USER MOD reduce.3.24.130724 H: found=0, std=0, add=1155, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1149 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 124 SER OG : rot -8:sc= 1.42 USER MOD Set 1.2: A 138 SER OG : rot 28:sc= 1.26 USER MOD Set 2.1: A 116 ASN : amide:sc= 0.907 K(o=-0.25,f=-1.2) USER MOD Set 2.2: A 117 GLN : amide:sc= -1.16 K(o=-0.25,f=-1.2) USER MOD Set 3.1: A 66 LYS NZ :NH3+ 159:sc= 0.223 (180deg=0) USER MOD Set 3.2: A 84 HIS : no HD1:sc= -0.516 K(o=-0.29,f=-3.3) USER MOD Set 4.1: A 1 MET N :NH3+ 160:sc= 1.17 (180deg=-0.0743) USER MOD Set 4.2: A 3 SER OG : rot -150:sc= 0.683 USER MOD Single : A 1 MET CE :methyl -175:sc= 0 (180deg=-0.0393) USER MOD Single : A 2 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 4 HIS : no HD1:sc=-0.000497 X(o=-0.0005,f=-0.23) USER MOD Single : A 5 SER OG : rot 40:sc= 1.21 USER MOD Single : A 8 THR OG1 : rot 180:sc= -0.0806 USER MOD Single : A 11 GLN : amide:sc= -1.09 X(o=-1.1,f=-1.1) USER MOD Single : A 12 THR OG1 : rot 46:sc= 1.21 USER MOD Single : A 14 GLN : amide:sc= 0.94 K(o=0.94,f=-0.91) USER MOD Single : A 16 GLN : amide:sc= 0.86 K(o=0.86,f=-0.2) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 HIS : no HE2:sc= 0.902 K(o=0.9,f=-4.5!) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 176:sc= 1.74 (180deg=1.45) USER MOD Single : A 24 MET CE :methyl 178:sc=-0.00639 (180deg=-0.00923) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 2.54 (180deg=2.54) USER MOD Single : A 29 GLN : amide:sc= 1.52 K(o=1.5,f=-10!) USER MOD Single : A 39 HIS : no HD1:sc= -0.108 X(o=-0.11,f=-0.0036) USER MOD Single : A 40 THR OG1 : rot 177:sc= 0.563 USER MOD Single : A 41 SER OG : rot -55:sc= 1.2 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot -51:sc= 0.327 USER MOD Single : A 53 TYR OH : rot 30:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.0656 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 96:sc= 0.908 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 1:sc= 0.369 USER MOD Single : A 76 LYS NZ :NH3+ -135:sc= 2.06 (180deg=-0.495) USER MOD Single : A 77 GLN :FLIP amide:sc= -0.6 F(o=-4!,f=-0.6) USER MOD Single : A 79 ASN : amide:sc= 0.481 K(o=0.48,f=-5.5!) USER MOD Single : A 81 LYS NZ :NH3+ 174:sc= -0.268 (180deg=-0.422) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= -0.355 USER MOD Single : A 91 ASN :FLIP amide:sc= -0.0242 F(o=-1.1,f=-0.024) USER MOD Single : A 100 LYS NZ :NH3+ 177:sc= 1.23 (180deg=1.18) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 HIS : no HD1:sc= -2.42 K(o=-2.4,f=-3) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot -130:sc= -0.18 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 138:sc= 1.18 USER MOD Single : A 123 TYR OH : rot 70:sc= -0.153 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 GLN : amide:sc= -1.42 X(o=-1.4,f=-1.2) USER MOD Single : A 142 LYS NZ :NH3+ -170:sc= 0.488 (180deg=-0.253!) USER MOD Single : A 143 THR OG1 : rot 139:sc= 0.359 USER MOD Single : A 145 ASN : amide:sc= -0.0505 X(o=-0.051,f=-0.063) USER MOD Single : A 149 HIS : no HE2:sc= -0.16 K(o=-0.16,f=-5.9!) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 GLN : amide:sc= -0.516 X(o=-0.52,f=-0.71) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 17.679 -45.970 -6.503 1.00 50.58 N ATOM 2 CA MET A 1 18.096 -47.000 -7.468 1.00 50.83 C ATOM 3 C MET A 1 17.221 -46.805 -8.703 1.00 49.42 C ATOM 4 O MET A 1 16.988 -45.650 -9.052 1.00 48.88 O ATOM 5 CB MET A 1 18.080 -48.411 -6.847 1.00 51.77 C ATOM 6 CG MET A 1 16.758 -48.829 -6.180 1.00 51.76 C ATOM 7 SD MET A 1 16.798 -50.414 -5.302 1.00 53.00 S ATOM 8 CE MET A 1 17.055 -51.571 -6.665 1.00 53.80 C ATOM 0 H1 MET A 1 17.979 -46.248 -5.547 1.00 50.58 H new ATOM 0 H2 MET A 1 18.119 -45.061 -6.753 1.00 50.58 H new ATOM 0 H3 MET A 1 16.644 -45.872 -6.526 1.00 50.58 H new ATOM 0 HA MET A 1 19.139 -46.895 -7.768 1.00 50.83 H new ATOM 0 HB2 MET A 1 18.317 -49.134 -7.627 1.00 51.77 H new ATOM 0 HB3 MET A 1 18.876 -48.471 -6.104 1.00 51.77 H new ATOM 0 HG2 MET A 1 16.464 -48.050 -5.476 1.00 51.76 H new ATOM 0 HG3 MET A 1 15.983 -48.876 -6.945 1.00 51.76 H new ATOM 0 HE1 MET A 1 17.012 -52.593 -6.288 1.00 53.80 H new ATOM 0 HE2 MET A 1 16.277 -51.428 -7.415 1.00 53.80 H new ATOM 0 HE3 MET A 1 18.031 -51.392 -7.115 1.00 53.80 H new ATOM 20 N GLN A 2 16.662 -47.864 -9.295 1.00 48.86 N ATOM 21 CA GLN A 2 15.458 -47.713 -10.100 1.00 47.41 C ATOM 22 C GLN A 2 14.373 -47.190 -9.153 1.00 46.25 C ATOM 23 O GLN A 2 13.822 -47.948 -8.356 1.00 46.59 O ATOM 24 CB GLN A 2 15.074 -49.057 -10.731 1.00 47.40 C ATOM 25 CG GLN A 2 16.125 -49.515 -11.753 1.00 47.97 C ATOM 26 CD GLN A 2 15.745 -50.830 -12.431 1.00 48.37 C ATOM 27 OE1 GLN A 2 14.765 -51.471 -12.068 1.00 48.31 O ATOM 28 NE2 GLN A 2 16.522 -51.249 -13.425 1.00 48.91 N ATOM 0 H GLN A 2 17.020 -48.817 -9.231 1.00 48.86 H new ATOM 0 HA GLN A 2 15.601 -47.018 -10.927 1.00 47.41 H new ATOM 0 HB2 GLN A 2 14.970 -49.811 -9.951 1.00 47.40 H new ATOM 0 HB3 GLN A 2 14.104 -48.968 -11.219 1.00 47.40 H new ATOM 0 HG2 GLN A 2 16.251 -48.742 -12.511 1.00 47.97 H new ATOM 0 HG3 GLN A 2 17.087 -49.632 -11.253 1.00 47.97 H new ATOM 0 HE21 GLN A 2 17.332 -50.696 -13.707 1.00 48.91 H new ATOM 0 HE22 GLN A 2 16.309 -52.123 -13.905 1.00 48.91 H new ATOM 37 N SER A 3 14.176 -45.871 -9.119 1.00 45.01 N ATOM 38 CA SER A 3 13.403 -45.206 -8.083 1.00 43.94 C ATOM 39 C SER A 3 12.951 -43.847 -8.615 1.00 42.37 C ATOM 40 O SER A 3 13.802 -43.019 -8.928 1.00 42.52 O ATOM 41 CB SER A 3 14.279 -45.021 -6.830 1.00 44.88 C ATOM 42 OG SER A 3 14.987 -46.211 -6.508 1.00 46.06 O ATOM 0 H SER A 3 14.555 -45.233 -9.819 1.00 45.01 H new ATOM 0 HA SER A 3 12.532 -45.804 -7.815 1.00 43.94 H new ATOM 0 HB2 SER A 3 14.987 -44.209 -6.997 1.00 44.88 H new ATOM 0 HB3 SER A 3 13.653 -44.730 -5.987 1.00 44.88 H new ATOM 0 HG SER A 3 15.132 -46.254 -5.540 1.00 46.06 H new ATOM 48 N HIS A 4 11.640 -43.614 -8.721 1.00 40.98 N ATOM 49 CA HIS A 4 11.080 -42.331 -9.123 1.00 39.40 C ATOM 50 C HIS A 4 9.600 -42.312 -8.742 1.00 38.12 C ATOM 51 O HIS A 4 9.000 -43.378 -8.609 1.00 38.51 O ATOM 52 CB HIS A 4 11.263 -42.089 -10.631 1.00 39.08 C ATOM 53 CG HIS A 4 10.433 -42.985 -11.520 1.00 38.88 C ATOM 54 ND1 HIS A 4 10.269 -44.346 -11.387 1.00 39.59 N ATOM 55 CD2 HIS A 4 9.669 -42.581 -12.583 1.00 38.05 C ATOM 56 CE1 HIS A 4 9.422 -44.748 -12.350 1.00 39.21 C ATOM 57 NE2 HIS A 4 9.032 -43.710 -13.105 1.00 38.28 N ATOM 0 H HIS A 4 10.933 -44.323 -8.527 1.00 40.98 H new ATOM 0 HA HIS A 4 11.606 -41.527 -8.608 1.00 39.40 H new ATOM 0 HB2 HIS A 4 11.014 -41.051 -10.851 1.00 39.08 H new ATOM 0 HB3 HIS A 4 12.315 -42.225 -10.882 1.00 39.08 H new ATOM 0 HD2 HIS A 4 9.576 -41.570 -12.952 1.00 38.05 H new ATOM 0 HE1 HIS A 4 9.099 -45.768 -12.496 1.00 39.21 H new ATOM 0 HE2 HIS A 4 8.396 -43.739 -13.902 1.00 38.28 H new ATOM 65 N SER A 5 9.036 -41.116 -8.565 1.00 36.71 N ATOM 66 CA SER A 5 7.628 -40.819 -8.334 1.00 35.28 C ATOM 67 C SER A 5 7.510 -39.295 -8.377 1.00 33.82 C ATOM 68 O SER A 5 8.495 -38.614 -8.095 1.00 34.10 O ATOM 69 CB SER A 5 7.161 -41.342 -6.967 1.00 35.78 C ATOM 70 OG SER A 5 6.903 -42.730 -7.008 1.00 36.31 O ATOM 0 H SER A 5 9.599 -40.266 -8.581 1.00 36.71 H new ATOM 0 HA SER A 5 7.003 -41.302 -9.085 1.00 35.28 H new ATOM 0 HB2 SER A 5 7.923 -41.134 -6.216 1.00 35.78 H new ATOM 0 HB3 SER A 5 6.259 -40.811 -6.661 1.00 35.78 H new ATOM 0 HG SER A 5 7.588 -43.174 -7.551 1.00 36.31 H new ATOM 76 N ALA A 6 6.337 -38.762 -8.727 1.00 32.38 N ATOM 77 CA ALA A 6 6.069 -37.331 -8.734 1.00 30.95 C ATOM 78 C ALA A 6 4.556 -37.131 -8.777 1.00 29.47 C ATOM 79 O ALA A 6 3.878 -37.831 -9.526 1.00 29.42 O ATOM 80 CB ALA A 6 6.730 -36.673 -9.950 1.00 30.89 C ATOM 0 H ALA A 6 5.538 -39.325 -9.017 1.00 32.38 H new ATOM 0 HA ALA A 6 6.481 -36.867 -7.838 1.00 30.95 H new ATOM 0 HB1 ALA A 6 6.522 -35.603 -9.943 1.00 30.89 H new ATOM 0 HB2 ALA A 6 7.807 -36.833 -9.910 1.00 30.89 H new ATOM 0 HB3 ALA A 6 6.332 -37.114 -10.864 1.00 30.89 H new ATOM 86 N LEU A 7 4.033 -36.205 -7.970 1.00 28.41 N ATOM 87 CA LEU A 7 2.635 -35.820 -7.913 1.00 26.98 C ATOM 88 C LEU A 7 2.610 -34.343 -7.522 1.00 25.92 C ATOM 89 O LEU A 7 3.534 -33.883 -6.853 1.00 26.51 O ATOM 90 CB LEU A 7 1.919 -36.633 -6.825 1.00 27.23 C ATOM 91 CG LEU A 7 1.691 -38.120 -7.143 1.00 27.43 C ATOM 92 CD1 LEU A 7 1.083 -38.803 -5.913 1.00 27.51 C ATOM 93 CD2 LEU A 7 0.749 -38.317 -8.338 1.00 26.98 C ATOM 0 H LEU A 7 4.608 -35.682 -7.309 1.00 28.41 H new ATOM 0 HA LEU A 7 2.139 -35.997 -8.867 1.00 26.98 H new ATOM 0 HB2 LEU A 7 2.498 -36.562 -5.904 1.00 27.23 H new ATOM 0 HB3 LEU A 7 0.952 -36.170 -6.629 1.00 27.23 H new ATOM 0 HG LEU A 7 2.655 -38.559 -7.401 1.00 27.43 H new ATOM 0 HD11 LEU A 7 0.917 -39.859 -6.128 1.00 27.51 H new ATOM 0 HD12 LEU A 7 1.766 -38.707 -5.069 1.00 27.51 H new ATOM 0 HD13 LEU A 7 0.133 -38.329 -5.666 1.00 27.51 H new ATOM 0 HD21 LEU A 7 0.617 -39.383 -8.526 1.00 26.98 H new ATOM 0 HD22 LEU A 7 -0.218 -37.865 -8.117 1.00 26.98 H new ATOM 0 HD23 LEU A 7 1.178 -37.843 -9.221 1.00 26.98 H new ATOM 105 N THR A 8 1.564 -33.613 -7.914 1.00 24.50 N ATOM 106 CA THR A 8 1.284 -32.254 -7.472 1.00 23.40 C ATOM 107 C THR A 8 -0.137 -31.907 -7.924 1.00 21.76 C ATOM 108 O THR A 8 -0.706 -32.634 -8.739 1.00 21.64 O ATOM 109 CB THR A 8 2.334 -31.255 -7.990 1.00 23.66 C ATOM 110 OG1 THR A 8 2.031 -29.959 -7.513 1.00 22.93 O ATOM 111 CG2 THR A 8 2.425 -31.226 -9.520 1.00 23.48 C ATOM 0 H THR A 8 0.868 -33.968 -8.570 1.00 24.50 H new ATOM 0 HA THR A 8 1.346 -32.187 -6.386 1.00 23.40 H new ATOM 0 HB THR A 8 3.302 -31.586 -7.615 1.00 23.66 H new ATOM 0 HG1 THR A 8 2.701 -29.324 -7.842 1.00 22.93 H new ATOM 0 HG21 THR A 8 3.182 -30.503 -9.826 1.00 23.48 H new ATOM 0 HG22 THR A 8 2.699 -32.215 -9.887 1.00 23.48 H new ATOM 0 HG23 THR A 8 1.460 -30.939 -9.937 1.00 23.48 H new ATOM 119 N ALA A 9 -0.697 -30.819 -7.392 1.00 20.67 N ATOM 120 CA ALA A 9 -2.011 -30.283 -7.717 1.00 19.12 C ATOM 121 C ALA A 9 -2.168 -28.959 -6.970 1.00 18.07 C ATOM 122 O ALA A 9 -1.611 -28.807 -5.884 1.00 18.74 O ATOM 123 CB ALA A 9 -3.118 -31.256 -7.294 1.00 19.26 C ATOM 0 H ALA A 9 -0.217 -30.262 -6.686 1.00 20.67 H new ATOM 0 HA ALA A 9 -2.096 -30.134 -8.793 1.00 19.12 H new ATOM 0 HB1 ALA A 9 -4.090 -30.833 -7.547 1.00 19.26 H new ATOM 0 HB2 ALA A 9 -2.988 -32.204 -7.815 1.00 19.26 H new ATOM 0 HB3 ALA A 9 -3.064 -31.423 -6.218 1.00 19.26 H new ATOM 129 N PHE A 10 -2.914 -28.008 -7.539 1.00 16.60 N ATOM 130 CA PHE A 10 -3.281 -26.751 -6.902 1.00 15.53 C ATOM 131 C PHE A 10 -4.338 -26.082 -7.779 1.00 14.23 C ATOM 132 O PHE A 10 -4.417 -26.387 -8.969 1.00 14.23 O ATOM 133 CB PHE A 10 -2.053 -25.843 -6.731 1.00 15.90 C ATOM 134 CG PHE A 10 -2.371 -24.498 -6.106 1.00 15.67 C ATOM 135 CD1 PHE A 10 -2.862 -24.440 -4.789 1.00 15.96 C ATOM 136 CD2 PHE A 10 -2.291 -23.320 -6.873 1.00 15.47 C ATOM 137 CE1 PHE A 10 -3.286 -23.215 -4.247 1.00 16.04 C ATOM 138 CE2 PHE A 10 -2.684 -22.090 -6.318 1.00 15.53 C ATOM 139 CZ PHE A 10 -3.193 -22.038 -5.009 1.00 15.82 C ATOM 0 H PHE A 10 -3.288 -28.099 -8.484 1.00 16.60 H new ATOM 0 HA PHE A 10 -3.679 -26.935 -5.904 1.00 15.53 H new ATOM 0 HB2 PHE A 10 -1.316 -26.356 -6.113 1.00 15.90 H new ATOM 0 HB3 PHE A 10 -1.593 -25.681 -7.706 1.00 15.90 H new ATOM 0 HD1 PHE A 10 -2.913 -25.339 -4.193 1.00 15.96 H new ATOM 0 HD2 PHE A 10 -1.927 -23.362 -7.889 1.00 15.47 H new ATOM 0 HE1 PHE A 10 -3.684 -23.178 -3.244 1.00 16.04 H new ATOM 0 HE2 PHE A 10 -2.595 -21.184 -6.898 1.00 15.53 H new ATOM 0 HZ PHE A 10 -3.512 -21.095 -4.590 1.00 15.82 H new ATOM 149 N GLN A 11 -5.151 -25.197 -7.198 1.00 13.39 N ATOM 150 CA GLN A 11 -6.158 -24.407 -7.884 1.00 12.27 C ATOM 151 C GLN A 11 -6.615 -23.296 -6.943 1.00 11.08 C ATOM 152 O GLN A 11 -6.431 -23.409 -5.733 1.00 11.56 O ATOM 153 CB GLN A 11 -7.348 -25.262 -8.346 1.00 12.28 C ATOM 154 CG GLN A 11 -7.967 -26.149 -7.251 1.00 13.12 C ATOM 155 CD GLN A 11 -7.141 -27.398 -6.948 1.00 14.52 C ATOM 156 OE1 GLN A 11 -6.615 -27.559 -5.853 1.00 15.04 O ATOM 157 NE2 GLN A 11 -7.013 -28.299 -7.918 1.00 15.44 N ATOM 0 H GLN A 11 -5.119 -25.009 -6.196 1.00 13.39 H new ATOM 0 HA GLN A 11 -5.722 -23.980 -8.787 1.00 12.27 H new ATOM 0 HB2 GLN A 11 -8.121 -24.602 -8.740 1.00 12.28 H new ATOM 0 HB3 GLN A 11 -7.023 -25.898 -9.169 1.00 12.28 H new ATOM 0 HG2 GLN A 11 -8.077 -25.564 -6.338 1.00 13.12 H new ATOM 0 HG3 GLN A 11 -8.968 -26.450 -7.559 1.00 13.12 H new ATOM 0 HE21 GLN A 11 -7.460 -28.143 -8.821 1.00 15.44 H new ATOM 0 HE22 GLN A 11 -6.468 -29.146 -7.759 1.00 15.44 H new ATOM 166 N THR A 12 -7.205 -22.241 -7.507 1.00 9.82 N ATOM 167 CA THR A 12 -7.698 -21.060 -6.815 1.00 8.67 C ATOM 168 C THR A 12 -8.371 -20.187 -7.876 1.00 7.58 C ATOM 169 O THR A 12 -8.282 -20.509 -9.069 1.00 8.15 O ATOM 170 CB THR A 12 -6.537 -20.338 -6.100 1.00 9.67 C ATOM 171 OG1 THR A 12 -6.948 -19.169 -5.424 1.00 9.56 O ATOM 172 CG2 THR A 12 -5.410 -19.939 -7.060 1.00 10.45 C ATOM 0 H THR A 12 -7.358 -22.190 -8.514 1.00 9.82 H new ATOM 0 HA THR A 12 -8.418 -21.311 -6.036 1.00 8.67 H new ATOM 0 HB THR A 12 -6.173 -21.070 -5.379 1.00 9.67 H new ATOM 0 HG1 THR A 12 -7.767 -19.354 -4.919 1.00 9.56 H new ATOM 0 HG21 THR A 12 -4.620 -19.435 -6.504 1.00 10.45 H new ATOM 0 HG22 THR A 12 -5.005 -20.832 -7.537 1.00 10.45 H new ATOM 0 HG23 THR A 12 -5.803 -19.266 -7.823 1.00 10.45 H new ATOM 180 N GLU A 13 -9.017 -19.101 -7.445 1.00 6.41 N ATOM 181 CA GLU A 13 -9.596 -18.063 -8.289 1.00 5.66 C ATOM 182 C GLU A 13 -8.523 -17.369 -9.136 1.00 7.17 C ATOM 183 O GLU A 13 -8.145 -16.226 -8.898 1.00 7.78 O ATOM 184 CB GLU A 13 -10.379 -17.063 -7.428 1.00 4.35 C ATOM 185 CG GLU A 13 -11.814 -17.546 -7.223 1.00 3.32 C ATOM 186 CD GLU A 13 -12.584 -17.522 -8.529 1.00 4.52 C ATOM 187 OE1 GLU A 13 -12.746 -18.609 -9.120 1.00 5.76 O ATOM 188 OE2 GLU A 13 -13.037 -16.442 -8.971 1.00 5.13 O ATOM 0 H GLU A 13 -9.155 -18.917 -6.451 1.00 6.41 H new ATOM 0 HA GLU A 13 -10.292 -18.529 -8.986 1.00 5.66 H new ATOM 0 HB2 GLU A 13 -9.888 -16.942 -6.462 1.00 4.35 H new ATOM 0 HB3 GLU A 13 -10.383 -16.085 -7.908 1.00 4.35 H new ATOM 0 HG2 GLU A 13 -11.807 -18.558 -6.819 1.00 3.32 H new ATOM 0 HG3 GLU A 13 -12.314 -16.913 -6.490 1.00 3.32 H new ATOM 195 N GLN A 14 -8.067 -18.094 -10.151 1.00 8.14 N ATOM 196 CA GLN A 14 -7.101 -17.701 -11.160 1.00 9.92 C ATOM 197 C GLN A 14 -7.168 -18.744 -12.277 1.00 10.63 C ATOM 198 O GLN A 14 -7.165 -18.404 -13.458 1.00 11.07 O ATOM 199 CB GLN A 14 -5.685 -17.634 -10.564 1.00 11.05 C ATOM 200 CG GLN A 14 -4.718 -16.954 -11.546 1.00 12.46 C ATOM 201 CD GLN A 14 -3.257 -17.040 -11.113 1.00 13.64 C ATOM 202 OE1 GLN A 14 -2.882 -17.890 -10.312 1.00 13.99 O ATOM 203 NE2 GLN A 14 -2.401 -16.173 -11.650 1.00 14.57 N ATOM 0 H GLN A 14 -8.393 -19.049 -10.298 1.00 8.14 H new ATOM 0 HA GLN A 14 -7.332 -16.708 -11.545 1.00 9.92 H new ATOM 0 HB2 GLN A 14 -5.706 -17.082 -9.624 1.00 11.05 H new ATOM 0 HB3 GLN A 14 -5.333 -18.640 -10.335 1.00 11.05 H new ATOM 0 HG2 GLN A 14 -4.826 -17.414 -12.528 1.00 12.46 H new ATOM 0 HG3 GLN A 14 -4.997 -15.906 -11.652 1.00 12.46 H new ATOM 0 HE21 GLN A 14 -2.733 -15.474 -12.314 1.00 14.57 H new ATOM 0 HE22 GLN A 14 -1.413 -16.208 -11.397 1.00 14.57 H new ATOM 212 N ILE A 15 -7.223 -20.028 -11.901 1.00 11.19 N ATOM 213 CA ILE A 15 -7.243 -21.111 -12.868 1.00 12.17 C ATOM 214 C ILE A 15 -8.621 -21.178 -13.531 1.00 11.57 C ATOM 215 O ILE A 15 -9.562 -21.736 -12.964 1.00 10.76 O ATOM 216 CB ILE A 15 -6.856 -22.446 -12.211 1.00 13.04 C ATOM 217 CG1 ILE A 15 -5.559 -22.370 -11.382 1.00 13.87 C ATOM 218 CG2 ILE A 15 -6.753 -23.519 -13.306 1.00 14.39 C ATOM 219 CD1 ILE A 15 -4.354 -21.775 -12.120 1.00 15.51 C ATOM 0 H ILE A 15 -7.254 -20.334 -10.928 1.00 11.19 H new ATOM 0 HA ILE A 15 -6.500 -20.916 -13.641 1.00 12.17 H new ATOM 0 HB ILE A 15 -7.636 -22.707 -11.496 1.00 13.04 H new ATOM 0 HG12 ILE A 15 -5.750 -21.774 -10.489 1.00 13.87 H new ATOM 0 HG13 ILE A 15 -5.301 -23.374 -11.046 1.00 13.87 H new ATOM 0 HG21 ILE A 15 -6.479 -24.473 -12.856 1.00 14.39 H new ATOM 0 HG22 ILE A 15 -7.715 -23.618 -13.810 1.00 14.39 H new ATOM 0 HG23 ILE A 15 -5.992 -23.228 -14.030 1.00 14.39 H new ATOM 0 HD11 ILE A 15 -3.490 -21.763 -11.456 1.00 15.51 H new ATOM 0 HD12 ILE A 15 -4.129 -22.381 -12.997 1.00 15.51 H new ATOM 0 HD13 ILE A 15 -4.585 -20.757 -12.432 1.00 15.51 H new ATOM 231 N GLN A 16 -8.712 -20.622 -14.742 1.00 12.35 N ATOM 232 CA GLN A 16 -9.894 -20.637 -15.591 1.00 12.48 C ATOM 233 C GLN A 16 -10.598 -22.004 -15.565 1.00 11.76 C ATOM 234 O GLN A 16 -9.932 -23.041 -15.596 1.00 12.00 O ATOM 235 CB GLN A 16 -9.469 -20.274 -17.023 1.00 14.14 C ATOM 236 CG GLN A 16 -10.639 -19.919 -17.953 1.00 14.86 C ATOM 237 CD GLN A 16 -11.042 -18.452 -17.840 1.00 15.60 C ATOM 238 OE1 GLN A 16 -10.726 -17.651 -18.714 1.00 17.01 O ATOM 239 NE2 GLN A 16 -11.742 -18.073 -16.779 1.00 14.99 N ATOM 0 H GLN A 16 -7.928 -20.130 -15.171 1.00 12.35 H new ATOM 0 HA GLN A 16 -10.611 -19.907 -15.215 1.00 12.48 H new ATOM 0 HB2 GLN A 16 -8.781 -19.429 -16.983 1.00 14.14 H new ATOM 0 HB3 GLN A 16 -8.920 -21.113 -17.451 1.00 14.14 H new ATOM 0 HG2 GLN A 16 -10.361 -20.139 -18.984 1.00 14.86 H new ATOM 0 HG3 GLN A 16 -11.496 -20.549 -17.713 1.00 14.86 H new ATOM 0 HE21 GLN A 16 -11.994 -18.755 -16.064 1.00 14.99 H new ATOM 0 HE22 GLN A 16 -12.028 -17.099 -16.678 1.00 14.99 H new ATOM 248 N ASP A 17 -11.934 -21.997 -15.505 1.00 11.28 N ATOM 249 CA ASP A 17 -12.827 -23.157 -15.496 1.00 10.94 C ATOM 250 C ASP A 17 -12.742 -23.972 -14.203 1.00 9.86 C ATOM 251 O ASP A 17 -13.749 -24.167 -13.526 1.00 9.16 O ATOM 252 CB ASP A 17 -12.682 -24.048 -16.736 1.00 12.33 C ATOM 253 CG ASP A 17 -13.640 -25.232 -16.655 1.00 12.45 C ATOM 254 OD1 ASP A 17 -13.193 -26.348 -16.992 1.00 13.17 O ATOM 255 OD2 ASP A 17 -14.798 -25.004 -16.237 1.00 12.12 O ATOM 0 H ASP A 17 -12.454 -21.120 -15.458 1.00 11.28 H new ATOM 0 HA ASP A 17 -13.830 -22.733 -15.536 1.00 10.94 H new ATOM 0 HB2 ASP A 17 -12.887 -23.467 -17.635 1.00 12.33 H new ATOM 0 HB3 ASP A 17 -11.656 -24.407 -16.816 1.00 12.33 H new ATOM 260 N SER A 18 -11.540 -24.400 -13.809 1.00 10.18 N ATOM 261 CA SER A 18 -11.311 -24.977 -12.486 1.00 9.71 C ATOM 262 C SER A 18 -11.912 -24.068 -11.408 1.00 8.29 C ATOM 263 O SER A 18 -12.485 -24.545 -10.429 1.00 7.95 O ATOM 264 CB SER A 18 -9.814 -25.180 -12.251 1.00 10.84 C ATOM 265 OG SER A 18 -9.265 -26.024 -13.244 1.00 11.92 O ATOM 0 H SER A 18 -10.706 -24.356 -14.394 1.00 10.18 H new ATOM 0 HA SER A 18 -11.800 -25.949 -12.431 1.00 9.71 H new ATOM 0 HB2 SER A 18 -9.304 -24.216 -12.263 1.00 10.84 H new ATOM 0 HB3 SER A 18 -9.651 -25.615 -11.265 1.00 10.84 H new ATOM 0 HG SER A 18 -8.306 -26.142 -13.080 1.00 11.92 H new ATOM 271 N GLU A 19 -11.820 -22.756 -11.633 1.00 7.92 N ATOM 272 CA GLU A 19 -12.519 -21.696 -10.926 1.00 6.92 C ATOM 273 C GLU A 19 -13.937 -22.083 -10.469 1.00 6.32 C ATOM 274 O GLU A 19 -14.334 -21.761 -9.354 1.00 5.86 O ATOM 275 CB GLU A 19 -12.525 -20.461 -11.836 1.00 7.57 C ATOM 276 CG GLU A 19 -13.652 -20.457 -12.873 1.00 8.30 C ATOM 277 CD GLU A 19 -13.488 -19.282 -13.805 1.00 9.03 C ATOM 278 OE1 GLU A 19 -13.837 -18.170 -13.346 1.00 9.16 O ATOM 279 OE2 GLU A 19 -12.977 -19.527 -14.921 1.00 9.90 O ATOM 0 H GLU A 19 -11.212 -22.387 -12.365 1.00 7.92 H new ATOM 0 HA GLU A 19 -11.991 -21.487 -9.996 1.00 6.92 H new ATOM 0 HB2 GLU A 19 -12.611 -19.567 -11.218 1.00 7.57 H new ATOM 0 HB3 GLU A 19 -11.568 -20.400 -12.354 1.00 7.57 H new ATOM 0 HG2 GLU A 19 -13.639 -21.387 -13.441 1.00 8.30 H new ATOM 0 HG3 GLU A 19 -14.619 -20.403 -12.372 1.00 8.30 H new ATOM 286 N HIS A 20 -14.715 -22.771 -11.312 1.00 6.97 N ATOM 287 CA HIS A 20 -16.070 -23.200 -10.991 1.00 7.36 C ATOM 288 C HIS A 20 -16.052 -24.097 -9.751 1.00 7.58 C ATOM 289 O HIS A 20 -16.824 -23.904 -8.805 1.00 7.90 O ATOM 290 CB HIS A 20 -16.681 -23.924 -12.202 1.00 8.56 C ATOM 291 CG HIS A 20 -16.762 -23.081 -13.454 1.00 9.35 C ATOM 292 ND1 HIS A 20 -16.287 -23.412 -14.707 1.00 10.28 N ATOM 293 CD2 HIS A 20 -17.358 -21.852 -13.561 1.00 9.81 C ATOM 294 CE1 HIS A 20 -16.597 -22.403 -15.538 1.00 11.17 C ATOM 295 NE2 HIS A 20 -17.256 -21.430 -14.888 1.00 10.99 N ATOM 0 H HIS A 20 -14.412 -23.046 -12.246 1.00 6.97 H new ATOM 0 HA HIS A 20 -16.690 -22.332 -10.766 1.00 7.36 H new ATOM 0 HB2 HIS A 20 -16.089 -24.814 -12.415 1.00 8.56 H new ATOM 0 HB3 HIS A 20 -17.683 -24.263 -11.940 1.00 8.56 H new ATOM 0 HD1 HIS A 20 -15.791 -24.267 -14.957 1.00 10.28 H new ATOM 0 HD2 HIS A 20 -17.826 -21.304 -12.757 1.00 9.81 H new ATOM 0 HE1 HIS A 20 -16.349 -22.378 -16.589 1.00 11.17 H new ATOM 303 N SER A 21 -15.122 -25.057 -9.730 1.00 8.03 N ATOM 304 CA SER A 21 -14.852 -25.816 -8.522 1.00 8.84 C ATOM 305 C SER A 21 -14.382 -24.840 -7.446 1.00 8.22 C ATOM 306 O SER A 21 -14.982 -24.796 -6.376 1.00 8.85 O ATOM 307 CB SER A 21 -13.839 -26.936 -8.781 1.00 9.92 C ATOM 308 OG SER A 21 -14.327 -27.788 -9.798 1.00 10.53 O ATOM 0 H SER A 21 -14.551 -25.320 -10.534 1.00 8.03 H new ATOM 0 HA SER A 21 -15.758 -26.315 -8.179 1.00 8.84 H new ATOM 0 HB2 SER A 21 -12.880 -26.512 -9.077 1.00 9.92 H new ATOM 0 HB3 SER A 21 -13.668 -27.504 -7.867 1.00 9.92 H new ATOM 0 HG SER A 21 -13.678 -28.503 -9.965 1.00 10.53 H new ATOM 314 N GLY A 22 -13.375 -24.024 -7.767 1.00 7.39 N ATOM 315 CA GLY A 22 -12.804 -22.993 -6.909 1.00 6.97 C ATOM 316 C GLY A 22 -13.833 -22.190 -6.105 1.00 6.58 C ATOM 317 O GLY A 22 -14.030 -22.479 -4.928 1.00 7.64 O ATOM 0 H GLY A 22 -12.916 -24.070 -8.677 1.00 7.39 H new ATOM 0 HA2 GLY A 22 -12.106 -23.462 -6.215 1.00 6.97 H new ATOM 0 HA3 GLY A 22 -12.227 -22.304 -7.526 1.00 6.97 H new ATOM 321 N LYS A 23 -14.434 -21.151 -6.695 1.00 5.66 N ATOM 322 CA LYS A 23 -15.167 -20.136 -5.938 1.00 5.96 C ATOM 323 C LYS A 23 -16.501 -20.655 -5.384 1.00 7.56 C ATOM 324 O LYS A 23 -16.534 -21.466 -4.458 1.00 8.78 O ATOM 325 CB LYS A 23 -15.317 -18.858 -6.795 1.00 5.56 C ATOM 326 CG LYS A 23 -15.710 -19.057 -8.275 1.00 6.19 C ATOM 327 CD LYS A 23 -16.080 -17.714 -8.930 1.00 7.18 C ATOM 328 CE LYS A 23 -15.858 -17.711 -10.456 1.00 8.30 C ATOM 329 NZ LYS A 23 -14.426 -17.622 -10.812 1.00 8.66 N ATOM 0 H LYS A 23 -14.425 -20.992 -7.703 1.00 5.66 H new ATOM 0 HA LYS A 23 -14.587 -19.880 -5.051 1.00 5.96 H new ATOM 0 HB2 LYS A 23 -16.067 -18.221 -6.327 1.00 5.56 H new ATOM 0 HB3 LYS A 23 -14.373 -18.315 -6.764 1.00 5.56 H new ATOM 0 HG2 LYS A 23 -14.882 -19.515 -8.817 1.00 6.19 H new ATOM 0 HG3 LYS A 23 -16.554 -19.744 -8.342 1.00 6.19 H new ATOM 0 HD2 LYS A 23 -17.125 -17.488 -8.719 1.00 7.18 H new ATOM 0 HD3 LYS A 23 -15.485 -16.919 -8.480 1.00 7.18 H new ATOM 0 HE2 LYS A 23 -16.281 -18.619 -10.885 1.00 8.30 H new ATOM 0 HE3 LYS A 23 -16.393 -16.870 -10.898 1.00 8.30 H new ATOM 0 HZ1 LYS A 23 -14.320 -17.691 -11.844 1.00 8.66 H new ATOM 0 HZ2 LYS A 23 -14.043 -16.712 -10.485 1.00 8.66 H new ATOM 0 HZ3 LYS A 23 -13.906 -18.400 -10.358 1.00 8.66 H new ATOM 343 N MET A 24 -17.621 -20.381 -6.054 1.00 8.07 N ATOM 344 CA MET A 24 -18.938 -20.803 -5.603 1.00 9.89 C ATOM 345 C MET A 24 -19.724 -21.320 -6.785 1.00 10.54 C ATOM 346 O MET A 24 -19.634 -22.521 -7.059 1.00 10.88 O ATOM 347 CB MET A 24 -19.630 -19.671 -4.831 1.00 10.65 C ATOM 348 CG MET A 24 -19.012 -19.501 -3.435 1.00 10.73 C ATOM 349 SD MET A 24 -19.921 -18.411 -2.310 1.00 12.49 S ATOM 350 CE MET A 24 -19.741 -16.818 -3.139 1.00 12.73 C ATOM 0 H MET A 24 -17.635 -19.857 -6.929 1.00 8.07 H new ATOM 0 HA MET A 24 -18.859 -21.627 -4.894 1.00 9.89 H new ATOM 0 HB2 MET A 24 -19.541 -18.738 -5.388 1.00 10.65 H new ATOM 0 HB3 MET A 24 -20.694 -19.887 -4.738 1.00 10.65 H new ATOM 0 HG2 MET A 24 -18.927 -20.484 -2.972 1.00 10.73 H new ATOM 0 HG3 MET A 24 -17.999 -19.114 -3.549 1.00 10.73 H new ATOM 0 HE1 MET A 24 -20.281 -16.054 -2.580 1.00 12.73 H new ATOM 0 HE2 MET A 24 -18.685 -16.552 -3.191 1.00 12.73 H new ATOM 0 HE3 MET A 24 -20.148 -16.885 -4.148 1.00 12.73 H new ATOM 360 N VAL A 25 -20.422 -20.420 -7.481 1.00 11.07 N ATOM 361 CA VAL A 25 -21.068 -20.681 -8.755 1.00 11.91 C ATOM 362 C VAL A 25 -22.258 -21.627 -8.569 1.00 13.25 C ATOM 363 O VAL A 25 -23.396 -21.169 -8.523 1.00 14.23 O ATOM 364 CB VAL A 25 -20.007 -21.146 -9.773 1.00 11.64 C ATOM 365 CG1 VAL A 25 -20.626 -21.667 -11.079 1.00 12.71 C ATOM 366 CG2 VAL A 25 -19.087 -19.965 -10.112 1.00 10.86 C ATOM 0 H VAL A 25 -20.553 -19.462 -7.157 1.00 11.07 H new ATOM 0 HA VAL A 25 -21.505 -19.773 -9.171 1.00 11.91 H new ATOM 0 HB VAL A 25 -19.456 -21.966 -9.313 1.00 11.64 H new ATOM 0 HG11 VAL A 25 -19.833 -21.980 -11.758 1.00 12.71 H new ATOM 0 HG12 VAL A 25 -21.274 -22.516 -10.861 1.00 12.71 H new ATOM 0 HG13 VAL A 25 -21.211 -20.875 -11.546 1.00 12.71 H new ATOM 0 HG21 VAL A 25 -18.334 -20.286 -10.832 1.00 10.86 H new ATOM 0 HG22 VAL A 25 -19.677 -19.155 -10.541 1.00 10.86 H new ATOM 0 HG23 VAL A 25 -18.596 -19.614 -9.204 1.00 10.86 H new ATOM 376 N ALA A 26 -22.000 -22.931 -8.459 1.00 13.53 N ATOM 377 CA ALA A 26 -23.008 -23.980 -8.389 1.00 14.94 C ATOM 378 C ALA A 26 -22.290 -25.322 -8.289 1.00 14.67 C ATOM 379 O ALA A 26 -21.682 -25.769 -9.257 1.00 14.26 O ATOM 380 CB ALA A 26 -23.915 -23.966 -9.629 1.00 15.98 C ATOM 0 H ALA A 26 -21.048 -23.295 -8.415 1.00 13.53 H new ATOM 0 HA ALA A 26 -23.640 -23.814 -7.517 1.00 14.94 H new ATOM 0 HB1 ALA A 26 -24.657 -24.761 -9.546 1.00 15.98 H new ATOM 0 HB2 ALA A 26 -24.421 -23.003 -9.699 1.00 15.98 H new ATOM 0 HB3 ALA A 26 -23.312 -24.124 -10.523 1.00 15.98 H new ATOM 386 N LYS A 27 -22.339 -25.957 -7.118 1.00 15.19 N ATOM 387 CA LYS A 27 -21.739 -27.256 -6.869 1.00 15.32 C ATOM 388 C LYS A 27 -22.299 -27.769 -5.546 1.00 16.28 C ATOM 389 O LYS A 27 -22.693 -26.963 -4.705 1.00 16.57 O ATOM 390 CB LYS A 27 -20.204 -27.149 -6.829 1.00 14.42 C ATOM 391 CG LYS A 27 -19.709 -25.961 -5.990 1.00 14.28 C ATOM 392 CD LYS A 27 -18.187 -26.024 -5.828 1.00 13.88 C ATOM 393 CE LYS A 27 -17.663 -24.825 -5.026 1.00 14.18 C ATOM 394 NZ LYS A 27 -17.337 -23.679 -5.895 1.00 14.49 N ATOM 0 H LYS A 27 -22.809 -25.568 -6.301 1.00 15.19 H new ATOM 0 HA LYS A 27 -21.980 -27.953 -7.671 1.00 15.32 H new ATOM 0 HB2 LYS A 27 -19.791 -28.072 -6.422 1.00 14.42 H new ATOM 0 HB3 LYS A 27 -19.825 -27.052 -7.846 1.00 14.42 H new ATOM 0 HG2 LYS A 27 -19.992 -25.024 -6.470 1.00 14.28 H new ATOM 0 HG3 LYS A 27 -20.187 -25.974 -5.010 1.00 14.28 H new ATOM 0 HD2 LYS A 27 -17.911 -26.950 -5.324 1.00 13.88 H new ATOM 0 HD3 LYS A 27 -17.715 -26.042 -6.810 1.00 13.88 H new ATOM 0 HE2 LYS A 27 -18.412 -24.523 -4.294 1.00 14.18 H new ATOM 0 HE3 LYS A 27 -16.774 -25.122 -4.469 1.00 14.18 H new ATOM 0 HZ1 LYS A 27 -16.987 -22.891 -5.314 1.00 14.49 H new ATOM 0 HZ2 LYS A 27 -16.604 -23.958 -6.577 1.00 14.49 H new ATOM 0 HZ3 LYS A 27 -18.190 -23.378 -6.408 1.00 14.49 H new ATOM 408 N ARG A 28 -22.339 -29.092 -5.361 1.00 17.10 N ATOM 409 CA ARG A 28 -22.737 -29.682 -4.089 1.00 18.24 C ATOM 410 C ARG A 28 -21.623 -29.435 -3.070 1.00 17.98 C ATOM 411 O ARG A 28 -21.813 -28.729 -2.084 1.00 18.48 O ATOM 412 CB ARG A 28 -23.015 -31.185 -4.254 1.00 19.40 C ATOM 413 CG ARG A 28 -24.216 -31.450 -5.172 1.00 20.10 C ATOM 414 CD ARG A 28 -24.477 -32.950 -5.374 1.00 21.41 C ATOM 415 NE ARG A 28 -24.895 -33.622 -4.129 1.00 22.52 N ATOM 416 CZ ARG A 28 -24.111 -34.316 -3.284 1.00 22.95 C ATOM 417 NH1 ARG A 28 -22.793 -34.402 -3.497 1.00 22.33 N ATOM 418 NH2 ARG A 28 -24.652 -34.921 -2.221 1.00 24.24 N ATOM 0 H ARG A 28 -22.099 -29.773 -6.082 1.00 17.10 H new ATOM 0 HA ARG A 28 -23.659 -29.220 -3.736 1.00 18.24 H new ATOM 0 HB2 ARG A 28 -22.131 -31.674 -4.663 1.00 19.40 H new ATOM 0 HB3 ARG A 28 -23.201 -31.629 -3.276 1.00 19.40 H new ATOM 0 HG2 ARG A 28 -25.105 -30.983 -4.747 1.00 20.10 H new ATOM 0 HG3 ARG A 28 -24.041 -30.981 -6.140 1.00 20.10 H new ATOM 0 HD2 ARG A 28 -25.249 -33.083 -6.132 1.00 21.41 H new ATOM 0 HD3 ARG A 28 -23.573 -33.425 -5.754 1.00 21.41 H new ATOM 0 HE ARG A 28 -25.882 -33.553 -3.883 1.00 22.52 H new ATOM 0 HH11 ARG A 28 -22.376 -33.939 -4.305 1.00 22.33 H new ATOM 0 HH12 ARG A 28 -22.205 -34.930 -2.852 1.00 22.33 H new ATOM 0 HH21 ARG A 28 -25.656 -34.855 -2.053 1.00 24.24 H new ATOM 0 HH22 ARG A 28 -24.061 -35.448 -1.578 1.00 24.24 H new ATOM 432 N GLN A 29 -20.446 -30.006 -3.345 1.00 17.40 N ATOM 433 CA GLN A 29 -19.264 -29.880 -2.507 1.00 17.28 C ATOM 434 C GLN A 29 -19.587 -30.272 -1.052 1.00 18.02 C ATOM 435 O GLN A 29 -20.357 -31.205 -0.829 1.00 19.19 O ATOM 436 CB GLN A 29 -18.650 -28.475 -2.712 1.00 16.64 C ATOM 437 CG GLN A 29 -17.125 -28.496 -2.915 1.00 16.17 C ATOM 438 CD GLN A 29 -16.353 -29.034 -1.714 1.00 16.90 C ATOM 439 OE1 GLN A 29 -16.542 -28.572 -0.591 1.00 17.29 O ATOM 440 NE2 GLN A 29 -15.506 -30.038 -1.918 1.00 17.41 N ATOM 0 H GLN A 29 -20.292 -30.579 -4.175 1.00 17.40 H new ATOM 0 HA GLN A 29 -18.486 -30.585 -2.800 1.00 17.28 H new ATOM 0 HB2 GLN A 29 -19.117 -28.006 -3.578 1.00 16.64 H new ATOM 0 HB3 GLN A 29 -18.885 -27.855 -1.847 1.00 16.64 H new ATOM 0 HG2 GLN A 29 -16.892 -29.106 -3.788 1.00 16.17 H new ATOM 0 HG3 GLN A 29 -16.782 -27.484 -3.132 1.00 16.17 H new ATOM 0 HE21 GLN A 29 -15.366 -30.404 -2.860 1.00 17.41 H new ATOM 0 HE22 GLN A 29 -14.996 -30.442 -1.133 1.00 17.41 H new ATOM 449 N PHE A 30 -18.973 -29.589 -0.084 1.00 17.53 N ATOM 450 CA PHE A 30 -18.957 -29.920 1.329 1.00 18.24 C ATOM 451 C PHE A 30 -18.758 -28.634 2.128 1.00 17.75 C ATOM 452 O PHE A 30 -19.659 -28.178 2.829 1.00 18.42 O ATOM 453 CB PHE A 30 -17.787 -30.878 1.606 1.00 18.15 C ATOM 454 CG PHE A 30 -18.038 -32.304 1.155 1.00 19.07 C ATOM 455 CD1 PHE A 30 -18.919 -33.120 1.889 1.00 20.45 C ATOM 456 CD2 PHE A 30 -17.423 -32.808 -0.007 1.00 18.78 C ATOM 457 CE1 PHE A 30 -19.172 -34.439 1.474 1.00 21.44 C ATOM 458 CE2 PHE A 30 -17.676 -34.129 -0.420 1.00 19.89 C ATOM 459 CZ PHE A 30 -18.547 -34.946 0.322 1.00 21.17 C ATOM 0 H PHE A 30 -18.444 -28.740 -0.285 1.00 17.53 H new ATOM 0 HA PHE A 30 -19.894 -30.396 1.617 1.00 18.24 H new ATOM 0 HB2 PHE A 30 -16.895 -30.501 1.105 1.00 18.15 H new ATOM 0 HB3 PHE A 30 -17.576 -30.878 2.675 1.00 18.15 H new ATOM 0 HD1 PHE A 30 -19.402 -32.732 2.774 1.00 20.45 H new ATOM 0 HD2 PHE A 30 -16.757 -32.181 -0.581 1.00 18.78 H new ATOM 0 HE1 PHE A 30 -19.847 -35.063 2.041 1.00 21.44 H new ATOM 0 HE2 PHE A 30 -17.200 -34.516 -1.309 1.00 19.89 H new ATOM 0 HZ PHE A 30 -18.735 -35.962 0.007 1.00 21.17 H new ATOM 469 N ARG A 31 -17.546 -28.077 2.040 1.00 16.77 N ATOM 470 CA ARG A 31 -17.103 -26.934 2.831 1.00 16.40 C ATOM 471 C ARG A 31 -15.757 -26.397 2.333 1.00 14.65 C ATOM 472 O ARG A 31 -15.032 -25.751 3.085 1.00 14.29 O ATOM 473 CB ARG A 31 -17.021 -27.329 4.323 1.00 17.63 C ATOM 474 CG ARG A 31 -17.609 -26.261 5.254 1.00 18.24 C ATOM 475 CD ARG A 31 -19.141 -26.261 5.162 1.00 19.66 C ATOM 476 NE ARG A 31 -19.753 -25.363 6.151 1.00 20.66 N ATOM 477 CZ ARG A 31 -21.079 -25.223 6.305 1.00 22.00 C ATOM 478 NH1 ARG A 31 -21.911 -25.909 5.513 1.00 22.47 N ATOM 479 NH2 ARG A 31 -21.564 -24.405 7.246 1.00 23.04 N ATOM 0 H ARG A 31 -16.831 -28.420 1.399 1.00 16.77 H new ATOM 0 HA ARG A 31 -17.833 -26.133 2.717 1.00 16.40 H new ATOM 0 HB2 ARG A 31 -17.552 -28.269 4.475 1.00 17.63 H new ATOM 0 HB3 ARG A 31 -15.979 -27.504 4.591 1.00 17.63 H new ATOM 0 HG2 ARG A 31 -17.299 -26.454 6.281 1.00 18.24 H new ATOM 0 HG3 ARG A 31 -17.221 -25.279 4.983 1.00 18.24 H new ATOM 0 HD2 ARG A 31 -19.444 -25.957 4.160 1.00 19.66 H new ATOM 0 HD3 ARG A 31 -19.513 -27.274 5.313 1.00 19.66 H new ATOM 0 HE ARG A 31 -19.137 -24.817 6.753 1.00 20.66 H new ATOM 0 HH11 ARG A 31 -21.536 -26.533 4.798 1.00 22.47 H new ATOM 0 HH12 ARG A 31 -22.920 -25.808 5.624 1.00 22.47 H new ATOM 0 HH21 ARG A 31 -20.926 -23.886 7.849 1.00 23.04 H new ATOM 0 HH22 ARG A 31 -22.572 -24.301 7.361 1.00 23.04 H new ATOM 493 N ILE A 32 -15.414 -26.683 1.076 1.00 13.83 N ATOM 494 CA ILE A 32 -14.136 -26.368 0.470 1.00 12.42 C ATOM 495 C ILE A 32 -14.455 -25.569 -0.790 1.00 11.88 C ATOM 496 O ILE A 32 -15.040 -26.091 -1.739 1.00 12.63 O ATOM 497 CB ILE A 32 -13.362 -27.664 0.169 1.00 12.65 C ATOM 498 CG1 ILE A 32 -13.163 -28.495 1.452 1.00 13.71 C ATOM 499 CG2 ILE A 32 -12.010 -27.336 -0.486 1.00 11.59 C ATOM 500 CD1 ILE A 32 -12.445 -29.825 1.203 1.00 14.28 C ATOM 0 H ILE A 32 -16.049 -27.159 0.435 1.00 13.83 H new ATOM 0 HA ILE A 32 -13.494 -25.783 1.129 1.00 12.42 H new ATOM 0 HB ILE A 32 -13.948 -28.262 -0.529 1.00 12.65 H new ATOM 0 HG12 ILE A 32 -12.591 -27.909 2.171 1.00 13.71 H new ATOM 0 HG13 ILE A 32 -14.135 -28.693 1.904 1.00 13.71 H new ATOM 0 HG21 ILE A 32 -11.472 -28.261 -0.694 1.00 11.59 H new ATOM 0 HG22 ILE A 32 -12.179 -26.797 -1.418 1.00 11.59 H new ATOM 0 HG23 ILE A 32 -11.419 -26.717 0.189 1.00 11.59 H new ATOM 0 HD11 ILE A 32 -12.336 -30.362 2.145 1.00 14.28 H new ATOM 0 HD12 ILE A 32 -13.028 -30.428 0.507 1.00 14.28 H new ATOM 0 HD13 ILE A 32 -11.459 -29.633 0.779 1.00 14.28 H new ATOM 512 N GLY A 33 -14.084 -24.294 -0.766 1.00 10.99 N ATOM 513 CA GLY A 33 -14.113 -23.369 -1.875 1.00 10.68 C ATOM 514 C GLY A 33 -12.933 -22.418 -1.688 1.00 9.31 C ATOM 515 O GLY A 33 -12.236 -22.496 -0.675 1.00 9.37 O ATOM 0 H GLY A 33 -13.734 -23.858 0.087 1.00 10.99 H new ATOM 0 HA2 GLY A 33 -14.035 -23.900 -2.824 1.00 10.68 H new ATOM 0 HA3 GLY A 33 -15.054 -22.819 -1.895 1.00 10.68 H new ATOM 519 N ASP A 34 -12.713 -21.556 -2.675 1.00 8.38 N ATOM 520 CA ASP A 34 -11.564 -20.665 -2.793 1.00 7.24 C ATOM 521 C ASP A 34 -11.448 -19.716 -1.597 1.00 6.37 C ATOM 522 O ASP A 34 -10.478 -19.783 -0.844 1.00 6.01 O ATOM 523 CB ASP A 34 -11.667 -19.894 -4.115 1.00 7.95 C ATOM 524 CG ASP A 34 -10.536 -18.895 -4.279 1.00 7.88 C ATOM 525 OD1 ASP A 34 -9.467 -19.315 -4.774 1.00 7.69 O ATOM 526 OD2 ASP A 34 -10.756 -17.719 -3.916 1.00 8.58 O ATOM 0 H ASP A 34 -13.364 -21.455 -3.454 1.00 8.38 H new ATOM 0 HA ASP A 34 -10.653 -21.263 -2.793 1.00 7.24 H new ATOM 0 HB2 ASP A 34 -11.653 -20.598 -4.947 1.00 7.95 H new ATOM 0 HB3 ASP A 34 -12.622 -19.371 -4.156 1.00 7.95 H new ATOM 531 N ILE A 35 -12.433 -18.830 -1.426 1.00 6.71 N ATOM 532 CA ILE A 35 -12.469 -17.811 -0.384 1.00 6.51 C ATOM 533 C ILE A 35 -11.145 -17.023 -0.314 1.00 5.14 C ATOM 534 O ILE A 35 -10.665 -16.694 0.771 1.00 5.61 O ATOM 535 CB ILE A 35 -12.914 -18.405 0.975 1.00 7.56 C ATOM 536 CG1 ILE A 35 -14.004 -19.483 0.797 1.00 8.96 C ATOM 537 CG2 ILE A 35 -13.457 -17.291 1.889 1.00 8.14 C ATOM 538 CD1 ILE A 35 -14.512 -20.061 2.122 1.00 10.52 C ATOM 0 H ILE A 35 -13.253 -18.805 -2.032 1.00 6.71 H new ATOM 0 HA ILE A 35 -13.232 -17.079 -0.651 1.00 6.51 H new ATOM 0 HB ILE A 35 -12.038 -18.869 1.428 1.00 7.56 H new ATOM 0 HG12 ILE A 35 -14.844 -19.053 0.251 1.00 8.96 H new ATOM 0 HG13 ILE A 35 -13.607 -20.293 0.185 1.00 8.96 H new ATOM 0 HG21 ILE A 35 -13.767 -17.721 2.842 1.00 8.14 H new ATOM 0 HG22 ILE A 35 -12.677 -16.550 2.062 1.00 8.14 H new ATOM 0 HG23 ILE A 35 -14.312 -16.813 1.411 1.00 8.14 H new ATOM 0 HD11 ILE A 35 -15.276 -20.812 1.922 1.00 10.52 H new ATOM 0 HD12 ILE A 35 -13.683 -20.521 2.660 1.00 10.52 H new ATOM 0 HD13 ILE A 35 -14.939 -19.262 2.728 1.00 10.52 H new ATOM 550 N ALA A 36 -10.566 -16.684 -1.470 1.00 3.92 N ATOM 551 CA ALA A 36 -9.333 -15.916 -1.584 1.00 3.11 C ATOM 552 C ALA A 36 -9.483 -14.844 -2.665 1.00 2.34 C ATOM 553 O ALA A 36 -9.414 -13.652 -2.375 1.00 3.15 O ATOM 554 CB ALA A 36 -8.161 -16.858 -1.881 1.00 3.31 C ATOM 0 H ALA A 36 -10.957 -16.946 -2.375 1.00 3.92 H new ATOM 0 HA ALA A 36 -9.127 -15.410 -0.641 1.00 3.11 H new ATOM 0 HB1 ALA A 36 -7.241 -16.279 -1.965 1.00 3.31 H new ATOM 0 HB2 ALA A 36 -8.062 -17.581 -1.072 1.00 3.31 H new ATOM 0 HB3 ALA A 36 -8.346 -17.384 -2.817 1.00 3.31 H new ATOM 560 N GLY A 37 -9.719 -15.259 -3.909 1.00 2.12 N ATOM 561 CA GLY A 37 -9.769 -14.362 -5.054 1.00 2.03 C ATOM 562 C GLY A 37 -11.195 -14.015 -5.481 1.00 1.94 C ATOM 563 O GLY A 37 -11.356 -13.207 -6.393 1.00 2.57 O ATOM 0 H GLY A 37 -9.882 -16.237 -4.148 1.00 2.12 H new ATOM 0 HA2 GLY A 37 -9.235 -13.443 -4.812 1.00 2.03 H new ATOM 0 HA3 GLY A 37 -9.247 -14.823 -5.892 1.00 2.03 H new ATOM 567 N GLU A 38 -12.222 -14.618 -4.865 1.00 1.85 N ATOM 568 CA GLU A 38 -13.596 -14.578 -5.360 1.00 1.90 C ATOM 569 C GLU A 38 -14.060 -13.185 -5.798 1.00 1.72 C ATOM 570 O GLU A 38 -14.149 -12.925 -6.996 1.00 1.81 O ATOM 571 CB GLU A 38 -14.569 -15.237 -4.371 1.00 2.24 C ATOM 572 CG GLU A 38 -14.073 -16.632 -3.950 1.00 2.65 C ATOM 573 CD GLU A 38 -15.169 -17.548 -3.423 1.00 3.84 C ATOM 574 OE1 GLU A 38 -14.807 -18.474 -2.667 1.00 4.93 O ATOM 575 OE2 GLU A 38 -16.336 -17.342 -3.819 1.00 4.31 O ATOM 0 H GLU A 38 -12.116 -15.151 -4.002 1.00 1.85 H new ATOM 0 HA GLU A 38 -13.601 -15.172 -6.274 1.00 1.90 H new ATOM 0 HB2 GLU A 38 -14.679 -14.606 -3.489 1.00 2.24 H new ATOM 0 HB3 GLU A 38 -15.555 -15.321 -4.828 1.00 2.24 H new ATOM 0 HG2 GLU A 38 -13.595 -17.110 -4.805 1.00 2.65 H new ATOM 0 HG3 GLU A 38 -13.309 -16.518 -3.181 1.00 2.65 H new ATOM 582 N HIS A 39 -14.390 -12.284 -4.864 1.00 1.63 N ATOM 583 CA HIS A 39 -14.822 -10.950 -5.252 1.00 1.55 C ATOM 584 C HIS A 39 -13.629 -10.149 -5.784 1.00 1.41 C ATOM 585 O HIS A 39 -13.764 -9.294 -6.656 1.00 1.40 O ATOM 586 CB HIS A 39 -15.490 -10.244 -4.071 1.00 1.81 C ATOM 587 CG HIS A 39 -16.533 -9.247 -4.511 1.00 2.85 C ATOM 588 ND1 HIS A 39 -17.892 -9.465 -4.499 1.00 3.98 N ATOM 589 CD2 HIS A 39 -16.316 -8.026 -5.095 1.00 4.22 C ATOM 590 CE1 HIS A 39 -18.480 -8.386 -5.042 1.00 5.46 C ATOM 591 NE2 HIS A 39 -17.564 -7.475 -5.407 1.00 5.76 N ATOM 0 H HIS A 39 -14.365 -12.455 -3.859 1.00 1.63 H new ATOM 0 HA HIS A 39 -15.560 -11.028 -6.051 1.00 1.55 H new ATOM 0 HB2 HIS A 39 -15.953 -10.987 -3.422 1.00 1.81 H new ATOM 0 HB3 HIS A 39 -14.730 -9.733 -3.480 1.00 1.81 H new ATOM 0 HD2 HIS A 39 -15.354 -7.571 -5.281 1.00 4.22 H new ATOM 0 HE1 HIS A 39 -19.546 -8.267 -5.168 1.00 5.46 H new ATOM 0 HE2 HIS A 39 -17.742 -6.563 -5.828 1.00 5.76 H new ATOM 599 N THR A 40 -12.465 -10.398 -5.194 1.00 1.56 N ATOM 600 CA THR A 40 -11.293 -9.558 -5.257 1.00 1.73 C ATOM 601 C THR A 40 -10.608 -9.572 -6.630 1.00 1.63 C ATOM 602 O THR A 40 -10.108 -8.538 -7.075 1.00 2.18 O ATOM 603 CB THR A 40 -10.440 -9.944 -4.037 1.00 2.35 C ATOM 604 OG1 THR A 40 -10.532 -11.337 -3.790 1.00 3.92 O ATOM 605 CG2 THR A 40 -11.068 -9.230 -2.830 1.00 3.36 C ATOM 0 H THR A 40 -12.315 -11.236 -4.632 1.00 1.56 H new ATOM 0 HA THR A 40 -11.531 -8.497 -5.184 1.00 1.73 H new ATOM 0 HB THR A 40 -9.398 -9.673 -4.206 1.00 2.35 H new ATOM 0 HG1 THR A 40 -9.947 -11.576 -3.041 1.00 3.92 H new ATOM 0 HG21 THR A 40 -10.501 -9.469 -1.930 1.00 3.36 H new ATOM 0 HG22 THR A 40 -11.050 -8.153 -2.995 1.00 3.36 H new ATOM 0 HG23 THR A 40 -12.099 -9.561 -2.707 1.00 3.36 H new ATOM 613 N SER A 41 -10.601 -10.708 -7.327 1.00 1.26 N ATOM 614 CA SER A 41 -10.322 -10.760 -8.761 1.00 1.13 C ATOM 615 C SER A 41 -11.525 -10.203 -9.543 1.00 1.15 C ATOM 616 O SER A 41 -11.381 -9.314 -10.384 1.00 1.44 O ATOM 617 CB SER A 41 -9.934 -12.185 -9.195 1.00 1.09 C ATOM 618 OG SER A 41 -8.811 -12.163 -10.053 1.00 2.06 O ATOM 0 H SER A 41 -10.789 -11.620 -6.911 1.00 1.26 H new ATOM 0 HA SER A 41 -9.462 -10.130 -8.989 1.00 1.13 H new ATOM 0 HB2 SER A 41 -9.713 -12.790 -8.316 1.00 1.09 H new ATOM 0 HB3 SER A 41 -10.775 -12.657 -9.703 1.00 1.09 H new ATOM 0 HG SER A 41 -8.994 -11.576 -10.816 1.00 2.06 H new ATOM 624 N PHE A 42 -12.720 -10.738 -9.251 1.00 1.10 N ATOM 625 CA PHE A 42 -13.996 -10.426 -9.908 1.00 1.33 C ATOM 626 C PHE A 42 -14.238 -8.925 -10.105 1.00 1.53 C ATOM 627 O PHE A 42 -14.821 -8.543 -11.119 1.00 1.81 O ATOM 628 CB PHE A 42 -15.131 -11.089 -9.118 1.00 1.50 C ATOM 629 CG PHE A 42 -16.535 -10.556 -9.319 1.00 1.66 C ATOM 630 CD1 PHE A 42 -16.968 -9.449 -8.562 1.00 2.69 C ATOM 631 CD2 PHE A 42 -17.461 -11.274 -10.096 1.00 2.34 C ATOM 632 CE1 PHE A 42 -18.314 -9.052 -8.598 1.00 2.91 C ATOM 633 CE2 PHE A 42 -18.814 -10.893 -10.109 1.00 2.39 C ATOM 634 CZ PHE A 42 -19.241 -9.778 -9.366 1.00 2.05 C ATOM 0 H PHE A 42 -12.827 -11.434 -8.513 1.00 1.10 H new ATOM 0 HA PHE A 42 -13.961 -10.831 -10.919 1.00 1.33 H new ATOM 0 HB2 PHE A 42 -15.137 -12.150 -9.366 1.00 1.50 H new ATOM 0 HB3 PHE A 42 -14.891 -11.011 -8.058 1.00 1.50 H new ATOM 0 HD1 PHE A 42 -16.262 -8.904 -7.952 1.00 2.69 H new ATOM 0 HD2 PHE A 42 -17.133 -12.119 -10.683 1.00 2.34 H new ATOM 0 HE1 PHE A 42 -18.637 -8.189 -8.036 1.00 2.91 H new ATOM 0 HE2 PHE A 42 -19.527 -11.458 -10.691 1.00 2.39 H new ATOM 0 HZ PHE A 42 -20.279 -9.480 -9.385 1.00 2.05 H new ATOM 644 N ASP A 43 -13.775 -8.086 -9.166 1.00 1.64 N ATOM 645 CA ASP A 43 -13.687 -6.627 -9.288 1.00 2.19 C ATOM 646 C ASP A 43 -13.438 -6.183 -10.735 1.00 2.22 C ATOM 647 O ASP A 43 -14.094 -5.252 -11.204 1.00 2.82 O ATOM 648 CB ASP A 43 -12.542 -6.101 -8.407 1.00 2.55 C ATOM 649 CG ASP A 43 -12.888 -5.914 -6.941 1.00 3.68 C ATOM 650 OD1 ASP A 43 -14.017 -5.451 -6.674 1.00 3.89 O ATOM 651 OD2 ASP A 43 -11.978 -6.134 -6.109 1.00 5.04 O ATOM 0 H ASP A 43 -13.438 -8.422 -8.264 1.00 1.64 H new ATOM 0 HA ASP A 43 -14.643 -6.217 -8.964 1.00 2.19 H new ATOM 0 HB2 ASP A 43 -11.702 -6.792 -8.480 1.00 2.55 H new ATOM 0 HB3 ASP A 43 -12.205 -5.146 -8.809 1.00 2.55 H new ATOM 656 N LYS A 44 -12.504 -6.879 -11.401 1.00 1.77 N ATOM 657 CA LYS A 44 -12.154 -6.903 -12.825 1.00 1.74 C ATOM 658 C LYS A 44 -10.638 -6.878 -12.974 1.00 1.79 C ATOM 659 O LYS A 44 -10.063 -6.024 -13.646 1.00 2.17 O ATOM 660 CB LYS A 44 -12.867 -5.857 -13.691 1.00 1.95 C ATOM 661 CG LYS A 44 -14.300 -6.334 -13.953 1.00 2.00 C ATOM 662 CD LYS A 44 -15.185 -5.150 -14.346 1.00 2.26 C ATOM 663 CE LYS A 44 -16.592 -5.646 -14.704 1.00 2.94 C ATOM 664 NZ LYS A 44 -17.487 -4.540 -15.099 1.00 3.48 N ATOM 0 H LYS A 44 -11.901 -7.519 -10.884 1.00 1.77 H new ATOM 0 HA LYS A 44 -12.536 -7.840 -13.230 1.00 1.74 H new ATOM 0 HB2 LYS A 44 -12.876 -4.891 -13.187 1.00 1.95 H new ATOM 0 HB3 LYS A 44 -12.336 -5.720 -14.633 1.00 1.95 H new ATOM 0 HG2 LYS A 44 -14.304 -7.080 -14.748 1.00 2.00 H new ATOM 0 HG3 LYS A 44 -14.700 -6.816 -13.061 1.00 2.00 H new ATOM 0 HD2 LYS A 44 -15.240 -4.437 -13.523 1.00 2.26 H new ATOM 0 HD3 LYS A 44 -14.748 -4.624 -15.195 1.00 2.26 H new ATOM 0 HE2 LYS A 44 -16.525 -6.367 -15.519 1.00 2.94 H new ATOM 0 HE3 LYS A 44 -17.020 -6.170 -13.849 1.00 2.94 H new ATOM 0 HZ1 LYS A 44 -18.427 -4.920 -15.332 1.00 3.48 H new ATOM 0 HZ2 LYS A 44 -17.572 -3.865 -14.313 1.00 3.48 H new ATOM 0 HZ3 LYS A 44 -17.093 -4.055 -15.931 1.00 3.48 H new ATOM 678 N LEU A 45 -10.011 -7.871 -12.350 1.00 1.61 N ATOM 679 CA LEU A 45 -8.591 -8.143 -12.400 1.00 1.80 C ATOM 680 C LEU A 45 -8.438 -9.586 -12.898 1.00 1.66 C ATOM 681 O LEU A 45 -8.954 -10.491 -12.242 1.00 2.22 O ATOM 682 CB LEU A 45 -7.991 -7.959 -10.998 1.00 2.16 C ATOM 683 CG LEU A 45 -7.974 -6.486 -10.540 1.00 2.33 C ATOM 684 CD1 LEU A 45 -9.205 -6.147 -9.695 1.00 1.76 C ATOM 685 CD2 LEU A 45 -6.730 -6.227 -9.685 1.00 3.61 C ATOM 0 H LEU A 45 -10.514 -8.540 -11.766 1.00 1.61 H new ATOM 0 HA LEU A 45 -8.063 -7.463 -13.069 1.00 1.80 H new ATOM 0 HB2 LEU A 45 -8.564 -8.550 -10.283 1.00 2.16 H new ATOM 0 HB3 LEU A 45 -6.973 -8.348 -10.990 1.00 2.16 H new ATOM 0 HG LEU A 45 -7.971 -5.865 -11.436 1.00 2.33 H new ATOM 0 HD11 LEU A 45 -9.160 -5.102 -9.390 1.00 1.76 H new ATOM 0 HD12 LEU A 45 -10.107 -6.315 -10.283 1.00 1.76 H new ATOM 0 HD13 LEU A 45 -9.225 -6.783 -8.810 1.00 1.76 H new ATOM 0 HD21 LEU A 45 -6.720 -5.186 -9.363 1.00 3.61 H new ATOM 0 HD22 LEU A 45 -6.748 -6.877 -8.810 1.00 3.61 H new ATOM 0 HD23 LEU A 45 -5.835 -6.433 -10.272 1.00 3.61 H new ATOM 697 N PRO A 46 -7.813 -9.820 -14.066 1.00 1.38 N ATOM 698 CA PRO A 46 -7.678 -11.152 -14.642 1.00 1.62 C ATOM 699 C PRO A 46 -6.538 -11.927 -13.968 1.00 1.70 C ATOM 700 O PRO A 46 -6.016 -11.519 -12.936 1.00 1.71 O ATOM 701 CB PRO A 46 -7.423 -10.897 -16.135 1.00 2.04 C ATOM 702 CG PRO A 46 -6.640 -9.586 -16.126 1.00 2.02 C ATOM 703 CD PRO A 46 -7.297 -8.814 -14.984 1.00 1.61 C ATOM 0 HA PRO A 46 -8.561 -11.774 -14.493 1.00 1.62 H new ATOM 0 HB2 PRO A 46 -6.852 -11.706 -16.592 1.00 2.04 H new ATOM 0 HB3 PRO A 46 -8.354 -10.808 -16.695 1.00 2.04 H new ATOM 0 HG2 PRO A 46 -5.577 -9.750 -15.946 1.00 2.02 H new ATOM 0 HG3 PRO A 46 -6.725 -9.056 -17.075 1.00 2.02 H new ATOM 0 HD2 PRO A 46 -6.577 -8.164 -14.487 1.00 1.61 H new ATOM 0 HD3 PRO A 46 -8.099 -8.176 -15.355 1.00 1.61 H new ATOM 711 N GLU A 47 -6.117 -13.040 -14.570 1.00 2.30 N ATOM 712 CA GLU A 47 -5.092 -13.924 -14.030 1.00 2.79 C ATOM 713 C GLU A 47 -3.702 -13.281 -13.884 1.00 2.35 C ATOM 714 O GLU A 47 -2.838 -13.861 -13.226 1.00 2.97 O ATOM 715 CB GLU A 47 -5.011 -15.174 -14.920 1.00 3.69 C ATOM 716 CG GLU A 47 -4.696 -14.835 -16.388 1.00 3.86 C ATOM 717 CD GLU A 47 -4.505 -16.096 -17.220 1.00 4.97 C ATOM 718 OE1 GLU A 47 -5.217 -16.213 -18.239 1.00 5.80 O ATOM 719 OE2 GLU A 47 -3.642 -16.907 -16.824 1.00 5.42 O ATOM 0 H GLU A 47 -6.489 -13.356 -15.466 1.00 2.30 H new ATOM 0 HA GLU A 47 -5.393 -14.175 -13.013 1.00 2.79 H new ATOM 0 HB2 GLU A 47 -4.242 -15.843 -14.532 1.00 3.69 H new ATOM 0 HB3 GLU A 47 -5.957 -15.713 -14.870 1.00 3.69 H new ATOM 0 HG2 GLU A 47 -5.507 -14.240 -16.808 1.00 3.86 H new ATOM 0 HG3 GLU A 47 -3.794 -14.225 -16.437 1.00 3.86 H new ATOM 726 N GLY A 48 -3.463 -12.150 -14.559 1.00 1.85 N ATOM 727 CA GLY A 48 -2.131 -11.640 -14.859 1.00 2.01 C ATOM 728 C GLY A 48 -1.378 -11.006 -13.684 1.00 1.21 C ATOM 729 O GLY A 48 -1.780 -11.112 -12.526 1.00 1.98 O ATOM 0 H GLY A 48 -4.210 -11.555 -14.917 1.00 1.85 H new ATOM 0 HA2 GLY A 48 -1.529 -12.459 -15.252 1.00 2.01 H new ATOM 0 HA3 GLY A 48 -2.217 -10.898 -15.653 1.00 2.01 H new ATOM 733 N GLY A 49 -0.275 -10.321 -14.014 1.00 1.28 N ATOM 734 CA GLY A 49 0.655 -9.743 -13.054 1.00 0.92 C ATOM 735 C GLY A 49 0.366 -8.267 -12.763 1.00 1.33 C ATOM 736 O GLY A 49 -0.704 -7.932 -12.270 1.00 2.98 O ATOM 0 H GLY A 49 -0.004 -10.153 -14.983 1.00 1.28 H new ATOM 0 HA2 GLY A 49 0.607 -10.308 -12.123 1.00 0.92 H new ATOM 0 HA3 GLY A 49 1.671 -9.841 -13.435 1.00 0.92 H new ATOM 740 N ARG A 50 1.314 -7.375 -13.065 1.00 0.96 N ATOM 741 CA ARG A 50 1.433 -6.076 -12.405 1.00 0.85 C ATOM 742 C ARG A 50 0.398 -5.048 -12.882 1.00 1.05 C ATOM 743 O ARG A 50 0.530 -4.502 -13.979 1.00 1.65 O ATOM 744 CB ARG A 50 2.873 -5.546 -12.544 1.00 0.90 C ATOM 745 CG ARG A 50 3.433 -5.552 -13.981 1.00 2.02 C ATOM 746 CD ARG A 50 4.498 -6.639 -14.204 1.00 2.40 C ATOM 747 NE ARG A 50 5.667 -6.433 -13.332 1.00 2.79 N ATOM 748 CZ ARG A 50 6.666 -7.315 -13.163 1.00 3.61 C ATOM 749 NH1 ARG A 50 6.675 -8.455 -13.862 1.00 4.44 N ATOM 750 NH2 ARG A 50 7.651 -7.049 -12.297 1.00 4.67 N ATOM 0 H ARG A 50 2.024 -7.537 -13.779 1.00 0.96 H new ATOM 0 HA ARG A 50 1.211 -6.231 -11.349 1.00 0.85 H new ATOM 0 HB2 ARG A 50 2.908 -4.526 -12.161 1.00 0.90 H new ATOM 0 HB3 ARG A 50 3.528 -6.146 -11.912 1.00 0.90 H new ATOM 0 HG2 ARG A 50 2.614 -5.703 -14.684 1.00 2.02 H new ATOM 0 HG3 ARG A 50 3.866 -4.576 -14.201 1.00 2.02 H new ATOM 0 HD2 ARG A 50 4.065 -7.620 -14.009 1.00 2.40 H new ATOM 0 HD3 ARG A 50 4.814 -6.632 -15.247 1.00 2.40 H new ATOM 0 HE ARG A 50 5.722 -5.554 -12.817 1.00 2.79 H new ATOM 0 HH11 ARG A 50 5.924 -8.654 -14.523 1.00 4.44 H new ATOM 0 HH12 ARG A 50 7.433 -9.125 -13.735 1.00 4.44 H new ATOM 0 HH21 ARG A 50 7.642 -6.178 -11.767 1.00 4.67 H new ATOM 0 HH22 ARG A 50 8.410 -7.718 -12.167 1.00 4.67 H new ATOM 764 N ALA A 51 -0.574 -4.718 -12.021 1.00 1.06 N ATOM 765 CA ALA A 51 -1.463 -3.583 -12.247 1.00 1.10 C ATOM 766 C ALA A 51 -0.809 -2.256 -11.847 1.00 0.63 C ATOM 767 O ALA A 51 0.309 -2.221 -11.339 1.00 0.96 O ATOM 768 CB ALA A 51 -2.802 -3.741 -11.518 1.00 1.79 C ATOM 0 H ALA A 51 -0.761 -5.228 -11.158 1.00 1.06 H new ATOM 0 HA ALA A 51 -1.658 -3.565 -13.319 1.00 1.10 H new ATOM 0 HB1 ALA A 51 -3.429 -2.872 -11.717 1.00 1.79 H new ATOM 0 HB2 ALA A 51 -3.305 -4.640 -11.873 1.00 1.79 H new ATOM 0 HB3 ALA A 51 -2.625 -3.823 -10.446 1.00 1.79 H new ATOM 774 N THR A 52 -1.525 -1.154 -12.090 1.00 0.59 N ATOM 775 CA THR A 52 -0.978 0.196 -12.146 1.00 0.71 C ATOM 776 C THR A 52 -1.332 1.019 -10.892 1.00 0.90 C ATOM 777 O THR A 52 -1.826 2.135 -10.989 1.00 1.30 O ATOM 778 CB THR A 52 -1.478 0.814 -13.473 1.00 0.95 C ATOM 779 OG1 THR A 52 -0.999 2.127 -13.680 1.00 1.37 O ATOM 780 CG2 THR A 52 -3.005 0.745 -13.652 1.00 1.01 C ATOM 0 H THR A 52 -2.531 -1.183 -12.258 1.00 0.59 H new ATOM 0 HA THR A 52 0.112 0.187 -12.139 1.00 0.71 H new ATOM 0 HB THR A 52 -1.048 0.181 -14.249 1.00 0.95 H new ATOM 0 HG1 THR A 52 -1.180 2.670 -12.885 1.00 1.37 H new ATOM 0 HG21 THR A 52 -3.280 1.197 -14.605 1.00 1.01 H new ATOM 0 HG22 THR A 52 -3.326 -0.297 -13.639 1.00 1.01 H new ATOM 0 HG23 THR A 52 -3.491 1.285 -12.840 1.00 1.01 H new ATOM 788 N TYR A 53 -0.973 0.544 -9.696 1.00 1.30 N ATOM 789 CA TYR A 53 -1.263 1.244 -8.441 1.00 1.73 C ATOM 790 C TYR A 53 -0.284 2.406 -8.228 1.00 1.68 C ATOM 791 O TYR A 53 0.564 2.378 -7.339 1.00 2.22 O ATOM 792 CB TYR A 53 -1.226 0.265 -7.256 1.00 2.04 C ATOM 793 CG TYR A 53 -2.465 -0.581 -7.048 1.00 1.89 C ATOM 794 CD1 TYR A 53 -3.165 -1.134 -8.138 1.00 2.67 C ATOM 795 CD2 TYR A 53 -2.854 -0.910 -5.734 1.00 2.65 C ATOM 796 CE1 TYR A 53 -4.252 -1.992 -7.915 1.00 3.16 C ATOM 797 CE2 TYR A 53 -3.927 -1.791 -5.519 1.00 2.93 C ATOM 798 CZ TYR A 53 -4.645 -2.307 -6.607 1.00 2.84 C ATOM 799 OH TYR A 53 -5.671 -3.173 -6.387 1.00 3.58 O ATOM 0 H TYR A 53 -0.473 -0.336 -9.570 1.00 1.30 H new ATOM 0 HA TYR A 53 -2.268 1.661 -8.503 1.00 1.73 H new ATOM 0 HB2 TYR A 53 -0.374 -0.402 -7.389 1.00 2.04 H new ATOM 0 HB3 TYR A 53 -1.044 0.836 -6.345 1.00 2.04 H new ATOM 0 HD1 TYR A 53 -2.864 -0.897 -9.148 1.00 2.67 H new ATOM 0 HD2 TYR A 53 -2.327 -0.485 -4.892 1.00 2.65 H new ATOM 0 HE1 TYR A 53 -4.788 -2.411 -8.754 1.00 3.16 H new ATOM 0 HE2 TYR A 53 -4.200 -2.072 -4.512 1.00 2.93 H new ATOM 0 HH TYR A 53 -5.713 -3.823 -7.119 1.00 3.58 H new ATOM 809 N ARG A 54 -0.406 3.437 -9.061 1.00 1.31 N ATOM 810 CA ARG A 54 0.371 4.661 -8.967 1.00 1.15 C ATOM 811 C ARG A 54 -0.239 5.541 -7.875 1.00 1.01 C ATOM 812 O ARG A 54 -1.384 5.980 -8.006 1.00 1.25 O ATOM 813 CB ARG A 54 0.287 5.395 -10.315 1.00 1.43 C ATOM 814 CG ARG A 54 1.088 4.713 -11.433 1.00 1.50 C ATOM 815 CD ARG A 54 2.580 5.081 -11.387 1.00 2.01 C ATOM 816 NE ARG A 54 2.808 6.530 -11.532 1.00 2.71 N ATOM 817 CZ ARG A 54 2.725 7.229 -12.677 1.00 3.08 C ATOM 818 NH1 ARG A 54 2.416 6.607 -13.820 1.00 3.09 N ATOM 819 NH2 ARG A 54 2.953 8.548 -12.673 1.00 4.62 N ATOM 0 H ARG A 54 -1.066 3.440 -9.838 1.00 1.31 H new ATOM 0 HA ARG A 54 1.411 4.440 -8.727 1.00 1.15 H new ATOM 0 HB2 ARG A 54 -0.758 5.465 -10.618 1.00 1.43 H new ATOM 0 HB3 ARG A 54 0.651 6.415 -10.188 1.00 1.43 H new ATOM 0 HG2 ARG A 54 0.980 3.632 -11.347 1.00 1.50 H new ATOM 0 HG3 ARG A 54 0.675 4.999 -12.400 1.00 1.50 H new ATOM 0 HD2 ARG A 54 3.006 4.742 -10.443 1.00 2.01 H new ATOM 0 HD3 ARG A 54 3.106 4.552 -12.182 1.00 2.01 H new ATOM 0 HE ARG A 54 3.050 7.049 -10.688 1.00 2.71 H new ATOM 0 HH11 ARG A 54 2.243 5.602 -13.823 1.00 3.09 H new ATOM 0 HH12 ARG A 54 2.353 7.138 -14.689 1.00 3.09 H new ATOM 0 HH21 ARG A 54 3.190 9.022 -11.801 1.00 4.62 H new ATOM 0 HH22 ARG A 54 2.890 9.079 -13.542 1.00 4.62 H new ATOM 833 N GLY A 55 0.518 5.838 -6.814 1.00 0.76 N ATOM 834 CA GLY A 55 0.041 6.780 -5.816 1.00 0.64 C ATOM 835 C GLY A 55 1.166 7.366 -4.977 1.00 0.53 C ATOM 836 O GLY A 55 2.351 7.217 -5.282 1.00 0.62 O ATOM 0 H GLY A 55 1.442 5.446 -6.632 1.00 0.76 H new ATOM 0 HA2 GLY A 55 -0.495 7.589 -6.313 1.00 0.64 H new ATOM 0 HA3 GLY A 55 -0.672 6.279 -5.161 1.00 0.64 H new ATOM 840 N THR A 56 0.800 8.072 -3.913 1.00 0.50 N ATOM 841 CA THR A 56 1.718 8.758 -3.029 1.00 0.62 C ATOM 842 C THR A 56 1.155 8.709 -1.614 1.00 0.69 C ATOM 843 O THR A 56 -0.056 8.777 -1.411 1.00 0.86 O ATOM 844 CB THR A 56 1.987 10.175 -3.553 1.00 1.10 C ATOM 845 OG1 THR A 56 2.477 10.086 -4.880 1.00 3.01 O ATOM 846 CG2 THR A 56 3.027 10.921 -2.713 1.00 2.08 C ATOM 0 H THR A 56 -0.176 8.182 -3.639 1.00 0.50 H new ATOM 0 HA THR A 56 2.691 8.268 -3.001 1.00 0.62 H new ATOM 0 HB THR A 56 1.048 10.726 -3.502 1.00 1.10 H new ATOM 0 HG1 THR A 56 2.651 10.986 -5.226 1.00 3.01 H new ATOM 0 HG21 THR A 56 3.181 11.918 -3.126 1.00 2.08 H new ATOM 0 HG22 THR A 56 2.673 11.004 -1.685 1.00 2.08 H new ATOM 0 HG23 THR A 56 3.969 10.373 -2.729 1.00 2.08 H new ATOM 854 N ALA A 57 2.066 8.511 -0.665 1.00 0.79 N ATOM 855 CA ALA A 57 1.836 8.194 0.726 1.00 0.78 C ATOM 856 C ALA A 57 2.511 9.282 1.552 1.00 0.75 C ATOM 857 O ALA A 57 3.594 9.065 2.093 1.00 0.89 O ATOM 858 CB ALA A 57 2.460 6.822 0.984 1.00 0.78 C ATOM 0 H ALA A 57 3.062 8.575 -0.875 1.00 0.79 H new ATOM 0 HA ALA A 57 0.779 8.156 0.989 1.00 0.78 H new ATOM 0 HB1 ALA A 57 2.308 6.544 2.027 1.00 0.78 H new ATOM 0 HB2 ALA A 57 1.989 6.081 0.338 1.00 0.78 H new ATOM 0 HB3 ALA A 57 3.528 6.862 0.771 1.00 0.78 H new ATOM 864 N PHE A 58 1.880 10.454 1.627 1.00 0.80 N ATOM 865 CA PHE A 58 2.484 11.615 2.268 1.00 0.83 C ATOM 866 C PHE A 58 2.371 11.465 3.772 1.00 0.77 C ATOM 867 O PHE A 58 1.368 10.982 4.289 1.00 0.75 O ATOM 868 CB PHE A 58 1.913 12.931 1.737 1.00 1.06 C ATOM 869 CG PHE A 58 0.473 13.236 2.096 1.00 1.17 C ATOM 870 CD1 PHE A 58 0.186 13.849 3.329 1.00 2.59 C ATOM 871 CD2 PHE A 58 -0.558 13.037 1.159 1.00 1.86 C ATOM 872 CE1 PHE A 58 -1.122 14.256 3.630 1.00 2.83 C ATOM 873 CE2 PHE A 58 -1.866 13.461 1.453 1.00 1.99 C ATOM 874 CZ PHE A 58 -2.148 14.080 2.684 1.00 1.78 C ATOM 0 H PHE A 58 0.947 10.621 1.249 1.00 0.80 H new ATOM 0 HA PHE A 58 3.544 11.658 2.016 1.00 0.83 H new ATOM 0 HB2 PHE A 58 2.536 13.746 2.104 1.00 1.06 H new ATOM 0 HB3 PHE A 58 2.000 12.927 0.651 1.00 1.06 H new ATOM 0 HD1 PHE A 58 0.977 14.007 4.047 1.00 2.59 H new ATOM 0 HD2 PHE A 58 -0.345 12.559 0.214 1.00 1.86 H new ATOM 0 HE1 PHE A 58 -1.341 14.704 4.588 1.00 2.83 H new ATOM 0 HE2 PHE A 58 -2.656 13.311 0.732 1.00 1.99 H new ATOM 0 HZ PHE A 58 -3.150 14.419 2.902 1.00 1.78 H new ATOM 884 N GLY A 59 3.439 11.827 4.471 1.00 0.82 N ATOM 885 CA GLY A 59 3.546 11.575 5.896 1.00 0.88 C ATOM 886 C GLY A 59 2.718 12.590 6.674 1.00 0.98 C ATOM 887 O GLY A 59 2.374 13.648 6.149 1.00 1.02 O ATOM 0 H GLY A 59 4.248 12.300 4.067 1.00 0.82 H new ATOM 0 HA2 GLY A 59 3.202 10.565 6.121 1.00 0.88 H new ATOM 0 HA3 GLY A 59 4.590 11.633 6.205 1.00 0.88 H new ATOM 891 N SER A 60 2.471 12.327 7.959 1.00 1.17 N ATOM 892 CA SER A 60 1.893 13.341 8.839 1.00 1.33 C ATOM 893 C SER A 60 2.767 14.607 8.873 1.00 1.33 C ATOM 894 O SER A 60 2.264 15.693 9.150 1.00 1.58 O ATOM 895 CB SER A 60 1.705 12.762 10.245 1.00 1.52 C ATOM 896 OG SER A 60 0.901 13.621 11.031 1.00 1.78 O ATOM 0 H SER A 60 2.660 11.431 8.408 1.00 1.17 H new ATOM 0 HA SER A 60 0.918 13.630 8.447 1.00 1.33 H new ATOM 0 HB2 SER A 60 1.241 11.778 10.180 1.00 1.52 H new ATOM 0 HB3 SER A 60 2.676 12.626 10.722 1.00 1.52 H new ATOM 0 HG SER A 60 0.789 13.237 11.925 1.00 1.78 H new ATOM 902 N ASP A 61 4.070 14.441 8.619 1.00 1.20 N ATOM 903 CA ASP A 61 5.092 15.481 8.546 1.00 1.28 C ATOM 904 C ASP A 61 5.365 15.902 7.088 1.00 1.13 C ATOM 905 O ASP A 61 6.277 16.677 6.821 1.00 1.14 O ATOM 906 CB ASP A 61 6.351 14.859 9.179 1.00 1.45 C ATOM 907 CG ASP A 61 7.551 15.796 9.257 1.00 1.76 C ATOM 908 OD1 ASP A 61 8.629 15.367 8.787 1.00 2.65 O ATOM 909 OD2 ASP A 61 7.385 16.882 9.850 1.00 2.16 O ATOM 0 H ASP A 61 4.460 13.514 8.448 1.00 1.20 H new ATOM 0 HA ASP A 61 4.776 16.385 9.066 1.00 1.28 H new ATOM 0 HB2 ASP A 61 6.106 14.519 10.185 1.00 1.45 H new ATOM 0 HB3 ASP A 61 6.632 13.976 8.604 1.00 1.45 H new ATOM 914 N ASP A 62 4.642 15.319 6.121 1.00 1.06 N ATOM 915 CA ASP A 62 5.226 14.844 4.886 1.00 1.14 C ATOM 916 C ASP A 62 6.737 14.638 4.862 1.00 1.19 C ATOM 917 O ASP A 62 7.473 15.240 4.083 1.00 1.40 O ATOM 918 CB ASP A 62 4.650 15.432 3.599 1.00 1.26 C ATOM 919 CG ASP A 62 4.959 14.484 2.443 1.00 1.96 C ATOM 920 OD1 ASP A 62 5.248 13.298 2.740 1.00 2.99 O ATOM 921 OD2 ASP A 62 4.824 14.923 1.284 1.00 2.46 O ATOM 0 H ASP A 62 3.635 15.169 6.186 1.00 1.06 H new ATOM 0 HA ASP A 62 4.854 13.819 4.894 1.00 1.14 H new ATOM 0 HB2 ASP A 62 3.573 15.570 3.696 1.00 1.26 H new ATOM 0 HB3 ASP A 62 5.081 16.414 3.407 1.00 1.26 H new ATOM 926 N ALA A 63 7.152 13.648 5.649 1.00 1.11 N ATOM 927 CA ALA A 63 8.310 12.838 5.336 1.00 1.08 C ATOM 928 C ALA A 63 7.778 11.491 4.849 1.00 0.88 C ATOM 929 O ALA A 63 8.091 10.449 5.420 1.00 0.91 O ATOM 930 CB ALA A 63 9.140 12.694 6.608 1.00 1.27 C ATOM 0 H ALA A 63 6.689 13.391 6.521 1.00 1.11 H new ATOM 0 HA ALA A 63 8.946 13.276 4.567 1.00 1.08 H new ATOM 0 HB1 ALA A 63 10.021 12.087 6.401 1.00 1.27 H new ATOM 0 HB2 ALA A 63 9.452 13.680 6.953 1.00 1.27 H new ATOM 0 HB3 ALA A 63 8.541 12.212 7.381 1.00 1.27 H new ATOM 936 N GLY A 64 6.950 11.523 3.806 1.00 0.80 N ATOM 937 CA GLY A 64 6.234 10.376 3.290 1.00 0.69 C ATOM 938 C GLY A 64 6.886 9.817 2.029 1.00 0.68 C ATOM 939 O GLY A 64 7.932 10.285 1.580 1.00 1.13 O ATOM 0 H GLY A 64 6.759 12.379 3.286 1.00 0.80 H new ATOM 0 HA2 GLY A 64 6.195 9.599 4.053 1.00 0.69 H new ATOM 0 HA3 GLY A 64 5.204 10.659 3.071 1.00 0.69 H new ATOM 943 N GLY A 65 6.289 8.750 1.502 1.00 0.61 N ATOM 944 CA GLY A 65 6.788 7.960 0.398 1.00 0.67 C ATOM 945 C GLY A 65 5.886 8.024 -0.826 1.00 0.54 C ATOM 946 O GLY A 65 4.829 8.648 -0.819 1.00 0.76 O ATOM 0 H GLY A 65 5.399 8.402 1.858 1.00 0.61 H new ATOM 0 HA2 GLY A 65 7.785 8.309 0.128 1.00 0.67 H new ATOM 0 HA3 GLY A 65 6.889 6.922 0.716 1.00 0.67 H new ATOM 950 N LYS A 66 6.318 7.351 -1.891 1.00 0.56 N ATOM 951 CA LYS A 66 5.528 7.109 -3.088 1.00 0.58 C ATOM 952 C LYS A 66 4.929 5.707 -2.969 1.00 0.64 C ATOM 953 O LYS A 66 5.619 4.816 -2.478 1.00 0.94 O ATOM 954 CB LYS A 66 6.457 7.204 -4.299 1.00 0.82 C ATOM 955 CG LYS A 66 7.042 8.615 -4.416 1.00 1.01 C ATOM 956 CD LYS A 66 8.074 8.686 -5.546 1.00 1.50 C ATOM 957 CE LYS A 66 9.288 7.778 -5.279 1.00 2.23 C ATOM 958 NZ LYS A 66 10.472 8.231 -6.039 1.00 3.67 N ATOM 0 H LYS A 66 7.254 6.949 -1.942 1.00 0.56 H new ATOM 0 HA LYS A 66 4.725 7.837 -3.203 1.00 0.58 H new ATOM 0 HB2 LYS A 66 7.263 6.476 -4.205 1.00 0.82 H new ATOM 0 HB3 LYS A 66 5.908 6.955 -5.207 1.00 0.82 H new ATOM 0 HG2 LYS A 66 6.242 9.331 -4.603 1.00 1.01 H new ATOM 0 HG3 LYS A 66 7.509 8.899 -3.473 1.00 1.01 H new ATOM 0 HD2 LYS A 66 7.603 8.395 -6.485 1.00 1.50 H new ATOM 0 HD3 LYS A 66 8.411 9.716 -5.664 1.00 1.50 H new ATOM 0 HE2 LYS A 66 9.516 7.775 -4.213 1.00 2.23 H new ATOM 0 HE3 LYS A 66 9.046 6.752 -5.556 1.00 2.23 H new ATOM 0 HZ1 LYS A 66 11.334 7.855 -5.595 1.00 3.67 H new ATOM 0 HZ2 LYS A 66 10.408 7.887 -7.018 1.00 3.67 H new ATOM 0 HZ3 LYS A 66 10.508 9.270 -6.039 1.00 3.67 H new ATOM 972 N LEU A 67 3.685 5.489 -3.415 1.00 0.64 N ATOM 973 CA LEU A 67 3.162 4.133 -3.529 1.00 0.68 C ATOM 974 C LEU A 67 3.526 3.636 -4.923 1.00 0.66 C ATOM 975 O LEU A 67 2.954 4.087 -5.918 1.00 0.88 O ATOM 976 CB LEU A 67 1.649 4.046 -3.268 1.00 0.72 C ATOM 977 CG LEU A 67 1.193 2.571 -3.190 1.00 0.73 C ATOM 978 CD1 LEU A 67 1.506 1.936 -1.828 1.00 0.83 C ATOM 979 CD2 LEU A 67 -0.315 2.439 -3.417 1.00 0.79 C ATOM 0 H LEU A 67 3.036 6.224 -3.697 1.00 0.64 H new ATOM 0 HA LEU A 67 3.607 3.502 -2.760 1.00 0.68 H new ATOM 0 HB2 LEU A 67 1.405 4.557 -2.337 1.00 0.72 H new ATOM 0 HB3 LEU A 67 1.107 4.558 -4.063 1.00 0.72 H new ATOM 0 HG LEU A 67 1.747 2.054 -3.974 1.00 0.73 H new ATOM 0 HD11 LEU A 67 1.167 0.900 -1.823 1.00 0.83 H new ATOM 0 HD12 LEU A 67 2.581 1.967 -1.651 1.00 0.83 H new ATOM 0 HD13 LEU A 67 0.993 2.490 -1.042 1.00 0.83 H new ATOM 0 HD21 LEU A 67 -0.602 1.389 -3.355 1.00 0.79 H new ATOM 0 HD22 LEU A 67 -0.849 3.006 -2.654 1.00 0.79 H new ATOM 0 HD23 LEU A 67 -0.570 2.827 -4.403 1.00 0.79 H new ATOM 991 N THR A 68 4.499 2.726 -4.981 1.00 0.61 N ATOM 992 CA THR A 68 4.944 2.125 -6.224 1.00 0.64 C ATOM 993 C THR A 68 3.950 1.038 -6.642 1.00 0.69 C ATOM 994 O THR A 68 3.429 0.319 -5.795 1.00 0.89 O ATOM 995 CB THR A 68 6.363 1.570 -6.033 1.00 0.88 C ATOM 996 OG1 THR A 68 7.178 2.517 -5.360 1.00 1.90 O ATOM 997 CG2 THR A 68 6.985 1.284 -7.402 1.00 1.36 C ATOM 0 H THR A 68 4.999 2.388 -4.159 1.00 0.61 H new ATOM 0 HA THR A 68 4.980 2.866 -7.023 1.00 0.64 H new ATOM 0 HB THR A 68 6.302 0.656 -5.442 1.00 0.88 H new ATOM 0 HG1 THR A 68 7.187 2.318 -4.400 1.00 1.90 H new ATOM 0 HG21 THR A 68 7.992 0.890 -7.269 1.00 1.36 H new ATOM 0 HG22 THR A 68 6.376 0.552 -7.932 1.00 1.36 H new ATOM 0 HG23 THR A 68 7.030 2.206 -7.981 1.00 1.36 H new ATOM 1005 N TYR A 69 3.676 0.907 -7.941 1.00 0.63 N ATOM 1006 CA TYR A 69 2.663 -0.023 -8.413 1.00 0.63 C ATOM 1007 C TYR A 69 3.212 -1.449 -8.434 1.00 0.58 C ATOM 1008 O TYR A 69 4.146 -1.749 -9.176 1.00 0.65 O ATOM 1009 CB TYR A 69 2.118 0.406 -9.781 1.00 0.65 C ATOM 1010 CG TYR A 69 3.121 0.528 -10.914 1.00 0.68 C ATOM 1011 CD1 TYR A 69 3.279 -0.524 -11.836 1.00 1.69 C ATOM 1012 CD2 TYR A 69 3.857 1.715 -11.081 1.00 2.00 C ATOM 1013 CE1 TYR A 69 4.182 -0.396 -12.904 1.00 1.72 C ATOM 1014 CE2 TYR A 69 4.772 1.838 -12.141 1.00 2.11 C ATOM 1015 CZ TYR A 69 4.939 0.777 -13.049 1.00 1.02 C ATOM 1016 OH TYR A 69 5.825 0.885 -14.078 1.00 1.31 O ATOM 0 H TYR A 69 4.143 1.434 -8.679 1.00 0.63 H new ATOM 0 HA TYR A 69 1.824 -0.006 -7.717 1.00 0.63 H new ATOM 0 HB2 TYR A 69 1.353 -0.310 -10.081 1.00 0.65 H new ATOM 0 HB3 TYR A 69 1.623 1.370 -9.662 1.00 0.65 H new ATOM 0 HD1 TYR A 69 2.705 -1.431 -11.722 1.00 1.69 H new ATOM 0 HD2 TYR A 69 3.719 2.535 -10.392 1.00 2.00 H new ATOM 0 HE1 TYR A 69 4.294 -1.201 -13.615 1.00 1.72 H new ATOM 0 HE2 TYR A 69 5.346 2.746 -12.258 1.00 2.11 H new ATOM 0 HH TYR A 69 6.268 1.758 -14.038 1.00 1.31 H new ATOM 1026 N THR A 70 2.657 -2.337 -7.606 1.00 0.54 N ATOM 1027 CA THR A 70 3.024 -3.746 -7.569 1.00 0.55 C ATOM 1028 C THR A 70 1.835 -4.549 -7.044 1.00 0.59 C ATOM 1029 O THR A 70 1.735 -4.782 -5.842 1.00 0.65 O ATOM 1030 CB THR A 70 4.265 -3.937 -6.678 1.00 0.65 C ATOM 1031 OG1 THR A 70 5.378 -3.244 -7.211 1.00 0.89 O ATOM 1032 CG2 THR A 70 4.653 -5.415 -6.562 1.00 0.77 C ATOM 0 H THR A 70 1.930 -2.089 -6.935 1.00 0.54 H new ATOM 0 HA THR A 70 3.274 -4.100 -8.569 1.00 0.55 H new ATOM 0 HB THR A 70 4.004 -3.545 -5.695 1.00 0.65 H new ATOM 0 HG1 THR A 70 5.110 -2.772 -8.027 1.00 0.89 H new ATOM 0 HG21 THR A 70 5.533 -5.511 -5.926 1.00 0.77 H new ATOM 0 HG22 THR A 70 3.826 -5.975 -6.125 1.00 0.77 H new ATOM 0 HG23 THR A 70 4.876 -5.811 -7.553 1.00 0.77 H new ATOM 1040 N ILE A 71 0.918 -4.966 -7.925 1.00 0.66 N ATOM 1041 CA ILE A 71 -0.162 -5.864 -7.542 1.00 0.75 C ATOM 1042 C ILE A 71 -0.282 -6.897 -8.650 1.00 0.80 C ATOM 1043 O ILE A 71 -0.392 -6.520 -9.812 1.00 1.04 O ATOM 1044 CB ILE A 71 -1.475 -5.089 -7.292 1.00 0.89 C ATOM 1045 CG1 ILE A 71 -2.412 -4.989 -8.500 1.00 1.12 C ATOM 1046 CG2 ILE A 71 -1.166 -3.634 -6.922 1.00 1.03 C ATOM 1047 CD1 ILE A 71 -3.292 -6.209 -8.761 1.00 1.56 C ATOM 0 H ILE A 71 0.908 -4.692 -8.907 1.00 0.66 H new ATOM 0 HA ILE A 71 0.051 -6.363 -6.597 1.00 0.75 H new ATOM 0 HB ILE A 71 -1.965 -5.660 -6.503 1.00 0.89 H new ATOM 0 HG12 ILE A 71 -3.058 -4.121 -8.364 1.00 1.12 H new ATOM 0 HG13 ILE A 71 -1.809 -4.802 -9.389 1.00 1.12 H new ATOM 0 HG21 ILE A 71 -2.098 -3.097 -6.748 1.00 1.03 H new ATOM 0 HG22 ILE A 71 -0.559 -3.610 -6.017 1.00 1.03 H new ATOM 0 HG23 ILE A 71 -0.621 -3.159 -7.738 1.00 1.03 H new ATOM 0 HD11 ILE A 71 -3.913 -6.028 -9.638 1.00 1.56 H new ATOM 0 HD12 ILE A 71 -2.662 -7.081 -8.936 1.00 1.56 H new ATOM 0 HD13 ILE A 71 -3.930 -6.390 -7.896 1.00 1.56 H new ATOM 1059 N ASP A 72 -0.268 -8.181 -8.308 1.00 0.70 N ATOM 1060 CA ASP A 72 -0.522 -9.235 -9.269 1.00 0.74 C ATOM 1061 C ASP A 72 -2.034 -9.429 -9.392 1.00 0.96 C ATOM 1062 O ASP A 72 -2.662 -9.844 -8.412 1.00 1.14 O ATOM 1063 CB ASP A 72 0.227 -10.498 -8.848 1.00 0.78 C ATOM 1064 CG ASP A 72 1.729 -10.283 -8.989 1.00 2.13 C ATOM 1065 OD1 ASP A 72 2.366 -10.083 -7.933 1.00 3.36 O ATOM 1066 OD2 ASP A 72 2.200 -10.265 -10.148 1.00 3.15 O ATOM 0 H ASP A 72 -0.081 -8.513 -7.362 1.00 0.70 H new ATOM 0 HA ASP A 72 -0.149 -8.974 -10.260 1.00 0.74 H new ATOM 0 HB2 ASP A 72 -0.018 -10.749 -7.816 1.00 0.78 H new ATOM 0 HB3 ASP A 72 -0.088 -11.340 -9.464 1.00 0.78 H new ATOM 1071 N PHE A 73 -2.624 -9.090 -10.551 1.00 1.13 N ATOM 1072 CA PHE A 73 -4.058 -9.245 -10.824 1.00 1.36 C ATOM 1073 C PHE A 73 -4.555 -10.610 -10.344 1.00 1.34 C ATOM 1074 O PHE A 73 -5.638 -10.694 -9.774 1.00 1.42 O ATOM 1075 CB PHE A 73 -4.401 -9.097 -12.317 1.00 1.50 C ATOM 1076 CG PHE A 73 -4.106 -7.766 -12.989 1.00 1.83 C ATOM 1077 CD1 PHE A 73 -3.040 -7.652 -13.897 1.00 3.23 C ATOM 1078 CD2 PHE A 73 -5.019 -6.703 -12.882 1.00 1.82 C ATOM 1079 CE1 PHE A 73 -2.790 -6.435 -14.552 1.00 3.56 C ATOM 1080 CE2 PHE A 73 -4.812 -5.505 -13.582 1.00 1.99 C ATOM 1081 CZ PHE A 73 -3.684 -5.362 -14.407 1.00 2.55 C ATOM 0 H PHE A 73 -2.107 -8.694 -11.336 1.00 1.13 H new ATOM 0 HA PHE A 73 -4.556 -8.444 -10.278 1.00 1.36 H new ATOM 0 HB2 PHE A 73 -3.862 -9.873 -12.862 1.00 1.50 H new ATOM 0 HB3 PHE A 73 -5.465 -9.303 -12.437 1.00 1.50 H new ATOM 0 HD1 PHE A 73 -2.408 -8.506 -14.093 1.00 3.23 H new ATOM 0 HD2 PHE A 73 -5.891 -6.810 -12.253 1.00 1.82 H new ATOM 0 HE1 PHE A 73 -1.910 -6.324 -15.168 1.00 3.56 H new ATOM 0 HE2 PHE A 73 -5.519 -4.694 -13.487 1.00 1.99 H new ATOM 0 HZ PHE A 73 -3.505 -4.432 -14.927 1.00 2.55 H new ATOM 1091 N ALA A 74 -3.714 -11.635 -10.536 1.00 1.39 N ATOM 1092 CA ALA A 74 -3.812 -12.999 -10.027 1.00 1.46 C ATOM 1093 C ALA A 74 -4.585 -13.135 -8.713 1.00 1.42 C ATOM 1094 O ALA A 74 -5.333 -14.093 -8.545 1.00 1.60 O ATOM 1095 CB ALA A 74 -2.392 -13.536 -9.824 1.00 1.62 C ATOM 0 H ALA A 74 -2.875 -11.514 -11.103 1.00 1.39 H new ATOM 0 HA ALA A 74 -4.375 -13.569 -10.766 1.00 1.46 H new ATOM 0 HB1 ALA A 74 -2.440 -14.556 -9.443 1.00 1.62 H new ATOM 0 HB2 ALA A 74 -1.861 -13.528 -10.776 1.00 1.62 H new ATOM 0 HB3 ALA A 74 -1.864 -12.906 -9.108 1.00 1.62 H new ATOM 1101 N ALA A 75 -4.365 -12.206 -7.777 1.00 1.36 N ATOM 1102 CA ALA A 75 -5.166 -12.137 -6.548 1.00 1.57 C ATOM 1103 C ALA A 75 -5.387 -10.727 -5.983 1.00 1.73 C ATOM 1104 O ALA A 75 -6.369 -10.543 -5.270 1.00 2.31 O ATOM 1105 CB ALA A 75 -4.648 -13.102 -5.473 1.00 1.58 C ATOM 0 H ALA A 75 -3.640 -11.492 -7.846 1.00 1.36 H new ATOM 0 HA ALA A 75 -6.158 -12.463 -6.859 1.00 1.57 H new ATOM 0 HB1 ALA A 75 -5.268 -13.019 -4.581 1.00 1.58 H new ATOM 0 HB2 ALA A 75 -4.690 -14.124 -5.851 1.00 1.58 H new ATOM 0 HB3 ALA A 75 -3.618 -12.849 -5.223 1.00 1.58 H new ATOM 1111 N LYS A 76 -4.528 -9.744 -6.318 1.00 1.36 N ATOM 1112 CA LYS A 76 -4.618 -8.319 -6.022 1.00 1.48 C ATOM 1113 C LYS A 76 -3.875 -7.919 -4.744 1.00 1.58 C ATOM 1114 O LYS A 76 -4.369 -7.151 -3.926 1.00 1.97 O ATOM 1115 CB LYS A 76 -6.069 -7.873 -6.058 1.00 1.54 C ATOM 1116 CG LYS A 76 -6.319 -6.361 -6.136 1.00 1.87 C ATOM 1117 CD LYS A 76 -7.128 -5.869 -4.934 1.00 2.64 C ATOM 1118 CE LYS A 76 -8.523 -6.508 -4.775 1.00 3.63 C ATOM 1119 NZ LYS A 76 -9.402 -6.303 -5.946 1.00 4.41 N ATOM 0 H LYS A 76 -3.683 -9.956 -6.849 1.00 1.36 H new ATOM 0 HA LYS A 76 -4.091 -7.775 -6.806 1.00 1.48 H new ATOM 0 HB2 LYS A 76 -6.549 -8.343 -6.916 1.00 1.54 H new ATOM 0 HB3 LYS A 76 -6.566 -8.255 -5.166 1.00 1.54 H new ATOM 0 HG2 LYS A 76 -5.366 -5.834 -6.176 1.00 1.87 H new ATOM 0 HG3 LYS A 76 -6.852 -6.125 -7.057 1.00 1.87 H new ATOM 0 HD2 LYS A 76 -6.554 -6.059 -4.027 1.00 2.64 H new ATOM 0 HD3 LYS A 76 -7.248 -4.789 -5.015 1.00 2.64 H new ATOM 0 HE2 LYS A 76 -8.406 -7.578 -4.601 1.00 3.63 H new ATOM 0 HE3 LYS A 76 -9.006 -6.092 -3.891 1.00 3.63 H new ATOM 0 HZ1 LYS A 76 -10.350 -6.022 -5.624 1.00 4.41 H new ATOM 0 HZ2 LYS A 76 -9.006 -5.555 -6.551 1.00 4.41 H new ATOM 0 HZ3 LYS A 76 -9.469 -7.188 -6.489 1.00 4.41 H new ATOM 1133 N GLN A 77 -2.627 -8.361 -4.629 1.00 1.34 N ATOM 1134 CA GLN A 77 -1.719 -8.088 -3.520 1.00 1.38 C ATOM 1135 C GLN A 77 -1.215 -6.650 -3.641 1.00 1.44 C ATOM 1136 O GLN A 77 -0.079 -6.376 -4.016 1.00 1.93 O ATOM 1137 CB GLN A 77 -0.594 -9.136 -3.401 1.00 1.44 C ATOM 1138 CG GLN A 77 -0.196 -9.855 -4.700 1.00 1.62 C ATOM 1139 CD GLN A 77 -1.125 -11.034 -4.990 1.00 1.57 C ATOM 1140 OE1 GLN A 77 -1.962 -10.960 -6.025 1.00 2.00 O flip ATOM 1141 NE2 GLN A 77 -1.109 -12.019 -4.262 1.00 1.61 N flip ATOM 0 H GLN A 77 -2.199 -8.950 -5.344 1.00 1.34 H new ATOM 0 HA GLN A 77 -2.259 -8.180 -2.578 1.00 1.38 H new ATOM 0 HB2 GLN A 77 0.291 -8.644 -2.997 1.00 1.44 H new ATOM 0 HB3 GLN A 77 -0.901 -9.888 -2.674 1.00 1.44 H new ATOM 0 HG2 GLN A 77 -0.228 -9.151 -5.532 1.00 1.62 H new ATOM 0 HG3 GLN A 77 0.832 -10.210 -4.621 1.00 1.62 H new ATOM 0 HE21 GLN A 77 -0.463 -12.060 -3.474 1.00 1.61 H new ATOM 0 HE22 GLN A 77 -1.742 -12.798 -4.444 1.00 1.61 H new ATOM 1150 N GLY A 78 -2.140 -5.733 -3.385 1.00 1.55 N ATOM 1151 CA GLY A 78 -2.006 -4.303 -3.550 1.00 1.66 C ATOM 1152 C GLY A 78 -1.001 -3.695 -2.587 1.00 1.37 C ATOM 1153 O GLY A 78 -1.385 -3.189 -1.534 1.00 1.52 O ATOM 0 H GLY A 78 -3.062 -5.993 -3.034 1.00 1.55 H new ATOM 0 HA2 GLY A 78 -1.700 -4.086 -4.573 1.00 1.66 H new ATOM 0 HA3 GLY A 78 -2.977 -3.831 -3.401 1.00 1.66 H new ATOM 1157 N ASN A 79 0.283 -3.726 -2.948 1.00 1.12 N ATOM 1158 CA ASN A 79 1.361 -3.261 -2.093 1.00 1.04 C ATOM 1159 C ASN A 79 2.310 -2.410 -2.933 1.00 1.13 C ATOM 1160 O ASN A 79 2.353 -2.549 -4.153 1.00 1.82 O ATOM 1161 CB ASN A 79 2.043 -4.478 -1.451 1.00 1.10 C ATOM 1162 CG ASN A 79 1.036 -5.335 -0.679 1.00 1.58 C ATOM 1163 OD1 ASN A 79 0.787 -6.485 -1.024 1.00 2.88 O ATOM 1164 ND2 ASN A 79 0.401 -4.776 0.345 1.00 1.19 N ATOM 0 H ASN A 79 0.600 -4.079 -3.851 1.00 1.12 H new ATOM 0 HA ASN A 79 0.996 -2.634 -1.279 1.00 1.04 H new ATOM 0 HB2 ASN A 79 2.520 -5.081 -2.224 1.00 1.10 H new ATOM 0 HB3 ASN A 79 2.831 -4.143 -0.777 1.00 1.10 H new ATOM 0 HD21 ASN A 79 -0.305 -5.304 0.857 1.00 1.19 H new ATOM 0 HD22 ASN A 79 0.620 -3.818 0.619 1.00 1.19 H new ATOM 1171 N GLY A 80 3.022 -1.477 -2.299 1.00 0.70 N ATOM 1172 CA GLY A 80 3.897 -0.550 -2.991 1.00 0.78 C ATOM 1173 C GLY A 80 4.957 -0.037 -2.034 1.00 0.71 C ATOM 1174 O GLY A 80 4.621 0.541 -1.005 1.00 0.89 O ATOM 0 H GLY A 80 3.003 -1.349 -1.287 1.00 0.70 H new ATOM 0 HA2 GLY A 80 4.369 -1.045 -3.840 1.00 0.78 H new ATOM 0 HA3 GLY A 80 3.318 0.284 -3.389 1.00 0.78 H new ATOM 1178 N LYS A 81 6.232 -0.252 -2.356 1.00 0.68 N ATOM 1179 CA LYS A 81 7.309 0.105 -1.443 1.00 0.66 C ATOM 1180 C LYS A 81 7.589 1.610 -1.492 1.00 0.64 C ATOM 1181 O LYS A 81 7.437 2.238 -2.544 1.00 0.78 O ATOM 1182 CB LYS A 81 8.550 -0.757 -1.710 1.00 0.84 C ATOM 1183 CG LYS A 81 9.308 -0.435 -3.002 1.00 1.14 C ATOM 1184 CD LYS A 81 10.601 -1.259 -3.131 1.00 1.69 C ATOM 1185 CE LYS A 81 10.387 -2.752 -3.434 1.00 2.72 C ATOM 1186 NZ LYS A 81 10.202 -3.587 -2.227 1.00 4.03 N ATOM 0 H LYS A 81 6.539 -0.668 -3.235 1.00 0.68 H new ATOM 0 HA LYS A 81 7.000 -0.111 -0.420 1.00 0.66 H new ATOM 0 HB2 LYS A 81 9.235 -0.647 -0.870 1.00 0.84 H new ATOM 0 HB3 LYS A 81 8.246 -1.803 -1.738 1.00 0.84 H new ATOM 0 HG2 LYS A 81 8.664 -0.633 -3.859 1.00 1.14 H new ATOM 0 HG3 LYS A 81 9.551 0.627 -3.025 1.00 1.14 H new ATOM 0 HD2 LYS A 81 11.214 -0.826 -3.922 1.00 1.69 H new ATOM 0 HD3 LYS A 81 11.167 -1.168 -2.204 1.00 1.69 H new ATOM 0 HE2 LYS A 81 9.513 -2.861 -4.077 1.00 2.72 H new ATOM 0 HE3 LYS A 81 11.244 -3.126 -3.995 1.00 2.72 H new ATOM 0 HZ1 LYS A 81 9.963 -4.559 -2.510 1.00 4.03 H new ATOM 0 HZ2 LYS A 81 11.081 -3.595 -1.672 1.00 4.03 H new ATOM 0 HZ3 LYS A 81 9.431 -3.196 -1.649 1.00 4.03 H new ATOM 1200 N ILE A 82 7.991 2.155 -0.340 1.00 0.66 N ATOM 1201 CA ILE A 82 8.326 3.550 -0.088 1.00 0.79 C ATOM 1202 C ILE A 82 9.843 3.622 0.092 1.00 0.89 C ATOM 1203 O ILE A 82 10.384 3.040 1.030 1.00 1.45 O ATOM 1204 CB ILE A 82 7.601 4.016 1.191 1.00 0.90 C ATOM 1205 CG1 ILE A 82 6.103 4.244 0.915 1.00 1.39 C ATOM 1206 CG2 ILE A 82 8.324 5.216 1.831 1.00 1.67 C ATOM 1207 CD1 ILE A 82 5.325 4.656 2.172 1.00 1.82 C ATOM 0 H ILE A 82 8.097 1.586 0.500 1.00 0.66 H new ATOM 0 HA ILE A 82 8.016 4.196 -0.910 1.00 0.79 H new ATOM 0 HB ILE A 82 7.643 3.226 1.941 1.00 0.90 H new ATOM 0 HG12 ILE A 82 5.991 5.017 0.154 1.00 1.39 H new ATOM 0 HG13 ILE A 82 5.670 3.331 0.508 1.00 1.39 H new ATOM 0 HG21 ILE A 82 7.791 5.524 2.731 1.00 1.67 H new ATOM 0 HG22 ILE A 82 9.343 4.930 2.092 1.00 1.67 H new ATOM 0 HG23 ILE A 82 8.350 6.045 1.123 1.00 1.67 H new ATOM 0 HD11 ILE A 82 4.275 4.803 1.918 1.00 1.82 H new ATOM 0 HD12 ILE A 82 5.410 3.873 2.925 1.00 1.82 H new ATOM 0 HD13 ILE A 82 5.737 5.585 2.566 1.00 1.82 H new ATOM 1219 N GLU A 83 10.529 4.333 -0.804 1.00 0.79 N ATOM 1220 CA GLU A 83 11.970 4.238 -0.938 1.00 0.95 C ATOM 1221 C GLU A 83 12.522 5.525 -1.555 1.00 1.35 C ATOM 1222 O GLU A 83 13.039 5.532 -2.671 1.00 2.22 O ATOM 1223 CB GLU A 83 12.244 2.995 -1.791 1.00 1.08 C ATOM 1224 CG GLU A 83 13.717 2.620 -1.722 1.00 1.33 C ATOM 1225 CD GLU A 83 13.997 1.262 -2.362 1.00 1.80 C ATOM 1226 OE1 GLU A 83 15.187 0.883 -2.384 1.00 2.59 O ATOM 1227 OE2 GLU A 83 13.023 0.632 -2.833 1.00 2.70 O ATOM 0 H GLU A 83 10.095 4.989 -1.454 1.00 0.79 H new ATOM 0 HA GLU A 83 12.473 4.132 0.023 1.00 0.95 H new ATOM 0 HB2 GLU A 83 11.633 2.163 -1.440 1.00 1.08 H new ATOM 0 HB3 GLU A 83 11.959 3.186 -2.826 1.00 1.08 H new ATOM 0 HG2 GLU A 83 14.309 3.385 -2.224 1.00 1.33 H new ATOM 0 HG3 GLU A 83 14.037 2.602 -0.680 1.00 1.33 H new ATOM 1234 N HIS A 84 12.303 6.656 -0.879 1.00 0.91 N ATOM 1235 CA HIS A 84 12.604 7.956 -1.461 1.00 0.74 C ATOM 1236 C HIS A 84 12.779 9.047 -0.407 1.00 0.81 C ATOM 1237 O HIS A 84 12.207 10.124 -0.552 1.00 1.56 O ATOM 1238 CB HIS A 84 11.459 8.270 -2.422 1.00 1.27 C ATOM 1239 CG HIS A 84 11.637 9.490 -3.279 1.00 1.61 C ATOM 1240 ND1 HIS A 84 12.735 9.786 -4.056 1.00 2.75 N ATOM 1241 CD2 HIS A 84 10.604 10.286 -3.682 1.00 2.19 C ATOM 1242 CE1 HIS A 84 12.359 10.730 -4.935 1.00 3.79 C ATOM 1243 NE2 HIS A 84 11.047 10.997 -4.802 1.00 3.53 N ATOM 0 H HIS A 84 11.921 6.693 0.066 1.00 0.91 H new ATOM 0 HA HIS A 84 13.560 7.925 -1.984 1.00 0.74 H new ATOM 0 HB2 HIS A 84 11.312 7.410 -3.075 1.00 1.27 H new ATOM 0 HB3 HIS A 84 10.545 8.389 -1.841 1.00 1.27 H new ATOM 0 HD2 HIS A 84 9.629 10.354 -3.223 1.00 2.19 H new ATOM 0 HE1 HIS A 84 13.016 11.207 -5.647 1.00 3.79 H new ATOM 0 HE2 HIS A 84 10.485 11.601 -5.402 1.00 3.53 H new ATOM 1251 N LEU A 85 13.529 8.783 0.666 1.00 0.69 N ATOM 1252 CA LEU A 85 13.641 9.730 1.771 1.00 0.77 C ATOM 1253 C LEU A 85 15.096 10.008 2.105 1.00 0.93 C ATOM 1254 O LEU A 85 15.977 9.197 1.833 1.00 1.19 O ATOM 1255 CB LEU A 85 12.859 9.252 3.003 1.00 0.83 C ATOM 1256 CG LEU A 85 11.411 8.923 2.653 1.00 0.81 C ATOM 1257 CD1 LEU A 85 11.209 7.418 2.459 1.00 1.53 C ATOM 1258 CD2 LEU A 85 10.410 9.449 3.680 1.00 1.27 C ATOM 0 H LEU A 85 14.065 7.924 0.790 1.00 0.69 H new ATOM 0 HA LEU A 85 13.191 10.670 1.450 1.00 0.77 H new ATOM 0 HB2 LEU A 85 13.343 8.370 3.422 1.00 0.83 H new ATOM 0 HB3 LEU A 85 12.882 10.024 3.772 1.00 0.83 H new ATOM 0 HG LEU A 85 11.214 9.437 1.712 1.00 0.81 H new ATOM 0 HD11 LEU A 85 10.166 7.220 2.211 1.00 1.53 H new ATOM 0 HD12 LEU A 85 11.848 7.067 1.649 1.00 1.53 H new ATOM 0 HD13 LEU A 85 11.469 6.894 3.379 1.00 1.53 H new ATOM 0 HD21 LEU A 85 9.399 9.182 3.373 1.00 1.27 H new ATOM 0 HD22 LEU A 85 10.622 9.007 4.654 1.00 1.27 H new ATOM 0 HD23 LEU A 85 10.494 10.534 3.748 1.00 1.27 H new ATOM 1270 N LYS A 86 15.320 11.173 2.719 1.00 1.04 N ATOM 1271 CA LYS A 86 16.633 11.681 3.081 1.00 1.25 C ATOM 1272 C LYS A 86 17.388 10.762 4.049 1.00 1.11 C ATOM 1273 O LYS A 86 18.607 10.861 4.155 1.00 1.36 O ATOM 1274 CB LYS A 86 16.517 13.125 3.603 1.00 1.57 C ATOM 1275 CG LYS A 86 15.297 13.477 4.477 1.00 1.61 C ATOM 1276 CD LYS A 86 15.130 12.581 5.710 1.00 1.96 C ATOM 1277 CE LYS A 86 14.332 13.232 6.855 1.00 2.47 C ATOM 1278 NZ LYS A 86 12.924 13.528 6.507 1.00 3.30 N ATOM 0 H LYS A 86 14.564 11.804 2.984 1.00 1.04 H new ATOM 0 HA LYS A 86 17.242 11.695 2.177 1.00 1.25 H new ATOM 0 HB2 LYS A 86 17.416 13.347 4.178 1.00 1.57 H new ATOM 0 HB3 LYS A 86 16.516 13.793 2.742 1.00 1.57 H new ATOM 0 HG2 LYS A 86 15.385 14.513 4.804 1.00 1.61 H new ATOM 0 HG3 LYS A 86 14.396 13.410 3.868 1.00 1.61 H new ATOM 0 HD2 LYS A 86 14.631 11.659 5.411 1.00 1.96 H new ATOM 0 HD3 LYS A 86 16.117 12.303 6.081 1.00 1.96 H new ATOM 0 HE2 LYS A 86 14.351 12.571 7.721 1.00 2.47 H new ATOM 0 HE3 LYS A 86 14.826 14.158 7.150 1.00 2.47 H new ATOM 0 HZ1 LYS A 86 12.449 13.964 7.323 1.00 3.30 H new ATOM 0 HZ2 LYS A 86 12.896 14.183 5.700 1.00 3.30 H new ATOM 0 HZ3 LYS A 86 12.436 12.645 6.253 1.00 3.30 H new ATOM 1292 N SER A 87 16.667 9.890 4.757 1.00 0.87 N ATOM 1293 CA SER A 87 17.235 8.958 5.726 1.00 0.90 C ATOM 1294 C SER A 87 16.939 7.526 5.264 1.00 0.84 C ATOM 1295 O SER A 87 15.760 7.193 5.151 1.00 0.82 O ATOM 1296 CB SER A 87 16.591 9.238 7.087 1.00 1.10 C ATOM 1297 OG SER A 87 16.870 10.561 7.504 1.00 1.32 O ATOM 0 H SER A 87 15.654 9.813 4.669 1.00 0.87 H new ATOM 0 HA SER A 87 18.315 9.079 5.808 1.00 0.90 H new ATOM 0 HB2 SER A 87 15.513 9.090 7.023 1.00 1.10 H new ATOM 0 HB3 SER A 87 16.967 8.530 7.826 1.00 1.10 H new ATOM 0 HG SER A 87 16.450 10.725 8.374 1.00 1.32 H new ATOM 1303 N PRO A 88 17.935 6.671 4.971 1.00 0.97 N ATOM 1304 CA PRO A 88 17.684 5.313 4.497 1.00 1.03 C ATOM 1305 C PRO A 88 16.770 4.527 5.444 1.00 1.04 C ATOM 1306 O PRO A 88 15.912 3.775 4.987 1.00 1.35 O ATOM 1307 CB PRO A 88 19.059 4.658 4.327 1.00 1.33 C ATOM 1308 CG PRO A 88 19.978 5.496 5.214 1.00 1.43 C ATOM 1309 CD PRO A 88 19.366 6.893 5.126 1.00 1.22 C ATOM 0 HA PRO A 88 17.145 5.324 3.550 1.00 1.03 H new ATOM 0 HB2 PRO A 88 19.045 3.614 4.640 1.00 1.33 H new ATOM 0 HB3 PRO A 88 19.384 4.675 3.287 1.00 1.33 H new ATOM 0 HG2 PRO A 88 19.994 5.127 6.240 1.00 1.43 H new ATOM 0 HG3 PRO A 88 21.007 5.483 4.854 1.00 1.43 H new ATOM 0 HD2 PRO A 88 19.580 7.474 6.023 1.00 1.22 H new ATOM 0 HD3 PRO A 88 19.773 7.449 4.281 1.00 1.22 H new ATOM 1317 N GLU A 89 16.906 4.732 6.758 1.00 1.04 N ATOM 1318 CA GLU A 89 16.066 4.109 7.772 1.00 1.17 C ATOM 1319 C GLU A 89 14.578 4.311 7.470 1.00 1.07 C ATOM 1320 O GLU A 89 13.763 3.445 7.781 1.00 1.41 O ATOM 1321 CB GLU A 89 16.383 4.668 9.169 1.00 1.41 C ATOM 1322 CG GLU A 89 17.881 4.828 9.474 1.00 1.89 C ATOM 1323 CD GLU A 89 18.367 6.244 9.185 1.00 2.42 C ATOM 1324 OE1 GLU A 89 18.368 6.603 7.987 1.00 3.27 O ATOM 1325 OE2 GLU A 89 18.678 6.960 10.158 1.00 3.24 O ATOM 0 H GLU A 89 17.619 5.349 7.149 1.00 1.04 H new ATOM 0 HA GLU A 89 16.284 3.041 7.754 1.00 1.17 H new ATOM 0 HB2 GLU A 89 15.899 5.639 9.275 1.00 1.41 H new ATOM 0 HB3 GLU A 89 15.942 4.009 9.917 1.00 1.41 H new ATOM 0 HG2 GLU A 89 18.067 4.586 10.520 1.00 1.89 H new ATOM 0 HG3 GLU A 89 18.452 4.118 8.876 1.00 1.89 H new ATOM 1332 N LEU A 90 14.226 5.463 6.884 1.00 0.94 N ATOM 1333 CA LEU A 90 12.845 5.823 6.601 1.00 0.88 C ATOM 1334 C LEU A 90 12.281 5.020 5.423 1.00 0.79 C ATOM 1335 O LEU A 90 11.075 5.063 5.194 1.00 0.91 O ATOM 1336 CB LEU A 90 12.706 7.331 6.349 1.00 0.90 C ATOM 1337 CG LEU A 90 12.639 8.211 7.609 1.00 1.13 C ATOM 1338 CD1 LEU A 90 11.209 8.275 8.163 1.00 1.38 C ATOM 1339 CD2 LEU A 90 13.599 7.787 8.727 1.00 1.99 C ATOM 0 H LEU A 90 14.901 6.170 6.594 1.00 0.94 H new ATOM 0 HA LEU A 90 12.258 5.570 7.484 1.00 0.88 H new ATOM 0 HB2 LEU A 90 13.550 7.659 5.743 1.00 0.90 H new ATOM 0 HB3 LEU A 90 11.805 7.501 5.760 1.00 0.90 H new ATOM 0 HG LEU A 90 12.960 9.199 7.277 1.00 1.13 H new ATOM 0 HD11 LEU A 90 11.192 8.904 9.053 1.00 1.38 H new ATOM 0 HD12 LEU A 90 10.545 8.696 7.408 1.00 1.38 H new ATOM 0 HD13 LEU A 90 10.874 7.271 8.421 1.00 1.38 H new ATOM 0 HD21 LEU A 90 13.487 8.460 9.577 1.00 1.99 H new ATOM 0 HD22 LEU A 90 13.368 6.768 9.038 1.00 1.99 H new ATOM 0 HD23 LEU A 90 14.625 7.831 8.362 1.00 1.99 H new ATOM 1351 N ASN A 91 13.117 4.317 4.649 1.00 0.76 N ATOM 1352 CA ASN A 91 12.648 3.487 3.550 1.00 0.87 C ATOM 1353 C ASN A 91 11.716 2.418 4.126 1.00 0.95 C ATOM 1354 O ASN A 91 12.138 1.587 4.932 1.00 1.52 O ATOM 1355 CB ASN A 91 13.828 2.857 2.791 1.00 1.24 C ATOM 1356 CG ASN A 91 14.785 3.856 2.127 1.00 1.45 C ATOM 1357 OD1 ASN A 91 14.575 5.165 2.278 1.00 2.58 O flip ATOM 1358 ND2 ASN A 91 15.737 3.456 1.469 1.00 1.12 N flip ATOM 0 H ASN A 91 14.130 4.312 4.771 1.00 0.76 H new ATOM 0 HA ASN A 91 12.104 4.095 2.828 1.00 0.87 H new ATOM 0 HB2 ASN A 91 14.398 2.239 3.485 1.00 1.24 H new ATOM 0 HB3 ASN A 91 13.432 2.192 2.023 1.00 1.24 H new ATOM 0 HD21 ASN A 91 15.894 2.455 1.356 1.00 1.12 H new ATOM 0 HD22 ASN A 91 16.373 4.124 1.034 1.00 1.12 H new ATOM 1365 N VAL A 92 10.441 2.476 3.741 1.00 0.71 N ATOM 1366 CA VAL A 92 9.403 1.573 4.198 1.00 0.74 C ATOM 1367 C VAL A 92 9.172 0.576 3.084 1.00 0.67 C ATOM 1368 O VAL A 92 8.514 0.902 2.097 1.00 0.93 O ATOM 1369 CB VAL A 92 8.131 2.345 4.593 1.00 0.75 C ATOM 1370 CG1 VAL A 92 6.843 1.519 4.506 1.00 1.07 C ATOM 1371 CG2 VAL A 92 8.295 2.798 6.035 1.00 1.02 C ATOM 0 H VAL A 92 10.099 3.176 3.083 1.00 0.71 H new ATOM 0 HA VAL A 92 9.702 1.044 5.103 1.00 0.74 H new ATOM 0 HB VAL A 92 8.027 3.170 3.888 1.00 0.75 H new ATOM 0 HG11 VAL A 92 5.994 2.136 4.801 1.00 1.07 H new ATOM 0 HG12 VAL A 92 6.702 1.172 3.482 1.00 1.07 H new ATOM 0 HG13 VAL A 92 6.916 0.660 5.173 1.00 1.07 H new ATOM 0 HG21 VAL A 92 7.408 3.350 6.346 1.00 1.02 H new ATOM 0 HG22 VAL A 92 8.425 1.927 6.677 1.00 1.02 H new ATOM 0 HG23 VAL A 92 9.170 3.443 6.117 1.00 1.02 H new ATOM 1381 N ASP A 93 9.696 -0.639 3.236 1.00 0.49 N ATOM 1382 CA ASP A 93 9.297 -1.688 2.317 1.00 0.50 C ATOM 1383 C ASP A 93 8.015 -2.323 2.844 1.00 0.55 C ATOM 1384 O ASP A 93 7.796 -2.387 4.055 1.00 0.66 O ATOM 1385 CB ASP A 93 10.407 -2.707 2.047 1.00 0.55 C ATOM 1386 CG ASP A 93 10.240 -3.322 0.666 1.00 0.98 C ATOM 1387 OD1 ASP A 93 11.256 -3.762 0.086 1.00 1.77 O ATOM 1388 OD2 ASP A 93 9.119 -3.271 0.104 1.00 1.90 O ATOM 0 H ASP A 93 10.368 -0.909 3.955 1.00 0.49 H new ATOM 0 HA ASP A 93 9.103 -1.250 1.338 1.00 0.50 H new ATOM 0 HB2 ASP A 93 11.380 -2.222 2.120 1.00 0.55 H new ATOM 0 HB3 ASP A 93 10.383 -3.489 2.806 1.00 0.55 H new ATOM 1393 N LEU A 94 7.155 -2.732 1.920 1.00 0.67 N ATOM 1394 CA LEU A 94 5.825 -3.252 2.156 1.00 0.85 C ATOM 1395 C LEU A 94 5.814 -4.742 1.827 1.00 0.84 C ATOM 1396 O LEU A 94 6.265 -5.131 0.750 1.00 0.94 O ATOM 1397 CB LEU A 94 4.830 -2.467 1.278 1.00 1.25 C ATOM 1398 CG LEU A 94 3.685 -1.929 2.135 1.00 1.29 C ATOM 1399 CD1 LEU A 94 2.801 -0.928 1.388 1.00 1.23 C ATOM 1400 CD2 LEU A 94 2.796 -3.070 2.637 1.00 2.99 C ATOM 0 H LEU A 94 7.387 -2.706 0.927 1.00 0.67 H new ATOM 0 HA LEU A 94 5.532 -3.133 3.199 1.00 0.85 H new ATOM 0 HB2 LEU A 94 5.342 -1.642 0.782 1.00 1.25 H new ATOM 0 HB3 LEU A 94 4.435 -3.114 0.495 1.00 1.25 H new ATOM 0 HG LEU A 94 4.159 -1.415 2.971 1.00 1.29 H new ATOM 0 HD11 LEU A 94 2.006 -0.581 2.048 1.00 1.23 H new ATOM 0 HD12 LEU A 94 3.404 -0.078 1.069 1.00 1.23 H new ATOM 0 HD13 LEU A 94 2.363 -1.411 0.514 1.00 1.23 H new ATOM 0 HD21 LEU A 94 1.988 -2.662 3.245 1.00 2.99 H new ATOM 0 HD22 LEU A 94 2.375 -3.605 1.786 1.00 2.99 H new ATOM 0 HD23 LEU A 94 3.391 -3.757 3.239 1.00 2.99 H new ATOM 1412 N ALA A 95 5.276 -5.580 2.719 1.00 0.86 N ATOM 1413 CA ALA A 95 5.207 -7.007 2.444 1.00 0.96 C ATOM 1414 C ALA A 95 4.069 -7.269 1.457 1.00 0.97 C ATOM 1415 O ALA A 95 3.108 -6.501 1.395 1.00 1.03 O ATOM 1416 CB ALA A 95 4.978 -7.770 3.751 1.00 1.12 C ATOM 0 H ALA A 95 4.890 -5.296 3.620 1.00 0.86 H new ATOM 0 HA ALA A 95 6.143 -7.351 2.004 1.00 0.96 H new ATOM 0 HB1 ALA A 95 4.926 -8.839 3.544 1.00 1.12 H new ATOM 0 HB2 ALA A 95 5.802 -7.572 4.437 1.00 1.12 H new ATOM 0 HB3 ALA A 95 4.042 -7.443 4.204 1.00 1.12 H new ATOM 1422 N ALA A 96 4.167 -8.359 0.689 1.00 1.01 N ATOM 1423 CA ALA A 96 3.107 -8.743 -0.229 1.00 1.01 C ATOM 1424 C ALA A 96 2.002 -9.394 0.599 1.00 0.92 C ATOM 1425 O ALA A 96 2.232 -10.429 1.221 1.00 1.27 O ATOM 1426 CB ALA A 96 3.628 -9.694 -1.309 1.00 1.20 C ATOM 0 H ALA A 96 4.972 -8.986 0.690 1.00 1.01 H new ATOM 0 HA ALA A 96 2.721 -7.868 -0.752 1.00 1.01 H new ATOM 0 HB1 ALA A 96 2.813 -9.964 -1.980 1.00 1.20 H new ATOM 0 HB2 ALA A 96 4.418 -9.202 -1.877 1.00 1.20 H new ATOM 0 HB3 ALA A 96 4.025 -10.594 -0.840 1.00 1.20 H new ATOM 1432 N ALA A 97 0.830 -8.761 0.647 1.00 0.75 N ATOM 1433 CA ALA A 97 -0.290 -9.162 1.479 1.00 0.68 C ATOM 1434 C ALA A 97 -1.524 -9.274 0.594 1.00 0.76 C ATOM 1435 O ALA A 97 -1.832 -8.351 -0.157 1.00 1.13 O ATOM 1436 CB ALA A 97 -0.488 -8.136 2.593 1.00 0.84 C ATOM 0 H ALA A 97 0.634 -7.930 0.089 1.00 0.75 H new ATOM 0 HA ALA A 97 -0.104 -10.128 1.948 1.00 0.68 H new ATOM 0 HB1 ALA A 97 -1.329 -8.436 3.219 1.00 0.84 H new ATOM 0 HB2 ALA A 97 0.415 -8.080 3.201 1.00 0.84 H new ATOM 0 HB3 ALA A 97 -0.692 -7.159 2.156 1.00 0.84 H new ATOM 1442 N ASP A 98 -2.191 -10.424 0.669 1.00 0.76 N ATOM 1443 CA ASP A 98 -3.299 -10.789 -0.202 1.00 0.87 C ATOM 1444 C ASP A 98 -4.637 -10.397 0.438 1.00 0.84 C ATOM 1445 O ASP A 98 -4.678 -9.926 1.576 1.00 1.10 O ATOM 1446 CB ASP A 98 -3.199 -12.290 -0.521 1.00 1.42 C ATOM 1447 CG ASP A 98 -4.183 -12.754 -1.588 1.00 3.13 C ATOM 1448 OD1 ASP A 98 -4.664 -11.879 -2.342 1.00 4.75 O ATOM 1449 OD2 ASP A 98 -4.466 -13.969 -1.602 1.00 3.67 O ATOM 0 H ASP A 98 -1.968 -11.144 1.356 1.00 0.76 H new ATOM 0 HA ASP A 98 -3.245 -10.242 -1.143 1.00 0.87 H new ATOM 0 HB2 ASP A 98 -2.185 -12.516 -0.851 1.00 1.42 H new ATOM 0 HB3 ASP A 98 -3.371 -12.859 0.392 1.00 1.42 H new ATOM 1454 N ILE A 99 -5.726 -10.544 -0.314 1.00 0.86 N ATOM 1455 CA ILE A 99 -6.987 -9.874 -0.110 1.00 0.84 C ATOM 1456 C ILE A 99 -8.141 -10.841 -0.418 1.00 1.09 C ATOM 1457 O ILE A 99 -8.663 -10.919 -1.529 1.00 1.65 O ATOM 1458 CB ILE A 99 -6.951 -8.580 -0.929 1.00 0.81 C ATOM 1459 CG1 ILE A 99 -8.328 -8.006 -1.241 1.00 0.95 C ATOM 1460 CG2 ILE A 99 -6.178 -8.699 -2.241 1.00 1.11 C ATOM 1461 CD1 ILE A 99 -8.309 -6.481 -1.212 1.00 1.31 C ATOM 0 H ILE A 99 -5.742 -11.168 -1.121 1.00 0.86 H new ATOM 0 HA ILE A 99 -7.160 -9.580 0.925 1.00 0.84 H new ATOM 0 HB ILE A 99 -6.423 -7.895 -0.265 1.00 0.81 H new ATOM 0 HG12 ILE A 99 -8.654 -8.350 -2.223 1.00 0.95 H new ATOM 0 HG13 ILE A 99 -9.052 -8.377 -0.516 1.00 0.95 H new ATOM 0 HG21 ILE A 99 -6.198 -7.742 -2.763 1.00 1.11 H new ATOM 0 HG22 ILE A 99 -5.145 -8.976 -2.031 1.00 1.11 H new ATOM 0 HG23 ILE A 99 -6.639 -9.464 -2.867 1.00 1.11 H new ATOM 0 HD11 ILE A 99 -9.305 -6.100 -1.438 1.00 1.31 H new ATOM 0 HD12 ILE A 99 -8.006 -6.140 -0.222 1.00 1.31 H new ATOM 0 HD13 ILE A 99 -7.602 -6.112 -1.955 1.00 1.31 H new ATOM 1473 N LYS A 100 -8.539 -11.551 0.638 1.00 1.19 N ATOM 1474 CA LYS A 100 -9.731 -12.391 0.742 1.00 1.43 C ATOM 1475 C LYS A 100 -11.027 -11.625 0.412 1.00 1.66 C ATOM 1476 O LYS A 100 -11.085 -10.409 0.593 1.00 2.21 O ATOM 1477 CB LYS A 100 -9.822 -13.001 2.155 1.00 2.19 C ATOM 1478 CG LYS A 100 -9.200 -12.127 3.256 1.00 3.38 C ATOM 1479 CD LYS A 100 -9.883 -12.340 4.611 1.00 4.37 C ATOM 1480 CE LYS A 100 -11.016 -11.312 4.747 1.00 6.00 C ATOM 1481 NZ LYS A 100 -11.745 -11.388 6.025 1.00 7.20 N ATOM 0 H LYS A 100 -7.999 -11.554 1.503 1.00 1.19 H new ATOM 0 HA LYS A 100 -9.632 -13.184 0.001 1.00 1.43 H new ATOM 0 HB2 LYS A 100 -10.870 -13.179 2.396 1.00 2.19 H new ATOM 0 HB3 LYS A 100 -9.326 -13.972 2.153 1.00 2.19 H new ATOM 0 HG2 LYS A 100 -8.138 -12.357 3.345 1.00 3.38 H new ATOM 0 HG3 LYS A 100 -9.276 -11.077 2.972 1.00 3.38 H new ATOM 0 HD2 LYS A 100 -10.279 -13.353 4.681 1.00 4.37 H new ATOM 0 HD3 LYS A 100 -9.164 -12.222 5.421 1.00 4.37 H new ATOM 0 HE2 LYS A 100 -10.599 -10.311 4.637 1.00 6.00 H new ATOM 0 HE3 LYS A 100 -11.722 -11.455 3.929 1.00 6.00 H new ATOM 0 HZ1 LYS A 100 -12.459 -10.632 6.063 1.00 7.20 H new ATOM 0 HZ2 LYS A 100 -12.215 -12.312 6.102 1.00 7.20 H new ATOM 0 HZ3 LYS A 100 -11.077 -11.273 6.813 1.00 7.20 H new ATOM 1495 N PRO A 101 -12.108 -12.318 0.014 1.00 2.66 N ATOM 1496 CA PRO A 101 -13.429 -11.723 -0.123 1.00 3.23 C ATOM 1497 C PRO A 101 -13.997 -11.387 1.261 1.00 2.25 C ATOM 1498 O PRO A 101 -14.778 -12.146 1.831 1.00 3.15 O ATOM 1499 CB PRO A 101 -14.266 -12.772 -0.858 1.00 5.07 C ATOM 1500 CG PRO A 101 -13.644 -14.092 -0.407 1.00 5.41 C ATOM 1501 CD PRO A 101 -12.161 -13.739 -0.286 1.00 4.04 C ATOM 0 HA PRO A 101 -13.419 -10.784 -0.677 1.00 3.23 H new ATOM 0 HB2 PRO A 101 -15.320 -12.709 -0.586 1.00 5.07 H new ATOM 0 HB3 PRO A 101 -14.208 -12.648 -1.939 1.00 5.07 H new ATOM 0 HG2 PRO A 101 -14.058 -14.432 0.542 1.00 5.41 H new ATOM 0 HG3 PRO A 101 -13.813 -14.888 -1.132 1.00 5.41 H new ATOM 0 HD2 PRO A 101 -11.685 -14.322 0.502 1.00 4.04 H new ATOM 0 HD3 PRO A 101 -11.631 -13.962 -1.212 1.00 4.04 H new ATOM 1509 N ASP A 102 -13.574 -10.246 1.805 1.00 1.38 N ATOM 1510 CA ASP A 102 -14.063 -9.681 3.055 1.00 1.61 C ATOM 1511 C ASP A 102 -15.422 -9.005 2.819 1.00 1.66 C ATOM 1512 O ASP A 102 -16.346 -9.623 2.290 1.00 2.28 O ATOM 1513 CB ASP A 102 -13.000 -8.703 3.541 1.00 2.52 C ATOM 1514 CG ASP A 102 -13.239 -8.256 4.967 1.00 4.12 C ATOM 1515 OD1 ASP A 102 -13.746 -7.123 5.090 1.00 4.76 O ATOM 1516 OD2 ASP A 102 -12.942 -9.065 5.875 1.00 5.41 O ATOM 0 H ASP A 102 -12.854 -9.671 1.368 1.00 1.38 H new ATOM 0 HA ASP A 102 -14.226 -10.443 3.817 1.00 1.61 H new ATOM 0 HB2 ASP A 102 -12.018 -9.172 3.469 1.00 2.52 H new ATOM 0 HB3 ASP A 102 -12.986 -7.831 2.887 1.00 2.52 H new ATOM 1521 N GLY A 103 -15.545 -7.710 3.129 1.00 2.64 N ATOM 1522 CA GLY A 103 -16.598 -6.859 2.612 1.00 3.40 C ATOM 1523 C GLY A 103 -16.493 -6.773 1.089 1.00 2.33 C ATOM 1524 O GLY A 103 -15.989 -5.789 0.547 1.00 3.41 O ATOM 0 H GLY A 103 -14.902 -7.226 3.756 1.00 2.64 H new ATOM 0 HA2 GLY A 103 -17.572 -7.256 2.897 1.00 3.40 H new ATOM 0 HA3 GLY A 103 -16.520 -5.863 3.048 1.00 3.40 H new ATOM 1528 N LYS A 104 -16.973 -7.812 0.400 1.00 1.58 N ATOM 1529 CA LYS A 104 -17.031 -7.895 -1.049 1.00 2.21 C ATOM 1530 C LYS A 104 -15.620 -7.700 -1.619 1.00 2.84 C ATOM 1531 O LYS A 104 -14.727 -8.492 -1.330 1.00 4.51 O ATOM 1532 CB LYS A 104 -18.086 -6.900 -1.575 1.00 2.81 C ATOM 1533 CG LYS A 104 -19.470 -7.187 -0.972 1.00 3.54 C ATOM 1534 CD LYS A 104 -20.500 -6.157 -1.455 1.00 4.64 C ATOM 1535 CE LYS A 104 -21.859 -6.417 -0.786 1.00 5.76 C ATOM 1536 NZ LYS A 104 -22.878 -5.418 -1.172 1.00 6.83 N ATOM 0 H LYS A 104 -17.343 -8.644 0.859 1.00 1.58 H new ATOM 0 HA LYS A 104 -17.358 -8.878 -1.387 1.00 2.21 H new ATOM 0 HB2 LYS A 104 -17.784 -5.882 -1.330 1.00 2.81 H new ATOM 0 HB3 LYS A 104 -18.140 -6.964 -2.662 1.00 2.81 H new ATOM 0 HG2 LYS A 104 -19.793 -8.190 -1.252 1.00 3.54 H new ATOM 0 HG3 LYS A 104 -19.409 -7.164 0.116 1.00 3.54 H new ATOM 0 HD2 LYS A 104 -20.157 -5.150 -1.220 1.00 4.64 H new ATOM 0 HD3 LYS A 104 -20.602 -6.214 -2.539 1.00 4.64 H new ATOM 0 HE2 LYS A 104 -22.210 -7.413 -1.057 1.00 5.76 H new ATOM 0 HE3 LYS A 104 -21.736 -6.406 0.297 1.00 5.76 H new ATOM 0 HZ1 LYS A 104 -23.776 -5.636 -0.695 1.00 6.83 H new ATOM 0 HZ2 LYS A 104 -22.558 -4.469 -0.890 1.00 6.83 H new ATOM 0 HZ3 LYS A 104 -23.017 -5.445 -2.202 1.00 6.83 H new ATOM 1550 N ARG A 105 -15.410 -6.625 -2.383 1.00 2.17 N ATOM 1551 CA ARG A 105 -14.127 -6.223 -2.948 1.00 2.82 C ATOM 1552 C ARG A 105 -13.018 -6.035 -1.909 1.00 2.94 C ATOM 1553 O ARG A 105 -11.860 -5.919 -2.299 1.00 3.76 O ATOM 1554 CB ARG A 105 -14.327 -4.949 -3.780 1.00 3.09 C ATOM 1555 CG ARG A 105 -14.762 -3.729 -2.959 1.00 4.41 C ATOM 1556 CD ARG A 105 -15.638 -2.796 -3.804 1.00 4.32 C ATOM 1557 NE ARG A 105 -14.894 -2.081 -4.857 1.00 5.76 N ATOM 1558 CZ ARG A 105 -15.241 -2.123 -6.154 1.00 6.04 C ATOM 1559 NH1 ARG A 105 -15.435 -3.287 -6.778 1.00 5.71 N ATOM 1560 NH2 ARG A 105 -15.425 -0.979 -6.824 1.00 7.32 N ATOM 0 H ARG A 105 -16.165 -5.986 -2.633 1.00 2.17 H new ATOM 0 HA ARG A 105 -13.782 -7.041 -3.581 1.00 2.82 H new ATOM 0 HB2 ARG A 105 -13.396 -4.714 -4.295 1.00 3.09 H new ATOM 0 HB3 ARG A 105 -15.076 -5.143 -4.548 1.00 3.09 H new ATOM 0 HG2 ARG A 105 -15.313 -4.055 -2.077 1.00 4.41 H new ATOM 0 HG3 ARG A 105 -13.883 -3.190 -2.605 1.00 4.41 H new ATOM 0 HD2 ARG A 105 -16.435 -3.379 -4.266 1.00 4.32 H new ATOM 0 HD3 ARG A 105 -16.115 -2.067 -3.149 1.00 4.32 H new ATOM 0 HE ARG A 105 -14.079 -1.530 -4.589 1.00 5.76 H new ATOM 0 HH11 ARG A 105 -15.320 -4.164 -6.269 1.00 5.71 H new ATOM 0 HH12 ARG A 105 -15.698 -3.300 -7.763 1.00 5.71 H new ATOM 0 HH21 ARG A 105 -15.302 -0.085 -6.349 1.00 7.32 H new ATOM 0 HH22 ARG A 105 -15.689 -1.002 -7.809 1.00 7.32 H new ATOM 1574 N HIS A 106 -13.361 -5.980 -0.614 1.00 2.79 N ATOM 1575 CA HIS A 106 -12.413 -5.865 0.484 1.00 3.37 C ATOM 1576 C HIS A 106 -11.602 -4.586 0.301 1.00 2.53 C ATOM 1577 O HIS A 106 -10.448 -4.614 -0.110 1.00 3.41 O ATOM 1578 CB HIS A 106 -11.524 -7.119 0.582 1.00 4.81 C ATOM 1579 CG HIS A 106 -10.690 -7.199 1.853 1.00 6.41 C ATOM 1580 ND1 HIS A 106 -10.907 -6.493 3.021 1.00 7.39 N ATOM 1581 CD2 HIS A 106 -9.742 -8.148 2.146 1.00 7.72 C ATOM 1582 CE1 HIS A 106 -10.130 -7.029 3.978 1.00 8.89 C ATOM 1583 NE2 HIS A 106 -9.401 -8.044 3.495 1.00 9.17 N ATOM 0 H HIS A 106 -14.331 -6.016 -0.302 1.00 2.79 H new ATOM 0 HA HIS A 106 -12.948 -5.801 1.432 1.00 3.37 H new ATOM 0 HB2 HIS A 106 -12.157 -8.004 0.521 1.00 4.81 H new ATOM 0 HB3 HIS A 106 -10.856 -7.144 -0.279 1.00 4.81 H new ATOM 0 HD2 HIS A 106 -9.328 -8.859 1.446 1.00 7.72 H new ATOM 0 HE1 HIS A 106 -10.098 -6.686 5.002 1.00 8.89 H new ATOM 0 HE2 HIS A 106 -8.734 -8.621 4.008 1.00 9.17 H new ATOM 1591 N ALA A 107 -12.198 -3.436 0.614 1.00 2.17 N ATOM 1592 CA ALA A 107 -11.572 -2.145 0.351 1.00 2.61 C ATOM 1593 C ALA A 107 -10.432 -1.816 1.332 1.00 2.37 C ATOM 1594 O ALA A 107 -10.269 -0.656 1.697 1.00 2.84 O ATOM 1595 CB ALA A 107 -12.659 -1.066 0.340 1.00 4.48 C ATOM 0 H ALA A 107 -13.117 -3.374 1.052 1.00 2.17 H new ATOM 0 HA ALA A 107 -11.091 -2.185 -0.627 1.00 2.61 H new ATOM 0 HB1 ALA A 107 -12.205 -0.094 0.144 1.00 4.48 H new ATOM 0 HB2 ALA A 107 -13.387 -1.290 -0.440 1.00 4.48 H new ATOM 0 HB3 ALA A 107 -13.160 -1.044 1.308 1.00 4.48 H new ATOM 1601 N VAL A 108 -9.628 -2.810 1.729 1.00 1.95 N ATOM 1602 CA VAL A 108 -8.436 -2.699 2.550 1.00 1.75 C ATOM 1603 C VAL A 108 -7.617 -3.982 2.388 1.00 1.46 C ATOM 1604 O VAL A 108 -8.190 -5.050 2.188 1.00 1.43 O ATOM 1605 CB VAL A 108 -8.764 -2.540 4.039 1.00 1.48 C ATOM 1606 CG1 VAL A 108 -9.230 -1.141 4.420 1.00 1.95 C ATOM 1607 CG2 VAL A 108 -9.750 -3.599 4.551 1.00 1.10 C ATOM 0 H VAL A 108 -9.814 -3.777 1.462 1.00 1.95 H new ATOM 0 HA VAL A 108 -7.890 -1.814 2.223 1.00 1.75 H new ATOM 0 HB VAL A 108 -7.811 -2.702 4.542 1.00 1.48 H new ATOM 0 HG11 VAL A 108 -9.443 -1.107 5.488 1.00 1.95 H new ATOM 0 HG12 VAL A 108 -8.448 -0.420 4.183 1.00 1.95 H new ATOM 0 HG13 VAL A 108 -10.133 -0.894 3.862 1.00 1.95 H new ATOM 0 HG21 VAL A 108 -9.943 -3.434 5.611 1.00 1.10 H new ATOM 0 HG22 VAL A 108 -10.685 -3.524 3.996 1.00 1.10 H new ATOM 0 HG23 VAL A 108 -9.323 -4.592 4.410 1.00 1.10 H new ATOM 1617 N ILE A 109 -6.294 -3.873 2.517 1.00 1.47 N ATOM 1618 CA ILE A 109 -5.335 -4.956 2.503 1.00 1.02 C ATOM 1619 C ILE A 109 -4.451 -4.810 3.741 1.00 1.08 C ATOM 1620 O ILE A 109 -3.770 -3.796 3.903 1.00 1.95 O ATOM 1621 CB ILE A 109 -4.492 -4.861 1.220 1.00 0.96 C ATOM 1622 CG1 ILE A 109 -5.391 -4.895 -0.020 1.00 1.84 C ATOM 1623 CG2 ILE A 109 -3.435 -5.975 1.169 1.00 1.50 C ATOM 1624 CD1 ILE A 109 -4.625 -4.575 -1.293 1.00 2.54 C ATOM 0 H ILE A 109 -5.845 -2.966 2.641 1.00 1.47 H new ATOM 0 HA ILE A 109 -5.832 -5.926 2.518 1.00 1.02 H new ATOM 0 HB ILE A 109 -3.965 -3.907 1.230 1.00 0.96 H new ATOM 0 HG12 ILE A 109 -5.846 -5.881 -0.110 1.00 1.84 H new ATOM 0 HG13 ILE A 109 -6.204 -4.179 0.103 1.00 1.84 H new ATOM 0 HG21 ILE A 109 -2.854 -5.883 0.251 1.00 1.50 H new ATOM 0 HG22 ILE A 109 -2.771 -5.887 2.029 1.00 1.50 H new ATOM 0 HG23 ILE A 109 -3.929 -6.946 1.190 1.00 1.50 H new ATOM 0 HD11 ILE A 109 -5.304 -4.611 -2.145 1.00 2.54 H new ATOM 0 HD12 ILE A 109 -4.192 -3.578 -1.216 1.00 2.54 H new ATOM 0 HD13 ILE A 109 -3.829 -5.306 -1.432 1.00 2.54 H new ATOM 1636 N SER A 110 -4.457 -5.815 4.617 1.00 0.73 N ATOM 1637 CA SER A 110 -3.790 -5.765 5.912 1.00 0.76 C ATOM 1638 C SER A 110 -2.290 -6.036 5.765 1.00 0.66 C ATOM 1639 O SER A 110 -1.794 -7.051 6.248 1.00 1.01 O ATOM 1640 CB SER A 110 -4.458 -6.789 6.837 1.00 1.01 C ATOM 1641 OG SER A 110 -5.865 -6.634 6.783 1.00 1.84 O ATOM 0 H SER A 110 -4.934 -6.699 4.441 1.00 0.73 H new ATOM 0 HA SER A 110 -3.888 -4.769 6.344 1.00 0.76 H new ATOM 0 HB2 SER A 110 -4.182 -7.800 6.536 1.00 1.01 H new ATOM 0 HB3 SER A 110 -4.106 -6.653 7.860 1.00 1.01 H new ATOM 0 HG SER A 110 -6.289 -7.291 7.374 1.00 1.84 H new ATOM 1647 N GLY A 111 -1.572 -5.145 5.081 1.00 0.57 N ATOM 1648 CA GLY A 111 -0.173 -5.362 4.739 1.00 0.79 C ATOM 1649 C GLY A 111 0.761 -4.739 5.777 1.00 0.85 C ATOM 1650 O GLY A 111 0.723 -3.530 6.004 1.00 1.45 O ATOM 0 H GLY A 111 -1.946 -4.255 4.751 1.00 0.57 H new ATOM 0 HA2 GLY A 111 0.023 -6.432 4.667 1.00 0.79 H new ATOM 0 HA3 GLY A 111 0.034 -4.933 3.758 1.00 0.79 H new ATOM 1654 N SER A 112 1.608 -5.560 6.403 1.00 0.63 N ATOM 1655 CA SER A 112 2.642 -5.106 7.323 1.00 0.62 C ATOM 1656 C SER A 112 3.832 -4.561 6.521 1.00 0.64 C ATOM 1657 O SER A 112 4.069 -4.983 5.385 1.00 0.78 O ATOM 1658 CB SER A 112 3.079 -6.286 8.200 1.00 0.82 C ATOM 1659 OG SER A 112 1.928 -6.959 8.678 1.00 1.43 O ATOM 0 H SER A 112 1.591 -6.572 6.280 1.00 0.63 H new ATOM 0 HA SER A 112 2.258 -4.310 7.961 1.00 0.62 H new ATOM 0 HB2 SER A 112 3.703 -6.970 7.626 1.00 0.82 H new ATOM 0 HB3 SER A 112 3.681 -5.930 9.036 1.00 0.82 H new ATOM 0 HG SER A 112 2.200 -7.716 9.238 1.00 1.43 H new ATOM 1665 N VAL A 113 4.558 -3.599 7.094 1.00 0.63 N ATOM 1666 CA VAL A 113 5.638 -2.882 6.429 1.00 0.66 C ATOM 1667 C VAL A 113 6.808 -2.764 7.395 1.00 0.54 C ATOM 1668 O VAL A 113 6.594 -2.847 8.606 1.00 0.68 O ATOM 1669 CB VAL A 113 5.159 -1.489 5.968 1.00 0.80 C ATOM 1670 CG1 VAL A 113 3.657 -1.452 5.684 1.00 0.96 C ATOM 1671 CG2 VAL A 113 5.437 -0.375 6.987 1.00 0.85 C ATOM 0 H VAL A 113 4.405 -3.293 8.055 1.00 0.63 H new ATOM 0 HA VAL A 113 5.955 -3.429 5.541 1.00 0.66 H new ATOM 0 HB VAL A 113 5.733 -1.310 5.059 1.00 0.80 H new ATOM 0 HG11 VAL A 113 3.372 -0.450 5.363 1.00 0.96 H new ATOM 0 HG12 VAL A 113 3.418 -2.167 4.897 1.00 0.96 H new ATOM 0 HG13 VAL A 113 3.109 -1.713 6.589 1.00 0.96 H new ATOM 0 HG21 VAL A 113 5.074 0.575 6.596 1.00 0.85 H new ATOM 0 HG22 VAL A 113 4.925 -0.602 7.922 1.00 0.85 H new ATOM 0 HG23 VAL A 113 6.510 -0.307 7.168 1.00 0.85 H new ATOM 1681 N LEU A 114 8.018 -2.511 6.882 1.00 0.51 N ATOM 1682 CA LEU A 114 9.190 -2.346 7.727 1.00 0.65 C ATOM 1683 C LEU A 114 10.031 -1.127 7.357 1.00 0.66 C ATOM 1684 O LEU A 114 10.356 -0.915 6.190 1.00 0.77 O ATOM 1685 CB LEU A 114 9.972 -3.667 7.834 1.00 1.07 C ATOM 1686 CG LEU A 114 11.139 -3.862 6.853 1.00 0.76 C ATOM 1687 CD1 LEU A 114 11.928 -5.113 7.255 1.00 1.45 C ATOM 1688 CD2 LEU A 114 10.657 -4.019 5.411 1.00 2.07 C ATOM 0 H LEU A 114 8.204 -2.417 5.883 1.00 0.51 H new ATOM 0 HA LEU A 114 8.851 -2.114 8.737 1.00 0.65 H new ATOM 0 HB2 LEU A 114 10.363 -3.749 8.848 1.00 1.07 H new ATOM 0 HB3 LEU A 114 9.270 -4.490 7.695 1.00 1.07 H new ATOM 0 HG LEU A 114 11.768 -2.973 6.901 1.00 0.76 H new ATOM 0 HD11 LEU A 114 12.758 -5.258 6.563 1.00 1.45 H new ATOM 0 HD12 LEU A 114 12.316 -4.989 8.266 1.00 1.45 H new ATOM 0 HD13 LEU A 114 11.272 -5.983 7.222 1.00 1.45 H new ATOM 0 HD21 LEU A 114 11.515 -4.154 4.753 1.00 2.07 H new ATOM 0 HD22 LEU A 114 10.004 -4.888 5.338 1.00 2.07 H new ATOM 0 HD23 LEU A 114 10.108 -3.126 5.112 1.00 2.07 H new ATOM 1700 N TYR A 115 10.384 -0.338 8.377 1.00 0.83 N ATOM 1701 CA TYR A 115 11.262 0.815 8.272 1.00 1.02 C ATOM 1702 C TYR A 115 12.694 0.296 8.222 1.00 0.99 C ATOM 1703 O TYR A 115 13.331 0.162 9.270 1.00 1.12 O ATOM 1704 CB TYR A 115 11.044 1.729 9.489 1.00 1.32 C ATOM 1705 CG TYR A 115 10.045 2.833 9.250 1.00 2.14 C ATOM 1706 CD1 TYR A 115 8.811 2.876 9.918 1.00 3.33 C ATOM 1707 CD2 TYR A 115 10.394 3.854 8.358 1.00 3.15 C ATOM 1708 CE1 TYR A 115 7.957 3.974 9.722 1.00 4.67 C ATOM 1709 CE2 TYR A 115 9.520 4.923 8.122 1.00 4.47 C ATOM 1710 CZ TYR A 115 8.297 4.980 8.799 1.00 5.04 C ATOM 1711 OH TYR A 115 7.421 5.982 8.507 1.00 6.55 O ATOM 0 H TYR A 115 10.051 -0.496 9.328 1.00 0.83 H new ATOM 0 HA TYR A 115 11.053 1.398 7.375 1.00 1.02 H new ATOM 0 HB2 TYR A 115 10.708 1.124 10.331 1.00 1.32 H new ATOM 0 HB3 TYR A 115 11.998 2.171 9.775 1.00 1.32 H new ATOM 0 HD1 TYR A 115 8.521 2.071 10.577 1.00 3.33 H new ATOM 0 HD2 TYR A 115 11.345 3.817 7.848 1.00 3.15 H new ATOM 0 HE1 TYR A 115 7.036 4.046 10.282 1.00 4.67 H new ATOM 0 HE2 TYR A 115 9.789 5.699 7.421 1.00 4.47 H new ATOM 0 HH TYR A 115 7.334 6.068 7.535 1.00 6.55 H new ATOM 1721 N ASN A 116 13.148 -0.050 7.012 1.00 0.96 N ATOM 1722 CA ASN A 116 14.395 -0.740 6.684 1.00 1.01 C ATOM 1723 C ASN A 116 14.563 -2.064 7.441 1.00 0.81 C ATOM 1724 O ASN A 116 14.529 -3.133 6.839 1.00 0.97 O ATOM 1725 CB ASN A 116 15.605 0.189 6.844 1.00 1.46 C ATOM 1726 CG ASN A 116 16.891 -0.527 6.440 1.00 2.36 C ATOM 1727 OD1 ASN A 116 17.068 -0.875 5.279 1.00 2.92 O ATOM 1728 ND2 ASN A 116 17.804 -0.772 7.377 1.00 3.71 N ATOM 0 H ASN A 116 12.609 0.163 6.173 1.00 0.96 H new ATOM 0 HA ASN A 116 14.337 -1.015 5.631 1.00 1.01 H new ATOM 0 HB2 ASN A 116 15.470 1.079 6.230 1.00 1.46 H new ATOM 0 HB3 ASN A 116 15.679 0.524 7.879 1.00 1.46 H new ATOM 0 HD21 ASN A 116 18.668 -1.257 7.133 1.00 3.71 H new ATOM 0 HD22 ASN A 116 17.640 -0.475 8.339 1.00 3.71 H new ATOM 1735 N GLN A 117 14.739 -1.989 8.761 1.00 0.77 N ATOM 1736 CA GLN A 117 14.813 -3.115 9.681 1.00 0.89 C ATOM 1737 C GLN A 117 13.553 -3.241 10.553 1.00 1.02 C ATOM 1738 O GLN A 117 13.195 -4.340 10.969 1.00 1.55 O ATOM 1739 CB GLN A 117 16.080 -2.999 10.548 1.00 1.18 C ATOM 1740 CG GLN A 117 16.192 -1.732 11.418 1.00 2.51 C ATOM 1741 CD GLN A 117 16.655 -0.499 10.644 1.00 2.00 C ATOM 1742 OE1 GLN A 117 17.792 -0.438 10.190 1.00 2.07 O ATOM 1743 NE2 GLN A 117 15.797 0.498 10.454 1.00 2.61 N ATOM 0 H GLN A 117 14.838 -1.093 9.238 1.00 0.77 H new ATOM 0 HA GLN A 117 14.869 -4.028 9.088 1.00 0.89 H new ATOM 0 HB2 GLN A 117 16.129 -3.870 11.202 1.00 1.18 H new ATOM 0 HB3 GLN A 117 16.950 -3.043 9.892 1.00 1.18 H new ATOM 0 HG2 GLN A 117 15.222 -1.524 11.870 1.00 2.51 H new ATOM 0 HG3 GLN A 117 16.889 -1.922 12.234 1.00 2.51 H new ATOM 0 HE21 GLN A 117 14.853 0.438 10.836 1.00 2.61 H new ATOM 0 HE22 GLN A 117 16.083 1.323 9.927 1.00 2.61 H new ATOM 1752 N ALA A 118 12.910 -2.121 10.899 1.00 0.91 N ATOM 1753 CA ALA A 118 11.932 -2.081 11.977 1.00 1.13 C ATOM 1754 C ALA A 118 10.520 -2.343 11.453 1.00 0.92 C ATOM 1755 O ALA A 118 9.858 -1.422 10.969 1.00 1.24 O ATOM 1756 CB ALA A 118 12.027 -0.733 12.700 1.00 1.51 C ATOM 0 H ALA A 118 13.056 -1.223 10.438 1.00 0.91 H new ATOM 0 HA ALA A 118 12.154 -2.875 12.690 1.00 1.13 H new ATOM 0 HB1 ALA A 118 11.296 -0.701 13.508 1.00 1.51 H new ATOM 0 HB2 ALA A 118 13.029 -0.611 13.113 1.00 1.51 H new ATOM 0 HB3 ALA A 118 11.825 0.073 11.995 1.00 1.51 H new ATOM 1762 N GLU A 119 10.030 -3.580 11.596 1.00 0.82 N ATOM 1763 CA GLU A 119 8.671 -3.942 11.209 1.00 0.97 C ATOM 1764 C GLU A 119 7.679 -3.469 12.274 1.00 1.01 C ATOM 1765 O GLU A 119 7.028 -4.272 12.937 1.00 1.56 O ATOM 1766 CB GLU A 119 8.562 -5.448 10.911 1.00 1.38 C ATOM 1767 CG GLU A 119 7.285 -5.728 10.099 1.00 1.77 C ATOM 1768 CD GLU A 119 7.009 -7.207 9.870 1.00 2.50 C ATOM 1769 OE1 GLU A 119 7.831 -8.028 10.329 1.00 3.11 O ATOM 1770 OE2 GLU A 119 5.964 -7.479 9.239 1.00 3.24 O ATOM 0 H GLU A 119 10.568 -4.355 11.984 1.00 0.82 H new ATOM 0 HA GLU A 119 8.414 -3.432 10.280 1.00 0.97 H new ATOM 0 HB2 GLU A 119 9.438 -5.782 10.355 1.00 1.38 H new ATOM 0 HB3 GLU A 119 8.542 -6.012 11.844 1.00 1.38 H new ATOM 0 HG2 GLU A 119 6.434 -5.286 10.616 1.00 1.77 H new ATOM 0 HG3 GLU A 119 7.365 -5.230 9.133 1.00 1.77 H new ATOM 1777 N LYS A 120 7.565 -2.147 12.445 1.00 0.66 N ATOM 1778 CA LYS A 120 6.572 -1.507 13.290 1.00 0.65 C ATOM 1779 C LYS A 120 5.768 -0.574 12.417 1.00 0.73 C ATOM 1780 O LYS A 120 5.709 0.638 12.605 1.00 1.06 O ATOM 1781 CB LYS A 120 7.230 -0.814 14.484 1.00 1.00 C ATOM 1782 CG LYS A 120 8.016 -1.812 15.339 1.00 1.68 C ATOM 1783 CD LYS A 120 7.176 -2.974 15.861 1.00 1.92 C ATOM 1784 CE LYS A 120 6.236 -2.580 17.004 1.00 2.59 C ATOM 1785 NZ LYS A 120 5.581 -3.767 17.594 1.00 3.26 N ATOM 0 H LYS A 120 8.183 -1.481 11.982 1.00 0.66 H new ATOM 0 HA LYS A 120 5.896 -2.240 13.731 1.00 0.65 H new ATOM 0 HB2 LYS A 120 7.898 -0.029 14.129 1.00 1.00 H new ATOM 0 HB3 LYS A 120 6.466 -0.331 15.094 1.00 1.00 H new ATOM 0 HG2 LYS A 120 8.842 -2.210 14.749 1.00 1.68 H new ATOM 0 HG3 LYS A 120 8.454 -1.284 16.186 1.00 1.68 H new ATOM 0 HD2 LYS A 120 6.587 -3.384 15.041 1.00 1.92 H new ATOM 0 HD3 LYS A 120 7.840 -3.767 16.204 1.00 1.92 H new ATOM 0 HE2 LYS A 120 6.798 -2.052 17.774 1.00 2.59 H new ATOM 0 HE3 LYS A 120 5.478 -1.890 16.633 1.00 2.59 H new ATOM 0 HZ1 LYS A 120 4.951 -3.468 18.365 1.00 3.26 H new ATOM 0 HZ2 LYS A 120 5.026 -4.256 16.863 1.00 3.26 H new ATOM 0 HZ3 LYS A 120 6.305 -4.413 17.969 1.00 3.26 H new ATOM 1799 N GLY A 121 5.118 -1.187 11.443 1.00 0.61 N ATOM 1800 CA GLY A 121 4.158 -0.470 10.638 1.00 0.70 C ATOM 1801 C GLY A 121 3.153 -1.398 9.981 1.00 0.59 C ATOM 1802 O GLY A 121 3.511 -2.427 9.414 1.00 0.85 O ATOM 0 H GLY A 121 5.239 -2.169 11.196 1.00 0.61 H new ATOM 0 HA2 GLY A 121 3.630 0.251 11.262 1.00 0.70 H new ATOM 0 HA3 GLY A 121 4.683 0.097 9.869 1.00 0.70 H new ATOM 1806 N SER A 122 1.888 -1.006 10.068 1.00 0.49 N ATOM 1807 CA SER A 122 0.758 -1.626 9.416 1.00 0.48 C ATOM 1808 C SER A 122 0.205 -0.630 8.393 1.00 0.48 C ATOM 1809 O SER A 122 0.038 0.553 8.704 1.00 0.59 O ATOM 1810 CB SER A 122 -0.268 -1.976 10.500 1.00 0.66 C ATOM 1811 OG SER A 122 -0.129 -1.083 11.606 1.00 0.85 O ATOM 0 H SER A 122 1.615 -0.200 10.630 1.00 0.49 H new ATOM 0 HA SER A 122 1.025 -2.542 8.889 1.00 0.48 H new ATOM 0 HB2 SER A 122 -1.277 -1.911 10.093 1.00 0.66 H new ATOM 0 HB3 SER A 122 -0.124 -3.004 10.831 1.00 0.66 H new ATOM 0 HG SER A 122 -1.016 -0.808 11.918 1.00 0.85 H new ATOM 1817 N TYR A 123 -0.058 -1.103 7.173 1.00 0.74 N ATOM 1818 CA TYR A 123 -0.728 -0.347 6.127 1.00 0.76 C ATOM 1819 C TYR A 123 -2.139 -0.904 5.950 1.00 0.68 C ATOM 1820 O TYR A 123 -2.445 -2.014 6.386 1.00 0.85 O ATOM 1821 CB TYR A 123 0.059 -0.449 4.814 1.00 0.90 C ATOM 1822 CG TYR A 123 0.342 0.824 4.043 1.00 1.65 C ATOM 1823 CD1 TYR A 123 1.603 1.436 4.182 1.00 3.13 C ATOM 1824 CD2 TYR A 123 -0.493 1.197 2.974 1.00 2.55 C ATOM 1825 CE1 TYR A 123 2.063 2.345 3.218 1.00 4.27 C ATOM 1826 CE2 TYR A 123 -0.039 2.121 2.016 1.00 3.60 C ATOM 1827 CZ TYR A 123 1.255 2.658 2.114 1.00 4.18 C ATOM 1828 OH TYR A 123 1.744 3.449 1.120 1.00 5.34 O ATOM 0 H TYR A 123 0.198 -2.047 6.884 1.00 0.74 H new ATOM 0 HA TYR A 123 -0.783 0.705 6.406 1.00 0.76 H new ATOM 0 HB2 TYR A 123 1.015 -0.922 5.036 1.00 0.90 H new ATOM 0 HB3 TYR A 123 -0.485 -1.124 4.153 1.00 0.90 H new ATOM 0 HD1 TYR A 123 2.220 1.204 5.037 1.00 3.13 H new ATOM 0 HD2 TYR A 123 -1.483 0.774 2.889 1.00 2.55 H new ATOM 0 HE1 TYR A 123 3.035 2.802 3.325 1.00 4.27 H new ATOM 0 HE2 TYR A 123 -0.686 2.418 1.204 1.00 3.60 H new ATOM 0 HH TYR A 123 2.431 2.960 0.621 1.00 5.34 H new ATOM 1838 N SER A 124 -2.983 -0.129 5.279 1.00 0.79 N ATOM 1839 CA SER A 124 -4.336 -0.480 4.904 1.00 0.87 C ATOM 1840 C SER A 124 -4.601 0.167 3.545 1.00 0.79 C ATOM 1841 O SER A 124 -5.270 1.197 3.476 1.00 0.83 O ATOM 1842 CB SER A 124 -5.303 0.014 5.990 1.00 1.18 C ATOM 1843 OG SER A 124 -5.153 1.407 6.183 1.00 2.53 O ATOM 0 H SER A 124 -2.723 0.807 4.969 1.00 0.79 H new ATOM 0 HA SER A 124 -4.480 -1.557 4.820 1.00 0.87 H new ATOM 0 HB2 SER A 124 -6.330 -0.212 5.702 1.00 1.18 H new ATOM 0 HB3 SER A 124 -5.111 -0.512 6.925 1.00 1.18 H new ATOM 0 HG SER A 124 -4.377 1.726 5.677 1.00 2.53 H new ATOM 1849 N LEU A 125 -4.038 -0.397 2.474 1.00 1.30 N ATOM 1850 CA LEU A 125 -4.327 0.037 1.112 1.00 1.11 C ATOM 1851 C LEU A 125 -5.600 -0.664 0.670 1.00 1.01 C ATOM 1852 O LEU A 125 -5.739 -1.853 0.918 1.00 1.11 O ATOM 1853 CB LEU A 125 -3.149 -0.303 0.194 1.00 0.97 C ATOM 1854 CG LEU A 125 -3.315 0.141 -1.264 1.00 0.82 C ATOM 1855 CD1 LEU A 125 -4.022 -0.890 -2.147 1.00 0.78 C ATOM 1856 CD2 LEU A 125 -3.857 1.560 -1.441 1.00 0.87 C ATOM 0 H LEU A 125 -3.370 -1.166 2.530 1.00 1.30 H new ATOM 0 HA LEU A 125 -4.469 1.117 1.064 1.00 1.11 H new ATOM 0 HB2 LEU A 125 -2.248 0.158 0.598 1.00 0.97 H new ATOM 0 HB3 LEU A 125 -2.992 -1.381 0.214 1.00 0.97 H new ATOM 0 HG LEU A 125 -2.292 0.192 -1.637 1.00 0.82 H new ATOM 0 HD11 LEU A 125 -4.102 -0.505 -3.163 1.00 0.78 H new ATOM 0 HD12 LEU A 125 -3.448 -1.817 -2.155 1.00 0.78 H new ATOM 0 HD13 LEU A 125 -5.019 -1.084 -1.753 1.00 0.78 H new ATOM 0 HD21 LEU A 125 -3.941 1.787 -2.504 1.00 0.87 H new ATOM 0 HD22 LEU A 125 -4.839 1.635 -0.975 1.00 0.87 H new ATOM 0 HD23 LEU A 125 -3.177 2.270 -0.971 1.00 0.87 H new ATOM 1868 N GLY A 126 -6.521 0.050 0.034 1.00 0.94 N ATOM 1869 CA GLY A 126 -7.797 -0.454 -0.449 1.00 0.98 C ATOM 1870 C GLY A 126 -7.895 -0.315 -1.963 1.00 0.81 C ATOM 1871 O GLY A 126 -6.979 0.189 -2.608 1.00 1.15 O ATOM 0 H GLY A 126 -6.391 1.041 -0.167 1.00 0.94 H new ATOM 0 HA2 GLY A 126 -7.910 -1.501 -0.167 1.00 0.98 H new ATOM 0 HA3 GLY A 126 -8.612 0.093 0.025 1.00 0.98 H new ATOM 1875 N ILE A 127 -8.999 -0.807 -2.531 1.00 1.06 N ATOM 1876 CA ILE A 127 -9.270 -0.802 -3.966 1.00 1.08 C ATOM 1877 C ILE A 127 -10.667 -0.241 -4.235 1.00 1.13 C ATOM 1878 O ILE A 127 -11.609 -0.534 -3.497 1.00 1.37 O ATOM 1879 CB ILE A 127 -9.111 -2.236 -4.514 1.00 1.54 C ATOM 1880 CG1 ILE A 127 -9.059 -2.311 -6.055 1.00 1.74 C ATOM 1881 CG2 ILE A 127 -10.173 -3.181 -3.934 1.00 2.20 C ATOM 1882 CD1 ILE A 127 -10.393 -2.609 -6.754 1.00 2.97 C ATOM 0 H ILE A 127 -9.750 -1.232 -1.987 1.00 1.06 H new ATOM 0 HA ILE A 127 -8.558 -0.157 -4.481 1.00 1.08 H new ATOM 0 HB ILE A 127 -8.133 -2.577 -4.173 1.00 1.54 H new ATOM 0 HG12 ILE A 127 -8.676 -1.363 -6.433 1.00 1.74 H new ATOM 0 HG13 ILE A 127 -8.342 -3.081 -6.339 1.00 1.74 H new ATOM 0 HG21 ILE A 127 -10.031 -4.182 -4.342 1.00 2.20 H new ATOM 0 HG22 ILE A 127 -10.077 -3.214 -2.849 1.00 2.20 H new ATOM 0 HG23 ILE A 127 -11.166 -2.819 -4.199 1.00 2.20 H new ATOM 0 HD11 ILE A 127 -10.240 -2.639 -7.833 1.00 2.97 H new ATOM 0 HD12 ILE A 127 -10.774 -3.572 -6.415 1.00 2.97 H new ATOM 0 HD13 ILE A 127 -11.113 -1.828 -6.511 1.00 2.97 H new ATOM 1894 N PHE A 128 -10.825 0.515 -5.324 1.00 1.05 N ATOM 1895 CA PHE A 128 -12.122 0.788 -5.918 1.00 1.12 C ATOM 1896 C PHE A 128 -11.917 1.192 -7.373 1.00 0.94 C ATOM 1897 O PHE A 128 -10.815 1.592 -7.746 1.00 1.43 O ATOM 1898 CB PHE A 128 -12.886 1.850 -5.110 1.00 2.15 C ATOM 1899 CG PHE A 128 -14.393 1.754 -5.246 1.00 2.95 C ATOM 1900 CD1 PHE A 128 -15.043 2.359 -6.337 1.00 3.48 C ATOM 1901 CD2 PHE A 128 -15.152 1.089 -4.267 1.00 4.15 C ATOM 1902 CE1 PHE A 128 -16.433 2.228 -6.493 1.00 4.59 C ATOM 1903 CE2 PHE A 128 -16.546 0.972 -4.415 1.00 5.11 C ATOM 1904 CZ PHE A 128 -17.185 1.523 -5.540 1.00 5.15 C ATOM 0 H PHE A 128 -10.047 0.955 -5.816 1.00 1.05 H new ATOM 0 HA PHE A 128 -12.742 -0.108 -5.894 1.00 1.12 H new ATOM 0 HB2 PHE A 128 -12.619 1.755 -4.058 1.00 2.15 H new ATOM 0 HB3 PHE A 128 -12.564 2.840 -5.432 1.00 2.15 H new ATOM 0 HD1 PHE A 128 -14.472 2.926 -7.057 1.00 3.48 H new ATOM 0 HD2 PHE A 128 -14.664 0.668 -3.400 1.00 4.15 H new ATOM 0 HE1 PHE A 128 -16.924 2.670 -7.347 1.00 4.59 H new ATOM 0 HE2 PHE A 128 -17.127 0.458 -3.663 1.00 5.11 H new ATOM 0 HZ PHE A 128 -18.251 1.404 -5.670 1.00 5.15 H new ATOM 1914 N GLY A 129 -12.953 1.012 -8.196 1.00 1.53 N ATOM 1915 CA GLY A 129 -12.948 1.317 -9.624 1.00 2.39 C ATOM 1916 C GLY A 129 -12.847 0.066 -10.497 1.00 2.09 C ATOM 1917 O GLY A 129 -12.690 0.156 -11.713 1.00 3.26 O ATOM 0 H GLY A 129 -13.846 0.638 -7.874 1.00 1.53 H new ATOM 0 HA2 GLY A 129 -13.859 1.859 -9.878 1.00 2.39 H new ATOM 0 HA3 GLY A 129 -12.111 1.978 -9.847 1.00 2.39 H new ATOM 1921 N GLY A 130 -12.942 -1.114 -9.884 1.00 1.59 N ATOM 1922 CA GLY A 130 -13.129 -2.371 -10.590 1.00 2.39 C ATOM 1923 C GLY A 130 -11.808 -2.871 -11.157 1.00 2.71 C ATOM 1924 O GLY A 130 -11.240 -3.825 -10.635 1.00 3.76 O ATOM 0 H GLY A 130 -12.890 -1.220 -8.871 1.00 1.59 H new ATOM 0 HA2 GLY A 130 -13.545 -3.116 -9.912 1.00 2.39 H new ATOM 0 HA3 GLY A 130 -13.849 -2.237 -11.397 1.00 2.39 H new ATOM 1928 N LYS A 131 -11.272 -2.192 -12.178 1.00 2.23 N ATOM 1929 CA LYS A 131 -9.937 -2.533 -12.660 1.00 2.37 C ATOM 1930 C LYS A 131 -8.862 -2.201 -11.617 1.00 2.38 C ATOM 1931 O LYS A 131 -7.749 -2.711 -11.714 1.00 3.42 O ATOM 1932 CB LYS A 131 -9.647 -1.980 -14.068 1.00 2.71 C ATOM 1933 CG LYS A 131 -9.264 -0.495 -14.146 1.00 2.91 C ATOM 1934 CD LYS A 131 -8.783 -0.147 -15.569 1.00 3.41 C ATOM 1935 CE LYS A 131 -8.200 1.273 -15.576 1.00 4.08 C ATOM 1936 NZ LYS A 131 -7.624 1.703 -16.863 1.00 4.63 N ATOM 0 H LYS A 131 -11.729 -1.426 -12.672 1.00 2.23 H new ATOM 0 HA LYS A 131 -9.903 -3.615 -12.788 1.00 2.37 H new ATOM 0 HB2 LYS A 131 -8.839 -2.566 -14.507 1.00 2.71 H new ATOM 0 HB3 LYS A 131 -10.530 -2.139 -14.688 1.00 2.71 H new ATOM 0 HG2 LYS A 131 -10.121 0.124 -13.882 1.00 2.91 H new ATOM 0 HG3 LYS A 131 -8.478 -0.276 -13.424 1.00 2.91 H new ATOM 0 HD2 LYS A 131 -8.029 -0.863 -15.895 1.00 3.41 H new ATOM 0 HD3 LYS A 131 -9.613 -0.215 -16.272 1.00 3.41 H new ATOM 0 HE2 LYS A 131 -8.986 1.974 -15.295 1.00 4.08 H new ATOM 0 HE3 LYS A 131 -7.427 1.336 -14.810 1.00 4.08 H new ATOM 0 HZ1 LYS A 131 -7.256 2.671 -16.772 1.00 4.63 H new ATOM 0 HZ2 LYS A 131 -6.849 1.062 -17.128 1.00 4.63 H new ATOM 0 HZ3 LYS A 131 -8.360 1.680 -17.598 1.00 4.63 H new ATOM 1950 N ALA A 132 -9.219 -1.342 -10.649 1.00 1.43 N ATOM 1951 CA ALA A 132 -8.398 -0.716 -9.629 1.00 1.37 C ATOM 1952 C ALA A 132 -8.116 0.676 -10.161 1.00 1.31 C ATOM 1953 O ALA A 132 -7.415 0.832 -11.156 1.00 1.51 O ATOM 1954 CB ALA A 132 -7.119 -1.478 -9.285 1.00 1.83 C ATOM 0 H ALA A 132 -10.191 -1.046 -10.563 1.00 1.43 H new ATOM 0 HA ALA A 132 -8.925 -0.702 -8.675 1.00 1.37 H new ATOM 0 HB1 ALA A 132 -6.569 -0.937 -8.515 1.00 1.83 H new ATOM 0 HB2 ALA A 132 -7.375 -2.472 -8.918 1.00 1.83 H new ATOM 0 HB3 ALA A 132 -6.499 -1.569 -10.177 1.00 1.83 H new ATOM 1960 N GLN A 133 -8.767 1.674 -9.574 1.00 1.30 N ATOM 1961 CA GLN A 133 -8.641 3.069 -9.941 1.00 1.34 C ATOM 1962 C GLN A 133 -8.250 3.832 -8.689 1.00 1.49 C ATOM 1963 O GLN A 133 -7.108 4.274 -8.527 1.00 1.96 O ATOM 1964 CB GLN A 133 -9.944 3.598 -10.565 1.00 1.30 C ATOM 1965 CG GLN A 133 -10.360 2.843 -11.840 1.00 1.47 C ATOM 1966 CD GLN A 133 -9.478 3.258 -13.009 1.00 2.43 C ATOM 1967 OE1 GLN A 133 -9.906 3.998 -13.889 1.00 2.66 O ATOM 1968 NE2 GLN A 133 -8.248 2.764 -13.031 1.00 3.82 N ATOM 0 H GLN A 133 -9.418 1.523 -8.804 1.00 1.30 H new ATOM 0 HA GLN A 133 -7.874 3.201 -10.704 1.00 1.34 H new ATOM 0 HB2 GLN A 133 -10.746 3.525 -9.830 1.00 1.30 H new ATOM 0 HB3 GLN A 133 -9.823 4.655 -10.801 1.00 1.30 H new ATOM 0 HG2 GLN A 133 -10.279 1.768 -11.678 1.00 1.47 H new ATOM 0 HG3 GLN A 133 -11.404 3.053 -12.071 1.00 1.47 H new ATOM 0 HE21 GLN A 133 -7.931 2.152 -12.279 1.00 3.82 H new ATOM 0 HE22 GLN A 133 -7.619 2.996 -13.800 1.00 3.82 H new ATOM 1977 N GLU A 134 -9.214 3.918 -7.781 1.00 1.41 N ATOM 1978 CA GLU A 134 -9.121 4.686 -6.568 1.00 1.76 C ATOM 1979 C GLU A 134 -8.588 3.717 -5.530 1.00 1.46 C ATOM 1980 O GLU A 134 -9.345 3.197 -4.709 1.00 2.02 O ATOM 1981 CB GLU A 134 -10.517 5.208 -6.217 1.00 2.33 C ATOM 1982 CG GLU A 134 -11.117 6.091 -7.323 1.00 2.64 C ATOM 1983 CD GLU A 134 -12.636 6.048 -7.268 1.00 3.98 C ATOM 1984 OE1 GLU A 134 -13.228 7.094 -6.932 1.00 4.13 O ATOM 1985 OE2 GLU A 134 -13.167 4.951 -7.553 1.00 5.41 O ATOM 0 H GLU A 134 -10.107 3.436 -7.882 1.00 1.41 H new ATOM 0 HA GLU A 134 -8.468 5.555 -6.642 1.00 1.76 H new ATOM 0 HB2 GLU A 134 -11.180 4.363 -6.033 1.00 2.33 H new ATOM 0 HB3 GLU A 134 -10.464 5.780 -5.290 1.00 2.33 H new ATOM 0 HG2 GLU A 134 -10.771 7.118 -7.205 1.00 2.64 H new ATOM 0 HG3 GLU A 134 -10.772 5.748 -8.298 1.00 2.64 H new ATOM 1992 N VAL A 135 -7.281 3.450 -5.576 1.00 0.96 N ATOM 1993 CA VAL A 135 -6.657 2.608 -4.568 1.00 0.66 C ATOM 1994 C VAL A 135 -6.474 3.468 -3.314 1.00 0.73 C ATOM 1995 O VAL A 135 -5.371 3.845 -2.929 1.00 1.42 O ATOM 1996 CB VAL A 135 -5.393 1.888 -5.084 1.00 0.77 C ATOM 1997 CG1 VAL A 135 -5.738 0.939 -6.233 1.00 1.01 C ATOM 1998 CG2 VAL A 135 -4.256 2.797 -5.544 1.00 1.37 C ATOM 0 H VAL A 135 -6.646 3.802 -6.293 1.00 0.96 H new ATOM 0 HA VAL A 135 -7.295 1.764 -4.307 1.00 0.66 H new ATOM 0 HB VAL A 135 -5.028 1.350 -4.209 1.00 0.77 H new ATOM 0 HG11 VAL A 135 -4.831 0.443 -6.580 1.00 1.01 H new ATOM 0 HG12 VAL A 135 -6.451 0.191 -5.886 1.00 1.01 H new ATOM 0 HG13 VAL A 135 -6.178 1.506 -7.053 1.00 1.01 H new ATOM 0 HG21 VAL A 135 -3.419 2.188 -5.886 1.00 1.37 H new ATOM 0 HG22 VAL A 135 -4.603 3.429 -6.362 1.00 1.37 H new ATOM 0 HG23 VAL A 135 -3.933 3.424 -4.713 1.00 1.37 H new ATOM 2008 N ALA A 136 -7.602 3.811 -2.690 1.00 0.81 N ATOM 2009 CA ALA A 136 -7.637 4.675 -1.529 1.00 0.89 C ATOM 2010 C ALA A 136 -7.185 3.832 -0.346 1.00 0.86 C ATOM 2011 O ALA A 136 -7.425 2.625 -0.309 1.00 0.86 O ATOM 2012 CB ALA A 136 -9.056 5.211 -1.322 1.00 1.03 C ATOM 0 H ALA A 136 -8.523 3.488 -2.987 1.00 0.81 H new ATOM 0 HA ALA A 136 -6.984 5.539 -1.649 1.00 0.89 H new ATOM 0 HB1 ALA A 136 -9.076 5.860 -0.447 1.00 1.03 H new ATOM 0 HB2 ALA A 136 -9.363 5.778 -2.201 1.00 1.03 H new ATOM 0 HB3 ALA A 136 -9.741 4.377 -1.170 1.00 1.03 H new ATOM 2018 N GLY A 137 -6.434 4.438 0.565 1.00 0.89 N ATOM 2019 CA GLY A 137 -5.684 3.690 1.545 1.00 0.88 C ATOM 2020 C GLY A 137 -5.383 4.547 2.755 1.00 0.85 C ATOM 2021 O GLY A 137 -5.711 5.732 2.795 1.00 0.97 O ATOM 0 H GLY A 137 -6.333 5.450 0.639 1.00 0.89 H new ATOM 0 HA2 GLY A 137 -6.250 2.809 1.849 1.00 0.88 H new ATOM 0 HA3 GLY A 137 -4.753 3.334 1.104 1.00 0.88 H new ATOM 2025 N SER A 138 -4.708 3.940 3.721 1.00 0.84 N ATOM 2026 CA SER A 138 -3.997 4.655 4.756 1.00 0.86 C ATOM 2027 C SER A 138 -2.879 3.735 5.220 1.00 0.84 C ATOM 2028 O SER A 138 -2.831 2.570 4.826 1.00 1.28 O ATOM 2029 CB SER A 138 -4.956 5.056 5.888 1.00 0.95 C ATOM 2030 OG SER A 138 -5.859 4.018 6.227 1.00 1.98 O ATOM 0 H SER A 138 -4.642 2.926 3.804 1.00 0.84 H new ATOM 0 HA SER A 138 -3.572 5.591 4.393 1.00 0.86 H new ATOM 0 HB2 SER A 138 -4.377 5.332 6.769 1.00 0.95 H new ATOM 0 HB3 SER A 138 -5.519 5.939 5.587 1.00 0.95 H new ATOM 0 HG SER A 138 -5.451 3.150 6.024 1.00 1.98 H new ATOM 2036 N ALA A 139 -1.989 4.247 6.059 1.00 0.72 N ATOM 2037 CA ALA A 139 -1.161 3.443 6.928 1.00 0.77 C ATOM 2038 C ALA A 139 -1.102 4.065 8.312 1.00 0.83 C ATOM 2039 O ALA A 139 -1.556 5.194 8.503 1.00 1.10 O ATOM 2040 CB ALA A 139 0.239 3.348 6.332 1.00 0.80 C ATOM 0 H ALA A 139 -1.824 5.249 6.151 1.00 0.72 H new ATOM 0 HA ALA A 139 -1.586 2.443 7.018 1.00 0.77 H new ATOM 0 HB1 ALA A 139 0.871 2.743 6.982 1.00 0.80 H new ATOM 0 HB2 ALA A 139 0.184 2.886 5.346 1.00 0.80 H new ATOM 0 HB3 ALA A 139 0.664 4.347 6.241 1.00 0.80 H new ATOM 2046 N GLU A 140 -0.509 3.326 9.251 1.00 0.70 N ATOM 2047 CA GLU A 140 -0.122 3.840 10.552 1.00 0.86 C ATOM 2048 C GLU A 140 1.253 3.295 10.938 1.00 0.95 C ATOM 2049 O GLU A 140 1.430 2.578 11.919 1.00 1.70 O ATOM 2050 CB GLU A 140 -1.186 3.553 11.597 1.00 1.11 C ATOM 2051 CG GLU A 140 -1.528 2.063 11.653 1.00 1.88 C ATOM 2052 CD GLU A 140 -1.630 1.512 13.065 1.00 2.12 C ATOM 2053 OE1 GLU A 140 -1.444 2.277 14.050 1.00 2.14 O ATOM 2054 OE2 GLU A 140 -1.715 0.269 13.181 1.00 3.41 O ATOM 0 H GLU A 140 -0.284 2.340 9.120 1.00 0.70 H new ATOM 0 HA GLU A 140 -0.040 4.926 10.499 1.00 0.86 H new ATOM 0 HB2 GLU A 140 -0.836 3.884 12.575 1.00 1.11 H new ATOM 0 HB3 GLU A 140 -2.085 4.126 11.369 1.00 1.11 H new ATOM 0 HG2 GLU A 140 -2.475 1.897 11.139 1.00 1.88 H new ATOM 0 HG3 GLU A 140 -0.767 1.504 11.109 1.00 1.88 H new ATOM 2061 N VAL A 141 2.245 3.672 10.147 1.00 0.89 N ATOM 2062 CA VAL A 141 3.630 3.277 10.346 1.00 0.93 C ATOM 2063 C VAL A 141 4.174 3.940 11.623 1.00 0.93 C ATOM 2064 O VAL A 141 4.188 5.163 11.713 1.00 1.09 O ATOM 2065 CB VAL A 141 4.429 3.553 9.061 1.00 1.02 C ATOM 2066 CG1 VAL A 141 3.790 2.823 7.872 1.00 2.56 C ATOM 2067 CG2 VAL A 141 4.532 5.042 8.709 1.00 1.88 C ATOM 0 H VAL A 141 2.107 4.272 9.334 1.00 0.89 H new ATOM 0 HA VAL A 141 3.727 2.205 10.519 1.00 0.93 H new ATOM 0 HB VAL A 141 5.437 3.187 9.257 1.00 1.02 H new ATOM 0 HG11 VAL A 141 4.365 3.026 6.969 1.00 2.56 H new ATOM 0 HG12 VAL A 141 3.784 1.750 8.064 1.00 2.56 H new ATOM 0 HG13 VAL A 141 2.767 3.173 7.737 1.00 2.56 H new ATOM 0 HG21 VAL A 141 5.109 5.160 7.792 1.00 1.88 H new ATOM 0 HG22 VAL A 141 3.532 5.452 8.564 1.00 1.88 H new ATOM 0 HG23 VAL A 141 5.028 5.574 9.521 1.00 1.88 H new ATOM 2077 N LYS A 142 4.536 3.160 12.650 1.00 1.06 N ATOM 2078 CA LYS A 142 4.676 3.651 14.019 1.00 1.35 C ATOM 2079 C LYS A 142 6.076 3.376 14.571 1.00 1.42 C ATOM 2080 O LYS A 142 6.383 2.265 14.995 1.00 1.61 O ATOM 2081 CB LYS A 142 3.549 3.069 14.893 1.00 1.71 C ATOM 2082 CG LYS A 142 3.728 1.600 15.302 1.00 1.83 C ATOM 2083 CD LYS A 142 2.399 0.997 15.796 1.00 2.10 C ATOM 2084 CE LYS A 142 1.548 0.458 14.633 1.00 3.83 C ATOM 2085 NZ LYS A 142 0.117 0.314 14.978 1.00 4.39 N ATOM 0 H LYS A 142 4.740 2.166 12.549 1.00 1.06 H new ATOM 0 HA LYS A 142 4.570 4.736 14.030 1.00 1.35 H new ATOM 0 HB2 LYS A 142 3.464 3.673 15.797 1.00 1.71 H new ATOM 0 HB3 LYS A 142 2.607 3.167 14.354 1.00 1.71 H new ATOM 0 HG2 LYS A 142 4.099 1.025 14.453 1.00 1.83 H new ATOM 0 HG3 LYS A 142 4.479 1.527 16.089 1.00 1.83 H new ATOM 0 HD2 LYS A 142 2.605 0.190 16.500 1.00 2.10 H new ATOM 0 HD3 LYS A 142 1.835 1.756 16.338 1.00 2.10 H new ATOM 0 HE2 LYS A 142 1.644 1.129 13.779 1.00 3.83 H new ATOM 0 HE3 LYS A 142 1.940 -0.511 14.323 1.00 3.83 H new ATOM 0 HZ1 LYS A 142 -0.372 -0.207 14.222 1.00 4.39 H new ATOM 0 HZ2 LYS A 142 0.026 -0.208 15.873 1.00 4.39 H new ATOM 0 HZ3 LYS A 142 -0.311 1.256 15.082 1.00 4.39 H new ATOM 2099 N THR A 143 6.926 4.398 14.610 1.00 1.47 N ATOM 2100 CA THR A 143 8.293 4.233 15.080 1.00 1.59 C ATOM 2101 C THR A 143 8.721 5.575 15.662 1.00 1.56 C ATOM 2102 O THR A 143 8.085 6.594 15.388 1.00 1.38 O ATOM 2103 CB THR A 143 9.198 3.766 13.916 1.00 1.67 C ATOM 2104 OG1 THR A 143 8.614 2.681 13.231 1.00 3.09 O ATOM 2105 CG2 THR A 143 10.595 3.304 14.352 1.00 2.32 C ATOM 0 H THR A 143 6.690 5.348 14.322 1.00 1.47 H new ATOM 0 HA THR A 143 8.375 3.465 15.850 1.00 1.59 H new ATOM 0 HB THR A 143 9.300 4.648 13.284 1.00 1.67 H new ATOM 0 HG1 THR A 143 8.740 2.798 12.266 1.00 3.09 H new ATOM 0 HG21 THR A 143 11.165 2.993 13.477 1.00 2.32 H new ATOM 0 HG22 THR A 143 11.111 4.126 14.849 1.00 2.32 H new ATOM 0 HG23 THR A 143 10.502 2.465 15.041 1.00 2.32 H new ATOM 2113 N VAL A 144 9.851 5.591 16.375 1.00 1.79 N ATOM 2114 CA VAL A 144 10.614 6.803 16.668 1.00 1.69 C ATOM 2115 C VAL A 144 10.748 7.671 15.406 1.00 1.44 C ATOM 2116 O VAL A 144 10.841 8.892 15.497 1.00 1.37 O ATOM 2117 CB VAL A 144 11.995 6.408 17.230 1.00 1.99 C ATOM 2118 CG1 VAL A 144 12.877 7.633 17.508 1.00 2.12 C ATOM 2119 CG2 VAL A 144 11.851 5.614 18.537 1.00 2.77 C ATOM 0 H VAL A 144 10.266 4.747 16.770 1.00 1.79 H new ATOM 0 HA VAL A 144 10.089 7.396 17.417 1.00 1.69 H new ATOM 0 HB VAL A 144 12.470 5.793 16.466 1.00 1.99 H new ATOM 0 HG11 VAL A 144 13.839 7.307 17.902 1.00 2.12 H new ATOM 0 HG12 VAL A 144 13.033 8.186 16.582 1.00 2.12 H new ATOM 0 HG13 VAL A 144 12.386 8.277 18.237 1.00 2.12 H new ATOM 0 HG21 VAL A 144 12.839 5.348 18.912 1.00 2.77 H new ATOM 0 HG22 VAL A 144 11.334 6.224 19.278 1.00 2.77 H new ATOM 0 HG23 VAL A 144 11.278 4.706 18.350 1.00 2.77 H new ATOM 2129 N ASN A 145 10.739 7.036 14.227 1.00 1.54 N ATOM 2130 CA ASN A 145 10.680 7.709 12.937 1.00 1.61 C ATOM 2131 C ASN A 145 9.587 7.048 12.101 1.00 1.60 C ATOM 2132 O ASN A 145 9.831 6.604 10.985 1.00 2.03 O ATOM 2133 CB ASN A 145 12.052 7.658 12.242 1.00 2.28 C ATOM 2134 CG ASN A 145 12.637 6.248 12.194 1.00 3.48 C ATOM 2135 OD1 ASN A 145 12.495 5.515 11.223 1.00 5.19 O ATOM 2136 ND2 ASN A 145 13.308 5.845 13.268 1.00 3.13 N ATOM 0 H ASN A 145 10.773 6.020 14.149 1.00 1.54 H new ATOM 0 HA ASN A 145 10.435 8.763 13.066 1.00 1.61 H new ATOM 0 HB2 ASN A 145 11.954 8.041 11.226 1.00 2.28 H new ATOM 0 HB3 ASN A 145 12.745 8.317 12.766 1.00 2.28 H new ATOM 0 HD21 ASN A 145 13.716 4.910 13.294 1.00 3.13 H new ATOM 0 HD22 ASN A 145 13.415 6.470 14.067 1.00 3.13 H new ATOM 2143 N GLY A 146 8.363 7.008 12.638 1.00 1.25 N ATOM 2144 CA GLY A 146 7.213 6.441 11.955 1.00 1.32 C ATOM 2145 C GLY A 146 6.054 7.414 12.009 1.00 0.94 C ATOM 2146 O GLY A 146 5.399 7.572 13.039 1.00 1.07 O ATOM 0 H GLY A 146 8.149 7.373 13.566 1.00 1.25 H new ATOM 0 HA2 GLY A 146 7.467 6.220 10.918 1.00 1.32 H new ATOM 0 HA3 GLY A 146 6.930 5.498 12.422 1.00 1.32 H new ATOM 2150 N ILE A 147 5.825 8.091 10.886 1.00 0.64 N ATOM 2151 CA ILE A 147 4.933 9.227 10.800 1.00 0.62 C ATOM 2152 C ILE A 147 3.494 8.753 10.565 1.00 0.90 C ATOM 2153 O ILE A 147 2.879 9.138 9.571 1.00 1.89 O ATOM 2154 CB ILE A 147 5.430 10.188 9.690 1.00 0.93 C ATOM 2155 CG1 ILE A 147 5.799 9.472 8.371 1.00 1.20 C ATOM 2156 CG2 ILE A 147 6.579 11.068 10.191 1.00 1.83 C ATOM 2157 CD1 ILE A 147 7.289 9.150 8.179 1.00 1.20 C ATOM 0 H ILE A 147 6.267 7.855 9.997 1.00 0.64 H new ATOM 0 HA ILE A 147 4.935 9.778 11.741 1.00 0.62 H new ATOM 0 HB ILE A 147 4.584 10.832 9.450 1.00 0.93 H new ATOM 0 HG12 ILE A 147 5.235 8.541 8.315 1.00 1.20 H new ATOM 0 HG13 ILE A 147 5.471 10.094 7.538 1.00 1.20 H new ATOM 0 HG21 ILE A 147 6.906 11.731 9.390 1.00 1.83 H new ATOM 0 HG22 ILE A 147 6.239 11.663 11.038 1.00 1.83 H new ATOM 0 HG23 ILE A 147 7.412 10.437 10.502 1.00 1.83 H new ATOM 0 HD11 ILE A 147 7.433 8.649 7.222 1.00 1.20 H new ATOM 0 HD12 ILE A 147 7.866 10.075 8.195 1.00 1.20 H new ATOM 0 HD13 ILE A 147 7.627 8.498 8.984 1.00 1.20 H new ATOM 2169 N ARG A 148 2.978 7.938 11.498 1.00 0.72 N ATOM 2170 CA ARG A 148 1.758 7.137 11.382 1.00 0.94 C ATOM 2171 C ARG A 148 0.786 7.581 10.295 1.00 0.96 C ATOM 2172 O ARG A 148 0.639 6.871 9.304 1.00 1.50 O ATOM 2173 CB ARG A 148 1.037 6.988 12.733 1.00 1.16 C ATOM 2174 CG ARG A 148 1.716 5.934 13.616 1.00 1.54 C ATOM 2175 CD ARG A 148 0.988 5.696 14.950 1.00 1.84 C ATOM 2176 NE ARG A 148 -0.285 4.964 14.771 1.00 2.07 N ATOM 2177 CZ ARG A 148 -1.506 5.502 14.622 1.00 2.07 C ATOM 2178 NH1 ARG A 148 -1.670 6.826 14.707 1.00 2.20 N ATOM 2179 NH2 ARG A 148 -2.534 4.692 14.361 1.00 2.70 N ATOM 0 H ARG A 148 3.430 7.816 12.404 1.00 0.72 H new ATOM 0 HA ARG A 148 2.118 6.160 11.060 1.00 0.94 H new ATOM 0 HB2 ARG A 148 1.028 7.947 13.250 1.00 1.16 H new ATOM 0 HB3 ARG A 148 -0.003 6.708 12.563 1.00 1.16 H new ATOM 0 HG2 ARG A 148 1.773 4.993 13.068 1.00 1.54 H new ATOM 0 HG3 ARG A 148 2.740 6.246 13.820 1.00 1.54 H new ATOM 0 HD2 ARG A 148 1.637 5.133 15.620 1.00 1.84 H new ATOM 0 HD3 ARG A 148 0.789 6.655 15.429 1.00 1.84 H new ATOM 0 HE ARG A 148 -0.229 3.946 14.760 1.00 2.07 H new ATOM 0 HH11 ARG A 148 -0.867 7.429 14.885 1.00 2.20 H new ATOM 0 HH12 ARG A 148 -2.598 7.233 14.594 1.00 2.20 H new ATOM 0 HH21 ARG A 148 -2.383 3.687 14.279 1.00 2.70 H new ATOM 0 HH22 ARG A 148 -3.471 5.078 14.244 1.00 2.70 H new ATOM 2193 N HIS A 149 0.087 8.698 10.519 1.00 0.65 N ATOM 2194 CA HIS A 149 -1.028 9.135 9.689 1.00 0.74 C ATOM 2195 C HIS A 149 -0.562 9.509 8.281 1.00 0.80 C ATOM 2196 O HIS A 149 -0.430 10.683 7.944 1.00 1.01 O ATOM 2197 CB HIS A 149 -1.787 10.270 10.390 1.00 0.80 C ATOM 2198 CG HIS A 149 -2.611 9.762 11.550 1.00 0.95 C ATOM 2199 ND1 HIS A 149 -3.952 9.454 11.506 1.00 2.26 N ATOM 2200 CD2 HIS A 149 -2.130 9.313 12.751 1.00 0.98 C ATOM 2201 CE1 HIS A 149 -4.267 8.837 12.658 1.00 2.21 C ATOM 2202 NE2 HIS A 149 -3.185 8.706 13.446 1.00 1.09 N ATOM 0 H HIS A 149 0.287 9.330 11.295 1.00 0.65 H new ATOM 0 HA HIS A 149 -1.725 8.307 9.561 1.00 0.74 H new ATOM 0 HB2 HIS A 149 -1.077 11.015 10.748 1.00 0.80 H new ATOM 0 HB3 HIS A 149 -2.438 10.769 9.672 1.00 0.80 H new ATOM 0 HD1 HIS A 149 -4.591 9.657 10.738 1.00 2.26 H new ATOM 0 HD2 HIS A 149 -1.113 9.410 13.102 1.00 0.98 H new ATOM 0 HE1 HIS A 149 -5.257 8.492 12.916 1.00 2.21 H new ATOM 2210 N ILE A 150 -0.340 8.482 7.462 1.00 0.77 N ATOM 2211 CA ILE A 150 0.035 8.601 6.071 1.00 0.75 C ATOM 2212 C ILE A 150 -1.217 8.895 5.245 1.00 1.06 C ATOM 2213 O ILE A 150 -2.157 8.098 5.223 1.00 1.43 O ATOM 2214 CB ILE A 150 0.785 7.327 5.630 1.00 0.92 C ATOM 2215 CG1 ILE A 150 2.251 7.454 6.092 1.00 1.04 C ATOM 2216 CG2 ILE A 150 0.715 7.095 4.116 1.00 1.48 C ATOM 2217 CD1 ILE A 150 3.163 6.297 5.674 1.00 1.34 C ATOM 0 H ILE A 150 -0.422 7.513 7.769 1.00 0.77 H new ATOM 0 HA ILE A 150 0.723 9.432 5.913 1.00 0.75 H new ATOM 0 HB ILE A 150 0.306 6.462 6.089 1.00 0.92 H new ATOM 0 HG12 ILE A 150 2.662 8.382 5.696 1.00 1.04 H new ATOM 0 HG13 ILE A 150 2.268 7.536 7.179 1.00 1.04 H new ATOM 0 HG21 ILE A 150 1.259 6.185 3.862 1.00 1.48 H new ATOM 0 HG22 ILE A 150 -0.327 6.992 3.811 1.00 1.48 H new ATOM 0 HG23 ILE A 150 1.162 7.943 3.597 1.00 1.48 H new ATOM 0 HD11 ILE A 150 4.172 6.477 6.045 1.00 1.34 H new ATOM 0 HD12 ILE A 150 2.783 5.365 6.093 1.00 1.34 H new ATOM 0 HD13 ILE A 150 3.184 6.224 4.587 1.00 1.34 H new ATOM 2229 N GLY A 151 -1.206 10.025 4.539 1.00 1.11 N ATOM 2230 CA GLY A 151 -2.193 10.371 3.541 1.00 1.52 C ATOM 2231 C GLY A 151 -1.857 9.632 2.250 1.00 1.32 C ATOM 2232 O GLY A 151 -0.949 10.020 1.515 1.00 1.36 O ATOM 0 H GLY A 151 -0.487 10.739 4.656 1.00 1.11 H new ATOM 0 HA2 GLY A 151 -3.191 10.098 3.885 1.00 1.52 H new ATOM 0 HA3 GLY A 151 -2.198 11.448 3.371 1.00 1.52 H new ATOM 2236 N LEU A 152 -2.575 8.536 2.004 1.00 1.23 N ATOM 2237 CA LEU A 152 -2.408 7.687 0.838 1.00 1.15 C ATOM 2238 C LEU A 152 -3.410 8.132 -0.230 1.00 1.24 C ATOM 2239 O LEU A 152 -4.606 7.881 -0.094 1.00 1.37 O ATOM 2240 CB LEU A 152 -2.624 6.238 1.289 1.00 1.42 C ATOM 2241 CG LEU A 152 -2.228 5.123 0.313 1.00 1.21 C ATOM 2242 CD1 LEU A 152 -3.025 5.137 -0.998 1.00 1.35 C ATOM 2243 CD2 LEU A 152 -0.734 5.143 -0.008 1.00 1.37 C ATOM 0 H LEU A 152 -3.309 8.210 2.633 1.00 1.23 H new ATOM 0 HA LEU A 152 -1.412 7.763 0.401 1.00 1.15 H new ATOM 0 HB2 LEU A 152 -2.067 6.088 2.214 1.00 1.42 H new ATOM 0 HB3 LEU A 152 -3.680 6.115 1.529 1.00 1.42 H new ATOM 0 HG LEU A 152 -2.474 4.201 0.840 1.00 1.21 H new ATOM 0 HD11 LEU A 152 -2.689 4.320 -1.637 1.00 1.35 H new ATOM 0 HD12 LEU A 152 -4.086 5.015 -0.780 1.00 1.35 H new ATOM 0 HD13 LEU A 152 -2.867 6.086 -1.510 1.00 1.35 H new ATOM 0 HD21 LEU A 152 -0.500 4.336 -0.702 1.00 1.37 H new ATOM 0 HD22 LEU A 152 -0.472 6.099 -0.461 1.00 1.37 H new ATOM 0 HD23 LEU A 152 -0.163 5.008 0.910 1.00 1.37 H new ATOM 2255 N ALA A 153 -2.926 8.788 -1.289 1.00 1.27 N ATOM 2256 CA ALA A 153 -3.724 9.188 -2.444 1.00 1.43 C ATOM 2257 C ALA A 153 -3.172 8.474 -3.675 1.00 1.10 C ATOM 2258 O ALA A 153 -1.962 8.279 -3.766 1.00 0.87 O ATOM 2259 CB ALA A 153 -3.648 10.707 -2.611 1.00 1.71 C ATOM 0 H ALA A 153 -1.946 9.060 -1.365 1.00 1.27 H new ATOM 0 HA ALA A 153 -4.770 8.914 -2.308 1.00 1.43 H new ATOM 0 HB1 ALA A 153 -4.243 11.008 -3.473 1.00 1.71 H new ATOM 0 HB2 ALA A 153 -4.036 11.191 -1.715 1.00 1.71 H new ATOM 0 HB3 ALA A 153 -2.611 11.005 -2.764 1.00 1.71 H new ATOM 2265 N ALA A 154 -4.026 8.054 -4.613 1.00 1.23 N ATOM 2266 CA ALA A 154 -3.591 7.268 -5.758 1.00 0.89 C ATOM 2267 C ALA A 154 -4.562 7.421 -6.922 1.00 0.78 C ATOM 2268 O ALA A 154 -5.724 7.754 -6.696 1.00 1.01 O ATOM 2269 CB ALA A 154 -3.493 5.808 -5.337 1.00 1.24 C ATOM 0 H ALA A 154 -5.027 8.250 -4.596 1.00 1.23 H new ATOM 0 HA ALA A 154 -2.617 7.624 -6.092 1.00 0.89 H new ATOM 0 HB1 ALA A 154 -3.168 5.206 -6.185 1.00 1.24 H new ATOM 0 HB2 ALA A 154 -2.772 5.711 -4.525 1.00 1.24 H new ATOM 0 HB3 ALA A 154 -4.469 5.461 -4.998 1.00 1.24 H new ATOM 2275 N LYS A 155 -4.081 7.211 -8.153 1.00 0.77 N ATOM 2276 CA LYS A 155 -4.902 7.305 -9.353 1.00 0.90 C ATOM 2277 C LYS A 155 -4.257 6.506 -10.485 1.00 1.19 C ATOM 2278 O LYS A 155 -3.032 6.487 -10.588 1.00 1.57 O ATOM 2279 CB LYS A 155 -5.061 8.781 -9.733 1.00 1.13 C ATOM 2280 CG LYS A 155 -6.018 8.961 -10.914 1.00 2.17 C ATOM 2281 CD LYS A 155 -6.244 10.458 -11.141 1.00 2.19 C ATOM 2282 CE LYS A 155 -7.230 10.659 -12.302 1.00 3.57 C ATOM 2283 NZ LYS A 155 -7.541 12.085 -12.530 1.00 4.17 N ATOM 0 H LYS A 155 -3.107 6.971 -8.339 1.00 0.77 H new ATOM 0 HA LYS A 155 -5.890 6.884 -9.168 1.00 0.90 H new ATOM 0 HB2 LYS A 155 -5.433 9.340 -8.874 1.00 1.13 H new ATOM 0 HB3 LYS A 155 -4.087 9.199 -9.987 1.00 1.13 H new ATOM 0 HG2 LYS A 155 -5.602 8.502 -11.811 1.00 2.17 H new ATOM 0 HG3 LYS A 155 -6.966 8.463 -10.711 1.00 2.17 H new ATOM 0 HD2 LYS A 155 -6.635 10.919 -10.234 1.00 2.19 H new ATOM 0 HD3 LYS A 155 -5.297 10.949 -11.365 1.00 2.19 H new ATOM 0 HE2 LYS A 155 -6.809 10.231 -13.212 1.00 3.57 H new ATOM 0 HE3 LYS A 155 -8.152 10.117 -12.091 1.00 3.57 H new ATOM 0 HZ1 LYS A 155 -8.209 12.172 -13.322 1.00 4.17 H new ATOM 0 HZ2 LYS A 155 -7.967 12.489 -11.671 1.00 4.17 H new ATOM 0 HZ3 LYS A 155 -6.666 12.599 -12.757 1.00 4.17 H new ATOM 2297 N GLN A 156 -5.067 5.887 -11.347 1.00 1.31 N ATOM 2298 CA GLN A 156 -4.678 5.091 -12.491 1.00 1.73 C ATOM 2299 C GLN A 156 -5.971 4.900 -13.304 1.00 3.11 C ATOM 2300 O GLN A 156 -6.058 3.971 -14.145 1.00 4.27 O ATOM 2301 CB GLN A 156 -4.092 3.779 -11.975 1.00 1.90 C ATOM 2302 CG GLN A 156 -5.203 2.979 -11.298 1.00 2.25 C ATOM 2303 CD GLN A 156 -4.737 2.060 -10.181 1.00 2.93 C ATOM 2304 OE1 GLN A 156 -4.333 0.919 -10.390 1.00 4.27 O ATOM 2305 NE2 GLN A 156 -4.832 2.558 -8.954 1.00 2.94 N ATOM 0 H GLN A 156 -6.081 5.939 -11.248 1.00 1.31 H new ATOM 0 HA GLN A 156 -3.915 5.547 -13.123 1.00 1.73 H new ATOM 0 HB2 GLN A 156 -3.663 3.208 -12.798 1.00 1.90 H new ATOM 0 HB3 GLN A 156 -3.285 3.977 -11.269 1.00 1.90 H new ATOM 0 HG2 GLN A 156 -5.938 3.675 -10.894 1.00 2.25 H new ATOM 0 HG3 GLN A 156 -5.712 2.380 -12.053 1.00 2.25 H new ATOM 0 HE21 GLN A 156 -5.171 3.510 -8.815 1.00 2.94 H new ATOM 0 HE22 GLN A 156 -4.565 1.989 -8.151 1.00 2.94 H new TER 2314 GLN A 156