USER MOD reduce.3.24.130724 H: found=0, std=0, add=889, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 883 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 60 ASN : amide:sc= -8.15! C(o=-14!,f=-21!) USER MOD Set 1.2: A 62 CYS SG : rot 180:sc= -6.11! USER MOD Set 2.1: A 56 MET CE :methyl -172:sc= -2.87 (180deg=-3.13) USER MOD Set 2.2: A 69 TYR OH : rot 114:sc= -1.91! USER MOD Set 3.1: A 44 SER OG : rot 180:sc= -0.454 USER MOD Set 3.2: A 48 THR OG1 : rot 76:sc= 0.886 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 51:sc= 0.324 USER MOD Single : A 3 HIS : no HD1:sc= -0.398 K(o=-0.4,f=-2.7!) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 8 SER OG : rot 180:sc= -0.434 USER MOD Single : A 9 LYS NZ :NH3+ -150:sc= -0.215 (180deg=-1.27!) USER MOD Single : A 10 ASN :FLIP amide:sc= -2.53 F(o=-5!,f=-2.5) USER MOD Single : A 15 THR OG1 : rot 67:sc= 1.15 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 HIS : no HD1:sc= -3.73! C(o=-3.7!,f=-7.8!) USER MOD Single : A 20 HIS : no HD1:sc= -0.0696 X(o=-0.07,f=-0.067) USER MOD Single : A 21 LYS NZ :NH3+ 148:sc= -0.0926 (180deg=-1.07) USER MOD Single : A 25 GLN : amide:sc= -0.516 K(o=-0.52,f=-1.6) USER MOD Single : A 28 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0576) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot -73:sc= -6.8! USER MOD Single : A 40 HIS :FLIP no HD1:sc= -5.08! C(o=-5.6!,f=-5.1!) USER MOD Single : A 43 GLN : amide:sc= -0.772 K(o=-0.77,f=-1.9) USER MOD Single : A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 50 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.377) USER MOD Single : A 54 SER OG : rot -69:sc=-0.00694 USER MOD Single : A 57 ASN : amide:sc= -7.3! C(o=-7.3!,f=-7!) USER MOD Single : A 58 LYS NZ :NH3+ -112:sc= -0.788 (180deg=-1.6!) USER MOD Single : A 61 ASN : amide:sc= -2.55 K(o=-2.6,f=-5.5!) USER MOD Single : A 64 THR OG1 : rot -46:sc= 0.793 USER MOD Single : A 65 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 TYR OH : rot -15:sc= -3.3! USER MOD Single : A 77 TYR OH : rot 117:sc= -4.05! USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= -0.131 X(o=-0.13,f=0) USER MOD Single : A 82 SER OG : rot 166:sc= -2.32! USER MOD Single : A 83 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0227) USER MOD Single : A 84 ASN : amide:sc= -4.42! C(o=-4.4!,f=-4.9!) USER MOD Single : A 85 ASN : amide:sc= -2.4 K(o=-2.4,f=-7.2!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 HIS : no HD1:sc= -0.224 X(o=-0.22,f=-0.02) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 ASN :FLIP amide:sc= -0.145 F(o=-2.1!,f=-0.14) USER MOD Single : A 98 THR OG1 : rot 180:sc= -2.22! USER MOD Single : A 104 THR OG1 : rot 55:sc= 0.551 USER MOD Single : A 105 CYS SG : rot 158:sc= -5.41! USER MOD Single : A 108 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.105) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 3.768 15.378 -6.230 1.00 0.00 N ATOM 2 CA GLY A 1 4.114 15.463 -7.675 1.00 0.00 C ATOM 3 C GLY A 1 5.098 14.350 -8.043 1.00 0.00 C ATOM 4 O GLY A 1 6.101 14.160 -7.384 1.00 0.00 O ATOM 0 H1 GLY A 1 3.099 16.137 -5.988 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.331 14.455 -6.031 1.00 0.00 H new ATOM 0 H3 GLY A 1 4.631 15.482 -5.660 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.211 15.376 -8.279 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.553 16.436 -7.896 1.00 0.00 H new ATOM 10 N SER A 2 4.786 13.636 -9.090 1.00 0.00 N ATOM 11 CA SER A 2 5.684 12.534 -9.515 1.00 0.00 C ATOM 12 C SER A 2 5.293 12.023 -10.898 1.00 0.00 C ATOM 13 O SER A 2 4.368 11.250 -11.038 1.00 0.00 O ATOM 14 CB SER A 2 5.552 11.382 -8.505 1.00 0.00 C ATOM 15 OG SER A 2 4.161 11.318 -8.233 1.00 0.00 O ATOM 0 H SER A 2 3.953 13.769 -9.664 1.00 0.00 H new ATOM 0 HA SER A 2 6.709 12.903 -9.555 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.921 10.444 -8.920 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.127 11.578 -7.600 1.00 0.00 H new ATOM 0 HG SER A 2 3.664 11.287 -9.077 1.00 0.00 H new ATOM 21 N HIS A 3 6.007 12.469 -11.897 1.00 0.00 N ATOM 22 CA HIS A 3 5.691 12.021 -13.276 1.00 0.00 C ATOM 23 C HIS A 3 6.406 10.713 -13.596 1.00 0.00 C ATOM 24 O HIS A 3 6.818 9.995 -12.704 1.00 0.00 O ATOM 25 CB HIS A 3 6.172 13.103 -14.255 1.00 0.00 C ATOM 26 CG HIS A 3 7.456 13.735 -13.717 1.00 0.00 C ATOM 27 ND1 HIS A 3 8.397 13.101 -13.197 1.00 0.00 N ATOM 28 CD2 HIS A 3 7.841 15.060 -13.687 1.00 0.00 C ATOM 29 CE1 HIS A 3 9.336 13.875 -12.838 1.00 0.00 C ATOM 30 NE2 HIS A 3 9.072 15.153 -13.112 1.00 0.00 N ATOM 0 H HIS A 3 6.789 13.119 -11.815 1.00 0.00 H new ATOM 0 HA HIS A 3 4.616 11.861 -13.365 1.00 0.00 H new ATOM 0 HB2 HIS A 3 6.352 12.667 -15.238 1.00 0.00 H new ATOM 0 HB3 HIS A 3 5.403 13.865 -14.380 1.00 0.00 H new ATOM 0 HD2 HIS A 3 7.259 15.890 -14.060 1.00 0.00 H new ATOM 0 HE1 HIS A 3 10.246 13.537 -12.364 1.00 0.00 H new ATOM 0 HE2 HIS A 3 9.641 15.981 -12.937 1.00 0.00 H new ATOM 38 N MET A 4 6.542 10.421 -14.861 1.00 0.00 N ATOM 39 CA MET A 4 7.226 9.164 -15.243 1.00 0.00 C ATOM 40 C MET A 4 6.653 7.988 -14.457 1.00 0.00 C ATOM 41 O MET A 4 7.306 7.423 -13.602 1.00 0.00 O ATOM 42 CB MET A 4 8.719 9.309 -14.909 1.00 0.00 C ATOM 43 CG MET A 4 9.379 10.209 -15.956 1.00 0.00 C ATOM 44 SD MET A 4 11.172 10.435 -15.849 1.00 0.00 S ATOM 45 CE MET A 4 11.320 11.698 -17.140 1.00 0.00 C ATOM 0 H MET A 4 6.211 10.995 -15.636 1.00 0.00 H new ATOM 0 HA MET A 4 7.082 8.979 -16.307 1.00 0.00 H new ATOM 0 HB2 MET A 4 8.842 9.736 -13.914 1.00 0.00 H new ATOM 0 HB3 MET A 4 9.199 8.330 -14.897 1.00 0.00 H new ATOM 0 HG2 MET A 4 9.149 9.804 -16.941 1.00 0.00 H new ATOM 0 HG3 MET A 4 8.912 11.192 -15.898 1.00 0.00 H new ATOM 0 HE1 MET A 4 12.365 11.990 -17.245 1.00 0.00 H new ATOM 0 HE2 MET A 4 10.959 11.295 -18.086 1.00 0.00 H new ATOM 0 HE3 MET A 4 10.725 12.570 -16.866 1.00 0.00 H new ATOM 55 N PRO A 5 5.426 7.646 -14.777 1.00 0.00 N ATOM 56 CA PRO A 5 4.735 6.541 -14.118 1.00 0.00 C ATOM 57 C PRO A 5 5.447 5.212 -14.356 1.00 0.00 C ATOM 58 O PRO A 5 4.884 4.157 -14.141 1.00 0.00 O ATOM 59 CB PRO A 5 3.333 6.507 -14.769 1.00 0.00 C ATOM 60 CG PRO A 5 3.281 7.659 -15.822 1.00 0.00 C ATOM 61 CD PRO A 5 4.658 8.343 -15.815 1.00 0.00 C ATOM 0 HA PRO A 5 4.700 6.684 -13.038 1.00 0.00 H new ATOM 0 HB2 PRO A 5 3.154 5.543 -15.245 1.00 0.00 H new ATOM 0 HB3 PRO A 5 2.556 6.640 -14.016 1.00 0.00 H new ATOM 0 HG2 PRO A 5 3.052 7.265 -16.812 1.00 0.00 H new ATOM 0 HG3 PRO A 5 2.496 8.373 -15.573 1.00 0.00 H new ATOM 0 HD2 PRO A 5 5.144 8.261 -16.787 1.00 0.00 H new ATOM 0 HD3 PRO A 5 4.569 9.406 -15.592 1.00 0.00 H new ATOM 69 N ARG A 6 6.670 5.290 -14.796 1.00 0.00 N ATOM 70 CA ARG A 6 7.433 4.045 -15.053 1.00 0.00 C ATOM 71 C ARG A 6 7.377 3.113 -13.846 1.00 0.00 C ATOM 72 O ARG A 6 7.807 1.978 -13.920 1.00 0.00 O ATOM 73 CB ARG A 6 8.898 4.424 -15.321 1.00 0.00 C ATOM 74 CG ARG A 6 8.976 5.225 -16.624 1.00 0.00 C ATOM 75 CD ARG A 6 8.959 4.262 -17.813 1.00 0.00 C ATOM 76 NE ARG A 6 10.273 4.334 -18.509 1.00 0.00 N ATOM 77 CZ ARG A 6 10.417 5.148 -19.517 1.00 0.00 C ATOM 78 NH1 ARG A 6 9.913 4.815 -20.671 1.00 0.00 N ATOM 79 NH2 ARG A 6 11.064 6.267 -19.335 1.00 0.00 N ATOM 0 H ARG A 6 7.170 6.158 -14.987 1.00 0.00 H new ATOM 0 HA ARG A 6 6.997 3.530 -15.909 1.00 0.00 H new ATOM 0 HB2 ARG A 6 9.292 5.013 -14.493 1.00 0.00 H new ATOM 0 HB3 ARG A 6 9.512 3.526 -15.394 1.00 0.00 H new ATOM 0 HG2 ARG A 6 8.136 5.917 -16.690 1.00 0.00 H new ATOM 0 HG3 ARG A 6 9.885 5.826 -16.641 1.00 0.00 H new ATOM 0 HD2 ARG A 6 8.768 3.245 -17.472 1.00 0.00 H new ATOM 0 HD3 ARG A 6 8.154 4.524 -18.499 1.00 0.00 H new ATOM 0 HE ARG A 6 11.052 3.753 -18.200 1.00 0.00 H new ATOM 0 HH11 ARG A 6 9.416 3.930 -20.774 1.00 0.00 H new ATOM 0 HH12 ARG A 6 10.015 5.439 -21.471 1.00 0.00 H new ATOM 0 HH21 ARG A 6 11.446 6.491 -18.416 1.00 0.00 H new ATOM 0 HH22 ARG A 6 11.187 6.917 -20.111 1.00 0.00 H new ATOM 93 N ASN A 7 6.845 3.617 -12.755 1.00 0.00 N ATOM 94 CA ASN A 7 6.744 2.787 -11.519 1.00 0.00 C ATOM 95 C ASN A 7 5.288 2.596 -11.113 1.00 0.00 C ATOM 96 O ASN A 7 4.387 2.860 -11.884 1.00 0.00 O ATOM 97 CB ASN A 7 7.480 3.520 -10.386 1.00 0.00 C ATOM 98 CG ASN A 7 8.695 4.253 -10.963 1.00 0.00 C ATOM 99 OD1 ASN A 7 9.529 3.669 -11.625 1.00 0.00 O ATOM 100 ND2 ASN A 7 8.832 5.531 -10.733 1.00 0.00 N ATOM 0 H ASN A 7 6.479 4.565 -12.671 1.00 0.00 H new ATOM 0 HA ASN A 7 7.185 1.808 -11.708 1.00 0.00 H new ATOM 0 HB2 ASN A 7 6.810 4.229 -9.901 1.00 0.00 H new ATOM 0 HB3 ASN A 7 7.798 2.809 -9.624 1.00 0.00 H new ATOM 0 HD21 ASN A 7 9.636 6.033 -11.109 1.00 0.00 H new ATOM 0 HD22 ASN A 7 8.135 6.027 -10.178 1.00 0.00 H new ATOM 107 N SER A 8 5.083 2.139 -9.904 1.00 0.00 N ATOM 108 CA SER A 8 3.689 1.927 -9.434 1.00 0.00 C ATOM 109 C SER A 8 3.667 1.422 -7.992 1.00 0.00 C ATOM 110 O SER A 8 2.644 1.455 -7.336 1.00 0.00 O ATOM 111 CB SER A 8 3.032 0.871 -10.337 1.00 0.00 C ATOM 112 OG SER A 8 4.127 0.126 -10.853 1.00 0.00 O ATOM 0 H SER A 8 5.814 1.907 -9.232 1.00 0.00 H new ATOM 0 HA SER A 8 3.152 2.874 -9.477 1.00 0.00 H new ATOM 0 HB2 SER A 8 2.348 0.236 -9.775 1.00 0.00 H new ATOM 0 HB3 SER A 8 2.453 1.334 -11.136 1.00 0.00 H new ATOM 0 HG SER A 8 3.793 -0.579 -11.446 1.00 0.00 H new ATOM 118 N LYS A 9 4.798 0.965 -7.524 1.00 0.00 N ATOM 119 CA LYS A 9 4.862 0.454 -6.129 1.00 0.00 C ATOM 120 C LYS A 9 4.579 1.567 -5.124 1.00 0.00 C ATOM 121 O LYS A 9 3.946 1.346 -4.113 1.00 0.00 O ATOM 122 CB LYS A 9 6.282 -0.087 -5.880 1.00 0.00 C ATOM 123 CG LYS A 9 6.267 -1.017 -4.657 1.00 0.00 C ATOM 124 CD LYS A 9 6.230 -0.176 -3.373 1.00 0.00 C ATOM 125 CE LYS A 9 7.363 -0.621 -2.446 1.00 0.00 C ATOM 126 NZ LYS A 9 7.362 -2.103 -2.290 1.00 0.00 N ATOM 0 H LYS A 9 5.674 0.924 -8.045 1.00 0.00 H new ATOM 0 HA LYS A 9 4.112 -0.326 -6.002 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.636 -0.628 -6.758 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.974 0.739 -5.714 1.00 0.00 H new ATOM 0 HG2 LYS A 9 5.399 -1.675 -4.698 1.00 0.00 H new ATOM 0 HG3 LYS A 9 7.151 -1.655 -4.661 1.00 0.00 H new ATOM 0 HD2 LYS A 9 6.336 0.882 -3.614 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.268 -0.295 -2.874 1.00 0.00 H new ATOM 0 HE2 LYS A 9 8.321 -0.293 -2.850 1.00 0.00 H new ATOM 0 HE3 LYS A 9 7.250 -0.147 -1.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 7.734 -2.354 -1.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 6.390 -2.461 -2.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 7.961 -2.530 -3.025 1.00 0.00 H new ATOM 140 N ASN A 10 5.058 2.745 -5.420 1.00 0.00 N ATOM 141 CA ASN A 10 4.825 3.880 -4.492 1.00 0.00 C ATOM 142 C ASN A 10 3.350 3.996 -4.121 1.00 0.00 C ATOM 143 O ASN A 10 3.015 4.334 -3.003 1.00 0.00 O ATOM 144 CB ASN A 10 5.263 5.177 -5.192 1.00 0.00 C ATOM 145 CG ASN A 10 4.843 5.127 -6.662 1.00 0.00 C ATOM 146 OD1 ASN A 10 3.587 5.307 -6.969 1.00 0.00 O flip ATOM 147 ND2 ASN A 10 5.654 4.924 -7.544 1.00 0.00 N flip ATOM 0 H ASN A 10 5.596 2.966 -6.258 1.00 0.00 H new ATOM 0 HA ASN A 10 5.397 3.711 -3.580 1.00 0.00 H new ATOM 0 HB2 ASN A 10 4.810 6.039 -4.702 1.00 0.00 H new ATOM 0 HB3 ASN A 10 6.344 5.298 -5.115 1.00 0.00 H new ATOM 0 HD21 ASN A 10 6.637 4.783 -7.310 1.00 0.00 H new ATOM 0 HD22 ASN A 10 5.352 4.895 -8.518 1.00 0.00 H new ATOM 154 N ASP A 11 2.494 3.712 -5.063 1.00 0.00 N ATOM 155 CA ASP A 11 1.041 3.801 -4.777 1.00 0.00 C ATOM 156 C ASP A 11 0.705 3.116 -3.458 1.00 0.00 C ATOM 157 O ASP A 11 -0.217 3.512 -2.772 1.00 0.00 O ATOM 158 CB ASP A 11 0.277 3.102 -5.911 1.00 0.00 C ATOM 159 CG ASP A 11 0.575 3.814 -7.233 1.00 0.00 C ATOM 160 OD1 ASP A 11 1.239 4.835 -7.159 1.00 0.00 O ATOM 161 OD2 ASP A 11 0.124 3.295 -8.240 1.00 0.00 O ATOM 0 H ASP A 11 2.738 3.424 -6.011 1.00 0.00 H new ATOM 0 HA ASP A 11 0.757 4.851 -4.706 1.00 0.00 H new ATOM 0 HB2 ASP A 11 0.573 2.055 -5.973 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -0.794 3.119 -5.708 1.00 0.00 H new ATOM 166 N GLY A 12 1.465 2.097 -3.130 1.00 0.00 N ATOM 167 CA GLY A 12 1.214 1.358 -1.852 1.00 0.00 C ATOM 168 C GLY A 12 0.839 -0.096 -2.139 1.00 0.00 C ATOM 169 O GLY A 12 0.461 -0.828 -1.245 1.00 0.00 O ATOM 0 H GLY A 12 2.243 1.747 -3.689 1.00 0.00 H new ATOM 0 HA2 GLY A 12 2.104 1.393 -1.224 1.00 0.00 H new ATOM 0 HA3 GLY A 12 0.412 1.844 -1.296 1.00 0.00 H new ATOM 173 N VAL A 13 0.947 -0.485 -3.381 1.00 0.00 N ATOM 174 CA VAL A 13 0.602 -1.882 -3.740 1.00 0.00 C ATOM 175 C VAL A 13 1.501 -2.399 -4.849 1.00 0.00 C ATOM 176 O VAL A 13 1.626 -1.784 -5.889 1.00 0.00 O ATOM 177 CB VAL A 13 -0.855 -1.913 -4.234 1.00 0.00 C ATOM 178 CG1 VAL A 13 -0.973 -1.098 -5.527 1.00 0.00 C ATOM 179 CG2 VAL A 13 -1.259 -3.361 -4.514 1.00 0.00 C ATOM 0 H VAL A 13 1.257 0.103 -4.155 1.00 0.00 H new ATOM 0 HA VAL A 13 0.735 -2.513 -2.861 1.00 0.00 H new ATOM 0 HB VAL A 13 -1.508 -1.487 -3.473 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -2.005 -1.119 -5.878 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -0.676 -0.067 -5.335 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -0.322 -1.527 -6.288 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -2.291 -3.390 -4.864 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -0.604 -3.780 -5.278 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.170 -3.947 -3.599 1.00 0.00 H new ATOM 189 N ASP A 14 2.110 -3.528 -4.611 1.00 0.00 N ATOM 190 CA ASP A 14 3.001 -4.098 -5.643 1.00 0.00 C ATOM 191 C ASP A 14 2.189 -4.978 -6.572 1.00 0.00 C ATOM 192 O ASP A 14 1.693 -6.013 -6.173 1.00 0.00 O ATOM 193 CB ASP A 14 4.079 -4.952 -4.952 1.00 0.00 C ATOM 194 CG ASP A 14 3.655 -5.239 -3.512 1.00 0.00 C ATOM 195 OD1 ASP A 14 3.921 -4.380 -2.688 1.00 0.00 O ATOM 196 OD2 ASP A 14 3.089 -6.302 -3.317 1.00 0.00 O ATOM 0 H ASP A 14 2.026 -4.072 -3.752 1.00 0.00 H new ATOM 0 HA ASP A 14 3.470 -3.297 -6.214 1.00 0.00 H new ATOM 0 HB2 ASP A 14 4.220 -5.887 -5.494 1.00 0.00 H new ATOM 0 HB3 ASP A 14 5.035 -4.429 -4.964 1.00 0.00 H new ATOM 201 N THR A 15 2.063 -4.551 -7.797 1.00 0.00 N ATOM 202 CA THR A 15 1.285 -5.344 -8.767 1.00 0.00 C ATOM 203 C THR A 15 1.897 -5.259 -10.158 1.00 0.00 C ATOM 204 O THR A 15 1.565 -4.384 -10.934 1.00 0.00 O ATOM 205 CB THR A 15 -0.131 -4.762 -8.808 1.00 0.00 C ATOM 206 OG1 THR A 15 0.017 -3.451 -9.319 1.00 0.00 O ATOM 207 CG2 THR A 15 -0.676 -4.559 -7.382 1.00 0.00 C ATOM 0 H THR A 15 2.467 -3.688 -8.161 1.00 0.00 H new ATOM 0 HA THR A 15 1.280 -6.391 -8.463 1.00 0.00 H new ATOM 0 HB THR A 15 -0.785 -5.419 -9.381 1.00 0.00 H new ATOM 0 HG1 THR A 15 0.312 -3.495 -10.252 1.00 0.00 H new ATOM 0 HG21 THR A 15 -1.683 -4.145 -7.433 1.00 0.00 H new ATOM 0 HG22 THR A 15 -0.704 -5.517 -6.863 1.00 0.00 H new ATOM 0 HG23 THR A 15 -0.028 -3.871 -6.839 1.00 0.00 H new ATOM 215 N ALA A 16 2.786 -6.171 -10.447 1.00 0.00 N ATOM 216 CA ALA A 16 3.433 -6.164 -11.780 1.00 0.00 C ATOM 217 C ALA A 16 3.688 -7.584 -12.263 1.00 0.00 C ATOM 218 O ALA A 16 4.735 -8.148 -12.014 1.00 0.00 O ATOM 219 CB ALA A 16 4.781 -5.435 -11.660 1.00 0.00 C ATOM 0 H ALA A 16 3.088 -6.915 -9.818 1.00 0.00 H new ATOM 0 HA ALA A 16 2.777 -5.664 -12.492 1.00 0.00 H new ATOM 0 HB1 ALA A 16 5.274 -5.419 -12.632 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.613 -4.413 -11.322 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.414 -5.956 -10.941 1.00 0.00 H new ATOM 225 N ILE A 17 2.722 -8.138 -12.946 1.00 0.00 N ATOM 226 CA ILE A 17 2.884 -9.508 -13.453 1.00 0.00 C ATOM 227 C ILE A 17 2.182 -9.666 -14.814 1.00 0.00 C ATOM 228 O ILE A 17 2.817 -9.563 -15.844 1.00 0.00 O ATOM 229 CB ILE A 17 2.287 -10.471 -12.427 1.00 0.00 C ATOM 230 CG1 ILE A 17 2.325 -11.863 -12.987 1.00 0.00 C ATOM 231 CG2 ILE A 17 0.828 -10.077 -12.130 1.00 0.00 C ATOM 232 CD1 ILE A 17 3.777 -12.207 -13.293 1.00 0.00 C ATOM 0 H ILE A 17 1.832 -7.692 -13.169 1.00 0.00 H new ATOM 0 HA ILE A 17 3.941 -9.728 -13.599 1.00 0.00 H new ATOM 0 HB ILE A 17 2.864 -10.426 -11.503 1.00 0.00 H new ATOM 0 HG12 ILE A 17 1.907 -12.573 -12.273 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.719 -11.927 -13.891 1.00 0.00 H new ATOM 0 HG21 ILE A 17 0.407 -10.766 -11.398 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.799 -9.063 -11.732 1.00 0.00 H new ATOM 0 HG23 ILE A 17 0.244 -10.123 -13.049 1.00 0.00 H new ATOM 0 HD11 ILE A 17 3.833 -13.216 -13.702 1.00 0.00 H new ATOM 0 HD12 ILE A 17 4.174 -11.498 -14.020 1.00 0.00 H new ATOM 0 HD13 ILE A 17 4.364 -12.154 -12.376 1.00 0.00 H new ATOM 244 N TYR A 18 0.893 -9.914 -14.801 1.00 0.00 N ATOM 245 CA TYR A 18 0.172 -10.070 -16.092 1.00 0.00 C ATOM 246 C TYR A 18 0.452 -8.861 -16.985 1.00 0.00 C ATOM 247 O TYR A 18 -0.006 -8.792 -18.106 1.00 0.00 O ATOM 248 CB TYR A 18 -1.345 -10.156 -15.830 1.00 0.00 C ATOM 249 CG TYR A 18 -1.631 -11.059 -14.625 1.00 0.00 C ATOM 250 CD1 TYR A 18 -0.846 -12.163 -14.367 1.00 0.00 C ATOM 251 CD2 TYR A 18 -2.686 -10.776 -13.781 1.00 0.00 C ATOM 252 CE1 TYR A 18 -1.112 -12.972 -13.280 1.00 0.00 C ATOM 253 CE2 TYR A 18 -2.953 -11.585 -12.695 1.00 0.00 C ATOM 254 CZ TYR A 18 -2.168 -12.689 -12.436 1.00 0.00 C ATOM 255 OH TYR A 18 -2.437 -13.503 -11.354 1.00 0.00 O ATOM 0 H TYR A 18 0.321 -10.013 -13.962 1.00 0.00 H new ATOM 0 HA TYR A 18 0.514 -10.980 -16.584 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -1.746 -9.159 -15.648 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -1.851 -10.547 -16.713 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -0.018 -12.396 -15.019 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -3.308 -9.914 -13.972 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -0.489 -13.833 -13.088 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -3.782 -11.352 -12.044 1.00 0.00 H new ATOM 0 HH TYR A 18 -3.214 -13.155 -10.868 1.00 0.00 H new ATOM 265 N HIS A 19 1.153 -7.902 -16.412 1.00 0.00 N ATOM 266 CA HIS A 19 1.520 -6.641 -17.142 1.00 0.00 C ATOM 267 C HIS A 19 1.887 -6.860 -18.603 1.00 0.00 C ATOM 268 O HIS A 19 2.093 -5.901 -19.319 1.00 0.00 O ATOM 269 CB HIS A 19 2.733 -6.019 -16.431 1.00 0.00 C ATOM 270 CG HIS A 19 3.965 -6.905 -16.648 1.00 0.00 C ATOM 271 ND1 HIS A 19 4.287 -7.428 -17.737 1.00 0.00 N ATOM 272 CD2 HIS A 19 4.944 -7.292 -15.751 1.00 0.00 C ATOM 273 CE1 HIS A 19 5.358 -8.099 -17.632 1.00 0.00 C ATOM 274 NE2 HIS A 19 5.855 -8.073 -16.394 1.00 0.00 N ATOM 0 H HIS A 19 1.491 -7.944 -15.451 1.00 0.00 H new ATOM 0 HA HIS A 19 0.642 -5.995 -17.129 1.00 0.00 H new ATOM 0 HB2 HIS A 19 2.920 -5.017 -16.818 1.00 0.00 H new ATOM 0 HB3 HIS A 19 2.529 -5.916 -15.365 1.00 0.00 H new ATOM 0 HD2 HIS A 19 4.980 -7.018 -14.707 1.00 0.00 H new ATOM 0 HE1 HIS A 19 5.816 -8.632 -18.452 1.00 0.00 H new ATOM 0 HE2 HIS A 19 6.695 -8.520 -16.027 1.00 0.00 H new ATOM 282 N HIS A 20 1.993 -8.096 -19.014 1.00 0.00 N ATOM 283 CA HIS A 20 2.351 -8.373 -20.433 1.00 0.00 C ATOM 284 C HIS A 20 1.766 -7.303 -21.370 1.00 0.00 C ATOM 285 O HIS A 20 2.495 -6.471 -21.874 1.00 0.00 O ATOM 286 CB HIS A 20 1.753 -9.742 -20.800 1.00 0.00 C ATOM 287 CG HIS A 20 2.473 -10.832 -20.000 1.00 0.00 C ATOM 288 ND1 HIS A 20 1.905 -11.699 -19.303 1.00 0.00 N ATOM 289 CD2 HIS A 20 3.826 -11.079 -19.863 1.00 0.00 C ATOM 290 CE1 HIS A 20 2.743 -12.466 -18.740 1.00 0.00 C ATOM 291 NE2 HIS A 20 4.003 -12.148 -19.039 1.00 0.00 N ATOM 0 H HIS A 20 1.848 -8.920 -18.431 1.00 0.00 H new ATOM 0 HA HIS A 20 3.435 -8.364 -20.546 1.00 0.00 H new ATOM 0 HB2 HIS A 20 0.685 -9.757 -20.581 1.00 0.00 H new ATOM 0 HB3 HIS A 20 1.862 -9.926 -21.869 1.00 0.00 H new ATOM 0 HD2 HIS A 20 4.617 -10.514 -20.334 1.00 0.00 H new ATOM 0 HE1 HIS A 20 2.467 -13.284 -18.091 1.00 0.00 H new ATOM 0 HE2 HIS A 20 4.870 -12.589 -18.732 1.00 0.00 H new ATOM 299 N LYS A 21 0.466 -7.336 -21.582 1.00 0.00 N ATOM 300 CA LYS A 21 -0.149 -6.310 -22.484 1.00 0.00 C ATOM 301 C LYS A 21 -0.788 -5.180 -21.664 1.00 0.00 C ATOM 302 O LYS A 21 -0.269 -4.084 -21.593 1.00 0.00 O ATOM 303 CB LYS A 21 -1.239 -6.991 -23.330 1.00 0.00 C ATOM 304 CG LYS A 21 -0.575 -7.816 -24.434 1.00 0.00 C ATOM 305 CD LYS A 21 0.088 -9.048 -23.815 1.00 0.00 C ATOM 306 CE LYS A 21 -0.151 -10.252 -24.728 1.00 0.00 C ATOM 307 NZ LYS A 21 0.126 -9.891 -26.147 1.00 0.00 N ATOM 0 H LYS A 21 -0.180 -8.014 -21.178 1.00 0.00 H new ATOM 0 HA LYS A 21 0.627 -5.885 -23.121 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -1.857 -7.632 -22.701 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -1.899 -6.241 -23.766 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -1.317 -8.120 -25.172 1.00 0.00 H new ATOM 0 HG3 LYS A 21 0.167 -7.214 -24.957 1.00 0.00 H new ATOM 0 HD2 LYS A 21 1.157 -8.877 -23.689 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -0.323 -9.239 -22.824 1.00 0.00 H new ATOM 0 HE2 LYS A 21 0.490 -11.079 -24.425 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -1.181 -10.594 -24.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 0.490 -10.724 -26.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -0.752 -9.567 -26.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 0.834 -9.130 -26.180 1.00 0.00 H new ATOM 321 N LEU A 22 -1.912 -5.484 -21.060 1.00 0.00 N ATOM 322 CA LEU A 22 -2.626 -4.466 -20.231 1.00 0.00 C ATOM 323 C LEU A 22 -3.454 -5.162 -19.159 1.00 0.00 C ATOM 324 O LEU A 22 -4.236 -4.539 -18.457 1.00 0.00 O ATOM 325 CB LEU A 22 -3.564 -3.638 -21.149 1.00 0.00 C ATOM 326 CG LEU A 22 -4.790 -4.475 -21.561 1.00 0.00 C ATOM 327 CD1 LEU A 22 -5.773 -3.578 -22.316 1.00 0.00 C ATOM 328 CD2 LEU A 22 -4.344 -5.608 -22.486 1.00 0.00 C ATOM 0 H LEU A 22 -2.366 -6.396 -21.107 1.00 0.00 H new ATOM 0 HA LEU A 22 -1.899 -3.810 -19.751 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -3.889 -2.737 -20.629 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -3.021 -3.315 -22.037 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.266 -4.890 -20.673 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -6.645 -4.162 -22.612 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.088 -2.758 -21.670 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.288 -3.174 -23.205 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -5.210 -6.201 -22.778 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -3.875 -5.188 -23.376 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -3.629 -6.243 -21.964 1.00 0.00 H new ATOM 340 N ARG A 23 -3.257 -6.443 -19.043 1.00 0.00 N ATOM 341 CA ARG A 23 -4.010 -7.209 -18.042 1.00 0.00 C ATOM 342 C ARG A 23 -3.720 -6.708 -16.642 1.00 0.00 C ATOM 343 O ARG A 23 -4.603 -6.647 -15.810 1.00 0.00 O ATOM 344 CB ARG A 23 -3.590 -8.681 -18.153 1.00 0.00 C ATOM 345 CG ARG A 23 -4.784 -9.506 -18.642 1.00 0.00 C ATOM 346 CD ARG A 23 -4.423 -10.990 -18.585 1.00 0.00 C ATOM 347 NE ARG A 23 -3.329 -11.259 -19.560 1.00 0.00 N ATOM 348 CZ ARG A 23 -3.629 -11.594 -20.789 1.00 0.00 C ATOM 349 NH1 ARG A 23 -4.140 -12.773 -21.014 1.00 0.00 N ATOM 350 NH2 ARG A 23 -3.409 -10.738 -21.749 1.00 0.00 N ATOM 0 H ARG A 23 -2.602 -6.986 -19.605 1.00 0.00 H new ATOM 0 HA ARG A 23 -5.078 -7.093 -18.228 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -2.754 -8.783 -18.845 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -3.249 -9.049 -17.185 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -5.658 -9.307 -18.021 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -5.046 -9.221 -19.661 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -4.106 -11.262 -17.578 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -5.296 -11.599 -18.820 1.00 0.00 H new ATOM 0 HE ARG A 23 -2.354 -11.183 -19.272 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -4.299 -13.416 -20.239 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -4.380 -13.052 -21.965 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -3.009 -9.824 -21.536 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -3.637 -10.983 -22.713 1.00 0.00 H new ATOM 364 N ASP A 24 -2.489 -6.357 -16.393 1.00 0.00 N ATOM 365 CA ASP A 24 -2.160 -5.863 -15.044 1.00 0.00 C ATOM 366 C ASP A 24 -2.987 -4.639 -14.728 1.00 0.00 C ATOM 367 O ASP A 24 -3.409 -4.439 -13.609 1.00 0.00 O ATOM 368 CB ASP A 24 -0.675 -5.482 -14.984 1.00 0.00 C ATOM 369 CG ASP A 24 -0.364 -4.874 -13.616 1.00 0.00 C ATOM 370 OD1 ASP A 24 -0.883 -3.796 -13.371 1.00 0.00 O ATOM 371 OD2 ASP A 24 0.377 -5.519 -12.893 1.00 0.00 O ATOM 0 H ASP A 24 -1.715 -6.392 -17.057 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.374 -6.649 -14.320 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.055 -6.362 -15.153 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -0.438 -4.769 -15.774 1.00 0.00 H new ATOM 376 N GLN A 25 -3.209 -3.841 -15.728 1.00 0.00 N ATOM 377 CA GLN A 25 -4.003 -2.626 -15.517 1.00 0.00 C ATOM 378 C GLN A 25 -5.408 -3.011 -15.175 1.00 0.00 C ATOM 379 O GLN A 25 -6.109 -2.286 -14.505 1.00 0.00 O ATOM 380 CB GLN A 25 -3.998 -1.812 -16.821 1.00 0.00 C ATOM 381 CG GLN A 25 -2.626 -1.936 -17.481 1.00 0.00 C ATOM 382 CD GLN A 25 -1.543 -1.545 -16.472 1.00 0.00 C ATOM 383 OE1 GLN A 25 -1.749 -0.709 -15.614 1.00 0.00 O ATOM 384 NE2 GLN A 25 -0.374 -2.124 -16.539 1.00 0.00 N ATOM 0 H GLN A 25 -2.871 -3.985 -16.680 1.00 0.00 H new ATOM 0 HA GLN A 25 -3.583 -2.034 -14.704 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -4.774 -2.176 -17.495 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -4.222 -0.766 -16.612 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -2.466 -2.958 -17.826 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -2.572 -1.291 -18.358 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -0.193 -2.827 -17.256 1.00 0.00 H new ATOM 0 HE22 GLN A 25 0.358 -1.874 -15.874 1.00 0.00 H new ATOM 393 N VAL A 26 -5.805 -4.152 -15.644 1.00 0.00 N ATOM 394 CA VAL A 26 -7.167 -4.599 -15.348 1.00 0.00 C ATOM 395 C VAL A 26 -7.237 -5.132 -13.931 1.00 0.00 C ATOM 396 O VAL A 26 -7.999 -4.646 -13.122 1.00 0.00 O ATOM 397 CB VAL A 26 -7.550 -5.704 -16.339 1.00 0.00 C ATOM 398 CG1 VAL A 26 -9.036 -6.011 -16.194 1.00 0.00 C ATOM 399 CG2 VAL A 26 -7.278 -5.216 -17.765 1.00 0.00 C ATOM 0 H VAL A 26 -5.244 -4.785 -16.215 1.00 0.00 H new ATOM 0 HA VAL A 26 -7.859 -3.762 -15.442 1.00 0.00 H new ATOM 0 HB VAL A 26 -6.964 -6.601 -16.136 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -9.315 -6.796 -16.896 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -9.241 -6.344 -15.177 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.616 -5.112 -16.405 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -7.548 -5.998 -18.475 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.872 -4.324 -17.964 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.220 -4.979 -17.873 1.00 0.00 H new ATOM 409 N LEU A 27 -6.439 -6.117 -13.644 1.00 0.00 N ATOM 410 CA LEU A 27 -6.462 -6.673 -12.276 1.00 0.00 C ATOM 411 C LEU A 27 -6.168 -5.561 -11.286 1.00 0.00 C ATOM 412 O LEU A 27 -6.529 -5.636 -10.126 1.00 0.00 O ATOM 413 CB LEU A 27 -5.381 -7.803 -12.180 1.00 0.00 C ATOM 414 CG LEU A 27 -4.188 -7.374 -11.292 1.00 0.00 C ATOM 415 CD1 LEU A 27 -4.534 -7.627 -9.825 1.00 0.00 C ATOM 416 CD2 LEU A 27 -2.965 -8.218 -11.654 1.00 0.00 C ATOM 0 H LEU A 27 -5.782 -6.554 -14.290 1.00 0.00 H new ATOM 0 HA LEU A 27 -7.440 -7.095 -12.045 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -5.833 -8.707 -11.771 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -5.022 -8.050 -13.179 1.00 0.00 H new ATOM 0 HG LEU A 27 -3.978 -6.316 -11.451 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -3.696 -7.326 -9.196 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -5.417 -7.048 -9.554 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -4.736 -8.688 -9.677 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -2.121 -7.921 -11.032 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -3.187 -9.272 -11.485 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.714 -8.064 -12.704 1.00 0.00 H new ATOM 428 N LYS A 28 -5.539 -4.524 -11.779 1.00 0.00 N ATOM 429 CA LYS A 28 -5.211 -3.391 -10.891 1.00 0.00 C ATOM 430 C LYS A 28 -6.386 -2.452 -10.819 1.00 0.00 C ATOM 431 O LYS A 28 -6.728 -1.963 -9.769 1.00 0.00 O ATOM 432 CB LYS A 28 -4.001 -2.641 -11.472 1.00 0.00 C ATOM 433 CG LYS A 28 -3.630 -1.484 -10.539 1.00 0.00 C ATOM 434 CD LYS A 28 -3.035 -0.343 -11.367 1.00 0.00 C ATOM 435 CE LYS A 28 -2.513 0.741 -10.423 1.00 0.00 C ATOM 436 NZ LYS A 28 -1.209 0.331 -9.833 1.00 0.00 N ATOM 0 H LYS A 28 -5.245 -4.422 -12.750 1.00 0.00 H new ATOM 0 HA LYS A 28 -4.980 -3.760 -9.892 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -3.156 -3.320 -11.582 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -4.237 -2.261 -12.466 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -4.512 -1.137 -10.001 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -2.912 -1.820 -9.791 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -2.226 -0.716 -11.995 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -3.791 0.071 -12.034 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -2.395 1.679 -10.966 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -3.238 0.921 -9.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -0.778 1.143 -9.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -1.363 -0.440 -9.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -0.574 0.003 -10.588 1.00 0.00 H new ATOM 450 N ALA A 29 -6.983 -2.209 -11.945 1.00 0.00 N ATOM 451 CA ALA A 29 -8.145 -1.300 -11.959 1.00 0.00 C ATOM 452 C ALA A 29 -9.271 -1.873 -11.122 1.00 0.00 C ATOM 453 O ALA A 29 -9.973 -1.156 -10.460 1.00 0.00 O ATOM 454 CB ALA A 29 -8.645 -1.160 -13.397 1.00 0.00 C ATOM 0 H ALA A 29 -6.717 -2.599 -12.849 1.00 0.00 H new ATOM 0 HA ALA A 29 -7.843 -0.334 -11.554 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.504 -0.490 -13.420 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -7.850 -0.752 -14.021 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.938 -2.139 -13.777 1.00 0.00 H new ATOM 460 N LEU A 30 -9.411 -3.165 -11.155 1.00 0.00 N ATOM 461 CA LEU A 30 -10.487 -3.794 -10.366 1.00 0.00 C ATOM 462 C LEU A 30 -10.146 -3.789 -8.888 1.00 0.00 C ATOM 463 O LEU A 30 -11.003 -3.584 -8.044 1.00 0.00 O ATOM 464 CB LEU A 30 -10.639 -5.247 -10.849 1.00 0.00 C ATOM 465 CG LEU A 30 -10.891 -5.241 -12.363 1.00 0.00 C ATOM 466 CD1 LEU A 30 -10.476 -6.587 -12.957 1.00 0.00 C ATOM 467 CD2 LEU A 30 -12.374 -5.022 -12.621 1.00 0.00 C ATOM 0 H LEU A 30 -8.828 -3.806 -11.693 1.00 0.00 H new ATOM 0 HA LEU A 30 -11.414 -3.237 -10.502 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.739 -5.817 -10.618 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -11.466 -5.733 -10.331 1.00 0.00 H new ATOM 0 HG LEU A 30 -10.310 -4.443 -12.825 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -10.656 -6.581 -14.032 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -9.416 -6.757 -12.767 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -11.060 -7.384 -12.496 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -12.560 -5.017 -13.695 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.946 -5.826 -12.158 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.680 -4.066 -12.195 1.00 0.00 H new ATOM 479 N TYR A 31 -8.897 -3.985 -8.598 1.00 0.00 N ATOM 480 CA TYR A 31 -8.478 -3.998 -7.182 1.00 0.00 C ATOM 481 C TYR A 31 -8.430 -2.597 -6.563 1.00 0.00 C ATOM 482 O TYR A 31 -8.954 -2.375 -5.489 1.00 0.00 O ATOM 483 CB TYR A 31 -7.073 -4.608 -7.114 1.00 0.00 C ATOM 484 CG TYR A 31 -6.507 -4.407 -5.710 1.00 0.00 C ATOM 485 CD1 TYR A 31 -6.002 -3.182 -5.329 1.00 0.00 C ATOM 486 CD2 TYR A 31 -6.497 -5.447 -4.805 1.00 0.00 C ATOM 487 CE1 TYR A 31 -5.495 -2.998 -4.061 1.00 0.00 C ATOM 488 CE2 TYR A 31 -5.991 -5.264 -3.536 1.00 0.00 C ATOM 489 CZ TYR A 31 -5.485 -4.038 -3.152 1.00 0.00 C ATOM 490 OH TYR A 31 -4.977 -3.857 -1.883 1.00 0.00 O ATOM 0 H TYR A 31 -8.152 -4.136 -9.279 1.00 0.00 H new ATOM 0 HA TYR A 31 -9.210 -4.577 -6.619 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -7.113 -5.670 -7.355 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -6.423 -4.138 -7.852 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -6.004 -2.360 -6.030 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -6.888 -6.412 -5.092 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -5.102 -2.033 -3.776 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -5.990 -6.087 -2.836 1.00 0.00 H new ATOM 0 HH TYR A 31 -5.051 -4.694 -1.378 1.00 0.00 H new ATOM 500 N ASP A 32 -7.810 -1.682 -7.247 1.00 0.00 N ATOM 501 CA ASP A 32 -7.718 -0.298 -6.705 1.00 0.00 C ATOM 502 C ASP A 32 -9.045 0.457 -6.785 1.00 0.00 C ATOM 503 O ASP A 32 -9.248 1.411 -6.062 1.00 0.00 O ATOM 504 CB ASP A 32 -6.659 0.473 -7.508 1.00 0.00 C ATOM 505 CG ASP A 32 -6.501 1.873 -6.911 1.00 0.00 C ATOM 506 OD1 ASP A 32 -6.303 1.929 -5.709 1.00 0.00 O ATOM 507 OD2 ASP A 32 -6.588 2.808 -7.691 1.00 0.00 O ATOM 0 H ASP A 32 -7.365 -1.828 -8.153 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.448 -0.372 -5.652 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -5.707 -0.057 -7.481 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.956 0.542 -8.554 1.00 0.00 H new ATOM 512 N VAL A 33 -9.927 0.039 -7.651 1.00 0.00 N ATOM 513 CA VAL A 33 -11.219 0.761 -7.739 1.00 0.00 C ATOM 514 C VAL A 33 -12.143 0.293 -6.638 1.00 0.00 C ATOM 515 O VAL A 33 -12.938 1.056 -6.124 1.00 0.00 O ATOM 516 CB VAL A 33 -11.876 0.471 -9.096 1.00 0.00 C ATOM 517 CG1 VAL A 33 -13.307 1.016 -9.087 1.00 0.00 C ATOM 518 CG2 VAL A 33 -11.083 1.179 -10.200 1.00 0.00 C ATOM 0 H VAL A 33 -9.811 -0.751 -8.285 1.00 0.00 H new ATOM 0 HA VAL A 33 -11.037 1.831 -7.635 1.00 0.00 H new ATOM 0 HB VAL A 33 -11.888 -0.604 -9.277 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -13.780 0.813 -10.048 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -13.876 0.531 -8.294 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -13.286 2.092 -8.913 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -11.545 0.977 -11.166 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -11.082 2.253 -10.016 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -10.057 0.811 -10.204 1.00 0.00 H new ATOM 528 N LEU A 34 -12.027 -0.957 -6.290 1.00 0.00 N ATOM 529 CA LEU A 34 -12.890 -1.487 -5.224 1.00 0.00 C ATOM 530 C LEU A 34 -12.318 -1.138 -3.864 1.00 0.00 C ATOM 531 O LEU A 34 -13.029 -0.720 -2.972 1.00 0.00 O ATOM 532 CB LEU A 34 -12.945 -3.009 -5.363 1.00 0.00 C ATOM 533 CG LEU A 34 -14.160 -3.390 -6.205 1.00 0.00 C ATOM 534 CD1 LEU A 34 -14.017 -4.840 -6.673 1.00 0.00 C ATOM 535 CD2 LEU A 34 -15.424 -3.258 -5.353 1.00 0.00 C ATOM 0 H LEU A 34 -11.373 -1.624 -6.700 1.00 0.00 H new ATOM 0 HA LEU A 34 -13.886 -1.053 -5.311 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -12.032 -3.377 -5.832 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -13.008 -3.474 -4.379 1.00 0.00 H new ATOM 0 HG LEU A 34 -14.228 -2.731 -7.070 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -14.883 -5.115 -7.275 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -13.112 -4.941 -7.272 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -13.954 -5.498 -5.806 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -16.295 -3.529 -5.950 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -15.353 -3.922 -4.492 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -15.526 -2.228 -5.010 1.00 0.00 H new ATOM 547 N ALA A 35 -11.034 -1.314 -3.731 1.00 0.00 N ATOM 548 CA ALA A 35 -10.390 -1.000 -2.441 1.00 0.00 C ATOM 549 C ALA A 35 -10.672 0.438 -2.032 1.00 0.00 C ATOM 550 O ALA A 35 -11.259 0.687 -0.997 1.00 0.00 O ATOM 551 CB ALA A 35 -8.874 -1.180 -2.600 1.00 0.00 C ATOM 0 H ALA A 35 -10.411 -1.660 -4.460 1.00 0.00 H new ATOM 0 HA ALA A 35 -10.786 -1.666 -1.674 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -8.380 -0.952 -1.656 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -8.658 -2.210 -2.884 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -8.507 -0.506 -3.374 1.00 0.00 H new ATOM 557 N LYS A 36 -10.245 1.358 -2.852 1.00 0.00 N ATOM 558 CA LYS A 36 -10.477 2.791 -2.534 1.00 0.00 C ATOM 559 C LYS A 36 -11.884 3.004 -2.000 1.00 0.00 C ATOM 560 O LYS A 36 -12.071 3.450 -0.885 1.00 0.00 O ATOM 561 CB LYS A 36 -10.314 3.605 -3.826 1.00 0.00 C ATOM 562 CG LYS A 36 -10.543 5.086 -3.518 1.00 0.00 C ATOM 563 CD LYS A 36 -9.507 5.922 -4.271 1.00 0.00 C ATOM 564 CE LYS A 36 -8.246 6.046 -3.416 1.00 0.00 C ATOM 565 NZ LYS A 36 -8.399 7.145 -2.420 1.00 0.00 N ATOM 0 H LYS A 36 -9.748 1.179 -3.724 1.00 0.00 H new ATOM 0 HA LYS A 36 -9.762 3.108 -1.775 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -9.317 3.457 -4.240 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.025 3.263 -4.578 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.550 5.380 -3.814 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -10.462 5.264 -2.446 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -9.269 5.454 -5.226 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -9.910 6.910 -4.492 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -8.054 5.105 -2.901 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -7.384 6.242 -4.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -7.534 7.217 -1.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -8.560 8.044 -2.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -9.209 6.942 -1.800 1.00 0.00 H new ATOM 579 N GLU A 37 -12.850 2.679 -2.807 1.00 0.00 N ATOM 580 CA GLU A 37 -14.257 2.852 -2.371 1.00 0.00 C ATOM 581 C GLU A 37 -14.502 2.154 -1.043 1.00 0.00 C ATOM 582 O GLU A 37 -15.140 2.697 -0.162 1.00 0.00 O ATOM 583 CB GLU A 37 -15.171 2.223 -3.433 1.00 0.00 C ATOM 584 CG GLU A 37 -16.458 3.043 -3.537 1.00 0.00 C ATOM 585 CD GLU A 37 -17.209 2.645 -4.810 1.00 0.00 C ATOM 586 OE1 GLU A 37 -16.530 2.212 -5.727 1.00 0.00 O ATOM 587 OE2 GLU A 37 -18.420 2.795 -4.794 1.00 0.00 O ATOM 0 H GLU A 37 -12.726 2.302 -3.747 1.00 0.00 H new ATOM 0 HA GLU A 37 -14.465 3.915 -2.250 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -14.664 2.196 -4.397 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -15.403 1.192 -3.166 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -17.085 2.870 -2.662 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -16.224 4.107 -3.557 1.00 0.00 H new ATOM 594 N SER A 38 -13.986 0.960 -0.924 1.00 0.00 N ATOM 595 CA SER A 38 -14.175 0.202 0.337 1.00 0.00 C ATOM 596 C SER A 38 -12.902 -0.529 0.735 1.00 0.00 C ATOM 597 O SER A 38 -12.612 -1.581 0.219 1.00 0.00 O ATOM 598 CB SER A 38 -15.295 -0.832 0.107 1.00 0.00 C ATOM 599 OG SER A 38 -14.953 -1.921 0.949 1.00 0.00 O ATOM 0 H SER A 38 -13.445 0.482 -1.644 1.00 0.00 H new ATOM 0 HA SER A 38 -14.433 0.896 1.137 1.00 0.00 H new ATOM 0 HB2 SER A 38 -16.272 -0.423 0.365 1.00 0.00 H new ATOM 0 HB3 SER A 38 -15.344 -1.138 -0.938 1.00 0.00 H new ATOM 0 HG SER A 38 -14.184 -2.397 0.572 1.00 0.00 H new ATOM 605 N GLU A 39 -12.160 0.058 1.644 1.00 0.00 N ATOM 606 CA GLU A 39 -10.901 -0.591 2.091 1.00 0.00 C ATOM 607 C GLU A 39 -11.175 -1.426 3.334 1.00 0.00 C ATOM 608 O GLU A 39 -10.591 -2.475 3.520 1.00 0.00 O ATOM 609 CB GLU A 39 -9.865 0.494 2.431 1.00 0.00 C ATOM 610 CG GLU A 39 -10.552 1.633 3.175 1.00 0.00 C ATOM 611 CD GLU A 39 -9.520 2.709 3.505 1.00 0.00 C ATOM 612 OE1 GLU A 39 -8.537 2.343 4.127 1.00 0.00 O ATOM 613 OE2 GLU A 39 -9.771 3.837 3.115 1.00 0.00 O ATOM 0 H GLU A 39 -12.375 0.951 2.089 1.00 0.00 H new ATOM 0 HA GLU A 39 -10.519 -1.232 1.296 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -9.068 0.073 3.044 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -9.401 0.868 1.518 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -11.351 2.053 2.564 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -11.013 1.261 4.090 1.00 0.00 H new ATOM 620 N HIS A 40 -12.073 -0.939 4.168 1.00 0.00 N ATOM 621 CA HIS A 40 -12.406 -1.694 5.407 1.00 0.00 C ATOM 622 C HIS A 40 -13.647 -2.569 5.184 1.00 0.00 C ATOM 623 O HIS A 40 -13.778 -3.628 5.768 1.00 0.00 O ATOM 624 CB HIS A 40 -12.693 -0.710 6.571 1.00 0.00 C ATOM 625 CG HIS A 40 -11.910 0.592 6.376 1.00 0.00 C ATOM 626 ND1 HIS A 40 -12.360 1.846 6.003 1.00 0.00 N flip ATOM 627 CD2 HIS A 40 -10.683 0.720 6.567 1.00 0.00 C flip ATOM 628 CE1 HIS A 40 -11.307 2.709 5.993 1.00 0.00 C flip ATOM 629 NE2 HIS A 40 -10.302 1.913 6.359 1.00 0.00 N flip ATOM 0 H HIS A 40 -12.579 -0.063 4.039 1.00 0.00 H new ATOM 0 HA HIS A 40 -11.554 -2.326 5.658 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -13.761 -0.496 6.619 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -12.417 -1.169 7.520 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -10.028 -0.083 6.871 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -11.290 3.762 5.752 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -9.337 2.227 6.460 1.00 0.00 H new ATOM 637 N PRO A 41 -14.567 -2.076 4.352 1.00 0.00 N ATOM 638 CA PRO A 41 -15.808 -2.803 4.039 1.00 0.00 C ATOM 639 C PRO A 41 -15.808 -3.584 2.658 1.00 0.00 C ATOM 640 O PRO A 41 -16.868 -3.866 2.135 1.00 0.00 O ATOM 641 CB PRO A 41 -16.835 -1.656 3.914 1.00 0.00 C ATOM 642 CG PRO A 41 -16.015 -0.354 3.611 1.00 0.00 C ATOM 643 CD PRO A 41 -14.531 -0.701 3.840 1.00 0.00 C ATOM 0 HA PRO A 41 -15.991 -3.566 4.796 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -17.548 -1.860 3.115 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -17.409 -1.547 4.834 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -16.181 -0.022 2.586 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -16.327 0.461 4.264 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -13.957 -0.633 2.916 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -14.067 -0.021 4.554 1.00 0.00 H new ATOM 651 N PRO A 42 -14.640 -3.939 2.094 1.00 0.00 N ATOM 652 CA PRO A 42 -14.618 -4.659 0.815 1.00 0.00 C ATOM 653 C PRO A 42 -15.385 -5.977 0.892 1.00 0.00 C ATOM 654 O PRO A 42 -15.447 -6.602 1.932 1.00 0.00 O ATOM 655 CB PRO A 42 -13.127 -4.932 0.537 1.00 0.00 C ATOM 656 CG PRO A 42 -12.314 -4.244 1.663 1.00 0.00 C ATOM 657 CD PRO A 42 -13.323 -3.699 2.682 1.00 0.00 C ATOM 0 HA PRO A 42 -15.096 -4.075 0.028 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -12.929 -6.004 0.520 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -12.840 -4.540 -0.439 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -11.635 -4.953 2.136 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -11.702 -3.438 1.258 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -13.224 -4.205 3.642 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -13.162 -2.636 2.864 1.00 0.00 H new ATOM 665 N GLN A 43 -15.956 -6.375 -0.217 1.00 0.00 N ATOM 666 CA GLN A 43 -16.723 -7.647 -0.232 1.00 0.00 C ATOM 667 C GLN A 43 -15.822 -8.834 -0.564 1.00 0.00 C ATOM 668 O GLN A 43 -15.948 -9.895 0.012 1.00 0.00 O ATOM 669 CB GLN A 43 -17.803 -7.536 -1.321 1.00 0.00 C ATOM 670 CG GLN A 43 -17.251 -6.715 -2.491 1.00 0.00 C ATOM 671 CD GLN A 43 -18.164 -6.889 -3.708 1.00 0.00 C ATOM 672 OE1 GLN A 43 -17.764 -6.671 -4.834 1.00 0.00 O ATOM 673 NE2 GLN A 43 -19.394 -7.281 -3.525 1.00 0.00 N ATOM 0 H GLN A 43 -15.922 -5.874 -1.105 1.00 0.00 H new ATOM 0 HA GLN A 43 -17.158 -7.810 0.754 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -18.096 -8.529 -1.663 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -18.697 -7.061 -0.917 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -17.191 -5.662 -2.215 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -16.239 -7.040 -2.732 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -19.735 -7.466 -2.582 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -20.015 -7.403 -4.325 1.00 0.00 H new ATOM 682 N SER A 44 -14.929 -8.625 -1.489 1.00 0.00 N ATOM 683 CA SER A 44 -14.005 -9.717 -1.886 1.00 0.00 C ATOM 684 C SER A 44 -13.143 -9.262 -3.049 1.00 0.00 C ATOM 685 O SER A 44 -13.028 -9.930 -4.051 1.00 0.00 O ATOM 686 CB SER A 44 -14.856 -10.940 -2.299 1.00 0.00 C ATOM 687 OG SER A 44 -16.061 -10.372 -2.795 1.00 0.00 O ATOM 0 H SER A 44 -14.800 -7.744 -1.987 1.00 0.00 H new ATOM 0 HA SER A 44 -13.350 -9.982 -1.056 1.00 0.00 H new ATOM 0 HB2 SER A 44 -14.353 -11.537 -3.060 1.00 0.00 H new ATOM 0 HB3 SER A 44 -15.045 -11.599 -1.451 1.00 0.00 H new ATOM 0 HG SER A 44 -16.665 -11.087 -3.084 1.00 0.00 H new ATOM 693 N ILE A 45 -12.548 -8.117 -2.881 1.00 0.00 N ATOM 694 CA ILE A 45 -11.683 -7.573 -3.949 1.00 0.00 C ATOM 695 C ILE A 45 -10.746 -8.620 -4.495 1.00 0.00 C ATOM 696 O ILE A 45 -10.656 -8.812 -5.689 1.00 0.00 O ATOM 697 CB ILE A 45 -10.829 -6.455 -3.360 1.00 0.00 C ATOM 698 CG1 ILE A 45 -11.621 -5.624 -2.342 1.00 0.00 C ATOM 699 CG2 ILE A 45 -10.378 -5.555 -4.510 1.00 0.00 C ATOM 700 CD1 ILE A 45 -13.080 -5.475 -2.791 1.00 0.00 C ATOM 0 H ILE A 45 -12.626 -7.536 -2.046 1.00 0.00 H new ATOM 0 HA ILE A 45 -12.326 -7.218 -4.754 1.00 0.00 H new ATOM 0 HB ILE A 45 -9.975 -6.890 -2.840 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -11.582 -6.103 -1.364 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -11.165 -4.640 -2.233 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -9.764 -4.744 -4.118 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -9.796 -6.139 -5.223 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -11.252 -5.139 -5.011 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -13.628 -4.883 -2.058 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -13.114 -4.975 -3.759 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -13.537 -6.461 -2.876 1.00 0.00 H new ATOM 712 N LEU A 46 -10.060 -9.281 -3.626 1.00 0.00 N ATOM 713 CA LEU A 46 -9.128 -10.311 -4.105 1.00 0.00 C ATOM 714 C LEU A 46 -9.859 -11.344 -4.937 1.00 0.00 C ATOM 715 O LEU A 46 -9.593 -11.505 -6.105 1.00 0.00 O ATOM 716 CB LEU A 46 -8.499 -11.006 -2.889 1.00 0.00 C ATOM 717 CG LEU A 46 -6.996 -11.205 -3.130 1.00 0.00 C ATOM 718 CD1 LEU A 46 -6.770 -11.790 -4.529 1.00 0.00 C ATOM 719 CD2 LEU A 46 -6.285 -9.855 -3.024 1.00 0.00 C ATOM 0 H LEU A 46 -10.103 -9.154 -2.615 1.00 0.00 H new ATOM 0 HA LEU A 46 -8.362 -9.841 -4.721 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -8.658 -10.407 -1.993 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -8.981 -11.969 -2.718 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.597 -11.891 -2.383 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -5.702 -11.930 -4.697 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.279 -12.751 -4.608 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.168 -11.106 -5.278 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -5.217 -9.992 -3.195 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.687 -9.172 -3.772 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.443 -9.438 -2.030 1.00 0.00 H new ATOM 731 N HIS A 47 -10.777 -12.008 -4.323 1.00 0.00 N ATOM 732 CA HIS A 47 -11.548 -13.042 -5.045 1.00 0.00 C ATOM 733 C HIS A 47 -12.468 -12.445 -6.105 1.00 0.00 C ATOM 734 O HIS A 47 -13.040 -13.168 -6.897 1.00 0.00 O ATOM 735 CB HIS A 47 -12.396 -13.796 -4.010 1.00 0.00 C ATOM 736 CG HIS A 47 -11.821 -15.200 -3.804 1.00 0.00 C ATOM 737 ND1 HIS A 47 -12.331 -16.253 -4.240 1.00 0.00 N ATOM 738 CD2 HIS A 47 -10.684 -15.596 -3.125 1.00 0.00 C ATOM 739 CE1 HIS A 47 -11.648 -17.271 -3.914 1.00 0.00 C ATOM 740 NE2 HIS A 47 -10.571 -16.951 -3.197 1.00 0.00 N ATOM 0 H HIS A 47 -11.032 -11.881 -3.344 1.00 0.00 H new ATOM 0 HA HIS A 47 -10.850 -13.703 -5.560 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -12.404 -13.252 -3.065 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -13.430 -13.861 -4.349 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -9.995 -14.936 -2.618 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -11.910 -18.283 -4.187 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -9.852 -17.560 -2.806 1.00 0.00 H new ATOM 748 N THR A 48 -12.598 -11.150 -6.111 1.00 0.00 N ATOM 749 CA THR A 48 -13.484 -10.523 -7.125 1.00 0.00 C ATOM 750 C THR A 48 -12.696 -10.139 -8.355 1.00 0.00 C ATOM 751 O THR A 48 -12.948 -10.634 -9.435 1.00 0.00 O ATOM 752 CB THR A 48 -14.106 -9.256 -6.530 1.00 0.00 C ATOM 753 OG1 THR A 48 -15.120 -9.710 -5.658 1.00 0.00 O ATOM 754 CG2 THR A 48 -14.851 -8.461 -7.612 1.00 0.00 C ATOM 0 H THR A 48 -12.136 -10.507 -5.468 1.00 0.00 H new ATOM 0 HA THR A 48 -14.257 -11.239 -7.404 1.00 0.00 H new ATOM 0 HB THR A 48 -13.332 -8.643 -6.068 1.00 0.00 H new ATOM 0 HG1 THR A 48 -14.714 -10.049 -4.833 1.00 0.00 H new ATOM 0 HG21 THR A 48 -15.286 -7.565 -7.170 1.00 0.00 H new ATOM 0 HG22 THR A 48 -14.153 -8.176 -8.399 1.00 0.00 H new ATOM 0 HG23 THR A 48 -15.643 -9.078 -8.036 1.00 0.00 H new ATOM 762 N ALA A 49 -11.753 -9.262 -8.180 1.00 0.00 N ATOM 763 CA ALA A 49 -10.947 -8.845 -9.340 1.00 0.00 C ATOM 764 C ALA A 49 -10.213 -10.042 -9.935 1.00 0.00 C ATOM 765 O ALA A 49 -9.847 -10.030 -11.090 1.00 0.00 O ATOM 766 CB ALA A 49 -9.924 -7.791 -8.880 1.00 0.00 C ATOM 0 H ALA A 49 -11.511 -8.823 -7.292 1.00 0.00 H new ATOM 0 HA ALA A 49 -11.603 -8.425 -10.103 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -9.321 -7.474 -9.731 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -10.449 -6.930 -8.467 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -9.276 -8.222 -8.116 1.00 0.00 H new ATOM 772 N LYS A 50 -10.014 -11.072 -9.136 1.00 0.00 N ATOM 773 CA LYS A 50 -9.305 -12.264 -9.673 1.00 0.00 C ATOM 774 C LYS A 50 -10.177 -13.017 -10.637 1.00 0.00 C ATOM 775 O LYS A 50 -9.747 -13.392 -11.711 1.00 0.00 O ATOM 776 CB LYS A 50 -8.989 -13.221 -8.527 1.00 0.00 C ATOM 777 CG LYS A 50 -8.106 -14.363 -9.048 1.00 0.00 C ATOM 778 CD LYS A 50 -6.793 -14.385 -8.262 1.00 0.00 C ATOM 779 CE LYS A 50 -7.048 -14.981 -6.875 1.00 0.00 C ATOM 780 NZ LYS A 50 -5.908 -14.686 -5.965 1.00 0.00 N ATOM 0 H LYS A 50 -10.307 -11.131 -8.161 1.00 0.00 H new ATOM 0 HA LYS A 50 -8.401 -11.916 -10.173 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -8.479 -12.689 -7.724 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -9.912 -13.622 -8.108 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -8.624 -15.316 -8.941 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -7.905 -14.227 -10.111 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -6.047 -14.976 -8.793 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -6.393 -13.375 -8.169 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -7.968 -14.571 -6.460 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -7.187 -16.059 -6.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -6.199 -14.849 -4.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -5.108 -15.309 -6.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -5.619 -13.694 -6.081 1.00 0.00 H new ATOM 794 N ALA A 51 -11.395 -13.228 -10.244 1.00 0.00 N ATOM 795 CA ALA A 51 -12.307 -13.959 -11.127 1.00 0.00 C ATOM 796 C ALA A 51 -12.774 -13.096 -12.298 1.00 0.00 C ATOM 797 O ALA A 51 -13.286 -13.603 -13.276 1.00 0.00 O ATOM 798 CB ALA A 51 -13.531 -14.392 -10.309 1.00 0.00 C ATOM 0 H ALA A 51 -11.789 -12.925 -9.353 1.00 0.00 H new ATOM 0 HA ALA A 51 -11.777 -14.820 -11.534 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -14.222 -14.938 -10.950 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -13.212 -15.035 -9.489 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -14.030 -13.511 -9.906 1.00 0.00 H new ATOM 804 N ILE A 52 -12.592 -11.808 -12.178 1.00 0.00 N ATOM 805 CA ILE A 52 -13.022 -10.901 -13.276 1.00 0.00 C ATOM 806 C ILE A 52 -11.871 -10.581 -14.226 1.00 0.00 C ATOM 807 O ILE A 52 -11.936 -10.872 -15.401 1.00 0.00 O ATOM 808 CB ILE A 52 -13.508 -9.597 -12.649 1.00 0.00 C ATOM 809 CG1 ILE A 52 -14.801 -9.842 -11.884 1.00 0.00 C ATOM 810 CG2 ILE A 52 -13.783 -8.587 -13.775 1.00 0.00 C ATOM 811 CD1 ILE A 52 -15.142 -8.593 -11.070 1.00 0.00 C ATOM 0 H ILE A 52 -12.167 -11.349 -11.372 1.00 0.00 H new ATOM 0 HA ILE A 52 -13.809 -11.394 -13.847 1.00 0.00 H new ATOM 0 HB ILE A 52 -12.750 -9.215 -11.965 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -15.610 -10.073 -12.577 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -14.691 -10.703 -11.224 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -14.132 -7.648 -13.345 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -12.866 -8.410 -14.337 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -14.547 -8.986 -14.443 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -16.067 -8.760 -10.518 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -14.334 -8.384 -10.369 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -15.268 -7.744 -11.742 1.00 0.00 H new ATOM 823 N GLU A 53 -10.844 -9.980 -13.698 1.00 0.00 N ATOM 824 CA GLU A 53 -9.678 -9.630 -14.552 1.00 0.00 C ATOM 825 C GLU A 53 -9.230 -10.816 -15.407 1.00 0.00 C ATOM 826 O GLU A 53 -8.397 -10.668 -16.279 1.00 0.00 O ATOM 827 CB GLU A 53 -8.514 -9.219 -13.632 1.00 0.00 C ATOM 828 CG GLU A 53 -7.771 -10.472 -13.169 1.00 0.00 C ATOM 829 CD GLU A 53 -6.729 -10.855 -14.220 1.00 0.00 C ATOM 830 OE1 GLU A 53 -6.074 -9.940 -14.692 1.00 0.00 O ATOM 831 OE2 GLU A 53 -6.646 -12.041 -14.491 1.00 0.00 O ATOM 0 H GLU A 53 -10.761 -9.717 -12.716 1.00 0.00 H new ATOM 0 HA GLU A 53 -9.967 -8.819 -15.220 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -7.833 -8.553 -14.163 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -8.893 -8.668 -12.771 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -7.287 -10.289 -12.210 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -8.474 -11.292 -13.020 1.00 0.00 H new ATOM 838 N SER A 54 -9.788 -11.969 -15.144 1.00 0.00 N ATOM 839 CA SER A 54 -9.396 -13.168 -15.936 1.00 0.00 C ATOM 840 C SER A 54 -10.348 -13.436 -17.106 1.00 0.00 C ATOM 841 O SER A 54 -9.953 -14.022 -18.095 1.00 0.00 O ATOM 842 CB SER A 54 -9.422 -14.385 -15.001 1.00 0.00 C ATOM 843 OG SER A 54 -10.803 -14.678 -14.847 1.00 0.00 O ATOM 0 H SER A 54 -10.491 -12.130 -14.422 1.00 0.00 H new ATOM 0 HA SER A 54 -8.404 -12.989 -16.351 1.00 0.00 H new ATOM 0 HB2 SER A 54 -8.882 -15.229 -15.431 1.00 0.00 H new ATOM 0 HB3 SER A 54 -8.953 -14.161 -14.043 1.00 0.00 H new ATOM 0 HG SER A 54 -11.231 -13.970 -14.321 1.00 0.00 H new ATOM 849 N GLU A 55 -11.578 -13.006 -16.983 1.00 0.00 N ATOM 850 CA GLU A 55 -12.549 -13.246 -18.095 1.00 0.00 C ATOM 851 C GLU A 55 -12.641 -12.074 -19.061 1.00 0.00 C ATOM 852 O GLU A 55 -12.538 -12.252 -20.257 1.00 0.00 O ATOM 853 CB GLU A 55 -13.938 -13.485 -17.479 1.00 0.00 C ATOM 854 CG GLU A 55 -14.828 -14.208 -18.497 1.00 0.00 C ATOM 855 CD GLU A 55 -15.854 -15.067 -17.753 1.00 0.00 C ATOM 856 OE1 GLU A 55 -16.787 -14.472 -17.241 1.00 0.00 O ATOM 857 OE2 GLU A 55 -15.645 -16.270 -17.740 1.00 0.00 O ATOM 0 H GLU A 55 -11.949 -12.507 -16.174 1.00 0.00 H new ATOM 0 HA GLU A 55 -12.199 -14.109 -18.662 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -13.848 -14.080 -16.571 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -14.390 -12.535 -17.194 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -15.336 -13.483 -19.132 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -14.219 -14.833 -19.150 1.00 0.00 H new ATOM 864 N MET A 56 -12.848 -10.907 -18.542 1.00 0.00 N ATOM 865 CA MET A 56 -12.948 -9.729 -19.439 1.00 0.00 C ATOM 866 C MET A 56 -11.858 -9.750 -20.503 1.00 0.00 C ATOM 867 O MET A 56 -12.021 -9.195 -21.571 1.00 0.00 O ATOM 868 CB MET A 56 -12.767 -8.466 -18.599 1.00 0.00 C ATOM 869 CG MET A 56 -13.731 -8.500 -17.415 1.00 0.00 C ATOM 870 SD MET A 56 -13.693 -7.091 -16.280 1.00 0.00 S ATOM 871 CE MET A 56 -12.016 -6.531 -16.677 1.00 0.00 C ATOM 0 H MET A 56 -12.952 -10.714 -17.546 1.00 0.00 H new ATOM 0 HA MET A 56 -13.921 -9.750 -19.931 1.00 0.00 H new ATOM 0 HB2 MET A 56 -11.739 -8.397 -18.243 1.00 0.00 H new ATOM 0 HB3 MET A 56 -12.953 -7.581 -19.208 1.00 0.00 H new ATOM 0 HG2 MET A 56 -14.744 -8.592 -17.806 1.00 0.00 H new ATOM 0 HG3 MET A 56 -13.528 -9.403 -16.840 1.00 0.00 H new ATOM 0 HE1 MET A 56 -11.722 -5.744 -15.983 1.00 0.00 H new ATOM 0 HE2 MET A 56 -11.323 -7.368 -16.591 1.00 0.00 H new ATOM 0 HE3 MET A 56 -11.993 -6.144 -17.696 1.00 0.00 H new ATOM 881 N ASN A 57 -10.766 -10.390 -20.193 1.00 0.00 N ATOM 882 CA ASN A 57 -9.654 -10.451 -21.184 1.00 0.00 C ATOM 883 C ASN A 57 -9.760 -11.684 -22.082 1.00 0.00 C ATOM 884 O ASN A 57 -9.237 -11.695 -23.179 1.00 0.00 O ATOM 885 CB ASN A 57 -8.321 -10.494 -20.411 1.00 0.00 C ATOM 886 CG ASN A 57 -7.843 -11.948 -20.264 1.00 0.00 C ATOM 887 OD1 ASN A 57 -6.717 -12.279 -20.582 1.00 0.00 O ATOM 888 ND2 ASN A 57 -8.667 -12.844 -19.790 1.00 0.00 N ATOM 0 H ASN A 57 -10.595 -10.868 -19.308 1.00 0.00 H new ATOM 0 HA ASN A 57 -9.709 -9.572 -21.826 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -7.568 -9.907 -20.936 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -8.448 -10.043 -19.427 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -8.364 -13.813 -19.689 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -9.613 -12.575 -19.521 1.00 0.00 H new ATOM 895 N LYS A 58 -10.422 -12.700 -21.592 1.00 0.00 N ATOM 896 CA LYS A 58 -10.578 -13.943 -22.398 1.00 0.00 C ATOM 897 C LYS A 58 -10.792 -13.619 -23.873 1.00 0.00 C ATOM 898 O LYS A 58 -9.983 -13.972 -24.710 1.00 0.00 O ATOM 899 CB LYS A 58 -11.809 -14.696 -21.876 1.00 0.00 C ATOM 900 CG LYS A 58 -11.743 -16.151 -22.339 1.00 0.00 C ATOM 901 CD LYS A 58 -12.670 -17.002 -21.465 1.00 0.00 C ATOM 902 CE LYS A 58 -14.113 -16.851 -21.960 1.00 0.00 C ATOM 903 NZ LYS A 58 -14.218 -17.234 -23.398 1.00 0.00 N ATOM 0 H LYS A 58 -10.860 -12.721 -20.671 1.00 0.00 H new ATOM 0 HA LYS A 58 -9.673 -14.544 -22.305 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -11.844 -14.650 -20.788 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -12.721 -14.226 -22.244 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -12.040 -16.226 -23.385 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -10.720 -16.520 -22.271 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -12.367 -18.048 -21.505 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -12.596 -16.689 -20.424 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -14.776 -17.477 -21.362 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -14.443 -15.820 -21.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -14.429 -16.390 -23.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -13.318 -17.648 -23.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -14.980 -17.931 -23.517 1.00 0.00 H new ATOM 917 N VAL A 59 -11.883 -12.953 -24.160 1.00 0.00 N ATOM 918 CA VAL A 59 -12.183 -12.587 -25.570 1.00 0.00 C ATOM 919 C VAL A 59 -12.590 -11.122 -25.663 1.00 0.00 C ATOM 920 O VAL A 59 -13.665 -10.749 -25.234 1.00 0.00 O ATOM 921 CB VAL A 59 -13.352 -13.456 -26.055 1.00 0.00 C ATOM 922 CG1 VAL A 59 -12.808 -14.608 -26.904 1.00 0.00 C ATOM 923 CG2 VAL A 59 -14.094 -14.030 -24.847 1.00 0.00 C ATOM 0 H VAL A 59 -12.576 -12.649 -23.476 1.00 0.00 H new ATOM 0 HA VAL A 59 -11.296 -12.747 -26.183 1.00 0.00 H new ATOM 0 HB VAL A 59 -14.034 -12.849 -26.650 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -13.636 -15.227 -27.250 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -12.272 -14.205 -27.763 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -12.128 -15.213 -26.304 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -14.924 -14.647 -25.190 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -13.410 -14.638 -24.255 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -14.477 -13.214 -24.234 1.00 0.00 H new ATOM 933 N ASN A 60 -11.724 -10.313 -26.222 1.00 0.00 N ATOM 934 CA ASN A 60 -12.055 -8.869 -26.348 1.00 0.00 C ATOM 935 C ASN A 60 -11.465 -8.271 -27.619 1.00 0.00 C ATOM 936 O ASN A 60 -11.051 -8.982 -28.515 1.00 0.00 O ATOM 937 CB ASN A 60 -11.472 -8.121 -25.135 1.00 0.00 C ATOM 938 CG ASN A 60 -10.022 -8.564 -24.907 1.00 0.00 C ATOM 939 OD1 ASN A 60 -9.672 -9.711 -25.102 1.00 0.00 O ATOM 940 ND2 ASN A 60 -9.151 -7.684 -24.491 1.00 0.00 N ATOM 0 H ASN A 60 -10.814 -10.590 -26.591 1.00 0.00 H new ATOM 0 HA ASN A 60 -13.139 -8.767 -26.390 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -11.512 -7.045 -25.305 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -12.070 -8.326 -24.247 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -8.182 -7.961 -24.331 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -9.439 -6.720 -24.326 1.00 0.00 H new ATOM 947 N ASN A 61 -11.443 -6.969 -27.667 1.00 0.00 N ATOM 948 CA ASN A 61 -10.893 -6.279 -28.859 1.00 0.00 C ATOM 949 C ASN A 61 -9.429 -5.882 -28.669 1.00 0.00 C ATOM 950 O ASN A 61 -8.811 -5.415 -29.582 1.00 0.00 O ATOM 951 CB ASN A 61 -11.716 -5.006 -29.094 1.00 0.00 C ATOM 952 CG ASN A 61 -13.190 -5.384 -29.251 1.00 0.00 C ATOM 953 OD1 ASN A 61 -13.752 -5.302 -30.324 1.00 0.00 O ATOM 954 ND2 ASN A 61 -13.851 -5.802 -28.206 1.00 0.00 N ATOM 0 H ASN A 61 -11.784 -6.354 -26.928 1.00 0.00 H new ATOM 0 HA ASN A 61 -10.948 -6.962 -29.707 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -11.591 -4.318 -28.258 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.363 -4.490 -29.987 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -14.835 -6.058 -28.293 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -13.384 -5.873 -27.302 1.00 0.00 H new ATOM 961 N CYS A 62 -8.921 -6.055 -27.475 1.00 0.00 N ATOM 962 CA CYS A 62 -7.486 -5.688 -27.203 1.00 0.00 C ATOM 963 C CYS A 62 -6.557 -5.940 -28.407 1.00 0.00 C ATOM 964 O CYS A 62 -5.539 -5.291 -28.542 1.00 0.00 O ATOM 965 CB CYS A 62 -6.985 -6.544 -26.026 1.00 0.00 C ATOM 966 SG CYS A 62 -7.255 -8.332 -26.125 1.00 0.00 S ATOM 0 H CYS A 62 -9.430 -6.432 -26.676 1.00 0.00 H new ATOM 0 HA CYS A 62 -7.459 -4.620 -26.985 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -5.915 -6.370 -25.914 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -7.464 -6.180 -25.117 1.00 0.00 H new ATOM 0 HG CYS A 62 -6.775 -8.903 -25.060 1.00 0.00 H new ATOM 972 N ASP A 63 -6.918 -6.864 -29.254 1.00 0.00 N ATOM 973 CA ASP A 63 -6.047 -7.146 -30.435 1.00 0.00 C ATOM 974 C ASP A 63 -6.428 -6.278 -31.638 1.00 0.00 C ATOM 975 O ASP A 63 -6.028 -6.550 -32.752 1.00 0.00 O ATOM 976 CB ASP A 63 -6.230 -8.623 -30.819 1.00 0.00 C ATOM 977 CG ASP A 63 -5.172 -9.015 -31.851 1.00 0.00 C ATOM 978 OD1 ASP A 63 -4.034 -8.639 -31.627 1.00 0.00 O ATOM 979 OD2 ASP A 63 -5.562 -9.668 -32.804 1.00 0.00 O ATOM 0 H ASP A 63 -7.764 -7.429 -29.184 1.00 0.00 H new ATOM 0 HA ASP A 63 -5.014 -6.923 -30.169 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -6.142 -9.254 -29.934 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -7.228 -8.783 -31.227 1.00 0.00 H new ATOM 984 N THR A 64 -7.187 -5.254 -31.388 1.00 0.00 N ATOM 985 CA THR A 64 -7.606 -4.360 -32.495 1.00 0.00 C ATOM 986 C THR A 64 -7.884 -2.958 -31.973 1.00 0.00 C ATOM 987 O THR A 64 -7.152 -2.029 -32.254 1.00 0.00 O ATOM 988 CB THR A 64 -8.888 -4.924 -33.114 1.00 0.00 C ATOM 989 OG1 THR A 64 -9.779 -5.102 -32.033 1.00 0.00 O ATOM 990 CG2 THR A 64 -8.656 -6.340 -33.662 1.00 0.00 C ATOM 0 H THR A 64 -7.536 -4.997 -30.464 1.00 0.00 H new ATOM 0 HA THR A 64 -6.808 -4.306 -33.236 1.00 0.00 H new ATOM 0 HB THR A 64 -9.236 -4.262 -33.906 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.311 -5.542 -31.293 1.00 0.00 H new ATOM 0 HG21 THR A 64 -9.581 -6.718 -34.096 1.00 0.00 H new ATOM 0 HG22 THR A 64 -7.881 -6.311 -34.428 1.00 0.00 H new ATOM 0 HG23 THR A 64 -8.341 -6.997 -32.851 1.00 0.00 H new ATOM 998 N ASN A 65 -8.954 -2.841 -31.220 1.00 0.00 N ATOM 999 CA ASN A 65 -9.334 -1.523 -30.649 1.00 0.00 C ATOM 1000 C ASN A 65 -9.371 -1.602 -29.132 1.00 0.00 C ATOM 1001 O ASN A 65 -10.425 -1.672 -28.532 1.00 0.00 O ATOM 1002 CB ASN A 65 -10.735 -1.159 -31.159 1.00 0.00 C ATOM 1003 CG ASN A 65 -10.634 -0.662 -32.603 1.00 0.00 C ATOM 1004 OD1 ASN A 65 -10.243 -1.388 -33.495 1.00 0.00 O ATOM 1005 ND2 ASN A 65 -10.977 0.568 -32.875 1.00 0.00 N ATOM 0 H ASN A 65 -9.579 -3.610 -30.980 1.00 0.00 H new ATOM 0 HA ASN A 65 -8.604 -0.772 -30.951 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -11.391 -2.028 -31.106 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -11.176 -0.388 -30.527 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -10.916 0.915 -33.832 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -11.306 1.182 -32.130 1.00 0.00 H new ATOM 1012 N GLU A 66 -8.215 -1.587 -28.542 1.00 0.00 N ATOM 1013 CA GLU A 66 -8.144 -1.660 -27.064 1.00 0.00 C ATOM 1014 C GLU A 66 -8.896 -0.500 -26.447 1.00 0.00 C ATOM 1015 O GLU A 66 -9.119 -0.455 -25.253 1.00 0.00 O ATOM 1016 CB GLU A 66 -6.668 -1.570 -26.650 1.00 0.00 C ATOM 1017 CG GLU A 66 -6.055 -0.312 -27.267 1.00 0.00 C ATOM 1018 CD GLU A 66 -4.578 -0.226 -26.879 1.00 0.00 C ATOM 1019 OE1 GLU A 66 -4.114 -1.194 -26.300 1.00 0.00 O ATOM 1020 OE2 GLU A 66 -3.998 0.803 -27.182 1.00 0.00 O ATOM 0 H GLU A 66 -7.316 -1.527 -29.020 1.00 0.00 H new ATOM 0 HA GLU A 66 -8.589 -2.594 -26.722 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -6.583 -1.537 -25.564 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -6.128 -2.456 -26.985 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.157 -0.339 -28.352 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -6.586 0.574 -26.919 1.00 0.00 H new ATOM 1027 N ALA A 67 -9.281 0.416 -27.282 1.00 0.00 N ATOM 1028 CA ALA A 67 -10.019 1.587 -26.791 1.00 0.00 C ATOM 1029 C ALA A 67 -11.403 1.174 -26.323 1.00 0.00 C ATOM 1030 O ALA A 67 -11.975 1.781 -25.437 1.00 0.00 O ATOM 1031 CB ALA A 67 -10.147 2.574 -27.954 1.00 0.00 C ATOM 0 H ALA A 67 -9.112 0.397 -28.288 1.00 0.00 H new ATOM 0 HA ALA A 67 -9.493 2.041 -25.951 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -10.692 3.458 -27.623 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -9.154 2.866 -28.294 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -10.687 2.101 -28.775 1.00 0.00 H new ATOM 1037 N ALA A 68 -11.914 0.144 -26.928 1.00 0.00 N ATOM 1038 CA ALA A 68 -13.256 -0.338 -26.545 1.00 0.00 C ATOM 1039 C ALA A 68 -13.178 -1.156 -25.259 1.00 0.00 C ATOM 1040 O ALA A 68 -13.753 -0.792 -24.253 1.00 0.00 O ATOM 1041 CB ALA A 68 -13.778 -1.233 -27.677 1.00 0.00 C ATOM 0 H ALA A 68 -11.457 -0.383 -27.672 1.00 0.00 H new ATOM 0 HA ALA A 68 -13.920 0.511 -26.380 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -14.770 -1.604 -27.420 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -13.834 -0.656 -28.600 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -13.101 -2.076 -27.816 1.00 0.00 H new ATOM 1047 N TYR A 69 -12.462 -2.248 -25.319 1.00 0.00 N ATOM 1048 CA TYR A 69 -12.331 -3.104 -24.112 1.00 0.00 C ATOM 1049 C TYR A 69 -12.052 -2.249 -22.877 1.00 0.00 C ATOM 1050 O TYR A 69 -12.475 -2.574 -21.787 1.00 0.00 O ATOM 1051 CB TYR A 69 -11.150 -4.068 -24.333 1.00 0.00 C ATOM 1052 CG TYR A 69 -10.699 -4.647 -22.986 1.00 0.00 C ATOM 1053 CD1 TYR A 69 -11.628 -5.058 -22.051 1.00 0.00 C ATOM 1054 CD2 TYR A 69 -9.355 -4.764 -22.687 1.00 0.00 C ATOM 1055 CE1 TYR A 69 -11.220 -5.573 -20.840 1.00 0.00 C ATOM 1056 CE2 TYR A 69 -8.950 -5.281 -21.475 1.00 0.00 C ATOM 1057 CZ TYR A 69 -9.878 -5.690 -20.543 1.00 0.00 C ATOM 1058 OH TYR A 69 -9.472 -6.207 -19.333 1.00 0.00 O ATOM 0 H TYR A 69 -11.967 -2.579 -26.147 1.00 0.00 H new ATOM 0 HA TYR A 69 -13.259 -3.654 -23.953 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -11.446 -4.873 -25.006 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -10.323 -3.542 -24.810 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -12.682 -4.975 -22.270 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -8.616 -4.448 -23.408 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -11.958 -5.888 -20.117 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -7.896 -5.366 -21.254 1.00 0.00 H new ATOM 0 HH TYR A 69 -9.011 -7.059 -19.480 1.00 0.00 H new ATOM 1068 N LYS A 70 -11.343 -1.169 -23.076 1.00 0.00 N ATOM 1069 CA LYS A 70 -11.024 -0.278 -21.928 1.00 0.00 C ATOM 1070 C LYS A 70 -12.271 0.457 -21.450 1.00 0.00 C ATOM 1071 O LYS A 70 -12.639 0.382 -20.292 1.00 0.00 O ATOM 1072 CB LYS A 70 -9.987 0.754 -22.397 1.00 0.00 C ATOM 1073 CG LYS A 70 -9.568 1.633 -21.215 1.00 0.00 C ATOM 1074 CD LYS A 70 -8.908 2.906 -21.750 1.00 0.00 C ATOM 1075 CE LYS A 70 -8.290 3.682 -20.586 1.00 0.00 C ATOM 1076 NZ LYS A 70 -7.515 4.851 -21.090 1.00 0.00 N ATOM 0 H LYS A 70 -10.974 -0.869 -23.978 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.638 -0.877 -21.104 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -9.116 0.247 -22.813 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -10.406 1.371 -23.192 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -10.437 1.886 -20.608 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -8.875 1.092 -20.570 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -8.140 2.652 -22.481 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -9.645 3.524 -22.263 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -9.075 4.023 -19.911 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -7.637 3.026 -20.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -7.102 5.366 -20.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -6.754 4.519 -21.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -8.147 5.484 -21.620 1.00 0.00 H new ATOM 1090 N ALA A 71 -12.897 1.159 -22.351 1.00 0.00 N ATOM 1091 CA ALA A 71 -14.119 1.905 -21.971 1.00 0.00 C ATOM 1092 C ALA A 71 -15.165 0.963 -21.385 1.00 0.00 C ATOM 1093 O ALA A 71 -15.636 1.161 -20.286 1.00 0.00 O ATOM 1094 CB ALA A 71 -14.697 2.561 -23.236 1.00 0.00 C ATOM 0 H ALA A 71 -12.615 1.246 -23.327 1.00 0.00 H new ATOM 0 HA ALA A 71 -13.864 2.654 -21.222 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -15.599 3.116 -22.978 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -13.960 3.243 -23.661 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -14.942 1.790 -23.966 1.00 0.00 H new ATOM 1100 N ARG A 72 -15.498 -0.053 -22.123 1.00 0.00 N ATOM 1101 CA ARG A 72 -16.509 -1.014 -21.621 1.00 0.00 C ATOM 1102 C ARG A 72 -16.168 -1.479 -20.212 1.00 0.00 C ATOM 1103 O ARG A 72 -16.994 -1.450 -19.328 1.00 0.00 O ATOM 1104 CB ARG A 72 -16.518 -2.237 -22.554 1.00 0.00 C ATOM 1105 CG ARG A 72 -17.231 -1.869 -23.859 1.00 0.00 C ATOM 1106 CD ARG A 72 -18.746 -1.951 -23.650 1.00 0.00 C ATOM 1107 NE ARG A 72 -19.358 -0.645 -24.024 1.00 0.00 N ATOM 1108 CZ ARG A 72 -20.110 -0.570 -25.087 1.00 0.00 C ATOM 1109 NH1 ARG A 72 -19.739 -1.201 -26.168 1.00 0.00 N ATOM 1110 NH2 ARG A 72 -21.208 0.132 -25.033 1.00 0.00 N ATOM 0 H ARG A 72 -15.116 -0.259 -23.046 1.00 0.00 H new ATOM 0 HA ARG A 72 -17.483 -0.525 -21.600 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -15.497 -2.559 -22.761 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -17.024 -3.073 -22.072 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -16.949 -0.863 -24.169 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -16.925 -2.546 -24.657 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -19.167 -2.752 -24.258 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -18.970 -2.188 -22.610 1.00 0.00 H new ATOM 0 HE ARG A 72 -19.190 0.184 -23.453 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -18.874 -1.741 -26.172 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -20.314 -1.154 -27.009 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -21.465 0.610 -24.170 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -21.809 0.203 -25.854 1.00 0.00 H new ATOM 1124 N TYR A 73 -14.957 -1.893 -20.023 1.00 0.00 N ATOM 1125 CA TYR A 73 -14.560 -2.360 -18.679 1.00 0.00 C ATOM 1126 C TYR A 73 -14.980 -1.368 -17.596 1.00 0.00 C ATOM 1127 O TYR A 73 -15.890 -1.624 -16.841 1.00 0.00 O ATOM 1128 CB TYR A 73 -13.025 -2.509 -18.655 1.00 0.00 C ATOM 1129 CG TYR A 73 -12.518 -2.372 -17.215 1.00 0.00 C ATOM 1130 CD1 TYR A 73 -13.278 -2.828 -16.154 1.00 0.00 C ATOM 1131 CD2 TYR A 73 -11.306 -1.769 -16.956 1.00 0.00 C ATOM 1132 CE1 TYR A 73 -12.834 -2.680 -14.862 1.00 0.00 C ATOM 1133 CE2 TYR A 73 -10.863 -1.621 -15.663 1.00 0.00 C ATOM 1134 CZ TYR A 73 -11.624 -2.076 -14.603 1.00 0.00 C ATOM 1135 OH TYR A 73 -11.184 -1.927 -13.306 1.00 0.00 O ATOM 0 H TYR A 73 -14.228 -1.929 -20.736 1.00 0.00 H new ATOM 0 HA TYR A 73 -15.054 -3.310 -18.476 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -12.737 -3.478 -19.062 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -12.566 -1.749 -19.287 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -14.229 -3.305 -16.342 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -10.700 -1.410 -17.775 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -13.439 -3.040 -14.043 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -9.912 -1.145 -15.474 1.00 0.00 H new ATOM 0 HH TYR A 73 -11.930 -2.075 -12.688 1.00 0.00 H new ATOM 1145 N ARG A 74 -14.319 -0.253 -17.560 1.00 0.00 N ATOM 1146 CA ARG A 74 -14.654 0.777 -16.534 1.00 0.00 C ATOM 1147 C ARG A 74 -16.143 1.115 -16.495 1.00 0.00 C ATOM 1148 O ARG A 74 -16.803 0.921 -15.493 1.00 0.00 O ATOM 1149 CB ARG A 74 -13.885 2.056 -16.885 1.00 0.00 C ATOM 1150 CG ARG A 74 -12.393 1.820 -16.673 1.00 0.00 C ATOM 1151 CD ARG A 74 -11.779 3.070 -16.046 1.00 0.00 C ATOM 1152 NE ARG A 74 -12.322 3.233 -14.669 1.00 0.00 N ATOM 1153 CZ ARG A 74 -12.464 4.432 -14.173 1.00 0.00 C ATOM 1154 NH1 ARG A 74 -13.289 5.262 -14.753 1.00 0.00 N ATOM 1155 NH2 ARG A 74 -11.777 4.760 -13.113 1.00 0.00 N ATOM 0 H ARG A 74 -13.560 -0.005 -18.194 1.00 0.00 H new ATOM 0 HA ARG A 74 -14.381 0.377 -15.557 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -14.077 2.337 -17.920 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -14.227 2.882 -16.262 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -12.236 0.957 -16.025 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -11.908 1.598 -17.623 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -10.693 2.982 -16.015 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -12.011 3.948 -16.649 1.00 0.00 H new ATOM 0 HE ARG A 74 -12.581 2.415 -14.118 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -13.810 4.969 -15.580 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -13.413 6.203 -14.379 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -11.143 4.084 -12.687 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -11.874 5.692 -12.711 1.00 0.00 H new ATOM 1169 N ILE A 75 -16.635 1.608 -17.584 1.00 0.00 N ATOM 1170 CA ILE A 75 -18.077 1.978 -17.649 1.00 0.00 C ATOM 1171 C ILE A 75 -18.989 0.921 -17.032 1.00 0.00 C ATOM 1172 O ILE A 75 -19.747 1.206 -16.127 1.00 0.00 O ATOM 1173 CB ILE A 75 -18.459 2.146 -19.118 1.00 0.00 C ATOM 1174 CG1 ILE A 75 -17.693 3.315 -19.723 1.00 0.00 C ATOM 1175 CG2 ILE A 75 -19.962 2.460 -19.198 1.00 0.00 C ATOM 1176 CD1 ILE A 75 -18.043 3.427 -21.208 1.00 0.00 C ATOM 0 H ILE A 75 -16.105 1.774 -18.439 1.00 0.00 H new ATOM 0 HA ILE A 75 -18.210 2.898 -17.080 1.00 0.00 H new ATOM 0 HB ILE A 75 -18.221 1.232 -19.662 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -17.948 4.240 -19.206 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -16.620 3.166 -19.600 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -20.253 2.583 -20.241 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -20.529 1.640 -18.758 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -20.171 3.380 -18.652 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -17.498 4.262 -21.648 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -17.766 2.504 -21.718 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -19.114 3.595 -21.318 1.00 0.00 H new ATOM 1188 N ILE A 76 -18.897 -0.272 -17.524 1.00 0.00 N ATOM 1189 CA ILE A 76 -19.754 -1.359 -16.984 1.00 0.00 C ATOM 1190 C ILE A 76 -19.149 -2.036 -15.739 1.00 0.00 C ATOM 1191 O ILE A 76 -19.810 -2.815 -15.084 1.00 0.00 O ATOM 1192 CB ILE A 76 -19.933 -2.389 -18.098 1.00 0.00 C ATOM 1193 CG1 ILE A 76 -20.185 -1.649 -19.405 1.00 0.00 C ATOM 1194 CG2 ILE A 76 -21.173 -3.260 -17.792 1.00 0.00 C ATOM 1195 CD1 ILE A 76 -20.841 -2.590 -20.400 1.00 0.00 C ATOM 0 H ILE A 76 -18.266 -0.547 -18.277 1.00 0.00 H new ATOM 0 HA ILE A 76 -20.705 -0.933 -16.666 1.00 0.00 H new ATOM 0 HB ILE A 76 -19.043 -3.014 -18.170 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -20.825 -0.785 -19.229 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -19.245 -1.272 -19.809 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -21.305 -3.997 -18.585 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -21.032 -3.772 -16.840 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -22.058 -2.626 -17.735 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -21.022 -2.061 -21.336 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -20.184 -3.440 -20.584 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -21.789 -2.945 -19.995 1.00 0.00 H new ATOM 1207 N TYR A 77 -17.918 -1.726 -15.417 1.00 0.00 N ATOM 1208 CA TYR A 77 -17.314 -2.374 -14.212 1.00 0.00 C ATOM 1209 C TYR A 77 -18.277 -2.335 -13.034 1.00 0.00 C ATOM 1210 O TYR A 77 -18.261 -3.203 -12.192 1.00 0.00 O ATOM 1211 CB TYR A 77 -16.022 -1.627 -13.814 1.00 0.00 C ATOM 1212 CG TYR A 77 -15.450 -2.230 -12.508 1.00 0.00 C ATOM 1213 CD1 TYR A 77 -15.359 -3.605 -12.328 1.00 0.00 C ATOM 1214 CD2 TYR A 77 -14.992 -1.402 -11.501 1.00 0.00 C ATOM 1215 CE1 TYR A 77 -14.821 -4.127 -11.171 1.00 0.00 C ATOM 1216 CE2 TYR A 77 -14.451 -1.932 -10.346 1.00 0.00 C ATOM 1217 CZ TYR A 77 -14.363 -3.296 -10.175 1.00 0.00 C ATOM 1218 OH TYR A 77 -13.820 -3.821 -9.021 1.00 0.00 O ATOM 0 H TYR A 77 -17.319 -1.071 -15.920 1.00 0.00 H new ATOM 0 HA TYR A 77 -17.094 -3.412 -14.461 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -15.286 -1.703 -14.614 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -16.232 -0.567 -13.674 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -15.713 -4.271 -13.101 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -15.058 -0.330 -11.618 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -14.759 -5.198 -11.045 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -14.094 -1.271 -9.570 1.00 0.00 H new ATOM 0 HH TYR A 77 -12.880 -3.553 -8.951 1.00 0.00 H new ATOM 1228 N SER A 78 -19.105 -1.329 -12.998 1.00 0.00 N ATOM 1229 CA SER A 78 -20.071 -1.228 -11.878 1.00 0.00 C ATOM 1230 C SER A 78 -21.085 -2.360 -11.938 1.00 0.00 C ATOM 1231 O SER A 78 -21.273 -3.080 -10.978 1.00 0.00 O ATOM 1232 CB SER A 78 -20.815 0.112 -11.993 1.00 0.00 C ATOM 1233 OG SER A 78 -21.750 0.085 -10.923 1.00 0.00 O ATOM 0 H SER A 78 -19.153 -0.581 -13.690 1.00 0.00 H new ATOM 0 HA SER A 78 -19.529 -1.292 -10.934 1.00 0.00 H new ATOM 0 HB2 SER A 78 -20.131 0.956 -11.903 1.00 0.00 H new ATOM 0 HB3 SER A 78 -21.315 0.208 -12.957 1.00 0.00 H new ATOM 0 HG SER A 78 -22.271 0.915 -10.923 1.00 0.00 H new ATOM 1239 N ASN A 79 -21.721 -2.497 -13.064 1.00 0.00 N ATOM 1240 CA ASN A 79 -22.725 -3.579 -13.203 1.00 0.00 C ATOM 1241 C ASN A 79 -22.066 -4.936 -13.037 1.00 0.00 C ATOM 1242 O ASN A 79 -22.693 -5.884 -12.625 1.00 0.00 O ATOM 1243 CB ASN A 79 -23.340 -3.496 -14.610 1.00 0.00 C ATOM 1244 CG ASN A 79 -24.569 -2.585 -14.575 1.00 0.00 C ATOM 1245 OD1 ASN A 79 -25.648 -2.965 -14.985 1.00 0.00 O ATOM 1246 ND2 ASN A 79 -24.450 -1.378 -14.096 1.00 0.00 N ATOM 0 H ASN A 79 -21.590 -1.910 -13.888 1.00 0.00 H new ATOM 0 HA ASN A 79 -23.491 -3.460 -12.437 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -22.607 -3.109 -15.317 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -23.621 -4.491 -14.955 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -25.260 -0.759 -14.067 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -23.547 -1.053 -13.750 1.00 0.00 H new ATOM 1253 N VAL A 80 -20.808 -5.009 -13.365 1.00 0.00 N ATOM 1254 CA VAL A 80 -20.106 -6.302 -13.226 1.00 0.00 C ATOM 1255 C VAL A 80 -20.030 -6.701 -11.762 1.00 0.00 C ATOM 1256 O VAL A 80 -20.228 -7.849 -11.416 1.00 0.00 O ATOM 1257 CB VAL A 80 -18.682 -6.144 -13.773 1.00 0.00 C ATOM 1258 CG1 VAL A 80 -17.849 -7.356 -13.359 1.00 0.00 C ATOM 1259 CG2 VAL A 80 -18.738 -6.065 -15.299 1.00 0.00 C ATOM 0 H VAL A 80 -20.245 -4.236 -13.719 1.00 0.00 H new ATOM 0 HA VAL A 80 -20.647 -7.071 -13.777 1.00 0.00 H new ATOM 0 HB VAL A 80 -18.230 -5.235 -13.375 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -16.835 -7.250 -13.745 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -17.818 -7.422 -12.271 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -18.299 -8.262 -13.765 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -17.729 -5.953 -15.695 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -19.183 -6.978 -15.694 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -19.342 -5.208 -15.597 1.00 0.00 H new ATOM 1269 N ILE A 81 -19.745 -5.741 -10.922 1.00 0.00 N ATOM 1270 CA ILE A 81 -19.654 -6.045 -9.480 1.00 0.00 C ATOM 1271 C ILE A 81 -21.040 -6.304 -8.906 1.00 0.00 C ATOM 1272 O ILE A 81 -21.180 -6.859 -7.834 1.00 0.00 O ATOM 1273 CB ILE A 81 -19.046 -4.852 -8.781 1.00 0.00 C ATOM 1274 CG1 ILE A 81 -17.712 -4.544 -9.411 1.00 0.00 C ATOM 1275 CG2 ILE A 81 -18.804 -5.200 -7.305 1.00 0.00 C ATOM 1276 CD1 ILE A 81 -17.365 -3.097 -9.141 1.00 0.00 C ATOM 0 H ILE A 81 -19.574 -4.769 -11.178 1.00 0.00 H new ATOM 0 HA ILE A 81 -19.041 -6.934 -9.333 1.00 0.00 H new ATOM 0 HB ILE A 81 -19.719 -3.999 -8.865 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -16.942 -5.199 -9.003 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -17.751 -4.728 -10.485 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -18.365 -4.342 -6.796 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -19.752 -5.457 -6.832 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -18.123 -6.049 -7.238 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -16.401 -2.864 -9.593 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -18.132 -2.453 -9.570 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -17.311 -2.930 -8.065 1.00 0.00 H new ATOM 1288 N SER A 82 -22.045 -5.892 -9.643 1.00 0.00 N ATOM 1289 CA SER A 82 -23.436 -6.096 -9.168 1.00 0.00 C ATOM 1290 C SER A 82 -24.046 -7.373 -9.752 1.00 0.00 C ATOM 1291 O SER A 82 -24.339 -8.302 -9.026 1.00 0.00 O ATOM 1292 CB SER A 82 -24.283 -4.891 -9.611 1.00 0.00 C ATOM 1293 OG SER A 82 -24.349 -5.007 -11.024 1.00 0.00 O ATOM 0 H SER A 82 -21.956 -5.427 -10.546 1.00 0.00 H new ATOM 0 HA SER A 82 -23.423 -6.191 -8.082 1.00 0.00 H new ATOM 0 HB2 SER A 82 -25.276 -4.917 -9.163 1.00 0.00 H new ATOM 0 HB3 SER A 82 -23.823 -3.950 -9.311 1.00 0.00 H new ATOM 0 HG SER A 82 -25.049 -4.414 -11.369 1.00 0.00 H new ATOM 1299 N LYS A 83 -24.227 -7.388 -11.059 1.00 0.00 N ATOM 1300 CA LYS A 83 -24.821 -8.594 -11.716 1.00 0.00 C ATOM 1301 C LYS A 83 -23.827 -9.282 -12.661 1.00 0.00 C ATOM 1302 O LYS A 83 -22.930 -9.970 -12.213 1.00 0.00 O ATOM 1303 CB LYS A 83 -26.050 -8.140 -12.518 1.00 0.00 C ATOM 1304 CG LYS A 83 -27.129 -7.641 -11.543 1.00 0.00 C ATOM 1305 CD LYS A 83 -27.821 -8.842 -10.886 1.00 0.00 C ATOM 1306 CE LYS A 83 -29.065 -8.358 -10.137 1.00 0.00 C ATOM 1307 NZ LYS A 83 -28.678 -7.553 -8.944 1.00 0.00 N ATOM 0 H LYS A 83 -23.990 -6.622 -11.689 1.00 0.00 H new ATOM 0 HA LYS A 83 -25.091 -9.315 -10.944 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -25.774 -7.346 -13.212 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -26.436 -8.966 -13.115 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -26.679 -7.005 -10.780 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -27.861 -7.032 -12.074 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -28.100 -9.575 -11.643 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -27.138 -9.339 -10.197 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -29.686 -7.758 -10.802 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -29.665 -9.213 -9.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -29.531 -7.290 -8.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -28.049 -8.115 -8.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -28.184 -6.691 -9.252 1.00 0.00 H new ATOM 1321 N ASN A 84 -23.997 -9.089 -13.956 1.00 0.00 N ATOM 1322 CA ASN A 84 -23.053 -9.745 -14.917 1.00 0.00 C ATOM 1323 C ASN A 84 -22.811 -8.902 -16.179 1.00 0.00 C ATOM 1324 O ASN A 84 -23.363 -7.830 -16.337 1.00 0.00 O ATOM 1325 CB ASN A 84 -23.678 -11.084 -15.343 1.00 0.00 C ATOM 1326 CG ASN A 84 -22.827 -11.718 -16.446 1.00 0.00 C ATOM 1327 OD1 ASN A 84 -21.699 -12.112 -16.225 1.00 0.00 O ATOM 1328 ND2 ASN A 84 -23.331 -11.839 -17.644 1.00 0.00 N ATOM 0 H ASN A 84 -24.731 -8.519 -14.376 1.00 0.00 H new ATOM 0 HA ASN A 84 -22.092 -9.871 -14.418 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -23.742 -11.756 -14.487 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -24.695 -10.925 -15.700 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -22.778 -12.263 -18.389 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -24.277 -11.510 -17.835 1.00 0.00 H new ATOM 1335 N ASN A 85 -21.976 -9.428 -17.055 1.00 0.00 N ATOM 1336 CA ASN A 85 -21.654 -8.709 -18.326 1.00 0.00 C ATOM 1337 C ASN A 85 -22.661 -9.074 -19.426 1.00 0.00 C ATOM 1338 O ASN A 85 -22.830 -10.232 -19.746 1.00 0.00 O ATOM 1339 CB ASN A 85 -20.259 -9.164 -18.778 1.00 0.00 C ATOM 1340 CG ASN A 85 -19.212 -8.608 -17.811 1.00 0.00 C ATOM 1341 OD1 ASN A 85 -18.878 -7.440 -17.845 1.00 0.00 O ATOM 1342 ND2 ASN A 85 -18.675 -9.406 -16.932 1.00 0.00 N ATOM 0 H ASN A 85 -21.506 -10.326 -16.938 1.00 0.00 H new ATOM 0 HA ASN A 85 -21.694 -7.633 -18.155 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -20.208 -10.253 -18.802 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -20.059 -8.813 -19.791 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -17.979 -9.049 -16.278 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -18.951 -10.387 -16.898 1.00 0.00 H new ATOM 1349 N PRO A 86 -23.327 -8.070 -19.994 1.00 0.00 N ATOM 1350 CA PRO A 86 -24.301 -8.320 -21.043 1.00 0.00 C ATOM 1351 C PRO A 86 -23.662 -8.953 -22.270 1.00 0.00 C ATOM 1352 O PRO A 86 -24.230 -9.840 -22.865 1.00 0.00 O ATOM 1353 CB PRO A 86 -24.862 -6.929 -21.413 1.00 0.00 C ATOM 1354 CG PRO A 86 -24.140 -5.882 -20.513 1.00 0.00 C ATOM 1355 CD PRO A 86 -23.161 -6.653 -19.618 1.00 0.00 C ATOM 0 HA PRO A 86 -25.069 -9.013 -20.701 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -24.689 -6.713 -22.467 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -25.940 -6.895 -21.253 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -23.610 -5.151 -21.123 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -24.861 -5.331 -19.909 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -22.135 -6.321 -19.778 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -23.385 -6.497 -18.563 1.00 0.00 H new ATOM 1363 N ASP A 87 -22.474 -8.502 -22.595 1.00 0.00 N ATOM 1364 CA ASP A 87 -21.755 -9.065 -23.800 1.00 0.00 C ATOM 1365 C ASP A 87 -20.683 -8.089 -24.293 1.00 0.00 C ATOM 1366 O ASP A 87 -20.375 -8.029 -25.468 1.00 0.00 O ATOM 1367 CB ASP A 87 -22.780 -9.284 -24.950 1.00 0.00 C ATOM 1368 CG ASP A 87 -23.877 -8.220 -24.861 1.00 0.00 C ATOM 1369 OD1 ASP A 87 -23.528 -7.112 -24.487 1.00 0.00 O ATOM 1370 OD2 ASP A 87 -25.001 -8.576 -25.174 1.00 0.00 O ATOM 0 H ASP A 87 -21.969 -7.775 -22.088 1.00 0.00 H new ATOM 0 HA ASP A 87 -21.285 -10.006 -23.514 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -22.278 -9.225 -25.916 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -23.217 -10.280 -24.878 1.00 0.00 H new ATOM 1375 N LEU A 88 -20.142 -7.339 -23.387 1.00 0.00 N ATOM 1376 CA LEU A 88 -19.086 -6.357 -23.781 1.00 0.00 C ATOM 1377 C LEU A 88 -18.030 -6.983 -24.707 1.00 0.00 C ATOM 1378 O LEU A 88 -17.201 -6.285 -25.257 1.00 0.00 O ATOM 1379 CB LEU A 88 -18.380 -5.871 -22.508 1.00 0.00 C ATOM 1380 CG LEU A 88 -17.540 -7.016 -21.936 1.00 0.00 C ATOM 1381 CD1 LEU A 88 -16.063 -6.776 -22.267 1.00 0.00 C ATOM 1382 CD2 LEU A 88 -17.714 -7.055 -20.418 1.00 0.00 C ATOM 0 H LEU A 88 -20.377 -7.356 -22.395 1.00 0.00 H new ATOM 0 HA LEU A 88 -19.568 -5.540 -24.318 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -17.745 -5.014 -22.733 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -19.114 -5.539 -21.774 1.00 0.00 H new ATOM 0 HG LEU A 88 -17.864 -7.962 -22.370 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -15.462 -7.590 -21.861 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -15.935 -6.735 -23.349 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -15.740 -5.832 -21.827 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -17.118 -7.869 -20.004 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -17.383 -6.109 -19.989 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -18.765 -7.215 -20.176 1.00 0.00 H new ATOM 1394 N LYS A 89 -18.077 -8.280 -24.867 1.00 0.00 N ATOM 1395 CA LYS A 89 -17.076 -8.941 -25.751 1.00 0.00 C ATOM 1396 C LYS A 89 -17.422 -8.810 -27.245 1.00 0.00 C ATOM 1397 O LYS A 89 -16.589 -8.411 -28.034 1.00 0.00 O ATOM 1398 CB LYS A 89 -17.022 -10.434 -25.390 1.00 0.00 C ATOM 1399 CG LYS A 89 -18.320 -11.113 -25.833 1.00 0.00 C ATOM 1400 CD LYS A 89 -18.471 -12.442 -25.089 1.00 0.00 C ATOM 1401 CE LYS A 89 -19.607 -13.252 -25.722 1.00 0.00 C ATOM 1402 NZ LYS A 89 -19.134 -14.617 -26.086 1.00 0.00 N ATOM 0 H LYS A 89 -18.757 -8.902 -24.429 1.00 0.00 H new ATOM 0 HA LYS A 89 -16.117 -8.448 -25.592 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -16.168 -10.906 -25.876 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -16.884 -10.555 -24.315 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -19.172 -10.467 -25.624 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -18.306 -11.284 -26.909 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -17.539 -13.005 -25.134 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -18.682 -12.260 -24.035 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -20.442 -13.324 -25.026 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -19.976 -12.739 -26.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -19.916 -15.153 -26.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -18.352 -14.543 -26.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -18.804 -15.109 -25.232 1.00 0.00 H new ATOM 1416 N HIS A 90 -18.638 -9.148 -27.608 1.00 0.00 N ATOM 1417 CA HIS A 90 -19.026 -9.045 -29.051 1.00 0.00 C ATOM 1418 C HIS A 90 -19.730 -7.723 -29.383 1.00 0.00 C ATOM 1419 O HIS A 90 -19.801 -7.338 -30.533 1.00 0.00 O ATOM 1420 CB HIS A 90 -19.985 -10.199 -29.373 1.00 0.00 C ATOM 1421 CG HIS A 90 -19.187 -11.359 -29.973 1.00 0.00 C ATOM 1422 ND1 HIS A 90 -19.262 -12.548 -29.599 1.00 0.00 N ATOM 1423 CD2 HIS A 90 -18.260 -11.355 -30.998 1.00 0.00 C ATOM 1424 CE1 HIS A 90 -18.490 -13.297 -30.270 1.00 0.00 C ATOM 1425 NE2 HIS A 90 -17.804 -12.623 -31.192 1.00 0.00 N ATOM 0 H HIS A 90 -19.367 -9.485 -26.979 1.00 0.00 H new ATOM 0 HA HIS A 90 -18.113 -9.090 -29.645 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -20.499 -10.524 -28.469 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -20.751 -9.867 -30.074 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -17.947 -10.485 -31.556 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -18.399 -14.361 -30.112 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -17.119 -12.966 -31.865 1.00 0.00 H new ATOM 1433 N LYS A 91 -20.241 -7.059 -28.389 1.00 0.00 N ATOM 1434 CA LYS A 91 -20.935 -5.774 -28.655 1.00 0.00 C ATOM 1435 C LYS A 91 -20.090 -4.838 -29.512 1.00 0.00 C ATOM 1436 O LYS A 91 -20.609 -3.926 -30.123 1.00 0.00 O ATOM 1437 CB LYS A 91 -21.209 -5.091 -27.307 1.00 0.00 C ATOM 1438 CG LYS A 91 -22.537 -5.594 -26.747 1.00 0.00 C ATOM 1439 CD LYS A 91 -23.675 -4.842 -27.429 1.00 0.00 C ATOM 1440 CE LYS A 91 -24.945 -5.693 -27.382 1.00 0.00 C ATOM 1441 NZ LYS A 91 -25.947 -5.185 -28.359 1.00 0.00 N ATOM 0 H LYS A 91 -20.209 -7.347 -27.411 1.00 0.00 H new ATOM 0 HA LYS A 91 -21.857 -5.985 -29.196 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -20.401 -5.305 -26.607 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -21.241 -4.009 -27.435 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -22.637 -6.666 -26.918 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -22.575 -5.439 -25.669 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -23.845 -3.887 -26.931 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -23.411 -4.620 -28.463 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -24.703 -6.732 -27.607 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -25.366 -5.674 -26.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -26.804 -5.773 -28.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -26.190 -4.201 -28.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -25.548 -5.226 -29.319 1.00 0.00 H new ATOM 1455 N ILE A 92 -18.809 -5.071 -29.547 1.00 0.00 N ATOM 1456 CA ILE A 92 -17.941 -4.189 -30.364 1.00 0.00 C ATOM 1457 C ILE A 92 -17.861 -4.675 -31.809 1.00 0.00 C ATOM 1458 O ILE A 92 -17.600 -3.902 -32.709 1.00 0.00 O ATOM 1459 CB ILE A 92 -16.536 -4.203 -29.764 1.00 0.00 C ATOM 1460 CG1 ILE A 92 -16.611 -3.911 -28.272 1.00 0.00 C ATOM 1461 CG2 ILE A 92 -15.704 -3.097 -30.441 1.00 0.00 C ATOM 1462 CD1 ILE A 92 -17.347 -2.588 -28.052 1.00 0.00 C ATOM 0 H ILE A 92 -18.333 -5.824 -29.051 1.00 0.00 H new ATOM 0 HA ILE A 92 -18.362 -3.184 -30.361 1.00 0.00 H new ATOM 0 HB ILE A 92 -16.080 -5.180 -29.921 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -17.130 -4.719 -27.757 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -15.608 -3.857 -27.849 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -14.697 -3.093 -30.024 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -15.652 -3.286 -31.513 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -16.174 -2.129 -30.265 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -17.403 -2.376 -26.984 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -16.809 -1.784 -28.554 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -18.355 -2.660 -28.461 1.00 0.00 H new ATOM 1474 N ALA A 93 -18.090 -5.943 -32.006 1.00 0.00 N ATOM 1475 CA ALA A 93 -18.029 -6.489 -33.387 1.00 0.00 C ATOM 1476 C ALA A 93 -19.346 -6.280 -34.135 1.00 0.00 C ATOM 1477 O ALA A 93 -19.370 -6.233 -35.348 1.00 0.00 O ATOM 1478 CB ALA A 93 -17.748 -7.999 -33.297 1.00 0.00 C ATOM 0 H ALA A 93 -18.315 -6.619 -31.276 1.00 0.00 H new ATOM 0 HA ALA A 93 -17.242 -5.967 -33.932 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -17.699 -8.420 -34.301 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -16.798 -8.163 -32.788 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -18.547 -8.485 -32.738 1.00 0.00 H new ATOM 1484 N ASN A 94 -20.420 -6.156 -33.401 1.00 0.00 N ATOM 1485 CA ASN A 94 -21.736 -5.951 -34.067 1.00 0.00 C ATOM 1486 C ASN A 94 -21.864 -4.534 -34.636 1.00 0.00 C ATOM 1487 O ASN A 94 -22.733 -4.264 -35.442 1.00 0.00 O ATOM 1488 CB ASN A 94 -22.842 -6.165 -33.021 1.00 0.00 C ATOM 1489 CG ASN A 94 -22.804 -7.615 -32.530 1.00 0.00 C ATOM 1490 OD1 ASN A 94 -21.958 -8.448 -33.076 1.00 0.00 O flip ATOM 1491 ND2 ASN A 94 -23.541 -8.003 -31.645 1.00 0.00 N flip ATOM 0 H ASN A 94 -20.443 -6.187 -32.382 1.00 0.00 H new ATOM 0 HA ASN A 94 -21.824 -6.658 -34.892 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -22.702 -5.482 -32.183 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -23.817 -5.942 -33.455 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -24.204 -7.359 -31.214 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -23.497 -8.973 -31.333 1.00 0.00 H new ATOM 1498 N GLY A 95 -20.998 -3.660 -34.206 1.00 0.00 N ATOM 1499 CA GLY A 95 -21.055 -2.250 -34.714 1.00 0.00 C ATOM 1500 C GLY A 95 -20.513 -2.145 -36.150 1.00 0.00 C ATOM 1501 O GLY A 95 -20.621 -1.119 -36.776 1.00 0.00 O ATOM 0 H GLY A 95 -20.258 -3.852 -33.531 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -22.085 -1.893 -34.686 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -20.475 -1.602 -34.057 1.00 0.00 H new ATOM 1505 N ASP A 96 -19.938 -3.199 -36.633 1.00 0.00 N ATOM 1506 CA ASP A 96 -19.385 -3.171 -38.021 1.00 0.00 C ATOM 1507 C ASP A 96 -20.382 -2.583 -39.040 1.00 0.00 C ATOM 1508 O ASP A 96 -20.031 -2.361 -40.183 1.00 0.00 O ATOM 1509 CB ASP A 96 -19.052 -4.614 -38.436 1.00 0.00 C ATOM 1510 CG ASP A 96 -20.348 -5.413 -38.600 1.00 0.00 C ATOM 1511 OD1 ASP A 96 -21.373 -4.864 -38.229 1.00 0.00 O ATOM 1512 OD2 ASP A 96 -20.239 -6.526 -39.086 1.00 0.00 O ATOM 0 H ASP A 96 -19.823 -4.082 -36.135 1.00 0.00 H new ATOM 0 HA ASP A 96 -18.500 -2.534 -38.019 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -18.492 -4.614 -39.371 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -18.417 -5.082 -37.684 1.00 0.00 H new ATOM 1517 N ILE A 97 -21.601 -2.345 -38.617 1.00 0.00 N ATOM 1518 CA ILE A 97 -22.611 -1.775 -39.571 1.00 0.00 C ATOM 1519 C ILE A 97 -22.642 -0.236 -39.573 1.00 0.00 C ATOM 1520 O ILE A 97 -23.416 0.358 -40.297 1.00 0.00 O ATOM 1521 CB ILE A 97 -23.994 -2.269 -39.151 1.00 0.00 C ATOM 1522 CG1 ILE A 97 -23.889 -3.657 -38.544 1.00 0.00 C ATOM 1523 CG2 ILE A 97 -24.885 -2.348 -40.401 1.00 0.00 C ATOM 1524 CD1 ILE A 97 -25.289 -4.137 -38.153 1.00 0.00 C ATOM 0 H ILE A 97 -21.938 -2.516 -37.670 1.00 0.00 H new ATOM 0 HA ILE A 97 -22.332 -2.102 -40.573 1.00 0.00 H new ATOM 0 HB ILE A 97 -24.416 -1.583 -38.416 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -23.440 -4.347 -39.258 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -23.240 -3.637 -37.669 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -25.877 -2.699 -40.119 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -24.965 -1.360 -40.854 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -24.445 -3.041 -41.118 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -25.223 -5.133 -37.716 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -25.719 -3.449 -37.425 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -25.923 -4.171 -39.039 1.00 0.00 H new ATOM 1536 N THR A 98 -21.811 0.381 -38.777 1.00 0.00 N ATOM 1537 CA THR A 98 -21.805 1.875 -38.743 1.00 0.00 C ATOM 1538 C THR A 98 -20.749 2.496 -39.678 1.00 0.00 C ATOM 1539 O THR A 98 -21.001 3.501 -40.312 1.00 0.00 O ATOM 1540 CB THR A 98 -21.502 2.331 -37.316 1.00 0.00 C ATOM 1541 OG1 THR A 98 -21.314 1.152 -36.570 1.00 0.00 O ATOM 1542 CG2 THR A 98 -22.733 2.994 -36.684 1.00 0.00 C ATOM 0 H THR A 98 -21.143 -0.076 -38.156 1.00 0.00 H new ATOM 0 HA THR A 98 -22.786 2.208 -39.082 1.00 0.00 H new ATOM 0 HB THR A 98 -20.656 3.018 -37.324 1.00 0.00 H new ATOM 0 HG1 THR A 98 -21.113 1.383 -35.639 1.00 0.00 H new ATOM 0 HG21 THR A 98 -22.495 3.311 -35.669 1.00 0.00 H new ATOM 0 HG22 THR A 98 -23.023 3.862 -37.276 1.00 0.00 H new ATOM 0 HG23 THR A 98 -23.557 2.281 -36.658 1.00 0.00 H new ATOM 1550 N PRO A 99 -19.581 1.882 -39.740 1.00 0.00 N ATOM 1551 CA PRO A 99 -18.493 2.379 -40.591 1.00 0.00 C ATOM 1552 C PRO A 99 -18.853 2.402 -42.086 1.00 0.00 C ATOM 1553 O PRO A 99 -19.983 2.645 -42.457 1.00 0.00 O ATOM 1554 CB PRO A 99 -17.321 1.401 -40.342 1.00 0.00 C ATOM 1555 CG PRO A 99 -17.763 0.440 -39.196 1.00 0.00 C ATOM 1556 CD PRO A 99 -19.265 0.673 -38.967 1.00 0.00 C ATOM 0 HA PRO A 99 -18.258 3.413 -40.341 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -17.088 0.840 -41.247 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -16.418 1.944 -40.063 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -17.571 -0.598 -39.468 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -17.199 0.641 -38.285 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -19.854 -0.179 -39.307 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -19.487 0.811 -37.909 1.00 0.00 H new ATOM 1564 N GLU A 100 -17.857 2.160 -42.908 1.00 0.00 N ATOM 1565 CA GLU A 100 -18.075 2.156 -44.390 1.00 0.00 C ATOM 1566 C GLU A 100 -19.331 1.386 -44.795 1.00 0.00 C ATOM 1567 O GLU A 100 -19.719 1.407 -45.937 1.00 0.00 O ATOM 1568 CB GLU A 100 -16.860 1.489 -45.049 1.00 0.00 C ATOM 1569 CG GLU A 100 -16.628 0.119 -44.406 1.00 0.00 C ATOM 1570 CD GLU A 100 -15.171 0.011 -43.953 1.00 0.00 C ATOM 1571 OE1 GLU A 100 -14.800 0.827 -43.126 1.00 0.00 O ATOM 1572 OE2 GLU A 100 -14.512 -0.882 -44.460 1.00 0.00 O ATOM 0 H GLU A 100 -16.900 1.965 -42.614 1.00 0.00 H new ATOM 0 HA GLU A 100 -18.202 3.189 -44.715 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -17.028 1.378 -46.120 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -15.976 2.115 -44.928 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -17.296 -0.013 -43.555 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -16.859 -0.673 -45.118 1.00 0.00 H new ATOM 1579 N PHE A 101 -19.925 0.709 -43.865 1.00 0.00 N ATOM 1580 CA PHE A 101 -21.156 -0.067 -44.188 1.00 0.00 C ATOM 1581 C PHE A 101 -22.197 0.798 -44.917 1.00 0.00 C ATOM 1582 O PHE A 101 -23.131 0.282 -45.499 1.00 0.00 O ATOM 1583 CB PHE A 101 -21.751 -0.553 -42.855 1.00 0.00 C ATOM 1584 CG PHE A 101 -23.028 -1.348 -43.112 1.00 0.00 C ATOM 1585 CD1 PHE A 101 -24.226 -0.696 -43.349 1.00 0.00 C ATOM 1586 CD2 PHE A 101 -23.008 -2.730 -43.087 1.00 0.00 C ATOM 1587 CE1 PHE A 101 -25.382 -1.417 -43.554 1.00 0.00 C ATOM 1588 CE2 PHE A 101 -24.166 -3.448 -43.291 1.00 0.00 C ATOM 1589 CZ PHE A 101 -25.352 -2.791 -43.525 1.00 0.00 C ATOM 0 H PHE A 101 -19.617 0.655 -42.894 1.00 0.00 H new ATOM 0 HA PHE A 101 -20.899 -0.897 -44.846 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -21.026 -1.174 -42.329 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -21.967 0.300 -42.211 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -24.255 0.383 -43.373 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -22.079 -3.250 -42.906 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -26.313 -0.902 -43.738 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -24.143 -4.527 -43.267 1.00 0.00 H new ATOM 0 HZ PHE A 101 -26.259 -3.355 -43.686 1.00 0.00 H new ATOM 1599 N LEU A 102 -22.012 2.090 -44.878 1.00 0.00 N ATOM 1600 CA LEU A 102 -22.985 2.992 -45.565 1.00 0.00 C ATOM 1601 C LEU A 102 -22.751 3.028 -47.077 1.00 0.00 C ATOM 1602 O LEU A 102 -23.543 3.578 -47.815 1.00 0.00 O ATOM 1603 CB LEU A 102 -22.803 4.412 -45.009 1.00 0.00 C ATOM 1604 CG LEU A 102 -22.983 4.384 -43.491 1.00 0.00 C ATOM 1605 CD1 LEU A 102 -23.041 5.820 -42.965 1.00 0.00 C ATOM 1606 CD2 LEU A 102 -24.292 3.670 -43.153 1.00 0.00 C ATOM 0 H LEU A 102 -21.238 2.558 -44.406 1.00 0.00 H new ATOM 0 HA LEU A 102 -23.992 2.616 -45.384 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -21.813 4.791 -45.263 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -23.529 5.088 -45.461 1.00 0.00 H new ATOM 0 HG LEU A 102 -22.147 3.857 -43.030 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -23.169 5.806 -41.883 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -22.114 6.336 -43.214 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -23.881 6.342 -43.423 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -24.425 3.647 -42.071 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -25.126 4.203 -43.610 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -24.260 2.650 -43.536 1.00 0.00 H new ATOM 1618 N ALA A 103 -21.669 2.443 -47.507 1.00 0.00 N ATOM 1619 CA ALA A 103 -21.374 2.437 -48.963 1.00 0.00 C ATOM 1620 C ALA A 103 -22.120 1.315 -49.661 1.00 0.00 C ATOM 1621 O ALA A 103 -23.051 1.553 -50.404 1.00 0.00 O ATOM 1622 CB ALA A 103 -19.866 2.217 -49.148 1.00 0.00 C ATOM 0 H ALA A 103 -20.982 1.973 -46.918 1.00 0.00 H new ATOM 0 HA ALA A 103 -21.690 3.387 -49.395 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -19.627 2.209 -50.211 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -19.318 3.022 -48.659 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -19.580 1.263 -48.705 1.00 0.00 H new ATOM 1628 N THR A 104 -21.698 0.108 -49.416 1.00 0.00 N ATOM 1629 CA THR A 104 -22.377 -1.035 -50.057 1.00 0.00 C ATOM 1630 C THR A 104 -22.296 -2.275 -49.191 1.00 0.00 C ATOM 1631 O THR A 104 -21.284 -2.947 -49.145 1.00 0.00 O ATOM 1632 CB THR A 104 -21.705 -1.339 -51.381 1.00 0.00 C ATOM 1633 OG1 THR A 104 -20.315 -1.318 -51.115 1.00 0.00 O ATOM 1634 CG2 THR A 104 -21.931 -0.201 -52.391 1.00 0.00 C ATOM 0 H THR A 104 -20.918 -0.130 -48.804 1.00 0.00 H new ATOM 0 HA THR A 104 -23.424 -0.767 -50.202 1.00 0.00 H new ATOM 0 HB THR A 104 -22.090 -2.278 -51.779 1.00 0.00 H new ATOM 0 HG1 THR A 104 -20.113 -1.935 -50.381 1.00 0.00 H new ATOM 0 HG21 THR A 104 -21.438 -0.446 -53.332 1.00 0.00 H new ATOM 0 HG22 THR A 104 -23.000 -0.075 -52.564 1.00 0.00 H new ATOM 0 HG23 THR A 104 -21.516 0.725 -51.994 1.00 0.00 H new ATOM 1642 N CYS A 105 -23.364 -2.549 -48.525 1.00 0.00 N ATOM 1643 CA CYS A 105 -23.403 -3.739 -47.644 1.00 0.00 C ATOM 1644 C CYS A 105 -24.034 -4.917 -48.372 1.00 0.00 C ATOM 1645 O CYS A 105 -23.382 -5.902 -48.653 1.00 0.00 O ATOM 1646 CB CYS A 105 -24.257 -3.403 -46.414 1.00 0.00 C ATOM 1647 SG CYS A 105 -25.149 -4.765 -45.624 1.00 0.00 S ATOM 0 H CYS A 105 -24.222 -1.999 -48.549 1.00 0.00 H new ATOM 0 HA CYS A 105 -22.387 -4.006 -47.352 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -23.607 -2.947 -45.667 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -24.986 -2.647 -46.706 1.00 0.00 H new ATOM 0 HG CYS A 105 -25.417 -4.451 -44.391 1.00 0.00 H new ATOM 1653 N ASP A 106 -25.297 -4.789 -48.665 1.00 0.00 N ATOM 1654 CA ASP A 106 -25.997 -5.885 -49.376 1.00 0.00 C ATOM 1655 C ASP A 106 -25.892 -5.707 -50.886 1.00 0.00 C ATOM 1656 O ASP A 106 -25.845 -6.672 -51.624 1.00 0.00 O ATOM 1657 CB ASP A 106 -27.479 -5.857 -48.972 1.00 0.00 C ATOM 1658 CG ASP A 106 -28.170 -7.117 -49.501 1.00 0.00 C ATOM 1659 OD1 ASP A 106 -28.489 -7.106 -50.679 1.00 0.00 O ATOM 1660 OD2 ASP A 106 -28.340 -8.018 -48.696 1.00 0.00 O ATOM 0 H ASP A 106 -25.870 -3.975 -48.443 1.00 0.00 H new ATOM 0 HA ASP A 106 -25.537 -6.836 -49.106 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -27.571 -5.806 -47.887 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -27.961 -4.967 -49.376 1.00 0.00 H new ATOM 1665 N ALA A 107 -25.863 -4.476 -51.323 1.00 0.00 N ATOM 1666 CA ALA A 107 -25.760 -4.229 -52.785 1.00 0.00 C ATOM 1667 C ALA A 107 -24.390 -4.632 -53.290 1.00 0.00 C ATOM 1668 O ALA A 107 -24.156 -4.687 -54.481 1.00 0.00 O ATOM 1669 CB ALA A 107 -25.950 -2.727 -53.050 1.00 0.00 C ATOM 0 H ALA A 107 -25.906 -3.642 -50.737 1.00 0.00 H new ATOM 0 HA ALA A 107 -26.524 -4.814 -53.298 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -25.876 -2.534 -54.120 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -26.931 -2.416 -52.692 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -25.177 -2.164 -52.526 1.00 0.00 H new ATOM 1675 N LYS A 108 -23.501 -4.910 -52.376 1.00 0.00 N ATOM 1676 CA LYS A 108 -22.143 -5.310 -52.797 1.00 0.00 C ATOM 1677 C LYS A 108 -22.211 -6.441 -53.803 1.00 0.00 C ATOM 1678 O LYS A 108 -21.351 -6.567 -54.652 1.00 0.00 O ATOM 1679 CB LYS A 108 -21.359 -5.773 -51.563 1.00 0.00 C ATOM 1680 CG LYS A 108 -20.078 -6.472 -52.024 1.00 0.00 C ATOM 1681 CD LYS A 108 -19.038 -6.404 -50.905 1.00 0.00 C ATOM 1682 CE LYS A 108 -18.415 -7.788 -50.717 1.00 0.00 C ATOM 1683 NZ LYS A 108 -17.682 -8.200 -51.945 1.00 0.00 N ATOM 0 H LYS A 108 -23.660 -4.876 -51.369 1.00 0.00 H new ATOM 0 HA LYS A 108 -21.647 -4.459 -53.263 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -21.116 -4.920 -50.929 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -21.965 -6.453 -50.964 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -20.288 -7.511 -52.279 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -19.693 -5.994 -52.925 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -18.267 -5.675 -51.152 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -19.505 -6.072 -49.977 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -17.733 -7.774 -49.867 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -19.194 -8.516 -50.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -17.127 -9.057 -51.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -18.363 -8.397 -52.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -17.043 -7.435 -52.241 1.00 0.00 H new ATOM 1697 N ASP A 109 -23.230 -7.258 -53.695 1.00 0.00 N ATOM 1698 CA ASP A 109 -23.344 -8.375 -54.655 1.00 0.00 C ATOM 1699 C ASP A 109 -23.177 -7.808 -56.031 1.00 0.00 C ATOM 1700 O ASP A 109 -22.542 -8.388 -56.889 1.00 0.00 O ATOM 1701 CB ASP A 109 -24.737 -9.007 -54.524 1.00 0.00 C ATOM 1702 CG ASP A 109 -24.888 -9.603 -53.123 1.00 0.00 C ATOM 1703 OD1 ASP A 109 -24.311 -9.018 -52.221 1.00 0.00 O ATOM 1704 OD2 ASP A 109 -25.569 -10.612 -53.034 1.00 0.00 O ATOM 0 H ASP A 109 -23.969 -7.195 -52.995 1.00 0.00 H new ATOM 0 HA ASP A 109 -22.588 -9.136 -54.462 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -25.508 -8.256 -54.698 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -24.870 -9.782 -55.279 1.00 0.00 H new ATOM 1709 N LEU A 110 -23.761 -6.667 -56.210 1.00 0.00 N ATOM 1710 CA LEU A 110 -23.674 -5.995 -57.500 1.00 0.00 C ATOM 1711 C LEU A 110 -23.597 -4.504 -57.255 1.00 0.00 C ATOM 1712 O LEU A 110 -24.589 -3.803 -57.314 1.00 0.00 O ATOM 1713 CB LEU A 110 -24.939 -6.309 -58.308 1.00 0.00 C ATOM 1714 CG LEU A 110 -26.147 -6.257 -57.375 1.00 0.00 C ATOM 1715 CD1 LEU A 110 -27.232 -5.379 -58.002 1.00 0.00 C ATOM 1716 CD2 LEU A 110 -26.697 -7.671 -57.175 1.00 0.00 C ATOM 0 H LEU A 110 -24.301 -6.173 -55.500 1.00 0.00 H new ATOM 0 HA LEU A 110 -22.795 -6.332 -58.049 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -25.057 -5.589 -59.118 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -24.859 -7.295 -58.766 1.00 0.00 H new ATOM 0 HG LEU A 110 -25.847 -5.842 -56.413 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -28.096 -5.339 -57.339 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -26.843 -4.372 -58.152 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -27.531 -5.800 -58.962 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -27.559 -7.635 -56.509 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -26.999 -8.084 -58.138 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -25.925 -8.303 -56.735 1.00 0.00 H new ATOM 1728 N ALA A 111 -22.410 -4.049 -56.982 1.00 0.00 N ATOM 1729 CA ALA A 111 -22.213 -2.609 -56.724 1.00 0.00 C ATOM 1730 C ALA A 111 -21.763 -1.820 -57.976 1.00 0.00 C ATOM 1731 O ALA A 111 -21.968 -0.625 -58.048 1.00 0.00 O ATOM 1732 CB ALA A 111 -21.126 -2.467 -55.652 1.00 0.00 C ATOM 0 H ALA A 111 -21.566 -4.619 -56.927 1.00 0.00 H new ATOM 0 HA ALA A 111 -23.171 -2.197 -56.409 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -20.959 -1.411 -55.441 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -21.445 -2.973 -54.741 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -20.200 -2.916 -56.011 1.00 0.00 H new ATOM 1738 N PRO A 112 -21.153 -2.497 -58.948 1.00 0.00 N ATOM 1739 CA PRO A 112 -20.697 -1.820 -60.161 1.00 0.00 C ATOM 1740 C PRO A 112 -21.850 -1.172 -60.916 1.00 0.00 C ATOM 1741 O PRO A 112 -22.615 -1.839 -61.587 1.00 0.00 O ATOM 1742 CB PRO A 112 -20.056 -2.932 -61.020 1.00 0.00 C ATOM 1743 CG PRO A 112 -20.032 -4.226 -60.152 1.00 0.00 C ATOM 1744 CD PRO A 112 -20.892 -3.947 -58.909 1.00 0.00 C ATOM 0 HA PRO A 112 -20.002 -1.015 -59.925 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -20.629 -3.092 -61.933 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -19.047 -2.652 -61.322 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -20.427 -5.074 -60.712 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -19.011 -4.480 -59.866 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -21.821 -4.517 -58.935 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -20.370 -4.230 -57.995 1.00 0.00 H new ATOM 1752 N ALA A 113 -21.952 0.124 -60.789 1.00 0.00 N ATOM 1753 CA ALA A 113 -23.043 0.845 -61.487 1.00 0.00 C ATOM 1754 C ALA A 113 -22.794 2.352 -61.477 1.00 0.00 C ATOM 1755 O ALA A 113 -23.542 3.112 -60.893 1.00 0.00 O ATOM 1756 CB ALA A 113 -24.359 0.558 -60.747 1.00 0.00 C ATOM 0 H ALA A 113 -21.327 0.708 -60.233 1.00 0.00 H new ATOM 0 HA ALA A 113 -23.089 0.507 -62.522 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -25.177 1.079 -61.244 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -24.554 -0.514 -60.755 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -24.280 0.905 -59.717 1.00 0.00 H new ATOM 1762 N PRO A 114 -21.730 2.748 -62.133 1.00 0.00 N ATOM 1763 CA PRO A 114 -21.354 4.158 -62.218 1.00 0.00 C ATOM 1764 C PRO A 114 -22.437 4.982 -62.910 1.00 0.00 C ATOM 1765 O PRO A 114 -22.820 5.977 -62.317 1.00 0.00 O ATOM 1766 CB PRO A 114 -20.065 4.172 -63.070 1.00 0.00 C ATOM 1767 CG PRO A 114 -19.725 2.691 -63.423 1.00 0.00 C ATOM 1768 CD PRO A 114 -20.838 1.813 -62.824 1.00 0.00 C ATOM 1769 OXT PRO A 114 -22.821 4.571 -63.992 1.00 0.00 O ATOM 0 HA PRO A 114 -21.216 4.593 -61.228 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -20.210 4.759 -63.977 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -19.245 4.633 -62.519 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -19.668 2.556 -64.503 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -18.753 2.412 -63.015 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -21.368 1.264 -63.602 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -20.430 1.075 -62.134 1.00 0.00 H new TER 1777 PRO A 114