USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 1077 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 Single : A 3 THR OG1 : rot 158:sc= 0.0198 USER MOD Single : A 9 SER OG : rot 107:sc= 0.698 USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 91:sc= 0.898 USER MOD Single : A 28 ASN : amide:sc= -0.346 X(o=-0.35,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 27:sc= 0.364 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 143:sc= 1.18 (180deg=-0.0791) USER MOD Single : A 41 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0238) USER MOD Single : A 46 LYS NZ :NH3+ 165:sc= 0.846 (180deg=0.504) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= -4.53! C(o=-4.5!,f=-2!) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -2.77! K(o=-2.8!,f=-0.65) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ -139:sc= 0.304 (180deg=-2.4!) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 GLN : amide:sc=-0.00796 X(o=-0.008,f=0.038) USER MOD Single : A 96 TYR OH : rot 30:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -1.26 X(o=-1.3,f=-0.95) USER MOD Single : A 100 LYS NZ :NH3+ 142:sc= -0.572 (180deg=-2.5!) USER MOD Single : A 101 LYS NZ :NH3+ 169:sc= 0.469 (180deg=0.378) USER MOD Single : A 109 THR OG1 : rot 112:sc= 0.141 USER MOD Single : A 111 ASN : amide:sc= -1.49! K(o=-1.5!,f=-0.93) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= -0.294 (180deg=-0.294) USER MOD Single : A 120 LYS NZ :NH3+ -168:sc= 0.529 (180deg=0.207) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 -1.997 -12.847 0.836 1.00 13.43 N ATOM 21 CA GLY A 2 -0.757 -12.122 1.126 1.00 11.42 C ATOM 22 C GLY A 2 -0.569 -10.912 0.224 1.00 13.22 C ATOM 23 O GLY A 2 0.561 -10.567 -0.132 1.00 14.12 O ATOM 0 HA2 GLY A 2 -0.763 -11.798 2.167 1.00 11.42 H new ATOM 0 HA3 GLY A 2 0.091 -12.796 1.007 1.00 11.42 H new ATOM 27 N THR A 3 -1.696 -10.270 -0.153 1.00 65.12 N ATOM 28 CA THR A 3 -1.695 -9.090 -1.021 1.00 1.31 C ATOM 29 C THR A 3 -1.037 -7.906 -0.297 1.00 4.43 C ATOM 30 O THR A 3 -1.470 -7.531 0.797 1.00 74.32 O ATOM 31 CB THR A 3 -3.153 -8.697 -1.449 1.00 64.13 C ATOM 32 OG1 THR A 3 -3.865 -9.872 -1.871 1.00 45.14 O ATOM 33 CG2 THR A 3 -3.160 -7.655 -2.593 1.00 24.24 C ATOM 0 H THR A 3 -2.628 -10.562 0.140 1.00 65.12 H new ATOM 0 HA THR A 3 -1.127 -9.335 -1.918 1.00 1.31 H new ATOM 0 HB THR A 3 -3.641 -8.248 -0.584 1.00 64.13 H new ATOM 0 HG1 THR A 3 -4.829 -9.713 -1.801 1.00 45.14 H new ATOM 0 HG21 THR A 3 -4.189 -7.412 -2.857 1.00 24.24 H new ATOM 0 HG22 THR A 3 -2.646 -6.751 -2.265 1.00 24.24 H new ATOM 0 HG23 THR A 3 -2.649 -8.067 -3.463 1.00 24.24 H new ATOM 41 N VAL A 4 -0.008 -7.322 -0.911 1.00 3.34 N ATOM 42 CA VAL A 4 0.717 -6.192 -0.330 1.00 34.24 C ATOM 43 C VAL A 4 0.028 -4.928 -0.841 1.00 43.15 C ATOM 44 O VAL A 4 0.080 -4.636 -2.030 1.00 52.41 O ATOM 45 CB VAL A 4 2.243 -6.208 -0.749 1.00 53.50 C ATOM 46 CG1 VAL A 4 3.036 -5.058 -0.077 1.00 13.34 C ATOM 47 CG2 VAL A 4 2.882 -7.582 -0.427 1.00 30.33 C ATOM 0 H VAL A 4 0.345 -7.617 -1.821 1.00 3.34 H new ATOM 0 HA VAL A 4 0.698 -6.241 0.759 1.00 34.24 H new ATOM 0 HB VAL A 4 2.291 -6.048 -1.826 1.00 53.50 H new ATOM 0 HG11 VAL A 4 4.079 -5.104 -0.390 1.00 13.34 H new ATOM 0 HG12 VAL A 4 2.610 -4.100 -0.374 1.00 13.34 H new ATOM 0 HG13 VAL A 4 2.978 -5.161 1.007 1.00 13.34 H new ATOM 0 HG21 VAL A 4 3.931 -7.573 -0.722 1.00 30.33 H new ATOM 0 HG22 VAL A 4 2.808 -7.776 0.643 1.00 30.33 H new ATOM 0 HG23 VAL A 4 2.357 -8.365 -0.975 1.00 30.33 H new ATOM 57 N VAL A 5 -0.639 -4.201 0.065 1.00 54.40 N ATOM 58 CA VAL A 5 -1.414 -2.995 -0.270 1.00 52.23 C ATOM 59 C VAL A 5 -0.752 -1.774 0.390 1.00 54.44 C ATOM 60 O VAL A 5 -0.675 -1.670 1.610 1.00 25.12 O ATOM 61 CB VAL A 5 -2.946 -3.145 0.131 1.00 2.32 C ATOM 62 CG1 VAL A 5 -3.641 -4.226 -0.734 1.00 54.42 C ATOM 63 CG2 VAL A 5 -3.144 -3.477 1.627 1.00 40.03 C ATOM 0 H VAL A 5 -0.657 -4.433 1.058 1.00 54.40 H new ATOM 0 HA VAL A 5 -1.407 -2.853 -1.351 1.00 52.23 H new ATOM 0 HB VAL A 5 -3.404 -2.174 -0.056 1.00 2.32 H new ATOM 0 HG11 VAL A 5 -4.687 -4.310 -0.440 1.00 54.42 H new ATOM 0 HG12 VAL A 5 -3.580 -3.945 -1.785 1.00 54.42 H new ATOM 0 HG13 VAL A 5 -3.145 -5.185 -0.586 1.00 54.42 H new ATOM 0 HG21 VAL A 5 -4.209 -3.567 1.842 1.00 40.03 H new ATOM 0 HG22 VAL A 5 -2.646 -4.418 1.860 1.00 40.03 H new ATOM 0 HG23 VAL A 5 -2.717 -2.680 2.236 1.00 40.03 H new ATOM 73 N ILE A 6 -0.216 -0.871 -0.431 1.00 10.04 N ATOM 74 CA ILE A 6 0.533 0.296 0.044 1.00 60.53 C ATOM 75 C ILE A 6 -0.385 1.519 -0.023 1.00 40.23 C ATOM 76 O ILE A 6 -0.656 2.027 -1.117 1.00 44.35 O ATOM 77 CB ILE A 6 1.846 0.554 -0.804 1.00 34.21 C ATOM 78 CG1 ILE A 6 2.791 -0.709 -0.851 1.00 32.03 C ATOM 79 CG2 ILE A 6 2.610 1.784 -0.254 1.00 10.51 C ATOM 80 CD1 ILE A 6 2.379 -1.808 -1.827 1.00 41.24 C ATOM 0 H ILE A 6 -0.288 -0.927 -1.447 1.00 10.04 H new ATOM 0 HA ILE A 6 0.853 0.108 1.069 1.00 60.53 H new ATOM 0 HB ILE A 6 1.533 0.755 -1.828 1.00 34.21 H new ATOM 0 HG12 ILE A 6 3.797 -0.378 -1.109 1.00 32.03 H new ATOM 0 HG13 ILE A 6 2.843 -1.138 0.150 1.00 32.03 H new ATOM 0 HG21 ILE A 6 3.510 1.948 -0.847 1.00 10.51 H new ATOM 0 HG22 ILE A 6 1.971 2.665 -0.312 1.00 10.51 H new ATOM 0 HG23 ILE A 6 2.888 1.605 0.785 1.00 10.51 H new ATOM 0 HD11 ILE A 6 3.097 -2.627 -1.777 1.00 41.24 H new ATOM 0 HD12 ILE A 6 1.389 -2.178 -1.562 1.00 41.24 H new ATOM 0 HD13 ILE A 6 2.357 -1.406 -2.840 1.00 41.24 H new ATOM 92 N VAL A 7 -0.884 1.965 1.141 1.00 24.11 N ATOM 93 CA VAL A 7 -1.755 3.145 1.243 1.00 54.33 C ATOM 94 C VAL A 7 -0.898 4.391 1.442 1.00 44.02 C ATOM 95 O VAL A 7 -0.224 4.544 2.466 1.00 0.11 O ATOM 96 CB VAL A 7 -2.810 3.017 2.399 1.00 74.01 C ATOM 97 CG1 VAL A 7 -3.681 4.300 2.541 1.00 40.34 C ATOM 98 CG2 VAL A 7 -3.689 1.778 2.161 1.00 54.51 C ATOM 0 H VAL A 7 -0.694 1.517 2.038 1.00 24.11 H new ATOM 0 HA VAL A 7 -2.318 3.223 0.313 1.00 54.33 H new ATOM 0 HB VAL A 7 -2.270 2.900 3.339 1.00 74.01 H new ATOM 0 HG11 VAL A 7 -4.396 4.166 3.352 1.00 40.34 H new ATOM 0 HG12 VAL A 7 -3.039 5.153 2.760 1.00 40.34 H new ATOM 0 HG13 VAL A 7 -4.218 4.480 1.610 1.00 40.34 H new ATOM 0 HG21 VAL A 7 -4.420 1.691 2.964 1.00 54.51 H new ATOM 0 HG22 VAL A 7 -4.208 1.877 1.207 1.00 54.51 H new ATOM 0 HG23 VAL A 7 -3.063 0.886 2.142 1.00 54.51 H new ATOM 108 N VAL A 8 -0.902 5.258 0.430 1.00 35.04 N ATOM 109 CA VAL A 8 -0.168 6.522 0.435 1.00 42.04 C ATOM 110 C VAL A 8 -1.172 7.686 0.402 1.00 11.22 C ATOM 111 O VAL A 8 -2.277 7.539 -0.123 1.00 72.14 O ATOM 112 CB VAL A 8 0.810 6.649 -0.790 1.00 65.41 C ATOM 113 CG1 VAL A 8 1.773 7.838 -0.598 1.00 14.43 C ATOM 114 CG2 VAL A 8 1.582 5.331 -1.052 1.00 12.40 C ATOM 0 H VAL A 8 -1.425 5.098 -0.431 1.00 35.04 H new ATOM 0 HA VAL A 8 0.434 6.552 1.343 1.00 42.04 H new ATOM 0 HB VAL A 8 0.206 6.842 -1.676 1.00 65.41 H new ATOM 0 HG11 VAL A 8 2.441 7.908 -1.457 1.00 14.43 H new ATOM 0 HG12 VAL A 8 1.199 8.760 -0.509 1.00 14.43 H new ATOM 0 HG13 VAL A 8 2.361 7.688 0.307 1.00 14.43 H new ATOM 0 HG21 VAL A 8 2.246 5.462 -1.906 1.00 12.40 H new ATOM 0 HG22 VAL A 8 2.170 5.073 -0.171 1.00 12.40 H new ATOM 0 HG23 VAL A 8 0.873 4.530 -1.263 1.00 12.40 H new ATOM 124 N SER A 9 -0.787 8.821 0.991 1.00 52.41 N ATOM 125 CA SER A 9 -1.519 10.086 0.858 1.00 11.21 C ATOM 126 C SER A 9 -0.573 11.251 1.160 1.00 53.03 C ATOM 127 O SER A 9 0.421 11.089 1.882 1.00 4.44 O ATOM 128 CB SER A 9 -2.759 10.115 1.782 1.00 55.35 C ATOM 129 OG SER A 9 -2.398 9.851 3.118 1.00 43.42 O ATOM 0 H SER A 9 0.045 8.890 1.577 1.00 52.41 H new ATOM 0 HA SER A 9 -1.883 10.181 -0.165 1.00 11.21 H new ATOM 0 HB2 SER A 9 -3.242 11.090 1.718 1.00 55.35 H new ATOM 0 HB3 SER A 9 -3.486 9.376 1.445 1.00 55.35 H new ATOM 0 HG SER A 9 -2.443 10.680 3.639 1.00 43.42 H new ATOM 135 N ASN A 10 -0.899 12.414 0.588 1.00 43.41 N ATOM 136 CA ASN A 10 -0.134 13.659 0.773 1.00 72.14 C ATOM 137 C ASN A 10 -0.367 14.237 2.174 1.00 32.44 C ATOM 138 O ASN A 10 0.482 14.967 2.706 1.00 3.44 O ATOM 139 CB ASN A 10 -0.514 14.688 -0.323 1.00 72.52 C ATOM 140 CG ASN A 10 -0.177 14.189 -1.731 1.00 0.11 C ATOM 141 OD1 ASN A 10 0.930 14.402 -2.230 1.00 54.32 O ATOM 142 ND2 ASN A 10 -1.112 13.493 -2.375 1.00 2.13 N ATOM 0 H ASN A 10 -1.708 12.523 -0.023 1.00 43.41 H new ATOM 0 HA ASN A 10 0.928 13.433 0.679 1.00 72.14 H new ATOM 0 HB2 ASN A 10 -1.581 14.903 -0.262 1.00 72.52 H new ATOM 0 HB3 ASN A 10 0.011 15.625 -0.137 1.00 72.52 H new ATOM 0 HD21 ASN A 10 -0.921 13.121 -3.305 1.00 2.13 H new ATOM 0 HD22 ASN A 10 -2.019 13.332 -1.938 1.00 2.13 H new ATOM 149 N ASP A 11 -1.527 13.903 2.760 1.00 0.35 N ATOM 150 CA ASP A 11 -1.878 14.286 4.136 1.00 3.45 C ATOM 151 C ASP A 11 -1.834 13.030 5.022 1.00 13.32 C ATOM 152 O ASP A 11 -2.557 12.070 4.775 1.00 23.04 O ATOM 153 CB ASP A 11 -3.279 14.948 4.167 1.00 51.23 C ATOM 154 CG ASP A 11 -3.648 15.533 5.545 1.00 24.23 C ATOM 155 OD1 ASP A 11 -4.120 14.780 6.417 1.00 32.52 O ATOM 156 OD2 ASP A 11 -3.428 16.747 5.768 1.00 44.13 O ATOM 0 H ASP A 11 -2.250 13.358 2.291 1.00 0.35 H new ATOM 0 HA ASP A 11 -1.163 15.016 4.517 1.00 3.45 H new ATOM 0 HB2 ASP A 11 -3.314 15.743 3.422 1.00 51.23 H new ATOM 0 HB3 ASP A 11 -4.028 14.210 3.881 1.00 51.23 H new ATOM 161 N GLU A 12 -0.991 13.062 6.056 1.00 23.32 N ATOM 162 CA GLU A 12 -0.727 11.906 6.934 1.00 41.00 C ATOM 163 C GLU A 12 -1.877 11.611 7.927 1.00 42.40 C ATOM 164 O GLU A 12 -1.907 10.529 8.518 1.00 45.10 O ATOM 165 CB GLU A 12 0.621 12.123 7.672 1.00 75.33 C ATOM 166 CG GLU A 12 1.848 12.115 6.734 1.00 31.55 C ATOM 167 CD GLU A 12 3.181 12.323 7.471 1.00 32.21 C ATOM 168 OE1 GLU A 12 3.690 11.360 8.083 1.00 31.42 O ATOM 169 OE2 GLU A 12 3.722 13.454 7.444 1.00 63.24 O ATOM 0 H GLU A 12 -0.464 13.896 6.315 1.00 23.32 H new ATOM 0 HA GLU A 12 -0.662 11.020 6.303 1.00 41.00 H new ATOM 0 HB2 GLU A 12 0.586 13.075 8.203 1.00 75.33 H new ATOM 0 HB3 GLU A 12 0.744 11.343 8.424 1.00 75.33 H new ATOM 0 HG2 GLU A 12 1.881 11.166 6.199 1.00 31.55 H new ATOM 0 HG3 GLU A 12 1.729 12.898 5.986 1.00 31.55 H new ATOM 176 N ARG A 13 -2.813 12.565 8.129 1.00 63.15 N ATOM 177 CA ARG A 13 -4.023 12.315 8.955 1.00 73.53 C ATOM 178 C ARG A 13 -5.030 11.450 8.188 1.00 61.44 C ATOM 179 O ARG A 13 -5.848 10.756 8.801 1.00 55.14 O ATOM 180 CB ARG A 13 -4.695 13.620 9.428 1.00 31.45 C ATOM 181 CG ARG A 13 -3.807 14.507 10.326 1.00 31.31 C ATOM 182 CD ARG A 13 -4.538 15.770 10.804 1.00 53.12 C ATOM 183 NE ARG A 13 -4.973 16.629 9.679 1.00 21.12 N ATOM 184 CZ ARG A 13 -6.232 17.056 9.459 1.00 11.52 C ATOM 185 NH1 ARG A 13 -7.233 16.717 10.273 1.00 50.12 N ATOM 186 NH2 ARG A 13 -6.473 17.835 8.422 1.00 21.43 N ATOM 0 H ARG A 13 -2.759 13.506 7.738 1.00 63.15 H new ATOM 0 HA ARG A 13 -3.692 11.780 9.845 1.00 73.53 H new ATOM 0 HB2 ARG A 13 -4.996 14.197 8.553 1.00 31.45 H new ATOM 0 HB3 ARG A 13 -5.605 13.369 9.973 1.00 31.45 H new ATOM 0 HG2 ARG A 13 -3.479 13.931 11.191 1.00 31.31 H new ATOM 0 HG3 ARG A 13 -2.911 14.795 9.776 1.00 31.31 H new ATOM 0 HD2 ARG A 13 -5.407 15.482 11.395 1.00 53.12 H new ATOM 0 HD3 ARG A 13 -3.881 16.340 11.461 1.00 53.12 H new ATOM 0 HE ARG A 13 -4.258 16.923 9.013 1.00 21.12 H new ATOM 0 HH11 ARG A 13 -7.053 16.122 11.082 1.00 50.12 H new ATOM 0 HH12 ARG A 13 -8.178 17.052 10.086 1.00 50.12 H new ATOM 0 HH21 ARG A 13 -5.712 18.106 7.800 1.00 21.43 H new ATOM 0 HH22 ARG A 13 -7.421 18.166 8.242 1.00 21.43 H new ATOM 200 N ILE A 14 -4.985 11.531 6.838 1.00 34.22 N ATOM 201 CA ILE A 14 -5.725 10.614 5.960 1.00 74.53 C ATOM 202 C ILE A 14 -5.245 9.170 6.228 1.00 74.30 C ATOM 203 O ILE A 14 -6.056 8.270 6.363 1.00 70.24 O ATOM 204 CB ILE A 14 -5.567 10.996 4.433 1.00 51.52 C ATOM 205 CG1 ILE A 14 -6.145 12.428 4.165 1.00 14.21 C ATOM 206 CG2 ILE A 14 -6.230 9.949 3.502 1.00 63.54 C ATOM 207 CD1 ILE A 14 -6.064 12.892 2.716 1.00 51.02 C ATOM 0 H ILE A 14 -4.437 12.230 6.336 1.00 34.22 H new ATOM 0 HA ILE A 14 -6.788 10.694 6.186 1.00 74.53 H new ATOM 0 HB ILE A 14 -4.502 11.000 4.203 1.00 51.52 H new ATOM 0 HG12 ILE A 14 -7.188 12.447 4.480 1.00 14.21 H new ATOM 0 HG13 ILE A 14 -5.610 13.143 4.790 1.00 14.21 H new ATOM 0 HG21 ILE A 14 -6.098 10.251 2.463 1.00 63.54 H new ATOM 0 HG22 ILE A 14 -5.765 8.976 3.659 1.00 63.54 H new ATOM 0 HG23 ILE A 14 -7.294 9.883 3.728 1.00 63.54 H new ATOM 0 HD11 ILE A 14 -6.488 13.893 2.630 1.00 51.02 H new ATOM 0 HD12 ILE A 14 -5.022 12.911 2.398 1.00 51.02 H new ATOM 0 HD13 ILE A 14 -6.624 12.205 2.082 1.00 51.02 H new ATOM 219 N LEU A 15 -3.913 8.988 6.382 1.00 3.21 N ATOM 220 CA LEU A 15 -3.318 7.680 6.759 1.00 50.41 C ATOM 221 C LEU A 15 -3.845 7.184 8.123 1.00 72.53 C ATOM 222 O LEU A 15 -4.114 5.999 8.282 1.00 35.24 O ATOM 223 CB LEU A 15 -1.775 7.769 6.833 1.00 44.25 C ATOM 224 CG LEU A 15 -1.052 8.087 5.502 1.00 15.32 C ATOM 225 CD1 LEU A 15 0.450 8.328 5.744 1.00 12.11 C ATOM 226 CD2 LEU A 15 -1.301 6.966 4.462 1.00 60.55 C ATOM 0 H LEU A 15 -3.227 9.731 6.251 1.00 3.21 H new ATOM 0 HA LEU A 15 -3.611 6.973 5.983 1.00 50.41 H new ATOM 0 HB2 LEU A 15 -1.509 8.536 7.561 1.00 44.25 H new ATOM 0 HB3 LEU A 15 -1.394 6.822 7.214 1.00 44.25 H new ATOM 0 HG LEU A 15 -1.466 9.007 5.090 1.00 15.32 H new ATOM 0 HD11 LEU A 15 0.940 8.550 4.796 1.00 12.11 H new ATOM 0 HD12 LEU A 15 0.578 9.170 6.425 1.00 12.11 H new ATOM 0 HD13 LEU A 15 0.896 7.435 6.183 1.00 12.11 H new ATOM 0 HD21 LEU A 15 -0.784 7.209 3.534 1.00 60.55 H new ATOM 0 HD22 LEU A 15 -0.924 6.020 4.850 1.00 60.55 H new ATOM 0 HD23 LEU A 15 -2.370 6.879 4.270 1.00 60.55 H new ATOM 238 N GLU A 16 -3.969 8.117 9.090 1.00 10.50 N ATOM 239 CA GLU A 16 -4.398 7.808 10.472 1.00 64.25 C ATOM 240 C GLU A 16 -5.868 7.359 10.518 1.00 74.14 C ATOM 241 O GLU A 16 -6.189 6.371 11.186 1.00 0.23 O ATOM 242 CB GLU A 16 -4.178 9.026 11.405 1.00 71.03 C ATOM 243 CG GLU A 16 -2.700 9.398 11.613 1.00 14.31 C ATOM 244 CD GLU A 16 -2.524 10.538 12.622 1.00 22.12 C ATOM 245 OE1 GLU A 16 -2.940 11.672 12.313 1.00 61.32 O ATOM 246 OE2 GLU A 16 -1.987 10.312 13.729 1.00 61.24 O ATOM 0 H GLU A 16 -3.775 9.106 8.936 1.00 10.50 H new ATOM 0 HA GLU A 16 -3.782 6.982 10.827 1.00 64.25 H new ATOM 0 HB2 GLU A 16 -4.704 9.887 10.991 1.00 71.03 H new ATOM 0 HB3 GLU A 16 -4.628 8.813 12.375 1.00 71.03 H new ATOM 0 HG2 GLU A 16 -2.152 8.522 11.959 1.00 14.31 H new ATOM 0 HG3 GLU A 16 -2.263 9.690 10.658 1.00 14.31 H new ATOM 253 N GLU A 17 -6.745 8.091 9.801 1.00 22.42 N ATOM 254 CA GLU A 17 -8.174 7.741 9.694 1.00 54.23 C ATOM 255 C GLU A 17 -8.334 6.384 8.996 1.00 12.55 C ATOM 256 O GLU A 17 -8.952 5.461 9.537 1.00 70.44 O ATOM 257 CB GLU A 17 -8.955 8.825 8.905 1.00 33.42 C ATOM 258 CG GLU A 17 -10.441 8.463 8.662 1.00 40.20 C ATOM 259 CD GLU A 17 -11.177 9.460 7.768 1.00 63.51 C ATOM 260 OE1 GLU A 17 -11.019 9.377 6.537 1.00 31.42 O ATOM 261 OE2 GLU A 17 -11.912 10.328 8.287 1.00 44.41 O ATOM 0 H GLU A 17 -6.485 8.932 9.286 1.00 22.42 H new ATOM 0 HA GLU A 17 -8.583 7.683 10.703 1.00 54.23 H new ATOM 0 HB2 GLU A 17 -8.904 9.767 9.450 1.00 33.42 H new ATOM 0 HB3 GLU A 17 -8.467 8.986 7.944 1.00 33.42 H new ATOM 0 HG2 GLU A 17 -10.495 7.473 8.209 1.00 40.20 H new ATOM 0 HG3 GLU A 17 -10.953 8.403 9.622 1.00 40.20 H new ATOM 268 N LEU A 18 -7.706 6.283 7.815 1.00 32.20 N ATOM 269 CA LEU A 18 -7.755 5.099 6.943 1.00 3.41 C ATOM 270 C LEU A 18 -7.134 3.868 7.633 1.00 11.34 C ATOM 271 O LEU A 18 -7.509 2.731 7.325 1.00 20.22 O ATOM 272 CB LEU A 18 -7.089 5.417 5.562 1.00 21.25 C ATOM 273 CG LEU A 18 -8.028 6.062 4.468 1.00 13.23 C ATOM 274 CD1 LEU A 18 -8.732 7.343 4.966 1.00 65.25 C ATOM 275 CD2 LEU A 18 -7.252 6.326 3.156 1.00 70.51 C ATOM 0 H LEU A 18 -7.138 7.038 7.431 1.00 32.20 H new ATOM 0 HA LEU A 18 -8.798 4.846 6.751 1.00 3.41 H new ATOM 0 HB2 LEU A 18 -6.249 6.091 5.733 1.00 21.25 H new ATOM 0 HB3 LEU A 18 -6.678 4.492 5.158 1.00 21.25 H new ATOM 0 HG LEU A 18 -8.814 5.335 4.263 1.00 13.23 H new ATOM 0 HD11 LEU A 18 -9.364 7.743 4.173 1.00 65.25 H new ATOM 0 HD12 LEU A 18 -9.346 7.106 5.835 1.00 65.25 H new ATOM 0 HD13 LEU A 18 -7.983 8.086 5.242 1.00 65.25 H new ATOM 0 HD21 LEU A 18 -7.922 6.770 2.420 1.00 70.51 H new ATOM 0 HD22 LEU A 18 -6.426 7.009 3.353 1.00 70.51 H new ATOM 0 HD23 LEU A 18 -6.861 5.385 2.769 1.00 70.51 H new ATOM 287 N LEU A 19 -6.189 4.116 8.569 1.00 33.42 N ATOM 288 CA LEU A 19 -5.615 3.076 9.442 1.00 2.01 C ATOM 289 C LEU A 19 -6.717 2.402 10.254 1.00 55.02 C ATOM 290 O LEU A 19 -6.855 1.185 10.223 1.00 23.53 O ATOM 291 CB LEU A 19 -4.552 3.674 10.405 1.00 71.42 C ATOM 292 CG LEU A 19 -3.984 2.699 11.493 1.00 31.15 C ATOM 293 CD1 LEU A 19 -3.233 1.520 10.863 1.00 70.22 C ATOM 294 CD2 LEU A 19 -3.110 3.439 12.516 1.00 72.14 C ATOM 0 H LEU A 19 -5.805 5.046 8.737 1.00 33.42 H new ATOM 0 HA LEU A 19 -5.128 2.338 8.805 1.00 2.01 H new ATOM 0 HB2 LEU A 19 -3.719 4.046 9.809 1.00 71.42 H new ATOM 0 HB3 LEU A 19 -4.991 4.534 10.910 1.00 71.42 H new ATOM 0 HG LEU A 19 -4.838 2.288 12.031 1.00 31.15 H new ATOM 0 HD11 LEU A 19 -2.855 0.867 11.650 1.00 70.22 H new ATOM 0 HD12 LEU A 19 -3.911 0.958 10.220 1.00 70.22 H new ATOM 0 HD13 LEU A 19 -2.399 1.895 10.270 1.00 70.22 H new ATOM 0 HD21 LEU A 19 -2.734 2.730 13.254 1.00 72.14 H new ATOM 0 HD22 LEU A 19 -2.270 3.909 12.004 1.00 72.14 H new ATOM 0 HD23 LEU A 19 -3.704 4.204 13.017 1.00 72.14 H new ATOM 306 N GLU A 20 -7.504 3.236 10.945 1.00 73.25 N ATOM 307 CA GLU A 20 -8.564 2.791 11.861 1.00 40.32 C ATOM 308 C GLU A 20 -9.686 2.070 11.103 1.00 51.02 C ATOM 309 O GLU A 20 -10.342 1.192 11.655 1.00 13.21 O ATOM 310 CB GLU A 20 -9.102 3.998 12.652 1.00 15.22 C ATOM 311 CG GLU A 20 -7.999 4.784 13.384 1.00 4.14 C ATOM 312 CD GLU A 20 -8.541 5.980 14.181 1.00 61.04 C ATOM 313 OE1 GLU A 20 -8.674 7.086 13.607 1.00 32.32 O ATOM 314 OE2 GLU A 20 -8.847 5.816 15.387 1.00 63.20 O ATOM 0 H GLU A 20 -7.422 4.251 10.884 1.00 73.25 H new ATOM 0 HA GLU A 20 -8.145 2.072 12.565 1.00 40.32 H new ATOM 0 HB2 GLU A 20 -9.624 4.668 11.969 1.00 15.22 H new ATOM 0 HB3 GLU A 20 -9.835 3.650 13.380 1.00 15.22 H new ATOM 0 HG2 GLU A 20 -7.471 4.113 14.061 1.00 4.14 H new ATOM 0 HG3 GLU A 20 -7.270 5.140 12.656 1.00 4.14 H new ATOM 321 N VAL A 21 -9.885 2.465 9.831 1.00 64.41 N ATOM 322 CA VAL A 21 -10.828 1.810 8.911 1.00 14.22 C ATOM 323 C VAL A 21 -10.403 0.349 8.648 1.00 71.32 C ATOM 324 O VAL A 21 -11.246 -0.554 8.620 1.00 41.22 O ATOM 325 CB VAL A 21 -10.947 2.604 7.555 1.00 51.11 C ATOM 326 CG1 VAL A 21 -11.945 1.939 6.570 1.00 14.03 C ATOM 327 CG2 VAL A 21 -11.338 4.074 7.833 1.00 15.32 C ATOM 0 H VAL A 21 -9.391 3.253 9.412 1.00 64.41 H new ATOM 0 HA VAL A 21 -11.810 1.807 9.385 1.00 14.22 H new ATOM 0 HB VAL A 21 -9.970 2.582 7.072 1.00 51.11 H new ATOM 0 HG11 VAL A 21 -11.992 2.523 5.651 1.00 14.03 H new ATOM 0 HG12 VAL A 21 -11.610 0.927 6.341 1.00 14.03 H new ATOM 0 HG13 VAL A 21 -12.934 1.899 7.026 1.00 14.03 H new ATOM 0 HG21 VAL A 21 -11.418 4.614 6.890 1.00 15.32 H new ATOM 0 HG22 VAL A 21 -12.297 4.104 8.350 1.00 15.32 H new ATOM 0 HG23 VAL A 21 -10.575 4.542 8.456 1.00 15.32 H new ATOM 337 N VAL A 22 -9.081 0.132 8.485 1.00 12.15 N ATOM 338 CA VAL A 22 -8.514 -1.212 8.295 1.00 3.12 C ATOM 339 C VAL A 22 -8.595 -2.019 9.611 1.00 31.12 C ATOM 340 O VAL A 22 -9.036 -3.171 9.606 1.00 54.02 O ATOM 341 CB VAL A 22 -7.026 -1.155 7.762 1.00 14.52 C ATOM 342 CG1 VAL A 22 -6.431 -2.579 7.590 1.00 75.15 C ATOM 343 CG2 VAL A 22 -6.947 -0.362 6.431 1.00 41.21 C ATOM 0 H VAL A 22 -8.386 0.878 8.482 1.00 12.15 H new ATOM 0 HA VAL A 22 -9.109 -1.718 7.534 1.00 3.12 H new ATOM 0 HB VAL A 22 -6.427 -0.633 8.508 1.00 14.52 H new ATOM 0 HG11 VAL A 22 -5.408 -2.504 7.222 1.00 75.15 H new ATOM 0 HG12 VAL A 22 -6.434 -3.093 8.551 1.00 75.15 H new ATOM 0 HG13 VAL A 22 -7.033 -3.141 6.876 1.00 75.15 H new ATOM 0 HG21 VAL A 22 -5.914 -0.336 6.084 1.00 41.21 H new ATOM 0 HG22 VAL A 22 -7.570 -0.848 5.680 1.00 41.21 H new ATOM 0 HG23 VAL A 22 -7.301 0.656 6.593 1.00 41.21 H new ATOM 353 N LEU A 23 -8.211 -1.361 10.733 1.00 64.13 N ATOM 354 CA LEU A 23 -8.195 -1.967 12.084 1.00 61.32 C ATOM 355 C LEU A 23 -9.578 -2.495 12.522 1.00 4.43 C ATOM 356 O LEU A 23 -9.689 -3.631 13.001 1.00 3.14 O ATOM 357 CB LEU A 23 -7.683 -0.935 13.123 1.00 54.22 C ATOM 358 CG LEU A 23 -6.211 -0.440 12.953 1.00 52.45 C ATOM 359 CD1 LEU A 23 -5.882 0.645 13.999 1.00 61.34 C ATOM 360 CD2 LEU A 23 -5.202 -1.616 13.011 1.00 34.11 C ATOM 0 H LEU A 23 -7.902 -0.389 10.724 1.00 64.13 H new ATOM 0 HA LEU A 23 -7.521 -2.823 12.036 1.00 61.32 H new ATOM 0 HB2 LEU A 23 -8.340 -0.066 13.092 1.00 54.22 H new ATOM 0 HB3 LEU A 23 -7.782 -1.374 14.116 1.00 54.22 H new ATOM 0 HG LEU A 23 -6.117 0.007 11.963 1.00 52.45 H new ATOM 0 HD11 LEU A 23 -4.853 0.978 13.866 1.00 61.34 H new ATOM 0 HD12 LEU A 23 -6.557 1.491 13.870 1.00 61.34 H new ATOM 0 HD13 LEU A 23 -6.003 0.233 15.001 1.00 61.34 H new ATOM 0 HD21 LEU A 23 -4.189 -1.233 12.889 1.00 34.11 H new ATOM 0 HD22 LEU A 23 -5.286 -2.120 13.974 1.00 34.11 H new ATOM 0 HD23 LEU A 23 -5.421 -2.323 12.211 1.00 34.11 H new ATOM 372 N LYS A 24 -10.631 -1.661 12.355 1.00 41.23 N ATOM 373 CA LYS A 24 -11.992 -1.995 12.830 1.00 21.04 C ATOM 374 C LYS A 24 -12.587 -3.139 11.998 1.00 12.20 C ATOM 375 O LYS A 24 -13.301 -4.000 12.534 1.00 73.11 O ATOM 376 CB LYS A 24 -12.939 -0.755 12.806 1.00 3.15 C ATOM 377 CG LYS A 24 -13.256 -0.191 11.399 1.00 31.43 C ATOM 378 CD LYS A 24 -14.256 0.991 11.431 1.00 60.42 C ATOM 379 CE LYS A 24 -14.449 1.649 10.054 1.00 51.12 C ATOM 380 NZ LYS A 24 -15.320 2.848 10.137 1.00 54.40 N ATOM 0 H LYS A 24 -10.563 -0.753 11.895 1.00 41.23 H new ATOM 0 HA LYS A 24 -11.904 -2.319 13.867 1.00 21.04 H new ATOM 0 HB2 LYS A 24 -13.877 -1.026 13.291 1.00 3.15 H new ATOM 0 HB3 LYS A 24 -12.488 0.037 13.404 1.00 3.15 H new ATOM 0 HG2 LYS A 24 -12.329 0.137 10.928 1.00 31.43 H new ATOM 0 HG3 LYS A 24 -13.664 -0.988 10.778 1.00 31.43 H new ATOM 0 HD2 LYS A 24 -15.219 0.635 11.796 1.00 60.42 H new ATOM 0 HD3 LYS A 24 -13.903 1.740 12.140 1.00 60.42 H new ATOM 0 HE2 LYS A 24 -13.478 1.932 9.646 1.00 51.12 H new ATOM 0 HE3 LYS A 24 -14.887 0.928 9.364 1.00 51.12 H new ATOM 0 HZ1 LYS A 24 -15.428 3.265 9.190 1.00 54.40 H new ATOM 0 HZ2 LYS A 24 -16.254 2.574 10.503 1.00 54.40 H new ATOM 0 HZ3 LYS A 24 -14.889 3.546 10.776 1.00 54.40 H new ATOM 394 N SER A 25 -12.276 -3.139 10.685 1.00 31.13 N ATOM 395 CA SER A 25 -12.758 -4.160 9.747 1.00 13.11 C ATOM 396 C SER A 25 -12.068 -5.504 10.031 1.00 4.14 C ATOM 397 O SER A 25 -12.717 -6.561 9.999 1.00 62.42 O ATOM 398 CB SER A 25 -12.516 -3.702 8.289 1.00 24.11 C ATOM 399 OG SER A 25 -13.196 -2.484 8.019 1.00 51.31 O ATOM 0 H SER A 25 -11.684 -2.430 10.251 1.00 31.13 H new ATOM 0 HA SER A 25 -13.831 -4.295 9.883 1.00 13.11 H new ATOM 0 HB2 SER A 25 -11.447 -3.572 8.117 1.00 24.11 H new ATOM 0 HB3 SER A 25 -12.858 -4.474 7.600 1.00 24.11 H new ATOM 0 HG SER A 25 -12.604 -1.728 8.215 1.00 51.31 H new ATOM 405 N ASP A 26 -10.763 -5.435 10.361 1.00 73.21 N ATOM 406 CA ASP A 26 -9.952 -6.616 10.676 1.00 3.34 C ATOM 407 C ASP A 26 -8.599 -6.182 11.307 1.00 40.30 C ATOM 408 O ASP A 26 -7.768 -5.570 10.620 1.00 71.21 O ATOM 409 CB ASP A 26 -9.717 -7.472 9.401 1.00 20.30 C ATOM 410 CG ASP A 26 -9.115 -8.843 9.725 1.00 31.05 C ATOM 411 OD1 ASP A 26 -9.878 -9.798 9.965 1.00 11.33 O ATOM 412 OD2 ASP A 26 -7.888 -8.971 9.766 1.00 64.45 O ATOM 0 H ASP A 26 -10.247 -4.557 10.415 1.00 73.21 H new ATOM 0 HA ASP A 26 -10.490 -7.229 11.399 1.00 3.34 H new ATOM 0 HB2 ASP A 26 -10.663 -7.608 8.877 1.00 20.30 H new ATOM 0 HB3 ASP A 26 -9.052 -6.936 8.724 1.00 20.30 H new ATOM 417 N PRO A 27 -8.354 -6.484 12.629 1.00 74.53 N ATOM 418 CA PRO A 27 -7.096 -6.102 13.335 1.00 11.32 C ATOM 419 C PRO A 27 -5.910 -7.039 13.020 1.00 44.03 C ATOM 420 O PRO A 27 -4.790 -6.804 13.494 1.00 73.23 O ATOM 421 CB PRO A 27 -7.490 -6.179 14.847 1.00 42.34 C ATOM 422 CG PRO A 27 -8.969 -6.502 14.874 1.00 15.41 C ATOM 423 CD PRO A 27 -9.270 -7.189 13.561 1.00 13.30 C ATOM 0 HA PRO A 27 -6.744 -5.119 13.023 1.00 11.32 H new ATOM 0 HB2 PRO A 27 -6.913 -6.947 15.362 1.00 42.34 H new ATOM 0 HB3 PRO A 27 -7.287 -5.235 15.352 1.00 42.34 H new ATOM 0 HG2 PRO A 27 -9.212 -7.149 15.717 1.00 15.41 H new ATOM 0 HG3 PRO A 27 -9.564 -5.596 14.986 1.00 15.41 H new ATOM 0 HD2 PRO A 27 -9.065 -8.259 13.604 1.00 13.30 H new ATOM 0 HD3 PRO A 27 -10.315 -7.076 13.271 1.00 13.30 H new ATOM 431 N ASN A 28 -6.171 -8.107 12.244 1.00 2.55 N ATOM 432 CA ASN A 28 -5.156 -9.125 11.912 1.00 41.35 C ATOM 433 C ASN A 28 -4.358 -8.693 10.674 1.00 22.12 C ATOM 434 O ASN A 28 -3.202 -9.101 10.518 1.00 50.43 O ATOM 435 CB ASN A 28 -5.807 -10.510 11.662 1.00 35.12 C ATOM 436 CG ASN A 28 -6.783 -10.924 12.760 1.00 74.55 C ATOM 437 OD1 ASN A 28 -6.401 -11.515 13.770 1.00 11.14 O ATOM 438 ND2 ASN A 28 -8.056 -10.617 12.566 1.00 23.22 N ATOM 0 H ASN A 28 -7.086 -8.289 11.831 1.00 2.55 H new ATOM 0 HA ASN A 28 -4.482 -9.215 12.764 1.00 41.35 H new ATOM 0 HB2 ASN A 28 -6.332 -10.490 10.707 1.00 35.12 H new ATOM 0 HB3 ASN A 28 -5.023 -11.263 11.579 1.00 35.12 H new ATOM 0 HD21 ASN A 28 -8.754 -10.871 13.265 1.00 23.22 H new ATOM 0 HD22 ASN A 28 -8.339 -10.127 11.717 1.00 23.22 H new ATOM 445 N VAL A 29 -4.992 -7.879 9.790 1.00 63.13 N ATOM 446 CA VAL A 29 -4.317 -7.305 8.608 1.00 3.41 C ATOM 447 C VAL A 29 -3.103 -6.476 9.076 1.00 5.25 C ATOM 448 O VAL A 29 -3.261 -5.552 9.888 1.00 54.25 O ATOM 449 CB VAL A 29 -5.266 -6.392 7.739 1.00 12.22 C ATOM 450 CG1 VAL A 29 -4.542 -5.915 6.468 1.00 43.45 C ATOM 451 CG2 VAL A 29 -6.580 -7.105 7.360 1.00 14.42 C ATOM 0 H VAL A 29 -5.971 -7.608 9.879 1.00 63.13 H new ATOM 0 HA VAL A 29 -4.006 -8.137 7.976 1.00 3.41 H new ATOM 0 HB VAL A 29 -5.526 -5.530 8.354 1.00 12.22 H new ATOM 0 HG11 VAL A 29 -5.212 -5.287 5.882 1.00 43.45 H new ATOM 0 HG12 VAL A 29 -3.658 -5.341 6.746 1.00 43.45 H new ATOM 0 HG13 VAL A 29 -4.242 -6.779 5.874 1.00 43.45 H new ATOM 0 HG21 VAL A 29 -7.198 -6.435 6.763 1.00 14.42 H new ATOM 0 HG22 VAL A 29 -6.354 -8.002 6.783 1.00 14.42 H new ATOM 0 HG23 VAL A 29 -7.118 -7.383 8.266 1.00 14.42 H new ATOM 461 N LYS A 30 -1.909 -6.821 8.569 1.00 42.11 N ATOM 462 CA LYS A 30 -0.630 -6.327 9.103 1.00 4.41 C ATOM 463 C LYS A 30 -0.377 -4.864 8.681 1.00 54.51 C ATOM 464 O LYS A 30 0.300 -4.602 7.686 1.00 54.40 O ATOM 465 CB LYS A 30 0.528 -7.255 8.631 1.00 62.22 C ATOM 466 CG LYS A 30 1.837 -7.113 9.440 1.00 13.14 C ATOM 467 CD LYS A 30 1.640 -7.539 10.915 1.00 71.14 C ATOM 468 CE LYS A 30 2.917 -7.453 11.753 1.00 33.45 C ATOM 469 NZ LYS A 30 2.659 -7.826 13.173 1.00 35.45 N ATOM 0 H LYS A 30 -1.803 -7.452 7.775 1.00 42.11 H new ATOM 0 HA LYS A 30 -0.674 -6.346 10.192 1.00 4.41 H new ATOM 0 HB2 LYS A 30 0.192 -8.290 8.687 1.00 62.22 H new ATOM 0 HB3 LYS A 30 0.740 -7.045 7.583 1.00 62.22 H new ATOM 0 HG2 LYS A 30 2.616 -7.724 8.984 1.00 13.14 H new ATOM 0 HG3 LYS A 30 2.180 -6.079 9.401 1.00 13.14 H new ATOM 0 HD2 LYS A 30 0.875 -6.908 11.368 1.00 71.14 H new ATOM 0 HD3 LYS A 30 1.266 -8.562 10.942 1.00 71.14 H new ATOM 0 HE2 LYS A 30 3.675 -8.114 11.333 1.00 33.45 H new ATOM 0 HE3 LYS A 30 3.317 -6.440 11.708 1.00 33.45 H new ATOM 0 HZ1 LYS A 30 3.543 -7.758 13.716 1.00 35.45 H new ATOM 0 HZ2 LYS A 30 1.953 -7.179 13.579 1.00 35.45 H new ATOM 0 HZ3 LYS A 30 2.300 -8.801 13.216 1.00 35.45 H new ATOM 483 N THR A 31 -0.965 -3.917 9.419 1.00 14.12 N ATOM 484 CA THR A 31 -0.783 -2.487 9.155 1.00 34.21 C ATOM 485 C THR A 31 0.553 -2.011 9.749 1.00 54.03 C ATOM 486 O THR A 31 0.700 -1.906 10.969 1.00 22.44 O ATOM 487 CB THR A 31 -1.970 -1.642 9.723 1.00 54.44 C ATOM 488 OG1 THR A 31 -2.096 -1.808 11.142 1.00 3.32 O ATOM 489 CG2 THR A 31 -3.303 -2.013 9.066 1.00 2.42 C ATOM 0 H THR A 31 -1.576 -4.118 10.210 1.00 14.12 H new ATOM 0 HA THR A 31 -0.766 -2.341 8.075 1.00 34.21 H new ATOM 0 HB THR A 31 -1.739 -0.601 9.495 1.00 54.44 H new ATOM 0 HG1 THR A 31 -1.223 -2.039 11.523 1.00 3.32 H new ATOM 0 HG21 THR A 31 -4.100 -1.402 9.490 1.00 2.42 H new ATOM 0 HG22 THR A 31 -3.241 -1.835 7.992 1.00 2.42 H new ATOM 0 HG23 THR A 31 -3.517 -3.066 9.247 1.00 2.42 H new ATOM 497 N VAL A 32 1.531 -1.756 8.874 1.00 62.10 N ATOM 498 CA VAL A 32 2.866 -1.284 9.262 1.00 13.31 C ATOM 499 C VAL A 32 3.032 0.150 8.726 1.00 41.20 C ATOM 500 O VAL A 32 3.034 0.367 7.508 1.00 25.42 O ATOM 501 CB VAL A 32 3.989 -2.231 8.676 1.00 45.55 C ATOM 502 CG1 VAL A 32 5.401 -1.787 9.123 1.00 54.01 C ATOM 503 CG2 VAL A 32 3.723 -3.713 9.051 1.00 51.31 C ATOM 0 H VAL A 32 1.418 -1.872 7.867 1.00 62.10 H new ATOM 0 HA VAL A 32 2.967 -1.296 10.347 1.00 13.31 H new ATOM 0 HB VAL A 32 3.951 -2.148 7.590 1.00 45.55 H new ATOM 0 HG11 VAL A 32 6.145 -2.462 8.700 1.00 54.01 H new ATOM 0 HG12 VAL A 32 5.591 -0.772 8.773 1.00 54.01 H new ATOM 0 HG13 VAL A 32 5.463 -1.813 10.211 1.00 54.01 H new ATOM 0 HG21 VAL A 32 4.511 -4.341 8.635 1.00 51.31 H new ATOM 0 HG22 VAL A 32 3.711 -3.817 10.136 1.00 51.31 H new ATOM 0 HG23 VAL A 32 2.760 -4.024 8.646 1.00 51.31 H new ATOM 513 N ARG A 33 3.127 1.131 9.645 1.00 73.44 N ATOM 514 CA ARG A 33 3.252 2.557 9.296 1.00 55.43 C ATOM 515 C ARG A 33 4.723 2.960 9.448 1.00 54.00 C ATOM 516 O ARG A 33 5.167 3.337 10.542 1.00 61.53 O ATOM 517 CB ARG A 33 2.339 3.465 10.192 1.00 63.32 C ATOM 518 CG ARG A 33 0.820 3.192 10.095 1.00 35.05 C ATOM 519 CD ARG A 33 0.382 1.907 10.806 1.00 3.41 C ATOM 520 NE ARG A 33 0.542 2.026 12.261 1.00 55.34 N ATOM 521 CZ ARG A 33 0.201 1.100 13.164 1.00 65.24 C ATOM 522 NH1 ARG A 33 -0.341 -0.057 12.798 1.00 22.40 N ATOM 523 NH2 ARG A 33 0.399 1.347 14.448 1.00 13.35 N ATOM 0 H ARG A 33 3.119 0.955 10.650 1.00 73.44 H new ATOM 0 HA ARG A 33 2.920 2.700 8.268 1.00 55.43 H new ATOM 0 HB2 ARG A 33 2.646 3.344 11.231 1.00 63.32 H new ATOM 0 HB3 ARG A 33 2.520 4.506 9.925 1.00 63.32 H new ATOM 0 HG2 ARG A 33 0.279 4.036 10.522 1.00 35.05 H new ATOM 0 HG3 ARG A 33 0.536 3.131 9.044 1.00 35.05 H new ATOM 0 HD2 ARG A 33 -0.660 1.693 10.568 1.00 3.41 H new ATOM 0 HD3 ARG A 33 0.971 1.066 10.440 1.00 3.41 H new ATOM 0 HE ARG A 33 0.949 2.892 12.614 1.00 55.34 H new ATOM 0 HH11 ARG A 33 -0.505 -0.254 11.811 1.00 22.40 H new ATOM 0 HH12 ARG A 33 -0.593 -0.748 13.504 1.00 22.40 H new ATOM 0 HH21 ARG A 33 0.807 2.235 14.739 1.00 13.35 H new ATOM 0 HH22 ARG A 33 0.143 0.649 15.147 1.00 13.35 H new ATOM 537 N THR A 34 5.455 2.851 8.337 1.00 24.34 N ATOM 538 CA THR A 34 6.881 3.199 8.240 1.00 13.22 C ATOM 539 C THR A 34 7.380 2.871 6.831 1.00 32.13 C ATOM 540 O THR A 34 6.785 2.057 6.109 1.00 72.42 O ATOM 541 CB THR A 34 7.803 2.455 9.302 1.00 22.41 C ATOM 542 OG1 THR A 34 9.139 2.997 9.277 1.00 42.31 O ATOM 543 CG2 THR A 34 7.862 0.922 9.079 1.00 33.31 C ATOM 0 H THR A 34 5.067 2.511 7.457 1.00 24.34 H new ATOM 0 HA THR A 34 6.955 4.265 8.457 1.00 13.22 H new ATOM 0 HB THR A 34 7.349 2.626 10.278 1.00 22.41 H new ATOM 0 HG1 THR A 34 9.694 2.531 9.937 1.00 42.31 H new ATOM 0 HG21 THR A 34 8.506 0.469 9.833 1.00 33.31 H new ATOM 0 HG22 THR A 34 6.859 0.504 9.160 1.00 33.31 H new ATOM 0 HG23 THR A 34 8.263 0.714 8.087 1.00 33.31 H new ATOM 551 N ASP A 35 8.473 3.527 6.458 1.00 33.31 N ATOM 552 CA ASP A 35 9.283 3.167 5.297 1.00 43.45 C ATOM 553 C ASP A 35 10.750 3.413 5.660 1.00 14.51 C ATOM 554 O ASP A 35 11.212 4.557 5.723 1.00 12.32 O ATOM 555 CB ASP A 35 8.859 3.953 4.032 1.00 11.13 C ATOM 556 CG ASP A 35 9.757 3.710 2.795 1.00 30.52 C ATOM 557 OD1 ASP A 35 10.180 2.555 2.558 1.00 50.11 O ATOM 558 OD2 ASP A 35 10.059 4.690 2.085 1.00 0.00 O ATOM 0 H ASP A 35 8.829 4.339 6.962 1.00 33.31 H new ATOM 0 HA ASP A 35 9.134 2.116 5.050 1.00 43.45 H new ATOM 0 HB2 ASP A 35 7.833 3.684 3.779 1.00 11.13 H new ATOM 0 HB3 ASP A 35 8.861 5.018 4.264 1.00 11.13 H new ATOM 563 N ASP A 36 11.443 2.316 5.975 1.00 13.25 N ATOM 564 CA ASP A 36 12.882 2.302 6.272 1.00 4.40 C ATOM 565 C ASP A 36 13.614 1.555 5.130 1.00 55.14 C ATOM 566 O ASP A 36 14.744 1.090 5.285 1.00 71.24 O ATOM 567 CB ASP A 36 13.085 1.651 7.672 1.00 53.00 C ATOM 568 CG ASP A 36 14.551 1.562 8.151 1.00 55.21 C ATOM 569 OD1 ASP A 36 15.122 2.596 8.546 1.00 21.14 O ATOM 570 OD2 ASP A 36 15.137 0.457 8.133 1.00 20.44 O ATOM 0 H ASP A 36 11.013 1.393 6.033 1.00 13.25 H new ATOM 0 HA ASP A 36 13.306 3.305 6.318 1.00 4.40 H new ATOM 0 HB2 ASP A 36 12.514 2.220 8.406 1.00 53.00 H new ATOM 0 HB3 ASP A 36 12.665 0.645 7.652 1.00 53.00 H new ATOM 575 N LYS A 37 12.931 1.483 3.954 1.00 62.21 N ATOM 576 CA LYS A 37 13.457 0.916 2.699 1.00 30.21 C ATOM 577 C LYS A 37 13.729 -0.602 2.841 1.00 1.43 C ATOM 578 O LYS A 37 12.879 -1.421 2.467 1.00 51.45 O ATOM 579 CB LYS A 37 14.714 1.700 2.209 1.00 24.30 C ATOM 580 CG LYS A 37 14.523 3.241 2.142 1.00 52.41 C ATOM 581 CD LYS A 37 15.692 3.952 1.429 1.00 23.04 C ATOM 582 CE LYS A 37 15.830 3.514 -0.040 1.00 2.24 C ATOM 583 NZ LYS A 37 17.028 4.093 -0.690 1.00 74.43 N ATOM 0 H LYS A 37 11.976 1.829 3.860 1.00 62.21 H new ATOM 0 HA LYS A 37 12.693 1.030 1.930 1.00 30.21 H new ATOM 0 HB2 LYS A 37 15.548 1.478 2.875 1.00 24.30 H new ATOM 0 HB3 LYS A 37 14.991 1.337 1.219 1.00 24.30 H new ATOM 0 HG2 LYS A 37 13.593 3.466 1.620 1.00 52.41 H new ATOM 0 HG3 LYS A 37 14.425 3.636 3.153 1.00 52.41 H new ATOM 0 HD2 LYS A 37 15.540 5.030 1.472 1.00 23.04 H new ATOM 0 HD3 LYS A 37 16.621 3.740 1.958 1.00 23.04 H new ATOM 0 HE2 LYS A 37 15.883 2.426 -0.089 1.00 2.24 H new ATOM 0 HE3 LYS A 37 14.939 3.815 -0.592 1.00 2.24 H new ATOM 0 HZ1 LYS A 37 17.078 3.770 -1.677 1.00 74.43 H new ATOM 0 HZ2 LYS A 37 16.967 5.131 -0.668 1.00 74.43 H new ATOM 0 HZ3 LYS A 37 17.882 3.786 -0.181 1.00 74.43 H new ATOM 597 N GLU A 38 14.892 -0.959 3.449 1.00 12.44 N ATOM 598 CA GLU A 38 15.306 -2.361 3.669 1.00 4.23 C ATOM 599 C GLU A 38 14.308 -3.097 4.585 1.00 60.42 C ATOM 600 O GLU A 38 14.019 -4.273 4.370 1.00 75.13 O ATOM 601 CB GLU A 38 16.738 -2.428 4.286 1.00 10.35 C ATOM 602 CG GLU A 38 16.883 -1.754 5.675 1.00 64.33 C ATOM 603 CD GLU A 38 18.279 -1.920 6.308 1.00 75.42 C ATOM 604 OE1 GLU A 38 18.591 -3.029 6.790 1.00 40.33 O ATOM 605 OE2 GLU A 38 19.069 -0.952 6.321 1.00 13.21 O ATOM 0 H GLU A 38 15.566 -0.278 3.799 1.00 12.44 H new ATOM 0 HA GLU A 38 15.317 -2.856 2.698 1.00 4.23 H new ATOM 0 HB2 GLU A 38 17.031 -3.474 4.374 1.00 10.35 H new ATOM 0 HB3 GLU A 38 17.438 -1.957 3.595 1.00 10.35 H new ATOM 0 HG2 GLU A 38 16.664 -0.691 5.577 1.00 64.33 H new ATOM 0 HG3 GLU A 38 16.137 -2.172 6.350 1.00 64.33 H new ATOM 612 N LYS A 39 13.769 -2.369 5.578 1.00 24.04 N ATOM 613 CA LYS A 39 12.860 -2.923 6.589 1.00 31.40 C ATOM 614 C LYS A 39 11.539 -3.419 5.984 1.00 54.14 C ATOM 615 O LYS A 39 10.984 -4.406 6.437 1.00 33.05 O ATOM 616 CB LYS A 39 12.593 -1.867 7.676 1.00 70.42 C ATOM 617 CG LYS A 39 11.579 -2.304 8.754 1.00 40.23 C ATOM 618 CD LYS A 39 11.617 -1.427 10.016 1.00 33.22 C ATOM 619 CE LYS A 39 10.626 -1.923 11.073 1.00 13.35 C ATOM 620 NZ LYS A 39 10.792 -3.374 11.371 1.00 52.14 N ATOM 0 H LYS A 39 13.955 -1.374 5.700 1.00 24.04 H new ATOM 0 HA LYS A 39 13.347 -3.792 7.031 1.00 31.40 H new ATOM 0 HB2 LYS A 39 13.536 -1.617 8.162 1.00 70.42 H new ATOM 0 HB3 LYS A 39 12.229 -0.957 7.200 1.00 70.42 H new ATOM 0 HG2 LYS A 39 10.575 -2.276 8.331 1.00 40.23 H new ATOM 0 HG3 LYS A 39 11.779 -3.339 9.033 1.00 40.23 H new ATOM 0 HD2 LYS A 39 12.625 -1.428 10.431 1.00 33.22 H new ATOM 0 HD3 LYS A 39 11.383 -0.396 9.751 1.00 33.22 H new ATOM 0 HE2 LYS A 39 10.759 -1.349 11.990 1.00 13.35 H new ATOM 0 HE3 LYS A 39 9.609 -1.740 10.728 1.00 13.35 H new ATOM 0 HZ1 LYS A 39 10.634 -3.540 12.385 1.00 52.14 H new ATOM 0 HZ2 LYS A 39 10.103 -3.923 10.819 1.00 52.14 H new ATOM 0 HZ3 LYS A 39 11.755 -3.673 11.117 1.00 52.14 H new ATOM 634 N VAL A 40 11.059 -2.746 4.937 1.00 53.33 N ATOM 635 CA VAL A 40 9.792 -3.119 4.282 1.00 22.53 C ATOM 636 C VAL A 40 9.879 -4.570 3.724 1.00 32.12 C ATOM 637 O VAL A 40 8.890 -5.289 3.706 1.00 2.22 O ATOM 638 CB VAL A 40 9.371 -2.078 3.184 1.00 51.21 C ATOM 639 CG1 VAL A 40 7.925 -2.340 2.688 1.00 20.13 C ATOM 640 CG2 VAL A 40 9.525 -0.626 3.723 1.00 44.34 C ATOM 0 H VAL A 40 11.524 -1.939 4.520 1.00 53.33 H new ATOM 0 HA VAL A 40 9.001 -3.099 5.032 1.00 22.53 H new ATOM 0 HB VAL A 40 10.037 -2.197 2.329 1.00 51.21 H new ATOM 0 HG11 VAL A 40 7.662 -1.604 1.929 1.00 20.13 H new ATOM 0 HG12 VAL A 40 7.863 -3.341 2.260 1.00 20.13 H new ATOM 0 HG13 VAL A 40 7.233 -2.260 3.526 1.00 20.13 H new ATOM 0 HG21 VAL A 40 9.229 0.083 2.949 1.00 44.34 H new ATOM 0 HG22 VAL A 40 8.890 -0.494 4.599 1.00 44.34 H new ATOM 0 HG23 VAL A 40 10.564 -0.449 3.999 1.00 44.34 H new ATOM 650 N LYS A 41 11.108 -4.988 3.326 1.00 32.32 N ATOM 651 CA LYS A 41 11.393 -6.365 2.846 1.00 25.10 C ATOM 652 C LYS A 41 11.185 -7.415 3.970 1.00 1.22 C ATOM 653 O LYS A 41 10.644 -8.496 3.700 1.00 10.01 O ATOM 654 CB LYS A 41 12.837 -6.506 2.256 1.00 14.41 C ATOM 655 CG LYS A 41 13.083 -5.795 0.900 1.00 43.41 C ATOM 656 CD LYS A 41 13.043 -4.255 0.998 1.00 73.31 C ATOM 657 CE LYS A 41 13.254 -3.555 -0.349 1.00 13.04 C ATOM 658 NZ LYS A 41 14.578 -3.848 -0.948 1.00 13.32 N ATOM 0 H LYS A 41 11.928 -4.381 3.329 1.00 32.32 H new ATOM 0 HA LYS A 41 10.680 -6.557 2.044 1.00 25.10 H new ATOM 0 HB2 LYS A 41 13.547 -6.114 2.984 1.00 14.41 H new ATOM 0 HB3 LYS A 41 13.058 -7.566 2.134 1.00 14.41 H new ATOM 0 HG2 LYS A 41 14.053 -6.101 0.508 1.00 43.41 H new ATOM 0 HG3 LYS A 41 12.331 -6.126 0.183 1.00 43.41 H new ATOM 0 HD2 LYS A 41 12.082 -3.949 1.412 1.00 73.31 H new ATOM 0 HD3 LYS A 41 13.811 -3.922 1.696 1.00 73.31 H new ATOM 0 HE2 LYS A 41 12.471 -3.865 -1.041 1.00 13.04 H new ATOM 0 HE3 LYS A 41 13.152 -2.478 -0.214 1.00 13.04 H new ATOM 0 HZ1 LYS A 41 14.693 -3.297 -1.822 1.00 13.32 H new ATOM 0 HZ2 LYS A 41 15.328 -3.591 -0.275 1.00 13.32 H new ATOM 0 HZ3 LYS A 41 14.643 -4.862 -1.168 1.00 13.32 H new ATOM 672 N GLU A 42 11.617 -7.107 5.228 1.00 41.13 N ATOM 673 CA GLU A 42 11.421 -8.041 6.371 1.00 24.13 C ATOM 674 C GLU A 42 9.923 -8.145 6.705 1.00 21.24 C ATOM 675 O GLU A 42 9.448 -9.197 7.126 1.00 33.41 O ATOM 676 CB GLU A 42 12.253 -7.662 7.652 1.00 24.45 C ATOM 677 CG GLU A 42 11.733 -6.447 8.457 1.00 61.00 C ATOM 678 CD GLU A 42 12.309 -6.304 9.877 1.00 21.33 C ATOM 679 OE1 GLU A 42 12.141 -7.241 10.678 1.00 4.22 O ATOM 680 OE2 GLU A 42 12.861 -5.237 10.224 1.00 60.45 O ATOM 0 H GLU A 42 12.093 -6.238 5.470 1.00 41.13 H new ATOM 0 HA GLU A 42 11.801 -9.011 6.052 1.00 24.13 H new ATOM 0 HB2 GLU A 42 12.280 -8.528 8.314 1.00 24.45 H new ATOM 0 HB3 GLU A 42 13.280 -7.460 7.349 1.00 24.45 H new ATOM 0 HG2 GLU A 42 11.958 -5.539 7.898 1.00 61.00 H new ATOM 0 HG3 GLU A 42 10.648 -6.517 8.528 1.00 61.00 H new ATOM 687 N GLU A 43 9.189 -7.035 6.478 1.00 63.14 N ATOM 688 CA GLU A 43 7.735 -6.965 6.695 1.00 61.22 C ATOM 689 C GLU A 43 6.983 -7.822 5.648 1.00 32.04 C ATOM 690 O GLU A 43 5.980 -8.473 5.966 1.00 45.42 O ATOM 691 CB GLU A 43 7.256 -5.489 6.642 1.00 0.13 C ATOM 692 CG GLU A 43 7.945 -4.525 7.636 1.00 12.42 C ATOM 693 CD GLU A 43 7.909 -4.989 9.108 1.00 13.13 C ATOM 694 OE1 GLU A 43 6.838 -5.421 9.592 1.00 33.41 O ATOM 695 OE2 GLU A 43 8.961 -4.927 9.791 1.00 3.25 O ATOM 0 H GLU A 43 9.593 -6.162 6.138 1.00 63.14 H new ATOM 0 HA GLU A 43 7.512 -7.367 7.683 1.00 61.22 H new ATOM 0 HB2 GLU A 43 7.412 -5.112 5.631 1.00 0.13 H new ATOM 0 HB3 GLU A 43 6.182 -5.468 6.828 1.00 0.13 H new ATOM 0 HG2 GLU A 43 8.984 -4.395 7.335 1.00 12.42 H new ATOM 0 HG3 GLU A 43 7.468 -3.548 7.565 1.00 12.42 H new ATOM 702 N ILE A 44 7.494 -7.810 4.393 1.00 0.21 N ATOM 703 CA ILE A 44 6.988 -8.650 3.282 1.00 31.30 C ATOM 704 C ILE A 44 7.229 -10.150 3.590 1.00 62.12 C ATOM 705 O ILE A 44 6.387 -11.009 3.274 1.00 3.03 O ATOM 706 CB ILE A 44 7.673 -8.242 1.910 1.00 62.42 C ATOM 707 CG1 ILE A 44 7.253 -6.797 1.478 1.00 32.01 C ATOM 708 CG2 ILE A 44 7.372 -9.253 0.774 1.00 51.51 C ATOM 709 CD1 ILE A 44 7.947 -6.290 0.224 1.00 51.34 C ATOM 0 H ILE A 44 8.275 -7.212 4.122 1.00 0.21 H new ATOM 0 HA ILE A 44 5.915 -8.484 3.185 1.00 31.30 H new ATOM 0 HB ILE A 44 8.749 -8.258 2.083 1.00 62.42 H new ATOM 0 HG12 ILE A 44 6.175 -6.778 1.315 1.00 32.01 H new ATOM 0 HG13 ILE A 44 7.463 -6.110 2.298 1.00 32.01 H new ATOM 0 HG21 ILE A 44 7.864 -8.927 -0.143 1.00 51.51 H new ATOM 0 HG22 ILE A 44 7.744 -10.238 1.055 1.00 51.51 H new ATOM 0 HG23 ILE A 44 6.296 -9.306 0.609 1.00 51.51 H new ATOM 0 HD11 ILE A 44 7.598 -5.283 -0.003 1.00 51.34 H new ATOM 0 HD12 ILE A 44 9.025 -6.272 0.386 1.00 51.34 H new ATOM 0 HD13 ILE A 44 7.717 -6.951 -0.612 1.00 51.34 H new ATOM 721 N GLU A 45 8.376 -10.436 4.251 1.00 71.13 N ATOM 722 CA GLU A 45 8.760 -11.801 4.660 1.00 12.25 C ATOM 723 C GLU A 45 7.759 -12.348 5.687 1.00 70.24 C ATOM 724 O GLU A 45 7.288 -13.482 5.570 1.00 51.21 O ATOM 725 CB GLU A 45 10.207 -11.828 5.229 1.00 31.24 C ATOM 726 CG GLU A 45 10.753 -13.248 5.484 1.00 13.34 C ATOM 727 CD GLU A 45 12.155 -13.275 6.107 1.00 63.21 C ATOM 728 OE1 GLU A 45 13.126 -12.887 5.420 1.00 4.14 O ATOM 729 OE2 GLU A 45 12.298 -13.688 7.279 1.00 23.51 O ATOM 0 H GLU A 45 9.058 -9.725 4.514 1.00 71.13 H new ATOM 0 HA GLU A 45 8.739 -12.442 3.779 1.00 12.25 H new ATOM 0 HB2 GLU A 45 10.870 -11.314 4.533 1.00 31.24 H new ATOM 0 HB3 GLU A 45 10.230 -11.268 6.164 1.00 31.24 H new ATOM 0 HG2 GLU A 45 10.064 -13.778 6.142 1.00 13.34 H new ATOM 0 HG3 GLU A 45 10.776 -13.792 4.540 1.00 13.34 H new ATOM 736 N LYS A 46 7.412 -11.490 6.661 1.00 54.22 N ATOM 737 CA LYS A 46 6.407 -11.798 7.689 1.00 62.30 C ATOM 738 C LYS A 46 5.028 -12.021 7.041 1.00 34.40 C ATOM 739 O LYS A 46 4.320 -12.941 7.410 1.00 43.54 O ATOM 740 CB LYS A 46 6.334 -10.641 8.720 1.00 24.04 C ATOM 741 CG LYS A 46 7.659 -10.385 9.467 1.00 4.13 C ATOM 742 CD LYS A 46 7.660 -9.044 10.246 1.00 70.23 C ATOM 743 CE LYS A 46 9.059 -8.683 10.759 1.00 54.22 C ATOM 744 NZ LYS A 46 9.123 -7.322 11.339 1.00 2.51 N ATOM 0 H LYS A 46 7.822 -10.561 6.757 1.00 54.22 H new ATOM 0 HA LYS A 46 6.700 -12.713 8.203 1.00 62.30 H new ATOM 0 HB2 LYS A 46 6.036 -9.727 8.206 1.00 24.04 H new ATOM 0 HB3 LYS A 46 5.555 -10.865 9.449 1.00 24.04 H new ATOM 0 HG2 LYS A 46 7.843 -11.204 10.162 1.00 4.13 H new ATOM 0 HG3 LYS A 46 8.481 -10.384 8.751 1.00 4.13 H new ATOM 0 HD2 LYS A 46 7.294 -8.247 9.598 1.00 70.23 H new ATOM 0 HD3 LYS A 46 6.971 -9.112 11.088 1.00 70.23 H new ATOM 0 HE2 LYS A 46 9.363 -9.409 11.513 1.00 54.22 H new ATOM 0 HE3 LYS A 46 9.773 -8.757 9.938 1.00 54.22 H new ATOM 0 HZ1 LYS A 46 9.999 -7.221 11.891 1.00 2.51 H new ATOM 0 HZ2 LYS A 46 9.113 -6.618 10.574 1.00 2.51 H new ATOM 0 HZ3 LYS A 46 8.303 -7.170 11.960 1.00 2.51 H new ATOM 758 N ALA A 47 4.700 -11.189 6.031 1.00 2.21 N ATOM 759 CA ALA A 47 3.367 -11.156 5.397 1.00 44.21 C ATOM 760 C ALA A 47 3.029 -12.455 4.647 1.00 15.24 C ATOM 761 O ALA A 47 1.912 -12.970 4.777 1.00 34.10 O ATOM 762 CB ALA A 47 3.262 -9.948 4.460 1.00 74.04 C ATOM 0 H ALA A 47 5.356 -10.518 5.631 1.00 2.21 H new ATOM 0 HA ALA A 47 2.633 -11.062 6.197 1.00 44.21 H new ATOM 0 HB1 ALA A 47 2.276 -9.932 3.997 1.00 74.04 H new ATOM 0 HB2 ALA A 47 3.410 -9.031 5.030 1.00 74.04 H new ATOM 0 HB3 ALA A 47 4.025 -10.021 3.685 1.00 74.04 H new ATOM 768 N ARG A 48 4.002 -12.986 3.878 1.00 61.34 N ATOM 769 CA ARG A 48 3.813 -14.248 3.138 1.00 63.44 C ATOM 770 C ARG A 48 3.830 -15.457 4.097 1.00 71.53 C ATOM 771 O ARG A 48 3.192 -16.479 3.828 1.00 51.14 O ATOM 772 CB ARG A 48 4.869 -14.420 2.012 1.00 42.44 C ATOM 773 CG ARG A 48 6.343 -14.580 2.455 1.00 44.22 C ATOM 774 CD ARG A 48 7.257 -14.997 1.282 1.00 14.24 C ATOM 775 NE ARG A 48 6.789 -16.245 0.641 1.00 43.40 N ATOM 776 CZ ARG A 48 7.424 -16.932 -0.322 1.00 1.50 C ATOM 777 NH1 ARG A 48 8.592 -16.529 -0.809 1.00 64.04 N ATOM 778 NH2 ARG A 48 6.868 -18.034 -0.797 1.00 72.14 N ATOM 0 H ARG A 48 4.921 -12.562 3.754 1.00 61.34 H new ATOM 0 HA ARG A 48 2.834 -14.202 2.662 1.00 63.44 H new ATOM 0 HB2 ARG A 48 4.595 -15.294 1.421 1.00 42.44 H new ATOM 0 HB3 ARG A 48 4.805 -13.555 1.351 1.00 42.44 H new ATOM 0 HG2 ARG A 48 6.699 -13.640 2.876 1.00 44.22 H new ATOM 0 HG3 ARG A 48 6.405 -15.327 3.246 1.00 44.22 H new ATOM 0 HD2 ARG A 48 7.287 -14.197 0.542 1.00 14.24 H new ATOM 0 HD3 ARG A 48 8.276 -15.134 1.645 1.00 14.24 H new ATOM 0 HE ARG A 48 5.897 -16.620 0.962 1.00 43.40 H new ATOM 0 HH11 ARG A 48 9.028 -15.679 -0.451 1.00 64.04 H new ATOM 0 HH12 ARG A 48 9.053 -17.070 -1.541 1.00 64.04 H new ATOM 0 HH21 ARG A 48 5.970 -18.350 -0.432 1.00 72.14 H new ATOM 0 HH22 ARG A 48 7.337 -18.567 -1.529 1.00 72.14 H new ATOM 792 N LYS A 49 4.560 -15.306 5.221 1.00 63.24 N ATOM 793 CA LYS A 49 4.742 -16.368 6.231 1.00 30.43 C ATOM 794 C LYS A 49 3.445 -16.575 7.051 1.00 20.53 C ATOM 795 O LYS A 49 2.994 -17.711 7.248 1.00 13.32 O ATOM 796 CB LYS A 49 5.939 -16.008 7.155 1.00 25.02 C ATOM 797 CG LYS A 49 6.379 -17.131 8.120 1.00 44.23 C ATOM 798 CD LYS A 49 7.651 -16.775 8.933 1.00 72.43 C ATOM 799 CE LYS A 49 8.891 -16.517 8.054 1.00 62.05 C ATOM 800 NZ LYS A 49 10.118 -16.291 8.865 1.00 65.43 N ATOM 0 H LYS A 49 5.043 -14.438 5.455 1.00 63.24 H new ATOM 0 HA LYS A 49 4.962 -17.308 5.725 1.00 30.43 H new ATOM 0 HB2 LYS A 49 6.789 -15.731 6.532 1.00 25.02 H new ATOM 0 HB3 LYS A 49 5.674 -15.128 7.742 1.00 25.02 H new ATOM 0 HG2 LYS A 49 5.564 -17.348 8.810 1.00 44.23 H new ATOM 0 HG3 LYS A 49 6.564 -18.041 7.548 1.00 44.23 H new ATOM 0 HD2 LYS A 49 7.451 -15.888 9.535 1.00 72.43 H new ATOM 0 HD3 LYS A 49 7.869 -17.588 9.626 1.00 72.43 H new ATOM 0 HE2 LYS A 49 9.048 -17.368 7.391 1.00 62.05 H new ATOM 0 HE3 LYS A 49 8.711 -15.648 7.421 1.00 62.05 H new ATOM 0 HZ1 LYS A 49 10.926 -16.122 8.232 1.00 65.43 H new ATOM 0 HZ2 LYS A 49 9.980 -15.463 9.480 1.00 65.43 H new ATOM 0 HZ3 LYS A 49 10.306 -17.130 9.451 1.00 65.43 H new ATOM 814 N GLN A 50 2.848 -15.454 7.502 1.00 13.54 N ATOM 815 CA GLN A 50 1.561 -15.445 8.227 1.00 22.44 C ATOM 816 C GLN A 50 0.383 -15.641 7.255 1.00 43.14 C ATOM 817 O GLN A 50 -0.706 -16.049 7.669 1.00 75.52 O ATOM 818 CB GLN A 50 1.398 -14.118 9.022 1.00 15.53 C ATOM 819 CG GLN A 50 1.271 -12.844 8.165 1.00 74.15 C ATOM 820 CD GLN A 50 1.207 -11.551 8.982 1.00 72.14 C ATOM 821 OE1 GLN A 50 0.693 -11.520 10.100 1.00 14.21 O ATOM 822 NE2 GLN A 50 1.732 -10.472 8.434 1.00 24.52 N ATOM 0 H GLN A 50 3.247 -14.524 7.373 1.00 13.54 H new ATOM 0 HA GLN A 50 1.559 -16.276 8.932 1.00 22.44 H new ATOM 0 HB2 GLN A 50 0.514 -14.200 9.654 1.00 15.53 H new ATOM 0 HB3 GLN A 50 2.255 -14.005 9.686 1.00 15.53 H new ATOM 0 HG2 GLN A 50 2.120 -12.790 7.484 1.00 74.15 H new ATOM 0 HG3 GLN A 50 0.374 -12.919 7.551 1.00 74.15 H new ATOM 0 HE21 GLN A 50 2.152 -10.524 7.506 1.00 24.52 H new ATOM 0 HE22 GLN A 50 1.718 -9.586 8.938 1.00 24.52 H new ATOM 831 N GLY A 51 0.628 -15.339 5.960 1.00 1.12 N ATOM 832 CA GLY A 51 -0.371 -15.492 4.903 1.00 4.13 C ATOM 833 C GLY A 51 -1.476 -14.445 4.959 1.00 34.31 C ATOM 834 O GLY A 51 -2.601 -14.704 4.530 1.00 23.15 O ATOM 0 H GLY A 51 1.525 -14.984 5.629 1.00 1.12 H new ATOM 0 HA2 GLY A 51 0.125 -15.435 3.934 1.00 4.13 H new ATOM 0 HA3 GLY A 51 -0.817 -16.484 4.975 1.00 4.13 H new ATOM 838 N ARG A 52 -1.148 -13.256 5.480 1.00 4.14 N ATOM 839 CA ARG A 52 -2.103 -12.140 5.626 1.00 10.41 C ATOM 840 C ARG A 52 -1.706 -10.985 4.686 1.00 55.51 C ATOM 841 O ARG A 52 -0.515 -10.847 4.351 1.00 75.34 O ATOM 842 CB ARG A 52 -2.120 -11.620 7.090 1.00 23.54 C ATOM 843 CG ARG A 52 -2.556 -12.652 8.150 1.00 52.11 C ATOM 844 CD ARG A 52 -2.559 -12.044 9.558 1.00 33.33 C ATOM 845 NE ARG A 52 -3.017 -12.978 10.595 1.00 33.02 N ATOM 846 CZ ARG A 52 -2.935 -12.742 11.914 1.00 62.15 C ATOM 847 NH1 ARG A 52 -2.404 -11.609 12.367 1.00 52.33 N ATOM 848 NH2 ARG A 52 -3.406 -13.631 12.774 1.00 34.13 N ATOM 0 H ARG A 52 -0.210 -13.036 5.815 1.00 4.14 H new ATOM 0 HA ARG A 52 -3.097 -12.505 5.366 1.00 10.41 H new ATOM 0 HB2 ARG A 52 -1.122 -11.263 7.343 1.00 23.54 H new ATOM 0 HB3 ARG A 52 -2.789 -10.761 7.146 1.00 23.54 H new ATOM 0 HG2 ARG A 52 -3.553 -13.022 7.910 1.00 52.11 H new ATOM 0 HG3 ARG A 52 -1.883 -13.509 8.124 1.00 52.11 H new ATOM 0 HD2 ARG A 52 -1.552 -11.707 9.802 1.00 33.33 H new ATOM 0 HD3 ARG A 52 -3.200 -11.163 9.564 1.00 33.33 H new ATOM 0 HE ARG A 52 -3.424 -13.863 10.293 1.00 33.02 H new ATOM 0 HH11 ARG A 52 -2.055 -10.911 11.710 1.00 52.33 H new ATOM 0 HH12 ARG A 52 -2.346 -11.439 13.371 1.00 52.33 H new ATOM 0 HH21 ARG A 52 -3.831 -14.494 12.434 1.00 34.13 H new ATOM 0 HH22 ARG A 52 -3.344 -13.453 13.776 1.00 34.13 H new ATOM 862 N PRO A 53 -2.691 -10.138 4.239 1.00 0.33 N ATOM 863 CA PRO A 53 -2.377 -8.873 3.542 1.00 5.22 C ATOM 864 C PRO A 53 -1.664 -7.875 4.491 1.00 25.40 C ATOM 865 O PRO A 53 -1.933 -7.851 5.701 1.00 24.50 O ATOM 866 CB PRO A 53 -3.771 -8.355 3.077 1.00 60.42 C ATOM 867 CG PRO A 53 -4.755 -8.994 4.020 1.00 41.44 C ATOM 868 CD PRO A 53 -4.167 -10.353 4.359 1.00 71.24 C ATOM 0 HA PRO A 53 -1.688 -9.001 2.707 1.00 5.22 H new ATOM 0 HB2 PRO A 53 -3.825 -7.267 3.127 1.00 60.42 H new ATOM 0 HB3 PRO A 53 -3.973 -8.637 2.044 1.00 60.42 H new ATOM 0 HG2 PRO A 53 -4.889 -8.389 4.917 1.00 41.44 H new ATOM 0 HG3 PRO A 53 -5.736 -9.095 3.555 1.00 41.44 H new ATOM 0 HD2 PRO A 53 -4.445 -10.671 5.364 1.00 71.24 H new ATOM 0 HD3 PRO A 53 -4.517 -11.124 3.672 1.00 71.24 H new ATOM 876 N ILE A 54 -0.743 -7.080 3.938 1.00 61.35 N ATOM 877 CA ILE A 54 0.046 -6.097 4.701 1.00 3.04 C ATOM 878 C ILE A 54 -0.204 -4.686 4.141 1.00 11.54 C ATOM 879 O ILE A 54 -0.097 -4.466 2.933 1.00 54.32 O ATOM 880 CB ILE A 54 1.582 -6.459 4.678 1.00 31.41 C ATOM 881 CG1 ILE A 54 2.423 -5.379 5.428 1.00 63.45 C ATOM 882 CG2 ILE A 54 2.103 -6.685 3.237 1.00 12.53 C ATOM 883 CD1 ILE A 54 3.903 -5.673 5.507 1.00 52.22 C ATOM 0 H ILE A 54 -0.520 -7.097 2.943 1.00 61.35 H new ATOM 0 HA ILE A 54 -0.274 -6.121 5.743 1.00 3.04 H new ATOM 0 HB ILE A 54 1.701 -7.404 5.208 1.00 31.41 H new ATOM 0 HG12 ILE A 54 2.283 -4.419 4.930 1.00 63.45 H new ATOM 0 HG13 ILE A 54 2.033 -5.273 6.440 1.00 63.45 H new ATOM 0 HG21 ILE A 54 3.164 -6.932 3.268 1.00 12.53 H new ATOM 0 HG22 ILE A 54 1.553 -7.505 2.776 1.00 12.53 H new ATOM 0 HG23 ILE A 54 1.959 -5.777 2.651 1.00 12.53 H new ATOM 0 HD11 ILE A 54 4.405 -4.869 6.045 1.00 52.22 H new ATOM 0 HD12 ILE A 54 4.059 -6.615 6.033 1.00 52.22 H new ATOM 0 HD13 ILE A 54 4.313 -5.748 4.500 1.00 52.22 H new ATOM 895 N VAL A 55 -0.563 -3.735 5.028 1.00 5.54 N ATOM 896 CA VAL A 55 -0.894 -2.360 4.634 1.00 64.23 C ATOM 897 C VAL A 55 0.222 -1.398 5.065 1.00 1.54 C ATOM 898 O VAL A 55 0.399 -1.149 6.265 1.00 63.43 O ATOM 899 CB VAL A 55 -2.269 -1.870 5.235 1.00 23.52 C ATOM 900 CG1 VAL A 55 -2.785 -0.646 4.462 1.00 5.50 C ATOM 901 CG2 VAL A 55 -3.326 -2.983 5.240 1.00 55.31 C ATOM 0 H VAL A 55 -0.630 -3.903 6.032 1.00 5.54 H new ATOM 0 HA VAL A 55 -0.989 -2.361 3.548 1.00 64.23 H new ATOM 0 HB VAL A 55 -2.088 -1.588 6.272 1.00 23.52 H new ATOM 0 HG11 VAL A 55 -3.734 -0.320 4.888 1.00 5.50 H new ATOM 0 HG12 VAL A 55 -2.058 0.163 4.534 1.00 5.50 H new ATOM 0 HG13 VAL A 55 -2.930 -0.912 3.415 1.00 5.50 H new ATOM 0 HG21 VAL A 55 -4.255 -2.600 5.662 1.00 55.31 H new ATOM 0 HG22 VAL A 55 -3.503 -3.321 4.219 1.00 55.31 H new ATOM 0 HG23 VAL A 55 -2.971 -3.819 5.843 1.00 55.31 H new ATOM 911 N ILE A 56 0.968 -0.858 4.090 1.00 40.42 N ATOM 912 CA ILE A 56 2.045 0.112 4.350 1.00 64.13 C ATOM 913 C ILE A 56 1.473 1.538 4.227 1.00 71.41 C ATOM 914 O ILE A 56 1.114 1.966 3.128 1.00 64.20 O ATOM 915 CB ILE A 56 3.245 -0.092 3.341 1.00 54.45 C ATOM 916 CG1 ILE A 56 3.819 -1.544 3.447 1.00 0.20 C ATOM 917 CG2 ILE A 56 4.368 0.963 3.551 1.00 4.33 C ATOM 918 CD1 ILE A 56 4.450 -1.895 4.793 1.00 42.34 C ATOM 0 H ILE A 56 0.843 -1.080 3.102 1.00 40.42 H new ATOM 0 HA ILE A 56 2.432 -0.043 5.357 1.00 64.13 H new ATOM 0 HB ILE A 56 2.850 0.052 2.335 1.00 54.45 H new ATOM 0 HG12 ILE A 56 3.015 -2.251 3.245 1.00 0.20 H new ATOM 0 HG13 ILE A 56 4.567 -1.680 2.666 1.00 0.20 H new ATOM 0 HG21 ILE A 56 5.172 0.785 2.837 1.00 4.33 H new ATOM 0 HG22 ILE A 56 3.961 1.963 3.398 1.00 4.33 H new ATOM 0 HG23 ILE A 56 4.759 0.881 4.565 1.00 4.33 H new ATOM 0 HD11 ILE A 56 4.818 -2.921 4.766 1.00 42.34 H new ATOM 0 HD12 ILE A 56 5.280 -1.217 4.994 1.00 42.34 H new ATOM 0 HD13 ILE A 56 3.703 -1.798 5.581 1.00 42.34 H new ATOM 930 N PHE A 57 1.371 2.255 5.361 1.00 74.44 N ATOM 931 CA PHE A 57 0.892 3.651 5.397 1.00 52.32 C ATOM 932 C PHE A 57 2.090 4.604 5.358 1.00 54.15 C ATOM 933 O PHE A 57 2.905 4.626 6.295 1.00 63.24 O ATOM 934 CB PHE A 57 0.050 3.936 6.660 1.00 52.20 C ATOM 935 CG PHE A 57 -1.303 3.247 6.695 1.00 72.54 C ATOM 936 CD1 PHE A 57 -1.444 1.953 7.194 1.00 41.43 C ATOM 937 CD2 PHE A 57 -2.444 3.906 6.238 1.00 63.42 C ATOM 938 CE1 PHE A 57 -2.680 1.348 7.222 1.00 31.44 C ATOM 939 CE2 PHE A 57 -3.672 3.292 6.264 1.00 41.44 C ATOM 940 CZ PHE A 57 -3.789 2.020 6.755 1.00 30.35 C ATOM 0 H PHE A 57 1.618 1.884 6.278 1.00 74.44 H new ATOM 0 HA PHE A 57 0.255 3.808 4.526 1.00 52.32 H new ATOM 0 HB2 PHE A 57 0.621 3.629 7.536 1.00 52.20 H new ATOM 0 HB3 PHE A 57 -0.104 5.012 6.741 1.00 52.20 H new ATOM 0 HD1 PHE A 57 -0.578 1.422 7.561 1.00 41.43 H new ATOM 0 HD2 PHE A 57 -2.361 4.914 5.858 1.00 63.42 H new ATOM 0 HE1 PHE A 57 -2.781 0.345 7.610 1.00 31.44 H new ATOM 0 HE2 PHE A 57 -4.544 3.812 5.897 1.00 41.44 H new ATOM 0 HZ PHE A 57 -4.756 1.540 6.777 1.00 30.35 H new ATOM 950 N ILE A 58 2.188 5.385 4.273 1.00 72.43 N ATOM 951 CA ILE A 58 3.298 6.327 4.022 1.00 23.40 C ATOM 952 C ILE A 58 2.802 7.577 3.274 1.00 24.24 C ATOM 953 O ILE A 58 1.681 7.621 2.771 1.00 51.20 O ATOM 954 CB ILE A 58 4.450 5.655 3.189 1.00 31.01 C ATOM 955 CG1 ILE A 58 3.877 4.908 1.954 1.00 4.30 C ATOM 956 CG2 ILE A 58 5.321 4.720 4.067 1.00 33.35 C ATOM 957 CD1 ILE A 58 4.939 4.326 1.055 1.00 63.44 C ATOM 0 H ILE A 58 1.489 5.383 3.530 1.00 72.43 H new ATOM 0 HA ILE A 58 3.691 6.618 4.996 1.00 23.40 H new ATOM 0 HB ILE A 58 5.102 6.449 2.825 1.00 31.01 H new ATOM 0 HG12 ILE A 58 3.223 4.106 2.296 1.00 4.30 H new ATOM 0 HG13 ILE A 58 3.261 5.597 1.376 1.00 4.30 H new ATOM 0 HG21 ILE A 58 6.106 4.274 3.456 1.00 33.35 H new ATOM 0 HG22 ILE A 58 5.773 5.296 4.875 1.00 33.35 H new ATOM 0 HG23 ILE A 58 4.697 3.931 4.488 1.00 33.35 H new ATOM 0 HD11 ILE A 58 4.466 3.819 0.214 1.00 63.44 H new ATOM 0 HD12 ILE A 58 5.579 5.126 0.683 1.00 63.44 H new ATOM 0 HD13 ILE A 58 5.540 3.612 1.617 1.00 63.44 H new ATOM 969 N ARG A 59 3.662 8.595 3.230 1.00 10.40 N ATOM 970 CA ARG A 59 3.390 9.872 2.550 1.00 33.54 C ATOM 971 C ARG A 59 4.079 9.877 1.166 1.00 22.43 C ATOM 972 O ARG A 59 4.931 9.018 0.905 1.00 43.12 O ATOM 973 CB ARG A 59 3.903 11.025 3.456 1.00 65.20 C ATOM 974 CG ARG A 59 3.389 12.426 3.073 1.00 4.54 C ATOM 975 CD ARG A 59 4.019 13.543 3.918 1.00 1.35 C ATOM 976 NE ARG A 59 3.524 14.872 3.536 1.00 51.24 N ATOM 977 CZ ARG A 59 3.562 15.958 4.317 1.00 1.51 C ATOM 978 NH1 ARG A 59 4.062 15.900 5.555 1.00 32.21 N ATOM 979 NH2 ARG A 59 3.095 17.102 3.851 1.00 43.15 N ATOM 0 H ARG A 59 4.581 8.560 3.670 1.00 10.40 H new ATOM 0 HA ARG A 59 2.321 10.008 2.383 1.00 33.54 H new ATOM 0 HB2 ARG A 59 3.612 10.816 4.486 1.00 65.20 H new ATOM 0 HB3 ARG A 59 4.993 11.033 3.428 1.00 65.20 H new ATOM 0 HG2 ARG A 59 3.601 12.610 2.020 1.00 4.54 H new ATOM 0 HG3 ARG A 59 2.306 12.455 3.190 1.00 4.54 H new ATOM 0 HD2 ARG A 59 3.803 13.365 4.972 1.00 1.35 H new ATOM 0 HD3 ARG A 59 5.103 13.514 3.806 1.00 1.35 H new ATOM 0 HE ARG A 59 3.121 14.975 2.605 1.00 51.24 H new ATOM 0 HH11 ARG A 59 4.423 15.018 5.919 1.00 32.21 H new ATOM 0 HH12 ARG A 59 4.083 16.738 6.136 1.00 32.21 H new ATOM 0 HH21 ARG A 59 2.712 17.150 2.907 1.00 43.15 H new ATOM 0 HH22 ARG A 59 3.118 17.938 4.435 1.00 43.15 H new ATOM 993 N GLY A 60 3.711 10.852 0.302 1.00 61.35 N ATOM 994 CA GLY A 60 4.208 10.954 -1.089 1.00 32.43 C ATOM 995 C GLY A 60 5.733 10.993 -1.241 1.00 10.33 C ATOM 996 O GLY A 60 6.255 10.687 -2.317 1.00 21.14 O ATOM 0 H GLY A 60 3.057 11.594 0.553 1.00 61.35 H new ATOM 0 HA2 GLY A 60 3.825 10.106 -1.657 1.00 32.43 H new ATOM 0 HA3 GLY A 60 3.792 11.854 -1.541 1.00 32.43 H new ATOM 1000 N ALA A 61 6.441 11.379 -0.160 1.00 12.22 N ATOM 1001 CA ALA A 61 7.917 11.337 -0.099 1.00 64.50 C ATOM 1002 C ALA A 61 8.425 9.878 -0.123 1.00 24.21 C ATOM 1003 O ALA A 61 9.263 9.507 -0.940 1.00 54.24 O ATOM 1004 CB ALA A 61 8.398 12.049 1.178 1.00 61.41 C ATOM 0 H ALA A 61 6.007 11.728 0.694 1.00 12.22 H new ATOM 0 HA ALA A 61 8.321 11.849 -0.972 1.00 64.50 H new ATOM 0 HB1 ALA A 61 9.487 12.018 1.224 1.00 61.41 H new ATOM 0 HB2 ALA A 61 8.064 13.087 1.164 1.00 61.41 H new ATOM 0 HB3 ALA A 61 7.984 11.547 2.052 1.00 61.41 H new ATOM 1010 N TYR A 62 7.848 9.072 0.778 1.00 44.35 N ATOM 1011 CA TYR A 62 8.211 7.654 0.998 1.00 11.12 C ATOM 1012 C TYR A 62 7.716 6.771 -0.164 1.00 70.40 C ATOM 1013 O TYR A 62 8.298 5.726 -0.453 1.00 5.13 O ATOM 1014 CB TYR A 62 7.600 7.157 2.328 1.00 51.15 C ATOM 1015 CG TYR A 62 7.915 8.036 3.542 1.00 23.15 C ATOM 1016 CD1 TYR A 62 7.090 9.109 3.888 1.00 44.34 C ATOM 1017 CD2 TYR A 62 9.036 7.800 4.339 1.00 64.53 C ATOM 1018 CE1 TYR A 62 7.372 9.914 4.971 1.00 71.31 C ATOM 1019 CE2 TYR A 62 9.319 8.602 5.426 1.00 42.34 C ATOM 1020 CZ TYR A 62 8.486 9.657 5.738 1.00 50.32 C ATOM 1021 OH TYR A 62 8.769 10.465 6.816 1.00 30.34 O ATOM 0 H TYR A 62 7.098 9.389 1.392 1.00 44.35 H new ATOM 0 HA TYR A 62 9.298 7.582 1.046 1.00 11.12 H new ATOM 0 HB2 TYR A 62 6.518 7.092 2.214 1.00 51.15 H new ATOM 0 HB3 TYR A 62 7.961 6.147 2.524 1.00 51.15 H new ATOM 0 HD1 TYR A 62 6.212 9.312 3.294 1.00 44.34 H new ATOM 0 HD2 TYR A 62 9.693 6.976 4.101 1.00 64.53 H new ATOM 0 HE1 TYR A 62 6.723 10.741 5.216 1.00 71.31 H new ATOM 0 HE2 TYR A 62 10.191 8.404 6.032 1.00 42.34 H new ATOM 0 HH TYR A 62 9.587 10.151 7.254 1.00 30.34 H new ATOM 1031 N GLU A 63 6.604 7.225 -0.787 1.00 74.01 N ATOM 1032 CA GLU A 63 5.926 6.564 -1.928 1.00 73.51 C ATOM 1033 C GLU A 63 6.921 6.207 -3.050 1.00 55.33 C ATOM 1034 O GLU A 63 6.787 5.164 -3.703 1.00 13.33 O ATOM 1035 CB GLU A 63 4.852 7.541 -2.464 1.00 32.52 C ATOM 1036 CG GLU A 63 4.010 7.041 -3.665 1.00 55.23 C ATOM 1037 CD GLU A 63 3.175 8.155 -4.343 1.00 20.13 C ATOM 1038 OE1 GLU A 63 2.258 8.703 -3.703 1.00 44.33 O ATOM 1039 OE2 GLU A 63 3.426 8.476 -5.531 1.00 73.04 O ATOM 0 H GLU A 63 6.139 8.087 -0.502 1.00 74.01 H new ATOM 0 HA GLU A 63 5.475 5.631 -1.592 1.00 73.51 H new ATOM 0 HB2 GLU A 63 4.173 7.785 -1.647 1.00 32.52 H new ATOM 0 HB3 GLU A 63 5.347 8.468 -2.755 1.00 32.52 H new ATOM 0 HG2 GLU A 63 4.676 6.596 -4.405 1.00 55.23 H new ATOM 0 HG3 GLU A 63 3.339 6.252 -3.325 1.00 55.23 H new ATOM 1046 N GLU A 64 7.935 7.082 -3.215 1.00 33.03 N ATOM 1047 CA GLU A 64 9.015 6.930 -4.199 1.00 15.34 C ATOM 1048 C GLU A 64 9.757 5.577 -4.053 1.00 21.43 C ATOM 1049 O GLU A 64 9.946 4.862 -5.038 1.00 0.12 O ATOM 1050 CB GLU A 64 10.005 8.118 -4.076 1.00 32.23 C ATOM 1051 CG GLU A 64 11.163 8.057 -5.074 1.00 1.22 C ATOM 1052 CD GLU A 64 12.055 9.302 -5.046 1.00 73.21 C ATOM 1053 OE1 GLU A 64 11.684 10.326 -5.652 1.00 32.54 O ATOM 1054 OE2 GLU A 64 13.139 9.260 -4.435 1.00 74.03 O ATOM 0 H GLU A 64 8.023 7.929 -2.654 1.00 33.03 H new ATOM 0 HA GLU A 64 8.566 6.934 -5.192 1.00 15.34 H new ATOM 0 HB2 GLU A 64 9.460 9.051 -4.221 1.00 32.23 H new ATOM 0 HB3 GLU A 64 10.409 8.140 -3.064 1.00 32.23 H new ATOM 0 HG2 GLU A 64 11.771 7.178 -4.860 1.00 1.22 H new ATOM 0 HG3 GLU A 64 10.761 7.930 -6.079 1.00 1.22 H new ATOM 1061 N VAL A 65 10.092 5.222 -2.805 1.00 71.12 N ATOM 1062 CA VAL A 65 10.905 4.028 -2.483 1.00 12.55 C ATOM 1063 C VAL A 65 10.167 2.713 -2.838 1.00 44.52 C ATOM 1064 O VAL A 65 10.811 1.709 -3.171 1.00 45.11 O ATOM 1065 CB VAL A 65 11.320 4.020 -0.967 1.00 71.14 C ATOM 1066 CG1 VAL A 65 12.214 2.804 -0.626 1.00 15.24 C ATOM 1067 CG2 VAL A 65 12.019 5.345 -0.580 1.00 20.23 C ATOM 0 H VAL A 65 9.808 5.754 -1.982 1.00 71.12 H new ATOM 0 HA VAL A 65 11.805 4.084 -3.095 1.00 12.55 H new ATOM 0 HB VAL A 65 10.407 3.930 -0.378 1.00 71.14 H new ATOM 0 HG11 VAL A 65 12.480 2.833 0.431 1.00 15.24 H new ATOM 0 HG12 VAL A 65 11.672 1.883 -0.838 1.00 15.24 H new ATOM 0 HG13 VAL A 65 13.121 2.838 -1.230 1.00 15.24 H new ATOM 0 HG21 VAL A 65 12.297 5.316 0.474 1.00 20.23 H new ATOM 0 HG22 VAL A 65 12.914 5.475 -1.188 1.00 20.23 H new ATOM 0 HG23 VAL A 65 11.339 6.179 -0.753 1.00 20.23 H new ATOM 1077 N VAL A 66 8.814 2.750 -2.784 1.00 20.33 N ATOM 1078 CA VAL A 66 7.956 1.556 -2.976 1.00 31.30 C ATOM 1079 C VAL A 66 8.289 0.808 -4.280 1.00 65.02 C ATOM 1080 O VAL A 66 8.391 -0.413 -4.264 1.00 2.25 O ATOM 1081 CB VAL A 66 6.427 1.931 -2.958 1.00 64.24 C ATOM 1082 CG1 VAL A 66 5.507 0.697 -3.178 1.00 25.41 C ATOM 1083 CG2 VAL A 66 6.081 2.637 -1.642 1.00 42.12 C ATOM 0 H VAL A 66 8.288 3.606 -2.607 1.00 20.33 H new ATOM 0 HA VAL A 66 8.166 0.893 -2.137 1.00 31.30 H new ATOM 0 HB VAL A 66 6.245 2.607 -3.793 1.00 64.24 H new ATOM 0 HG11 VAL A 66 4.464 1.012 -3.156 1.00 25.41 H new ATOM 0 HG12 VAL A 66 5.729 0.245 -4.145 1.00 25.41 H new ATOM 0 HG13 VAL A 66 5.682 -0.033 -2.387 1.00 25.41 H new ATOM 0 HG21 VAL A 66 5.022 2.894 -1.635 1.00 42.12 H new ATOM 0 HG22 VAL A 66 6.299 1.974 -0.805 1.00 42.12 H new ATOM 0 HG23 VAL A 66 6.676 3.546 -1.549 1.00 42.12 H new ATOM 1093 N ARG A 67 8.532 1.566 -5.369 1.00 11.03 N ATOM 1094 CA ARG A 67 8.806 1.014 -6.721 1.00 63.52 C ATOM 1095 C ARG A 67 9.987 0.014 -6.700 1.00 54.42 C ATOM 1096 O ARG A 67 9.949 -1.022 -7.381 1.00 22.45 O ATOM 1097 CB ARG A 67 9.060 2.198 -7.713 1.00 11.13 C ATOM 1098 CG ARG A 67 9.285 1.817 -9.212 1.00 34.31 C ATOM 1099 CD ARG A 67 10.764 1.542 -9.586 1.00 12.41 C ATOM 1100 NE ARG A 67 10.905 1.120 -10.991 1.00 1.44 N ATOM 1101 CZ ARG A 67 12.044 1.144 -11.704 1.00 4.11 C ATOM 1102 NH1 ARG A 67 13.187 1.579 -11.173 1.00 25.33 N ATOM 1103 NH2 ARG A 67 12.028 0.712 -12.954 1.00 35.31 N ATOM 0 H ARG A 67 8.545 2.585 -5.340 1.00 11.03 H new ATOM 0 HA ARG A 67 7.938 0.449 -7.061 1.00 63.52 H new ATOM 0 HB2 ARG A 67 8.209 2.877 -7.658 1.00 11.13 H new ATOM 0 HB3 ARG A 67 9.933 2.751 -7.367 1.00 11.13 H new ATOM 0 HG2 ARG A 67 8.694 0.931 -9.442 1.00 34.31 H new ATOM 0 HG3 ARG A 67 8.908 2.624 -9.840 1.00 34.31 H new ATOM 0 HD2 ARG A 67 11.355 2.442 -9.416 1.00 12.41 H new ATOM 0 HD3 ARG A 67 11.166 0.768 -8.932 1.00 12.41 H new ATOM 0 HE ARG A 67 10.067 0.781 -11.463 1.00 1.44 H new ATOM 0 HH11 ARG A 67 13.209 1.903 -10.206 1.00 25.33 H new ATOM 0 HH12 ARG A 67 14.039 1.588 -11.734 1.00 25.33 H new ATOM 0 HH21 ARG A 67 11.160 0.367 -13.363 1.00 35.31 H new ATOM 0 HH22 ARG A 67 12.884 0.724 -13.509 1.00 35.31 H new ATOM 1117 N ASP A 68 11.014 0.338 -5.894 1.00 52.42 N ATOM 1118 CA ASP A 68 12.204 -0.515 -5.700 1.00 44.41 C ATOM 1119 C ASP A 68 11.813 -1.790 -4.920 1.00 51.34 C ATOM 1120 O ASP A 68 12.155 -2.910 -5.312 1.00 44.43 O ATOM 1121 CB ASP A 68 13.309 0.262 -4.921 1.00 0.43 C ATOM 1122 CG ASP A 68 13.613 1.648 -5.521 1.00 30.45 C ATOM 1123 OD1 ASP A 68 12.908 2.619 -5.176 1.00 42.21 O ATOM 1124 OD2 ASP A 68 14.546 1.776 -6.344 1.00 13.53 O ATOM 0 H ASP A 68 11.043 1.204 -5.355 1.00 52.42 H new ATOM 0 HA ASP A 68 12.596 -0.796 -6.678 1.00 44.41 H new ATOM 0 HB2 ASP A 68 12.997 0.383 -3.884 1.00 0.43 H new ATOM 0 HB3 ASP A 68 14.223 -0.331 -4.912 1.00 0.43 H new ATOM 1129 N ILE A 69 11.049 -1.568 -3.827 1.00 21.11 N ATOM 1130 CA ILE A 69 10.608 -2.609 -2.870 1.00 73.42 C ATOM 1131 C ILE A 69 9.706 -3.677 -3.537 1.00 25.22 C ATOM 1132 O ILE A 69 9.757 -4.864 -3.168 1.00 75.42 O ATOM 1133 CB ILE A 69 9.825 -1.945 -1.665 1.00 23.43 C ATOM 1134 CG1 ILE A 69 10.679 -0.822 -0.989 1.00 75.12 C ATOM 1135 CG2 ILE A 69 9.383 -3.004 -0.622 1.00 62.22 C ATOM 1136 CD1 ILE A 69 9.927 -0.001 0.047 1.00 62.31 C ATOM 0 H ILE A 69 10.713 -0.637 -3.579 1.00 21.11 H new ATOM 0 HA ILE A 69 11.506 -3.108 -2.506 1.00 73.42 H new ATOM 0 HB ILE A 69 8.925 -1.487 -2.074 1.00 23.43 H new ATOM 0 HG12 ILE A 69 11.547 -1.279 -0.513 1.00 75.12 H new ATOM 0 HG13 ILE A 69 11.055 -0.153 -1.763 1.00 75.12 H new ATOM 0 HG21 ILE A 69 8.848 -2.513 0.191 1.00 62.22 H new ATOM 0 HG22 ILE A 69 8.728 -3.733 -1.099 1.00 62.22 H new ATOM 0 HG23 ILE A 69 10.262 -3.512 -0.224 1.00 62.22 H new ATOM 0 HD11 ILE A 69 10.592 0.754 0.466 1.00 62.31 H new ATOM 0 HD12 ILE A 69 9.075 0.488 -0.425 1.00 62.31 H new ATOM 0 HD13 ILE A 69 9.574 -0.656 0.844 1.00 62.31 H new ATOM 1148 N VAL A 70 8.901 -3.233 -4.528 1.00 23.50 N ATOM 1149 CA VAL A 70 7.901 -4.071 -5.208 1.00 71.11 C ATOM 1150 C VAL A 70 8.534 -5.341 -5.822 1.00 34.53 C ATOM 1151 O VAL A 70 7.940 -6.412 -5.738 1.00 51.53 O ATOM 1152 CB VAL A 70 7.118 -3.271 -6.326 1.00 0.24 C ATOM 1153 CG1 VAL A 70 6.215 -4.211 -7.148 1.00 63.44 C ATOM 1154 CG2 VAL A 70 6.269 -2.129 -5.713 1.00 12.41 C ATOM 0 H VAL A 70 8.931 -2.275 -4.877 1.00 23.50 H new ATOM 0 HA VAL A 70 7.190 -4.375 -4.440 1.00 71.11 H new ATOM 0 HB VAL A 70 7.862 -2.830 -6.989 1.00 0.24 H new ATOM 0 HG11 VAL A 70 5.688 -3.636 -7.909 1.00 63.44 H new ATOM 0 HG12 VAL A 70 6.827 -4.975 -7.629 1.00 63.44 H new ATOM 0 HG13 VAL A 70 5.491 -4.688 -6.488 1.00 63.44 H new ATOM 0 HG21 VAL A 70 5.744 -1.599 -6.508 1.00 12.41 H new ATOM 0 HG22 VAL A 70 5.544 -2.549 -5.016 1.00 12.41 H new ATOM 0 HG23 VAL A 70 6.921 -1.435 -5.184 1.00 12.41 H new ATOM 1164 N GLU A 71 9.751 -5.207 -6.399 1.00 15.24 N ATOM 1165 CA GLU A 71 10.451 -6.324 -7.082 1.00 25.42 C ATOM 1166 C GLU A 71 10.676 -7.517 -6.125 1.00 32.42 C ATOM 1167 O GLU A 71 10.584 -8.682 -6.542 1.00 74.00 O ATOM 1168 CB GLU A 71 11.800 -5.848 -7.686 1.00 71.31 C ATOM 1169 CG GLU A 71 12.561 -6.942 -8.476 1.00 51.10 C ATOM 1170 CD GLU A 71 13.944 -6.499 -8.968 1.00 1.42 C ATOM 1171 OE1 GLU A 71 14.828 -6.265 -8.119 1.00 73.15 O ATOM 1172 OE2 GLU A 71 14.166 -6.403 -10.194 1.00 23.13 O ATOM 0 H GLU A 71 10.273 -4.331 -6.406 1.00 15.24 H new ATOM 0 HA GLU A 71 9.811 -6.663 -7.896 1.00 25.42 H new ATOM 0 HB2 GLU A 71 11.611 -5.002 -8.347 1.00 71.31 H new ATOM 0 HB3 GLU A 71 12.439 -5.486 -6.880 1.00 71.31 H new ATOM 0 HG2 GLU A 71 12.675 -7.822 -7.843 1.00 51.10 H new ATOM 0 HG3 GLU A 71 11.959 -7.243 -9.334 1.00 51.10 H new ATOM 1179 N TYR A 72 10.931 -7.204 -4.836 1.00 32.43 N ATOM 1180 CA TYR A 72 11.068 -8.223 -3.782 1.00 73.11 C ATOM 1181 C TYR A 72 9.718 -8.930 -3.543 1.00 13.32 C ATOM 1182 O TYR A 72 9.662 -10.149 -3.453 1.00 63.23 O ATOM 1183 CB TYR A 72 11.600 -7.600 -2.460 1.00 11.44 C ATOM 1184 CG TYR A 72 11.784 -8.627 -1.323 1.00 70.43 C ATOM 1185 CD1 TYR A 72 12.934 -9.419 -1.232 1.00 13.04 C ATOM 1186 CD2 TYR A 72 10.791 -8.821 -0.355 1.00 55.25 C ATOM 1187 CE1 TYR A 72 13.078 -10.359 -0.226 1.00 15.23 C ATOM 1188 CE2 TYR A 72 10.934 -9.754 0.649 1.00 62.23 C ATOM 1189 CZ TYR A 72 12.075 -10.521 0.709 1.00 2.41 C ATOM 1190 OH TYR A 72 12.210 -11.462 1.708 1.00 61.33 O ATOM 0 H TYR A 72 11.046 -6.247 -4.503 1.00 32.43 H new ATOM 0 HA TYR A 72 11.796 -8.961 -4.118 1.00 73.11 H new ATOM 0 HB2 TYR A 72 12.555 -7.113 -2.656 1.00 11.44 H new ATOM 0 HB3 TYR A 72 10.909 -6.825 -2.130 1.00 11.44 H new ATOM 0 HD1 TYR A 72 13.723 -9.295 -1.959 1.00 13.04 H new ATOM 0 HD2 TYR A 72 9.891 -8.225 -0.396 1.00 55.25 H new ATOM 0 HE1 TYR A 72 13.971 -10.963 -0.173 1.00 15.23 H new ATOM 0 HE2 TYR A 72 10.154 -9.883 1.385 1.00 62.23 H new ATOM 0 HH TYR A 72 11.416 -11.446 2.282 1.00 61.33 H new ATOM 1200 N ALA A 73 8.635 -8.149 -3.456 1.00 35.21 N ATOM 1201 CA ALA A 73 7.281 -8.696 -3.243 1.00 13.14 C ATOM 1202 C ALA A 73 6.825 -9.549 -4.448 1.00 5.35 C ATOM 1203 O ALA A 73 6.117 -10.540 -4.268 1.00 44.32 O ATOM 1204 CB ALA A 73 6.294 -7.561 -2.958 1.00 31.44 C ATOM 0 H ALA A 73 8.666 -7.132 -3.530 1.00 35.21 H new ATOM 0 HA ALA A 73 7.307 -9.355 -2.375 1.00 13.14 H new ATOM 0 HB1 ALA A 73 5.298 -7.975 -2.802 1.00 31.44 H new ATOM 0 HB2 ALA A 73 6.607 -7.023 -2.063 1.00 31.44 H new ATOM 0 HB3 ALA A 73 6.273 -6.875 -3.805 1.00 31.44 H new ATOM 1210 N GLN A 74 7.282 -9.164 -5.666 1.00 73.00 N ATOM 1211 CA GLN A 74 6.954 -9.876 -6.920 1.00 12.40 C ATOM 1212 C GLN A 74 7.544 -11.300 -6.910 1.00 11.15 C ATOM 1213 O GLN A 74 6.817 -12.269 -7.136 1.00 24.33 O ATOM 1214 CB GLN A 74 7.479 -9.113 -8.179 1.00 1.05 C ATOM 1215 CG GLN A 74 6.794 -7.765 -8.494 1.00 40.14 C ATOM 1216 CD GLN A 74 7.244 -7.160 -9.839 1.00 53.12 C ATOM 1217 OE1 GLN A 74 7.572 -7.882 -10.784 1.00 41.23 O ATOM 1218 NE2 GLN A 74 7.288 -5.837 -9.941 1.00 73.33 N ATOM 0 H GLN A 74 7.886 -8.354 -5.803 1.00 73.00 H new ATOM 0 HA GLN A 74 5.867 -9.929 -6.977 1.00 12.40 H new ATOM 0 HB2 GLN A 74 8.546 -8.933 -8.050 1.00 1.05 H new ATOM 0 HB3 GLN A 74 7.368 -9.765 -9.046 1.00 1.05 H new ATOM 0 HG2 GLN A 74 5.714 -7.908 -8.510 1.00 40.14 H new ATOM 0 HG3 GLN A 74 7.011 -7.058 -7.693 1.00 40.14 H new ATOM 0 HE21 GLN A 74 7.013 -5.255 -9.150 1.00 73.33 H new ATOM 0 HE22 GLN A 74 7.597 -5.403 -10.811 1.00 73.33 H new ATOM 1227 N LYS A 75 8.864 -11.409 -6.615 1.00 22.12 N ATOM 1228 CA LYS A 75 9.583 -12.705 -6.626 1.00 1.14 C ATOM 1229 C LYS A 75 9.054 -13.649 -5.522 1.00 73.51 C ATOM 1230 O LYS A 75 9.013 -14.869 -5.711 1.00 31.01 O ATOM 1231 CB LYS A 75 11.125 -12.511 -6.476 1.00 25.14 C ATOM 1232 CG LYS A 75 11.559 -11.848 -5.151 1.00 53.12 C ATOM 1233 CD LYS A 75 13.079 -11.899 -4.882 1.00 71.14 C ATOM 1234 CE LYS A 75 13.605 -13.330 -4.662 1.00 3.54 C ATOM 1235 NZ LYS A 75 15.061 -13.348 -4.367 1.00 13.21 N ATOM 0 H LYS A 75 9.451 -10.613 -6.367 1.00 22.12 H new ATOM 0 HA LYS A 75 9.393 -13.165 -7.596 1.00 1.14 H new ATOM 0 HB2 LYS A 75 11.611 -13.483 -6.558 1.00 25.14 H new ATOM 0 HB3 LYS A 75 11.485 -11.904 -7.307 1.00 25.14 H new ATOM 0 HG2 LYS A 75 11.238 -10.806 -5.157 1.00 53.12 H new ATOM 0 HG3 LYS A 75 11.040 -12.337 -4.327 1.00 53.12 H new ATOM 0 HD2 LYS A 75 13.606 -11.450 -5.723 1.00 71.14 H new ATOM 0 HD3 LYS A 75 13.307 -11.295 -4.004 1.00 71.14 H new ATOM 0 HE2 LYS A 75 13.062 -13.793 -3.838 1.00 3.54 H new ATOM 0 HE3 LYS A 75 13.408 -13.930 -5.551 1.00 3.54 H new ATOM 0 HZ1 LYS A 75 15.374 -14.330 -4.226 1.00 13.21 H new ATOM 0 HZ2 LYS A 75 15.582 -12.930 -5.164 1.00 13.21 H new ATOM 0 HZ3 LYS A 75 15.247 -12.798 -3.505 1.00 13.21 H new ATOM 1249 N GLU A 76 8.626 -13.063 -4.379 1.00 51.44 N ATOM 1250 CA GLU A 76 8.087 -13.816 -3.226 1.00 75.42 C ATOM 1251 C GLU A 76 6.630 -14.274 -3.457 1.00 11.41 C ATOM 1252 O GLU A 76 6.028 -14.895 -2.573 1.00 24.24 O ATOM 1253 CB GLU A 76 8.218 -12.967 -1.924 1.00 22.34 C ATOM 1254 CG GLU A 76 9.676 -12.620 -1.547 1.00 60.32 C ATOM 1255 CD GLU A 76 10.595 -13.850 -1.434 1.00 35.21 C ATOM 1256 OE1 GLU A 76 10.588 -14.513 -0.383 1.00 14.04 O ATOM 1257 OE2 GLU A 76 11.319 -14.174 -2.393 1.00 74.43 O ATOM 0 H GLU A 76 8.646 -12.054 -4.232 1.00 51.44 H new ATOM 0 HA GLU A 76 8.680 -14.723 -3.113 1.00 75.42 H new ATOM 0 HB2 GLU A 76 7.655 -12.042 -2.047 1.00 22.34 H new ATOM 0 HB3 GLU A 76 7.760 -13.512 -1.099 1.00 22.34 H new ATOM 0 HG2 GLU A 76 10.084 -11.940 -2.295 1.00 60.32 H new ATOM 0 HG3 GLU A 76 9.679 -12.086 -0.597 1.00 60.32 H new ATOM 1264 N GLY A 77 6.079 -13.966 -4.654 1.00 32.25 N ATOM 1265 CA GLY A 77 4.752 -14.435 -5.055 1.00 62.25 C ATOM 1266 C GLY A 77 3.633 -13.712 -4.337 1.00 53.32 C ATOM 1267 O GLY A 77 2.589 -14.302 -4.044 1.00 74.33 O ATOM 0 H GLY A 77 6.544 -13.390 -5.356 1.00 32.25 H new ATOM 0 HA2 GLY A 77 4.634 -14.301 -6.130 1.00 62.25 H new ATOM 0 HA3 GLY A 77 4.674 -15.504 -4.856 1.00 62.25 H new ATOM 1271 N LEU A 78 3.873 -12.436 -4.023 1.00 22.02 N ATOM 1272 CA LEU A 78 2.892 -11.556 -3.381 1.00 61.31 C ATOM 1273 C LEU A 78 2.440 -10.496 -4.388 1.00 30.23 C ATOM 1274 O LEU A 78 3.267 -9.757 -4.940 1.00 52.50 O ATOM 1275 CB LEU A 78 3.495 -10.897 -2.111 1.00 23.40 C ATOM 1276 CG LEU A 78 3.962 -11.878 -0.983 1.00 31.31 C ATOM 1277 CD1 LEU A 78 4.405 -11.107 0.274 1.00 61.02 C ATOM 1278 CD2 LEU A 78 2.860 -12.917 -0.649 1.00 4.54 C ATOM 0 H LEU A 78 4.766 -11.979 -4.210 1.00 22.02 H new ATOM 0 HA LEU A 78 2.028 -12.142 -3.066 1.00 61.31 H new ATOM 0 HB2 LEU A 78 4.348 -10.289 -2.412 1.00 23.40 H new ATOM 0 HB3 LEU A 78 2.752 -10.219 -1.691 1.00 23.40 H new ATOM 0 HG LEU A 78 4.827 -12.426 -1.357 1.00 31.31 H new ATOM 0 HD11 LEU A 78 4.724 -11.813 1.040 1.00 61.02 H new ATOM 0 HD12 LEU A 78 5.234 -10.446 0.022 1.00 61.02 H new ATOM 0 HD13 LEU A 78 3.571 -10.515 0.651 1.00 61.02 H new ATOM 0 HD21 LEU A 78 3.215 -13.583 0.137 1.00 4.54 H new ATOM 0 HD22 LEU A 78 1.963 -12.399 -0.309 1.00 4.54 H new ATOM 0 HD23 LEU A 78 2.627 -13.499 -1.540 1.00 4.54 H new ATOM 1290 N ARG A 79 1.126 -10.464 -4.644 1.00 4.24 N ATOM 1291 CA ARG A 79 0.501 -9.518 -5.575 1.00 14.15 C ATOM 1292 C ARG A 79 0.563 -8.117 -4.944 1.00 53.34 C ATOM 1293 O ARG A 79 0.137 -7.937 -3.799 1.00 4.44 O ATOM 1294 CB ARG A 79 -0.964 -9.987 -5.861 1.00 32.15 C ATOM 1295 CG ARG A 79 -1.723 -9.244 -6.996 1.00 74.45 C ATOM 1296 CD ARG A 79 -2.311 -7.870 -6.586 1.00 0.11 C ATOM 1297 NE ARG A 79 -3.070 -7.253 -7.683 1.00 42.31 N ATOM 1298 CZ ARG A 79 -4.339 -7.540 -7.991 1.00 12.53 C ATOM 1299 NH1 ARG A 79 -5.020 -8.440 -7.297 1.00 51.44 N ATOM 1300 NH2 ARG A 79 -4.919 -6.943 -9.017 1.00 24.34 N ATOM 0 H ARG A 79 0.461 -11.101 -4.206 1.00 4.24 H new ATOM 0 HA ARG A 79 1.022 -9.481 -6.531 1.00 14.15 H new ATOM 0 HB2 ARG A 79 -0.940 -11.049 -6.105 1.00 32.15 H new ATOM 0 HB3 ARG A 79 -1.540 -9.884 -4.942 1.00 32.15 H new ATOM 0 HG2 ARG A 79 -1.043 -9.098 -7.835 1.00 74.45 H new ATOM 0 HG3 ARG A 79 -2.534 -9.880 -7.350 1.00 74.45 H new ATOM 0 HD2 ARG A 79 -2.961 -7.996 -5.720 1.00 0.11 H new ATOM 0 HD3 ARG A 79 -1.503 -7.204 -6.283 1.00 0.11 H new ATOM 0 HE ARG A 79 -2.593 -6.554 -8.252 1.00 42.31 H new ATOM 0 HH11 ARG A 79 -4.577 -8.924 -6.516 1.00 51.44 H new ATOM 0 HH12 ARG A 79 -5.988 -8.649 -7.543 1.00 51.44 H new ATOM 0 HH21 ARG A 79 -4.399 -6.264 -9.573 1.00 24.34 H new ATOM 0 HH22 ARG A 79 -5.887 -7.161 -9.253 1.00 24.34 H new ATOM 1314 N VAL A 80 1.070 -7.124 -5.699 1.00 74.35 N ATOM 1315 CA VAL A 80 1.337 -5.789 -5.175 1.00 14.10 C ATOM 1316 C VAL A 80 0.266 -4.838 -5.707 1.00 41.03 C ATOM 1317 O VAL A 80 -0.043 -4.833 -6.908 1.00 1.24 O ATOM 1318 CB VAL A 80 2.770 -5.281 -5.574 1.00 64.23 C ATOM 1319 CG1 VAL A 80 3.100 -3.940 -4.873 1.00 53.43 C ATOM 1320 CG2 VAL A 80 3.832 -6.360 -5.254 1.00 44.53 C ATOM 0 H VAL A 80 1.302 -7.233 -6.686 1.00 74.35 H new ATOM 0 HA VAL A 80 1.306 -5.824 -4.086 1.00 14.10 H new ATOM 0 HB VAL A 80 2.784 -5.099 -6.649 1.00 64.23 H new ATOM 0 HG11 VAL A 80 4.097 -3.612 -5.167 1.00 53.43 H new ATOM 0 HG12 VAL A 80 2.369 -3.187 -5.166 1.00 53.43 H new ATOM 0 HG13 VAL A 80 3.067 -4.077 -3.792 1.00 53.43 H new ATOM 0 HG21 VAL A 80 4.819 -5.994 -5.536 1.00 44.53 H new ATOM 0 HG22 VAL A 80 3.817 -6.579 -4.186 1.00 44.53 H new ATOM 0 HG23 VAL A 80 3.608 -7.268 -5.814 1.00 44.53 H new ATOM 1330 N LEU A 81 -0.292 -4.058 -4.793 1.00 42.34 N ATOM 1331 CA LEU A 81 -1.417 -3.185 -5.046 1.00 34.34 C ATOM 1332 C LEU A 81 -1.112 -1.852 -4.370 1.00 5.51 C ATOM 1333 O LEU A 81 -1.111 -1.767 -3.146 1.00 43.51 O ATOM 1334 CB LEU A 81 -2.688 -3.840 -4.440 1.00 22.02 C ATOM 1335 CG LEU A 81 -4.052 -3.262 -4.897 1.00 41.12 C ATOM 1336 CD1 LEU A 81 -4.246 -3.474 -6.397 1.00 22.25 C ATOM 1337 CD2 LEU A 81 -5.201 -3.891 -4.101 1.00 72.34 C ATOM 0 H LEU A 81 0.039 -4.018 -3.829 1.00 42.34 H new ATOM 0 HA LEU A 81 -1.585 -3.025 -6.111 1.00 34.34 H new ATOM 0 HB2 LEU A 81 -2.671 -4.903 -4.680 1.00 22.02 H new ATOM 0 HB3 LEU A 81 -2.629 -3.757 -3.355 1.00 22.02 H new ATOM 0 HG LEU A 81 -4.056 -2.190 -4.702 1.00 41.12 H new ATOM 0 HD11 LEU A 81 -5.208 -3.062 -6.701 1.00 22.25 H new ATOM 0 HD12 LEU A 81 -3.447 -2.970 -6.942 1.00 22.25 H new ATOM 0 HD13 LEU A 81 -4.221 -4.541 -6.620 1.00 22.25 H new ATOM 0 HD21 LEU A 81 -6.149 -3.471 -4.437 1.00 72.34 H new ATOM 0 HD22 LEU A 81 -5.205 -4.970 -4.259 1.00 72.34 H new ATOM 0 HD23 LEU A 81 -5.067 -3.680 -3.040 1.00 72.34 H new ATOM 1349 N VAL A 82 -0.815 -0.822 -5.153 1.00 4.32 N ATOM 1350 CA VAL A 82 -0.494 0.504 -4.602 1.00 32.31 C ATOM 1351 C VAL A 82 -1.750 1.387 -4.656 1.00 62.33 C ATOM 1352 O VAL A 82 -2.233 1.754 -5.727 1.00 71.40 O ATOM 1353 CB VAL A 82 0.731 1.153 -5.360 1.00 50.44 C ATOM 1354 CG1 VAL A 82 2.058 0.450 -4.965 1.00 21.12 C ATOM 1355 CG2 VAL A 82 0.537 1.113 -6.891 1.00 53.12 C ATOM 0 H VAL A 82 -0.788 -0.872 -6.171 1.00 4.32 H new ATOM 0 HA VAL A 82 -0.189 0.405 -3.560 1.00 32.31 H new ATOM 0 HB VAL A 82 0.786 2.199 -5.057 1.00 50.44 H new ATOM 0 HG11 VAL A 82 2.888 0.913 -5.499 1.00 21.12 H new ATOM 0 HG12 VAL A 82 2.217 0.549 -3.891 1.00 21.12 H new ATOM 0 HG13 VAL A 82 2.002 -0.606 -5.227 1.00 21.12 H new ATOM 0 HG21 VAL A 82 1.399 1.568 -7.379 1.00 53.12 H new ATOM 0 HG22 VAL A 82 0.439 0.078 -7.218 1.00 53.12 H new ATOM 0 HG23 VAL A 82 -0.364 1.665 -7.158 1.00 53.12 H new ATOM 1365 N ILE A 83 -2.284 1.691 -3.470 1.00 33.12 N ATOM 1366 CA ILE A 83 -3.492 2.505 -3.303 1.00 71.24 C ATOM 1367 C ILE A 83 -3.052 3.885 -2.798 1.00 41.02 C ATOM 1368 O ILE A 83 -2.631 4.000 -1.651 1.00 34.43 O ATOM 1369 CB ILE A 83 -4.473 1.836 -2.254 1.00 74.00 C ATOM 1370 CG1 ILE A 83 -4.682 0.315 -2.581 1.00 40.54 C ATOM 1371 CG2 ILE A 83 -5.831 2.589 -2.201 1.00 33.14 C ATOM 1372 CD1 ILE A 83 -5.460 -0.462 -1.528 1.00 74.15 C ATOM 0 H ILE A 83 -1.884 1.375 -2.587 1.00 33.12 H new ATOM 0 HA ILE A 83 -4.023 2.589 -4.251 1.00 71.24 H new ATOM 0 HB ILE A 83 -4.015 1.909 -1.267 1.00 74.00 H new ATOM 0 HG12 ILE A 83 -5.204 0.231 -3.534 1.00 40.54 H new ATOM 0 HG13 ILE A 83 -3.706 -0.152 -2.710 1.00 40.54 H new ATOM 0 HG21 ILE A 83 -6.485 2.109 -1.473 1.00 33.14 H new ATOM 0 HG22 ILE A 83 -5.661 3.625 -1.908 1.00 33.14 H new ATOM 0 HG23 ILE A 83 -6.301 2.562 -3.184 1.00 33.14 H new ATOM 0 HD11 ILE A 83 -5.555 -1.502 -1.839 1.00 74.15 H new ATOM 0 HD12 ILE A 83 -4.931 -0.415 -0.576 1.00 74.15 H new ATOM 0 HD13 ILE A 83 -6.452 -0.026 -1.413 1.00 74.15 H new ATOM 1384 N LYS A 84 -3.132 4.935 -3.630 1.00 71.34 N ATOM 1385 CA LYS A 84 -2.636 6.268 -3.227 1.00 64.44 C ATOM 1386 C LYS A 84 -3.678 7.361 -3.501 1.00 4.02 C ATOM 1387 O LYS A 84 -4.314 7.395 -4.568 1.00 5.22 O ATOM 1388 CB LYS A 84 -1.263 6.587 -3.893 1.00 51.14 C ATOM 1389 CG LYS A 84 -1.229 6.683 -5.430 1.00 20.32 C ATOM 1390 CD LYS A 84 0.199 6.992 -5.934 1.00 62.31 C ATOM 1391 CE LYS A 84 0.253 7.457 -7.390 1.00 53.35 C ATOM 1392 NZ LYS A 84 1.634 7.891 -7.766 1.00 42.35 N ATOM 0 H LYS A 84 -3.527 4.894 -4.570 1.00 71.34 H new ATOM 0 HA LYS A 84 -2.472 6.250 -2.150 1.00 64.44 H new ATOM 0 HB2 LYS A 84 -0.903 7.533 -3.488 1.00 51.14 H new ATOM 0 HB3 LYS A 84 -0.553 5.819 -3.587 1.00 51.14 H new ATOM 0 HG2 LYS A 84 -1.577 5.746 -5.864 1.00 20.32 H new ATOM 0 HG3 LYS A 84 -1.913 7.463 -5.765 1.00 20.32 H new ATOM 0 HD2 LYS A 84 0.639 7.762 -5.300 1.00 62.31 H new ATOM 0 HD3 LYS A 84 0.814 6.099 -5.825 1.00 62.31 H new ATOM 0 HE2 LYS A 84 -0.068 6.648 -8.046 1.00 53.35 H new ATOM 0 HE3 LYS A 84 -0.444 8.282 -7.537 1.00 53.35 H new ATOM 0 HZ1 LYS A 84 1.581 8.750 -8.350 1.00 42.35 H new ATOM 0 HZ2 LYS A 84 2.182 8.091 -6.905 1.00 42.35 H new ATOM 0 HZ3 LYS A 84 2.101 7.134 -8.305 1.00 42.35 H new ATOM 1406 N VAL A 85 -3.860 8.241 -2.492 1.00 51.31 N ATOM 1407 CA VAL A 85 -4.737 9.406 -2.570 1.00 64.11 C ATOM 1408 C VAL A 85 -3.946 10.560 -3.169 1.00 75.04 C ATOM 1409 O VAL A 85 -2.958 11.036 -2.581 1.00 1.04 O ATOM 1410 CB VAL A 85 -5.305 9.857 -1.172 1.00 11.04 C ATOM 1411 CG1 VAL A 85 -6.316 11.032 -1.323 1.00 71.23 C ATOM 1412 CG2 VAL A 85 -5.930 8.673 -0.408 1.00 2.21 C ATOM 0 H VAL A 85 -3.390 8.151 -1.591 1.00 51.31 H new ATOM 0 HA VAL A 85 -5.592 9.128 -3.186 1.00 64.11 H new ATOM 0 HB VAL A 85 -4.465 10.220 -0.580 1.00 11.04 H new ATOM 0 HG11 VAL A 85 -6.689 11.319 -0.340 1.00 71.23 H new ATOM 0 HG12 VAL A 85 -5.817 11.884 -1.785 1.00 71.23 H new ATOM 0 HG13 VAL A 85 -7.150 10.716 -1.950 1.00 71.23 H new ATOM 0 HG21 VAL A 85 -6.312 9.020 0.552 1.00 2.21 H new ATOM 0 HG22 VAL A 85 -6.748 8.253 -0.993 1.00 2.21 H new ATOM 0 HG23 VAL A 85 -5.173 7.907 -0.242 1.00 2.21 H new ATOM 1422 N ALA A 86 -4.389 10.990 -4.331 1.00 42.11 N ATOM 1423 CA ALA A 86 -3.816 12.100 -5.061 1.00 74.12 C ATOM 1424 C ALA A 86 -4.946 12.871 -5.732 1.00 14.31 C ATOM 1425 O ALA A 86 -6.123 12.527 -5.579 1.00 52.42 O ATOM 1426 CB ALA A 86 -2.806 11.575 -6.081 1.00 45.34 C ATOM 0 H ALA A 86 -5.183 10.563 -4.808 1.00 42.11 H new ATOM 0 HA ALA A 86 -3.285 12.774 -4.389 1.00 74.12 H new ATOM 0 HB1 ALA A 86 -2.375 12.412 -6.630 1.00 45.34 H new ATOM 0 HB2 ALA A 86 -2.014 11.034 -5.563 1.00 45.34 H new ATOM 0 HB3 ALA A 86 -3.308 10.904 -6.778 1.00 45.34 H new ATOM 1432 N GLN A 87 -4.578 13.920 -6.463 1.00 73.31 N ATOM 1433 CA GLN A 87 -5.498 14.777 -7.194 1.00 75.05 C ATOM 1434 C GLN A 87 -4.926 14.979 -8.592 1.00 75.13 C ATOM 1435 O GLN A 87 -3.886 14.382 -8.940 1.00 31.14 O ATOM 1436 CB GLN A 87 -5.684 16.116 -6.426 1.00 30.43 C ATOM 1437 CG GLN A 87 -6.301 15.935 -5.026 1.00 2.22 C ATOM 1438 CD GLN A 87 -6.486 17.234 -4.263 1.00 31.04 C ATOM 1439 OE1 GLN A 87 -5.586 17.689 -3.555 1.00 12.43 O ATOM 1440 NE2 GLN A 87 -7.649 17.839 -4.385 1.00 53.02 N ATOM 0 H GLN A 87 -3.603 14.203 -6.564 1.00 73.31 H new ATOM 0 HA GLN A 87 -6.487 14.327 -7.282 1.00 75.05 H new ATOM 0 HB2 GLN A 87 -4.716 16.608 -6.328 1.00 30.43 H new ATOM 0 HB3 GLN A 87 -6.320 16.778 -7.013 1.00 30.43 H new ATOM 0 HG2 GLN A 87 -7.269 15.443 -5.127 1.00 2.22 H new ATOM 0 HG3 GLN A 87 -5.665 15.270 -4.442 1.00 2.22 H new ATOM 0 HE21 GLN A 87 -8.374 17.436 -4.979 1.00 53.02 H new ATOM 0 HE22 GLN A 87 -7.825 18.711 -3.885 1.00 53.02 H new ATOM 1449 N ASP A 88 -5.608 15.797 -9.392 1.00 0.45 N ATOM 1450 CA ASP A 88 -5.215 16.086 -10.772 1.00 74.23 C ATOM 1451 C ASP A 88 -3.895 16.896 -10.795 1.00 63.24 C ATOM 1452 O ASP A 88 -3.901 18.130 -10.767 1.00 63.12 O ATOM 1453 CB ASP A 88 -6.373 16.833 -11.475 1.00 5.23 C ATOM 1454 CG ASP A 88 -6.085 17.162 -12.955 1.00 24.31 C ATOM 1455 OD1 ASP A 88 -5.978 16.217 -13.771 1.00 51.51 O ATOM 1456 OD2 ASP A 88 -5.944 18.359 -13.306 1.00 42.21 O ATOM 0 H ASP A 88 -6.456 16.282 -9.099 1.00 0.45 H new ATOM 0 HA ASP A 88 -5.026 15.160 -11.315 1.00 74.23 H new ATOM 0 HB2 ASP A 88 -7.276 16.225 -11.415 1.00 5.23 H new ATOM 0 HB3 ASP A 88 -6.576 17.760 -10.938 1.00 5.23 H new ATOM 1461 N GLN A 89 -2.767 16.163 -10.766 1.00 14.11 N ATOM 1462 CA GLN A 89 -1.399 16.721 -10.788 1.00 32.44 C ATOM 1463 C GLN A 89 -0.675 16.224 -12.045 1.00 72.11 C ATOM 1464 O GLN A 89 -0.908 15.091 -12.489 1.00 24.33 O ATOM 1465 CB GLN A 89 -0.608 16.277 -9.520 1.00 1.24 C ATOM 1466 CG GLN A 89 -1.202 16.722 -8.168 1.00 33.21 C ATOM 1467 CD GLN A 89 -1.278 18.239 -8.000 1.00 64.21 C ATOM 1468 OE1 GLN A 89 -2.295 18.868 -8.294 1.00 25.13 O ATOM 1469 NE2 GLN A 89 -0.188 18.842 -7.553 1.00 2.44 N ATOM 0 H GLN A 89 -2.780 15.144 -10.726 1.00 14.11 H new ATOM 0 HA GLN A 89 -1.458 17.809 -10.797 1.00 32.44 H new ATOM 0 HB2 GLN A 89 -0.535 15.189 -9.523 1.00 1.24 H new ATOM 0 HB3 GLN A 89 0.408 16.665 -9.594 1.00 1.24 H new ATOM 0 HG2 GLN A 89 -2.203 16.303 -8.066 1.00 33.21 H new ATOM 0 HG3 GLN A 89 -0.598 16.306 -7.361 1.00 33.21 H new ATOM 0 HE21 GLN A 89 0.639 18.293 -7.318 1.00 2.44 H new ATOM 0 HE22 GLN A 89 -0.175 19.856 -7.444 1.00 2.44 H new ATOM 1478 N GLU A 90 0.200 17.073 -12.600 1.00 33.32 N ATOM 1479 CA GLU A 90 1.061 16.712 -13.740 1.00 61.01 C ATOM 1480 C GLU A 90 2.195 15.801 -13.233 1.00 5.01 C ATOM 1481 O GLU A 90 2.505 14.770 -13.837 1.00 63.42 O ATOM 1482 CB GLU A 90 1.656 17.974 -14.447 1.00 44.33 C ATOM 1483 CG GLU A 90 0.636 19.051 -14.904 1.00 34.14 C ATOM 1484 CD GLU A 90 0.143 19.967 -13.765 1.00 52.34 C ATOM 1485 OE1 GLU A 90 0.868 20.910 -13.397 1.00 24.44 O ATOM 1486 OE2 GLU A 90 -0.953 19.738 -13.220 1.00 64.24 O ATOM 0 H GLU A 90 0.333 18.030 -12.273 1.00 33.32 H new ATOM 0 HA GLU A 90 0.456 16.188 -14.480 1.00 61.01 H new ATOM 0 HB2 GLU A 90 2.368 18.443 -13.768 1.00 44.33 H new ATOM 0 HB3 GLU A 90 2.219 17.644 -15.320 1.00 44.33 H new ATOM 0 HG2 GLU A 90 1.094 19.666 -15.679 1.00 34.14 H new ATOM 0 HG3 GLU A 90 -0.223 18.555 -15.356 1.00 34.14 H new ATOM 1493 N LEU A 91 2.776 16.210 -12.084 1.00 21.10 N ATOM 1494 CA LEU A 91 3.843 15.481 -11.359 1.00 2.40 C ATOM 1495 C LEU A 91 3.408 14.051 -10.971 1.00 24.34 C ATOM 1496 O LEU A 91 4.253 13.154 -10.844 1.00 53.54 O ATOM 1497 CB LEU A 91 4.238 16.291 -10.091 1.00 14.14 C ATOM 1498 CG LEU A 91 5.316 15.666 -9.138 1.00 24.31 C ATOM 1499 CD1 LEU A 91 6.663 15.453 -9.860 1.00 51.44 C ATOM 1500 CD2 LEU A 91 5.480 16.522 -7.859 1.00 63.32 C ATOM 0 H LEU A 91 2.510 17.079 -11.622 1.00 21.10 H new ATOM 0 HA LEU A 91 4.702 15.381 -12.022 1.00 2.40 H new ATOM 0 HB2 LEU A 91 4.601 17.267 -10.415 1.00 14.14 H new ATOM 0 HB3 LEU A 91 3.334 16.465 -9.508 1.00 14.14 H new ATOM 0 HG LEU A 91 4.962 14.680 -8.836 1.00 24.31 H new ATOM 0 HD11 LEU A 91 7.383 15.019 -9.166 1.00 51.44 H new ATOM 0 HD12 LEU A 91 6.521 14.779 -10.705 1.00 51.44 H new ATOM 0 HD13 LEU A 91 7.038 16.411 -10.220 1.00 51.44 H new ATOM 0 HD21 LEU A 91 6.232 16.070 -7.213 1.00 63.32 H new ATOM 0 HD22 LEU A 91 5.795 17.529 -8.133 1.00 63.32 H new ATOM 0 HD23 LEU A 91 4.529 16.571 -7.329 1.00 63.32 H new ATOM 1512 N LEU A 92 2.084 13.854 -10.786 1.00 42.35 N ATOM 1513 CA LEU A 92 1.510 12.577 -10.328 1.00 41.50 C ATOM 1514 C LEU A 92 1.900 11.420 -11.261 1.00 32.22 C ATOM 1515 O LEU A 92 2.399 10.393 -10.791 1.00 42.12 O ATOM 1516 CB LEU A 92 -0.040 12.678 -10.254 1.00 74.41 C ATOM 1517 CG LEU A 92 -0.789 11.381 -9.807 1.00 51.14 C ATOM 1518 CD1 LEU A 92 -0.309 10.925 -8.414 1.00 10.40 C ATOM 1519 CD2 LEU A 92 -2.324 11.567 -9.854 1.00 41.20 C ATOM 0 H LEU A 92 1.386 14.579 -10.951 1.00 42.35 H new ATOM 0 HA LEU A 92 1.913 12.373 -9.336 1.00 41.50 H new ATOM 0 HB2 LEU A 92 -0.300 13.480 -9.563 1.00 74.41 H new ATOM 0 HB3 LEU A 92 -0.413 12.969 -11.236 1.00 74.41 H new ATOM 0 HG LEU A 92 -0.545 10.590 -10.516 1.00 51.14 H new ATOM 0 HD11 LEU A 92 -0.844 10.021 -8.123 1.00 10.40 H new ATOM 0 HD12 LEU A 92 0.761 10.719 -8.447 1.00 10.40 H new ATOM 0 HD13 LEU A 92 -0.505 11.712 -7.686 1.00 10.40 H new ATOM 0 HD21 LEU A 92 -2.812 10.645 -9.537 1.00 41.20 H new ATOM 0 HD22 LEU A 92 -2.613 12.379 -9.186 1.00 41.20 H new ATOM 0 HD23 LEU A 92 -2.630 11.808 -10.872 1.00 41.20 H new ATOM 1531 N GLU A 93 1.736 11.649 -12.579 1.00 73.23 N ATOM 1532 CA GLU A 93 1.975 10.633 -13.615 1.00 70.44 C ATOM 1533 C GLU A 93 3.465 10.257 -13.707 1.00 33.41 C ATOM 1534 O GLU A 93 3.791 9.154 -14.114 1.00 62.02 O ATOM 1535 CB GLU A 93 1.495 11.138 -14.994 1.00 74.20 C ATOM 1536 CG GLU A 93 0.005 11.520 -15.068 1.00 61.54 C ATOM 1537 CD GLU A 93 -0.403 11.928 -16.488 1.00 3.32 C ATOM 1538 OE1 GLU A 93 -0.215 13.101 -16.856 1.00 23.20 O ATOM 1539 OE2 GLU A 93 -0.864 11.062 -17.263 1.00 75.43 O ATOM 0 H GLU A 93 1.433 12.548 -12.953 1.00 73.23 H new ATOM 0 HA GLU A 93 1.408 9.746 -13.331 1.00 70.44 H new ATOM 0 HB2 GLU A 93 2.091 12.007 -15.273 1.00 74.20 H new ATOM 0 HB3 GLU A 93 1.693 10.364 -15.736 1.00 74.20 H new ATOM 0 HG2 GLU A 93 -0.604 10.677 -14.742 1.00 61.54 H new ATOM 0 HG3 GLU A 93 -0.195 12.342 -14.381 1.00 61.54 H new ATOM 1546 N ARG A 94 4.339 11.196 -13.306 1.00 55.44 N ATOM 1547 CA ARG A 94 5.796 11.079 -13.480 1.00 44.20 C ATOM 1548 C ARG A 94 6.365 9.883 -12.694 1.00 14.34 C ATOM 1549 O ARG A 94 7.141 9.101 -13.237 1.00 44.43 O ATOM 1550 CB ARG A 94 6.466 12.402 -13.060 1.00 52.54 C ATOM 1551 CG ARG A 94 7.925 12.590 -13.532 1.00 33.53 C ATOM 1552 CD ARG A 94 8.421 14.026 -13.289 1.00 51.45 C ATOM 1553 NE ARG A 94 7.520 15.028 -13.912 1.00 33.44 N ATOM 1554 CZ ARG A 94 7.389 16.314 -13.542 1.00 4.53 C ATOM 1555 NH1 ARG A 94 8.103 16.829 -12.542 1.00 35.54 N ATOM 1556 NH2 ARG A 94 6.521 17.084 -14.173 1.00 21.52 N ATOM 0 H ARG A 94 4.052 12.062 -12.850 1.00 55.44 H new ATOM 0 HA ARG A 94 6.013 10.891 -14.532 1.00 44.20 H new ATOM 0 HB2 ARG A 94 5.869 13.229 -13.445 1.00 52.54 H new ATOM 0 HB3 ARG A 94 6.443 12.471 -11.972 1.00 52.54 H new ATOM 0 HG2 ARG A 94 8.571 11.888 -13.005 1.00 33.53 H new ATOM 0 HG3 ARG A 94 7.997 12.355 -14.594 1.00 33.53 H new ATOM 0 HD2 ARG A 94 8.487 14.212 -12.217 1.00 51.45 H new ATOM 0 HD3 ARG A 94 9.426 14.138 -13.695 1.00 51.45 H new ATOM 0 HE ARG A 94 6.947 14.711 -14.694 1.00 33.44 H new ATOM 0 HH11 ARG A 94 8.769 16.244 -12.037 1.00 35.54 H new ATOM 0 HH12 ARG A 94 7.984 17.808 -12.282 1.00 35.54 H new ATOM 0 HH21 ARG A 94 5.958 16.702 -14.933 1.00 21.52 H new ATOM 0 HH22 ARG A 94 6.414 18.061 -13.900 1.00 21.52 H new ATOM 1570 N PHE A 95 5.974 9.758 -11.409 1.00 4.02 N ATOM 1571 CA PHE A 95 6.320 8.582 -10.589 1.00 74.02 C ATOM 1572 C PHE A 95 5.397 7.398 -10.927 1.00 10.01 C ATOM 1573 O PHE A 95 5.863 6.275 -11.120 1.00 0.43 O ATOM 1574 CB PHE A 95 6.246 8.886 -9.062 1.00 60.42 C ATOM 1575 CG PHE A 95 6.541 7.648 -8.207 1.00 3.12 C ATOM 1576 CD1 PHE A 95 7.802 7.040 -8.264 1.00 4.40 C ATOM 1577 CD2 PHE A 95 5.554 7.037 -7.425 1.00 43.44 C ATOM 1578 CE1 PHE A 95 8.072 5.893 -7.547 1.00 23.15 C ATOM 1579 CE2 PHE A 95 5.833 5.887 -6.713 1.00 72.22 C ATOM 1580 CZ PHE A 95 7.085 5.310 -6.784 1.00 62.41 C ATOM 0 H PHE A 95 5.418 10.458 -10.918 1.00 4.02 H new ATOM 0 HA PHE A 95 7.351 8.321 -10.828 1.00 74.02 H new ATOM 0 HB2 PHE A 95 6.959 9.673 -8.816 1.00 60.42 H new ATOM 0 HB3 PHE A 95 5.254 9.266 -8.817 1.00 60.42 H new ATOM 0 HD1 PHE A 95 8.575 7.476 -8.879 1.00 4.40 H new ATOM 0 HD2 PHE A 95 4.565 7.469 -7.378 1.00 43.44 H new ATOM 0 HE1 PHE A 95 9.057 5.452 -7.584 1.00 23.15 H new ATOM 0 HE2 PHE A 95 5.068 5.437 -6.098 1.00 72.22 H new ATOM 0 HZ PHE A 95 7.291 4.400 -6.240 1.00 62.41 H new ATOM 1590 N TYR A 96 4.081 7.689 -10.984 1.00 53.33 N ATOM 1591 CA TYR A 96 2.996 6.696 -11.199 1.00 4.22 C ATOM 1592 C TYR A 96 3.233 5.809 -12.456 1.00 5.24 C ATOM 1593 O TYR A 96 2.793 4.655 -12.501 1.00 33.35 O ATOM 1594 CB TYR A 96 1.643 7.478 -11.254 1.00 65.10 C ATOM 1595 CG TYR A 96 0.460 6.793 -11.951 1.00 64.24 C ATOM 1596 CD1 TYR A 96 0.270 6.929 -13.334 1.00 31.54 C ATOM 1597 CD2 TYR A 96 -0.468 6.036 -11.238 1.00 43.43 C ATOM 1598 CE1 TYR A 96 -0.792 6.334 -13.971 1.00 53.13 C ATOM 1599 CE2 TYR A 96 -1.533 5.446 -11.875 1.00 64.33 C ATOM 1600 CZ TYR A 96 -1.692 5.593 -13.241 1.00 21.54 C ATOM 1601 OH TYR A 96 -2.756 4.987 -13.873 1.00 45.42 O ATOM 0 H TYR A 96 3.730 8.641 -10.880 1.00 53.33 H new ATOM 0 HA TYR A 96 2.976 5.987 -10.372 1.00 4.22 H new ATOM 0 HB2 TYR A 96 1.345 7.707 -10.231 1.00 65.10 H new ATOM 0 HB3 TYR A 96 1.824 8.429 -11.754 1.00 65.10 H new ATOM 0 HD1 TYR A 96 0.973 7.513 -13.910 1.00 31.54 H new ATOM 0 HD2 TYR A 96 -0.349 5.912 -10.172 1.00 43.43 H new ATOM 0 HE1 TYR A 96 -0.919 6.447 -15.037 1.00 53.13 H new ATOM 0 HE2 TYR A 96 -2.247 4.867 -11.308 1.00 64.33 H new ATOM 0 HH TYR A 96 -2.504 4.761 -14.793 1.00 45.42 H new ATOM 1611 N GLU A 97 3.926 6.377 -13.459 1.00 61.45 N ATOM 1612 CA GLU A 97 4.232 5.702 -14.734 1.00 55.24 C ATOM 1613 C GLU A 97 5.130 4.475 -14.503 1.00 31.31 C ATOM 1614 O GLU A 97 4.921 3.442 -15.129 1.00 71.21 O ATOM 1615 CB GLU A 97 4.917 6.696 -15.699 1.00 51.14 C ATOM 1616 CG GLU A 97 5.336 6.098 -17.063 1.00 23.34 C ATOM 1617 CD GLU A 97 6.407 6.923 -17.784 1.00 22.44 C ATOM 1618 OE1 GLU A 97 7.610 6.667 -17.559 1.00 75.12 O ATOM 1619 OE2 GLU A 97 6.059 7.840 -18.557 1.00 44.54 O ATOM 0 H GLU A 97 4.293 7.327 -13.407 1.00 61.45 H new ATOM 0 HA GLU A 97 3.299 5.357 -15.179 1.00 55.24 H new ATOM 0 HB2 GLU A 97 4.240 7.531 -15.878 1.00 51.14 H new ATOM 0 HB3 GLU A 97 5.802 7.103 -15.210 1.00 51.14 H new ATOM 0 HG2 GLU A 97 5.710 5.086 -16.908 1.00 23.34 H new ATOM 0 HG3 GLU A 97 4.457 6.019 -17.702 1.00 23.34 H new ATOM 1626 N GLN A 98 6.106 4.609 -13.578 1.00 24.42 N ATOM 1627 CA GLN A 98 7.023 3.502 -13.174 1.00 31.34 C ATOM 1628 C GLN A 98 6.255 2.269 -12.656 1.00 3.42 C ATOM 1629 O GLN A 98 6.669 1.136 -12.874 1.00 72.13 O ATOM 1630 CB GLN A 98 8.038 3.996 -12.093 1.00 71.31 C ATOM 1631 CG GLN A 98 9.357 4.560 -12.661 1.00 2.03 C ATOM 1632 CD GLN A 98 9.173 5.731 -13.621 1.00 24.34 C ATOM 1633 OE1 GLN A 98 9.927 5.876 -14.583 1.00 13.13 O ATOM 1634 NE2 GLN A 98 8.230 6.620 -13.342 1.00 54.14 N ATOM 0 H GLN A 98 6.286 5.484 -13.086 1.00 24.42 H new ATOM 0 HA GLN A 98 7.569 3.198 -14.067 1.00 31.34 H new ATOM 0 HB2 GLN A 98 7.559 4.766 -11.489 1.00 71.31 H new ATOM 0 HB3 GLN A 98 8.270 3.166 -11.426 1.00 71.31 H new ATOM 0 HG2 GLN A 98 9.989 4.880 -11.833 1.00 2.03 H new ATOM 0 HG3 GLN A 98 9.888 3.761 -13.178 1.00 2.03 H new ATOM 0 HE21 GLN A 98 7.617 6.478 -12.539 1.00 54.14 H new ATOM 0 HE22 GLN A 98 8.117 7.446 -13.930 1.00 54.14 H new ATOM 1643 N LEU A 99 5.135 2.526 -11.980 1.00 61.13 N ATOM 1644 CA LEU A 99 4.261 1.486 -11.405 1.00 70.13 C ATOM 1645 C LEU A 99 3.650 0.662 -12.554 1.00 45.43 C ATOM 1646 O LEU A 99 3.621 -0.562 -12.512 1.00 72.25 O ATOM 1647 CB LEU A 99 3.153 2.153 -10.519 1.00 35.12 C ATOM 1648 CG LEU A 99 3.597 2.792 -9.138 1.00 75.12 C ATOM 1649 CD1 LEU A 99 4.888 3.620 -9.247 1.00 52.12 C ATOM 1650 CD2 LEU A 99 2.470 3.670 -8.547 1.00 74.14 C ATOM 0 H LEU A 99 4.799 3.474 -11.810 1.00 61.13 H new ATOM 0 HA LEU A 99 4.835 0.817 -10.764 1.00 70.13 H new ATOM 0 HB2 LEU A 99 2.675 2.934 -11.111 1.00 35.12 H new ATOM 0 HB3 LEU A 99 2.392 1.400 -10.311 1.00 35.12 H new ATOM 0 HG LEU A 99 3.799 1.954 -8.471 1.00 75.12 H new ATOM 0 HD11 LEU A 99 5.140 4.031 -8.270 1.00 52.12 H new ATOM 0 HD12 LEU A 99 5.701 2.982 -9.593 1.00 52.12 H new ATOM 0 HD13 LEU A 99 4.739 4.435 -9.956 1.00 52.12 H new ATOM 0 HD21 LEU A 99 2.800 4.097 -7.600 1.00 74.14 H new ATOM 0 HD22 LEU A 99 2.232 4.474 -9.244 1.00 74.14 H new ATOM 0 HD23 LEU A 99 1.583 3.059 -8.380 1.00 74.14 H new ATOM 1662 N LYS A 100 3.233 1.382 -13.605 1.00 62.12 N ATOM 1663 CA LYS A 100 2.656 0.799 -14.829 1.00 11.35 C ATOM 1664 C LYS A 100 3.754 0.180 -15.726 1.00 10.44 C ATOM 1665 O LYS A 100 3.493 -0.766 -16.474 1.00 10.23 O ATOM 1666 CB LYS A 100 1.871 1.893 -15.604 1.00 63.43 C ATOM 1667 CG LYS A 100 0.887 2.715 -14.735 1.00 61.12 C ATOM 1668 CD LYS A 100 -0.222 1.871 -14.053 1.00 13.30 C ATOM 1669 CE LYS A 100 -1.339 1.395 -15.009 1.00 4.45 C ATOM 1670 NZ LYS A 100 -0.887 0.364 -15.986 1.00 15.04 N ATOM 0 H LYS A 100 3.287 2.400 -13.631 1.00 62.12 H new ATOM 0 HA LYS A 100 1.974 -0.002 -14.545 1.00 11.35 H new ATOM 0 HB2 LYS A 100 2.584 2.575 -16.067 1.00 63.43 H new ATOM 0 HB3 LYS A 100 1.314 1.419 -16.412 1.00 63.43 H new ATOM 0 HG2 LYS A 100 1.452 3.240 -13.965 1.00 61.12 H new ATOM 0 HG3 LYS A 100 0.417 3.475 -15.359 1.00 61.12 H new ATOM 0 HD2 LYS A 100 0.237 0.999 -13.587 1.00 13.30 H new ATOM 0 HD3 LYS A 100 -0.671 2.461 -13.254 1.00 13.30 H new ATOM 0 HE2 LYS A 100 -2.162 0.990 -14.420 1.00 4.45 H new ATOM 0 HE3 LYS A 100 -1.730 2.254 -15.554 1.00 4.45 H new ATOM 0 HZ1 LYS A 100 -1.642 -0.338 -16.124 1.00 15.04 H new ATOM 0 HZ2 LYS A 100 -0.668 0.819 -16.895 1.00 15.04 H new ATOM 0 HZ3 LYS A 100 -0.036 -0.110 -15.622 1.00 15.04 H new ATOM 1684 N LYS A 101 4.974 0.735 -15.626 1.00 20.14 N ATOM 1685 CA LYS A 101 6.139 0.361 -16.454 1.00 24.54 C ATOM 1686 C LYS A 101 6.649 -1.031 -16.069 1.00 62.21 C ATOM 1687 O LYS A 101 6.966 -1.852 -16.936 1.00 63.24 O ATOM 1688 CB LYS A 101 7.263 1.423 -16.253 1.00 5.53 C ATOM 1689 CG LYS A 101 8.561 1.216 -17.077 1.00 4.33 C ATOM 1690 CD LYS A 101 9.684 2.209 -16.678 1.00 64.51 C ATOM 1691 CE LYS A 101 9.276 3.691 -16.832 1.00 2.53 C ATOM 1692 NZ LYS A 101 8.988 4.078 -18.242 1.00 41.13 N ATOM 0 H LYS A 101 5.185 1.472 -14.953 1.00 20.14 H new ATOM 0 HA LYS A 101 5.843 0.333 -17.503 1.00 24.54 H new ATOM 0 HB2 LYS A 101 6.855 2.403 -16.499 1.00 5.53 H new ATOM 0 HB3 LYS A 101 7.529 1.444 -15.196 1.00 5.53 H new ATOM 0 HG2 LYS A 101 8.917 0.195 -16.937 1.00 4.33 H new ATOM 0 HG3 LYS A 101 8.337 1.333 -18.137 1.00 4.33 H new ATOM 0 HD2 LYS A 101 9.971 2.025 -15.643 1.00 64.51 H new ATOM 0 HD3 LYS A 101 10.564 2.016 -17.292 1.00 64.51 H new ATOM 0 HE2 LYS A 101 8.393 3.883 -16.222 1.00 2.53 H new ATOM 0 HE3 LYS A 101 10.075 4.323 -16.445 1.00 2.53 H new ATOM 0 HZ1 LYS A 101 8.545 5.019 -18.260 1.00 41.13 H new ATOM 0 HZ2 LYS A 101 9.876 4.103 -18.783 1.00 41.13 H new ATOM 0 HZ3 LYS A 101 8.342 3.383 -18.668 1.00 41.13 H new ATOM 1706 N ASP A 102 6.716 -1.278 -14.757 1.00 63.40 N ATOM 1707 CA ASP A 102 7.255 -2.528 -14.192 1.00 21.01 C ATOM 1708 C ASP A 102 6.153 -3.575 -13.977 1.00 4.14 C ATOM 1709 O ASP A 102 6.426 -4.779 -13.998 1.00 15.30 O ATOM 1710 CB ASP A 102 8.017 -2.225 -12.881 1.00 1.12 C ATOM 1711 CG ASP A 102 9.275 -1.369 -13.137 1.00 52.44 C ATOM 1712 OD1 ASP A 102 9.187 -0.123 -13.130 1.00 31.42 O ATOM 1713 OD2 ASP A 102 10.358 -1.939 -13.384 1.00 43.43 O ATOM 0 H ASP A 102 6.397 -0.616 -14.050 1.00 63.40 H new ATOM 0 HA ASP A 102 7.955 -2.957 -14.909 1.00 21.01 H new ATOM 0 HB2 ASP A 102 7.357 -1.703 -12.188 1.00 1.12 H new ATOM 0 HB3 ASP A 102 8.305 -3.161 -12.403 1.00 1.12 H new ATOM 1718 N GLY A 103 4.907 -3.111 -13.779 1.00 4.03 N ATOM 1719 CA GLY A 103 3.752 -4.002 -13.649 1.00 71.24 C ATOM 1720 C GLY A 103 3.277 -4.108 -12.217 1.00 13.21 C ATOM 1721 O GLY A 103 3.534 -5.105 -11.535 1.00 53.23 O ATOM 0 H GLY A 103 4.679 -2.120 -13.706 1.00 4.03 H new ATOM 0 HA2 GLY A 103 2.938 -3.635 -14.275 1.00 71.24 H new ATOM 0 HA3 GLY A 103 4.015 -4.993 -14.018 1.00 71.24 H new ATOM 1725 N VAL A 104 2.616 -3.040 -11.755 1.00 33.51 N ATOM 1726 CA VAL A 104 2.002 -2.957 -10.420 1.00 24.22 C ATOM 1727 C VAL A 104 0.572 -2.451 -10.579 1.00 21.42 C ATOM 1728 O VAL A 104 0.336 -1.446 -11.272 1.00 55.42 O ATOM 1729 CB VAL A 104 2.777 -1.989 -9.446 1.00 11.51 C ATOM 1730 CG1 VAL A 104 2.147 -1.984 -8.028 1.00 65.21 C ATOM 1731 CG2 VAL A 104 4.262 -2.365 -9.378 1.00 60.13 C ATOM 0 H VAL A 104 2.489 -2.192 -12.307 1.00 33.51 H new ATOM 0 HA VAL A 104 2.034 -3.953 -9.979 1.00 24.22 H new ATOM 0 HB VAL A 104 2.693 -0.979 -9.848 1.00 11.51 H new ATOM 0 HG11 VAL A 104 2.707 -1.306 -7.384 1.00 65.21 H new ATOM 0 HG12 VAL A 104 1.111 -1.652 -8.091 1.00 65.21 H new ATOM 0 HG13 VAL A 104 2.180 -2.991 -7.612 1.00 65.21 H new ATOM 0 HG21 VAL A 104 4.779 -1.685 -8.701 1.00 60.13 H new ATOM 0 HG22 VAL A 104 4.362 -3.387 -9.012 1.00 60.13 H new ATOM 0 HG23 VAL A 104 4.702 -2.291 -10.372 1.00 60.13 H new ATOM 1741 N ASP A 105 -0.361 -3.142 -9.931 1.00 31.52 N ATOM 1742 CA ASP A 105 -1.777 -2.795 -9.954 1.00 1.25 C ATOM 1743 C ASP A 105 -2.008 -1.524 -9.127 1.00 31.14 C ATOM 1744 O ASP A 105 -1.874 -1.539 -7.901 1.00 31.12 O ATOM 1745 CB ASP A 105 -2.598 -3.969 -9.401 1.00 74.32 C ATOM 1746 CG ASP A 105 -2.444 -5.237 -10.241 1.00 25.32 C ATOM 1747 OD1 ASP A 105 -1.474 -5.992 -10.013 1.00 44.42 O ATOM 1748 OD2 ASP A 105 -3.298 -5.500 -11.114 1.00 25.42 O ATOM 0 H ASP A 105 -0.152 -3.967 -9.369 1.00 31.52 H new ATOM 0 HA ASP A 105 -2.097 -2.600 -10.978 1.00 1.25 H new ATOM 0 HB2 ASP A 105 -2.287 -4.175 -8.377 1.00 74.32 H new ATOM 0 HB3 ASP A 105 -3.650 -3.687 -9.364 1.00 74.32 H new ATOM 1753 N VAL A 106 -2.318 -0.425 -9.821 1.00 51.03 N ATOM 1754 CA VAL A 106 -2.537 0.888 -9.202 1.00 61.23 C ATOM 1755 C VAL A 106 -4.025 1.088 -8.896 1.00 12.44 C ATOM 1756 O VAL A 106 -4.902 0.642 -9.658 1.00 65.51 O ATOM 1757 CB VAL A 106 -2.019 2.070 -10.109 1.00 32.12 C ATOM 1758 CG1 VAL A 106 -0.507 1.922 -10.388 1.00 63.13 C ATOM 1759 CG2 VAL A 106 -2.827 2.179 -11.429 1.00 13.44 C ATOM 0 H VAL A 106 -2.425 -0.420 -10.835 1.00 51.03 H new ATOM 0 HA VAL A 106 -1.963 0.905 -8.275 1.00 61.23 H new ATOM 0 HB VAL A 106 -2.175 3.000 -9.561 1.00 32.12 H new ATOM 0 HG11 VAL A 106 -0.170 2.747 -11.015 1.00 63.13 H new ATOM 0 HG12 VAL A 106 0.040 1.936 -9.445 1.00 63.13 H new ATOM 0 HG13 VAL A 106 -0.322 0.978 -10.901 1.00 63.13 H new ATOM 0 HG21 VAL A 106 -2.440 3.005 -12.026 1.00 13.44 H new ATOM 0 HG22 VAL A 106 -2.733 1.250 -11.991 1.00 13.44 H new ATOM 0 HG23 VAL A 106 -3.877 2.359 -11.199 1.00 13.44 H new ATOM 1769 N ARG A 107 -4.292 1.720 -7.753 1.00 51.04 N ATOM 1770 CA ARG A 107 -5.623 2.156 -7.346 1.00 73.43 C ATOM 1771 C ARG A 107 -5.502 3.630 -6.955 1.00 70.11 C ATOM 1772 O ARG A 107 -4.934 3.961 -5.908 1.00 22.35 O ATOM 1773 CB ARG A 107 -6.137 1.290 -6.148 1.00 30.30 C ATOM 1774 CG ARG A 107 -6.183 -0.234 -6.431 1.00 34.34 C ATOM 1775 CD ARG A 107 -7.193 -0.617 -7.536 1.00 53.20 C ATOM 1776 NE ARG A 107 -6.913 -1.946 -8.118 1.00 22.44 N ATOM 1777 CZ ARG A 107 -7.536 -3.096 -7.809 1.00 41.12 C ATOM 1778 NH1 ARG A 107 -8.503 -3.133 -6.899 1.00 72.32 N ATOM 1779 NH2 ARG A 107 -7.192 -4.206 -8.439 1.00 73.23 N ATOM 0 H ARG A 107 -3.570 1.947 -7.070 1.00 51.04 H new ATOM 0 HA ARG A 107 -6.345 2.035 -8.154 1.00 73.43 H new ATOM 0 HB2 ARG A 107 -5.495 1.468 -5.286 1.00 30.30 H new ATOM 0 HB3 ARG A 107 -7.137 1.627 -5.875 1.00 30.30 H new ATOM 0 HG2 ARG A 107 -5.189 -0.573 -6.723 1.00 34.34 H new ATOM 0 HG3 ARG A 107 -6.442 -0.760 -5.512 1.00 34.34 H new ATOM 0 HD2 ARG A 107 -8.201 -0.610 -7.122 1.00 53.20 H new ATOM 0 HD3 ARG A 107 -7.167 0.135 -8.325 1.00 53.20 H new ATOM 0 HE ARG A 107 -6.176 -1.995 -8.822 1.00 22.44 H new ATOM 0 HH11 ARG A 107 -8.786 -2.278 -6.420 1.00 72.32 H new ATOM 0 HH12 ARG A 107 -8.963 -4.016 -6.679 1.00 72.32 H new ATOM 0 HH21 ARG A 107 -6.461 -4.183 -9.150 1.00 73.23 H new ATOM 0 HH22 ARG A 107 -7.657 -5.085 -8.214 1.00 73.23 H new ATOM 1793 N VAL A 108 -5.997 4.511 -7.829 1.00 54.43 N ATOM 1794 CA VAL A 108 -6.049 5.956 -7.592 1.00 62.45 C ATOM 1795 C VAL A 108 -7.525 6.364 -7.580 1.00 11.23 C ATOM 1796 O VAL A 108 -8.240 6.249 -8.587 1.00 35.14 O ATOM 1797 CB VAL A 108 -5.193 6.771 -8.657 1.00 12.32 C ATOM 1798 CG1 VAL A 108 -3.671 6.536 -8.439 1.00 73.20 C ATOM 1799 CG2 VAL A 108 -5.588 6.426 -10.124 1.00 13.03 C ATOM 0 H VAL A 108 -6.378 4.236 -8.734 1.00 54.43 H new ATOM 0 HA VAL A 108 -5.594 6.198 -6.632 1.00 62.45 H new ATOM 0 HB VAL A 108 -5.416 7.826 -8.499 1.00 12.32 H new ATOM 0 HG11 VAL A 108 -3.106 7.103 -9.179 1.00 73.20 H new ATOM 0 HG12 VAL A 108 -3.392 6.865 -7.438 1.00 73.20 H new ATOM 0 HG13 VAL A 108 -3.448 5.475 -8.547 1.00 73.20 H new ATOM 0 HG21 VAL A 108 -4.975 7.008 -10.812 1.00 13.03 H new ATOM 0 HG22 VAL A 108 -5.426 5.363 -10.304 1.00 13.03 H new ATOM 0 HG23 VAL A 108 -6.639 6.665 -10.283 1.00 13.03 H new ATOM 1809 N THR A 109 -7.992 6.780 -6.404 1.00 64.11 N ATOM 1810 CA THR A 109 -9.406 7.114 -6.173 1.00 53.31 C ATOM 1811 C THR A 109 -9.672 8.597 -6.471 1.00 54.44 C ATOM 1812 O THR A 109 -10.832 8.992 -6.675 1.00 45.13 O ATOM 1813 CB THR A 109 -9.803 6.775 -4.708 1.00 52.23 C ATOM 1814 OG1 THR A 109 -8.897 7.436 -3.807 1.00 62.12 O ATOM 1815 CG2 THR A 109 -9.784 5.254 -4.457 1.00 22.12 C ATOM 0 H THR A 109 -7.403 6.897 -5.579 1.00 64.11 H new ATOM 0 HA THR A 109 -10.017 6.517 -6.850 1.00 53.31 H new ATOM 0 HB THR A 109 -10.820 7.125 -4.535 1.00 52.23 H new ATOM 0 HG1 THR A 109 -9.377 8.134 -3.314 1.00 62.12 H new ATOM 0 HG21 THR A 109 -10.066 5.052 -3.424 1.00 22.12 H new ATOM 0 HG22 THR A 109 -10.491 4.766 -5.128 1.00 22.12 H new ATOM 0 HG23 THR A 109 -8.782 4.867 -4.641 1.00 22.12 H new ATOM 1823 N ASP A 110 -8.579 9.412 -6.450 1.00 33.22 N ATOM 1824 CA ASP A 110 -8.610 10.861 -6.767 1.00 64.04 C ATOM 1825 C ASP A 110 -9.485 11.636 -5.735 1.00 25.42 C ATOM 1826 O ASP A 110 -9.927 12.764 -5.967 1.00 21.31 O ATOM 1827 CB ASP A 110 -9.058 11.055 -8.260 1.00 22.44 C ATOM 1828 CG ASP A 110 -9.051 12.509 -8.778 1.00 31.13 C ATOM 1829 OD1 ASP A 110 -7.955 13.069 -9.002 1.00 31.25 O ATOM 1830 OD2 ASP A 110 -10.147 13.084 -9.003 1.00 54.23 O ATOM 0 H ASP A 110 -7.647 9.074 -6.210 1.00 33.22 H new ATOM 0 HA ASP A 110 -7.613 11.291 -6.676 1.00 64.04 H new ATOM 0 HB2 ASP A 110 -8.404 10.459 -8.897 1.00 22.44 H new ATOM 0 HB3 ASP A 110 -10.065 10.654 -8.373 1.00 22.44 H new ATOM 1835 N ASN A 111 -9.667 11.017 -4.548 1.00 54.12 N ATOM 1836 CA ASN A 111 -10.510 11.546 -3.467 1.00 40.11 C ATOM 1837 C ASN A 111 -10.175 10.823 -2.150 1.00 52.41 C ATOM 1838 O ASN A 111 -9.959 9.599 -2.136 1.00 5.32 O ATOM 1839 CB ASN A 111 -12.012 11.381 -3.830 1.00 32.34 C ATOM 1840 CG ASN A 111 -12.997 11.860 -2.751 1.00 41.34 C ATOM 1841 OD1 ASN A 111 -12.706 12.760 -1.965 1.00 42.24 O ATOM 1842 ND2 ASN A 111 -14.187 11.276 -2.723 1.00 20.22 N ATOM 0 H ASN A 111 -9.226 10.127 -4.317 1.00 54.12 H new ATOM 0 HA ASN A 111 -10.311 12.610 -3.338 1.00 40.11 H new ATOM 0 HB2 ASN A 111 -12.210 11.929 -4.751 1.00 32.34 H new ATOM 0 HB3 ASN A 111 -12.207 10.329 -4.037 1.00 32.34 H new ATOM 0 HD21 ASN A 111 -14.884 11.571 -2.039 1.00 20.22 H new ATOM 0 HD22 ASN A 111 -14.405 10.532 -3.385 1.00 20.22 H new ATOM 1849 N GLU A 112 -10.164 11.602 -1.062 1.00 22.01 N ATOM 1850 CA GLU A 112 -9.758 11.166 0.284 1.00 5.35 C ATOM 1851 C GLU A 112 -10.703 10.078 0.864 1.00 51.32 C ATOM 1852 O GLU A 112 -10.253 8.982 1.225 1.00 64.51 O ATOM 1853 CB GLU A 112 -9.669 12.420 1.209 1.00 53.33 C ATOM 1854 CG GLU A 112 -10.952 13.293 1.244 1.00 24.02 C ATOM 1855 CD GLU A 112 -10.743 14.677 1.883 1.00 44.23 C ATOM 1856 OE1 GLU A 112 -10.225 15.578 1.191 1.00 22.31 O ATOM 1857 OE2 GLU A 112 -11.114 14.878 3.060 1.00 33.05 O ATOM 0 H GLU A 112 -10.445 12.582 -1.092 1.00 22.01 H new ATOM 0 HA GLU A 112 -8.778 10.693 0.223 1.00 5.35 H new ATOM 0 HB2 GLU A 112 -9.442 12.091 2.223 1.00 53.33 H new ATOM 0 HB3 GLU A 112 -8.834 13.039 0.880 1.00 53.33 H new ATOM 0 HG2 GLU A 112 -11.319 13.425 0.226 1.00 24.02 H new ATOM 0 HG3 GLU A 112 -11.727 12.761 1.796 1.00 24.02 H new ATOM 1864 N ASP A 113 -12.016 10.377 0.907 1.00 23.52 N ATOM 1865 CA ASP A 113 -13.042 9.484 1.491 1.00 43.44 C ATOM 1866 C ASP A 113 -13.331 8.300 0.560 1.00 73.13 C ATOM 1867 O ASP A 113 -13.779 7.251 1.018 1.00 32.13 O ATOM 1868 CB ASP A 113 -14.347 10.254 1.815 1.00 33.11 C ATOM 1869 CG ASP A 113 -14.951 10.955 0.588 1.00 34.13 C ATOM 1870 OD1 ASP A 113 -14.577 12.112 0.315 1.00 35.41 O ATOM 1871 OD2 ASP A 113 -15.779 10.351 -0.123 1.00 4.53 O ATOM 0 H ASP A 113 -12.398 11.247 0.537 1.00 23.52 H new ATOM 0 HA ASP A 113 -12.643 9.096 2.428 1.00 43.44 H new ATOM 0 HB2 ASP A 113 -15.079 9.560 2.227 1.00 33.11 H new ATOM 0 HB3 ASP A 113 -14.142 10.996 2.587 1.00 33.11 H new ATOM 1876 N GLU A 114 -13.138 8.498 -0.756 1.00 20.15 N ATOM 1877 CA GLU A 114 -13.323 7.434 -1.757 1.00 24.45 C ATOM 1878 C GLU A 114 -12.268 6.318 -1.577 1.00 5.34 C ATOM 1879 O GLU A 114 -12.566 5.136 -1.776 1.00 75.01 O ATOM 1880 CB GLU A 114 -13.298 8.038 -3.183 1.00 11.40 C ATOM 1881 CG GLU A 114 -13.573 7.051 -4.338 1.00 61.11 C ATOM 1882 CD GLU A 114 -14.855 6.220 -4.137 1.00 65.00 C ATOM 1883 OE1 GLU A 114 -15.958 6.808 -4.086 1.00 31.15 O ATOM 1884 OE2 GLU A 114 -14.756 4.982 -3.999 1.00 33.12 O ATOM 0 H GLU A 114 -12.852 9.393 -1.153 1.00 20.15 H new ATOM 0 HA GLU A 114 -14.299 6.971 -1.610 1.00 24.45 H new ATOM 0 HB2 GLU A 114 -14.037 8.838 -3.231 1.00 11.40 H new ATOM 0 HB3 GLU A 114 -12.322 8.495 -3.346 1.00 11.40 H new ATOM 0 HG2 GLU A 114 -13.652 7.608 -5.272 1.00 61.11 H new ATOM 0 HG3 GLU A 114 -12.723 6.376 -4.440 1.00 61.11 H new ATOM 1891 N ALA A 115 -11.043 6.706 -1.159 1.00 4.33 N ATOM 1892 CA ALA A 115 -9.978 5.740 -0.813 1.00 54.14 C ATOM 1893 C ALA A 115 -10.341 4.977 0.460 1.00 33.04 C ATOM 1894 O ALA A 115 -10.053 3.787 0.581 1.00 3.24 O ATOM 1895 CB ALA A 115 -8.644 6.454 -0.644 1.00 61.53 C ATOM 0 H ALA A 115 -10.768 7.682 -1.053 1.00 4.33 H new ATOM 0 HA ALA A 115 -9.884 5.024 -1.630 1.00 54.14 H new ATOM 0 HB1 ALA A 115 -7.872 5.728 -0.390 1.00 61.53 H new ATOM 0 HB2 ALA A 115 -8.379 6.954 -1.575 1.00 61.53 H new ATOM 0 HB3 ALA A 115 -8.725 7.192 0.154 1.00 61.53 H new ATOM 1901 N LYS A 116 -10.993 5.694 1.390 1.00 32.33 N ATOM 1902 CA LYS A 116 -11.475 5.144 2.655 1.00 52.40 C ATOM 1903 C LYS A 116 -12.532 4.032 2.413 1.00 11.14 C ATOM 1904 O LYS A 116 -12.492 2.979 3.065 1.00 33.14 O ATOM 1905 CB LYS A 116 -12.076 6.296 3.491 1.00 74.03 C ATOM 1906 CG LYS A 116 -12.505 5.901 4.913 1.00 45.33 C ATOM 1907 CD LYS A 116 -13.621 6.801 5.478 1.00 32.52 C ATOM 1908 CE LYS A 116 -14.042 6.366 6.889 1.00 54.24 C ATOM 1909 NZ LYS A 116 -15.344 6.933 7.304 1.00 3.14 N ATOM 0 H LYS A 116 -11.200 6.686 1.277 1.00 32.33 H new ATOM 0 HA LYS A 116 -10.645 4.688 3.194 1.00 52.40 H new ATOM 0 HB2 LYS A 116 -11.343 7.100 3.557 1.00 74.03 H new ATOM 0 HB3 LYS A 116 -12.941 6.697 2.963 1.00 74.03 H new ATOM 0 HG2 LYS A 116 -12.848 4.866 4.909 1.00 45.33 H new ATOM 0 HG3 LYS A 116 -11.639 5.947 5.574 1.00 45.33 H new ATOM 0 HD2 LYS A 116 -13.277 7.835 5.504 1.00 32.52 H new ATOM 0 HD3 LYS A 116 -14.485 6.769 4.814 1.00 32.52 H new ATOM 0 HE2 LYS A 116 -14.097 5.278 6.927 1.00 54.24 H new ATOM 0 HE3 LYS A 116 -13.275 6.671 7.601 1.00 54.24 H new ATOM 0 HZ1 LYS A 116 -15.576 6.605 8.263 1.00 3.14 H new ATOM 0 HZ2 LYS A 116 -15.288 7.971 7.297 1.00 3.14 H new ATOM 0 HZ3 LYS A 116 -16.085 6.622 6.644 1.00 3.14 H new ATOM 1923 N LYS A 117 -13.475 4.295 1.463 1.00 41.42 N ATOM 1924 CA LYS A 117 -14.490 3.306 1.026 1.00 51.02 C ATOM 1925 C LYS A 117 -13.786 2.075 0.442 1.00 74.41 C ATOM 1926 O LYS A 117 -14.075 0.930 0.811 1.00 71.22 O ATOM 1927 CB LYS A 117 -15.424 3.864 -0.093 1.00 15.03 C ATOM 1928 CG LYS A 117 -16.173 5.177 0.205 1.00 22.33 C ATOM 1929 CD LYS A 117 -17.165 5.527 -0.941 1.00 30.41 C ATOM 1930 CE LYS A 117 -17.684 6.965 -0.889 1.00 53.10 C ATOM 1931 NZ LYS A 117 -16.616 7.941 -1.203 1.00 32.42 N ATOM 0 H LYS A 117 -13.548 5.193 0.985 1.00 41.42 H new ATOM 0 HA LYS A 117 -15.087 3.063 1.905 1.00 51.02 H new ATOM 0 HB2 LYS A 117 -14.824 4.014 -0.990 1.00 15.03 H new ATOM 0 HB3 LYS A 117 -16.164 3.099 -0.328 1.00 15.03 H new ATOM 0 HG2 LYS A 117 -16.717 5.084 1.145 1.00 22.33 H new ATOM 0 HG3 LYS A 117 -15.456 5.988 0.330 1.00 22.33 H new ATOM 0 HD2 LYS A 117 -16.672 5.363 -1.899 1.00 30.41 H new ATOM 0 HD3 LYS A 117 -18.012 4.843 -0.897 1.00 30.41 H new ATOM 0 HE2 LYS A 117 -18.505 7.082 -1.597 1.00 53.10 H new ATOM 0 HE3 LYS A 117 -18.087 7.172 0.103 1.00 53.10 H new ATOM 0 HZ1 LYS A 117 -17.003 8.905 -1.159 1.00 32.42 H new ATOM 0 HZ2 LYS A 117 -15.844 7.845 -0.512 1.00 32.42 H new ATOM 0 HZ3 LYS A 117 -16.249 7.759 -2.159 1.00 32.42 H new ATOM 1945 N ARG A 118 -12.832 2.374 -0.469 1.00 63.21 N ATOM 1946 CA ARG A 118 -12.162 1.381 -1.302 1.00 52.32 C ATOM 1947 C ARG A 118 -11.320 0.421 -0.450 1.00 64.21 C ATOM 1948 O ARG A 118 -11.201 -0.743 -0.798 1.00 22.11 O ATOM 1949 CB ARG A 118 -11.291 2.071 -2.398 1.00 41.42 C ATOM 1950 CG ARG A 118 -10.917 1.157 -3.601 1.00 0.13 C ATOM 1951 CD ARG A 118 -12.066 0.999 -4.634 1.00 51.14 C ATOM 1952 NE ARG A 118 -13.330 0.470 -4.053 1.00 44.03 N ATOM 1953 CZ ARG A 118 -14.548 1.058 -4.171 1.00 2.25 C ATOM 1954 NH1 ARG A 118 -14.694 2.195 -4.842 1.00 51.55 N ATOM 1955 NH2 ARG A 118 -15.613 0.504 -3.609 1.00 73.11 N ATOM 0 H ARG A 118 -12.510 3.327 -0.639 1.00 63.21 H new ATOM 0 HA ARG A 118 -12.929 0.792 -1.804 1.00 52.32 H new ATOM 0 HB2 ARG A 118 -11.827 2.942 -2.774 1.00 41.42 H new ATOM 0 HB3 ARG A 118 -10.373 2.436 -1.937 1.00 41.42 H new ATOM 0 HG2 ARG A 118 -10.041 1.569 -4.102 1.00 0.13 H new ATOM 0 HG3 ARG A 118 -10.637 0.172 -3.227 1.00 0.13 H new ATOM 0 HD2 ARG A 118 -12.266 1.968 -5.092 1.00 51.14 H new ATOM 0 HD3 ARG A 118 -11.736 0.332 -5.430 1.00 51.14 H new ATOM 0 HE ARG A 118 -13.277 -0.401 -3.526 1.00 44.03 H new ATOM 0 HH11 ARG A 118 -13.885 2.638 -5.277 1.00 51.55 H new ATOM 0 HH12 ARG A 118 -15.615 2.625 -4.922 1.00 51.55 H new ATOM 0 HH21 ARG A 118 -15.519 -0.367 -3.086 1.00 73.11 H new ATOM 0 HH22 ARG A 118 -16.527 0.948 -3.700 1.00 73.11 H new ATOM 1969 N LEU A 119 -10.779 0.918 0.684 1.00 43.14 N ATOM 1970 CA LEU A 119 -9.981 0.095 1.612 1.00 62.44 C ATOM 1971 C LEU A 119 -10.808 -1.049 2.185 1.00 32.01 C ATOM 1972 O LEU A 119 -10.418 -2.207 2.057 1.00 4.02 O ATOM 1973 CB LEU A 119 -9.379 0.940 2.769 1.00 73.31 C ATOM 1974 CG LEU A 119 -8.154 1.821 2.399 1.00 73.12 C ATOM 1975 CD1 LEU A 119 -7.574 2.493 3.649 1.00 31.11 C ATOM 1976 CD2 LEU A 119 -7.077 0.992 1.668 1.00 31.23 C ATOM 0 H LEU A 119 -10.883 1.889 0.977 1.00 43.14 H new ATOM 0 HA LEU A 119 -9.157 -0.320 1.031 1.00 62.44 H new ATOM 0 HB2 LEU A 119 -10.161 1.587 3.165 1.00 73.31 H new ATOM 0 HB3 LEU A 119 -9.087 0.264 3.573 1.00 73.31 H new ATOM 0 HG LEU A 119 -8.492 2.603 1.718 1.00 73.12 H new ATOM 0 HD11 LEU A 119 -6.717 3.105 3.368 1.00 31.11 H new ATOM 0 HD12 LEU A 119 -8.335 3.123 4.110 1.00 31.11 H new ATOM 0 HD13 LEU A 119 -7.257 1.729 4.359 1.00 31.11 H new ATOM 0 HD21 LEU A 119 -6.231 1.633 1.420 1.00 31.23 H new ATOM 0 HD22 LEU A 119 -6.741 0.181 2.314 1.00 31.23 H new ATOM 0 HD23 LEU A 119 -7.497 0.576 0.752 1.00 31.23 H new ATOM 1988 N LYS A 120 -11.970 -0.712 2.780 1.00 24.32 N ATOM 1989 CA LYS A 120 -12.830 -1.716 3.416 1.00 12.01 C ATOM 1990 C LYS A 120 -13.385 -2.685 2.355 1.00 5.40 C ATOM 1991 O LYS A 120 -13.425 -3.885 2.587 1.00 34.43 O ATOM 1992 CB LYS A 120 -13.973 -1.060 4.230 1.00 13.05 C ATOM 1993 CG LYS A 120 -14.769 -2.082 5.070 1.00 74.13 C ATOM 1994 CD LYS A 120 -15.901 -1.455 5.901 1.00 53.01 C ATOM 1995 CE LYS A 120 -16.659 -2.512 6.721 1.00 13.11 C ATOM 1996 NZ LYS A 120 -17.203 -3.598 5.860 1.00 0.22 N ATOM 0 H LYS A 120 -12.328 0.242 2.831 1.00 24.32 H new ATOM 0 HA LYS A 120 -12.224 -2.283 4.123 1.00 12.01 H new ATOM 0 HB2 LYS A 120 -13.554 -0.301 4.890 1.00 13.05 H new ATOM 0 HB3 LYS A 120 -14.652 -0.549 3.548 1.00 13.05 H new ATOM 0 HG2 LYS A 120 -15.193 -2.834 4.404 1.00 74.13 H new ATOM 0 HG3 LYS A 120 -14.083 -2.600 5.740 1.00 74.13 H new ATOM 0 HD2 LYS A 120 -15.486 -0.703 6.572 1.00 53.01 H new ATOM 0 HD3 LYS A 120 -16.597 -0.941 5.238 1.00 53.01 H new ATOM 0 HE2 LYS A 120 -15.990 -2.941 7.467 1.00 13.11 H new ATOM 0 HE3 LYS A 120 -17.476 -2.034 7.262 1.00 13.11 H new ATOM 0 HZ1 LYS A 120 -17.871 -4.175 6.410 1.00 0.22 H new ATOM 0 HZ2 LYS A 120 -17.695 -3.181 5.044 1.00 0.22 H new ATOM 0 HZ3 LYS A 120 -16.423 -4.198 5.524 1.00 0.22 H new ATOM 2010 N GLU A 121 -13.731 -2.131 1.171 1.00 42.24 N ATOM 2011 CA GLU A 121 -14.183 -2.897 -0.014 1.00 14.15 C ATOM 2012 C GLU A 121 -13.168 -4.008 -0.383 1.00 24.12 C ATOM 2013 O GLU A 121 -13.524 -5.178 -0.542 1.00 21.44 O ATOM 2014 CB GLU A 121 -14.333 -1.923 -1.217 1.00 45.45 C ATOM 2015 CG GLU A 121 -14.745 -2.580 -2.555 1.00 41.24 C ATOM 2016 CD GLU A 121 -16.216 -3.026 -2.590 1.00 43.13 C ATOM 2017 OE1 GLU A 121 -17.097 -2.160 -2.794 1.00 32.12 O ATOM 2018 OE2 GLU A 121 -16.499 -4.234 -2.418 1.00 1.44 O ATOM 0 H GLU A 121 -13.704 -1.124 1.009 1.00 42.24 H new ATOM 0 HA GLU A 121 -15.138 -3.368 0.220 1.00 14.15 H new ATOM 0 HB2 GLU A 121 -15.074 -1.166 -0.960 1.00 45.45 H new ATOM 0 HB3 GLU A 121 -13.386 -1.404 -1.363 1.00 45.45 H new ATOM 0 HG2 GLU A 121 -14.568 -1.875 -3.367 1.00 41.24 H new ATOM 0 HG3 GLU A 121 -14.107 -3.444 -2.738 1.00 41.24 H new ATOM 2025 N LEU A 122 -11.895 -3.599 -0.486 1.00 40.52 N ATOM 2026 CA LEU A 122 -10.787 -4.478 -0.883 1.00 51.45 C ATOM 2027 C LEU A 122 -10.422 -5.453 0.259 1.00 30.53 C ATOM 2028 O LEU A 122 -9.954 -6.563 0.004 1.00 4.20 O ATOM 2029 CB LEU A 122 -9.573 -3.617 -1.336 1.00 71.12 C ATOM 2030 CG LEU A 122 -9.801 -2.753 -2.633 1.00 40.22 C ATOM 2031 CD1 LEU A 122 -8.516 -2.012 -3.056 1.00 42.42 C ATOM 2032 CD2 LEU A 122 -10.376 -3.589 -3.803 1.00 2.34 C ATOM 0 H LEU A 122 -11.604 -2.640 -0.294 1.00 40.52 H new ATOM 0 HA LEU A 122 -11.096 -5.092 -1.729 1.00 51.45 H new ATOM 0 HB2 LEU A 122 -9.298 -2.949 -0.519 1.00 71.12 H new ATOM 0 HB3 LEU A 122 -8.724 -4.279 -1.506 1.00 71.12 H new ATOM 0 HG LEU A 122 -10.550 -2.003 -2.378 1.00 40.22 H new ATOM 0 HD11 LEU A 122 -8.712 -1.427 -3.954 1.00 42.42 H new ATOM 0 HD12 LEU A 122 -8.198 -1.348 -2.252 1.00 42.42 H new ATOM 0 HD13 LEU A 122 -7.728 -2.737 -3.261 1.00 42.42 H new ATOM 0 HD21 LEU A 122 -10.515 -2.948 -4.674 1.00 2.34 H new ATOM 0 HD22 LEU A 122 -9.683 -4.393 -4.051 1.00 2.34 H new ATOM 0 HD23 LEU A 122 -11.335 -4.015 -3.509 1.00 2.34 H new ATOM 2044 N LEU A 123 -10.663 -5.023 1.513 1.00 25.42 N ATOM 2045 CA LEU A 123 -10.473 -5.859 2.723 1.00 35.44 C ATOM 2046 C LEU A 123 -11.492 -7.011 2.756 1.00 32.41 C ATOM 2047 O LEU A 123 -11.156 -8.111 3.201 1.00 12.14 O ATOM 2048 CB LEU A 123 -10.573 -4.999 4.030 1.00 53.50 C ATOM 2049 CG LEU A 123 -9.222 -4.599 4.703 1.00 21.13 C ATOM 2050 CD1 LEU A 123 -8.282 -3.830 3.745 1.00 1.42 C ATOM 2051 CD2 LEU A 123 -9.510 -3.806 5.985 1.00 2.34 C ATOM 0 H LEU A 123 -10.997 -4.082 1.720 1.00 25.42 H new ATOM 0 HA LEU A 123 -9.471 -6.285 2.677 1.00 35.44 H new ATOM 0 HB2 LEU A 123 -11.122 -4.087 3.797 1.00 53.50 H new ATOM 0 HB3 LEU A 123 -11.167 -5.552 4.758 1.00 53.50 H new ATOM 0 HG LEU A 123 -8.686 -5.512 4.962 1.00 21.13 H new ATOM 0 HD11 LEU A 123 -7.359 -3.578 4.266 1.00 1.42 H new ATOM 0 HD12 LEU A 123 -8.052 -4.454 2.882 1.00 1.42 H new ATOM 0 HD13 LEU A 123 -8.772 -2.915 3.411 1.00 1.42 H new ATOM 0 HD21 LEU A 123 -8.569 -3.525 6.458 1.00 2.34 H new ATOM 0 HD22 LEU A 123 -10.075 -2.907 5.738 1.00 2.34 H new ATOM 0 HD23 LEU A 123 -10.091 -4.422 6.671 1.00 2.34 H new ATOM 2063 N GLU A 124 -12.727 -6.748 2.259 1.00 72.33 N ATOM 2064 CA GLU A 124 -13.800 -7.766 2.184 1.00 73.11 C ATOM 2065 C GLU A 124 -13.372 -8.973 1.318 1.00 24.40 C ATOM 2066 O GLU A 124 -13.904 -10.072 1.477 1.00 43.13 O ATOM 2067 CB GLU A 124 -15.126 -7.177 1.615 1.00 33.02 C ATOM 2068 CG GLU A 124 -15.708 -5.964 2.371 1.00 4.15 C ATOM 2069 CD GLU A 124 -15.880 -6.184 3.889 1.00 61.12 C ATOM 2070 OE1 GLU A 124 -16.718 -7.017 4.286 1.00 11.05 O ATOM 2071 OE2 GLU A 124 -15.194 -5.513 4.692 1.00 61.41 O ATOM 0 H GLU A 124 -13.003 -5.833 1.903 1.00 72.33 H new ATOM 0 HA GLU A 124 -13.976 -8.099 3.207 1.00 73.11 H new ATOM 0 HB2 GLU A 124 -14.956 -6.886 0.578 1.00 33.02 H new ATOM 0 HB3 GLU A 124 -15.876 -7.968 1.605 1.00 33.02 H new ATOM 0 HG2 GLU A 124 -15.056 -5.105 2.212 1.00 4.15 H new ATOM 0 HG3 GLU A 124 -16.677 -5.713 1.940 1.00 4.15 H new ATOM 2078 N LYS A 125 -12.408 -8.746 0.404 1.00 64.24 N ATOM 2079 CA LYS A 125 -12.030 -9.725 -0.633 1.00 31.11 C ATOM 2080 C LYS A 125 -10.481 -9.875 -0.732 1.00 4.23 C ATOM 2081 O LYS A 125 -9.957 -10.342 -1.749 1.00 10.15 O ATOM 2082 CB LYS A 125 -12.686 -9.248 -1.963 1.00 31.02 C ATOM 2083 CG LYS A 125 -12.836 -10.328 -3.061 1.00 53.54 C ATOM 2084 CD LYS A 125 -13.871 -9.931 -4.143 1.00 65.22 C ATOM 2085 CE LYS A 125 -15.301 -9.800 -3.583 1.00 10.14 C ATOM 2086 NZ LYS A 125 -16.277 -9.352 -4.608 1.00 52.34 N ATOM 0 H LYS A 125 -11.871 -7.880 0.364 1.00 64.24 H new ATOM 0 HA LYS A 125 -12.391 -10.724 -0.388 1.00 31.11 H new ATOM 0 HB2 LYS A 125 -13.674 -8.847 -1.736 1.00 31.02 H new ATOM 0 HB3 LYS A 125 -12.093 -8.427 -2.365 1.00 31.02 H new ATOM 0 HG2 LYS A 125 -11.869 -10.499 -3.533 1.00 53.54 H new ATOM 0 HG3 LYS A 125 -13.138 -11.269 -2.602 1.00 53.54 H new ATOM 0 HD2 LYS A 125 -13.574 -8.984 -4.593 1.00 65.22 H new ATOM 0 HD3 LYS A 125 -13.864 -10.677 -4.937 1.00 65.22 H new ATOM 0 HE2 LYS A 125 -15.619 -10.762 -3.180 1.00 10.14 H new ATOM 0 HE3 LYS A 125 -15.299 -9.092 -2.754 1.00 10.14 H new ATOM 0 HZ1 LYS A 125 -17.222 -9.280 -4.180 1.00 52.34 H new ATOM 0 HZ2 LYS A 125 -15.992 -8.422 -4.976 1.00 52.34 H new ATOM 0 HZ3 LYS A 125 -16.302 -10.040 -5.388 1.00 52.34 H new ATOM 2100 N VAL A 126 -9.782 -9.493 0.371 1.00 54.44 N ATOM 2101 CA VAL A 126 -8.300 -9.598 0.535 1.00 41.55 C ATOM 2102 C VAL A 126 -7.533 -8.903 -0.619 1.00 11.32 C ATOM 2103 O VAL A 126 -7.141 -9.549 -1.607 1.00 52.41 O ATOM 2104 CB VAL A 126 -7.800 -11.092 0.721 1.00 4.43 C ATOM 2105 CG1 VAL A 126 -6.269 -11.163 1.002 1.00 31.11 C ATOM 2106 CG2 VAL A 126 -8.601 -11.817 1.830 1.00 64.12 C ATOM 0 H VAL A 126 -10.240 -9.094 1.190 1.00 54.44 H new ATOM 0 HA VAL A 126 -8.072 -9.067 1.459 1.00 41.55 H new ATOM 0 HB VAL A 126 -7.981 -11.609 -0.221 1.00 4.43 H new ATOM 0 HG11 VAL A 126 -5.969 -12.204 1.123 1.00 31.11 H new ATOM 0 HG12 VAL A 126 -5.725 -10.723 0.166 1.00 31.11 H new ATOM 0 HG13 VAL A 126 -6.040 -10.611 1.914 1.00 31.11 H new ATOM 0 HG21 VAL A 126 -8.235 -12.839 1.934 1.00 64.12 H new ATOM 0 HG22 VAL A 126 -8.475 -11.288 2.775 1.00 64.12 H new ATOM 0 HG23 VAL A 126 -9.658 -11.835 1.563 1.00 64.12 H new ATOM 2116 N GLY A 127 -7.369 -7.571 -0.500 1.00 25.24 N ATOM 2117 CA GLY A 127 -6.603 -6.779 -1.462 1.00 12.21 C ATOM 2118 C GLY A 127 -7.347 -6.556 -2.778 1.00 12.14 C ATOM 2119 O GLY A 127 -7.822 -5.461 -3.039 1.00 72.44 O ATOM 0 H GLY A 127 -7.764 -7.023 0.264 1.00 25.24 H new ATOM 0 HA2 GLY A 127 -6.362 -5.813 -1.019 1.00 12.21 H new ATOM 0 HA3 GLY A 127 -5.657 -7.281 -1.666 1.00 12.21 H new