USER MOD reduce.3.24.130724 H: found=0, std=0, add=1396, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1394 hydrogens (12 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 151 SER OG : rot -100:sc= -0.803! USER MOD Set 1.2: A 154 THR OG1 : rot -70:sc= -3.66! USER MOD Set 2.1: A 69 THR OG1 : rot -87:sc= 1.29 USER MOD Set 2.2: A 71 MET CE :methyl 171:sc= -0.653 (180deg=-0.936) USER MOD Set 3.1: A 62 THR OG1 : rot 66:sc= 1.22 USER MOD Set 3.2: A 70 THR OG1 : rot 79:sc= 0.92 USER MOD Set 4.1: A 21 LYS NZ :NH3+ -178:sc= 1.24 (180deg=-0.000286) USER MOD Set 4.2: A 95 GLN : amide:sc= -1.96! C(o=-0.72!,f=-9.7!) USER MOD Set 5.1: A 16 HIS :FLIP no HE2:sc= -10.2! C(o=-19!,f=-18!) USER MOD Set 5.2: A 19 HIS : no HD1:sc= -4.4! C(o=-18!,f=-31!) USER MOD Set 5.3: A 96 THR OG1 : rot -156:sc= -3.23! USER MOD Single : A 1 GLY N :NH3+ -136:sc= 0.0103 (180deg=0) USER MOD Single : A 2 SER OG : rot -35:sc= 0.647 USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 MET CE :methyl 162:sc= -0.0852 (180deg=-0.529) USER MOD Single : A 12 THR OG1 : rot 123:sc= 0.866 USER MOD Single : A 14 MET CE :methyl 167:sc= -1.07 (180deg=-1.23) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot -144:sc= -1.22! USER MOD Single : A 30 HIS : no HD1:sc= -0.157 X(o=-0.16,f=-0.052) USER MOD Single : A 31 SER OG : rot 72:sc= 1.24 USER MOD Single : A 32 LYS NZ :NH3+ -152:sc= 1.21 (180deg=0.00596) USER MOD Single : A 34 THR OG1 : rot 59:sc= -0.0217 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 THR OG1 : rot -36:sc= 0.268 USER MOD Single : A 43 GLN : amide:sc= -0.106 K(o=-0.11,f=-0.69) USER MOD Single : A 44 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 TYR OH : rot -130:sc= -0.756 USER MOD Single : A 49 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -0.291 K(o=-0.29,f=-15!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ -162:sc= 0.698 (180deg=-0.12!) USER MOD Single : A 58 THR OG1 : rot 170:sc= -1.36 USER MOD Single : A 65 HIS : no HD1:sc= -0.013 X(o=-0.013,f=-0.13) USER MOD Single : A 77 GLN :FLIP amide:sc= -0.0905 F(o=-1.4!,f=-0.091) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 MET CE :methyl -117:sc= 0 (180deg=-0.351) USER MOD Single : A 101 ASN : amide:sc= -0.622 K(o=-0.62,f=-1.9!) USER MOD Single : A 102 HIS : no HD1:sc= -0.52 X(o=-0.52,f=-0.73) USER MOD Single : A 104 LYS NZ :NH3+ -116:sc= 0.0743 (180deg=-0.0273) USER MOD Single : A 107 ASN : amide:sc= -0.0168 K(o=-0.017,f=-1.2!) USER MOD Single : A 115 ASN : amide:sc= -10.8! C(o=-11!,f=-15!) USER MOD Single : A 116 LYS NZ :NH3+ -139:sc= 2.19 (180deg=1.16) USER MOD Single : A 117 MET CE :methyl -167:sc= -8.14! (180deg=-9.13!) USER MOD Single : A 119 LYS NZ :NH3+ 160:sc= 2.47 (180deg=1.98) USER MOD Single : A 123 ASN :FLIP amide:sc= -0.385 F(o=-4.7!,f=-0.39) USER MOD Single : A 128 MET CE :methyl 156:sc= -1.02 (180deg=-1.96) USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 132 MET CE :methyl -161:sc= -0.354 (180deg=-1.15) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 ASN : amide:sc= -0.258 K(o=-0.26,f=-1.2) USER MOD Single : A 145 THR OG1 : rot -16:sc= 0.195 USER MOD Single : A 148 CYS SG : rot 110:sc= -2.15! USER MOD Single : A 149 LYS NZ :NH3+ -170:sc= 1.24 (180deg=1.06) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ -169:sc= 0.289 (180deg=0.153) USER MOD Single : A 160 HIS : no HD1:sc=-0.00257 X(o=-0.0026,f=-0.0026) USER MOD Single : A 164 MET CE :methyl 136:sc= -2.43! (180deg=-5.56!) USER MOD Single : A 169 SER OG : rot 67:sc= 1.02 USER MOD Single : A 171 MET CE :methyl -163:sc= -0.0182 (180deg=-0.351) USER MOD Single : A 175 LYS NZ :NH3+ -174:sc= 0.0585 (180deg=0.0524) USER MOD Single : A 177 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 179 GDP O2' : rot 9:sc= 0.319 USER MOD Single : A 179 GDP O3' : rot -177:sc= 0.3 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -21.395 2.838 -25.931 1.00 11.58 N ATOM 2 CA GLY A 1 -20.205 1.974 -26.119 1.00 11.11 C ATOM 3 C GLY A 1 -20.547 0.514 -25.936 1.00 10.21 C ATOM 4 O GLY A 1 -21.604 0.062 -26.372 1.00 9.82 O ATOM 0 H1 GLY A 1 -21.421 3.561 -26.678 1.00 11.58 H new ATOM 0 H2 GLY A 1 -22.257 2.258 -25.981 1.00 11.58 H new ATOM 0 H3 GLY A 1 -21.344 3.302 -25.002 1.00 11.58 H new ATOM 0 HA2 GLY A 1 -19.794 2.130 -27.116 1.00 11.11 H new ATOM 0 HA3 GLY A 1 -19.431 2.259 -25.407 1.00 11.11 H new ATOM 10 N SER A 2 -19.669 -0.223 -25.276 1.00 10.08 N ATOM 11 CA SER A 2 -19.909 -1.630 -25.014 1.00 9.47 C ATOM 12 C SER A 2 -20.251 -1.845 -23.539 1.00 8.68 C ATOM 13 O SER A 2 -20.444 -2.978 -23.093 1.00 8.69 O ATOM 14 CB SER A 2 -18.686 -2.465 -25.412 1.00 9.96 C ATOM 15 OG SER A 2 -18.920 -3.850 -25.211 1.00 10.61 O ATOM 0 H SER A 2 -18.784 0.131 -24.912 1.00 10.08 H new ATOM 0 HA SER A 2 -20.757 -1.956 -25.616 1.00 9.47 H new ATOM 0 HB2 SER A 2 -18.444 -2.283 -26.459 1.00 9.96 H new ATOM 0 HB3 SER A 2 -17.822 -2.151 -24.826 1.00 9.96 H new ATOM 0 HG SER A 2 -19.478 -3.975 -24.415 1.00 10.61 H new ATOM 21 N HIS A 3 -20.319 -0.755 -22.785 1.00 8.25 N ATOM 22 CA HIS A 3 -20.679 -0.829 -21.374 1.00 7.71 C ATOM 23 C HIS A 3 -22.128 -0.414 -21.179 1.00 6.90 C ATOM 24 O HIS A 3 -22.461 0.765 -21.293 1.00 6.93 O ATOM 25 CB HIS A 3 -19.786 0.081 -20.511 1.00 8.30 C ATOM 26 CG HIS A 3 -18.338 -0.302 -20.465 1.00 8.89 C ATOM 27 ND1 HIS A 3 -17.772 -0.989 -19.413 1.00 9.51 N ATOM 28 CD2 HIS A 3 -17.330 -0.053 -21.332 1.00 9.23 C ATOM 29 CE1 HIS A 3 -16.478 -1.141 -19.637 1.00 10.14 C ATOM 30 NE2 HIS A 3 -16.183 -0.582 -20.795 1.00 9.99 N ATOM 0 H HIS A 3 -20.130 0.188 -23.125 1.00 8.25 H new ATOM 0 HA HIS A 3 -20.536 -1.863 -21.059 1.00 7.71 H new ATOM 0 HB2 HIS A 3 -19.863 1.101 -20.887 1.00 8.30 H new ATOM 0 HB3 HIS A 3 -20.176 0.086 -19.493 1.00 8.30 H new ATOM 0 HD2 HIS A 3 -17.413 0.467 -22.275 1.00 9.23 H new ATOM 0 HE1 HIS A 3 -15.779 -1.639 -18.982 1.00 10.14 H new ATOM 0 HE2 HIS A 3 -15.257 -0.549 -21.220 1.00 9.99 H new ATOM 39 N MET A 4 -22.996 -1.377 -20.920 1.00 6.50 N ATOM 40 CA MET A 4 -24.361 -1.068 -20.519 1.00 6.05 C ATOM 41 C MET A 4 -24.515 -1.366 -19.037 1.00 5.19 C ATOM 42 O MET A 4 -25.413 -0.856 -18.367 1.00 5.17 O ATOM 43 CB MET A 4 -25.383 -1.866 -21.333 1.00 6.67 C ATOM 44 CG MET A 4 -26.816 -1.418 -21.084 1.00 7.26 C ATOM 45 SD MET A 4 -28.029 -2.353 -22.034 1.00 8.18 S ATOM 46 CE MET A 4 -27.811 -3.991 -21.345 1.00 8.77 C ATOM 0 H MET A 4 -22.784 -2.373 -20.979 1.00 6.50 H new ATOM 0 HA MET A 4 -24.553 -0.012 -20.710 1.00 6.05 H new ATOM 0 HB2 MET A 4 -25.155 -1.764 -22.394 1.00 6.67 H new ATOM 0 HB3 MET A 4 -25.290 -2.924 -21.087 1.00 6.67 H new ATOM 0 HG2 MET A 4 -27.041 -1.517 -20.022 1.00 7.26 H new ATOM 0 HG3 MET A 4 -26.907 -0.360 -21.332 1.00 7.26 H new ATOM 0 HE1 MET A 4 -28.680 -4.604 -21.583 1.00 8.77 H new ATOM 0 HE2 MET A 4 -26.917 -4.448 -21.769 1.00 8.77 H new ATOM 0 HE3 MET A 4 -27.703 -3.919 -20.263 1.00 8.77 H new ATOM 56 N VAL A 5 -23.617 -2.199 -18.535 1.00 4.89 N ATOM 57 CA VAL A 5 -23.566 -2.502 -17.118 1.00 4.47 C ATOM 58 C VAL A 5 -22.588 -1.565 -16.415 1.00 4.02 C ATOM 59 O VAL A 5 -21.474 -1.333 -16.894 1.00 4.26 O ATOM 60 CB VAL A 5 -23.158 -3.972 -16.854 1.00 5.11 C ATOM 61 CG1 VAL A 5 -24.198 -4.920 -17.425 1.00 5.46 C ATOM 62 CG2 VAL A 5 -21.785 -4.282 -17.437 1.00 5.74 C ATOM 0 H VAL A 5 -22.911 -2.678 -19.094 1.00 4.89 H new ATOM 0 HA VAL A 5 -24.570 -2.356 -16.718 1.00 4.47 H new ATOM 0 HB VAL A 5 -23.103 -4.113 -15.775 1.00 5.11 H new ATOM 0 HG11 VAL A 5 -23.897 -5.950 -17.231 1.00 5.46 H new ATOM 0 HG12 VAL A 5 -25.162 -4.729 -16.954 1.00 5.46 H new ATOM 0 HG13 VAL A 5 -24.282 -4.763 -18.500 1.00 5.46 H new ATOM 0 HG21 VAL A 5 -21.530 -5.322 -17.234 1.00 5.74 H new ATOM 0 HG22 VAL A 5 -21.801 -4.116 -18.514 1.00 5.74 H new ATOM 0 HG23 VAL A 5 -21.040 -3.630 -16.981 1.00 5.74 H new ATOM 72 N GLU A 6 -23.018 -1.006 -15.302 1.00 3.71 N ATOM 73 CA GLU A 6 -22.155 -0.157 -14.498 1.00 3.56 C ATOM 74 C GLU A 6 -21.662 -0.935 -13.291 1.00 3.07 C ATOM 75 O GLU A 6 -22.369 -1.802 -12.775 1.00 3.23 O ATOM 76 CB GLU A 6 -22.891 1.109 -14.066 1.00 4.14 C ATOM 77 CG GLU A 6 -24.257 0.846 -13.459 1.00 4.54 C ATOM 78 CD GLU A 6 -24.943 2.116 -13.015 1.00 5.11 C ATOM 79 OE1 GLU A 6 -25.279 2.950 -13.884 1.00 5.70 O ATOM 80 OE2 GLU A 6 -25.158 2.283 -11.796 1.00 5.29 O ATOM 0 H GLU A 6 -23.961 -1.123 -14.931 1.00 3.71 H new ATOM 0 HA GLU A 6 -21.297 0.148 -15.097 1.00 3.56 H new ATOM 0 HB2 GLU A 6 -22.278 1.645 -13.341 1.00 4.14 H new ATOM 0 HB3 GLU A 6 -23.007 1.763 -14.930 1.00 4.14 H new ATOM 0 HG2 GLU A 6 -24.884 0.334 -14.189 1.00 4.54 H new ATOM 0 HG3 GLU A 6 -24.150 0.177 -12.606 1.00 4.54 H new ATOM 87 N ARG A 7 -20.453 -0.639 -12.853 1.00 2.85 N ATOM 88 CA ARG A 7 -19.826 -1.417 -11.799 1.00 2.62 C ATOM 89 C ARG A 7 -19.381 -0.525 -10.641 1.00 2.19 C ATOM 90 O ARG A 7 -18.354 0.153 -10.720 1.00 2.44 O ATOM 91 CB ARG A 7 -18.648 -2.218 -12.373 1.00 3.27 C ATOM 92 CG ARG A 7 -17.625 -1.373 -13.117 1.00 3.86 C ATOM 93 CD ARG A 7 -16.551 -2.229 -13.767 1.00 4.69 C ATOM 94 NE ARG A 7 -17.034 -2.919 -14.966 1.00 5.27 N ATOM 95 CZ ARG A 7 -16.463 -4.010 -15.477 1.00 6.08 C ATOM 96 NH1 ARG A 7 -15.461 -4.607 -14.843 1.00 6.40 N ATOM 97 NH2 ARG A 7 -16.910 -4.519 -16.615 1.00 6.85 N ATOM 0 H ARG A 7 -19.886 0.131 -13.208 1.00 2.85 H new ATOM 0 HA ARG A 7 -20.560 -2.117 -11.399 1.00 2.62 H new ATOM 0 HB2 ARG A 7 -18.147 -2.741 -11.558 1.00 3.27 H new ATOM 0 HB3 ARG A 7 -19.036 -2.979 -13.050 1.00 3.27 H new ATOM 0 HG2 ARG A 7 -18.129 -0.781 -13.881 1.00 3.86 H new ATOM 0 HG3 ARG A 7 -17.161 -0.671 -12.424 1.00 3.86 H new ATOM 0 HD2 ARG A 7 -15.700 -1.601 -14.031 1.00 4.69 H new ATOM 0 HD3 ARG A 7 -16.193 -2.965 -13.047 1.00 4.69 H new ATOM 0 HE ARG A 7 -17.856 -2.542 -15.438 1.00 5.27 H new ATOM 0 HH11 ARG A 7 -15.122 -4.231 -13.957 1.00 6.40 H new ATOM 0 HH12 ARG A 7 -15.030 -5.441 -15.242 1.00 6.40 H new ATOM 0 HH21 ARG A 7 -17.691 -4.076 -17.100 1.00 6.85 H new ATOM 0 HH22 ARG A 7 -16.474 -5.354 -17.007 1.00 6.85 H new ATOM 111 N PRO A 8 -20.172 -0.491 -9.560 1.00 2.01 N ATOM 112 CA PRO A 8 -19.817 0.243 -8.345 1.00 2.04 C ATOM 113 C PRO A 8 -18.573 -0.353 -7.691 1.00 1.71 C ATOM 114 O PRO A 8 -18.526 -1.551 -7.414 1.00 1.69 O ATOM 115 CB PRO A 8 -21.038 0.070 -7.433 1.00 2.57 C ATOM 116 CG PRO A 8 -22.139 -0.386 -8.329 1.00 2.80 C ATOM 117 CD PRO A 8 -21.476 -1.158 -9.431 1.00 2.42 C ATOM 0 HA PRO A 8 -19.584 1.289 -8.545 1.00 2.04 H new ATOM 0 HB2 PRO A 8 -20.842 -0.661 -6.648 1.00 2.57 H new ATOM 0 HB3 PRO A 8 -21.296 1.007 -6.939 1.00 2.57 H new ATOM 0 HG2 PRO A 8 -22.851 -1.010 -7.788 1.00 2.80 H new ATOM 0 HG3 PRO A 8 -22.696 0.462 -8.726 1.00 2.80 H new ATOM 0 HD2 PRO A 8 -21.367 -2.212 -9.177 1.00 2.42 H new ATOM 0 HD3 PRO A 8 -22.048 -1.111 -10.358 1.00 2.42 H new ATOM 125 N PRO A 9 -17.542 0.472 -7.461 1.00 1.83 N ATOM 126 CA PRO A 9 -16.269 0.013 -6.903 1.00 1.84 C ATOM 127 C PRO A 9 -16.422 -0.660 -5.541 1.00 1.40 C ATOM 128 O PRO A 9 -16.632 0.007 -4.524 1.00 1.72 O ATOM 129 CB PRO A 9 -15.444 1.296 -6.772 1.00 2.47 C ATOM 130 CG PRO A 9 -16.066 2.251 -7.729 1.00 2.76 C ATOM 131 CD PRO A 9 -17.529 1.915 -7.744 1.00 2.36 C ATOM 0 HA PRO A 9 -15.810 -0.744 -7.538 1.00 1.84 H new ATOM 0 HB2 PRO A 9 -15.473 1.682 -5.753 1.00 2.47 H new ATOM 0 HB3 PRO A 9 -14.396 1.119 -7.016 1.00 2.47 H new ATOM 0 HG2 PRO A 9 -15.904 3.282 -7.414 1.00 2.76 H new ATOM 0 HG3 PRO A 9 -15.630 2.149 -8.723 1.00 2.76 H new ATOM 0 HD2 PRO A 9 -18.080 2.479 -6.991 1.00 2.36 H new ATOM 0 HD3 PRO A 9 -17.985 2.141 -8.708 1.00 2.36 H new ATOM 139 N VAL A 10 -16.350 -1.982 -5.536 1.00 1.18 N ATOM 140 CA VAL A 10 -16.288 -2.735 -4.298 1.00 0.94 C ATOM 141 C VAL A 10 -14.840 -2.789 -3.846 1.00 0.94 C ATOM 142 O VAL A 10 -13.986 -3.339 -4.541 1.00 1.76 O ATOM 143 CB VAL A 10 -16.845 -4.167 -4.456 1.00 1.25 C ATOM 144 CG1 VAL A 10 -16.851 -4.894 -3.118 1.00 1.90 C ATOM 145 CG2 VAL A 10 -18.246 -4.132 -5.054 1.00 2.00 C ATOM 0 H VAL A 10 -16.333 -2.555 -6.380 1.00 1.18 H new ATOM 0 HA VAL A 10 -16.909 -2.235 -3.555 1.00 0.94 H new ATOM 0 HB VAL A 10 -16.193 -4.714 -5.137 1.00 1.25 H new ATOM 0 HG11 VAL A 10 -17.247 -5.901 -3.253 1.00 1.90 H new ATOM 0 HG12 VAL A 10 -15.834 -4.953 -2.731 1.00 1.90 H new ATOM 0 HG13 VAL A 10 -17.477 -4.349 -2.411 1.00 1.90 H new ATOM 0 HG21 VAL A 10 -18.623 -5.150 -5.158 1.00 2.00 H new ATOM 0 HG22 VAL A 10 -18.907 -3.566 -4.398 1.00 2.00 H new ATOM 0 HG23 VAL A 10 -18.212 -3.656 -6.034 1.00 2.00 H new ATOM 155 N VAL A 11 -14.563 -2.184 -2.707 1.00 0.62 N ATOM 156 CA VAL A 11 -13.195 -2.006 -2.255 1.00 0.61 C ATOM 157 C VAL A 11 -12.883 -2.900 -1.061 1.00 0.62 C ATOM 158 O VAL A 11 -13.674 -3.007 -0.127 1.00 0.93 O ATOM 159 CB VAL A 11 -12.931 -0.525 -1.891 1.00 0.76 C ATOM 160 CG1 VAL A 11 -11.553 -0.345 -1.278 1.00 1.35 C ATOM 161 CG2 VAL A 11 -13.080 0.356 -3.124 1.00 0.95 C ATOM 0 H VAL A 11 -15.269 -1.806 -2.075 1.00 0.62 H new ATOM 0 HA VAL A 11 -12.537 -2.293 -3.075 1.00 0.61 H new ATOM 0 HB VAL A 11 -13.670 -0.224 -1.149 1.00 0.76 H new ATOM 0 HG11 VAL A 11 -11.398 0.706 -1.033 1.00 1.35 H new ATOM 0 HG12 VAL A 11 -11.478 -0.944 -0.370 1.00 1.35 H new ATOM 0 HG13 VAL A 11 -10.793 -0.668 -1.990 1.00 1.35 H new ATOM 0 HG21 VAL A 11 -12.892 1.395 -2.854 1.00 0.95 H new ATOM 0 HG22 VAL A 11 -12.364 0.043 -3.884 1.00 0.95 H new ATOM 0 HG23 VAL A 11 -14.092 0.261 -3.519 1.00 0.95 H new ATOM 171 N THR A 12 -11.728 -3.540 -1.111 1.00 0.44 N ATOM 172 CA THR A 12 -11.271 -4.397 -0.032 1.00 0.45 C ATOM 173 C THR A 12 -10.485 -3.582 0.994 1.00 0.41 C ATOM 174 O THR A 12 -9.641 -2.771 0.628 1.00 0.50 O ATOM 175 CB THR A 12 -10.377 -5.524 -0.590 1.00 0.54 C ATOM 176 OG1 THR A 12 -11.096 -6.287 -1.565 1.00 0.61 O ATOM 177 CG2 THR A 12 -9.894 -6.440 0.522 1.00 0.64 C ATOM 0 H THR A 12 -11.082 -3.480 -1.898 1.00 0.44 H new ATOM 0 HA THR A 12 -12.142 -4.837 0.453 1.00 0.45 H new ATOM 0 HB THR A 12 -9.508 -5.063 -1.059 1.00 0.54 H new ATOM 0 HG1 THR A 12 -10.605 -6.280 -2.413 1.00 0.61 H new ATOM 0 HG21 THR A 12 -9.266 -7.225 0.100 1.00 0.64 H new ATOM 0 HG22 THR A 12 -9.317 -5.863 1.244 1.00 0.64 H new ATOM 0 HG23 THR A 12 -10.752 -6.891 1.021 1.00 0.64 H new ATOM 185 N ILE A 13 -10.769 -3.773 2.277 1.00 0.40 N ATOM 186 CA ILE A 13 -10.011 -3.100 3.326 1.00 0.40 C ATOM 187 C ILE A 13 -9.197 -4.113 4.128 1.00 0.37 C ATOM 188 O ILE A 13 -9.743 -5.066 4.683 1.00 0.52 O ATOM 189 CB ILE A 13 -10.923 -2.289 4.274 1.00 0.52 C ATOM 190 CG1 ILE A 13 -11.619 -1.166 3.502 1.00 1.15 C ATOM 191 CG2 ILE A 13 -10.116 -1.718 5.437 1.00 1.26 C ATOM 192 CD1 ILE A 13 -12.461 -0.254 4.371 1.00 1.30 C ATOM 0 H ILE A 13 -11.513 -4.384 2.615 1.00 0.40 H new ATOM 0 HA ILE A 13 -9.336 -2.398 2.835 1.00 0.40 H new ATOM 0 HB ILE A 13 -11.683 -2.956 4.681 1.00 0.52 H new ATOM 0 HG12 ILE A 13 -10.865 -0.569 2.990 1.00 1.15 H new ATOM 0 HG13 ILE A 13 -12.253 -1.606 2.733 1.00 1.15 H new ATOM 0 HG21 ILE A 13 -10.775 -1.150 6.093 1.00 1.26 H new ATOM 0 HG22 ILE A 13 -9.660 -2.533 5.998 1.00 1.26 H new ATOM 0 HG23 ILE A 13 -9.336 -1.062 5.051 1.00 1.26 H new ATOM 0 HD11 ILE A 13 -12.921 0.516 3.752 1.00 1.30 H new ATOM 0 HD12 ILE A 13 -13.239 -0.837 4.863 1.00 1.30 H new ATOM 0 HD13 ILE A 13 -11.829 0.216 5.124 1.00 1.30 H new ATOM 204 N MET A 14 -7.889 -3.910 4.164 1.00 0.26 N ATOM 205 CA MET A 14 -6.977 -4.805 4.835 1.00 0.28 C ATOM 206 C MET A 14 -5.907 -4.004 5.568 1.00 0.24 C ATOM 207 O MET A 14 -5.843 -2.784 5.426 1.00 0.29 O ATOM 208 CB MET A 14 -6.328 -5.719 3.805 1.00 0.36 C ATOM 209 CG MET A 14 -7.234 -6.829 3.288 1.00 0.49 C ATOM 210 SD MET A 14 -6.435 -7.847 2.029 1.00 0.79 S ATOM 211 CE MET A 14 -7.691 -9.086 1.720 1.00 0.69 C ATOM 0 H MET A 14 -7.433 -3.111 3.723 1.00 0.26 H new ATOM 0 HA MET A 14 -7.523 -5.405 5.562 1.00 0.28 H new ATOM 0 HB2 MET A 14 -5.995 -5.116 2.960 1.00 0.36 H new ATOM 0 HB3 MET A 14 -5.438 -6.169 4.246 1.00 0.36 H new ATOM 0 HG2 MET A 14 -7.539 -7.462 4.121 1.00 0.49 H new ATOM 0 HG3 MET A 14 -8.141 -6.389 2.873 1.00 0.49 H new ATOM 0 HE1 MET A 14 -7.441 -9.639 0.814 1.00 0.69 H new ATOM 0 HE2 MET A 14 -7.739 -9.774 2.564 1.00 0.69 H new ATOM 0 HE3 MET A 14 -8.658 -8.600 1.593 1.00 0.69 H new ATOM 221 N GLY A 15 -5.068 -4.678 6.343 1.00 0.27 N ATOM 222 CA GLY A 15 -4.007 -3.998 7.043 1.00 0.27 C ATOM 223 C GLY A 15 -3.724 -4.612 8.390 1.00 0.24 C ATOM 224 O GLY A 15 -4.125 -5.745 8.655 1.00 0.31 O ATOM 0 H GLY A 15 -5.107 -5.686 6.497 1.00 0.27 H new ATOM 0 HA2 GLY A 15 -3.101 -4.023 6.437 1.00 0.27 H new ATOM 0 HA3 GLY A 15 -4.275 -2.949 7.173 1.00 0.27 H new ATOM 228 N HIS A 16 -3.023 -3.876 9.233 1.00 0.20 N ATOM 229 CA HIS A 16 -2.662 -4.379 10.553 1.00 0.17 C ATOM 230 C HIS A 16 -3.627 -3.897 11.633 1.00 0.19 C ATOM 231 O HIS A 16 -4.370 -2.929 11.456 1.00 0.22 O ATOM 232 CB HIS A 16 -1.237 -3.956 10.909 1.00 0.17 C ATOM 233 CG HIS A 16 -0.692 -4.614 12.146 1.00 0.16 C ATOM 234 ND1 HIS A 16 -0.098 -4.053 13.218 1.00 0.16 N flip ATOM 235 CD2 HIS A 16 -0.759 -5.975 12.336 1.00 0.19 C flip ATOM 236 CE1 HIS A 16 0.207 -5.063 14.087 1.00 0.19 C flip ATOM 237 NE2 HIS A 16 -0.207 -6.200 13.519 1.00 0.22 N flip ATOM 0 H HIS A 16 -2.692 -2.932 9.032 1.00 0.20 H new ATOM 0 HA HIS A 16 -2.723 -5.467 10.512 1.00 0.17 H new ATOM 0 HB2 HIS A 16 -0.581 -4.186 10.069 1.00 0.17 H new ATOM 0 HB3 HIS A 16 -1.214 -2.875 11.045 1.00 0.17 H new ATOM 0 HD1 HIS A 16 0.089 -3.060 13.355 1.00 0.16 H new ATOM 0 HD2 HIS A 16 -1.175 -6.708 11.661 1.00 0.19 H new ATOM 0 HE1 HIS A 16 0.690 -4.962 15.048 1.00 0.19 H new ATOM 245 N VAL A 17 -3.596 -4.606 12.746 1.00 0.20 N ATOM 246 CA VAL A 17 -4.344 -4.257 13.943 1.00 0.25 C ATOM 247 C VAL A 17 -3.693 -3.063 14.626 1.00 0.26 C ATOM 248 O VAL A 17 -2.490 -2.860 14.483 1.00 0.25 O ATOM 249 CB VAL A 17 -4.366 -5.465 14.896 1.00 0.29 C ATOM 250 CG1 VAL A 17 -2.955 -5.876 15.283 1.00 0.30 C ATOM 251 CG2 VAL A 17 -5.173 -5.202 16.139 1.00 0.36 C ATOM 0 H VAL A 17 -3.041 -5.456 12.847 1.00 0.20 H new ATOM 0 HA VAL A 17 -5.366 -3.992 13.673 1.00 0.25 H new ATOM 0 HB VAL A 17 -4.846 -6.278 14.352 1.00 0.29 H new ATOM 0 HG11 VAL A 17 -2.997 -6.732 15.957 1.00 0.30 H new ATOM 0 HG12 VAL A 17 -2.396 -6.147 14.387 1.00 0.30 H new ATOM 0 HG13 VAL A 17 -2.458 -5.045 15.783 1.00 0.30 H new ATOM 0 HG21 VAL A 17 -5.156 -6.085 16.777 1.00 0.36 H new ATOM 0 HG22 VAL A 17 -4.746 -4.357 16.678 1.00 0.36 H new ATOM 0 HG23 VAL A 17 -6.202 -4.973 15.863 1.00 0.36 H new ATOM 261 N ASP A 18 -4.491 -2.260 15.335 1.00 0.31 N ATOM 262 CA ASP A 18 -4.000 -1.045 16.004 1.00 0.36 C ATOM 263 C ASP A 18 -3.712 0.052 14.982 1.00 0.34 C ATOM 264 O ASP A 18 -3.791 1.244 15.283 1.00 0.41 O ATOM 265 CB ASP A 18 -2.757 -1.349 16.854 1.00 0.42 C ATOM 266 CG ASP A 18 -2.118 -0.107 17.441 1.00 0.55 C ATOM 267 OD1 ASP A 18 -2.503 0.300 18.560 1.00 0.69 O ATOM 268 OD2 ASP A 18 -1.230 0.477 16.783 1.00 0.59 O ATOM 0 H ASP A 18 -5.489 -2.429 15.463 1.00 0.31 H new ATOM 0 HA ASP A 18 -4.781 -0.686 16.675 1.00 0.36 H new ATOM 0 HB2 ASP A 18 -3.034 -2.024 17.663 1.00 0.42 H new ATOM 0 HB3 ASP A 18 -2.024 -1.872 16.240 1.00 0.42 H new ATOM 273 N HIS A 19 -3.395 -0.355 13.760 1.00 0.29 N ATOM 274 CA HIS A 19 -3.283 0.577 12.654 1.00 0.32 C ATOM 275 C HIS A 19 -4.688 0.941 12.187 1.00 0.43 C ATOM 276 O HIS A 19 -4.878 1.843 11.378 1.00 0.63 O ATOM 277 CB HIS A 19 -2.471 -0.010 11.494 1.00 0.29 C ATOM 278 CG HIS A 19 -1.095 -0.465 11.868 1.00 0.22 C ATOM 279 ND1 HIS A 19 -0.187 -0.838 10.909 1.00 0.27 N ATOM 280 CD2 HIS A 19 -0.523 -0.590 13.089 1.00 0.21 C ATOM 281 CE1 HIS A 19 0.907 -1.180 11.560 1.00 0.26 C ATOM 282 NE2 HIS A 19 0.749 -1.046 12.879 1.00 0.24 N ATOM 0 H HIS A 19 -3.211 -1.327 13.513 1.00 0.29 H new ATOM 0 HA HIS A 19 -2.753 1.467 12.994 1.00 0.32 H new ATOM 0 HB2 HIS A 19 -3.018 -0.855 11.075 1.00 0.29 H new ATOM 0 HB3 HIS A 19 -2.391 0.740 10.707 1.00 0.29 H new ATOM 0 HD2 HIS A 19 -0.982 -0.372 14.042 1.00 0.21 H new ATOM 0 HE1 HIS A 19 1.815 -1.524 11.087 1.00 0.26 H new ATOM 0 HE2 HIS A 19 1.446 -1.246 13.596 1.00 0.24 H new ATOM 290 N GLY A 20 -5.670 0.207 12.698 1.00 0.42 N ATOM 291 CA GLY A 20 -7.048 0.578 12.491 1.00 0.54 C ATOM 292 C GLY A 20 -7.831 -0.396 11.645 1.00 0.57 C ATOM 293 O GLY A 20 -8.470 0.010 10.681 1.00 0.79 O ATOM 0 H GLY A 20 -5.531 -0.638 13.252 1.00 0.42 H new ATOM 0 HA2 GLY A 20 -7.536 0.674 13.461 1.00 0.54 H new ATOM 0 HA3 GLY A 20 -7.081 1.560 12.019 1.00 0.54 H new ATOM 297 N LYS A 21 -7.798 -1.678 11.997 1.00 0.61 N ATOM 298 CA LYS A 21 -8.611 -2.667 11.302 1.00 0.95 C ATOM 299 C LYS A 21 -10.084 -2.252 11.270 1.00 0.89 C ATOM 300 O LYS A 21 -10.654 -2.035 10.202 1.00 1.05 O ATOM 301 CB LYS A 21 -8.465 -4.024 11.980 1.00 1.36 C ATOM 302 CG LYS A 21 -8.366 -5.162 10.992 1.00 1.79 C ATOM 303 CD LYS A 21 -7.178 -4.955 10.078 1.00 2.30 C ATOM 304 CE LYS A 21 -7.192 -5.912 8.906 1.00 2.66 C ATOM 305 NZ LYS A 21 -7.058 -7.329 9.336 1.00 3.31 N ATOM 0 H LYS A 21 -7.223 -2.052 12.752 1.00 0.61 H new ATOM 0 HA LYS A 21 -8.259 -2.735 10.273 1.00 0.95 H new ATOM 0 HB2 LYS A 21 -7.576 -4.017 12.610 1.00 1.36 H new ATOM 0 HB3 LYS A 21 -9.319 -4.191 12.636 1.00 1.36 H new ATOM 0 HG2 LYS A 21 -8.265 -6.108 11.524 1.00 1.79 H new ATOM 0 HG3 LYS A 21 -9.281 -5.224 10.403 1.00 1.79 H new ATOM 0 HD2 LYS A 21 -7.179 -3.929 9.709 1.00 2.30 H new ATOM 0 HD3 LYS A 21 -6.257 -5.089 10.645 1.00 2.30 H new ATOM 0 HE2 LYS A 21 -8.121 -5.789 8.350 1.00 2.66 H new ATOM 0 HE3 LYS A 21 -6.378 -5.662 8.225 1.00 2.66 H new ATOM 0 HZ1 LYS A 21 -7.038 -7.946 8.499 1.00 3.31 H new ATOM 0 HZ2 LYS A 21 -6.175 -7.447 9.873 1.00 3.31 H new ATOM 0 HZ3 LYS A 21 -7.866 -7.587 9.937 1.00 3.31 H new ATOM 319 N THR A 22 -10.695 -2.145 12.440 1.00 0.84 N ATOM 320 CA THR A 22 -12.085 -1.731 12.537 1.00 0.87 C ATOM 321 C THR A 22 -12.194 -0.232 12.814 1.00 0.79 C ATOM 322 O THR A 22 -13.130 0.422 12.362 1.00 0.79 O ATOM 323 CB THR A 22 -12.808 -2.519 13.644 1.00 1.02 C ATOM 324 OG1 THR A 22 -12.586 -3.922 13.447 1.00 1.21 O ATOM 325 CG2 THR A 22 -14.304 -2.239 13.637 1.00 1.18 C ATOM 0 H THR A 22 -10.249 -2.340 13.336 1.00 0.84 H new ATOM 0 HA THR A 22 -12.562 -1.942 11.580 1.00 0.87 H new ATOM 0 HB THR A 22 -12.407 -2.203 14.607 1.00 1.02 H new ATOM 0 HG1 THR A 22 -13.043 -4.428 14.151 1.00 1.21 H new ATOM 0 HG21 THR A 22 -14.785 -2.811 14.431 1.00 1.18 H new ATOM 0 HG22 THR A 22 -14.476 -1.175 13.801 1.00 1.18 H new ATOM 0 HG23 THR A 22 -14.724 -2.530 12.674 1.00 1.18 H new ATOM 333 N THR A 23 -11.222 0.310 13.542 1.00 0.75 N ATOM 334 CA THR A 23 -11.214 1.725 13.898 1.00 0.75 C ATOM 335 C THR A 23 -11.211 2.649 12.678 1.00 0.67 C ATOM 336 O THR A 23 -11.580 3.809 12.790 1.00 0.66 O ATOM 337 CB THR A 23 -10.010 2.052 14.784 1.00 0.82 C ATOM 338 OG1 THR A 23 -9.064 0.974 14.732 1.00 1.25 O ATOM 339 CG2 THR A 23 -10.441 2.301 16.222 1.00 1.17 C ATOM 0 H THR A 23 -10.424 -0.215 13.899 1.00 0.75 H new ATOM 0 HA THR A 23 -12.140 1.905 14.444 1.00 0.75 H new ATOM 0 HB THR A 23 -9.543 2.963 14.409 1.00 0.82 H new ATOM 0 HG1 THR A 23 -8.641 0.867 15.610 1.00 1.25 H new ATOM 0 HG21 THR A 23 -9.566 2.531 16.830 1.00 1.17 H new ATOM 0 HG22 THR A 23 -11.135 3.141 16.254 1.00 1.17 H new ATOM 0 HG23 THR A 23 -10.931 1.410 16.614 1.00 1.17 H new ATOM 347 N LEU A 24 -10.797 2.144 11.521 1.00 0.65 N ATOM 348 CA LEU A 24 -10.853 2.927 10.290 1.00 0.63 C ATOM 349 C LEU A 24 -12.281 3.022 9.802 1.00 0.64 C ATOM 350 O LEU A 24 -12.706 4.053 9.298 1.00 0.65 O ATOM 351 CB LEU A 24 -9.973 2.306 9.229 1.00 0.67 C ATOM 352 CG LEU A 24 -8.660 3.042 8.945 1.00 0.84 C ATOM 353 CD1 LEU A 24 -8.938 4.393 8.308 1.00 1.49 C ATOM 354 CD2 LEU A 24 -7.848 3.218 10.220 1.00 1.30 C ATOM 0 H LEU A 24 -10.421 1.202 11.409 1.00 0.65 H new ATOM 0 HA LEU A 24 -10.485 3.932 10.496 1.00 0.63 H new ATOM 0 HB2 LEU A 24 -9.739 1.285 9.529 1.00 0.67 H new ATOM 0 HB3 LEU A 24 -10.542 2.244 8.301 1.00 0.67 H new ATOM 0 HG LEU A 24 -8.077 2.438 8.250 1.00 0.84 H new ATOM 0 HD11 LEU A 24 -7.995 4.904 8.112 1.00 1.49 H new ATOM 0 HD12 LEU A 24 -9.475 4.250 7.370 1.00 1.49 H new ATOM 0 HD13 LEU A 24 -9.544 4.996 8.984 1.00 1.49 H new ATOM 0 HD21 LEU A 24 -6.921 3.743 9.991 1.00 1.30 H new ATOM 0 HD22 LEU A 24 -8.424 3.797 10.941 1.00 1.30 H new ATOM 0 HD23 LEU A 24 -7.616 2.240 10.642 1.00 1.30 H new ATOM 366 N LEU A 25 -13.028 1.949 9.997 1.00 0.68 N ATOM 367 CA LEU A 25 -14.438 1.923 9.651 1.00 0.75 C ATOM 368 C LEU A 25 -15.227 2.741 10.670 1.00 0.74 C ATOM 369 O LEU A 25 -16.377 3.109 10.435 1.00 0.82 O ATOM 370 CB LEU A 25 -14.944 0.477 9.625 1.00 0.85 C ATOM 371 CG LEU A 25 -15.680 0.067 8.351 1.00 0.92 C ATOM 372 CD1 LEU A 25 -16.977 0.842 8.209 1.00 1.63 C ATOM 373 CD2 LEU A 25 -14.787 0.280 7.140 1.00 1.69 C ATOM 0 H LEU A 25 -12.678 1.078 10.396 1.00 0.68 H new ATOM 0 HA LEU A 25 -14.576 2.357 8.661 1.00 0.75 H new ATOM 0 HB2 LEU A 25 -14.094 -0.191 9.765 1.00 0.85 H new ATOM 0 HB3 LEU A 25 -15.610 0.327 10.474 1.00 0.85 H new ATOM 0 HG LEU A 25 -15.928 -0.993 8.416 1.00 0.92 H new ATOM 0 HD11 LEU A 25 -17.486 0.535 7.295 1.00 1.63 H new ATOM 0 HD12 LEU A 25 -17.618 0.639 9.067 1.00 1.63 H new ATOM 0 HD13 LEU A 25 -16.760 1.909 8.163 1.00 1.63 H new ATOM 0 HD21 LEU A 25 -15.322 -0.016 6.237 1.00 1.69 H new ATOM 0 HD22 LEU A 25 -14.512 1.333 7.071 1.00 1.69 H new ATOM 0 HD23 LEU A 25 -13.885 -0.324 7.242 1.00 1.69 H new ATOM 385 N ASP A 26 -14.585 3.035 11.793 1.00 0.71 N ATOM 386 CA ASP A 26 -15.194 3.820 12.856 1.00 0.75 C ATOM 387 C ASP A 26 -14.773 5.264 12.714 1.00 0.70 C ATOM 388 O ASP A 26 -15.521 6.184 13.042 1.00 0.76 O ATOM 389 CB ASP A 26 -14.782 3.292 14.223 1.00 0.81 C ATOM 390 CG ASP A 26 -15.607 2.105 14.678 1.00 1.01 C ATOM 391 OD1 ASP A 26 -16.851 2.176 14.594 1.00 1.13 O ATOM 392 OD2 ASP A 26 -15.017 1.087 15.091 1.00 1.23 O ATOM 0 H ASP A 26 -13.630 2.736 11.991 1.00 0.71 H new ATOM 0 HA ASP A 26 -16.278 3.742 12.774 1.00 0.75 H new ATOM 0 HB2 ASP A 26 -13.731 3.005 14.193 1.00 0.81 H new ATOM 0 HB3 ASP A 26 -14.873 4.093 14.957 1.00 0.81 H new ATOM 397 N ALA A 27 -13.565 5.451 12.213 1.00 0.63 N ATOM 398 CA ALA A 27 -13.050 6.775 11.934 1.00 0.61 C ATOM 399 C ALA A 27 -13.758 7.335 10.714 1.00 0.58 C ATOM 400 O ALA A 27 -14.246 8.464 10.720 1.00 0.62 O ATOM 401 CB ALA A 27 -11.556 6.693 11.700 1.00 0.61 C ATOM 0 H ALA A 27 -12.919 4.694 11.990 1.00 0.63 H new ATOM 0 HA ALA A 27 -13.232 7.438 12.780 1.00 0.61 H new ATOM 0 HB1 ALA A 27 -11.165 7.689 11.490 1.00 0.61 H new ATOM 0 HB2 ALA A 27 -11.070 6.293 12.590 1.00 0.61 H new ATOM 0 HB3 ALA A 27 -11.356 6.038 10.852 1.00 0.61 H new ATOM 407 N ILE A 28 -13.833 6.501 9.686 1.00 0.56 N ATOM 408 CA ILE A 28 -14.511 6.824 8.438 1.00 0.57 C ATOM 409 C ILE A 28 -15.984 7.138 8.702 1.00 0.64 C ATOM 410 O ILE A 28 -16.623 7.892 7.968 1.00 0.71 O ATOM 411 CB ILE A 28 -14.371 5.624 7.466 1.00 0.61 C ATOM 412 CG1 ILE A 28 -14.280 6.076 6.017 1.00 0.84 C ATOM 413 CG2 ILE A 28 -15.516 4.631 7.626 1.00 1.02 C ATOM 414 CD1 ILE A 28 -13.807 4.964 5.112 1.00 0.85 C ATOM 0 H ILE A 28 -13.419 5.569 9.695 1.00 0.56 H new ATOM 0 HA ILE A 28 -14.056 7.707 7.988 1.00 0.57 H new ATOM 0 HB ILE A 28 -13.439 5.124 7.730 1.00 0.61 H new ATOM 0 HG12 ILE A 28 -15.257 6.426 5.683 1.00 0.84 H new ATOM 0 HG13 ILE A 28 -13.596 6.921 5.942 1.00 0.84 H new ATOM 0 HG21 ILE A 28 -15.381 3.805 6.928 1.00 1.02 H new ATOM 0 HG22 ILE A 28 -15.524 4.246 8.646 1.00 1.02 H new ATOM 0 HG23 ILE A 28 -16.462 5.131 7.419 1.00 1.02 H new ATOM 0 HD11 ILE A 28 -13.755 5.327 4.086 1.00 0.85 H new ATOM 0 HD12 ILE A 28 -12.819 4.632 5.430 1.00 0.85 H new ATOM 0 HD13 ILE A 28 -14.505 4.129 5.167 1.00 0.85 H new ATOM 426 N ARG A 29 -16.485 6.568 9.789 1.00 0.70 N ATOM 427 CA ARG A 29 -17.864 6.734 10.210 1.00 0.82 C ATOM 428 C ARG A 29 -18.144 8.186 10.575 1.00 0.86 C ATOM 429 O ARG A 29 -19.095 8.787 10.097 1.00 1.07 O ATOM 430 CB ARG A 29 -18.116 5.852 11.429 1.00 0.99 C ATOM 431 CG ARG A 29 -19.574 5.536 11.691 1.00 1.06 C ATOM 432 CD ARG A 29 -20.080 4.465 10.742 1.00 1.06 C ATOM 433 NE ARG A 29 -19.214 3.289 10.773 1.00 1.62 N ATOM 434 CZ ARG A 29 -19.298 2.320 11.683 1.00 2.19 C ATOM 435 NH1 ARG A 29 -20.265 2.324 12.592 1.00 2.49 N ATOM 436 NH2 ARG A 29 -18.407 1.339 11.683 1.00 3.04 N ATOM 0 H ARG A 29 -15.937 5.971 10.408 1.00 0.70 H new ATOM 0 HA ARG A 29 -18.523 6.448 9.390 1.00 0.82 H new ATOM 0 HB2 ARG A 29 -17.573 4.916 11.302 1.00 0.99 H new ATOM 0 HB3 ARG A 29 -17.701 6.344 12.309 1.00 0.99 H new ATOM 0 HG2 ARG A 29 -19.697 5.201 12.721 1.00 1.06 H new ATOM 0 HG3 ARG A 29 -20.172 6.440 11.576 1.00 1.06 H new ATOM 0 HD2 ARG A 29 -21.096 4.181 11.017 1.00 1.06 H new ATOM 0 HD3 ARG A 29 -20.123 4.863 9.728 1.00 1.06 H new ATOM 0 HE ARG A 29 -18.499 3.204 10.051 1.00 1.62 H new ATOM 0 HH11 ARG A 29 -20.955 3.075 12.599 1.00 2.49 H new ATOM 0 HH12 ARG A 29 -20.318 1.576 13.283 1.00 2.49 H new ATOM 0 HH21 ARG A 29 -17.661 1.328 10.988 1.00 3.04 H new ATOM 0 HH22 ARG A 29 -18.468 0.595 12.378 1.00 3.04 H new ATOM 450 N HIS A 30 -17.279 8.742 11.413 1.00 0.83 N ATOM 451 CA HIS A 30 -17.497 10.067 11.979 1.00 0.98 C ATOM 452 C HIS A 30 -16.757 11.130 11.190 1.00 0.95 C ATOM 453 O HIS A 30 -16.443 12.212 11.691 1.00 1.10 O ATOM 454 CB HIS A 30 -17.023 10.084 13.412 1.00 1.15 C ATOM 455 CG HIS A 30 -17.634 11.147 14.258 1.00 1.60 C ATOM 456 ND1 HIS A 30 -17.149 11.512 15.497 1.00 2.04 N ATOM 457 CD2 HIS A 30 -18.709 11.917 14.036 1.00 2.10 C ATOM 458 CE1 HIS A 30 -17.909 12.464 15.999 1.00 2.61 C ATOM 459 NE2 HIS A 30 -18.866 12.731 15.130 1.00 2.65 N ATOM 0 H HIS A 30 -16.415 8.293 11.717 1.00 0.83 H new ATOM 0 HA HIS A 30 -18.563 10.288 11.933 1.00 0.98 H new ATOM 0 HB2 HIS A 30 -17.235 9.114 13.862 1.00 1.15 H new ATOM 0 HB3 HIS A 30 -15.940 10.209 13.421 1.00 1.15 H new ATOM 0 HD2 HIS A 30 -19.337 11.900 13.157 1.00 2.10 H new ATOM 0 HE1 HIS A 30 -17.772 12.944 16.957 1.00 2.61 H new ATOM 0 HE2 HIS A 30 -19.601 13.428 15.251 1.00 2.65 H new ATOM 468 N SER A 31 -16.471 10.800 9.968 1.00 0.82 N ATOM 469 CA SER A 31 -15.815 11.716 9.057 1.00 0.84 C ATOM 470 C SER A 31 -16.850 12.367 8.155 1.00 1.00 C ATOM 471 O SER A 31 -16.835 13.583 7.943 1.00 1.38 O ATOM 472 CB SER A 31 -14.764 10.983 8.221 1.00 0.78 C ATOM 473 OG SER A 31 -13.773 10.404 9.047 1.00 1.46 O ATOM 0 H SER A 31 -16.682 9.888 9.564 1.00 0.82 H new ATOM 0 HA SER A 31 -15.309 12.489 9.636 1.00 0.84 H new ATOM 0 HB2 SER A 31 -15.245 10.207 7.625 1.00 0.78 H new ATOM 0 HB3 SER A 31 -14.299 11.679 7.523 1.00 0.78 H new ATOM 0 HG SER A 31 -14.152 9.635 9.522 1.00 1.46 H new ATOM 479 N LYS A 32 -17.767 11.552 7.659 1.00 0.91 N ATOM 480 CA LYS A 32 -18.798 12.013 6.750 1.00 1.09 C ATOM 481 C LYS A 32 -19.768 10.876 6.475 1.00 1.10 C ATOM 482 O LYS A 32 -19.693 9.850 7.144 1.00 1.37 O ATOM 483 CB LYS A 32 -18.151 12.530 5.460 1.00 1.39 C ATOM 484 CG LYS A 32 -17.574 11.453 4.556 1.00 1.56 C ATOM 485 CD LYS A 32 -16.408 11.986 3.729 1.00 2.24 C ATOM 486 CE LYS A 32 -16.801 13.196 2.892 1.00 3.10 C ATOM 487 NZ LYS A 32 -15.637 13.768 2.159 1.00 3.92 N ATOM 0 H LYS A 32 -17.816 10.556 7.876 1.00 0.91 H new ATOM 0 HA LYS A 32 -19.357 12.836 7.196 1.00 1.09 H new ATOM 0 HB2 LYS A 32 -18.896 13.094 4.899 1.00 1.39 H new ATOM 0 HB3 LYS A 32 -17.355 13.227 5.724 1.00 1.39 H new ATOM 0 HG2 LYS A 32 -17.238 10.610 5.160 1.00 1.56 H new ATOM 0 HG3 LYS A 32 -18.352 11.078 3.891 1.00 1.56 H new ATOM 0 HD2 LYS A 32 -15.588 12.257 4.394 1.00 2.24 H new ATOM 0 HD3 LYS A 32 -16.040 11.197 3.073 1.00 2.24 H new ATOM 0 HE2 LYS A 32 -17.573 12.908 2.179 1.00 3.10 H new ATOM 0 HE3 LYS A 32 -17.233 13.960 3.539 1.00 3.10 H new ATOM 0 HZ1 LYS A 32 -15.790 14.785 2.004 1.00 3.92 H new ATOM 0 HZ2 LYS A 32 -14.772 13.629 2.719 1.00 3.92 H new ATOM 0 HZ3 LYS A 32 -15.536 13.290 1.241 1.00 3.92 H new ATOM 501 N VAL A 33 -20.643 11.072 5.487 1.00 1.17 N ATOM 502 CA VAL A 33 -21.719 10.131 5.121 1.00 1.39 C ATOM 503 C VAL A 33 -22.547 9.637 6.323 1.00 1.51 C ATOM 504 O VAL A 33 -23.670 10.102 6.530 1.00 2.31 O ATOM 505 CB VAL A 33 -21.239 8.932 4.233 1.00 2.16 C ATOM 506 CG1 VAL A 33 -20.043 8.188 4.814 1.00 3.10 C ATOM 507 CG2 VAL A 33 -22.386 7.960 3.982 1.00 3.06 C ATOM 0 H VAL A 33 -20.628 11.907 4.902 1.00 1.17 H new ATOM 0 HA VAL A 33 -22.386 10.731 4.503 1.00 1.39 H new ATOM 0 HB VAL A 33 -20.909 9.367 3.289 1.00 2.16 H new ATOM 0 HG11 VAL A 33 -19.764 7.371 4.148 1.00 3.10 H new ATOM 0 HG12 VAL A 33 -19.203 8.875 4.918 1.00 3.10 H new ATOM 0 HG13 VAL A 33 -20.305 7.785 5.792 1.00 3.10 H new ATOM 0 HG21 VAL A 33 -22.034 7.134 3.364 1.00 3.06 H new ATOM 0 HG22 VAL A 33 -22.749 7.572 4.934 1.00 3.06 H new ATOM 0 HG23 VAL A 33 -23.196 8.478 3.469 1.00 3.06 H new ATOM 517 N THR A 34 -22.005 8.730 7.110 1.00 1.46 N ATOM 518 CA THR A 34 -22.750 8.087 8.176 1.00 1.91 C ATOM 519 C THR A 34 -22.875 8.963 9.418 1.00 2.50 C ATOM 520 O THR A 34 -21.881 9.412 9.984 1.00 2.78 O ATOM 521 CB THR A 34 -22.096 6.750 8.553 1.00 1.83 C ATOM 522 OG1 THR A 34 -20.666 6.878 8.506 1.00 2.42 O ATOM 523 CG2 THR A 34 -22.556 5.648 7.613 1.00 1.73 C ATOM 0 H THR A 34 -21.037 8.417 7.030 1.00 1.46 H new ATOM 0 HA THR A 34 -23.756 7.915 7.794 1.00 1.91 H new ATOM 0 HB THR A 34 -22.398 6.485 9.566 1.00 1.83 H new ATOM 0 HG1 THR A 34 -20.380 7.582 9.125 1.00 2.42 H new ATOM 0 HG21 THR A 34 -22.082 4.708 7.895 1.00 1.73 H new ATOM 0 HG22 THR A 34 -23.639 5.543 7.678 1.00 1.73 H new ATOM 0 HG23 THR A 34 -22.277 5.902 6.590 1.00 1.73 H new ATOM 531 N GLU A 35 -24.114 9.208 9.822 1.00 3.15 N ATOM 532 CA GLU A 35 -24.395 9.902 11.069 1.00 3.98 C ATOM 533 C GLU A 35 -24.638 8.874 12.179 1.00 4.05 C ATOM 534 O GLU A 35 -24.046 7.793 12.158 1.00 4.33 O ATOM 535 CB GLU A 35 -25.599 10.835 10.895 1.00 4.75 C ATOM 536 CG GLU A 35 -26.819 10.163 10.280 1.00 5.08 C ATOM 537 CD GLU A 35 -27.964 11.128 10.049 1.00 5.84 C ATOM 538 OE1 GLU A 35 -28.025 11.735 8.960 1.00 6.16 O ATOM 539 OE2 GLU A 35 -28.816 11.274 10.952 1.00 6.34 O ATOM 0 H GLU A 35 -24.946 8.934 9.299 1.00 3.15 H new ATOM 0 HA GLU A 35 -23.540 10.517 11.350 1.00 3.98 H new ATOM 0 HB2 GLU A 35 -25.873 11.243 11.868 1.00 4.75 H new ATOM 0 HB3 GLU A 35 -25.306 11.677 10.268 1.00 4.75 H new ATOM 0 HG2 GLU A 35 -26.537 9.706 9.331 1.00 5.08 H new ATOM 0 HG3 GLU A 35 -27.154 9.358 10.934 1.00 5.08 H new ATOM 546 N GLN A 36 -25.515 9.183 13.129 1.00 4.07 N ATOM 547 CA GLN A 36 -25.830 8.247 14.211 1.00 4.38 C ATOM 548 C GLN A 36 -26.804 7.160 13.744 1.00 4.02 C ATOM 549 O GLN A 36 -27.660 6.699 14.499 1.00 4.41 O ATOM 550 CB GLN A 36 -26.407 8.994 15.412 1.00 5.16 C ATOM 551 CG GLN A 36 -25.413 9.930 16.069 1.00 5.59 C ATOM 552 CD GLN A 36 -26.007 10.683 17.238 1.00 6.26 C ATOM 553 OE1 GLN A 36 -25.958 10.223 18.379 1.00 6.59 O ATOM 554 NE2 GLN A 36 -26.577 11.842 16.962 1.00 6.79 N ATOM 0 H GLN A 36 -26.019 10.068 13.175 1.00 4.07 H new ATOM 0 HA GLN A 36 -24.902 7.760 14.510 1.00 4.38 H new ATOM 0 HB2 GLN A 36 -27.277 9.566 15.091 1.00 5.16 H new ATOM 0 HB3 GLN A 36 -26.755 8.270 16.148 1.00 5.16 H new ATOM 0 HG2 GLN A 36 -24.551 9.357 16.411 1.00 5.59 H new ATOM 0 HG3 GLN A 36 -25.048 10.643 15.330 1.00 5.59 H new ATOM 0 HE21 GLN A 36 -26.595 12.186 16.002 1.00 6.79 H new ATOM 0 HE22 GLN A 36 -26.999 12.393 17.709 1.00 6.79 H new ATOM 563 N GLU A 37 -26.655 6.756 12.494 1.00 3.65 N ATOM 564 CA GLU A 37 -27.445 5.690 11.921 1.00 3.72 C ATOM 565 C GLU A 37 -26.634 4.402 11.913 1.00 3.46 C ATOM 566 O GLU A 37 -25.495 4.376 12.386 1.00 3.48 O ATOM 567 CB GLU A 37 -27.854 6.057 10.496 1.00 4.27 C ATOM 568 CG GLU A 37 -28.779 7.259 10.412 1.00 4.95 C ATOM 569 CD GLU A 37 -30.022 7.100 11.260 1.00 5.60 C ATOM 570 OE1 GLU A 37 -30.788 6.143 11.030 1.00 5.76 O ATOM 571 OE2 GLU A 37 -30.248 7.941 12.151 1.00 6.24 O ATOM 0 H GLU A 37 -25.978 7.163 11.848 1.00 3.65 H new ATOM 0 HA GLU A 37 -28.343 5.544 12.521 1.00 3.72 H new ATOM 0 HB2 GLU A 37 -26.957 6.260 9.912 1.00 4.27 H new ATOM 0 HB3 GLU A 37 -28.346 5.199 10.037 1.00 4.27 H new ATOM 0 HG2 GLU A 37 -28.239 8.151 10.730 1.00 4.95 H new ATOM 0 HG3 GLU A 37 -29.070 7.416 9.373 1.00 4.95 H new ATOM 578 N ALA A 38 -27.228 3.332 11.405 1.00 3.77 N ATOM 579 CA ALA A 38 -26.520 2.071 11.260 1.00 4.17 C ATOM 580 C ALA A 38 -25.474 2.176 10.152 1.00 4.07 C ATOM 581 O ALA A 38 -25.780 1.989 8.973 1.00 4.46 O ATOM 582 CB ALA A 38 -27.499 0.942 10.969 1.00 4.95 C ATOM 0 H ALA A 38 -28.197 3.313 11.087 1.00 3.77 H new ATOM 0 HA ALA A 38 -26.009 1.848 12.197 1.00 4.17 H new ATOM 0 HB1 ALA A 38 -26.953 0.005 10.863 1.00 4.95 H new ATOM 0 HB2 ALA A 38 -28.210 0.857 11.790 1.00 4.95 H new ATOM 0 HB3 ALA A 38 -28.036 1.155 10.045 1.00 4.95 H new ATOM 588 N GLY A 39 -24.243 2.493 10.538 1.00 4.00 N ATOM 589 CA GLY A 39 -23.165 2.643 9.577 1.00 4.22 C ATOM 590 C GLY A 39 -22.612 1.314 9.105 1.00 4.22 C ATOM 591 O GLY A 39 -21.436 1.014 9.298 1.00 4.68 O ATOM 0 H GLY A 39 -23.971 2.650 11.508 1.00 4.00 H new ATOM 0 HA2 GLY A 39 -23.526 3.207 8.717 1.00 4.22 H new ATOM 0 HA3 GLY A 39 -22.362 3.227 10.027 1.00 4.22 H new ATOM 595 N GLY A 40 -23.472 0.527 8.484 1.00 4.14 N ATOM 596 CA GLY A 40 -23.086 -0.780 8.000 1.00 4.55 C ATOM 597 C GLY A 40 -24.299 -1.587 7.602 1.00 4.28 C ATOM 598 O GLY A 40 -25.229 -1.744 8.393 1.00 4.37 O ATOM 0 H GLY A 40 -24.445 0.774 8.304 1.00 4.14 H new ATOM 0 HA2 GLY A 40 -22.419 -0.673 7.145 1.00 4.55 H new ATOM 0 HA3 GLY A 40 -22.530 -1.309 8.774 1.00 4.55 H new ATOM 602 N ILE A 41 -24.311 -2.093 6.378 1.00 4.35 N ATOM 603 CA ILE A 41 -25.469 -2.820 5.897 1.00 4.40 C ATOM 604 C ILE A 41 -25.323 -4.308 6.192 1.00 4.54 C ATOM 605 O ILE A 41 -25.184 -5.134 5.283 1.00 5.04 O ATOM 606 CB ILE A 41 -25.686 -2.616 4.384 1.00 4.99 C ATOM 607 CG1 ILE A 41 -25.673 -1.125 4.023 1.00 5.27 C ATOM 608 CG2 ILE A 41 -27.002 -3.249 3.960 1.00 5.57 C ATOM 609 CD1 ILE A 41 -26.754 -0.314 4.708 1.00 5.56 C ATOM 0 H ILE A 41 -23.543 -2.014 5.711 1.00 4.35 H new ATOM 0 HA ILE A 41 -26.338 -2.425 6.423 1.00 4.40 H new ATOM 0 HB ILE A 41 -24.868 -3.100 3.850 1.00 4.99 H new ATOM 0 HG12 ILE A 41 -24.700 -0.707 4.283 1.00 5.27 H new ATOM 0 HG13 ILE A 41 -25.785 -1.022 2.944 1.00 5.27 H new ATOM 0 HG21 ILE A 41 -27.149 -3.101 2.890 1.00 5.57 H new ATOM 0 HG22 ILE A 41 -26.980 -4.317 4.179 1.00 5.57 H new ATOM 0 HG23 ILE A 41 -27.822 -2.784 4.507 1.00 5.57 H new ATOM 0 HD11 ILE A 41 -26.677 0.729 4.400 1.00 5.56 H new ATOM 0 HD12 ILE A 41 -27.733 -0.703 4.428 1.00 5.56 H new ATOM 0 HD13 ILE A 41 -26.631 -0.383 5.789 1.00 5.56 H new ATOM 621 N THR A 42 -25.359 -4.644 7.467 1.00 4.43 N ATOM 622 CA THR A 42 -25.290 -6.024 7.916 1.00 4.86 C ATOM 623 C THR A 42 -25.675 -6.073 9.398 1.00 4.64 C ATOM 624 O THR A 42 -25.641 -5.047 10.076 1.00 4.68 O ATOM 625 CB THR A 42 -23.857 -6.617 7.769 1.00 5.21 C ATOM 626 OG1 THR A 42 -23.215 -6.157 6.572 1.00 5.55 O ATOM 627 CG2 THR A 42 -23.898 -8.138 7.750 1.00 5.93 C ATOM 0 H THR A 42 -25.437 -3.966 8.225 1.00 4.43 H new ATOM 0 HA THR A 42 -25.970 -6.612 7.299 1.00 4.86 H new ATOM 0 HB THR A 42 -23.285 -6.275 8.632 1.00 5.21 H new ATOM 0 HG1 THR A 42 -23.877 -6.083 5.853 1.00 5.55 H new ATOM 0 HG21 THR A 42 -22.885 -8.528 7.647 1.00 5.93 H new ATOM 0 HG22 THR A 42 -24.334 -8.502 8.681 1.00 5.93 H new ATOM 0 HG23 THR A 42 -24.504 -8.475 6.909 1.00 5.93 H new ATOM 635 N GLN A 43 -26.041 -7.251 9.899 1.00 4.73 N ATOM 636 CA GLN A 43 -26.262 -7.430 11.334 1.00 4.79 C ATOM 637 C GLN A 43 -24.930 -7.777 12.009 1.00 4.45 C ATOM 638 O GLN A 43 -24.868 -8.148 13.182 1.00 4.74 O ATOM 639 CB GLN A 43 -27.304 -8.530 11.579 1.00 5.52 C ATOM 640 CG GLN A 43 -27.810 -8.609 13.016 1.00 5.96 C ATOM 641 CD GLN A 43 -28.525 -7.348 13.464 1.00 6.23 C ATOM 642 OE1 GLN A 43 -29.128 -6.637 12.661 1.00 6.39 O ATOM 643 NE2 GLN A 43 -28.480 -7.074 14.757 1.00 6.63 N ATOM 0 H GLN A 43 -26.190 -8.090 9.339 1.00 4.73 H new ATOM 0 HA GLN A 43 -26.646 -6.505 11.763 1.00 4.79 H new ATOM 0 HB2 GLN A 43 -28.153 -8.363 10.916 1.00 5.52 H new ATOM 0 HB3 GLN A 43 -26.870 -9.492 11.306 1.00 5.52 H new ATOM 0 HG2 GLN A 43 -28.488 -9.457 13.110 1.00 5.96 H new ATOM 0 HG3 GLN A 43 -26.968 -8.798 13.682 1.00 5.96 H new ATOM 0 HE21 GLN A 43 -27.969 -7.688 15.391 1.00 6.63 H new ATOM 0 HE22 GLN A 43 -28.956 -6.248 15.120 1.00 6.63 H new ATOM 652 N HIS A 44 -23.867 -7.668 11.226 1.00 4.15 N ATOM 653 CA HIS A 44 -22.502 -7.816 11.705 1.00 4.05 C ATOM 654 C HIS A 44 -21.695 -6.626 11.213 1.00 3.55 C ATOM 655 O HIS A 44 -21.815 -6.242 10.048 1.00 3.72 O ATOM 656 CB HIS A 44 -21.863 -9.104 11.177 1.00 4.61 C ATOM 657 CG HIS A 44 -22.451 -10.371 11.718 1.00 5.23 C ATOM 658 ND1 HIS A 44 -21.948 -11.028 12.815 1.00 5.76 N ATOM 659 CD2 HIS A 44 -23.483 -11.122 11.272 1.00 5.72 C ATOM 660 CE1 HIS A 44 -22.641 -12.130 13.020 1.00 6.54 C ATOM 661 NE2 HIS A 44 -23.583 -12.216 12.098 1.00 6.49 N ATOM 0 H HIS A 44 -23.930 -7.472 10.227 1.00 4.15 H new ATOM 0 HA HIS A 44 -22.512 -7.864 12.794 1.00 4.05 H new ATOM 0 HB2 HIS A 44 -21.950 -9.116 10.091 1.00 4.61 H new ATOM 0 HB3 HIS A 44 -20.799 -9.086 11.411 1.00 4.61 H new ATOM 0 HD2 HIS A 44 -24.113 -10.903 10.423 1.00 5.72 H new ATOM 0 HE1 HIS A 44 -22.467 -12.845 13.811 1.00 6.54 H new ATOM 0 HE2 HIS A 44 -24.268 -12.967 12.013 1.00 6.49 H new ATOM 670 N ILE A 45 -20.891 -6.034 12.079 1.00 3.31 N ATOM 671 CA ILE A 45 -20.098 -4.880 11.687 1.00 3.06 C ATOM 672 C ILE A 45 -18.926 -5.305 10.820 1.00 2.33 C ATOM 673 O ILE A 45 -18.446 -6.438 10.897 1.00 2.50 O ATOM 674 CB ILE A 45 -19.593 -4.076 12.907 1.00 3.87 C ATOM 675 CG1 ILE A 45 -18.863 -2.798 12.474 1.00 4.51 C ATOM 676 CG2 ILE A 45 -18.695 -4.925 13.796 1.00 4.43 C ATOM 677 CD1 ILE A 45 -19.745 -1.817 11.734 1.00 5.17 C ATOM 0 H ILE A 45 -20.770 -6.328 13.048 1.00 3.31 H new ATOM 0 HA ILE A 45 -20.752 -4.226 11.110 1.00 3.06 H new ATOM 0 HB ILE A 45 -20.470 -3.786 13.485 1.00 3.87 H new ATOM 0 HG12 ILE A 45 -18.451 -2.309 13.356 1.00 4.51 H new ATOM 0 HG13 ILE A 45 -18.021 -3.069 11.837 1.00 4.51 H new ATOM 0 HG21 ILE A 45 -18.357 -4.331 14.645 1.00 4.43 H new ATOM 0 HG22 ILE A 45 -19.253 -5.789 14.157 1.00 4.43 H new ATOM 0 HG23 ILE A 45 -17.832 -5.264 13.223 1.00 4.43 H new ATOM 0 HD11 ILE A 45 -19.161 -0.938 11.459 1.00 5.17 H new ATOM 0 HD12 ILE A 45 -20.137 -2.288 10.833 1.00 5.17 H new ATOM 0 HD13 ILE A 45 -20.573 -1.516 12.376 1.00 5.17 H new ATOM 689 N GLY A 46 -18.478 -4.386 9.997 1.00 2.18 N ATOM 690 CA GLY A 46 -17.413 -4.672 9.069 1.00 2.10 C ATOM 691 C GLY A 46 -17.185 -3.541 8.088 1.00 1.86 C ATOM 692 O GLY A 46 -16.097 -2.976 8.036 1.00 2.51 O ATOM 0 H GLY A 46 -18.837 -3.432 9.952 1.00 2.18 H new ATOM 0 HA2 GLY A 46 -16.493 -4.861 9.622 1.00 2.10 H new ATOM 0 HA3 GLY A 46 -17.648 -5.584 8.520 1.00 2.10 H new ATOM 696 N ALA A 47 -18.216 -3.198 7.324 1.00 1.36 N ATOM 697 CA ALA A 47 -18.093 -2.162 6.305 1.00 1.12 C ATOM 698 C ALA A 47 -19.460 -1.639 5.886 1.00 1.01 C ATOM 699 O ALA A 47 -20.478 -1.992 6.481 1.00 1.17 O ATOM 700 CB ALA A 47 -17.333 -2.697 5.106 1.00 1.29 C ATOM 0 H ALA A 47 -19.142 -3.620 7.390 1.00 1.36 H new ATOM 0 HA ALA A 47 -17.535 -1.328 6.730 1.00 1.12 H new ATOM 0 HB1 ALA A 47 -17.247 -1.915 4.351 1.00 1.29 H new ATOM 0 HB2 ALA A 47 -16.337 -3.012 5.417 1.00 1.29 H new ATOM 0 HB3 ALA A 47 -17.868 -3.549 4.687 1.00 1.29 H new ATOM 706 N TYR A 48 -19.479 -0.810 4.846 1.00 0.85 N ATOM 707 CA TYR A 48 -20.695 -0.128 4.437 1.00 0.89 C ATOM 708 C TYR A 48 -20.481 0.554 3.096 1.00 0.81 C ATOM 709 O TYR A 48 -19.384 0.511 2.535 1.00 0.73 O ATOM 710 CB TYR A 48 -21.117 0.909 5.492 1.00 0.97 C ATOM 711 CG TYR A 48 -20.252 2.152 5.536 1.00 0.94 C ATOM 712 CD1 TYR A 48 -18.870 2.068 5.625 1.00 0.92 C ATOM 713 CD2 TYR A 48 -20.828 3.414 5.501 1.00 1.20 C ATOM 714 CE1 TYR A 48 -18.086 3.204 5.672 1.00 1.15 C ATOM 715 CE2 TYR A 48 -20.051 4.554 5.547 1.00 1.40 C ATOM 716 CZ TYR A 48 -18.683 4.444 5.633 1.00 1.37 C ATOM 717 OH TYR A 48 -17.910 5.580 5.681 1.00 1.70 O ATOM 0 H TYR A 48 -18.663 -0.597 4.273 1.00 0.85 H new ATOM 0 HA TYR A 48 -21.490 -0.867 4.341 1.00 0.89 H new ATOM 0 HB2 TYR A 48 -22.148 1.206 5.298 1.00 0.97 H new ATOM 0 HB3 TYR A 48 -21.101 0.436 6.474 1.00 0.97 H new ATOM 0 HD1 TYR A 48 -18.399 1.097 5.658 1.00 0.92 H new ATOM 0 HD2 TYR A 48 -21.902 3.506 5.437 1.00 1.20 H new ATOM 0 HE1 TYR A 48 -17.011 3.120 5.739 1.00 1.15 H new ATOM 0 HE2 TYR A 48 -20.516 5.528 5.516 1.00 1.40 H new ATOM 0 HH TYR A 48 -18.261 6.186 6.367 1.00 1.70 H new ATOM 727 N GLN A 49 -21.534 1.178 2.590 1.00 0.91 N ATOM 728 CA GLN A 49 -21.456 1.943 1.357 1.00 0.89 C ATOM 729 C GLN A 49 -21.167 3.398 1.702 1.00 0.90 C ATOM 730 O GLN A 49 -21.929 4.021 2.448 1.00 1.02 O ATOM 731 CB GLN A 49 -22.779 1.843 0.588 1.00 1.02 C ATOM 732 CG GLN A 49 -23.323 0.427 0.482 1.00 1.09 C ATOM 733 CD GLN A 49 -24.695 0.369 -0.160 1.00 1.45 C ATOM 734 OE1 GLN A 49 -25.480 1.313 -0.068 1.00 1.87 O ATOM 735 NE2 GLN A 49 -25.003 -0.746 -0.806 1.00 1.91 N ATOM 0 H GLN A 49 -22.459 1.168 3.019 1.00 0.91 H new ATOM 0 HA GLN A 49 -20.660 1.544 0.728 1.00 0.89 H new ATOM 0 HB2 GLN A 49 -23.522 2.472 1.079 1.00 1.02 H new ATOM 0 HB3 GLN A 49 -22.636 2.243 -0.416 1.00 1.02 H new ATOM 0 HG2 GLN A 49 -22.629 -0.181 -0.099 1.00 1.09 H new ATOM 0 HG3 GLN A 49 -23.375 -0.013 1.478 1.00 1.09 H new ATOM 0 HE21 GLN A 49 -24.326 -1.507 -0.861 1.00 1.91 H new ATOM 0 HE22 GLN A 49 -25.917 -0.843 -1.248 1.00 1.91 H new ATOM 744 N VAL A 50 -20.078 3.933 1.181 1.00 0.85 N ATOM 745 CA VAL A 50 -19.655 5.278 1.540 1.00 0.91 C ATOM 746 C VAL A 50 -20.212 6.300 0.554 1.00 0.96 C ATOM 747 O VAL A 50 -20.876 5.952 -0.423 1.00 1.01 O ATOM 748 CB VAL A 50 -18.110 5.378 1.592 1.00 0.93 C ATOM 749 CG1 VAL A 50 -17.511 5.391 0.193 1.00 1.53 C ATOM 750 CG2 VAL A 50 -17.645 6.587 2.396 1.00 1.34 C ATOM 0 H VAL A 50 -19.471 3.461 0.511 1.00 0.85 H new ATOM 0 HA VAL A 50 -20.049 5.497 2.532 1.00 0.91 H new ATOM 0 HB VAL A 50 -17.749 4.487 2.106 1.00 0.93 H new ATOM 0 HG11 VAL A 50 -16.426 5.462 0.263 1.00 1.53 H new ATOM 0 HG12 VAL A 50 -17.782 4.472 -0.327 1.00 1.53 H new ATOM 0 HG13 VAL A 50 -17.896 6.248 -0.360 1.00 1.53 H new ATOM 0 HG21 VAL A 50 -16.556 6.619 2.407 1.00 1.34 H new ATOM 0 HG22 VAL A 50 -18.030 7.498 1.939 1.00 1.34 H new ATOM 0 HG23 VAL A 50 -18.016 6.509 3.418 1.00 1.34 H new ATOM 760 N THR A 51 -19.946 7.558 0.828 1.00 1.09 N ATOM 761 CA THR A 51 -20.342 8.634 -0.053 1.00 1.16 C ATOM 762 C THR A 51 -19.115 9.372 -0.566 1.00 1.19 C ATOM 763 O THR A 51 -18.576 10.251 0.110 1.00 1.28 O ATOM 764 CB THR A 51 -21.289 9.631 0.650 1.00 1.29 C ATOM 765 OG1 THR A 51 -22.499 8.972 1.039 1.00 1.51 O ATOM 766 CG2 THR A 51 -21.626 10.803 -0.262 1.00 1.42 C ATOM 0 H THR A 51 -19.450 7.863 1.666 1.00 1.09 H new ATOM 0 HA THR A 51 -20.880 8.189 -0.890 1.00 1.16 H new ATOM 0 HB THR A 51 -20.777 10.011 1.534 1.00 1.29 H new ATOM 0 HG1 THR A 51 -23.091 9.613 1.485 1.00 1.51 H new ATOM 0 HG21 THR A 51 -22.294 11.489 0.259 1.00 1.42 H new ATOM 0 HG22 THR A 51 -20.710 11.326 -0.535 1.00 1.42 H new ATOM 0 HG23 THR A 51 -22.116 10.434 -1.163 1.00 1.42 H new ATOM 774 N VAL A 52 -18.648 8.980 -1.743 1.00 1.36 N ATOM 775 CA VAL A 52 -17.603 9.742 -2.426 1.00 1.62 C ATOM 776 C VAL A 52 -18.279 10.872 -3.178 1.00 1.81 C ATOM 777 O VAL A 52 -17.742 11.969 -3.350 1.00 2.11 O ATOM 778 CB VAL A 52 -16.779 8.876 -3.418 1.00 1.88 C ATOM 779 CG1 VAL A 52 -17.630 8.403 -4.591 1.00 1.98 C ATOM 780 CG2 VAL A 52 -15.566 9.643 -3.920 1.00 2.27 C ATOM 0 H VAL A 52 -18.969 8.150 -2.243 1.00 1.36 H new ATOM 0 HA VAL A 52 -16.900 10.114 -1.681 1.00 1.62 H new ATOM 0 HB VAL A 52 -16.438 7.994 -2.877 1.00 1.88 H new ATOM 0 HG11 VAL A 52 -17.020 7.800 -5.264 1.00 1.98 H new ATOM 0 HG12 VAL A 52 -18.461 7.803 -4.219 1.00 1.98 H new ATOM 0 HG13 VAL A 52 -18.019 9.267 -5.130 1.00 1.98 H new ATOM 0 HG21 VAL A 52 -15.002 9.019 -4.613 1.00 2.27 H new ATOM 0 HG22 VAL A 52 -15.894 10.548 -4.431 1.00 2.27 H new ATOM 0 HG23 VAL A 52 -14.931 9.912 -3.076 1.00 2.27 H new ATOM 790 N ASN A 53 -19.489 10.564 -3.594 1.00 1.81 N ATOM 791 CA ASN A 53 -20.341 11.454 -4.305 1.00 1.99 C ATOM 792 C ASN A 53 -21.760 11.229 -3.811 1.00 1.80 C ATOM 793 O ASN A 53 -22.443 12.160 -3.384 1.00 1.82 O ATOM 794 CB ASN A 53 -20.194 11.185 -5.804 1.00 2.39 C ATOM 795 CG ASN A 53 -20.457 9.751 -6.237 1.00 3.10 C ATOM 796 OD1 ASN A 53 -20.491 8.819 -5.432 1.00 3.68 O ATOM 797 ND2 ASN A 53 -20.578 9.566 -7.530 1.00 3.42 N ATOM 0 H ASN A 53 -19.909 9.649 -3.433 1.00 1.81 H new ATOM 0 HA ASN A 53 -20.078 12.498 -4.135 1.00 1.99 H new ATOM 0 HB2 ASN A 53 -20.878 11.841 -6.343 1.00 2.39 H new ATOM 0 HB3 ASN A 53 -19.184 11.459 -6.108 1.00 2.39 H new ATOM 0 HD21 ASN A 53 -20.705 8.624 -7.901 1.00 3.42 H new ATOM 0 HD22 ASN A 53 -20.545 10.364 -8.165 1.00 3.42 H new ATOM 804 N ASP A 54 -22.159 9.967 -3.848 1.00 1.81 N ATOM 805 CA ASP A 54 -23.367 9.481 -3.201 1.00 1.82 C ATOM 806 C ASP A 54 -23.533 7.980 -3.452 1.00 2.08 C ATOM 807 O ASP A 54 -23.874 7.551 -4.552 1.00 2.23 O ATOM 808 CB ASP A 54 -24.611 10.260 -3.656 1.00 2.01 C ATOM 809 CG ASP A 54 -24.927 10.133 -5.134 1.00 2.47 C ATOM 810 OD1 ASP A 54 -24.203 10.734 -5.950 1.00 2.69 O ATOM 811 OD2 ASP A 54 -25.881 9.406 -5.487 1.00 2.99 O ATOM 0 H ASP A 54 -21.641 9.238 -4.339 1.00 1.81 H new ATOM 0 HA ASP A 54 -23.264 9.646 -2.129 1.00 1.82 H new ATOM 0 HB2 ASP A 54 -25.471 9.914 -3.083 1.00 2.01 H new ATOM 0 HB3 ASP A 54 -24.472 11.314 -3.416 1.00 2.01 H new ATOM 816 N LYS A 55 -23.177 7.185 -2.433 1.00 2.27 N ATOM 817 CA LYS A 55 -23.476 5.739 -2.390 1.00 2.75 C ATOM 818 C LYS A 55 -22.465 4.907 -3.177 1.00 1.92 C ATOM 819 O LYS A 55 -22.477 3.678 -3.104 1.00 2.45 O ATOM 820 CB LYS A 55 -24.900 5.442 -2.892 1.00 4.02 C ATOM 821 CG LYS A 55 -26.003 6.017 -2.012 1.00 5.04 C ATOM 822 CD LYS A 55 -26.024 5.369 -0.637 1.00 5.92 C ATOM 823 CE LYS A 55 -27.118 5.963 0.236 1.00 6.66 C ATOM 824 NZ LYS A 55 -27.151 5.347 1.590 1.00 7.36 N ATOM 0 H LYS A 55 -22.673 7.523 -1.613 1.00 2.27 H new ATOM 0 HA LYS A 55 -23.402 5.449 -1.342 1.00 2.75 H new ATOM 0 HB2 LYS A 55 -25.009 5.842 -3.900 1.00 4.02 H new ATOM 0 HB3 LYS A 55 -25.031 4.362 -2.961 1.00 4.02 H new ATOM 0 HG2 LYS A 55 -25.859 7.092 -1.905 1.00 5.04 H new ATOM 0 HG3 LYS A 55 -26.968 5.871 -2.497 1.00 5.04 H new ATOM 0 HD2 LYS A 55 -26.181 4.295 -0.741 1.00 5.92 H new ATOM 0 HD3 LYS A 55 -25.056 5.504 -0.154 1.00 5.92 H new ATOM 0 HE2 LYS A 55 -26.962 7.038 0.331 1.00 6.66 H new ATOM 0 HE3 LYS A 55 -28.084 5.823 -0.249 1.00 6.66 H new ATOM 0 HZ1 LYS A 55 -27.911 5.782 2.151 1.00 7.36 H new ATOM 0 HZ2 LYS A 55 -27.326 4.326 1.503 1.00 7.36 H new ATOM 0 HZ3 LYS A 55 -26.239 5.502 2.064 1.00 7.36 H new ATOM 838 N LYS A 56 -21.602 5.573 -3.930 1.00 1.27 N ATOM 839 CA LYS A 56 -20.557 4.888 -4.677 1.00 1.10 C ATOM 840 C LYS A 56 -19.467 4.401 -3.722 1.00 1.03 C ATOM 841 O LYS A 56 -19.122 5.097 -2.768 1.00 1.91 O ATOM 842 CB LYS A 56 -19.966 5.832 -5.732 1.00 1.91 C ATOM 843 CG LYS A 56 -18.985 5.176 -6.696 1.00 2.63 C ATOM 844 CD LYS A 56 -18.322 6.215 -7.592 1.00 3.33 C ATOM 845 CE LYS A 56 -17.355 5.584 -8.584 1.00 3.92 C ATOM 846 NZ LYS A 56 -18.045 5.012 -9.777 1.00 4.46 N ATOM 0 H LYS A 56 -21.605 6.587 -4.040 1.00 1.27 H new ATOM 0 HA LYS A 56 -20.986 4.024 -5.184 1.00 1.10 H new ATOM 0 HB2 LYS A 56 -20.782 6.269 -6.307 1.00 1.91 H new ATOM 0 HB3 LYS A 56 -19.460 6.653 -5.223 1.00 1.91 H new ATOM 0 HG2 LYS A 56 -18.223 4.636 -6.134 1.00 2.63 H new ATOM 0 HG3 LYS A 56 -19.508 4.442 -7.309 1.00 2.63 H new ATOM 0 HD2 LYS A 56 -19.089 6.767 -8.135 1.00 3.33 H new ATOM 0 HD3 LYS A 56 -17.787 6.937 -6.975 1.00 3.33 H new ATOM 0 HE2 LYS A 56 -16.635 6.334 -8.911 1.00 3.92 H new ATOM 0 HE3 LYS A 56 -16.790 4.797 -8.084 1.00 3.92 H new ATOM 0 HZ1 LYS A 56 -17.410 4.344 -10.258 1.00 4.46 H new ATOM 0 HZ2 LYS A 56 -18.906 4.514 -9.474 1.00 4.46 H new ATOM 0 HZ3 LYS A 56 -18.300 5.779 -10.431 1.00 4.46 H new ATOM 860 N ILE A 57 -18.938 3.202 -3.999 1.00 0.92 N ATOM 861 CA ILE A 57 -17.878 2.572 -3.195 1.00 0.72 C ATOM 862 C ILE A 57 -18.447 1.871 -1.971 1.00 0.69 C ATOM 863 O ILE A 57 -18.824 2.502 -0.982 1.00 0.80 O ATOM 864 CB ILE A 57 -16.764 3.555 -2.747 1.00 0.65 C ATOM 865 CG1 ILE A 57 -16.223 4.358 -3.935 1.00 0.73 C ATOM 866 CG2 ILE A 57 -15.633 2.783 -2.089 1.00 0.71 C ATOM 867 CD1 ILE A 57 -15.275 5.463 -3.529 1.00 0.75 C ATOM 0 H ILE A 57 -19.235 2.636 -4.794 1.00 0.92 H new ATOM 0 HA ILE A 57 -17.420 1.841 -3.861 1.00 0.72 H new ATOM 0 HB ILE A 57 -17.195 4.256 -2.032 1.00 0.65 H new ATOM 0 HG12 ILE A 57 -15.710 3.681 -4.618 1.00 0.73 H new ATOM 0 HG13 ILE A 57 -17.060 4.790 -4.483 1.00 0.73 H new ATOM 0 HG21 ILE A 57 -14.853 3.477 -1.776 1.00 0.71 H new ATOM 0 HG22 ILE A 57 -16.015 2.249 -1.219 1.00 0.71 H new ATOM 0 HG23 ILE A 57 -15.219 2.068 -2.800 1.00 0.71 H new ATOM 0 HD11 ILE A 57 -14.930 5.991 -4.418 1.00 0.75 H new ATOM 0 HD12 ILE A 57 -15.791 6.161 -2.870 1.00 0.75 H new ATOM 0 HD13 ILE A 57 -14.420 5.035 -3.006 1.00 0.75 H new ATOM 879 N THR A 58 -18.520 0.553 -2.054 1.00 0.71 N ATOM 880 CA THR A 58 -18.870 -0.260 -0.912 1.00 0.71 C ATOM 881 C THR A 58 -17.683 -1.118 -0.519 1.00 0.71 C ATOM 882 O THR A 58 -17.311 -2.052 -1.227 1.00 0.82 O ATOM 883 CB THR A 58 -20.083 -1.165 -1.185 1.00 0.85 C ATOM 884 OG1 THR A 58 -21.169 -0.379 -1.694 1.00 0.96 O ATOM 885 CG2 THR A 58 -20.511 -1.878 0.096 1.00 0.86 C ATOM 0 H THR A 58 -18.339 0.025 -2.908 1.00 0.71 H new ATOM 0 HA THR A 58 -19.140 0.417 -0.101 1.00 0.71 H new ATOM 0 HB THR A 58 -19.804 -1.915 -1.925 1.00 0.85 H new ATOM 0 HG1 THR A 58 -21.879 -0.972 -2.017 1.00 0.96 H new ATOM 0 HG21 THR A 58 -21.371 -2.515 -0.112 1.00 0.86 H new ATOM 0 HG22 THR A 58 -19.687 -2.489 0.465 1.00 0.86 H new ATOM 0 HG23 THR A 58 -20.781 -1.139 0.851 1.00 0.86 H new ATOM 893 N PHE A 59 -17.077 -0.768 0.597 1.00 0.67 N ATOM 894 CA PHE A 59 -15.904 -1.477 1.114 1.00 0.77 C ATOM 895 C PHE A 59 -16.253 -2.863 1.689 1.00 0.96 C ATOM 896 O PHE A 59 -15.648 -3.292 2.669 1.00 1.57 O ATOM 897 CB PHE A 59 -15.239 -0.641 2.215 1.00 0.80 C ATOM 898 CG PHE A 59 -14.930 0.777 1.815 1.00 0.72 C ATOM 899 CD1 PHE A 59 -13.874 1.057 0.966 1.00 1.07 C ATOM 900 CD2 PHE A 59 -15.701 1.829 2.287 1.00 1.04 C ATOM 901 CE1 PHE A 59 -13.590 2.360 0.596 1.00 1.10 C ATOM 902 CE2 PHE A 59 -15.422 3.128 1.919 1.00 1.06 C ATOM 903 CZ PHE A 59 -14.367 3.397 1.074 1.00 0.80 C ATOM 0 H PHE A 59 -17.377 0.015 1.178 1.00 0.67 H new ATOM 0 HA PHE A 59 -15.227 -1.624 0.273 1.00 0.77 H new ATOM 0 HB2 PHE A 59 -15.892 -0.626 3.088 1.00 0.80 H new ATOM 0 HB3 PHE A 59 -14.313 -1.131 2.518 1.00 0.80 H new ATOM 0 HD1 PHE A 59 -13.264 0.250 0.588 1.00 1.07 H new ATOM 0 HD2 PHE A 59 -16.529 1.628 2.950 1.00 1.04 H new ATOM 0 HE1 PHE A 59 -12.762 2.566 -0.066 1.00 1.10 H new ATOM 0 HE2 PHE A 59 -16.032 3.937 2.294 1.00 1.06 H new ATOM 0 HZ PHE A 59 -14.149 4.415 0.787 1.00 0.80 H new ATOM 913 N LEU A 60 -17.199 -3.576 1.081 1.00 1.19 N ATOM 914 CA LEU A 60 -17.661 -4.845 1.644 1.00 1.38 C ATOM 915 C LEU A 60 -18.127 -5.813 0.562 1.00 1.95 C ATOM 916 O LEU A 60 -18.954 -5.470 -0.284 1.00 2.65 O ATOM 917 CB LEU A 60 -18.796 -4.584 2.650 1.00 1.84 C ATOM 918 CG LEU A 60 -19.366 -5.820 3.363 1.00 2.35 C ATOM 919 CD1 LEU A 60 -19.871 -5.442 4.744 1.00 2.89 C ATOM 920 CD2 LEU A 60 -20.502 -6.439 2.560 1.00 3.21 C ATOM 0 H LEU A 60 -17.656 -3.303 0.211 1.00 1.19 H new ATOM 0 HA LEU A 60 -16.818 -5.311 2.155 1.00 1.38 H new ATOM 0 HB2 LEU A 60 -18.431 -3.890 3.407 1.00 1.84 H new ATOM 0 HB3 LEU A 60 -19.611 -4.084 2.126 1.00 1.84 H new ATOM 0 HG LEU A 60 -18.564 -6.553 3.456 1.00 2.35 H new ATOM 0 HD11 LEU A 60 -20.272 -6.326 5.239 1.00 2.89 H new ATOM 0 HD12 LEU A 60 -19.049 -5.038 5.334 1.00 2.89 H new ATOM 0 HD13 LEU A 60 -20.655 -4.690 4.652 1.00 2.89 H new ATOM 0 HD21 LEU A 60 -20.887 -7.312 3.087 1.00 3.21 H new ATOM 0 HD22 LEU A 60 -21.301 -5.708 2.437 1.00 3.21 H new ATOM 0 HD23 LEU A 60 -20.132 -6.741 1.580 1.00 3.21 H new ATOM 932 N ASP A 61 -17.594 -7.030 0.606 1.00 2.43 N ATOM 933 CA ASP A 61 -18.080 -8.117 -0.240 1.00 3.40 C ATOM 934 C ASP A 61 -18.602 -9.261 0.623 1.00 3.45 C ATOM 935 O ASP A 61 -19.811 -9.445 0.761 1.00 3.73 O ATOM 936 CB ASP A 61 -16.984 -8.638 -1.180 1.00 4.36 C ATOM 937 CG ASP A 61 -17.457 -9.815 -2.023 1.00 5.14 C ATOM 938 OD1 ASP A 61 -18.249 -9.598 -2.964 1.00 5.61 O ATOM 939 OD2 ASP A 61 -17.046 -10.964 -1.741 1.00 5.55 O ATOM 0 H ASP A 61 -16.823 -7.290 1.221 1.00 2.43 H new ATOM 0 HA ASP A 61 -18.890 -7.720 -0.852 1.00 3.40 H new ATOM 0 HB2 ASP A 61 -16.658 -7.831 -1.837 1.00 4.36 H new ATOM 0 HB3 ASP A 61 -16.117 -8.940 -0.592 1.00 4.36 H new ATOM 944 N THR A 62 -17.685 -10.010 1.226 1.00 3.65 N ATOM 945 CA THR A 62 -18.051 -11.147 2.056 1.00 4.03 C ATOM 946 C THR A 62 -17.317 -11.090 3.398 1.00 4.27 C ATOM 947 O THR A 62 -16.091 -10.998 3.437 1.00 4.71 O ATOM 948 CB THR A 62 -17.730 -12.470 1.334 1.00 4.83 C ATOM 949 OG1 THR A 62 -18.358 -12.476 0.045 1.00 5.19 O ATOM 950 CG2 THR A 62 -18.208 -13.671 2.138 1.00 5.45 C ATOM 0 H THR A 62 -16.681 -9.848 1.154 1.00 3.65 H new ATOM 0 HA THR A 62 -19.124 -11.102 2.242 1.00 4.03 H new ATOM 0 HB THR A 62 -16.648 -12.544 1.224 1.00 4.83 H new ATOM 0 HG1 THR A 62 -17.956 -11.782 -0.518 1.00 5.19 H new ATOM 0 HG21 THR A 62 -17.966 -14.588 1.601 1.00 5.45 H new ATOM 0 HG22 THR A 62 -17.714 -13.678 3.110 1.00 5.45 H new ATOM 0 HG23 THR A 62 -19.287 -13.608 2.280 1.00 5.45 H new ATOM 958 N PRO A 63 -18.067 -11.116 4.512 1.00 4.49 N ATOM 959 CA PRO A 63 -17.491 -11.051 5.857 1.00 5.20 C ATOM 960 C PRO A 63 -16.918 -12.390 6.328 1.00 5.56 C ATOM 961 O PRO A 63 -17.530 -13.443 6.146 1.00 6.11 O ATOM 962 CB PRO A 63 -18.685 -10.641 6.720 1.00 5.69 C ATOM 963 CG PRO A 63 -19.872 -11.209 6.018 1.00 5.34 C ATOM 964 CD PRO A 63 -19.541 -11.200 4.545 1.00 4.58 C ATOM 0 HA PRO A 63 -16.647 -10.364 5.906 1.00 5.20 H new ATOM 0 HB2 PRO A 63 -18.597 -11.036 7.732 1.00 5.69 H new ATOM 0 HB3 PRO A 63 -18.757 -9.557 6.807 1.00 5.69 H new ATOM 0 HG2 PRO A 63 -20.079 -12.222 6.363 1.00 5.34 H new ATOM 0 HG3 PRO A 63 -20.763 -10.615 6.219 1.00 5.34 H new ATOM 0 HD2 PRO A 63 -19.901 -12.102 4.049 1.00 4.58 H new ATOM 0 HD3 PRO A 63 -20.001 -10.352 4.037 1.00 4.58 H new ATOM 972 N GLY A 64 -15.740 -12.329 6.932 1.00 5.49 N ATOM 973 CA GLY A 64 -15.086 -13.516 7.444 1.00 6.04 C ATOM 974 C GLY A 64 -13.607 -13.269 7.639 1.00 5.99 C ATOM 975 O GLY A 64 -13.218 -12.221 8.156 1.00 6.36 O ATOM 0 H GLY A 64 -15.219 -11.464 7.078 1.00 5.49 H new ATOM 0 HA2 GLY A 64 -15.539 -13.807 8.392 1.00 6.04 H new ATOM 0 HA3 GLY A 64 -15.233 -14.345 6.752 1.00 6.04 H new ATOM 979 N HIS A 65 -12.779 -14.222 7.238 1.00 5.85 N ATOM 980 CA HIS A 65 -11.338 -14.003 7.207 1.00 6.04 C ATOM 981 C HIS A 65 -10.940 -13.422 5.862 1.00 5.42 C ATOM 982 O HIS A 65 -9.830 -12.920 5.681 1.00 5.51 O ATOM 983 CB HIS A 65 -10.564 -15.296 7.465 1.00 6.53 C ATOM 984 CG HIS A 65 -10.534 -15.709 8.902 1.00 7.30 C ATOM 985 ND1 HIS A 65 -10.102 -14.882 9.914 1.00 8.05 N ATOM 986 CD2 HIS A 65 -10.869 -16.878 9.495 1.00 7.71 C ATOM 987 CE1 HIS A 65 -10.170 -15.521 11.063 1.00 8.78 C ATOM 988 NE2 HIS A 65 -10.634 -16.736 10.841 1.00 8.61 N ATOM 0 H HIS A 65 -13.076 -15.148 6.931 1.00 5.85 H new ATOM 0 HA HIS A 65 -11.086 -13.302 8.003 1.00 6.04 H new ATOM 0 HB2 HIS A 65 -11.009 -16.098 6.876 1.00 6.53 H new ATOM 0 HB3 HIS A 65 -9.540 -15.172 7.112 1.00 6.53 H new ATOM 0 HD2 HIS A 65 -11.251 -17.760 9.002 1.00 7.71 H new ATOM 0 HE1 HIS A 65 -9.892 -15.118 12.026 1.00 8.78 H new ATOM 0 HE2 HIS A 65 -10.792 -17.451 11.551 1.00 8.61 H new ATOM 997 N GLU A 66 -11.856 -13.513 4.913 1.00 5.13 N ATOM 998 CA GLU A 66 -11.657 -12.935 3.602 1.00 4.83 C ATOM 999 C GLU A 66 -12.192 -11.512 3.566 1.00 4.30 C ATOM 1000 O GLU A 66 -12.929 -11.084 4.454 1.00 4.72 O ATOM 1001 CB GLU A 66 -12.348 -13.772 2.518 1.00 5.31 C ATOM 1002 CG GLU A 66 -11.913 -15.229 2.489 1.00 5.97 C ATOM 1003 CD GLU A 66 -12.843 -16.134 3.271 1.00 6.59 C ATOM 1004 OE1 GLU A 66 -12.873 -16.023 4.512 1.00 6.87 O ATOM 1005 OE2 GLU A 66 -13.556 -16.952 2.651 1.00 7.05 O ATOM 0 H GLU A 66 -12.751 -13.987 5.031 1.00 5.13 H new ATOM 0 HA GLU A 66 -10.586 -12.924 3.401 1.00 4.83 H new ATOM 0 HB2 GLU A 66 -13.426 -13.729 2.672 1.00 5.31 H new ATOM 0 HB3 GLU A 66 -12.147 -13.324 1.545 1.00 5.31 H new ATOM 0 HG2 GLU A 66 -11.867 -15.569 1.455 1.00 5.97 H new ATOM 0 HG3 GLU A 66 -10.905 -15.311 2.897 1.00 5.97 H new ATOM 1012 N ALA A 67 -11.803 -10.789 2.533 1.00 3.82 N ATOM 1013 CA ALA A 67 -12.258 -9.426 2.308 1.00 3.70 C ATOM 1014 C ALA A 67 -12.190 -9.135 0.822 1.00 2.58 C ATOM 1015 O ALA A 67 -13.024 -8.417 0.275 1.00 2.95 O ATOM 1016 CB ALA A 67 -11.419 -8.432 3.096 1.00 4.55 C ATOM 0 H ALA A 67 -11.158 -11.131 1.821 1.00 3.82 H new ATOM 0 HA ALA A 67 -13.286 -9.323 2.656 1.00 3.70 H new ATOM 0 HB1 ALA A 67 -11.781 -7.421 2.909 1.00 4.55 H new ATOM 0 HB2 ALA A 67 -11.496 -8.654 4.160 1.00 4.55 H new ATOM 0 HB3 ALA A 67 -10.377 -8.508 2.784 1.00 4.55 H new ATOM 1022 N PHE A 68 -11.158 -9.703 0.192 1.00 1.79 N ATOM 1023 CA PHE A 68 -11.026 -9.734 -1.258 1.00 1.15 C ATOM 1024 C PHE A 68 -12.331 -10.215 -1.879 1.00 1.77 C ATOM 1025 O PHE A 68 -12.892 -11.221 -1.433 1.00 2.37 O ATOM 1026 CB PHE A 68 -9.908 -10.710 -1.615 1.00 1.18 C ATOM 1027 CG PHE A 68 -9.009 -10.264 -2.724 1.00 1.12 C ATOM 1028 CD1 PHE A 68 -9.401 -10.371 -4.045 1.00 1.67 C ATOM 1029 CD2 PHE A 68 -7.758 -9.759 -2.434 1.00 1.08 C ATOM 1030 CE1 PHE A 68 -8.555 -9.974 -5.062 1.00 2.10 C ATOM 1031 CE2 PHE A 68 -6.908 -9.357 -3.444 1.00 1.52 C ATOM 1032 CZ PHE A 68 -7.308 -9.465 -4.759 1.00 2.00 C ATOM 0 H PHE A 68 -10.387 -10.156 0.682 1.00 1.79 H new ATOM 0 HA PHE A 68 -10.797 -8.738 -1.636 1.00 1.15 H new ATOM 0 HB2 PHE A 68 -9.303 -10.887 -0.726 1.00 1.18 H new ATOM 0 HB3 PHE A 68 -10.355 -11.665 -1.891 1.00 1.18 H new ATOM 0 HD1 PHE A 68 -10.376 -10.768 -4.284 1.00 1.67 H new ATOM 0 HD2 PHE A 68 -7.441 -9.677 -1.405 1.00 1.08 H new ATOM 0 HE1 PHE A 68 -8.868 -10.062 -6.092 1.00 2.10 H new ATOM 0 HE2 PHE A 68 -5.933 -8.959 -3.205 1.00 1.52 H new ATOM 0 HZ PHE A 68 -6.646 -9.151 -5.552 1.00 2.00 H new ATOM 1042 N THR A 69 -12.803 -9.509 -2.901 1.00 2.35 N ATOM 1043 CA THR A 69 -14.083 -9.823 -3.516 1.00 3.31 C ATOM 1044 C THR A 69 -14.143 -11.277 -3.967 1.00 3.54 C ATOM 1045 O THR A 69 -13.225 -11.778 -4.625 1.00 3.89 O ATOM 1046 CB THR A 69 -14.379 -8.900 -4.717 1.00 4.11 C ATOM 1047 OG1 THR A 69 -13.292 -8.929 -5.650 1.00 4.46 O ATOM 1048 CG2 THR A 69 -14.618 -7.472 -4.256 1.00 4.90 C ATOM 0 H THR A 69 -12.317 -8.716 -3.319 1.00 2.35 H new ATOM 0 HA THR A 69 -14.843 -9.658 -2.753 1.00 3.31 H new ATOM 0 HB THR A 69 -15.281 -9.266 -5.207 1.00 4.11 H new ATOM 0 HG1 THR A 69 -12.623 -8.260 -5.394 1.00 4.46 H new ATOM 0 HG21 THR A 69 -14.824 -6.840 -5.120 1.00 4.90 H new ATOM 0 HG22 THR A 69 -15.470 -7.447 -3.576 1.00 4.90 H new ATOM 0 HG23 THR A 69 -13.731 -7.103 -3.740 1.00 4.90 H new ATOM 1056 N THR A 70 -15.211 -11.964 -3.577 1.00 3.82 N ATOM 1057 CA THR A 70 -15.419 -13.347 -3.970 1.00 4.35 C ATOM 1058 C THR A 70 -15.687 -13.428 -5.470 1.00 4.41 C ATOM 1059 O THR A 70 -16.836 -13.414 -5.922 1.00 4.95 O ATOM 1060 CB THR A 70 -16.582 -13.975 -3.182 1.00 5.16 C ATOM 1061 OG1 THR A 70 -16.402 -13.710 -1.788 1.00 5.40 O ATOM 1062 CG2 THR A 70 -16.650 -15.479 -3.410 1.00 5.84 C ATOM 0 H THR A 70 -15.948 -11.580 -2.986 1.00 3.82 H new ATOM 0 HA THR A 70 -14.515 -13.910 -3.740 1.00 4.35 H new ATOM 0 HB THR A 70 -17.516 -13.535 -3.531 1.00 5.16 H new ATOM 0 HG1 THR A 70 -16.684 -12.793 -1.590 1.00 5.40 H new ATOM 0 HG21 THR A 70 -17.481 -15.896 -2.841 1.00 5.84 H new ATOM 0 HG22 THR A 70 -16.800 -15.680 -4.471 1.00 5.84 H new ATOM 0 HG23 THR A 70 -15.718 -15.939 -3.082 1.00 5.84 H new ATOM 1070 N MET A 71 -14.609 -13.482 -6.230 1.00 4.19 N ATOM 1071 CA MET A 71 -14.675 -13.470 -7.679 1.00 4.50 C ATOM 1072 C MET A 71 -14.715 -14.881 -8.245 1.00 4.86 C ATOM 1073 O MET A 71 -13.842 -15.705 -7.975 1.00 5.21 O ATOM 1074 CB MET A 71 -13.478 -12.697 -8.247 1.00 4.42 C ATOM 1075 CG MET A 71 -12.126 -13.227 -7.783 1.00 4.38 C ATOM 1076 SD MET A 71 -10.751 -12.187 -8.306 1.00 4.69 S ATOM 1077 CE MET A 71 -11.126 -10.669 -7.431 1.00 4.34 C ATOM 0 H MET A 71 -13.661 -13.536 -5.859 1.00 4.19 H new ATOM 0 HA MET A 71 -15.598 -12.971 -7.975 1.00 4.50 H new ATOM 0 HB2 MET A 71 -13.518 -12.733 -9.336 1.00 4.42 H new ATOM 0 HB3 MET A 71 -13.565 -11.649 -7.960 1.00 4.42 H new ATOM 0 HG2 MET A 71 -12.125 -13.303 -6.696 1.00 4.38 H new ATOM 0 HG3 MET A 71 -11.982 -14.234 -8.173 1.00 4.38 H new ATOM 0 HE1 MET A 71 -10.287 -9.980 -7.522 1.00 4.34 H new ATOM 0 HE2 MET A 71 -12.018 -10.213 -7.860 1.00 4.34 H new ATOM 0 HE3 MET A 71 -11.301 -10.890 -6.378 1.00 4.34 H new ATOM 1087 N ARG A 72 -15.756 -15.162 -9.006 1.00 5.04 N ATOM 1088 CA ARG A 72 -15.858 -16.416 -9.730 1.00 5.54 C ATOM 1089 C ARG A 72 -15.907 -16.129 -11.220 1.00 5.80 C ATOM 1090 O ARG A 72 -15.381 -16.890 -12.031 1.00 6.36 O ATOM 1091 CB ARG A 72 -17.109 -17.185 -9.305 1.00 5.95 C ATOM 1092 CG ARG A 72 -17.165 -18.598 -9.856 1.00 6.36 C ATOM 1093 CD ARG A 72 -18.501 -19.253 -9.562 1.00 6.73 C ATOM 1094 NE ARG A 72 -19.595 -18.612 -10.290 1.00 7.09 N ATOM 1095 CZ ARG A 72 -20.885 -18.878 -10.086 1.00 7.63 C ATOM 1096 NH1 ARG A 72 -21.247 -19.747 -9.152 1.00 7.86 N ATOM 1097 NH2 ARG A 72 -21.810 -18.270 -10.817 1.00 8.21 N ATOM 0 H ARG A 72 -16.549 -14.534 -9.140 1.00 5.04 H new ATOM 0 HA ARG A 72 -14.987 -17.030 -9.502 1.00 5.54 H new ATOM 0 HB2 ARG A 72 -17.149 -17.226 -8.216 1.00 5.95 H new ATOM 0 HB3 ARG A 72 -17.992 -16.639 -9.636 1.00 5.95 H new ATOM 0 HG2 ARG A 72 -16.997 -18.577 -10.933 1.00 6.36 H new ATOM 0 HG3 ARG A 72 -16.362 -19.193 -9.420 1.00 6.36 H new ATOM 0 HD2 ARG A 72 -18.455 -20.308 -9.831 1.00 6.73 H new ATOM 0 HD3 ARG A 72 -18.701 -19.206 -8.491 1.00 6.73 H new ATOM 0 HE ARG A 72 -19.356 -17.918 -10.998 1.00 7.09 H new ATOM 0 HH11 ARG A 72 -20.537 -20.214 -8.587 1.00 7.86 H new ATOM 0 HH12 ARG A 72 -22.235 -19.948 -8.998 1.00 7.86 H new ATOM 0 HH21 ARG A 72 -21.534 -17.600 -11.534 1.00 8.21 H new ATOM 0 HH22 ARG A 72 -22.797 -18.473 -10.662 1.00 8.21 H new ATOM 1111 N ALA A 73 -16.539 -15.013 -11.563 1.00 5.58 N ATOM 1112 CA ALA A 73 -16.632 -14.570 -12.946 1.00 6.01 C ATOM 1113 C ALA A 73 -15.242 -14.339 -13.526 1.00 5.86 C ATOM 1114 O ALA A 73 -14.842 -15.020 -14.471 1.00 6.36 O ATOM 1115 CB ALA A 73 -17.464 -13.300 -13.032 1.00 6.36 C ATOM 0 H ALA A 73 -16.998 -14.394 -10.894 1.00 5.58 H new ATOM 0 HA ALA A 73 -17.121 -15.348 -13.531 1.00 6.01 H new ATOM 0 HB1 ALA A 73 -17.528 -12.976 -14.071 1.00 6.36 H new ATOM 0 HB2 ALA A 73 -18.466 -13.495 -12.651 1.00 6.36 H new ATOM 0 HB3 ALA A 73 -16.995 -12.517 -12.436 1.00 6.36 H new ATOM 1121 N ARG A 74 -14.512 -13.386 -12.946 1.00 5.40 N ATOM 1122 CA ARG A 74 -13.151 -13.069 -13.379 1.00 5.50 C ATOM 1123 C ARG A 74 -13.131 -12.627 -14.843 1.00 5.18 C ATOM 1124 O ARG A 74 -14.174 -12.305 -15.423 1.00 5.49 O ATOM 1125 CB ARG A 74 -12.226 -14.281 -13.181 1.00 6.12 C ATOM 1126 CG ARG A 74 -12.159 -14.775 -11.744 1.00 6.76 C ATOM 1127 CD ARG A 74 -11.277 -16.007 -11.625 1.00 7.55 C ATOM 1128 NE ARG A 74 -11.752 -17.102 -12.472 1.00 8.14 N ATOM 1129 CZ ARG A 74 -11.383 -18.376 -12.328 1.00 8.93 C ATOM 1130 NH1 ARG A 74 -10.565 -18.736 -11.345 1.00 9.21 N ATOM 1131 NH2 ARG A 74 -11.852 -19.290 -13.165 1.00 9.65 N ATOM 0 H ARG A 74 -14.844 -12.816 -12.168 1.00 5.40 H new ATOM 0 HA ARG A 74 -12.788 -12.244 -12.766 1.00 5.50 H new ATOM 0 HB2 ARG A 74 -12.568 -15.095 -13.820 1.00 6.12 H new ATOM 0 HB3 ARG A 74 -11.221 -14.017 -13.512 1.00 6.12 H new ATOM 0 HG2 ARG A 74 -11.771 -13.984 -11.103 1.00 6.76 H new ATOM 0 HG3 ARG A 74 -13.163 -15.008 -11.390 1.00 6.76 H new ATOM 0 HD2 ARG A 74 -10.255 -15.750 -11.903 1.00 7.55 H new ATOM 0 HD3 ARG A 74 -11.251 -16.336 -10.586 1.00 7.55 H new ATOM 0 HE ARG A 74 -12.407 -16.877 -13.220 1.00 8.14 H new ATOM 0 HH11 ARG A 74 -10.213 -18.036 -10.692 1.00 9.21 H new ATOM 0 HH12 ARG A 74 -10.289 -19.713 -11.243 1.00 9.21 H new ATOM 0 HH21 ARG A 74 -12.490 -19.017 -13.913 1.00 9.65 H new ATOM 0 HH22 ARG A 74 -11.575 -20.266 -13.062 1.00 9.65 H new ATOM 1145 N GLY A 75 -11.946 -12.595 -15.431 1.00 4.93 N ATOM 1146 CA GLY A 75 -11.823 -12.238 -16.825 1.00 4.87 C ATOM 1147 C GLY A 75 -10.584 -11.415 -17.098 1.00 4.49 C ATOM 1148 O GLY A 75 -9.510 -11.702 -16.566 1.00 4.54 O ATOM 0 H GLY A 75 -11.065 -12.811 -14.965 1.00 4.93 H new ATOM 0 HA2 GLY A 75 -11.795 -13.145 -17.429 1.00 4.87 H new ATOM 0 HA3 GLY A 75 -12.705 -11.677 -17.133 1.00 4.87 H new ATOM 1152 N ALA A 76 -10.736 -10.389 -17.920 1.00 4.53 N ATOM 1153 CA ALA A 76 -9.628 -9.513 -18.269 1.00 4.52 C ATOM 1154 C ALA A 76 -9.287 -8.569 -17.121 1.00 3.91 C ATOM 1155 O ALA A 76 -9.807 -7.454 -17.051 1.00 4.15 O ATOM 1156 CB ALA A 76 -9.965 -8.724 -19.525 1.00 5.47 C ATOM 0 H ALA A 76 -11.622 -10.141 -18.361 1.00 4.53 H new ATOM 0 HA ALA A 76 -8.751 -10.131 -18.462 1.00 4.52 H new ATOM 0 HB1 ALA A 76 -9.130 -8.071 -19.779 1.00 5.47 H new ATOM 0 HB2 ALA A 76 -10.150 -9.413 -20.349 1.00 5.47 H new ATOM 0 HB3 ALA A 76 -10.856 -8.122 -19.348 1.00 5.47 H new ATOM 1162 N GLN A 77 -8.420 -9.040 -16.220 1.00 3.61 N ATOM 1163 CA GLN A 77 -7.943 -8.250 -15.082 1.00 3.40 C ATOM 1164 C GLN A 77 -9.069 -7.903 -14.111 1.00 2.90 C ATOM 1165 O GLN A 77 -9.858 -6.988 -14.351 1.00 3.33 O ATOM 1166 CB GLN A 77 -7.249 -6.969 -15.560 1.00 4.25 C ATOM 1167 CG GLN A 77 -5.877 -7.210 -16.167 1.00 4.87 C ATOM 1168 CD GLN A 77 -4.842 -7.620 -15.134 1.00 5.70 C ATOM 1169 OE1 GLN A 77 -4.974 -7.108 -13.918 1.00 6.14 O flip ATOM 1170 NE2 GLN A 77 -3.921 -8.379 -15.431 1.00 6.26 N flip ATOM 0 H GLN A 77 -8.029 -9.981 -16.260 1.00 3.61 H new ATOM 0 HA GLN A 77 -7.222 -8.868 -14.547 1.00 3.40 H new ATOM 0 HB2 GLN A 77 -7.882 -6.477 -16.298 1.00 4.25 H new ATOM 0 HB3 GLN A 77 -7.149 -6.284 -14.718 1.00 4.25 H new ATOM 0 HG2 GLN A 77 -5.952 -7.987 -16.928 1.00 4.87 H new ATOM 0 HG3 GLN A 77 -5.542 -6.303 -16.670 1.00 4.87 H new ATOM 0 HE21 GLN A 77 -3.853 -8.753 -16.378 1.00 6.26 H new ATOM 0 HE22 GLN A 77 -3.225 -8.635 -14.731 1.00 6.26 H new ATOM 1179 N VAL A 78 -9.125 -8.633 -13.004 1.00 2.65 N ATOM 1180 CA VAL A 78 -10.114 -8.368 -11.967 1.00 2.75 C ATOM 1181 C VAL A 78 -9.846 -7.021 -11.295 1.00 2.21 C ATOM 1182 O VAL A 78 -8.720 -6.726 -10.894 1.00 2.72 O ATOM 1183 CB VAL A 78 -10.148 -9.486 -10.902 1.00 3.65 C ATOM 1184 CG1 VAL A 78 -10.758 -10.751 -11.489 1.00 4.31 C ATOM 1185 CG2 VAL A 78 -8.753 -9.770 -10.359 1.00 4.21 C ATOM 0 H VAL A 78 -8.498 -9.412 -12.801 1.00 2.65 H new ATOM 0 HA VAL A 78 -11.088 -8.339 -12.456 1.00 2.75 H new ATOM 0 HB VAL A 78 -10.768 -9.147 -10.072 1.00 3.65 H new ATOM 0 HG11 VAL A 78 -10.777 -11.532 -10.729 1.00 4.31 H new ATOM 0 HG12 VAL A 78 -11.775 -10.544 -11.822 1.00 4.31 H new ATOM 0 HG13 VAL A 78 -10.160 -11.084 -12.337 1.00 4.31 H new ATOM 0 HG21 VAL A 78 -8.808 -10.561 -9.611 1.00 4.21 H new ATOM 0 HG22 VAL A 78 -8.102 -10.086 -11.175 1.00 4.21 H new ATOM 0 HG23 VAL A 78 -8.349 -8.866 -9.902 1.00 4.21 H new ATOM 1195 N THR A 79 -10.882 -6.207 -11.190 1.00 1.82 N ATOM 1196 CA THR A 79 -10.739 -4.863 -10.658 1.00 1.90 C ATOM 1197 C THR A 79 -10.995 -4.828 -9.153 1.00 1.53 C ATOM 1198 O THR A 79 -11.846 -4.072 -8.676 1.00 1.82 O ATOM 1199 CB THR A 79 -11.707 -3.893 -11.363 1.00 2.70 C ATOM 1200 OG1 THR A 79 -11.863 -4.273 -12.735 1.00 3.20 O ATOM 1201 CG2 THR A 79 -11.193 -2.461 -11.289 1.00 3.41 C ATOM 0 H THR A 79 -11.832 -6.454 -11.466 1.00 1.82 H new ATOM 0 HA THR A 79 -9.712 -4.549 -10.844 1.00 1.90 H new ATOM 0 HB THR A 79 -12.670 -3.944 -10.855 1.00 2.70 H new ATOM 0 HG1 THR A 79 -12.481 -3.654 -13.178 1.00 3.20 H new ATOM 0 HG21 THR A 79 -11.894 -1.796 -11.794 1.00 3.41 H new ATOM 0 HG22 THR A 79 -11.097 -2.162 -10.245 1.00 3.41 H new ATOM 0 HG23 THR A 79 -10.219 -2.398 -11.775 1.00 3.41 H new ATOM 1209 N ASP A 80 -10.271 -5.650 -8.410 1.00 1.21 N ATOM 1210 CA ASP A 80 -10.341 -5.600 -6.959 1.00 1.14 C ATOM 1211 C ASP A 80 -9.343 -4.568 -6.466 1.00 0.88 C ATOM 1212 O ASP A 80 -8.203 -4.523 -6.932 1.00 1.12 O ATOM 1213 CB ASP A 80 -10.037 -6.965 -6.328 1.00 1.60 C ATOM 1214 CG ASP A 80 -10.372 -7.020 -4.841 1.00 2.14 C ATOM 1215 OD1 ASP A 80 -9.724 -6.311 -4.041 1.00 2.66 O ATOM 1216 OD2 ASP A 80 -11.291 -7.778 -4.469 1.00 2.60 O ATOM 0 H ASP A 80 -9.634 -6.354 -8.784 1.00 1.21 H new ATOM 0 HA ASP A 80 -11.354 -5.326 -6.665 1.00 1.14 H new ATOM 0 HB2 ASP A 80 -10.603 -7.736 -6.851 1.00 1.60 H new ATOM 0 HB3 ASP A 80 -8.981 -7.196 -6.466 1.00 1.60 H new ATOM 1221 N ILE A 81 -9.778 -3.722 -5.557 1.00 0.63 N ATOM 1222 CA ILE A 81 -8.922 -2.677 -5.036 1.00 0.42 C ATOM 1223 C ILE A 81 -8.690 -2.901 -3.557 1.00 0.38 C ATOM 1224 O ILE A 81 -9.583 -2.662 -2.741 1.00 0.57 O ATOM 1225 CB ILE A 81 -9.539 -1.280 -5.241 1.00 0.42 C ATOM 1226 CG1 ILE A 81 -9.988 -1.104 -6.693 1.00 0.56 C ATOM 1227 CG2 ILE A 81 -8.528 -0.204 -4.862 1.00 0.50 C ATOM 1228 CD1 ILE A 81 -10.800 0.150 -6.927 1.00 0.71 C ATOM 0 H ILE A 81 -10.719 -3.737 -5.163 1.00 0.63 H new ATOM 0 HA ILE A 81 -7.979 -2.718 -5.581 1.00 0.42 H new ATOM 0 HB ILE A 81 -10.413 -1.183 -4.597 1.00 0.42 H new ATOM 0 HG12 ILE A 81 -9.109 -1.083 -7.337 1.00 0.56 H new ATOM 0 HG13 ILE A 81 -10.579 -1.970 -6.989 1.00 0.56 H new ATOM 0 HG21 ILE A 81 -8.972 0.781 -5.010 1.00 0.50 H new ATOM 0 HG22 ILE A 81 -8.246 -0.322 -3.816 1.00 0.50 H new ATOM 0 HG23 ILE A 81 -7.642 -0.300 -5.489 1.00 0.50 H new ATOM 0 HD11 ILE A 81 -11.084 0.209 -7.978 1.00 0.71 H new ATOM 0 HD12 ILE A 81 -11.698 0.122 -6.310 1.00 0.71 H new ATOM 0 HD13 ILE A 81 -10.204 1.024 -6.662 1.00 0.71 H new ATOM 1240 N VAL A 82 -7.502 -3.356 -3.204 1.00 0.27 N ATOM 1241 CA VAL A 82 -7.220 -3.652 -1.813 1.00 0.28 C ATOM 1242 C VAL A 82 -6.580 -2.476 -1.125 1.00 0.23 C ATOM 1243 O VAL A 82 -5.475 -2.062 -1.461 1.00 0.26 O ATOM 1244 CB VAL A 82 -6.341 -4.902 -1.637 1.00 0.35 C ATOM 1245 CG1 VAL A 82 -5.790 -4.997 -0.215 1.00 1.02 C ATOM 1246 CG2 VAL A 82 -7.162 -6.123 -1.955 1.00 1.17 C ATOM 0 H VAL A 82 -6.730 -3.526 -3.848 1.00 0.27 H new ATOM 0 HA VAL A 82 -8.183 -3.859 -1.347 1.00 0.28 H new ATOM 0 HB VAL A 82 -5.492 -4.834 -2.317 1.00 0.35 H new ATOM 0 HG11 VAL A 82 -5.173 -5.891 -0.123 1.00 1.02 H new ATOM 0 HG12 VAL A 82 -5.186 -4.116 0.001 1.00 1.02 H new ATOM 0 HG13 VAL A 82 -6.617 -5.052 0.493 1.00 1.02 H new ATOM 0 HG21 VAL A 82 -6.549 -7.016 -1.833 1.00 1.17 H new ATOM 0 HG22 VAL A 82 -8.015 -6.174 -1.278 1.00 1.17 H new ATOM 0 HG23 VAL A 82 -7.518 -6.064 -2.984 1.00 1.17 H new ATOM 1256 N ILE A 83 -7.298 -1.937 -0.173 1.00 0.22 N ATOM 1257 CA ILE A 83 -6.763 -0.912 0.686 1.00 0.19 C ATOM 1258 C ILE A 83 -5.975 -1.545 1.794 1.00 0.19 C ATOM 1259 O ILE A 83 -6.465 -2.414 2.506 1.00 0.24 O ATOM 1260 CB ILE A 83 -7.844 0.005 1.277 1.00 0.22 C ATOM 1261 CG1 ILE A 83 -8.413 0.851 0.157 1.00 0.27 C ATOM 1262 CG2 ILE A 83 -7.266 0.884 2.389 1.00 0.24 C ATOM 1263 CD1 ILE A 83 -9.366 1.935 0.616 1.00 0.37 C ATOM 0 H ILE A 83 -8.264 -2.194 0.028 1.00 0.22 H new ATOM 0 HA ILE A 83 -6.120 -0.284 0.069 1.00 0.19 H new ATOM 0 HB ILE A 83 -8.636 -0.596 1.724 1.00 0.22 H new ATOM 0 HG12 ILE A 83 -7.590 1.314 -0.387 1.00 0.27 H new ATOM 0 HG13 ILE A 83 -8.933 0.200 -0.546 1.00 0.27 H new ATOM 0 HG21 ILE A 83 -8.051 1.524 2.792 1.00 0.24 H new ATOM 0 HG22 ILE A 83 -6.870 0.252 3.184 1.00 0.24 H new ATOM 0 HG23 ILE A 83 -6.465 1.503 1.984 1.00 0.24 H new ATOM 0 HD11 ILE A 83 -9.726 2.493 -0.248 1.00 0.37 H new ATOM 0 HD12 ILE A 83 -10.211 1.481 1.133 1.00 0.37 H new ATOM 0 HD13 ILE A 83 -8.847 2.612 1.294 1.00 0.37 H new ATOM 1275 N LEU A 84 -4.752 -1.111 1.923 1.00 0.19 N ATOM 1276 CA LEU A 84 -3.873 -1.650 2.917 1.00 0.23 C ATOM 1277 C LEU A 84 -3.551 -0.552 3.922 1.00 0.24 C ATOM 1278 O LEU A 84 -2.830 0.398 3.622 1.00 0.31 O ATOM 1279 CB LEU A 84 -2.628 -2.235 2.230 1.00 0.39 C ATOM 1280 CG LEU A 84 -1.530 -2.787 3.139 1.00 0.31 C ATOM 1281 CD1 LEU A 84 -0.649 -1.656 3.603 1.00 0.91 C ATOM 1282 CD2 LEU A 84 -2.114 -3.541 4.328 1.00 1.01 C ATOM 0 H LEU A 84 -4.341 -0.378 1.345 1.00 0.19 H new ATOM 0 HA LEU A 84 -4.338 -2.469 3.466 1.00 0.23 H new ATOM 0 HB2 LEU A 84 -2.952 -3.036 1.566 1.00 0.39 H new ATOM 0 HB3 LEU A 84 -2.190 -1.458 1.603 1.00 0.39 H new ATOM 0 HG LEU A 84 -0.933 -3.499 2.569 1.00 0.31 H new ATOM 0 HD11 LEU A 84 0.135 -2.048 4.251 1.00 0.91 H new ATOM 0 HD12 LEU A 84 -0.196 -1.170 2.739 1.00 0.91 H new ATOM 0 HD13 LEU A 84 -1.248 -0.931 4.155 1.00 0.91 H new ATOM 0 HD21 LEU A 84 -1.304 -3.919 4.952 1.00 1.01 H new ATOM 0 HD22 LEU A 84 -2.740 -2.868 4.914 1.00 1.01 H new ATOM 0 HD23 LEU A 84 -2.716 -4.376 3.969 1.00 1.01 H new ATOM 1294 N VAL A 85 -4.143 -0.666 5.091 1.00 0.21 N ATOM 1295 CA VAL A 85 -3.975 0.316 6.138 1.00 0.27 C ATOM 1296 C VAL A 85 -2.768 -0.012 7.001 1.00 0.25 C ATOM 1297 O VAL A 85 -2.766 -1.003 7.739 1.00 0.29 O ATOM 1298 CB VAL A 85 -5.234 0.389 7.020 1.00 0.34 C ATOM 1299 CG1 VAL A 85 -5.059 1.427 8.104 1.00 0.43 C ATOM 1300 CG2 VAL A 85 -6.464 0.695 6.178 1.00 0.40 C ATOM 0 H VAL A 85 -4.755 -1.443 5.342 1.00 0.21 H new ATOM 0 HA VAL A 85 -3.815 1.284 5.663 1.00 0.27 H new ATOM 0 HB VAL A 85 -5.379 -0.582 7.493 1.00 0.34 H new ATOM 0 HG11 VAL A 85 -5.958 1.466 8.719 1.00 0.43 H new ATOM 0 HG12 VAL A 85 -4.205 1.162 8.727 1.00 0.43 H new ATOM 0 HG13 VAL A 85 -4.888 2.403 7.649 1.00 0.43 H new ATOM 0 HG21 VAL A 85 -7.343 0.742 6.821 1.00 0.40 H new ATOM 0 HG22 VAL A 85 -6.331 1.653 5.674 1.00 0.40 H new ATOM 0 HG23 VAL A 85 -6.600 -0.090 5.434 1.00 0.40 H new ATOM 1310 N VAL A 86 -1.732 0.800 6.876 1.00 0.22 N ATOM 1311 CA VAL A 86 -0.556 0.665 7.709 1.00 0.20 C ATOM 1312 C VAL A 86 -0.291 1.931 8.498 1.00 0.17 C ATOM 1313 O VAL A 86 -0.378 3.038 7.970 1.00 0.22 O ATOM 1314 CB VAL A 86 0.697 0.338 6.884 1.00 0.23 C ATOM 1315 CG1 VAL A 86 0.754 -1.142 6.577 1.00 0.49 C ATOM 1316 CG2 VAL A 86 0.728 1.154 5.603 1.00 0.64 C ATOM 0 H VAL A 86 -1.685 1.563 6.201 1.00 0.22 H new ATOM 0 HA VAL A 86 -0.762 -0.160 8.391 1.00 0.20 H new ATOM 0 HB VAL A 86 1.575 0.602 7.473 1.00 0.23 H new ATOM 0 HG11 VAL A 86 1.648 -1.358 5.992 1.00 0.49 H new ATOM 0 HG12 VAL A 86 0.786 -1.706 7.509 1.00 0.49 H new ATOM 0 HG13 VAL A 86 -0.130 -1.430 6.009 1.00 0.49 H new ATOM 0 HG21 VAL A 86 1.624 0.906 5.035 1.00 0.64 H new ATOM 0 HG22 VAL A 86 -0.155 0.927 5.005 1.00 0.64 H new ATOM 0 HG23 VAL A 86 0.737 2.216 5.848 1.00 0.64 H new ATOM 1326 N ALA A 87 0.021 1.765 9.761 1.00 0.17 N ATOM 1327 CA ALA A 87 0.407 2.879 10.599 1.00 0.18 C ATOM 1328 C ALA A 87 1.815 3.322 10.245 1.00 0.16 C ATOM 1329 O ALA A 87 2.706 2.489 10.117 1.00 0.24 O ATOM 1330 CB ALA A 87 0.333 2.474 12.060 1.00 0.28 C ATOM 0 H ALA A 87 0.015 0.862 10.236 1.00 0.17 H new ATOM 0 HA ALA A 87 -0.277 3.711 10.432 1.00 0.18 H new ATOM 0 HB1 ALA A 87 0.625 3.317 12.686 1.00 0.28 H new ATOM 0 HB2 ALA A 87 -0.687 2.177 12.304 1.00 0.28 H new ATOM 0 HB3 ALA A 87 1.008 1.637 12.240 1.00 0.28 H new ATOM 1336 N ALA A 88 2.034 4.623 10.104 1.00 0.12 N ATOM 1337 CA ALA A 88 3.365 5.111 9.763 1.00 0.14 C ATOM 1338 C ALA A 88 4.236 5.113 10.986 1.00 0.16 C ATOM 1339 O ALA A 88 5.443 5.340 10.912 1.00 0.22 O ATOM 1340 CB ALA A 88 3.308 6.505 9.188 1.00 0.17 C ATOM 0 H ALA A 88 1.324 5.347 10.217 1.00 0.12 H new ATOM 0 HA ALA A 88 3.784 4.444 9.009 1.00 0.14 H new ATOM 0 HB1 ALA A 88 4.316 6.840 8.944 1.00 0.17 H new ATOM 0 HB2 ALA A 88 2.699 6.501 8.284 1.00 0.17 H new ATOM 0 HB3 ALA A 88 2.868 7.183 9.920 1.00 0.17 H new ATOM 1346 N ASP A 89 3.608 4.879 12.112 1.00 0.16 N ATOM 1347 CA ASP A 89 4.325 4.847 13.368 1.00 0.21 C ATOM 1348 C ASP A 89 4.833 3.430 13.656 1.00 0.22 C ATOM 1349 O ASP A 89 5.646 3.222 14.557 1.00 0.37 O ATOM 1350 CB ASP A 89 3.425 5.342 14.508 1.00 0.30 C ATOM 1351 CG ASP A 89 2.813 4.216 15.325 1.00 0.39 C ATOM 1352 OD1 ASP A 89 2.105 3.375 14.738 1.00 0.47 O ATOM 1353 OD2 ASP A 89 3.043 4.160 16.550 1.00 0.58 O ATOM 0 H ASP A 89 2.605 4.708 12.187 1.00 0.16 H new ATOM 0 HA ASP A 89 5.186 5.512 13.296 1.00 0.21 H new ATOM 0 HB2 ASP A 89 4.007 5.985 15.168 1.00 0.30 H new ATOM 0 HB3 ASP A 89 2.626 5.954 14.090 1.00 0.30 H new ATOM 1358 N ASP A 90 4.367 2.466 12.858 1.00 0.19 N ATOM 1359 CA ASP A 90 4.655 1.053 13.105 1.00 0.23 C ATOM 1360 C ASP A 90 5.097 0.345 11.818 1.00 0.25 C ATOM 1361 O ASP A 90 6.205 -0.183 11.749 1.00 0.42 O ATOM 1362 CB ASP A 90 3.417 0.384 13.699 1.00 0.26 C ATOM 1363 CG ASP A 90 3.729 -0.927 14.385 1.00 0.36 C ATOM 1364 OD1 ASP A 90 4.802 -1.023 15.015 1.00 0.56 O ATOM 1365 OD2 ASP A 90 2.927 -1.875 14.258 1.00 0.46 O ATOM 0 H ASP A 90 3.789 2.639 12.036 1.00 0.19 H new ATOM 0 HA ASP A 90 5.479 0.977 13.814 1.00 0.23 H new ATOM 0 HB2 ASP A 90 2.952 1.062 14.415 1.00 0.26 H new ATOM 0 HB3 ASP A 90 2.689 0.210 12.907 1.00 0.26 H new ATOM 1370 N GLY A 91 4.240 0.346 10.800 1.00 0.20 N ATOM 1371 CA GLY A 91 4.623 -0.183 9.495 1.00 0.21 C ATOM 1372 C GLY A 91 3.942 -1.495 9.146 1.00 0.22 C ATOM 1373 O GLY A 91 2.739 -1.645 9.327 1.00 0.37 O ATOM 0 H GLY A 91 3.286 0.703 10.852 1.00 0.20 H new ATOM 0 HA2 GLY A 91 4.385 0.555 8.729 1.00 0.21 H new ATOM 0 HA3 GLY A 91 5.703 -0.327 9.474 1.00 0.21 H new ATOM 1377 N VAL A 92 4.717 -2.437 8.631 1.00 0.26 N ATOM 1378 CA VAL A 92 4.200 -3.733 8.198 1.00 0.26 C ATOM 1379 C VAL A 92 4.466 -4.793 9.248 1.00 0.24 C ATOM 1380 O VAL A 92 5.584 -4.943 9.753 1.00 0.28 O ATOM 1381 CB VAL A 92 4.820 -4.150 6.853 1.00 0.32 C ATOM 1382 CG1 VAL A 92 4.568 -5.624 6.554 1.00 0.96 C ATOM 1383 CG2 VAL A 92 4.249 -3.287 5.746 1.00 1.03 C ATOM 0 H VAL A 92 5.723 -2.328 8.500 1.00 0.26 H new ATOM 0 HA VAL A 92 3.122 -3.637 8.065 1.00 0.26 H new ATOM 0 HB VAL A 92 5.899 -4.006 6.913 1.00 0.32 H new ATOM 0 HG11 VAL A 92 5.020 -5.883 5.597 1.00 0.96 H new ATOM 0 HG12 VAL A 92 5.009 -6.236 7.341 1.00 0.96 H new ATOM 0 HG13 VAL A 92 3.495 -5.808 6.510 1.00 0.96 H new ATOM 0 HG21 VAL A 92 4.687 -3.581 4.792 1.00 1.03 H new ATOM 0 HG22 VAL A 92 3.168 -3.418 5.704 1.00 1.03 H new ATOM 0 HG23 VAL A 92 4.481 -2.241 5.944 1.00 1.03 H new ATOM 1393 N MET A 93 3.419 -5.526 9.555 1.00 0.22 N ATOM 1394 CA MET A 93 3.408 -6.474 10.653 1.00 0.22 C ATOM 1395 C MET A 93 2.786 -7.797 10.179 1.00 0.22 C ATOM 1396 O MET A 93 2.387 -7.898 9.014 1.00 0.23 O ATOM 1397 CB MET A 93 2.605 -5.849 11.795 1.00 0.21 C ATOM 1398 CG MET A 93 3.070 -4.445 12.156 1.00 0.23 C ATOM 1399 SD MET A 93 4.603 -4.448 13.088 1.00 0.28 S ATOM 1400 CE MET A 93 3.963 -4.912 14.689 1.00 0.27 C ATOM 0 H MET A 93 2.538 -5.482 9.043 1.00 0.22 H new ATOM 0 HA MET A 93 4.417 -6.694 11.002 1.00 0.22 H new ATOM 0 HB2 MET A 93 1.552 -5.815 11.514 1.00 0.21 H new ATOM 0 HB3 MET A 93 2.680 -6.487 12.675 1.00 0.21 H new ATOM 0 HG2 MET A 93 3.204 -3.864 11.243 1.00 0.23 H new ATOM 0 HG3 MET A 93 2.295 -3.948 12.739 1.00 0.23 H new ATOM 0 HE1 MET A 93 4.140 -4.104 15.399 1.00 0.27 H new ATOM 0 HE2 MET A 93 2.892 -5.100 14.612 1.00 0.27 H new ATOM 0 HE3 MET A 93 4.466 -5.815 15.034 1.00 0.27 H new ATOM 1410 N PRO A 94 2.699 -8.833 11.050 1.00 0.25 N ATOM 1411 CA PRO A 94 2.154 -10.155 10.684 1.00 0.30 C ATOM 1412 C PRO A 94 0.847 -10.111 9.887 1.00 0.28 C ATOM 1413 O PRO A 94 0.808 -10.527 8.732 1.00 0.31 O ATOM 1414 CB PRO A 94 1.923 -10.819 12.040 1.00 0.37 C ATOM 1415 CG PRO A 94 2.966 -10.233 12.920 1.00 0.58 C ATOM 1416 CD PRO A 94 3.164 -8.816 12.453 1.00 0.30 C ATOM 0 HA PRO A 94 2.839 -10.683 10.021 1.00 0.30 H new ATOM 0 HB2 PRO A 94 0.922 -10.612 12.418 1.00 0.37 H new ATOM 0 HB3 PRO A 94 2.022 -11.903 11.974 1.00 0.37 H new ATOM 0 HG2 PRO A 94 2.653 -10.258 13.964 1.00 0.58 H new ATOM 0 HG3 PRO A 94 3.895 -10.799 12.852 1.00 0.58 H new ATOM 0 HD2 PRO A 94 2.589 -8.113 13.056 1.00 0.30 H new ATOM 0 HD3 PRO A 94 4.209 -8.515 12.523 1.00 0.30 H new ATOM 1424 N GLN A 95 -0.230 -9.607 10.484 1.00 0.29 N ATOM 1425 CA GLN A 95 -1.522 -9.637 9.813 1.00 0.32 C ATOM 1426 C GLN A 95 -1.598 -8.587 8.711 1.00 0.31 C ATOM 1427 O GLN A 95 -2.524 -8.586 7.898 1.00 0.37 O ATOM 1428 CB GLN A 95 -2.673 -9.460 10.800 1.00 0.37 C ATOM 1429 CG GLN A 95 -2.884 -8.041 11.285 1.00 0.45 C ATOM 1430 CD GLN A 95 -4.227 -7.859 11.970 1.00 0.50 C ATOM 1431 OE1 GLN A 95 -5.225 -7.550 11.319 1.00 0.75 O ATOM 1432 NE2 GLN A 95 -4.273 -8.031 13.282 1.00 0.34 N ATOM 0 H GLN A 95 -0.234 -9.182 11.411 1.00 0.29 H new ATOM 0 HA GLN A 95 -1.621 -10.621 9.355 1.00 0.32 H new ATOM 0 HB2 GLN A 95 -3.593 -9.808 10.330 1.00 0.37 H new ATOM 0 HB3 GLN A 95 -2.494 -10.101 11.663 1.00 0.37 H new ATOM 0 HG2 GLN A 95 -2.086 -7.774 11.978 1.00 0.45 H new ATOM 0 HG3 GLN A 95 -2.814 -7.356 10.440 1.00 0.45 H new ATOM 0 HE21 GLN A 95 -3.428 -8.287 13.793 1.00 0.34 H new ATOM 0 HE22 GLN A 95 -5.153 -7.908 13.782 1.00 0.34 H new ATOM 1441 N THR A 96 -0.618 -7.703 8.693 1.00 0.26 N ATOM 1442 CA THR A 96 -0.508 -6.703 7.648 1.00 0.25 C ATOM 1443 C THR A 96 -0.130 -7.379 6.347 1.00 0.25 C ATOM 1444 O THR A 96 -0.757 -7.162 5.312 1.00 0.31 O ATOM 1445 CB THR A 96 0.556 -5.660 7.983 1.00 0.25 C ATOM 1446 OG1 THR A 96 0.682 -5.550 9.398 1.00 0.24 O ATOM 1447 CG2 THR A 96 0.181 -4.311 7.402 1.00 0.28 C ATOM 0 H THR A 96 0.119 -7.658 9.397 1.00 0.26 H new ATOM 0 HA THR A 96 -1.472 -6.202 7.559 1.00 0.25 H new ATOM 0 HB THR A 96 1.505 -5.975 7.550 1.00 0.25 H new ATOM 0 HG1 THR A 96 1.046 -4.669 9.627 1.00 0.24 H new ATOM 0 HG21 THR A 96 0.951 -3.581 7.651 1.00 0.28 H new ATOM 0 HG22 THR A 96 0.095 -4.393 6.318 1.00 0.28 H new ATOM 0 HG23 THR A 96 -0.773 -3.988 7.818 1.00 0.28 H new ATOM 1455 N VAL A 97 0.894 -8.216 6.408 1.00 0.25 N ATOM 1456 CA VAL A 97 1.341 -8.923 5.239 1.00 0.31 C ATOM 1457 C VAL A 97 0.379 -10.036 4.822 1.00 0.23 C ATOM 1458 O VAL A 97 0.291 -10.346 3.640 1.00 0.24 O ATOM 1459 CB VAL A 97 2.766 -9.476 5.406 1.00 0.48 C ATOM 1460 CG1 VAL A 97 2.939 -10.225 6.710 1.00 1.02 C ATOM 1461 CG2 VAL A 97 3.097 -10.377 4.244 1.00 1.38 C ATOM 0 H VAL A 97 1.424 -8.416 7.256 1.00 0.25 H new ATOM 0 HA VAL A 97 1.358 -8.186 4.436 1.00 0.31 H new ATOM 0 HB VAL A 97 3.451 -8.629 5.427 1.00 0.48 H new ATOM 0 HG11 VAL A 97 3.961 -10.597 6.783 1.00 1.02 H new ATOM 0 HG12 VAL A 97 2.736 -9.554 7.545 1.00 1.02 H new ATOM 0 HG13 VAL A 97 2.244 -11.064 6.742 1.00 1.02 H new ATOM 0 HG21 VAL A 97 4.107 -10.768 4.363 1.00 1.38 H new ATOM 0 HG22 VAL A 97 2.389 -11.205 4.212 1.00 1.38 H new ATOM 0 HG23 VAL A 97 3.035 -9.810 3.315 1.00 1.38 H new ATOM 1471 N GLU A 98 -0.357 -10.624 5.760 1.00 0.24 N ATOM 1472 CA GLU A 98 -1.352 -11.639 5.390 1.00 0.29 C ATOM 1473 C GLU A 98 -2.352 -11.036 4.411 1.00 0.31 C ATOM 1474 O GLU A 98 -2.898 -11.726 3.548 1.00 0.37 O ATOM 1475 CB GLU A 98 -2.091 -12.165 6.623 1.00 0.39 C ATOM 1476 CG GLU A 98 -1.186 -12.795 7.668 1.00 0.92 C ATOM 1477 CD GLU A 98 -1.969 -13.403 8.815 1.00 1.64 C ATOM 1478 OE1 GLU A 98 -2.630 -12.651 9.560 1.00 2.35 O ATOM 1479 OE2 GLU A 98 -1.925 -14.640 8.980 1.00 1.97 O ATOM 0 H GLU A 98 -0.291 -10.426 6.758 1.00 0.24 H new ATOM 0 HA GLU A 98 -0.832 -12.476 4.923 1.00 0.29 H new ATOM 0 HB2 GLU A 98 -2.640 -11.343 7.082 1.00 0.39 H new ATOM 0 HB3 GLU A 98 -2.828 -12.902 6.304 1.00 0.39 H new ATOM 0 HG2 GLU A 98 -0.575 -13.566 7.199 1.00 0.92 H new ATOM 0 HG3 GLU A 98 -0.503 -12.040 8.057 1.00 0.92 H new ATOM 1486 N ALA A 99 -2.560 -9.735 4.541 1.00 0.31 N ATOM 1487 CA ALA A 99 -3.410 -8.996 3.633 1.00 0.35 C ATOM 1488 C ALA A 99 -2.736 -8.832 2.275 1.00 0.34 C ATOM 1489 O ALA A 99 -3.361 -9.024 1.230 1.00 0.44 O ATOM 1490 CB ALA A 99 -3.741 -7.642 4.228 1.00 0.39 C ATOM 0 H ALA A 99 -2.143 -9.167 5.279 1.00 0.31 H new ATOM 0 HA ALA A 99 -4.334 -9.555 3.485 1.00 0.35 H new ATOM 0 HB1 ALA A 99 -4.381 -7.089 3.541 1.00 0.39 H new ATOM 0 HB2 ALA A 99 -4.260 -7.779 5.177 1.00 0.39 H new ATOM 0 HB3 ALA A 99 -2.820 -7.083 4.395 1.00 0.39 H new ATOM 1496 N ILE A 100 -1.443 -8.516 2.299 1.00 0.28 N ATOM 1497 CA ILE A 100 -0.674 -8.335 1.085 1.00 0.29 C ATOM 1498 C ILE A 100 -0.570 -9.662 0.354 1.00 0.29 C ATOM 1499 O ILE A 100 -0.688 -9.736 -0.868 1.00 0.34 O ATOM 1500 CB ILE A 100 0.742 -7.854 1.421 1.00 0.32 C ATOM 1501 CG1 ILE A 100 0.691 -6.560 2.235 1.00 0.35 C ATOM 1502 CG2 ILE A 100 1.532 -7.668 0.140 1.00 0.36 C ATOM 1503 CD1 ILE A 100 2.015 -6.198 2.873 1.00 0.41 C ATOM 0 H ILE A 100 -0.909 -8.381 3.157 1.00 0.28 H new ATOM 0 HA ILE A 100 -1.173 -7.593 0.461 1.00 0.29 H new ATOM 0 HB ILE A 100 1.243 -8.606 2.031 1.00 0.32 H new ATOM 0 HG12 ILE A 100 0.374 -5.744 1.586 1.00 0.35 H new ATOM 0 HG13 ILE A 100 -0.064 -6.660 3.015 1.00 0.35 H new ATOM 0 HG21 ILE A 100 2.539 -7.326 0.380 1.00 0.36 H new ATOM 0 HG22 ILE A 100 1.589 -8.617 -0.394 1.00 0.36 H new ATOM 0 HG23 ILE A 100 1.037 -6.927 -0.488 1.00 0.36 H new ATOM 0 HD11 ILE A 100 1.907 -5.270 3.435 1.00 0.41 H new ATOM 0 HD12 ILE A 100 2.324 -6.996 3.548 1.00 0.41 H new ATOM 0 HD13 ILE A 100 2.769 -6.066 2.097 1.00 0.41 H new ATOM 1515 N ASN A 101 -0.347 -10.698 1.142 1.00 0.29 N ATOM 1516 CA ASN A 101 -0.243 -12.055 0.652 1.00 0.34 C ATOM 1517 C ASN A 101 -1.503 -12.460 -0.087 1.00 0.36 C ATOM 1518 O ASN A 101 -1.429 -13.099 -1.127 1.00 0.43 O ATOM 1519 CB ASN A 101 0.027 -13.006 1.822 1.00 0.44 C ATOM 1520 CG ASN A 101 1.480 -13.035 2.219 1.00 0.53 C ATOM 1521 OD1 ASN A 101 2.365 -12.696 1.430 1.00 0.67 O ATOM 1522 ND2 ASN A 101 1.740 -13.469 3.436 1.00 0.64 N ATOM 0 H ASN A 101 -0.232 -10.617 2.152 1.00 0.29 H new ATOM 0 HA ASN A 101 0.588 -12.112 -0.051 1.00 0.34 H new ATOM 0 HB2 ASN A 101 -0.574 -12.702 2.679 1.00 0.44 H new ATOM 0 HB3 ASN A 101 -0.292 -14.012 1.549 1.00 0.44 H new ATOM 0 HD21 ASN A 101 2.705 -13.535 3.759 1.00 0.64 H new ATOM 0 HD22 ASN A 101 0.976 -13.739 4.055 1.00 0.64 H new ATOM 1529 N HIS A 102 -2.652 -12.056 0.438 1.00 0.35 N ATOM 1530 CA HIS A 102 -3.926 -12.337 -0.208 1.00 0.43 C ATOM 1531 C HIS A 102 -4.013 -11.571 -1.527 1.00 0.37 C ATOM 1532 O HIS A 102 -4.470 -12.102 -2.545 1.00 0.41 O ATOM 1533 CB HIS A 102 -5.082 -11.956 0.727 1.00 0.61 C ATOM 1534 CG HIS A 102 -6.395 -12.561 0.335 1.00 1.18 C ATOM 1535 ND1 HIS A 102 -7.227 -13.215 1.218 1.00 2.07 N ATOM 1536 CD2 HIS A 102 -7.015 -12.605 -0.862 1.00 1.10 C ATOM 1537 CE1 HIS A 102 -8.298 -13.645 0.575 1.00 2.50 C ATOM 1538 NE2 HIS A 102 -8.193 -13.286 -0.690 1.00 1.91 N ATOM 0 H HIS A 102 -2.727 -11.532 1.310 1.00 0.35 H new ATOM 0 HA HIS A 102 -4.000 -13.403 -0.422 1.00 0.43 H new ATOM 0 HB2 HIS A 102 -4.836 -12.269 1.742 1.00 0.61 H new ATOM 0 HB3 HIS A 102 -5.182 -10.871 0.744 1.00 0.61 H new ATOM 0 HD2 HIS A 102 -6.651 -12.182 -1.786 1.00 1.10 H new ATOM 0 HE1 HIS A 102 -9.119 -14.196 1.010 1.00 2.50 H new ATOM 0 HE2 HIS A 102 -8.877 -13.483 -1.421 1.00 1.91 H new ATOM 1547 N ALA A 103 -3.541 -10.333 -1.509 1.00 0.37 N ATOM 1548 CA ALA A 103 -3.611 -9.469 -2.678 1.00 0.41 C ATOM 1549 C ALA A 103 -2.659 -9.929 -3.781 1.00 0.40 C ATOM 1550 O ALA A 103 -3.045 -10.002 -4.944 1.00 0.44 O ATOM 1551 CB ALA A 103 -3.305 -8.033 -2.286 1.00 0.47 C ATOM 0 H ALA A 103 -3.104 -9.903 -0.694 1.00 0.37 H new ATOM 0 HA ALA A 103 -4.625 -9.527 -3.072 1.00 0.41 H new ATOM 0 HB1 ALA A 103 -3.360 -7.395 -3.168 1.00 0.47 H new ATOM 0 HB2 ALA A 103 -4.032 -7.695 -1.548 1.00 0.47 H new ATOM 0 HB3 ALA A 103 -2.303 -7.978 -1.860 1.00 0.47 H new ATOM 1557 N LYS A 104 -1.418 -10.244 -3.419 1.00 0.41 N ATOM 1558 CA LYS A 104 -0.415 -10.666 -4.396 1.00 0.49 C ATOM 1559 C LYS A 104 -0.692 -12.069 -4.870 1.00 0.54 C ATOM 1560 O LYS A 104 -0.344 -12.441 -5.991 1.00 0.66 O ATOM 1561 CB LYS A 104 0.969 -10.588 -3.778 1.00 0.61 C ATOM 1562 CG LYS A 104 1.296 -9.190 -3.344 1.00 0.70 C ATOM 1563 CD LYS A 104 1.396 -8.265 -4.548 1.00 0.84 C ATOM 1564 CE LYS A 104 1.488 -6.803 -4.152 1.00 0.99 C ATOM 1565 NZ LYS A 104 1.569 -5.917 -5.346 1.00 1.66 N ATOM 0 H LYS A 104 -1.082 -10.215 -2.456 1.00 0.41 H new ATOM 0 HA LYS A 104 -0.463 -9.998 -5.256 1.00 0.49 H new ATOM 0 HB2 LYS A 104 1.025 -11.259 -2.921 1.00 0.61 H new ATOM 0 HB3 LYS A 104 1.711 -10.930 -4.499 1.00 0.61 H new ATOM 0 HG2 LYS A 104 0.528 -8.826 -2.662 1.00 0.70 H new ATOM 0 HG3 LYS A 104 2.238 -9.185 -2.795 1.00 0.70 H new ATOM 0 HD2 LYS A 104 2.273 -8.534 -5.137 1.00 0.84 H new ATOM 0 HD3 LYS A 104 0.525 -8.411 -5.187 1.00 0.84 H new ATOM 0 HE2 LYS A 104 0.617 -6.531 -3.555 1.00 0.99 H new ATOM 0 HE3 LYS A 104 2.366 -6.650 -3.524 1.00 0.99 H new ATOM 0 HZ1 LYS A 104 2.486 -5.426 -5.352 1.00 1.66 H new ATOM 0 HZ2 LYS A 104 1.477 -6.489 -6.210 1.00 1.66 H new ATOM 0 HZ3 LYS A 104 0.801 -5.216 -5.311 1.00 1.66 H new ATOM 1579 N ALA A 105 -1.302 -12.836 -3.991 1.00 0.51 N ATOM 1580 CA ALA A 105 -1.787 -14.172 -4.351 1.00 0.61 C ATOM 1581 C ALA A 105 -2.649 -14.112 -5.612 1.00 0.62 C ATOM 1582 O ALA A 105 -2.526 -14.955 -6.502 1.00 0.77 O ATOM 1583 CB ALA A 105 -2.581 -14.799 -3.214 1.00 0.65 C ATOM 0 H ALA A 105 -1.478 -12.568 -3.023 1.00 0.51 H new ATOM 0 HA ALA A 105 -0.914 -14.795 -4.545 1.00 0.61 H new ATOM 0 HB1 ALA A 105 -2.926 -15.789 -3.514 1.00 0.65 H new ATOM 0 HB2 ALA A 105 -1.946 -14.888 -2.332 1.00 0.65 H new ATOM 0 HB3 ALA A 105 -3.440 -14.170 -2.981 1.00 0.65 H new ATOM 1589 N ALA A 106 -3.521 -13.112 -5.676 1.00 0.54 N ATOM 1590 CA ALA A 106 -4.351 -12.897 -6.858 1.00 0.64 C ATOM 1591 C ALA A 106 -3.675 -11.944 -7.846 1.00 0.64 C ATOM 1592 O ALA A 106 -4.017 -11.913 -9.029 1.00 0.74 O ATOM 1593 CB ALA A 106 -5.720 -12.361 -6.459 1.00 0.68 C ATOM 0 H ALA A 106 -3.672 -12.438 -4.925 1.00 0.54 H new ATOM 0 HA ALA A 106 -4.481 -13.859 -7.353 1.00 0.64 H new ATOM 0 HB1 ALA A 106 -6.325 -12.207 -7.353 1.00 0.68 H new ATOM 0 HB2 ALA A 106 -6.215 -13.079 -5.805 1.00 0.68 H new ATOM 0 HB3 ALA A 106 -5.601 -11.413 -5.934 1.00 0.68 H new ATOM 1599 N ASN A 107 -2.706 -11.185 -7.330 1.00 0.59 N ATOM 1600 CA ASN A 107 -1.949 -10.195 -8.104 1.00 0.65 C ATOM 1601 C ASN A 107 -2.836 -9.010 -8.466 1.00 0.60 C ATOM 1602 O ASN A 107 -3.165 -8.790 -9.630 1.00 0.85 O ATOM 1603 CB ASN A 107 -1.332 -10.810 -9.356 1.00 0.85 C ATOM 1604 CG ASN A 107 -0.284 -9.928 -9.990 1.00 1.04 C ATOM 1605 OD1 ASN A 107 0.364 -9.125 -9.322 1.00 1.17 O ATOM 1606 ND2 ASN A 107 -0.097 -10.092 -11.283 1.00 1.41 N ATOM 0 H ASN A 107 -2.421 -11.240 -6.352 1.00 0.59 H new ATOM 0 HA ASN A 107 -1.130 -9.840 -7.478 1.00 0.65 H new ATOM 0 HB2 ASN A 107 -0.884 -11.770 -9.100 1.00 0.85 H new ATOM 0 HB3 ASN A 107 -2.120 -11.009 -10.083 1.00 0.85 H new ATOM 0 HD21 ASN A 107 0.609 -9.540 -11.770 1.00 1.41 H new ATOM 0 HD22 ASN A 107 -0.658 -10.771 -11.797 1.00 1.41 H new ATOM 1613 N VAL A 108 -3.221 -8.252 -7.452 1.00 0.44 N ATOM 1614 CA VAL A 108 -4.134 -7.133 -7.629 1.00 0.42 C ATOM 1615 C VAL A 108 -3.462 -5.809 -7.258 1.00 0.37 C ATOM 1616 O VAL A 108 -2.516 -5.780 -6.463 1.00 0.38 O ATOM 1617 CB VAL A 108 -5.411 -7.340 -6.774 1.00 0.49 C ATOM 1618 CG1 VAL A 108 -5.521 -6.299 -5.666 1.00 1.06 C ATOM 1619 CG2 VAL A 108 -6.648 -7.328 -7.654 1.00 1.35 C ATOM 0 H VAL A 108 -2.913 -8.393 -6.490 1.00 0.44 H new ATOM 0 HA VAL A 108 -4.414 -7.090 -8.682 1.00 0.42 H new ATOM 0 HB VAL A 108 -5.336 -8.316 -6.295 1.00 0.49 H new ATOM 0 HG11 VAL A 108 -6.428 -6.477 -5.089 1.00 1.06 H new ATOM 0 HG12 VAL A 108 -4.653 -6.372 -5.010 1.00 1.06 H new ATOM 0 HG13 VAL A 108 -5.560 -5.302 -6.106 1.00 1.06 H new ATOM 0 HG21 VAL A 108 -7.535 -7.475 -7.037 1.00 1.35 H new ATOM 0 HG22 VAL A 108 -6.719 -6.370 -8.169 1.00 1.35 H new ATOM 0 HG23 VAL A 108 -6.580 -8.131 -8.388 1.00 1.35 H new ATOM 1629 N PRO A 109 -3.918 -4.703 -7.875 1.00 0.35 N ATOM 1630 CA PRO A 109 -3.485 -3.353 -7.515 1.00 0.33 C ATOM 1631 C PRO A 109 -3.916 -2.957 -6.107 1.00 0.28 C ATOM 1632 O PRO A 109 -5.031 -3.264 -5.673 1.00 0.29 O ATOM 1633 CB PRO A 109 -4.185 -2.448 -8.528 1.00 0.37 C ATOM 1634 CG PRO A 109 -4.631 -3.352 -9.626 1.00 0.47 C ATOM 1635 CD PRO A 109 -4.869 -4.691 -8.994 1.00 0.40 C ATOM 0 HA PRO A 109 -2.398 -3.279 -7.530 1.00 0.33 H new ATOM 0 HB2 PRO A 109 -5.032 -1.933 -8.075 1.00 0.37 H new ATOM 0 HB3 PRO A 109 -3.508 -1.680 -8.902 1.00 0.37 H new ATOM 0 HG2 PRO A 109 -5.540 -2.976 -10.095 1.00 0.47 H new ATOM 0 HG3 PRO A 109 -3.874 -3.419 -10.407 1.00 0.47 H new ATOM 0 HD2 PRO A 109 -5.898 -4.798 -8.650 1.00 0.40 H new ATOM 0 HD3 PRO A 109 -4.680 -5.506 -9.693 1.00 0.40 H new ATOM 1643 N ILE A 110 -3.051 -2.251 -5.401 1.00 0.25 N ATOM 1644 CA ILE A 110 -3.326 -1.910 -4.020 1.00 0.21 C ATOM 1645 C ILE A 110 -3.572 -0.405 -3.861 1.00 0.19 C ATOM 1646 O ILE A 110 -3.127 0.411 -4.670 1.00 0.23 O ATOM 1647 CB ILE A 110 -2.145 -2.351 -3.121 1.00 0.23 C ATOM 1648 CG1 ILE A 110 -1.902 -3.861 -3.239 1.00 0.38 C ATOM 1649 CG2 ILE A 110 -2.362 -1.964 -1.667 1.00 0.21 C ATOM 1650 CD1 ILE A 110 -2.999 -4.709 -2.637 1.00 0.60 C ATOM 0 H ILE A 110 -2.160 -1.906 -5.759 1.00 0.25 H new ATOM 0 HA ILE A 110 -4.230 -2.436 -3.713 1.00 0.21 H new ATOM 0 HB ILE A 110 -1.259 -1.824 -3.475 1.00 0.23 H new ATOM 0 HG12 ILE A 110 -1.793 -4.120 -4.292 1.00 0.38 H new ATOM 0 HG13 ILE A 110 -0.958 -4.106 -2.751 1.00 0.38 H new ATOM 0 HG21 ILE A 110 -1.510 -2.292 -1.072 1.00 0.21 H new ATOM 0 HG22 ILE A 110 -2.463 -0.881 -1.590 1.00 0.21 H new ATOM 0 HG23 ILE A 110 -3.269 -2.440 -1.295 1.00 0.21 H new ATOM 0 HD11 ILE A 110 -2.753 -5.764 -2.761 1.00 0.60 H new ATOM 0 HD12 ILE A 110 -3.094 -4.481 -1.575 1.00 0.60 H new ATOM 0 HD13 ILE A 110 -3.942 -4.495 -3.140 1.00 0.60 H new ATOM 1662 N ILE A 111 -4.298 -0.079 -2.816 1.00 0.18 N ATOM 1663 CA ILE A 111 -4.489 1.284 -2.362 1.00 0.18 C ATOM 1664 C ILE A 111 -4.081 1.338 -0.903 1.00 0.16 C ATOM 1665 O ILE A 111 -4.875 1.106 0.004 1.00 0.18 O ATOM 1666 CB ILE A 111 -5.952 1.777 -2.536 1.00 0.25 C ATOM 1667 CG1 ILE A 111 -6.208 2.139 -3.996 1.00 0.32 C ATOM 1668 CG2 ILE A 111 -6.245 2.991 -1.654 1.00 0.27 C ATOM 1669 CD1 ILE A 111 -5.538 3.428 -4.410 1.00 0.37 C ATOM 0 H ILE A 111 -4.784 -0.769 -2.243 1.00 0.18 H new ATOM 0 HA ILE A 111 -3.877 1.949 -2.970 1.00 0.18 H new ATOM 0 HB ILE A 111 -6.613 0.966 -2.232 1.00 0.25 H new ATOM 0 HG12 ILE A 111 -5.852 1.330 -4.633 1.00 0.32 H new ATOM 0 HG13 ILE A 111 -7.282 2.225 -4.160 1.00 0.32 H new ATOM 0 HG21 ILE A 111 -7.277 3.308 -1.802 1.00 0.27 H new ATOM 0 HG22 ILE A 111 -6.094 2.726 -0.608 1.00 0.27 H new ATOM 0 HG23 ILE A 111 -5.573 3.806 -1.922 1.00 0.27 H new ATOM 0 HD11 ILE A 111 -5.757 3.632 -5.458 1.00 0.37 H new ATOM 0 HD12 ILE A 111 -5.913 4.247 -3.795 1.00 0.37 H new ATOM 0 HD13 ILE A 111 -4.460 3.337 -4.276 1.00 0.37 H new ATOM 1681 N VAL A 112 -2.811 1.561 -0.682 1.00 0.16 N ATOM 1682 CA VAL A 112 -2.301 1.641 0.658 1.00 0.18 C ATOM 1683 C VAL A 112 -2.711 2.943 1.281 1.00 0.20 C ATOM 1684 O VAL A 112 -2.852 3.958 0.611 1.00 0.22 O ATOM 1685 CB VAL A 112 -0.780 1.525 0.696 1.00 0.19 C ATOM 1686 CG1 VAL A 112 -0.269 1.529 2.106 1.00 0.26 C ATOM 1687 CG2 VAL A 112 -0.342 0.267 0.000 1.00 0.19 C ATOM 0 H VAL A 112 -2.113 1.690 -1.414 1.00 0.16 H new ATOM 0 HA VAL A 112 -2.720 0.805 1.218 1.00 0.18 H new ATOM 0 HB VAL A 112 -0.364 2.390 0.180 1.00 0.19 H new ATOM 0 HG11 VAL A 112 0.818 1.445 2.099 1.00 0.26 H new ATOM 0 HG12 VAL A 112 -0.558 2.459 2.595 1.00 0.26 H new ATOM 0 HG13 VAL A 112 -0.695 0.686 2.650 1.00 0.26 H new ATOM 0 HG21 VAL A 112 0.745 0.193 0.032 1.00 0.19 H new ATOM 0 HG22 VAL A 112 -0.780 -0.597 0.500 1.00 0.19 H new ATOM 0 HG23 VAL A 112 -0.673 0.291 -1.038 1.00 0.19 H new ATOM 1697 N ALA A 113 -2.897 2.890 2.558 1.00 0.21 N ATOM 1698 CA ALA A 113 -3.298 4.047 3.312 1.00 0.24 C ATOM 1699 C ALA A 113 -2.637 4.046 4.671 1.00 0.25 C ATOM 1700 O ALA A 113 -2.974 3.257 5.550 1.00 0.28 O ATOM 1701 CB ALA A 113 -4.805 4.105 3.417 1.00 0.29 C ATOM 0 H ALA A 113 -2.777 2.045 3.116 1.00 0.21 H new ATOM 0 HA ALA A 113 -2.969 4.946 2.791 1.00 0.24 H new ATOM 0 HB1 ALA A 113 -5.096 4.985 3.990 1.00 0.29 H new ATOM 0 HB2 ALA A 113 -5.237 4.163 2.418 1.00 0.29 H new ATOM 0 HB3 ALA A 113 -5.170 3.209 3.919 1.00 0.29 H new ATOM 1707 N ILE A 114 -1.665 4.920 4.805 1.00 0.24 N ATOM 1708 CA ILE A 114 -0.927 5.075 6.028 1.00 0.27 C ATOM 1709 C ILE A 114 -1.734 5.899 7.014 1.00 0.30 C ATOM 1710 O ILE A 114 -2.299 6.908 6.641 1.00 0.50 O ATOM 1711 CB ILE A 114 0.423 5.765 5.741 1.00 0.33 C ATOM 1712 CG1 ILE A 114 1.386 4.808 5.034 1.00 0.38 C ATOM 1713 CG2 ILE A 114 1.040 6.300 7.013 1.00 0.44 C ATOM 1714 CD1 ILE A 114 1.208 4.739 3.530 1.00 0.59 C ATOM 0 H ILE A 114 -1.365 5.547 4.058 1.00 0.24 H new ATOM 0 HA ILE A 114 -0.737 4.092 6.459 1.00 0.27 H new ATOM 0 HB ILE A 114 0.232 6.608 5.077 1.00 0.33 H new ATOM 0 HG12 ILE A 114 2.409 5.114 5.253 1.00 0.38 H new ATOM 0 HG13 ILE A 114 1.256 3.809 5.449 1.00 0.38 H new ATOM 0 HG21 ILE A 114 1.990 6.781 6.782 1.00 0.44 H new ATOM 0 HG22 ILE A 114 0.366 7.027 7.467 1.00 0.44 H new ATOM 0 HG23 ILE A 114 1.209 5.478 7.709 1.00 0.44 H new ATOM 0 HD11 ILE A 114 1.930 4.038 3.110 1.00 0.59 H new ATOM 0 HD12 ILE A 114 0.198 4.402 3.298 1.00 0.59 H new ATOM 0 HD13 ILE A 114 1.368 5.727 3.099 1.00 0.59 H new ATOM 1726 N ASN A 115 -1.790 5.470 8.259 1.00 0.19 N ATOM 1727 CA ASN A 115 -2.515 6.198 9.296 1.00 0.22 C ATOM 1728 C ASN A 115 -1.501 6.703 10.277 1.00 0.20 C ATOM 1729 O ASN A 115 -0.300 6.453 10.113 1.00 0.22 O ATOM 1730 CB ASN A 115 -3.566 5.291 9.966 1.00 0.33 C ATOM 1731 CG ASN A 115 -3.060 4.519 11.167 1.00 0.84 C ATOM 1732 OD1 ASN A 115 -1.913 4.134 11.239 1.00 1.85 O ATOM 1733 ND2 ASN A 115 -3.931 4.291 12.124 1.00 0.56 N ATOM 0 H ASN A 115 -1.340 4.614 8.585 1.00 0.19 H new ATOM 0 HA ASN A 115 -3.065 7.038 8.872 1.00 0.22 H new ATOM 0 HB2 ASN A 115 -4.412 5.905 10.275 1.00 0.33 H new ATOM 0 HB3 ASN A 115 -3.940 4.583 9.227 1.00 0.33 H new ATOM 0 HD21 ASN A 115 -3.649 3.776 12.958 1.00 0.56 H new ATOM 0 HD22 ASN A 115 -4.889 4.629 12.033 1.00 0.56 H new ATOM 1740 N LYS A 116 -1.963 7.435 11.265 1.00 0.19 N ATOM 1741 CA LYS A 116 -1.096 7.904 12.309 1.00 0.20 C ATOM 1742 C LYS A 116 -0.143 8.977 11.810 1.00 0.21 C ATOM 1743 O LYS A 116 0.989 9.076 12.278 1.00 0.26 O ATOM 1744 CB LYS A 116 -0.345 6.725 12.923 1.00 0.25 C ATOM 1745 CG LYS A 116 -1.215 5.880 13.830 1.00 0.32 C ATOM 1746 CD LYS A 116 -0.382 4.891 14.622 1.00 0.40 C ATOM 1747 CE LYS A 116 -1.223 3.836 15.321 1.00 0.51 C ATOM 1748 NZ LYS A 116 -0.370 2.880 16.085 1.00 0.59 N ATOM 0 H LYS A 116 -2.938 7.717 11.363 1.00 0.19 H new ATOM 0 HA LYS A 116 -1.706 8.369 13.083 1.00 0.20 H new ATOM 0 HB2 LYS A 116 0.054 6.099 12.125 1.00 0.25 H new ATOM 0 HB3 LYS A 116 0.507 7.099 13.491 1.00 0.25 H new ATOM 0 HG2 LYS A 116 -1.766 6.525 14.514 1.00 0.32 H new ATOM 0 HG3 LYS A 116 -1.953 5.343 13.234 1.00 0.32 H new ATOM 0 HD2 LYS A 116 0.324 4.400 13.952 1.00 0.40 H new ATOM 0 HD3 LYS A 116 0.205 5.431 15.365 1.00 0.40 H new ATOM 0 HE2 LYS A 116 -1.927 4.319 15.998 1.00 0.51 H new ATOM 0 HE3 LYS A 116 -1.813 3.291 14.584 1.00 0.51 H new ATOM 0 HZ1 LYS A 116 -0.735 1.914 15.961 1.00 0.59 H new ATOM 0 HZ2 LYS A 116 0.607 2.929 15.733 1.00 0.59 H new ATOM 0 HZ3 LYS A 116 -0.387 3.130 17.094 1.00 0.59 H new ATOM 1762 N MET A 117 -0.610 9.783 10.857 1.00 0.21 N ATOM 1763 CA MET A 117 0.084 11.018 10.511 1.00 0.28 C ATOM 1764 C MET A 117 -0.174 12.007 11.630 1.00 0.29 C ATOM 1765 O MET A 117 0.539 12.995 11.808 1.00 0.37 O ATOM 1766 CB MET A 117 -0.415 11.575 9.179 1.00 0.38 C ATOM 1767 CG MET A 117 0.091 10.813 7.963 1.00 0.48 C ATOM 1768 SD MET A 117 1.831 11.098 7.629 1.00 0.77 S ATOM 1769 CE MET A 117 2.442 9.456 7.942 1.00 0.92 C ATOM 0 H MET A 117 -1.457 9.604 10.317 1.00 0.21 H new ATOM 0 HA MET A 117 1.152 10.831 10.397 1.00 0.28 H new ATOM 0 HB2 MET A 117 -1.505 11.561 9.176 1.00 0.38 H new ATOM 0 HB3 MET A 117 -0.109 12.618 9.095 1.00 0.38 H new ATOM 0 HG2 MET A 117 -0.074 9.746 8.115 1.00 0.48 H new ATOM 0 HG3 MET A 117 -0.493 11.104 7.090 1.00 0.48 H new ATOM 0 HE1 MET A 117 3.529 9.480 8.012 1.00 0.92 H new ATOM 0 HE2 MET A 117 2.026 9.085 8.879 1.00 0.92 H new ATOM 0 HE3 MET A 117 2.145 8.796 7.127 1.00 0.92 H new ATOM 1779 N ASP A 118 -1.221 11.692 12.379 1.00 0.27 N ATOM 1780 CA ASP A 118 -1.571 12.397 13.604 1.00 0.34 C ATOM 1781 C ASP A 118 -0.461 12.256 14.636 1.00 0.33 C ATOM 1782 O ASP A 118 -0.173 13.187 15.385 1.00 0.47 O ATOM 1783 CB ASP A 118 -2.877 11.826 14.166 1.00 0.39 C ATOM 1784 CG ASP A 118 -3.005 10.337 13.923 1.00 0.55 C ATOM 1785 OD1 ASP A 118 -2.374 9.557 14.654 1.00 0.76 O ATOM 1786 OD2 ASP A 118 -3.722 9.942 12.969 1.00 0.67 O ATOM 0 H ASP A 118 -1.859 10.930 12.150 1.00 0.27 H new ATOM 0 HA ASP A 118 -1.702 13.455 13.377 1.00 0.34 H new ATOM 0 HB2 ASP A 118 -2.926 12.023 15.237 1.00 0.39 H new ATOM 0 HB3 ASP A 118 -3.722 12.340 13.709 1.00 0.39 H new ATOM 1791 N LYS A 119 0.162 11.087 14.661 1.00 0.23 N ATOM 1792 CA LYS A 119 1.253 10.819 15.578 1.00 0.26 C ATOM 1793 C LYS A 119 2.543 11.433 15.057 1.00 0.28 C ATOM 1794 O LYS A 119 2.804 11.429 13.859 1.00 0.26 O ATOM 1795 CB LYS A 119 1.445 9.311 15.757 1.00 0.29 C ATOM 1796 CG LYS A 119 0.317 8.626 16.509 1.00 0.36 C ATOM 1797 CD LYS A 119 0.727 7.237 16.976 1.00 0.72 C ATOM 1798 CE LYS A 119 1.921 7.298 17.920 1.00 0.87 C ATOM 1799 NZ LYS A 119 2.374 5.952 18.355 1.00 1.17 N ATOM 0 H LYS A 119 -0.074 10.305 14.050 1.00 0.23 H new ATOM 0 HA LYS A 119 1.004 11.264 16.541 1.00 0.26 H new ATOM 0 HB2 LYS A 119 1.545 8.849 14.775 1.00 0.29 H new ATOM 0 HB3 LYS A 119 2.380 9.135 16.288 1.00 0.29 H new ATOM 0 HG2 LYS A 119 0.030 9.231 17.369 1.00 0.36 H new ATOM 0 HG3 LYS A 119 -0.559 8.552 15.865 1.00 0.36 H new ATOM 0 HD2 LYS A 119 -0.113 6.758 17.480 1.00 0.72 H new ATOM 0 HD3 LYS A 119 0.975 6.620 16.113 1.00 0.72 H new ATOM 0 HE2 LYS A 119 2.745 7.812 17.425 1.00 0.87 H new ATOM 0 HE3 LYS A 119 1.657 7.889 18.797 1.00 0.87 H new ATOM 0 HZ1 LYS A 119 3.353 6.010 18.700 1.00 1.17 H new ATOM 0 HZ2 LYS A 119 1.757 5.608 19.119 1.00 1.17 H new ATOM 0 HZ3 LYS A 119 2.329 5.294 17.551 1.00 1.17 H new ATOM 1813 N PRO A 120 3.367 11.980 15.963 1.00 0.38 N ATOM 1814 CA PRO A 120 4.687 12.519 15.614 1.00 0.45 C ATOM 1815 C PRO A 120 5.637 11.427 15.127 1.00 0.40 C ATOM 1816 O PRO A 120 6.667 11.704 14.520 1.00 0.45 O ATOM 1817 CB PRO A 120 5.197 13.116 16.929 1.00 0.57 C ATOM 1818 CG PRO A 120 4.397 12.459 17.999 1.00 0.58 C ATOM 1819 CD PRO A 120 3.061 12.142 17.393 1.00 0.48 C ATOM 0 HA PRO A 120 4.629 13.243 14.801 1.00 0.45 H new ATOM 0 HB2 PRO A 120 6.262 12.924 17.061 1.00 0.57 H new ATOM 0 HB3 PRO A 120 5.064 14.198 16.947 1.00 0.57 H new ATOM 0 HG2 PRO A 120 4.889 11.552 18.351 1.00 0.58 H new ATOM 0 HG3 PRO A 120 4.286 13.117 18.861 1.00 0.58 H new ATOM 0 HD2 PRO A 120 2.632 11.234 17.818 1.00 0.48 H new ATOM 0 HD3 PRO A 120 2.342 12.944 17.562 1.00 0.48 H new ATOM 1827 N GLU A 121 5.267 10.181 15.401 1.00 0.35 N ATOM 1828 CA GLU A 121 6.044 9.026 14.967 1.00 0.37 C ATOM 1829 C GLU A 121 5.674 8.634 13.540 1.00 0.30 C ATOM 1830 O GLU A 121 6.039 7.561 13.063 1.00 0.37 O ATOM 1831 CB GLU A 121 5.802 7.852 15.916 1.00 0.48 C ATOM 1832 CG GLU A 121 6.086 8.192 17.366 1.00 0.62 C ATOM 1833 CD GLU A 121 5.936 7.004 18.291 1.00 1.04 C ATOM 1834 OE1 GLU A 121 6.894 6.211 18.403 1.00 1.40 O ATOM 1835 OE2 GLU A 121 4.856 6.859 18.903 1.00 1.45 O ATOM 0 H GLU A 121 4.426 9.944 15.927 1.00 0.35 H new ATOM 0 HA GLU A 121 7.101 9.290 14.986 1.00 0.37 H new ATOM 0 HB2 GLU A 121 4.767 7.524 15.822 1.00 0.48 H new ATOM 0 HB3 GLU A 121 6.431 7.014 15.616 1.00 0.48 H new ATOM 0 HG2 GLU A 121 7.099 8.585 17.450 1.00 0.62 H new ATOM 0 HG3 GLU A 121 5.409 8.984 17.687 1.00 0.62 H new ATOM 1842 N ALA A 122 4.925 9.510 12.882 1.00 0.24 N ATOM 1843 CA ALA A 122 4.540 9.326 11.489 1.00 0.22 C ATOM 1844 C ALA A 122 5.761 9.271 10.585 1.00 0.21 C ATOM 1845 O ALA A 122 6.346 10.300 10.242 1.00 0.26 O ATOM 1846 CB ALA A 122 3.614 10.451 11.058 1.00 0.27 C ATOM 0 H ALA A 122 4.567 10.369 13.300 1.00 0.24 H new ATOM 0 HA ALA A 122 4.015 8.375 11.400 1.00 0.22 H new ATOM 0 HB1 ALA A 122 3.329 10.309 10.016 1.00 0.27 H new ATOM 0 HB2 ALA A 122 2.720 10.446 11.682 1.00 0.27 H new ATOM 0 HB3 ALA A 122 4.127 11.406 11.167 1.00 0.27 H new ATOM 1852 N ASN A 123 6.142 8.063 10.202 1.00 0.21 N ATOM 1853 CA ASN A 123 7.239 7.865 9.273 1.00 0.23 C ATOM 1854 C ASN A 123 6.716 7.129 8.054 1.00 0.23 C ATOM 1855 O ASN A 123 6.936 5.930 7.882 1.00 0.25 O ATOM 1856 CB ASN A 123 8.376 7.078 9.917 1.00 0.26 C ATOM 1857 CG ASN A 123 9.684 7.796 9.852 1.00 0.42 C ATOM 1858 OD1 ASN A 123 10.449 7.506 8.837 1.00 0.95 O flip ATOM 1859 ND2 ASN A 123 10.014 8.606 10.720 1.00 0.52 N flip ATOM 0 H ASN A 123 5.703 7.200 10.524 1.00 0.21 H new ATOM 0 HA ASN A 123 7.638 8.837 8.982 1.00 0.23 H new ATOM 0 HB2 ASN A 123 8.128 6.877 10.959 1.00 0.26 H new ATOM 0 HB3 ASN A 123 8.471 6.113 9.420 1.00 0.26 H new ATOM 0 HD21 ASN A 123 9.385 8.804 11.498 1.00 0.52 H new ATOM 0 HD22 ASN A 123 10.916 9.078 10.660 1.00 0.52 H new ATOM 1866 N PRO A 124 6.023 7.859 7.184 1.00 0.25 N ATOM 1867 CA PRO A 124 5.269 7.281 6.068 1.00 0.32 C ATOM 1868 C PRO A 124 6.144 6.665 5.006 1.00 0.33 C ATOM 1869 O PRO A 124 5.991 5.498 4.660 1.00 0.35 O ATOM 1870 CB PRO A 124 4.527 8.476 5.507 1.00 0.40 C ATOM 1871 CG PRO A 124 5.348 9.658 5.879 1.00 0.32 C ATOM 1872 CD PRO A 124 5.915 9.329 7.225 1.00 0.27 C ATOM 0 HA PRO A 124 4.630 6.462 6.399 1.00 0.32 H new ATOM 0 HB2 PRO A 124 4.417 8.398 4.425 1.00 0.40 H new ATOM 0 HB3 PRO A 124 3.523 8.547 5.925 1.00 0.40 H new ATOM 0 HG2 PRO A 124 6.139 9.834 5.150 1.00 0.32 H new ATOM 0 HG3 PRO A 124 4.742 10.563 5.917 1.00 0.32 H new ATOM 0 HD2 PRO A 124 6.885 9.802 7.382 1.00 0.27 H new ATOM 0 HD3 PRO A 124 5.263 9.664 8.031 1.00 0.27 H new ATOM 1880 N ASP A 125 7.047 7.465 4.485 1.00 0.37 N ATOM 1881 CA ASP A 125 8.006 7.007 3.495 1.00 0.44 C ATOM 1882 C ASP A 125 8.792 5.817 4.019 1.00 0.34 C ATOM 1883 O ASP A 125 9.268 4.989 3.248 1.00 0.33 O ATOM 1884 CB ASP A 125 8.948 8.140 3.116 1.00 0.61 C ATOM 1885 CG ASP A 125 8.230 9.257 2.385 1.00 0.99 C ATOM 1886 OD1 ASP A 125 7.403 9.952 3.011 1.00 1.44 O ATOM 1887 OD2 ASP A 125 8.489 9.447 1.175 1.00 1.13 O ATOM 0 H ASP A 125 7.140 8.450 4.732 1.00 0.37 H new ATOM 0 HA ASP A 125 7.461 6.690 2.606 1.00 0.44 H new ATOM 0 HB2 ASP A 125 9.416 8.538 4.016 1.00 0.61 H new ATOM 0 HB3 ASP A 125 9.748 7.751 2.486 1.00 0.61 H new ATOM 1892 N ARG A 126 8.882 5.708 5.336 1.00 0.31 N ATOM 1893 CA ARG A 126 9.587 4.583 5.942 1.00 0.31 C ATOM 1894 C ARG A 126 8.742 3.334 5.816 1.00 0.27 C ATOM 1895 O ARG A 126 9.158 2.339 5.228 1.00 0.30 O ATOM 1896 CB ARG A 126 9.894 4.859 7.415 1.00 0.35 C ATOM 1897 CG ARG A 126 10.288 3.623 8.223 1.00 0.51 C ATOM 1898 CD ARG A 126 11.534 2.941 7.674 1.00 1.24 C ATOM 1899 NE ARG A 126 12.727 3.776 7.803 1.00 1.92 N ATOM 1900 CZ ARG A 126 13.761 3.724 6.967 1.00 2.94 C ATOM 1901 NH1 ARG A 126 13.751 2.875 5.946 1.00 3.49 N ATOM 1902 NH2 ARG A 126 14.809 4.512 7.164 1.00 3.79 N ATOM 0 H ARG A 126 8.483 6.373 5.999 1.00 0.31 H new ATOM 0 HA ARG A 126 10.533 4.441 5.419 1.00 0.31 H new ATOM 0 HB2 ARG A 126 10.702 5.589 7.474 1.00 0.35 H new ATOM 0 HB3 ARG A 126 9.018 5.315 7.876 1.00 0.35 H new ATOM 0 HG2 ARG A 126 10.462 3.911 9.260 1.00 0.51 H new ATOM 0 HG3 ARG A 126 9.460 2.914 8.224 1.00 0.51 H new ATOM 0 HD2 ARG A 126 11.693 2.001 8.202 1.00 1.24 H new ATOM 0 HD3 ARG A 126 11.378 2.695 6.624 1.00 1.24 H new ATOM 0 HE ARG A 126 12.769 4.437 8.579 1.00 1.92 H new ATOM 0 HH11 ARG A 126 12.950 2.261 5.801 1.00 3.49 H new ATOM 0 HH12 ARG A 126 14.545 2.837 5.307 1.00 3.49 H new ATOM 0 HH21 ARG A 126 14.821 5.156 7.955 1.00 3.79 H new ATOM 0 HH22 ARG A 126 15.603 4.474 6.525 1.00 3.79 H new ATOM 1916 N VAL A 127 7.543 3.417 6.353 1.00 0.25 N ATOM 1917 CA VAL A 127 6.637 2.285 6.358 1.00 0.28 C ATOM 1918 C VAL A 127 6.225 1.884 4.939 1.00 0.28 C ATOM 1919 O VAL A 127 6.052 0.701 4.661 1.00 0.33 O ATOM 1920 CB VAL A 127 5.407 2.550 7.259 1.00 0.36 C ATOM 1921 CG1 VAL A 127 5.877 2.847 8.669 1.00 0.59 C ATOM 1922 CG2 VAL A 127 4.527 3.685 6.746 1.00 0.44 C ATOM 0 H VAL A 127 7.171 4.259 6.793 1.00 0.25 H new ATOM 0 HA VAL A 127 7.175 1.439 6.785 1.00 0.28 H new ATOM 0 HB VAL A 127 4.790 1.651 7.245 1.00 0.36 H new ATOM 0 HG11 VAL A 127 5.014 3.035 9.308 1.00 0.59 H new ATOM 0 HG12 VAL A 127 6.435 1.993 9.054 1.00 0.59 H new ATOM 0 HG13 VAL A 127 6.520 3.727 8.660 1.00 0.59 H new ATOM 0 HG21 VAL A 127 3.681 3.823 7.420 1.00 0.44 H new ATOM 0 HG22 VAL A 127 5.109 4.605 6.702 1.00 0.44 H new ATOM 0 HG23 VAL A 127 4.160 3.439 5.749 1.00 0.44 H new ATOM 1932 N MET A 128 6.130 2.858 4.029 1.00 0.27 N ATOM 1933 CA MET A 128 5.769 2.572 2.635 1.00 0.31 C ATOM 1934 C MET A 128 6.962 1.972 1.887 1.00 0.26 C ATOM 1935 O MET A 128 6.807 1.390 0.814 1.00 0.35 O ATOM 1936 CB MET A 128 5.249 3.838 1.919 1.00 0.52 C ATOM 1937 CG MET A 128 6.336 4.785 1.431 1.00 0.81 C ATOM 1938 SD MET A 128 5.713 6.418 0.947 1.00 0.67 S ATOM 1939 CE MET A 128 4.621 6.043 -0.434 1.00 0.46 C ATOM 0 H MET A 128 6.296 3.844 4.229 1.00 0.27 H new ATOM 0 HA MET A 128 4.960 1.841 2.638 1.00 0.31 H new ATOM 0 HB2 MET A 128 4.642 3.533 1.066 1.00 0.52 H new ATOM 0 HB3 MET A 128 4.593 4.380 2.600 1.00 0.52 H new ATOM 0 HG2 MET A 128 7.080 4.908 2.219 1.00 0.81 H new ATOM 0 HG3 MET A 128 6.845 4.333 0.580 1.00 0.81 H new ATOM 0 HE1 MET A 128 3.881 6.836 -0.539 1.00 0.46 H new ATOM 0 HE2 MET A 128 5.206 5.969 -1.351 1.00 0.46 H new ATOM 0 HE3 MET A 128 4.114 5.096 -0.250 1.00 0.46 H new ATOM 1949 N GLN A 129 8.157 2.103 2.456 1.00 0.24 N ATOM 1950 CA GLN A 129 9.327 1.417 1.922 1.00 0.27 C ATOM 1951 C GLN A 129 9.312 -0.044 2.345 1.00 0.30 C ATOM 1952 O GLN A 129 9.728 -0.920 1.597 1.00 0.33 O ATOM 1953 CB GLN A 129 10.620 2.094 2.367 1.00 0.32 C ATOM 1954 CG GLN A 129 11.095 3.172 1.411 1.00 0.42 C ATOM 1955 CD GLN A 129 12.133 4.086 2.027 1.00 0.54 C ATOM 1956 OE1 GLN A 129 12.912 3.676 2.888 1.00 1.17 O ATOM 1957 NE2 GLN A 129 12.153 5.335 1.593 1.00 1.31 N ATOM 0 H GLN A 129 8.339 2.674 3.281 1.00 0.24 H new ATOM 0 HA GLN A 129 9.286 1.471 0.834 1.00 0.27 H new ATOM 0 HB2 GLN A 129 10.471 2.533 3.353 1.00 0.32 H new ATOM 0 HB3 GLN A 129 11.400 1.340 2.469 1.00 0.32 H new ATOM 0 HG2 GLN A 129 11.513 2.703 0.520 1.00 0.42 H new ATOM 0 HG3 GLN A 129 10.241 3.766 1.087 1.00 0.42 H new ATOM 0 HE21 GLN A 129 11.491 5.637 0.878 1.00 1.31 H new ATOM 0 HE22 GLN A 129 12.830 5.996 1.973 1.00 1.31 H new ATOM 1966 N GLU A 130 8.801 -0.306 3.542 1.00 0.37 N ATOM 1967 CA GLU A 130 8.615 -1.677 4.000 1.00 0.43 C ATOM 1968 C GLU A 130 7.513 -2.322 3.184 1.00 0.36 C ATOM 1969 O GLU A 130 7.484 -3.540 2.984 1.00 0.35 O ATOM 1970 CB GLU A 130 8.250 -1.711 5.477 1.00 0.61 C ATOM 1971 CG GLU A 130 8.980 -0.671 6.290 1.00 0.63 C ATOM 1972 CD GLU A 130 8.755 -0.834 7.772 1.00 1.04 C ATOM 1973 OE1 GLU A 130 9.445 -1.672 8.388 1.00 1.64 O ATOM 1974 OE2 GLU A 130 7.878 -0.150 8.330 1.00 1.63 O ATOM 0 H GLU A 130 8.510 0.408 4.209 1.00 0.37 H new ATOM 0 HA GLU A 130 9.548 -2.225 3.869 1.00 0.43 H new ATOM 0 HB2 GLU A 130 7.176 -1.559 5.583 1.00 0.61 H new ATOM 0 HB3 GLU A 130 8.473 -2.700 5.878 1.00 0.61 H new ATOM 0 HG2 GLU A 130 10.048 -0.733 6.079 1.00 0.63 H new ATOM 0 HG3 GLU A 130 8.652 0.322 5.983 1.00 0.63 H new ATOM 1981 N LEU A 131 6.619 -1.474 2.703 1.00 0.36 N ATOM 1982 CA LEU A 131 5.572 -1.901 1.805 1.00 0.37 C ATOM 1983 C LEU A 131 6.195 -2.504 0.561 1.00 0.29 C ATOM 1984 O LEU A 131 5.815 -3.591 0.133 1.00 0.32 O ATOM 1985 CB LEU A 131 4.651 -0.731 1.413 1.00 0.49 C ATOM 1986 CG LEU A 131 3.350 -0.581 2.220 1.00 0.71 C ATOM 1987 CD1 LEU A 131 2.960 -1.889 2.844 1.00 1.36 C ATOM 1988 CD2 LEU A 131 3.465 0.485 3.289 1.00 1.18 C ATOM 0 H LEU A 131 6.602 -0.479 2.925 1.00 0.36 H new ATOM 0 HA LEU A 131 4.963 -2.646 2.318 1.00 0.37 H new ATOM 0 HB2 LEU A 131 5.218 0.195 1.505 1.00 0.49 H new ATOM 0 HB3 LEU A 131 4.389 -0.841 0.361 1.00 0.49 H new ATOM 0 HG LEU A 131 2.574 -0.270 1.520 1.00 0.71 H new ATOM 0 HD11 LEU A 131 2.037 -1.761 3.410 1.00 1.36 H new ATOM 0 HD12 LEU A 131 2.806 -2.633 2.063 1.00 1.36 H new ATOM 0 HD13 LEU A 131 3.753 -2.224 3.513 1.00 1.36 H new ATOM 0 HD21 LEU A 131 2.524 0.557 3.834 1.00 1.18 H new ATOM 0 HD22 LEU A 131 4.266 0.222 3.980 1.00 1.18 H new ATOM 0 HD23 LEU A 131 3.689 1.445 2.823 1.00 1.18 H new ATOM 2000 N MET A 132 7.192 -1.821 0.004 1.00 0.25 N ATOM 2001 CA MET A 132 7.808 -2.290 -1.226 1.00 0.26 C ATOM 2002 C MET A 132 8.719 -3.478 -0.964 1.00 0.30 C ATOM 2003 O MET A 132 9.113 -4.179 -1.896 1.00 0.37 O ATOM 2004 CB MET A 132 8.584 -1.189 -1.951 1.00 0.32 C ATOM 2005 CG MET A 132 9.946 -0.880 -1.348 1.00 0.88 C ATOM 2006 SD MET A 132 10.835 0.411 -2.242 1.00 1.60 S ATOM 2007 CE MET A 132 10.762 -0.216 -3.918 1.00 1.61 C ATOM 0 H MET A 132 7.582 -0.957 0.379 1.00 0.25 H new ATOM 0 HA MET A 132 6.992 -2.602 -1.877 1.00 0.26 H new ATOM 0 HB2 MET A 132 8.719 -1.482 -2.992 1.00 0.32 H new ATOM 0 HB3 MET A 132 7.985 -0.278 -1.951 1.00 0.32 H new ATOM 0 HG2 MET A 132 9.817 -0.573 -0.310 1.00 0.88 H new ATOM 0 HG3 MET A 132 10.548 -1.789 -1.339 1.00 0.88 H new ATOM 0 HE1 MET A 132 11.530 0.268 -4.521 1.00 1.61 H new ATOM 0 HE2 MET A 132 10.931 -1.293 -3.911 1.00 1.61 H new ATOM 0 HE3 MET A 132 9.781 -0.005 -4.343 1.00 1.61 H new ATOM 2017 N GLU A 133 9.036 -3.717 0.302 1.00 0.32 N ATOM 2018 CA GLU A 133 9.821 -4.878 0.674 1.00 0.40 C ATOM 2019 C GLU A 133 8.958 -6.108 0.481 1.00 0.38 C ATOM 2020 O GLU A 133 9.443 -7.204 0.199 1.00 0.45 O ATOM 2021 CB GLU A 133 10.266 -4.776 2.128 1.00 0.54 C ATOM 2022 CG GLU A 133 11.140 -3.571 2.418 1.00 0.79 C ATOM 2023 CD GLU A 133 12.488 -3.643 1.735 1.00 1.07 C ATOM 2024 OE1 GLU A 133 13.259 -4.581 2.030 1.00 1.53 O ATOM 2025 OE2 GLU A 133 12.780 -2.768 0.893 1.00 1.67 O ATOM 0 H GLU A 133 8.761 -3.122 1.084 1.00 0.32 H new ATOM 0 HA GLU A 133 10.714 -4.939 0.052 1.00 0.40 H new ATOM 0 HB2 GLU A 133 9.383 -4.735 2.766 1.00 0.54 H new ATOM 0 HB3 GLU A 133 10.811 -5.681 2.396 1.00 0.54 H new ATOM 0 HG2 GLU A 133 10.623 -2.667 2.095 1.00 0.79 H new ATOM 0 HG3 GLU A 133 11.288 -3.487 3.495 1.00 0.79 H new ATOM 2032 N TYR A 134 7.660 -5.897 0.635 1.00 0.35 N ATOM 2033 CA TYR A 134 6.672 -6.925 0.398 1.00 0.40 C ATOM 2034 C TYR A 134 6.074 -6.728 -0.993 1.00 0.41 C ATOM 2035 O TYR A 134 4.961 -7.163 -1.293 1.00 0.50 O ATOM 2036 CB TYR A 134 5.619 -6.881 1.498 1.00 0.46 C ATOM 2037 CG TYR A 134 6.151 -7.329 2.853 1.00 0.55 C ATOM 2038 CD1 TYR A 134 7.408 -6.931 3.286 1.00 0.88 C ATOM 2039 CD2 TYR A 134 5.411 -8.150 3.689 1.00 0.98 C ATOM 2040 CE1 TYR A 134 7.914 -7.335 4.501 1.00 0.95 C ATOM 2041 CE2 TYR A 134 5.909 -8.557 4.914 1.00 1.08 C ATOM 2042 CZ TYR A 134 7.161 -8.149 5.313 1.00 0.80 C ATOM 2043 OH TYR A 134 7.657 -8.559 6.529 1.00 0.95 O ATOM 0 H TYR A 134 7.266 -5.003 0.929 1.00 0.35 H new ATOM 0 HA TYR A 134 7.127 -7.915 0.426 1.00 0.40 H new ATOM 0 HB2 TYR A 134 5.234 -5.865 1.584 1.00 0.46 H new ATOM 0 HB3 TYR A 134 4.780 -7.517 1.215 1.00 0.46 H new ATOM 0 HD1 TYR A 134 8.004 -6.289 2.654 1.00 0.88 H new ATOM 0 HD2 TYR A 134 4.430 -8.477 3.379 1.00 0.98 H new ATOM 0 HE1 TYR A 134 8.897 -7.014 4.814 1.00 0.95 H new ATOM 0 HE2 TYR A 134 5.317 -9.193 5.555 1.00 1.08 H new ATOM 0 HH TYR A 134 6.997 -9.128 6.976 1.00 0.95 H new ATOM 2053 N ASN A 135 6.867 -6.047 -1.825 1.00 0.36 N ATOM 2054 CA ASN A 135 6.564 -5.763 -3.225 1.00 0.43 C ATOM 2055 C ASN A 135 5.289 -4.942 -3.385 1.00 0.48 C ATOM 2056 O ASN A 135 4.396 -5.269 -4.170 1.00 0.64 O ATOM 2057 CB ASN A 135 6.497 -7.059 -4.035 1.00 0.58 C ATOM 2058 CG ASN A 135 6.437 -6.820 -5.521 1.00 0.71 C ATOM 2059 OD1 ASN A 135 6.894 -5.792 -6.022 1.00 0.89 O ATOM 2060 ND2 ASN A 135 5.894 -7.776 -6.239 1.00 1.10 N ATOM 0 H ASN A 135 7.766 -5.667 -1.530 1.00 0.36 H new ATOM 0 HA ASN A 135 7.378 -5.154 -3.618 1.00 0.43 H new ATOM 0 HB2 ASN A 135 7.370 -7.670 -3.806 1.00 0.58 H new ATOM 0 HB3 ASN A 135 5.620 -7.628 -3.728 1.00 0.58 H new ATOM 0 HD21 ASN A 135 5.839 -7.683 -7.253 1.00 1.10 H new ATOM 0 HD22 ASN A 135 5.528 -8.611 -5.782 1.00 1.10 H new ATOM 2067 N LEU A 136 5.209 -3.872 -2.623 1.00 0.44 N ATOM 2068 CA LEU A 136 4.166 -2.891 -2.778 1.00 0.54 C ATOM 2069 C LEU A 136 4.775 -1.562 -3.144 1.00 0.41 C ATOM 2070 O LEU A 136 5.261 -0.829 -2.285 1.00 0.47 O ATOM 2071 CB LEU A 136 3.384 -2.776 -1.497 1.00 0.78 C ATOM 2072 CG LEU A 136 2.552 -3.997 -1.155 1.00 0.64 C ATOM 2073 CD1 LEU A 136 2.154 -3.955 0.303 1.00 1.36 C ATOM 2074 CD2 LEU A 136 1.337 -4.051 -2.058 1.00 1.17 C ATOM 0 H LEU A 136 5.871 -3.661 -1.876 1.00 0.44 H new ATOM 0 HA LEU A 136 3.489 -3.199 -3.574 1.00 0.54 H new ATOM 0 HB2 LEU A 136 4.078 -2.584 -0.679 1.00 0.78 H new ATOM 0 HB3 LEU A 136 2.725 -1.911 -1.565 1.00 0.78 H new ATOM 0 HG LEU A 136 3.138 -4.902 -1.317 1.00 0.64 H new ATOM 0 HD11 LEU A 136 1.557 -4.835 0.543 1.00 1.36 H new ATOM 0 HD12 LEU A 136 3.049 -3.944 0.924 1.00 1.36 H new ATOM 0 HD13 LEU A 136 1.569 -3.056 0.495 1.00 1.36 H new ATOM 0 HD21 LEU A 136 0.739 -4.929 -1.812 1.00 1.17 H new ATOM 0 HD22 LEU A 136 0.737 -3.152 -1.915 1.00 1.17 H new ATOM 0 HD23 LEU A 136 1.659 -4.111 -3.098 1.00 1.17 H new ATOM 2086 N VAL A 137 4.759 -1.252 -4.420 1.00 0.31 N ATOM 2087 CA VAL A 137 5.455 -0.073 -4.889 1.00 0.27 C ATOM 2088 C VAL A 137 4.492 1.049 -5.208 1.00 0.29 C ATOM 2089 O VAL A 137 3.662 0.944 -6.113 1.00 0.33 O ATOM 2090 CB VAL A 137 6.324 -0.353 -6.117 1.00 0.29 C ATOM 2091 CG1 VAL A 137 7.147 0.885 -6.455 1.00 0.43 C ATOM 2092 CG2 VAL A 137 7.212 -1.563 -5.878 1.00 0.41 C ATOM 0 H VAL A 137 4.280 -1.789 -5.143 1.00 0.31 H new ATOM 0 HA VAL A 137 6.108 0.231 -4.071 1.00 0.27 H new ATOM 0 HB VAL A 137 5.683 -0.582 -6.968 1.00 0.29 H new ATOM 0 HG11 VAL A 137 7.765 0.683 -7.330 1.00 0.43 H new ATOM 0 HG12 VAL A 137 6.479 1.719 -6.668 1.00 0.43 H new ATOM 0 HG13 VAL A 137 7.787 1.139 -5.610 1.00 0.43 H new ATOM 0 HG21 VAL A 137 7.823 -1.747 -6.762 1.00 0.41 H new ATOM 0 HG22 VAL A 137 7.860 -1.375 -5.022 1.00 0.41 H new ATOM 0 HG23 VAL A 137 6.591 -2.436 -5.678 1.00 0.41 H new ATOM 2102 N PRO A 138 4.586 2.114 -4.417 1.00 0.34 N ATOM 2103 CA PRO A 138 3.863 3.354 -4.623 1.00 0.43 C ATOM 2104 C PRO A 138 3.903 3.824 -6.060 1.00 0.43 C ATOM 2105 O PRO A 138 4.916 3.708 -6.751 1.00 0.45 O ATOM 2106 CB PRO A 138 4.619 4.342 -3.748 1.00 0.53 C ATOM 2107 CG PRO A 138 5.200 3.533 -2.654 1.00 0.54 C ATOM 2108 CD PRO A 138 5.393 2.151 -3.199 1.00 0.39 C ATOM 0 HA PRO A 138 2.806 3.245 -4.382 1.00 0.43 H new ATOM 0 HB2 PRO A 138 5.397 4.853 -4.315 1.00 0.53 H new ATOM 0 HB3 PRO A 138 3.952 5.111 -3.357 1.00 0.53 H new ATOM 0 HG2 PRO A 138 6.149 3.955 -2.322 1.00 0.54 H new ATOM 0 HG3 PRO A 138 4.537 3.519 -1.789 1.00 0.54 H new ATOM 0 HD2 PRO A 138 6.443 1.954 -3.414 1.00 0.39 H new ATOM 0 HD3 PRO A 138 5.066 1.395 -2.485 1.00 0.39 H new ATOM 2116 N GLU A 139 2.790 4.357 -6.490 1.00 0.48 N ATOM 2117 CA GLU A 139 2.686 4.977 -7.804 1.00 0.56 C ATOM 2118 C GLU A 139 3.443 6.294 -7.834 1.00 0.56 C ATOM 2119 O GLU A 139 3.701 6.854 -8.900 1.00 0.64 O ATOM 2120 CB GLU A 139 1.230 5.189 -8.204 1.00 0.71 C ATOM 2121 CG GLU A 139 0.654 4.025 -8.989 1.00 1.35 C ATOM 2122 CD GLU A 139 1.418 3.781 -10.275 1.00 2.40 C ATOM 2123 OE1 GLU A 139 1.048 4.367 -11.307 1.00 2.78 O ATOM 2124 OE2 GLU A 139 2.375 2.977 -10.259 1.00 3.08 O ATOM 0 H GLU A 139 1.926 4.379 -5.948 1.00 0.48 H new ATOM 0 HA GLU A 139 3.136 4.299 -8.529 1.00 0.56 H new ATOM 0 HB2 GLU A 139 0.632 5.346 -7.306 1.00 0.71 H new ATOM 0 HB3 GLU A 139 1.152 6.097 -8.802 1.00 0.71 H new ATOM 0 HG2 GLU A 139 0.679 3.125 -8.375 1.00 1.35 H new ATOM 0 HG3 GLU A 139 -0.392 4.225 -9.220 1.00 1.35 H new ATOM 2131 N GLU A 140 3.786 6.796 -6.651 1.00 0.54 N ATOM 2132 CA GLU A 140 4.728 7.897 -6.538 1.00 0.60 C ATOM 2133 C GLU A 140 6.121 7.428 -6.947 1.00 0.56 C ATOM 2134 O GLU A 140 6.983 8.238 -7.283 1.00 0.65 O ATOM 2135 CB GLU A 140 4.766 8.483 -5.112 1.00 0.67 C ATOM 2136 CG GLU A 140 4.478 7.488 -4.011 1.00 0.63 C ATOM 2137 CD GLU A 140 2.996 7.354 -3.727 1.00 1.12 C ATOM 2138 OE1 GLU A 140 2.469 8.164 -2.936 1.00 1.27 O ATOM 2139 OE2 GLU A 140 2.360 6.444 -4.298 1.00 1.57 O ATOM 0 H GLU A 140 3.424 6.456 -5.760 1.00 0.54 H new ATOM 0 HA GLU A 140 4.393 8.689 -7.208 1.00 0.60 H new ATOM 0 HB2 GLU A 140 5.750 8.920 -4.940 1.00 0.67 H new ATOM 0 HB3 GLU A 140 4.041 9.295 -5.048 1.00 0.67 H new ATOM 0 HG2 GLU A 140 4.881 6.515 -4.290 1.00 0.63 H new ATOM 0 HG3 GLU A 140 4.993 7.797 -3.102 1.00 0.63 H new ATOM 2146 N TRP A 141 6.341 6.111 -6.922 1.00 0.47 N ATOM 2147 CA TRP A 141 7.629 5.547 -7.253 1.00 0.49 C ATOM 2148 C TRP A 141 7.581 4.851 -8.610 1.00 0.51 C ATOM 2149 O TRP A 141 8.577 4.796 -9.329 1.00 0.66 O ATOM 2150 CB TRP A 141 8.062 4.585 -6.168 1.00 0.45 C ATOM 2151 CG TRP A 141 8.178 5.213 -4.804 1.00 0.46 C ATOM 2152 CD1 TRP A 141 8.059 6.536 -4.479 1.00 0.54 C ATOM 2153 CD2 TRP A 141 8.433 4.529 -3.581 1.00 0.44 C ATOM 2154 NE1 TRP A 141 8.224 6.709 -3.126 1.00 0.55 N ATOM 2155 CE2 TRP A 141 8.453 5.491 -2.553 1.00 0.49 C ATOM 2156 CE3 TRP A 141 8.641 3.195 -3.257 1.00 0.45 C ATOM 2157 CZ2 TRP A 141 8.679 5.153 -1.223 1.00 0.52 C ATOM 2158 CZ3 TRP A 141 8.862 2.860 -1.937 1.00 0.50 C ATOM 2159 CH2 TRP A 141 8.876 3.831 -0.936 1.00 0.52 C ATOM 0 H TRP A 141 5.632 5.421 -6.673 1.00 0.47 H new ATOM 0 HA TRP A 141 8.361 6.352 -7.318 1.00 0.49 H new ATOM 0 HB2 TRP A 141 7.348 3.763 -6.119 1.00 0.45 H new ATOM 0 HB3 TRP A 141 9.025 4.154 -6.442 1.00 0.45 H new ATOM 0 HD1 TRP A 141 7.864 7.330 -5.184 1.00 0.54 H new ATOM 0 HE1 TRP A 141 8.182 7.600 -2.631 1.00 0.55 H new ATOM 0 HE3 TRP A 141 8.630 2.434 -4.024 1.00 0.45 H new ATOM 0 HZ2 TRP A 141 8.698 5.905 -0.448 1.00 0.52 H new ATOM 0 HZ3 TRP A 141 9.027 1.826 -1.674 1.00 0.50 H new ATOM 0 HH2 TRP A 141 9.046 3.532 0.088 1.00 0.52 H new ATOM 2170 N GLY A 142 6.414 4.322 -8.955 1.00 0.45 N ATOM 2171 CA GLY A 142 6.227 3.729 -10.265 1.00 0.50 C ATOM 2172 C GLY A 142 5.970 2.239 -10.215 1.00 0.45 C ATOM 2173 O GLY A 142 6.266 1.523 -11.170 1.00 0.53 O ATOM 0 H GLY A 142 5.593 4.293 -8.350 1.00 0.45 H new ATOM 0 HA2 GLY A 142 5.390 4.219 -10.762 1.00 0.50 H new ATOM 0 HA3 GLY A 142 7.113 3.918 -10.872 1.00 0.50 H new ATOM 2177 N GLY A 143 5.438 1.764 -9.100 1.00 0.39 N ATOM 2178 CA GLY A 143 5.109 0.350 -8.992 1.00 0.41 C ATOM 2179 C GLY A 143 3.710 0.037 -9.478 1.00 0.45 C ATOM 2180 O GLY A 143 3.453 0.035 -10.684 1.00 0.60 O ATOM 0 H GLY A 143 5.228 2.322 -8.273 1.00 0.39 H new ATOM 0 HA2 GLY A 143 5.828 -0.231 -9.569 1.00 0.41 H new ATOM 0 HA3 GLY A 143 5.207 0.037 -7.953 1.00 0.41 H new ATOM 2184 N ASP A 144 2.807 -0.254 -8.544 1.00 0.40 N ATOM 2185 CA ASP A 144 1.401 -0.453 -8.878 1.00 0.45 C ATOM 2186 C ASP A 144 0.534 -0.406 -7.618 1.00 0.33 C ATOM 2187 O ASP A 144 -0.177 -1.362 -7.258 1.00 0.35 O ATOM 2188 CB ASP A 144 1.200 -1.777 -9.609 1.00 0.64 C ATOM 2189 CG ASP A 144 -0.203 -1.940 -10.168 1.00 1.33 C ATOM 2190 OD1 ASP A 144 -0.594 -1.146 -11.054 1.00 1.91 O ATOM 2191 OD2 ASP A 144 -0.923 -2.852 -9.715 1.00 1.91 O ATOM 0 H ASP A 144 3.024 -0.357 -7.553 1.00 0.40 H new ATOM 0 HA ASP A 144 1.094 0.357 -9.540 1.00 0.45 H new ATOM 0 HB2 ASP A 144 1.920 -1.849 -10.424 1.00 0.64 H new ATOM 0 HB3 ASP A 144 1.410 -2.599 -8.925 1.00 0.64 H new ATOM 2196 N THR A 145 0.581 0.738 -6.958 1.00 0.26 N ATOM 2197 CA THR A 145 -0.175 0.958 -5.741 1.00 0.24 C ATOM 2198 C THR A 145 -0.241 2.443 -5.414 1.00 0.27 C ATOM 2199 O THR A 145 0.790 3.092 -5.257 1.00 0.37 O ATOM 2200 CB THR A 145 0.458 0.226 -4.536 1.00 0.25 C ATOM 2201 OG1 THR A 145 0.535 -1.186 -4.770 1.00 0.30 O ATOM 2202 CG2 THR A 145 -0.348 0.493 -3.280 1.00 0.30 C ATOM 0 H THR A 145 1.143 1.537 -7.251 1.00 0.26 H new ATOM 0 HA THR A 145 -1.176 0.563 -5.916 1.00 0.24 H new ATOM 0 HB THR A 145 1.470 0.609 -4.405 1.00 0.25 H new ATOM 0 HG1 THR A 145 -0.054 -1.427 -5.515 1.00 0.30 H new ATOM 0 HG21 THR A 145 0.108 -0.028 -2.438 1.00 0.30 H new ATOM 0 HG22 THR A 145 -0.364 1.564 -3.079 1.00 0.30 H new ATOM 0 HG23 THR A 145 -1.368 0.135 -3.419 1.00 0.30 H new ATOM 2210 N ILE A 146 -1.440 2.982 -5.303 1.00 0.26 N ATOM 2211 CA ILE A 146 -1.601 4.342 -4.843 1.00 0.28 C ATOM 2212 C ILE A 146 -1.603 4.359 -3.320 1.00 0.23 C ATOM 2213 O ILE A 146 -2.522 3.845 -2.685 1.00 0.24 O ATOM 2214 CB ILE A 146 -2.900 4.975 -5.392 1.00 0.36 C ATOM 2215 CG1 ILE A 146 -2.751 5.320 -6.873 1.00 0.53 C ATOM 2216 CG2 ILE A 146 -3.285 6.212 -4.594 1.00 0.34 C ATOM 2217 CD1 ILE A 146 -1.756 6.430 -7.139 1.00 0.63 C ATOM 0 H ILE A 146 -2.311 2.499 -5.525 1.00 0.26 H new ATOM 0 HA ILE A 146 -0.767 4.937 -5.216 1.00 0.28 H new ATOM 0 HB ILE A 146 -3.699 4.241 -5.287 1.00 0.36 H new ATOM 0 HG12 ILE A 146 -2.441 4.427 -7.416 1.00 0.53 H new ATOM 0 HG13 ILE A 146 -3.723 5.612 -7.269 1.00 0.53 H new ATOM 0 HG21 ILE A 146 -4.202 6.637 -5.002 1.00 0.34 H new ATOM 0 HG22 ILE A 146 -3.445 5.937 -3.551 1.00 0.34 H new ATOM 0 HG23 ILE A 146 -2.484 6.949 -4.657 1.00 0.34 H new ATOM 0 HD11 ILE A 146 -1.702 6.621 -8.211 1.00 0.63 H new ATOM 0 HD12 ILE A 146 -2.076 7.336 -6.624 1.00 0.63 H new ATOM 0 HD13 ILE A 146 -0.773 6.133 -6.774 1.00 0.63 H new ATOM 2229 N PHE A 147 -0.541 4.890 -2.738 1.00 0.25 N ATOM 2230 CA PHE A 147 -0.474 5.036 -1.302 1.00 0.30 C ATOM 2231 C PHE A 147 -1.090 6.351 -0.883 1.00 0.32 C ATOM 2232 O PHE A 147 -1.004 7.362 -1.582 1.00 0.50 O ATOM 2233 CB PHE A 147 0.953 5.018 -0.783 1.00 0.41 C ATOM 2234 CG PHE A 147 1.642 3.685 -0.839 1.00 0.33 C ATOM 2235 CD1 PHE A 147 1.683 2.945 -2.005 1.00 0.32 C ATOM 2236 CD2 PHE A 147 2.245 3.169 0.294 1.00 0.37 C ATOM 2237 CE1 PHE A 147 2.314 1.717 -2.040 1.00 0.33 C ATOM 2238 CE2 PHE A 147 2.872 1.944 0.262 1.00 0.36 C ATOM 2239 CZ PHE A 147 2.907 1.216 -0.904 1.00 0.33 C ATOM 0 H PHE A 147 0.282 5.225 -3.240 1.00 0.25 H new ATOM 0 HA PHE A 147 -1.017 4.189 -0.883 1.00 0.30 H new ATOM 0 HB2 PHE A 147 1.539 5.735 -1.357 1.00 0.41 H new ATOM 0 HB3 PHE A 147 0.950 5.363 0.251 1.00 0.41 H new ATOM 0 HD1 PHE A 147 1.216 3.331 -2.899 1.00 0.32 H new ATOM 0 HD2 PHE A 147 2.224 3.734 1.214 1.00 0.37 H new ATOM 0 HE1 PHE A 147 2.342 1.150 -2.959 1.00 0.33 H new ATOM 0 HE2 PHE A 147 3.338 1.554 1.155 1.00 0.36 H new ATOM 0 HZ PHE A 147 3.398 0.254 -0.928 1.00 0.33 H new ATOM 2249 N CYS A 148 -1.709 6.311 0.253 1.00 0.26 N ATOM 2250 CA CYS A 148 -2.223 7.483 0.911 1.00 0.27 C ATOM 2251 C CYS A 148 -1.527 7.646 2.252 1.00 0.31 C ATOM 2252 O CYS A 148 -1.327 6.671 2.959 1.00 0.53 O ATOM 2253 CB CYS A 148 -3.727 7.332 1.114 1.00 0.30 C ATOM 2254 SG CYS A 148 -4.652 7.060 -0.414 1.00 0.68 S ATOM 0 H CYS A 148 -1.878 5.446 0.766 1.00 0.26 H new ATOM 0 HA CYS A 148 -2.036 8.366 0.300 1.00 0.27 H new ATOM 0 HB2 CYS A 148 -3.910 6.497 1.791 1.00 0.30 H new ATOM 0 HB3 CYS A 148 -4.109 8.228 1.603 1.00 0.30 H new ATOM 0 HG CYS A 148 -5.098 5.839 -0.440 1.00 0.68 H new ATOM 2260 N LYS A 149 -1.129 8.856 2.590 1.00 0.29 N ATOM 2261 CA LYS A 149 -0.507 9.113 3.884 1.00 0.28 C ATOM 2262 C LYS A 149 -1.466 9.920 4.742 1.00 0.28 C ATOM 2263 O LYS A 149 -1.462 11.149 4.713 1.00 0.40 O ATOM 2264 CB LYS A 149 0.821 9.858 3.699 1.00 0.36 C ATOM 2265 CG LYS A 149 1.804 9.118 2.805 1.00 0.56 C ATOM 2266 CD LYS A 149 3.066 9.929 2.544 1.00 0.89 C ATOM 2267 CE LYS A 149 4.021 9.169 1.635 1.00 1.01 C ATOM 2268 NZ LYS A 149 5.269 9.929 1.346 1.00 1.44 N ATOM 0 H LYS A 149 -1.222 9.678 1.993 1.00 0.29 H new ATOM 0 HA LYS A 149 -0.291 8.168 4.382 1.00 0.28 H new ATOM 0 HB2 LYS A 149 0.622 10.841 3.273 1.00 0.36 H new ATOM 0 HB3 LYS A 149 1.278 10.020 4.675 1.00 0.36 H new ATOM 0 HG2 LYS A 149 2.073 8.170 3.270 1.00 0.56 H new ATOM 0 HG3 LYS A 149 1.323 8.882 1.856 1.00 0.56 H new ATOM 0 HD2 LYS A 149 2.802 10.882 2.086 1.00 0.89 H new ATOM 0 HD3 LYS A 149 3.560 10.155 3.489 1.00 0.89 H new ATOM 0 HE2 LYS A 149 4.280 8.218 2.101 1.00 1.01 H new ATOM 0 HE3 LYS A 149 3.516 8.938 0.697 1.00 1.01 H new ATOM 0 HZ1 LYS A 149 5.803 9.447 0.595 1.00 1.44 H new ATOM 0 HZ2 LYS A 149 5.025 10.891 1.034 1.00 1.44 H new ATOM 0 HZ3 LYS A 149 5.851 9.981 2.206 1.00 1.44 H new ATOM 2282 N LEU A 150 -2.302 9.219 5.492 1.00 0.21 N ATOM 2283 CA LEU A 150 -3.400 9.842 6.190 1.00 0.22 C ATOM 2284 C LEU A 150 -3.250 9.738 7.696 1.00 0.19 C ATOM 2285 O LEU A 150 -2.314 9.152 8.234 1.00 0.17 O ATOM 2286 CB LEU A 150 -4.718 9.197 5.752 1.00 0.25 C ATOM 2287 CG LEU A 150 -4.937 7.753 6.177 1.00 0.26 C ATOM 2288 CD1 LEU A 150 -5.765 7.670 7.441 1.00 0.79 C ATOM 2289 CD2 LEU A 150 -5.585 6.962 5.058 1.00 0.84 C ATOM 0 H LEU A 150 -2.234 8.211 5.629 1.00 0.21 H new ATOM 0 HA LEU A 150 -3.399 10.901 5.934 1.00 0.22 H new ATOM 0 HB2 LEU A 150 -5.539 9.797 6.144 1.00 0.25 H new ATOM 0 HB3 LEU A 150 -4.778 9.246 4.665 1.00 0.25 H new ATOM 0 HG LEU A 150 -3.962 7.316 6.391 1.00 0.26 H new ATOM 0 HD11 LEU A 150 -5.903 6.625 7.718 1.00 0.79 H new ATOM 0 HD12 LEU A 150 -5.252 8.194 8.247 1.00 0.79 H new ATOM 0 HD13 LEU A 150 -6.738 8.132 7.270 1.00 0.79 H new ATOM 0 HD21 LEU A 150 -5.734 5.931 5.380 1.00 0.84 H new ATOM 0 HD22 LEU A 150 -6.548 7.407 4.808 1.00 0.84 H new ATOM 0 HD23 LEU A 150 -4.939 6.978 4.180 1.00 0.84 H new ATOM 2301 N SER A 151 -4.222 10.302 8.346 1.00 0.26 N ATOM 2302 CA SER A 151 -4.336 10.335 9.770 1.00 0.29 C ATOM 2303 C SER A 151 -5.809 10.247 10.097 1.00 0.25 C ATOM 2304 O SER A 151 -6.523 11.247 10.044 1.00 0.29 O ATOM 2305 CB SER A 151 -3.769 11.642 10.289 1.00 0.46 C ATOM 2306 OG SER A 151 -4.153 12.726 9.460 1.00 1.77 O ATOM 0 H SER A 151 -4.993 10.774 7.874 1.00 0.26 H new ATOM 0 HA SER A 151 -3.788 9.513 10.231 1.00 0.29 H new ATOM 0 HB2 SER A 151 -4.119 11.816 11.307 1.00 0.46 H new ATOM 0 HB3 SER A 151 -2.682 11.579 10.332 1.00 0.46 H new ATOM 0 HG SER A 151 -3.415 12.954 8.857 1.00 1.77 H new ATOM 2312 N ALA A 152 -6.289 9.054 10.368 1.00 0.28 N ATOM 2313 CA ALA A 152 -7.697 8.876 10.646 1.00 0.31 C ATOM 2314 C ALA A 152 -8.051 9.559 11.951 1.00 0.33 C ATOM 2315 O ALA A 152 -9.217 9.852 12.217 1.00 0.41 O ATOM 2316 CB ALA A 152 -8.052 7.409 10.681 1.00 0.41 C ATOM 0 H ALA A 152 -5.732 8.200 10.402 1.00 0.28 H new ATOM 0 HA ALA A 152 -8.279 9.335 9.847 1.00 0.31 H new ATOM 0 HB1 ALA A 152 -9.116 7.297 10.892 1.00 0.41 H new ATOM 0 HB2 ALA A 152 -7.823 6.956 9.716 1.00 0.41 H new ATOM 0 HB3 ALA A 152 -7.474 6.913 11.461 1.00 0.41 H new ATOM 2322 N LYS A 153 -7.031 9.832 12.752 1.00 0.30 N ATOM 2323 CA LYS A 153 -7.231 10.585 13.974 1.00 0.34 C ATOM 2324 C LYS A 153 -7.298 12.089 13.703 1.00 0.36 C ATOM 2325 O LYS A 153 -8.161 12.772 14.248 1.00 0.49 O ATOM 2326 CB LYS A 153 -6.158 10.274 14.998 1.00 0.35 C ATOM 2327 CG LYS A 153 -6.326 8.919 15.671 1.00 0.60 C ATOM 2328 CD LYS A 153 -7.669 8.800 16.380 1.00 1.12 C ATOM 2329 CE LYS A 153 -7.820 7.446 17.062 1.00 1.65 C ATOM 2330 NZ LYS A 153 -9.161 7.273 17.686 1.00 2.30 N ATOM 0 H LYS A 153 -6.068 9.545 12.578 1.00 0.30 H new ATOM 0 HA LYS A 153 -8.191 10.276 14.387 1.00 0.34 H new ATOM 0 HB2 LYS A 153 -5.183 10.309 14.511 1.00 0.35 H new ATOM 0 HB3 LYS A 153 -6.161 11.052 15.762 1.00 0.35 H new ATOM 0 HG2 LYS A 153 -6.238 8.129 14.925 1.00 0.60 H new ATOM 0 HG3 LYS A 153 -5.521 8.769 16.390 1.00 0.60 H new ATOM 0 HD2 LYS A 153 -7.763 9.594 17.120 1.00 1.12 H new ATOM 0 HD3 LYS A 153 -8.476 8.938 15.660 1.00 1.12 H new ATOM 0 HE2 LYS A 153 -7.657 6.654 16.331 1.00 1.65 H new ATOM 0 HE3 LYS A 153 -7.050 7.339 17.826 1.00 1.65 H new ATOM 0 HZ1 LYS A 153 -9.216 6.338 18.137 1.00 2.30 H new ATOM 0 HZ2 LYS A 153 -9.308 8.012 18.403 1.00 2.30 H new ATOM 0 HZ3 LYS A 153 -9.897 7.348 16.955 1.00 2.30 H new ATOM 2344 N THR A 154 -6.407 12.613 12.853 1.00 0.30 N ATOM 2345 CA THR A 154 -6.438 14.040 12.528 1.00 0.39 C ATOM 2346 C THR A 154 -7.575 14.351 11.559 1.00 0.36 C ATOM 2347 O THR A 154 -7.959 15.510 11.368 1.00 0.41 O ATOM 2348 CB THR A 154 -5.110 14.516 11.909 1.00 0.47 C ATOM 2349 OG1 THR A 154 -4.016 13.846 12.530 1.00 0.50 O ATOM 2350 CG2 THR A 154 -4.925 16.009 12.094 1.00 0.70 C ATOM 0 H THR A 154 -5.671 12.082 12.387 1.00 0.30 H new ATOM 0 HA THR A 154 -6.597 14.572 13.466 1.00 0.39 H new ATOM 0 HB THR A 154 -5.141 14.287 10.844 1.00 0.47 H new ATOM 0 HG1 THR A 154 -3.915 14.167 13.450 1.00 0.50 H new ATOM 0 HG21 THR A 154 -3.979 16.317 11.647 1.00 0.70 H new ATOM 0 HG22 THR A 154 -5.745 16.540 11.610 1.00 0.70 H new ATOM 0 HG23 THR A 154 -4.918 16.246 13.158 1.00 0.70 H new ATOM 2358 N LYS A 155 -8.098 13.287 10.949 1.00 0.30 N ATOM 2359 CA LYS A 155 -9.193 13.379 9.982 1.00 0.32 C ATOM 2360 C LYS A 155 -8.735 14.103 8.735 1.00 0.34 C ATOM 2361 O LYS A 155 -9.422 14.974 8.211 1.00 0.41 O ATOM 2362 CB LYS A 155 -10.421 14.073 10.572 1.00 0.38 C ATOM 2363 CG LYS A 155 -11.189 13.197 11.530 1.00 0.40 C ATOM 2364 CD LYS A 155 -11.459 11.836 10.922 1.00 0.45 C ATOM 2365 CE LYS A 155 -12.411 11.030 11.787 1.00 0.61 C ATOM 2366 NZ LYS A 155 -11.922 10.900 13.189 1.00 1.36 N ATOM 0 H LYS A 155 -7.773 12.334 11.112 1.00 0.30 H new ATOM 0 HA LYS A 155 -9.483 12.361 9.722 1.00 0.32 H new ATOM 0 HB2 LYS A 155 -10.106 14.979 11.090 1.00 0.38 H new ATOM 0 HB3 LYS A 155 -11.081 14.382 9.762 1.00 0.38 H new ATOM 0 HG2 LYS A 155 -10.624 13.081 12.455 1.00 0.40 H new ATOM 0 HG3 LYS A 155 -12.132 13.677 11.791 1.00 0.40 H new ATOM 0 HD2 LYS A 155 -11.883 11.957 9.925 1.00 0.45 H new ATOM 0 HD3 LYS A 155 -10.521 11.294 10.806 1.00 0.45 H new ATOM 0 HE2 LYS A 155 -13.391 11.507 11.788 1.00 0.61 H new ATOM 0 HE3 LYS A 155 -12.540 10.038 11.355 1.00 0.61 H new ATOM 0 HZ1 LYS A 155 -12.497 10.195 13.693 1.00 1.36 H new ATOM 0 HZ2 LYS A 155 -10.928 10.595 13.183 1.00 1.36 H new ATOM 0 HZ3 LYS A 155 -12.000 11.819 13.670 1.00 1.36 H new ATOM 2380 N GLU A 156 -7.570 13.714 8.261 1.00 0.30 N ATOM 2381 CA GLU A 156 -6.958 14.388 7.131 1.00 0.33 C ATOM 2382 C GLU A 156 -7.031 13.518 5.880 1.00 0.28 C ATOM 2383 O GLU A 156 -7.624 13.890 4.861 1.00 0.30 O ATOM 2384 CB GLU A 156 -5.508 14.755 7.499 1.00 0.40 C ATOM 2385 CG GLU A 156 -4.463 14.380 6.461 1.00 1.30 C ATOM 2386 CD GLU A 156 -3.052 14.645 6.933 1.00 1.70 C ATOM 2387 OE1 GLU A 156 -2.491 13.787 7.638 1.00 2.48 O ATOM 2388 OE2 GLU A 156 -2.499 15.717 6.600 1.00 1.52 O ATOM 0 H GLU A 156 -7.028 12.937 8.638 1.00 0.30 H new ATOM 0 HA GLU A 156 -7.501 15.305 6.903 1.00 0.33 H new ATOM 0 HB2 GLU A 156 -5.455 15.830 7.673 1.00 0.40 H new ATOM 0 HB3 GLU A 156 -5.254 14.267 8.440 1.00 0.40 H new ATOM 0 HG2 GLU A 156 -4.566 13.324 6.212 1.00 1.30 H new ATOM 0 HG3 GLU A 156 -4.647 14.943 5.546 1.00 1.30 H new ATOM 2395 N GLY A 157 -6.477 12.333 5.980 1.00 0.29 N ATOM 2396 CA GLY A 157 -6.352 11.497 4.829 1.00 0.28 C ATOM 2397 C GLY A 157 -7.550 10.613 4.594 1.00 0.27 C ATOM 2398 O GLY A 157 -7.544 9.812 3.674 1.00 0.29 O ATOM 0 H GLY A 157 -6.110 11.935 6.845 1.00 0.29 H new ATOM 0 HA2 GLY A 157 -6.195 12.123 3.951 1.00 0.28 H new ATOM 0 HA3 GLY A 157 -5.465 10.872 4.938 1.00 0.28 H new ATOM 2402 N LEU A 158 -8.572 10.733 5.431 1.00 0.26 N ATOM 2403 CA LEU A 158 -9.787 9.974 5.214 1.00 0.28 C ATOM 2404 C LEU A 158 -10.553 10.580 4.053 1.00 0.30 C ATOM 2405 O LEU A 158 -11.066 9.868 3.183 1.00 0.33 O ATOM 2406 CB LEU A 158 -10.633 9.934 6.482 1.00 0.31 C ATOM 2407 CG LEU A 158 -10.032 9.103 7.616 1.00 0.47 C ATOM 2408 CD1 LEU A 158 -10.960 9.072 8.814 1.00 0.73 C ATOM 2409 CD2 LEU A 158 -9.736 7.689 7.138 1.00 0.80 C ATOM 0 H LEU A 158 -8.582 11.339 6.252 1.00 0.26 H new ATOM 0 HA LEU A 158 -9.533 8.944 4.966 1.00 0.28 H new ATOM 0 HB2 LEU A 158 -10.784 10.954 6.836 1.00 0.31 H new ATOM 0 HB3 LEU A 158 -11.616 9.533 6.236 1.00 0.31 H new ATOM 0 HG LEU A 158 -9.097 9.572 7.922 1.00 0.47 H new ATOM 0 HD11 LEU A 158 -10.510 8.475 9.607 1.00 0.73 H new ATOM 0 HD12 LEU A 158 -11.124 10.088 9.173 1.00 0.73 H new ATOM 0 HD13 LEU A 158 -11.914 8.631 8.524 1.00 0.73 H new ATOM 0 HD21 LEU A 158 -9.309 7.110 7.957 1.00 0.80 H new ATOM 0 HD22 LEU A 158 -10.660 7.217 6.804 1.00 0.80 H new ATOM 0 HD23 LEU A 158 -9.027 7.725 6.311 1.00 0.80 H new ATOM 2421 N ASP A 159 -10.590 11.905 4.023 1.00 0.32 N ATOM 2422 CA ASP A 159 -11.137 12.611 2.883 1.00 0.38 C ATOM 2423 C ASP A 159 -10.233 12.401 1.681 1.00 0.32 C ATOM 2424 O ASP A 159 -10.700 12.113 0.585 1.00 0.33 O ATOM 2425 CB ASP A 159 -11.294 14.105 3.173 1.00 0.50 C ATOM 2426 CG ASP A 159 -12.417 14.405 4.142 1.00 1.25 C ATOM 2427 OD1 ASP A 159 -13.592 14.406 3.716 1.00 1.42 O ATOM 2428 OD2 ASP A 159 -12.133 14.628 5.340 1.00 2.20 O ATOM 0 H ASP A 159 -10.249 12.506 4.773 1.00 0.32 H new ATOM 0 HA ASP A 159 -12.129 12.211 2.672 1.00 0.38 H new ATOM 0 HB2 ASP A 159 -10.359 14.491 3.579 1.00 0.50 H new ATOM 0 HB3 ASP A 159 -11.478 14.634 2.238 1.00 0.50 H new ATOM 2433 N HIS A 160 -8.924 12.509 1.910 1.00 0.30 N ATOM 2434 CA HIS A 160 -7.940 12.296 0.851 1.00 0.30 C ATOM 2435 C HIS A 160 -7.984 10.855 0.323 1.00 0.28 C ATOM 2436 O HIS A 160 -7.584 10.591 -0.812 1.00 0.33 O ATOM 2437 CB HIS A 160 -6.536 12.631 1.371 1.00 0.34 C ATOM 2438 CG HIS A 160 -5.436 12.401 0.376 1.00 0.41 C ATOM 2439 ND1 HIS A 160 -5.089 13.316 -0.593 1.00 0.52 N ATOM 2440 CD2 HIS A 160 -4.603 11.348 0.211 1.00 0.46 C ATOM 2441 CE1 HIS A 160 -4.088 12.838 -1.309 1.00 0.58 C ATOM 2442 NE2 HIS A 160 -3.775 11.646 -0.841 1.00 0.54 N ATOM 0 H HIS A 160 -8.522 12.742 2.818 1.00 0.30 H new ATOM 0 HA HIS A 160 -8.186 12.958 0.021 1.00 0.30 H new ATOM 0 HB2 HIS A 160 -6.516 13.676 1.681 1.00 0.34 H new ATOM 0 HB3 HIS A 160 -6.338 12.031 2.259 1.00 0.34 H new ATOM 0 HD2 HIS A 160 -4.592 10.442 0.798 1.00 0.46 H new ATOM 0 HE1 HIS A 160 -3.608 13.338 -2.137 1.00 0.58 H new ATOM 0 HE2 HIS A 160 -3.036 11.043 -1.203 1.00 0.54 H new ATOM 2451 N LEU A 161 -8.487 9.932 1.135 1.00 0.27 N ATOM 2452 CA LEU A 161 -8.529 8.524 0.764 1.00 0.28 C ATOM 2453 C LEU A 161 -9.516 8.321 -0.362 1.00 0.29 C ATOM 2454 O LEU A 161 -9.174 7.816 -1.429 1.00 0.31 O ATOM 2455 CB LEU A 161 -8.937 7.666 1.962 1.00 0.29 C ATOM 2456 CG LEU A 161 -8.942 6.154 1.720 1.00 0.57 C ATOM 2457 CD1 LEU A 161 -7.549 5.662 1.367 1.00 1.15 C ATOM 2458 CD2 LEU A 161 -9.470 5.423 2.944 1.00 1.16 C ATOM 0 H LEU A 161 -8.872 10.135 2.057 1.00 0.27 H new ATOM 0 HA LEU A 161 -7.534 8.221 0.437 1.00 0.28 H new ATOM 0 HB2 LEU A 161 -8.260 7.882 2.788 1.00 0.29 H new ATOM 0 HB3 LEU A 161 -9.935 7.969 2.280 1.00 0.29 H new ATOM 0 HG LEU A 161 -9.602 5.944 0.878 1.00 0.57 H new ATOM 0 HD11 LEU A 161 -7.575 4.585 1.199 1.00 1.15 H new ATOM 0 HD12 LEU A 161 -7.205 6.162 0.462 1.00 1.15 H new ATOM 0 HD13 LEU A 161 -6.866 5.885 2.187 1.00 1.15 H new ATOM 0 HD21 LEU A 161 -9.467 4.349 2.756 1.00 1.16 H new ATOM 0 HD22 LEU A 161 -8.834 5.643 3.802 1.00 1.16 H new ATOM 0 HD23 LEU A 161 -10.488 5.752 3.153 1.00 1.16 H new ATOM 2470 N LEU A 162 -10.741 8.751 -0.119 1.00 0.31 N ATOM 2471 CA LEU A 162 -11.799 8.620 -1.099 1.00 0.37 C ATOM 2472 C LEU A 162 -11.502 9.472 -2.336 1.00 0.38 C ATOM 2473 O LEU A 162 -11.989 9.178 -3.421 1.00 0.45 O ATOM 2474 CB LEU A 162 -13.144 8.971 -0.454 1.00 0.47 C ATOM 2475 CG LEU A 162 -13.293 10.400 0.082 1.00 0.85 C ATOM 2476 CD1 LEU A 162 -13.694 11.361 -1.025 1.00 1.49 C ATOM 2477 CD2 LEU A 162 -14.313 10.433 1.209 1.00 1.51 C ATOM 0 H LEU A 162 -11.027 9.196 0.753 1.00 0.31 H new ATOM 0 HA LEU A 162 -11.854 7.586 -1.441 1.00 0.37 H new ATOM 0 HB2 LEU A 162 -13.930 8.798 -1.189 1.00 0.47 H new ATOM 0 HB3 LEU A 162 -13.319 8.278 0.369 1.00 0.47 H new ATOM 0 HG LEU A 162 -12.326 10.721 0.471 1.00 0.85 H new ATOM 0 HD11 LEU A 162 -13.792 12.367 -0.616 1.00 1.49 H new ATOM 0 HD12 LEU A 162 -12.931 11.359 -1.803 1.00 1.49 H new ATOM 0 HD13 LEU A 162 -14.647 11.048 -1.451 1.00 1.49 H new ATOM 0 HD21 LEU A 162 -14.410 11.453 1.582 1.00 1.51 H new ATOM 0 HD22 LEU A 162 -15.278 10.089 0.837 1.00 1.51 H new ATOM 0 HD23 LEU A 162 -13.983 9.781 2.018 1.00 1.51 H new ATOM 2489 N GLU A 163 -10.688 10.517 -2.169 1.00 0.37 N ATOM 2490 CA GLU A 163 -10.216 11.307 -3.302 1.00 0.44 C ATOM 2491 C GLU A 163 -9.298 10.468 -4.191 1.00 0.41 C ATOM 2492 O GLU A 163 -9.417 10.479 -5.416 1.00 0.50 O ATOM 2493 CB GLU A 163 -9.465 12.543 -2.819 1.00 0.56 C ATOM 2494 CG GLU A 163 -10.325 13.518 -2.036 1.00 1.03 C ATOM 2495 CD GLU A 163 -11.371 14.203 -2.891 1.00 1.78 C ATOM 2496 OE1 GLU A 163 -10.995 14.854 -3.886 1.00 2.14 O ATOM 2497 OE2 GLU A 163 -12.568 14.130 -2.549 1.00 2.57 O ATOM 0 H GLU A 163 -10.344 10.833 -1.262 1.00 0.37 H new ATOM 0 HA GLU A 163 -11.085 11.623 -3.879 1.00 0.44 H new ATOM 0 HB2 GLU A 163 -8.630 12.227 -2.194 1.00 0.56 H new ATOM 0 HB3 GLU A 163 -9.041 13.059 -3.681 1.00 0.56 H new ATOM 0 HG2 GLU A 163 -10.820 12.986 -1.223 1.00 1.03 H new ATOM 0 HG3 GLU A 163 -9.685 14.273 -1.580 1.00 1.03 H new ATOM 2504 N MET A 164 -8.381 9.737 -3.566 1.00 0.37 N ATOM 2505 CA MET A 164 -7.474 8.862 -4.302 1.00 0.39 C ATOM 2506 C MET A 164 -8.246 7.708 -4.923 1.00 0.37 C ATOM 2507 O MET A 164 -7.952 7.270 -6.033 1.00 0.43 O ATOM 2508 CB MET A 164 -6.371 8.324 -3.390 1.00 0.43 C ATOM 2509 CG MET A 164 -5.421 9.387 -2.852 1.00 0.64 C ATOM 2510 SD MET A 164 -4.311 10.075 -4.104 1.00 0.58 S ATOM 2511 CE MET A 164 -5.401 11.183 -4.999 1.00 0.53 C ATOM 0 H MET A 164 -8.246 9.732 -2.555 1.00 0.37 H new ATOM 0 HA MET A 164 -7.007 9.447 -5.095 1.00 0.39 H new ATOM 0 HB2 MET A 164 -6.833 7.808 -2.548 1.00 0.43 H new ATOM 0 HB3 MET A 164 -5.792 7.582 -3.940 1.00 0.43 H new ATOM 0 HG2 MET A 164 -6.006 10.196 -2.415 1.00 0.64 H new ATOM 0 HG3 MET A 164 -4.824 8.955 -2.049 1.00 0.64 H new ATOM 0 HE1 MET A 164 -4.890 12.129 -5.180 1.00 0.53 H new ATOM 0 HE2 MET A 164 -5.677 10.731 -5.952 1.00 0.53 H new ATOM 0 HE3 MET A 164 -6.300 11.364 -4.410 1.00 0.53 H new ATOM 2521 N ILE A 165 -9.244 7.226 -4.195 1.00 0.34 N ATOM 2522 CA ILE A 165 -10.126 6.193 -4.712 1.00 0.38 C ATOM 2523 C ILE A 165 -10.958 6.743 -5.870 1.00 0.44 C ATOM 2524 O ILE A 165 -11.298 6.023 -6.805 1.00 0.52 O ATOM 2525 CB ILE A 165 -11.063 5.649 -3.614 1.00 0.40 C ATOM 2526 CG1 ILE A 165 -10.249 5.049 -2.465 1.00 0.42 C ATOM 2527 CG2 ILE A 165 -12.009 4.608 -4.191 1.00 0.50 C ATOM 2528 CD1 ILE A 165 -11.096 4.590 -1.298 1.00 0.50 C ATOM 0 H ILE A 165 -9.461 7.534 -3.247 1.00 0.34 H new ATOM 0 HA ILE A 165 -9.503 5.372 -5.066 1.00 0.38 H new ATOM 0 HB ILE A 165 -11.655 6.477 -3.224 1.00 0.40 H new ATOM 0 HG12 ILE A 165 -9.674 4.203 -2.841 1.00 0.42 H new ATOM 0 HG13 ILE A 165 -9.532 5.790 -2.113 1.00 0.42 H new ATOM 0 HG21 ILE A 165 -12.663 4.234 -3.403 1.00 0.50 H new ATOM 0 HG22 ILE A 165 -12.611 5.061 -4.979 1.00 0.50 H new ATOM 0 HG23 ILE A 165 -11.432 3.782 -4.605 1.00 0.50 H new ATOM 0 HD11 ILE A 165 -10.452 4.176 -0.522 1.00 0.50 H new ATOM 0 HD12 ILE A 165 -11.651 5.438 -0.896 1.00 0.50 H new ATOM 0 HD13 ILE A 165 -11.796 3.825 -1.635 1.00 0.50 H new ATOM 2540 N LEU A 166 -11.274 8.029 -5.797 1.00 0.46 N ATOM 2541 CA LEU A 166 -11.995 8.721 -6.859 1.00 0.57 C ATOM 2542 C LEU A 166 -11.142 8.821 -8.116 1.00 0.61 C ATOM 2543 O LEU A 166 -11.656 8.770 -9.232 1.00 0.70 O ATOM 2544 CB LEU A 166 -12.415 10.113 -6.383 1.00 0.66 C ATOM 2545 CG LEU A 166 -12.650 11.135 -7.490 1.00 1.07 C ATOM 2546 CD1 LEU A 166 -14.074 11.672 -7.434 1.00 1.73 C ATOM 2547 CD2 LEU A 166 -11.638 12.267 -7.387 1.00 1.38 C ATOM 0 H LEU A 166 -11.038 8.622 -5.001 1.00 0.46 H new ATOM 0 HA LEU A 166 -12.889 8.147 -7.104 1.00 0.57 H new ATOM 0 HB2 LEU A 166 -13.330 10.019 -5.798 1.00 0.66 H new ATOM 0 HB3 LEU A 166 -11.646 10.498 -5.713 1.00 0.66 H new ATOM 0 HG LEU A 166 -12.516 10.641 -8.452 1.00 1.07 H new ATOM 0 HD11 LEU A 166 -14.220 12.400 -8.232 1.00 1.73 H new ATOM 0 HD12 LEU A 166 -14.778 10.849 -7.559 1.00 1.73 H new ATOM 0 HD13 LEU A 166 -14.244 12.152 -6.470 1.00 1.73 H new ATOM 0 HD21 LEU A 166 -11.818 12.989 -8.183 1.00 1.38 H new ATOM 0 HD22 LEU A 166 -11.741 12.760 -6.420 1.00 1.38 H new ATOM 0 HD23 LEU A 166 -10.630 11.864 -7.483 1.00 1.38 H new ATOM 2559 N LEU A 167 -9.844 8.986 -7.927 1.00 0.56 N ATOM 2560 CA LEU A 167 -8.889 8.921 -9.028 1.00 0.64 C ATOM 2561 C LEU A 167 -9.021 7.577 -9.728 1.00 0.66 C ATOM 2562 O LEU A 167 -9.013 7.482 -10.955 1.00 0.75 O ATOM 2563 CB LEU A 167 -7.466 9.088 -8.498 1.00 0.64 C ATOM 2564 CG LEU A 167 -6.376 9.273 -9.559 1.00 0.81 C ATOM 2565 CD1 LEU A 167 -6.619 10.543 -10.364 1.00 1.47 C ATOM 2566 CD2 LEU A 167 -5.003 9.310 -8.906 1.00 1.51 C ATOM 0 H LEU A 167 -9.422 9.167 -7.016 1.00 0.56 H new ATOM 0 HA LEU A 167 -9.098 9.724 -9.734 1.00 0.64 H new ATOM 0 HB2 LEU A 167 -7.446 9.949 -7.830 1.00 0.64 H new ATOM 0 HB3 LEU A 167 -7.217 8.213 -7.898 1.00 0.64 H new ATOM 0 HG LEU A 167 -6.413 8.424 -10.242 1.00 0.81 H new ATOM 0 HD11 LEU A 167 -5.834 10.656 -11.112 1.00 1.47 H new ATOM 0 HD12 LEU A 167 -7.587 10.479 -10.861 1.00 1.47 H new ATOM 0 HD13 LEU A 167 -6.610 11.404 -9.696 1.00 1.47 H new ATOM 0 HD21 LEU A 167 -4.239 9.442 -9.672 1.00 1.51 H new ATOM 0 HD22 LEU A 167 -4.957 10.140 -8.201 1.00 1.51 H new ATOM 0 HD23 LEU A 167 -4.827 8.374 -8.376 1.00 1.51 H new ATOM 2578 N VAL A 168 -9.153 6.536 -8.927 1.00 0.61 N ATOM 2579 CA VAL A 168 -9.382 5.201 -9.434 1.00 0.69 C ATOM 2580 C VAL A 168 -10.781 5.098 -10.049 1.00 0.77 C ATOM 2581 O VAL A 168 -10.964 4.491 -11.102 1.00 0.89 O ATOM 2582 CB VAL A 168 -9.227 4.150 -8.318 1.00 0.68 C ATOM 2583 CG1 VAL A 168 -9.395 2.757 -8.879 1.00 0.84 C ATOM 2584 CG2 VAL A 168 -7.878 4.296 -7.628 1.00 0.66 C ATOM 0 H VAL A 168 -9.104 6.594 -7.910 1.00 0.61 H new ATOM 0 HA VAL A 168 -8.635 5.003 -10.203 1.00 0.69 H new ATOM 0 HB VAL A 168 -10.007 4.316 -7.575 1.00 0.68 H new ATOM 0 HG11 VAL A 168 -9.283 2.026 -8.078 1.00 0.84 H new ATOM 0 HG12 VAL A 168 -10.386 2.660 -9.322 1.00 0.84 H new ATOM 0 HG13 VAL A 168 -8.637 2.578 -9.642 1.00 0.84 H new ATOM 0 HG21 VAL A 168 -7.788 3.545 -6.843 1.00 0.66 H new ATOM 0 HG22 VAL A 168 -7.080 4.157 -8.357 1.00 0.66 H new ATOM 0 HG23 VAL A 168 -7.800 5.291 -7.189 1.00 0.66 H new ATOM 2594 N SER A 169 -11.758 5.725 -9.393 1.00 0.74 N ATOM 2595 CA SER A 169 -13.130 5.773 -9.895 1.00 0.87 C ATOM 2596 C SER A 169 -13.223 6.614 -11.175 1.00 0.96 C ATOM 2597 O SER A 169 -14.263 6.670 -11.826 1.00 1.12 O ATOM 2598 CB SER A 169 -14.052 6.349 -8.820 1.00 0.88 C ATOM 2599 OG SER A 169 -13.957 5.608 -7.612 1.00 1.35 O ATOM 0 H SER A 169 -11.622 6.210 -8.506 1.00 0.74 H new ATOM 0 HA SER A 169 -13.443 4.757 -10.137 1.00 0.87 H new ATOM 0 HB2 SER A 169 -13.790 7.390 -8.633 1.00 0.88 H new ATOM 0 HB3 SER A 169 -15.082 6.338 -9.176 1.00 0.88 H new ATOM 0 HG SER A 169 -13.066 5.729 -7.223 1.00 1.35 H new ATOM 2605 N GLU A 170 -12.130 7.284 -11.510 1.00 0.96 N ATOM 2606 CA GLU A 170 -12.019 8.001 -12.767 1.00 1.11 C ATOM 2607 C GLU A 170 -11.600 7.023 -13.854 1.00 1.17 C ATOM 2608 O GLU A 170 -12.125 7.031 -14.968 1.00 1.37 O ATOM 2609 CB GLU A 170 -10.966 9.107 -12.635 1.00 1.26 C ATOM 2610 CG GLU A 170 -10.865 10.029 -13.835 1.00 1.84 C ATOM 2611 CD GLU A 170 -11.897 11.131 -13.803 1.00 2.19 C ATOM 2612 OE1 GLU A 170 -11.749 12.056 -12.976 1.00 2.56 O ATOM 2613 OE2 GLU A 170 -12.852 11.090 -14.606 1.00 2.73 O ATOM 0 H GLU A 170 -11.300 7.345 -10.920 1.00 0.96 H new ATOM 0 HA GLU A 170 -12.978 8.451 -13.024 1.00 1.11 H new ATOM 0 HB2 GLU A 170 -11.194 9.705 -11.752 1.00 1.26 H new ATOM 0 HB3 GLU A 170 -9.993 8.646 -12.465 1.00 1.26 H new ATOM 0 HG2 GLU A 170 -9.868 10.469 -13.869 1.00 1.84 H new ATOM 0 HG3 GLU A 170 -10.987 9.447 -14.748 1.00 1.84 H new ATOM 2620 N MET A 171 -10.673 6.149 -13.493 1.00 1.11 N ATOM 2621 CA MET A 171 -10.070 5.238 -14.448 1.00 1.28 C ATOM 2622 C MET A 171 -10.914 3.987 -14.664 1.00 1.54 C ATOM 2623 O MET A 171 -10.614 3.197 -15.548 1.00 1.88 O ATOM 2624 CB MET A 171 -8.654 4.851 -14.018 1.00 1.31 C ATOM 2625 CG MET A 171 -7.720 6.041 -13.853 1.00 1.43 C ATOM 2626 SD MET A 171 -5.980 5.572 -13.879 1.00 1.66 S ATOM 2627 CE MET A 171 -5.983 4.178 -12.756 1.00 1.68 C ATOM 0 H MET A 171 -10.322 6.053 -12.540 1.00 1.11 H new ATOM 0 HA MET A 171 -10.018 5.769 -15.398 1.00 1.28 H new ATOM 0 HB2 MET A 171 -8.706 4.307 -13.075 1.00 1.31 H new ATOM 0 HB3 MET A 171 -8.233 4.169 -14.757 1.00 1.31 H new ATOM 0 HG2 MET A 171 -7.910 6.759 -14.650 1.00 1.43 H new ATOM 0 HG3 MET A 171 -7.942 6.544 -12.912 1.00 1.43 H new ATOM 0 HE1 MET A 171 -4.963 3.969 -12.432 1.00 1.68 H new ATOM 0 HE2 MET A 171 -6.599 4.412 -11.887 1.00 1.68 H new ATOM 0 HE3 MET A 171 -6.389 3.303 -13.263 1.00 1.68 H new ATOM 2637 N GLU A 172 -11.953 3.785 -13.854 1.00 1.62 N ATOM 2638 CA GLU A 172 -12.859 2.649 -14.066 1.00 2.07 C ATOM 2639 C GLU A 172 -13.369 2.638 -15.512 1.00 2.05 C ATOM 2640 O GLU A 172 -13.540 1.577 -16.119 1.00 2.58 O ATOM 2641 CB GLU A 172 -14.030 2.676 -13.071 1.00 2.47 C ATOM 2642 CG GLU A 172 -14.857 3.953 -13.107 1.00 3.01 C ATOM 2643 CD GLU A 172 -16.022 3.936 -12.129 1.00 3.71 C ATOM 2644 OE1 GLU A 172 -15.784 3.931 -10.905 1.00 4.27 O ATOM 2645 OE2 GLU A 172 -17.185 3.961 -12.581 1.00 4.04 O ATOM 0 H GLU A 172 -12.188 4.379 -13.059 1.00 1.62 H new ATOM 0 HA GLU A 172 -12.300 1.730 -13.889 1.00 2.07 H new ATOM 0 HB2 GLU A 172 -14.684 1.828 -13.275 1.00 2.47 H new ATOM 0 HB3 GLU A 172 -13.638 2.540 -12.063 1.00 2.47 H new ATOM 0 HG2 GLU A 172 -14.213 4.803 -12.881 1.00 3.01 H new ATOM 0 HG3 GLU A 172 -15.240 4.103 -14.117 1.00 3.01 H new ATOM 2652 N GLU A 173 -13.579 3.832 -16.060 1.00 1.85 N ATOM 2653 CA GLU A 173 -13.930 3.993 -17.466 1.00 2.28 C ATOM 2654 C GLU A 173 -12.745 4.537 -18.261 1.00 2.77 C ATOM 2655 O GLU A 173 -12.550 4.185 -19.426 1.00 3.47 O ATOM 2656 CB GLU A 173 -15.126 4.939 -17.610 1.00 2.50 C ATOM 2657 CG GLU A 173 -16.473 4.250 -17.479 1.00 2.86 C ATOM 2658 CD GLU A 173 -16.791 3.376 -18.675 1.00 3.41 C ATOM 2659 OE1 GLU A 173 -17.327 3.909 -19.674 1.00 3.91 O ATOM 2660 OE2 GLU A 173 -16.503 2.161 -18.624 1.00 3.82 O ATOM 0 H GLU A 173 -13.511 4.710 -15.545 1.00 1.85 H new ATOM 0 HA GLU A 173 -14.198 3.014 -17.863 1.00 2.28 H new ATOM 0 HB2 GLU A 173 -15.053 5.720 -16.853 1.00 2.50 H new ATOM 0 HB3 GLU A 173 -15.073 5.431 -18.581 1.00 2.50 H new ATOM 0 HG2 GLU A 173 -16.481 3.641 -16.575 1.00 2.86 H new ATOM 0 HG3 GLU A 173 -17.254 5.002 -17.364 1.00 2.86 H new ATOM 2667 N LEU A 174 -11.939 5.376 -17.618 1.00 2.83 N ATOM 2668 CA LEU A 174 -10.836 6.059 -18.291 1.00 3.69 C ATOM 2669 C LEU A 174 -9.482 5.449 -17.920 1.00 3.89 C ATOM 2670 O LEU A 174 -8.534 6.170 -17.609 1.00 4.73 O ATOM 2671 CB LEU A 174 -10.833 7.561 -17.956 1.00 4.31 C ATOM 2672 CG LEU A 174 -11.928 8.407 -18.621 1.00 4.98 C ATOM 2673 CD1 LEU A 174 -11.995 8.126 -20.117 1.00 5.48 C ATOM 2674 CD2 LEU A 174 -13.280 8.175 -17.963 1.00 5.72 C ATOM 0 H LEU A 174 -12.029 5.601 -16.627 1.00 2.83 H new ATOM 0 HA LEU A 174 -10.989 5.931 -19.362 1.00 3.69 H new ATOM 0 HB2 LEU A 174 -10.924 7.671 -16.875 1.00 4.31 H new ATOM 0 HB3 LEU A 174 -9.864 7.973 -18.238 1.00 4.31 H new ATOM 0 HG LEU A 174 -11.669 9.457 -18.484 1.00 4.98 H new ATOM 0 HD11 LEU A 174 -12.778 8.736 -20.567 1.00 5.48 H new ATOM 0 HD12 LEU A 174 -11.037 8.368 -20.576 1.00 5.48 H new ATOM 0 HD13 LEU A 174 -12.219 7.072 -20.280 1.00 5.48 H new ATOM 0 HD21 LEU A 174 -14.035 8.788 -18.456 1.00 5.72 H new ATOM 0 HD22 LEU A 174 -13.552 7.123 -18.052 1.00 5.72 H new ATOM 0 HD23 LEU A 174 -13.223 8.447 -16.909 1.00 5.72 H new ATOM 2686 N LYS A 175 -9.389 4.123 -17.958 1.00 3.42 N ATOM 2687 CA LYS A 175 -8.148 3.423 -17.623 1.00 3.88 C ATOM 2688 C LYS A 175 -7.157 3.453 -18.792 1.00 4.00 C ATOM 2689 O LYS A 175 -6.349 2.540 -18.968 1.00 4.36 O ATOM 2690 CB LYS A 175 -8.433 1.969 -17.195 1.00 4.27 C ATOM 2691 CG LYS A 175 -9.256 1.140 -18.181 1.00 4.29 C ATOM 2692 CD LYS A 175 -10.726 1.544 -18.210 1.00 4.24 C ATOM 2693 CE LYS A 175 -11.610 0.429 -18.742 1.00 4.99 C ATOM 2694 NZ LYS A 175 -11.859 -0.614 -17.713 1.00 5.49 N ATOM 0 H LYS A 175 -10.160 3.508 -18.218 1.00 3.42 H new ATOM 0 HA LYS A 175 -7.693 3.947 -16.782 1.00 3.88 H new ATOM 0 HB2 LYS A 175 -7.481 1.465 -17.030 1.00 4.27 H new ATOM 0 HB3 LYS A 175 -8.955 1.986 -16.238 1.00 4.27 H new ATOM 0 HG2 LYS A 175 -8.834 1.248 -19.180 1.00 4.29 H new ATOM 0 HG3 LYS A 175 -9.179 0.086 -17.915 1.00 4.29 H new ATOM 0 HD2 LYS A 175 -11.048 1.814 -17.204 1.00 4.24 H new ATOM 0 HD3 LYS A 175 -10.846 2.431 -18.832 1.00 4.24 H new ATOM 0 HE2 LYS A 175 -12.561 0.846 -19.075 1.00 4.99 H new ATOM 0 HE3 LYS A 175 -11.138 -0.025 -19.613 1.00 4.99 H new ATOM 0 HZ1 LYS A 175 -12.380 -1.406 -18.141 1.00 5.49 H new ATOM 0 HZ2 LYS A 175 -10.951 -0.957 -17.340 1.00 5.49 H new ATOM 0 HZ3 LYS A 175 -12.421 -0.209 -16.937 1.00 5.49 H new ATOM 2708 N ALA A 176 -7.228 4.516 -19.577 1.00 4.26 N ATOM 2709 CA ALA A 176 -6.344 4.717 -20.711 1.00 4.89 C ATOM 2710 C ALA A 176 -6.330 6.194 -21.087 1.00 5.36 C ATOM 2711 O ALA A 176 -7.173 6.655 -21.857 1.00 5.78 O ATOM 2712 CB ALA A 176 -6.783 3.862 -21.892 1.00 5.48 C ATOM 0 H ALA A 176 -7.905 5.267 -19.444 1.00 4.26 H new ATOM 0 HA ALA A 176 -5.334 4.411 -20.437 1.00 4.89 H new ATOM 0 HB1 ALA A 176 -6.108 4.027 -22.732 1.00 5.48 H new ATOM 0 HB2 ALA A 176 -6.759 2.810 -21.608 1.00 5.48 H new ATOM 0 HB3 ALA A 176 -7.797 4.136 -22.183 1.00 5.48 H new ATOM 2718 N ASN A 177 -5.396 6.935 -20.509 1.00 5.66 N ATOM 2719 CA ASN A 177 -5.302 8.374 -20.750 1.00 6.40 C ATOM 2720 C ASN A 177 -4.729 8.682 -22.142 1.00 6.79 C ATOM 2721 O ASN A 177 -5.327 9.456 -22.887 1.00 6.94 O ATOM 2722 CB ASN A 177 -4.458 9.064 -19.667 1.00 6.79 C ATOM 2723 CG ASN A 177 -4.964 8.788 -18.262 1.00 7.41 C ATOM 2724 OD1 ASN A 177 -4.539 7.829 -17.615 1.00 7.72 O ATOM 2725 ND2 ASN A 177 -5.871 9.622 -17.774 1.00 7.88 N ATOM 0 H ASN A 177 -4.691 6.567 -19.870 1.00 5.66 H new ATOM 0 HA ASN A 177 -6.317 8.770 -20.707 1.00 6.40 H new ATOM 0 HB2 ASN A 177 -3.425 8.727 -19.749 1.00 6.79 H new ATOM 0 HB3 ASN A 177 -4.458 10.140 -19.843 1.00 6.79 H new ATOM 0 HD21 ASN A 177 -6.240 9.481 -16.834 1.00 7.88 H new ATOM 0 HD22 ASN A 177 -6.200 10.405 -18.339 1.00 7.88 H new ATOM 2732 N PRO A 178 -3.562 8.102 -22.513 1.00 7.29 N ATOM 2733 CA PRO A 178 -2.974 8.308 -23.844 1.00 8.00 C ATOM 2734 C PRO A 178 -3.858 7.754 -24.960 1.00 8.71 C ATOM 2735 O PRO A 178 -4.208 8.521 -25.880 1.00 9.19 O ATOM 2736 CB PRO A 178 -1.644 7.547 -23.787 1.00 8.54 C ATOM 2737 CG PRO A 178 -1.803 6.570 -22.674 1.00 8.16 C ATOM 2738 CD PRO A 178 -2.718 7.225 -21.679 1.00 7.54 C ATOM 2739 OXT PRO A 178 -4.200 6.554 -24.911 1.00 9.00 O ATOM 0 HA PRO A 178 -2.856 9.368 -24.069 1.00 8.00 H new ATOM 0 HB2 PRO A 178 -1.439 7.040 -24.730 1.00 8.54 H new ATOM 0 HB3 PRO A 178 -0.810 8.224 -23.601 1.00 8.54 H new ATOM 0 HG2 PRO A 178 -2.225 5.632 -23.035 1.00 8.16 H new ATOM 0 HG3 PRO A 178 -0.840 6.333 -22.222 1.00 8.16 H new ATOM 0 HD2 PRO A 178 -3.314 6.490 -21.138 1.00 7.54 H new ATOM 0 HD3 PRO A 178 -2.161 7.794 -20.935 1.00 7.54 H new TER 2747 PRO A 178 HETATM 2748 PB GDP A 179 -8.461 -3.327 15.463 1.00 0.68 P HETATM 2749 O1B GDP A 179 -9.722 -3.137 14.685 1.00 1.61 O HETATM 2750 O2B GDP A 179 -7.247 -2.664 14.816 1.00 1.63 O HETATM 2751 O3B GDP A 179 -8.205 -4.765 15.940 1.00 1.65 O HETATM 2752 O3A GDP A 179 -8.706 -2.454 16.860 1.00 0.68 O HETATM 2753 PA GDP A 179 -9.628 -1.217 17.135 1.00 0.75 P HETATM 2754 O1A GDP A 179 -10.197 -1.253 18.506 1.00 0.87 O HETATM 2755 O2A GDP A 179 -10.581 -0.936 15.995 1.00 0.88 O HETATM 2756 O5' GDP A 179 -8.553 -0.021 17.077 1.00 0.69 O HETATM 2757 C5' GDP A 179 -7.245 -0.196 17.616 1.00 0.65 C HETATM 2758 C4' GDP A 179 -6.571 1.142 17.821 1.00 0.66 C HETATM 2759 O4' GDP A 179 -6.298 1.754 16.537 1.00 0.63 O HETATM 2760 C3' GDP A 179 -7.382 2.196 18.571 1.00 0.75 C HETATM 2761 O3' GDP A 179 -6.976 2.262 19.933 1.00 0.96 O HETATM 2762 C2' GDP A 179 -7.101 3.516 17.842 1.00 0.75 C HETATM 2763 O2' GDP A 179 -6.546 4.490 18.705 1.00 0.95 O HETATM 2764 C1' GDP A 179 -6.052 3.111 16.805 1.00 0.62 C HETATM 2765 N9 GDP A 179 -6.114 3.881 15.568 1.00 0.55 N HETATM 2766 C8 GDP A 179 -6.925 3.652 14.483 1.00 0.62 C HETATM 2767 N7 GDP A 179 -6.763 4.521 13.524 1.00 0.61 N HETATM 2768 C5 GDP A 179 -5.783 5.380 14.003 1.00 0.49 C HETATM 2769 C6 GDP A 179 -5.183 6.521 13.401 1.00 0.45 C HETATM 2770 O6 GDP A 179 -5.406 7.012 12.287 1.00 0.55 O HETATM 2771 N1 GDP A 179 -4.225 7.098 14.228 1.00 0.37 N HETATM 2772 C2 GDP A 179 -3.893 6.630 15.480 1.00 0.40 C HETATM 2773 N2 GDP A 179 -2.948 7.312 16.143 1.00 0.46 N HETATM 2774 N3 GDP A 179 -4.445 5.572 16.050 1.00 0.45 N HETATM 2775 C4 GDP A 179 -5.372 4.997 15.259 1.00 0.46 C HETATM 0 HO3' GDP A 179 -7.536 2.909 20.410 1.00 0.96 H new HETATM 0 HO2' GDP A 179 -6.322 4.076 19.565 1.00 0.95 H new HETATM 0 HN22 GDP A 179 -2.661 7.012 17.075 1.00 0.46 H new HETATM 0 HN21 GDP A 179 -2.516 8.131 15.716 1.00 0.46 H new HETATM 0 H5'' GDP A 179 -7.305 -0.728 18.565 1.00 0.65 H new HETATM 0 HN1 GDP A 179 -3.735 7.924 13.884 1.00 0.37 H new HETATM 0 H8 GDP A 179 -7.634 2.826 14.429 1.00 0.62 H new HETATM 0 H5' GDP A 179 -6.648 -0.811 16.943 1.00 0.65 H new HETATM 0 H4' GDP A 179 -5.692 0.888 18.413 1.00 0.66 H new HETATM 0 H3' GDP A 179 -8.447 1.965 18.581 1.00 0.75 H new HETATM 0 H2' GDP A 179 -8.008 3.959 17.429 1.00 0.75 H new HETATM 0 H1' GDP A 179 -5.055 3.302 17.203 1.00 0.62 H new