USER MOD reduce.3.24.130724 H: found=0, std=0, add=416, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 415 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 942 HIS : no HE2:sc= -4.13! C(o=-4!,f=-7.8!) USER MOD Set 1.2: A 948 GLN : amide:sc= 0.165 K(o=-4,f=-6.4) USER MOD Single : A 912 SER OG : rot 180:sc= 0 USER MOD Single : A 913 SER OG : rot 180:sc= 0 USER MOD Single : A 916 GLN : amide:sc= 0.433 X(o=0.43,f=-0.031) USER MOD Single : A 917 THR OG1 : rot 180:sc= 0 USER MOD Single : A 921 MET CE :methyl 163:sc= -0.0999 (180deg=-0.768) USER MOD Single : A 923 HIS : no HD1:sc= -1.27 X(o=-1.3,f=-0.8) USER MOD Single : A 927 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 930 CYS SG : rot 180:sc= 0 USER MOD Single : A 933 GLN : amide:sc= -0.0887 X(o=-0.089,f=-0.42) USER MOD Single : A 935 ASN : amide:sc= -3.93 K(o=-3.9,f=-6.8!) USER MOD Single : A 940 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.266) USER MOD Single : A 941 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 943 ASN : amide:sc= 0 X(o=0,f=-0.0051) USER MOD Single : A 944 TYR OH : rot 180:sc= 0 USER MOD Single : A 945 ASN : amide:sc= -1.74 K(o=-1.7,f=-0.85) USER MOD Single : A 951 THR OG1 : rot 86:sc= 0.934 USER MOD Single : A 955 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 957 ASN : amide:sc= -0.183 K(o=-0.18,f=-0.92) USER MOD Single : A 958 ASN : amide:sc= 0 X(o=0,f=-0.0031) USER MOD Single : A 959 ASN : amide:sc= -1.99 K(o=-2,f=-3.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 908 2.912 -3.402 -8.249 1.00 3.30 N ATOM 2 CA GLY A 908 2.034 -2.267 -8.468 1.00 64.23 C ATOM 3 C GLY A 908 0.839 -2.271 -7.537 1.00 14.14 C ATOM 4 O GLY A 908 -0.302 -2.468 -7.956 1.00 62.54 O ATOM 0 HA2 GLY A 908 2.597 -1.344 -8.328 1.00 64.23 H new ATOM 0 HA3 GLY A 908 1.686 -2.275 -9.501 1.00 64.23 H new ATOM 8 N PRO A 909 1.094 -2.050 -6.239 1.00 2.24 N ATOM 9 CA PRO A 909 0.042 -2.025 -5.218 1.00 4.42 C ATOM 10 C PRO A 909 -0.863 -0.805 -5.348 1.00 41.53 C ATOM 11 O PRO A 909 -2.065 -0.881 -5.092 1.00 13.42 O ATOM 12 CB PRO A 909 0.825 -1.972 -3.903 1.00 40.34 C ATOM 13 CG PRO A 909 2.132 -1.354 -4.265 1.00 54.10 C ATOM 14 CD PRO A 909 2.430 -1.807 -5.668 1.00 14.24 C ATOM 0 HA PRO A 909 -0.625 -2.883 -5.299 1.00 4.42 H new ATOM 0 HB2 PRO A 909 0.301 -1.379 -3.154 1.00 40.34 H new ATOM 0 HB3 PRO A 909 0.961 -2.968 -3.483 1.00 40.34 H new ATOM 0 HG2 PRO A 909 2.078 -0.267 -4.209 1.00 54.10 H new ATOM 0 HG3 PRO A 909 2.917 -1.670 -3.578 1.00 54.10 H new ATOM 0 HD2 PRO A 909 2.974 -1.047 -6.229 1.00 14.24 H new ATOM 0 HD3 PRO A 909 3.041 -2.709 -5.678 1.00 14.24 H new ATOM 22 N LEU A 910 -0.279 0.319 -5.749 1.00 1.54 N ATOM 23 CA LEU A 910 -1.034 1.557 -5.914 1.00 24.11 C ATOM 24 C LEU A 910 -0.894 2.095 -7.334 1.00 64.44 C ATOM 25 O LEU A 910 -1.000 3.298 -7.567 1.00 23.01 O ATOM 26 CB LEU A 910 -0.556 2.607 -4.910 1.00 25.05 C ATOM 27 CG LEU A 910 -1.025 2.418 -3.467 1.00 2.25 C ATOM 28 CD1 LEU A 910 -0.086 1.485 -2.718 1.00 33.32 C ATOM 29 CD2 LEU A 910 -1.122 3.761 -2.757 1.00 51.13 C ATOM 0 H LEU A 910 0.714 0.399 -5.966 1.00 1.54 H new ATOM 0 HA LEU A 910 -2.086 1.339 -5.730 1.00 24.11 H new ATOM 0 HB2 LEU A 910 0.534 2.619 -4.918 1.00 25.05 H new ATOM 0 HB3 LEU A 910 -0.888 3.587 -5.253 1.00 25.05 H new ATOM 0 HG LEU A 910 -2.017 1.966 -3.484 1.00 2.25 H new ATOM 0 HD11 LEU A 910 -0.436 1.363 -1.693 1.00 33.32 H new ATOM 0 HD12 LEU A 910 -0.066 0.514 -3.213 1.00 33.32 H new ATOM 0 HD13 LEU A 910 0.918 1.909 -2.710 1.00 33.32 H new ATOM 0 HD21 LEU A 910 -1.457 3.607 -1.731 1.00 51.13 H new ATOM 0 HD22 LEU A 910 -0.143 4.241 -2.751 1.00 51.13 H new ATOM 0 HD23 LEU A 910 -1.835 4.398 -3.280 1.00 51.13 H new ATOM 41 N GLY A 911 -0.656 1.193 -8.282 1.00 74.15 N ATOM 42 CA GLY A 911 -0.508 1.596 -9.669 1.00 20.42 C ATOM 43 C GLY A 911 0.926 1.499 -10.150 1.00 41.02 C ATOM 44 O GLY A 911 1.848 1.345 -9.349 1.00 50.41 O ATOM 0 H GLY A 911 -0.563 0.191 -8.114 1.00 74.15 H new ATOM 0 HA2 GLY A 911 -1.142 0.969 -10.296 1.00 20.42 H new ATOM 0 HA3 GLY A 911 -0.859 2.621 -9.786 1.00 20.42 H new ATOM 48 N SER A 912 1.115 1.588 -11.463 1.00 23.41 N ATOM 49 CA SER A 912 2.447 1.504 -12.051 1.00 21.43 C ATOM 50 C SER A 912 2.635 2.571 -13.125 1.00 22.23 C ATOM 51 O SER A 912 1.686 3.254 -13.509 1.00 63.04 O ATOM 52 CB SER A 912 2.677 0.115 -12.650 1.00 34.21 C ATOM 53 OG SER A 912 2.661 -0.883 -11.644 1.00 73.52 O ATOM 0 H SER A 912 0.363 1.718 -12.139 1.00 23.41 H new ATOM 0 HA SER A 912 3.177 1.676 -11.261 1.00 21.43 H new ATOM 0 HB2 SER A 912 1.905 -0.098 -13.390 1.00 34.21 H new ATOM 0 HB3 SER A 912 3.634 0.094 -13.172 1.00 34.21 H new ATOM 0 HG SER A 912 2.809 -1.762 -12.052 1.00 73.52 H new ATOM 59 N SER A 913 3.867 2.708 -13.605 1.00 22.34 N ATOM 60 CA SER A 913 4.182 3.694 -14.632 1.00 22.24 C ATOM 61 C SER A 913 4.808 3.026 -15.852 1.00 71.13 C ATOM 62 O SER A 913 6.030 2.959 -15.978 1.00 2.25 O ATOM 63 CB SER A 913 5.132 4.756 -14.074 1.00 71.04 C ATOM 64 OG SER A 913 4.863 5.014 -12.707 1.00 62.41 O ATOM 0 H SER A 913 4.663 2.149 -13.299 1.00 22.34 H new ATOM 0 HA SER A 913 3.252 4.173 -14.939 1.00 22.24 H new ATOM 0 HB2 SER A 913 6.163 4.422 -14.188 1.00 71.04 H new ATOM 0 HB3 SER A 913 5.030 5.677 -14.648 1.00 71.04 H new ATOM 0 HG SER A 913 5.485 5.695 -12.374 1.00 62.41 H new ATOM 70 N GLU A 914 3.960 2.533 -16.749 1.00 54.13 N ATOM 71 CA GLU A 914 4.429 1.869 -17.960 1.00 2.42 C ATOM 72 C GLU A 914 5.322 2.798 -18.778 1.00 22.12 C ATOM 73 O GLU A 914 6.143 2.344 -19.575 1.00 22.31 O ATOM 74 CB GLU A 914 3.242 1.408 -18.808 1.00 23.40 C ATOM 75 CG GLU A 914 3.649 0.716 -20.098 1.00 70.13 C ATOM 76 CD GLU A 914 2.519 -0.089 -20.710 1.00 31.43 C ATOM 77 OE1 GLU A 914 1.437 0.490 -20.942 1.00 71.42 O ATOM 78 OE2 GLU A 914 2.716 -1.298 -20.955 1.00 51.34 O ATOM 0 H GLU A 914 2.945 2.581 -16.660 1.00 54.13 H new ATOM 0 HA GLU A 914 5.014 0.998 -17.663 1.00 2.42 H new ATOM 0 HB2 GLU A 914 2.628 0.727 -18.219 1.00 23.40 H new ATOM 0 HB3 GLU A 914 2.621 2.271 -19.049 1.00 23.40 H new ATOM 0 HG2 GLU A 914 3.988 1.463 -20.816 1.00 70.13 H new ATOM 0 HG3 GLU A 914 4.495 0.057 -19.901 1.00 70.13 H new ATOM 85 N ASP A 915 5.155 4.100 -18.575 1.00 0.04 N ATOM 86 CA ASP A 915 5.946 5.093 -19.292 1.00 55.52 C ATOM 87 C ASP A 915 7.436 4.788 -19.178 1.00 12.25 C ATOM 88 O ASP A 915 8.213 5.095 -20.081 1.00 54.42 O ATOM 89 CB ASP A 915 5.656 6.494 -18.751 1.00 41.40 C ATOM 90 CG ASP A 915 6.177 7.587 -19.664 1.00 61.21 C ATOM 91 OD1 ASP A 915 5.699 7.677 -20.814 1.00 40.34 O ATOM 92 OD2 ASP A 915 7.062 8.352 -19.228 1.00 64.20 O ATOM 0 H ASP A 915 4.479 4.492 -17.920 1.00 0.04 H new ATOM 0 HA ASP A 915 5.666 5.053 -20.345 1.00 55.52 H new ATOM 0 HB2 ASP A 915 4.580 6.615 -18.622 1.00 41.40 H new ATOM 0 HB3 ASP A 915 6.110 6.601 -17.766 1.00 41.40 H new ATOM 97 N GLN A 916 7.826 4.183 -18.060 1.00 45.34 N ATOM 98 CA GLN A 916 9.224 3.839 -17.828 1.00 30.45 C ATOM 99 C GLN A 916 9.773 2.990 -18.970 1.00 0.32 C ATOM 100 O GLN A 916 10.931 3.134 -19.364 1.00 52.42 O ATOM 101 CB GLN A 916 9.372 3.089 -16.503 1.00 23.34 C ATOM 102 CG GLN A 916 8.734 1.709 -16.510 1.00 1.04 C ATOM 103 CD GLN A 916 8.599 1.121 -15.119 1.00 2.33 C ATOM 104 OE1 GLN A 916 9.595 0.831 -14.456 1.00 2.25 O ATOM 105 NE2 GLN A 916 7.363 0.943 -14.669 1.00 33.43 N ATOM 0 H GLN A 916 7.195 3.922 -17.302 1.00 45.34 H new ATOM 0 HA GLN A 916 9.797 4.765 -17.780 1.00 30.45 H new ATOM 0 HB2 GLN A 916 10.432 2.989 -16.268 1.00 23.34 H new ATOM 0 HB3 GLN A 916 8.924 3.683 -15.707 1.00 23.34 H new ATOM 0 HG2 GLN A 916 7.748 1.771 -16.971 1.00 1.04 H new ATOM 0 HG3 GLN A 916 9.333 1.039 -17.127 1.00 1.04 H new ATOM 0 HE21 GLN A 916 6.566 1.198 -15.253 1.00 33.43 H new ATOM 0 HE22 GLN A 916 7.210 0.552 -13.740 1.00 33.43 H new ATOM 114 N THR A 917 8.935 2.104 -19.498 1.00 53.03 N ATOM 115 CA THR A 917 9.336 1.231 -20.594 1.00 42.22 C ATOM 116 C THR A 917 9.856 2.039 -21.778 1.00 74.43 C ATOM 117 O THR A 917 10.890 1.711 -22.359 1.00 74.13 O ATOM 118 CB THR A 917 8.167 0.346 -21.065 1.00 33.24 C ATOM 119 OG1 THR A 917 7.729 -0.497 -19.993 1.00 73.22 O ATOM 120 CG2 THR A 917 8.579 -0.509 -22.253 1.00 64.22 C ATOM 0 H THR A 917 7.974 1.972 -19.184 1.00 53.03 H new ATOM 0 HA THR A 917 10.134 0.593 -20.214 1.00 42.22 H new ATOM 0 HB THR A 917 7.349 0.997 -21.373 1.00 33.24 H new ATOM 0 HG1 THR A 917 6.985 -1.056 -20.299 1.00 73.22 H new ATOM 0 HG21 THR A 917 7.737 -1.125 -22.567 1.00 64.22 H new ATOM 0 HG22 THR A 917 8.884 0.136 -23.077 1.00 64.22 H new ATOM 0 HG23 THR A 917 9.412 -1.152 -21.967 1.00 64.22 H new ATOM 128 N ALA A 918 9.132 3.096 -22.130 1.00 52.24 N ATOM 129 CA ALA A 918 9.522 3.952 -23.244 1.00 14.21 C ATOM 130 C ALA A 918 10.974 4.398 -23.111 1.00 53.50 C ATOM 131 O ALA A 918 11.656 4.628 -24.109 1.00 40.40 O ATOM 132 CB ALA A 918 8.601 5.161 -23.328 1.00 5.14 C ATOM 0 H ALA A 918 8.272 3.380 -21.660 1.00 52.24 H new ATOM 0 HA ALA A 918 9.430 3.375 -24.164 1.00 14.21 H new ATOM 0 HB1 ALA A 918 8.904 5.792 -24.164 1.00 5.14 H new ATOM 0 HB2 ALA A 918 7.575 4.827 -23.479 1.00 5.14 H new ATOM 0 HB3 ALA A 918 8.664 5.732 -22.402 1.00 5.14 H new ATOM 138 N ALA A 919 11.440 4.520 -21.872 1.00 73.33 N ATOM 139 CA ALA A 919 12.811 4.937 -21.610 1.00 2.35 C ATOM 140 C ALA A 919 13.787 3.786 -21.826 1.00 71.51 C ATOM 141 O ALA A 919 14.913 3.990 -22.280 1.00 65.33 O ATOM 142 CB ALA A 919 12.936 5.478 -20.193 1.00 20.12 C ATOM 0 H ALA A 919 10.888 4.336 -21.035 1.00 73.33 H new ATOM 0 HA ALA A 919 13.064 5.729 -22.314 1.00 2.35 H new ATOM 0 HB1 ALA A 919 13.966 5.786 -20.011 1.00 20.12 H new ATOM 0 HB2 ALA A 919 12.274 6.335 -20.071 1.00 20.12 H new ATOM 0 HB3 ALA A 919 12.658 4.701 -19.481 1.00 20.12 H new ATOM 148 N LEU A 920 13.348 2.575 -21.498 1.00 42.31 N ATOM 149 CA LEU A 920 14.184 1.390 -21.656 1.00 74.13 C ATOM 150 C LEU A 920 14.331 1.020 -23.129 1.00 33.13 C ATOM 151 O LEU A 920 15.442 0.830 -23.623 1.00 15.10 O ATOM 152 CB LEU A 920 13.587 0.214 -20.880 1.00 40.24 C ATOM 153 CG LEU A 920 13.030 0.539 -19.494 1.00 75.30 C ATOM 154 CD1 LEU A 920 12.400 -0.697 -18.869 1.00 53.44 C ATOM 155 CD2 LEU A 920 14.125 1.094 -18.595 1.00 71.42 C ATOM 0 H LEU A 920 12.419 2.388 -21.121 1.00 42.31 H new ATOM 0 HA LEU A 920 15.173 1.617 -21.257 1.00 74.13 H new ATOM 0 HB2 LEU A 920 12.787 -0.222 -21.478 1.00 40.24 H new ATOM 0 HB3 LEU A 920 14.356 -0.551 -20.771 1.00 40.24 H new ATOM 0 HG LEU A 920 12.258 1.300 -19.603 1.00 75.30 H new ATOM 0 HD11 LEU A 920 12.009 -0.447 -17.883 1.00 53.44 H new ATOM 0 HD12 LEU A 920 11.587 -1.051 -19.503 1.00 53.44 H new ATOM 0 HD13 LEU A 920 13.152 -1.480 -18.773 1.00 53.44 H new ATOM 0 HD21 LEU A 920 13.710 1.320 -17.613 1.00 71.42 H new ATOM 0 HD22 LEU A 920 14.920 0.356 -18.492 1.00 71.42 H new ATOM 0 HD23 LEU A 920 14.530 2.005 -19.035 1.00 71.42 H new ATOM 167 N MET A 921 13.203 0.921 -23.824 1.00 55.33 N ATOM 168 CA MET A 921 13.207 0.578 -25.241 1.00 74.55 C ATOM 169 C MET A 921 14.123 1.512 -26.025 1.00 24.32 C ATOM 170 O MET A 921 14.763 1.101 -26.993 1.00 31.14 O ATOM 171 CB MET A 921 11.787 0.644 -25.808 1.00 61.33 C ATOM 172 CG MET A 921 11.055 1.931 -25.465 1.00 31.32 C ATOM 173 SD MET A 921 10.015 2.519 -26.815 1.00 15.54 S ATOM 174 CE MET A 921 10.445 4.258 -26.840 1.00 15.01 C ATOM 0 H MET A 921 12.275 1.073 -23.429 1.00 55.33 H new ATOM 0 HA MET A 921 13.584 -0.440 -25.341 1.00 74.55 H new ATOM 0 HB2 MET A 921 11.832 0.539 -26.892 1.00 61.33 H new ATOM 0 HB3 MET A 921 11.214 -0.202 -25.430 1.00 61.33 H new ATOM 0 HG2 MET A 921 10.439 1.769 -24.581 1.00 31.32 H new ATOM 0 HG3 MET A 921 11.783 2.701 -25.210 1.00 31.32 H new ATOM 0 HE1 MET A 921 10.131 4.697 -27.787 1.00 15.01 H new ATOM 0 HE2 MET A 921 9.942 4.769 -26.019 1.00 15.01 H new ATOM 0 HE3 MET A 921 11.524 4.368 -26.730 1.00 15.01 H new ATOM 184 N ALA A 922 14.182 2.770 -25.600 1.00 31.40 N ATOM 185 CA ALA A 922 15.022 3.761 -26.261 1.00 32.21 C ATOM 186 C ALA A 922 16.500 3.485 -26.007 1.00 11.11 C ATOM 187 O ALA A 922 17.351 3.786 -26.844 1.00 51.35 O ATOM 188 CB ALA A 922 14.656 5.161 -25.791 1.00 34.34 C ATOM 0 H ALA A 922 13.658 3.127 -24.801 1.00 31.40 H new ATOM 0 HA ALA A 922 14.846 3.692 -27.334 1.00 32.21 H new ATOM 0 HB1 ALA A 922 15.291 5.891 -26.293 1.00 34.34 H new ATOM 0 HB2 ALA A 922 13.612 5.364 -26.030 1.00 34.34 H new ATOM 0 HB3 ALA A 922 14.802 5.233 -24.713 1.00 34.34 H new ATOM 194 N HIS A 923 16.799 2.911 -24.846 1.00 2.32 N ATOM 195 CA HIS A 923 18.176 2.595 -24.482 1.00 13.14 C ATOM 196 C HIS A 923 18.773 1.576 -25.448 1.00 11.34 C ATOM 197 O HIS A 923 19.969 1.610 -25.741 1.00 53.22 O ATOM 198 CB HIS A 923 18.236 2.056 -23.052 1.00 4.30 C ATOM 199 CG HIS A 923 17.807 3.051 -22.018 1.00 43.41 C ATOM 200 ND1 HIS A 923 17.794 4.412 -22.243 1.00 34.20 N ATOM 201 CD2 HIS A 923 17.373 2.877 -20.748 1.00 41.00 C ATOM 202 CE1 HIS A 923 17.371 5.031 -21.155 1.00 42.33 C ATOM 203 NE2 HIS A 923 17.109 4.122 -20.233 1.00 51.54 N ATOM 0 H HIS A 923 16.107 2.655 -24.142 1.00 2.32 H new ATOM 0 HA HIS A 923 18.762 3.512 -24.542 1.00 13.14 H new ATOM 0 HB2 HIS A 923 17.602 1.172 -22.979 1.00 4.30 H new ATOM 0 HB3 HIS A 923 19.255 1.736 -22.836 1.00 4.30 H new ATOM 0 HD2 HIS A 923 17.256 1.934 -20.235 1.00 41.00 H new ATOM 0 HE1 HIS A 923 17.259 6.099 -21.039 1.00 42.33 H new ATOM 0 HE2 HIS A 923 16.766 4.314 -19.292 1.00 51.54 H new ATOM 211 N LEU A 924 17.934 0.671 -25.938 1.00 33.20 N ATOM 212 CA LEU A 924 18.379 -0.359 -26.871 1.00 13.13 C ATOM 213 C LEU A 924 18.538 0.212 -28.276 1.00 63.22 C ATOM 214 O LEU A 924 19.529 -0.054 -28.957 1.00 21.41 O ATOM 215 CB LEU A 924 17.385 -1.521 -26.890 1.00 33.52 C ATOM 216 CG LEU A 924 17.127 -2.206 -25.547 1.00 73.12 C ATOM 217 CD1 LEU A 924 15.682 -2.008 -25.116 1.00 32.11 C ATOM 218 CD2 LEU A 924 17.462 -3.688 -25.631 1.00 72.11 C ATOM 0 H LEU A 924 16.942 0.629 -25.705 1.00 33.20 H new ATOM 0 HA LEU A 924 19.349 -0.725 -26.535 1.00 13.13 H new ATOM 0 HB2 LEU A 924 16.434 -1.153 -27.276 1.00 33.52 H new ATOM 0 HB3 LEU A 924 17.746 -2.271 -27.594 1.00 33.52 H new ATOM 0 HG LEU A 924 17.774 -1.750 -24.798 1.00 73.12 H new ATOM 0 HD11 LEU A 924 15.517 -2.502 -24.159 1.00 32.11 H new ATOM 0 HD12 LEU A 924 15.475 -0.943 -25.015 1.00 32.11 H new ATOM 0 HD13 LEU A 924 15.017 -2.437 -25.865 1.00 32.11 H new ATOM 0 HD21 LEU A 924 17.272 -4.159 -24.667 1.00 72.11 H new ATOM 0 HD22 LEU A 924 16.841 -4.159 -26.393 1.00 72.11 H new ATOM 0 HD23 LEU A 924 18.513 -3.809 -25.894 1.00 72.11 H new ATOM 230 N PHE A 925 17.557 1.000 -28.704 1.00 64.42 N ATOM 231 CA PHE A 925 17.589 1.610 -30.028 1.00 64.44 C ATOM 232 C PHE A 925 18.859 2.435 -30.217 1.00 31.05 C ATOM 233 O PHE A 925 19.340 2.605 -31.336 1.00 42.01 O ATOM 234 CB PHE A 925 16.358 2.493 -30.236 1.00 54.21 C ATOM 235 CG PHE A 925 15.058 1.765 -30.043 1.00 62.04 C ATOM 236 CD1 PHE A 925 14.921 0.447 -30.447 1.00 70.31 C ATOM 237 CD2 PHE A 925 13.974 2.399 -29.459 1.00 14.11 C ATOM 238 CE1 PHE A 925 13.727 -0.226 -30.271 1.00 33.41 C ATOM 239 CE2 PHE A 925 12.777 1.731 -29.280 1.00 21.13 C ATOM 240 CZ PHE A 925 12.653 0.417 -29.687 1.00 41.13 C ATOM 0 H PHE A 925 16.730 1.231 -28.153 1.00 64.42 H new ATOM 0 HA PHE A 925 17.583 0.810 -30.769 1.00 64.44 H new ATOM 0 HB2 PHE A 925 16.402 3.332 -29.542 1.00 54.21 H new ATOM 0 HB3 PHE A 925 16.386 2.910 -31.243 1.00 54.21 H new ATOM 0 HD1 PHE A 925 15.757 -0.060 -30.905 1.00 70.31 H new ATOM 0 HD2 PHE A 925 14.065 3.427 -29.140 1.00 14.11 H new ATOM 0 HE1 PHE A 925 13.634 -1.254 -30.590 1.00 33.41 H new ATOM 0 HE2 PHE A 925 11.939 2.236 -28.822 1.00 21.13 H new ATOM 0 HZ PHE A 925 11.719 -0.107 -29.549 1.00 41.13 H new ATOM 250 N GLU A 926 19.395 2.946 -29.112 1.00 72.52 N ATOM 251 CA GLU A 926 20.607 3.754 -29.156 1.00 3.42 C ATOM 252 C GLU A 926 21.799 2.923 -29.622 1.00 41.45 C ATOM 253 O GLU A 926 22.795 3.463 -30.103 1.00 42.20 O ATOM 254 CB GLU A 926 20.897 4.353 -27.778 1.00 3.11 C ATOM 255 CG GLU A 926 20.017 5.543 -27.434 1.00 31.34 C ATOM 256 CD GLU A 926 20.028 5.867 -25.952 1.00 52.34 C ATOM 257 OE1 GLU A 926 20.537 5.041 -25.167 1.00 74.40 O ATOM 258 OE2 GLU A 926 19.527 6.949 -25.579 1.00 63.01 O ATOM 0 H GLU A 926 19.009 2.814 -28.177 1.00 72.52 H new ATOM 0 HA GLU A 926 20.448 4.562 -29.870 1.00 3.42 H new ATOM 0 HB2 GLU A 926 20.762 3.581 -27.020 1.00 3.11 H new ATOM 0 HB3 GLU A 926 21.942 4.661 -27.738 1.00 3.11 H new ATOM 0 HG2 GLU A 926 20.355 6.414 -27.995 1.00 31.34 H new ATOM 0 HG3 GLU A 926 18.994 5.337 -27.750 1.00 31.34 H new ATOM 265 N MET A 927 21.689 1.607 -29.476 1.00 53.13 N ATOM 266 CA MET A 927 22.757 0.701 -29.883 1.00 54.22 C ATOM 267 C MET A 927 22.642 0.356 -31.365 1.00 13.14 C ATOM 268 O MET A 927 23.646 0.251 -32.067 1.00 42.10 O ATOM 269 CB MET A 927 22.716 -0.578 -29.045 1.00 4.00 C ATOM 270 CG MET A 927 22.788 -0.326 -27.548 1.00 14.24 C ATOM 271 SD MET A 927 24.456 0.067 -26.988 1.00 50.51 S ATOM 272 CE MET A 927 24.704 -1.200 -25.747 1.00 44.11 C ATOM 0 H MET A 927 20.871 1.144 -29.079 1.00 53.13 H new ATOM 0 HA MET A 927 23.710 1.204 -29.718 1.00 54.22 H new ATOM 0 HB2 MET A 927 21.798 -1.121 -29.270 1.00 4.00 H new ATOM 0 HB3 MET A 927 23.546 -1.221 -29.337 1.00 4.00 H new ATOM 0 HG2 MET A 927 22.119 0.495 -27.289 1.00 14.24 H new ATOM 0 HG3 MET A 927 22.429 -1.208 -27.018 1.00 14.24 H new ATOM 0 HE1 MET A 927 25.695 -1.089 -25.307 1.00 44.11 H new ATOM 0 HE2 MET A 927 23.948 -1.100 -24.968 1.00 44.11 H new ATOM 0 HE3 MET A 927 24.620 -2.184 -26.209 1.00 44.11 H new ATOM 282 N GLY A 928 21.410 0.180 -31.833 1.00 52.32 N ATOM 283 CA GLY A 928 21.187 -0.152 -33.228 1.00 42.43 C ATOM 284 C GLY A 928 20.372 -1.418 -33.400 1.00 63.20 C ATOM 285 O GLY A 928 20.230 -1.928 -34.512 1.00 4.22 O ATOM 0 H GLY A 928 20.563 0.261 -31.271 1.00 52.32 H new ATOM 0 HA2 GLY A 928 20.674 0.676 -33.718 1.00 42.43 H new ATOM 0 HA3 GLY A 928 22.148 -0.272 -33.728 1.00 42.43 H new ATOM 289 N PHE A 929 19.836 -1.929 -32.297 1.00 24.34 N ATOM 290 CA PHE A 929 19.034 -3.146 -32.329 1.00 75.15 C ATOM 291 C PHE A 929 17.844 -2.988 -33.272 1.00 43.23 C ATOM 292 O PHE A 929 17.709 -3.727 -34.248 1.00 63.10 O ATOM 293 CB PHE A 929 18.541 -3.496 -30.924 1.00 2.34 C ATOM 294 CG PHE A 929 19.632 -3.971 -30.007 1.00 43.41 C ATOM 295 CD1 PHE A 929 20.321 -5.142 -30.277 1.00 71.20 C ATOM 296 CD2 PHE A 929 19.969 -3.246 -28.875 1.00 40.54 C ATOM 297 CE1 PHE A 929 21.326 -5.582 -29.436 1.00 12.11 C ATOM 298 CE2 PHE A 929 20.973 -3.680 -28.031 1.00 42.00 C ATOM 299 CZ PHE A 929 21.652 -4.850 -28.311 1.00 34.21 C ATOM 0 H PHE A 929 19.943 -1.519 -31.369 1.00 24.34 H new ATOM 0 HA PHE A 929 19.664 -3.956 -32.697 1.00 75.15 H new ATOM 0 HB2 PHE A 929 18.065 -2.619 -30.486 1.00 2.34 H new ATOM 0 HB3 PHE A 929 17.777 -4.270 -30.998 1.00 2.34 H new ATOM 0 HD1 PHE A 929 20.070 -5.718 -31.155 1.00 71.20 H new ATOM 0 HD2 PHE A 929 19.441 -2.331 -28.650 1.00 40.54 H new ATOM 0 HE1 PHE A 929 21.855 -6.497 -29.658 1.00 12.11 H new ATOM 0 HE2 PHE A 929 21.227 -3.105 -27.153 1.00 42.00 H new ATOM 0 HZ PHE A 929 22.436 -5.192 -27.652 1.00 34.21 H new ATOM 309 N CYS A 930 16.985 -2.020 -32.973 1.00 41.13 N ATOM 310 CA CYS A 930 15.806 -1.764 -33.793 1.00 33.42 C ATOM 311 C CYS A 930 14.860 -2.961 -33.772 1.00 51.23 C ATOM 312 O CYS A 930 14.488 -3.489 -34.820 1.00 63.14 O ATOM 313 CB CYS A 930 16.217 -1.449 -35.231 1.00 43.15 C ATOM 314 SG CYS A 930 15.028 -0.427 -36.132 1.00 60.43 S ATOM 0 H CYS A 930 17.083 -1.400 -32.169 1.00 41.13 H new ATOM 0 HA CYS A 930 15.284 -0.903 -33.376 1.00 33.42 H new ATOM 0 HB2 CYS A 930 17.181 -0.941 -35.219 1.00 43.15 H new ATOM 0 HB3 CYS A 930 16.357 -2.385 -35.771 1.00 43.15 H new ATOM 0 HG CYS A 930 15.465 -0.213 -37.337 1.00 60.43 H new ATOM 320 N ASP A 931 14.476 -3.384 -32.573 1.00 54.12 N ATOM 321 CA ASP A 931 13.573 -4.519 -32.416 1.00 5.23 C ATOM 322 C ASP A 931 12.626 -4.301 -31.240 1.00 24.13 C ATOM 323 O ASP A 931 12.835 -4.842 -30.154 1.00 31.23 O ATOM 324 CB ASP A 931 14.372 -5.808 -32.212 1.00 55.40 C ATOM 325 CG ASP A 931 15.274 -6.122 -33.389 1.00 0.21 C ATOM 326 OD1 ASP A 931 14.787 -6.080 -34.538 1.00 70.13 O ATOM 327 OD2 ASP A 931 16.468 -6.408 -33.161 1.00 34.43 O ATOM 0 H ASP A 931 14.775 -2.959 -31.696 1.00 54.12 H new ATOM 0 HA ASP A 931 12.979 -4.609 -33.325 1.00 5.23 H new ATOM 0 HB2 ASP A 931 14.976 -5.719 -31.309 1.00 55.40 H new ATOM 0 HB3 ASP A 931 13.683 -6.638 -32.054 1.00 55.40 H new ATOM 332 N ARG A 932 11.586 -3.505 -31.464 1.00 3.33 N ATOM 333 CA ARG A 932 10.609 -3.214 -30.422 1.00 53.51 C ATOM 334 C ARG A 932 9.952 -4.496 -29.919 1.00 53.33 C ATOM 335 O ARG A 932 9.496 -4.564 -28.778 1.00 40.03 O ATOM 336 CB ARG A 932 9.541 -2.254 -30.949 1.00 53.54 C ATOM 337 CG ARG A 932 8.797 -2.779 -32.166 1.00 40.35 C ATOM 338 CD ARG A 932 7.385 -3.218 -31.810 1.00 44.01 C ATOM 339 NE ARG A 932 6.435 -2.924 -32.879 1.00 35.11 N ATOM 340 CZ ARG A 932 6.439 -3.539 -34.056 1.00 60.32 C ATOM 341 NH1 ARG A 932 7.340 -4.478 -34.314 1.00 54.42 N ATOM 342 NH2 ARG A 932 5.541 -3.217 -34.978 1.00 40.42 N ATOM 0 H ARG A 932 11.398 -3.050 -32.357 1.00 3.33 H new ATOM 0 HA ARG A 932 11.132 -2.744 -29.589 1.00 53.51 H new ATOM 0 HB2 ARG A 932 8.823 -2.051 -30.154 1.00 53.54 H new ATOM 0 HB3 ARG A 932 10.012 -1.304 -31.203 1.00 53.54 H new ATOM 0 HG2 ARG A 932 8.756 -2.004 -32.931 1.00 40.35 H new ATOM 0 HG3 ARG A 932 9.344 -3.620 -32.593 1.00 40.35 H new ATOM 0 HD2 ARG A 932 7.379 -4.288 -31.604 1.00 44.01 H new ATOM 0 HD3 ARG A 932 7.069 -2.716 -30.896 1.00 44.01 H new ATOM 0 HE ARG A 932 5.729 -2.207 -32.713 1.00 35.11 H new ATOM 0 HH11 ARG A 932 8.032 -4.729 -33.608 1.00 54.42 H new ATOM 0 HH12 ARG A 932 7.341 -4.949 -35.219 1.00 54.42 H new ATOM 0 HH21 ARG A 932 4.846 -2.496 -34.783 1.00 40.42 H new ATOM 0 HH22 ARG A 932 5.545 -3.690 -35.882 1.00 40.42 H new ATOM 356 N GLN A 933 9.907 -5.508 -30.779 1.00 60.13 N ATOM 357 CA GLN A 933 9.305 -6.787 -30.422 1.00 73.11 C ATOM 358 C GLN A 933 10.181 -7.543 -29.429 1.00 64.34 C ATOM 359 O GLN A 933 9.688 -8.095 -28.445 1.00 25.24 O ATOM 360 CB GLN A 933 9.082 -7.637 -31.674 1.00 74.12 C ATOM 361 CG GLN A 933 8.034 -7.068 -32.617 1.00 52.01 C ATOM 362 CD GLN A 933 6.970 -8.082 -32.988 1.00 31.21 C ATOM 363 OE1 GLN A 933 6.503 -8.846 -32.143 1.00 20.51 O ATOM 364 NE2 GLN A 933 6.580 -8.094 -34.257 1.00 60.43 N ATOM 0 H GLN A 933 10.280 -5.467 -31.727 1.00 60.13 H new ATOM 0 HA GLN A 933 8.343 -6.588 -29.951 1.00 73.11 H new ATOM 0 HB2 GLN A 933 10.026 -7.734 -32.210 1.00 74.12 H new ATOM 0 HB3 GLN A 933 8.781 -8.641 -31.373 1.00 74.12 H new ATOM 0 HG2 GLN A 933 7.560 -6.205 -32.149 1.00 52.01 H new ATOM 0 HG3 GLN A 933 8.522 -6.711 -33.524 1.00 52.01 H new ATOM 0 HE21 GLN A 933 6.994 -7.443 -34.924 1.00 60.43 H new ATOM 0 HE22 GLN A 933 5.866 -8.754 -34.565 1.00 60.43 H new ATOM 373 N LEU A 934 11.483 -7.565 -29.694 1.00 71.44 N ATOM 374 CA LEU A 934 12.429 -8.255 -28.824 1.00 43.41 C ATOM 375 C LEU A 934 12.485 -7.595 -27.450 1.00 5.10 C ATOM 376 O LEU A 934 12.329 -8.258 -26.426 1.00 4.24 O ATOM 377 CB LEU A 934 13.822 -8.261 -29.456 1.00 61.55 C ATOM 378 CG LEU A 934 14.215 -9.538 -30.201 1.00 52.24 C ATOM 379 CD1 LEU A 934 13.125 -9.940 -31.183 1.00 51.40 C ATOM 380 CD2 LEU A 934 15.541 -9.348 -30.923 1.00 1.32 C ATOM 0 H LEU A 934 11.907 -7.113 -30.504 1.00 71.44 H new ATOM 0 HA LEU A 934 12.088 -9.283 -28.700 1.00 43.41 H new ATOM 0 HB2 LEU A 934 13.888 -7.424 -30.151 1.00 61.55 H new ATOM 0 HB3 LEU A 934 14.556 -8.082 -28.671 1.00 61.55 H new ATOM 0 HG LEU A 934 14.333 -10.339 -29.472 1.00 52.24 H new ATOM 0 HD11 LEU A 934 13.422 -10.850 -31.704 1.00 51.40 H new ATOM 0 HD12 LEU A 934 12.196 -10.118 -30.642 1.00 51.40 H new ATOM 0 HD13 LEU A 934 12.975 -9.140 -31.908 1.00 51.40 H new ATOM 0 HD21 LEU A 934 15.805 -10.266 -31.447 1.00 1.32 H new ATOM 0 HD22 LEU A 934 15.451 -8.533 -31.641 1.00 1.32 H new ATOM 0 HD23 LEU A 934 16.319 -9.108 -30.198 1.00 1.32 H new ATOM 392 N ASN A 935 12.707 -6.285 -27.437 1.00 5.50 N ATOM 393 CA ASN A 935 12.782 -5.534 -26.189 1.00 24.35 C ATOM 394 C ASN A 935 11.542 -5.776 -25.333 1.00 41.15 C ATOM 395 O ASN A 935 11.599 -5.708 -24.105 1.00 33.21 O ATOM 396 CB ASN A 935 12.934 -4.039 -26.476 1.00 61.20 C ATOM 397 CG ASN A 935 13.877 -3.766 -27.632 1.00 11.51 C ATOM 398 OD1 ASN A 935 14.912 -4.418 -27.771 1.00 52.31 O ATOM 399 ND2 ASN A 935 13.522 -2.796 -28.468 1.00 23.44 N ATOM 0 H ASN A 935 12.838 -5.721 -28.277 1.00 5.50 H new ATOM 0 HA ASN A 935 13.656 -5.881 -25.638 1.00 24.35 H new ATOM 0 HB2 ASN A 935 11.956 -3.613 -26.700 1.00 61.20 H new ATOM 0 HB3 ASN A 935 13.303 -3.536 -25.582 1.00 61.20 H new ATOM 0 HD21 ASN A 935 14.117 -2.566 -29.264 1.00 23.44 H new ATOM 0 HD22 ASN A 935 12.655 -2.282 -28.314 1.00 23.44 H new ATOM 406 N LEU A 936 10.423 -6.058 -25.991 1.00 70.31 N ATOM 407 CA LEU A 936 9.168 -6.311 -25.292 1.00 32.01 C ATOM 408 C LEU A 936 9.174 -7.692 -24.643 1.00 42.43 C ATOM 409 O LEU A 936 8.890 -7.831 -23.454 1.00 12.44 O ATOM 410 CB LEU A 936 7.989 -6.195 -26.260 1.00 65.55 C ATOM 411 CG LEU A 936 6.646 -5.812 -25.640 1.00 35.42 C ATOM 412 CD1 LEU A 936 6.181 -6.886 -24.667 1.00 44.43 C ATOM 413 CD2 LEU A 936 6.746 -4.464 -24.941 1.00 73.31 C ATOM 0 H LEU A 936 10.359 -6.117 -27.007 1.00 70.31 H new ATOM 0 HA LEU A 936 9.061 -5.562 -24.508 1.00 32.01 H new ATOM 0 HB2 LEU A 936 8.240 -5.454 -27.019 1.00 65.55 H new ATOM 0 HB3 LEU A 936 7.871 -7.150 -26.773 1.00 65.55 H new ATOM 0 HG LEU A 936 5.909 -5.731 -26.439 1.00 35.42 H new ATOM 0 HD11 LEU A 936 5.223 -6.596 -24.235 1.00 44.43 H new ATOM 0 HD12 LEU A 936 6.069 -7.832 -25.196 1.00 44.43 H new ATOM 0 HD13 LEU A 936 6.918 -7.000 -23.872 1.00 44.43 H new ATOM 0 HD21 LEU A 936 5.780 -4.207 -24.505 1.00 73.31 H new ATOM 0 HD22 LEU A 936 7.497 -4.518 -24.153 1.00 73.31 H new ATOM 0 HD23 LEU A 936 7.033 -3.700 -25.664 1.00 73.31 H new ATOM 425 N ARG A 937 9.502 -8.709 -25.433 1.00 24.12 N ATOM 426 CA ARG A 937 9.547 -10.079 -24.935 1.00 50.31 C ATOM 427 C ARG A 937 10.689 -10.258 -23.939 1.00 61.44 C ATOM 428 O ARG A 937 10.617 -11.097 -23.040 1.00 12.21 O ATOM 429 CB ARG A 937 9.710 -11.061 -26.097 1.00 15.13 C ATOM 430 CG ARG A 937 11.152 -11.252 -26.535 1.00 42.25 C ATOM 431 CD ARG A 937 11.781 -12.466 -25.870 1.00 11.22 C ATOM 432 NE ARG A 937 11.058 -13.696 -26.180 1.00 33.10 N ATOM 433 CZ ARG A 937 11.283 -14.855 -25.570 1.00 40.45 C ATOM 434 NH1 ARG A 937 12.206 -14.940 -24.623 1.00 24.41 N ATOM 435 NH2 ARG A 937 10.584 -15.930 -25.908 1.00 74.52 N ATOM 0 H ARG A 937 9.740 -8.611 -26.420 1.00 24.12 H new ATOM 0 HA ARG A 937 8.607 -10.285 -24.424 1.00 50.31 H new ATOM 0 HB2 ARG A 937 9.297 -12.027 -25.806 1.00 15.13 H new ATOM 0 HB3 ARG A 937 9.125 -10.707 -26.946 1.00 15.13 H new ATOM 0 HG2 ARG A 937 11.192 -11.368 -27.618 1.00 42.25 H new ATOM 0 HG3 ARG A 937 11.729 -10.361 -26.288 1.00 42.25 H new ATOM 0 HD2 ARG A 937 12.817 -12.562 -26.196 1.00 11.22 H new ATOM 0 HD3 ARG A 937 11.800 -12.319 -24.790 1.00 11.22 H new ATOM 0 HE ARG A 937 10.341 -13.664 -26.905 1.00 33.10 H new ATOM 0 HH11 ARG A 937 12.745 -14.115 -24.361 1.00 24.41 H new ATOM 0 HH12 ARG A 937 12.377 -15.831 -24.156 1.00 24.41 H new ATOM 0 HH21 ARG A 937 9.873 -15.868 -26.637 1.00 74.52 H new ATOM 0 HH22 ARG A 937 10.757 -16.819 -25.439 1.00 74.52 H new ATOM 449 N LEU A 938 11.743 -9.467 -24.106 1.00 54.44 N ATOM 450 CA LEU A 938 12.901 -9.538 -23.223 1.00 22.12 C ATOM 451 C LEU A 938 12.588 -8.922 -21.863 1.00 51.21 C ATOM 452 O LEU A 938 12.857 -9.521 -20.821 1.00 44.40 O ATOM 453 CB LEU A 938 14.096 -8.823 -23.857 1.00 14.14 C ATOM 454 CG LEU A 938 15.179 -9.723 -24.452 1.00 34.41 C ATOM 455 CD1 LEU A 938 15.713 -10.682 -23.400 1.00 23.35 C ATOM 456 CD2 LEU A 938 14.636 -10.491 -25.649 1.00 13.24 C ATOM 0 H LEU A 938 11.819 -8.769 -24.845 1.00 54.44 H new ATOM 0 HA LEU A 938 13.151 -10.589 -23.076 1.00 22.12 H new ATOM 0 HB2 LEU A 938 13.725 -8.166 -24.644 1.00 14.14 H new ATOM 0 HB3 LEU A 938 14.556 -8.187 -23.101 1.00 14.14 H new ATOM 0 HG LEU A 938 16.001 -9.093 -24.792 1.00 34.41 H new ATOM 0 HD11 LEU A 938 16.483 -11.315 -23.842 1.00 23.35 H new ATOM 0 HD12 LEU A 938 16.140 -10.114 -22.573 1.00 23.35 H new ATOM 0 HD13 LEU A 938 14.899 -11.306 -23.030 1.00 23.35 H new ATOM 0 HD21 LEU A 938 15.420 -11.126 -26.060 1.00 13.24 H new ATOM 0 HD22 LEU A 938 13.796 -11.110 -25.334 1.00 13.24 H new ATOM 0 HD23 LEU A 938 14.302 -9.787 -26.412 1.00 13.24 H new ATOM 468 N LEU A 939 12.016 -7.723 -21.881 1.00 35.14 N ATOM 469 CA LEU A 939 11.663 -7.026 -20.649 1.00 14.22 C ATOM 470 C LEU A 939 10.867 -7.935 -19.717 1.00 51.44 C ATOM 471 O LEU A 939 11.229 -8.122 -18.556 1.00 1.54 O ATOM 472 CB LEU A 939 10.853 -5.767 -20.966 1.00 62.10 C ATOM 473 CG LEU A 939 11.663 -4.495 -21.220 1.00 15.24 C ATOM 474 CD1 LEU A 939 10.789 -3.424 -21.854 1.00 52.02 C ATOM 475 CD2 LEU A 939 12.276 -3.986 -19.923 1.00 43.05 C ATOM 0 H LEU A 939 11.787 -7.214 -22.734 1.00 35.14 H new ATOM 0 HA LEU A 939 12.587 -6.740 -20.146 1.00 14.22 H new ATOM 0 HB2 LEU A 939 10.240 -5.965 -21.845 1.00 62.10 H new ATOM 0 HB3 LEU A 939 10.170 -5.580 -20.137 1.00 62.10 H new ATOM 0 HG LEU A 939 12.471 -4.733 -21.912 1.00 15.24 H new ATOM 0 HD11 LEU A 939 11.382 -2.526 -22.028 1.00 52.02 H new ATOM 0 HD12 LEU A 939 10.397 -3.789 -22.803 1.00 52.02 H new ATOM 0 HD13 LEU A 939 9.960 -3.188 -21.186 1.00 52.02 H new ATOM 0 HD21 LEU A 939 12.849 -3.080 -20.122 1.00 43.05 H new ATOM 0 HD22 LEU A 939 11.483 -3.764 -19.208 1.00 43.05 H new ATOM 0 HD23 LEU A 939 12.935 -4.749 -19.508 1.00 43.05 H new ATOM 487 N LYS A 940 9.782 -8.499 -20.235 1.00 74.44 N ATOM 488 CA LYS A 940 8.935 -9.392 -19.453 1.00 23.25 C ATOM 489 C LYS A 940 9.707 -10.636 -19.023 1.00 41.13 C ATOM 490 O LYS A 940 9.359 -11.286 -18.037 1.00 72.14 O ATOM 491 CB LYS A 940 7.702 -9.799 -20.262 1.00 15.44 C ATOM 492 CG LYS A 940 6.932 -8.619 -20.831 1.00 64.35 C ATOM 493 CD LYS A 940 5.574 -8.466 -20.168 1.00 2.04 C ATOM 494 CE LYS A 940 5.614 -7.436 -19.049 1.00 54.34 C ATOM 495 NZ LYS A 940 5.903 -8.061 -17.729 1.00 51.21 N ATOM 0 H LYS A 940 9.468 -8.353 -21.194 1.00 74.44 H new ATOM 0 HA LYS A 940 8.615 -8.857 -18.559 1.00 23.25 H new ATOM 0 HB2 LYS A 940 8.013 -10.448 -21.081 1.00 15.44 H new ATOM 0 HB3 LYS A 940 7.037 -10.384 -19.626 1.00 15.44 H new ATOM 0 HG2 LYS A 940 7.510 -7.705 -20.692 1.00 64.35 H new ATOM 0 HG3 LYS A 940 6.800 -8.753 -21.905 1.00 64.35 H new ATOM 0 HD2 LYS A 940 4.836 -8.168 -20.912 1.00 2.04 H new ATOM 0 HD3 LYS A 940 5.253 -9.428 -19.768 1.00 2.04 H new ATOM 0 HE2 LYS A 940 6.375 -6.688 -19.271 1.00 54.34 H new ATOM 0 HE3 LYS A 940 4.658 -6.914 -19.002 1.00 54.34 H new ATOM 0 HZ1 LYS A 940 6.332 -7.355 -17.097 1.00 51.21 H new ATOM 0 HZ2 LYS A 940 5.018 -8.409 -17.309 1.00 51.21 H new ATOM 0 HZ3 LYS A 940 6.561 -8.856 -17.858 1.00 51.21 H new ATOM 509 N LYS A 941 10.758 -10.961 -19.769 1.00 31.14 N ATOM 510 CA LYS A 941 11.582 -12.125 -19.464 1.00 75.22 C ATOM 511 C LYS A 941 12.479 -11.857 -18.260 1.00 50.04 C ATOM 512 O LYS A 941 12.651 -12.718 -17.397 1.00 72.43 O ATOM 513 CB LYS A 941 12.436 -12.502 -20.677 1.00 32.23 C ATOM 514 CG LYS A 941 13.057 -13.885 -20.577 1.00 1.42 C ATOM 515 CD LYS A 941 14.517 -13.871 -20.997 1.00 62.51 C ATOM 516 CE LYS A 941 15.349 -14.825 -20.153 1.00 73.42 C ATOM 517 NZ LYS A 941 16.327 -15.587 -20.978 1.00 43.41 N ATOM 0 H LYS A 941 11.059 -10.435 -20.589 1.00 31.14 H new ATOM 0 HA LYS A 941 10.919 -12.955 -19.222 1.00 75.22 H new ATOM 0 HB2 LYS A 941 11.819 -12.454 -21.574 1.00 32.23 H new ATOM 0 HB3 LYS A 941 13.230 -11.764 -20.796 1.00 32.23 H new ATOM 0 HG2 LYS A 941 12.975 -14.248 -19.553 1.00 1.42 H new ATOM 0 HG3 LYS A 941 12.503 -14.580 -21.207 1.00 1.42 H new ATOM 0 HD2 LYS A 941 14.597 -14.149 -22.048 1.00 62.51 H new ATOM 0 HD3 LYS A 941 14.914 -12.860 -20.904 1.00 62.51 H new ATOM 0 HE2 LYS A 941 15.881 -14.262 -19.387 1.00 73.42 H new ATOM 0 HE3 LYS A 941 14.689 -15.522 -19.636 1.00 73.42 H new ATOM 0 HZ1 LYS A 941 16.874 -16.226 -20.366 1.00 43.41 H new ATOM 0 HZ2 LYS A 941 15.818 -16.145 -21.693 1.00 43.41 H new ATOM 0 HZ3 LYS A 941 16.973 -14.924 -21.452 1.00 43.41 H new ATOM 531 N HIS A 942 13.048 -10.657 -18.208 1.00 2.21 N ATOM 532 CA HIS A 942 13.927 -10.275 -17.108 1.00 14.21 C ATOM 533 C HIS A 942 13.163 -9.478 -16.054 1.00 71.14 C ATOM 534 O HIS A 942 13.742 -9.015 -15.073 1.00 13.41 O ATOM 535 CB HIS A 942 15.105 -9.453 -17.630 1.00 42.15 C ATOM 536 CG HIS A 942 15.905 -10.155 -18.684 1.00 73.14 C ATOM 537 ND1 HIS A 942 16.809 -11.157 -18.401 1.00 12.14 N ATOM 538 CD2 HIS A 942 15.931 -9.997 -20.028 1.00 53.54 C ATOM 539 CE1 HIS A 942 17.358 -11.583 -19.524 1.00 53.22 C ATOM 540 NE2 HIS A 942 16.842 -10.895 -20.527 1.00 34.11 N ATOM 0 H HIS A 942 12.916 -9.933 -18.914 1.00 2.21 H new ATOM 0 HA HIS A 942 14.306 -11.186 -16.646 1.00 14.21 H new ATOM 0 HB2 HIS A 942 14.730 -8.513 -18.036 1.00 42.15 H new ATOM 0 HB3 HIS A 942 15.760 -9.201 -16.796 1.00 42.15 H new ATOM 0 HD1 HIS A 942 17.021 -11.514 -17.469 1.00 12.14 H new ATOM 0 HD2 HIS A 942 15.344 -9.295 -20.602 1.00 53.54 H new ATOM 0 HE1 HIS A 942 18.102 -12.361 -19.608 1.00 53.22 H new ATOM 548 N ASN A 943 11.860 -9.323 -16.266 1.00 40.33 N ATOM 549 CA ASN A 943 11.017 -8.581 -15.335 1.00 44.24 C ATOM 550 C ASN A 943 11.401 -7.104 -15.313 1.00 73.21 C ATOM 551 O ASN A 943 11.819 -6.576 -14.283 1.00 31.15 O ATOM 552 CB ASN A 943 11.134 -9.171 -13.929 1.00 13.35 C ATOM 553 CG ASN A 943 9.885 -8.939 -13.099 1.00 42.05 C ATOM 554 OD1 ASN A 943 8.823 -9.490 -13.389 1.00 22.51 O ATOM 555 ND2 ASN A 943 10.008 -8.119 -12.062 1.00 32.21 N ATOM 0 H ASN A 943 11.365 -9.701 -17.074 1.00 40.33 H new ATOM 0 HA ASN A 943 9.984 -8.665 -15.672 1.00 44.24 H new ATOM 0 HB2 ASN A 943 11.325 -10.242 -14.002 1.00 13.35 H new ATOM 0 HB3 ASN A 943 11.991 -8.728 -13.422 1.00 13.35 H new ATOM 0 HD21 ASN A 943 9.202 -7.924 -11.468 1.00 32.21 H new ATOM 0 HD22 ASN A 943 10.908 -7.685 -11.859 1.00 32.21 H new ATOM 562 N TYR A 944 11.255 -6.444 -16.456 1.00 54.42 N ATOM 563 CA TYR A 944 11.587 -5.028 -16.569 1.00 31.40 C ATOM 564 C TYR A 944 13.053 -4.784 -16.226 1.00 23.11 C ATOM 565 O TYR A 944 13.376 -3.916 -15.416 1.00 24.40 O ATOM 566 CB TYR A 944 10.691 -4.198 -15.649 1.00 0.34 C ATOM 567 CG TYR A 944 9.346 -3.864 -16.253 1.00 40.51 C ATOM 568 CD1 TYR A 944 8.553 -4.852 -16.822 1.00 33.23 C ATOM 569 CD2 TYR A 944 8.868 -2.559 -16.255 1.00 1.33 C ATOM 570 CE1 TYR A 944 7.324 -4.551 -17.376 1.00 34.12 C ATOM 571 CE2 TYR A 944 7.640 -2.249 -16.805 1.00 54.32 C ATOM 572 CZ TYR A 944 6.871 -3.248 -17.365 1.00 23.11 C ATOM 573 OH TYR A 944 5.647 -2.944 -17.915 1.00 31.45 O ATOM 0 H TYR A 944 10.909 -6.866 -17.318 1.00 54.42 H new ATOM 0 HA TYR A 944 11.418 -4.722 -17.602 1.00 31.40 H new ATOM 0 HB2 TYR A 944 10.536 -4.743 -14.718 1.00 0.34 H new ATOM 0 HB3 TYR A 944 11.205 -3.271 -15.394 1.00 0.34 H new ATOM 0 HD1 TYR A 944 8.903 -5.874 -16.831 1.00 33.23 H new ATOM 0 HD2 TYR A 944 9.467 -1.774 -15.819 1.00 1.33 H new ATOM 0 HE1 TYR A 944 6.721 -5.332 -17.815 1.00 34.12 H new ATOM 0 HE2 TYR A 944 7.283 -1.230 -16.797 1.00 54.32 H new ATOM 0 HH TYR A 944 5.477 -1.983 -17.824 1.00 31.45 H new ATOM 583 N ASN A 945 13.937 -5.557 -16.850 1.00 12.42 N ATOM 584 CA ASN A 945 15.370 -5.425 -16.612 1.00 34.34 C ATOM 585 C ASN A 945 16.104 -5.063 -17.899 1.00 21.31 C ATOM 586 O ASN A 945 16.674 -5.928 -18.564 1.00 61.53 O ATOM 587 CB ASN A 945 15.934 -6.727 -16.038 1.00 13.30 C ATOM 588 CG ASN A 945 17.033 -6.482 -15.023 1.00 23.24 C ATOM 589 OD1 ASN A 945 17.031 -7.062 -13.937 1.00 30.32 O ATOM 590 ND2 ASN A 945 17.980 -5.619 -15.372 1.00 61.23 N ATOM 0 H ASN A 945 13.686 -6.281 -17.524 1.00 12.42 H new ATOM 0 HA ASN A 945 15.521 -4.622 -15.891 1.00 34.34 H new ATOM 0 HB2 ASN A 945 15.129 -7.293 -15.569 1.00 13.30 H new ATOM 0 HB3 ASN A 945 16.323 -7.341 -16.850 1.00 13.30 H new ATOM 0 HD21 ASN A 945 18.745 -5.414 -14.729 1.00 61.23 H new ATOM 0 HD22 ASN A 945 17.942 -5.161 -16.283 1.00 61.23 H new ATOM 597 N ILE A 946 16.086 -3.780 -18.243 1.00 23.01 N ATOM 598 CA ILE A 946 16.752 -3.304 -19.449 1.00 12.40 C ATOM 599 C ILE A 946 18.197 -3.787 -19.507 1.00 10.23 C ATOM 600 O ILE A 946 18.699 -4.154 -20.570 1.00 55.12 O ATOM 601 CB ILE A 946 16.733 -1.766 -19.533 1.00 13.15 C ATOM 602 CG1 ILE A 946 17.498 -1.291 -20.769 1.00 62.13 C ATOM 603 CG2 ILE A 946 17.327 -1.159 -18.270 1.00 72.50 C ATOM 604 CD1 ILE A 946 16.942 -1.831 -22.068 1.00 64.53 C ATOM 0 H ILE A 946 15.618 -3.052 -17.704 1.00 23.01 H new ATOM 0 HA ILE A 946 16.201 -3.713 -20.296 1.00 12.40 H new ATOM 0 HB ILE A 946 15.698 -1.435 -19.620 1.00 13.15 H new ATOM 0 HG12 ILE A 946 17.481 -0.202 -20.801 1.00 62.13 H new ATOM 0 HG13 ILE A 946 18.542 -1.591 -20.678 1.00 62.13 H new ATOM 0 HG21 ILE A 946 17.307 -0.072 -18.344 1.00 72.50 H new ATOM 0 HG22 ILE A 946 16.743 -1.475 -17.405 1.00 72.50 H new ATOM 0 HG23 ILE A 946 18.357 -1.495 -18.154 1.00 72.50 H new ATOM 0 HD11 ILE A 946 17.533 -1.453 -22.902 1.00 64.53 H new ATOM 0 HD12 ILE A 946 16.985 -2.920 -22.057 1.00 64.53 H new ATOM 0 HD13 ILE A 946 15.907 -1.510 -22.182 1.00 64.53 H new ATOM 616 N LEU A 947 18.862 -3.786 -18.356 1.00 55.15 N ATOM 617 CA LEU A 947 20.250 -4.226 -18.275 1.00 31.23 C ATOM 618 C LEU A 947 20.415 -5.620 -18.872 1.00 43.23 C ATOM 619 O LEU A 947 21.275 -5.841 -19.724 1.00 61.35 O ATOM 620 CB LEU A 947 20.721 -4.224 -16.819 1.00 45.45 C ATOM 621 CG LEU A 947 20.396 -2.968 -16.011 1.00 14.45 C ATOM 622 CD1 LEU A 947 20.991 -3.063 -14.614 1.00 51.43 C ATOM 623 CD2 LEU A 947 20.905 -1.725 -16.726 1.00 63.22 C ATOM 0 H LEU A 947 18.462 -3.486 -17.467 1.00 55.15 H new ATOM 0 HA LEU A 947 20.861 -3.530 -18.850 1.00 31.23 H new ATOM 0 HB2 LEU A 947 20.278 -5.082 -16.313 1.00 45.45 H new ATOM 0 HB3 LEU A 947 21.801 -4.370 -16.807 1.00 45.45 H new ATOM 0 HG LEU A 947 19.313 -2.890 -15.918 1.00 14.45 H new ATOM 0 HD11 LEU A 947 20.749 -2.160 -14.053 1.00 51.43 H new ATOM 0 HD12 LEU A 947 20.577 -3.931 -14.100 1.00 51.43 H new ATOM 0 HD13 LEU A 947 22.074 -3.167 -14.686 1.00 51.43 H new ATOM 0 HD21 LEU A 947 20.664 -0.841 -16.135 1.00 63.22 H new ATOM 0 HD22 LEU A 947 21.986 -1.794 -16.851 1.00 63.22 H new ATOM 0 HD23 LEU A 947 20.430 -1.648 -17.704 1.00 63.22 H new ATOM 635 N GLN A 948 19.585 -6.554 -18.421 1.00 31.13 N ATOM 636 CA GLN A 948 19.639 -7.926 -18.912 1.00 51.35 C ATOM 637 C GLN A 948 19.077 -8.019 -20.327 1.00 64.24 C ATOM 638 O GLN A 948 19.514 -8.848 -21.126 1.00 74.40 O ATOM 639 CB GLN A 948 18.861 -8.855 -17.980 1.00 35.33 C ATOM 640 CG GLN A 948 19.356 -8.830 -16.543 1.00 0.42 C ATOM 641 CD GLN A 948 19.168 -10.158 -15.837 1.00 11.22 C ATOM 642 OE1 GLN A 948 18.054 -10.675 -15.750 1.00 20.53 O ATOM 643 NE2 GLN A 948 20.259 -10.718 -15.328 1.00 1.22 N ATOM 0 H GLN A 948 18.867 -6.386 -17.716 1.00 31.13 H new ATOM 0 HA GLN A 948 20.683 -8.237 -18.933 1.00 51.35 H new ATOM 0 HB2 GLN A 948 17.808 -8.575 -17.998 1.00 35.33 H new ATOM 0 HB3 GLN A 948 18.926 -9.875 -18.360 1.00 35.33 H new ATOM 0 HG2 GLN A 948 20.413 -8.563 -16.532 1.00 0.42 H new ATOM 0 HG3 GLN A 948 18.825 -8.053 -15.994 1.00 0.42 H new ATOM 0 HE21 GLN A 948 21.162 -10.254 -15.423 1.00 1.22 H new ATOM 0 HE22 GLN A 948 20.194 -11.612 -14.842 1.00 1.22 H new ATOM 652 N VAL A 949 18.107 -7.163 -20.631 1.00 73.44 N ATOM 653 CA VAL A 949 17.486 -7.149 -21.950 1.00 53.14 C ATOM 654 C VAL A 949 18.516 -6.876 -23.040 1.00 64.52 C ATOM 655 O VAL A 949 18.715 -7.693 -23.940 1.00 24.13 O ATOM 656 CB VAL A 949 16.373 -6.088 -22.035 1.00 54.41 C ATOM 657 CG1 VAL A 949 15.827 -5.998 -23.452 1.00 13.10 C ATOM 658 CG2 VAL A 949 15.261 -6.402 -21.045 1.00 51.14 C ATOM 0 H VAL A 949 17.734 -6.470 -19.982 1.00 73.44 H new ATOM 0 HA VAL A 949 17.050 -8.136 -22.105 1.00 53.14 H new ATOM 0 HB VAL A 949 16.798 -5.119 -21.774 1.00 54.41 H new ATOM 0 HG11 VAL A 949 15.042 -5.243 -23.492 1.00 13.10 H new ATOM 0 HG12 VAL A 949 16.631 -5.722 -24.135 1.00 13.10 H new ATOM 0 HG13 VAL A 949 15.417 -6.964 -23.746 1.00 13.10 H new ATOM 0 HG21 VAL A 949 14.483 -5.642 -21.119 1.00 51.14 H new ATOM 0 HG22 VAL A 949 14.836 -7.380 -21.273 1.00 51.14 H new ATOM 0 HG23 VAL A 949 15.666 -6.410 -20.033 1.00 51.14 H new ATOM 668 N VAL A 950 19.171 -5.723 -22.953 1.00 52.32 N ATOM 669 CA VAL A 950 20.183 -5.342 -23.931 1.00 22.31 C ATOM 670 C VAL A 950 21.275 -6.401 -24.032 1.00 22.44 C ATOM 671 O VAL A 950 21.650 -6.822 -25.127 1.00 11.50 O ATOM 672 CB VAL A 950 20.827 -3.989 -23.575 1.00 30.11 C ATOM 673 CG1 VAL A 950 21.937 -3.650 -24.559 1.00 33.35 C ATOM 674 CG2 VAL A 950 19.775 -2.890 -23.546 1.00 22.52 C ATOM 0 H VAL A 950 19.019 -5.036 -22.215 1.00 52.32 H new ATOM 0 HA VAL A 950 19.677 -5.253 -24.892 1.00 22.31 H new ATOM 0 HB VAL A 950 21.267 -4.066 -22.581 1.00 30.11 H new ATOM 0 HG11 VAL A 950 22.380 -2.691 -24.291 1.00 33.35 H new ATOM 0 HG12 VAL A 950 22.702 -4.425 -24.525 1.00 33.35 H new ATOM 0 HG13 VAL A 950 21.525 -3.591 -25.566 1.00 33.35 H new ATOM 0 HG21 VAL A 950 20.247 -1.941 -23.293 1.00 22.52 H new ATOM 0 HG22 VAL A 950 19.304 -2.811 -24.526 1.00 22.52 H new ATOM 0 HG23 VAL A 950 19.019 -3.130 -22.798 1.00 22.52 H new ATOM 684 N THR A 951 21.783 -6.831 -22.881 1.00 5.14 N ATOM 685 CA THR A 951 22.833 -7.841 -22.838 1.00 43.13 C ATOM 686 C THR A 951 22.439 -9.078 -23.637 1.00 12.11 C ATOM 687 O THR A 951 23.268 -9.675 -24.322 1.00 71.24 O ATOM 688 CB THR A 951 23.153 -8.259 -21.391 1.00 12.24 C ATOM 689 OG1 THR A 951 23.630 -7.131 -20.649 1.00 43.41 O ATOM 690 CG2 THR A 951 24.195 -9.367 -21.365 1.00 14.04 C ATOM 0 H THR A 951 21.484 -6.495 -21.966 1.00 5.14 H new ATOM 0 HA THR A 951 23.721 -7.392 -23.283 1.00 43.13 H new ATOM 0 HB THR A 951 22.237 -8.633 -20.934 1.00 12.24 H new ATOM 0 HG1 THR A 951 22.869 -6.636 -20.281 1.00 43.41 H new ATOM 0 HG21 THR A 951 24.405 -9.645 -20.332 1.00 14.04 H new ATOM 0 HG22 THR A 951 23.817 -10.235 -21.905 1.00 14.04 H new ATOM 0 HG23 THR A 951 25.111 -9.016 -21.839 1.00 14.04 H new ATOM 698 N GLU A 952 21.168 -9.456 -23.544 1.00 32.32 N ATOM 699 CA GLU A 952 20.665 -10.623 -24.259 1.00 34.43 C ATOM 700 C GLU A 952 20.695 -10.392 -25.767 1.00 21.52 C ATOM 701 O GLU A 952 21.224 -11.210 -26.521 1.00 71.21 O ATOM 702 CB GLU A 952 19.238 -10.948 -23.810 1.00 62.11 C ATOM 703 CG GLU A 952 18.850 -12.402 -24.020 1.00 24.12 C ATOM 704 CD GLU A 952 19.549 -13.338 -23.053 1.00 3.34 C ATOM 705 OE1 GLU A 952 19.687 -12.971 -21.867 1.00 24.41 O ATOM 706 OE2 GLU A 952 19.958 -14.437 -23.482 1.00 41.12 O ATOM 0 H GLU A 952 20.469 -8.972 -22.981 1.00 32.32 H new ATOM 0 HA GLU A 952 21.313 -11.468 -24.025 1.00 34.43 H new ATOM 0 HB2 GLU A 952 19.134 -10.702 -22.753 1.00 62.11 H new ATOM 0 HB3 GLU A 952 18.541 -10.312 -24.356 1.00 62.11 H new ATOM 0 HG2 GLU A 952 17.771 -12.506 -23.905 1.00 24.12 H new ATOM 0 HG3 GLU A 952 19.092 -12.695 -25.042 1.00 24.12 H new ATOM 713 N LEU A 953 20.124 -9.274 -26.200 1.00 11.14 N ATOM 714 CA LEU A 953 20.084 -8.934 -27.618 1.00 24.22 C ATOM 715 C LEU A 953 21.489 -8.919 -28.213 1.00 54.43 C ATOM 716 O LEU A 953 21.716 -9.435 -29.308 1.00 71.13 O ATOM 717 CB LEU A 953 19.418 -7.572 -27.818 1.00 3.34 C ATOM 718 CG LEU A 953 18.028 -7.408 -27.203 1.00 54.02 C ATOM 719 CD1 LEU A 953 17.378 -6.122 -27.689 1.00 13.43 C ATOM 720 CD2 LEU A 953 17.153 -8.608 -27.536 1.00 20.13 C ATOM 0 H LEU A 953 19.682 -8.587 -25.589 1.00 11.14 H new ATOM 0 HA LEU A 953 19.499 -9.696 -28.133 1.00 24.22 H new ATOM 0 HB2 LEU A 953 20.071 -6.806 -27.400 1.00 3.34 H new ATOM 0 HB3 LEU A 953 19.345 -7.379 -28.888 1.00 3.34 H new ATOM 0 HG LEU A 953 18.135 -7.350 -26.120 1.00 54.02 H new ATOM 0 HD11 LEU A 953 16.389 -6.022 -27.241 1.00 13.43 H new ATOM 0 HD12 LEU A 953 17.995 -5.271 -27.400 1.00 13.43 H new ATOM 0 HD13 LEU A 953 17.283 -6.150 -28.775 1.00 13.43 H new ATOM 0 HD21 LEU A 953 16.167 -8.474 -27.090 1.00 20.13 H new ATOM 0 HD22 LEU A 953 17.053 -8.696 -28.618 1.00 20.13 H new ATOM 0 HD23 LEU A 953 17.611 -9.514 -27.139 1.00 20.13 H new ATOM 732 N LEU A 954 22.428 -8.325 -27.485 1.00 72.11 N ATOM 733 CA LEU A 954 23.812 -8.244 -27.940 1.00 75.20 C ATOM 734 C LEU A 954 24.391 -9.636 -28.171 1.00 71.23 C ATOM 735 O LEU A 954 24.751 -9.990 -29.294 1.00 11.33 O ATOM 736 CB LEU A 954 24.662 -7.489 -26.917 1.00 51.23 C ATOM 737 CG LEU A 954 25.801 -6.642 -27.486 1.00 64.41 C ATOM 738 CD1 LEU A 954 25.249 -5.466 -28.277 1.00 25.25 C ATOM 739 CD2 LEU A 954 26.713 -6.156 -26.369 1.00 42.12 C ATOM 0 H LEU A 954 22.257 -7.892 -26.577 1.00 72.11 H new ATOM 0 HA LEU A 954 23.827 -7.703 -28.886 1.00 75.20 H new ATOM 0 HB2 LEU A 954 24.006 -6.838 -26.339 1.00 51.23 H new ATOM 0 HB3 LEU A 954 25.087 -8.213 -26.222 1.00 51.23 H new ATOM 0 HG LEU A 954 26.388 -7.264 -28.162 1.00 64.41 H new ATOM 0 HD11 LEU A 954 26.074 -4.875 -28.674 1.00 25.25 H new ATOM 0 HD12 LEU A 954 24.639 -5.836 -29.101 1.00 25.25 H new ATOM 0 HD13 LEU A 954 24.638 -4.843 -27.624 1.00 25.25 H new ATOM 0 HD21 LEU A 954 27.518 -5.555 -26.792 1.00 42.12 H new ATOM 0 HD22 LEU A 954 26.139 -5.551 -25.667 1.00 42.12 H new ATOM 0 HD23 LEU A 954 27.137 -7.013 -25.846 1.00 42.12 H new ATOM 751 N GLN A 955 24.476 -10.421 -27.102 1.00 75.42 N ATOM 752 CA GLN A 955 25.010 -11.775 -27.190 1.00 32.32 C ATOM 753 C GLN A 955 24.267 -12.586 -28.247 1.00 22.12 C ATOM 754 O GLN A 955 24.884 -13.229 -29.098 1.00 34.25 O ATOM 755 CB GLN A 955 24.912 -12.474 -25.832 1.00 51.44 C ATOM 756 CG GLN A 955 25.933 -11.981 -24.820 1.00 1.12 C ATOM 757 CD GLN A 955 26.167 -12.973 -23.697 1.00 45.35 C ATOM 758 OE1 GLN A 955 27.247 -13.555 -23.583 1.00 54.31 O ATOM 759 NE2 GLN A 955 25.155 -13.171 -22.861 1.00 44.40 N ATOM 0 H GLN A 955 24.182 -10.143 -26.166 1.00 75.42 H new ATOM 0 HA GLN A 955 26.058 -11.707 -27.481 1.00 32.32 H new ATOM 0 HB2 GLN A 955 23.911 -12.326 -25.428 1.00 51.44 H new ATOM 0 HB3 GLN A 955 25.042 -13.547 -25.974 1.00 51.44 H new ATOM 0 HG2 GLN A 955 26.877 -11.784 -25.328 1.00 1.12 H new ATOM 0 HG3 GLN A 955 25.594 -11.034 -24.399 1.00 1.12 H new ATOM 0 HE21 GLN A 955 24.278 -12.667 -22.993 1.00 44.40 H new ATOM 0 HE22 GLN A 955 25.254 -13.827 -22.086 1.00 44.40 H new ATOM 768 N LEU A 956 22.941 -12.552 -28.187 1.00 54.13 N ATOM 769 CA LEU A 956 22.113 -13.284 -29.140 1.00 31.24 C ATOM 770 C LEU A 956 22.521 -12.964 -30.574 1.00 72.42 C ATOM 771 O LEU A 956 22.534 -13.842 -31.436 1.00 55.24 O ATOM 772 CB LEU A 956 20.636 -12.944 -28.929 1.00 44.03 C ATOM 773 CG LEU A 956 19.629 -13.927 -29.528 1.00 3.41 C ATOM 774 CD1 LEU A 956 19.638 -13.841 -31.046 1.00 53.12 C ATOM 775 CD2 LEU A 956 19.933 -15.346 -29.070 1.00 55.03 C ATOM 0 H LEU A 956 22.416 -12.026 -27.489 1.00 54.13 H new ATOM 0 HA LEU A 956 22.262 -14.350 -28.969 1.00 31.24 H new ATOM 0 HB2 LEU A 956 20.450 -12.872 -27.857 1.00 44.03 H new ATOM 0 HB3 LEU A 956 20.447 -11.958 -29.352 1.00 44.03 H new ATOM 0 HG LEU A 956 18.633 -13.658 -29.176 1.00 3.41 H new ATOM 0 HD11 LEU A 956 18.915 -14.547 -31.455 1.00 53.12 H new ATOM 0 HD12 LEU A 956 19.372 -12.830 -31.355 1.00 53.12 H new ATOM 0 HD13 LEU A 956 20.633 -14.084 -31.418 1.00 53.12 H new ATOM 0 HD21 LEU A 956 19.207 -16.032 -29.506 1.00 55.03 H new ATOM 0 HD22 LEU A 956 20.936 -15.626 -29.393 1.00 55.03 H new ATOM 0 HD23 LEU A 956 19.874 -15.398 -27.983 1.00 55.03 H new ATOM 787 N ASN A 957 22.856 -11.702 -30.821 1.00 74.14 N ATOM 788 CA ASN A 957 23.266 -11.267 -32.151 1.00 50.34 C ATOM 789 C ASN A 957 24.712 -11.664 -32.432 1.00 1.13 C ATOM 790 O ASN A 957 25.104 -11.848 -33.583 1.00 74.43 O ATOM 791 CB ASN A 957 23.106 -9.751 -32.286 1.00 43.04 C ATOM 792 CG ASN A 957 22.084 -9.369 -33.339 1.00 50.22 C ATOM 793 OD1 ASN A 957 21.129 -10.104 -33.589 1.00 34.25 O ATOM 794 ND2 ASN A 957 22.281 -8.213 -33.963 1.00 61.32 N ATOM 0 H ASN A 957 22.852 -10.963 -30.118 1.00 74.14 H new ATOM 0 HA ASN A 957 22.624 -11.760 -32.881 1.00 50.34 H new ATOM 0 HB2 ASN A 957 22.807 -9.333 -31.325 1.00 43.04 H new ATOM 0 HB3 ASN A 957 24.069 -9.308 -32.541 1.00 43.04 H new ATOM 0 HD21 ASN A 957 21.627 -7.903 -34.681 1.00 61.32 H new ATOM 0 HD22 ASN A 957 23.087 -7.635 -33.724 1.00 61.32 H new ATOM 801 N ASN A 958 25.501 -11.794 -31.370 1.00 33.22 N ATOM 802 CA ASN A 958 26.904 -12.170 -31.501 1.00 52.32 C ATOM 803 C ASN A 958 27.041 -13.652 -31.837 1.00 2.33 C ATOM 804 O ASN A 958 27.952 -14.053 -32.560 1.00 55.34 O ATOM 805 CB ASN A 958 27.661 -11.856 -30.209 1.00 55.51 C ATOM 806 CG ASN A 958 29.164 -11.851 -30.406 1.00 42.53 C ATOM 807 OD1 ASN A 958 29.694 -11.075 -31.202 1.00 64.54 O ATOM 808 ND2 ASN A 958 29.859 -12.719 -29.680 1.00 52.41 N ATOM 0 H ASN A 958 25.192 -11.644 -30.409 1.00 33.22 H new ATOM 0 HA ASN A 958 27.335 -11.589 -32.317 1.00 52.32 H new ATOM 0 HB2 ASN A 958 27.344 -10.884 -29.832 1.00 55.51 H new ATOM 0 HB3 ASN A 958 27.399 -12.593 -29.450 1.00 55.51 H new ATOM 0 HD21 ASN A 958 30.874 -12.761 -29.770 1.00 52.41 H new ATOM 0 HD22 ASN A 958 29.378 -13.343 -29.033 1.00 52.41 H new ATOM 815 N ASN A 959 26.130 -14.460 -31.305 1.00 73.04 N ATOM 816 CA ASN A 959 26.149 -15.898 -31.548 1.00 52.14 C ATOM 817 C ASN A 959 27.553 -16.463 -31.358 1.00 20.21 C ATOM 818 O ASN A 959 27.721 -17.643 -31.052 1.00 21.25 O ATOM 819 CB ASN A 959 25.651 -16.204 -32.963 1.00 2.15 C ATOM 820 CG ASN A 959 26.756 -16.109 -33.997 1.00 52.23 C ATOM 821 OD1 ASN A 959 27.621 -16.981 -34.080 1.00 12.10 O ATOM 822 ND2 ASN A 959 26.731 -15.046 -34.793 1.00 2.33 N ATOM 0 H ASN A 959 25.370 -14.144 -30.703 1.00 73.04 H new ATOM 0 HA ASN A 959 25.485 -16.372 -30.826 1.00 52.14 H new ATOM 0 HB2 ASN A 959 25.221 -17.205 -32.985 1.00 2.15 H new ATOM 0 HB3 ASN A 959 24.853 -15.509 -33.223 1.00 2.15 H new ATOM 0 HD21 ASN A 959 27.448 -14.928 -35.509 1.00 2.33 H new ATOM 0 HD22 ASN A 959 25.995 -14.348 -34.689 1.00 2.33 H new TER 829 ASN A 959