USER MOD reduce.3.24.130724 H: found=0, std=0, add=676, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 673 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 8 MET CE :methyl -143:sc= -1.26 (180deg=0) USER MOD Set 1.2: A 77 CYS SG : rot 180:sc= -1.24 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 38:sc= 0.879 USER MOD Single : A 10 ASN :FLIP amide:sc= -0.793 F(o=-2.2!,f=-0.79) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= 0.144 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.084) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -117:sc= 0.959 (180deg=-0.844) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 HIS : no HD1:sc= -3.78! C(o=-3.8!,f=-8.7!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= 1.01 K(o=1,f=-0.23) USER MOD Single : A 45 ASN : amide:sc= -0.856 K(o=-0.86,f=-5!) USER MOD Single : A 46 LYS NZ :NH3+ -165:sc= 0.501 (180deg=0.392) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot -59:sc= 0.289 USER MOD Single : A 60 TYR OH : rot 180:sc= -0.0215 USER MOD Single : A 64 SER OG : rot -39:sc= -0.0497 USER MOD Single : A 66 SER OG : rot 180:sc= -0.0673 USER MOD Single : A 67 LYS NZ :NH3+ 168:sc=-0.00225 (180deg=-0.119) USER MOD Single : A 68 LYS NZ :NH3+ 177:sc= 0.268 (180deg=0.263) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot -140:sc= -0.394 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.854 7.242 -14.735 1.00 0.00 N ATOM 2 CA GLY A 1 1.512 7.787 -13.434 1.00 0.00 C ATOM 3 C GLY A 1 1.542 9.302 -13.414 1.00 0.00 C ATOM 4 O GLY A 1 2.471 9.904 -12.876 1.00 0.00 O ATOM 0 H1 GLY A 1 1.819 6.203 -14.696 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.175 7.585 -15.444 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.813 7.547 -14.998 1.00 0.00 H new ATOM 0 HA2 GLY A 1 0.518 7.443 -13.149 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.208 7.403 -12.688 1.00 0.00 H new ATOM 8 N SER A 2 0.524 9.921 -14.004 1.00 0.00 N ATOM 9 CA SER A 2 0.440 11.375 -14.056 1.00 0.00 C ATOM 10 C SER A 2 0.843 11.992 -12.720 1.00 0.00 C ATOM 11 O SER A 2 1.806 12.755 -12.641 1.00 0.00 O ATOM 12 CB SER A 2 -0.979 11.813 -14.425 1.00 0.00 C ATOM 13 OG SER A 2 -1.365 11.285 -15.682 1.00 0.00 O ATOM 0 H SER A 2 -0.254 9.437 -14.453 1.00 0.00 H new ATOM 0 HA SER A 2 1.132 11.726 -14.822 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.677 11.480 -13.657 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.031 12.901 -14.453 1.00 0.00 H new ATOM 0 HG SER A 2 -2.276 11.578 -15.894 1.00 0.00 H new ATOM 19 N SER A 3 0.099 11.654 -11.672 1.00 0.00 N ATOM 20 CA SER A 3 0.376 12.176 -10.338 1.00 0.00 C ATOM 21 C SER A 3 0.796 11.056 -9.392 1.00 0.00 C ATOM 22 O SER A 3 -0.026 10.245 -8.968 1.00 0.00 O ATOM 23 CB SER A 3 -0.856 12.893 -9.783 1.00 0.00 C ATOM 24 OG SER A 3 -0.638 13.325 -8.451 1.00 0.00 O ATOM 0 H SER A 3 -0.700 11.022 -11.720 1.00 0.00 H new ATOM 0 HA SER A 3 1.198 12.888 -10.417 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.096 13.750 -10.412 1.00 0.00 H new ATOM 0 HB3 SER A 3 -1.716 12.224 -9.815 1.00 0.00 H new ATOM 0 HG SER A 3 -1.439 13.782 -8.120 1.00 0.00 H new ATOM 30 N GLY A 4 2.085 11.017 -9.066 1.00 0.00 N ATOM 31 CA GLY A 4 2.593 9.992 -8.173 1.00 0.00 C ATOM 32 C GLY A 4 3.438 10.567 -7.054 1.00 0.00 C ATOM 33 O GLY A 4 3.174 10.318 -5.877 1.00 0.00 O ATOM 0 H GLY A 4 2.786 11.677 -9.404 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.756 9.439 -7.746 1.00 0.00 H new ATOM 0 HA3 GLY A 4 3.188 9.279 -8.744 1.00 0.00 H new ATOM 37 N SER A 5 4.459 11.336 -7.419 1.00 0.00 N ATOM 38 CA SER A 5 5.349 11.943 -6.437 1.00 0.00 C ATOM 39 C SER A 5 4.570 12.836 -5.476 1.00 0.00 C ATOM 40 O SER A 5 4.639 12.666 -4.258 1.00 0.00 O ATOM 41 CB SER A 5 6.438 12.758 -7.138 1.00 0.00 C ATOM 42 OG SER A 5 7.476 13.104 -6.238 1.00 0.00 O ATOM 0 H SER A 5 4.690 11.553 -8.388 1.00 0.00 H new ATOM 0 HA SER A 5 5.816 11.142 -5.864 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.849 12.183 -7.968 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.003 13.663 -7.562 1.00 0.00 H new ATOM 0 HG SER A 5 8.160 13.623 -6.711 1.00 0.00 H new ATOM 48 N SER A 6 3.828 13.788 -6.032 1.00 0.00 N ATOM 49 CA SER A 6 3.038 14.711 -5.226 1.00 0.00 C ATOM 50 C SER A 6 1.640 14.153 -4.974 1.00 0.00 C ATOM 51 O SER A 6 0.778 14.190 -5.850 1.00 0.00 O ATOM 52 CB SER A 6 2.939 16.071 -5.919 1.00 0.00 C ATOM 53 OG SER A 6 2.303 15.955 -7.181 1.00 0.00 O ATOM 0 H SER A 6 3.757 13.940 -7.038 1.00 0.00 H new ATOM 0 HA SER A 6 3.539 14.836 -4.266 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.381 16.764 -5.289 1.00 0.00 H new ATOM 0 HB3 SER A 6 3.937 16.490 -6.048 1.00 0.00 H new ATOM 0 HG SER A 6 1.573 15.304 -7.121 1.00 0.00 H new ATOM 59 N GLY A 7 1.425 13.635 -3.768 1.00 0.00 N ATOM 60 CA GLY A 7 0.132 13.076 -3.421 1.00 0.00 C ATOM 61 C GLY A 7 0.244 11.899 -2.472 1.00 0.00 C ATOM 62 O GLY A 7 1.100 11.887 -1.587 1.00 0.00 O ATOM 0 H GLY A 7 2.123 13.593 -3.026 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.484 13.850 -2.963 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.379 12.758 -4.330 1.00 0.00 H new ATOM 66 N MET A 8 -0.622 10.909 -2.655 1.00 0.00 N ATOM 67 CA MET A 8 -0.616 9.722 -1.807 1.00 0.00 C ATOM 68 C MET A 8 -0.278 8.476 -2.618 1.00 0.00 C ATOM 69 O MET A 8 -0.772 8.296 -3.731 1.00 0.00 O ATOM 70 CB MET A 8 -1.975 9.549 -1.126 1.00 0.00 C ATOM 71 CG MET A 8 -3.093 9.175 -2.086 1.00 0.00 C ATOM 72 SD MET A 8 -4.729 9.351 -1.350 1.00 0.00 S ATOM 73 CE MET A 8 -5.727 9.645 -2.808 1.00 0.00 C ATOM 0 H MET A 8 -1.337 10.904 -3.382 1.00 0.00 H new ATOM 0 HA MET A 8 0.150 9.855 -1.044 1.00 0.00 H new ATOM 0 HB2 MET A 8 -1.893 8.778 -0.359 1.00 0.00 H new ATOM 0 HB3 MET A 8 -2.238 10.477 -0.618 1.00 0.00 H new ATOM 0 HG2 MET A 8 -3.029 9.803 -2.974 1.00 0.00 H new ATOM 0 HG3 MET A 8 -2.955 8.145 -2.414 1.00 0.00 H new ATOM 0 HE1 MET A 8 -6.508 10.369 -2.575 1.00 0.00 H new ATOM 0 HE2 MET A 8 -5.097 10.036 -3.607 1.00 0.00 H new ATOM 0 HE3 MET A 8 -6.184 8.710 -3.131 1.00 0.00 H new ATOM 83 N ALA A 9 0.566 7.618 -2.054 1.00 0.00 N ATOM 84 CA ALA A 9 0.968 6.388 -2.725 1.00 0.00 C ATOM 85 C ALA A 9 -0.148 5.350 -2.683 1.00 0.00 C ATOM 86 O ALA A 9 -0.552 4.902 -1.612 1.00 0.00 O ATOM 87 CB ALA A 9 2.233 5.831 -2.091 1.00 0.00 C ATOM 0 H ALA A 9 0.985 7.752 -1.134 1.00 0.00 H new ATOM 0 HA ALA A 9 1.171 6.623 -3.770 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.522 4.912 -2.602 1.00 0.00 H new ATOM 0 HB2 ALA A 9 3.036 6.563 -2.178 1.00 0.00 H new ATOM 0 HB3 ALA A 9 2.049 5.618 -1.038 1.00 0.00 H new ATOM 93 N ASN A 10 -0.644 4.973 -3.858 1.00 0.00 N ATOM 94 CA ASN A 10 -1.715 3.989 -3.955 1.00 0.00 C ATOM 95 C ASN A 10 -1.253 2.629 -3.439 1.00 0.00 C ATOM 96 O ASN A 10 -0.303 2.045 -3.962 1.00 0.00 O ATOM 97 CB ASN A 10 -2.190 3.862 -5.404 1.00 0.00 C ATOM 98 CG ASN A 10 -2.384 5.212 -6.069 1.00 0.00 C ATOM 99 OD1 ASN A 10 -1.304 5.769 -6.602 1.00 0.00 O flip ATOM 100 ND2 ASN A 10 -3.493 5.745 -6.102 1.00 0.00 N flip ATOM 0 H ASN A 10 -0.321 5.334 -4.755 1.00 0.00 H new ATOM 0 HA ASN A 10 -2.545 4.330 -3.336 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -1.463 3.281 -5.972 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -3.129 3.309 -5.429 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -4.296 5.279 -5.679 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -3.609 6.653 -6.553 1.00 0.00 H new ATOM 107 N TYR A 11 -1.931 2.131 -2.412 1.00 0.00 N ATOM 108 CA TYR A 11 -1.589 0.841 -1.823 1.00 0.00 C ATOM 109 C TYR A 11 -1.477 -0.235 -2.899 1.00 0.00 C ATOM 110 O TYR A 11 -0.429 -0.860 -3.061 1.00 0.00 O ATOM 111 CB TYR A 11 -2.639 0.436 -0.787 1.00 0.00 C ATOM 112 CG TYR A 11 -2.858 1.473 0.291 1.00 0.00 C ATOM 113 CD1 TYR A 11 -1.784 2.028 0.976 1.00 0.00 C ATOM 114 CD2 TYR A 11 -4.138 1.898 0.624 1.00 0.00 C ATOM 115 CE1 TYR A 11 -1.980 2.975 1.963 1.00 0.00 C ATOM 116 CE2 TYR A 11 -4.343 2.845 1.608 1.00 0.00 C ATOM 117 CZ TYR A 11 -3.261 3.381 2.275 1.00 0.00 C ATOM 118 OH TYR A 11 -3.459 4.325 3.256 1.00 0.00 O ATOM 0 H TYR A 11 -2.721 2.600 -1.969 1.00 0.00 H new ATOM 0 HA TYR A 11 -0.622 0.939 -1.330 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -3.585 0.247 -1.295 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -2.335 -0.501 -0.321 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -0.780 1.714 0.733 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -4.988 1.480 0.104 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -1.135 3.395 2.488 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -5.345 3.164 1.854 1.00 0.00 H new ATOM 0 HH TYR A 11 -4.418 4.501 3.352 1.00 0.00 H new ATOM 128 N TYR A 12 -2.565 -0.445 -3.632 1.00 0.00 N ATOM 129 CA TYR A 12 -2.591 -1.447 -4.691 1.00 0.00 C ATOM 130 C TYR A 12 -1.324 -1.378 -5.537 1.00 0.00 C ATOM 131 O TYR A 12 -0.701 -2.399 -5.825 1.00 0.00 O ATOM 132 CB TYR A 12 -3.822 -1.250 -5.578 1.00 0.00 C ATOM 133 CG TYR A 12 -5.111 -1.714 -4.937 1.00 0.00 C ATOM 134 CD1 TYR A 12 -5.390 -3.067 -4.794 1.00 0.00 C ATOM 135 CD2 TYR A 12 -6.049 -0.799 -4.476 1.00 0.00 C ATOM 136 CE1 TYR A 12 -6.566 -3.496 -4.210 1.00 0.00 C ATOM 137 CE2 TYR A 12 -7.227 -1.218 -3.889 1.00 0.00 C ATOM 138 CZ TYR A 12 -7.481 -2.568 -3.759 1.00 0.00 C ATOM 139 OH TYR A 12 -8.654 -2.990 -3.176 1.00 0.00 O ATOM 0 H TYR A 12 -3.440 0.065 -3.512 1.00 0.00 H new ATOM 0 HA TYR A 12 -2.641 -2.431 -4.225 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -3.912 -0.194 -5.831 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -3.676 -1.791 -6.513 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -4.675 -3.796 -5.145 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -5.854 0.258 -4.578 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -6.768 -4.552 -4.107 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -7.945 -0.493 -3.534 1.00 0.00 H new ATOM 0 HH TYR A 12 -9.187 -2.211 -2.913 1.00 0.00 H new ATOM 149 N GLU A 13 -0.950 -0.165 -5.933 1.00 0.00 N ATOM 150 CA GLU A 13 0.243 0.038 -6.747 1.00 0.00 C ATOM 151 C GLU A 13 1.502 -0.334 -5.970 1.00 0.00 C ATOM 152 O GLU A 13 2.323 -1.124 -6.436 1.00 0.00 O ATOM 153 CB GLU A 13 0.328 1.494 -7.211 1.00 0.00 C ATOM 154 CG GLU A 13 -0.641 1.834 -8.331 1.00 0.00 C ATOM 155 CD GLU A 13 -2.063 2.015 -7.836 1.00 0.00 C ATOM 156 OE1 GLU A 13 -2.673 1.015 -7.402 1.00 0.00 O ATOM 157 OE2 GLU A 13 -2.565 3.158 -7.881 1.00 0.00 O ATOM 0 H GLU A 13 -1.455 0.691 -5.704 1.00 0.00 H new ATOM 0 HA GLU A 13 0.171 -0.611 -7.620 1.00 0.00 H new ATOM 0 HB2 GLU A 13 0.133 2.149 -6.362 1.00 0.00 H new ATOM 0 HB3 GLU A 13 1.344 1.701 -7.546 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -0.313 2.748 -8.825 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -0.619 1.042 -9.079 1.00 0.00 H new ATOM 164 N VAL A 14 1.648 0.241 -4.780 1.00 0.00 N ATOM 165 CA VAL A 14 2.806 -0.029 -3.937 1.00 0.00 C ATOM 166 C VAL A 14 3.109 -1.522 -3.883 1.00 0.00 C ATOM 167 O VAL A 14 4.265 -1.936 -3.985 1.00 0.00 O ATOM 168 CB VAL A 14 2.590 0.492 -2.503 1.00 0.00 C ATOM 169 CG1 VAL A 14 3.721 0.036 -1.594 1.00 0.00 C ATOM 170 CG2 VAL A 14 2.472 2.008 -2.501 1.00 0.00 C ATOM 0 H VAL A 14 0.978 0.897 -4.378 1.00 0.00 H new ATOM 0 HA VAL A 14 3.652 0.495 -4.382 1.00 0.00 H new ATOM 0 HB VAL A 14 1.658 0.077 -2.120 1.00 0.00 H new ATOM 0 HG11 VAL A 14 3.552 0.413 -0.585 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.754 -1.053 -1.573 1.00 0.00 H new ATOM 0 HG13 VAL A 14 4.669 0.421 -1.971 1.00 0.00 H new ATOM 0 HG21 VAL A 14 2.320 2.360 -1.481 1.00 0.00 H new ATOM 0 HG22 VAL A 14 3.386 2.445 -2.903 1.00 0.00 H new ATOM 0 HG23 VAL A 14 1.625 2.308 -3.118 1.00 0.00 H new ATOM 180 N LEU A 15 2.065 -2.327 -3.721 1.00 0.00 N ATOM 181 CA LEU A 15 2.219 -3.776 -3.654 1.00 0.00 C ATOM 182 C LEU A 15 2.302 -4.380 -5.052 1.00 0.00 C ATOM 183 O LEU A 15 3.038 -5.339 -5.282 1.00 0.00 O ATOM 184 CB LEU A 15 1.050 -4.398 -2.887 1.00 0.00 C ATOM 185 CG LEU A 15 1.135 -4.326 -1.362 1.00 0.00 C ATOM 186 CD1 LEU A 15 -0.256 -4.353 -0.748 1.00 0.00 C ATOM 187 CD2 LEU A 15 1.981 -5.470 -0.821 1.00 0.00 C ATOM 0 H LEU A 15 1.102 -2.001 -3.634 1.00 0.00 H new ATOM 0 HA LEU A 15 3.148 -3.994 -3.128 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.131 -3.906 -3.203 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.967 -5.445 -3.177 1.00 0.00 H new ATOM 0 HG LEU A 15 1.613 -3.385 -1.088 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -0.176 -4.301 0.338 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -0.830 -3.500 -1.111 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -0.761 -5.277 -1.031 1.00 0.00 H new ATOM 0 HD21 LEU A 15 2.031 -5.403 0.266 1.00 0.00 H new ATOM 0 HD22 LEU A 15 1.532 -6.421 -1.106 1.00 0.00 H new ATOM 0 HD23 LEU A 15 2.987 -5.406 -1.235 1.00 0.00 H new ATOM 199 N GLY A 16 1.544 -3.810 -5.984 1.00 0.00 N ATOM 200 CA GLY A 16 1.549 -4.304 -7.349 1.00 0.00 C ATOM 201 C GLY A 16 0.417 -5.276 -7.618 1.00 0.00 C ATOM 202 O GLY A 16 0.568 -6.217 -8.396 1.00 0.00 O ATOM 0 H GLY A 16 0.927 -3.015 -5.818 1.00 0.00 H new ATOM 0 HA2 GLY A 16 1.472 -3.462 -8.037 1.00 0.00 H new ATOM 0 HA3 GLY A 16 2.501 -4.795 -7.551 1.00 0.00 H new ATOM 206 N VAL A 17 -0.722 -5.048 -6.971 1.00 0.00 N ATOM 207 CA VAL A 17 -1.885 -5.911 -7.143 1.00 0.00 C ATOM 208 C VAL A 17 -3.135 -5.094 -7.448 1.00 0.00 C ATOM 209 O VAL A 17 -3.132 -3.869 -7.327 1.00 0.00 O ATOM 210 CB VAL A 17 -2.138 -6.769 -5.889 1.00 0.00 C ATOM 211 CG1 VAL A 17 -0.979 -7.725 -5.653 1.00 0.00 C ATOM 212 CG2 VAL A 17 -2.365 -5.882 -4.675 1.00 0.00 C ATOM 0 H VAL A 17 -0.864 -4.273 -6.323 1.00 0.00 H new ATOM 0 HA VAL A 17 -1.670 -6.568 -7.986 1.00 0.00 H new ATOM 0 HB VAL A 17 -3.038 -7.362 -6.051 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.176 -8.323 -4.763 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -0.869 -8.383 -6.515 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -0.060 -7.155 -5.512 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -2.542 -6.504 -3.798 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.484 -5.262 -4.508 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -3.231 -5.243 -4.848 1.00 0.00 H new ATOM 222 N GLN A 18 -4.202 -5.780 -7.843 1.00 0.00 N ATOM 223 CA GLN A 18 -5.460 -5.117 -8.165 1.00 0.00 C ATOM 224 C GLN A 18 -6.572 -5.571 -7.225 1.00 0.00 C ATOM 225 O GLN A 18 -6.502 -6.653 -6.642 1.00 0.00 O ATOM 226 CB GLN A 18 -5.855 -5.402 -9.615 1.00 0.00 C ATOM 227 CG GLN A 18 -4.941 -4.742 -10.635 1.00 0.00 C ATOM 228 CD GLN A 18 -4.995 -5.418 -11.991 1.00 0.00 C ATOM 229 OE1 GLN A 18 -6.057 -5.850 -12.440 1.00 0.00 O ATOM 230 NE2 GLN A 18 -3.847 -5.514 -12.651 1.00 0.00 N ATOM 0 H GLN A 18 -4.221 -6.794 -7.948 1.00 0.00 H new ATOM 0 HA GLN A 18 -5.318 -4.044 -8.038 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -5.851 -6.480 -9.779 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -6.876 -5.059 -9.779 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -5.221 -3.694 -10.744 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -3.916 -4.761 -10.265 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -2.990 -5.142 -12.241 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -3.822 -5.960 -13.568 1.00 0.00 H new ATOM 239 N ALA A 19 -7.597 -4.737 -7.081 1.00 0.00 N ATOM 240 CA ALA A 19 -8.724 -5.054 -6.213 1.00 0.00 C ATOM 241 C ALA A 19 -9.291 -6.433 -6.531 1.00 0.00 C ATOM 242 O ALA A 19 -9.601 -7.211 -5.629 1.00 0.00 O ATOM 243 CB ALA A 19 -9.806 -3.993 -6.344 1.00 0.00 C ATOM 0 H ALA A 19 -7.670 -3.837 -7.555 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.366 -5.066 -5.184 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -10.642 -4.243 -5.690 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -9.400 -3.022 -6.059 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -10.153 -3.953 -7.377 1.00 0.00 H new ATOM 249 N SER A 20 -9.425 -6.730 -7.820 1.00 0.00 N ATOM 250 CA SER A 20 -9.960 -8.014 -8.257 1.00 0.00 C ATOM 251 C SER A 20 -9.099 -9.164 -7.743 1.00 0.00 C ATOM 252 O SER A 20 -9.521 -10.320 -7.748 1.00 0.00 O ATOM 253 CB SER A 20 -10.040 -8.064 -9.784 1.00 0.00 C ATOM 254 OG SER A 20 -11.022 -7.167 -10.273 1.00 0.00 O ATOM 0 H SER A 20 -9.170 -6.099 -8.580 1.00 0.00 H new ATOM 0 HA SER A 20 -10.963 -8.122 -7.844 1.00 0.00 H new ATOM 0 HB2 SER A 20 -9.069 -7.813 -10.211 1.00 0.00 H new ATOM 0 HB3 SER A 20 -10.277 -9.078 -10.106 1.00 0.00 H new ATOM 0 HG SER A 20 -11.052 -7.217 -11.251 1.00 0.00 H new ATOM 260 N ALA A 21 -7.889 -8.837 -7.301 1.00 0.00 N ATOM 261 CA ALA A 21 -6.969 -9.841 -6.782 1.00 0.00 C ATOM 262 C ALA A 21 -7.579 -10.588 -5.601 1.00 0.00 C ATOM 263 O ALA A 21 -8.664 -10.244 -5.131 1.00 0.00 O ATOM 264 CB ALA A 21 -5.654 -9.192 -6.376 1.00 0.00 C ATOM 0 H ALA A 21 -7.523 -7.885 -7.292 1.00 0.00 H new ATOM 0 HA ALA A 21 -6.776 -10.564 -7.574 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -4.976 -9.954 -5.990 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -5.203 -8.711 -7.244 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -5.840 -8.446 -5.603 1.00 0.00 H new ATOM 270 N SER A 22 -6.876 -11.611 -5.126 1.00 0.00 N ATOM 271 CA SER A 22 -7.351 -12.409 -4.002 1.00 0.00 C ATOM 272 C SER A 22 -6.683 -11.970 -2.703 1.00 0.00 C ATOM 273 O SER A 22 -5.628 -11.335 -2.701 1.00 0.00 O ATOM 274 CB SER A 22 -7.080 -13.894 -4.253 1.00 0.00 C ATOM 275 OG SER A 22 -8.122 -14.482 -5.013 1.00 0.00 O ATOM 0 H SER A 22 -5.975 -11.907 -5.502 1.00 0.00 H new ATOM 0 HA SER A 22 -8.426 -12.254 -3.907 1.00 0.00 H new ATOM 0 HB2 SER A 22 -6.132 -14.010 -4.779 1.00 0.00 H new ATOM 0 HB3 SER A 22 -6.982 -14.415 -3.301 1.00 0.00 H new ATOM 0 HG SER A 22 -7.924 -15.430 -5.161 1.00 0.00 H new ATOM 281 N PRO A 23 -7.311 -12.316 -1.569 1.00 0.00 N ATOM 282 CA PRO A 23 -6.795 -11.969 -0.242 1.00 0.00 C ATOM 283 C PRO A 23 -5.528 -12.742 0.109 1.00 0.00 C ATOM 284 O PRO A 23 -4.783 -12.354 1.008 1.00 0.00 O ATOM 285 CB PRO A 23 -7.939 -12.363 0.697 1.00 0.00 C ATOM 286 CG PRO A 23 -8.684 -13.423 -0.038 1.00 0.00 C ATOM 287 CD PRO A 23 -8.572 -13.073 -1.496 1.00 0.00 C ATOM 0 HA PRO A 23 -6.513 -10.918 -0.177 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -7.560 -12.734 1.649 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -8.580 -11.510 0.919 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -8.260 -14.407 0.161 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -9.727 -13.456 0.276 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -8.542 -13.965 -2.122 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -9.419 -12.476 -1.832 1.00 0.00 H new ATOM 295 N GLU A 24 -5.291 -13.836 -0.608 1.00 0.00 N ATOM 296 CA GLU A 24 -4.114 -14.663 -0.371 1.00 0.00 C ATOM 297 C GLU A 24 -2.977 -14.273 -1.311 1.00 0.00 C ATOM 298 O GLU A 24 -1.802 -14.458 -0.993 1.00 0.00 O ATOM 299 CB GLU A 24 -4.457 -16.143 -0.554 1.00 0.00 C ATOM 300 CG GLU A 24 -5.521 -16.645 0.407 1.00 0.00 C ATOM 301 CD GLU A 24 -5.120 -16.479 1.860 1.00 0.00 C ATOM 302 OE1 GLU A 24 -5.020 -15.322 2.320 1.00 0.00 O ATOM 303 OE2 GLU A 24 -4.907 -17.506 2.537 1.00 0.00 O ATOM 0 H GLU A 24 -5.898 -14.170 -1.357 1.00 0.00 H new ATOM 0 HA GLU A 24 -3.787 -14.498 0.656 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -4.798 -16.304 -1.577 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -3.552 -16.736 -0.422 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -6.451 -16.106 0.227 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -5.719 -17.698 0.207 1.00 0.00 H new ATOM 310 N ASP A 25 -3.335 -13.733 -2.471 1.00 0.00 N ATOM 311 CA ASP A 25 -2.346 -13.316 -3.458 1.00 0.00 C ATOM 312 C ASP A 25 -1.675 -12.012 -3.038 1.00 0.00 C ATOM 313 O ASP A 25 -0.543 -11.730 -3.432 1.00 0.00 O ATOM 314 CB ASP A 25 -3.003 -13.147 -4.829 1.00 0.00 C ATOM 315 CG ASP A 25 -2.981 -14.425 -5.643 1.00 0.00 C ATOM 316 OD1 ASP A 25 -1.877 -14.961 -5.876 1.00 0.00 O ATOM 317 OD2 ASP A 25 -4.067 -14.890 -6.049 1.00 0.00 O ATOM 0 H ASP A 25 -4.303 -13.574 -2.751 1.00 0.00 H new ATOM 0 HA ASP A 25 -1.583 -14.092 -3.522 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -4.035 -12.822 -4.696 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -2.489 -12.360 -5.380 1.00 0.00 H new ATOM 322 N ILE A 26 -2.381 -11.221 -2.237 1.00 0.00 N ATOM 323 CA ILE A 26 -1.853 -9.947 -1.763 1.00 0.00 C ATOM 324 C ILE A 26 -0.872 -10.152 -0.614 1.00 0.00 C ATOM 325 O ILE A 26 0.114 -9.425 -0.487 1.00 0.00 O ATOM 326 CB ILE A 26 -2.981 -9.007 -1.299 1.00 0.00 C ATOM 327 CG1 ILE A 26 -3.930 -8.703 -2.460 1.00 0.00 C ATOM 328 CG2 ILE A 26 -2.399 -7.721 -0.732 1.00 0.00 C ATOM 329 CD1 ILE A 26 -5.308 -8.265 -2.015 1.00 0.00 C ATOM 0 H ILE A 26 -3.320 -11.440 -1.903 1.00 0.00 H new ATOM 0 HA ILE A 26 -1.333 -9.489 -2.604 1.00 0.00 H new ATOM 0 HB ILE A 26 -3.548 -9.504 -0.512 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -3.492 -7.922 -3.081 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -4.024 -9.592 -3.084 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -3.209 -7.067 -0.408 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -1.760 -7.955 0.119 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -1.811 -7.218 -1.500 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -5.927 -8.067 -2.890 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -5.766 -9.054 -1.418 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -5.226 -7.358 -1.416 1.00 0.00 H new ATOM 341 N LYS A 27 -1.148 -11.147 0.222 1.00 0.00 N ATOM 342 CA LYS A 27 -0.289 -11.452 1.361 1.00 0.00 C ATOM 343 C LYS A 27 0.982 -12.163 0.908 1.00 0.00 C ATOM 344 O LYS A 27 2.081 -11.842 1.362 1.00 0.00 O ATOM 345 CB LYS A 27 -1.039 -12.320 2.373 1.00 0.00 C ATOM 346 CG LYS A 27 -1.257 -13.749 1.907 1.00 0.00 C ATOM 347 CD LYS A 27 -1.845 -14.612 3.010 1.00 0.00 C ATOM 348 CE LYS A 27 -1.587 -16.090 2.759 1.00 0.00 C ATOM 349 NZ LYS A 27 -1.640 -16.884 4.018 1.00 0.00 N ATOM 0 H LYS A 27 -1.961 -11.757 0.132 1.00 0.00 H new ATOM 0 HA LYS A 27 -0.009 -10.512 1.836 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -0.482 -12.333 3.310 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -2.006 -11.864 2.583 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -1.925 -13.754 1.045 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -0.309 -14.174 1.578 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -1.413 -14.324 3.968 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -2.918 -14.435 3.078 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -2.327 -16.474 2.056 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -0.610 -16.214 2.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -1.459 -17.886 3.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -0.917 -16.535 4.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -2.581 -16.787 4.451 1.00 0.00 H new ATOM 363 N LYS A 28 0.826 -13.130 0.010 1.00 0.00 N ATOM 364 CA LYS A 28 1.961 -13.885 -0.506 1.00 0.00 C ATOM 365 C LYS A 28 2.921 -12.974 -1.264 1.00 0.00 C ATOM 366 O LYS A 28 4.116 -13.255 -1.356 1.00 0.00 O ATOM 367 CB LYS A 28 1.477 -15.010 -1.424 1.00 0.00 C ATOM 368 CG LYS A 28 0.569 -14.533 -2.544 1.00 0.00 C ATOM 369 CD LYS A 28 1.366 -14.119 -3.770 1.00 0.00 C ATOM 370 CE LYS A 28 1.701 -15.316 -4.647 1.00 0.00 C ATOM 371 NZ LYS A 28 0.572 -15.675 -5.549 1.00 0.00 N ATOM 0 H LYS A 28 -0.076 -13.409 -0.375 1.00 0.00 H new ATOM 0 HA LYS A 28 2.492 -14.319 0.341 1.00 0.00 H new ATOM 0 HB2 LYS A 28 2.342 -15.511 -1.858 1.00 0.00 H new ATOM 0 HB3 LYS A 28 0.945 -15.751 -0.827 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -0.127 -15.328 -2.813 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.028 -13.690 -2.196 1.00 0.00 H new ATOM 0 HD2 LYS A 28 0.796 -13.392 -4.348 1.00 0.00 H new ATOM 0 HD3 LYS A 28 2.287 -13.626 -3.458 1.00 0.00 H new ATOM 0 HE2 LYS A 28 2.586 -15.093 -5.243 1.00 0.00 H new ATOM 0 HE3 LYS A 28 1.948 -16.170 -4.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 0.232 -16.630 -5.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -0.202 -14.992 -5.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 0.897 -15.655 -6.537 1.00 0.00 H new ATOM 385 N ALA A 29 2.391 -11.882 -1.805 1.00 0.00 N ATOM 386 CA ALA A 29 3.202 -10.929 -2.552 1.00 0.00 C ATOM 387 C ALA A 29 4.019 -10.048 -1.613 1.00 0.00 C ATOM 388 O ALA A 29 5.202 -9.803 -1.849 1.00 0.00 O ATOM 389 CB ALA A 29 2.318 -10.072 -3.447 1.00 0.00 C ATOM 0 H ALA A 29 1.403 -11.635 -1.740 1.00 0.00 H new ATOM 0 HA ALA A 29 3.897 -11.491 -3.176 1.00 0.00 H new ATOM 0 HB1 ALA A 29 2.937 -9.365 -3.999 1.00 0.00 H new ATOM 0 HB2 ALA A 29 1.783 -10.711 -4.149 1.00 0.00 H new ATOM 0 HB3 ALA A 29 1.601 -9.526 -2.834 1.00 0.00 H new ATOM 395 N TYR A 30 3.380 -9.575 -0.548 1.00 0.00 N ATOM 396 CA TYR A 30 4.048 -8.719 0.425 1.00 0.00 C ATOM 397 C TYR A 30 5.330 -9.370 0.934 1.00 0.00 C ATOM 398 O TYR A 30 6.398 -8.758 0.920 1.00 0.00 O ATOM 399 CB TYR A 30 3.113 -8.421 1.599 1.00 0.00 C ATOM 400 CG TYR A 30 3.837 -8.203 2.908 1.00 0.00 C ATOM 401 CD1 TYR A 30 4.106 -9.267 3.761 1.00 0.00 C ATOM 402 CD2 TYR A 30 4.250 -6.934 3.294 1.00 0.00 C ATOM 403 CE1 TYR A 30 4.766 -9.072 4.959 1.00 0.00 C ATOM 404 CE2 TYR A 30 4.911 -6.730 4.489 1.00 0.00 C ATOM 405 CZ TYR A 30 5.167 -7.802 5.318 1.00 0.00 C ATOM 406 OH TYR A 30 5.825 -7.604 6.511 1.00 0.00 O ATOM 0 H TYR A 30 2.401 -9.770 -0.337 1.00 0.00 H new ATOM 0 HA TYR A 30 4.309 -7.784 -0.070 1.00 0.00 H new ATOM 0 HB2 TYR A 30 2.523 -7.534 1.367 1.00 0.00 H new ATOM 0 HB3 TYR A 30 2.413 -9.248 1.714 1.00 0.00 H new ATOM 0 HD1 TYR A 30 3.794 -10.263 3.483 1.00 0.00 H new ATOM 0 HD2 TYR A 30 4.050 -6.092 2.648 1.00 0.00 H new ATOM 0 HE1 TYR A 30 4.967 -9.909 5.611 1.00 0.00 H new ATOM 0 HE2 TYR A 30 5.226 -5.737 4.773 1.00 0.00 H new ATOM 0 HH TYR A 30 6.039 -6.653 6.613 1.00 0.00 H new ATOM 416 N ARG A 31 5.216 -10.615 1.383 1.00 0.00 N ATOM 417 CA ARG A 31 6.365 -11.351 1.898 1.00 0.00 C ATOM 418 C ARG A 31 7.592 -11.127 1.018 1.00 0.00 C ATOM 419 O ARG A 31 8.618 -10.627 1.479 1.00 0.00 O ATOM 420 CB ARG A 31 6.047 -12.845 1.978 1.00 0.00 C ATOM 421 CG ARG A 31 4.992 -13.188 3.016 1.00 0.00 C ATOM 422 CD ARG A 31 5.190 -14.590 3.570 1.00 0.00 C ATOM 423 NE ARG A 31 6.070 -14.599 4.736 1.00 0.00 N ATOM 424 CZ ARG A 31 6.824 -15.637 5.078 1.00 0.00 C ATOM 425 NH1 ARG A 31 6.807 -16.744 4.348 1.00 0.00 N ATOM 426 NH2 ARG A 31 7.599 -15.569 6.153 1.00 0.00 N ATOM 0 H ARG A 31 4.339 -11.136 1.401 1.00 0.00 H new ATOM 0 HA ARG A 31 6.584 -10.980 2.899 1.00 0.00 H new ATOM 0 HB2 ARG A 31 5.708 -13.189 1.001 1.00 0.00 H new ATOM 0 HB3 ARG A 31 6.962 -13.391 2.208 1.00 0.00 H new ATOM 0 HG2 ARG A 31 5.033 -12.465 3.830 1.00 0.00 H new ATOM 0 HG3 ARG A 31 4.001 -13.109 2.569 1.00 0.00 H new ATOM 0 HD2 ARG A 31 4.223 -15.012 3.843 1.00 0.00 H new ATOM 0 HD3 ARG A 31 5.610 -15.230 2.794 1.00 0.00 H new ATOM 0 HE ARG A 31 6.107 -13.763 5.319 1.00 0.00 H new ATOM 0 HH11 ARG A 31 6.213 -16.800 3.521 1.00 0.00 H new ATOM 0 HH12 ARG A 31 7.388 -17.539 4.614 1.00 0.00 H new ATOM 0 HH21 ARG A 31 7.616 -14.719 6.717 1.00 0.00 H new ATOM 0 HH22 ARG A 31 8.178 -16.367 6.415 1.00 0.00 H new ATOM 440 N LYS A 32 7.479 -11.502 -0.252 1.00 0.00 N ATOM 441 CA LYS A 32 8.577 -11.343 -1.198 1.00 0.00 C ATOM 442 C LYS A 32 9.001 -9.881 -1.298 1.00 0.00 C ATOM 443 O LYS A 32 10.192 -9.567 -1.282 1.00 0.00 O ATOM 444 CB LYS A 32 8.168 -11.862 -2.578 1.00 0.00 C ATOM 445 CG LYS A 32 7.569 -13.257 -2.550 1.00 0.00 C ATOM 446 CD LYS A 32 8.560 -14.279 -2.018 1.00 0.00 C ATOM 447 CE LYS A 32 8.325 -15.653 -2.626 1.00 0.00 C ATOM 448 NZ LYS A 32 8.857 -16.742 -1.761 1.00 0.00 N ATOM 0 H LYS A 32 6.637 -11.918 -0.650 1.00 0.00 H new ATOM 0 HA LYS A 32 9.424 -11.925 -0.834 1.00 0.00 H new ATOM 0 HB2 LYS A 32 7.445 -11.174 -3.016 1.00 0.00 H new ATOM 0 HB3 LYS A 32 9.042 -11.864 -3.230 1.00 0.00 H new ATOM 0 HG2 LYS A 32 6.675 -13.257 -1.927 1.00 0.00 H new ATOM 0 HG3 LYS A 32 7.257 -13.540 -3.555 1.00 0.00 H new ATOM 0 HD2 LYS A 32 9.576 -13.951 -2.239 1.00 0.00 H new ATOM 0 HD3 LYS A 32 8.474 -14.341 -0.933 1.00 0.00 H new ATOM 0 HE2 LYS A 32 7.257 -15.803 -2.782 1.00 0.00 H new ATOM 0 HE3 LYS A 32 8.800 -15.703 -3.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 8.677 -17.662 -2.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 9.881 -16.614 -1.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 8.385 -16.711 -0.835 1.00 0.00 H new ATOM 462 N LEU A 33 8.020 -8.991 -1.400 1.00 0.00 N ATOM 463 CA LEU A 33 8.291 -7.561 -1.501 1.00 0.00 C ATOM 464 C LEU A 33 9.195 -7.097 -0.364 1.00 0.00 C ATOM 465 O LEU A 33 10.286 -6.576 -0.597 1.00 0.00 O ATOM 466 CB LEU A 33 6.982 -6.771 -1.482 1.00 0.00 C ATOM 467 CG LEU A 33 6.282 -6.599 -2.831 1.00 0.00 C ATOM 468 CD1 LEU A 33 4.852 -6.120 -2.633 1.00 0.00 C ATOM 469 CD2 LEU A 33 7.054 -5.629 -3.713 1.00 0.00 C ATOM 0 H LEU A 33 7.030 -9.234 -1.415 1.00 0.00 H new ATOM 0 HA LEU A 33 8.804 -7.379 -2.446 1.00 0.00 H new ATOM 0 HB2 LEU A 33 6.292 -7.266 -0.798 1.00 0.00 H new ATOM 0 HB3 LEU A 33 7.184 -5.782 -1.071 1.00 0.00 H new ATOM 0 HG LEU A 33 6.253 -7.568 -3.330 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.370 -6.003 -3.604 1.00 0.00 H new ATOM 0 HD12 LEU A 33 4.302 -6.851 -2.040 1.00 0.00 H new ATOM 0 HD13 LEU A 33 4.858 -5.162 -2.113 1.00 0.00 H new ATOM 0 HD21 LEU A 33 6.541 -5.519 -4.669 1.00 0.00 H new ATOM 0 HD22 LEU A 33 7.115 -4.659 -3.220 1.00 0.00 H new ATOM 0 HD23 LEU A 33 8.060 -6.013 -3.883 1.00 0.00 H new ATOM 481 N ALA A 34 8.735 -7.290 0.868 1.00 0.00 N ATOM 482 CA ALA A 34 9.503 -6.895 2.042 1.00 0.00 C ATOM 483 C ALA A 34 10.997 -7.097 1.813 1.00 0.00 C ATOM 484 O ALA A 34 11.814 -6.264 2.208 1.00 0.00 O ATOM 485 CB ALA A 34 9.044 -7.679 3.262 1.00 0.00 C ATOM 0 H ALA A 34 7.833 -7.718 1.079 1.00 0.00 H new ATOM 0 HA ALA A 34 9.329 -5.834 2.219 1.00 0.00 H new ATOM 0 HB1 ALA A 34 9.626 -7.373 4.131 1.00 0.00 H new ATOM 0 HB2 ALA A 34 7.988 -7.481 3.445 1.00 0.00 H new ATOM 0 HB3 ALA A 34 9.188 -8.745 3.085 1.00 0.00 H new ATOM 491 N LEU A 35 11.349 -8.207 1.173 1.00 0.00 N ATOM 492 CA LEU A 35 12.746 -8.518 0.892 1.00 0.00 C ATOM 493 C LEU A 35 13.244 -7.738 -0.321 1.00 0.00 C ATOM 494 O LEU A 35 14.382 -7.268 -0.344 1.00 0.00 O ATOM 495 CB LEU A 35 12.916 -10.019 0.652 1.00 0.00 C ATOM 496 CG LEU A 35 13.221 -10.866 1.888 1.00 0.00 C ATOM 497 CD1 LEU A 35 12.735 -12.293 1.691 1.00 0.00 C ATOM 498 CD2 LEU A 35 14.711 -10.845 2.195 1.00 0.00 C ATOM 0 H LEU A 35 10.686 -8.906 0.839 1.00 0.00 H new ATOM 0 HA LEU A 35 13.339 -8.225 1.758 1.00 0.00 H new ATOM 0 HB2 LEU A 35 12.004 -10.399 0.192 1.00 0.00 H new ATOM 0 HB3 LEU A 35 13.720 -10.162 -0.070 1.00 0.00 H new ATOM 0 HG LEU A 35 12.690 -10.438 2.738 1.00 0.00 H new ATOM 0 HD11 LEU A 35 12.961 -12.880 2.581 1.00 0.00 H new ATOM 0 HD12 LEU A 35 11.658 -12.291 1.522 1.00 0.00 H new ATOM 0 HD13 LEU A 35 13.237 -12.733 0.829 1.00 0.00 H new ATOM 0 HD21 LEU A 35 14.909 -11.453 3.078 1.00 0.00 H new ATOM 0 HD22 LEU A 35 15.263 -11.247 1.346 1.00 0.00 H new ATOM 0 HD23 LEU A 35 15.030 -9.819 2.382 1.00 0.00 H new ATOM 510 N ARG A 36 12.385 -7.603 -1.325 1.00 0.00 N ATOM 511 CA ARG A 36 12.737 -6.879 -2.540 1.00 0.00 C ATOM 512 C ARG A 36 13.069 -5.423 -2.229 1.00 0.00 C ATOM 513 O ARG A 36 14.110 -4.911 -2.641 1.00 0.00 O ATOM 514 CB ARG A 36 11.591 -6.947 -3.551 1.00 0.00 C ATOM 515 CG ARG A 36 11.982 -6.494 -4.948 1.00 0.00 C ATOM 516 CD ARG A 36 12.079 -4.979 -5.036 1.00 0.00 C ATOM 517 NE ARG A 36 12.033 -4.507 -6.417 1.00 0.00 N ATOM 518 CZ ARG A 36 10.927 -4.491 -7.152 1.00 0.00 C ATOM 519 NH1 ARG A 36 9.781 -4.917 -6.640 1.00 0.00 N ATOM 520 NH2 ARG A 36 10.966 -4.046 -8.402 1.00 0.00 N ATOM 0 H ARG A 36 11.440 -7.986 -1.321 1.00 0.00 H new ATOM 0 HA ARG A 36 13.620 -7.351 -2.970 1.00 0.00 H new ATOM 0 HB2 ARG A 36 11.222 -7.972 -3.601 1.00 0.00 H new ATOM 0 HB3 ARG A 36 10.767 -6.328 -3.195 1.00 0.00 H new ATOM 0 HG2 ARG A 36 12.940 -6.937 -5.221 1.00 0.00 H new ATOM 0 HG3 ARG A 36 11.247 -6.855 -5.668 1.00 0.00 H new ATOM 0 HD2 ARG A 36 11.261 -4.530 -4.472 1.00 0.00 H new ATOM 0 HD3 ARG A 36 13.007 -4.648 -4.570 1.00 0.00 H new ATOM 0 HE ARG A 36 12.898 -4.171 -6.841 1.00 0.00 H new ATOM 0 HH11 ARG A 36 9.747 -5.258 -5.679 1.00 0.00 H new ATOM 0 HH12 ARG A 36 8.933 -4.904 -7.207 1.00 0.00 H new ATOM 0 HH21 ARG A 36 11.846 -3.716 -8.799 1.00 0.00 H new ATOM 0 HH22 ARG A 36 10.116 -4.034 -8.966 1.00 0.00 H new ATOM 534 N TRP A 37 12.178 -4.762 -1.500 1.00 0.00 N ATOM 535 CA TRP A 37 12.376 -3.364 -1.133 1.00 0.00 C ATOM 536 C TRP A 37 13.206 -3.247 0.140 1.00 0.00 C ATOM 537 O TRP A 37 13.272 -2.182 0.754 1.00 0.00 O ATOM 538 CB TRP A 37 11.027 -2.669 -0.943 1.00 0.00 C ATOM 539 CG TRP A 37 10.413 -2.200 -2.228 1.00 0.00 C ATOM 540 CD1 TRP A 37 9.351 -2.759 -2.880 1.00 0.00 C ATOM 541 CD2 TRP A 37 10.826 -1.079 -3.016 1.00 0.00 C ATOM 542 NE1 TRP A 37 9.079 -2.052 -4.027 1.00 0.00 N ATOM 543 CE2 TRP A 37 9.969 -1.016 -4.132 1.00 0.00 C ATOM 544 CE3 TRP A 37 11.835 -0.120 -2.886 1.00 0.00 C ATOM 545 CZ2 TRP A 37 10.093 -0.033 -5.111 1.00 0.00 C ATOM 546 CZ3 TRP A 37 11.957 0.854 -3.858 1.00 0.00 C ATOM 547 CH2 TRP A 37 11.090 0.892 -4.958 1.00 0.00 C ATOM 0 H TRP A 37 11.311 -5.171 -1.151 1.00 0.00 H new ATOM 0 HA TRP A 37 12.917 -2.875 -1.943 1.00 0.00 H new ATOM 0 HB2 TRP A 37 10.339 -3.356 -0.450 1.00 0.00 H new ATOM 0 HB3 TRP A 37 11.157 -1.815 -0.278 1.00 0.00 H new ATOM 0 HD1 TRP A 37 8.805 -3.628 -2.544 1.00 0.00 H new ATOM 0 HE1 TRP A 37 8.335 -2.264 -4.692 1.00 0.00 H new ATOM 0 HE3 TRP A 37 12.507 -0.140 -2.041 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 9.426 -0.002 -5.960 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 12.734 1.599 -3.768 1.00 0.00 H new ATOM 0 HH2 TRP A 37 11.211 1.667 -5.700 1.00 0.00 H new ATOM 558 N HIS A 38 13.838 -4.349 0.533 1.00 0.00 N ATOM 559 CA HIS A 38 14.665 -4.369 1.734 1.00 0.00 C ATOM 560 C HIS A 38 15.892 -3.478 1.564 1.00 0.00 C ATOM 561 O HIS A 38 16.517 -3.436 0.504 1.00 0.00 O ATOM 562 CB HIS A 38 15.100 -5.799 2.055 1.00 0.00 C ATOM 563 CG HIS A 38 15.409 -6.019 3.504 1.00 0.00 C ATOM 564 ND1 HIS A 38 16.652 -5.782 4.053 1.00 0.00 N ATOM 565 CD2 HIS A 38 14.628 -6.457 4.520 1.00 0.00 C ATOM 566 CE1 HIS A 38 16.622 -6.065 5.343 1.00 0.00 C ATOM 567 NE2 HIS A 38 15.405 -6.476 5.652 1.00 0.00 N ATOM 0 H HIS A 38 13.793 -5.239 0.037 1.00 0.00 H new ATOM 0 HA HIS A 38 14.070 -3.983 2.562 1.00 0.00 H new ATOM 0 HB2 HIS A 38 14.311 -6.487 1.752 1.00 0.00 H new ATOM 0 HB3 HIS A 38 15.982 -6.044 1.463 1.00 0.00 H new ATOM 0 HD2 HIS A 38 13.588 -6.739 4.452 1.00 0.00 H new ATOM 0 HE1 HIS A 38 17.452 -5.976 6.029 1.00 0.00 H new ATOM 0 HE2 HIS A 38 15.093 -6.761 6.580 1.00 0.00 H new ATOM 575 N PRO A 39 16.246 -2.747 2.631 1.00 0.00 N ATOM 576 CA PRO A 39 17.401 -1.843 2.624 1.00 0.00 C ATOM 577 C PRO A 39 18.726 -2.596 2.578 1.00 0.00 C ATOM 578 O PRO A 39 19.663 -2.180 1.896 1.00 0.00 O ATOM 579 CB PRO A 39 17.264 -1.083 3.946 1.00 0.00 C ATOM 580 CG PRO A 39 16.487 -1.997 4.830 1.00 0.00 C ATOM 581 CD PRO A 39 15.547 -2.747 3.927 1.00 0.00 C ATOM 0 HA PRO A 39 17.409 -1.199 1.745 1.00 0.00 H new ATOM 0 HB2 PRO A 39 18.240 -0.854 4.374 1.00 0.00 H new ATOM 0 HB3 PRO A 39 16.747 -0.134 3.805 1.00 0.00 H new ATOM 0 HG2 PRO A 39 17.148 -2.682 5.361 1.00 0.00 H new ATOM 0 HG3 PRO A 39 15.937 -1.435 5.585 1.00 0.00 H new ATOM 0 HD2 PRO A 39 15.367 -3.760 4.287 1.00 0.00 H new ATOM 0 HD3 PRO A 39 14.576 -2.256 3.860 1.00 0.00 H new ATOM 589 N ASP A 40 18.797 -3.705 3.305 1.00 0.00 N ATOM 590 CA ASP A 40 20.007 -4.517 3.345 1.00 0.00 C ATOM 591 C ASP A 40 20.287 -5.144 1.983 1.00 0.00 C ATOM 592 O ASP A 40 21.439 -5.254 1.562 1.00 0.00 O ATOM 593 CB ASP A 40 19.878 -5.611 4.407 1.00 0.00 C ATOM 594 CG ASP A 40 21.045 -6.579 4.386 1.00 0.00 C ATOM 595 OD1 ASP A 40 21.376 -7.086 3.293 1.00 0.00 O ATOM 596 OD2 ASP A 40 21.629 -6.827 5.461 1.00 0.00 O ATOM 0 H ASP A 40 18.030 -4.063 3.875 1.00 0.00 H new ATOM 0 HA ASP A 40 20.842 -3.866 3.604 1.00 0.00 H new ATOM 0 HB2 ASP A 40 19.810 -5.150 5.392 1.00 0.00 H new ATOM 0 HB3 ASP A 40 18.951 -6.161 4.247 1.00 0.00 H new ATOM 601 N LYS A 41 19.225 -5.554 1.297 1.00 0.00 N ATOM 602 CA LYS A 41 19.355 -6.170 -0.018 1.00 0.00 C ATOM 603 C LYS A 41 19.787 -5.143 -1.060 1.00 0.00 C ATOM 604 O LYS A 41 20.309 -5.498 -2.115 1.00 0.00 O ATOM 605 CB LYS A 41 18.030 -6.811 -0.437 1.00 0.00 C ATOM 606 CG LYS A 41 17.628 -7.996 0.424 1.00 0.00 C ATOM 607 CD LYS A 41 18.382 -9.254 0.026 1.00 0.00 C ATOM 608 CE LYS A 41 17.668 -10.003 -1.088 1.00 0.00 C ATOM 609 NZ LYS A 41 18.260 -11.350 -1.320 1.00 0.00 N ATOM 0 H LYS A 41 18.265 -5.471 1.630 1.00 0.00 H new ATOM 0 HA LYS A 41 20.122 -6.942 0.045 1.00 0.00 H new ATOM 0 HB2 LYS A 41 17.243 -6.058 -0.395 1.00 0.00 H new ATOM 0 HB3 LYS A 41 18.105 -7.136 -1.475 1.00 0.00 H new ATOM 0 HG2 LYS A 41 17.824 -7.769 1.472 1.00 0.00 H new ATOM 0 HG3 LYS A 41 16.556 -8.168 0.330 1.00 0.00 H new ATOM 0 HD2 LYS A 41 19.388 -8.989 -0.299 1.00 0.00 H new ATOM 0 HD3 LYS A 41 18.489 -9.905 0.894 1.00 0.00 H new ATOM 0 HE2 LYS A 41 16.613 -10.109 -0.836 1.00 0.00 H new ATOM 0 HE3 LYS A 41 17.719 -9.421 -2.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 17.745 -11.828 -2.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 19.260 -11.248 -1.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 18.188 -11.915 -0.450 1.00 0.00 H new ATOM 623 N ASN A 42 19.565 -3.868 -0.754 1.00 0.00 N ATOM 624 CA ASN A 42 19.933 -2.790 -1.664 1.00 0.00 C ATOM 625 C ASN A 42 21.133 -2.012 -1.131 1.00 0.00 C ATOM 626 O ASN A 42 21.014 -1.178 -0.233 1.00 0.00 O ATOM 627 CB ASN A 42 18.749 -1.843 -1.871 1.00 0.00 C ATOM 628 CG ASN A 42 17.647 -2.468 -2.704 1.00 0.00 C ATOM 629 OD1 ASN A 42 17.802 -2.666 -3.910 1.00 0.00 O ATOM 630 ND2 ASN A 42 16.527 -2.782 -2.064 1.00 0.00 N ATOM 0 H ASN A 42 19.133 -3.557 0.116 1.00 0.00 H new ATOM 0 HA ASN A 42 20.207 -3.234 -2.621 1.00 0.00 H new ATOM 0 HB2 ASN A 42 18.346 -1.552 -0.901 1.00 0.00 H new ATOM 0 HB3 ASN A 42 19.097 -0.932 -2.358 1.00 0.00 H new ATOM 0 HD21 ASN A 42 15.751 -3.205 -2.572 1.00 0.00 H new ATOM 0 HD22 ASN A 42 16.443 -2.600 -1.064 1.00 0.00 H new ATOM 637 N PRO A 43 22.317 -2.291 -1.696 1.00 0.00 N ATOM 638 CA PRO A 43 23.561 -1.628 -1.294 1.00 0.00 C ATOM 639 C PRO A 43 23.597 -0.162 -1.709 1.00 0.00 C ATOM 640 O PRO A 43 23.883 0.717 -0.895 1.00 0.00 O ATOM 641 CB PRO A 43 24.640 -2.421 -2.035 1.00 0.00 C ATOM 642 CG PRO A 43 23.942 -2.999 -3.217 1.00 0.00 C ATOM 643 CD PRO A 43 22.532 -3.274 -2.771 1.00 0.00 C ATOM 0 HA PRO A 43 23.687 -1.619 -0.211 1.00 0.00 H new ATOM 0 HB2 PRO A 43 25.466 -1.777 -2.339 1.00 0.00 H new ATOM 0 HB3 PRO A 43 25.061 -3.203 -1.403 1.00 0.00 H new ATOM 0 HG2 PRO A 43 23.957 -2.305 -4.057 1.00 0.00 H new ATOM 0 HG3 PRO A 43 24.431 -3.914 -3.550 1.00 0.00 H new ATOM 0 HD2 PRO A 43 21.820 -3.141 -3.585 1.00 0.00 H new ATOM 0 HD3 PRO A 43 22.417 -4.296 -2.410 1.00 0.00 H new ATOM 651 N ASP A 44 23.306 0.096 -2.979 1.00 0.00 N ATOM 652 CA ASP A 44 23.304 1.457 -3.502 1.00 0.00 C ATOM 653 C ASP A 44 22.444 2.371 -2.635 1.00 0.00 C ATOM 654 O ASP A 44 22.922 3.377 -2.113 1.00 0.00 O ATOM 655 CB ASP A 44 22.792 1.471 -4.944 1.00 0.00 C ATOM 656 CG ASP A 44 23.433 0.395 -5.797 1.00 0.00 C ATOM 657 OD1 ASP A 44 24.677 0.287 -5.779 1.00 0.00 O ATOM 658 OD2 ASP A 44 22.691 -0.340 -6.483 1.00 0.00 O ATOM 0 H ASP A 44 23.068 -0.620 -3.666 1.00 0.00 H new ATOM 0 HA ASP A 44 24.329 1.828 -3.485 1.00 0.00 H new ATOM 0 HB2 ASP A 44 21.711 1.334 -4.944 1.00 0.00 H new ATOM 0 HB3 ASP A 44 22.989 2.447 -5.387 1.00 0.00 H new ATOM 663 N ASN A 45 21.172 2.014 -2.487 1.00 0.00 N ATOM 664 CA ASN A 45 20.245 2.803 -1.685 1.00 0.00 C ATOM 665 C ASN A 45 19.684 1.977 -0.531 1.00 0.00 C ATOM 666 O ASN A 45 18.883 1.065 -0.738 1.00 0.00 O ATOM 667 CB ASN A 45 19.101 3.326 -2.556 1.00 0.00 C ATOM 668 CG ASN A 45 18.350 2.209 -3.254 1.00 0.00 C ATOM 669 OD1 ASN A 45 18.954 1.307 -3.835 1.00 0.00 O ATOM 670 ND2 ASN A 45 17.024 2.264 -3.201 1.00 0.00 N ATOM 0 H ASN A 45 20.760 1.183 -2.912 1.00 0.00 H new ATOM 0 HA ASN A 45 20.793 3.649 -1.270 1.00 0.00 H new ATOM 0 HB2 ASN A 45 18.407 3.895 -1.937 1.00 0.00 H new ATOM 0 HB3 ASN A 45 19.500 4.013 -3.302 1.00 0.00 H new ATOM 0 HD21 ASN A 45 16.465 1.540 -3.653 1.00 0.00 H new ATOM 0 HD22 ASN A 45 16.565 3.030 -2.708 1.00 0.00 H new ATOM 677 N LYS A 46 20.111 2.302 0.684 1.00 0.00 N ATOM 678 CA LYS A 46 19.651 1.592 1.872 1.00 0.00 C ATOM 679 C LYS A 46 18.438 2.286 2.485 1.00 0.00 C ATOM 680 O LYS A 46 17.397 1.664 2.693 1.00 0.00 O ATOM 681 CB LYS A 46 20.776 1.502 2.905 1.00 0.00 C ATOM 682 CG LYS A 46 21.653 0.272 2.744 1.00 0.00 C ATOM 683 CD LYS A 46 22.827 0.542 1.818 1.00 0.00 C ATOM 684 CE LYS A 46 24.021 -0.335 2.163 1.00 0.00 C ATOM 685 NZ LYS A 46 25.294 0.227 1.633 1.00 0.00 N ATOM 0 H LYS A 46 20.775 3.053 0.872 1.00 0.00 H new ATOM 0 HA LYS A 46 19.359 0.585 1.573 1.00 0.00 H new ATOM 0 HB2 LYS A 46 21.398 2.394 2.831 1.00 0.00 H new ATOM 0 HB3 LYS A 46 20.341 1.499 3.904 1.00 0.00 H new ATOM 0 HG2 LYS A 46 22.023 -0.043 3.720 1.00 0.00 H new ATOM 0 HG3 LYS A 46 21.058 -0.551 2.348 1.00 0.00 H new ATOM 0 HD2 LYS A 46 22.527 0.361 0.786 1.00 0.00 H new ATOM 0 HD3 LYS A 46 23.113 1.592 1.887 1.00 0.00 H new ATOM 0 HE2 LYS A 46 24.093 -0.440 3.245 1.00 0.00 H new ATOM 0 HE3 LYS A 46 23.868 -1.334 1.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 26.034 -0.503 1.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 25.153 0.540 0.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 25.585 1.037 2.217 1.00 0.00 H new ATOM 699 N GLU A 47 18.582 3.576 2.771 1.00 0.00 N ATOM 700 CA GLU A 47 17.497 4.353 3.359 1.00 0.00 C ATOM 701 C GLU A 47 16.265 4.337 2.458 1.00 0.00 C ATOM 702 O GLU A 47 15.209 3.838 2.843 1.00 0.00 O ATOM 703 CB GLU A 47 17.946 5.795 3.602 1.00 0.00 C ATOM 704 CG GLU A 47 17.072 6.546 4.593 1.00 0.00 C ATOM 705 CD GLU A 47 17.533 6.370 6.027 1.00 0.00 C ATOM 706 OE1 GLU A 47 17.192 5.335 6.637 1.00 0.00 O ATOM 707 OE2 GLU A 47 18.236 7.267 6.538 1.00 0.00 O ATOM 0 H GLU A 47 19.438 4.105 2.605 1.00 0.00 H new ATOM 0 HA GLU A 47 17.234 3.896 4.313 1.00 0.00 H new ATOM 0 HB2 GLU A 47 18.973 5.790 3.967 1.00 0.00 H new ATOM 0 HB3 GLU A 47 17.948 6.331 2.653 1.00 0.00 H new ATOM 0 HG2 GLU A 47 17.074 7.607 4.342 1.00 0.00 H new ATOM 0 HG3 GLU A 47 16.043 6.198 4.501 1.00 0.00 H new ATOM 714 N GLU A 48 16.411 4.887 1.256 1.00 0.00 N ATOM 715 CA GLU A 48 15.310 4.937 0.301 1.00 0.00 C ATOM 716 C GLU A 48 14.471 3.664 0.372 1.00 0.00 C ATOM 717 O GLU A 48 13.272 3.714 0.644 1.00 0.00 O ATOM 718 CB GLU A 48 15.847 5.129 -1.119 1.00 0.00 C ATOM 719 CG GLU A 48 14.766 5.102 -2.187 1.00 0.00 C ATOM 720 CD GLU A 48 15.133 5.919 -3.410 1.00 0.00 C ATOM 721 OE1 GLU A 48 15.935 6.866 -3.271 1.00 0.00 O ATOM 722 OE2 GLU A 48 14.619 5.611 -4.506 1.00 0.00 O ATOM 0 H GLU A 48 17.280 5.304 0.921 1.00 0.00 H new ATOM 0 HA GLU A 48 14.675 5.785 0.560 1.00 0.00 H new ATOM 0 HB2 GLU A 48 16.376 6.081 -1.173 1.00 0.00 H new ATOM 0 HB3 GLU A 48 16.576 4.347 -1.332 1.00 0.00 H new ATOM 0 HG2 GLU A 48 14.582 4.070 -2.486 1.00 0.00 H new ATOM 0 HG3 GLU A 48 13.835 5.483 -1.766 1.00 0.00 H new ATOM 729 N ALA A 49 15.110 2.526 0.123 1.00 0.00 N ATOM 730 CA ALA A 49 14.423 1.241 0.160 1.00 0.00 C ATOM 731 C ALA A 49 13.670 1.058 1.473 1.00 0.00 C ATOM 732 O ALA A 49 12.533 0.589 1.486 1.00 0.00 O ATOM 733 CB ALA A 49 15.416 0.106 -0.044 1.00 0.00 C ATOM 0 H ALA A 49 16.102 2.468 -0.106 1.00 0.00 H new ATOM 0 HA ALA A 49 13.695 1.223 -0.651 1.00 0.00 H new ATOM 0 HB1 ALA A 49 14.889 -0.848 -0.014 1.00 0.00 H new ATOM 0 HB2 ALA A 49 15.905 0.220 -1.011 1.00 0.00 H new ATOM 0 HB3 ALA A 49 16.165 0.132 0.747 1.00 0.00 H new ATOM 739 N GLU A 50 14.313 1.430 2.576 1.00 0.00 N ATOM 740 CA GLU A 50 13.703 1.305 3.894 1.00 0.00 C ATOM 741 C GLU A 50 12.310 1.928 3.910 1.00 0.00 C ATOM 742 O GLU A 50 11.335 1.287 4.303 1.00 0.00 O ATOM 743 CB GLU A 50 14.584 1.971 4.953 1.00 0.00 C ATOM 744 CG GLU A 50 14.340 1.453 6.361 1.00 0.00 C ATOM 745 CD GLU A 50 15.181 2.168 7.400 1.00 0.00 C ATOM 746 OE1 GLU A 50 16.422 2.027 7.357 1.00 0.00 O ATOM 747 OE2 GLU A 50 14.601 2.868 8.255 1.00 0.00 O ATOM 0 H GLU A 50 15.255 1.820 2.582 1.00 0.00 H new ATOM 0 HA GLU A 50 13.610 0.244 4.124 1.00 0.00 H new ATOM 0 HB2 GLU A 50 15.631 1.814 4.694 1.00 0.00 H new ATOM 0 HB3 GLU A 50 14.409 3.047 4.935 1.00 0.00 H new ATOM 0 HG2 GLU A 50 13.285 1.570 6.609 1.00 0.00 H new ATOM 0 HG3 GLU A 50 14.558 0.386 6.394 1.00 0.00 H new ATOM 754 N LYS A 51 12.224 3.183 3.481 1.00 0.00 N ATOM 755 CA LYS A 51 10.952 3.894 3.445 1.00 0.00 C ATOM 756 C LYS A 51 9.844 3.000 2.897 1.00 0.00 C ATOM 757 O LYS A 51 8.850 2.740 3.575 1.00 0.00 O ATOM 758 CB LYS A 51 11.074 5.156 2.588 1.00 0.00 C ATOM 759 CG LYS A 51 9.742 5.823 2.293 1.00 0.00 C ATOM 760 CD LYS A 51 9.070 6.312 3.565 1.00 0.00 C ATOM 761 CE LYS A 51 7.970 7.318 3.263 1.00 0.00 C ATOM 762 NZ LYS A 51 8.519 8.676 2.994 1.00 0.00 N ATOM 0 H LYS A 51 13.021 3.729 3.153 1.00 0.00 H new ATOM 0 HA LYS A 51 10.694 4.178 4.465 1.00 0.00 H new ATOM 0 HB2 LYS A 51 11.723 5.869 3.097 1.00 0.00 H new ATOM 0 HB3 LYS A 51 11.559 4.900 1.646 1.00 0.00 H new ATOM 0 HG2 LYS A 51 9.897 6.663 1.616 1.00 0.00 H new ATOM 0 HG3 LYS A 51 9.086 5.118 1.782 1.00 0.00 H new ATOM 0 HD2 LYS A 51 8.650 5.463 4.105 1.00 0.00 H new ATOM 0 HD3 LYS A 51 9.813 6.769 4.218 1.00 0.00 H new ATOM 0 HE2 LYS A 51 7.396 6.981 2.400 1.00 0.00 H new ATOM 0 HE3 LYS A 51 7.280 7.366 4.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 7.738 9.333 2.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 9.045 9.009 3.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 9.158 8.636 2.174 1.00 0.00 H new ATOM 776 N LYS A 52 10.022 2.531 1.667 1.00 0.00 N ATOM 777 CA LYS A 52 9.040 1.663 1.028 1.00 0.00 C ATOM 778 C LYS A 52 8.644 0.517 1.953 1.00 0.00 C ATOM 779 O LYS A 52 7.466 0.174 2.064 1.00 0.00 O ATOM 780 CB LYS A 52 9.597 1.106 -0.283 1.00 0.00 C ATOM 781 CG LYS A 52 9.790 2.160 -1.359 1.00 0.00 C ATOM 782 CD LYS A 52 8.536 2.335 -2.200 1.00 0.00 C ATOM 783 CE LYS A 52 8.862 2.882 -3.581 1.00 0.00 C ATOM 784 NZ LYS A 52 7.692 3.567 -4.197 1.00 0.00 N ATOM 0 H LYS A 52 10.839 2.738 1.092 1.00 0.00 H new ATOM 0 HA LYS A 52 8.152 2.257 0.814 1.00 0.00 H new ATOM 0 HB2 LYS A 52 10.553 0.622 -0.085 1.00 0.00 H new ATOM 0 HB3 LYS A 52 8.922 0.337 -0.657 1.00 0.00 H new ATOM 0 HG2 LYS A 52 10.054 3.111 -0.895 1.00 0.00 H new ATOM 0 HG3 LYS A 52 10.624 1.877 -2.002 1.00 0.00 H new ATOM 0 HD2 LYS A 52 8.026 1.377 -2.298 1.00 0.00 H new ATOM 0 HD3 LYS A 52 7.848 3.011 -1.693 1.00 0.00 H new ATOM 0 HE2 LYS A 52 9.695 3.581 -3.507 1.00 0.00 H new ATOM 0 HE3 LYS A 52 9.187 2.067 -4.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 7.955 3.926 -5.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 6.905 2.893 -4.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 7.397 4.361 -3.594 1.00 0.00 H new ATOM 798 N PHE A 53 9.634 -0.071 2.617 1.00 0.00 N ATOM 799 CA PHE A 53 9.388 -1.179 3.532 1.00 0.00 C ATOM 800 C PHE A 53 8.153 -0.914 4.388 1.00 0.00 C ATOM 801 O PHE A 53 7.289 -1.778 4.538 1.00 0.00 O ATOM 802 CB PHE A 53 10.606 -1.405 4.431 1.00 0.00 C ATOM 803 CG PHE A 53 10.578 -2.719 5.159 1.00 0.00 C ATOM 804 CD1 PHE A 53 10.908 -3.895 4.505 1.00 0.00 C ATOM 805 CD2 PHE A 53 10.222 -2.777 6.496 1.00 0.00 C ATOM 806 CE1 PHE A 53 10.882 -5.105 5.172 1.00 0.00 C ATOM 807 CE2 PHE A 53 10.195 -3.985 7.169 1.00 0.00 C ATOM 808 CZ PHE A 53 10.527 -5.150 6.506 1.00 0.00 C ATOM 0 H PHE A 53 10.614 0.202 2.538 1.00 0.00 H new ATOM 0 HA PHE A 53 9.211 -2.076 2.938 1.00 0.00 H new ATOM 0 HB2 PHE A 53 11.510 -1.354 3.824 1.00 0.00 H new ATOM 0 HB3 PHE A 53 10.665 -0.596 5.159 1.00 0.00 H new ATOM 0 HD1 PHE A 53 11.189 -3.866 3.463 1.00 0.00 H new ATOM 0 HD2 PHE A 53 9.962 -1.869 7.019 1.00 0.00 H new ATOM 0 HE1 PHE A 53 11.139 -6.015 4.650 1.00 0.00 H new ATOM 0 HE2 PHE A 53 9.915 -4.017 8.211 1.00 0.00 H new ATOM 0 HZ PHE A 53 10.509 -6.094 7.030 1.00 0.00 H new ATOM 818 N LYS A 54 8.076 0.289 4.948 1.00 0.00 N ATOM 819 CA LYS A 54 6.948 0.671 5.789 1.00 0.00 C ATOM 820 C LYS A 54 5.645 0.648 4.995 1.00 0.00 C ATOM 821 O LYS A 54 4.622 0.158 5.475 1.00 0.00 O ATOM 822 CB LYS A 54 7.173 2.065 6.379 1.00 0.00 C ATOM 823 CG LYS A 54 6.089 2.498 7.350 1.00 0.00 C ATOM 824 CD LYS A 54 6.320 1.921 8.737 1.00 0.00 C ATOM 825 CE LYS A 54 7.173 2.846 9.591 1.00 0.00 C ATOM 826 NZ LYS A 54 7.022 2.556 11.043 1.00 0.00 N ATOM 0 H LYS A 54 8.782 1.016 4.834 1.00 0.00 H new ATOM 0 HA LYS A 54 6.872 -0.052 6.601 1.00 0.00 H new ATOM 0 HB2 LYS A 54 8.135 2.082 6.891 1.00 0.00 H new ATOM 0 HB3 LYS A 54 7.231 2.789 5.566 1.00 0.00 H new ATOM 0 HG2 LYS A 54 6.064 3.586 7.407 1.00 0.00 H new ATOM 0 HG3 LYS A 54 5.116 2.176 6.978 1.00 0.00 H new ATOM 0 HD2 LYS A 54 5.361 1.754 9.227 1.00 0.00 H new ATOM 0 HD3 LYS A 54 6.808 0.950 8.652 1.00 0.00 H new ATOM 0 HE2 LYS A 54 8.220 2.740 9.307 1.00 0.00 H new ATOM 0 HE3 LYS A 54 6.893 3.881 9.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 7.619 3.208 11.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 6.028 2.681 11.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 7.314 1.576 11.233 1.00 0.00 H new ATOM 840 N LEU A 55 5.690 1.180 3.779 1.00 0.00 N ATOM 841 CA LEU A 55 4.514 1.219 2.917 1.00 0.00 C ATOM 842 C LEU A 55 4.043 -0.191 2.574 1.00 0.00 C ATOM 843 O LEU A 55 2.847 -0.481 2.601 1.00 0.00 O ATOM 844 CB LEU A 55 4.823 1.992 1.634 1.00 0.00 C ATOM 845 CG LEU A 55 4.719 3.515 1.726 1.00 0.00 C ATOM 846 CD1 LEU A 55 3.303 3.932 2.093 1.00 0.00 C ATOM 847 CD2 LEU A 55 5.716 4.057 2.740 1.00 0.00 C ATOM 0 H LEU A 55 6.528 1.590 3.367 1.00 0.00 H new ATOM 0 HA LEU A 55 3.715 1.728 3.457 1.00 0.00 H new ATOM 0 HB2 LEU A 55 5.833 1.736 1.313 1.00 0.00 H new ATOM 0 HB3 LEU A 55 4.144 1.648 0.854 1.00 0.00 H new ATOM 0 HG LEU A 55 4.958 3.936 0.750 1.00 0.00 H new ATOM 0 HD11 LEU A 55 3.248 5.019 2.154 1.00 0.00 H new ATOM 0 HD12 LEU A 55 2.610 3.576 1.331 1.00 0.00 H new ATOM 0 HD13 LEU A 55 3.035 3.501 3.057 1.00 0.00 H new ATOM 0 HD21 LEU A 55 5.628 5.142 2.792 1.00 0.00 H new ATOM 0 HD22 LEU A 55 5.508 3.628 3.720 1.00 0.00 H new ATOM 0 HD23 LEU A 55 6.728 3.789 2.435 1.00 0.00 H new ATOM 859 N VAL A 56 4.992 -1.065 2.252 1.00 0.00 N ATOM 860 CA VAL A 56 4.675 -2.445 1.907 1.00 0.00 C ATOM 861 C VAL A 56 3.948 -3.144 3.051 1.00 0.00 C ATOM 862 O VAL A 56 2.986 -3.881 2.831 1.00 0.00 O ATOM 863 CB VAL A 56 5.946 -3.242 1.558 1.00 0.00 C ATOM 864 CG1 VAL A 56 5.629 -4.725 1.435 1.00 0.00 C ATOM 865 CG2 VAL A 56 6.569 -2.714 0.275 1.00 0.00 C ATOM 0 H VAL A 56 5.987 -0.841 2.223 1.00 0.00 H new ATOM 0 HA VAL A 56 4.024 -2.412 1.033 1.00 0.00 H new ATOM 0 HB VAL A 56 6.667 -3.115 2.365 1.00 0.00 H new ATOM 0 HG11 VAL A 56 6.539 -5.272 1.188 1.00 0.00 H new ATOM 0 HG12 VAL A 56 5.230 -5.092 2.381 1.00 0.00 H new ATOM 0 HG13 VAL A 56 4.890 -4.875 0.648 1.00 0.00 H new ATOM 0 HG21 VAL A 56 7.466 -3.288 0.043 1.00 0.00 H new ATOM 0 HG22 VAL A 56 5.855 -2.810 -0.543 1.00 0.00 H new ATOM 0 HG23 VAL A 56 6.833 -1.664 0.404 1.00 0.00 H new ATOM 875 N SER A 57 4.414 -2.909 4.273 1.00 0.00 N ATOM 876 CA SER A 57 3.810 -3.519 5.452 1.00 0.00 C ATOM 877 C SER A 57 2.449 -2.896 5.749 1.00 0.00 C ATOM 878 O SER A 57 1.467 -3.604 5.968 1.00 0.00 O ATOM 879 CB SER A 57 4.732 -3.359 6.663 1.00 0.00 C ATOM 880 OG SER A 57 4.549 -2.097 7.280 1.00 0.00 O ATOM 0 H SER A 57 5.208 -2.301 4.473 1.00 0.00 H new ATOM 0 HA SER A 57 3.668 -4.581 5.250 1.00 0.00 H new ATOM 0 HB2 SER A 57 4.532 -4.152 7.384 1.00 0.00 H new ATOM 0 HB3 SER A 57 5.771 -3.467 6.350 1.00 0.00 H new ATOM 0 HG SER A 57 4.731 -1.386 6.631 1.00 0.00 H new ATOM 886 N GLU A 58 2.401 -1.568 5.754 1.00 0.00 N ATOM 887 CA GLU A 58 1.162 -0.850 6.025 1.00 0.00 C ATOM 888 C GLU A 58 0.090 -1.209 5.000 1.00 0.00 C ATOM 889 O GLU A 58 -1.006 -1.641 5.357 1.00 0.00 O ATOM 890 CB GLU A 58 1.408 0.660 6.013 1.00 0.00 C ATOM 891 CG GLU A 58 0.192 1.478 6.416 1.00 0.00 C ATOM 892 CD GLU A 58 0.562 2.848 6.953 1.00 0.00 C ATOM 893 OE1 GLU A 58 1.094 2.918 8.081 1.00 0.00 O ATOM 894 OE2 GLU A 58 0.320 3.848 6.246 1.00 0.00 O ATOM 0 H GLU A 58 3.206 -0.968 5.573 1.00 0.00 H new ATOM 0 HA GLU A 58 0.810 -1.146 7.013 1.00 0.00 H new ATOM 0 HB2 GLU A 58 2.231 0.891 6.689 1.00 0.00 H new ATOM 0 HB3 GLU A 58 1.723 0.960 5.014 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -0.465 1.595 5.554 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -0.372 0.935 7.174 1.00 0.00 H new ATOM 901 N ALA A 59 0.415 -1.027 3.724 1.00 0.00 N ATOM 902 CA ALA A 59 -0.519 -1.332 2.647 1.00 0.00 C ATOM 903 C ALA A 59 -1.035 -2.763 2.757 1.00 0.00 C ATOM 904 O ALA A 59 -2.243 -2.998 2.769 1.00 0.00 O ATOM 905 CB ALA A 59 0.144 -1.111 1.296 1.00 0.00 C ATOM 0 H ALA A 59 1.318 -0.670 3.411 1.00 0.00 H new ATOM 0 HA ALA A 59 -1.371 -0.658 2.736 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -0.565 -1.342 0.501 1.00 0.00 H new ATOM 0 HB2 ALA A 59 0.458 -0.071 1.211 1.00 0.00 H new ATOM 0 HB3 ALA A 59 1.014 -1.761 1.207 1.00 0.00 H new ATOM 911 N TYR A 60 -0.112 -3.715 2.837 1.00 0.00 N ATOM 912 CA TYR A 60 -0.474 -5.124 2.944 1.00 0.00 C ATOM 913 C TYR A 60 -1.657 -5.312 3.889 1.00 0.00 C ATOM 914 O TYR A 60 -2.564 -6.097 3.615 1.00 0.00 O ATOM 915 CB TYR A 60 0.721 -5.943 3.434 1.00 0.00 C ATOM 916 CG TYR A 60 0.341 -7.304 3.974 1.00 0.00 C ATOM 917 CD1 TYR A 60 -0.464 -8.165 3.239 1.00 0.00 C ATOM 918 CD2 TYR A 60 0.785 -7.726 5.221 1.00 0.00 C ATOM 919 CE1 TYR A 60 -0.814 -9.408 3.729 1.00 0.00 C ATOM 920 CE2 TYR A 60 0.441 -8.968 5.718 1.00 0.00 C ATOM 921 CZ TYR A 60 -0.359 -9.806 4.969 1.00 0.00 C ATOM 922 OH TYR A 60 -0.705 -11.043 5.461 1.00 0.00 O ATOM 0 H TYR A 60 0.892 -3.537 2.830 1.00 0.00 H new ATOM 0 HA TYR A 60 -0.764 -5.475 1.954 1.00 0.00 H new ATOM 0 HB2 TYR A 60 1.425 -6.071 2.612 1.00 0.00 H new ATOM 0 HB3 TYR A 60 1.239 -5.384 4.213 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -0.822 -7.857 2.268 1.00 0.00 H new ATOM 0 HD2 TYR A 60 1.409 -7.072 5.812 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -1.441 -10.065 3.144 1.00 0.00 H new ATOM 0 HE2 TYR A 60 0.797 -9.282 6.688 1.00 0.00 H new ATOM 0 HH TYR A 60 -0.302 -11.168 6.345 1.00 0.00 H new ATOM 932 N GLU A 61 -1.638 -4.586 5.002 1.00 0.00 N ATOM 933 CA GLU A 61 -2.708 -4.673 5.988 1.00 0.00 C ATOM 934 C GLU A 61 -3.942 -3.905 5.522 1.00 0.00 C ATOM 935 O GLU A 61 -5.060 -4.418 5.565 1.00 0.00 O ATOM 936 CB GLU A 61 -2.235 -4.128 7.337 1.00 0.00 C ATOM 937 CG GLU A 61 -0.993 -4.821 7.872 1.00 0.00 C ATOM 938 CD GLU A 61 -1.247 -6.270 8.242 1.00 0.00 C ATOM 939 OE1 GLU A 61 -2.305 -6.552 8.842 1.00 0.00 O ATOM 940 OE2 GLU A 61 -0.387 -7.120 7.930 1.00 0.00 O ATOM 0 H GLU A 61 -0.894 -3.931 5.243 1.00 0.00 H new ATOM 0 HA GLU A 61 -2.976 -5.723 6.102 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -2.031 -3.062 7.237 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -3.040 -4.232 8.064 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -0.204 -4.775 7.122 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -0.631 -4.284 8.749 1.00 0.00 H new ATOM 947 N VAL A 62 -3.730 -2.670 5.077 1.00 0.00 N ATOM 948 CA VAL A 62 -4.823 -1.830 4.602 1.00 0.00 C ATOM 949 C VAL A 62 -5.709 -2.586 3.619 1.00 0.00 C ATOM 950 O VAL A 62 -6.924 -2.386 3.580 1.00 0.00 O ATOM 951 CB VAL A 62 -4.295 -0.553 3.922 1.00 0.00 C ATOM 952 CG1 VAL A 62 -5.433 0.211 3.264 1.00 0.00 C ATOM 953 CG2 VAL A 62 -3.566 0.323 4.929 1.00 0.00 C ATOM 0 H VAL A 62 -2.811 -2.229 5.036 1.00 0.00 H new ATOM 0 HA VAL A 62 -5.411 -1.551 5.477 1.00 0.00 H new ATOM 0 HB VAL A 62 -3.587 -0.842 3.145 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.041 1.110 2.789 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.907 -0.419 2.512 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.168 0.491 4.019 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -3.199 1.221 4.432 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -4.251 0.605 5.729 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.725 -0.228 5.349 1.00 0.00 H new ATOM 963 N LEU A 63 -5.095 -3.457 2.825 1.00 0.00 N ATOM 964 CA LEU A 63 -5.828 -4.245 1.841 1.00 0.00 C ATOM 965 C LEU A 63 -6.329 -5.550 2.452 1.00 0.00 C ATOM 966 O LEU A 63 -7.492 -5.919 2.284 1.00 0.00 O ATOM 967 CB LEU A 63 -4.939 -4.543 0.632 1.00 0.00 C ATOM 968 CG LEU A 63 -4.285 -3.332 -0.034 1.00 0.00 C ATOM 969 CD1 LEU A 63 -3.349 -3.777 -1.148 1.00 0.00 C ATOM 970 CD2 LEU A 63 -5.345 -2.382 -0.573 1.00 0.00 C ATOM 0 H LEU A 63 -4.091 -3.635 2.844 1.00 0.00 H new ATOM 0 HA LEU A 63 -6.690 -3.663 1.516 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -4.152 -5.229 0.945 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.538 -5.064 -0.115 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.698 -2.801 0.716 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -2.892 -2.902 -1.611 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -2.570 -4.417 -0.734 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -3.914 -4.331 -1.898 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -4.861 -1.526 -1.043 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -5.959 -2.901 -1.309 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -5.975 -2.037 0.247 1.00 0.00 H new ATOM 982 N SER A 64 -5.445 -6.242 3.163 1.00 0.00 N ATOM 983 CA SER A 64 -5.797 -7.507 3.798 1.00 0.00 C ATOM 984 C SER A 64 -7.120 -7.388 4.549 1.00 0.00 C ATOM 985 O SER A 64 -7.951 -8.295 4.511 1.00 0.00 O ATOM 986 CB SER A 64 -4.690 -7.945 4.759 1.00 0.00 C ATOM 987 OG SER A 64 -4.692 -7.153 5.934 1.00 0.00 O ATOM 0 H SER A 64 -4.480 -5.948 3.314 1.00 0.00 H new ATOM 0 HA SER A 64 -5.909 -8.259 3.017 1.00 0.00 H new ATOM 0 HB2 SER A 64 -4.827 -8.994 5.023 1.00 0.00 H new ATOM 0 HB3 SER A 64 -3.722 -7.865 4.264 1.00 0.00 H new ATOM 0 HG SER A 64 -4.874 -6.219 5.699 1.00 0.00 H new ATOM 993 N ASP A 65 -7.307 -6.263 5.229 1.00 0.00 N ATOM 994 CA ASP A 65 -8.529 -6.023 5.989 1.00 0.00 C ATOM 995 C ASP A 65 -9.693 -5.697 5.058 1.00 0.00 C ATOM 996 O ASP A 65 -9.492 -5.382 3.885 1.00 0.00 O ATOM 997 CB ASP A 65 -8.320 -4.881 6.984 1.00 0.00 C ATOM 998 CG ASP A 65 -7.658 -5.344 8.267 1.00 0.00 C ATOM 999 OD1 ASP A 65 -7.872 -6.511 8.656 1.00 0.00 O ATOM 1000 OD2 ASP A 65 -6.928 -4.539 8.882 1.00 0.00 O ATOM 0 H ASP A 65 -6.629 -5.502 5.270 1.00 0.00 H new ATOM 0 HA ASP A 65 -8.771 -6.933 6.538 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -7.707 -4.107 6.521 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -9.283 -4.427 7.219 1.00 0.00 H new ATOM 1005 N SER A 66 -10.909 -5.776 5.588 1.00 0.00 N ATOM 1006 CA SER A 66 -12.105 -5.495 4.803 1.00 0.00 C ATOM 1007 C SER A 66 -12.526 -4.036 4.959 1.00 0.00 C ATOM 1008 O SER A 66 -12.800 -3.349 3.975 1.00 0.00 O ATOM 1009 CB SER A 66 -13.250 -6.416 5.230 1.00 0.00 C ATOM 1010 OG SER A 66 -13.595 -6.204 6.588 1.00 0.00 O ATOM 0 H SER A 66 -11.092 -6.032 6.558 1.00 0.00 H new ATOM 0 HA SER A 66 -11.873 -5.679 3.754 1.00 0.00 H new ATOM 0 HB2 SER A 66 -14.120 -6.237 4.598 1.00 0.00 H new ATOM 0 HB3 SER A 66 -12.958 -7.456 5.084 1.00 0.00 H new ATOM 0 HG SER A 66 -14.330 -6.803 6.836 1.00 0.00 H new ATOM 1016 N LYS A 67 -12.574 -3.570 6.202 1.00 0.00 N ATOM 1017 CA LYS A 67 -12.959 -2.194 6.489 1.00 0.00 C ATOM 1018 C LYS A 67 -11.961 -1.212 5.885 1.00 0.00 C ATOM 1019 O LYS A 67 -12.338 -0.139 5.412 1.00 0.00 O ATOM 1020 CB LYS A 67 -13.055 -1.974 8.001 1.00 0.00 C ATOM 1021 CG LYS A 67 -11.796 -2.368 8.754 1.00 0.00 C ATOM 1022 CD LYS A 67 -11.623 -1.544 10.019 1.00 0.00 C ATOM 1023 CE LYS A 67 -12.603 -1.971 11.101 1.00 0.00 C ATOM 1024 NZ LYS A 67 -12.249 -3.297 11.678 1.00 0.00 N ATOM 0 H LYS A 67 -12.351 -4.126 7.028 1.00 0.00 H new ATOM 0 HA LYS A 67 -13.936 -2.016 6.039 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -13.270 -0.923 8.194 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -13.896 -2.548 8.391 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -11.841 -3.426 9.011 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -10.928 -2.233 8.109 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -10.603 -1.651 10.388 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -11.770 -0.489 9.790 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -12.618 -1.223 11.893 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -13.609 -2.013 10.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -12.808 -3.461 12.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -12.454 -4.044 10.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -11.236 -3.313 11.915 1.00 0.00 H new ATOM 1038 N LYS A 68 -10.686 -1.585 5.903 1.00 0.00 N ATOM 1039 CA LYS A 68 -9.633 -0.739 5.354 1.00 0.00 C ATOM 1040 C LYS A 68 -9.629 -0.795 3.830 1.00 0.00 C ATOM 1041 O LYS A 68 -9.593 0.239 3.162 1.00 0.00 O ATOM 1042 CB LYS A 68 -8.268 -1.173 5.895 1.00 0.00 C ATOM 1043 CG LYS A 68 -7.917 -0.547 7.233 1.00 0.00 C ATOM 1044 CD LYS A 68 -6.717 -1.228 7.870 1.00 0.00 C ATOM 1045 CE LYS A 68 -6.766 -1.138 9.387 1.00 0.00 C ATOM 1046 NZ LYS A 68 -5.699 -1.958 10.026 1.00 0.00 N ATOM 0 H LYS A 68 -10.357 -2.468 6.292 1.00 0.00 H new ATOM 0 HA LYS A 68 -9.829 0.288 5.661 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -8.255 -2.258 5.997 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -7.499 -0.912 5.168 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -7.704 0.513 7.095 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -8.774 -0.615 7.904 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -6.688 -2.275 7.567 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -5.799 -0.766 7.506 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -6.657 -0.098 9.693 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -7.742 -1.473 9.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -5.734 -1.830 11.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -5.848 -2.961 9.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -4.769 -1.656 9.671 1.00 0.00 H new ATOM 1060 N ARG A 69 -9.667 -2.007 3.287 1.00 0.00 N ATOM 1061 CA ARG A 69 -9.668 -2.197 1.841 1.00 0.00 C ATOM 1062 C ARG A 69 -10.912 -1.576 1.212 1.00 0.00 C ATOM 1063 O ARG A 69 -10.829 -0.897 0.189 1.00 0.00 O ATOM 1064 CB ARG A 69 -9.601 -3.687 1.501 1.00 0.00 C ATOM 1065 CG ARG A 69 -9.255 -3.964 0.047 1.00 0.00 C ATOM 1066 CD ARG A 69 -9.368 -5.445 -0.280 1.00 0.00 C ATOM 1067 NE ARG A 69 -8.881 -5.748 -1.623 1.00 0.00 N ATOM 1068 CZ ARG A 69 -8.481 -6.956 -2.005 1.00 0.00 C ATOM 1069 NH1 ARG A 69 -8.511 -7.969 -1.149 1.00 0.00 N ATOM 1070 NH2 ARG A 69 -8.052 -7.153 -3.244 1.00 0.00 N ATOM 0 H ARG A 69 -9.698 -2.872 3.826 1.00 0.00 H new ATOM 0 HA ARG A 69 -8.788 -1.699 1.434 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -8.858 -4.164 2.140 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -10.562 -4.147 1.731 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -9.921 -3.395 -0.601 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -8.241 -3.621 -0.159 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -8.800 -6.022 0.450 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -10.409 -5.757 -0.193 1.00 0.00 H new ATOM 0 HE ARG A 69 -8.846 -4.991 -2.305 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -8.842 -7.821 -0.195 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -8.203 -8.896 -1.444 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -8.029 -6.377 -3.905 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -7.745 -8.081 -3.536 1.00 0.00 H new ATOM 1084 N SER A 70 -12.064 -1.815 1.831 1.00 0.00 N ATOM 1085 CA SER A 70 -13.325 -1.283 1.330 1.00 0.00 C ATOM 1086 C SER A 70 -13.359 0.238 1.448 1.00 0.00 C ATOM 1087 O SER A 70 -13.671 0.940 0.485 1.00 0.00 O ATOM 1088 CB SER A 70 -14.501 -1.891 2.098 1.00 0.00 C ATOM 1089 OG SER A 70 -15.693 -1.835 1.334 1.00 0.00 O ATOM 0 H SER A 70 -12.150 -2.374 2.680 1.00 0.00 H new ATOM 0 HA SER A 70 -13.410 -1.551 0.277 1.00 0.00 H new ATOM 0 HB2 SER A 70 -14.277 -2.927 2.352 1.00 0.00 H new ATOM 0 HB3 SER A 70 -14.642 -1.356 3.037 1.00 0.00 H new ATOM 0 HG SER A 70 -16.429 -2.231 1.846 1.00 0.00 H new ATOM 1095 N LEU A 71 -13.036 0.740 2.634 1.00 0.00 N ATOM 1096 CA LEU A 71 -13.029 2.178 2.880 1.00 0.00 C ATOM 1097 C LEU A 71 -12.152 2.900 1.861 1.00 0.00 C ATOM 1098 O LEU A 71 -12.560 3.904 1.276 1.00 0.00 O ATOM 1099 CB LEU A 71 -12.532 2.471 4.296 1.00 0.00 C ATOM 1100 CG LEU A 71 -13.572 2.353 5.410 1.00 0.00 C ATOM 1101 CD1 LEU A 71 -12.893 2.151 6.756 1.00 0.00 C ATOM 1102 CD2 LEU A 71 -14.463 3.587 5.441 1.00 0.00 C ATOM 0 H LEU A 71 -12.775 0.173 3.441 1.00 0.00 H new ATOM 0 HA LEU A 71 -14.050 2.544 2.778 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -11.711 1.790 4.519 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -12.123 3.481 4.314 1.00 0.00 H new ATOM 0 HG LEU A 71 -14.196 1.483 5.207 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -13.649 2.069 7.536 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -12.298 1.238 6.730 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -12.244 3.001 6.967 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -15.197 3.486 6.240 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -13.853 4.472 5.619 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -14.978 3.688 4.486 1.00 0.00 H new ATOM 1114 N TYR A 72 -10.947 2.381 1.653 1.00 0.00 N ATOM 1115 CA TYR A 72 -10.012 2.976 0.706 1.00 0.00 C ATOM 1116 C TYR A 72 -10.575 2.940 -0.711 1.00 0.00 C ATOM 1117 O TYR A 72 -10.347 3.852 -1.506 1.00 0.00 O ATOM 1118 CB TYR A 72 -8.670 2.243 0.752 1.00 0.00 C ATOM 1119 CG TYR A 72 -7.581 2.922 -0.047 1.00 0.00 C ATOM 1120 CD1 TYR A 72 -7.206 4.232 0.226 1.00 0.00 C ATOM 1121 CD2 TYR A 72 -6.926 2.253 -1.073 1.00 0.00 C ATOM 1122 CE1 TYR A 72 -6.212 4.856 -0.502 1.00 0.00 C ATOM 1123 CE2 TYR A 72 -5.929 2.869 -1.805 1.00 0.00 C ATOM 1124 CZ TYR A 72 -5.576 4.171 -1.517 1.00 0.00 C ATOM 1125 OH TYR A 72 -4.585 4.789 -2.243 1.00 0.00 O ATOM 0 H TYR A 72 -10.595 1.550 2.128 1.00 0.00 H new ATOM 0 HA TYR A 72 -9.860 4.017 0.991 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -8.348 2.157 1.790 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -8.806 1.229 0.376 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -7.700 4.771 1.021 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -7.201 1.234 -1.303 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -5.934 5.875 -0.278 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -5.429 2.334 -2.599 1.00 0.00 H new ATOM 0 HH TYR A 72 -4.671 4.544 -3.188 1.00 0.00 H new ATOM 1135 N ASP A 73 -11.313 1.879 -1.020 1.00 0.00 N ATOM 1136 CA ASP A 73 -11.912 1.723 -2.341 1.00 0.00 C ATOM 1137 C ASP A 73 -13.047 2.721 -2.545 1.00 0.00 C ATOM 1138 O ASP A 73 -13.041 3.495 -3.502 1.00 0.00 O ATOM 1139 CB ASP A 73 -12.432 0.296 -2.523 1.00 0.00 C ATOM 1140 CG ASP A 73 -13.171 0.112 -3.834 1.00 0.00 C ATOM 1141 OD1 ASP A 73 -14.388 0.389 -3.872 1.00 0.00 O ATOM 1142 OD2 ASP A 73 -12.533 -0.310 -4.821 1.00 0.00 O ATOM 0 H ASP A 73 -11.511 1.115 -0.374 1.00 0.00 H new ATOM 0 HA ASP A 73 -11.142 1.919 -3.087 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -11.595 -0.401 -2.480 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -13.097 0.047 -1.696 1.00 0.00 H new ATOM 1147 N ARG A 74 -14.019 2.697 -1.639 1.00 0.00 N ATOM 1148 CA ARG A 74 -15.162 3.599 -1.720 1.00 0.00 C ATOM 1149 C ARG A 74 -14.710 5.055 -1.660 1.00 0.00 C ATOM 1150 O ARG A 74 -15.228 5.906 -2.384 1.00 0.00 O ATOM 1151 CB ARG A 74 -16.147 3.312 -0.586 1.00 0.00 C ATOM 1152 CG ARG A 74 -15.593 3.624 0.795 1.00 0.00 C ATOM 1153 CD ARG A 74 -16.482 3.059 1.892 1.00 0.00 C ATOM 1154 NE ARG A 74 -17.779 3.727 1.944 1.00 0.00 N ATOM 1155 CZ ARG A 74 -18.583 3.692 3.001 1.00 0.00 C ATOM 1156 NH1 ARG A 74 -18.222 3.026 4.089 1.00 0.00 N ATOM 1157 NH2 ARG A 74 -19.748 4.325 2.972 1.00 0.00 N ATOM 0 H ARG A 74 -14.038 2.063 -0.840 1.00 0.00 H new ATOM 0 HA ARG A 74 -15.660 3.430 -2.675 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -17.053 3.897 -0.746 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -16.436 2.262 -0.624 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -14.590 3.209 0.888 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -15.504 4.703 0.917 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -16.630 1.992 1.725 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -15.981 3.164 2.854 1.00 0.00 H new ATOM 0 HE ARG A 74 -18.085 4.250 1.123 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -17.326 2.540 4.115 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -18.840 3.000 4.900 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -20.028 4.840 2.137 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -20.364 4.297 3.785 1.00 0.00 H new ATOM 1171 N ALA A 75 -13.743 5.335 -0.793 1.00 0.00 N ATOM 1172 CA ALA A 75 -13.222 6.687 -0.640 1.00 0.00 C ATOM 1173 C ALA A 75 -12.662 7.212 -1.957 1.00 0.00 C ATOM 1174 O ALA A 75 -13.141 8.210 -2.493 1.00 0.00 O ATOM 1175 CB ALA A 75 -12.152 6.721 0.442 1.00 0.00 C ATOM 0 H ALA A 75 -13.304 4.643 -0.186 1.00 0.00 H new ATOM 0 HA ALA A 75 -14.046 7.336 -0.342 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -11.772 7.737 0.546 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -12.582 6.396 1.389 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -11.335 6.054 0.167 1.00 0.00 H new ATOM 1181 N GLY A 76 -11.643 6.533 -2.475 1.00 0.00 N ATOM 1182 CA GLY A 76 -11.034 6.947 -3.725 1.00 0.00 C ATOM 1183 C GLY A 76 -10.325 8.282 -3.611 1.00 0.00 C ATOM 1184 O GLY A 76 -9.963 8.708 -2.514 1.00 0.00 O ATOM 0 H GLY A 76 -11.228 5.703 -2.051 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -10.322 6.187 -4.048 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.802 7.012 -4.496 1.00 0.00 H new ATOM 1188 N CYS A 77 -10.126 8.943 -4.746 1.00 0.00 N ATOM 1189 CA CYS A 77 -9.453 10.237 -4.769 1.00 0.00 C ATOM 1190 C CYS A 77 -10.316 11.286 -5.463 1.00 0.00 C ATOM 1191 O CYS A 77 -11.088 10.969 -6.368 1.00 0.00 O ATOM 1192 CB CYS A 77 -8.102 10.120 -5.477 1.00 0.00 C ATOM 1193 SG CYS A 77 -6.969 11.487 -5.134 1.00 0.00 S ATOM 0 H CYS A 77 -10.421 8.605 -5.662 1.00 0.00 H new ATOM 0 HA CYS A 77 -9.289 10.552 -3.739 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -7.627 9.185 -5.179 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -8.271 10.063 -6.552 1.00 0.00 H new ATOM 0 HG CYS A 77 -5.854 11.298 -5.775 1.00 0.00 H new ATOM 1199 N ASP A 78 -10.180 12.535 -5.031 1.00 0.00 N ATOM 1200 CA ASP A 78 -10.948 13.631 -5.611 1.00 0.00 C ATOM 1201 C ASP A 78 -10.069 14.861 -5.816 1.00 0.00 C ATOM 1202 O ASP A 78 -9.545 15.429 -4.858 1.00 0.00 O ATOM 1203 CB ASP A 78 -12.135 13.982 -4.712 1.00 0.00 C ATOM 1204 CG ASP A 78 -13.048 15.018 -5.337 1.00 0.00 C ATOM 1205 OD1 ASP A 78 -12.634 16.192 -5.435 1.00 0.00 O ATOM 1206 OD2 ASP A 78 -14.178 14.655 -5.728 1.00 0.00 O ATOM 0 H ASP A 78 -9.546 12.814 -4.282 1.00 0.00 H new ATOM 0 HA ASP A 78 -11.321 13.307 -6.582 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -12.707 13.078 -4.501 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -11.766 14.356 -3.757 1.00 0.00 H new ATOM 1211 N SER A 79 -9.911 15.266 -7.072 1.00 0.00 N ATOM 1212 CA SER A 79 -9.091 16.425 -7.404 1.00 0.00 C ATOM 1213 C SER A 79 -9.652 17.690 -6.760 1.00 0.00 C ATOM 1214 O SER A 79 -10.863 17.824 -6.583 1.00 0.00 O ATOM 1215 CB SER A 79 -9.013 16.604 -8.922 1.00 0.00 C ATOM 1216 OG SER A 79 -10.210 17.166 -9.431 1.00 0.00 O ATOM 0 H SER A 79 -10.340 14.809 -7.876 1.00 0.00 H new ATOM 0 HA SER A 79 -8.088 16.253 -7.014 1.00 0.00 H new ATOM 0 HB2 SER A 79 -8.170 17.248 -9.173 1.00 0.00 H new ATOM 0 HB3 SER A 79 -8.830 15.640 -9.396 1.00 0.00 H new ATOM 0 HG SER A 79 -10.134 17.272 -10.402 1.00 0.00 H new ATOM 1222 N TRP A 80 -8.763 18.613 -6.412 1.00 0.00 N ATOM 1223 CA TRP A 80 -9.169 19.867 -5.788 1.00 0.00 C ATOM 1224 C TRP A 80 -8.139 20.962 -6.046 1.00 0.00 C ATOM 1225 O TRP A 80 -7.036 20.930 -5.501 1.00 0.00 O ATOM 1226 CB TRP A 80 -9.358 19.673 -4.283 1.00 0.00 C ATOM 1227 CG TRP A 80 -10.753 19.273 -3.906 1.00 0.00 C ATOM 1228 CD1 TRP A 80 -11.167 18.041 -3.488 1.00 0.00 C ATOM 1229 CD2 TRP A 80 -11.916 20.108 -3.915 1.00 0.00 C ATOM 1230 NE1 TRP A 80 -12.518 18.059 -3.236 1.00 0.00 N ATOM 1231 CE2 TRP A 80 -13.000 19.316 -3.490 1.00 0.00 C ATOM 1232 CE3 TRP A 80 -12.146 21.447 -4.239 1.00 0.00 C ATOM 1233 CZ2 TRP A 80 -14.293 19.821 -3.383 1.00 0.00 C ATOM 1234 CZ3 TRP A 80 -13.430 21.947 -4.133 1.00 0.00 C ATOM 1235 CH2 TRP A 80 -14.490 21.136 -3.707 1.00 0.00 C ATOM 0 H TRP A 80 -7.757 18.517 -6.551 1.00 0.00 H new ATOM 0 HA TRP A 80 -10.117 20.174 -6.230 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -8.662 18.911 -3.932 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -9.102 20.600 -3.769 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -10.527 17.179 -3.372 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -13.072 17.266 -2.913 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -11.335 22.080 -4.567 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.112 19.197 -3.056 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -13.620 22.980 -4.383 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -15.482 21.557 -3.633 1.00 0.00 H new ATOM 1246 N ARG A 81 -8.507 21.929 -6.881 1.00 0.00 N ATOM 1247 CA ARG A 81 -7.614 23.033 -7.211 1.00 0.00 C ATOM 1248 C ARG A 81 -7.630 24.092 -6.114 1.00 0.00 C ATOM 1249 O ARG A 81 -6.588 24.445 -5.563 1.00 0.00 O ATOM 1250 CB ARG A 81 -8.018 23.660 -8.547 1.00 0.00 C ATOM 1251 CG ARG A 81 -8.031 22.675 -9.704 1.00 0.00 C ATOM 1252 CD ARG A 81 -8.956 23.137 -10.819 1.00 0.00 C ATOM 1253 NE ARG A 81 -9.280 22.055 -11.745 1.00 0.00 N ATOM 1254 CZ ARG A 81 -8.451 21.623 -12.689 1.00 0.00 C ATOM 1255 NH1 ARG A 81 -7.255 22.177 -12.831 1.00 0.00 N ATOM 1256 NH2 ARG A 81 -8.818 20.633 -13.493 1.00 0.00 N ATOM 0 H ARG A 81 -9.417 21.970 -7.341 1.00 0.00 H new ATOM 0 HA ARG A 81 -6.602 22.637 -7.294 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -9.009 24.102 -8.446 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -7.329 24.472 -8.780 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -7.020 22.557 -10.094 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -8.351 21.696 -9.346 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -9.876 23.532 -10.387 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -8.485 23.953 -11.366 1.00 0.00 H new ATOM 0 HE ARG A 81 -10.192 21.607 -11.662 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -6.969 22.937 -12.214 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -6.621 21.843 -13.557 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -9.737 20.203 -13.386 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -8.181 20.302 -14.218 1.00 0.00 H new ATOM 1270 N ALA A 82 -8.820 24.596 -5.802 1.00 0.00 N ATOM 1271 CA ALA A 82 -8.971 25.614 -4.769 1.00 0.00 C ATOM 1272 C ALA A 82 -8.874 25.002 -3.376 1.00 0.00 C ATOM 1273 O ALA A 82 -8.100 25.461 -2.538 1.00 0.00 O ATOM 1274 CB ALA A 82 -10.297 26.342 -4.937 1.00 0.00 C ATOM 0 H ALA A 82 -9.693 24.316 -6.250 1.00 0.00 H new ATOM 0 HA ALA A 82 -8.158 26.332 -4.879 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -10.397 27.099 -4.160 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -10.328 26.821 -5.916 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -11.117 25.628 -4.856 1.00 0.00 H new ATOM 1280 N GLY A 83 -9.666 23.961 -3.136 1.00 0.00 N ATOM 1281 CA GLY A 83 -9.655 23.303 -1.842 1.00 0.00 C ATOM 1282 C GLY A 83 -8.484 22.353 -1.685 1.00 0.00 C ATOM 1283 O GLY A 83 -7.437 22.540 -2.302 1.00 0.00 O ATOM 0 H GLY A 83 -10.315 23.562 -3.814 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -9.616 24.056 -1.055 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -10.586 22.752 -1.710 1.00 0.00 H new ATOM 1287 N GLY A 84 -8.662 21.329 -0.856 1.00 0.00 N ATOM 1288 CA GLY A 84 -7.604 20.361 -0.634 1.00 0.00 C ATOM 1289 C GLY A 84 -8.137 18.965 -0.384 1.00 0.00 C ATOM 1290 O GLY A 84 -9.176 18.584 -0.922 1.00 0.00 O ATOM 0 H GLY A 84 -9.520 21.153 -0.334 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -6.944 20.344 -1.501 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -7.002 20.675 0.219 1.00 0.00 H new ATOM 1294 N GLY A 85 -7.424 18.198 0.435 1.00 0.00 N ATOM 1295 CA GLY A 85 -7.846 16.843 0.739 1.00 0.00 C ATOM 1296 C GLY A 85 -7.595 16.469 2.187 1.00 0.00 C ATOM 1297 O GLY A 85 -8.026 17.172 3.100 1.00 0.00 O ATOM 0 H GLY A 85 -6.561 18.491 0.894 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -8.908 16.738 0.519 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -7.316 16.146 0.090 1.00 0.00 H new ATOM 1301 N ALA A 86 -6.898 15.357 2.396 1.00 0.00 N ATOM 1302 CA ALA A 86 -6.590 14.891 3.743 1.00 0.00 C ATOM 1303 C ALA A 86 -5.222 14.220 3.792 1.00 0.00 C ATOM 1304 O ALA A 86 -4.833 13.512 2.863 1.00 0.00 O ATOM 1305 CB ALA A 86 -7.668 13.933 4.229 1.00 0.00 C ATOM 0 H ALA A 86 -6.536 14.762 1.651 1.00 0.00 H new ATOM 0 HA ALA A 86 -6.564 15.757 4.404 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -7.425 13.593 5.236 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -8.631 14.444 4.241 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -7.721 13.075 3.559 1.00 0.00 H new ATOM 1311 N SER A 87 -4.495 14.447 4.881 1.00 0.00 N ATOM 1312 CA SER A 87 -3.168 13.867 5.050 1.00 0.00 C ATOM 1313 C SER A 87 -3.196 12.730 6.066 1.00 0.00 C ATOM 1314 O SER A 87 -4.050 12.695 6.952 1.00 0.00 O ATOM 1315 CB SER A 87 -2.172 14.940 5.495 1.00 0.00 C ATOM 1316 OG SER A 87 -0.837 14.515 5.286 1.00 0.00 O ATOM 0 H SER A 87 -4.803 15.029 5.660 1.00 0.00 H new ATOM 0 HA SER A 87 -2.851 13.463 4.089 1.00 0.00 H new ATOM 0 HB2 SER A 87 -2.354 15.861 4.942 1.00 0.00 H new ATOM 0 HB3 SER A 87 -2.324 15.166 6.550 1.00 0.00 H new ATOM 0 HG SER A 87 -0.220 15.219 5.577 1.00 0.00 H new ATOM 1322 N GLY A 88 -2.255 11.800 5.932 1.00 0.00 N ATOM 1323 CA GLY A 88 -2.190 10.674 6.844 1.00 0.00 C ATOM 1324 C GLY A 88 -1.148 10.867 7.929 1.00 0.00 C ATOM 1325 O GLY A 88 -0.887 11.983 8.377 1.00 0.00 O ATOM 0 H GLY A 88 -1.537 11.807 5.208 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -3.167 10.526 7.305 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -1.962 9.768 6.282 1.00 0.00 H new ATOM 1329 N PRO A 89 -0.534 9.758 8.369 1.00 0.00 N ATOM 1330 CA PRO A 89 0.493 9.784 9.414 1.00 0.00 C ATOM 1331 C PRO A 89 1.789 10.431 8.937 1.00 0.00 C ATOM 1332 O PRO A 89 1.927 10.774 7.763 1.00 0.00 O ATOM 1333 CB PRO A 89 0.719 8.303 9.727 1.00 0.00 C ATOM 1334 CG PRO A 89 0.322 7.588 8.481 1.00 0.00 C ATOM 1335 CD PRO A 89 -0.796 8.394 7.879 1.00 0.00 C ATOM 0 HA PRO A 89 0.182 10.373 10.276 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.760 8.107 9.982 1.00 0.00 H new ATOM 0 HB3 PRO A 89 0.117 7.982 10.577 1.00 0.00 H new ATOM 0 HG2 PRO A 89 1.162 7.510 7.791 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -0.004 6.572 8.701 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -0.783 8.349 6.790 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -1.772 8.031 8.202 1.00 0.00 H new ATOM 1343 N SER A 90 2.737 10.594 9.854 1.00 0.00 N ATOM 1344 CA SER A 90 4.021 11.202 9.527 1.00 0.00 C ATOM 1345 C SER A 90 5.171 10.398 10.126 1.00 0.00 C ATOM 1346 O SER A 90 5.038 9.804 11.195 1.00 0.00 O ATOM 1347 CB SER A 90 4.071 12.644 10.039 1.00 0.00 C ATOM 1348 OG SER A 90 5.357 13.208 9.849 1.00 0.00 O ATOM 0 H SER A 90 2.640 10.313 10.830 1.00 0.00 H new ATOM 0 HA SER A 90 4.129 11.204 8.442 1.00 0.00 H new ATOM 0 HB2 SER A 90 3.326 13.245 9.517 1.00 0.00 H new ATOM 0 HB3 SER A 90 3.813 12.666 11.098 1.00 0.00 H new ATOM 0 HG SER A 90 5.363 14.130 10.182 1.00 0.00 H new ATOM 1354 N SER A 91 6.302 10.385 9.427 1.00 0.00 N ATOM 1355 CA SER A 91 7.476 9.651 9.886 1.00 0.00 C ATOM 1356 C SER A 91 8.590 10.610 10.293 1.00 0.00 C ATOM 1357 O SER A 91 9.237 11.224 9.446 1.00 0.00 O ATOM 1358 CB SER A 91 7.974 8.708 8.789 1.00 0.00 C ATOM 1359 OG SER A 91 8.949 7.811 9.293 1.00 0.00 O ATOM 0 H SER A 91 6.430 10.874 8.541 1.00 0.00 H new ATOM 0 HA SER A 91 7.190 9.063 10.758 1.00 0.00 H new ATOM 0 HB2 SER A 91 7.135 8.146 8.380 1.00 0.00 H new ATOM 0 HB3 SER A 91 8.398 9.289 7.970 1.00 0.00 H new ATOM 0 HG SER A 91 9.251 7.218 8.574 1.00 0.00 H new ATOM 1365 N GLY A 92 8.809 10.732 11.599 1.00 0.00 N ATOM 1366 CA GLY A 92 9.845 11.617 12.098 1.00 0.00 C ATOM 1367 C GLY A 92 9.850 11.709 13.611 1.00 0.00 C ATOM 1368 O GLY A 92 8.795 11.798 14.238 1.00 0.00 O ATOM 0 H GLY A 92 8.287 10.234 12.320 1.00 0.00 H new ATOM 0 HA2 GLY A 92 10.817 11.263 11.755 1.00 0.00 H new ATOM 0 HA3 GLY A 92 9.702 12.612 11.677 1.00 0.00 H new TER 1372 GLY A 92