USER MOD reduce.3.24.130724 H: found=0, std=0, add=636, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 628 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 16 THR OG1 : rot 160:sc= 0.358 USER MOD Set 1.2: A 74 TYR OH : rot 159:sc= 0.472 USER MOD Set 2.1: A 33 LYS NZ :NH3+ -177:sc= 1.1 (180deg=0.00113) USER MOD Set 2.2: A 62 TYR OH : rot 180:sc= 0 USER MOD Set 2.3: A 66 SER OG : rot 128:sc= 1.21 USER MOD Set 3.1: A 47 LYS NZ :NH3+ -165:sc= -0.0434 (180deg=-0.376) USER MOD Set 3.2: A 48 ASN : amide:sc=-0.00116 K(o=-0.045,f=-0.6) USER MOD Set 4.1: A 7 HIS : no HD1:sc= 0 X(o=0,f=0.33) USER MOD Set 4.2: A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl -167:sc=-0.00198 (180deg=-0.222) USER MOD Single : A 1 MET N :NH3+ 143:sc= -0.0161 (180deg=-0.102) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot -75:sc= -0.803 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 67:sc= 1.56 USER MOD Single : A 24 LYS NZ :NH3+ -176:sc= 1.04 (180deg=1.01) USER MOD Single : A 26 ASN : amide:sc= -0.0222 K(o=-0.022,f=-0.94) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.83 USER MOD Single : A 29 GLN : amide:sc= -0.113 K(o=-0.11,f=-0.7) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 HIS : no HD1:sc= -2.06! C(o=-2.1!,f=-6.4!) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 54 LYS NZ :NH3+ -169:sc= -0.0284 (180deg=-0.174) USER MOD Single : A 56 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0459) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 59 SER OG : rot 75:sc= 0.338 USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ -162:sc= -1.3! (180deg=-2.37!) USER MOD Single : A 76 LYS NZ :NH3+ -170:sc= -0.017 (180deg=-0.168) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.192 -5.173 -7.689 1.00 0.00 N ATOM 2 CA MET A 1 2.429 -5.914 -7.345 1.00 0.00 C ATOM 3 C MET A 1 3.423 -5.926 -8.505 1.00 0.00 C ATOM 4 O MET A 1 4.150 -6.902 -8.704 1.00 0.00 O ATOM 5 CB MET A 1 2.109 -7.352 -6.908 1.00 0.00 C ATOM 6 CG MET A 1 1.465 -7.448 -5.532 1.00 0.00 C ATOM 7 SD MET A 1 1.210 -9.157 -4.993 1.00 0.00 S ATOM 8 CE MET A 1 -0.056 -9.691 -6.139 1.00 0.00 C ATOM 0 H1 MET A 1 0.372 -5.647 -7.259 1.00 0.00 H new ATOM 0 H2 MET A 1 1.258 -4.200 -7.327 1.00 0.00 H new ATOM 0 H3 MET A 1 1.077 -5.151 -8.722 1.00 0.00 H new ATOM 0 HA MET A 1 2.892 -5.389 -6.509 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.443 -7.805 -7.643 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.030 -7.935 -6.909 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.093 -6.933 -4.805 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.506 -6.930 -5.548 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.483 -10.634 -5.796 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.840 -8.936 -6.193 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.383 -9.829 -7.127 1.00 0.00 H new ATOM 20 N GLY A 2 3.461 -4.840 -9.269 1.00 0.00 N ATOM 21 CA GLY A 2 4.419 -4.729 -10.354 1.00 0.00 C ATOM 22 C GLY A 2 3.966 -5.398 -11.635 1.00 0.00 C ATOM 23 O GLY A 2 4.761 -5.596 -12.541 1.00 0.00 O ATOM 0 H GLY A 2 2.846 -4.034 -9.157 1.00 0.00 H new ATOM 0 HA2 GLY A 2 4.609 -3.674 -10.553 1.00 0.00 H new ATOM 0 HA3 GLY A 2 5.365 -5.170 -10.039 1.00 0.00 H new ATOM 27 N HIS A 3 2.695 -5.763 -11.709 1.00 0.00 N ATOM 28 CA HIS A 3 2.165 -6.380 -12.925 1.00 0.00 C ATOM 29 C HIS A 3 2.005 -5.339 -14.014 1.00 0.00 C ATOM 30 O HIS A 3 2.466 -5.525 -15.140 1.00 0.00 O ATOM 31 CB HIS A 3 0.828 -7.076 -12.654 1.00 0.00 C ATOM 32 CG HIS A 3 0.958 -8.378 -11.919 1.00 0.00 C ATOM 33 ND1 HIS A 3 0.347 -9.543 -12.338 1.00 0.00 N ATOM 34 CD2 HIS A 3 1.623 -8.694 -10.783 1.00 0.00 C ATOM 35 CE1 HIS A 3 0.631 -10.516 -11.487 1.00 0.00 C ATOM 36 NE2 HIS A 3 1.403 -10.027 -10.539 1.00 0.00 N ATOM 0 H HIS A 3 2.017 -5.647 -10.956 1.00 0.00 H new ATOM 0 HA HIS A 3 2.876 -7.135 -13.259 1.00 0.00 H new ATOM 0 HB2 HIS A 3 0.191 -6.406 -12.076 1.00 0.00 H new ATOM 0 HB3 HIS A 3 0.324 -7.255 -13.604 1.00 0.00 H new ATOM 0 HD2 HIS A 3 2.216 -8.022 -10.181 1.00 0.00 H new ATOM 0 HE1 HIS A 3 0.288 -11.538 -11.558 1.00 0.00 H new ATOM 0 HE2 HIS A 3 1.777 -10.554 -9.750 1.00 0.00 H new ATOM 44 N HIS A 4 1.375 -4.230 -13.663 1.00 0.00 N ATOM 45 CA HIS A 4 1.158 -3.140 -14.598 1.00 0.00 C ATOM 46 C HIS A 4 0.814 -1.864 -13.842 1.00 0.00 C ATOM 47 O HIS A 4 0.382 -1.923 -12.697 1.00 0.00 O ATOM 48 CB HIS A 4 0.045 -3.487 -15.609 1.00 0.00 C ATOM 49 CG HIS A 4 -1.313 -3.682 -14.999 1.00 0.00 C ATOM 50 ND1 HIS A 4 -1.770 -4.899 -14.547 1.00 0.00 N ATOM 51 CD2 HIS A 4 -2.318 -2.799 -14.767 1.00 0.00 C ATOM 52 CE1 HIS A 4 -2.989 -4.755 -14.067 1.00 0.00 C ATOM 53 NE2 HIS A 4 -3.343 -3.492 -14.186 1.00 0.00 N ATOM 0 H HIS A 4 1.002 -4.061 -12.729 1.00 0.00 H new ATOM 0 HA HIS A 4 2.079 -2.981 -15.158 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -0.015 -2.691 -16.351 1.00 0.00 H new ATOM 0 HB3 HIS A 4 0.325 -4.397 -16.140 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -2.309 -1.744 -14.999 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -3.597 -5.542 -13.646 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -4.236 -3.096 -13.893 1.00 0.00 H new ATOM 61 N HIS A 5 0.988 -0.730 -14.490 1.00 0.00 N ATOM 62 CA HIS A 5 0.674 0.553 -13.880 1.00 0.00 C ATOM 63 C HIS A 5 -0.643 1.088 -14.429 1.00 0.00 C ATOM 64 O HIS A 5 -0.982 0.857 -15.592 1.00 0.00 O ATOM 65 CB HIS A 5 1.804 1.567 -14.114 1.00 0.00 C ATOM 66 CG HIS A 5 3.070 1.246 -13.368 1.00 0.00 C ATOM 67 ND1 HIS A 5 3.311 1.669 -12.077 1.00 0.00 N ATOM 68 CD2 HIS A 5 4.167 0.543 -13.741 1.00 0.00 C ATOM 69 CE1 HIS A 5 4.500 1.246 -11.690 1.00 0.00 C ATOM 70 NE2 HIS A 5 5.038 0.560 -12.680 1.00 0.00 N ATOM 0 H HIS A 5 1.346 -0.667 -15.443 1.00 0.00 H new ATOM 0 HA HIS A 5 0.573 0.404 -12.805 1.00 0.00 H new ATOM 0 HB2 HIS A 5 2.023 1.613 -15.181 1.00 0.00 H new ATOM 0 HB3 HIS A 5 1.459 2.557 -13.816 1.00 0.00 H new ATOM 0 HD2 HIS A 5 4.326 0.060 -14.694 1.00 0.00 H new ATOM 0 HE1 HIS A 5 4.954 1.430 -10.728 1.00 0.00 H new ATOM 0 HE2 HIS A 5 5.955 0.113 -12.660 1.00 0.00 H new ATOM 78 N HIS A 6 -1.390 1.787 -13.582 1.00 0.00 N ATOM 79 CA HIS A 6 -2.697 2.326 -13.964 1.00 0.00 C ATOM 80 C HIS A 6 -2.569 3.395 -15.045 1.00 0.00 C ATOM 81 O HIS A 6 -3.274 3.358 -16.053 1.00 0.00 O ATOM 82 CB HIS A 6 -3.412 2.910 -12.741 1.00 0.00 C ATOM 83 CG HIS A 6 -3.752 1.896 -11.689 1.00 0.00 C ATOM 84 ND1 HIS A 6 -2.983 1.696 -10.561 1.00 0.00 N ATOM 85 CD2 HIS A 6 -4.784 1.034 -11.588 1.00 0.00 C ATOM 86 CE1 HIS A 6 -3.530 0.758 -9.813 1.00 0.00 C ATOM 87 NE2 HIS A 6 -4.624 0.338 -10.411 1.00 0.00 N ATOM 0 H HIS A 6 -1.115 1.996 -12.622 1.00 0.00 H new ATOM 0 HA HIS A 6 -3.285 1.502 -14.368 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -2.781 3.680 -12.298 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -4.329 3.399 -13.069 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -5.588 0.912 -12.299 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -3.146 0.396 -8.871 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -5.251 -0.385 -10.060 1.00 0.00 H new ATOM 95 N HIS A 7 -1.657 4.333 -14.841 1.00 0.00 N ATOM 96 CA HIS A 7 -1.447 5.404 -15.804 1.00 0.00 C ATOM 97 C HIS A 7 -0.026 5.939 -15.714 1.00 0.00 C ATOM 98 O HIS A 7 0.385 6.468 -14.684 1.00 0.00 O ATOM 99 CB HIS A 7 -2.453 6.544 -15.570 1.00 0.00 C ATOM 100 CG HIS A 7 -2.414 7.613 -16.618 1.00 0.00 C ATOM 101 ND1 HIS A 7 -1.854 8.856 -16.412 1.00 0.00 N ATOM 102 CD2 HIS A 7 -2.870 7.618 -17.891 1.00 0.00 C ATOM 103 CE1 HIS A 7 -1.970 9.577 -17.515 1.00 0.00 C ATOM 104 NE2 HIS A 7 -2.582 8.845 -18.426 1.00 0.00 N ATOM 0 H HIS A 7 -1.052 4.375 -14.021 1.00 0.00 H new ATOM 0 HA HIS A 7 -1.603 4.996 -16.803 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -3.459 6.125 -15.529 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -2.256 6.995 -14.597 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -3.370 6.803 -18.394 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -1.623 10.591 -17.647 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -2.805 9.145 -19.375 1.00 0.00 H new ATOM 112 N HIS A 8 0.715 5.789 -16.784 1.00 0.00 N ATOM 113 CA HIS A 8 2.077 6.281 -16.852 1.00 0.00 C ATOM 114 C HIS A 8 2.338 6.846 -18.237 1.00 0.00 C ATOM 115 O HIS A 8 2.370 6.103 -19.216 1.00 0.00 O ATOM 116 CB HIS A 8 3.075 5.162 -16.530 1.00 0.00 C ATOM 117 CG HIS A 8 4.510 5.604 -16.553 1.00 0.00 C ATOM 118 ND1 HIS A 8 5.146 6.146 -15.457 1.00 0.00 N ATOM 119 CD2 HIS A 8 5.429 5.588 -17.544 1.00 0.00 C ATOM 120 CE1 HIS A 8 6.390 6.442 -15.770 1.00 0.00 C ATOM 121 NE2 HIS A 8 6.587 6.114 -17.030 1.00 0.00 N ATOM 0 H HIS A 8 0.395 5.324 -17.634 1.00 0.00 H new ATOM 0 HA HIS A 8 2.209 7.069 -16.111 1.00 0.00 H new ATOM 0 HB2 HIS A 8 2.846 4.756 -15.545 1.00 0.00 H new ATOM 0 HB3 HIS A 8 2.942 4.352 -17.248 1.00 0.00 H new ATOM 0 HD2 HIS A 8 5.280 5.229 -18.551 1.00 0.00 H new ATOM 0 HE1 HIS A 8 7.123 6.879 -15.108 1.00 0.00 H new ATOM 0 HE2 HIS A 8 7.461 6.232 -17.542 1.00 0.00 H new ATOM 129 N SER A 9 2.533 8.146 -18.323 1.00 0.00 N ATOM 130 CA SER A 9 2.734 8.787 -19.608 1.00 0.00 C ATOM 131 C SER A 9 3.774 9.904 -19.530 1.00 0.00 C ATOM 132 O SER A 9 4.128 10.372 -18.444 1.00 0.00 O ATOM 133 CB SER A 9 1.398 9.345 -20.114 1.00 0.00 C ATOM 134 OG SER A 9 0.781 10.169 -19.126 1.00 0.00 O ATOM 0 H SER A 9 2.557 8.778 -17.523 1.00 0.00 H new ATOM 0 HA SER A 9 3.112 8.038 -20.305 1.00 0.00 H new ATOM 0 HB2 SER A 9 1.562 9.923 -21.024 1.00 0.00 H new ATOM 0 HB3 SER A 9 0.732 8.523 -20.375 1.00 0.00 H new ATOM 0 HG SER A 9 -0.068 10.514 -19.472 1.00 0.00 H new ATOM 140 N HIS A 10 4.273 10.298 -20.694 1.00 0.00 N ATOM 141 CA HIS A 10 5.214 11.395 -20.815 1.00 0.00 C ATOM 142 C HIS A 10 5.037 12.062 -22.177 1.00 0.00 C ATOM 143 O HIS A 10 5.618 11.628 -23.167 1.00 0.00 O ATOM 144 CB HIS A 10 6.668 10.904 -20.641 1.00 0.00 C ATOM 145 CG HIS A 10 7.714 11.990 -20.750 1.00 0.00 C ATOM 146 ND1 HIS A 10 8.648 12.037 -21.765 1.00 0.00 N ATOM 147 CD2 HIS A 10 7.974 13.062 -19.962 1.00 0.00 C ATOM 148 CE1 HIS A 10 9.435 13.088 -21.597 1.00 0.00 C ATOM 149 NE2 HIS A 10 9.045 13.722 -20.514 1.00 0.00 N ATOM 0 H HIS A 10 4.033 9.861 -21.584 1.00 0.00 H new ATOM 0 HA HIS A 10 5.013 12.119 -20.025 1.00 0.00 H new ATOM 0 HB2 HIS A 10 6.762 10.423 -19.667 1.00 0.00 H new ATOM 0 HB3 HIS A 10 6.873 10.142 -21.393 1.00 0.00 H new ATOM 0 HD2 HIS A 10 7.439 13.344 -19.067 1.00 0.00 H new ATOM 0 HE1 HIS A 10 10.255 13.375 -22.239 1.00 0.00 H new ATOM 0 HE2 HIS A 10 9.471 14.571 -20.142 1.00 0.00 H new ATOM 157 N MET A 11 4.190 13.075 -22.226 1.00 0.00 N ATOM 158 CA MET A 11 3.953 13.810 -23.454 1.00 0.00 C ATOM 159 C MET A 11 4.924 14.953 -23.592 1.00 0.00 C ATOM 160 O MET A 11 5.290 15.593 -22.602 1.00 0.00 O ATOM 161 CB MET A 11 2.518 14.320 -23.541 1.00 0.00 C ATOM 162 CG MET A 11 1.485 13.233 -23.763 1.00 0.00 C ATOM 163 SD MET A 11 -0.189 13.890 -23.890 1.00 0.00 S ATOM 164 CE MET A 11 -1.123 12.377 -24.097 1.00 0.00 C ATOM 0 H MET A 11 3.653 13.408 -21.425 1.00 0.00 H new ATOM 0 HA MET A 11 4.110 13.116 -24.280 1.00 0.00 H new ATOM 0 HB2 MET A 11 2.277 14.852 -22.621 1.00 0.00 H new ATOM 0 HB3 MET A 11 2.450 15.042 -24.354 1.00 0.00 H new ATOM 0 HG2 MET A 11 1.728 12.686 -24.674 1.00 0.00 H new ATOM 0 HG3 MET A 11 1.531 12.519 -22.941 1.00 0.00 H new ATOM 0 HE1 MET A 11 -2.183 12.614 -24.190 1.00 0.00 H new ATOM 0 HE2 MET A 11 -0.786 11.861 -24.996 1.00 0.00 H new ATOM 0 HE3 MET A 11 -0.970 11.733 -23.231 1.00 0.00 H new ATOM 174 N VAL A 12 5.351 15.203 -24.811 1.00 0.00 N ATOM 175 CA VAL A 12 6.303 16.252 -25.069 1.00 0.00 C ATOM 176 C VAL A 12 5.618 17.575 -25.413 1.00 0.00 C ATOM 177 O VAL A 12 5.047 17.746 -26.497 1.00 0.00 O ATOM 178 CB VAL A 12 7.326 15.844 -26.172 1.00 0.00 C ATOM 179 CG1 VAL A 12 6.623 15.328 -27.419 1.00 0.00 C ATOM 180 CG2 VAL A 12 8.255 16.999 -26.521 1.00 0.00 C ATOM 0 H VAL A 12 5.050 14.690 -25.639 1.00 0.00 H new ATOM 0 HA VAL A 12 6.859 16.405 -24.144 1.00 0.00 H new ATOM 0 HB VAL A 12 7.931 15.033 -25.766 1.00 0.00 H new ATOM 0 HG11 VAL A 12 7.366 15.053 -28.168 1.00 0.00 H new ATOM 0 HG12 VAL A 12 6.024 14.454 -27.164 1.00 0.00 H new ATOM 0 HG13 VAL A 12 5.975 16.107 -27.820 1.00 0.00 H new ATOM 0 HG21 VAL A 12 8.956 16.682 -27.293 1.00 0.00 H new ATOM 0 HG22 VAL A 12 7.667 17.840 -26.888 1.00 0.00 H new ATOM 0 HG23 VAL A 12 8.808 17.303 -25.632 1.00 0.00 H new ATOM 190 N LYS A 13 5.658 18.498 -24.470 1.00 0.00 N ATOM 191 CA LYS A 13 5.112 19.817 -24.673 1.00 0.00 C ATOM 192 C LYS A 13 6.177 20.835 -24.350 1.00 0.00 C ATOM 193 O LYS A 13 6.278 21.304 -23.211 1.00 0.00 O ATOM 194 CB LYS A 13 3.867 20.042 -23.803 1.00 0.00 C ATOM 195 CG LYS A 13 2.699 19.127 -24.140 1.00 0.00 C ATOM 196 CD LYS A 13 1.468 19.479 -23.303 1.00 0.00 C ATOM 197 CE LYS A 13 0.246 18.643 -23.689 1.00 0.00 C ATOM 198 NZ LYS A 13 0.404 17.209 -23.347 1.00 0.00 N ATOM 0 H LYS A 13 6.069 18.351 -23.548 1.00 0.00 H new ATOM 0 HA LYS A 13 4.803 19.922 -25.713 1.00 0.00 H new ATOM 0 HB2 LYS A 13 4.137 19.898 -22.757 1.00 0.00 H new ATOM 0 HB3 LYS A 13 3.545 21.078 -23.909 1.00 0.00 H new ATOM 0 HG2 LYS A 13 2.459 19.213 -25.200 1.00 0.00 H new ATOM 0 HG3 LYS A 13 2.981 18.090 -23.960 1.00 0.00 H new ATOM 0 HD2 LYS A 13 1.693 19.325 -22.248 1.00 0.00 H new ATOM 0 HD3 LYS A 13 1.236 20.537 -23.428 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -0.635 19.038 -23.183 1.00 0.00 H new ATOM 0 HE3 LYS A 13 0.068 18.740 -24.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -0.451 16.689 -23.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 1.227 16.821 -23.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 0.547 17.110 -22.322 1.00 0.00 H new ATOM 212 N GLU A 14 6.990 21.152 -25.362 1.00 0.00 N ATOM 213 CA GLU A 14 8.121 22.059 -25.214 1.00 0.00 C ATOM 214 C GLU A 14 9.033 21.602 -24.074 1.00 0.00 C ATOM 215 O GLU A 14 9.020 22.174 -22.972 1.00 0.00 O ATOM 216 CB GLU A 14 7.655 23.485 -24.976 1.00 0.00 C ATOM 217 CG GLU A 14 8.789 24.480 -24.862 1.00 0.00 C ATOM 218 CD GLU A 14 8.305 25.870 -24.535 1.00 0.00 C ATOM 219 OE1 GLU A 14 7.978 26.626 -25.472 1.00 0.00 O ATOM 220 OE2 GLU A 14 8.251 26.216 -23.337 1.00 0.00 O ATOM 0 H GLU A 14 6.878 20.784 -26.307 1.00 0.00 H new ATOM 0 HA GLU A 14 8.687 22.038 -26.145 1.00 0.00 H new ATOM 0 HB2 GLU A 14 6.999 23.786 -25.793 1.00 0.00 H new ATOM 0 HB3 GLU A 14 7.061 23.517 -24.063 1.00 0.00 H new ATOM 0 HG2 GLU A 14 9.483 24.149 -24.089 1.00 0.00 H new ATOM 0 HG3 GLU A 14 9.344 24.503 -25.800 1.00 0.00 H new ATOM 227 N THR A 15 9.795 20.563 -24.310 1.00 0.00 N ATOM 228 CA THR A 15 10.642 20.057 -23.298 1.00 0.00 C ATOM 229 C THR A 15 11.940 20.826 -23.232 1.00 0.00 C ATOM 230 O THR A 15 12.873 20.595 -24.005 1.00 0.00 O ATOM 231 CB THR A 15 10.923 18.597 -23.505 1.00 0.00 C ATOM 232 OG1 THR A 15 9.685 17.880 -23.623 1.00 0.00 O ATOM 233 CG2 THR A 15 11.723 18.048 -22.356 1.00 0.00 C ATOM 0 H THR A 15 9.835 20.062 -25.198 1.00 0.00 H new ATOM 0 HA THR A 15 10.118 20.180 -22.350 1.00 0.00 H new ATOM 0 HB THR A 15 11.501 18.476 -24.421 1.00 0.00 H new ATOM 0 HG1 THR A 15 9.268 17.799 -22.740 1.00 0.00 H new ATOM 0 HG21 THR A 15 11.918 16.988 -22.522 1.00 0.00 H new ATOM 0 HG22 THR A 15 12.669 18.584 -22.283 1.00 0.00 H new ATOM 0 HG23 THR A 15 11.162 18.173 -21.430 1.00 0.00 H new ATOM 241 N THR A 16 11.972 21.745 -22.318 1.00 0.00 N ATOM 242 CA THR A 16 13.134 22.547 -22.078 1.00 0.00 C ATOM 243 C THR A 16 13.971 21.923 -20.978 1.00 0.00 C ATOM 244 O THR A 16 13.611 20.883 -20.446 1.00 0.00 O ATOM 245 CB THR A 16 12.754 24.019 -21.730 1.00 0.00 C ATOM 246 OG1 THR A 16 13.924 24.812 -21.508 1.00 0.00 O ATOM 247 CG2 THR A 16 11.852 24.085 -20.505 1.00 0.00 C ATOM 0 H THR A 16 11.183 21.963 -21.709 1.00 0.00 H new ATOM 0 HA THR A 16 13.724 22.579 -22.994 1.00 0.00 H new ATOM 0 HB THR A 16 12.210 24.421 -22.585 1.00 0.00 H new ATOM 0 HG1 THR A 16 13.700 25.761 -21.610 1.00 0.00 H new ATOM 0 HG21 THR A 16 11.606 25.125 -20.290 1.00 0.00 H new ATOM 0 HG22 THR A 16 10.935 23.528 -20.698 1.00 0.00 H new ATOM 0 HG23 THR A 16 12.368 23.650 -19.649 1.00 0.00 H new ATOM 255 N TYR A 17 15.070 22.562 -20.634 1.00 0.00 N ATOM 256 CA TYR A 17 15.952 22.054 -19.581 1.00 0.00 C ATOM 257 C TYR A 17 15.204 21.967 -18.276 1.00 0.00 C ATOM 258 O TYR A 17 15.442 21.075 -17.475 1.00 0.00 O ATOM 259 CB TYR A 17 17.187 22.938 -19.431 1.00 0.00 C ATOM 260 CG TYR A 17 18.151 22.846 -20.602 1.00 0.00 C ATOM 261 CD1 TYR A 17 18.670 21.621 -21.007 1.00 0.00 C ATOM 262 CD2 TYR A 17 18.535 23.978 -21.299 1.00 0.00 C ATOM 263 CE1 TYR A 17 19.545 21.531 -22.072 1.00 0.00 C ATOM 264 CE2 TYR A 17 19.417 23.895 -22.369 1.00 0.00 C ATOM 265 CZ TYR A 17 19.915 22.669 -22.748 1.00 0.00 C ATOM 266 OH TYR A 17 20.795 22.581 -23.813 1.00 0.00 O ATOM 0 H TYR A 17 15.381 23.434 -21.062 1.00 0.00 H new ATOM 0 HA TYR A 17 16.285 21.055 -19.863 1.00 0.00 H new ATOM 0 HB2 TYR A 17 16.869 23.974 -19.314 1.00 0.00 H new ATOM 0 HB3 TYR A 17 17.712 22.661 -18.517 1.00 0.00 H new ATOM 0 HD1 TYR A 17 18.384 20.723 -20.479 1.00 0.00 H new ATOM 0 HD2 TYR A 17 18.143 24.941 -21.007 1.00 0.00 H new ATOM 0 HE1 TYR A 17 19.937 20.570 -22.372 1.00 0.00 H new ATOM 0 HE2 TYR A 17 19.711 24.788 -22.901 1.00 0.00 H new ATOM 0 HH TYR A 17 20.952 23.475 -24.182 1.00 0.00 H new ATOM 276 N TYR A 18 14.277 22.872 -18.086 1.00 0.00 N ATOM 277 CA TYR A 18 13.458 22.879 -16.917 1.00 0.00 C ATOM 278 C TYR A 18 12.511 21.680 -16.950 1.00 0.00 C ATOM 279 O TYR A 18 12.262 21.046 -15.935 1.00 0.00 O ATOM 280 CB TYR A 18 12.674 24.177 -16.872 1.00 0.00 C ATOM 281 CG TYR A 18 13.519 25.417 -16.619 1.00 0.00 C ATOM 282 CD1 TYR A 18 14.562 25.780 -17.480 1.00 0.00 C ATOM 283 CD2 TYR A 18 13.255 26.240 -15.535 1.00 0.00 C ATOM 284 CE1 TYR A 18 15.301 26.922 -17.257 1.00 0.00 C ATOM 285 CE2 TYR A 18 13.996 27.380 -15.304 1.00 0.00 C ATOM 286 CZ TYR A 18 15.015 27.717 -16.169 1.00 0.00 C ATOM 287 OH TYR A 18 15.745 28.853 -15.945 1.00 0.00 O ATOM 0 H TYR A 18 14.074 23.624 -18.745 1.00 0.00 H new ATOM 0 HA TYR A 18 14.078 22.806 -16.023 1.00 0.00 H new ATOM 0 HB2 TYR A 18 12.145 24.300 -17.817 1.00 0.00 H new ATOM 0 HB3 TYR A 18 11.918 24.103 -16.091 1.00 0.00 H new ATOM 0 HD1 TYR A 18 14.791 25.156 -18.331 1.00 0.00 H new ATOM 0 HD2 TYR A 18 12.453 25.983 -14.858 1.00 0.00 H new ATOM 0 HE1 TYR A 18 16.100 27.192 -17.932 1.00 0.00 H new ATOM 0 HE2 TYR A 18 13.779 28.005 -14.450 1.00 0.00 H new ATOM 0 HH TYR A 18 15.572 29.499 -16.661 1.00 0.00 H new ATOM 297 N ASP A 19 12.002 21.375 -18.142 1.00 0.00 N ATOM 298 CA ASP A 19 11.096 20.244 -18.353 1.00 0.00 C ATOM 299 C ASP A 19 11.839 18.913 -18.160 1.00 0.00 C ATOM 300 O ASP A 19 11.331 17.989 -17.525 1.00 0.00 O ATOM 301 CB ASP A 19 10.480 20.317 -19.765 1.00 0.00 C ATOM 302 CG ASP A 19 9.269 19.409 -19.927 1.00 0.00 C ATOM 303 OD1 ASP A 19 8.157 19.837 -19.554 1.00 0.00 O ATOM 304 OD2 ASP A 19 9.412 18.287 -20.437 1.00 0.00 O ATOM 0 H ASP A 19 12.205 21.904 -18.990 1.00 0.00 H new ATOM 0 HA ASP A 19 10.294 20.297 -17.616 1.00 0.00 H new ATOM 0 HB2 ASP A 19 10.188 21.346 -19.977 1.00 0.00 H new ATOM 0 HB3 ASP A 19 11.236 20.042 -20.501 1.00 0.00 H new ATOM 309 N VAL A 20 13.046 18.838 -18.717 1.00 0.00 N ATOM 310 CA VAL A 20 13.908 17.660 -18.595 1.00 0.00 C ATOM 311 C VAL A 20 14.252 17.406 -17.142 1.00 0.00 C ATOM 312 O VAL A 20 14.192 16.278 -16.654 1.00 0.00 O ATOM 313 CB VAL A 20 15.234 17.863 -19.367 1.00 0.00 C ATOM 314 CG1 VAL A 20 16.158 16.683 -19.186 1.00 0.00 C ATOM 315 CG2 VAL A 20 14.972 18.107 -20.825 1.00 0.00 C ATOM 0 H VAL A 20 13.456 19.593 -19.267 1.00 0.00 H new ATOM 0 HA VAL A 20 13.362 16.813 -19.011 1.00 0.00 H new ATOM 0 HB VAL A 20 15.726 18.743 -18.953 1.00 0.00 H new ATOM 0 HG11 VAL A 20 17.081 16.855 -19.740 1.00 0.00 H new ATOM 0 HG12 VAL A 20 16.388 16.560 -18.128 1.00 0.00 H new ATOM 0 HG13 VAL A 20 15.673 15.781 -19.559 1.00 0.00 H new ATOM 0 HG21 VAL A 20 15.919 18.247 -21.346 1.00 0.00 H new ATOM 0 HG22 VAL A 20 14.447 17.251 -21.249 1.00 0.00 H new ATOM 0 HG23 VAL A 20 14.359 19.001 -20.940 1.00 0.00 H new ATOM 325 N LEU A 21 14.583 18.476 -16.455 1.00 0.00 N ATOM 326 CA LEU A 21 15.001 18.403 -15.069 1.00 0.00 C ATOM 327 C LEU A 21 13.773 18.340 -14.161 1.00 0.00 C ATOM 328 O LEU A 21 13.886 18.164 -12.954 1.00 0.00 O ATOM 329 CB LEU A 21 15.872 19.625 -14.736 1.00 0.00 C ATOM 330 CG LEU A 21 16.854 19.460 -13.580 1.00 0.00 C ATOM 331 CD1 LEU A 21 17.935 18.448 -13.923 1.00 0.00 C ATOM 332 CD2 LEU A 21 17.476 20.791 -13.214 1.00 0.00 C ATOM 0 H LEU A 21 14.571 19.421 -16.839 1.00 0.00 H new ATOM 0 HA LEU A 21 15.590 17.501 -14.906 1.00 0.00 H new ATOM 0 HB2 LEU A 21 16.436 19.896 -15.628 1.00 0.00 H new ATOM 0 HB3 LEU A 21 15.213 20.463 -14.508 1.00 0.00 H new ATOM 0 HG LEU A 21 16.299 19.087 -12.719 1.00 0.00 H new ATOM 0 HD11 LEU A 21 18.621 18.350 -13.082 1.00 0.00 H new ATOM 0 HD12 LEU A 21 17.476 17.482 -14.132 1.00 0.00 H new ATOM 0 HD13 LEU A 21 18.484 18.786 -14.802 1.00 0.00 H new ATOM 0 HD21 LEU A 21 18.173 20.652 -12.388 1.00 0.00 H new ATOM 0 HD22 LEU A 21 18.010 21.192 -14.075 1.00 0.00 H new ATOM 0 HD23 LEU A 21 16.693 21.488 -12.915 1.00 0.00 H new ATOM 344 N GLY A 22 12.593 18.470 -14.771 1.00 0.00 N ATOM 345 CA GLY A 22 11.355 18.359 -14.037 1.00 0.00 C ATOM 346 C GLY A 22 11.214 19.410 -12.960 1.00 0.00 C ATOM 347 O GLY A 22 10.659 19.143 -11.885 1.00 0.00 O ATOM 0 H GLY A 22 12.481 18.652 -15.768 1.00 0.00 H new ATOM 0 HA2 GLY A 22 10.518 18.442 -14.731 1.00 0.00 H new ATOM 0 HA3 GLY A 22 11.295 17.370 -13.583 1.00 0.00 H new ATOM 351 N VAL A 23 11.695 20.600 -13.245 1.00 0.00 N ATOM 352 CA VAL A 23 11.686 21.664 -12.280 1.00 0.00 C ATOM 353 C VAL A 23 10.792 22.808 -12.763 1.00 0.00 C ATOM 354 O VAL A 23 10.355 22.820 -13.919 1.00 0.00 O ATOM 355 CB VAL A 23 13.128 22.178 -12.013 1.00 0.00 C ATOM 356 CG1 VAL A 23 13.527 23.292 -12.963 1.00 0.00 C ATOM 357 CG2 VAL A 23 13.316 22.576 -10.563 1.00 0.00 C ATOM 0 H VAL A 23 12.100 20.851 -14.147 1.00 0.00 H new ATOM 0 HA VAL A 23 11.284 21.276 -11.344 1.00 0.00 H new ATOM 0 HB VAL A 23 13.804 21.346 -12.212 1.00 0.00 H new ATOM 0 HG11 VAL A 23 14.542 23.617 -12.736 1.00 0.00 H new ATOM 0 HG12 VAL A 23 13.483 22.928 -13.989 1.00 0.00 H new ATOM 0 HG13 VAL A 23 12.842 24.132 -12.847 1.00 0.00 H new ATOM 0 HG21 VAL A 23 14.336 22.931 -10.412 1.00 0.00 H new ATOM 0 HG22 VAL A 23 12.614 23.371 -10.310 1.00 0.00 H new ATOM 0 HG23 VAL A 23 13.133 21.713 -9.922 1.00 0.00 H new ATOM 367 N LYS A 24 10.513 23.750 -11.879 1.00 0.00 N ATOM 368 CA LYS A 24 9.656 24.873 -12.196 1.00 0.00 C ATOM 369 C LYS A 24 10.454 25.968 -12.899 1.00 0.00 C ATOM 370 O LYS A 24 11.665 26.065 -12.736 1.00 0.00 O ATOM 371 CB LYS A 24 9.024 25.464 -10.912 1.00 0.00 C ATOM 372 CG LYS A 24 8.155 24.509 -10.076 1.00 0.00 C ATOM 373 CD LYS A 24 8.963 23.381 -9.446 1.00 0.00 C ATOM 374 CE LYS A 24 8.162 22.628 -8.397 1.00 0.00 C ATOM 375 NZ LYS A 24 8.040 23.402 -7.139 1.00 0.00 N ATOM 0 H LYS A 24 10.874 23.756 -10.925 1.00 0.00 H new ATOM 0 HA LYS A 24 8.866 24.511 -12.854 1.00 0.00 H new ATOM 0 HB2 LYS A 24 9.827 25.839 -10.277 1.00 0.00 H new ATOM 0 HB3 LYS A 24 8.414 26.322 -11.195 1.00 0.00 H new ATOM 0 HG2 LYS A 24 7.653 25.074 -9.290 1.00 0.00 H new ATOM 0 HG3 LYS A 24 7.377 24.083 -10.709 1.00 0.00 H new ATOM 0 HD2 LYS A 24 9.286 22.688 -10.223 1.00 0.00 H new ATOM 0 HD3 LYS A 24 9.864 23.791 -8.990 1.00 0.00 H new ATOM 0 HE2 LYS A 24 7.168 22.408 -8.787 1.00 0.00 H new ATOM 0 HE3 LYS A 24 8.642 21.671 -8.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 7.546 22.829 -6.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 8.988 23.648 -6.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 7.500 24.273 -7.318 1.00 0.00 H new ATOM 389 N PRO A 25 9.780 26.812 -13.680 1.00 0.00 N ATOM 390 CA PRO A 25 10.408 27.945 -14.364 1.00 0.00 C ATOM 391 C PRO A 25 10.856 29.012 -13.370 1.00 0.00 C ATOM 392 O PRO A 25 11.646 29.890 -13.685 1.00 0.00 O ATOM 393 CB PRO A 25 9.303 28.487 -15.286 1.00 0.00 C ATOM 394 CG PRO A 25 8.226 27.446 -15.271 1.00 0.00 C ATOM 395 CD PRO A 25 8.345 26.735 -13.963 1.00 0.00 C ATOM 0 HA PRO A 25 11.305 27.652 -14.909 1.00 0.00 H new ATOM 0 HB2 PRO A 25 8.928 29.446 -14.928 1.00 0.00 H new ATOM 0 HB3 PRO A 25 9.679 28.649 -16.296 1.00 0.00 H new ATOM 0 HG2 PRO A 25 7.242 27.903 -15.376 1.00 0.00 H new ATOM 0 HG3 PRO A 25 8.345 26.752 -16.103 1.00 0.00 H new ATOM 0 HD2 PRO A 25 7.753 27.218 -13.185 1.00 0.00 H new ATOM 0 HD3 PRO A 25 8.001 25.703 -14.031 1.00 0.00 H new ATOM 403 N ASN A 26 10.342 28.904 -12.159 1.00 0.00 N ATOM 404 CA ASN A 26 10.630 29.841 -11.097 1.00 0.00 C ATOM 405 C ASN A 26 11.392 29.138 -9.995 1.00 0.00 C ATOM 406 O ASN A 26 11.392 29.570 -8.840 1.00 0.00 O ATOM 407 CB ASN A 26 9.333 30.444 -10.563 1.00 0.00 C ATOM 408 CG ASN A 26 8.717 31.450 -11.515 1.00 0.00 C ATOM 409 OD1 ASN A 26 9.421 32.158 -12.223 1.00 0.00 O ATOM 410 ND2 ASN A 26 7.394 31.506 -11.549 1.00 0.00 N ATOM 0 H ASN A 26 9.707 28.154 -11.885 1.00 0.00 H new ATOM 0 HA ASN A 26 11.246 30.652 -11.485 1.00 0.00 H new ATOM 0 HB2 ASN A 26 8.617 29.644 -10.374 1.00 0.00 H new ATOM 0 HB3 ASN A 26 9.530 30.929 -9.607 1.00 0.00 H new ATOM 0 HD21 ASN A 26 6.927 32.156 -12.181 1.00 0.00 H new ATOM 0 HD22 ASN A 26 6.842 30.899 -10.943 1.00 0.00 H new ATOM 417 N ALA A 27 12.027 28.033 -10.360 1.00 0.00 N ATOM 418 CA ALA A 27 12.784 27.243 -9.435 1.00 0.00 C ATOM 419 C ALA A 27 14.058 27.940 -9.008 1.00 0.00 C ATOM 420 O ALA A 27 14.669 28.685 -9.774 1.00 0.00 O ATOM 421 CB ALA A 27 13.078 25.907 -10.053 1.00 0.00 C ATOM 0 H ALA A 27 12.024 27.669 -11.313 1.00 0.00 H new ATOM 0 HA ALA A 27 12.191 27.101 -8.532 1.00 0.00 H new ATOM 0 HB1 ALA A 27 13.654 25.301 -9.353 1.00 0.00 H new ATOM 0 HB2 ALA A 27 12.142 25.400 -10.286 1.00 0.00 H new ATOM 0 HB3 ALA A 27 13.652 26.048 -10.969 1.00 0.00 H new ATOM 427 N THR A 28 14.443 27.688 -7.785 1.00 0.00 N ATOM 428 CA THR A 28 15.616 28.292 -7.202 1.00 0.00 C ATOM 429 C THR A 28 16.855 27.565 -7.571 1.00 0.00 C ATOM 430 O THR A 28 16.811 26.465 -8.110 1.00 0.00 O ATOM 431 CB THR A 28 15.510 28.311 -5.684 1.00 0.00 C ATOM 432 OG1 THR A 28 15.452 26.967 -5.183 1.00 0.00 O ATOM 433 CG2 THR A 28 14.267 29.025 -5.294 1.00 0.00 C ATOM 0 H THR A 28 13.949 27.053 -7.159 1.00 0.00 H new ATOM 0 HA THR A 28 15.670 29.308 -7.593 1.00 0.00 H new ATOM 0 HB THR A 28 16.381 28.816 -5.267 1.00 0.00 H new ATOM 0 HG1 THR A 28 15.386 26.985 -4.205 1.00 0.00 H new ATOM 0 HG21 THR A 28 14.183 29.043 -4.207 1.00 0.00 H new ATOM 0 HG22 THR A 28 14.300 30.047 -5.672 1.00 0.00 H new ATOM 0 HG23 THR A 28 13.404 28.510 -5.716 1.00 0.00 H new ATOM 441 N GLN A 29 17.967 28.189 -7.276 1.00 0.00 N ATOM 442 CA GLN A 29 19.256 27.581 -7.458 1.00 0.00 C ATOM 443 C GLN A 29 19.305 26.244 -6.720 1.00 0.00 C ATOM 444 O GLN A 29 19.872 25.260 -7.212 1.00 0.00 O ATOM 445 CB GLN A 29 20.336 28.512 -6.936 1.00 0.00 C ATOM 446 CG GLN A 29 21.737 27.964 -7.105 1.00 0.00 C ATOM 447 CD GLN A 29 22.111 27.783 -8.562 1.00 0.00 C ATOM 448 OE1 GLN A 29 22.663 28.685 -9.184 1.00 0.00 O ATOM 449 NE2 GLN A 29 21.790 26.626 -9.116 1.00 0.00 N ATOM 0 H GLN A 29 18.002 29.137 -6.901 1.00 0.00 H new ATOM 0 HA GLN A 29 19.427 27.401 -8.519 1.00 0.00 H new ATOM 0 HB2 GLN A 29 20.263 29.468 -7.455 1.00 0.00 H new ATOM 0 HB3 GLN A 29 20.156 28.708 -5.879 1.00 0.00 H new ATOM 0 HG2 GLN A 29 22.449 28.640 -6.631 1.00 0.00 H new ATOM 0 HG3 GLN A 29 21.815 27.006 -6.590 1.00 0.00 H new ATOM 0 HE21 GLN A 29 21.332 25.904 -8.560 1.00 0.00 H new ATOM 0 HE22 GLN A 29 22.001 26.455 -10.099 1.00 0.00 H new ATOM 458 N GLU A 30 18.684 26.220 -5.550 1.00 0.00 N ATOM 459 CA GLU A 30 18.623 25.038 -4.730 1.00 0.00 C ATOM 460 C GLU A 30 17.716 24.005 -5.373 1.00 0.00 C ATOM 461 O GLU A 30 18.056 22.826 -5.449 1.00 0.00 O ATOM 462 CB GLU A 30 18.104 25.396 -3.344 1.00 0.00 C ATOM 463 CG GLU A 30 18.185 24.254 -2.343 1.00 0.00 C ATOM 464 CD GLU A 30 17.691 24.656 -0.978 1.00 0.00 C ATOM 465 OE1 GLU A 30 16.467 24.579 -0.739 1.00 0.00 O ATOM 466 OE2 GLU A 30 18.528 25.046 -0.129 1.00 0.00 O ATOM 0 H GLU A 30 18.209 27.028 -5.148 1.00 0.00 H new ATOM 0 HA GLU A 30 19.625 24.618 -4.637 1.00 0.00 H new ATOM 0 HB2 GLU A 30 18.673 26.243 -2.961 1.00 0.00 H new ATOM 0 HB3 GLU A 30 17.067 25.720 -3.428 1.00 0.00 H new ATOM 0 HG2 GLU A 30 17.596 23.412 -2.707 1.00 0.00 H new ATOM 0 HG3 GLU A 30 19.217 23.912 -2.268 1.00 0.00 H new ATOM 473 N GLU A 31 16.575 24.470 -5.865 1.00 0.00 N ATOM 474 CA GLU A 31 15.589 23.626 -6.478 1.00 0.00 C ATOM 475 C GLU A 31 16.139 22.977 -7.755 1.00 0.00 C ATOM 476 O GLU A 31 15.869 21.813 -8.035 1.00 0.00 O ATOM 477 CB GLU A 31 14.311 24.454 -6.740 1.00 0.00 C ATOM 478 CG GLU A 31 13.151 23.650 -7.278 1.00 0.00 C ATOM 479 CD GLU A 31 11.808 24.336 -7.071 1.00 0.00 C ATOM 480 OE1 GLU A 31 11.725 25.566 -7.253 1.00 0.00 O ATOM 481 OE2 GLU A 31 10.823 23.643 -6.719 1.00 0.00 O ATOM 0 H GLU A 31 16.317 25.457 -5.844 1.00 0.00 H new ATOM 0 HA GLU A 31 15.334 22.807 -5.806 1.00 0.00 H new ATOM 0 HB2 GLU A 31 14.006 24.934 -5.810 1.00 0.00 H new ATOM 0 HB3 GLU A 31 14.546 25.250 -7.447 1.00 0.00 H new ATOM 0 HG2 GLU A 31 13.302 23.472 -8.343 1.00 0.00 H new ATOM 0 HG3 GLU A 31 13.134 22.675 -6.791 1.00 0.00 H new ATOM 488 N LEU A 32 16.927 23.737 -8.508 1.00 0.00 N ATOM 489 CA LEU A 32 17.567 23.226 -9.724 1.00 0.00 C ATOM 490 C LEU A 32 18.515 22.062 -9.417 1.00 0.00 C ATOM 491 O LEU A 32 18.452 21.006 -10.049 1.00 0.00 O ATOM 492 CB LEU A 32 18.359 24.339 -10.403 1.00 0.00 C ATOM 493 CG LEU A 32 17.584 25.274 -11.316 1.00 0.00 C ATOM 494 CD1 LEU A 32 16.120 25.337 -10.937 1.00 0.00 C ATOM 495 CD2 LEU A 32 18.182 26.658 -11.282 1.00 0.00 C ATOM 0 H LEU A 32 17.141 24.712 -8.300 1.00 0.00 H new ATOM 0 HA LEU A 32 16.776 22.867 -10.383 1.00 0.00 H new ATOM 0 HB2 LEU A 32 18.835 24.939 -9.627 1.00 0.00 H new ATOM 0 HB3 LEU A 32 19.158 23.880 -10.986 1.00 0.00 H new ATOM 0 HG LEU A 32 17.654 24.876 -12.328 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.598 26.015 -11.612 1.00 0.00 H new ATOM 0 HD12 LEU A 32 15.682 24.342 -11.012 1.00 0.00 H new ATOM 0 HD13 LEU A 32 16.024 25.699 -9.913 1.00 0.00 H new ATOM 0 HD21 LEU A 32 17.615 27.316 -11.941 1.00 0.00 H new ATOM 0 HD22 LEU A 32 18.145 27.045 -10.264 1.00 0.00 H new ATOM 0 HD23 LEU A 32 19.219 26.615 -11.616 1.00 0.00 H new ATOM 507 N LYS A 33 19.378 22.267 -8.429 1.00 0.00 N ATOM 508 CA LYS A 33 20.343 21.254 -8.025 1.00 0.00 C ATOM 509 C LYS A 33 19.622 20.056 -7.436 1.00 0.00 C ATOM 510 O LYS A 33 19.989 18.904 -7.686 1.00 0.00 O ATOM 511 CB LYS A 33 21.332 21.837 -7.014 1.00 0.00 C ATOM 512 CG LYS A 33 22.227 22.933 -7.588 1.00 0.00 C ATOM 513 CD LYS A 33 23.106 23.539 -6.507 1.00 0.00 C ATOM 514 CE LYS A 33 23.954 24.694 -7.029 1.00 0.00 C ATOM 515 NZ LYS A 33 25.022 24.248 -7.951 1.00 0.00 N ATOM 0 H LYS A 33 19.428 23.132 -7.890 1.00 0.00 H new ATOM 0 HA LYS A 33 20.902 20.928 -8.902 1.00 0.00 H new ATOM 0 HB2 LYS A 33 20.776 22.241 -6.168 1.00 0.00 H new ATOM 0 HB3 LYS A 33 21.959 21.033 -6.629 1.00 0.00 H new ATOM 0 HG2 LYS A 33 22.851 22.520 -8.380 1.00 0.00 H new ATOM 0 HG3 LYS A 33 21.611 23.711 -8.040 1.00 0.00 H new ATOM 0 HD2 LYS A 33 22.479 23.893 -5.688 1.00 0.00 H new ATOM 0 HD3 LYS A 33 23.759 22.768 -6.098 1.00 0.00 H new ATOM 0 HE2 LYS A 33 23.311 25.408 -7.543 1.00 0.00 H new ATOM 0 HE3 LYS A 33 24.403 25.219 -6.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 25.599 25.065 -8.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 25.625 23.549 -7.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 24.594 23.816 -8.795 1.00 0.00 H new ATOM 529 N LYS A 34 18.585 20.343 -6.656 1.00 0.00 N ATOM 530 CA LYS A 34 17.797 19.321 -6.007 1.00 0.00 C ATOM 531 C LYS A 34 17.099 18.445 -7.045 1.00 0.00 C ATOM 532 O LYS A 34 16.997 17.231 -6.867 1.00 0.00 O ATOM 533 CB LYS A 34 16.783 19.957 -5.054 1.00 0.00 C ATOM 534 CG LYS A 34 16.060 18.958 -4.171 1.00 0.00 C ATOM 535 CD LYS A 34 15.145 19.655 -3.181 1.00 0.00 C ATOM 536 CE LYS A 34 14.460 18.651 -2.272 1.00 0.00 C ATOM 537 NZ LYS A 34 13.566 19.311 -1.294 1.00 0.00 N ATOM 0 H LYS A 34 18.273 21.294 -6.461 1.00 0.00 H new ATOM 0 HA LYS A 34 18.461 18.685 -5.422 1.00 0.00 H new ATOM 0 HB2 LYS A 34 17.297 20.681 -4.422 1.00 0.00 H new ATOM 0 HB3 LYS A 34 16.047 20.510 -5.638 1.00 0.00 H new ATOM 0 HG2 LYS A 34 15.477 18.277 -4.791 1.00 0.00 H new ATOM 0 HG3 LYS A 34 16.789 18.353 -3.632 1.00 0.00 H new ATOM 0 HD2 LYS A 34 15.722 20.359 -2.581 1.00 0.00 H new ATOM 0 HD3 LYS A 34 14.395 20.234 -3.719 1.00 0.00 H new ATOM 0 HE2 LYS A 34 13.883 17.950 -2.875 1.00 0.00 H new ATOM 0 HE3 LYS A 34 15.213 18.070 -1.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 13.118 18.591 -0.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 14.120 19.961 -0.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 12.831 19.845 -1.801 1.00 0.00 H new ATOM 551 N ALA A 35 16.632 19.064 -8.140 1.00 0.00 N ATOM 552 CA ALA A 35 15.985 18.319 -9.223 1.00 0.00 C ATOM 553 C ALA A 35 16.942 17.285 -9.787 1.00 0.00 C ATOM 554 O ALA A 35 16.581 16.125 -9.958 1.00 0.00 O ATOM 555 CB ALA A 35 15.518 19.255 -10.338 1.00 0.00 C ATOM 0 H ALA A 35 16.691 20.070 -8.296 1.00 0.00 H new ATOM 0 HA ALA A 35 15.110 17.817 -8.810 1.00 0.00 H new ATOM 0 HB1 ALA A 35 15.042 18.672 -11.127 1.00 0.00 H new ATOM 0 HB2 ALA A 35 14.803 19.972 -9.935 1.00 0.00 H new ATOM 0 HB3 ALA A 35 16.375 19.789 -10.748 1.00 0.00 H new ATOM 561 N TYR A 36 18.181 17.704 -10.041 1.00 0.00 N ATOM 562 CA TYR A 36 19.198 16.806 -10.574 1.00 0.00 C ATOM 563 C TYR A 36 19.446 15.634 -9.650 1.00 0.00 C ATOM 564 O TYR A 36 19.459 14.490 -10.091 1.00 0.00 O ATOM 565 CB TYR A 36 20.508 17.547 -10.825 1.00 0.00 C ATOM 566 CG TYR A 36 21.669 16.650 -11.241 1.00 0.00 C ATOM 567 CD1 TYR A 36 21.708 16.074 -12.497 1.00 0.00 C ATOM 568 CD2 TYR A 36 22.728 16.399 -10.372 1.00 0.00 C ATOM 569 CE1 TYR A 36 22.767 15.267 -12.883 1.00 0.00 C ATOM 570 CE2 TYR A 36 23.787 15.594 -10.750 1.00 0.00 C ATOM 571 CZ TYR A 36 23.802 15.030 -12.010 1.00 0.00 C ATOM 572 OH TYR A 36 24.861 14.231 -12.397 1.00 0.00 O ATOM 0 H TYR A 36 18.502 18.660 -9.886 1.00 0.00 H new ATOM 0 HA TYR A 36 18.819 16.424 -11.522 1.00 0.00 H new ATOM 0 HB2 TYR A 36 20.346 18.294 -11.602 1.00 0.00 H new ATOM 0 HB3 TYR A 36 20.787 18.085 -9.919 1.00 0.00 H new ATOM 0 HD1 TYR A 36 20.899 16.256 -13.190 1.00 0.00 H new ATOM 0 HD2 TYR A 36 22.722 16.840 -9.386 1.00 0.00 H new ATOM 0 HE1 TYR A 36 22.779 14.825 -13.868 1.00 0.00 H new ATOM 0 HE2 TYR A 36 24.599 15.407 -10.063 1.00 0.00 H new ATOM 0 HH TYR A 36 25.507 14.166 -11.663 1.00 0.00 H new ATOM 582 N ARG A 37 19.633 15.919 -8.368 1.00 0.00 N ATOM 583 CA ARG A 37 19.894 14.859 -7.400 1.00 0.00 C ATOM 584 C ARG A 37 18.705 13.904 -7.329 1.00 0.00 C ATOM 585 O ARG A 37 18.874 12.687 -7.266 1.00 0.00 O ATOM 586 CB ARG A 37 20.206 15.440 -6.016 1.00 0.00 C ATOM 587 CG ARG A 37 20.595 14.391 -4.982 1.00 0.00 C ATOM 588 CD ARG A 37 20.934 15.028 -3.650 1.00 0.00 C ATOM 589 NE ARG A 37 21.509 14.067 -2.701 1.00 0.00 N ATOM 590 CZ ARG A 37 22.060 14.415 -1.538 1.00 0.00 C ATOM 591 NH1 ARG A 37 22.038 15.686 -1.139 1.00 0.00 N ATOM 592 NH2 ARG A 37 22.614 13.488 -0.761 1.00 0.00 N ATOM 0 H ARG A 37 19.610 16.861 -7.977 1.00 0.00 H new ATOM 0 HA ARG A 37 20.770 14.302 -7.732 1.00 0.00 H new ATOM 0 HB2 ARG A 37 21.017 16.162 -6.110 1.00 0.00 H new ATOM 0 HB3 ARG A 37 19.334 15.985 -5.656 1.00 0.00 H new ATOM 0 HG2 ARG A 37 19.775 13.685 -4.851 1.00 0.00 H new ATOM 0 HG3 ARG A 37 21.451 13.822 -5.343 1.00 0.00 H new ATOM 0 HD2 ARG A 37 21.639 15.844 -3.809 1.00 0.00 H new ATOM 0 HD3 ARG A 37 20.033 15.465 -3.219 1.00 0.00 H new ATOM 0 HE ARG A 37 21.486 13.077 -2.945 1.00 0.00 H new ATOM 0 HH11 ARG A 37 21.599 16.397 -1.724 1.00 0.00 H new ATOM 0 HH12 ARG A 37 22.461 15.948 -0.249 1.00 0.00 H new ATOM 0 HH21 ARG A 37 22.617 12.511 -1.055 1.00 0.00 H new ATOM 0 HH22 ARG A 37 23.036 13.754 0.129 1.00 0.00 H new ATOM 606 N LYS A 38 17.507 14.472 -7.367 1.00 0.00 N ATOM 607 CA LYS A 38 16.274 13.706 -7.308 1.00 0.00 C ATOM 608 C LYS A 38 16.181 12.731 -8.494 1.00 0.00 C ATOM 609 O LYS A 38 15.948 11.523 -8.316 1.00 0.00 O ATOM 610 CB LYS A 38 15.094 14.691 -7.332 1.00 0.00 C ATOM 611 CG LYS A 38 13.714 14.074 -7.223 1.00 0.00 C ATOM 612 CD LYS A 38 12.647 15.163 -7.260 1.00 0.00 C ATOM 613 CE LYS A 38 11.246 14.596 -7.138 1.00 0.00 C ATOM 614 NZ LYS A 38 10.211 15.666 -7.201 1.00 0.00 N ATOM 0 H LYS A 38 17.365 15.479 -7.440 1.00 0.00 H new ATOM 0 HA LYS A 38 16.251 13.115 -6.392 1.00 0.00 H new ATOM 0 HB2 LYS A 38 15.220 15.399 -6.513 1.00 0.00 H new ATOM 0 HB3 LYS A 38 15.143 15.264 -8.258 1.00 0.00 H new ATOM 0 HG2 LYS A 38 13.556 13.372 -8.041 1.00 0.00 H new ATOM 0 HG3 LYS A 38 13.633 13.507 -6.296 1.00 0.00 H new ATOM 0 HD2 LYS A 38 12.823 15.870 -6.449 1.00 0.00 H new ATOM 0 HD3 LYS A 38 12.732 15.721 -8.193 1.00 0.00 H new ATOM 0 HE2 LYS A 38 11.074 13.876 -7.938 1.00 0.00 H new ATOM 0 HE3 LYS A 38 11.153 14.055 -6.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 9.266 15.240 -7.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 10.360 16.340 -6.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 10.283 16.166 -8.110 1.00 0.00 H new ATOM 628 N LEU A 39 16.393 13.252 -9.695 1.00 0.00 N ATOM 629 CA LEU A 39 16.329 12.439 -10.905 1.00 0.00 C ATOM 630 C LEU A 39 17.447 11.424 -10.932 1.00 0.00 C ATOM 631 O LEU A 39 17.246 10.269 -11.303 1.00 0.00 O ATOM 632 CB LEU A 39 16.422 13.314 -12.130 1.00 0.00 C ATOM 633 CG LEU A 39 15.464 14.482 -12.161 1.00 0.00 C ATOM 634 CD1 LEU A 39 15.630 15.286 -13.436 1.00 0.00 C ATOM 635 CD2 LEU A 39 14.022 14.023 -11.991 1.00 0.00 C ATOM 0 H LEU A 39 16.611 14.235 -9.859 1.00 0.00 H new ATOM 0 HA LEU A 39 15.374 11.914 -10.904 1.00 0.00 H new ATOM 0 HB2 LEU A 39 17.440 13.697 -12.207 1.00 0.00 H new ATOM 0 HB3 LEU A 39 16.246 12.697 -13.011 1.00 0.00 H new ATOM 0 HG LEU A 39 15.706 15.129 -11.318 1.00 0.00 H new ATOM 0 HD11 LEU A 39 14.929 16.121 -13.434 1.00 0.00 H new ATOM 0 HD12 LEU A 39 16.649 15.668 -13.495 1.00 0.00 H new ATOM 0 HD13 LEU A 39 15.431 14.648 -14.297 1.00 0.00 H new ATOM 0 HD21 LEU A 39 13.359 14.888 -12.018 1.00 0.00 H new ATOM 0 HD22 LEU A 39 13.760 13.340 -12.799 1.00 0.00 H new ATOM 0 HD23 LEU A 39 13.913 13.512 -11.034 1.00 0.00 H new ATOM 647 N ALA A 40 18.622 11.867 -10.527 1.00 0.00 N ATOM 648 CA ALA A 40 19.820 11.025 -10.526 1.00 0.00 C ATOM 649 C ALA A 40 19.636 9.782 -9.681 1.00 0.00 C ATOM 650 O ALA A 40 20.092 8.700 -10.043 1.00 0.00 O ATOM 651 CB ALA A 40 21.038 11.813 -10.053 1.00 0.00 C ATOM 0 H ALA A 40 18.781 12.816 -10.189 1.00 0.00 H new ATOM 0 HA ALA A 40 19.988 10.704 -11.554 1.00 0.00 H new ATOM 0 HB1 ALA A 40 21.915 11.166 -10.061 1.00 0.00 H new ATOM 0 HB2 ALA A 40 21.205 12.659 -10.719 1.00 0.00 H new ATOM 0 HB3 ALA A 40 20.865 12.177 -9.040 1.00 0.00 H new ATOM 657 N LEU A 41 18.994 9.941 -8.553 1.00 0.00 N ATOM 658 CA LEU A 41 18.739 8.839 -7.665 1.00 0.00 C ATOM 659 C LEU A 41 17.797 7.819 -8.309 1.00 0.00 C ATOM 660 O LEU A 41 17.991 6.609 -8.176 1.00 0.00 O ATOM 661 CB LEU A 41 18.144 9.357 -6.366 1.00 0.00 C ATOM 662 CG LEU A 41 19.048 10.265 -5.535 1.00 0.00 C ATOM 663 CD1 LEU A 41 18.327 10.735 -4.291 1.00 0.00 C ATOM 664 CD2 LEU A 41 20.353 9.563 -5.178 1.00 0.00 C ATOM 0 H LEU A 41 18.634 10.837 -8.225 1.00 0.00 H new ATOM 0 HA LEU A 41 19.684 8.337 -7.456 1.00 0.00 H new ATOM 0 HB2 LEU A 41 17.229 9.902 -6.600 1.00 0.00 H new ATOM 0 HB3 LEU A 41 17.858 8.502 -5.753 1.00 0.00 H new ATOM 0 HG LEU A 41 19.297 11.139 -6.137 1.00 0.00 H new ATOM 0 HD11 LEU A 41 18.986 11.381 -3.711 1.00 0.00 H new ATOM 0 HD12 LEU A 41 17.434 11.290 -4.576 1.00 0.00 H new ATOM 0 HD13 LEU A 41 18.041 9.873 -3.688 1.00 0.00 H new ATOM 0 HD21 LEU A 41 20.977 10.233 -4.586 1.00 0.00 H new ATOM 0 HD22 LEU A 41 20.137 8.664 -4.600 1.00 0.00 H new ATOM 0 HD23 LEU A 41 20.880 9.289 -6.092 1.00 0.00 H new ATOM 676 N LYS A 42 16.762 8.315 -8.979 1.00 0.00 N ATOM 677 CA LYS A 42 15.772 7.460 -9.616 1.00 0.00 C ATOM 678 C LYS A 42 16.269 6.812 -10.932 1.00 0.00 C ATOM 679 O LYS A 42 16.111 5.606 -11.134 1.00 0.00 O ATOM 680 CB LYS A 42 14.488 8.255 -9.866 1.00 0.00 C ATOM 681 CG LYS A 42 13.532 8.310 -8.672 1.00 0.00 C ATOM 682 CD LYS A 42 14.119 9.082 -7.491 1.00 0.00 C ATOM 683 CE LYS A 42 13.144 9.114 -6.320 1.00 0.00 C ATOM 684 NZ LYS A 42 13.713 9.805 -5.134 1.00 0.00 N ATOM 0 H LYS A 42 16.588 9.313 -9.094 1.00 0.00 H new ATOM 0 HA LYS A 42 15.578 6.637 -8.928 1.00 0.00 H new ATOM 0 HB2 LYS A 42 14.755 9.273 -10.148 1.00 0.00 H new ATOM 0 HB3 LYS A 42 13.964 7.816 -10.715 1.00 0.00 H new ATOM 0 HG2 LYS A 42 12.597 8.778 -8.980 1.00 0.00 H new ATOM 0 HG3 LYS A 42 13.291 7.295 -8.356 1.00 0.00 H new ATOM 0 HD2 LYS A 42 15.054 8.618 -7.177 1.00 0.00 H new ATOM 0 HD3 LYS A 42 14.356 10.100 -7.799 1.00 0.00 H new ATOM 0 HE2 LYS A 42 12.227 9.618 -6.627 1.00 0.00 H new ATOM 0 HE3 LYS A 42 12.872 8.094 -6.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 13.015 9.803 -4.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 14.574 9.310 -4.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 13.949 10.787 -5.384 1.00 0.00 H new ATOM 698 N TYR A 43 16.877 7.611 -11.801 1.00 0.00 N ATOM 699 CA TYR A 43 17.304 7.133 -13.138 1.00 0.00 C ATOM 700 C TYR A 43 18.812 6.917 -13.206 1.00 0.00 C ATOM 701 O TYR A 43 19.417 7.130 -14.255 1.00 0.00 O ATOM 702 CB TYR A 43 16.893 8.140 -14.231 1.00 0.00 C ATOM 703 CG TYR A 43 15.416 8.476 -14.246 1.00 0.00 C ATOM 704 CD1 TYR A 43 14.492 7.622 -14.833 1.00 0.00 C ATOM 705 CD2 TYR A 43 14.952 9.650 -13.670 1.00 0.00 C ATOM 706 CE1 TYR A 43 13.146 7.931 -14.845 1.00 0.00 C ATOM 707 CE2 TYR A 43 13.607 9.966 -13.681 1.00 0.00 C ATOM 708 CZ TYR A 43 12.708 9.104 -14.268 1.00 0.00 C ATOM 709 OH TYR A 43 11.369 9.417 -14.284 1.00 0.00 O ATOM 0 H TYR A 43 17.091 8.591 -11.618 1.00 0.00 H new ATOM 0 HA TYR A 43 16.807 6.178 -13.308 1.00 0.00 H new ATOM 0 HB2 TYR A 43 17.461 9.060 -14.093 1.00 0.00 H new ATOM 0 HB3 TYR A 43 17.172 7.736 -15.204 1.00 0.00 H new ATOM 0 HD1 TYR A 43 14.831 6.702 -15.287 1.00 0.00 H new ATOM 0 HD2 TYR A 43 15.653 10.328 -13.206 1.00 0.00 H new ATOM 0 HE1 TYR A 43 12.439 7.256 -15.305 1.00 0.00 H new ATOM 0 HE2 TYR A 43 13.262 10.885 -13.231 1.00 0.00 H new ATOM 0 HH TYR A 43 11.229 10.277 -13.835 1.00 0.00 H new ATOM 719 N HIS A 44 19.409 6.509 -12.091 1.00 0.00 N ATOM 720 CA HIS A 44 20.857 6.271 -12.031 1.00 0.00 C ATOM 721 C HIS A 44 21.307 5.340 -13.163 1.00 0.00 C ATOM 722 O HIS A 44 20.808 4.218 -13.280 1.00 0.00 O ATOM 723 CB HIS A 44 21.236 5.650 -10.689 1.00 0.00 C ATOM 724 CG HIS A 44 22.617 6.016 -10.243 1.00 0.00 C ATOM 725 ND1 HIS A 44 23.760 5.485 -10.801 1.00 0.00 N ATOM 726 CD2 HIS A 44 23.036 6.889 -9.295 1.00 0.00 C ATOM 727 CE1 HIS A 44 24.819 6.012 -10.215 1.00 0.00 C ATOM 728 NE2 HIS A 44 24.405 6.867 -9.302 1.00 0.00 N ATOM 0 H HIS A 44 18.918 6.335 -11.214 1.00 0.00 H new ATOM 0 HA HIS A 44 21.358 7.232 -12.144 1.00 0.00 H new ATOM 0 HB2 HIS A 44 20.519 5.969 -9.932 1.00 0.00 H new ATOM 0 HB3 HIS A 44 21.160 4.565 -10.763 1.00 0.00 H new ATOM 0 HD2 HIS A 44 22.408 7.490 -8.654 1.00 0.00 H new ATOM 0 HE1 HIS A 44 25.849 5.782 -10.445 1.00 0.00 H new ATOM 0 HE2 HIS A 44 25.008 7.424 -8.697 1.00 0.00 H new ATOM 736 N PRO A 45 22.263 5.785 -14.007 1.00 0.00 N ATOM 737 CA PRO A 45 22.743 4.991 -15.140 1.00 0.00 C ATOM 738 C PRO A 45 23.469 3.719 -14.704 1.00 0.00 C ATOM 739 O PRO A 45 23.551 2.751 -15.462 1.00 0.00 O ATOM 740 CB PRO A 45 23.688 5.940 -15.871 1.00 0.00 C ATOM 741 CG PRO A 45 24.115 6.911 -14.843 1.00 0.00 C ATOM 742 CD PRO A 45 22.940 7.085 -13.928 1.00 0.00 C ATOM 0 HA PRO A 45 21.921 4.635 -15.762 1.00 0.00 H new ATOM 0 HB2 PRO A 45 24.541 5.405 -16.289 1.00 0.00 H new ATOM 0 HB3 PRO A 45 23.186 6.437 -16.701 1.00 0.00 H new ATOM 0 HG2 PRO A 45 24.984 6.545 -14.297 1.00 0.00 H new ATOM 0 HG3 PRO A 45 24.400 7.860 -15.297 1.00 0.00 H new ATOM 0 HD2 PRO A 45 23.253 7.316 -12.910 1.00 0.00 H new ATOM 0 HD3 PRO A 45 22.291 7.898 -14.254 1.00 0.00 H new ATOM 750 N ASP A 46 23.991 3.725 -13.480 1.00 0.00 N ATOM 751 CA ASP A 46 24.654 2.545 -12.921 1.00 0.00 C ATOM 752 C ASP A 46 23.633 1.533 -12.442 1.00 0.00 C ATOM 753 O ASP A 46 23.975 0.397 -12.096 1.00 0.00 O ATOM 754 CB ASP A 46 25.591 2.930 -11.774 1.00 0.00 C ATOM 755 CG ASP A 46 26.949 3.403 -12.255 1.00 0.00 C ATOM 756 OD1 ASP A 46 27.021 4.444 -12.939 1.00 0.00 O ATOM 757 OD2 ASP A 46 27.956 2.724 -11.954 1.00 0.00 O ATOM 0 H ASP A 46 23.969 4.531 -12.856 1.00 0.00 H new ATOM 0 HA ASP A 46 25.250 2.093 -13.714 1.00 0.00 H new ATOM 0 HB2 ASP A 46 25.127 3.718 -11.181 1.00 0.00 H new ATOM 0 HB3 ASP A 46 25.723 2.071 -11.116 1.00 0.00 H new ATOM 762 N LYS A 47 22.380 1.949 -12.406 1.00 0.00 N ATOM 763 CA LYS A 47 21.298 1.088 -11.994 1.00 0.00 C ATOM 764 C LYS A 47 20.466 0.688 -13.217 1.00 0.00 C ATOM 765 O LYS A 47 20.062 -0.470 -13.361 1.00 0.00 O ATOM 766 CB LYS A 47 20.411 1.794 -10.956 1.00 0.00 C ATOM 767 CG LYS A 47 19.328 0.901 -10.374 1.00 0.00 C ATOM 768 CD LYS A 47 18.474 1.636 -9.363 1.00 0.00 C ATOM 769 CE LYS A 47 17.418 0.716 -8.770 1.00 0.00 C ATOM 770 NZ LYS A 47 16.551 0.115 -9.818 1.00 0.00 N ATOM 0 H LYS A 47 22.089 2.893 -12.662 1.00 0.00 H new ATOM 0 HA LYS A 47 21.715 0.192 -11.534 1.00 0.00 H new ATOM 0 HB2 LYS A 47 21.039 2.165 -10.146 1.00 0.00 H new ATOM 0 HB3 LYS A 47 19.944 2.662 -11.420 1.00 0.00 H new ATOM 0 HG2 LYS A 47 18.696 0.525 -11.179 1.00 0.00 H new ATOM 0 HG3 LYS A 47 19.788 0.034 -9.899 1.00 0.00 H new ATOM 0 HD2 LYS A 47 19.105 2.031 -8.567 1.00 0.00 H new ATOM 0 HD3 LYS A 47 17.992 2.489 -9.841 1.00 0.00 H new ATOM 0 HE2 LYS A 47 17.905 -0.078 -8.204 1.00 0.00 H new ATOM 0 HE3 LYS A 47 16.802 1.277 -8.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 15.703 -0.292 -9.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 16.268 0.850 -10.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 17.075 -0.633 -10.315 1.00 0.00 H new ATOM 784 N ASN A 48 20.223 1.656 -14.092 1.00 0.00 N ATOM 785 CA ASN A 48 19.480 1.424 -15.320 1.00 0.00 C ATOM 786 C ASN A 48 20.143 2.139 -16.484 1.00 0.00 C ATOM 787 O ASN A 48 19.925 3.330 -16.702 1.00 0.00 O ATOM 788 CB ASN A 48 18.027 1.888 -15.203 1.00 0.00 C ATOM 789 CG ASN A 48 17.219 1.108 -14.183 1.00 0.00 C ATOM 790 OD1 ASN A 48 17.163 1.470 -13.006 1.00 0.00 O ATOM 791 ND2 ASN A 48 16.577 0.044 -14.625 1.00 0.00 N ATOM 0 H ASN A 48 20.535 2.619 -13.969 1.00 0.00 H new ATOM 0 HA ASN A 48 19.482 0.349 -15.498 1.00 0.00 H new ATOM 0 HB2 ASN A 48 18.013 2.944 -14.934 1.00 0.00 H new ATOM 0 HB3 ASN A 48 17.547 1.800 -16.178 1.00 0.00 H new ATOM 0 HD21 ASN A 48 16.009 -0.511 -13.985 1.00 0.00 H new ATOM 0 HD22 ASN A 48 16.648 -0.223 -15.607 1.00 0.00 H new ATOM 798 N PRO A 49 20.974 1.419 -17.236 1.00 0.00 N ATOM 799 CA PRO A 49 21.643 1.942 -18.408 1.00 0.00 C ATOM 800 C PRO A 49 20.645 2.322 -19.502 1.00 0.00 C ATOM 801 O PRO A 49 20.944 3.124 -20.387 1.00 0.00 O ATOM 802 CB PRO A 49 22.515 0.778 -18.859 1.00 0.00 C ATOM 803 CG PRO A 49 21.896 -0.407 -18.267 1.00 0.00 C ATOM 804 CD PRO A 49 21.334 0.043 -16.983 1.00 0.00 C ATOM 0 HA PRO A 49 22.206 2.852 -18.199 1.00 0.00 H new ATOM 0 HB2 PRO A 49 22.546 0.706 -19.946 1.00 0.00 H new ATOM 0 HB3 PRO A 49 23.543 0.899 -18.518 1.00 0.00 H new ATOM 0 HG2 PRO A 49 21.118 -0.809 -18.916 1.00 0.00 H new ATOM 0 HG3 PRO A 49 22.629 -1.200 -18.118 1.00 0.00 H new ATOM 0 HD2 PRO A 49 20.468 -0.552 -16.694 1.00 0.00 H new ATOM 0 HD3 PRO A 49 22.061 -0.040 -16.175 1.00 0.00 H new ATOM 812 N ASN A 50 19.455 1.738 -19.421 1.00 0.00 N ATOM 813 CA ASN A 50 18.374 2.026 -20.360 1.00 0.00 C ATOM 814 C ASN A 50 17.887 3.468 -20.177 1.00 0.00 C ATOM 815 O ASN A 50 17.405 4.102 -21.119 1.00 0.00 O ATOM 816 CB ASN A 50 17.208 1.028 -20.171 1.00 0.00 C ATOM 817 CG ASN A 50 16.057 1.251 -21.143 1.00 0.00 C ATOM 818 OD1 ASN A 50 16.252 1.675 -22.281 1.00 0.00 O ATOM 819 ND2 ASN A 50 14.852 0.952 -20.700 1.00 0.00 N ATOM 0 H ASN A 50 19.211 1.053 -18.705 1.00 0.00 H new ATOM 0 HA ASN A 50 18.755 1.913 -21.375 1.00 0.00 H new ATOM 0 HB2 ASN A 50 17.585 0.013 -20.293 1.00 0.00 H new ATOM 0 HB3 ASN A 50 16.833 1.108 -19.151 1.00 0.00 H new ATOM 0 HD21 ASN A 50 14.041 1.070 -21.308 1.00 0.00 H new ATOM 0 HD22 ASN A 50 14.730 0.603 -19.749 1.00 0.00 H new ATOM 826 N GLU A 51 18.039 3.987 -18.959 1.00 0.00 N ATOM 827 CA GLU A 51 17.596 5.344 -18.659 1.00 0.00 C ATOM 828 C GLU A 51 18.735 6.348 -18.837 1.00 0.00 C ATOM 829 O GLU A 51 18.548 7.551 -18.645 1.00 0.00 O ATOM 830 CB GLU A 51 17.025 5.442 -17.242 1.00 0.00 C ATOM 831 CG GLU A 51 15.808 4.560 -17.012 1.00 0.00 C ATOM 832 CD GLU A 51 14.679 4.845 -17.986 1.00 0.00 C ATOM 833 OE1 GLU A 51 14.072 5.926 -17.907 1.00 0.00 O ATOM 834 OE2 GLU A 51 14.404 3.980 -18.847 1.00 0.00 O ATOM 0 H GLU A 51 18.461 3.493 -18.173 1.00 0.00 H new ATOM 0 HA GLU A 51 16.804 5.590 -19.366 1.00 0.00 H new ATOM 0 HB2 GLU A 51 17.801 5.169 -16.527 1.00 0.00 H new ATOM 0 HB3 GLU A 51 16.755 6.478 -17.039 1.00 0.00 H new ATOM 0 HG2 GLU A 51 16.102 3.514 -17.100 1.00 0.00 H new ATOM 0 HG3 GLU A 51 15.448 4.705 -15.994 1.00 0.00 H new ATOM 841 N GLY A 52 19.909 5.853 -19.224 1.00 0.00 N ATOM 842 CA GLY A 52 21.060 6.716 -19.414 1.00 0.00 C ATOM 843 C GLY A 52 20.862 7.704 -20.544 1.00 0.00 C ATOM 844 O GLY A 52 21.453 8.786 -20.543 1.00 0.00 O ATOM 0 H GLY A 52 20.082 4.865 -19.410 1.00 0.00 H new ATOM 0 HA2 GLY A 52 21.259 7.260 -18.491 1.00 0.00 H new ATOM 0 HA3 GLY A 52 21.939 6.105 -19.620 1.00 0.00 H new ATOM 848 N GLU A 53 20.012 7.340 -21.503 1.00 0.00 N ATOM 849 CA GLU A 53 19.716 8.218 -22.634 1.00 0.00 C ATOM 850 C GLU A 53 19.021 9.469 -22.116 1.00 0.00 C ATOM 851 O GLU A 53 19.299 10.593 -22.558 1.00 0.00 O ATOM 852 CB GLU A 53 18.816 7.515 -23.678 1.00 0.00 C ATOM 853 CG GLU A 53 19.426 6.269 -24.320 1.00 0.00 C ATOM 854 CD GLU A 53 18.565 5.704 -25.424 1.00 0.00 C ATOM 855 OE1 GLU A 53 17.594 4.985 -25.126 1.00 0.00 O ATOM 856 OE2 GLU A 53 18.869 5.960 -26.607 1.00 0.00 O ATOM 0 H GLU A 53 19.518 6.448 -21.520 1.00 0.00 H new ATOM 0 HA GLU A 53 20.653 8.479 -23.126 1.00 0.00 H new ATOM 0 HB2 GLU A 53 17.878 7.236 -23.198 1.00 0.00 H new ATOM 0 HB3 GLU A 53 18.572 8.229 -24.465 1.00 0.00 H new ATOM 0 HG2 GLU A 53 20.409 6.516 -24.721 1.00 0.00 H new ATOM 0 HG3 GLU A 53 19.576 5.507 -23.555 1.00 0.00 H new ATOM 863 N LYS A 54 18.114 9.253 -21.169 1.00 0.00 N ATOM 864 CA LYS A 54 17.391 10.314 -20.519 1.00 0.00 C ATOM 865 C LYS A 54 18.326 11.112 -19.622 1.00 0.00 C ATOM 866 O LYS A 54 18.185 12.318 -19.461 1.00 0.00 O ATOM 867 CB LYS A 54 16.238 9.757 -19.706 1.00 0.00 C ATOM 868 CG LYS A 54 15.131 9.126 -20.535 1.00 0.00 C ATOM 869 CD LYS A 54 13.958 8.781 -19.664 1.00 0.00 C ATOM 870 CE LYS A 54 12.876 8.045 -20.439 1.00 0.00 C ATOM 871 NZ LYS A 54 12.470 8.776 -21.668 1.00 0.00 N ATOM 0 H LYS A 54 17.865 8.322 -20.835 1.00 0.00 H new ATOM 0 HA LYS A 54 16.985 10.974 -21.286 1.00 0.00 H new ATOM 0 HB2 LYS A 54 16.626 9.011 -19.012 1.00 0.00 H new ATOM 0 HB3 LYS A 54 15.812 10.560 -19.105 1.00 0.00 H new ATOM 0 HG2 LYS A 54 14.819 9.814 -21.321 1.00 0.00 H new ATOM 0 HG3 LYS A 54 15.503 8.228 -21.027 1.00 0.00 H new ATOM 0 HD2 LYS A 54 14.293 8.163 -18.831 1.00 0.00 H new ATOM 0 HD3 LYS A 54 13.542 9.693 -19.236 1.00 0.00 H new ATOM 0 HE2 LYS A 54 13.237 7.053 -20.711 1.00 0.00 H new ATOM 0 HE3 LYS A 54 12.006 7.903 -19.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 11.611 8.342 -22.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 12.278 9.771 -21.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 13.236 8.728 -22.370 1.00 0.00 H new ATOM 885 N PHE A 55 19.277 10.409 -19.036 1.00 0.00 N ATOM 886 CA PHE A 55 20.235 10.993 -18.116 1.00 0.00 C ATOM 887 C PHE A 55 21.065 12.078 -18.794 1.00 0.00 C ATOM 888 O PHE A 55 21.333 13.120 -18.201 1.00 0.00 O ATOM 889 CB PHE A 55 21.135 9.909 -17.515 1.00 0.00 C ATOM 890 CG PHE A 55 21.994 10.381 -16.376 1.00 0.00 C ATOM 891 CD1 PHE A 55 21.441 10.591 -15.125 1.00 0.00 C ATOM 892 CD2 PHE A 55 23.350 10.611 -16.550 1.00 0.00 C ATOM 893 CE1 PHE A 55 22.219 11.022 -14.072 1.00 0.00 C ATOM 894 CE2 PHE A 55 24.135 11.044 -15.501 1.00 0.00 C ATOM 895 CZ PHE A 55 23.570 11.247 -14.260 1.00 0.00 C ATOM 0 H PHE A 55 19.407 9.409 -19.186 1.00 0.00 H new ATOM 0 HA PHE A 55 19.678 11.464 -17.306 1.00 0.00 H new ATOM 0 HB2 PHE A 55 20.510 9.086 -17.167 1.00 0.00 H new ATOM 0 HB3 PHE A 55 21.779 9.511 -18.300 1.00 0.00 H new ATOM 0 HD1 PHE A 55 20.387 10.415 -14.972 1.00 0.00 H new ATOM 0 HD2 PHE A 55 23.798 10.449 -17.519 1.00 0.00 H new ATOM 0 HE1 PHE A 55 21.774 11.184 -13.101 1.00 0.00 H new ATOM 0 HE2 PHE A 55 25.189 11.223 -15.652 1.00 0.00 H new ATOM 0 HZ PHE A 55 24.182 11.581 -13.436 1.00 0.00 H new ATOM 905 N LYS A 56 21.458 11.834 -20.040 1.00 0.00 N ATOM 906 CA LYS A 56 22.245 12.808 -20.796 1.00 0.00 C ATOM 907 C LYS A 56 21.494 14.142 -20.881 1.00 0.00 C ATOM 908 O LYS A 56 22.094 15.211 -20.803 1.00 0.00 O ATOM 909 CB LYS A 56 22.542 12.277 -22.204 1.00 0.00 C ATOM 910 CG LYS A 56 23.460 11.060 -22.235 1.00 0.00 C ATOM 911 CD LYS A 56 23.692 10.585 -23.663 1.00 0.00 C ATOM 912 CE LYS A 56 24.572 9.342 -23.711 1.00 0.00 C ATOM 913 NZ LYS A 56 25.956 9.609 -23.239 1.00 0.00 N ATOM 0 H LYS A 56 21.247 10.975 -20.548 1.00 0.00 H new ATOM 0 HA LYS A 56 23.191 12.969 -20.278 1.00 0.00 H new ATOM 0 HB2 LYS A 56 21.600 12.020 -22.689 1.00 0.00 H new ATOM 0 HB3 LYS A 56 22.996 13.075 -22.792 1.00 0.00 H new ATOM 0 HG2 LYS A 56 24.415 11.309 -21.772 1.00 0.00 H new ATOM 0 HG3 LYS A 56 23.021 10.254 -21.647 1.00 0.00 H new ATOM 0 HD2 LYS A 56 22.733 10.370 -24.135 1.00 0.00 H new ATOM 0 HD3 LYS A 56 24.159 11.383 -24.240 1.00 0.00 H new ATOM 0 HE2 LYS A 56 24.126 8.560 -23.096 1.00 0.00 H new ATOM 0 HE3 LYS A 56 24.606 8.964 -24.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 26.546 8.768 -23.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 26.352 10.416 -23.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 25.940 9.830 -22.223 1.00 0.00 H new ATOM 927 N GLN A 57 20.178 14.058 -21.036 1.00 0.00 N ATOM 928 CA GLN A 57 19.302 15.207 -21.052 1.00 0.00 C ATOM 929 C GLN A 57 19.381 15.951 -19.730 1.00 0.00 C ATOM 930 O GLN A 57 19.502 17.183 -19.692 1.00 0.00 O ATOM 931 CB GLN A 57 17.892 14.698 -21.247 1.00 0.00 C ATOM 932 CG GLN A 57 17.653 14.086 -22.603 1.00 0.00 C ATOM 933 CD GLN A 57 16.264 13.475 -22.754 1.00 0.00 C ATOM 934 OE1 GLN A 57 15.314 13.871 -22.084 1.00 0.00 O ATOM 935 NE2 GLN A 57 16.147 12.497 -23.625 1.00 0.00 N ATOM 0 H GLN A 57 19.688 13.171 -21.156 1.00 0.00 H new ATOM 0 HA GLN A 57 19.593 15.889 -21.851 1.00 0.00 H new ATOM 0 HB2 GLN A 57 17.673 13.956 -20.479 1.00 0.00 H new ATOM 0 HB3 GLN A 57 17.194 15.522 -21.102 1.00 0.00 H new ATOM 0 HG2 GLN A 57 17.791 14.850 -23.368 1.00 0.00 H new ATOM 0 HG3 GLN A 57 18.403 13.315 -22.783 1.00 0.00 H new ATOM 0 HE21 GLN A 57 16.958 12.194 -24.164 1.00 0.00 H new ATOM 0 HE22 GLN A 57 15.245 12.041 -23.762 1.00 0.00 H new ATOM 944 N ILE A 58 19.335 15.190 -18.658 1.00 0.00 N ATOM 945 CA ILE A 58 19.372 15.721 -17.313 1.00 0.00 C ATOM 946 C ILE A 58 20.689 16.447 -17.056 1.00 0.00 C ATOM 947 O ILE A 58 20.708 17.549 -16.495 1.00 0.00 O ATOM 948 CB ILE A 58 19.203 14.580 -16.283 1.00 0.00 C ATOM 949 CG1 ILE A 58 17.809 13.982 -16.373 1.00 0.00 C ATOM 950 CG2 ILE A 58 19.472 15.071 -14.894 1.00 0.00 C ATOM 951 CD1 ILE A 58 17.627 12.709 -15.569 1.00 0.00 C ATOM 0 H ILE A 58 19.270 14.173 -18.697 1.00 0.00 H new ATOM 0 HA ILE A 58 18.551 16.430 -17.206 1.00 0.00 H new ATOM 0 HB ILE A 58 19.930 13.802 -16.517 1.00 0.00 H new ATOM 0 HG12 ILE A 58 17.085 14.722 -16.030 1.00 0.00 H new ATOM 0 HG13 ILE A 58 17.582 13.774 -17.419 1.00 0.00 H new ATOM 0 HG21 ILE A 58 19.347 14.251 -14.187 1.00 0.00 H new ATOM 0 HG22 ILE A 58 20.492 15.450 -14.833 1.00 0.00 H new ATOM 0 HG23 ILE A 58 18.773 15.871 -14.649 1.00 0.00 H new ATOM 0 HD11 ILE A 58 16.606 12.347 -15.687 1.00 0.00 H new ATOM 0 HD12 ILE A 58 18.324 11.951 -15.925 1.00 0.00 H new ATOM 0 HD13 ILE A 58 17.820 12.913 -14.516 1.00 0.00 H new ATOM 963 N SER A 59 21.779 15.834 -17.492 1.00 0.00 N ATOM 964 CA SER A 59 23.100 16.397 -17.323 1.00 0.00 C ATOM 965 C SER A 59 23.210 17.783 -17.981 1.00 0.00 C ATOM 966 O SER A 59 23.847 18.681 -17.436 1.00 0.00 O ATOM 967 CB SER A 59 24.155 15.451 -17.899 1.00 0.00 C ATOM 968 OG SER A 59 24.045 14.161 -17.317 1.00 0.00 O ATOM 0 H SER A 59 21.768 14.934 -17.972 1.00 0.00 H new ATOM 0 HA SER A 59 23.277 16.521 -16.255 1.00 0.00 H new ATOM 0 HB2 SER A 59 24.034 15.379 -18.980 1.00 0.00 H new ATOM 0 HB3 SER A 59 25.151 15.854 -17.716 1.00 0.00 H new ATOM 0 HG SER A 59 23.263 13.700 -17.688 1.00 0.00 H new ATOM 974 N GLN A 60 22.585 17.940 -19.153 1.00 0.00 N ATOM 975 CA GLN A 60 22.616 19.193 -19.886 1.00 0.00 C ATOM 976 C GLN A 60 21.930 20.299 -19.101 1.00 0.00 C ATOM 977 O GLN A 60 22.497 21.387 -18.898 1.00 0.00 O ATOM 978 CB GLN A 60 21.897 19.008 -21.199 1.00 0.00 C ATOM 979 CG GLN A 60 22.466 17.925 -22.093 1.00 0.00 C ATOM 980 CD GLN A 60 21.676 17.769 -23.383 1.00 0.00 C ATOM 981 OE1 GLN A 60 21.143 18.738 -23.924 1.00 0.00 O ATOM 982 NE2 GLN A 60 21.586 16.546 -23.874 1.00 0.00 N ATOM 0 H GLN A 60 22.049 17.203 -19.611 1.00 0.00 H new ATOM 0 HA GLN A 60 23.656 19.475 -20.051 1.00 0.00 H new ATOM 0 HB2 GLN A 60 20.852 18.777 -20.994 1.00 0.00 H new ATOM 0 HB3 GLN A 60 21.914 19.953 -21.742 1.00 0.00 H new ATOM 0 HG2 GLN A 60 23.503 18.161 -22.331 1.00 0.00 H new ATOM 0 HG3 GLN A 60 22.470 16.977 -21.555 1.00 0.00 H new ATOM 0 HE21 GLN A 60 22.042 15.769 -23.395 1.00 0.00 H new ATOM 0 HE22 GLN A 60 21.060 16.378 -24.732 1.00 0.00 H new ATOM 991 N ALA A 61 20.717 20.017 -18.659 1.00 0.00 N ATOM 992 CA ALA A 61 19.928 20.969 -17.892 1.00 0.00 C ATOM 993 C ALA A 61 20.662 21.362 -16.642 1.00 0.00 C ATOM 994 O ALA A 61 20.800 22.538 -16.347 1.00 0.00 O ATOM 995 CB ALA A 61 18.574 20.362 -17.545 1.00 0.00 C ATOM 0 H ALA A 61 20.251 19.124 -18.820 1.00 0.00 H new ATOM 0 HA ALA A 61 19.767 21.863 -18.494 1.00 0.00 H new ATOM 0 HB1 ALA A 61 17.989 21.081 -16.971 1.00 0.00 H new ATOM 0 HB2 ALA A 61 18.042 20.112 -18.463 1.00 0.00 H new ATOM 0 HB3 ALA A 61 18.721 19.459 -16.953 1.00 0.00 H new ATOM 1001 N TYR A 62 21.164 20.373 -15.937 1.00 0.00 N ATOM 1002 CA TYR A 62 21.905 20.607 -14.721 1.00 0.00 C ATOM 1003 C TYR A 62 23.149 21.434 -14.997 1.00 0.00 C ATOM 1004 O TYR A 62 23.516 22.286 -14.203 1.00 0.00 O ATOM 1005 CB TYR A 62 22.281 19.284 -14.068 1.00 0.00 C ATOM 1006 CG TYR A 62 23.097 19.433 -12.801 1.00 0.00 C ATOM 1007 CD1 TYR A 62 22.537 19.974 -11.651 1.00 0.00 C ATOM 1008 CD2 TYR A 62 24.414 19.002 -12.747 1.00 0.00 C ATOM 1009 CE1 TYR A 62 23.266 20.081 -10.486 1.00 0.00 C ATOM 1010 CE2 TYR A 62 25.151 19.111 -11.586 1.00 0.00 C ATOM 1011 CZ TYR A 62 24.571 19.651 -10.458 1.00 0.00 C ATOM 1012 OH TYR A 62 25.293 19.744 -9.299 1.00 0.00 O ATOM 0 H TYR A 62 21.070 19.389 -16.190 1.00 0.00 H new ATOM 0 HA TYR A 62 21.269 21.167 -14.036 1.00 0.00 H new ATOM 0 HB2 TYR A 62 21.370 18.732 -13.838 1.00 0.00 H new ATOM 0 HB3 TYR A 62 22.845 18.685 -14.783 1.00 0.00 H new ATOM 0 HD1 TYR A 62 21.513 20.317 -11.670 1.00 0.00 H new ATOM 0 HD2 TYR A 62 24.870 18.574 -13.628 1.00 0.00 H new ATOM 0 HE1 TYR A 62 22.814 20.501 -9.600 1.00 0.00 H new ATOM 0 HE2 TYR A 62 26.177 18.775 -11.561 1.00 0.00 H new ATOM 0 HH TYR A 62 26.197 19.396 -9.448 1.00 0.00 H new ATOM 1022 N GLU A 63 23.782 21.183 -16.129 1.00 0.00 N ATOM 1023 CA GLU A 63 25.012 21.862 -16.491 1.00 0.00 C ATOM 1024 C GLU A 63 24.853 23.383 -16.433 1.00 0.00 C ATOM 1025 O GLU A 63 25.681 24.078 -15.853 1.00 0.00 O ATOM 1026 CB GLU A 63 25.463 21.407 -17.875 1.00 0.00 C ATOM 1027 CG GLU A 63 26.844 21.870 -18.253 1.00 0.00 C ATOM 1028 CD GLU A 63 27.885 21.433 -17.259 1.00 0.00 C ATOM 1029 OE1 GLU A 63 28.104 20.214 -17.118 1.00 0.00 O ATOM 1030 OE2 GLU A 63 28.494 22.307 -16.616 1.00 0.00 O ATOM 0 H GLU A 63 23.459 20.506 -16.820 1.00 0.00 H new ATOM 0 HA GLU A 63 25.780 21.596 -15.765 1.00 0.00 H new ATOM 0 HB2 GLU A 63 25.432 20.318 -17.916 1.00 0.00 H new ATOM 0 HB3 GLU A 63 24.753 21.774 -18.616 1.00 0.00 H new ATOM 0 HG2 GLU A 63 27.099 21.479 -19.238 1.00 0.00 H new ATOM 0 HG3 GLU A 63 26.852 22.957 -18.330 1.00 0.00 H new ATOM 1037 N VAL A 64 23.812 23.885 -17.045 1.00 0.00 N ATOM 1038 CA VAL A 64 23.518 25.311 -17.020 1.00 0.00 C ATOM 1039 C VAL A 64 22.699 25.737 -15.774 1.00 0.00 C ATOM 1040 O VAL A 64 22.964 26.772 -15.192 1.00 0.00 O ATOM 1041 CB VAL A 64 22.845 25.745 -18.347 1.00 0.00 C ATOM 1042 CG1 VAL A 64 22.428 24.528 -19.144 1.00 0.00 C ATOM 1043 CG2 VAL A 64 21.667 26.647 -18.108 1.00 0.00 C ATOM 0 H VAL A 64 23.142 23.328 -17.575 1.00 0.00 H new ATOM 0 HA VAL A 64 24.467 25.841 -16.933 1.00 0.00 H new ATOM 0 HB VAL A 64 23.578 26.313 -18.920 1.00 0.00 H new ATOM 0 HG11 VAL A 64 21.957 24.846 -20.074 1.00 0.00 H new ATOM 0 HG12 VAL A 64 23.306 23.923 -19.371 1.00 0.00 H new ATOM 0 HG13 VAL A 64 21.721 23.937 -18.562 1.00 0.00 H new ATOM 0 HG21 VAL A 64 21.224 26.928 -19.064 1.00 0.00 H new ATOM 0 HG22 VAL A 64 20.925 26.124 -17.504 1.00 0.00 H new ATOM 0 HG23 VAL A 64 21.996 27.544 -17.583 1.00 0.00 H new ATOM 1053 N LEU A 65 21.727 24.920 -15.377 1.00 0.00 N ATOM 1054 CA LEU A 65 20.852 25.231 -14.225 1.00 0.00 C ATOM 1055 C LEU A 65 21.617 25.262 -12.895 1.00 0.00 C ATOM 1056 O LEU A 65 21.223 25.956 -11.961 1.00 0.00 O ATOM 1057 CB LEU A 65 19.628 24.284 -14.174 1.00 0.00 C ATOM 1058 CG LEU A 65 18.363 24.761 -14.955 1.00 0.00 C ATOM 1059 CD1 LEU A 65 18.694 25.169 -16.380 1.00 0.00 C ATOM 1060 CD2 LEU A 65 17.289 23.685 -14.974 1.00 0.00 C ATOM 0 H LEU A 65 21.516 24.031 -15.831 1.00 0.00 H new ATOM 0 HA LEU A 65 20.474 26.242 -14.378 1.00 0.00 H new ATOM 0 HB2 LEU A 65 19.928 23.312 -14.566 1.00 0.00 H new ATOM 0 HB3 LEU A 65 19.352 24.135 -13.130 1.00 0.00 H new ATOM 0 HG LEU A 65 17.985 25.636 -14.426 1.00 0.00 H new ATOM 0 HD11 LEU A 65 17.785 25.494 -16.886 1.00 0.00 H new ATOM 0 HD12 LEU A 65 19.414 25.987 -16.366 1.00 0.00 H new ATOM 0 HD13 LEU A 65 19.121 24.319 -16.912 1.00 0.00 H new ATOM 0 HD21 LEU A 65 16.421 24.047 -15.525 1.00 0.00 H new ATOM 0 HD22 LEU A 65 17.679 22.790 -15.459 1.00 0.00 H new ATOM 0 HD23 LEU A 65 16.996 23.445 -13.952 1.00 0.00 H new ATOM 1072 N SER A 66 22.706 24.506 -12.806 1.00 0.00 N ATOM 1073 CA SER A 66 23.504 24.462 -11.586 1.00 0.00 C ATOM 1074 C SER A 66 24.245 25.796 -11.357 1.00 0.00 C ATOM 1075 O SER A 66 24.692 26.082 -10.243 1.00 0.00 O ATOM 1076 CB SER A 66 24.503 23.298 -11.638 1.00 0.00 C ATOM 1077 OG SER A 66 25.047 23.026 -10.356 1.00 0.00 O ATOM 0 H SER A 66 23.056 23.917 -13.562 1.00 0.00 H new ATOM 0 HA SER A 66 22.826 24.304 -10.748 1.00 0.00 H new ATOM 0 HB2 SER A 66 24.006 22.407 -12.021 1.00 0.00 H new ATOM 0 HB3 SER A 66 25.308 23.538 -12.333 1.00 0.00 H new ATOM 0 HG SER A 66 24.944 22.073 -10.153 1.00 0.00 H new ATOM 1083 N ASP A 67 24.368 26.600 -12.409 1.00 0.00 N ATOM 1084 CA ASP A 67 25.015 27.888 -12.324 1.00 0.00 C ATOM 1085 C ASP A 67 24.061 28.979 -12.754 1.00 0.00 C ATOM 1086 O ASP A 67 23.626 29.013 -13.903 1.00 0.00 O ATOM 1087 CB ASP A 67 26.256 27.920 -13.200 1.00 0.00 C ATOM 1088 CG ASP A 67 27.384 27.052 -12.681 1.00 0.00 C ATOM 1089 OD1 ASP A 67 28.032 27.440 -11.682 1.00 0.00 O ATOM 1090 OD2 ASP A 67 27.642 25.988 -13.274 1.00 0.00 O ATOM 0 H ASP A 67 24.020 26.370 -13.340 1.00 0.00 H new ATOM 0 HA ASP A 67 25.310 28.056 -11.288 1.00 0.00 H new ATOM 0 HB2 ASP A 67 25.990 27.594 -14.205 1.00 0.00 H new ATOM 0 HB3 ASP A 67 26.607 28.949 -13.281 1.00 0.00 H new ATOM 1095 N ALA A 68 23.750 29.882 -11.841 1.00 0.00 N ATOM 1096 CA ALA A 68 22.816 30.978 -12.110 1.00 0.00 C ATOM 1097 C ALA A 68 23.204 31.782 -13.356 1.00 0.00 C ATOM 1098 O ALA A 68 22.339 32.302 -14.056 1.00 0.00 O ATOM 1099 CB ALA A 68 22.709 31.893 -10.900 1.00 0.00 C ATOM 0 H ALA A 68 24.132 29.883 -10.895 1.00 0.00 H new ATOM 0 HA ALA A 68 21.842 30.529 -12.307 1.00 0.00 H new ATOM 0 HB1 ALA A 68 22.011 32.702 -11.116 1.00 0.00 H new ATOM 0 HB2 ALA A 68 22.349 31.323 -10.043 1.00 0.00 H new ATOM 0 HB3 ALA A 68 23.690 32.311 -10.672 1.00 0.00 H new ATOM 1105 N LYS A 69 24.502 31.881 -13.626 1.00 0.00 N ATOM 1106 CA LYS A 69 24.972 32.629 -14.780 1.00 0.00 C ATOM 1107 C LYS A 69 24.604 31.931 -16.072 1.00 0.00 C ATOM 1108 O LYS A 69 24.058 32.547 -16.979 1.00 0.00 O ATOM 1109 CB LYS A 69 26.482 32.864 -14.718 1.00 0.00 C ATOM 1110 CG LYS A 69 27.011 33.661 -15.901 1.00 0.00 C ATOM 1111 CD LYS A 69 28.499 33.918 -15.789 1.00 0.00 C ATOM 1112 CE LYS A 69 29.002 34.728 -16.975 1.00 0.00 C ATOM 1113 NZ LYS A 69 30.457 35.022 -16.880 1.00 0.00 N ATOM 0 H LYS A 69 25.240 31.455 -13.065 1.00 0.00 H new ATOM 0 HA LYS A 69 24.475 33.599 -14.758 1.00 0.00 H new ATOM 0 HB2 LYS A 69 26.724 33.391 -13.795 1.00 0.00 H new ATOM 0 HB3 LYS A 69 26.992 31.902 -14.679 1.00 0.00 H new ATOM 0 HG2 LYS A 69 26.805 33.120 -16.825 1.00 0.00 H new ATOM 0 HG3 LYS A 69 26.482 34.612 -15.964 1.00 0.00 H new ATOM 0 HD2 LYS A 69 28.711 34.452 -14.863 1.00 0.00 H new ATOM 0 HD3 LYS A 69 29.033 32.969 -15.739 1.00 0.00 H new ATOM 0 HE2 LYS A 69 28.803 34.181 -17.897 1.00 0.00 H new ATOM 0 HE3 LYS A 69 28.447 35.664 -17.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 30.754 35.575 -17.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 30.645 35.567 -16.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 30.990 34.130 -16.850 1.00 0.00 H new ATOM 1127 N LYS A 70 24.875 30.635 -16.140 1.00 0.00 N ATOM 1128 CA LYS A 70 24.608 29.865 -17.322 1.00 0.00 C ATOM 1129 C LYS A 70 23.114 29.825 -17.579 1.00 0.00 C ATOM 1130 O LYS A 70 22.655 29.903 -18.727 1.00 0.00 O ATOM 1131 CB LYS A 70 25.184 28.469 -17.150 1.00 0.00 C ATOM 1132 CG LYS A 70 26.694 28.488 -16.957 1.00 0.00 C ATOM 1133 CD LYS A 70 27.259 27.116 -16.662 1.00 0.00 C ATOM 1134 CE LYS A 70 27.150 26.193 -17.853 1.00 0.00 C ATOM 1135 NZ LYS A 70 27.791 24.886 -17.577 1.00 0.00 N ATOM 0 H LYS A 70 25.285 30.100 -15.374 1.00 0.00 H new ATOM 0 HA LYS A 70 25.083 30.326 -18.188 1.00 0.00 H new ATOM 0 HB2 LYS A 70 24.716 27.988 -16.291 1.00 0.00 H new ATOM 0 HB3 LYS A 70 24.939 27.867 -18.025 1.00 0.00 H new ATOM 0 HG2 LYS A 70 27.167 28.886 -17.855 1.00 0.00 H new ATOM 0 HG3 LYS A 70 26.944 29.164 -16.139 1.00 0.00 H new ATOM 0 HD2 LYS A 70 28.305 27.209 -16.370 1.00 0.00 H new ATOM 0 HD3 LYS A 70 26.729 26.680 -15.815 1.00 0.00 H new ATOM 0 HE2 LYS A 70 26.100 26.041 -18.104 1.00 0.00 H new ATOM 0 HE3 LYS A 70 27.621 26.656 -18.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 27.976 24.394 -18.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 28.689 25.039 -17.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 27.159 24.307 -16.988 1.00 0.00 H new ATOM 1149 N ARG A 71 22.367 29.696 -16.491 1.00 0.00 N ATOM 1150 CA ARG A 71 20.914 29.722 -16.528 1.00 0.00 C ATOM 1151 C ARG A 71 20.420 31.045 -17.103 1.00 0.00 C ATOM 1152 O ARG A 71 19.536 31.069 -17.951 1.00 0.00 O ATOM 1153 CB ARG A 71 20.352 29.562 -15.114 1.00 0.00 C ATOM 1154 CG ARG A 71 18.839 29.539 -15.073 1.00 0.00 C ATOM 1155 CD ARG A 71 18.310 29.489 -13.652 1.00 0.00 C ATOM 1156 NE ARG A 71 16.850 29.523 -13.628 1.00 0.00 N ATOM 1157 CZ ARG A 71 16.117 29.810 -12.559 1.00 0.00 C ATOM 1158 NH1 ARG A 71 16.699 30.063 -11.397 1.00 0.00 N ATOM 1159 NH2 ARG A 71 14.792 29.847 -12.651 1.00 0.00 N ATOM 0 H ARG A 71 22.754 29.570 -15.556 1.00 0.00 H new ATOM 0 HA ARG A 71 20.574 28.901 -17.159 1.00 0.00 H new ATOM 0 HB2 ARG A 71 20.735 28.638 -14.680 1.00 0.00 H new ATOM 0 HB3 ARG A 71 20.714 30.380 -14.491 1.00 0.00 H new ATOM 0 HG2 ARG A 71 18.449 30.425 -15.574 1.00 0.00 H new ATOM 0 HG3 ARG A 71 18.474 28.674 -15.626 1.00 0.00 H new ATOM 0 HD2 ARG A 71 18.663 28.582 -13.162 1.00 0.00 H new ATOM 0 HD3 ARG A 71 18.705 30.332 -13.085 1.00 0.00 H new ATOM 0 HE ARG A 71 16.358 29.311 -14.496 1.00 0.00 H new ATOM 0 HH11 ARG A 71 17.716 30.038 -11.320 1.00 0.00 H new ATOM 0 HH12 ARG A 71 16.131 30.283 -10.579 1.00 0.00 H new ATOM 0 HH21 ARG A 71 14.337 29.655 -13.544 1.00 0.00 H new ATOM 0 HH22 ARG A 71 14.230 30.068 -11.829 1.00 0.00 H new ATOM 1173 N GLU A 72 21.045 32.132 -16.662 1.00 0.00 N ATOM 1174 CA GLU A 72 20.639 33.458 -17.029 1.00 0.00 C ATOM 1175 C GLU A 72 20.831 33.681 -18.506 1.00 0.00 C ATOM 1176 O GLU A 72 20.004 34.315 -19.158 1.00 0.00 O ATOM 1177 CB GLU A 72 21.422 34.492 -16.214 1.00 0.00 C ATOM 1178 CG GLU A 72 21.111 35.917 -16.590 1.00 0.00 C ATOM 1179 CD GLU A 72 21.871 36.933 -15.767 1.00 0.00 C ATOM 1180 OE1 GLU A 72 23.086 37.120 -16.015 1.00 0.00 O ATOM 1181 OE2 GLU A 72 21.256 37.571 -14.877 1.00 0.00 O ATOM 0 H GLU A 72 21.851 32.103 -16.037 1.00 0.00 H new ATOM 0 HA GLU A 72 19.578 33.575 -16.807 1.00 0.00 H new ATOM 0 HB2 GLU A 72 21.204 34.349 -15.156 1.00 0.00 H new ATOM 0 HB3 GLU A 72 22.489 34.315 -16.347 1.00 0.00 H new ATOM 0 HG2 GLU A 72 21.344 36.066 -17.644 1.00 0.00 H new ATOM 0 HG3 GLU A 72 20.041 36.091 -16.472 1.00 0.00 H new ATOM 1188 N LEU A 73 21.908 33.141 -19.042 1.00 0.00 N ATOM 1189 CA LEU A 73 22.189 33.283 -20.433 1.00 0.00 C ATOM 1190 C LEU A 73 21.110 32.563 -21.245 1.00 0.00 C ATOM 1191 O LEU A 73 20.624 33.082 -22.252 1.00 0.00 O ATOM 1192 CB LEU A 73 23.561 32.693 -20.742 1.00 0.00 C ATOM 1193 CG LEU A 73 24.704 33.129 -19.820 1.00 0.00 C ATOM 1194 CD1 LEU A 73 26.036 32.631 -20.332 1.00 0.00 C ATOM 1195 CD2 LEU A 73 24.718 34.634 -19.623 1.00 0.00 C ATOM 0 H LEU A 73 22.598 32.600 -18.521 1.00 0.00 H new ATOM 0 HA LEU A 73 22.192 34.340 -20.700 1.00 0.00 H new ATOM 0 HB2 LEU A 73 23.484 31.606 -20.703 1.00 0.00 H new ATOM 0 HB3 LEU A 73 23.826 32.957 -21.766 1.00 0.00 H new ATOM 0 HG LEU A 73 24.530 32.675 -18.844 1.00 0.00 H new ATOM 0 HD11 LEU A 73 26.829 32.955 -19.658 1.00 0.00 H new ATOM 0 HD12 LEU A 73 26.023 31.542 -20.380 1.00 0.00 H new ATOM 0 HD13 LEU A 73 26.218 33.036 -21.328 1.00 0.00 H new ATOM 0 HD21 LEU A 73 25.542 34.907 -18.964 1.00 0.00 H new ATOM 0 HD22 LEU A 73 24.847 35.126 -20.587 1.00 0.00 H new ATOM 0 HD23 LEU A 73 23.776 34.951 -19.177 1.00 0.00 H new ATOM 1207 N TYR A 74 20.738 31.362 -20.787 1.00 0.00 N ATOM 1208 CA TYR A 74 19.704 30.571 -21.445 1.00 0.00 C ATOM 1209 C TYR A 74 18.356 31.272 -21.400 1.00 0.00 C ATOM 1210 O TYR A 74 17.675 31.401 -22.412 1.00 0.00 O ATOM 1211 CB TYR A 74 19.583 29.183 -20.813 1.00 0.00 C ATOM 1212 CG TYR A 74 18.582 28.294 -21.532 1.00 0.00 C ATOM 1213 CD1 TYR A 74 18.886 27.745 -22.774 1.00 0.00 C ATOM 1214 CD2 TYR A 74 17.334 28.017 -20.982 1.00 0.00 C ATOM 1215 CE1 TYR A 74 17.980 26.946 -23.443 1.00 0.00 C ATOM 1216 CE2 TYR A 74 16.422 27.213 -21.651 1.00 0.00 C ATOM 1217 CZ TYR A 74 16.752 26.684 -22.879 1.00 0.00 C ATOM 1218 OH TYR A 74 15.845 25.885 -23.548 1.00 0.00 O ATOM 0 H TYR A 74 21.142 30.920 -19.961 1.00 0.00 H new ATOM 0 HA TYR A 74 20.004 30.459 -22.487 1.00 0.00 H new ATOM 0 HB2 TYR A 74 20.560 28.700 -20.818 1.00 0.00 H new ATOM 0 HB3 TYR A 74 19.285 29.288 -19.770 1.00 0.00 H new ATOM 0 HD1 TYR A 74 19.847 27.947 -23.223 1.00 0.00 H new ATOM 0 HD2 TYR A 74 17.072 28.434 -20.021 1.00 0.00 H new ATOM 0 HE1 TYR A 74 18.234 26.528 -24.406 1.00 0.00 H new ATOM 0 HE2 TYR A 74 15.458 27.003 -21.211 1.00 0.00 H new ATOM 0 HH TYR A 74 15.191 25.528 -22.911 1.00 0.00 H new ATOM 1228 N ASP A 75 17.992 31.730 -20.216 1.00 0.00 N ATOM 1229 CA ASP A 75 16.703 32.404 -20.001 1.00 0.00 C ATOM 1230 C ASP A 75 16.603 33.669 -20.827 1.00 0.00 C ATOM 1231 O ASP A 75 15.530 34.009 -21.327 1.00 0.00 O ATOM 1232 CB ASP A 75 16.496 32.758 -18.524 1.00 0.00 C ATOM 1233 CG ASP A 75 16.232 31.557 -17.637 1.00 0.00 C ATOM 1234 OD1 ASP A 75 15.374 30.714 -17.992 1.00 0.00 O ATOM 1235 OD2 ASP A 75 16.850 31.464 -16.566 1.00 0.00 O ATOM 0 H ASP A 75 18.568 31.652 -19.378 1.00 0.00 H new ATOM 0 HA ASP A 75 15.927 31.705 -20.313 1.00 0.00 H new ATOM 0 HB2 ASP A 75 17.380 33.281 -18.158 1.00 0.00 H new ATOM 0 HB3 ASP A 75 15.659 33.451 -18.440 1.00 0.00 H new ATOM 1240 N LYS A 76 17.726 34.351 -20.984 1.00 0.00 N ATOM 1241 CA LYS A 76 17.760 35.614 -21.697 1.00 0.00 C ATOM 1242 C LYS A 76 17.766 35.387 -23.209 1.00 0.00 C ATOM 1243 O LYS A 76 17.484 36.307 -23.987 1.00 0.00 O ATOM 1244 CB LYS A 76 18.996 36.408 -21.272 1.00 0.00 C ATOM 1245 CG LYS A 76 19.038 37.837 -21.765 1.00 0.00 C ATOM 1246 CD LYS A 76 20.275 38.547 -21.256 1.00 0.00 C ATOM 1247 CE LYS A 76 20.297 40.006 -21.675 1.00 0.00 C ATOM 1248 NZ LYS A 76 20.242 40.167 -23.150 1.00 0.00 N ATOM 0 H LYS A 76 18.631 34.047 -20.624 1.00 0.00 H new ATOM 0 HA LYS A 76 16.864 36.182 -21.448 1.00 0.00 H new ATOM 0 HB2 LYS A 76 19.049 36.413 -20.183 1.00 0.00 H new ATOM 0 HB3 LYS A 76 19.884 35.889 -21.632 1.00 0.00 H new ATOM 0 HG2 LYS A 76 19.028 37.851 -22.855 1.00 0.00 H new ATOM 0 HG3 LYS A 76 18.146 38.367 -21.432 1.00 0.00 H new ATOM 0 HD2 LYS A 76 20.312 38.480 -20.169 1.00 0.00 H new ATOM 0 HD3 LYS A 76 21.165 38.046 -21.636 1.00 0.00 H new ATOM 0 HE2 LYS A 76 19.452 40.525 -21.223 1.00 0.00 H new ATOM 0 HE3 LYS A 76 21.202 40.478 -21.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 20.429 41.160 -23.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 20.960 39.558 -23.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 19.299 39.896 -23.494 1.00 0.00 H new ATOM 1262 N GLY A 77 18.069 34.167 -23.620 1.00 0.00 N ATOM 1263 CA GLY A 77 18.095 33.845 -25.027 1.00 0.00 C ATOM 1264 C GLY A 77 16.831 33.126 -25.466 1.00 0.00 C ATOM 1265 O GLY A 77 15.859 33.803 -25.859 1.00 0.00 O ATOM 1266 OXT GLY A 77 16.799 31.875 -25.410 1.00 0.00 O ATOM 0 H GLY A 77 18.298 33.391 -22.999 1.00 0.00 H new ATOM 0 HA2 GLY A 77 18.212 34.760 -25.607 1.00 0.00 H new ATOM 0 HA3 GLY A 77 18.962 33.219 -25.240 1.00 0.00 H new TER 1270 GLY A 77