USER MOD reduce.3.24.130724 H: found=0, std=0, add=672, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 670 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 882 SER OG : rot 101:sc= 0.00725 USER MOD Set 1.2: A 886 SER OG : rot 180:sc= 0 USER MOD Single : A 883 SER OG : rot -63:sc= 0.165 USER MOD Single : A 885 SER OG : rot 180:sc= 0 USER MOD Single : A 893 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 894 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 895 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 901 GLN :FLIP amide:sc= -2.41 F(o=-3.4,f=-2.4) USER MOD Single : A 902 ASN : amide:sc= -0.0791 X(o=-0.079,f=-0.43) USER MOD Single : A 904 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 908 SER OG : rot 180:sc= 0 USER MOD Single : A 910 MET CE :methyl -175:sc= 0 (180deg=-0.0221) USER MOD Single : A 913 SER OG : rot 180:sc= 0 USER MOD Single : A 914 SER OG : rot -160:sc= 0 USER MOD Single : A 917 SER OG : rot 180:sc= 0 USER MOD Single : A 919 SER OG : rot 180:sc= 0 USER MOD Single : A 921 THR OG1 : rot 174:sc= 0.432 USER MOD Single : A 924 THR OG1 : rot 103:sc= 1.12 USER MOD Single : A 927 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 929 HIS : no HD1:sc= -0.196 X(o=-0.2,f=0) USER MOD Single : A 933 SER OG : rot -3:sc= 0.686 USER MOD Single : A 935 SER OG : rot 180:sc= 0 USER MOD Single : A 942 LYS NZ :NH3+ 160:sc= 1.1 (180deg=0.495) USER MOD Single : A 944 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.521) USER MOD Single : A 947 ASN : amide:sc= -0.165 K(o=-0.16,f=-1.9) USER MOD Single : A 949 HIS : no HD1:sc= -4.12! C(o=-4.1!,f=-6.9!) USER MOD Single : A 954 THR OG1 : rot 180:sc= -0.151 USER MOD Single : A 955 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 956 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 957 LYS NZ :NH3+ -148:sc= -0.189 (180deg=-1.51!) USER MOD Single : A 960 SER OG : rot 180:sc= 0 USER MOD Single : A 963 SER OG : rot 180:sc=-0.00645 USER MOD Single : A 964 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 881 -7.413 -22.042 -15.388 1.00 0.00 N ATOM 2 CA GLY A 881 -8.665 -21.812 -14.691 1.00 0.00 C ATOM 3 C GLY A 881 -8.678 -20.496 -13.940 1.00 0.00 C ATOM 4 O GLY A 881 -7.867 -19.610 -14.212 1.00 0.00 O ATOM 0 HA2 GLY A 881 -9.485 -21.825 -15.409 1.00 0.00 H new ATOM 0 HA3 GLY A 881 -8.842 -22.628 -13.991 1.00 0.00 H new ATOM 8 N SER A 882 -9.601 -20.366 -12.992 1.00 0.00 N ATOM 9 CA SER A 882 -9.719 -19.146 -12.203 1.00 0.00 C ATOM 10 C SER A 882 -10.685 -19.343 -11.039 1.00 0.00 C ATOM 11 O SER A 882 -11.666 -20.079 -11.150 1.00 0.00 O ATOM 12 CB SER A 882 -10.193 -17.988 -13.083 1.00 0.00 C ATOM 13 OG SER A 882 -11.456 -18.269 -13.660 1.00 0.00 O ATOM 0 H SER A 882 -10.278 -21.091 -12.752 1.00 0.00 H new ATOM 0 HA SER A 882 -8.735 -18.907 -11.800 1.00 0.00 H new ATOM 0 HB2 SER A 882 -10.256 -17.077 -12.488 1.00 0.00 H new ATOM 0 HB3 SER A 882 -9.463 -17.804 -13.871 1.00 0.00 H new ATOM 0 HG SER A 882 -12.155 -17.796 -13.162 1.00 0.00 H new ATOM 19 N SER A 883 -10.401 -18.681 -9.922 1.00 0.00 N ATOM 20 CA SER A 883 -11.242 -18.785 -8.736 1.00 0.00 C ATOM 21 C SER A 883 -12.285 -17.673 -8.709 1.00 0.00 C ATOM 22 O SER A 883 -12.373 -16.911 -7.747 1.00 0.00 O ATOM 23 CB SER A 883 -10.384 -18.726 -7.470 1.00 0.00 C ATOM 24 OG SER A 883 -11.158 -19.002 -6.316 1.00 0.00 O ATOM 0 H SER A 883 -9.594 -18.066 -9.814 1.00 0.00 H new ATOM 0 HA SER A 883 -11.760 -19.743 -8.772 1.00 0.00 H new ATOM 0 HB2 SER A 883 -9.569 -19.446 -7.546 1.00 0.00 H new ATOM 0 HB3 SER A 883 -9.930 -17.739 -7.380 1.00 0.00 H new ATOM 0 HG SER A 883 -11.846 -18.312 -6.211 1.00 0.00 H new ATOM 30 N GLY A 884 -13.075 -17.586 -9.775 1.00 0.00 N ATOM 31 CA GLY A 884 -14.103 -16.564 -9.856 1.00 0.00 C ATOM 32 C GLY A 884 -14.720 -16.469 -11.237 1.00 0.00 C ATOM 33 O GLY A 884 -14.089 -16.826 -12.232 1.00 0.00 O ATOM 0 H GLY A 884 -13.022 -18.205 -10.584 1.00 0.00 H new ATOM 0 HA2 GLY A 884 -14.884 -16.780 -9.127 1.00 0.00 H new ATOM 0 HA3 GLY A 884 -13.674 -15.599 -9.586 1.00 0.00 H new ATOM 37 N SER A 885 -15.957 -15.989 -11.299 1.00 0.00 N ATOM 38 CA SER A 885 -16.662 -15.854 -12.568 1.00 0.00 C ATOM 39 C SER A 885 -15.746 -15.270 -13.639 1.00 0.00 C ATOM 40 O SER A 885 -15.178 -14.191 -13.465 1.00 0.00 O ATOM 41 CB SER A 885 -17.897 -14.967 -12.398 1.00 0.00 C ATOM 42 OG SER A 885 -18.707 -15.420 -11.328 1.00 0.00 O ATOM 0 H SER A 885 -16.492 -15.687 -10.485 1.00 0.00 H new ATOM 0 HA SER A 885 -16.978 -16.847 -12.887 1.00 0.00 H new ATOM 0 HB2 SER A 885 -17.587 -13.938 -12.213 1.00 0.00 H new ATOM 0 HB3 SER A 885 -18.477 -14.964 -13.321 1.00 0.00 H new ATOM 0 HG SER A 885 -19.489 -14.835 -11.239 1.00 0.00 H new ATOM 48 N SER A 886 -15.607 -15.990 -14.747 1.00 0.00 N ATOM 49 CA SER A 886 -14.757 -15.546 -15.846 1.00 0.00 C ATOM 50 C SER A 886 -15.439 -14.443 -16.649 1.00 0.00 C ATOM 51 O SER A 886 -16.467 -14.669 -17.287 1.00 0.00 O ATOM 52 CB SER A 886 -14.416 -16.723 -16.762 1.00 0.00 C ATOM 53 OG SER A 886 -13.266 -17.412 -16.301 1.00 0.00 O ATOM 0 H SER A 886 -16.072 -16.884 -14.908 1.00 0.00 H new ATOM 0 HA SER A 886 -13.836 -15.146 -15.422 1.00 0.00 H new ATOM 0 HB2 SER A 886 -15.261 -17.410 -16.807 1.00 0.00 H new ATOM 0 HB3 SER A 886 -14.245 -16.361 -17.776 1.00 0.00 H new ATOM 0 HG SER A 886 -13.070 -18.161 -16.902 1.00 0.00 H new ATOM 59 N GLY A 887 -14.859 -13.247 -16.612 1.00 0.00 N ATOM 60 CA GLY A 887 -15.423 -12.126 -17.340 1.00 0.00 C ATOM 61 C GLY A 887 -14.368 -11.314 -18.064 1.00 0.00 C ATOM 62 O GLY A 887 -13.207 -11.717 -18.137 1.00 0.00 O ATOM 0 H GLY A 887 -14.008 -13.035 -16.091 1.00 0.00 H new ATOM 0 HA2 GLY A 887 -16.151 -12.495 -18.062 1.00 0.00 H new ATOM 0 HA3 GLY A 887 -15.961 -11.480 -16.646 1.00 0.00 H new ATOM 66 N ASP A 888 -14.771 -10.169 -18.603 1.00 0.00 N ATOM 67 CA ASP A 888 -13.851 -9.298 -19.326 1.00 0.00 C ATOM 68 C ASP A 888 -13.980 -7.855 -18.850 1.00 0.00 C ATOM 69 O ASP A 888 -12.986 -7.210 -18.517 1.00 0.00 O ATOM 70 CB ASP A 888 -14.117 -9.378 -20.831 1.00 0.00 C ATOM 71 CG ASP A 888 -14.099 -10.803 -21.347 1.00 0.00 C ATOM 72 OD1 ASP A 888 -13.005 -11.402 -21.396 1.00 0.00 O ATOM 73 OD2 ASP A 888 -15.180 -11.319 -21.704 1.00 0.00 O ATOM 0 H ASP A 888 -15.729 -9.822 -18.553 1.00 0.00 H new ATOM 0 HA ASP A 888 -12.835 -9.637 -19.125 1.00 0.00 H new ATOM 0 HB2 ASP A 888 -15.085 -8.927 -21.050 1.00 0.00 H new ATOM 0 HB3 ASP A 888 -13.366 -8.793 -21.361 1.00 0.00 H new ATOM 78 N ARG A 889 -15.211 -7.355 -18.821 1.00 0.00 N ATOM 79 CA ARG A 889 -15.470 -5.987 -18.387 1.00 0.00 C ATOM 80 C ARG A 889 -14.613 -5.629 -17.177 1.00 0.00 C ATOM 81 O ARG A 889 -14.016 -4.554 -17.124 1.00 0.00 O ATOM 82 CB ARG A 889 -16.951 -5.809 -18.048 1.00 0.00 C ATOM 83 CG ARG A 889 -17.338 -4.370 -17.747 1.00 0.00 C ATOM 84 CD ARG A 889 -17.027 -3.999 -16.305 1.00 0.00 C ATOM 85 NE ARG A 889 -17.882 -2.919 -15.821 1.00 0.00 N ATOM 86 CZ ARG A 889 -19.100 -3.111 -15.328 1.00 0.00 C ATOM 87 NH1 ARG A 889 -19.604 -4.335 -15.253 1.00 0.00 N ATOM 88 NH2 ARG A 889 -19.817 -2.077 -14.907 1.00 0.00 N ATOM 0 H ARG A 889 -16.045 -7.876 -19.093 1.00 0.00 H new ATOM 0 HA ARG A 889 -15.209 -5.317 -19.206 1.00 0.00 H new ATOM 0 HB2 ARG A 889 -17.552 -6.171 -18.882 1.00 0.00 H new ATOM 0 HB3 ARG A 889 -17.195 -6.430 -17.186 1.00 0.00 H new ATOM 0 HG2 ARG A 889 -16.803 -3.700 -18.420 1.00 0.00 H new ATOM 0 HG3 ARG A 889 -18.402 -4.231 -17.938 1.00 0.00 H new ATOM 0 HD2 ARG A 889 -17.155 -4.875 -15.670 1.00 0.00 H new ATOM 0 HD3 ARG A 889 -15.982 -3.698 -16.225 1.00 0.00 H new ATOM 0 HE ARG A 889 -17.524 -1.965 -15.864 1.00 0.00 H new ATOM 0 HH11 ARG A 889 -19.056 -5.133 -15.575 1.00 0.00 H new ATOM 0 HH12 ARG A 889 -20.540 -4.479 -14.874 1.00 0.00 H new ATOM 0 HH21 ARG A 889 -19.433 -1.134 -14.962 1.00 0.00 H new ATOM 0 HH22 ARG A 889 -20.752 -2.225 -14.528 1.00 0.00 H new ATOM 102 N GLU A 890 -14.558 -6.537 -16.207 1.00 0.00 N ATOM 103 CA GLU A 890 -13.776 -6.316 -14.997 1.00 0.00 C ATOM 104 C GLU A 890 -12.469 -5.595 -15.319 1.00 0.00 C ATOM 105 O GLU A 890 -12.063 -4.676 -14.607 1.00 0.00 O ATOM 106 CB GLU A 890 -13.479 -7.647 -14.304 1.00 0.00 C ATOM 107 CG GLU A 890 -13.119 -7.501 -12.835 1.00 0.00 C ATOM 108 CD GLU A 890 -12.702 -8.815 -12.203 1.00 0.00 C ATOM 109 OE1 GLU A 890 -13.435 -9.812 -12.368 1.00 0.00 O ATOM 110 OE2 GLU A 890 -11.642 -8.846 -11.544 1.00 0.00 O ATOM 0 H GLU A 890 -15.046 -7.432 -16.236 1.00 0.00 H new ATOM 0 HA GLU A 890 -14.362 -5.689 -14.326 1.00 0.00 H new ATOM 0 HB2 GLU A 890 -14.350 -8.296 -14.393 1.00 0.00 H new ATOM 0 HB3 GLU A 890 -12.658 -8.142 -14.823 1.00 0.00 H new ATOM 0 HG2 GLU A 890 -12.308 -6.780 -12.733 1.00 0.00 H new ATOM 0 HG3 GLU A 890 -13.974 -7.097 -12.294 1.00 0.00 H new ATOM 117 N ARG A 891 -11.816 -6.019 -16.395 1.00 0.00 N ATOM 118 CA ARG A 891 -10.555 -5.417 -16.811 1.00 0.00 C ATOM 119 C ARG A 891 -10.573 -3.908 -16.585 1.00 0.00 C ATOM 120 O ARG A 891 -9.626 -3.341 -16.040 1.00 0.00 O ATOM 121 CB ARG A 891 -10.282 -5.719 -18.285 1.00 0.00 C ATOM 122 CG ARG A 891 -11.233 -5.013 -19.238 1.00 0.00 C ATOM 123 CD ARG A 891 -11.234 -5.667 -20.611 1.00 0.00 C ATOM 124 NE ARG A 891 -12.313 -5.163 -21.456 1.00 0.00 N ATOM 125 CZ ARG A 891 -12.782 -5.814 -22.515 1.00 0.00 C ATOM 126 NH1 ARG A 891 -12.270 -6.989 -22.855 1.00 0.00 N ATOM 127 NH2 ARG A 891 -13.766 -5.291 -23.235 1.00 0.00 N ATOM 0 H ARG A 891 -12.139 -6.778 -16.995 1.00 0.00 H new ATOM 0 HA ARG A 891 -9.758 -5.849 -16.206 1.00 0.00 H new ATOM 0 HB2 ARG A 891 -9.259 -5.427 -18.523 1.00 0.00 H new ATOM 0 HB3 ARG A 891 -10.352 -6.795 -18.446 1.00 0.00 H new ATOM 0 HG2 ARG A 891 -12.242 -5.029 -18.825 1.00 0.00 H new ATOM 0 HG3 ARG A 891 -10.944 -3.966 -19.333 1.00 0.00 H new ATOM 0 HD2 ARG A 891 -10.276 -5.486 -21.099 1.00 0.00 H new ATOM 0 HD3 ARG A 891 -11.336 -6.746 -20.498 1.00 0.00 H new ATOM 0 HE ARG A 891 -12.729 -4.262 -21.220 1.00 0.00 H new ATOM 0 HH11 ARG A 891 -11.514 -7.395 -22.303 1.00 0.00 H new ATOM 0 HH12 ARG A 891 -12.632 -7.487 -23.668 1.00 0.00 H new ATOM 0 HH21 ARG A 891 -14.163 -4.388 -22.976 1.00 0.00 H new ATOM 0 HH22 ARG A 891 -14.125 -5.792 -24.048 1.00 0.00 H new ATOM 141 N GLU A 892 -11.657 -3.264 -17.007 1.00 0.00 N ATOM 142 CA GLU A 892 -11.797 -1.821 -16.851 1.00 0.00 C ATOM 143 C GLU A 892 -11.264 -1.366 -15.496 1.00 0.00 C ATOM 144 O GLU A 892 -10.401 -0.492 -15.419 1.00 0.00 O ATOM 145 CB GLU A 892 -13.263 -1.409 -17.000 1.00 0.00 C ATOM 146 CG GLU A 892 -13.448 -0.003 -17.544 1.00 0.00 C ATOM 147 CD GLU A 892 -14.858 0.518 -17.347 1.00 0.00 C ATOM 148 OE1 GLU A 892 -15.721 0.235 -18.205 1.00 0.00 O ATOM 149 OE2 GLU A 892 -15.100 1.209 -16.335 1.00 0.00 O ATOM 0 H GLU A 892 -12.450 -3.719 -17.459 1.00 0.00 H new ATOM 0 HA GLU A 892 -11.211 -1.338 -17.633 1.00 0.00 H new ATOM 0 HB2 GLU A 892 -13.764 -2.115 -17.662 1.00 0.00 H new ATOM 0 HB3 GLU A 892 -13.752 -1.481 -16.029 1.00 0.00 H new ATOM 0 HG2 GLU A 892 -12.745 0.668 -17.052 1.00 0.00 H new ATOM 0 HG3 GLU A 892 -13.207 0.006 -18.607 1.00 0.00 H new ATOM 156 N GLN A 893 -11.786 -1.965 -14.430 1.00 0.00 N ATOM 157 CA GLN A 893 -11.364 -1.620 -13.078 1.00 0.00 C ATOM 158 C GLN A 893 -10.343 -2.624 -12.553 1.00 0.00 C ATOM 159 O GLN A 893 -10.408 -3.045 -11.397 1.00 0.00 O ATOM 160 CB GLN A 893 -12.573 -1.568 -12.141 1.00 0.00 C ATOM 161 CG GLN A 893 -13.217 -2.924 -11.903 1.00 0.00 C ATOM 162 CD GLN A 893 -13.923 -3.007 -10.564 1.00 0.00 C ATOM 163 OE1 GLN A 893 -13.586 -3.839 -9.722 1.00 0.00 O ATOM 164 NE2 GLN A 893 -14.910 -2.142 -10.360 1.00 0.00 N ATOM 0 H GLN A 893 -12.501 -2.691 -14.477 1.00 0.00 H new ATOM 0 HA GLN A 893 -10.896 -0.636 -13.111 1.00 0.00 H new ATOM 0 HB2 GLN A 893 -12.262 -1.150 -11.184 1.00 0.00 H new ATOM 0 HB3 GLN A 893 -13.317 -0.890 -12.559 1.00 0.00 H new ATOM 0 HG2 GLN A 893 -13.932 -3.127 -12.700 1.00 0.00 H new ATOM 0 HG3 GLN A 893 -12.453 -3.699 -11.955 1.00 0.00 H new ATOM 0 HE21 GLN A 893 -15.156 -1.469 -11.086 1.00 0.00 H new ATOM 0 HE22 GLN A 893 -15.422 -2.151 -9.478 1.00 0.00 H new ATOM 173 N HIS A 894 -9.401 -3.006 -13.410 1.00 0.00 N ATOM 174 CA HIS A 894 -8.366 -3.961 -13.033 1.00 0.00 C ATOM 175 C HIS A 894 -6.993 -3.297 -13.019 1.00 0.00 C ATOM 176 O HIS A 894 -6.278 -3.345 -12.018 1.00 0.00 O ATOM 177 CB HIS A 894 -8.362 -5.148 -13.997 1.00 0.00 C ATOM 178 CG HIS A 894 -7.795 -6.400 -13.403 1.00 0.00 C ATOM 179 ND1 HIS A 894 -8.580 -7.432 -12.933 1.00 0.00 N ATOM 180 CD2 HIS A 894 -6.512 -6.785 -13.205 1.00 0.00 C ATOM 181 CE1 HIS A 894 -7.804 -8.396 -12.470 1.00 0.00 C ATOM 182 NE2 HIS A 894 -6.545 -8.029 -12.624 1.00 0.00 N ATOM 0 H HIS A 894 -9.334 -2.668 -14.370 1.00 0.00 H new ATOM 0 HA HIS A 894 -8.586 -4.320 -12.028 1.00 0.00 H new ATOM 0 HB2 HIS A 894 -9.383 -5.342 -14.326 1.00 0.00 H new ATOM 0 HB3 HIS A 894 -7.786 -4.883 -14.884 1.00 0.00 H new ATOM 0 HD2 HIS A 894 -5.627 -6.219 -13.457 1.00 0.00 H new ATOM 0 HE1 HIS A 894 -8.142 -9.327 -12.039 1.00 0.00 H new ATOM 0 HE2 HIS A 894 -5.730 -8.580 -12.355 1.00 0.00 H new ATOM 190 N LYS A 895 -6.629 -2.677 -14.137 1.00 0.00 N ATOM 191 CA LYS A 895 -5.342 -2.002 -14.255 1.00 0.00 C ATOM 192 C LYS A 895 -4.967 -1.313 -12.946 1.00 0.00 C ATOM 193 O LYS A 895 -3.842 -1.443 -12.466 1.00 0.00 O ATOM 194 CB LYS A 895 -5.382 -0.977 -15.390 1.00 0.00 C ATOM 195 CG LYS A 895 -5.225 -1.591 -16.770 1.00 0.00 C ATOM 196 CD LYS A 895 -3.793 -2.032 -17.024 1.00 0.00 C ATOM 197 CE LYS A 895 -2.921 -0.868 -17.467 1.00 0.00 C ATOM 198 NZ LYS A 895 -1.625 -1.330 -18.035 1.00 0.00 N ATOM 0 H LYS A 895 -7.208 -2.628 -14.975 1.00 0.00 H new ATOM 0 HA LYS A 895 -4.585 -2.754 -14.480 1.00 0.00 H new ATOM 0 HB2 LYS A 895 -6.328 -0.437 -15.347 1.00 0.00 H new ATOM 0 HB3 LYS A 895 -4.590 -0.245 -15.235 1.00 0.00 H new ATOM 0 HG2 LYS A 895 -5.893 -2.447 -16.867 1.00 0.00 H new ATOM 0 HG3 LYS A 895 -5.524 -0.867 -17.528 1.00 0.00 H new ATOM 0 HD2 LYS A 895 -3.380 -2.472 -16.116 1.00 0.00 H new ATOM 0 HD3 LYS A 895 -3.781 -2.809 -17.789 1.00 0.00 H new ATOM 0 HE2 LYS A 895 -3.454 -0.278 -18.212 1.00 0.00 H new ATOM 0 HE3 LYS A 895 -2.732 -0.212 -16.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 895 -1.060 -0.507 -18.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 895 -1.104 -1.872 -17.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 895 -1.804 -1.935 -18.862 1.00 0.00 H new ATOM 212 N ARG A 896 -5.919 -0.582 -12.375 1.00 0.00 N ATOM 213 CA ARG A 896 -5.688 0.127 -11.122 1.00 0.00 C ATOM 214 C ARG A 896 -5.632 -0.847 -9.948 1.00 0.00 C ATOM 215 O ARG A 896 -4.712 -0.798 -9.132 1.00 0.00 O ATOM 216 CB ARG A 896 -6.789 1.163 -10.887 1.00 0.00 C ATOM 217 CG ARG A 896 -6.446 2.183 -9.814 1.00 0.00 C ATOM 218 CD ARG A 896 -7.645 3.052 -9.468 1.00 0.00 C ATOM 219 NE ARG A 896 -8.018 3.935 -10.571 1.00 0.00 N ATOM 220 CZ ARG A 896 -9.058 4.760 -10.533 1.00 0.00 C ATOM 221 NH1 ARG A 896 -9.826 4.815 -9.453 1.00 0.00 N ATOM 222 NH2 ARG A 896 -9.333 5.532 -11.576 1.00 0.00 N ATOM 0 H ARG A 896 -6.856 -0.465 -12.760 1.00 0.00 H new ATOM 0 HA ARG A 896 -4.728 0.637 -11.194 1.00 0.00 H new ATOM 0 HB2 ARG A 896 -6.990 1.686 -11.822 1.00 0.00 H new ATOM 0 HB3 ARG A 896 -7.707 0.647 -10.606 1.00 0.00 H new ATOM 0 HG2 ARG A 896 -6.098 1.668 -8.919 1.00 0.00 H new ATOM 0 HG3 ARG A 896 -5.626 2.813 -10.158 1.00 0.00 H new ATOM 0 HD2 ARG A 896 -8.492 2.416 -9.211 1.00 0.00 H new ATOM 0 HD3 ARG A 896 -7.417 3.650 -8.586 1.00 0.00 H new ATOM 0 HE ARG A 896 -7.448 3.917 -11.417 1.00 0.00 H new ATOM 0 HH11 ARG A 896 -9.618 4.223 -8.649 1.00 0.00 H new ATOM 0 HH12 ARG A 896 -10.624 5.450 -9.427 1.00 0.00 H new ATOM 0 HH21 ARG A 896 -8.745 5.492 -12.409 1.00 0.00 H new ATOM 0 HH22 ARG A 896 -10.132 6.165 -11.545 1.00 0.00 H new ATOM 236 N GLU A 897 -6.623 -1.730 -9.871 1.00 0.00 N ATOM 237 CA GLU A 897 -6.687 -2.714 -8.797 1.00 0.00 C ATOM 238 C GLU A 897 -5.304 -3.288 -8.502 1.00 0.00 C ATOM 239 O GLU A 897 -4.855 -3.295 -7.357 1.00 0.00 O ATOM 240 CB GLU A 897 -7.652 -3.842 -9.165 1.00 0.00 C ATOM 241 CG GLU A 897 -9.102 -3.536 -8.832 1.00 0.00 C ATOM 242 CD GLU A 897 -9.425 -3.761 -7.367 1.00 0.00 C ATOM 243 OE1 GLU A 897 -9.370 -4.926 -6.920 1.00 0.00 O ATOM 244 OE2 GLU A 897 -9.733 -2.773 -6.669 1.00 0.00 O ATOM 0 H GLU A 897 -7.392 -1.784 -10.539 1.00 0.00 H new ATOM 0 HA GLU A 897 -7.052 -2.212 -7.901 1.00 0.00 H new ATOM 0 HB2 GLU A 897 -7.569 -4.046 -10.232 1.00 0.00 H new ATOM 0 HB3 GLU A 897 -7.352 -4.750 -8.642 1.00 0.00 H new ATOM 0 HG2 GLU A 897 -9.320 -2.500 -9.093 1.00 0.00 H new ATOM 0 HG3 GLU A 897 -9.751 -4.163 -9.444 1.00 0.00 H new ATOM 251 N GLU A 898 -4.635 -3.769 -9.546 1.00 0.00 N ATOM 252 CA GLU A 898 -3.304 -4.347 -9.399 1.00 0.00 C ATOM 253 C GLU A 898 -2.398 -3.426 -8.587 1.00 0.00 C ATOM 254 O GLU A 898 -1.656 -3.878 -7.716 1.00 0.00 O ATOM 255 CB GLU A 898 -2.684 -4.610 -10.772 1.00 0.00 C ATOM 256 CG GLU A 898 -3.143 -5.911 -11.409 1.00 0.00 C ATOM 257 CD GLU A 898 -2.402 -6.226 -12.694 1.00 0.00 C ATOM 258 OE1 GLU A 898 -1.160 -6.344 -12.649 1.00 0.00 O ATOM 259 OE2 GLU A 898 -3.066 -6.354 -13.744 1.00 0.00 O ATOM 0 H GLU A 898 -4.993 -3.770 -10.501 1.00 0.00 H new ATOM 0 HA GLU A 898 -3.403 -5.293 -8.866 1.00 0.00 H new ATOM 0 HB2 GLU A 898 -2.931 -3.783 -11.437 1.00 0.00 H new ATOM 0 HB3 GLU A 898 -1.599 -4.627 -10.674 1.00 0.00 H new ATOM 0 HG2 GLU A 898 -2.999 -6.728 -10.702 1.00 0.00 H new ATOM 0 HG3 GLU A 898 -4.212 -5.853 -11.615 1.00 0.00 H new ATOM 266 N ALA A 899 -2.463 -2.131 -8.882 1.00 0.00 N ATOM 267 CA ALA A 899 -1.651 -1.146 -8.179 1.00 0.00 C ATOM 268 C ALA A 899 -1.999 -1.104 -6.695 1.00 0.00 C ATOM 269 O ALA A 899 -1.114 -1.045 -5.842 1.00 0.00 O ATOM 270 CB ALA A 899 -1.831 0.229 -8.805 1.00 0.00 C ATOM 0 H ALA A 899 -3.070 -1.740 -9.603 1.00 0.00 H new ATOM 0 HA ALA A 899 -0.606 -1.441 -8.271 1.00 0.00 H new ATOM 0 HB1 ALA A 899 -1.219 0.955 -8.270 1.00 0.00 H new ATOM 0 HB2 ALA A 899 -1.524 0.196 -9.850 1.00 0.00 H new ATOM 0 HB3 ALA A 899 -2.879 0.522 -8.743 1.00 0.00 H new ATOM 276 N ILE A 900 -3.293 -1.134 -6.395 1.00 0.00 N ATOM 277 CA ILE A 900 -3.757 -1.100 -5.014 1.00 0.00 C ATOM 278 C ILE A 900 -3.138 -2.230 -4.198 1.00 0.00 C ATOM 279 O ILE A 900 -2.442 -1.986 -3.213 1.00 0.00 O ATOM 280 CB ILE A 900 -5.292 -1.205 -4.933 1.00 0.00 C ATOM 281 CG1 ILE A 900 -5.945 -0.043 -5.684 1.00 0.00 C ATOM 282 CG2 ILE A 900 -5.746 -1.226 -3.481 1.00 0.00 C ATOM 283 CD1 ILE A 900 -7.437 -0.205 -5.869 1.00 0.00 C ATOM 0 H ILE A 900 -4.038 -1.182 -7.090 1.00 0.00 H new ATOM 0 HA ILE A 900 -3.444 -0.142 -4.600 1.00 0.00 H new ATOM 0 HB ILE A 900 -5.603 -2.138 -5.404 1.00 0.00 H new ATOM 0 HG12 ILE A 900 -5.753 0.883 -5.142 1.00 0.00 H new ATOM 0 HG13 ILE A 900 -5.475 0.057 -6.662 1.00 0.00 H new ATOM 0 HG21 ILE A 900 -6.833 -1.300 -3.441 1.00 0.00 H new ATOM 0 HG22 ILE A 900 -5.304 -2.084 -2.974 1.00 0.00 H new ATOM 0 HG23 ILE A 900 -5.427 -0.309 -2.987 1.00 0.00 H new ATOM 0 HD11 ILE A 900 -7.832 0.655 -6.409 1.00 0.00 H new ATOM 0 HD12 ILE A 900 -7.637 -1.113 -6.438 1.00 0.00 H new ATOM 0 HD13 ILE A 900 -7.919 -0.274 -4.894 1.00 0.00 H new ATOM 295 N GLN A 901 -3.396 -3.465 -4.615 1.00 0.00 N ATOM 296 CA GLN A 901 -2.863 -4.632 -3.923 1.00 0.00 C ATOM 297 C GLN A 901 -1.340 -4.579 -3.862 1.00 0.00 C ATOM 298 O GLN A 901 -0.747 -4.716 -2.792 1.00 0.00 O ATOM 299 CB GLN A 901 -3.313 -5.916 -4.622 1.00 0.00 C ATOM 300 CG GLN A 901 -4.769 -6.269 -4.367 1.00 0.00 C ATOM 301 CD GLN A 901 -5.695 -5.079 -4.526 1.00 0.00 C ATOM 302 OE1 GLN A 901 -5.903 -4.342 -3.442 1.00 0.00 O flip ATOM 303 NE2 GLN A 901 -6.218 -4.826 -5.611 1.00 0.00 N flip ATOM 0 H GLN A 901 -3.971 -3.683 -5.429 1.00 0.00 H new ATOM 0 HA GLN A 901 -3.250 -4.627 -2.904 1.00 0.00 H new ATOM 0 HB2 GLN A 901 -3.156 -5.810 -5.695 1.00 0.00 H new ATOM 0 HB3 GLN A 901 -2.684 -6.741 -4.288 1.00 0.00 H new ATOM 0 HG2 GLN A 901 -5.074 -7.056 -5.056 1.00 0.00 H new ATOM 0 HG3 GLN A 901 -4.870 -6.671 -3.359 1.00 0.00 H new ATOM 0 HE21 GLN A 901 -6.030 -5.420 -6.419 1.00 0.00 H new ATOM 0 HE22 GLN A 901 -6.839 -4.022 -5.703 1.00 0.00 H new ATOM 312 N ASN A 902 -0.712 -4.380 -5.016 1.00 0.00 N ATOM 313 CA ASN A 902 0.742 -4.311 -5.093 1.00 0.00 C ATOM 314 C ASN A 902 1.291 -3.280 -4.111 1.00 0.00 C ATOM 315 O ASN A 902 2.280 -3.529 -3.421 1.00 0.00 O ATOM 316 CB ASN A 902 1.182 -3.960 -6.516 1.00 0.00 C ATOM 317 CG ASN A 902 1.332 -5.187 -7.394 1.00 0.00 C ATOM 318 OD1 ASN A 902 1.922 -6.188 -6.987 1.00 0.00 O ATOM 319 ND2 ASN A 902 0.796 -5.116 -8.607 1.00 0.00 N ATOM 0 H ASN A 902 -1.188 -4.264 -5.911 1.00 0.00 H new ATOM 0 HA ASN A 902 1.142 -5.290 -4.827 1.00 0.00 H new ATOM 0 HB2 ASN A 902 0.453 -3.284 -6.963 1.00 0.00 H new ATOM 0 HB3 ASN A 902 2.131 -3.425 -6.478 1.00 0.00 H new ATOM 0 HD21 ASN A 902 0.865 -5.911 -9.242 1.00 0.00 H new ATOM 0 HD22 ASN A 902 0.316 -4.266 -8.903 1.00 0.00 H new ATOM 326 N PHE A 903 0.641 -2.123 -4.053 1.00 0.00 N ATOM 327 CA PHE A 903 1.063 -1.053 -3.155 1.00 0.00 C ATOM 328 C PHE A 903 1.116 -1.545 -1.711 1.00 0.00 C ATOM 329 O PHE A 903 2.142 -1.429 -1.041 1.00 0.00 O ATOM 330 CB PHE A 903 0.110 0.139 -3.265 1.00 0.00 C ATOM 331 CG PHE A 903 0.669 1.408 -2.687 1.00 0.00 C ATOM 332 CD1 PHE A 903 1.844 1.952 -3.181 1.00 0.00 C ATOM 333 CD2 PHE A 903 0.020 2.056 -1.649 1.00 0.00 C ATOM 334 CE1 PHE A 903 2.361 3.119 -2.652 1.00 0.00 C ATOM 335 CE2 PHE A 903 0.532 3.224 -1.115 1.00 0.00 C ATOM 336 CZ PHE A 903 1.704 3.755 -1.616 1.00 0.00 C ATOM 0 H PHE A 903 -0.180 -1.902 -4.617 1.00 0.00 H new ATOM 0 HA PHE A 903 2.064 -0.738 -3.450 1.00 0.00 H new ATOM 0 HB2 PHE A 903 -0.134 0.304 -4.315 1.00 0.00 H new ATOM 0 HB3 PHE A 903 -0.823 -0.103 -2.755 1.00 0.00 H new ATOM 0 HD1 PHE A 903 2.362 1.458 -3.989 1.00 0.00 H new ATOM 0 HD2 PHE A 903 -0.896 1.644 -1.252 1.00 0.00 H new ATOM 0 HE1 PHE A 903 3.277 3.533 -3.047 1.00 0.00 H new ATOM 0 HE2 PHE A 903 0.016 3.721 -0.307 1.00 0.00 H new ATOM 0 HZ PHE A 903 2.107 4.666 -1.199 1.00 0.00 H new ATOM 346 N LYS A 904 0.002 -2.092 -1.238 1.00 0.00 N ATOM 347 CA LYS A 904 -0.081 -2.603 0.126 1.00 0.00 C ATOM 348 C LYS A 904 1.105 -3.509 0.440 1.00 0.00 C ATOM 349 O LYS A 904 1.832 -3.283 1.407 1.00 0.00 O ATOM 350 CB LYS A 904 -1.390 -3.369 0.327 1.00 0.00 C ATOM 351 CG LYS A 904 -2.620 -2.478 0.339 1.00 0.00 C ATOM 352 CD LYS A 904 -3.878 -3.261 0.002 1.00 0.00 C ATOM 353 CE LYS A 904 -5.132 -2.447 0.280 1.00 0.00 C ATOM 354 NZ LYS A 904 -5.595 -2.603 1.687 1.00 0.00 N ATOM 0 H LYS A 904 -0.857 -2.193 -1.779 1.00 0.00 H new ATOM 0 HA LYS A 904 -0.057 -1.753 0.808 1.00 0.00 H new ATOM 0 HB2 LYS A 904 -1.495 -4.108 -0.468 1.00 0.00 H new ATOM 0 HB3 LYS A 904 -1.340 -3.917 1.268 1.00 0.00 H new ATOM 0 HG2 LYS A 904 -2.728 -2.019 1.322 1.00 0.00 H new ATOM 0 HG3 LYS A 904 -2.491 -1.668 -0.379 1.00 0.00 H new ATOM 0 HD2 LYS A 904 -3.857 -3.551 -1.048 1.00 0.00 H new ATOM 0 HD3 LYS A 904 -3.903 -4.181 0.586 1.00 0.00 H new ATOM 0 HE2 LYS A 904 -4.934 -1.394 0.078 1.00 0.00 H new ATOM 0 HE3 LYS A 904 -5.925 -2.758 -0.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 904 -6.452 -2.032 1.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 904 -5.809 -3.604 1.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 904 -4.848 -2.282 2.336 1.00 0.00 H new ATOM 368 N ALA A 905 1.295 -4.534 -0.384 1.00 0.00 N ATOM 369 CA ALA A 905 2.395 -5.472 -0.195 1.00 0.00 C ATOM 370 C ALA A 905 3.726 -4.740 -0.071 1.00 0.00 C ATOM 371 O ALA A 905 4.547 -5.063 0.789 1.00 0.00 O ATOM 372 CB ALA A 905 2.443 -6.468 -1.345 1.00 0.00 C ATOM 0 H ALA A 905 0.702 -4.736 -1.189 1.00 0.00 H new ATOM 0 HA ALA A 905 2.221 -6.015 0.734 1.00 0.00 H new ATOM 0 HB1 ALA A 905 3.269 -7.162 -1.191 1.00 0.00 H new ATOM 0 HB2 ALA A 905 1.506 -7.023 -1.385 1.00 0.00 H new ATOM 0 HB3 ALA A 905 2.589 -5.933 -2.284 1.00 0.00 H new ATOM 378 N LEU A 906 3.935 -3.752 -0.935 1.00 0.00 N ATOM 379 CA LEU A 906 5.169 -2.973 -0.922 1.00 0.00 C ATOM 380 C LEU A 906 5.344 -2.252 0.410 1.00 0.00 C ATOM 381 O LEU A 906 6.446 -2.194 0.957 1.00 0.00 O ATOM 382 CB LEU A 906 5.166 -1.959 -2.068 1.00 0.00 C ATOM 383 CG LEU A 906 6.170 -0.812 -1.950 1.00 0.00 C ATOM 384 CD1 LEU A 906 7.576 -1.298 -2.265 1.00 0.00 C ATOM 385 CD2 LEU A 906 5.780 0.334 -2.873 1.00 0.00 C ATOM 0 H LEU A 906 3.267 -3.472 -1.653 1.00 0.00 H new ATOM 0 HA LEU A 906 6.005 -3.660 -1.054 1.00 0.00 H new ATOM 0 HB2 LEU A 906 5.361 -2.492 -2.999 1.00 0.00 H new ATOM 0 HB3 LEU A 906 4.166 -1.533 -2.148 1.00 0.00 H new ATOM 0 HG LEU A 906 6.156 -0.447 -0.923 1.00 0.00 H new ATOM 0 HD11 LEU A 906 8.276 -0.468 -2.176 1.00 0.00 H new ATOM 0 HD12 LEU A 906 7.855 -2.085 -1.564 1.00 0.00 H new ATOM 0 HD13 LEU A 906 7.606 -1.690 -3.281 1.00 0.00 H new ATOM 0 HD21 LEU A 906 6.505 1.142 -2.776 1.00 0.00 H new ATOM 0 HD22 LEU A 906 5.765 -0.019 -3.904 1.00 0.00 H new ATOM 0 HD23 LEU A 906 4.790 0.700 -2.600 1.00 0.00 H new ATOM 397 N LEU A 907 4.250 -1.705 0.929 1.00 0.00 N ATOM 398 CA LEU A 907 4.282 -0.989 2.200 1.00 0.00 C ATOM 399 C LEU A 907 4.738 -1.906 3.330 1.00 0.00 C ATOM 400 O LEU A 907 5.521 -1.505 4.191 1.00 0.00 O ATOM 401 CB LEU A 907 2.900 -0.416 2.519 1.00 0.00 C ATOM 402 CG LEU A 907 2.366 0.631 1.541 1.00 0.00 C ATOM 403 CD1 LEU A 907 0.864 0.803 1.710 1.00 0.00 C ATOM 404 CD2 LEU A 907 3.082 1.960 1.738 1.00 0.00 C ATOM 0 H LEU A 907 3.330 -1.743 0.490 1.00 0.00 H new ATOM 0 HA LEU A 907 4.996 -0.171 2.111 1.00 0.00 H new ATOM 0 HB2 LEU A 907 2.188 -1.240 2.562 1.00 0.00 H new ATOM 0 HB3 LEU A 907 2.934 0.029 3.514 1.00 0.00 H new ATOM 0 HG LEU A 907 2.559 0.284 0.526 1.00 0.00 H new ATOM 0 HD11 LEU A 907 0.502 1.552 1.006 1.00 0.00 H new ATOM 0 HD12 LEU A 907 0.365 -0.147 1.518 1.00 0.00 H new ATOM 0 HD13 LEU A 907 0.647 1.127 2.728 1.00 0.00 H new ATOM 0 HD21 LEU A 907 2.689 2.693 1.033 1.00 0.00 H new ATOM 0 HD22 LEU A 907 2.920 2.313 2.757 1.00 0.00 H new ATOM 0 HD23 LEU A 907 4.150 1.827 1.565 1.00 0.00 H new ATOM 416 N SER A 908 4.243 -3.140 3.320 1.00 0.00 N ATOM 417 CA SER A 908 4.599 -4.114 4.346 1.00 0.00 C ATOM 418 C SER A 908 5.976 -4.712 4.074 1.00 0.00 C ATOM 419 O SER A 908 6.657 -5.173 4.990 1.00 0.00 O ATOM 420 CB SER A 908 3.551 -5.227 4.407 1.00 0.00 C ATOM 421 OG SER A 908 3.903 -6.207 5.368 1.00 0.00 O ATOM 0 H SER A 908 3.595 -3.489 2.614 1.00 0.00 H new ATOM 0 HA SER A 908 4.629 -3.599 5.306 1.00 0.00 H new ATOM 0 HB2 SER A 908 2.579 -4.802 4.656 1.00 0.00 H new ATOM 0 HB3 SER A 908 3.454 -5.693 3.427 1.00 0.00 H new ATOM 0 HG SER A 908 3.217 -6.906 5.389 1.00 0.00 H new ATOM 427 N ASP A 909 6.380 -4.700 2.808 1.00 0.00 N ATOM 428 CA ASP A 909 7.676 -5.239 2.414 1.00 0.00 C ATOM 429 C ASP A 909 8.809 -4.339 2.898 1.00 0.00 C ATOM 430 O ASP A 909 9.857 -4.821 3.326 1.00 0.00 O ATOM 431 CB ASP A 909 7.746 -5.395 0.894 1.00 0.00 C ATOM 432 CG ASP A 909 8.666 -6.523 0.470 1.00 0.00 C ATOM 433 OD1 ASP A 909 8.697 -7.558 1.169 1.00 0.00 O ATOM 434 OD2 ASP A 909 9.353 -6.372 -0.561 1.00 0.00 O ATOM 0 H ASP A 909 5.828 -4.323 2.037 1.00 0.00 H new ATOM 0 HA ASP A 909 7.791 -6.219 2.878 1.00 0.00 H new ATOM 0 HB2 ASP A 909 6.745 -5.580 0.504 1.00 0.00 H new ATOM 0 HB3 ASP A 909 8.093 -4.461 0.451 1.00 0.00 H new ATOM 439 N MET A 910 8.590 -3.030 2.827 1.00 0.00 N ATOM 440 CA MET A 910 9.592 -2.063 3.258 1.00 0.00 C ATOM 441 C MET A 910 9.294 -1.562 4.668 1.00 0.00 C ATOM 442 O MET A 910 10.143 -1.632 5.555 1.00 0.00 O ATOM 443 CB MET A 910 9.646 -0.883 2.286 1.00 0.00 C ATOM 444 CG MET A 910 9.615 -1.299 0.824 1.00 0.00 C ATOM 445 SD MET A 910 11.195 -1.953 0.254 1.00 0.00 S ATOM 446 CE MET A 910 12.111 -0.438 -0.017 1.00 0.00 C ATOM 0 H MET A 910 7.727 -2.615 2.475 1.00 0.00 H new ATOM 0 HA MET A 910 10.561 -2.562 3.266 1.00 0.00 H new ATOM 0 HB2 MET A 910 8.804 -0.220 2.485 1.00 0.00 H new ATOM 0 HB3 MET A 910 10.554 -0.310 2.473 1.00 0.00 H new ATOM 0 HG2 MET A 910 8.841 -2.053 0.681 1.00 0.00 H new ATOM 0 HG3 MET A 910 9.340 -0.440 0.212 1.00 0.00 H new ATOM 0 HE1 MET A 910 13.080 -0.673 -0.456 1.00 0.00 H new ATOM 0 HE2 MET A 910 11.553 0.209 -0.694 1.00 0.00 H new ATOM 0 HE3 MET A 910 12.258 0.073 0.934 1.00 0.00 H new ATOM 456 N VAL A 911 8.081 -1.056 4.866 1.00 0.00 N ATOM 457 CA VAL A 911 7.670 -0.544 6.168 1.00 0.00 C ATOM 458 C VAL A 911 7.035 -1.641 7.015 1.00 0.00 C ATOM 459 O VAL A 911 5.852 -1.576 7.349 1.00 0.00 O ATOM 460 CB VAL A 911 6.671 0.620 6.024 1.00 0.00 C ATOM 461 CG1 VAL A 911 6.572 1.403 7.324 1.00 0.00 C ATOM 462 CG2 VAL A 911 7.076 1.529 4.873 1.00 0.00 C ATOM 0 H VAL A 911 7.366 -0.990 4.142 1.00 0.00 H new ATOM 0 HA VAL A 911 8.571 -0.181 6.663 1.00 0.00 H new ATOM 0 HB VAL A 911 5.687 0.207 5.802 1.00 0.00 H new ATOM 0 HG11 VAL A 911 5.862 2.221 7.203 1.00 0.00 H new ATOM 0 HG12 VAL A 911 6.232 0.742 8.122 1.00 0.00 H new ATOM 0 HG13 VAL A 911 7.551 1.808 7.581 1.00 0.00 H new ATOM 0 HG21 VAL A 911 6.360 2.346 4.785 1.00 0.00 H new ATOM 0 HG22 VAL A 911 8.069 1.936 5.063 1.00 0.00 H new ATOM 0 HG23 VAL A 911 7.090 0.957 3.945 1.00 0.00 H new ATOM 472 N ARG A 912 7.830 -2.649 7.359 1.00 0.00 N ATOM 473 CA ARG A 912 7.345 -3.762 8.167 1.00 0.00 C ATOM 474 C ARG A 912 7.051 -3.310 9.594 1.00 0.00 C ATOM 475 O ARG A 912 6.524 -4.075 10.402 1.00 0.00 O ATOM 476 CB ARG A 912 8.373 -4.895 8.181 1.00 0.00 C ATOM 477 CG ARG A 912 8.666 -5.470 6.805 1.00 0.00 C ATOM 478 CD ARG A 912 10.011 -6.178 6.771 1.00 0.00 C ATOM 479 NE ARG A 912 11.120 -5.258 7.006 1.00 0.00 N ATOM 480 CZ ARG A 912 12.331 -5.649 7.388 1.00 0.00 C ATOM 481 NH1 ARG A 912 12.587 -6.936 7.577 1.00 0.00 N ATOM 482 NH2 ARG A 912 13.289 -4.751 7.581 1.00 0.00 N ATOM 0 H ARG A 912 8.812 -2.718 7.091 1.00 0.00 H new ATOM 0 HA ARG A 912 6.419 -4.126 7.722 1.00 0.00 H new ATOM 0 HB2 ARG A 912 9.302 -4.526 8.616 1.00 0.00 H new ATOM 0 HB3 ARG A 912 8.012 -5.693 8.830 1.00 0.00 H new ATOM 0 HG2 ARG A 912 7.878 -6.170 6.527 1.00 0.00 H new ATOM 0 HG3 ARG A 912 8.656 -4.669 6.065 1.00 0.00 H new ATOM 0 HD2 ARG A 912 10.026 -6.964 7.526 1.00 0.00 H new ATOM 0 HD3 ARG A 912 10.141 -6.663 5.803 1.00 0.00 H new ATOM 0 HE ARG A 912 10.956 -4.261 6.869 1.00 0.00 H new ATOM 0 HH11 ARG A 912 11.853 -7.629 7.429 1.00 0.00 H new ATOM 0 HH12 ARG A 912 13.518 -7.233 7.870 1.00 0.00 H new ATOM 0 HH21 ARG A 912 13.096 -3.760 7.436 1.00 0.00 H new ATOM 0 HH22 ARG A 912 14.218 -5.052 7.874 1.00 0.00 H new ATOM 496 N SER A 913 7.396 -2.063 9.898 1.00 0.00 N ATOM 497 CA SER A 913 7.173 -1.511 11.229 1.00 0.00 C ATOM 498 C SER A 913 5.949 -0.600 11.241 1.00 0.00 C ATOM 499 O SER A 913 5.342 -0.343 10.201 1.00 0.00 O ATOM 500 CB SER A 913 8.405 -0.733 11.694 1.00 0.00 C ATOM 501 OG SER A 913 9.456 -1.612 12.058 1.00 0.00 O ATOM 0 H SER A 913 7.831 -1.416 9.241 1.00 0.00 H new ATOM 0 HA SER A 913 6.995 -2.340 11.914 1.00 0.00 H new ATOM 0 HB2 SER A 913 8.741 -0.069 10.898 1.00 0.00 H new ATOM 0 HB3 SER A 913 8.142 -0.104 12.544 1.00 0.00 H new ATOM 0 HG SER A 913 10.233 -1.090 12.350 1.00 0.00 H new ATOM 507 N SER A 914 5.591 -0.115 12.426 1.00 0.00 N ATOM 508 CA SER A 914 4.437 0.763 12.575 1.00 0.00 C ATOM 509 C SER A 914 4.849 2.104 13.176 1.00 0.00 C ATOM 510 O SER A 914 4.135 3.099 13.050 1.00 0.00 O ATOM 511 CB SER A 914 3.376 0.101 13.456 1.00 0.00 C ATOM 512 OG SER A 914 3.879 -0.151 14.757 1.00 0.00 O ATOM 0 H SER A 914 6.084 -0.315 13.296 1.00 0.00 H new ATOM 0 HA SER A 914 4.017 0.941 11.585 1.00 0.00 H new ATOM 0 HB2 SER A 914 2.499 0.745 13.520 1.00 0.00 H new ATOM 0 HB3 SER A 914 3.052 -0.835 13.000 1.00 0.00 H new ATOM 0 HG SER A 914 3.330 -0.836 15.193 1.00 0.00 H new ATOM 518 N ASP A 915 6.005 2.121 13.830 1.00 0.00 N ATOM 519 CA ASP A 915 6.515 3.338 14.451 1.00 0.00 C ATOM 520 C ASP A 915 7.342 4.149 13.458 1.00 0.00 C ATOM 521 O ASP A 915 8.435 4.615 13.779 1.00 0.00 O ATOM 522 CB ASP A 915 7.361 2.995 15.678 1.00 0.00 C ATOM 523 CG ASP A 915 6.579 2.222 16.722 1.00 0.00 C ATOM 524 OD1 ASP A 915 5.606 2.780 17.270 1.00 0.00 O ATOM 525 OD2 ASP A 915 6.941 1.057 16.990 1.00 0.00 O ATOM 0 H ASP A 915 6.607 1.306 13.944 1.00 0.00 H new ATOM 0 HA ASP A 915 5.663 3.941 14.765 1.00 0.00 H new ATOM 0 HB2 ASP A 915 8.225 2.408 15.367 1.00 0.00 H new ATOM 0 HB3 ASP A 915 7.743 3.915 16.121 1.00 0.00 H new ATOM 530 N VAL A 916 6.813 4.314 12.250 1.00 0.00 N ATOM 531 CA VAL A 916 7.501 5.068 11.209 1.00 0.00 C ATOM 532 C VAL A 916 6.755 6.356 10.879 1.00 0.00 C ATOM 533 O VAL A 916 5.745 6.678 11.504 1.00 0.00 O ATOM 534 CB VAL A 916 7.660 4.235 9.924 1.00 0.00 C ATOM 535 CG1 VAL A 916 8.492 2.991 10.193 1.00 0.00 C ATOM 536 CG2 VAL A 916 6.297 3.863 9.359 1.00 0.00 C ATOM 0 H VAL A 916 5.909 3.935 11.968 1.00 0.00 H new ATOM 0 HA VAL A 916 8.489 5.314 11.597 1.00 0.00 H new ATOM 0 HB VAL A 916 8.183 4.839 9.183 1.00 0.00 H new ATOM 0 HG11 VAL A 916 8.593 2.415 9.273 1.00 0.00 H new ATOM 0 HG12 VAL A 916 9.480 3.284 10.548 1.00 0.00 H new ATOM 0 HG13 VAL A 916 8.000 2.381 10.951 1.00 0.00 H new ATOM 0 HG21 VAL A 916 6.428 3.274 8.451 1.00 0.00 H new ATOM 0 HG22 VAL A 916 5.746 3.277 10.095 1.00 0.00 H new ATOM 0 HG23 VAL A 916 5.740 4.770 9.126 1.00 0.00 H new ATOM 546 N SER A 917 7.259 7.088 9.891 1.00 0.00 N ATOM 547 CA SER A 917 6.642 8.344 9.479 1.00 0.00 C ATOM 548 C SER A 917 6.229 8.290 8.011 1.00 0.00 C ATOM 549 O SER A 917 6.772 7.508 7.231 1.00 0.00 O ATOM 550 CB SER A 917 7.607 9.509 9.706 1.00 0.00 C ATOM 551 OG SER A 917 6.904 10.731 9.856 1.00 0.00 O ATOM 0 H SER A 917 8.092 6.834 9.361 1.00 0.00 H new ATOM 0 HA SER A 917 5.749 8.498 10.085 1.00 0.00 H new ATOM 0 HB2 SER A 917 8.208 9.320 10.596 1.00 0.00 H new ATOM 0 HB3 SER A 917 8.297 9.583 8.865 1.00 0.00 H new ATOM 0 HG SER A 917 7.543 11.460 10.002 1.00 0.00 H new ATOM 557 N TRP A 918 5.265 9.126 7.644 1.00 0.00 N ATOM 558 CA TRP A 918 4.778 9.174 6.270 1.00 0.00 C ATOM 559 C TRP A 918 5.885 9.606 5.315 1.00 0.00 C ATOM 560 O TRP A 918 6.061 9.019 4.247 1.00 0.00 O ATOM 561 CB TRP A 918 3.591 10.132 6.161 1.00 0.00 C ATOM 562 CG TRP A 918 3.304 10.565 4.755 1.00 0.00 C ATOM 563 CD1 TRP A 918 3.141 11.845 4.309 1.00 0.00 C ATOM 564 CD2 TRP A 918 3.143 9.716 3.613 1.00 0.00 C ATOM 565 NE1 TRP A 918 2.889 11.844 2.958 1.00 0.00 N ATOM 566 CE2 TRP A 918 2.886 10.551 2.507 1.00 0.00 C ATOM 567 CE3 TRP A 918 3.193 8.334 3.416 1.00 0.00 C ATOM 568 CZ2 TRP A 918 2.680 10.046 1.226 1.00 0.00 C ATOM 569 CZ3 TRP A 918 2.988 7.834 2.144 1.00 0.00 C ATOM 570 CH2 TRP A 918 2.734 8.688 1.063 1.00 0.00 C ATOM 0 H TRP A 918 4.805 9.780 8.278 1.00 0.00 H new ATOM 0 HA TRP A 918 4.454 8.172 5.991 1.00 0.00 H new ATOM 0 HB2 TRP A 918 2.705 9.649 6.573 1.00 0.00 H new ATOM 0 HB3 TRP A 918 3.787 11.013 6.772 1.00 0.00 H new ATOM 0 HD1 TRP A 918 3.201 12.729 4.927 1.00 0.00 H new ATOM 0 HE1 TRP A 918 2.730 12.672 2.384 1.00 0.00 H new ATOM 0 HE3 TRP A 918 3.388 7.668 4.243 1.00 0.00 H new ATOM 0 HZ2 TRP A 918 2.485 10.702 0.391 1.00 0.00 H new ATOM 0 HZ3 TRP A 918 3.024 6.767 1.981 1.00 0.00 H new ATOM 0 HH2 TRP A 918 2.578 8.266 0.081 1.00 0.00 H new ATOM 581 N SER A 919 6.629 10.636 5.705 1.00 0.00 N ATOM 582 CA SER A 919 7.718 11.148 4.881 1.00 0.00 C ATOM 583 C SER A 919 8.811 10.098 4.710 1.00 0.00 C ATOM 584 O SER A 919 9.205 9.774 3.590 1.00 0.00 O ATOM 585 CB SER A 919 8.305 12.415 5.506 1.00 0.00 C ATOM 586 OG SER A 919 7.290 13.364 5.787 1.00 0.00 O ATOM 0 H SER A 919 6.498 11.132 6.586 1.00 0.00 H new ATOM 0 HA SER A 919 7.314 11.389 3.898 1.00 0.00 H new ATOM 0 HB2 SER A 919 8.833 12.160 6.425 1.00 0.00 H new ATOM 0 HB3 SER A 919 9.038 12.852 4.828 1.00 0.00 H new ATOM 0 HG SER A 919 7.691 14.163 6.187 1.00 0.00 H new ATOM 592 N ASP A 920 9.296 9.570 5.828 1.00 0.00 N ATOM 593 CA ASP A 920 10.343 8.556 5.804 1.00 0.00 C ATOM 594 C ASP A 920 9.985 7.429 4.840 1.00 0.00 C ATOM 595 O ASP A 920 10.805 7.012 4.022 1.00 0.00 O ATOM 596 CB ASP A 920 10.569 7.991 7.207 1.00 0.00 C ATOM 597 CG ASP A 920 11.494 8.858 8.038 1.00 0.00 C ATOM 598 OD1 ASP A 920 11.007 9.837 8.643 1.00 0.00 O ATOM 599 OD2 ASP A 920 12.705 8.558 8.084 1.00 0.00 O ATOM 0 H ASP A 920 8.980 9.828 6.763 1.00 0.00 H new ATOM 0 HA ASP A 920 11.263 9.027 5.459 1.00 0.00 H new ATOM 0 HB2 ASP A 920 9.610 7.896 7.716 1.00 0.00 H new ATOM 0 HB3 ASP A 920 10.989 6.988 7.128 1.00 0.00 H new ATOM 604 N THR A 921 8.753 6.938 4.943 1.00 0.00 N ATOM 605 CA THR A 921 8.287 5.858 4.083 1.00 0.00 C ATOM 606 C THR A 921 8.242 6.297 2.624 1.00 0.00 C ATOM 607 O THR A 921 8.946 5.745 1.777 1.00 0.00 O ATOM 608 CB THR A 921 6.888 5.369 4.503 1.00 0.00 C ATOM 609 OG1 THR A 921 6.941 4.804 5.817 1.00 0.00 O ATOM 610 CG2 THR A 921 6.359 4.334 3.521 1.00 0.00 C ATOM 0 H THR A 921 8.061 7.272 5.614 1.00 0.00 H new ATOM 0 HA THR A 921 8.998 5.039 4.192 1.00 0.00 H new ATOM 0 HB THR A 921 6.213 6.225 4.503 1.00 0.00 H new ATOM 0 HG1 THR A 921 6.034 4.587 6.117 1.00 0.00 H new ATOM 0 HG21 THR A 921 5.370 4.003 3.838 1.00 0.00 H new ATOM 0 HG22 THR A 921 6.292 4.776 2.527 1.00 0.00 H new ATOM 0 HG23 THR A 921 7.035 3.480 3.493 1.00 0.00 H new ATOM 618 N ARG A 922 7.411 7.293 2.336 1.00 0.00 N ATOM 619 CA ARG A 922 7.274 7.806 0.978 1.00 0.00 C ATOM 620 C ARG A 922 8.610 7.759 0.242 1.00 0.00 C ATOM 621 O ARG A 922 8.741 7.096 -0.786 1.00 0.00 O ATOM 622 CB ARG A 922 6.744 9.241 1.003 1.00 0.00 C ATOM 623 CG ARG A 922 6.052 9.657 -0.285 1.00 0.00 C ATOM 624 CD ARG A 922 5.462 11.054 -0.174 1.00 0.00 C ATOM 625 NE ARG A 922 4.830 11.482 -1.420 1.00 0.00 N ATOM 626 CZ ARG A 922 4.271 12.675 -1.588 1.00 0.00 C ATOM 627 NH1 ARG A 922 4.267 13.555 -0.596 1.00 0.00 N ATOM 628 NH2 ARG A 922 3.716 12.990 -2.751 1.00 0.00 N ATOM 0 H ARG A 922 6.822 7.761 3.025 1.00 0.00 H new ATOM 0 HA ARG A 922 6.563 7.173 0.447 1.00 0.00 H new ATOM 0 HB2 ARG A 922 6.044 9.347 1.832 1.00 0.00 H new ATOM 0 HB3 ARG A 922 7.573 9.922 1.197 1.00 0.00 H new ATOM 0 HG2 ARG A 922 6.765 9.626 -1.109 1.00 0.00 H new ATOM 0 HG3 ARG A 922 5.261 8.945 -0.521 1.00 0.00 H new ATOM 0 HD2 ARG A 922 4.727 11.074 0.631 1.00 0.00 H new ATOM 0 HD3 ARG A 922 6.248 11.759 0.095 1.00 0.00 H new ATOM 0 HE ARG A 922 4.817 10.829 -2.203 1.00 0.00 H new ATOM 0 HH11 ARG A 922 4.694 13.316 0.299 1.00 0.00 H new ATOM 0 HH12 ARG A 922 3.837 14.470 -0.728 1.00 0.00 H new ATOM 0 HH21 ARG A 922 3.718 12.316 -3.516 1.00 0.00 H new ATOM 0 HH22 ARG A 922 3.287 13.906 -2.880 1.00 0.00 H new ATOM 642 N ARG A 923 9.599 8.469 0.776 1.00 0.00 N ATOM 643 CA ARG A 923 10.924 8.509 0.169 1.00 0.00 C ATOM 644 C ARG A 923 11.515 7.107 0.059 1.00 0.00 C ATOM 645 O ARG A 923 12.102 6.747 -0.962 1.00 0.00 O ATOM 646 CB ARG A 923 11.857 9.404 0.989 1.00 0.00 C ATOM 647 CG ARG A 923 13.117 9.814 0.245 1.00 0.00 C ATOM 648 CD ARG A 923 14.152 10.407 1.187 1.00 0.00 C ATOM 649 NE ARG A 923 13.945 11.837 1.397 1.00 0.00 N ATOM 650 CZ ARG A 923 13.084 12.334 2.279 1.00 0.00 C ATOM 651 NH1 ARG A 923 12.354 11.519 3.029 1.00 0.00 N ATOM 652 NH2 ARG A 923 12.952 13.647 2.412 1.00 0.00 N ATOM 0 H ARG A 923 9.508 9.024 1.627 1.00 0.00 H new ATOM 0 HA ARG A 923 10.824 8.922 -0.835 1.00 0.00 H new ATOM 0 HB2 ARG A 923 11.315 10.301 1.290 1.00 0.00 H new ATOM 0 HB3 ARG A 923 12.139 8.880 1.902 1.00 0.00 H new ATOM 0 HG2 ARG A 923 13.540 8.947 -0.262 1.00 0.00 H new ATOM 0 HG3 ARG A 923 12.865 10.543 -0.526 1.00 0.00 H new ATOM 0 HD2 ARG A 923 14.108 9.890 2.145 1.00 0.00 H new ATOM 0 HD3 ARG A 923 15.150 10.241 0.780 1.00 0.00 H new ATOM 0 HE ARG A 923 14.491 12.491 0.836 1.00 0.00 H new ATOM 0 HH11 ARG A 923 12.453 10.509 2.929 1.00 0.00 H new ATOM 0 HH12 ARG A 923 11.694 11.903 3.705 1.00 0.00 H new ATOM 0 HH21 ARG A 923 13.512 14.277 1.837 1.00 0.00 H new ATOM 0 HH22 ARG A 923 12.291 14.027 3.089 1.00 0.00 H new ATOM 666 N THR A 924 11.355 6.318 1.117 1.00 0.00 N ATOM 667 CA THR A 924 11.874 4.956 1.140 1.00 0.00 C ATOM 668 C THR A 924 11.366 4.154 -0.054 1.00 0.00 C ATOM 669 O THR A 924 12.014 3.206 -0.499 1.00 0.00 O ATOM 670 CB THR A 924 11.480 4.227 2.438 1.00 0.00 C ATOM 671 OG1 THR A 924 12.024 4.914 3.570 1.00 0.00 O ATOM 672 CG2 THR A 924 11.978 2.789 2.424 1.00 0.00 C ATOM 0 H THR A 924 10.870 6.599 1.969 1.00 0.00 H new ATOM 0 HA THR A 924 12.960 5.031 1.089 1.00 0.00 H new ATOM 0 HB THR A 924 10.392 4.218 2.507 1.00 0.00 H new ATOM 0 HG1 THR A 924 11.319 5.437 4.005 1.00 0.00 H new ATOM 0 HG21 THR A 924 11.688 2.294 3.351 1.00 0.00 H new ATOM 0 HG22 THR A 924 11.539 2.260 1.578 1.00 0.00 H new ATOM 0 HG23 THR A 924 13.064 2.781 2.333 1.00 0.00 H new ATOM 680 N LEU A 925 10.204 4.540 -0.569 1.00 0.00 N ATOM 681 CA LEU A 925 9.609 3.858 -1.712 1.00 0.00 C ATOM 682 C LEU A 925 9.988 4.551 -3.017 1.00 0.00 C ATOM 683 O LEU A 925 10.151 3.903 -4.051 1.00 0.00 O ATOM 684 CB LEU A 925 8.087 3.812 -1.569 1.00 0.00 C ATOM 685 CG LEU A 925 7.555 3.337 -0.216 1.00 0.00 C ATOM 686 CD1 LEU A 925 6.068 3.632 -0.095 1.00 0.00 C ATOM 687 CD2 LEU A 925 7.822 1.850 -0.030 1.00 0.00 C ATOM 0 H LEU A 925 9.655 5.322 -0.213 1.00 0.00 H new ATOM 0 HA LEU A 925 9.996 2.839 -1.737 1.00 0.00 H new ATOM 0 HB2 LEU A 925 7.693 4.810 -1.762 1.00 0.00 H new ATOM 0 HB3 LEU A 925 7.689 3.157 -2.344 1.00 0.00 H new ATOM 0 HG LEU A 925 8.078 3.881 0.570 1.00 0.00 H new ATOM 0 HD11 LEU A 925 5.706 3.287 0.874 1.00 0.00 H new ATOM 0 HD12 LEU A 925 5.902 4.706 -0.183 1.00 0.00 H new ATOM 0 HD13 LEU A 925 5.529 3.115 -0.889 1.00 0.00 H new ATOM 0 HD21 LEU A 925 7.437 1.529 0.938 1.00 0.00 H new ATOM 0 HD22 LEU A 925 7.325 1.289 -0.822 1.00 0.00 H new ATOM 0 HD23 LEU A 925 8.895 1.665 -0.073 1.00 0.00 H new ATOM 699 N ARG A 926 10.127 5.871 -2.961 1.00 0.00 N ATOM 700 CA ARG A 926 10.487 6.652 -4.138 1.00 0.00 C ATOM 701 C ARG A 926 11.686 6.036 -4.853 1.00 0.00 C ATOM 702 O ARG A 926 11.724 5.972 -6.082 1.00 0.00 O ATOM 703 CB ARG A 926 10.803 8.096 -3.742 1.00 0.00 C ATOM 704 CG ARG A 926 9.569 8.973 -3.605 1.00 0.00 C ATOM 705 CD ARG A 926 9.937 10.448 -3.551 1.00 0.00 C ATOM 706 NE ARG A 926 10.552 10.904 -4.795 1.00 0.00 N ATOM 707 CZ ARG A 926 11.158 12.078 -4.928 1.00 0.00 C ATOM 708 NH1 ARG A 926 11.231 12.911 -3.898 1.00 0.00 N ATOM 709 NH2 ARG A 926 11.694 12.422 -6.092 1.00 0.00 N ATOM 0 H ARG A 926 9.996 6.422 -2.113 1.00 0.00 H new ATOM 0 HA ARG A 926 9.637 6.647 -4.820 1.00 0.00 H new ATOM 0 HB2 ARG A 926 11.344 8.094 -2.796 1.00 0.00 H new ATOM 0 HB3 ARG A 926 11.467 8.532 -4.488 1.00 0.00 H new ATOM 0 HG2 ARG A 926 8.899 8.795 -4.446 1.00 0.00 H new ATOM 0 HG3 ARG A 926 9.025 8.699 -2.701 1.00 0.00 H new ATOM 0 HD2 ARG A 926 9.042 11.038 -3.351 1.00 0.00 H new ATOM 0 HD3 ARG A 926 10.624 10.620 -2.722 1.00 0.00 H new ATOM 0 HE ARG A 926 10.514 10.287 -5.606 1.00 0.00 H new ATOM 0 HH11 ARG A 926 10.821 12.650 -3.001 1.00 0.00 H new ATOM 0 HH12 ARG A 926 11.697 13.812 -4.003 1.00 0.00 H new ATOM 0 HH21 ARG A 926 11.641 11.784 -6.886 1.00 0.00 H new ATOM 0 HH22 ARG A 926 12.159 13.324 -6.193 1.00 0.00 H new ATOM 723 N LYS A 927 12.665 5.585 -4.076 1.00 0.00 N ATOM 724 CA LYS A 927 13.865 4.974 -4.633 1.00 0.00 C ATOM 725 C LYS A 927 13.561 3.586 -5.189 1.00 0.00 C ATOM 726 O LYS A 927 14.205 3.131 -6.134 1.00 0.00 O ATOM 727 CB LYS A 927 14.957 4.879 -3.565 1.00 0.00 C ATOM 728 CG LYS A 927 14.591 3.977 -2.399 1.00 0.00 C ATOM 729 CD LYS A 927 15.731 3.864 -1.401 1.00 0.00 C ATOM 730 CE LYS A 927 15.270 3.228 -0.098 1.00 0.00 C ATOM 731 NZ LYS A 927 16.128 3.633 1.050 1.00 0.00 N ATOM 0 H LYS A 927 12.650 5.632 -3.057 1.00 0.00 H new ATOM 0 HA LYS A 927 14.218 5.604 -5.449 1.00 0.00 H new ATOM 0 HB2 LYS A 927 15.873 4.509 -4.026 1.00 0.00 H new ATOM 0 HB3 LYS A 927 15.171 5.879 -3.187 1.00 0.00 H new ATOM 0 HG2 LYS A 927 13.706 4.369 -1.898 1.00 0.00 H new ATOM 0 HG3 LYS A 927 14.333 2.986 -2.772 1.00 0.00 H new ATOM 0 HD2 LYS A 927 16.536 3.269 -1.832 1.00 0.00 H new ATOM 0 HD3 LYS A 927 16.139 4.854 -1.199 1.00 0.00 H new ATOM 0 HE2 LYS A 927 14.238 3.515 0.101 1.00 0.00 H new ATOM 0 HE3 LYS A 927 15.285 2.143 -0.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 927 15.782 3.179 1.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 927 17.109 3.337 0.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 927 16.093 4.666 1.162 1.00 0.00 H new ATOM 745 N ASP A 928 12.576 2.920 -4.597 1.00 0.00 N ATOM 746 CA ASP A 928 12.185 1.585 -5.035 1.00 0.00 C ATOM 747 C ASP A 928 11.741 1.600 -6.495 1.00 0.00 C ATOM 748 O ASP A 928 11.578 2.664 -7.094 1.00 0.00 O ATOM 749 CB ASP A 928 11.059 1.045 -4.153 1.00 0.00 C ATOM 750 CG ASP A 928 10.702 -0.391 -4.483 1.00 0.00 C ATOM 751 OD1 ASP A 928 11.621 -1.235 -4.533 1.00 0.00 O ATOM 752 OD2 ASP A 928 9.503 -0.671 -4.691 1.00 0.00 O ATOM 0 H ASP A 928 12.034 3.282 -3.813 1.00 0.00 H new ATOM 0 HA ASP A 928 13.053 0.931 -4.944 1.00 0.00 H new ATOM 0 HB2 ASP A 928 11.358 1.111 -3.107 1.00 0.00 H new ATOM 0 HB3 ASP A 928 10.176 1.672 -4.272 1.00 0.00 H new ATOM 757 N HIS A 929 11.549 0.414 -7.062 1.00 0.00 N ATOM 758 CA HIS A 929 11.125 0.291 -8.452 1.00 0.00 C ATOM 759 C HIS A 929 9.607 0.173 -8.549 1.00 0.00 C ATOM 760 O HIS A 929 8.971 0.860 -9.348 1.00 0.00 O ATOM 761 CB HIS A 929 11.785 -0.925 -9.103 1.00 0.00 C ATOM 762 CG HIS A 929 11.354 -1.154 -10.519 1.00 0.00 C ATOM 763 ND1 HIS A 929 12.074 -0.705 -11.607 1.00 0.00 N ATOM 764 CD2 HIS A 929 10.272 -1.791 -11.023 1.00 0.00 C ATOM 765 CE1 HIS A 929 11.451 -1.054 -12.718 1.00 0.00 C ATOM 766 NE2 HIS A 929 10.355 -1.715 -12.392 1.00 0.00 N ATOM 0 H HIS A 929 11.680 -0.476 -6.581 1.00 0.00 H new ATOM 0 HA HIS A 929 11.436 1.191 -8.982 1.00 0.00 H new ATOM 0 HB2 HIS A 929 12.867 -0.798 -9.077 1.00 0.00 H new ATOM 0 HB3 HIS A 929 11.554 -1.812 -8.514 1.00 0.00 H new ATOM 0 HD2 HIS A 929 9.489 -2.270 -10.455 1.00 0.00 H new ATOM 0 HE1 HIS A 929 11.782 -0.836 -13.723 1.00 0.00 H new ATOM 0 HE2 HIS A 929 9.680 -2.105 -13.050 1.00 0.00 H new ATOM 774 N ARG A 930 9.033 -0.703 -7.730 1.00 0.00 N ATOM 775 CA ARG A 930 7.590 -0.912 -7.725 1.00 0.00 C ATOM 776 C ARG A 930 6.850 0.410 -7.547 1.00 0.00 C ATOM 777 O ARG A 930 5.759 0.599 -8.085 1.00 0.00 O ATOM 778 CB ARG A 930 7.198 -1.883 -6.609 1.00 0.00 C ATOM 779 CG ARG A 930 7.680 -3.305 -6.842 1.00 0.00 C ATOM 780 CD ARG A 930 9.095 -3.506 -6.325 1.00 0.00 C ATOM 781 NE ARG A 930 9.347 -4.893 -5.942 1.00 0.00 N ATOM 782 CZ ARG A 930 8.962 -5.417 -4.784 1.00 0.00 C ATOM 783 NH1 ARG A 930 8.311 -4.674 -3.900 1.00 0.00 N ATOM 784 NH2 ARG A 930 9.228 -6.688 -4.509 1.00 0.00 N ATOM 0 H ARG A 930 9.545 -1.279 -7.062 1.00 0.00 H new ATOM 0 HA ARG A 930 7.307 -1.340 -8.686 1.00 0.00 H new ATOM 0 HB2 ARG A 930 7.604 -1.521 -5.665 1.00 0.00 H new ATOM 0 HB3 ARG A 930 6.113 -1.888 -6.508 1.00 0.00 H new ATOM 0 HG2 ARG A 930 7.007 -4.004 -6.345 1.00 0.00 H new ATOM 0 HG3 ARG A 930 7.645 -3.532 -7.908 1.00 0.00 H new ATOM 0 HD2 ARG A 930 9.808 -3.207 -7.094 1.00 0.00 H new ATOM 0 HD3 ARG A 930 9.262 -2.857 -5.466 1.00 0.00 H new ATOM 0 HE ARG A 930 9.846 -5.492 -6.600 1.00 0.00 H new ATOM 0 HH11 ARG A 930 8.105 -3.697 -4.108 1.00 0.00 H new ATOM 0 HH12 ARG A 930 8.017 -5.079 -3.011 1.00 0.00 H new ATOM 0 HH21 ARG A 930 9.728 -7.263 -5.187 1.00 0.00 H new ATOM 0 HH22 ARG A 930 8.932 -7.090 -3.619 1.00 0.00 H new ATOM 798 N TRP A 931 7.450 1.321 -6.788 1.00 0.00 N ATOM 799 CA TRP A 931 6.847 2.625 -6.539 1.00 0.00 C ATOM 800 C TRP A 931 6.188 3.170 -7.801 1.00 0.00 C ATOM 801 O TRP A 931 5.127 3.792 -7.738 1.00 0.00 O ATOM 802 CB TRP A 931 7.903 3.610 -6.034 1.00 0.00 C ATOM 803 CG TRP A 931 7.462 5.041 -6.104 1.00 0.00 C ATOM 804 CD1 TRP A 931 7.632 5.900 -7.152 1.00 0.00 C ATOM 805 CD2 TRP A 931 6.781 5.778 -5.083 1.00 0.00 C ATOM 806 NE1 TRP A 931 7.097 7.128 -6.844 1.00 0.00 N ATOM 807 CE2 TRP A 931 6.569 7.079 -5.581 1.00 0.00 C ATOM 808 CE3 TRP A 931 6.329 5.467 -3.799 1.00 0.00 C ATOM 809 CZ2 TRP A 931 5.925 8.064 -4.837 1.00 0.00 C ATOM 810 CZ3 TRP A 931 5.691 6.446 -3.061 1.00 0.00 C ATOM 811 CH2 TRP A 931 5.492 7.731 -3.582 1.00 0.00 C ATOM 0 H TRP A 931 8.353 1.180 -6.335 1.00 0.00 H new ATOM 0 HA TRP A 931 6.079 2.503 -5.775 1.00 0.00 H new ATOM 0 HB2 TRP A 931 8.154 3.365 -5.002 1.00 0.00 H new ATOM 0 HB3 TRP A 931 8.813 3.489 -6.621 1.00 0.00 H new ATOM 0 HD1 TRP A 931 8.115 5.651 -8.085 1.00 0.00 H new ATOM 0 HE1 TRP A 931 7.094 7.944 -7.457 1.00 0.00 H new ATOM 0 HE3 TRP A 931 6.475 4.478 -3.390 1.00 0.00 H new ATOM 0 HZ2 TRP A 931 5.772 9.056 -5.236 1.00 0.00 H new ATOM 0 HZ3 TRP A 931 5.340 6.216 -2.066 1.00 0.00 H new ATOM 0 HH2 TRP A 931 4.987 8.473 -2.982 1.00 0.00 H new ATOM 822 N GLU A 932 6.822 2.933 -8.945 1.00 0.00 N ATOM 823 CA GLU A 932 6.295 3.402 -10.221 1.00 0.00 C ATOM 824 C GLU A 932 4.803 3.102 -10.337 1.00 0.00 C ATOM 825 O GLU A 932 3.994 4.001 -10.564 1.00 0.00 O ATOM 826 CB GLU A 932 7.050 2.748 -11.381 1.00 0.00 C ATOM 827 CG GLU A 932 8.297 3.508 -11.801 1.00 0.00 C ATOM 828 CD GLU A 932 9.283 3.685 -10.663 1.00 0.00 C ATOM 829 OE1 GLU A 932 8.996 4.486 -9.749 1.00 0.00 O ATOM 830 OE2 GLU A 932 10.342 3.023 -10.687 1.00 0.00 O ATOM 0 H GLU A 932 7.701 2.419 -9.014 1.00 0.00 H new ATOM 0 HA GLU A 932 6.435 4.482 -10.268 1.00 0.00 H new ATOM 0 HB2 GLU A 932 7.331 1.735 -11.095 1.00 0.00 H new ATOM 0 HB3 GLU A 932 6.381 2.663 -12.237 1.00 0.00 H new ATOM 0 HG2 GLU A 932 8.784 2.977 -12.619 1.00 0.00 H new ATOM 0 HG3 GLU A 932 8.010 4.487 -12.183 1.00 0.00 H new ATOM 837 N SER A 933 4.448 1.831 -10.180 1.00 0.00 N ATOM 838 CA SER A 933 3.054 1.410 -10.272 1.00 0.00 C ATOM 839 C SER A 933 2.182 2.204 -9.304 1.00 0.00 C ATOM 840 O SER A 933 1.057 2.579 -9.629 1.00 0.00 O ATOM 841 CB SER A 933 2.931 -0.086 -9.977 1.00 0.00 C ATOM 842 OG SER A 933 3.663 -0.439 -8.816 1.00 0.00 O ATOM 0 H SER A 933 5.105 1.075 -9.989 1.00 0.00 H new ATOM 0 HA SER A 933 2.708 1.603 -11.287 1.00 0.00 H new ATOM 0 HB2 SER A 933 1.882 -0.348 -9.843 1.00 0.00 H new ATOM 0 HB3 SER A 933 3.296 -0.659 -10.829 1.00 0.00 H new ATOM 0 HG SER A 933 4.139 0.348 -8.478 1.00 0.00 H new ATOM 848 N GLY A 934 2.712 2.458 -8.111 1.00 0.00 N ATOM 849 CA GLY A 934 1.970 3.206 -7.113 1.00 0.00 C ATOM 850 C GLY A 934 1.514 4.559 -7.623 1.00 0.00 C ATOM 851 O GLY A 934 0.668 5.208 -7.010 1.00 0.00 O ATOM 0 H GLY A 934 3.642 2.159 -7.818 1.00 0.00 H new ATOM 0 HA2 GLY A 934 1.101 2.627 -6.801 1.00 0.00 H new ATOM 0 HA3 GLY A 934 2.594 3.345 -6.230 1.00 0.00 H new ATOM 855 N SER A 935 2.078 4.986 -8.749 1.00 0.00 N ATOM 856 CA SER A 935 1.729 6.273 -9.338 1.00 0.00 C ATOM 857 C SER A 935 0.216 6.411 -9.484 1.00 0.00 C ATOM 858 O SER A 935 -0.373 7.402 -9.049 1.00 0.00 O ATOM 859 CB SER A 935 2.401 6.432 -10.703 1.00 0.00 C ATOM 860 OG SER A 935 1.977 7.622 -11.345 1.00 0.00 O ATOM 0 H SER A 935 2.778 4.459 -9.271 1.00 0.00 H new ATOM 0 HA SER A 935 2.086 7.059 -8.672 1.00 0.00 H new ATOM 0 HB2 SER A 935 3.484 6.448 -10.579 1.00 0.00 H new ATOM 0 HB3 SER A 935 2.165 5.573 -11.330 1.00 0.00 H new ATOM 0 HG SER A 935 2.422 7.701 -12.215 1.00 0.00 H new ATOM 866 N LEU A 936 -0.406 5.412 -10.099 1.00 0.00 N ATOM 867 CA LEU A 936 -1.850 5.420 -10.303 1.00 0.00 C ATOM 868 C LEU A 936 -2.575 5.900 -9.049 1.00 0.00 C ATOM 869 O LEU A 936 -3.568 6.624 -9.132 1.00 0.00 O ATOM 870 CB LEU A 936 -2.339 4.022 -10.684 1.00 0.00 C ATOM 871 CG LEU A 936 -2.049 3.577 -12.118 1.00 0.00 C ATOM 872 CD1 LEU A 936 -2.126 2.062 -12.233 1.00 0.00 C ATOM 873 CD2 LEU A 936 -3.018 4.237 -13.088 1.00 0.00 C ATOM 0 H LEU A 936 0.067 4.586 -10.465 1.00 0.00 H new ATOM 0 HA LEU A 936 -2.073 6.111 -11.116 1.00 0.00 H new ATOM 0 HB2 LEU A 936 -1.885 3.302 -10.003 1.00 0.00 H new ATOM 0 HB3 LEU A 936 -3.416 3.979 -10.522 1.00 0.00 H new ATOM 0 HG LEU A 936 -1.037 3.890 -12.377 1.00 0.00 H new ATOM 0 HD11 LEU A 936 -1.917 1.764 -13.260 1.00 0.00 H new ATOM 0 HD12 LEU A 936 -1.392 1.609 -11.567 1.00 0.00 H new ATOM 0 HD13 LEU A 936 -3.125 1.726 -11.954 1.00 0.00 H new ATOM 0 HD21 LEU A 936 -2.797 3.909 -14.103 1.00 0.00 H new ATOM 0 HD22 LEU A 936 -4.039 3.956 -12.830 1.00 0.00 H new ATOM 0 HD23 LEU A 936 -2.914 5.320 -13.026 1.00 0.00 H new ATOM 885 N LEU A 937 -2.070 5.495 -7.889 1.00 0.00 N ATOM 886 CA LEU A 937 -2.668 5.886 -6.617 1.00 0.00 C ATOM 887 C LEU A 937 -2.313 7.328 -6.269 1.00 0.00 C ATOM 888 O LEU A 937 -1.148 7.653 -6.042 1.00 0.00 O ATOM 889 CB LEU A 937 -2.198 4.950 -5.502 1.00 0.00 C ATOM 890 CG LEU A 937 -2.406 3.455 -5.748 1.00 0.00 C ATOM 891 CD1 LEU A 937 -1.502 2.634 -4.842 1.00 0.00 C ATOM 892 CD2 LEU A 937 -3.864 3.077 -5.533 1.00 0.00 C ATOM 0 H LEU A 937 -1.249 4.897 -7.803 1.00 0.00 H new ATOM 0 HA LEU A 937 -3.751 5.811 -6.714 1.00 0.00 H new ATOM 0 HB2 LEU A 937 -1.136 5.125 -5.331 1.00 0.00 H new ATOM 0 HB3 LEU A 937 -2.718 5.222 -4.583 1.00 0.00 H new ATOM 0 HG LEU A 937 -2.143 3.237 -6.783 1.00 0.00 H new ATOM 0 HD11 LEU A 937 -1.664 1.573 -5.031 1.00 0.00 H new ATOM 0 HD12 LEU A 937 -0.460 2.884 -5.044 1.00 0.00 H new ATOM 0 HD13 LEU A 937 -1.733 2.856 -3.800 1.00 0.00 H new ATOM 0 HD21 LEU A 937 -3.993 2.010 -5.712 1.00 0.00 H new ATOM 0 HD22 LEU A 937 -4.153 3.310 -4.508 1.00 0.00 H new ATOM 0 HD23 LEU A 937 -4.491 3.640 -6.224 1.00 0.00 H new ATOM 904 N GLU A 938 -3.326 8.187 -6.227 1.00 0.00 N ATOM 905 CA GLU A 938 -3.121 9.595 -5.905 1.00 0.00 C ATOM 906 C GLU A 938 -2.614 9.757 -4.475 1.00 0.00 C ATOM 907 O GLU A 938 -2.855 8.905 -3.619 1.00 0.00 O ATOM 908 CB GLU A 938 -4.422 10.378 -6.089 1.00 0.00 C ATOM 909 CG GLU A 938 -5.441 10.133 -4.988 1.00 0.00 C ATOM 910 CD GLU A 938 -6.726 10.909 -5.200 1.00 0.00 C ATOM 911 OE1 GLU A 938 -6.647 12.111 -5.531 1.00 0.00 O ATOM 912 OE2 GLU A 938 -7.812 10.315 -5.034 1.00 0.00 O ATOM 0 H GLU A 938 -4.297 7.933 -6.412 1.00 0.00 H new ATOM 0 HA GLU A 938 -2.368 9.992 -6.586 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -4.193 11.443 -6.130 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -4.865 10.110 -7.048 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -5.668 9.068 -4.938 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -5.007 10.411 -4.028 1.00 0.00 H new ATOM 919 N ARG A 939 -1.910 10.856 -4.224 1.00 0.00 N ATOM 920 CA ARG A 939 -1.368 11.130 -2.899 1.00 0.00 C ATOM 921 C ARG A 939 -2.344 10.693 -1.811 1.00 0.00 C ATOM 922 O ARG A 939 -1.952 10.063 -0.829 1.00 0.00 O ATOM 923 CB ARG A 939 -1.055 12.620 -2.750 1.00 0.00 C ATOM 924 CG ARG A 939 -0.110 12.933 -1.602 1.00 0.00 C ATOM 925 CD ARG A 939 -0.075 14.423 -1.299 1.00 0.00 C ATOM 926 NE ARG A 939 -1.332 14.894 -0.725 1.00 0.00 N ATOM 927 CZ ARG A 939 -1.463 16.058 -0.098 1.00 0.00 C ATOM 928 NH1 ARG A 939 -0.419 16.865 0.034 1.00 0.00 N ATOM 929 NH2 ARG A 939 -2.640 16.418 0.398 1.00 0.00 N ATOM 0 H ARG A 939 -1.702 11.571 -4.921 1.00 0.00 H new ATOM 0 HA ARG A 939 -0.446 10.559 -2.787 1.00 0.00 H new ATOM 0 HB2 ARG A 939 -0.617 12.985 -3.679 1.00 0.00 H new ATOM 0 HB3 ARG A 939 -1.987 13.165 -2.601 1.00 0.00 H new ATOM 0 HG2 ARG A 939 -0.423 12.387 -0.712 1.00 0.00 H new ATOM 0 HG3 ARG A 939 0.893 12.588 -1.851 1.00 0.00 H new ATOM 0 HD2 ARG A 939 0.741 14.633 -0.607 1.00 0.00 H new ATOM 0 HD3 ARG A 939 0.134 14.975 -2.216 1.00 0.00 H new ATOM 0 HE ARG A 939 -2.155 14.297 -0.810 1.00 0.00 H new ATOM 0 HH11 ARG A 939 0.487 16.593 -0.346 1.00 0.00 H new ATOM 0 HH12 ARG A 939 -0.522 17.758 0.516 1.00 0.00 H new ATOM 0 HH21 ARG A 939 -3.446 15.801 0.298 1.00 0.00 H new ATOM 0 HH22 ARG A 939 -2.739 17.312 0.879 1.00 0.00 H new ATOM 943 N GLU A 940 -3.616 11.033 -1.993 1.00 0.00 N ATOM 944 CA GLU A 940 -4.648 10.677 -1.025 1.00 0.00 C ATOM 945 C GLU A 940 -4.645 9.175 -0.756 1.00 0.00 C ATOM 946 O GLU A 940 -4.746 8.740 0.391 1.00 0.00 O ATOM 947 CB GLU A 940 -6.025 11.113 -1.531 1.00 0.00 C ATOM 948 CG GLU A 940 -7.087 11.152 -0.445 1.00 0.00 C ATOM 949 CD GLU A 940 -8.277 12.012 -0.824 1.00 0.00 C ATOM 950 OE1 GLU A 940 -9.081 11.573 -1.672 1.00 0.00 O ATOM 951 OE2 GLU A 940 -8.404 13.124 -0.270 1.00 0.00 O ATOM 0 H GLU A 940 -3.957 11.554 -2.801 1.00 0.00 H new ATOM 0 HA GLU A 940 -4.431 11.197 -0.092 1.00 0.00 H new ATOM 0 HB2 GLU A 940 -5.941 12.102 -1.981 1.00 0.00 H new ATOM 0 HB3 GLU A 940 -6.347 10.431 -2.318 1.00 0.00 H new ATOM 0 HG2 GLU A 940 -7.428 10.137 -0.238 1.00 0.00 H new ATOM 0 HG3 GLU A 940 -6.646 11.534 0.476 1.00 0.00 H new ATOM 958 N GLU A 941 -4.529 8.388 -1.821 1.00 0.00 N ATOM 959 CA GLU A 941 -4.514 6.935 -1.699 1.00 0.00 C ATOM 960 C GLU A 941 -3.226 6.458 -1.035 1.00 0.00 C ATOM 961 O GLU A 941 -3.229 5.495 -0.267 1.00 0.00 O ATOM 962 CB GLU A 941 -4.663 6.284 -3.076 1.00 0.00 C ATOM 963 CG GLU A 941 -6.106 6.029 -3.476 1.00 0.00 C ATOM 964 CD GLU A 941 -6.679 4.782 -2.830 1.00 0.00 C ATOM 965 OE1 GLU A 941 -6.233 3.671 -3.185 1.00 0.00 O ATOM 966 OE2 GLU A 941 -7.572 4.919 -1.968 1.00 0.00 O ATOM 0 H GLU A 941 -4.444 8.732 -2.777 1.00 0.00 H new ATOM 0 HA GLU A 941 -5.356 6.640 -1.073 1.00 0.00 H new ATOM 0 HB2 GLU A 941 -4.195 6.925 -3.824 1.00 0.00 H new ATOM 0 HB3 GLU A 941 -4.121 5.339 -3.082 1.00 0.00 H new ATOM 0 HG2 GLU A 941 -6.714 6.890 -3.198 1.00 0.00 H new ATOM 0 HG3 GLU A 941 -6.167 5.933 -4.560 1.00 0.00 H new ATOM 973 N LYS A 942 -2.125 7.137 -1.336 1.00 0.00 N ATOM 974 CA LYS A 942 -0.829 6.785 -0.770 1.00 0.00 C ATOM 975 C LYS A 942 -0.808 7.030 0.736 1.00 0.00 C ATOM 976 O LYS A 942 -0.401 6.164 1.509 1.00 0.00 O ATOM 977 CB LYS A 942 0.283 7.594 -1.444 1.00 0.00 C ATOM 978 CG LYS A 942 0.319 7.436 -2.954 1.00 0.00 C ATOM 979 CD LYS A 942 1.644 7.905 -3.531 1.00 0.00 C ATOM 980 CE LYS A 942 1.764 7.553 -5.006 1.00 0.00 C ATOM 981 NZ LYS A 942 1.197 8.618 -5.879 1.00 0.00 N ATOM 0 H LYS A 942 -2.105 7.936 -1.970 1.00 0.00 H new ATOM 0 HA LYS A 942 -0.659 5.724 -0.951 1.00 0.00 H new ATOM 0 HB2 LYS A 942 0.153 8.648 -1.200 1.00 0.00 H new ATOM 0 HB3 LYS A 942 1.245 7.288 -1.032 1.00 0.00 H new ATOM 0 HG2 LYS A 942 0.157 6.390 -3.216 1.00 0.00 H new ATOM 0 HG3 LYS A 942 -0.496 8.006 -3.400 1.00 0.00 H new ATOM 0 HD2 LYS A 942 1.736 8.984 -3.404 1.00 0.00 H new ATOM 0 HD3 LYS A 942 2.465 7.448 -2.979 1.00 0.00 H new ATOM 0 HE2 LYS A 942 2.813 7.397 -5.258 1.00 0.00 H new ATOM 0 HE3 LYS A 942 1.247 6.613 -5.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 1.584 8.522 -6.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 0.162 8.525 -5.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 1.449 9.552 -5.496 1.00 0.00 H new ATOM 995 N GLU A 943 -1.251 8.215 1.144 1.00 0.00 N ATOM 996 CA GLU A 943 -1.284 8.572 2.558 1.00 0.00 C ATOM 997 C GLU A 943 -2.230 7.656 3.328 1.00 0.00 C ATOM 998 O GLU A 943 -1.829 6.995 4.287 1.00 0.00 O ATOM 999 CB GLU A 943 -1.717 10.030 2.728 1.00 0.00 C ATOM 1000 CG GLU A 943 -1.242 10.657 4.028 1.00 0.00 C ATOM 1001 CD GLU A 943 -1.511 12.148 4.089 1.00 0.00 C ATOM 1002 OE1 GLU A 943 -0.896 12.896 3.300 1.00 0.00 O ATOM 1003 OE2 GLU A 943 -2.338 12.568 4.926 1.00 0.00 O ATOM 0 H GLU A 943 -1.592 8.943 0.517 1.00 0.00 H new ATOM 0 HA GLU A 943 -0.279 8.449 2.961 1.00 0.00 H new ATOM 0 HB2 GLU A 943 -1.334 10.614 1.891 1.00 0.00 H new ATOM 0 HB3 GLU A 943 -2.805 10.085 2.684 1.00 0.00 H new ATOM 0 HG2 GLU A 943 -1.739 10.167 4.866 1.00 0.00 H new ATOM 0 HG3 GLU A 943 -0.173 10.479 4.143 1.00 0.00 H new ATOM 1010 N LYS A 944 -3.488 7.622 2.903 1.00 0.00 N ATOM 1011 CA LYS A 944 -4.493 6.787 3.551 1.00 0.00 C ATOM 1012 C LYS A 944 -4.022 5.339 3.640 1.00 0.00 C ATOM 1013 O LYS A 944 -3.880 4.787 4.732 1.00 0.00 O ATOM 1014 CB LYS A 944 -5.816 6.859 2.786 1.00 0.00 C ATOM 1015 CG LYS A 944 -7.038 6.646 3.662 1.00 0.00 C ATOM 1016 CD LYS A 944 -7.338 5.168 3.852 1.00 0.00 C ATOM 1017 CE LYS A 944 -8.060 4.587 2.646 1.00 0.00 C ATOM 1018 NZ LYS A 944 -8.250 3.115 2.769 1.00 0.00 N ATOM 0 H LYS A 944 -3.837 8.163 2.112 1.00 0.00 H new ATOM 0 HA LYS A 944 -4.645 7.164 4.563 1.00 0.00 H new ATOM 0 HB2 LYS A 944 -5.893 7.832 2.300 1.00 0.00 H new ATOM 0 HB3 LYS A 944 -5.810 6.108 1.996 1.00 0.00 H new ATOM 0 HG2 LYS A 944 -6.876 7.113 4.633 1.00 0.00 H new ATOM 0 HG3 LYS A 944 -7.900 7.138 3.211 1.00 0.00 H new ATOM 0 HD2 LYS A 944 -6.407 4.625 4.017 1.00 0.00 H new ATOM 0 HD3 LYS A 944 -7.949 5.031 4.744 1.00 0.00 H new ATOM 0 HE2 LYS A 944 -9.031 5.070 2.536 1.00 0.00 H new ATOM 0 HE3 LYS A 944 -7.491 4.805 1.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 944 -8.990 2.804 2.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 944 -7.358 2.630 2.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 944 -8.535 2.882 3.742 1.00 0.00 H new ATOM 1032 N LEU A 945 -3.781 4.729 2.485 1.00 0.00 N ATOM 1033 CA LEU A 945 -3.324 3.344 2.432 1.00 0.00 C ATOM 1034 C LEU A 945 -2.242 3.087 3.476 1.00 0.00 C ATOM 1035 O LEU A 945 -2.309 2.115 4.229 1.00 0.00 O ATOM 1036 CB LEU A 945 -2.791 3.015 1.037 1.00 0.00 C ATOM 1037 CG LEU A 945 -3.845 2.793 -0.049 1.00 0.00 C ATOM 1038 CD1 LEU A 945 -3.225 2.931 -1.431 1.00 0.00 C ATOM 1039 CD2 LEU A 945 -4.497 1.428 0.111 1.00 0.00 C ATOM 0 H LEU A 945 -3.894 5.171 1.573 1.00 0.00 H new ATOM 0 HA LEU A 945 -4.175 2.698 2.651 1.00 0.00 H new ATOM 0 HB2 LEU A 945 -2.136 3.826 0.719 1.00 0.00 H new ATOM 0 HB3 LEU A 945 -2.176 2.118 1.107 1.00 0.00 H new ATOM 0 HG LEU A 945 -4.616 3.556 0.059 1.00 0.00 H new ATOM 0 HD11 LEU A 945 -3.990 2.770 -2.191 1.00 0.00 H new ATOM 0 HD12 LEU A 945 -2.807 3.931 -1.544 1.00 0.00 H new ATOM 0 HD13 LEU A 945 -2.434 2.191 -1.550 1.00 0.00 H new ATOM 0 HD21 LEU A 945 -5.244 1.288 -0.670 1.00 0.00 H new ATOM 0 HD22 LEU A 945 -3.737 0.650 0.031 1.00 0.00 H new ATOM 0 HD23 LEU A 945 -4.977 1.366 1.088 1.00 0.00 H new ATOM 1051 N PHE A 946 -1.246 3.966 3.516 1.00 0.00 N ATOM 1052 CA PHE A 946 -0.150 3.836 4.469 1.00 0.00 C ATOM 1053 C PHE A 946 -0.679 3.707 5.894 1.00 0.00 C ATOM 1054 O PHE A 946 -0.364 2.750 6.600 1.00 0.00 O ATOM 1055 CB PHE A 946 0.788 5.041 4.368 1.00 0.00 C ATOM 1056 CG PHE A 946 1.797 5.110 5.478 1.00 0.00 C ATOM 1057 CD1 PHE A 946 2.777 4.138 5.603 1.00 0.00 C ATOM 1058 CD2 PHE A 946 1.766 6.146 6.398 1.00 0.00 C ATOM 1059 CE1 PHE A 946 3.708 4.199 6.623 1.00 0.00 C ATOM 1060 CE2 PHE A 946 2.694 6.212 7.420 1.00 0.00 C ATOM 1061 CZ PHE A 946 3.665 5.236 7.533 1.00 0.00 C ATOM 0 H PHE A 946 -1.175 4.776 2.900 1.00 0.00 H new ATOM 0 HA PHE A 946 0.405 2.931 4.224 1.00 0.00 H new ATOM 0 HB2 PHE A 946 1.312 5.004 3.413 1.00 0.00 H new ATOM 0 HB3 PHE A 946 0.194 5.955 4.370 1.00 0.00 H new ATOM 0 HD1 PHE A 946 2.814 3.323 4.895 1.00 0.00 H new ATOM 0 HD2 PHE A 946 1.008 6.911 6.315 1.00 0.00 H new ATOM 0 HE1 PHE A 946 4.468 3.436 6.708 1.00 0.00 H new ATOM 0 HE2 PHE A 946 2.660 7.026 8.129 1.00 0.00 H new ATOM 0 HZ PHE A 946 4.390 5.284 8.332 1.00 0.00 H new ATOM 1071 N ASN A 947 -1.487 4.678 6.309 1.00 0.00 N ATOM 1072 CA ASN A 947 -2.060 4.674 7.650 1.00 0.00 C ATOM 1073 C ASN A 947 -2.754 3.347 7.941 1.00 0.00 C ATOM 1074 O ASN A 947 -2.550 2.748 8.997 1.00 0.00 O ATOM 1075 CB ASN A 947 -3.054 5.827 7.805 1.00 0.00 C ATOM 1076 CG ASN A 947 -2.415 7.179 7.556 1.00 0.00 C ATOM 1077 OD1 ASN A 947 -1.215 7.273 7.295 1.00 0.00 O ATOM 1078 ND2 ASN A 947 -3.215 8.236 7.636 1.00 0.00 N ATOM 0 H ASN A 947 -1.759 5.477 5.736 1.00 0.00 H new ATOM 0 HA ASN A 947 -1.248 4.804 8.366 1.00 0.00 H new ATOM 0 HB2 ASN A 947 -3.881 5.686 7.110 1.00 0.00 H new ATOM 0 HB3 ASN A 947 -3.475 5.807 8.810 1.00 0.00 H new ATOM 0 HD21 ASN A 947 -2.841 9.172 7.479 1.00 0.00 H new ATOM 0 HD22 ASN A 947 -4.203 8.112 7.855 1.00 0.00 H new ATOM 1085 N GLU A 948 -3.573 2.894 6.998 1.00 0.00 N ATOM 1086 CA GLU A 948 -4.296 1.638 7.154 1.00 0.00 C ATOM 1087 C GLU A 948 -3.349 0.510 7.554 1.00 0.00 C ATOM 1088 O GLU A 948 -3.624 -0.244 8.488 1.00 0.00 O ATOM 1089 CB GLU A 948 -5.019 1.274 5.855 1.00 0.00 C ATOM 1090 CG GLU A 948 -6.061 2.296 5.432 1.00 0.00 C ATOM 1091 CD GLU A 948 -7.351 2.173 6.218 1.00 0.00 C ATOM 1092 OE1 GLU A 948 -8.198 1.336 5.841 1.00 0.00 O ATOM 1093 OE2 GLU A 948 -7.515 2.913 7.211 1.00 0.00 O ATOM 0 H GLU A 948 -3.752 3.378 6.118 1.00 0.00 H new ATOM 0 HA GLU A 948 -5.032 1.770 7.947 1.00 0.00 H new ATOM 0 HB2 GLU A 948 -4.284 1.166 5.058 1.00 0.00 H new ATOM 0 HB3 GLU A 948 -5.502 0.304 5.977 1.00 0.00 H new ATOM 0 HG2 GLU A 948 -5.655 3.299 5.562 1.00 0.00 H new ATOM 0 HG3 GLU A 948 -6.274 2.174 4.370 1.00 0.00 H new ATOM 1100 N HIS A 949 -2.233 0.401 6.841 1.00 0.00 N ATOM 1101 CA HIS A 949 -1.244 -0.634 7.121 1.00 0.00 C ATOM 1102 C HIS A 949 -0.731 -0.521 8.553 1.00 0.00 C ATOM 1103 O HIS A 949 -0.923 -1.427 9.365 1.00 0.00 O ATOM 1104 CB HIS A 949 -0.077 -0.533 6.139 1.00 0.00 C ATOM 1105 CG HIS A 949 1.093 -1.393 6.508 1.00 0.00 C ATOM 1106 ND1 HIS A 949 1.018 -2.767 6.594 1.00 0.00 N ATOM 1107 CD2 HIS A 949 2.370 -1.067 6.813 1.00 0.00 C ATOM 1108 CE1 HIS A 949 2.200 -3.249 6.937 1.00 0.00 C ATOM 1109 NE2 HIS A 949 3.038 -2.237 7.076 1.00 0.00 N ATOM 0 H HIS A 949 -1.991 1.017 6.065 1.00 0.00 H new ATOM 0 HA HIS A 949 -1.726 -1.604 7.002 1.00 0.00 H new ATOM 0 HB2 HIS A 949 -0.424 -0.814 5.145 1.00 0.00 H new ATOM 0 HB3 HIS A 949 0.250 0.505 6.081 1.00 0.00 H new ATOM 0 HD2 HIS A 949 2.787 -0.071 6.844 1.00 0.00 H new ATOM 0 HE1 HIS A 949 2.440 -4.292 7.079 1.00 0.00 H new ATOM 0 HE2 HIS A 949 4.021 -2.313 7.336 1.00 0.00 H new ATOM 1117 N ILE A 950 -0.078 0.596 8.856 1.00 0.00 N ATOM 1118 CA ILE A 950 0.462 0.826 10.191 1.00 0.00 C ATOM 1119 C ILE A 950 -0.471 0.277 11.264 1.00 0.00 C ATOM 1120 O ILE A 950 -0.037 -0.417 12.182 1.00 0.00 O ATOM 1121 CB ILE A 950 0.700 2.325 10.451 1.00 0.00 C ATOM 1122 CG1 ILE A 950 1.540 2.933 9.326 1.00 0.00 C ATOM 1123 CG2 ILE A 950 1.381 2.528 11.796 1.00 0.00 C ATOM 1124 CD1 ILE A 950 2.789 2.140 9.008 1.00 0.00 C ATOM 0 H ILE A 950 0.090 1.355 8.196 1.00 0.00 H new ATOM 0 HA ILE A 950 1.416 0.301 10.240 1.00 0.00 H new ATOM 0 HB ILE A 950 -0.265 2.832 10.474 1.00 0.00 H new ATOM 0 HG12 ILE A 950 0.928 3.008 8.427 1.00 0.00 H new ATOM 0 HG13 ILE A 950 1.825 3.948 9.604 1.00 0.00 H new ATOM 0 HG21 ILE A 950 1.542 3.593 11.965 1.00 0.00 H new ATOM 0 HG22 ILE A 950 0.749 2.126 12.588 1.00 0.00 H new ATOM 0 HG23 ILE A 950 2.340 2.011 11.800 1.00 0.00 H new ATOM 0 HD11 ILE A 950 3.335 2.629 8.202 1.00 0.00 H new ATOM 0 HD12 ILE A 950 3.421 2.086 9.894 1.00 0.00 H new ATOM 0 HD13 ILE A 950 2.511 1.132 8.699 1.00 0.00 H new ATOM 1136 N GLU A 951 -1.757 0.593 11.140 1.00 0.00 N ATOM 1137 CA GLU A 951 -2.752 0.130 12.100 1.00 0.00 C ATOM 1138 C GLU A 951 -2.848 -1.393 12.092 1.00 0.00 C ATOM 1139 O GLU A 951 -2.831 -2.032 13.144 1.00 0.00 O ATOM 1140 CB GLU A 951 -4.120 0.739 11.784 1.00 0.00 C ATOM 1141 CG GLU A 951 -4.213 2.222 12.103 1.00 0.00 C ATOM 1142 CD GLU A 951 -3.793 2.540 13.525 1.00 0.00 C ATOM 1143 OE1 GLU A 951 -4.505 2.122 14.462 1.00 0.00 O ATOM 1144 OE2 GLU A 951 -2.752 3.208 13.701 1.00 0.00 O ATOM 0 H GLU A 951 -2.133 1.167 10.385 1.00 0.00 H new ATOM 0 HA GLU A 951 -2.439 0.452 13.093 1.00 0.00 H new ATOM 0 HB2 GLU A 951 -4.340 0.589 10.727 1.00 0.00 H new ATOM 0 HB3 GLU A 951 -4.885 0.206 12.348 1.00 0.00 H new ATOM 0 HG2 GLU A 951 -3.584 2.779 11.409 1.00 0.00 H new ATOM 0 HG3 GLU A 951 -5.237 2.560 11.946 1.00 0.00 H new ATOM 1151 N ALA A 952 -2.950 -1.968 10.898 1.00 0.00 N ATOM 1152 CA ALA A 952 -3.048 -3.415 10.753 1.00 0.00 C ATOM 1153 C ALA A 952 -1.903 -4.118 11.475 1.00 0.00 C ATOM 1154 O ALA A 952 -2.100 -5.153 12.112 1.00 0.00 O ATOM 1155 CB ALA A 952 -3.059 -3.798 9.280 1.00 0.00 C ATOM 0 H ALA A 952 -2.967 -1.454 10.017 1.00 0.00 H new ATOM 0 HA ALA A 952 -3.984 -3.738 11.209 1.00 0.00 H new ATOM 0 HB1 ALA A 952 -3.133 -4.881 9.186 1.00 0.00 H new ATOM 0 HB2 ALA A 952 -3.914 -3.333 8.789 1.00 0.00 H new ATOM 0 HB3 ALA A 952 -2.138 -3.455 8.808 1.00 0.00 H new ATOM 1161 N LEU A 953 -0.707 -3.549 11.372 1.00 0.00 N ATOM 1162 CA LEU A 953 0.470 -4.122 12.015 1.00 0.00 C ATOM 1163 C LEU A 953 0.250 -4.274 13.517 1.00 0.00 C ATOM 1164 O LEU A 953 0.390 -5.366 14.069 1.00 0.00 O ATOM 1165 CB LEU A 953 1.696 -3.245 11.754 1.00 0.00 C ATOM 1166 CG LEU A 953 2.203 -3.213 10.312 1.00 0.00 C ATOM 1167 CD1 LEU A 953 3.366 -2.242 10.176 1.00 0.00 C ATOM 1168 CD2 LEU A 953 2.614 -4.606 9.860 1.00 0.00 C ATOM 0 H LEU A 953 -0.527 -2.692 10.850 1.00 0.00 H new ATOM 0 HA LEU A 953 0.641 -5.111 11.589 1.00 0.00 H new ATOM 0 HB2 LEU A 953 1.460 -2.225 12.058 1.00 0.00 H new ATOM 0 HB3 LEU A 953 2.507 -3.589 12.396 1.00 0.00 H new ATOM 0 HG LEU A 953 1.392 -2.869 9.670 1.00 0.00 H new ATOM 0 HD11 LEU A 953 3.713 -2.233 9.143 1.00 0.00 H new ATOM 0 HD12 LEU A 953 3.039 -1.241 10.458 1.00 0.00 H new ATOM 0 HD13 LEU A 953 4.180 -2.555 10.830 1.00 0.00 H new ATOM 0 HD21 LEU A 953 2.972 -4.564 8.831 1.00 0.00 H new ATOM 0 HD22 LEU A 953 3.409 -4.978 10.506 1.00 0.00 H new ATOM 0 HD23 LEU A 953 1.756 -5.275 9.918 1.00 0.00 H new ATOM 1180 N THR A 954 -0.097 -3.172 14.174 1.00 0.00 N ATOM 1181 CA THR A 954 -0.338 -3.182 15.611 1.00 0.00 C ATOM 1182 C THR A 954 -1.549 -4.040 15.959 1.00 0.00 C ATOM 1183 O THR A 954 -1.433 -5.034 16.677 1.00 0.00 O ATOM 1184 CB THR A 954 -0.558 -1.758 16.154 1.00 0.00 C ATOM 1185 OG1 THR A 954 -1.642 -1.131 15.459 1.00 0.00 O ATOM 1186 CG2 THR A 954 0.702 -0.919 16.001 1.00 0.00 C ATOM 0 H THR A 954 -0.217 -2.260 13.733 1.00 0.00 H new ATOM 0 HA THR A 954 0.551 -3.607 16.078 1.00 0.00 H new ATOM 0 HB THR A 954 -0.800 -1.831 17.214 1.00 0.00 H new ATOM 0 HG1 THR A 954 -1.777 -0.226 15.811 1.00 0.00 H new ATOM 0 HG21 THR A 954 0.522 0.083 16.392 1.00 0.00 H new ATOM 0 HG22 THR A 954 1.518 -1.383 16.555 1.00 0.00 H new ATOM 0 HG23 THR A 954 0.970 -0.854 14.947 1.00 0.00 H new ATOM 1194 N LYS A 955 -2.711 -3.650 15.446 1.00 0.00 N ATOM 1195 CA LYS A 955 -3.945 -4.385 15.701 1.00 0.00 C ATOM 1196 C LYS A 955 -3.694 -5.889 15.697 1.00 0.00 C ATOM 1197 O LYS A 955 -4.178 -6.612 16.568 1.00 0.00 O ATOM 1198 CB LYS A 955 -5.000 -4.030 14.651 1.00 0.00 C ATOM 1199 CG LYS A 955 -6.426 -4.125 15.165 1.00 0.00 C ATOM 1200 CD LYS A 955 -7.434 -4.046 14.030 1.00 0.00 C ATOM 1201 CE LYS A 955 -7.622 -2.614 13.551 1.00 0.00 C ATOM 1202 NZ LYS A 955 -8.638 -1.887 14.361 1.00 0.00 N ATOM 0 H LYS A 955 -2.824 -2.829 14.851 1.00 0.00 H new ATOM 0 HA LYS A 955 -4.312 -4.099 16.687 1.00 0.00 H new ATOM 0 HB2 LYS A 955 -4.818 -3.016 14.294 1.00 0.00 H new ATOM 0 HB3 LYS A 955 -4.886 -4.695 13.795 1.00 0.00 H new ATOM 0 HG2 LYS A 955 -6.557 -5.063 15.705 1.00 0.00 H new ATOM 0 HG3 LYS A 955 -6.612 -3.319 15.875 1.00 0.00 H new ATOM 0 HD2 LYS A 955 -7.098 -4.668 13.200 1.00 0.00 H new ATOM 0 HD3 LYS A 955 -8.391 -4.448 14.363 1.00 0.00 H new ATOM 0 HE2 LYS A 955 -6.670 -2.086 13.603 1.00 0.00 H new ATOM 0 HE3 LYS A 955 -7.927 -2.618 12.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 955 -8.737 -0.916 14.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 955 -9.553 -2.377 14.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 955 -8.335 -1.860 15.355 1.00 0.00 H new ATOM 1216 N LYS A 956 -2.932 -6.354 14.713 1.00 0.00 N ATOM 1217 CA LYS A 956 -2.614 -7.772 14.596 1.00 0.00 C ATOM 1218 C LYS A 956 -1.640 -8.203 15.689 1.00 0.00 C ATOM 1219 O LYS A 956 -1.927 -9.114 16.466 1.00 0.00 O ATOM 1220 CB LYS A 956 -2.016 -8.071 13.219 1.00 0.00 C ATOM 1221 CG LYS A 956 -1.825 -9.553 12.947 1.00 0.00 C ATOM 1222 CD LYS A 956 -3.157 -10.273 12.822 1.00 0.00 C ATOM 1223 CE LYS A 956 -2.982 -11.677 12.264 1.00 0.00 C ATOM 1224 NZ LYS A 956 -2.759 -12.679 13.343 1.00 0.00 N ATOM 0 H LYS A 956 -2.523 -5.769 13.984 1.00 0.00 H new ATOM 0 HA LYS A 956 -3.539 -8.337 14.714 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -2.665 -7.650 12.451 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -1.053 -7.567 13.133 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -1.252 -9.684 12.029 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -1.243 -10.000 13.753 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -3.636 -10.326 13.800 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -3.821 -9.702 12.172 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -3.867 -11.952 11.690 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -2.138 -11.691 11.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -2.644 -13.623 12.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -1.901 -12.431 13.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -3.576 -12.684 13.986 1.00 0.00 H new ATOM 1238 N LYS A 957 -0.490 -7.541 15.744 1.00 0.00 N ATOM 1239 CA LYS A 957 0.525 -7.853 16.743 1.00 0.00 C ATOM 1240 C LYS A 957 -0.115 -8.153 18.095 1.00 0.00 C ATOM 1241 O LYS A 957 -1.177 -7.622 18.421 1.00 0.00 O ATOM 1242 CB LYS A 957 1.509 -6.689 16.881 1.00 0.00 C ATOM 1243 CG LYS A 957 2.579 -6.665 15.803 1.00 0.00 C ATOM 1244 CD LYS A 957 3.431 -5.411 15.890 1.00 0.00 C ATOM 1245 CE LYS A 957 4.620 -5.608 16.818 1.00 0.00 C ATOM 1246 NZ LYS A 957 4.225 -5.519 18.251 1.00 0.00 N ATOM 0 H LYS A 957 -0.237 -6.785 15.108 1.00 0.00 H new ATOM 0 HA LYS A 957 1.064 -8.740 16.411 1.00 0.00 H new ATOM 0 HB2 LYS A 957 0.955 -5.751 16.852 1.00 0.00 H new ATOM 0 HB3 LYS A 957 1.990 -6.745 17.857 1.00 0.00 H new ATOM 0 HG2 LYS A 957 3.215 -7.545 15.901 1.00 0.00 H new ATOM 0 HG3 LYS A 957 2.109 -6.719 14.821 1.00 0.00 H new ATOM 0 HD2 LYS A 957 3.785 -5.141 14.895 1.00 0.00 H new ATOM 0 HD3 LYS A 957 2.822 -4.581 16.248 1.00 0.00 H new ATOM 0 HE2 LYS A 957 5.074 -6.580 16.626 1.00 0.00 H new ATOM 0 HE3 LYS A 957 5.378 -4.855 16.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 957 5.012 -5.123 18.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 957 3.392 -4.904 18.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 957 3.995 -6.469 18.607 1.00 0.00 H new ATOM 1260 N ARG A 958 0.537 -9.007 18.877 1.00 0.00 N ATOM 1261 CA ARG A 958 0.031 -9.377 20.193 1.00 0.00 C ATOM 1262 C ARG A 958 -0.601 -8.176 20.890 1.00 0.00 C ATOM 1263 O ARG A 958 0.079 -7.199 21.202 1.00 0.00 O ATOM 1264 CB ARG A 958 1.159 -9.945 21.056 1.00 0.00 C ATOM 1265 CG ARG A 958 1.399 -11.431 20.842 1.00 0.00 C ATOM 1266 CD ARG A 958 1.973 -11.710 19.462 1.00 0.00 C ATOM 1267 NE ARG A 958 0.996 -11.471 18.404 1.00 0.00 N ATOM 1268 CZ ARG A 958 1.288 -11.519 17.109 1.00 0.00 C ATOM 1269 NH1 ARG A 958 2.523 -11.797 16.715 1.00 0.00 N ATOM 1270 NH2 ARG A 958 0.343 -11.290 16.206 1.00 0.00 N ATOM 0 H ARG A 958 1.417 -9.456 18.622 1.00 0.00 H new ATOM 0 HA ARG A 958 -0.734 -10.141 20.058 1.00 0.00 H new ATOM 0 HB2 ARG A 958 2.079 -9.402 20.840 1.00 0.00 H new ATOM 0 HB3 ARG A 958 0.925 -9.771 22.106 1.00 0.00 H new ATOM 0 HG2 ARG A 958 2.084 -11.803 21.604 1.00 0.00 H new ATOM 0 HG3 ARG A 958 0.461 -11.973 20.964 1.00 0.00 H new ATOM 0 HD2 ARG A 958 2.846 -11.079 19.298 1.00 0.00 H new ATOM 0 HD3 ARG A 958 2.314 -12.744 19.414 1.00 0.00 H new ATOM 0 HE ARG A 958 0.036 -11.255 18.674 1.00 0.00 H new ATOM 0 HH11 ARG A 958 3.251 -11.975 17.407 1.00 0.00 H new ATOM 0 HH12 ARG A 958 2.745 -11.833 15.720 1.00 0.00 H new ATOM 0 HH21 ARG A 958 -0.608 -11.077 16.506 1.00 0.00 H new ATOM 0 HH22 ARG A 958 0.568 -11.327 15.212 1.00 0.00 H new ATOM 1284 N GLU A 959 -1.906 -8.256 21.130 1.00 0.00 N ATOM 1285 CA GLU A 959 -2.629 -7.174 21.789 1.00 0.00 C ATOM 1286 C GLU A 959 -3.651 -7.727 22.779 1.00 0.00 C ATOM 1287 O GLU A 959 -4.047 -8.889 22.695 1.00 0.00 O ATOM 1288 CB GLU A 959 -3.331 -6.295 20.752 1.00 0.00 C ATOM 1289 CG GLU A 959 -3.770 -4.945 21.296 1.00 0.00 C ATOM 1290 CD GLU A 959 -4.304 -4.026 20.215 1.00 0.00 C ATOM 1291 OE1 GLU A 959 -5.053 -4.510 19.340 1.00 0.00 O ATOM 1292 OE2 GLU A 959 -3.972 -2.822 20.243 1.00 0.00 O ATOM 0 H GLU A 959 -2.484 -9.058 20.878 1.00 0.00 H new ATOM 0 HA GLU A 959 -1.907 -6.570 22.338 1.00 0.00 H new ATOM 0 HB2 GLU A 959 -2.660 -6.136 19.908 1.00 0.00 H new ATOM 0 HB3 GLU A 959 -4.204 -6.825 20.370 1.00 0.00 H new ATOM 0 HG2 GLU A 959 -4.540 -5.095 22.053 1.00 0.00 H new ATOM 0 HG3 GLU A 959 -2.926 -4.465 21.791 1.00 0.00 H new ATOM 1299 N SER A 960 -4.073 -6.884 23.716 1.00 0.00 N ATOM 1300 CA SER A 960 -5.045 -7.288 24.725 1.00 0.00 C ATOM 1301 C SER A 960 -6.384 -7.636 24.081 1.00 0.00 C ATOM 1302 O SER A 960 -7.275 -6.794 23.981 1.00 0.00 O ATOM 1303 CB SER A 960 -5.237 -6.173 25.755 1.00 0.00 C ATOM 1304 OG SER A 960 -5.955 -6.639 26.884 1.00 0.00 O ATOM 0 H SER A 960 -3.757 -5.918 23.797 1.00 0.00 H new ATOM 0 HA SER A 960 -4.661 -8.176 25.228 1.00 0.00 H new ATOM 0 HB2 SER A 960 -4.265 -5.793 26.070 1.00 0.00 H new ATOM 0 HB3 SER A 960 -5.772 -5.340 25.298 1.00 0.00 H new ATOM 0 HG SER A 960 -6.063 -5.908 27.528 1.00 0.00 H new ATOM 1310 N GLY A 961 -6.517 -8.885 23.645 1.00 0.00 N ATOM 1311 CA GLY A 961 -7.749 -9.324 23.016 1.00 0.00 C ATOM 1312 C GLY A 961 -7.505 -10.063 21.715 1.00 0.00 C ATOM 1313 O GLY A 961 -7.644 -9.508 20.625 1.00 0.00 O ATOM 0 H GLY A 961 -5.794 -9.601 23.716 1.00 0.00 H new ATOM 0 HA2 GLY A 961 -8.292 -9.973 23.703 1.00 0.00 H new ATOM 0 HA3 GLY A 961 -8.384 -8.459 22.825 1.00 0.00 H new ATOM 1317 N PRO A 962 -7.129 -11.346 21.821 1.00 0.00 N ATOM 1318 CA PRO A 962 -6.855 -12.190 20.654 1.00 0.00 C ATOM 1319 C PRO A 962 -8.120 -12.523 19.870 1.00 0.00 C ATOM 1320 O PRO A 962 -9.230 -12.416 20.391 1.00 0.00 O ATOM 1321 CB PRO A 962 -6.255 -13.458 21.266 1.00 0.00 C ATOM 1322 CG PRO A 962 -6.800 -13.505 22.652 1.00 0.00 C ATOM 1323 CD PRO A 962 -6.942 -12.073 23.088 1.00 0.00 C ATOM 0 HA PRO A 962 -6.199 -11.695 19.938 1.00 0.00 H new ATOM 0 HB2 PRO A 962 -6.539 -14.344 20.699 1.00 0.00 H new ATOM 0 HB3 PRO A 962 -5.166 -13.418 21.270 1.00 0.00 H new ATOM 0 HG2 PRO A 962 -7.762 -14.018 22.676 1.00 0.00 H new ATOM 0 HG3 PRO A 962 -6.131 -14.051 23.317 1.00 0.00 H new ATOM 0 HD2 PRO A 962 -7.792 -11.939 23.757 1.00 0.00 H new ATOM 0 HD3 PRO A 962 -6.058 -11.727 23.623 1.00 0.00 H new ATOM 1331 N SER A 963 -7.944 -12.928 18.616 1.00 0.00 N ATOM 1332 CA SER A 963 -9.072 -13.273 17.759 1.00 0.00 C ATOM 1333 C SER A 963 -9.182 -14.786 17.590 1.00 0.00 C ATOM 1334 O SER A 963 -10.161 -15.400 18.016 1.00 0.00 O ATOM 1335 CB SER A 963 -8.924 -12.605 16.391 1.00 0.00 C ATOM 1336 OG SER A 963 -7.702 -12.971 15.775 1.00 0.00 O ATOM 0 H SER A 963 -7.031 -13.025 18.171 1.00 0.00 H new ATOM 0 HA SER A 963 -9.983 -12.910 18.235 1.00 0.00 H new ATOM 0 HB2 SER A 963 -9.758 -12.892 15.751 1.00 0.00 H new ATOM 0 HB3 SER A 963 -8.967 -11.522 16.505 1.00 0.00 H new ATOM 0 HG SER A 963 -7.632 -12.533 14.901 1.00 0.00 H new ATOM 1342 N SER A 964 -8.170 -15.380 16.965 1.00 0.00 N ATOM 1343 CA SER A 964 -8.154 -16.820 16.736 1.00 0.00 C ATOM 1344 C SER A 964 -6.723 -17.350 16.711 1.00 0.00 C ATOM 1345 O SER A 964 -5.764 -16.581 16.760 1.00 0.00 O ATOM 1346 CB SER A 964 -8.857 -17.156 15.419 1.00 0.00 C ATOM 1347 OG SER A 964 -10.219 -16.766 15.455 1.00 0.00 O ATOM 0 H SER A 964 -7.351 -14.887 16.609 1.00 0.00 H new ATOM 0 HA SER A 964 -8.687 -17.300 17.557 1.00 0.00 H new ATOM 0 HB2 SER A 964 -8.353 -16.652 14.595 1.00 0.00 H new ATOM 0 HB3 SER A 964 -8.787 -18.227 15.228 1.00 0.00 H new ATOM 0 HG SER A 964 -10.646 -16.990 14.602 1.00 0.00 H new ATOM 1353 N GLY A 965 -6.589 -18.670 16.634 1.00 0.00 N ATOM 1354 CA GLY A 965 -5.273 -19.282 16.604 1.00 0.00 C ATOM 1355 C GLY A 965 -5.139 -20.314 15.502 1.00 0.00 C ATOM 1356 O GLY A 965 -4.125 -21.006 15.411 1.00 0.00 O ATOM 0 H GLY A 965 -7.368 -19.327 16.592 1.00 0.00 H new ATOM 0 HA2 GLY A 965 -4.519 -18.508 16.466 1.00 0.00 H new ATOM 0 HA3 GLY A 965 -5.073 -19.754 17.566 1.00 0.00 H new TER 1360 GLY A 965