13.042 1.00 0.00 C ATOM 229 NZ LYS A 15 -2.701 -14.753 -14.360 1.00 0.00 N ATOM 0 H LYS A 15 -2.404 -21.012 -12.827 1.00 0.00 H new ATOM 0 HA LYS A 15 -1.479 -18.766 -11.125 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -3.706 -18.904 -13.186 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.434 -17.577 -12.074 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -1.234 -18.435 -13.962 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -2.552 -17.441 -14.551 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -0.829 -16.657 -12.173 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -0.445 -16.207 -13.822 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -3.070 -15.527 -12.428 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -1.699 -14.439 -12.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -3.460 -14.058 -14.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -1.916 -14.304 -14.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -3.068 -15.551 -14.918 1.00 0.00 H new ATOM 243 N LEU A 16 -2.788 -20.141 -9.445 1.00 0.00 N ATOM 244 CA LEU A 16 -3.587 -20.742 -8.381 1.00 0.00 C ATOM 245 C LEU A 16 -4.642 -19.774 -7.843 1.00 0.00 C ATOM 246 O LEU A 16 -5.809 -20.126 -7.659 1.00 0.00 O ATOM 247 CB LEU A 16 -2.655 -21.179 -7.256 1.00 0.00 C ATOM 248 CG LEU A 16 -1.829 -22.444 -7.544 1.00 0.00 C ATOM 249 CD1 LEU A 16 -2.528 -23.526 -8.368 1.00 0.00 C ATOM 250 CD2 LEU A 16 -0.500 -22.141 -8.220 1.00 0.00 C ATOM 0 H LEU A 16 -1.833 -19.923 -9.161 1.00 0.00 H new ATOM 0 HA LEU A 16 -4.118 -21.601 -8.790 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.971 -20.360 -7.034 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -3.250 -21.349 -6.359 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.677 -22.840 -6.540 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -1.852 -24.370 -8.509 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.423 -23.861 -7.844 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -2.808 -23.119 -9.340 1.00 0.00 H new ATOM 0 HD21 LEU A 16 0.038 -23.072 -8.398 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.681 -21.639 -9.171 1.00 0.00 H new ATOM 0 HD23 LEU A 16 0.096 -21.494 -7.576 1.00 0.00 H new ATOM 262 N PHE A 17 -4.204 -18.544 -7.596 1.00 0.00 N ATOM 263 CA PHE A 17 -5.021 -17.438 -7.088 1.00 0.00 C ATOM 264 C PHE A 17 -5.988 -16.874 -8.151 1.00 0.00 C ATOM 265 O PHE A 17 -6.094 -17.399 -9.267 1.00 0.00 O ATOM 266 CB PHE A 17 -4.097 -16.366 -6.482 1.00 0.00 C ATOM 267 CG PHE A 17 -3.646 -15.255 -7.418 1.00 0.00 C ATOM 268 CD1 PHE A 17 -2.696 -15.485 -8.425 1.00 0.00 C ATOM 269 CD2 PHE A 17 -4.224 -13.978 -7.297 1.00 0.00 C ATOM 270 CE1 PHE A 17 -2.380 -14.460 -9.332 1.00 0.00 C ATOM 271 CE2 PHE A 17 -3.860 -12.937 -8.164 1.00 0.00 C ATOM 272 CZ PHE A 17 -2.936 -13.182 -9.181 1.00 0.00 C ATOM 0 H PHE A 17 -3.232 -18.275 -7.749 1.00 0.00 H new ATOM 0 HA PHE A 17 -5.673 -17.815 -6.300 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -4.611 -15.912 -5.635 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -3.210 -16.862 -6.088 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -2.210 -16.446 -8.502 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -4.958 -13.797 -6.526 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -1.704 -14.658 -10.151 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -4.291 -11.954 -8.046 1.00 0.00 H new ATOM 0 HZ PHE A 17 -2.649 -12.386 -9.852 1.00 0.00 H new ATOM 282 N LYS A 18 -6.699 -15.799 -7.794 1.00 0.00 N ATOM 283 CA LYS A 18 -7.609 -15.054 -8.679 1.00 0.00 C ATOM 284 C LYS A 18 -7.407 -13.548 -8.546 1.00 0.00 C ATOM 285 O LYS A 18 -7.354 -13.016 -7.438 1.00 0.00 O ATOM 286 CB LYS A 18 -9.062 -15.389 -8.363 1.00 0.00 C ATOM 287 CG LYS A 18 -9.420 -16.870 -8.489 1.00 0.00 C ATOM 288 CD LYS A 18 -9.399 -17.400 -9.936 1.00 0.00 C ATOM 289 CE LYS A 18 -9.381 -18.932 -10.030 1.00 0.00 C ATOM 290 NZ LYS A 18 -8.082 -19.511 -9.584 1.00 0.00 N ATOM 0 H LYS A 18 -6.658 -15.409 -6.852 1.00 0.00 H new ATOM 0 HA LYS A 18 -7.378 -15.352 -9.702 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -9.283 -15.061 -7.347 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -9.706 -14.816 -9.030 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -8.722 -17.454 -7.889 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -10.413 -17.030 -8.069 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -10.274 -17.022 -10.465 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -8.522 -17.003 -10.447 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -10.187 -19.341 -9.420 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -9.576 -19.233 -11.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -7.752 -20.204 -10.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -7.378 -18.752 -9.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -8.209 -19.982 -8.665 1.00 0.00 H new ATOM 304 N ALA A 19 -7.351 -12.875 -9.689 1.00 0.00 N ATOM 305 CA ALA A 19 -7.274 -11.427 -9.817 1.00 0.00 C ATOM 306 C ALA A 19 -8.433 -10.731 -9.078 1.00 0.00 C ATOM 307 O ALA A 19 -9.589 -10.807 -9.498 1.00 0.00 O ATOM 308 CB ALA A 19 -7.213 -11.094 -11.315 1.00 0.00 C ATOM 0 H ALA A 19 -7.358 -13.347 -10.593 1.00 0.00 H new ATOM 0 HA ALA A 19 -6.374 -11.043 -9.337 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -7.155 -10.013 -11.445 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -6.332 -11.561 -11.756 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.109 -11.471 -11.808 1.00 0.00 H new ATOM 314 N GLY A 20 -8.113 -10.077 -7.957 1.00 0.00 N ATOM 315 CA GLY A 20 -9.047 -9.293 -7.144 1.00 0.00 C ATOM 316 C GLY A 20 -9.631 -10.002 -5.902 1.00 0.00 C ATOM 317 O GLY A 20 -10.307 -9.344 -5.109 1.00 0.00 O ATOM 0 H GLY A 20 -7.166 -10.079 -7.579 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -8.537 -8.388 -6.814 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -9.875 -8.979 -7.780 1.00 0.00 H new ATOM 321 N ASP A 21 -9.433 -11.319 -5.731 1.00 0.00 N ATOM 322 CA ASP A 21 -10.060 -12.102 -4.647 1.00 0.00 C ATOM 323 C ASP A 21 -9.316 -12.047 -3.288 1.00 0.00 C ATOM 324 O ASP A 21 -8.353 -11.298 -3.098 1.00 0.00 O ATOM 325 CB ASP A 21 -10.226 -13.544 -5.156 1.00 0.00 C ATOM 326 CG ASP A 21 -11.552 -14.188 -4.710 1.00 0.00 C ATOM 327 OD1 ASP A 21 -11.705 -14.480 -3.503 1.00 0.00 O ATOM 328 OD2 ASP A 21 -12.447 -14.389 -5.565 1.00 0.00 O ATOM 0 H ASP A 21 -8.833 -11.875 -6.340 1.00 0.00 H new ATOM 0 HA ASP A 21 -11.026 -11.651 -4.419 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -10.174 -13.548 -6.245 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -9.394 -14.149 -4.795 1.00 0.00 H new ATOM 333 N LYS A 22 -9.758 -12.847 -2.309 1.00 0.00 N ATOM 334 CA LYS A 22 -9.046 -13.083 -1.044 1.00 0.00 C ATOM 335 C LYS A 22 -7.916 -14.110 -1.195 1.00 0.00 C ATOM 336 O LYS A 22 -7.896 -14.924 -2.123 1.00 0.00 O ATOM 337 CB LYS A 22 -10.033 -13.557 0.041 1.00 0.00 C ATOM 338 CG LYS A 22 -11.113 -12.531 0.425 1.00 0.00 C ATOM 339 CD LYS A 22 -10.532 -11.261 1.072 1.00 0.00 C ATOM 340 CE LYS A 22 -11.610 -10.245 1.466 1.00 0.00 C ATOM 341 NZ LYS A 22 -12.390 -10.665 2.663 1.00 0.00 N ATOM 0 H LYS A 22 -10.638 -13.359 -2.374 1.00 0.00 H new ATOM 0 HA LYS A 22 -8.596 -12.135 -0.748 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -10.523 -14.466 -0.306 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -9.468 -13.821 0.935 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -11.676 -12.253 -0.466 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -11.818 -12.994 1.116 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -9.961 -11.539 1.958 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.835 -10.792 0.378 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -11.140 -9.282 1.664 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -12.291 -10.101 0.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -13.284 -10.135 2.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -12.593 -11.683 2.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -11.838 -10.470 3.523 1.00 0.00 H new ATOM 355 N VAL A 23 -7.010 -14.100 -0.219 1.00 0.00 N ATOM 356 CA VAL A 23 -5.936 -15.088 -0.015 1.00 0.00 C ATOM 357 C VAL A 23 -5.789 -15.383 1.487 1.00 0.00 C ATOM 358 O VAL A 23 -5.913 -14.474 2.312 1.00 0.00 O ATOM 359 CB VAL A 23 -4.590 -14.618 -0.604 1.00 0.00 C ATOM 360 CG1 VAL A 23 -4.618 -14.644 -2.138 1.00 0.00 C ATOM 361 CG2 VAL A 23 -4.162 -13.214 -0.174 1.00 0.00 C ATOM 0 H VAL A 23 -6.999 -13.368 0.491 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.214 -15.999 -0.546 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.864 -15.326 -0.204 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.656 -14.308 -2.525 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.812 -15.660 -2.481 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.406 -13.983 -2.499 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -3.206 -12.968 -0.636 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.914 -12.491 -0.490 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -4.060 -13.181 0.911 1.00 0.00 H new ATOM 371 N LYS A 24 -5.536 -16.652 1.849 1.00 0.00 N ATOM 372 CA LYS A 24 -5.142 -17.058 3.216 1.00 0.00 C ATOM 373 C LYS A 24 -3.720 -16.586 3.557 1.00 0.00 C ATOM 374 O LYS A 24 -3.062 -15.947 2.740 1.00 0.00 O ATOM 375 CB LYS A 24 -5.308 -18.588 3.404 1.00 0.00 C ATOM 376 CG LYS A 24 -6.738 -19.014 3.764 1.00 0.00 C ATOM 377 CD LYS A 24 -7.429 -18.346 4.964 1.00 0.00 C ATOM 378 CE LYS A 24 -6.588 -18.212 6.214 1.00 0.00 C ATOM 379 NZ LYS A 24 -7.247 -17.350 7.220 1.00 0.00 N ATOM 0 H LYS A 24 -5.599 -17.435 1.198 1.00 0.00 H new ATOM 0 HA LYS A 24 -5.812 -16.566 3.921 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.008 -19.093 2.485 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -4.630 -18.924 4.188 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -7.363 -18.846 2.887 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -6.727 -20.089 3.946 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -7.760 -17.352 4.662 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -8.323 -18.918 5.210 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -6.408 -19.199 6.640 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -5.615 -17.794 5.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -6.785 -17.478 8.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.169 -16.355 6.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -8.251 -17.611 7.296 1.00 0.00 H new ATOM 393 N LYS A 25 -3.249 -16.934 4.764 1.00 0.00 N ATOM 394 CA LYS A 25 -1.965 -16.535 5.418 1.00 0.00 C ATOM 395 C LYS A 25 -0.678 -17.028 4.709 1.00 0.00 C ATOM 396 O LYS A 25 0.287 -17.408 5.364 1.00 0.00 O ATOM 397 CB LYS A 25 -1.928 -16.952 6.894 1.00 0.00 C ATOM 398 CG LYS A 25 -3.120 -16.507 7.747 1.00 0.00 C ATOM 399 CD LYS A 25 -2.957 -15.151 8.460 1.00 0.00 C ATOM 400 CE LYS A 25 -1.742 -15.105 9.398 1.00 0.00 C ATOM 401 NZ LYS A 25 -1.841 -13.972 10.355 1.00 0.00 N ATOM 0 H LYS A 25 -3.790 -17.552 5.368 1.00 0.00 H new ATOM 0 HA LYS A 25 -1.960 -15.448 5.333 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -1.857 -18.039 6.942 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -1.017 -16.553 7.341 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -4.003 -16.458 7.109 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -3.312 -17.272 8.499 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -2.861 -14.364 7.712 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -3.859 -14.938 9.033 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -1.669 -16.043 9.948 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -0.829 -15.008 8.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -1.080 -14.045 11.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -1.750 -13.073 9.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -2.762 -14.003 10.836 1.00 0.00 H new ATOM 415 N GLY A 26 -0.673 -17.089 3.383 1.00 0.00 N ATOM 416 CA GLY A 26 0.356 -17.764 2.589 1.00 0.00 C ATOM 417 C GLY A 26 -0.173 -18.836 1.642 1.00 0.00 C ATOM 418 O GLY A 26 0.528 -19.815 1.398 1.00 0.00 O ATOM 0 H GLY A 26 -1.402 -16.661 2.812 1.00 0.00 H new ATOM 0 HA2 GLY A 26 0.895 -17.017 2.006 1.00 0.00 H new ATOM 0 HA3 GLY A 26 1.078 -18.221 3.267 1.00 0.00 H new ATOM 422 N GLN A 27 -1.417 -18.721 1.161 1.00 0.00 N ATOM 423 CA GLN A 27 -1.913 -19.599 0.098 1.00 0.00 C ATOM 424 C GLN A 27 -1.015 -19.553 -1.150 1.00 0.00 C ATOM 425 O GLN A 27 -0.431 -18.523 -1.480 1.00 0.00 O ATOM 426 CB GLN A 27 -3.404 -19.396 -0.164 1.00 0.00 C ATOM 427 CG GLN A 27 -3.682 -18.519 -1.353 1.00 0.00 C ATOM 428 CD GLN A 27 -5.178 -18.335 -1.576 1.00 0.00 C ATOM 429 OE1 GLN A 27 -5.974 -18.293 -0.649 1.00 0.00 O ATOM 430 NE2 GLN A 27 -5.614 -18.280 -2.813 1.00 0.00 N ATOM 0 H GLN A 27 -2.094 -18.032 1.490 1.00 0.00 H new ATOM 0 HA GLN A 27 -1.840 -20.629 0.446 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -3.875 -20.367 -0.319 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -3.865 -18.956 0.720 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -3.213 -17.546 -1.206 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -3.232 -18.958 -2.243 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -4.953 -18.315 -3.589 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -6.614 -18.202 -2.998 1.00 0.00 H new ATOM 439 N THR A 28 -0.935 -20.673 -1.860 1.00 0.00 N ATOM 440 CA THR A 28 -0.215 -20.797 -3.134 1.00 0.00 C ATOM 441 C THR A 28 -0.873 -19.949 -4.226 1.00 0.00 C ATOM 442 O THR A 28 -2.096 -19.915 -4.359 1.00 0.00 O ATOM 443 CB THR A 28 -0.186 -22.269 -3.556 1.00 0.00 C ATOM 444 OG1 THR A 28 0.245 -23.073 -2.479 1.00 0.00 O ATOM 445 CG2 THR A 28 0.787 -22.529 -4.704 1.00 0.00 C ATOM 0 H THR A 28 -1.377 -21.543 -1.564 1.00 0.00 H new ATOM 0 HA THR A 28 0.803 -20.432 -2.997 1.00 0.00 H new ATOM 0 HB THR A 28 -1.201 -22.512 -3.871 1.00 0.00 H new ATOM 0 HG1 THR A 28 0.259 -24.013 -2.757 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.769 -23.587 -4.964 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.493 -21.937 -5.571 1.00 0.00 H new ATOM 0 HG23 THR A 28 1.795 -22.248 -4.398 1.00 0.00 H new ATOM 453 N LEU A 29 -0.048 -19.262 -5.018 1.00 0.00 N ATOM 454 CA LEU A 29 -0.418 -18.220 -5.979 1.00 0.00 C ATOM 455 C LEU A 29 0.032 -18.536 -7.413 1.00 0.00 C ATOM 456 O LEU A 29 -0.764 -18.413 -8.344 1.00 0.00 O ATOM 457 CB LEU A 29 0.220 -16.900 -5.543 1.00 0.00 C ATOM 458 CG LEU A 29 -0.140 -16.361 -4.149 1.00 0.00 C ATOM 459 CD1 LEU A 29 0.272 -14.901 -4.133 1.00 0.00 C ATOM 460 CD2 LEU A 29 -1.605 -16.427 -3.744 1.00 0.00 C ATOM 0 H LEU A 29 0.958 -19.428 -5.005 1.00 0.00 H new ATOM 0 HA LEU A 29 -1.506 -18.159 -5.987 1.00 0.00 H new ATOM 0 HB2 LEU A 29 1.303 -17.019 -5.588 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -0.047 -16.139 -6.277 1.00 0.00 H new ATOM 0 HG LEU A 29 0.377 -17.004 -3.437 1.00 0.00 H new ATOM 0 HD11 LEU A 29 0.037 -14.467 -3.161 1.00 0.00 H new ATOM 0 HD12 LEU A 29 1.344 -14.823 -4.316 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.269 -14.362 -4.911 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -1.724 -16.016 -2.741 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -2.203 -15.847 -4.447 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.939 -17.465 -3.753 1.00 0.00 H new ATOM 472 N PHE A 30 1.275 -19.000 -7.590 1.00 0.00 N ATOM 473 CA PHE A 30 1.860 -19.295 -8.914 1.00 0.00 C ATOM 474 C PHE A 30 2.728 -20.549 -8.927 1.00 0.00 C ATOM 475 O PHE A 30 3.163 -21.051 -7.886 1.00 0.00 O ATOM 476 CB PHE A 30 2.729 -18.119 -9.418 1.00 0.00 C ATOM 477 CG PHE A 30 2.110 -16.746 -9.348 1.00 0.00 C ATOM 478 CD1 PHE A 30 2.178 -15.986 -8.161 1.00 0.00 C ATOM 479 CD2 PHE A 30 1.473 -16.233 -10.485 1.00 0.00 C ATOM 480 CE1 PHE A 30 1.534 -14.741 -8.082 1.00 0.00 C ATOM 481 CE2 PHE A 30 0.847 -14.984 -10.412 1.00 0.00 C ATOM 482 CZ PHE A 30 0.824 -14.265 -9.204 1.00 0.00 C ATOM 0 H PHE A 30 1.912 -19.184 -6.815 1.00 0.00 H new ATOM 0 HA PHE A 30 1.004 -19.456 -9.569 1.00 0.00 H new ATOM 0 HB2 PHE A 30 3.653 -18.106 -8.841 1.00 0.00 H new ATOM 0 HB3 PHE A 30 3.003 -18.317 -10.454 1.00 0.00 H new ATOM 0 HD1 PHE A 30 2.727 -16.363 -7.311 1.00 0.00 H new ATOM 0 HD2 PHE A 30 1.465 -16.795 -11.407 1.00 0.00 H new ATOM 0 HE1 PHE A 30 1.582 -14.156 -7.175 1.00 0.00 H new ATOM 0 HE2 PHE A 30 0.377 -14.568 -11.291 1.00 0.00 H new ATOM 0 HZ PHE A 30 0.261 -13.346 -9.135 1.00 0.00 H new ATOM 492 N ILE A 31 3.026 -20.996 -10.146 1.00 0.00 N ATOM 493 CA ILE A 31 3.986 -22.062 -10.464 1.00 0.00 C ATOM 494 C ILE A 31 4.877 -21.534 -11.588 1.00 0.00 C ATOM 495 O ILE A 31 4.380 -20.861 -12.486 1.00 0.00 O ATOM 496 CB ILE A 31 3.271 -23.354 -10.884 1.00 0.00 C ATOM 497 CG1 ILE A 31 2.254 -23.728 -9.791 1.00 0.00 C ATOM 498 CG2 ILE A 31 4.284 -24.494 -11.156 1.00 0.00 C ATOM 499 CD1 ILE A 31 1.504 -25.037 -10.005 1.00 0.00 C ATOM 0 H ILE A 31 2.586 -20.609 -10.981 1.00 0.00 H new ATOM 0 HA ILE A 31 4.580 -22.316 -9.586 1.00 0.00 H new ATOM 0 HB ILE A 31 2.739 -23.195 -11.822 1.00 0.00 H new ATOM 0 HG12 ILE A 31 2.778 -23.783 -8.837 1.00 0.00 H new ATOM 0 HG13 ILE A 31 1.525 -22.922 -9.708 1.00 0.00 H new ATOM 0 HG21 ILE A 31 3.747 -25.395 -11.451 1.00 0.00 H new ATOM 0 HG22 ILE A 31 4.961 -24.196 -11.957 1.00 0.00 H new ATOM 0 HG23 ILE A 31 4.858 -24.694 -10.251 1.00 0.00 H new ATOM 0 HD11 ILE A 31 0.815 -25.201 -9.176 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.944 -24.987 -10.939 1.00 0.00 H new ATOM 0 HD13 ILE A 31 2.216 -25.861 -10.053 1.00 0.00 H new ATOM 511 N ILE A 32 6.170 -21.836 -11.548 1.00 0.00 N ATOM 512 CA ILE A 32 7.205 -21.406 -12.493 1.00 0.00 C ATOM 513 C ILE A 32 7.972 -22.579 -13.052 1.00 0.00 C ATOM 514 O ILE A 32 8.134 -23.571 -12.350 1.00 0.00 O ATOM 515 CB ILE A 32 8.158 -20.425 -11.768 1.00 0.00 C ATOM 516 CG1 ILE A 32 7.459 -19.062 -11.776 1.00 0.00 C ATOM 517 CG2 ILE A 32 9.576 -20.314 -12.364 1.00 0.00 C ATOM 518 CD1 ILE A 32 8.199 -18.004 -10.961 1.00 0.00 C ATOM 0 H ILE A 32 6.552 -22.426 -10.809 1.00 0.00 H new ATOM 0 HA ILE A 32 6.729 -20.909 -13.338 1.00 0.00 H new ATOM 0 HB ILE A 32 8.336 -20.808 -10.763 1.00 0.00 H new ATOM 0 HG12 ILE A 32 7.361 -18.717 -12.805 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.450 -19.176 -11.381 1.00 0.00 H new ATOM 0 HG21 ILE A 32 10.161 -19.602 -11.782 1.00 0.00 H new ATOM 0 HG22 ILE A 32 10.060 -21.290 -12.335 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.511 -19.972 -13.397 1.00 0.00 H new ATOM 0 HD11 ILE A 32 7.653 -17.062 -11.007 1.00 0.00 H new ATOM 0 HD12 ILE A 32 8.274 -18.330 -9.924 1.00 0.00 H new ATOM 0 HD13 ILE A 32 9.200 -17.864 -11.370 1.00 0.00 H new ATOM 530 N GLU A 33 8.487 -22.433 -14.276 1.00 0.00 N ATOM 531 CA GLU A 33 9.445 -23.359 -14.867 1.00 0.00 C ATOM 532 C GLU A 33 10.790 -22.654 -15.048 1.00 0.00 C ATOM 533 O GLU A 33 10.891 -21.666 -15.780 1.00 0.00 O ATOM 534 CB GLU A 33 8.877 -23.890 -16.192 1.00 0.00 C ATOM 535 CG GLU A 33 9.529 -25.218 -16.532 1.00 0.00 C ATOM 536 CD GLU A 33 8.825 -25.908 -17.708 1.00 0.00 C ATOM 537 OE1 GLU A 33 7.701 -26.441 -17.542 1.00 0.00 O ATOM 538 OE2 GLU A 33 9.390 -25.924 -18.824 1.00 0.00 O ATOM 0 H GLU A 33 8.244 -21.655 -14.890 1.00 0.00 H new ATOM 0 HA GLU A 33 9.613 -24.214 -14.212 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.797 -24.014 -16.112 1.00 0.00 H new ATOM 0 HB3 GLU A 33 9.057 -23.170 -16.991 1.00 0.00 H new ATOM 0 HG2 GLU A 33 10.578 -25.056 -16.779 1.00 0.00 H new ATOM 0 HG3 GLU A 33 9.504 -25.870 -15.659 1.00 0.00 H new ATOM 545 N GLN A 34 11.811 -23.124 -14.324 1.00 0.00 N ATOM 546 CA GLN A 34 13.142 -22.501 -14.281 1.00 0.00 C ATOM 547 C GLN A 34 13.848 -22.381 -15.627 1.00 0.00 C ATOM 548 O GLN A 34 14.646 -21.466 -15.822 1.00 0.00 O ATOM 549 CB GLN A 34 13.999 -23.200 -13.208 1.00 0.00 C ATOM 550 CG GLN A 34 13.578 -22.757 -11.789 1.00 0.00 C ATOM 551 CD GLN A 34 14.536 -23.235 -10.696 1.00 0.00 C ATOM 552 OE1 GLN A 34 15.755 -23.171 -10.817 1.00 0.00 O ATOM 553 NE2 GLN A 34 14.036 -23.682 -9.565 1.00 0.00 N ATOM 0 H GLN A 34 11.737 -23.959 -13.743 1.00 0.00 H new ATOM 0 HA GLN A 34 12.993 -21.459 -13.999 1.00 0.00 H new ATOM 0 HB2 GLN A 34 13.895 -24.281 -13.301 1.00 0.00 H new ATOM 0 HB3 GLN A 34 15.051 -22.966 -13.369 1.00 0.00 H new ATOM 0 HG2 GLN A 34 13.517 -21.669 -11.759 1.00 0.00 H new ATOM 0 HG3 GLN A 34 12.579 -23.138 -11.579 1.00 0.00 H new ATOM 0 HE21 GLN A 34 13.025 -23.743 -9.443 1.00 0.00 H new ATOM 0 HE22 GLN A 34 14.659 -23.967 -8.809 1.00 0.00 H new ATOM 562 N ASP A 35 13.504 -23.272 -16.544 1.00 0.00 N ATOM 563 CA ASP A 35 14.072 -23.461 -17.888 1.00 0.00 C ATOM 564 C ASP A 35 13.570 -24.798 -18.473 1.00 0.00 C ATOM 565 O ASP A 35 13.405 -25.786 -17.753 1.00 0.00 O ATOM 566 CB ASP A 35 15.607 -23.358 -17.808 1.00 0.00 C ATOM 567 CG ASP A 35 16.358 -24.147 -18.892 1.00 0.00 C ATOM 568 OD1 ASP A 35 16.141 -23.874 -20.100 1.00 0.00 O ATOM 569 OD2 ASP A 35 17.193 -25.010 -18.540 1.00 0.00 O ATOM 0 H ASP A 35 12.758 -23.943 -16.360 1.00 0.00 H new ATOM 0 HA ASP A 35 13.740 -22.679 -18.571 1.00 0.00 H new ATOM 0 HB2 ASP A 35 15.892 -22.308 -17.878 1.00 0.00 H new ATOM 0 HB3 ASP A 35 15.931 -23.712 -16.829 1.00 0.00 H new ATOM 574 N GLN A 36 13.279 -24.822 -19.773 1.00 0.00 N ATOM 575 CA GLN A 36 12.612 -25.945 -20.442 1.00 0.00 C ATOM 576 C GLN A 36 13.449 -27.215 -20.521 1.00 0.00 C ATOM 577 O GLN A 36 14.660 -27.149 -20.753 1.00 0.00 O ATOM 578 CB GLN A 36 12.208 -25.563 -21.862 1.00 0.00 C ATOM 579 CG GLN A 36 10.877 -24.832 -21.829 1.00 0.00 C ATOM 580 CD GLN A 36 10.883 -23.521 -21.053 1.00 0.00 C ATOM 581 OE1 GLN A 36 11.442 -22.515 -21.469 1.00 0.00 O ATOM 582 NE2 GLN A 36 10.272 -23.492 -19.893 1.00 0.00 N ATOM 0 H GLN A 36 13.502 -24.052 -20.403 1.00 0.00 H new ATOM 0 HA GLN A 36 11.742 -26.159 -19.821 1.00 0.00 H new ATOM 0 HB2 GLN A 36 12.972 -24.929 -22.311 1.00 0.00 H new ATOM 0 HB3 GLN A 36 12.130 -26.456 -22.482 1.00 0.00 H new ATOM 0 HG2 GLN A 36 10.565 -24.629 -22.854 1.00 0.00 H new ATOM 0 HG3 GLN A 36 10.127 -25.492 -21.392 1.00 0.00 H new ATOM 0 HE21 GLN A 36 9.805 -24.328 -19.542 1.00 0.00 H new ATOM 0 HE22 GLN A 36 10.264 -22.634 -19.342 1.00 0.00 H new ATOM 591 N ALA A 37 12.765 -28.367 -20.421 1.00 0.00 N ATOM 592 CA ALA A 37 13.344 -29.659 -20.770 1.00 0.00 C ATOM 593 C ALA A 37 12.688 -30.315 -21.999 1.00 0.00 C ATOM 594 O ALA A 37 13.318 -30.408 -23.058 1.00 0.00 O ATOM 595 CB ALA A 37 13.437 -30.569 -19.536 1.00 0.00 C ATOM 0 H ALA A 37 11.799 -28.421 -20.096 1.00 0.00 H new ATOM 0 HA ALA A 37 14.368 -29.481 -21.098 1.00 0.00 H new ATOM 0 HB1 ALA A 37 13.872 -31.527 -19.822 1.00 0.00 H new ATOM 0 HB2 ALA A 37 14.066 -30.096 -18.782 1.00 0.00 H new ATOM 0 HB3 ALA A 37 12.440 -30.731 -19.127 1.00 0.00 H new ATOM 601 N SER A 38 11.417 -30.714 -21.922 1.00 0.00 N ATOM 602 CA SER A 38 10.711 -31.369 -23.043 1.00 0.00 C ATOM 603 C SER A 38 10.589 -30.493 -24.295 1.00 0.00 C ATOM 604 O SER A 38 10.536 -31.007 -25.411 1.00 0.00 O ATOM 605 CB SER A 38 9.312 -31.837 -22.627 1.00 0.00 C ATOM 606 OG SER A 38 9.352 -32.488 -21.366 1.00 0.00 O ATOM 0 H SER A 38 10.843 -30.596 -21.087 1.00 0.00 H new ATOM 0 HA SER A 38 11.333 -32.226 -23.301 1.00 0.00 H new ATOM 0 HB2 SER A 38 8.637 -30.982 -22.579 1.00 0.00 H new ATOM 0 HB3 SER A 38 8.912 -32.517 -23.380 1.00 0.00 H new ATOM 0 HG SER A 38 8.449 -32.777 -21.118 1.00 0.00 H new ATOM 612 N LYS A 39 10.595 -29.164 -24.128 1.00 0.00 N ATOM 613 CA LYS A 39 10.528 -28.189 -25.226 1.00 0.00 C ATOM 614 C LYS A 39 11.793 -28.223 -26.105 1.00 0.00 C ATOM 615 O LYS A 39 11.736 -27.879 -27.285 1.00 0.00 O ATOM 616 CB LYS A 39 10.248 -26.768 -24.687 1.00 0.00 C ATOM 617 CG LYS A 39 8.869 -26.581 -24.010 1.00 0.00 C ATOM 618 CD LYS A 39 8.655 -27.312 -22.663 1.00 0.00 C ATOM 619 CE LYS A 39 7.749 -26.496 -21.726 1.00 0.00 C ATOM 620 NZ LYS A 39 7.507 -27.174 -20.427 1.00 0.00 N ATOM 0 H LYS A 39 10.648 -28.727 -23.208 1.00 0.00 H new ATOM 0 HA LYS A 39 9.693 -28.474 -25.866 1.00 0.00 H new ATOM 0 HB2 LYS A 39 11.026 -26.509 -23.969 1.00 0.00 H new ATOM 0 HB3 LYS A 39 10.329 -26.061 -25.513 1.00 0.00 H new ATOM 0 HG2 LYS A 39 8.710 -25.515 -23.848 1.00 0.00 H new ATOM 0 HG3 LYS A 39 8.099 -26.916 -24.706 1.00 0.00 H new ATOM 0 HD2 LYS A 39 8.209 -28.290 -22.844 1.00 0.00 H new ATOM 0 HD3 LYS A 39 9.618 -27.485 -22.183 1.00 0.00 H new ATOM 0 HE2 LYS A 39 8.205 -25.523 -21.544 1.00 0.00 H new ATOM 0 HE3 LYS A 39 6.794 -26.313 -22.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 6.610 -26.838 -20.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 7.456 -28.202 -20.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 8.285 -26.957 -19.772 1.00 0.00 H new ATOM 634 N ASP A 40 12.919 -28.672 -25.552 1.00 0.00 N ATOM 635 CA ASP A 40 14.141 -29.003 -26.296 1.00 0.00 C ATOM 636 C ASP A 40 14.102 -30.466 -26.743 1.00 0.00 C ATOM 637 O ASP A 40 14.331 -30.781 -27.915 1.00 0.00 O ATOM 638 CB ASP A 40 15.368 -28.805 -25.389 1.00 0.00 C ATOM 639 CG ASP A 40 15.823 -27.334 -25.369 1.00 0.00 C ATOM 640 OD1 ASP A 40 16.553 -26.916 -26.296 1.00 0.00 O ATOM 641 OD2 ASP A 40 15.445 -26.588 -24.430 1.00 0.00 O ATOM 0 H ASP A 40 13.012 -28.821 -24.547 1.00 0.00 H new ATOM 0 HA ASP A 40 14.206 -28.351 -27.167 1.00 0.00 H new ATOM 0 HB2 ASP A 40 15.128 -29.127 -24.375 1.00 0.00 H new ATOM 0 HB3 ASP A 40 16.186 -29.435 -25.739 1.00 0.00 H new ATOM 646 N PHE A 41 13.791 -31.369 -25.806 1.00 0.00 N ATOM 647 CA PHE A 41 13.959 -32.803 -26.004 1.00 0.00 C ATOM 648 C PHE A 41 13.034 -33.434 -27.054 1.00 0.00 C ATOM 649 O PHE A 41 13.472 -34.314 -27.797 1.00 0.00 O ATOM 650 CB PHE A 41 13.843 -33.521 -24.654 1.00 0.00 C ATOM 651 CG PHE A 41 14.554 -34.854 -24.673 1.00 0.00 C ATOM 652 CD1 PHE A 41 15.934 -34.888 -24.948 1.00 0.00 C ATOM 653 CD2 PHE A 41 13.838 -36.054 -24.490 1.00 0.00 C ATOM 654 CE1 PHE A 41 16.586 -36.131 -25.065 1.00 0.00 C ATOM 655 CE2 PHE A 41 14.504 -37.290 -24.587 1.00 0.00 C ATOM 656 CZ PHE A 41 15.875 -37.332 -24.883 1.00 0.00 C ATOM 0 H PHE A 41 13.416 -31.120 -24.891 1.00 0.00 H new ATOM 0 HA PHE A 41 14.957 -32.935 -26.422 1.00 0.00 H new ATOM 0 HB2 PHE A 41 14.265 -32.893 -23.869 1.00 0.00 H new ATOM 0 HB3 PHE A 41 12.791 -33.672 -24.410 1.00 0.00 H new ATOM 0 HD1 PHE A 41 16.488 -33.969 -25.068 1.00 0.00 H new ATOM 0 HD2 PHE A 41 12.780 -36.025 -24.276 1.00 0.00 H new ATOM 0 HE1 PHE A 41 17.640 -36.163 -25.296 1.00 0.00 H new ATOM 0 HE2 PHE A 41 13.958 -38.209 -24.433 1.00 0.00 H new ATOM 0 HZ PHE A 41 16.382 -38.281 -24.971 1.00 0.00 H new ATOM 666 N ASN A 42 11.785 -32.965 -27.182 1.00 0.00 N ATOM 667 CA ASN A 42 10.871 -33.446 -28.229 1.00 0.00 C ATOM 668 C ASN A 42 11.447 -33.251 -29.633 1.00 0.00 C ATOM 669 O ASN A 42 11.281 -34.108 -30.504 1.00 0.00 O ATOM 670 CB ASN A 42 9.488 -32.776 -28.116 1.00 0.00 C ATOM 671 CG ASN A 42 9.354 -31.410 -28.765 1.00 0.00 C ATOM 672 OD1 ASN A 42 8.951 -31.272 -29.909 1.00 0.00 O ATOM 673 ND2 ASN A 42 9.716 -30.360 -28.070 1.00 0.00 N ATOM 0 H ASN A 42 11.384 -32.252 -26.573 1.00 0.00 H new ATOM 0 HA ASN A 42 10.750 -34.517 -28.069 1.00 0.00 H new ATOM 0 HB2 ASN A 42 8.747 -33.441 -28.560 1.00 0.00 H new ATOM 0 HB3 ASN A 42 9.238 -32.680 -27.059 1.00 0.00 H new ATOM 0 HD21 ASN A 42 9.661 -29.430 -28.485 1.00 0.00 H new ATOM 0 HD22 ASN A 42 10.053 -30.473 -27.114 1.00 0.00 H new ATOM 680 N ARG A 43 12.132 -32.115 -29.843 1.00 0.00 N ATOM 681 CA ARG A 43 12.594 -31.738 -31.176 1.00 0.00 C ATOM 682 C ARG A 43 13.795 -32.578 -31.624 1.00 0.00 C ATOM 683 O ARG A 43 13.926 -32.901 -32.804 1.00 0.00 O ATOM 684 CB ARG A 43 12.919 -30.236 -31.237 1.00 0.00 C ATOM 685 CG ARG A 43 11.642 -29.382 -31.289 1.00 0.00 C ATOM 686 CD ARG A 43 11.948 -27.877 -31.381 1.00 0.00 C ATOM 687 NE ARG A 43 12.361 -27.318 -30.078 1.00 0.00 N ATOM 688 CZ ARG A 43 13.058 -26.217 -29.864 1.00 0.00 C ATOM 689 NH1 ARG A 43 13.554 -25.485 -30.822 1.00 0.00 N ATOM 690 NH2 ARG A 43 13.269 -25.835 -28.640 1.00 0.00 N ATOM 0 H ARG A 43 12.374 -31.450 -29.108 1.00 0.00 H new ATOM 0 HA ARG A 43 11.781 -31.942 -31.872 1.00 0.00 H new ATOM 0 HB2 ARG A 43 13.510 -29.955 -30.365 1.00 0.00 H new ATOM 0 HB3 ARG A 43 13.530 -30.031 -32.116 1.00 0.00 H new ATOM 0 HG2 ARG A 43 11.042 -29.682 -32.148 1.00 0.00 H new ATOM 0 HG3 ARG A 43 11.042 -29.575 -30.399 1.00 0.00 H new ATOM 0 HD2 ARG A 43 12.738 -27.711 -32.114 1.00 0.00 H new ATOM 0 HD3 ARG A 43 11.065 -27.348 -31.739 1.00 0.00 H new ATOM 0 HE ARG A 43 12.076 -27.841 -29.250 1.00 0.00 H new ATOM 0 HH11 ARG A 43 13.411 -25.754 -31.795 1.00 0.00 H new ATOM 0 HH12 ARG A 43 14.085 -24.643 -30.598 1.00 0.00 H new ATOM 0 HH21 ARG A 43 12.898 -26.383 -27.864 1.00 0.00 H new ATOM 0 HH22 ARG A 43 13.805 -24.987 -28.456 1.00 0.00 H new ATOM 704 N SER A 44 14.638 -32.990 -30.670 1.00 0.00 N ATOM 705 CA SER A 44 15.806 -33.858 -30.907 1.00 0.00 C ATOM 706 C SER A 44 15.437 -35.241 -31.457 1.00 0.00 C ATOM 707 O SER A 44 16.179 -35.780 -32.276 1.00 0.00 O ATOM 708 CB SER A 44 16.614 -34.043 -29.613 1.00 0.00 C ATOM 709 OG SER A 44 17.216 -32.827 -29.206 1.00 0.00 O ATOM 0 H SER A 44 14.528 -32.726 -29.691 1.00 0.00 H new ATOM 0 HA SER A 44 16.402 -33.348 -31.664 1.00 0.00 H new ATOM 0 HB2 SER A 44 15.960 -34.410 -28.822 1.00 0.00 H new ATOM 0 HB3 SER A 44 17.384 -34.799 -29.767 1.00 0.00 H new ATOM 0 HG SER A 44 17.298 -32.813 -28.229 1.00 0.00 H new ATOM 715 N LYS A 45 14.273 -35.796 -31.069 1.00 0.00 N ATOM 716 CA LYS A 45 13.815 -37.152 -31.457 1.00 0.00 C ATOM 717 C LYS A 45 13.738 -37.380 -32.977 1.00 0.00 C ATOM 718 O LYS A 45 13.849 -38.522 -33.429 1.00 0.00 O ATOM 719 CB LYS A 45 12.451 -37.454 -30.809 1.00 0.00 C ATOM 720 CG LYS A 45 12.519 -37.488 -29.274 1.00 0.00 C ATOM 721 CD LYS A 45 11.140 -37.783 -28.665 1.00 0.00 C ATOM 722 CE LYS A 45 11.224 -37.764 -27.132 1.00 0.00 C ATOM 723 NZ LYS A 45 9.910 -38.062 -26.505 1.00 0.00 N ATOM 0 H LYS A 45 13.610 -35.309 -30.466 1.00 0.00 H new ATOM 0 HA LYS A 45 14.574 -37.842 -31.088 1.00 0.00 H new ATOM 0 HB2 LYS A 45 11.730 -36.698 -31.120 1.00 0.00 H new ATOM 0 HB3 LYS A 45 12.084 -38.413 -31.174 1.00 0.00 H new ATOM 0 HG2 LYS A 45 13.231 -38.249 -28.955 1.00 0.00 H new ATOM 0 HG3 LYS A 45 12.887 -36.532 -28.902 1.00 0.00 H new ATOM 0 HD2 LYS A 45 10.417 -37.042 -29.006 1.00 0.00 H new ATOM 0 HD3 LYS A 45 10.784 -38.756 -29.005 1.00 0.00 H new ATOM 0 HE2 LYS A 45 11.960 -38.496 -26.799 1.00 0.00 H new ATOM 0 HE3 LYS A 45 11.573 -36.786 -26.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.006 -38.040 -25.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.214 -37.349 -26.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 9.589 -39.005 -26.803 1.00 0.00 H new ATOM 737 N ALA A 46 13.580 -36.316 -33.767 1.00 0.00 N ATOM 738 CA ALA A 46 13.614 -36.348 -35.231 1.00 0.00 C ATOM 739 C ALA A 46 15.011 -36.638 -35.830 1.00 0.00 C ATOM 740 O ALA A 46 15.120 -36.884 -37.033 1.00 0.00 O ATOM 741 CB ALA A 46 13.078 -35.002 -35.736 1.00 0.00 C ATOM 0 H ALA A 46 13.420 -35.380 -33.395 1.00 0.00 H new ATOM 0 HA ALA A 46 12.994 -37.181 -35.562 1.00 0.00 H new ATOM 0 HB1 ALA A 46 13.090 -34.992 -36.826 1.00 0.00 H new ATOM 0 HB2 ALA A 46 12.057 -34.861 -35.383 1.00 0.00 H new ATOM 0 HB3 ALA A 46 13.707 -34.195 -35.359 1.00 0.00 H new ATOM 747 N LEU A 47 16.081 -36.616 -35.020 1.00 0.00 N ATOM 748 CA LEU A 47 17.484 -36.684 -35.456 1.00 0.00 C ATOM 749 C LEU A 47 18.349 -37.634 -34.616 1.00 0.00 C ATOM 750 O LEU A 47 19.057 -38.467 -35.183 1.00 0.00 O ATOM 751 CB LEU A 47 18.090 -35.267 -35.399 1.00 0.00 C ATOM 752 CG LEU A 47 17.472 -34.229 -36.357 1.00 0.00 C ATOM 753 CD1 LEU A 47 18.058 -32.850 -36.065 1.00 0.00 C ATOM 754 CD2 LEU A 47 17.735 -34.558 -37.831 1.00 0.00 C ATOM 0 H LEU A 47 15.989 -36.548 -34.006 1.00 0.00 H new ATOM 0 HA LEU A 47 17.481 -37.083 -36.470 1.00 0.00 H new ATOM 0 HB2 LEU A 47 17.995 -34.893 -34.380 1.00 0.00 H new ATOM 0 HB3 LEU A 47 19.156 -35.340 -35.613 1.00 0.00 H new ATOM 0 HG LEU A 47 16.395 -34.246 -36.189 1.00 0.00 H new ATOM 0 HD11 LEU A 47 17.620 -32.118 -36.743 1.00 0.00 H new ATOM 0 HD12 LEU A 47 17.835 -32.570 -35.035 1.00 0.00 H new ATOM 0 HD13 LEU A 47 19.138 -32.876 -36.208 1.00 0.00 H new ATOM 0 HD21 LEU A 47 17.278 -33.795 -38.461 1.00 0.00 H new ATOM 0 HD22 LEU A 47 18.810 -34.582 -38.012 1.00 0.00 H new ATOM 0 HD23 LEU A 47 17.305 -35.531 -38.069 1.00 0.00 H new ATOM 766 N PHE A 48 18.299 -37.521 -33.286 1.00 0.00 N ATOM 767 CA PHE A 48 19.247 -38.162 -32.364 1.00 0.00 C ATOM 768 C PHE A 48 18.712 -38.267 -30.922 1.00 0.00 C ATOM 769 O PHE A 48 17.856 -37.488 -30.500 1.00 0.00 O ATOM 770 CB PHE A 48 20.537 -37.309 -32.374 1.00 0.00 C ATOM 771 CG PHE A 48 21.606 -37.756 -33.356 1.00 0.00 C ATOM 772 CD1 PHE A 48 22.319 -38.951 -33.121 1.00 0.00 C ATOM 773 CD2 PHE A 48 21.921 -36.966 -34.478 1.00 0.00 C ATOM 774 CE1 PHE A 48 23.321 -39.360 -34.021 1.00 0.00 C ATOM 775 CE2 PHE A 48 22.925 -37.375 -35.375 1.00 0.00 C ATOM 776 CZ PHE A 48 23.626 -38.570 -35.147 1.00 0.00 C ATOM 0 H PHE A 48 17.585 -36.971 -32.808 1.00 0.00 H new ATOM 0 HA PHE A 48 19.423 -39.184 -32.699 1.00 0.00 H new ATOM 0 HB2 PHE A 48 20.268 -36.277 -32.600 1.00 0.00 H new ATOM 0 HB3 PHE A 48 20.964 -37.315 -31.371 1.00 0.00 H new ATOM 0 HD1 PHE A 48 22.096 -39.551 -32.251 1.00 0.00 H new ATOM 0 HD2 PHE A 48 21.390 -36.042 -34.651 1.00 0.00 H new ATOM 0 HE1 PHE A 48 23.857 -40.281 -33.848 1.00 0.00 H new ATOM 0 HE2 PHE A 48 23.156 -36.770 -36.239 1.00 0.00 H new ATOM 0 HZ PHE A 48 24.398 -38.883 -35.834 1.00 0.00 H new ATOM 786 N SER A 49 19.301 -39.182 -30.144 1.00 0.00 N ATOM 787 CA SER A 49 19.021 -39.367 -28.706 1.00 0.00 C ATOM 788 C SER A 49 20.166 -38.894 -27.792 1.00 0.00 C ATOM 789 O SER A 49 19.999 -38.832 -26.574 1.00 0.00 O ATOM 790 CB SER A 49 18.702 -40.839 -28.409 1.00 0.00 C ATOM 791 OG SER A 49 17.607 -41.278 -29.203 1.00 0.00 O ATOM 0 H SER A 49 20.002 -39.832 -30.500 1.00 0.00 H new ATOM 0 HA SER A 49 18.157 -38.740 -28.484 1.00 0.00 H new ATOM 0 HB2 SER A 49 19.577 -41.456 -28.612 1.00 0.00 H new ATOM 0 HB3 SER A 49 18.465 -40.960 -27.352 1.00 0.00 H new ATOM 0 HG SER A 49 17.416 -42.218 -29.005 1.00 0.00 H new ATOM 797 N GLN A 50 21.323 -38.521 -28.354 1.00 0.00 N ATOM 798 CA GLN A 50 22.511 -38.067 -27.607 1.00 0.00 C ATOM 799 C GLN A 50 22.261 -36.807 -26.753 1.00 0.00 C ATOM 800 O GLN A 50 22.936 -36.599 -25.740 1.00 0.00 O ATOM 801 CB GLN A 50 23.680 -37.832 -28.577 1.00 0.00 C ATOM 802 CG GLN A 50 24.137 -39.127 -29.274 1.00 0.00 C ATOM 803 CD GLN A 50 25.357 -38.934 -30.178 1.00 0.00 C ATOM 804 OE1 GLN A 50 25.692 -37.844 -30.627 1.00 0.00 O ATOM 805 NE2 GLN A 50 26.080 -39.994 -30.482 1.00 0.00 N ATOM 0 H GLN A 50 21.466 -38.525 -29.364 1.00 0.00 H new ATOM 0 HA GLN A 50 22.760 -38.863 -26.905 1.00 0.00 H new ATOM 0 HB2 GLN A 50 23.382 -37.103 -29.331 1.00 0.00 H new ATOM 0 HB3 GLN A 50 24.520 -37.401 -28.032 1.00 0.00 H new ATOM 0 HG2 GLN A 50 24.370 -39.875 -28.517 1.00 0.00 H new ATOM 0 HG3 GLN A 50 23.313 -39.521 -29.868 1.00 0.00 H new ATOM 0 HE21 GLN A 50 25.819 -40.911 -30.119 1.00 0.00 H new ATOM 0 HE22 GLN A 50 26.900 -39.897 -31.080 1.00 0.00 H new ATOM 814 N SER A 51 21.249 -36.007 -27.102 1.00 0.00 N ATOM 815 CA SER A 51 20.760 -34.858 -26.323 1.00 0.00 C ATOM 816 C SER A 51 20.333 -35.209 -24.886 1.00 0.00 C ATOM 817 O SER A 51 20.261 -34.331 -24.031 1.00 0.00 O ATOM 818 CB SER A 51 19.585 -34.194 -27.051 1.00 0.00 C ATOM 819 OG SER A 51 19.896 -33.937 -28.411 1.00 0.00 O ATOM 0 H SER A 51 20.726 -36.144 -27.967 1.00 0.00 H new ATOM 0 HA SER A 51 21.605 -34.174 -26.239 1.00 0.00 H new ATOM 0 HB2 SER A 51 18.708 -34.839 -26.993 1.00 0.00 H new ATOM 0 HB3 SER A 51 19.328 -33.260 -26.552 1.00 0.00 H new ATOM 0 HG SER A 51 19.117 -33.542 -28.856 1.00 0.00 H new ATOM 825 N ALA A 52 20.107 -36.494 -24.579 1.00 0.00 N ATOM 826 CA ALA A 52 19.800 -36.995 -23.234 1.00 0.00 C ATOM 827 C ALA A 52 20.896 -36.740 -22.183 1.00 0.00 C ATOM 828 O ALA A 52 20.658 -36.875 -20.983 1.00 0.00 O ATOM 829 CB ALA A 52 19.501 -38.494 -23.351 1.00 0.00 C ATOM 0 H ALA A 52 20.134 -37.234 -25.281 1.00 0.00 H new ATOM 0 HA ALA A 52 18.939 -36.437 -22.866 1.00 0.00 H new ATOM 0 HB1 ALA A 52 19.269 -38.897 -22.365 1.00 0.00 H new ATOM 0 HB2 ALA A 52 18.649 -38.644 -24.014 1.00 0.00 H new ATOM 0 HB3 ALA A 52 20.372 -39.008 -23.757 1.00 0.00 H new ATOM 835 N ILE A 53 22.090 -36.368 -22.638 1.00 0.00 N ATOM 836 CA ILE A 53 23.271 -36.055 -21.823 1.00 0.00 C ATOM 837 C ILE A 53 23.397 -34.536 -21.541 1.00 0.00 C ATOM 838 O ILE A 53 24.106 -34.134 -20.613 1.00 0.00 O ATOM 839 CB ILE A 53 24.484 -36.620 -22.598 1.00 0.00 C ATOM 840 CG1 ILE A 53 24.417 -38.157 -22.799 1.00 0.00 C ATOM 841 CG2 ILE A 53 25.844 -36.247 -21.978 1.00 0.00 C ATOM 842 CD1 ILE A 53 24.338 -38.992 -21.515 1.00 0.00 C ATOM 0 H ILE A 53 22.274 -36.270 -23.637 1.00 0.00 H new ATOM 0 HA ILE A 53 23.201 -36.509 -20.834 1.00 0.00 H new ATOM 0 HB ILE A 53 24.414 -36.137 -23.573 1.00 0.00 H new ATOM 0 HG12 ILE A 53 23.547 -38.387 -23.414 1.00 0.00 H new ATOM 0 HG13 ILE A 53 25.297 -38.470 -23.361 1.00 0.00 H new ATOM 0 HG21 ILE A 53 26.647 -36.678 -22.576 1.00 0.00 H new ATOM 0 HG22 ILE A 53 25.949 -35.162 -21.958 1.00 0.00 H new ATOM 0 HG23 ILE A 53 25.899 -36.636 -20.961 1.00 0.00 H new ATOM 0 HD11 ILE A 53 24.295 -40.051 -21.771 1.00 0.00 H new ATOM 0 HD12 ILE A 53 25.220 -38.802 -20.903 1.00 0.00 H new ATOM 0 HD13 ILE A 53 23.443 -38.718 -20.957 1.00 0.00 H new ATOM 854 N SER A 54 22.690 -33.679 -22.289 1.00 0.00 N ATOM 855 CA SER A 54 22.745 -32.213 -22.155 1.00 0.00 C ATOM 856 C SER A 54 22.266 -31.722 -20.778 1.00 0.00 C ATOM 857 O SER A 54 21.263 -32.200 -20.250 1.00 0.00 O ATOM 858 CB SER A 54 21.936 -31.548 -23.262 1.00 0.00 C ATOM 859 OG SER A 54 22.500 -31.854 -24.528 1.00 0.00 O ATOM 0 H SER A 54 22.050 -33.989 -23.020 1.00 0.00 H new ATOM 0 HA SER A 54 23.793 -31.928 -22.248 1.00 0.00 H new ATOM 0 HB2 SER A 54 20.902 -31.890 -23.223 1.00 0.00 H new ATOM 0 HB3 SER A 54 21.920 -30.468 -23.113 1.00 0.00 H new ATOM 0 HG SER A 54 21.973 -31.424 -25.233 1.00 0.00 H new ATOM 865 N GLN A 55 22.954 -30.710 -20.233 1.00 0.00 N ATOM 866 CA GLN A 55 22.889 -30.183 -18.851 1.00 0.00 C ATOM 867 C GLN A 55 21.530 -29.707 -18.301 1.00 0.00 C ATOM 868 O GLN A 55 21.429 -29.340 -17.128 1.00 0.00 O ATOM 869 CB GLN A 55 23.943 -29.081 -18.679 1.00 0.00 C ATOM 870 CG GLN A 55 25.339 -29.648 -18.945 1.00 0.00 C ATOM 871 CD GLN A 55 26.450 -28.664 -18.587 1.00 0.00 C ATOM 872 OE1 GLN A 55 27.194 -28.184 -19.436 1.00 0.00 O ATOM 873 NE2 GLN A 55 26.605 -28.314 -17.326 1.00 0.00 N ATOM 0 H GLN A 55 23.631 -30.190 -20.791 1.00 0.00 H new ATOM 0 HA GLN A 55 23.087 -31.064 -18.241 1.00 0.00 H new ATOM 0 HB2 GLN A 55 23.738 -28.260 -19.366 1.00 0.00 H new ATOM 0 HB3 GLN A 55 23.893 -28.673 -17.670 1.00 0.00 H new ATOM 0 HG2 GLN A 55 25.471 -30.564 -18.369 1.00 0.00 H new ATOM 0 HG3 GLN A 55 25.423 -29.918 -19.998 1.00 0.00 H new ATOM 0 HE21 GLN A 55 25.994 -28.705 -16.609 1.00 0.00 H new ATOM 0 HE22 GLN A 55 27.336 -27.652 -17.067 1.00 0.00 H new ATOM 882 N LYS A 56 20.496 -29.679 -19.141 1.00 0.00 N ATOM 883 CA LYS A 56 19.125 -29.256 -18.806 1.00 0.00 C ATOM 884 C LYS A 56 18.048 -30.258 -19.266 1.00 0.00 C ATOM 885 O LYS A 56 16.850 -30.017 -19.124 1.00 0.00 O ATOM 886 CB LYS A 56 18.891 -27.834 -19.339 1.00 0.00 C ATOM 887 CG LYS A 56 19.521 -27.606 -20.725 1.00 0.00 C ATOM 888 CD LYS A 56 18.992 -26.331 -21.398 1.00 0.00 C ATOM 889 CE LYS A 56 17.585 -26.595 -21.945 1.00 0.00 C ATOM 890 NZ LYS A 56 16.902 -25.361 -22.382 1.00 0.00 N ATOM 0 H LYS A 56 20.589 -29.961 -20.117 1.00 0.00 H new ATOM 0 HA LYS A 56 19.026 -29.241 -17.721 1.00 0.00 H new ATOM 0 HB2 LYS A 56 17.819 -27.644 -19.396 1.00 0.00 H new ATOM 0 HB3 LYS A 56 19.305 -27.114 -18.634 1.00 0.00 H new ATOM 0 HG2 LYS A 56 20.604 -27.539 -20.624 1.00 0.00 H new ATOM 0 HG3 LYS A 56 19.313 -28.465 -21.363 1.00 0.00 H new ATOM 0 HD2 LYS A 56 18.968 -25.510 -20.681 1.00 0.00 H new ATOM 0 HD3 LYS A 56 19.658 -26.029 -22.206 1.00 0.00 H new ATOM 0 HE2 LYS A 56 17.650 -27.286 -22.785 1.00 0.00 H new ATOM 0 HE3 LYS A 56 16.987 -27.084 -21.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 16.163 -25.600 -23.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 16.469 -24.894 -21.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 17.592 -24.719 -22.821 1.00 0.00 H new ATOM 904 N GLU A 57 18.485 -31.367 -19.867 1.00 0.00 N ATOM 905 CA GLU A 57 17.682 -32.514 -20.309 1.00 0.00 C ATOM 906 C GLU A 57 17.963 -33.784 -19.493 1.00 0.00 C ATOM 907 O GLU A 57 17.053 -34.565 -19.206 1.00 0.00 O ATOM 908 CB GLU A 57 18.027 -32.760 -21.781 1.00 0.00 C ATOM 909 CG GLU A 57 17.266 -31.763 -22.676 1.00 0.00 C ATOM 910 CD GLU A 57 18.114 -31.236 -23.841 1.00 0.00 C ATOM 911 OE1 GLU A 57 18.897 -30.280 -23.624 1.00 0.00 O ATOM 912 OE2 GLU A 57 17.968 -31.740 -24.979 1.00 0.00 O ATOM 0 H GLU A 57 19.475 -31.498 -20.072 1.00 0.00 H new ATOM 0 HA GLU A 57 16.626 -32.286 -20.167 1.00 0.00 H new ATOM 0 HB2 GLU A 57 19.101 -32.652 -21.934 1.00 0.00 H new ATOM 0 HB3 GLU A 57 17.767 -33.782 -22.058 1.00 0.00 H new ATOM 0 HG2 GLU A 57 16.374 -32.247 -23.073 1.00 0.00 H new ATOM 0 HG3 GLU A 57 16.929 -30.922 -22.069 1.00 0.00 H new ATOM 919 N TYR A 58 19.227 -33.998 -19.117 1.00 0.00 N ATOM 920 CA TYR A 58 19.691 -35.171 -18.370 1.00 0.00 C ATOM 921 C TYR A 58 19.072 -35.326 -16.962 1.00 0.00 C ATOM 922 O TYR A 58 19.098 -36.414 -16.382 1.00 0.00 O ATOM 923 CB TYR A 58 21.224 -35.126 -18.314 1.00 0.00 C ATOM 924 CG TYR A 58 21.780 -34.417 -17.092 1.00 0.00 C ATOM 925 CD1 TYR A 58 21.734 -33.017 -17.014 1.00 0.00 C ATOM 926 CD2 TYR A 58 22.262 -35.172 -16.006 1.00 0.00 C ATOM 927 CE1 TYR A 58 22.164 -32.363 -15.842 1.00 0.00 C ATOM 928 CE2 TYR A 58 22.715 -34.521 -14.843 1.00 0.00 C ATOM 929 CZ TYR A 58 22.666 -33.113 -14.757 1.00 0.00 C ATOM 930 OH TYR A 58 23.091 -32.489 -13.622 1.00 0.00 O ATOM 0 H TYR A 58 19.978 -33.341 -19.330 1.00 0.00 H new ATOM 0 HA TYR A 58 19.348 -36.058 -18.903 1.00 0.00 H new ATOM 0 HB2 TYR A 58 21.608 -36.146 -18.335 1.00 0.00 H new ATOM 0 HB3 TYR A 58 21.595 -34.628 -19.210 1.00 0.00 H new ATOM 0 HD1 TYR A 58 21.369 -32.441 -17.852 1.00 0.00 H new ATOM 0 HD2 TYR A 58 22.284 -36.250 -16.065 1.00 0.00 H new ATOM 0 HE1 TYR A 58 22.109 -31.287 -15.774 1.00 0.00 H new ATOM 0 HE2 TYR A 58 23.100 -35.099 -14.016 1.00 0.00 H new ATOM 0 HH TYR A 58 23.404 -33.158 -12.978 1.00 0.00 H new ATOM 940 N ASP A 59 18.495 -34.250 -16.423 1.00 0.00 N ATOM 941 CA ASP A 59 17.989 -34.114 -15.056 1.00 0.00 C ATOM 942 C ASP A 59 16.450 -34.162 -14.948 1.00 0.00 C ATOM 943 O ASP A 59 15.901 -33.965 -13.866 1.00 0.00 O ATOM 944 CB ASP A 59 18.569 -32.826 -14.447 1.00 0.00 C ATOM 945 CG ASP A 59 18.034 -31.553 -15.131 1.00 0.00 C ATOM 946 OD1 ASP A 59 18.192 -31.427 -16.369 1.00 0.00 O ATOM 947 OD2 ASP A 59 17.476 -30.676 -14.428 1.00 0.00 O ATOM 0 H ASP A 59 18.360 -33.396 -16.964 1.00 0.00 H new ATOM 0 HA ASP A 59 18.323 -34.982 -14.487 1.00 0.00 H new ATOM 0 HB2 ASP A 59 18.329 -32.791 -13.384 1.00 0.00 H new ATOM 0 HB3 ASP A 59 19.656 -32.848 -14.528 1.00 0.00 H new ATOM 952 N SER A 60 15.727 -34.466 -16.031 1.00 0.00 N ATOM 953 CA SER A 60 14.273 -34.717 -15.982 1.00 0.00 C ATOM 954 C SER A 60 13.888 -35.853 -15.012 1.00 0.00 C ATOM 955 O SER A 60 12.802 -35.835 -14.435 1.00 0.00 O ATOM 956 CB SER A 60 13.731 -35.035 -17.380 1.00 0.00 C ATOM 957 OG SER A 60 13.976 -33.961 -18.269 1.00 0.00 O ATOM 0 H SER A 60 16.127 -34.546 -16.966 1.00 0.00 H new ATOM 0 HA SER A 60 13.820 -33.799 -15.607 1.00 0.00 H new ATOM 0 HB2 SER A 60 14.201 -35.942 -17.760 1.00 0.00 H new ATOM 0 HB3 SER A 60 12.660 -35.230 -17.324 1.00 0.00 H new ATOM 0 HG SER A 60 14.887 -34.031 -18.623 1.00 0.00 H new ATOM 963 N SER A 61 14.789 -36.812 -14.769 1.00 0.00 N ATOM 964 CA SER A 61 14.646 -37.866 -13.749 1.00 0.00 C ATOM 965 C SER A 61 14.827 -37.375 -12.298 1.00 0.00 C ATOM 966 O SER A 61 14.372 -38.038 -11.361 1.00 0.00 O ATOM 967 CB SER A 61 15.661 -38.983 -14.031 1.00 0.00 C ATOM 968 OG SER A 61 16.977 -38.446 -14.076 1.00 0.00 O ATOM 0 H SER A 61 15.664 -36.881 -15.289 1.00 0.00 H new ATOM 0 HA SER A 61 13.620 -38.225 -13.825 1.00 0.00 H new ATOM 0 HB2 SER A 61 15.598 -39.747 -13.256 1.00 0.00 H new ATOM 0 HB3 SER A 61 15.425 -39.469 -14.978 1.00 0.00 H new ATOM 0 HG SER A 61 17.618 -39.165 -14.255 1.00 0.00 H new ATOM 974 N LEU A 62 15.477 -36.222 -12.102 1.00 0.00 N ATOM 975 CA LEU A 62 15.828 -35.639 -10.812 1.00 0.00 C ATOM 976 C LEU A 62 14.902 -34.488 -10.390 1.00 0.00 C ATOM 977 O LEU A 62 14.695 -34.284 -9.191 1.00 0.00 O ATOM 978 CB LEU A 62 17.260 -35.102 -10.949 1.00 0.00 C ATOM 979 CG LEU A 62 18.355 -36.168 -11.137 1.00 0.00 C ATOM 980 CD1 LEU A 62 19.707 -35.474 -11.252 1.00 0.00 C ATOM 981 CD2 LEU A 62 18.423 -37.156 -9.972 1.00 0.00 C ATOM 0 H LEU A 62 15.786 -35.644 -12.883 1.00 0.00 H new ATOM 0 HA LEU A 62 15.730 -36.407 -10.044 1.00 0.00 H new ATOM 0 HB2 LEU A 62 17.293 -34.419 -11.798 1.00 0.00 H new ATOM 0 HB3 LEU A 62 17.496 -34.517 -10.060 1.00 0.00 H new ATOM 0 HG LEU A 62 18.109 -36.728 -12.039 1.00 0.00 H new ATOM 0 HD11 LEU A 62 20.489 -36.221 -11.385 1.00 0.00 H new ATOM 0 HD12 LEU A 62 19.699 -34.800 -12.109 1.00 0.00 H new ATOM 0 HD13 LEU A 62 19.901 -34.903 -10.344 1.00 0.00 H new ATOM 0 HD21 LEU A 62 19.212 -37.884 -10.158 1.00 0.00 H new ATOM 0 HD22 LEU A 62 18.638 -36.617 -9.049 1.00 0.00 H new ATOM 0 HD23 LEU A 62 17.468 -37.672 -9.877 1.00 0.00 H new ATOM 993 N ALA A 63 14.358 -33.743 -11.354 1.00 0.00 N ATOM 994 CA ALA A 63 13.650 -32.477 -11.127 1.00 0.00 C ATOM 995 C ALA A 63 12.365 -32.285 -11.952 1.00 0.00 C ATOM 996 O ALA A 63 11.760 -31.211 -11.930 1.00 0.00 O ATOM 997 CB ALA A 63 14.655 -31.357 -11.424 1.00 0.00 C ATOM 0 H ALA A 63 14.397 -34.008 -12.338 1.00 0.00 H new ATOM 0 HA ALA A 63 13.297 -32.468 -10.096 1.00 0.00 H new ATOM 0 HB1 ALA A 63 14.177 -30.389 -11.270 1.00 0.00 H new ATOM 0 HB2 ALA A 63 15.511 -31.450 -10.756 1.00 0.00 H new ATOM 0 HB3 ALA A 63 14.992 -31.435 -12.458 1.00 0.00 H new ATOM 1003 N THR A 64 11.939 -33.317 -12.679 1.00 0.00 N ATOM 1004 CA THR A 64 10.824 -33.356 -13.654 1.00 0.00 C ATOM 1005 C THR A 64 10.943 -32.386 -14.831 1.00 0.00 C ATOM 1006 O THR A 64 11.176 -32.780 -15.974 1.00 0.00 O ATOM 1007 CB THR A 64 9.447 -33.290 -12.961 1.00 0.00 C ATOM 1008 OG1 THR A 64 9.352 -34.298 -11.970 1.00 0.00 O ATOM 1009 CG2 THR A 64 8.278 -33.522 -13.921 1.00 0.00 C ATOM 0 H THR A 64 12.395 -34.226 -12.603 1.00 0.00 H new ATOM 0 HA THR A 64 10.911 -34.335 -14.125 1.00 0.00 H new ATOM 0 HB THR A 64 9.379 -32.286 -12.543 1.00 0.00 H new ATOM 0 HG1 THR A 64 8.476 -34.247 -11.535 1.00 0.00 H new ATOM 0 HG21 THR A 64 7.339 -33.463 -13.371 1.00 0.00 H new ATOM 0 HG22 THR A 64 8.291 -32.760 -14.701 1.00 0.00 H new ATOM 0 HG23 THR A 64 8.371 -34.508 -14.376 1.00 0.00 H new ATOM 1017 N LEU A 65 10.770 -31.116 -14.518 1.00 0.00 N ATOM 1018 CA LEU A 65 10.752 -29.943 -15.405 1.00 0.00 C ATOM 1019 C LEU A 65 11.379 -28.683 -14.756 1.00 0.00 C ATOM 1020 O LEU A 65 11.302 -27.596 -15.328 1.00 0.00 O ATOM 1021 CB LEU A 65 9.289 -29.678 -15.828 1.00 0.00 C ATOM 1022 CG LEU A 65 8.766 -30.584 -16.955 1.00 0.00 C ATOM 1023 CD1 LEU A 65 7.258 -30.398 -17.135 1.00 0.00 C ATOM 1024 CD2 LEU A 65 9.426 -30.271 -18.301 1.00 0.00 C ATOM 0 H LEU A 65 10.624 -30.842 -13.547 1.00 0.00 H new ATOM 0 HA LEU A 65 11.369 -30.161 -16.277 1.00 0.00 H new ATOM 0 HB2 LEU A 65 8.646 -29.800 -14.956 1.00 0.00 H new ATOM 0 HB3 LEU A 65 9.201 -28.639 -16.146 1.00 0.00 H new ATOM 0 HG LEU A 65 9.005 -31.606 -16.661 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.905 -31.047 -17.937 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.746 -30.655 -16.208 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.047 -29.359 -17.389 1.00 0.00 H new ATOM 0 HD21 LEU A 65 9.025 -30.936 -19.066 1.00 0.00 H new ATOM 0 HD22 LEU A 65 9.220 -29.236 -18.575 1.00 0.00 H new ATOM 0 HD23 LEU A 65 10.503 -30.418 -18.221 1.00 0.00 H new ATOM 1036 N ASP A 66 12.010 -28.809 -13.582 1.00 0.00 N ATOM 1037 CA ASP A 66 12.555 -27.697 -12.784 1.00 0.00 C ATOM 1038 C ASP A 66 11.491 -26.662 -12.372 1.00 0.00 C ATOM 1039 O ASP A 66 11.683 -25.449 -12.498 1.00 0.00 O ATOM 1040 CB ASP A 66 13.815 -27.105 -13.454 1.00 0.00 C ATOM 1041 CG ASP A 66 14.870 -26.590 -12.454 1.00 0.00 C ATOM 1042 OD1 ASP A 66 14.682 -26.687 -11.217 1.00 0.00 O ATOM 1043 OD2 ASP A 66 15.940 -26.133 -12.922 1.00 0.00 O ATOM 0 H ASP A 66 12.162 -29.718 -13.144 1.00 0.00 H new ATOM 0 HA ASP A 66 12.886 -28.103 -11.828 1.00 0.00 H new ATOM 0 HB2 ASP A 66 14.270 -27.867 -14.087 1.00 0.00 H new ATOM 0 HB3 ASP A 66 13.516 -26.285 -14.107 1.00 0.00 H new ATOM 1048 N HIS A 67 10.329 -27.138 -11.905 1.00 0.00 N ATOM 1049 CA HIS A 67 9.275 -26.264 -11.398 1.00 0.00 C ATOM 1050 C HIS A 67 9.527 -25.737 -9.985 1.00 0.00 C ATOM 1051 O HIS A 67 10.119 -26.425 -9.149 1.00 0.00 O ATOM 1052 CB HIS A 67 7.901 -26.969 -11.435 1.00 0.00 C ATOM 1053 CG HIS A 67 7.361 -27.294 -12.805 1.00 0.00 C ATOM 1054 ND1 HIS A 67 6.614 -28.424 -13.137 1.00 0.00 N ATOM 1055 CD2 HIS A 67 7.458 -26.504 -13.909 1.00 0.00 C ATOM 1056 CE1 HIS A 67 6.308 -28.302 -14.441 1.00 0.00 C ATOM 1057 NE2 HIS A 67 6.824 -27.160 -14.938 1.00 0.00 N ATOM 0 H HIS A 67 10.099 -28.131 -11.870 1.00 0.00 H new ATOM 0 HA HIS A 67 9.278 -25.404 -12.068 1.00 0.00 H new ATOM 0 HB2 HIS A 67 7.975 -27.896 -10.866 1.00 0.00 H new ATOM 0 HB3 HIS A 67 7.177 -26.337 -10.921 1.00 0.00 H new ATOM 0 HD2 HIS A 67 7.943 -25.541 -13.966 1.00 0.00 H new ATOM 0 HE1 HIS A 67 5.731 -29.017 -15.009 1.00 0.00 H new ATOM 0 HE2 HIS A 67 6.756 -26.840 -15.904 1.00 0.00 H new ATOM 1065 N THR A 68 8.987 -24.552 -9.680 1.00 0.00 N ATOM 1066 CA THR A 68 8.941 -23.993 -8.314 1.00 0.00 C ATOM 1067 C THR A 68 7.600 -23.289 -8.070 1.00 0.00 C ATOM 1068 O THR A 68 7.011 -22.747 -9.003 1.00 0.00 O ATOM 1069 CB THR A 68 10.117 -23.021 -8.107 1.00 0.00 C ATOM 1070 OG1 THR A 68 11.338 -23.648 -8.442 1.00 0.00 O ATOM 1071 CG2 THR A 68 10.278 -22.548 -6.666 1.00 0.00 C ATOM 0 H THR A 68 8.563 -23.943 -10.380 1.00 0.00 H new ATOM 0 HA THR A 68 9.031 -24.805 -7.593 1.00 0.00 H new ATOM 0 HB THR A 68 9.887 -22.168 -8.746 1.00 0.00 H new ATOM 0 HG1 THR A 68 12.028 -23.387 -7.796 1.00 0.00 H new ATOM 0 HG21 THR A 68 11.126 -21.867 -6.599 1.00 0.00 H new ATOM 0 HG22 THR A 68 9.372 -22.031 -6.349 1.00 0.00 H new ATOM 0 HG23 THR A 68 10.451 -23.407 -6.018 1.00 0.00 H new ATOM 1079 N GLU A 69 7.103 -23.294 -6.828 1.00 0.00 N ATOM 1080 CA GLU A 69 5.787 -22.746 -6.456 1.00 0.00 C ATOM 1081 C GLU A 69 5.936 -21.489 -5.583 1.00 0.00 C ATOM 1082 O GLU A 69 6.884 -21.364 -4.809 1.00 0.00 O ATOM 1083 CB GLU A 69 4.959 -23.816 -5.717 1.00 0.00 C ATOM 1084 CG GLU A 69 4.731 -25.088 -6.543 1.00 0.00 C ATOM 1085 CD GLU A 69 3.826 -26.074 -5.775 1.00 0.00 C ATOM 1086 OE1 GLU A 69 4.338 -26.869 -4.948 1.00 0.00 O ATOM 1087 OE2 GLU A 69 2.594 -26.083 -6.011 1.00 0.00 O ATOM 0 H GLU A 69 7.612 -23.686 -6.035 1.00 0.00 H new ATOM 0 HA GLU A 69 5.266 -22.460 -7.370 1.00 0.00 H new ATOM 0 HB2 GLU A 69 5.466 -24.080 -4.789 1.00 0.00 H new ATOM 0 HB3 GLU A 69 3.993 -23.392 -5.443 1.00 0.00 H new ATOM 0 HG2 GLU A 69 4.272 -24.832 -7.498 1.00 0.00 H new ATOM 0 HG3 GLU A 69 5.688 -25.561 -6.766 1.00 0.00 H new ATOM 1094 N ILE A 70 4.985 -20.555 -5.685 1.00 0.00 N ATOM 1095 CA ILE A 70 5.046 -19.204 -5.102 1.00 0.00 C ATOM 1096 C ILE A 70 3.780 -18.983 -4.272 1.00 0.00 C ATOM 1097 O ILE A 70 2.697 -19.359 -4.723 1.00 0.00 O ATOM 1098 CB ILE A 70 5.191 -18.102 -6.182 1.00 0.00 C ATOM 1099 CG1 ILE A 70 6.473 -18.270 -7.027 1.00 0.00 C ATOM 1100 CG2 ILE A 70 5.239 -16.699 -5.538 1.00 0.00 C ATOM 1101 CD1 ILE A 70 6.343 -19.229 -8.206 1.00 0.00 C ATOM 0 H ILE A 70 4.117 -20.722 -6.195 1.00 0.00 H new ATOM 0 HA ILE A 70 5.933 -19.133 -4.473 1.00 0.00 H new ATOM 0 HB ILE A 70 4.318 -18.203 -6.827 1.00 0.00 H new ATOM 0 HG12 ILE A 70 6.773 -17.292 -7.404 1.00 0.00 H new ATOM 0 HG13 ILE A 70 7.275 -18.621 -6.378 1.00 0.00 H new ATOM 0 HG21 ILE A 70 5.341 -15.944 -6.318 1.00 0.00 H new ATOM 0 HG22 ILE A 70 4.319 -16.523 -4.981 1.00 0.00 H new ATOM 0 HG23 ILE A 70 6.091 -16.639 -4.861 1.00 0.00 H new ATOM 0 HD11 ILE A 70 7.293 -19.282 -8.739 1.00 0.00 H new ATOM 0 HD12 ILE A 70 6.077 -20.221 -7.841 1.00 0.00 H new ATOM 0 HD13 ILE A 70 5.567 -18.871 -8.882 1.00 0.00 H new ATOM 1113 N LYS A 71 3.893 -18.347 -3.101 1.00 0.00 N ATOM 1114 CA LYS A 71 2.809 -18.218 -2.115 1.00 0.00 C ATOM 1115 C LYS A 71 2.717 -16.822 -1.480 1.00 0.00 C ATOM 1116 O LYS A 71 3.707 -16.097 -1.428 1.00 0.00 O ATOM 1117 CB LYS A 71 2.973 -19.336 -1.071 1.00 0.00 C ATOM 1118 CG LYS A 71 4.216 -19.191 -0.168 1.00 0.00 C ATOM 1119 CD LYS A 71 4.531 -20.468 0.629 1.00 0.00 C ATOM 1120 CE LYS A 71 3.395 -20.856 1.575 1.00 0.00 C ATOM 1121 NZ LYS A 71 3.734 -22.050 2.390 1.00 0.00 N ATOM 0 H LYS A 71 4.759 -17.897 -2.804 1.00 0.00 H new ATOM 0 HA LYS A 71 1.854 -18.333 -2.629 1.00 0.00 H new ATOM 0 HB2 LYS A 71 2.083 -19.361 -0.442 1.00 0.00 H new ATOM 0 HB3 LYS A 71 3.025 -20.294 -1.588 1.00 0.00 H new ATOM 0 HG2 LYS A 71 5.077 -18.932 -0.784 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.060 -18.365 0.526 1.00 0.00 H new ATOM 0 HD2 LYS A 71 4.721 -21.288 -0.063 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.445 -20.319 1.204 1.00 0.00 H new ATOM 0 HE2 LYS A 71 3.171 -20.018 2.235 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.493 -21.056 0.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 2.937 -22.279 3.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 3.923 -22.857 1.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 4.579 -21.851 2.962 1.00 0.00 H new ATOM 1135 N ALA A 72 1.525 -16.449 -1.009 1.00 0.00 N ATOM 1136 CA ALA A 72 1.211 -15.145 -0.402 1.00 0.00 C ATOM 1137 C ALA A 72 2.069 -14.805 0.841 1.00 0.00 C ATOM 1138 O ALA A 72 2.647 -15.693 1.472 1.00 0.00 O ATOM 1139 CB ALA A 72 -0.294 -15.125 -0.068 1.00 0.00 C ATOM 0 H ALA A 72 0.716 -17.070 -1.039 1.00 0.00 H new ATOM 0 HA ALA A 72 1.459 -14.368 -1.125 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.554 -14.168 0.384 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -0.871 -15.263 -0.982 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -0.522 -15.930 0.631 1.00 0.00 H new ATOM 1145 N PRO A 73 2.116 -13.521 1.242 1.00 0.00 N ATOM 1146 CA PRO A 73 2.736 -13.095 2.499 1.00 0.00 C ATOM 1147 C PRO A 73 1.846 -13.335 3.732 1.00 0.00 C ATOM 1148 O PRO A 73 2.326 -13.750 4.791 1.00 0.00 O ATOM 1149 CB PRO A 73 2.934 -11.587 2.313 1.00 0.00 C ATOM 1150 CG PRO A 73 1.742 -11.188 1.439 1.00 0.00 C ATOM 1151 CD PRO A 73 1.667 -12.363 0.473 1.00 0.00 C ATOM 0 HA PRO A 73 3.650 -13.658 2.686 1.00 0.00 H new ATOM 0 HB2 PRO A 73 2.930 -11.059 3.266 1.00 0.00 H new ATOM 0 HB3 PRO A 73 3.884 -11.361 1.828 1.00 0.00 H new ATOM 0 HG2 PRO A 73 0.827 -11.076 2.020 1.00 0.00 H new ATOM 0 HG3 PRO A 73 1.910 -10.243 0.923 1.00 0.00 H new ATOM 0 HD2 PRO A 73 0.651 -12.505 0.104 1.00 0.00 H new ATOM 0 HD3 PRO A 73 2.302 -12.198 -0.397 1.00 0.00 H new ATOM 1159 N PHE A 74 0.550 -13.034 3.599 1.00 0.00 N ATOM 1160 CA PHE A 74 -0.435 -12.943 4.674 1.00 0.00 C ATOM 1161 C PHE A 74 -1.888 -12.988 4.170 1.00 0.00 C ATOM 1162 O PHE A 74 -2.156 -12.866 2.975 1.00 0.00 O ATOM 1163 CB PHE A 74 -0.196 -11.655 5.479 1.00 0.00 C ATOM 1164 CG PHE A 74 -0.258 -10.348 4.675 1.00 0.00 C ATOM 1165 CD1 PHE A 74 -1.487 -9.819 4.230 1.00 0.00 C ATOM 1166 CD2 PHE A 74 0.929 -9.675 4.324 1.00 0.00 C ATOM 1167 CE1 PHE A 74 -1.524 -8.687 3.401 1.00 0.00 C ATOM 1168 CE2 PHE A 74 0.896 -8.532 3.505 1.00 0.00 C ATOM 1169 CZ PHE A 74 -0.332 -8.048 3.033 1.00 0.00 C ATOM 0 H PHE A 74 0.141 -12.837 2.686 1.00 0.00 H new ATOM 0 HA PHE A 74 -0.300 -13.819 5.308 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -0.936 -11.605 6.278 1.00 0.00 H new ATOM 0 HB3 PHE A 74 0.782 -11.722 5.955 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -2.411 -10.291 4.531 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.877 -10.042 4.689 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -2.471 -8.308 3.047 1.00 0.00 H new ATOM 0 HE2 PHE A 74 1.814 -8.029 3.241 1.00 0.00 H new ATOM 0 HZ PHE A 74 -0.360 -7.183 2.386 1.00 0.00 H new ATOM 1179 N ASP A 75 -2.830 -13.139 5.109 1.00 0.00 N ATOM 1180 CA ASP A 75 -4.271 -13.129 4.851 1.00 0.00 C ATOM 1181 C ASP A 75 -4.768 -11.717 4.551 1.00 0.00 C ATOM 1182 O ASP A 75 -4.613 -10.787 5.344 1.00 0.00 O ATOM 1183 CB ASP A 75 -5.005 -13.690 6.056 1.00 0.00 C ATOM 1184 CG ASP A 75 -6.520 -13.837 5.891 1.00 0.00 C ATOM 1185 OD1 ASP A 75 -7.221 -12.804 5.917 1.00 0.00 O ATOM 1186 OD2 ASP A 75 -6.995 -14.996 5.829 1.00 0.00 O ATOM 0 H ASP A 75 -2.603 -13.275 6.094 1.00 0.00 H new ATOM 0 HA ASP A 75 -4.469 -13.749 3.977 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -4.586 -14.668 6.293 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -4.811 -13.044 6.912 1.00 0.00 H new ATOM 1191 N GLY A 76 -5.377 -11.570 3.391 1.00 0.00 N ATOM 1192 CA GLY A 76 -5.714 -10.273 2.819 1.00 0.00 C ATOM 1193 C GLY A 76 -6.454 -10.395 1.499 1.00 0.00 C ATOM 1194 O GLY A 76 -7.065 -11.421 1.191 1.00 0.00 O ATOM 0 H GLY A 76 -5.658 -12.358 2.807 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -6.328 -9.716 3.526 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -4.801 -9.698 2.668 1.00 0.00 H new ATOM 1198 N THR A 77 -6.375 -9.324 0.723 1.00 0.00 N ATOM 1199 CA THR A 77 -7.074 -9.190 -0.558 1.00 0.00 C ATOM 1200 C THR A 77 -6.067 -8.773 -1.596 1.00 0.00 C ATOM 1201 O THR A 77 -5.295 -7.833 -1.410 1.00 0.00 O ATOM 1202 CB THR A 77 -8.194 -8.152 -0.514 1.00 0.00 C ATOM 1203 OG1 THR A 77 -8.981 -8.307 0.644 1.00 0.00 O ATOM 1204 CG2 THR A 77 -9.146 -8.248 -1.704 1.00 0.00 C ATOM 0 H THR A 77 -5.815 -8.507 0.965 1.00 0.00 H new ATOM 0 HA THR A 77 -7.532 -10.150 -0.795 1.00 0.00 H new ATOM 0 HB THR A 77 -7.686 -7.188 -0.530 1.00 0.00 H new ATOM 0 HG1 THR A 77 -8.524 -7.896 1.407 1.00 0.00 H new ATOM 0 HG21 THR A 77 -9.919 -7.485 -1.614 1.00 0.00 H new ATOM 0 HG22 THR A 77 -8.589 -8.094 -2.629 1.00 0.00 H new ATOM 0 HG23 THR A 77 -9.610 -9.234 -1.720 1.00 0.00 H new ATOM 1212 N ILE A 78 -6.045 -9.508 -2.692 1.00 0.00 N ATOM 1213 CA ILE A 78 -4.984 -9.444 -3.690 1.00 0.00 C ATOM 1214 C ILE A 78 -5.484 -8.635 -4.903 1.00 0.00 C ATOM 1215 O ILE A 78 -6.689 -8.539 -5.143 1.00 0.00 O ATOM 1216 CB ILE A 78 -4.584 -10.909 -3.997 1.00 0.00 C ATOM 1217 CG1 ILE A 78 -3.138 -11.038 -4.485 1.00 0.00 C ATOM 1218 CG2 ILE A 78 -5.574 -11.603 -4.948 1.00 0.00 C ATOM 1219 CD1 ILE A 78 -2.534 -12.432 -4.410 1.00 0.00 C ATOM 0 H ILE A 78 -6.777 -10.181 -2.922 1.00 0.00 H new ATOM 0 HA ILE A 78 -4.090 -8.921 -3.351 1.00 0.00 H new ATOM 0 HB ILE A 78 -4.639 -11.437 -3.045 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -3.092 -10.698 -5.520 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -2.516 -10.361 -3.900 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -5.247 -12.627 -5.130 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -6.566 -11.614 -4.496 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -5.612 -11.061 -5.893 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -1.509 -12.405 -4.781 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -2.537 -12.775 -3.375 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -3.123 -13.117 -5.020 1.00 0.00 H new ATOM 1231 N GLY A 79 -4.582 -8.005 -5.652 1.00 0.00 N ATOM 1232 CA GLY A 79 -4.926 -7.180 -6.814 1.00 0.00 C ATOM 1233 C GLY A 79 -5.149 -8.007 -8.079 1.00 0.00 C ATOM 1234 O GLY A 79 -5.209 -9.239 -8.043 1.00 0.00 O ATOM 0 H GLY A 79 -3.580 -8.052 -5.469 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -5.828 -6.609 -6.595 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.128 -6.459 -6.992 1.00 0.00 H new ATOM 1238 N ASP A 80 -5.271 -7.339 -9.225 1.00 0.00 N ATOM 1239 CA ASP A 80 -5.249 -7.980 -10.519 1.00 0.00 C ATOM 1240 C ASP A 80 -3.846 -8.525 -10.837 1.00 0.00 C ATOM 1241 O ASP A 80 -2.824 -7.916 -10.507 1.00 0.00 O ATOM 1242 CB ASP A 80 -5.652 -6.941 -11.553 1.00 0.00 C ATOM 1243 CG ASP A 80 -7.066 -6.381 -11.339 1.00 0.00 C ATOM 1244 OD1 ASP A 80 -8.051 -7.088 -11.659 1.00 0.00 O ATOM 1245 OD2 ASP A 80 -7.195 -5.231 -10.853 1.00 0.00 O ATOM 0 H ASP A 80 -5.389 -6.327 -9.271 1.00 0.00 H new ATOM 0 HA ASP A 80 -5.939 -8.824 -10.529 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -4.937 -6.119 -11.529 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -5.592 -7.386 -12.546 1.00 0.00 H new ATOM 1250 N ALA A 81 -3.800 -9.672 -11.510 1.00 0.00 N ATOM 1251 CA ALA A 81 -2.549 -10.314 -11.894 1.00 0.00 C ATOM 1252 C ALA A 81 -1.731 -9.437 -12.868 1.00 0.00 C ATOM 1253 O ALA A 81 -2.291 -8.693 -13.676 1.00 0.00 O ATOM 1254 CB ALA A 81 -2.850 -11.676 -12.525 1.00 0.00 C ATOM 0 H ALA A 81 -4.632 -10.183 -11.804 1.00 0.00 H new ATOM 0 HA ALA A 81 -1.944 -10.450 -10.997 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -1.916 -12.158 -12.813 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.375 -12.303 -11.804 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -3.474 -11.538 -13.408 1.00 0.00 H new ATOM 1260 N LEU A 82 -0.407 -9.596 -12.846 1.00 0.00 N ATOM 1261 CA LEU A 82 0.556 -8.861 -13.685 1.00 0.00 C ATOM 1262 C LEU A 82 1.372 -9.794 -14.610 1.00 0.00 C ATOM 1263 O LEU A 82 2.280 -9.340 -15.310 1.00 0.00 O ATOM 1264 CB LEU A 82 1.434 -7.987 -12.776 1.00 0.00 C ATOM 1265 CG LEU A 82 0.752 -6.968 -11.862 1.00 0.00 C ATOM 1266 CD1 LEU A 82 1.747 -6.395 -10.849 1.00 0.00 C ATOM 1267 CD2 LEU A 82 0.245 -5.860 -12.741 1.00 0.00 C ATOM 0 H LEU A 82 0.047 -10.264 -12.222 1.00 0.00 H new ATOM 0 HA LEU A 82 0.013 -8.211 -14.371 1.00 0.00 H new ATOM 0 HB2 LEU A 82 2.025 -8.653 -12.147 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.133 -7.445 -13.413 1.00 0.00 H new ATOM 0 HG LEU A 82 -0.057 -7.443 -11.306 1.00 0.00 H new ATOM 0 HD11 LEU A 82 1.240 -5.673 -10.210 1.00 0.00 H new ATOM 0 HD12 LEU A 82 2.149 -7.202 -10.237 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.562 -5.902 -11.379 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -0.251 -5.107 -12.128 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.082 -5.403 -13.270 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -0.464 -6.264 -13.464 1.00 0.00 H new ATOM 1279 N VAL A 83 1.019 -11.085 -14.637 1.00 0.00 N ATOM 1280 CA VAL A 83 1.679 -12.183 -15.369 1.00 0.00 C ATOM 1281 C VAL A 83 0.655 -13.225 -15.814 1.00 0.00 C ATOM 1282 O VAL A 83 -0.412 -13.364 -15.214 1.00 0.00 O ATOM 1283 CB VAL A 83 2.754 -12.868 -14.500 1.00 0.00 C ATOM 1284 CG1 VAL A 83 3.842 -11.897 -14.054 1.00 0.00 C ATOM 1285 CG2 VAL A 83 2.207 -13.553 -13.241 1.00 0.00 C ATOM 0 H VAL A 83 0.209 -11.417 -14.113 1.00 0.00 H new ATOM 0 HA VAL A 83 2.159 -11.747 -16.245 1.00 0.00 H new ATOM 0 HB VAL A 83 3.163 -13.631 -15.162 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.575 -12.426 -13.445 1.00 0.00 H new ATOM 0 HG12 VAL A 83 4.335 -11.475 -14.930 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.395 -11.094 -13.467 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.029 -14.009 -12.689 1.00 0.00 H new ATOM 0 HG22 VAL A 83 1.712 -12.814 -12.611 1.00 0.00 H new ATOM 0 HG23 VAL A 83 1.491 -14.323 -13.528 1.00 0.00 H new ATOM 1295 N ASN A 84 0.998 -13.999 -16.836 1.00 0.00 N ATOM 1296 CA ASN A 84 0.200 -15.067 -17.416 1.00 0.00 C ATOM 1297 C ASN A 84 1.081 -16.296 -17.651 1.00 0.00 C ATOM 1298 O ASN A 84 2.307 -16.202 -17.636 1.00 0.00 O ATOM 1299 CB ASN A 84 -0.333 -14.615 -18.781 1.00 0.00 C ATOM 1300 CG ASN A 84 -0.890 -13.206 -18.846 1.00 0.00 C ATOM 1301 OD1 ASN A 84 -2.072 -12.959 -18.634 1.00 0.00 O ATOM 1302 ND2 ASN A 84 -0.071 -12.240 -19.164 1.00 0.00 N ATOM 0 H ASN A 84 1.895 -13.890 -17.309 1.00 0.00 H new ATOM 0 HA ASN A 84 -0.619 -15.305 -16.737 1.00 0.00 H new ATOM 0 HB2 ASN A 84 0.474 -14.699 -19.509 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -1.115 -15.308 -19.090 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -0.415 -11.282 -19.236 1.00 0.00 H new ATOM 0 HD22 ASN A 84 0.913 -12.443 -19.341 1.00 0.00 H new ATOM 1309 N ILE A 85 0.460 -17.434 -17.930 1.00 0.00 N ATOM 1310 CA ILE A 85 1.093 -18.709 -18.273 1.00 0.00 C ATOM 1311 C ILE A 85 2.034 -18.518 -19.473 1.00 0.00 C ATOM 1312 O ILE A 85 1.596 -18.372 -20.618 1.00 0.00 O ATOM 1313 CB ILE A 85 -0.015 -19.738 -18.561 1.00 0.00 C ATOM 1314 CG1 ILE A 85 -0.894 -20.081 -17.325 1.00 0.00 C ATOM 1315 CG2 ILE A 85 0.575 -21.068 -19.068 1.00 0.00 C ATOM 1316 CD1 ILE A 85 -1.785 -18.969 -16.750 1.00 0.00 C ATOM 0 H ILE A 85 -0.558 -17.500 -17.924 1.00 0.00 H new ATOM 0 HA ILE A 85 1.701 -19.077 -17.447 1.00 0.00 H new ATOM 0 HB ILE A 85 -0.637 -19.258 -19.316 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -1.536 -20.920 -17.593 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -0.234 -20.426 -16.530 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -0.233 -21.774 -19.262 1.00 0.00 H new ATOM 0 HG22 ILE A 85 1.132 -20.892 -19.988 1.00 0.00 H new ATOM 0 HG23 ILE A 85 1.244 -21.481 -18.313 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -2.339 -19.353 -15.893 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -1.163 -18.131 -16.434 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -2.486 -18.633 -17.514 1.00 0.00 H new ATOM 1328 N GLY A 86 3.334 -18.487 -19.195 1.00 0.00 N ATOM 1329 CA GLY A 86 4.421 -18.362 -20.168 1.00 0.00 C ATOM 1330 C GLY A 86 5.226 -17.070 -20.006 1.00 0.00 C ATOM 1331 O GLY A 86 6.251 -16.915 -20.664 1.00 0.00 O ATOM 0 H GLY A 86 3.678 -18.551 -18.237 1.00 0.00 H new ATOM 0 HA2 GLY A 86 5.091 -19.216 -20.067 1.00 0.00 H new ATOM 0 HA3 GLY A 86 4.006 -18.400 -21.175 1.00 0.00 H new ATOM 1335 N ASP A 87 4.797 -16.141 -19.143 1.00 0.00 N ATOM 1336 CA ASP A 87 5.546 -14.910 -18.876 1.00 0.00 C ATOM 1337 C ASP A 87 6.860 -15.192 -18.136 1.00 0.00 C ATOM 1338 O ASP A 87 6.853 -15.753 -17.039 1.00 0.00 O ATOM 1339 CB ASP A 87 4.690 -13.917 -18.075 1.00 0.00 C ATOM 1340 CG ASP A 87 3.900 -12.962 -18.977 1.00 0.00 C ATOM 1341 OD1 ASP A 87 4.523 -12.243 -19.795 1.00 0.00 O ATOM 1342 OD2 ASP A 87 2.654 -12.904 -18.849 1.00 0.00 O ATOM 0 H ASP A 87 3.928 -16.221 -18.615 1.00 0.00 H new ATOM 0 HA ASP A 87 5.795 -14.467 -19.840 1.00 0.00 H new ATOM 0 HB2 ASP A 87 3.997 -14.469 -17.441 1.00 0.00 H new ATOM 0 HB3 ASP A 87 5.334 -13.338 -17.414 1.00 0.00 H new ATOM 1347 N TYR A 88 7.987 -14.787 -18.730 1.00 0.00 N ATOM 1348 CA TYR A 88 9.292 -14.774 -18.066 1.00 0.00 C ATOM 1349 C TYR A 88 9.314 -13.776 -16.896 1.00 0.00 C ATOM 1350 O TYR A 88 8.842 -12.641 -17.012 1.00 0.00 O ATOM 1351 CB TYR A 88 10.392 -14.485 -19.091 1.00 0.00 C ATOM 1352 CG TYR A 88 11.744 -14.411 -18.418 1.00 0.00 C ATOM 1353 CD1 TYR A 88 12.328 -15.601 -17.944 1.00 0.00 C ATOM 1354 CD2 TYR A 88 12.327 -13.167 -18.101 1.00 0.00 C ATOM 1355 CE1 TYR A 88 13.469 -15.555 -17.130 1.00 0.00 C ATOM 1356 CE2 TYR A 88 13.485 -13.120 -17.301 1.00 0.00 C ATOM 1357 CZ TYR A 88 14.062 -14.314 -16.809 1.00 0.00 C ATOM 1358 OH TYR A 88 15.180 -14.255 -16.035 1.00 0.00 O ATOM 0 H TYR A 88 8.018 -14.456 -19.694 1.00 0.00 H new ATOM 0 HA TYR A 88 9.480 -15.758 -17.636 1.00 0.00 H new ATOM 0 HB2 TYR A 88 10.401 -15.266 -19.852 1.00 0.00 H new ATOM 0 HB3 TYR A 88 10.182 -13.545 -19.601 1.00 0.00 H new ATOM 0 HD1 TYR A 88 11.895 -16.554 -18.209 1.00 0.00 H new ATOM 0 HD2 TYR A 88 11.887 -12.253 -18.471 1.00 0.00 H new ATOM 0 HE1 TYR A 88 13.895 -16.471 -16.748 1.00 0.00 H new ATOM 0 HE2 TYR A 88 13.935 -12.168 -17.062 1.00 0.00 H new ATOM 0 HH TYR A 88 15.448 -13.320 -15.919 1.00 0.00 H new ATOM 1368 N VAL A 89 9.894 -14.214 -15.781 1.00 0.00 N ATOM 1369 CA VAL A 89 10.011 -13.494 -14.511 1.00 0.00 C ATOM 1370 C VAL A 89 11.362 -13.755 -13.836 1.00 0.00 C ATOM 1371 O VAL A 89 12.002 -14.792 -14.034 1.00 0.00 O ATOM 1372 CB VAL A 89 8.876 -13.859 -13.532 1.00 0.00 C ATOM 1373 CG1 VAL A 89 7.521 -13.346 -14.021 1.00 0.00 C ATOM 1374 CG2 VAL A 89 8.746 -15.358 -13.264 1.00 0.00 C ATOM 0 H VAL A 89 10.322 -15.139 -15.735 1.00 0.00 H new ATOM 0 HA VAL A 89 9.933 -12.435 -14.756 1.00 0.00 H new ATOM 0 HB VAL A 89 9.158 -13.370 -12.600 1.00 0.00 H new ATOM 0 HG11 VAL A 89 6.747 -13.623 -13.305 1.00 0.00 H new ATOM 0 HG12 VAL A 89 7.556 -12.261 -14.116 1.00 0.00 H new ATOM 0 HG13 VAL A 89 7.293 -13.788 -14.991 1.00 0.00 H new ATOM 0 HG21 VAL A 89 7.927 -15.533 -12.567 1.00 0.00 H new ATOM 0 HG22 VAL A 89 8.544 -15.879 -14.200 1.00 0.00 H new ATOM 0 HG23 VAL A 89 9.675 -15.733 -12.834 1.00 0.00 H new ATOM 1384 N SER A 90 11.772 -12.829 -12.979 1.00 0.00 N ATOM 1385 CA SER A 90 13.028 -12.855 -12.229 1.00 0.00 C ATOM 1386 C SER A 90 12.768 -12.500 -10.759 1.00 0.00 C ATOM 1387 O SER A 90 11.884 -11.696 -10.447 1.00 0.00 O ATOM 1388 CB SER A 90 14.004 -11.922 -12.929 1.00 0.00 C ATOM 1389 OG SER A 90 15.098 -11.597 -12.087 1.00 0.00 O ATOM 0 H SER A 90 11.214 -11.999 -12.776 1.00 0.00 H new ATOM 0 HA SER A 90 13.473 -13.850 -12.212 1.00 0.00 H new ATOM 0 HB2 SER A 90 14.371 -12.393 -13.841 1.00 0.00 H new ATOM 0 HB3 SER A 90 13.488 -11.009 -13.227 1.00 0.00 H new ATOM 0 HG SER A 90 15.099 -10.633 -11.910 1.00 0.00 H new ATOM 1395 N ALA A 91 13.536 -13.115 -9.854 1.00 0.00 N ATOM 1396 CA ALA A 91 13.267 -13.170 -8.412 1.00 0.00 C ATOM 1397 C ALA A 91 13.090 -11.885 -7.615 1.00 0.00 C ATOM 1398 O ALA A 91 12.480 -11.905 -6.544 1.00 0.00 O ATOM 1399 CB ALA A 91 14.249 -14.143 -7.762 1.00 0.00 C ATOM 0 H ALA A 91 14.392 -13.605 -10.113 1.00 0.00 H new ATOM 0 HA ALA A 91 12.237 -13.525 -8.364 1.00 0.00 H new ATOM 0 HB1 ALA A 91 14.058 -14.191 -6.690 1.00 0.00 H new ATOM 0 HB2 ALA A 91 14.122 -15.134 -8.198 1.00 0.00 H new ATOM 0 HB3 ALA A 91 15.269 -13.799 -7.933 1.00 0.00 H new ATOM 1405 N SER A 92 13.595 -10.768 -8.106 1.00 0.00 N ATOM 1406 CA SER A 92 13.190 -9.461 -7.576 1.00 0.00 C ATOM 1407 C SER A 92 12.839 -8.448 -8.668 1.00 0.00 C ATOM 1408 O SER A 92 12.422 -7.325 -8.374 1.00 0.00 O ATOM 1409 CB SER A 92 14.239 -8.910 -6.600 1.00 0.00 C ATOM 1410 OG SER A 92 15.482 -8.720 -7.252 1.00 0.00 O ATOM 0 H SER A 92 14.279 -10.729 -8.862 1.00 0.00 H new ATOM 0 HA SER A 92 12.267 -9.626 -7.021 1.00 0.00 H new ATOM 0 HB2 SER A 92 13.893 -7.964 -6.184 1.00 0.00 H new ATOM 0 HB3 SER A 92 14.363 -9.599 -5.765 1.00 0.00 H new ATOM 0 HG SER A 92 16.136 -8.367 -6.613 1.00 0.00 H new ATOM 1416 N THR A 93 12.980 -8.836 -9.936 1.00 0.00 N ATOM 1417 CA THR A 93 12.933 -7.904 -11.086 1.00 0.00 C ATOM 1418 C THR A 93 11.559 -7.826 -11.766 1.00 0.00 C ATOM 1419 O THR A 93 11.295 -6.905 -12.540 1.00 0.00 O ATOM 1420 CB THR A 93 14.008 -8.265 -12.133 1.00 0.00 C ATOM 1421 OG1 THR A 93 15.219 -8.669 -11.520 1.00 0.00 O ATOM 1422 CG2 THR A 93 14.368 -7.114 -13.069 1.00 0.00 C ATOM 0 H THR A 93 13.131 -9.808 -10.206 1.00 0.00 H new ATOM 0 HA THR A 93 13.135 -6.918 -10.668 1.00 0.00 H new ATOM 0 HB THR A 93 13.554 -9.073 -12.706 1.00 0.00 H new ATOM 0 HG1 THR A 93 15.877 -8.892 -12.211 1.00 0.00 H new ATOM 0 HG21 THR A 93 15.129 -7.444 -13.776 1.00 0.00 H new ATOM 0 HG22 THR A 93 13.479 -6.797 -13.615 1.00 0.00 H new ATOM 0 HG23 THR A 93 14.753 -6.278 -12.486 1.00 0.00 H new ATOM 1430 N THR A 94 10.663 -8.774 -11.483 1.00 0.00 N ATOM 1431 CA THR A 94 9.400 -8.958 -12.196 1.00 0.00 C ATOM 1432 C THR A 94 8.343 -9.319 -11.180 1.00 0.00 C ATOM 1433 O THR A 94 8.467 -10.257 -10.386 1.00 0.00 O ATOM 1434 CB THR A 94 9.485 -10.036 -13.280 1.00 0.00 C ATOM 1435 OG1 THR A 94 10.780 -10.168 -13.834 1.00 0.00 O ATOM 1436 CG2 THR A 94 8.541 -9.696 -14.429 1.00 0.00 C ATOM 0 H THR A 94 10.800 -9.451 -10.733 1.00 0.00 H new ATOM 0 HA THR A 94 9.151 -8.030 -12.710 1.00 0.00 H new ATOM 0 HB THR A 94 9.215 -10.971 -12.790 1.00 0.00 H new ATOM 0 HG1 THR A 94 10.709 -10.309 -14.801 1.00 0.00 H new ATOM 0 HG21 THR A 94 8.608 -10.468 -15.196 1.00 0.00 H new ATOM 0 HG22 THR A 94 7.518 -9.643 -14.056 1.00 0.00 H new ATOM 0 HG23 THR A 94 8.821 -8.734 -14.858 1.00 0.00 H new ATOM 1444 N GLU A 95 7.334 -8.471 -11.167 1.00 0.00 N ATOM 1445 CA GLU A 95 6.341 -8.385 -10.125 1.00 0.00 C ATOM 1446 C GLU A 95 5.031 -9.024 -10.584 1.00 0.00 C ATOM 1447 O GLU A 95 4.511 -8.726 -11.660 1.00 0.00 O ATOM 1448 CB GLU A 95 6.259 -6.935 -9.625 1.00 0.00 C ATOM 1449 CG GLU A 95 7.330 -5.966 -10.159 1.00 0.00 C ATOM 1450 CD GLU A 95 7.328 -4.614 -9.432 1.00 0.00 C ATOM 1451 OE1 GLU A 95 6.469 -3.754 -9.735 1.00 0.00 O ATOM 1452 OE2 GLU A 95 8.219 -4.401 -8.574 1.00 0.00 O ATOM 0 H GLU A 95 7.181 -7.796 -11.916 1.00 0.00 H new ATOM 0 HA GLU A 95 6.620 -8.971 -9.249 1.00 0.00 H new ATOM 0 HB2 GLU A 95 5.278 -6.538 -9.887 1.00 0.00 H new ATOM 0 HB3 GLU A 95 6.319 -6.945 -8.537 1.00 0.00 H new ATOM 0 HG2 GLU A 95 8.313 -6.426 -10.057 1.00 0.00 H new ATOM 0 HG3 GLU A 95 7.165 -5.801 -11.224 1.00 0.00 H new ATOM 1459 N LEU A 96 4.519 -9.939 -9.761 1.00 0.00 N ATOM 1460 CA LEU A 96 3.448 -10.873 -10.142 1.00 0.00 C ATOM 1461 C LEU A 96 2.017 -10.373 -9.876 1.00 0.00 C ATOM 1462 O LEU A 96 1.125 -10.643 -10.677 1.00 0.00 O ATOM 1463 CB LEU A 96 3.653 -12.198 -9.396 1.00 0.00 C ATOM 1464 CG LEU A 96 5.092 -12.769 -9.409 1.00 0.00 C ATOM 1465 CD1 LEU A 96 5.271 -13.815 -8.320 1.00 0.00 C ATOM 1466 CD2 LEU A 96 5.434 -13.388 -10.758 1.00 0.00 C ATOM 0 H LEU A 96 4.837 -10.058 -8.799 1.00 0.00 H new ATOM 0 HA LEU A 96 3.528 -10.986 -11.223 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.348 -12.059 -8.359 1.00 0.00 H new ATOM 0 HB3 LEU A 96 2.984 -12.942 -9.828 1.00 0.00 H new ATOM 0 HG LEU A 96 5.768 -11.934 -9.224 1.00 0.00 H new ATOM 0 HD11 LEU A 96 6.290 -14.201 -8.350 1.00 0.00 H new ATOM 0 HD12 LEU A 96 5.083 -13.362 -7.346 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.569 -14.633 -8.482 1.00 0.00 H new ATOM 0 HD21 LEU A 96 6.451 -13.779 -10.732 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.739 -14.200 -10.973 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.357 -12.629 -11.537 1.00 0.00 H new ATOM 1478 N VAL A 97 1.813 -9.660 -8.762 1.00 0.00 N ATOM 1479 CA VAL A 97 0.543 -9.071 -8.268 1.00 0.00 C ATOM 1480 C VAL A 97 0.778 -8.375 -6.913 1.00 0.00 C ATOM 1481 O VAL A 97 1.771 -8.653 -6.250 1.00 0.00 O ATOM 1482 CB VAL A 97 -0.591 -10.112 -8.176 1.00 0.00 C ATOM 1483 CG1 VAL A 97 -0.275 -11.300 -7.288 1.00 0.00 C ATOM 1484 CG2 VAL A 97 -1.881 -9.505 -7.647 1.00 0.00 C ATOM 0 H VAL A 97 2.585 -9.459 -8.127 1.00 0.00 H new ATOM 0 HA VAL A 97 0.216 -8.327 -8.995 1.00 0.00 H new ATOM 0 HB VAL A 97 -0.703 -10.454 -9.205 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.124 -11.983 -7.279 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.603 -11.818 -7.673 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -0.077 -10.954 -6.274 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.652 -10.274 -7.599 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.710 -9.100 -6.650 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -2.207 -8.706 -8.313 1.00 0.00 H new ATOM 1494 N ARG A 98 -0.125 -7.501 -6.454 1.00 0.00 N ATOM 1495 CA ARG A 98 -0.099 -6.892 -5.105 1.00 0.00 C ATOM 1496 C ARG A 98 -1.003 -7.585 -4.066 1.00 0.00 C ATOM 1497 O ARG A 98 -2.053 -8.060 -4.486 1.00 0.00 O ATOM 1498 CB ARG A 98 -0.431 -5.400 -5.266 1.00 0.00 C ATOM 1499 CG ARG A 98 -1.902 -5.055 -5.294 1.00 0.00 C ATOM 1500 CD ARG A 98 -2.293 -4.620 -3.891 1.00 0.00 C ATOM 1501 NE ARG A 98 -3.758 -4.467 -3.763 1.00 0.00 N ATOM 1502 CZ ARG A 98 -4.469 -3.371 -3.951 1.00 0.00 C ATOM 1503 NH1 ARG A 98 -3.917 -2.231 -4.259 1.00 0.00 N ATOM 1504 NH2 ARG A 98 -5.765 -3.401 -3.848 1.00 0.00 N ATOM 0 H ARG A 98 -0.915 -7.186 -7.017 1.00 0.00 H new ATOM 0 HA ARG A 98 0.899 -7.026 -4.688 1.00 0.00 H new ATOM 0 HB2 ARG A 98 0.036 -4.852 -4.448 1.00 0.00 H new ATOM 0 HB3 ARG A 98 0.025 -5.043 -6.190 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -2.096 -4.257 -6.011 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -2.492 -5.916 -5.608 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -1.938 -5.355 -3.168 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -1.805 -3.675 -3.652 1.00 0.00 H new ATOM 0 HE ARG A 98 -4.278 -5.304 -3.499 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -2.904 -2.166 -4.362 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -4.498 -1.404 -4.397 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -6.238 -4.275 -3.621 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -6.308 -2.550 -3.995 1.00 0.00 H new ATOM 1518 N VAL A 99 -0.737 -7.601 -2.747 1.00 0.00 N ATOM 1519 CA VAL A 99 -1.817 -7.937 -1.770 1.00 0.00 C ATOM 1520 C VAL A 99 -1.774 -6.982 -0.594 1.00 0.00 C ATOM 1521 O VAL A 99 -0.742 -6.397 -0.263 1.00 0.00 O ATOM 1522 CB VAL A 99 -1.923 -9.421 -1.347 1.00 0.00 C ATOM 1523 CG1 VAL A 99 -0.872 -9.902 -0.425 1.00 0.00 C ATOM 1524 CG2 VAL A 99 -3.205 -9.898 -0.638 1.00 0.00 C ATOM 0 H VAL A 99 0.173 -7.396 -2.334 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.752 -7.794 -2.312 1.00 0.00 H new ATOM 0 HB VAL A 99 -1.857 -9.825 -2.357 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.043 -10.954 -0.195 1.00 0.00 H new ATOM 0 HG12 VAL A 99 0.105 -9.788 -0.895 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.901 -9.320 0.496 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -3.120 -10.960 -0.409 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -3.340 -9.337 0.287 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -4.063 -9.735 -1.290 1.00 0.00 H new ATOM 1534 N THR A 100 -2.942 -6.760 -0.018 1.00 0.00 N ATOM 1535 CA THR A 100 -3.200 -5.736 0.982 1.00 0.00 C ATOM 1536 C THR A 100 -4.146 -6.263 2.056 1.00 0.00 C ATOM 1537 O THR A 100 -5.000 -7.110 1.788 1.00 0.00 O ATOM 1538 CB THR A 100 -3.706 -4.480 0.260 1.00 0.00 C ATOM 1539 OG1 THR A 100 -3.866 -3.414 1.169 1.00 0.00 O ATOM 1540 CG2 THR A 100 -5.039 -4.712 -0.456 1.00 0.00 C ATOM 0 H THR A 100 -3.771 -7.310 -0.242 1.00 0.00 H new ATOM 0 HA THR A 100 -2.290 -5.464 1.517 1.00 0.00 H new ATOM 0 HB THR A 100 -2.951 -4.233 -0.487 1.00 0.00 H new ATOM 0 HG1 THR A 100 -4.187 -2.621 0.690 1.00 0.00 H new ATOM 0 HG21 THR A 100 -5.352 -3.792 -0.950 1.00 0.00 H new ATOM 0 HG22 THR A 100 -4.921 -5.501 -1.199 1.00 0.00 H new ATOM 0 HG23 THR A 100 -5.795 -5.009 0.271 1.00 0.00 H new ATOM 1548 N ASN A 101 -3.969 -5.822 3.293 1.00 0.00 N ATOM 1549 CA ASN A 101 -4.722 -6.316 4.439 1.00 0.00 C ATOM 1550 C ASN A 101 -5.834 -5.327 4.823 1.00 0.00 C ATOM 1551 O ASN A 101 -5.588 -4.218 5.302 1.00 0.00 O ATOM 1552 CB ASN A 101 -3.739 -6.617 5.577 1.00 0.00 C ATOM 1553 CG ASN A 101 -4.422 -6.729 6.930 1.00 0.00 C ATOM 1554 OD1 ASN A 101 -4.179 -5.946 7.837 1.00 0.00 O ATOM 1555 ND2 ASN A 101 -5.295 -7.693 7.116 1.00 0.00 N ATOM 0 H ASN A 101 -3.289 -5.101 3.533 1.00 0.00 H new ATOM 0 HA ASN A 101 -5.236 -7.246 4.196 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -3.215 -7.548 5.361 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -2.986 -5.830 5.619 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -5.768 -7.786 8.015 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -5.500 -8.348 6.361 1.00 0.00 H new ATOM 1562 N LEU A 102 -7.066 -5.767 4.584 1.00 0.00 N ATOM 1563 CA LEU A 102 -8.308 -5.138 5.036 1.00 0.00 C ATOM 1564 C LEU A 102 -8.445 -5.114 6.580 1.00 0.00 C ATOM 1565 O LEU A 102 -7.629 -5.678 7.309 1.00 0.00 O ATOM 1566 CB LEU A 102 -9.459 -5.925 4.376 1.00 0.00 C ATOM 1567 CG LEU A 102 -9.670 -5.639 2.882 1.00 0.00 C ATOM 1568 CD1 LEU A 102 -10.842 -6.505 2.428 1.00 0.00 C ATOM 1569 CD2 LEU A 102 -9.991 -4.178 2.569 1.00 0.00 C ATOM 0 H LEU A 102 -7.236 -6.615 4.043 1.00 0.00 H new ATOM 0 HA LEU A 102 -8.324 -4.089 4.742 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -9.269 -6.991 4.503 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -10.384 -5.700 4.907 1.00 0.00 H new ATOM 0 HG LEU A 102 -8.739 -5.863 2.361 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -11.031 -6.335 1.368 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -10.602 -7.556 2.590 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -11.731 -6.243 3.001 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -10.126 -4.057 1.494 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -10.907 -3.888 3.084 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -9.170 -3.545 2.905 1.00 0.00 H new ATOM 1581 N ASN A 103 -9.498 -4.458 7.075 1.00 0.00 N ATOM 1582 CA ASN A 103 -9.824 -4.369 8.506 1.00 0.00 C ATOM 1583 C ASN A 103 -9.949 -5.767 9.170 1.00 0.00 C ATOM 1584 O ASN A 103 -10.249 -6.746 8.481 1.00 0.00 O ATOM 1585 CB ASN A 103 -11.106 -3.531 8.677 1.00 0.00 C ATOM 1586 CG ASN A 103 -11.035 -2.147 8.047 1.00 0.00 C ATOM 1587 OD1 ASN A 103 -10.022 -1.457 8.083 1.00 0.00 O ATOM 1588 ND2 ASN A 103 -12.106 -1.686 7.440 1.00 0.00 N ATOM 0 H ASN A 103 -10.164 -3.962 6.482 1.00 0.00 H new ATOM 0 HA ASN A 103 -9.003 -3.873 9.023 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -11.943 -4.075 8.239 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -11.317 -3.423 9.741 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -12.089 -0.763 7.005 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -12.954 -2.251 7.404 1.00 0.00 H new ATOM 1595 N PRO A 104 -9.811 -5.888 10.509 1.00 0.00 N ATOM 1596 CA PRO A 104 -9.666 -7.177 11.196 1.00 0.00 C ATOM 1597 C PRO A 104 -10.956 -8.014 11.318 1.00 0.00 C ATOM 1598 O PRO A 104 -10.968 -9.084 11.931 1.00 0.00 O ATOM 1599 CB PRO A 104 -9.011 -6.837 12.539 1.00 0.00 C ATOM 1600 CG PRO A 104 -9.514 -5.430 12.841 1.00 0.00 C ATOM 1601 CD PRO A 104 -9.719 -4.794 11.465 1.00 0.00 C ATOM 0 HA PRO A 104 -9.050 -7.854 10.604 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -9.303 -7.542 13.317 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -7.923 -6.868 12.473 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -10.444 -5.454 13.410 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -8.792 -4.869 13.434 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -10.625 -4.189 11.449 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -8.889 -4.132 11.217 1.00 0.00 H new ATOM 1609 N ILE A 105 -12.029 -7.537 10.695 1.00 0.00 N ATOM 1610 CA ILE A 105 -13.318 -8.218 10.499 1.00 0.00 C ATOM 1611 C ILE A 105 -13.482 -8.796 9.079 1.00 0.00 C ATOM 1612 O ILE A 105 -14.476 -9.465 8.796 1.00 0.00 O ATOM 1613 CB ILE A 105 -14.470 -7.246 10.850 1.00 0.00 C ATOM 1614 CG1 ILE A 105 -14.332 -5.893 10.114 1.00 0.00 C ATOM 1615 CG2 ILE A 105 -14.524 -7.035 12.371 1.00 0.00 C ATOM 1616 CD1 ILE A 105 -15.639 -5.088 10.086 1.00 0.00 C ATOM 0 H ILE A 105 -12.028 -6.603 10.284 1.00 0.00 H new ATOM 0 HA ILE A 105 -13.349 -9.076 11.171 1.00 0.00 H new ATOM 0 HB ILE A 105 -15.404 -7.696 10.514 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -13.557 -5.300 10.599 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -14.002 -6.074 9.091 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -15.336 -6.350 12.615 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -14.695 -7.991 12.865 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -13.579 -6.614 12.714 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -15.477 -4.149 9.556 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -16.411 -5.665 9.576 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -15.959 -4.878 11.107 1.00 0.00 H new ATOM 1628 N TYR A 106 -12.497 -8.578 8.200 1.00 0.00 N ATOM 1629 CA TYR A 106 -12.519 -8.923 6.774 1.00 0.00 C ATOM 1630 C TYR A 106 -11.221 -9.600 6.289 1.00 0.00 C ATOM 1631 O TYR A 106 -11.245 -10.301 5.274 1.00 0.00 O ATOM 1632 CB TYR A 106 -12.750 -7.631 5.971 1.00 0.00 C ATOM 1633 CG TYR A 106 -14.058 -6.883 6.189 1.00 0.00 C ATOM 1634 CD1 TYR A 106 -15.284 -7.575 6.281 1.00 0.00 C ATOM 1635 CD2 TYR A 106 -14.044 -5.476 6.271 1.00 0.00 C ATOM 1636 CE1 TYR A 106 -16.483 -6.869 6.483 1.00 0.00 C ATOM 1637 CE2 TYR A 106 -15.244 -4.766 6.471 1.00 0.00 C ATOM 1638 CZ TYR A 106 -16.469 -5.459 6.587 1.00 0.00 C ATOM 1639 OH TYR A 106 -17.636 -4.782 6.770 1.00 0.00 O ATOM 0 H TYR A 106 -11.621 -8.135 8.477 1.00 0.00 H new ATOM 0 HA TYR A 106 -13.321 -9.645 6.620 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -11.932 -6.947 6.195 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -12.678 -7.878 4.912 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -15.302 -8.651 6.196 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -13.110 -4.941 6.180 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -17.417 -7.405 6.559 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -15.227 -3.688 6.536 1.00 0.00 H new ATOM 0 HH TYR A 106 -17.452 -3.821 6.822 1.00 0.00 H new ATOM 1649 N ALA A 107 -10.106 -9.416 7.001 1.00 0.00 N ATOM 1650 CA ALA A 107 -8.830 -10.111 6.799 1.00 0.00 C ATOM 1651 C ALA A 107 -8.009 -10.165 8.107 1.00 0.00 C ATOM 1652 O ALA A 107 -8.301 -9.422 9.044 1.00 0.00 O ATOM 1653 CB ALA A 107 -8.056 -9.377 5.696 1.00 0.00 C ATOM 0 H ALA A 107 -10.066 -8.747 7.770 1.00 0.00 H new ATOM 0 HA ALA A 107 -9.017 -11.143 6.501 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -7.102 -9.876 5.527 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -8.638 -9.387 4.775 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -7.877 -8.346 6.001 1.00 0.00 H new ATOM 1659 N ASP A 108 -6.964 -11.002 8.171 1.00 0.00 N ATOM 1660 CA ASP A 108 -6.169 -11.207 9.397 1.00 0.00 C ATOM 1661 C ASP A 108 -4.741 -10.610 9.342 1.00 0.00 C ATOM 1662 O ASP A 108 -4.217 -10.196 10.378 1.00 0.00 O ATOM 1663 CB ASP A 108 -6.150 -12.702 9.746 1.00 0.00 C ATOM 1664 CG ASP A 108 -5.547 -12.965 11.135 1.00 0.00 C ATOM 1665 OD1 ASP A 108 -6.217 -12.674 12.158 1.00 0.00 O ATOM 1666 OD2 ASP A 108 -4.411 -13.489 11.218 1.00 0.00 O ATOM 0 H ASP A 108 -6.644 -11.557 7.377 1.00 0.00 H new ATOM 0 HA ASP A 108 -6.661 -10.648 10.192 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -7.166 -13.094 9.713 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.575 -13.242 8.994 1.00 0.00 H new ATOM 1671 N GLY A 109 -4.139 -10.493 8.149 1.00 0.00 N ATOM 1672 CA GLY A 109 -2.872 -9.783 7.917 1.00 0.00 C ATOM 1673 C GLY A 109 -1.649 -10.374 8.623 1.00 0.00 C ATOM 1674 O GLY A 109 -1.660 -11.514 9.097 1.00 0.00 O ATOM 0 H GLY A 109 -4.529 -10.899 7.298 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -2.677 -9.764 6.845 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -2.991 -8.748 8.238 1.00 0.00 H new ATOM 1678 N SER A 110 -0.552 -9.616 8.657 1.00 0.00 N ATOM 1679 CA SER A 110 0.615 -9.923 9.503 1.00 0.00 C ATOM 1680 C SER A 110 0.249 -9.714 10.983 1.00 0.00 C ATOM 1681 O SER A 110 -0.544 -8.829 11.314 1.00 0.00 O ATOM 1682 CB SER A 110 1.787 -9.014 9.134 1.00 0.00 C ATOM 1683 OG SER A 110 2.172 -9.208 7.779 1.00 0.00 O ATOM 0 H SER A 110 -0.442 -8.769 8.100 1.00 0.00 H new ATOM 0 HA SER A 110 0.906 -10.961 9.341 1.00 0.00 H new ATOM 0 HB2 SER A 110 1.508 -7.972 9.291 1.00 0.00 H new ATOM 0 HB3 SER A 110 2.633 -9.220 9.790 1.00 0.00 H new ATOM 0 HG SER A 110 2.922 -8.615 7.564 1.00 0.00 H new ATOM 1689 N HIS A 111 0.823 -10.505 11.891 1.00 0.00 N ATOM 1690 CA HIS A 111 0.416 -10.560 13.306 1.00 0.00 C ATOM 1691 C HIS A 111 1.602 -10.562 14.290 1.00 0.00 C ATOM 1692 O HIS A 111 2.771 -10.524 13.894 1.00 0.00 O ATOM 1693 CB HIS A 111 -0.522 -11.765 13.509 1.00 0.00 C ATOM 1694 CG HIS A 111 0.171 -13.104 13.424 1.00 0.00 C ATOM 1695 ND1 HIS A 111 0.461 -13.796 12.244 1.00 0.00 N ATOM 1696 CD2 HIS A 111 0.635 -13.824 14.488 1.00 0.00 C ATOM 1697 CE1 HIS A 111 1.106 -14.915 12.626 1.00 0.00 C ATOM 1698 NE2 HIS A 111 1.220 -14.957 13.967 1.00 0.00 N ATOM 0 H HIS A 111 1.593 -11.135 11.667 1.00 0.00 H new ATOM 0 HA HIS A 111 -0.122 -9.641 13.540 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -1.003 -11.678 14.483 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -1.312 -11.728 12.759 1.00 0.00 H new ATOM 0 HD2 HIS A 111 0.558 -13.558 15.532 1.00 0.00 H new ATOM 0 HE1 HIS A 111 1.479 -15.672 11.952 1.00 0.00 H new ATOM 0 HE2 HIS A 111 1.664 -15.701 14.505 1.00 0.00 H new ATOM 1706 N HIS A 112 1.278 -10.580 15.588 1.00 0.00 N ATOM 1707 CA HIS A 112 2.200 -10.409 16.718 1.00 0.00 C ATOM 1708 C HIS A 112 1.830 -11.353 17.878 1.00 0.00 C ATOM 1709 O HIS A 112 0.735 -11.920 17.904 1.00 0.00 O ATOM 1710 CB HIS A 112 2.161 -8.920 17.123 1.00 0.00 C ATOM 1711 CG HIS A 112 2.912 -8.583 18.385 1.00 0.00 C ATOM 1712 ND1 HIS A 112 4.263 -8.846 18.628 1.00 0.00 N ATOM 1713 CD2 HIS A 112 2.349 -8.079 19.518 1.00 0.00 C ATOM 1714 CE1 HIS A 112 4.484 -8.481 19.904 1.00 0.00 C ATOM 1715 NE2 HIS A 112 3.349 -8.029 20.460 1.00 0.00 N ATOM 0 H HIS A 112 0.316 -10.722 15.895 1.00 0.00 H new ATOM 0 HA HIS A 112 3.219 -10.677 16.438 1.00 0.00 H new ATOM 0 HB2 HIS A 112 2.570 -8.326 16.305 1.00 0.00 H new ATOM 0 HB3 HIS A 112 1.120 -8.620 17.246 1.00 0.00 H new ATOM 0 HD2 HIS A 112 1.320 -7.778 19.650 1.00 0.00 H new ATOM 0 HE1 HIS A 112 5.437 -8.543 20.408 1.00 0.00 H new ATOM 0 HE2 HIS A 112 3.246 -7.703 21.421 1.00 0.00 H new ATOM 1723 N HIS A 113 2.728 -11.521 18.854 1.00 0.00 N ATOM 1724 CA HIS A 113 2.601 -12.462 19.984 1.00 0.00 C ATOM 1725 C HIS A 113 1.361 -12.237 20.870 1.00 0.00 C ATOM 1726 O HIS A 113 0.898 -13.174 21.525 1.00 0.00 O ATOM 1727 CB HIS A 113 3.878 -12.401 20.838 1.00 0.00 C ATOM 1728 CG HIS A 113 5.140 -12.703 20.066 1.00 0.00 C ATOM 1729 ND1 HIS A 113 5.378 -13.860 19.317 1.00 0.00 N ATOM 1730 CD2 HIS A 113 6.234 -11.889 19.984 1.00 0.00 C ATOM 1731 CE1 HIS A 113 6.604 -13.708 18.789 1.00 0.00 C ATOM 1732 NE2 HIS A 113 7.140 -12.537 19.176 1.00 0.00 N ATOM 0 H HIS A 113 3.597 -10.988 18.885 1.00 0.00 H new ATOM 0 HA HIS A 113 2.467 -13.451 19.546 1.00 0.00 H new ATOM 0 HB2 HIS A 113 3.962 -11.408 21.280 1.00 0.00 H new ATOM 0 HB3 HIS A 113 3.788 -13.110 21.661 1.00 0.00 H new ATOM 0 HD2 HIS A 113 6.362 -10.928 20.459 1.00 0.00 H new ATOM 0 HE1 HIS A 113 7.091 -14.425 18.145 1.00 0.00 H new ATOM 0 HE2 HIS A 113 8.062 -12.188 18.915 1.00 0.00 H new ATOM 1740 N HIS A 114 0.799 -11.021 20.876 1.00 0.00 N ATOM 1741 CA HIS A 114 -0.404 -10.653 21.640 1.00 0.00 C ATOM 1742 C HIS A 114 -1.718 -10.739 20.828 1.00 0.00 C ATOM 1743 O HIS A 114 -2.772 -10.324 21.314 1.00 0.00 O ATOM 1744 CB HIS A 114 -0.200 -9.262 22.270 1.00 0.00 C ATOM 1745 CG HIS A 114 0.991 -9.170 23.202 1.00 0.00 C ATOM 1746 ND1 HIS A 114 1.996 -8.196 23.150 1.00 0.00 N ATOM 1747 CD2 HIS A 114 1.252 -10.010 24.246 1.00 0.00 C ATOM 1748 CE1 HIS A 114 2.835 -8.474 24.162 1.00 0.00 C ATOM 1749 NE2 HIS A 114 2.412 -9.556 24.838 1.00 0.00 N ATOM 0 H HIS A 114 1.178 -10.244 20.335 1.00 0.00 H new ATOM 0 HA HIS A 114 -0.529 -11.395 22.429 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -0.080 -8.529 21.473 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -1.100 -8.990 22.821 1.00 0.00 H new ATOM 0 HD2 HIS A 114 0.664 -10.864 24.549 1.00 0.00 H new ATOM 0 HE1 HIS A 114 3.724 -7.908 24.399 1.00 0.00 H new ATOM 0 HE2 HIS A 114 2.870 -9.970 25.650 1.00 0.00 H new ATOM 1757 N HIS A 115 -1.685 -11.285 19.606 1.00 0.00 N ATOM 1758 CA HIS A 115 -2.863 -11.541 18.756 1.00 0.00 C ATOM 1759 C HIS A 115 -3.691 -12.755 19.239 1.00 0.00 C ATOM 1760 O HIS A 115 -3.745 -13.804 18.588 1.00 0.00 O ATOM 1761 CB HIS A 115 -2.422 -11.658 17.285 1.00 0.00 C ATOM 1762 CG HIS A 115 -3.567 -11.630 16.300 1.00 0.00 C ATOM 1763 ND1 HIS A 115 -4.625 -10.716 16.317 1.00 0.00 N ATOM 1764 CD2 HIS A 115 -3.709 -12.447 15.212 1.00 0.00 C ATOM 1765 CE1 HIS A 115 -5.380 -11.005 15.242 1.00 0.00 C ATOM 1766 NE2 HIS A 115 -4.852 -12.035 14.561 1.00 0.00 N ATOM 0 H HIS A 115 -0.811 -11.571 19.164 1.00 0.00 H new ATOM 0 HA HIS A 115 -3.542 -10.692 18.838 1.00 0.00 H new ATOM 0 HB2 HIS A 115 -1.737 -10.842 17.055 1.00 0.00 H new ATOM 0 HB3 HIS A 115 -1.866 -12.587 17.155 1.00 0.00 H new ATOM 0 HD2 HIS A 115 -3.055 -13.255 14.921 1.00 0.00 H new ATOM 0 HE1 HIS A 115 -6.284 -10.482 14.965 1.00 0.00 H new ATOM 0 HE2 HIS A 115 -5.232 -12.443 13.707 1.00 0.00 H new ATOM 1774 N HIS A 116 -4.295 -12.623 20.428 1.00 0.00 N ATOM 1775 CA HIS A 116 -5.022 -13.667 21.167 1.00 0.00 C ATOM 1776 C HIS A 116 -6.276 -13.110 21.854 1.00 0.00 C ATOM 1777 O HIS A 116 -6.151 -12.152 22.653 1.00 0.00 O ATOM 1778 CB HIS A 116 -4.060 -14.319 22.177 1.00 0.00 C ATOM 1779 CG HIS A 116 -4.691 -15.404 23.018 1.00 0.00 C ATOM 1780 ND1 HIS A 116 -4.786 -16.756 22.669 1.00 0.00 N ATOM 1781 CD2 HIS A 116 -5.224 -15.233 24.260 1.00 0.00 C ATOM 1782 CE1 HIS A 116 -5.376 -17.366 23.712 1.00 0.00 C ATOM 1783 NE2 HIS A 116 -5.656 -16.474 24.682 1.00 0.00 N ATOM 1784 OXT HIS A 116 -7.383 -13.620 21.567 1.00 0.00 O ATOM 0 H HIS A 116 -4.290 -11.735 20.929 1.00 0.00 H new ATOM 0 HA HIS A 116 -5.374 -14.424 20.466 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -3.213 -14.740 21.636 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -3.665 -13.547 22.837 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -5.295 -14.305 24.809 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -5.595 -18.422 23.765 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -6.108 -16.680 25.573 1.00 0.00 H new TER 1792 HIS A 116