USER MOD reduce.3.24.130724 H: found=0, std=0, add=997, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 994 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 101 TYR OH : rot -30:sc= -1.18! USER MOD Set 1.2: A 121 TYR OH : rot -135:sc= 0.209 USER MOD Set 2.1: A 93 SER OG : rot 180:sc= -0.169 USER MOD Set 2.2: A 95 ASN : amide:sc= -0.98 K(o=-1.1,f=-5.2!) USER MOD Set 3.1: A 73 HIS : no HE2:sc= -0.911! C(o=0.3!,f=-8.3!) USER MOD Set 3.2: A 85 SER OG : rot -108:sc= 1.21 USER MOD Set 4.1: A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 82 TYR OH : rot 166:sc= -4.51! USER MOD Set 5.1: A 5 THR OG1 : rot 180:sc= -0.134 USER MOD Set 5.2: A 120 LYS NZ :NH3+ -173:sc= 0.296 (180deg=0) USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 11 THR OG1 : rot -2:sc= 0.525! USER MOD Single : A 12 SER OG : rot 155:sc= -5.33! USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot 180:sc= -0.0121 USER MOD Single : A 53 THR OG1 : rot 56:sc= -3.21! USER MOD Single : A 56 LYS NZ :NH3+ 158:sc= -0.863 (180deg=-1.93) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 0:sc= 0.916 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS : no HE2:sc= -6.61! C(o=-6.6!,f=-6.5!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN :FLIP amide:sc=-0.00606 F(o=-0.78,f=-0.0061) USER MOD Single : A 80 HIS : no HE2:sc= -0.565 X(o=-0.56,f=-0.62) USER MOD Single : A 81 THR OG1 : rot 57:sc= 0.968 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 107:sc= 1.11 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 THR OG1 : rot 170:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 113 THR OG1 : rot 119:sc= 0.237 USER MOD Single : A 116 LYS NZ :NH3+ 141:sc= 0.609 (180deg=-0.215) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.0623 USER MOD Single : A 119 SER OG : rot -95:sc= 0.477 USER MOD Single : A 122 HIS : no HE2:sc= -7.04! C(o=-7!,f=-10!) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 TYR OH : rot 180:sc= -1.25 USER MOD ----------------------------------------------------------------- ATOM 8 N VAL A 3 -7.232 -1.048 18.975 1.00 0.00 N ATOM 9 CA VAL A 3 -5.916 -1.342 18.342 1.00 0.00 C ATOM 10 C VAL A 3 -5.461 -0.133 17.521 1.00 0.00 C ATOM 11 O VAL A 3 -6.260 0.555 16.916 1.00 0.00 O ATOM 12 CB VAL A 3 -6.053 -2.557 17.422 1.00 0.00 C ATOM 13 CG1 VAL A 3 -7.127 -2.278 16.369 1.00 0.00 C ATOM 14 CG2 VAL A 3 -4.716 -2.826 16.725 1.00 0.00 C ATOM 0 HA VAL A 3 -5.180 -1.552 19.118 1.00 0.00 H new ATOM 0 HB VAL A 3 -6.336 -3.429 18.012 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -7.226 -3.142 15.712 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -8.080 -2.086 16.863 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -6.842 -1.406 15.780 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -4.815 -3.692 16.070 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.432 -1.955 16.135 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -3.949 -3.023 17.474 1.00 0.00 H new ATOM 24 N TYR A 4 -4.184 0.128 17.493 1.00 0.00 N ATOM 25 CA TYR A 4 -3.677 1.287 16.707 1.00 0.00 C ATOM 26 C TYR A 4 -2.834 0.773 15.538 1.00 0.00 C ATOM 27 O TYR A 4 -2.253 -0.292 15.602 1.00 0.00 O ATOM 28 CB TYR A 4 -2.814 2.174 17.607 1.00 0.00 C ATOM 29 CG TYR A 4 -3.615 2.601 18.814 1.00 0.00 C ATOM 30 CD1 TYR A 4 -4.492 3.687 18.723 1.00 0.00 C ATOM 31 CD2 TYR A 4 -3.480 1.910 20.024 1.00 0.00 C ATOM 32 CE1 TYR A 4 -5.234 4.084 19.842 1.00 0.00 C ATOM 33 CE2 TYR A 4 -4.221 2.307 21.143 1.00 0.00 C ATOM 34 CZ TYR A 4 -5.099 3.394 21.052 1.00 0.00 C ATOM 35 OH TYR A 4 -5.830 3.785 22.154 1.00 0.00 O ATOM 0 H TYR A 4 -3.469 -0.412 17.981 1.00 0.00 H new ATOM 0 HA TYR A 4 -4.517 1.867 16.325 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -1.923 1.632 17.923 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -2.475 3.050 17.054 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -4.597 4.219 17.789 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -2.804 1.071 20.094 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -5.911 4.923 19.771 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -4.116 1.775 22.077 1.00 0.00 H new ATOM 0 HH TYR A 4 -5.619 3.200 22.911 1.00 0.00 H new ATOM 45 N THR A 5 -2.760 1.520 14.471 1.00 0.00 N ATOM 46 CA THR A 5 -1.952 1.068 13.303 1.00 0.00 C ATOM 47 C THR A 5 -0.542 1.652 13.411 1.00 0.00 C ATOM 48 O THR A 5 -0.357 2.775 13.837 1.00 0.00 O ATOM 49 CB THR A 5 -2.608 1.552 12.008 1.00 0.00 C ATOM 50 OG1 THR A 5 -3.966 1.135 11.983 1.00 0.00 O ATOM 51 CG2 THR A 5 -1.868 0.959 10.807 1.00 0.00 C ATOM 0 H THR A 5 -3.223 2.422 14.357 1.00 0.00 H new ATOM 0 HA THR A 5 -1.898 -0.021 13.294 1.00 0.00 H new ATOM 0 HB THR A 5 -2.561 2.640 11.960 1.00 0.00 H new ATOM 0 HG1 THR A 5 -4.388 1.446 11.155 1.00 0.00 H new ATOM 0 HG21 THR A 5 -2.336 1.304 9.885 1.00 0.00 H new ATOM 0 HG22 THR A 5 -0.826 1.279 10.827 1.00 0.00 H new ATOM 0 HG23 THR A 5 -1.914 -0.129 10.852 1.00 0.00 H new ATOM 59 N TYR A 6 0.454 0.899 13.034 1.00 0.00 N ATOM 60 CA TYR A 6 1.848 1.417 13.123 1.00 0.00 C ATOM 61 C TYR A 6 2.480 1.448 11.730 1.00 0.00 C ATOM 62 O TYR A 6 2.474 0.467 11.012 1.00 0.00 O ATOM 63 CB TYR A 6 2.671 0.507 14.036 1.00 0.00 C ATOM 64 CG TYR A 6 2.098 0.545 15.433 1.00 0.00 C ATOM 65 CD1 TYR A 6 2.397 1.617 16.283 1.00 0.00 C ATOM 66 CD2 TYR A 6 1.268 -0.489 15.876 1.00 0.00 C ATOM 67 CE1 TYR A 6 1.865 1.652 17.578 1.00 0.00 C ATOM 68 CE2 TYR A 6 0.736 -0.455 17.170 1.00 0.00 C ATOM 69 CZ TYR A 6 1.035 0.616 18.021 1.00 0.00 C ATOM 70 OH TYR A 6 0.510 0.651 19.297 1.00 0.00 O ATOM 0 H TYR A 6 0.364 -0.049 12.669 1.00 0.00 H new ATOM 0 HA TYR A 6 1.831 2.427 13.532 1.00 0.00 H new ATOM 0 HB2 TYR A 6 2.661 -0.514 13.655 1.00 0.00 H new ATOM 0 HB3 TYR A 6 3.711 0.832 14.049 1.00 0.00 H new ATOM 0 HD1 TYR A 6 3.037 2.416 15.940 1.00 0.00 H new ATOM 0 HD2 TYR A 6 1.037 -1.315 15.219 1.00 0.00 H new ATOM 0 HE1 TYR A 6 2.095 2.478 18.234 1.00 0.00 H new ATOM 0 HE2 TYR A 6 0.095 -1.254 17.512 1.00 0.00 H new ATOM 0 HH TYR A 6 -0.045 -0.143 19.444 1.00 0.00 H new ATOM 80 N GLU A 7 3.028 2.568 11.345 1.00 0.00 N ATOM 81 CA GLU A 7 3.667 2.668 10.004 1.00 0.00 C ATOM 82 C GLU A 7 5.184 2.763 10.177 1.00 0.00 C ATOM 83 O GLU A 7 5.674 3.448 11.053 1.00 0.00 O ATOM 84 CB GLU A 7 3.154 3.917 9.286 1.00 0.00 C ATOM 85 CG GLU A 7 3.682 3.934 7.850 1.00 0.00 C ATOM 86 CD GLU A 7 3.208 5.208 7.148 1.00 0.00 C ATOM 87 OE1 GLU A 7 2.617 6.043 7.814 1.00 0.00 O ATOM 88 OE2 GLU A 7 3.444 5.328 5.958 1.00 0.00 O ATOM 0 H GLU A 7 3.060 3.421 11.904 1.00 0.00 H new ATOM 0 HA GLU A 7 3.420 1.786 9.413 1.00 0.00 H new ATOM 0 HB2 GLU A 7 2.064 3.926 9.284 1.00 0.00 H new ATOM 0 HB3 GLU A 7 3.479 4.813 9.815 1.00 0.00 H new ATOM 0 HG2 GLU A 7 4.771 3.890 7.851 1.00 0.00 H new ATOM 0 HG3 GLU A 7 3.328 3.055 7.311 1.00 0.00 H new ATOM 95 N ASN A 8 5.932 2.079 9.355 1.00 0.00 N ATOM 96 CA ASN A 8 7.415 2.133 9.486 1.00 0.00 C ATOM 97 C ASN A 8 8.046 2.448 8.128 1.00 0.00 C ATOM 98 O ASN A 8 7.753 1.815 7.134 1.00 0.00 O ATOM 99 CB ASN A 8 7.931 0.782 9.985 1.00 0.00 C ATOM 100 CG ASN A 8 9.380 0.929 10.453 1.00 0.00 C ATOM 101 OD1 ASN A 8 9.657 1.647 11.394 1.00 0.00 O ATOM 102 ND2 ASN A 8 10.324 0.275 9.832 1.00 0.00 N ATOM 0 H ASN A 8 5.582 1.487 8.601 1.00 0.00 H new ATOM 0 HA ASN A 8 7.684 2.914 10.197 1.00 0.00 H new ATOM 0 HB2 ASN A 8 7.308 0.423 10.804 1.00 0.00 H new ATOM 0 HB3 ASN A 8 7.869 0.040 9.189 1.00 0.00 H new ATOM 0 HD21 ASN A 8 11.293 0.367 10.137 1.00 0.00 H new ATOM 0 HD22 ASN A 8 10.092 -0.328 9.042 1.00 0.00 H new ATOM 109 N GLU A 9 8.920 3.417 8.084 1.00 0.00 N ATOM 110 CA GLU A 9 9.582 3.770 6.796 1.00 0.00 C ATOM 111 C GLU A 9 11.050 3.345 6.857 1.00 0.00 C ATOM 112 O GLU A 9 11.783 3.742 7.741 1.00 0.00 O ATOM 113 CB GLU A 9 9.497 5.282 6.575 1.00 0.00 C ATOM 114 CG GLU A 9 8.036 5.729 6.648 1.00 0.00 C ATOM 115 CD GLU A 9 7.957 7.246 6.456 1.00 0.00 C ATOM 116 OE1 GLU A 9 9.000 7.879 6.465 1.00 0.00 O ATOM 117 OE2 GLU A 9 6.855 7.745 6.301 1.00 0.00 O ATOM 0 H GLU A 9 9.204 3.980 8.886 1.00 0.00 H new ATOM 0 HA GLU A 9 9.084 3.257 5.973 1.00 0.00 H new ATOM 0 HB2 GLU A 9 10.086 5.804 7.329 1.00 0.00 H new ATOM 0 HB3 GLU A 9 9.920 5.542 5.605 1.00 0.00 H new ATOM 0 HG2 GLU A 9 7.451 5.223 5.880 1.00 0.00 H new ATOM 0 HG3 GLU A 9 7.607 5.451 7.610 1.00 0.00 H new ATOM 124 N PHE A 10 11.486 2.535 5.933 1.00 0.00 N ATOM 125 CA PHE A 10 12.906 2.085 5.953 1.00 0.00 C ATOM 126 C PHE A 10 13.491 2.150 4.542 1.00 0.00 C ATOM 127 O PHE A 10 12.872 1.738 3.581 1.00 0.00 O ATOM 128 CB PHE A 10 12.975 0.644 6.465 1.00 0.00 C ATOM 129 CG PHE A 10 14.403 0.159 6.413 1.00 0.00 C ATOM 130 CD1 PHE A 10 14.900 -0.430 5.243 1.00 0.00 C ATOM 131 CD2 PHE A 10 15.232 0.297 7.533 1.00 0.00 C ATOM 132 CE1 PHE A 10 16.224 -0.881 5.195 1.00 0.00 C ATOM 133 CE2 PHE A 10 16.557 -0.153 7.484 1.00 0.00 C ATOM 134 CZ PHE A 10 17.053 -0.743 6.315 1.00 0.00 C ATOM 0 H PHE A 10 10.923 2.166 5.167 1.00 0.00 H new ATOM 0 HA PHE A 10 13.480 2.737 6.611 1.00 0.00 H new ATOM 0 HB2 PHE A 10 12.599 0.591 7.487 1.00 0.00 H new ATOM 0 HB3 PHE A 10 12.339 0.000 5.858 1.00 0.00 H new ATOM 0 HD1 PHE A 10 14.262 -0.536 4.378 1.00 0.00 H new ATOM 0 HD2 PHE A 10 14.849 0.751 8.435 1.00 0.00 H new ATOM 0 HE1 PHE A 10 16.607 -1.336 4.293 1.00 0.00 H new ATOM 0 HE2 PHE A 10 17.196 -0.045 8.348 1.00 0.00 H new ATOM 0 HZ PHE A 10 18.075 -1.091 6.277 1.00 0.00 H new ATOM 144 N THR A 11 14.685 2.661 4.411 1.00 0.00 N ATOM 145 CA THR A 11 15.317 2.748 3.065 1.00 0.00 C ATOM 146 C THR A 11 16.204 1.522 2.848 1.00 0.00 C ATOM 147 O THR A 11 17.002 1.165 3.693 1.00 0.00 O ATOM 148 CB THR A 11 16.168 4.017 2.982 1.00 0.00 C ATOM 149 OG1 THR A 11 17.376 3.822 3.705 1.00 0.00 O ATOM 150 CG2 THR A 11 15.397 5.193 3.582 1.00 0.00 C ATOM 0 H THR A 11 15.250 3.022 5.179 1.00 0.00 H new ATOM 0 HA THR A 11 14.544 2.782 2.297 1.00 0.00 H new ATOM 0 HB THR A 11 16.398 4.233 1.939 1.00 0.00 H new ATOM 0 HG1 THR A 11 17.369 2.935 4.121 1.00 0.00 H new ATOM 0 HG21 THR A 11 16.005 6.096 3.522 1.00 0.00 H new ATOM 0 HG22 THR A 11 14.471 5.342 3.027 1.00 0.00 H new ATOM 0 HG23 THR A 11 15.165 4.981 4.626 1.00 0.00 H new ATOM 158 N SER A 12 16.072 0.868 1.726 1.00 0.00 N ATOM 159 CA SER A 12 16.909 -0.337 1.469 1.00 0.00 C ATOM 160 C SER A 12 17.558 -0.234 0.088 1.00 0.00 C ATOM 161 O SER A 12 17.326 0.702 -0.652 1.00 0.00 O ATOM 162 CB SER A 12 16.029 -1.588 1.523 1.00 0.00 C ATOM 163 OG SER A 12 15.115 -1.571 0.436 1.00 0.00 O ATOM 0 H SER A 12 15.423 1.115 0.979 1.00 0.00 H new ATOM 0 HA SER A 12 17.688 -0.401 2.229 1.00 0.00 H new ATOM 0 HB2 SER A 12 16.648 -2.484 1.477 1.00 0.00 H new ATOM 0 HB3 SER A 12 15.487 -1.624 2.468 1.00 0.00 H new ATOM 0 HG SER A 12 14.845 -2.488 0.222 1.00 0.00 H new ATOM 169 N ASP A 13 18.371 -1.191 -0.263 1.00 0.00 N ATOM 170 CA ASP A 13 19.040 -1.158 -1.593 1.00 0.00 C ATOM 171 C ASP A 13 18.073 -1.666 -2.664 1.00 0.00 C ATOM 172 O ASP A 13 16.920 -1.941 -2.392 1.00 0.00 O ATOM 173 CB ASP A 13 20.282 -2.051 -1.559 1.00 0.00 C ATOM 174 CG ASP A 13 19.885 -3.457 -1.108 1.00 0.00 C ATOM 175 OD1 ASP A 13 18.721 -3.654 -0.801 1.00 0.00 O ATOM 176 OD2 ASP A 13 20.753 -4.315 -1.076 1.00 0.00 O ATOM 0 H ASP A 13 18.602 -1.998 0.317 1.00 0.00 H new ATOM 0 HA ASP A 13 19.334 -0.135 -1.828 1.00 0.00 H new ATOM 0 HB2 ASP A 13 20.742 -2.090 -2.546 1.00 0.00 H new ATOM 0 HB3 ASP A 13 21.024 -1.635 -0.878 1.00 0.00 H new ATOM 181 N ILE A 14 18.530 -1.792 -3.880 1.00 0.00 N ATOM 182 CA ILE A 14 17.633 -2.280 -4.965 1.00 0.00 C ATOM 183 C ILE A 14 16.564 -1.223 -5.248 1.00 0.00 C ATOM 184 O ILE A 14 15.991 -0.652 -4.342 1.00 0.00 O ATOM 185 CB ILE A 14 16.958 -3.582 -4.529 1.00 0.00 C ATOM 186 CG1 ILE A 14 17.963 -4.455 -3.773 1.00 0.00 C ATOM 187 CG2 ILE A 14 16.458 -4.335 -5.763 1.00 0.00 C ATOM 188 CD1 ILE A 14 19.239 -4.601 -4.602 1.00 0.00 C ATOM 0 H ILE A 14 19.485 -1.578 -4.169 1.00 0.00 H new ATOM 0 HA ILE A 14 18.218 -2.462 -5.866 1.00 0.00 H new ATOM 0 HB ILE A 14 16.116 -3.351 -3.876 1.00 0.00 H new ATOM 0 HG12 ILE A 14 18.194 -4.007 -2.806 1.00 0.00 H new ATOM 0 HG13 ILE A 14 17.531 -5.436 -3.575 1.00 0.00 H new ATOM 0 HG21 ILE A 14 15.977 -5.263 -5.453 1.00 0.00 H new ATOM 0 HG22 ILE A 14 15.740 -3.716 -6.301 1.00 0.00 H new ATOM 0 HG23 ILE A 14 17.300 -4.564 -6.416 1.00 0.00 H new ATOM 0 HD11 ILE A 14 19.954 -5.223 -4.063 1.00 0.00 H new ATOM 0 HD12 ILE A 14 19.001 -5.068 -5.558 1.00 0.00 H new ATOM 0 HD13 ILE A 14 19.674 -3.617 -4.777 1.00 0.00 H new ATOM 200 N PRO A 15 16.293 -0.959 -6.535 1.00 0.00 N ATOM 201 CA PRO A 15 15.292 0.033 -6.941 1.00 0.00 C ATOM 202 C PRO A 15 13.865 -0.442 -6.647 1.00 0.00 C ATOM 203 O PRO A 15 13.574 -1.622 -6.655 1.00 0.00 O ATOM 204 CB PRO A 15 15.510 0.168 -8.448 1.00 0.00 C ATOM 205 CG PRO A 15 16.125 -1.125 -8.860 1.00 0.00 C ATOM 206 CD PRO A 15 16.941 -1.603 -7.690 1.00 0.00 C ATOM 0 HA PRO A 15 15.403 0.973 -6.400 1.00 0.00 H new ATOM 0 HB2 PRO A 15 14.569 0.343 -8.970 1.00 0.00 H new ATOM 0 HB3 PRO A 15 16.164 1.009 -8.680 1.00 0.00 H new ATOM 0 HG2 PRO A 15 15.358 -1.854 -9.121 1.00 0.00 H new ATOM 0 HG3 PRO A 15 16.752 -0.993 -9.742 1.00 0.00 H new ATOM 0 HD2 PRO A 15 16.924 -2.690 -7.606 1.00 0.00 H new ATOM 0 HD3 PRO A 15 17.986 -1.307 -7.781 1.00 0.00 H new ATOM 214 N ALA A 16 12.979 0.476 -6.376 1.00 0.00 N ATOM 215 CA ALA A 16 11.567 0.109 -6.065 1.00 0.00 C ATOM 216 C ALA A 16 11.086 -1.050 -6.953 1.00 0.00 C ATOM 217 O ALA A 16 10.566 -2.032 -6.460 1.00 0.00 O ATOM 218 CB ALA A 16 10.669 1.325 -6.299 1.00 0.00 C ATOM 0 H ALA A 16 13.175 1.477 -6.356 1.00 0.00 H new ATOM 0 HA ALA A 16 11.515 -0.209 -5.024 1.00 0.00 H new ATOM 0 HB1 ALA A 16 9.635 1.063 -6.073 1.00 0.00 H new ATOM 0 HB2 ALA A 16 10.986 2.142 -5.650 1.00 0.00 H new ATOM 0 HB3 ALA A 16 10.745 1.638 -7.340 1.00 0.00 H new ATOM 224 N PRO A 17 11.235 -0.929 -8.283 1.00 0.00 N ATOM 225 CA PRO A 17 10.784 -1.968 -9.227 1.00 0.00 C ATOM 226 C PRO A 17 11.543 -3.292 -9.077 1.00 0.00 C ATOM 227 O PRO A 17 10.945 -4.345 -8.980 1.00 0.00 O ATOM 228 CB PRO A 17 11.060 -1.348 -10.598 1.00 0.00 C ATOM 229 CG PRO A 17 12.140 -0.353 -10.345 1.00 0.00 C ATOM 230 CD PRO A 17 11.853 0.212 -8.984 1.00 0.00 C ATOM 0 HA PRO A 17 9.740 -2.230 -9.059 1.00 0.00 H new ATOM 0 HB2 PRO A 17 11.376 -2.102 -11.319 1.00 0.00 H new ATOM 0 HB3 PRO A 17 10.168 -0.871 -11.005 1.00 0.00 H new ATOM 0 HG2 PRO A 17 13.123 -0.824 -10.375 1.00 0.00 H new ATOM 0 HG3 PRO A 17 12.138 0.430 -11.103 1.00 0.00 H new ATOM 0 HD2 PRO A 17 12.762 0.549 -8.486 1.00 0.00 H new ATOM 0 HD3 PRO A 17 11.181 1.068 -9.035 1.00 0.00 H new ATOM 238 N LYS A 18 12.847 -3.260 -9.065 1.00 0.00 N ATOM 239 CA LYS A 18 13.614 -4.534 -8.932 1.00 0.00 C ATOM 240 C LYS A 18 13.280 -5.206 -7.598 1.00 0.00 C ATOM 241 O LYS A 18 13.240 -6.416 -7.497 1.00 0.00 O ATOM 242 CB LYS A 18 15.113 -4.243 -8.993 1.00 0.00 C ATOM 243 CG LYS A 18 15.485 -3.779 -10.403 1.00 0.00 C ATOM 244 CD LYS A 18 16.999 -3.582 -10.494 1.00 0.00 C ATOM 245 CE LYS A 18 17.346 -2.911 -11.825 1.00 0.00 C ATOM 246 NZ LYS A 18 18.473 -3.644 -12.471 1.00 0.00 N ATOM 0 H LYS A 18 13.413 -2.415 -9.141 1.00 0.00 H new ATOM 0 HA LYS A 18 13.340 -5.200 -9.750 1.00 0.00 H new ATOM 0 HB2 LYS A 18 15.375 -3.475 -8.265 1.00 0.00 H new ATOM 0 HB3 LYS A 18 15.679 -5.137 -8.732 1.00 0.00 H new ATOM 0 HG2 LYS A 18 15.159 -4.516 -11.137 1.00 0.00 H new ATOM 0 HG3 LYS A 18 14.972 -2.846 -10.637 1.00 0.00 H new ATOM 0 HD2 LYS A 18 17.347 -2.968 -9.663 1.00 0.00 H new ATOM 0 HD3 LYS A 18 17.507 -4.543 -10.415 1.00 0.00 H new ATOM 0 HE2 LYS A 18 16.476 -2.909 -12.481 1.00 0.00 H new ATOM 0 HE3 LYS A 18 17.623 -1.870 -11.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 18.710 -3.189 -13.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 19.304 -3.624 -11.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 18.192 -4.631 -12.643 1.00 0.00 H new ATOM 260 N LEU A 19 13.046 -4.436 -6.572 1.00 0.00 N ATOM 261 CA LEU A 19 12.720 -5.040 -5.249 1.00 0.00 C ATOM 262 C LEU A 19 11.244 -5.443 -5.217 1.00 0.00 C ATOM 263 O LEU A 19 10.857 -6.363 -4.525 1.00 0.00 O ATOM 264 CB LEU A 19 12.999 -4.023 -4.140 1.00 0.00 C ATOM 265 CG LEU A 19 12.910 -4.715 -2.779 1.00 0.00 C ATOM 266 CD1 LEU A 19 13.882 -4.048 -1.804 1.00 0.00 C ATOM 267 CD2 LEU A 19 11.484 -4.595 -2.238 1.00 0.00 C ATOM 0 H LEU A 19 13.066 -3.416 -6.592 1.00 0.00 H new ATOM 0 HA LEU A 19 13.338 -5.924 -5.093 1.00 0.00 H new ATOM 0 HB2 LEU A 19 13.988 -3.586 -4.274 1.00 0.00 H new ATOM 0 HB3 LEU A 19 12.280 -3.206 -4.192 1.00 0.00 H new ATOM 0 HG LEU A 19 13.170 -5.768 -2.889 1.00 0.00 H new ATOM 0 HD11 LEU A 19 13.819 -4.541 -0.834 1.00 0.00 H new ATOM 0 HD12 LEU A 19 14.898 -4.132 -2.189 1.00 0.00 H new ATOM 0 HD13 LEU A 19 13.622 -2.995 -1.694 1.00 0.00 H new ATOM 0 HD21 LEU A 19 11.420 -5.088 -1.268 1.00 0.00 H new ATOM 0 HD22 LEU A 19 11.224 -3.542 -2.128 1.00 0.00 H new ATOM 0 HD23 LEU A 19 10.790 -5.069 -2.932 1.00 0.00 H new ATOM 279 N PHE A 20 10.417 -4.760 -5.961 1.00 0.00 N ATOM 280 CA PHE A 20 8.967 -5.102 -5.970 1.00 0.00 C ATOM 281 C PHE A 20 8.754 -6.415 -6.725 1.00 0.00 C ATOM 282 O PHE A 20 7.891 -7.202 -6.390 1.00 0.00 O ATOM 283 CB PHE A 20 8.185 -3.986 -6.665 1.00 0.00 C ATOM 284 CG PHE A 20 6.715 -4.328 -6.663 1.00 0.00 C ATOM 285 CD1 PHE A 20 5.917 -3.981 -5.568 1.00 0.00 C ATOM 286 CD2 PHE A 20 6.151 -4.994 -7.759 1.00 0.00 C ATOM 287 CE1 PHE A 20 4.554 -4.299 -5.566 1.00 0.00 C ATOM 288 CE2 PHE A 20 4.788 -5.313 -7.757 1.00 0.00 C ATOM 289 CZ PHE A 20 3.989 -4.966 -6.660 1.00 0.00 C ATOM 0 H PHE A 20 10.683 -3.980 -6.563 1.00 0.00 H new ATOM 0 HA PHE A 20 8.615 -5.212 -4.944 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.350 -3.038 -6.153 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.539 -3.861 -7.688 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.353 -3.467 -4.724 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.767 -5.261 -8.605 1.00 0.00 H new ATOM 0 HE1 PHE A 20 3.938 -4.030 -4.721 1.00 0.00 H new ATOM 0 HE2 PHE A 20 4.352 -5.827 -8.601 1.00 0.00 H new ATOM 0 HZ PHE A 20 2.938 -5.213 -6.658 1.00 0.00 H new ATOM 299 N LYS A 21 9.531 -6.657 -7.744 1.00 0.00 N ATOM 300 CA LYS A 21 9.370 -7.918 -8.521 1.00 0.00 C ATOM 301 C LYS A 21 9.782 -9.113 -7.658 1.00 0.00 C ATOM 302 O LYS A 21 9.145 -10.147 -7.668 1.00 0.00 O ATOM 303 CB LYS A 21 10.250 -7.862 -9.772 1.00 0.00 C ATOM 304 CG LYS A 21 9.735 -6.762 -10.705 1.00 0.00 C ATOM 305 CD LYS A 21 10.537 -6.778 -12.007 1.00 0.00 C ATOM 306 CE LYS A 21 10.135 -5.578 -12.867 1.00 0.00 C ATOM 307 NZ LYS A 21 10.832 -5.652 -14.182 1.00 0.00 N ATOM 0 H LYS A 21 10.271 -6.036 -8.072 1.00 0.00 H new ATOM 0 HA LYS A 21 8.326 -8.030 -8.815 1.00 0.00 H new ATOM 0 HB2 LYS A 21 11.285 -7.664 -9.494 1.00 0.00 H new ATOM 0 HB3 LYS A 21 10.236 -8.824 -10.284 1.00 0.00 H new ATOM 0 HG2 LYS A 21 8.677 -6.916 -10.916 1.00 0.00 H new ATOM 0 HG3 LYS A 21 9.826 -5.789 -10.222 1.00 0.00 H new ATOM 0 HD2 LYS A 21 11.605 -6.742 -11.790 1.00 0.00 H new ATOM 0 HD3 LYS A 21 10.353 -7.706 -12.549 1.00 0.00 H new ATOM 0 HE2 LYS A 21 9.055 -5.569 -13.016 1.00 0.00 H new ATOM 0 HE3 LYS A 21 10.394 -4.650 -12.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 10.559 -4.836 -14.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 11.861 -5.640 -14.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 10.564 -6.531 -14.668 1.00 0.00 H new ATOM 321 N ALA A 22 10.843 -8.983 -6.910 1.00 0.00 N ATOM 322 CA ALA A 22 11.289 -10.116 -6.051 1.00 0.00 C ATOM 323 C ALA A 22 10.544 -10.078 -4.713 1.00 0.00 C ATOM 324 O ALA A 22 10.413 -11.078 -4.037 1.00 0.00 O ATOM 325 CB ALA A 22 12.795 -10.003 -5.796 1.00 0.00 C ATOM 0 H ALA A 22 11.419 -8.143 -6.856 1.00 0.00 H new ATOM 0 HA ALA A 22 11.073 -11.056 -6.558 1.00 0.00 H new ATOM 0 HB1 ALA A 22 13.121 -10.832 -5.168 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.328 -10.036 -6.746 1.00 0.00 H new ATOM 0 HB3 ALA A 22 13.009 -9.060 -5.293 1.00 0.00 H new ATOM 331 N PHE A 23 10.056 -8.931 -4.326 1.00 0.00 N ATOM 332 CA PHE A 23 9.323 -8.834 -3.030 1.00 0.00 C ATOM 333 C PHE A 23 7.869 -9.269 -3.230 1.00 0.00 C ATOM 334 O PHE A 23 7.154 -9.524 -2.282 1.00 0.00 O ATOM 335 CB PHE A 23 9.360 -7.388 -2.529 1.00 0.00 C ATOM 336 CG PHE A 23 8.601 -7.282 -1.227 1.00 0.00 C ATOM 337 CD1 PHE A 23 9.248 -7.552 -0.015 1.00 0.00 C ATOM 338 CD2 PHE A 23 7.250 -6.911 -1.232 1.00 0.00 C ATOM 339 CE1 PHE A 23 8.545 -7.452 1.192 1.00 0.00 C ATOM 340 CE2 PHE A 23 6.548 -6.811 -0.025 1.00 0.00 C ATOM 341 CZ PHE A 23 7.195 -7.081 1.187 1.00 0.00 C ATOM 0 H PHE A 23 10.132 -8.059 -4.849 1.00 0.00 H new ATOM 0 HA PHE A 23 9.798 -9.485 -2.296 1.00 0.00 H new ATOM 0 HB2 PHE A 23 10.392 -7.068 -2.387 1.00 0.00 H new ATOM 0 HB3 PHE A 23 8.920 -6.724 -3.273 1.00 0.00 H new ATOM 0 HD1 PHE A 23 10.290 -7.837 -0.011 1.00 0.00 H new ATOM 0 HD2 PHE A 23 6.750 -6.702 -2.166 1.00 0.00 H new ATOM 0 HE1 PHE A 23 9.044 -7.661 2.127 1.00 0.00 H new ATOM 0 HE2 PHE A 23 5.506 -6.525 -0.029 1.00 0.00 H new ATOM 0 HZ PHE A 23 6.653 -7.003 2.118 1.00 0.00 H new ATOM 351 N VAL A 24 7.427 -9.359 -4.454 1.00 0.00 N ATOM 352 CA VAL A 24 6.019 -9.777 -4.706 1.00 0.00 C ATOM 353 C VAL A 24 6.006 -11.057 -5.545 1.00 0.00 C ATOM 354 O VAL A 24 5.429 -12.055 -5.160 1.00 0.00 O ATOM 355 CB VAL A 24 5.284 -8.664 -5.455 1.00 0.00 C ATOM 356 CG1 VAL A 24 3.832 -9.082 -5.696 1.00 0.00 C ATOM 357 CG2 VAL A 24 5.312 -7.386 -4.615 1.00 0.00 C ATOM 0 H VAL A 24 7.978 -9.162 -5.289 1.00 0.00 H new ATOM 0 HA VAL A 24 5.520 -9.965 -3.755 1.00 0.00 H new ATOM 0 HB VAL A 24 5.773 -8.484 -6.412 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.309 -8.289 -6.230 1.00 0.00 H new ATOM 0 HG12 VAL A 24 3.810 -9.995 -6.291 1.00 0.00 H new ATOM 0 HG13 VAL A 24 3.341 -9.261 -4.739 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.789 -6.590 -5.146 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.821 -7.568 -3.659 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.346 -7.088 -4.441 1.00 0.00 H new ATOM 367 N LEU A 25 6.635 -11.039 -6.687 1.00 0.00 N ATOM 368 CA LEU A 25 6.653 -12.259 -7.543 1.00 0.00 C ATOM 369 C LEU A 25 7.475 -13.350 -6.856 1.00 0.00 C ATOM 370 O LEU A 25 7.134 -14.516 -6.895 1.00 0.00 O ATOM 371 CB LEU A 25 7.280 -11.926 -8.898 1.00 0.00 C ATOM 372 CG LEU A 25 7.104 -13.113 -9.846 1.00 0.00 C ATOM 373 CD1 LEU A 25 5.646 -13.576 -9.818 1.00 0.00 C ATOM 374 CD2 LEU A 25 7.478 -12.687 -11.267 1.00 0.00 C ATOM 0 H LEU A 25 7.136 -10.235 -7.064 1.00 0.00 H new ATOM 0 HA LEU A 25 5.632 -12.611 -7.693 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.810 -11.037 -9.320 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.339 -11.699 -8.775 1.00 0.00 H new ATOM 0 HG LEU A 25 7.750 -13.932 -9.530 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.520 -14.422 -10.494 1.00 0.00 H new ATOM 0 HD12 LEU A 25 5.379 -13.878 -8.805 1.00 0.00 H new ATOM 0 HD13 LEU A 25 4.999 -12.759 -10.135 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.353 -13.532 -11.945 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.831 -11.869 -11.584 1.00 0.00 H new ATOM 0 HD23 LEU A 25 8.517 -12.357 -11.286 1.00 0.00 H new ATOM 386 N ASP A 26 8.557 -12.982 -6.225 1.00 0.00 N ATOM 387 CA ASP A 26 9.398 -13.999 -5.537 1.00 0.00 C ATOM 388 C ASP A 26 9.178 -13.905 -4.026 1.00 0.00 C ATOM 389 O ASP A 26 9.973 -14.386 -3.244 1.00 0.00 O ATOM 390 CB ASP A 26 10.873 -13.744 -5.855 1.00 0.00 C ATOM 391 CG ASP A 26 11.084 -13.784 -7.370 1.00 0.00 C ATOM 392 OD1 ASP A 26 10.227 -14.318 -8.054 1.00 0.00 O ATOM 393 OD2 ASP A 26 12.099 -13.279 -7.821 1.00 0.00 O ATOM 0 H ASP A 26 8.894 -12.022 -6.157 1.00 0.00 H new ATOM 0 HA ASP A 26 9.120 -14.994 -5.884 1.00 0.00 H new ATOM 0 HB2 ASP A 26 11.179 -12.775 -5.460 1.00 0.00 H new ATOM 0 HB3 ASP A 26 11.496 -14.496 -5.371 1.00 0.00 H new ATOM 398 N ALA A 27 8.107 -13.289 -3.607 1.00 0.00 N ATOM 399 CA ALA A 27 7.843 -13.170 -2.145 1.00 0.00 C ATOM 400 C ALA A 27 7.489 -14.548 -1.580 1.00 0.00 C ATOM 401 O ALA A 27 7.858 -14.890 -0.474 1.00 0.00 O ATOM 402 CB ALA A 27 6.678 -12.207 -1.910 1.00 0.00 C ATOM 0 H ALA A 27 7.405 -12.864 -4.212 1.00 0.00 H new ATOM 0 HA ALA A 27 8.733 -12.788 -1.645 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.487 -12.122 -0.840 1.00 0.00 H new ATOM 0 HB2 ALA A 27 6.930 -11.226 -2.313 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.786 -12.586 -2.409 1.00 0.00 H new ATOM 408 N ASP A 28 6.771 -15.339 -2.330 1.00 0.00 N ATOM 409 CA ASP A 28 6.387 -16.692 -1.837 1.00 0.00 C ATOM 410 C ASP A 28 7.586 -17.638 -1.941 1.00 0.00 C ATOM 411 O ASP A 28 7.643 -18.656 -1.279 1.00 0.00 O ATOM 412 CB ASP A 28 5.234 -17.233 -2.684 1.00 0.00 C ATOM 413 CG ASP A 28 4.794 -18.593 -2.139 1.00 0.00 C ATOM 414 OD1 ASP A 28 5.186 -18.921 -1.032 1.00 0.00 O ATOM 415 OD2 ASP A 28 4.071 -19.284 -2.839 1.00 0.00 O ATOM 0 H ASP A 28 6.433 -15.106 -3.264 1.00 0.00 H new ATOM 0 HA ASP A 28 6.073 -16.622 -0.796 1.00 0.00 H new ATOM 0 HB2 ASP A 28 4.397 -16.535 -2.667 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.547 -17.330 -3.724 1.00 0.00 H new ATOM 420 N ASN A 29 8.544 -17.313 -2.765 1.00 0.00 N ATOM 421 CA ASN A 29 9.736 -18.198 -2.906 1.00 0.00 C ATOM 422 C ASN A 29 10.925 -17.573 -2.173 1.00 0.00 C ATOM 423 O ASN A 29 11.805 -18.262 -1.696 1.00 0.00 O ATOM 424 CB ASN A 29 10.081 -18.358 -4.387 1.00 0.00 C ATOM 425 CG ASN A 29 9.002 -19.195 -5.078 1.00 0.00 C ATOM 426 OD1 ASN A 29 8.186 -19.814 -4.426 1.00 0.00 O ATOM 427 ND2 ASN A 29 8.965 -19.239 -6.382 1.00 0.00 N ATOM 0 H ASN A 29 8.554 -16.475 -3.346 1.00 0.00 H new ATOM 0 HA ASN A 29 9.515 -19.175 -2.476 1.00 0.00 H new ATOM 0 HB2 ASN A 29 10.156 -17.379 -4.861 1.00 0.00 H new ATOM 0 HB3 ASN A 29 11.053 -18.839 -4.494 1.00 0.00 H new ATOM 0 HD21 ASN A 29 8.250 -19.793 -6.854 1.00 0.00 H new ATOM 0 HD22 ASN A 29 9.651 -18.719 -6.929 1.00 0.00 H new ATOM 434 N LEU A 30 10.960 -16.271 -2.080 1.00 0.00 N ATOM 435 CA LEU A 30 12.093 -15.604 -1.381 1.00 0.00 C ATOM 436 C LEU A 30 11.986 -15.861 0.124 1.00 0.00 C ATOM 437 O LEU A 30 12.974 -16.076 0.798 1.00 0.00 O ATOM 438 CB LEU A 30 12.040 -14.098 -1.645 1.00 0.00 C ATOM 439 CG LEU A 30 13.263 -13.427 -1.016 1.00 0.00 C ATOM 440 CD1 LEU A 30 14.526 -14.191 -1.423 1.00 0.00 C ATOM 441 CD2 LEU A 30 13.361 -11.982 -1.506 1.00 0.00 C ATOM 0 H LEU A 30 10.252 -15.641 -2.458 1.00 0.00 H new ATOM 0 HA LEU A 30 13.036 -16.005 -1.753 1.00 0.00 H new ATOM 0 HB2 LEU A 30 12.018 -13.907 -2.718 1.00 0.00 H new ATOM 0 HB3 LEU A 30 11.126 -13.677 -1.227 1.00 0.00 H new ATOM 0 HG LEU A 30 13.165 -13.435 0.070 1.00 0.00 H new ATOM 0 HD11 LEU A 30 15.399 -13.715 -0.976 1.00 0.00 H new ATOM 0 HD12 LEU A 30 14.456 -15.221 -1.074 1.00 0.00 H new ATOM 0 HD13 LEU A 30 14.623 -14.181 -2.509 1.00 0.00 H new ATOM 0 HD21 LEU A 30 14.232 -11.504 -1.058 1.00 0.00 H new ATOM 0 HD22 LEU A 30 13.460 -11.972 -2.591 1.00 0.00 H new ATOM 0 HD23 LEU A 30 12.461 -11.438 -1.218 1.00 0.00 H new ATOM 453 N ILE A 31 10.795 -15.843 0.655 1.00 0.00 N ATOM 454 CA ILE A 31 10.628 -16.087 2.115 1.00 0.00 C ATOM 455 C ILE A 31 11.267 -17.432 2.481 1.00 0.00 C ATOM 456 O ILE A 31 12.137 -17.501 3.326 1.00 0.00 O ATOM 457 CB ILE A 31 9.136 -16.097 2.462 1.00 0.00 C ATOM 458 CG1 ILE A 31 8.610 -14.660 2.482 1.00 0.00 C ATOM 459 CG2 ILE A 31 8.928 -16.731 3.840 1.00 0.00 C ATOM 460 CD1 ILE A 31 7.165 -14.642 1.983 1.00 0.00 C ATOM 0 H ILE A 31 9.931 -15.670 0.142 1.00 0.00 H new ATOM 0 HA ILE A 31 11.118 -15.295 2.682 1.00 0.00 H new ATOM 0 HB ILE A 31 8.597 -16.677 1.713 1.00 0.00 H new ATOM 0 HG12 ILE A 31 8.662 -14.256 3.493 1.00 0.00 H new ATOM 0 HG13 ILE A 31 9.232 -14.024 1.852 1.00 0.00 H new ATOM 0 HG21 ILE A 31 7.865 -16.736 4.082 1.00 0.00 H new ATOM 0 HG22 ILE A 31 9.302 -17.755 3.830 1.00 0.00 H new ATOM 0 HG23 ILE A 31 9.468 -16.155 4.591 1.00 0.00 H new ATOM 0 HD11 ILE A 31 6.788 -13.619 1.996 1.00 0.00 H new ATOM 0 HD12 ILE A 31 7.127 -15.030 0.965 1.00 0.00 H new ATOM 0 HD13 ILE A 31 6.548 -15.264 2.631 1.00 0.00 H new ATOM 472 N PRO A 32 10.830 -18.522 1.826 1.00 0.00 N ATOM 473 CA PRO A 32 11.369 -19.864 2.084 1.00 0.00 C ATOM 474 C PRO A 32 12.811 -20.000 1.585 1.00 0.00 C ATOM 475 O PRO A 32 13.495 -20.957 1.886 1.00 0.00 O ATOM 476 CB PRO A 32 10.453 -20.780 1.271 1.00 0.00 C ATOM 477 CG PRO A 32 9.916 -19.906 0.189 1.00 0.00 C ATOM 478 CD PRO A 32 9.781 -18.536 0.791 1.00 0.00 C ATOM 0 HA PRO A 32 11.394 -20.097 3.149 1.00 0.00 H new ATOM 0 HB2 PRO A 32 11.002 -21.628 0.861 1.00 0.00 H new ATOM 0 HB3 PRO A 32 9.651 -21.187 1.887 1.00 0.00 H new ATOM 0 HG2 PRO A 32 10.588 -19.890 -0.669 1.00 0.00 H new ATOM 0 HG3 PRO A 32 8.953 -20.272 -0.167 1.00 0.00 H new ATOM 0 HD2 PRO A 32 9.936 -17.753 0.049 1.00 0.00 H new ATOM 0 HD3 PRO A 32 8.791 -18.379 1.218 1.00 0.00 H new ATOM 486 N LYS A 33 13.276 -19.048 0.824 1.00 0.00 N ATOM 487 CA LYS A 33 14.671 -19.122 0.303 1.00 0.00 C ATOM 488 C LYS A 33 15.642 -18.594 1.361 1.00 0.00 C ATOM 489 O LYS A 33 16.741 -19.091 1.511 1.00 0.00 O ATOM 490 CB LYS A 33 14.788 -18.268 -0.960 1.00 0.00 C ATOM 491 CG LYS A 33 14.494 -19.128 -2.188 1.00 0.00 C ATOM 492 CD LYS A 33 14.701 -18.295 -3.455 1.00 0.00 C ATOM 493 CE LYS A 33 13.919 -18.919 -4.610 1.00 0.00 C ATOM 494 NZ LYS A 33 14.864 -19.599 -5.541 1.00 0.00 N ATOM 0 H LYS A 33 12.750 -18.221 0.540 1.00 0.00 H new ATOM 0 HA LYS A 33 14.915 -20.158 0.069 1.00 0.00 H new ATOM 0 HB2 LYS A 33 14.089 -17.433 -0.913 1.00 0.00 H new ATOM 0 HB3 LYS A 33 15.789 -17.843 -1.032 1.00 0.00 H new ATOM 0 HG2 LYS A 33 15.150 -19.999 -2.201 1.00 0.00 H new ATOM 0 HG3 LYS A 33 13.470 -19.500 -2.148 1.00 0.00 H new ATOM 0 HD2 LYS A 33 14.368 -17.271 -3.288 1.00 0.00 H new ATOM 0 HD3 LYS A 33 15.761 -18.249 -3.703 1.00 0.00 H new ATOM 0 HE2 LYS A 33 13.192 -19.635 -4.226 1.00 0.00 H new ATOM 0 HE3 LYS A 33 13.359 -18.150 -5.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 14.332 -20.024 -6.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 15.541 -18.905 -5.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 15.379 -20.344 -5.030 1.00 0.00 H new ATOM 508 N ILE A 34 15.247 -17.589 2.091 1.00 0.00 N ATOM 509 CA ILE A 34 16.151 -17.027 3.134 1.00 0.00 C ATOM 510 C ILE A 34 16.159 -17.947 4.356 1.00 0.00 C ATOM 511 O ILE A 34 17.143 -18.045 5.063 1.00 0.00 O ATOM 512 CB ILE A 34 15.653 -15.640 3.540 1.00 0.00 C ATOM 513 CG1 ILE A 34 15.695 -14.707 2.329 1.00 0.00 C ATOM 514 CG2 ILE A 34 16.551 -15.082 4.645 1.00 0.00 C ATOM 515 CD1 ILE A 34 15.119 -13.344 2.715 1.00 0.00 C ATOM 0 H ILE A 34 14.338 -17.132 2.011 1.00 0.00 H new ATOM 0 HA ILE A 34 17.163 -16.949 2.736 1.00 0.00 H new ATOM 0 HB ILE A 34 14.629 -15.714 3.905 1.00 0.00 H new ATOM 0 HG12 ILE A 34 16.721 -14.594 1.979 1.00 0.00 H new ATOM 0 HG13 ILE A 34 15.123 -15.136 1.506 1.00 0.00 H new ATOM 0 HG21 ILE A 34 16.198 -14.093 4.936 1.00 0.00 H new ATOM 0 HG22 ILE A 34 16.521 -15.747 5.508 1.00 0.00 H new ATOM 0 HG23 ILE A 34 17.575 -15.008 4.279 1.00 0.00 H new ATOM 0 HD11 ILE A 34 15.149 -12.679 1.852 1.00 0.00 H new ATOM 0 HD12 ILE A 34 14.087 -13.465 3.044 1.00 0.00 H new ATOM 0 HD13 ILE A 34 15.710 -12.915 3.524 1.00 0.00 H new ATOM 527 N ALA A 35 15.072 -18.620 4.614 1.00 0.00 N ATOM 528 CA ALA A 35 15.023 -19.531 5.793 1.00 0.00 C ATOM 529 C ALA A 35 14.040 -20.670 5.518 1.00 0.00 C ATOM 530 O ALA A 35 12.941 -20.692 6.036 1.00 0.00 O ATOM 531 CB ALA A 35 14.563 -18.747 7.023 1.00 0.00 C ATOM 0 H ALA A 35 14.216 -18.579 4.060 1.00 0.00 H new ATOM 0 HA ALA A 35 16.015 -19.944 5.974 1.00 0.00 H new ATOM 0 HB1 ALA A 35 14.527 -19.412 7.886 1.00 0.00 H new ATOM 0 HB2 ALA A 35 15.263 -17.935 7.220 1.00 0.00 H new ATOM 0 HB3 ALA A 35 13.571 -18.334 6.841 1.00 0.00 H new ATOM 537 N PRO A 36 14.449 -21.639 4.685 1.00 0.00 N ATOM 538 CA PRO A 36 13.609 -22.791 4.335 1.00 0.00 C ATOM 539 C PRO A 36 13.423 -23.738 5.524 1.00 0.00 C ATOM 540 O PRO A 36 12.422 -24.419 5.636 1.00 0.00 O ATOM 541 CB PRO A 36 14.400 -23.488 3.228 1.00 0.00 C ATOM 542 CG PRO A 36 15.815 -23.082 3.466 1.00 0.00 C ATOM 543 CD PRO A 36 15.763 -21.686 4.020 1.00 0.00 C ATOM 0 HA PRO A 36 12.605 -22.491 4.034 1.00 0.00 H new ATOM 0 HB2 PRO A 36 14.284 -24.571 3.279 1.00 0.00 H new ATOM 0 HB3 PRO A 36 14.059 -23.177 2.241 1.00 0.00 H new ATOM 0 HG2 PRO A 36 16.302 -23.761 4.166 1.00 0.00 H new ATOM 0 HG3 PRO A 36 16.390 -23.112 2.540 1.00 0.00 H new ATOM 0 HD2 PRO A 36 16.577 -21.500 4.721 1.00 0.00 H new ATOM 0 HD3 PRO A 36 15.843 -20.937 3.233 1.00 0.00 H new ATOM 551 N GLN A 37 14.377 -23.785 6.413 1.00 0.00 N ATOM 552 CA GLN A 37 14.252 -24.685 7.593 1.00 0.00 C ATOM 553 C GLN A 37 13.279 -24.066 8.600 1.00 0.00 C ATOM 554 O GLN A 37 12.686 -24.752 9.407 1.00 0.00 O ATOM 555 CB GLN A 37 15.622 -24.862 8.250 1.00 0.00 C ATOM 556 CG GLN A 37 16.556 -25.598 7.287 1.00 0.00 C ATOM 557 CD GLN A 37 17.939 -25.740 7.925 1.00 0.00 C ATOM 558 OE1 GLN A 37 18.254 -25.057 8.879 1.00 0.00 O ATOM 559 NE2 GLN A 37 18.784 -26.606 7.435 1.00 0.00 N ATOM 0 H GLN A 37 15.238 -23.239 6.373 1.00 0.00 H new ATOM 0 HA GLN A 37 13.878 -25.657 7.272 1.00 0.00 H new ATOM 0 HB2 GLN A 37 16.042 -23.890 8.509 1.00 0.00 H new ATOM 0 HB3 GLN A 37 15.522 -25.424 9.178 1.00 0.00 H new ATOM 0 HG2 GLN A 37 16.150 -26.582 7.051 1.00 0.00 H new ATOM 0 HG3 GLN A 37 16.632 -25.050 6.348 1.00 0.00 H new ATOM 0 HE21 GLN A 37 18.520 -27.180 6.634 1.00 0.00 H new ATOM 0 HE22 GLN A 37 19.709 -26.709 7.853 1.00 0.00 H new ATOM 568 N ALA A 38 13.112 -22.772 8.558 1.00 0.00 N ATOM 569 CA ALA A 38 12.178 -22.111 9.512 1.00 0.00 C ATOM 570 C ALA A 38 10.735 -22.427 9.108 1.00 0.00 C ATOM 571 O ALA A 38 9.886 -22.669 9.943 1.00 0.00 O ATOM 572 CB ALA A 38 12.398 -20.597 9.476 1.00 0.00 C ATOM 0 H ALA A 38 13.582 -22.145 7.905 1.00 0.00 H new ATOM 0 HA ALA A 38 12.364 -22.480 10.521 1.00 0.00 H new ATOM 0 HB1 ALA A 38 11.715 -20.113 10.174 1.00 0.00 H new ATOM 0 HB2 ALA A 38 13.426 -20.372 9.760 1.00 0.00 H new ATOM 0 HB3 ALA A 38 12.210 -20.226 8.468 1.00 0.00 H new ATOM 578 N VAL A 39 10.453 -22.427 7.835 1.00 0.00 N ATOM 579 CA VAL A 39 9.067 -22.730 7.377 1.00 0.00 C ATOM 580 C VAL A 39 9.077 -24.011 6.541 1.00 0.00 C ATOM 581 O VAL A 39 10.055 -24.335 5.898 1.00 0.00 O ATOM 582 CB VAL A 39 8.546 -21.570 6.528 1.00 0.00 C ATOM 583 CG1 VAL A 39 9.526 -21.294 5.385 1.00 0.00 C ATOM 584 CG2 VAL A 39 7.177 -21.935 5.950 1.00 0.00 C ATOM 0 H VAL A 39 11.122 -22.230 7.091 1.00 0.00 H new ATOM 0 HA VAL A 39 8.418 -22.866 8.242 1.00 0.00 H new ATOM 0 HB VAL A 39 8.452 -20.679 7.149 1.00 0.00 H new ATOM 0 HG11 VAL A 39 9.155 -20.467 4.779 1.00 0.00 H new ATOM 0 HG12 VAL A 39 10.501 -21.033 5.797 1.00 0.00 H new ATOM 0 HG13 VAL A 39 9.621 -22.185 4.764 1.00 0.00 H new ATOM 0 HG21 VAL A 39 6.805 -21.108 5.345 1.00 0.00 H new ATOM 0 HG22 VAL A 39 7.270 -22.826 5.329 1.00 0.00 H new ATOM 0 HG23 VAL A 39 6.479 -22.131 6.764 1.00 0.00 H new ATOM 594 N LYS A 40 7.996 -24.742 6.544 1.00 0.00 N ATOM 595 CA LYS A 40 7.947 -26.002 5.749 1.00 0.00 C ATOM 596 C LYS A 40 7.785 -25.665 4.266 1.00 0.00 C ATOM 597 O LYS A 40 8.528 -26.136 3.427 1.00 0.00 O ATOM 598 CB LYS A 40 6.761 -26.852 6.210 1.00 0.00 C ATOM 599 CG LYS A 40 6.782 -28.195 5.479 1.00 0.00 C ATOM 600 CD LYS A 40 5.518 -28.984 5.827 1.00 0.00 C ATOM 601 CE LYS A 40 5.571 -30.355 5.148 1.00 0.00 C ATOM 602 NZ LYS A 40 4.708 -30.341 3.934 1.00 0.00 N ATOM 0 H LYS A 40 7.145 -24.522 7.062 1.00 0.00 H new ATOM 0 HA LYS A 40 8.872 -26.559 5.896 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.811 -27.011 7.287 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.826 -26.330 6.008 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.839 -28.034 4.402 1.00 0.00 H new ATOM 0 HG3 LYS A 40 7.668 -28.763 5.764 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.437 -29.104 6.907 1.00 0.00 H new ATOM 0 HD3 LYS A 40 4.633 -28.438 5.500 1.00 0.00 H new ATOM 0 HE2 LYS A 40 6.598 -30.598 4.875 1.00 0.00 H new ATOM 0 HE3 LYS A 40 5.234 -31.128 5.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 4.743 -31.272 3.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 3.728 -30.127 4.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 5.050 -29.614 3.274 1.00 0.00 H new ATOM 616 N CYS A 41 6.816 -24.856 3.933 1.00 0.00 N ATOM 617 CA CYS A 41 6.609 -24.493 2.503 1.00 0.00 C ATOM 618 C CYS A 41 5.379 -23.590 2.376 1.00 0.00 C ATOM 619 O CYS A 41 4.323 -23.886 2.900 1.00 0.00 O ATOM 620 CB CYS A 41 6.392 -25.765 1.681 1.00 0.00 C ATOM 621 SG CYS A 41 7.658 -25.875 0.392 1.00 0.00 S ATOM 0 H CYS A 41 6.160 -24.432 4.589 1.00 0.00 H new ATOM 0 HA CYS A 41 7.487 -23.964 2.133 1.00 0.00 H new ATOM 0 HB2 CYS A 41 6.440 -26.641 2.328 1.00 0.00 H new ATOM 0 HB3 CYS A 41 5.399 -25.755 1.231 1.00 0.00 H new ATOM 0 HG CYS A 41 7.475 -26.957 -0.305 1.00 0.00 H new ATOM 627 N ALA A 42 5.507 -22.490 1.685 1.00 0.00 N ATOM 628 CA ALA A 42 4.344 -21.572 1.526 1.00 0.00 C ATOM 629 C ALA A 42 3.619 -21.891 0.217 1.00 0.00 C ATOM 630 O ALA A 42 4.202 -21.865 -0.849 1.00 0.00 O ATOM 631 CB ALA A 42 4.835 -20.123 1.498 1.00 0.00 C ATOM 0 H ALA A 42 6.365 -22.188 1.224 1.00 0.00 H new ATOM 0 HA ALA A 42 3.659 -21.706 2.363 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.984 -19.452 1.382 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.351 -19.896 2.431 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.521 -19.987 0.662 1.00 0.00 H new ATOM 637 N GLU A 43 2.351 -22.194 0.288 1.00 0.00 N ATOM 638 CA GLU A 43 1.590 -22.516 -0.952 1.00 0.00 C ATOM 639 C GLU A 43 0.355 -21.617 -1.040 1.00 0.00 C ATOM 640 O GLU A 43 -0.176 -21.176 -0.041 1.00 0.00 O ATOM 641 CB GLU A 43 1.152 -23.981 -0.916 1.00 0.00 C ATOM 642 CG GLU A 43 2.385 -24.879 -0.793 1.00 0.00 C ATOM 643 CD GLU A 43 1.950 -26.346 -0.809 1.00 0.00 C ATOM 644 OE1 GLU A 43 0.759 -26.593 -0.708 1.00 0.00 O ATOM 645 OE2 GLU A 43 2.816 -27.199 -0.923 1.00 0.00 O ATOM 0 H GLU A 43 1.810 -22.232 1.152 1.00 0.00 H new ATOM 0 HA GLU A 43 2.225 -22.348 -1.822 1.00 0.00 H new ATOM 0 HB2 GLU A 43 0.480 -24.150 -0.075 1.00 0.00 H new ATOM 0 HB3 GLU A 43 0.598 -24.228 -1.821 1.00 0.00 H new ATOM 0 HG2 GLU A 43 3.074 -24.684 -1.615 1.00 0.00 H new ATOM 0 HG3 GLU A 43 2.919 -24.657 0.131 1.00 0.00 H new ATOM 652 N ILE A 44 -0.107 -21.342 -2.230 1.00 0.00 N ATOM 653 CA ILE A 44 -1.307 -20.471 -2.380 1.00 0.00 C ATOM 654 C ILE A 44 -2.514 -21.329 -2.766 1.00 0.00 C ATOM 655 O ILE A 44 -2.526 -21.977 -3.793 1.00 0.00 O ATOM 656 CB ILE A 44 -1.050 -19.431 -3.472 1.00 0.00 C ATOM 657 CG1 ILE A 44 0.219 -18.643 -3.137 1.00 0.00 C ATOM 658 CG2 ILE A 44 -2.238 -18.471 -3.552 1.00 0.00 C ATOM 659 CD1 ILE A 44 0.542 -17.683 -4.283 1.00 0.00 C ATOM 0 H ILE A 44 0.294 -21.683 -3.104 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.508 -19.964 -1.436 1.00 0.00 H new ATOM 0 HB ILE A 44 -0.924 -19.935 -4.430 1.00 0.00 H new ATOM 0 HG12 ILE A 44 0.080 -18.086 -2.210 1.00 0.00 H new ATOM 0 HG13 ILE A 44 1.052 -19.327 -2.976 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -2.055 -17.730 -4.330 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.143 -19.031 -3.789 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.364 -17.967 -2.594 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.446 -17.122 -4.044 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.699 -18.251 -5.200 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.288 -16.991 -4.423 1.00 0.00 H new ATOM 671 N LEU A 45 -3.533 -21.337 -1.949 1.00 0.00 N ATOM 672 CA LEU A 45 -4.738 -22.152 -2.268 1.00 0.00 C ATOM 673 C LEU A 45 -5.363 -21.650 -3.572 1.00 0.00 C ATOM 674 O LEU A 45 -5.746 -22.423 -4.427 1.00 0.00 O ATOM 675 CB LEU A 45 -5.755 -22.024 -1.132 1.00 0.00 C ATOM 676 CG LEU A 45 -6.926 -22.975 -1.386 1.00 0.00 C ATOM 677 CD1 LEU A 45 -6.473 -24.418 -1.147 1.00 0.00 C ATOM 678 CD2 LEU A 45 -8.074 -22.638 -0.433 1.00 0.00 C ATOM 0 H LEU A 45 -3.582 -20.814 -1.075 1.00 0.00 H new ATOM 0 HA LEU A 45 -4.450 -23.197 -2.382 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.282 -22.259 -0.178 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.114 -20.997 -1.065 1.00 0.00 H new ATOM 0 HG LEU A 45 -7.265 -22.866 -2.416 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -7.307 -25.096 -1.328 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.655 -24.660 -1.826 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -6.134 -24.527 -0.117 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -8.908 -23.316 -0.614 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -7.735 -22.747 0.597 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -8.398 -21.611 -0.602 1.00 0.00 H new ATOM 690 N GLU A 46 -5.467 -20.358 -3.732 1.00 0.00 N ATOM 691 CA GLU A 46 -6.066 -19.808 -4.980 1.00 0.00 C ATOM 692 C GLU A 46 -5.636 -18.350 -5.153 1.00 0.00 C ATOM 693 O GLU A 46 -5.316 -17.670 -4.199 1.00 0.00 O ATOM 694 CB GLU A 46 -7.591 -19.881 -4.890 1.00 0.00 C ATOM 695 CG GLU A 46 -8.035 -21.345 -4.900 1.00 0.00 C ATOM 696 CD GLU A 46 -9.560 -21.417 -5.005 1.00 0.00 C ATOM 697 OE1 GLU A 46 -10.185 -20.370 -4.968 1.00 0.00 O ATOM 698 OE2 GLU A 46 -10.076 -22.516 -5.120 1.00 0.00 O ATOM 0 H GLU A 46 -5.163 -19.661 -3.052 1.00 0.00 H new ATOM 0 HA GLU A 46 -5.724 -20.392 -5.834 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.936 -19.392 -3.979 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.041 -19.348 -5.728 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -7.577 -21.869 -5.739 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -7.699 -21.844 -3.991 1.00 0.00 H new ATOM 705 N GLY A 47 -5.625 -17.867 -6.365 1.00 0.00 N ATOM 706 CA GLY A 47 -5.217 -16.454 -6.599 1.00 0.00 C ATOM 707 C GLY A 47 -3.815 -16.423 -7.208 1.00 0.00 C ATOM 708 O GLY A 47 -3.540 -15.670 -8.121 1.00 0.00 O ATOM 0 H GLY A 47 -5.881 -18.390 -7.203 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -5.926 -15.965 -7.267 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -5.230 -15.900 -5.660 1.00 0.00 H new ATOM 712 N ASP A 48 -2.925 -17.238 -6.711 1.00 0.00 N ATOM 713 CA ASP A 48 -1.540 -17.256 -7.261 1.00 0.00 C ATOM 714 C ASP A 48 -0.894 -15.883 -7.064 1.00 0.00 C ATOM 715 O ASP A 48 -0.146 -15.414 -7.897 1.00 0.00 O ATOM 716 CB ASP A 48 -1.590 -17.586 -8.755 1.00 0.00 C ATOM 717 CG ASP A 48 -2.063 -19.029 -8.942 1.00 0.00 C ATOM 718 OD1 ASP A 48 -2.146 -19.738 -7.952 1.00 0.00 O ATOM 719 OD2 ASP A 48 -2.332 -19.401 -10.073 1.00 0.00 O ATOM 0 H ASP A 48 -3.097 -17.892 -5.948 1.00 0.00 H new ATOM 0 HA ASP A 48 -0.952 -18.012 -6.740 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.266 -16.901 -9.267 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.604 -17.454 -9.201 1.00 0.00 H new ATOM 724 N GLY A 49 -1.176 -15.238 -5.966 1.00 0.00 N ATOM 725 CA GLY A 49 -0.577 -13.895 -5.716 1.00 0.00 C ATOM 726 C GLY A 49 -1.462 -12.817 -6.343 1.00 0.00 C ATOM 727 O GLY A 49 -0.983 -11.810 -6.825 1.00 0.00 O ATOM 0 H GLY A 49 -1.794 -15.582 -5.231 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -0.479 -13.722 -4.644 1.00 0.00 H new ATOM 0 HA3 GLY A 49 0.426 -13.848 -6.139 1.00 0.00 H new ATOM 731 N GLY A 50 -2.753 -13.020 -6.341 1.00 0.00 N ATOM 732 CA GLY A 50 -3.668 -12.006 -6.937 1.00 0.00 C ATOM 733 C GLY A 50 -4.636 -11.501 -5.865 1.00 0.00 C ATOM 734 O GLY A 50 -4.432 -11.710 -4.685 1.00 0.00 O ATOM 0 H GLY A 50 -3.212 -13.844 -5.952 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.092 -11.174 -7.343 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -4.223 -12.444 -7.766 1.00 0.00 H new ATOM 738 N PRO A 51 -5.712 -10.823 -6.291 1.00 0.00 N ATOM 739 CA PRO A 51 -6.723 -10.280 -5.374 1.00 0.00 C ATOM 740 C PRO A 51 -7.553 -11.390 -4.721 1.00 0.00 C ATOM 741 O PRO A 51 -8.051 -12.278 -5.384 1.00 0.00 O ATOM 742 CB PRO A 51 -7.609 -9.430 -6.283 1.00 0.00 C ATOM 743 CG PRO A 51 -7.440 -10.027 -7.639 1.00 0.00 C ATOM 744 CD PRO A 51 -6.026 -10.532 -7.700 1.00 0.00 C ATOM 0 HA PRO A 51 -6.274 -9.723 -4.552 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -8.651 -9.461 -5.963 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -7.303 -8.384 -6.269 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -8.150 -10.838 -7.799 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -7.623 -9.285 -8.417 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -5.943 -11.422 -8.323 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -5.350 -9.786 -8.118 1.00 0.00 H new ATOM 752 N GLY A 52 -7.706 -11.345 -3.426 1.00 0.00 N ATOM 753 CA GLY A 52 -8.502 -12.395 -2.733 1.00 0.00 C ATOM 754 C GLY A 52 -7.744 -13.722 -2.781 1.00 0.00 C ATOM 755 O GLY A 52 -8.332 -14.786 -2.758 1.00 0.00 O ATOM 0 H GLY A 52 -7.314 -10.626 -2.818 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.684 -12.105 -1.698 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.476 -12.503 -3.210 1.00 0.00 H new ATOM 759 N THR A 53 -6.441 -13.670 -2.848 1.00 0.00 N ATOM 760 CA THR A 53 -5.647 -14.929 -2.898 1.00 0.00 C ATOM 761 C THR A 53 -5.444 -15.462 -1.479 1.00 0.00 C ATOM 762 O THR A 53 -5.255 -14.712 -0.543 1.00 0.00 O ATOM 763 CB THR A 53 -4.283 -14.645 -3.535 1.00 0.00 C ATOM 764 OG1 THR A 53 -4.472 -14.129 -4.844 1.00 0.00 O ATOM 765 CG2 THR A 53 -3.473 -15.940 -3.606 1.00 0.00 C ATOM 0 H THR A 53 -5.893 -12.810 -2.870 1.00 0.00 H new ATOM 0 HA THR A 53 -6.180 -15.671 -3.492 1.00 0.00 H new ATOM 0 HB THR A 53 -3.744 -13.915 -2.932 1.00 0.00 H new ATOM 0 HG1 THR A 53 -5.050 -13.338 -4.804 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.503 -15.738 -4.059 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.329 -16.334 -2.600 1.00 0.00 H new ATOM 0 HG23 THR A 53 -4.010 -16.672 -4.209 1.00 0.00 H new ATOM 773 N ILE A 54 -5.482 -16.756 -1.312 1.00 0.00 N ATOM 774 CA ILE A 54 -5.292 -17.338 0.047 1.00 0.00 C ATOM 775 C ILE A 54 -3.930 -18.031 0.116 1.00 0.00 C ATOM 776 O ILE A 54 -3.573 -18.807 -0.748 1.00 0.00 O ATOM 777 CB ILE A 54 -6.398 -18.356 0.325 1.00 0.00 C ATOM 778 CG1 ILE A 54 -7.763 -17.712 0.070 1.00 0.00 C ATOM 779 CG2 ILE A 54 -6.315 -18.812 1.783 1.00 0.00 C ATOM 780 CD1 ILE A 54 -7.830 -16.361 0.784 1.00 0.00 C ATOM 0 H ILE A 54 -5.636 -17.435 -2.057 1.00 0.00 H new ATOM 0 HA ILE A 54 -5.335 -16.544 0.793 1.00 0.00 H new ATOM 0 HB ILE A 54 -6.274 -19.215 -0.334 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -7.920 -17.578 -1.000 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -8.558 -18.365 0.429 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -7.103 -19.538 1.983 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.344 -19.272 1.966 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -6.439 -17.952 2.441 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -8.802 -15.902 0.603 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -7.692 -16.508 1.855 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -7.044 -15.709 0.403 1.00 0.00 H new ATOM 792 N LYS A 55 -3.167 -17.758 1.139 1.00 0.00 N ATOM 793 CA LYS A 55 -1.829 -18.402 1.260 1.00 0.00 C ATOM 794 C LYS A 55 -1.792 -19.272 2.518 1.00 0.00 C ATOM 795 O LYS A 55 -2.436 -18.981 3.505 1.00 0.00 O ATOM 796 CB LYS A 55 -0.750 -17.321 1.360 1.00 0.00 C ATOM 797 CG LYS A 55 -0.763 -16.467 0.091 1.00 0.00 C ATOM 798 CD LYS A 55 0.398 -15.471 0.138 1.00 0.00 C ATOM 799 CE LYS A 55 0.356 -14.578 -1.103 1.00 0.00 C ATOM 800 NZ LYS A 55 1.739 -14.148 -1.451 1.00 0.00 N ATOM 0 H LYS A 55 -3.412 -17.118 1.895 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.645 -19.022 0.383 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.928 -16.695 2.234 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.229 -17.781 1.491 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.676 -17.103 -0.790 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.710 -15.935 0.007 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.332 -14.862 1.040 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.347 -16.005 0.183 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -0.090 -15.118 -1.938 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.271 -13.706 -0.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.712 -13.541 -2.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 2.148 -13.617 -0.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.324 -14.985 -1.646 1.00 0.00 H new ATOM 814 N LYS A 56 -1.039 -20.337 2.490 1.00 0.00 N ATOM 815 CA LYS A 56 -0.957 -21.225 3.684 1.00 0.00 C ATOM 816 C LYS A 56 0.510 -21.549 3.975 1.00 0.00 C ATOM 817 O LYS A 56 1.239 -21.995 3.111 1.00 0.00 O ATOM 818 CB LYS A 56 -1.721 -22.521 3.413 1.00 0.00 C ATOM 819 CG LYS A 56 -1.776 -23.356 4.694 1.00 0.00 C ATOM 820 CD LYS A 56 -2.438 -24.704 4.400 1.00 0.00 C ATOM 821 CE LYS A 56 -2.500 -25.531 5.687 1.00 0.00 C ATOM 822 NZ LYS A 56 -3.630 -25.050 6.531 1.00 0.00 N ATOM 0 H LYS A 56 -0.477 -20.631 1.691 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.397 -20.719 4.543 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -2.730 -22.296 3.069 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -1.232 -23.085 2.619 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.769 -23.511 5.083 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -2.336 -22.824 5.463 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -3.442 -24.550 4.005 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -1.874 -25.240 3.637 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.634 -26.586 5.448 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -1.561 -25.444 6.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -3.914 -25.801 7.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -3.330 -24.212 7.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -4.436 -24.801 5.923 1.00 0.00 H new ATOM 836 N ILE A 57 0.950 -21.328 5.183 1.00 0.00 N ATOM 837 CA ILE A 57 2.369 -21.624 5.523 1.00 0.00 C ATOM 838 C ILE A 57 2.423 -22.661 6.648 1.00 0.00 C ATOM 839 O ILE A 57 1.752 -22.536 7.653 1.00 0.00 O ATOM 840 CB ILE A 57 3.063 -20.340 5.980 1.00 0.00 C ATOM 841 CG1 ILE A 57 2.897 -19.261 4.909 1.00 0.00 C ATOM 842 CG2 ILE A 57 4.552 -20.614 6.201 1.00 0.00 C ATOM 843 CD1 ILE A 57 3.195 -17.889 5.516 1.00 0.00 C ATOM 0 H ILE A 57 0.388 -20.955 5.949 1.00 0.00 H new ATOM 0 HA ILE A 57 2.876 -22.019 4.643 1.00 0.00 H new ATOM 0 HB ILE A 57 2.615 -19.998 6.913 1.00 0.00 H new ATOM 0 HG12 ILE A 57 3.571 -19.455 4.075 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.882 -19.282 4.511 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.046 -19.699 6.527 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.671 -21.382 6.965 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.001 -20.957 5.269 1.00 0.00 H new ATOM 0 HD11 ILE A 57 3.077 -17.120 4.753 1.00 0.00 H new ATOM 0 HD12 ILE A 57 2.503 -17.696 6.336 1.00 0.00 H new ATOM 0 HD13 ILE A 57 4.218 -17.872 5.893 1.00 0.00 H new ATOM 855 N THR A 58 3.217 -23.683 6.485 1.00 0.00 N ATOM 856 CA THR A 58 3.316 -24.729 7.542 1.00 0.00 C ATOM 857 C THR A 58 4.726 -24.718 8.137 1.00 0.00 C ATOM 858 O THR A 58 5.710 -24.792 7.428 1.00 0.00 O ATOM 859 CB THR A 58 3.031 -26.101 6.929 1.00 0.00 C ATOM 860 OG1 THR A 58 1.756 -26.081 6.301 1.00 0.00 O ATOM 861 CG2 THR A 58 3.044 -27.165 8.027 1.00 0.00 C ATOM 0 H THR A 58 3.802 -23.839 5.664 1.00 0.00 H new ATOM 0 HA THR A 58 2.588 -24.524 8.327 1.00 0.00 H new ATOM 0 HB THR A 58 3.797 -26.336 6.190 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.572 -26.959 5.906 1.00 0.00 H new ATOM 0 HG21 THR A 58 2.841 -28.142 7.589 1.00 0.00 H new ATOM 0 HG22 THR A 58 4.022 -27.179 8.508 1.00 0.00 H new ATOM 0 HG23 THR A 58 2.279 -26.933 8.768 1.00 0.00 H new ATOM 869 N PHE A 59 4.832 -24.624 9.434 1.00 0.00 N ATOM 870 CA PHE A 59 6.178 -24.608 10.072 1.00 0.00 C ATOM 871 C PHE A 59 6.587 -26.035 10.444 1.00 0.00 C ATOM 872 O PHE A 59 5.799 -26.802 10.962 1.00 0.00 O ATOM 873 CB PHE A 59 6.132 -23.744 11.335 1.00 0.00 C ATOM 874 CG PHE A 59 5.866 -22.309 10.952 1.00 0.00 C ATOM 875 CD1 PHE A 59 6.921 -21.487 10.537 1.00 0.00 C ATOM 876 CD2 PHE A 59 4.563 -21.797 11.010 1.00 0.00 C ATOM 877 CE1 PHE A 59 6.675 -20.155 10.182 1.00 0.00 C ATOM 878 CE2 PHE A 59 4.317 -20.466 10.654 1.00 0.00 C ATOM 879 CZ PHE A 59 5.372 -19.645 10.240 1.00 0.00 C ATOM 0 H PHE A 59 4.045 -24.558 10.079 1.00 0.00 H new ATOM 0 HA PHE A 59 6.905 -24.194 9.374 1.00 0.00 H new ATOM 0 HB2 PHE A 59 5.352 -24.103 12.006 1.00 0.00 H new ATOM 0 HB3 PHE A 59 7.076 -23.819 11.875 1.00 0.00 H new ATOM 0 HD1 PHE A 59 7.926 -21.881 10.491 1.00 0.00 H new ATOM 0 HD2 PHE A 59 3.748 -22.430 11.330 1.00 0.00 H new ATOM 0 HE1 PHE A 59 7.490 -19.521 9.864 1.00 0.00 H new ATOM 0 HE2 PHE A 59 3.312 -20.072 10.699 1.00 0.00 H new ATOM 0 HZ PHE A 59 5.181 -18.618 9.965 1.00 0.00 H new ATOM 974 N TYR A 67 0.849 -23.138 11.969 1.00 0.00 N ATOM 975 CA TYR A 67 0.809 -22.746 10.533 1.00 0.00 C ATOM 976 C TYR A 67 0.147 -21.372 10.402 1.00 0.00 C ATOM 977 O TYR A 67 -0.742 -21.027 11.153 1.00 0.00 O ATOM 978 CB TYR A 67 0.002 -23.778 9.743 1.00 0.00 C ATOM 979 CG TYR A 67 -1.460 -23.654 10.100 1.00 0.00 C ATOM 980 CD1 TYR A 67 -2.286 -22.785 9.376 1.00 0.00 C ATOM 981 CD2 TYR A 67 -1.990 -24.405 11.156 1.00 0.00 C ATOM 982 CE1 TYR A 67 -3.640 -22.668 9.708 1.00 0.00 C ATOM 983 CE2 TYR A 67 -3.345 -24.288 11.488 1.00 0.00 C ATOM 984 CZ TYR A 67 -4.170 -23.420 10.764 1.00 0.00 C ATOM 985 OH TYR A 67 -5.506 -23.304 11.092 1.00 0.00 O ATOM 0 HA TYR A 67 1.824 -22.702 10.139 1.00 0.00 H new ATOM 0 HB2 TYR A 67 0.141 -23.622 8.673 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.358 -24.783 9.968 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -1.878 -22.205 8.561 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.353 -25.075 11.715 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -4.277 -21.998 9.150 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -3.753 -24.868 12.303 1.00 0.00 H new ATOM 0 HH TYR A 67 -5.935 -22.658 10.493 1.00 0.00 H new ATOM 995 N VAL A 68 0.575 -20.583 9.453 1.00 0.00 N ATOM 996 CA VAL A 68 -0.032 -19.234 9.279 1.00 0.00 C ATOM 997 C VAL A 68 -0.551 -19.086 7.847 1.00 0.00 C ATOM 998 O VAL A 68 -0.003 -19.644 6.917 1.00 0.00 O ATOM 999 CB VAL A 68 1.023 -18.160 9.551 1.00 0.00 C ATOM 1000 CG1 VAL A 68 0.372 -16.778 9.484 1.00 0.00 C ATOM 1001 CG2 VAL A 68 1.621 -18.376 10.943 1.00 0.00 C ATOM 0 H VAL A 68 1.317 -20.815 8.793 1.00 0.00 H new ATOM 0 HA VAL A 68 -0.859 -19.117 9.979 1.00 0.00 H new ATOM 0 HB VAL A 68 1.812 -18.226 8.802 1.00 0.00 H new ATOM 0 HG11 VAL A 68 1.123 -16.012 9.678 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -0.055 -16.625 8.493 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.417 -16.711 10.233 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.373 -17.612 11.139 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.832 -18.309 11.692 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.084 -19.361 10.991 1.00 0.00 H new ATOM 1011 N LYS A 69 -1.603 -18.337 7.663 1.00 0.00 N ATOM 1012 CA LYS A 69 -2.157 -18.151 6.292 1.00 0.00 C ATOM 1013 C LYS A 69 -2.160 -16.661 5.944 1.00 0.00 C ATOM 1014 O LYS A 69 -2.391 -15.818 6.787 1.00 0.00 O ATOM 1015 CB LYS A 69 -3.588 -18.690 6.243 1.00 0.00 C ATOM 1016 CG LYS A 69 -3.567 -20.208 6.424 1.00 0.00 C ATOM 1017 CD LYS A 69 -4.986 -20.758 6.279 1.00 0.00 C ATOM 1018 CE LYS A 69 -4.969 -22.275 6.487 1.00 0.00 C ATOM 1019 NZ LYS A 69 -6.345 -22.749 6.804 1.00 0.00 N ATOM 0 H LYS A 69 -2.103 -17.845 8.403 1.00 0.00 H new ATOM 0 HA LYS A 69 -1.541 -18.692 5.573 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -4.189 -18.228 7.026 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -4.053 -18.433 5.291 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -2.911 -20.664 5.683 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.165 -20.463 7.405 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -5.646 -20.288 7.008 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -5.381 -20.520 5.291 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -4.600 -22.772 5.590 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -4.288 -22.534 7.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -6.333 -23.779 6.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -6.681 -22.284 7.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -6.983 -22.515 6.017 1.00 0.00 H new ATOM 1033 N HIS A 70 -1.906 -16.329 4.707 1.00 0.00 N ATOM 1034 CA HIS A 70 -1.895 -14.893 4.309 1.00 0.00 C ATOM 1035 C HIS A 70 -2.899 -14.666 3.177 1.00 0.00 C ATOM 1036 O HIS A 70 -3.008 -15.459 2.262 1.00 0.00 O ATOM 1037 CB HIS A 70 -0.494 -14.506 3.832 1.00 0.00 C ATOM 1038 CG HIS A 70 0.486 -14.689 4.956 1.00 0.00 C ATOM 1039 ND1 HIS A 70 0.758 -13.684 5.870 1.00 0.00 N ATOM 1040 CD2 HIS A 70 1.267 -15.756 5.328 1.00 0.00 C ATOM 1041 CE1 HIS A 70 1.667 -14.162 6.741 1.00 0.00 C ATOM 1042 NE2 HIS A 70 2.011 -15.421 6.455 1.00 0.00 N ATOM 0 H HIS A 70 -1.706 -16.990 3.956 1.00 0.00 H new ATOM 0 HA HIS A 70 -2.171 -14.279 5.166 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -0.205 -15.121 2.980 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -0.487 -13.470 3.494 1.00 0.00 H new ATOM 0 HD1 HIS A 70 0.345 -12.751 5.881 1.00 0.00 H new ATOM 0 HD2 HIS A 70 1.299 -16.710 4.823 1.00 0.00 H new ATOM 0 HE1 HIS A 70 2.069 -13.597 7.569 1.00 0.00 H new ATOM 1050 N LYS A 71 -3.633 -13.589 3.230 1.00 0.00 N ATOM 1051 CA LYS A 71 -4.627 -13.310 2.156 1.00 0.00 C ATOM 1052 C LYS A 71 -4.252 -12.009 1.441 1.00 0.00 C ATOM 1053 O LYS A 71 -3.805 -11.061 2.054 1.00 0.00 O ATOM 1054 CB LYS A 71 -6.019 -13.169 2.775 1.00 0.00 C ATOM 1055 CG LYS A 71 -7.061 -13.049 1.662 1.00 0.00 C ATOM 1056 CD LYS A 71 -8.446 -12.838 2.278 1.00 0.00 C ATOM 1057 CE LYS A 71 -9.509 -12.920 1.181 1.00 0.00 C ATOM 1058 NZ LYS A 71 -10.751 -13.527 1.738 1.00 0.00 N ATOM 0 H LYS A 71 -3.587 -12.890 3.971 1.00 0.00 H new ATOM 0 HA LYS A 71 -4.629 -14.131 1.439 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -6.239 -14.033 3.402 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -6.055 -12.290 3.418 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -6.813 -12.215 1.006 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -7.058 -13.950 1.048 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -8.636 -13.593 3.040 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -8.492 -11.868 2.772 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -9.721 -11.925 0.790 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -9.141 -13.518 0.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -11.474 -13.583 0.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.542 -14.483 2.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -11.104 -12.939 2.520 1.00 0.00 H new ATOM 1072 N ILE A 72 -4.429 -11.959 0.149 1.00 0.00 N ATOM 1073 CA ILE A 72 -4.081 -10.720 -0.601 1.00 0.00 C ATOM 1074 C ILE A 72 -5.359 -9.949 -0.939 1.00 0.00 C ATOM 1075 O ILE A 72 -6.319 -10.506 -1.434 1.00 0.00 O ATOM 1076 CB ILE A 72 -3.353 -11.095 -1.894 1.00 0.00 C ATOM 1077 CG1 ILE A 72 -2.159 -11.994 -1.565 1.00 0.00 C ATOM 1078 CG2 ILE A 72 -2.859 -9.824 -2.587 1.00 0.00 C ATOM 1079 CD1 ILE A 72 -1.425 -12.359 -2.856 1.00 0.00 C ATOM 0 H ILE A 72 -4.799 -12.722 -0.419 1.00 0.00 H new ATOM 0 HA ILE A 72 -3.433 -10.094 0.013 1.00 0.00 H new ATOM 0 HB ILE A 72 -4.037 -11.627 -2.555 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.482 -11.482 -0.881 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.499 -12.898 -1.059 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.340 -10.090 -3.508 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.709 -9.183 -2.821 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -2.175 -9.292 -1.926 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.574 -12.999 -2.622 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.105 -12.888 -3.524 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.072 -11.450 -3.343 1.00 0.00 H new ATOM 1091 N HIS A 73 -5.379 -8.672 -0.674 1.00 0.00 N ATOM 1092 CA HIS A 73 -6.594 -7.866 -0.979 1.00 0.00 C ATOM 1093 C HIS A 73 -6.466 -7.254 -2.375 1.00 0.00 C ATOM 1094 O HIS A 73 -7.408 -7.228 -3.141 1.00 0.00 O ATOM 1095 CB HIS A 73 -6.736 -6.748 0.057 1.00 0.00 C ATOM 1096 CG HIS A 73 -6.920 -7.352 1.422 1.00 0.00 C ATOM 1097 ND1 HIS A 73 -8.034 -8.108 1.753 1.00 0.00 N ATOM 1098 CD2 HIS A 73 -6.140 -7.321 2.552 1.00 0.00 C ATOM 1099 CE1 HIS A 73 -7.895 -8.496 3.033 1.00 0.00 C ATOM 1100 NE2 HIS A 73 -6.758 -8.043 3.568 1.00 0.00 N ATOM 0 H HIS A 73 -4.606 -8.152 -0.259 1.00 0.00 H new ATOM 0 HA HIS A 73 -7.474 -8.509 -0.945 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -5.851 -6.112 0.045 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -7.588 -6.114 -0.190 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -8.817 -8.330 1.138 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -5.191 -6.813 2.639 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -8.615 -9.101 3.564 1.00 0.00 H new ATOM 1108 N SER A 74 -5.306 -6.759 -2.711 1.00 0.00 N ATOM 1109 CA SER A 74 -5.118 -6.150 -4.057 1.00 0.00 C ATOM 1110 C SER A 74 -3.635 -5.847 -4.279 1.00 0.00 C ATOM 1111 O SER A 74 -2.916 -5.510 -3.360 1.00 0.00 O ATOM 1112 CB SER A 74 -5.922 -4.850 -4.145 1.00 0.00 C ATOM 1113 OG SER A 74 -5.764 -4.283 -5.438 1.00 0.00 O ATOM 0 H SER A 74 -4.481 -6.750 -2.111 1.00 0.00 H new ATOM 0 HA SER A 74 -5.465 -6.846 -4.821 1.00 0.00 H new ATOM 0 HB2 SER A 74 -6.976 -5.048 -3.949 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.582 -4.147 -3.384 1.00 0.00 H new ATOM 0 HG SER A 74 -6.280 -3.452 -5.496 1.00 0.00 H new ATOM 1119 N ILE A 75 -3.172 -5.964 -5.493 1.00 0.00 N ATOM 1120 CA ILE A 75 -1.736 -5.683 -5.774 1.00 0.00 C ATOM 1121 C ILE A 75 -1.627 -4.713 -6.952 1.00 0.00 C ATOM 1122 O ILE A 75 -2.397 -4.770 -7.889 1.00 0.00 O ATOM 1123 CB ILE A 75 -1.020 -6.989 -6.123 1.00 0.00 C ATOM 1124 CG1 ILE A 75 -1.547 -7.520 -7.458 1.00 0.00 C ATOM 1125 CG2 ILE A 75 -1.278 -8.023 -5.026 1.00 0.00 C ATOM 1126 CD1 ILE A 75 -0.731 -8.744 -7.878 1.00 0.00 C ATOM 0 H ILE A 75 -3.726 -6.242 -6.303 1.00 0.00 H new ATOM 0 HA ILE A 75 -1.274 -5.238 -4.893 1.00 0.00 H new ATOM 0 HB ILE A 75 0.051 -6.804 -6.203 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -2.600 -7.786 -7.366 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.480 -6.745 -8.222 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -0.768 -8.953 -5.275 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -0.901 -7.646 -4.075 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -2.349 -8.208 -4.945 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.106 -9.123 -8.829 1.00 0.00 H new ATOM 0 HD12 ILE A 75 0.316 -8.463 -7.987 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.821 -9.520 -7.118 1.00 0.00 H new ATOM 1138 N ASP A 76 -0.675 -3.821 -6.912 1.00 0.00 N ATOM 1139 CA ASP A 76 -0.519 -2.849 -8.029 1.00 0.00 C ATOM 1140 C ASP A 76 0.908 -2.926 -8.574 1.00 0.00 C ATOM 1141 O ASP A 76 1.798 -2.240 -8.113 1.00 0.00 O ATOM 1142 CB ASP A 76 -0.795 -1.434 -7.518 1.00 0.00 C ATOM 1143 CG ASP A 76 -2.232 -1.351 -7.001 1.00 0.00 C ATOM 1144 OD1 ASP A 76 -3.006 -2.240 -7.315 1.00 0.00 O ATOM 1145 OD2 ASP A 76 -2.535 -0.400 -6.298 1.00 0.00 O ATOM 0 H ASP A 76 0.001 -3.724 -6.154 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.225 -3.091 -8.823 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -0.095 -1.180 -6.722 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.643 -0.710 -8.319 1.00 0.00 H new ATOM 1150 N LYS A 77 1.135 -3.756 -9.555 1.00 0.00 N ATOM 1151 CA LYS A 77 2.504 -3.877 -10.128 1.00 0.00 C ATOM 1152 C LYS A 77 2.938 -2.527 -10.701 1.00 0.00 C ATOM 1153 O LYS A 77 4.093 -2.157 -10.637 1.00 0.00 O ATOM 1154 CB LYS A 77 2.500 -4.924 -11.244 1.00 0.00 C ATOM 1155 CG LYS A 77 2.209 -6.303 -10.648 1.00 0.00 C ATOM 1156 CD LYS A 77 2.343 -7.367 -11.739 1.00 0.00 C ATOM 1157 CE LYS A 77 1.904 -8.724 -11.185 1.00 0.00 C ATOM 1158 NZ LYS A 77 2.160 -9.782 -12.204 1.00 0.00 N ATOM 0 H LYS A 77 0.430 -4.356 -9.984 1.00 0.00 H new ATOM 0 HA LYS A 77 3.199 -4.181 -9.345 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.747 -4.672 -11.991 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.464 -4.932 -11.753 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.902 -6.513 -9.833 1.00 0.00 H new ATOM 0 HG3 LYS A 77 1.204 -6.324 -10.226 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.731 -7.099 -12.600 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.375 -7.420 -12.085 1.00 0.00 H new ATOM 0 HE2 LYS A 77 2.449 -8.948 -10.268 1.00 0.00 H new ATOM 0 HE3 LYS A 77 0.845 -8.699 -10.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 1.862 -10.705 -11.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 1.622 -9.569 -13.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 3.175 -9.811 -12.427 1.00 0.00 H new ATOM 1172 N VAL A 78 2.020 -1.786 -11.259 1.00 0.00 N ATOM 1173 CA VAL A 78 2.382 -0.460 -11.835 1.00 0.00 C ATOM 1174 C VAL A 78 2.729 0.511 -10.705 1.00 0.00 C ATOM 1175 O VAL A 78 3.674 1.270 -10.794 1.00 0.00 O ATOM 1176 CB VAL A 78 1.197 0.089 -12.633 1.00 0.00 C ATOM 1177 CG1 VAL A 78 1.478 1.541 -13.026 1.00 0.00 C ATOM 1178 CG2 VAL A 78 0.997 -0.753 -13.894 1.00 0.00 C ATOM 0 H VAL A 78 1.036 -2.041 -11.341 1.00 0.00 H new ATOM 0 HA VAL A 78 3.243 -0.573 -12.493 1.00 0.00 H new ATOM 0 HB VAL A 78 0.295 0.046 -12.022 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.635 1.934 -13.595 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.620 2.140 -12.127 1.00 0.00 H new ATOM 0 HG13 VAL A 78 2.380 1.585 -13.637 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.153 -0.362 -14.462 1.00 0.00 H new ATOM 0 HG22 VAL A 78 1.898 -0.711 -14.506 1.00 0.00 H new ATOM 0 HG23 VAL A 78 0.797 -1.787 -13.613 1.00 0.00 H new ATOM 1188 N ASN A 79 1.973 0.494 -9.642 1.00 0.00 N ATOM 1189 CA ASN A 79 2.261 1.417 -8.508 1.00 0.00 C ATOM 1190 C ASN A 79 3.258 0.757 -7.554 1.00 0.00 C ATOM 1191 O ASN A 79 3.502 1.239 -6.465 1.00 0.00 O ATOM 1192 CB ASN A 79 0.963 1.724 -7.758 1.00 0.00 C ATOM 1193 CG ASN A 79 -0.039 2.371 -8.715 1.00 0.00 C ATOM 1194 OD1 ASN A 79 -1.206 1.816 -8.891 1.00 0.00 O flip ATOM 1195 ND2 ASN A 79 0.243 3.393 -9.308 1.00 0.00 N flip ATOM 0 H ASN A 79 1.168 -0.119 -9.510 1.00 0.00 H new ATOM 0 HA ASN A 79 2.686 2.344 -8.893 1.00 0.00 H new ATOM 0 HB2 ASN A 79 0.545 0.807 -7.343 1.00 0.00 H new ATOM 0 HB3 ASN A 79 1.164 2.391 -6.920 1.00 0.00 H new ATOM 0 HD21 ASN A 79 1.156 3.827 -9.170 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -0.433 3.817 -9.943 1.00 0.00 H new ATOM 1202 N HIS A 80 3.835 -0.344 -7.951 1.00 0.00 N ATOM 1203 CA HIS A 80 4.814 -1.032 -7.063 1.00 0.00 C ATOM 1204 C HIS A 80 4.264 -1.078 -5.637 1.00 0.00 C ATOM 1205 O HIS A 80 4.973 -0.842 -4.680 1.00 0.00 O ATOM 1206 CB HIS A 80 6.138 -0.265 -7.075 1.00 0.00 C ATOM 1207 CG HIS A 80 6.660 -0.191 -8.484 1.00 0.00 C ATOM 1208 ND1 HIS A 80 6.483 0.929 -9.280 1.00 0.00 N ATOM 1209 CD2 HIS A 80 7.357 -1.091 -9.252 1.00 0.00 C ATOM 1210 CE1 HIS A 80 7.062 0.677 -10.468 1.00 0.00 C ATOM 1211 NE2 HIS A 80 7.609 -0.540 -10.505 1.00 0.00 N ATOM 0 H HIS A 80 3.671 -0.796 -8.850 1.00 0.00 H new ATOM 0 HA HIS A 80 4.979 -2.048 -7.421 1.00 0.00 H new ATOM 0 HB2 HIS A 80 5.993 0.739 -6.676 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.865 -0.762 -6.432 1.00 0.00 H new ATOM 0 HD1 HIS A 80 6.002 1.788 -9.014 1.00 0.00 H new ATOM 0 HD2 HIS A 80 7.663 -2.076 -8.932 1.00 0.00 H new ATOM 0 HE1 HIS A 80 7.082 1.375 -11.292 1.00 0.00 H new ATOM 1219 N THR A 81 3.003 -1.379 -5.487 1.00 0.00 N ATOM 1220 CA THR A 81 2.407 -1.438 -4.122 1.00 0.00 C ATOM 1221 C THR A 81 1.790 -2.819 -3.894 1.00 0.00 C ATOM 1222 O THR A 81 1.071 -3.334 -4.728 1.00 0.00 O ATOM 1223 CB THR A 81 1.323 -0.366 -3.993 1.00 0.00 C ATOM 1224 OG1 THR A 81 1.864 0.897 -4.351 1.00 0.00 O ATOM 1225 CG2 THR A 81 0.821 -0.318 -2.549 1.00 0.00 C ATOM 0 H THR A 81 2.360 -1.587 -6.251 1.00 0.00 H new ATOM 0 HA THR A 81 3.183 -1.261 -3.378 1.00 0.00 H new ATOM 0 HB THR A 81 0.492 -0.606 -4.656 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.227 0.852 -5.260 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.049 0.446 -2.457 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.406 -1.288 -2.276 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.650 -0.077 -1.883 1.00 0.00 H new ATOM 1233 N TYR A 82 2.064 -3.424 -2.771 1.00 0.00 N ATOM 1234 CA TYR A 82 1.492 -4.771 -2.490 1.00 0.00 C ATOM 1235 C TYR A 82 0.639 -4.706 -1.222 1.00 0.00 C ATOM 1236 O TYR A 82 1.100 -4.304 -0.173 1.00 0.00 O ATOM 1237 CB TYR A 82 2.629 -5.775 -2.292 1.00 0.00 C ATOM 1238 CG TYR A 82 2.053 -7.162 -2.133 1.00 0.00 C ATOM 1239 CD1 TYR A 82 1.727 -7.918 -3.267 1.00 0.00 C ATOM 1240 CD2 TYR A 82 1.844 -7.691 -0.855 1.00 0.00 C ATOM 1241 CE1 TYR A 82 1.193 -9.204 -3.120 1.00 0.00 C ATOM 1242 CE2 TYR A 82 1.309 -8.978 -0.709 1.00 0.00 C ATOM 1243 CZ TYR A 82 0.985 -9.733 -1.841 1.00 0.00 C ATOM 1244 OH TYR A 82 0.458 -11.001 -1.696 1.00 0.00 O ATOM 0 H TYR A 82 2.660 -3.044 -2.036 1.00 0.00 H new ATOM 0 HA TYR A 82 0.872 -5.087 -3.329 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.307 -5.747 -3.145 1.00 0.00 H new ATOM 0 HB3 TYR A 82 3.214 -5.509 -1.412 1.00 0.00 H new ATOM 0 HD1 TYR A 82 1.888 -7.509 -4.254 1.00 0.00 H new ATOM 0 HD2 TYR A 82 2.095 -7.108 0.019 1.00 0.00 H new ATOM 0 HE1 TYR A 82 0.942 -9.788 -3.993 1.00 0.00 H new ATOM 0 HE2 TYR A 82 1.147 -9.387 0.277 1.00 0.00 H new ATOM 0 HH TYR A 82 0.583 -11.303 -0.772 1.00 0.00 H new ATOM 1254 N SER A 83 -0.603 -5.097 -1.310 1.00 0.00 N ATOM 1255 CA SER A 83 -1.484 -5.055 -0.108 1.00 0.00 C ATOM 1256 C SER A 83 -1.951 -6.472 0.235 1.00 0.00 C ATOM 1257 O SER A 83 -2.453 -7.190 -0.606 1.00 0.00 O ATOM 1258 CB SER A 83 -2.700 -4.175 -0.400 1.00 0.00 C ATOM 1259 OG SER A 83 -3.518 -4.095 0.759 1.00 0.00 O ATOM 0 H SER A 83 -1.046 -5.443 -2.161 1.00 0.00 H new ATOM 0 HA SER A 83 -0.929 -4.643 0.735 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.377 -3.178 -0.699 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.270 -4.589 -1.232 1.00 0.00 H new ATOM 0 HG SER A 83 -4.296 -3.530 0.572 1.00 0.00 H new ATOM 1265 N TYR A 84 -1.791 -6.877 1.465 1.00 0.00 N ATOM 1266 CA TYR A 84 -2.228 -8.245 1.862 1.00 0.00 C ATOM 1267 C TYR A 84 -2.501 -8.275 3.368 1.00 0.00 C ATOM 1268 O TYR A 84 -2.205 -7.335 4.080 1.00 0.00 O ATOM 1269 CB TYR A 84 -1.128 -9.253 1.520 1.00 0.00 C ATOM 1270 CG TYR A 84 0.030 -9.086 2.476 1.00 0.00 C ATOM 1271 CD1 TYR A 84 0.977 -8.076 2.260 1.00 0.00 C ATOM 1272 CD2 TYR A 84 0.157 -9.941 3.577 1.00 0.00 C ATOM 1273 CE1 TYR A 84 2.049 -7.921 3.147 1.00 0.00 C ATOM 1274 CE2 TYR A 84 1.230 -9.785 4.463 1.00 0.00 C ATOM 1275 CZ TYR A 84 2.175 -8.776 4.248 1.00 0.00 C ATOM 1276 OH TYR A 84 3.232 -8.623 5.122 1.00 0.00 O ATOM 0 H TYR A 84 -1.377 -6.320 2.212 1.00 0.00 H new ATOM 0 HA TYR A 84 -3.138 -8.507 1.323 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -1.520 -10.268 1.582 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.790 -9.103 0.495 1.00 0.00 H new ATOM 0 HD1 TYR A 84 0.880 -7.417 1.410 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -0.572 -10.720 3.743 1.00 0.00 H new ATOM 0 HE1 TYR A 84 2.779 -7.142 2.982 1.00 0.00 H new ATOM 0 HE2 TYR A 84 1.328 -10.444 5.313 1.00 0.00 H new ATOM 0 HH TYR A 84 2.908 -8.241 5.964 1.00 0.00 H new ATOM 1286 N SER A 85 -3.061 -9.346 3.860 1.00 0.00 N ATOM 1287 CA SER A 85 -3.351 -9.432 5.319 1.00 0.00 C ATOM 1288 C SER A 85 -3.095 -10.859 5.808 1.00 0.00 C ATOM 1289 O SER A 85 -3.020 -11.788 5.029 1.00 0.00 O ATOM 1290 CB SER A 85 -4.814 -9.061 5.570 1.00 0.00 C ATOM 1291 OG SER A 85 -5.658 -10.066 5.029 1.00 0.00 O ATOM 0 H SER A 85 -3.330 -10.165 3.315 1.00 0.00 H new ATOM 0 HA SER A 85 -2.703 -8.742 5.859 1.00 0.00 H new ATOM 0 HB2 SER A 85 -4.995 -8.956 6.640 1.00 0.00 H new ATOM 0 HB3 SER A 85 -5.039 -8.097 5.113 1.00 0.00 H new ATOM 0 HG SER A 85 -6.099 -9.724 4.223 1.00 0.00 H new ATOM 1297 N LEU A 86 -2.960 -11.040 7.093 1.00 0.00 N ATOM 1298 CA LEU A 86 -2.708 -12.407 7.631 1.00 0.00 C ATOM 1299 C LEU A 86 -4.021 -13.005 8.139 1.00 0.00 C ATOM 1300 O LEU A 86 -4.740 -12.389 8.902 1.00 0.00 O ATOM 1301 CB LEU A 86 -1.706 -12.326 8.783 1.00 0.00 C ATOM 1302 CG LEU A 86 -1.102 -13.709 9.033 1.00 0.00 C ATOM 1303 CD1 LEU A 86 0.056 -13.589 10.026 1.00 0.00 C ATOM 1304 CD2 LEU A 86 -2.173 -14.637 9.610 1.00 0.00 C ATOM 0 H LEU A 86 -3.013 -10.301 7.794 1.00 0.00 H new ATOM 0 HA LEU A 86 -2.302 -13.039 6.841 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.918 -11.611 8.544 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -2.201 -11.965 9.685 1.00 0.00 H new ATOM 0 HG LEU A 86 -0.734 -14.119 8.093 1.00 0.00 H new ATOM 0 HD11 LEU A 86 0.486 -14.575 10.204 1.00 0.00 H new ATOM 0 HD12 LEU A 86 0.820 -12.928 9.616 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -0.312 -13.179 10.966 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.743 -15.623 9.788 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.542 -14.227 10.550 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -2.998 -14.724 8.903 1.00 0.00 H new ATOM 1316 N ILE A 87 -4.339 -14.201 7.724 1.00 0.00 N ATOM 1317 CA ILE A 87 -5.604 -14.837 8.183 1.00 0.00 C ATOM 1318 C ILE A 87 -5.349 -15.593 9.490 1.00 0.00 C ATOM 1319 O ILE A 87 -5.735 -15.155 10.557 1.00 0.00 O ATOM 1320 CB ILE A 87 -6.097 -15.818 7.118 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -6.241 -15.090 5.780 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -7.454 -16.387 7.537 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -7.009 -13.782 5.989 1.00 0.00 C ATOM 0 H ILE A 87 -3.776 -14.764 7.087 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.358 -14.068 8.347 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.378 -16.631 7.014 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -5.257 -14.883 5.359 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.767 -15.722 5.065 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.805 -17.086 6.778 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.352 -16.907 8.490 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.173 -15.574 7.642 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -7.111 -13.264 5.036 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -7.998 -14.001 6.391 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.465 -13.149 6.690 1.00 0.00 H new ATOM 1335 N GLU A 88 -4.701 -16.723 9.416 1.00 0.00 N ATOM 1336 CA GLU A 88 -4.423 -17.506 10.653 1.00 0.00 C ATOM 1337 C GLU A 88 -2.912 -17.564 10.889 1.00 0.00 C ATOM 1338 O GLU A 88 -2.124 -17.370 9.985 1.00 0.00 O ATOM 1339 CB GLU A 88 -4.967 -18.926 10.490 1.00 0.00 C ATOM 1340 CG GLU A 88 -6.491 -18.875 10.355 1.00 0.00 C ATOM 1341 CD GLU A 88 -7.048 -20.300 10.310 1.00 0.00 C ATOM 1342 OE1 GLU A 88 -6.254 -21.223 10.231 1.00 0.00 O ATOM 1343 OE2 GLU A 88 -8.258 -20.442 10.358 1.00 0.00 O ATOM 0 H GLU A 88 -4.352 -17.138 8.552 1.00 0.00 H new ATOM 0 HA GLU A 88 -4.907 -17.027 11.504 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -4.529 -19.396 9.610 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.687 -19.535 11.350 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -6.923 -18.331 11.195 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -6.769 -18.336 9.449 1.00 0.00 H new ATOM 1350 N GLY A 89 -2.501 -17.830 12.099 1.00 0.00 N ATOM 1351 CA GLY A 89 -1.042 -17.900 12.392 1.00 0.00 C ATOM 1352 C GLY A 89 -0.831 -18.266 13.862 1.00 0.00 C ATOM 1353 O GLY A 89 -1.708 -18.099 14.686 1.00 0.00 O ATOM 0 H GLY A 89 -3.113 -18.002 12.897 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -0.567 -18.642 11.750 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.571 -16.942 12.174 1.00 0.00 H new ATOM 1357 N ASP A 90 0.327 -18.764 14.196 1.00 0.00 N ATOM 1358 CA ASP A 90 0.597 -19.141 15.612 1.00 0.00 C ATOM 1359 C ASP A 90 0.471 -17.901 16.501 1.00 0.00 C ATOM 1360 O ASP A 90 -0.155 -17.933 17.542 1.00 0.00 O ATOM 1361 CB ASP A 90 2.011 -19.713 15.726 1.00 0.00 C ATOM 1362 CG ASP A 90 2.095 -21.023 14.939 1.00 0.00 C ATOM 1363 OD1 ASP A 90 1.051 -21.544 14.581 1.00 0.00 O ATOM 1364 OD2 ASP A 90 3.201 -21.482 14.708 1.00 0.00 O ATOM 0 H ASP A 90 1.099 -18.926 13.549 1.00 0.00 H new ATOM 0 HA ASP A 90 -0.124 -19.893 15.934 1.00 0.00 H new ATOM 0 HB2 ASP A 90 2.737 -18.997 15.340 1.00 0.00 H new ATOM 0 HB3 ASP A 90 2.261 -19.888 16.772 1.00 0.00 H new ATOM 1369 N ALA A 91 1.063 -16.807 16.101 1.00 0.00 N ATOM 1370 CA ALA A 91 0.974 -15.567 16.923 1.00 0.00 C ATOM 1371 C ALA A 91 -0.487 -15.124 17.019 1.00 0.00 C ATOM 1372 O ALA A 91 -0.877 -14.431 17.937 1.00 0.00 O ATOM 1373 CB ALA A 91 1.801 -14.459 16.268 1.00 0.00 C ATOM 0 H ALA A 91 1.604 -16.719 15.241 1.00 0.00 H new ATOM 0 HA ALA A 91 1.361 -15.765 17.923 1.00 0.00 H new ATOM 0 HB1 ALA A 91 1.736 -13.552 16.869 1.00 0.00 H new ATOM 0 HB2 ALA A 91 2.842 -14.774 16.199 1.00 0.00 H new ATOM 0 HB3 ALA A 91 1.415 -14.260 15.268 1.00 0.00 H new ATOM 1379 N LEU A 92 -1.298 -15.520 16.077 1.00 0.00 N ATOM 1380 CA LEU A 92 -2.732 -15.122 16.114 1.00 0.00 C ATOM 1381 C LEU A 92 -3.499 -16.069 17.040 1.00 0.00 C ATOM 1382 O LEU A 92 -4.309 -15.648 17.842 1.00 0.00 O ATOM 1383 CB LEU A 92 -3.319 -15.202 14.704 1.00 0.00 C ATOM 1384 CG LEU A 92 -2.660 -14.143 13.817 1.00 0.00 C ATOM 1385 CD1 LEU A 92 -1.185 -14.491 13.615 1.00 0.00 C ATOM 1386 CD2 LEU A 92 -3.365 -14.105 12.460 1.00 0.00 C ATOM 0 H LEU A 92 -1.029 -16.102 15.284 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.817 -14.101 16.486 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.155 -16.195 14.286 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -4.397 -15.044 14.738 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.740 -13.167 14.296 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.716 -13.736 12.983 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -0.682 -14.518 14.582 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -1.104 -15.467 13.136 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -2.896 -13.351 11.828 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -3.285 -15.081 11.981 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.416 -13.856 12.603 1.00 0.00 H new ATOM 1398 N SER A 93 -3.249 -17.345 16.935 1.00 0.00 N ATOM 1399 CA SER A 93 -3.963 -18.318 17.807 1.00 0.00 C ATOM 1400 C SER A 93 -5.469 -18.218 17.556 1.00 0.00 C ATOM 1401 O SER A 93 -5.949 -17.258 16.985 1.00 0.00 O ATOM 1402 CB SER A 93 -3.667 -18.000 19.275 1.00 0.00 C ATOM 1403 OG SER A 93 -4.559 -18.729 20.105 1.00 0.00 O ATOM 0 H SER A 93 -2.581 -17.755 16.283 1.00 0.00 H new ATOM 0 HA SER A 93 -3.623 -19.328 17.579 1.00 0.00 H new ATOM 0 HB2 SER A 93 -2.636 -18.260 19.514 1.00 0.00 H new ATOM 0 HB3 SER A 93 -3.776 -16.931 19.456 1.00 0.00 H new ATOM 0 HG SER A 93 -4.370 -18.528 21.045 1.00 0.00 H new ATOM 1409 N GLU A 94 -6.218 -19.199 17.976 1.00 0.00 N ATOM 1410 CA GLU A 94 -7.691 -19.158 17.759 1.00 0.00 C ATOM 1411 C GLU A 94 -8.295 -18.022 18.588 1.00 0.00 C ATOM 1412 O GLU A 94 -9.444 -17.664 18.424 1.00 0.00 O ATOM 1413 CB GLU A 94 -8.307 -20.491 18.190 1.00 0.00 C ATOM 1414 CG GLU A 94 -7.657 -21.629 17.401 1.00 0.00 C ATOM 1415 CD GLU A 94 -8.253 -22.965 17.849 1.00 0.00 C ATOM 1416 OE1 GLU A 94 -8.929 -22.980 18.864 1.00 0.00 O ATOM 1417 OE2 GLU A 94 -8.023 -23.952 17.168 1.00 0.00 O ATOM 0 H GLU A 94 -5.874 -20.028 18.460 1.00 0.00 H new ATOM 0 HA GLU A 94 -7.900 -18.988 16.703 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -8.159 -20.644 19.259 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.383 -20.481 18.015 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -7.821 -21.485 16.333 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -6.579 -21.628 17.561 1.00 0.00 H new ATOM 1424 N ASN A 95 -7.528 -17.454 19.478 1.00 0.00 N ATOM 1425 CA ASN A 95 -8.057 -16.342 20.317 1.00 0.00 C ATOM 1426 C ASN A 95 -8.206 -15.083 19.465 1.00 0.00 C ATOM 1427 O ASN A 95 -9.160 -14.343 19.596 1.00 0.00 O ATOM 1428 CB ASN A 95 -7.084 -16.058 21.460 1.00 0.00 C ATOM 1429 CG ASN A 95 -6.808 -17.348 22.231 1.00 0.00 C ATOM 1430 OD1 ASN A 95 -7.201 -18.419 21.810 1.00 0.00 O ATOM 1431 ND2 ASN A 95 -6.145 -17.291 23.353 1.00 0.00 N ATOM 0 H ASN A 95 -6.558 -17.712 19.660 1.00 0.00 H new ATOM 0 HA ASN A 95 -9.028 -16.628 20.721 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -6.153 -15.652 21.066 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -7.502 -15.305 22.128 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -5.956 -18.145 23.878 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -5.816 -16.392 23.706 1.00 0.00 H new ATOM 1438 N ILE A 96 -7.264 -14.824 18.599 1.00 0.00 N ATOM 1439 CA ILE A 96 -7.355 -13.603 17.754 1.00 0.00 C ATOM 1440 C ILE A 96 -6.631 -13.825 16.424 1.00 0.00 C ATOM 1441 O ILE A 96 -5.500 -14.268 16.386 1.00 0.00 O ATOM 1442 CB ILE A 96 -6.702 -12.432 18.493 1.00 0.00 C ATOM 1443 CG1 ILE A 96 -5.253 -12.788 18.837 1.00 0.00 C ATOM 1444 CG2 ILE A 96 -7.476 -12.149 19.783 1.00 0.00 C ATOM 1445 CD1 ILE A 96 -4.551 -11.564 19.428 1.00 0.00 C ATOM 0 H ILE A 96 -6.439 -15.403 18.442 1.00 0.00 H new ATOM 0 HA ILE A 96 -8.404 -13.384 17.556 1.00 0.00 H new ATOM 0 HB ILE A 96 -6.717 -11.547 17.856 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -5.230 -13.613 19.549 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -4.728 -13.124 17.943 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -7.012 -11.315 20.310 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -8.508 -11.896 19.540 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -7.460 -13.034 20.419 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -3.520 -11.819 19.672 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -4.562 -10.752 18.701 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.071 -11.248 20.332 1.00 0.00 H new ATOM 1457 N GLU A 97 -7.268 -13.500 15.331 1.00 0.00 N ATOM 1458 CA GLU A 97 -6.605 -13.669 14.009 1.00 0.00 C ATOM 1459 C GLU A 97 -7.076 -12.557 13.071 1.00 0.00 C ATOM 1460 O GLU A 97 -8.193 -12.563 12.593 1.00 0.00 O ATOM 1461 CB GLU A 97 -6.980 -15.029 13.414 1.00 0.00 C ATOM 1462 CG GLU A 97 -6.881 -16.107 14.495 1.00 0.00 C ATOM 1463 CD GLU A 97 -7.515 -17.401 13.982 1.00 0.00 C ATOM 1464 OE1 GLU A 97 -8.289 -17.327 13.041 1.00 0.00 O ATOM 1465 OE2 GLU A 97 -7.215 -18.445 14.538 1.00 0.00 O ATOM 0 H GLU A 97 -8.216 -13.126 15.298 1.00 0.00 H new ATOM 0 HA GLU A 97 -5.523 -13.618 14.132 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -7.993 -14.995 13.012 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -6.316 -15.270 12.584 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -5.837 -16.280 14.757 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -7.387 -15.776 15.402 1.00 0.00 H new ATOM 1472 N LYS A 98 -6.229 -11.602 12.806 1.00 0.00 N ATOM 1473 CA LYS A 98 -6.616 -10.486 11.899 1.00 0.00 C ATOM 1474 C LYS A 98 -5.434 -9.526 11.764 1.00 0.00 C ATOM 1475 O LYS A 98 -5.259 -8.632 12.568 1.00 0.00 O ATOM 1476 CB LYS A 98 -7.817 -9.745 12.486 1.00 0.00 C ATOM 1477 CG LYS A 98 -8.253 -8.636 11.526 1.00 0.00 C ATOM 1478 CD LYS A 98 -8.909 -9.259 10.292 1.00 0.00 C ATOM 1479 CE LYS A 98 -9.390 -8.150 9.354 1.00 0.00 C ATOM 1480 NZ LYS A 98 -9.473 -8.677 7.962 1.00 0.00 N ATOM 0 H LYS A 98 -5.282 -11.546 13.180 1.00 0.00 H new ATOM 0 HA LYS A 98 -6.884 -10.880 10.919 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -8.640 -10.440 12.653 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -7.557 -9.320 13.455 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -8.953 -7.964 12.023 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -7.392 -8.037 11.230 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -8.198 -9.904 9.775 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -9.749 -9.886 10.591 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -10.366 -7.786 9.675 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -8.705 -7.303 9.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -9.800 -7.923 7.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -8.534 -9.004 7.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -10.143 -9.472 7.931 1.00 0.00 H new ATOM 1494 N ILE A 99 -4.614 -9.699 10.766 1.00 0.00 N ATOM 1495 CA ILE A 99 -3.445 -8.789 10.612 1.00 0.00 C ATOM 1496 C ILE A 99 -3.461 -8.147 9.224 1.00 0.00 C ATOM 1497 O ILE A 99 -3.371 -8.820 8.215 1.00 0.00 O ATOM 1498 CB ILE A 99 -2.152 -9.586 10.789 1.00 0.00 C ATOM 1499 CG1 ILE A 99 -2.337 -10.613 11.909 1.00 0.00 C ATOM 1500 CG2 ILE A 99 -1.012 -8.634 11.153 1.00 0.00 C ATOM 1501 CD1 ILE A 99 -1.004 -11.314 12.184 1.00 0.00 C ATOM 0 H ILE A 99 -4.701 -10.425 10.055 1.00 0.00 H new ATOM 0 HA ILE A 99 -3.500 -8.006 11.368 1.00 0.00 H new ATOM 0 HB ILE A 99 -1.911 -10.101 9.859 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -2.694 -10.120 12.813 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.093 -11.345 11.625 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.090 -9.202 11.279 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -0.881 -7.902 10.356 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -1.251 -8.119 12.083 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -1.135 -12.045 12.981 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -0.666 -11.820 11.280 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -0.261 -10.576 12.487 1.00 0.00 H new ATOM 1513 N ASP A 100 -3.564 -6.848 9.165 1.00 0.00 N ATOM 1514 CA ASP A 100 -3.573 -6.157 7.846 1.00 0.00 C ATOM 1515 C ASP A 100 -2.151 -5.703 7.515 1.00 0.00 C ATOM 1516 O ASP A 100 -1.538 -4.962 8.258 1.00 0.00 O ATOM 1517 CB ASP A 100 -4.499 -4.940 7.912 1.00 0.00 C ATOM 1518 CG ASP A 100 -4.497 -4.224 6.559 1.00 0.00 C ATOM 1519 OD1 ASP A 100 -3.991 -4.798 5.608 1.00 0.00 O ATOM 1520 OD2 ASP A 100 -5.001 -3.115 6.498 1.00 0.00 O ATOM 0 H ASP A 100 -3.642 -6.234 9.976 1.00 0.00 H new ATOM 0 HA ASP A 100 -3.932 -6.838 7.074 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -5.511 -5.253 8.168 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.168 -4.259 8.696 1.00 0.00 H new ATOM 1525 N TYR A 101 -1.615 -6.147 6.410 1.00 0.00 N ATOM 1526 CA TYR A 101 -0.228 -5.743 6.045 1.00 0.00 C ATOM 1527 C TYR A 101 -0.251 -4.884 4.779 1.00 0.00 C ATOM 1528 O TYR A 101 -0.941 -5.182 3.825 1.00 0.00 O ATOM 1529 CB TYR A 101 0.616 -6.994 5.796 1.00 0.00 C ATOM 1530 CG TYR A 101 0.962 -7.638 7.117 1.00 0.00 C ATOM 1531 CD1 TYR A 101 2.085 -7.205 7.831 1.00 0.00 C ATOM 1532 CD2 TYR A 101 0.159 -8.665 7.627 1.00 0.00 C ATOM 1533 CE1 TYR A 101 2.407 -7.801 9.057 1.00 0.00 C ATOM 1534 CE2 TYR A 101 0.481 -9.261 8.853 1.00 0.00 C ATOM 1535 CZ TYR A 101 1.604 -8.829 9.568 1.00 0.00 C ATOM 1536 OH TYR A 101 1.921 -9.415 10.776 1.00 0.00 O ATOM 0 H TYR A 101 -2.076 -6.770 5.747 1.00 0.00 H new ATOM 0 HA TYR A 101 0.204 -5.165 6.862 1.00 0.00 H new ATOM 0 HB2 TYR A 101 0.068 -7.697 5.169 1.00 0.00 H new ATOM 0 HB3 TYR A 101 1.527 -6.730 5.258 1.00 0.00 H new ATOM 0 HD1 TYR A 101 2.703 -6.412 7.437 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -0.708 -8.998 7.076 1.00 0.00 H new ATOM 0 HE1 TYR A 101 3.274 -7.468 9.608 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -0.137 -10.054 9.247 1.00 0.00 H new ATOM 0 HH TYR A 101 2.891 -9.385 10.909 1.00 0.00 H new ATOM 1546 N GLU A 102 0.508 -3.822 4.764 1.00 0.00 N ATOM 1547 CA GLU A 102 0.544 -2.943 3.562 1.00 0.00 C ATOM 1548 C GLU A 102 2.002 -2.690 3.174 1.00 0.00 C ATOM 1549 O GLU A 102 2.801 -2.263 3.983 1.00 0.00 O ATOM 1550 CB GLU A 102 -0.137 -1.611 3.880 1.00 0.00 C ATOM 1551 CG GLU A 102 -1.593 -1.864 4.277 1.00 0.00 C ATOM 1552 CD GLU A 102 -2.306 -0.525 4.480 1.00 0.00 C ATOM 1553 OE1 GLU A 102 -1.630 0.491 4.468 1.00 0.00 O ATOM 1554 OE2 GLU A 102 -3.515 -0.538 4.642 1.00 0.00 O ATOM 0 H GLU A 102 1.106 -3.525 5.535 1.00 0.00 H new ATOM 0 HA GLU A 102 0.020 -3.426 2.737 1.00 0.00 H new ATOM 0 HB2 GLU A 102 0.389 -1.106 4.690 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.095 -0.953 3.012 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -2.097 -2.443 3.503 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.634 -2.453 5.193 1.00 0.00 H new ATOM 1561 N THR A 103 2.358 -2.953 1.948 1.00 0.00 N ATOM 1562 CA THR A 103 3.768 -2.730 1.521 1.00 0.00 C ATOM 1563 C THR A 103 3.804 -1.778 0.324 1.00 0.00 C ATOM 1564 O THR A 103 3.083 -1.947 -0.639 1.00 0.00 O ATOM 1565 CB THR A 103 4.398 -4.068 1.127 1.00 0.00 C ATOM 1566 OG1 THR A 103 4.222 -5.001 2.183 1.00 0.00 O ATOM 1567 CG2 THR A 103 5.892 -3.871 0.860 1.00 0.00 C ATOM 0 H THR A 103 1.735 -3.312 1.224 1.00 0.00 H new ATOM 0 HA THR A 103 4.328 -2.290 2.346 1.00 0.00 H new ATOM 0 HB THR A 103 3.917 -4.446 0.225 1.00 0.00 H new ATOM 0 HG1 THR A 103 4.477 -5.896 1.875 1.00 0.00 H new ATOM 0 HG21 THR A 103 6.340 -4.824 0.579 1.00 0.00 H new ATOM 0 HG22 THR A 103 6.025 -3.155 0.049 1.00 0.00 H new ATOM 0 HG23 THR A 103 6.376 -3.494 1.761 1.00 0.00 H new ATOM 1575 N LYS A 104 4.642 -0.780 0.377 1.00 0.00 N ATOM 1576 CA LYS A 104 4.731 0.182 -0.757 1.00 0.00 C ATOM 1577 C LYS A 104 6.202 0.513 -1.022 1.00 0.00 C ATOM 1578 O LYS A 104 6.912 0.973 -0.151 1.00 0.00 O ATOM 1579 CB LYS A 104 3.977 1.465 -0.403 1.00 0.00 C ATOM 1580 CG LYS A 104 3.964 2.397 -1.616 1.00 0.00 C ATOM 1581 CD LYS A 104 3.211 3.681 -1.265 1.00 0.00 C ATOM 1582 CE LYS A 104 3.083 4.555 -2.514 1.00 0.00 C ATOM 1583 NZ LYS A 104 2.185 5.708 -2.224 1.00 0.00 N ATOM 0 H LYS A 104 5.270 -0.589 1.158 1.00 0.00 H new ATOM 0 HA LYS A 104 4.287 -0.263 -1.648 1.00 0.00 H new ATOM 0 HB2 LYS A 104 2.957 1.229 -0.101 1.00 0.00 H new ATOM 0 HB3 LYS A 104 4.454 1.959 0.444 1.00 0.00 H new ATOM 0 HG2 LYS A 104 4.985 2.632 -1.918 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.487 1.903 -2.462 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.223 3.440 -0.874 1.00 0.00 H new ATOM 0 HD3 LYS A 104 3.740 4.223 -0.481 1.00 0.00 H new ATOM 0 HE2 LYS A 104 4.065 4.914 -2.822 1.00 0.00 H new ATOM 0 HE3 LYS A 104 2.684 3.969 -3.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 2.098 6.302 -3.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 1.246 5.356 -1.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 2.584 6.272 -1.446 1.00 0.00 H new ATOM 1597 N LEU A 105 6.666 0.279 -2.219 1.00 0.00 N ATOM 1598 CA LEU A 105 8.092 0.578 -2.534 1.00 0.00 C ATOM 1599 C LEU A 105 8.200 1.976 -3.145 1.00 0.00 C ATOM 1600 O LEU A 105 7.480 2.324 -4.059 1.00 0.00 O ATOM 1601 CB LEU A 105 8.621 -0.456 -3.531 1.00 0.00 C ATOM 1602 CG LEU A 105 8.570 -1.848 -2.896 1.00 0.00 C ATOM 1603 CD1 LEU A 105 9.207 -1.798 -1.505 1.00 0.00 C ATOM 1604 CD2 LEU A 105 7.113 -2.299 -2.774 1.00 0.00 C ATOM 0 H LEU A 105 6.121 -0.105 -2.991 1.00 0.00 H new ATOM 0 HA LEU A 105 8.682 0.537 -1.618 1.00 0.00 H new ATOM 0 HB2 LEU A 105 8.023 -0.438 -4.442 1.00 0.00 H new ATOM 0 HB3 LEU A 105 9.644 -0.212 -3.816 1.00 0.00 H new ATOM 0 HG LEU A 105 9.118 -2.553 -3.521 1.00 0.00 H new ATOM 0 HD11 LEU A 105 9.171 -2.789 -1.052 1.00 0.00 H new ATOM 0 HD12 LEU A 105 10.245 -1.476 -1.591 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.659 -1.093 -0.879 1.00 0.00 H new ATOM 0 HD21 LEU A 105 7.076 -3.290 -2.322 1.00 0.00 H new ATOM 0 HD22 LEU A 105 6.565 -1.594 -2.149 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.659 -2.335 -3.764 1.00 0.00 H new ATOM 1616 N VAL A 106 9.098 2.780 -2.645 1.00 0.00 N ATOM 1617 CA VAL A 106 9.258 4.155 -3.196 1.00 0.00 C ATOM 1618 C VAL A 106 10.739 4.423 -3.465 1.00 0.00 C ATOM 1619 O VAL A 106 11.592 4.114 -2.656 1.00 0.00 O ATOM 1620 CB VAL A 106 8.730 5.175 -2.185 1.00 0.00 C ATOM 1621 CG1 VAL A 106 8.913 6.588 -2.742 1.00 0.00 C ATOM 1622 CG2 VAL A 106 7.245 4.917 -1.927 1.00 0.00 C ATOM 0 H VAL A 106 9.728 2.544 -1.878 1.00 0.00 H new ATOM 0 HA VAL A 106 8.696 4.243 -4.126 1.00 0.00 H new ATOM 0 HB VAL A 106 9.283 5.079 -1.251 1.00 0.00 H new ATOM 0 HG11 VAL A 106 8.537 7.315 -2.022 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.972 6.773 -2.925 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.361 6.685 -3.677 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.869 5.644 -1.207 1.00 0.00 H new ATOM 0 HG22 VAL A 106 6.691 5.012 -2.861 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.114 3.911 -1.529 1.00 0.00 H new ATOM 1632 N SER A 107 11.055 4.994 -4.595 1.00 0.00 N ATOM 1633 CA SER A 107 12.482 5.277 -4.911 1.00 0.00 C ATOM 1634 C SER A 107 12.743 6.780 -4.790 1.00 0.00 C ATOM 1635 O SER A 107 11.911 7.594 -5.139 1.00 0.00 O ATOM 1636 CB SER A 107 12.789 4.818 -6.336 1.00 0.00 C ATOM 1637 OG SER A 107 12.023 5.584 -7.255 1.00 0.00 O ATOM 0 H SER A 107 10.387 5.276 -5.312 1.00 0.00 H new ATOM 0 HA SER A 107 13.123 4.740 -4.211 1.00 0.00 H new ATOM 0 HB2 SER A 107 13.852 4.935 -6.546 1.00 0.00 H new ATOM 0 HB3 SER A 107 12.557 3.759 -6.446 1.00 0.00 H new ATOM 0 HG SER A 107 12.221 5.291 -8.169 1.00 0.00 H new ATOM 1643 N ALA A 108 13.891 7.153 -4.298 1.00 0.00 N ATOM 1644 CA ALA A 108 14.206 8.602 -4.154 1.00 0.00 C ATOM 1645 C ALA A 108 15.302 8.986 -5.149 1.00 0.00 C ATOM 1646 O ALA A 108 15.917 8.141 -5.767 1.00 0.00 O ATOM 1647 CB ALA A 108 14.691 8.877 -2.729 1.00 0.00 C ATOM 0 H ALA A 108 14.626 6.517 -3.989 1.00 0.00 H new ATOM 0 HA ALA A 108 13.311 9.192 -4.354 1.00 0.00 H new ATOM 0 HB1 ALA A 108 14.922 9.937 -2.621 1.00 0.00 H new ATOM 0 HB2 ALA A 108 13.910 8.602 -2.020 1.00 0.00 H new ATOM 0 HB3 ALA A 108 15.586 8.288 -2.529 1.00 0.00 H new ATOM 1653 N PRO A 109 15.548 10.296 -5.303 1.00 0.00 N ATOM 1654 CA PRO A 109 16.570 10.808 -6.222 1.00 0.00 C ATOM 1655 C PRO A 109 17.986 10.501 -5.725 1.00 0.00 C ATOM 1656 O PRO A 109 18.947 10.600 -6.460 1.00 0.00 O ATOM 1657 CB PRO A 109 16.331 12.317 -6.221 1.00 0.00 C ATOM 1658 CG PRO A 109 15.674 12.593 -4.911 1.00 0.00 C ATOM 1659 CD PRO A 109 14.847 11.379 -4.591 1.00 0.00 C ATOM 0 HA PRO A 109 16.496 10.353 -7.210 1.00 0.00 H new ATOM 0 HB2 PRO A 109 17.267 12.867 -6.319 1.00 0.00 H new ATOM 0 HB3 PRO A 109 15.696 12.618 -7.054 1.00 0.00 H new ATOM 0 HG2 PRO A 109 16.417 12.774 -4.134 1.00 0.00 H new ATOM 0 HG3 PRO A 109 15.050 13.485 -4.969 1.00 0.00 H new ATOM 0 HD2 PRO A 109 14.804 11.193 -3.518 1.00 0.00 H new ATOM 0 HD3 PRO A 109 13.819 11.489 -4.937 1.00 0.00 H new ATOM 1667 N HIS A 110 18.120 10.128 -4.480 1.00 0.00 N ATOM 1668 CA HIS A 110 19.472 9.814 -3.940 1.00 0.00 C ATOM 1669 C HIS A 110 19.958 8.486 -4.524 1.00 0.00 C ATOM 1670 O HIS A 110 21.125 8.155 -4.454 1.00 0.00 O ATOM 1671 CB HIS A 110 19.399 9.702 -2.415 1.00 0.00 C ATOM 1672 CG HIS A 110 18.940 11.012 -1.836 1.00 0.00 C ATOM 1673 ND1 HIS A 110 19.776 12.113 -1.742 1.00 0.00 N ATOM 1674 CD2 HIS A 110 17.734 11.412 -1.316 1.00 0.00 C ATOM 1675 CE1 HIS A 110 19.069 13.112 -1.184 1.00 0.00 C ATOM 1676 NE2 HIS A 110 17.818 12.738 -0.904 1.00 0.00 N ATOM 0 H HIS A 110 17.352 10.028 -3.816 1.00 0.00 H new ATOM 0 HA HIS A 110 20.166 10.609 -4.214 1.00 0.00 H new ATOM 0 HB2 HIS A 110 18.711 8.906 -2.131 1.00 0.00 H new ATOM 0 HB3 HIS A 110 20.377 9.437 -2.012 1.00 0.00 H new ATOM 0 HD2 HIS A 110 16.854 10.791 -1.239 1.00 0.00 H new ATOM 0 HE1 HIS A 110 19.465 14.097 -0.986 1.00 0.00 H new ATOM 0 HE2 HIS A 110 17.082 13.303 -0.479 1.00 0.00 H new ATOM 1684 N GLY A 111 19.070 7.721 -5.099 1.00 0.00 N ATOM 1685 CA GLY A 111 19.480 6.415 -5.685 1.00 0.00 C ATOM 1686 C GLY A 111 19.043 5.280 -4.755 1.00 0.00 C ATOM 1687 O GLY A 111 19.084 4.120 -5.115 1.00 0.00 O ATOM 0 H GLY A 111 18.079 7.945 -5.188 1.00 0.00 H new ATOM 0 HA2 GLY A 111 19.029 6.288 -6.669 1.00 0.00 H new ATOM 0 HA3 GLY A 111 20.561 6.390 -5.824 1.00 0.00 H new ATOM 1691 N GLY A 112 18.625 5.606 -3.563 1.00 0.00 N ATOM 1692 CA GLY A 112 18.186 4.546 -2.611 1.00 0.00 C ATOM 1693 C GLY A 112 16.682 4.310 -2.768 1.00 0.00 C ATOM 1694 O GLY A 112 15.988 5.070 -3.412 1.00 0.00 O ATOM 0 H GLY A 112 18.568 6.560 -3.207 1.00 0.00 H new ATOM 0 HA2 GLY A 112 18.732 3.622 -2.802 1.00 0.00 H new ATOM 0 HA3 GLY A 112 18.413 4.845 -1.588 1.00 0.00 H new ATOM 1698 N THR A 113 16.174 3.259 -2.184 1.00 0.00 N ATOM 1699 CA THR A 113 14.715 2.975 -2.300 1.00 0.00 C ATOM 1700 C THR A 113 14.083 2.971 -0.908 1.00 0.00 C ATOM 1701 O THR A 113 14.525 2.274 -0.017 1.00 0.00 O ATOM 1702 CB THR A 113 14.513 1.608 -2.957 1.00 0.00 C ATOM 1703 OG1 THR A 113 15.135 1.602 -4.235 1.00 0.00 O ATOM 1704 CG2 THR A 113 13.017 1.333 -3.114 1.00 0.00 C ATOM 0 H THR A 113 16.705 2.585 -1.632 1.00 0.00 H new ATOM 0 HA THR A 113 14.242 3.745 -2.910 1.00 0.00 H new ATOM 0 HB THR A 113 14.959 0.834 -2.332 1.00 0.00 H new ATOM 0 HG1 THR A 113 15.832 0.913 -4.256 1.00 0.00 H new ATOM 0 HG21 THR A 113 12.873 0.359 -3.582 1.00 0.00 H new ATOM 0 HG22 THR A 113 12.541 1.338 -2.133 1.00 0.00 H new ATOM 0 HG23 THR A 113 12.569 2.106 -3.739 1.00 0.00 H new ATOM 1712 N ILE A 114 13.048 3.742 -0.715 1.00 0.00 N ATOM 1713 CA ILE A 114 12.385 3.780 0.620 1.00 0.00 C ATOM 1714 C ILE A 114 11.194 2.821 0.622 1.00 0.00 C ATOM 1715 O ILE A 114 10.429 2.766 -0.320 1.00 0.00 O ATOM 1716 CB ILE A 114 11.901 5.202 0.911 1.00 0.00 C ATOM 1717 CG1 ILE A 114 13.076 6.176 0.794 1.00 0.00 C ATOM 1718 CG2 ILE A 114 11.328 5.266 2.328 1.00 0.00 C ATOM 1719 CD1 ILE A 114 12.556 7.613 0.869 1.00 0.00 C ATOM 0 H ILE A 114 12.633 4.347 -1.423 1.00 0.00 H new ATOM 0 HA ILE A 114 13.096 3.478 1.389 1.00 0.00 H new ATOM 0 HB ILE A 114 11.128 5.476 0.193 1.00 0.00 H new ATOM 0 HG12 ILE A 114 13.793 5.995 1.595 1.00 0.00 H new ATOM 0 HG13 ILE A 114 13.602 6.017 -0.147 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.983 6.279 2.536 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.491 4.573 2.414 1.00 0.00 H new ATOM 0 HG23 ILE A 114 12.101 4.992 3.046 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.392 8.307 0.786 1.00 0.00 H new ATOM 0 HD12 ILE A 114 11.855 7.789 0.053 1.00 0.00 H new ATOM 0 HD13 ILE A 114 12.050 7.767 1.822 1.00 0.00 H new ATOM 1731 N ILE A 115 11.031 2.062 1.671 1.00 0.00 N ATOM 1732 CA ILE A 115 9.889 1.106 1.726 1.00 0.00 C ATOM 1733 C ILE A 115 8.987 1.448 2.912 1.00 0.00 C ATOM 1734 O ILE A 115 9.408 1.431 4.052 1.00 0.00 O ATOM 1735 CB ILE A 115 10.425 -0.318 1.889 1.00 0.00 C ATOM 1736 CG1 ILE A 115 11.296 -0.678 0.684 1.00 0.00 C ATOM 1737 CG2 ILE A 115 9.251 -1.296 1.979 1.00 0.00 C ATOM 1738 CD1 ILE A 115 12.700 -1.051 1.165 1.00 0.00 C ATOM 0 H ILE A 115 11.638 2.062 2.491 1.00 0.00 H new ATOM 0 HA ILE A 115 9.314 1.177 0.803 1.00 0.00 H new ATOM 0 HB ILE A 115 11.022 -0.379 2.799 1.00 0.00 H new ATOM 0 HG12 ILE A 115 10.854 -1.511 0.137 1.00 0.00 H new ATOM 0 HG13 ILE A 115 11.348 0.164 -0.006 1.00 0.00 H new ATOM 0 HG21 ILE A 115 9.631 -2.311 2.095 1.00 0.00 H new ATOM 0 HG22 ILE A 115 8.630 -1.041 2.837 1.00 0.00 H new ATOM 0 HG23 ILE A 115 8.655 -1.234 1.069 1.00 0.00 H new ATOM 0 HD11 ILE A 115 13.322 -1.308 0.308 1.00 0.00 H new ATOM 0 HD12 ILE A 115 13.141 -0.205 1.693 1.00 0.00 H new ATOM 0 HD13 ILE A 115 12.639 -1.906 1.838 1.00 0.00 H new ATOM 1750 N LYS A 116 7.744 1.753 2.653 1.00 0.00 N ATOM 1751 CA LYS A 116 6.810 2.089 3.764 1.00 0.00 C ATOM 1752 C LYS A 116 5.865 0.909 3.998 1.00 0.00 C ATOM 1753 O LYS A 116 5.148 0.492 3.111 1.00 0.00 O ATOM 1754 CB LYS A 116 5.997 3.329 3.389 1.00 0.00 C ATOM 1755 CG LYS A 116 6.944 4.508 3.155 1.00 0.00 C ATOM 1756 CD LYS A 116 6.129 5.758 2.815 1.00 0.00 C ATOM 1757 CE LYS A 116 5.329 6.195 4.043 1.00 0.00 C ATOM 1758 NZ LYS A 116 3.972 6.644 3.619 1.00 0.00 N ATOM 0 H LYS A 116 7.335 1.784 1.719 1.00 0.00 H new ATOM 0 HA LYS A 116 7.377 2.291 4.673 1.00 0.00 H new ATOM 0 HB2 LYS A 116 5.412 3.135 2.490 1.00 0.00 H new ATOM 0 HB3 LYS A 116 5.291 3.568 4.184 1.00 0.00 H new ATOM 0 HG2 LYS A 116 7.548 4.685 4.045 1.00 0.00 H new ATOM 0 HG3 LYS A 116 7.634 4.279 2.343 1.00 0.00 H new ATOM 0 HD2 LYS A 116 6.792 6.562 2.495 1.00 0.00 H new ATOM 0 HD3 LYS A 116 5.455 5.551 1.984 1.00 0.00 H new ATOM 0 HE2 LYS A 116 5.246 5.369 4.749 1.00 0.00 H new ATOM 0 HE3 LYS A 116 5.847 7.004 4.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 3.267 6.323 4.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 3.952 7.682 3.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 3.748 6.241 2.687 1.00 0.00 H new ATOM 1772 N THR A 117 5.860 0.362 5.184 1.00 0.00 N ATOM 1773 CA THR A 117 4.961 -0.793 5.461 1.00 0.00 C ATOM 1774 C THR A 117 4.108 -0.505 6.697 1.00 0.00 C ATOM 1775 O THR A 117 4.599 -0.049 7.711 1.00 0.00 O ATOM 1776 CB THR A 117 5.806 -2.046 5.707 1.00 0.00 C ATOM 1777 OG1 THR A 117 6.641 -2.282 4.582 1.00 0.00 O ATOM 1778 CG2 THR A 117 4.887 -3.249 5.925 1.00 0.00 C ATOM 0 H THR A 117 6.437 0.664 5.969 1.00 0.00 H new ATOM 0 HA THR A 117 4.307 -0.952 4.604 1.00 0.00 H new ATOM 0 HB THR A 117 6.424 -1.899 6.593 1.00 0.00 H new ATOM 0 HG1 THR A 117 7.183 -3.083 4.739 1.00 0.00 H new ATOM 0 HG21 THR A 117 5.490 -4.140 6.100 1.00 0.00 H new ATOM 0 HG22 THR A 117 4.249 -3.067 6.790 1.00 0.00 H new ATOM 0 HG23 THR A 117 4.267 -3.398 5.041 1.00 0.00 H new ATOM 1786 N THR A 118 2.834 -0.772 6.620 1.00 0.00 N ATOM 1787 CA THR A 118 1.944 -0.522 7.789 1.00 0.00 C ATOM 1788 C THR A 118 1.362 -1.853 8.269 1.00 0.00 C ATOM 1789 O THR A 118 0.982 -2.694 7.479 1.00 0.00 O ATOM 1790 CB THR A 118 0.806 0.414 7.375 1.00 0.00 C ATOM 1791 OG1 THR A 118 1.352 1.612 6.841 1.00 0.00 O ATOM 1792 CG2 THR A 118 -0.056 0.743 8.594 1.00 0.00 C ATOM 0 H THR A 118 2.369 -1.154 5.796 1.00 0.00 H new ATOM 0 HA THR A 118 2.516 -0.059 8.593 1.00 0.00 H new ATOM 0 HB THR A 118 0.190 -0.074 6.619 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.625 2.212 6.574 1.00 0.00 H new ATOM 0 HG21 THR A 118 -0.866 1.410 8.298 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.474 -0.177 9.003 1.00 0.00 H new ATOM 0 HG23 THR A 118 0.557 1.231 9.352 1.00 0.00 H new ATOM 1800 N SER A 119 1.294 -2.057 9.556 1.00 0.00 N ATOM 1801 CA SER A 119 0.742 -3.341 10.074 1.00 0.00 C ATOM 1802 C SER A 119 -0.292 -3.058 11.166 1.00 0.00 C ATOM 1803 O SER A 119 -0.130 -2.167 11.976 1.00 0.00 O ATOM 1804 CB SER A 119 1.876 -4.186 10.654 1.00 0.00 C ATOM 1805 OG SER A 119 2.849 -4.428 9.648 1.00 0.00 O ATOM 0 H SER A 119 1.596 -1.393 10.269 1.00 0.00 H new ATOM 0 HA SER A 119 0.264 -3.882 9.257 1.00 0.00 H new ATOM 0 HB2 SER A 119 2.332 -3.671 11.499 1.00 0.00 H new ATOM 0 HB3 SER A 119 1.484 -5.131 11.030 1.00 0.00 H new ATOM 0 HG SER A 119 2.676 -5.296 9.228 1.00 0.00 H new ATOM 1811 N LYS A 120 -1.353 -3.820 11.194 1.00 0.00 N ATOM 1812 CA LYS A 120 -2.400 -3.610 12.233 1.00 0.00 C ATOM 1813 C LYS A 120 -2.834 -4.966 12.790 1.00 0.00 C ATOM 1814 O LYS A 120 -2.799 -5.969 12.104 1.00 0.00 O ATOM 1815 CB LYS A 120 -3.604 -2.902 11.609 1.00 0.00 C ATOM 1816 CG LYS A 120 -4.414 -2.210 12.708 1.00 0.00 C ATOM 1817 CD LYS A 120 -5.603 -1.478 12.082 1.00 0.00 C ATOM 1818 CE LYS A 120 -6.413 -0.789 13.182 1.00 0.00 C ATOM 1819 NZ LYS A 120 -6.859 0.551 12.705 1.00 0.00 N ATOM 0 H LYS A 120 -1.539 -4.580 10.540 1.00 0.00 H new ATOM 0 HA LYS A 120 -1.999 -2.995 13.039 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -3.269 -2.170 10.874 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -4.229 -3.622 11.080 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -4.766 -2.945 13.432 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -3.784 -1.505 13.250 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -5.251 -0.742 11.359 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -6.233 -2.183 11.539 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -7.277 -1.398 13.448 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -5.808 -0.684 14.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -7.306 1.068 13.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -6.038 1.088 12.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -7.545 0.434 11.932 1.00 0.00 H new ATOM 1833 N TYR A 121 -3.239 -5.012 14.030 1.00 0.00 N ATOM 1834 CA TYR A 121 -3.669 -6.310 14.623 1.00 0.00 C ATOM 1835 C TYR A 121 -5.053 -6.156 15.257 1.00 0.00 C ATOM 1836 O TYR A 121 -5.370 -5.140 15.842 1.00 0.00 O ATOM 1837 CB TYR A 121 -2.663 -6.737 15.695 1.00 0.00 C ATOM 1838 CG TYR A 121 -1.315 -6.973 15.058 1.00 0.00 C ATOM 1839 CD1 TYR A 121 -0.427 -5.905 14.879 1.00 0.00 C ATOM 1840 CD2 TYR A 121 -0.951 -8.261 14.648 1.00 0.00 C ATOM 1841 CE1 TYR A 121 0.823 -6.125 14.289 1.00 0.00 C ATOM 1842 CE2 TYR A 121 0.299 -8.481 14.058 1.00 0.00 C ATOM 1843 CZ TYR A 121 1.187 -7.413 13.878 1.00 0.00 C ATOM 1844 OH TYR A 121 2.419 -7.631 13.297 1.00 0.00 O ATOM 0 H TYR A 121 -3.291 -4.209 14.657 1.00 0.00 H new ATOM 0 HA TYR A 121 -3.714 -7.067 13.840 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -2.584 -5.966 16.462 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -3.007 -7.645 16.190 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -0.707 -4.911 15.196 1.00 0.00 H new ATOM 0 HD2 TYR A 121 -1.635 -9.085 14.787 1.00 0.00 H new ATOM 0 HE1 TYR A 121 1.507 -5.301 14.151 1.00 0.00 H new ATOM 0 HE2 TYR A 121 0.579 -9.475 13.741 1.00 0.00 H new ATOM 0 HH TYR A 121 2.312 -8.203 12.508 1.00 0.00 H new ATOM 1854 N HIS A 122 -5.880 -7.160 15.150 1.00 0.00 N ATOM 1855 CA HIS A 122 -7.242 -7.074 15.752 1.00 0.00 C ATOM 1856 C HIS A 122 -7.548 -8.377 16.493 1.00 0.00 C ATOM 1857 O HIS A 122 -6.875 -9.374 16.317 1.00 0.00 O ATOM 1858 CB HIS A 122 -8.280 -6.855 14.647 1.00 0.00 C ATOM 1859 CG HIS A 122 -7.926 -5.624 13.860 1.00 0.00 C ATOM 1860 ND1 HIS A 122 -7.103 -5.671 12.745 1.00 0.00 N ATOM 1861 CD2 HIS A 122 -8.277 -4.306 14.010 1.00 0.00 C ATOM 1862 CE1 HIS A 122 -6.989 -4.417 12.272 1.00 0.00 C ATOM 1863 NE2 HIS A 122 -7.685 -3.545 13.007 1.00 0.00 N ATOM 0 H HIS A 122 -5.672 -8.037 14.672 1.00 0.00 H new ATOM 0 HA HIS A 122 -7.281 -6.238 16.451 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -8.314 -7.723 13.988 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -9.273 -6.747 15.083 1.00 0.00 H new ATOM 0 HD1 HIS A 122 -6.664 -6.505 12.355 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -8.916 -3.918 14.789 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -6.406 -4.148 11.404 1.00 0.00 H new ATOM 1871 N THR A 123 -8.555 -8.380 17.323 1.00 0.00 N ATOM 1872 CA THR A 123 -8.895 -9.620 18.075 1.00 0.00 C ATOM 1873 C THR A 123 -10.285 -10.110 17.662 1.00 0.00 C ATOM 1874 O THR A 123 -11.150 -9.333 17.311 1.00 0.00 O ATOM 1875 CB THR A 123 -8.885 -9.325 19.577 1.00 0.00 C ATOM 1876 OG1 THR A 123 -10.012 -8.527 19.908 1.00 0.00 O ATOM 1877 CG2 THR A 123 -7.602 -8.576 19.943 1.00 0.00 C ATOM 0 H THR A 123 -9.156 -7.578 17.512 1.00 0.00 H new ATOM 0 HA THR A 123 -8.159 -10.391 17.849 1.00 0.00 H new ATOM 0 HB THR A 123 -8.927 -10.262 20.132 1.00 0.00 H new ATOM 0 HG1 THR A 123 -10.008 -8.339 20.870 1.00 0.00 H new ATOM 0 HG21 THR A 123 -7.596 -8.366 21.013 1.00 0.00 H new ATOM 0 HG22 THR A 123 -6.738 -9.189 19.688 1.00 0.00 H new ATOM 0 HG23 THR A 123 -7.558 -7.638 19.389 1.00 0.00 H new ATOM 2169 N ALA A 142 11.242 -7.425 10.271 1.00 0.00 N ATOM 2170 CA ALA A 142 12.235 -6.446 9.747 1.00 0.00 C ATOM 2171 C ALA A 142 13.579 -7.146 9.539 1.00 0.00 C ATOM 2172 O ALA A 142 14.259 -6.925 8.558 1.00 0.00 O ATOM 2173 CB ALA A 142 12.404 -5.304 10.752 1.00 0.00 C ATOM 0 HA ALA A 142 11.884 -6.044 8.797 1.00 0.00 H new ATOM 0 HB1 ALA A 142 13.130 -4.587 10.369 1.00 0.00 H new ATOM 0 HB2 ALA A 142 11.446 -4.806 10.901 1.00 0.00 H new ATOM 0 HB3 ALA A 142 12.756 -5.705 11.703 1.00 0.00 H new ATOM 2179 N HIS A 143 13.967 -7.990 10.456 1.00 0.00 N ATOM 2180 CA HIS A 143 15.265 -8.703 10.310 1.00 0.00 C ATOM 2181 C HIS A 143 15.275 -9.477 8.989 1.00 0.00 C ATOM 2182 O HIS A 143 16.210 -9.398 8.219 1.00 0.00 O ATOM 2183 CB HIS A 143 15.446 -9.679 11.474 1.00 0.00 C ATOM 2184 CG HIS A 143 16.812 -10.304 11.397 1.00 0.00 C ATOM 2185 ND1 HIS A 143 17.973 -9.568 11.570 1.00 0.00 N ATOM 2186 CD2 HIS A 143 17.219 -11.595 11.165 1.00 0.00 C ATOM 2187 CE1 HIS A 143 19.013 -10.412 11.442 1.00 0.00 C ATOM 2188 NE2 HIS A 143 18.608 -11.660 11.194 1.00 0.00 N ATOM 0 H HIS A 143 13.440 -8.216 11.300 1.00 0.00 H new ATOM 0 HA HIS A 143 16.080 -7.979 10.314 1.00 0.00 H new ATOM 0 HB2 HIS A 143 15.327 -9.156 12.423 1.00 0.00 H new ATOM 0 HB3 HIS A 143 14.678 -10.452 11.437 1.00 0.00 H new ATOM 0 HD2 HIS A 143 16.561 -12.432 10.987 1.00 0.00 H new ATOM 0 HE1 HIS A 143 20.048 -10.116 11.529 1.00 0.00 H new ATOM 0 HE2 HIS A 143 19.192 -12.485 11.055 1.00 0.00 H new ATOM 2196 N LEU A 144 14.238 -10.224 8.722 1.00 0.00 N ATOM 2197 CA LEU A 144 14.188 -11.000 7.451 1.00 0.00 C ATOM 2198 C LEU A 144 14.224 -10.034 6.265 1.00 0.00 C ATOM 2199 O LEU A 144 14.863 -10.289 5.263 1.00 0.00 O ATOM 2200 CB LEU A 144 12.898 -11.819 7.403 1.00 0.00 C ATOM 2201 CG LEU A 144 12.846 -12.763 8.607 1.00 0.00 C ATOM 2202 CD1 LEU A 144 11.655 -13.712 8.461 1.00 0.00 C ATOM 2203 CD2 LEU A 144 14.142 -13.574 8.674 1.00 0.00 C ATOM 0 H LEU A 144 13.425 -10.330 9.328 1.00 0.00 H new ATOM 0 HA LEU A 144 15.045 -11.672 7.400 1.00 0.00 H new ATOM 0 HB2 LEU A 144 12.033 -11.156 7.410 1.00 0.00 H new ATOM 0 HB3 LEU A 144 12.853 -12.392 6.477 1.00 0.00 H new ATOM 0 HG LEU A 144 12.734 -12.181 9.522 1.00 0.00 H new ATOM 0 HD11 LEU A 144 11.618 -14.384 9.318 1.00 0.00 H new ATOM 0 HD12 LEU A 144 10.732 -13.133 8.414 1.00 0.00 H new ATOM 0 HD13 LEU A 144 11.765 -14.296 7.547 1.00 0.00 H new ATOM 0 HD21 LEU A 144 14.106 -14.247 9.531 1.00 0.00 H new ATOM 0 HD22 LEU A 144 14.254 -14.157 7.760 1.00 0.00 H new ATOM 0 HD23 LEU A 144 14.990 -12.897 8.779 1.00 0.00 H new ATOM 2215 N PHE A 145 13.542 -8.926 6.368 1.00 0.00 N ATOM 2216 CA PHE A 145 13.540 -7.948 5.246 1.00 0.00 C ATOM 2217 C PHE A 145 14.983 -7.595 4.879 1.00 0.00 C ATOM 2218 O PHE A 145 15.331 -7.495 3.720 1.00 0.00 O ATOM 2219 CB PHE A 145 12.796 -6.681 5.672 1.00 0.00 C ATOM 2220 CG PHE A 145 12.599 -5.783 4.473 1.00 0.00 C ATOM 2221 CD1 PHE A 145 11.549 -6.027 3.578 1.00 0.00 C ATOM 2222 CD2 PHE A 145 13.467 -4.708 4.254 1.00 0.00 C ATOM 2223 CE1 PHE A 145 11.369 -5.195 2.467 1.00 0.00 C ATOM 2224 CE2 PHE A 145 13.287 -3.875 3.143 1.00 0.00 C ATOM 2225 CZ PHE A 145 12.237 -4.119 2.250 1.00 0.00 C ATOM 0 H PHE A 145 12.987 -8.657 7.180 1.00 0.00 H new ATOM 0 HA PHE A 145 13.041 -8.386 4.382 1.00 0.00 H new ATOM 0 HB2 PHE A 145 11.831 -6.942 6.106 1.00 0.00 H new ATOM 0 HB3 PHE A 145 13.361 -6.157 6.443 1.00 0.00 H new ATOM 0 HD1 PHE A 145 10.879 -6.857 3.745 1.00 0.00 H new ATOM 0 HD2 PHE A 145 14.277 -4.520 4.943 1.00 0.00 H new ATOM 0 HE1 PHE A 145 10.560 -5.383 1.777 1.00 0.00 H new ATOM 0 HE2 PHE A 145 13.958 -3.045 2.975 1.00 0.00 H new ATOM 0 HZ PHE A 145 12.097 -3.477 1.393 1.00 0.00 H new ATOM 2235 N LYS A 146 15.825 -7.406 5.858 1.00 0.00 N ATOM 2236 CA LYS A 146 17.244 -7.063 5.563 1.00 0.00 C ATOM 2237 C LYS A 146 17.864 -8.169 4.706 1.00 0.00 C ATOM 2238 O LYS A 146 18.587 -7.907 3.766 1.00 0.00 O ATOM 2239 CB LYS A 146 18.024 -6.936 6.873 1.00 0.00 C ATOM 2240 CG LYS A 146 19.430 -6.407 6.580 1.00 0.00 C ATOM 2241 CD LYS A 146 20.165 -6.152 7.896 1.00 0.00 C ATOM 2242 CE LYS A 146 20.404 -7.482 8.613 1.00 0.00 C ATOM 2243 NZ LYS A 146 21.864 -7.784 8.626 1.00 0.00 N ATOM 0 H LYS A 146 15.591 -7.474 6.849 1.00 0.00 H new ATOM 0 HA LYS A 146 17.285 -6.116 5.025 1.00 0.00 H new ATOM 0 HB2 LYS A 146 17.505 -6.262 7.554 1.00 0.00 H new ATOM 0 HB3 LYS A 146 18.084 -7.905 7.368 1.00 0.00 H new ATOM 0 HG2 LYS A 146 19.982 -7.127 5.977 1.00 0.00 H new ATOM 0 HG3 LYS A 146 19.370 -5.486 6.001 1.00 0.00 H new ATOM 0 HD2 LYS A 146 21.116 -5.655 7.703 1.00 0.00 H new ATOM 0 HD3 LYS A 146 19.579 -5.486 8.529 1.00 0.00 H new ATOM 0 HE2 LYS A 146 20.023 -7.431 9.633 1.00 0.00 H new ATOM 0 HE3 LYS A 146 19.861 -8.282 8.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 22.027 -8.688 9.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 22.214 -7.849 7.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 22.371 -7.025 9.125 1.00 0.00 H new ATOM 2257 N LEU A 147 17.584 -9.403 5.022 1.00 0.00 N ATOM 2258 CA LEU A 147 18.154 -10.523 4.223 1.00 0.00 C ATOM 2259 C LEU A 147 17.743 -10.360 2.760 1.00 0.00 C ATOM 2260 O LEU A 147 18.527 -10.571 1.856 1.00 0.00 O ATOM 2261 CB LEU A 147 17.624 -11.855 4.757 1.00 0.00 C ATOM 2262 CG LEU A 147 18.100 -12.054 6.197 1.00 0.00 C ATOM 2263 CD1 LEU A 147 17.722 -13.460 6.670 1.00 0.00 C ATOM 2264 CD2 LEU A 147 19.619 -11.887 6.260 1.00 0.00 C ATOM 0 H LEU A 147 16.985 -9.684 5.799 1.00 0.00 H new ATOM 0 HA LEU A 147 19.241 -10.510 4.301 1.00 0.00 H new ATOM 0 HB2 LEU A 147 16.535 -11.867 4.718 1.00 0.00 H new ATOM 0 HB3 LEU A 147 17.974 -12.675 4.130 1.00 0.00 H new ATOM 0 HG LEU A 147 17.626 -11.314 6.841 1.00 0.00 H new ATOM 0 HD11 LEU A 147 18.061 -13.602 7.696 1.00 0.00 H new ATOM 0 HD12 LEU A 147 16.640 -13.580 6.626 1.00 0.00 H new ATOM 0 HD13 LEU A 147 18.196 -14.200 6.025 1.00 0.00 H new ATOM 0 HD21 LEU A 147 19.958 -12.029 7.286 1.00 0.00 H new ATOM 0 HD22 LEU A 147 20.093 -12.627 5.615 1.00 0.00 H new ATOM 0 HD23 LEU A 147 19.889 -10.886 5.923 1.00 0.00 H new ATOM 2276 N ILE A 148 16.517 -9.979 2.518 1.00 0.00 N ATOM 2277 CA ILE A 148 16.060 -9.798 1.112 1.00 0.00 C ATOM 2278 C ILE A 148 17.002 -8.829 0.395 1.00 0.00 C ATOM 2279 O ILE A 148 17.452 -9.085 -0.704 1.00 0.00 O ATOM 2280 CB ILE A 148 14.639 -9.232 1.105 1.00 0.00 C ATOM 2281 CG1 ILE A 148 13.689 -10.232 1.767 1.00 0.00 C ATOM 2282 CG2 ILE A 148 14.195 -8.988 -0.339 1.00 0.00 C ATOM 2283 CD1 ILE A 148 12.292 -9.616 1.869 1.00 0.00 C ATOM 0 H ILE A 148 15.815 -9.786 3.232 1.00 0.00 H new ATOM 0 HA ILE A 148 16.067 -10.760 0.599 1.00 0.00 H new ATOM 0 HB ILE A 148 14.619 -8.292 1.656 1.00 0.00 H new ATOM 0 HG12 ILE A 148 13.651 -11.153 1.186 1.00 0.00 H new ATOM 0 HG13 ILE A 148 14.055 -10.496 2.759 1.00 0.00 H new ATOM 0 HG21 ILE A 148 13.182 -8.585 -0.345 1.00 0.00 H new ATOM 0 HG22 ILE A 148 14.872 -8.277 -0.812 1.00 0.00 H new ATOM 0 HG23 ILE A 148 14.214 -9.929 -0.889 1.00 0.00 H new ATOM 0 HD11 ILE A 148 11.614 -10.328 2.340 1.00 0.00 H new ATOM 0 HD12 ILE A 148 12.338 -8.707 2.468 1.00 0.00 H new ATOM 0 HD13 ILE A 148 11.927 -9.374 0.871 1.00 0.00 H new ATOM 2295 N GLU A 149 17.309 -7.719 1.010 1.00 0.00 N ATOM 2296 CA GLU A 149 18.229 -6.741 0.363 1.00 0.00 C ATOM 2297 C GLU A 149 19.531 -7.449 -0.013 1.00 0.00 C ATOM 2298 O GLU A 149 20.028 -7.315 -1.113 1.00 0.00 O ATOM 2299 CB GLU A 149 18.533 -5.601 1.336 1.00 0.00 C ATOM 2300 CG GLU A 149 17.226 -4.927 1.757 1.00 0.00 C ATOM 2301 CD GLU A 149 17.481 -4.044 2.980 1.00 0.00 C ATOM 2302 OE1 GLU A 149 18.608 -4.024 3.446 1.00 0.00 O ATOM 2303 OE2 GLU A 149 16.545 -3.402 3.428 1.00 0.00 O ATOM 0 H GLU A 149 16.963 -7.448 1.930 1.00 0.00 H new ATOM 0 HA GLU A 149 17.759 -6.335 -0.533 1.00 0.00 H new ATOM 0 HB2 GLU A 149 19.055 -5.986 2.212 1.00 0.00 H new ATOM 0 HB3 GLU A 149 19.194 -4.874 0.865 1.00 0.00 H new ATOM 0 HG2 GLU A 149 16.833 -4.326 0.937 1.00 0.00 H new ATOM 0 HG3 GLU A 149 16.474 -5.681 1.989 1.00 0.00 H new ATOM 2310 N GLY A 150 20.086 -8.205 0.895 1.00 0.00 N ATOM 2311 CA GLY A 150 21.353 -8.927 0.592 1.00 0.00 C ATOM 2312 C GLY A 150 21.064 -10.067 -0.385 1.00 0.00 C ATOM 2313 O GLY A 150 21.918 -10.476 -1.146 1.00 0.00 O ATOM 0 H GLY A 150 19.716 -8.353 1.834 1.00 0.00 H new ATOM 0 HA2 GLY A 150 22.082 -8.240 0.162 1.00 0.00 H new ATOM 0 HA3 GLY A 150 21.789 -9.321 1.510 1.00 0.00 H new ATOM 2317 N TYR A 151 19.866 -10.583 -0.370 1.00 0.00 N ATOM 2318 CA TYR A 151 19.521 -11.695 -1.300 1.00 0.00 C ATOM 2319 C TYR A 151 19.724 -11.231 -2.742 1.00 0.00 C ATOM 2320 O TYR A 151 20.325 -11.915 -3.547 1.00 0.00 O ATOM 2321 CB TYR A 151 18.059 -12.096 -1.095 1.00 0.00 C ATOM 2322 CG TYR A 151 17.728 -13.263 -1.995 1.00 0.00 C ATOM 2323 CD1 TYR A 151 17.926 -14.573 -1.544 1.00 0.00 C ATOM 2324 CD2 TYR A 151 17.224 -13.033 -3.281 1.00 0.00 C ATOM 2325 CE1 TYR A 151 17.620 -15.654 -2.379 1.00 0.00 C ATOM 2326 CE2 TYR A 151 16.918 -14.114 -4.115 1.00 0.00 C ATOM 2327 CZ TYR A 151 17.116 -15.424 -3.665 1.00 0.00 C ATOM 2328 OH TYR A 151 16.815 -16.489 -4.488 1.00 0.00 O ATOM 0 H TYR A 151 19.111 -10.283 0.246 1.00 0.00 H new ATOM 0 HA TYR A 151 20.164 -12.552 -1.098 1.00 0.00 H new ATOM 0 HB2 TYR A 151 17.887 -12.366 -0.053 1.00 0.00 H new ATOM 0 HB3 TYR A 151 17.405 -11.253 -1.318 1.00 0.00 H new ATOM 0 HD1 TYR A 151 18.315 -14.750 -0.552 1.00 0.00 H new ATOM 0 HD2 TYR A 151 17.072 -12.022 -3.629 1.00 0.00 H new ATOM 0 HE1 TYR A 151 17.773 -16.665 -2.031 1.00 0.00 H new ATOM 0 HE2 TYR A 151 16.529 -13.937 -5.107 1.00 0.00 H new ATOM 0 HH TYR A 151 16.475 -16.155 -5.344 1.00 0.00 H new ATOM 2338 N LEU A 152 19.228 -10.071 -3.077 1.00 0.00 N ATOM 2339 CA LEU A 152 19.395 -9.562 -4.466 1.00 0.00 C ATOM 2340 C LEU A 152 20.843 -9.112 -4.670 1.00 0.00 C ATOM 2341 O LEU A 152 21.488 -9.481 -5.630 1.00 0.00 O ATOM 2342 CB LEU A 152 18.452 -8.378 -4.692 1.00 0.00 C ATOM 2343 CG LEU A 152 17.005 -8.874 -4.678 1.00 0.00 C ATOM 2344 CD1 LEU A 152 16.579 -9.166 -3.238 1.00 0.00 C ATOM 2345 CD2 LEU A 152 16.091 -7.798 -5.271 1.00 0.00 C ATOM 0 H LEU A 152 18.714 -9.454 -2.448 1.00 0.00 H new ATOM 0 HA LEU A 152 19.157 -10.353 -5.177 1.00 0.00 H new ATOM 0 HB2 LEU A 152 18.599 -7.628 -3.915 1.00 0.00 H new ATOM 0 HB3 LEU A 152 18.675 -7.898 -5.645 1.00 0.00 H new ATOM 0 HG LEU A 152 16.928 -9.785 -5.272 1.00 0.00 H new ATOM 0 HD11 LEU A 152 15.548 -9.519 -3.228 1.00 0.00 H new ATOM 0 HD12 LEU A 152 17.229 -9.932 -2.814 1.00 0.00 H new ATOM 0 HD13 LEU A 152 16.656 -8.255 -2.644 1.00 0.00 H new ATOM 0 HD21 LEU A 152 15.060 -8.151 -5.261 1.00 0.00 H new ATOM 0 HD22 LEU A 152 16.168 -6.887 -4.677 1.00 0.00 H new ATOM 0 HD23 LEU A 152 16.393 -7.589 -6.297 1.00 0.00 H new