USER MOD reduce.3.24.130724 H: found=0, std=0, add=889, rem=0, adj=36 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 79 ASN : amide:sc= -0.0344 X(o=-0.53,f=-0.65) USER MOD Set 1.2: A 82 SER OG : rot -64:sc= -0.493 USER MOD Set 2.1: A 56 MET CE :methyl -158:sc= -7.78! (180deg=-8.16!) USER MOD Set 2.2: A 69 TYR OH : rot 141:sc= -5.16! USER MOD Set 3.1: A 18 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 50 LYS NZ :NH3+ -148:sc= -0.504 (180deg=-1.99!) USER MOD Set 4.1: A 2 SER OG : rot 180:sc= -0.305 USER MOD Set 4.2: A 3 HIS :FLIP no HD1:sc= -3.77! C(o=-6.5!,f=-4.1!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 MET CE :methyl -114:sc= 0 (180deg=-0.0251) USER MOD Single : A 7 ASN :FLIP amide:sc= -0.0405 F(o=-1.1,f=-0.04) USER MOD Single : A 8 SER OG : rot -76:sc= 0.699 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN :FLIP amide:sc= -0.153 F(o=-1.7,f=-0.15) USER MOD Single : A 15 THR OG1 : rot 73:sc= 1.61 USER MOD Single : A 19 HIS : no HD1:sc= -0.142 X(o=-0.14,f=-0.59) USER MOD Single : A 20 HIS : no HD1:sc= -0.553 X(o=-0.55,f=-0.34) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 28 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0141) 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 -80:sc= -7.27! USER MOD Single : A 40 HIS : no HD1:sc= -5.18! C(o=-5.2!,f=-9.4!) USER MOD Single : A 43 GLN : amide:sc= -0.0947 K(o=-0.095,f=-2.4!) USER MOD Single : A 44 SER OG : rot 49:sc= 1.07 USER MOD Single : A 47 HIS : no HD1:sc= -0.456 K(o=-0.46,f=-1.2!) USER MOD Single : A 48 THR OG1 : rot 89:sc= 1.17 USER MOD Single : A 54 SER OG : rot -54:sc= 0.0967 USER MOD Single : A 57 ASN : amide:sc= -4.68! C(o=-4.7!,f=-9.3!) USER MOD Single : A 58 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.0886) USER MOD Single : A 60 ASN :FLIP amide:sc= -4.18 F(o=-5.4!,f=-4.2) USER MOD Single : A 61 ASN :FLIP amide:sc= -0.339 F(o=-2.6!,f=-0.34) USER MOD Single : A 62 CYS SG : rot 140:sc= -4.02! USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 ASN :FLIP amide:sc= -0.146 F(o=-1.7!,f=-0.15) USER MOD Single : A 70 LYS NZ :NH3+ -178:sc= -0.968 (180deg=-1.08) USER MOD Single : A 73 TYR OH : rot -100:sc= -3.4! USER MOD Single : A 77 TYR OH : rot -165:sc= -2.21 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ -164:sc= -0.124 (180deg=-0.706) USER MOD Single : A 84 ASN : amide:sc= -4.02! C(o=-4!,f=-4.7!) USER MOD Single : A 85 ASN :FLIP amide:sc= -6.02! C(o=-8.2!,f=-6!) USER MOD Single : A 89 LYS NZ :NH3+ 166:sc= -0.0133 (180deg=-0.312) USER MOD Single : A 90 HIS : no HD1:sc= -0.193 X(o=-0.19,f=-0.34) USER MOD Single : A 91 LYS NZ :NH3+ -154:sc= -0.104 (180deg=-0.641) USER MOD Single : A 94 ASN :FLIP amide:sc= -0.941 F(o=-1.8!,f=-0.94) USER MOD Single : A 98 THR OG1 : rot 53:sc= -5! USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 CYS SG : rot 180:sc= -1.44! USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 13.867 4.074 -7.731 1.00 0.00 N ATOM 2 CA GLY A 1 14.808 5.200 -7.471 1.00 0.00 C ATOM 3 C GLY A 1 15.220 5.199 -6.000 1.00 0.00 C ATOM 4 O GLY A 1 15.709 4.210 -5.488 1.00 0.00 O ATOM 0 H1 GLY A 1 13.589 4.078 -8.733 1.00 0.00 H new ATOM 0 H2 GLY A 1 14.334 3.172 -7.505 1.00 0.00 H new ATOM 0 H3 GLY A 1 13.021 4.184 -7.137 1.00 0.00 H new ATOM 0 HA2 GLY A 1 15.689 5.104 -8.105 1.00 0.00 H new ATOM 0 HA3 GLY A 1 14.334 6.148 -7.725 1.00 0.00 H new ATOM 10 N SER A 2 15.012 6.307 -5.346 1.00 0.00 N ATOM 11 CA SER A 2 15.383 6.383 -3.915 1.00 0.00 C ATOM 12 C SER A 2 14.463 5.503 -3.079 1.00 0.00 C ATOM 13 O SER A 2 14.066 4.436 -3.505 1.00 0.00 O ATOM 14 CB SER A 2 15.236 7.840 -3.451 1.00 0.00 C ATOM 15 OG SER A 2 13.836 8.072 -3.475 1.00 0.00 O ATOM 0 H SER A 2 14.604 7.155 -5.740 1.00 0.00 H new ATOM 0 HA SER A 2 16.409 6.038 -3.790 1.00 0.00 H new ATOM 0 HB2 SER A 2 15.647 7.983 -2.452 1.00 0.00 H new ATOM 0 HB3 SER A 2 15.765 8.525 -4.114 1.00 0.00 H new ATOM 0 HG SER A 2 13.652 8.990 -3.187 1.00 0.00 H new ATOM 21 N HIS A 3 14.138 5.962 -1.904 1.00 0.00 N ATOM 22 CA HIS A 3 13.243 5.157 -1.037 1.00 0.00 C ATOM 23 C HIS A 3 11.829 5.142 -1.601 1.00 0.00 C ATOM 24 O HIS A 3 11.235 4.097 -1.771 1.00 0.00 O ATOM 25 CB HIS A 3 13.211 5.797 0.361 1.00 0.00 C ATOM 26 CG HIS A 3 12.270 7.007 0.343 1.00 0.00 C ATOM 27 ND1 HIS A 3 12.463 8.271 -0.185 1.00 0.00 N flip ATOM 28 CD2 HIS A 3 11.119 7.022 0.827 1.00 0.00 C flip ATOM 29 CE1 HIS A 3 11.344 9.018 0.027 1.00 0.00 C flip ATOM 30 NE2 HIS A 3 10.560 8.150 0.667 1.00 0.00 N flip ATOM 0 H HIS A 3 14.450 6.850 -1.512 1.00 0.00 H new ATOM 0 HA HIS A 3 13.616 4.134 -0.988 1.00 0.00 H new ATOM 0 HB2 HIS A 3 12.873 5.070 1.099 1.00 0.00 H new ATOM 0 HB3 HIS A 3 14.214 6.106 0.655 1.00 0.00 H new ATOM 0 HD2 HIS A 3 10.657 6.180 1.320 1.00 0.00 H new ATOM 0 HE1 HIS A 3 11.144 10.043 -0.250 1.00 0.00 H new ATOM 0 HE2 HIS A 3 9.618 8.368 0.991 1.00 0.00 H new ATOM 38 N MET A 4 11.316 6.310 -1.879 1.00 0.00 N ATOM 39 CA MET A 4 9.945 6.397 -2.432 1.00 0.00 C ATOM 40 C MET A 4 9.658 7.818 -2.912 1.00 0.00 C ATOM 41 O MET A 4 9.029 8.596 -2.222 1.00 0.00 O ATOM 42 CB MET A 4 8.946 6.046 -1.315 1.00 0.00 C ATOM 43 CG MET A 4 7.568 5.790 -1.936 1.00 0.00 C ATOM 44 SD MET A 4 6.258 5.183 -0.841 1.00 0.00 S ATOM 45 CE MET A 4 6.840 3.475 -0.712 1.00 0.00 C ATOM 0 H MET A 4 11.790 7.203 -1.746 1.00 0.00 H new ATOM 0 HA MET A 4 9.850 5.708 -3.272 1.00 0.00 H new ATOM 0 HB2 MET A 4 9.284 5.163 -0.772 1.00 0.00 H new ATOM 0 HB3 MET A 4 8.888 6.861 -0.593 1.00 0.00 H new ATOM 0 HG2 MET A 4 7.224 6.720 -2.388 1.00 0.00 H new ATOM 0 HG3 MET A 4 7.692 5.069 -2.744 1.00 0.00 H new ATOM 0 HE1 MET A 4 6.118 2.808 -1.183 1.00 0.00 H new ATOM 0 HE2 MET A 4 7.803 3.380 -1.214 1.00 0.00 H new ATOM 0 HE3 MET A 4 6.950 3.206 0.339 1.00 0.00 H new ATOM 55 N PRO A 5 10.131 8.130 -4.101 1.00 0.00 N ATOM 56 CA PRO A 5 9.932 9.453 -4.677 1.00 0.00 C ATOM 57 C PRO A 5 8.455 9.760 -4.866 1.00 0.00 C ATOM 58 O PRO A 5 7.601 8.977 -4.500 1.00 0.00 O ATOM 59 CB PRO A 5 10.635 9.401 -6.051 1.00 0.00 C ATOM 60 CG PRO A 5 11.288 7.991 -6.183 1.00 0.00 C ATOM 61 CD PRO A 5 10.880 7.183 -4.940 1.00 0.00 C ATOM 0 HA PRO A 5 10.331 10.231 -4.026 1.00 0.00 H new ATOM 0 HB2 PRO A 5 9.919 9.570 -6.856 1.00 0.00 H new ATOM 0 HB3 PRO A 5 11.390 10.183 -6.126 1.00 0.00 H new ATOM 0 HG2 PRO A 5 10.950 7.494 -7.093 1.00 0.00 H new ATOM 0 HG3 PRO A 5 12.373 8.074 -6.249 1.00 0.00 H new ATOM 0 HD2 PRO A 5 10.266 6.324 -5.211 1.00 0.00 H new ATOM 0 HD3 PRO A 5 11.754 6.797 -4.416 1.00 0.00 H new ATOM 69 N ARG A 6 8.179 10.897 -5.434 1.00 0.00 N ATOM 70 CA ARG A 6 6.766 11.275 -5.654 1.00 0.00 C ATOM 71 C ARG A 6 6.263 10.730 -6.985 1.00 0.00 C ATOM 72 O ARG A 6 6.851 10.971 -8.020 1.00 0.00 O ATOM 73 CB ARG A 6 6.680 12.810 -5.677 1.00 0.00 C ATOM 74 CG ARG A 6 5.294 13.245 -5.194 1.00 0.00 C ATOM 75 CD ARG A 6 4.291 13.075 -6.335 1.00 0.00 C ATOM 76 NE ARG A 6 4.758 13.857 -7.514 1.00 0.00 N ATOM 77 CZ ARG A 6 3.974 13.985 -8.551 1.00 0.00 C ATOM 78 NH1 ARG A 6 2.682 14.015 -8.364 1.00 0.00 N ATOM 79 NH2 ARG A 6 4.507 14.080 -9.738 1.00 0.00 N ATOM 0 H ARG A 6 8.870 11.576 -5.753 1.00 0.00 H new ATOM 0 HA ARG A 6 6.152 10.859 -4.855 1.00 0.00 H new ATOM 0 HB2 ARG A 6 7.452 13.239 -5.038 1.00 0.00 H new ATOM 0 HB3 ARG A 6 6.859 13.181 -6.686 1.00 0.00 H new ATOM 0 HG2 ARG A 6 4.991 12.647 -4.334 1.00 0.00 H new ATOM 0 HG3 ARG A 6 5.319 14.284 -4.867 1.00 0.00 H new ATOM 0 HD2 ARG A 6 4.194 12.021 -6.597 1.00 0.00 H new ATOM 0 HD3 ARG A 6 3.305 13.418 -6.023 1.00 0.00 H new ATOM 0 HE ARG A 6 5.682 14.289 -7.511 1.00 0.00 H new ATOM 0 HH11 ARG A 6 2.301 13.939 -7.421 1.00 0.00 H new ATOM 0 HH12 ARG A 6 2.053 14.114 -9.161 1.00 0.00 H new ATOM 0 HH21 ARG A 6 5.521 14.054 -9.845 1.00 0.00 H new ATOM 0 HH22 ARG A 6 3.910 14.180 -10.559 1.00 0.00 H new ATOM 93 N ASN A 7 5.182 10.003 -6.932 1.00 0.00 N ATOM 94 CA ASN A 7 4.624 9.432 -8.182 1.00 0.00 C ATOM 95 C ASN A 7 3.228 8.870 -7.943 1.00 0.00 C ATOM 96 O ASN A 7 2.248 9.415 -8.411 1.00 0.00 O ATOM 97 CB ASN A 7 5.544 8.291 -8.645 1.00 0.00 C ATOM 98 CG ASN A 7 4.969 7.661 -9.914 1.00 0.00 C ATOM 99 OD1 ASN A 7 4.258 8.400 -10.720 1.00 0.00 O flip ATOM 100 ND2 ASN A 7 5.161 6.491 -10.181 1.00 0.00 N flip ATOM 0 H ASN A 7 4.665 9.782 -6.081 1.00 0.00 H new ATOM 0 HA ASN A 7 4.561 10.216 -8.936 1.00 0.00 H new ATOM 0 HB2 ASN A 7 6.547 8.672 -8.837 1.00 0.00 H new ATOM 0 HB3 ASN A 7 5.633 7.540 -7.861 1.00 0.00 H new ATOM 0 HD21 ASN A 7 5.716 5.909 -9.554 1.00 0.00 H new ATOM 0 HD22 ASN A 7 4.767 6.091 -11.032 1.00 0.00 H new ATOM 107 N SER A 8 3.161 7.786 -7.214 1.00 0.00 N ATOM 108 CA SER A 8 1.837 7.176 -6.934 1.00 0.00 C ATOM 109 C SER A 8 1.820 6.519 -5.557 1.00 0.00 C ATOM 110 O SER A 8 1.662 5.319 -5.443 1.00 0.00 O ATOM 111 CB SER A 8 1.563 6.100 -7.997 1.00 0.00 C ATOM 112 OG SER A 8 0.307 5.551 -7.620 1.00 0.00 O ATOM 0 H SER A 8 3.961 7.304 -6.805 1.00 0.00 H new ATOM 0 HA SER A 8 1.076 7.956 -6.958 1.00 0.00 H new ATOM 0 HB2 SER A 8 1.526 6.529 -8.998 1.00 0.00 H new ATOM 0 HB3 SER A 8 2.344 5.340 -8.005 1.00 0.00 H new ATOM 0 HG SER A 8 0.429 4.949 -6.856 1.00 0.00 H new ATOM 118 N LYS A 9 1.986 7.316 -4.534 1.00 0.00 N ATOM 119 CA LYS A 9 1.980 6.752 -3.161 1.00 0.00 C ATOM 120 C LYS A 9 0.564 6.390 -2.735 1.00 0.00 C ATOM 121 O LYS A 9 0.366 5.629 -1.807 1.00 0.00 O ATOM 122 CB LYS A 9 2.530 7.813 -2.195 1.00 0.00 C ATOM 123 CG LYS A 9 3.906 8.267 -2.680 1.00 0.00 C ATOM 124 CD LYS A 9 4.236 9.624 -2.049 1.00 0.00 C ATOM 125 CE LYS A 9 4.596 9.427 -0.571 1.00 0.00 C ATOM 126 NZ LYS A 9 5.671 10.376 -0.170 1.00 0.00 N ATOM 0 H LYS A 9 2.124 8.325 -4.593 1.00 0.00 H new ATOM 0 HA LYS A 9 2.594 5.852 -3.143 1.00 0.00 H new ATOM 0 HB2 LYS A 9 1.850 8.663 -2.144 1.00 0.00 H new ATOM 0 HB3 LYS A 9 2.603 7.403 -1.188 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.663 7.531 -2.407 1.00 0.00 H new ATOM 0 HG3 LYS A 9 3.915 8.345 -3.767 1.00 0.00 H new ATOM 0 HD2 LYS A 9 5.067 10.090 -2.578 1.00 0.00 H new ATOM 0 HD3 LYS A 9 3.383 10.296 -2.140 1.00 0.00 H new ATOM 0 HE2 LYS A 9 3.713 9.583 0.049 1.00 0.00 H new ATOM 0 HE3 LYS A 9 4.926 8.402 -0.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 5.905 10.232 0.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 6.517 10.208 -0.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 5.343 11.353 -0.312 1.00 0.00 H new ATOM 140 N ASN A 10 -0.400 6.941 -3.419 1.00 0.00 N ATOM 141 CA ASN A 10 -1.807 6.641 -3.068 1.00 0.00 C ATOM 142 C ASN A 10 -2.049 5.136 -3.071 1.00 0.00 C ATOM 143 O ASN A 10 -2.506 4.576 -2.093 1.00 0.00 O ATOM 144 CB ASN A 10 -2.718 7.296 -4.118 1.00 0.00 C ATOM 145 CG ASN A 10 -4.137 7.416 -3.559 1.00 0.00 C ATOM 146 OD1 ASN A 10 -4.767 6.334 -3.191 1.00 0.00 O flip ATOM 147 ND2 ASN A 10 -4.684 8.496 -3.451 1.00 0.00 N flip ATOM 0 H ASN A 10 -0.271 7.582 -4.201 1.00 0.00 H new ATOM 0 HA ASN A 10 -2.021 7.028 -2.072 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -2.335 8.282 -4.383 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -2.725 6.701 -5.031 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -4.197 9.345 -3.737 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -5.630 8.553 -3.074 1.00 0.00 H new ATOM 154 N ASP A 11 -1.740 4.507 -4.175 1.00 0.00 N ATOM 155 CA ASP A 11 -1.942 3.037 -4.267 1.00 0.00 C ATOM 156 C ASP A 11 -0.650 2.293 -3.943 1.00 0.00 C ATOM 157 O ASP A 11 -0.538 1.650 -2.917 1.00 0.00 O ATOM 158 CB ASP A 11 -2.358 2.699 -5.707 1.00 0.00 C ATOM 159 CG ASP A 11 -3.648 3.448 -6.047 1.00 0.00 C ATOM 160 OD1 ASP A 11 -4.512 3.455 -5.186 1.00 0.00 O ATOM 161 OD2 ASP A 11 -3.694 3.972 -7.147 1.00 0.00 O ATOM 0 H ASP A 11 -1.358 4.948 -5.012 1.00 0.00 H new ATOM 0 HA ASP A 11 -2.708 2.734 -3.553 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -1.567 2.979 -6.402 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -2.509 1.625 -5.812 1.00 0.00 H new ATOM 166 N GLY A 12 0.301 2.392 -4.832 1.00 0.00 N ATOM 167 CA GLY A 12 1.599 1.700 -4.603 1.00 0.00 C ATOM 168 C GLY A 12 1.369 0.232 -4.255 1.00 0.00 C ATOM 169 O GLY A 12 1.374 -0.143 -3.099 1.00 0.00 O ATOM 0 H GLY A 12 0.235 2.920 -5.702 1.00 0.00 H new ATOM 0 HA2 GLY A 12 2.220 1.775 -5.496 1.00 0.00 H new ATOM 0 HA3 GLY A 12 2.142 2.191 -3.795 1.00 0.00 H new ATOM 173 N VAL A 13 1.173 -0.570 -5.267 1.00 0.00 N ATOM 174 CA VAL A 13 0.940 -2.011 -5.027 1.00 0.00 C ATOM 175 C VAL A 13 1.652 -2.853 -6.058 1.00 0.00 C ATOM 176 O VAL A 13 1.802 -2.454 -7.196 1.00 0.00 O ATOM 177 CB VAL A 13 -0.573 -2.280 -5.121 1.00 0.00 C ATOM 178 CG1 VAL A 13 -1.092 -1.819 -6.486 1.00 0.00 C ATOM 179 CG2 VAL A 13 -0.827 -3.779 -4.964 1.00 0.00 C ATOM 0 H VAL A 13 1.165 -0.284 -6.246 1.00 0.00 H new ATOM 0 HA VAL A 13 1.324 -2.274 -4.041 1.00 0.00 H new ATOM 0 HB VAL A 13 -1.090 -1.733 -4.333 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -2.163 -2.010 -6.551 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -0.906 -0.752 -6.604 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -0.577 -2.367 -7.275 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -1.897 -3.976 -5.030 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -0.309 -4.321 -5.756 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -0.456 -4.111 -3.994 1.00 0.00 H new ATOM 189 N ASP A 14 2.078 -4.014 -5.649 1.00 0.00 N ATOM 190 CA ASP A 14 2.779 -4.890 -6.599 1.00 0.00 C ATOM 191 C ASP A 14 1.741 -5.688 -7.331 1.00 0.00 C ATOM 192 O ASP A 14 0.846 -6.240 -6.721 1.00 0.00 O ATOM 193 CB ASP A 14 3.699 -5.840 -5.819 1.00 0.00 C ATOM 194 CG ASP A 14 4.562 -6.626 -6.807 1.00 0.00 C ATOM 195 OD1 ASP A 14 4.681 -6.145 -7.924 1.00 0.00 O ATOM 196 OD2 ASP A 14 5.053 -7.662 -6.392 1.00 0.00 O ATOM 0 H ASP A 14 1.968 -4.384 -4.705 1.00 0.00 H new ATOM 0 HA ASP A 14 3.377 -4.307 -7.299 1.00 0.00 H new ATOM 0 HB2 ASP A 14 4.331 -5.274 -5.135 1.00 0.00 H new ATOM 0 HB3 ASP A 14 3.106 -6.524 -5.212 1.00 0.00 H new ATOM 201 N THR A 15 1.863 -5.751 -8.624 1.00 0.00 N ATOM 202 CA THR A 15 0.871 -6.510 -9.383 1.00 0.00 C ATOM 203 C THR A 15 1.481 -7.132 -10.629 1.00 0.00 C ATOM 204 O THR A 15 1.480 -6.555 -11.698 1.00 0.00 O ATOM 205 CB THR A 15 -0.253 -5.524 -9.778 1.00 0.00 C ATOM 206 OG1 THR A 15 0.285 -4.715 -10.804 1.00 0.00 O ATOM 207 CG2 THR A 15 -0.534 -4.526 -8.627 1.00 0.00 C ATOM 0 H THR A 15 2.602 -5.311 -9.172 1.00 0.00 H new ATOM 0 HA THR A 15 0.485 -7.328 -8.775 1.00 0.00 H new ATOM 0 HB THR A 15 -1.150 -6.085 -10.042 1.00 0.00 H new ATOM 0 HG1 THR A 15 0.358 -5.239 -11.629 1.00 0.00 H new ATOM 0 HG21 THR A 15 -1.328 -3.841 -8.925 1.00 0.00 H new ATOM 0 HG22 THR A 15 -0.843 -5.074 -7.737 1.00 0.00 H new ATOM 0 HG23 THR A 15 0.371 -3.959 -8.408 1.00 0.00 H new ATOM 215 N ALA A 16 1.995 -8.307 -10.458 1.00 0.00 N ATOM 216 CA ALA A 16 2.609 -9.004 -11.595 1.00 0.00 C ATOM 217 C ALA A 16 1.536 -9.852 -12.247 1.00 0.00 C ATOM 218 O ALA A 16 1.184 -10.906 -11.756 1.00 0.00 O ATOM 219 CB ALA A 16 3.742 -9.883 -11.058 1.00 0.00 C ATOM 0 H ALA A 16 2.014 -8.814 -9.573 1.00 0.00 H new ATOM 0 HA ALA A 16 3.017 -8.308 -12.328 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.215 -10.412 -11.885 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.481 -9.258 -10.557 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.337 -10.605 -10.349 1.00 0.00 H new ATOM 225 N ILE A 17 1.038 -9.375 -13.347 1.00 0.00 N ATOM 226 CA ILE A 17 0.007 -10.093 -14.043 1.00 0.00 C ATOM 227 C ILE A 17 0.423 -11.403 -14.566 1.00 0.00 C ATOM 228 O ILE A 17 1.426 -11.975 -14.186 1.00 0.00 O ATOM 229 CB ILE A 17 -0.449 -9.260 -15.204 1.00 0.00 C ATOM 230 CG1 ILE A 17 0.595 -9.272 -16.338 1.00 0.00 C ATOM 231 CG2 ILE A 17 -0.640 -7.840 -14.721 1.00 0.00 C ATOM 232 CD1 ILE A 17 2.023 -9.140 -15.767 1.00 0.00 C ATOM 0 H ILE A 17 1.324 -8.498 -13.782 1.00 0.00 H new ATOM 0 HA ILE A 17 -0.781 -10.279 -13.313 1.00 0.00 H new ATOM 0 HB ILE A 17 -1.381 -9.670 -15.594 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.510 -10.198 -16.907 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.397 -8.453 -17.030 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -0.972 -7.215 -15.550 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -1.390 -7.822 -13.930 1.00 0.00 H new ATOM 0 HG23 ILE A 17 0.304 -7.457 -14.334 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.744 -9.151 -16.584 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.110 -8.202 -15.218 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.224 -9.974 -15.095 1.00 0.00 H new ATOM 244 N TYR A 18 -0.390 -11.841 -15.433 1.00 0.00 N ATOM 245 CA TYR A 18 -0.179 -13.125 -16.079 1.00 0.00 C ATOM 246 C TYR A 18 0.426 -13.056 -17.480 1.00 0.00 C ATOM 247 O TYR A 18 1.571 -13.432 -17.648 1.00 0.00 O ATOM 248 CB TYR A 18 -1.528 -13.829 -16.147 1.00 0.00 C ATOM 249 CG TYR A 18 -2.184 -13.722 -14.780 1.00 0.00 C ATOM 250 CD1 TYR A 18 -1.540 -14.208 -13.660 1.00 0.00 C ATOM 251 CD2 TYR A 18 -3.406 -13.108 -14.636 1.00 0.00 C ATOM 252 CE1 TYR A 18 -2.109 -14.074 -12.415 1.00 0.00 C ATOM 253 CE2 TYR A 18 -3.977 -12.976 -13.390 1.00 0.00 C ATOM 254 CZ TYR A 18 -3.334 -13.457 -12.269 1.00 0.00 C ATOM 255 OH TYR A 18 -3.901 -13.314 -11.023 1.00 0.00 O ATOM 0 H TYR A 18 -1.228 -11.345 -15.736 1.00 0.00 H new ATOM 0 HA TYR A 18 0.555 -13.665 -15.481 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -2.159 -13.371 -16.909 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -1.398 -14.875 -16.427 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -0.582 -14.697 -13.762 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -3.921 -12.727 -15.505 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -1.593 -14.454 -11.546 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -4.937 -12.491 -13.290 1.00 0.00 H new ATOM 0 HH TYR A 18 -4.763 -12.856 -11.107 1.00 0.00 H new ATOM 265 N HIS A 19 -0.333 -12.567 -18.488 1.00 0.00 N ATOM 266 CA HIS A 19 0.293 -12.536 -19.853 1.00 0.00 C ATOM 267 C HIS A 19 0.890 -11.222 -20.453 1.00 0.00 C ATOM 268 O HIS A 19 2.080 -11.010 -20.312 1.00 0.00 O ATOM 269 CB HIS A 19 -0.779 -13.028 -20.820 1.00 0.00 C ATOM 270 CG HIS A 19 -0.743 -14.557 -20.852 1.00 0.00 C ATOM 271 ND1 HIS A 19 0.265 -15.248 -20.599 1.00 0.00 N ATOM 272 CD2 HIS A 19 -1.748 -15.463 -21.137 1.00 0.00 C ATOM 273 CE1 HIS A 19 0.015 -16.487 -20.692 1.00 0.00 C ATOM 274 NE2 HIS A 19 -1.250 -16.725 -21.034 1.00 0.00 N ATOM 0 H HIS A 19 -1.288 -12.217 -18.413 1.00 0.00 H new ATOM 0 HA HIS A 19 1.190 -13.141 -19.720 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -1.762 -12.679 -20.504 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -0.603 -12.625 -21.817 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -2.765 -15.210 -21.399 1.00 0.00 H new ATOM 0 HE1 HIS A 19 0.745 -17.262 -20.514 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -1.721 -17.618 -21.180 1.00 0.00 H new ATOM 282 N HIS A 20 0.071 -10.341 -21.112 1.00 0.00 N ATOM 283 CA HIS A 20 0.726 -9.084 -21.699 1.00 0.00 C ATOM 284 C HIS A 20 0.457 -7.629 -21.190 1.00 0.00 C ATOM 285 O HIS A 20 1.158 -7.122 -20.339 1.00 0.00 O ATOM 286 CB HIS A 20 0.303 -9.093 -23.160 1.00 0.00 C ATOM 287 CG HIS A 20 1.090 -8.035 -23.935 1.00 0.00 C ATOM 288 ND1 HIS A 20 0.663 -7.422 -24.932 1.00 0.00 N ATOM 289 CD2 HIS A 20 2.366 -7.547 -23.720 1.00 0.00 C ATOM 290 CE1 HIS A 20 1.519 -6.600 -25.376 1.00 0.00 C ATOM 291 NE2 HIS A 20 2.646 -6.606 -24.664 1.00 0.00 N ATOM 0 H HIS A 20 -0.935 -10.439 -21.251 1.00 0.00 H new ATOM 0 HA HIS A 20 1.767 -9.208 -21.399 1.00 0.00 H new ATOM 0 HB2 HIS A 20 0.478 -10.078 -23.592 1.00 0.00 H new ATOM 0 HB3 HIS A 20 -0.766 -8.895 -23.240 1.00 0.00 H new ATOM 0 HD2 HIS A 20 3.033 -7.861 -22.931 1.00 0.00 H new ATOM 0 HE1 HIS A 20 1.354 -5.966 -26.235 1.00 0.00 H new ATOM 0 HE2 HIS A 20 3.493 -6.053 -24.792 1.00 0.00 H new ATOM 299 N LYS A 21 -0.592 -6.998 -21.765 1.00 0.00 N ATOM 300 CA LYS A 21 -0.950 -5.565 -21.384 1.00 0.00 C ATOM 301 C LYS A 21 -2.169 -5.278 -20.491 1.00 0.00 C ATOM 302 O LYS A 21 -2.039 -4.623 -19.478 1.00 0.00 O ATOM 303 CB LYS A 21 -1.187 -4.825 -22.713 1.00 0.00 C ATOM 304 CG LYS A 21 -1.282 -3.312 -22.457 1.00 0.00 C ATOM 305 CD LYS A 21 0.126 -2.714 -22.325 1.00 0.00 C ATOM 306 CE LYS A 21 0.110 -1.288 -22.883 1.00 0.00 C ATOM 307 NZ LYS A 21 1.038 -0.405 -22.117 1.00 0.00 N ATOM 0 H LYS A 21 -1.199 -7.417 -22.469 1.00 0.00 H new ATOM 0 HA LYS A 21 -0.115 -5.246 -20.760 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -0.373 -5.035 -23.407 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -2.105 -5.182 -23.180 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -1.816 -2.829 -23.275 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -1.853 -3.123 -21.548 1.00 0.00 H new ATOM 0 HD2 LYS A 21 0.437 -2.707 -21.280 1.00 0.00 H new ATOM 0 HD3 LYS A 21 0.848 -3.324 -22.868 1.00 0.00 H new ATOM 0 HE2 LYS A 21 0.399 -1.301 -23.934 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -0.902 -0.886 -22.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 1.010 0.556 -22.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 0.746 -0.376 -21.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 2.006 -0.778 -22.183 1.00 0.00 H new ATOM 321 N LEU A 22 -3.323 -5.760 -20.865 1.00 0.00 N ATOM 322 CA LEU A 22 -4.514 -5.470 -20.016 1.00 0.00 C ATOM 323 C LEU A 22 -4.613 -6.388 -18.860 1.00 0.00 C ATOM 324 O LEU A 22 -5.546 -6.327 -18.089 1.00 0.00 O ATOM 325 CB LEU A 22 -5.783 -5.608 -20.887 1.00 0.00 C ATOM 326 CG LEU A 22 -6.075 -7.094 -21.167 1.00 0.00 C ATOM 327 CD1 LEU A 22 -7.444 -7.213 -21.845 1.00 0.00 C ATOM 328 CD2 LEU A 22 -4.992 -7.659 -22.095 1.00 0.00 C ATOM 0 H LEU A 22 -3.492 -6.326 -21.697 1.00 0.00 H new ATOM 0 HA LEU A 22 -4.414 -4.458 -19.623 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -6.633 -5.152 -20.379 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -5.648 -5.073 -21.827 1.00 0.00 H new ATOM 0 HG LEU A 22 -6.077 -7.654 -20.232 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.660 -8.262 -22.047 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -8.212 -6.805 -21.188 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -7.435 -6.657 -22.782 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -5.196 -8.711 -22.295 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -4.992 -7.105 -23.034 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -4.017 -7.563 -21.617 1.00 0.00 H new ATOM 340 N ARG A 23 -3.665 -7.205 -18.731 1.00 0.00 N ATOM 341 CA ARG A 23 -3.700 -8.119 -17.627 1.00 0.00 C ATOM 342 C ARG A 23 -3.388 -7.335 -16.345 1.00 0.00 C ATOM 343 O ARG A 23 -3.770 -7.723 -15.260 1.00 0.00 O ATOM 344 CB ARG A 23 -2.633 -9.189 -17.899 1.00 0.00 C ATOM 345 CG ARG A 23 -3.041 -10.494 -17.214 1.00 0.00 C ATOM 346 CD ARG A 23 -4.108 -11.193 -18.070 1.00 0.00 C ATOM 347 NE ARG A 23 -3.441 -12.030 -19.102 1.00 0.00 N ATOM 348 CZ ARG A 23 -4.143 -12.474 -20.108 1.00 0.00 C ATOM 349 NH1 ARG A 23 -5.067 -13.366 -19.884 1.00 0.00 N ATOM 350 NH2 ARG A 23 -3.901 -12.010 -21.304 1.00 0.00 N ATOM 0 H ARG A 23 -2.857 -7.281 -19.349 1.00 0.00 H new ATOM 0 HA ARG A 23 -4.673 -8.595 -17.509 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -2.524 -9.346 -18.972 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -1.664 -8.856 -17.526 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -2.173 -11.142 -17.090 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -3.432 -10.290 -16.217 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -4.747 -11.812 -17.441 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -4.751 -10.453 -18.546 1.00 0.00 H new ATOM 0 HE ARG A 23 -2.449 -12.254 -19.025 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -5.230 -13.704 -18.936 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -5.627 -13.726 -20.657 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -3.172 -11.310 -21.442 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -4.441 -12.347 -22.101 1.00 0.00 H new ATOM 364 N ASP A 24 -2.726 -6.204 -16.521 1.00 0.00 N ATOM 365 CA ASP A 24 -2.363 -5.350 -15.345 1.00 0.00 C ATOM 366 C ASP A 24 -3.363 -4.242 -15.104 1.00 0.00 C ATOM 367 O ASP A 24 -3.859 -4.088 -14.008 1.00 0.00 O ATOM 368 CB ASP A 24 -0.992 -4.705 -15.627 1.00 0.00 C ATOM 369 CG ASP A 24 -0.185 -4.593 -14.327 1.00 0.00 C ATOM 370 OD1 ASP A 24 -0.452 -5.394 -13.444 1.00 0.00 O ATOM 371 OD2 ASP A 24 0.659 -3.712 -14.291 1.00 0.00 O ATOM 0 H ASP A 24 -2.426 -5.843 -17.426 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.347 -5.986 -14.460 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -0.443 -5.303 -16.355 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -1.130 -3.716 -16.065 1.00 0.00 H new ATOM 376 N GLN A 25 -3.638 -3.479 -16.111 1.00 0.00 N ATOM 377 CA GLN A 25 -4.601 -2.393 -15.914 1.00 0.00 C ATOM 378 C GLN A 25 -5.854 -2.964 -15.368 1.00 0.00 C ATOM 379 O GLN A 25 -6.577 -2.313 -14.645 1.00 0.00 O ATOM 380 CB GLN A 25 -4.898 -1.723 -17.265 1.00 0.00 C ATOM 381 CG GLN A 25 -3.635 -1.735 -18.126 1.00 0.00 C ATOM 382 CD GLN A 25 -3.420 -0.348 -18.731 1.00 0.00 C ATOM 383 OE1 GLN A 25 -4.335 0.272 -19.238 1.00 0.00 O ATOM 384 NE2 GLN A 25 -2.227 0.172 -18.698 1.00 0.00 N ATOM 0 H GLN A 25 -3.241 -3.562 -17.047 1.00 0.00 H new ATOM 0 HA GLN A 25 -4.193 -1.654 -15.224 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -5.704 -2.250 -17.775 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -5.235 -0.698 -17.109 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -2.773 -2.018 -17.522 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -3.728 -2.479 -18.917 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -1.457 -0.345 -18.274 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -2.062 1.096 -19.097 1.00 0.00 H new ATOM 393 N VAL A 26 -6.098 -4.187 -15.704 1.00 0.00 N ATOM 394 CA VAL A 26 -7.302 -4.810 -15.207 1.00 0.00 C ATOM 395 C VAL A 26 -7.108 -5.282 -13.785 1.00 0.00 C ATOM 396 O VAL A 26 -7.858 -4.913 -12.908 1.00 0.00 O ATOM 397 CB VAL A 26 -7.652 -5.988 -16.111 1.00 0.00 C ATOM 398 CG1 VAL A 26 -8.887 -6.681 -15.560 1.00 0.00 C ATOM 399 CG2 VAL A 26 -7.951 -5.459 -17.522 1.00 0.00 C ATOM 0 H VAL A 26 -5.508 -4.768 -16.300 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.116 -4.085 -15.212 1.00 0.00 H new ATOM 0 HB VAL A 26 -6.822 -6.693 -16.150 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -9.146 -7.525 -16.199 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -8.684 -7.039 -14.551 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.718 -5.977 -15.534 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -8.203 -6.293 -18.177 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.790 -4.764 -17.480 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.073 -4.944 -17.911 1.00 0.00 H new ATOM 409 N LEU A 27 -6.102 -6.077 -13.564 1.00 0.00 N ATOM 410 CA LEU A 27 -5.873 -6.564 -12.182 1.00 0.00 C ATOM 411 C LEU A 27 -5.730 -5.391 -11.231 1.00 0.00 C ATOM 412 O LEU A 27 -6.003 -5.505 -10.046 1.00 0.00 O ATOM 413 CB LEU A 27 -4.568 -7.381 -12.152 1.00 0.00 C ATOM 414 CG LEU A 27 -4.908 -8.882 -12.178 1.00 0.00 C ATOM 415 CD1 LEU A 27 -3.763 -9.683 -12.828 1.00 0.00 C ATOM 416 CD2 LEU A 27 -5.093 -9.370 -10.743 1.00 0.00 C ATOM 0 H LEU A 27 -5.440 -6.405 -14.267 1.00 0.00 H new ATOM 0 HA LEU A 27 -6.720 -7.178 -11.875 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.944 -7.123 -13.007 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -3.996 -7.141 -11.256 1.00 0.00 H new ATOM 0 HG LEU A 27 -5.820 -9.029 -12.757 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -4.020 -10.742 -12.838 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -3.611 -9.337 -13.850 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -2.847 -9.537 -12.256 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -5.334 -10.433 -10.748 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -4.172 -9.210 -10.183 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -5.905 -8.816 -10.272 1.00 0.00 H new ATOM 428 N LYS A 28 -5.336 -4.266 -11.766 1.00 0.00 N ATOM 429 CA LYS A 28 -5.173 -3.084 -10.897 1.00 0.00 C ATOM 430 C LYS A 28 -6.470 -2.321 -10.831 1.00 0.00 C ATOM 431 O LYS A 28 -6.864 -1.846 -9.786 1.00 0.00 O ATOM 432 CB LYS A 28 -4.078 -2.172 -11.486 1.00 0.00 C ATOM 433 CG LYS A 28 -4.327 -0.733 -11.020 1.00 0.00 C ATOM 434 CD LYS A 28 -3.099 0.122 -11.320 1.00 0.00 C ATOM 435 CE LYS A 28 -3.391 1.565 -10.900 1.00 0.00 C ATOM 436 NZ LYS A 28 -4.231 2.249 -11.923 1.00 0.00 N ATOM 0 H LYS A 28 -5.125 -4.123 -12.754 1.00 0.00 H new ATOM 0 HA LYS A 28 -4.890 -3.405 -9.895 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -3.093 -2.508 -11.162 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -4.090 -2.223 -12.575 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -5.201 -0.322 -11.526 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -4.541 -0.718 -9.951 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -2.232 -0.260 -10.781 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -2.859 0.079 -12.382 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -3.902 1.573 -9.937 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -2.455 2.108 -10.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -4.320 3.257 -11.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -3.785 2.155 -12.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -5.175 1.814 -11.945 1.00 0.00 H new ATOM 450 N ALA A 29 -7.118 -2.213 -11.951 1.00 0.00 N ATOM 451 CA ALA A 29 -8.392 -1.486 -11.965 1.00 0.00 C ATOM 452 C ALA A 29 -9.428 -2.234 -11.154 1.00 0.00 C ATOM 453 O ALA A 29 -10.386 -1.663 -10.698 1.00 0.00 O ATOM 454 CB ALA A 29 -8.883 -1.381 -13.411 1.00 0.00 C ATOM 0 H ALA A 29 -6.817 -2.596 -12.847 1.00 0.00 H new ATOM 0 HA ALA A 29 -8.245 -0.495 -11.536 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.830 -0.842 -13.435 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -8.145 -0.845 -14.008 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -9.024 -2.381 -13.821 1.00 0.00 H new ATOM 460 N LEU A 30 -9.213 -3.510 -10.975 1.00 0.00 N ATOM 461 CA LEU A 30 -10.184 -4.289 -10.196 1.00 0.00 C ATOM 462 C LEU A 30 -9.910 -4.165 -8.722 1.00 0.00 C ATOM 463 O LEU A 30 -10.794 -3.866 -7.953 1.00 0.00 O ATOM 464 CB LEU A 30 -10.061 -5.758 -10.602 1.00 0.00 C ATOM 465 CG LEU A 30 -10.518 -5.908 -12.049 1.00 0.00 C ATOM 466 CD1 LEU A 30 -9.916 -7.181 -12.635 1.00 0.00 C ATOM 467 CD2 LEU A 30 -12.040 -6.003 -12.091 1.00 0.00 C ATOM 0 H LEU A 30 -8.413 -4.031 -11.335 1.00 0.00 H new ATOM 0 HA LEU A 30 -11.187 -3.911 -10.396 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.030 -6.094 -10.495 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -10.669 -6.383 -9.948 1.00 0.00 H new ATOM 0 HG LEU A 30 -10.190 -5.045 -12.629 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -10.239 -7.294 -13.670 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.828 -7.119 -12.599 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -10.249 -8.042 -12.055 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -12.369 -6.110 -13.124 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.367 -6.868 -11.514 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.473 -5.098 -11.664 1.00 0.00 H new ATOM 479 N TYR A 31 -8.686 -4.370 -8.350 1.00 0.00 N ATOM 480 CA TYR A 31 -8.351 -4.269 -6.918 1.00 0.00 C ATOM 481 C TYR A 31 -8.332 -2.820 -6.421 1.00 0.00 C ATOM 482 O TYR A 31 -8.659 -2.554 -5.280 1.00 0.00 O ATOM 483 CB TYR A 31 -6.957 -4.873 -6.710 1.00 0.00 C ATOM 484 CG TYR A 31 -6.379 -4.335 -5.406 1.00 0.00 C ATOM 485 CD1 TYR A 31 -5.858 -3.060 -5.350 1.00 0.00 C ATOM 486 CD2 TYR A 31 -6.387 -5.104 -4.263 1.00 0.00 C ATOM 487 CE1 TYR A 31 -5.354 -2.558 -4.172 1.00 0.00 C ATOM 488 CE2 TYR A 31 -5.883 -4.605 -3.081 1.00 0.00 C ATOM 489 CZ TYR A 31 -5.362 -3.328 -3.026 1.00 0.00 C ATOM 490 OH TYR A 31 -4.859 -2.828 -1.842 1.00 0.00 O ATOM 0 H TYR A 31 -7.911 -4.601 -8.971 1.00 0.00 H new ATOM 0 HA TYR A 31 -9.117 -4.802 -6.354 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -7.018 -5.961 -6.675 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -6.306 -4.617 -7.546 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -5.845 -2.449 -6.240 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -6.791 -6.105 -4.293 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -4.950 -1.557 -4.144 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -5.896 -5.218 -2.192 1.00 0.00 H new ATOM 0 HH TYR A 31 -4.946 -3.504 -1.138 1.00 0.00 H new ATOM 500 N ASP A 32 -7.954 -1.914 -7.270 1.00 0.00 N ATOM 501 CA ASP A 32 -7.912 -0.492 -6.840 1.00 0.00 C ATOM 502 C ASP A 32 -9.270 0.212 -6.945 1.00 0.00 C ATOM 503 O ASP A 32 -9.547 1.110 -6.174 1.00 0.00 O ATOM 504 CB ASP A 32 -6.891 0.247 -7.720 1.00 0.00 C ATOM 505 CG ASP A 32 -6.704 1.673 -7.200 1.00 0.00 C ATOM 506 OD1 ASP A 32 -6.161 1.788 -6.115 1.00 0.00 O ATOM 507 OD2 ASP A 32 -7.114 2.568 -7.921 1.00 0.00 O ATOM 0 H ASP A 32 -7.674 -2.091 -8.235 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.629 -0.473 -5.787 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -5.938 -0.282 -7.712 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -7.235 0.268 -8.754 1.00 0.00 H new ATOM 512 N VAL A 33 -10.097 -0.180 -7.879 1.00 0.00 N ATOM 513 CA VAL A 33 -11.411 0.508 -7.975 1.00 0.00 C ATOM 514 C VAL A 33 -12.359 -0.037 -6.925 1.00 0.00 C ATOM 515 O VAL A 33 -13.283 0.636 -6.509 1.00 0.00 O ATOM 516 CB VAL A 33 -12.008 0.290 -9.377 1.00 0.00 C ATOM 517 CG1 VAL A 33 -13.332 1.051 -9.488 1.00 0.00 C ATOM 518 CG2 VAL A 33 -11.036 0.845 -10.423 1.00 0.00 C ATOM 0 H VAL A 33 -9.926 -0.922 -8.557 1.00 0.00 H new ATOM 0 HA VAL A 33 -11.268 1.575 -7.805 1.00 0.00 H new ATOM 0 HB VAL A 33 -12.176 -0.774 -9.542 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -13.757 0.899 -10.480 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -14.028 0.682 -8.734 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -13.155 2.115 -9.329 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -11.450 0.695 -11.420 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -10.884 1.910 -10.249 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -10.081 0.325 -10.345 1.00 0.00 H new ATOM 528 N LEU A 34 -12.113 -1.249 -6.503 1.00 0.00 N ATOM 529 CA LEU A 34 -12.994 -1.840 -5.480 1.00 0.00 C ATOM 530 C LEU A 34 -12.573 -1.374 -4.105 1.00 0.00 C ATOM 531 O LEU A 34 -13.379 -0.904 -3.327 1.00 0.00 O ATOM 532 CB LEU A 34 -12.856 -3.363 -5.528 1.00 0.00 C ATOM 533 CG LEU A 34 -13.986 -3.949 -6.370 1.00 0.00 C ATOM 534 CD1 LEU A 34 -13.601 -5.359 -6.836 1.00 0.00 C ATOM 535 CD2 LEU A 34 -15.254 -4.025 -5.519 1.00 0.00 C ATOM 0 H LEU A 34 -11.347 -1.842 -6.824 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.022 -1.536 -5.676 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -11.891 -3.638 -5.953 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -12.889 -3.774 -4.519 1.00 0.00 H new ATOM 0 HG LEU A 34 -14.161 -3.316 -7.240 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -14.409 -5.777 -7.437 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -12.692 -5.309 -7.435 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -13.429 -5.995 -5.968 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -16.067 -4.443 -6.113 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -15.073 -4.662 -4.653 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -15.527 -3.025 -5.183 1.00 0.00 H new ATOM 547 N ALA A 35 -11.306 -1.509 -3.829 1.00 0.00 N ATOM 548 CA ALA A 35 -10.804 -1.083 -2.509 1.00 0.00 C ATOM 549 C ALA A 35 -11.196 0.362 -2.217 1.00 0.00 C ATOM 550 O ALA A 35 -11.998 0.628 -1.344 1.00 0.00 O ATOM 551 CB ALA A 35 -9.268 -1.192 -2.512 1.00 0.00 C ATOM 0 H ALA A 35 -10.605 -1.895 -4.462 1.00 0.00 H new ATOM 0 HA ALA A 35 -11.240 -1.723 -1.741 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -8.879 -0.880 -1.542 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -8.977 -2.225 -2.705 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -8.859 -0.548 -3.291 1.00 0.00 H new ATOM 557 N LYS A 36 -10.623 1.267 -2.956 1.00 0.00 N ATOM 558 CA LYS A 36 -10.944 2.706 -2.743 1.00 0.00 C ATOM 559 C LYS A 36 -12.441 2.924 -2.546 1.00 0.00 C ATOM 560 O LYS A 36 -12.852 3.683 -1.691 1.00 0.00 O ATOM 561 CB LYS A 36 -10.500 3.488 -3.986 1.00 0.00 C ATOM 562 CG LYS A 36 -10.980 4.938 -3.865 1.00 0.00 C ATOM 563 CD LYS A 36 -10.122 5.832 -4.767 1.00 0.00 C ATOM 564 CE LYS A 36 -10.477 7.301 -4.511 1.00 0.00 C ATOM 565 NZ LYS A 36 -9.600 8.196 -5.321 1.00 0.00 N ATOM 0 H LYS A 36 -9.948 1.075 -3.696 1.00 0.00 H new ATOM 0 HA LYS A 36 -10.426 3.047 -1.847 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -9.415 3.458 -4.081 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -10.911 3.030 -4.885 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -12.029 5.011 -4.153 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -10.909 5.271 -2.830 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -9.064 5.662 -4.567 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -10.293 5.582 -5.814 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -11.522 7.479 -4.764 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -10.362 7.530 -3.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -9.852 9.188 -5.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -8.606 8.037 -5.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -9.730 7.987 -6.332 1.00 0.00 H new ATOM 579 N GLU A 37 -13.226 2.261 -3.341 1.00 0.00 N ATOM 580 CA GLU A 37 -14.697 2.420 -3.213 1.00 0.00 C ATOM 581 C GLU A 37 -15.200 1.869 -1.878 1.00 0.00 C ATOM 582 O GLU A 37 -16.108 2.416 -1.280 1.00 0.00 O ATOM 583 CB GLU A 37 -15.365 1.640 -4.357 1.00 0.00 C ATOM 584 CG GLU A 37 -16.852 1.994 -4.411 1.00 0.00 C ATOM 585 CD GLU A 37 -17.492 1.297 -5.614 1.00 0.00 C ATOM 586 OE1 GLU A 37 -17.213 0.119 -5.768 1.00 0.00 O ATOM 587 OE2 GLU A 37 -18.223 1.980 -6.312 1.00 0.00 O ATOM 0 H GLU A 37 -12.916 1.619 -4.070 1.00 0.00 H new ATOM 0 HA GLU A 37 -14.944 3.481 -3.259 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -14.887 1.883 -5.306 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -15.240 0.568 -4.203 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -17.346 1.683 -3.490 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -16.978 3.074 -4.491 1.00 0.00 H new ATOM 594 N SER A 38 -14.600 0.800 -1.437 1.00 0.00 N ATOM 595 CA SER A 38 -15.028 0.197 -0.145 1.00 0.00 C ATOM 596 C SER A 38 -13.844 -0.370 0.601 1.00 0.00 C ATOM 597 O SER A 38 -13.326 -1.408 0.249 1.00 0.00 O ATOM 598 CB SER A 38 -16.009 -0.946 -0.447 1.00 0.00 C ATOM 599 OG SER A 38 -15.953 -1.764 0.714 1.00 0.00 O ATOM 0 H SER A 38 -13.836 0.320 -1.912 1.00 0.00 H new ATOM 0 HA SER A 38 -15.495 0.967 0.470 1.00 0.00 H new ATOM 0 HB2 SER A 38 -17.017 -0.571 -0.622 1.00 0.00 H new ATOM 0 HB3 SER A 38 -15.715 -1.499 -1.339 1.00 0.00 H new ATOM 0 HG SER A 38 -15.158 -2.335 0.674 1.00 0.00 H new ATOM 605 N GLU A 39 -13.431 0.324 1.615 1.00 0.00 N ATOM 606 CA GLU A 39 -12.282 -0.161 2.399 1.00 0.00 C ATOM 607 C GLU A 39 -12.762 -1.042 3.540 1.00 0.00 C ATOM 608 O GLU A 39 -12.179 -2.070 3.819 1.00 0.00 O ATOM 609 CB GLU A 39 -11.540 1.054 2.980 1.00 0.00 C ATOM 610 CG GLU A 39 -11.269 2.056 1.860 1.00 0.00 C ATOM 611 CD GLU A 39 -10.392 3.191 2.395 1.00 0.00 C ATOM 612 OE1 GLU A 39 -9.696 2.928 3.361 1.00 0.00 O ATOM 613 OE2 GLU A 39 -10.467 4.257 1.805 1.00 0.00 O ATOM 0 H GLU A 39 -13.840 1.203 1.932 1.00 0.00 H new ATOM 0 HA GLU A 39 -11.621 -0.742 1.756 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -12.137 1.519 3.765 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -10.602 0.739 3.437 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -10.773 1.560 1.026 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -12.209 2.456 1.480 1.00 0.00 H new ATOM 620 N HIS A 40 -13.829 -0.625 4.178 1.00 0.00 N ATOM 621 CA HIS A 40 -14.366 -1.434 5.311 1.00 0.00 C ATOM 622 C HIS A 40 -15.506 -2.358 4.863 1.00 0.00 C ATOM 623 O HIS A 40 -15.729 -3.397 5.457 1.00 0.00 O ATOM 624 CB HIS A 40 -14.900 -0.492 6.412 1.00 0.00 C ATOM 625 CG HIS A 40 -13.948 0.693 6.587 1.00 0.00 C ATOM 626 ND1 HIS A 40 -13.297 1.230 5.669 1.00 0.00 N ATOM 627 CD2 HIS A 40 -13.618 1.397 7.731 1.00 0.00 C ATOM 628 CE1 HIS A 40 -12.589 2.193 6.101 1.00 0.00 C ATOM 629 NE2 HIS A 40 -12.729 2.376 7.412 1.00 0.00 N ATOM 0 H HIS A 40 -14.344 0.229 3.965 1.00 0.00 H new ATOM 0 HA HIS A 40 -13.550 -2.050 5.690 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -15.895 -0.135 6.147 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -14.997 -1.035 7.352 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -14.005 1.201 8.720 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -11.947 2.795 5.475 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -12.287 3.068 8.017 1.00 0.00 H new ATOM 637 N PRO A 41 -16.237 -1.943 3.835 1.00 0.00 N ATOM 638 CA PRO A 41 -17.354 -2.741 3.313 1.00 0.00 C ATOM 639 C PRO A 41 -17.018 -3.699 2.101 1.00 0.00 C ATOM 640 O PRO A 41 -17.932 -4.125 1.423 1.00 0.00 O ATOM 641 CB PRO A 41 -18.330 -1.666 2.788 1.00 0.00 C ATOM 642 CG PRO A 41 -17.500 -0.353 2.602 1.00 0.00 C ATOM 643 CD PRO A 41 -16.129 -0.594 3.257 1.00 0.00 C ATOM 0 HA PRO A 41 -17.711 -3.405 4.100 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -18.777 -1.978 1.844 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -19.148 -1.510 3.492 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -17.386 -0.115 1.544 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -18.006 0.493 3.067 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -15.323 -0.538 2.526 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -15.917 0.152 4.023 1.00 0.00 H new ATOM 651 N PRO A 42 -15.743 -4.041 1.836 1.00 0.00 N ATOM 652 CA PRO A 42 -15.447 -4.928 0.708 1.00 0.00 C ATOM 653 C PRO A 42 -15.962 -6.343 0.953 1.00 0.00 C ATOM 654 O PRO A 42 -15.954 -6.827 2.068 1.00 0.00 O ATOM 655 CB PRO A 42 -13.914 -4.964 0.611 1.00 0.00 C ATOM 656 CG PRO A 42 -13.356 -4.149 1.813 1.00 0.00 C ATOM 657 CD PRO A 42 -14.563 -3.609 2.600 1.00 0.00 C ATOM 0 HA PRO A 42 -15.927 -4.566 -0.201 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -13.551 -5.991 0.641 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -13.578 -4.535 -0.333 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -12.734 -4.779 2.449 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -12.728 -3.330 1.463 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -14.583 -4.008 3.614 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -14.524 -2.523 2.685 1.00 0.00 H new ATOM 665 N GLN A 43 -16.397 -6.979 -0.096 1.00 0.00 N ATOM 666 CA GLN A 43 -16.912 -8.359 0.050 1.00 0.00 C ATOM 667 C GLN A 43 -15.801 -9.364 -0.217 1.00 0.00 C ATOM 668 O GLN A 43 -15.809 -10.461 0.300 1.00 0.00 O ATOM 669 CB GLN A 43 -18.013 -8.558 -0.991 1.00 0.00 C ATOM 670 CG GLN A 43 -17.724 -7.642 -2.183 1.00 0.00 C ATOM 671 CD GLN A 43 -18.493 -8.141 -3.414 1.00 0.00 C ATOM 672 OE1 GLN A 43 -18.999 -9.245 -3.436 1.00 0.00 O ATOM 673 NE2 GLN A 43 -18.601 -7.361 -4.456 1.00 0.00 N ATOM 0 H GLN A 43 -16.417 -6.602 -1.043 1.00 0.00 H new ATOM 0 HA GLN A 43 -17.290 -8.509 1.061 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -18.047 -9.599 -1.312 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -18.987 -8.325 -0.561 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -18.018 -6.619 -1.948 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -16.654 -7.626 -2.392 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -18.178 -6.433 -4.444 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -19.108 -7.680 -5.282 1.00 0.00 H new ATOM 682 N SER A 44 -14.859 -8.952 -1.024 1.00 0.00 N ATOM 683 CA SER A 44 -13.716 -9.835 -1.370 1.00 0.00 C ATOM 684 C SER A 44 -13.022 -9.294 -2.611 1.00 0.00 C ATOM 685 O SER A 44 -13.049 -9.893 -3.664 1.00 0.00 O ATOM 686 CB SER A 44 -14.254 -11.258 -1.649 1.00 0.00 C ATOM 687 OG SER A 44 -14.046 -11.951 -0.428 1.00 0.00 O ATOM 0 H SER A 44 -14.836 -8.031 -1.461 1.00 0.00 H new ATOM 0 HA SER A 44 -13.003 -9.867 -0.547 1.00 0.00 H new ATOM 0 HB2 SER A 44 -15.309 -11.239 -1.922 1.00 0.00 H new ATOM 0 HB3 SER A 44 -13.720 -11.732 -2.473 1.00 0.00 H new ATOM 0 HG SER A 44 -14.386 -11.412 0.316 1.00 0.00 H new ATOM 693 N ILE A 45 -12.419 -8.152 -2.460 1.00 0.00 N ATOM 694 CA ILE A 45 -11.719 -7.545 -3.608 1.00 0.00 C ATOM 695 C ILE A 45 -10.674 -8.479 -4.168 1.00 0.00 C ATOM 696 O ILE A 45 -10.563 -8.640 -5.363 1.00 0.00 O ATOM 697 CB ILE A 45 -11.000 -6.282 -3.143 1.00 0.00 C ATOM 698 CG1 ILE A 45 -11.952 -5.288 -2.432 1.00 0.00 C ATOM 699 CG2 ILE A 45 -10.404 -5.608 -4.384 1.00 0.00 C ATOM 700 CD1 ILE A 45 -13.428 -5.551 -2.790 1.00 0.00 C ATOM 0 H ILE A 45 -12.383 -7.618 -1.592 1.00 0.00 H new ATOM 0 HA ILE A 45 -12.462 -7.327 -4.375 1.00 0.00 H new ATOM 0 HB ILE A 45 -10.232 -6.561 -2.421 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -11.820 -5.368 -1.353 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -11.687 -4.268 -2.711 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -9.881 -4.699 -4.088 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -9.703 -6.289 -4.867 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -11.204 -5.356 -5.081 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -14.062 -4.832 -2.271 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -13.566 -5.445 -3.866 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -13.701 -6.562 -2.487 1.00 0.00 H new ATOM 712 N LEU A 46 -9.919 -9.077 -3.306 1.00 0.00 N ATOM 713 CA LEU A 46 -8.880 -10.000 -3.797 1.00 0.00 C ATOM 714 C LEU A 46 -9.509 -11.167 -4.527 1.00 0.00 C ATOM 715 O LEU A 46 -9.123 -11.497 -5.622 1.00 0.00 O ATOM 716 CB LEU A 46 -8.086 -10.530 -2.598 1.00 0.00 C ATOM 717 CG LEU A 46 -6.595 -10.343 -2.870 1.00 0.00 C ATOM 718 CD1 LEU A 46 -5.793 -11.087 -1.803 1.00 0.00 C ATOM 719 CD2 LEU A 46 -6.260 -10.919 -4.249 1.00 0.00 C ATOM 0 H LEU A 46 -9.975 -8.968 -2.293 1.00 0.00 H new ATOM 0 HA LEU A 46 -8.225 -9.466 -4.485 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -8.373 -9.998 -1.691 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -8.310 -11.584 -2.434 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.344 -9.283 -2.844 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.727 -10.957 -1.992 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -6.038 -10.687 -0.819 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -6.040 -12.148 -1.836 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -5.197 -10.789 -4.449 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.505 -11.981 -4.269 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.839 -10.398 -5.011 1.00 0.00 H new ATOM 731 N HIS A 47 -10.480 -11.760 -3.908 1.00 0.00 N ATOM 732 CA HIS A 47 -11.153 -12.911 -4.543 1.00 0.00 C ATOM 733 C HIS A 47 -12.110 -12.467 -5.644 1.00 0.00 C ATOM 734 O HIS A 47 -12.559 -13.274 -6.432 1.00 0.00 O ATOM 735 CB HIS A 47 -11.953 -13.644 -3.453 1.00 0.00 C ATOM 736 CG HIS A 47 -11.604 -15.133 -3.473 1.00 0.00 C ATOM 737 ND1 HIS A 47 -10.937 -15.699 -4.363 1.00 0.00 N ATOM 738 CD2 HIS A 47 -11.927 -16.127 -2.567 1.00 0.00 C ATOM 739 CE1 HIS A 47 -10.800 -16.938 -4.125 1.00 0.00 C ATOM 740 NE2 HIS A 47 -11.401 -17.307 -2.994 1.00 0.00 N ATOM 0 H HIS A 47 -10.836 -11.497 -2.989 1.00 0.00 H new ATOM 0 HA HIS A 47 -10.401 -13.557 -4.996 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -11.726 -13.220 -2.475 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -13.022 -13.509 -3.619 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -12.504 -15.989 -1.665 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -10.258 -17.617 -4.766 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -11.453 -18.230 -2.563 1.00 0.00 H new ATOM 748 N THR A 48 -12.403 -11.195 -5.686 1.00 0.00 N ATOM 749 CA THR A 48 -13.332 -10.699 -6.738 1.00 0.00 C ATOM 750 C THR A 48 -12.564 -10.177 -7.933 1.00 0.00 C ATOM 751 O THR A 48 -13.046 -10.216 -9.048 1.00 0.00 O ATOM 752 CB THR A 48 -14.168 -9.553 -6.156 1.00 0.00 C ATOM 753 OG1 THR A 48 -15.017 -10.155 -5.201 1.00 0.00 O ATOM 754 CG2 THR A 48 -15.118 -8.979 -7.216 1.00 0.00 C ATOM 0 H THR A 48 -12.044 -10.487 -5.046 1.00 0.00 H new ATOM 0 HA THR A 48 -13.969 -11.523 -7.060 1.00 0.00 H new ATOM 0 HB THR A 48 -13.510 -8.773 -5.772 1.00 0.00 H new ATOM 0 HG1 THR A 48 -14.565 -10.181 -4.332 1.00 0.00 H new ATOM 0 HG21 THR A 48 -15.701 -8.167 -6.781 1.00 0.00 H new ATOM 0 HG22 THR A 48 -14.538 -8.599 -8.057 1.00 0.00 H new ATOM 0 HG23 THR A 48 -15.791 -9.763 -7.564 1.00 0.00 H new ATOM 762 N ALA A 49 -11.383 -9.704 -7.689 1.00 0.00 N ATOM 763 CA ALA A 49 -10.579 -9.179 -8.803 1.00 0.00 C ATOM 764 C ALA A 49 -9.811 -10.307 -9.482 1.00 0.00 C ATOM 765 O ALA A 49 -9.542 -10.248 -10.666 1.00 0.00 O ATOM 766 CB ALA A 49 -9.589 -8.145 -8.245 1.00 0.00 C ATOM 0 H ALA A 49 -10.945 -9.660 -6.769 1.00 0.00 H new ATOM 0 HA ALA A 49 -11.236 -8.716 -9.540 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -8.984 -7.745 -9.058 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -10.140 -7.334 -7.769 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -8.940 -8.622 -7.511 1.00 0.00 H new ATOM 772 N LYS A 50 -9.465 -11.319 -8.723 1.00 0.00 N ATOM 773 CA LYS A 50 -8.713 -12.452 -9.334 1.00 0.00 C ATOM 774 C LYS A 50 -9.584 -13.237 -10.299 1.00 0.00 C ATOM 775 O LYS A 50 -9.098 -13.773 -11.273 1.00 0.00 O ATOM 776 CB LYS A 50 -8.263 -13.418 -8.228 1.00 0.00 C ATOM 777 CG LYS A 50 -6.779 -13.755 -8.420 1.00 0.00 C ATOM 778 CD LYS A 50 -6.351 -14.756 -7.345 1.00 0.00 C ATOM 779 CE LYS A 50 -5.086 -15.489 -7.805 1.00 0.00 C ATOM 780 NZ LYS A 50 -5.234 -15.960 -9.210 1.00 0.00 N ATOM 0 H LYS A 50 -9.667 -11.407 -7.727 1.00 0.00 H new ATOM 0 HA LYS A 50 -7.861 -12.033 -9.870 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -8.421 -12.966 -7.249 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -8.861 -14.329 -8.259 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -6.614 -14.175 -9.412 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -6.176 -12.850 -8.353 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -6.163 -14.238 -6.405 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -7.152 -15.472 -7.160 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -4.226 -14.824 -7.727 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -4.893 -16.338 -7.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -4.702 -16.845 -9.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -6.240 -16.128 -9.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -4.864 -15.237 -9.859 1.00 0.00 H new ATOM 794 N ALA A 51 -10.859 -13.299 -10.017 1.00 0.00 N ATOM 795 CA ALA A 51 -11.747 -14.057 -10.923 1.00 0.00 C ATOM 796 C ALA A 51 -12.304 -13.188 -12.056 1.00 0.00 C ATOM 797 O ALA A 51 -12.353 -13.611 -13.189 1.00 0.00 O ATOM 798 CB ALA A 51 -12.924 -14.603 -10.101 1.00 0.00 C ATOM 0 H ALA A 51 -11.310 -12.864 -9.212 1.00 0.00 H new ATOM 0 HA ALA A 51 -11.162 -14.858 -11.375 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -13.592 -15.166 -10.752 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -12.546 -15.257 -9.315 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -13.470 -13.773 -9.652 1.00 0.00 H new ATOM 804 N ILE A 52 -12.710 -11.995 -11.726 1.00 0.00 N ATOM 805 CA ILE A 52 -13.270 -11.088 -12.772 1.00 0.00 C ATOM 806 C ILE A 52 -12.303 -10.865 -13.940 1.00 0.00 C ATOM 807 O ILE A 52 -12.613 -11.167 -15.066 1.00 0.00 O ATOM 808 CB ILE A 52 -13.555 -9.735 -12.117 1.00 0.00 C ATOM 809 CG1 ILE A 52 -14.884 -9.796 -11.380 1.00 0.00 C ATOM 810 CG2 ILE A 52 -13.652 -8.659 -13.218 1.00 0.00 C ATOM 811 CD1 ILE A 52 -15.017 -8.566 -10.484 1.00 0.00 C ATOM 0 H ILE A 52 -12.680 -11.608 -10.783 1.00 0.00 H new ATOM 0 HA ILE A 52 -14.170 -11.552 -13.175 1.00 0.00 H new ATOM 0 HB ILE A 52 -12.755 -9.493 -11.417 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -15.708 -9.832 -12.093 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -14.940 -10.705 -10.781 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -13.855 -7.690 -12.763 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -12.711 -8.613 -13.765 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -14.459 -8.913 -13.905 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -15.968 -8.604 -9.953 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -14.199 -8.551 -9.763 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -14.979 -7.665 -11.096 1.00 0.00 H new ATOM 823 N GLU A 53 -11.164 -10.326 -13.645 1.00 0.00 N ATOM 824 CA GLU A 53 -10.153 -10.066 -14.720 1.00 0.00 C ATOM 825 C GLU A 53 -10.111 -11.162 -15.803 1.00 0.00 C ATOM 826 O GLU A 53 -10.530 -10.949 -16.924 1.00 0.00 O ATOM 827 CB GLU A 53 -8.768 -10.007 -14.058 1.00 0.00 C ATOM 828 CG GLU A 53 -7.696 -9.891 -15.147 1.00 0.00 C ATOM 829 CD GLU A 53 -7.088 -11.272 -15.413 1.00 0.00 C ATOM 830 OE1 GLU A 53 -6.836 -11.952 -14.432 1.00 0.00 O ATOM 831 OE2 GLU A 53 -6.909 -11.568 -16.584 1.00 0.00 O ATOM 0 H GLU A 53 -10.878 -10.049 -12.706 1.00 0.00 H new ATOM 0 HA GLU A 53 -10.433 -9.134 -15.211 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -8.711 -9.154 -13.382 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -8.599 -10.901 -13.458 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -8.133 -9.492 -16.062 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -6.919 -9.194 -14.835 1.00 0.00 H new ATOM 838 N SER A 54 -9.608 -12.303 -15.436 1.00 0.00 N ATOM 839 CA SER A 54 -9.510 -13.441 -16.408 1.00 0.00 C ATOM 840 C SER A 54 -10.773 -13.651 -17.264 1.00 0.00 C ATOM 841 O SER A 54 -10.734 -14.402 -18.218 1.00 0.00 O ATOM 842 CB SER A 54 -9.255 -14.725 -15.604 1.00 0.00 C ATOM 843 OG SER A 54 -10.459 -14.927 -14.877 1.00 0.00 O ATOM 0 H SER A 54 -9.256 -12.505 -14.500 1.00 0.00 H new ATOM 0 HA SER A 54 -8.702 -13.201 -17.099 1.00 0.00 H new ATOM 0 HB2 SER A 54 -9.039 -15.569 -16.259 1.00 0.00 H new ATOM 0 HB3 SER A 54 -8.401 -14.614 -14.936 1.00 0.00 H new ATOM 0 HG SER A 54 -10.672 -14.119 -14.365 1.00 0.00 H new ATOM 849 N GLU A 55 -11.856 -12.995 -16.928 1.00 0.00 N ATOM 850 CA GLU A 55 -13.103 -13.187 -17.747 1.00 0.00 C ATOM 851 C GLU A 55 -13.291 -12.116 -18.812 1.00 0.00 C ATOM 852 O GLU A 55 -13.196 -12.394 -19.986 1.00 0.00 O ATOM 853 CB GLU A 55 -14.319 -13.164 -16.808 1.00 0.00 C ATOM 854 CG GLU A 55 -14.265 -14.381 -15.883 1.00 0.00 C ATOM 855 CD GLU A 55 -15.631 -14.574 -15.223 1.00 0.00 C ATOM 856 OE1 GLU A 55 -16.467 -15.180 -15.874 1.00 0.00 O ATOM 857 OE2 GLU A 55 -15.764 -14.101 -14.105 1.00 0.00 O ATOM 0 H GLU A 55 -11.936 -12.349 -16.143 1.00 0.00 H new ATOM 0 HA GLU A 55 -13.006 -14.143 -18.262 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -14.322 -12.246 -16.220 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -15.242 -13.174 -17.388 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -13.993 -15.271 -16.450 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -13.497 -14.240 -15.122 1.00 0.00 H new ATOM 864 N MET A 56 -13.578 -10.925 -18.396 1.00 0.00 N ATOM 865 CA MET A 56 -13.776 -9.844 -19.392 1.00 0.00 C ATOM 866 C MET A 56 -12.558 -9.683 -20.292 1.00 0.00 C ATOM 867 O MET A 56 -12.616 -9.002 -21.284 1.00 0.00 O ATOM 868 CB MET A 56 -14.008 -8.529 -18.637 1.00 0.00 C ATOM 869 CG MET A 56 -13.227 -8.564 -17.325 1.00 0.00 C ATOM 870 SD MET A 56 -12.984 -6.993 -16.464 1.00 0.00 S ATOM 871 CE MET A 56 -11.702 -6.340 -17.558 1.00 0.00 C ATOM 0 H MET A 56 -13.684 -10.651 -17.419 1.00 0.00 H new ATOM 0 HA MET A 56 -14.631 -10.100 -20.018 1.00 0.00 H new ATOM 0 HB2 MET A 56 -13.685 -7.684 -19.245 1.00 0.00 H new ATOM 0 HB3 MET A 56 -15.071 -8.391 -18.439 1.00 0.00 H new ATOM 0 HG2 MET A 56 -13.739 -9.246 -16.646 1.00 0.00 H new ATOM 0 HG3 MET A 56 -12.246 -8.993 -17.528 1.00 0.00 H new ATOM 0 HE1 MET A 56 -11.127 -5.579 -17.031 1.00 0.00 H new ATOM 0 HE2 MET A 56 -11.039 -7.149 -17.865 1.00 0.00 H new ATOM 0 HE3 MET A 56 -12.166 -5.898 -18.439 1.00 0.00 H new ATOM 881 N ASN A 57 -11.488 -10.339 -19.947 1.00 0.00 N ATOM 882 CA ASN A 57 -10.257 -10.220 -20.784 1.00 0.00 C ATOM 883 C ASN A 57 -10.180 -11.315 -21.846 1.00 0.00 C ATOM 884 O ASN A 57 -9.292 -11.305 -22.673 1.00 0.00 O ATOM 885 CB ASN A 57 -9.031 -10.318 -19.872 1.00 0.00 C ATOM 886 CG ASN A 57 -8.770 -11.786 -19.529 1.00 0.00 C ATOM 887 OD1 ASN A 57 -9.638 -12.628 -19.651 1.00 0.00 O ATOM 888 ND2 ASN A 57 -7.590 -12.137 -19.097 1.00 0.00 N ATOM 0 H ASN A 57 -11.409 -10.947 -19.132 1.00 0.00 H new ATOM 0 HA ASN A 57 -10.287 -9.259 -21.298 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -8.160 -9.888 -20.367 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -9.195 -9.744 -18.960 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -7.401 -13.112 -18.864 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -6.856 -11.436 -18.992 1.00 0.00 H new ATOM 895 N LYS A 58 -11.105 -12.243 -21.786 1.00 0.00 N ATOM 896 CA LYS A 58 -11.119 -13.363 -22.782 1.00 0.00 C ATOM 897 C LYS A 58 -10.583 -12.928 -24.156 1.00 0.00 C ATOM 898 O LYS A 58 -9.547 -13.394 -24.588 1.00 0.00 O ATOM 899 CB LYS A 58 -12.579 -13.815 -22.952 1.00 0.00 C ATOM 900 CG LYS A 58 -12.617 -15.299 -23.325 1.00 0.00 C ATOM 901 CD LYS A 58 -14.022 -15.648 -23.829 1.00 0.00 C ATOM 902 CE LYS A 58 -14.450 -17.001 -23.252 1.00 0.00 C ATOM 903 NZ LYS A 58 -14.778 -16.872 -21.805 1.00 0.00 N ATOM 0 H LYS A 58 -11.851 -12.274 -21.091 1.00 0.00 H new ATOM 0 HA LYS A 58 -10.477 -14.163 -22.413 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -13.132 -13.648 -22.028 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -13.066 -13.222 -23.726 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -11.876 -15.513 -24.095 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -12.364 -15.912 -22.460 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -14.729 -14.874 -23.532 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -14.030 -15.686 -24.918 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -15.317 -17.376 -23.795 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -13.650 -17.729 -23.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -15.344 -17.691 -21.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -13.898 -16.836 -21.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -15.321 -15.999 -21.649 1.00 0.00 H new ATOM 917 N VAL A 59 -11.291 -12.049 -24.820 1.00 0.00 N ATOM 918 CA VAL A 59 -10.812 -11.596 -26.155 1.00 0.00 C ATOM 919 C VAL A 59 -11.349 -10.208 -26.502 1.00 0.00 C ATOM 920 O VAL A 59 -12.542 -9.979 -26.482 1.00 0.00 O ATOM 921 CB VAL A 59 -11.313 -12.594 -27.205 1.00 0.00 C ATOM 922 CG1 VAL A 59 -10.122 -13.374 -27.768 1.00 0.00 C ATOM 923 CG2 VAL A 59 -12.293 -13.572 -26.554 1.00 0.00 C ATOM 0 H VAL A 59 -12.165 -11.633 -24.500 1.00 0.00 H new ATOM 0 HA VAL A 59 -9.723 -11.545 -26.138 1.00 0.00 H new ATOM 0 HB VAL A 59 -11.815 -12.056 -28.009 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -10.473 -14.085 -28.515 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -9.418 -12.681 -28.229 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -9.625 -13.912 -26.961 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -12.649 -14.282 -27.301 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -11.790 -14.112 -25.752 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -13.140 -13.021 -26.145 1.00 0.00 H new ATOM 933 N ASN A 60 -10.454 -9.300 -26.815 1.00 0.00 N ATOM 934 CA ASN A 60 -10.903 -7.928 -27.165 1.00 0.00 C ATOM 935 C ASN A 60 -9.930 -7.251 -28.144 1.00 0.00 C ATOM 936 O ASN A 60 -9.082 -7.896 -28.729 1.00 0.00 O ATOM 937 CB ASN A 60 -10.984 -7.100 -25.872 1.00 0.00 C ATOM 938 CG ASN A 60 -12.173 -7.585 -25.039 1.00 0.00 C ATOM 939 OD1 ASN A 60 -12.022 -8.623 -24.260 1.00 0.00 O flip ATOM 940 ND2 ASN A 60 -13.252 -7.031 -25.095 1.00 0.00 N flip ATOM 0 H ASN A 60 -9.446 -9.453 -26.841 1.00 0.00 H new ATOM 0 HA ASN A 60 -11.877 -7.989 -27.650 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -10.060 -7.201 -25.303 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -11.098 -6.042 -26.110 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -13.378 -6.220 -25.701 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -14.032 -7.377 -24.536 1.00 0.00 H new ATOM 947 N ASN A 61 -10.081 -5.958 -28.297 1.00 0.00 N ATOM 948 CA ASN A 61 -9.186 -5.200 -29.226 1.00 0.00 C ATOM 949 C ASN A 61 -7.886 -4.801 -28.540 1.00 0.00 C ATOM 950 O ASN A 61 -7.008 -4.253 -29.158 1.00 0.00 O ATOM 951 CB ASN A 61 -9.920 -3.929 -29.672 1.00 0.00 C ATOM 952 CG ASN A 61 -11.285 -4.313 -30.244 1.00 0.00 C ATOM 953 OD1 ASN A 61 -12.211 -4.746 -29.433 1.00 0.00 O flip ATOM 954 ND2 ASN A 61 -11.520 -4.225 -31.433 1.00 0.00 N flip ATOM 0 H ASN A 61 -10.785 -5.395 -27.819 1.00 0.00 H new ATOM 0 HA ASN A 61 -8.943 -5.836 -30.077 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -10.044 -3.251 -28.828 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -9.333 -3.400 -30.423 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -10.800 -3.887 -32.072 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -12.437 -4.489 -31.792 1.00 0.00 H new ATOM 961 N CYS A 62 -7.825 -5.048 -27.261 1.00 0.00 N ATOM 962 CA CYS A 62 -6.602 -4.704 -26.464 1.00 0.00 C ATOM 963 C CYS A 62 -5.285 -5.034 -27.192 1.00 0.00 C ATOM 964 O CYS A 62 -4.224 -4.656 -26.738 1.00 0.00 O ATOM 965 CB CYS A 62 -6.648 -5.530 -25.174 1.00 0.00 C ATOM 966 SG CYS A 62 -7.561 -7.091 -25.232 1.00 0.00 S ATOM 0 H CYS A 62 -8.577 -5.479 -26.723 1.00 0.00 H new ATOM 0 HA CYS A 62 -6.612 -3.629 -26.286 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -5.623 -5.748 -24.874 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -7.085 -4.911 -24.390 1.00 0.00 H new ATOM 0 HG CYS A 62 -6.913 -7.998 -24.564 1.00 0.00 H new ATOM 972 N ASP A 63 -5.368 -5.717 -28.297 1.00 0.00 N ATOM 973 CA ASP A 63 -4.116 -6.058 -29.032 1.00 0.00 C ATOM 974 C ASP A 63 -3.719 -4.951 -30.013 1.00 0.00 C ATOM 975 O ASP A 63 -2.709 -5.048 -30.681 1.00 0.00 O ATOM 976 CB ASP A 63 -4.370 -7.346 -29.828 1.00 0.00 C ATOM 977 CG ASP A 63 -3.041 -7.891 -30.353 1.00 0.00 C ATOM 978 OD1 ASP A 63 -2.392 -8.573 -29.577 1.00 0.00 O ATOM 979 OD2 ASP A 63 -2.751 -7.598 -31.501 1.00 0.00 O ATOM 0 H ASP A 63 -6.234 -6.051 -28.720 1.00 0.00 H new ATOM 0 HA ASP A 63 -3.308 -6.180 -28.310 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -4.855 -8.088 -29.194 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -5.047 -7.145 -30.659 1.00 0.00 H new ATOM 984 N THR A 64 -4.517 -3.925 -30.078 1.00 0.00 N ATOM 985 CA THR A 64 -4.199 -2.810 -31.005 1.00 0.00 C ATOM 986 C THR A 64 -4.763 -1.499 -30.480 1.00 0.00 C ATOM 987 O THR A 64 -4.044 -0.530 -30.322 1.00 0.00 O ATOM 988 CB THR A 64 -4.830 -3.111 -32.364 1.00 0.00 C ATOM 989 OG1 THR A 64 -6.006 -3.842 -32.077 1.00 0.00 O ATOM 990 CG2 THR A 64 -3.953 -4.082 -33.165 1.00 0.00 C ATOM 0 H THR A 64 -5.371 -3.811 -29.532 1.00 0.00 H new ATOM 0 HA THR A 64 -3.117 -2.717 -31.092 1.00 0.00 H new ATOM 0 HB THR A 64 -4.979 -2.184 -32.918 1.00 0.00 H new ATOM 0 HG1 THR A 64 -6.464 -4.067 -32.914 1.00 0.00 H new ATOM 0 HG21 THR A 64 -4.420 -4.283 -34.129 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.970 -3.638 -33.323 1.00 0.00 H new ATOM 0 HG23 THR A 64 -3.845 -5.015 -32.612 1.00 0.00 H new ATOM 998 N ASN A 65 -6.049 -1.499 -30.223 1.00 0.00 N ATOM 999 CA ASN A 65 -6.711 -0.275 -29.705 1.00 0.00 C ATOM 1000 C ASN A 65 -7.450 -0.586 -28.415 1.00 0.00 C ATOM 1001 O ASN A 65 -8.651 -0.770 -28.406 1.00 0.00 O ATOM 1002 CB ASN A 65 -7.721 0.212 -30.753 1.00 0.00 C ATOM 1003 CG ASN A 65 -7.017 1.154 -31.733 1.00 0.00 C ATOM 1004 OD1 ASN A 65 -5.718 1.281 -31.666 1.00 0.00 O flip ATOM 1005 ND2 ASN A 65 -7.640 1.779 -32.567 1.00 0.00 N flip ATOM 0 H ASN A 65 -6.666 -2.301 -30.353 1.00 0.00 H new ATOM 0 HA ASN A 65 -5.960 0.490 -29.509 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -8.146 -0.637 -31.288 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -8.548 0.728 -30.266 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -8.654 1.684 -32.624 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -7.149 2.399 -33.211 1.00 0.00 H new ATOM 1012 N GLU A 66 -6.711 -0.640 -27.349 1.00 0.00 N ATOM 1013 CA GLU A 66 -7.331 -0.938 -26.035 1.00 0.00 C ATOM 1014 C GLU A 66 -8.289 0.160 -25.645 1.00 0.00 C ATOM 1015 O GLU A 66 -9.030 0.038 -24.688 1.00 0.00 O ATOM 1016 CB GLU A 66 -6.218 -1.022 -24.982 1.00 0.00 C ATOM 1017 CG GLU A 66 -5.624 0.371 -24.773 1.00 0.00 C ATOM 1018 CD GLU A 66 -6.442 1.113 -23.716 1.00 0.00 C ATOM 1019 OE1 GLU A 66 -6.494 0.597 -22.611 1.00 0.00 O ATOM 1020 OE2 GLU A 66 -6.970 2.155 -24.072 1.00 0.00 O ATOM 0 H GLU A 66 -5.702 -0.490 -27.330 1.00 0.00 H new ATOM 0 HA GLU A 66 -7.878 -1.879 -26.098 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -6.616 -1.406 -24.043 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -5.444 -1.717 -25.307 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -4.584 0.292 -24.456 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.630 0.926 -25.711 1.00 0.00 H new ATOM 1027 N ALA A 67 -8.258 1.217 -26.390 1.00 0.00 N ATOM 1028 CA ALA A 67 -9.155 2.334 -26.086 1.00 0.00 C ATOM 1029 C ALA A 67 -10.577 1.823 -26.041 1.00 0.00 C ATOM 1030 O ALA A 67 -11.434 2.376 -25.374 1.00 0.00 O ATOM 1031 CB ALA A 67 -9.015 3.365 -27.209 1.00 0.00 C ATOM 0 H ALA A 67 -7.647 1.350 -27.196 1.00 0.00 H new ATOM 0 HA ALA A 67 -8.905 2.784 -25.125 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -9.673 4.211 -27.010 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -7.983 3.712 -27.258 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -9.290 2.907 -28.159 1.00 0.00 H new ATOM 1037 N ALA A 68 -10.793 0.758 -26.754 1.00 0.00 N ATOM 1038 CA ALA A 68 -12.134 0.159 -26.794 1.00 0.00 C ATOM 1039 C ALA A 68 -12.378 -0.669 -25.542 1.00 0.00 C ATOM 1040 O ALA A 68 -13.354 -0.478 -24.846 1.00 0.00 O ATOM 1041 CB ALA A 68 -12.192 -0.761 -28.017 1.00 0.00 C ATOM 0 H ALA A 68 -10.087 0.279 -27.313 1.00 0.00 H new ATOM 0 HA ALA A 68 -12.891 0.941 -26.849 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -13.177 -1.224 -28.078 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -12.009 -0.178 -28.920 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -11.432 -1.537 -27.925 1.00 0.00 H new ATOM 1047 N TYR A 69 -11.477 -1.577 -25.279 1.00 0.00 N ATOM 1048 CA TYR A 69 -11.630 -2.432 -24.079 1.00 0.00 C ATOM 1049 C TYR A 69 -11.790 -1.575 -22.829 1.00 0.00 C ATOM 1050 O TYR A 69 -12.555 -1.899 -21.943 1.00 0.00 O ATOM 1051 CB TYR A 69 -10.356 -3.288 -23.936 1.00 0.00 C ATOM 1052 CG TYR A 69 -10.598 -4.403 -22.916 1.00 0.00 C ATOM 1053 CD1 TYR A 69 -11.661 -5.272 -23.061 1.00 0.00 C ATOM 1054 CD2 TYR A 69 -9.771 -4.538 -21.817 1.00 0.00 C ATOM 1055 CE1 TYR A 69 -11.895 -6.253 -22.127 1.00 0.00 C ATOM 1056 CE2 TYR A 69 -10.005 -5.521 -20.881 1.00 0.00 C ATOM 1057 CZ TYR A 69 -11.068 -6.387 -21.027 1.00 0.00 C ATOM 1058 OH TYR A 69 -11.303 -7.368 -20.088 1.00 0.00 O ATOM 0 H TYR A 69 -10.647 -1.759 -25.843 1.00 0.00 H new ATOM 0 HA TYR A 69 -12.515 -3.059 -24.189 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -10.084 -3.717 -24.900 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -9.521 -2.665 -23.617 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -12.315 -5.180 -23.916 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -8.934 -3.867 -21.691 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -12.731 -6.924 -22.253 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -9.351 -5.614 -20.027 1.00 0.00 H new ATOM 0 HH TYR A 69 -10.450 -7.745 -19.788 1.00 0.00 H new ATOM 1068 N LYS A 70 -11.064 -0.491 -22.782 1.00 0.00 N ATOM 1069 CA LYS A 70 -11.163 0.397 -21.601 1.00 0.00 C ATOM 1070 C LYS A 70 -12.555 1.006 -21.504 1.00 0.00 C ATOM 1071 O LYS A 70 -13.186 0.963 -20.467 1.00 0.00 O ATOM 1072 CB LYS A 70 -10.132 1.530 -21.758 1.00 0.00 C ATOM 1073 CG LYS A 70 -9.162 1.498 -20.573 1.00 0.00 C ATOM 1074 CD LYS A 70 -9.836 2.132 -19.352 1.00 0.00 C ATOM 1075 CE LYS A 70 -8.810 2.265 -18.225 1.00 0.00 C ATOM 1076 NZ LYS A 70 -7.442 1.952 -18.727 1.00 0.00 N ATOM 0 H LYS A 70 -10.413 -0.188 -23.507 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.971 -0.182 -20.698 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -9.585 1.413 -22.694 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -10.638 2.494 -21.803 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -8.874 0.470 -20.351 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -8.249 2.039 -20.821 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -10.239 3.111 -19.611 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -10.676 1.518 -19.025 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -8.833 3.277 -17.821 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -9.068 1.590 -17.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -6.762 2.014 -17.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -7.429 0.990 -19.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -7.179 2.634 -19.467 1.00 0.00 H new ATOM 1090 N ALA A 71 -13.010 1.557 -22.593 1.00 0.00 N ATOM 1091 CA ALA A 71 -14.358 2.176 -22.591 1.00 0.00 C ATOM 1092 C ALA A 71 -15.384 1.271 -21.909 1.00 0.00 C ATOM 1093 O ALA A 71 -15.992 1.648 -20.929 1.00 0.00 O ATOM 1094 CB ALA A 71 -14.787 2.396 -24.052 1.00 0.00 C ATOM 0 H ALA A 71 -12.508 1.604 -23.479 1.00 0.00 H new ATOM 0 HA ALA A 71 -14.313 3.117 -22.043 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -15.777 2.851 -24.076 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -14.073 3.055 -24.546 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -14.815 1.438 -24.571 1.00 0.00 H new ATOM 1100 N ARG A 72 -15.554 0.092 -22.441 1.00 0.00 N ATOM 1101 CA ARG A 72 -16.535 -0.849 -21.839 1.00 0.00 C ATOM 1102 C ARG A 72 -16.141 -1.239 -20.417 1.00 0.00 C ATOM 1103 O ARG A 72 -16.828 -0.913 -19.470 1.00 0.00 O ATOM 1104 CB ARG A 72 -16.575 -2.121 -22.704 1.00 0.00 C ATOM 1105 CG ARG A 72 -16.842 -1.731 -24.161 1.00 0.00 C ATOM 1106 CD ARG A 72 -18.345 -1.826 -24.445 1.00 0.00 C ATOM 1107 NE ARG A 72 -19.035 -0.687 -23.780 1.00 0.00 N ATOM 1108 CZ ARG A 72 -19.916 0.006 -24.447 1.00 0.00 C ATOM 1109 NH1 ARG A 72 -20.750 -0.622 -25.230 1.00 0.00 N ATOM 1110 NH2 ARG A 72 -19.935 1.304 -24.309 1.00 0.00 N ATOM 0 H ARG A 72 -15.059 -0.257 -23.261 1.00 0.00 H new ATOM 0 HA ARG A 72 -17.508 -0.359 -21.800 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -15.630 -2.658 -22.626 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -17.354 -2.794 -22.346 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -16.488 -0.717 -24.348 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -16.291 -2.390 -24.832 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -18.528 -1.802 -25.519 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -18.739 -2.773 -24.076 1.00 0.00 H new ATOM 0 HE ARG A 72 -18.821 -0.451 -22.811 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -20.706 -1.638 -25.312 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -21.446 -0.097 -25.760 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -19.268 1.761 -23.687 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -20.617 1.862 -24.823 1.00 0.00 H new ATOM 1124 N TYR A 73 -15.043 -1.932 -20.298 1.00 0.00 N ATOM 1125 CA TYR A 73 -14.580 -2.361 -18.949 1.00 0.00 C ATOM 1126 C TYR A 73 -14.782 -1.263 -17.906 1.00 0.00 C ATOM 1127 O TYR A 73 -15.484 -1.449 -16.933 1.00 0.00 O ATOM 1128 CB TYR A 73 -13.083 -2.686 -19.038 1.00 0.00 C ATOM 1129 CG TYR A 73 -12.505 -2.794 -17.629 1.00 0.00 C ATOM 1130 CD1 TYR A 73 -12.846 -3.849 -16.808 1.00 0.00 C ATOM 1131 CD2 TYR A 73 -11.638 -1.832 -17.155 1.00 0.00 C ATOM 1132 CE1 TYR A 73 -12.326 -3.943 -15.535 1.00 0.00 C ATOM 1133 CE2 TYR A 73 -11.119 -1.925 -15.882 1.00 0.00 C ATOM 1134 CZ TYR A 73 -11.461 -2.981 -15.060 1.00 0.00 C ATOM 1135 OH TYR A 73 -10.947 -3.071 -13.783 1.00 0.00 O ATOM 0 H TYR A 73 -14.447 -2.219 -21.075 1.00 0.00 H new ATOM 0 HA TYR A 73 -15.162 -3.230 -18.642 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -12.934 -3.621 -19.577 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -12.563 -1.909 -19.598 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -13.526 -4.608 -17.166 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -11.364 -1.000 -17.786 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -12.598 -4.777 -14.905 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -10.439 -1.166 -15.524 1.00 0.00 H new ATOM 0 HH TYR A 73 -11.449 -2.478 -13.186 1.00 0.00 H new ATOM 1145 N ARG A 74 -14.164 -0.143 -18.127 1.00 0.00 N ATOM 1146 CA ARG A 74 -14.306 0.977 -17.157 1.00 0.00 C ATOM 1147 C ARG A 74 -15.774 1.302 -16.874 1.00 0.00 C ATOM 1148 O ARG A 74 -16.172 1.419 -15.732 1.00 0.00 O ATOM 1149 CB ARG A 74 -13.632 2.218 -17.757 1.00 0.00 C ATOM 1150 CG ARG A 74 -13.618 3.334 -16.712 1.00 0.00 C ATOM 1151 CD ARG A 74 -13.269 4.657 -17.397 1.00 0.00 C ATOM 1152 NE ARG A 74 -13.242 5.741 -16.378 1.00 0.00 N ATOM 1153 CZ ARG A 74 -14.329 6.422 -16.139 1.00 0.00 C ATOM 1154 NH1 ARG A 74 -15.084 6.779 -17.142 1.00 0.00 N ATOM 1155 NH2 ARG A 74 -14.627 6.722 -14.905 1.00 0.00 N ATOM 0 H ARG A 74 -13.568 0.048 -18.933 1.00 0.00 H new ATOM 0 HA ARG A 74 -13.840 0.682 -16.217 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -12.614 1.980 -18.067 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -14.169 2.544 -18.648 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -14.591 3.407 -16.227 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -12.889 3.110 -15.933 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -12.300 4.581 -17.890 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -14.003 4.885 -18.170 1.00 0.00 H new ATOM 0 HE ARG A 74 -12.382 5.950 -15.871 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -14.821 6.525 -18.094 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -15.937 7.312 -16.974 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -14.014 6.425 -14.146 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -15.473 7.254 -14.699 1.00 0.00 H new ATOM 1169 N ILE A 75 -16.550 1.439 -17.908 1.00 0.00 N ATOM 1170 CA ILE A 75 -17.989 1.758 -17.699 1.00 0.00 C ATOM 1171 C ILE A 75 -18.739 0.587 -17.066 1.00 0.00 C ATOM 1172 O ILE A 75 -19.138 0.645 -15.920 1.00 0.00 O ATOM 1173 CB ILE A 75 -18.619 2.057 -19.062 1.00 0.00 C ATOM 1174 CG1 ILE A 75 -18.011 3.328 -19.656 1.00 0.00 C ATOM 1175 CG2 ILE A 75 -20.131 2.271 -18.863 1.00 0.00 C ATOM 1176 CD1 ILE A 75 -18.701 4.558 -19.057 1.00 0.00 C ATOM 0 H ILE A 75 -16.256 1.346 -18.880 1.00 0.00 H new ATOM 0 HA ILE A 75 -18.059 2.614 -17.027 1.00 0.00 H new ATOM 0 HB ILE A 75 -18.433 1.224 -19.740 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -16.941 3.362 -19.449 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -18.126 3.326 -20.740 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -20.598 2.486 -19.824 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -20.573 1.370 -18.438 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -20.294 3.109 -18.186 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -18.266 5.462 -19.482 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -19.766 4.525 -19.286 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -18.563 4.562 -17.976 1.00 0.00 H new ATOM 1188 N ILE A 76 -18.917 -0.449 -17.827 1.00 0.00 N ATOM 1189 CA ILE A 76 -19.637 -1.634 -17.299 1.00 0.00 C ATOM 1190 C ILE A 76 -19.053 -2.105 -15.972 1.00 0.00 C ATOM 1191 O ILE A 76 -19.619 -2.952 -15.312 1.00 0.00 O ATOM 1192 CB ILE A 76 -19.513 -2.742 -18.313 1.00 0.00 C ATOM 1193 CG1 ILE A 76 -20.154 -2.287 -19.606 1.00 0.00 C ATOM 1194 CG2 ILE A 76 -20.271 -3.977 -17.800 1.00 0.00 C ATOM 1195 CD1 ILE A 76 -19.631 -3.136 -20.743 1.00 0.00 C ATOM 0 H ILE A 76 -18.596 -0.528 -18.792 1.00 0.00 H new ATOM 0 HA ILE A 76 -20.679 -1.365 -17.126 1.00 0.00 H new ATOM 0 HB ILE A 76 -18.463 -2.986 -18.473 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -21.238 -2.375 -19.539 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -19.930 -1.236 -19.787 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -20.187 -4.784 -18.528 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -19.843 -4.298 -16.851 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -21.322 -3.726 -17.657 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -20.089 -2.814 -21.678 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -18.549 -3.025 -20.812 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -19.878 -4.182 -20.560 1.00 0.00 H new ATOM 1207 N TYR A 77 -17.923 -1.549 -15.609 1.00 0.00 N ATOM 1208 CA TYR A 77 -17.276 -1.947 -14.323 1.00 0.00 C ATOM 1209 C TYR A 77 -18.315 -2.173 -13.230 1.00 0.00 C ATOM 1210 O TYR A 77 -18.095 -2.931 -12.305 1.00 0.00 O ATOM 1211 CB TYR A 77 -16.345 -0.807 -13.896 1.00 0.00 C ATOM 1212 CG TYR A 77 -15.763 -1.094 -12.507 1.00 0.00 C ATOM 1213 CD1 TYR A 77 -14.748 -2.018 -12.344 1.00 0.00 C ATOM 1214 CD2 TYR A 77 -16.209 -0.393 -11.403 1.00 0.00 C ATOM 1215 CE1 TYR A 77 -14.189 -2.229 -11.102 1.00 0.00 C ATOM 1216 CE2 TYR A 77 -15.649 -0.607 -10.165 1.00 0.00 C ATOM 1217 CZ TYR A 77 -14.636 -1.523 -10.004 1.00 0.00 C ATOM 1218 OH TYR A 77 -14.068 -1.722 -8.769 1.00 0.00 O ATOM 0 H TYR A 77 -17.424 -0.840 -16.146 1.00 0.00 H new ATOM 0 HA TYR A 77 -16.728 -2.878 -14.468 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -15.539 -0.695 -14.621 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -16.894 0.135 -13.881 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -14.391 -2.578 -13.195 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -17.004 0.329 -11.513 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -13.395 -2.952 -10.987 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -16.008 -0.051 -9.312 1.00 0.00 H new ATOM 0 HH TYR A 77 -14.644 -1.335 -8.078 1.00 0.00 H new ATOM 1228 N SER A 78 -19.429 -1.510 -13.353 1.00 0.00 N ATOM 1229 CA SER A 78 -20.487 -1.679 -12.330 1.00 0.00 C ATOM 1230 C SER A 78 -21.094 -3.065 -12.428 1.00 0.00 C ATOM 1231 O SER A 78 -21.093 -3.815 -11.473 1.00 0.00 O ATOM 1232 CB SER A 78 -21.584 -0.633 -12.585 1.00 0.00 C ATOM 1233 OG SER A 78 -22.711 -1.134 -11.879 1.00 0.00 O ATOM 0 H SER A 78 -19.649 -0.865 -14.112 1.00 0.00 H new ATOM 0 HA SER A 78 -20.056 -1.550 -11.337 1.00 0.00 H new ATOM 0 HB2 SER A 78 -21.290 0.351 -12.219 1.00 0.00 H new ATOM 0 HB3 SER A 78 -21.795 -0.528 -13.649 1.00 0.00 H new ATOM 0 HG SER A 78 -23.466 -0.519 -11.989 1.00 0.00 H new ATOM 1239 N ASN A 79 -21.607 -3.382 -13.581 1.00 0.00 N ATOM 1240 CA ASN A 79 -22.214 -4.716 -13.751 1.00 0.00 C ATOM 1241 C ASN A 79 -21.163 -5.791 -13.562 1.00 0.00 C ATOM 1242 O ASN A 79 -21.480 -6.920 -13.270 1.00 0.00 O ATOM 1243 CB ASN A 79 -22.788 -4.822 -15.170 1.00 0.00 C ATOM 1244 CG ASN A 79 -23.882 -5.895 -15.196 1.00 0.00 C ATOM 1245 OD1 ASN A 79 -23.747 -6.919 -15.837 1.00 0.00 O ATOM 1246 ND2 ASN A 79 -24.980 -5.701 -14.517 1.00 0.00 N ATOM 0 H ASN A 79 -21.630 -2.778 -14.403 1.00 0.00 H new ATOM 0 HA ASN A 79 -23.003 -4.852 -13.012 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -23.198 -3.861 -15.481 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -21.997 -5.075 -15.876 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -25.717 -6.406 -14.527 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -25.101 -4.844 -13.977 1.00 0.00 H new ATOM 1253 N VAL A 80 -19.916 -5.422 -13.740 1.00 0.00 N ATOM 1254 CA VAL A 80 -18.843 -6.424 -13.567 1.00 0.00 C ATOM 1255 C VAL A 80 -18.825 -6.899 -12.125 1.00 0.00 C ATOM 1256 O VAL A 80 -18.720 -8.078 -11.861 1.00 0.00 O ATOM 1257 CB VAL A 80 -17.486 -5.778 -13.907 1.00 0.00 C ATOM 1258 CG1 VAL A 80 -16.357 -6.740 -13.513 1.00 0.00 C ATOM 1259 CG2 VAL A 80 -17.417 -5.505 -15.414 1.00 0.00 C ATOM 0 H VAL A 80 -19.608 -4.483 -13.993 1.00 0.00 H new ATOM 0 HA VAL A 80 -19.023 -7.271 -14.228 1.00 0.00 H new ATOM 0 HB VAL A 80 -17.378 -4.841 -13.361 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -15.394 -6.288 -13.751 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -16.408 -6.942 -12.443 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -16.466 -7.674 -14.064 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -16.458 -5.048 -15.657 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -17.520 -6.443 -15.959 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -18.224 -4.829 -15.699 1.00 0.00 H new ATOM 1269 N ILE A 81 -18.927 -5.968 -11.203 1.00 0.00 N ATOM 1270 CA ILE A 81 -18.919 -6.375 -9.775 1.00 0.00 C ATOM 1271 C ILE A 81 -20.180 -7.171 -9.453 1.00 0.00 C ATOM 1272 O ILE A 81 -20.275 -7.804 -8.419 1.00 0.00 O ATOM 1273 CB ILE A 81 -18.898 -5.129 -8.904 1.00 0.00 C ATOM 1274 CG1 ILE A 81 -18.294 -3.974 -9.686 1.00 0.00 C ATOM 1275 CG2 ILE A 81 -18.025 -5.427 -7.666 1.00 0.00 C ATOM 1276 CD1 ILE A 81 -17.659 -2.978 -8.725 1.00 0.00 C ATOM 0 H ILE A 81 -19.013 -4.967 -11.379 1.00 0.00 H new ATOM 0 HA ILE A 81 -18.039 -6.990 -9.584 1.00 0.00 H new ATOM 0 HB ILE A 81 -19.909 -4.860 -8.600 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -17.545 -4.348 -10.384 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -19.065 -3.481 -10.278 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -17.993 -4.547 -7.023 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -18.451 -6.265 -7.114 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -17.014 -5.679 -7.986 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -17.227 -2.152 -9.290 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -18.419 -2.594 -8.044 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -16.876 -3.474 -8.152 1.00 0.00 H new ATOM 1288 N SER A 82 -21.130 -7.118 -10.354 1.00 0.00 N ATOM 1289 CA SER A 82 -22.400 -7.859 -10.133 1.00 0.00 C ATOM 1290 C SER A 82 -22.378 -9.231 -10.812 1.00 0.00 C ATOM 1291 O SER A 82 -22.882 -10.197 -10.275 1.00 0.00 O ATOM 1292 CB SER A 82 -23.550 -7.035 -10.735 1.00 0.00 C ATOM 1293 OG SER A 82 -23.566 -7.411 -12.104 1.00 0.00 O ATOM 0 H SER A 82 -21.077 -6.595 -11.228 1.00 0.00 H new ATOM 0 HA SER A 82 -22.531 -8.009 -9.061 1.00 0.00 H new ATOM 0 HB2 SER A 82 -24.499 -7.260 -10.249 1.00 0.00 H new ATOM 0 HB3 SER A 82 -23.378 -5.965 -10.617 1.00 0.00 H new ATOM 0 HG SER A 82 -22.729 -7.131 -12.530 1.00 0.00 H new ATOM 1299 N LYS A 83 -21.797 -9.288 -11.983 1.00 0.00 N ATOM 1300 CA LYS A 83 -21.732 -10.586 -12.712 1.00 0.00 C ATOM 1301 C LYS A 83 -20.406 -10.717 -13.462 1.00 0.00 C ATOM 1302 O LYS A 83 -19.393 -10.221 -13.015 1.00 0.00 O ATOM 1303 CB LYS A 83 -22.896 -10.631 -13.722 1.00 0.00 C ATOM 1304 CG LYS A 83 -24.223 -10.500 -12.961 1.00 0.00 C ATOM 1305 CD LYS A 83 -25.387 -10.616 -13.950 1.00 0.00 C ATOM 1306 CE LYS A 83 -26.698 -10.281 -13.229 1.00 0.00 C ATOM 1307 NZ LYS A 83 -26.651 -10.744 -11.813 1.00 0.00 N ATOM 0 H LYS A 83 -21.368 -8.496 -12.462 1.00 0.00 H new ATOM 0 HA LYS A 83 -21.807 -11.407 -11.999 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -22.797 -9.823 -14.447 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -22.873 -11.566 -14.281 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -24.298 -11.277 -12.201 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -24.265 -9.542 -12.443 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -25.236 -9.937 -14.789 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -25.432 -11.625 -14.361 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -26.872 -9.205 -13.260 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -27.534 -10.754 -13.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -27.614 -10.761 -11.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -26.245 -11.701 -11.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -26.061 -10.094 -11.255 1.00 0.00 H new ATOM 1321 N ASN A 84 -20.427 -11.383 -14.589 1.00 0.00 N ATOM 1322 CA ASN A 84 -19.161 -11.537 -15.353 1.00 0.00 C ATOM 1323 C ASN A 84 -19.418 -11.763 -16.843 1.00 0.00 C ATOM 1324 O ASN A 84 -20.347 -12.449 -17.221 1.00 0.00 O ATOM 1325 CB ASN A 84 -18.411 -12.751 -14.791 1.00 0.00 C ATOM 1326 CG ASN A 84 -18.171 -12.545 -13.292 1.00 0.00 C ATOM 1327 OD1 ASN A 84 -19.009 -12.856 -12.469 1.00 0.00 O ATOM 1328 ND2 ASN A 84 -17.041 -12.023 -12.896 1.00 0.00 N ATOM 0 H ASN A 84 -21.251 -11.818 -15.004 1.00 0.00 H new ATOM 0 HA ASN A 84 -18.579 -10.621 -15.250 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -18.989 -13.660 -14.957 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -17.461 -12.878 -15.310 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -16.867 -11.879 -11.901 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -16.333 -11.760 -13.581 1.00 0.00 H new ATOM 1335 N ASN A 85 -18.567 -11.181 -17.659 1.00 0.00 N ATOM 1336 CA ASN A 85 -18.716 -11.331 -19.137 1.00 0.00 C ATOM 1337 C ASN A 85 -20.170 -11.335 -19.558 1.00 0.00 C ATOM 1338 O ASN A 85 -20.698 -12.329 -20.013 1.00 0.00 O ATOM 1339 CB ASN A 85 -18.078 -12.661 -19.558 1.00 0.00 C ATOM 1340 CG ASN A 85 -18.758 -13.809 -18.806 1.00 0.00 C ATOM 1341 OD1 ASN A 85 -18.404 -14.059 -17.577 1.00 0.00 O flip ATOM 1342 ND2 ASN A 85 -19.612 -14.493 -19.336 1.00 0.00 N flip ATOM 0 H ASN A 85 -17.777 -10.609 -17.361 1.00 0.00 H new ATOM 0 HA ASN A 85 -18.226 -10.484 -19.618 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -18.182 -12.803 -20.634 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -17.010 -12.650 -19.340 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -19.894 -14.303 -20.298 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -20.047 -15.257 -18.819 1.00 0.00 H new ATOM 1349 N PRO A 86 -20.789 -10.208 -19.392 1.00 0.00 N ATOM 1350 CA PRO A 86 -22.181 -10.050 -19.748 1.00 0.00 C ATOM 1351 C PRO A 86 -22.368 -10.198 -21.242 1.00 0.00 C ATOM 1352 O PRO A 86 -23.177 -10.977 -21.690 1.00 0.00 O ATOM 1353 CB PRO A 86 -22.539 -8.612 -19.315 1.00 0.00 C ATOM 1354 CG PRO A 86 -21.246 -7.976 -18.717 1.00 0.00 C ATOM 1355 CD PRO A 86 -20.137 -9.025 -18.824 1.00 0.00 C ATOM 0 HA PRO A 86 -22.811 -10.801 -19.270 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -22.896 -8.031 -20.166 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -23.341 -8.621 -18.577 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -20.974 -7.072 -19.261 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -21.404 -7.687 -17.678 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -19.325 -8.677 -19.462 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -19.704 -9.243 -17.848 1.00 0.00 H new ATOM 1363 N ASP A 87 -21.580 -9.455 -21.970 1.00 0.00 N ATOM 1364 CA ASP A 87 -21.646 -9.489 -23.463 1.00 0.00 C ATOM 1365 C ASP A 87 -21.095 -8.177 -24.011 1.00 0.00 C ATOM 1366 O ASP A 87 -21.614 -7.619 -24.957 1.00 0.00 O ATOM 1367 CB ASP A 87 -23.123 -9.643 -23.924 1.00 0.00 C ATOM 1368 CG ASP A 87 -24.046 -8.895 -22.958 1.00 0.00 C ATOM 1369 OD1 ASP A 87 -23.637 -7.825 -22.537 1.00 0.00 O ATOM 1370 OD2 ASP A 87 -25.108 -9.435 -22.696 1.00 0.00 O ATOM 0 H ASP A 87 -20.882 -8.816 -21.590 1.00 0.00 H new ATOM 0 HA ASP A 87 -21.061 -10.332 -23.832 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -23.242 -9.250 -24.934 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -23.395 -10.698 -23.959 1.00 0.00 H new ATOM 1375 N LEU A 88 -20.046 -7.711 -23.388 1.00 0.00 N ATOM 1376 CA LEU A 88 -19.415 -6.426 -23.835 1.00 0.00 C ATOM 1377 C LEU A 88 -19.495 -6.227 -25.353 1.00 0.00 C ATOM 1378 O LEU A 88 -20.243 -5.394 -25.827 1.00 0.00 O ATOM 1379 CB LEU A 88 -17.934 -6.450 -23.428 1.00 0.00 C ATOM 1380 CG LEU A 88 -17.812 -5.996 -21.973 1.00 0.00 C ATOM 1381 CD1 LEU A 88 -18.342 -7.099 -21.055 1.00 0.00 C ATOM 1382 CD2 LEU A 88 -16.341 -5.730 -21.647 1.00 0.00 C ATOM 0 H LEU A 88 -19.596 -8.160 -22.590 1.00 0.00 H new ATOM 0 HA LEU A 88 -19.957 -5.606 -23.364 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -17.527 -7.455 -23.545 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -17.354 -5.794 -24.077 1.00 0.00 H new ATOM 0 HG LEU A 88 -18.390 -5.084 -21.823 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -18.257 -6.780 -20.016 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -19.388 -7.296 -21.290 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -17.759 -8.008 -21.204 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -16.251 -5.406 -20.610 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -15.765 -6.644 -21.793 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -15.958 -4.950 -22.305 1.00 0.00 H new ATOM 1394 N LYS A 89 -18.734 -6.994 -26.087 1.00 0.00 N ATOM 1395 CA LYS A 89 -18.769 -6.842 -27.570 1.00 0.00 C ATOM 1396 C LYS A 89 -19.782 -7.790 -28.207 1.00 0.00 C ATOM 1397 O LYS A 89 -20.153 -7.622 -29.351 1.00 0.00 O ATOM 1398 CB LYS A 89 -17.372 -7.171 -28.119 1.00 0.00 C ATOM 1399 CG LYS A 89 -17.095 -8.667 -27.933 1.00 0.00 C ATOM 1400 CD LYS A 89 -15.825 -8.848 -27.106 1.00 0.00 C ATOM 1401 CE LYS A 89 -15.746 -10.301 -26.637 1.00 0.00 C ATOM 1402 NZ LYS A 89 -15.802 -11.229 -27.802 1.00 0.00 N ATOM 0 H LYS A 89 -18.099 -7.709 -25.731 1.00 0.00 H new ATOM 0 HA LYS A 89 -19.062 -5.820 -27.810 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -17.312 -6.907 -29.175 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -16.616 -6.582 -27.599 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -17.938 -9.145 -27.434 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -16.982 -9.151 -28.903 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -14.948 -8.595 -27.701 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -15.833 -8.175 -26.249 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -14.822 -10.460 -26.082 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -16.569 -10.514 -25.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -15.513 -12.182 -27.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -16.773 -11.263 -28.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -15.159 -10.891 -28.546 1.00 0.00 H new ATOM 1416 N HIS A 90 -20.214 -8.765 -27.460 1.00 0.00 N ATOM 1417 CA HIS A 90 -21.199 -9.726 -28.018 1.00 0.00 C ATOM 1418 C HIS A 90 -22.461 -9.009 -28.488 1.00 0.00 C ATOM 1419 O HIS A 90 -23.120 -9.451 -29.406 1.00 0.00 O ATOM 1420 CB HIS A 90 -21.582 -10.718 -26.913 1.00 0.00 C ATOM 1421 CG HIS A 90 -20.955 -12.078 -27.212 1.00 0.00 C ATOM 1422 ND1 HIS A 90 -20.986 -12.653 -28.321 1.00 0.00 N ATOM 1423 CD2 HIS A 90 -20.257 -12.928 -26.377 1.00 0.00 C ATOM 1424 CE1 HIS A 90 -20.387 -13.770 -28.282 1.00 0.00 C ATOM 1425 NE2 HIS A 90 -19.886 -14.035 -27.075 1.00 0.00 N ATOM 0 H HIS A 90 -19.930 -8.937 -26.495 1.00 0.00 H new ATOM 0 HA HIS A 90 -20.751 -10.235 -28.871 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -21.239 -10.352 -25.945 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -22.666 -10.811 -26.852 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -20.040 -12.743 -25.335 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -20.293 -14.432 -29.130 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -19.363 -14.852 -26.759 1.00 0.00 H new ATOM 1433 N LYS A 91 -22.770 -7.916 -27.851 1.00 0.00 N ATOM 1434 CA LYS A 91 -23.983 -7.163 -28.248 1.00 0.00 C ATOM 1435 C LYS A 91 -23.797 -6.483 -29.600 1.00 0.00 C ATOM 1436 O LYS A 91 -24.735 -6.339 -30.359 1.00 0.00 O ATOM 1437 CB LYS A 91 -24.240 -6.087 -27.189 1.00 0.00 C ATOM 1438 CG LYS A 91 -25.725 -6.081 -26.829 1.00 0.00 C ATOM 1439 CD LYS A 91 -25.922 -5.281 -25.547 1.00 0.00 C ATOM 1440 CE LYS A 91 -27.412 -4.978 -25.372 1.00 0.00 C ATOM 1441 NZ LYS A 91 -27.880 -4.032 -26.426 1.00 0.00 N ATOM 0 H LYS A 91 -22.238 -7.516 -27.078 1.00 0.00 H new ATOM 0 HA LYS A 91 -24.820 -7.857 -28.327 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -23.639 -6.283 -26.301 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -23.941 -5.109 -27.567 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -26.307 -5.642 -27.640 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -26.084 -7.101 -26.695 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -25.549 -5.844 -24.691 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -25.352 -4.353 -25.591 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -27.986 -5.903 -25.425 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -27.589 -4.549 -24.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -28.704 -3.502 -26.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -27.115 -3.367 -26.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -28.148 -4.566 -27.277 1.00 0.00 H new ATOM 1455 N ILE A 92 -22.591 -6.073 -29.878 1.00 0.00 N ATOM 1456 CA ILE A 92 -22.332 -5.404 -31.175 1.00 0.00 C ATOM 1457 C ILE A 92 -22.250 -6.426 -32.302 1.00 0.00 C ATOM 1458 O ILE A 92 -22.517 -6.116 -33.447 1.00 0.00 O ATOM 1459 CB ILE A 92 -20.990 -4.674 -31.083 1.00 0.00 C ATOM 1460 CG1 ILE A 92 -21.152 -3.368 -30.311 1.00 0.00 C ATOM 1461 CG2 ILE A 92 -20.516 -4.341 -32.510 1.00 0.00 C ATOM 1462 CD1 ILE A 92 -21.383 -3.676 -28.827 1.00 0.00 C ATOM 0 H ILE A 92 -21.781 -6.173 -29.266 1.00 0.00 H new ATOM 0 HA ILE A 92 -23.146 -4.710 -31.385 1.00 0.00 H new ATOM 0 HB ILE A 92 -20.269 -5.310 -30.570 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -20.262 -2.750 -30.431 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -21.992 -2.799 -30.710 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -19.560 -3.820 -32.463 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -20.399 -5.263 -33.079 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -21.253 -3.704 -32.999 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -21.499 -2.743 -28.275 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -22.285 -4.277 -28.716 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -20.529 -4.227 -28.433 1.00 0.00 H new ATOM 1474 N ALA A 93 -21.884 -7.627 -31.952 1.00 0.00 N ATOM 1475 CA ALA A 93 -21.776 -8.686 -32.984 1.00 0.00 C ATOM 1476 C ALA A 93 -23.095 -9.430 -33.162 1.00 0.00 C ATOM 1477 O ALA A 93 -23.401 -9.893 -34.243 1.00 0.00 O ATOM 1478 CB ALA A 93 -20.706 -9.688 -32.530 1.00 0.00 C ATOM 0 H ALA A 93 -21.657 -7.917 -31.001 1.00 0.00 H new ATOM 0 HA ALA A 93 -21.514 -8.222 -33.935 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -20.608 -10.478 -33.274 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -19.751 -9.175 -32.418 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -20.998 -10.124 -31.575 1.00 0.00 H new ATOM 1484 N ASN A 94 -23.857 -9.539 -32.105 1.00 0.00 N ATOM 1485 CA ASN A 94 -25.151 -10.257 -32.232 1.00 0.00 C ATOM 1486 C ASN A 94 -26.172 -9.772 -31.205 1.00 0.00 C ATOM 1487 O ASN A 94 -26.858 -10.564 -30.590 1.00 0.00 O ATOM 1488 CB ASN A 94 -24.900 -11.751 -32.006 1.00 0.00 C ATOM 1489 CG ASN A 94 -26.072 -12.546 -32.583 1.00 0.00 C ATOM 1490 OD1 ASN A 94 -26.653 -12.117 -33.670 1.00 0.00 O flip ATOM 1491 ND2 ASN A 94 -26.471 -13.560 -32.049 1.00 0.00 N flip ATOM 0 H ASN A 94 -23.642 -9.169 -31.179 1.00 0.00 H new ATOM 0 HA ASN A 94 -25.554 -10.065 -33.227 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -23.968 -12.053 -32.485 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -24.793 -11.958 -30.941 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -26.021 -13.900 -31.199 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -27.257 -14.072 -32.450 1.00 0.00 H new ATOM 1498 N GLY A 95 -26.256 -8.482 -31.040 1.00 0.00 N ATOM 1499 CA GLY A 95 -27.233 -7.931 -30.056 1.00 0.00 C ATOM 1500 C GLY A 95 -28.640 -7.994 -30.644 1.00 0.00 C ATOM 1501 O GLY A 95 -29.614 -7.733 -29.964 1.00 0.00 O ATOM 0 H GLY A 95 -25.697 -7.789 -31.538 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -27.190 -8.500 -29.127 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -26.976 -6.901 -29.811 1.00 0.00 H new ATOM 1505 N ASP A 96 -28.702 -8.335 -31.908 1.00 0.00 N ATOM 1506 CA ASP A 96 -30.015 -8.431 -32.600 1.00 0.00 C ATOM 1507 C ASP A 96 -31.111 -8.933 -31.673 1.00 0.00 C ATOM 1508 O ASP A 96 -32.202 -8.399 -31.666 1.00 0.00 O ATOM 1509 CB ASP A 96 -29.867 -9.416 -33.773 1.00 0.00 C ATOM 1510 CG ASP A 96 -29.214 -8.691 -34.952 1.00 0.00 C ATOM 1511 OD1 ASP A 96 -29.853 -7.776 -35.446 1.00 0.00 O ATOM 1512 OD2 ASP A 96 -28.112 -9.090 -35.292 1.00 0.00 O ATOM 0 H ASP A 96 -27.892 -8.551 -32.489 1.00 0.00 H new ATOM 0 HA ASP A 96 -30.299 -7.436 -32.943 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -29.260 -10.270 -33.473 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -30.843 -9.805 -34.064 1.00 0.00 H new ATOM 1517 N ILE A 97 -30.815 -9.955 -30.909 1.00 0.00 N ATOM 1518 CA ILE A 97 -31.852 -10.485 -29.982 1.00 0.00 C ATOM 1519 C ILE A 97 -31.221 -11.001 -28.657 1.00 0.00 C ATOM 1520 O ILE A 97 -30.227 -10.480 -28.183 1.00 0.00 O ATOM 1521 CB ILE A 97 -32.615 -11.639 -30.717 1.00 0.00 C ATOM 1522 CG1 ILE A 97 -33.151 -11.142 -32.055 1.00 0.00 C ATOM 1523 CG2 ILE A 97 -33.834 -12.107 -29.867 1.00 0.00 C ATOM 1524 CD1 ILE A 97 -33.806 -12.312 -32.795 1.00 0.00 C ATOM 0 H ILE A 97 -29.916 -10.436 -30.888 1.00 0.00 H new ATOM 0 HA ILE A 97 -32.542 -9.686 -29.712 1.00 0.00 H new ATOM 0 HB ILE A 97 -31.916 -12.462 -30.865 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -33.876 -10.343 -31.897 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -32.341 -10.724 -32.653 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -34.355 -12.909 -30.389 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -33.485 -12.470 -28.900 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -34.515 -11.270 -29.716 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -34.192 -11.966 -33.754 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -33.067 -13.095 -32.963 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -34.625 -12.709 -32.196 1.00 0.00 H new ATOM 1536 N THR A 98 -31.841 -12.009 -28.109 1.00 0.00 N ATOM 1537 CA THR A 98 -31.400 -12.657 -26.821 1.00 0.00 C ATOM 1538 C THR A 98 -30.625 -14.033 -26.940 1.00 0.00 C ATOM 1539 O THR A 98 -30.423 -14.639 -25.926 1.00 0.00 O ATOM 1540 CB THR A 98 -32.643 -12.898 -25.969 1.00 0.00 C ATOM 1541 OG1 THR A 98 -33.402 -13.851 -26.678 1.00 0.00 O ATOM 1542 CG2 THR A 98 -33.531 -11.648 -25.921 1.00 0.00 C ATOM 0 H THR A 98 -32.674 -12.435 -28.514 1.00 0.00 H new ATOM 0 HA THR A 98 -30.681 -11.962 -26.389 1.00 0.00 H new ATOM 0 HB THR A 98 -32.347 -13.188 -24.961 1.00 0.00 H new ATOM 0 HG1 THR A 98 -32.839 -14.624 -26.892 1.00 0.00 H new ATOM 0 HG21 THR A 98 -34.409 -11.849 -25.307 1.00 0.00 H new ATOM 0 HG22 THR A 98 -32.969 -10.819 -25.491 1.00 0.00 H new ATOM 0 HG23 THR A 98 -33.847 -11.387 -26.931 1.00 0.00 H new ATOM 1550 N PRO A 99 -30.211 -14.495 -28.173 1.00 0.00 N ATOM 1551 CA PRO A 99 -29.504 -15.792 -28.342 1.00 0.00 C ATOM 1552 C PRO A 99 -29.362 -16.658 -27.096 1.00 0.00 C ATOM 1553 O PRO A 99 -29.771 -17.800 -27.116 1.00 0.00 O ATOM 1554 CB PRO A 99 -28.185 -15.394 -28.959 1.00 0.00 C ATOM 1555 CG PRO A 99 -28.518 -14.094 -29.767 1.00 0.00 C ATOM 1556 CD PRO A 99 -29.942 -13.637 -29.293 1.00 0.00 C ATOM 0 HA PRO A 99 -30.090 -16.468 -28.965 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -27.429 -15.207 -28.197 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -27.796 -16.178 -29.608 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -27.777 -13.317 -29.578 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -28.509 -14.289 -30.839 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -29.952 -12.586 -29.005 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -30.686 -13.759 -30.080 1.00 0.00 H new ATOM 1564 N GLU A 100 -28.773 -16.169 -26.066 1.00 0.00 N ATOM 1565 CA GLU A 100 -28.660 -17.030 -24.876 1.00 0.00 C ATOM 1566 C GLU A 100 -30.055 -17.589 -24.540 1.00 0.00 C ATOM 1567 O GLU A 100 -30.205 -18.456 -23.704 1.00 0.00 O ATOM 1568 CB GLU A 100 -28.166 -16.175 -23.698 1.00 0.00 C ATOM 1569 CG GLU A 100 -28.454 -16.912 -22.389 1.00 0.00 C ATOM 1570 CD GLU A 100 -27.601 -16.310 -21.271 1.00 0.00 C ATOM 1571 OE1 GLU A 100 -27.684 -15.104 -21.118 1.00 0.00 O ATOM 1572 OE2 GLU A 100 -26.916 -17.093 -20.633 1.00 0.00 O ATOM 0 H GLU A 100 -28.372 -15.234 -25.990 1.00 0.00 H new ATOM 0 HA GLU A 100 -27.964 -17.848 -25.062 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -27.097 -15.984 -23.794 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -28.665 -15.206 -23.702 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -29.512 -16.832 -22.138 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -28.232 -17.973 -22.500 1.00 0.00 H new ATOM 1579 N PHE A 101 -31.051 -17.050 -25.223 1.00 0.00 N ATOM 1580 CA PHE A 101 -32.460 -17.489 -25.006 1.00 0.00 C ATOM 1581 C PHE A 101 -32.901 -18.522 -26.051 1.00 0.00 C ATOM 1582 O PHE A 101 -33.819 -19.279 -25.819 1.00 0.00 O ATOM 1583 CB PHE A 101 -33.351 -16.230 -25.112 1.00 0.00 C ATOM 1584 CG PHE A 101 -34.187 -16.288 -26.370 1.00 0.00 C ATOM 1585 CD1 PHE A 101 -33.588 -16.192 -27.607 1.00 0.00 C ATOM 1586 CD2 PHE A 101 -35.550 -16.455 -26.289 1.00 0.00 C ATOM 1587 CE1 PHE A 101 -34.342 -16.259 -28.747 1.00 0.00 C ATOM 1588 CE2 PHE A 101 -36.307 -16.522 -27.427 1.00 0.00 C ATOM 1589 CZ PHE A 101 -35.705 -16.424 -28.661 1.00 0.00 C ATOM 0 H PHE A 101 -30.936 -16.319 -25.925 1.00 0.00 H new ATOM 0 HA PHE A 101 -32.548 -17.964 -24.029 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -33.999 -16.159 -24.239 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -32.729 -15.335 -25.121 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -32.518 -16.063 -27.677 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -36.025 -16.534 -25.322 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -33.867 -16.182 -29.714 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -37.377 -16.652 -27.357 1.00 0.00 H new ATOM 0 HZ PHE A 101 -36.301 -16.477 -29.560 1.00 0.00 H new ATOM 1599 N LEU A 102 -32.256 -18.504 -27.185 1.00 0.00 N ATOM 1600 CA LEU A 102 -32.616 -19.469 -28.261 1.00 0.00 C ATOM 1601 C LEU A 102 -32.965 -20.834 -27.689 1.00 0.00 C ATOM 1602 O LEU A 102 -33.708 -21.586 -28.287 1.00 0.00 O ATOM 1603 CB LEU A 102 -31.405 -19.624 -29.189 1.00 0.00 C ATOM 1604 CG LEU A 102 -31.369 -18.454 -30.173 1.00 0.00 C ATOM 1605 CD1 LEU A 102 -29.924 -18.231 -30.632 1.00 0.00 C ATOM 1606 CD2 LEU A 102 -32.246 -18.781 -31.389 1.00 0.00 C ATOM 0 H LEU A 102 -31.496 -17.863 -27.413 1.00 0.00 H new ATOM 0 HA LEU A 102 -33.486 -19.088 -28.796 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -30.485 -19.651 -28.604 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -31.466 -20.568 -29.731 1.00 0.00 H new ATOM 0 HG LEU A 102 -31.745 -17.553 -29.688 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -29.890 -17.398 -31.334 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -29.299 -18.004 -29.768 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -29.554 -19.133 -31.120 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -32.221 -17.947 -32.091 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -31.869 -19.679 -31.879 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -33.272 -18.949 -31.063 1.00 0.00 H new ATOM 1618 N ALA A 103 -32.424 -21.130 -26.539 1.00 0.00 N ATOM 1619 CA ALA A 103 -32.715 -22.445 -25.915 1.00 0.00 C ATOM 1620 C ALA A 103 -33.884 -22.326 -24.950 1.00 0.00 C ATOM 1621 O ALA A 103 -34.649 -23.252 -24.775 1.00 0.00 O ATOM 1622 CB ALA A 103 -31.471 -22.896 -25.136 1.00 0.00 C ATOM 0 H ALA A 103 -31.799 -20.522 -26.011 1.00 0.00 H new ATOM 0 HA ALA A 103 -32.970 -23.166 -26.691 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -31.664 -23.862 -24.669 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -30.627 -22.986 -25.819 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -31.238 -22.161 -24.366 1.00 0.00 H new ATOM 1628 N THR A 104 -33.996 -21.183 -24.338 1.00 0.00 N ATOM 1629 CA THR A 104 -35.098 -20.963 -23.380 1.00 0.00 C ATOM 1630 C THR A 104 -36.279 -20.301 -24.078 1.00 0.00 C ATOM 1631 O THR A 104 -37.279 -19.986 -23.461 1.00 0.00 O ATOM 1632 CB THR A 104 -34.587 -20.023 -22.290 1.00 0.00 C ATOM 1633 OG1 THR A 104 -33.307 -20.512 -21.941 1.00 0.00 O ATOM 1634 CG2 THR A 104 -35.414 -20.165 -21.013 1.00 0.00 C ATOM 0 H THR A 104 -33.366 -20.391 -24.464 1.00 0.00 H new ATOM 0 HA THR A 104 -35.421 -21.917 -22.964 1.00 0.00 H new ATOM 0 HB THR A 104 -34.616 -18.995 -22.650 1.00 0.00 H new ATOM 0 HG1 THR A 104 -32.920 -19.946 -21.241 1.00 0.00 H new ATOM 0 HG21 THR A 104 -35.029 -19.485 -20.253 1.00 0.00 H new ATOM 0 HG22 THR A 104 -36.455 -19.921 -21.225 1.00 0.00 H new ATOM 0 HG23 THR A 104 -35.348 -21.190 -20.649 1.00 0.00 H new ATOM 1642 N CYS A 105 -36.131 -20.108 -25.357 1.00 0.00 N ATOM 1643 CA CYS A 105 -37.215 -19.469 -26.150 1.00 0.00 C ATOM 1644 C CYS A 105 -38.594 -19.928 -25.695 1.00 0.00 C ATOM 1645 O CYS A 105 -39.382 -19.139 -25.210 1.00 0.00 O ATOM 1646 CB CYS A 105 -37.023 -19.864 -27.625 1.00 0.00 C ATOM 1647 SG CYS A 105 -38.462 -20.512 -28.509 1.00 0.00 S ATOM 0 H CYS A 105 -35.301 -20.367 -25.890 1.00 0.00 H new ATOM 0 HA CYS A 105 -37.158 -18.389 -26.012 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -36.664 -18.987 -28.164 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -36.233 -20.614 -27.673 1.00 0.00 H new ATOM 0 HG CYS A 105 -38.129 -20.792 -29.734 1.00 0.00 H new ATOM 1653 N ASP A 106 -38.861 -21.192 -25.858 1.00 0.00 N ATOM 1654 CA ASP A 106 -40.187 -21.719 -25.439 1.00 0.00 C ATOM 1655 C ASP A 106 -40.142 -22.273 -24.021 1.00 0.00 C ATOM 1656 O ASP A 106 -41.057 -22.074 -23.247 1.00 0.00 O ATOM 1657 CB ASP A 106 -40.583 -22.849 -26.399 1.00 0.00 C ATOM 1658 CG ASP A 106 -42.075 -23.152 -26.236 1.00 0.00 C ATOM 1659 OD1 ASP A 106 -42.842 -22.230 -26.459 1.00 0.00 O ATOM 1660 OD2 ASP A 106 -42.363 -24.290 -25.899 1.00 0.00 O ATOM 0 H ASP A 106 -38.223 -21.879 -26.260 1.00 0.00 H new ATOM 0 HA ASP A 106 -40.911 -20.905 -25.465 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -40.369 -22.559 -27.428 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -39.994 -23.742 -26.190 1.00 0.00 H new ATOM 1665 N ALA A 107 -39.085 -22.961 -23.706 1.00 0.00 N ATOM 1666 CA ALA A 107 -38.980 -23.529 -22.344 1.00 0.00 C ATOM 1667 C ALA A 107 -39.100 -22.435 -21.296 1.00 0.00 C ATOM 1668 O ALA A 107 -39.327 -22.708 -20.135 1.00 0.00 O ATOM 1669 CB ALA A 107 -37.614 -24.211 -22.201 1.00 0.00 C ATOM 0 H ALA A 107 -38.298 -23.152 -24.327 1.00 0.00 H new ATOM 0 HA ALA A 107 -39.787 -24.247 -22.194 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -37.522 -24.635 -21.201 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -37.525 -25.006 -22.942 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -36.823 -23.478 -22.359 1.00 0.00 H new ATOM 1675 N LYS A 108 -38.938 -21.211 -21.721 1.00 0.00 N ATOM 1676 CA LYS A 108 -39.044 -20.094 -20.753 1.00 0.00 C ATOM 1677 C LYS A 108 -40.376 -20.171 -20.036 1.00 0.00 C ATOM 1678 O LYS A 108 -40.495 -19.776 -18.892 1.00 0.00 O ATOM 1679 CB LYS A 108 -38.939 -18.763 -21.532 1.00 0.00 C ATOM 1680 CG LYS A 108 -39.681 -17.653 -20.769 1.00 0.00 C ATOM 1681 CD LYS A 108 -41.179 -17.695 -21.115 1.00 0.00 C ATOM 1682 CE LYS A 108 -41.582 -16.366 -21.767 1.00 0.00 C ATOM 1683 NZ LYS A 108 -42.889 -16.504 -22.467 1.00 0.00 N ATOM 0 H LYS A 108 -38.739 -20.943 -22.685 1.00 0.00 H new ATOM 0 HA LYS A 108 -38.245 -20.155 -20.014 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -37.892 -18.489 -21.663 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -39.365 -18.880 -22.528 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -39.543 -17.782 -19.696 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -39.265 -16.680 -21.029 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -41.385 -18.524 -21.792 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -41.768 -17.866 -20.214 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -41.650 -15.587 -21.007 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -40.814 -16.054 -22.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -43.147 -15.596 -22.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -42.812 -17.233 -23.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -43.622 -16.780 -21.783 1.00 0.00 H new ATOM 1697 N ASP A 109 -41.360 -20.692 -20.712 1.00 0.00 N ATOM 1698 CA ASP A 109 -42.677 -20.800 -20.070 1.00 0.00 C ATOM 1699 C ASP A 109 -42.486 -21.546 -18.783 1.00 0.00 C ATOM 1700 O ASP A 109 -43.123 -21.274 -17.785 1.00 0.00 O ATOM 1701 CB ASP A 109 -43.614 -21.589 -20.999 1.00 0.00 C ATOM 1702 CG ASP A 109 -43.909 -20.749 -22.245 1.00 0.00 C ATOM 1703 OD1 ASP A 109 -42.957 -20.175 -22.750 1.00 0.00 O ATOM 1704 OD2 ASP A 109 -45.068 -20.729 -22.623 1.00 0.00 O ATOM 0 H ASP A 109 -41.302 -21.041 -21.669 1.00 0.00 H new ATOM 0 HA ASP A 109 -43.111 -19.819 -19.878 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -43.152 -22.534 -21.284 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -44.542 -21.831 -20.480 1.00 0.00 H new ATOM 1709 N LEU A 110 -41.593 -22.486 -18.840 1.00 0.00 N ATOM 1710 CA LEU A 110 -41.293 -23.295 -17.657 1.00 0.00 C ATOM 1711 C LEU A 110 -39.820 -23.673 -17.683 1.00 0.00 C ATOM 1712 O LEU A 110 -39.449 -24.740 -18.129 1.00 0.00 O ATOM 1713 CB LEU A 110 -42.140 -24.575 -17.701 1.00 0.00 C ATOM 1714 CG LEU A 110 -42.358 -24.971 -19.154 1.00 0.00 C ATOM 1715 CD1 LEU A 110 -42.245 -26.489 -19.287 1.00 0.00 C ATOM 1716 CD2 LEU A 110 -43.756 -24.527 -19.594 1.00 0.00 C ATOM 0 H LEU A 110 -41.055 -22.724 -19.673 1.00 0.00 H new ATOM 0 HA LEU A 110 -41.518 -22.733 -16.751 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -41.637 -25.378 -17.163 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -43.098 -24.411 -17.207 1.00 0.00 H new ATOM 0 HG LEU A 110 -41.606 -24.492 -19.781 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -42.401 -26.776 -20.327 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -41.254 -26.809 -18.967 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -43.000 -26.966 -18.662 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -43.917 -24.809 -20.635 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -44.505 -25.011 -18.967 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -43.843 -23.445 -19.494 1.00 0.00 H new ATOM 1728 N ALA A 111 -39.014 -22.776 -17.199 1.00 0.00 N ATOM 1729 CA ALA A 111 -37.550 -23.028 -17.169 1.00 0.00 C ATOM 1730 C ALA A 111 -37.101 -23.896 -15.966 1.00 0.00 C ATOM 1731 O ALA A 111 -36.139 -24.632 -16.063 1.00 0.00 O ATOM 1732 CB ALA A 111 -36.846 -21.667 -17.073 1.00 0.00 C ATOM 0 H ALA A 111 -39.307 -21.875 -16.821 1.00 0.00 H new ATOM 0 HA ALA A 111 -37.288 -23.576 -18.074 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -35.767 -21.817 -17.049 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -37.109 -21.059 -17.939 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -37.162 -21.157 -16.163 1.00 0.00 H new ATOM 1738 N PRO A 112 -37.806 -23.786 -14.850 1.00 0.00 N ATOM 1739 CA PRO A 112 -37.466 -24.560 -13.649 1.00 0.00 C ATOM 1740 C PRO A 112 -37.638 -26.062 -13.869 1.00 0.00 C ATOM 1741 O PRO A 112 -38.743 -26.565 -13.915 1.00 0.00 O ATOM 1742 CB PRO A 112 -38.461 -24.068 -12.573 1.00 0.00 C ATOM 1743 CG PRO A 112 -39.277 -22.898 -13.205 1.00 0.00 C ATOM 1744 CD PRO A 112 -38.967 -22.899 -14.710 1.00 0.00 C ATOM 0 HA PRO A 112 -36.423 -24.414 -13.368 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -39.123 -24.876 -12.262 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -37.930 -23.731 -11.683 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -40.344 -23.033 -13.031 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -38.999 -21.945 -12.754 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -39.816 -23.263 -15.289 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -38.744 -21.894 -15.069 1.00 0.00 H new ATOM 1752 N ALA A 113 -36.533 -26.751 -13.998 1.00 0.00 N ATOM 1753 CA ALA A 113 -36.604 -28.215 -14.215 1.00 0.00 C ATOM 1754 C ALA A 113 -36.854 -28.971 -12.901 1.00 0.00 C ATOM 1755 O ALA A 113 -37.697 -29.844 -12.840 1.00 0.00 O ATOM 1756 CB ALA A 113 -35.265 -28.682 -14.813 1.00 0.00 C ATOM 0 H ALA A 113 -35.592 -26.360 -13.962 1.00 0.00 H new ATOM 0 HA ALA A 113 -37.434 -28.427 -14.889 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -35.297 -29.759 -14.980 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -35.092 -28.172 -15.761 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -34.456 -28.446 -14.122 1.00 0.00 H new ATOM 1762 N PRO A 114 -36.106 -28.622 -11.871 1.00 0.00 N ATOM 1763 CA PRO A 114 -36.254 -29.270 -10.573 1.00 0.00 C ATOM 1764 C PRO A 114 -37.605 -28.949 -9.950 1.00 0.00 C ATOM 1765 O PRO A 114 -37.779 -27.794 -9.600 1.00 0.00 O ATOM 1766 CB PRO A 114 -35.124 -28.679 -9.701 1.00 0.00 C ATOM 1767 CG PRO A 114 -34.353 -27.646 -10.581 1.00 0.00 C ATOM 1768 CD PRO A 114 -35.072 -27.578 -11.938 1.00 0.00 C ATOM 1769 OXT PRO A 114 -38.394 -29.874 -9.862 1.00 0.00 O ATOM 0 HA PRO A 114 -36.197 -30.355 -10.661 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -35.535 -28.197 -8.814 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -34.454 -29.466 -9.355 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -34.341 -26.667 -10.103 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -33.314 -27.950 -10.711 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -35.513 -26.595 -12.103 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -34.381 -27.759 -12.761 1.00 0.00 H new TER 1777 PRO A 114