USER MOD reduce.3.24.130724 H: found=0, std=0, add=1272, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1271 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 135 LYS NZ :NH3+ -161:sc= 0.816 (180deg=0) USER MOD Set 1.2: A 139 ASN : amide:sc= 0.511 K(o=1.3,f=-5.9!) USER MOD Set 2.1: A 130 SER OG : rot -4:sc= 0.341 USER MOD Set 2.2: A 131 LYS NZ :NH3+ 138:sc= 2.13 (180deg=-0.0718) USER MOD Set 3.1: A 43 ASN : amide:sc= 0.762 K(o=0.15,f=-1.3) USER MOD Set 3.2: A 113 ASN : amide:sc= -0.609 K(o=0.15,f=-2.5!) USER MOD Set 4.1: A 99 THR OG1 : rot 44:sc= 0.622 USER MOD Set 4.2: A 103 GLN : amide:sc= 0.482 K(o=1.1,f=-2.7!) USER MOD Set 5.1: A 94 ASN : amide:sc= 0.301 K(o=1.2,f=-2.3) USER MOD Set 5.2: A 96 LYS NZ :NH3+ -144:sc= 0.85 (180deg=0.376) USER MOD Set 6.1: A 78 ASN : amide:sc= -2.51 K(o=-1.9,f=-4.6!) USER MOD Set 6.2: A 116 GLN : amide:sc= 0.644 K(o=-1.9,f=-3.2) USER MOD Set 7.1: A 31 ASN : amide:sc= 0.275 K(o=0.83,f=-1.2) USER MOD Set 7.2: A 34 THR OG1 : rot 83:sc= 0.556 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -128:sc= 1.36 (180deg=-0.222) USER MOD Single : A 4 SER OG : rot -174:sc= -1.47 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 CYS SG : rot -26:sc=5.89e-05 USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= -0.55 K(o=-0.55,f=-2.1!) USER MOD Single : A 24 ASN : amide:sc= -0.408 X(o=-0.41,f=0.01) USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 36 GLN : amide:sc= 0.557 K(o=0.56,f=-5.7!) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 171:sc= 0.888 (180deg=0.759) USER MOD Single : A 56 ASN : amide:sc= 0.576 K(o=0.58,f=0) USER MOD Single : A 61 TYR OH : rot 141:sc= 0.964 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.0212 USER MOD Single : A 71 LYS NZ :NH3+ -171:sc= 1.13 (180deg=0.998) USER MOD Single : A 72 THR OG1 : rot 120:sc=-0.00633 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 HIS : no HE2:sc= -2.13 X(o=-2.1,f=-2.3) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= 0.534 K(o=0.53,f=0) USER MOD Single : A 86 CYS SG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 172:sc= 0.603 (180deg=0.567) USER MOD Single : A 101 THR OG1 : rot -176:sc= 1.9 USER MOD Single : A 106 GLN : amide:sc= -0.394 K(o=-0.39,f=-1) USER MOD Single : A 107 SER OG : rot -150:sc= 0 USER MOD Single : A 119 HIS : no HE2:sc= 0.243 K(o=0.24,f=-1.8) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 CYS SG : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ -121:sc= 1.03 (180deg=-1.6) USER MOD Single : A 144 THR OG1 : rot -163:sc= 0.216 USER MOD Single : A 145 LYS NZ :NH3+ -170:sc= 0.909 (180deg=0.833) USER MOD Single : A 146 LYS NZ :NH3+ -177:sc= 0.85 (180deg=0.844) USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -21.706 -4.669 10.939 1.00 1.52 N ATOM 2 CA MET A 1 -20.626 -4.407 9.968 1.00 0.68 C ATOM 3 C MET A 1 -20.958 -3.228 9.044 1.00 0.66 C ATOM 4 O MET A 1 -21.034 -3.375 7.827 1.00 0.92 O ATOM 5 CB MET A 1 -20.262 -5.690 9.216 1.00 0.74 C ATOM 6 CG MET A 1 -21.391 -6.321 8.389 1.00 2.48 C ATOM 7 SD MET A 1 -22.612 -7.236 9.362 1.00 2.84 S ATOM 8 CE MET A 1 -23.526 -8.012 8.004 1.00 4.73 C ATOM 0 H1 MET A 1 -21.309 -4.702 11.900 1.00 1.52 H new ATOM 0 H2 MET A 1 -22.415 -3.910 10.883 1.00 1.52 H new ATOM 0 H3 MET A 1 -22.157 -5.580 10.720 1.00 1.52 H new ATOM 0 HA MET A 1 -19.735 -4.097 10.514 1.00 0.68 H new ATOM 0 HB2 MET A 1 -19.426 -5.474 8.550 1.00 0.74 H new ATOM 0 HB3 MET A 1 -19.912 -6.426 9.939 1.00 0.74 H new ATOM 0 HG2 MET A 1 -21.902 -5.534 7.835 1.00 2.48 H new ATOM 0 HG3 MET A 1 -20.952 -6.995 7.653 1.00 2.48 H new ATOM 0 HE1 MET A 1 -24.330 -8.625 8.410 1.00 4.73 H new ATOM 0 HE2 MET A 1 -23.948 -7.239 7.361 1.00 4.73 H new ATOM 0 HE3 MET A 1 -22.850 -8.639 7.422 1.00 4.73 H new ATOM 20 N ALA A 2 -21.136 -2.025 9.605 1.00 0.66 N ATOM 21 CA ALA A 2 -21.545 -0.863 8.818 1.00 0.74 C ATOM 22 C ALA A 2 -20.497 -0.464 7.776 1.00 0.71 C ATOM 23 O ALA A 2 -20.841 0.107 6.746 1.00 1.15 O ATOM 24 CB ALA A 2 -21.850 0.314 9.747 1.00 0.91 C ATOM 0 H ALA A 2 -21.003 -1.835 10.598 1.00 0.66 H new ATOM 0 HA ALA A 2 -22.446 -1.140 8.271 1.00 0.74 H new ATOM 0 HB1 ALA A 2 -22.154 1.176 9.154 1.00 0.91 H new ATOM 0 HB2 ALA A 2 -22.655 0.040 10.429 1.00 0.91 H new ATOM 0 HB3 ALA A 2 -20.958 0.565 10.321 1.00 0.91 H new ATOM 30 N ALA A 3 -19.222 -0.759 8.032 1.00 0.49 N ATOM 31 CA ALA A 3 -18.169 -0.522 7.063 1.00 0.40 C ATOM 32 C ALA A 3 -18.289 -1.522 5.916 1.00 0.26 C ATOM 33 O ALA A 3 -18.251 -1.121 4.761 1.00 0.27 O ATOM 34 CB ALA A 3 -16.803 -0.618 7.742 1.00 0.56 C ATOM 0 H ALA A 3 -18.899 -1.165 8.910 1.00 0.49 H new ATOM 0 HA ALA A 3 -18.271 0.482 6.652 1.00 0.40 H new ATOM 0 HB1 ALA A 3 -16.018 -0.439 7.007 1.00 0.56 H new ATOM 0 HB2 ALA A 3 -16.737 0.129 8.533 1.00 0.56 H new ATOM 0 HB3 ALA A 3 -16.679 -1.613 8.170 1.00 0.56 H new ATOM 40 N SER A 4 -18.456 -2.813 6.217 1.00 0.28 N ATOM 41 CA SER A 4 -18.470 -3.905 5.250 1.00 0.34 C ATOM 42 C SER A 4 -19.394 -3.632 4.079 1.00 0.34 C ATOM 43 O SER A 4 -19.004 -3.829 2.933 1.00 0.41 O ATOM 44 CB SER A 4 -18.911 -5.192 5.932 1.00 0.43 C ATOM 45 OG SER A 4 -17.915 -5.647 6.804 1.00 2.00 O ATOM 0 H SER A 4 -18.590 -3.134 7.176 1.00 0.28 H new ATOM 0 HA SER A 4 -17.455 -4.000 4.863 1.00 0.34 H new ATOM 0 HB2 SER A 4 -19.836 -5.021 6.483 1.00 0.43 H new ATOM 0 HB3 SER A 4 -19.123 -5.954 5.182 1.00 0.43 H new ATOM 0 HG SER A 4 -18.170 -6.522 7.164 1.00 2.00 H new ATOM 51 N ARG A 5 -20.620 -3.180 4.347 1.00 0.36 N ATOM 52 CA ARG A 5 -21.559 -2.868 3.269 1.00 0.43 C ATOM 53 C ARG A 5 -20.947 -1.912 2.243 1.00 0.42 C ATOM 54 O ARG A 5 -21.184 -2.054 1.047 1.00 0.65 O ATOM 55 CB ARG A 5 -22.881 -2.327 3.845 1.00 0.49 C ATOM 56 CG ARG A 5 -22.656 -1.171 4.828 1.00 2.17 C ATOM 57 CD ARG A 5 -23.681 -0.035 4.708 1.00 3.30 C ATOM 58 NE ARG A 5 -24.815 -0.200 5.630 1.00 4.21 N ATOM 59 CZ ARG A 5 -25.874 0.617 5.692 1.00 5.67 C ATOM 60 NH1 ARG A 5 -26.764 0.488 6.676 1.00 6.72 N ATOM 61 NH2 ARG A 5 -26.040 1.570 4.772 1.00 6.32 N ATOM 0 H ARG A 5 -20.982 -3.023 5.288 1.00 0.36 H new ATOM 0 HA ARG A 5 -21.781 -3.792 2.736 1.00 0.43 H new ATOM 0 HB2 ARG A 5 -23.519 -1.988 3.029 1.00 0.49 H new ATOM 0 HB3 ARG A 5 -23.412 -3.134 4.351 1.00 0.49 H new ATOM 0 HG2 ARG A 5 -22.682 -1.563 5.845 1.00 2.17 H new ATOM 0 HG3 ARG A 5 -21.658 -0.763 4.669 1.00 2.17 H new ATOM 0 HD2 ARG A 5 -23.189 0.917 4.909 1.00 3.30 H new ATOM 0 HD3 ARG A 5 -24.053 0.008 3.684 1.00 3.30 H new ATOM 0 HE ARG A 5 -24.793 -0.995 6.269 1.00 4.21 H new ATOM 0 HH11 ARG A 5 -26.639 -0.235 7.385 1.00 6.72 H new ATOM 0 HH12 ARG A 5 -27.570 1.112 6.720 1.00 6.72 H new ATOM 0 HH21 ARG A 5 -25.359 1.677 4.020 1.00 6.32 H new ATOM 0 HH22 ARG A 5 -26.847 2.191 4.821 1.00 6.32 H new ATOM 75 N ARG A 6 -20.168 -0.931 2.698 1.00 0.27 N ATOM 76 CA ARG A 6 -19.525 0.018 1.806 1.00 0.31 C ATOM 77 C ARG A 6 -18.299 -0.616 1.179 1.00 0.31 C ATOM 78 O ARG A 6 -18.058 -0.411 0.002 1.00 0.41 O ATOM 79 CB ARG A 6 -19.152 1.313 2.535 1.00 0.36 C ATOM 80 CG ARG A 6 -20.326 1.839 3.368 1.00 0.41 C ATOM 81 CD ARG A 6 -20.207 3.345 3.613 1.00 1.14 C ATOM 82 NE ARG A 6 -20.671 4.111 2.446 1.00 1.73 N ATOM 83 CZ ARG A 6 -20.975 5.415 2.458 1.00 1.74 C ATOM 84 NH1 ARG A 6 -21.541 5.979 1.389 1.00 3.03 N ATOM 85 NH2 ARG A 6 -20.723 6.148 3.543 1.00 2.30 N ATOM 0 H ARG A 6 -19.970 -0.777 3.687 1.00 0.27 H new ATOM 0 HA ARG A 6 -20.233 0.281 1.020 1.00 0.31 H new ATOM 0 HB2 ARG A 6 -18.294 1.134 3.183 1.00 0.36 H new ATOM 0 HB3 ARG A 6 -18.851 2.068 1.809 1.00 0.36 H new ATOM 0 HG2 ARG A 6 -21.263 1.626 2.854 1.00 0.41 H new ATOM 0 HG3 ARG A 6 -20.360 1.315 4.323 1.00 0.41 H new ATOM 0 HD2 ARG A 6 -20.793 3.621 4.489 1.00 1.14 H new ATOM 0 HD3 ARG A 6 -19.170 3.600 3.830 1.00 1.14 H new ATOM 0 HE ARG A 6 -20.768 3.612 1.562 1.00 1.73 H new ATOM 0 HH11 ARG A 6 -21.742 5.417 0.562 1.00 3.03 H new ATOM 0 HH12 ARG A 6 -21.772 6.972 1.399 1.00 3.03 H new ATOM 0 HH21 ARG A 6 -20.299 5.715 4.364 1.00 2.30 H new ATOM 0 HH22 ARG A 6 -20.954 7.141 3.552 1.00 2.30 H new ATOM 99 N LEU A 7 -17.519 -1.370 1.951 1.00 0.27 N ATOM 100 CA LEU A 7 -16.234 -1.896 1.523 1.00 0.24 C ATOM 101 C LEU A 7 -16.410 -2.885 0.390 1.00 0.24 C ATOM 102 O LEU A 7 -15.596 -2.898 -0.517 1.00 0.29 O ATOM 103 CB LEU A 7 -15.509 -2.568 2.694 1.00 0.26 C ATOM 104 CG LEU A 7 -15.086 -1.545 3.753 1.00 0.29 C ATOM 105 CD1 LEU A 7 -14.719 -2.278 5.040 1.00 0.37 C ATOM 106 CD2 LEU A 7 -13.891 -0.703 3.312 1.00 0.35 C ATOM 0 H LEU A 7 -17.770 -1.634 2.904 1.00 0.27 H new ATOM 0 HA LEU A 7 -15.630 -1.061 1.168 1.00 0.24 H new ATOM 0 HB2 LEU A 7 -16.161 -3.314 3.147 1.00 0.26 H new ATOM 0 HB3 LEU A 7 -14.630 -3.096 2.325 1.00 0.26 H new ATOM 0 HG LEU A 7 -15.929 -0.872 3.907 1.00 0.29 H new ATOM 0 HD11 LEU A 7 -14.417 -1.555 5.797 1.00 0.37 H new ATOM 0 HD12 LEU A 7 -15.582 -2.839 5.398 1.00 0.37 H new ATOM 0 HD13 LEU A 7 -13.895 -2.965 4.845 1.00 0.37 H new ATOM 0 HD21 LEU A 7 -13.634 0.005 4.100 1.00 0.35 H new ATOM 0 HD22 LEU A 7 -13.039 -1.354 3.117 1.00 0.35 H new ATOM 0 HD23 LEU A 7 -14.146 -0.158 2.403 1.00 0.35 H new ATOM 118 N MET A 8 -17.440 -3.724 0.438 1.00 0.31 N ATOM 119 CA MET A 8 -17.686 -4.713 -0.598 1.00 0.39 C ATOM 120 C MET A 8 -18.041 -3.999 -1.901 1.00 0.32 C ATOM 121 O MET A 8 -17.441 -4.273 -2.937 1.00 0.31 O ATOM 122 CB MET A 8 -18.765 -5.688 -0.097 1.00 0.58 C ATOM 123 CG MET A 8 -18.710 -7.038 -0.814 1.00 1.09 C ATOM 124 SD MET A 8 -19.364 -7.055 -2.499 1.00 2.38 S ATOM 125 CE MET A 8 -18.898 -8.747 -2.954 1.00 2.73 C ATOM 0 H MET A 8 -18.124 -3.735 1.195 1.00 0.31 H new ATOM 0 HA MET A 8 -16.799 -5.309 -0.813 1.00 0.39 H new ATOM 0 HB2 MET A 8 -18.641 -5.844 0.975 1.00 0.58 H new ATOM 0 HB3 MET A 8 -19.749 -5.242 -0.242 1.00 0.58 H new ATOM 0 HG2 MET A 8 -17.673 -7.372 -0.843 1.00 1.09 H new ATOM 0 HG3 MET A 8 -19.263 -7.767 -0.221 1.00 1.09 H new ATOM 0 HE1 MET A 8 -19.220 -8.951 -3.975 1.00 2.73 H new ATOM 0 HE2 MET A 8 -17.816 -8.857 -2.886 1.00 2.73 H new ATOM 0 HE3 MET A 8 -19.377 -9.452 -2.274 1.00 2.73 H new ATOM 135 N LYS A 9 -18.968 -3.033 -1.846 1.00 0.32 N ATOM 136 CA LYS A 9 -19.304 -2.231 -3.027 1.00 0.28 C ATOM 137 C LYS A 9 -18.067 -1.536 -3.599 1.00 0.27 C ATOM 138 O LYS A 9 -17.791 -1.647 -4.787 1.00 0.32 O ATOM 139 CB LYS A 9 -20.387 -1.195 -2.690 1.00 0.44 C ATOM 140 CG LYS A 9 -21.801 -1.673 -3.040 1.00 1.71 C ATOM 141 CD LYS A 9 -22.229 -2.926 -2.270 1.00 2.38 C ATOM 142 CE LYS A 9 -23.756 -3.064 -2.304 1.00 3.12 C ATOM 143 NZ LYS A 9 -24.264 -3.388 -3.655 1.00 4.40 N ATOM 0 H LYS A 9 -19.493 -2.791 -1.006 1.00 0.32 H new ATOM 0 HA LYS A 9 -19.692 -2.910 -3.786 1.00 0.28 H new ATOM 0 HB2 LYS A 9 -20.341 -0.962 -1.626 1.00 0.44 H new ATOM 0 HB3 LYS A 9 -20.178 -0.270 -3.228 1.00 0.44 H new ATOM 0 HG2 LYS A 9 -22.509 -0.870 -2.834 1.00 1.71 H new ATOM 0 HG3 LYS A 9 -21.853 -1.878 -4.109 1.00 1.71 H new ATOM 0 HD2 LYS A 9 -21.766 -3.809 -2.709 1.00 2.38 H new ATOM 0 HD3 LYS A 9 -21.884 -2.865 -1.238 1.00 2.38 H new ATOM 0 HE2 LYS A 9 -24.063 -3.844 -1.607 1.00 3.12 H new ATOM 0 HE3 LYS A 9 -24.210 -2.134 -1.962 1.00 3.12 H new ATOM 0 HZ1 LYS A 9 -25.300 -3.471 -3.626 1.00 4.40 H new ATOM 0 HZ2 LYS A 9 -23.996 -2.632 -4.317 1.00 4.40 H new ATOM 0 HZ3 LYS A 9 -23.854 -4.289 -3.973 1.00 4.40 H new ATOM 157 N GLU A 10 -17.341 -0.798 -2.763 1.00 0.25 N ATOM 158 CA GLU A 10 -16.155 -0.045 -3.146 1.00 0.30 C ATOM 159 C GLU A 10 -15.141 -0.997 -3.771 1.00 0.30 C ATOM 160 O GLU A 10 -14.592 -0.684 -4.810 1.00 0.40 O ATOM 161 CB GLU A 10 -15.567 0.694 -1.929 1.00 0.35 C ATOM 162 CG GLU A 10 -16.334 1.984 -1.562 1.00 0.58 C ATOM 163 CD GLU A 10 -15.993 3.203 -2.439 1.00 1.32 C ATOM 164 OE1 GLU A 10 -15.191 3.051 -3.382 1.00 2.23 O ATOM 165 OE2 GLU A 10 -16.500 4.315 -2.150 1.00 1.84 O ATOM 0 H GLU A 10 -17.570 -0.706 -1.773 1.00 0.25 H new ATOM 0 HA GLU A 10 -16.421 0.713 -3.883 1.00 0.30 H new ATOM 0 HB2 GLU A 10 -15.569 0.023 -1.070 1.00 0.35 H new ATOM 0 HB3 GLU A 10 -14.526 0.945 -2.134 1.00 0.35 H new ATOM 0 HG2 GLU A 10 -17.404 1.788 -1.635 1.00 0.58 H new ATOM 0 HG3 GLU A 10 -16.125 2.232 -0.521 1.00 0.58 H new ATOM 172 N LEU A 11 -14.901 -2.171 -3.183 1.00 0.27 N ATOM 173 CA LEU A 11 -13.936 -3.154 -3.664 1.00 0.27 C ATOM 174 C LEU A 11 -14.269 -3.599 -5.070 1.00 0.30 C ATOM 175 O LEU A 11 -13.391 -3.668 -5.929 1.00 0.32 O ATOM 176 CB LEU A 11 -13.918 -4.374 -2.739 1.00 0.29 C ATOM 177 CG LEU A 11 -12.741 -5.305 -3.060 1.00 0.25 C ATOM 178 CD1 LEU A 11 -12.323 -6.005 -1.774 1.00 0.35 C ATOM 179 CD2 LEU A 11 -13.075 -6.376 -4.104 1.00 0.42 C ATOM 0 H LEU A 11 -15.387 -2.469 -2.337 1.00 0.27 H new ATOM 0 HA LEU A 11 -12.953 -2.682 -3.668 1.00 0.27 H new ATOM 0 HB2 LEU A 11 -13.851 -4.045 -1.702 1.00 0.29 H new ATOM 0 HB3 LEU A 11 -14.855 -4.922 -2.839 1.00 0.29 H new ATOM 0 HG LEU A 11 -11.946 -4.687 -3.477 1.00 0.25 H new ATOM 0 HD11 LEU A 11 -11.486 -6.673 -1.979 1.00 0.35 H new ATOM 0 HD12 LEU A 11 -12.021 -5.261 -1.036 1.00 0.35 H new ATOM 0 HD13 LEU A 11 -13.162 -6.583 -1.385 1.00 0.35 H new ATOM 0 HD21 LEU A 11 -12.197 -6.997 -4.281 1.00 0.42 H new ATOM 0 HD22 LEU A 11 -13.892 -6.998 -3.739 1.00 0.42 H new ATOM 0 HD23 LEU A 11 -13.374 -5.895 -5.036 1.00 0.42 H new ATOM 191 N GLU A 12 -15.536 -3.932 -5.286 1.00 0.31 N ATOM 192 CA GLU A 12 -16.025 -4.305 -6.599 1.00 0.38 C ATOM 193 C GLU A 12 -15.687 -3.180 -7.579 1.00 0.37 C ATOM 194 O GLU A 12 -15.069 -3.426 -8.613 1.00 0.40 O ATOM 195 CB GLU A 12 -17.521 -4.628 -6.510 1.00 0.45 C ATOM 196 CG GLU A 12 -18.064 -5.170 -7.833 1.00 0.53 C ATOM 197 CD GLU A 12 -19.484 -5.718 -7.662 1.00 0.99 C ATOM 198 OE1 GLU A 12 -20.362 -4.940 -7.222 1.00 2.00 O ATOM 199 OE2 GLU A 12 -19.672 -6.915 -7.975 1.00 1.42 O ATOM 0 H GLU A 12 -16.248 -3.950 -4.556 1.00 0.31 H new ATOM 0 HA GLU A 12 -15.543 -5.208 -6.972 1.00 0.38 H new ATOM 0 HB2 GLU A 12 -17.688 -5.361 -5.721 1.00 0.45 H new ATOM 0 HB3 GLU A 12 -18.071 -3.729 -6.232 1.00 0.45 H new ATOM 0 HG2 GLU A 12 -18.064 -4.378 -8.582 1.00 0.53 H new ATOM 0 HG3 GLU A 12 -17.409 -5.958 -8.203 1.00 0.53 H new ATOM 206 N GLU A 13 -16.008 -1.940 -7.210 1.00 0.36 N ATOM 207 CA GLU A 13 -15.660 -0.746 -7.972 1.00 0.38 C ATOM 208 C GLU A 13 -14.150 -0.617 -8.183 1.00 0.37 C ATOM 209 O GLU A 13 -13.723 -0.184 -9.245 1.00 0.52 O ATOM 210 CB GLU A 13 -16.221 0.511 -7.281 1.00 0.40 C ATOM 211 CG GLU A 13 -17.390 1.110 -8.068 1.00 0.80 C ATOM 212 CD GLU A 13 -16.928 1.699 -9.404 1.00 2.43 C ATOM 213 OE1 GLU A 13 -16.590 2.903 -9.413 1.00 3.38 O ATOM 214 OE2 GLU A 13 -16.931 0.934 -10.394 1.00 3.38 O ATOM 0 H GLU A 13 -16.527 -1.736 -6.356 1.00 0.36 H new ATOM 0 HA GLU A 13 -16.114 -0.843 -8.958 1.00 0.38 H new ATOM 0 HB2 GLU A 13 -16.551 0.257 -6.274 1.00 0.40 H new ATOM 0 HB3 GLU A 13 -15.431 1.255 -7.179 1.00 0.40 H new ATOM 0 HG2 GLU A 13 -18.140 0.340 -8.249 1.00 0.80 H new ATOM 0 HG3 GLU A 13 -17.869 1.888 -7.473 1.00 0.80 H new ATOM 221 N ILE A 14 -13.317 -0.977 -7.206 1.00 0.27 N ATOM 222 CA ILE A 14 -11.873 -0.830 -7.301 1.00 0.27 C ATOM 223 C ILE A 14 -11.384 -1.744 -8.419 1.00 0.33 C ATOM 224 O ILE A 14 -10.776 -1.282 -9.388 1.00 0.38 O ATOM 225 CB ILE A 14 -11.188 -1.083 -5.933 1.00 0.22 C ATOM 226 CG1 ILE A 14 -11.403 0.150 -5.036 1.00 0.25 C ATOM 227 CG2 ILE A 14 -9.676 -1.273 -6.120 1.00 0.27 C ATOM 228 CD1 ILE A 14 -10.637 0.061 -3.715 1.00 0.28 C ATOM 0 H ILE A 14 -13.632 -1.380 -6.324 1.00 0.27 H new ATOM 0 HA ILE A 14 -11.600 0.194 -7.555 1.00 0.27 H new ATOM 0 HB ILE A 14 -11.618 -1.978 -5.484 1.00 0.22 H new ATOM 0 HG12 ILE A 14 -11.089 1.044 -5.574 1.00 0.25 H new ATOM 0 HG13 ILE A 14 -12.467 0.261 -4.827 1.00 0.25 H new ATOM 0 HG21 ILE A 14 -9.209 -1.450 -5.151 1.00 0.27 H new ATOM 0 HG22 ILE A 14 -9.495 -2.128 -6.772 1.00 0.27 H new ATOM 0 HG23 ILE A 14 -9.250 -0.377 -6.570 1.00 0.27 H new ATOM 0 HD11 ILE A 14 -10.826 0.957 -3.124 1.00 0.28 H new ATOM 0 HD12 ILE A 14 -10.969 -0.817 -3.160 1.00 0.28 H new ATOM 0 HD13 ILE A 14 -9.569 -0.021 -3.918 1.00 0.28 H new ATOM 240 N ARG A 15 -11.659 -3.046 -8.314 1.00 0.35 N ATOM 241 CA ARG A 15 -11.251 -3.996 -9.342 1.00 0.43 C ATOM 242 C ARG A 15 -11.738 -3.531 -10.708 1.00 0.49 C ATOM 243 O ARG A 15 -10.963 -3.499 -11.665 1.00 0.57 O ATOM 244 CB ARG A 15 -11.788 -5.399 -9.042 1.00 0.51 C ATOM 245 CG ARG A 15 -10.900 -6.125 -8.027 1.00 0.92 C ATOM 246 CD ARG A 15 -11.297 -7.601 -7.932 1.00 0.78 C ATOM 247 NE ARG A 15 -11.083 -8.291 -9.214 1.00 1.18 N ATOM 248 CZ ARG A 15 -11.516 -9.515 -9.529 1.00 1.35 C ATOM 249 NH1 ARG A 15 -11.360 -9.971 -10.773 1.00 2.15 N ATOM 250 NH2 ARG A 15 -12.102 -10.276 -8.603 1.00 1.44 N ATOM 0 H ARG A 15 -12.161 -3.462 -7.529 1.00 0.35 H new ATOM 0 HA ARG A 15 -10.162 -4.043 -9.347 1.00 0.43 H new ATOM 0 HB2 ARG A 15 -12.804 -5.327 -8.655 1.00 0.51 H new ATOM 0 HB3 ARG A 15 -11.838 -5.977 -9.965 1.00 0.51 H new ATOM 0 HG2 ARG A 15 -9.854 -6.041 -8.323 1.00 0.92 H new ATOM 0 HG3 ARG A 15 -10.993 -5.653 -7.049 1.00 0.92 H new ATOM 0 HD2 ARG A 15 -10.713 -8.088 -7.151 1.00 0.78 H new ATOM 0 HD3 ARG A 15 -12.345 -7.681 -7.643 1.00 0.78 H new ATOM 0 HE ARG A 15 -10.555 -7.788 -9.928 1.00 1.18 H new ATOM 0 HH11 ARG A 15 -10.912 -9.386 -11.478 1.00 2.15 H new ATOM 0 HH12 ARG A 15 -11.689 -10.905 -11.019 1.00 2.15 H new ATOM 0 HH21 ARG A 15 -12.220 -9.923 -7.653 1.00 1.44 H new ATOM 0 HH22 ARG A 15 -12.432 -11.210 -8.845 1.00 1.44 H new ATOM 264 N LYS A 16 -13.025 -3.195 -10.787 1.00 0.45 N ATOM 265 CA LYS A 16 -13.690 -2.799 -12.017 1.00 0.47 C ATOM 266 C LYS A 16 -13.082 -1.529 -12.604 1.00 0.50 C ATOM 267 O LYS A 16 -13.038 -1.398 -13.824 1.00 0.53 O ATOM 268 CB LYS A 16 -15.189 -2.617 -11.746 1.00 0.45 C ATOM 269 CG LYS A 16 -15.870 -3.970 -11.492 1.00 0.85 C ATOM 270 CD LYS A 16 -15.997 -4.786 -12.782 1.00 1.47 C ATOM 271 CE LYS A 16 -17.481 -4.977 -13.109 1.00 1.90 C ATOM 272 NZ LYS A 16 -17.680 -5.613 -14.428 1.00 3.36 N ATOM 0 H LYS A 16 -13.644 -3.192 -9.976 1.00 0.45 H new ATOM 0 HA LYS A 16 -13.550 -3.586 -12.758 1.00 0.47 H new ATOM 0 HB2 LYS A 16 -15.330 -1.967 -10.882 1.00 0.45 H new ATOM 0 HB3 LYS A 16 -15.659 -2.123 -12.597 1.00 0.45 H new ATOM 0 HG2 LYS A 16 -15.296 -4.535 -10.758 1.00 0.85 H new ATOM 0 HG3 LYS A 16 -16.859 -3.806 -11.065 1.00 0.85 H new ATOM 0 HD2 LYS A 16 -15.494 -4.274 -13.602 1.00 1.47 H new ATOM 0 HD3 LYS A 16 -15.510 -5.754 -12.664 1.00 1.47 H new ATOM 0 HE2 LYS A 16 -17.946 -5.590 -12.337 1.00 1.90 H new ATOM 0 HE3 LYS A 16 -17.983 -4.010 -13.094 1.00 1.90 H new ATOM 0 HZ1 LYS A 16 -18.698 -5.724 -14.610 1.00 3.36 H new ATOM 0 HZ2 LYS A 16 -17.259 -5.016 -15.168 1.00 3.36 H new ATOM 0 HZ3 LYS A 16 -17.223 -6.547 -14.435 1.00 3.36 H new ATOM 286 N CYS A 17 -12.603 -0.613 -11.764 1.00 0.50 N ATOM 287 CA CYS A 17 -11.982 0.626 -12.201 1.00 0.52 C ATOM 288 C CYS A 17 -10.714 0.296 -12.979 1.00 0.50 C ATOM 289 O CYS A 17 -10.374 0.989 -13.936 1.00 0.56 O ATOM 290 CB CYS A 17 -11.662 1.506 -10.984 1.00 0.54 C ATOM 291 SG CYS A 17 -11.088 3.140 -11.527 1.00 0.88 S ATOM 0 H CYS A 17 -12.638 -0.716 -10.750 1.00 0.50 H new ATOM 0 HA CYS A 17 -12.664 1.177 -12.849 1.00 0.52 H new ATOM 0 HB2 CYS A 17 -12.549 1.613 -10.360 1.00 0.54 H new ATOM 0 HB3 CYS A 17 -10.897 1.029 -10.372 1.00 0.54 H new ATOM 0 HG CYS A 17 -10.550 3.041 -12.706 1.00 0.88 H new ATOM 297 N GLY A 18 -10.002 -0.752 -12.564 1.00 0.48 N ATOM 298 CA GLY A 18 -8.889 -1.277 -13.327 1.00 0.49 C ATOM 299 C GLY A 18 -7.814 -1.779 -12.386 1.00 0.42 C ATOM 300 O GLY A 18 -6.880 -1.045 -12.081 1.00 0.41 O ATOM 0 H GLY A 18 -10.185 -1.252 -11.694 1.00 0.48 H new ATOM 0 HA2 GLY A 18 -9.228 -2.088 -13.972 1.00 0.49 H new ATOM 0 HA3 GLY A 18 -8.483 -0.501 -13.977 1.00 0.49 H new ATOM 304 N MET A 19 -7.937 -3.034 -11.946 1.00 0.39 N ATOM 305 CA MET A 19 -6.929 -3.738 -11.157 1.00 0.31 C ATOM 306 C MET A 19 -5.604 -3.875 -11.898 1.00 0.31 C ATOM 307 O MET A 19 -5.299 -4.921 -12.465 1.00 0.35 O ATOM 308 CB MET A 19 -7.468 -5.109 -10.747 1.00 0.40 C ATOM 309 CG MET A 19 -7.848 -5.978 -11.952 1.00 0.89 C ATOM 310 SD MET A 19 -9.444 -6.825 -11.824 1.00 1.89 S ATOM 311 CE MET A 19 -9.926 -6.681 -13.565 1.00 2.96 C ATOM 0 H MET A 19 -8.763 -3.601 -12.135 1.00 0.39 H new ATOM 0 HA MET A 19 -6.725 -3.145 -10.266 1.00 0.31 H new ATOM 0 HB2 MET A 19 -6.716 -5.628 -10.152 1.00 0.40 H new ATOM 0 HB3 MET A 19 -8.342 -4.976 -10.110 1.00 0.40 H new ATOM 0 HG2 MET A 19 -7.859 -5.350 -12.843 1.00 0.89 H new ATOM 0 HG3 MET A 19 -7.069 -6.726 -12.099 1.00 0.89 H new ATOM 0 HE1 MET A 19 -10.900 -7.147 -13.713 1.00 2.96 H new ATOM 0 HE2 MET A 19 -9.982 -5.628 -13.841 1.00 2.96 H new ATOM 0 HE3 MET A 19 -9.186 -7.181 -14.190 1.00 2.96 H new ATOM 321 N LYS A 20 -4.829 -2.796 -11.920 1.00 0.30 N ATOM 322 CA LYS A 20 -3.551 -2.729 -12.597 1.00 0.31 C ATOM 323 C LYS A 20 -2.455 -2.656 -11.552 1.00 0.28 C ATOM 324 O LYS A 20 -1.842 -3.657 -11.196 1.00 0.37 O ATOM 325 CB LYS A 20 -3.613 -1.565 -13.596 1.00 0.36 C ATOM 326 CG LYS A 20 -3.015 -1.955 -14.942 1.00 1.04 C ATOM 327 CD LYS A 20 -3.709 -1.104 -16.001 1.00 1.55 C ATOM 328 CE LYS A 20 -2.973 -1.229 -17.336 1.00 1.72 C ATOM 329 NZ LYS A 20 -3.614 -0.416 -18.391 1.00 2.54 N ATOM 0 H LYS A 20 -5.084 -1.925 -11.454 1.00 0.30 H new ATOM 0 HA LYS A 20 -3.318 -3.615 -13.187 1.00 0.31 H new ATOM 0 HB2 LYS A 20 -4.649 -1.256 -13.733 1.00 0.36 H new ATOM 0 HB3 LYS A 20 -3.075 -0.708 -13.192 1.00 0.36 H new ATOM 0 HG2 LYS A 20 -1.939 -1.781 -14.951 1.00 1.04 H new ATOM 0 HG3 LYS A 20 -3.168 -3.016 -15.139 1.00 1.04 H new ATOM 0 HD2 LYS A 20 -4.745 -1.424 -16.116 1.00 1.55 H new ATOM 0 HD3 LYS A 20 -3.731 -0.061 -15.685 1.00 1.55 H new ATOM 0 HE2 LYS A 20 -1.937 -0.913 -17.212 1.00 1.72 H new ATOM 0 HE3 LYS A 20 -2.953 -2.274 -17.644 1.00 1.72 H new ATOM 0 HZ1 LYS A 20 -3.088 -0.526 -19.281 1.00 2.54 H new ATOM 0 HZ2 LYS A 20 -4.595 -0.734 -18.527 1.00 2.54 H new ATOM 0 HZ3 LYS A 20 -3.611 0.585 -18.108 1.00 2.54 H new ATOM 343 N ASN A 21 -2.299 -1.469 -10.973 1.00 0.28 N ATOM 344 CA ASN A 21 -1.321 -1.208 -9.932 1.00 0.26 C ATOM 345 C ASN A 21 -1.741 -1.820 -8.603 1.00 0.24 C ATOM 346 O ASN A 21 -1.002 -1.764 -7.625 1.00 0.22 O ATOM 347 CB ASN A 21 -1.125 0.300 -9.785 1.00 0.32 C ATOM 348 CG ASN A 21 -0.280 0.832 -10.943 1.00 0.50 C ATOM 349 OD1 ASN A 21 -0.201 0.196 -11.986 1.00 1.81 O ATOM 350 ND2 ASN A 21 0.320 2.007 -10.813 1.00 1.27 N ATOM 0 H ASN A 21 -2.858 -0.653 -11.220 1.00 0.28 H new ATOM 0 HA ASN A 21 -0.379 -1.673 -10.222 1.00 0.26 H new ATOM 0 HB2 ASN A 21 -2.093 0.801 -9.770 1.00 0.32 H new ATOM 0 HB3 ASN A 21 -0.637 0.521 -8.836 1.00 0.32 H new ATOM 0 HD21 ASN A 21 0.857 2.394 -11.589 1.00 1.27 H new ATOM 0 HD22 ASN A 21 0.244 2.524 -9.937 1.00 1.27 H new ATOM 357 N PHE A 22 -2.926 -2.412 -8.552 1.00 0.27 N ATOM 358 CA PHE A 22 -3.442 -3.100 -7.401 1.00 0.22 C ATOM 359 C PHE A 22 -4.091 -4.359 -7.955 1.00 0.27 C ATOM 360 O PHE A 22 -5.031 -4.285 -8.743 1.00 0.45 O ATOM 361 CB PHE A 22 -4.402 -2.170 -6.657 1.00 0.19 C ATOM 362 CG PHE A 22 -5.404 -1.431 -7.523 1.00 0.22 C ATOM 363 CD1 PHE A 22 -6.655 -2.002 -7.818 1.00 0.20 C ATOM 364 CD2 PHE A 22 -5.064 -0.176 -8.063 1.00 0.35 C ATOM 365 CE1 PHE A 22 -7.546 -1.322 -8.666 1.00 0.26 C ATOM 366 CE2 PHE A 22 -5.963 0.507 -8.898 1.00 0.42 C ATOM 367 CZ PHE A 22 -7.208 -0.069 -9.201 1.00 0.36 C ATOM 0 H PHE A 22 -3.569 -2.421 -9.344 1.00 0.27 H new ATOM 0 HA PHE A 22 -2.689 -3.381 -6.665 1.00 0.22 H new ATOM 0 HB2 PHE A 22 -4.950 -2.757 -5.920 1.00 0.19 H new ATOM 0 HB3 PHE A 22 -3.814 -1.436 -6.106 1.00 0.19 H new ATOM 0 HD1 PHE A 22 -6.929 -2.957 -7.395 1.00 0.20 H new ATOM 0 HD2 PHE A 22 -4.105 0.265 -7.833 1.00 0.35 H new ATOM 0 HE1 PHE A 22 -8.499 -1.768 -8.908 1.00 0.26 H new ATOM 0 HE2 PHE A 22 -5.698 1.471 -9.306 1.00 0.42 H new ATOM 0 HZ PHE A 22 -7.903 0.451 -9.844 1.00 0.36 H new ATOM 377 N ARG A 23 -3.545 -5.520 -7.603 1.00 0.23 N ATOM 378 CA ARG A 23 -4.021 -6.809 -8.081 1.00 0.28 C ATOM 379 C ARG A 23 -3.997 -7.759 -6.898 1.00 0.28 C ATOM 380 O ARG A 23 -3.644 -7.372 -5.789 1.00 0.27 O ATOM 381 CB ARG A 23 -3.136 -7.318 -9.240 1.00 0.41 C ATOM 382 CG ARG A 23 -3.517 -6.722 -10.604 1.00 0.89 C ATOM 383 CD ARG A 23 -4.066 -7.771 -11.585 1.00 1.32 C ATOM 384 NE ARG A 23 -5.293 -8.417 -11.088 1.00 2.59 N ATOM 385 CZ ARG A 23 -5.893 -9.451 -11.693 1.00 3.32 C ATOM 386 NH1 ARG A 23 -6.961 -10.024 -11.133 1.00 5.15 N ATOM 387 NH2 ARG A 23 -5.429 -9.918 -12.849 1.00 2.72 N ATOM 0 H ARG A 23 -2.749 -5.590 -6.969 1.00 0.23 H new ATOM 0 HA ARG A 23 -5.034 -6.732 -8.477 1.00 0.28 H new ATOM 0 HB2 ARG A 23 -2.095 -7.078 -9.025 1.00 0.41 H new ATOM 0 HB3 ARG A 23 -3.209 -8.404 -9.293 1.00 0.41 H new ATOM 0 HG2 ARG A 23 -4.265 -5.943 -10.458 1.00 0.89 H new ATOM 0 HG3 ARG A 23 -2.641 -6.245 -11.043 1.00 0.89 H new ATOM 0 HD2 ARG A 23 -4.272 -7.295 -12.544 1.00 1.32 H new ATOM 0 HD3 ARG A 23 -3.305 -8.531 -11.763 1.00 1.32 H new ATOM 0 HE ARG A 23 -5.711 -8.055 -10.231 1.00 2.59 H new ATOM 0 HH11 ARG A 23 -7.320 -9.675 -10.245 1.00 5.15 H new ATOM 0 HH12 ARG A 23 -7.418 -10.811 -11.594 1.00 5.15 H new ATOM 0 HH21 ARG A 23 -4.611 -9.489 -13.281 1.00 2.72 H new ATOM 0 HH22 ARG A 23 -5.891 -10.706 -13.303 1.00 2.72 H new ATOM 401 N ASN A 24 -4.424 -9.002 -7.113 1.00 0.30 N ATOM 402 CA ASN A 24 -4.646 -9.944 -6.027 1.00 0.28 C ATOM 403 C ASN A 24 -5.509 -9.314 -4.927 1.00 0.27 C ATOM 404 O ASN A 24 -5.333 -9.647 -3.762 1.00 0.29 O ATOM 405 CB ASN A 24 -3.291 -10.442 -5.495 1.00 0.29 C ATOM 406 CG ASN A 24 -3.404 -11.816 -4.852 1.00 0.39 C ATOM 407 OD1 ASN A 24 -3.224 -12.825 -5.515 1.00 1.36 O ATOM 408 ND2 ASN A 24 -3.727 -11.902 -3.572 1.00 1.28 N ATOM 0 H ASN A 24 -4.624 -9.379 -8.040 1.00 0.30 H new ATOM 0 HA ASN A 24 -5.199 -10.807 -6.399 1.00 0.28 H new ATOM 0 HB2 ASN A 24 -2.572 -10.482 -6.314 1.00 0.29 H new ATOM 0 HB3 ASN A 24 -2.904 -9.731 -4.766 1.00 0.29 H new ATOM 0 HD21 ASN A 24 -3.827 -12.817 -3.132 1.00 1.28 H new ATOM 0 HD22 ASN A 24 -3.876 -11.054 -3.025 1.00 1.28 H new ATOM 415 N ILE A 25 -6.437 -8.414 -5.274 1.00 0.27 N ATOM 416 CA ILE A 25 -7.425 -7.929 -4.321 1.00 0.24 C ATOM 417 C ILE A 25 -8.221 -9.158 -3.883 1.00 0.27 C ATOM 418 O ILE A 25 -8.771 -9.860 -4.733 1.00 0.33 O ATOM 419 CB ILE A 25 -8.314 -6.830 -4.964 1.00 0.22 C ATOM 420 CG1 ILE A 25 -7.749 -5.429 -4.669 1.00 0.29 C ATOM 421 CG2 ILE A 25 -9.758 -6.896 -4.451 1.00 0.31 C ATOM 422 CD1 ILE A 25 -8.572 -4.309 -5.299 1.00 0.26 C ATOM 0 H ILE A 25 -6.519 -8.011 -6.208 1.00 0.27 H new ATOM 0 HA ILE A 25 -6.966 -7.453 -3.455 1.00 0.24 H new ATOM 0 HB ILE A 25 -8.312 -7.012 -6.039 1.00 0.22 H new ATOM 0 HG12 ILE A 25 -7.708 -5.280 -3.590 1.00 0.29 H new ATOM 0 HG13 ILE A 25 -6.725 -5.371 -5.038 1.00 0.29 H new ATOM 0 HG21 ILE A 25 -10.348 -6.111 -4.924 1.00 0.31 H new ATOM 0 HG22 ILE A 25 -10.186 -7.869 -4.694 1.00 0.31 H new ATOM 0 HG23 ILE A 25 -9.767 -6.755 -3.370 1.00 0.31 H new ATOM 0 HD11 ILE A 25 -8.123 -3.346 -5.055 1.00 0.26 H new ATOM 0 HD12 ILE A 25 -8.592 -4.436 -6.381 1.00 0.26 H new ATOM 0 HD13 ILE A 25 -9.590 -4.343 -4.911 1.00 0.26 H new ATOM 434 N GLN A 26 -8.288 -9.414 -2.577 1.00 0.25 N ATOM 435 CA GLN A 26 -9.134 -10.445 -2.001 1.00 0.28 C ATOM 436 C GLN A 26 -9.709 -9.890 -0.703 1.00 0.27 C ATOM 437 O GLN A 26 -9.190 -8.920 -0.144 1.00 0.30 O ATOM 438 CB GLN A 26 -8.380 -11.763 -1.746 1.00 0.33 C ATOM 439 CG GLN A 26 -7.170 -11.948 -2.664 1.00 0.32 C ATOM 440 CD GLN A 26 -6.579 -13.345 -2.578 1.00 0.47 C ATOM 441 OE1 GLN A 26 -6.441 -13.914 -1.506 1.00 1.62 O ATOM 442 NE2 GLN A 26 -6.159 -13.904 -3.705 1.00 1.41 N ATOM 0 H GLN A 26 -7.745 -8.900 -1.883 1.00 0.25 H new ATOM 0 HA GLN A 26 -9.926 -10.693 -2.708 1.00 0.28 H new ATOM 0 HB2 GLN A 26 -8.049 -11.790 -0.708 1.00 0.33 H new ATOM 0 HB3 GLN A 26 -9.065 -12.599 -1.884 1.00 0.33 H new ATOM 0 HG2 GLN A 26 -7.465 -11.745 -3.693 1.00 0.32 H new ATOM 0 HG3 GLN A 26 -6.405 -11.217 -2.402 1.00 0.32 H new ATOM 0 HE21 GLN A 26 -6.281 -13.416 -4.593 1.00 1.41 H new ATOM 0 HE22 GLN A 26 -5.714 -14.821 -3.684 1.00 1.41 H new ATOM 451 N VAL A 27 -10.776 -10.516 -0.220 1.00 0.29 N ATOM 452 CA VAL A 27 -11.487 -10.097 0.969 1.00 0.31 C ATOM 453 C VAL A 27 -11.872 -11.393 1.682 1.00 0.42 C ATOM 454 O VAL A 27 -12.200 -12.370 1.009 1.00 0.57 O ATOM 455 CB VAL A 27 -12.664 -9.206 0.523 1.00 0.34 C ATOM 456 CG1 VAL A 27 -13.868 -9.990 -0.012 1.00 0.55 C ATOM 457 CG2 VAL A 27 -13.114 -8.282 1.647 1.00 0.37 C ATOM 0 H VAL A 27 -11.175 -11.346 -0.658 1.00 0.29 H new ATOM 0 HA VAL A 27 -10.917 -9.488 1.670 1.00 0.31 H new ATOM 0 HB VAL A 27 -12.275 -8.616 -0.307 1.00 0.34 H new ATOM 0 HG11 VAL A 27 -14.654 -9.294 -0.305 1.00 0.55 H new ATOM 0 HG12 VAL A 27 -13.563 -10.579 -0.877 1.00 0.55 H new ATOM 0 HG13 VAL A 27 -14.244 -10.655 0.766 1.00 0.55 H new ATOM 0 HG21 VAL A 27 -13.945 -7.667 1.302 1.00 0.37 H new ATOM 0 HG22 VAL A 27 -13.434 -8.878 2.502 1.00 0.37 H new ATOM 0 HG23 VAL A 27 -12.285 -7.639 1.943 1.00 0.37 H new ATOM 467 N ASP A 28 -11.742 -11.455 3.006 1.00 0.41 N ATOM 468 CA ASP A 28 -12.097 -12.673 3.732 1.00 0.54 C ATOM 469 C ASP A 28 -13.622 -12.782 3.810 1.00 0.55 C ATOM 470 O ASP A 28 -14.316 -11.786 3.628 1.00 0.49 O ATOM 471 CB ASP A 28 -11.449 -12.644 5.116 1.00 0.59 C ATOM 472 CG ASP A 28 -11.561 -13.999 5.799 1.00 0.78 C ATOM 473 OD1 ASP A 28 -12.564 -14.198 6.520 1.00 1.07 O ATOM 474 OD2 ASP A 28 -10.656 -14.828 5.569 1.00 1.58 O ATOM 0 H ASP A 28 -11.400 -10.691 3.589 1.00 0.41 H new ATOM 0 HA ASP A 28 -11.725 -13.556 3.212 1.00 0.54 H new ATOM 0 HB2 ASP A 28 -10.399 -12.365 5.024 1.00 0.59 H new ATOM 0 HB3 ASP A 28 -11.929 -11.882 5.730 1.00 0.59 H new ATOM 479 N GLU A 29 -14.171 -13.970 4.062 1.00 0.71 N ATOM 480 CA GLU A 29 -15.615 -14.111 4.219 1.00 0.80 C ATOM 481 C GLU A 29 -16.041 -13.576 5.583 1.00 0.75 C ATOM 482 O GLU A 29 -16.970 -12.777 5.686 1.00 0.77 O ATOM 483 CB GLU A 29 -16.037 -15.578 4.077 1.00 1.02 C ATOM 484 CG GLU A 29 -16.156 -15.972 2.602 1.00 1.90 C ATOM 485 CD GLU A 29 -16.665 -17.407 2.458 1.00 2.30 C ATOM 486 OE1 GLU A 29 -17.899 -17.587 2.559 1.00 2.55 O ATOM 487 OE2 GLU A 29 -15.816 -18.302 2.259 1.00 3.29 O ATOM 0 H GLU A 29 -13.644 -14.838 4.161 1.00 0.71 H new ATOM 0 HA GLU A 29 -16.107 -13.535 3.435 1.00 0.80 H new ATOM 0 HB2 GLU A 29 -15.308 -16.220 4.571 1.00 1.02 H new ATOM 0 HB3 GLU A 29 -16.992 -15.736 4.578 1.00 1.02 H new ATOM 0 HG2 GLU A 29 -16.835 -15.288 2.093 1.00 1.90 H new ATOM 0 HG3 GLU A 29 -15.185 -15.876 2.117 1.00 1.90 H new ATOM 494 N ALA A 30 -15.382 -14.045 6.641 1.00 0.73 N ATOM 495 CA ALA A 30 -15.703 -13.640 7.997 1.00 0.72 C ATOM 496 C ALA A 30 -15.156 -12.238 8.228 1.00 0.52 C ATOM 497 O ALA A 30 -15.892 -11.297 8.520 1.00 0.56 O ATOM 498 CB ALA A 30 -15.095 -14.637 8.992 1.00 0.82 C ATOM 0 H ALA A 30 -14.614 -14.714 6.577 1.00 0.73 H new ATOM 0 HA ALA A 30 -16.783 -13.631 8.145 1.00 0.72 H new ATOM 0 HB1 ALA A 30 -15.338 -14.330 10.009 1.00 0.82 H new ATOM 0 HB2 ALA A 30 -15.502 -15.631 8.806 1.00 0.82 H new ATOM 0 HB3 ALA A 30 -14.012 -14.660 8.869 1.00 0.82 H new ATOM 504 N ASN A 31 -13.841 -12.090 8.096 1.00 0.42 N ATOM 505 CA ASN A 31 -13.165 -10.828 8.331 1.00 0.30 C ATOM 506 C ASN A 31 -13.138 -10.009 7.038 1.00 0.27 C ATOM 507 O ASN A 31 -12.081 -9.535 6.630 1.00 0.30 O ATOM 508 CB ASN A 31 -11.755 -11.121 8.856 1.00 0.42 C ATOM 509 CG ASN A 31 -11.021 -9.845 9.249 1.00 1.44 C ATOM 510 OD1 ASN A 31 -11.619 -8.783 9.415 1.00 2.35 O ATOM 511 ND2 ASN A 31 -9.707 -9.923 9.401 1.00 2.18 N ATOM 0 H ASN A 31 -13.216 -12.848 7.822 1.00 0.42 H new ATOM 0 HA ASN A 31 -13.695 -10.237 9.078 1.00 0.30 H new ATOM 0 HB2 ASN A 31 -11.819 -11.784 9.719 1.00 0.42 H new ATOM 0 HB3 ASN A 31 -11.184 -11.648 8.091 1.00 0.42 H new ATOM 0 HD21 ASN A 31 -9.173 -9.093 9.660 1.00 2.18 H new ATOM 0 HD22 ASN A 31 -9.229 -10.813 9.259 1.00 2.18 H new ATOM 518 N LEU A 32 -14.287 -9.832 6.376 1.00 0.26 N ATOM 519 CA LEU A 32 -14.331 -9.117 5.096 1.00 0.30 C ATOM 520 C LEU A 32 -13.944 -7.647 5.269 1.00 0.29 C ATOM 521 O LEU A 32 -13.508 -6.979 4.338 1.00 0.34 O ATOM 522 CB LEU A 32 -15.687 -9.339 4.387 1.00 0.40 C ATOM 523 CG LEU A 32 -16.723 -8.202 4.433 1.00 0.41 C ATOM 524 CD1 LEU A 32 -16.579 -7.217 3.264 1.00 0.61 C ATOM 525 CD2 LEU A 32 -18.123 -8.812 4.312 1.00 0.47 C ATOM 0 H LEU A 32 -15.192 -10.171 6.702 1.00 0.26 H new ATOM 0 HA LEU A 32 -13.578 -9.535 4.428 1.00 0.30 H new ATOM 0 HB2 LEU A 32 -15.483 -9.562 3.340 1.00 0.40 H new ATOM 0 HB3 LEU A 32 -16.148 -10.228 4.819 1.00 0.40 H new ATOM 0 HG LEU A 32 -16.565 -7.668 5.370 1.00 0.41 H new ATOM 0 HD11 LEU A 32 -17.336 -6.437 3.350 1.00 0.61 H new ATOM 0 HD12 LEU A 32 -15.588 -6.765 3.289 1.00 0.61 H new ATOM 0 HD13 LEU A 32 -16.711 -7.749 2.322 1.00 0.61 H new ATOM 0 HD21 LEU A 32 -18.870 -8.018 4.343 1.00 0.47 H new ATOM 0 HD22 LEU A 32 -18.205 -9.351 3.368 1.00 0.47 H new ATOM 0 HD23 LEU A 32 -18.292 -9.502 5.139 1.00 0.47 H new ATOM 537 N LEU A 33 -14.080 -7.138 6.492 1.00 0.26 N ATOM 538 CA LEU A 33 -13.615 -5.820 6.891 1.00 0.27 C ATOM 539 C LEU A 33 -12.133 -5.636 6.572 1.00 0.31 C ATOM 540 O LEU A 33 -11.702 -4.542 6.214 1.00 0.64 O ATOM 541 CB LEU A 33 -13.896 -5.658 8.390 1.00 0.29 C ATOM 542 CG LEU A 33 -15.399 -5.487 8.632 1.00 0.39 C ATOM 543 CD1 LEU A 33 -15.745 -5.546 10.110 1.00 0.50 C ATOM 544 CD2 LEU A 33 -15.897 -4.136 8.127 1.00 0.45 C ATOM 0 H LEU A 33 -14.530 -7.649 7.251 1.00 0.26 H new ATOM 0 HA LEU A 33 -14.144 -5.049 6.331 1.00 0.27 H new ATOM 0 HB2 LEU A 33 -13.530 -6.530 8.932 1.00 0.29 H new ATOM 0 HB3 LEU A 33 -13.357 -4.793 8.777 1.00 0.29 H new ATOM 0 HG LEU A 33 -15.875 -6.306 8.093 1.00 0.39 H new ATOM 0 HD11 LEU A 33 -16.820 -5.420 10.237 1.00 0.50 H new ATOM 0 HD12 LEU A 33 -15.442 -6.511 10.516 1.00 0.50 H new ATOM 0 HD13 LEU A 33 -15.222 -4.749 10.638 1.00 0.50 H new ATOM 0 HD21 LEU A 33 -16.967 -4.049 8.315 1.00 0.45 H new ATOM 0 HD22 LEU A 33 -15.371 -3.336 8.648 1.00 0.45 H new ATOM 0 HD23 LEU A 33 -15.709 -4.056 7.056 1.00 0.45 H new ATOM 556 N THR A 34 -11.334 -6.691 6.703 1.00 0.22 N ATOM 557 CA THR A 34 -9.929 -6.623 6.362 1.00 0.20 C ATOM 558 C THR A 34 -9.713 -7.037 4.913 1.00 0.19 C ATOM 559 O THR A 34 -10.359 -7.940 4.384 1.00 0.22 O ATOM 560 CB THR A 34 -9.138 -7.513 7.321 1.00 0.24 C ATOM 561 OG1 THR A 34 -9.423 -7.124 8.651 1.00 0.34 O ATOM 562 CG2 THR A 34 -7.632 -7.373 7.112 1.00 0.24 C ATOM 0 H THR A 34 -11.642 -7.602 7.044 1.00 0.22 H new ATOM 0 HA THR A 34 -9.574 -5.597 6.463 1.00 0.20 H new ATOM 0 HB THR A 34 -9.429 -8.546 7.129 1.00 0.24 H new ATOM 0 HG1 THR A 34 -10.259 -7.544 8.942 1.00 0.34 H new ATOM 0 HG21 THR A 34 -7.106 -8.021 7.812 1.00 0.24 H new ATOM 0 HG22 THR A 34 -7.378 -7.659 6.091 1.00 0.24 H new ATOM 0 HG23 THR A 34 -7.336 -6.338 7.283 1.00 0.24 H new ATOM 570 N TRP A 35 -8.765 -6.353 4.279 1.00 0.15 N ATOM 571 CA TRP A 35 -8.440 -6.519 2.877 1.00 0.13 C ATOM 572 C TRP A 35 -7.024 -7.041 2.768 1.00 0.13 C ATOM 573 O TRP A 35 -6.180 -6.763 3.622 1.00 0.15 O ATOM 574 CB TRP A 35 -8.479 -5.170 2.169 1.00 0.13 C ATOM 575 CG TRP A 35 -9.800 -4.496 2.056 1.00 0.14 C ATOM 576 CD1 TRP A 35 -10.676 -4.282 3.060 1.00 0.19 C ATOM 577 CD2 TRP A 35 -10.377 -3.870 0.879 1.00 0.17 C ATOM 578 NE1 TRP A 35 -11.776 -3.618 2.579 1.00 0.20 N ATOM 579 CE2 TRP A 35 -11.642 -3.313 1.237 1.00 0.17 C ATOM 580 CE3 TRP A 35 -9.929 -3.683 -0.445 1.00 0.24 C ATOM 581 CZ2 TRP A 35 -12.422 -2.608 0.310 1.00 0.20 C ATOM 582 CZ3 TRP A 35 -10.705 -2.979 -1.379 1.00 0.28 C ATOM 583 CH2 TRP A 35 -11.949 -2.444 -1.004 1.00 0.24 C ATOM 0 H TRP A 35 -8.190 -5.651 4.744 1.00 0.15 H new ATOM 0 HA TRP A 35 -9.158 -7.204 2.426 1.00 0.13 H new ATOM 0 HB2 TRP A 35 -7.800 -4.496 2.691 1.00 0.13 H new ATOM 0 HB3 TRP A 35 -8.083 -5.306 1.163 1.00 0.13 H new ATOM 0 HD1 TRP A 35 -10.533 -4.587 4.086 1.00 0.19 H new ATOM 0 HE1 TRP A 35 -12.592 -3.379 3.142 1.00 0.20 H new ATOM 0 HE3 TRP A 35 -8.974 -4.088 -0.745 1.00 0.24 H new ATOM 0 HZ2 TRP A 35 -13.376 -2.195 0.602 1.00 0.20 H new ATOM 0 HZ3 TRP A 35 -10.345 -2.848 -2.389 1.00 0.28 H new ATOM 0 HH2 TRP A 35 -12.544 -1.905 -1.727 1.00 0.24 H new ATOM 594 N GLN A 36 -6.737 -7.726 1.669 1.00 0.18 N ATOM 595 CA GLN A 36 -5.406 -8.210 1.394 1.00 0.26 C ATOM 596 C GLN A 36 -5.194 -8.161 -0.109 1.00 0.35 C ATOM 597 O GLN A 36 -6.128 -8.390 -0.875 1.00 0.53 O ATOM 598 CB GLN A 36 -5.259 -9.634 1.943 1.00 0.35 C ATOM 599 CG GLN A 36 -6.466 -10.522 1.594 1.00 0.51 C ATOM 600 CD GLN A 36 -6.202 -11.990 1.905 1.00 0.73 C ATOM 601 OE1 GLN A 36 -5.088 -12.471 1.728 1.00 1.43 O ATOM 602 NE2 GLN A 36 -7.211 -12.724 2.358 1.00 1.07 N ATOM 0 H GLN A 36 -7.423 -7.957 0.950 1.00 0.18 H new ATOM 0 HA GLN A 36 -4.650 -7.593 1.879 1.00 0.26 H new ATOM 0 HB2 GLN A 36 -4.351 -10.084 1.541 1.00 0.35 H new ATOM 0 HB3 GLN A 36 -5.142 -9.593 3.026 1.00 0.35 H new ATOM 0 HG2 GLN A 36 -7.339 -10.184 2.153 1.00 0.51 H new ATOM 0 HG3 GLN A 36 -6.703 -10.412 0.536 1.00 0.51 H new ATOM 0 HE21 GLN A 36 -8.128 -12.300 2.497 1.00 1.07 H new ATOM 0 HE22 GLN A 36 -7.069 -13.712 2.567 1.00 1.07 H new ATOM 611 N GLY A 37 -3.971 -7.879 -0.540 1.00 0.27 N ATOM 612 CA GLY A 37 -3.628 -8.034 -1.938 1.00 0.25 C ATOM 613 C GLY A 37 -2.193 -7.616 -2.159 1.00 0.22 C ATOM 614 O GLY A 37 -1.413 -7.571 -1.214 1.00 0.25 O ATOM 0 H GLY A 37 -3.212 -7.546 0.054 1.00 0.27 H new ATOM 0 HA2 GLY A 37 -3.766 -9.071 -2.244 1.00 0.25 H new ATOM 0 HA3 GLY A 37 -4.292 -7.429 -2.555 1.00 0.25 H new ATOM 618 N LEU A 38 -1.832 -7.304 -3.398 1.00 0.22 N ATOM 619 CA LEU A 38 -0.531 -6.743 -3.689 1.00 0.22 C ATOM 620 C LEU A 38 -0.731 -5.495 -4.521 1.00 0.22 C ATOM 621 O LEU A 38 -1.788 -5.282 -5.117 1.00 0.26 O ATOM 622 CB LEU A 38 0.412 -7.786 -4.319 1.00 0.24 C ATOM 623 CG LEU A 38 -0.002 -8.380 -5.679 1.00 0.25 C ATOM 624 CD1 LEU A 38 0.141 -7.385 -6.835 1.00 0.29 C ATOM 625 CD2 LEU A 38 0.909 -9.567 -6.006 1.00 0.35 C ATOM 0 H LEU A 38 -2.429 -7.433 -4.215 1.00 0.22 H new ATOM 0 HA LEU A 38 -0.022 -6.452 -2.770 1.00 0.22 H new ATOM 0 HB2 LEU A 38 1.394 -7.327 -4.436 1.00 0.24 H new ATOM 0 HB3 LEU A 38 0.527 -8.608 -3.612 1.00 0.24 H new ATOM 0 HG LEU A 38 -1.050 -8.665 -5.585 1.00 0.25 H new ATOM 0 HD11 LEU A 38 -0.166 -7.862 -7.766 1.00 0.29 H new ATOM 0 HD12 LEU A 38 -0.490 -6.516 -6.648 1.00 0.29 H new ATOM 0 HD13 LEU A 38 1.181 -7.068 -6.915 1.00 0.29 H new ATOM 0 HD21 LEU A 38 0.621 -9.992 -6.968 1.00 0.35 H new ATOM 0 HD22 LEU A 38 1.944 -9.229 -6.054 1.00 0.35 H new ATOM 0 HD23 LEU A 38 0.811 -10.326 -5.230 1.00 0.35 H new ATOM 637 N ILE A 39 0.299 -4.668 -4.563 1.00 0.21 N ATOM 638 CA ILE A 39 0.304 -3.488 -5.391 1.00 0.21 C ATOM 639 C ILE A 39 1.514 -3.624 -6.297 1.00 0.24 C ATOM 640 O ILE A 39 2.617 -3.909 -5.828 1.00 0.25 O ATOM 641 CB ILE A 39 0.240 -2.210 -4.534 1.00 0.19 C ATOM 642 CG1 ILE A 39 1.232 -2.230 -3.354 1.00 0.19 C ATOM 643 CG2 ILE A 39 -1.196 -2.064 -4.003 1.00 0.18 C ATOM 644 CD1 ILE A 39 1.122 -0.976 -2.485 1.00 0.18 C ATOM 0 H ILE A 39 1.153 -4.801 -4.021 1.00 0.21 H new ATOM 0 HA ILE A 39 -0.582 -3.396 -6.020 1.00 0.21 H new ATOM 0 HB ILE A 39 0.521 -1.364 -5.161 1.00 0.19 H new ATOM 0 HG12 ILE A 39 1.047 -3.112 -2.741 1.00 0.19 H new ATOM 0 HG13 ILE A 39 2.249 -2.316 -3.738 1.00 0.19 H new ATOM 0 HG21 ILE A 39 -1.268 -1.165 -3.392 1.00 0.18 H new ATOM 0 HG22 ILE A 39 -1.888 -1.989 -4.842 1.00 0.18 H new ATOM 0 HG23 ILE A 39 -1.451 -2.935 -3.399 1.00 0.18 H new ATOM 0 HD11 ILE A 39 1.840 -1.036 -1.667 1.00 0.18 H new ATOM 0 HD12 ILE A 39 1.334 -0.094 -3.090 1.00 0.18 H new ATOM 0 HD13 ILE A 39 0.114 -0.903 -2.078 1.00 0.18 H new ATOM 656 N VAL A 40 1.264 -3.531 -7.602 1.00 0.33 N ATOM 657 CA VAL A 40 2.257 -3.610 -8.651 1.00 0.36 C ATOM 658 C VAL A 40 2.633 -2.162 -8.961 1.00 0.38 C ATOM 659 O VAL A 40 1.799 -1.410 -9.459 1.00 0.44 O ATOM 660 CB VAL A 40 1.672 -4.314 -9.891 1.00 0.32 C ATOM 661 CG1 VAL A 40 2.786 -4.639 -10.887 1.00 0.37 C ATOM 662 CG2 VAL A 40 0.980 -5.635 -9.533 1.00 0.40 C ATOM 0 H VAL A 40 0.320 -3.393 -7.964 1.00 0.33 H new ATOM 0 HA VAL A 40 3.129 -4.190 -8.351 1.00 0.36 H new ATOM 0 HB VAL A 40 0.942 -3.628 -10.321 1.00 0.32 H new ATOM 0 HG11 VAL A 40 2.361 -5.136 -11.759 1.00 0.37 H new ATOM 0 HG12 VAL A 40 3.276 -3.717 -11.198 1.00 0.37 H new ATOM 0 HG13 VAL A 40 3.516 -5.296 -10.415 1.00 0.37 H new ATOM 0 HG21 VAL A 40 0.583 -6.095 -10.438 1.00 0.40 H new ATOM 0 HG22 VAL A 40 1.700 -6.309 -9.069 1.00 0.40 H new ATOM 0 HG23 VAL A 40 0.164 -5.441 -8.837 1.00 0.40 H new ATOM 672 N PRO A 41 3.838 -1.722 -8.599 1.00 0.49 N ATOM 673 CA PRO A 41 4.298 -0.392 -8.939 1.00 0.55 C ATOM 674 C PRO A 41 4.757 -0.319 -10.395 1.00 0.45 C ATOM 675 O PRO A 41 4.764 -1.325 -11.100 1.00 0.45 O ATOM 676 CB PRO A 41 5.455 -0.124 -7.988 1.00 0.77 C ATOM 677 CG PRO A 41 5.937 -1.494 -7.505 1.00 0.75 C ATOM 678 CD PRO A 41 4.813 -2.468 -7.832 1.00 0.66 C ATOM 0 HA PRO A 41 3.505 0.349 -8.840 1.00 0.55 H new ATOM 0 HB2 PRO A 41 6.257 0.415 -8.493 1.00 0.77 H new ATOM 0 HB3 PRO A 41 5.134 0.494 -7.149 1.00 0.77 H new ATOM 0 HG2 PRO A 41 6.862 -1.782 -8.005 1.00 0.75 H new ATOM 0 HG3 PRO A 41 6.144 -1.481 -6.435 1.00 0.75 H new ATOM 0 HD2 PRO A 41 5.189 -3.318 -8.402 1.00 0.66 H new ATOM 0 HD3 PRO A 41 4.368 -2.868 -6.921 1.00 0.66 H new ATOM 686 N ASP A 42 5.193 0.874 -10.804 1.00 0.48 N ATOM 687 CA ASP A 42 5.779 1.132 -12.115 1.00 0.46 C ATOM 688 C ASP A 42 7.247 1.529 -11.930 1.00 0.37 C ATOM 689 O ASP A 42 8.135 0.955 -12.548 1.00 0.33 O ATOM 690 CB ASP A 42 5.029 2.257 -12.848 1.00 0.66 C ATOM 691 CG ASP A 42 3.513 2.060 -12.907 1.00 1.17 C ATOM 692 OD1 ASP A 42 3.045 1.414 -13.867 1.00 1.44 O ATOM 693 OD2 ASP A 42 2.837 2.603 -11.999 1.00 2.17 O ATOM 0 H ASP A 42 5.146 1.706 -10.216 1.00 0.48 H new ATOM 0 HA ASP A 42 5.702 0.227 -12.718 1.00 0.46 H new ATOM 0 HB2 ASP A 42 5.243 3.204 -12.353 1.00 0.66 H new ATOM 0 HB3 ASP A 42 5.415 2.334 -13.865 1.00 0.66 H new ATOM 698 N ASN A 43 7.501 2.542 -11.093 1.00 0.39 N ATOM 699 CA ASN A 43 8.838 3.116 -10.902 1.00 0.38 C ATOM 700 C ASN A 43 9.831 2.128 -10.278 1.00 0.33 C ATOM 701 O ASN A 43 10.855 1.828 -10.887 1.00 0.38 O ATOM 702 CB ASN A 43 8.770 4.408 -10.070 1.00 0.46 C ATOM 703 CG ASN A 43 9.155 5.635 -10.883 1.00 0.58 C ATOM 704 OD1 ASN A 43 10.293 5.759 -11.319 1.00 0.69 O ATOM 705 ND2 ASN A 43 8.230 6.558 -11.098 1.00 0.81 N ATOM 0 H ASN A 43 6.780 2.989 -10.526 1.00 0.39 H new ATOM 0 HA ASN A 43 9.213 3.354 -11.898 1.00 0.38 H new ATOM 0 HB2 ASN A 43 7.760 4.535 -9.680 1.00 0.46 H new ATOM 0 HB3 ASN A 43 9.435 4.320 -9.211 1.00 0.46 H new ATOM 0 HD21 ASN A 43 8.459 7.394 -11.636 1.00 0.81 H new ATOM 0 HD22 ASN A 43 7.289 6.433 -10.725 1.00 0.81 H new ATOM 712 N PRO A 44 9.614 1.663 -9.037 1.00 0.33 N ATOM 713 CA PRO A 44 10.512 0.710 -8.410 1.00 0.35 C ATOM 714 C PRO A 44 10.393 -0.648 -9.108 1.00 0.37 C ATOM 715 O PRO A 44 9.385 -0.939 -9.751 1.00 0.38 O ATOM 716 CB PRO A 44 10.068 0.641 -6.946 1.00 0.37 C ATOM 717 CG PRO A 44 8.571 0.875 -7.085 1.00 0.32 C ATOM 718 CD PRO A 44 8.522 1.980 -8.138 1.00 0.38 C ATOM 0 HA PRO A 44 11.560 1.002 -8.483 1.00 0.35 H new ATOM 0 HB2 PRO A 44 10.294 -0.324 -6.492 1.00 0.37 H new ATOM 0 HB3 PRO A 44 10.549 1.403 -6.333 1.00 0.37 H new ATOM 0 HG2 PRO A 44 8.046 -0.023 -7.410 1.00 0.32 H new ATOM 0 HG3 PRO A 44 8.117 1.187 -6.144 1.00 0.32 H new ATOM 0 HD2 PRO A 44 7.566 1.990 -8.661 1.00 0.38 H new ATOM 0 HD3 PRO A 44 8.649 2.965 -7.688 1.00 0.38 H new ATOM 726 N PRO A 45 11.406 -1.505 -8.946 1.00 0.42 N ATOM 727 CA PRO A 45 11.517 -2.781 -9.628 1.00 0.49 C ATOM 728 C PRO A 45 10.329 -3.686 -9.312 1.00 0.62 C ATOM 729 O PRO A 45 10.268 -4.273 -8.229 1.00 1.17 O ATOM 730 CB PRO A 45 12.850 -3.383 -9.196 1.00 0.61 C ATOM 731 CG PRO A 45 13.167 -2.641 -7.910 1.00 0.57 C ATOM 732 CD PRO A 45 12.567 -1.264 -8.127 1.00 0.47 C ATOM 0 HA PRO A 45 11.495 -2.659 -10.711 1.00 0.49 H new ATOM 0 HB2 PRO A 45 12.772 -4.458 -9.032 1.00 0.61 H new ATOM 0 HB3 PRO A 45 13.623 -3.231 -9.949 1.00 0.61 H new ATOM 0 HG2 PRO A 45 12.728 -3.136 -7.044 1.00 0.57 H new ATOM 0 HG3 PRO A 45 14.241 -2.586 -7.735 1.00 0.57 H new ATOM 0 HD2 PRO A 45 12.296 -0.795 -7.181 1.00 0.47 H new ATOM 0 HD3 PRO A 45 13.272 -0.597 -8.623 1.00 0.47 H new ATOM 740 N TYR A 46 9.424 -3.813 -10.286 1.00 0.33 N ATOM 741 CA TYR A 46 8.221 -4.631 -10.204 1.00 0.36 C ATOM 742 C TYR A 46 8.312 -5.864 -11.109 1.00 0.40 C ATOM 743 O TYR A 46 7.538 -6.806 -10.970 1.00 0.76 O ATOM 744 CB TYR A 46 6.988 -3.791 -10.545 1.00 0.42 C ATOM 745 CG TYR A 46 6.862 -3.400 -12.002 1.00 0.52 C ATOM 746 CD1 TYR A 46 7.491 -2.235 -12.479 1.00 2.40 C ATOM 747 CD2 TYR A 46 6.083 -4.186 -12.871 1.00 1.81 C ATOM 748 CE1 TYR A 46 7.341 -1.857 -13.823 1.00 2.64 C ATOM 749 CE2 TYR A 46 5.920 -3.807 -14.215 1.00 1.79 C ATOM 750 CZ TYR A 46 6.549 -2.634 -14.695 1.00 1.17 C ATOM 751 OH TYR A 46 6.381 -2.236 -15.988 1.00 1.54 O ATOM 0 H TYR A 46 9.516 -3.332 -11.181 1.00 0.33 H new ATOM 0 HA TYR A 46 8.128 -4.991 -9.179 1.00 0.36 H new ATOM 0 HB2 TYR A 46 6.097 -4.348 -10.256 1.00 0.42 H new ATOM 0 HB3 TYR A 46 7.007 -2.884 -9.941 1.00 0.42 H new ATOM 0 HD1 TYR A 46 8.089 -1.632 -11.812 1.00 2.40 H new ATOM 0 HD2 TYR A 46 5.608 -5.084 -12.504 1.00 1.81 H new ATOM 0 HE1 TYR A 46 7.833 -0.969 -14.191 1.00 2.64 H new ATOM 0 HE2 TYR A 46 5.317 -4.409 -14.879 1.00 1.79 H new ATOM 0 HH TYR A 46 5.810 -2.880 -16.457 1.00 1.54 H new ATOM 761 N ASP A 47 9.267 -5.900 -12.039 1.00 0.34 N ATOM 762 CA ASP A 47 9.466 -7.064 -12.896 1.00 0.36 C ATOM 763 C ASP A 47 9.812 -8.299 -12.067 1.00 0.37 C ATOM 764 O ASP A 47 9.415 -9.412 -12.403 1.00 0.54 O ATOM 765 CB ASP A 47 10.586 -6.782 -13.901 1.00 0.40 C ATOM 766 CG ASP A 47 10.139 -5.769 -14.940 1.00 1.40 C ATOM 767 OD1 ASP A 47 10.263 -4.569 -14.610 1.00 2.88 O ATOM 768 OD2 ASP A 47 9.685 -6.212 -16.016 1.00 2.08 O ATOM 0 H ASP A 47 9.915 -5.133 -12.216 1.00 0.34 H new ATOM 0 HA ASP A 47 8.537 -7.260 -13.432 1.00 0.36 H new ATOM 0 HB2 ASP A 47 11.465 -6.407 -13.376 1.00 0.40 H new ATOM 0 HB3 ASP A 47 10.880 -7.709 -14.394 1.00 0.40 H new ATOM 773 N LYS A 48 10.587 -8.118 -10.993 1.00 0.27 N ATOM 774 CA LYS A 48 11.142 -9.238 -10.237 1.00 0.29 C ATOM 775 C LYS A 48 10.198 -9.686 -9.117 1.00 0.31 C ATOM 776 O LYS A 48 10.449 -10.715 -8.496 1.00 0.41 O ATOM 777 CB LYS A 48 12.545 -8.892 -9.688 1.00 0.47 C ATOM 778 CG LYS A 48 13.655 -8.919 -10.759 1.00 0.65 C ATOM 779 CD LYS A 48 13.613 -7.716 -11.710 1.00 1.00 C ATOM 780 CE LYS A 48 14.640 -7.765 -12.846 1.00 1.26 C ATOM 781 NZ LYS A 48 16.018 -7.951 -12.357 1.00 1.85 N ATOM 0 H LYS A 48 10.843 -7.200 -10.629 1.00 0.27 H new ATOM 0 HA LYS A 48 11.249 -10.079 -10.922 1.00 0.29 H new ATOM 0 HB2 LYS A 48 12.514 -7.901 -9.235 1.00 0.47 H new ATOM 0 HB3 LYS A 48 12.799 -9.597 -8.896 1.00 0.47 H new ATOM 0 HG2 LYS A 48 14.626 -8.948 -10.265 1.00 0.65 H new ATOM 0 HG3 LYS A 48 13.566 -9.836 -11.341 1.00 0.65 H new ATOM 0 HD2 LYS A 48 12.615 -7.646 -12.143 1.00 1.00 H new ATOM 0 HD3 LYS A 48 13.774 -6.806 -11.131 1.00 1.00 H new ATOM 0 HE2 LYS A 48 14.386 -8.579 -13.525 1.00 1.26 H new ATOM 0 HE3 LYS A 48 14.584 -6.841 -13.421 1.00 1.26 H new ATOM 0 HZ1 LYS A 48 16.651 -8.130 -13.163 1.00 1.85 H new ATOM 0 HZ2 LYS A 48 16.328 -7.093 -11.857 1.00 1.85 H new ATOM 0 HZ3 LYS A 48 16.049 -8.762 -11.706 1.00 1.85 H new ATOM 795 N GLY A 49 9.134 -8.933 -8.830 1.00 0.35 N ATOM 796 CA GLY A 49 8.270 -9.165 -7.681 1.00 0.47 C ATOM 797 C GLY A 49 7.453 -7.900 -7.422 1.00 0.45 C ATOM 798 O GLY A 49 7.443 -6.997 -8.247 1.00 0.50 O ATOM 0 H GLY A 49 8.849 -8.136 -9.399 1.00 0.35 H new ATOM 0 HA2 GLY A 49 7.608 -10.011 -7.870 1.00 0.47 H new ATOM 0 HA3 GLY A 49 8.866 -9.416 -6.804 1.00 0.47 H new ATOM 802 N ALA A 50 6.768 -7.810 -6.290 1.00 0.43 N ATOM 803 CA ALA A 50 5.894 -6.701 -5.955 1.00 0.47 C ATOM 804 C ALA A 50 5.856 -6.588 -4.439 1.00 0.37 C ATOM 805 O ALA A 50 6.773 -7.042 -3.757 1.00 0.41 O ATOM 806 CB ALA A 50 4.497 -6.967 -6.528 1.00 0.52 C ATOM 0 H ALA A 50 6.808 -8.525 -5.564 1.00 0.43 H new ATOM 0 HA ALA A 50 6.256 -5.765 -6.380 1.00 0.47 H new ATOM 0 HB1 ALA A 50 3.837 -6.136 -6.279 1.00 0.52 H new ATOM 0 HB2 ALA A 50 4.561 -7.067 -7.612 1.00 0.52 H new ATOM 0 HB3 ALA A 50 4.098 -7.888 -6.102 1.00 0.52 H new ATOM 812 N PHE A 51 4.788 -6.014 -3.891 1.00 0.35 N ATOM 813 CA PHE A 51 4.687 -5.769 -2.471 1.00 0.35 C ATOM 814 C PHE A 51 3.304 -6.215 -2.023 1.00 0.27 C ATOM 815 O PHE A 51 2.303 -5.679 -2.502 1.00 0.26 O ATOM 816 CB PHE A 51 4.941 -4.279 -2.236 1.00 0.45 C ATOM 817 CG PHE A 51 6.300 -3.843 -2.764 1.00 0.52 C ATOM 818 CD1 PHE A 51 7.453 -4.193 -2.046 1.00 1.58 C ATOM 819 CD2 PHE A 51 6.434 -3.235 -4.028 1.00 2.33 C ATOM 820 CE1 PHE A 51 8.733 -3.941 -2.569 1.00 1.41 C ATOM 821 CE2 PHE A 51 7.714 -2.996 -4.563 1.00 2.86 C ATOM 822 CZ PHE A 51 8.864 -3.353 -3.837 1.00 1.58 C ATOM 0 H PHE A 51 3.974 -5.709 -4.425 1.00 0.35 H new ATOM 0 HA PHE A 51 5.421 -6.326 -1.888 1.00 0.35 H new ATOM 0 HB2 PHE A 51 4.159 -3.697 -2.723 1.00 0.45 H new ATOM 0 HB3 PHE A 51 4.881 -4.065 -1.169 1.00 0.45 H new ATOM 0 HD1 PHE A 51 7.356 -4.662 -1.078 1.00 1.58 H new ATOM 0 HD2 PHE A 51 5.554 -2.952 -4.587 1.00 2.33 H new ATOM 0 HE1 PHE A 51 9.612 -4.199 -1.998 1.00 1.41 H new ATOM 0 HE2 PHE A 51 7.813 -2.536 -5.535 1.00 2.86 H new ATOM 0 HZ PHE A 51 9.845 -3.175 -4.253 1.00 1.58 H new ATOM 832 N ARG A 52 3.231 -7.227 -1.153 1.00 0.28 N ATOM 833 CA ARG A 52 1.945 -7.642 -0.610 1.00 0.23 C ATOM 834 C ARG A 52 1.643 -6.718 0.554 1.00 0.19 C ATOM 835 O ARG A 52 2.517 -6.500 1.394 1.00 0.23 O ATOM 836 CB ARG A 52 1.957 -9.107 -0.150 1.00 0.30 C ATOM 837 CG ARG A 52 0.528 -9.556 0.173 1.00 0.48 C ATOM 838 CD ARG A 52 0.432 -10.998 0.684 1.00 0.56 C ATOM 839 NE ARG A 52 -0.974 -11.438 0.745 1.00 0.96 N ATOM 840 CZ ARG A 52 -1.725 -11.796 -0.309 1.00 2.19 C ATOM 841 NH1 ARG A 52 -3.022 -12.052 -0.147 1.00 2.80 N ATOM 842 NH2 ARG A 52 -1.193 -11.899 -1.527 1.00 3.37 N ATOM 0 H ARG A 52 4.033 -7.761 -0.818 1.00 0.28 H new ATOM 0 HA ARG A 52 1.177 -7.576 -1.381 1.00 0.23 H new ATOM 0 HB2 ARG A 52 2.380 -9.740 -0.930 1.00 0.30 H new ATOM 0 HB3 ARG A 52 2.591 -9.217 0.730 1.00 0.30 H new ATOM 0 HG2 ARG A 52 0.108 -8.886 0.923 1.00 0.48 H new ATOM 0 HG3 ARG A 52 -0.085 -9.456 -0.723 1.00 0.48 H new ATOM 0 HD2 ARG A 52 0.997 -11.660 0.028 1.00 0.56 H new ATOM 0 HD3 ARG A 52 0.884 -11.069 1.674 1.00 0.56 H new ATOM 0 HE ARG A 52 -1.413 -11.473 1.665 1.00 0.96 H new ATOM 0 HH11 ARG A 52 -3.445 -11.976 0.778 1.00 2.80 H new ATOM 0 HH12 ARG A 52 -3.592 -12.324 -0.948 1.00 2.80 H new ATOM 0 HH21 ARG A 52 -0.202 -11.705 -1.669 1.00 3.37 H new ATOM 0 HH22 ARG A 52 -1.777 -12.172 -2.317 1.00 3.37 H new ATOM 856 N ILE A 53 0.418 -6.207 0.630 1.00 0.15 N ATOM 857 CA ILE A 53 -0.011 -5.350 1.710 1.00 0.14 C ATOM 858 C ILE A 53 -1.361 -5.828 2.224 1.00 0.14 C ATOM 859 O ILE A 53 -2.115 -6.501 1.520 1.00 0.22 O ATOM 860 CB ILE A 53 -0.007 -3.872 1.275 1.00 0.14 C ATOM 861 CG1 ILE A 53 -1.069 -3.498 0.227 1.00 0.14 C ATOM 862 CG2 ILE A 53 1.372 -3.523 0.702 1.00 0.16 C ATOM 863 CD1 ILE A 53 -1.359 -1.996 0.296 1.00 0.18 C ATOM 0 H ILE A 53 -0.305 -6.383 -0.067 1.00 0.15 H new ATOM 0 HA ILE A 53 0.693 -5.412 2.540 1.00 0.14 H new ATOM 0 HB ILE A 53 -0.247 -3.304 2.174 1.00 0.14 H new ATOM 0 HG12 ILE A 53 -0.719 -3.765 -0.770 1.00 0.14 H new ATOM 0 HG13 ILE A 53 -1.984 -4.063 0.405 1.00 0.14 H new ATOM 0 HG21 ILE A 53 1.383 -2.478 0.392 1.00 0.16 H new ATOM 0 HG22 ILE A 53 2.134 -3.683 1.465 1.00 0.16 H new ATOM 0 HG23 ILE A 53 1.580 -4.159 -0.158 1.00 0.16 H new ATOM 0 HD11 ILE A 53 -2.112 -1.736 -0.448 1.00 0.18 H new ATOM 0 HD12 ILE A 53 -1.728 -1.742 1.290 1.00 0.18 H new ATOM 0 HD13 ILE A 53 -0.444 -1.439 0.096 1.00 0.18 H new ATOM 875 N GLU A 54 -1.655 -5.483 3.470 1.00 0.15 N ATOM 876 CA GLU A 54 -2.883 -5.849 4.141 1.00 0.14 C ATOM 877 C GLU A 54 -3.424 -4.557 4.730 1.00 0.16 C ATOM 878 O GLU A 54 -2.652 -3.788 5.310 1.00 0.23 O ATOM 879 CB GLU A 54 -2.538 -6.885 5.212 1.00 0.18 C ATOM 880 CG GLU A 54 -3.769 -7.450 5.922 1.00 0.28 C ATOM 881 CD GLU A 54 -3.317 -8.189 7.178 1.00 0.62 C ATOM 882 OE1 GLU A 54 -2.474 -9.104 7.035 1.00 0.84 O ATOM 883 OE2 GLU A 54 -3.706 -7.757 8.284 1.00 1.69 O ATOM 0 H GLU A 54 -1.027 -4.928 4.051 1.00 0.15 H new ATOM 0 HA GLU A 54 -3.634 -6.294 3.489 1.00 0.14 H new ATOM 0 HB2 GLU A 54 -1.984 -7.703 4.752 1.00 0.18 H new ATOM 0 HB3 GLU A 54 -1.878 -6.429 5.950 1.00 0.18 H new ATOM 0 HG2 GLU A 54 -4.456 -6.645 6.184 1.00 0.28 H new ATOM 0 HG3 GLU A 54 -4.309 -8.127 5.260 1.00 0.28 H new ATOM 890 N ILE A 55 -4.718 -4.292 4.541 1.00 0.16 N ATOM 891 CA ILE A 55 -5.345 -3.056 4.980 1.00 0.16 C ATOM 892 C ILE A 55 -6.415 -3.449 5.984 1.00 0.18 C ATOM 893 O ILE A 55 -7.372 -4.139 5.640 1.00 0.34 O ATOM 894 CB ILE A 55 -5.980 -2.279 3.808 1.00 0.17 C ATOM 895 CG1 ILE A 55 -5.098 -2.244 2.541 1.00 0.19 C ATOM 896 CG2 ILE A 55 -6.318 -0.860 4.287 1.00 0.25 C ATOM 897 CD1 ILE A 55 -5.574 -3.246 1.489 1.00 0.62 C ATOM 0 H ILE A 55 -5.359 -4.935 4.076 1.00 0.16 H new ATOM 0 HA ILE A 55 -4.597 -2.395 5.418 1.00 0.16 H new ATOM 0 HB ILE A 55 -6.886 -2.806 3.510 1.00 0.17 H new ATOM 0 HG12 ILE A 55 -5.110 -1.240 2.118 1.00 0.19 H new ATOM 0 HG13 ILE A 55 -4.065 -2.464 2.811 1.00 0.19 H new ATOM 0 HG21 ILE A 55 -6.768 -0.297 3.469 1.00 0.25 H new ATOM 0 HG22 ILE A 55 -7.020 -0.914 5.119 1.00 0.25 H new ATOM 0 HG23 ILE A 55 -5.406 -0.359 4.613 1.00 0.25 H new ATOM 0 HD11 ILE A 55 -4.927 -3.190 0.614 1.00 0.62 H new ATOM 0 HD12 ILE A 55 -5.537 -4.254 1.903 1.00 0.62 H new ATOM 0 HD13 ILE A 55 -6.598 -3.010 1.199 1.00 0.62 H new ATOM 909 N ASN A 56 -6.267 -3.029 7.232 1.00 0.30 N ATOM 910 CA ASN A 56 -7.228 -3.375 8.256 1.00 0.26 C ATOM 911 C ASN A 56 -8.266 -2.262 8.283 1.00 0.25 C ATOM 912 O ASN A 56 -7.938 -1.127 8.638 1.00 0.30 O ATOM 913 CB ASN A 56 -6.510 -3.521 9.608 1.00 0.30 C ATOM 914 CG ASN A 56 -5.276 -4.412 9.506 1.00 0.35 C ATOM 915 OD1 ASN A 56 -4.156 -3.943 9.688 1.00 1.19 O ATOM 916 ND2 ASN A 56 -5.463 -5.683 9.180 1.00 0.93 N ATOM 0 H ASN A 56 -5.491 -2.450 7.554 1.00 0.30 H new ATOM 0 HA ASN A 56 -7.717 -4.327 8.051 1.00 0.26 H new ATOM 0 HB2 ASN A 56 -6.217 -2.536 9.971 1.00 0.30 H new ATOM 0 HB3 ASN A 56 -7.199 -3.939 10.341 1.00 0.30 H new ATOM 0 HD21 ASN A 56 -4.662 -6.305 9.073 1.00 0.93 H new ATOM 0 HD22 ASN A 56 -6.408 -6.039 9.036 1.00 0.93 H new ATOM 923 N PHE A 57 -9.502 -2.576 7.888 1.00 0.27 N ATOM 924 CA PHE A 57 -10.558 -1.588 7.705 1.00 0.29 C ATOM 925 C PHE A 57 -11.716 -1.935 8.644 1.00 0.29 C ATOM 926 O PHE A 57 -12.679 -2.580 8.243 1.00 0.36 O ATOM 927 CB PHE A 57 -10.960 -1.547 6.218 1.00 0.41 C ATOM 928 CG PHE A 57 -10.990 -0.160 5.616 1.00 0.46 C ATOM 929 CD1 PHE A 57 -9.906 0.293 4.847 1.00 1.64 C ATOM 930 CD2 PHE A 57 -12.121 0.658 5.775 1.00 1.93 C ATOM 931 CE1 PHE A 57 -9.959 1.550 4.220 1.00 1.52 C ATOM 932 CE2 PHE A 57 -12.178 1.908 5.134 1.00 2.20 C ATOM 933 CZ PHE A 57 -11.094 2.361 4.368 1.00 0.97 C ATOM 0 H PHE A 57 -9.796 -3.531 7.686 1.00 0.27 H new ATOM 0 HA PHE A 57 -10.223 -0.584 7.964 1.00 0.29 H new ATOM 0 HB2 PHE A 57 -10.263 -2.162 5.649 1.00 0.41 H new ATOM 0 HB3 PHE A 57 -11.946 -1.999 6.108 1.00 0.41 H new ATOM 0 HD1 PHE A 57 -9.028 -0.327 4.737 1.00 1.64 H new ATOM 0 HD2 PHE A 57 -12.946 0.327 6.389 1.00 1.93 H new ATOM 0 HE1 PHE A 57 -9.126 1.892 3.624 1.00 1.52 H new ATOM 0 HE2 PHE A 57 -13.061 2.522 5.232 1.00 2.20 H new ATOM 0 HZ PHE A 57 -11.133 3.331 3.894 1.00 0.97 H new ATOM 943 N PRO A 58 -11.624 -1.564 9.928 1.00 0.28 N ATOM 944 CA PRO A 58 -12.557 -2.045 10.932 1.00 0.31 C ATOM 945 C PRO A 58 -13.959 -1.488 10.692 1.00 0.29 C ATOM 946 O PRO A 58 -14.156 -0.553 9.917 1.00 0.25 O ATOM 947 CB PRO A 58 -11.971 -1.592 12.274 1.00 0.35 C ATOM 948 CG PRO A 58 -11.151 -0.357 11.905 1.00 0.35 C ATOM 949 CD PRO A 58 -10.608 -0.715 10.523 1.00 0.30 C ATOM 0 HA PRO A 58 -12.674 -3.128 10.902 1.00 0.31 H new ATOM 0 HB2 PRO A 58 -12.754 -1.354 12.994 1.00 0.35 H new ATOM 0 HB3 PRO A 58 -11.350 -2.367 12.723 1.00 0.35 H new ATOM 0 HG2 PRO A 58 -11.765 0.543 11.878 1.00 0.35 H new ATOM 0 HG3 PRO A 58 -10.349 -0.175 12.620 1.00 0.35 H new ATOM 0 HD2 PRO A 58 -10.439 0.178 9.922 1.00 0.30 H new ATOM 0 HD3 PRO A 58 -9.653 -1.235 10.597 1.00 0.30 H new ATOM 957 N ALA A 59 -14.946 -2.025 11.415 1.00 0.32 N ATOM 958 CA ALA A 59 -16.297 -1.480 11.392 1.00 0.31 C ATOM 959 C ALA A 59 -16.283 0.004 11.741 1.00 0.26 C ATOM 960 O ALA A 59 -17.067 0.781 11.206 1.00 0.25 O ATOM 961 CB ALA A 59 -17.190 -2.239 12.364 1.00 0.36 C ATOM 0 H ALA A 59 -14.830 -2.837 12.022 1.00 0.32 H new ATOM 0 HA ALA A 59 -16.696 -1.595 10.384 1.00 0.31 H new ATOM 0 HB1 ALA A 59 -18.196 -1.821 12.336 1.00 0.36 H new ATOM 0 HB2 ALA A 59 -17.226 -3.291 12.080 1.00 0.36 H new ATOM 0 HB3 ALA A 59 -16.788 -2.150 13.373 1.00 0.36 H new ATOM 967 N GLU A 60 -15.360 0.386 12.622 1.00 0.24 N ATOM 968 CA GLU A 60 -15.130 1.747 13.060 1.00 0.22 C ATOM 969 C GLU A 60 -14.425 2.596 12.000 1.00 0.19 C ATOM 970 O GLU A 60 -13.876 3.631 12.346 1.00 0.24 O ATOM 971 CB GLU A 60 -14.255 1.712 14.317 1.00 0.29 C ATOM 972 CG GLU A 60 -14.901 0.892 15.430 1.00 0.42 C ATOM 973 CD GLU A 60 -14.052 0.965 16.700 1.00 0.58 C ATOM 974 OE1 GLU A 60 -14.649 1.189 17.776 1.00 1.98 O ATOM 975 OE2 GLU A 60 -12.816 0.807 16.571 1.00 1.76 O ATOM 0 H GLU A 60 -14.728 -0.280 13.065 1.00 0.24 H new ATOM 0 HA GLU A 60 -16.102 2.201 13.254 1.00 0.22 H new ATOM 0 HB2 GLU A 60 -13.281 1.289 14.071 1.00 0.29 H new ATOM 0 HB3 GLU A 60 -14.081 2.729 14.668 1.00 0.29 H new ATOM 0 HG2 GLU A 60 -15.904 1.267 15.632 1.00 0.42 H new ATOM 0 HG3 GLU A 60 -15.006 -0.146 15.113 1.00 0.42 H new ATOM 982 N TYR A 61 -14.437 2.230 10.719 1.00 0.19 N ATOM 983 CA TYR A 61 -13.836 3.073 9.685 1.00 0.27 C ATOM 984 C TYR A 61 -14.348 4.526 9.726 1.00 0.24 C ATOM 985 O TYR A 61 -13.546 5.458 9.683 1.00 0.26 O ATOM 986 CB TYR A 61 -13.952 2.413 8.300 1.00 0.45 C ATOM 987 CG TYR A 61 -14.609 3.232 7.203 1.00 0.41 C ATOM 988 CD1 TYR A 61 -15.815 2.797 6.623 1.00 1.63 C ATOM 989 CD2 TYR A 61 -13.996 4.409 6.735 1.00 1.74 C ATOM 990 CE1 TYR A 61 -16.419 3.538 5.595 1.00 1.72 C ATOM 991 CE2 TYR A 61 -14.596 5.158 5.710 1.00 1.69 C ATOM 992 CZ TYR A 61 -15.814 4.727 5.135 1.00 0.53 C ATOM 993 OH TYR A 61 -16.412 5.444 4.145 1.00 0.66 O ATOM 0 H TYR A 61 -14.852 1.364 10.374 1.00 0.19 H new ATOM 0 HA TYR A 61 -12.771 3.154 9.902 1.00 0.27 H new ATOM 0 HB2 TYR A 61 -12.950 2.143 7.968 1.00 0.45 H new ATOM 0 HB3 TYR A 61 -14.512 1.485 8.412 1.00 0.45 H new ATOM 0 HD1 TYR A 61 -16.279 1.886 6.971 1.00 1.63 H new ATOM 0 HD2 TYR A 61 -13.061 4.737 7.165 1.00 1.74 H new ATOM 0 HE1 TYR A 61 -17.346 3.198 5.157 1.00 1.72 H new ATOM 0 HE2 TYR A 61 -14.126 6.065 5.360 1.00 1.69 H new ATOM 0 HH TYR A 61 -16.321 6.401 4.334 1.00 0.66 H new ATOM 1003 N PRO A 62 -15.661 4.789 9.818 1.00 0.24 N ATOM 1004 CA PRO A 62 -16.121 6.165 9.862 1.00 0.27 C ATOM 1005 C PRO A 62 -15.826 6.817 11.222 1.00 0.29 C ATOM 1006 O PRO A 62 -16.016 8.019 11.367 1.00 0.35 O ATOM 1007 CB PRO A 62 -17.614 6.099 9.542 1.00 0.32 C ATOM 1008 CG PRO A 62 -18.027 4.729 10.077 1.00 0.32 C ATOM 1009 CD PRO A 62 -16.782 3.864 9.880 1.00 0.28 C ATOM 0 HA PRO A 62 -15.599 6.797 9.143 1.00 0.27 H new ATOM 0 HB2 PRO A 62 -18.166 6.904 10.028 1.00 0.32 H new ATOM 0 HB3 PRO A 62 -17.800 6.186 8.472 1.00 0.32 H new ATOM 0 HG2 PRO A 62 -18.315 4.781 11.127 1.00 0.32 H new ATOM 0 HG3 PRO A 62 -18.882 4.329 9.532 1.00 0.32 H new ATOM 0 HD2 PRO A 62 -16.662 3.159 10.703 1.00 0.28 H new ATOM 0 HD3 PRO A 62 -16.855 3.277 8.965 1.00 0.28 H new ATOM 1017 N PHE A 63 -15.360 6.046 12.210 1.00 0.25 N ATOM 1018 CA PHE A 63 -14.948 6.501 13.532 1.00 0.27 C ATOM 1019 C PHE A 63 -13.440 6.740 13.648 1.00 0.28 C ATOM 1020 O PHE A 63 -13.024 7.517 14.503 1.00 0.36 O ATOM 1021 CB PHE A 63 -15.395 5.479 14.588 1.00 0.30 C ATOM 1022 CG PHE A 63 -16.641 5.890 15.337 1.00 0.36 C ATOM 1023 CD1 PHE A 63 -17.891 5.335 15.009 1.00 1.89 C ATOM 1024 CD2 PHE A 63 -16.539 6.831 16.376 1.00 1.76 C ATOM 1025 CE1 PHE A 63 -19.037 5.717 15.727 1.00 1.95 C ATOM 1026 CE2 PHE A 63 -17.686 7.213 17.094 1.00 1.79 C ATOM 1027 CZ PHE A 63 -18.934 6.655 16.770 1.00 0.68 C ATOM 0 H PHE A 63 -15.257 5.037 12.098 1.00 0.25 H new ATOM 0 HA PHE A 63 -15.430 7.464 13.701 1.00 0.27 H new ATOM 0 HB2 PHE A 63 -15.573 4.520 14.101 1.00 0.30 H new ATOM 0 HB3 PHE A 63 -14.585 5.328 15.302 1.00 0.30 H new ATOM 0 HD1 PHE A 63 -17.970 4.616 14.207 1.00 1.89 H new ATOM 0 HD2 PHE A 63 -15.579 7.261 16.623 1.00 1.76 H new ATOM 0 HE1 PHE A 63 -19.997 5.290 15.478 1.00 1.95 H new ATOM 0 HE2 PHE A 63 -17.608 7.935 17.894 1.00 1.79 H new ATOM 0 HZ PHE A 63 -19.815 6.947 17.322 1.00 0.68 H new ATOM 1037 N LYS A 64 -12.602 6.065 12.858 1.00 0.23 N ATOM 1038 CA LYS A 64 -11.154 6.210 12.938 1.00 0.23 C ATOM 1039 C LYS A 64 -10.533 5.740 11.632 1.00 0.23 C ATOM 1040 O LYS A 64 -11.096 4.875 10.967 1.00 0.24 O ATOM 1041 CB LYS A 64 -10.605 5.393 14.119 1.00 0.26 C ATOM 1042 CG LYS A 64 -10.949 3.896 14.047 1.00 1.30 C ATOM 1043 CD LYS A 64 -10.246 3.135 15.173 1.00 1.55 C ATOM 1044 CE LYS A 64 -8.754 2.980 14.850 1.00 2.68 C ATOM 1045 NZ LYS A 64 -7.962 2.717 16.069 1.00 3.22 N ATOM 0 H LYS A 64 -12.912 5.404 12.146 1.00 0.23 H new ATOM 0 HA LYS A 64 -10.900 7.257 13.100 1.00 0.23 H new ATOM 0 HB2 LYS A 64 -9.522 5.507 14.156 1.00 0.26 H new ATOM 0 HB3 LYS A 64 -11.000 5.803 15.048 1.00 0.26 H new ATOM 0 HG2 LYS A 64 -12.028 3.760 14.125 1.00 1.30 H new ATOM 0 HG3 LYS A 64 -10.645 3.492 13.081 1.00 1.30 H new ATOM 0 HD2 LYS A 64 -10.369 3.668 16.116 1.00 1.55 H new ATOM 0 HD3 LYS A 64 -10.703 2.154 15.300 1.00 1.55 H new ATOM 0 HE2 LYS A 64 -8.617 2.163 14.142 1.00 2.68 H new ATOM 0 HE3 LYS A 64 -8.389 3.886 14.366 1.00 2.68 H new ATOM 0 HZ1 LYS A 64 -6.958 2.617 15.816 1.00 3.22 H new ATOM 0 HZ2 LYS A 64 -8.075 3.509 16.734 1.00 3.22 H new ATOM 0 HZ3 LYS A 64 -8.295 1.839 16.517 1.00 3.22 H new ATOM 1059 N PRO A 65 -9.361 6.259 11.250 1.00 0.24 N ATOM 1060 CA PRO A 65 -8.729 5.821 10.027 1.00 0.24 C ATOM 1061 C PRO A 65 -8.267 4.365 10.170 1.00 0.23 C ATOM 1062 O PRO A 65 -7.956 3.911 11.276 1.00 0.24 O ATOM 1063 CB PRO A 65 -7.568 6.790 9.801 1.00 0.27 C ATOM 1064 CG PRO A 65 -7.201 7.239 11.216 1.00 0.28 C ATOM 1065 CD PRO A 65 -8.546 7.237 11.947 1.00 0.26 C ATOM 0 HA PRO A 65 -9.403 5.834 9.170 1.00 0.24 H new ATOM 0 HB2 PRO A 65 -6.729 6.303 9.304 1.00 0.27 H new ATOM 0 HB3 PRO A 65 -7.864 7.633 9.176 1.00 0.27 H new ATOM 0 HG2 PRO A 65 -6.489 6.558 11.682 1.00 0.28 H new ATOM 0 HG3 PRO A 65 -6.744 8.228 11.218 1.00 0.28 H new ATOM 0 HD2 PRO A 65 -8.423 6.970 12.996 1.00 0.26 H new ATOM 0 HD3 PRO A 65 -9.009 8.224 11.922 1.00 0.26 H new ATOM 1073 N PRO A 66 -8.220 3.635 9.049 1.00 0.23 N ATOM 1074 CA PRO A 66 -7.694 2.282 8.967 1.00 0.22 C ATOM 1075 C PRO A 66 -6.175 2.291 9.111 1.00 0.22 C ATOM 1076 O PRO A 66 -5.546 3.341 9.232 1.00 0.29 O ATOM 1077 CB PRO A 66 -8.115 1.773 7.590 1.00 0.28 C ATOM 1078 CG PRO A 66 -8.162 3.050 6.759 1.00 0.33 C ATOM 1079 CD PRO A 66 -8.627 4.112 7.744 1.00 0.29 C ATOM 0 HA PRO A 66 -8.074 1.642 9.763 1.00 0.22 H new ATOM 0 HB2 PRO A 66 -7.400 1.055 7.188 1.00 0.28 H new ATOM 0 HB3 PRO A 66 -9.084 1.275 7.622 1.00 0.28 H new ATOM 0 HG2 PRO A 66 -7.184 3.292 6.343 1.00 0.33 H new ATOM 0 HG3 PRO A 66 -8.851 2.955 5.920 1.00 0.33 H new ATOM 0 HD2 PRO A 66 -8.175 5.079 7.521 1.00 0.29 H new ATOM 0 HD3 PRO A 66 -9.708 4.246 7.695 1.00 0.29 H new ATOM 1087 N LYS A 67 -5.571 1.106 9.055 1.00 0.27 N ATOM 1088 CA LYS A 67 -4.128 0.948 9.155 1.00 0.25 C ATOM 1089 C LYS A 67 -3.692 0.027 8.028 1.00 0.22 C ATOM 1090 O LYS A 67 -4.514 -0.711 7.486 1.00 0.35 O ATOM 1091 CB LYS A 67 -3.780 0.389 10.545 1.00 0.35 C ATOM 1092 CG LYS A 67 -2.659 1.164 11.253 1.00 0.98 C ATOM 1093 CD LYS A 67 -1.241 0.726 10.840 1.00 1.25 C ATOM 1094 CE LYS A 67 -0.223 0.894 11.983 1.00 1.68 C ATOM 1095 NZ LYS A 67 0.457 2.211 11.996 1.00 2.15 N ATOM 0 H LYS A 67 -6.074 0.226 8.938 1.00 0.27 H new ATOM 0 HA LYS A 67 -3.601 1.897 9.052 1.00 0.25 H new ATOM 0 HB2 LYS A 67 -4.673 0.406 11.169 1.00 0.35 H new ATOM 0 HB3 LYS A 67 -3.482 -0.655 10.444 1.00 0.35 H new ATOM 0 HG2 LYS A 67 -2.776 2.227 11.042 1.00 0.98 H new ATOM 0 HG3 LYS A 67 -2.768 1.039 12.330 1.00 0.98 H new ATOM 0 HD2 LYS A 67 -1.262 -0.317 10.525 1.00 1.25 H new ATOM 0 HD3 LYS A 67 -0.918 1.312 9.979 1.00 1.25 H new ATOM 0 HE2 LYS A 67 -0.734 0.751 12.935 1.00 1.68 H new ATOM 0 HE3 LYS A 67 0.529 0.109 11.904 1.00 1.68 H new ATOM 0 HZ1 LYS A 67 1.125 2.249 12.792 1.00 2.15 H new ATOM 0 HZ2 LYS A 67 0.974 2.344 11.103 1.00 2.15 H new ATOM 0 HZ3 LYS A 67 -0.250 2.966 12.102 1.00 2.15 H new ATOM 1109 N ILE A 68 -2.415 0.070 7.665 1.00 0.16 N ATOM 1110 CA ILE A 68 -1.873 -0.791 6.628 1.00 0.16 C ATOM 1111 C ILE A 68 -0.547 -1.318 7.134 1.00 0.17 C ATOM 1112 O ILE A 68 0.187 -0.585 7.801 1.00 0.24 O ATOM 1113 CB ILE A 68 -1.672 -0.032 5.301 1.00 0.14 C ATOM 1114 CG1 ILE A 68 -2.686 1.107 5.132 1.00 0.17 C ATOM 1115 CG2 ILE A 68 -1.756 -1.012 4.125 1.00 0.16 C ATOM 1116 CD1 ILE A 68 -2.381 1.896 3.876 1.00 0.22 C ATOM 0 H ILE A 68 -1.731 0.701 8.081 1.00 0.16 H new ATOM 0 HA ILE A 68 -2.571 -1.603 6.422 1.00 0.16 H new ATOM 0 HB ILE A 68 -0.682 0.423 5.320 1.00 0.14 H new ATOM 0 HG12 ILE A 68 -3.696 0.700 5.078 1.00 0.17 H new ATOM 0 HG13 ILE A 68 -2.653 1.765 6.001 1.00 0.17 H new ATOM 0 HG21 ILE A 68 -1.613 -0.471 3.190 1.00 0.16 H new ATOM 0 HG22 ILE A 68 -0.980 -1.771 4.227 1.00 0.16 H new ATOM 0 HG23 ILE A 68 -2.734 -1.492 4.121 1.00 0.16 H new ATOM 0 HD11 ILE A 68 -3.107 2.701 3.767 1.00 0.22 H new ATOM 0 HD12 ILE A 68 -1.379 2.318 3.946 1.00 0.22 H new ATOM 0 HD13 ILE A 68 -2.437 1.237 3.010 1.00 0.22 H new ATOM 1128 N THR A 69 -0.235 -2.561 6.780 1.00 0.15 N ATOM 1129 CA THR A 69 1.067 -3.122 7.074 1.00 0.16 C ATOM 1130 C THR A 69 1.471 -4.011 5.903 1.00 0.14 C ATOM 1131 O THR A 69 0.731 -4.922 5.521 1.00 0.18 O ATOM 1132 CB THR A 69 1.012 -3.902 8.398 1.00 0.20 C ATOM 1133 OG1 THR A 69 0.249 -3.226 9.379 1.00 0.29 O ATOM 1134 CG2 THR A 69 2.414 -4.077 8.972 1.00 0.21 C ATOM 0 H THR A 69 -0.869 -3.193 6.290 1.00 0.15 H new ATOM 0 HA THR A 69 1.814 -2.338 7.197 1.00 0.16 H new ATOM 0 HB THR A 69 0.553 -4.863 8.167 1.00 0.20 H new ATOM 0 HG1 THR A 69 0.237 -3.754 10.205 1.00 0.29 H new ATOM 0 HG21 THR A 69 2.357 -4.631 9.909 1.00 0.21 H new ATOM 0 HG22 THR A 69 3.032 -4.627 8.262 1.00 0.21 H new ATOM 0 HG23 THR A 69 2.857 -3.098 9.156 1.00 0.21 H new ATOM 1142 N PHE A 70 2.631 -3.739 5.303 1.00 0.13 N ATOM 1143 CA PHE A 70 3.170 -4.590 4.259 1.00 0.13 C ATOM 1144 C PHE A 70 3.525 -5.932 4.890 1.00 0.15 C ATOM 1145 O PHE A 70 4.063 -5.989 5.992 1.00 0.20 O ATOM 1146 CB PHE A 70 4.392 -3.960 3.568 1.00 0.18 C ATOM 1147 CG PHE A 70 4.101 -2.798 2.630 1.00 0.21 C ATOM 1148 CD1 PHE A 70 3.275 -1.719 3.009 1.00 0.23 C ATOM 1149 CD2 PHE A 70 4.664 -2.805 1.339 1.00 0.27 C ATOM 1150 CE1 PHE A 70 3.022 -0.670 2.111 1.00 0.27 C ATOM 1151 CE2 PHE A 70 4.436 -1.740 0.449 1.00 0.30 C ATOM 1152 CZ PHE A 70 3.617 -0.668 0.839 1.00 0.30 C ATOM 0 H PHE A 70 3.212 -2.931 5.528 1.00 0.13 H new ATOM 0 HA PHE A 70 2.422 -4.722 3.478 1.00 0.13 H new ATOM 0 HB2 PHE A 70 5.083 -3.616 4.338 1.00 0.18 H new ATOM 0 HB3 PHE A 70 4.906 -4.737 3.003 1.00 0.18 H new ATOM 0 HD1 PHE A 70 2.835 -1.700 3.995 1.00 0.23 H new ATOM 0 HD2 PHE A 70 5.278 -3.638 1.029 1.00 0.27 H new ATOM 0 HE1 PHE A 70 2.367 0.139 2.400 1.00 0.27 H new ATOM 0 HE2 PHE A 70 4.889 -1.747 -0.531 1.00 0.30 H new ATOM 0 HZ PHE A 70 3.445 0.156 0.162 1.00 0.30 H new ATOM 1162 N LYS A 71 3.189 -7.020 4.202 1.00 0.24 N ATOM 1163 CA LYS A 71 3.599 -8.358 4.594 1.00 0.29 C ATOM 1164 C LYS A 71 5.045 -8.571 4.162 1.00 0.32 C ATOM 1165 O LYS A 71 5.827 -9.180 4.886 1.00 0.39 O ATOM 1166 CB LYS A 71 2.687 -9.401 3.938 1.00 0.29 C ATOM 1167 CG LYS A 71 1.180 -9.160 4.132 1.00 0.42 C ATOM 1168 CD LYS A 71 0.684 -9.382 5.564 1.00 0.57 C ATOM 1169 CE LYS A 71 0.864 -8.144 6.449 1.00 0.88 C ATOM 1170 NZ LYS A 71 0.171 -8.322 7.743 1.00 1.33 N ATOM 0 H LYS A 71 2.622 -6.994 3.354 1.00 0.24 H new ATOM 0 HA LYS A 71 3.520 -8.469 5.675 1.00 0.29 H new ATOM 0 HB2 LYS A 71 2.901 -9.428 2.870 1.00 0.29 H new ATOM 0 HB3 LYS A 71 2.937 -10.384 4.338 1.00 0.29 H new ATOM 0 HG2 LYS A 71 0.946 -8.138 3.834 1.00 0.42 H new ATOM 0 HG3 LYS A 71 0.629 -9.821 3.463 1.00 0.42 H new ATOM 0 HD2 LYS A 71 -0.370 -9.657 5.541 1.00 0.57 H new ATOM 0 HD3 LYS A 71 1.223 -10.221 6.005 1.00 0.57 H new ATOM 0 HE2 LYS A 71 1.925 -7.965 6.621 1.00 0.88 H new ATOM 0 HE3 LYS A 71 0.471 -7.265 5.938 1.00 0.88 H new ATOM 0 HZ1 LYS A 71 0.174 -7.422 8.265 1.00 1.33 H new ATOM 0 HZ2 LYS A 71 -0.811 -8.621 7.573 1.00 1.33 H new ATOM 0 HZ3 LYS A 71 0.662 -9.048 8.303 1.00 1.33 H new ATOM 1184 N THR A 72 5.394 -8.115 2.959 1.00 0.31 N ATOM 1185 CA THR A 72 6.743 -8.265 2.454 1.00 0.35 C ATOM 1186 C THR A 72 7.632 -7.142 2.983 1.00 0.43 C ATOM 1187 O THR A 72 7.135 -6.094 3.393 1.00 0.62 O ATOM 1188 CB THR A 72 6.705 -8.246 0.925 1.00 0.33 C ATOM 1189 OG1 THR A 72 6.067 -7.072 0.453 1.00 0.37 O ATOM 1190 CG2 THR A 72 5.904 -9.441 0.396 1.00 0.24 C ATOM 0 H THR A 72 4.755 -7.640 2.322 1.00 0.31 H new ATOM 0 HA THR A 72 7.160 -9.213 2.793 1.00 0.35 H new ATOM 0 HB THR A 72 7.737 -8.286 0.575 1.00 0.33 H new ATOM 0 HG1 THR A 72 6.692 -6.561 -0.103 1.00 0.37 H new ATOM 0 HG21 THR A 72 5.886 -9.413 -0.694 1.00 0.24 H new ATOM 0 HG22 THR A 72 6.372 -10.368 0.728 1.00 0.24 H new ATOM 0 HG23 THR A 72 4.884 -9.393 0.777 1.00 0.24 H new ATOM 1198 N LYS A 73 8.952 -7.325 2.898 1.00 0.31 N ATOM 1199 CA LYS A 73 9.913 -6.263 3.157 1.00 0.27 C ATOM 1200 C LYS A 73 9.675 -5.072 2.241 1.00 0.39 C ATOM 1201 O LYS A 73 9.088 -5.220 1.165 1.00 0.84 O ATOM 1202 CB LYS A 73 11.343 -6.788 2.954 1.00 0.35 C ATOM 1203 CG LYS A 73 11.746 -7.839 3.990 1.00 0.73 C ATOM 1204 CD LYS A 73 11.486 -7.271 5.383 1.00 0.82 C ATOM 1205 CE LYS A 73 12.348 -7.932 6.457 1.00 0.98 C ATOM 1206 NZ LYS A 73 11.877 -9.298 6.774 1.00 1.55 N ATOM 0 H LYS A 73 9.380 -8.216 2.647 1.00 0.31 H new ATOM 0 HA LYS A 73 9.784 -5.937 4.189 1.00 0.27 H new ATOM 0 HB2 LYS A 73 11.428 -7.218 1.956 1.00 0.35 H new ATOM 0 HB3 LYS A 73 12.041 -5.952 3.002 1.00 0.35 H new ATOM 0 HG2 LYS A 73 11.175 -8.755 3.842 1.00 0.73 H new ATOM 0 HG3 LYS A 73 12.799 -8.098 3.877 1.00 0.73 H new ATOM 0 HD2 LYS A 73 11.680 -6.198 5.376 1.00 0.82 H new ATOM 0 HD3 LYS A 73 10.434 -7.403 5.635 1.00 0.82 H new ATOM 0 HE2 LYS A 73 13.383 -7.974 6.118 1.00 0.98 H new ATOM 0 HE3 LYS A 73 12.333 -7.323 7.361 1.00 0.98 H new ATOM 0 HZ1 LYS A 73 12.487 -9.714 7.507 1.00 1.55 H new ATOM 0 HZ2 LYS A 73 10.898 -9.256 7.121 1.00 1.55 H new ATOM 0 HZ3 LYS A 73 11.915 -9.886 5.917 1.00 1.55 H new ATOM 1220 N ILE A 74 10.171 -3.902 2.653 1.00 0.27 N ATOM 1221 CA ILE A 74 10.044 -2.681 1.877 1.00 0.30 C ATOM 1222 C ILE A 74 11.400 -1.988 1.746 1.00 0.42 C ATOM 1223 O ILE A 74 12.339 -2.310 2.462 1.00 0.79 O ATOM 1224 CB ILE A 74 8.970 -1.782 2.510 1.00 0.31 C ATOM 1225 CG1 ILE A 74 9.246 -1.348 3.960 1.00 0.36 C ATOM 1226 CG2 ILE A 74 7.639 -2.541 2.485 1.00 0.37 C ATOM 1227 CD1 ILE A 74 10.252 -0.199 4.092 1.00 0.54 C ATOM 0 H ILE A 74 10.670 -3.782 3.534 1.00 0.27 H new ATOM 0 HA ILE A 74 9.719 -2.914 0.863 1.00 0.30 H new ATOM 0 HB ILE A 74 8.959 -0.866 1.920 1.00 0.31 H new ATOM 0 HG12 ILE A 74 8.306 -1.048 4.423 1.00 0.36 H new ATOM 0 HG13 ILE A 74 9.617 -2.207 4.520 1.00 0.36 H new ATOM 0 HG21 ILE A 74 6.859 -1.923 2.930 1.00 0.37 H new ATOM 0 HG22 ILE A 74 7.373 -2.775 1.454 1.00 0.37 H new ATOM 0 HG23 ILE A 74 7.737 -3.466 3.053 1.00 0.37 H new ATOM 0 HD11 ILE A 74 10.389 0.045 5.145 1.00 0.54 H new ATOM 0 HD12 ILE A 74 11.207 -0.500 3.662 1.00 0.54 H new ATOM 0 HD13 ILE A 74 9.876 0.677 3.563 1.00 0.54 H new ATOM 1239 N TYR A 75 11.492 -1.012 0.841 1.00 0.31 N ATOM 1240 CA TYR A 75 12.649 -0.126 0.709 1.00 0.36 C ATOM 1241 C TYR A 75 12.176 1.304 0.438 1.00 0.46 C ATOM 1242 O TYR A 75 12.905 2.131 -0.105 1.00 0.91 O ATOM 1243 CB TYR A 75 13.565 -0.628 -0.422 1.00 0.42 C ATOM 1244 CG TYR A 75 14.992 -0.859 0.025 1.00 0.68 C ATOM 1245 CD1 TYR A 75 15.551 -2.139 -0.103 1.00 2.04 C ATOM 1246 CD2 TYR A 75 15.752 0.184 0.589 1.00 1.94 C ATOM 1247 CE1 TYR A 75 16.846 -2.399 0.365 1.00 2.38 C ATOM 1248 CE2 TYR A 75 17.065 -0.058 1.035 1.00 2.28 C ATOM 1249 CZ TYR A 75 17.614 -1.359 0.931 1.00 1.82 C ATOM 1250 OH TYR A 75 18.892 -1.612 1.327 1.00 2.40 O ATOM 0 H TYR A 75 10.752 -0.812 0.168 1.00 0.31 H new ATOM 0 HA TYR A 75 13.220 -0.129 1.638 1.00 0.36 H new ATOM 0 HB2 TYR A 75 13.161 -1.558 -0.822 1.00 0.42 H new ATOM 0 HB3 TYR A 75 13.559 0.098 -1.235 1.00 0.42 H new ATOM 0 HD1 TYR A 75 14.979 -2.930 -0.566 1.00 2.04 H new ATOM 0 HD2 TYR A 75 15.326 1.172 0.680 1.00 1.94 H new ATOM 0 HE1 TYR A 75 17.256 -3.395 0.293 1.00 2.38 H new ATOM 0 HE2 TYR A 75 17.652 0.746 1.455 1.00 2.28 H new ATOM 0 HH TYR A 75 19.288 -0.795 1.695 1.00 2.40 H new ATOM 1260 N HIS A 76 10.923 1.599 0.779 1.00 0.23 N ATOM 1261 CA HIS A 76 10.277 2.845 0.420 1.00 0.26 C ATOM 1262 C HIS A 76 10.127 3.649 1.693 1.00 0.25 C ATOM 1263 O HIS A 76 9.565 3.123 2.646 1.00 0.25 O ATOM 1264 CB HIS A 76 8.906 2.541 -0.185 1.00 0.33 C ATOM 1265 CG HIS A 76 9.021 1.876 -1.528 1.00 0.46 C ATOM 1266 ND1 HIS A 76 8.985 0.517 -1.791 1.00 0.57 N ATOM 1267 CD2 HIS A 76 9.191 2.540 -2.706 1.00 0.99 C ATOM 1268 CE1 HIS A 76 9.160 0.363 -3.118 1.00 0.89 C ATOM 1269 NE2 HIS A 76 9.260 1.581 -3.691 1.00 1.23 N ATOM 0 H HIS A 76 10.328 0.969 1.317 1.00 0.23 H new ATOM 0 HA HIS A 76 10.859 3.403 -0.314 1.00 0.26 H new ATOM 0 HB2 HIS A 76 8.345 1.897 0.492 1.00 0.33 H new ATOM 0 HB3 HIS A 76 8.340 3.467 -0.286 1.00 0.33 H new ATOM 0 HD1 HIS A 76 8.851 -0.228 -1.108 1.00 0.57 H new ATOM 0 HD2 HIS A 76 9.258 3.609 -2.840 1.00 0.99 H new ATOM 0 HE1 HIS A 76 9.212 -0.582 -3.639 1.00 0.89 H new ATOM 1278 N PRO A 77 10.561 4.911 1.718 1.00 0.25 N ATOM 1279 CA PRO A 77 10.593 5.701 2.936 1.00 0.23 C ATOM 1280 C PRO A 77 9.193 5.981 3.476 1.00 0.20 C ATOM 1281 O PRO A 77 9.023 6.252 4.658 1.00 0.17 O ATOM 1282 CB PRO A 77 11.330 6.980 2.548 1.00 0.25 C ATOM 1283 CG PRO A 77 11.039 7.127 1.057 1.00 0.26 C ATOM 1284 CD PRO A 77 11.067 5.674 0.590 1.00 0.26 C ATOM 0 HA PRO A 77 11.095 5.176 3.749 1.00 0.23 H new ATOM 0 HB2 PRO A 77 10.967 7.838 3.113 1.00 0.25 H new ATOM 0 HB3 PRO A 77 12.400 6.900 2.741 1.00 0.25 H new ATOM 0 HG2 PRO A 77 10.073 7.597 0.873 1.00 0.26 H new ATOM 0 HG3 PRO A 77 11.790 7.734 0.551 1.00 0.26 H new ATOM 0 HD2 PRO A 77 10.446 5.531 -0.294 1.00 0.26 H new ATOM 0 HD3 PRO A 77 12.077 5.364 0.324 1.00 0.26 H new ATOM 1292 N ASN A 78 8.172 5.941 2.618 1.00 0.22 N ATOM 1293 CA ASN A 78 6.796 6.170 3.037 1.00 0.18 C ATOM 1294 C ASN A 78 6.261 5.046 3.934 1.00 0.15 C ATOM 1295 O ASN A 78 5.199 5.207 4.533 1.00 0.24 O ATOM 1296 CB ASN A 78 5.919 6.353 1.794 1.00 0.30 C ATOM 1297 CG ASN A 78 6.064 7.763 1.246 1.00 1.24 C ATOM 1298 OD1 ASN A 78 5.806 8.729 1.954 1.00 2.55 O ATOM 1299 ND2 ASN A 78 6.410 7.923 -0.026 1.00 2.04 N ATOM 0 H ASN A 78 8.278 5.750 1.622 1.00 0.22 H new ATOM 0 HA ASN A 78 6.768 7.076 3.642 1.00 0.18 H new ATOM 0 HB2 ASN A 78 6.203 5.628 1.031 1.00 0.30 H new ATOM 0 HB3 ASN A 78 4.876 6.159 2.045 1.00 0.30 H new ATOM 0 HD21 ASN A 78 6.464 8.860 -0.426 1.00 2.04 H new ATOM 0 HD22 ASN A 78 6.622 7.109 -0.603 1.00 2.04 H new ATOM 1306 N ILE A 79 6.971 3.918 4.028 1.00 0.15 N ATOM 1307 CA ILE A 79 6.629 2.772 4.851 1.00 0.18 C ATOM 1308 C ILE A 79 7.837 2.495 5.766 1.00 0.21 C ATOM 1309 O ILE A 79 8.944 2.964 5.514 1.00 0.26 O ATOM 1310 CB ILE A 79 6.255 1.598 3.917 1.00 0.19 C ATOM 1311 CG1 ILE A 79 5.184 2.033 2.895 1.00 0.19 C ATOM 1312 CG2 ILE A 79 5.711 0.363 4.658 1.00 0.25 C ATOM 1313 CD1 ILE A 79 5.671 1.987 1.445 1.00 0.37 C ATOM 0 H ILE A 79 7.837 3.780 3.506 1.00 0.15 H new ATOM 0 HA ILE A 79 5.764 2.939 5.493 1.00 0.18 H new ATOM 0 HB ILE A 79 7.188 1.321 3.427 1.00 0.19 H new ATOM 0 HG12 ILE A 79 4.312 1.388 2.998 1.00 0.19 H new ATOM 0 HG13 ILE A 79 4.860 3.047 3.129 1.00 0.19 H new ATOM 0 HG21 ILE A 79 5.471 -0.418 3.936 1.00 0.25 H new ATOM 0 HG22 ILE A 79 6.465 -0.005 5.354 1.00 0.25 H new ATOM 0 HG23 ILE A 79 4.811 0.636 5.209 1.00 0.25 H new ATOM 0 HD11 ILE A 79 4.867 2.305 0.781 1.00 0.37 H new ATOM 0 HD12 ILE A 79 6.525 2.654 1.327 1.00 0.37 H new ATOM 0 HD13 ILE A 79 5.968 0.969 1.193 1.00 0.37 H new ATOM 1325 N ASP A 80 7.621 1.769 6.858 1.00 0.22 N ATOM 1326 CA ASP A 80 8.628 1.382 7.835 1.00 0.26 C ATOM 1327 C ASP A 80 9.049 -0.055 7.549 1.00 0.25 C ATOM 1328 O ASP A 80 8.322 -0.781 6.876 1.00 0.24 O ATOM 1329 CB ASP A 80 7.972 1.443 9.214 1.00 0.32 C ATOM 1330 CG ASP A 80 8.881 0.975 10.340 1.00 0.40 C ATOM 1331 OD1 ASP A 80 10.091 1.296 10.283 1.00 1.35 O ATOM 1332 OD2 ASP A 80 8.365 0.255 11.225 1.00 1.17 O ATOM 0 H ASP A 80 6.693 1.418 7.096 1.00 0.22 H new ATOM 0 HA ASP A 80 9.498 2.037 7.790 1.00 0.26 H new ATOM 0 HB2 ASP A 80 7.658 2.468 9.413 1.00 0.32 H new ATOM 0 HB3 ASP A 80 7.071 0.830 9.206 1.00 0.32 H new ATOM 1337 N GLU A 81 10.177 -0.511 8.096 1.00 0.29 N ATOM 1338 CA GLU A 81 10.616 -1.894 7.904 1.00 0.33 C ATOM 1339 C GLU A 81 9.552 -2.878 8.363 1.00 0.30 C ATOM 1340 O GLU A 81 9.354 -3.926 7.754 1.00 0.36 O ATOM 1341 CB GLU A 81 11.924 -2.194 8.646 1.00 0.46 C ATOM 1342 CG GLU A 81 13.016 -2.643 7.664 1.00 1.32 C ATOM 1343 CD GLU A 81 12.635 -3.931 6.909 1.00 3.47 C ATOM 1344 OE1 GLU A 81 12.084 -3.804 5.790 1.00 4.84 O ATOM 1345 OE2 GLU A 81 12.892 -5.033 7.452 1.00 4.33 O ATOM 0 H GLU A 81 10.800 0.054 8.673 1.00 0.29 H new ATOM 0 HA GLU A 81 10.787 -2.013 6.834 1.00 0.33 H new ATOM 0 HB2 GLU A 81 12.255 -1.305 9.184 1.00 0.46 H new ATOM 0 HB3 GLU A 81 11.755 -2.972 9.390 1.00 0.46 H new ATOM 0 HG2 GLU A 81 13.204 -1.846 6.945 1.00 1.32 H new ATOM 0 HG3 GLU A 81 13.946 -2.806 8.209 1.00 1.32 H new ATOM 1352 N LYS A 82 8.819 -2.544 9.425 1.00 0.26 N ATOM 1353 CA LYS A 82 7.757 -3.417 9.894 1.00 0.26 C ATOM 1354 C LYS A 82 6.491 -3.213 9.063 1.00 0.22 C ATOM 1355 O LYS A 82 5.389 -3.398 9.569 1.00 0.30 O ATOM 1356 CB LYS A 82 7.563 -3.145 11.388 1.00 0.32 C ATOM 1357 CG LYS A 82 8.629 -3.920 12.166 1.00 0.94 C ATOM 1358 CD LYS A 82 8.808 -3.354 13.570 1.00 1.04 C ATOM 1359 CE LYS A 82 9.764 -4.278 14.330 1.00 1.63 C ATOM 1360 NZ LYS A 82 10.068 -3.775 15.686 1.00 2.16 N ATOM 0 H LYS A 82 8.942 -1.688 9.966 1.00 0.26 H new ATOM 0 HA LYS A 82 8.015 -4.468 9.768 1.00 0.26 H new ATOM 0 HB2 LYS A 82 7.646 -2.078 11.592 1.00 0.32 H new ATOM 0 HB3 LYS A 82 6.566 -3.453 11.703 1.00 0.32 H new ATOM 0 HG2 LYS A 82 8.346 -4.971 12.228 1.00 0.94 H new ATOM 0 HG3 LYS A 82 9.577 -3.877 11.630 1.00 0.94 H new ATOM 0 HD2 LYS A 82 9.210 -2.342 13.525 1.00 1.04 H new ATOM 0 HD3 LYS A 82 7.848 -3.293 14.082 1.00 1.04 H new ATOM 0 HE2 LYS A 82 9.323 -5.272 14.404 1.00 1.63 H new ATOM 0 HE3 LYS A 82 10.691 -4.381 13.766 1.00 1.63 H new ATOM 0 HZ1 LYS A 82 10.718 -4.432 16.162 1.00 2.16 H new ATOM 0 HZ2 LYS A 82 10.513 -2.837 15.617 1.00 2.16 H new ATOM 0 HZ3 LYS A 82 9.187 -3.701 16.234 1.00 2.16 H new ATOM 1374 N GLY A 83 6.619 -2.795 7.802 1.00 0.21 N ATOM 1375 CA GLY A 83 5.516 -2.598 6.888 1.00 0.19 C ATOM 1376 C GLY A 83 4.580 -1.460 7.282 1.00 0.19 C ATOM 1377 O GLY A 83 3.635 -1.203 6.542 1.00 0.19 O ATOM 0 H GLY A 83 7.525 -2.580 7.386 1.00 0.21 H new ATOM 0 HA2 GLY A 83 5.913 -2.400 5.893 1.00 0.19 H new ATOM 0 HA3 GLY A 83 4.941 -3.522 6.824 1.00 0.19 H new ATOM 1381 N GLN A 84 4.792 -0.792 8.421 1.00 0.22 N ATOM 1382 CA GLN A 84 3.871 0.214 8.916 1.00 0.23 C ATOM 1383 C GLN A 84 3.827 1.395 7.963 1.00 0.21 C ATOM 1384 O GLN A 84 4.821 1.713 7.322 1.00 0.25 O ATOM 1385 CB GLN A 84 4.327 0.747 10.274 1.00 0.32 C ATOM 1386 CG GLN A 84 4.389 -0.304 11.376 1.00 0.55 C ATOM 1387 CD GLN A 84 4.703 0.408 12.682 1.00 0.95 C ATOM 1388 OE1 GLN A 84 3.791 0.800 13.403 1.00 1.18 O ATOM 1389 NE2 GLN A 84 5.979 0.651 12.970 1.00 1.55 N ATOM 0 H GLN A 84 5.606 -0.939 9.017 1.00 0.22 H new ATOM 0 HA GLN A 84 2.891 -0.256 9.003 1.00 0.23 H new ATOM 0 HB2 GLN A 84 5.314 1.196 10.161 1.00 0.32 H new ATOM 0 HB3 GLN A 84 3.649 1.542 10.585 1.00 0.32 H new ATOM 0 HG2 GLN A 84 3.441 -0.836 11.450 1.00 0.55 H new ATOM 0 HG3 GLN A 84 5.155 -1.047 11.152 1.00 0.55 H new ATOM 0 HE21 GLN A 84 6.715 0.312 12.351 1.00 1.55 H new ATOM 0 HE22 GLN A 84 6.221 1.176 13.810 1.00 1.55 H new ATOM 1398 N VAL A 85 2.708 2.107 7.932 1.00 0.19 N ATOM 1399 CA VAL A 85 2.555 3.252 7.055 1.00 0.18 C ATOM 1400 C VAL A 85 2.178 4.483 7.871 1.00 0.18 C ATOM 1401 O VAL A 85 1.574 4.352 8.939 1.00 0.22 O ATOM 1402 CB VAL A 85 1.508 2.912 5.993 1.00 0.18 C ATOM 1403 CG1 VAL A 85 1.906 1.661 5.204 1.00 0.18 C ATOM 1404 CG2 VAL A 85 0.129 2.701 6.615 1.00 0.22 C ATOM 0 H VAL A 85 1.891 1.907 8.509 1.00 0.19 H new ATOM 0 HA VAL A 85 3.492 3.484 6.549 1.00 0.18 H new ATOM 0 HB VAL A 85 1.460 3.762 5.313 1.00 0.18 H new ATOM 0 HG11 VAL A 85 1.143 1.444 4.457 1.00 0.18 H new ATOM 0 HG12 VAL A 85 2.861 1.832 4.708 1.00 0.18 H new ATOM 0 HG13 VAL A 85 1.998 0.815 5.885 1.00 0.18 H new ATOM 0 HG21 VAL A 85 -0.590 2.461 5.832 1.00 0.22 H new ATOM 0 HG22 VAL A 85 0.174 1.880 7.330 1.00 0.22 H new ATOM 0 HG23 VAL A 85 -0.182 3.611 7.127 1.00 0.22 H new ATOM 1414 N CYS A 86 2.518 5.673 7.367 1.00 0.19 N ATOM 1415 CA CYS A 86 2.038 6.934 7.909 1.00 0.20 C ATOM 1416 C CYS A 86 1.786 7.898 6.746 1.00 0.20 C ATOM 1417 O CYS A 86 2.680 8.655 6.378 1.00 0.25 O ATOM 1418 CB CYS A 86 3.061 7.508 8.895 1.00 0.24 C ATOM 1419 SG CYS A 86 2.279 8.808 9.887 1.00 0.39 S ATOM 0 H CYS A 86 3.139 5.782 6.565 1.00 0.19 H new ATOM 0 HA CYS A 86 1.107 6.781 8.455 1.00 0.20 H new ATOM 0 HB2 CYS A 86 3.439 6.718 9.544 1.00 0.24 H new ATOM 0 HB3 CYS A 86 3.916 7.913 8.354 1.00 0.24 H new ATOM 0 HG CYS A 86 3.145 9.294 10.725 1.00 0.39 H new ATOM 1425 N LEU A 87 0.598 7.857 6.136 1.00 0.21 N ATOM 1426 CA LEU A 87 0.228 8.744 5.040 1.00 0.23 C ATOM 1427 C LEU A 87 -0.985 9.569 5.461 1.00 0.24 C ATOM 1428 O LEU A 87 -1.810 9.084 6.235 1.00 0.22 O ATOM 1429 CB LEU A 87 -0.148 7.937 3.789 1.00 0.22 C ATOM 1430 CG LEU A 87 0.958 7.122 3.120 1.00 0.23 C ATOM 1431 CD1 LEU A 87 2.253 7.918 2.989 1.00 0.28 C ATOM 1432 CD2 LEU A 87 1.239 5.790 3.802 1.00 0.21 C ATOM 0 H LEU A 87 -0.138 7.200 6.395 1.00 0.21 H new ATOM 0 HA LEU A 87 1.078 9.386 4.810 1.00 0.23 H new ATOM 0 HB2 LEU A 87 -0.954 7.254 4.058 1.00 0.22 H new ATOM 0 HB3 LEU A 87 -0.550 8.629 3.050 1.00 0.22 H new ATOM 0 HG LEU A 87 0.573 6.898 2.125 1.00 0.23 H new ATOM 0 HD11 LEU A 87 3.012 7.301 2.508 1.00 0.28 H new ATOM 0 HD12 LEU A 87 2.074 8.808 2.386 1.00 0.28 H new ATOM 0 HD13 LEU A 87 2.600 8.214 3.979 1.00 0.28 H new ATOM 0 HD21 LEU A 87 2.035 5.270 3.270 1.00 0.21 H new ATOM 0 HD22 LEU A 87 1.546 5.967 4.833 1.00 0.21 H new ATOM 0 HD23 LEU A 87 0.337 5.179 3.792 1.00 0.21 H new ATOM 1444 N PRO A 88 -1.165 10.775 4.903 1.00 0.26 N ATOM 1445 CA PRO A 88 -2.264 11.659 5.261 1.00 0.28 C ATOM 1446 C PRO A 88 -3.636 11.026 5.017 1.00 0.32 C ATOM 1447 O PRO A 88 -4.574 11.304 5.757 1.00 0.51 O ATOM 1448 CB PRO A 88 -2.053 12.950 4.468 1.00 0.31 C ATOM 1449 CG PRO A 88 -1.124 12.540 3.326 1.00 0.30 C ATOM 1450 CD PRO A 88 -0.288 11.420 3.941 1.00 0.29 C ATOM 0 HA PRO A 88 -2.260 11.864 6.331 1.00 0.28 H new ATOM 0 HB2 PRO A 88 -2.997 13.345 4.092 1.00 0.31 H new ATOM 0 HB3 PRO A 88 -1.605 13.728 5.086 1.00 0.31 H new ATOM 0 HG2 PRO A 88 -1.683 12.194 2.457 1.00 0.30 H new ATOM 0 HG3 PRO A 88 -0.502 13.371 2.995 1.00 0.30 H new ATOM 0 HD2 PRO A 88 0.048 10.716 3.180 1.00 0.29 H new ATOM 0 HD3 PRO A 88 0.605 11.815 4.425 1.00 0.29 H new ATOM 1458 N VAL A 89 -3.753 10.146 4.023 1.00 0.23 N ATOM 1459 CA VAL A 89 -5.000 9.453 3.679 1.00 0.19 C ATOM 1460 C VAL A 89 -5.592 8.712 4.884 1.00 0.18 C ATOM 1461 O VAL A 89 -6.804 8.523 4.953 1.00 0.20 O ATOM 1462 CB VAL A 89 -4.798 8.520 2.464 1.00 0.16 C ATOM 1463 CG1 VAL A 89 -4.525 9.358 1.210 1.00 0.19 C ATOM 1464 CG2 VAL A 89 -3.630 7.545 2.651 1.00 0.16 C ATOM 0 H VAL A 89 -2.971 9.888 3.421 1.00 0.23 H new ATOM 0 HA VAL A 89 -5.731 10.209 3.391 1.00 0.19 H new ATOM 0 HB VAL A 89 -5.714 7.938 2.362 1.00 0.16 H new ATOM 0 HG11 VAL A 89 -4.383 8.697 0.355 1.00 0.19 H new ATOM 0 HG12 VAL A 89 -5.372 10.018 1.022 1.00 0.19 H new ATOM 0 HG13 VAL A 89 -3.626 9.955 1.360 1.00 0.19 H new ATOM 0 HG21 VAL A 89 -3.536 6.915 1.766 1.00 0.16 H new ATOM 0 HG22 VAL A 89 -2.707 8.106 2.796 1.00 0.16 H new ATOM 0 HG23 VAL A 89 -3.815 6.919 3.524 1.00 0.16 H new ATOM 1474 N ILE A 90 -4.749 8.281 5.828 1.00 0.17 N ATOM 1475 CA ILE A 90 -5.160 7.574 7.035 1.00 0.18 C ATOM 1476 C ILE A 90 -4.528 8.203 8.277 1.00 0.20 C ATOM 1477 O ILE A 90 -4.428 7.570 9.326 1.00 0.21 O ATOM 1478 CB ILE A 90 -4.814 6.086 6.890 1.00 0.15 C ATOM 1479 CG1 ILE A 90 -3.304 5.897 6.669 1.00 0.14 C ATOM 1480 CG2 ILE A 90 -5.637 5.525 5.721 1.00 0.14 C ATOM 1481 CD1 ILE A 90 -2.926 4.441 6.433 1.00 0.15 C ATOM 0 H ILE A 90 -3.740 8.419 5.768 1.00 0.17 H new ATOM 0 HA ILE A 90 -6.239 7.660 7.164 1.00 0.18 H new ATOM 0 HB ILE A 90 -5.062 5.544 7.802 1.00 0.15 H new ATOM 0 HG12 ILE A 90 -2.988 6.494 5.814 1.00 0.14 H new ATOM 0 HG13 ILE A 90 -2.763 6.273 7.538 1.00 0.14 H new ATOM 0 HG21 ILE A 90 -5.412 4.466 5.593 1.00 0.14 H new ATOM 0 HG22 ILE A 90 -6.699 5.647 5.932 1.00 0.14 H new ATOM 0 HG23 ILE A 90 -5.384 6.063 4.807 1.00 0.14 H new ATOM 0 HD11 ILE A 90 -1.849 4.364 6.283 1.00 0.15 H new ATOM 0 HD12 ILE A 90 -3.215 3.845 7.299 1.00 0.15 H new ATOM 0 HD13 ILE A 90 -3.443 4.070 5.548 1.00 0.15 H new ATOM 1493 N SER A 91 -4.093 9.454 8.170 1.00 0.26 N ATOM 1494 CA SER A 91 -3.575 10.190 9.303 1.00 0.33 C ATOM 1495 C SER A 91 -4.738 10.544 10.224 1.00 0.37 C ATOM 1496 O SER A 91 -5.869 10.684 9.769 1.00 0.43 O ATOM 1497 CB SER A 91 -2.872 11.433 8.768 1.00 0.39 C ATOM 1498 OG SER A 91 -2.621 12.371 9.799 1.00 0.57 O ATOM 0 H SER A 91 -4.092 9.979 7.296 1.00 0.26 H new ATOM 0 HA SER A 91 -2.858 9.605 9.879 1.00 0.33 H new ATOM 0 HB2 SER A 91 -1.931 11.146 8.298 1.00 0.39 H new ATOM 0 HB3 SER A 91 -3.486 11.896 7.995 1.00 0.39 H new ATOM 0 HG SER A 91 -2.168 13.155 9.425 1.00 0.57 H new ATOM 1504 N ALA A 92 -4.463 10.722 11.516 1.00 0.41 N ATOM 1505 CA ALA A 92 -5.485 11.136 12.462 1.00 0.46 C ATOM 1506 C ALA A 92 -6.002 12.531 12.109 1.00 0.53 C ATOM 1507 O ALA A 92 -7.207 12.751 12.094 1.00 0.55 O ATOM 1508 CB ALA A 92 -4.925 11.093 13.887 1.00 0.56 C ATOM 0 H ALA A 92 -3.539 10.585 11.926 1.00 0.41 H new ATOM 0 HA ALA A 92 -6.327 10.446 12.406 1.00 0.46 H new ATOM 0 HB1 ALA A 92 -5.697 11.405 14.591 1.00 0.56 H new ATOM 0 HB2 ALA A 92 -4.608 10.077 14.123 1.00 0.56 H new ATOM 0 HB3 ALA A 92 -4.071 11.767 13.963 1.00 0.56 H new ATOM 1514 N GLU A 93 -5.110 13.479 11.804 1.00 0.63 N ATOM 1515 CA GLU A 93 -5.542 14.830 11.455 1.00 0.78 C ATOM 1516 C GLU A 93 -6.339 14.833 10.158 1.00 0.80 C ATOM 1517 O GLU A 93 -7.291 15.592 10.012 1.00 1.15 O ATOM 1518 CB GLU A 93 -4.350 15.778 11.319 1.00 0.97 C ATOM 1519 CG GLU A 93 -3.805 16.182 12.690 1.00 1.26 C ATOM 1520 CD GLU A 93 -2.878 17.388 12.547 1.00 1.61 C ATOM 1521 OE1 GLU A 93 -1.838 17.223 11.873 1.00 2.15 O ATOM 1522 OE2 GLU A 93 -3.238 18.457 13.085 1.00 2.54 O ATOM 0 H GLU A 93 -4.100 13.337 11.792 1.00 0.63 H new ATOM 0 HA GLU A 93 -6.180 15.180 12.267 1.00 0.78 H new ATOM 0 HB2 GLU A 93 -3.563 15.296 10.740 1.00 0.97 H new ATOM 0 HB3 GLU A 93 -4.651 16.669 10.768 1.00 0.97 H new ATOM 0 HG2 GLU A 93 -4.629 16.423 13.362 1.00 1.26 H new ATOM 0 HG3 GLU A 93 -3.264 15.348 13.136 1.00 1.26 H new ATOM 1529 N ASN A 94 -5.942 14.001 9.194 1.00 0.55 N ATOM 1530 CA ASN A 94 -6.611 13.987 7.902 1.00 0.55 C ATOM 1531 C ASN A 94 -7.621 12.852 7.795 1.00 0.54 C ATOM 1532 O ASN A 94 -8.110 12.592 6.695 1.00 0.69 O ATOM 1533 CB ASN A 94 -5.576 13.971 6.774 1.00 0.55 C ATOM 1534 CG ASN A 94 -5.251 15.394 6.380 1.00 1.15 C ATOM 1535 OD1 ASN A 94 -5.861 15.917 5.449 1.00 2.09 O ATOM 1536 ND2 ASN A 94 -4.357 16.039 7.120 1.00 0.98 N ATOM 0 H ASN A 94 -5.172 13.339 9.285 1.00 0.55 H new ATOM 0 HA ASN A 94 -7.192 14.904 7.803 1.00 0.55 H new ATOM 0 HB2 ASN A 94 -4.673 13.456 7.100 1.00 0.55 H new ATOM 0 HB3 ASN A 94 -5.964 13.422 5.916 1.00 0.55 H new ATOM 0 HD21 ASN A 94 -4.147 17.018 6.928 1.00 0.98 H new ATOM 0 HD22 ASN A 94 -3.880 15.555 7.881 1.00 0.98 H new ATOM 1543 N TRP A 95 -7.990 12.240 8.921 1.00 0.49 N ATOM 1544 CA TRP A 95 -9.011 11.211 8.989 1.00 0.46 C ATOM 1545 C TRP A 95 -10.303 11.772 8.408 1.00 0.44 C ATOM 1546 O TRP A 95 -10.903 12.692 8.958 1.00 0.47 O ATOM 1547 CB TRP A 95 -9.195 10.777 10.445 1.00 0.44 C ATOM 1548 CG TRP A 95 -10.493 10.121 10.807 1.00 0.39 C ATOM 1549 CD1 TRP A 95 -11.105 9.091 10.174 1.00 0.36 C ATOM 1550 CD2 TRP A 95 -11.375 10.500 11.902 1.00 0.40 C ATOM 1551 NE1 TRP A 95 -12.314 8.824 10.792 1.00 0.34 N ATOM 1552 CE2 TRP A 95 -12.548 9.696 11.838 1.00 0.37 C ATOM 1553 CE3 TRP A 95 -11.299 11.459 12.935 1.00 0.49 C ATOM 1554 CZ2 TRP A 95 -13.614 9.879 12.731 1.00 0.43 C ATOM 1555 CZ3 TRP A 95 -12.347 11.617 13.860 1.00 0.55 C ATOM 1556 CH2 TRP A 95 -13.507 10.833 13.754 1.00 0.53 C ATOM 0 H TRP A 95 -7.574 12.455 9.827 1.00 0.49 H new ATOM 0 HA TRP A 95 -8.719 10.334 8.411 1.00 0.46 H new ATOM 0 HB2 TRP A 95 -8.388 10.089 10.697 1.00 0.44 H new ATOM 0 HB3 TRP A 95 -9.073 11.657 11.077 1.00 0.44 H new ATOM 0 HD1 TRP A 95 -10.710 8.561 9.320 1.00 0.36 H new ATOM 0 HE1 TRP A 95 -12.951 8.079 10.511 1.00 0.34 H new ATOM 0 HE3 TRP A 95 -10.421 12.082 13.017 1.00 0.49 H new ATOM 0 HZ2 TRP A 95 -14.513 9.288 12.632 1.00 0.43 H new ATOM 0 HZ3 TRP A 95 -12.259 12.344 14.654 1.00 0.55 H new ATOM 0 HH2 TRP A 95 -14.315 10.964 14.458 1.00 0.53 H new ATOM 1567 N LYS A 96 -10.725 11.228 7.270 1.00 0.49 N ATOM 1568 CA LYS A 96 -11.937 11.638 6.586 1.00 0.50 C ATOM 1569 C LYS A 96 -12.786 10.381 6.504 1.00 0.47 C ATOM 1570 O LYS A 96 -12.381 9.442 5.827 1.00 0.46 O ATOM 1571 CB LYS A 96 -11.584 12.182 5.186 1.00 0.59 C ATOM 1572 CG LYS A 96 -11.655 13.714 5.076 1.00 0.77 C ATOM 1573 CD LYS A 96 -10.866 14.453 6.167 1.00 1.09 C ATOM 1574 CE LYS A 96 -9.924 15.539 5.636 1.00 1.32 C ATOM 1575 NZ LYS A 96 -8.729 14.958 4.978 1.00 2.45 N ATOM 0 H LYS A 96 -10.223 10.479 6.794 1.00 0.49 H new ATOM 0 HA LYS A 96 -12.470 12.437 7.102 1.00 0.50 H new ATOM 0 HB2 LYS A 96 -10.578 11.855 4.923 1.00 0.59 H new ATOM 0 HB3 LYS A 96 -12.263 11.743 4.455 1.00 0.59 H new ATOM 0 HG2 LYS A 96 -11.276 14.016 4.100 1.00 0.77 H new ATOM 0 HG3 LYS A 96 -12.699 14.024 5.123 1.00 0.77 H new ATOM 0 HD2 LYS A 96 -11.570 14.908 6.864 1.00 1.09 H new ATOM 0 HD3 LYS A 96 -10.282 13.727 6.732 1.00 1.09 H new ATOM 0 HE2 LYS A 96 -10.460 16.169 4.926 1.00 1.32 H new ATOM 0 HE3 LYS A 96 -9.610 16.181 6.459 1.00 1.32 H new ATOM 0 HZ1 LYS A 96 -7.900 15.556 5.173 1.00 2.45 H new ATOM 0 HZ2 LYS A 96 -8.560 14.001 5.348 1.00 2.45 H new ATOM 0 HZ3 LYS A 96 -8.887 14.910 3.951 1.00 2.45 H new ATOM 1589 N PRO A 97 -13.960 10.331 7.141 1.00 0.45 N ATOM 1590 CA PRO A 97 -14.832 9.171 7.052 1.00 0.43 C ATOM 1591 C PRO A 97 -15.409 9.015 5.643 1.00 0.49 C ATOM 1592 O PRO A 97 -15.855 7.937 5.267 1.00 0.62 O ATOM 1593 CB PRO A 97 -15.898 9.393 8.125 1.00 0.45 C ATOM 1594 CG PRO A 97 -15.974 10.914 8.249 1.00 0.47 C ATOM 1595 CD PRO A 97 -14.529 11.350 8.006 1.00 0.46 C ATOM 0 HA PRO A 97 -14.303 8.234 7.227 1.00 0.43 H new ATOM 0 HB2 PRO A 97 -16.857 8.967 7.831 1.00 0.45 H new ATOM 0 HB3 PRO A 97 -15.618 8.927 9.070 1.00 0.45 H new ATOM 0 HG2 PRO A 97 -16.655 11.345 7.515 1.00 0.47 H new ATOM 0 HG3 PRO A 97 -16.329 11.222 9.233 1.00 0.47 H new ATOM 0 HD2 PRO A 97 -14.489 12.332 7.535 1.00 0.46 H new ATOM 0 HD3 PRO A 97 -13.977 11.423 8.943 1.00 0.46 H new ATOM 1603 N ALA A 98 -15.377 10.074 4.833 1.00 0.54 N ATOM 1604 CA ALA A 98 -15.747 9.996 3.429 1.00 0.59 C ATOM 1605 C ALA A 98 -14.703 9.253 2.584 1.00 0.55 C ATOM 1606 O ALA A 98 -14.990 8.899 1.444 1.00 0.57 O ATOM 1607 CB ALA A 98 -15.928 11.418 2.904 1.00 0.69 C ATOM 0 H ALA A 98 -15.094 11.006 5.136 1.00 0.54 H new ATOM 0 HA ALA A 98 -16.673 9.427 3.348 1.00 0.59 H new ATOM 0 HB1 ALA A 98 -16.206 11.384 1.851 1.00 0.69 H new ATOM 0 HB2 ALA A 98 -16.713 11.918 3.471 1.00 0.69 H new ATOM 0 HB3 ALA A 98 -14.994 11.968 3.015 1.00 0.69 H new ATOM 1613 N THR A 99 -13.485 9.061 3.098 1.00 0.55 N ATOM 1614 CA THR A 99 -12.445 8.363 2.362 1.00 0.52 C ATOM 1615 C THR A 99 -12.783 6.877 2.283 1.00 0.48 C ATOM 1616 O THR A 99 -13.699 6.399 2.954 1.00 0.60 O ATOM 1617 CB THR A 99 -11.069 8.635 3.002 1.00 0.52 C ATOM 1618 OG1 THR A 99 -10.097 8.693 1.989 1.00 0.59 O ATOM 1619 CG2 THR A 99 -10.597 7.593 4.021 1.00 0.46 C ATOM 0 H THR A 99 -13.201 9.383 4.023 1.00 0.55 H new ATOM 0 HA THR A 99 -12.392 8.736 1.339 1.00 0.52 H new ATOM 0 HB THR A 99 -11.192 9.573 3.544 1.00 0.52 H new ATOM 0 HG1 THR A 99 -10.438 9.222 1.238 1.00 0.59 H new ATOM 0 HG21 THR A 99 -9.620 7.880 4.409 1.00 0.46 H new ATOM 0 HG22 THR A 99 -11.312 7.537 4.842 1.00 0.46 H new ATOM 0 HG23 THR A 99 -10.523 6.619 3.538 1.00 0.46 H new ATOM 1627 N LYS A 100 -12.024 6.128 1.483 1.00 0.37 N ATOM 1628 CA LYS A 100 -12.171 4.685 1.419 1.00 0.30 C ATOM 1629 C LYS A 100 -10.851 4.043 1.023 1.00 0.25 C ATOM 1630 O LYS A 100 -9.859 4.732 0.784 1.00 0.23 O ATOM 1631 CB LYS A 100 -13.283 4.306 0.437 1.00 0.44 C ATOM 1632 CG LYS A 100 -13.001 4.752 -1.001 1.00 2.28 C ATOM 1633 CD LYS A 100 -13.862 5.940 -1.425 1.00 2.44 C ATOM 1634 CE LYS A 100 -13.974 5.921 -2.951 1.00 4.01 C ATOM 1635 NZ LYS A 100 -15.223 6.567 -3.383 1.00 3.60 N ATOM 0 H LYS A 100 -11.300 6.504 0.871 1.00 0.37 H new ATOM 0 HA LYS A 100 -12.450 4.313 2.405 1.00 0.30 H new ATOM 0 HB2 LYS A 100 -13.420 3.225 0.454 1.00 0.44 H new ATOM 0 HB3 LYS A 100 -14.220 4.751 0.771 1.00 0.44 H new ATOM 0 HG2 LYS A 100 -11.948 5.018 -1.095 1.00 2.28 H new ATOM 0 HG3 LYS A 100 -13.180 3.917 -1.679 1.00 2.28 H new ATOM 0 HD2 LYS A 100 -14.850 5.876 -0.969 1.00 2.44 H new ATOM 0 HD3 LYS A 100 -13.415 6.875 -1.087 1.00 2.44 H new ATOM 0 HE2 LYS A 100 -13.120 6.436 -3.391 1.00 4.01 H new ATOM 0 HE3 LYS A 100 -13.946 4.893 -3.311 1.00 4.01 H new ATOM 0 HZ1 LYS A 100 -15.222 6.668 -4.418 1.00 3.60 H new ATOM 0 HZ2 LYS A 100 -16.034 5.984 -3.093 1.00 3.60 H new ATOM 0 HZ3 LYS A 100 -15.298 7.507 -2.944 1.00 3.60 H new ATOM 1649 N THR A 101 -10.859 2.720 0.902 1.00 0.26 N ATOM 1650 CA THR A 101 -9.730 1.943 0.441 1.00 0.24 C ATOM 1651 C THR A 101 -9.197 2.407 -0.899 1.00 0.23 C ATOM 1652 O THR A 101 -8.001 2.287 -1.102 1.00 0.33 O ATOM 1653 CB THR A 101 -10.120 0.481 0.304 1.00 0.27 C ATOM 1654 OG1 THR A 101 -11.479 0.432 -0.071 1.00 0.42 O ATOM 1655 CG2 THR A 101 -9.928 -0.278 1.610 1.00 0.32 C ATOM 0 H THR A 101 -11.674 2.151 1.129 1.00 0.26 H new ATOM 0 HA THR A 101 -8.948 2.078 1.189 1.00 0.24 H new ATOM 0 HB THR A 101 -9.483 0.010 -0.445 1.00 0.27 H new ATOM 0 HG1 THR A 101 -11.774 -0.502 -0.110 1.00 0.42 H new ATOM 0 HG21 THR A 101 -10.218 -1.320 1.471 1.00 0.32 H new ATOM 0 HG22 THR A 101 -8.881 -0.229 1.909 1.00 0.32 H new ATOM 0 HG23 THR A 101 -10.548 0.171 2.386 1.00 0.32 H new ATOM 1663 N ASP A 102 -10.026 2.917 -1.812 1.00 0.22 N ATOM 1664 CA ASP A 102 -9.526 3.506 -3.056 1.00 0.21 C ATOM 1665 C ASP A 102 -8.435 4.524 -2.725 1.00 0.21 C ATOM 1666 O ASP A 102 -7.294 4.384 -3.161 1.00 0.31 O ATOM 1667 CB ASP A 102 -10.689 4.104 -3.861 1.00 0.28 C ATOM 1668 CG ASP A 102 -10.295 5.368 -4.619 1.00 1.29 C ATOM 1669 OD1 ASP A 102 -10.793 6.437 -4.196 1.00 1.74 O ATOM 1670 OD2 ASP A 102 -9.492 5.245 -5.566 1.00 2.79 O ATOM 0 H ASP A 102 -11.041 2.934 -1.715 1.00 0.22 H new ATOM 0 HA ASP A 102 -9.076 2.742 -3.690 1.00 0.21 H new ATOM 0 HB2 ASP A 102 -11.055 3.360 -4.569 1.00 0.28 H new ATOM 0 HB3 ASP A 102 -11.513 4.333 -3.185 1.00 0.28 H new ATOM 1675 N GLN A 103 -8.759 5.498 -1.878 1.00 0.17 N ATOM 1676 CA GLN A 103 -7.821 6.541 -1.503 1.00 0.17 C ATOM 1677 C GLN A 103 -6.609 6.001 -0.758 1.00 0.18 C ATOM 1678 O GLN A 103 -5.532 6.590 -0.851 1.00 0.26 O ATOM 1679 CB GLN A 103 -8.541 7.630 -0.714 1.00 0.20 C ATOM 1680 CG GLN A 103 -9.741 8.139 -1.524 1.00 0.22 C ATOM 1681 CD GLN A 103 -10.115 9.557 -1.121 1.00 0.35 C ATOM 1682 OE1 GLN A 103 -11.074 9.788 -0.393 1.00 1.39 O ATOM 1683 NE2 GLN A 103 -9.325 10.533 -1.544 1.00 2.09 N ATOM 0 H GLN A 103 -9.675 5.582 -1.437 1.00 0.17 H new ATOM 0 HA GLN A 103 -7.427 6.981 -2.419 1.00 0.17 H new ATOM 0 HB2 GLN A 103 -8.877 7.237 0.246 1.00 0.20 H new ATOM 0 HB3 GLN A 103 -7.858 8.452 -0.501 1.00 0.20 H new ATOM 0 HG2 GLN A 103 -9.503 8.111 -2.587 1.00 0.22 H new ATOM 0 HG3 GLN A 103 -10.594 7.478 -1.370 1.00 0.22 H new ATOM 0 HE21 GLN A 103 -8.532 10.321 -2.149 1.00 2.09 H new ATOM 0 HE22 GLN A 103 -9.510 11.496 -1.264 1.00 2.09 H new ATOM 1692 N VAL A 104 -6.752 4.894 -0.034 1.00 0.13 N ATOM 1693 CA VAL A 104 -5.628 4.283 0.651 1.00 0.13 C ATOM 1694 C VAL A 104 -4.671 3.664 -0.366 1.00 0.14 C ATOM 1695 O VAL A 104 -3.499 4.030 -0.421 1.00 0.18 O ATOM 1696 CB VAL A 104 -6.170 3.273 1.671 1.00 0.14 C ATOM 1697 CG1 VAL A 104 -5.023 2.512 2.304 1.00 0.15 C ATOM 1698 CG2 VAL A 104 -6.926 4.017 2.774 1.00 0.16 C ATOM 0 H VAL A 104 -7.638 4.405 0.091 1.00 0.13 H new ATOM 0 HA VAL A 104 -5.048 5.026 1.198 1.00 0.13 H new ATOM 0 HB VAL A 104 -6.836 2.579 1.159 1.00 0.14 H new ATOM 0 HG11 VAL A 104 -5.416 1.797 3.027 1.00 0.15 H new ATOM 0 HG12 VAL A 104 -4.469 1.979 1.531 1.00 0.15 H new ATOM 0 HG13 VAL A 104 -4.358 3.211 2.810 1.00 0.15 H new ATOM 0 HG21 VAL A 104 -7.311 3.300 3.499 1.00 0.16 H new ATOM 0 HG22 VAL A 104 -6.250 4.711 3.274 1.00 0.16 H new ATOM 0 HG23 VAL A 104 -7.756 4.571 2.336 1.00 0.16 H new ATOM 1708 N ILE A 105 -5.169 2.727 -1.166 1.00 0.14 N ATOM 1709 CA ILE A 105 -4.421 1.918 -2.111 1.00 0.14 C ATOM 1710 C ILE A 105 -3.699 2.825 -3.088 1.00 0.13 C ATOM 1711 O ILE A 105 -2.488 2.697 -3.257 1.00 0.14 O ATOM 1712 CB ILE A 105 -5.371 0.919 -2.796 1.00 0.14 C ATOM 1713 CG1 ILE A 105 -5.663 -0.250 -1.839 1.00 0.15 C ATOM 1714 CG2 ILE A 105 -4.841 0.377 -4.132 1.00 0.13 C ATOM 1715 CD1 ILE A 105 -4.407 -0.983 -1.340 1.00 0.17 C ATOM 0 H ILE A 105 -6.164 2.502 -1.169 1.00 0.14 H new ATOM 0 HA ILE A 105 -3.658 1.329 -1.601 1.00 0.14 H new ATOM 0 HB ILE A 105 -6.284 1.467 -3.029 1.00 0.14 H new ATOM 0 HG12 ILE A 105 -6.215 0.128 -0.979 1.00 0.15 H new ATOM 0 HG13 ILE A 105 -6.311 -0.966 -2.344 1.00 0.15 H new ATOM 0 HG21 ILE A 105 -5.564 -0.320 -4.554 1.00 0.13 H new ATOM 0 HG22 ILE A 105 -4.687 1.204 -4.825 1.00 0.13 H new ATOM 0 HG23 ILE A 105 -3.895 -0.138 -3.966 1.00 0.13 H new ATOM 0 HD11 ILE A 105 -4.700 -1.792 -0.671 1.00 0.17 H new ATOM 0 HD12 ILE A 105 -3.863 -1.394 -2.191 1.00 0.17 H new ATOM 0 HD13 ILE A 105 -3.766 -0.283 -0.804 1.00 0.17 H new ATOM 1727 N GLN A 106 -4.430 3.754 -3.709 1.00 0.14 N ATOM 1728 CA GLN A 106 -3.830 4.691 -4.645 1.00 0.15 C ATOM 1729 C GLN A 106 -2.693 5.461 -3.978 1.00 0.16 C ATOM 1730 O GLN A 106 -1.730 5.794 -4.650 1.00 0.19 O ATOM 1731 CB GLN A 106 -4.889 5.604 -5.288 1.00 0.21 C ATOM 1732 CG GLN A 106 -5.473 6.666 -4.347 1.00 0.56 C ATOM 1733 CD GLN A 106 -4.594 7.906 -4.191 1.00 1.20 C ATOM 1734 OE1 GLN A 106 -4.155 8.503 -5.165 1.00 1.82 O ATOM 1735 NE2 GLN A 106 -4.321 8.324 -2.960 1.00 2.12 N ATOM 0 H GLN A 106 -5.434 3.872 -3.577 1.00 0.14 H new ATOM 0 HA GLN A 106 -3.388 4.129 -5.468 1.00 0.15 H new ATOM 0 HB2 GLN A 106 -4.444 6.105 -6.148 1.00 0.21 H new ATOM 0 HB3 GLN A 106 -5.703 4.985 -5.665 1.00 0.21 H new ATOM 0 HG2 GLN A 106 -6.451 6.970 -4.721 1.00 0.56 H new ATOM 0 HG3 GLN A 106 -5.632 6.220 -3.365 1.00 0.56 H new ATOM 0 HE21 GLN A 106 -4.692 7.819 -2.156 1.00 2.12 H new ATOM 0 HE22 GLN A 106 -3.740 9.150 -2.819 1.00 2.12 H new ATOM 1744 N SER A 107 -2.777 5.722 -2.671 1.00 0.15 N ATOM 1745 CA SER A 107 -1.716 6.350 -1.907 1.00 0.16 C ATOM 1746 C SER A 107 -0.502 5.437 -1.860 1.00 0.14 C ATOM 1747 O SER A 107 0.581 5.873 -2.230 1.00 0.16 O ATOM 1748 CB SER A 107 -2.181 6.692 -0.491 1.00 0.19 C ATOM 1749 OG SER A 107 -1.598 7.906 -0.068 1.00 0.41 O ATOM 0 H SER A 107 -3.600 5.496 -2.113 1.00 0.15 H new ATOM 0 HA SER A 107 -1.444 7.282 -2.402 1.00 0.16 H new ATOM 0 HB2 SER A 107 -3.268 6.774 -0.467 1.00 0.19 H new ATOM 0 HB3 SER A 107 -1.906 5.890 0.194 1.00 0.19 H new ATOM 0 HG SER A 107 -1.486 7.893 0.905 1.00 0.41 H new ATOM 1755 N LEU A 108 -0.634 4.178 -1.423 1.00 0.13 N ATOM 1756 CA LEU A 108 0.545 3.318 -1.347 1.00 0.14 C ATOM 1757 C LEU A 108 1.239 3.285 -2.691 1.00 0.16 C ATOM 1758 O LEU A 108 2.434 3.521 -2.766 1.00 0.23 O ATOM 1759 CB LEU A 108 0.249 1.870 -0.949 1.00 0.14 C ATOM 1760 CG LEU A 108 -0.184 1.651 0.503 1.00 0.18 C ATOM 1761 CD1 LEU A 108 0.518 2.593 1.475 1.00 0.14 C ATOM 1762 CD2 LEU A 108 -1.696 1.764 0.654 1.00 0.37 C ATOM 0 H LEU A 108 -1.511 3.748 -1.128 1.00 0.13 H new ATOM 0 HA LEU A 108 1.167 3.754 -0.565 1.00 0.14 H new ATOM 0 HB2 LEU A 108 -0.534 1.487 -1.603 1.00 0.14 H new ATOM 0 HB3 LEU A 108 1.141 1.273 -1.136 1.00 0.14 H new ATOM 0 HG LEU A 108 0.119 0.636 0.761 1.00 0.18 H new ATOM 0 HD11 LEU A 108 0.173 2.393 2.489 1.00 0.14 H new ATOM 0 HD12 LEU A 108 1.595 2.435 1.421 1.00 0.14 H new ATOM 0 HD13 LEU A 108 0.289 3.625 1.211 1.00 0.14 H new ATOM 0 HD21 LEU A 108 -1.971 1.603 1.697 1.00 0.37 H new ATOM 0 HD22 LEU A 108 -2.020 2.757 0.342 1.00 0.37 H new ATOM 0 HD23 LEU A 108 -2.181 1.012 0.031 1.00 0.37 H new ATOM 1774 N ILE A 109 0.489 3.012 -3.752 1.00 0.17 N ATOM 1775 CA ILE A 109 1.022 2.991 -5.101 1.00 0.16 C ATOM 1776 C ILE A 109 1.705 4.316 -5.393 1.00 0.17 C ATOM 1777 O ILE A 109 2.837 4.318 -5.848 1.00 0.23 O ATOM 1778 CB ILE A 109 -0.118 2.694 -6.076 1.00 0.17 C ATOM 1779 CG1 ILE A 109 -0.555 1.242 -5.852 1.00 0.15 C ATOM 1780 CG2 ILE A 109 0.288 2.874 -7.545 1.00 0.20 C ATOM 1781 CD1 ILE A 109 -2.020 1.069 -6.220 1.00 0.16 C ATOM 0 H ILE A 109 -0.507 2.799 -3.697 1.00 0.17 H new ATOM 0 HA ILE A 109 1.772 2.208 -5.214 1.00 0.16 H new ATOM 0 HB ILE A 109 -0.925 3.401 -5.883 1.00 0.17 H new ATOM 0 HG12 ILE A 109 0.060 0.573 -6.454 1.00 0.15 H new ATOM 0 HG13 ILE A 109 -0.400 0.965 -4.809 1.00 0.15 H new ATOM 0 HG21 ILE A 109 -0.563 2.649 -8.188 1.00 0.20 H new ATOM 0 HG22 ILE A 109 0.606 3.903 -7.711 1.00 0.20 H new ATOM 0 HG23 ILE A 109 1.110 2.198 -7.781 1.00 0.20 H new ATOM 0 HD11 ILE A 109 -2.316 0.033 -6.056 1.00 0.16 H new ATOM 0 HD12 ILE A 109 -2.631 1.724 -5.599 1.00 0.16 H new ATOM 0 HD13 ILE A 109 -2.164 1.326 -7.269 1.00 0.16 H new ATOM 1793 N ALA A 110 1.046 5.436 -5.121 1.00 0.16 N ATOM 1794 CA ALA A 110 1.551 6.766 -5.408 1.00 0.17 C ATOM 1795 C ALA A 110 2.905 6.996 -4.738 1.00 0.16 C ATOM 1796 O ALA A 110 3.777 7.616 -5.327 1.00 0.19 O ATOM 1797 CB ALA A 110 0.513 7.807 -4.965 1.00 0.19 C ATOM 0 H ALA A 110 0.124 5.441 -4.684 1.00 0.16 H new ATOM 0 HA ALA A 110 1.711 6.868 -6.481 1.00 0.17 H new ATOM 0 HB1 ALA A 110 0.888 8.808 -5.178 1.00 0.19 H new ATOM 0 HB2 ALA A 110 -0.419 7.645 -5.507 1.00 0.19 H new ATOM 0 HB3 ALA A 110 0.332 7.708 -3.895 1.00 0.19 H new ATOM 1803 N LEU A 111 3.078 6.510 -3.511 1.00 0.14 N ATOM 1804 CA LEU A 111 4.229 6.725 -2.646 1.00 0.16 C ATOM 1805 C LEU A 111 5.327 5.671 -2.812 1.00 0.29 C ATOM 1806 O LEU A 111 6.459 5.893 -2.382 1.00 0.74 O ATOM 1807 CB LEU A 111 3.733 6.690 -1.192 1.00 0.19 C ATOM 1808 CG LEU A 111 3.185 8.013 -0.613 1.00 0.21 C ATOM 1809 CD1 LEU A 111 3.385 9.260 -1.469 1.00 0.55 C ATOM 1810 CD2 LEU A 111 1.699 7.895 -0.304 1.00 0.37 C ATOM 0 H LEU A 111 2.373 5.919 -3.070 1.00 0.14 H new ATOM 0 HA LEU A 111 4.671 7.683 -2.918 1.00 0.16 H new ATOM 0 HB2 LEU A 111 2.949 5.936 -1.118 1.00 0.19 H new ATOM 0 HB3 LEU A 111 4.556 6.357 -0.560 1.00 0.19 H new ATOM 0 HG LEU A 111 3.786 8.156 0.285 1.00 0.21 H new ATOM 0 HD11 LEU A 111 2.959 10.124 -0.958 1.00 0.55 H new ATOM 0 HD12 LEU A 111 4.450 9.423 -1.631 1.00 0.55 H new ATOM 0 HD13 LEU A 111 2.888 9.125 -2.430 1.00 0.55 H new ATOM 0 HD21 LEU A 111 1.336 8.839 0.103 1.00 0.37 H new ATOM 0 HD22 LEU A 111 1.155 7.661 -1.219 1.00 0.37 H new ATOM 0 HD23 LEU A 111 1.541 7.101 0.426 1.00 0.37 H new ATOM 1822 N VAL A 112 4.979 4.492 -3.321 1.00 0.22 N ATOM 1823 CA VAL A 112 5.879 3.377 -3.592 1.00 0.21 C ATOM 1824 C VAL A 112 6.513 3.612 -4.965 1.00 0.25 C ATOM 1825 O VAL A 112 7.706 3.381 -5.165 1.00 0.35 O ATOM 1826 CB VAL A 112 5.061 2.070 -3.496 1.00 0.20 C ATOM 1827 CG1 VAL A 112 5.762 0.815 -4.013 1.00 0.22 C ATOM 1828 CG2 VAL A 112 4.740 1.774 -2.026 1.00 0.22 C ATOM 0 H VAL A 112 4.012 4.279 -3.568 1.00 0.22 H new ATOM 0 HA VAL A 112 6.693 3.297 -2.871 1.00 0.21 H new ATOM 0 HB VAL A 112 4.188 2.259 -4.121 1.00 0.20 H new ATOM 0 HG11 VAL A 112 5.101 -0.044 -3.899 1.00 0.22 H new ATOM 0 HG12 VAL A 112 6.010 0.945 -5.066 1.00 0.22 H new ATOM 0 HG13 VAL A 112 6.676 0.648 -3.443 1.00 0.22 H new ATOM 0 HG21 VAL A 112 4.163 0.852 -1.958 1.00 0.22 H new ATOM 0 HG22 VAL A 112 5.669 1.663 -1.466 1.00 0.22 H new ATOM 0 HG23 VAL A 112 4.160 2.597 -1.607 1.00 0.22 H new ATOM 1838 N ASN A 113 5.682 4.077 -5.896 1.00 0.29 N ATOM 1839 CA ASN A 113 6.010 4.540 -7.228 1.00 0.29 C ATOM 1840 C ASN A 113 6.836 5.819 -7.111 1.00 0.32 C ATOM 1841 O ASN A 113 7.975 5.854 -7.569 1.00 0.41 O ATOM 1842 CB ASN A 113 4.688 4.750 -7.990 1.00 0.35 C ATOM 1843 CG ASN A 113 4.851 4.992 -9.479 1.00 1.49 C ATOM 1844 OD1 ASN A 113 5.681 5.777 -9.909 1.00 2.62 O ATOM 1845 ND2 ASN A 113 4.067 4.307 -10.297 1.00 2.12 N ATOM 0 H ASN A 113 4.680 4.142 -5.715 1.00 0.29 H new ATOM 0 HA ASN A 113 6.610 3.818 -7.782 1.00 0.29 H new ATOM 0 HB2 ASN A 113 4.056 3.874 -7.844 1.00 0.35 H new ATOM 0 HB3 ASN A 113 4.162 5.598 -7.552 1.00 0.35 H new ATOM 0 HD21 ASN A 113 4.151 4.431 -11.306 1.00 2.12 H new ATOM 0 HD22 ASN A 113 3.379 3.656 -9.918 1.00 2.12 H new ATOM 1852 N ASP A 114 6.290 6.844 -6.452 1.00 0.28 N ATOM 1853 CA ASP A 114 6.890 8.174 -6.415 1.00 0.36 C ATOM 1854 C ASP A 114 6.979 8.669 -4.965 1.00 0.30 C ATOM 1855 O ASP A 114 6.077 9.330 -4.453 1.00 0.29 O ATOM 1856 CB ASP A 114 6.096 9.125 -7.323 1.00 0.48 C ATOM 1857 CG ASP A 114 6.950 10.322 -7.735 1.00 0.80 C ATOM 1858 OD1 ASP A 114 8.085 10.071 -8.202 1.00 1.42 O ATOM 1859 OD2 ASP A 114 6.458 11.465 -7.611 1.00 1.23 O ATOM 0 H ASP A 114 5.417 6.772 -5.929 1.00 0.28 H new ATOM 0 HA ASP A 114 7.909 8.138 -6.800 1.00 0.36 H new ATOM 0 HB2 ASP A 114 5.759 8.590 -8.211 1.00 0.48 H new ATOM 0 HB3 ASP A 114 5.204 9.472 -6.802 1.00 0.48 H new ATOM 1864 N PRO A 115 8.036 8.288 -4.239 1.00 0.29 N ATOM 1865 CA PRO A 115 8.141 8.578 -2.819 1.00 0.25 C ATOM 1866 C PRO A 115 8.455 10.051 -2.549 1.00 0.26 C ATOM 1867 O PRO A 115 9.007 10.751 -3.393 1.00 0.41 O ATOM 1868 CB PRO A 115 9.246 7.656 -2.295 1.00 0.32 C ATOM 1869 CG PRO A 115 10.107 7.404 -3.530 1.00 0.42 C ATOM 1870 CD PRO A 115 9.100 7.406 -4.676 1.00 0.38 C ATOM 0 HA PRO A 115 7.194 8.399 -2.310 1.00 0.25 H new ATOM 0 HB2 PRO A 115 9.818 8.127 -1.495 1.00 0.32 H new ATOM 0 HB3 PRO A 115 8.839 6.729 -1.892 1.00 0.32 H new ATOM 0 HG2 PRO A 115 10.861 8.180 -3.658 1.00 0.42 H new ATOM 0 HG3 PRO A 115 10.636 6.453 -3.463 1.00 0.42 H new ATOM 0 HD2 PRO A 115 9.554 7.763 -5.600 1.00 0.38 H new ATOM 0 HD3 PRO A 115 8.724 6.402 -4.873 1.00 0.38 H new ATOM 1878 N GLN A 116 8.153 10.509 -1.329 1.00 0.30 N ATOM 1879 CA GLN A 116 8.319 11.903 -0.934 1.00 0.32 C ATOM 1880 C GLN A 116 9.420 11.985 0.125 1.00 0.31 C ATOM 1881 O GLN A 116 9.179 11.648 1.279 1.00 0.41 O ATOM 1882 CB GLN A 116 6.965 12.484 -0.475 1.00 0.37 C ATOM 1883 CG GLN A 116 6.389 11.857 0.808 1.00 2.02 C ATOM 1884 CD GLN A 116 4.894 12.106 0.979 1.00 1.99 C ATOM 1885 OE1 GLN A 116 4.371 13.148 0.606 1.00 2.03 O ATOM 1886 NE2 GLN A 116 4.175 11.154 1.561 1.00 2.50 N ATOM 0 H GLN A 116 7.784 9.915 -0.586 1.00 0.30 H new ATOM 0 HA GLN A 116 8.637 12.519 -1.776 1.00 0.32 H new ATOM 0 HB2 GLN A 116 7.082 13.556 -0.317 1.00 0.37 H new ATOM 0 HB3 GLN A 116 6.241 12.358 -1.280 1.00 0.37 H new ATOM 0 HG2 GLN A 116 6.573 10.783 0.794 1.00 2.02 H new ATOM 0 HG3 GLN A 116 6.919 12.260 1.671 1.00 2.02 H new ATOM 0 HE21 GLN A 116 4.624 10.291 1.867 1.00 2.50 H new ATOM 0 HE22 GLN A 116 3.173 11.286 1.702 1.00 2.50 H new ATOM 1895 N PRO A 117 10.641 12.420 -0.216 1.00 0.31 N ATOM 1896 CA PRO A 117 11.710 12.570 0.760 1.00 0.31 C ATOM 1897 C PRO A 117 11.608 13.883 1.546 1.00 0.40 C ATOM 1898 O PRO A 117 12.544 14.234 2.251 1.00 0.65 O ATOM 1899 CB PRO A 117 13.003 12.472 -0.058 1.00 0.37 C ATOM 1900 CG PRO A 117 12.590 13.109 -1.386 1.00 0.44 C ATOM 1901 CD PRO A 117 11.135 12.660 -1.560 1.00 0.37 C ATOM 0 HA PRO A 117 11.663 11.801 1.531 1.00 0.31 H new ATOM 0 HB2 PRO A 117 13.826 13.010 0.414 1.00 0.37 H new ATOM 0 HB3 PRO A 117 13.328 11.439 -0.185 1.00 0.37 H new ATOM 0 HG2 PRO A 117 12.674 14.195 -1.353 1.00 0.44 H new ATOM 0 HG3 PRO A 117 13.217 12.765 -2.208 1.00 0.44 H new ATOM 0 HD2 PRO A 117 10.545 13.426 -2.064 1.00 0.37 H new ATOM 0 HD3 PRO A 117 11.073 11.758 -2.168 1.00 0.37 H new ATOM 1909 N GLU A 118 10.477 14.590 1.451 1.00 0.34 N ATOM 1910 CA GLU A 118 10.152 15.756 2.263 1.00 0.37 C ATOM 1911 C GLU A 118 10.093 15.332 3.737 1.00 0.36 C ATOM 1912 O GLU A 118 10.988 15.632 4.522 1.00 0.65 O ATOM 1913 CB GLU A 118 8.822 16.354 1.743 1.00 0.44 C ATOM 1914 CG GLU A 118 8.935 17.833 1.358 1.00 1.93 C ATOM 1915 CD GLU A 118 8.926 18.764 2.571 1.00 3.03 C ATOM 1916 OE1 GLU A 118 8.451 19.909 2.412 1.00 3.82 O ATOM 1917 OE2 GLU A 118 9.398 18.317 3.637 1.00 4.23 O ATOM 0 H GLU A 118 9.742 14.355 0.784 1.00 0.34 H new ATOM 0 HA GLU A 118 10.912 16.534 2.187 1.00 0.37 H new ATOM 0 HB2 GLU A 118 8.489 15.784 0.876 1.00 0.44 H new ATOM 0 HB3 GLU A 118 8.056 16.242 2.511 1.00 0.44 H new ATOM 0 HG2 GLU A 118 9.855 17.988 0.794 1.00 1.93 H new ATOM 0 HG3 GLU A 118 8.108 18.096 0.698 1.00 1.93 H new ATOM 1924 N HIS A 119 9.066 14.565 4.110 1.00 0.21 N ATOM 1925 CA HIS A 119 8.891 14.122 5.488 1.00 0.21 C ATOM 1926 C HIS A 119 8.173 12.765 5.534 1.00 0.22 C ATOM 1927 O HIS A 119 7.029 12.667 5.980 1.00 0.28 O ATOM 1928 CB HIS A 119 8.153 15.222 6.267 1.00 0.28 C ATOM 1929 CG HIS A 119 6.938 15.765 5.552 1.00 0.83 C ATOM 1930 ND1 HIS A 119 5.810 15.047 5.233 1.00 2.12 N ATOM 1931 CD2 HIS A 119 6.790 17.027 5.040 1.00 1.42 C ATOM 1932 CE1 HIS A 119 4.995 15.861 4.540 1.00 2.43 C ATOM 1933 NE2 HIS A 119 5.544 17.077 4.405 1.00 1.86 N ATOM 0 H HIS A 119 8.342 14.238 3.471 1.00 0.21 H new ATOM 0 HA HIS A 119 9.858 13.963 5.965 1.00 0.21 H new ATOM 0 HB2 HIS A 119 7.846 14.825 7.235 1.00 0.28 H new ATOM 0 HB3 HIS A 119 8.844 16.042 6.463 1.00 0.28 H new ATOM 0 HD1 HIS A 119 5.625 14.074 5.478 1.00 2.12 H new ATOM 0 HD2 HIS A 119 7.503 17.834 5.113 1.00 1.42 H new ATOM 0 HE1 HIS A 119 4.031 15.575 4.146 1.00 2.43 H new ATOM 1941 N PRO A 120 8.820 11.701 5.046 1.00 0.19 N ATOM 1942 CA PRO A 120 8.264 10.358 5.049 1.00 0.19 C ATOM 1943 C PRO A 120 8.544 9.647 6.381 1.00 0.21 C ATOM 1944 O PRO A 120 9.162 10.209 7.282 1.00 0.28 O ATOM 1945 CB PRO A 120 8.978 9.675 3.890 1.00 0.19 C ATOM 1946 CG PRO A 120 10.374 10.284 3.957 1.00 0.20 C ATOM 1947 CD PRO A 120 10.113 11.725 4.384 1.00 0.20 C ATOM 0 HA PRO A 120 7.180 10.345 4.940 1.00 0.19 H new ATOM 0 HB2 PRO A 120 9.002 8.592 4.010 1.00 0.19 H new ATOM 0 HB3 PRO A 120 8.491 9.880 2.936 1.00 0.19 H new ATOM 0 HG2 PRO A 120 11.006 9.761 4.674 1.00 0.20 H new ATOM 0 HG3 PRO A 120 10.880 10.236 2.993 1.00 0.20 H new ATOM 0 HD2 PRO A 120 10.892 12.083 5.056 1.00 0.20 H new ATOM 0 HD3 PRO A 120 10.102 12.394 3.524 1.00 0.20 H new ATOM 1955 N LEU A 121 8.113 8.385 6.495 1.00 0.17 N ATOM 1956 CA LEU A 121 8.259 7.577 7.706 1.00 0.19 C ATOM 1957 C LEU A 121 9.729 7.378 8.061 1.00 0.25 C ATOM 1958 O LEU A 121 10.134 7.534 9.210 1.00 0.40 O ATOM 1959 CB LEU A 121 7.569 6.210 7.515 1.00 0.16 C ATOM 1960 CG LEU A 121 6.407 6.024 8.492 1.00 0.20 C ATOM 1961 CD1 LEU A 121 5.608 4.783 8.101 1.00 0.52 C ATOM 1962 CD2 LEU A 121 6.869 5.866 9.939 1.00 0.50 C ATOM 0 H LEU A 121 7.646 7.891 5.735 1.00 0.17 H new ATOM 0 HA LEU A 121 7.782 8.109 8.529 1.00 0.19 H new ATOM 0 HB2 LEU A 121 7.202 6.127 6.492 1.00 0.16 H new ATOM 0 HB3 LEU A 121 8.297 5.411 7.658 1.00 0.16 H new ATOM 0 HG LEU A 121 5.796 6.925 8.432 1.00 0.20 H new ATOM 0 HD11 LEU A 121 4.780 4.650 8.797 1.00 0.52 H new ATOM 0 HD12 LEU A 121 5.217 4.905 7.091 1.00 0.52 H new ATOM 0 HD13 LEU A 121 6.256 3.907 8.136 1.00 0.52 H new ATOM 0 HD21 LEU A 121 6.001 5.738 10.586 1.00 0.50 H new ATOM 0 HD22 LEU A 121 7.515 4.992 10.021 1.00 0.50 H new ATOM 0 HD23 LEU A 121 7.421 6.755 10.244 1.00 0.50 H new ATOM 1974 N ARG A 122 10.533 6.994 7.071 1.00 0.25 N ATOM 1975 CA ARG A 122 11.951 6.746 7.220 1.00 0.34 C ATOM 1976 C ARG A 122 12.671 7.727 6.315 1.00 0.33 C ATOM 1977 O ARG A 122 13.022 7.386 5.186 1.00 0.35 O ATOM 1978 CB ARG A 122 12.260 5.292 6.840 1.00 0.47 C ATOM 1979 CG ARG A 122 11.735 4.276 7.857 1.00 0.73 C ATOM 1980 CD ARG A 122 12.587 4.286 9.128 1.00 1.04 C ATOM 1981 NE ARG A 122 12.199 3.197 10.032 1.00 2.69 N ATOM 1982 CZ ARG A 122 12.940 2.690 11.022 1.00 3.04 C ATOM 1983 NH1 ARG A 122 12.466 1.671 11.734 1.00 5.25 N ATOM 1984 NH2 ARG A 122 14.144 3.196 11.295 1.00 2.11 N ATOM 0 H ARG A 122 10.198 6.845 6.119 1.00 0.25 H new ATOM 0 HA ARG A 122 12.281 6.887 8.249 1.00 0.34 H new ATOM 0 HB2 ARG A 122 11.823 5.078 5.864 1.00 0.47 H new ATOM 0 HB3 ARG A 122 13.339 5.171 6.740 1.00 0.47 H new ATOM 0 HG2 ARG A 122 10.699 4.507 8.107 1.00 0.73 H new ATOM 0 HG3 ARG A 122 11.742 3.279 7.417 1.00 0.73 H new ATOM 0 HD2 ARG A 122 13.640 4.187 8.865 1.00 1.04 H new ATOM 0 HD3 ARG A 122 12.475 5.243 9.637 1.00 1.04 H new ATOM 0 HE ARG A 122 11.275 2.788 9.891 1.00 2.69 H new ATOM 0 HH11 ARG A 122 11.546 1.285 11.522 1.00 5.25 H new ATOM 0 HH12 ARG A 122 13.023 1.276 12.492 1.00 5.25 H new ATOM 0 HH21 ARG A 122 14.506 3.976 10.746 1.00 2.11 H new ATOM 0 HH22 ARG A 122 14.703 2.803 12.052 1.00 2.11 H new ATOM 1998 N ALA A 123 12.907 8.937 6.828 1.00 0.33 N ATOM 1999 CA ALA A 123 13.657 9.963 6.120 1.00 0.31 C ATOM 2000 C ALA A 123 14.967 9.386 5.581 1.00 0.31 C ATOM 2001 O ALA A 123 15.338 9.671 4.455 1.00 0.32 O ATOM 2002 CB ALA A 123 13.905 11.163 7.037 1.00 0.34 C ATOM 0 H ALA A 123 12.580 9.228 7.749 1.00 0.33 H new ATOM 0 HA ALA A 123 13.073 10.310 5.268 1.00 0.31 H new ATOM 0 HB1 ALA A 123 14.467 11.924 6.496 1.00 0.34 H new ATOM 0 HB2 ALA A 123 12.950 11.578 7.360 1.00 0.34 H new ATOM 0 HB3 ALA A 123 14.475 10.843 7.909 1.00 0.34 H new ATOM 2008 N ASP A 124 15.633 8.533 6.358 1.00 0.35 N ATOM 2009 CA ASP A 124 16.893 7.890 5.989 1.00 0.36 C ATOM 2010 C ASP A 124 16.801 7.131 4.663 1.00 0.37 C ATOM 2011 O ASP A 124 17.615 7.342 3.770 1.00 0.40 O ATOM 2012 CB ASP A 124 17.317 6.938 7.122 1.00 0.50 C ATOM 2013 CG ASP A 124 18.719 7.253 7.624 1.00 1.30 C ATOM 2014 OD1 ASP A 124 19.600 6.384 7.459 1.00 2.33 O ATOM 2015 OD2 ASP A 124 18.868 8.355 8.195 1.00 2.41 O ATOM 0 H ASP A 124 15.303 8.263 7.285 1.00 0.35 H new ATOM 0 HA ASP A 124 17.641 8.670 5.848 1.00 0.36 H new ATOM 0 HB2 ASP A 124 16.609 7.015 7.947 1.00 0.50 H new ATOM 0 HB3 ASP A 124 17.280 5.909 6.766 1.00 0.50 H new ATOM 2020 N LEU A 125 15.801 6.262 4.488 1.00 0.35 N ATOM 2021 CA LEU A 125 15.613 5.573 3.213 1.00 0.37 C ATOM 2022 C LEU A 125 15.371 6.590 2.093 1.00 0.34 C ATOM 2023 O LEU A 125 15.725 6.366 0.938 1.00 0.37 O ATOM 2024 CB LEU A 125 14.436 4.591 3.313 1.00 0.40 C ATOM 2025 CG LEU A 125 14.637 3.492 4.364 1.00 0.47 C ATOM 2026 CD1 LEU A 125 13.402 2.588 4.392 1.00 1.27 C ATOM 2027 CD2 LEU A 125 15.880 2.657 4.070 1.00 1.27 C ATOM 0 H LEU A 125 15.117 6.022 5.206 1.00 0.35 H new ATOM 0 HA LEU A 125 16.516 5.010 2.979 1.00 0.37 H new ATOM 0 HB2 LEU A 125 13.529 5.147 3.551 1.00 0.40 H new ATOM 0 HB3 LEU A 125 14.279 4.126 2.340 1.00 0.40 H new ATOM 0 HG LEU A 125 14.776 3.968 5.335 1.00 0.47 H new ATOM 0 HD11 LEU A 125 13.541 1.805 5.138 1.00 1.27 H new ATOM 0 HD12 LEU A 125 12.523 3.180 4.647 1.00 1.27 H new ATOM 0 HD13 LEU A 125 13.261 2.134 3.411 1.00 1.27 H new ATOM 0 HD21 LEU A 125 15.991 1.888 4.835 1.00 1.27 H new ATOM 0 HD22 LEU A 125 15.778 2.185 3.093 1.00 1.27 H new ATOM 0 HD23 LEU A 125 16.760 3.301 4.072 1.00 1.27 H new ATOM 2039 N ALA A 126 14.745 7.712 2.440 1.00 0.29 N ATOM 2040 CA ALA A 126 14.437 8.790 1.522 1.00 0.26 C ATOM 2041 C ALA A 126 15.696 9.555 1.136 1.00 0.28 C ATOM 2042 O ALA A 126 15.748 10.152 0.068 1.00 0.26 O ATOM 2043 CB ALA A 126 13.429 9.736 2.172 1.00 0.28 C ATOM 0 H ALA A 126 14.433 7.895 3.394 1.00 0.29 H new ATOM 0 HA ALA A 126 14.009 8.364 0.614 1.00 0.26 H new ATOM 0 HB1 ALA A 126 13.196 10.548 1.483 1.00 0.28 H new ATOM 0 HB2 ALA A 126 12.517 9.188 2.410 1.00 0.28 H new ATOM 0 HB3 ALA A 126 13.854 10.148 3.087 1.00 0.28 H new ATOM 2049 N GLU A 127 16.690 9.558 2.016 1.00 0.33 N ATOM 2050 CA GLU A 127 17.966 10.216 1.841 1.00 0.33 C ATOM 2051 C GLU A 127 18.818 9.387 0.915 1.00 0.34 C ATOM 2052 O GLU A 127 19.234 9.882 -0.121 1.00 0.38 O ATOM 2053 CB GLU A 127 18.650 10.445 3.184 1.00 0.30 C ATOM 2054 CG GLU A 127 17.883 11.579 3.849 1.00 0.45 C ATOM 2055 CD GLU A 127 18.525 12.932 3.521 1.00 1.41 C ATOM 2056 OE1 GLU A 127 19.031 13.589 4.454 1.00 1.49 O ATOM 2057 OE2 GLU A 127 18.532 13.286 2.314 1.00 3.13 O ATOM 0 H GLU A 127 16.618 9.076 2.912 1.00 0.33 H new ATOM 0 HA GLU A 127 17.814 11.199 1.395 1.00 0.33 H new ATOM 0 HB2 GLU A 127 18.624 9.543 3.796 1.00 0.30 H new ATOM 0 HB3 GLU A 127 19.699 10.708 3.049 1.00 0.30 H new ATOM 0 HG2 GLU A 127 16.847 11.571 3.511 1.00 0.45 H new ATOM 0 HG3 GLU A 127 17.867 11.430 4.929 1.00 0.45 H new ATOM 2064 N GLU A 128 19.021 8.110 1.225 1.00 0.34 N ATOM 2065 CA GLU A 128 19.752 7.218 0.332 1.00 0.35 C ATOM 2066 C GLU A 128 19.110 7.262 -1.056 1.00 0.33 C ATOM 2067 O GLU A 128 19.808 7.263 -2.063 1.00 0.33 O ATOM 2068 CB GLU A 128 19.745 5.798 0.922 1.00 0.36 C ATOM 2069 CG GLU A 128 20.702 4.853 0.162 1.00 0.51 C ATOM 2070 CD GLU A 128 20.472 3.348 0.407 1.00 1.59 C ATOM 2071 OE1 GLU A 128 19.624 2.996 1.256 1.00 2.53 O ATOM 2072 OE2 GLU A 128 21.132 2.541 -0.294 1.00 2.45 O ATOM 0 H GLU A 128 18.691 7.671 2.085 1.00 0.34 H new ATOM 0 HA GLU A 128 20.790 7.536 0.233 1.00 0.35 H new ATOM 0 HB2 GLU A 128 20.034 5.840 1.972 1.00 0.36 H new ATOM 0 HB3 GLU A 128 18.733 5.395 0.886 1.00 0.36 H new ATOM 0 HG2 GLU A 128 20.608 5.049 -0.906 1.00 0.51 H new ATOM 0 HG3 GLU A 128 21.727 5.098 0.442 1.00 0.51 H new ATOM 2079 N TYR A 129 17.783 7.376 -1.119 1.00 0.33 N ATOM 2080 CA TYR A 129 17.064 7.521 -2.381 1.00 0.31 C ATOM 2081 C TYR A 129 17.376 8.856 -3.051 1.00 0.29 C ATOM 2082 O TYR A 129 17.719 8.909 -4.225 1.00 0.31 O ATOM 2083 CB TYR A 129 15.565 7.411 -2.084 1.00 0.36 C ATOM 2084 CG TYR A 129 14.643 7.954 -3.159 1.00 0.70 C ATOM 2085 CD1 TYR A 129 14.447 7.238 -4.349 1.00 1.65 C ATOM 2086 CD2 TYR A 129 13.992 9.188 -2.969 1.00 2.09 C ATOM 2087 CE1 TYR A 129 13.579 7.722 -5.342 1.00 2.01 C ATOM 2088 CE2 TYR A 129 13.146 9.699 -3.969 1.00 2.69 C ATOM 2089 CZ TYR A 129 12.932 8.965 -5.158 1.00 2.16 C ATOM 2090 OH TYR A 129 12.098 9.466 -6.111 1.00 2.89 O ATOM 0 H TYR A 129 17.179 7.370 -0.297 1.00 0.33 H new ATOM 0 HA TYR A 129 17.377 6.737 -3.071 1.00 0.31 H new ATOM 0 HB2 TYR A 129 15.322 6.362 -1.918 1.00 0.36 H new ATOM 0 HB3 TYR A 129 15.358 7.938 -1.152 1.00 0.36 H new ATOM 0 HD1 TYR A 129 14.969 6.305 -4.504 1.00 1.65 H new ATOM 0 HD2 TYR A 129 14.143 9.742 -2.054 1.00 2.09 H new ATOM 0 HE1 TYR A 129 13.407 7.148 -6.240 1.00 2.01 H new ATOM 0 HE2 TYR A 129 12.659 10.653 -3.829 1.00 2.69 H new ATOM 0 HH TYR A 129 11.742 10.329 -5.813 1.00 2.89 H new ATOM 2100 N SER A 130 17.201 9.954 -2.327 1.00 0.30 N ATOM 2101 CA SER A 130 17.242 11.309 -2.852 1.00 0.32 C ATOM 2102 C SER A 130 18.642 11.623 -3.369 1.00 0.38 C ATOM 2103 O SER A 130 18.809 12.345 -4.349 1.00 0.56 O ATOM 2104 CB SER A 130 16.823 12.261 -1.724 1.00 0.35 C ATOM 2105 OG SER A 130 17.056 13.621 -2.037 1.00 0.56 O ATOM 0 H SER A 130 17.020 9.922 -1.324 1.00 0.30 H new ATOM 0 HA SER A 130 16.558 11.426 -3.692 1.00 0.32 H new ATOM 0 HB2 SER A 130 15.764 12.119 -1.510 1.00 0.35 H new ATOM 0 HB3 SER A 130 17.369 12.003 -0.816 1.00 0.35 H new ATOM 0 HG SER A 130 17.511 13.684 -2.902 1.00 0.56 H new ATOM 2111 N LYS A 131 19.647 11.097 -2.676 1.00 0.36 N ATOM 2112 CA LYS A 131 21.049 11.258 -2.997 1.00 0.35 C ATOM 2113 C LYS A 131 21.433 10.260 -4.083 1.00 0.33 C ATOM 2114 O LYS A 131 22.168 10.624 -4.996 1.00 0.40 O ATOM 2115 CB LYS A 131 21.893 11.077 -1.725 1.00 0.36 C ATOM 2116 CG LYS A 131 22.042 12.394 -0.939 1.00 0.65 C ATOM 2117 CD LYS A 131 20.765 12.858 -0.215 1.00 1.07 C ATOM 2118 CE LYS A 131 20.189 14.157 -0.786 1.00 2.80 C ATOM 2119 NZ LYS A 131 18.942 14.534 -0.084 1.00 3.61 N ATOM 0 H LYS A 131 19.494 10.526 -1.845 1.00 0.36 H new ATOM 0 HA LYS A 131 21.239 12.261 -3.379 1.00 0.35 H new ATOM 0 HB2 LYS A 131 21.430 10.324 -1.087 1.00 0.36 H new ATOM 0 HB3 LYS A 131 22.880 10.702 -1.995 1.00 0.36 H new ATOM 0 HG2 LYS A 131 22.837 12.274 -0.203 1.00 0.65 H new ATOM 0 HG3 LYS A 131 22.359 13.178 -1.627 1.00 0.65 H new ATOM 0 HD2 LYS A 131 20.011 12.073 -0.281 1.00 1.07 H new ATOM 0 HD3 LYS A 131 20.985 12.999 0.843 1.00 1.07 H new ATOM 0 HE2 LYS A 131 20.922 14.958 -0.690 1.00 2.80 H new ATOM 0 HE3 LYS A 131 19.989 14.034 -1.850 1.00 2.80 H new ATOM 0 HZ1 LYS A 131 18.939 15.559 0.093 1.00 3.61 H new ATOM 0 HZ2 LYS A 131 18.122 14.282 -0.673 1.00 3.61 H new ATOM 0 HZ3 LYS A 131 18.887 14.026 0.822 1.00 3.61 H new ATOM 2133 N ASP A 132 20.942 9.020 -4.011 1.00 0.30 N ATOM 2134 CA ASP A 132 21.207 8.036 -5.049 1.00 0.34 C ATOM 2135 C ASP A 132 20.025 7.101 -5.303 1.00 0.32 C ATOM 2136 O ASP A 132 19.935 5.976 -4.804 1.00 0.37 O ATOM 2137 CB ASP A 132 22.452 7.204 -4.757 1.00 0.51 C ATOM 2138 CG ASP A 132 22.669 6.276 -5.952 1.00 0.79 C ATOM 2139 OD1 ASP A 132 23.107 5.124 -5.747 1.00 1.65 O ATOM 2140 OD2 ASP A 132 22.300 6.698 -7.074 1.00 1.98 O ATOM 0 H ASP A 132 20.361 8.680 -3.245 1.00 0.30 H new ATOM 0 HA ASP A 132 21.377 8.623 -5.951 1.00 0.34 H new ATOM 0 HB2 ASP A 132 23.319 7.848 -4.608 1.00 0.51 H new ATOM 0 HB3 ASP A 132 22.323 6.627 -3.841 1.00 0.51 H new ATOM 2145 N ARG A 133 19.155 7.516 -6.219 1.00 0.30 N ATOM 2146 CA ARG A 133 18.047 6.675 -6.638 1.00 0.31 C ATOM 2147 C ARG A 133 18.546 5.369 -7.246 1.00 0.33 C ATOM 2148 O ARG A 133 17.768 4.425 -7.318 1.00 0.34 O ATOM 2149 CB ARG A 133 17.134 7.356 -7.664 1.00 0.35 C ATOM 2150 CG ARG A 133 16.675 8.770 -7.256 1.00 0.58 C ATOM 2151 CD ARG A 133 16.628 9.730 -8.446 1.00 1.51 C ATOM 2152 NE ARG A 133 15.471 9.497 -9.318 1.00 2.22 N ATOM 2153 CZ ARG A 133 15.294 10.090 -10.506 1.00 2.97 C ATOM 2154 NH1 ARG A 133 14.161 9.907 -11.184 1.00 4.05 N ATOM 2155 NH2 ARG A 133 16.252 10.870 -11.012 1.00 3.36 N ATOM 0 H ARG A 133 19.198 8.424 -6.681 1.00 0.30 H new ATOM 0 HA ARG A 133 17.473 6.482 -5.732 1.00 0.31 H new ATOM 0 HB2 ARG A 133 17.659 7.417 -8.618 1.00 0.35 H new ATOM 0 HB3 ARG A 133 16.255 6.732 -7.823 1.00 0.35 H new ATOM 0 HG2 ARG A 133 15.687 8.711 -6.800 1.00 0.58 H new ATOM 0 HG3 ARG A 133 17.353 9.165 -6.499 1.00 0.58 H new ATOM 0 HD2 ARG A 133 16.600 10.756 -8.079 1.00 1.51 H new ATOM 0 HD3 ARG A 133 17.543 9.625 -9.028 1.00 1.51 H new ATOM 0 HE ARG A 133 14.757 8.842 -8.999 1.00 2.22 H new ATOM 0 HH11 ARG A 133 13.426 9.314 -10.798 1.00 4.05 H new ATOM 0 HH12 ARG A 133 14.029 10.360 -12.088 1.00 4.05 H new ATOM 0 HH21 ARG A 133 17.119 11.014 -10.494 1.00 3.36 H new ATOM 0 HH22 ARG A 133 16.117 11.322 -11.917 1.00 3.36 H new ATOM 2169 N LYS A 134 19.794 5.292 -7.725 1.00 0.35 N ATOM 2170 CA LYS A 134 20.304 4.051 -8.291 1.00 0.34 C ATOM 2171 C LYS A 134 20.294 2.995 -7.208 1.00 0.41 C ATOM 2172 O LYS A 134 19.736 1.931 -7.436 1.00 0.52 O ATOM 2173 CB LYS A 134 21.703 4.214 -8.884 1.00 0.31 C ATOM 2174 CG LYS A 134 21.674 5.207 -10.055 1.00 0.47 C ATOM 2175 CD LYS A 134 23.045 5.852 -10.246 1.00 1.96 C ATOM 2176 CE LYS A 134 22.982 6.834 -11.417 1.00 2.60 C ATOM 2177 NZ LYS A 134 24.276 7.520 -11.615 1.00 3.57 N ATOM 0 H LYS A 134 20.457 6.067 -7.730 1.00 0.35 H new ATOM 0 HA LYS A 134 19.660 3.750 -9.117 1.00 0.34 H new ATOM 0 HB2 LYS A 134 22.392 4.567 -8.116 1.00 0.31 H new ATOM 0 HB3 LYS A 134 22.075 3.248 -9.226 1.00 0.31 H new ATOM 0 HG2 LYS A 134 21.378 4.692 -10.969 1.00 0.47 H new ATOM 0 HG3 LYS A 134 20.926 5.978 -9.867 1.00 0.47 H new ATOM 0 HD2 LYS A 134 23.345 6.372 -9.336 1.00 1.96 H new ATOM 0 HD3 LYS A 134 23.796 5.086 -10.438 1.00 1.96 H new ATOM 0 HE2 LYS A 134 22.708 6.300 -12.327 1.00 2.60 H new ATOM 0 HE3 LYS A 134 22.201 7.572 -11.233 1.00 2.60 H new ATOM 0 HZ1 LYS A 134 24.201 8.179 -12.416 1.00 3.57 H new ATOM 0 HZ2 LYS A 134 24.524 8.048 -10.754 1.00 3.57 H new ATOM 0 HZ3 LYS A 134 25.015 6.816 -11.814 1.00 3.57 H new ATOM 2191 N LYS A 135 20.852 3.257 -6.026 1.00 0.40 N ATOM 2192 CA LYS A 135 20.760 2.305 -4.936 1.00 0.46 C ATOM 2193 C LYS A 135 19.340 2.003 -4.523 1.00 0.45 C ATOM 2194 O LYS A 135 19.038 0.849 -4.263 1.00 0.53 O ATOM 2195 CB LYS A 135 21.539 2.793 -3.718 1.00 0.48 C ATOM 2196 CG LYS A 135 22.987 2.337 -3.810 1.00 0.61 C ATOM 2197 CD LYS A 135 23.071 0.826 -4.010 1.00 3.24 C ATOM 2198 CE LYS A 135 24.211 0.255 -3.177 1.00 3.87 C ATOM 2199 NZ LYS A 135 24.066 -1.208 -3.016 1.00 6.10 N ATOM 0 H LYS A 135 21.365 4.111 -5.807 1.00 0.40 H new ATOM 0 HA LYS A 135 21.196 1.382 -5.317 1.00 0.46 H new ATOM 0 HB2 LYS A 135 21.495 3.881 -3.659 1.00 0.48 H new ATOM 0 HB3 LYS A 135 21.084 2.406 -2.806 1.00 0.48 H new ATOM 0 HG2 LYS A 135 23.481 2.845 -4.638 1.00 0.61 H new ATOM 0 HG3 LYS A 135 23.519 2.618 -2.901 1.00 0.61 H new ATOM 0 HD2 LYS A 135 22.129 0.359 -3.721 1.00 3.24 H new ATOM 0 HD3 LYS A 135 23.230 0.598 -5.064 1.00 3.24 H new ATOM 0 HE2 LYS A 135 25.164 0.479 -3.656 1.00 3.87 H new ATOM 0 HE3 LYS A 135 24.226 0.733 -2.197 1.00 3.87 H new ATOM 0 HZ1 LYS A 135 24.638 -1.527 -2.208 1.00 6.10 H new ATOM 0 HZ2 LYS A 135 23.067 -1.441 -2.846 1.00 6.10 H new ATOM 0 HZ3 LYS A 135 24.391 -1.686 -3.881 1.00 6.10 H new ATOM 2213 N PHE A 136 18.453 2.984 -4.471 1.00 0.42 N ATOM 2214 CA PHE A 136 17.065 2.675 -4.148 1.00 0.45 C ATOM 2215 C PHE A 136 16.534 1.667 -5.164 1.00 0.40 C ATOM 2216 O PHE A 136 15.859 0.708 -4.808 1.00 0.43 O ATOM 2217 CB PHE A 136 16.235 3.959 -4.136 1.00 0.48 C ATOM 2218 CG PHE A 136 14.737 3.771 -4.296 1.00 0.90 C ATOM 2219 CD1 PHE A 136 14.163 3.839 -5.581 1.00 2.41 C ATOM 2220 CD2 PHE A 136 13.909 3.605 -3.170 1.00 1.55 C ATOM 2221 CE1 PHE A 136 12.770 3.766 -5.740 1.00 2.90 C ATOM 2222 CE2 PHE A 136 12.515 3.532 -3.330 1.00 1.83 C ATOM 2223 CZ PHE A 136 11.944 3.629 -4.613 1.00 2.10 C ATOM 0 H PHE A 136 18.656 3.969 -4.641 1.00 0.42 H new ATOM 0 HA PHE A 136 16.996 2.233 -3.154 1.00 0.45 H new ATOM 0 HB2 PHE A 136 16.420 4.481 -3.197 1.00 0.48 H new ATOM 0 HB3 PHE A 136 16.590 4.608 -4.937 1.00 0.48 H new ATOM 0 HD1 PHE A 136 14.798 3.948 -6.448 1.00 2.41 H new ATOM 0 HD2 PHE A 136 14.345 3.534 -2.184 1.00 1.55 H new ATOM 0 HE1 PHE A 136 12.335 3.815 -6.727 1.00 2.90 H new ATOM 0 HE2 PHE A 136 11.880 3.401 -2.466 1.00 1.83 H new ATOM 0 HZ PHE A 136 10.871 3.598 -4.730 1.00 2.10 H new ATOM 2233 N CYS A 137 16.867 1.879 -6.434 1.00 0.32 N ATOM 2234 CA CYS A 137 16.390 1.082 -7.540 1.00 0.30 C ATOM 2235 C CYS A 137 16.964 -0.336 -7.429 1.00 0.27 C ATOM 2236 O CYS A 137 16.254 -1.318 -7.594 1.00 0.28 O ATOM 2237 CB CYS A 137 16.794 1.751 -8.858 1.00 0.30 C ATOM 2238 SG CYS A 137 15.989 0.928 -10.260 1.00 1.73 S ATOM 0 H CYS A 137 17.493 2.632 -6.721 1.00 0.32 H new ATOM 0 HA CYS A 137 15.303 1.010 -7.515 1.00 0.30 H new ATOM 0 HB2 CYS A 137 16.516 2.805 -8.838 1.00 0.30 H new ATOM 0 HB3 CYS A 137 17.877 1.710 -8.977 1.00 0.30 H new ATOM 0 HG CYS A 137 16.343 1.511 -11.367 1.00 1.73 H new ATOM 2244 N LYS A 138 18.272 -0.448 -7.180 1.00 0.27 N ATOM 2245 CA LYS A 138 19.006 -1.712 -7.256 1.00 0.25 C ATOM 2246 C LYS A 138 18.778 -2.515 -5.987 1.00 0.25 C ATOM 2247 O LYS A 138 18.431 -3.691 -6.055 1.00 0.28 O ATOM 2248 CB LYS A 138 20.510 -1.472 -7.476 1.00 0.38 C ATOM 2249 CG LYS A 138 20.952 -1.837 -8.899 1.00 0.62 C ATOM 2250 CD LYS A 138 20.405 -0.890 -9.981 1.00 0.95 C ATOM 2251 CE LYS A 138 19.390 -1.566 -10.912 1.00 2.21 C ATOM 2252 NZ LYS A 138 19.948 -2.726 -11.638 1.00 3.11 N ATOM 0 H LYS A 138 18.856 0.346 -6.917 1.00 0.27 H new ATOM 0 HA LYS A 138 18.632 -2.276 -8.111 1.00 0.25 H new ATOM 0 HB2 LYS A 138 20.741 -0.424 -7.283 1.00 0.38 H new ATOM 0 HB3 LYS A 138 21.079 -2.062 -6.758 1.00 0.38 H new ATOM 0 HG2 LYS A 138 22.041 -1.834 -8.943 1.00 0.62 H new ATOM 0 HG3 LYS A 138 20.627 -2.853 -9.121 1.00 0.62 H new ATOM 0 HD2 LYS A 138 19.934 -0.032 -9.501 1.00 0.95 H new ATOM 0 HD3 LYS A 138 21.235 -0.507 -10.574 1.00 0.95 H new ATOM 0 HE2 LYS A 138 18.530 -1.892 -10.326 1.00 2.21 H new ATOM 0 HE3 LYS A 138 19.026 -0.835 -11.634 1.00 2.21 H new ATOM 0 HZ1 LYS A 138 19.872 -2.564 -12.662 1.00 3.11 H new ATOM 0 HZ2 LYS A 138 20.948 -2.848 -11.381 1.00 3.11 H new ATOM 0 HZ3 LYS A 138 19.417 -3.583 -11.383 1.00 3.11 H new ATOM 2266 N ASN A 139 18.974 -1.886 -4.828 1.00 0.31 N ATOM 2267 CA ASN A 139 18.644 -2.513 -3.554 1.00 0.41 C ATOM 2268 C ASN A 139 17.210 -3.035 -3.610 1.00 0.41 C ATOM 2269 O ASN A 139 16.968 -4.176 -3.228 1.00 0.45 O ATOM 2270 CB ASN A 139 18.789 -1.570 -2.351 1.00 0.61 C ATOM 2271 CG ASN A 139 20.161 -0.950 -2.105 1.00 0.77 C ATOM 2272 OD1 ASN A 139 21.194 -1.488 -2.509 1.00 1.65 O ATOM 2273 ND2 ASN A 139 20.169 0.184 -1.409 1.00 0.69 N ATOM 0 H ASN A 139 19.359 -0.945 -4.748 1.00 0.31 H new ATOM 0 HA ASN A 139 19.358 -3.324 -3.407 1.00 0.41 H new ATOM 0 HB2 ASN A 139 18.070 -0.760 -2.470 1.00 0.61 H new ATOM 0 HB3 ASN A 139 18.503 -2.121 -1.455 1.00 0.61 H new ATOM 0 HD21 ASN A 139 21.054 0.642 -1.191 1.00 0.69 H new ATOM 0 HD22 ASN A 139 19.290 0.595 -1.094 1.00 0.69 H new ATOM 2280 N ALA A 140 16.262 -2.225 -4.102 1.00 0.43 N ATOM 2281 CA ALA A 140 14.890 -2.680 -4.269 1.00 0.46 C ATOM 2282 C ALA A 140 14.820 -3.896 -5.188 1.00 0.42 C ATOM 2283 O ALA A 140 14.090 -4.817 -4.883 1.00 0.45 O ATOM 2284 CB ALA A 140 13.980 -1.562 -4.777 1.00 0.51 C ATOM 0 H ALA A 140 16.426 -1.260 -4.387 1.00 0.43 H new ATOM 0 HA ALA A 140 14.528 -2.977 -3.285 1.00 0.46 H new ATOM 0 HB1 ALA A 140 12.964 -1.942 -4.889 1.00 0.51 H new ATOM 0 HB2 ALA A 140 13.983 -0.738 -4.063 1.00 0.51 H new ATOM 0 HB3 ALA A 140 14.343 -1.208 -5.742 1.00 0.51 H new ATOM 2290 N GLU A 141 15.538 -3.936 -6.306 1.00 0.39 N ATOM 2291 CA GLU A 141 15.520 -5.048 -7.253 1.00 0.33 C ATOM 2292 C GLU A 141 15.760 -6.385 -6.548 1.00 0.28 C ATOM 2293 O GLU A 141 15.094 -7.383 -6.834 1.00 0.31 O ATOM 2294 CB GLU A 141 16.566 -4.766 -8.345 1.00 0.33 C ATOM 2295 CG GLU A 141 16.217 -5.385 -9.699 1.00 0.60 C ATOM 2296 CD GLU A 141 17.313 -5.117 -10.738 1.00 0.77 C ATOM 2297 OE1 GLU A 141 17.981 -4.063 -10.660 1.00 2.08 O ATOM 2298 OE2 GLU A 141 17.477 -5.980 -11.628 1.00 1.79 O ATOM 0 H GLU A 141 16.163 -3.180 -6.586 1.00 0.39 H new ATOM 0 HA GLU A 141 14.536 -5.130 -7.715 1.00 0.33 H new ATOM 0 HB2 GLU A 141 16.673 -3.688 -8.464 1.00 0.33 H new ATOM 0 HB3 GLU A 141 17.533 -5.148 -8.018 1.00 0.33 H new ATOM 0 HG2 GLU A 141 16.078 -6.460 -9.584 1.00 0.60 H new ATOM 0 HG3 GLU A 141 15.270 -4.977 -10.054 1.00 0.60 H new ATOM 2305 N GLU A 142 16.699 -6.407 -5.605 1.00 0.29 N ATOM 2306 CA GLU A 142 16.972 -7.601 -4.823 1.00 0.30 C ATOM 2307 C GLU A 142 15.909 -7.804 -3.756 1.00 0.32 C ATOM 2308 O GLU A 142 15.447 -8.925 -3.577 1.00 0.33 O ATOM 2309 CB GLU A 142 18.362 -7.507 -4.183 1.00 0.41 C ATOM 2310 CG GLU A 142 19.408 -8.186 -5.079 1.00 0.60 C ATOM 2311 CD GLU A 142 19.686 -9.610 -4.588 1.00 1.91 C ATOM 2312 OE1 GLU A 142 19.065 -10.568 -5.118 1.00 3.29 O ATOM 2313 OE2 GLU A 142 20.439 -9.765 -3.601 1.00 2.43 O ATOM 0 H GLU A 142 17.284 -5.606 -5.366 1.00 0.29 H new ATOM 0 HA GLU A 142 16.950 -8.462 -5.491 1.00 0.30 H new ATOM 0 HB2 GLU A 142 18.629 -6.461 -4.029 1.00 0.41 H new ATOM 0 HB3 GLU A 142 18.351 -7.981 -3.202 1.00 0.41 H new ATOM 0 HG2 GLU A 142 19.052 -8.212 -6.109 1.00 0.60 H new ATOM 0 HG3 GLU A 142 20.331 -7.606 -5.075 1.00 0.60 H new ATOM 2320 N PHE A 143 15.524 -6.756 -3.027 1.00 0.36 N ATOM 2321 CA PHE A 143 14.551 -6.878 -1.939 1.00 0.37 C ATOM 2322 C PHE A 143 13.233 -7.468 -2.447 1.00 0.29 C ATOM 2323 O PHE A 143 12.689 -8.412 -1.874 1.00 0.29 O ATOM 2324 CB PHE A 143 14.337 -5.516 -1.270 1.00 0.49 C ATOM 2325 CG PHE A 143 14.806 -5.448 0.171 1.00 1.19 C ATOM 2326 CD1 PHE A 143 13.985 -4.855 1.147 1.00 1.21 C ATOM 2327 CD2 PHE A 143 16.085 -5.913 0.529 1.00 2.17 C ATOM 2328 CE1 PHE A 143 14.437 -4.723 2.471 1.00 2.03 C ATOM 2329 CE2 PHE A 143 16.532 -5.796 1.857 1.00 2.99 C ATOM 2330 CZ PHE A 143 15.709 -5.198 2.827 1.00 2.89 C ATOM 0 H PHE A 143 15.873 -5.808 -3.171 1.00 0.36 H new ATOM 0 HA PHE A 143 14.945 -7.566 -1.191 1.00 0.37 H new ATOM 0 HB2 PHE A 143 14.862 -4.754 -1.847 1.00 0.49 H new ATOM 0 HB3 PHE A 143 13.276 -5.269 -1.307 1.00 0.49 H new ATOM 0 HD1 PHE A 143 13.002 -4.499 0.877 1.00 1.21 H new ATOM 0 HD2 PHE A 143 16.724 -6.361 -0.218 1.00 2.17 H new ATOM 0 HE1 PHE A 143 13.807 -4.257 3.214 1.00 2.03 H new ATOM 0 HE2 PHE A 143 17.509 -6.166 2.132 1.00 2.99 H new ATOM 0 HZ PHE A 143 16.055 -5.104 3.846 1.00 2.89 H new ATOM 2340 N THR A 144 12.752 -6.938 -3.563 1.00 0.28 N ATOM 2341 CA THR A 144 11.675 -7.455 -4.374 1.00 0.27 C ATOM 2342 C THR A 144 11.883 -8.953 -4.610 1.00 0.25 C ATOM 2343 O THR A 144 10.981 -9.743 -4.358 1.00 0.29 O ATOM 2344 CB THR A 144 11.618 -6.651 -5.684 1.00 0.35 C ATOM 2345 OG1 THR A 144 11.182 -5.329 -5.437 1.00 0.35 O ATOM 2346 CG2 THR A 144 10.631 -7.277 -6.652 1.00 0.40 C ATOM 0 H THR A 144 13.136 -6.074 -3.947 1.00 0.28 H new ATOM 0 HA THR A 144 10.715 -7.344 -3.869 1.00 0.27 H new ATOM 0 HB THR A 144 12.622 -6.651 -6.107 1.00 0.35 H new ATOM 0 HG1 THR A 144 10.892 -4.918 -6.278 1.00 0.35 H new ATOM 0 HG21 THR A 144 10.605 -6.694 -7.573 1.00 0.40 H new ATOM 0 HG22 THR A 144 10.940 -8.298 -6.877 1.00 0.40 H new ATOM 0 HG23 THR A 144 9.638 -7.290 -6.202 1.00 0.40 H new ATOM 2354 N LYS A 145 13.053 -9.376 -5.090 1.00 0.28 N ATOM 2355 CA LYS A 145 13.274 -10.793 -5.373 1.00 0.32 C ATOM 2356 C LYS A 145 13.434 -11.631 -4.096 1.00 0.34 C ATOM 2357 O LYS A 145 13.326 -12.852 -4.151 1.00 0.47 O ATOM 2358 CB LYS A 145 14.466 -10.925 -6.332 1.00 0.41 C ATOM 2359 CG LYS A 145 14.679 -12.369 -6.808 1.00 1.19 C ATOM 2360 CD LYS A 145 15.737 -13.118 -5.981 1.00 1.71 C ATOM 2361 CE LYS A 145 17.019 -13.352 -6.792 1.00 2.04 C ATOM 2362 NZ LYS A 145 17.710 -12.093 -7.155 1.00 3.40 N ATOM 0 H LYS A 145 13.849 -8.770 -5.288 1.00 0.28 H new ATOM 0 HA LYS A 145 12.389 -11.203 -5.859 1.00 0.32 H new ATOM 0 HB2 LYS A 145 14.306 -10.281 -7.196 1.00 0.41 H new ATOM 0 HB3 LYS A 145 15.370 -10.573 -5.834 1.00 0.41 H new ATOM 0 HG2 LYS A 145 13.733 -12.908 -6.754 1.00 1.19 H new ATOM 0 HG3 LYS A 145 14.982 -12.361 -7.855 1.00 1.19 H new ATOM 0 HD2 LYS A 145 15.972 -12.546 -5.084 1.00 1.71 H new ATOM 0 HD3 LYS A 145 15.333 -14.075 -5.652 1.00 1.71 H new ATOM 0 HE2 LYS A 145 17.698 -13.980 -6.215 1.00 2.04 H new ATOM 0 HE3 LYS A 145 16.773 -13.900 -7.701 1.00 2.04 H new ATOM 0 HZ1 LYS A 145 18.467 -12.297 -7.838 1.00 3.40 H new ATOM 0 HZ2 LYS A 145 17.028 -11.433 -7.581 1.00 3.40 H new ATOM 0 HZ3 LYS A 145 18.121 -11.664 -6.301 1.00 3.40 H new ATOM 2376 N LYS A 146 13.738 -11.012 -2.955 1.00 0.30 N ATOM 2377 CA LYS A 146 13.948 -11.696 -1.683 1.00 0.33 C ATOM 2378 C LYS A 146 12.602 -12.041 -1.058 1.00 0.30 C ATOM 2379 O LYS A 146 12.323 -13.202 -0.776 1.00 0.36 O ATOM 2380 CB LYS A 146 14.770 -10.798 -0.740 1.00 0.38 C ATOM 2381 CG LYS A 146 16.223 -11.214 -0.627 1.00 0.75 C ATOM 2382 CD LYS A 146 17.026 -11.081 -1.919 1.00 1.50 C ATOM 2383 CE LYS A 146 18.055 -12.195 -1.814 1.00 2.70 C ATOM 2384 NZ LYS A 146 19.213 -12.011 -2.715 1.00 3.37 N ATOM 0 H LYS A 146 13.847 -10.000 -2.890 1.00 0.30 H new ATOM 0 HA LYS A 146 14.501 -12.620 -1.852 1.00 0.33 H new ATOM 0 HB2 LYS A 146 14.721 -9.769 -1.096 1.00 0.38 H new ATOM 0 HB3 LYS A 146 14.317 -10.814 0.251 1.00 0.38 H new ATOM 0 HG2 LYS A 146 16.701 -10.611 0.145 1.00 0.75 H new ATOM 0 HG3 LYS A 146 16.265 -12.251 -0.294 1.00 0.75 H new ATOM 0 HD2 LYS A 146 16.394 -11.201 -2.799 1.00 1.50 H new ATOM 0 HD3 LYS A 146 17.500 -10.103 -1.998 1.00 1.50 H new ATOM 0 HE2 LYS A 146 18.410 -12.256 -0.785 1.00 2.70 H new ATOM 0 HE3 LYS A 146 17.574 -13.146 -2.042 1.00 2.70 H new ATOM 0 HZ1 LYS A 146 19.851 -12.828 -2.632 1.00 3.37 H new ATOM 0 HZ2 LYS A 146 18.880 -11.931 -3.697 1.00 3.37 H new ATOM 0 HZ3 LYS A 146 19.724 -11.145 -2.451 1.00 3.37 H new ATOM 2398 N TYR A 147 11.801 -11.013 -0.794 1.00 0.27 N ATOM 2399 CA TYR A 147 10.540 -11.100 -0.075 1.00 0.26 C ATOM 2400 C TYR A 147 9.374 -10.610 -0.920 1.00 0.23 C ATOM 2401 O TYR A 147 8.238 -10.944 -0.608 1.00 0.29 O ATOM 2402 CB TYR A 147 10.609 -10.244 1.190 1.00 0.33 C ATOM 2403 CG TYR A 147 10.802 -11.090 2.417 1.00 0.36 C ATOM 2404 CD1 TYR A 147 9.678 -11.603 3.085 1.00 1.83 C ATOM 2405 CD2 TYR A 147 12.096 -11.440 2.830 1.00 1.77 C ATOM 2406 CE1 TYR A 147 9.845 -12.466 4.178 1.00 1.87 C ATOM 2407 CE2 TYR A 147 12.270 -12.299 3.925 1.00 1.76 C ATOM 2408 CZ TYR A 147 11.146 -12.814 4.609 1.00 0.46 C ATOM 2409 OH TYR A 147 11.329 -13.638 5.677 1.00 0.54 O ATOM 0 H TYR A 147 12.023 -10.062 -1.087 1.00 0.27 H new ATOM 0 HA TYR A 147 10.378 -12.149 0.173 1.00 0.26 H new ATOM 0 HB2 TYR A 147 11.430 -9.532 1.105 1.00 0.33 H new ATOM 0 HB3 TYR A 147 9.692 -9.663 1.288 1.00 0.33 H new ATOM 0 HD1 TYR A 147 8.685 -11.333 2.757 1.00 1.83 H new ATOM 0 HD2 TYR A 147 12.956 -11.049 2.306 1.00 1.77 H new ATOM 0 HE1 TYR A 147 8.981 -12.864 4.690 1.00 1.87 H new ATOM 0 HE2 TYR A 147 13.266 -12.567 4.246 1.00 1.76 H new ATOM 0 HH TYR A 147 12.288 -13.768 5.829 1.00 0.54 H new ATOM 2419 N GLY A 148 9.627 -9.743 -1.903 1.00 0.22 N ATOM 2420 CA GLY A 148 8.575 -9.107 -2.671 1.00 0.23 C ATOM 2421 C GLY A 148 7.646 -10.140 -3.292 1.00 0.23 C ATOM 2422 O GLY A 148 8.060 -11.217 -3.716 1.00 0.30 O ATOM 0 H GLY A 148 10.569 -9.468 -2.182 1.00 0.22 H new ATOM 0 HA2 GLY A 148 8.003 -8.440 -2.026 1.00 0.23 H new ATOM 0 HA3 GLY A 148 9.015 -8.491 -3.456 1.00 0.23 H new ATOM 2426 N GLU A 149 6.361 -9.802 -3.320 1.00 0.26 N ATOM 2427 CA GLU A 149 5.326 -10.743 -3.686 1.00 0.31 C ATOM 2428 C GLU A 149 5.442 -11.093 -5.160 1.00 0.34 C ATOM 2429 O GLU A 149 5.980 -10.354 -5.982 1.00 0.38 O ATOM 2430 CB GLU A 149 3.971 -10.116 -3.381 1.00 0.47 C ATOM 2431 CG GLU A 149 2.756 -11.048 -3.419 1.00 0.81 C ATOM 2432 CD GLU A 149 2.693 -12.069 -2.291 1.00 0.94 C ATOM 2433 OE1 GLU A 149 3.756 -12.391 -1.726 1.00 2.14 O ATOM 2434 OE2 GLU A 149 1.551 -12.494 -2.003 1.00 1.76 O ATOM 0 H GLU A 149 6.016 -8.870 -3.089 1.00 0.26 H new ATOM 0 HA GLU A 149 5.433 -11.664 -3.114 1.00 0.31 H new ATOM 0 HB2 GLU A 149 4.021 -9.663 -2.391 1.00 0.47 H new ATOM 0 HB3 GLU A 149 3.802 -9.308 -4.093 1.00 0.47 H new ATOM 0 HG2 GLU A 149 1.851 -10.442 -3.391 1.00 0.81 H new ATOM 0 HG3 GLU A 149 2.754 -11.580 -4.371 1.00 0.81 H new ATOM 2441 N LYS A 150 4.915 -12.245 -5.523 1.00 0.38 N ATOM 2442 CA LYS A 150 5.058 -12.714 -6.885 1.00 0.42 C ATOM 2443 C LYS A 150 4.011 -12.010 -7.734 1.00 0.41 C ATOM 2444 O LYS A 150 2.841 -12.381 -7.708 1.00 0.57 O ATOM 2445 CB LYS A 150 4.960 -14.240 -6.890 1.00 0.57 C ATOM 2446 CG LYS A 150 6.116 -14.790 -6.027 1.00 1.64 C ATOM 2447 CD LYS A 150 7.104 -15.662 -6.811 1.00 2.49 C ATOM 2448 CE LYS A 150 6.923 -17.144 -6.469 1.00 3.14 C ATOM 2449 NZ LYS A 150 7.517 -17.477 -5.154 1.00 4.07 N ATOM 0 H LYS A 150 4.392 -12.865 -4.905 1.00 0.38 H new ATOM 0 HA LYS A 150 6.029 -12.473 -7.318 1.00 0.42 H new ATOM 0 HB2 LYS A 150 3.998 -14.562 -6.491 1.00 0.57 H new ATOM 0 HB3 LYS A 150 5.027 -14.624 -7.908 1.00 0.57 H new ATOM 0 HG2 LYS A 150 6.656 -13.954 -5.582 1.00 1.64 H new ATOM 0 HG3 LYS A 150 5.700 -15.374 -5.206 1.00 1.64 H new ATOM 0 HD2 LYS A 150 6.957 -15.512 -7.881 1.00 2.49 H new ATOM 0 HD3 LYS A 150 8.125 -15.355 -6.583 1.00 2.49 H new ATOM 0 HE2 LYS A 150 5.861 -17.389 -6.462 1.00 3.14 H new ATOM 0 HE3 LYS A 150 7.386 -17.756 -7.243 1.00 3.14 H new ATOM 0 HZ1 LYS A 150 7.376 -18.488 -4.955 1.00 4.07 H new ATOM 0 HZ2 LYS A 150 8.535 -17.266 -5.170 1.00 4.07 H new ATOM 0 HZ3 LYS A 150 7.058 -16.911 -4.412 1.00 4.07 H new ATOM 2463 N ARG A 151 4.427 -10.959 -8.453 1.00 0.32 N ATOM 2464 CA ARG A 151 3.500 -10.190 -9.273 1.00 0.35 C ATOM 2465 C ARG A 151 2.814 -11.111 -10.280 1.00 0.55 C ATOM 2466 O ARG A 151 3.414 -12.100 -10.707 1.00 0.71 O ATOM 2467 CB ARG A 151 4.189 -8.995 -9.957 1.00 0.42 C ATOM 2468 CG ARG A 151 5.089 -9.286 -11.172 1.00 0.76 C ATOM 2469 CD ARG A 151 6.535 -9.603 -10.779 1.00 1.55 C ATOM 2470 NE ARG A 151 6.854 -11.039 -10.800 1.00 2.56 N ATOM 2471 CZ ARG A 151 7.187 -11.723 -11.904 1.00 2.65 C ATOM 2472 NH1 ARG A 151 7.547 -13.004 -11.811 1.00 3.76 N ATOM 2473 NH2 ARG A 151 7.169 -11.132 -13.097 1.00 2.45 N ATOM 0 H ARG A 151 5.392 -10.629 -8.480 1.00 0.32 H new ATOM 0 HA ARG A 151 2.737 -9.763 -8.622 1.00 0.35 H new ATOM 0 HB2 ARG A 151 3.414 -8.297 -10.274 1.00 0.42 H new ATOM 0 HB3 ARG A 151 4.793 -8.482 -9.208 1.00 0.42 H new ATOM 0 HG2 ARG A 151 4.677 -10.126 -11.730 1.00 0.76 H new ATOM 0 HG3 ARG A 151 5.080 -8.424 -11.840 1.00 0.76 H new ATOM 0 HD2 ARG A 151 7.209 -9.080 -11.458 1.00 1.55 H new ATOM 0 HD3 ARG A 151 6.724 -9.213 -9.779 1.00 1.55 H new ATOM 0 HE ARG A 151 6.820 -11.548 -9.917 1.00 2.56 H new ATOM 0 HH11 ARG A 151 7.569 -13.463 -10.900 1.00 3.76 H new ATOM 0 HH12 ARG A 151 7.800 -13.525 -12.651 1.00 3.76 H new ATOM 0 HH21 ARG A 151 6.900 -10.151 -13.176 1.00 2.45 H new ATOM 0 HH22 ARG A 151 7.424 -11.660 -13.932 1.00 2.45 H new ATOM 2487 N PRO A 152 1.569 -10.804 -10.661 1.00 0.64 N ATOM 2488 CA PRO A 152 0.845 -11.624 -11.606 1.00 0.88 C ATOM 2489 C PRO A 152 1.497 -11.470 -12.977 1.00 0.96 C ATOM 2490 O PRO A 152 2.077 -10.430 -13.280 1.00 0.94 O ATOM 2491 CB PRO A 152 -0.593 -11.099 -11.574 1.00 0.95 C ATOM 2492 CG PRO A 152 -0.436 -9.630 -11.186 1.00 0.73 C ATOM 2493 CD PRO A 152 0.831 -9.596 -10.329 1.00 0.57 C ATOM 0 HA PRO A 152 0.857 -12.688 -11.370 1.00 0.88 H new ATOM 0 HB2 PRO A 152 -1.080 -11.207 -12.543 1.00 0.95 H new ATOM 0 HB3 PRO A 152 -1.201 -11.641 -10.850 1.00 0.95 H new ATOM 0 HG2 PRO A 152 -0.337 -8.995 -12.066 1.00 0.73 H new ATOM 0 HG3 PRO A 152 -1.302 -9.271 -10.630 1.00 0.73 H new ATOM 0 HD2 PRO A 152 1.423 -8.706 -10.542 1.00 0.57 H new ATOM 0 HD3 PRO A 152 0.584 -9.568 -9.268 1.00 0.57 H new ATOM 2501 N VAL A 153 1.392 -12.509 -13.807 1.00 1.20 N ATOM 2502 CA VAL A 153 1.801 -12.425 -15.203 1.00 1.39 C ATOM 2503 C VAL A 153 0.895 -11.445 -15.958 1.00 1.51 C ATOM 2504 O VAL A 153 1.360 -10.761 -16.867 1.00 1.64 O ATOM 2505 CB VAL A 153 1.825 -13.826 -15.839 1.00 1.88 C ATOM 2506 CG1 VAL A 153 2.830 -14.715 -15.093 1.00 2.15 C ATOM 2507 CG2 VAL A 153 0.462 -14.531 -15.830 1.00 2.24 C ATOM 0 H VAL A 153 1.025 -13.420 -13.532 1.00 1.20 H new ATOM 0 HA VAL A 153 2.817 -12.035 -15.265 1.00 1.39 H new ATOM 0 HB VAL A 153 2.112 -13.679 -16.880 1.00 1.88 H new ATOM 0 HG11 VAL A 153 2.845 -15.706 -15.546 1.00 2.15 H new ATOM 0 HG12 VAL A 153 3.824 -14.272 -15.156 1.00 2.15 H new ATOM 0 HG13 VAL A 153 2.536 -14.798 -14.047 1.00 2.15 H new ATOM 0 HG21 VAL A 153 0.557 -15.513 -16.294 1.00 2.24 H new ATOM 0 HG22 VAL A 153 0.119 -14.648 -14.802 1.00 2.24 H new ATOM 0 HG23 VAL A 153 -0.260 -13.934 -16.387 1.00 2.24 H new ATOM 2517 N ASP A 154 -0.367 -11.365 -15.519 1.00 1.70 N ATOM 2518 CA ASP A 154 -1.460 -10.593 -16.103 1.00 2.17 C ATOM 2519 C ASP A 154 -1.651 -10.932 -17.581 1.00 2.64 C ATOM 2520 O ASP A 154 -2.002 -10.025 -18.364 1.00 3.36 O ATOM 2521 CB ASP A 154 -1.311 -9.091 -15.778 1.00 2.90 C ATOM 2522 CG ASP A 154 -2.656 -8.441 -15.430 1.00 4.01 C ATOM 2523 OD1 ASP A 154 -3.352 -9.010 -14.550 1.00 4.86 O ATOM 2524 OD2 ASP A 154 -2.948 -7.337 -15.941 1.00 4.85 O ATOM 2525 OXT ASP A 154 -1.508 -12.139 -17.886 1.00 3.82 O ATOM 0 H ASP A 154 -0.668 -11.875 -14.688 1.00 1.70 H new ATOM 0 HA ASP A 154 -2.401 -10.884 -15.637 1.00 2.17 H new ATOM 0 HB2 ASP A 154 -0.622 -8.968 -14.942 1.00 2.90 H new ATOM 0 HB3 ASP A 154 -0.871 -8.577 -16.633 1.00 2.90 H new TER 2530 ASP A 154