USER MOD reduce.3.24.130724 H: found=0, std=0, add=1087, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 1084 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 Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.104 USER MOD Single : A 7 SER OG : rot 180:sc= 0.00565 USER MOD Single : A 9 HIS : no HD1:sc= -0.0801 X(o=-0.08,f=-0.00029) USER MOD Single : A 13 TYR OH : rot -59:sc= 0.993 USER MOD Single : A 15 SER OG : rot 29:sc= -0.693 USER MOD Single : A 20 THR OG1 : rot 180:sc= -0.23 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0357 USER MOD Single : A 33 ASN : amide:sc= -0.181 X(o=-0.18,f=-0.18) USER MOD Single : A 41 ASN : amide:sc= -0.0943 K(o=-0.094,f=-0.66) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ -162:sc= 0.967 (180deg=0.755) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ -111:sc= -0.396 (180deg=-1.57!) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0223 USER MOD Single : A 73 THR OG1 : rot 180:sc= -0.421 USER MOD Single : A 80 HIS : no HE2:sc= -0.475 K(o=-0.47,f=-1.8) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.0485 USER MOD Single : A 94 SER OG : rot 26:sc= 0.514 USER MOD Single : A 99 HIS : no HD1:sc= -0.209 X(o=-0.21,f=-0.61) USER MOD Single : A 106 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= -0.992 K(o=-0.99,f=-6!) USER MOD Single : A 124 ASN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 125 GLN : amide:sc= -4.89 K(o=-4.9,f=-5.4!) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -2.39 X(o=-2.4,f=-2) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 3 2.607 -2.548 -11.005 1.00 63.21 N ATOM 2 CA ASP A 3 1.333 -2.943 -10.415 1.00 1.10 C ATOM 3 C ASP A 3 0.427 -1.732 -10.216 1.00 54.11 C ATOM 4 O ASP A 3 0.890 -0.591 -10.214 1.00 24.32 O ATOM 5 CB ASP A 3 1.562 -3.649 -9.079 1.00 23.13 C ATOM 6 CG ASP A 3 1.706 -5.151 -9.234 1.00 5.44 C ATOM 7 OD1 ASP A 3 2.654 -5.588 -9.918 1.00 40.21 O ATOM 8 OD2 ASP A 3 0.868 -5.888 -8.673 1.00 10.33 O1- ATOM 0 HA ASP A 3 0.842 -3.633 -11.102 1.00 1.10 H new ATOM 0 HB2 ASP A 3 2.460 -3.248 -8.609 1.00 23.13 H new ATOM 0 HB3 ASP A 3 0.728 -3.434 -8.410 1.00 23.13 H new ATOM 13 N VAL A 4 -0.867 -1.987 -10.049 1.00 1.21 N ATOM 14 CA VAL A 4 -1.837 -0.918 -9.849 1.00 45.01 C ATOM 15 C VAL A 4 -2.708 -1.189 -8.627 1.00 4.33 C ATOM 16 O VAL A 4 -2.945 -2.341 -8.262 1.00 12.14 O ATOM 17 CB VAL A 4 -2.742 -0.743 -11.083 1.00 11.04 C ATOM 18 CG1 VAL A 4 -3.638 -1.960 -11.265 1.00 11.12 C ATOM 19 CG2 VAL A 4 -3.573 0.526 -10.958 1.00 24.21 C ATOM 0 H VAL A 4 -1.267 -2.925 -10.048 1.00 1.21 H new ATOM 0 HA VAL A 4 -1.270 -0.001 -9.691 1.00 45.01 H new ATOM 0 HB VAL A 4 -2.110 -0.651 -11.966 1.00 11.04 H new ATOM 0 HG11 VAL A 4 -4.270 -1.818 -12.142 1.00 11.12 H new ATOM 0 HG12 VAL A 4 -3.022 -2.848 -11.402 1.00 11.12 H new ATOM 0 HG13 VAL A 4 -4.265 -2.086 -10.382 1.00 11.12 H new ATOM 0 HG21 VAL A 4 -4.207 0.634 -11.838 1.00 24.21 H new ATOM 0 HG22 VAL A 4 -4.197 0.466 -10.067 1.00 24.21 H new ATOM 0 HG23 VAL A 4 -2.911 1.388 -10.879 1.00 24.21 H new ATOM 29 N TYR A 5 -3.185 -0.120 -7.998 1.00 14.41 N ATOM 30 CA TYR A 5 -4.029 -0.242 -6.816 1.00 14.11 C ATOM 31 C TYR A 5 -5.273 0.633 -6.941 1.00 34.31 C ATOM 32 O TYR A 5 -5.221 1.732 -7.496 1.00 3.50 O ATOM 33 CB TYR A 5 -3.244 0.145 -5.561 1.00 22.13 C ATOM 34 CG TYR A 5 -2.678 1.546 -5.610 1.00 23.14 C ATOM 35 CD1 TYR A 5 -3.434 2.637 -5.196 1.00 4.24 C ATOM 36 CD2 TYR A 5 -1.388 1.781 -6.069 1.00 11.34 C ATOM 37 CE1 TYR A 5 -2.921 3.919 -5.239 1.00 42.42 C ATOM 38 CE2 TYR A 5 -0.867 3.058 -6.114 1.00 71.45 C ATOM 39 CZ TYR A 5 -1.637 4.125 -5.699 1.00 3.24 C ATOM 40 OH TYR A 5 -1.121 5.400 -5.744 1.00 3.20 O ATOM 0 H TYR A 5 -3.001 0.841 -8.288 1.00 14.41 H new ATOM 0 HA TYR A 5 -4.345 -1.282 -6.733 1.00 14.11 H new ATOM 0 HB2 TYR A 5 -3.896 0.056 -4.692 1.00 22.13 H new ATOM 0 HB3 TYR A 5 -2.427 -0.563 -5.420 1.00 22.13 H new ATOM 0 HD1 TYR A 5 -4.439 2.480 -4.835 1.00 4.24 H new ATOM 0 HD2 TYR A 5 -0.782 0.949 -6.397 1.00 11.34 H new ATOM 0 HE1 TYR A 5 -3.522 4.755 -4.914 1.00 42.42 H new ATOM 0 HE2 TYR A 5 0.139 3.221 -6.472 1.00 71.45 H new ATOM 0 HH TYR A 5 -0.205 5.370 -6.092 1.00 3.20 H new ATOM 50 N THR A 6 -6.392 0.138 -6.422 1.00 71.00 N ATOM 51 CA THR A 6 -7.650 0.872 -6.476 1.00 14.31 C ATOM 52 C THR A 6 -8.034 1.406 -5.100 1.00 73.50 C ATOM 53 O THR A 6 -7.623 0.861 -4.076 1.00 43.33 O ATOM 54 CB THR A 6 -8.794 -0.011 -7.009 1.00 51.52 C ATOM 55 OG1 THR A 6 -10.046 0.667 -6.860 1.00 70.22 O ATOM 56 CG2 THR A 6 -8.839 -1.340 -6.272 1.00 71.11 C ATOM 0 H THR A 6 -6.453 -0.769 -5.959 1.00 71.00 H new ATOM 0 HA THR A 6 -7.499 1.708 -7.159 1.00 14.31 H new ATOM 0 HB THR A 6 -8.612 -0.206 -8.066 1.00 51.52 H new ATOM 0 HG1 THR A 6 -10.768 0.100 -7.203 1.00 70.22 H new ATOM 0 HG21 THR A 6 -9.655 -1.947 -6.665 1.00 71.11 H new ATOM 0 HG22 THR A 6 -7.895 -1.866 -6.413 1.00 71.11 H new ATOM 0 HG23 THR A 6 -9.000 -1.161 -5.209 1.00 71.11 H new ATOM 64 N SER A 7 -8.825 2.474 -5.085 1.00 24.13 N ATOM 65 CA SER A 7 -9.262 3.084 -3.835 1.00 4.43 C ATOM 66 C SER A 7 -10.624 2.541 -3.413 1.00 34.24 C ATOM 67 O SER A 7 -11.163 1.631 -4.042 1.00 13.42 O ATOM 68 CB SER A 7 -9.329 4.605 -3.981 1.00 10.54 C ATOM 69 OG SER A 7 -8.631 5.039 -5.135 1.00 74.54 O ATOM 0 H SER A 7 -9.176 2.935 -5.924 1.00 24.13 H new ATOM 0 HA SER A 7 -8.535 2.833 -3.063 1.00 4.43 H new ATOM 0 HB2 SER A 7 -10.370 4.922 -4.042 1.00 10.54 H new ATOM 0 HB3 SER A 7 -8.903 5.077 -3.096 1.00 10.54 H new ATOM 0 HG SER A 7 -8.691 6.015 -5.206 1.00 74.54 H new ATOM 75 N ILE A 8 -11.175 3.108 -2.346 1.00 55.43 N ATOM 76 CA ILE A 8 -12.474 2.683 -1.840 1.00 25.01 C ATOM 77 C ILE A 8 -13.587 3.027 -2.825 1.00 21.43 C ATOM 78 O ILE A 8 -13.634 4.133 -3.364 1.00 13.54 O ATOM 79 CB ILE A 8 -12.789 3.333 -0.480 1.00 54.34 C ATOM 80 CG1 ILE A 8 -11.638 3.099 0.501 1.00 4.33 C ATOM 81 CG2 ILE A 8 -14.091 2.781 0.081 1.00 52.02 C ATOM 82 CD1 ILE A 8 -10.825 4.342 0.784 1.00 12.02 C ATOM 0 H ILE A 8 -10.742 3.863 -1.815 1.00 55.43 H new ATOM 0 HA ILE A 8 -12.425 1.601 -1.714 1.00 25.01 H new ATOM 0 HB ILE A 8 -12.905 4.407 -0.625 1.00 54.34 H new ATOM 0 HG12 ILE A 8 -12.042 2.717 1.439 1.00 4.33 H new ATOM 0 HG13 ILE A 8 -10.980 2.328 0.100 1.00 4.33 H new ATOM 0 HG21 ILE A 8 -14.301 3.250 1.043 1.00 52.02 H new ATOM 0 HG22 ILE A 8 -14.905 2.994 -0.612 1.00 52.02 H new ATOM 0 HG23 ILE A 8 -14.001 1.703 0.215 1.00 52.02 H new ATOM 0 HD11 ILE A 8 -10.027 4.103 1.487 1.00 12.02 H new ATOM 0 HD12 ILE A 8 -10.392 4.713 -0.145 1.00 12.02 H new ATOM 0 HD13 ILE A 8 -11.470 5.108 1.215 1.00 12.02 H new ATOM 94 N HIS A 9 -14.482 2.071 -3.055 1.00 22.41 N ATOM 95 CA HIS A 9 -15.596 2.273 -3.974 1.00 40.14 C ATOM 96 C HIS A 9 -16.792 2.888 -3.252 1.00 0.44 C ATOM 97 O HIS A 9 -16.898 2.808 -2.028 1.00 31.34 O ATOM 98 CB HIS A 9 -16.002 0.946 -4.616 1.00 13.31 C ATOM 99 CG HIS A 9 -15.327 0.684 -5.927 1.00 14.24 C ATOM 100 ND1 HIS A 9 -15.855 -0.147 -6.893 1.00 60.14 N ATOM 101 CD2 HIS A 9 -14.159 1.148 -6.430 1.00 65.44 C ATOM 102 CE1 HIS A 9 -15.040 -0.182 -7.933 1.00 42.51 C ATOM 103 NE2 HIS A 9 -14.003 0.595 -7.677 1.00 14.34 N ATOM 0 H HIS A 9 -14.457 1.150 -2.618 1.00 22.41 H new ATOM 0 HA HIS A 9 -15.271 2.962 -4.754 1.00 40.14 H new ATOM 0 HB2 HIS A 9 -15.770 0.133 -3.928 1.00 13.31 H new ATOM 0 HB3 HIS A 9 -17.082 0.939 -4.765 1.00 13.31 H new ATOM 0 HD2 HIS A 9 -13.476 1.827 -5.941 1.00 65.44 H new ATOM 0 HE1 HIS A 9 -15.196 -0.750 -8.839 1.00 42.51 H new ATOM 0 HE2 HIS A 9 -13.215 0.758 -8.304 1.00 14.34 H new ATOM 111 N ILE A 10 -17.686 3.503 -4.017 1.00 62.41 N ATOM 112 CA ILE A 10 -18.873 4.132 -3.450 1.00 5.23 C ATOM 113 C ILE A 10 -20.144 3.574 -4.079 1.00 41.15 C ATOM 114 O ILE A 10 -20.348 3.676 -5.288 1.00 13.04 O ATOM 115 CB ILE A 10 -18.847 5.660 -3.642 1.00 51.44 C ATOM 116 CG1 ILE A 10 -17.623 6.262 -2.949 1.00 72.52 C ATOM 117 CG2 ILE A 10 -20.127 6.283 -3.104 1.00 54.40 C ATOM 118 CD1 ILE A 10 -17.646 6.115 -1.444 1.00 33.02 C ATOM 0 H ILE A 10 -17.612 3.580 -5.031 1.00 62.41 H new ATOM 0 HA ILE A 10 -18.869 3.908 -2.383 1.00 5.23 H new ATOM 0 HB ILE A 10 -18.781 5.877 -4.708 1.00 51.44 H new ATOM 0 HG12 ILE A 10 -16.724 5.785 -3.339 1.00 72.52 H new ATOM 0 HG13 ILE A 10 -17.557 7.320 -3.201 1.00 72.52 H new ATOM 0 HG21 ILE A 10 -20.094 7.363 -3.247 1.00 54.40 H new ATOM 0 HG22 ILE A 10 -20.984 5.872 -3.638 1.00 54.40 H new ATOM 0 HG23 ILE A 10 -20.221 6.060 -2.041 1.00 54.40 H new ATOM 0 HD11 ILE A 10 -16.748 6.564 -1.021 1.00 33.02 H new ATOM 0 HD12 ILE A 10 -18.526 6.617 -1.043 1.00 33.02 H new ATOM 0 HD13 ILE A 10 -17.680 5.057 -1.182 1.00 33.02 H new ATOM 130 N GLU A 11 -21.000 2.984 -3.248 1.00 14.33 N ATOM 131 CA GLU A 11 -22.253 2.410 -3.723 1.00 21.25 C ATOM 132 C GLU A 11 -23.322 3.487 -3.873 1.00 42.40 C ATOM 133 O GLU A 11 -23.225 4.559 -3.277 1.00 51.11 O ATOM 134 CB GLU A 11 -22.739 1.323 -2.763 1.00 50.43 C ATOM 135 CG GLU A 11 -22.316 -0.080 -3.166 1.00 44.11 C ATOM 136 CD GLU A 11 -23.303 -1.139 -2.715 1.00 11.42 C ATOM 137 OE1 GLU A 11 -23.358 -1.420 -1.500 1.00 55.02 O ATOM 138 OE2 GLU A 11 -24.021 -1.686 -3.578 1.00 31.51 O1- ATOM 0 H GLU A 11 -20.848 2.892 -2.244 1.00 14.33 H new ATOM 0 HA GLU A 11 -22.071 1.965 -4.701 1.00 21.25 H new ATOM 0 HB2 GLU A 11 -22.358 1.535 -1.764 1.00 50.43 H new ATOM 0 HB3 GLU A 11 -23.827 1.362 -2.704 1.00 50.43 H new ATOM 0 HG2 GLU A 11 -22.209 -0.126 -4.250 1.00 44.11 H new ATOM 0 HG3 GLU A 11 -21.336 -0.297 -2.740 1.00 44.11 H new ATOM 145 N GLU A 12 -24.343 3.194 -4.674 1.00 22.22 N ATOM 146 CA GLU A 12 -25.430 4.138 -4.903 1.00 35.34 C ATOM 147 C GLU A 12 -26.767 3.413 -5.008 1.00 30.44 C ATOM 148 O GLU A 12 -27.015 2.680 -5.967 1.00 41.32 O ATOM 149 CB GLU A 12 -25.174 4.946 -6.176 1.00 64.20 C ATOM 150 CG GLU A 12 -26.184 6.059 -6.405 1.00 75.35 C ATOM 151 CD GLU A 12 -25.637 7.173 -7.275 1.00 25.02 C ATOM 152 OE1 GLU A 12 -24.933 8.055 -6.738 1.00 51.50 O ATOM 153 OE2 GLU A 12 -25.912 7.165 -8.493 1.00 22.11 O1- ATOM 0 H GLU A 12 -24.439 2.311 -5.175 1.00 22.22 H new ATOM 0 HA GLU A 12 -25.471 4.818 -4.052 1.00 35.34 H new ATOM 0 HB2 GLU A 12 -24.175 5.378 -6.127 1.00 64.20 H new ATOM 0 HB3 GLU A 12 -25.188 4.272 -7.033 1.00 64.20 H new ATOM 0 HG2 GLU A 12 -27.077 5.644 -6.872 1.00 75.35 H new ATOM 0 HG3 GLU A 12 -26.489 6.471 -5.443 1.00 75.35 H new ATOM 160 N TYR A 13 -27.627 3.621 -4.017 1.00 22.50 N ATOM 161 CA TYR A 13 -28.939 2.985 -3.996 1.00 61.54 C ATOM 162 C TYR A 13 -30.046 4.011 -4.220 1.00 2.15 C ATOM 163 O TYR A 13 -29.924 5.168 -3.819 1.00 12.31 O ATOM 164 CB TYR A 13 -29.158 2.265 -2.665 1.00 3.33 C ATOM 165 CG TYR A 13 -28.378 0.975 -2.539 1.00 52.40 C ATOM 166 CD1 TYR A 13 -27.065 0.977 -2.087 1.00 2.40 C ATOM 167 CD2 TYR A 13 -28.956 -0.244 -2.870 1.00 44.14 C ATOM 168 CE1 TYR A 13 -26.349 -0.199 -1.971 1.00 40.42 C ATOM 169 CE2 TYR A 13 -28.249 -1.425 -2.756 1.00 2.10 C ATOM 170 CZ TYR A 13 -26.945 -1.397 -2.306 1.00 52.02 C ATOM 171 OH TYR A 13 -26.235 -2.570 -2.190 1.00 41.41 O ATOM 0 H TYR A 13 -27.439 4.226 -3.217 1.00 22.50 H new ATOM 0 HA TYR A 13 -28.974 2.257 -4.806 1.00 61.54 H new ATOM 0 HB2 TYR A 13 -28.876 2.932 -1.850 1.00 3.33 H new ATOM 0 HB3 TYR A 13 -30.220 2.050 -2.548 1.00 3.33 H new ATOM 0 HD1 TYR A 13 -26.596 1.913 -1.822 1.00 2.40 H new ATOM 0 HD2 TYR A 13 -29.976 -0.269 -3.223 1.00 44.14 H new ATOM 0 HE1 TYR A 13 -25.328 -0.180 -1.620 1.00 40.42 H new ATOM 0 HE2 TYR A 13 -28.714 -2.364 -3.017 1.00 2.10 H new ATOM 0 HH TYR A 13 -25.436 -2.526 -2.755 1.00 41.41 H new ATOM 181 N GLU A 14 -31.125 3.577 -4.864 1.00 51.13 N ATOM 182 CA GLU A 14 -32.253 4.458 -5.142 1.00 44.05 C ATOM 183 C GLU A 14 -33.522 3.946 -4.464 1.00 34.43 C ATOM 184 O GLU A 14 -33.702 2.742 -4.288 1.00 43.23 O ATOM 185 CB GLU A 14 -32.479 4.574 -6.651 1.00 41.01 C ATOM 186 CG GLU A 14 -32.768 5.991 -7.116 1.00 63.43 C ATOM 187 CD GLU A 14 -32.521 6.179 -8.600 1.00 53.14 C ATOM 188 OE1 GLU A 14 -31.758 5.378 -9.181 1.00 2.11 O ATOM 189 OE2 GLU A 14 -33.090 7.127 -9.181 1.00 40.11 O1- ATOM 0 H GLU A 14 -31.242 2.622 -5.203 1.00 51.13 H new ATOM 0 HA GLU A 14 -32.019 5.444 -4.741 1.00 44.05 H new ATOM 0 HB2 GLU A 14 -31.596 4.203 -7.172 1.00 41.01 H new ATOM 0 HB3 GLU A 14 -33.311 3.930 -6.936 1.00 41.01 H new ATOM 0 HG2 GLU A 14 -33.805 6.239 -6.890 1.00 63.43 H new ATOM 0 HG3 GLU A 14 -32.144 6.688 -6.556 1.00 63.43 H new ATOM 196 N SER A 15 -34.398 4.872 -4.086 1.00 45.22 N ATOM 197 CA SER A 15 -35.648 4.517 -3.425 1.00 21.12 C ATOM 198 C SER A 15 -36.644 5.670 -3.490 1.00 40.40 C ATOM 199 O SER A 15 -36.480 6.684 -2.814 1.00 61.11 O ATOM 200 CB SER A 15 -35.386 4.136 -1.966 1.00 50.55 C ATOM 201 OG SER A 15 -35.147 2.745 -1.838 1.00 60.35 O ATOM 0 H SER A 15 -34.265 5.873 -4.226 1.00 45.22 H new ATOM 0 HA SER A 15 -36.076 3.661 -3.946 1.00 21.12 H new ATOM 0 HB2 SER A 15 -34.527 4.692 -1.590 1.00 50.55 H new ATOM 0 HB3 SER A 15 -36.242 4.419 -1.353 1.00 50.55 H new ATOM 0 HG SER A 15 -34.754 2.403 -2.668 1.00 60.35 H new ATOM 207 N GLU A 16 -37.677 5.505 -4.312 1.00 11.34 N ATOM 208 CA GLU A 16 -38.700 6.533 -4.467 1.00 40.23 C ATOM 209 C GLU A 16 -40.094 5.947 -4.266 1.00 3.23 C ATOM 210 O GLU A 16 -40.395 4.855 -4.747 1.00 64.35 O ATOM 211 CB GLU A 16 -38.600 7.179 -5.851 1.00 4.30 C ATOM 212 CG GLU A 16 -39.171 6.318 -6.966 1.00 43.20 C ATOM 213 CD GLU A 16 -38.547 6.622 -8.315 1.00 63.23 C ATOM 214 OE1 GLU A 16 -37.735 7.568 -8.393 1.00 62.45 O ATOM 215 OE2 GLU A 16 -38.870 5.913 -9.290 1.00 71.20 O1- ATOM 0 H GLU A 16 -37.827 4.671 -4.880 1.00 11.34 H new ATOM 0 HA GLU A 16 -38.532 7.295 -3.706 1.00 40.23 H new ATOM 0 HB2 GLU A 16 -39.125 8.134 -5.836 1.00 4.30 H new ATOM 0 HB3 GLU A 16 -37.554 7.393 -6.068 1.00 4.30 H new ATOM 0 HG2 GLU A 16 -39.013 5.267 -6.725 1.00 43.20 H new ATOM 0 HG3 GLU A 16 -40.248 6.473 -7.025 1.00 43.20 H new ATOM 222 N ALA A 17 -40.941 6.681 -3.552 1.00 45.31 N ATOM 223 CA ALA A 17 -42.304 6.236 -3.288 1.00 31.31 C ATOM 224 C ALA A 17 -43.179 6.382 -4.529 1.00 53.14 C ATOM 225 O ALA A 17 -43.679 7.469 -4.822 1.00 52.54 O ATOM 226 CB ALA A 17 -42.898 7.016 -2.125 1.00 33.40 C ATOM 0 H ALA A 17 -40.707 7.587 -3.146 1.00 45.31 H new ATOM 0 HA ALA A 17 -42.270 5.179 -3.022 1.00 31.31 H new ATOM 0 HB1 ALA A 17 -43.916 6.673 -1.939 1.00 33.40 H new ATOM 0 HB2 ALA A 17 -42.293 6.856 -1.233 1.00 33.40 H new ATOM 0 HB3 ALA A 17 -42.912 8.078 -2.369 1.00 33.40 H new ATOM 232 N ARG A 18 -43.359 5.283 -5.254 1.00 33.11 N ATOM 233 CA ARG A 18 -44.172 5.290 -6.463 1.00 74.51 C ATOM 234 C ARG A 18 -45.654 5.151 -6.124 1.00 1.22 C ATOM 235 O ARG A 18 -46.023 4.433 -5.195 1.00 0.43 O ATOM 236 CB ARG A 18 -43.744 4.158 -7.399 1.00 24.01 C ATOM 237 CG ARG A 18 -42.246 4.112 -7.653 1.00 71.34 C ATOM 238 CD ARG A 18 -41.899 3.136 -8.766 1.00 21.32 C ATOM 239 NE ARG A 18 -40.457 2.999 -8.944 1.00 34.15 N ATOM 240 CZ ARG A 18 -39.902 2.262 -9.900 1.00 3.12 C ATOM 241 NH1 ARG A 18 -40.664 1.599 -10.758 1.00 25.32 N1+ ATOM 242 NH2 ARG A 18 -38.580 2.187 -9.999 1.00 33.24 N ATOM 0 H ARG A 18 -42.952 4.376 -5.025 1.00 33.11 H new ATOM 0 HA ARG A 18 -44.020 6.245 -6.966 1.00 74.51 H new ATOM 0 HB2 ARG A 18 -44.061 3.206 -6.973 1.00 24.01 H new ATOM 0 HB3 ARG A 18 -44.262 4.270 -8.351 1.00 24.01 H new ATOM 0 HG2 ARG A 18 -41.890 5.108 -7.917 1.00 71.34 H new ATOM 0 HG3 ARG A 18 -41.730 3.821 -6.738 1.00 71.34 H new ATOM 0 HD2 ARG A 18 -42.331 2.161 -8.540 1.00 21.32 H new ATOM 0 HD3 ARG A 18 -42.349 3.476 -9.699 1.00 21.32 H new ATOM 0 HE ARG A 18 -39.842 3.496 -8.300 1.00 34.15 H new ATOM 0 HH11 ARG A 18 -41.680 1.654 -10.686 1.00 25.32 H new ATOM 0 HH12 ARG A 18 -40.234 1.034 -11.491 1.00 25.32 H new ATOM 0 HH21 ARG A 18 -37.990 2.695 -9.341 1.00 33.24 H new ATOM 0 HH22 ARG A 18 -38.155 1.621 -10.733 1.00 33.24 H new ATOM 256 N ASP A 19 -46.496 5.843 -6.882 1.00 32.20 N ATOM 257 CA ASP A 19 -47.937 5.797 -6.662 1.00 41.34 C ATOM 258 C ASP A 19 -48.515 4.463 -7.125 1.00 44.41 C ATOM 259 O ASP A 19 -48.225 3.997 -8.228 1.00 5.35 O ATOM 260 CB ASP A 19 -48.625 6.948 -7.398 1.00 22.55 C ATOM 261 CG ASP A 19 -48.503 6.826 -8.905 1.00 73.34 C ATOM 262 OD1 ASP A 19 -47.380 6.578 -9.391 1.00 3.01 O ATOM 263 OD2 ASP A 19 -49.530 6.978 -9.597 1.00 24.34 O1- ATOM 0 H ASP A 19 -46.206 6.443 -7.654 1.00 32.20 H new ATOM 0 HA ASP A 19 -48.119 5.900 -5.592 1.00 41.34 H new ATOM 0 HB2 ASP A 19 -49.679 6.973 -7.122 1.00 22.55 H new ATOM 0 HB3 ASP A 19 -48.189 7.894 -7.076 1.00 22.55 H new ATOM 268 N THR A 20 -49.333 3.850 -6.274 1.00 61.12 N ATOM 269 CA THR A 20 -49.948 2.569 -6.595 1.00 12.12 C ATOM 270 C THR A 20 -51.210 2.759 -7.431 1.00 54.32 C ATOM 271 O THR A 20 -51.716 3.873 -7.566 1.00 54.42 O ATOM 272 CB THR A 20 -50.306 1.783 -5.319 1.00 40.23 C ATOM 273 OG1 THR A 20 -50.845 0.503 -5.667 1.00 70.42 O ATOM 274 CG2 THR A 20 -51.312 2.549 -4.475 1.00 72.02 C ATOM 0 H THR A 20 -49.584 4.221 -5.358 1.00 61.12 H new ATOM 0 HA THR A 20 -49.216 2.002 -7.170 1.00 12.12 H new ATOM 0 HB THR A 20 -49.395 1.647 -4.736 1.00 40.23 H new ATOM 0 HG1 THR A 20 -51.068 0.009 -4.851 1.00 70.42 H new ATOM 0 HG21 THR A 20 -51.549 1.974 -3.580 1.00 72.02 H new ATOM 0 HG22 THR A 20 -50.888 3.511 -4.187 1.00 72.02 H new ATOM 0 HG23 THR A 20 -52.222 2.713 -5.053 1.00 72.02 H new ATOM 282 N LYS A 21 -51.713 1.665 -7.991 1.00 3.44 N ATOM 283 CA LYS A 21 -52.917 1.709 -8.812 1.00 22.44 C ATOM 284 C LYS A 21 -54.165 1.516 -7.959 1.00 14.33 C ATOM 285 O LYS A 21 -55.276 1.406 -8.480 1.00 74.45 O ATOM 286 CB LYS A 21 -52.857 0.633 -9.899 1.00 24.43 C ATOM 287 CG LYS A 21 -52.851 -0.784 -9.352 1.00 51.34 C ATOM 288 CD LYS A 21 -54.181 -1.479 -9.588 1.00 33.02 C ATOM 289 CE LYS A 21 -54.605 -2.296 -8.378 1.00 63.52 C ATOM 290 NZ LYS A 21 -54.032 -3.670 -8.408 1.00 64.01 N1+ ATOM 0 H LYS A 21 -51.305 0.735 -7.891 1.00 3.44 H new ATOM 0 HA LYS A 21 -52.970 2.691 -9.283 1.00 22.44 H new ATOM 0 HB2 LYS A 21 -53.712 0.753 -10.565 1.00 24.43 H new ATOM 0 HB3 LYS A 21 -51.961 0.785 -10.500 1.00 24.43 H new ATOM 0 HG2 LYS A 21 -52.052 -1.354 -9.826 1.00 51.34 H new ATOM 0 HG3 LYS A 21 -52.636 -0.762 -8.284 1.00 51.34 H new ATOM 0 HD2 LYS A 21 -54.946 -0.736 -9.813 1.00 33.02 H new ATOM 0 HD3 LYS A 21 -54.103 -2.130 -10.459 1.00 33.02 H new ATOM 0 HE2 LYS A 21 -54.285 -1.789 -7.467 1.00 63.52 H new ATOM 0 HE3 LYS A 21 -55.693 -2.357 -8.344 1.00 63.52 H new ATOM 0 HZ1 LYS A 21 -54.344 -4.195 -7.566 1.00 64.01 H new ATOM 0 HZ2 LYS A 21 -54.357 -4.163 -9.264 1.00 64.01 H new ATOM 0 HZ3 LYS A 21 -52.994 -3.613 -8.415 1.00 64.01 H new ATOM 304 N LEU A 22 -53.978 1.477 -6.645 1.00 11.11 N ATOM 305 CA LEU A 22 -55.091 1.300 -5.717 1.00 62.04 C ATOM 306 C LEU A 22 -55.477 2.626 -5.070 1.00 2.31 C ATOM 307 O LEU A 22 -56.437 2.697 -4.303 1.00 51.15 O ATOM 308 CB LEU A 22 -54.723 0.281 -4.638 1.00 32.22 C ATOM 309 CG LEU A 22 -55.785 -0.771 -4.318 1.00 53.13 C ATOM 310 CD1 LEU A 22 -57.092 -0.105 -3.916 1.00 24.41 C ATOM 311 CD2 LEU A 22 -55.999 -1.693 -5.509 1.00 34.53 C ATOM 0 H LEU A 22 -53.066 1.566 -6.197 1.00 11.11 H new ATOM 0 HA LEU A 22 -55.947 0.930 -6.281 1.00 62.04 H new ATOM 0 HB2 LEU A 22 -53.813 -0.233 -4.947 1.00 32.22 H new ATOM 0 HB3 LEU A 22 -54.488 0.822 -3.721 1.00 32.22 H new ATOM 0 HG LEU A 22 -55.433 -1.371 -3.479 1.00 53.13 H new ATOM 0 HD11 LEU A 22 -57.836 -0.869 -3.692 1.00 24.41 H new ATOM 0 HD12 LEU A 22 -56.929 0.513 -3.033 1.00 24.41 H new ATOM 0 HD13 LEU A 22 -57.449 0.520 -4.735 1.00 24.41 H new ATOM 0 HD21 LEU A 22 -56.758 -2.435 -5.263 1.00 34.53 H new ATOM 0 HD22 LEU A 22 -56.329 -1.108 -6.368 1.00 34.53 H new ATOM 0 HD23 LEU A 22 -55.064 -2.197 -5.751 1.00 34.53 H new ATOM 323 N GLY A 23 -54.725 3.675 -5.387 1.00 52.15 N ATOM 324 CA GLY A 23 -55.006 4.985 -4.830 1.00 43.34 C ATOM 325 C GLY A 23 -54.198 5.268 -3.578 1.00 14.33 C ATOM 326 O GLY A 23 -54.695 5.165 -2.457 1.00 42.31 O ATOM 0 H GLY A 23 -53.926 3.641 -6.020 1.00 52.15 H new ATOM 0 HA2 GLY A 23 -54.791 5.748 -5.578 1.00 43.34 H new ATOM 0 HA3 GLY A 23 -56.068 5.057 -4.597 1.00 43.34 H new ATOM 330 N PRO A 24 -52.921 5.633 -3.764 1.00 42.45 N ATOM 331 CA PRO A 24 -52.016 5.939 -2.653 1.00 55.11 C ATOM 332 C PRO A 24 -52.385 7.236 -1.942 1.00 31.25 C ATOM 333 O PRO A 24 -53.209 8.009 -2.432 1.00 23.44 O ATOM 334 CB PRO A 24 -50.651 6.072 -3.333 1.00 4.11 C ATOM 335 CG PRO A 24 -50.964 6.457 -4.737 1.00 61.03 C ATOM 336 CD PRO A 24 -52.263 5.776 -5.073 1.00 45.53 C ATOM 0 HA PRO A 24 -52.050 5.172 -1.879 1.00 55.11 H new ATOM 0 HB2 PRO A 24 -50.036 6.827 -2.843 1.00 4.11 H new ATOM 0 HB3 PRO A 24 -50.096 5.135 -3.294 1.00 4.11 H new ATOM 0 HG2 PRO A 24 -51.054 7.539 -4.834 1.00 61.03 H new ATOM 0 HG3 PRO A 24 -50.171 6.141 -5.415 1.00 61.03 H new ATOM 0 HD2 PRO A 24 -52.863 6.371 -5.761 1.00 45.53 H new ATOM 0 HD3 PRO A 24 -52.099 4.809 -5.548 1.00 45.53 H new ATOM 344 N GLU A 25 -51.771 7.469 -0.787 1.00 30.43 N ATOM 345 CA GLU A 25 -52.038 8.675 -0.011 1.00 61.13 C ATOM 346 C GLU A 25 -50.752 9.227 0.595 1.00 2.52 C ATOM 347 O GLU A 25 -50.512 10.435 0.574 1.00 75.32 O ATOM 348 CB GLU A 25 -53.051 8.380 1.098 1.00 32.13 C ATOM 349 CG GLU A 25 -52.770 7.092 1.853 1.00 54.54 C ATOM 350 CD GLU A 25 -53.850 6.761 2.865 1.00 55.02 C ATOM 351 OE1 GLU A 25 -54.494 7.703 3.373 1.00 54.21 O ATOM 352 OE2 GLU A 25 -54.051 5.562 3.150 1.00 12.11 O1- ATOM 0 H GLU A 25 -51.086 6.840 -0.368 1.00 30.43 H new ATOM 0 HA GLU A 25 -52.454 9.425 -0.684 1.00 61.13 H new ATOM 0 HB2 GLU A 25 -53.057 9.211 1.804 1.00 32.13 H new ATOM 0 HB3 GLU A 25 -54.049 8.325 0.662 1.00 32.13 H new ATOM 0 HG2 GLU A 25 -52.680 6.271 1.142 1.00 54.54 H new ATOM 0 HG3 GLU A 25 -51.811 7.177 2.365 1.00 54.54 H new ATOM 359 N GLU A 26 -49.927 8.334 1.136 1.00 43.40 N ATOM 360 CA GLU A 26 -48.665 8.734 1.748 1.00 42.11 C ATOM 361 C GLU A 26 -47.764 7.523 1.976 1.00 25.51 C ATOM 362 O GLU A 26 -48.246 6.414 2.210 1.00 40.12 O ATOM 363 CB GLU A 26 -48.922 9.449 3.076 1.00 74.23 C ATOM 364 CG GLU A 26 -49.352 8.517 4.197 1.00 70.14 C ATOM 365 CD GLU A 26 -50.360 9.156 5.131 1.00 31.34 C ATOM 366 OE1 GLU A 26 -51.208 9.936 4.648 1.00 24.24 O ATOM 367 OE2 GLU A 26 -50.303 8.875 6.347 1.00 61.41 O1- ATOM 0 H GLU A 26 -50.110 7.331 1.163 1.00 43.40 H new ATOM 0 HA GLU A 26 -48.160 9.418 1.066 1.00 42.11 H new ATOM 0 HB2 GLU A 26 -48.015 9.973 3.378 1.00 74.23 H new ATOM 0 HB3 GLU A 26 -49.693 10.205 2.928 1.00 74.23 H new ATOM 0 HG2 GLU A 26 -49.783 7.612 3.768 1.00 70.14 H new ATOM 0 HG3 GLU A 26 -48.475 8.213 4.768 1.00 70.14 H new ATOM 374 N ILE A 27 -46.456 7.745 1.905 1.00 34.23 N ATOM 375 CA ILE A 27 -45.488 6.673 2.104 1.00 51.54 C ATOM 376 C ILE A 27 -45.376 6.301 3.578 1.00 3.43 C ATOM 377 O ILE A 27 -45.499 7.155 4.457 1.00 75.14 O ATOM 378 CB ILE A 27 -44.096 7.068 1.578 1.00 31.11 C ATOM 379 CG1 ILE A 27 -43.208 5.829 1.444 1.00 64.55 C ATOM 380 CG2 ILE A 27 -43.451 8.091 2.500 1.00 22.12 C ATOM 381 CD1 ILE A 27 -41.813 6.137 0.945 1.00 33.44 C ATOM 0 H ILE A 27 -46.042 8.657 1.711 1.00 34.23 H new ATOM 0 HA ILE A 27 -45.849 5.812 1.541 1.00 51.54 H new ATOM 0 HB ILE A 27 -44.211 7.519 0.592 1.00 31.11 H new ATOM 0 HG12 ILE A 27 -43.138 5.336 2.413 1.00 64.55 H new ATOM 0 HG13 ILE A 27 -43.682 5.124 0.761 1.00 64.55 H new ATOM 0 HG21 ILE A 27 -42.468 8.360 2.114 1.00 22.12 H new ATOM 0 HG22 ILE A 27 -44.077 8.982 2.550 1.00 22.12 H new ATOM 0 HG23 ILE A 27 -43.345 7.666 3.498 1.00 22.12 H new ATOM 0 HD11 ILE A 27 -41.240 5.213 0.874 1.00 33.44 H new ATOM 0 HD12 ILE A 27 -41.873 6.603 -0.039 1.00 33.44 H new ATOM 0 HD13 ILE A 27 -41.320 6.818 1.639 1.00 33.44 H new ATOM 393 N THR A 28 -45.140 5.020 3.843 1.00 23.51 N ATOM 394 CA THR A 28 -45.008 4.534 5.211 1.00 45.35 C ATOM 395 C THR A 28 -44.096 3.314 5.276 1.00 32.33 C ATOM 396 O THR A 28 -43.576 2.861 4.256 1.00 33.43 O ATOM 397 CB THR A 28 -46.380 4.167 5.809 1.00 53.03 C ATOM 398 OG1 THR A 28 -46.259 3.967 7.223 1.00 4.11 O ATOM 399 CG2 THR A 28 -46.935 2.909 5.160 1.00 21.31 C ATOM 0 H THR A 28 -45.036 4.300 3.128 1.00 23.51 H new ATOM 0 HA THR A 28 -44.569 5.343 5.794 1.00 45.35 H new ATOM 0 HB THR A 28 -47.068 4.990 5.615 1.00 53.03 H new ATOM 0 HG1 THR A 28 -47.135 3.736 7.597 1.00 4.11 H new ATOM 0 HG21 THR A 28 -47.904 2.670 5.599 1.00 21.31 H new ATOM 0 HG22 THR A 28 -47.052 3.074 4.089 1.00 21.31 H new ATOM 0 HG23 THR A 28 -46.247 2.080 5.326 1.00 21.31 H new ATOM 407 N ARG A 29 -43.907 2.787 6.481 1.00 14.42 N ATOM 408 CA ARG A 29 -43.055 1.620 6.678 1.00 74.04 C ATOM 409 C ARG A 29 -43.852 0.460 7.267 1.00 61.04 C ATOM 410 O ARG A 29 -44.467 0.589 8.326 1.00 23.41 O ATOM 411 CB ARG A 29 -41.884 1.966 7.599 1.00 13.44 C ATOM 412 CG ARG A 29 -42.155 3.152 8.511 1.00 21.03 C ATOM 413 CD ARG A 29 -43.199 2.816 9.564 1.00 15.43 C ATOM 414 NE ARG A 29 -42.992 3.569 10.799 1.00 11.32 N ATOM 415 CZ ARG A 29 -43.335 4.844 10.947 1.00 74.13 C ATOM 416 NH1 ARG A 29 -43.899 5.504 9.945 1.00 53.55 N1+ ATOM 417 NH2 ARG A 29 -43.115 5.461 12.102 1.00 74.03 N ATOM 0 H ARG A 29 -44.332 3.149 7.335 1.00 14.42 H new ATOM 0 HA ARG A 29 -42.666 1.317 5.706 1.00 74.04 H new ATOM 0 HB2 ARG A 29 -41.644 1.096 8.210 1.00 13.44 H new ATOM 0 HB3 ARG A 29 -41.005 2.180 6.991 1.00 13.44 H new ATOM 0 HG2 ARG A 29 -41.229 3.457 8.999 1.00 21.03 H new ATOM 0 HG3 ARG A 29 -42.496 4.000 7.916 1.00 21.03 H new ATOM 0 HD2 ARG A 29 -44.193 3.030 9.171 1.00 15.43 H new ATOM 0 HD3 ARG A 29 -43.165 1.748 9.780 1.00 15.43 H new ATOM 0 HE ARG A 29 -42.561 3.090 11.590 1.00 11.32 H new ATOM 0 HH11 ARG A 29 -44.071 5.033 9.057 1.00 53.55 H new ATOM 0 HH12 ARG A 29 -44.161 6.483 10.062 1.00 53.55 H new ATOM 0 HH21 ARG A 29 -42.683 4.956 12.876 1.00 74.03 H new ATOM 0 HH22 ARG A 29 -43.378 6.440 12.216 1.00 74.03 H new ATOM 431 N ASP A 30 -43.838 -0.674 6.574 1.00 64.35 N ATOM 432 CA ASP A 30 -44.558 -1.857 7.028 1.00 0.23 C ATOM 433 C ASP A 30 -43.833 -3.130 6.604 1.00 34.02 C ATOM 434 O ASP A 30 -44.073 -3.663 5.520 1.00 14.01 O ATOM 435 CB ASP A 30 -45.983 -1.857 6.471 1.00 31.35 C ATOM 436 CG ASP A 30 -46.687 -3.185 6.681 1.00 31.41 C ATOM 437 OD1 ASP A 30 -47.147 -3.440 7.814 1.00 64.23 O ATOM 438 OD2 ASP A 30 -46.777 -3.967 5.713 1.00 50.33 O1- ATOM 0 H ASP A 30 -43.335 -0.798 5.695 1.00 64.35 H new ATOM 0 HA ASP A 30 -44.601 -1.831 8.117 1.00 0.23 H new ATOM 0 HB2 ASP A 30 -46.558 -1.065 6.951 1.00 31.35 H new ATOM 0 HB3 ASP A 30 -45.954 -1.629 5.405 1.00 31.35 H new ATOM 443 N ILE A 31 -42.945 -3.613 7.467 1.00 63.23 N ATOM 444 CA ILE A 31 -42.185 -4.824 7.182 1.00 25.31 C ATOM 445 C ILE A 31 -42.621 -5.973 8.086 1.00 64.24 C ATOM 446 O ILE A 31 -41.993 -6.266 9.104 1.00 20.01 O ATOM 447 CB ILE A 31 -40.672 -4.594 7.357 1.00 73.13 C ATOM 448 CG1 ILE A 31 -40.290 -3.189 6.885 1.00 24.14 C ATOM 449 CG2 ILE A 31 -39.884 -5.648 6.593 1.00 43.12 C ATOM 450 CD1 ILE A 31 -40.681 -2.906 5.451 1.00 71.21 C ATOM 0 H ILE A 31 -42.734 -3.185 8.368 1.00 63.23 H new ATOM 0 HA ILE A 31 -42.387 -5.085 6.143 1.00 25.31 H new ATOM 0 HB ILE A 31 -40.426 -4.681 8.415 1.00 73.13 H new ATOM 0 HG12 ILE A 31 -40.766 -2.454 7.535 1.00 24.14 H new ATOM 0 HG13 ILE A 31 -39.213 -3.059 6.992 1.00 24.14 H new ATOM 0 HG21 ILE A 31 -38.817 -5.472 6.726 1.00 43.12 H new ATOM 0 HG22 ILE A 31 -40.139 -6.638 6.971 1.00 43.12 H new ATOM 0 HG23 ILE A 31 -40.132 -5.590 5.533 1.00 43.12 H new ATOM 0 HD11 ILE A 31 -40.380 -1.893 5.185 1.00 71.21 H new ATOM 0 HD12 ILE A 31 -40.184 -3.617 4.791 1.00 71.21 H new ATOM 0 HD13 ILE A 31 -41.761 -3.004 5.342 1.00 71.21 H new ATOM 462 N PRO A 32 -43.720 -6.640 7.706 1.00 34.15 N ATOM 463 CA PRO A 32 -44.264 -7.768 8.468 1.00 63.53 C ATOM 464 C PRO A 32 -43.370 -9.002 8.392 1.00 74.13 C ATOM 465 O PRO A 32 -42.730 -9.254 7.373 1.00 52.54 O ATOM 466 CB PRO A 32 -45.608 -8.040 7.789 1.00 61.33 C ATOM 467 CG PRO A 32 -45.442 -7.526 6.401 1.00 72.25 C ATOM 468 CD PRO A 32 -44.518 -6.344 6.505 1.00 11.40 C ATOM 0 HA PRO A 32 -44.347 -7.540 9.531 1.00 63.53 H new ATOM 0 HB2 PRO A 32 -45.845 -9.104 7.791 1.00 61.33 H new ATOM 0 HB3 PRO A 32 -46.422 -7.531 8.305 1.00 61.33 H new ATOM 0 HG2 PRO A 32 -45.023 -8.292 5.749 1.00 72.25 H new ATOM 0 HG3 PRO A 32 -46.402 -7.235 5.975 1.00 72.25 H new ATOM 0 HD2 PRO A 32 -43.890 -6.246 5.619 1.00 11.40 H new ATOM 0 HD3 PRO A 32 -45.070 -5.410 6.610 1.00 11.40 H new ATOM 476 N ASN A 33 -43.334 -9.768 9.479 1.00 71.22 N ATOM 477 CA ASN A 33 -42.518 -10.975 9.535 1.00 2.45 C ATOM 478 C ASN A 33 -41.035 -10.636 9.431 1.00 2.05 C ATOM 479 O ASN A 33 -40.249 -11.400 8.870 1.00 32.14 O ATOM 480 CB ASN A 33 -42.913 -11.935 8.411 1.00 52.30 C ATOM 481 CG ASN A 33 -44.416 -12.019 8.223 1.00 14.10 C ATOM 482 OD1 ASN A 33 -45.137 -12.489 9.102 1.00 31.13 O ATOM 483 ND2 ASN A 33 -44.893 -11.560 7.072 1.00 31.33 N ATOM 0 H ASN A 33 -43.860 -9.574 10.331 1.00 71.22 H new ATOM 0 HA ASN A 33 -42.695 -11.458 10.496 1.00 2.45 H new ATOM 0 HB2 ASN A 33 -42.451 -11.609 7.479 1.00 52.30 H new ATOM 0 HB3 ASN A 33 -42.521 -12.928 8.631 1.00 52.30 H new ATOM 0 HD21 ASN A 33 -45.896 -11.589 6.888 1.00 31.33 H new ATOM 0 HD22 ASN A 33 -44.257 -11.179 6.372 1.00 31.33 H new ATOM 490 N VAL A 34 -40.657 -9.483 9.975 1.00 34.42 N ATOM 491 CA VAL A 34 -39.268 -9.041 9.945 1.00 3.55 C ATOM 492 C VAL A 34 -38.595 -9.254 11.296 1.00 63.25 C ATOM 493 O VAL A 34 -39.262 -9.358 12.324 1.00 72.34 O ATOM 494 CB VAL A 34 -39.159 -7.555 9.558 1.00 61.54 C ATOM 495 CG1 VAL A 34 -39.620 -6.669 10.705 1.00 74.44 C ATOM 496 CG2 VAL A 34 -37.734 -7.214 9.148 1.00 63.24 C ATOM 0 H VAL A 34 -41.294 -8.838 10.442 1.00 34.42 H new ATOM 0 HA VAL A 34 -38.761 -9.642 9.190 1.00 3.55 H new ATOM 0 HB VAL A 34 -39.811 -7.371 8.704 1.00 61.54 H new ATOM 0 HG11 VAL A 34 -39.536 -5.622 10.413 1.00 74.44 H new ATOM 0 HG12 VAL A 34 -40.659 -6.896 10.945 1.00 74.44 H new ATOM 0 HG13 VAL A 34 -38.996 -6.853 11.580 1.00 74.44 H new ATOM 0 HG21 VAL A 34 -37.676 -6.160 8.878 1.00 63.24 H new ATOM 0 HG22 VAL A 34 -37.058 -7.413 9.980 1.00 63.24 H new ATOM 0 HG23 VAL A 34 -37.446 -7.824 8.292 1.00 63.24 H new ATOM 506 N GLY A 35 -37.267 -9.317 11.286 1.00 71.54 N ATOM 507 CA GLY A 35 -36.524 -9.517 12.517 1.00 61.21 C ATOM 508 C GLY A 35 -36.329 -8.228 13.292 1.00 63.23 C ATOM 509 O GLY A 35 -36.054 -7.181 12.706 1.00 50.52 O ATOM 0 H GLY A 35 -36.692 -9.233 10.448 1.00 71.54 H new ATOM 0 HA2 GLY A 35 -37.051 -10.238 13.143 1.00 61.21 H new ATOM 0 HA3 GLY A 35 -35.550 -9.948 12.284 1.00 61.21 H new ATOM 513 N GLU A 36 -36.472 -8.304 14.611 1.00 25.34 N ATOM 514 CA GLU A 36 -36.312 -7.134 15.466 1.00 23.30 C ATOM 515 C GLU A 36 -34.952 -6.478 15.241 1.00 75.14 C ATOM 516 O GLU A 36 -34.826 -5.255 15.291 1.00 34.31 O ATOM 517 CB GLU A 36 -36.466 -7.524 16.937 1.00 11.14 C ATOM 518 CG GLU A 36 -37.889 -7.404 17.454 1.00 41.24 C ATOM 519 CD GLU A 36 -38.685 -8.682 17.277 1.00 1.32 C ATOM 520 OE1 GLU A 36 -38.085 -9.773 17.375 1.00 11.12 O ATOM 521 OE2 GLU A 36 -39.908 -8.592 17.041 1.00 24.50 O1- ATOM 0 H GLU A 36 -36.698 -9.164 15.111 1.00 25.34 H new ATOM 0 HA GLU A 36 -37.090 -6.416 15.206 1.00 23.30 H new ATOM 0 HB2 GLU A 36 -36.126 -8.551 17.069 1.00 11.14 H new ATOM 0 HB3 GLU A 36 -35.815 -6.893 17.541 1.00 11.14 H new ATOM 0 HG2 GLU A 36 -37.866 -7.138 18.511 1.00 41.24 H new ATOM 0 HG3 GLU A 36 -38.394 -6.591 16.932 1.00 41.24 H new ATOM 528 N ASP A 37 -33.939 -7.301 14.994 1.00 22.02 N ATOM 529 CA ASP A 37 -32.589 -6.802 14.761 1.00 32.15 C ATOM 530 C ASP A 37 -32.521 -6.005 13.463 1.00 14.55 C ATOM 531 O ASP A 37 -31.768 -5.037 13.357 1.00 61.42 O ATOM 532 CB ASP A 37 -31.595 -7.965 14.713 1.00 75.52 C ATOM 533 CG ASP A 37 -30.285 -7.577 14.057 1.00 61.23 C ATOM 534 OD1 ASP A 37 -30.246 -7.497 12.811 1.00 2.44 O ATOM 535 OD2 ASP A 37 -29.297 -7.355 14.789 1.00 44.23 O1- ATOM 0 H ASP A 37 -34.027 -8.316 14.950 1.00 22.02 H new ATOM 0 HA ASP A 37 -32.324 -6.141 15.586 1.00 32.15 H new ATOM 0 HB2 ASP A 37 -31.401 -8.316 15.727 1.00 75.52 H new ATOM 0 HB3 ASP A 37 -32.039 -8.797 14.167 1.00 75.52 H new ATOM 540 N ALA A 38 -33.312 -6.418 12.478 1.00 41.12 N ATOM 541 CA ALA A 38 -33.342 -5.741 11.188 1.00 33.22 C ATOM 542 C ALA A 38 -33.891 -4.325 11.323 1.00 61.11 C ATOM 543 O ALA A 38 -33.647 -3.469 10.470 1.00 73.30 O ATOM 544 CB ALA A 38 -34.171 -6.538 10.193 1.00 54.45 C ATOM 0 H ALA A 38 -33.940 -7.218 12.549 1.00 41.12 H new ATOM 0 HA ALA A 38 -32.319 -5.672 10.818 1.00 33.22 H new ATOM 0 HB1 ALA A 38 -34.185 -6.020 9.234 1.00 54.45 H new ATOM 0 HB2 ALA A 38 -33.733 -7.528 10.065 1.00 54.45 H new ATOM 0 HB3 ALA A 38 -35.190 -6.638 10.566 1.00 54.45 H new ATOM 550 N LEU A 39 -34.634 -4.084 12.398 1.00 44.35 N ATOM 551 CA LEU A 39 -35.219 -2.771 12.644 1.00 51.12 C ATOM 552 C LEU A 39 -34.661 -2.157 13.924 1.00 25.44 C ATOM 553 O LEU A 39 -35.214 -1.195 14.455 1.00 75.32 O ATOM 554 CB LEU A 39 -36.742 -2.879 12.739 1.00 75.42 C ATOM 555 CG LEU A 39 -37.281 -3.909 13.733 1.00 63.45 C ATOM 556 CD1 LEU A 39 -37.426 -3.292 15.115 1.00 3.12 C ATOM 557 CD2 LEU A 39 -38.613 -4.466 13.253 1.00 33.13 C ATOM 0 H LEU A 39 -34.845 -4.781 13.113 1.00 44.35 H new ATOM 0 HA LEU A 39 -34.958 -2.122 11.808 1.00 51.12 H new ATOM 0 HB2 LEU A 39 -37.140 -1.901 13.009 1.00 75.42 H new ATOM 0 HB3 LEU A 39 -37.132 -3.120 11.750 1.00 75.42 H new ATOM 0 HG LEU A 39 -36.568 -4.731 13.798 1.00 63.45 H new ATOM 0 HD11 LEU A 39 -37.811 -4.040 15.809 1.00 3.12 H new ATOM 0 HD12 LEU A 39 -36.453 -2.942 15.461 1.00 3.12 H new ATOM 0 HD13 LEU A 39 -38.118 -2.451 15.067 1.00 3.12 H new ATOM 0 HD21 LEU A 39 -38.982 -5.197 13.972 1.00 33.13 H new ATOM 0 HD22 LEU A 39 -39.334 -3.654 13.159 1.00 33.13 H new ATOM 0 HD23 LEU A 39 -38.479 -4.946 12.284 1.00 33.13 H new ATOM 569 N ARG A 40 -33.561 -2.721 14.412 1.00 20.52 N ATOM 570 CA ARG A 40 -32.926 -2.228 15.630 1.00 43.52 C ATOM 571 C ARG A 40 -32.306 -0.852 15.401 1.00 33.33 C ATOM 572 O ARG A 40 -32.256 -0.026 16.310 1.00 61.33 O ATOM 573 CB ARG A 40 -31.854 -3.210 16.105 1.00 31.43 C ATOM 574 CG ARG A 40 -30.576 -3.161 15.283 1.00 41.24 C ATOM 575 CD ARG A 40 -29.700 -4.377 15.542 1.00 43.45 C ATOM 576 NE ARG A 40 -28.888 -4.221 16.745 1.00 63.04 N ATOM 577 CZ ARG A 40 -27.784 -4.920 16.982 1.00 32.22 C ATOM 578 NH1 ARG A 40 -27.363 -5.819 16.103 1.00 22.50 N1+ ATOM 579 NH2 ARG A 40 -27.099 -4.721 18.101 1.00 20.05 N ATOM 0 H ARG A 40 -33.091 -3.519 13.984 1.00 20.52 H new ATOM 0 HA ARG A 40 -33.693 -2.138 16.399 1.00 43.52 H new ATOM 0 HB2 ARG A 40 -31.614 -2.997 17.147 1.00 31.43 H new ATOM 0 HB3 ARG A 40 -32.259 -4.221 16.071 1.00 31.43 H new ATOM 0 HG2 ARG A 40 -30.826 -3.110 14.223 1.00 41.24 H new ATOM 0 HG3 ARG A 40 -30.022 -2.254 15.524 1.00 41.24 H new ATOM 0 HD2 ARG A 40 -30.329 -5.262 15.641 1.00 43.45 H new ATOM 0 HD3 ARG A 40 -29.048 -4.544 14.684 1.00 43.45 H new ATOM 0 HE ARG A 40 -29.185 -3.538 17.442 1.00 63.04 H new ATOM 0 HH11 ARG A 40 -27.887 -5.975 15.242 1.00 22.50 H new ATOM 0 HH12 ARG A 40 -26.515 -6.354 16.288 1.00 22.50 H new ATOM 0 HH21 ARG A 40 -27.420 -4.031 18.780 1.00 20.05 H new ATOM 0 HH22 ARG A 40 -26.251 -5.258 18.282 1.00 20.05 H new ATOM 593 N ASN A 41 -31.834 -0.617 14.181 1.00 55.32 N ATOM 594 CA ASN A 41 -31.217 0.658 13.834 1.00 71.13 C ATOM 595 C ASN A 41 -32.246 1.621 13.251 1.00 35.30 C ATOM 596 O ASN A 41 -32.100 2.839 13.350 1.00 31.23 O ATOM 597 CB ASN A 41 -30.080 0.442 12.833 1.00 34.41 C ATOM 598 CG ASN A 41 -29.192 -0.728 13.211 1.00 10.32 C ATOM 599 OD1 ASN A 41 -29.359 -1.838 12.704 1.00 32.53 O ATOM 600 ND2 ASN A 41 -28.242 -0.484 14.106 1.00 61.32 N ATOM 0 H ASN A 41 -31.867 -1.292 13.417 1.00 55.32 H new ATOM 0 HA ASN A 41 -30.812 1.097 14.746 1.00 71.13 H new ATOM 0 HB2 ASN A 41 -30.500 0.271 11.842 1.00 34.41 H new ATOM 0 HB3 ASN A 41 -29.477 1.348 12.772 1.00 34.41 H new ATOM 0 HD21 ASN A 41 -27.614 -1.232 14.400 1.00 61.32 H new ATOM 0 HD22 ASN A 41 -28.140 0.451 14.500 1.00 61.32 H new ATOM 607 N LEU A 42 -33.288 1.066 12.641 1.00 5.31 N ATOM 608 CA LEU A 42 -34.344 1.874 12.042 1.00 1.45 C ATOM 609 C LEU A 42 -35.023 2.748 13.091 1.00 41.30 C ATOM 610 O LEU A 42 -35.186 2.342 14.242 1.00 64.12 O ATOM 611 CB LEU A 42 -35.379 0.975 11.363 1.00 35.41 C ATOM 612 CG LEU A 42 -36.077 1.563 10.136 1.00 32.44 C ATOM 613 CD1 LEU A 42 -35.448 1.030 8.858 1.00 21.05 C ATOM 614 CD2 LEU A 42 -37.566 1.251 10.169 1.00 43.22 C ATOM 0 H LEU A 42 -33.424 0.059 12.548 1.00 5.31 H new ATOM 0 HA LEU A 42 -33.890 2.524 11.294 1.00 1.45 H new ATOM 0 HB2 LEU A 42 -34.887 0.048 11.067 1.00 35.41 H new ATOM 0 HB3 LEU A 42 -36.140 0.712 12.098 1.00 35.41 H new ATOM 0 HG LEU A 42 -35.952 2.646 10.155 1.00 32.44 H new ATOM 0 HD11 LEU A 42 -35.957 1.459 7.995 1.00 21.05 H new ATOM 0 HD12 LEU A 42 -34.393 1.304 8.830 1.00 21.05 H new ATOM 0 HD13 LEU A 42 -35.542 -0.056 8.832 1.00 21.05 H new ATOM 0 HD21 LEU A 42 -38.047 1.677 9.288 1.00 43.22 H new ATOM 0 HD22 LEU A 42 -37.711 0.171 10.175 1.00 43.22 H new ATOM 0 HD23 LEU A 42 -38.008 1.681 11.068 1.00 43.22 H new ATOM 626 N ASP A 43 -35.419 3.949 12.686 1.00 10.14 N ATOM 627 CA ASP A 43 -36.084 4.880 13.591 1.00 31.33 C ATOM 628 C ASP A 43 -37.535 5.100 13.174 1.00 31.33 C ATOM 629 O ASP A 43 -38.057 4.395 12.311 1.00 2.34 O ATOM 630 CB ASP A 43 -35.341 6.217 13.618 1.00 44.20 C ATOM 631 CG ASP A 43 -33.835 6.042 13.611 1.00 54.04 C ATOM 632 OD1 ASP A 43 -33.264 5.859 12.515 1.00 1.31 O ATOM 633 OD2 ASP A 43 -33.227 6.090 14.701 1.00 30.34 O1- ATOM 0 H ASP A 43 -35.291 4.301 11.737 1.00 10.14 H new ATOM 0 HA ASP A 43 -36.073 4.446 14.591 1.00 31.33 H new ATOM 0 HB2 ASP A 43 -35.639 6.812 12.755 1.00 44.20 H new ATOM 0 HB3 ASP A 43 -35.635 6.775 14.507 1.00 44.20 H new ATOM 638 N ASP A 44 -38.181 6.081 13.795 1.00 73.33 N ATOM 639 CA ASP A 44 -39.573 6.393 13.489 1.00 11.43 C ATOM 640 C ASP A 44 -39.714 6.902 12.057 1.00 44.41 C ATOM 641 O ASP A 44 -40.817 6.959 11.515 1.00 0.12 O ATOM 642 CB ASP A 44 -40.110 7.438 14.469 1.00 63.23 C ATOM 643 CG ASP A 44 -41.610 7.330 14.663 1.00 31.34 C ATOM 644 OD1 ASP A 44 -42.356 7.952 13.879 1.00 40.13 O ATOM 645 OD2 ASP A 44 -42.038 6.625 15.601 1.00 13.32 O1- ATOM 0 H ASP A 44 -37.764 6.674 14.513 1.00 73.33 H new ATOM 0 HA ASP A 44 -40.156 5.477 13.589 1.00 11.43 H new ATOM 0 HB2 ASP A 44 -39.612 7.319 15.431 1.00 63.23 H new ATOM 0 HB3 ASP A 44 -39.864 8.435 14.104 1.00 63.23 H new ATOM 650 N ARG A 45 -38.589 7.269 11.452 1.00 71.11 N ATOM 651 CA ARG A 45 -38.587 7.774 10.085 1.00 52.13 C ATOM 652 C ARG A 45 -38.741 6.633 9.083 1.00 35.45 C ATOM 653 O ARG A 45 -39.160 6.844 7.946 1.00 3.22 O ATOM 654 CB ARG A 45 -37.294 8.543 9.804 1.00 65.04 C ATOM 655 CG ARG A 45 -37.101 9.756 10.699 1.00 43.34 C ATOM 656 CD ARG A 45 -37.770 10.991 10.116 1.00 43.42 C ATOM 657 NE ARG A 45 -37.047 11.510 8.958 1.00 64.23 N ATOM 658 CZ ARG A 45 -37.409 12.602 8.294 1.00 23.12 C ATOM 659 NH1 ARG A 45 -38.480 13.286 8.672 1.00 63.01 N1+ ATOM 660 NH2 ARG A 45 -36.701 13.011 7.250 1.00 3.01 N ATOM 0 H ARG A 45 -37.668 7.226 11.887 1.00 71.11 H new ATOM 0 HA ARG A 45 -39.435 8.450 9.973 1.00 52.13 H new ATOM 0 HB2 ARG A 45 -36.446 7.870 9.930 1.00 65.04 H new ATOM 0 HB3 ARG A 45 -37.292 8.866 8.763 1.00 65.04 H new ATOM 0 HG2 ARG A 45 -37.513 9.550 11.687 1.00 43.34 H new ATOM 0 HG3 ARG A 45 -36.036 9.946 10.831 1.00 43.34 H new ATOM 0 HD2 ARG A 45 -38.792 10.747 9.826 1.00 43.42 H new ATOM 0 HD3 ARG A 45 -37.832 11.765 10.881 1.00 43.42 H new ATOM 0 HE ARG A 45 -36.218 11.006 8.642 1.00 64.23 H new ATOM 0 HH11 ARG A 45 -39.028 12.974 9.474 1.00 63.01 H new ATOM 0 HH12 ARG A 45 -38.756 14.124 8.161 1.00 63.01 H new ATOM 0 HH21 ARG A 45 -35.877 12.487 6.956 1.00 3.01 H new ATOM 0 HH22 ARG A 45 -36.980 13.850 6.741 1.00 3.01 H new ATOM 674 N GLY A 46 -38.397 5.423 9.514 1.00 63.25 N ATOM 675 CA GLY A 46 -38.503 4.268 8.644 1.00 13.20 C ATOM 676 C GLY A 46 -37.200 3.952 7.937 1.00 41.41 C ATOM 677 O GLY A 46 -37.090 2.943 7.242 1.00 11.40 O ATOM 0 H GLY A 46 -38.047 5.223 10.451 1.00 63.25 H new ATOM 0 HA2 GLY A 46 -38.814 3.403 9.230 1.00 13.20 H new ATOM 0 HA3 GLY A 46 -39.281 4.446 7.902 1.00 13.20 H new ATOM 681 N VAL A 47 -36.209 4.822 8.110 1.00 30.53 N ATOM 682 CA VAL A 47 -34.907 4.633 7.483 1.00 42.32 C ATOM 683 C VAL A 47 -33.822 4.392 8.527 1.00 35.22 C ATOM 684 O VAL A 47 -33.858 4.967 9.616 1.00 74.45 O ATOM 685 CB VAL A 47 -34.516 5.850 6.623 1.00 33.24 C ATOM 686 CG1 VAL A 47 -34.407 7.099 7.485 1.00 62.32 C ATOM 687 CG2 VAL A 47 -33.211 5.584 5.886 1.00 11.24 C ATOM 0 H VAL A 47 -36.284 5.665 8.680 1.00 30.53 H new ATOM 0 HA VAL A 47 -34.990 3.756 6.842 1.00 42.32 H new ATOM 0 HB VAL A 47 -35.297 6.016 5.882 1.00 33.24 H new ATOM 0 HG11 VAL A 47 -34.130 7.949 6.861 1.00 62.32 H new ATOM 0 HG12 VAL A 47 -35.367 7.297 7.962 1.00 62.32 H new ATOM 0 HG13 VAL A 47 -33.646 6.948 8.250 1.00 62.32 H new ATOM 0 HG21 VAL A 47 -32.950 6.454 5.283 1.00 11.24 H new ATOM 0 HG22 VAL A 47 -32.418 5.392 6.608 1.00 11.24 H new ATOM 0 HG23 VAL A 47 -33.330 4.716 5.238 1.00 11.24 H new ATOM 697 N ILE A 48 -32.861 3.541 8.188 1.00 4.11 N ATOM 698 CA ILE A 48 -31.765 3.226 9.096 1.00 23.31 C ATOM 699 C ILE A 48 -30.855 4.433 9.299 1.00 42.35 C ATOM 700 O ILE A 48 -30.516 5.135 8.346 1.00 21.41 O ATOM 701 CB ILE A 48 -30.924 2.045 8.575 1.00 74.51 C ATOM 702 CG1 ILE A 48 -31.772 0.774 8.517 1.00 2.21 C ATOM 703 CG2 ILE A 48 -29.703 1.835 9.460 1.00 61.43 C ATOM 704 CD1 ILE A 48 -32.186 0.260 9.878 1.00 11.41 C ATOM 0 H ILE A 48 -32.818 3.057 7.291 1.00 4.11 H new ATOM 0 HA ILE A 48 -32.215 2.949 10.049 1.00 23.31 H new ATOM 0 HB ILE A 48 -30.582 2.277 7.566 1.00 74.51 H new ATOM 0 HG12 ILE A 48 -32.666 0.970 7.925 1.00 2.21 H new ATOM 0 HG13 ILE A 48 -31.211 -0.004 7.999 1.00 2.21 H new ATOM 0 HG21 ILE A 48 -29.118 0.997 9.080 1.00 61.43 H new ATOM 0 HG22 ILE A 48 -29.091 2.737 9.455 1.00 61.43 H new ATOM 0 HG23 ILE A 48 -30.025 1.620 10.479 1.00 61.43 H new ATOM 0 HD11 ILE A 48 -32.785 -0.643 9.759 1.00 11.41 H new ATOM 0 HD12 ILE A 48 -31.297 0.032 10.466 1.00 11.41 H new ATOM 0 HD13 ILE A 48 -32.775 1.021 10.391 1.00 11.41 H new ATOM 716 N ARG A 49 -30.462 4.668 10.547 1.00 61.21 N ATOM 717 CA ARG A 49 -29.591 5.789 10.876 1.00 55.21 C ATOM 718 C ARG A 49 -28.168 5.534 10.387 1.00 4.43 C ATOM 719 O ARG A 49 -27.799 4.397 10.089 1.00 74.42 O ATOM 720 CB ARG A 49 -29.587 6.034 12.386 1.00 75.12 C ATOM 721 CG ARG A 49 -28.968 7.364 12.786 1.00 63.14 C ATOM 722 CD ARG A 49 -29.173 7.651 14.264 1.00 21.00 C ATOM 723 NE ARG A 49 -28.455 8.848 14.694 1.00 40.53 N ATOM 724 CZ ARG A 49 -28.895 10.084 14.487 1.00 35.01 C ATOM 725 NH1 ARG A 49 -30.045 10.285 13.860 1.00 2.42 N1+ ATOM 726 NH2 ARG A 49 -28.183 11.122 14.909 1.00 44.41 N ATOM 0 H ARG A 49 -30.734 4.096 11.347 1.00 61.21 H new ATOM 0 HA ARG A 49 -29.976 6.676 10.372 1.00 55.21 H new ATOM 0 HB2 ARG A 49 -30.612 5.995 12.755 1.00 75.12 H new ATOM 0 HB3 ARG A 49 -29.041 5.227 12.875 1.00 75.12 H new ATOM 0 HG2 ARG A 49 -27.902 7.353 12.561 1.00 63.14 H new ATOM 0 HG3 ARG A 49 -29.410 8.165 12.194 1.00 63.14 H new ATOM 0 HD2 ARG A 49 -30.237 7.775 14.465 1.00 21.00 H new ATOM 0 HD3 ARG A 49 -28.835 6.796 14.850 1.00 21.00 H new ATOM 0 HE ARG A 49 -27.566 8.728 15.180 1.00 40.53 H new ATOM 0 HH11 ARG A 49 -30.595 9.490 13.535 1.00 2.42 H new ATOM 0 HH12 ARG A 49 -30.381 11.235 13.702 1.00 2.42 H new ATOM 0 HH21 ARG A 49 -27.298 10.970 15.392 1.00 44.41 H new ATOM 0 HH22 ARG A 49 -28.521 12.071 14.750 1.00 44.41 H new ATOM 740 N ILE A 50 -27.376 6.598 10.308 1.00 42.34 N ATOM 741 CA ILE A 50 -25.994 6.488 9.856 1.00 64.41 C ATOM 742 C ILE A 50 -25.150 5.704 10.855 1.00 25.51 C ATOM 743 O ILE A 50 -25.426 5.706 12.054 1.00 50.31 O ATOM 744 CB ILE A 50 -25.360 7.875 9.641 1.00 4.21 C ATOM 745 CG1 ILE A 50 -26.296 8.766 8.823 1.00 31.11 C ATOM 746 CG2 ILE A 50 -24.010 7.740 8.952 1.00 54.25 C ATOM 747 CD1 ILE A 50 -26.666 8.180 7.478 1.00 54.33 C ATOM 0 H ILE A 50 -27.667 7.545 10.551 1.00 42.34 H new ATOM 0 HA ILE A 50 -26.014 5.956 8.905 1.00 64.41 H new ATOM 0 HB ILE A 50 -25.203 8.341 10.614 1.00 4.21 H new ATOM 0 HG12 ILE A 50 -27.206 8.945 9.395 1.00 31.11 H new ATOM 0 HG13 ILE A 50 -25.820 9.735 8.670 1.00 31.11 H new ATOM 0 HG21 ILE A 50 -23.575 8.729 8.807 1.00 54.25 H new ATOM 0 HG22 ILE A 50 -23.344 7.138 9.570 1.00 54.25 H new ATOM 0 HG23 ILE A 50 -24.142 7.257 7.984 1.00 54.25 H new ATOM 0 HD11 ILE A 50 -27.331 8.865 6.953 1.00 54.33 H new ATOM 0 HD12 ILE A 50 -25.763 8.027 6.887 1.00 54.33 H new ATOM 0 HD13 ILE A 50 -27.170 7.225 7.624 1.00 54.33 H new ATOM 759 N GLY A 51 -24.116 5.035 10.353 1.00 2.14 N ATOM 760 CA GLY A 51 -23.245 4.258 11.215 1.00 43.44 C ATOM 761 C GLY A 51 -23.760 2.851 11.441 1.00 53.24 C ATOM 762 O GLY A 51 -23.292 2.148 12.337 1.00 63.33 O ATOM 0 H GLY A 51 -23.866 5.018 9.364 1.00 2.14 H new ATOM 0 HA2 GLY A 51 -22.250 4.211 10.773 1.00 43.44 H new ATOM 0 HA3 GLY A 51 -23.144 4.763 12.175 1.00 43.44 H new ATOM 766 N ALA A 52 -24.726 2.438 10.628 1.00 53.13 N ATOM 767 CA ALA A 52 -25.304 1.105 10.743 1.00 25.41 C ATOM 768 C ALA A 52 -24.788 0.186 9.642 1.00 3.24 C ATOM 769 O ALA A 52 -24.884 0.506 8.457 1.00 33.21 O ATOM 770 CB ALA A 52 -26.823 1.183 10.699 1.00 4.44 C ATOM 0 H ALA A 52 -25.125 3.008 9.882 1.00 53.13 H new ATOM 0 HA ALA A 52 -25.000 0.686 11.702 1.00 25.41 H new ATOM 0 HB1 ALA A 52 -27.241 0.180 10.786 1.00 4.44 H new ATOM 0 HB2 ALA A 52 -27.180 1.798 11.525 1.00 4.44 H new ATOM 0 HB3 ALA A 52 -27.137 1.627 9.754 1.00 4.44 H new ATOM 776 N GLU A 53 -24.238 -0.959 10.040 1.00 24.44 N ATOM 777 CA GLU A 53 -23.705 -1.922 9.084 1.00 12.23 C ATOM 778 C GLU A 53 -24.828 -2.552 8.263 1.00 61.23 C ATOM 779 O GLU A 53 -25.873 -2.917 8.799 1.00 62.55 O ATOM 780 CB GLU A 53 -22.918 -3.013 9.814 1.00 5.05 C ATOM 781 CG GLU A 53 -21.621 -2.519 10.432 1.00 63.31 C ATOM 782 CD GLU A 53 -21.175 -3.367 11.607 1.00 65.35 C ATOM 783 OE1 GLU A 53 -21.879 -3.367 12.639 1.00 22.21 O ATOM 784 OE2 GLU A 53 -20.122 -4.029 11.496 1.00 42.20 O1- ATOM 0 H GLU A 53 -24.151 -1.241 11.016 1.00 24.44 H new ATOM 0 HA GLU A 53 -23.036 -1.392 8.406 1.00 12.23 H new ATOM 0 HB2 GLU A 53 -23.545 -3.438 10.598 1.00 5.05 H new ATOM 0 HB3 GLU A 53 -22.693 -3.817 9.114 1.00 5.05 H new ATOM 0 HG2 GLU A 53 -20.839 -2.517 9.673 1.00 63.31 H new ATOM 0 HG3 GLU A 53 -21.749 -1.488 10.761 1.00 63.31 H new ATOM 791 N VAL A 54 -24.601 -2.674 6.960 1.00 22.21 N ATOM 792 CA VAL A 54 -25.591 -3.259 6.063 1.00 62.55 C ATOM 793 C VAL A 54 -25.375 -4.760 5.910 1.00 25.30 C ATOM 794 O VAL A 54 -24.241 -5.240 5.922 1.00 72.42 O ATOM 795 CB VAL A 54 -25.546 -2.601 4.671 1.00 34.21 C ATOM 796 CG1 VAL A 54 -24.147 -2.694 4.081 1.00 11.11 C ATOM 797 CG2 VAL A 54 -26.568 -3.243 3.745 1.00 22.21 C ATOM 0 H VAL A 54 -23.740 -2.376 6.501 1.00 22.21 H new ATOM 0 HA VAL A 54 -26.568 -3.079 6.510 1.00 62.55 H new ATOM 0 HB VAL A 54 -25.799 -1.546 4.779 1.00 34.21 H new ATOM 0 HG11 VAL A 54 -24.135 -2.224 3.098 1.00 11.11 H new ATOM 0 HG12 VAL A 54 -23.441 -2.183 4.736 1.00 11.11 H new ATOM 0 HG13 VAL A 54 -23.861 -3.742 3.986 1.00 11.11 H new ATOM 0 HG21 VAL A 54 -26.522 -2.766 2.766 1.00 22.21 H new ATOM 0 HG22 VAL A 54 -26.348 -4.306 3.641 1.00 22.21 H new ATOM 0 HG23 VAL A 54 -27.567 -3.118 4.163 1.00 22.21 H new ATOM 807 N LYS A 55 -26.471 -5.498 5.767 1.00 32.13 N ATOM 808 CA LYS A 55 -26.404 -6.946 5.610 1.00 11.44 C ATOM 809 C LYS A 55 -27.698 -7.489 5.015 1.00 24.20 C ATOM 810 O LYS A 55 -28.675 -6.757 4.856 1.00 53.12 O ATOM 811 CB LYS A 55 -26.131 -7.614 6.960 1.00 13.34 C ATOM 812 CG LYS A 55 -27.219 -7.369 7.990 1.00 34.42 C ATOM 813 CD LYS A 55 -26.877 -8.009 9.325 1.00 72.33 C ATOM 814 CE LYS A 55 -27.153 -9.505 9.314 1.00 54.12 C ATOM 815 NZ LYS A 55 -26.547 -10.190 10.490 1.00 75.44 N1+ ATOM 0 H LYS A 55 -27.417 -5.116 5.757 1.00 32.13 H new ATOM 0 HA LYS A 55 -25.586 -7.175 4.926 1.00 11.44 H new ATOM 0 HB2 LYS A 55 -26.020 -8.688 6.809 1.00 13.34 H new ATOM 0 HB3 LYS A 55 -25.182 -7.248 7.352 1.00 13.34 H new ATOM 0 HG2 LYS A 55 -27.359 -6.296 8.125 1.00 34.42 H new ATOM 0 HG3 LYS A 55 -28.164 -7.770 7.625 1.00 34.42 H new ATOM 0 HD2 LYS A 55 -25.826 -7.834 9.555 1.00 72.33 H new ATOM 0 HD3 LYS A 55 -27.459 -7.536 10.116 1.00 72.33 H new ATOM 0 HE2 LYS A 55 -28.230 -9.676 9.309 1.00 54.12 H new ATOM 0 HE3 LYS A 55 -26.757 -9.941 8.396 1.00 54.12 H new ATOM 0 HZ1 LYS A 55 -26.758 -11.207 10.446 1.00 75.44 H new ATOM 0 HZ2 LYS A 55 -25.517 -10.049 10.481 1.00 75.44 H new ATOM 0 HZ3 LYS A 55 -26.943 -9.792 11.366 1.00 75.44 H new ATOM 829 N ASP A 56 -27.700 -8.777 4.688 1.00 1.11 N ATOM 830 CA ASP A 56 -28.875 -9.419 4.113 1.00 50.12 C ATOM 831 C ASP A 56 -30.102 -9.194 4.991 1.00 51.21 C ATOM 832 O ASP A 56 -30.007 -9.186 6.218 1.00 22.43 O ATOM 833 CB ASP A 56 -28.629 -10.918 3.935 1.00 24.03 C ATOM 834 CG ASP A 56 -29.334 -11.481 2.717 1.00 74.11 C ATOM 835 OD1 ASP A 56 -29.135 -10.935 1.611 1.00 70.55 O ATOM 836 OD2 ASP A 56 -30.084 -12.467 2.869 1.00 42.54 O1- ATOM 0 H ASP A 56 -26.900 -9.397 4.812 1.00 1.11 H new ATOM 0 HA ASP A 56 -29.061 -8.971 3.137 1.00 50.12 H new ATOM 0 HB2 ASP A 56 -27.558 -11.099 3.847 1.00 24.03 H new ATOM 0 HB3 ASP A 56 -28.970 -11.447 4.825 1.00 24.03 H new ATOM 841 N GLY A 57 -31.254 -9.009 4.354 1.00 23.23 N ATOM 842 CA GLY A 57 -32.484 -8.786 5.093 1.00 2.42 C ATOM 843 C GLY A 57 -32.607 -7.359 5.592 1.00 30.44 C ATOM 844 O GLY A 57 -33.588 -7.006 6.246 1.00 50.43 O ATOM 0 H GLY A 57 -31.358 -9.009 3.339 1.00 23.23 H new ATOM 0 HA2 GLY A 57 -33.336 -9.020 4.454 1.00 2.42 H new ATOM 0 HA3 GLY A 57 -32.524 -9.470 5.941 1.00 2.42 H new ATOM 848 N ASP A 58 -31.610 -6.538 5.284 1.00 1.23 N ATOM 849 CA ASP A 58 -31.611 -5.142 5.707 1.00 24.33 C ATOM 850 C ASP A 58 -31.944 -4.220 4.537 1.00 44.22 C ATOM 851 O ASP A 58 -31.058 -3.801 3.791 1.00 4.32 O ATOM 852 CB ASP A 58 -30.252 -4.765 6.298 1.00 74.23 C ATOM 853 CG ASP A 58 -30.378 -3.870 7.516 1.00 42.34 C ATOM 854 OD1 ASP A 58 -31.431 -3.218 7.666 1.00 52.45 O ATOM 855 OD2 ASP A 58 -29.421 -3.821 8.317 1.00 60.24 O1- ATOM 0 H ASP A 58 -30.791 -6.814 4.743 1.00 1.23 H new ATOM 0 HA ASP A 58 -32.378 -5.020 6.472 1.00 24.33 H new ATOM 0 HB2 ASP A 58 -29.714 -5.672 6.572 1.00 74.23 H new ATOM 0 HB3 ASP A 58 -29.657 -4.258 5.538 1.00 74.23 H new ATOM 860 N LEU A 59 -33.226 -3.909 4.383 1.00 1.10 N ATOM 861 CA LEU A 59 -33.677 -3.038 3.304 1.00 32.31 C ATOM 862 C LEU A 59 -33.119 -1.629 3.472 1.00 22.24 C ATOM 863 O LEU A 59 -32.760 -0.971 2.494 1.00 63.34 O ATOM 864 CB LEU A 59 -35.206 -2.991 3.265 1.00 63.13 C ATOM 865 CG LEU A 59 -35.925 -4.312 3.538 1.00 21.11 C ATOM 866 CD1 LEU A 59 -36.505 -4.325 4.944 1.00 3.32 C ATOM 867 CD2 LEU A 59 -37.019 -4.546 2.507 1.00 13.30 C ATOM 0 H LEU A 59 -33.971 -4.247 4.992 1.00 1.10 H new ATOM 0 HA LEU A 59 -33.307 -3.446 2.363 1.00 32.31 H new ATOM 0 HB2 LEU A 59 -35.546 -2.258 3.996 1.00 63.13 H new ATOM 0 HB3 LEU A 59 -35.514 -2.629 2.284 1.00 63.13 H new ATOM 0 HG LEU A 59 -35.199 -5.121 3.459 1.00 21.11 H new ATOM 0 HD11 LEU A 59 -37.013 -5.273 5.119 1.00 3.32 H new ATOM 0 HD12 LEU A 59 -35.701 -4.204 5.670 1.00 3.32 H new ATOM 0 HD13 LEU A 59 -37.217 -3.507 5.051 1.00 3.32 H new ATOM 0 HD21 LEU A 59 -37.520 -5.491 2.717 1.00 13.30 H new ATOM 0 HD22 LEU A 59 -37.743 -3.733 2.554 1.00 13.30 H new ATOM 0 HD23 LEU A 59 -36.578 -4.582 1.511 1.00 13.30 H new ATOM 879 N LEU A 60 -33.044 -1.171 4.717 1.00 4.23 N ATOM 880 CA LEU A 60 -32.525 0.159 5.014 1.00 33.23 C ATOM 881 C LEU A 60 -33.422 1.239 4.418 1.00 4.21 C ATOM 882 O LEU A 60 -33.039 2.406 4.337 1.00 64.02 O ATOM 883 CB LEU A 60 -31.103 0.306 4.472 1.00 0.12 C ATOM 884 CG LEU A 60 -30.141 -0.839 4.791 1.00 74.51 C ATOM 885 CD1 LEU A 60 -29.064 -0.945 3.723 1.00 63.21 C ATOM 886 CD2 LEU A 60 -29.515 -0.643 6.165 1.00 1.41 C ATOM 0 H LEU A 60 -33.336 -1.702 5.537 1.00 4.23 H new ATOM 0 HA LEU A 60 -32.509 0.282 6.097 1.00 33.23 H new ATOM 0 HB2 LEU A 60 -31.158 0.416 3.389 1.00 0.12 H new ATOM 0 HB3 LEU A 60 -30.679 1.230 4.866 1.00 0.12 H new ATOM 0 HG LEU A 60 -30.707 -1.771 4.801 1.00 74.51 H new ATOM 0 HD11 LEU A 60 -28.389 -1.765 3.967 1.00 63.21 H new ATOM 0 HD12 LEU A 60 -29.529 -1.133 2.755 1.00 63.21 H new ATOM 0 HD13 LEU A 60 -28.501 -0.013 3.680 1.00 63.21 H new ATOM 0 HD21 LEU A 60 -28.833 -1.467 6.375 1.00 1.41 H new ATOM 0 HD22 LEU A 60 -28.964 0.297 6.183 1.00 1.41 H new ATOM 0 HD23 LEU A 60 -30.299 -0.619 6.922 1.00 1.41 H new ATOM 898 N VAL A 61 -34.622 0.842 4.003 1.00 0.20 N ATOM 899 CA VAL A 61 -35.576 1.775 3.418 1.00 71.21 C ATOM 900 C VAL A 61 -37.010 1.321 3.663 1.00 70.32 C ATOM 901 O VAL A 61 -37.356 0.165 3.421 1.00 31.11 O ATOM 902 CB VAL A 61 -35.350 1.933 1.902 1.00 31.34 C ATOM 903 CG1 VAL A 61 -36.440 2.797 1.287 1.00 4.22 C ATOM 904 CG2 VAL A 61 -33.974 2.520 1.627 1.00 2.31 C ATOM 0 H VAL A 61 -34.955 -0.120 4.062 1.00 0.20 H new ATOM 0 HA VAL A 61 -35.415 2.738 3.904 1.00 71.21 H new ATOM 0 HB VAL A 61 -35.398 0.947 1.440 1.00 31.34 H new ATOM 0 HG11 VAL A 61 -36.264 2.897 0.216 1.00 4.22 H new ATOM 0 HG12 VAL A 61 -37.411 2.330 1.453 1.00 4.22 H new ATOM 0 HG13 VAL A 61 -36.428 3.783 1.751 1.00 4.22 H new ATOM 0 HG21 VAL A 61 -33.831 2.625 0.551 1.00 2.31 H new ATOM 0 HG22 VAL A 61 -33.895 3.499 2.100 1.00 2.31 H new ATOM 0 HG23 VAL A 61 -33.208 1.858 2.032 1.00 2.31 H new ATOM 914 N GLY A 62 -37.843 2.240 4.143 1.00 71.04 N ATOM 915 CA GLY A 62 -39.231 1.915 4.413 1.00 31.12 C ATOM 916 C GLY A 62 -40.159 2.367 3.302 1.00 34.53 C ATOM 917 O GLY A 62 -40.508 3.544 3.217 1.00 41.31 O ATOM 0 H GLY A 62 -37.581 3.204 4.350 1.00 71.04 H new ATOM 0 HA2 GLY A 62 -39.329 0.838 4.548 1.00 31.12 H new ATOM 0 HA3 GLY A 62 -39.535 2.383 5.349 1.00 31.12 H new ATOM 921 N LYS A 63 -40.557 1.431 2.448 1.00 64.14 N ATOM 922 CA LYS A 63 -41.449 1.738 1.337 1.00 33.22 C ATOM 923 C LYS A 63 -42.539 0.680 1.205 1.00 20.52 C ATOM 924 O LYS A 63 -42.252 -0.500 1.002 1.00 13.53 O ATOM 925 CB LYS A 63 -40.656 1.834 0.031 1.00 74.02 C ATOM 926 CG LYS A 63 -41.273 2.778 -0.987 1.00 20.40 C ATOM 927 CD LYS A 63 -40.244 3.260 -1.995 1.00 71.32 C ATOM 928 CE LYS A 63 -39.719 2.115 -2.849 1.00 42.40 C ATOM 929 NZ LYS A 63 -38.867 2.603 -3.968 1.00 61.51 N1+ ATOM 0 H LYS A 63 -40.275 0.452 2.504 1.00 64.14 H new ATOM 0 HA LYS A 63 -41.923 2.699 1.539 1.00 33.22 H new ATOM 0 HB2 LYS A 63 -39.642 2.166 0.255 1.00 74.02 H new ATOM 0 HB3 LYS A 63 -40.576 0.840 -0.409 1.00 74.02 H new ATOM 0 HG2 LYS A 63 -42.085 2.272 -1.509 1.00 20.40 H new ATOM 0 HG3 LYS A 63 -41.709 3.634 -0.473 1.00 20.40 H new ATOM 0 HD2 LYS A 63 -40.691 4.019 -2.637 1.00 71.32 H new ATOM 0 HD3 LYS A 63 -39.414 3.734 -1.471 1.00 71.32 H new ATOM 0 HE2 LYS A 63 -39.143 1.431 -2.225 1.00 42.40 H new ATOM 0 HE3 LYS A 63 -40.558 1.548 -3.252 1.00 42.40 H new ATOM 0 HZ1 LYS A 63 -38.781 1.858 -4.689 1.00 61.51 H new ATOM 0 HZ2 LYS A 63 -39.301 3.447 -4.392 1.00 61.51 H new ATOM 0 HZ3 LYS A 63 -37.923 2.845 -3.605 1.00 61.51 H new ATOM 943 N VAL A 64 -43.792 1.108 1.321 1.00 71.05 N ATOM 944 CA VAL A 64 -44.925 0.198 1.212 1.00 72.21 C ATOM 945 C VAL A 64 -46.189 0.942 0.796 1.00 72.14 C ATOM 946 O VAL A 64 -46.277 2.163 0.926 1.00 61.31 O ATOM 947 CB VAL A 64 -45.187 -0.533 2.541 1.00 41.14 C ATOM 948 CG1 VAL A 64 -44.250 -1.722 2.691 1.00 41.34 C ATOM 949 CG2 VAL A 64 -45.039 0.424 3.714 1.00 71.41 C ATOM 0 H VAL A 64 -44.048 2.081 1.491 1.00 71.05 H new ATOM 0 HA VAL A 64 -44.670 -0.535 0.447 1.00 72.21 H new ATOM 0 HB VAL A 64 -46.211 -0.907 2.534 1.00 41.14 H new ATOM 0 HG11 VAL A 64 -44.450 -2.226 3.636 1.00 41.34 H new ATOM 0 HG12 VAL A 64 -44.411 -2.418 1.868 1.00 41.34 H new ATOM 0 HG13 VAL A 64 -43.217 -1.375 2.677 1.00 41.34 H new ATOM 0 HG21 VAL A 64 -45.228 -0.110 4.645 1.00 71.41 H new ATOM 0 HG22 VAL A 64 -44.027 0.830 3.727 1.00 71.41 H new ATOM 0 HG23 VAL A 64 -45.756 1.239 3.611 1.00 71.41 H new ATOM 959 N THR A 65 -47.170 0.197 0.295 1.00 75.31 N ATOM 960 CA THR A 65 -48.431 0.784 -0.141 1.00 21.11 C ATOM 961 C THR A 65 -49.618 -0.037 0.347 1.00 50.33 C ATOM 962 O THR A 65 -49.527 -1.249 0.544 1.00 22.30 O ATOM 963 CB THR A 65 -48.496 0.898 -1.676 1.00 51.22 C ATOM 964 OG1 THR A 65 -47.604 -0.047 -2.276 1.00 52.43 O ATOM 965 CG2 THR A 65 -48.134 2.304 -2.131 1.00 65.41 C ATOM 0 H THR A 65 -47.115 -0.815 0.181 1.00 75.31 H new ATOM 0 HA THR A 65 -48.481 1.783 0.293 1.00 21.11 H new ATOM 0 HB THR A 65 -49.517 0.683 -1.990 1.00 51.22 H new ATOM 0 HG1 THR A 65 -47.653 0.031 -3.252 1.00 52.43 H new ATOM 0 HG21 THR A 65 -48.187 2.360 -3.218 1.00 65.41 H new ATOM 0 HG22 THR A 65 -48.833 3.018 -1.697 1.00 65.41 H new ATOM 0 HG23 THR A 65 -47.122 2.543 -1.804 1.00 65.41 H new ATOM 973 N PRO A 66 -50.762 0.635 0.546 1.00 71.34 N ATOM 974 CA PRO A 66 -51.990 -0.013 1.014 1.00 72.00 C ATOM 975 C PRO A 66 -52.599 -0.930 -0.042 1.00 31.14 C ATOM 976 O PRO A 66 -52.649 -0.585 -1.224 1.00 4.01 O ATOM 977 CB PRO A 66 -52.925 1.164 1.303 1.00 54.11 C ATOM 978 CG PRO A 66 -52.432 2.263 0.427 1.00 72.32 C ATOM 979 CD PRO A 66 -50.942 2.081 0.332 1.00 51.54 C ATOM 0 HA PRO A 66 -51.810 -0.653 1.878 1.00 72.00 H new ATOM 0 HB2 PRO A 66 -53.961 0.912 1.076 1.00 54.11 H new ATOM 0 HB3 PRO A 66 -52.889 1.449 2.354 1.00 54.11 H new ATOM 0 HG2 PRO A 66 -52.895 2.214 -0.559 1.00 72.32 H new ATOM 0 HG3 PRO A 66 -52.680 3.238 0.847 1.00 72.32 H new ATOM 0 HD2 PRO A 66 -50.560 2.394 -0.640 1.00 51.54 H new ATOM 0 HD3 PRO A 66 -50.416 2.668 1.086 1.00 51.54 H new ATOM 987 N LYS A 67 -53.061 -2.097 0.390 1.00 13.34 N ATOM 988 CA LYS A 67 -53.669 -3.064 -0.517 1.00 22.03 C ATOM 989 C LYS A 67 -55.164 -2.801 -0.669 1.00 61.40 C ATOM 990 O LYS A 67 -55.746 -2.019 0.081 1.00 45.12 O ATOM 991 CB LYS A 67 -53.441 -4.488 -0.006 1.00 13.12 C ATOM 992 CG LYS A 67 -51.974 -4.845 0.165 1.00 24.12 C ATOM 993 CD LYS A 67 -51.417 -5.521 -1.077 1.00 43.33 C ATOM 994 CE LYS A 67 -51.939 -6.943 -1.218 1.00 51.24 C ATOM 995 NZ LYS A 67 -53.061 -7.027 -2.195 1.00 22.33 N1+ ATOM 0 H LYS A 67 -53.026 -2.397 1.364 1.00 13.34 H new ATOM 0 HA LYS A 67 -53.197 -2.955 -1.493 1.00 22.03 H new ATOM 0 HB2 LYS A 67 -53.949 -4.608 0.951 1.00 13.12 H new ATOM 0 HB3 LYS A 67 -53.899 -5.192 -0.701 1.00 13.12 H new ATOM 0 HG2 LYS A 67 -51.401 -3.942 0.377 1.00 24.12 H new ATOM 0 HG3 LYS A 67 -51.857 -5.506 1.024 1.00 24.12 H new ATOM 0 HD2 LYS A 67 -51.689 -4.943 -1.960 1.00 43.33 H new ATOM 0 HD3 LYS A 67 -50.328 -5.535 -1.028 1.00 43.33 H new ATOM 0 HE2 LYS A 67 -51.128 -7.597 -1.538 1.00 51.24 H new ATOM 0 HE3 LYS A 67 -52.275 -7.305 -0.246 1.00 51.24 H new ATOM 0 HZ1 LYS A 67 -53.945 -7.239 -1.691 1.00 22.33 H new ATOM 0 HZ2 LYS A 67 -53.156 -6.119 -2.693 1.00 22.33 H new ATOM 0 HZ3 LYS A 67 -52.866 -7.781 -2.884 1.00 22.33 H new ATOM 1009 N GLY A 68 -55.780 -3.462 -1.645 1.00 41.33 N ATOM 1010 CA GLY A 68 -57.201 -3.287 -1.877 1.00 62.55 C ATOM 1011 C GLY A 68 -57.946 -4.606 -1.935 1.00 22.32 C ATOM 1012 O GLY A 68 -57.334 -5.674 -1.939 1.00 24.52 O ATOM 0 H GLY A 68 -55.320 -4.115 -2.279 1.00 41.33 H new ATOM 0 HA2 GLY A 68 -57.622 -2.670 -1.083 1.00 62.55 H new ATOM 0 HA3 GLY A 68 -57.350 -2.748 -2.813 1.00 62.55 H new ATOM 1016 N VAL A 69 -59.273 -4.534 -1.980 1.00 13.52 N ATOM 1017 CA VAL A 69 -60.102 -5.731 -2.038 1.00 23.11 C ATOM 1018 C VAL A 69 -60.206 -6.260 -3.464 1.00 22.23 C ATOM 1019 O VAL A 69 -60.383 -7.459 -3.683 1.00 32.21 O ATOM 1020 CB VAL A 69 -61.519 -5.459 -1.499 1.00 70.31 C ATOM 1021 CG1 VAL A 69 -62.242 -4.453 -2.381 1.00 51.03 C ATOM 1022 CG2 VAL A 69 -62.308 -6.756 -1.398 1.00 34.25 C ATOM 0 H VAL A 69 -59.796 -3.659 -1.977 1.00 13.52 H new ATOM 0 HA VAL A 69 -59.620 -6.480 -1.410 1.00 23.11 H new ATOM 0 HB VAL A 69 -61.433 -5.033 -0.499 1.00 70.31 H new ATOM 0 HG11 VAL A 69 -63.241 -4.274 -1.984 1.00 51.03 H new ATOM 0 HG12 VAL A 69 -61.684 -3.517 -2.397 1.00 51.03 H new ATOM 0 HG13 VAL A 69 -62.319 -4.847 -3.394 1.00 51.03 H new ATOM 0 HG21 VAL A 69 -63.307 -6.545 -1.015 1.00 34.25 H new ATOM 0 HG22 VAL A 69 -62.386 -7.212 -2.385 1.00 34.25 H new ATOM 0 HG23 VAL A 69 -61.797 -7.441 -0.721 1.00 34.25 H new ATOM 1032 N THR A 70 -60.093 -5.357 -4.434 1.00 55.35 N ATOM 1033 CA THR A 70 -60.174 -5.732 -5.839 1.00 0.23 C ATOM 1034 C THR A 70 -59.159 -6.818 -6.179 1.00 24.22 C ATOM 1035 O THR A 70 -59.443 -7.720 -6.965 1.00 33.12 O ATOM 1036 CB THR A 70 -59.937 -4.518 -6.758 1.00 23.51 C ATOM 1037 OG1 THR A 70 -60.592 -3.364 -6.224 1.00 74.35 O ATOM 1038 CG2 THR A 70 -60.452 -4.795 -8.164 1.00 3.05 C ATOM 0 H THR A 70 -59.945 -4.361 -4.271 1.00 55.35 H new ATOM 0 HA THR A 70 -61.181 -6.115 -6.006 1.00 0.23 H new ATOM 0 HB THR A 70 -58.864 -4.334 -6.810 1.00 23.51 H new ATOM 0 HG1 THR A 70 -60.435 -2.597 -6.813 1.00 74.35 H new ATOM 0 HG21 THR A 70 -60.274 -3.924 -8.795 1.00 3.05 H new ATOM 0 HG22 THR A 70 -59.930 -5.657 -8.579 1.00 3.05 H new ATOM 0 HG23 THR A 70 -61.521 -5.003 -8.125 1.00 3.05 H new ATOM 1046 N GLU A 71 -57.976 -6.725 -5.580 1.00 11.11 N ATOM 1047 CA GLU A 71 -56.919 -7.700 -5.820 1.00 34.23 C ATOM 1048 C GLU A 71 -56.447 -8.323 -4.510 1.00 23.33 C ATOM 1049 O GLU A 71 -55.286 -8.178 -4.123 1.00 53.31 O ATOM 1050 CB GLU A 71 -55.741 -7.042 -6.539 1.00 54.35 C ATOM 1051 CG GLU A 71 -55.902 -6.986 -8.049 1.00 72.01 C ATOM 1052 CD GLU A 71 -55.558 -8.301 -8.722 1.00 25.40 C ATOM 1053 OE1 GLU A 71 -56.010 -9.356 -8.230 1.00 5.12 O ATOM 1054 OE2 GLU A 71 -54.836 -8.273 -9.740 1.00 23.50 O1- ATOM 0 H GLU A 71 -57.726 -5.984 -4.925 1.00 11.11 H new ATOM 0 HA GLU A 71 -57.325 -8.490 -6.452 1.00 34.23 H new ATOM 0 HB2 GLU A 71 -55.614 -6.029 -6.158 1.00 54.35 H new ATOM 0 HB3 GLU A 71 -54.829 -7.589 -6.300 1.00 54.35 H new ATOM 0 HG2 GLU A 71 -56.930 -6.716 -8.291 1.00 72.01 H new ATOM 0 HG3 GLU A 71 -55.263 -6.199 -8.450 1.00 72.01 H new ATOM 1061 N LEU A 72 -57.353 -9.017 -3.831 1.00 12.50 N ATOM 1062 CA LEU A 72 -57.030 -9.662 -2.563 1.00 60.42 C ATOM 1063 C LEU A 72 -57.009 -11.180 -2.715 1.00 51.14 C ATOM 1064 O LEU A 72 -57.446 -11.720 -3.732 1.00 34.14 O ATOM 1065 CB LEU A 72 -58.044 -9.261 -1.490 1.00 44.10 C ATOM 1066 CG LEU A 72 -57.503 -9.141 -0.066 1.00 41.21 C ATOM 1067 CD1 LEU A 72 -56.398 -8.098 0.000 1.00 14.22 C ATOM 1068 CD2 LEU A 72 -58.624 -8.796 0.903 1.00 4.04 C ATOM 0 H LEU A 72 -58.317 -9.148 -4.137 1.00 12.50 H new ATOM 0 HA LEU A 72 -56.037 -9.331 -2.258 1.00 60.42 H new ATOM 0 HB2 LEU A 72 -58.482 -8.304 -1.772 1.00 44.10 H new ATOM 0 HB3 LEU A 72 -58.851 -9.993 -1.490 1.00 44.10 H new ATOM 0 HG LEU A 72 -57.082 -10.104 0.224 1.00 41.21 H new ATOM 0 HD11 LEU A 72 -56.025 -8.027 1.022 1.00 14.22 H new ATOM 0 HD12 LEU A 72 -55.584 -8.388 -0.664 1.00 14.22 H new ATOM 0 HD13 LEU A 72 -56.792 -7.130 -0.311 1.00 14.22 H new ATOM 0 HD21 LEU A 72 -58.220 -8.715 1.912 1.00 4.04 H new ATOM 0 HD22 LEU A 72 -59.075 -7.846 0.615 1.00 4.04 H new ATOM 0 HD23 LEU A 72 -59.381 -9.580 0.877 1.00 4.04 H new ATOM 1080 N THR A 73 -56.498 -11.865 -1.695 1.00 73.31 N ATOM 1081 CA THR A 73 -56.421 -13.320 -1.715 1.00 33.52 C ATOM 1082 C THR A 73 -57.623 -13.944 -1.015 1.00 24.20 C ATOM 1083 O THR A 73 -58.239 -13.326 -0.148 1.00 22.42 O ATOM 1084 CB THR A 73 -55.130 -13.823 -1.041 1.00 30.40 C ATOM 1085 OG1 THR A 73 -55.207 -13.620 0.375 1.00 65.52 O ATOM 1086 CG2 THR A 73 -53.912 -13.100 -1.596 1.00 71.53 C ATOM 0 H THR A 73 -56.132 -11.435 -0.846 1.00 73.31 H new ATOM 0 HA THR A 73 -56.417 -13.622 -2.762 1.00 33.52 H new ATOM 0 HB THR A 73 -55.027 -14.888 -1.251 1.00 30.40 H new ATOM 0 HG1 THR A 73 -54.384 -13.944 0.797 1.00 65.52 H new ATOM 0 HG21 THR A 73 -53.013 -13.472 -1.105 1.00 71.53 H new ATOM 0 HG22 THR A 73 -53.840 -13.279 -2.669 1.00 71.53 H new ATOM 0 HG23 THR A 73 -54.009 -12.030 -1.413 1.00 71.53 H new ATOM 1094 N ALA A 74 -57.951 -15.175 -1.398 1.00 25.51 N ATOM 1095 CA ALA A 74 -59.077 -15.883 -0.804 1.00 22.05 C ATOM 1096 C ALA A 74 -58.906 -16.023 0.704 1.00 64.11 C ATOM 1097 O ALA A 74 -59.884 -16.034 1.451 1.00 22.20 O ATOM 1098 CB ALA A 74 -59.237 -17.253 -1.449 1.00 52.43 C ATOM 0 H ALA A 74 -57.453 -15.701 -2.116 1.00 25.51 H new ATOM 0 HA ALA A 74 -59.979 -15.299 -0.987 1.00 22.05 H new ATOM 0 HB1 ALA A 74 -60.082 -17.772 -0.996 1.00 52.43 H new ATOM 0 HB2 ALA A 74 -59.415 -17.133 -2.518 1.00 52.43 H new ATOM 0 HB3 ALA A 74 -58.329 -17.836 -1.295 1.00 52.43 H new ATOM 1104 N GLU A 75 -57.656 -16.130 1.146 1.00 71.15 N ATOM 1105 CA GLU A 75 -57.359 -16.271 2.566 1.00 23.11 C ATOM 1106 C GLU A 75 -57.801 -15.032 3.340 1.00 12.34 C ATOM 1107 O GLU A 75 -58.243 -15.128 4.485 1.00 50.21 O ATOM 1108 CB GLU A 75 -55.861 -16.507 2.775 1.00 42.41 C ATOM 1109 CG GLU A 75 -55.361 -17.810 2.175 1.00 25.54 C ATOM 1110 CD GLU A 75 -53.858 -17.823 1.976 1.00 73.13 C ATOM 1111 OE1 GLU A 75 -53.254 -16.730 1.944 1.00 41.51 O ATOM 1112 OE2 GLU A 75 -53.285 -18.926 1.852 1.00 65.41 O1- ATOM 0 H GLU A 75 -56.834 -16.122 0.541 1.00 71.15 H new ATOM 0 HA GLU A 75 -57.912 -17.131 2.943 1.00 23.11 H new ATOM 0 HB2 GLU A 75 -55.306 -15.678 2.336 1.00 42.41 H new ATOM 0 HB3 GLU A 75 -55.647 -16.503 3.844 1.00 42.41 H new ATOM 0 HG2 GLU A 75 -55.645 -18.637 2.826 1.00 25.54 H new ATOM 0 HG3 GLU A 75 -55.852 -17.976 1.216 1.00 25.54 H new ATOM 1119 N GLU A 76 -57.680 -13.870 2.706 1.00 50.31 N ATOM 1120 CA GLU A 76 -58.066 -12.612 3.335 1.00 72.21 C ATOM 1121 C GLU A 76 -59.570 -12.571 3.589 1.00 22.24 C ATOM 1122 O GLU A 76 -60.032 -11.947 4.544 1.00 10.21 O ATOM 1123 CB GLU A 76 -57.653 -11.429 2.458 1.00 62.24 C ATOM 1124 CG GLU A 76 -56.159 -11.151 2.476 1.00 64.30 C ATOM 1125 CD GLU A 76 -55.625 -10.921 3.877 1.00 33.44 C ATOM 1126 OE1 GLU A 76 -56.170 -10.049 4.584 1.00 31.41 O ATOM 1127 OE2 GLU A 76 -54.662 -11.614 4.265 1.00 3.21 O1- ATOM 0 H GLU A 76 -57.318 -13.773 1.757 1.00 50.31 H new ATOM 0 HA GLU A 76 -57.551 -12.541 4.293 1.00 72.21 H new ATOM 0 HB2 GLU A 76 -57.966 -11.621 1.432 1.00 62.24 H new ATOM 0 HB3 GLU A 76 -58.184 -10.537 2.791 1.00 62.24 H new ATOM 0 HG2 GLU A 76 -55.632 -11.991 2.023 1.00 64.30 H new ATOM 0 HG3 GLU A 76 -55.949 -10.275 1.863 1.00 64.30 H new ATOM 1134 N ARG A 77 -60.328 -13.240 2.727 1.00 60.41 N ATOM 1135 CA ARG A 77 -61.780 -13.279 2.855 1.00 75.45 C ATOM 1136 C ARG A 77 -62.198 -14.148 4.038 1.00 5.25 C ATOM 1137 O ARG A 77 -63.012 -13.738 4.866 1.00 54.11 O ATOM 1138 CB ARG A 77 -62.414 -13.810 1.569 1.00 61.41 C ATOM 1139 CG ARG A 77 -61.826 -13.205 0.305 1.00 55.33 C ATOM 1140 CD ARG A 77 -62.517 -13.735 -0.942 1.00 52.34 C ATOM 1141 NE ARG A 77 -62.421 -15.189 -1.042 1.00 62.33 N ATOM 1142 CZ ARG A 77 -62.828 -15.881 -2.101 1.00 34.33 C ATOM 1143 NH1 ARG A 77 -63.356 -15.253 -3.143 1.00 23.02 N1+ ATOM 1144 NH2 ARG A 77 -62.708 -17.202 -2.119 1.00 22.33 N ATOM 0 H ARG A 77 -59.961 -13.763 1.932 1.00 60.41 H new ATOM 0 HA ARG A 77 -62.131 -12.262 3.031 1.00 75.45 H new ATOM 0 HB2 ARG A 77 -62.292 -14.893 1.534 1.00 61.41 H new ATOM 0 HB3 ARG A 77 -63.485 -13.610 1.593 1.00 61.41 H new ATOM 0 HG2 ARG A 77 -61.922 -12.120 0.342 1.00 55.33 H new ATOM 0 HG3 ARG A 77 -60.761 -13.430 0.255 1.00 55.33 H new ATOM 0 HD2 ARG A 77 -63.566 -13.441 -0.928 1.00 52.34 H new ATOM 0 HD3 ARG A 77 -62.070 -13.280 -1.826 1.00 52.34 H new ATOM 0 HE ARG A 77 -62.020 -15.701 -0.256 1.00 62.33 H new ATOM 0 HH11 ARG A 77 -63.450 -14.237 -3.132 1.00 23.02 H new ATOM 0 HH12 ARG A 77 -63.668 -15.786 -3.955 1.00 23.02 H new ATOM 0 HH21 ARG A 77 -62.303 -17.688 -1.319 1.00 22.33 H new ATOM 0 HH22 ARG A 77 -63.021 -17.731 -2.933 1.00 22.33 H new ATOM 1158 N LEU A 78 -61.636 -15.349 4.109 1.00 4.11 N ATOM 1159 CA LEU A 78 -61.951 -16.278 5.190 1.00 63.30 C ATOM 1160 C LEU A 78 -61.328 -15.816 6.503 1.00 1.51 C ATOM 1161 O LEU A 78 -61.824 -16.135 7.584 1.00 72.43 O ATOM 1162 CB LEU A 78 -61.454 -17.682 4.843 1.00 62.25 C ATOM 1163 CG LEU A 78 -59.967 -17.805 4.512 1.00 4.10 C ATOM 1164 CD1 LEU A 78 -59.142 -17.900 5.787 1.00 71.01 C ATOM 1165 CD2 LEU A 78 -59.716 -19.014 3.622 1.00 24.05 C ATOM 0 H LEU A 78 -60.960 -15.703 3.432 1.00 4.11 H new ATOM 0 HA LEU A 78 -63.034 -16.302 5.311 1.00 63.30 H new ATOM 0 HB2 LEU A 78 -61.675 -18.341 5.682 1.00 62.25 H new ATOM 0 HB3 LEU A 78 -62.027 -18.048 3.991 1.00 62.25 H new ATOM 0 HG LEU A 78 -59.661 -16.910 3.970 1.00 4.10 H new ATOM 0 HD11 LEU A 78 -58.086 -17.987 5.531 1.00 71.01 H new ATOM 0 HD12 LEU A 78 -59.297 -17.004 6.388 1.00 71.01 H new ATOM 0 HD13 LEU A 78 -59.451 -18.777 6.356 1.00 71.01 H new ATOM 0 HD21 LEU A 78 -58.652 -19.085 3.397 1.00 24.05 H new ATOM 0 HD22 LEU A 78 -60.039 -19.918 4.137 1.00 24.05 H new ATOM 0 HD23 LEU A 78 -60.277 -18.905 2.694 1.00 24.05 H new ATOM 1177 N LEU A 79 -60.239 -15.061 6.402 1.00 73.12 N ATOM 1178 CA LEU A 79 -59.550 -14.551 7.583 1.00 25.52 C ATOM 1179 C LEU A 79 -60.477 -13.678 8.421 1.00 13.43 C ATOM 1180 O LEU A 79 -60.297 -13.548 9.633 1.00 45.51 O ATOM 1181 CB LEU A 79 -58.313 -13.751 7.169 1.00 42.42 C ATOM 1182 CG LEU A 79 -57.004 -14.536 7.084 1.00 44.11 C ATOM 1183 CD1 LEU A 79 -55.963 -13.753 6.298 1.00 40.45 C ATOM 1184 CD2 LEU A 79 -56.486 -14.865 8.476 1.00 24.32 C ATOM 0 H LEU A 79 -59.814 -14.789 5.515 1.00 73.12 H new ATOM 0 HA LEU A 79 -59.240 -15.403 8.188 1.00 25.52 H new ATOM 0 HB2 LEU A 79 -58.506 -13.299 6.196 1.00 42.42 H new ATOM 0 HB3 LEU A 79 -58.178 -12.935 7.879 1.00 42.42 H new ATOM 0 HG LEU A 79 -57.198 -15.472 6.561 1.00 44.11 H new ATOM 0 HD11 LEU A 79 -55.038 -14.327 6.248 1.00 40.45 H new ATOM 0 HD12 LEU A 79 -56.331 -13.569 5.289 1.00 40.45 H new ATOM 0 HD13 LEU A 79 -55.773 -12.801 6.794 1.00 40.45 H new ATOM 0 HD21 LEU A 79 -55.554 -15.424 8.395 1.00 24.32 H new ATOM 0 HD22 LEU A 79 -56.308 -13.941 9.026 1.00 24.32 H new ATOM 0 HD23 LEU A 79 -57.224 -15.466 9.006 1.00 24.32 H new ATOM 1196 N HIS A 80 -61.471 -13.083 7.770 1.00 75.01 N ATOM 1197 CA HIS A 80 -62.429 -12.225 8.457 1.00 1.10 C ATOM 1198 C HIS A 80 -63.206 -13.010 9.510 1.00 41.42 C ATOM 1199 O HIS A 80 -63.601 -12.464 10.539 1.00 43.25 O ATOM 1200 CB HIS A 80 -63.397 -11.600 7.453 1.00 42.21 C ATOM 1201 CG HIS A 80 -64.459 -10.758 8.089 1.00 54.33 C ATOM 1202 ND1 HIS A 80 -65.765 -11.177 8.238 1.00 50.24 N ATOM 1203 CD2 HIS A 80 -64.403 -9.513 8.619 1.00 45.33 C ATOM 1204 CE1 HIS A 80 -66.466 -10.227 8.830 1.00 33.42 C ATOM 1205 NE2 HIS A 80 -65.664 -9.206 9.072 1.00 55.02 N ATOM 0 H HIS A 80 -61.634 -13.179 6.768 1.00 75.01 H new ATOM 0 HA HIS A 80 -61.874 -11.432 8.958 1.00 1.10 H new ATOM 0 HB2 HIS A 80 -62.833 -10.988 6.749 1.00 42.21 H new ATOM 0 HB3 HIS A 80 -63.871 -12.394 6.876 1.00 42.21 H new ATOM 0 HD1 HIS A 80 -66.132 -12.080 7.938 1.00 50.24 H new ATOM 0 HD2 HIS A 80 -63.530 -8.879 8.675 1.00 45.33 H new ATOM 0 HE1 HIS A 80 -67.517 -10.277 9.075 1.00 33.42 H new ATOM 1213 N ALA A 81 -63.421 -14.294 9.243 1.00 63.15 N ATOM 1214 CA ALA A 81 -64.149 -15.156 10.167 1.00 52.51 C ATOM 1215 C ALA A 81 -63.282 -15.534 11.363 1.00 71.02 C ATOM 1216 O ALA A 81 -63.795 -15.840 12.441 1.00 50.32 O ATOM 1217 CB ALA A 81 -64.637 -16.405 9.451 1.00 34.12 C ATOM 0 H ALA A 81 -63.101 -14.761 8.394 1.00 63.15 H new ATOM 0 HA ALA A 81 -65.012 -14.603 10.537 1.00 52.51 H new ATOM 0 HB1 ALA A 81 -65.179 -17.039 10.153 1.00 34.12 H new ATOM 0 HB2 ALA A 81 -65.300 -16.120 8.634 1.00 34.12 H new ATOM 0 HB3 ALA A 81 -63.783 -16.953 9.052 1.00 34.12 H new ATOM 1223 N ILE A 82 -61.969 -15.512 11.167 1.00 14.21 N ATOM 1224 CA ILE A 82 -61.032 -15.852 12.230 1.00 11.44 C ATOM 1225 C ILE A 82 -60.900 -14.711 13.234 1.00 25.11 C ATOM 1226 O ILE A 82 -61.198 -14.874 14.417 1.00 24.25 O ATOM 1227 CB ILE A 82 -59.639 -16.188 11.666 1.00 54.10 C ATOM 1228 CG1 ILE A 82 -59.761 -17.153 10.485 1.00 55.43 C ATOM 1229 CG2 ILE A 82 -58.757 -16.783 12.754 1.00 73.32 C ATOM 1230 CD1 ILE A 82 -58.431 -17.527 9.869 1.00 45.00 C ATOM 0 H ILE A 82 -61.529 -15.262 10.281 1.00 14.21 H new ATOM 0 HA ILE A 82 -61.433 -16.731 12.734 1.00 11.44 H new ATOM 0 HB ILE A 82 -59.175 -15.267 11.312 1.00 54.10 H new ATOM 0 HG12 ILE A 82 -60.266 -18.060 10.818 1.00 55.43 H new ATOM 0 HG13 ILE A 82 -60.392 -16.700 9.720 1.00 55.43 H new ATOM 0 HG21 ILE A 82 -57.776 -17.015 12.340 1.00 73.32 H new ATOM 0 HG22 ILE A 82 -58.647 -16.065 13.567 1.00 73.32 H new ATOM 0 HG23 ILE A 82 -59.215 -17.695 13.135 1.00 73.32 H new ATOM 0 HD11 ILE A 82 -58.595 -18.213 9.038 1.00 45.00 H new ATOM 0 HD12 ILE A 82 -57.933 -16.628 9.505 1.00 45.00 H new ATOM 0 HD13 ILE A 82 -57.805 -18.009 10.620 1.00 45.00 H new ATOM 1242 N PHE A 83 -60.454 -13.555 12.751 1.00 72.31 N ATOM 1243 CA PHE A 83 -60.284 -12.386 13.606 1.00 63.53 C ATOM 1244 C PHE A 83 -61.633 -11.757 13.941 1.00 3.44 C ATOM 1245 O PHE A 83 -61.784 -11.097 14.969 1.00 52.42 O ATOM 1246 CB PHE A 83 -59.385 -11.355 12.922 1.00 53.14 C ATOM 1247 CG PHE A 83 -57.977 -11.346 13.446 1.00 4.12 C ATOM 1248 CD1 PHE A 83 -57.643 -10.592 14.559 1.00 53.02 C ATOM 1249 CD2 PHE A 83 -56.987 -12.092 12.825 1.00 44.11 C ATOM 1250 CE1 PHE A 83 -56.348 -10.583 15.045 1.00 32.53 C ATOM 1251 CE2 PHE A 83 -55.691 -12.086 13.305 1.00 2.50 C ATOM 1252 CZ PHE A 83 -55.371 -11.330 14.416 1.00 24.31 C ATOM 0 H PHE A 83 -60.204 -13.403 11.774 1.00 72.31 H new ATOM 0 HA PHE A 83 -59.813 -12.711 14.534 1.00 63.53 H new ATOM 0 HB2 PHE A 83 -59.364 -11.556 11.851 1.00 53.14 H new ATOM 0 HB3 PHE A 83 -59.819 -10.363 13.052 1.00 53.14 H new ATOM 0 HD1 PHE A 83 -58.403 -10.004 15.053 1.00 53.02 H new ATOM 0 HD2 PHE A 83 -57.231 -12.685 11.956 1.00 44.11 H new ATOM 0 HE1 PHE A 83 -56.101 -9.993 15.915 1.00 32.53 H new ATOM 0 HE2 PHE A 83 -54.929 -12.672 12.812 1.00 2.50 H new ATOM 0 HZ PHE A 83 -54.359 -11.323 14.792 1.00 24.31 H new ATOM 1262 N GLY A 84 -62.611 -11.967 13.066 1.00 11.45 N ATOM 1263 CA GLY A 84 -63.935 -11.413 13.287 1.00 21.23 C ATOM 1264 C GLY A 84 -63.969 -9.907 13.120 1.00 34.15 C ATOM 1265 O GLY A 84 -64.798 -9.228 13.725 1.00 1.13 O ATOM 0 H GLY A 84 -62.511 -12.510 12.209 1.00 11.45 H new ATOM 0 HA2 GLY A 84 -64.637 -11.869 12.589 1.00 21.23 H new ATOM 0 HA3 GLY A 84 -64.271 -11.672 14.291 1.00 21.23 H new ATOM 1269 N GLU A 85 -63.065 -9.383 12.298 1.00 71.23 N ATOM 1270 CA GLU A 85 -62.994 -7.947 12.056 1.00 3.24 C ATOM 1271 C GLU A 85 -62.287 -7.652 10.737 1.00 45.31 C ATOM 1272 O GLU A 85 -61.313 -8.315 10.378 1.00 43.43 O ATOM 1273 CB GLU A 85 -62.264 -7.249 13.206 1.00 62.14 C ATOM 1274 CG GLU A 85 -60.975 -7.941 13.617 1.00 3.03 C ATOM 1275 CD GLU A 85 -60.071 -7.047 14.443 1.00 22.13 C ATOM 1276 OE1 GLU A 85 -59.335 -6.233 13.845 1.00 62.10 O ATOM 1277 OE2 GLU A 85 -60.098 -7.159 15.686 1.00 0.10 O1- ATOM 0 H GLU A 85 -62.372 -9.931 11.789 1.00 71.23 H new ATOM 0 HA GLU A 85 -64.013 -7.564 11.996 1.00 3.24 H new ATOM 0 HB2 GLU A 85 -62.039 -6.224 12.913 1.00 62.14 H new ATOM 0 HB3 GLU A 85 -62.929 -7.196 14.068 1.00 62.14 H new ATOM 0 HG2 GLU A 85 -61.215 -8.837 14.189 1.00 3.03 H new ATOM 0 HG3 GLU A 85 -60.441 -8.266 12.724 1.00 3.03 H new ATOM 1284 N LYS A 86 -62.785 -6.652 10.016 1.00 0.31 N ATOM 1285 CA LYS A 86 -62.203 -6.266 8.737 1.00 50.23 C ATOM 1286 C LYS A 86 -60.828 -5.636 8.932 1.00 62.42 C ATOM 1287 O LYS A 86 -60.678 -4.671 9.682 1.00 1.22 O ATOM 1288 CB LYS A 86 -63.125 -5.288 8.007 1.00 52.31 C ATOM 1289 CG LYS A 86 -64.229 -5.968 7.215 1.00 22.44 C ATOM 1290 CD LYS A 86 -65.447 -6.242 8.079 1.00 14.40 C ATOM 1291 CE LYS A 86 -66.391 -5.049 8.107 1.00 71.34 C ATOM 1292 NZ LYS A 86 -67.590 -5.310 8.951 1.00 0.31 N1+ ATOM 0 H LYS A 86 -63.591 -6.094 10.297 1.00 0.31 H new ATOM 0 HA LYS A 86 -62.088 -7.166 8.133 1.00 50.23 H new ATOM 0 HB2 LYS A 86 -63.575 -4.613 8.735 1.00 52.31 H new ATOM 0 HB3 LYS A 86 -62.529 -4.675 7.331 1.00 52.31 H new ATOM 0 HG2 LYS A 86 -64.514 -5.338 6.372 1.00 22.44 H new ATOM 0 HG3 LYS A 86 -63.857 -6.905 6.801 1.00 22.44 H new ATOM 0 HD2 LYS A 86 -65.975 -7.116 7.698 1.00 14.40 H new ATOM 0 HD3 LYS A 86 -65.128 -6.479 9.094 1.00 14.40 H new ATOM 0 HE2 LYS A 86 -65.862 -4.176 8.488 1.00 71.34 H new ATOM 0 HE3 LYS A 86 -66.707 -4.812 7.091 1.00 71.34 H new ATOM 0 HZ1 LYS A 86 -68.208 -4.474 8.944 1.00 0.31 H new ATOM 0 HZ2 LYS A 86 -68.110 -6.128 8.573 1.00 0.31 H new ATOM 0 HZ3 LYS A 86 -67.291 -5.511 9.926 1.00 0.31 H new ATOM 1306 N ALA A 87 -59.827 -6.185 8.252 1.00 21.22 N ATOM 1307 CA ALA A 87 -58.465 -5.673 8.350 1.00 63.11 C ATOM 1308 C ALA A 87 -57.904 -5.341 6.970 1.00 4.23 C ATOM 1309 O ALA A 87 -58.271 -5.965 5.974 1.00 21.02 O ATOM 1310 CB ALA A 87 -57.571 -6.682 9.056 1.00 2.10 C ATOM 0 H ALA A 87 -59.933 -6.984 7.627 1.00 21.22 H new ATOM 0 HA ALA A 87 -58.489 -4.754 8.935 1.00 63.11 H new ATOM 0 HB1 ALA A 87 -56.557 -6.287 9.122 1.00 2.10 H new ATOM 0 HB2 ALA A 87 -57.954 -6.868 10.059 1.00 2.10 H new ATOM 0 HB3 ALA A 87 -57.560 -7.615 8.493 1.00 2.10 H new ATOM 1316 N ARG A 88 -57.014 -4.356 6.921 1.00 51.52 N ATOM 1317 CA ARG A 88 -56.404 -3.940 5.664 1.00 72.01 C ATOM 1318 C ARG A 88 -55.082 -4.666 5.435 1.00 43.43 C ATOM 1319 O ARG A 88 -54.465 -5.164 6.376 1.00 52.35 O ATOM 1320 CB ARG A 88 -56.175 -2.428 5.660 1.00 64.15 C ATOM 1321 CG ARG A 88 -57.387 -1.629 5.210 1.00 10.34 C ATOM 1322 CD ARG A 88 -58.553 -1.798 6.171 1.00 52.23 C ATOM 1323 NE ARG A 88 -58.215 -1.361 7.523 1.00 54.25 N ATOM 1324 CZ ARG A 88 -58.161 -0.087 7.892 1.00 53.44 C ATOM 1325 NH1 ARG A 88 -58.418 0.872 7.014 1.00 14.44 N1+ ATOM 1326 NH2 ARG A 88 -57.846 0.231 9.142 1.00 23.21 N ATOM 0 H ARG A 88 -56.699 -3.831 7.737 1.00 51.52 H new ATOM 0 HA ARG A 88 -57.086 -4.200 4.854 1.00 72.01 H new ATOM 0 HB2 ARG A 88 -55.893 -2.109 6.663 1.00 64.15 H new ATOM 0 HB3 ARG A 88 -55.335 -2.198 5.004 1.00 64.15 H new ATOM 0 HG2 ARG A 88 -57.123 -0.574 5.139 1.00 10.34 H new ATOM 0 HG3 ARG A 88 -57.686 -1.951 4.213 1.00 10.34 H new ATOM 0 HD2 ARG A 88 -59.408 -1.227 5.808 1.00 52.23 H new ATOM 0 HD3 ARG A 88 -58.856 -2.845 6.193 1.00 52.23 H new ATOM 0 HE ARG A 88 -58.009 -2.074 8.222 1.00 54.25 H new ATOM 0 HH11 ARG A 88 -58.658 0.632 6.052 1.00 14.44 H new ATOM 0 HH12 ARG A 88 -58.376 1.850 7.300 1.00 14.44 H new ATOM 0 HH21 ARG A 88 -57.645 -0.504 9.820 1.00 23.21 H new ATOM 0 HH22 ARG A 88 -57.805 1.210 9.424 1.00 23.21 H new ATOM 1340 N GLU A 89 -54.653 -4.723 4.178 1.00 51.11 N ATOM 1341 CA GLU A 89 -53.406 -5.390 3.826 1.00 3.21 C ATOM 1342 C GLU A 89 -52.402 -4.397 3.249 1.00 11.30 C ATOM 1343 O GLU A 89 -52.767 -3.292 2.843 1.00 53.52 O ATOM 1344 CB GLU A 89 -53.667 -6.512 2.818 1.00 74.52 C ATOM 1345 CG GLU A 89 -54.201 -7.786 3.450 1.00 45.43 C ATOM 1346 CD GLU A 89 -53.128 -8.564 4.187 1.00 12.21 C ATOM 1347 OE1 GLU A 89 -52.065 -8.824 3.588 1.00 23.33 O ATOM 1348 OE2 GLU A 89 -53.354 -8.914 5.364 1.00 4.44 O1- ATOM 0 H GLU A 89 -55.151 -4.315 3.387 1.00 51.11 H new ATOM 0 HA GLU A 89 -52.985 -5.819 4.735 1.00 3.21 H new ATOM 0 HB2 GLU A 89 -54.380 -6.160 2.072 1.00 74.52 H new ATOM 0 HB3 GLU A 89 -52.740 -6.739 2.291 1.00 74.52 H new ATOM 0 HG2 GLU A 89 -55.004 -7.535 4.143 1.00 45.43 H new ATOM 0 HG3 GLU A 89 -54.635 -8.418 2.675 1.00 45.43 H new ATOM 1355 N VAL A 90 -51.134 -4.796 3.215 1.00 14.00 N ATOM 1356 CA VAL A 90 -50.077 -3.942 2.688 1.00 43.15 C ATOM 1357 C VAL A 90 -49.153 -4.723 1.759 1.00 34.22 C ATOM 1358 O VAL A 90 -49.024 -5.941 1.875 1.00 14.45 O ATOM 1359 CB VAL A 90 -49.241 -3.319 3.821 1.00 61.31 C ATOM 1360 CG1 VAL A 90 -48.288 -2.271 3.267 1.00 61.42 C ATOM 1361 CG2 VAL A 90 -50.149 -2.718 4.884 1.00 63.51 C ATOM 0 H VAL A 90 -50.814 -5.706 3.547 1.00 14.00 H new ATOM 0 HA VAL A 90 -50.564 -3.145 2.126 1.00 43.15 H new ATOM 0 HB VAL A 90 -48.647 -4.106 4.286 1.00 61.31 H new ATOM 0 HG11 VAL A 90 -47.706 -1.842 4.082 1.00 61.42 H new ATOM 0 HG12 VAL A 90 -47.615 -2.736 2.546 1.00 61.42 H new ATOM 0 HG13 VAL A 90 -48.859 -1.484 2.775 1.00 61.42 H new ATOM 0 HG21 VAL A 90 -49.542 -2.282 5.677 1.00 63.51 H new ATOM 0 HG22 VAL A 90 -50.771 -1.943 4.436 1.00 63.51 H new ATOM 0 HG23 VAL A 90 -50.786 -3.498 5.302 1.00 63.51 H new ATOM 1371 N ARG A 91 -48.512 -4.011 0.838 1.00 25.45 N ATOM 1372 CA ARG A 91 -47.599 -4.636 -0.112 1.00 3.45 C ATOM 1373 C ARG A 91 -46.153 -4.256 0.193 1.00 15.52 C ATOM 1374 O ARG A 91 -45.852 -3.096 0.476 1.00 10.53 O ATOM 1375 CB ARG A 91 -47.956 -4.225 -1.541 1.00 35.24 C ATOM 1376 CG ARG A 91 -47.657 -5.297 -2.576 1.00 1.41 C ATOM 1377 CD ARG A 91 -46.248 -5.161 -3.129 1.00 62.05 C ATOM 1378 NE ARG A 91 -45.888 -6.281 -3.995 1.00 32.31 N ATOM 1379 CZ ARG A 91 -44.739 -6.357 -4.659 1.00 62.40 C ATOM 1380 NH1 ARG A 91 -43.845 -5.383 -4.556 1.00 60.23 N1+ ATOM 1381 NH2 ARG A 91 -44.485 -7.409 -5.427 1.00 63.42 N ATOM 0 H ARG A 91 -48.608 -3.001 0.729 1.00 25.45 H new ATOM 0 HA ARG A 91 -47.700 -5.717 -0.017 1.00 3.45 H new ATOM 0 HB2 ARG A 91 -49.016 -3.976 -1.584 1.00 35.24 H new ATOM 0 HB3 ARG A 91 -47.405 -3.320 -1.798 1.00 35.24 H new ATOM 0 HG2 ARG A 91 -47.779 -6.282 -2.126 1.00 1.41 H new ATOM 0 HG3 ARG A 91 -48.377 -5.228 -3.391 1.00 1.41 H new ATOM 0 HD2 ARG A 91 -46.167 -4.229 -3.689 1.00 62.05 H new ATOM 0 HD3 ARG A 91 -45.539 -5.099 -2.303 1.00 62.05 H new ATOM 0 HE ARG A 91 -46.555 -7.046 -4.096 1.00 32.31 H new ATOM 0 HH11 ARG A 91 -44.038 -4.573 -3.966 1.00 60.23 H new ATOM 0 HH12 ARG A 91 -42.964 -5.443 -5.066 1.00 60.23 H new ATOM 0 HH21 ARG A 91 -45.171 -8.159 -5.508 1.00 63.42 H new ATOM 0 HH22 ARG A 91 -43.603 -7.467 -5.937 1.00 63.42 H new ATOM 1395 N ASP A 92 -45.262 -5.240 0.130 1.00 43.34 N ATOM 1396 CA ASP A 92 -43.848 -5.009 0.399 1.00 22.20 C ATOM 1397 C ASP A 92 -43.154 -4.410 -0.821 1.00 4.24 C ATOM 1398 O ASP A 92 -42.755 -5.129 -1.737 1.00 43.15 O ATOM 1399 CB ASP A 92 -43.162 -6.316 0.801 1.00 42.30 C ATOM 1400 CG ASP A 92 -43.396 -7.425 -0.206 1.00 10.14 C ATOM 1401 OD1 ASP A 92 -44.539 -7.924 -0.285 1.00 24.00 O ATOM 1402 OD2 ASP A 92 -42.436 -7.794 -0.914 1.00 53.42 O1- ATOM 0 H ASP A 92 -45.494 -6.205 -0.105 1.00 43.34 H new ATOM 0 HA ASP A 92 -43.772 -4.300 1.223 1.00 22.20 H new ATOM 0 HB2 ASP A 92 -42.091 -6.144 0.905 1.00 42.30 H new ATOM 0 HB3 ASP A 92 -43.531 -6.631 1.777 1.00 42.30 H new ATOM 1407 N THR A 93 -43.016 -3.088 -0.828 1.00 3.24 N ATOM 1408 CA THR A 93 -42.373 -2.393 -1.936 1.00 15.11 C ATOM 1409 C THR A 93 -41.083 -1.715 -1.486 1.00 15.23 C ATOM 1410 O THR A 93 -40.640 -0.738 -2.091 1.00 31.43 O ATOM 1411 CB THR A 93 -43.307 -1.335 -2.553 1.00 51.14 C ATOM 1412 OG1 THR A 93 -43.409 -0.203 -1.681 1.00 20.55 O ATOM 1413 CG2 THR A 93 -44.691 -1.915 -2.803 1.00 32.22 C ATOM 0 H THR A 93 -43.341 -2.477 -0.079 1.00 3.24 H new ATOM 0 HA THR A 93 -42.141 -3.146 -2.689 1.00 15.11 H new ATOM 0 HB THR A 93 -42.884 -1.021 -3.507 1.00 51.14 H new ATOM 0 HG1 THR A 93 -44.003 0.466 -2.081 1.00 20.55 H new ATOM 0 HG21 THR A 93 -45.333 -1.150 -3.239 1.00 32.22 H new ATOM 0 HG22 THR A 93 -44.614 -2.758 -3.490 1.00 32.22 H new ATOM 0 HG23 THR A 93 -45.119 -2.254 -1.860 1.00 32.22 H new ATOM 1421 N SER A 94 -40.485 -2.239 -0.420 1.00 41.23 N ATOM 1422 CA SER A 94 -39.248 -1.681 0.112 1.00 71.52 C ATOM 1423 C SER A 94 -38.072 -1.987 -0.811 1.00 43.33 C ATOM 1424 O SER A 94 -38.193 -2.779 -1.747 1.00 3.02 O ATOM 1425 CB SER A 94 -38.972 -2.240 1.509 1.00 20.52 C ATOM 1426 OG SER A 94 -39.857 -1.684 2.465 1.00 2.23 O ATOM 0 H SER A 94 -40.837 -3.048 0.091 1.00 41.23 H new ATOM 0 HA SER A 94 -39.365 -0.599 0.177 1.00 71.52 H new ATOM 0 HB2 SER A 94 -39.079 -3.325 1.498 1.00 20.52 H new ATOM 0 HB3 SER A 94 -37.942 -2.024 1.793 1.00 20.52 H new ATOM 0 HG SER A 94 -40.682 -1.398 2.020 1.00 2.23 H new ATOM 1432 N LEU A 95 -36.936 -1.355 -0.541 1.00 11.13 N ATOM 1433 CA LEU A 95 -35.736 -1.559 -1.346 1.00 34.44 C ATOM 1434 C LEU A 95 -35.085 -2.898 -1.023 1.00 62.22 C ATOM 1435 O LEU A 95 -35.167 -3.384 0.105 1.00 61.44 O ATOM 1436 CB LEU A 95 -34.740 -0.422 -1.108 1.00 53.31 C ATOM 1437 CG LEU A 95 -33.313 -0.668 -1.600 1.00 14.14 C ATOM 1438 CD1 LEU A 95 -32.682 0.631 -2.075 1.00 71.33 C ATOM 1439 CD2 LEU A 95 -32.472 -1.301 -0.501 1.00 61.44 C ATOM 0 H LEU A 95 -36.820 -0.697 0.229 1.00 11.13 H new ATOM 0 HA LEU A 95 -36.028 -1.564 -2.396 1.00 34.44 H new ATOM 0 HB2 LEU A 95 -35.121 0.476 -1.594 1.00 53.31 H new ATOM 0 HB3 LEU A 95 -34.704 -0.215 -0.038 1.00 53.31 H new ATOM 0 HG LEU A 95 -33.353 -1.358 -2.443 1.00 14.14 H new ATOM 0 HD11 LEU A 95 -31.667 0.437 -2.421 1.00 71.33 H new ATOM 0 HD12 LEU A 95 -33.272 1.044 -2.893 1.00 71.33 H new ATOM 0 HD13 LEU A 95 -32.654 1.344 -1.251 1.00 71.33 H new ATOM 0 HD21 LEU A 95 -31.460 -1.469 -0.869 1.00 61.44 H new ATOM 0 HD22 LEU A 95 -32.439 -0.635 0.361 1.00 61.44 H new ATOM 0 HD23 LEU A 95 -32.914 -2.253 -0.207 1.00 61.44 H new ATOM 1451 N ARG A 96 -34.435 -3.490 -2.020 1.00 22.20 N ATOM 1452 CA ARG A 96 -33.767 -4.774 -1.842 1.00 2.41 C ATOM 1453 C ARG A 96 -32.277 -4.581 -1.581 1.00 14.45 C ATOM 1454 O ARG A 96 -31.615 -3.792 -2.257 1.00 63.30 O ATOM 1455 CB ARG A 96 -33.970 -5.654 -3.077 1.00 44.25 C ATOM 1456 CG ARG A 96 -33.451 -7.073 -2.905 1.00 63.41 C ATOM 1457 CD ARG A 96 -34.348 -7.888 -1.987 1.00 52.41 C ATOM 1458 NE ARG A 96 -34.165 -9.324 -2.177 1.00 50.34 N ATOM 1459 CZ ARG A 96 -34.995 -10.240 -1.693 1.00 2.41 C ATOM 1460 NH1 ARG A 96 -36.061 -9.872 -0.996 1.00 13.23 N1+ ATOM 1461 NH2 ARG A 96 -34.761 -11.529 -1.907 1.00 2.33 N ATOM 0 H ARG A 96 -34.357 -3.101 -2.960 1.00 22.20 H new ATOM 0 HA ARG A 96 -34.208 -5.267 -0.976 1.00 2.41 H new ATOM 0 HB2 ARG A 96 -35.033 -5.691 -3.316 1.00 44.25 H new ATOM 0 HB3 ARG A 96 -33.468 -5.193 -3.928 1.00 44.25 H new ATOM 0 HG2 ARG A 96 -33.388 -7.559 -3.879 1.00 63.41 H new ATOM 0 HG3 ARG A 96 -32.441 -7.045 -2.497 1.00 63.41 H new ATOM 0 HD2 ARG A 96 -34.136 -7.630 -0.950 1.00 52.41 H new ATOM 0 HD3 ARG A 96 -35.390 -7.628 -2.173 1.00 52.41 H new ATOM 0 HE ARG A 96 -33.355 -9.641 -2.711 1.00 50.34 H new ATOM 0 HH11 ARG A 96 -36.245 -8.883 -0.830 1.00 13.23 H new ATOM 0 HH12 ARG A 96 -36.697 -10.578 -0.625 1.00 13.23 H new ATOM 0 HH21 ARG A 96 -33.943 -11.817 -2.444 1.00 2.33 H new ATOM 0 HH22 ARG A 96 -35.399 -12.232 -1.535 1.00 2.33 H new ATOM 1475 N VAL A 97 -31.754 -5.304 -0.597 1.00 32.32 N ATOM 1476 CA VAL A 97 -30.342 -5.212 -0.246 1.00 32.11 C ATOM 1477 C VAL A 97 -29.677 -6.584 -0.276 1.00 2.42 C ATOM 1478 O VAL A 97 -30.181 -7.558 0.285 1.00 4.01 O ATOM 1479 CB VAL A 97 -30.148 -4.591 1.149 1.00 24.41 C ATOM 1480 CG1 VAL A 97 -28.770 -4.930 1.698 1.00 40.42 C ATOM 1481 CG2 VAL A 97 -30.355 -3.085 1.096 1.00 52.15 C ATOM 0 H VAL A 97 -32.288 -5.961 -0.028 1.00 32.32 H new ATOM 0 HA VAL A 97 -29.874 -4.568 -0.990 1.00 32.11 H new ATOM 0 HB VAL A 97 -30.894 -5.013 1.822 1.00 24.41 H new ATOM 0 HG11 VAL A 97 -28.651 -4.482 2.685 1.00 40.42 H new ATOM 0 HG12 VAL A 97 -28.665 -6.012 1.775 1.00 40.42 H new ATOM 0 HG13 VAL A 97 -28.005 -4.539 1.028 1.00 40.42 H new ATOM 0 HG21 VAL A 97 -30.214 -2.663 2.091 1.00 52.15 H new ATOM 0 HG22 VAL A 97 -29.634 -2.643 0.409 1.00 52.15 H new ATOM 0 HG23 VAL A 97 -31.366 -2.869 0.750 1.00 52.15 H new ATOM 1491 N PRO A 98 -28.519 -6.666 -0.948 1.00 12.13 N ATOM 1492 CA PRO A 98 -27.759 -7.915 -1.066 1.00 3.14 C ATOM 1493 C PRO A 98 -27.136 -8.343 0.257 1.00 31.21 C ATOM 1494 O PRO A 98 -26.984 -7.534 1.174 1.00 54.31 O ATOM 1495 CB PRO A 98 -26.669 -7.571 -2.085 1.00 5.32 C ATOM 1496 CG PRO A 98 -26.500 -6.095 -1.975 1.00 31.15 C ATOM 1497 CD PRO A 98 -27.861 -5.547 -1.641 1.00 23.22 C ATOM 0 HA PRO A 98 -28.392 -8.751 -1.364 1.00 3.14 H new ATOM 0 HB2 PRO A 98 -25.739 -8.094 -1.862 1.00 5.32 H new ATOM 0 HB3 PRO A 98 -26.964 -7.862 -3.093 1.00 5.32 H new ATOM 0 HG2 PRO A 98 -25.776 -5.842 -1.200 1.00 31.15 H new ATOM 0 HG3 PRO A 98 -26.128 -5.674 -2.909 1.00 31.15 H new ATOM 0 HD2 PRO A 98 -27.794 -4.664 -1.005 1.00 23.22 H new ATOM 0 HD3 PRO A 98 -28.407 -5.253 -2.538 1.00 23.22 H new ATOM 1505 N HIS A 99 -26.778 -9.619 0.353 1.00 2.03 N ATOM 1506 CA HIS A 99 -26.170 -10.154 1.565 1.00 40.20 C ATOM 1507 C HIS A 99 -24.799 -9.529 1.808 1.00 23.32 C ATOM 1508 O HIS A 99 -23.987 -9.415 0.891 1.00 3.54 O ATOM 1509 CB HIS A 99 -26.039 -11.674 1.467 1.00 10.22 C ATOM 1510 CG HIS A 99 -25.306 -12.135 0.245 1.00 63.35 C ATOM 1511 ND1 HIS A 99 -23.932 -12.233 0.184 1.00 22.30 N ATOM 1512 CD2 HIS A 99 -25.764 -12.527 -0.966 1.00 12.11 C ATOM 1513 CE1 HIS A 99 -23.577 -12.664 -1.014 1.00 51.45 C ATOM 1514 NE2 HIS A 99 -24.670 -12.851 -1.730 1.00 54.33 N ATOM 0 H HIS A 99 -26.899 -10.302 -0.395 1.00 2.03 H new ATOM 0 HA HIS A 99 -26.817 -9.905 2.406 1.00 40.20 H new ATOM 0 HB2 HIS A 99 -25.521 -12.043 2.352 1.00 10.22 H new ATOM 0 HB3 HIS A 99 -27.035 -12.117 1.472 1.00 10.22 H new ATOM 0 HD2 HIS A 99 -26.798 -12.576 -1.275 1.00 12.11 H new ATOM 0 HE1 HIS A 99 -22.565 -12.834 -1.350 1.00 51.45 H new ATOM 0 HE2 HIS A 99 -24.698 -13.182 -2.694 1.00 54.33 H new ATOM 1522 N GLY A 100 -24.550 -9.123 3.049 1.00 52.11 N ATOM 1523 CA GLY A 100 -23.278 -8.513 3.390 1.00 34.40 C ATOM 1524 C GLY A 100 -23.258 -7.023 3.115 1.00 32.53 C ATOM 1525 O GLY A 100 -22.884 -6.230 3.978 1.00 13.43 O ATOM 0 H GLY A 100 -25.207 -9.206 3.825 1.00 52.11 H new ATOM 0 HA2 GLY A 100 -23.066 -8.688 4.445 1.00 34.40 H new ATOM 0 HA3 GLY A 100 -22.483 -8.995 2.821 1.00 34.40 H new ATOM 1529 N GLY A 101 -23.661 -6.639 1.907 1.00 3.44 N ATOM 1530 CA GLY A 101 -23.679 -5.234 1.542 1.00 63.32 C ATOM 1531 C GLY A 101 -22.351 -4.765 0.981 1.00 13.11 C ATOM 1532 O GLY A 101 -22.311 -3.930 0.078 1.00 41.12 O ATOM 0 H GLY A 101 -23.975 -7.276 1.175 1.00 3.44 H new ATOM 0 HA2 GLY A 101 -24.463 -5.063 0.804 1.00 63.32 H new ATOM 0 HA3 GLY A 101 -23.931 -4.637 2.418 1.00 63.32 H new ATOM 1536 N GLY A 102 -21.260 -5.302 1.518 1.00 35.30 N ATOM 1537 CA GLY A 102 -19.939 -4.919 1.054 1.00 42.33 C ATOM 1538 C GLY A 102 -19.354 -3.771 1.853 1.00 11.11 C ATOM 1539 O GLY A 102 -18.157 -3.749 2.136 1.00 65.03 O ATOM 0 H GLY A 102 -21.267 -5.995 2.266 1.00 35.30 H new ATOM 0 HA2 GLY A 102 -19.272 -5.779 1.117 1.00 42.33 H new ATOM 0 HA3 GLY A 102 -19.995 -4.635 0.003 1.00 42.33 H new ATOM 1543 N GLY A 103 -20.201 -2.813 2.217 1.00 42.51 N ATOM 1544 CA GLY A 103 -19.743 -1.668 2.983 1.00 70.24 C ATOM 1545 C GLY A 103 -20.646 -1.359 4.161 1.00 14.31 C ATOM 1546 O GLY A 103 -21.376 -2.228 4.636 1.00 75.45 O ATOM 0 H GLY A 103 -21.197 -2.809 1.995 1.00 42.51 H new ATOM 0 HA2 GLY A 103 -18.732 -1.857 3.344 1.00 70.24 H new ATOM 0 HA3 GLY A 103 -19.691 -0.796 2.331 1.00 70.24 H new ATOM 1550 N ILE A 104 -20.595 -0.117 4.632 1.00 10.42 N ATOM 1551 CA ILE A 104 -21.416 0.304 5.761 1.00 73.30 C ATOM 1552 C ILE A 104 -22.054 1.663 5.499 1.00 61.32 C ATOM 1553 O ILE A 104 -21.479 2.509 4.814 1.00 74.25 O ATOM 1554 CB ILE A 104 -20.590 0.377 7.059 1.00 31.42 C ATOM 1555 CG1 ILE A 104 -19.864 -0.947 7.304 1.00 73.31 C ATOM 1556 CG2 ILE A 104 -21.488 0.721 8.238 1.00 75.13 C ATOM 1557 CD1 ILE A 104 -18.878 -0.893 8.450 1.00 42.35 C ATOM 0 H ILE A 104 -19.995 0.614 4.250 1.00 10.42 H new ATOM 0 HA ILE A 104 -22.199 -0.444 5.880 1.00 73.30 H new ATOM 0 HB ILE A 104 -19.843 1.164 6.953 1.00 31.42 H new ATOM 0 HG12 ILE A 104 -20.601 -1.724 7.506 1.00 73.31 H new ATOM 0 HG13 ILE A 104 -19.337 -1.236 6.395 1.00 73.31 H new ATOM 0 HG21 ILE A 104 -20.891 0.769 9.148 1.00 75.13 H new ATOM 0 HG22 ILE A 104 -21.963 1.687 8.064 1.00 75.13 H new ATOM 0 HG23 ILE A 104 -22.255 -0.046 8.347 1.00 75.13 H new ATOM 0 HD11 ILE A 104 -18.401 -1.866 8.566 1.00 42.35 H new ATOM 0 HD12 ILE A 104 -18.119 -0.139 8.242 1.00 42.35 H new ATOM 0 HD13 ILE A 104 -19.403 -0.635 9.370 1.00 42.35 H new ATOM 1569 N ILE A 105 -23.245 1.867 6.052 1.00 72.41 N ATOM 1570 CA ILE A 105 -23.960 3.126 5.882 1.00 11.13 C ATOM 1571 C ILE A 105 -23.209 4.279 6.540 1.00 43.31 C ATOM 1572 O ILE A 105 -23.229 4.429 7.762 1.00 71.54 O ATOM 1573 CB ILE A 105 -25.381 3.050 6.470 1.00 21.24 C ATOM 1574 CG1 ILE A 105 -26.119 1.826 5.925 1.00 33.43 C ATOM 1575 CG2 ILE A 105 -26.153 4.324 6.156 1.00 13.51 C ATOM 1576 CD1 ILE A 105 -26.385 1.894 4.437 1.00 11.11 C ATOM 0 H ILE A 105 -23.735 1.177 6.621 1.00 72.41 H new ATOM 0 HA ILE A 105 -24.029 3.307 4.809 1.00 11.13 H new ATOM 0 HB ILE A 105 -25.305 2.951 7.553 1.00 21.24 H new ATOM 0 HG12 ILE A 105 -25.533 0.933 6.141 1.00 33.43 H new ATOM 0 HG13 ILE A 105 -27.068 1.720 6.451 1.00 33.43 H new ATOM 0 HG21 ILE A 105 -27.156 4.255 6.578 1.00 13.51 H new ATOM 0 HG22 ILE A 105 -25.635 5.180 6.589 1.00 13.51 H new ATOM 0 HG23 ILE A 105 -26.222 4.451 5.076 1.00 13.51 H new ATOM 0 HD11 ILE A 105 -26.911 0.993 4.120 1.00 11.11 H new ATOM 0 HD12 ILE A 105 -26.997 2.768 4.216 1.00 11.11 H new ATOM 0 HD13 ILE A 105 -25.439 1.969 3.901 1.00 11.11 H new ATOM 1588 N HIS A 106 -22.549 5.092 5.722 1.00 44.11 N ATOM 1589 CA HIS A 106 -21.793 6.234 6.224 1.00 34.34 C ATOM 1590 C HIS A 106 -22.533 7.539 5.947 1.00 52.02 C ATOM 1591 O HIS A 106 -22.301 8.549 6.612 1.00 2.51 O ATOM 1592 CB HIS A 106 -20.405 6.275 5.585 1.00 22.33 C ATOM 1593 CG HIS A 106 -19.461 7.218 6.264 1.00 1.11 C ATOM 1594 ND1 HIS A 106 -18.753 6.888 7.401 1.00 2.12 N ATOM 1595 CD2 HIS A 106 -19.109 8.489 5.959 1.00 44.21 C ATOM 1596 CE1 HIS A 106 -18.007 7.915 7.766 1.00 70.15 C ATOM 1597 NE2 HIS A 106 -18.204 8.900 6.908 1.00 4.01 N ATOM 0 H HIS A 106 -22.522 4.981 4.708 1.00 44.11 H new ATOM 0 HA HIS A 106 -21.684 6.120 7.303 1.00 34.34 H new ATOM 0 HB2 HIS A 106 -19.977 5.272 5.600 1.00 22.33 H new ATOM 0 HB3 HIS A 106 -20.504 6.564 4.539 1.00 22.33 H new ATOM 0 HD2 HIS A 106 -19.472 9.072 5.125 1.00 44.21 H new ATOM 0 HE1 HIS A 106 -17.348 7.945 8.621 1.00 70.15 H new ATOM 0 HE2 HIS A 106 -17.757 9.816 6.944 1.00 4.01 H new ATOM 1605 N ASP A 107 -23.422 7.512 4.960 1.00 2.53 N ATOM 1606 CA ASP A 107 -24.197 8.692 4.596 1.00 2.33 C ATOM 1607 C ASP A 107 -25.497 8.297 3.903 1.00 53.53 C ATOM 1608 O ASP A 107 -25.600 7.217 3.321 1.00 42.21 O ATOM 1609 CB ASP A 107 -23.375 9.605 3.683 1.00 13.01 C ATOM 1610 CG ASP A 107 -23.633 11.075 3.950 1.00 51.05 C ATOM 1611 OD1 ASP A 107 -23.229 11.562 5.026 1.00 40.31 O ATOM 1612 OD2 ASP A 107 -24.238 11.737 3.082 1.00 71.12 O1- ATOM 0 H ASP A 107 -23.624 6.685 4.398 1.00 2.53 H new ATOM 0 HA ASP A 107 -24.444 9.231 5.511 1.00 2.33 H new ATOM 0 HB2 ASP A 107 -22.315 9.394 3.822 1.00 13.01 H new ATOM 0 HB3 ASP A 107 -23.610 9.381 2.643 1.00 13.01 H new ATOM 1617 N VAL A 108 -26.489 9.179 3.970 1.00 40.23 N ATOM 1618 CA VAL A 108 -27.783 8.923 3.350 1.00 11.03 C ATOM 1619 C VAL A 108 -28.453 10.223 2.920 1.00 62.13 C ATOM 1620 O VAL A 108 -28.655 11.129 3.729 1.00 23.34 O ATOM 1621 CB VAL A 108 -28.724 8.165 4.305 1.00 20.20 C ATOM 1622 CG1 VAL A 108 -30.088 7.965 3.664 1.00 12.41 C ATOM 1623 CG2 VAL A 108 -28.113 6.831 4.706 1.00 33.40 C ATOM 0 H VAL A 108 -26.421 10.078 4.448 1.00 40.23 H new ATOM 0 HA VAL A 108 -27.596 8.306 2.471 1.00 11.03 H new ATOM 0 HB VAL A 108 -28.858 8.763 5.206 1.00 20.20 H new ATOM 0 HG11 VAL A 108 -30.739 7.428 4.354 1.00 12.41 H new ATOM 0 HG12 VAL A 108 -30.527 8.935 3.432 1.00 12.41 H new ATOM 0 HG13 VAL A 108 -29.977 7.388 2.746 1.00 12.41 H new ATOM 0 HG21 VAL A 108 -28.791 6.308 5.381 1.00 33.40 H new ATOM 0 HG22 VAL A 108 -27.948 6.224 3.816 1.00 33.40 H new ATOM 0 HG23 VAL A 108 -27.162 7.003 5.209 1.00 33.40 H new ATOM 1633 N LYS A 109 -28.798 10.310 1.639 1.00 73.05 N ATOM 1634 CA LYS A 109 -29.449 11.498 1.100 1.00 64.22 C ATOM 1635 C LYS A 109 -30.948 11.270 0.935 1.00 55.52 C ATOM 1636 O LYS A 109 -31.375 10.259 0.379 1.00 53.24 O ATOM 1637 CB LYS A 109 -28.829 11.877 -0.248 1.00 5.12 C ATOM 1638 CG LYS A 109 -27.639 12.812 -0.128 1.00 4.01 C ATOM 1639 CD LYS A 109 -28.051 14.265 -0.296 1.00 43.23 C ATOM 1640 CE LYS A 109 -26.940 15.213 0.127 1.00 25.43 C ATOM 1641 NZ LYS A 109 -25.924 15.391 -0.948 1.00 11.23 N1+ ATOM 0 H LYS A 109 -28.637 9.571 0.955 1.00 73.05 H new ATOM 0 HA LYS A 109 -29.299 12.315 1.805 1.00 64.22 H new ATOM 0 HB2 LYS A 109 -28.516 10.969 -0.763 1.00 5.12 H new ATOM 0 HB3 LYS A 109 -29.590 12.349 -0.869 1.00 5.12 H new ATOM 0 HG2 LYS A 109 -27.166 12.677 0.845 1.00 4.01 H new ATOM 0 HG3 LYS A 109 -26.895 12.554 -0.882 1.00 4.01 H new ATOM 0 HD2 LYS A 109 -28.313 14.452 -1.337 1.00 43.23 H new ATOM 0 HD3 LYS A 109 -28.944 14.462 0.297 1.00 43.23 H new ATOM 0 HE2 LYS A 109 -27.368 16.181 0.386 1.00 25.43 H new ATOM 0 HE3 LYS A 109 -26.456 14.828 1.024 1.00 25.43 H new ATOM 0 HZ1 LYS A 109 -25.184 16.044 -0.621 1.00 11.23 H new ATOM 0 HZ2 LYS A 109 -25.497 14.471 -1.178 1.00 11.23 H new ATOM 0 HZ3 LYS A 109 -26.381 15.783 -1.796 1.00 11.23 H new ATOM 1655 N VAL A 110 -31.742 12.219 1.421 1.00 33.40 N ATOM 1656 CA VAL A 110 -33.195 12.123 1.325 1.00 62.24 C ATOM 1657 C VAL A 110 -33.807 13.454 0.902 1.00 62.33 C ATOM 1658 O VAL A 110 -33.600 14.479 1.552 1.00 72.31 O ATOM 1659 CB VAL A 110 -33.818 11.686 2.664 1.00 4.52 C ATOM 1660 CG1 VAL A 110 -33.399 12.631 3.781 1.00 44.34 C ATOM 1661 CG2 VAL A 110 -35.333 11.621 2.550 1.00 54.34 C ATOM 0 H VAL A 110 -31.405 13.062 1.885 1.00 33.40 H new ATOM 0 HA VAL A 110 -33.413 11.370 0.568 1.00 62.24 H new ATOM 0 HB VAL A 110 -33.452 10.689 2.908 1.00 4.52 H new ATOM 0 HG11 VAL A 110 -33.849 12.307 4.720 1.00 44.34 H new ATOM 0 HG12 VAL A 110 -32.313 12.623 3.877 1.00 44.34 H new ATOM 0 HG13 VAL A 110 -33.735 13.641 3.548 1.00 44.34 H new ATOM 0 HG21 VAL A 110 -35.757 11.311 3.505 1.00 54.34 H new ATOM 0 HG22 VAL A 110 -35.720 12.604 2.284 1.00 54.34 H new ATOM 0 HG23 VAL A 110 -35.609 10.901 1.779 1.00 54.34 H new ATOM 1671 N PHE A 111 -34.561 13.431 -0.192 1.00 31.14 N ATOM 1672 CA PHE A 111 -35.204 14.636 -0.702 1.00 61.30 C ATOM 1673 C PHE A 111 -36.714 14.581 -0.486 1.00 14.04 C ATOM 1674 O PHE A 111 -37.333 13.527 -0.625 1.00 54.20 O ATOM 1675 CB PHE A 111 -34.896 14.812 -2.191 1.00 25.34 C ATOM 1676 CG PHE A 111 -33.450 14.590 -2.534 1.00 21.54 C ATOM 1677 CD1 PHE A 111 -32.455 15.311 -1.895 1.00 61.01 C ATOM 1678 CD2 PHE A 111 -33.088 13.661 -3.496 1.00 34.24 C ATOM 1679 CE1 PHE A 111 -31.124 15.110 -2.210 1.00 62.23 C ATOM 1680 CE2 PHE A 111 -31.759 13.455 -3.815 1.00 44.30 C ATOM 1681 CZ PHE A 111 -30.775 14.180 -3.170 1.00 45.00 C ATOM 0 H PHE A 111 -34.742 12.591 -0.742 1.00 31.14 H new ATOM 0 HA PHE A 111 -34.808 15.490 -0.152 1.00 61.30 H new ATOM 0 HB2 PHE A 111 -35.508 14.117 -2.765 1.00 25.34 H new ATOM 0 HB3 PHE A 111 -35.184 15.818 -2.497 1.00 25.34 H new ATOM 0 HD1 PHE A 111 -32.722 16.038 -1.142 1.00 61.01 H new ATOM 0 HD2 PHE A 111 -33.853 13.091 -4.002 1.00 34.24 H new ATOM 0 HE1 PHE A 111 -30.357 15.680 -1.706 1.00 62.23 H new ATOM 0 HE2 PHE A 111 -31.490 12.728 -4.567 1.00 44.30 H new ATOM 0 HZ PHE A 111 -29.736 14.020 -3.416 1.00 45.00 H new ATOM 1691 N ASN A 112 -37.298 15.724 -0.146 1.00 50.25 N ATOM 1692 CA ASN A 112 -38.735 15.807 0.092 1.00 72.43 C ATOM 1693 C ASN A 112 -39.341 16.994 -0.651 1.00 13.34 C ATOM 1694 O ASN A 112 -38.685 18.016 -0.849 1.00 60.11 O ATOM 1695 CB ASN A 112 -39.020 15.928 1.590 1.00 64.11 C ATOM 1696 CG ASN A 112 -38.136 16.957 2.265 1.00 42.02 C ATOM 1697 OD1 ASN A 112 -37.559 17.824 1.608 1.00 74.51 O ATOM 1698 ND2 ASN A 112 -38.024 16.866 3.586 1.00 45.40 N ATOM 0 H ASN A 112 -36.799 16.606 -0.029 1.00 50.25 H new ATOM 0 HA ASN A 112 -39.194 14.893 -0.284 1.00 72.43 H new ATOM 0 HB2 ASN A 112 -40.066 16.199 1.737 1.00 64.11 H new ATOM 0 HB3 ASN A 112 -38.872 14.958 2.065 1.00 64.11 H new ATOM 0 HD21 ASN A 112 -37.442 17.531 4.095 1.00 45.40 H new ATOM 0 HD22 ASN A 112 -38.520 16.131 4.090 1.00 45.40 H new ATOM 1705 N ARG A 113 -40.598 16.852 -1.057 1.00 20.34 N ATOM 1706 CA ARG A 113 -41.294 17.912 -1.778 1.00 53.42 C ATOM 1707 C ARG A 113 -41.496 19.133 -0.885 1.00 54.43 C ATOM 1708 O ARG A 113 -41.653 20.250 -1.374 1.00 33.44 O ATOM 1709 CB ARG A 113 -42.645 17.409 -2.288 1.00 52.52 C ATOM 1710 CG ARG A 113 -43.573 16.931 -1.183 1.00 1.01 C ATOM 1711 CD ARG A 113 -44.918 16.488 -1.739 1.00 10.22 C ATOM 1712 NE ARG A 113 -45.490 17.481 -2.645 1.00 43.12 N ATOM 1713 CZ ARG A 113 -46.101 18.587 -2.233 1.00 21.52 C ATOM 1714 NH1 ARG A 113 -46.219 18.838 -0.937 1.00 31.21 N1+ ATOM 1715 NH2 ARG A 113 -46.594 19.442 -3.119 1.00 54.41 N ATOM 0 H ARG A 113 -41.156 16.013 -0.899 1.00 20.34 H new ATOM 0 HA ARG A 113 -40.679 18.204 -2.629 1.00 53.42 H new ATOM 0 HB2 ARG A 113 -43.136 18.209 -2.842 1.00 52.52 H new ATOM 0 HB3 ARG A 113 -42.478 16.592 -2.989 1.00 52.52 H new ATOM 0 HG2 ARG A 113 -43.108 16.103 -0.649 1.00 1.01 H new ATOM 0 HG3 ARG A 113 -43.723 17.733 -0.460 1.00 1.01 H new ATOM 0 HD2 ARG A 113 -44.798 15.542 -2.267 1.00 10.22 H new ATOM 0 HD3 ARG A 113 -45.609 16.308 -0.916 1.00 10.22 H new ATOM 0 HE ARG A 113 -45.416 17.316 -3.649 1.00 43.12 H new ATOM 0 HH11 ARG A 113 -45.841 18.182 -0.254 1.00 31.21 H new ATOM 0 HH12 ARG A 113 -46.688 19.687 -0.623 1.00 31.21 H new ATOM 0 HH21 ARG A 113 -46.504 19.251 -4.117 1.00 54.41 H new ATOM 0 HH22 ARG A 113 -47.063 20.291 -2.802 1.00 54.41 H new ATOM 1729 N GLU A 114 -41.493 18.909 0.425 1.00 1.14 N ATOM 1730 CA GLU A 114 -41.678 19.991 1.385 1.00 4.11 C ATOM 1731 C GLU A 114 -40.534 20.995 1.300 1.00 41.23 C ATOM 1732 O GLU A 114 -40.714 22.183 1.571 1.00 33.03 O ATOM 1733 CB GLU A 114 -41.777 19.431 2.806 1.00 54.33 C ATOM 1734 CG GLU A 114 -42.902 18.427 2.988 1.00 44.41 C ATOM 1735 CD GLU A 114 -43.385 18.347 4.423 1.00 52.21 C ATOM 1736 OE1 GLU A 114 -42.567 18.012 5.306 1.00 71.42 O ATOM 1737 OE2 GLU A 114 -44.580 18.619 4.664 1.00 73.01 O1- ATOM 0 H GLU A 114 -41.365 17.989 0.846 1.00 1.14 H new ATOM 0 HA GLU A 114 -42.607 20.505 1.140 1.00 4.11 H new ATOM 0 HB2 GLU A 114 -40.831 18.955 3.067 1.00 54.33 H new ATOM 0 HB3 GLU A 114 -41.922 20.256 3.503 1.00 54.33 H new ATOM 0 HG2 GLU A 114 -43.736 18.701 2.342 1.00 44.41 H new ATOM 0 HG3 GLU A 114 -42.561 17.443 2.668 1.00 44.41 H new ATOM 1744 N ASP A 115 -39.356 20.510 0.922 1.00 61.31 N ATOM 1745 CA ASP A 115 -38.180 21.365 0.800 1.00 32.24 C ATOM 1746 C ASP A 115 -38.273 22.243 -0.443 1.00 43.43 C ATOM 1747 O ASP A 115 -37.632 23.290 -0.526 1.00 43.12 O ATOM 1748 CB ASP A 115 -36.909 20.515 0.745 1.00 53.53 C ATOM 1749 CG ASP A 115 -35.674 21.341 0.443 1.00 13.43 C ATOM 1750 OD1 ASP A 115 -35.123 21.950 1.383 1.00 74.43 O ATOM 1751 OD2 ASP A 115 -35.258 21.376 -0.734 1.00 32.32 O1- ATOM 0 H ASP A 115 -39.190 19.530 0.695 1.00 61.31 H new ATOM 0 HA ASP A 115 -38.139 22.011 1.677 1.00 32.24 H new ATOM 0 HB2 ASP A 115 -36.776 20.003 1.698 1.00 53.53 H new ATOM 0 HB3 ASP A 115 -37.023 19.745 -0.018 1.00 53.53 H new ATOM 1756 N GLY A 116 -39.078 21.811 -1.409 1.00 54.51 N ATOM 1757 CA GLY A 116 -39.240 22.569 -2.635 1.00 23.20 C ATOM 1758 C GLY A 116 -38.568 21.906 -3.821 1.00 2.22 C ATOM 1759 O GLY A 116 -38.307 22.551 -4.836 1.00 55.14 O ATOM 0 H GLY A 116 -39.621 20.949 -1.364 1.00 54.51 H new ATOM 0 HA2 GLY A 116 -40.303 22.691 -2.845 1.00 23.20 H new ATOM 0 HA3 GLY A 116 -38.825 23.568 -2.498 1.00 23.20 H new ATOM 1763 N ASP A 117 -38.284 20.614 -3.692 1.00 71.14 N ATOM 1764 CA ASP A 117 -37.637 19.862 -4.761 1.00 22.33 C ATOM 1765 C ASP A 117 -38.673 19.205 -5.666 1.00 23.13 C ATOM 1766 O ASP A 117 -39.508 18.427 -5.206 1.00 55.15 O ATOM 1767 CB ASP A 117 -36.705 18.801 -4.174 1.00 15.40 C ATOM 1768 CG ASP A 117 -36.348 17.725 -5.181 1.00 11.35 C ATOM 1769 OD1 ASP A 117 -37.173 16.809 -5.388 1.00 73.13 O ATOM 1770 OD2 ASP A 117 -35.245 17.798 -5.761 1.00 42.23 O1- ATOM 0 H ASP A 117 -38.492 20.066 -2.857 1.00 71.14 H new ATOM 0 HA ASP A 117 -37.049 20.558 -5.359 1.00 22.33 H new ATOM 0 HB2 ASP A 117 -35.792 19.279 -3.818 1.00 15.40 H new ATOM 0 HB3 ASP A 117 -37.182 18.341 -3.308 1.00 15.40 H new ATOM 1775 N GLU A 118 -38.612 19.523 -6.956 1.00 12.24 N ATOM 1776 CA GLU A 118 -39.547 18.963 -7.924 1.00 23.12 C ATOM 1777 C GLU A 118 -39.256 17.486 -8.171 1.00 62.43 C ATOM 1778 O GLU A 118 -38.101 17.056 -8.146 1.00 43.24 O ATOM 1779 CB GLU A 118 -39.472 19.736 -9.243 1.00 34.24 C ATOM 1780 CG GLU A 118 -40.578 19.377 -10.222 1.00 62.21 C ATOM 1781 CD GLU A 118 -40.450 20.113 -11.542 1.00 42.54 C ATOM 1782 OE1 GLU A 118 -39.494 20.902 -11.691 1.00 52.30 O ATOM 1783 OE2 GLU A 118 -41.307 19.899 -12.426 1.00 0.43 O1- ATOM 0 H GLU A 118 -37.926 20.164 -7.354 1.00 12.24 H new ATOM 0 HA GLU A 118 -40.553 19.053 -7.514 1.00 23.12 H new ATOM 0 HB2 GLU A 118 -39.518 20.804 -9.032 1.00 34.24 H new ATOM 0 HB3 GLU A 118 -38.507 19.545 -9.712 1.00 34.24 H new ATOM 0 HG2 GLU A 118 -40.561 18.303 -10.406 1.00 62.21 H new ATOM 0 HG3 GLU A 118 -41.544 19.608 -9.774 1.00 62.21 H new ATOM 1790 N LEU A 119 -40.309 16.712 -8.408 1.00 53.45 N ATOM 1791 CA LEU A 119 -40.168 15.283 -8.659 1.00 44.14 C ATOM 1792 C LEU A 119 -40.926 14.872 -9.917 1.00 13.41 C ATOM 1793 O LEU A 119 -41.852 15.551 -10.362 1.00 3.34 O ATOM 1794 CB LEU A 119 -40.677 14.482 -7.459 1.00 54.15 C ATOM 1795 CG LEU A 119 -39.718 14.367 -6.273 1.00 4.14 C ATOM 1796 CD1 LEU A 119 -40.493 14.265 -4.968 1.00 75.22 C ATOM 1797 CD2 LEU A 119 -38.800 13.165 -6.445 1.00 64.10 C ATOM 0 H LEU A 119 -41.271 17.051 -8.432 1.00 53.45 H new ATOM 0 HA LEU A 119 -39.110 15.069 -8.809 1.00 44.14 H new ATOM 0 HB2 LEU A 119 -41.603 14.939 -7.109 1.00 54.15 H new ATOM 0 HB3 LEU A 119 -40.926 13.476 -7.798 1.00 54.15 H new ATOM 0 HG LEU A 119 -39.104 15.267 -6.238 1.00 4.14 H new ATOM 0 HD11 LEU A 119 -39.794 14.184 -4.135 1.00 75.22 H new ATOM 0 HD12 LEU A 119 -41.109 15.155 -4.840 1.00 75.22 H new ATOM 0 HD13 LEU A 119 -41.132 13.382 -4.992 1.00 75.22 H new ATOM 0 HD21 LEU A 119 -38.124 13.098 -5.592 1.00 64.10 H new ATOM 0 HD22 LEU A 119 -39.398 12.256 -6.506 1.00 64.10 H new ATOM 0 HD23 LEU A 119 -38.219 13.279 -7.360 1.00 64.10 H new ATOM 1809 N PRO A 120 -40.528 13.734 -10.504 1.00 20.10 N ATOM 1810 CA PRO A 120 -41.159 13.206 -11.717 1.00 0.40 C ATOM 1811 C PRO A 120 -42.572 12.694 -11.460 1.00 11.03 C ATOM 1812 O PRO A 120 -43.004 12.539 -10.318 1.00 42.43 O ATOM 1813 CB PRO A 120 -40.237 12.053 -12.123 1.00 45.01 C ATOM 1814 CG PRO A 120 -39.582 11.627 -10.856 1.00 75.10 C ATOM 1815 CD PRO A 120 -39.431 12.875 -10.028 1.00 64.30 C ATOM 0 HA PRO A 120 -41.270 13.971 -12.485 1.00 0.40 H new ATOM 0 HB2 PRO A 120 -40.800 11.235 -12.572 1.00 45.01 H new ATOM 0 HB3 PRO A 120 -39.501 12.375 -12.860 1.00 45.01 H new ATOM 0 HG2 PRO A 120 -40.186 10.884 -10.335 1.00 75.10 H new ATOM 0 HG3 PRO A 120 -38.612 11.169 -11.053 1.00 75.10 H new ATOM 0 HD2 PRO A 120 -39.519 12.664 -8.962 1.00 64.30 H new ATOM 0 HD3 PRO A 120 -38.459 13.343 -10.180 1.00 64.30 H new ATOM 1823 N PRO A 121 -43.310 12.423 -12.547 1.00 13.45 N ATOM 1824 CA PRO A 121 -44.686 11.923 -12.464 1.00 63.41 C ATOM 1825 C PRO A 121 -44.752 10.492 -11.942 1.00 74.12 C ATOM 1826 O PRO A 121 -44.127 9.589 -12.496 1.00 70.11 O ATOM 1827 CB PRO A 121 -45.174 11.986 -13.913 1.00 51.31 C ATOM 1828 CG PRO A 121 -43.935 11.896 -14.735 1.00 10.41 C ATOM 1829 CD PRO A 121 -42.860 12.584 -13.940 1.00 53.13 C ATOM 0 HA PRO A 121 -45.291 12.507 -11.770 1.00 63.41 H new ATOM 0 HB2 PRO A 121 -45.857 11.167 -14.136 1.00 51.31 H new ATOM 0 HB3 PRO A 121 -45.713 12.913 -14.109 1.00 51.31 H new ATOM 0 HG2 PRO A 121 -43.671 10.857 -14.931 1.00 10.41 H new ATOM 0 HG3 PRO A 121 -44.073 12.377 -15.703 1.00 10.41 H new ATOM 0 HD2 PRO A 121 -41.884 12.126 -14.103 1.00 53.13 H new ATOM 0 HD3 PRO A 121 -42.768 13.635 -14.214 1.00 53.13 H new ATOM 1837 N GLY A 122 -45.514 10.292 -10.870 1.00 43.21 N ATOM 1838 CA GLY A 122 -45.648 8.968 -10.292 1.00 45.50 C ATOM 1839 C GLY A 122 -44.844 8.809 -9.017 1.00 61.31 C ATOM 1840 O GLY A 122 -45.042 7.854 -8.265 1.00 64.21 O ATOM 0 H GLY A 122 -46.040 11.023 -10.392 1.00 43.21 H new ATOM 0 HA2 GLY A 122 -46.699 8.771 -10.082 1.00 45.50 H new ATOM 0 HA3 GLY A 122 -45.323 8.223 -11.018 1.00 45.50 H new ATOM 1844 N VAL A 123 -43.934 9.747 -8.772 1.00 20.12 N ATOM 1845 CA VAL A 123 -43.096 9.705 -7.579 1.00 30.11 C ATOM 1846 C VAL A 123 -43.554 10.735 -6.551 1.00 42.43 C ATOM 1847 O VAL A 123 -43.998 11.826 -6.906 1.00 35.02 O ATOM 1848 CB VAL A 123 -41.617 9.961 -7.922 1.00 72.33 C ATOM 1849 CG1 VAL A 123 -40.767 9.956 -6.661 1.00 14.23 C ATOM 1850 CG2 VAL A 123 -41.115 8.927 -8.917 1.00 34.10 C ATOM 0 H VAL A 123 -43.758 10.544 -9.383 1.00 20.12 H new ATOM 0 HA VAL A 123 -43.195 8.705 -7.157 1.00 30.11 H new ATOM 0 HB VAL A 123 -41.534 10.945 -8.383 1.00 72.33 H new ATOM 0 HG11 VAL A 123 -39.725 10.139 -6.924 1.00 14.23 H new ATOM 0 HG12 VAL A 123 -41.113 10.738 -5.986 1.00 14.23 H new ATOM 0 HG13 VAL A 123 -40.853 8.987 -6.168 1.00 14.23 H new ATOM 0 HG21 VAL A 123 -40.068 9.123 -9.148 1.00 34.10 H new ATOM 0 HG22 VAL A 123 -41.211 7.931 -8.486 1.00 34.10 H new ATOM 0 HG23 VAL A 123 -41.706 8.985 -9.831 1.00 34.10 H new ATOM 1860 N ASN A 124 -43.441 10.380 -5.276 1.00 33.12 N ATOM 1861 CA ASN A 124 -43.844 11.274 -4.195 1.00 53.53 C ATOM 1862 C ASN A 124 -42.644 11.664 -3.337 1.00 53.12 C ATOM 1863 O ASN A 124 -42.649 12.707 -2.684 1.00 73.13 O ATOM 1864 CB ASN A 124 -44.912 10.608 -3.325 1.00 43.21 C ATOM 1865 CG ASN A 124 -46.171 10.281 -4.105 1.00 42.43 C ATOM 1866 OD1 ASN A 124 -46.487 10.936 -5.099 1.00 73.31 O ATOM 1867 ND2 ASN A 124 -46.896 9.263 -3.658 1.00 3.04 N ATOM 0 H ASN A 124 -43.074 9.480 -4.965 1.00 33.12 H new ATOM 0 HA ASN A 124 -44.260 12.178 -4.640 1.00 53.53 H new ATOM 0 HB2 ASN A 124 -44.507 9.693 -2.894 1.00 43.21 H new ATOM 0 HB3 ASN A 124 -45.163 11.267 -2.494 1.00 43.21 H new ATOM 0 HD21 ASN A 124 -47.753 8.996 -4.142 1.00 3.04 H new ATOM 0 HD22 ASN A 124 -46.596 8.748 -2.830 1.00 3.04 H new ATOM 1874 N GLN A 125 -41.619 10.818 -3.344 1.00 42.31 N ATOM 1875 CA GLN A 125 -40.412 11.075 -2.566 1.00 61.22 C ATOM 1876 C GLN A 125 -39.189 10.463 -3.241 1.00 32.52 C ATOM 1877 O GLN A 125 -39.314 9.658 -4.165 1.00 3.53 O ATOM 1878 CB GLN A 125 -40.563 10.514 -1.151 1.00 74.32 C ATOM 1879 CG GLN A 125 -41.528 11.305 -0.282 1.00 12.52 C ATOM 1880 CD GLN A 125 -42.962 10.834 -0.427 1.00 12.21 C ATOM 1881 OE1 GLN A 125 -43.869 11.633 -0.664 1.00 35.21 O ATOM 1882 NE2 GLN A 125 -43.175 9.532 -0.281 1.00 13.11 N ATOM 0 H GLN A 125 -41.600 9.950 -3.879 1.00 42.31 H new ATOM 0 HA GLN A 125 -40.270 12.154 -2.508 1.00 61.22 H new ATOM 0 HB2 GLN A 125 -40.906 9.481 -1.213 1.00 74.32 H new ATOM 0 HB3 GLN A 125 -39.585 10.496 -0.670 1.00 74.32 H new ATOM 0 HG2 GLN A 125 -41.225 11.220 0.762 1.00 12.52 H new ATOM 0 HG3 GLN A 125 -41.468 12.361 -0.546 1.00 12.52 H new ATOM 0 HE21 GLN A 125 -42.394 8.906 -0.085 1.00 13.11 H new ATOM 0 HE22 GLN A 125 -44.120 9.157 -0.365 1.00 13.11 H new ATOM 1891 N LEU A 126 -38.006 10.849 -2.773 1.00 13.13 N ATOM 1892 CA LEU A 126 -36.760 10.338 -3.332 1.00 42.24 C ATOM 1893 C LEU A 126 -35.684 10.232 -2.255 1.00 22.01 C ATOM 1894 O LEU A 126 -35.425 11.189 -1.525 1.00 4.43 O ATOM 1895 CB LEU A 126 -36.276 11.245 -4.464 1.00 14.10 C ATOM 1896 CG LEU A 126 -35.237 10.642 -5.410 1.00 62.41 C ATOM 1897 CD1 LEU A 126 -33.895 10.500 -4.709 1.00 34.22 C ATOM 1898 CD2 LEU A 126 -35.711 9.294 -5.934 1.00 54.24 C ATOM 0 H LEU A 126 -37.884 11.513 -2.009 1.00 13.13 H new ATOM 0 HA LEU A 126 -36.951 9.341 -3.730 1.00 42.24 H new ATOM 0 HB2 LEU A 126 -37.141 11.550 -5.053 1.00 14.10 H new ATOM 0 HB3 LEU A 126 -35.856 12.149 -4.024 1.00 14.10 H new ATOM 0 HG LEU A 126 -35.112 11.316 -6.258 1.00 62.41 H new ATOM 0 HD11 LEU A 126 -33.168 10.069 -5.398 1.00 34.22 H new ATOM 0 HD12 LEU A 126 -33.549 11.481 -4.383 1.00 34.22 H new ATOM 0 HD13 LEU A 126 -34.004 9.848 -3.843 1.00 34.22 H new ATOM 0 HD21 LEU A 126 -34.959 8.880 -6.606 1.00 54.24 H new ATOM 0 HD22 LEU A 126 -35.865 8.612 -5.098 1.00 54.24 H new ATOM 0 HD23 LEU A 126 -36.649 9.423 -6.475 1.00 54.24 H new ATOM 1910 N VAL A 127 -35.058 9.064 -2.164 1.00 20.53 N ATOM 1911 CA VAL A 127 -34.008 8.833 -1.179 1.00 45.13 C ATOM 1912 C VAL A 127 -32.952 7.873 -1.716 1.00 1.10 C ATOM 1913 O VAL A 127 -33.268 6.930 -2.441 1.00 14.25 O ATOM 1914 CB VAL A 127 -34.582 8.266 0.132 1.00 20.41 C ATOM 1915 CG1 VAL A 127 -35.395 7.010 -0.140 1.00 10.03 C ATOM 1916 CG2 VAL A 127 -33.466 7.984 1.125 1.00 54.52 C ATOM 0 H VAL A 127 -35.260 8.262 -2.761 1.00 20.53 H new ATOM 0 HA VAL A 127 -33.547 9.800 -0.976 1.00 45.13 H new ATOM 0 HB VAL A 127 -35.246 9.012 0.570 1.00 20.41 H new ATOM 0 HG11 VAL A 127 -35.793 6.624 0.798 1.00 10.03 H new ATOM 0 HG12 VAL A 127 -36.219 7.249 -0.812 1.00 10.03 H new ATOM 0 HG13 VAL A 127 -34.757 6.256 -0.601 1.00 10.03 H new ATOM 0 HG21 VAL A 127 -33.891 7.584 2.046 1.00 54.52 H new ATOM 0 HG22 VAL A 127 -32.774 7.257 0.698 1.00 54.52 H new ATOM 0 HG23 VAL A 127 -32.932 8.908 1.344 1.00 54.52 H new ATOM 1926 N ARG A 128 -31.697 8.120 -1.354 1.00 4.20 N ATOM 1927 CA ARG A 128 -30.594 7.277 -1.799 1.00 61.44 C ATOM 1928 C ARG A 128 -29.675 6.923 -0.634 1.00 20.05 C ATOM 1929 O ARG A 128 -29.581 7.666 0.345 1.00 44.24 O ATOM 1930 CB ARG A 128 -29.796 7.984 -2.897 1.00 53.24 C ATOM 1931 CG ARG A 128 -30.644 8.423 -4.079 1.00 2.30 C ATOM 1932 CD ARG A 128 -29.991 9.569 -4.837 1.00 44.25 C ATOM 1933 NE ARG A 128 -29.143 9.091 -5.926 1.00 42.20 N ATOM 1934 CZ ARG A 128 -29.612 8.706 -7.107 1.00 12.20 C ATOM 1935 NH1 ARG A 128 -30.914 8.742 -7.351 1.00 23.30 N1+ ATOM 1936 NH2 ARG A 128 -28.777 8.285 -8.048 1.00 64.11 N ATOM 0 H ARG A 128 -31.419 8.897 -0.754 1.00 4.20 H new ATOM 0 HA ARG A 128 -31.013 6.354 -2.200 1.00 61.44 H new ATOM 0 HB2 ARG A 128 -29.302 8.857 -2.471 1.00 53.24 H new ATOM 0 HB3 ARG A 128 -29.011 7.316 -3.252 1.00 53.24 H new ATOM 0 HG2 ARG A 128 -30.796 7.580 -4.752 1.00 2.30 H new ATOM 0 HG3 ARG A 128 -31.628 8.732 -3.727 1.00 2.30 H new ATOM 0 HD2 ARG A 128 -30.763 10.224 -5.240 1.00 44.25 H new ATOM 0 HD3 ARG A 128 -29.394 10.166 -4.148 1.00 44.25 H new ATOM 0 HE ARG A 128 -28.136 9.051 -5.771 1.00 42.20 H new ATOM 0 HH11 ARG A 128 -31.559 9.066 -6.631 1.00 23.30 H new ATOM 0 HH12 ARG A 128 -31.271 8.446 -8.259 1.00 23.30 H new ATOM 0 HH21 ARG A 128 -27.774 8.257 -7.864 1.00 64.11 H new ATOM 0 HH22 ARG A 128 -29.138 7.989 -8.955 1.00 64.11 H new ATOM 1950 N VAL A 129 -28.997 5.784 -0.745 1.00 61.44 N ATOM 1951 CA VAL A 129 -28.085 5.333 0.298 1.00 71.52 C ATOM 1952 C VAL A 129 -26.640 5.356 -0.187 1.00 13.23 C ATOM 1953 O VAL A 129 -26.373 5.203 -1.380 1.00 34.03 O ATOM 1954 CB VAL A 129 -28.434 3.909 0.772 1.00 44.32 C ATOM 1955 CG1 VAL A 129 -27.619 3.540 2.002 1.00 3.32 C ATOM 1956 CG2 VAL A 129 -29.925 3.793 1.056 1.00 62.34 C ATOM 0 H VAL A 129 -29.063 5.158 -1.547 1.00 61.44 H new ATOM 0 HA VAL A 129 -28.195 6.023 1.134 1.00 71.52 H new ATOM 0 HB VAL A 129 -28.183 3.208 -0.024 1.00 44.32 H new ATOM 0 HG11 VAL A 129 -27.879 2.531 2.322 1.00 3.32 H new ATOM 0 HG12 VAL A 129 -26.557 3.581 1.761 1.00 3.32 H new ATOM 0 HG13 VAL A 129 -27.836 4.243 2.806 1.00 3.32 H new ATOM 0 HG21 VAL A 129 -30.154 2.781 1.390 1.00 62.34 H new ATOM 0 HG22 VAL A 129 -30.203 4.504 1.834 1.00 62.34 H new ATOM 0 HG23 VAL A 129 -30.486 4.011 0.148 1.00 62.34 H new ATOM 1966 N TYR A 130 -25.712 5.545 0.744 1.00 2.33 N ATOM 1967 CA TYR A 130 -24.293 5.590 0.410 1.00 2.11 C ATOM 1968 C TYR A 130 -23.512 4.556 1.216 1.00 50.21 C ATOM 1969 O TYR A 130 -23.388 4.668 2.436 1.00 35.14 O ATOM 1970 CB TYR A 130 -23.730 6.988 0.670 1.00 54.22 C ATOM 1971 CG TYR A 130 -24.215 8.028 -0.313 1.00 50.10 C ATOM 1972 CD1 TYR A 130 -25.560 8.368 -0.389 1.00 41.25 C ATOM 1973 CD2 TYR A 130 -23.328 8.673 -1.166 1.00 64.34 C ATOM 1974 CE1 TYR A 130 -26.007 9.317 -1.287 1.00 42.45 C ATOM 1975 CE2 TYR A 130 -23.766 9.624 -2.066 1.00 13.34 C ATOM 1976 CZ TYR A 130 -25.106 9.944 -2.124 1.00 23.14 C ATOM 1977 OH TYR A 130 -25.547 10.891 -3.018 1.00 43.15 O ATOM 0 H TYR A 130 -25.916 5.669 1.736 1.00 2.33 H new ATOM 0 HA TYR A 130 -24.187 5.355 -0.649 1.00 2.11 H new ATOM 0 HB2 TYR A 130 -24.003 7.299 1.679 1.00 54.22 H new ATOM 0 HB3 TYR A 130 -22.641 6.945 0.633 1.00 54.22 H new ATOM 0 HD1 TYR A 130 -26.268 7.882 0.266 1.00 41.25 H new ATOM 0 HD2 TYR A 130 -22.277 8.426 -1.124 1.00 64.34 H new ATOM 0 HE1 TYR A 130 -27.056 9.567 -1.334 1.00 42.45 H new ATOM 0 HE2 TYR A 130 -23.062 10.115 -2.722 1.00 13.34 H new ATOM 0 HH TYR A 130 -24.787 11.236 -3.531 1.00 43.15 H new ATOM 1987 N ILE A 131 -22.987 3.550 0.524 1.00 62.14 N ATOM 1988 CA ILE A 131 -22.216 2.498 1.175 1.00 14.52 C ATOM 1989 C ILE A 131 -20.794 2.441 0.627 1.00 32.22 C ATOM 1990 O ILE A 131 -20.584 2.421 -0.586 1.00 50.11 O ATOM 1991 CB ILE A 131 -22.880 1.120 0.993 1.00 53.44 C ATOM 1992 CG1 ILE A 131 -24.119 1.005 1.881 1.00 75.34 C ATOM 1993 CG2 ILE A 131 -21.890 0.008 1.310 1.00 74.22 C ATOM 1994 CD1 ILE A 131 -25.420 1.198 1.133 1.00 41.20 C ATOM 0 H ILE A 131 -23.081 3.441 -0.486 1.00 62.14 H new ATOM 0 HA ILE A 131 -22.184 2.740 2.237 1.00 14.52 H new ATOM 0 HB ILE A 131 -23.191 1.018 -0.047 1.00 53.44 H new ATOM 0 HG12 ILE A 131 -24.125 0.024 2.357 1.00 75.34 H new ATOM 0 HG13 ILE A 131 -24.055 1.746 2.678 1.00 75.34 H new ATOM 0 HG21 ILE A 131 -22.374 -0.959 1.177 1.00 74.22 H new ATOM 0 HG22 ILE A 131 -21.034 0.081 0.639 1.00 74.22 H new ATOM 0 HG23 ILE A 131 -21.552 0.105 2.342 1.00 74.22 H new ATOM 0 HD11 ILE A 131 -26.256 1.103 1.826 1.00 41.20 H new ATOM 0 HD12 ILE A 131 -25.436 2.189 0.680 1.00 41.20 H new ATOM 0 HD13 ILE A 131 -25.507 0.441 0.353 1.00 41.20 H new ATOM 2006 N VAL A 132 -19.819 2.410 1.530 1.00 41.23 N ATOM 2007 CA VAL A 132 -18.415 2.352 1.139 1.00 34.34 C ATOM 2008 C VAL A 132 -17.843 0.955 1.353 1.00 0.01 C ATOM 2009 O VAL A 132 -17.795 0.459 2.478 1.00 51.31 O ATOM 2010 CB VAL A 132 -17.570 3.368 1.929 1.00 61.21 C ATOM 2011 CG1 VAL A 132 -17.856 4.785 1.455 1.00 1.22 C ATOM 2012 CG2 VAL A 132 -17.831 3.233 3.421 1.00 73.24 C ATOM 0 H VAL A 132 -19.976 2.424 2.538 1.00 41.23 H new ATOM 0 HA VAL A 132 -18.371 2.601 0.079 1.00 34.34 H new ATOM 0 HB VAL A 132 -16.516 3.156 1.748 1.00 61.21 H new ATOM 0 HG11 VAL A 132 -17.249 5.489 2.025 1.00 1.22 H new ATOM 0 HG12 VAL A 132 -17.612 4.871 0.396 1.00 1.22 H new ATOM 0 HG13 VAL A 132 -18.912 5.012 1.604 1.00 1.22 H new ATOM 0 HG21 VAL A 132 -17.225 3.959 3.963 1.00 73.24 H new ATOM 0 HG22 VAL A 132 -18.886 3.417 3.624 1.00 73.24 H new ATOM 0 HG23 VAL A 132 -17.569 2.226 3.747 1.00 73.24 H new ATOM 2022 N GLN A 133 -17.410 0.327 0.265 1.00 42.41 N ATOM 2023 CA GLN A 133 -16.840 -1.014 0.334 1.00 12.41 C ATOM 2024 C GLN A 133 -15.515 -1.005 1.089 1.00 54.20 C ATOM 2025 O GLN A 133 -14.779 -0.018 1.061 1.00 2.20 O ATOM 2026 CB GLN A 133 -16.635 -1.577 -1.073 1.00 71.20 C ATOM 2027 CG GLN A 133 -17.893 -2.182 -1.676 1.00 14.21 C ATOM 2028 CD GLN A 133 -19.088 -1.256 -1.582 1.00 65.31 C ATOM 2029 OE1 GLN A 133 -20.119 -1.610 -1.007 1.00 73.53 O ATOM 2030 NE2 GLN A 133 -18.960 -0.062 -2.148 1.00 12.32 N ATOM 0 H GLN A 133 -17.443 0.724 -0.674 1.00 42.41 H new ATOM 0 HA GLN A 133 -17.540 -1.651 0.874 1.00 12.41 H new ATOM 0 HB2 GLN A 133 -16.276 -0.781 -1.725 1.00 71.20 H new ATOM 0 HB3 GLN A 133 -15.855 -2.338 -1.041 1.00 71.20 H new ATOM 0 HG2 GLN A 133 -17.709 -2.426 -2.722 1.00 14.21 H new ATOM 0 HG3 GLN A 133 -18.122 -3.118 -1.166 1.00 14.21 H new ATOM 0 HE21 GLN A 133 -18.089 0.191 -2.614 1.00 12.32 H new ATOM 0 HE22 GLN A 133 -19.733 0.603 -2.117 1.00 12.32 H new ATOM 2039 N LYS A 134 -15.216 -2.109 1.765 1.00 12.52 N ATOM 2040 CA LYS A 134 -13.979 -2.230 2.527 1.00 43.01 C ATOM 2041 C LYS A 134 -13.112 -3.360 1.982 1.00 3.21 C ATOM 2042 O LYS A 134 -13.621 -4.404 1.576 1.00 43.24 O ATOM 2043 CB LYS A 134 -14.290 -2.478 4.005 1.00 4.32 C ATOM 2044 CG LYS A 134 -13.170 -2.054 4.940 1.00 31.52 C ATOM 2045 CD LYS A 134 -13.279 -2.745 6.289 1.00 15.52 C ATOM 2046 CE LYS A 134 -14.532 -2.314 7.036 1.00 55.02 C ATOM 2047 NZ LYS A 134 -14.334 -2.338 8.513 1.00 1.44 N1+ ATOM 0 H LYS A 134 -15.815 -2.934 1.801 1.00 12.52 H new ATOM 0 HA LYS A 134 -13.428 -1.295 2.429 1.00 43.01 H new ATOM 0 HB2 LYS A 134 -15.199 -1.939 4.272 1.00 4.32 H new ATOM 0 HB3 LYS A 134 -14.493 -3.539 4.152 1.00 4.32 H new ATOM 0 HG2 LYS A 134 -12.207 -2.289 4.486 1.00 31.52 H new ATOM 0 HG3 LYS A 134 -13.201 -0.973 5.080 1.00 31.52 H new ATOM 0 HD2 LYS A 134 -13.293 -3.825 6.146 1.00 15.52 H new ATOM 0 HD3 LYS A 134 -12.399 -2.515 6.889 1.00 15.52 H new ATOM 0 HE2 LYS A 134 -14.813 -1.308 6.724 1.00 55.02 H new ATOM 0 HE3 LYS A 134 -15.358 -2.973 6.770 1.00 55.02 H new ATOM 0 HZ1 LYS A 134 -15.210 -2.038 8.986 1.00 1.44 H new ATOM 0 HZ2 LYS A 134 -14.091 -3.303 8.815 1.00 1.44 H new ATOM 0 HZ3 LYS A 134 -13.562 -1.690 8.770 1.00 1.44 H new ATOM 2061 N ARG A 135 -11.801 -3.144 1.978 1.00 73.21 N ATOM 2062 CA ARG A 135 -10.863 -4.145 1.484 1.00 2.23 C ATOM 2063 C ARG A 135 -10.376 -5.042 2.618 1.00 4.34 C ATOM 2064 O ARG A 135 -10.376 -4.642 3.783 1.00 70.31 O ATOM 2065 CB ARG A 135 -9.671 -3.468 0.806 1.00 24.23 C ATOM 2066 CG ARG A 135 -9.866 -3.238 -0.683 1.00 61.24 C ATOM 2067 CD ARG A 135 -9.739 -4.534 -1.468 1.00 61.52 C ATOM 2068 NE ARG A 135 -10.409 -4.457 -2.764 1.00 65.45 N ATOM 2069 CZ ARG A 135 -10.652 -5.516 -3.529 1.00 44.11 C ATOM 2070 NH1 ARG A 135 -10.281 -6.726 -3.131 1.00 2.13 N1+ ATOM 2071 NH2 ARG A 135 -11.267 -5.366 -4.695 1.00 1.42 N ATOM 0 H ARG A 135 -11.364 -2.285 2.311 1.00 73.21 H new ATOM 0 HA ARG A 135 -11.384 -4.764 0.753 1.00 2.23 H new ATOM 0 HB2 ARG A 135 -9.484 -2.510 1.291 1.00 24.23 H new ATOM 0 HB3 ARG A 135 -8.782 -4.081 0.957 1.00 24.23 H new ATOM 0 HG2 ARG A 135 -10.848 -2.800 -0.859 1.00 61.24 H new ATOM 0 HG3 ARG A 135 -9.128 -2.520 -1.041 1.00 61.24 H new ATOM 0 HD2 ARG A 135 -8.684 -4.765 -1.618 1.00 61.52 H new ATOM 0 HD3 ARG A 135 -10.165 -5.353 -0.888 1.00 61.52 H new ATOM 0 HE ARG A 135 -10.706 -3.541 -3.100 1.00 65.45 H new ATOM 0 HH11 ARG A 135 -9.808 -6.845 -2.235 1.00 2.13 H new ATOM 0 HH12 ARG A 135 -10.469 -7.537 -3.721 1.00 2.13 H new ATOM 0 HH21 ARG A 135 -11.554 -4.437 -5.005 1.00 1.42 H new ATOM 0 HH22 ARG A 135 -11.453 -6.179 -5.282 1.00 1.42 H new ATOM 2085 N LYS A 136 -9.961 -6.255 2.271 1.00 75.34 N ATOM 2086 CA LYS A 136 -9.471 -7.209 3.258 1.00 14.01 C ATOM 2087 C LYS A 136 -8.212 -7.910 2.758 1.00 71.32 C ATOM 2088 O LYS A 136 -8.063 -8.160 1.562 1.00 71.05 O ATOM 2089 CB LYS A 136 -10.552 -8.244 3.578 1.00 52.34 C ATOM 2090 CG LYS A 136 -11.256 -8.788 2.348 1.00 44.13 C ATOM 2091 CD LYS A 136 -11.894 -10.140 2.623 1.00 43.40 C ATOM 2092 CE LYS A 136 -12.045 -10.955 1.347 1.00 63.11 C ATOM 2093 NZ LYS A 136 -10.780 -11.652 0.982 1.00 55.42 N1+ ATOM 0 H LYS A 136 -9.954 -6.601 1.312 1.00 75.34 H new ATOM 0 HA LYS A 136 -9.223 -6.660 4.166 1.00 14.01 H new ATOM 0 HB2 LYS A 136 -10.100 -9.072 4.124 1.00 52.34 H new ATOM 0 HB3 LYS A 136 -11.291 -7.792 4.239 1.00 52.34 H new ATOM 0 HG2 LYS A 136 -12.021 -8.083 2.024 1.00 44.13 H new ATOM 0 HG3 LYS A 136 -10.542 -8.881 1.530 1.00 44.13 H new ATOM 0 HD2 LYS A 136 -11.285 -10.692 3.339 1.00 43.40 H new ATOM 0 HD3 LYS A 136 -12.872 -9.995 3.082 1.00 43.40 H new ATOM 0 HE2 LYS A 136 -12.840 -11.689 1.477 1.00 63.11 H new ATOM 0 HE3 LYS A 136 -12.347 -10.299 0.531 1.00 63.11 H new ATOM 0 HZ1 LYS A 136 -10.923 -12.196 0.108 1.00 55.42 H new ATOM 0 HZ2 LYS A 136 -10.027 -10.950 0.833 1.00 55.42 H new ATOM 0 HZ3 LYS A 136 -10.505 -12.297 1.750 1.00 55.42 H new ATOM 2107 N ILE A 137 -7.311 -8.226 3.682 1.00 30.52 N ATOM 2108 CA ILE A 137 -6.067 -8.901 3.335 1.00 4.50 C ATOM 2109 C ILE A 137 -6.333 -10.147 2.497 1.00 42.20 C ATOM 2110 O ILE A 137 -7.445 -10.674 2.485 1.00 34.34 O ATOM 2111 CB ILE A 137 -5.273 -9.301 4.592 1.00 24.31 C ATOM 2112 CG1 ILE A 137 -6.131 -10.177 5.506 1.00 34.43 C ATOM 2113 CG2 ILE A 137 -4.794 -8.062 5.333 1.00 52.43 C ATOM 2114 CD1 ILE A 137 -6.069 -11.650 5.166 1.00 4.14 C ATOM 0 H ILE A 137 -7.419 -8.025 4.676 1.00 30.52 H new ATOM 0 HA ILE A 137 -5.476 -8.194 2.753 1.00 4.50 H new ATOM 0 HB ILE A 137 -4.400 -9.876 4.284 1.00 24.31 H new ATOM 0 HG12 ILE A 137 -5.808 -10.037 6.538 1.00 34.43 H new ATOM 0 HG13 ILE A 137 -7.167 -9.843 5.448 1.00 34.43 H new ATOM 0 HG21 ILE A 137 -4.234 -8.362 6.219 1.00 52.43 H new ATOM 0 HG22 ILE A 137 -4.150 -7.473 4.679 1.00 52.43 H new ATOM 0 HG23 ILE A 137 -5.653 -7.462 5.632 1.00 52.43 H new ATOM 0 HD11 ILE A 137 -6.702 -12.209 5.855 1.00 4.14 H new ATOM 0 HD12 ILE A 137 -6.420 -11.803 4.146 1.00 4.14 H new ATOM 0 HD13 ILE A 137 -5.040 -12.000 5.252 1.00 4.14 H new ATOM 2126 N SER A 138 -5.303 -10.615 1.798 1.00 33.30 N ATOM 2127 CA SER A 138 -5.425 -11.799 0.955 1.00 12.12 C ATOM 2128 C SER A 138 -5.492 -13.065 1.804 1.00 23.35 C ATOM 2129 O SER A 138 -4.574 -13.362 2.567 1.00 14.03 O ATOM 2130 CB SER A 138 -4.246 -11.884 -0.016 1.00 33.30 C ATOM 2131 OG SER A 138 -4.336 -13.043 -0.827 1.00 33.15 O ATOM 0 H SER A 138 -4.375 -10.192 1.799 1.00 33.30 H new ATOM 0 HA SER A 138 -6.350 -11.715 0.385 1.00 12.12 H new ATOM 0 HB2 SER A 138 -4.226 -10.995 -0.647 1.00 33.30 H new ATOM 0 HB3 SER A 138 -3.311 -11.899 0.543 1.00 33.30 H new ATOM 0 HG SER A 138 -3.572 -13.073 -1.440 1.00 33.15 H new ATOM 2137 N GLU A 139 -6.586 -13.807 1.663 1.00 73.41 N ATOM 2138 CA GLU A 139 -6.774 -15.041 2.417 1.00 32.15 C ATOM 2139 C GLU A 139 -6.230 -16.239 1.644 1.00 5.54 C ATOM 2140 O GLU A 139 -6.521 -16.412 0.461 1.00 63.51 O ATOM 2141 CB GLU A 139 -8.256 -15.252 2.731 1.00 31.35 C ATOM 2142 CG GLU A 139 -8.508 -16.301 3.801 1.00 73.33 C ATOM 2143 CD GLU A 139 -8.345 -15.754 5.205 1.00 40.35 C ATOM 2144 OE1 GLU A 139 -7.197 -15.452 5.595 1.00 55.44 O ATOM 2145 OE2 GLU A 139 -9.364 -15.626 5.914 1.00 25.42 O1- ATOM 0 H GLU A 139 -7.355 -13.575 1.034 1.00 73.41 H new ATOM 0 HA GLU A 139 -6.221 -14.953 3.352 1.00 32.15 H new ATOM 0 HB2 GLU A 139 -8.689 -14.305 3.053 1.00 31.35 H new ATOM 0 HB3 GLU A 139 -8.774 -15.545 1.818 1.00 31.35 H new ATOM 0 HG2 GLU A 139 -9.516 -16.698 3.685 1.00 73.33 H new ATOM 0 HG3 GLU A 139 -7.819 -17.134 3.657 1.00 73.33 H new ATOM 2152 N GLY A 140 -5.437 -17.063 2.323 1.00 65.11 N ATOM 2153 CA GLY A 140 -4.865 -18.234 1.684 1.00 41.24 C ATOM 2154 C GLY A 140 -3.422 -18.022 1.270 1.00 43.02 C ATOM 2155 O GLY A 140 -2.678 -18.981 1.073 1.00 23.34 O ATOM 0 H GLY A 140 -5.181 -16.941 3.303 1.00 65.11 H new ATOM 0 HA2 GLY A 140 -4.923 -19.082 2.367 1.00 41.24 H new ATOM 0 HA3 GLY A 140 -5.458 -18.491 0.806 1.00 41.24 H new ATOM 2159 N ASP A 141 -3.028 -16.760 1.134 1.00 63.32 N ATOM 2160 CA ASP A 141 -1.665 -16.424 0.738 1.00 33.42 C ATOM 2161 C ASP A 141 -1.006 -15.521 1.777 1.00 14.14 C ATOM 2162 O ASP A 141 -1.626 -14.586 2.285 1.00 20.30 O ATOM 2163 CB ASP A 141 -1.662 -15.737 -0.628 1.00 74.13 C ATOM 2164 CG ASP A 141 -1.629 -16.729 -1.774 1.00 34.21 C ATOM 2165 OD1 ASP A 141 -0.530 -17.228 -2.095 1.00 41.30 O ATOM 2166 OD2 ASP A 141 -2.702 -17.006 -2.350 1.00 23.22 O1- ATOM 0 H ASP A 141 -3.633 -15.954 1.292 1.00 63.32 H new ATOM 0 HA ASP A 141 -1.093 -17.350 0.671 1.00 33.42 H new ATOM 0 HB2 ASP A 141 -2.550 -15.111 -0.719 1.00 74.13 H new ATOM 0 HB3 ASP A 141 -0.798 -15.077 -0.698 1.00 74.13 H new TER 2171 ASP A 141