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 894 HIS : no HE2:sc= -0.11 K(o=0.38,f=-4.2) USER MOD Set 1.2: A 895 LYS NZ :NH3+ -112:sc= 0.491 (180deg=-0.167) USER MOD Single : A 882 SER OG : rot 4:sc= 0.477 USER MOD Single : A 883 SER OG : rot 180:sc= 0 USER MOD Single : A 885 SER OG : rot -158:sc= 0.00241 USER MOD Single : A 886 SER OG : rot 180:sc= 0 USER MOD Single : A 893 GLN : amide:sc= -0.336 K(o=-0.34,f=-3.5!) USER MOD Single : A 901 GLN :FLIP amide:sc= -0.406 F(o=-1,f=-0.41) USER MOD Single : A 902 ASN : amide:sc= -0.0995 K(o=-0.1,f=-2.2!) 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 147:sc= -0.0689 (180deg=-1.32) USER MOD Single : A 913 SER OG : rot 180:sc= 0 USER MOD Single : A 914 SER OG : rot 180: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 131:sc= 1.01 USER MOD Single : A 924 THR OG1 : rot 99:sc= 1.14 USER MOD Single : A 927 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 929 HIS : no HD1:sc= 0 X(o=0,f=-0.0019) USER MOD Single : A 933 SER OG : rot -6:sc= 0.808 USER MOD Single : A 935 SER OG : rot 180:sc= 0 USER MOD Single : A 942 LYS NZ :NH3+ -125:sc= -1.76 (180deg=-2.1) USER MOD Single : A 944 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 947 ASN : amide:sc= 0.266 X(o=0.27,f=-0.00095) USER MOD Single : A 949 HIS : no HD1:sc= -3.89! C(o=-3.9!,f=-9.7!) USER MOD Single : A 954 THR OG1 : rot 180:sc= -0.118 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 960 SER OG : rot 180:sc= 0 USER MOD Single : A 963 SER OG : rot 180:sc= 0 USER MOD Single : A 964 SER OG : rot -17:sc= 0.436 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 881 -21.361 -26.921 -15.781 1.00 0.00 N ATOM 2 CA GLY A 881 -22.187 -26.580 -16.924 1.00 0.00 C ATOM 3 C GLY A 881 -21.413 -25.848 -18.002 1.00 0.00 C ATOM 4 O GLY A 881 -20.965 -26.455 -18.975 1.00 0.00 O ATOM 0 HA2 GLY A 881 -22.615 -27.491 -17.343 1.00 0.00 H new ATOM 0 HA3 GLY A 881 -23.020 -25.959 -16.594 1.00 0.00 H new ATOM 8 N SER A 882 -21.255 -24.540 -17.831 1.00 0.00 N ATOM 9 CA SER A 882 -20.534 -23.723 -18.800 1.00 0.00 C ATOM 10 C SER A 882 -19.975 -22.465 -18.142 1.00 0.00 C ATOM 11 O SER A 882 -20.721 -21.657 -17.588 1.00 0.00 O ATOM 12 CB SER A 882 -21.454 -23.339 -19.960 1.00 0.00 C ATOM 13 OG SER A 882 -21.825 -24.479 -20.716 1.00 0.00 O ATOM 0 H SER A 882 -21.617 -24.023 -17.030 1.00 0.00 H new ATOM 0 HA SER A 882 -19.701 -24.311 -19.185 1.00 0.00 H new ATOM 0 HB2 SER A 882 -22.347 -22.849 -19.573 1.00 0.00 H new ATOM 0 HB3 SER A 882 -20.950 -22.619 -20.605 1.00 0.00 H new ATOM 0 HG SER A 882 -21.455 -25.284 -20.297 1.00 0.00 H new ATOM 19 N SER A 883 -18.657 -22.307 -18.206 1.00 0.00 N ATOM 20 CA SER A 883 -17.996 -21.150 -17.613 1.00 0.00 C ATOM 21 C SER A 883 -16.790 -20.728 -18.447 1.00 0.00 C ATOM 22 O SER A 883 -15.855 -21.503 -18.645 1.00 0.00 O ATOM 23 CB SER A 883 -17.556 -21.466 -16.182 1.00 0.00 C ATOM 24 OG SER A 883 -16.832 -20.384 -15.621 1.00 0.00 O ATOM 0 H SER A 883 -18.026 -22.965 -18.662 1.00 0.00 H new ATOM 0 HA SER A 883 -18.708 -20.325 -17.593 1.00 0.00 H new ATOM 0 HB2 SER A 883 -18.431 -21.680 -15.568 1.00 0.00 H new ATOM 0 HB3 SER A 883 -16.937 -22.363 -16.178 1.00 0.00 H new ATOM 0 HG SER A 883 -16.563 -20.610 -14.706 1.00 0.00 H new ATOM 30 N GLY A 884 -16.819 -19.490 -18.934 1.00 0.00 N ATOM 31 CA GLY A 884 -15.724 -18.985 -19.740 1.00 0.00 C ATOM 32 C GLY A 884 -15.891 -17.519 -20.091 1.00 0.00 C ATOM 33 O GLY A 884 -16.946 -17.104 -20.569 1.00 0.00 O ATOM 0 H GLY A 884 -17.581 -18.829 -18.784 1.00 0.00 H new ATOM 0 HA2 GLY A 884 -14.787 -19.122 -19.201 1.00 0.00 H new ATOM 0 HA3 GLY A 884 -15.652 -19.569 -20.657 1.00 0.00 H new ATOM 37 N SER A 885 -14.846 -16.733 -19.851 1.00 0.00 N ATOM 38 CA SER A 885 -14.884 -15.304 -20.139 1.00 0.00 C ATOM 39 C SER A 885 -14.145 -14.992 -21.437 1.00 0.00 C ATOM 40 O SER A 885 -13.373 -15.810 -21.937 1.00 0.00 O ATOM 41 CB SER A 885 -14.265 -14.513 -18.984 1.00 0.00 C ATOM 42 OG SER A 885 -15.136 -14.475 -17.867 1.00 0.00 O ATOM 0 H SER A 885 -13.964 -17.061 -19.458 1.00 0.00 H new ATOM 0 HA SER A 885 -15.927 -15.009 -20.255 1.00 0.00 H new ATOM 0 HB2 SER A 885 -13.317 -14.967 -18.695 1.00 0.00 H new ATOM 0 HB3 SER A 885 -14.045 -13.497 -19.312 1.00 0.00 H new ATOM 0 HG SER A 885 -14.909 -13.708 -17.301 1.00 0.00 H new ATOM 48 N SER A 886 -14.389 -13.803 -21.978 1.00 0.00 N ATOM 49 CA SER A 886 -13.751 -13.383 -23.220 1.00 0.00 C ATOM 50 C SER A 886 -13.240 -11.949 -23.111 1.00 0.00 C ATOM 51 O SER A 886 -13.778 -11.142 -22.354 1.00 0.00 O ATOM 52 CB SER A 886 -14.734 -13.498 -24.387 1.00 0.00 C ATOM 53 OG SER A 886 -14.100 -13.199 -25.619 1.00 0.00 O ATOM 0 H SER A 886 -15.024 -13.113 -21.576 1.00 0.00 H new ATOM 0 HA SER A 886 -12.901 -14.040 -23.403 1.00 0.00 H new ATOM 0 HB2 SER A 886 -15.146 -14.507 -24.422 1.00 0.00 H new ATOM 0 HB3 SER A 886 -15.571 -12.817 -24.230 1.00 0.00 H new ATOM 0 HG SER A 886 -14.749 -13.281 -26.349 1.00 0.00 H new ATOM 59 N GLY A 887 -12.196 -11.640 -23.873 1.00 0.00 N ATOM 60 CA GLY A 887 -11.628 -10.305 -23.848 1.00 0.00 C ATOM 61 C GLY A 887 -11.450 -9.777 -22.438 1.00 0.00 C ATOM 62 O GLY A 887 -11.129 -10.533 -21.521 1.00 0.00 O ATOM 0 H GLY A 887 -11.733 -12.291 -24.508 1.00 0.00 H new ATOM 0 HA2 GLY A 887 -10.662 -10.315 -24.354 1.00 0.00 H new ATOM 0 HA3 GLY A 887 -12.274 -9.628 -24.407 1.00 0.00 H new ATOM 66 N ASP A 888 -11.657 -8.477 -22.265 1.00 0.00 N ATOM 67 CA ASP A 888 -11.517 -7.848 -20.956 1.00 0.00 C ATOM 68 C ASP A 888 -12.865 -7.350 -20.446 1.00 0.00 C ATOM 69 O ASP A 888 -12.962 -6.261 -19.880 1.00 0.00 O ATOM 70 CB ASP A 888 -10.524 -6.687 -21.029 1.00 0.00 C ATOM 71 CG ASP A 888 -9.127 -7.142 -21.402 1.00 0.00 C ATOM 72 OD1 ASP A 888 -8.945 -7.629 -22.538 1.00 0.00 O ATOM 73 OD2 ASP A 888 -8.215 -7.009 -20.559 1.00 0.00 O ATOM 0 H ASP A 888 -11.922 -7.838 -23.014 1.00 0.00 H new ATOM 0 HA ASP A 888 -11.139 -8.596 -20.259 1.00 0.00 H new ATOM 0 HB2 ASP A 888 -10.874 -5.959 -21.761 1.00 0.00 H new ATOM 0 HB3 ASP A 888 -10.492 -6.179 -20.065 1.00 0.00 H new ATOM 78 N ARG A 889 -13.903 -8.154 -20.650 1.00 0.00 N ATOM 79 CA ARG A 889 -15.246 -7.794 -20.212 1.00 0.00 C ATOM 80 C ARG A 889 -15.285 -7.570 -18.704 1.00 0.00 C ATOM 81 O ARG A 889 -15.635 -6.487 -18.236 1.00 0.00 O ATOM 82 CB ARG A 889 -16.243 -8.887 -20.602 1.00 0.00 C ATOM 83 CG ARG A 889 -17.624 -8.696 -19.996 1.00 0.00 C ATOM 84 CD ARG A 889 -18.467 -7.739 -20.823 1.00 0.00 C ATOM 85 NE ARG A 889 -19.081 -8.401 -21.972 1.00 0.00 N ATOM 86 CZ ARG A 889 -19.946 -7.808 -22.787 1.00 0.00 C ATOM 87 NH1 ARG A 889 -20.297 -6.546 -22.581 1.00 0.00 N ATOM 88 NH2 ARG A 889 -20.461 -8.477 -23.810 1.00 0.00 N ATOM 0 H ARG A 889 -13.840 -9.059 -21.116 1.00 0.00 H new ATOM 0 HA ARG A 889 -15.525 -6.864 -20.707 1.00 0.00 H new ATOM 0 HB2 ARG A 889 -16.333 -8.915 -21.688 1.00 0.00 H new ATOM 0 HB3 ARG A 889 -15.849 -9.854 -20.290 1.00 0.00 H new ATOM 0 HG2 ARG A 889 -18.128 -9.660 -19.926 1.00 0.00 H new ATOM 0 HG3 ARG A 889 -17.527 -8.313 -18.980 1.00 0.00 H new ATOM 0 HD2 ARG A 889 -19.246 -7.307 -20.195 1.00 0.00 H new ATOM 0 HD3 ARG A 889 -17.844 -6.915 -21.170 1.00 0.00 H new ATOM 0 HE ARG A 889 -18.831 -9.372 -22.158 1.00 0.00 H new ATOM 0 HH11 ARG A 889 -19.903 -6.029 -21.795 1.00 0.00 H new ATOM 0 HH12 ARG A 889 -20.961 -6.093 -23.208 1.00 0.00 H new ATOM 0 HH21 ARG A 889 -20.193 -9.448 -23.971 1.00 0.00 H new ATOM 0 HH22 ARG A 889 -21.125 -8.021 -24.435 1.00 0.00 H new ATOM 102 N GLU A 890 -14.923 -8.602 -17.948 1.00 0.00 N ATOM 103 CA GLU A 890 -14.918 -8.518 -16.492 1.00 0.00 C ATOM 104 C GLU A 890 -13.950 -7.439 -16.013 1.00 0.00 C ATOM 105 O GLU A 890 -14.357 -6.458 -15.390 1.00 0.00 O ATOM 106 CB GLU A 890 -14.536 -9.868 -15.882 1.00 0.00 C ATOM 107 CG GLU A 890 -15.711 -10.819 -15.725 1.00 0.00 C ATOM 108 CD GLU A 890 -15.336 -12.093 -14.994 1.00 0.00 C ATOM 109 OE1 GLU A 890 -14.404 -12.048 -14.163 1.00 0.00 O ATOM 110 OE2 GLU A 890 -15.974 -13.135 -15.252 1.00 0.00 O ATOM 0 H GLU A 890 -14.630 -9.505 -18.319 1.00 0.00 H new ATOM 0 HA GLU A 890 -15.923 -8.252 -16.166 1.00 0.00 H new ATOM 0 HB2 GLU A 890 -13.779 -10.339 -16.509 1.00 0.00 H new ATOM 0 HB3 GLU A 890 -14.082 -9.701 -14.905 1.00 0.00 H new ATOM 0 HG2 GLU A 890 -16.511 -10.315 -15.183 1.00 0.00 H new ATOM 0 HG3 GLU A 890 -16.103 -11.072 -16.710 1.00 0.00 H new ATOM 117 N ARG A 891 -12.669 -7.629 -16.309 1.00 0.00 N ATOM 118 CA ARG A 891 -11.643 -6.674 -15.907 1.00 0.00 C ATOM 119 C ARG A 891 -11.904 -5.303 -16.524 1.00 0.00 C ATOM 120 O ARG A 891 -11.481 -5.026 -17.646 1.00 0.00 O ATOM 121 CB ARG A 891 -10.258 -7.176 -16.322 1.00 0.00 C ATOM 122 CG ARG A 891 -9.881 -8.508 -15.696 1.00 0.00 C ATOM 123 CD ARG A 891 -9.314 -8.325 -14.297 1.00 0.00 C ATOM 124 NE ARG A 891 -10.366 -8.183 -13.295 1.00 0.00 N ATOM 125 CZ ARG A 891 -10.176 -7.627 -12.103 1.00 0.00 C ATOM 126 NH1 ARG A 891 -8.980 -7.163 -11.768 1.00 0.00 N ATOM 127 NH2 ARG A 891 -11.183 -7.533 -11.245 1.00 0.00 N ATOM 0 H ARG A 891 -12.317 -8.435 -16.825 1.00 0.00 H new ATOM 0 HA ARG A 891 -11.678 -6.578 -14.822 1.00 0.00 H new ATOM 0 HB2 ARG A 891 -10.226 -7.272 -17.407 1.00 0.00 H new ATOM 0 HB3 ARG A 891 -9.513 -6.430 -16.046 1.00 0.00 H new ATOM 0 HG2 ARG A 891 -10.759 -9.152 -15.653 1.00 0.00 H new ATOM 0 HG3 ARG A 891 -9.147 -9.012 -16.324 1.00 0.00 H new ATOM 0 HD2 ARG A 891 -8.687 -9.180 -14.045 1.00 0.00 H new ATOM 0 HD3 ARG A 891 -8.674 -7.443 -14.278 1.00 0.00 H new ATOM 0 HE ARG A 891 -11.298 -8.530 -13.522 1.00 0.00 H new ATOM 0 HH11 ARG A 891 -8.203 -7.232 -12.426 1.00 0.00 H new ATOM 0 HH12 ARG A 891 -8.836 -6.737 -10.853 1.00 0.00 H new ATOM 0 HH21 ARG A 891 -12.105 -7.888 -11.500 1.00 0.00 H new ATOM 0 HH22 ARG A 891 -11.036 -7.106 -10.330 1.00 0.00 H new ATOM 141 N GLU A 892 -12.605 -4.450 -15.783 1.00 0.00 N ATOM 142 CA GLU A 892 -12.924 -3.109 -16.259 1.00 0.00 C ATOM 143 C GLU A 892 -11.949 -2.083 -15.689 1.00 0.00 C ATOM 144 O GLU A 892 -11.382 -1.276 -16.425 1.00 0.00 O ATOM 145 CB GLU A 892 -14.357 -2.735 -15.874 1.00 0.00 C ATOM 146 CG GLU A 892 -14.698 -1.279 -16.141 1.00 0.00 C ATOM 147 CD GLU A 892 -16.189 -1.007 -16.076 1.00 0.00 C ATOM 148 OE1 GLU A 892 -16.932 -1.584 -16.897 1.00 0.00 O ATOM 149 OE2 GLU A 892 -16.611 -0.219 -15.205 1.00 0.00 O ATOM 0 H GLU A 892 -12.962 -4.664 -14.852 1.00 0.00 H new ATOM 0 HA GLU A 892 -12.834 -3.106 -17.345 1.00 0.00 H new ATOM 0 HB2 GLU A 892 -15.050 -3.369 -16.427 1.00 0.00 H new ATOM 0 HB3 GLU A 892 -14.507 -2.946 -14.815 1.00 0.00 H new ATOM 0 HG2 GLU A 892 -14.186 -0.650 -15.413 1.00 0.00 H new ATOM 0 HG3 GLU A 892 -14.324 -0.997 -17.125 1.00 0.00 H new ATOM 156 N GLN A 893 -11.759 -2.123 -14.374 1.00 0.00 N ATOM 157 CA GLN A 893 -10.853 -1.196 -13.706 1.00 0.00 C ATOM 158 C GLN A 893 -9.671 -1.938 -13.091 1.00 0.00 C ATOM 159 O GLN A 893 -9.276 -1.667 -11.957 1.00 0.00 O ATOM 160 CB GLN A 893 -11.598 -0.413 -12.623 1.00 0.00 C ATOM 161 CG GLN A 893 -10.834 0.798 -12.114 1.00 0.00 C ATOM 162 CD GLN A 893 -10.891 1.970 -13.075 1.00 0.00 C ATOM 163 OE1 GLN A 893 -11.080 1.792 -14.279 1.00 0.00 O ATOM 164 NE2 GLN A 893 -10.729 3.177 -12.547 1.00 0.00 N ATOM 0 H GLN A 893 -12.220 -2.786 -13.751 1.00 0.00 H new ATOM 0 HA GLN A 893 -10.472 -0.498 -14.452 1.00 0.00 H new ATOM 0 HB2 GLN A 893 -12.559 -0.086 -13.019 1.00 0.00 H new ATOM 0 HB3 GLN A 893 -11.808 -1.078 -11.785 1.00 0.00 H new ATOM 0 HG2 GLN A 893 -11.243 1.103 -11.151 1.00 0.00 H new ATOM 0 HG3 GLN A 893 -9.793 0.522 -11.945 1.00 0.00 H new ATOM 0 HE21 GLN A 893 -10.575 3.278 -11.544 1.00 0.00 H new ATOM 0 HE22 GLN A 893 -10.759 4.003 -13.144 1.00 0.00 H new ATOM 173 N HIS A 894 -9.110 -2.877 -13.847 1.00 0.00 N ATOM 174 CA HIS A 894 -7.972 -3.659 -13.376 1.00 0.00 C ATOM 175 C HIS A 894 -6.688 -2.838 -13.434 1.00 0.00 C ATOM 176 O HIS A 894 -5.852 -2.909 -12.533 1.00 0.00 O ATOM 177 CB HIS A 894 -7.818 -4.929 -14.214 1.00 0.00 C ATOM 178 CG HIS A 894 -6.956 -4.746 -15.425 1.00 0.00 C ATOM 179 ND1 HIS A 894 -7.450 -4.335 -16.645 1.00 0.00 N ATOM 180 CD2 HIS A 894 -5.625 -4.920 -15.599 1.00 0.00 C ATOM 181 CE1 HIS A 894 -6.460 -4.265 -17.517 1.00 0.00 C ATOM 182 NE2 HIS A 894 -5.342 -4.614 -16.907 1.00 0.00 N ATOM 0 H HIS A 894 -9.425 -3.115 -14.788 1.00 0.00 H new ATOM 0 HA HIS A 894 -8.158 -3.937 -12.339 1.00 0.00 H new ATOM 0 HB2 HIS A 894 -7.393 -5.716 -13.591 1.00 0.00 H new ATOM 0 HB3 HIS A 894 -8.805 -5.269 -14.528 1.00 0.00 H new ATOM 0 HD1 HIS A 894 -8.427 -4.119 -16.843 1.00 0.00 H new ATOM 0 HD2 HIS A 894 -4.917 -5.240 -14.849 1.00 0.00 H new ATOM 0 HE1 HIS A 894 -6.550 -3.972 -18.553 1.00 0.00 H new ATOM 190 N LYS A 895 -6.536 -2.059 -14.500 1.00 0.00 N ATOM 191 CA LYS A 895 -5.354 -1.224 -14.676 1.00 0.00 C ATOM 192 C LYS A 895 -4.911 -0.621 -13.346 1.00 0.00 C ATOM 193 O LYS A 895 -3.716 -0.478 -13.087 1.00 0.00 O ATOM 194 CB LYS A 895 -5.639 -0.108 -15.684 1.00 0.00 C ATOM 195 CG LYS A 895 -5.334 -0.494 -17.121 1.00 0.00 C ATOM 196 CD LYS A 895 -3.837 -0.566 -17.373 1.00 0.00 C ATOM 197 CE LYS A 895 -3.526 -1.294 -18.672 1.00 0.00 C ATOM 198 NZ LYS A 895 -3.786 -2.756 -18.564 1.00 0.00 N ATOM 0 H LYS A 895 -7.218 -1.989 -15.256 1.00 0.00 H new ATOM 0 HA LYS A 895 -4.549 -1.852 -15.056 1.00 0.00 H new ATOM 0 HB2 LYS A 895 -6.688 0.179 -15.609 1.00 0.00 H new ATOM 0 HB3 LYS A 895 -5.048 0.769 -15.419 1.00 0.00 H new ATOM 0 HG2 LYS A 895 -5.788 -1.459 -17.344 1.00 0.00 H new ATOM 0 HG3 LYS A 895 -5.783 0.233 -17.797 1.00 0.00 H new ATOM 0 HD2 LYS A 895 -3.424 0.442 -17.412 1.00 0.00 H new ATOM 0 HD3 LYS A 895 -3.351 -1.078 -16.542 1.00 0.00 H new ATOM 0 HE2 LYS A 895 -4.131 -0.876 -19.476 1.00 0.00 H new ATOM 0 HE3 LYS A 895 -2.482 -1.129 -18.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 895 -2.885 -3.273 -18.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 895 -4.257 -2.959 -17.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 895 -4.398 -3.059 -19.348 1.00 0.00 H new ATOM 212 N ARG A 896 -5.881 -0.271 -12.508 1.00 0.00 N ATOM 213 CA ARG A 896 -5.590 0.315 -11.205 1.00 0.00 C ATOM 214 C ARG A 896 -5.408 -0.770 -10.148 1.00 0.00 C ATOM 215 O ARG A 896 -4.473 -0.722 -9.350 1.00 0.00 O ATOM 216 CB ARG A 896 -6.713 1.266 -10.787 1.00 0.00 C ATOM 217 CG ARG A 896 -6.576 1.783 -9.365 1.00 0.00 C ATOM 218 CD ARG A 896 -7.922 2.200 -8.792 1.00 0.00 C ATOM 219 NE ARG A 896 -8.491 3.340 -9.506 1.00 0.00 N ATOM 220 CZ ARG A 896 -9.441 4.121 -9.004 1.00 0.00 C ATOM 221 NH1 ARG A 896 -9.925 3.887 -7.792 1.00 0.00 N ATOM 222 NH2 ARG A 896 -9.908 5.139 -9.715 1.00 0.00 N ATOM 0 H ARG A 896 -6.875 -0.383 -12.708 1.00 0.00 H new ATOM 0 HA ARG A 896 -4.659 0.877 -11.288 1.00 0.00 H new ATOM 0 HB2 ARG A 896 -6.734 2.113 -11.472 1.00 0.00 H new ATOM 0 HB3 ARG A 896 -7.669 0.752 -10.887 1.00 0.00 H new ATOM 0 HG2 ARG A 896 -6.136 1.009 -8.736 1.00 0.00 H new ATOM 0 HG3 ARG A 896 -5.894 2.633 -9.350 1.00 0.00 H new ATOM 0 HD2 ARG A 896 -8.614 1.359 -8.842 1.00 0.00 H new ATOM 0 HD3 ARG A 896 -7.805 2.454 -7.739 1.00 0.00 H new ATOM 0 HE ARG A 896 -8.140 3.548 -10.441 1.00 0.00 H new ATOM 0 HH11 ARG A 896 -9.568 3.106 -7.242 1.00 0.00 H new ATOM 0 HH12 ARG A 896 -10.654 4.489 -7.409 1.00 0.00 H new ATOM 0 HH21 ARG A 896 -9.538 5.322 -10.648 1.00 0.00 H new ATOM 0 HH22 ARG A 896 -10.638 5.738 -9.329 1.00 0.00 H new ATOM 236 N GLU A 897 -6.310 -1.747 -10.150 1.00 0.00 N ATOM 237 CA GLU A 897 -6.249 -2.843 -9.190 1.00 0.00 C ATOM 238 C GLU A 897 -4.806 -3.275 -8.948 1.00 0.00 C ATOM 239 O GLU A 897 -4.291 -3.158 -7.837 1.00 0.00 O ATOM 240 CB GLU A 897 -7.073 -4.033 -9.688 1.00 0.00 C ATOM 241 CG GLU A 897 -8.573 -3.825 -9.575 1.00 0.00 C ATOM 242 CD GLU A 897 -9.079 -3.982 -8.154 1.00 0.00 C ATOM 243 OE1 GLU A 897 -8.973 -3.010 -7.377 1.00 0.00 O ATOM 244 OE2 GLU A 897 -9.580 -5.075 -7.820 1.00 0.00 O ATOM 0 H GLU A 897 -7.090 -1.802 -10.805 1.00 0.00 H new ATOM 0 HA GLU A 897 -6.667 -2.490 -8.247 1.00 0.00 H new ATOM 0 HB2 GLU A 897 -6.819 -4.229 -10.730 1.00 0.00 H new ATOM 0 HB3 GLU A 897 -6.794 -4.920 -9.120 1.00 0.00 H new ATOM 0 HG2 GLU A 897 -8.826 -2.829 -9.939 1.00 0.00 H new ATOM 0 HG3 GLU A 897 -9.085 -4.540 -10.220 1.00 0.00 H new ATOM 251 N GLU A 898 -4.160 -3.776 -9.997 1.00 0.00 N ATOM 252 CA GLU A 898 -2.777 -4.227 -9.897 1.00 0.00 C ATOM 253 C GLU A 898 -1.951 -3.266 -9.047 1.00 0.00 C ATOM 254 O GLU A 898 -1.222 -3.685 -8.149 1.00 0.00 O ATOM 255 CB GLU A 898 -2.158 -4.354 -11.291 1.00 0.00 C ATOM 256 CG GLU A 898 -2.118 -3.044 -12.061 1.00 0.00 C ATOM 257 CD GLU A 898 -2.081 -3.252 -13.562 1.00 0.00 C ATOM 258 OE1 GLU A 898 -3.045 -3.830 -14.106 1.00 0.00 O ATOM 259 OE2 GLU A 898 -1.088 -2.835 -14.194 1.00 0.00 O ATOM 0 H GLU A 898 -4.572 -3.880 -10.924 1.00 0.00 H new ATOM 0 HA GLU A 898 -2.774 -5.205 -9.415 1.00 0.00 H new ATOM 0 HB2 GLU A 898 -1.143 -4.740 -11.195 1.00 0.00 H new ATOM 0 HB3 GLU A 898 -2.725 -5.086 -11.866 1.00 0.00 H new ATOM 0 HG2 GLU A 898 -2.993 -2.447 -11.802 1.00 0.00 H new ATOM 0 HG3 GLU A 898 -1.241 -2.473 -11.755 1.00 0.00 H new ATOM 266 N ALA A 899 -2.071 -1.974 -9.339 1.00 0.00 N ATOM 267 CA ALA A 899 -1.338 -0.953 -8.601 1.00 0.00 C ATOM 268 C ALA A 899 -1.720 -0.962 -7.125 1.00 0.00 C ATOM 269 O ALA A 899 -0.854 -0.928 -6.250 1.00 0.00 O ATOM 270 CB ALA A 899 -1.592 0.419 -9.206 1.00 0.00 C ATOM 0 H ALA A 899 -2.669 -1.611 -10.081 1.00 0.00 H new ATOM 0 HA ALA A 899 -0.274 -1.179 -8.675 1.00 0.00 H new ATOM 0 HB1 ALA A 899 -1.039 1.172 -8.645 1.00 0.00 H new ATOM 0 HB2 ALA A 899 -1.262 0.425 -10.245 1.00 0.00 H new ATOM 0 HB3 ALA A 899 -2.658 0.644 -9.162 1.00 0.00 H new ATOM 276 N ILE A 900 -3.020 -1.007 -6.855 1.00 0.00 N ATOM 277 CA ILE A 900 -3.515 -1.020 -5.484 1.00 0.00 C ATOM 278 C ILE A 900 -2.864 -2.137 -4.675 1.00 0.00 C ATOM 279 O ILE A 900 -2.113 -1.877 -3.735 1.00 0.00 O ATOM 280 CB ILE A 900 -5.045 -1.195 -5.440 1.00 0.00 C ATOM 281 CG1 ILE A 900 -5.734 -0.025 -6.145 1.00 0.00 C ATOM 282 CG2 ILE A 900 -5.523 -1.309 -4.001 1.00 0.00 C ATOM 283 CD1 ILE A 900 -7.203 -0.264 -6.417 1.00 0.00 C ATOM 0 H ILE A 900 -3.750 -1.035 -7.567 1.00 0.00 H new ATOM 0 HA ILE A 900 -3.254 -0.057 -5.045 1.00 0.00 H new ATOM 0 HB ILE A 900 -5.307 -2.115 -5.963 1.00 0.00 H new ATOM 0 HG12 ILE A 900 -5.627 0.871 -5.534 1.00 0.00 H new ATOM 0 HG13 ILE A 900 -5.225 0.171 -7.089 1.00 0.00 H new ATOM 0 HG21 ILE A 900 -6.606 -1.432 -3.986 1.00 0.00 H new ATOM 0 HG22 ILE A 900 -5.053 -2.172 -3.529 1.00 0.00 H new ATOM 0 HG23 ILE A 900 -5.253 -0.405 -3.455 1.00 0.00 H new ATOM 0 HD11 ILE A 900 -7.626 0.606 -6.918 1.00 0.00 H new ATOM 0 HD12 ILE A 900 -7.317 -1.141 -7.054 1.00 0.00 H new ATOM 0 HD13 ILE A 900 -7.725 -0.430 -5.475 1.00 0.00 H new ATOM 295 N GLN A 901 -3.155 -3.378 -5.049 1.00 0.00 N ATOM 296 CA GLN A 901 -2.597 -4.534 -4.358 1.00 0.00 C ATOM 297 C GLN A 901 -1.081 -4.416 -4.237 1.00 0.00 C ATOM 298 O GLN A 901 -0.524 -4.535 -3.147 1.00 0.00 O ATOM 299 CB GLN A 901 -2.962 -5.823 -5.097 1.00 0.00 C ATOM 300 CG GLN A 901 -4.388 -6.285 -4.844 1.00 0.00 C ATOM 301 CD GLN A 901 -4.625 -6.687 -3.402 1.00 0.00 C ATOM 302 OE1 GLN A 901 -4.987 -5.718 -2.569 1.00 0.00 O flip ATOM 303 NE2 GLN A 901 -4.483 -7.855 -3.039 1.00 0.00 N flip ATOM 0 H GLN A 901 -3.774 -3.609 -5.826 1.00 0.00 H new ATOM 0 HA GLN A 901 -3.023 -4.566 -3.355 1.00 0.00 H new ATOM 0 HB2 GLN A 901 -2.823 -5.671 -6.167 1.00 0.00 H new ATOM 0 HB3 GLN A 901 -2.274 -6.613 -4.795 1.00 0.00 H new ATOM 0 HG2 GLN A 901 -5.078 -5.485 -5.112 1.00 0.00 H new ATOM 0 HG3 GLN A 901 -4.613 -7.130 -5.494 1.00 0.00 H new ATOM 0 HE21 GLN A 901 -4.204 -8.568 -3.713 1.00 0.00 H new ATOM 0 HE22 GLN A 901 -4.645 -8.109 -2.065 1.00 0.00 H new ATOM 312 N ASN A 902 -0.419 -4.183 -5.366 1.00 0.00 N ATOM 313 CA ASN A 902 1.033 -4.049 -5.386 1.00 0.00 C ATOM 314 C ASN A 902 1.503 -3.050 -4.334 1.00 0.00 C ATOM 315 O ASN A 902 2.509 -3.270 -3.658 1.00 0.00 O ATOM 316 CB ASN A 902 1.506 -3.607 -6.773 1.00 0.00 C ATOM 317 CG ASN A 902 1.736 -4.780 -7.706 1.00 0.00 C ATOM 318 OD1 ASN A 902 1.706 -5.937 -7.287 1.00 0.00 O ATOM 319 ND2 ASN A 902 1.969 -4.485 -8.980 1.00 0.00 N ATOM 0 H ASN A 902 -0.865 -4.083 -6.278 1.00 0.00 H new ATOM 0 HA ASN A 902 1.465 -5.022 -5.155 1.00 0.00 H new ATOM 0 HB2 ASN A 902 0.765 -2.938 -7.211 1.00 0.00 H new ATOM 0 HB3 ASN A 902 2.430 -3.038 -6.674 1.00 0.00 H new ATOM 0 HD21 ASN A 902 2.132 -5.232 -9.655 1.00 0.00 H new ATOM 0 HD22 ASN A 902 1.985 -3.511 -9.283 1.00 0.00 H new ATOM 326 N PHE A 903 0.768 -1.951 -4.200 1.00 0.00 N ATOM 327 CA PHE A 903 1.109 -0.917 -3.230 1.00 0.00 C ATOM 328 C PHE A 903 1.088 -1.475 -1.810 1.00 0.00 C ATOM 329 O PHE A 903 2.089 -1.425 -1.095 1.00 0.00 O ATOM 330 CB PHE A 903 0.136 0.259 -3.343 1.00 0.00 C ATOM 331 CG PHE A 903 0.654 1.528 -2.729 1.00 0.00 C ATOM 332 CD1 PHE A 903 1.658 2.253 -3.350 1.00 0.00 C ATOM 333 CD2 PHE A 903 0.139 1.994 -1.530 1.00 0.00 C ATOM 334 CE1 PHE A 903 2.137 3.422 -2.788 1.00 0.00 C ATOM 335 CE2 PHE A 903 0.614 3.162 -0.964 1.00 0.00 C ATOM 336 CZ PHE A 903 1.615 3.876 -1.593 1.00 0.00 C ATOM 0 H PHE A 903 -0.067 -1.754 -4.751 1.00 0.00 H new ATOM 0 HA PHE A 903 2.118 -0.567 -3.449 1.00 0.00 H new ATOM 0 HB2 PHE A 903 -0.084 0.438 -4.395 1.00 0.00 H new ATOM 0 HB3 PHE A 903 -0.804 -0.010 -2.862 1.00 0.00 H new ATOM 0 HD1 PHE A 903 2.071 1.901 -4.284 1.00 0.00 H new ATOM 0 HD2 PHE A 903 -0.642 1.438 -1.032 1.00 0.00 H new ATOM 0 HE1 PHE A 903 2.918 3.979 -3.283 1.00 0.00 H new ATOM 0 HE2 PHE A 903 0.203 3.516 -0.030 1.00 0.00 H new ATOM 0 HZ PHE A 903 1.989 4.788 -1.151 1.00 0.00 H new ATOM 346 N LYS A 904 -0.062 -2.006 -1.406 1.00 0.00 N ATOM 347 CA LYS A 904 -0.216 -2.574 -0.073 1.00 0.00 C ATOM 348 C LYS A 904 0.925 -3.536 0.244 1.00 0.00 C ATOM 349 O LYS A 904 1.572 -3.426 1.285 1.00 0.00 O ATOM 350 CB LYS A 904 -1.557 -3.302 0.042 1.00 0.00 C ATOM 351 CG LYS A 904 -2.757 -2.415 -0.242 1.00 0.00 C ATOM 352 CD LYS A 904 -3.927 -3.218 -0.785 1.00 0.00 C ATOM 353 CE LYS A 904 -5.209 -2.399 -0.791 1.00 0.00 C ATOM 354 NZ LYS A 904 -5.876 -2.402 0.540 1.00 0.00 N ATOM 0 H LYS A 904 -0.901 -2.054 -1.984 1.00 0.00 H new ATOM 0 HA LYS A 904 -0.190 -1.757 0.648 1.00 0.00 H new ATOM 0 HB2 LYS A 904 -1.565 -4.143 -0.652 1.00 0.00 H new ATOM 0 HB3 LYS A 904 -1.651 -3.716 1.046 1.00 0.00 H new ATOM 0 HG2 LYS A 904 -3.058 -1.905 0.673 1.00 0.00 H new ATOM 0 HG3 LYS A 904 -2.479 -1.644 -0.960 1.00 0.00 H new ATOM 0 HD2 LYS A 904 -3.702 -3.551 -1.798 1.00 0.00 H new ATOM 0 HD3 LYS A 904 -4.068 -4.113 -0.179 1.00 0.00 H new ATOM 0 HE2 LYS A 904 -4.983 -1.373 -1.081 1.00 0.00 H new ATOM 0 HE3 LYS A 904 -5.892 -2.799 -1.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 904 -6.745 -1.833 0.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 904 -6.115 -3.379 0.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 904 -5.234 -1.996 1.251 1.00 0.00 H new ATOM 368 N ALA A 905 1.168 -4.478 -0.662 1.00 0.00 N ATOM 369 CA ALA A 905 2.233 -5.456 -0.480 1.00 0.00 C ATOM 370 C ALA A 905 3.581 -4.770 -0.287 1.00 0.00 C ATOM 371 O ALA A 905 4.395 -5.199 0.533 1.00 0.00 O ATOM 372 CB ALA A 905 2.287 -6.405 -1.668 1.00 0.00 C ATOM 0 H ALA A 905 0.641 -4.584 -1.529 1.00 0.00 H new ATOM 0 HA ALA A 905 2.015 -6.031 0.420 1.00 0.00 H new ATOM 0 HB1 ALA A 905 3.087 -7.130 -1.518 1.00 0.00 H new ATOM 0 HB2 ALA A 905 1.335 -6.928 -1.759 1.00 0.00 H new ATOM 0 HB3 ALA A 905 2.477 -5.837 -2.579 1.00 0.00 H new ATOM 378 N LEU A 906 3.812 -3.705 -1.045 1.00 0.00 N ATOM 379 CA LEU A 906 5.062 -2.959 -0.958 1.00 0.00 C ATOM 380 C LEU A 906 5.192 -2.270 0.397 1.00 0.00 C ATOM 381 O LEU A 906 6.267 -2.258 0.999 1.00 0.00 O ATOM 382 CB LEU A 906 5.140 -1.922 -2.080 1.00 0.00 C ATOM 383 CG LEU A 906 6.287 -0.915 -1.984 1.00 0.00 C ATOM 384 CD1 LEU A 906 7.589 -1.541 -2.460 1.00 0.00 C ATOM 385 CD2 LEU A 906 5.968 0.335 -2.792 1.00 0.00 C ATOM 0 H LEU A 906 3.149 -3.338 -1.728 1.00 0.00 H new ATOM 0 HA LEU A 906 5.886 -3.665 -1.067 1.00 0.00 H new ATOM 0 HB2 LEU A 906 5.225 -2.450 -3.030 1.00 0.00 H new ATOM 0 HB3 LEU A 906 4.200 -1.371 -2.104 1.00 0.00 H new ATOM 0 HG LEU A 906 6.406 -0.628 -0.939 1.00 0.00 H new ATOM 0 HD11 LEU A 906 8.393 -0.809 -2.384 1.00 0.00 H new ATOM 0 HD12 LEU A 906 7.825 -2.406 -1.840 1.00 0.00 H new ATOM 0 HD13 LEU A 906 7.483 -1.857 -3.498 1.00 0.00 H new ATOM 0 HD21 LEU A 906 6.795 1.041 -2.712 1.00 0.00 H new ATOM 0 HD22 LEU A 906 5.821 0.065 -3.838 1.00 0.00 H new ATOM 0 HD23 LEU A 906 5.059 0.796 -2.405 1.00 0.00 H new ATOM 397 N LEU A 907 4.091 -1.700 0.872 1.00 0.00 N ATOM 398 CA LEU A 907 4.081 -1.010 2.158 1.00 0.00 C ATOM 399 C LEU A 907 4.538 -1.940 3.278 1.00 0.00 C ATOM 400 O LEU A 907 5.396 -1.582 4.084 1.00 0.00 O ATOM 401 CB LEU A 907 2.679 -0.478 2.462 1.00 0.00 C ATOM 402 CG LEU A 907 2.132 0.566 1.488 1.00 0.00 C ATOM 403 CD1 LEU A 907 0.677 0.877 1.800 1.00 0.00 C ATOM 404 CD2 LEU A 907 2.972 1.834 1.537 1.00 0.00 C ATOM 0 H LEU A 907 3.194 -1.701 0.387 1.00 0.00 H new ATOM 0 HA LEU A 907 4.776 -0.173 2.099 1.00 0.00 H new ATOM 0 HB2 LEU A 907 1.989 -1.321 2.485 1.00 0.00 H new ATOM 0 HB3 LEU A 907 2.685 -0.045 3.462 1.00 0.00 H new ATOM 0 HG LEU A 907 2.187 0.157 0.479 1.00 0.00 H new ATOM 0 HD11 LEU A 907 0.305 1.622 1.096 1.00 0.00 H new ATOM 0 HD12 LEU A 907 0.084 -0.033 1.712 1.00 0.00 H new ATOM 0 HD13 LEU A 907 0.598 1.265 2.815 1.00 0.00 H new ATOM 0 HD21 LEU A 907 2.568 2.566 0.837 1.00 0.00 H new ATOM 0 HD22 LEU A 907 2.950 2.246 2.546 1.00 0.00 H new ATOM 0 HD23 LEU A 907 4.001 1.600 1.263 1.00 0.00 H new ATOM 416 N SER A 908 3.959 -3.136 3.320 1.00 0.00 N ATOM 417 CA SER A 908 4.306 -4.117 4.342 1.00 0.00 C ATOM 418 C SER A 908 5.728 -4.632 4.140 1.00 0.00 C ATOM 419 O SER A 908 6.531 -4.652 5.073 1.00 0.00 O ATOM 420 CB SER A 908 3.319 -5.285 4.314 1.00 0.00 C ATOM 421 OG SER A 908 3.757 -6.344 5.147 1.00 0.00 O ATOM 0 H SER A 908 3.248 -3.449 2.659 1.00 0.00 H new ATOM 0 HA SER A 908 4.250 -3.628 5.314 1.00 0.00 H new ATOM 0 HB2 SER A 908 2.337 -4.943 4.641 1.00 0.00 H new ATOM 0 HB3 SER A 908 3.206 -5.645 3.291 1.00 0.00 H new ATOM 0 HG SER A 908 3.108 -7.077 5.112 1.00 0.00 H new ATOM 427 N ASP A 909 6.030 -5.049 2.915 1.00 0.00 N ATOM 428 CA ASP A 909 7.355 -5.565 2.589 1.00 0.00 C ATOM 429 C ASP A 909 8.441 -4.581 3.014 1.00 0.00 C ATOM 430 O ASP A 909 9.299 -4.906 3.835 1.00 0.00 O ATOM 431 CB ASP A 909 7.461 -5.843 1.089 1.00 0.00 C ATOM 432 CG ASP A 909 7.044 -7.257 0.732 1.00 0.00 C ATOM 433 OD1 ASP A 909 7.883 -8.173 0.861 1.00 0.00 O ATOM 434 OD2 ASP A 909 5.880 -7.446 0.322 1.00 0.00 O ATOM 0 H ASP A 909 5.376 -5.040 2.132 1.00 0.00 H new ATOM 0 HA ASP A 909 7.500 -6.497 3.135 1.00 0.00 H new ATOM 0 HB2 ASP A 909 6.835 -5.135 0.546 1.00 0.00 H new ATOM 0 HB3 ASP A 909 8.488 -5.677 0.763 1.00 0.00 H new ATOM 439 N MET A 910 8.397 -3.379 2.450 1.00 0.00 N ATOM 440 CA MET A 910 9.378 -2.348 2.771 1.00 0.00 C ATOM 441 C MET A 910 9.133 -1.781 4.166 1.00 0.00 C ATOM 442 O MET A 910 10.014 -1.814 5.024 1.00 0.00 O ATOM 443 CB MET A 910 9.326 -1.224 1.734 1.00 0.00 C ATOM 444 CG MET A 910 9.970 -1.592 0.407 1.00 0.00 C ATOM 445 SD MET A 910 11.767 -1.694 0.510 1.00 0.00 S ATOM 446 CE MET A 910 12.240 -0.191 -0.342 1.00 0.00 C ATOM 0 H MET A 910 7.693 -3.094 1.769 1.00 0.00 H new ATOM 0 HA MET A 910 10.368 -2.804 2.752 1.00 0.00 H new ATOM 0 HB2 MET A 910 8.286 -0.949 1.560 1.00 0.00 H new ATOM 0 HB3 MET A 910 9.825 -0.344 2.139 1.00 0.00 H new ATOM 0 HG2 MET A 910 9.575 -2.550 0.069 1.00 0.00 H new ATOM 0 HG3 MET A 910 9.695 -0.851 -0.344 1.00 0.00 H new ATOM 0 HE1 MET A 910 13.155 0.205 0.099 1.00 0.00 H new ATOM 0 HE2 MET A 910 12.410 -0.409 -1.396 1.00 0.00 H new ATOM 0 HE3 MET A 910 11.443 0.547 -0.248 1.00 0.00 H new ATOM 456 N VAL A 911 7.929 -1.260 4.385 1.00 0.00 N ATOM 457 CA VAL A 911 7.568 -0.685 5.675 1.00 0.00 C ATOM 458 C VAL A 911 6.806 -1.692 6.530 1.00 0.00 C ATOM 459 O VAL A 911 5.577 -1.672 6.583 1.00 0.00 O ATOM 460 CB VAL A 911 6.710 0.582 5.505 1.00 0.00 C ATOM 461 CG1 VAL A 911 6.640 1.358 6.811 1.00 0.00 C ATOM 462 CG2 VAL A 911 7.262 1.453 4.387 1.00 0.00 C ATOM 0 H VAL A 911 7.188 -1.225 3.685 1.00 0.00 H new ATOM 0 HA VAL A 911 8.499 -0.418 6.175 1.00 0.00 H new ATOM 0 HB VAL A 911 5.698 0.281 5.234 1.00 0.00 H new ATOM 0 HG11 VAL A 911 6.030 2.250 6.672 1.00 0.00 H new ATOM 0 HG12 VAL A 911 6.195 0.731 7.584 1.00 0.00 H new ATOM 0 HG13 VAL A 911 7.645 1.650 7.115 1.00 0.00 H new ATOM 0 HG21 VAL A 911 6.643 2.344 4.281 1.00 0.00 H new ATOM 0 HG22 VAL A 911 8.284 1.747 4.626 1.00 0.00 H new ATOM 0 HG23 VAL A 911 7.255 0.893 3.452 1.00 0.00 H new ATOM 472 N ARG A 912 7.545 -2.570 7.200 1.00 0.00 N ATOM 473 CA ARG A 912 6.939 -3.585 8.053 1.00 0.00 C ATOM 474 C ARG A 912 6.847 -3.098 9.496 1.00 0.00 C ATOM 475 O ARG A 912 6.182 -3.715 10.329 1.00 0.00 O ATOM 476 CB ARG A 912 7.747 -4.883 7.992 1.00 0.00 C ATOM 477 CG ARG A 912 9.166 -4.742 8.519 1.00 0.00 C ATOM 478 CD ARG A 912 9.979 -6.003 8.273 1.00 0.00 C ATOM 479 NE ARG A 912 10.121 -6.293 6.849 1.00 0.00 N ATOM 480 CZ ARG A 912 10.575 -7.449 6.376 1.00 0.00 C ATOM 481 NH1 ARG A 912 10.928 -8.417 7.210 1.00 0.00 N ATOM 482 NH2 ARG A 912 10.676 -7.638 5.067 1.00 0.00 N ATOM 0 H ARG A 912 8.564 -2.599 7.169 1.00 0.00 H new ATOM 0 HA ARG A 912 5.930 -3.776 7.687 1.00 0.00 H new ATOM 0 HB2 ARG A 912 7.229 -5.651 8.567 1.00 0.00 H new ATOM 0 HB3 ARG A 912 7.785 -5.230 6.959 1.00 0.00 H new ATOM 0 HG2 ARG A 912 9.652 -3.894 8.036 1.00 0.00 H new ATOM 0 HG3 ARG A 912 9.139 -4.528 9.587 1.00 0.00 H new ATOM 0 HD2 ARG A 912 10.967 -5.891 8.720 1.00 0.00 H new ATOM 0 HD3 ARG A 912 9.499 -6.847 8.769 1.00 0.00 H new ATOM 0 HE ARG A 912 9.857 -5.569 6.181 1.00 0.00 H new ATOM 0 HH11 ARG A 912 10.851 -8.276 8.217 1.00 0.00 H new ATOM 0 HH12 ARG A 912 11.276 -9.303 6.844 1.00 0.00 H new ATOM 0 HH21 ARG A 912 10.405 -6.896 4.422 1.00 0.00 H new ATOM 0 HH22 ARG A 912 11.025 -8.526 4.705 1.00 0.00 H new ATOM 496 N SER A 913 7.520 -1.989 9.785 1.00 0.00 N ATOM 497 CA SER A 913 7.518 -1.422 11.129 1.00 0.00 C ATOM 498 C SER A 913 6.235 -0.636 11.384 1.00 0.00 C ATOM 499 O SER A 913 5.418 -0.450 10.483 1.00 0.00 O ATOM 500 CB SER A 913 8.733 -0.514 11.323 1.00 0.00 C ATOM 501 OG SER A 913 9.049 -0.372 12.698 1.00 0.00 O ATOM 0 H SER A 913 8.074 -1.465 9.107 1.00 0.00 H new ATOM 0 HA SER A 913 7.569 -2.243 11.844 1.00 0.00 H new ATOM 0 HB2 SER A 913 9.589 -0.928 10.791 1.00 0.00 H new ATOM 0 HB3 SER A 913 8.532 0.466 10.890 1.00 0.00 H new ATOM 0 HG SER A 913 9.830 0.212 12.796 1.00 0.00 H new ATOM 507 N SER A 914 6.067 -0.176 12.620 1.00 0.00 N ATOM 508 CA SER A 914 4.883 0.587 12.997 1.00 0.00 C ATOM 509 C SER A 914 5.264 1.996 13.443 1.00 0.00 C ATOM 510 O SER A 914 4.444 2.914 13.404 1.00 0.00 O ATOM 511 CB SER A 914 4.126 -0.127 14.118 1.00 0.00 C ATOM 512 OG SER A 914 4.958 -0.331 15.247 1.00 0.00 O ATOM 0 H SER A 914 6.736 -0.318 13.377 1.00 0.00 H new ATOM 0 HA SER A 914 4.237 0.663 12.123 1.00 0.00 H new ATOM 0 HB2 SER A 914 3.256 0.462 14.406 1.00 0.00 H new ATOM 0 HB3 SER A 914 3.756 -1.087 13.757 1.00 0.00 H new ATOM 0 HG SER A 914 4.450 -0.787 15.950 1.00 0.00 H new ATOM 518 N ASP A 915 6.513 2.158 13.866 1.00 0.00 N ATOM 519 CA ASP A 915 7.004 3.455 14.319 1.00 0.00 C ATOM 520 C ASP A 915 7.636 4.228 13.166 1.00 0.00 C ATOM 521 O ASP A 915 8.715 4.805 13.310 1.00 0.00 O ATOM 522 CB ASP A 915 8.021 3.273 15.447 1.00 0.00 C ATOM 523 CG ASP A 915 7.564 2.264 16.481 1.00 0.00 C ATOM 524 OD1 ASP A 915 6.373 2.295 16.856 1.00 0.00 O ATOM 525 OD2 ASP A 915 8.397 1.442 16.916 1.00 0.00 O ATOM 0 H ASP A 915 7.204 1.408 13.905 1.00 0.00 H new ATOM 0 HA ASP A 915 6.156 4.027 14.695 1.00 0.00 H new ATOM 0 HB2 ASP A 915 8.973 2.951 15.025 1.00 0.00 H new ATOM 0 HB3 ASP A 915 8.196 4.233 15.933 1.00 0.00 H new ATOM 530 N VAL A 916 6.959 4.236 12.023 1.00 0.00 N ATOM 531 CA VAL A 916 7.454 4.938 10.845 1.00 0.00 C ATOM 532 C VAL A 916 6.499 6.050 10.425 1.00 0.00 C ATOM 533 O VAL A 916 5.280 5.907 10.530 1.00 0.00 O ATOM 534 CB VAL A 916 7.656 3.975 9.660 1.00 0.00 C ATOM 535 CG1 VAL A 916 8.799 3.012 9.944 1.00 0.00 C ATOM 536 CG2 VAL A 916 6.370 3.218 9.365 1.00 0.00 C ATOM 0 H VAL A 916 6.065 3.764 11.887 1.00 0.00 H new ATOM 0 HA VAL A 916 8.416 5.373 11.118 1.00 0.00 H new ATOM 0 HB VAL A 916 7.917 4.560 8.778 1.00 0.00 H new ATOM 0 HG11 VAL A 916 8.927 2.339 9.096 1.00 0.00 H new ATOM 0 HG12 VAL A 916 9.719 3.575 10.102 1.00 0.00 H new ATOM 0 HG13 VAL A 916 8.571 2.430 10.837 1.00 0.00 H new ATOM 0 HG21 VAL A 916 6.530 2.542 8.525 1.00 0.00 H new ATOM 0 HG22 VAL A 916 6.077 2.643 10.243 1.00 0.00 H new ATOM 0 HG23 VAL A 916 5.580 3.926 9.115 1.00 0.00 H new ATOM 546 N SER A 917 7.059 7.156 9.949 1.00 0.00 N ATOM 547 CA SER A 917 6.257 8.294 9.516 1.00 0.00 C ATOM 548 C SER A 917 5.971 8.220 8.019 1.00 0.00 C ATOM 549 O SER A 917 6.743 7.637 7.257 1.00 0.00 O ATOM 550 CB SER A 917 6.974 9.605 9.845 1.00 0.00 C ATOM 551 OG SER A 917 6.989 9.842 11.242 1.00 0.00 O ATOM 0 H SER A 917 8.066 7.289 9.853 1.00 0.00 H new ATOM 0 HA SER A 917 5.308 8.262 10.051 1.00 0.00 H new ATOM 0 HB2 SER A 917 7.996 9.568 9.468 1.00 0.00 H new ATOM 0 HB3 SER A 917 6.477 10.432 9.338 1.00 0.00 H new ATOM 0 HG SER A 917 7.454 10.685 11.426 1.00 0.00 H new ATOM 557 N TRP A 918 4.857 8.813 7.606 1.00 0.00 N ATOM 558 CA TRP A 918 4.468 8.814 6.201 1.00 0.00 C ATOM 559 C TRP A 918 5.609 9.313 5.320 1.00 0.00 C ATOM 560 O TRP A 918 5.821 8.807 4.218 1.00 0.00 O ATOM 561 CB TRP A 918 3.229 9.686 5.994 1.00 0.00 C ATOM 562 CG TRP A 918 3.037 10.117 4.571 1.00 0.00 C ATOM 563 CD1 TRP A 918 2.900 11.397 4.114 1.00 0.00 C ATOM 564 CD2 TRP A 918 2.958 9.267 3.421 1.00 0.00 C ATOM 565 NE1 TRP A 918 2.741 11.394 2.749 1.00 0.00 N ATOM 566 CE2 TRP A 918 2.774 10.100 2.300 1.00 0.00 C ATOM 567 CE3 TRP A 918 3.027 7.885 3.230 1.00 0.00 C ATOM 568 CZ2 TRP A 918 2.657 9.593 1.008 1.00 0.00 C ATOM 569 CZ3 TRP A 918 2.911 7.384 1.947 1.00 0.00 C ATOM 570 CH2 TRP A 918 2.728 8.236 0.850 1.00 0.00 C ATOM 0 H TRP A 918 4.207 9.299 8.224 1.00 0.00 H new ATOM 0 HA TRP A 918 4.234 7.789 5.914 1.00 0.00 H new ATOM 0 HB2 TRP A 918 2.347 9.135 6.322 1.00 0.00 H new ATOM 0 HB3 TRP A 918 3.306 10.570 6.627 1.00 0.00 H new ATOM 0 HD1 TRP A 918 2.915 12.281 4.734 1.00 0.00 H new ATOM 0 HE1 TRP A 918 2.618 12.221 2.165 1.00 0.00 H new ATOM 0 HE3 TRP A 918 3.168 7.220 4.069 1.00 0.00 H new ATOM 0 HZ2 TRP A 918 2.515 10.248 0.161 1.00 0.00 H new ATOM 0 HZ3 TRP A 918 2.962 6.317 1.787 1.00 0.00 H new ATOM 0 HH2 TRP A 918 2.641 7.813 -0.140 1.00 0.00 H new ATOM 581 N SER A 919 6.340 10.307 5.814 1.00 0.00 N ATOM 582 CA SER A 919 7.457 10.876 5.070 1.00 0.00 C ATOM 583 C SER A 919 8.590 9.863 4.930 1.00 0.00 C ATOM 584 O SER A 919 9.106 9.639 3.835 1.00 0.00 O ATOM 585 CB SER A 919 7.970 12.139 5.765 1.00 0.00 C ATOM 586 OG SER A 919 7.118 13.242 5.512 1.00 0.00 O ATOM 0 H SER A 919 6.179 10.735 6.726 1.00 0.00 H new ATOM 0 HA SER A 919 7.101 11.137 4.073 1.00 0.00 H new ATOM 0 HB2 SER A 919 8.036 11.965 6.839 1.00 0.00 H new ATOM 0 HB3 SER A 919 8.977 12.366 5.416 1.00 0.00 H new ATOM 0 HG SER A 919 7.467 14.036 5.968 1.00 0.00 H new ATOM 592 N ASP A 920 8.970 9.253 6.047 1.00 0.00 N ATOM 593 CA ASP A 920 10.041 8.263 6.051 1.00 0.00 C ATOM 594 C ASP A 920 9.792 7.190 4.996 1.00 0.00 C ATOM 595 O ASP A 920 10.707 6.787 4.276 1.00 0.00 O ATOM 596 CB ASP A 920 10.163 7.618 7.433 1.00 0.00 C ATOM 597 CG ASP A 920 11.566 7.121 7.718 1.00 0.00 C ATOM 598 OD1 ASP A 920 12.521 7.909 7.549 1.00 0.00 O ATOM 599 OD2 ASP A 920 11.711 5.945 8.111 1.00 0.00 O ATOM 0 H ASP A 920 8.553 9.426 6.961 1.00 0.00 H new ATOM 0 HA ASP A 920 10.975 8.772 5.813 1.00 0.00 H new ATOM 0 HB2 ASP A 920 9.875 8.342 8.195 1.00 0.00 H new ATOM 0 HB3 ASP A 920 9.464 6.785 7.505 1.00 0.00 H new ATOM 604 N THR A 921 8.548 6.730 4.909 1.00 0.00 N ATOM 605 CA THR A 921 8.179 5.702 3.943 1.00 0.00 C ATOM 606 C THR A 921 8.217 6.246 2.520 1.00 0.00 C ATOM 607 O THR A 921 8.917 5.712 1.659 1.00 0.00 O ATOM 608 CB THR A 921 6.773 5.141 4.229 1.00 0.00 C ATOM 609 OG1 THR A 921 6.747 4.518 5.518 1.00 0.00 O ATOM 610 CG2 THR A 921 6.366 4.134 3.164 1.00 0.00 C ATOM 0 H THR A 921 7.779 7.053 5.496 1.00 0.00 H new ATOM 0 HA THR A 921 8.909 4.899 4.042 1.00 0.00 H new ATOM 0 HB THR A 921 6.065 5.969 4.213 1.00 0.00 H new ATOM 0 HG1 THR A 921 5.978 4.851 6.027 1.00 0.00 H new ATOM 0 HG21 THR A 921 5.370 3.751 3.387 1.00 0.00 H new ATOM 0 HG22 THR A 921 6.358 4.620 2.188 1.00 0.00 H new ATOM 0 HG23 THR A 921 7.078 3.308 3.153 1.00 0.00 H new ATOM 618 N ARG A 922 7.461 7.312 2.278 1.00 0.00 N ATOM 619 CA ARG A 922 7.408 7.928 0.958 1.00 0.00 C ATOM 620 C ARG A 922 8.780 7.900 0.290 1.00 0.00 C ATOM 621 O ARG A 922 8.932 7.387 -0.819 1.00 0.00 O ATOM 622 CB ARG A 922 6.909 9.370 1.064 1.00 0.00 C ATOM 623 CG ARG A 922 6.340 9.915 -0.236 1.00 0.00 C ATOM 624 CD ARG A 922 5.688 11.273 -0.032 1.00 0.00 C ATOM 625 NE ARG A 922 5.013 11.743 -1.239 1.00 0.00 N ATOM 626 CZ ARG A 922 4.755 13.022 -1.487 1.00 0.00 C ATOM 627 NH1 ARG A 922 5.116 13.955 -0.616 1.00 0.00 N ATOM 628 NH2 ARG A 922 4.137 13.371 -2.608 1.00 0.00 N ATOM 0 H ARG A 922 6.877 7.767 2.979 1.00 0.00 H new ATOM 0 HA ARG A 922 6.713 7.355 0.345 1.00 0.00 H new ATOM 0 HB2 ARG A 922 6.143 9.424 1.837 1.00 0.00 H new ATOM 0 HB3 ARG A 922 7.732 10.008 1.386 1.00 0.00 H new ATOM 0 HG2 ARG A 922 7.136 10.000 -0.976 1.00 0.00 H new ATOM 0 HG3 ARG A 922 5.607 9.214 -0.636 1.00 0.00 H new ATOM 0 HD2 ARG A 922 4.969 11.211 0.785 1.00 0.00 H new ATOM 0 HD3 ARG A 922 6.446 11.998 0.265 1.00 0.00 H new ATOM 0 HE ARG A 922 4.724 11.051 -1.930 1.00 0.00 H new ATOM 0 HH11 ARG A 922 5.593 13.691 0.246 1.00 0.00 H new ATOM 0 HH12 ARG A 922 4.917 14.937 -0.808 1.00 0.00 H new ATOM 0 HH21 ARG A 922 3.859 12.657 -3.281 1.00 0.00 H new ATOM 0 HH22 ARG A 922 3.940 14.354 -2.797 1.00 0.00 H new ATOM 642 N ARG A 923 9.776 8.457 0.972 1.00 0.00 N ATOM 643 CA ARG A 923 11.134 8.498 0.445 1.00 0.00 C ATOM 644 C ARG A 923 11.695 7.089 0.277 1.00 0.00 C ATOM 645 O ARG A 923 12.218 6.739 -0.782 1.00 0.00 O ATOM 646 CB ARG A 923 12.039 9.312 1.371 1.00 0.00 C ATOM 647 CG ARG A 923 13.500 9.311 0.950 1.00 0.00 C ATOM 648 CD ARG A 923 14.343 10.188 1.863 1.00 0.00 C ATOM 649 NE ARG A 923 14.382 11.575 1.406 1.00 0.00 N ATOM 650 CZ ARG A 923 14.682 12.600 2.195 1.00 0.00 C ATOM 651 NH1 ARG A 923 14.968 12.396 3.474 1.00 0.00 N ATOM 652 NH2 ARG A 923 14.696 13.834 1.706 1.00 0.00 N ATOM 0 H ARG A 923 9.667 8.886 1.891 1.00 0.00 H new ATOM 0 HA ARG A 923 11.103 8.977 -0.534 1.00 0.00 H new ATOM 0 HB2 ARG A 923 11.680 10.341 1.404 1.00 0.00 H new ATOM 0 HB3 ARG A 923 11.961 8.915 2.383 1.00 0.00 H new ATOM 0 HG2 ARG A 923 13.884 8.291 0.967 1.00 0.00 H new ATOM 0 HG3 ARG A 923 13.584 9.666 -0.077 1.00 0.00 H new ATOM 0 HD2 ARG A 923 13.940 10.151 2.875 1.00 0.00 H new ATOM 0 HD3 ARG A 923 15.358 9.793 1.910 1.00 0.00 H new ATOM 0 HE ARG A 923 14.167 11.766 0.427 1.00 0.00 H new ATOM 0 HH11 ARG A 923 14.958 11.450 3.854 1.00 0.00 H new ATOM 0 HH12 ARG A 923 15.198 13.186 4.077 1.00 0.00 H new ATOM 0 HH21 ARG A 923 14.476 13.996 0.723 1.00 0.00 H new ATOM 0 HH22 ARG A 923 14.927 14.621 2.313 1.00 0.00 H new ATOM 666 N THR A 924 11.583 6.284 1.329 1.00 0.00 N ATOM 667 CA THR A 924 12.080 4.914 1.299 1.00 0.00 C ATOM 668 C THR A 924 11.603 4.183 0.049 1.00 0.00 C ATOM 669 O THR A 924 12.366 3.452 -0.584 1.00 0.00 O ATOM 670 CB THR A 924 11.631 4.126 2.544 1.00 0.00 C ATOM 671 OG1 THR A 924 12.089 4.783 3.731 1.00 0.00 O ATOM 672 CG2 THR A 924 12.167 2.703 2.506 1.00 0.00 C ATOM 0 H THR A 924 11.152 6.557 2.212 1.00 0.00 H new ATOM 0 HA THR A 924 13.168 4.973 1.289 1.00 0.00 H new ATOM 0 HB THR A 924 10.542 4.087 2.549 1.00 0.00 H new ATOM 0 HG1 THR A 924 11.362 5.321 4.108 1.00 0.00 H new ATOM 0 HG21 THR A 924 11.837 2.166 3.395 1.00 0.00 H new ATOM 0 HG22 THR A 924 11.792 2.197 1.616 1.00 0.00 H new ATOM 0 HG23 THR A 924 13.256 2.725 2.479 1.00 0.00 H new ATOM 680 N LEU A 925 10.338 4.385 -0.302 1.00 0.00 N ATOM 681 CA LEU A 925 9.759 3.746 -1.478 1.00 0.00 C ATOM 682 C LEU A 925 10.244 4.419 -2.758 1.00 0.00 C ATOM 683 O LEU A 925 10.612 3.748 -3.723 1.00 0.00 O ATOM 684 CB LEU A 925 8.232 3.794 -1.410 1.00 0.00 C ATOM 685 CG LEU A 925 7.595 3.167 -0.169 1.00 0.00 C ATOM 686 CD1 LEU A 925 6.081 3.294 -0.224 1.00 0.00 C ATOM 687 CD2 LEU A 925 8.006 1.708 -0.038 1.00 0.00 C ATOM 0 H LEU A 925 9.694 4.986 0.211 1.00 0.00 H new ATOM 0 HA LEU A 925 10.083 2.705 -1.491 1.00 0.00 H new ATOM 0 HB2 LEU A 925 7.918 4.836 -1.467 1.00 0.00 H new ATOM 0 HB3 LEU A 925 7.833 3.292 -2.291 1.00 0.00 H new ATOM 0 HG LEU A 925 7.952 3.704 0.710 1.00 0.00 H new ATOM 0 HD11 LEU A 925 5.645 2.842 0.667 1.00 0.00 H new ATOM 0 HD12 LEU A 925 5.806 4.348 -0.268 1.00 0.00 H new ATOM 0 HD13 LEU A 925 5.705 2.783 -1.110 1.00 0.00 H new ATOM 0 HD21 LEU A 925 7.543 1.278 0.850 1.00 0.00 H new ATOM 0 HD22 LEU A 925 7.679 1.157 -0.920 1.00 0.00 H new ATOM 0 HD23 LEU A 925 9.090 1.642 0.049 1.00 0.00 H new ATOM 699 N ARG A 926 10.242 5.748 -2.759 1.00 0.00 N ATOM 700 CA ARG A 926 10.682 6.512 -3.920 1.00 0.00 C ATOM 701 C ARG A 926 11.862 5.829 -4.605 1.00 0.00 C ATOM 702 O ARG A 926 11.921 5.747 -5.832 1.00 0.00 O ATOM 703 CB ARG A 926 11.072 7.932 -3.505 1.00 0.00 C ATOM 704 CG ARG A 926 9.893 8.889 -3.429 1.00 0.00 C ATOM 705 CD ARG A 926 10.340 10.293 -3.055 1.00 0.00 C ATOM 706 NE ARG A 926 10.943 10.995 -4.184 1.00 0.00 N ATOM 707 CZ ARG A 926 10.241 11.635 -5.112 1.00 0.00 C ATOM 708 NH1 ARG A 926 8.917 11.662 -5.045 1.00 0.00 N ATOM 709 NH2 ARG A 926 10.863 12.251 -6.110 1.00 0.00 N ATOM 0 H ARG A 926 9.941 6.318 -1.969 1.00 0.00 H new ATOM 0 HA ARG A 926 9.853 6.562 -4.626 1.00 0.00 H new ATOM 0 HB2 ARG A 926 11.563 7.896 -2.533 1.00 0.00 H new ATOM 0 HB3 ARG A 926 11.801 8.322 -4.216 1.00 0.00 H new ATOM 0 HG2 ARG A 926 9.380 8.913 -4.390 1.00 0.00 H new ATOM 0 HG3 ARG A 926 9.175 8.526 -2.693 1.00 0.00 H new ATOM 0 HD2 ARG A 926 9.484 10.861 -2.691 1.00 0.00 H new ATOM 0 HD3 ARG A 926 11.058 10.239 -2.237 1.00 0.00 H new ATOM 0 HE ARG A 926 11.960 10.994 -4.265 1.00 0.00 H new ATOM 0 HH11 ARG A 926 8.435 11.191 -4.279 1.00 0.00 H new ATOM 0 HH12 ARG A 926 8.380 12.154 -5.759 1.00 0.00 H new ATOM 0 HH21 ARG A 926 11.881 12.233 -6.165 1.00 0.00 H new ATOM 0 HH22 ARG A 926 10.323 12.742 -6.822 1.00 0.00 H new ATOM 723 N LYS A 927 12.802 5.339 -3.803 1.00 0.00 N ATOM 724 CA LYS A 927 13.981 4.662 -4.330 1.00 0.00 C ATOM 725 C LYS A 927 13.595 3.366 -5.036 1.00 0.00 C ATOM 726 O LYS A 927 14.123 3.048 -6.102 1.00 0.00 O ATOM 727 CB LYS A 927 14.970 4.364 -3.201 1.00 0.00 C ATOM 728 CG LYS A 927 15.489 5.609 -2.502 1.00 0.00 C ATOM 729 CD LYS A 927 16.426 6.402 -3.398 1.00 0.00 C ATOM 730 CE LYS A 927 16.624 7.819 -2.881 1.00 0.00 C ATOM 731 NZ LYS A 927 17.074 8.743 -3.958 1.00 0.00 N ATOM 0 H LYS A 927 12.770 5.398 -2.785 1.00 0.00 H new ATOM 0 HA LYS A 927 14.455 5.323 -5.056 1.00 0.00 H new ATOM 0 HB2 LYS A 927 14.486 3.720 -2.466 1.00 0.00 H new ATOM 0 HB3 LYS A 927 15.814 3.807 -3.607 1.00 0.00 H new ATOM 0 HG2 LYS A 927 14.649 6.237 -2.205 1.00 0.00 H new ATOM 0 HG3 LYS A 927 16.012 5.324 -1.589 1.00 0.00 H new ATOM 0 HD2 LYS A 927 17.390 5.897 -3.456 1.00 0.00 H new ATOM 0 HD3 LYS A 927 16.022 6.436 -4.410 1.00 0.00 H new ATOM 0 HE2 LYS A 927 15.689 8.185 -2.456 1.00 0.00 H new ATOM 0 HE3 LYS A 927 17.360 7.813 -2.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 927 17.198 9.698 -3.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 927 17.979 8.408 -4.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 927 16.360 8.769 -4.714 1.00 0.00 H new ATOM 745 N ASP A 928 12.669 2.625 -4.437 1.00 0.00 N ATOM 746 CA ASP A 928 12.210 1.365 -5.011 1.00 0.00 C ATOM 747 C ASP A 928 11.735 1.563 -6.447 1.00 0.00 C ATOM 748 O ASP A 928 11.597 2.693 -6.916 1.00 0.00 O ATOM 749 CB ASP A 928 11.081 0.776 -4.164 1.00 0.00 C ATOM 750 CG ASP A 928 10.591 -0.555 -4.698 1.00 0.00 C ATOM 751 OD1 ASP A 928 11.412 -1.489 -4.811 1.00 0.00 O ATOM 752 OD2 ASP A 928 9.385 -0.663 -5.003 1.00 0.00 O ATOM 0 H ASP A 928 12.222 2.875 -3.555 1.00 0.00 H new ATOM 0 HA ASP A 928 13.050 0.670 -5.018 1.00 0.00 H new ATOM 0 HB2 ASP A 928 11.429 0.647 -3.139 1.00 0.00 H new ATOM 0 HB3 ASP A 928 10.249 1.480 -4.132 1.00 0.00 H new ATOM 757 N HIS A 929 11.488 0.456 -7.141 1.00 0.00 N ATOM 758 CA HIS A 929 11.029 0.508 -8.525 1.00 0.00 C ATOM 759 C HIS A 929 9.511 0.369 -8.599 1.00 0.00 C ATOM 760 O HIS A 929 8.836 1.168 -9.247 1.00 0.00 O ATOM 761 CB HIS A 929 11.695 -0.595 -9.347 1.00 0.00 C ATOM 762 CG HIS A 929 13.174 -0.414 -9.505 1.00 0.00 C ATOM 763 ND1 HIS A 929 13.733 0.646 -10.187 1.00 0.00 N ATOM 764 CD2 HIS A 929 14.210 -1.165 -9.064 1.00 0.00 C ATOM 765 CE1 HIS A 929 15.050 0.538 -10.160 1.00 0.00 C ATOM 766 NE2 HIS A 929 15.365 -0.552 -9.484 1.00 0.00 N ATOM 0 H HIS A 929 11.598 -0.487 -6.768 1.00 0.00 H new ATOM 0 HA HIS A 929 11.308 1.477 -8.939 1.00 0.00 H new ATOM 0 HB2 HIS A 929 11.504 -1.557 -8.872 1.00 0.00 H new ATOM 0 HB3 HIS A 929 11.234 -0.630 -10.334 1.00 0.00 H new ATOM 0 HD2 HIS A 929 14.141 -2.077 -8.489 1.00 0.00 H new ATOM 0 HE1 HIS A 929 15.750 1.224 -10.614 1.00 0.00 H new ATOM 0 HE2 HIS A 929 16.312 -0.885 -9.303 1.00 0.00 H new ATOM 774 N ARG A 930 8.983 -0.652 -7.932 1.00 0.00 N ATOM 775 CA ARG A 930 7.545 -0.897 -7.925 1.00 0.00 C ATOM 776 C ARG A 930 6.772 0.409 -7.770 1.00 0.00 C ATOM 777 O ARG A 930 5.789 0.646 -8.472 1.00 0.00 O ATOM 778 CB ARG A 930 7.177 -1.859 -6.793 1.00 0.00 C ATOM 779 CG ARG A 930 7.895 -3.196 -6.871 1.00 0.00 C ATOM 780 CD ARG A 930 7.974 -3.866 -5.508 1.00 0.00 C ATOM 781 NE ARG A 930 8.022 -5.321 -5.616 1.00 0.00 N ATOM 782 CZ ARG A 930 7.772 -6.142 -4.602 1.00 0.00 C ATOM 783 NH1 ARG A 930 7.457 -5.652 -3.411 1.00 0.00 N ATOM 784 NH2 ARG A 930 7.836 -7.456 -4.778 1.00 0.00 N ATOM 0 H ARG A 930 9.528 -1.322 -7.390 1.00 0.00 H new ATOM 0 HA ARG A 930 7.273 -1.348 -8.879 1.00 0.00 H new ATOM 0 HB2 ARG A 930 7.408 -1.388 -5.838 1.00 0.00 H new ATOM 0 HB3 ARG A 930 6.101 -2.033 -6.811 1.00 0.00 H new ATOM 0 HG2 ARG A 930 7.373 -3.850 -7.570 1.00 0.00 H new ATOM 0 HG3 ARG A 930 8.901 -3.048 -7.264 1.00 0.00 H new ATOM 0 HD2 ARG A 930 8.860 -3.512 -4.981 1.00 0.00 H new ATOM 0 HD3 ARG A 930 7.110 -3.575 -4.910 1.00 0.00 H new ATOM 0 HE ARG A 930 8.261 -5.730 -6.520 1.00 0.00 H new ATOM 0 HH11 ARG A 930 7.406 -4.643 -3.272 1.00 0.00 H new ATOM 0 HH12 ARG A 930 7.265 -6.284 -2.634 1.00 0.00 H new ATOM 0 HH21 ARG A 930 8.077 -7.837 -5.693 1.00 0.00 H new ATOM 0 HH22 ARG A 930 7.644 -8.085 -3.998 1.00 0.00 H new ATOM 798 N TRP A 931 7.221 1.250 -6.846 1.00 0.00 N ATOM 799 CA TRP A 931 6.571 2.532 -6.598 1.00 0.00 C ATOM 800 C TRP A 931 6.027 3.125 -7.893 1.00 0.00 C ATOM 801 O TRP A 931 4.904 3.627 -7.932 1.00 0.00 O ATOM 802 CB TRP A 931 7.553 3.508 -5.949 1.00 0.00 C ATOM 803 CG TRP A 931 7.057 4.923 -5.928 1.00 0.00 C ATOM 804 CD1 TRP A 931 7.165 5.844 -6.931 1.00 0.00 C ATOM 805 CD2 TRP A 931 6.378 5.578 -4.851 1.00 0.00 C ATOM 806 NE1 TRP A 931 6.594 7.031 -6.542 1.00 0.00 N ATOM 807 CE2 TRP A 931 6.104 6.894 -5.271 1.00 0.00 C ATOM 808 CE3 TRP A 931 5.974 5.180 -3.574 1.00 0.00 C ATOM 809 CZ2 TRP A 931 5.445 7.812 -4.457 1.00 0.00 C ATOM 810 CZ3 TRP A 931 5.321 6.092 -2.768 1.00 0.00 C ATOM 811 CH2 TRP A 931 5.060 7.395 -3.212 1.00 0.00 C ATOM 0 H TRP A 931 8.033 1.068 -6.256 1.00 0.00 H new ATOM 0 HA TRP A 931 5.736 2.363 -5.918 1.00 0.00 H new ATOM 0 HB2 TRP A 931 7.753 3.185 -4.927 1.00 0.00 H new ATOM 0 HB3 TRP A 931 8.500 3.470 -6.487 1.00 0.00 H new ATOM 0 HD1 TRP A 931 7.631 5.665 -7.889 1.00 0.00 H new ATOM 0 HE1 TRP A 931 6.543 7.878 -7.108 1.00 0.00 H new ATOM 0 HE3 TRP A 931 6.169 4.177 -3.223 1.00 0.00 H new ATOM 0 HZ2 TRP A 931 5.245 8.818 -4.796 1.00 0.00 H new ATOM 0 HZ3 TRP A 931 5.006 5.796 -1.778 1.00 0.00 H new ATOM 0 HH2 TRP A 931 4.545 8.084 -2.559 1.00 0.00 H new ATOM 822 N GLU A 932 6.829 3.063 -8.951 1.00 0.00 N ATOM 823 CA GLU A 932 6.426 3.595 -10.247 1.00 0.00 C ATOM 824 C GLU A 932 4.956 3.295 -10.526 1.00 0.00 C ATOM 825 O GLU A 932 4.175 4.195 -10.833 1.00 0.00 O ATOM 826 CB GLU A 932 7.298 3.007 -11.359 1.00 0.00 C ATOM 827 CG GLU A 932 8.769 3.365 -11.232 1.00 0.00 C ATOM 828 CD GLU A 932 9.044 4.823 -11.544 1.00 0.00 C ATOM 829 OE1 GLU A 932 8.918 5.660 -10.626 1.00 0.00 O ATOM 830 OE2 GLU A 932 9.385 5.127 -12.706 1.00 0.00 O ATOM 0 H GLU A 932 7.761 2.650 -8.936 1.00 0.00 H new ATOM 0 HA GLU A 932 6.560 4.676 -10.224 1.00 0.00 H new ATOM 0 HB2 GLU A 932 7.195 1.922 -11.355 1.00 0.00 H new ATOM 0 HB3 GLU A 932 6.929 3.358 -12.323 1.00 0.00 H new ATOM 0 HG2 GLU A 932 9.107 3.144 -10.219 1.00 0.00 H new ATOM 0 HG3 GLU A 932 9.351 2.737 -11.906 1.00 0.00 H new ATOM 837 N SER A 933 4.588 2.022 -10.417 1.00 0.00 N ATOM 838 CA SER A 933 3.213 1.601 -10.661 1.00 0.00 C ATOM 839 C SER A 933 2.255 2.285 -9.690 1.00 0.00 C ATOM 840 O SER A 933 1.151 2.677 -10.064 1.00 0.00 O ATOM 841 CB SER A 933 3.092 0.082 -10.530 1.00 0.00 C ATOM 842 OG SER A 933 3.711 -0.379 -9.341 1.00 0.00 O ATOM 0 H SER A 933 5.222 1.265 -10.162 1.00 0.00 H new ATOM 0 HA SER A 933 2.944 1.894 -11.676 1.00 0.00 H new ATOM 0 HB2 SER A 933 2.040 -0.203 -10.530 1.00 0.00 H new ATOM 0 HB3 SER A 933 3.553 -0.398 -11.393 1.00 0.00 H new ATOM 0 HG SER A 933 4.164 0.368 -8.897 1.00 0.00 H new ATOM 848 N GLY A 934 2.687 2.423 -8.440 1.00 0.00 N ATOM 849 CA GLY A 934 1.857 3.059 -7.435 1.00 0.00 C ATOM 850 C GLY A 934 1.388 4.437 -7.856 1.00 0.00 C ATOM 851 O GLY A 934 0.476 5.002 -7.253 1.00 0.00 O ATOM 0 H GLY A 934 3.597 2.106 -8.106 1.00 0.00 H new ATOM 0 HA2 GLY A 934 0.990 2.430 -7.233 1.00 0.00 H new ATOM 0 HA3 GLY A 934 2.417 3.138 -6.503 1.00 0.00 H new ATOM 855 N SER A 935 2.014 4.981 -8.895 1.00 0.00 N ATOM 856 CA SER A 935 1.659 6.305 -9.394 1.00 0.00 C ATOM 857 C SER A 935 0.160 6.400 -9.664 1.00 0.00 C ATOM 858 O SER A 935 -0.486 7.386 -9.308 1.00 0.00 O ATOM 859 CB SER A 935 2.440 6.618 -10.672 1.00 0.00 C ATOM 860 OG SER A 935 2.389 8.002 -10.974 1.00 0.00 O ATOM 0 H SER A 935 2.769 4.526 -9.407 1.00 0.00 H new ATOM 0 HA SER A 935 1.920 7.036 -8.629 1.00 0.00 H new ATOM 0 HB2 SER A 935 3.478 6.306 -10.553 1.00 0.00 H new ATOM 0 HB3 SER A 935 2.028 6.046 -11.503 1.00 0.00 H new ATOM 0 HG SER A 935 2.897 8.177 -11.794 1.00 0.00 H new ATOM 866 N LEU A 936 -0.387 5.367 -10.296 1.00 0.00 N ATOM 867 CA LEU A 936 -1.810 5.332 -10.615 1.00 0.00 C ATOM 868 C LEU A 936 -2.638 5.919 -9.476 1.00 0.00 C ATOM 869 O LEU A 936 -3.521 6.748 -9.699 1.00 0.00 O ATOM 870 CB LEU A 936 -2.254 3.896 -10.896 1.00 0.00 C ATOM 871 CG LEU A 936 -1.863 3.327 -12.261 1.00 0.00 C ATOM 872 CD1 LEU A 936 -1.910 1.807 -12.239 1.00 0.00 C ATOM 873 CD2 LEU A 936 -2.775 3.875 -13.348 1.00 0.00 C ATOM 0 H LEU A 936 0.133 4.543 -10.597 1.00 0.00 H new ATOM 0 HA LEU A 936 -1.973 5.937 -11.507 1.00 0.00 H new ATOM 0 HB2 LEU A 936 -1.838 3.250 -10.123 1.00 0.00 H new ATOM 0 HB3 LEU A 936 -3.339 3.847 -10.802 1.00 0.00 H new ATOM 0 HG LEU A 936 -0.841 3.635 -12.483 1.00 0.00 H new ATOM 0 HD11 LEU A 936 -1.629 1.420 -13.218 1.00 0.00 H new ATOM 0 HD12 LEU A 936 -1.215 1.432 -11.488 1.00 0.00 H new ATOM 0 HD13 LEU A 936 -2.920 1.478 -11.995 1.00 0.00 H new ATOM 0 HD21 LEU A 936 -2.482 3.460 -14.312 1.00 0.00 H new ATOM 0 HD22 LEU A 936 -3.807 3.598 -13.131 1.00 0.00 H new ATOM 0 HD23 LEU A 936 -2.691 4.961 -13.380 1.00 0.00 H new ATOM 885 N LEU A 937 -2.346 5.485 -8.255 1.00 0.00 N ATOM 886 CA LEU A 937 -3.061 5.969 -7.079 1.00 0.00 C ATOM 887 C LEU A 937 -2.858 7.470 -6.898 1.00 0.00 C ATOM 888 O LEU A 937 -2.159 8.110 -7.682 1.00 0.00 O ATOM 889 CB LEU A 937 -2.591 5.224 -5.829 1.00 0.00 C ATOM 890 CG LEU A 937 -2.586 3.698 -5.919 1.00 0.00 C ATOM 891 CD1 LEU A 937 -1.684 3.103 -4.849 1.00 0.00 C ATOM 892 CD2 LEU A 937 -4.001 3.151 -5.791 1.00 0.00 C ATOM 0 H LEU A 937 -1.619 4.799 -8.053 1.00 0.00 H new ATOM 0 HA LEU A 937 -4.124 5.780 -7.228 1.00 0.00 H new ATOM 0 HB2 LEU A 937 -1.581 5.557 -5.590 1.00 0.00 H new ATOM 0 HB3 LEU A 937 -3.229 5.517 -4.995 1.00 0.00 H new ATOM 0 HG LEU A 937 -2.194 3.412 -6.895 1.00 0.00 H new ATOM 0 HD11 LEU A 937 -1.693 2.016 -4.929 1.00 0.00 H new ATOM 0 HD12 LEU A 937 -0.666 3.468 -4.987 1.00 0.00 H new ATOM 0 HD13 LEU A 937 -2.045 3.398 -3.864 1.00 0.00 H new ATOM 0 HD21 LEU A 937 -3.978 2.063 -5.857 1.00 0.00 H new ATOM 0 HD22 LEU A 937 -4.420 3.447 -4.829 1.00 0.00 H new ATOM 0 HD23 LEU A 937 -4.620 3.551 -6.595 1.00 0.00 H new ATOM 904 N GLU A 938 -3.472 8.023 -5.857 1.00 0.00 N ATOM 905 CA GLU A 938 -3.357 9.449 -5.572 1.00 0.00 C ATOM 906 C GLU A 938 -2.845 9.680 -4.153 1.00 0.00 C ATOM 907 O GLU A 938 -3.068 8.863 -3.260 1.00 0.00 O ATOM 908 CB GLU A 938 -4.710 10.140 -5.757 1.00 0.00 C ATOM 909 CG GLU A 938 -5.681 9.892 -4.615 1.00 0.00 C ATOM 910 CD GLU A 938 -7.002 10.612 -4.806 1.00 0.00 C ATOM 911 OE1 GLU A 938 -7.101 11.788 -4.399 1.00 0.00 O ATOM 912 OE2 GLU A 938 -7.936 9.998 -5.363 1.00 0.00 O ATOM 0 H GLU A 938 -4.054 7.506 -5.197 1.00 0.00 H new ATOM 0 HA GLU A 938 -2.640 9.877 -6.273 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -4.549 11.213 -5.860 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -5.161 9.795 -6.687 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -5.865 8.821 -4.525 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -5.226 10.217 -3.679 1.00 0.00 H new ATOM 919 N ARG A 939 -2.158 10.800 -3.954 1.00 0.00 N ATOM 920 CA ARG A 939 -1.613 11.139 -2.645 1.00 0.00 C ATOM 921 C ARG A 939 -2.548 10.679 -1.530 1.00 0.00 C ATOM 922 O ARG A 939 -2.112 10.078 -0.550 1.00 0.00 O ATOM 923 CB ARG A 939 -1.381 12.648 -2.541 1.00 0.00 C ATOM 924 CG ARG A 939 -0.341 13.034 -1.501 1.00 0.00 C ATOM 925 CD ARG A 939 -0.409 14.516 -1.169 1.00 0.00 C ATOM 926 NE ARG A 939 0.211 15.338 -2.204 1.00 0.00 N ATOM 927 CZ ARG A 939 0.381 16.651 -2.095 1.00 0.00 C ATOM 928 NH1 ARG A 939 -0.020 17.287 -1.003 1.00 0.00 N ATOM 929 NH2 ARG A 939 0.953 17.331 -3.081 1.00 0.00 N ATOM 0 H ARG A 939 -1.966 11.488 -4.682 1.00 0.00 H new ATOM 0 HA ARG A 939 -0.660 10.623 -2.532 1.00 0.00 H new ATOM 0 HB2 ARG A 939 -1.068 13.027 -3.514 1.00 0.00 H new ATOM 0 HB3 ARG A 939 -2.325 13.136 -2.298 1.00 0.00 H new ATOM 0 HG2 ARG A 939 -0.497 12.449 -0.594 1.00 0.00 H new ATOM 0 HG3 ARG A 939 0.654 12.788 -1.871 1.00 0.00 H new ATOM 0 HD2 ARG A 939 -1.451 14.812 -1.046 1.00 0.00 H new ATOM 0 HD3 ARG A 939 0.088 14.697 -0.216 1.00 0.00 H new ATOM 0 HE ARG A 939 0.531 14.879 -3.057 1.00 0.00 H new ATOM 0 HH11 ARG A 939 -0.461 16.768 -0.243 1.00 0.00 H new ATOM 0 HH12 ARG A 939 0.112 18.295 -0.923 1.00 0.00 H new ATOM 0 HH21 ARG A 939 1.262 16.845 -3.923 1.00 0.00 H new ATOM 0 HH22 ARG A 939 1.083 18.339 -2.997 1.00 0.00 H new ATOM 943 N GLU A 940 -3.836 10.968 -1.689 1.00 0.00 N ATOM 944 CA GLU A 940 -4.832 10.585 -0.695 1.00 0.00 C ATOM 945 C GLU A 940 -4.829 9.075 -0.476 1.00 0.00 C ATOM 946 O GLU A 940 -4.661 8.602 0.647 1.00 0.00 O ATOM 947 CB GLU A 940 -6.224 11.045 -1.133 1.00 0.00 C ATOM 948 CG GLU A 940 -7.336 10.591 -0.202 1.00 0.00 C ATOM 949 CD GLU A 940 -8.678 11.205 -0.551 1.00 0.00 C ATOM 950 OE1 GLU A 940 -8.722 12.429 -0.799 1.00 0.00 O ATOM 951 OE2 GLU A 940 -9.682 10.464 -0.577 1.00 0.00 O ATOM 0 H GLU A 940 -4.214 11.465 -2.495 1.00 0.00 H new ATOM 0 HA GLU A 940 -4.575 11.072 0.246 1.00 0.00 H new ATOM 0 HB2 GLU A 940 -6.235 12.133 -1.195 1.00 0.00 H new ATOM 0 HB3 GLU A 940 -6.424 10.667 -2.136 1.00 0.00 H new ATOM 0 HG2 GLU A 940 -7.417 9.505 -0.242 1.00 0.00 H new ATOM 0 HG3 GLU A 940 -7.076 10.854 0.823 1.00 0.00 H new ATOM 958 N GLU A 941 -5.017 8.325 -1.558 1.00 0.00 N ATOM 959 CA GLU A 941 -5.037 6.869 -1.483 1.00 0.00 C ATOM 960 C GLU A 941 -3.738 6.337 -0.887 1.00 0.00 C ATOM 961 O GLU A 941 -3.751 5.474 -0.009 1.00 0.00 O ATOM 962 CB GLU A 941 -5.258 6.268 -2.873 1.00 0.00 C ATOM 963 CG GLU A 941 -5.882 4.883 -2.845 1.00 0.00 C ATOM 964 CD GLU A 941 -7.340 4.908 -2.430 1.00 0.00 C ATOM 965 OE1 GLU A 941 -7.742 5.863 -1.732 1.00 0.00 O ATOM 966 OE2 GLU A 941 -8.079 3.973 -2.804 1.00 0.00 O ATOM 0 H GLU A 941 -5.157 8.701 -2.496 1.00 0.00 H new ATOM 0 HA GLU A 941 -5.861 6.575 -0.833 1.00 0.00 H new ATOM 0 HB2 GLU A 941 -5.899 6.934 -3.450 1.00 0.00 H new ATOM 0 HB3 GLU A 941 -4.302 6.216 -3.393 1.00 0.00 H new ATOM 0 HG2 GLU A 941 -5.797 4.430 -3.833 1.00 0.00 H new ATOM 0 HG3 GLU A 941 -5.323 4.251 -2.156 1.00 0.00 H new ATOM 973 N LYS A 942 -2.615 6.858 -1.370 1.00 0.00 N ATOM 974 CA LYS A 942 -1.305 6.437 -0.887 1.00 0.00 C ATOM 975 C LYS A 942 -1.197 6.624 0.623 1.00 0.00 C ATOM 976 O LYS A 942 -0.955 5.669 1.360 1.00 0.00 O ATOM 977 CB LYS A 942 -0.200 7.228 -1.590 1.00 0.00 C ATOM 978 CG LYS A 942 -0.055 6.892 -3.064 1.00 0.00 C ATOM 979 CD LYS A 942 1.106 7.642 -3.695 1.00 0.00 C ATOM 980 CE LYS A 942 1.147 7.439 -5.202 1.00 0.00 C ATOM 981 NZ LYS A 942 -0.080 7.961 -5.866 1.00 0.00 N ATOM 0 H LYS A 942 -2.586 7.573 -2.096 1.00 0.00 H new ATOM 0 HA LYS A 942 -1.185 5.378 -1.114 1.00 0.00 H new ATOM 0 HB2 LYS A 942 -0.406 8.293 -1.487 1.00 0.00 H new ATOM 0 HB3 LYS A 942 0.748 7.037 -1.087 1.00 0.00 H new ATOM 0 HG2 LYS A 942 0.098 5.819 -3.180 1.00 0.00 H new ATOM 0 HG3 LYS A 942 -0.978 7.141 -3.588 1.00 0.00 H new ATOM 0 HD2 LYS A 942 1.018 8.705 -3.472 1.00 0.00 H new ATOM 0 HD3 LYS A 942 2.043 7.301 -3.255 1.00 0.00 H new ATOM 0 HE2 LYS A 942 2.023 7.941 -5.612 1.00 0.00 H new ATOM 0 HE3 LYS A 942 1.255 6.377 -5.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 -0.516 7.206 -6.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 -0.755 8.284 -5.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 0.172 8.758 -6.485 1.00 0.00 H new ATOM 995 N GLU A 943 -1.379 7.861 1.076 1.00 0.00 N ATOM 996 CA GLU A 943 -1.302 8.172 2.499 1.00 0.00 C ATOM 997 C GLU A 943 -2.256 7.291 3.301 1.00 0.00 C ATOM 998 O GLU A 943 -1.858 6.650 4.274 1.00 0.00 O ATOM 999 CB GLU A 943 -1.629 9.647 2.739 1.00 0.00 C ATOM 1000 CG GLU A 943 -1.019 10.206 4.014 1.00 0.00 C ATOM 1001 CD GLU A 943 -1.681 11.495 4.461 1.00 0.00 C ATOM 1002 OE1 GLU A 943 -2.916 11.493 4.651 1.00 0.00 O ATOM 1003 OE2 GLU A 943 -0.965 12.505 4.621 1.00 0.00 O ATOM 0 H GLU A 943 -1.581 8.663 0.479 1.00 0.00 H new ATOM 0 HA GLU A 943 -0.284 7.974 2.834 1.00 0.00 H new ATOM 0 HB2 GLU A 943 -1.275 10.232 1.890 1.00 0.00 H new ATOM 0 HB3 GLU A 943 -2.711 9.768 2.780 1.00 0.00 H new ATOM 0 HG2 GLU A 943 -1.103 9.464 4.808 1.00 0.00 H new ATOM 0 HG3 GLU A 943 0.045 10.384 3.856 1.00 0.00 H new ATOM 1010 N LYS A 944 -3.517 7.264 2.885 1.00 0.00 N ATOM 1011 CA LYS A 944 -4.530 6.462 3.562 1.00 0.00 C ATOM 1012 C LYS A 944 -4.056 5.022 3.737 1.00 0.00 C ATOM 1013 O LYS A 944 -3.989 4.512 4.856 1.00 0.00 O ATOM 1014 CB LYS A 944 -5.841 6.486 2.773 1.00 0.00 C ATOM 1015 CG LYS A 944 -6.709 7.695 3.074 1.00 0.00 C ATOM 1016 CD LYS A 944 -7.641 7.435 4.245 1.00 0.00 C ATOM 1017 CE LYS A 944 -8.800 8.420 4.265 1.00 0.00 C ATOM 1018 NZ LYS A 944 -9.952 7.936 3.454 1.00 0.00 N ATOM 0 H LYS A 944 -3.863 7.789 2.081 1.00 0.00 H new ATOM 0 HA LYS A 944 -4.699 6.893 4.549 1.00 0.00 H new ATOM 0 HB2 LYS A 944 -5.614 6.468 1.707 1.00 0.00 H new ATOM 0 HB3 LYS A 944 -6.405 5.580 2.994 1.00 0.00 H new ATOM 0 HG2 LYS A 944 -6.075 8.553 3.296 1.00 0.00 H new ATOM 0 HG3 LYS A 944 -7.295 7.952 2.192 1.00 0.00 H new ATOM 0 HD2 LYS A 944 -8.028 6.418 4.184 1.00 0.00 H new ATOM 0 HD3 LYS A 944 -7.083 7.509 5.179 1.00 0.00 H new ATOM 0 HE2 LYS A 944 -9.122 8.581 5.294 1.00 0.00 H new ATOM 0 HE3 LYS A 944 -8.465 9.384 3.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 944 -10.722 8.635 3.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 944 -9.651 7.806 2.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 944 -10.288 7.029 3.836 1.00 0.00 H new ATOM 1032 N LEU A 945 -3.727 4.373 2.626 1.00 0.00 N ATOM 1033 CA LEU A 945 -3.257 2.993 2.656 1.00 0.00 C ATOM 1034 C LEU A 945 -2.202 2.800 3.740 1.00 0.00 C ATOM 1035 O LEU A 945 -2.351 1.956 4.624 1.00 0.00 O ATOM 1036 CB LEU A 945 -2.684 2.598 1.294 1.00 0.00 C ATOM 1037 CG LEU A 945 -3.696 2.444 0.159 1.00 0.00 C ATOM 1038 CD1 LEU A 945 -2.999 2.513 -1.191 1.00 0.00 C ATOM 1039 CD2 LEU A 945 -4.461 1.135 0.300 1.00 0.00 C ATOM 0 H LEU A 945 -3.777 4.781 1.692 1.00 0.00 H new ATOM 0 HA LEU A 945 -4.108 2.351 2.885 1.00 0.00 H new ATOM 0 HB2 LEU A 945 -1.950 3.348 1.000 1.00 0.00 H new ATOM 0 HB3 LEU A 945 -2.149 1.655 1.407 1.00 0.00 H new ATOM 0 HG LEU A 945 -4.409 3.267 0.219 1.00 0.00 H new ATOM 0 HD11 LEU A 945 -3.735 2.401 -1.987 1.00 0.00 H new ATOM 0 HD12 LEU A 945 -2.498 3.475 -1.293 1.00 0.00 H new ATOM 0 HD13 LEU A 945 -2.264 1.712 -1.262 1.00 0.00 H new ATOM 0 HD21 LEU A 945 -5.177 1.042 -0.517 1.00 0.00 H new ATOM 0 HD22 LEU A 945 -3.762 0.299 0.266 1.00 0.00 H new ATOM 0 HD23 LEU A 945 -4.993 1.125 1.252 1.00 0.00 H new ATOM 1051 N PHE A 946 -1.136 3.590 3.668 1.00 0.00 N ATOM 1052 CA PHE A 946 -0.055 3.508 4.644 1.00 0.00 C ATOM 1053 C PHE A 946 -0.602 3.571 6.067 1.00 0.00 C ATOM 1054 O PHE A 946 -0.449 2.629 6.844 1.00 0.00 O ATOM 1055 CB PHE A 946 0.949 4.641 4.421 1.00 0.00 C ATOM 1056 CG PHE A 946 1.950 4.782 5.532 1.00 0.00 C ATOM 1057 CD1 PHE A 946 3.123 4.044 5.523 1.00 0.00 C ATOM 1058 CD2 PHE A 946 1.718 5.651 6.585 1.00 0.00 C ATOM 1059 CE1 PHE A 946 4.046 4.171 6.543 1.00 0.00 C ATOM 1060 CE2 PHE A 946 2.638 5.783 7.608 1.00 0.00 C ATOM 1061 CZ PHE A 946 3.803 5.041 7.588 1.00 0.00 C ATOM 0 H PHE A 946 -0.997 4.295 2.944 1.00 0.00 H new ATOM 0 HA PHE A 946 0.451 2.552 4.510 1.00 0.00 H new ATOM 0 HB2 PHE A 946 1.479 4.467 3.485 1.00 0.00 H new ATOM 0 HB3 PHE A 946 0.407 5.580 4.310 1.00 0.00 H new ATOM 0 HD1 PHE A 946 3.318 3.362 4.709 1.00 0.00 H new ATOM 0 HD2 PHE A 946 0.808 6.232 6.607 1.00 0.00 H new ATOM 0 HE1 PHE A 946 4.957 3.591 6.523 1.00 0.00 H new ATOM 0 HE2 PHE A 946 2.446 6.466 8.422 1.00 0.00 H new ATOM 0 HZ PHE A 946 4.522 5.141 8.388 1.00 0.00 H new ATOM 1071 N ASN A 947 -1.240 4.688 6.401 1.00 0.00 N ATOM 1072 CA ASN A 947 -1.809 4.875 7.730 1.00 0.00 C ATOM 1073 C ASN A 947 -2.537 3.616 8.193 1.00 0.00 C ATOM 1074 O ASN A 947 -2.419 3.208 9.347 1.00 0.00 O ATOM 1075 CB ASN A 947 -2.772 6.064 7.734 1.00 0.00 C ATOM 1076 CG ASN A 947 -2.058 7.384 7.953 1.00 0.00 C ATOM 1077 OD1 ASN A 947 -1.761 7.761 9.087 1.00 0.00 O ATOM 1078 ND2 ASN A 947 -1.781 8.094 6.866 1.00 0.00 N ATOM 0 H ASN A 947 -1.376 5.477 5.769 1.00 0.00 H new ATOM 0 HA ASN A 947 -0.991 5.076 8.422 1.00 0.00 H new ATOM 0 HB2 ASN A 947 -3.309 6.097 6.786 1.00 0.00 H new ATOM 0 HB3 ASN A 947 -3.517 5.922 8.517 1.00 0.00 H new ATOM 0 HD21 ASN A 947 -1.303 8.991 6.951 1.00 0.00 H new ATOM 0 HD22 ASN A 947 -2.046 7.742 5.946 1.00 0.00 H new ATOM 1085 N GLU A 948 -3.289 3.006 7.282 1.00 0.00 N ATOM 1086 CA GLU A 948 -4.036 1.794 7.597 1.00 0.00 C ATOM 1087 C GLU A 948 -3.092 0.654 7.968 1.00 0.00 C ATOM 1088 O GLU A 948 -3.295 -0.034 8.969 1.00 0.00 O ATOM 1089 CB GLU A 948 -4.908 1.382 6.408 1.00 0.00 C ATOM 1090 CG GLU A 948 -6.132 2.262 6.217 1.00 0.00 C ATOM 1091 CD GLU A 948 -7.016 2.306 7.448 1.00 0.00 C ATOM 1092 OE1 GLU A 948 -7.337 1.226 7.987 1.00 0.00 O ATOM 1093 OE2 GLU A 948 -7.388 3.420 7.872 1.00 0.00 O ATOM 0 H GLU A 948 -3.397 3.331 6.321 1.00 0.00 H new ATOM 0 HA GLU A 948 -4.677 2.005 8.453 1.00 0.00 H new ATOM 0 HB2 GLU A 948 -4.306 1.410 5.500 1.00 0.00 H new ATOM 0 HB3 GLU A 948 -5.231 0.350 6.545 1.00 0.00 H new ATOM 0 HG2 GLU A 948 -5.812 3.274 5.967 1.00 0.00 H new ATOM 0 HG3 GLU A 948 -6.712 1.893 5.371 1.00 0.00 H new ATOM 1100 N HIS A 949 -2.059 0.460 7.155 1.00 0.00 N ATOM 1101 CA HIS A 949 -1.083 -0.597 7.397 1.00 0.00 C ATOM 1102 C HIS A 949 -0.546 -0.523 8.823 1.00 0.00 C ATOM 1103 O HIS A 949 -0.635 -1.490 9.580 1.00 0.00 O ATOM 1104 CB HIS A 949 0.071 -0.492 6.399 1.00 0.00 C ATOM 1105 CG HIS A 949 1.207 -1.421 6.699 1.00 0.00 C ATOM 1106 ND1 HIS A 949 1.055 -2.787 6.808 1.00 0.00 N ATOM 1107 CD2 HIS A 949 2.521 -1.172 6.911 1.00 0.00 C ATOM 1108 CE1 HIS A 949 2.225 -3.338 7.076 1.00 0.00 C ATOM 1109 NE2 HIS A 949 3.131 -2.380 7.144 1.00 0.00 N ATOM 0 H HIS A 949 -1.876 1.021 6.323 1.00 0.00 H new ATOM 0 HA HIS A 949 -1.582 -1.557 7.264 1.00 0.00 H new ATOM 0 HB2 HIS A 949 -0.305 -0.702 5.398 1.00 0.00 H new ATOM 0 HB3 HIS A 949 0.442 0.533 6.392 1.00 0.00 H new ATOM 0 HD2 HIS A 949 3.000 -0.204 6.899 1.00 0.00 H new ATOM 0 HE1 HIS A 949 2.409 -4.393 7.216 1.00 0.00 H new ATOM 0 HE2 HIS A 949 4.123 -2.515 7.338 1.00 0.00 H new ATOM 1117 N ILE A 950 0.011 0.628 9.182 1.00 0.00 N ATOM 1118 CA ILE A 950 0.561 0.827 10.517 1.00 0.00 C ATOM 1119 C ILE A 950 -0.470 0.498 11.591 1.00 0.00 C ATOM 1120 O ILE A 950 -0.218 -0.318 12.477 1.00 0.00 O ATOM 1121 CB ILE A 950 1.049 2.274 10.715 1.00 0.00 C ATOM 1122 CG1 ILE A 950 2.080 2.639 9.645 1.00 0.00 C ATOM 1123 CG2 ILE A 950 1.638 2.449 12.107 1.00 0.00 C ATOM 1124 CD1 ILE A 950 3.151 1.588 9.454 1.00 0.00 C ATOM 0 H ILE A 950 0.093 1.437 8.567 1.00 0.00 H new ATOM 0 HA ILE A 950 1.410 0.150 10.613 1.00 0.00 H new ATOM 0 HB ILE A 950 0.196 2.946 10.615 1.00 0.00 H new ATOM 0 HG12 ILE A 950 1.567 2.799 8.697 1.00 0.00 H new ATOM 0 HG13 ILE A 950 2.553 3.583 9.915 1.00 0.00 H new ATOM 0 HG21 ILE A 950 1.978 3.477 12.231 1.00 0.00 H new ATOM 0 HG22 ILE A 950 0.877 2.226 12.855 1.00 0.00 H new ATOM 0 HG23 ILE A 950 2.481 1.770 12.233 1.00 0.00 H new ATOM 0 HD11 ILE A 950 3.847 1.914 8.681 1.00 0.00 H new ATOM 0 HD12 ILE A 950 3.690 1.444 10.390 1.00 0.00 H new ATOM 0 HD13 ILE A 950 2.689 0.648 9.153 1.00 0.00 H new ATOM 1136 N GLU A 951 -1.632 1.138 11.504 1.00 0.00 N ATOM 1137 CA GLU A 951 -2.702 0.912 12.469 1.00 0.00 C ATOM 1138 C GLU A 951 -2.979 -0.580 12.635 1.00 0.00 C ATOM 1139 O GLU A 951 -3.405 -1.028 13.699 1.00 0.00 O ATOM 1140 CB GLU A 951 -3.977 1.633 12.028 1.00 0.00 C ATOM 1141 CG GLU A 951 -3.973 3.120 12.338 1.00 0.00 C ATOM 1142 CD GLU A 951 -4.327 3.416 13.782 1.00 0.00 C ATOM 1143 OE1 GLU A 951 -5.457 3.081 14.196 1.00 0.00 O ATOM 1144 OE2 GLU A 951 -3.476 3.984 14.498 1.00 0.00 O ATOM 0 H GLU A 951 -1.856 1.816 10.776 1.00 0.00 H new ATOM 0 HA GLU A 951 -2.381 1.313 13.430 1.00 0.00 H new ATOM 0 HB2 GLU A 951 -4.110 1.494 10.955 1.00 0.00 H new ATOM 0 HB3 GLU A 951 -4.834 1.171 12.518 1.00 0.00 H new ATOM 0 HG2 GLU A 951 -2.987 3.530 12.118 1.00 0.00 H new ATOM 0 HG3 GLU A 951 -4.682 3.626 11.683 1.00 0.00 H new ATOM 1151 N ALA A 952 -2.734 -1.342 11.574 1.00 0.00 N ATOM 1152 CA ALA A 952 -2.955 -2.783 11.602 1.00 0.00 C ATOM 1153 C ALA A 952 -1.861 -3.491 12.393 1.00 0.00 C ATOM 1154 O ALA A 952 -2.141 -4.216 13.348 1.00 0.00 O ATOM 1155 CB ALA A 952 -3.026 -3.333 10.185 1.00 0.00 C ATOM 0 H ALA A 952 -2.383 -0.986 10.685 1.00 0.00 H new ATOM 0 HA ALA A 952 -3.906 -2.971 12.101 1.00 0.00 H new ATOM 0 HB1 ALA A 952 -3.191 -4.410 10.221 1.00 0.00 H new ATOM 0 HB2 ALA A 952 -3.848 -2.857 9.651 1.00 0.00 H new ATOM 0 HB3 ALA A 952 -2.089 -3.127 9.667 1.00 0.00 H new ATOM 1161 N LEU A 953 -0.613 -3.279 11.988 1.00 0.00 N ATOM 1162 CA LEU A 953 0.525 -3.898 12.659 1.00 0.00 C ATOM 1163 C LEU A 953 0.445 -3.691 14.168 1.00 0.00 C ATOM 1164 O LEU A 953 0.851 -4.555 14.947 1.00 0.00 O ATOM 1165 CB LEU A 953 1.835 -3.320 12.122 1.00 0.00 C ATOM 1166 CG LEU A 953 2.097 -3.527 10.629 1.00 0.00 C ATOM 1167 CD1 LEU A 953 3.343 -2.768 10.197 1.00 0.00 C ATOM 1168 CD2 LEU A 953 2.236 -5.008 10.312 1.00 0.00 C ATOM 0 H LEU A 953 -0.364 -2.683 11.198 1.00 0.00 H new ATOM 0 HA LEU A 953 0.497 -4.968 12.456 1.00 0.00 H new ATOM 0 HB2 LEU A 953 1.848 -2.250 12.328 1.00 0.00 H new ATOM 0 HB3 LEU A 953 2.660 -3.762 12.680 1.00 0.00 H new ATOM 0 HG LEU A 953 1.246 -3.136 10.072 1.00 0.00 H new ATOM 0 HD11 LEU A 953 3.515 -2.926 9.132 1.00 0.00 H new ATOM 0 HD12 LEU A 953 3.205 -1.704 10.388 1.00 0.00 H new ATOM 0 HD13 LEU A 953 4.203 -3.129 10.761 1.00 0.00 H new ATOM 0 HD21 LEU A 953 2.422 -5.136 9.246 1.00 0.00 H new ATOM 0 HD22 LEU A 953 3.069 -5.425 10.878 1.00 0.00 H new ATOM 0 HD23 LEU A 953 1.317 -5.526 10.585 1.00 0.00 H new ATOM 1180 N THR A 954 -0.081 -2.540 14.576 1.00 0.00 N ATOM 1181 CA THR A 954 -0.215 -2.220 15.992 1.00 0.00 C ATOM 1182 C THR A 954 -1.401 -2.950 16.611 1.00 0.00 C ATOM 1183 O THR A 954 -1.239 -3.751 17.532 1.00 0.00 O ATOM 1184 CB THR A 954 -0.387 -0.705 16.211 1.00 0.00 C ATOM 1185 OG1 THR A 954 -1.439 -0.206 15.376 1.00 0.00 O ATOM 1186 CG2 THR A 954 0.905 0.037 15.905 1.00 0.00 C ATOM 0 H THR A 954 -0.421 -1.814 13.946 1.00 0.00 H new ATOM 0 HA THR A 954 0.703 -2.548 16.479 1.00 0.00 H new ATOM 0 HB THR A 954 -0.643 -0.538 17.257 1.00 0.00 H new ATOM 0 HG1 THR A 954 -1.543 0.757 15.522 1.00 0.00 H new ATOM 0 HG21 THR A 954 0.758 1.105 16.067 1.00 0.00 H new ATOM 0 HG22 THR A 954 1.696 -0.324 16.562 1.00 0.00 H new ATOM 0 HG23 THR A 954 1.187 -0.137 14.867 1.00 0.00 H new ATOM 1194 N LYS A 955 -2.595 -2.669 16.100 1.00 0.00 N ATOM 1195 CA LYS A 955 -3.810 -3.301 16.601 1.00 0.00 C ATOM 1196 C LYS A 955 -3.588 -4.790 16.846 1.00 0.00 C ATOM 1197 O LYS A 955 -3.780 -5.282 17.958 1.00 0.00 O ATOM 1198 CB LYS A 955 -4.959 -3.102 15.610 1.00 0.00 C ATOM 1199 CG LYS A 955 -6.335 -3.196 16.246 1.00 0.00 C ATOM 1200 CD LYS A 955 -7.387 -2.490 15.407 1.00 0.00 C ATOM 1201 CE LYS A 955 -8.601 -2.109 16.241 1.00 0.00 C ATOM 1202 NZ LYS A 955 -9.789 -1.822 15.390 1.00 0.00 N ATOM 0 H LYS A 955 -2.747 -2.007 15.339 1.00 0.00 H new ATOM 0 HA LYS A 955 -4.070 -2.830 17.549 1.00 0.00 H new ATOM 0 HB2 LYS A 955 -4.853 -2.126 15.136 1.00 0.00 H new ATOM 0 HB3 LYS A 955 -4.881 -3.850 14.821 1.00 0.00 H new ATOM 0 HG2 LYS A 955 -6.609 -4.244 16.369 1.00 0.00 H new ATOM 0 HG3 LYS A 955 -6.307 -2.755 17.242 1.00 0.00 H new ATOM 0 HD2 LYS A 955 -6.956 -1.594 14.959 1.00 0.00 H new ATOM 0 HD3 LYS A 955 -7.696 -3.139 14.588 1.00 0.00 H new ATOM 0 HE2 LYS A 955 -8.836 -2.919 16.932 1.00 0.00 H new ATOM 0 HE3 LYS A 955 -8.366 -1.233 16.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 955 -10.596 -1.566 15.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 955 -9.574 -1.033 14.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 955 -10.029 -2.666 14.832 1.00 0.00 H new ATOM 1216 N LYS A 956 -3.182 -5.503 15.801 1.00 0.00 N ATOM 1217 CA LYS A 956 -2.931 -6.935 15.902 1.00 0.00 C ATOM 1218 C LYS A 956 -2.104 -7.256 17.143 1.00 0.00 C ATOM 1219 O LYS A 956 -2.508 -8.065 17.979 1.00 0.00 O ATOM 1220 CB LYS A 956 -2.207 -7.437 14.650 1.00 0.00 C ATOM 1221 CG LYS A 956 -2.501 -8.890 14.319 1.00 0.00 C ATOM 1222 CD LYS A 956 -3.747 -9.026 13.460 1.00 0.00 C ATOM 1223 CE LYS A 956 -4.190 -10.476 13.347 1.00 0.00 C ATOM 1224 NZ LYS A 956 -5.515 -10.600 12.679 1.00 0.00 N ATOM 0 H LYS A 956 -3.020 -5.111 14.873 1.00 0.00 H new ATOM 0 HA LYS A 956 -3.892 -7.442 15.986 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -2.492 -6.815 13.802 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -1.133 -7.315 14.788 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -1.649 -9.325 13.797 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -2.631 -9.455 15.242 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -4.553 -8.431 13.889 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -3.550 -8.626 12.465 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -3.446 -11.041 12.785 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -4.242 -10.919 14.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -5.782 -11.603 12.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -6.231 -10.083 13.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -5.459 -10.201 11.720 1.00 0.00 H new ATOM 1238 N LYS A 957 -0.945 -6.617 17.257 1.00 0.00 N ATOM 1239 CA LYS A 957 -0.061 -6.832 18.397 1.00 0.00 C ATOM 1240 C LYS A 957 -0.816 -6.656 19.711 1.00 0.00 C ATOM 1241 O LYS A 957 -1.188 -5.542 20.080 1.00 0.00 O ATOM 1242 CB LYS A 957 1.121 -5.862 18.342 1.00 0.00 C ATOM 1243 CG LYS A 957 2.382 -6.402 18.995 1.00 0.00 C ATOM 1244 CD LYS A 957 3.574 -5.496 18.739 1.00 0.00 C ATOM 1245 CE LYS A 957 4.835 -6.035 19.397 1.00 0.00 C ATOM 1246 NZ LYS A 957 5.959 -5.061 19.323 1.00 0.00 N ATOM 0 H LYS A 957 -0.595 -5.945 16.574 1.00 0.00 H new ATOM 0 HA LYS A 957 0.313 -7.854 18.347 1.00 0.00 H new ATOM 0 HB2 LYS A 957 1.335 -5.622 17.301 1.00 0.00 H new ATOM 0 HB3 LYS A 957 0.839 -4.930 18.832 1.00 0.00 H new ATOM 0 HG2 LYS A 957 2.223 -6.501 20.069 1.00 0.00 H new ATOM 0 HG3 LYS A 957 2.593 -7.400 18.611 1.00 0.00 H new ATOM 0 HD2 LYS A 957 3.735 -5.400 17.665 1.00 0.00 H new ATOM 0 HD3 LYS A 957 3.362 -4.497 19.120 1.00 0.00 H new ATOM 0 HE2 LYS A 957 4.627 -6.271 20.441 1.00 0.00 H new ATOM 0 HE3 LYS A 957 5.128 -6.966 18.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 957 6.800 -5.466 19.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 957 6.174 -4.854 18.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 957 5.689 -4.182 19.808 1.00 0.00 H new ATOM 1260 N ARG A 958 -1.038 -7.762 20.414 1.00 0.00 N ATOM 1261 CA ARG A 958 -1.748 -7.730 21.687 1.00 0.00 C ATOM 1262 C ARG A 958 -1.057 -8.618 22.717 1.00 0.00 C ATOM 1263 O ARG A 958 -0.981 -9.835 22.550 1.00 0.00 O ATOM 1264 CB ARG A 958 -3.197 -8.181 21.498 1.00 0.00 C ATOM 1265 CG ARG A 958 -4.105 -7.097 20.941 1.00 0.00 C ATOM 1266 CD ARG A 958 -4.740 -6.276 22.052 1.00 0.00 C ATOM 1267 NE ARG A 958 -5.700 -5.305 21.535 1.00 0.00 N ATOM 1268 CZ ARG A 958 -6.129 -4.255 22.227 1.00 0.00 C ATOM 1269 NH1 ARG A 958 -5.686 -4.043 23.459 1.00 0.00 N ATOM 1270 NH2 ARG A 958 -7.004 -3.416 21.688 1.00 0.00 N ATOM 0 H ARG A 958 -0.736 -8.692 20.123 1.00 0.00 H new ATOM 0 HA ARG A 958 -1.739 -6.704 22.054 1.00 0.00 H new ATOM 0 HB2 ARG A 958 -3.217 -9.040 20.827 1.00 0.00 H new ATOM 0 HB3 ARG A 958 -3.592 -8.517 22.457 1.00 0.00 H new ATOM 0 HG2 ARG A 958 -3.531 -6.442 20.286 1.00 0.00 H new ATOM 0 HG3 ARG A 958 -4.886 -7.553 20.332 1.00 0.00 H new ATOM 0 HD2 ARG A 958 -5.241 -6.942 22.754 1.00 0.00 H new ATOM 0 HD3 ARG A 958 -3.961 -5.755 22.608 1.00 0.00 H new ATOM 0 HE ARG A 958 -6.061 -5.440 20.591 1.00 0.00 H new ATOM 0 HH11 ARG A 958 -5.014 -4.687 23.877 1.00 0.00 H new ATOM 0 HH12 ARG A 958 -6.017 -3.236 23.988 1.00 0.00 H new ATOM 0 HH21 ARG A 958 -7.348 -3.577 20.741 1.00 0.00 H new ATOM 0 HH22 ARG A 958 -7.333 -2.610 22.220 1.00 0.00 H new ATOM 1284 N GLU A 959 -0.555 -8.000 23.782 1.00 0.00 N ATOM 1285 CA GLU A 959 0.130 -8.735 24.838 1.00 0.00 C ATOM 1286 C GLU A 959 -0.870 -9.463 25.732 1.00 0.00 C ATOM 1287 O GLU A 959 -1.341 -8.915 26.729 1.00 0.00 O ATOM 1288 CB GLU A 959 0.986 -7.785 25.679 1.00 0.00 C ATOM 1289 CG GLU A 959 2.140 -7.164 24.911 1.00 0.00 C ATOM 1290 CD GLU A 959 3.066 -8.202 24.308 1.00 0.00 C ATOM 1291 OE1 GLU A 959 2.679 -8.830 23.300 1.00 0.00 O ATOM 1292 OE2 GLU A 959 4.178 -8.387 24.845 1.00 0.00 O ATOM 0 H GLU A 959 -0.610 -6.993 23.936 1.00 0.00 H new ATOM 0 HA GLU A 959 0.777 -9.476 24.368 1.00 0.00 H new ATOM 0 HB2 GLU A 959 0.352 -6.990 26.072 1.00 0.00 H new ATOM 0 HB3 GLU A 959 1.382 -8.329 26.536 1.00 0.00 H new ATOM 0 HG2 GLU A 959 1.744 -6.531 24.117 1.00 0.00 H new ATOM 0 HG3 GLU A 959 2.710 -6.518 25.579 1.00 0.00 H new ATOM 1299 N SER A 960 -1.191 -10.700 25.368 1.00 0.00 N ATOM 1300 CA SER A 960 -2.138 -11.501 26.133 1.00 0.00 C ATOM 1301 C SER A 960 -2.077 -12.966 25.711 1.00 0.00 C ATOM 1302 O SER A 960 -1.790 -13.279 24.556 1.00 0.00 O ATOM 1303 CB SER A 960 -3.559 -10.965 25.948 1.00 0.00 C ATOM 1304 OG SER A 960 -3.978 -11.084 24.599 1.00 0.00 O ATOM 0 H SER A 960 -0.809 -11.169 24.547 1.00 0.00 H new ATOM 0 HA SER A 960 -1.865 -11.432 27.186 1.00 0.00 H new ATOM 0 HB2 SER A 960 -4.245 -11.513 26.595 1.00 0.00 H new ATOM 0 HB3 SER A 960 -3.599 -9.919 26.254 1.00 0.00 H new ATOM 0 HG SER A 960 -4.890 -10.736 24.508 1.00 0.00 H new ATOM 1310 N GLY A 961 -2.348 -13.860 26.656 1.00 0.00 N ATOM 1311 CA GLY A 961 -2.319 -15.281 26.364 1.00 0.00 C ATOM 1312 C GLY A 961 -3.702 -15.901 26.355 1.00 0.00 C ATOM 1313 O GLY A 961 -4.660 -15.339 26.886 1.00 0.00 O ATOM 0 H GLY A 961 -2.587 -13.626 27.619 1.00 0.00 H new ATOM 0 HA2 GLY A 961 -1.847 -15.440 25.394 1.00 0.00 H new ATOM 0 HA3 GLY A 961 -1.702 -15.788 27.106 1.00 0.00 H new ATOM 1317 N PRO A 962 -3.820 -17.085 25.738 1.00 0.00 N ATOM 1318 CA PRO A 962 -5.093 -17.806 25.645 1.00 0.00 C ATOM 1319 C PRO A 962 -5.549 -18.353 26.994 1.00 0.00 C ATOM 1320 O PRO A 962 -4.867 -19.178 27.602 1.00 0.00 O ATOM 1321 CB PRO A 962 -4.782 -18.953 24.681 1.00 0.00 C ATOM 1322 CG PRO A 962 -3.313 -19.167 24.807 1.00 0.00 C ATOM 1323 CD PRO A 962 -2.720 -17.813 25.082 1.00 0.00 C ATOM 0 HA PRO A 962 -5.904 -17.159 25.311 1.00 0.00 H new ATOM 0 HB2 PRO A 962 -5.337 -19.853 24.945 1.00 0.00 H new ATOM 0 HB3 PRO A 962 -5.058 -18.696 23.658 1.00 0.00 H new ATOM 0 HG2 PRO A 962 -3.088 -19.863 25.615 1.00 0.00 H new ATOM 0 HG3 PRO A 962 -2.901 -19.595 23.893 1.00 0.00 H new ATOM 0 HD2 PRO A 962 -1.843 -17.882 25.726 1.00 0.00 H new ATOM 0 HD3 PRO A 962 -2.403 -17.319 24.163 1.00 0.00 H new ATOM 1331 N SER A 963 -6.705 -17.889 27.456 1.00 0.00 N ATOM 1332 CA SER A 963 -7.250 -18.329 28.734 1.00 0.00 C ATOM 1333 C SER A 963 -7.203 -19.850 28.850 1.00 0.00 C ATOM 1334 O SER A 963 -6.672 -20.393 29.819 1.00 0.00 O ATOM 1335 CB SER A 963 -8.691 -17.839 28.895 1.00 0.00 C ATOM 1336 OG SER A 963 -8.741 -16.426 28.986 1.00 0.00 O ATOM 0 H SER A 963 -7.283 -17.208 26.964 1.00 0.00 H new ATOM 0 HA SER A 963 -6.638 -17.902 29.528 1.00 0.00 H new ATOM 0 HB2 SER A 963 -9.289 -18.174 28.047 1.00 0.00 H new ATOM 0 HB3 SER A 963 -9.131 -18.280 29.789 1.00 0.00 H new ATOM 0 HG SER A 963 -9.672 -16.137 29.087 1.00 0.00 H new ATOM 1342 N SER A 964 -7.762 -20.531 27.855 1.00 0.00 N ATOM 1343 CA SER A 964 -7.787 -21.989 27.846 1.00 0.00 C ATOM 1344 C SER A 964 -8.056 -22.536 29.244 1.00 0.00 C ATOM 1345 O SER A 964 -7.432 -23.505 29.675 1.00 0.00 O ATOM 1346 CB SER A 964 -6.462 -22.540 27.316 1.00 0.00 C ATOM 1347 OG SER A 964 -5.427 -22.385 28.271 1.00 0.00 O ATOM 0 H SER A 964 -8.204 -20.097 27.045 1.00 0.00 H new ATOM 0 HA SER A 964 -8.594 -22.310 27.188 1.00 0.00 H new ATOM 0 HB2 SER A 964 -6.577 -23.595 27.067 1.00 0.00 H new ATOM 0 HB3 SER A 964 -6.192 -22.023 26.395 1.00 0.00 H new ATOM 0 HG SER A 964 -5.698 -21.725 28.943 1.00 0.00 H new ATOM 1353 N GLY A 965 -8.991 -21.907 29.950 1.00 0.00 N ATOM 1354 CA GLY A 965 -9.327 -22.344 31.293 1.00 0.00 C ATOM 1355 C GLY A 965 -10.307 -23.500 31.298 1.00 0.00 C ATOM 1356 O GLY A 965 -10.903 -23.822 30.270 1.00 0.00 O ATOM 0 H GLY A 965 -9.522 -21.103 29.616 1.00 0.00 H new ATOM 0 HA2 GLY A 965 -8.417 -22.641 31.814 1.00 0.00 H new ATOM 0 HA3 GLY A 965 -9.753 -21.508 31.848 1.00 0.00 H new TER 1360 GLY A 965