USER MOD reduce.3.24.130724 H: found=0, std=0, add=1153, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1154 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 64 HIS : no HE2:sc= 0.102 K(o=-1.1,f=-5.4) USER MOD Set 1.2: B 164 HIS : no HE2:sc= -1.16 X(o=-1.1,f=-1.3) USER MOD Set 2.1: A 16 LYS NZ :NH3+ 145:sc= 0.0738 (180deg=0) USER MOD Set 2.2: B 105 GLN : amide:sc= -1.17 K(o=-1.1,f=-2.8) USER MOD Set 3.1: A 5 GLN : amide:sc= -1.99 K(o=-1.3,f=-6.8!) USER MOD Set 3.2: B 116 LYS NZ :NH3+ -147:sc= 0.712 (180deg=0.698) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -124:sc= 0.0198 (180deg=-0.0233) USER MOD Single : A 4 LYS NZ :NH3+ 151:sc= 0.833 (180deg=-0.0376) USER MOD Single : A 8 HIS : no HD1:sc= -0.292 K(o=-0.29,f=-1.4) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ -117:sc= 1.33 (180deg=-0.178) USER MOD Single : A 50 GLN : amide:sc= -1.12 X(o=-1.1,f=-1.1) USER MOD Single : A 52 THR OG1 : rot -76:sc= 0.724 USER MOD Single : A 55 ASN :FLIP amide:sc= -1.27 F(o=-4.4!,f=-1.3) USER MOD Single : A 57 HIS :FLIP no HD1:sc= -0.371 F(o=-0.93,f=-0.37) USER MOD Single : A 60 TYR OH : rot 148:sc= 0.399 USER MOD Single : A 66 HIS : no HD1:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 67 LYS NZ :NH3+ -165:sc= 0.976 (180deg=0.65) USER MOD Single : A 72 SER OG : rot 180:sc= -0.837 USER MOD Single : B 101 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 104 LYS NZ :NH3+ 163:sc= 0.457 (180deg=-0.0139) USER MOD Single : B 108 HIS : no HD1:sc= -0.577 K(o=-0.58,f=-1.5) USER MOD Single : B 127 SER OG : rot 180:sc= 0 USER MOD Single : B 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 135 TYR OH : rot 180:sc= 0 USER MOD Single : B 137 SER OG : rot 180:sc= 0 USER MOD Single : B 138 TYR OH : rot 180:sc= 0 USER MOD Single : B 142 HIS : no HE2:sc= 0.0288 K(o=0.029,f=-1.5!) USER MOD Single : B 143 LYS NZ :NH3+ -108:sc= 0.425 (180deg=0.00469) USER MOD Single : B 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 148 LYS NZ :NH3+ 154:sc= 0.858 (180deg=0.468) USER MOD Single : B 150 GLN : amide:sc= -1.08 X(o=-1.1,f=-1.4) USER MOD Single : B 152 THR OG1 : rot -80:sc= 0.88 USER MOD Single : B 155 ASN :FLIP amide:sc= -1.11 F(o=-4.4!,f=-1.1) USER MOD Single : B 157 HIS : no HD1:sc=-0.00506 X(o=-0.0051,f=-0.32) USER MOD Single : B 160 TYR OH : rot 15:sc= 0 USER MOD Single : B 166 HIS : no HE2:sc= 0.00573 X(o=0.0057,f=-0.063) USER MOD Single : B 167 LYS NZ :NH3+ -171:sc= 0.735 (180deg=0.622) USER MOD Single : B 172 SER OG : rot 180:sc= 0.00645 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.937 -19.663 -14.825 1.00 30.31 N ATOM 2 CA MET A 1 8.768 -18.822 -14.466 1.00 3.30 C ATOM 3 C MET A 1 9.253 -17.421 -14.034 1.00 3.40 C ATOM 4 O MET A 1 10.328 -17.305 -13.434 1.00 42.20 O ATOM 5 CB MET A 1 7.934 -19.480 -13.324 1.00 4.11 C ATOM 6 CG MET A 1 7.343 -20.852 -13.677 1.00 52.21 C ATOM 7 SD MET A 1 6.316 -21.535 -12.355 1.00 20.34 S ATOM 8 CE MET A 1 5.890 -23.148 -13.019 1.00 74.42 C ATOM 0 H1 MET A 1 9.822 -20.022 -15.794 1.00 30.31 H new ATOM 0 H2 MET A 1 10.805 -19.093 -14.767 1.00 30.31 H new ATOM 0 H3 MET A 1 10.004 -20.464 -14.165 1.00 30.31 H new ATOM 0 HA MET A 1 8.124 -18.730 -15.341 1.00 3.30 H new ATOM 0 HB2 MET A 1 8.568 -19.587 -12.444 1.00 4.11 H new ATOM 0 HB3 MET A 1 7.121 -18.807 -13.051 1.00 4.11 H new ATOM 0 HG2 MET A 1 6.746 -20.763 -14.585 1.00 52.21 H new ATOM 0 HG3 MET A 1 8.154 -21.546 -13.896 1.00 52.21 H new ATOM 0 HE1 MET A 1 5.258 -23.679 -12.307 1.00 74.42 H new ATOM 0 HE2 MET A 1 5.352 -23.024 -13.959 1.00 74.42 H new ATOM 0 HE3 MET A 1 6.800 -23.721 -13.194 1.00 74.42 H new ATOM 20 N PRO A 2 8.467 -16.323 -14.307 1.00 25.44 N ATOM 21 CA PRO A 2 8.789 -14.951 -13.822 1.00 44.43 C ATOM 22 C PRO A 2 8.377 -14.734 -12.341 1.00 70.41 C ATOM 23 O PRO A 2 8.055 -13.609 -11.936 1.00 53.10 O ATOM 24 CB PRO A 2 7.957 -14.063 -14.784 1.00 15.54 C ATOM 25 CG PRO A 2 6.738 -14.885 -15.079 1.00 52.32 C ATOM 26 CD PRO A 2 7.225 -16.322 -15.137 1.00 50.12 C ATOM 0 HA PRO A 2 9.857 -14.732 -13.831 1.00 44.43 H new ATOM 0 HB2 PRO A 2 7.694 -13.112 -14.321 1.00 15.54 H new ATOM 0 HB3 PRO A 2 8.512 -13.832 -15.693 1.00 15.54 H new ATOM 0 HG2 PRO A 2 5.981 -14.758 -14.305 1.00 52.32 H new ATOM 0 HG3 PRO A 2 6.282 -14.586 -16.023 1.00 52.32 H new ATOM 0 HD2 PRO A 2 6.480 -17.011 -14.739 1.00 50.12 H new ATOM 0 HD3 PRO A 2 7.431 -16.632 -16.162 1.00 50.12 H new ATOM 34 N ASP A 3 8.421 -15.827 -11.553 1.00 62.12 N ATOM 35 CA ASP A 3 8.070 -15.851 -10.130 1.00 21.32 C ATOM 36 C ASP A 3 8.942 -14.879 -9.337 1.00 62.22 C ATOM 37 O ASP A 3 10.173 -14.922 -9.421 1.00 4.44 O ATOM 38 CB ASP A 3 8.231 -17.299 -9.579 1.00 0.44 C ATOM 39 CG ASP A 3 8.062 -17.417 -8.048 1.00 31.33 C ATOM 40 OD1 ASP A 3 6.928 -17.273 -7.563 1.00 53.52 O ATOM 41 OD2 ASP A 3 9.061 -17.672 -7.335 1.00 72.15 O ATOM 0 H ASP A 3 8.711 -16.740 -11.905 1.00 62.12 H new ATOM 0 HA ASP A 3 7.032 -15.536 -10.019 1.00 21.32 H new ATOM 0 HB2 ASP A 3 7.499 -17.944 -10.065 1.00 0.44 H new ATOM 0 HB3 ASP A 3 9.217 -17.673 -9.854 1.00 0.44 H new ATOM 46 N LYS A 4 8.275 -13.986 -8.608 1.00 41.42 N ATOM 47 CA LYS A 4 8.899 -13.010 -7.721 1.00 34.23 C ATOM 48 C LYS A 4 8.064 -12.857 -6.450 1.00 11.10 C ATOM 49 O LYS A 4 6.831 -12.935 -6.484 1.00 30.33 O ATOM 50 CB LYS A 4 9.079 -11.624 -8.423 1.00 24.40 C ATOM 51 CG LYS A 4 10.281 -11.528 -9.391 1.00 1.44 C ATOM 52 CD LYS A 4 11.637 -11.799 -8.688 1.00 22.34 C ATOM 53 CE LYS A 4 12.838 -11.739 -9.650 1.00 31.01 C ATOM 54 NZ LYS A 4 13.042 -10.372 -10.205 1.00 13.15 N ATOM 0 H LYS A 4 7.257 -13.921 -8.620 1.00 41.42 H new ATOM 0 HA LYS A 4 9.892 -13.377 -7.461 1.00 34.23 H new ATOM 0 HB2 LYS A 4 8.168 -11.394 -8.976 1.00 24.40 H new ATOM 0 HB3 LYS A 4 9.189 -10.858 -7.656 1.00 24.40 H new ATOM 0 HG2 LYS A 4 10.147 -12.244 -10.202 1.00 1.44 H new ATOM 0 HG3 LYS A 4 10.302 -10.536 -9.841 1.00 1.44 H new ATOM 0 HD2 LYS A 4 11.780 -11.068 -7.892 1.00 22.34 H new ATOM 0 HD3 LYS A 4 11.605 -12.781 -8.217 1.00 22.34 H new ATOM 0 HE2 LYS A 4 13.739 -12.055 -9.125 1.00 31.01 H new ATOM 0 HE3 LYS A 4 12.683 -12.443 -10.468 1.00 31.01 H new ATOM 0 HZ1 LYS A 4 14.050 -10.231 -10.419 1.00 13.15 H new ATOM 0 HZ2 LYS A 4 12.485 -10.265 -11.077 1.00 13.15 H new ATOM 0 HZ3 LYS A 4 12.734 -9.665 -9.508 1.00 13.15 H new ATOM 68 N GLN A 5 8.783 -12.672 -5.337 1.00 73.53 N ATOM 69 CA GLN A 5 8.231 -12.158 -4.069 1.00 2.42 C ATOM 70 C GLN A 5 7.636 -10.752 -4.288 1.00 14.13 C ATOM 71 O GLN A 5 6.706 -10.351 -3.607 1.00 32.34 O ATOM 72 CB GLN A 5 9.341 -12.149 -2.941 1.00 24.41 C ATOM 73 CG GLN A 5 10.792 -11.885 -3.415 1.00 30.42 C ATOM 74 CD GLN A 5 11.019 -10.537 -4.116 1.00 23.31 C ATOM 75 OE1 GLN A 5 11.788 -10.450 -5.072 1.00 4.00 O ATOM 76 NE2 GLN A 5 10.407 -9.468 -3.624 1.00 34.14 N ATOM 0 H GLN A 5 9.781 -12.877 -5.287 1.00 73.53 H new ATOM 0 HA GLN A 5 7.431 -12.818 -3.734 1.00 2.42 H new ATOM 0 HB2 GLN A 5 9.077 -11.389 -2.206 1.00 24.41 H new ATOM 0 HB3 GLN A 5 9.317 -13.111 -2.428 1.00 24.41 H new ATOM 0 HG2 GLN A 5 11.455 -11.943 -2.552 1.00 30.42 H new ATOM 0 HG3 GLN A 5 11.085 -12.684 -4.096 1.00 30.42 H new ATOM 0 HE21 GLN A 5 9.773 -9.563 -2.831 1.00 34.14 H new ATOM 0 HE22 GLN A 5 10.570 -8.551 -4.039 1.00 34.14 H new ATOM 85 N LEU A 6 8.214 -10.026 -5.263 1.00 35.12 N ATOM 86 CA LEU A 6 7.808 -8.673 -5.631 1.00 14.34 C ATOM 87 C LEU A 6 6.561 -8.749 -6.516 1.00 14.31 C ATOM 88 O LEU A 6 6.608 -9.302 -7.623 1.00 51.13 O ATOM 89 CB LEU A 6 8.973 -7.963 -6.367 1.00 44.03 C ATOM 90 CG LEU A 6 8.765 -6.447 -6.653 1.00 61.21 C ATOM 91 CD1 LEU A 6 8.675 -5.634 -5.348 1.00 13.54 C ATOM 92 CD2 LEU A 6 9.867 -5.899 -7.572 1.00 54.13 C ATOM 0 H LEU A 6 8.991 -10.378 -5.823 1.00 35.12 H new ATOM 0 HA LEU A 6 7.568 -8.095 -4.738 1.00 14.34 H new ATOM 0 HB2 LEU A 6 9.879 -8.081 -5.773 1.00 44.03 H new ATOM 0 HB3 LEU A 6 9.144 -8.473 -7.315 1.00 44.03 H new ATOM 0 HG LEU A 6 7.813 -6.340 -7.173 1.00 61.21 H new ATOM 0 HD11 LEU A 6 8.530 -4.580 -5.585 1.00 13.54 H new ATOM 0 HD12 LEU A 6 7.834 -5.991 -4.754 1.00 13.54 H new ATOM 0 HD13 LEU A 6 9.597 -5.754 -4.780 1.00 13.54 H new ATOM 0 HD21 LEU A 6 9.695 -4.838 -7.754 1.00 54.13 H new ATOM 0 HD22 LEU A 6 10.838 -6.033 -7.095 1.00 54.13 H new ATOM 0 HD23 LEU A 6 9.851 -6.437 -8.520 1.00 54.13 H new ATOM 104 N LEU A 7 5.462 -8.181 -6.025 1.00 1.14 N ATOM 105 CA LEU A 7 4.130 -8.395 -6.603 1.00 45.24 C ATOM 106 C LEU A 7 3.217 -7.194 -6.314 1.00 41.14 C ATOM 107 O LEU A 7 3.692 -6.142 -5.880 1.00 63.22 O ATOM 108 CB LEU A 7 3.550 -9.770 -6.095 1.00 11.14 C ATOM 109 CG LEU A 7 3.107 -9.947 -4.572 1.00 22.23 C ATOM 110 CD1 LEU A 7 3.838 -9.028 -3.566 1.00 20.23 C ATOM 111 CD2 LEU A 7 1.586 -9.839 -4.396 1.00 22.21 C ATOM 0 H LEU A 7 5.466 -7.559 -5.216 1.00 1.14 H new ATOM 0 HA LEU A 7 4.196 -8.462 -7.689 1.00 45.24 H new ATOM 0 HB2 LEU A 7 2.682 -10.001 -6.712 1.00 11.14 H new ATOM 0 HB3 LEU A 7 4.301 -10.533 -6.303 1.00 11.14 H new ATOM 0 HG LEU A 7 3.422 -10.961 -4.325 1.00 22.23 H new ATOM 0 HD11 LEU A 7 3.468 -9.223 -2.560 1.00 20.23 H new ATOM 0 HD12 LEU A 7 4.909 -9.227 -3.604 1.00 20.23 H new ATOM 0 HD13 LEU A 7 3.653 -7.985 -3.825 1.00 20.23 H new ATOM 0 HD21 LEU A 7 1.332 -9.966 -3.344 1.00 22.21 H new ATOM 0 HD22 LEU A 7 1.249 -8.859 -4.735 1.00 22.21 H new ATOM 0 HD23 LEU A 7 1.096 -10.615 -4.984 1.00 22.21 H new ATOM 123 N HIS A 8 1.923 -7.336 -6.612 1.00 1.11 N ATOM 124 CA HIS A 8 0.915 -6.306 -6.327 1.00 44.31 C ATOM 125 C HIS A 8 0.332 -6.514 -4.920 1.00 13.01 C ATOM 126 O HIS A 8 -0.494 -7.401 -4.732 1.00 40.11 O ATOM 127 CB HIS A 8 -0.209 -6.348 -7.396 1.00 1.24 C ATOM 128 CG HIS A 8 0.225 -5.991 -8.794 1.00 63.11 C ATOM 129 ND1 HIS A 8 -0.652 -5.917 -9.853 1.00 63.54 N ATOM 130 CD2 HIS A 8 1.445 -5.699 -9.310 1.00 53.42 C ATOM 131 CE1 HIS A 8 0.005 -5.609 -10.948 1.00 34.44 C ATOM 132 NE2 HIS A 8 1.278 -5.469 -10.645 1.00 71.15 N ATOM 0 H HIS A 8 1.542 -8.170 -7.059 1.00 1.11 H new ATOM 0 HA HIS A 8 1.389 -5.325 -6.364 1.00 44.31 H new ATOM 0 HB2 HIS A 8 -0.638 -7.350 -7.410 1.00 1.24 H new ATOM 0 HB3 HIS A 8 -1.003 -5.665 -7.093 1.00 1.24 H new ATOM 0 HD2 HIS A 8 2.377 -5.656 -8.765 1.00 53.42 H new ATOM 0 HE1 HIS A 8 -0.427 -5.491 -11.931 1.00 34.44 H new ATOM 0 HE2 HIS A 8 2.020 -5.228 -11.302 1.00 71.15 H new ATOM 141 N ILE A 9 0.779 -5.702 -3.932 1.00 55.32 N ATOM 142 CA ILE A 9 0.277 -5.779 -2.535 1.00 73.43 C ATOM 143 C ILE A 9 -1.199 -5.346 -2.457 1.00 12.23 C ATOM 144 O ILE A 9 -1.741 -4.795 -3.407 1.00 43.30 O ATOM 145 CB ILE A 9 1.129 -4.898 -1.543 1.00 63.43 C ATOM 146 CG1 ILE A 9 0.992 -3.376 -1.882 1.00 4.50 C ATOM 147 CG2 ILE A 9 2.606 -5.348 -1.551 1.00 24.43 C ATOM 148 CD1 ILE A 9 1.742 -2.440 -0.947 1.00 5.34 C ATOM 0 H ILE A 9 1.488 -4.983 -4.076 1.00 55.32 H new ATOM 0 HA ILE A 9 0.371 -6.822 -2.231 1.00 73.43 H new ATOM 0 HB ILE A 9 0.740 -5.043 -0.535 1.00 63.43 H new ATOM 0 HG12 ILE A 9 1.348 -3.212 -2.899 1.00 4.50 H new ATOM 0 HG13 ILE A 9 -0.065 -3.110 -1.868 1.00 4.50 H new ATOM 0 HG21 ILE A 9 3.179 -4.729 -0.861 1.00 24.43 H new ATOM 0 HG22 ILE A 9 2.670 -6.391 -1.242 1.00 24.43 H new ATOM 0 HG23 ILE A 9 3.013 -5.242 -2.557 1.00 24.43 H new ATOM 0 HD11 ILE A 9 1.586 -1.408 -1.263 1.00 5.34 H new ATOM 0 HD12 ILE A 9 1.371 -2.568 0.070 1.00 5.34 H new ATOM 0 HD13 ILE A 9 2.807 -2.672 -0.977 1.00 5.34 H new ATOM 160 N VAL A 10 -1.829 -5.558 -1.301 1.00 64.31 N ATOM 161 CA VAL A 10 -3.280 -5.347 -1.132 1.00 72.45 C ATOM 162 C VAL A 10 -3.581 -4.333 -0.020 1.00 0.12 C ATOM 163 O VAL A 10 -3.031 -4.412 1.084 1.00 11.42 O ATOM 164 CB VAL A 10 -4.020 -6.715 -0.873 1.00 70.04 C ATOM 165 CG1 VAL A 10 -4.319 -7.422 -2.198 1.00 62.12 C ATOM 166 CG2 VAL A 10 -3.186 -7.640 0.050 1.00 34.23 C ATOM 0 H VAL A 10 -1.357 -5.879 -0.456 1.00 64.31 H new ATOM 0 HA VAL A 10 -3.662 -4.927 -2.062 1.00 72.45 H new ATOM 0 HB VAL A 10 -4.961 -6.494 -0.370 1.00 70.04 H new ATOM 0 HG11 VAL A 10 -4.830 -8.364 -2.000 1.00 62.12 H new ATOM 0 HG12 VAL A 10 -4.955 -6.787 -2.814 1.00 62.12 H new ATOM 0 HG13 VAL A 10 -3.385 -7.619 -2.724 1.00 62.12 H new ATOM 0 HG21 VAL A 10 -3.723 -8.575 0.209 1.00 34.23 H new ATOM 0 HG22 VAL A 10 -2.224 -7.849 -0.418 1.00 34.23 H new ATOM 0 HG23 VAL A 10 -3.024 -7.147 1.008 1.00 34.23 H new ATOM 176 N VAL A 11 -4.478 -3.387 -0.349 1.00 21.14 N ATOM 177 CA VAL A 11 -4.913 -2.299 0.550 1.00 0.24 C ATOM 178 C VAL A 11 -6.309 -1.793 0.130 1.00 12.22 C ATOM 179 O VAL A 11 -6.652 -1.782 -1.057 1.00 51.02 O ATOM 180 CB VAL A 11 -3.889 -1.099 0.541 1.00 12.21 C ATOM 181 CG1 VAL A 11 -3.685 -0.542 -0.881 1.00 22.23 C ATOM 182 CG2 VAL A 11 -4.298 0.027 1.531 1.00 42.44 C ATOM 0 H VAL A 11 -4.930 -3.355 -1.263 1.00 21.14 H new ATOM 0 HA VAL A 11 -4.958 -2.701 1.562 1.00 0.24 H new ATOM 0 HB VAL A 11 -2.934 -1.497 0.884 1.00 12.21 H new ATOM 0 HG11 VAL A 11 -2.974 0.283 -0.850 1.00 22.23 H new ATOM 0 HG12 VAL A 11 -3.299 -1.329 -1.528 1.00 22.23 H new ATOM 0 HG13 VAL A 11 -4.638 -0.185 -1.272 1.00 22.23 H new ATOM 0 HG21 VAL A 11 -3.564 0.832 1.490 1.00 42.44 H new ATOM 0 HG22 VAL A 11 -5.278 0.416 1.255 1.00 42.44 H new ATOM 0 HG23 VAL A 11 -4.339 -0.376 2.543 1.00 42.44 H new ATOM 192 N GLY A 12 -7.092 -1.369 1.120 1.00 21.34 N ATOM 193 CA GLY A 12 -8.393 -0.761 0.897 1.00 71.41 C ATOM 194 C GLY A 12 -8.783 0.098 2.079 1.00 63.44 C ATOM 195 O GLY A 12 -8.028 1.001 2.455 1.00 12.31 O ATOM 0 H GLY A 12 -6.836 -1.440 2.105 1.00 21.34 H new ATOM 0 HA2 GLY A 12 -8.368 -0.155 -0.009 1.00 71.41 H new ATOM 0 HA3 GLY A 12 -9.142 -1.537 0.740 1.00 71.41 H new ATOM 199 N GLY A 13 -9.941 -0.191 2.680 1.00 1.34 N ATOM 200 CA GLY A 13 -10.412 0.525 3.861 1.00 14.22 C ATOM 201 C GLY A 13 -11.752 1.174 3.602 1.00 30.11 C ATOM 202 O GLY A 13 -12.438 0.802 2.649 1.00 54.43 O ATOM 0 H GLY A 13 -10.573 -0.925 2.361 1.00 1.34 H new ATOM 0 HA2 GLY A 13 -10.494 -0.165 4.700 1.00 14.22 H new ATOM 0 HA3 GLY A 13 -9.684 1.285 4.144 1.00 14.22 H new ATOM 206 N GLU A 14 -12.106 2.161 4.431 1.00 3.03 N ATOM 207 CA GLU A 14 -13.421 2.823 4.397 1.00 22.22 C ATOM 208 C GLU A 14 -13.369 4.088 3.541 1.00 3.05 C ATOM 209 O GLU A 14 -12.380 4.836 3.558 1.00 3.44 O ATOM 210 CB GLU A 14 -13.868 3.132 5.841 1.00 3.43 C ATOM 211 CG GLU A 14 -14.041 1.860 6.695 1.00 50.25 C ATOM 212 CD GLU A 14 -14.054 2.123 8.206 1.00 5.44 C ATOM 213 OE1 GLU A 14 -13.052 2.660 8.725 1.00 55.53 O ATOM 214 OE2 GLU A 14 -15.054 1.796 8.878 1.00 22.31 O ATOM 0 H GLU A 14 -11.485 2.529 5.152 1.00 3.03 H new ATOM 0 HA GLU A 14 -14.153 2.158 3.939 1.00 22.22 H new ATOM 0 HB2 GLU A 14 -13.133 3.784 6.313 1.00 3.43 H new ATOM 0 HB3 GLU A 14 -14.810 3.679 5.816 1.00 3.43 H new ATOM 0 HG2 GLU A 14 -14.973 1.369 6.414 1.00 50.25 H new ATOM 0 HG3 GLU A 14 -13.233 1.166 6.464 1.00 50.25 H new ATOM 221 N LEU A 15 -14.443 4.279 2.769 1.00 55.51 N ATOM 222 CA LEU A 15 -14.600 5.372 1.809 1.00 20.13 C ATOM 223 C LEU A 15 -15.721 6.323 2.275 1.00 43.00 C ATOM 224 O LEU A 15 -16.580 5.949 3.085 1.00 25.40 O ATOM 225 CB LEU A 15 -14.924 4.795 0.392 1.00 14.30 C ATOM 226 CG LEU A 15 -13.780 4.010 -0.351 1.00 10.30 C ATOM 227 CD1 LEU A 15 -12.504 4.828 -0.435 1.00 72.32 C ATOM 228 CD2 LEU A 15 -13.477 2.641 0.261 1.00 1.41 C ATOM 0 H LEU A 15 -15.251 3.657 2.797 1.00 55.51 H new ATOM 0 HA LEU A 15 -13.668 5.935 1.750 1.00 20.13 H new ATOM 0 HB2 LEU A 15 -15.782 4.129 0.488 1.00 14.30 H new ATOM 0 HB3 LEU A 15 -15.233 5.623 -0.246 1.00 14.30 H new ATOM 0 HG LEU A 15 -14.164 3.834 -1.356 1.00 10.30 H new ATOM 0 HD11 LEU A 15 -11.737 4.253 -0.954 1.00 72.32 H new ATOM 0 HD12 LEU A 15 -12.699 5.751 -0.982 1.00 72.32 H new ATOM 0 HD13 LEU A 15 -12.159 5.068 0.571 1.00 72.32 H new ATOM 0 HD21 LEU A 15 -12.679 2.159 -0.303 1.00 1.41 H new ATOM 0 HD22 LEU A 15 -13.164 2.767 1.297 1.00 1.41 H new ATOM 0 HD23 LEU A 15 -14.372 2.020 0.225 1.00 1.41 H new ATOM 240 N LYS A 16 -15.671 7.565 1.786 1.00 63.40 N ATOM 241 CA LYS A 16 -16.740 8.565 1.999 1.00 12.23 C ATOM 242 C LYS A 16 -17.984 8.228 1.155 1.00 72.14 C ATOM 243 O LYS A 16 -19.108 8.564 1.534 1.00 44.13 O ATOM 244 CB LYS A 16 -16.234 9.996 1.654 1.00 44.41 C ATOM 245 CG LYS A 16 -15.165 10.540 2.624 1.00 22.43 C ATOM 246 CD LYS A 16 -14.628 11.940 2.233 1.00 53.44 C ATOM 247 CE LYS A 16 -13.878 11.935 0.897 1.00 22.10 C ATOM 248 NZ LYS A 16 -13.283 13.258 0.575 1.00 31.04 N ATOM 0 H LYS A 16 -14.890 7.913 1.230 1.00 63.40 H new ATOM 0 HA LYS A 16 -17.017 8.537 3.053 1.00 12.23 H new ATOM 0 HB2 LYS A 16 -15.823 9.990 0.644 1.00 44.41 H new ATOM 0 HB3 LYS A 16 -17.084 10.678 1.648 1.00 44.41 H new ATOM 0 HG2 LYS A 16 -15.588 10.590 3.627 1.00 22.43 H new ATOM 0 HG3 LYS A 16 -14.332 9.838 2.664 1.00 22.43 H new ATOM 0 HD2 LYS A 16 -15.461 12.641 2.174 1.00 53.44 H new ATOM 0 HD3 LYS A 16 -13.962 12.301 3.017 1.00 53.44 H new ATOM 0 HE2 LYS A 16 -13.089 11.183 0.929 1.00 22.10 H new ATOM 0 HE3 LYS A 16 -14.563 11.644 0.100 1.00 22.10 H new ATOM 0 HZ1 LYS A 16 -12.379 13.121 0.080 1.00 31.04 H new ATOM 0 HZ2 LYS A 16 -13.934 13.792 -0.035 1.00 31.04 H new ATOM 0 HZ3 LYS A 16 -13.119 13.788 1.455 1.00 31.04 H new ATOM 262 N ASP A 17 -17.769 7.542 0.023 1.00 44.41 N ATOM 263 CA ASP A 17 -18.826 7.263 -0.973 1.00 44.23 C ATOM 264 C ASP A 17 -19.056 5.736 -1.087 1.00 12.53 C ATOM 265 O ASP A 17 -18.214 4.945 -0.645 1.00 0.44 O ATOM 266 CB ASP A 17 -18.408 7.880 -2.344 1.00 42.12 C ATOM 267 CG ASP A 17 -19.559 7.915 -3.368 1.00 51.13 C ATOM 268 OD1 ASP A 17 -19.750 6.928 -4.117 1.00 12.25 O ATOM 269 OD2 ASP A 17 -20.307 8.914 -3.394 1.00 20.13 O ATOM 0 H ASP A 17 -16.857 7.162 -0.233 1.00 44.41 H new ATOM 0 HA ASP A 17 -19.766 7.716 -0.659 1.00 44.23 H new ATOM 0 HB2 ASP A 17 -18.042 8.894 -2.183 1.00 42.12 H new ATOM 0 HB3 ASP A 17 -17.580 7.304 -2.757 1.00 42.12 H new ATOM 274 N VAL A 18 -20.203 5.342 -1.679 1.00 54.34 N ATOM 275 CA VAL A 18 -20.594 3.927 -1.868 1.00 25.44 C ATOM 276 C VAL A 18 -19.673 3.200 -2.869 1.00 71.34 C ATOM 277 O VAL A 18 -19.209 2.090 -2.596 1.00 33.14 O ATOM 278 CB VAL A 18 -22.102 3.791 -2.318 1.00 11.34 C ATOM 279 CG1 VAL A 18 -23.052 4.138 -1.154 1.00 33.04 C ATOM 280 CG2 VAL A 18 -22.425 4.668 -3.558 1.00 55.14 C ATOM 0 H VAL A 18 -20.890 6.002 -2.043 1.00 54.34 H new ATOM 0 HA VAL A 18 -20.481 3.447 -0.896 1.00 25.44 H new ATOM 0 HB VAL A 18 -22.257 2.751 -2.604 1.00 11.34 H new ATOM 0 HG11 VAL A 18 -24.085 4.038 -1.486 1.00 33.04 H new ATOM 0 HG12 VAL A 18 -22.871 3.458 -0.321 1.00 33.04 H new ATOM 0 HG13 VAL A 18 -22.872 5.163 -0.831 1.00 33.04 H new ATOM 0 HG21 VAL A 18 -23.473 4.541 -3.830 1.00 55.14 H new ATOM 0 HG22 VAL A 18 -22.235 5.715 -3.322 1.00 55.14 H new ATOM 0 HG23 VAL A 18 -21.794 4.364 -4.393 1.00 55.14 H new ATOM 290 N ALA A 19 -19.419 3.840 -4.017 1.00 74.44 N ATOM 291 CA ALA A 19 -18.618 3.259 -5.115 1.00 10.34 C ATOM 292 C ALA A 19 -17.288 4.006 -5.274 1.00 35.23 C ATOM 293 O ALA A 19 -16.300 3.430 -5.757 1.00 63.41 O ATOM 294 CB ALA A 19 -19.420 3.305 -6.424 1.00 72.12 C ATOM 0 H ALA A 19 -19.762 4.780 -4.217 1.00 74.44 H new ATOM 0 HA ALA A 19 -18.393 2.221 -4.872 1.00 10.34 H new ATOM 0 HB1 ALA A 19 -18.825 2.876 -7.230 1.00 72.12 H new ATOM 0 HB2 ALA A 19 -20.340 2.733 -6.307 1.00 72.12 H new ATOM 0 HB3 ALA A 19 -19.664 4.340 -6.665 1.00 72.12 H new ATOM 300 N GLY A 20 -17.291 5.290 -4.854 1.00 72.04 N ATOM 301 CA GLY A 20 -16.145 6.191 -5.010 1.00 14.41 C ATOM 302 C GLY A 20 -14.955 5.794 -4.152 1.00 1.53 C ATOM 303 O GLY A 20 -15.133 5.293 -3.040 1.00 4.31 O ATOM 0 H GLY A 20 -18.093 5.724 -4.397 1.00 72.04 H new ATOM 0 HA2 GLY A 20 -15.842 6.206 -6.057 1.00 14.41 H new ATOM 0 HA3 GLY A 20 -16.450 7.205 -4.752 1.00 14.41 H new ATOM 307 N VAL A 21 -13.738 6.062 -4.660 1.00 13.11 N ATOM 308 CA VAL A 21 -12.471 5.632 -4.033 1.00 2.51 C ATOM 309 C VAL A 21 -11.849 6.770 -3.172 1.00 55.30 C ATOM 310 O VAL A 21 -10.640 6.802 -2.893 1.00 71.51 O ATOM 311 CB VAL A 21 -11.478 5.119 -5.147 1.00 52.04 C ATOM 312 CG1 VAL A 21 -10.927 6.266 -6.035 1.00 61.01 C ATOM 313 CG2 VAL A 21 -10.351 4.257 -4.539 1.00 24.44 C ATOM 0 H VAL A 21 -13.603 6.587 -5.524 1.00 13.11 H new ATOM 0 HA VAL A 21 -12.674 4.807 -3.350 1.00 2.51 H new ATOM 0 HB VAL A 21 -12.055 4.479 -5.815 1.00 52.04 H new ATOM 0 HG11 VAL A 21 -10.250 5.854 -6.783 1.00 61.01 H new ATOM 0 HG12 VAL A 21 -11.755 6.770 -6.534 1.00 61.01 H new ATOM 0 HG13 VAL A 21 -10.389 6.981 -5.413 1.00 61.01 H new ATOM 0 HG21 VAL A 21 -9.684 3.919 -5.332 1.00 24.44 H new ATOM 0 HG22 VAL A 21 -9.788 4.850 -3.819 1.00 24.44 H new ATOM 0 HG23 VAL A 21 -10.785 3.392 -4.037 1.00 24.44 H new ATOM 323 N GLU A 22 -12.722 7.647 -2.667 1.00 44.34 N ATOM 324 CA GLU A 22 -12.336 8.778 -1.819 1.00 14.15 C ATOM 325 C GLU A 22 -12.235 8.322 -0.352 1.00 60.15 C ATOM 326 O GLU A 22 -13.239 8.299 0.362 1.00 75.53 O ATOM 327 CB GLU A 22 -13.370 9.918 -1.988 1.00 32.54 C ATOM 328 CG GLU A 22 -13.547 10.413 -3.434 1.00 41.31 C ATOM 329 CD GLU A 22 -12.248 10.972 -4.043 1.00 75.31 C ATOM 330 OE1 GLU A 22 -11.960 12.165 -3.844 1.00 40.54 O ATOM 331 OE2 GLU A 22 -11.513 10.222 -4.721 1.00 43.41 O ATOM 0 H GLU A 22 -13.726 7.591 -2.837 1.00 44.34 H new ATOM 0 HA GLU A 22 -11.357 9.153 -2.119 1.00 14.15 H new ATOM 0 HB2 GLU A 22 -14.335 9.574 -1.615 1.00 32.54 H new ATOM 0 HB3 GLU A 22 -13.069 10.759 -1.364 1.00 32.54 H new ATOM 0 HG2 GLU A 22 -13.907 9.590 -4.052 1.00 41.31 H new ATOM 0 HG3 GLU A 22 -14.314 11.187 -3.456 1.00 41.31 H new ATOM 338 N PHE A 23 -11.018 7.895 0.050 1.00 64.11 N ATOM 339 CA PHE A 23 -10.727 7.355 1.403 1.00 12.53 C ATOM 340 C PHE A 23 -11.236 8.292 2.518 1.00 22.45 C ATOM 341 O PHE A 23 -10.827 9.458 2.597 1.00 62.12 O ATOM 342 CB PHE A 23 -9.207 7.086 1.570 1.00 25.20 C ATOM 343 CG PHE A 23 -8.652 5.969 0.671 1.00 23.23 C ATOM 344 CD1 PHE A 23 -9.247 4.704 0.662 1.00 62.12 C ATOM 345 CD2 PHE A 23 -7.520 6.165 -0.128 1.00 4.31 C ATOM 346 CE1 PHE A 23 -8.738 3.678 -0.122 1.00 14.32 C ATOM 347 CE2 PHE A 23 -7.016 5.138 -0.915 1.00 71.51 C ATOM 348 CZ PHE A 23 -7.622 3.896 -0.909 1.00 72.12 C ATOM 0 H PHE A 23 -10.200 7.914 -0.559 1.00 64.11 H new ATOM 0 HA PHE A 23 -11.263 6.411 1.498 1.00 12.53 H new ATOM 0 HB2 PHE A 23 -8.663 8.007 1.360 1.00 25.20 H new ATOM 0 HB3 PHE A 23 -9.009 6.829 2.611 1.00 25.20 H new ATOM 0 HD1 PHE A 23 -10.117 4.522 1.275 1.00 62.12 H new ATOM 0 HD2 PHE A 23 -7.032 7.128 -0.133 1.00 4.31 H new ATOM 0 HE1 PHE A 23 -9.214 2.709 -0.117 1.00 14.32 H new ATOM 0 HE2 PHE A 23 -6.148 5.310 -1.534 1.00 71.51 H new ATOM 0 HZ PHE A 23 -7.225 3.097 -1.518 1.00 72.12 H new ATOM 358 N ARG A 24 -12.138 7.751 3.364 1.00 5.44 N ATOM 359 CA ARG A 24 -12.811 8.505 4.433 1.00 31.24 C ATOM 360 C ARG A 24 -11.799 9.037 5.453 1.00 72.23 C ATOM 361 O ARG A 24 -11.950 10.153 5.959 1.00 20.50 O ATOM 362 CB ARG A 24 -13.903 7.634 5.128 1.00 12.43 C ATOM 363 CG ARG A 24 -14.815 8.417 6.105 1.00 63.15 C ATOM 364 CD ARG A 24 -15.987 7.586 6.662 1.00 23.23 C ATOM 365 NE ARG A 24 -16.853 8.404 7.537 1.00 75.11 N ATOM 366 CZ ARG A 24 -18.105 8.099 7.908 1.00 42.44 C ATOM 367 NH1 ARG A 24 -18.687 6.978 7.500 1.00 51.35 N ATOM 368 NH2 ARG A 24 -18.788 8.938 8.672 1.00 32.11 N ATOM 0 H ARG A 24 -12.419 6.771 3.321 1.00 5.44 H new ATOM 0 HA ARG A 24 -13.306 9.362 3.977 1.00 31.24 H new ATOM 0 HB2 ARG A 24 -14.524 7.171 4.361 1.00 12.43 H new ATOM 0 HB3 ARG A 24 -13.415 6.826 5.673 1.00 12.43 H new ATOM 0 HG2 ARG A 24 -14.212 8.781 6.937 1.00 63.15 H new ATOM 0 HG3 ARG A 24 -15.214 9.293 5.593 1.00 63.15 H new ATOM 0 HD2 ARG A 24 -16.575 7.183 5.837 1.00 23.23 H new ATOM 0 HD3 ARG A 24 -15.599 6.735 7.222 1.00 23.23 H new ATOM 0 HE ARG A 24 -16.464 9.278 7.890 1.00 75.11 H new ATOM 0 HH11 ARG A 24 -18.181 6.332 6.894 1.00 51.35 H new ATOM 0 HH12 ARG A 24 -19.640 6.763 7.792 1.00 51.35 H new ATOM 0 HH21 ARG A 24 -18.361 9.813 8.976 1.00 32.11 H new ATOM 0 HH22 ARG A 24 -19.741 8.709 8.956 1.00 32.11 H new ATOM 382 N ASP A 25 -10.763 8.235 5.724 1.00 73.13 N ATOM 383 CA ASP A 25 -9.657 8.639 6.585 1.00 45.01 C ATOM 384 C ASP A 25 -8.432 7.783 6.269 1.00 34.30 C ATOM 385 O ASP A 25 -8.545 6.574 6.054 1.00 21.23 O ATOM 386 CB ASP A 25 -10.052 8.551 8.077 1.00 54.23 C ATOM 387 CG ASP A 25 -8.986 9.121 9.019 1.00 11.44 C ATOM 388 OD1 ASP A 25 -8.781 10.354 9.016 1.00 22.25 O ATOM 389 OD2 ASP A 25 -8.339 8.343 9.746 1.00 53.34 O ATOM 0 H ASP A 25 -10.672 7.290 5.351 1.00 73.13 H new ATOM 0 HA ASP A 25 -9.410 9.682 6.389 1.00 45.01 H new ATOM 0 HB2 ASP A 25 -10.988 9.088 8.231 1.00 54.23 H new ATOM 0 HB3 ASP A 25 -10.237 7.509 8.336 1.00 54.23 H new ATOM 394 N LEU A 26 -7.268 8.436 6.237 1.00 32.41 N ATOM 395 CA LEU A 26 -5.999 7.836 5.811 1.00 25.10 C ATOM 396 C LEU A 26 -5.308 7.049 6.938 1.00 62.15 C ATOM 397 O LEU A 26 -4.261 6.442 6.719 1.00 34.44 O ATOM 398 CB LEU A 26 -5.074 8.938 5.226 1.00 55.01 C ATOM 399 CG LEU A 26 -5.578 9.641 3.919 1.00 21.12 C ATOM 400 CD1 LEU A 26 -5.938 8.619 2.824 1.00 40.42 C ATOM 401 CD2 LEU A 26 -6.739 10.622 4.186 1.00 14.23 C ATOM 0 H LEU A 26 -7.178 9.414 6.511 1.00 32.41 H new ATOM 0 HA LEU A 26 -6.215 7.105 5.032 1.00 25.10 H new ATOM 0 HB2 LEU A 26 -4.924 9.701 5.990 1.00 55.01 H new ATOM 0 HB3 LEU A 26 -4.099 8.495 5.023 1.00 55.01 H new ATOM 0 HG LEU A 26 -4.745 10.238 3.548 1.00 21.12 H new ATOM 0 HD11 LEU A 26 -6.283 9.146 1.934 1.00 40.42 H new ATOM 0 HD12 LEU A 26 -5.058 8.026 2.576 1.00 40.42 H new ATOM 0 HD13 LEU A 26 -6.728 7.961 3.186 1.00 40.42 H new ATOM 0 HD21 LEU A 26 -7.050 11.082 3.248 1.00 14.23 H new ATOM 0 HD22 LEU A 26 -7.579 10.081 4.621 1.00 14.23 H new ATOM 0 HD23 LEU A 26 -6.409 11.397 4.878 1.00 14.23 H new ATOM 413 N SER A 27 -5.882 7.080 8.146 1.00 10.44 N ATOM 414 CA SER A 27 -5.523 6.143 9.226 1.00 3.32 C ATOM 415 C SER A 27 -6.467 4.917 9.166 1.00 43.43 C ATOM 416 O SER A 27 -6.115 3.827 9.624 1.00 74.25 O ATOM 417 CB SER A 27 -5.604 6.862 10.595 1.00 10.53 C ATOM 418 OG SER A 27 -5.264 6.006 11.673 1.00 53.10 O ATOM 0 H SER A 27 -6.606 7.750 8.406 1.00 10.44 H new ATOM 0 HA SER A 27 -4.498 5.794 9.098 1.00 3.32 H new ATOM 0 HB2 SER A 27 -4.934 7.722 10.592 1.00 10.53 H new ATOM 0 HB3 SER A 27 -6.614 7.245 10.743 1.00 10.53 H new ATOM 0 HG SER A 27 -5.327 6.501 12.516 1.00 53.10 H new ATOM 424 N LYS A 28 -7.660 5.108 8.552 1.00 70.34 N ATOM 425 CA LYS A 28 -8.683 4.046 8.388 1.00 60.32 C ATOM 426 C LYS A 28 -8.497 3.273 7.067 1.00 55.34 C ATOM 427 O LYS A 28 -9.328 2.417 6.732 1.00 22.12 O ATOM 428 CB LYS A 28 -10.113 4.659 8.445 1.00 4.41 C ATOM 429 CG LYS A 28 -10.446 5.392 9.760 1.00 40.15 C ATOM 430 CD LYS A 28 -10.435 4.470 10.999 1.00 53.30 C ATOM 431 CE LYS A 28 -10.779 5.235 12.287 1.00 62.34 C ATOM 432 NZ LYS A 28 -10.764 4.363 13.484 1.00 60.32 N ATOM 0 H LYS A 28 -7.941 6.005 8.156 1.00 70.34 H new ATOM 0 HA LYS A 28 -8.557 3.341 9.210 1.00 60.32 H new ATOM 0 HB2 LYS A 28 -10.228 5.357 7.616 1.00 4.41 H new ATOM 0 HB3 LYS A 28 -10.842 3.863 8.294 1.00 4.41 H new ATOM 0 HG2 LYS A 28 -9.727 6.197 9.910 1.00 40.15 H new ATOM 0 HG3 LYS A 28 -11.429 5.855 9.670 1.00 40.15 H new ATOM 0 HD2 LYS A 28 -11.151 3.661 10.855 1.00 53.30 H new ATOM 0 HD3 LYS A 28 -9.452 4.011 11.101 1.00 53.30 H new ATOM 0 HE2 LYS A 28 -10.066 6.048 12.425 1.00 62.34 H new ATOM 0 HE3 LYS A 28 -11.765 5.689 12.184 1.00 62.34 H new ATOM 0 HZ1 LYS A 28 -11.002 4.925 14.326 1.00 60.32 H new ATOM 0 HZ2 LYS A 28 -11.462 3.601 13.367 1.00 60.32 H new ATOM 0 HZ3 LYS A 28 -9.817 3.949 13.600 1.00 60.32 H new ATOM 446 N VAL A 29 -7.423 3.580 6.308 1.00 42.12 N ATOM 447 CA VAL A 29 -7.066 2.794 5.116 1.00 42.33 C ATOM 448 C VAL A 29 -6.452 1.453 5.579 1.00 21.23 C ATOM 449 O VAL A 29 -5.316 1.391 6.065 1.00 74.41 O ATOM 450 CB VAL A 29 -6.117 3.575 4.112 1.00 22.21 C ATOM 451 CG1 VAL A 29 -6.833 4.820 3.554 1.00 31.24 C ATOM 452 CG2 VAL A 29 -4.764 3.973 4.745 1.00 63.03 C ATOM 0 H VAL A 29 -6.795 4.361 6.500 1.00 42.12 H new ATOM 0 HA VAL A 29 -7.973 2.603 4.542 1.00 42.33 H new ATOM 0 HB VAL A 29 -5.892 2.887 3.297 1.00 22.21 H new ATOM 0 HG11 VAL A 29 -6.169 5.344 2.867 1.00 31.24 H new ATOM 0 HG12 VAL A 29 -7.735 4.514 3.024 1.00 31.24 H new ATOM 0 HG13 VAL A 29 -7.103 5.484 4.376 1.00 31.24 H new ATOM 0 HG21 VAL A 29 -4.160 4.504 4.009 1.00 63.03 H new ATOM 0 HG22 VAL A 29 -4.941 4.620 5.604 1.00 63.03 H new ATOM 0 HG23 VAL A 29 -4.236 3.076 5.069 1.00 63.03 H new ATOM 462 N GLU A 30 -7.256 0.388 5.518 1.00 53.43 N ATOM 463 CA GLU A 30 -6.852 -0.919 6.018 1.00 35.31 C ATOM 464 C GLU A 30 -5.948 -1.609 4.991 1.00 23.50 C ATOM 465 O GLU A 30 -6.409 -2.017 3.915 1.00 15.30 O ATOM 466 CB GLU A 30 -8.072 -1.806 6.341 1.00 74.03 C ATOM 467 CG GLU A 30 -7.673 -3.169 6.952 1.00 22.41 C ATOM 468 CD GLU A 30 -8.846 -4.134 7.165 1.00 35.31 C ATOM 469 OE1 GLU A 30 -9.892 -3.716 7.704 1.00 33.22 O ATOM 470 OE2 GLU A 30 -8.711 -5.324 6.823 1.00 15.24 O ATOM 0 H GLU A 30 -8.196 0.411 5.123 1.00 53.43 H new ATOM 0 HA GLU A 30 -6.300 -0.771 6.946 1.00 35.31 H new ATOM 0 HB2 GLU A 30 -8.726 -1.279 7.035 1.00 74.03 H new ATOM 0 HB3 GLU A 30 -8.645 -1.975 5.429 1.00 74.03 H new ATOM 0 HG2 GLU A 30 -6.940 -3.645 6.301 1.00 22.41 H new ATOM 0 HG3 GLU A 30 -7.183 -2.995 7.910 1.00 22.41 H new ATOM 477 N PHE A 31 -4.658 -1.692 5.325 1.00 75.14 N ATOM 478 CA PHE A 31 -3.680 -2.467 4.565 1.00 13.24 C ATOM 479 C PHE A 31 -3.958 -3.948 4.813 1.00 61.42 C ATOM 480 O PHE A 31 -3.674 -4.465 5.904 1.00 20.02 O ATOM 481 CB PHE A 31 -2.236 -2.090 4.986 1.00 74.23 C ATOM 482 CG PHE A 31 -1.918 -0.613 4.781 1.00 45.23 C ATOM 483 CD1 PHE A 31 -2.182 0.325 5.779 1.00 63.33 C ATOM 484 CD2 PHE A 31 -1.381 -0.159 3.579 1.00 74.31 C ATOM 485 CE1 PHE A 31 -1.915 1.659 5.578 1.00 13.25 C ATOM 486 CE2 PHE A 31 -1.116 1.177 3.383 1.00 64.33 C ATOM 487 CZ PHE A 31 -1.386 2.084 4.378 1.00 61.13 C ATOM 0 H PHE A 31 -4.262 -1.219 6.137 1.00 75.14 H new ATOM 0 HA PHE A 31 -3.769 -2.248 3.501 1.00 13.24 H new ATOM 0 HB2 PHE A 31 -2.093 -2.344 6.036 1.00 74.23 H new ATOM 0 HB3 PHE A 31 -1.529 -2.690 4.414 1.00 74.23 H new ATOM 0 HD1 PHE A 31 -2.601 0.000 6.720 1.00 63.33 H new ATOM 0 HD2 PHE A 31 -1.170 -0.865 2.790 1.00 74.31 H new ATOM 0 HE1 PHE A 31 -2.120 2.374 6.361 1.00 13.25 H new ATOM 0 HE2 PHE A 31 -0.696 1.512 2.446 1.00 64.33 H new ATOM 0 HZ PHE A 31 -1.183 3.133 4.220 1.00 61.13 H new ATOM 497 N VAL A 32 -4.575 -4.593 3.808 1.00 65.10 N ATOM 498 CA VAL A 32 -4.915 -6.025 3.841 1.00 31.40 C ATOM 499 C VAL A 32 -3.638 -6.863 4.049 1.00 11.14 C ATOM 500 O VAL A 32 -3.660 -7.910 4.706 1.00 43.25 O ATOM 501 CB VAL A 32 -5.646 -6.469 2.520 1.00 64.44 C ATOM 502 CG1 VAL A 32 -6.032 -7.967 2.547 1.00 14.11 C ATOM 503 CG2 VAL A 32 -6.881 -5.584 2.244 1.00 71.51 C ATOM 0 H VAL A 32 -4.854 -4.131 2.943 1.00 65.10 H new ATOM 0 HA VAL A 32 -5.597 -6.193 4.674 1.00 31.40 H new ATOM 0 HB VAL A 32 -4.940 -6.333 1.701 1.00 64.44 H new ATOM 0 HG11 VAL A 32 -6.534 -8.230 1.616 1.00 14.11 H new ATOM 0 HG12 VAL A 32 -5.133 -8.573 2.658 1.00 14.11 H new ATOM 0 HG13 VAL A 32 -6.702 -8.155 3.386 1.00 14.11 H new ATOM 0 HG21 VAL A 32 -7.367 -5.913 1.325 1.00 71.51 H new ATOM 0 HG22 VAL A 32 -7.582 -5.668 3.075 1.00 71.51 H new ATOM 0 HG23 VAL A 32 -6.568 -4.546 2.137 1.00 71.51 H new ATOM 513 N GLY A 33 -2.529 -6.355 3.492 1.00 64.05 N ATOM 514 CA GLY A 33 -1.206 -6.916 3.685 1.00 71.32 C ATOM 515 C GLY A 33 -0.499 -7.096 2.363 1.00 70.50 C ATOM 516 O GLY A 33 -0.546 -6.200 1.504 1.00 13.11 O ATOM 0 H GLY A 33 -2.538 -5.532 2.889 1.00 64.05 H new ATOM 0 HA2 GLY A 33 -0.619 -6.261 4.329 1.00 71.32 H new ATOM 0 HA3 GLY A 33 -1.285 -7.877 4.194 1.00 71.32 H new ATOM 520 N ALA A 34 0.147 -8.248 2.202 1.00 33.33 N ATOM 521 CA ALA A 34 0.874 -8.613 0.984 1.00 54.44 C ATOM 522 C ALA A 34 1.115 -10.128 0.988 1.00 32.00 C ATOM 523 O ALA A 34 1.207 -10.746 2.056 1.00 61.45 O ATOM 524 CB ALA A 34 2.196 -7.845 0.900 1.00 2.41 C ATOM 0 H ALA A 34 0.182 -8.967 2.924 1.00 33.33 H new ATOM 0 HA ALA A 34 0.284 -8.347 0.107 1.00 54.44 H new ATOM 0 HB1 ALA A 34 2.724 -8.128 -0.011 1.00 2.41 H new ATOM 0 HB2 ALA A 34 1.994 -6.774 0.885 1.00 2.41 H new ATOM 0 HB3 ALA A 34 2.812 -8.086 1.766 1.00 2.41 H new ATOM 530 N TYR A 35 1.213 -10.720 -0.209 1.00 21.14 N ATOM 531 CA TYR A 35 1.271 -12.185 -0.398 1.00 71.31 C ATOM 532 C TYR A 35 2.484 -12.563 -1.281 1.00 21.34 C ATOM 533 O TYR A 35 3.029 -11.692 -1.945 1.00 31.00 O ATOM 534 CB TYR A 35 -0.079 -12.659 -1.011 1.00 41.03 C ATOM 535 CG TYR A 35 -1.261 -12.543 -0.034 1.00 34.33 C ATOM 536 CD1 TYR A 35 -1.545 -13.562 0.881 1.00 12.33 C ATOM 537 CD2 TYR A 35 -2.065 -11.400 0.004 1.00 71.04 C ATOM 538 CE1 TYR A 35 -2.586 -13.447 1.782 1.00 3.14 C ATOM 539 CE2 TYR A 35 -3.110 -11.285 0.902 1.00 74.32 C ATOM 540 CZ TYR A 35 -3.363 -12.305 1.792 1.00 40.31 C ATOM 541 OH TYR A 35 -4.401 -12.190 2.694 1.00 24.21 O ATOM 0 H TYR A 35 1.255 -10.197 -1.083 1.00 21.14 H new ATOM 0 HA TYR A 35 1.411 -12.690 0.558 1.00 71.31 H new ATOM 0 HB2 TYR A 35 -0.293 -12.069 -1.902 1.00 41.03 H new ATOM 0 HB3 TYR A 35 0.019 -13.696 -1.331 1.00 41.03 H new ATOM 0 HD1 TYR A 35 -0.939 -14.456 0.883 1.00 12.33 H new ATOM 0 HD2 TYR A 35 -1.866 -10.590 -0.682 1.00 71.04 H new ATOM 0 HE1 TYR A 35 -2.792 -14.248 2.477 1.00 3.14 H new ATOM 0 HE2 TYR A 35 -3.726 -10.398 0.905 1.00 74.32 H new ATOM 0 HH TYR A 35 -4.847 -11.326 2.571 1.00 24.21 H new ATOM 551 N PRO A 36 2.943 -13.863 -1.296 1.00 42.51 N ATOM 552 CA PRO A 36 4.142 -14.286 -2.088 1.00 12.13 C ATOM 553 C PRO A 36 3.916 -14.326 -3.617 1.00 31.01 C ATOM 554 O PRO A 36 4.864 -14.583 -4.375 1.00 64.22 O ATOM 555 CB PRO A 36 4.426 -15.709 -1.539 1.00 74.53 C ATOM 556 CG PRO A 36 3.082 -16.220 -1.114 1.00 64.41 C ATOM 557 CD PRO A 36 2.371 -15.018 -0.530 1.00 54.20 C ATOM 0 HA PRO A 36 4.962 -13.577 -1.974 1.00 12.13 H new ATOM 0 HB2 PRO A 36 4.871 -16.348 -2.302 1.00 74.53 H new ATOM 0 HB3 PRO A 36 5.123 -15.680 -0.702 1.00 74.53 H new ATOM 0 HG2 PRO A 36 2.531 -16.632 -1.960 1.00 64.41 H new ATOM 0 HG3 PRO A 36 3.178 -17.018 -0.377 1.00 64.41 H new ATOM 0 HD2 PRO A 36 1.291 -15.089 -0.659 1.00 54.20 H new ATOM 0 HD3 PRO A 36 2.558 -14.922 0.539 1.00 54.20 H new ATOM 565 N SER A 37 2.671 -14.065 -4.059 1.00 54.12 N ATOM 566 CA SER A 37 2.270 -14.205 -5.470 1.00 34.32 C ATOM 567 C SER A 37 1.114 -13.250 -5.788 1.00 71.22 C ATOM 568 O SER A 37 0.279 -12.960 -4.916 1.00 21.23 O ATOM 569 CB SER A 37 1.863 -15.672 -5.760 1.00 33.44 C ATOM 570 OG SER A 37 1.377 -15.849 -7.076 1.00 34.24 O ATOM 0 H SER A 37 1.917 -13.752 -3.448 1.00 54.12 H new ATOM 0 HA SER A 37 3.115 -13.946 -6.108 1.00 34.32 H new ATOM 0 HB2 SER A 37 2.724 -16.322 -5.604 1.00 33.44 H new ATOM 0 HB3 SER A 37 1.097 -15.981 -5.049 1.00 33.44 H new ATOM 0 HG SER A 37 1.135 -16.789 -7.212 1.00 34.24 H new ATOM 576 N TYR A 38 1.076 -12.783 -7.053 1.00 3.22 N ATOM 577 CA TYR A 38 0.064 -11.838 -7.547 1.00 2.22 C ATOM 578 C TYR A 38 -1.359 -12.404 -7.410 1.00 73.31 C ATOM 579 O TYR A 38 -2.257 -11.682 -7.004 1.00 32.44 O ATOM 580 CB TYR A 38 0.349 -11.450 -9.027 1.00 2.10 C ATOM 581 CG TYR A 38 -0.805 -10.689 -9.723 1.00 10.14 C ATOM 582 CD1 TYR A 38 -1.113 -9.367 -9.383 1.00 64.41 C ATOM 583 CD2 TYR A 38 -1.610 -11.311 -10.684 1.00 71.23 C ATOM 584 CE1 TYR A 38 -2.171 -8.699 -9.977 1.00 42.02 C ATOM 585 CE2 TYR A 38 -2.657 -10.643 -11.282 1.00 41.23 C ATOM 586 CZ TYR A 38 -2.940 -9.344 -10.922 1.00 12.54 C ATOM 587 OH TYR A 38 -4.002 -8.691 -11.508 1.00 13.21 O ATOM 0 H TYR A 38 1.755 -13.056 -7.763 1.00 3.22 H new ATOM 0 HA TYR A 38 0.127 -10.943 -6.929 1.00 2.22 H new ATOM 0 HB2 TYR A 38 1.247 -10.833 -9.062 1.00 2.10 H new ATOM 0 HB3 TYR A 38 0.563 -12.357 -9.593 1.00 2.10 H new ATOM 0 HD1 TYR A 38 -0.514 -8.857 -8.643 1.00 64.41 H new ATOM 0 HD2 TYR A 38 -1.407 -12.335 -10.963 1.00 71.23 H new ATOM 0 HE1 TYR A 38 -2.392 -7.678 -9.701 1.00 42.02 H new ATOM 0 HE2 TYR A 38 -3.255 -11.138 -12.033 1.00 41.23 H new ATOM 0 HH TYR A 38 -4.437 -9.287 -12.152 1.00 13.21 H new ATOM 597 N ASP A 39 -1.543 -13.692 -7.769 1.00 40.13 N ATOM 598 CA ASP A 39 -2.874 -14.328 -7.804 1.00 23.31 C ATOM 599 C ASP A 39 -3.450 -14.484 -6.388 1.00 64.20 C ATOM 600 O ASP A 39 -4.674 -14.451 -6.205 1.00 22.13 O ATOM 601 CB ASP A 39 -2.826 -15.695 -8.538 1.00 4.02 C ATOM 602 CG ASP A 39 -4.235 -16.280 -8.796 1.00 51.50 C ATOM 603 OD1 ASP A 39 -4.943 -15.766 -9.690 1.00 71.00 O ATOM 604 OD2 ASP A 39 -4.658 -17.214 -8.081 1.00 14.33 O ATOM 0 H ASP A 39 -0.781 -14.314 -8.040 1.00 40.13 H new ATOM 0 HA ASP A 39 -3.538 -13.672 -8.366 1.00 23.31 H new ATOM 0 HB2 ASP A 39 -2.307 -15.575 -9.489 1.00 4.02 H new ATOM 0 HB3 ASP A 39 -2.246 -16.402 -7.945 1.00 4.02 H new ATOM 609 N GLU A 40 -2.554 -14.624 -5.391 1.00 5.13 N ATOM 610 CA GLU A 40 -2.938 -14.687 -3.970 1.00 61.25 C ATOM 611 C GLU A 40 -3.510 -13.332 -3.523 1.00 23.33 C ATOM 612 O GLU A 40 -4.537 -13.269 -2.841 1.00 11.34 O ATOM 613 CB GLU A 40 -1.722 -15.059 -3.079 1.00 52.24 C ATOM 614 CG GLU A 40 -0.951 -16.320 -3.494 1.00 44.15 C ATOM 615 CD GLU A 40 -1.815 -17.588 -3.547 1.00 42.21 C ATOM 616 OE1 GLU A 40 -1.987 -18.252 -2.501 1.00 24.23 O ATOM 617 OE2 GLU A 40 -2.324 -17.933 -4.633 1.00 41.02 O ATOM 0 H GLU A 40 -1.549 -14.696 -5.549 1.00 5.13 H new ATOM 0 HA GLU A 40 -3.697 -15.461 -3.857 1.00 61.25 H new ATOM 0 HB2 GLU A 40 -1.029 -14.218 -3.073 1.00 52.24 H new ATOM 0 HB3 GLU A 40 -2.072 -15.191 -2.055 1.00 52.24 H new ATOM 0 HG2 GLU A 40 -0.505 -16.155 -4.475 1.00 44.15 H new ATOM 0 HG3 GLU A 40 -0.131 -16.480 -2.794 1.00 44.15 H new ATOM 624 N ALA A 41 -2.823 -12.248 -3.938 1.00 34.21 N ATOM 625 CA ALA A 41 -3.229 -10.875 -3.635 1.00 75.40 C ATOM 626 C ALA A 41 -4.434 -10.455 -4.501 1.00 5.30 C ATOM 627 O ALA A 41 -5.243 -9.616 -4.095 1.00 53.13 O ATOM 628 CB ALA A 41 -2.038 -9.941 -3.846 1.00 62.53 C ATOM 0 H ALA A 41 -1.970 -12.309 -4.494 1.00 34.21 H new ATOM 0 HA ALA A 41 -3.545 -10.812 -2.594 1.00 75.40 H new ATOM 0 HB1 ALA A 41 -2.335 -8.916 -3.622 1.00 62.53 H new ATOM 0 HB2 ALA A 41 -1.223 -10.236 -3.185 1.00 62.53 H new ATOM 0 HB3 ALA A 41 -1.705 -10.004 -4.882 1.00 62.53 H new ATOM 634 N HIS A 42 -4.558 -11.081 -5.689 1.00 61.50 N ATOM 635 CA HIS A 42 -5.680 -10.844 -6.600 1.00 55.12 C ATOM 636 C HIS A 42 -6.959 -11.324 -5.923 1.00 32.40 C ATOM 637 O HIS A 42 -7.903 -10.565 -5.791 1.00 23.43 O ATOM 638 CB HIS A 42 -5.482 -11.550 -7.975 1.00 11.21 C ATOM 639 CG HIS A 42 -6.679 -11.436 -8.892 1.00 12.52 C ATOM 640 ND1 HIS A 42 -7.203 -12.497 -9.592 1.00 24.34 N ATOM 641 CD2 HIS A 42 -7.467 -10.374 -9.191 1.00 11.14 C ATOM 642 CE1 HIS A 42 -8.251 -12.093 -10.279 1.00 33.31 C ATOM 643 NE2 HIS A 42 -8.434 -10.809 -10.052 1.00 72.33 N ATOM 0 H HIS A 42 -3.882 -11.761 -6.037 1.00 61.50 H new ATOM 0 HA HIS A 42 -5.742 -9.776 -6.811 1.00 55.12 H new ATOM 0 HB2 HIS A 42 -4.612 -11.121 -8.472 1.00 11.21 H new ATOM 0 HB3 HIS A 42 -5.264 -12.604 -7.805 1.00 11.21 H new ATOM 0 HD2 HIS A 42 -7.351 -9.368 -8.817 1.00 11.14 H new ATOM 0 HE1 HIS A 42 -8.859 -12.712 -10.922 1.00 33.31 H new ATOM 0 HE2 HIS A 42 -9.175 -10.234 -10.453 1.00 72.33 H new ATOM 652 N LYS A 43 -6.940 -12.578 -5.449 1.00 10.11 N ATOM 653 CA LYS A 43 -8.086 -13.175 -4.762 1.00 44.11 C ATOM 654 C LYS A 43 -8.412 -12.406 -3.469 1.00 53.11 C ATOM 655 O LYS A 43 -9.582 -12.255 -3.130 1.00 61.13 O ATOM 656 CB LYS A 43 -7.824 -14.669 -4.448 1.00 55.24 C ATOM 657 CG LYS A 43 -9.037 -15.396 -3.818 1.00 50.33 C ATOM 658 CD LYS A 43 -10.278 -15.411 -4.748 1.00 20.24 C ATOM 659 CE LYS A 43 -10.067 -16.274 -6.003 1.00 55.30 C ATOM 660 NZ LYS A 43 -11.286 -16.347 -6.845 1.00 43.24 N ATOM 0 H LYS A 43 -6.135 -13.199 -5.532 1.00 10.11 H new ATOM 0 HA LYS A 43 -8.946 -13.109 -5.428 1.00 44.11 H new ATOM 0 HB2 LYS A 43 -7.543 -15.181 -5.369 1.00 55.24 H new ATOM 0 HB3 LYS A 43 -6.974 -14.745 -3.770 1.00 55.24 H new ATOM 0 HG2 LYS A 43 -8.756 -16.421 -3.578 1.00 50.33 H new ATOM 0 HG3 LYS A 43 -9.299 -14.909 -2.878 1.00 50.33 H new ATOM 0 HD2 LYS A 43 -11.138 -15.787 -4.194 1.00 20.24 H new ATOM 0 HD3 LYS A 43 -10.514 -14.390 -5.049 1.00 20.24 H new ATOM 0 HE2 LYS A 43 -9.246 -15.863 -6.590 1.00 55.30 H new ATOM 0 HE3 LYS A 43 -9.773 -17.280 -5.705 1.00 55.30 H new ATOM 0 HZ1 LYS A 43 -11.097 -16.939 -7.679 1.00 43.24 H new ATOM 0 HZ2 LYS A 43 -12.064 -16.763 -6.294 1.00 43.24 H new ATOM 0 HZ3 LYS A 43 -11.553 -15.390 -7.153 1.00 43.24 H new ATOM 674 N ALA A 44 -7.359 -11.895 -2.793 1.00 11.12 N ATOM 675 CA ALA A 44 -7.486 -11.166 -1.517 1.00 71.20 C ATOM 676 C ALA A 44 -8.387 -9.921 -1.634 1.00 50.10 C ATOM 677 O ALA A 44 -9.083 -9.575 -0.681 1.00 11.53 O ATOM 678 CB ALA A 44 -6.102 -10.779 -0.997 1.00 53.31 C ATOM 0 H ALA A 44 -6.396 -11.978 -3.120 1.00 11.12 H new ATOM 0 HA ALA A 44 -7.968 -11.837 -0.806 1.00 71.20 H new ATOM 0 HB1 ALA A 44 -6.205 -10.241 -0.055 1.00 53.31 H new ATOM 0 HB2 ALA A 44 -5.508 -11.679 -0.838 1.00 53.31 H new ATOM 0 HB3 ALA A 44 -5.605 -10.140 -1.727 1.00 53.31 H new ATOM 684 N TRP A 45 -8.359 -9.278 -2.816 1.00 54.44 N ATOM 685 CA TRP A 45 -9.216 -8.121 -3.155 1.00 22.42 C ATOM 686 C TRP A 45 -10.719 -8.471 -2.958 1.00 44.24 C ATOM 687 O TRP A 45 -11.428 -7.801 -2.200 1.00 12.11 O ATOM 688 CB TRP A 45 -8.872 -7.641 -4.625 1.00 40.33 C ATOM 689 CG TRP A 45 -10.051 -7.297 -5.522 1.00 64.51 C ATOM 690 CD1 TRP A 45 -10.718 -6.106 -5.598 1.00 75.14 C ATOM 691 CD2 TRP A 45 -10.683 -8.168 -6.487 1.00 62.30 C ATOM 692 NE1 TRP A 45 -11.731 -6.192 -6.519 1.00 34.33 N ATOM 693 CE2 TRP A 45 -11.736 -7.445 -7.070 1.00 3.02 C ATOM 694 CE3 TRP A 45 -10.471 -9.492 -6.901 1.00 13.13 C ATOM 695 CZ2 TRP A 45 -12.565 -7.994 -8.040 1.00 3.24 C ATOM 696 CZ3 TRP A 45 -11.295 -10.035 -7.857 1.00 21.33 C ATOM 697 CH2 TRP A 45 -12.332 -9.289 -8.415 1.00 20.54 C ATOM 0 H TRP A 45 -7.733 -9.549 -3.574 1.00 54.44 H new ATOM 0 HA TRP A 45 -9.016 -7.289 -2.479 1.00 22.42 H new ATOM 0 HB2 TRP A 45 -8.229 -6.763 -4.555 1.00 40.33 H new ATOM 0 HB3 TRP A 45 -8.290 -8.424 -5.112 1.00 40.33 H new ATOM 0 HD1 TRP A 45 -10.482 -5.226 -5.018 1.00 75.14 H new ATOM 0 HE1 TRP A 45 -12.379 -5.440 -6.756 1.00 34.33 H new ATOM 0 HE3 TRP A 45 -9.670 -10.077 -6.473 1.00 13.13 H new ATOM 0 HZ2 TRP A 45 -13.365 -7.419 -8.482 1.00 3.24 H new ATOM 0 HZ3 TRP A 45 -11.137 -11.053 -8.180 1.00 21.33 H new ATOM 0 HH2 TRP A 45 -12.967 -9.744 -9.161 1.00 20.54 H new ATOM 708 N LYS A 46 -11.169 -9.549 -3.627 1.00 21.11 N ATOM 709 CA LYS A 46 -12.586 -9.988 -3.614 1.00 61.42 C ATOM 710 C LYS A 46 -12.922 -10.743 -2.326 1.00 52.34 C ATOM 711 O LYS A 46 -14.059 -10.706 -1.861 1.00 71.32 O ATOM 712 CB LYS A 46 -12.866 -10.859 -4.855 1.00 34.42 C ATOM 713 CG LYS A 46 -14.290 -11.437 -4.995 1.00 45.51 C ATOM 714 CD LYS A 46 -14.456 -12.224 -6.318 1.00 70.24 C ATOM 715 CE LYS A 46 -15.879 -12.753 -6.548 1.00 61.02 C ATOM 716 NZ LYS A 46 -16.009 -13.422 -7.875 1.00 14.54 N ATOM 0 H LYS A 46 -10.564 -10.144 -4.193 1.00 21.11 H new ATOM 0 HA LYS A 46 -13.226 -9.107 -3.646 1.00 61.42 H new ATOM 0 HB2 LYS A 46 -12.653 -10.263 -5.743 1.00 34.42 H new ATOM 0 HB3 LYS A 46 -12.161 -11.690 -4.852 1.00 34.42 H new ATOM 0 HG2 LYS A 46 -14.502 -12.093 -4.151 1.00 45.51 H new ATOM 0 HG3 LYS A 46 -15.018 -10.626 -4.959 1.00 45.51 H new ATOM 0 HD2 LYS A 46 -14.179 -11.579 -7.151 1.00 70.24 H new ATOM 0 HD3 LYS A 46 -13.761 -13.064 -6.320 1.00 70.24 H new ATOM 0 HE2 LYS A 46 -16.138 -13.458 -5.758 1.00 61.02 H new ATOM 0 HE3 LYS A 46 -16.589 -11.928 -6.485 1.00 61.02 H new ATOM 0 HZ1 LYS A 46 -16.983 -13.767 -7.996 1.00 14.54 H new ATOM 0 HZ2 LYS A 46 -15.786 -12.742 -8.630 1.00 14.54 H new ATOM 0 HZ3 LYS A 46 -15.349 -14.224 -7.926 1.00 14.54 H new ATOM 730 N ALA A 47 -11.911 -11.398 -1.744 1.00 11.42 N ATOM 731 CA ALA A 47 -12.051 -12.149 -0.492 1.00 3.22 C ATOM 732 C ALA A 47 -12.400 -11.199 0.664 1.00 11.21 C ATOM 733 O ALA A 47 -13.149 -11.551 1.572 1.00 33.51 O ATOM 734 CB ALA A 47 -10.752 -12.914 -0.213 1.00 3.15 C ATOM 0 H ALA A 47 -10.968 -11.422 -2.131 1.00 11.42 H new ATOM 0 HA ALA A 47 -12.865 -12.868 -0.584 1.00 3.22 H new ATOM 0 HB1 ALA A 47 -10.852 -13.474 0.717 1.00 3.15 H new ATOM 0 HB2 ALA A 47 -10.553 -13.605 -1.033 1.00 3.15 H new ATOM 0 HB3 ALA A 47 -9.926 -12.208 -0.125 1.00 3.15 H new ATOM 740 N LYS A 48 -11.844 -9.982 0.589 1.00 54.42 N ATOM 741 CA LYS A 48 -12.134 -8.893 1.522 1.00 43.52 C ATOM 742 C LYS A 48 -13.442 -8.176 1.149 1.00 1.41 C ATOM 743 O LYS A 48 -14.220 -7.812 2.029 1.00 62.33 O ATOM 744 CB LYS A 48 -10.943 -7.910 1.516 1.00 12.20 C ATOM 745 CG LYS A 48 -9.674 -8.443 2.212 1.00 72.22 C ATOM 746 CD LYS A 48 -9.846 -8.605 3.739 1.00 53.30 C ATOM 747 CE LYS A 48 -10.167 -7.271 4.423 1.00 42.22 C ATOM 748 NZ LYS A 48 -10.245 -7.409 5.894 1.00 43.14 N ATOM 0 H LYS A 48 -11.171 -9.726 -0.133 1.00 54.42 H new ATOM 0 HA LYS A 48 -12.269 -9.299 2.524 1.00 43.52 H new ATOM 0 HB2 LYS A 48 -10.699 -7.660 0.483 1.00 12.20 H new ATOM 0 HB3 LYS A 48 -11.249 -6.985 2.004 1.00 12.20 H new ATOM 0 HG2 LYS A 48 -9.406 -9.406 1.778 1.00 72.22 H new ATOM 0 HG3 LYS A 48 -8.845 -7.763 2.015 1.00 72.22 H new ATOM 0 HD2 LYS A 48 -10.645 -9.318 3.941 1.00 53.30 H new ATOM 0 HD3 LYS A 48 -8.933 -9.021 4.165 1.00 53.30 H new ATOM 0 HE2 LYS A 48 -9.401 -6.539 4.167 1.00 42.22 H new ATOM 0 HE3 LYS A 48 -11.114 -6.887 4.044 1.00 42.22 H new ATOM 0 HZ1 LYS A 48 -11.208 -7.181 6.213 1.00 43.14 H new ATOM 0 HZ2 LYS A 48 -10.013 -8.386 6.164 1.00 43.14 H new ATOM 0 HZ3 LYS A 48 -9.569 -6.757 6.340 1.00 43.14 H new ATOM 762 N ALA A 49 -13.673 -8.003 -0.165 1.00 3.45 N ATOM 763 CA ALA A 49 -14.872 -7.315 -0.700 1.00 4.14 C ATOM 764 C ALA A 49 -16.175 -8.080 -0.362 1.00 33.02 C ATOM 765 O ALA A 49 -17.242 -7.477 -0.211 1.00 34.35 O ATOM 766 CB ALA A 49 -14.729 -7.131 -2.219 1.00 62.51 C ATOM 0 H ALA A 49 -13.036 -8.335 -0.890 1.00 3.45 H new ATOM 0 HA ALA A 49 -14.942 -6.337 -0.223 1.00 4.14 H new ATOM 0 HB1 ALA A 49 -15.612 -6.625 -2.609 1.00 62.51 H new ATOM 0 HB2 ALA A 49 -13.844 -6.531 -2.431 1.00 62.51 H new ATOM 0 HB3 ALA A 49 -14.629 -8.106 -2.696 1.00 62.51 H new ATOM 772 N GLN A 50 -16.061 -9.412 -0.259 1.00 20.32 N ATOM 773 CA GLN A 50 -17.174 -10.307 0.109 1.00 61.31 C ATOM 774 C GLN A 50 -17.310 -10.405 1.640 1.00 53.14 C ATOM 775 O GLN A 50 -18.415 -10.596 2.165 1.00 71.53 O ATOM 776 CB GLN A 50 -16.944 -11.722 -0.499 1.00 70.23 C ATOM 777 CG GLN A 50 -17.046 -11.796 -2.037 1.00 21.22 C ATOM 778 CD GLN A 50 -16.651 -13.154 -2.628 1.00 43.21 C ATOM 779 OE1 GLN A 50 -17.211 -13.596 -3.638 1.00 2.52 O ATOM 780 NE2 GLN A 50 -15.652 -13.806 -2.046 1.00 64.33 N ATOM 0 H GLN A 50 -15.185 -9.906 -0.430 1.00 20.32 H new ATOM 0 HA GLN A 50 -18.098 -9.892 -0.293 1.00 61.31 H new ATOM 0 HB2 GLN A 50 -15.957 -12.074 -0.198 1.00 70.23 H new ATOM 0 HB3 GLN A 50 -17.673 -12.409 -0.068 1.00 70.23 H new ATOM 0 HG2 GLN A 50 -18.070 -11.567 -2.333 1.00 21.22 H new ATOM 0 HG3 GLN A 50 -16.409 -11.025 -2.470 1.00 21.22 H new ATOM 0 HE21 GLN A 50 -15.207 -13.419 -1.214 1.00 64.33 H new ATOM 0 HE22 GLN A 50 -15.329 -14.694 -2.431 1.00 64.33 H new ATOM 789 N ALA A 51 -16.171 -10.276 2.346 1.00 41.44 N ATOM 790 CA ALA A 51 -16.108 -10.456 3.808 1.00 32.44 C ATOM 791 C ALA A 51 -16.693 -9.246 4.553 1.00 40.31 C ATOM 792 O ALA A 51 -17.570 -9.404 5.409 1.00 53.32 O ATOM 793 CB ALA A 51 -14.657 -10.716 4.242 1.00 5.31 C ATOM 0 H ALA A 51 -15.273 -10.045 1.921 1.00 41.44 H new ATOM 0 HA ALA A 51 -16.717 -11.321 4.070 1.00 32.44 H new ATOM 0 HB1 ALA A 51 -14.619 -10.848 5.323 1.00 5.31 H new ATOM 0 HB2 ALA A 51 -14.287 -11.617 3.753 1.00 5.31 H new ATOM 0 HB3 ALA A 51 -14.035 -9.867 3.958 1.00 5.31 H new ATOM 799 N THR A 52 -16.245 -8.039 4.171 1.00 34.01 N ATOM 800 CA THR A 52 -16.497 -6.793 4.928 1.00 42.45 C ATOM 801 C THR A 52 -17.801 -6.085 4.483 1.00 61.40 C ATOM 802 O THR A 52 -17.897 -4.847 4.512 1.00 31.42 O ATOM 803 CB THR A 52 -15.277 -5.838 4.771 1.00 3.35 C ATOM 804 OG1 THR A 52 -15.104 -5.508 3.382 1.00 35.32 O ATOM 805 CG2 THR A 52 -13.977 -6.468 5.306 1.00 24.40 C ATOM 0 H THR A 52 -15.695 -7.895 3.324 1.00 34.01 H new ATOM 0 HA THR A 52 -16.628 -7.059 5.977 1.00 42.45 H new ATOM 0 HB THR A 52 -15.481 -4.942 5.356 1.00 3.35 H new ATOM 0 HG1 THR A 52 -14.705 -6.270 2.912 1.00 35.32 H new ATOM 0 HG21 THR A 52 -13.153 -5.767 5.176 1.00 24.40 H new ATOM 0 HG22 THR A 52 -14.094 -6.699 6.365 1.00 24.40 H new ATOM 0 HG23 THR A 52 -13.764 -7.385 4.756 1.00 24.40 H new ATOM 813 N VAL A 53 -18.813 -6.888 4.125 1.00 41.43 N ATOM 814 CA VAL A 53 -20.134 -6.393 3.687 1.00 2.24 C ATOM 815 C VAL A 53 -20.923 -5.734 4.840 1.00 32.35 C ATOM 816 O VAL A 53 -21.780 -4.875 4.601 1.00 5.44 O ATOM 817 CB VAL A 53 -20.986 -7.543 3.035 1.00 60.51 C ATOM 818 CG1 VAL A 53 -20.409 -7.942 1.659 1.00 32.42 C ATOM 819 CG2 VAL A 53 -21.089 -8.778 3.971 1.00 42.20 C ATOM 0 H VAL A 53 -18.742 -7.905 4.130 1.00 41.43 H new ATOM 0 HA VAL A 53 -19.945 -5.627 2.935 1.00 2.24 H new ATOM 0 HB VAL A 53 -21.995 -7.160 2.885 1.00 60.51 H new ATOM 0 HG11 VAL A 53 -21.015 -8.739 1.228 1.00 32.42 H new ATOM 0 HG12 VAL A 53 -20.420 -7.078 0.995 1.00 32.42 H new ATOM 0 HG13 VAL A 53 -19.384 -8.292 1.782 1.00 32.42 H new ATOM 0 HG21 VAL A 53 -21.685 -9.552 3.488 1.00 42.20 H new ATOM 0 HG22 VAL A 53 -20.090 -9.164 4.176 1.00 42.20 H new ATOM 0 HG23 VAL A 53 -21.564 -8.486 4.907 1.00 42.20 H new ATOM 829 N ASP A 54 -20.631 -6.156 6.079 1.00 71.11 N ATOM 830 CA ASP A 54 -21.249 -5.590 7.300 1.00 22.30 C ATOM 831 C ASP A 54 -20.592 -4.251 7.687 1.00 24.44 C ATOM 832 O ASP A 54 -21.192 -3.462 8.431 1.00 64.54 O ATOM 833 CB ASP A 54 -21.146 -6.588 8.485 1.00 14.22 C ATOM 834 CG ASP A 54 -21.898 -7.906 8.240 1.00 2.00 C ATOM 835 OD1 ASP A 54 -21.370 -8.779 7.512 1.00 21.02 O ATOM 836 OD2 ASP A 54 -23.024 -8.078 8.761 1.00 61.51 O ATOM 0 H ASP A 54 -19.960 -6.900 6.269 1.00 71.11 H new ATOM 0 HA ASP A 54 -22.301 -5.410 7.080 1.00 22.30 H new ATOM 0 HB2 ASP A 54 -20.095 -6.808 8.675 1.00 14.22 H new ATOM 0 HB3 ASP A 54 -21.541 -6.115 9.384 1.00 14.22 H new ATOM 841 N ASN A 55 -19.353 -4.003 7.204 1.00 1.11 N ATOM 842 CA ASN A 55 -18.660 -2.727 7.413 1.00 24.10 C ATOM 843 C ASN A 55 -19.181 -1.700 6.391 1.00 51.13 C ATOM 844 O ASN A 55 -19.495 -2.066 5.251 1.00 2.52 O ATOM 845 CB ASN A 55 -17.123 -2.906 7.261 1.00 1.13 C ATOM 846 CG ASN A 55 -16.340 -1.700 7.792 1.00 23.01 C ATOM 847 OD1 ASN A 55 -16.274 -0.638 7.019 1.00 1.24 O flip ATOM 848 ND2 ASN A 55 -15.847 -1.704 8.920 1.00 60.15 N flip ATOM 0 H ASN A 55 -18.816 -4.681 6.664 1.00 1.11 H new ATOM 0 HA ASN A 55 -18.859 -2.371 8.424 1.00 24.10 H new ATOM 0 HB2 ASN A 55 -16.810 -3.803 7.795 1.00 1.13 H new ATOM 0 HB3 ASN A 55 -16.880 -3.060 6.210 1.00 1.13 H new ATOM 0 HD21 ASN A 55 -15.911 -2.540 9.501 1.00 60.15 H new ATOM 0 HD22 ASN A 55 -15.375 -0.872 9.273 1.00 60.15 H new ATOM 855 N ALA A 56 -19.246 -0.425 6.799 1.00 71.25 N ATOM 856 CA ALA A 56 -19.740 0.678 5.956 1.00 62.32 C ATOM 857 C ALA A 56 -18.642 1.183 4.995 1.00 65.34 C ATOM 858 O ALA A 56 -17.566 1.607 5.443 1.00 3.00 O ATOM 859 CB ALA A 56 -20.250 1.817 6.851 1.00 75.04 C ATOM 0 H ALA A 56 -18.956 -0.126 7.730 1.00 71.25 H new ATOM 0 HA ALA A 56 -20.562 0.309 5.343 1.00 62.32 H new ATOM 0 HB1 ALA A 56 -20.616 2.633 6.228 1.00 75.04 H new ATOM 0 HB2 ALA A 56 -21.061 1.450 7.481 1.00 75.04 H new ATOM 0 HB3 ALA A 56 -19.436 2.177 7.480 1.00 75.04 H new ATOM 865 N HIS A 57 -18.930 1.083 3.675 1.00 14.42 N ATOM 866 CA HIS A 57 -18.105 1.655 2.580 1.00 52.14 C ATOM 867 C HIS A 57 -16.670 1.092 2.550 1.00 55.00 C ATOM 868 O HIS A 57 -15.765 1.746 2.047 1.00 61.24 O ATOM 869 CB HIS A 57 -18.065 3.207 2.665 1.00 30.40 C ATOM 870 CG HIS A 57 -19.395 3.889 2.461 1.00 62.14 C ATOM 871 ND1 HIS A 57 -20.444 3.575 1.667 1.00 63.14 N flip ATOM 872 CD2 HIS A 57 -19.749 5.055 3.099 1.00 15.33 C flip ATOM 873 CE1 HIS A 57 -21.397 4.541 1.841 1.00 41.23 C flip ATOM 874 NE2 HIS A 57 -20.952 5.420 2.711 1.00 61.52 N flip ATOM 0 H HIS A 57 -19.757 0.594 3.334 1.00 14.42 H new ATOM 0 HA HIS A 57 -18.588 1.356 1.650 1.00 52.14 H new ATOM 0 HB2 HIS A 57 -17.673 3.493 3.641 1.00 30.40 H new ATOM 0 HB3 HIS A 57 -17.364 3.579 1.918 1.00 30.40 H new ATOM 0 HD2 HIS A 57 -19.134 5.589 3.809 1.00 15.33 H new ATOM 0 HE1 HIS A 57 -22.356 4.576 1.346 1.00 41.23 H new ATOM 0 HE2 HIS A 57 -21.455 6.247 3.032 1.00 61.52 H new ATOM 883 N ALA A 58 -16.474 -0.125 3.067 1.00 64.03 N ATOM 884 CA ALA A 58 -15.155 -0.767 3.091 1.00 41.14 C ATOM 885 C ALA A 58 -14.901 -1.490 1.763 1.00 60.24 C ATOM 886 O ALA A 58 -15.359 -2.620 1.555 1.00 11.14 O ATOM 887 CB ALA A 58 -15.019 -1.724 4.277 1.00 11.50 C ATOM 0 H ALA A 58 -17.218 -0.689 3.478 1.00 64.03 H new ATOM 0 HA ALA A 58 -14.398 0.007 3.217 1.00 41.14 H new ATOM 0 HB1 ALA A 58 -14.030 -2.182 4.264 1.00 11.50 H new ATOM 0 HB2 ALA A 58 -15.151 -1.171 5.207 1.00 11.50 H new ATOM 0 HB3 ALA A 58 -15.780 -2.502 4.206 1.00 11.50 H new ATOM 893 N ARG A 59 -14.189 -0.805 0.863 1.00 42.51 N ATOM 894 CA ARG A 59 -13.838 -1.315 -0.465 1.00 42.11 C ATOM 895 C ARG A 59 -12.341 -1.607 -0.461 1.00 64.45 C ATOM 896 O ARG A 59 -11.538 -0.731 -0.116 1.00 33.53 O ATOM 897 CB ARG A 59 -14.173 -0.277 -1.565 1.00 55.25 C ATOM 898 CG ARG A 59 -15.649 0.160 -1.656 1.00 3.03 C ATOM 899 CD ARG A 59 -16.603 -0.997 -1.985 1.00 72.00 C ATOM 900 NE ARG A 59 -17.947 -0.501 -2.305 1.00 10.41 N ATOM 901 CZ ARG A 59 -18.924 -1.215 -2.877 1.00 0.25 C ATOM 902 NH1 ARG A 59 -18.748 -2.496 -3.210 1.00 65.30 N ATOM 903 NH2 ARG A 59 -20.076 -0.627 -3.146 1.00 10.32 N ATOM 0 H ARG A 59 -13.835 0.135 1.040 1.00 42.51 H new ATOM 0 HA ARG A 59 -14.411 -2.216 -0.682 1.00 42.11 H new ATOM 0 HB2 ARG A 59 -13.562 0.610 -1.398 1.00 55.25 H new ATOM 0 HB3 ARG A 59 -13.877 -0.691 -2.529 1.00 55.25 H new ATOM 0 HG2 ARG A 59 -15.947 0.610 -0.709 1.00 3.03 H new ATOM 0 HG3 ARG A 59 -15.746 0.931 -2.420 1.00 3.03 H new ATOM 0 HD2 ARG A 59 -16.212 -1.566 -2.829 1.00 72.00 H new ATOM 0 HD3 ARG A 59 -16.657 -1.680 -1.137 1.00 72.00 H new ATOM 0 HE ARG A 59 -18.154 0.470 -2.072 1.00 10.41 H new ATOM 0 HH11 ARG A 59 -17.853 -2.952 -3.029 1.00 65.30 H new ATOM 0 HH12 ARG A 59 -19.508 -3.019 -3.645 1.00 65.30 H new ATOM 0 HH21 ARG A 59 -20.211 0.358 -2.918 1.00 10.32 H new ATOM 0 HH22 ARG A 59 -20.830 -1.158 -3.582 1.00 10.32 H new ATOM 917 N TYR A 60 -11.973 -2.842 -0.804 1.00 11.35 N ATOM 918 CA TYR A 60 -10.582 -3.301 -0.788 1.00 70.35 C ATOM 919 C TYR A 60 -10.088 -3.542 -2.207 1.00 32.12 C ATOM 920 O TYR A 60 -10.747 -4.210 -3.008 1.00 42.35 O ATOM 921 CB TYR A 60 -10.446 -4.548 0.105 1.00 12.12 C ATOM 922 CG TYR A 60 -10.796 -4.233 1.562 1.00 31.14 C ATOM 923 CD1 TYR A 60 -12.105 -4.312 2.020 1.00 3.12 C ATOM 924 CD2 TYR A 60 -9.824 -3.807 2.464 1.00 4.13 C ATOM 925 CE1 TYR A 60 -12.424 -3.979 3.308 1.00 10.40 C ATOM 926 CE2 TYR A 60 -10.143 -3.483 3.762 1.00 62.14 C ATOM 927 CZ TYR A 60 -11.450 -3.569 4.181 1.00 24.52 C ATOM 928 OH TYR A 60 -11.791 -3.243 5.474 1.00 32.22 O ATOM 0 H TYR A 60 -12.636 -3.557 -1.103 1.00 11.35 H new ATOM 0 HA TYR A 60 -9.947 -2.526 -0.358 1.00 70.35 H new ATOM 0 HB2 TYR A 60 -11.101 -5.336 -0.266 1.00 12.12 H new ATOM 0 HB3 TYR A 60 -9.426 -4.928 0.048 1.00 12.12 H new ATOM 0 HD1 TYR A 60 -12.884 -4.642 1.348 1.00 3.12 H new ATOM 0 HD2 TYR A 60 -8.798 -3.729 2.137 1.00 4.13 H new ATOM 0 HE1 TYR A 60 -13.450 -4.040 3.639 1.00 10.40 H new ATOM 0 HE2 TYR A 60 -9.372 -3.163 4.448 1.00 62.14 H new ATOM 0 HH TYR A 60 -11.048 -3.465 6.074 1.00 32.22 H new ATOM 938 N PHE A 61 -8.930 -2.951 -2.494 1.00 14.35 N ATOM 939 CA PHE A 61 -8.325 -2.896 -3.825 1.00 52.23 C ATOM 940 C PHE A 61 -6.936 -3.555 -3.788 1.00 23.15 C ATOM 941 O PHE A 61 -6.537 -4.157 -2.779 1.00 35.14 O ATOM 942 CB PHE A 61 -8.201 -1.406 -4.259 1.00 34.40 C ATOM 943 CG PHE A 61 -9.513 -0.615 -4.225 1.00 15.22 C ATOM 944 CD1 PHE A 61 -10.417 -0.702 -5.278 1.00 74.31 C ATOM 945 CD2 PHE A 61 -9.833 0.218 -3.148 1.00 20.11 C ATOM 946 CE1 PHE A 61 -11.598 0.011 -5.264 1.00 53.52 C ATOM 947 CE2 PHE A 61 -11.016 0.933 -3.133 1.00 70.25 C ATOM 948 CZ PHE A 61 -11.898 0.829 -4.194 1.00 52.45 C ATOM 0 H PHE A 61 -8.368 -2.482 -1.784 1.00 14.35 H new ATOM 0 HA PHE A 61 -8.947 -3.433 -4.541 1.00 52.23 H new ATOM 0 HB2 PHE A 61 -7.478 -0.912 -3.609 1.00 34.40 H new ATOM 0 HB3 PHE A 61 -7.797 -1.369 -5.271 1.00 34.40 H new ATOM 0 HD1 PHE A 61 -10.191 -1.338 -6.121 1.00 74.31 H new ATOM 0 HD2 PHE A 61 -9.147 0.304 -2.318 1.00 20.11 H new ATOM 0 HE1 PHE A 61 -12.288 -0.071 -6.091 1.00 53.52 H new ATOM 0 HE2 PHE A 61 -11.251 1.572 -2.295 1.00 70.25 H new ATOM 0 HZ PHE A 61 -12.822 1.388 -4.185 1.00 52.45 H new ATOM 958 N ILE A 62 -6.207 -3.436 -4.904 1.00 54.23 N ATOM 959 CA ILE A 62 -4.817 -3.898 -5.033 1.00 15.12 C ATOM 960 C ILE A 62 -3.966 -2.698 -5.504 1.00 22.33 C ATOM 961 O ILE A 62 -4.500 -1.792 -6.122 1.00 21.43 O ATOM 962 CB ILE A 62 -4.693 -5.081 -6.080 1.00 42.11 C ATOM 963 CG1 ILE A 62 -5.912 -6.058 -6.009 1.00 33.32 C ATOM 964 CG2 ILE A 62 -3.382 -5.851 -5.861 1.00 63.22 C ATOM 965 CD1 ILE A 62 -5.955 -7.105 -7.113 1.00 35.22 C ATOM 0 H ILE A 62 -6.570 -3.010 -5.756 1.00 54.23 H new ATOM 0 HA ILE A 62 -4.471 -4.276 -4.071 1.00 15.12 H new ATOM 0 HB ILE A 62 -4.688 -4.636 -7.075 1.00 42.11 H new ATOM 0 HG12 ILE A 62 -5.896 -6.567 -5.045 1.00 33.32 H new ATOM 0 HG13 ILE A 62 -6.831 -5.473 -6.046 1.00 33.32 H new ATOM 0 HG21 ILE A 62 -3.310 -6.661 -6.587 1.00 63.22 H new ATOM 0 HG22 ILE A 62 -2.537 -5.174 -5.987 1.00 63.22 H new ATOM 0 HG23 ILE A 62 -3.367 -6.265 -4.853 1.00 63.22 H new ATOM 0 HD11 ILE A 62 -6.834 -7.736 -6.982 1.00 35.22 H new ATOM 0 HD12 ILE A 62 -6.006 -6.610 -8.083 1.00 35.22 H new ATOM 0 HD13 ILE A 62 -5.056 -7.720 -7.066 1.00 35.22 H new ATOM 977 N ILE A 63 -2.665 -2.666 -5.169 1.00 32.21 N ATOM 978 CA ILE A 63 -1.689 -1.692 -5.734 1.00 14.12 C ATOM 979 C ILE A 63 -0.365 -2.429 -6.006 1.00 74.32 C ATOM 980 O ILE A 63 -0.021 -3.365 -5.289 1.00 10.35 O ATOM 981 CB ILE A 63 -1.405 -0.455 -4.786 1.00 34.13 C ATOM 982 CG1 ILE A 63 -2.709 0.299 -4.394 1.00 55.42 C ATOM 983 CG2 ILE A 63 -0.410 0.532 -5.441 1.00 52.31 C ATOM 984 CD1 ILE A 63 -2.489 1.486 -3.471 1.00 5.44 C ATOM 0 H ILE A 63 -2.250 -3.312 -4.498 1.00 32.21 H new ATOM 0 HA ILE A 63 -2.127 -1.291 -6.648 1.00 14.12 H new ATOM 0 HB ILE A 63 -0.963 -0.859 -3.875 1.00 34.13 H new ATOM 0 HG12 ILE A 63 -3.202 0.646 -5.302 1.00 55.42 H new ATOM 0 HG13 ILE A 63 -3.389 -0.402 -3.910 1.00 55.42 H new ATOM 0 HG21 ILE A 63 -0.234 1.371 -4.768 1.00 52.31 H new ATOM 0 HG22 ILE A 63 0.532 0.021 -5.639 1.00 52.31 H new ATOM 0 HG23 ILE A 63 -0.827 0.900 -6.379 1.00 52.31 H new ATOM 0 HD11 ILE A 63 -3.447 1.955 -3.247 1.00 5.44 H new ATOM 0 HD12 ILE A 63 -2.026 1.146 -2.545 1.00 5.44 H new ATOM 0 HD13 ILE A 63 -1.836 2.210 -3.958 1.00 5.44 H new ATOM 996 N HIS A 64 0.374 -1.994 -7.036 1.00 21.24 N ATOM 997 CA HIS A 64 1.683 -2.574 -7.375 1.00 22.53 C ATOM 998 C HIS A 64 2.739 -2.201 -6.320 1.00 53.01 C ATOM 999 O HIS A 64 2.904 -1.030 -6.003 1.00 13.52 O ATOM 1000 CB HIS A 64 2.157 -2.111 -8.788 1.00 13.33 C ATOM 1001 CG HIS A 64 2.432 -0.620 -8.929 1.00 31.53 C ATOM 1002 ND1 HIS A 64 3.642 -0.040 -8.599 1.00 74.32 N ATOM 1003 CD2 HIS A 64 1.665 0.389 -9.396 1.00 43.43 C ATOM 1004 CE1 HIS A 64 3.596 1.249 -8.855 1.00 34.11 C ATOM 1005 NE2 HIS A 64 2.410 1.539 -9.343 1.00 63.11 N ATOM 0 H HIS A 64 0.085 -1.236 -7.654 1.00 21.24 H new ATOM 0 HA HIS A 64 1.566 -3.658 -7.387 1.00 22.53 H new ATOM 0 HB2 HIS A 64 3.065 -2.656 -9.045 1.00 13.33 H new ATOM 0 HB3 HIS A 64 1.398 -2.394 -9.518 1.00 13.33 H new ATOM 0 HD1 HIS A 64 4.447 -0.535 -8.216 1.00 74.32 H new ATOM 0 HD2 HIS A 64 0.647 0.305 -9.748 1.00 43.43 H new ATOM 0 HE1 HIS A 64 4.399 1.953 -8.692 1.00 34.11 H new ATOM 1014 N ALA A 65 3.411 -3.210 -5.758 1.00 44.12 N ATOM 1015 CA ALA A 65 4.688 -3.008 -5.044 1.00 24.23 C ATOM 1016 C ALA A 65 5.841 -3.151 -6.042 1.00 71.43 C ATOM 1017 O ALA A 65 6.970 -2.808 -5.735 1.00 64.23 O ATOM 1018 CB ALA A 65 4.852 -3.996 -3.891 1.00 11.54 C ATOM 0 H ALA A 65 3.096 -4.180 -5.781 1.00 44.12 H new ATOM 0 HA ALA A 65 4.693 -2.008 -4.611 1.00 24.23 H new ATOM 0 HB1 ALA A 65 5.803 -3.816 -3.390 1.00 11.54 H new ATOM 0 HB2 ALA A 65 4.037 -3.864 -3.180 1.00 11.54 H new ATOM 0 HB3 ALA A 65 4.833 -5.014 -4.279 1.00 11.54 H new ATOM 1024 N HIS A 66 5.543 -3.701 -7.239 1.00 52.30 N ATOM 1025 CA HIS A 66 6.503 -3.736 -8.338 1.00 34.21 C ATOM 1026 C HIS A 66 6.720 -2.303 -8.816 1.00 54.42 C ATOM 1027 O HIS A 66 5.793 -1.666 -9.328 1.00 50.25 O ATOM 1028 CB HIS A 66 6.032 -4.643 -9.495 1.00 72.54 C ATOM 1029 CG HIS A 66 7.131 -4.978 -10.474 1.00 32.22 C ATOM 1030 ND1 HIS A 66 7.824 -6.168 -10.428 1.00 12.11 N ATOM 1031 CD2 HIS A 66 7.696 -4.262 -11.483 1.00 51.33 C ATOM 1032 CE1 HIS A 66 8.761 -6.166 -11.348 1.00 30.44 C ATOM 1033 NE2 HIS A 66 8.704 -5.024 -12.006 1.00 63.45 N ATOM 0 H HIS A 66 4.641 -4.124 -7.458 1.00 52.30 H new ATOM 0 HA HIS A 66 7.440 -4.165 -7.984 1.00 34.21 H new ATOM 0 HB2 HIS A 66 5.628 -5.567 -9.082 1.00 72.54 H new ATOM 0 HB3 HIS A 66 5.219 -4.149 -10.027 1.00 72.54 H new ATOM 0 HD2 HIS A 66 7.403 -3.275 -11.810 1.00 51.33 H new ATOM 0 HE1 HIS A 66 9.462 -6.966 -11.535 1.00 30.44 H new ATOM 0 HE2 HIS A 66 9.312 -4.754 -12.779 1.00 63.45 H new ATOM 1042 N LYS A 67 7.944 -1.849 -8.613 1.00 63.32 N ATOM 1043 CA LYS A 67 8.380 -0.456 -8.789 1.00 71.04 C ATOM 1044 C LYS A 67 7.717 0.437 -7.718 1.00 54.44 C ATOM 1045 O LYS A 67 6.552 0.830 -7.849 1.00 35.23 O ATOM 1046 CB LYS A 67 8.141 0.070 -10.253 1.00 44.43 C ATOM 1047 CG LYS A 67 8.802 1.443 -10.607 1.00 53.13 C ATOM 1048 CD LYS A 67 7.962 2.681 -10.193 1.00 2.21 C ATOM 1049 CE LYS A 67 8.696 4.006 -10.449 1.00 64.53 C ATOM 1050 NZ LYS A 67 9.962 4.115 -9.670 1.00 53.15 N ATOM 0 H LYS A 67 8.702 -2.460 -8.307 1.00 63.32 H new ATOM 0 HA LYS A 67 9.460 -0.413 -8.645 1.00 71.04 H new ATOM 0 HB2 LYS A 67 8.512 -0.680 -10.952 1.00 44.43 H new ATOM 0 HB3 LYS A 67 7.067 0.154 -10.416 1.00 44.43 H new ATOM 0 HG2 LYS A 67 9.776 1.500 -10.121 1.00 53.13 H new ATOM 0 HG3 LYS A 67 8.979 1.481 -11.682 1.00 53.13 H new ATOM 0 HD2 LYS A 67 7.022 2.678 -10.745 1.00 2.21 H new ATOM 0 HD3 LYS A 67 7.711 2.608 -9.135 1.00 2.21 H new ATOM 0 HE2 LYS A 67 8.918 4.095 -11.512 1.00 64.53 H new ATOM 0 HE3 LYS A 67 8.040 4.837 -10.189 1.00 64.53 H new ATOM 0 HZ1 LYS A 67 10.287 5.103 -9.672 1.00 53.15 H new ATOM 0 HZ2 LYS A 67 9.795 3.808 -8.691 1.00 53.15 H new ATOM 0 HZ3 LYS A 67 10.689 3.510 -10.103 1.00 53.15 H new ATOM 1064 N LEU A 68 8.454 0.672 -6.626 1.00 34.30 N ATOM 1065 CA LEU A 68 8.119 1.684 -5.625 1.00 1.23 C ATOM 1066 C LEU A 68 8.372 3.078 -6.217 1.00 40.22 C ATOM 1067 O LEU A 68 9.298 3.251 -7.023 1.00 53.21 O ATOM 1068 CB LEU A 68 8.988 1.482 -4.355 1.00 53.03 C ATOM 1069 CG LEU A 68 8.650 0.264 -3.433 1.00 15.10 C ATOM 1070 CD1 LEU A 68 7.230 0.370 -2.861 1.00 1.43 C ATOM 1071 CD2 LEU A 68 8.873 -1.093 -4.125 1.00 62.40 C ATOM 0 H LEU A 68 9.309 0.158 -6.413 1.00 34.30 H new ATOM 0 HA LEU A 68 7.069 1.590 -5.348 1.00 1.23 H new ATOM 0 HB2 LEU A 68 10.027 1.387 -4.670 1.00 53.03 H new ATOM 0 HB3 LEU A 68 8.919 2.388 -3.753 1.00 53.03 H new ATOM 0 HG LEU A 68 9.354 0.306 -2.602 1.00 15.10 H new ATOM 0 HD11 LEU A 68 7.028 -0.492 -2.225 1.00 1.43 H new ATOM 0 HD12 LEU A 68 7.142 1.283 -2.272 1.00 1.43 H new ATOM 0 HD13 LEU A 68 6.509 0.394 -3.678 1.00 1.43 H new ATOM 0 HD21 LEU A 68 8.622 -1.899 -3.435 1.00 62.40 H new ATOM 0 HD22 LEU A 68 8.238 -1.160 -5.008 1.00 62.40 H new ATOM 0 HD23 LEU A 68 9.918 -1.183 -4.422 1.00 62.40 H new ATOM 1083 N LEU A 69 7.561 4.061 -5.816 1.00 61.05 N ATOM 1084 CA LEU A 69 7.743 5.453 -6.225 1.00 64.05 C ATOM 1085 C LEU A 69 8.871 6.062 -5.394 1.00 34.30 C ATOM 1086 O LEU A 69 8.650 6.618 -4.306 1.00 62.23 O ATOM 1087 CB LEU A 69 6.436 6.271 -6.095 1.00 61.41 C ATOM 1088 CG LEU A 69 5.235 5.784 -6.964 1.00 43.01 C ATOM 1089 CD1 LEU A 69 4.040 6.746 -6.830 1.00 14.10 C ATOM 1090 CD2 LEU A 69 5.637 5.590 -8.447 1.00 73.04 C ATOM 0 H LEU A 69 6.762 3.913 -5.200 1.00 61.05 H new ATOM 0 HA LEU A 69 8.011 5.482 -7.281 1.00 64.05 H new ATOM 0 HB2 LEU A 69 6.129 6.264 -5.049 1.00 61.41 H new ATOM 0 HB3 LEU A 69 6.652 7.307 -6.357 1.00 61.41 H new ATOM 0 HG LEU A 69 4.930 4.808 -6.587 1.00 43.01 H new ATOM 0 HD11 LEU A 69 3.214 6.388 -7.444 1.00 14.10 H new ATOM 0 HD12 LEU A 69 3.724 6.791 -5.788 1.00 14.10 H new ATOM 0 HD13 LEU A 69 4.335 7.741 -7.163 1.00 14.10 H new ATOM 0 HD21 LEU A 69 4.772 5.251 -9.017 1.00 73.04 H new ATOM 0 HD22 LEU A 69 5.991 6.537 -8.855 1.00 73.04 H new ATOM 0 HD23 LEU A 69 6.431 4.846 -8.514 1.00 73.04 H new ATOM 1102 N ASP A 70 10.087 5.849 -5.888 1.00 41.42 N ATOM 1103 CA ASP A 70 11.307 6.377 -5.299 1.00 54.22 C ATOM 1104 C ASP A 70 11.528 7.827 -5.795 1.00 42.44 C ATOM 1105 O ASP A 70 11.620 8.068 -7.001 1.00 55.54 O ATOM 1106 CB ASP A 70 12.510 5.455 -5.634 1.00 14.30 C ATOM 1107 CG ASP A 70 12.727 5.234 -7.143 1.00 4.41 C ATOM 1108 OD1 ASP A 70 12.060 4.349 -7.728 1.00 1.11 O ATOM 1109 OD2 ASP A 70 13.525 5.971 -7.754 1.00 42.32 O ATOM 0 H ASP A 70 10.252 5.292 -6.727 1.00 41.42 H new ATOM 0 HA ASP A 70 11.216 6.401 -4.213 1.00 54.22 H new ATOM 0 HB2 ASP A 70 13.415 5.886 -5.206 1.00 14.30 H new ATOM 0 HB3 ASP A 70 12.359 4.488 -5.153 1.00 14.30 H new ATOM 1114 N PRO A 71 11.535 8.831 -4.872 1.00 30.22 N ATOM 1115 CA PRO A 71 11.944 10.227 -5.192 1.00 41.20 C ATOM 1116 C PRO A 71 13.476 10.385 -5.373 1.00 2.34 C ATOM 1117 O PRO A 71 13.966 11.494 -5.627 1.00 2.20 O ATOM 1118 CB PRO A 71 11.421 11.042 -3.971 1.00 13.53 C ATOM 1119 CG PRO A 71 10.506 10.107 -3.232 1.00 73.03 C ATOM 1120 CD PRO A 71 11.066 8.731 -3.473 1.00 33.42 C ATOM 0 HA PRO A 71 11.536 10.565 -6.145 1.00 41.20 H new ATOM 0 HB2 PRO A 71 12.244 11.371 -3.336 1.00 13.53 H new ATOM 0 HB3 PRO A 71 10.890 11.938 -4.294 1.00 13.53 H new ATOM 0 HG2 PRO A 71 10.481 10.341 -2.168 1.00 73.03 H new ATOM 0 HG3 PRO A 71 9.483 10.185 -3.600 1.00 73.03 H new ATOM 0 HD2 PRO A 71 11.879 8.495 -2.786 1.00 33.42 H new ATOM 0 HD3 PRO A 71 10.310 7.955 -3.351 1.00 33.42 H new ATOM 1128 N SER A 72 14.214 9.270 -5.222 1.00 1.14 N ATOM 1129 CA SER A 72 15.666 9.214 -5.420 1.00 73.11 C ATOM 1130 C SER A 72 16.030 9.336 -6.913 1.00 71.31 C ATOM 1131 O SER A 72 16.776 10.248 -7.306 1.00 61.51 O ATOM 1132 CB SER A 72 16.212 7.902 -4.806 1.00 62.02 C ATOM 1133 OG SER A 72 15.494 6.775 -5.276 1.00 63.51 O ATOM 0 H SER A 72 13.809 8.373 -4.955 1.00 1.14 H new ATOM 0 HA SER A 72 16.131 10.060 -4.914 1.00 73.11 H new ATOM 0 HB2 SER A 72 17.267 7.793 -5.055 1.00 62.02 H new ATOM 0 HB3 SER A 72 16.145 7.951 -3.719 1.00 62.02 H new ATOM 0 HG SER A 72 15.862 5.961 -4.873 1.00 63.51 H new ATOM 1139 N GLU A 73 15.500 8.412 -7.736 1.00 60.53 N ATOM 1140 CA GLU A 73 15.732 8.405 -9.197 1.00 21.34 C ATOM 1141 C GLU A 73 14.565 9.107 -9.911 1.00 52.33 C ATOM 1142 O GLU A 73 14.765 9.820 -10.905 1.00 52.11 O ATOM 1143 CB GLU A 73 15.886 6.949 -9.722 1.00 23.32 C ATOM 1144 CG GLU A 73 16.873 6.074 -8.917 1.00 72.41 C ATOM 1145 CD GLU A 73 18.287 6.675 -8.813 1.00 75.32 C ATOM 1146 OE1 GLU A 73 19.005 6.712 -9.838 1.00 31.53 O ATOM 1147 OE2 GLU A 73 18.692 7.110 -7.707 1.00 20.20 O ATOM 0 H GLU A 73 14.902 7.652 -7.412 1.00 60.53 H new ATOM 0 HA GLU A 73 16.657 8.943 -9.407 1.00 21.34 H new ATOM 0 HB2 GLU A 73 14.907 6.469 -9.715 1.00 23.32 H new ATOM 0 HB3 GLU A 73 16.216 6.984 -10.760 1.00 23.32 H new ATOM 0 HG2 GLU A 73 16.476 5.924 -7.913 1.00 72.41 H new ATOM 0 HG3 GLU A 73 16.938 5.091 -9.384 1.00 72.41 H new ATOM 1154 N GLY A 74 13.345 8.880 -9.384 1.00 73.54 N ATOM 1155 CA GLY A 74 12.128 9.490 -9.924 1.00 52.33 C ATOM 1156 C GLY A 74 11.985 10.958 -9.555 1.00 34.12 C ATOM 1157 O GLY A 74 12.191 11.343 -8.400 1.00 11.52 O ATOM 0 H GLY A 74 13.183 8.274 -8.580 1.00 73.54 H new ATOM 0 HA2 GLY A 74 12.130 9.393 -11.010 1.00 52.33 H new ATOM 0 HA3 GLY A 74 11.260 8.943 -9.557 1.00 52.33 H new TER 1161 GLY A 74 ATOM 1162 N MET B 101 -10.158 25.276 -5.186 1.00 21.20 N ATOM 1163 CA MET B 101 -9.036 24.363 -5.375 1.00 21.53 C ATOM 1164 C MET B 101 -9.526 22.898 -5.267 1.00 45.41 C ATOM 1165 O MET B 101 -9.896 22.462 -4.170 1.00 0.43 O ATOM 1166 CB MET B 101 -7.915 24.639 -4.325 1.00 55.21 C ATOM 1167 CG MET B 101 -7.361 26.074 -4.337 1.00 13.53 C ATOM 1168 SD MET B 101 -6.065 26.332 -3.098 1.00 33.21 S ATOM 1169 CE MET B 101 -5.694 28.079 -3.303 1.00 4.14 C ATOM 0 HA MET B 101 -8.618 24.526 -6.368 1.00 21.53 H new ATOM 0 HB2 MET B 101 -8.307 24.424 -3.331 1.00 55.21 H new ATOM 0 HB3 MET B 101 -7.093 23.945 -4.501 1.00 55.21 H new ATOM 0 HG2 MET B 101 -6.962 26.297 -5.326 1.00 13.53 H new ATOM 0 HG3 MET B 101 -8.176 26.775 -4.156 1.00 13.53 H new ATOM 0 HE1 MET B 101 -4.912 28.370 -2.601 1.00 4.14 H new ATOM 0 HE2 MET B 101 -5.353 28.261 -4.322 1.00 4.14 H new ATOM 0 HE3 MET B 101 -6.592 28.667 -3.110 1.00 4.14 H new ATOM 1179 N PRO B 102 -9.582 22.125 -6.408 1.00 63.42 N ATOM 1180 CA PRO B 102 -9.880 20.670 -6.381 1.00 74.24 C ATOM 1181 C PRO B 102 -8.749 19.897 -5.668 1.00 74.14 C ATOM 1182 O PRO B 102 -7.750 19.524 -6.286 1.00 42.13 O ATOM 1183 CB PRO B 102 -10.009 20.287 -7.892 1.00 70.44 C ATOM 1184 CG PRO B 102 -10.165 21.595 -8.620 1.00 35.42 C ATOM 1185 CD PRO B 102 -9.388 22.602 -7.804 1.00 2.04 C ATOM 0 HA PRO B 102 -10.784 20.421 -5.825 1.00 74.24 H new ATOM 0 HB2 PRO B 102 -9.128 19.747 -8.238 1.00 70.44 H new ATOM 0 HB3 PRO B 102 -10.868 19.637 -8.061 1.00 70.44 H new ATOM 0 HG2 PRO B 102 -9.776 21.528 -9.636 1.00 35.42 H new ATOM 0 HG3 PRO B 102 -11.215 21.878 -8.699 1.00 35.42 H new ATOM 0 HD2 PRO B 102 -8.334 22.619 -8.082 1.00 2.04 H new ATOM 0 HD3 PRO B 102 -9.770 23.614 -7.941 1.00 2.04 H new ATOM 1193 N ASP B 103 -8.894 19.726 -4.348 1.00 64.44 N ATOM 1194 CA ASP B 103 -7.858 19.133 -3.481 1.00 31.02 C ATOM 1195 C ASP B 103 -8.450 17.947 -2.715 1.00 20.52 C ATOM 1196 O ASP B 103 -9.478 18.080 -2.050 1.00 52.55 O ATOM 1197 CB ASP B 103 -7.310 20.224 -2.515 1.00 32.30 C ATOM 1198 CG ASP B 103 -6.172 19.721 -1.611 1.00 21.14 C ATOM 1199 OD1 ASP B 103 -5.119 19.335 -2.147 1.00 72.24 O ATOM 1200 OD2 ASP B 103 -6.320 19.717 -0.368 1.00 65.10 O ATOM 0 H ASP B 103 -9.739 19.996 -3.844 1.00 64.44 H new ATOM 0 HA ASP B 103 -7.027 18.763 -4.082 1.00 31.02 H new ATOM 0 HB2 ASP B 103 -6.952 21.071 -3.100 1.00 32.30 H new ATOM 0 HB3 ASP B 103 -8.126 20.590 -1.891 1.00 32.30 H new ATOM 1205 N LYS B 104 -7.804 16.778 -2.841 1.00 52.13 N ATOM 1206 CA LYS B 104 -8.318 15.508 -2.316 1.00 72.53 C ATOM 1207 C LYS B 104 -7.443 14.956 -1.186 1.00 34.03 C ATOM 1208 O LYS B 104 -6.229 15.199 -1.140 1.00 4.25 O ATOM 1209 CB LYS B 104 -8.411 14.462 -3.463 1.00 42.22 C ATOM 1210 CG LYS B 104 -9.344 14.861 -4.627 1.00 55.54 C ATOM 1211 CD LYS B 104 -10.780 15.200 -4.156 1.00 51.35 C ATOM 1212 CE LYS B 104 -11.758 15.371 -5.324 1.00 63.41 C ATOM 1213 NZ LYS B 104 -11.871 14.129 -6.133 1.00 2.35 N ATOM 0 H LYS B 104 -6.904 16.689 -3.313 1.00 52.13 H new ATOM 0 HA LYS B 104 -9.309 15.700 -1.905 1.00 72.53 H new ATOM 0 HB2 LYS B 104 -7.411 14.289 -3.860 1.00 42.22 H new ATOM 0 HB3 LYS B 104 -8.757 13.516 -3.046 1.00 42.22 H new ATOM 0 HG2 LYS B 104 -8.923 15.723 -5.145 1.00 55.54 H new ATOM 0 HG3 LYS B 104 -9.386 14.045 -5.349 1.00 55.54 H new ATOM 0 HD2 LYS B 104 -11.139 14.408 -3.499 1.00 51.35 H new ATOM 0 HD3 LYS B 104 -10.758 16.117 -3.568 1.00 51.35 H new ATOM 0 HE2 LYS B 104 -12.740 15.645 -4.939 1.00 63.41 H new ATOM 0 HE3 LYS B 104 -11.425 16.191 -5.960 1.00 63.41 H new ATOM 0 HZ1 LYS B 104 -12.728 14.174 -6.721 1.00 2.35 H new ATOM 0 HZ2 LYS B 104 -11.036 14.037 -6.746 1.00 2.35 H new ATOM 0 HZ3 LYS B 104 -11.929 13.306 -5.500 1.00 2.35 H new ATOM 1227 N GLN B 105 -8.105 14.223 -0.275 1.00 4.50 N ATOM 1228 CA GLN B 105 -7.447 13.341 0.720 1.00 43.13 C ATOM 1229 C GLN B 105 -6.762 12.149 0.017 1.00 52.22 C ATOM 1230 O GLN B 105 -5.863 11.525 0.576 1.00 51.41 O ATOM 1231 CB GLN B 105 -8.488 12.846 1.795 1.00 32.31 C ATOM 1232 CG GLN B 105 -9.928 12.560 1.285 1.00 3.25 C ATOM 1233 CD GLN B 105 -10.060 11.482 0.199 1.00 73.00 C ATOM 1234 OE1 GLN B 105 -10.902 11.602 -0.692 1.00 11.14 O ATOM 1235 NE2 GLN B 105 -9.302 10.396 0.298 1.00 54.03 N ATOM 0 H GLN B 105 -9.122 14.222 -0.203 1.00 4.50 H new ATOM 0 HA GLN B 105 -6.677 13.914 1.237 1.00 43.13 H new ATOM 0 HB2 GLN B 105 -8.100 11.935 2.251 1.00 32.31 H new ATOM 0 HB3 GLN B 105 -8.548 13.597 2.583 1.00 32.31 H new ATOM 0 HG2 GLN B 105 -10.541 12.265 2.137 1.00 3.25 H new ATOM 0 HG3 GLN B 105 -10.346 13.489 0.898 1.00 3.25 H new ATOM 0 HE21 GLN B 105 -8.612 10.322 1.046 1.00 54.03 H new ATOM 0 HE22 GLN B 105 -9.410 9.636 -0.374 1.00 54.03 H new ATOM 1244 N LEU B 106 -7.248 11.837 -1.206 1.00 41.43 N ATOM 1245 CA LEU B 106 -6.743 10.747 -2.048 1.00 75.23 C ATOM 1246 C LEU B 106 -5.349 11.112 -2.587 1.00 31.23 C ATOM 1247 O LEU B 106 -5.198 12.104 -3.310 1.00 31.44 O ATOM 1248 CB LEU B 106 -7.744 10.485 -3.208 1.00 25.12 C ATOM 1249 CG LEU B 106 -7.456 9.225 -4.078 1.00 23.43 C ATOM 1250 CD1 LEU B 106 -7.574 7.938 -3.248 1.00 1.30 C ATOM 1251 CD2 LEU B 106 -8.368 9.171 -5.317 1.00 10.10 C ATOM 0 H LEU B 106 -8.017 12.350 -1.637 1.00 41.43 H new ATOM 0 HA LEU B 106 -6.651 9.834 -1.460 1.00 75.23 H new ATOM 0 HB2 LEU B 106 -8.744 10.391 -2.786 1.00 25.12 H new ATOM 0 HB3 LEU B 106 -7.754 11.359 -3.859 1.00 25.12 H new ATOM 0 HG LEU B 106 -6.428 9.302 -4.432 1.00 23.43 H new ATOM 0 HD11 LEU B 106 -7.368 7.076 -3.882 1.00 1.30 H new ATOM 0 HD12 LEU B 106 -6.855 7.966 -2.429 1.00 1.30 H new ATOM 0 HD13 LEU B 106 -8.583 7.857 -2.843 1.00 1.30 H new ATOM 0 HD21 LEU B 106 -8.138 8.279 -5.899 1.00 10.10 H new ATOM 0 HD22 LEU B 106 -9.410 9.139 -5.000 1.00 10.10 H new ATOM 0 HD23 LEU B 106 -8.202 10.057 -5.930 1.00 10.10 H new ATOM 1263 N LEU B 107 -4.346 10.296 -2.242 1.00 61.24 N ATOM 1264 CA LEU B 107 -2.925 10.657 -2.396 1.00 35.14 C ATOM 1265 C LEU B 107 -2.046 9.405 -2.595 1.00 23.12 C ATOM 1266 O LEU B 107 -2.553 8.335 -2.934 1.00 54.44 O ATOM 1267 CB LEU B 107 -2.478 11.540 -1.171 1.00 51.54 C ATOM 1268 CG LEU B 107 -2.368 10.901 0.290 1.00 43.22 C ATOM 1269 CD1 LEU B 107 -3.258 9.660 0.531 1.00 10.21 C ATOM 1270 CD2 LEU B 107 -0.914 10.611 0.694 1.00 4.11 C ATOM 0 H LEU B 107 -4.493 9.367 -1.848 1.00 61.24 H new ATOM 0 HA LEU B 107 -2.793 11.252 -3.300 1.00 35.14 H new ATOM 0 HB2 LEU B 107 -1.501 11.957 -1.414 1.00 51.54 H new ATOM 0 HB3 LEU B 107 -3.174 12.376 -1.105 1.00 51.54 H new ATOM 0 HG LEU B 107 -2.765 11.679 0.942 1.00 43.22 H new ATOM 0 HD11 LEU B 107 -3.113 9.300 1.550 1.00 10.21 H new ATOM 0 HD12 LEU B 107 -4.304 9.929 0.387 1.00 10.21 H new ATOM 0 HD13 LEU B 107 -2.985 8.874 -0.174 1.00 10.21 H new ATOM 0 HD21 LEU B 107 -0.894 10.178 1.694 1.00 4.11 H new ATOM 0 HD22 LEU B 107 -0.473 9.910 -0.014 1.00 4.11 H new ATOM 0 HD23 LEU B 107 -0.343 11.539 0.689 1.00 4.11 H new ATOM 1282 N HIS B 108 -0.723 9.569 -2.428 1.00 72.20 N ATOM 1283 CA HIS B 108 0.260 8.478 -2.537 1.00 31.40 C ATOM 1284 C HIS B 108 0.590 7.923 -1.141 1.00 33.45 C ATOM 1285 O HIS B 108 1.318 8.571 -0.387 1.00 43.45 O ATOM 1286 CB HIS B 108 1.553 8.999 -3.219 1.00 74.54 C ATOM 1287 CG HIS B 108 1.399 9.389 -4.668 1.00 22.11 C ATOM 1288 ND1 HIS B 108 2.473 9.571 -5.506 1.00 32.22 N ATOM 1289 CD2 HIS B 108 0.299 9.656 -5.420 1.00 52.32 C ATOM 1290 CE1 HIS B 108 2.047 9.935 -6.696 1.00 23.30 C ATOM 1291 NE2 HIS B 108 0.731 9.993 -6.673 1.00 15.15 N ATOM 0 H HIS B 108 -0.302 10.472 -2.211 1.00 72.20 H new ATOM 0 HA HIS B 108 -0.165 7.678 -3.143 1.00 31.40 H new ATOM 0 HB2 HIS B 108 1.916 9.863 -2.663 1.00 74.54 H new ATOM 0 HB3 HIS B 108 2.320 8.228 -3.146 1.00 74.54 H new ATOM 0 HD2 HIS B 108 -0.728 9.610 -5.089 1.00 52.32 H new ATOM 0 HE1 HIS B 108 2.672 10.150 -7.550 1.00 23.30 H new ATOM 0 HE2 HIS B 108 0.133 10.247 -7.460 1.00 15.15 H new ATOM 1300 N ILE B 109 0.050 6.732 -0.795 1.00 1.52 N ATOM 1301 CA ILE B 109 0.305 6.092 0.521 1.00 62.40 C ATOM 1302 C ILE B 109 1.770 5.626 0.624 1.00 4.05 C ATOM 1303 O ILE B 109 2.464 5.494 -0.384 1.00 3.33 O ATOM 1304 CB ILE B 109 -0.646 4.866 0.793 1.00 51.11 C ATOM 1305 CG1 ILE B 109 -0.349 3.705 -0.208 1.00 15.14 C ATOM 1306 CG2 ILE B 109 -2.130 5.296 0.752 1.00 44.12 C ATOM 1307 CD1 ILE B 109 -1.221 2.471 -0.053 1.00 21.21 C ATOM 0 H ILE B 109 -0.564 6.194 -1.406 1.00 1.52 H new ATOM 0 HA ILE B 109 0.100 6.851 1.276 1.00 62.40 H new ATOM 0 HB ILE B 109 -0.447 4.492 1.797 1.00 51.11 H new ATOM 0 HG12 ILE B 109 -0.464 4.085 -1.223 1.00 15.14 H new ATOM 0 HG13 ILE B 109 0.694 3.409 -0.095 1.00 15.14 H new ATOM 0 HG21 ILE B 109 -2.765 4.431 0.943 1.00 44.12 H new ATOM 0 HG22 ILE B 109 -2.310 6.054 1.514 1.00 44.12 H new ATOM 0 HG23 ILE B 109 -2.363 5.707 -0.230 1.00 44.12 H new ATOM 0 HD11 ILE B 109 -0.933 1.726 -0.795 1.00 21.21 H new ATOM 0 HD12 ILE B 109 -1.090 2.056 0.947 1.00 21.21 H new ATOM 0 HD13 ILE B 109 -2.266 2.743 -0.199 1.00 21.21 H new ATOM 1319 N VAL B 110 2.208 5.325 1.843 1.00 64.43 N ATOM 1320 CA VAL B 110 3.620 5.032 2.149 1.00 0.54 C ATOM 1321 C VAL B 110 3.789 3.628 2.740 1.00 34.02 C ATOM 1322 O VAL B 110 3.024 3.205 3.615 1.00 75.03 O ATOM 1323 CB VAL B 110 4.225 6.125 3.110 1.00 53.42 C ATOM 1324 CG1 VAL B 110 4.709 7.334 2.306 1.00 34.00 C ATOM 1325 CG2 VAL B 110 3.190 6.572 4.180 1.00 61.30 C ATOM 0 H VAL B 110 1.596 5.275 2.657 1.00 64.43 H new ATOM 0 HA VAL B 110 4.173 5.060 1.210 1.00 0.54 H new ATOM 0 HB VAL B 110 5.075 5.680 3.628 1.00 53.42 H new ATOM 0 HG11 VAL B 110 5.124 8.080 2.984 1.00 34.00 H new ATOM 0 HG12 VAL B 110 5.477 7.018 1.600 1.00 34.00 H new ATOM 0 HG13 VAL B 110 3.871 7.767 1.760 1.00 34.00 H new ATOM 0 HG21 VAL B 110 3.638 7.326 4.827 1.00 61.30 H new ATOM 0 HG22 VAL B 110 2.314 6.992 3.686 1.00 61.30 H new ATOM 0 HG23 VAL B 110 2.891 5.712 4.779 1.00 61.30 H new ATOM 1335 N VAL B 111 4.823 2.932 2.242 1.00 22.43 N ATOM 1336 CA VAL B 111 5.186 1.569 2.661 1.00 61.41 C ATOM 1337 C VAL B 111 6.690 1.334 2.427 1.00 52.41 C ATOM 1338 O VAL B 111 7.286 1.894 1.500 1.00 31.13 O ATOM 1339 CB VAL B 111 4.351 0.477 1.881 1.00 22.12 C ATOM 1340 CG1 VAL B 111 4.556 0.587 0.355 1.00 62.15 C ATOM 1341 CG2 VAL B 111 4.664 -0.958 2.380 1.00 10.02 C ATOM 0 H VAL B 111 5.442 3.308 1.523 1.00 22.43 H new ATOM 0 HA VAL B 111 4.956 1.475 3.722 1.00 61.41 H new ATOM 0 HB VAL B 111 3.300 0.675 2.092 1.00 22.12 H new ATOM 0 HG11 VAL B 111 3.966 -0.180 -0.148 1.00 62.15 H new ATOM 0 HG12 VAL B 111 4.236 1.572 0.015 1.00 62.15 H new ATOM 0 HG13 VAL B 111 5.611 0.447 0.119 1.00 62.15 H new ATOM 0 HG21 VAL B 111 4.069 -1.677 1.817 1.00 10.02 H new ATOM 0 HG22 VAL B 111 5.723 -1.171 2.234 1.00 10.02 H new ATOM 0 HG23 VAL B 111 4.421 -1.036 3.440 1.00 10.02 H new ATOM 1351 N GLY B 112 7.283 0.500 3.276 1.00 60.22 N ATOM 1352 CA GLY B 112 8.651 0.049 3.104 1.00 1.53 C ATOM 1353 C GLY B 112 8.849 -1.297 3.756 1.00 11.21 C ATOM 1354 O GLY B 112 7.953 -2.140 3.704 1.00 44.13 O ATOM 0 H GLY B 112 6.823 0.120 4.103 1.00 60.22 H new ATOM 0 HA2 GLY B 112 8.888 -0.016 2.042 1.00 1.53 H new ATOM 0 HA3 GLY B 112 9.337 0.775 3.540 1.00 1.53 H new ATOM 1358 N GLY B 113 10.008 -1.497 4.377 1.00 64.21 N ATOM 1359 CA GLY B 113 10.352 -2.766 5.017 1.00 73.23 C ATOM 1360 C GLY B 113 11.683 -3.261 4.503 1.00 10.23 C ATOM 1361 O GLY B 113 12.444 -2.472 3.921 1.00 52.33 O ATOM 0 H GLY B 113 10.735 -0.786 4.452 1.00 64.21 H new ATOM 0 HA2 GLY B 113 10.396 -2.637 6.098 1.00 73.23 H new ATOM 0 HA3 GLY B 113 9.577 -3.506 4.816 1.00 73.23 H new ATOM 1365 N GLU B 114 11.979 -4.553 4.698 1.00 43.34 N ATOM 1366 CA GLU B 114 13.265 -5.133 4.291 1.00 32.32 C ATOM 1367 C GLU B 114 13.241 -5.717 2.872 1.00 72.32 C ATOM 1368 O GLU B 114 12.337 -6.470 2.475 1.00 10.53 O ATOM 1369 CB GLU B 114 13.784 -6.159 5.327 1.00 42.34 C ATOM 1370 CG GLU B 114 14.297 -5.481 6.609 1.00 4.25 C ATOM 1371 CD GLU B 114 15.190 -6.370 7.479 1.00 31.14 C ATOM 1372 OE1 GLU B 114 16.274 -6.773 6.999 1.00 24.21 O ATOM 1373 OE2 GLU B 114 14.829 -6.664 8.633 1.00 2.45 O ATOM 0 H GLU B 114 11.342 -5.218 5.137 1.00 43.34 H new ATOM 0 HA GLU B 114 13.974 -4.306 4.263 1.00 32.32 H new ATOM 0 HB2 GLU B 114 12.983 -6.853 5.581 1.00 42.34 H new ATOM 0 HB3 GLU B 114 14.587 -6.747 4.883 1.00 42.34 H new ATOM 0 HG2 GLU B 114 14.854 -4.585 6.334 1.00 4.25 H new ATOM 0 HG3 GLU B 114 13.442 -5.156 7.201 1.00 4.25 H new ATOM 1380 N LEU B 115 14.277 -5.314 2.135 1.00 43.45 N ATOM 1381 CA LEU B 115 14.559 -5.696 0.756 1.00 51.33 C ATOM 1382 C LEU B 115 15.572 -6.864 0.743 1.00 70.31 C ATOM 1383 O LEU B 115 16.190 -7.173 1.770 1.00 42.32 O ATOM 1384 CB LEU B 115 15.142 -4.455 0.008 1.00 44.01 C ATOM 1385 CG LEU B 115 14.162 -3.260 -0.290 1.00 23.31 C ATOM 1386 CD1 LEU B 115 12.917 -3.720 -1.041 1.00 32.24 C ATOM 1387 CD2 LEU B 115 13.769 -2.482 0.973 1.00 63.51 C ATOM 0 H LEU B 115 14.980 -4.676 2.508 1.00 43.45 H new ATOM 0 HA LEU B 115 13.648 -6.024 0.256 1.00 51.33 H new ATOM 0 HB2 LEU B 115 15.975 -4.069 0.596 1.00 44.01 H new ATOM 0 HB3 LEU B 115 15.554 -4.797 -0.941 1.00 44.01 H new ATOM 0 HG LEU B 115 14.717 -2.576 -0.932 1.00 23.31 H new ATOM 0 HD11 LEU B 115 12.267 -2.865 -1.227 1.00 32.24 H new ATOM 0 HD12 LEU B 115 13.210 -4.167 -1.991 1.00 32.24 H new ATOM 0 HD13 LEU B 115 12.383 -4.458 -0.442 1.00 32.24 H new ATOM 0 HD21 LEU B 115 13.092 -1.671 0.705 1.00 63.51 H new ATOM 0 HD22 LEU B 115 13.271 -3.153 1.673 1.00 63.51 H new ATOM 0 HD23 LEU B 115 14.664 -2.069 1.439 1.00 63.51 H new ATOM 1399 N LYS B 116 15.710 -7.541 -0.407 1.00 13.54 N ATOM 1400 CA LYS B 116 16.746 -8.592 -0.585 1.00 71.40 C ATOM 1401 C LYS B 116 18.151 -7.979 -0.709 1.00 41.01 C ATOM 1402 O LYS B 116 19.137 -8.556 -0.238 1.00 63.14 O ATOM 1403 CB LYS B 116 16.453 -9.460 -1.831 1.00 5.34 C ATOM 1404 CG LYS B 116 15.215 -10.369 -1.714 1.00 33.50 C ATOM 1405 CD LYS B 116 14.977 -11.204 -2.991 1.00 23.43 C ATOM 1406 CE LYS B 116 14.783 -10.326 -4.224 1.00 34.32 C ATOM 1407 NZ LYS B 116 14.567 -11.121 -5.460 1.00 50.03 N ATOM 0 H LYS B 116 15.125 -7.387 -1.228 1.00 13.54 H new ATOM 0 HA LYS B 116 16.715 -9.223 0.303 1.00 71.40 H new ATOM 0 HB2 LYS B 116 16.323 -8.803 -2.691 1.00 5.34 H new ATOM 0 HB3 LYS B 116 17.324 -10.082 -2.035 1.00 5.34 H new ATOM 0 HG2 LYS B 116 15.338 -11.039 -0.863 1.00 33.50 H new ATOM 0 HG3 LYS B 116 14.336 -9.757 -1.514 1.00 33.50 H new ATOM 0 HD2 LYS B 116 15.825 -11.870 -3.151 1.00 23.43 H new ATOM 0 HD3 LYS B 116 14.098 -11.834 -2.853 1.00 23.43 H new ATOM 0 HE2 LYS B 116 13.929 -9.667 -4.066 1.00 34.32 H new ATOM 0 HE3 LYS B 116 15.658 -9.689 -4.354 1.00 34.32 H new ATOM 0 HZ1 LYS B 116 14.980 -10.619 -6.272 1.00 50.03 H new ATOM 0 HZ2 LYS B 116 15.023 -12.050 -5.359 1.00 50.03 H new ATOM 0 HZ3 LYS B 116 13.547 -11.251 -5.615 1.00 50.03 H new ATOM 1421 N ASP B 117 18.230 -6.823 -1.366 1.00 73.43 N ATOM 1422 CA ASP B 117 19.495 -6.108 -1.622 1.00 0.35 C ATOM 1423 C ASP B 117 19.453 -4.752 -0.883 1.00 40.20 C ATOM 1424 O ASP B 117 18.407 -4.376 -0.341 1.00 22.24 O ATOM 1425 CB ASP B 117 19.671 -5.945 -3.163 1.00 54.33 C ATOM 1426 CG ASP B 117 21.014 -5.323 -3.595 1.00 73.12 C ATOM 1427 OD1 ASP B 117 22.010 -6.064 -3.717 1.00 71.01 O ATOM 1428 OD2 ASP B 117 21.085 -4.092 -3.801 1.00 22.12 O ATOM 0 H ASP B 117 17.412 -6.345 -1.743 1.00 73.43 H new ATOM 0 HA ASP B 117 20.355 -6.663 -1.247 1.00 0.35 H new ATOM 0 HB2 ASP B 117 19.572 -6.924 -3.632 1.00 54.33 H new ATOM 0 HB3 ASP B 117 18.860 -5.325 -3.544 1.00 54.33 H new ATOM 1433 N VAL B 118 20.591 -4.045 -0.840 1.00 1.35 N ATOM 1434 CA VAL B 118 20.710 -2.734 -0.178 1.00 64.33 C ATOM 1435 C VAL B 118 19.940 -1.639 -0.948 1.00 11.43 C ATOM 1436 O VAL B 118 19.279 -0.795 -0.349 1.00 53.31 O ATOM 1437 CB VAL B 118 22.217 -2.330 -0.004 1.00 33.40 C ATOM 1438 CG1 VAL B 118 22.930 -3.314 0.950 1.00 50.24 C ATOM 1439 CG2 VAL B 118 22.968 -2.249 -1.360 1.00 22.12 C ATOM 0 H VAL B 118 21.461 -4.367 -1.265 1.00 1.35 H new ATOM 0 HA VAL B 118 20.260 -2.825 0.811 1.00 64.33 H new ATOM 0 HB VAL B 118 22.234 -1.331 0.431 1.00 33.40 H new ATOM 0 HG11 VAL B 118 23.974 -3.021 1.061 1.00 50.24 H new ATOM 0 HG12 VAL B 118 22.442 -3.294 1.924 1.00 50.24 H new ATOM 0 HG13 VAL B 118 22.878 -4.322 0.539 1.00 50.24 H new ATOM 0 HG21 VAL B 118 24.006 -1.966 -1.185 1.00 22.12 H new ATOM 0 HG22 VAL B 118 22.935 -3.221 -1.853 1.00 22.12 H new ATOM 0 HG23 VAL B 118 22.491 -1.503 -1.996 1.00 22.12 H new ATOM 1449 N ALA B 119 20.043 -1.666 -2.281 1.00 61.25 N ATOM 1450 CA ALA B 119 19.344 -0.712 -3.171 1.00 65.20 C ATOM 1451 C ALA B 119 18.296 -1.431 -4.040 1.00 55.34 C ATOM 1452 O ALA B 119 17.423 -0.781 -4.634 1.00 75.24 O ATOM 1453 CB ALA B 119 20.364 0.031 -4.045 1.00 23.55 C ATOM 0 H ALA B 119 20.613 -2.348 -2.781 1.00 61.25 H new ATOM 0 HA ALA B 119 18.816 0.015 -2.554 1.00 65.20 H new ATOM 0 HB1 ALA B 119 19.842 0.731 -4.697 1.00 23.55 H new ATOM 0 HB2 ALA B 119 21.059 0.578 -3.408 1.00 23.55 H new ATOM 0 HB3 ALA B 119 20.916 -0.688 -4.651 1.00 23.55 H new ATOM 1459 N GLY B 120 18.410 -2.776 -4.106 1.00 31.01 N ATOM 1460 CA GLY B 120 17.489 -3.623 -4.872 1.00 32.12 C ATOM 1461 C GLY B 120 16.099 -3.624 -4.264 1.00 54.04 C ATOM 1462 O GLY B 120 15.898 -4.175 -3.179 1.00 74.22 O ATOM 0 H GLY B 120 19.145 -3.298 -3.628 1.00 31.01 H new ATOM 0 HA2 GLY B 120 17.437 -3.268 -5.901 1.00 32.12 H new ATOM 0 HA3 GLY B 120 17.873 -4.642 -4.906 1.00 32.12 H new ATOM 1466 N VAL B 121 15.140 -3.044 -4.996 1.00 12.41 N ATOM 1467 CA VAL B 121 13.824 -2.638 -4.466 1.00 33.44 C ATOM 1468 C VAL B 121 12.774 -3.797 -4.492 1.00 33.54 C ATOM 1469 O VAL B 121 11.553 -3.568 -4.513 1.00 4.01 O ATOM 1470 CB VAL B 121 13.334 -1.347 -5.251 1.00 54.11 C ATOM 1471 CG1 VAL B 121 12.732 -1.675 -6.643 1.00 21.41 C ATOM 1472 CG2 VAL B 121 12.379 -0.489 -4.396 1.00 34.10 C ATOM 0 H VAL B 121 15.254 -2.839 -5.989 1.00 12.41 H new ATOM 0 HA VAL B 121 13.931 -2.391 -3.410 1.00 33.44 H new ATOM 0 HB VAL B 121 14.225 -0.750 -5.444 1.00 54.11 H new ATOM 0 HG11 VAL B 121 12.416 -0.752 -7.129 1.00 21.41 H new ATOM 0 HG12 VAL B 121 13.484 -2.170 -7.257 1.00 21.41 H new ATOM 0 HG13 VAL B 121 11.872 -2.334 -6.522 1.00 21.41 H new ATOM 0 HG21 VAL B 121 12.065 0.385 -4.967 1.00 34.10 H new ATOM 0 HG22 VAL B 121 11.503 -1.079 -4.125 1.00 34.10 H new ATOM 0 HG23 VAL B 121 12.892 -0.166 -3.491 1.00 34.10 H new ATOM 1482 N GLU B 122 13.262 -5.050 -4.389 1.00 0.10 N ATOM 1483 CA GLU B 122 12.404 -6.245 -4.318 1.00 1.14 C ATOM 1484 C GLU B 122 12.279 -6.679 -2.846 1.00 44.41 C ATOM 1485 O GLU B 122 13.280 -7.072 -2.225 1.00 1.42 O ATOM 1486 CB GLU B 122 12.965 -7.406 -5.177 1.00 25.02 C ATOM 1487 CG GLU B 122 13.464 -7.008 -6.580 1.00 32.14 C ATOM 1488 CD GLU B 122 13.376 -8.151 -7.604 1.00 33.10 C ATOM 1489 OE1 GLU B 122 14.225 -9.069 -7.577 1.00 42.45 O ATOM 1490 OE2 GLU B 122 12.448 -8.139 -8.446 1.00 4.03 O ATOM 0 H GLU B 122 14.260 -5.259 -4.353 1.00 0.10 H new ATOM 0 HA GLU B 122 11.422 -5.995 -4.720 1.00 1.14 H new ATOM 0 HB2 GLU B 122 13.789 -7.871 -4.635 1.00 25.02 H new ATOM 0 HB3 GLU B 122 12.188 -8.162 -5.287 1.00 25.02 H new ATOM 0 HG2 GLU B 122 12.879 -6.162 -6.940 1.00 32.14 H new ATOM 0 HG3 GLU B 122 14.499 -6.673 -6.508 1.00 32.14 H new ATOM 1497 N PHE B 123 11.057 -6.569 -2.297 1.00 74.33 N ATOM 1498 CA PHE B 123 10.760 -6.865 -0.885 1.00 4.11 C ATOM 1499 C PHE B 123 11.045 -8.340 -0.532 1.00 4.03 C ATOM 1500 O PHE B 123 10.307 -9.234 -0.949 1.00 44.41 O ATOM 1501 CB PHE B 123 9.286 -6.519 -0.569 1.00 13.23 C ATOM 1502 CG PHE B 123 8.960 -5.025 -0.571 1.00 73.13 C ATOM 1503 CD1 PHE B 123 9.696 -4.138 0.221 1.00 4.33 C ATOM 1504 CD2 PHE B 123 7.893 -4.515 -1.313 1.00 32.44 C ATOM 1505 CE1 PHE B 123 9.378 -2.795 0.269 1.00 2.11 C ATOM 1506 CE2 PHE B 123 7.582 -3.169 -1.268 1.00 35.13 C ATOM 1507 CZ PHE B 123 8.323 -2.309 -0.475 1.00 10.13 C ATOM 0 H PHE B 123 10.239 -6.269 -2.827 1.00 74.33 H new ATOM 0 HA PHE B 123 11.419 -6.248 -0.274 1.00 4.11 H new ATOM 0 HB2 PHE B 123 8.647 -7.016 -1.299 1.00 13.23 H new ATOM 0 HB3 PHE B 123 9.033 -6.930 0.408 1.00 13.23 H new ATOM 0 HD1 PHE B 123 10.526 -4.509 0.804 1.00 4.33 H new ATOM 0 HD2 PHE B 123 7.304 -5.179 -1.929 1.00 32.44 H new ATOM 0 HE1 PHE B 123 9.955 -2.125 0.889 1.00 2.11 H new ATOM 0 HE2 PHE B 123 6.759 -2.787 -1.853 1.00 35.13 H new ATOM 0 HZ PHE B 123 8.075 -1.258 -0.439 1.00 10.13 H new ATOM 1517 N ARG B 124 12.108 -8.551 0.264 1.00 64.44 N ATOM 1518 CA ARG B 124 12.597 -9.884 0.686 1.00 25.15 C ATOM 1519 C ARG B 124 11.477 -10.785 1.236 1.00 11.33 C ATOM 1520 O ARG B 124 11.398 -11.972 0.896 1.00 63.34 O ATOM 1521 CB ARG B 124 13.714 -9.694 1.750 1.00 74.03 C ATOM 1522 CG ARG B 124 14.222 -10.979 2.453 1.00 62.13 C ATOM 1523 CD ARG B 124 15.437 -10.690 3.361 1.00 10.01 C ATOM 1524 NE ARG B 124 15.728 -11.798 4.294 1.00 52.45 N ATOM 1525 CZ ARG B 124 16.583 -12.811 4.073 1.00 33.23 C ATOM 1526 NH1 ARG B 124 17.264 -12.901 2.935 1.00 25.34 N ATOM 1527 NH2 ARG B 124 16.797 -13.705 5.024 1.00 40.21 N ATOM 0 H ARG B 124 12.666 -7.786 0.642 1.00 64.44 H new ATOM 0 HA ARG B 124 12.991 -10.392 -0.194 1.00 25.15 H new ATOM 0 HB2 ARG B 124 14.564 -9.208 1.270 1.00 74.03 H new ATOM 0 HB3 ARG B 124 13.345 -9.010 2.514 1.00 74.03 H new ATOM 0 HG2 ARG B 124 13.417 -11.411 3.048 1.00 62.13 H new ATOM 0 HG3 ARG B 124 14.497 -11.720 1.703 1.00 62.13 H new ATOM 0 HD2 ARG B 124 16.313 -10.504 2.740 1.00 10.01 H new ATOM 0 HD3 ARG B 124 15.251 -9.780 3.931 1.00 10.01 H new ATOM 0 HE ARG B 124 15.235 -11.794 5.187 1.00 52.45 H new ATOM 0 HH11 ARG B 124 17.142 -12.193 2.210 1.00 25.34 H new ATOM 0 HH12 ARG B 124 17.908 -13.678 2.786 1.00 25.34 H new ATOM 0 HH21 ARG B 124 16.314 -13.623 5.919 1.00 40.21 H new ATOM 0 HH22 ARG B 124 17.445 -14.476 4.863 1.00 40.21 H new ATOM 1541 N ASP B 125 10.614 -10.194 2.067 1.00 54.12 N ATOM 1542 CA ASP B 125 9.497 -10.898 2.695 1.00 63.51 C ATOM 1543 C ASP B 125 8.326 -9.924 2.858 1.00 52.41 C ATOM 1544 O ASP B 125 8.480 -8.845 3.438 1.00 63.42 O ATOM 1545 CB ASP B 125 9.925 -11.496 4.054 1.00 33.33 C ATOM 1546 CG ASP B 125 8.795 -12.280 4.740 1.00 13.01 C ATOM 1547 OD1 ASP B 125 8.528 -13.428 4.329 1.00 24.25 O ATOM 1548 OD2 ASP B 125 8.164 -11.757 5.679 1.00 71.22 O ATOM 0 H ASP B 125 10.673 -9.208 2.323 1.00 54.12 H new ATOM 0 HA ASP B 125 9.183 -11.728 2.063 1.00 63.51 H new ATOM 0 HB2 ASP B 125 10.779 -12.156 3.903 1.00 33.33 H new ATOM 0 HB3 ASP B 125 10.255 -10.692 4.712 1.00 33.33 H new ATOM 1553 N LEU B 126 7.164 -10.337 2.346 1.00 43.23 N ATOM 1554 CA LEU B 126 5.952 -9.519 2.260 1.00 63.53 C ATOM 1555 C LEU B 126 5.176 -9.454 3.599 1.00 0.53 C ATOM 1556 O LEU B 126 4.090 -8.872 3.663 1.00 14.41 O ATOM 1557 CB LEU B 126 5.052 -10.076 1.121 1.00 0.30 C ATOM 1558 CG LEU B 126 5.705 -10.210 -0.301 1.00 74.20 C ATOM 1559 CD1 LEU B 126 6.490 -8.945 -0.702 1.00 71.44 C ATOM 1560 CD2 LEU B 126 6.557 -11.492 -0.441 1.00 24.34 C ATOM 0 H LEU B 126 7.037 -11.276 1.969 1.00 43.23 H new ATOM 0 HA LEU B 126 6.248 -8.494 2.037 1.00 63.53 H new ATOM 0 HB2 LEU B 126 4.693 -11.060 1.423 1.00 0.30 H new ATOM 0 HB3 LEU B 126 4.178 -9.431 1.033 1.00 0.30 H new ATOM 0 HG LEU B 126 4.882 -10.307 -1.009 1.00 74.20 H new ATOM 0 HD11 LEU B 126 6.924 -9.084 -1.692 1.00 71.44 H new ATOM 0 HD12 LEU B 126 5.816 -8.088 -0.718 1.00 71.44 H new ATOM 0 HD13 LEU B 126 7.286 -8.767 0.021 1.00 71.44 H new ATOM 0 HD21 LEU B 126 6.986 -11.536 -1.442 1.00 24.34 H new ATOM 0 HD22 LEU B 126 7.359 -11.478 0.297 1.00 24.34 H new ATOM 0 HD23 LEU B 126 5.928 -12.367 -0.277 1.00 24.34 H new ATOM 1572 N SER B 127 5.728 -10.065 4.659 1.00 35.33 N ATOM 1573 CA SER B 127 5.223 -9.909 6.036 1.00 34.52 C ATOM 1574 C SER B 127 6.186 -9.004 6.851 1.00 71.24 C ATOM 1575 O SER B 127 5.797 -8.445 7.880 1.00 50.43 O ATOM 1576 CB SER B 127 5.049 -11.299 6.694 1.00 4.15 C ATOM 1577 OG SER B 127 4.459 -11.215 7.986 1.00 61.22 O ATOM 0 H SER B 127 6.537 -10.682 4.588 1.00 35.33 H new ATOM 0 HA SER B 127 4.246 -9.425 6.017 1.00 34.52 H new ATOM 0 HB2 SER B 127 4.429 -11.926 6.054 1.00 4.15 H new ATOM 0 HB3 SER B 127 6.021 -11.786 6.772 1.00 4.15 H new ATOM 0 HG SER B 127 4.367 -12.115 8.363 1.00 61.22 H new ATOM 1583 N LYS B 128 7.443 -8.865 6.371 1.00 32.44 N ATOM 1584 CA LYS B 128 8.439 -7.924 6.950 1.00 21.21 C ATOM 1585 C LYS B 128 8.150 -6.476 6.519 1.00 21.33 C ATOM 1586 O LYS B 128 8.660 -5.533 7.137 1.00 72.14 O ATOM 1587 CB LYS B 128 9.887 -8.303 6.516 1.00 11.25 C ATOM 1588 CG LYS B 128 10.422 -9.622 7.106 1.00 74.03 C ATOM 1589 CD LYS B 128 10.627 -9.570 8.635 1.00 0.02 C ATOM 1590 CE LYS B 128 11.139 -10.907 9.204 1.00 24.43 C ATOM 1591 NZ LYS B 128 11.461 -10.807 10.652 1.00 11.21 N ATOM 0 H LYS B 128 7.797 -9.397 5.576 1.00 32.44 H new ATOM 0 HA LYS B 128 8.357 -7.999 8.034 1.00 21.21 H new ATOM 0 HB2 LYS B 128 9.918 -8.371 5.429 1.00 11.25 H new ATOM 0 HB3 LYS B 128 10.559 -7.495 6.804 1.00 11.25 H new ATOM 0 HG2 LYS B 128 9.727 -10.427 6.867 1.00 74.03 H new ATOM 0 HG3 LYS B 128 11.370 -9.867 6.628 1.00 74.03 H new ATOM 0 HD2 LYS B 128 11.337 -8.779 8.877 1.00 0.02 H new ATOM 0 HD3 LYS B 128 9.684 -9.310 9.117 1.00 0.02 H new ATOM 0 HE2 LYS B 128 10.384 -11.679 9.053 1.00 24.43 H new ATOM 0 HE3 LYS B 128 12.028 -11.218 8.655 1.00 24.43 H new ATOM 0 HZ1 LYS B 128 11.802 -11.727 10.996 1.00 11.21 H new ATOM 0 HZ2 LYS B 128 12.200 -10.089 10.795 1.00 11.21 H new ATOM 0 HZ3 LYS B 128 10.607 -10.535 11.180 1.00 11.21 H new ATOM 1605 N VAL B 129 7.347 -6.313 5.449 1.00 15.44 N ATOM 1606 CA VAL B 129 7.069 -4.999 4.858 1.00 41.24 C ATOM 1607 C VAL B 129 6.194 -4.151 5.805 1.00 54.42 C ATOM 1608 O VAL B 129 5.016 -4.444 6.041 1.00 1.22 O ATOM 1609 CB VAL B 129 6.447 -5.110 3.408 1.00 12.23 C ATOM 1610 CG1 VAL B 129 7.425 -5.838 2.475 1.00 4.21 C ATOM 1611 CG2 VAL B 129 5.066 -5.799 3.380 1.00 11.33 C ATOM 0 H VAL B 129 6.878 -7.086 4.976 1.00 15.44 H new ATOM 0 HA VAL B 129 8.022 -4.484 4.735 1.00 41.24 H new ATOM 0 HB VAL B 129 6.284 -4.090 3.059 1.00 12.23 H new ATOM 0 HG11 VAL B 129 6.991 -5.911 1.478 1.00 4.21 H new ATOM 0 HG12 VAL B 129 8.361 -5.282 2.423 1.00 4.21 H new ATOM 0 HG13 VAL B 129 7.619 -6.839 2.861 1.00 4.21 H new ATOM 0 HG21 VAL B 129 4.701 -5.840 2.354 1.00 11.33 H new ATOM 0 HG22 VAL B 129 5.156 -6.811 3.774 1.00 11.33 H new ATOM 0 HG23 VAL B 129 4.364 -5.233 3.993 1.00 11.33 H new ATOM 1621 N GLU B 130 6.817 -3.132 6.398 1.00 50.40 N ATOM 1622 CA GLU B 130 6.158 -2.242 7.342 1.00 24.34 C ATOM 1623 C GLU B 130 5.429 -1.142 6.559 1.00 22.25 C ATOM 1624 O GLU B 130 6.066 -0.265 5.956 1.00 14.13 O ATOM 1625 CB GLU B 130 7.187 -1.646 8.329 1.00 71.55 C ATOM 1626 CG GLU B 130 6.569 -0.696 9.379 1.00 51.34 C ATOM 1627 CD GLU B 130 7.597 -0.142 10.371 1.00 31.04 C ATOM 1628 OE1 GLU B 130 7.904 -0.822 11.377 1.00 24.03 O ATOM 1629 OE2 GLU B 130 8.103 0.969 10.149 1.00 40.44 O ATOM 0 H GLU B 130 7.797 -2.904 6.233 1.00 50.40 H new ATOM 0 HA GLU B 130 5.429 -2.798 7.931 1.00 24.34 H new ATOM 0 HB2 GLU B 130 7.695 -2.461 8.845 1.00 71.55 H new ATOM 0 HB3 GLU B 130 7.946 -1.104 7.764 1.00 71.55 H new ATOM 0 HG2 GLU B 130 6.084 0.135 8.867 1.00 51.34 H new ATOM 0 HG3 GLU B 130 5.793 -1.228 9.929 1.00 51.34 H new ATOM 1636 N PHE B 131 4.093 -1.245 6.526 1.00 75.00 N ATOM 1637 CA PHE B 131 3.220 -0.242 5.919 1.00 3.21 C ATOM 1638 C PHE B 131 3.204 0.982 6.835 1.00 20.11 C ATOM 1639 O PHE B 131 2.559 0.956 7.891 1.00 22.34 O ATOM 1640 CB PHE B 131 1.788 -0.807 5.726 1.00 41.42 C ATOM 1641 CG PHE B 131 1.727 -2.086 4.891 1.00 44.44 C ATOM 1642 CD1 PHE B 131 1.883 -3.342 5.484 1.00 11.34 C ATOM 1643 CD2 PHE B 131 1.519 -2.033 3.515 1.00 64.00 C ATOM 1644 CE1 PHE B 131 1.834 -4.493 4.726 1.00 22.03 C ATOM 1645 CE2 PHE B 131 1.469 -3.186 2.760 1.00 70.21 C ATOM 1646 CZ PHE B 131 1.629 -4.414 3.364 1.00 51.14 C ATOM 0 H PHE B 131 3.588 -2.036 6.925 1.00 75.00 H new ATOM 0 HA PHE B 131 3.593 0.035 4.933 1.00 3.21 H new ATOM 0 HB2 PHE B 131 1.352 -1.005 6.705 1.00 41.42 H new ATOM 0 HB3 PHE B 131 1.170 -0.046 5.250 1.00 41.42 H new ATOM 0 HD1 PHE B 131 2.044 -3.412 6.550 1.00 11.34 H new ATOM 0 HD2 PHE B 131 1.395 -1.075 3.032 1.00 64.00 H new ATOM 0 HE1 PHE B 131 1.956 -5.456 5.199 1.00 22.03 H new ATOM 0 HE2 PHE B 131 1.304 -3.126 1.694 1.00 70.21 H new ATOM 0 HZ PHE B 131 1.594 -5.316 2.771 1.00 51.14 H new ATOM 1656 N VAL B 132 3.980 2.009 6.443 1.00 64.41 N ATOM 1657 CA VAL B 132 4.138 3.265 7.208 1.00 13.23 C ATOM 1658 C VAL B 132 2.765 3.902 7.477 1.00 53.25 C ATOM 1659 O VAL B 132 2.514 4.437 8.559 1.00 45.23 O ATOM 1660 CB VAL B 132 5.053 4.296 6.447 1.00 32.23 C ATOM 1661 CG1 VAL B 132 5.264 5.600 7.263 1.00 12.22 C ATOM 1662 CG2 VAL B 132 6.400 3.658 6.059 1.00 45.51 C ATOM 0 H VAL B 132 4.521 1.993 5.579 1.00 64.41 H new ATOM 0 HA VAL B 132 4.618 3.013 8.154 1.00 13.23 H new ATOM 0 HB VAL B 132 4.533 4.574 5.530 1.00 32.23 H new ATOM 0 HG11 VAL B 132 5.901 6.282 6.700 1.00 12.22 H new ATOM 0 HG12 VAL B 132 4.300 6.073 7.448 1.00 12.22 H new ATOM 0 HG13 VAL B 132 5.740 5.361 8.214 1.00 12.22 H new ATOM 0 HG21 VAL B 132 7.012 4.392 5.535 1.00 45.51 H new ATOM 0 HG22 VAL B 132 6.919 3.328 6.959 1.00 45.51 H new ATOM 0 HG23 VAL B 132 6.223 2.802 5.408 1.00 45.51 H new ATOM 1672 N GLY B 133 1.895 3.821 6.463 1.00 23.44 N ATOM 1673 CA GLY B 133 0.517 4.249 6.568 1.00 11.03 C ATOM 1674 C GLY B 133 0.115 5.113 5.398 1.00 75.45 C ATOM 1675 O GLY B 133 0.407 4.781 4.240 1.00 43.02 O ATOM 0 H GLY B 133 2.141 3.452 5.544 1.00 23.44 H new ATOM 0 HA2 GLY B 133 -0.133 3.376 6.617 1.00 11.03 H new ATOM 0 HA3 GLY B 133 0.377 4.803 7.496 1.00 11.03 H new ATOM 1679 N ALA B 134 -0.562 6.212 5.703 1.00 70.01 N ATOM 1680 CA ALA B 134 -1.027 7.187 4.722 1.00 61.42 C ATOM 1681 C ALA B 134 -1.326 8.497 5.451 1.00 5.04 C ATOM 1682 O ALA B 134 -1.642 8.500 6.650 1.00 14.10 O ATOM 1683 CB ALA B 134 -2.277 6.686 3.996 1.00 30.12 C ATOM 0 H ALA B 134 -0.810 6.457 6.662 1.00 70.01 H new ATOM 0 HA ALA B 134 -0.253 7.342 3.970 1.00 61.42 H new ATOM 0 HB1 ALA B 134 -2.601 7.433 3.271 1.00 30.12 H new ATOM 0 HB2 ALA B 134 -2.049 5.754 3.479 1.00 30.12 H new ATOM 0 HB3 ALA B 134 -3.074 6.514 4.720 1.00 30.12 H new ATOM 1689 N TYR B 135 -1.219 9.607 4.727 1.00 54.25 N ATOM 1690 CA TYR B 135 -1.391 10.960 5.279 1.00 54.13 C ATOM 1691 C TYR B 135 -2.465 11.699 4.461 1.00 45.44 C ATOM 1692 O TYR B 135 -2.704 11.318 3.326 1.00 3.43 O ATOM 1693 CB TYR B 135 -0.020 11.690 5.246 1.00 62.42 C ATOM 1694 CG TYR B 135 1.017 11.119 6.237 1.00 44.50 C ATOM 1695 CD1 TYR B 135 1.705 9.930 5.969 1.00 4.23 C ATOM 1696 CD2 TYR B 135 1.289 11.757 7.451 1.00 64.20 C ATOM 1697 CE1 TYR B 135 2.618 9.408 6.862 1.00 53.02 C ATOM 1698 CE2 TYR B 135 2.201 11.237 8.345 1.00 75.51 C ATOM 1699 CZ TYR B 135 2.861 10.064 8.050 1.00 62.10 C ATOM 1700 OH TYR B 135 3.771 9.549 8.946 1.00 41.03 O ATOM 0 H TYR B 135 -1.008 9.600 3.729 1.00 54.25 H new ATOM 0 HA TYR B 135 -1.728 10.926 6.315 1.00 54.13 H new ATOM 0 HB2 TYR B 135 0.387 11.633 4.236 1.00 62.42 H new ATOM 0 HB3 TYR B 135 -0.176 12.746 5.467 1.00 62.42 H new ATOM 0 HD1 TYR B 135 1.517 9.409 5.042 1.00 4.23 H new ATOM 0 HD2 TYR B 135 0.775 12.675 7.693 1.00 64.20 H new ATOM 0 HE1 TYR B 135 3.139 8.491 6.632 1.00 53.02 H new ATOM 0 HE2 TYR B 135 2.398 11.749 9.276 1.00 75.51 H new ATOM 0 HH TYR B 135 3.824 10.134 9.731 1.00 41.03 H new ATOM 1710 N PRO B 136 -3.142 12.763 5.005 1.00 34.32 N ATOM 1711 CA PRO B 136 -4.245 13.468 4.277 1.00 1.11 C ATOM 1712 C PRO B 136 -3.773 14.325 3.073 1.00 31.04 C ATOM 1713 O PRO B 136 -4.594 15.019 2.450 1.00 51.10 O ATOM 1714 CB PRO B 136 -4.883 14.340 5.392 1.00 33.21 C ATOM 1715 CG PRO B 136 -3.763 14.606 6.353 1.00 42.24 C ATOM 1716 CD PRO B 136 -2.926 13.343 6.364 1.00 4.21 C ATOM 0 HA PRO B 136 -4.934 12.765 3.809 1.00 1.11 H new ATOM 0 HB2 PRO B 136 -5.286 15.268 4.987 1.00 33.21 H new ATOM 0 HB3 PRO B 136 -5.708 13.820 5.879 1.00 33.21 H new ATOM 0 HG2 PRO B 136 -3.171 15.465 6.037 1.00 42.24 H new ATOM 0 HG3 PRO B 136 -4.146 14.831 7.348 1.00 42.24 H new ATOM 0 HD2 PRO B 136 -1.873 13.562 6.543 1.00 4.21 H new ATOM 0 HD3 PRO B 136 -3.247 12.657 7.148 1.00 4.21 H new ATOM 1724 N SER B 137 -2.469 14.252 2.739 1.00 44.40 N ATOM 1725 CA SER B 137 -1.862 15.041 1.660 1.00 33.12 C ATOM 1726 C SER B 137 -0.581 14.346 1.167 1.00 30.51 C ATOM 1727 O SER B 137 0.087 13.641 1.942 1.00 41.34 O ATOM 1728 CB SER B 137 -1.577 16.477 2.162 1.00 63.11 C ATOM 1729 OG SER B 137 -0.868 17.255 1.212 1.00 13.53 O ATOM 0 H SER B 137 -1.808 13.639 3.216 1.00 44.40 H new ATOM 0 HA SER B 137 -2.550 15.111 0.817 1.00 33.12 H new ATOM 0 HB2 SER B 137 -2.520 16.969 2.398 1.00 63.11 H new ATOM 0 HB3 SER B 137 -1.003 16.427 3.087 1.00 63.11 H new ATOM 0 HG SER B 137 -0.714 18.153 1.574 1.00 13.53 H new ATOM 1735 N TYR B 138 -0.256 14.559 -0.129 1.00 10.12 N ATOM 1736 CA TYR B 138 0.860 13.894 -0.823 1.00 11.34 C ATOM 1737 C TYR B 138 2.205 14.112 -0.118 1.00 24.22 C ATOM 1738 O TYR B 138 2.864 13.145 0.245 1.00 1.13 O ATOM 1739 CB TYR B 138 0.944 14.371 -2.302 1.00 0.04 C ATOM 1740 CG TYR B 138 2.231 13.938 -3.048 1.00 3.45 C ATOM 1741 CD1 TYR B 138 2.426 12.614 -3.452 1.00 54.40 C ATOM 1742 CD2 TYR B 138 3.260 14.852 -3.314 1.00 54.54 C ATOM 1743 CE1 TYR B 138 3.591 12.222 -4.087 1.00 72.20 C ATOM 1744 CE2 TYR B 138 4.418 14.461 -3.954 1.00 33.22 C ATOM 1745 CZ TYR B 138 4.579 13.147 -4.333 1.00 22.12 C ATOM 1746 OH TYR B 138 5.740 12.756 -4.957 1.00 64.24 O ATOM 0 H TYR B 138 -0.771 15.207 -0.726 1.00 10.12 H new ATOM 0 HA TYR B 138 0.654 12.824 -0.800 1.00 11.34 H new ATOM 0 HB2 TYR B 138 0.079 13.987 -2.843 1.00 0.04 H new ATOM 0 HB3 TYR B 138 0.876 15.459 -2.323 1.00 0.04 H new ATOM 0 HD1 TYR B 138 1.653 11.884 -3.265 1.00 54.40 H new ATOM 0 HD2 TYR B 138 3.144 15.882 -3.012 1.00 54.54 H new ATOM 0 HE1 TYR B 138 3.724 11.194 -4.388 1.00 72.20 H new ATOM 0 HE2 TYR B 138 5.195 15.183 -4.157 1.00 33.22 H new ATOM 0 HH TYR B 138 6.334 13.529 -5.057 1.00 64.24 H new ATOM 1756 N ASP B 139 2.596 15.387 0.065 1.00 31.35 N ATOM 1757 CA ASP B 139 3.950 15.737 0.542 1.00 61.24 C ATOM 1758 C ASP B 139 4.144 15.374 2.025 1.00 61.42 C ATOM 1759 O ASP B 139 5.279 15.272 2.494 1.00 1.33 O ATOM 1760 CB ASP B 139 4.263 17.231 0.276 1.00 22.11 C ATOM 1761 CG ASP B 139 5.720 17.636 0.594 1.00 63.32 C ATOM 1762 OD1 ASP B 139 6.652 16.996 0.060 1.00 51.34 O ATOM 1763 OD2 ASP B 139 5.938 18.579 1.382 1.00 35.45 O ATOM 0 H ASP B 139 1.995 16.192 -0.110 1.00 31.35 H new ATOM 0 HA ASP B 139 4.663 15.141 -0.027 1.00 61.24 H new ATOM 0 HB2 ASP B 139 4.055 17.454 -0.771 1.00 22.11 H new ATOM 0 HB3 ASP B 139 3.588 17.845 0.873 1.00 22.11 H new ATOM 1768 N GLU B 140 3.028 15.148 2.743 1.00 52.02 N ATOM 1769 CA GLU B 140 3.062 14.664 4.134 1.00 43.12 C ATOM 1770 C GLU B 140 3.523 13.193 4.163 1.00 42.32 C ATOM 1771 O GLU B 140 4.298 12.784 5.038 1.00 34.52 O ATOM 1772 CB GLU B 140 1.670 14.802 4.800 1.00 35.05 C ATOM 1773 CG GLU B 140 0.996 16.177 4.647 1.00 24.15 C ATOM 1774 CD GLU B 140 1.893 17.364 5.023 1.00 34.33 C ATOM 1775 OE1 GLU B 140 2.162 17.567 6.227 1.00 11.33 O ATOM 1776 OE2 GLU B 140 2.323 18.113 4.112 1.00 34.04 O ATOM 0 H GLU B 140 2.087 15.294 2.379 1.00 52.02 H new ATOM 0 HA GLU B 140 3.769 15.273 4.697 1.00 43.12 H new ATOM 0 HB2 GLU B 140 1.009 14.044 4.380 1.00 35.05 H new ATOM 0 HB3 GLU B 140 1.772 14.583 5.863 1.00 35.05 H new ATOM 0 HG2 GLU B 140 0.670 16.296 3.614 1.00 24.15 H new ATOM 0 HG3 GLU B 140 0.101 16.201 5.269 1.00 24.15 H new ATOM 1783 N ALA B 141 3.033 12.403 3.180 1.00 2.40 N ATOM 1784 CA ALA B 141 3.434 11.005 3.003 1.00 71.42 C ATOM 1785 C ALA B 141 4.858 10.944 2.437 1.00 52.41 C ATOM 1786 O ALA B 141 5.694 10.166 2.899 1.00 51.55 O ATOM 1787 CB ALA B 141 2.434 10.295 2.082 1.00 23.45 C ATOM 0 H ALA B 141 2.351 12.724 2.493 1.00 2.40 H new ATOM 0 HA ALA B 141 3.431 10.493 3.965 1.00 71.42 H new ATOM 0 HB1 ALA B 141 2.734 9.255 1.952 1.00 23.45 H new ATOM 0 HB2 ALA B 141 1.440 10.333 2.527 1.00 23.45 H new ATOM 0 HB3 ALA B 141 2.417 10.792 1.112 1.00 23.45 H new ATOM 1793 N HIS B 142 5.123 11.831 1.461 1.00 71.13 N ATOM 1794 CA HIS B 142 6.431 11.974 0.809 1.00 73.41 C ATOM 1795 C HIS B 142 7.521 12.283 1.842 1.00 33.31 C ATOM 1796 O HIS B 142 8.629 11.787 1.739 1.00 10.14 O ATOM 1797 CB HIS B 142 6.362 13.084 -0.281 1.00 3.10 C ATOM 1798 CG HIS B 142 7.670 13.412 -0.962 1.00 61.04 C ATOM 1799 ND1 HIS B 142 8.057 14.698 -1.249 1.00 61.21 N ATOM 1800 CD2 HIS B 142 8.677 12.622 -1.405 1.00 32.35 C ATOM 1801 CE1 HIS B 142 9.233 14.685 -1.829 1.00 10.03 C ATOM 1802 NE2 HIS B 142 9.632 13.439 -1.936 1.00 63.11 N ATOM 0 H HIS B 142 4.421 12.477 1.100 1.00 71.13 H new ATOM 0 HA HIS B 142 6.690 11.031 0.327 1.00 73.41 H new ATOM 0 HB2 HIS B 142 5.644 12.777 -1.042 1.00 3.10 H new ATOM 0 HB3 HIS B 142 5.973 13.994 0.176 1.00 3.10 H new ATOM 0 HD1 HIS B 142 7.513 15.536 -1.043 1.00 61.21 H new ATOM 0 HD2 HIS B 142 8.717 11.544 -1.348 1.00 32.35 H new ATOM 0 HE1 HIS B 142 9.781 15.554 -2.163 1.00 10.03 H new ATOM 1811 N LYS B 143 7.167 13.064 2.860 1.00 22.25 N ATOM 1812 CA LYS B 143 8.100 13.454 3.916 1.00 43.44 C ATOM 1813 C LYS B 143 8.415 12.253 4.819 1.00 11.11 C ATOM 1814 O LYS B 143 9.560 12.071 5.257 1.00 74.34 O ATOM 1815 CB LYS B 143 7.514 14.634 4.742 1.00 65.12 C ATOM 1816 CG LYS B 143 8.583 15.615 5.257 1.00 4.33 C ATOM 1817 CD LYS B 143 9.313 16.315 4.078 1.00 21.45 C ATOM 1818 CE LYS B 143 8.351 17.181 3.234 1.00 13.44 C ATOM 1819 NZ LYS B 143 8.957 17.635 1.960 1.00 51.35 N ATOM 0 H LYS B 143 6.228 13.444 2.977 1.00 22.25 H new ATOM 0 HA LYS B 143 9.032 13.788 3.459 1.00 43.44 H new ATOM 0 HB2 LYS B 143 6.799 15.179 4.125 1.00 65.12 H new ATOM 0 HB3 LYS B 143 6.961 14.233 5.591 1.00 65.12 H new ATOM 0 HG2 LYS B 143 8.116 16.364 5.896 1.00 4.33 H new ATOM 0 HG3 LYS B 143 9.307 15.079 5.871 1.00 4.33 H new ATOM 0 HD2 LYS B 143 10.116 16.940 4.469 1.00 21.45 H new ATOM 0 HD3 LYS B 143 9.777 15.562 3.441 1.00 21.45 H new ATOM 0 HE2 LYS B 143 7.448 16.609 3.019 1.00 13.44 H new ATOM 0 HE3 LYS B 143 8.046 18.050 3.816 1.00 13.44 H new ATOM 0 HZ1 LYS B 143 9.160 18.653 2.016 1.00 51.35 H new ATOM 0 HZ2 LYS B 143 9.841 17.114 1.791 1.00 51.35 H new ATOM 0 HZ3 LYS B 143 8.295 17.457 1.178 1.00 51.35 H new ATOM 1833 N ALA B 144 7.390 11.414 5.031 1.00 11.31 N ATOM 1834 CA ALA B 144 7.481 10.233 5.894 1.00 23.11 C ATOM 1835 C ALA B 144 8.392 9.160 5.273 1.00 34.52 C ATOM 1836 O ALA B 144 8.973 8.364 5.996 1.00 44.30 O ATOM 1837 CB ALA B 144 6.085 9.662 6.163 1.00 4.34 C ATOM 0 H ALA B 144 6.472 11.539 4.605 1.00 11.31 H new ATOM 0 HA ALA B 144 7.923 10.540 6.842 1.00 23.11 H new ATOM 0 HB1 ALA B 144 6.168 8.785 6.805 1.00 4.34 H new ATOM 0 HB2 ALA B 144 5.472 10.416 6.656 1.00 4.34 H new ATOM 0 HB3 ALA B 144 5.620 9.378 5.219 1.00 4.34 H new ATOM 1843 N TRP B 145 8.513 9.183 3.925 1.00 1.54 N ATOM 1844 CA TRP B 145 9.358 8.248 3.148 1.00 31.33 C ATOM 1845 C TRP B 145 10.810 8.259 3.683 1.00 14.05 C ATOM 1846 O TRP B 145 11.350 7.221 4.088 1.00 71.24 O ATOM 1847 CB TRP B 145 9.271 8.621 1.605 1.00 63.51 C ATOM 1848 CG TRP B 145 10.587 8.586 0.831 1.00 70.20 C ATOM 1849 CD1 TRP B 145 11.236 7.479 0.363 1.00 72.44 C ATOM 1850 CD2 TRP B 145 11.399 9.717 0.429 1.00 71.52 C ATOM 1851 NE1 TRP B 145 12.404 7.835 -0.253 1.00 74.33 N ATOM 1852 CE2 TRP B 145 12.531 9.196 -0.229 1.00 14.03 C ATOM 1853 CE3 TRP B 145 11.299 11.112 0.573 1.00 13.14 C ATOM 1854 CZ2 TRP B 145 13.536 10.009 -0.735 1.00 73.44 C ATOM 1855 CZ3 TRP B 145 12.298 11.912 0.071 1.00 4.40 C ATOM 1856 CH2 TRP B 145 13.404 11.359 -0.573 1.00 33.23 C ATOM 0 H TRP B 145 8.021 9.859 3.341 1.00 1.54 H new ATOM 0 HA TRP B 145 8.993 7.228 3.265 1.00 31.33 H new ATOM 0 HB2 TRP B 145 8.572 7.936 1.125 1.00 63.51 H new ATOM 0 HB3 TRP B 145 8.848 9.622 1.517 1.00 63.51 H new ATOM 0 HD1 TRP B 145 10.877 6.465 0.465 1.00 72.44 H new ATOM 0 HE1 TRP B 145 13.075 7.187 -0.666 1.00 74.33 H new ATOM 0 HE3 TRP B 145 10.447 11.550 1.072 1.00 13.14 H new ATOM 0 HZ2 TRP B 145 14.393 9.588 -1.240 1.00 73.44 H new ATOM 0 HZ3 TRP B 145 12.225 12.984 0.177 1.00 4.40 H new ATOM 0 HH2 TRP B 145 14.175 12.013 -0.953 1.00 33.23 H new ATOM 1867 N LYS B 146 11.401 9.462 3.725 1.00 24.44 N ATOM 1868 CA LYS B 146 12.822 9.639 4.069 1.00 13.21 C ATOM 1869 C LYS B 146 13.006 9.742 5.585 1.00 44.14 C ATOM 1870 O LYS B 146 14.068 9.390 6.108 1.00 12.50 O ATOM 1871 CB LYS B 146 13.384 10.868 3.328 1.00 52.44 C ATOM 1872 CG LYS B 146 14.890 11.125 3.511 1.00 13.11 C ATOM 1873 CD LYS B 146 15.413 12.261 2.597 1.00 32.31 C ATOM 1874 CE LYS B 146 16.922 12.494 2.749 1.00 74.30 C ATOM 1875 NZ LYS B 146 17.421 13.589 1.877 1.00 4.31 N ATOM 0 H LYS B 146 10.913 10.335 3.523 1.00 24.44 H new ATOM 0 HA LYS B 146 13.386 8.764 3.745 1.00 13.21 H new ATOM 0 HB2 LYS B 146 13.180 10.752 2.263 1.00 52.44 H new ATOM 0 HB3 LYS B 146 12.840 11.751 3.662 1.00 52.44 H new ATOM 0 HG2 LYS B 146 15.088 11.380 4.552 1.00 13.11 H new ATOM 0 HG3 LYS B 146 15.440 10.209 3.297 1.00 13.11 H new ATOM 0 HD2 LYS B 146 15.190 12.018 1.558 1.00 32.31 H new ATOM 0 HD3 LYS B 146 14.881 13.184 2.830 1.00 32.31 H new ATOM 0 HE2 LYS B 146 17.146 12.732 3.789 1.00 74.30 H new ATOM 0 HE3 LYS B 146 17.454 11.573 2.510 1.00 74.30 H new ATOM 0 HZ1 LYS B 146 18.445 13.706 2.018 1.00 4.31 H new ATOM 0 HZ2 LYS B 146 17.233 13.353 0.882 1.00 4.31 H new ATOM 0 HZ3 LYS B 146 16.935 14.476 2.121 1.00 4.31 H new ATOM 1889 N ALA B 147 11.947 10.191 6.292 1.00 10.30 N ATOM 1890 CA ALA B 147 11.921 10.199 7.765 1.00 65.24 C ATOM 1891 C ALA B 147 12.084 8.765 8.298 1.00 62.12 C ATOM 1892 O ALA B 147 12.823 8.525 9.247 1.00 1.32 O ATOM 1893 CB ALA B 147 10.611 10.824 8.277 1.00 74.45 C ATOM 0 H ALA B 147 11.097 10.554 5.861 1.00 10.30 H new ATOM 0 HA ALA B 147 12.750 10.805 8.131 1.00 65.24 H new ATOM 0 HB1 ALA B 147 10.609 10.822 9.367 1.00 74.45 H new ATOM 0 HB2 ALA B 147 10.532 11.849 7.916 1.00 74.45 H new ATOM 0 HB3 ALA B 147 9.764 10.244 7.911 1.00 74.45 H new ATOM 1899 N LYS B 148 11.412 7.820 7.622 1.00 30.33 N ATOM 1900 CA LYS B 148 11.442 6.395 7.975 1.00 25.05 C ATOM 1901 C LYS B 148 12.765 5.747 7.559 1.00 71.20 C ATOM 1902 O LYS B 148 13.388 5.049 8.357 1.00 1.13 O ATOM 1903 CB LYS B 148 10.246 5.671 7.313 1.00 24.10 C ATOM 1904 CG LYS B 148 8.878 5.991 7.944 1.00 21.31 C ATOM 1905 CD LYS B 148 8.769 5.559 9.420 1.00 5.22 C ATOM 1906 CE LYS B 148 8.980 4.056 9.604 1.00 14.23 C ATOM 1907 NZ LYS B 148 8.708 3.625 10.994 1.00 52.43 N ATOM 0 H LYS B 148 10.829 8.026 6.810 1.00 30.33 H new ATOM 0 HA LYS B 148 11.361 6.304 9.058 1.00 25.05 H new ATOM 0 HB2 LYS B 148 10.216 5.937 6.256 1.00 24.10 H new ATOM 0 HB3 LYS B 148 10.414 4.595 7.366 1.00 24.10 H new ATOM 0 HG2 LYS B 148 8.695 7.063 7.872 1.00 21.31 H new ATOM 0 HG3 LYS B 148 8.096 5.495 7.369 1.00 21.31 H new ATOM 0 HD2 LYS B 148 9.507 6.102 10.010 1.00 5.22 H new ATOM 0 HD3 LYS B 148 7.787 5.835 9.805 1.00 5.22 H new ATOM 0 HE2 LYS B 148 8.327 3.512 8.921 1.00 14.23 H new ATOM 0 HE3 LYS B 148 10.005 3.798 9.338 1.00 14.23 H new ATOM 0 HZ1 LYS B 148 8.429 2.623 10.999 1.00 52.43 H new ATOM 0 HZ2 LYS B 148 9.565 3.748 11.570 1.00 52.43 H new ATOM 0 HZ3 LYS B 148 7.938 4.200 11.392 1.00 52.43 H new ATOM 1921 N ALA B 149 13.185 6.019 6.310 1.00 0.52 N ATOM 1922 CA ALA B 149 14.417 5.454 5.720 1.00 75.22 C ATOM 1923 C ALA B 149 15.673 5.811 6.552 1.00 73.33 C ATOM 1924 O ALA B 149 16.595 4.996 6.681 1.00 13.24 O ATOM 1925 CB ALA B 149 14.557 5.945 4.271 1.00 31.20 C ATOM 0 H ALA B 149 12.679 6.639 5.678 1.00 0.52 H new ATOM 0 HA ALA B 149 14.337 4.367 5.728 1.00 75.22 H new ATOM 0 HB1 ALA B 149 15.465 5.530 3.832 1.00 31.20 H new ATOM 0 HB2 ALA B 149 13.693 5.620 3.692 1.00 31.20 H new ATOM 0 HB3 ALA B 149 14.613 7.033 4.259 1.00 31.20 H new ATOM 1931 N GLN B 150 15.680 7.030 7.120 1.00 25.23 N ATOM 1932 CA GLN B 150 16.785 7.538 7.961 1.00 1.30 C ATOM 1933 C GLN B 150 16.640 7.091 9.431 1.00 11.45 C ATOM 1934 O GLN B 150 17.641 6.999 10.156 1.00 3.44 O ATOM 1935 CB GLN B 150 16.843 9.085 7.875 1.00 13.33 C ATOM 1936 CG GLN B 150 17.268 9.626 6.495 1.00 10.22 C ATOM 1937 CD GLN B 150 17.229 11.153 6.384 1.00 20.43 C ATOM 1938 OE1 GLN B 150 18.059 11.756 5.703 1.00 72.35 O ATOM 1939 NE2 GLN B 150 16.233 11.791 6.991 1.00 1.35 N ATOM 0 H GLN B 150 14.916 7.696 7.009 1.00 25.23 H new ATOM 0 HA GLN B 150 17.715 7.116 7.581 1.00 1.30 H new ATOM 0 HB2 GLN B 150 15.862 9.489 8.124 1.00 13.33 H new ATOM 0 HB3 GLN B 150 17.540 9.454 8.628 1.00 13.33 H new ATOM 0 HG2 GLN B 150 18.279 9.282 6.277 1.00 10.22 H new ATOM 0 HG3 GLN B 150 16.616 9.200 5.733 1.00 10.22 H new ATOM 0 HE21 GLN B 150 15.558 11.269 7.550 1.00 1.35 H new ATOM 0 HE22 GLN B 150 16.144 12.803 6.898 1.00 1.35 H new ATOM 1948 N ALA B 151 15.395 6.838 9.869 1.00 71.13 N ATOM 1949 CA ALA B 151 15.109 6.401 11.252 1.00 53.14 C ATOM 1950 C ALA B 151 15.550 4.946 11.467 1.00 22.01 C ATOM 1951 O ALA B 151 16.198 4.618 12.470 1.00 61.04 O ATOM 1952 CB ALA B 151 13.612 6.563 11.565 1.00 1.14 C ATOM 0 H ALA B 151 14.564 6.928 9.284 1.00 71.13 H new ATOM 0 HA ALA B 151 15.678 7.032 11.935 1.00 53.14 H new ATOM 0 HB1 ALA B 151 13.417 6.237 12.587 1.00 1.14 H new ATOM 0 HB2 ALA B 151 13.329 7.610 11.458 1.00 1.14 H new ATOM 0 HB3 ALA B 151 13.028 5.957 10.873 1.00 1.14 H new ATOM 1958 N THR B 152 15.240 4.099 10.477 1.00 4.32 N ATOM 1959 CA THR B 152 15.384 2.638 10.570 1.00 63.32 C ATOM 1960 C THR B 152 16.778 2.162 10.100 1.00 43.43 C ATOM 1961 O THR B 152 16.906 1.131 9.424 1.00 44.40 O ATOM 1962 CB THR B 152 14.259 1.964 9.727 1.00 42.03 C ATOM 1963 OG1 THR B 152 14.378 2.376 8.351 1.00 51.51 O ATOM 1964 CG2 THR B 152 12.858 2.328 10.256 1.00 61.20 C ATOM 0 H THR B 152 14.877 4.412 9.577 1.00 4.32 H new ATOM 0 HA THR B 152 15.289 2.346 11.616 1.00 63.32 H new ATOM 0 HB THR B 152 14.378 0.883 9.807 1.00 42.03 H new ATOM 0 HG1 THR B 152 13.982 3.266 8.240 1.00 51.51 H new ATOM 0 HG21 THR B 152 12.100 1.840 9.644 1.00 61.20 H new ATOM 0 HG22 THR B 152 12.761 1.993 11.289 1.00 61.20 H new ATOM 0 HG23 THR B 152 12.721 3.408 10.210 1.00 61.20 H new ATOM 1972 N VAL B 153 17.824 2.906 10.503 1.00 70.33 N ATOM 1973 CA VAL B 153 19.232 2.535 10.240 1.00 35.34 C ATOM 1974 C VAL B 153 19.644 1.284 11.039 1.00 64.13 C ATOM 1975 O VAL B 153 20.559 0.552 10.643 1.00 14.23 O ATOM 1976 CB VAL B 153 20.218 3.717 10.567 1.00 13.23 C ATOM 1977 CG1 VAL B 153 20.041 4.867 9.558 1.00 13.15 C ATOM 1978 CG2 VAL B 153 20.050 4.227 12.026 1.00 32.31 C ATOM 0 H VAL B 153 17.721 3.780 11.019 1.00 70.33 H new ATOM 0 HA VAL B 153 19.300 2.312 9.175 1.00 35.34 H new ATOM 0 HB VAL B 153 21.233 3.330 10.477 1.00 13.23 H new ATOM 0 HG11 VAL B 153 20.732 5.674 9.802 1.00 13.15 H new ATOM 0 HG12 VAL B 153 20.248 4.503 8.552 1.00 13.15 H new ATOM 0 HG13 VAL B 153 19.017 5.239 9.606 1.00 13.15 H new ATOM 0 HG21 VAL B 153 20.750 5.043 12.209 1.00 32.31 H new ATOM 0 HG22 VAL B 153 19.030 4.584 12.172 1.00 32.31 H new ATOM 0 HG23 VAL B 153 20.252 3.413 12.722 1.00 32.31 H new ATOM 1988 N ASP B 154 18.967 1.074 12.174 1.00 23.31 N ATOM 1989 CA ASP B 154 19.170 -0.101 13.046 1.00 74.51 C ATOM 1990 C ASP B 154 18.599 -1.377 12.401 1.00 11.54 C ATOM 1991 O ASP B 154 19.128 -2.477 12.608 1.00 72.14 O ATOM 1992 CB ASP B 154 18.505 0.152 14.420 1.00 55.33 C ATOM 1993 CG ASP B 154 19.092 1.378 15.137 1.00 75.01 C ATOM 1994 OD1 ASP B 154 20.115 1.236 15.841 1.00 1.33 O ATOM 1995 OD2 ASP B 154 18.547 2.495 14.977 1.00 53.33 O ATOM 0 H ASP B 154 18.255 1.717 12.521 1.00 23.31 H new ATOM 0 HA ASP B 154 20.241 -0.250 13.184 1.00 74.51 H new ATOM 0 HB2 ASP B 154 17.433 0.294 14.281 1.00 55.33 H new ATOM 0 HB3 ASP B 154 18.631 -0.729 15.050 1.00 55.33 H new ATOM 2000 N ASN B 155 17.516 -1.212 11.616 1.00 63.05 N ATOM 2001 CA ASN B 155 16.846 -2.310 10.923 1.00 3.00 C ATOM 2002 C ASN B 155 17.570 -2.522 9.571 1.00 22.01 C ATOM 2003 O ASN B 155 17.706 -1.568 8.791 1.00 71.41 O ATOM 2004 CB ASN B 155 15.346 -1.957 10.737 1.00 74.10 C ATOM 2005 CG ASN B 155 14.500 -3.173 10.394 1.00 42.42 C ATOM 2006 OD1 ASN B 155 14.490 -3.552 9.142 1.00 31.41 O flip ATOM 2007 ND2 ASN B 155 13.898 -3.798 11.266 1.00 1.23 N flip ATOM 0 H ASN B 155 17.085 -0.303 11.449 1.00 63.05 H new ATOM 0 HA ASN B 155 16.890 -3.237 11.494 1.00 3.00 H new ATOM 0 HB2 ASN B 155 14.967 -1.501 11.652 1.00 74.10 H new ATOM 0 HB3 ASN B 155 15.246 -1.214 9.946 1.00 74.10 H new ATOM 0 HD21 ASN B 155 13.925 -3.477 12.234 1.00 1.23 H new ATOM 0 HD22 ASN B 155 13.372 -4.637 11.021 1.00 1.23 H new ATOM 2014 N ALA B 156 18.006 -3.773 9.314 1.00 34.00 N ATOM 2015 CA ALA B 156 19.036 -4.109 8.297 1.00 62.21 C ATOM 2016 C ALA B 156 18.738 -3.568 6.876 1.00 72.44 C ATOM 2017 O ALA B 156 19.329 -2.573 6.467 1.00 73.03 O ATOM 2018 CB ALA B 156 19.276 -5.634 8.281 1.00 44.24 C ATOM 0 H ALA B 156 17.651 -4.591 9.810 1.00 34.00 H new ATOM 0 HA ALA B 156 19.947 -3.594 8.600 1.00 62.21 H new ATOM 0 HB1 ALA B 156 20.032 -5.876 7.534 1.00 44.24 H new ATOM 0 HB2 ALA B 156 19.620 -5.959 9.263 1.00 44.24 H new ATOM 0 HB3 ALA B 156 18.346 -6.146 8.035 1.00 44.24 H new ATOM 2024 N HIS B 157 17.807 -4.205 6.150 1.00 11.01 N ATOM 2025 CA HIS B 157 17.538 -3.901 4.716 1.00 3.23 C ATOM 2026 C HIS B 157 16.341 -2.940 4.548 1.00 63.51 C ATOM 2027 O HIS B 157 15.678 -2.939 3.507 1.00 35.13 O ATOM 2028 CB HIS B 157 17.265 -5.219 3.955 1.00 53.22 C ATOM 2029 CG HIS B 157 18.461 -6.100 3.740 1.00 13.23 C ATOM 2030 ND1 HIS B 157 18.930 -6.426 2.489 1.00 44.44 N ATOM 2031 CD2 HIS B 157 19.261 -6.751 4.617 1.00 63.53 C ATOM 2032 CE1 HIS B 157 19.959 -7.234 2.606 1.00 22.50 C ATOM 2033 NE2 HIS B 157 20.185 -7.449 3.885 1.00 52.12 N ATOM 0 H HIS B 157 17.215 -4.945 6.529 1.00 11.01 H new ATOM 0 HA HIS B 157 18.417 -3.406 4.304 1.00 3.23 H new ATOM 0 HB2 HIS B 157 16.512 -5.785 4.503 1.00 53.22 H new ATOM 0 HB3 HIS B 157 16.836 -4.975 2.983 1.00 53.22 H new ATOM 0 HD2 HIS B 157 19.185 -6.725 5.694 1.00 63.53 H new ATOM 0 HE1 HIS B 157 20.526 -7.653 1.788 1.00 22.50 H new ATOM 0 HE2 HIS B 157 20.925 -8.038 4.267 1.00 52.12 H new ATOM 2042 N ALA B 158 16.119 -2.084 5.544 1.00 63.12 N ATOM 2043 CA ALA B 158 14.897 -1.267 5.653 1.00 52.42 C ATOM 2044 C ALA B 158 14.997 0.032 4.831 1.00 30.45 C ATOM 2045 O ALA B 158 15.527 1.048 5.303 1.00 2.03 O ATOM 2046 CB ALA B 158 14.587 -0.974 7.122 1.00 11.43 C ATOM 0 H ALA B 158 16.781 -1.932 6.305 1.00 63.12 H new ATOM 0 HA ALA B 158 14.072 -1.841 5.232 1.00 52.42 H new ATOM 0 HB1 ALA B 158 13.682 -0.370 7.189 1.00 11.43 H new ATOM 0 HB2 ALA B 158 14.438 -1.912 7.656 1.00 11.43 H new ATOM 0 HB3 ALA B 158 15.420 -0.431 7.568 1.00 11.43 H new ATOM 2052 N ARG B 159 14.514 -0.041 3.582 1.00 34.12 N ATOM 2053 CA ARG B 159 14.445 1.100 2.642 1.00 13.02 C ATOM 2054 C ARG B 159 12.966 1.395 2.397 1.00 0.20 C ATOM 2055 O ARG B 159 12.279 0.647 1.690 1.00 53.41 O ATOM 2056 CB ARG B 159 15.184 0.813 1.288 1.00 13.13 C ATOM 2057 CG ARG B 159 16.729 0.900 1.311 1.00 30.13 C ATOM 2058 CD ARG B 159 17.365 -0.048 2.327 1.00 33.34 C ATOM 2059 NE ARG B 159 18.830 -0.034 2.279 1.00 3.15 N ATOM 2060 CZ ARG B 159 19.643 -0.427 3.267 1.00 4.15 C ATOM 2061 NH1 ARG B 159 19.146 -0.870 4.410 1.00 53.31 N ATOM 2062 NH2 ARG B 159 20.951 -0.390 3.092 1.00 20.42 N ATOM 0 H ARG B 159 14.153 -0.908 3.185 1.00 34.12 H new ATOM 0 HA ARG B 159 14.953 1.959 3.080 1.00 13.02 H new ATOM 0 HB2 ARG B 159 14.904 -0.185 0.952 1.00 13.13 H new ATOM 0 HB3 ARG B 159 14.814 1.516 0.542 1.00 13.13 H new ATOM 0 HG2 ARG B 159 17.115 0.671 0.318 1.00 30.13 H new ATOM 0 HG3 ARG B 159 17.026 1.923 1.541 1.00 30.13 H new ATOM 0 HD2 ARG B 159 17.036 0.228 3.329 1.00 33.34 H new ATOM 0 HD3 ARG B 159 17.010 -1.062 2.143 1.00 33.34 H new ATOM 0 HE ARG B 159 19.266 0.303 1.421 1.00 3.15 H new ATOM 0 HH11 ARG B 159 18.136 -0.914 4.544 1.00 53.31 H new ATOM 0 HH12 ARG B 159 19.773 -1.167 5.158 1.00 53.31 H new ATOM 0 HH21 ARG B 159 21.338 -0.063 2.207 1.00 20.42 H new ATOM 0 HH22 ARG B 159 21.575 -0.688 3.842 1.00 20.42 H new ATOM 2076 N TYR B 160 12.473 2.439 3.061 1.00 30.24 N ATOM 2077 CA TYR B 160 11.075 2.866 2.970 1.00 55.24 C ATOM 2078 C TYR B 160 10.874 3.795 1.771 1.00 22.14 C ATOM 2079 O TYR B 160 11.724 4.638 1.479 1.00 3.04 O ATOM 2080 CB TYR B 160 10.637 3.533 4.294 1.00 0.31 C ATOM 2081 CG TYR B 160 10.603 2.542 5.468 1.00 72.03 C ATOM 2082 CD1 TYR B 160 11.773 2.105 6.075 1.00 2.14 C ATOM 2083 CD2 TYR B 160 9.403 2.032 5.952 1.00 3.24 C ATOM 2084 CE1 TYR B 160 11.743 1.195 7.100 1.00 25.50 C ATOM 2085 CE2 TYR B 160 9.369 1.125 6.986 1.00 53.51 C ATOM 2086 CZ TYR B 160 10.546 0.710 7.562 1.00 15.05 C ATOM 2087 OH TYR B 160 10.536 -0.201 8.596 1.00 23.51 O ATOM 0 H TYR B 160 13.036 3.018 3.683 1.00 30.24 H new ATOM 0 HA TYR B 160 10.443 1.992 2.812 1.00 55.24 H new ATOM 0 HB2 TYR B 160 11.321 4.348 4.530 1.00 0.31 H new ATOM 0 HB3 TYR B 160 9.648 3.974 4.166 1.00 0.31 H new ATOM 0 HD1 TYR B 160 12.723 2.489 5.734 1.00 2.14 H new ATOM 0 HD2 TYR B 160 8.475 2.356 5.505 1.00 3.24 H new ATOM 0 HE1 TYR B 160 12.667 0.858 7.546 1.00 25.50 H new ATOM 0 HE2 TYR B 160 8.424 0.742 7.343 1.00 53.51 H new ATOM 0 HH TYR B 160 11.413 -0.210 9.032 1.00 23.51 H new ATOM 2097 N PHE B 161 9.744 3.593 1.079 1.00 50.03 N ATOM 2098 CA PHE B 161 9.385 4.308 -0.155 1.00 51.24 C ATOM 2099 C PHE B 161 7.898 4.700 -0.129 1.00 24.13 C ATOM 2100 O PHE B 161 7.241 4.666 0.922 1.00 45.10 O ATOM 2101 CB PHE B 161 9.695 3.424 -1.401 1.00 12.12 C ATOM 2102 CG PHE B 161 11.178 3.170 -1.648 1.00 74.30 C ATOM 2103 CD1 PHE B 161 11.986 4.173 -2.180 1.00 34.12 C ATOM 2104 CD2 PHE B 161 11.764 1.939 -1.353 1.00 34.53 C ATOM 2105 CE1 PHE B 161 13.330 3.953 -2.406 1.00 51.21 C ATOM 2106 CE2 PHE B 161 13.109 1.720 -1.581 1.00 23.40 C ATOM 2107 CZ PHE B 161 13.893 2.726 -2.108 1.00 30.32 C ATOM 0 H PHE B 161 9.039 2.914 1.367 1.00 50.03 H new ATOM 0 HA PHE B 161 9.982 5.218 -0.220 1.00 51.24 H new ATOM 0 HB2 PHE B 161 9.190 2.465 -1.284 1.00 12.12 H new ATOM 0 HB3 PHE B 161 9.270 3.902 -2.284 1.00 12.12 H new ATOM 0 HD1 PHE B 161 11.555 5.134 -2.418 1.00 34.12 H new ATOM 0 HD2 PHE B 161 11.158 1.146 -0.941 1.00 34.53 H new ATOM 0 HE1 PHE B 161 13.943 4.741 -2.817 1.00 51.21 H new ATOM 0 HE2 PHE B 161 13.547 0.761 -1.347 1.00 23.40 H new ATOM 0 HZ PHE B 161 14.944 2.555 -2.287 1.00 30.32 H new ATOM 2117 N ILE B 162 7.388 5.102 -1.303 1.00 15.11 N ATOM 2118 CA ILE B 162 5.992 5.504 -1.504 1.00 33.25 C ATOM 2119 C ILE B 162 5.406 4.649 -2.639 1.00 64.01 C ATOM 2120 O ILE B 162 6.154 4.041 -3.403 1.00 22.41 O ATOM 2121 CB ILE B 162 5.892 7.035 -1.907 1.00 24.44 C ATOM 2122 CG1 ILE B 162 6.971 7.897 -1.175 1.00 25.52 C ATOM 2123 CG2 ILE B 162 4.481 7.582 -1.618 1.00 41.54 C ATOM 2124 CD1 ILE B 162 7.042 9.344 -1.624 1.00 4.11 C ATOM 0 H ILE B 162 7.947 5.157 -2.154 1.00 15.11 H new ATOM 0 HA ILE B 162 5.441 5.358 -0.575 1.00 33.25 H new ATOM 0 HB ILE B 162 6.083 7.104 -2.978 1.00 24.44 H new ATOM 0 HG12 ILE B 162 6.769 7.873 -0.104 1.00 25.52 H new ATOM 0 HG13 ILE B 162 7.947 7.436 -1.326 1.00 25.52 H new ATOM 0 HG21 ILE B 162 4.433 8.633 -1.901 1.00 41.54 H new ATOM 0 HG22 ILE B 162 3.747 7.018 -2.193 1.00 41.54 H new ATOM 0 HG23 ILE B 162 4.263 7.483 -0.555 1.00 41.54 H new ATOM 0 HD11 ILE B 162 7.818 9.862 -1.061 1.00 4.11 H new ATOM 0 HD12 ILE B 162 7.277 9.384 -2.688 1.00 4.11 H new ATOM 0 HD13 ILE B 162 6.081 9.828 -1.447 1.00 4.11 H new ATOM 2136 N ILE B 163 4.069 4.562 -2.717 1.00 41.15 N ATOM 2137 CA ILE B 163 3.355 4.111 -3.930 1.00 74.24 C ATOM 2138 C ILE B 163 2.123 5.010 -4.113 1.00 11.44 C ATOM 2139 O ILE B 163 1.641 5.608 -3.150 1.00 75.12 O ATOM 2140 CB ILE B 163 2.877 2.602 -3.906 1.00 3.24 C ATOM 2141 CG1 ILE B 163 3.867 1.671 -3.152 1.00 44.21 C ATOM 2142 CG2 ILE B 163 2.684 2.096 -5.357 1.00 61.43 C ATOM 2143 CD1 ILE B 163 3.385 0.239 -2.991 1.00 71.22 C ATOM 0 H ILE B 163 3.449 4.801 -1.943 1.00 41.15 H new ATOM 0 HA ILE B 163 4.067 4.183 -4.752 1.00 74.24 H new ATOM 0 HB ILE B 163 1.932 2.570 -3.364 1.00 3.24 H new ATOM 0 HG12 ILE B 163 4.817 1.664 -3.686 1.00 44.21 H new ATOM 0 HG13 ILE B 163 4.059 2.090 -2.164 1.00 44.21 H new ATOM 0 HG21 ILE B 163 2.355 1.057 -5.339 1.00 61.43 H new ATOM 0 HG22 ILE B 163 1.933 2.706 -5.858 1.00 61.43 H new ATOM 0 HG23 ILE B 163 3.629 2.168 -5.896 1.00 61.43 H new ATOM 0 HD11 ILE B 163 4.137 -0.340 -2.454 1.00 71.22 H new ATOM 0 HD12 ILE B 163 2.451 0.230 -2.429 1.00 71.22 H new ATOM 0 HD13 ILE B 163 3.221 -0.202 -3.974 1.00 71.22 H new ATOM 2155 N HIS B 164 1.612 5.099 -5.347 1.00 42.54 N ATOM 2156 CA HIS B 164 0.404 5.880 -5.646 1.00 52.40 C ATOM 2157 C HIS B 164 -0.847 5.092 -5.218 1.00 71.22 C ATOM 2158 O HIS B 164 -0.969 3.901 -5.513 1.00 63.32 O ATOM 2159 CB HIS B 164 0.335 6.278 -7.153 1.00 61.53 C ATOM 2160 CG HIS B 164 0.009 5.164 -8.127 1.00 74.44 C ATOM 2161 ND1 HIS B 164 -0.954 5.285 -9.106 1.00 3.25 N ATOM 2162 CD2 HIS B 164 0.521 3.918 -8.270 1.00 70.31 C ATOM 2163 CE1 HIS B 164 -1.015 4.167 -9.799 1.00 63.21 C ATOM 2164 NE2 HIS B 164 -0.131 3.326 -9.313 1.00 62.22 N ATOM 0 H HIS B 164 2.019 4.637 -6.160 1.00 42.54 H new ATOM 0 HA HIS B 164 0.445 6.808 -5.076 1.00 52.40 H new ATOM 0 HB2 HIS B 164 -0.414 7.062 -7.266 1.00 61.53 H new ATOM 0 HB3 HIS B 164 1.294 6.711 -7.437 1.00 61.53 H new ATOM 0 HD1 HIS B 164 -1.529 6.111 -9.268 1.00 3.25 H new ATOM 0 HD2 HIS B 164 1.301 3.475 -7.669 1.00 70.31 H new ATOM 0 HE1 HIS B 164 -1.680 3.974 -10.628 1.00 63.21 H new ATOM 2173 N ALA B 165 -1.742 5.760 -4.492 1.00 75.54 N ATOM 2174 CA ALA B 165 -3.054 5.207 -4.119 1.00 34.02 C ATOM 2175 C ALA B 165 -4.166 6.083 -4.693 1.00 24.51 C ATOM 2176 O ALA B 165 -5.305 6.009 -4.252 1.00 3.13 O ATOM 2177 CB ALA B 165 -3.160 5.100 -2.600 1.00 54.00 C ATOM 0 H ALA B 165 -1.582 6.705 -4.142 1.00 75.54 H new ATOM 0 HA ALA B 165 -3.161 4.206 -4.536 1.00 34.02 H new ATOM 0 HB1 ALA B 165 -4.134 4.690 -2.331 1.00 54.00 H new ATOM 0 HB2 ALA B 165 -2.374 4.444 -2.226 1.00 54.00 H new ATOM 0 HB3 ALA B 165 -3.048 6.090 -2.157 1.00 54.00 H new ATOM 2183 N HIS B 166 -3.810 6.927 -5.677 1.00 73.42 N ATOM 2184 CA HIS B 166 -4.784 7.751 -6.396 1.00 12.31 C ATOM 2185 C HIS B 166 -5.451 6.895 -7.487 1.00 21.44 C ATOM 2186 O HIS B 166 -6.653 7.016 -7.734 1.00 21.40 O ATOM 2187 CB HIS B 166 -4.108 9.017 -6.987 1.00 55.43 C ATOM 2188 CG HIS B 166 -5.078 10.133 -7.314 1.00 31.33 C ATOM 2189 ND1 HIS B 166 -5.360 11.159 -6.430 1.00 45.23 N ATOM 2190 CD2 HIS B 166 -5.842 10.374 -8.412 1.00 3.22 C ATOM 2191 CE1 HIS B 166 -6.248 11.973 -6.969 1.00 12.32 C ATOM 2192 NE2 HIS B 166 -6.553 11.519 -8.168 1.00 65.11 N ATOM 0 H HIS B 166 -2.848 7.053 -5.990 1.00 73.42 H new ATOM 0 HA HIS B 166 -5.552 8.100 -5.706 1.00 12.31 H new ATOM 0 HB2 HIS B 166 -3.369 9.388 -6.277 1.00 55.43 H new ATOM 0 HB3 HIS B 166 -3.569 8.740 -7.893 1.00 55.43 H new ATOM 0 HD1 HIS B 166 -4.946 11.269 -5.505 1.00 45.23 H new ATOM 0 HD2 HIS B 166 -5.881 9.774 -9.309 1.00 3.22 H new ATOM 0 HE1 HIS B 166 -6.655 12.860 -6.506 1.00 12.32 H new ATOM 2201 N LYS B 167 -4.637 6.029 -8.132 1.00 54.30 N ATOM 2202 CA LYS B 167 -5.120 4.996 -9.065 1.00 43.33 C ATOM 2203 C LYS B 167 -4.842 3.620 -8.435 1.00 53.43 C ATOM 2204 O LYS B 167 -3.682 3.232 -8.242 1.00 34.34 O ATOM 2205 CB LYS B 167 -4.446 5.140 -10.471 1.00 71.10 C ATOM 2206 CG LYS B 167 -5.064 4.267 -11.614 1.00 75.54 C ATOM 2207 CD LYS B 167 -4.595 2.789 -11.630 1.00 53.01 C ATOM 2208 CE LYS B 167 -5.314 1.948 -12.700 1.00 0.13 C ATOM 2209 NZ LYS B 167 -6.786 1.861 -12.460 1.00 44.35 N ATOM 0 H LYS B 167 -3.624 6.030 -8.017 1.00 54.30 H new ATOM 0 HA LYS B 167 -6.191 5.111 -9.230 1.00 43.33 H new ATOM 0 HB2 LYS B 167 -4.495 6.187 -10.771 1.00 71.10 H new ATOM 0 HB3 LYS B 167 -3.390 4.885 -10.375 1.00 71.10 H new ATOM 0 HG2 LYS B 167 -6.150 4.288 -11.521 1.00 75.54 H new ATOM 0 HG3 LYS B 167 -4.817 4.722 -12.573 1.00 75.54 H new ATOM 0 HD2 LYS B 167 -3.520 2.755 -11.809 1.00 53.01 H new ATOM 0 HD3 LYS B 167 -4.769 2.347 -10.649 1.00 53.01 H new ATOM 0 HE2 LYS B 167 -5.134 2.384 -13.683 1.00 0.13 H new ATOM 0 HE3 LYS B 167 -4.891 0.944 -12.714 1.00 0.13 H new ATOM 0 HZ1 LYS B 167 -7.203 1.166 -13.111 1.00 44.35 H new ATOM 0 HZ2 LYS B 167 -6.961 1.565 -11.479 1.00 44.35 H new ATOM 0 HZ3 LYS B 167 -7.220 2.792 -12.623 1.00 44.35 H new ATOM 2223 N LEU B 168 -5.925 2.936 -8.071 1.00 74.12 N ATOM 2224 CA LEU B 168 -5.927 1.576 -7.529 1.00 50.33 C ATOM 2225 C LEU B 168 -6.011 0.553 -8.683 1.00 1.24 C ATOM 2226 O LEU B 168 -6.591 0.832 -9.742 1.00 43.01 O ATOM 2227 CB LEU B 168 -7.149 1.406 -6.582 1.00 42.33 C ATOM 2228 CG LEU B 168 -7.164 2.239 -5.250 1.00 45.04 C ATOM 2229 CD1 LEU B 168 -6.070 1.784 -4.276 1.00 5.14 C ATOM 2230 CD2 LEU B 168 -7.088 3.761 -5.484 1.00 21.55 C ATOM 0 H LEU B 168 -6.863 3.329 -8.148 1.00 74.12 H new ATOM 0 HA LEU B 168 -5.007 1.403 -6.971 1.00 50.33 H new ATOM 0 HB2 LEU B 168 -8.047 1.659 -7.145 1.00 42.33 H new ATOM 0 HB3 LEU B 168 -7.224 0.351 -6.318 1.00 42.33 H new ATOM 0 HG LEU B 168 -8.133 2.038 -4.793 1.00 45.04 H new ATOM 0 HD11 LEU B 168 -6.117 2.387 -3.369 1.00 5.14 H new ATOM 0 HD12 LEU B 168 -6.222 0.735 -4.023 1.00 5.14 H new ATOM 0 HD13 LEU B 168 -5.093 1.907 -4.743 1.00 5.14 H new ATOM 0 HD21 LEU B 168 -7.102 4.278 -4.524 1.00 21.55 H new ATOM 0 HD22 LEU B 168 -6.166 4.002 -6.012 1.00 21.55 H new ATOM 0 HD23 LEU B 168 -7.942 4.080 -6.081 1.00 21.55 H new ATOM 2242 N LEU B 169 -5.439 -0.628 -8.466 1.00 34.30 N ATOM 2243 CA LEU B 169 -5.483 -1.744 -9.421 1.00 15.42 C ATOM 2244 C LEU B 169 -6.675 -2.654 -9.096 1.00 14.42 C ATOM 2245 O LEU B 169 -6.515 -3.799 -8.648 1.00 3.04 O ATOM 2246 CB LEU B 169 -4.161 -2.540 -9.400 1.00 22.41 C ATOM 2247 CG LEU B 169 -2.860 -1.725 -9.655 1.00 60.34 C ATOM 2248 CD1 LEU B 169 -1.636 -2.651 -9.662 1.00 52.14 C ATOM 2249 CD2 LEU B 169 -2.950 -0.897 -10.956 1.00 10.54 C ATOM 0 H LEU B 169 -4.924 -0.845 -7.613 1.00 34.30 H new ATOM 0 HA LEU B 169 -5.609 -1.343 -10.427 1.00 15.42 H new ATOM 0 HB2 LEU B 169 -4.073 -3.031 -8.431 1.00 22.41 H new ATOM 0 HB3 LEU B 169 -4.224 -3.327 -10.151 1.00 22.41 H new ATOM 0 HG LEU B 169 -2.744 -1.016 -8.835 1.00 60.34 H new ATOM 0 HD11 LEU B 169 -0.736 -2.063 -9.842 1.00 52.14 H new ATOM 0 HD12 LEU B 169 -1.555 -3.154 -8.698 1.00 52.14 H new ATOM 0 HD13 LEU B 169 -1.747 -3.395 -10.451 1.00 52.14 H new ATOM 0 HD21 LEU B 169 -2.023 -0.342 -11.099 1.00 10.54 H new ATOM 0 HD22 LEU B 169 -3.107 -1.565 -11.803 1.00 10.54 H new ATOM 0 HD23 LEU B 169 -3.784 -0.198 -10.886 1.00 10.54 H new ATOM 2261 N ASP B 170 -7.865 -2.101 -9.286 1.00 0.25 N ATOM 2262 CA ASP B 170 -9.126 -2.820 -9.076 1.00 23.21 C ATOM 2263 C ASP B 170 -9.482 -3.631 -10.348 1.00 52.12 C ATOM 2264 O ASP B 170 -9.692 -3.050 -11.413 1.00 34.50 O ATOM 2265 CB ASP B 170 -10.264 -1.849 -8.662 1.00 2.53 C ATOM 2266 CG ASP B 170 -10.502 -0.681 -9.637 1.00 23.44 C ATOM 2267 OD1 ASP B 170 -9.671 0.260 -9.669 1.00 40.44 O ATOM 2268 OD2 ASP B 170 -11.498 -0.701 -10.383 1.00 22.34 O ATOM 0 H ASP B 170 -7.989 -1.136 -9.592 1.00 0.25 H new ATOM 0 HA ASP B 170 -9.004 -3.522 -8.251 1.00 23.21 H new ATOM 0 HB2 ASP B 170 -11.189 -2.417 -8.564 1.00 2.53 H new ATOM 0 HB3 ASP B 170 -10.035 -1.441 -7.678 1.00 2.53 H new ATOM 2273 N PRO B 171 -9.518 -5.007 -10.258 1.00 20.50 N ATOM 2274 CA PRO B 171 -9.836 -5.904 -11.410 1.00 74.04 C ATOM 2275 C PRO B 171 -11.227 -5.661 -12.038 1.00 32.50 C ATOM 2276 O PRO B 171 -11.500 -6.134 -13.154 1.00 21.44 O ATOM 2277 CB PRO B 171 -9.741 -7.330 -10.806 1.00 64.53 C ATOM 2278 CG PRO B 171 -8.909 -7.173 -9.571 1.00 32.13 C ATOM 2279 CD PRO B 171 -9.204 -5.795 -9.040 1.00 54.55 C ATOM 0 HA PRO B 171 -9.149 -5.727 -12.237 1.00 74.04 H new ATOM 0 HB2 PRO B 171 -10.729 -7.725 -10.569 1.00 64.53 H new ATOM 0 HB3 PRO B 171 -9.280 -8.026 -11.507 1.00 64.53 H new ATOM 0 HG2 PRO B 171 -9.158 -7.936 -8.834 1.00 32.13 H new ATOM 0 HG3 PRO B 171 -7.849 -7.284 -9.799 1.00 32.13 H new ATOM 0 HD2 PRO B 171 -10.042 -5.806 -8.343 1.00 54.55 H new ATOM 0 HD3 PRO B 171 -8.350 -5.381 -8.505 1.00 54.55 H new ATOM 2287 N SER B 172 -12.092 -4.927 -11.312 1.00 52.53 N ATOM 2288 CA SER B 172 -13.410 -4.508 -11.803 1.00 3.51 C ATOM 2289 C SER B 172 -13.254 -3.590 -13.032 1.00 23.41 C ATOM 2290 O SER B 172 -13.818 -3.863 -14.098 1.00 42.13 O ATOM 2291 CB SER B 172 -14.200 -3.817 -10.665 1.00 22.34 C ATOM 2292 OG SER B 172 -13.408 -2.841 -10.007 1.00 43.51 O ATOM 0 H SER B 172 -11.891 -4.609 -10.364 1.00 52.53 H new ATOM 0 HA SER B 172 -13.976 -5.384 -12.119 1.00 3.51 H new ATOM 0 HB2 SER B 172 -15.095 -3.347 -11.074 1.00 22.34 H new ATOM 0 HB3 SER B 172 -14.533 -4.564 -9.945 1.00 22.34 H new ATOM 0 HG SER B 172 -13.933 -2.420 -9.295 1.00 43.51 H new ATOM 2298 N GLU B 173 -12.444 -2.528 -12.881 1.00 33.21 N ATOM 2299 CA GLU B 173 -12.130 -1.580 -13.976 1.00 21.32 C ATOM 2300 C GLU B 173 -10.692 -1.812 -14.488 1.00 40.25 C ATOM 2301 O GLU B 173 -10.102 -0.942 -15.148 1.00 54.11 O ATOM 2302 CB GLU B 173 -12.315 -0.129 -13.467 1.00 4.34 C ATOM 2303 CG GLU B 173 -13.729 0.183 -12.935 1.00 63.12 C ATOM 2304 CD GLU B 173 -14.821 0.136 -14.016 1.00 54.33 C ATOM 2305 OE1 GLU B 173 -14.846 1.039 -14.883 1.00 51.10 O ATOM 2306 OE2 GLU B 173 -15.655 -0.793 -14.007 1.00 45.10 O ATOM 0 H GLU B 173 -11.986 -2.298 -11.999 1.00 33.21 H new ATOM 0 HA GLU B 173 -12.811 -1.747 -14.811 1.00 21.32 H new ATOM 0 HB2 GLU B 173 -11.591 0.060 -12.674 1.00 4.34 H new ATOM 0 HB3 GLU B 173 -12.085 0.560 -14.279 1.00 4.34 H new ATOM 0 HG2 GLU B 173 -13.977 -0.530 -12.149 1.00 63.12 H new ATOM 0 HG3 GLU B 173 -13.725 1.172 -12.478 1.00 63.12 H new ATOM 2313 N GLY B 174 -10.146 -3.005 -14.194 1.00 43.43 N ATOM 2314 CA GLY B 174 -8.793 -3.390 -14.615 1.00 14.00 C ATOM 2315 C GLY B 174 -8.769 -4.146 -15.942 1.00 1.12 C ATOM 2316 O GLY B 174 -7.873 -4.992 -16.148 1.00 33.03 O ATOM 2317 OXT GLY B 174 -9.650 -3.899 -16.792 1.00 37.49 O ATOM 0 H GLY B 174 -10.631 -3.726 -13.659 1.00 43.43 H new ATOM 0 HA2 GLY B 174 -8.178 -2.494 -14.703 1.00 14.00 H new ATOM 0 HA3 GLY B 174 -8.342 -4.012 -13.842 1.00 14.00 H new TER 2321 GLY B 174