USER MOD reduce.3.24.130724 H: found=0, std=0, add=1043, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1045 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 13 SER OG : rot -100:sc= -0.139! USER MOD Set 1.2: A 153 LYS NZ :NH3+ -144:sc= -1.82! (180deg=-4.15!) USER MOD Set 2.1: A 146 GLN : amide:sc= 0.37 K(o=-2.7,f=-6.8) USER MOD Set 2.2: A 147 ASN :FLIP amide:sc= -3.05! C(o=-4.6!,f=-2.7!) USER MOD Set 3.1: A 16 MET CE :methyl 141:sc= -9.19! (180deg=-4.51!) USER MOD Set 3.2: A 111 SER OG : rot 101:sc= -6.95! USER MOD Set 3.3: A 144 THR OG1 : rot 4:sc= -4.92! USER MOD Set 4.1: A 47 TYR OH : rot 9:sc= 1.23 USER MOD Set 4.2: A 79 HIS : no HE2:sc= -3.13! C(o=-1.9!,f=-7.7!) USER MOD Set 5.1: A 51 SER OG : rot 61:sc= -2.67! USER MOD Set 5.2: A 84 THR OG1 : rot -130:sc= 1.08 USER MOD Set 5.3: A 95 SER OG : rot 130:sc= -7.47! USER MOD Set 6.1: A 8 SER OG : rot 180:sc= -0.0386 USER MOD Set 6.2: A 20 LYS NZ :NH3+ -174:sc= -0.303 (180deg=-0.376) USER MOD Single : A 3 HIS :FLIP no HD1:sc= -5.1! C(o=-8.7!,f=-5.1!) USER MOD Single : A 6 THR OG1 : rot 30:sc= 0.256 USER MOD Single : A 12 TYR OH : rot 12:sc= 1.11 USER MOD Single : A 17 GLN : amide:sc= -1.58 K(o=-1.6,f=-8!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0.107 USER MOD Single : A 22 GLN : amide:sc= -0.0161 X(o=-0.016,f=0.34) USER MOD Single : A 24 ASN : amide:sc= -0.0898 X(o=-0.09,f=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= -3.23! C(o=-3.2!,f=-11!) USER MOD Single : A 27 MET CE :methyl -146:sc= -1.81 (180deg=-2.65) USER MOD Single : A 30 THR OG1 : rot 140:sc= -6.91! USER MOD Single : A 34 ASN : amide:sc= -0.121 X(o=-0.12,f=-0.11) USER MOD Single : A 37 SER OG : rot 180:sc= -0.0083 USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.04) USER MOD Single : A 46 THR OG1 : rot -154:sc= -0.385 USER MOD Single : A 50 ASN : amide:sc= 0.0853 K(o=0.085,f=-12!) USER MOD Single : A 52 ASN : amide:sc= -1.16 K(o=-1.2,f=-2!) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.0242 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 ASN :FLIP amide:sc= -5.77! C(o=-6.8!,f=-5.8!) USER MOD Single : A 66 THR OG1 : rot 180:sc= -3.28! USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= -0.0117 USER MOD Single : A 71 THR OG1 : rot 170:sc=-0.00307 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= -0.439 X(o=-0.44,f=0) USER MOD Single : A 83 SER OG : rot -99:sc= -0.456 USER MOD Single : A 85 THR OG1 : rot 110:sc= -0.487 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 TYR OH : rot 127:sc= 1.62 USER MOD Single : A 90 GLN : amide:sc= -0.0706 X(o=-0.071,f=-0.5) USER MOD Single : A 92 GLN :FLIP amide:sc= -0.572 F(o=-3.1,f=-0.57) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 36:sc= 0.503 USER MOD Single : A 105 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 THR OG1 : rot 37:sc= 0.671 USER MOD Single : A 110 ASN : amide:sc= -3.34! C(o=-3.3!,f=-4.1!) USER MOD Single : A 112 ASN : amide:sc=-0.00986 X(o=-0.0099,f=-0.013) USER MOD Single : A 117 HIS :FLIP no HD1:sc= -5.38! C(o=-7.2!,f=-5.4!) USER MOD Single : A 122 TYR OH : rot 180:sc= -2.56! USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 ASN : amide:sc= -5.05! C(o=-5!,f=-6.8!) USER MOD Single : A 125 HIS : no HD1:sc= -0.0163 X(o=-0.016,f=-0.26) USER MOD Single : A 126 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 75:sc= 0.904 USER MOD Single : A 131 THR OG1 : rot -140:sc= -0.151 USER MOD Single : A 132 SER OG : rot 180:sc= -0.967 USER MOD Single : A 138 ASN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 139 MET CE :methyl -167:sc=-0.00049 (180deg=-0.172) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot -130:sc= 0 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 152 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 31 N HIS A 3 8.128 -2.549 17.794 1.00 0.00 N ATOM 32 CA HIS A 3 7.015 -3.295 17.216 1.00 0.00 C ATOM 33 C HIS A 3 5.685 -2.824 17.797 1.00 0.00 C ATOM 34 O HIS A 3 5.647 -2.162 18.834 1.00 0.00 O ATOM 35 CB HIS A 3 7.190 -4.794 17.469 1.00 0.00 C ATOM 36 CG HIS A 3 6.719 -5.231 18.821 1.00 0.00 C ATOM 37 ND1 HIS A 3 5.472 -5.299 19.345 1.00 0.00 N flip ATOM 38 CD2 HIS A 3 7.574 -5.666 19.813 1.00 0.00 C flip ATOM 39 CE1 HIS A 3 5.597 -5.768 20.629 1.00 0.00 C flip ATOM 40 NE2 HIS A 3 6.872 -5.983 20.887 1.00 0.00 N flip ATOM 0 HA HIS A 3 7.009 -3.113 16.141 1.00 0.00 H new ATOM 0 HB2 HIS A 3 6.644 -5.349 16.706 1.00 0.00 H new ATOM 0 HB3 HIS A 3 8.243 -5.052 17.359 1.00 0.00 H new ATOM 0 HD2 HIS A 3 8.648 -5.736 19.725 1.00 0.00 H new ATOM 0 HE1 HIS A 3 4.782 -5.934 21.318 1.00 0.00 H new ATOM 0 HE2 HIS A 3 7.252 -6.334 21.766 1.00 0.00 H new ATOM 49 N CYS A 4 4.596 -3.174 17.121 1.00 0.00 N ATOM 50 CA CYS A 4 3.262 -2.793 17.566 1.00 0.00 C ATOM 51 C CYS A 4 2.314 -3.985 17.512 1.00 0.00 C ATOM 52 O CYS A 4 2.550 -4.945 16.777 1.00 0.00 O ATOM 53 CB CYS A 4 2.717 -1.653 16.704 1.00 0.00 C ATOM 54 SG CYS A 4 3.870 -0.257 16.502 1.00 0.00 S ATOM 0 H CYS A 4 4.612 -3.722 16.261 1.00 0.00 H new ATOM 0 HA CYS A 4 3.334 -2.452 18.599 1.00 0.00 H new ATOM 0 HB2 CYS A 4 2.463 -2.046 15.720 1.00 0.00 H new ATOM 0 HB3 CYS A 4 1.792 -1.285 17.149 1.00 0.00 H new ATOM 59 N VAL A 5 1.243 -3.922 18.295 1.00 0.00 N ATOM 60 CA VAL A 5 0.263 -5.000 18.333 1.00 0.00 C ATOM 61 C VAL A 5 -1.141 -4.484 18.038 1.00 0.00 C ATOM 62 O VAL A 5 -1.557 -3.453 18.566 1.00 0.00 O ATOM 63 CB VAL A 5 0.259 -5.706 19.702 1.00 0.00 C ATOM 64 CG1 VAL A 5 -0.878 -6.714 19.780 1.00 0.00 C ATOM 65 CG2 VAL A 5 1.598 -6.379 19.961 1.00 0.00 C ATOM 0 H VAL A 5 1.032 -3.137 18.911 1.00 0.00 H new ATOM 0 HA VAL A 5 0.552 -5.714 17.562 1.00 0.00 H new ATOM 0 HB VAL A 5 0.101 -4.955 20.476 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -0.865 -7.203 20.754 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -1.830 -6.200 19.645 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -0.755 -7.462 18.997 1.00 0.00 H new ATOM 0 HG21 VAL A 5 1.575 -6.872 20.933 1.00 0.00 H new ATOM 0 HG22 VAL A 5 1.790 -7.118 19.183 1.00 0.00 H new ATOM 0 HG23 VAL A 5 2.389 -5.630 19.953 1.00 0.00 H new ATOM 75 N THR A 6 -1.867 -5.210 17.194 1.00 0.00 N ATOM 76 CA THR A 6 -3.226 -4.825 16.833 1.00 0.00 C ATOM 77 C THR A 6 -4.249 -5.700 17.547 1.00 0.00 C ATOM 78 O THR A 6 -4.027 -6.897 17.739 1.00 0.00 O ATOM 79 CB THR A 6 -3.461 -4.920 15.315 1.00 0.00 C ATOM 80 OG1 THR A 6 -4.859 -4.798 15.027 1.00 0.00 O ATOM 81 CG2 THR A 6 -2.940 -6.237 14.764 1.00 0.00 C ATOM 0 H THR A 6 -1.538 -6.066 16.748 1.00 0.00 H new ATOM 0 HA THR A 6 -3.351 -3.788 17.144 1.00 0.00 H new ATOM 0 HB THR A 6 -2.917 -4.105 14.837 1.00 0.00 H new ATOM 0 HG1 THR A 6 -5.286 -4.241 15.711 1.00 0.00 H new ATOM 0 HG21 THR A 6 -3.119 -6.278 13.690 1.00 0.00 H new ATOM 0 HG22 THR A 6 -1.870 -6.314 14.957 1.00 0.00 H new ATOM 0 HG23 THR A 6 -3.457 -7.065 15.250 1.00 0.00 H new ATOM 89 N ASP A 7 -5.366 -5.090 17.936 1.00 0.00 N ATOM 90 CA ASP A 7 -6.433 -5.801 18.632 1.00 0.00 C ATOM 91 C ASP A 7 -6.640 -7.192 18.046 1.00 0.00 C ATOM 92 O ASP A 7 -7.059 -8.114 18.746 1.00 0.00 O ATOM 93 CB ASP A 7 -7.737 -5.005 18.556 1.00 0.00 C ATOM 94 CG ASP A 7 -8.045 -4.530 17.151 1.00 0.00 C ATOM 95 OD1 ASP A 7 -7.090 -4.315 16.375 1.00 0.00 O ATOM 96 OD2 ASP A 7 -9.240 -4.373 16.824 1.00 0.00 O ATOM 0 H ASP A 7 -5.555 -4.100 17.780 1.00 0.00 H new ATOM 0 HA ASP A 7 -6.139 -5.909 19.676 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -8.559 -5.625 18.915 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -7.673 -4.144 19.221 1.00 0.00 H new ATOM 101 N SER A 8 -6.339 -7.340 16.760 1.00 0.00 N ATOM 102 CA SER A 8 -6.489 -8.624 16.087 1.00 0.00 C ATOM 103 C SER A 8 -5.682 -9.699 16.805 1.00 0.00 C ATOM 104 O SER A 8 -5.903 -10.894 16.608 1.00 0.00 O ATOM 105 CB SER A 8 -6.038 -8.517 14.629 1.00 0.00 C ATOM 106 OG SER A 8 -4.741 -9.060 14.454 1.00 0.00 O ATOM 0 H SER A 8 -5.991 -6.588 16.165 1.00 0.00 H new ATOM 0 HA SER A 8 -7.542 -8.903 16.110 1.00 0.00 H new ATOM 0 HB2 SER A 8 -6.745 -9.043 13.987 1.00 0.00 H new ATOM 0 HB3 SER A 8 -6.043 -7.472 14.320 1.00 0.00 H new ATOM 0 HG SER A 8 -4.477 -8.981 13.513 1.00 0.00 H new ATOM 112 N GLY A 9 -4.746 -9.260 17.639 1.00 0.00 N ATOM 113 CA GLY A 9 -3.915 -10.185 18.380 1.00 0.00 C ATOM 114 C GLY A 9 -2.591 -10.447 17.694 1.00 0.00 C ATOM 115 O GLY A 9 -2.023 -11.532 17.824 1.00 0.00 O ATOM 0 H GLY A 9 -4.549 -8.275 17.814 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -3.732 -9.786 19.378 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -4.448 -11.127 18.507 1.00 0.00 H new ATOM 119 N VAL A 10 -2.097 -9.457 16.955 1.00 0.00 N ATOM 120 CA VAL A 10 -0.831 -9.605 16.247 1.00 0.00 C ATOM 121 C VAL A 10 0.210 -8.606 16.747 1.00 0.00 C ATOM 122 O VAL A 10 -0.098 -7.722 17.545 1.00 0.00 O ATOM 123 CB VAL A 10 -1.029 -9.451 14.721 1.00 0.00 C ATOM 124 CG1 VAL A 10 -0.835 -8.014 14.270 1.00 0.00 C ATOM 125 CG2 VAL A 10 -0.095 -10.383 13.963 1.00 0.00 C ATOM 0 H VAL A 10 -2.550 -8.552 16.832 1.00 0.00 H new ATOM 0 HA VAL A 10 -0.461 -10.610 16.451 1.00 0.00 H new ATOM 0 HB VAL A 10 -2.058 -9.728 14.494 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -0.983 -7.948 13.192 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.558 -7.373 14.775 1.00 0.00 H new ATOM 0 HG13 VAL A 10 0.175 -7.688 14.519 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -0.249 -10.260 12.891 1.00 0.00 H new ATOM 0 HG22 VAL A 10 0.939 -10.142 14.211 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -0.305 -11.415 14.244 1.00 0.00 H new ATOM 135 N VAL A 11 1.442 -8.756 16.269 1.00 0.00 N ATOM 136 CA VAL A 11 2.530 -7.870 16.664 1.00 0.00 C ATOM 137 C VAL A 11 3.388 -7.484 15.464 1.00 0.00 C ATOM 138 O VAL A 11 4.394 -8.131 15.174 1.00 0.00 O ATOM 139 CB VAL A 11 3.429 -8.522 17.730 1.00 0.00 C ATOM 140 CG1 VAL A 11 4.630 -7.637 18.031 1.00 0.00 C ATOM 141 CG2 VAL A 11 2.637 -8.808 18.996 1.00 0.00 C ATOM 0 H VAL A 11 1.711 -9.484 15.607 1.00 0.00 H new ATOM 0 HA VAL A 11 2.070 -6.976 17.084 1.00 0.00 H new ATOM 0 HB VAL A 11 3.796 -9.471 17.338 1.00 0.00 H new ATOM 0 HG11 VAL A 11 5.254 -8.115 18.787 1.00 0.00 H new ATOM 0 HG12 VAL A 11 5.211 -7.490 17.121 1.00 0.00 H new ATOM 0 HG13 VAL A 11 4.287 -6.671 18.402 1.00 0.00 H new ATOM 0 HG21 VAL A 11 3.290 -9.269 19.737 1.00 0.00 H new ATOM 0 HG22 VAL A 11 2.238 -7.875 19.394 1.00 0.00 H new ATOM 0 HG23 VAL A 11 1.815 -9.486 18.766 1.00 0.00 H new ATOM 151 N TYR A 12 2.983 -6.427 14.767 1.00 0.00 N ATOM 152 CA TYR A 12 3.716 -5.957 13.598 1.00 0.00 C ATOM 153 C TYR A 12 4.972 -5.198 14.012 1.00 0.00 C ATOM 154 O TYR A 12 4.922 -4.313 14.865 1.00 0.00 O ATOM 155 CB TYR A 12 2.824 -5.063 12.736 1.00 0.00 C ATOM 156 CG TYR A 12 1.695 -5.808 12.058 1.00 0.00 C ATOM 157 CD1 TYR A 12 1.923 -6.558 10.911 1.00 0.00 C ATOM 158 CD2 TYR A 12 0.404 -5.760 12.566 1.00 0.00 C ATOM 159 CE1 TYR A 12 0.894 -7.239 10.289 1.00 0.00 C ATOM 160 CE2 TYR A 12 -0.630 -6.439 11.949 1.00 0.00 C ATOM 161 CZ TYR A 12 -0.380 -7.177 10.812 1.00 0.00 C ATOM 162 OH TYR A 12 -1.407 -7.855 10.196 1.00 0.00 O ATOM 0 H TYR A 12 2.152 -5.880 14.992 1.00 0.00 H new ATOM 0 HA TYR A 12 4.017 -6.827 13.014 1.00 0.00 H new ATOM 0 HB2 TYR A 12 2.404 -4.273 13.359 1.00 0.00 H new ATOM 0 HB3 TYR A 12 3.436 -4.578 11.976 1.00 0.00 H new ATOM 0 HD1 TYR A 12 2.920 -6.610 10.499 1.00 0.00 H new ATOM 0 HD2 TYR A 12 0.204 -5.183 13.457 1.00 0.00 H new ATOM 0 HE1 TYR A 12 1.087 -7.817 9.397 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -1.629 -6.391 12.356 1.00 0.00 H new ATOM 0 HH TYR A 12 -1.038 -8.473 9.530 1.00 0.00 H new ATOM 172 N SER A 13 6.098 -5.554 13.403 1.00 0.00 N ATOM 173 CA SER A 13 7.372 -4.911 13.709 1.00 0.00 C ATOM 174 C SER A 13 7.417 -3.490 13.159 1.00 0.00 C ATOM 175 O SER A 13 6.908 -3.215 12.073 1.00 0.00 O ATOM 176 CB SER A 13 8.529 -5.729 13.132 1.00 0.00 C ATOM 177 OG SER A 13 9.438 -6.114 14.148 1.00 0.00 O ATOM 0 H SER A 13 6.155 -6.285 12.694 1.00 0.00 H new ATOM 0 HA SER A 13 7.472 -4.862 14.793 1.00 0.00 H new ATOM 0 HB2 SER A 13 8.138 -6.616 12.634 1.00 0.00 H new ATOM 0 HB3 SER A 13 9.051 -5.143 12.376 1.00 0.00 H new ATOM 0 HG SER A 13 10.213 -5.514 14.138 1.00 0.00 H new ATOM 183 N VAL A 14 8.038 -2.595 13.919 1.00 0.00 N ATOM 184 CA VAL A 14 8.167 -1.200 13.520 1.00 0.00 C ATOM 185 C VAL A 14 8.437 -1.079 12.024 1.00 0.00 C ATOM 186 O VAL A 14 8.800 -2.055 11.369 1.00 0.00 O ATOM 187 CB VAL A 14 9.305 -0.512 14.295 1.00 0.00 C ATOM 188 CG1 VAL A 14 10.526 -1.416 14.338 1.00 0.00 C ATOM 189 CG2 VAL A 14 9.648 0.835 13.677 1.00 0.00 C ATOM 0 H VAL A 14 8.462 -2.814 14.820 1.00 0.00 H new ATOM 0 HA VAL A 14 7.223 -0.708 13.752 1.00 0.00 H new ATOM 0 HB VAL A 14 8.970 -0.331 15.316 1.00 0.00 H new ATOM 0 HG11 VAL A 14 11.326 -0.921 14.888 1.00 0.00 H new ATOM 0 HG12 VAL A 14 10.269 -2.351 14.835 1.00 0.00 H new ATOM 0 HG13 VAL A 14 10.860 -1.625 13.322 1.00 0.00 H new ATOM 0 HG21 VAL A 14 10.455 1.300 14.243 1.00 0.00 H new ATOM 0 HG22 VAL A 14 9.966 0.691 12.644 1.00 0.00 H new ATOM 0 HG23 VAL A 14 8.770 1.480 13.700 1.00 0.00 H new ATOM 199 N GLY A 15 8.256 0.123 11.488 1.00 0.00 N ATOM 200 CA GLY A 15 8.483 0.343 10.073 1.00 0.00 C ATOM 201 C GLY A 15 7.819 -0.716 9.218 1.00 0.00 C ATOM 202 O GLY A 15 8.386 -1.167 8.223 1.00 0.00 O ATOM 0 H GLY A 15 7.956 0.948 12.008 1.00 0.00 H new ATOM 0 HA2 GLY A 15 8.102 1.325 9.794 1.00 0.00 H new ATOM 0 HA3 GLY A 15 9.555 0.349 9.875 1.00 0.00 H new ATOM 206 N MET A 16 6.614 -1.117 9.611 1.00 0.00 N ATOM 207 CA MET A 16 5.872 -2.136 8.875 1.00 0.00 C ATOM 208 C MET A 16 4.384 -1.804 8.828 1.00 0.00 C ATOM 209 O MET A 16 3.782 -1.460 9.844 1.00 0.00 O ATOM 210 CB MET A 16 6.078 -3.509 9.520 1.00 0.00 C ATOM 211 CG MET A 16 5.544 -4.659 8.682 1.00 0.00 C ATOM 212 SD MET A 16 5.243 -6.147 9.656 1.00 0.00 S ATOM 213 CE MET A 16 6.717 -7.095 9.290 1.00 0.00 C ATOM 0 H MET A 16 6.131 -0.753 10.433 1.00 0.00 H new ATOM 0 HA MET A 16 6.252 -2.158 7.854 1.00 0.00 H new ATOM 0 HB2 MET A 16 7.143 -3.662 9.697 1.00 0.00 H new ATOM 0 HB3 MET A 16 5.588 -3.521 10.494 1.00 0.00 H new ATOM 0 HG2 MET A 16 4.616 -4.352 8.199 1.00 0.00 H new ATOM 0 HG3 MET A 16 6.256 -4.887 7.889 1.00 0.00 H new ATOM 0 HE1 MET A 16 7.054 -7.607 10.192 1.00 0.00 H new ATOM 0 HE2 MET A 16 6.494 -7.830 8.517 1.00 0.00 H new ATOM 0 HE3 MET A 16 7.502 -6.426 8.938 1.00 0.00 H new ATOM 223 N GLN A 17 3.799 -1.909 7.640 1.00 0.00 N ATOM 224 CA GLN A 17 2.381 -1.620 7.457 1.00 0.00 C ATOM 225 C GLN A 17 1.552 -2.899 7.483 1.00 0.00 C ATOM 226 O GLN A 17 2.095 -4.005 7.441 1.00 0.00 O ATOM 227 CB GLN A 17 2.156 -0.880 6.137 1.00 0.00 C ATOM 228 CG GLN A 17 3.372 -0.100 5.662 1.00 0.00 C ATOM 229 CD GLN A 17 3.127 0.621 4.351 1.00 0.00 C ATOM 230 OE1 GLN A 17 2.289 0.208 3.549 1.00 0.00 O ATOM 231 NE2 GLN A 17 3.858 1.706 4.127 1.00 0.00 N ATOM 0 H GLN A 17 4.285 -2.192 6.789 1.00 0.00 H new ATOM 0 HA GLN A 17 2.059 -0.986 8.283 1.00 0.00 H new ATOM 0 HB2 GLN A 17 1.874 -1.601 5.369 1.00 0.00 H new ATOM 0 HB3 GLN A 17 1.317 -0.194 6.253 1.00 0.00 H new ATOM 0 HG2 GLN A 17 3.654 0.626 6.425 1.00 0.00 H new ATOM 0 HG3 GLN A 17 4.214 -0.782 5.545 1.00 0.00 H new ATOM 0 HE21 GLN A 17 4.541 2.013 4.820 1.00 0.00 H new ATOM 0 HE22 GLN A 17 3.736 2.233 3.262 1.00 0.00 H new ATOM 240 N TRP A 18 0.234 -2.742 7.550 1.00 0.00 N ATOM 241 CA TRP A 18 -0.673 -3.883 7.581 1.00 0.00 C ATOM 242 C TRP A 18 -2.125 -3.419 7.650 1.00 0.00 C ATOM 243 O TRP A 18 -2.521 -2.718 8.581 1.00 0.00 O ATOM 244 CB TRP A 18 -0.355 -4.783 8.776 1.00 0.00 C ATOM 245 CG TRP A 18 -0.947 -4.296 10.064 1.00 0.00 C ATOM 246 CD1 TRP A 18 -2.211 -4.528 10.524 1.00 0.00 C ATOM 247 CD2 TRP A 18 -0.298 -3.493 11.058 1.00 0.00 C ATOM 248 NE1 TRP A 18 -2.388 -3.920 11.743 1.00 0.00 N ATOM 249 CE2 TRP A 18 -1.229 -3.279 12.093 1.00 0.00 C ATOM 250 CE3 TRP A 18 0.978 -2.937 11.173 1.00 0.00 C ATOM 251 CZ2 TRP A 18 -0.922 -2.532 13.226 1.00 0.00 C ATOM 252 CZ3 TRP A 18 1.281 -2.195 12.300 1.00 0.00 C ATOM 253 CH2 TRP A 18 0.335 -1.999 13.313 1.00 0.00 C ATOM 0 H TRP A 18 -0.230 -1.834 7.584 1.00 0.00 H new ATOM 0 HA TRP A 18 -0.534 -4.452 6.662 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -0.724 -5.788 8.572 1.00 0.00 H new ATOM 0 HB3 TRP A 18 0.727 -4.857 8.887 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -2.962 -5.105 10.005 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -3.244 -3.942 12.298 1.00 0.00 H new ATOM 0 HE3 TRP A 18 1.714 -3.084 10.397 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -1.650 -2.378 14.009 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 2.264 -1.759 12.400 1.00 0.00 H new ATOM 0 HH2 TRP A 18 0.603 -1.415 14.181 1.00 0.00 H new ATOM 264 N LEU A 19 -2.915 -3.817 6.657 1.00 0.00 N ATOM 265 CA LEU A 19 -4.323 -3.443 6.603 1.00 0.00 C ATOM 266 C LEU A 19 -5.109 -4.118 7.722 1.00 0.00 C ATOM 267 O LEU A 19 -4.797 -5.238 8.126 1.00 0.00 O ATOM 268 CB LEU A 19 -4.920 -3.819 5.246 1.00 0.00 C ATOM 269 CG LEU A 19 -5.476 -2.647 4.436 1.00 0.00 C ATOM 270 CD1 LEU A 19 -4.350 -1.733 3.979 1.00 0.00 C ATOM 271 CD2 LEU A 19 -6.274 -3.153 3.243 1.00 0.00 C ATOM 0 H LEU A 19 -2.603 -4.398 5.879 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.392 -2.363 6.736 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -4.153 -4.318 4.654 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -5.720 -4.542 5.406 1.00 0.00 H new ATOM 0 HG LEU A 19 -6.145 -2.072 5.076 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.764 -0.905 3.404 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -3.822 -1.343 4.849 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.655 -2.296 3.356 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -6.662 -2.305 2.679 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -5.628 -3.752 2.601 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -7.105 -3.765 3.594 1.00 0.00 H new ATOM 283 N LYS A 20 -6.131 -3.428 8.220 1.00 0.00 N ATOM 284 CA LYS A 20 -6.963 -3.960 9.293 1.00 0.00 C ATOM 285 C LYS A 20 -8.443 -3.769 8.979 1.00 0.00 C ATOM 286 O LYS A 20 -8.967 -2.659 9.063 1.00 0.00 O ATOM 287 CB LYS A 20 -6.619 -3.279 10.619 1.00 0.00 C ATOM 288 CG LYS A 20 -5.264 -3.683 11.176 1.00 0.00 C ATOM 289 CD LYS A 20 -5.093 -5.193 11.189 1.00 0.00 C ATOM 290 CE LYS A 20 -6.170 -5.869 12.022 1.00 0.00 C ATOM 291 NZ LYS A 20 -6.258 -7.328 11.740 1.00 0.00 N ATOM 0 H LYS A 20 -6.402 -2.499 7.897 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.763 -5.028 9.379 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -6.637 -2.198 10.478 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -7.390 -3.518 11.352 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -4.474 -3.232 10.576 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -5.156 -3.295 12.189 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -5.129 -5.573 10.168 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -4.111 -5.445 11.588 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.959 -5.716 13.080 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.133 -5.401 11.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -7.069 -7.732 12.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -6.383 -7.477 10.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -5.383 -7.796 12.053 1.00 0.00 H new ATOM 305 N THR A 21 -9.111 -4.860 8.617 1.00 0.00 N ATOM 306 CA THR A 21 -10.531 -4.813 8.292 1.00 0.00 C ATOM 307 C THR A 21 -11.380 -4.680 9.551 1.00 0.00 C ATOM 308 O THR A 21 -12.099 -5.605 9.928 1.00 0.00 O ATOM 309 CB THR A 21 -10.972 -6.070 7.519 1.00 0.00 C ATOM 310 OG1 THR A 21 -9.829 -6.866 7.184 1.00 0.00 O ATOM 311 CG2 THR A 21 -11.722 -5.692 6.251 1.00 0.00 C ATOM 0 H THR A 21 -8.691 -5.787 8.542 1.00 0.00 H new ATOM 0 HA THR A 21 -10.682 -3.936 7.662 1.00 0.00 H new ATOM 0 HB THR A 21 -11.641 -6.646 8.159 1.00 0.00 H new ATOM 0 HG1 THR A 21 -10.118 -7.664 6.694 1.00 0.00 H new ATOM 0 HG21 THR A 21 -12.023 -6.597 5.723 1.00 0.00 H new ATOM 0 HG22 THR A 21 -12.608 -5.112 6.511 1.00 0.00 H new ATOM 0 HG23 THR A 21 -11.074 -5.096 5.609 1.00 0.00 H new ATOM 319 N GLN A 22 -11.292 -3.522 10.197 1.00 0.00 N ATOM 320 CA GLN A 22 -12.053 -3.267 11.414 1.00 0.00 C ATOM 321 C GLN A 22 -13.503 -2.925 11.089 1.00 0.00 C ATOM 322 O GLN A 22 -13.862 -1.754 10.968 1.00 0.00 O ATOM 323 CB GLN A 22 -11.414 -2.128 12.211 1.00 0.00 C ATOM 324 CG GLN A 22 -12.010 -1.946 13.598 1.00 0.00 C ATOM 325 CD GLN A 22 -12.385 -0.505 13.887 1.00 0.00 C ATOM 326 OE1 GLN A 22 -13.040 0.153 13.077 1.00 0.00 O ATOM 327 NE2 GLN A 22 -11.969 -0.007 15.045 1.00 0.00 N ATOM 0 H GLN A 22 -10.702 -2.746 9.898 1.00 0.00 H new ATOM 0 HA GLN A 22 -12.040 -4.175 12.017 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -10.345 -2.318 12.306 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -11.524 -1.198 11.652 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -12.895 -2.574 13.694 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -11.294 -2.288 14.345 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -11.429 -0.589 15.686 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -12.190 0.957 15.294 1.00 0.00 H new ATOM 336 N GLY A 23 -14.331 -3.954 10.948 1.00 0.00 N ATOM 337 CA GLY A 23 -15.733 -3.740 10.637 1.00 0.00 C ATOM 338 C GLY A 23 -16.083 -4.160 9.223 1.00 0.00 C ATOM 339 O GLY A 23 -16.501 -5.294 8.991 1.00 0.00 O ATOM 0 H GLY A 23 -14.057 -4.932 11.043 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -16.348 -4.300 11.342 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -15.975 -2.686 10.770 1.00 0.00 H new ATOM 343 N ASN A 24 -15.915 -3.242 8.277 1.00 0.00 N ATOM 344 CA ASN A 24 -16.216 -3.521 6.879 1.00 0.00 C ATOM 345 C ASN A 24 -15.201 -2.851 5.958 1.00 0.00 C ATOM 346 O ASN A 24 -15.424 -2.731 4.754 1.00 0.00 O ATOM 347 CB ASN A 24 -17.628 -3.042 6.533 1.00 0.00 C ATOM 348 CG ASN A 24 -18.114 -1.953 7.470 1.00 0.00 C ATOM 349 OD1 ASN A 24 -17.975 -0.764 7.181 1.00 0.00 O ATOM 350 ND2 ASN A 24 -18.686 -2.354 8.599 1.00 0.00 N ATOM 0 H ASN A 24 -15.572 -2.298 8.454 1.00 0.00 H new ATOM 0 HA ASN A 24 -16.158 -4.599 6.731 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -17.642 -2.669 5.509 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -18.316 -3.887 6.574 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -19.031 -1.666 9.268 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -18.780 -3.350 8.797 1.00 0.00 H new ATOM 357 N LYS A 25 -14.084 -2.417 6.534 1.00 0.00 N ATOM 358 CA LYS A 25 -13.034 -1.760 5.765 1.00 0.00 C ATOM 359 C LYS A 25 -11.671 -1.966 6.418 1.00 0.00 C ATOM 360 O LYS A 25 -11.562 -2.031 7.642 1.00 0.00 O ATOM 361 CB LYS A 25 -13.329 -0.265 5.634 1.00 0.00 C ATOM 362 CG LYS A 25 -14.717 0.037 5.091 1.00 0.00 C ATOM 363 CD LYS A 25 -15.043 1.519 5.186 1.00 0.00 C ATOM 364 CE LYS A 25 -16.338 1.851 4.463 1.00 0.00 C ATOM 365 NZ LYS A 25 -16.346 3.248 3.952 1.00 0.00 N ATOM 0 H LYS A 25 -13.883 -2.509 7.530 1.00 0.00 H new ATOM 0 HA LYS A 25 -13.012 -2.208 4.771 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.220 0.205 6.611 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.585 0.187 4.978 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -14.780 -0.284 4.051 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -15.459 -0.536 5.647 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -15.125 1.808 6.234 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -14.226 2.101 4.758 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -16.477 1.160 3.632 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -17.179 1.708 5.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -17.246 3.435 3.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -16.239 3.909 4.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -15.559 3.378 3.285 1.00 0.00 H new ATOM 379 N GLN A 26 -10.635 -2.067 5.593 1.00 0.00 N ATOM 380 CA GLN A 26 -9.278 -2.266 6.090 1.00 0.00 C ATOM 381 C GLN A 26 -8.612 -0.929 6.402 1.00 0.00 C ATOM 382 O GLN A 26 -8.684 0.011 5.611 1.00 0.00 O ATOM 383 CB GLN A 26 -8.444 -3.037 5.066 1.00 0.00 C ATOM 384 CG GLN A 26 -9.103 -4.321 4.588 1.00 0.00 C ATOM 385 CD GLN A 26 -9.438 -4.289 3.110 1.00 0.00 C ATOM 386 OE1 GLN A 26 -8.773 -3.613 2.325 1.00 0.00 O ATOM 387 NE2 GLN A 26 -10.475 -5.023 2.722 1.00 0.00 N ATOM 0 H GLN A 26 -10.708 -2.014 4.577 1.00 0.00 H new ATOM 0 HA GLN A 26 -9.337 -2.847 7.011 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -8.254 -2.394 4.207 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -7.476 -3.277 5.505 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -8.439 -5.162 4.788 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -10.015 -4.492 5.160 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -10.998 -5.568 3.407 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -10.748 -5.041 1.739 1.00 0.00 H new ATOM 396 N MET A 27 -7.965 -0.853 7.561 1.00 0.00 N ATOM 397 CA MET A 27 -7.287 0.370 7.978 1.00 0.00 C ATOM 398 C MET A 27 -5.778 0.243 7.795 1.00 0.00 C ATOM 399 O MET A 27 -5.144 -0.639 8.375 1.00 0.00 O ATOM 400 CB MET A 27 -7.611 0.685 9.439 1.00 0.00 C ATOM 401 CG MET A 27 -8.984 1.304 9.638 1.00 0.00 C ATOM 402 SD MET A 27 -8.968 2.666 10.819 1.00 0.00 S ATOM 403 CE MET A 27 -7.825 3.792 10.022 1.00 0.00 C ATOM 0 H MET A 27 -7.896 -1.622 8.227 1.00 0.00 H new ATOM 0 HA MET A 27 -7.644 1.187 7.351 1.00 0.00 H new ATOM 0 HB2 MET A 27 -7.548 -0.233 10.023 1.00 0.00 H new ATOM 0 HB3 MET A 27 -6.855 1.365 9.832 1.00 0.00 H new ATOM 0 HG2 MET A 27 -9.358 1.664 8.680 1.00 0.00 H new ATOM 0 HG3 MET A 27 -9.677 0.537 9.983 1.00 0.00 H new ATOM 0 HE1 MET A 27 -7.252 4.326 10.780 1.00 0.00 H new ATOM 0 HE2 MET A 27 -7.145 3.228 9.383 1.00 0.00 H new ATOM 0 HE3 MET A 27 -8.382 4.508 9.417 1.00 0.00 H new ATOM 413 N LEU A 28 -5.208 1.130 6.986 1.00 0.00 N ATOM 414 CA LEU A 28 -3.773 1.117 6.727 1.00 0.00 C ATOM 415 C LEU A 28 -2.990 1.477 7.985 1.00 0.00 C ATOM 416 O LEU A 28 -2.706 2.648 8.238 1.00 0.00 O ATOM 417 CB LEU A 28 -3.428 2.093 5.600 1.00 0.00 C ATOM 418 CG LEU A 28 -2.220 1.697 4.749 1.00 0.00 C ATOM 419 CD1 LEU A 28 -2.537 0.468 3.911 1.00 0.00 C ATOM 420 CD2 LEU A 28 -1.792 2.856 3.862 1.00 0.00 C ATOM 0 H LEU A 28 -5.718 1.867 6.499 1.00 0.00 H new ATOM 0 HA LEU A 28 -3.493 0.108 6.423 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -4.296 2.193 4.948 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -3.241 3.075 6.035 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.393 1.452 5.416 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.666 0.201 3.312 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -2.795 -0.363 4.567 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.378 0.684 3.252 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.931 2.557 3.263 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.615 3.133 3.202 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -1.523 3.710 4.484 1.00 0.00 H new ATOM 432 N CYS A 29 -2.645 0.463 8.772 1.00 0.00 N ATOM 433 CA CYS A 29 -1.895 0.673 10.005 1.00 0.00 C ATOM 434 C CYS A 29 -0.457 0.188 9.854 1.00 0.00 C ATOM 435 O CYS A 29 -0.210 -0.900 9.336 1.00 0.00 O ATOM 436 CB CYS A 29 -2.573 -0.054 11.168 1.00 0.00 C ATOM 437 SG CYS A 29 -4.281 0.489 11.491 1.00 0.00 S ATOM 0 H CYS A 29 -2.873 -0.512 8.578 1.00 0.00 H new ATOM 0 HA CYS A 29 -1.878 1.742 10.215 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -2.577 -1.124 10.961 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -1.979 0.094 12.070 1.00 0.00 H new ATOM 442 N THR A 30 0.489 1.002 10.312 1.00 0.00 N ATOM 443 CA THR A 30 1.902 0.654 10.227 1.00 0.00 C ATOM 444 C THR A 30 2.629 0.971 11.526 1.00 0.00 C ATOM 445 O THR A 30 2.453 2.045 12.102 1.00 0.00 O ATOM 446 CB THR A 30 2.601 1.403 9.078 1.00 0.00 C ATOM 447 OG1 THR A 30 2.001 1.058 7.823 1.00 0.00 O ATOM 448 CG2 THR A 30 4.087 1.075 9.044 1.00 0.00 C ATOM 0 H THR A 30 0.302 1.906 10.745 1.00 0.00 H new ATOM 0 HA THR A 30 1.945 -0.418 10.037 1.00 0.00 H new ATOM 0 HB THR A 30 2.483 2.473 9.250 1.00 0.00 H new ATOM 0 HG1 THR A 30 1.931 1.859 7.263 1.00 0.00 H new ATOM 0 HG21 THR A 30 4.560 1.615 8.224 1.00 0.00 H new ATOM 0 HG22 THR A 30 4.547 1.371 9.987 1.00 0.00 H new ATOM 0 HG23 THR A 30 4.220 0.003 8.896 1.00 0.00 H new ATOM 456 N CYS A 31 3.460 0.037 11.974 1.00 0.00 N ATOM 457 CA CYS A 31 4.227 0.227 13.197 1.00 0.00 C ATOM 458 C CYS A 31 5.399 1.164 12.941 1.00 0.00 C ATOM 459 O CYS A 31 6.070 1.062 11.914 1.00 0.00 O ATOM 460 CB CYS A 31 4.735 -1.115 13.724 1.00 0.00 C ATOM 461 SG CYS A 31 5.397 -1.044 15.421 1.00 0.00 S ATOM 0 H CYS A 31 3.619 -0.857 11.509 1.00 0.00 H new ATOM 0 HA CYS A 31 3.575 0.672 13.949 1.00 0.00 H new ATOM 0 HB2 CYS A 31 3.920 -1.838 13.693 1.00 0.00 H new ATOM 0 HB3 CYS A 31 5.514 -1.484 13.057 1.00 0.00 H new ATOM 466 N LEU A 32 5.638 2.080 13.872 1.00 0.00 N ATOM 467 CA LEU A 32 6.728 3.037 13.736 1.00 0.00 C ATOM 468 C LEU A 32 7.420 3.270 15.075 1.00 0.00 C ATOM 469 O LEU A 32 7.509 4.402 15.552 1.00 0.00 O ATOM 470 CB LEU A 32 6.203 4.361 13.179 1.00 0.00 C ATOM 471 CG LEU A 32 5.617 4.283 11.767 1.00 0.00 C ATOM 472 CD1 LEU A 32 4.205 4.849 11.743 1.00 0.00 C ATOM 473 CD2 LEU A 32 6.507 5.022 10.779 1.00 0.00 C ATOM 0 H LEU A 32 5.092 2.180 14.728 1.00 0.00 H new ATOM 0 HA LEU A 32 7.458 2.623 13.041 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.437 4.743 13.853 1.00 0.00 H new ATOM 0 HB3 LEU A 32 7.017 5.086 13.179 1.00 0.00 H new ATOM 0 HG LEU A 32 5.571 3.235 11.470 1.00 0.00 H new ATOM 0 HD11 LEU A 32 3.805 4.785 10.731 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.572 4.276 12.421 1.00 0.00 H new ATOM 0 HD13 LEU A 32 4.226 5.892 12.060 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.075 4.956 9.780 1.00 0.00 H new ATOM 0 HD22 LEU A 32 6.585 6.069 11.072 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.499 4.571 10.775 1.00 0.00 H new ATOM 485 N GLY A 33 7.909 2.191 15.677 1.00 0.00 N ATOM 486 CA GLY A 33 8.587 2.298 16.956 1.00 0.00 C ATOM 487 C GLY A 33 7.657 2.057 18.127 1.00 0.00 C ATOM 488 O GLY A 33 7.607 0.955 18.673 1.00 0.00 O ATOM 0 H GLY A 33 7.848 1.244 15.302 1.00 0.00 H new ATOM 0 HA2 GLY A 33 9.405 1.578 16.991 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.031 3.289 17.047 1.00 0.00 H new ATOM 492 N ASN A 34 6.918 3.091 18.516 1.00 0.00 N ATOM 493 CA ASN A 34 5.985 2.987 19.631 1.00 0.00 C ATOM 494 C ASN A 34 4.647 3.631 19.285 1.00 0.00 C ATOM 495 O ASN A 34 3.926 4.101 20.164 1.00 0.00 O ATOM 496 CB ASN A 34 6.574 3.648 20.879 1.00 0.00 C ATOM 497 CG ASN A 34 7.091 2.636 21.882 1.00 0.00 C ATOM 498 OD1 ASN A 34 7.435 1.509 21.523 1.00 0.00 O ATOM 499 ND2 ASN A 34 7.150 3.032 23.148 1.00 0.00 N ATOM 0 H ASN A 34 6.948 4.010 18.075 1.00 0.00 H new ATOM 0 HA ASN A 34 5.816 1.929 19.832 1.00 0.00 H new ATOM 0 HB2 ASN A 34 7.387 4.312 20.585 1.00 0.00 H new ATOM 0 HB3 ASN A 34 5.812 4.267 21.352 1.00 0.00 H new ATOM 0 HD21 ASN A 34 7.490 2.393 23.867 1.00 0.00 H new ATOM 0 HD22 ASN A 34 6.855 3.975 23.402 1.00 0.00 H new ATOM 506 N GLY A 35 4.321 3.649 17.996 1.00 0.00 N ATOM 507 CA GLY A 35 3.070 4.238 17.556 1.00 0.00 C ATOM 508 C GLY A 35 2.652 3.752 16.182 1.00 0.00 C ATOM 509 O GLY A 35 3.374 3.939 15.204 1.00 0.00 O ATOM 0 H GLY A 35 4.901 3.266 17.249 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.287 4.000 18.276 1.00 0.00 H new ATOM 0 HA3 GLY A 35 3.169 5.323 17.540 1.00 0.00 H new ATOM 513 N VAL A 36 1.481 3.126 16.109 1.00 0.00 N ATOM 514 CA VAL A 36 0.966 2.612 14.846 1.00 0.00 C ATOM 515 C VAL A 36 0.441 3.742 13.967 1.00 0.00 C ATOM 516 O VAL A 36 -0.120 4.719 14.463 1.00 0.00 O ATOM 517 CB VAL A 36 -0.160 1.588 15.074 1.00 0.00 C ATOM 518 CG1 VAL A 36 -0.856 1.257 13.762 1.00 0.00 C ATOM 519 CG2 VAL A 36 0.385 0.328 15.728 1.00 0.00 C ATOM 0 H VAL A 36 0.871 2.963 16.910 1.00 0.00 H new ATOM 0 HA VAL A 36 1.797 2.119 14.342 1.00 0.00 H new ATOM 0 HB VAL A 36 -0.894 2.030 15.748 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -1.649 0.531 13.944 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.285 2.165 13.339 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -0.133 0.837 13.063 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -0.427 -0.383 15.881 1.00 0.00 H new ATOM 0 HG22 VAL A 36 1.142 -0.118 15.083 1.00 0.00 H new ATOM 0 HG23 VAL A 36 0.831 0.581 16.690 1.00 0.00 H new ATOM 529 N SER A 37 0.626 3.601 12.658 1.00 0.00 N ATOM 530 CA SER A 37 0.170 4.609 11.709 1.00 0.00 C ATOM 531 C SER A 37 -1.043 4.113 10.928 1.00 0.00 C ATOM 532 O SER A 37 -0.907 3.560 9.837 1.00 0.00 O ATOM 533 CB SER A 37 1.298 4.977 10.742 1.00 0.00 C ATOM 534 OG SER A 37 0.794 5.654 9.604 1.00 0.00 O ATOM 0 H SER A 37 1.089 2.798 12.231 1.00 0.00 H new ATOM 0 HA SER A 37 -0.121 5.496 12.272 1.00 0.00 H new ATOM 0 HB2 SER A 37 2.026 5.608 11.251 1.00 0.00 H new ATOM 0 HB3 SER A 37 1.822 4.074 10.429 1.00 0.00 H new ATOM 0 HG SER A 37 1.534 5.879 9.003 1.00 0.00 H new ATOM 540 N CYS A 38 -2.227 4.314 11.496 1.00 0.00 N ATOM 541 CA CYS A 38 -3.465 3.886 10.852 1.00 0.00 C ATOM 542 C CYS A 38 -4.027 4.991 9.964 1.00 0.00 C ATOM 543 O CYS A 38 -3.981 6.169 10.316 1.00 0.00 O ATOM 544 CB CYS A 38 -4.499 3.487 11.906 1.00 0.00 C ATOM 545 SG CYS A 38 -4.065 1.988 12.844 1.00 0.00 S ATOM 0 H CYS A 38 -2.356 4.770 12.399 1.00 0.00 H new ATOM 0 HA CYS A 38 -3.241 3.022 10.226 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -4.628 4.314 12.604 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -5.460 3.330 11.416 1.00 0.00 H new ATOM 550 N GLN A 39 -4.556 4.602 8.808 1.00 0.00 N ATOM 551 CA GLN A 39 -5.128 5.559 7.868 1.00 0.00 C ATOM 552 C GLN A 39 -6.112 4.874 6.926 1.00 0.00 C ATOM 553 O GLN A 39 -5.722 4.062 6.088 1.00 0.00 O ATOM 554 CB GLN A 39 -4.019 6.237 7.061 1.00 0.00 C ATOM 555 CG GLN A 39 -3.965 7.744 7.249 1.00 0.00 C ATOM 556 CD GLN A 39 -3.488 8.470 6.008 1.00 0.00 C ATOM 557 OE1 GLN A 39 -4.257 8.700 5.074 1.00 0.00 O ATOM 558 NE2 GLN A 39 -2.212 8.836 5.989 1.00 0.00 N ATOM 0 H GLN A 39 -4.600 3.631 8.500 1.00 0.00 H new ATOM 0 HA GLN A 39 -5.666 6.315 8.439 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -3.059 5.809 7.348 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -4.164 6.016 6.003 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -4.956 8.108 7.520 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -3.301 7.979 8.081 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -1.609 8.626 6.784 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -1.834 9.328 5.179 1.00 0.00 H new ATOM 567 N GLU A 40 -7.391 5.208 7.069 1.00 0.00 N ATOM 568 CA GLU A 40 -8.432 4.625 6.231 1.00 0.00 C ATOM 569 C GLU A 40 -8.071 4.744 4.754 1.00 0.00 C ATOM 570 O GLU A 40 -7.225 5.555 4.374 1.00 0.00 O ATOM 571 CB GLU A 40 -9.773 5.311 6.496 1.00 0.00 C ATOM 572 CG GLU A 40 -10.790 4.412 7.181 1.00 0.00 C ATOM 573 CD GLU A 40 -12.203 4.641 6.680 1.00 0.00 C ATOM 574 OE1 GLU A 40 -12.419 5.628 5.945 1.00 0.00 O ATOM 575 OE2 GLU A 40 -13.092 3.834 7.023 1.00 0.00 O ATOM 0 H GLU A 40 -7.731 5.879 7.758 1.00 0.00 H new ATOM 0 HA GLU A 40 -8.516 3.568 6.483 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -9.605 6.193 7.114 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -10.187 5.659 5.550 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -10.515 3.370 7.019 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -10.757 4.586 8.256 1.00 0.00 H new ATOM 636 N GLN A 45 -5.885 13.234 -2.989 1.00 0.00 N ATOM 637 CA GLN A 45 -5.800 14.508 -3.692 1.00 0.00 C ATOM 638 C GLN A 45 -6.412 14.405 -5.084 1.00 0.00 C ATOM 639 O GLN A 45 -6.928 13.355 -5.470 1.00 0.00 O ATOM 640 CB GLN A 45 -4.342 14.960 -3.795 1.00 0.00 C ATOM 641 CG GLN A 45 -4.034 16.212 -2.989 1.00 0.00 C ATOM 642 CD GLN A 45 -2.823 16.046 -2.093 1.00 0.00 C ATOM 643 OE1 GLN A 45 -2.790 15.168 -1.231 1.00 0.00 O ATOM 644 NE2 GLN A 45 -1.819 16.892 -2.293 1.00 0.00 N ATOM 0 HA GLN A 45 -6.364 15.247 -3.122 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -3.695 14.151 -3.456 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -4.100 15.143 -4.842 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -3.865 17.046 -3.670 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -4.900 16.469 -2.379 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -1.890 17.605 -3.019 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -0.977 16.829 -1.720 1.00 0.00 H new ATOM 653 N THR A 46 -6.352 15.499 -5.835 1.00 0.00 N ATOM 654 CA THR A 46 -6.900 15.533 -7.185 1.00 0.00 C ATOM 655 C THR A 46 -6.093 16.463 -8.083 1.00 0.00 C ATOM 656 O THR A 46 -5.838 17.615 -7.730 1.00 0.00 O ATOM 657 CB THR A 46 -8.370 15.988 -7.184 1.00 0.00 C ATOM 658 OG1 THR A 46 -8.548 17.071 -6.263 1.00 0.00 O ATOM 659 CG2 THR A 46 -9.292 14.839 -6.804 1.00 0.00 C ATOM 0 H THR A 46 -5.928 16.376 -5.531 1.00 0.00 H new ATOM 0 HA THR A 46 -6.843 14.516 -7.574 1.00 0.00 H new ATOM 0 HB THR A 46 -8.624 16.321 -8.190 1.00 0.00 H new ATOM 0 HG1 THR A 46 -9.479 17.091 -5.958 1.00 0.00 H new ATOM 0 HG21 THR A 46 -10.326 15.185 -6.810 1.00 0.00 H new ATOM 0 HG22 THR A 46 -9.177 14.027 -7.522 1.00 0.00 H new ATOM 0 HG23 THR A 46 -9.035 14.481 -5.807 1.00 0.00 H new ATOM 667 N TYR A 47 -5.693 15.958 -9.245 1.00 0.00 N ATOM 668 CA TYR A 47 -4.915 16.745 -10.194 1.00 0.00 C ATOM 669 C TYR A 47 -5.214 16.322 -11.628 1.00 0.00 C ATOM 670 O TYR A 47 -5.594 15.179 -11.882 1.00 0.00 O ATOM 671 CB TYR A 47 -3.419 16.594 -9.908 1.00 0.00 C ATOM 672 CG TYR A 47 -2.882 15.210 -10.196 1.00 0.00 C ATOM 673 CD1 TYR A 47 -2.840 14.719 -11.495 1.00 0.00 C ATOM 674 CD2 TYR A 47 -2.419 14.396 -9.171 1.00 0.00 C ATOM 675 CE1 TYR A 47 -2.350 13.454 -11.764 1.00 0.00 C ATOM 676 CE2 TYR A 47 -1.927 13.131 -9.431 1.00 0.00 C ATOM 677 CZ TYR A 47 -1.895 12.665 -10.729 1.00 0.00 C ATOM 678 OH TYR A 47 -1.407 11.406 -10.992 1.00 0.00 O ATOM 0 H TYR A 47 -5.895 15.007 -9.552 1.00 0.00 H new ATOM 0 HA TYR A 47 -5.198 17.791 -10.077 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -2.869 17.320 -10.507 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -3.232 16.836 -8.862 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -3.196 15.335 -12.308 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -2.444 14.757 -8.154 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -2.324 13.086 -12.779 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -1.570 12.511 -8.622 1.00 0.00 H new ATOM 0 HH TYR A 47 -1.321 11.284 -11.961 1.00 0.00 H new ATOM 688 N GLY A 48 -5.041 17.251 -12.562 1.00 0.00 N ATOM 689 CA GLY A 48 -5.297 16.956 -13.960 1.00 0.00 C ATOM 690 C GLY A 48 -6.722 16.499 -14.204 1.00 0.00 C ATOM 691 O GLY A 48 -7.537 16.467 -13.283 1.00 0.00 O ATOM 0 H GLY A 48 -4.728 18.204 -12.376 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -5.096 17.845 -14.558 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -4.608 16.182 -14.297 1.00 0.00 H new ATOM 695 N GLY A 49 -7.020 16.144 -15.450 1.00 0.00 N ATOM 696 CA GLY A 49 -8.357 15.692 -15.791 1.00 0.00 C ATOM 697 C GLY A 49 -9.300 16.840 -16.089 1.00 0.00 C ATOM 698 O GLY A 49 -8.883 17.996 -16.146 1.00 0.00 O ATOM 0 H GLY A 49 -6.361 16.161 -16.228 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -8.304 15.035 -16.659 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -8.758 15.101 -14.968 1.00 0.00 H new ATOM 702 N ASN A 50 -10.576 16.520 -16.282 1.00 0.00 N ATOM 703 CA ASN A 50 -11.582 17.533 -16.577 1.00 0.00 C ATOM 704 C ASN A 50 -12.127 18.150 -15.292 1.00 0.00 C ATOM 705 O ASN A 50 -13.141 18.846 -15.307 1.00 0.00 O ATOM 706 CB ASN A 50 -12.726 16.925 -17.389 1.00 0.00 C ATOM 707 CG ASN A 50 -13.186 15.591 -16.833 1.00 0.00 C ATOM 708 OD1 ASN A 50 -12.832 15.217 -15.714 1.00 0.00 O ATOM 709 ND2 ASN A 50 -13.977 14.865 -17.613 1.00 0.00 N ATOM 0 H ASN A 50 -10.937 15.567 -16.239 1.00 0.00 H new ATOM 0 HA ASN A 50 -11.107 18.320 -17.164 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -13.567 17.619 -17.403 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -12.404 16.793 -18.422 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -14.317 13.958 -17.292 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -14.245 15.214 -18.533 1.00 0.00 H new ATOM 716 N SER A 51 -11.445 17.889 -14.182 1.00 0.00 N ATOM 717 CA SER A 51 -11.860 18.418 -12.888 1.00 0.00 C ATOM 718 C SER A 51 -10.956 19.567 -12.455 1.00 0.00 C ATOM 719 O SER A 51 -11.334 20.385 -11.615 1.00 0.00 O ATOM 720 CB SER A 51 -11.840 17.312 -11.830 1.00 0.00 C ATOM 721 OG SER A 51 -12.937 16.431 -11.993 1.00 0.00 O ATOM 0 H SER A 51 -10.603 17.315 -14.152 1.00 0.00 H new ATOM 0 HA SER A 51 -12.877 18.797 -12.988 1.00 0.00 H new ATOM 0 HB2 SER A 51 -10.907 16.753 -11.901 1.00 0.00 H new ATOM 0 HB3 SER A 51 -11.871 17.756 -10.835 1.00 0.00 H new ATOM 0 HG SER A 51 -12.889 16.009 -12.876 1.00 0.00 H new ATOM 727 N ASN A 52 -9.762 19.625 -13.035 1.00 0.00 N ATOM 728 CA ASN A 52 -8.804 20.676 -12.710 1.00 0.00 C ATOM 729 C ASN A 52 -8.474 20.670 -11.221 1.00 0.00 C ATOM 730 O ASN A 52 -8.933 21.530 -10.469 1.00 0.00 O ATOM 731 CB ASN A 52 -9.358 22.043 -13.116 1.00 0.00 C ATOM 732 CG ASN A 52 -8.590 23.188 -12.486 1.00 0.00 C ATOM 733 OD1 ASN A 52 -9.024 23.767 -11.490 1.00 0.00 O ATOM 734 ND2 ASN A 52 -7.443 23.522 -13.065 1.00 0.00 N ATOM 0 H ASN A 52 -9.434 18.957 -13.732 1.00 0.00 H new ATOM 0 HA ASN A 52 -7.887 20.483 -13.267 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -9.322 22.139 -14.201 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -10.406 22.108 -12.825 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -6.884 24.286 -12.685 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -7.121 23.015 -13.889 1.00 0.00 H new ATOM 741 N GLY A 53 -7.675 19.695 -10.802 1.00 0.00 N ATOM 742 CA GLY A 53 -7.296 19.595 -9.404 1.00 0.00 C ATOM 743 C GLY A 53 -8.421 19.994 -8.468 1.00 0.00 C ATOM 744 O GLY A 53 -8.275 20.924 -7.675 1.00 0.00 O ATOM 0 H GLY A 53 -7.283 18.972 -11.405 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -6.992 18.571 -9.186 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -6.431 20.231 -9.219 1.00 0.00 H new ATOM 748 N GLU A 54 -9.544 19.291 -8.562 1.00 0.00 N ATOM 749 CA GLU A 54 -10.697 19.577 -7.716 1.00 0.00 C ATOM 750 C GLU A 54 -11.145 18.327 -6.965 1.00 0.00 C ATOM 751 O GLU A 54 -10.667 17.225 -7.233 1.00 0.00 O ATOM 752 CB GLU A 54 -11.852 20.120 -8.561 1.00 0.00 C ATOM 753 CG GLU A 54 -12.034 21.625 -8.444 1.00 0.00 C ATOM 754 CD GLU A 54 -13.243 22.126 -9.210 1.00 0.00 C ATOM 755 OE1 GLU A 54 -13.793 21.354 -10.024 1.00 0.00 O ATOM 756 OE2 GLU A 54 -13.639 23.291 -8.998 1.00 0.00 O ATOM 0 H GLU A 54 -9.681 18.519 -9.215 1.00 0.00 H new ATOM 0 HA GLU A 54 -10.403 20.331 -6.986 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -11.679 19.863 -9.606 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -12.776 19.626 -8.260 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -12.137 21.894 -7.393 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -11.140 22.126 -8.815 1.00 0.00 H new ATOM 763 N PRO A 55 -12.073 18.488 -6.012 1.00 0.00 N ATOM 764 CA PRO A 55 -12.594 17.373 -5.215 1.00 0.00 C ATOM 765 C PRO A 55 -13.439 16.413 -6.046 1.00 0.00 C ATOM 766 O PRO A 55 -13.820 16.724 -7.175 1.00 0.00 O ATOM 767 CB PRO A 55 -13.453 18.063 -4.153 1.00 0.00 C ATOM 768 CG PRO A 55 -13.844 19.363 -4.767 1.00 0.00 C ATOM 769 CD PRO A 55 -12.690 19.773 -5.638 1.00 0.00 C ATOM 0 HA PRO A 55 -11.794 16.760 -4.800 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -14.329 17.464 -3.902 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -12.895 18.214 -3.229 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -14.757 19.259 -5.353 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -14.040 20.113 -4.001 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -13.025 20.328 -6.514 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -11.990 20.414 -5.102 1.00 0.00 H new ATOM 777 N CYS A 56 -13.729 15.246 -5.480 1.00 0.00 N ATOM 778 CA CYS A 56 -14.529 14.242 -6.170 1.00 0.00 C ATOM 779 C CYS A 56 -15.955 14.217 -5.635 1.00 0.00 C ATOM 780 O CYS A 56 -16.353 15.081 -4.854 1.00 0.00 O ATOM 781 CB CYS A 56 -13.893 12.858 -6.021 1.00 0.00 C ATOM 782 SG CYS A 56 -12.073 12.878 -5.956 1.00 0.00 S ATOM 0 H CYS A 56 -13.422 14.973 -4.546 1.00 0.00 H new ATOM 0 HA CYS A 56 -14.561 14.508 -7.227 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -14.273 12.391 -5.112 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -14.209 12.233 -6.856 1.00 0.00 H new ATOM 787 N VAL A 57 -16.720 13.222 -6.068 1.00 0.00 N ATOM 788 CA VAL A 57 -18.105 13.081 -5.643 1.00 0.00 C ATOM 789 C VAL A 57 -18.503 11.612 -5.565 1.00 0.00 C ATOM 790 O VAL A 57 -19.515 11.200 -6.132 1.00 0.00 O ATOM 791 CB VAL A 57 -19.054 13.816 -6.606 1.00 0.00 C ATOM 792 CG1 VAL A 57 -20.403 14.062 -5.947 1.00 0.00 C ATOM 793 CG2 VAL A 57 -18.427 15.123 -7.070 1.00 0.00 C ATOM 0 H VAL A 57 -16.402 12.500 -6.715 1.00 0.00 H new ATOM 0 HA VAL A 57 -18.189 13.526 -4.652 1.00 0.00 H new ATOM 0 HB VAL A 57 -19.219 13.187 -7.481 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -21.059 14.583 -6.644 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -20.852 13.108 -5.670 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -20.266 14.672 -5.054 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -19.109 15.632 -7.751 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -18.233 15.760 -6.207 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -17.489 14.914 -7.585 1.00 0.00 H new ATOM 803 N LEU A 58 -17.697 10.827 -4.859 1.00 0.00 N ATOM 804 CA LEU A 58 -17.955 9.401 -4.703 1.00 0.00 C ATOM 805 C LEU A 58 -19.095 9.155 -3.720 1.00 0.00 C ATOM 806 O LEU A 58 -19.431 10.021 -2.913 1.00 0.00 O ATOM 807 CB LEU A 58 -16.690 8.687 -4.222 1.00 0.00 C ATOM 808 CG LEU A 58 -15.630 8.454 -5.301 1.00 0.00 C ATOM 809 CD1 LEU A 58 -14.234 8.596 -4.716 1.00 0.00 C ATOM 810 CD2 LEU A 58 -15.809 7.083 -5.935 1.00 0.00 C ATOM 0 H LEU A 58 -16.856 11.156 -4.384 1.00 0.00 H new ATOM 0 HA LEU A 58 -18.247 9.001 -5.674 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -16.245 9.271 -3.417 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -16.973 7.724 -3.798 1.00 0.00 H new ATOM 0 HG LEU A 58 -15.754 9.210 -6.077 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -13.493 8.427 -5.497 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -14.110 9.600 -4.310 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -14.096 7.863 -3.921 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -15.047 6.934 -6.700 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -15.711 6.313 -5.170 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -16.797 7.019 -6.390 1.00 0.00 H new ATOM 822 N PRO A 59 -19.708 7.962 -3.779 1.00 0.00 N ATOM 823 CA PRO A 59 -19.327 6.915 -4.731 1.00 0.00 C ATOM 824 C PRO A 59 -19.712 7.269 -6.162 1.00 0.00 C ATOM 825 O PRO A 59 -20.601 8.089 -6.393 1.00 0.00 O ATOM 826 CB PRO A 59 -20.113 5.680 -4.261 1.00 0.00 C ATOM 827 CG PRO A 59 -20.674 6.044 -2.924 1.00 0.00 C ATOM 828 CD PRO A 59 -20.819 7.537 -2.923 1.00 0.00 C ATOM 0 HA PRO A 59 -18.248 6.764 -4.748 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -20.907 5.430 -4.964 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -19.465 4.807 -4.189 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -21.637 5.559 -2.761 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -20.012 5.717 -2.122 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -21.783 7.852 -3.323 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -20.740 7.952 -1.918 1.00 0.00 H new ATOM 836 N PHE A 60 -19.039 6.643 -7.121 1.00 0.00 N ATOM 837 CA PHE A 60 -19.313 6.888 -8.532 1.00 0.00 C ATOM 838 C PHE A 60 -19.152 5.608 -9.345 1.00 0.00 C ATOM 839 O PHE A 60 -18.155 4.897 -9.213 1.00 0.00 O ATOM 840 CB PHE A 60 -18.380 7.974 -9.075 1.00 0.00 C ATOM 841 CG PHE A 60 -17.010 7.473 -9.431 1.00 0.00 C ATOM 842 CD1 PHE A 60 -16.821 6.651 -10.530 1.00 0.00 C ATOM 843 CD2 PHE A 60 -15.910 7.825 -8.665 1.00 0.00 C ATOM 844 CE1 PHE A 60 -15.561 6.190 -10.859 1.00 0.00 C ATOM 845 CE2 PHE A 60 -14.647 7.367 -8.989 1.00 0.00 C ATOM 846 CZ PHE A 60 -14.472 6.547 -10.087 1.00 0.00 C ATOM 0 H PHE A 60 -18.300 5.962 -6.947 1.00 0.00 H new ATOM 0 HA PHE A 60 -20.344 7.229 -8.623 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -18.834 8.421 -9.959 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -18.286 8.764 -8.330 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -17.668 6.367 -11.136 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -16.041 8.465 -7.805 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -15.427 5.551 -11.719 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -13.798 7.650 -8.385 1.00 0.00 H new ATOM 0 HZ PHE A 60 -13.486 6.186 -10.341 1.00 0.00 H new ATOM 856 N THR A 61 -20.141 5.318 -10.183 1.00 0.00 N ATOM 857 CA THR A 61 -20.113 4.125 -11.015 1.00 0.00 C ATOM 858 C THR A 61 -19.582 4.442 -12.409 1.00 0.00 C ATOM 859 O THR A 61 -19.827 5.522 -12.946 1.00 0.00 O ATOM 860 CB THR A 61 -21.514 3.507 -11.140 1.00 0.00 C ATOM 861 OG1 THR A 61 -22.496 4.540 -11.284 1.00 0.00 O ATOM 862 CG2 THR A 61 -21.844 2.654 -9.924 1.00 0.00 C ATOM 0 H THR A 61 -20.973 5.896 -10.303 1.00 0.00 H new ATOM 0 HA THR A 61 -19.447 3.410 -10.531 1.00 0.00 H new ATOM 0 HB THR A 61 -21.525 2.869 -12.024 1.00 0.00 H new ATOM 0 HG1 THR A 61 -23.386 4.137 -11.365 1.00 0.00 H new ATOM 0 HG21 THR A 61 -22.841 2.228 -10.038 1.00 0.00 H new ATOM 0 HG22 THR A 61 -21.114 1.849 -9.835 1.00 0.00 H new ATOM 0 HG23 THR A 61 -21.814 3.272 -9.027 1.00 0.00 H new ATOM 870 N TYR A 62 -18.856 3.493 -12.992 1.00 0.00 N ATOM 871 CA TYR A 62 -18.295 3.675 -14.326 1.00 0.00 C ATOM 872 C TYR A 62 -18.018 2.329 -14.991 1.00 0.00 C ATOM 873 O TYR A 62 -17.366 1.460 -14.413 1.00 0.00 O ATOM 874 CB TYR A 62 -17.009 4.505 -14.256 1.00 0.00 C ATOM 875 CG TYR A 62 -16.094 4.313 -15.443 1.00 0.00 C ATOM 876 CD1 TYR A 62 -16.340 4.966 -16.644 1.00 0.00 C ATOM 877 CD2 TYR A 62 -14.984 3.483 -15.363 1.00 0.00 C ATOM 878 CE1 TYR A 62 -15.507 4.796 -17.733 1.00 0.00 C ATOM 879 CE2 TYR A 62 -14.145 3.308 -16.447 1.00 0.00 C ATOM 880 CZ TYR A 62 -14.411 3.967 -17.630 1.00 0.00 C ATOM 881 OH TYR A 62 -13.577 3.795 -18.711 1.00 0.00 O ATOM 0 H TYR A 62 -18.643 2.593 -12.563 1.00 0.00 H new ATOM 0 HA TYR A 62 -19.028 4.210 -14.930 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -17.272 5.560 -14.179 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -16.468 4.244 -13.346 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -17.197 5.618 -16.728 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -14.773 2.966 -14.439 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -15.714 5.310 -18.660 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -13.285 2.659 -16.369 1.00 0.00 H new ATOM 0 HH TYR A 62 -12.853 3.180 -18.471 1.00 0.00 H new ATOM 891 N ASN A 63 -18.529 2.165 -16.209 1.00 0.00 N ATOM 892 CA ASN A 63 -18.347 0.928 -16.968 1.00 0.00 C ATOM 893 C ASN A 63 -19.259 -0.189 -16.456 1.00 0.00 C ATOM 894 O ASN A 63 -19.383 -1.235 -17.092 1.00 0.00 O ATOM 895 CB ASN A 63 -16.876 0.487 -16.923 1.00 0.00 C ATOM 896 CG ASN A 63 -16.587 -0.526 -15.828 1.00 0.00 C ATOM 897 OD1 ASN A 63 -15.636 -0.203 -14.959 1.00 0.00 O flip ATOM 898 ND2 ASN A 63 -17.211 -1.585 -15.766 1.00 0.00 N flip ATOM 0 H ASN A 63 -19.075 2.877 -16.694 1.00 0.00 H new ATOM 0 HA ASN A 63 -18.625 1.129 -18.003 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -16.603 0.058 -17.887 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -16.245 1.363 -16.774 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -17.934 -1.792 -16.455 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -17.005 -2.256 -15.025 1.00 0.00 H new ATOM 905 N GLY A 64 -19.889 0.032 -15.305 1.00 0.00 N ATOM 906 CA GLY A 64 -20.767 -0.970 -14.738 1.00 0.00 C ATOM 907 C GLY A 64 -20.404 -1.293 -13.304 1.00 0.00 C ATOM 908 O GLY A 64 -21.079 -2.088 -12.648 1.00 0.00 O ATOM 0 H GLY A 64 -19.805 0.888 -14.757 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -21.797 -0.616 -14.781 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -20.717 -1.878 -15.339 1.00 0.00 H new ATOM 912 N ARG A 65 -19.334 -0.672 -12.817 1.00 0.00 N ATOM 913 CA ARG A 65 -18.878 -0.895 -11.453 1.00 0.00 C ATOM 914 C ARG A 65 -19.021 0.383 -10.626 1.00 0.00 C ATOM 915 O ARG A 65 -18.840 1.487 -11.139 1.00 0.00 O ATOM 916 CB ARG A 65 -17.419 -1.390 -11.465 1.00 0.00 C ATOM 917 CG ARG A 65 -16.445 -0.533 -10.672 1.00 0.00 C ATOM 918 CD ARG A 65 -16.474 -0.875 -9.192 1.00 0.00 C ATOM 919 NE ARG A 65 -16.598 -2.313 -8.964 1.00 0.00 N ATOM 920 CZ ARG A 65 -17.139 -2.841 -7.871 1.00 0.00 C ATOM 921 NH1 ARG A 65 -17.603 -2.053 -6.910 1.00 0.00 N ATOM 922 NH2 ARG A 65 -17.218 -4.158 -7.738 1.00 0.00 N ATOM 0 H ARG A 65 -18.768 -0.011 -13.348 1.00 0.00 H new ATOM 0 HA ARG A 65 -19.498 -1.662 -10.989 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -17.392 -2.405 -11.069 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -17.077 -1.441 -12.499 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -15.436 -0.676 -11.059 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -16.693 0.520 -10.807 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -15.563 -0.510 -8.718 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -17.309 -0.359 -8.717 1.00 0.00 H new ATOM 0 HE ARG A 65 -16.250 -2.947 -9.684 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -17.545 -1.039 -7.009 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -18.018 -2.461 -6.072 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -16.863 -4.767 -8.475 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -17.633 -4.562 -6.899 1.00 0.00 H new ATOM 936 N THR A 66 -19.343 0.226 -9.346 1.00 0.00 N ATOM 937 CA THR A 66 -19.504 1.369 -8.456 1.00 0.00 C ATOM 938 C THR A 66 -18.231 1.622 -7.656 1.00 0.00 C ATOM 939 O THR A 66 -18.005 1.005 -6.617 1.00 0.00 O ATOM 940 CB THR A 66 -20.678 1.164 -7.479 1.00 0.00 C ATOM 941 OG1 THR A 66 -21.845 0.744 -8.196 1.00 0.00 O ATOM 942 CG2 THR A 66 -20.979 2.447 -6.717 1.00 0.00 C ATOM 0 H THR A 66 -19.497 -0.680 -8.903 1.00 0.00 H new ATOM 0 HA THR A 66 -19.715 2.233 -9.086 1.00 0.00 H new ATOM 0 HB THR A 66 -20.395 0.393 -6.763 1.00 0.00 H new ATOM 0 HG1 THR A 66 -22.586 0.614 -7.568 1.00 0.00 H new ATOM 0 HG21 THR A 66 -21.811 2.278 -6.034 1.00 0.00 H new ATOM 0 HG22 THR A 66 -20.099 2.748 -6.149 1.00 0.00 H new ATOM 0 HG23 THR A 66 -21.243 3.235 -7.422 1.00 0.00 H new ATOM 950 N PHE A 67 -17.400 2.534 -8.153 1.00 0.00 N ATOM 951 CA PHE A 67 -16.146 2.868 -7.488 1.00 0.00 C ATOM 952 C PHE A 67 -16.382 3.811 -6.313 1.00 0.00 C ATOM 953 O PHE A 67 -17.000 4.865 -6.463 1.00 0.00 O ATOM 954 CB PHE A 67 -15.176 3.506 -8.484 1.00 0.00 C ATOM 955 CG PHE A 67 -15.128 2.800 -9.807 1.00 0.00 C ATOM 956 CD1 PHE A 67 -16.106 3.024 -10.763 1.00 0.00 C ATOM 957 CD2 PHE A 67 -14.108 1.907 -10.095 1.00 0.00 C ATOM 958 CE1 PHE A 67 -16.067 2.372 -11.980 1.00 0.00 C ATOM 959 CE2 PHE A 67 -14.065 1.251 -11.310 1.00 0.00 C ATOM 960 CZ PHE A 67 -15.046 1.485 -12.254 1.00 0.00 C ATOM 0 H PHE A 67 -17.573 3.054 -9.013 1.00 0.00 H new ATOM 0 HA PHE A 67 -15.711 1.946 -7.103 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -15.464 4.545 -8.645 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -14.176 3.516 -8.050 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -16.908 3.716 -10.554 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -13.338 1.722 -9.361 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -16.835 2.556 -12.717 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -13.266 0.556 -11.522 1.00 0.00 H new ATOM 0 HZ PHE A 67 -15.014 0.974 -13.205 1.00 0.00 H new ATOM 970 N TYR A 68 -15.885 3.424 -5.143 1.00 0.00 N ATOM 971 CA TYR A 68 -16.038 4.234 -3.940 1.00 0.00 C ATOM 972 C TYR A 68 -14.759 5.010 -3.645 1.00 0.00 C ATOM 973 O TYR A 68 -14.581 5.541 -2.549 1.00 0.00 O ATOM 974 CB TYR A 68 -16.399 3.349 -2.745 1.00 0.00 C ATOM 975 CG TYR A 68 -17.794 2.768 -2.820 1.00 0.00 C ATOM 976 CD1 TYR A 68 -18.074 1.691 -3.651 1.00 0.00 C ATOM 977 CD2 TYR A 68 -18.828 3.299 -2.060 1.00 0.00 C ATOM 978 CE1 TYR A 68 -19.348 1.158 -3.721 1.00 0.00 C ATOM 979 CE2 TYR A 68 -20.104 2.771 -2.125 1.00 0.00 C ATOM 980 CZ TYR A 68 -20.358 1.702 -2.957 1.00 0.00 C ATOM 981 OH TYR A 68 -21.627 1.173 -3.026 1.00 0.00 O ATOM 0 H TYR A 68 -15.372 2.554 -5.002 1.00 0.00 H new ATOM 0 HA TYR A 68 -16.845 4.947 -4.110 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -15.678 2.534 -2.677 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -16.307 3.934 -1.830 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -17.285 1.263 -4.252 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -18.632 4.137 -1.408 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -19.551 0.320 -4.371 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -20.898 3.194 -1.527 1.00 0.00 H new ATOM 0 HH TYR A 68 -22.221 1.669 -2.425 1.00 0.00 H new ATOM 991 N SER A 69 -13.872 5.071 -4.632 1.00 0.00 N ATOM 992 CA SER A 69 -12.607 5.780 -4.484 1.00 0.00 C ATOM 993 C SER A 69 -11.840 5.799 -5.802 1.00 0.00 C ATOM 994 O SER A 69 -12.121 5.010 -6.706 1.00 0.00 O ATOM 995 CB SER A 69 -11.755 5.126 -3.394 1.00 0.00 C ATOM 996 OG SER A 69 -12.001 3.733 -3.320 1.00 0.00 O ATOM 0 H SER A 69 -14.006 4.637 -5.545 1.00 0.00 H new ATOM 0 HA SER A 69 -12.826 6.808 -4.195 1.00 0.00 H new ATOM 0 HB2 SER A 69 -10.699 5.301 -3.600 1.00 0.00 H new ATOM 0 HB3 SER A 69 -11.973 5.588 -2.431 1.00 0.00 H new ATOM 0 HG SER A 69 -11.443 3.339 -2.617 1.00 0.00 H new ATOM 1002 N CYS A 70 -10.871 6.703 -5.907 1.00 0.00 N ATOM 1003 CA CYS A 70 -10.066 6.821 -7.117 1.00 0.00 C ATOM 1004 C CYS A 70 -9.804 5.450 -7.733 1.00 0.00 C ATOM 1005 O CYS A 70 -9.862 4.430 -7.046 1.00 0.00 O ATOM 1006 CB CYS A 70 -8.740 7.517 -6.806 1.00 0.00 C ATOM 1007 SG CYS A 70 -8.920 9.232 -6.215 1.00 0.00 S ATOM 0 H CYS A 70 -10.625 7.363 -5.170 1.00 0.00 H new ATOM 0 HA CYS A 70 -10.623 7.421 -7.837 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -8.206 6.938 -6.052 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -8.122 7.517 -7.704 1.00 0.00 H new ATOM 1012 N THR A 71 -9.518 5.434 -9.030 1.00 0.00 N ATOM 1013 CA THR A 71 -9.248 4.187 -9.738 1.00 0.00 C ATOM 1014 C THR A 71 -8.450 4.442 -11.012 1.00 0.00 C ATOM 1015 O THR A 71 -8.527 5.521 -11.599 1.00 0.00 O ATOM 1016 CB THR A 71 -10.553 3.454 -10.102 1.00 0.00 C ATOM 1017 OG1 THR A 71 -10.253 2.211 -10.748 1.00 0.00 O ATOM 1018 CG2 THR A 71 -11.416 4.309 -11.016 1.00 0.00 C ATOM 0 H THR A 71 -9.467 6.270 -9.613 1.00 0.00 H new ATOM 0 HA THR A 71 -8.664 3.560 -9.064 1.00 0.00 H new ATOM 0 HB THR A 71 -11.105 3.262 -9.182 1.00 0.00 H new ATOM 0 HG1 THR A 71 -11.072 1.679 -10.831 1.00 0.00 H new ATOM 0 HG21 THR A 71 -12.332 3.771 -11.260 1.00 0.00 H new ATOM 0 HG22 THR A 71 -11.667 5.242 -10.512 1.00 0.00 H new ATOM 0 HG23 THR A 71 -10.869 4.528 -11.933 1.00 0.00 H new ATOM 1026 N THR A 72 -7.685 3.441 -11.434 1.00 0.00 N ATOM 1027 CA THR A 72 -6.873 3.557 -12.640 1.00 0.00 C ATOM 1028 C THR A 72 -7.573 2.922 -13.836 1.00 0.00 C ATOM 1029 O THR A 72 -6.953 2.666 -14.868 1.00 0.00 O ATOM 1030 CB THR A 72 -5.496 2.893 -12.455 1.00 0.00 C ATOM 1031 OG1 THR A 72 -5.594 1.484 -12.692 1.00 0.00 O ATOM 1032 CG2 THR A 72 -4.960 3.140 -11.054 1.00 0.00 C ATOM 0 H THR A 72 -7.610 2.541 -10.960 1.00 0.00 H new ATOM 0 HA THR A 72 -6.733 4.622 -12.826 1.00 0.00 H new ATOM 0 HB THR A 72 -4.806 3.334 -13.174 1.00 0.00 H new ATOM 0 HG1 THR A 72 -4.713 1.070 -12.574 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.987 2.661 -10.947 1.00 0.00 H new ATOM 0 HG22 THR A 72 -4.857 4.212 -10.887 1.00 0.00 H new ATOM 0 HG23 THR A 72 -5.651 2.724 -10.321 1.00 0.00 H new ATOM 1040 N GLU A 73 -8.871 2.671 -13.691 1.00 0.00 N ATOM 1041 CA GLU A 73 -9.656 2.066 -14.760 1.00 0.00 C ATOM 1042 C GLU A 73 -9.975 3.088 -15.847 1.00 0.00 C ATOM 1043 O GLU A 73 -11.140 3.389 -16.107 1.00 0.00 O ATOM 1044 CB GLU A 73 -10.953 1.479 -14.201 1.00 0.00 C ATOM 1045 CG GLU A 73 -11.146 0.008 -14.528 1.00 0.00 C ATOM 1046 CD GLU A 73 -10.598 -0.363 -15.892 1.00 0.00 C ATOM 1047 OE1 GLU A 73 -11.143 0.125 -16.903 1.00 0.00 O ATOM 1048 OE2 GLU A 73 -9.624 -1.143 -15.948 1.00 0.00 O ATOM 0 H GLU A 73 -9.400 2.877 -12.844 1.00 0.00 H new ATOM 0 HA GLU A 73 -9.063 1.265 -15.202 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -10.962 1.606 -13.118 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -11.797 2.044 -14.596 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -10.655 -0.597 -13.766 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -12.208 -0.233 -14.490 1.00 0.00 H new ATOM 1055 N GLY A 74 -8.932 3.620 -16.476 1.00 0.00 N ATOM 1056 CA GLY A 74 -9.123 4.603 -17.526 1.00 0.00 C ATOM 1057 C GLY A 74 -7.870 5.411 -17.799 1.00 0.00 C ATOM 1058 O GLY A 74 -7.572 5.742 -18.946 1.00 0.00 O ATOM 0 H GLY A 74 -7.959 3.388 -16.277 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -9.432 4.097 -18.441 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -9.932 5.277 -17.245 1.00 0.00 H new ATOM 1062 N ARG A 75 -7.133 5.731 -16.739 1.00 0.00 N ATOM 1063 CA ARG A 75 -5.904 6.506 -16.869 1.00 0.00 C ATOM 1064 C ARG A 75 -4.776 5.648 -17.431 1.00 0.00 C ATOM 1065 O ARG A 75 -4.395 4.640 -16.836 1.00 0.00 O ATOM 1066 CB ARG A 75 -5.495 7.084 -15.512 1.00 0.00 C ATOM 1067 CG ARG A 75 -6.543 7.997 -14.898 1.00 0.00 C ATOM 1068 CD ARG A 75 -6.267 9.457 -15.221 1.00 0.00 C ATOM 1069 NE ARG A 75 -5.422 9.606 -16.401 1.00 0.00 N ATOM 1070 CZ ARG A 75 -5.892 9.653 -17.643 1.00 0.00 C ATOM 1071 NH1 ARG A 75 -7.196 9.561 -17.863 1.00 0.00 N ATOM 1072 NH2 ARG A 75 -5.059 9.791 -18.666 1.00 0.00 N ATOM 0 H ARG A 75 -7.365 5.466 -15.782 1.00 0.00 H new ATOM 0 HA ARG A 75 -6.092 7.325 -17.563 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -5.292 6.264 -14.824 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -4.565 7.640 -15.629 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -7.530 7.721 -15.269 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -6.559 7.859 -13.817 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -7.211 9.977 -15.383 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -5.784 9.932 -14.367 1.00 0.00 H new ATOM 0 HE ARG A 75 -4.414 9.678 -16.265 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -7.839 9.454 -17.079 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -7.556 9.597 -18.817 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -4.055 9.861 -18.500 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -5.422 9.827 -19.618 1.00 0.00 H new ATOM 1086 N GLN A 76 -4.246 6.054 -18.579 1.00 0.00 N ATOM 1087 CA GLN A 76 -3.161 5.322 -19.222 1.00 0.00 C ATOM 1088 C GLN A 76 -1.809 5.754 -18.665 1.00 0.00 C ATOM 1089 O GLN A 76 -0.763 5.435 -19.230 1.00 0.00 O ATOM 1090 CB GLN A 76 -3.196 5.542 -20.736 1.00 0.00 C ATOM 1091 CG GLN A 76 -2.905 6.975 -21.149 1.00 0.00 C ATOM 1092 CD GLN A 76 -2.628 7.109 -22.634 1.00 0.00 C ATOM 1093 OE1 GLN A 76 -1.798 7.915 -23.053 1.00 0.00 O ATOM 1094 NE2 GLN A 76 -3.326 6.316 -23.439 1.00 0.00 N ATOM 0 H GLN A 76 -4.550 6.886 -19.084 1.00 0.00 H new ATOM 0 HA GLN A 76 -3.298 4.261 -19.013 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -2.468 4.882 -21.208 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -4.178 5.256 -21.114 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -3.754 7.605 -20.883 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -2.046 7.344 -20.588 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -4.004 5.662 -23.048 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.184 6.361 -24.448 1.00 0.00 H new ATOM 1103 N ASP A 77 -1.838 6.481 -17.553 1.00 0.00 N ATOM 1104 CA ASP A 77 -0.613 6.957 -16.919 1.00 0.00 C ATOM 1105 C ASP A 77 -0.286 6.130 -15.679 1.00 0.00 C ATOM 1106 O ASP A 77 0.813 6.220 -15.133 1.00 0.00 O ATOM 1107 CB ASP A 77 -0.750 8.432 -16.541 1.00 0.00 C ATOM 1108 CG ASP A 77 -2.192 8.840 -16.315 1.00 0.00 C ATOM 1109 OD1 ASP A 77 -3.029 8.584 -17.207 1.00 0.00 O ATOM 1110 OD2 ASP A 77 -2.486 9.417 -15.246 1.00 0.00 O ATOM 0 H ASP A 77 -2.695 6.753 -17.072 1.00 0.00 H new ATOM 0 HA ASP A 77 0.203 6.847 -17.633 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -0.174 8.627 -15.636 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -0.321 9.048 -17.331 1.00 0.00 H new ATOM 1115 N GLY A 78 -1.249 5.325 -15.240 1.00 0.00 N ATOM 1116 CA GLY A 78 -1.043 4.495 -14.068 1.00 0.00 C ATOM 1117 C GLY A 78 -1.531 5.158 -12.794 1.00 0.00 C ATOM 1118 O GLY A 78 -1.195 4.723 -11.693 1.00 0.00 O ATOM 0 H GLY A 78 -2.167 5.233 -15.675 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -1.563 3.547 -14.202 1.00 0.00 H new ATOM 0 HA3 GLY A 78 0.018 4.266 -13.971 1.00 0.00 H new ATOM 1122 N HIS A 79 -2.324 6.213 -12.946 1.00 0.00 N ATOM 1123 CA HIS A 79 -2.859 6.938 -11.799 1.00 0.00 C ATOM 1124 C HIS A 79 -4.334 6.613 -11.589 1.00 0.00 C ATOM 1125 O HIS A 79 -4.973 6.001 -12.446 1.00 0.00 O ATOM 1126 CB HIS A 79 -2.679 8.445 -11.992 1.00 0.00 C ATOM 1127 CG HIS A 79 -1.330 8.825 -12.520 1.00 0.00 C ATOM 1128 ND1 HIS A 79 -1.114 9.940 -13.302 1.00 0.00 N ATOM 1129 CD2 HIS A 79 -0.123 8.230 -12.373 1.00 0.00 C ATOM 1130 CE1 HIS A 79 0.168 10.014 -13.614 1.00 0.00 C ATOM 1131 NE2 HIS A 79 0.791 8.989 -13.062 1.00 0.00 N ATOM 0 H HIS A 79 -2.610 6.585 -13.851 1.00 0.00 H new ATOM 0 HA HIS A 79 -2.307 6.624 -10.913 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -3.444 8.809 -12.678 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -2.841 8.947 -11.038 1.00 0.00 H new ATOM 0 HD1 HIS A 79 -1.831 10.604 -13.594 1.00 0.00 H new ATOM 0 HD2 HIS A 79 0.083 7.327 -11.818 1.00 0.00 H new ATOM 0 HE1 HIS A 79 0.628 10.782 -14.218 1.00 0.00 H new ATOM 1140 N LEU A 80 -4.869 7.027 -10.446 1.00 0.00 N ATOM 1141 CA LEU A 80 -6.270 6.780 -10.124 1.00 0.00 C ATOM 1142 C LEU A 80 -7.096 8.053 -10.274 1.00 0.00 C ATOM 1143 O LEU A 80 -6.738 9.104 -9.742 1.00 0.00 O ATOM 1144 CB LEU A 80 -6.400 6.241 -8.698 1.00 0.00 C ATOM 1145 CG LEU A 80 -5.389 5.158 -8.320 1.00 0.00 C ATOM 1146 CD1 LEU A 80 -4.038 5.779 -8.000 1.00 0.00 C ATOM 1147 CD2 LEU A 80 -5.896 4.343 -7.140 1.00 0.00 C ATOM 0 H LEU A 80 -4.354 7.535 -9.727 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.651 6.036 -10.824 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -6.296 7.072 -8.001 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -7.405 5.840 -8.568 1.00 0.00 H new ATOM 0 HG LEU A 80 -5.267 4.489 -9.172 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -3.331 4.994 -7.733 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -3.669 6.318 -8.873 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -4.144 6.471 -7.164 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -5.163 3.577 -6.885 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -6.048 4.999 -6.283 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -6.840 3.868 -7.405 1.00 0.00 H new ATOM 1159 N TRP A 81 -8.203 7.953 -11.002 1.00 0.00 N ATOM 1160 CA TRP A 81 -9.081 9.097 -11.221 1.00 0.00 C ATOM 1161 C TRP A 81 -10.363 8.962 -10.406 1.00 0.00 C ATOM 1162 O TRP A 81 -10.754 7.859 -10.025 1.00 0.00 O ATOM 1163 CB TRP A 81 -9.417 9.231 -12.707 1.00 0.00 C ATOM 1164 CG TRP A 81 -9.909 7.957 -13.324 1.00 0.00 C ATOM 1165 CD1 TRP A 81 -9.155 6.881 -13.693 1.00 0.00 C ATOM 1166 CD2 TRP A 81 -11.264 7.628 -13.645 1.00 0.00 C ATOM 1167 NE1 TRP A 81 -9.959 5.902 -14.224 1.00 0.00 N ATOM 1168 CE2 TRP A 81 -11.259 6.337 -14.205 1.00 0.00 C ATOM 1169 CE3 TRP A 81 -12.483 8.299 -13.512 1.00 0.00 C ATOM 1170 CZ2 TRP A 81 -12.424 5.705 -14.632 1.00 0.00 C ATOM 1171 CZ3 TRP A 81 -13.639 7.671 -13.936 1.00 0.00 C ATOM 1172 CH2 TRP A 81 -13.602 6.385 -14.489 1.00 0.00 C ATOM 0 H TRP A 81 -8.514 7.091 -11.451 1.00 0.00 H new ATOM 0 HA TRP A 81 -8.557 9.995 -10.893 1.00 0.00 H new ATOM 0 HB2 TRP A 81 -10.176 10.003 -12.832 1.00 0.00 H new ATOM 0 HB3 TRP A 81 -8.530 9.567 -13.244 1.00 0.00 H new ATOM 0 HD1 TRP A 81 -8.083 6.810 -13.584 1.00 0.00 H new ATOM 0 HE1 TRP A 81 -9.641 4.999 -14.575 1.00 0.00 H new ATOM 0 HE3 TRP A 81 -12.521 9.291 -13.086 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 -12.398 4.714 -15.060 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 -14.586 8.180 -13.839 1.00 0.00 H new ATOM 0 HH2 TRP A 81 -14.523 5.920 -14.809 1.00 0.00 H new ATOM 1183 N CYS A 82 -11.010 10.092 -10.140 1.00 0.00 N ATOM 1184 CA CYS A 82 -12.249 10.099 -9.368 1.00 0.00 C ATOM 1185 C CYS A 82 -13.299 10.986 -10.029 1.00 0.00 C ATOM 1186 O CYS A 82 -13.026 12.134 -10.377 1.00 0.00 O ATOM 1187 CB CYS A 82 -11.980 10.585 -7.943 1.00 0.00 C ATOM 1188 SG CYS A 82 -11.514 12.342 -7.833 1.00 0.00 S ATOM 0 H CYS A 82 -10.698 11.014 -10.447 1.00 0.00 H new ATOM 0 HA CYS A 82 -12.632 9.079 -9.333 1.00 0.00 H new ATOM 0 HB2 CYS A 82 -12.872 10.418 -7.339 1.00 0.00 H new ATOM 0 HB3 CYS A 82 -11.183 9.981 -7.509 1.00 0.00 H new ATOM 1193 N SER A 83 -14.501 10.445 -10.196 1.00 0.00 N ATOM 1194 CA SER A 83 -15.594 11.188 -10.812 1.00 0.00 C ATOM 1195 C SER A 83 -16.044 12.335 -9.913 1.00 0.00 C ATOM 1196 O SER A 83 -16.596 12.112 -8.836 1.00 0.00 O ATOM 1197 CB SER A 83 -16.773 10.258 -11.100 1.00 0.00 C ATOM 1198 OG SER A 83 -17.927 10.995 -11.466 1.00 0.00 O ATOM 0 H SER A 83 -14.743 9.495 -9.914 1.00 0.00 H new ATOM 0 HA SER A 83 -15.233 11.605 -11.752 1.00 0.00 H new ATOM 0 HB2 SER A 83 -16.509 9.568 -11.902 1.00 0.00 H new ATOM 0 HB3 SER A 83 -16.988 9.654 -10.218 1.00 0.00 H new ATOM 0 HG SER A 83 -18.520 11.081 -10.690 1.00 0.00 H new ATOM 1204 N THR A 84 -15.803 13.562 -10.362 1.00 0.00 N ATOM 1205 CA THR A 84 -16.182 14.743 -9.598 1.00 0.00 C ATOM 1206 C THR A 84 -17.645 15.107 -9.832 1.00 0.00 C ATOM 1207 O THR A 84 -17.967 16.257 -10.128 1.00 0.00 O ATOM 1208 CB THR A 84 -15.301 15.953 -9.959 1.00 0.00 C ATOM 1209 OG1 THR A 84 -15.492 16.305 -11.335 1.00 0.00 O ATOM 1210 CG2 THR A 84 -13.832 15.646 -9.710 1.00 0.00 C ATOM 0 H THR A 84 -15.347 13.764 -11.252 1.00 0.00 H new ATOM 0 HA THR A 84 -16.036 14.497 -8.546 1.00 0.00 H new ATOM 0 HB THR A 84 -15.594 16.790 -9.325 1.00 0.00 H new ATOM 0 HG1 THR A 84 -14.621 16.387 -11.776 1.00 0.00 H new ATOM 0 HG21 THR A 84 -13.229 16.515 -9.972 1.00 0.00 H new ATOM 0 HG22 THR A 84 -13.684 15.406 -8.657 1.00 0.00 H new ATOM 0 HG23 THR A 84 -13.529 14.796 -10.322 1.00 0.00 H new ATOM 1218 N THR A 85 -18.526 14.121 -9.697 1.00 0.00 N ATOM 1219 CA THR A 85 -19.954 14.341 -9.894 1.00 0.00 C ATOM 1220 C THR A 85 -20.743 13.052 -9.696 1.00 0.00 C ATOM 1221 O THR A 85 -20.482 12.045 -10.353 1.00 0.00 O ATOM 1222 CB THR A 85 -20.248 14.900 -11.297 1.00 0.00 C ATOM 1223 OG1 THR A 85 -19.260 14.439 -12.227 1.00 0.00 O ATOM 1224 CG2 THR A 85 -20.262 16.421 -11.277 1.00 0.00 C ATOM 0 H THR A 85 -18.276 13.163 -9.452 1.00 0.00 H new ATOM 0 HA THR A 85 -20.266 15.072 -9.148 1.00 0.00 H new ATOM 0 HB THR A 85 -21.230 14.545 -11.608 1.00 0.00 H new ATOM 0 HG1 THR A 85 -19.667 13.796 -12.845 1.00 0.00 H new ATOM 0 HG21 THR A 85 -20.472 16.796 -12.279 1.00 0.00 H new ATOM 0 HG22 THR A 85 -21.034 16.769 -10.590 1.00 0.00 H new ATOM 0 HG23 THR A 85 -19.291 16.789 -10.948 1.00 0.00 H new ATOM 1232 N SER A 86 -21.711 13.093 -8.785 1.00 0.00 N ATOM 1233 CA SER A 86 -22.541 11.928 -8.499 1.00 0.00 C ATOM 1234 C SER A 86 -22.963 11.233 -9.789 1.00 0.00 C ATOM 1235 O SER A 86 -22.596 10.083 -10.034 1.00 0.00 O ATOM 1236 CB SER A 86 -23.778 12.343 -7.700 1.00 0.00 C ATOM 1237 OG SER A 86 -24.727 11.291 -7.647 1.00 0.00 O ATOM 0 H SER A 86 -21.940 13.920 -8.233 1.00 0.00 H new ATOM 0 HA SER A 86 -21.952 11.228 -7.906 1.00 0.00 H new ATOM 0 HB2 SER A 86 -23.484 12.624 -6.688 1.00 0.00 H new ATOM 0 HB3 SER A 86 -24.231 13.223 -8.156 1.00 0.00 H new ATOM 0 HG SER A 86 -25.507 11.580 -7.130 1.00 0.00 H new ATOM 1243 N ASN A 87 -23.736 11.938 -10.609 1.00 0.00 N ATOM 1244 CA ASN A 87 -24.207 11.388 -11.875 1.00 0.00 C ATOM 1245 C ASN A 87 -23.084 11.360 -12.907 1.00 0.00 C ATOM 1246 O ASN A 87 -23.062 12.166 -13.837 1.00 0.00 O ATOM 1247 CB ASN A 87 -25.383 12.210 -12.406 1.00 0.00 C ATOM 1248 CG ASN A 87 -26.564 12.212 -11.455 1.00 0.00 C ATOM 1249 OD1 ASN A 87 -27.252 11.204 -11.300 1.00 0.00 O ATOM 1250 ND2 ASN A 87 -26.804 13.349 -10.811 1.00 0.00 N ATOM 0 H ASN A 87 -24.049 12.890 -10.420 1.00 0.00 H new ATOM 0 HA ASN A 87 -24.539 10.365 -11.697 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -25.057 13.236 -12.578 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -25.697 11.809 -13.370 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -27.585 13.410 -10.158 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -26.207 14.161 -10.970 1.00 0.00 H new ATOM 1257 N TYR A 88 -22.153 10.428 -12.734 1.00 0.00 N ATOM 1258 CA TYR A 88 -21.025 10.295 -13.649 1.00 0.00 C ATOM 1259 C TYR A 88 -21.502 10.202 -15.094 1.00 0.00 C ATOM 1260 O TYR A 88 -20.739 10.453 -16.027 1.00 0.00 O ATOM 1261 CB TYR A 88 -20.198 9.059 -13.294 1.00 0.00 C ATOM 1262 CG TYR A 88 -19.090 8.766 -14.280 1.00 0.00 C ATOM 1263 CD1 TYR A 88 -17.841 9.359 -14.145 1.00 0.00 C ATOM 1264 CD2 TYR A 88 -19.294 7.899 -15.346 1.00 0.00 C ATOM 1265 CE1 TYR A 88 -16.825 9.094 -15.045 1.00 0.00 C ATOM 1266 CE2 TYR A 88 -18.283 7.629 -16.249 1.00 0.00 C ATOM 1267 CZ TYR A 88 -17.052 8.228 -16.094 1.00 0.00 C ATOM 1268 OH TYR A 88 -16.044 7.963 -16.992 1.00 0.00 O ATOM 0 H TYR A 88 -22.157 9.754 -11.969 1.00 0.00 H new ATOM 0 HA TYR A 88 -20.402 11.184 -13.548 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -19.764 9.195 -12.303 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -20.859 8.194 -13.236 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -17.661 10.038 -13.324 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -20.258 7.428 -15.471 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -15.859 9.563 -14.927 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -18.457 6.952 -17.072 1.00 0.00 H new ATOM 0 HH TYR A 88 -15.924 6.994 -17.072 1.00 0.00 H new ATOM 1278 N GLU A 89 -22.767 9.841 -15.274 1.00 0.00 N ATOM 1279 CA GLU A 89 -23.340 9.717 -16.608 1.00 0.00 C ATOM 1280 C GLU A 89 -23.890 11.056 -17.093 1.00 0.00 C ATOM 1281 O GLU A 89 -24.252 11.203 -18.260 1.00 0.00 O ATOM 1282 CB GLU A 89 -24.451 8.665 -16.617 1.00 0.00 C ATOM 1283 CG GLU A 89 -24.515 7.831 -15.347 1.00 0.00 C ATOM 1284 CD GLU A 89 -25.424 6.625 -15.485 1.00 0.00 C ATOM 1285 OE1 GLU A 89 -26.587 6.803 -15.902 1.00 0.00 O ATOM 1286 OE2 GLU A 89 -24.971 5.503 -15.176 1.00 0.00 O ATOM 0 H GLU A 89 -23.414 9.629 -14.514 1.00 0.00 H new ATOM 0 HA GLU A 89 -22.546 9.403 -17.286 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -25.410 9.163 -16.762 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -24.304 8.002 -17.469 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -23.511 7.496 -15.086 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -24.867 8.454 -14.525 1.00 0.00 H new ATOM 1293 N GLN A 90 -23.948 12.030 -16.190 1.00 0.00 N ATOM 1294 CA GLN A 90 -24.452 13.356 -16.527 1.00 0.00 C ATOM 1295 C GLN A 90 -23.303 14.328 -16.774 1.00 0.00 C ATOM 1296 O GLN A 90 -23.305 15.069 -17.758 1.00 0.00 O ATOM 1297 CB GLN A 90 -25.349 13.884 -15.406 1.00 0.00 C ATOM 1298 CG GLN A 90 -26.806 14.032 -15.812 1.00 0.00 C ATOM 1299 CD GLN A 90 -27.480 15.214 -15.143 1.00 0.00 C ATOM 1300 OE1 GLN A 90 -26.931 16.314 -15.100 1.00 0.00 O ATOM 1301 NE2 GLN A 90 -28.678 14.990 -14.616 1.00 0.00 N ATOM 0 H GLN A 90 -23.652 11.925 -15.219 1.00 0.00 H new ATOM 0 HA GLN A 90 -25.037 13.273 -17.443 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -25.285 13.209 -14.552 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -24.972 14.852 -15.076 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -26.868 14.148 -16.894 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -27.345 13.119 -15.558 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -29.096 14.061 -14.675 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -29.181 15.747 -14.152 1.00 0.00 H new ATOM 1310 N ASP A 91 -22.323 14.319 -15.878 1.00 0.00 N ATOM 1311 CA ASP A 91 -21.166 15.200 -16.000 1.00 0.00 C ATOM 1312 C ASP A 91 -19.903 14.401 -16.300 1.00 0.00 C ATOM 1313 O ASP A 91 -18.895 14.958 -16.735 1.00 0.00 O ATOM 1314 CB ASP A 91 -20.979 16.010 -14.716 1.00 0.00 C ATOM 1315 CG ASP A 91 -22.269 16.164 -13.935 1.00 0.00 C ATOM 1316 OD1 ASP A 91 -23.001 17.146 -14.184 1.00 0.00 O ATOM 1317 OD2 ASP A 91 -22.549 15.304 -13.073 1.00 0.00 O ATOM 0 H ASP A 91 -22.306 13.712 -15.059 1.00 0.00 H new ATOM 0 HA ASP A 91 -21.346 15.884 -16.830 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -20.233 15.522 -14.088 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -20.589 16.997 -14.966 1.00 0.00 H new ATOM 1322 N GLN A 92 -19.969 13.093 -16.061 1.00 0.00 N ATOM 1323 CA GLN A 92 -18.836 12.203 -16.303 1.00 0.00 C ATOM 1324 C GLN A 92 -17.510 12.919 -16.068 1.00 0.00 C ATOM 1325 O GLN A 92 -16.520 12.651 -16.750 1.00 0.00 O ATOM 1326 CB GLN A 92 -18.888 11.646 -17.727 1.00 0.00 C ATOM 1327 CG GLN A 92 -19.204 12.692 -18.784 1.00 0.00 C ATOM 1328 CD GLN A 92 -20.656 12.663 -19.220 1.00 0.00 C ATOM 1329 OE1 GLN A 92 -21.532 12.205 -18.333 1.00 0.00 O flip ATOM 1330 NE2 GLN A 92 -20.987 13.050 -20.340 1.00 0.00 N flip ATOM 0 H GLN A 92 -20.799 12.624 -15.698 1.00 0.00 H new ATOM 0 HA GLN A 92 -18.905 11.376 -15.596 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -17.929 11.184 -17.962 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -19.641 10.859 -17.772 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -18.966 13.681 -18.393 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -18.565 12.530 -19.652 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -20.280 13.394 -20.990 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -21.968 13.027 -20.618 1.00 0.00 H new ATOM 1339 N LYS A 93 -17.496 13.827 -15.098 1.00 0.00 N ATOM 1340 CA LYS A 93 -16.290 14.577 -14.770 1.00 0.00 C ATOM 1341 C LYS A 93 -15.432 13.806 -13.773 1.00 0.00 C ATOM 1342 O LYS A 93 -15.936 13.290 -12.775 1.00 0.00 O ATOM 1343 CB LYS A 93 -16.656 15.947 -14.196 1.00 0.00 C ATOM 1344 CG LYS A 93 -17.393 16.841 -15.179 1.00 0.00 C ATOM 1345 CD LYS A 93 -16.699 18.183 -15.341 1.00 0.00 C ATOM 1346 CE LYS A 93 -17.702 19.320 -15.451 1.00 0.00 C ATOM 1347 NZ LYS A 93 -18.163 19.520 -16.853 1.00 0.00 N ATOM 0 H LYS A 93 -18.307 14.061 -14.525 1.00 0.00 H new ATOM 0 HA LYS A 93 -15.716 14.719 -15.686 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -17.276 15.807 -13.310 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -15.745 16.451 -13.872 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -17.457 16.344 -16.147 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -18.415 16.998 -14.834 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -16.041 18.358 -14.490 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -16.071 18.164 -16.231 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -18.560 19.110 -14.813 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -17.249 20.241 -15.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -18.846 20.304 -16.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -17.348 19.746 -17.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -18.618 18.650 -17.196 1.00 0.00 H new ATOM 1361 N TYR A 94 -14.134 13.727 -14.048 1.00 0.00 N ATOM 1362 CA TYR A 94 -13.212 13.013 -13.173 1.00 0.00 C ATOM 1363 C TYR A 94 -11.953 13.835 -12.914 1.00 0.00 C ATOM 1364 O TYR A 94 -11.813 14.952 -13.411 1.00 0.00 O ATOM 1365 CB TYR A 94 -12.835 11.665 -13.789 1.00 0.00 C ATOM 1366 CG TYR A 94 -12.238 11.776 -15.174 1.00 0.00 C ATOM 1367 CD1 TYR A 94 -11.047 12.460 -15.385 1.00 0.00 C ATOM 1368 CD2 TYR A 94 -12.867 11.200 -16.270 1.00 0.00 C ATOM 1369 CE1 TYR A 94 -10.499 12.565 -16.649 1.00 0.00 C ATOM 1370 CE2 TYR A 94 -12.325 11.300 -17.537 1.00 0.00 C ATOM 1371 CZ TYR A 94 -11.142 11.983 -17.721 1.00 0.00 C ATOM 1372 OH TYR A 94 -10.599 12.086 -18.982 1.00 0.00 O ATOM 0 H TYR A 94 -13.698 14.148 -14.868 1.00 0.00 H new ATOM 0 HA TYR A 94 -13.714 12.845 -12.220 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -12.122 11.163 -13.135 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -13.723 11.035 -13.835 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -10.541 12.917 -14.547 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -13.795 10.665 -16.130 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -9.572 13.100 -16.797 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -12.826 10.845 -18.379 1.00 0.00 H new ATOM 0 HH TYR A 94 -11.174 11.621 -19.625 1.00 0.00 H new ATOM 1382 N SER A 95 -11.038 13.269 -12.132 1.00 0.00 N ATOM 1383 CA SER A 95 -9.788 13.942 -11.804 1.00 0.00 C ATOM 1384 C SER A 95 -8.726 12.931 -11.381 1.00 0.00 C ATOM 1385 O SER A 95 -8.999 12.019 -10.602 1.00 0.00 O ATOM 1386 CB SER A 95 -10.010 14.963 -10.687 1.00 0.00 C ATOM 1387 OG SER A 95 -11.391 15.180 -10.459 1.00 0.00 O ATOM 0 H SER A 95 -11.140 12.344 -11.714 1.00 0.00 H new ATOM 0 HA SER A 95 -9.438 14.463 -12.695 1.00 0.00 H new ATOM 0 HB2 SER A 95 -9.538 14.611 -9.770 1.00 0.00 H new ATOM 0 HB3 SER A 95 -9.530 15.905 -10.951 1.00 0.00 H new ATOM 0 HG SER A 95 -11.582 15.096 -9.501 1.00 0.00 H new ATOM 1393 N PHE A 96 -7.514 13.100 -11.902 1.00 0.00 N ATOM 1394 CA PHE A 96 -6.414 12.200 -11.578 1.00 0.00 C ATOM 1395 C PHE A 96 -5.881 12.469 -10.174 1.00 0.00 C ATOM 1396 O PHE A 96 -5.356 13.548 -9.895 1.00 0.00 O ATOM 1397 CB PHE A 96 -5.287 12.352 -12.602 1.00 0.00 C ATOM 1398 CG PHE A 96 -5.772 12.710 -13.977 1.00 0.00 C ATOM 1399 CD1 PHE A 96 -6.899 12.103 -14.508 1.00 0.00 C ATOM 1400 CD2 PHE A 96 -5.102 13.654 -14.738 1.00 0.00 C ATOM 1401 CE1 PHE A 96 -7.349 12.431 -15.773 1.00 0.00 C ATOM 1402 CE2 PHE A 96 -5.546 13.986 -16.004 1.00 0.00 C ATOM 1403 CZ PHE A 96 -6.671 13.373 -16.522 1.00 0.00 C ATOM 0 H PHE A 96 -7.270 13.850 -12.549 1.00 0.00 H new ATOM 0 HA PHE A 96 -6.793 11.178 -11.611 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -4.595 13.121 -12.258 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -4.726 11.419 -12.655 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -7.432 11.365 -13.927 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -4.223 14.136 -14.337 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -8.229 11.952 -16.175 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -5.015 14.723 -16.587 1.00 0.00 H new ATOM 0 HZ PHE A 96 -7.020 13.630 -17.511 1.00 0.00 H new ATOM 1413 N CYS A 97 -6.017 11.481 -9.298 1.00 0.00 N ATOM 1414 CA CYS A 97 -5.548 11.608 -7.922 1.00 0.00 C ATOM 1415 C CYS A 97 -4.100 11.145 -7.799 1.00 0.00 C ATOM 1416 O CYS A 97 -3.483 10.737 -8.783 1.00 0.00 O ATOM 1417 CB CYS A 97 -6.434 10.793 -6.979 1.00 0.00 C ATOM 1418 SG CYS A 97 -8.055 10.343 -7.678 1.00 0.00 S ATOM 0 H CYS A 97 -6.448 10.582 -9.515 1.00 0.00 H new ATOM 0 HA CYS A 97 -5.603 12.660 -7.642 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -5.906 9.881 -6.700 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -6.592 11.363 -6.063 1.00 0.00 H new ATOM 1423 N THR A 98 -3.566 11.206 -6.584 1.00 0.00 N ATOM 1424 CA THR A 98 -2.194 10.787 -6.335 1.00 0.00 C ATOM 1425 C THR A 98 -2.074 9.268 -6.369 1.00 0.00 C ATOM 1426 O THR A 98 -2.668 8.569 -5.549 1.00 0.00 O ATOM 1427 CB THR A 98 -1.686 11.300 -4.975 1.00 0.00 C ATOM 1428 OG1 THR A 98 -2.560 10.863 -3.928 1.00 0.00 O ATOM 1429 CG2 THR A 98 -1.599 12.819 -4.967 1.00 0.00 C ATOM 0 H THR A 98 -4.062 11.541 -5.758 1.00 0.00 H new ATOM 0 HA THR A 98 -1.582 11.218 -7.127 1.00 0.00 H new ATOM 0 HB THR A 98 -0.688 10.893 -4.809 1.00 0.00 H new ATOM 0 HG1 THR A 98 -2.894 9.965 -4.134 1.00 0.00 H new ATOM 0 HG21 THR A 98 -1.238 13.158 -3.996 1.00 0.00 H new ATOM 0 HG22 THR A 98 -0.910 13.148 -5.745 1.00 0.00 H new ATOM 0 HG23 THR A 98 -2.586 13.241 -5.154 1.00 0.00 H new ATOM 1481 N VAL A 102 0.839 1.154 -3.597 1.00 0.00 N ATOM 1482 CA VAL A 102 1.894 0.161 -3.765 1.00 0.00 C ATOM 1483 C VAL A 102 2.078 -0.664 -2.496 1.00 0.00 C ATOM 1484 O VAL A 102 3.199 -0.852 -2.023 1.00 0.00 O ATOM 1485 CB VAL A 102 3.236 0.822 -4.131 1.00 0.00 C ATOM 1486 CG1 VAL A 102 3.807 1.568 -2.936 1.00 0.00 C ATOM 1487 CG2 VAL A 102 4.221 -0.217 -4.643 1.00 0.00 C ATOM 0 HA VAL A 102 1.585 -0.493 -4.581 1.00 0.00 H new ATOM 0 HB VAL A 102 3.059 1.544 -4.929 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.755 2.028 -3.214 1.00 0.00 H new ATOM 0 HG12 VAL A 102 3.106 2.341 -2.621 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.969 0.870 -2.115 1.00 0.00 H new ATOM 0 HG21 VAL A 102 5.163 0.269 -4.897 1.00 0.00 H new ATOM 0 HG22 VAL A 102 4.395 -0.965 -3.870 1.00 0.00 H new ATOM 0 HG23 VAL A 102 3.812 -0.700 -5.530 1.00 0.00 H new ATOM 1497 N LEU A 103 0.970 -1.156 -1.950 1.00 0.00 N ATOM 1498 CA LEU A 103 1.010 -1.962 -0.735 1.00 0.00 C ATOM 1499 C LEU A 103 0.589 -3.400 -1.021 1.00 0.00 C ATOM 1500 O LEU A 103 -0.475 -3.645 -1.588 1.00 0.00 O ATOM 1501 CB LEU A 103 0.101 -1.354 0.336 1.00 0.00 C ATOM 1502 CG LEU A 103 -0.099 0.159 0.231 1.00 0.00 C ATOM 1503 CD1 LEU A 103 -1.574 0.490 0.055 1.00 0.00 C ATOM 1504 CD2 LEU A 103 0.465 0.857 1.459 1.00 0.00 C ATOM 0 H LEU A 103 0.034 -1.011 -2.329 1.00 0.00 H new ATOM 0 HA LEU A 103 2.036 -1.970 -0.368 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.874 -1.839 0.282 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.517 -1.583 1.317 1.00 0.00 H new ATOM 0 HG LEU A 103 0.440 0.519 -0.645 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.698 1.570 -0.018 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.946 0.020 -0.855 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.135 0.117 0.912 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.314 1.933 1.368 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.046 0.494 2.351 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.531 0.646 1.540 1.00 0.00 H new ATOM 1516 N VAL A 104 1.433 -4.348 -0.625 1.00 0.00 N ATOM 1517 CA VAL A 104 1.149 -5.762 -0.838 1.00 0.00 C ATOM 1518 C VAL A 104 0.672 -6.419 0.455 1.00 0.00 C ATOM 1519 O VAL A 104 1.196 -6.140 1.532 1.00 0.00 O ATOM 1520 CB VAL A 104 2.396 -6.502 -1.378 1.00 0.00 C ATOM 1521 CG1 VAL A 104 2.353 -7.990 -1.052 1.00 0.00 C ATOM 1522 CG2 VAL A 104 2.528 -6.289 -2.877 1.00 0.00 C ATOM 0 H VAL A 104 2.319 -4.162 -0.155 1.00 0.00 H new ATOM 0 HA VAL A 104 0.355 -5.833 -1.581 1.00 0.00 H new ATOM 0 HB VAL A 104 3.271 -6.083 -0.882 1.00 0.00 H new ATOM 0 HG11 VAL A 104 3.245 -8.475 -1.448 1.00 0.00 H new ATOM 0 HG12 VAL A 104 2.316 -8.125 0.029 1.00 0.00 H new ATOM 0 HG13 VAL A 104 1.467 -8.436 -1.504 1.00 0.00 H new ATOM 0 HG21 VAL A 104 3.410 -6.815 -3.243 1.00 0.00 H new ATOM 0 HG22 VAL A 104 1.641 -6.675 -3.379 1.00 0.00 H new ATOM 0 HG23 VAL A 104 2.629 -5.224 -3.086 1.00 0.00 H new ATOM 1532 N GLN A 105 -0.322 -7.291 0.341 1.00 0.00 N ATOM 1533 CA GLN A 105 -0.866 -7.985 1.504 1.00 0.00 C ATOM 1534 C GLN A 105 -0.187 -9.337 1.698 1.00 0.00 C ATOM 1535 O GLN A 105 -0.649 -10.354 1.181 1.00 0.00 O ATOM 1536 CB GLN A 105 -2.375 -8.177 1.349 1.00 0.00 C ATOM 1537 CG GLN A 105 -3.184 -6.931 1.674 1.00 0.00 C ATOM 1538 CD GLN A 105 -4.632 -7.243 1.998 1.00 0.00 C ATOM 1539 OE1 GLN A 105 -4.938 -7.799 3.053 1.00 0.00 O ATOM 1540 NE2 GLN A 105 -5.532 -6.885 1.090 1.00 0.00 N ATOM 0 H GLN A 105 -0.768 -7.535 -0.543 1.00 0.00 H new ATOM 0 HA GLN A 105 -0.673 -7.372 2.385 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -2.591 -8.483 0.325 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -2.698 -8.990 2.000 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -2.729 -6.418 2.521 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -3.145 -6.246 0.827 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -5.233 -6.426 0.229 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -6.522 -7.069 1.253 1.00 0.00 H new ATOM 1549 N THR A 106 0.912 -9.340 2.446 1.00 0.00 N ATOM 1550 CA THR A 106 1.653 -10.567 2.708 1.00 0.00 C ATOM 1551 C THR A 106 1.289 -11.152 4.068 1.00 0.00 C ATOM 1552 O THR A 106 1.418 -10.486 5.095 1.00 0.00 O ATOM 1553 CB THR A 106 3.174 -10.329 2.659 1.00 0.00 C ATOM 1554 OG1 THR A 106 3.495 -9.082 3.288 1.00 0.00 O ATOM 1555 CG2 THR A 106 3.673 -10.319 1.223 1.00 0.00 C ATOM 0 H THR A 106 1.308 -8.507 2.881 1.00 0.00 H new ATOM 0 HA THR A 106 1.376 -11.273 1.925 1.00 0.00 H new ATOM 0 HB THR A 106 3.664 -11.143 3.193 1.00 0.00 H new ATOM 0 HG1 THR A 106 2.909 -8.946 4.062 1.00 0.00 H new ATOM 0 HG21 THR A 106 4.750 -10.149 1.213 1.00 0.00 H new ATOM 0 HG22 THR A 106 3.452 -11.278 0.755 1.00 0.00 H new ATOM 0 HG23 THR A 106 3.175 -9.522 0.670 1.00 0.00 H new ATOM 1563 N ARG A 107 0.834 -12.400 4.066 1.00 0.00 N ATOM 1564 CA ARG A 107 0.451 -13.074 5.301 1.00 0.00 C ATOM 1565 C ARG A 107 1.232 -14.372 5.478 1.00 0.00 C ATOM 1566 O ARG A 107 1.157 -15.272 4.641 1.00 0.00 O ATOM 1567 CB ARG A 107 -1.050 -13.364 5.305 1.00 0.00 C ATOM 1568 CG ARG A 107 -1.582 -13.808 6.658 1.00 0.00 C ATOM 1569 CD ARG A 107 -2.806 -14.696 6.513 1.00 0.00 C ATOM 1570 NE ARG A 107 -3.412 -15.009 7.803 1.00 0.00 N ATOM 1571 CZ ARG A 107 -4.168 -14.157 8.487 1.00 0.00 C ATOM 1572 NH1 ARG A 107 -4.410 -12.947 8.004 1.00 0.00 N ATOM 1573 NH2 ARG A 107 -4.686 -14.516 9.655 1.00 0.00 N ATOM 0 H ARG A 107 0.721 -12.965 3.224 1.00 0.00 H new ATOM 0 HA ARG A 107 0.688 -12.412 6.134 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -1.585 -12.468 4.990 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -1.264 -14.138 4.568 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -0.803 -14.347 7.197 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -1.836 -12.932 7.255 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -3.540 -14.200 5.879 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -2.525 -15.622 6.011 1.00 0.00 H new ATOM 0 HE ARG A 107 -3.246 -15.933 8.202 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -4.016 -12.668 7.106 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -4.991 -12.294 8.531 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -4.504 -15.447 10.029 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -5.266 -13.861 10.179 1.00 0.00 H new ATOM 1587 N GLY A 108 1.981 -14.463 6.572 1.00 0.00 N ATOM 1588 CA GLY A 108 2.763 -15.657 6.837 1.00 0.00 C ATOM 1589 C GLY A 108 4.206 -15.341 7.178 1.00 0.00 C ATOM 1590 O GLY A 108 4.647 -14.199 7.045 1.00 0.00 O ATOM 0 H GLY A 108 2.061 -13.732 7.279 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.310 -16.208 7.661 1.00 0.00 H new ATOM 0 HA3 GLY A 108 2.734 -16.308 5.963 1.00 0.00 H new ATOM 1594 N GLY A 109 4.943 -16.355 7.619 1.00 0.00 N ATOM 1595 CA GLY A 109 6.336 -16.160 7.973 1.00 0.00 C ATOM 1596 C GLY A 109 6.509 -15.651 9.391 1.00 0.00 C ATOM 1597 O GLY A 109 6.444 -16.424 10.347 1.00 0.00 O ATOM 0 H GLY A 109 4.600 -17.308 7.737 1.00 0.00 H new ATOM 0 HA2 GLY A 109 6.871 -17.103 7.861 1.00 0.00 H new ATOM 0 HA3 GLY A 109 6.788 -15.452 7.279 1.00 0.00 H new ATOM 1601 N ASN A 110 6.730 -14.348 9.527 1.00 0.00 N ATOM 1602 CA ASN A 110 6.914 -13.737 10.838 1.00 0.00 C ATOM 1603 C ASN A 110 6.428 -12.292 10.839 1.00 0.00 C ATOM 1604 O ASN A 110 6.777 -11.508 11.722 1.00 0.00 O ATOM 1605 CB ASN A 110 8.388 -13.792 11.248 1.00 0.00 C ATOM 1606 CG ASN A 110 9.057 -15.085 10.827 1.00 0.00 C ATOM 1607 OD1 ASN A 110 8.612 -16.174 11.188 1.00 0.00 O ATOM 1608 ND2 ASN A 110 10.134 -14.971 10.058 1.00 0.00 N ATOM 0 H ASN A 110 6.786 -13.695 8.746 1.00 0.00 H new ATOM 0 HA ASN A 110 6.322 -14.301 11.559 1.00 0.00 H new ATOM 0 HB2 ASN A 110 8.918 -12.950 10.802 1.00 0.00 H new ATOM 0 HB3 ASN A 110 8.466 -13.681 12.330 1.00 0.00 H new ATOM 0 HD21 ASN A 110 10.627 -15.807 9.743 1.00 0.00 H new ATOM 0 HD22 ASN A 110 10.468 -14.048 9.782 1.00 0.00 H new ATOM 1615 N SER A 111 5.621 -11.944 9.842 1.00 0.00 N ATOM 1616 CA SER A 111 5.087 -10.591 9.728 1.00 0.00 C ATOM 1617 C SER A 111 3.586 -10.572 10.003 1.00 0.00 C ATOM 1618 O SER A 111 2.986 -9.507 10.147 1.00 0.00 O ATOM 1619 CB SER A 111 5.369 -10.026 8.335 1.00 0.00 C ATOM 1620 OG SER A 111 6.762 -9.969 8.079 1.00 0.00 O ATOM 0 H SER A 111 5.323 -12.579 9.102 1.00 0.00 H new ATOM 0 HA SER A 111 5.582 -9.968 10.473 1.00 0.00 H new ATOM 0 HB2 SER A 111 4.883 -10.647 7.582 1.00 0.00 H new ATOM 0 HB3 SER A 111 4.940 -9.028 8.250 1.00 0.00 H new ATOM 0 HG SER A 111 7.021 -10.724 7.511 1.00 0.00 H new ATOM 1626 N ASN A 112 2.986 -11.755 10.072 1.00 0.00 N ATOM 1627 CA ASN A 112 1.556 -11.873 10.328 1.00 0.00 C ATOM 1628 C ASN A 112 0.771 -10.867 9.493 1.00 0.00 C ATOM 1629 O ASN A 112 0.488 -9.757 9.943 1.00 0.00 O ATOM 1630 CB ASN A 112 1.262 -11.658 11.814 1.00 0.00 C ATOM 1631 CG ASN A 112 1.859 -12.747 12.684 1.00 0.00 C ATOM 1632 OD1 ASN A 112 1.569 -13.930 12.506 1.00 0.00 O ATOM 1633 ND2 ASN A 112 2.700 -12.352 13.634 1.00 0.00 N ATOM 0 H ASN A 112 3.468 -12.646 9.954 1.00 0.00 H new ATOM 0 HA ASN A 112 1.243 -12.878 10.045 1.00 0.00 H new ATOM 0 HB2 ASN A 112 1.658 -10.691 12.124 1.00 0.00 H new ATOM 0 HB3 ASN A 112 0.183 -11.625 11.967 1.00 0.00 H new ATOM 0 HD21 ASN A 112 3.133 -13.040 14.250 1.00 0.00 H new ATOM 0 HD22 ASN A 112 2.913 -11.361 13.747 1.00 0.00 H new ATOM 1640 N GLY A 113 0.422 -11.266 8.274 1.00 0.00 N ATOM 1641 CA GLY A 113 -0.326 -10.388 7.395 1.00 0.00 C ATOM 1642 C GLY A 113 0.154 -8.953 7.468 1.00 0.00 C ATOM 1643 O GLY A 113 -0.521 -8.093 8.034 1.00 0.00 O ATOM 0 H GLY A 113 0.644 -12.180 7.880 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -0.239 -10.746 6.369 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -1.383 -10.429 7.659 1.00 0.00 H new ATOM 1647 N ALA A 114 1.326 -8.692 6.896 1.00 0.00 N ATOM 1648 CA ALA A 114 1.895 -7.350 6.903 1.00 0.00 C ATOM 1649 C ALA A 114 1.921 -6.756 5.500 1.00 0.00 C ATOM 1650 O ALA A 114 2.326 -7.415 4.543 1.00 0.00 O ATOM 1651 CB ALA A 114 3.298 -7.375 7.493 1.00 0.00 C ATOM 0 H ALA A 114 1.898 -9.391 6.423 1.00 0.00 H new ATOM 0 HA ALA A 114 1.261 -6.718 7.525 1.00 0.00 H new ATOM 0 HB1 ALA A 114 3.711 -6.366 7.492 1.00 0.00 H new ATOM 0 HB2 ALA A 114 3.256 -7.749 8.516 1.00 0.00 H new ATOM 0 HB3 ALA A 114 3.933 -8.028 6.894 1.00 0.00 H new ATOM 1657 N LEU A 115 1.486 -5.505 5.384 1.00 0.00 N ATOM 1658 CA LEU A 115 1.462 -4.824 4.096 1.00 0.00 C ATOM 1659 C LEU A 115 2.860 -4.776 3.489 1.00 0.00 C ATOM 1660 O LEU A 115 3.582 -3.791 3.644 1.00 0.00 O ATOM 1661 CB LEU A 115 0.911 -3.406 4.253 1.00 0.00 C ATOM 1662 CG LEU A 115 -0.403 -3.138 3.516 1.00 0.00 C ATOM 1663 CD1 LEU A 115 -0.724 -1.652 3.524 1.00 0.00 C ATOM 1664 CD2 LEU A 115 -0.330 -3.664 2.091 1.00 0.00 C ATOM 0 H LEU A 115 1.146 -4.944 6.165 1.00 0.00 H new ATOM 0 HA LEU A 115 0.809 -5.384 3.426 1.00 0.00 H new ATOM 0 HB2 LEU A 115 0.763 -3.205 5.314 1.00 0.00 H new ATOM 0 HB3 LEU A 115 1.661 -2.699 3.897 1.00 0.00 H new ATOM 0 HG LEU A 115 -1.205 -3.664 4.035 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -1.662 -1.479 2.996 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -0.818 -1.306 4.553 1.00 0.00 H new ATOM 0 HD13 LEU A 115 0.078 -1.104 3.029 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -1.273 -3.465 1.581 1.00 0.00 H new ATOM 0 HD22 LEU A 115 0.482 -3.166 1.560 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -0.147 -4.738 2.109 1.00 0.00 H new ATOM 1676 N CYS A 116 3.237 -5.848 2.799 1.00 0.00 N ATOM 1677 CA CYS A 116 4.549 -5.930 2.172 1.00 0.00 C ATOM 1678 C CYS A 116 4.948 -4.592 1.561 1.00 0.00 C ATOM 1679 O CYS A 116 4.095 -3.765 1.235 1.00 0.00 O ATOM 1680 CB CYS A 116 4.560 -7.014 1.097 1.00 0.00 C ATOM 1681 SG CYS A 116 5.847 -8.281 1.333 1.00 0.00 S ATOM 0 H CYS A 116 2.651 -6.672 2.661 1.00 0.00 H new ATOM 0 HA CYS A 116 5.273 -6.187 2.945 1.00 0.00 H new ATOM 0 HB2 CYS A 116 3.585 -7.501 1.077 1.00 0.00 H new ATOM 0 HB3 CYS A 116 4.702 -6.544 0.124 1.00 0.00 H new ATOM 1686 N HIS A 117 6.251 -4.394 1.409 1.00 0.00 N ATOM 1687 CA HIS A 117 6.779 -3.162 0.836 1.00 0.00 C ATOM 1688 C HIS A 117 7.657 -3.463 -0.374 1.00 0.00 C ATOM 1689 O HIS A 117 8.728 -4.054 -0.245 1.00 0.00 O ATOM 1690 CB HIS A 117 7.579 -2.390 1.891 1.00 0.00 C ATOM 1691 CG HIS A 117 8.584 -1.440 1.314 1.00 0.00 C ATOM 1692 ND1 HIS A 117 9.735 -1.670 0.640 1.00 0.00 N flip ATOM 1693 CD2 HIS A 117 8.462 -0.069 1.403 1.00 0.00 C flip ATOM 1694 CE1 HIS A 117 10.281 -0.447 0.337 1.00 0.00 C flip ATOM 1695 NE2 HIS A 117 9.494 0.502 0.807 1.00 0.00 N flip ATOM 0 H HIS A 117 6.964 -5.073 1.675 1.00 0.00 H new ATOM 0 HA HIS A 117 5.941 -2.548 0.508 1.00 0.00 H new ATOM 0 HB2 HIS A 117 6.887 -1.833 2.522 1.00 0.00 H new ATOM 0 HB3 HIS A 117 8.095 -3.102 2.535 1.00 0.00 H new ATOM 0 HD2 HIS A 117 7.650 0.456 1.884 1.00 0.00 H new ATOM 0 HE1 HIS A 117 11.205 -0.288 -0.199 1.00 0.00 H new ATOM 0 HE2 HIS A 117 9.655 1.506 0.724 1.00 0.00 H new ATOM 1704 N PHE A 118 7.194 -3.054 -1.550 1.00 0.00 N ATOM 1705 CA PHE A 118 7.936 -3.281 -2.783 1.00 0.00 C ATOM 1706 C PHE A 118 8.563 -1.985 -3.286 1.00 0.00 C ATOM 1707 O PHE A 118 7.934 -0.927 -3.258 1.00 0.00 O ATOM 1708 CB PHE A 118 7.015 -3.863 -3.856 1.00 0.00 C ATOM 1709 CG PHE A 118 6.762 -5.336 -3.705 1.00 0.00 C ATOM 1710 CD1 PHE A 118 7.644 -6.262 -4.236 1.00 0.00 C ATOM 1711 CD2 PHE A 118 5.638 -5.794 -3.035 1.00 0.00 C ATOM 1712 CE1 PHE A 118 7.409 -7.616 -4.103 1.00 0.00 C ATOM 1713 CE2 PHE A 118 5.397 -7.149 -2.903 1.00 0.00 C ATOM 1714 CZ PHE A 118 6.286 -8.060 -3.439 1.00 0.00 C ATOM 0 H PHE A 118 6.308 -2.564 -1.675 1.00 0.00 H new ATOM 0 HA PHE A 118 8.734 -3.993 -2.572 1.00 0.00 H new ATOM 0 HB2 PHE A 118 6.062 -3.335 -3.828 1.00 0.00 H new ATOM 0 HB3 PHE A 118 7.453 -3.678 -4.837 1.00 0.00 H new ATOM 0 HD1 PHE A 118 8.525 -5.922 -4.760 1.00 0.00 H new ATOM 0 HD2 PHE A 118 4.943 -5.084 -2.611 1.00 0.00 H new ATOM 0 HE1 PHE A 118 8.106 -8.328 -4.520 1.00 0.00 H new ATOM 0 HE2 PHE A 118 4.516 -7.494 -2.382 1.00 0.00 H new ATOM 0 HZ PHE A 118 6.101 -9.119 -3.338 1.00 0.00 H new ATOM 1724 N PRO A 119 9.818 -2.052 -3.752 1.00 0.00 N ATOM 1725 CA PRO A 119 10.584 -3.296 -3.794 1.00 0.00 C ATOM 1726 C PRO A 119 11.264 -3.604 -2.463 1.00 0.00 C ATOM 1727 O PRO A 119 11.631 -2.696 -1.718 1.00 0.00 O ATOM 1728 CB PRO A 119 11.623 -3.008 -4.872 1.00 0.00 C ATOM 1729 CG PRO A 119 11.879 -1.542 -4.760 1.00 0.00 C ATOM 1730 CD PRO A 119 10.592 -0.914 -4.280 1.00 0.00 C ATOM 0 HA PRO A 119 9.958 -4.166 -3.995 1.00 0.00 H new ATOM 0 HB2 PRO A 119 12.534 -3.584 -4.709 1.00 0.00 H new ATOM 0 HB3 PRO A 119 11.252 -3.272 -5.862 1.00 0.00 H new ATOM 0 HG2 PRO A 119 12.691 -1.343 -4.061 1.00 0.00 H new ATOM 0 HG3 PRO A 119 12.177 -1.126 -5.722 1.00 0.00 H new ATOM 0 HD2 PRO A 119 10.776 -0.164 -3.510 1.00 0.00 H new ATOM 0 HD3 PRO A 119 10.064 -0.414 -5.092 1.00 0.00 H new ATOM 1738 N PHE A 120 11.430 -4.890 -2.173 1.00 0.00 N ATOM 1739 CA PHE A 120 12.069 -5.315 -0.932 1.00 0.00 C ATOM 1740 C PHE A 120 13.429 -5.944 -1.211 1.00 0.00 C ATOM 1741 O PHE A 120 13.670 -6.470 -2.298 1.00 0.00 O ATOM 1742 CB PHE A 120 11.177 -6.310 -0.186 1.00 0.00 C ATOM 1743 CG PHE A 120 11.044 -7.636 -0.879 1.00 0.00 C ATOM 1744 CD1 PHE A 120 10.211 -7.778 -1.976 1.00 0.00 C ATOM 1745 CD2 PHE A 120 11.752 -8.739 -0.432 1.00 0.00 C ATOM 1746 CE1 PHE A 120 10.087 -8.996 -2.615 1.00 0.00 C ATOM 1747 CE2 PHE A 120 11.633 -9.960 -1.067 1.00 0.00 C ATOM 1748 CZ PHE A 120 10.799 -10.090 -2.160 1.00 0.00 C ATOM 0 H PHE A 120 11.132 -5.655 -2.778 1.00 0.00 H new ATOM 0 HA PHE A 120 12.216 -4.433 -0.308 1.00 0.00 H new ATOM 0 HB2 PHE A 120 11.583 -6.471 0.813 1.00 0.00 H new ATOM 0 HB3 PHE A 120 10.186 -5.874 -0.061 1.00 0.00 H new ATOM 0 HD1 PHE A 120 9.652 -6.927 -2.336 1.00 0.00 H new ATOM 0 HD2 PHE A 120 12.405 -8.644 0.423 1.00 0.00 H new ATOM 0 HE1 PHE A 120 9.434 -9.094 -3.470 1.00 0.00 H new ATOM 0 HE2 PHE A 120 12.192 -10.812 -0.709 1.00 0.00 H new ATOM 0 HZ PHE A 120 10.703 -11.044 -2.658 1.00 0.00 H new ATOM 1758 N LEU A 121 14.319 -5.882 -0.226 1.00 0.00 N ATOM 1759 CA LEU A 121 15.657 -6.443 -0.370 1.00 0.00 C ATOM 1760 C LEU A 121 15.675 -7.920 -0.015 1.00 0.00 C ATOM 1761 O LEU A 121 14.883 -8.385 0.801 1.00 0.00 O ATOM 1762 CB LEU A 121 16.647 -5.704 0.529 1.00 0.00 C ATOM 1763 CG LEU A 121 18.090 -5.633 0.029 1.00 0.00 C ATOM 1764 CD1 LEU A 121 18.134 -5.553 -1.486 1.00 0.00 C ATOM 1765 CD2 LEU A 121 18.788 -4.438 0.650 1.00 0.00 C ATOM 0 H LEU A 121 14.138 -5.449 0.680 1.00 0.00 H new ATOM 0 HA LEU A 121 15.949 -6.325 -1.413 1.00 0.00 H new ATOM 0 HB2 LEU A 121 16.284 -4.686 0.674 1.00 0.00 H new ATOM 0 HB3 LEU A 121 16.647 -6.185 1.507 1.00 0.00 H new ATOM 0 HG LEU A 121 18.611 -6.542 0.329 1.00 0.00 H new ATOM 0 HD11 LEU A 121 19.171 -5.503 -1.818 1.00 0.00 H new ATOM 0 HD12 LEU A 121 17.659 -6.437 -1.911 1.00 0.00 H new ATOM 0 HD13 LEU A 121 17.604 -4.661 -1.819 1.00 0.00 H new ATOM 0 HD21 LEU A 121 19.816 -4.390 0.291 1.00 0.00 H new ATOM 0 HD22 LEU A 121 18.264 -3.524 0.370 1.00 0.00 H new ATOM 0 HD23 LEU A 121 18.787 -4.539 1.735 1.00 0.00 H new ATOM 1777 N TYR A 122 16.604 -8.637 -0.622 1.00 0.00 N ATOM 1778 CA TYR A 122 16.772 -10.062 -0.374 1.00 0.00 C ATOM 1779 C TYR A 122 18.229 -10.453 -0.570 1.00 0.00 C ATOM 1780 O TYR A 122 18.836 -10.116 -1.586 1.00 0.00 O ATOM 1781 CB TYR A 122 15.884 -10.891 -1.299 1.00 0.00 C ATOM 1782 CG TYR A 122 15.975 -12.373 -1.023 1.00 0.00 C ATOM 1783 CD1 TYR A 122 16.942 -13.155 -1.642 1.00 0.00 C ATOM 1784 CD2 TYR A 122 15.104 -12.986 -0.134 1.00 0.00 C ATOM 1785 CE1 TYR A 122 17.035 -14.509 -1.382 1.00 0.00 C ATOM 1786 CE2 TYR A 122 15.191 -14.337 0.132 1.00 0.00 C ATOM 1787 CZ TYR A 122 16.158 -15.096 -0.495 1.00 0.00 C ATOM 1788 OH TYR A 122 16.248 -16.444 -0.232 1.00 0.00 O ATOM 0 H TYR A 122 17.262 -8.251 -1.299 1.00 0.00 H new ATOM 0 HA TYR A 122 16.475 -10.265 0.655 1.00 0.00 H new ATOM 0 HB2 TYR A 122 14.849 -10.568 -1.187 1.00 0.00 H new ATOM 0 HB3 TYR A 122 16.167 -10.701 -2.334 1.00 0.00 H new ATOM 0 HD1 TYR A 122 17.631 -12.698 -2.337 1.00 0.00 H new ATOM 0 HD2 TYR A 122 14.345 -12.396 0.358 1.00 0.00 H new ATOM 0 HE1 TYR A 122 17.791 -15.105 -1.871 1.00 0.00 H new ATOM 0 HE2 TYR A 122 14.506 -14.798 0.828 1.00 0.00 H new ATOM 0 HH TYR A 122 15.557 -16.698 0.415 1.00 0.00 H new ATOM 1798 N ASN A 123 18.795 -11.149 0.408 1.00 0.00 N ATOM 1799 CA ASN A 123 20.190 -11.554 0.324 1.00 0.00 C ATOM 1800 C ASN A 123 21.056 -10.345 -0.015 1.00 0.00 C ATOM 1801 O ASN A 123 22.160 -10.483 -0.543 1.00 0.00 O ATOM 1802 CB ASN A 123 20.368 -12.642 -0.738 1.00 0.00 C ATOM 1803 CG ASN A 123 20.712 -13.988 -0.134 1.00 0.00 C ATOM 1804 OD1 ASN A 123 19.927 -14.562 0.622 1.00 0.00 O ATOM 1805 ND2 ASN A 123 21.891 -14.502 -0.465 1.00 0.00 N ATOM 0 H ASN A 123 18.315 -11.442 1.259 1.00 0.00 H new ATOM 0 HA ASN A 123 20.499 -11.959 1.288 1.00 0.00 H new ATOM 0 HB2 ASN A 123 19.451 -12.732 -1.320 1.00 0.00 H new ATOM 0 HB3 ASN A 123 21.156 -12.345 -1.430 1.00 0.00 H new ATOM 0 HD21 ASN A 123 22.177 -15.406 -0.089 1.00 0.00 H new ATOM 0 HD22 ASN A 123 22.511 -13.993 -1.095 1.00 0.00 H new ATOM 1812 N ASN A 124 20.535 -9.158 0.290 1.00 0.00 N ATOM 1813 CA ASN A 124 21.238 -7.911 0.017 1.00 0.00 C ATOM 1814 C ASN A 124 21.038 -7.479 -1.434 1.00 0.00 C ATOM 1815 O ASN A 124 21.470 -6.399 -1.836 1.00 0.00 O ATOM 1816 CB ASN A 124 22.730 -8.063 0.309 1.00 0.00 C ATOM 1817 CG ASN A 124 23.000 -8.978 1.487 1.00 0.00 C ATOM 1818 OD1 ASN A 124 22.166 -9.121 2.381 1.00 0.00 O ATOM 1819 ND2 ASN A 124 24.170 -9.605 1.494 1.00 0.00 N ATOM 0 H ASN A 124 19.622 -9.036 0.729 1.00 0.00 H new ATOM 0 HA ASN A 124 20.823 -7.143 0.670 1.00 0.00 H new ATOM 0 HB2 ASN A 124 23.232 -8.456 -0.575 1.00 0.00 H new ATOM 0 HB3 ASN A 124 23.160 -7.082 0.509 1.00 0.00 H new ATOM 0 HD21 ASN A 124 24.407 -10.234 2.261 1.00 0.00 H new ATOM 0 HD22 ASN A 124 24.832 -9.457 0.732 1.00 0.00 H new ATOM 1826 N HIS A 125 20.378 -8.329 -2.216 1.00 0.00 N ATOM 1827 CA HIS A 125 20.120 -8.033 -3.620 1.00 0.00 C ATOM 1828 C HIS A 125 18.740 -7.409 -3.799 1.00 0.00 C ATOM 1829 O HIS A 125 17.723 -8.026 -3.482 1.00 0.00 O ATOM 1830 CB HIS A 125 20.229 -9.307 -4.460 1.00 0.00 C ATOM 1831 CG HIS A 125 20.190 -9.057 -5.936 1.00 0.00 C ATOM 1832 ND1 HIS A 125 19.774 -10.003 -6.849 1.00 0.00 N ATOM 1833 CD2 HIS A 125 20.517 -7.959 -6.658 1.00 0.00 C ATOM 1834 CE1 HIS A 125 19.847 -9.498 -8.068 1.00 0.00 C ATOM 1835 NE2 HIS A 125 20.294 -8.260 -7.979 1.00 0.00 N ATOM 0 H HIS A 125 20.013 -9.228 -1.900 1.00 0.00 H new ATOM 0 HA HIS A 125 20.870 -7.318 -3.959 1.00 0.00 H new ATOM 0 HB2 HIS A 125 21.159 -9.818 -4.211 1.00 0.00 H new ATOM 0 HB3 HIS A 125 19.414 -9.980 -4.192 1.00 0.00 H new ATOM 0 HD2 HIS A 125 20.885 -7.022 -6.268 1.00 0.00 H new ATOM 0 HE1 HIS A 125 19.585 -10.011 -8.981 1.00 0.00 H new ATOM 0 HE2 HIS A 125 20.449 -7.628 -8.765 1.00 0.00 H new ATOM 1844 N ASN A 126 18.713 -6.183 -4.307 1.00 0.00 N ATOM 1845 CA ASN A 126 17.460 -5.471 -4.528 1.00 0.00 C ATOM 1846 C ASN A 126 16.422 -6.378 -5.182 1.00 0.00 C ATOM 1847 O ASN A 126 16.529 -6.711 -6.362 1.00 0.00 O ATOM 1848 CB ASN A 126 17.697 -4.237 -5.399 1.00 0.00 C ATOM 1849 CG ASN A 126 17.686 -2.950 -4.597 1.00 0.00 C ATOM 1850 OD1 ASN A 126 16.728 -2.179 -4.659 1.00 0.00 O ATOM 1851 ND2 ASN A 126 18.754 -2.715 -3.841 1.00 0.00 N ATOM 0 H ASN A 126 19.547 -5.660 -4.574 1.00 0.00 H new ATOM 0 HA ASN A 126 17.077 -5.155 -3.558 1.00 0.00 H new ATOM 0 HB2 ASN A 126 18.655 -4.335 -5.910 1.00 0.00 H new ATOM 0 HB3 ASN A 126 16.928 -4.187 -6.170 1.00 0.00 H new ATOM 0 HD21 ASN A 126 18.804 -1.865 -3.279 1.00 0.00 H new ATOM 0 HD22 ASN A 126 19.523 -3.385 -3.823 1.00 0.00 H new ATOM 1857 N TYR A 127 15.415 -6.770 -4.408 1.00 0.00 N ATOM 1858 CA TYR A 127 14.354 -7.636 -4.912 1.00 0.00 C ATOM 1859 C TYR A 127 13.067 -6.845 -5.127 1.00 0.00 C ATOM 1860 O TYR A 127 12.768 -5.917 -4.377 1.00 0.00 O ATOM 1861 CB TYR A 127 14.101 -8.790 -3.939 1.00 0.00 C ATOM 1862 CG TYR A 127 14.886 -10.041 -4.263 1.00 0.00 C ATOM 1863 CD1 TYR A 127 16.165 -9.961 -4.799 1.00 0.00 C ATOM 1864 CD2 TYR A 127 14.348 -11.300 -4.033 1.00 0.00 C ATOM 1865 CE1 TYR A 127 16.886 -11.102 -5.098 1.00 0.00 C ATOM 1866 CE2 TYR A 127 15.063 -12.446 -4.328 1.00 0.00 C ATOM 1867 CZ TYR A 127 16.330 -12.342 -4.859 1.00 0.00 C ATOM 1868 OH TYR A 127 17.045 -13.479 -5.155 1.00 0.00 O ATOM 0 H TYR A 127 15.311 -6.502 -3.429 1.00 0.00 H new ATOM 0 HA TYR A 127 14.675 -8.044 -5.870 1.00 0.00 H new ATOM 0 HB2 TYR A 127 14.353 -8.465 -2.930 1.00 0.00 H new ATOM 0 HB3 TYR A 127 13.037 -9.028 -3.941 1.00 0.00 H new ATOM 0 HD1 TYR A 127 16.603 -8.992 -4.985 1.00 0.00 H new ATOM 0 HD2 TYR A 127 13.355 -11.386 -3.617 1.00 0.00 H new ATOM 0 HE1 TYR A 127 17.879 -11.023 -5.516 1.00 0.00 H new ATOM 0 HE2 TYR A 127 14.630 -13.418 -4.143 1.00 0.00 H new ATOM 0 HH TYR A 127 16.512 -14.269 -4.926 1.00 0.00 H new ATOM 1878 N THR A 128 12.311 -7.213 -6.157 1.00 0.00 N ATOM 1879 CA THR A 128 11.061 -6.529 -6.464 1.00 0.00 C ATOM 1880 C THR A 128 10.019 -7.490 -7.028 1.00 0.00 C ATOM 1881 O THR A 128 9.674 -7.427 -8.207 1.00 0.00 O ATOM 1882 CB THR A 128 11.282 -5.382 -7.469 1.00 0.00 C ATOM 1883 OG1 THR A 128 11.327 -5.899 -8.804 1.00 0.00 O ATOM 1884 CG2 THR A 128 12.574 -4.639 -7.167 1.00 0.00 C ATOM 0 H THR A 128 12.542 -7.978 -6.791 1.00 0.00 H new ATOM 0 HA THR A 128 10.693 -6.118 -5.524 1.00 0.00 H new ATOM 0 HB THR A 128 10.449 -4.685 -7.377 1.00 0.00 H new ATOM 0 HG1 THR A 128 10.421 -6.131 -9.096 1.00 0.00 H new ATOM 0 HG21 THR A 128 12.708 -3.834 -7.890 1.00 0.00 H new ATOM 0 HG22 THR A 128 12.526 -4.220 -6.162 1.00 0.00 H new ATOM 0 HG23 THR A 128 13.415 -5.330 -7.233 1.00 0.00 H new ATOM 1892 N ASP A 129 9.514 -8.371 -6.172 1.00 0.00 N ATOM 1893 CA ASP A 129 8.501 -9.338 -6.578 1.00 0.00 C ATOM 1894 C ASP A 129 8.406 -10.484 -5.583 1.00 0.00 C ATOM 1895 O ASP A 129 9.414 -10.945 -5.050 1.00 0.00 O ATOM 1896 CB ASP A 129 8.808 -9.879 -7.976 1.00 0.00 C ATOM 1897 CG ASP A 129 7.794 -9.425 -9.008 1.00 0.00 C ATOM 1898 OD1 ASP A 129 6.856 -8.689 -8.636 1.00 0.00 O ATOM 1899 OD2 ASP A 129 7.938 -9.805 -10.189 1.00 0.00 O ATOM 0 H ASP A 129 9.790 -8.436 -5.192 1.00 0.00 H new ATOM 0 HA ASP A 129 7.539 -8.825 -6.600 1.00 0.00 H new ATOM 0 HB2 ASP A 129 9.802 -9.551 -8.279 1.00 0.00 H new ATOM 0 HB3 ASP A 129 8.827 -10.968 -7.945 1.00 0.00 H new ATOM 1904 N CYS A 130 7.180 -10.932 -5.336 1.00 0.00 N ATOM 1905 CA CYS A 130 6.937 -12.023 -4.402 1.00 0.00 C ATOM 1906 C CYS A 130 7.958 -13.138 -4.590 1.00 0.00 C ATOM 1907 O CYS A 130 7.742 -14.070 -5.364 1.00 0.00 O ATOM 1908 CB CYS A 130 5.522 -12.573 -4.588 1.00 0.00 C ATOM 1909 SG CYS A 130 4.972 -13.679 -3.248 1.00 0.00 S ATOM 0 H CYS A 130 6.338 -10.555 -5.771 1.00 0.00 H new ATOM 0 HA CYS A 130 7.038 -11.632 -3.390 1.00 0.00 H new ATOM 0 HB2 CYS A 130 4.826 -11.738 -4.664 1.00 0.00 H new ATOM 0 HB3 CYS A 130 5.475 -13.114 -5.533 1.00 0.00 H new ATOM 1914 N THR A 131 9.073 -13.034 -3.877 1.00 0.00 N ATOM 1915 CA THR A 131 10.133 -14.031 -3.963 1.00 0.00 C ATOM 1916 C THR A 131 9.751 -15.306 -3.220 1.00 0.00 C ATOM 1917 O THR A 131 9.059 -15.261 -2.202 1.00 0.00 O ATOM 1918 CB THR A 131 11.458 -13.493 -3.392 1.00 0.00 C ATOM 1919 OG1 THR A 131 12.554 -14.286 -3.865 1.00 0.00 O ATOM 1920 CG2 THR A 131 11.438 -13.507 -1.870 1.00 0.00 C ATOM 0 H THR A 131 9.267 -12.268 -3.232 1.00 0.00 H new ATOM 0 HA THR A 131 10.268 -14.258 -5.020 1.00 0.00 H new ATOM 0 HB THR A 131 11.581 -12.464 -3.729 1.00 0.00 H new ATOM 0 HG1 THR A 131 13.199 -14.418 -3.139 1.00 0.00 H new ATOM 0 HG21 THR A 131 12.385 -13.123 -1.490 1.00 0.00 H new ATOM 0 HG22 THR A 131 10.622 -12.880 -1.511 1.00 0.00 H new ATOM 0 HG23 THR A 131 11.293 -14.528 -1.517 1.00 0.00 H new ATOM 1928 N SER A 132 10.208 -16.443 -3.735 1.00 0.00 N ATOM 1929 CA SER A 132 9.915 -17.732 -3.120 1.00 0.00 C ATOM 1930 C SER A 132 11.201 -18.491 -2.807 1.00 0.00 C ATOM 1931 O SER A 132 11.214 -19.720 -2.764 1.00 0.00 O ATOM 1932 CB SER A 132 9.026 -18.571 -4.041 1.00 0.00 C ATOM 1933 OG SER A 132 8.054 -19.287 -3.301 1.00 0.00 O ATOM 0 H SER A 132 10.782 -16.498 -4.576 1.00 0.00 H new ATOM 0 HA SER A 132 9.386 -17.547 -2.185 1.00 0.00 H new ATOM 0 HB2 SER A 132 8.531 -17.922 -4.764 1.00 0.00 H new ATOM 0 HB3 SER A 132 9.642 -19.269 -4.608 1.00 0.00 H new ATOM 0 HG SER A 132 7.499 -19.813 -3.914 1.00 0.00 H new ATOM 1939 N GLU A 133 12.281 -17.747 -2.588 1.00 0.00 N ATOM 1940 CA GLU A 133 13.573 -18.348 -2.279 1.00 0.00 C ATOM 1941 C GLU A 133 13.539 -19.046 -0.923 1.00 0.00 C ATOM 1942 O GLU A 133 12.922 -18.555 0.023 1.00 0.00 O ATOM 1943 CB GLU A 133 14.670 -17.282 -2.290 1.00 0.00 C ATOM 1944 CG GLU A 133 15.081 -16.844 -3.687 1.00 0.00 C ATOM 1945 CD GLU A 133 16.485 -17.284 -4.046 1.00 0.00 C ATOM 1946 OE1 GLU A 133 17.371 -17.222 -3.167 1.00 0.00 O ATOM 1947 OE2 GLU A 133 16.701 -17.690 -5.208 1.00 0.00 O ATOM 0 H GLU A 133 12.287 -16.727 -2.619 1.00 0.00 H new ATOM 0 HA GLU A 133 13.792 -19.093 -3.044 1.00 0.00 H new ATOM 0 HB2 GLU A 133 14.324 -16.411 -1.733 1.00 0.00 H new ATOM 0 HB3 GLU A 133 15.545 -17.668 -1.767 1.00 0.00 H new ATOM 0 HG2 GLU A 133 14.379 -17.254 -4.413 1.00 0.00 H new ATOM 0 HG3 GLU A 133 15.015 -15.758 -3.757 1.00 0.00 H new ATOM 1954 N GLY A 134 14.205 -20.192 -0.837 1.00 0.00 N ATOM 1955 CA GLY A 134 14.240 -20.938 0.406 1.00 0.00 C ATOM 1956 C GLY A 134 12.935 -21.660 0.686 1.00 0.00 C ATOM 1957 O GLY A 134 12.811 -22.364 1.688 1.00 0.00 O ATOM 0 H GLY A 134 14.722 -20.618 -1.607 1.00 0.00 H new ATOM 0 HA2 GLY A 134 15.052 -21.664 0.368 1.00 0.00 H new ATOM 0 HA3 GLY A 134 14.459 -20.257 1.229 1.00 0.00 H new ATOM 1961 N ARG A 135 11.962 -21.485 -0.202 1.00 0.00 N ATOM 1962 CA ARG A 135 10.661 -22.125 -0.045 1.00 0.00 C ATOM 1963 C ARG A 135 10.377 -23.072 -1.206 1.00 0.00 C ATOM 1964 O ARG A 135 10.183 -22.638 -2.341 1.00 0.00 O ATOM 1965 CB ARG A 135 9.558 -21.069 0.047 1.00 0.00 C ATOM 1966 CG ARG A 135 9.625 -20.229 1.313 1.00 0.00 C ATOM 1967 CD ARG A 135 8.251 -19.724 1.720 1.00 0.00 C ATOM 1968 NE ARG A 135 7.344 -20.818 2.057 1.00 0.00 N ATOM 1969 CZ ARG A 135 7.260 -21.357 3.268 1.00 0.00 C ATOM 1970 NH1 ARG A 135 8.025 -20.904 4.253 1.00 0.00 N ATOM 1971 NH2 ARG A 135 6.410 -22.348 3.497 1.00 0.00 N ATOM 0 H ARG A 135 12.050 -20.906 -1.037 1.00 0.00 H new ATOM 0 HA ARG A 135 10.678 -22.705 0.878 1.00 0.00 H new ATOM 0 HB2 ARG A 135 9.623 -20.411 -0.820 1.00 0.00 H new ATOM 0 HB3 ARG A 135 8.588 -21.564 -0.000 1.00 0.00 H new ATOM 0 HG2 ARG A 135 10.050 -20.822 2.122 1.00 0.00 H new ATOM 0 HG3 ARG A 135 10.293 -19.382 1.154 1.00 0.00 H new ATOM 0 HD2 ARG A 135 8.349 -19.057 2.577 1.00 0.00 H new ATOM 0 HD3 ARG A 135 7.825 -19.137 0.906 1.00 0.00 H new ATOM 0 HE ARG A 135 6.742 -21.189 1.322 1.00 0.00 H new ATOM 0 HH11 ARG A 135 8.679 -20.140 4.081 1.00 0.00 H new ATOM 0 HH12 ARG A 135 7.959 -21.319 5.182 1.00 0.00 H new ATOM 0 HH21 ARG A 135 5.819 -22.698 2.743 1.00 0.00 H new ATOM 0 HH22 ARG A 135 6.347 -22.761 4.428 1.00 0.00 H new ATOM 1985 N ARG A 136 10.355 -24.369 -0.913 1.00 0.00 N ATOM 1986 CA ARG A 136 10.093 -25.378 -1.932 1.00 0.00 C ATOM 1987 C ARG A 136 8.597 -25.631 -2.077 1.00 0.00 C ATOM 1988 O ARG A 136 8.178 -26.604 -2.705 1.00 0.00 O ATOM 1989 CB ARG A 136 10.812 -26.683 -1.584 1.00 0.00 C ATOM 1990 CG ARG A 136 11.848 -27.100 -2.615 1.00 0.00 C ATOM 1991 CD ARG A 136 12.569 -28.372 -2.197 1.00 0.00 C ATOM 1992 NE ARG A 136 13.865 -28.508 -2.855 1.00 0.00 N ATOM 1993 CZ ARG A 136 14.881 -29.195 -2.342 1.00 0.00 C ATOM 1994 NH1 ARG A 136 14.749 -29.807 -1.173 1.00 0.00 N ATOM 1995 NH2 ARG A 136 16.031 -29.273 -3.000 1.00 0.00 N ATOM 0 H ARG A 136 10.515 -24.745 0.022 1.00 0.00 H new ATOM 0 HA ARG A 136 10.473 -25.004 -2.883 1.00 0.00 H new ATOM 0 HB2 ARG A 136 11.300 -26.572 -0.615 1.00 0.00 H new ATOM 0 HB3 ARG A 136 10.074 -27.478 -1.480 1.00 0.00 H new ATOM 0 HG2 ARG A 136 11.362 -27.256 -3.578 1.00 0.00 H new ATOM 0 HG3 ARG A 136 12.573 -26.297 -2.750 1.00 0.00 H new ATOM 0 HD2 ARG A 136 12.710 -28.370 -1.116 1.00 0.00 H new ATOM 0 HD3 ARG A 136 11.949 -29.236 -2.436 1.00 0.00 H new ATOM 0 HE ARG A 136 13.998 -28.051 -3.757 1.00 0.00 H new ATOM 0 HH11 ARG A 136 13.866 -29.751 -0.665 1.00 0.00 H new ATOM 0 HH12 ARG A 136 15.530 -30.333 -0.782 1.00 0.00 H new ATOM 0 HH21 ARG A 136 16.136 -28.805 -3.900 1.00 0.00 H new ATOM 0 HH22 ARG A 136 16.810 -29.800 -2.605 1.00 0.00 H new ATOM 2009 N ASP A 137 7.793 -24.750 -1.490 1.00 0.00 N ATOM 2010 CA ASP A 137 6.342 -24.877 -1.553 1.00 0.00 C ATOM 2011 C ASP A 137 5.738 -23.791 -2.436 1.00 0.00 C ATOM 2012 O ASP A 137 6.190 -22.646 -2.424 1.00 0.00 O ATOM 2013 CB ASP A 137 5.736 -24.799 -0.149 1.00 0.00 C ATOM 2014 CG ASP A 137 6.686 -24.187 0.863 1.00 0.00 C ATOM 2015 OD1 ASP A 137 7.389 -23.217 0.506 1.00 0.00 O ATOM 2016 OD2 ASP A 137 6.727 -24.675 2.011 1.00 0.00 O ATOM 0 H ASP A 137 8.123 -23.940 -0.965 1.00 0.00 H new ATOM 0 HA ASP A 137 6.110 -25.849 -1.988 1.00 0.00 H new ATOM 0 HB2 ASP A 137 4.820 -24.209 -0.185 1.00 0.00 H new ATOM 0 HB3 ASP A 137 5.458 -25.801 0.179 1.00 0.00 H new ATOM 2021 N ASN A 138 4.716 -24.159 -3.202 1.00 0.00 N ATOM 2022 CA ASN A 138 4.051 -23.220 -4.092 1.00 0.00 C ATOM 2023 C ASN A 138 3.338 -22.127 -3.302 1.00 0.00 C ATOM 2024 O ASN A 138 2.122 -21.963 -3.407 1.00 0.00 O ATOM 2025 CB ASN A 138 3.050 -23.955 -4.985 1.00 0.00 C ATOM 2026 CG ASN A 138 3.381 -23.820 -6.458 1.00 0.00 C ATOM 2027 OD1 ASN A 138 4.484 -24.154 -6.891 1.00 0.00 O ATOM 2028 ND2 ASN A 138 2.424 -23.329 -7.238 1.00 0.00 N ATOM 0 H ASN A 138 4.331 -25.103 -3.223 1.00 0.00 H new ATOM 0 HA ASN A 138 4.812 -22.751 -4.717 1.00 0.00 H new ATOM 0 HB2 ASN A 138 3.033 -25.011 -4.715 1.00 0.00 H new ATOM 0 HB3 ASN A 138 2.049 -23.563 -4.803 1.00 0.00 H new ATOM 0 HD21 ASN A 138 2.589 -23.216 -8.238 1.00 0.00 H new ATOM 0 HD22 ASN A 138 1.524 -23.065 -6.837 1.00 0.00 H new ATOM 2035 N MET A 139 4.101 -21.379 -2.510 1.00 0.00 N ATOM 2036 CA MET A 139 3.541 -20.302 -1.704 1.00 0.00 C ATOM 2037 C MET A 139 4.425 -19.060 -1.766 1.00 0.00 C ATOM 2038 O MET A 139 4.906 -18.576 -0.741 1.00 0.00 O ATOM 2039 CB MET A 139 3.379 -20.754 -0.251 1.00 0.00 C ATOM 2040 CG MET A 139 2.406 -19.903 0.546 1.00 0.00 C ATOM 2041 SD MET A 139 2.262 -20.435 2.263 1.00 0.00 S ATOM 2042 CE MET A 139 1.348 -21.963 2.069 1.00 0.00 C ATOM 0 H MET A 139 5.109 -21.500 -2.410 1.00 0.00 H new ATOM 0 HA MET A 139 2.561 -20.050 -2.110 1.00 0.00 H new ATOM 0 HB2 MET A 139 3.039 -21.789 -0.237 1.00 0.00 H new ATOM 0 HB3 MET A 139 4.353 -20.732 0.238 1.00 0.00 H new ATOM 0 HG2 MET A 139 2.732 -18.863 0.518 1.00 0.00 H new ATOM 0 HG3 MET A 139 1.424 -19.942 0.074 1.00 0.00 H new ATOM 0 HE1 MET A 139 0.981 -22.293 3.041 1.00 0.00 H new ATOM 0 HE2 MET A 139 0.504 -21.800 1.398 1.00 0.00 H new ATOM 0 HE3 MET A 139 2.002 -22.727 1.650 1.00 0.00 H new ATOM 2052 N LYS A 140 4.634 -18.550 -2.976 1.00 0.00 N ATOM 2053 CA LYS A 140 5.461 -17.365 -3.174 1.00 0.00 C ATOM 2054 C LYS A 140 5.280 -16.377 -2.025 1.00 0.00 C ATOM 2055 O LYS A 140 4.166 -16.162 -1.547 1.00 0.00 O ATOM 2056 CB LYS A 140 5.111 -16.691 -4.502 1.00 0.00 C ATOM 2057 CG LYS A 140 3.724 -16.070 -4.522 1.00 0.00 C ATOM 2058 CD LYS A 140 2.665 -17.084 -4.921 1.00 0.00 C ATOM 2059 CE LYS A 140 1.899 -16.635 -6.154 1.00 0.00 C ATOM 2060 NZ LYS A 140 2.669 -16.876 -7.406 1.00 0.00 N ATOM 0 H LYS A 140 4.242 -18.939 -3.834 1.00 0.00 H new ATOM 0 HA LYS A 140 6.504 -17.679 -3.197 1.00 0.00 H new ATOM 0 HB2 LYS A 140 5.849 -15.917 -4.713 1.00 0.00 H new ATOM 0 HB3 LYS A 140 5.182 -17.427 -5.303 1.00 0.00 H new ATOM 0 HG2 LYS A 140 3.490 -15.667 -3.536 1.00 0.00 H new ATOM 0 HG3 LYS A 140 3.709 -15.233 -5.220 1.00 0.00 H new ATOM 0 HD2 LYS A 140 3.137 -18.047 -5.116 1.00 0.00 H new ATOM 0 HD3 LYS A 140 1.971 -17.231 -4.094 1.00 0.00 H new ATOM 0 HE2 LYS A 140 0.949 -17.167 -6.204 1.00 0.00 H new ATOM 0 HE3 LYS A 140 1.666 -15.573 -6.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 2.111 -16.556 -8.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 3.565 -16.348 -7.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 2.869 -17.892 -7.500 1.00 0.00 H new ATOM 2074 N TRP A 141 6.383 -15.779 -1.587 1.00 0.00 N ATOM 2075 CA TRP A 141 6.345 -14.815 -0.495 1.00 0.00 C ATOM 2076 C TRP A 141 7.022 -13.507 -0.894 1.00 0.00 C ATOM 2077 O TRP A 141 7.648 -13.415 -1.950 1.00 0.00 O ATOM 2078 CB TRP A 141 7.021 -15.395 0.749 1.00 0.00 C ATOM 2079 CG TRP A 141 8.452 -15.776 0.524 1.00 0.00 C ATOM 2080 CD1 TRP A 141 8.917 -16.956 0.021 1.00 0.00 C ATOM 2081 CD2 TRP A 141 9.603 -14.972 0.797 1.00 0.00 C ATOM 2082 NE1 TRP A 141 10.289 -16.935 -0.037 1.00 0.00 N ATOM 2083 CE2 TRP A 141 10.734 -15.728 0.433 1.00 0.00 C ATOM 2084 CE3 TRP A 141 9.790 -13.686 1.311 1.00 0.00 C ATOM 2085 CZ2 TRP A 141 12.031 -15.239 0.568 1.00 0.00 C ATOM 2086 CZ3 TRP A 141 11.078 -13.203 1.445 1.00 0.00 C ATOM 2087 CH2 TRP A 141 12.183 -13.978 1.075 1.00 0.00 C ATOM 0 H TRP A 141 7.313 -15.945 -1.971 1.00 0.00 H new ATOM 0 HA TRP A 141 5.300 -14.605 -0.268 1.00 0.00 H new ATOM 0 HB2 TRP A 141 6.970 -14.664 1.556 1.00 0.00 H new ATOM 0 HB3 TRP A 141 6.466 -16.273 1.079 1.00 0.00 H new ATOM 0 HD1 TRP A 141 8.297 -17.785 -0.286 1.00 0.00 H new ATOM 0 HE1 TRP A 141 10.880 -17.694 -0.375 1.00 0.00 H new ATOM 0 HE3 TRP A 141 8.943 -13.080 1.598 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 12.886 -15.834 0.283 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 11.234 -12.211 1.842 1.00 0.00 H new ATOM 0 HH2 TRP A 141 13.177 -13.572 1.192 1.00 0.00 H new ATOM 2098 N CYS A 142 6.887 -12.497 -0.042 1.00 0.00 N ATOM 2099 CA CYS A 142 7.481 -11.191 -0.302 1.00 0.00 C ATOM 2100 C CYS A 142 8.066 -10.601 0.978 1.00 0.00 C ATOM 2101 O CYS A 142 7.751 -11.047 2.081 1.00 0.00 O ATOM 2102 CB CYS A 142 6.426 -10.248 -0.897 1.00 0.00 C ATOM 2103 SG CYS A 142 6.671 -8.482 -0.512 1.00 0.00 S ATOM 0 H CYS A 142 6.371 -12.558 0.836 1.00 0.00 H new ATOM 0 HA CYS A 142 8.292 -11.311 -1.020 1.00 0.00 H new ATOM 0 HB2 CYS A 142 6.419 -10.371 -1.980 1.00 0.00 H new ATOM 0 HB3 CYS A 142 5.443 -10.551 -0.535 1.00 0.00 H new ATOM 2108 N GLY A 143 8.919 -9.593 0.822 1.00 0.00 N ATOM 2109 CA GLY A 143 9.533 -8.955 1.971 1.00 0.00 C ATOM 2110 C GLY A 143 8.639 -7.903 2.596 1.00 0.00 C ATOM 2111 O GLY A 143 8.188 -6.979 1.916 1.00 0.00 O ATOM 0 H GLY A 143 9.196 -9.207 -0.081 1.00 0.00 H new ATOM 0 HA2 GLY A 143 9.775 -9.712 2.717 1.00 0.00 H new ATOM 0 HA3 GLY A 143 10.473 -8.495 1.668 1.00 0.00 H new ATOM 2115 N THR A 144 8.380 -8.042 3.891 1.00 0.00 N ATOM 2116 CA THR A 144 7.531 -7.097 4.607 1.00 0.00 C ATOM 2117 C THR A 144 8.261 -5.783 4.869 1.00 0.00 C ATOM 2118 O THR A 144 7.705 -4.863 5.467 1.00 0.00 O ATOM 2119 CB THR A 144 7.052 -7.679 5.949 1.00 0.00 C ATOM 2120 OG1 THR A 144 6.499 -6.639 6.766 1.00 0.00 O ATOM 2121 CG2 THR A 144 8.200 -8.352 6.686 1.00 0.00 C ATOM 0 H THR A 144 8.746 -8.800 4.467 1.00 0.00 H new ATOM 0 HA THR A 144 6.667 -6.907 3.970 1.00 0.00 H new ATOM 0 HB THR A 144 6.285 -8.425 5.743 1.00 0.00 H new ATOM 0 HG1 THR A 144 6.498 -5.796 6.266 1.00 0.00 H new ATOM 0 HG21 THR A 144 7.838 -8.756 7.632 1.00 0.00 H new ATOM 0 HG22 THR A 144 8.600 -9.161 6.075 1.00 0.00 H new ATOM 0 HG23 THR A 144 8.986 -7.622 6.880 1.00 0.00 H new ATOM 2129 N THR A 145 9.508 -5.700 4.416 1.00 0.00 N ATOM 2130 CA THR A 145 10.309 -4.497 4.602 1.00 0.00 C ATOM 2131 C THR A 145 11.272 -4.292 3.437 1.00 0.00 C ATOM 2132 O THR A 145 11.798 -5.255 2.878 1.00 0.00 O ATOM 2133 CB THR A 145 11.111 -4.553 5.915 1.00 0.00 C ATOM 2134 OG1 THR A 145 11.826 -5.791 6.000 1.00 0.00 O ATOM 2135 CG2 THR A 145 10.190 -4.410 7.117 1.00 0.00 C ATOM 0 H THR A 145 9.985 -6.452 3.918 1.00 0.00 H new ATOM 0 HA THR A 145 9.614 -3.658 4.646 1.00 0.00 H new ATOM 0 HB THR A 145 11.819 -3.724 5.919 1.00 0.00 H new ATOM 0 HG1 THR A 145 11.658 -6.206 6.872 1.00 0.00 H new ATOM 0 HG21 THR A 145 10.779 -4.452 8.033 1.00 0.00 H new ATOM 0 HG22 THR A 145 9.669 -3.454 7.064 1.00 0.00 H new ATOM 0 HG23 THR A 145 9.462 -5.221 7.116 1.00 0.00 H new ATOM 2143 N GLN A 146 11.498 -3.034 3.075 1.00 0.00 N ATOM 2144 CA GLN A 146 12.396 -2.702 1.976 1.00 0.00 C ATOM 2145 C GLN A 146 13.667 -3.545 2.034 1.00 0.00 C ATOM 2146 O GLN A 146 14.309 -3.789 1.012 1.00 0.00 O ATOM 2147 CB GLN A 146 12.756 -1.215 2.015 1.00 0.00 C ATOM 2148 CG GLN A 146 13.394 -0.779 3.323 1.00 0.00 C ATOM 2149 CD GLN A 146 14.049 0.585 3.226 1.00 0.00 C ATOM 2150 OE1 GLN A 146 15.274 0.702 3.251 1.00 0.00 O ATOM 2151 NE2 GLN A 146 13.233 1.627 3.114 1.00 0.00 N ATOM 0 H GLN A 146 11.071 -2.226 3.528 1.00 0.00 H new ATOM 0 HA GLN A 146 11.879 -2.921 1.041 1.00 0.00 H new ATOM 0 HB2 GLN A 146 13.439 -0.993 1.195 1.00 0.00 H new ATOM 0 HB3 GLN A 146 11.854 -0.627 1.846 1.00 0.00 H new ATOM 0 HG2 GLN A 146 12.634 -0.758 4.104 1.00 0.00 H new ATOM 0 HG3 GLN A 146 14.140 -1.516 3.623 1.00 0.00 H new ATOM 0 HE21 GLN A 146 12.223 1.484 3.097 1.00 0.00 H new ATOM 0 HE22 GLN A 146 13.616 2.570 3.045 1.00 0.00 H new ATOM 2160 N ASN A 147 14.025 -3.984 3.235 1.00 0.00 N ATOM 2161 CA ASN A 147 15.221 -4.797 3.428 1.00 0.00 C ATOM 2162 C ASN A 147 14.901 -6.058 4.227 1.00 0.00 C ATOM 2163 O ASN A 147 15.122 -6.106 5.436 1.00 0.00 O ATOM 2164 CB ASN A 147 16.298 -3.987 4.151 1.00 0.00 C ATOM 2165 CG ASN A 147 16.254 -2.515 3.792 1.00 0.00 C ATOM 2166 OD1 ASN A 147 16.136 -2.224 2.502 1.00 0.00 O flip ATOM 2167 ND2 ASN A 147 16.323 -1.649 4.664 1.00 0.00 N flip ATOM 0 H ASN A 147 13.504 -3.791 4.090 1.00 0.00 H new ATOM 0 HA ASN A 147 15.590 -5.094 2.446 1.00 0.00 H new ATOM 0 HB2 ASN A 147 16.171 -4.099 5.228 1.00 0.00 H new ATOM 0 HB3 ASN A 147 17.280 -4.390 3.902 1.00 0.00 H new ATOM 0 HD21 ASN A 147 16.413 -1.918 5.644 1.00 0.00 H new ATOM 0 HD22 ASN A 147 16.290 -0.663 4.407 1.00 0.00 H new ATOM 2174 N TYR A 148 14.383 -7.082 3.548 1.00 0.00 N ATOM 2175 CA TYR A 148 14.046 -8.334 4.219 1.00 0.00 C ATOM 2176 C TYR A 148 15.306 -9.006 4.749 1.00 0.00 C ATOM 2177 O TYR A 148 15.369 -9.398 5.914 1.00 0.00 O ATOM 2178 CB TYR A 148 13.303 -9.280 3.274 1.00 0.00 C ATOM 2179 CG TYR A 148 13.343 -10.727 3.715 1.00 0.00 C ATOM 2180 CD1 TYR A 148 12.798 -11.115 4.931 1.00 0.00 C ATOM 2181 CD2 TYR A 148 13.930 -11.701 2.916 1.00 0.00 C ATOM 2182 CE1 TYR A 148 12.836 -12.434 5.340 1.00 0.00 C ATOM 2183 CE2 TYR A 148 13.972 -13.020 3.320 1.00 0.00 C ATOM 2184 CZ TYR A 148 13.424 -13.383 4.531 1.00 0.00 C ATOM 2185 OH TYR A 148 13.464 -14.697 4.936 1.00 0.00 O ATOM 0 H TYR A 148 14.190 -7.069 2.546 1.00 0.00 H new ATOM 0 HA TYR A 148 13.389 -8.102 5.057 1.00 0.00 H new ATOM 0 HB2 TYR A 148 12.264 -8.961 3.196 1.00 0.00 H new ATOM 0 HB3 TYR A 148 13.737 -9.200 2.277 1.00 0.00 H new ATOM 0 HD1 TYR A 148 12.337 -10.374 5.567 1.00 0.00 H new ATOM 0 HD2 TYR A 148 14.359 -11.422 1.965 1.00 0.00 H new ATOM 0 HE1 TYR A 148 12.407 -12.720 6.289 1.00 0.00 H new ATOM 0 HE2 TYR A 148 14.433 -13.765 2.689 1.00 0.00 H new ATOM 0 HH TYR A 148 13.911 -15.237 4.251 1.00 0.00 H new ATOM 2195 N ASP A 149 16.313 -9.130 3.889 1.00 0.00 N ATOM 2196 CA ASP A 149 17.573 -9.746 4.283 1.00 0.00 C ATOM 2197 C ASP A 149 18.195 -8.990 5.451 1.00 0.00 C ATOM 2198 O ASP A 149 19.098 -9.493 6.121 1.00 0.00 O ATOM 2199 CB ASP A 149 18.544 -9.772 3.102 1.00 0.00 C ATOM 2200 CG ASP A 149 19.488 -10.957 3.156 1.00 0.00 C ATOM 2201 OD1 ASP A 149 19.009 -12.102 3.028 1.00 0.00 O ATOM 2202 OD2 ASP A 149 20.706 -10.738 3.327 1.00 0.00 O ATOM 0 H ASP A 149 16.280 -8.813 2.920 1.00 0.00 H new ATOM 0 HA ASP A 149 17.371 -10.770 4.597 1.00 0.00 H new ATOM 0 HB2 ASP A 149 17.978 -9.804 2.171 1.00 0.00 H new ATOM 0 HB3 ASP A 149 19.124 -8.849 3.092 1.00 0.00 H new ATOM 2207 N ALA A 150 17.707 -7.775 5.688 1.00 0.00 N ATOM 2208 CA ALA A 150 18.211 -6.944 6.773 1.00 0.00 C ATOM 2209 C ALA A 150 17.349 -7.085 8.023 1.00 0.00 C ATOM 2210 O ALA A 150 17.865 -7.207 9.134 1.00 0.00 O ATOM 2211 CB ALA A 150 18.271 -5.489 6.332 1.00 0.00 C ATOM 0 H ALA A 150 16.961 -7.345 5.141 1.00 0.00 H new ATOM 0 HA ALA A 150 19.217 -7.282 7.021 1.00 0.00 H new ATOM 0 HB1 ALA A 150 18.649 -4.876 7.150 1.00 0.00 H new ATOM 0 HB2 ALA A 150 18.935 -5.396 5.473 1.00 0.00 H new ATOM 0 HB3 ALA A 150 17.272 -5.151 6.057 1.00 0.00 H new ATOM 2217 N ASP A 151 16.033 -7.067 7.834 1.00 0.00 N ATOM 2218 CA ASP A 151 15.100 -7.191 8.948 1.00 0.00 C ATOM 2219 C ASP A 151 14.837 -8.655 9.281 1.00 0.00 C ATOM 2220 O ASP A 151 14.773 -9.035 10.451 1.00 0.00 O ATOM 2221 CB ASP A 151 13.782 -6.487 8.615 1.00 0.00 C ATOM 2222 CG ASP A 151 13.159 -5.822 9.827 1.00 0.00 C ATOM 2223 OD1 ASP A 151 13.460 -6.252 10.961 1.00 0.00 O ATOM 2224 OD2 ASP A 151 12.372 -4.870 9.643 1.00 0.00 O ATOM 0 H ASP A 151 15.589 -6.968 6.921 1.00 0.00 H new ATOM 0 HA ASP A 151 15.550 -6.716 9.820 1.00 0.00 H new ATOM 0 HB2 ASP A 151 13.959 -5.738 7.843 1.00 0.00 H new ATOM 0 HB3 ASP A 151 13.081 -7.212 8.201 1.00 0.00 H new ATOM 2229 N GLN A 152 14.685 -9.474 8.245 1.00 0.00 N ATOM 2230 CA GLN A 152 14.429 -10.900 8.423 1.00 0.00 C ATOM 2231 C GLN A 152 12.938 -11.171 8.591 1.00 0.00 C ATOM 2232 O GLN A 152 12.539 -12.060 9.341 1.00 0.00 O ATOM 2233 CB GLN A 152 15.196 -11.432 9.636 1.00 0.00 C ATOM 2234 CG GLN A 152 16.598 -10.860 9.767 1.00 0.00 C ATOM 2235 CD GLN A 152 17.675 -11.912 9.595 1.00 0.00 C ATOM 2236 OE1 GLN A 152 17.942 -12.699 10.503 1.00 0.00 O ATOM 2237 NE2 GLN A 152 18.303 -11.931 8.424 1.00 0.00 N ATOM 0 H GLN A 152 14.735 -9.174 7.271 1.00 0.00 H new ATOM 0 HA GLN A 152 14.774 -11.418 7.528 1.00 0.00 H new ATOM 0 HB2 GLN A 152 14.633 -11.203 10.541 1.00 0.00 H new ATOM 0 HB3 GLN A 152 15.260 -12.518 9.567 1.00 0.00 H new ATOM 0 HG2 GLN A 152 16.738 -10.077 9.022 1.00 0.00 H new ATOM 0 HG3 GLN A 152 16.705 -10.392 10.745 1.00 0.00 H new ATOM 0 HE21 GLN A 152 18.050 -11.260 7.699 1.00 0.00 H new ATOM 0 HE22 GLN A 152 19.038 -12.617 8.251 1.00 0.00 H new ATOM 2246 N LYS A 153 12.118 -10.398 7.886 1.00 0.00 N ATOM 2247 CA LYS A 153 10.669 -10.555 7.956 1.00 0.00 C ATOM 2248 C LYS A 153 10.079 -10.783 6.567 1.00 0.00 C ATOM 2249 O LYS A 153 10.273 -9.975 5.660 1.00 0.00 O ATOM 2250 CB LYS A 153 10.031 -9.322 8.597 1.00 0.00 C ATOM 2251 CG LYS A 153 10.599 -8.986 9.966 1.00 0.00 C ATOM 2252 CD LYS A 153 10.269 -7.559 10.372 1.00 0.00 C ATOM 2253 CE LYS A 153 10.692 -7.274 11.803 1.00 0.00 C ATOM 2254 NZ LYS A 153 9.925 -8.092 12.783 1.00 0.00 N ATOM 0 H LYS A 153 12.432 -9.657 7.260 1.00 0.00 H new ATOM 0 HA LYS A 153 10.453 -11.428 8.571 1.00 0.00 H new ATOM 0 HB2 LYS A 153 10.169 -8.467 7.936 1.00 0.00 H new ATOM 0 HB3 LYS A 153 8.957 -9.485 8.688 1.00 0.00 H new ATOM 0 HG2 LYS A 153 10.198 -9.678 10.707 1.00 0.00 H new ATOM 0 HG3 LYS A 153 11.681 -9.121 9.955 1.00 0.00 H new ATOM 0 HD2 LYS A 153 10.769 -6.863 9.698 1.00 0.00 H new ATOM 0 HD3 LYS A 153 9.197 -7.389 10.268 1.00 0.00 H new ATOM 0 HE2 LYS A 153 11.757 -7.479 11.914 1.00 0.00 H new ATOM 0 HE3 LYS A 153 10.546 -6.216 12.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 9.751 -7.532 13.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 9.016 -8.375 12.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 10.472 -8.942 13.029 1.00 0.00 H new ATOM 2268 N PHE A 154 9.359 -11.889 6.410 1.00 0.00 N ATOM 2269 CA PHE A 154 8.741 -12.223 5.132 1.00 0.00 C ATOM 2270 C PHE A 154 7.251 -12.499 5.300 1.00 0.00 C ATOM 2271 O PHE A 154 6.718 -12.434 6.407 1.00 0.00 O ATOM 2272 CB PHE A 154 9.430 -13.438 4.510 1.00 0.00 C ATOM 2273 CG PHE A 154 9.253 -14.701 5.304 1.00 0.00 C ATOM 2274 CD1 PHE A 154 10.072 -14.974 6.388 1.00 0.00 C ATOM 2275 CD2 PHE A 154 8.268 -15.614 4.967 1.00 0.00 C ATOM 2276 CE1 PHE A 154 9.911 -16.135 7.121 1.00 0.00 C ATOM 2277 CE2 PHE A 154 8.101 -16.776 5.696 1.00 0.00 C ATOM 2278 CZ PHE A 154 8.924 -17.037 6.774 1.00 0.00 C ATOM 0 H PHE A 154 9.189 -12.569 7.151 1.00 0.00 H new ATOM 0 HA PHE A 154 8.859 -11.367 4.467 1.00 0.00 H new ATOM 0 HB2 PHE A 154 9.038 -13.593 3.505 1.00 0.00 H new ATOM 0 HB3 PHE A 154 10.495 -13.229 4.408 1.00 0.00 H new ATOM 0 HD1 PHE A 154 10.845 -14.272 6.663 1.00 0.00 H new ATOM 0 HD2 PHE A 154 7.622 -15.416 4.124 1.00 0.00 H new ATOM 0 HE1 PHE A 154 10.556 -16.336 7.964 1.00 0.00 H new ATOM 0 HE2 PHE A 154 7.328 -17.479 5.423 1.00 0.00 H new ATOM 0 HZ PHE A 154 8.796 -17.945 7.345 1.00 0.00 H new ATOM 2288 N GLY A 155 6.585 -12.810 4.193 1.00 0.00 N ATOM 2289 CA GLY A 155 5.162 -13.094 4.237 1.00 0.00 C ATOM 2290 C GLY A 155 4.633 -13.607 2.912 1.00 0.00 C ATOM 2291 O GLY A 155 5.143 -13.247 1.850 1.00 0.00 O ATOM 0 H GLY A 155 7.005 -12.871 3.266 1.00 0.00 H new ATOM 0 HA2 GLY A 155 4.966 -13.833 5.014 1.00 0.00 H new ATOM 0 HA3 GLY A 155 4.622 -12.189 4.515 1.00 0.00 H new ATOM 2295 N PHE A 156 3.607 -14.450 2.972 1.00 0.00 N ATOM 2296 CA PHE A 156 3.010 -15.012 1.765 1.00 0.00 C ATOM 2297 C PHE A 156 2.155 -13.972 1.050 1.00 0.00 C ATOM 2298 O PHE A 156 1.269 -13.363 1.650 1.00 0.00 O ATOM 2299 CB PHE A 156 2.162 -16.237 2.112 1.00 0.00 C ATOM 2300 CG PHE A 156 2.878 -17.240 2.972 1.00 0.00 C ATOM 2301 CD1 PHE A 156 4.133 -17.705 2.615 1.00 0.00 C ATOM 2302 CD2 PHE A 156 2.297 -17.715 4.136 1.00 0.00 C ATOM 2303 CE1 PHE A 156 4.795 -18.627 3.404 1.00 0.00 C ATOM 2304 CE2 PHE A 156 2.954 -18.637 4.930 1.00 0.00 C ATOM 2305 CZ PHE A 156 4.205 -19.093 4.562 1.00 0.00 C ATOM 0 H PHE A 156 3.172 -14.759 3.842 1.00 0.00 H new ATOM 0 HA PHE A 156 3.816 -15.316 1.097 1.00 0.00 H new ATOM 0 HB2 PHE A 156 1.258 -15.909 2.626 1.00 0.00 H new ATOM 0 HB3 PHE A 156 1.845 -16.723 1.189 1.00 0.00 H new ATOM 0 HD1 PHE A 156 4.599 -17.343 1.710 1.00 0.00 H new ATOM 0 HD2 PHE A 156 1.319 -17.361 4.427 1.00 0.00 H new ATOM 0 HE1 PHE A 156 5.773 -18.983 3.115 1.00 0.00 H new ATOM 0 HE2 PHE A 156 2.490 -19.000 5.835 1.00 0.00 H new ATOM 0 HZ PHE A 156 4.721 -19.813 5.180 1.00 0.00 H new ATOM 2315 N CYS A 157 2.427 -13.773 -0.235 1.00 0.00 N ATOM 2316 CA CYS A 157 1.684 -12.804 -1.033 1.00 0.00 C ATOM 2317 C CYS A 157 0.468 -13.452 -1.687 1.00 0.00 C ATOM 2318 O CYS A 157 0.424 -14.668 -1.875 1.00 0.00 O ATOM 2319 CB CYS A 157 2.587 -12.193 -2.105 1.00 0.00 C ATOM 2320 SG CYS A 157 4.369 -12.405 -1.787 1.00 0.00 S ATOM 0 H CYS A 157 3.156 -14.270 -0.747 1.00 0.00 H new ATOM 0 HA CYS A 157 1.338 -12.015 -0.366 1.00 0.00 H new ATOM 0 HB2 CYS A 157 2.345 -12.643 -3.068 1.00 0.00 H new ATOM 0 HB3 CYS A 157 2.368 -11.128 -2.186 1.00 0.00 H new ATOM 2325 N PRO A 158 -0.537 -12.640 -2.042 1.00 0.00 N ATOM 2326 CA PRO A 158 -1.764 -13.127 -2.679 1.00 0.00 C ATOM 2327 C PRO A 158 -1.476 -14.031 -3.874 1.00 0.00 C ATOM 2328 O PRO A 158 -0.363 -14.048 -4.397 1.00 0.00 O ATOM 2329 CB PRO A 158 -2.459 -11.843 -3.135 1.00 0.00 C ATOM 2330 CG PRO A 158 -1.967 -10.795 -2.198 1.00 0.00 C ATOM 2331 CD PRO A 158 -0.555 -11.178 -1.848 1.00 0.00 C ATOM 0 HA PRO A 158 -2.363 -13.734 -2.001 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -2.207 -11.601 -4.168 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -3.544 -11.941 -3.086 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.000 -9.810 -2.663 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -2.590 -10.747 -1.305 1.00 0.00 H new ATOM 0 HD2 PRO A 158 0.168 -10.679 -2.493 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -0.308 -10.906 -0.822 1.00 0.00 H new