USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 965 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 98 THR OG1 : rot 131:sc= -0.175 USER MOD Set 1.2: A 100 ASN : amide:sc= -0.159 K(o=-0.33,f=-0.96) USER MOD Set 2.1: A 76 GLN :FLIP amide:sc= -1.37 F(o=-6.8!,f=-4.9) USER MOD Set 2.2: A 79 GLN : amide:sc= -3.57 K(o=-4.9,f=-10!) USER MOD Set 3.1: A 38 HIS : no HD1:sc= -2.1! C(o=-1.6!,f=-8.8!) USER MOD Set 3.2: A 78 SER OG : rot -123:sc= 0.538 USER MOD Single : A 1 GLY N :NH3+ -112:sc= 0.0697 (180deg=0) USER MOD Single : A 2 SER OG : rot 11:sc= 1.24 USER MOD Single : A 3 SER OG : rot -3:sc= 1.02 USER MOD Single : A 5 SER OG : rot 32:sc= 0.234 USER MOD Single : A 6 SER OG : rot 180:sc= -0.0752 USER MOD Single : A 13 THR OG1 : rot 160:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=-0.007) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 SER OG : rot 1:sc= -0.0333 USER MOD Single : A 31 ASN : amide:sc= -0.0238 K(o=-0.024,f=-0.82) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= -0.368 USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.884 K(o=-0.88,f=-4.9!) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.0384 USER MOD Single : A 47 GLN : amide:sc= 0.0604 K(o=0.06,f=-0.6) USER MOD Single : A 48 ASN : amide:sc= -1.23 X(o=-1.2,f=-1.6) USER MOD Single : A 50 GLN : amide:sc= -0.129 K(o=-0.13,f=-0.81) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 TYR OH : rot 150:sc= -2.54! USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 153:sc= 0.421 (180deg=0.104) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 140:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 70:sc= 0.717 USER MOD Single : A 90 TYR OH : rot 30:sc= 0 USER MOD Single : A 91 ASN : amide:sc= -1.58 K(o=-1.6,f=-7.1!) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 80:sc= -0.12 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot -168:sc= 1.27 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc=-0.00419 USER MOD Single : A 130 SER OG : rot 32:sc= 0.0993 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 32.962 1.939 -31.736 1.00 0.00 N ATOM 2 CA GLY A 1 31.899 2.877 -31.425 1.00 0.00 C ATOM 3 C GLY A 1 30.942 2.342 -30.377 1.00 0.00 C ATOM 4 O GLY A 1 30.972 1.157 -30.048 1.00 0.00 O ATOM 0 H1 GLY A 1 33.869 2.318 -31.397 1.00 0.00 H new ATOM 0 H2 GLY A 1 32.770 1.030 -31.269 1.00 0.00 H new ATOM 0 H3 GLY A 1 33.009 1.796 -32.765 1.00 0.00 H new ATOM 0 HA2 GLY A 1 32.335 3.811 -31.071 1.00 0.00 H new ATOM 0 HA3 GLY A 1 31.345 3.108 -32.335 1.00 0.00 H new ATOM 8 N SER A 2 30.093 3.219 -29.852 1.00 0.00 N ATOM 9 CA SER A 2 29.127 2.830 -28.831 1.00 0.00 C ATOM 10 C SER A 2 28.077 3.919 -28.633 1.00 0.00 C ATOM 11 O SER A 2 28.364 5.107 -28.780 1.00 0.00 O ATOM 12 CB SER A 2 29.838 2.544 -27.507 1.00 0.00 C ATOM 13 OG SER A 2 30.395 1.242 -27.498 1.00 0.00 O ATOM 0 H SER A 2 30.054 4.203 -30.116 1.00 0.00 H new ATOM 0 HA SER A 2 28.625 1.923 -29.168 1.00 0.00 H new ATOM 0 HB2 SER A 2 30.625 3.281 -27.347 1.00 0.00 H new ATOM 0 HB3 SER A 2 29.133 2.647 -26.682 1.00 0.00 H new ATOM 0 HG SER A 2 30.363 0.866 -28.402 1.00 0.00 H new ATOM 19 N SER A 3 26.859 3.505 -28.298 1.00 0.00 N ATOM 20 CA SER A 3 25.765 4.444 -28.083 1.00 0.00 C ATOM 21 C SER A 3 24.624 3.782 -27.317 1.00 0.00 C ATOM 22 O SER A 3 24.670 2.589 -27.021 1.00 0.00 O ATOM 23 CB SER A 3 25.253 4.978 -29.422 1.00 0.00 C ATOM 24 OG SER A 3 26.199 5.847 -30.020 1.00 0.00 O ATOM 0 H SER A 3 26.605 2.525 -28.170 1.00 0.00 H new ATOM 0 HA SER A 3 26.144 5.276 -27.489 1.00 0.00 H new ATOM 0 HB2 SER A 3 25.044 4.145 -30.093 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.313 5.508 -29.270 1.00 0.00 H new ATOM 0 HG SER A 3 26.962 5.966 -29.416 1.00 0.00 H new ATOM 30 N GLY A 4 23.599 4.567 -26.998 1.00 0.00 N ATOM 31 CA GLY A 4 22.460 4.041 -26.269 1.00 0.00 C ATOM 32 C GLY A 4 21.819 5.078 -25.368 1.00 0.00 C ATOM 33 O GLY A 4 22.419 5.511 -24.385 1.00 0.00 O ATOM 0 H GLY A 4 23.537 5.558 -27.232 1.00 0.00 H new ATOM 0 HA2 GLY A 4 21.718 3.671 -26.977 1.00 0.00 H new ATOM 0 HA3 GLY A 4 22.779 3.189 -25.668 1.00 0.00 H new ATOM 37 N SER A 5 20.597 5.478 -25.704 1.00 0.00 N ATOM 38 CA SER A 5 19.876 6.475 -24.921 1.00 0.00 C ATOM 39 C SER A 5 18.417 6.558 -25.358 1.00 0.00 C ATOM 40 O SER A 5 18.121 6.738 -26.539 1.00 0.00 O ATOM 41 CB SER A 5 20.542 7.845 -25.064 1.00 0.00 C ATOM 42 OG SER A 5 20.550 8.270 -26.415 1.00 0.00 O ATOM 0 H SER A 5 20.085 5.127 -26.513 1.00 0.00 H new ATOM 0 HA SER A 5 19.907 6.171 -23.875 1.00 0.00 H new ATOM 0 HB2 SER A 5 20.012 8.576 -24.453 1.00 0.00 H new ATOM 0 HB3 SER A 5 21.564 7.797 -24.689 1.00 0.00 H new ATOM 0 HG SER A 5 19.758 7.918 -26.873 1.00 0.00 H new ATOM 48 N SER A 6 17.509 6.427 -24.396 1.00 0.00 N ATOM 49 CA SER A 6 16.080 6.483 -24.680 1.00 0.00 C ATOM 50 C SER A 6 15.268 6.461 -23.389 1.00 0.00 C ATOM 51 O SER A 6 15.806 6.225 -22.308 1.00 0.00 O ATOM 52 CB SER A 6 15.670 5.311 -25.574 1.00 0.00 C ATOM 53 OG SER A 6 14.346 5.473 -26.052 1.00 0.00 O ATOM 0 H SER A 6 17.738 6.281 -23.413 1.00 0.00 H new ATOM 0 HA SER A 6 15.875 7.418 -25.202 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.357 5.234 -26.417 1.00 0.00 H new ATOM 0 HB3 SER A 6 15.746 4.379 -25.015 1.00 0.00 H new ATOM 0 HG SER A 6 14.109 4.712 -26.622 1.00 0.00 H new ATOM 59 N GLY A 7 13.967 6.708 -23.511 1.00 0.00 N ATOM 60 CA GLY A 7 13.101 6.712 -22.347 1.00 0.00 C ATOM 61 C GLY A 7 12.513 8.081 -22.067 1.00 0.00 C ATOM 62 O GLY A 7 13.245 9.041 -21.825 1.00 0.00 O ATOM 0 H GLY A 7 13.498 6.905 -24.395 1.00 0.00 H new ATOM 0 HA2 GLY A 7 12.293 5.996 -22.497 1.00 0.00 H new ATOM 0 HA3 GLY A 7 13.666 6.377 -21.477 1.00 0.00 H new ATOM 66 N ASP A 8 11.188 8.172 -22.101 1.00 0.00 N ATOM 67 CA ASP A 8 10.502 9.434 -21.850 1.00 0.00 C ATOM 68 C ASP A 8 9.132 9.192 -21.223 1.00 0.00 C ATOM 69 O ASP A 8 8.227 8.663 -21.868 1.00 0.00 O ATOM 70 CB ASP A 8 10.349 10.224 -23.150 1.00 0.00 C ATOM 71 CG ASP A 8 10.041 9.332 -24.337 1.00 0.00 C ATOM 72 OD1 ASP A 8 10.978 8.691 -24.856 1.00 0.00 O ATOM 73 OD2 ASP A 8 8.862 9.275 -24.747 1.00 0.00 O ATOM 0 H ASP A 8 10.568 7.387 -22.300 1.00 0.00 H new ATOM 0 HA ASP A 8 11.105 10.014 -21.151 1.00 0.00 H new ATOM 0 HB2 ASP A 8 9.551 10.958 -23.034 1.00 0.00 H new ATOM 0 HB3 ASP A 8 11.267 10.779 -23.345 1.00 0.00 H new ATOM 78 N VAL A 9 8.988 9.583 -19.960 1.00 0.00 N ATOM 79 CA VAL A 9 7.729 9.408 -19.246 1.00 0.00 C ATOM 80 C VAL A 9 7.472 10.571 -18.293 1.00 0.00 C ATOM 81 O VAL A 9 8.380 11.031 -17.601 1.00 0.00 O ATOM 82 CB VAL A 9 7.714 8.091 -18.447 1.00 0.00 C ATOM 83 CG1 VAL A 9 6.418 7.956 -17.663 1.00 0.00 C ATOM 84 CG2 VAL A 9 7.911 6.903 -19.377 1.00 0.00 C ATOM 0 H VAL A 9 9.727 10.022 -19.411 1.00 0.00 H new ATOM 0 HA VAL A 9 6.941 9.376 -19.998 1.00 0.00 H new ATOM 0 HB VAL A 9 8.540 8.108 -17.736 1.00 0.00 H new ATOM 0 HG11 VAL A 9 6.426 7.020 -17.105 1.00 0.00 H new ATOM 0 HG12 VAL A 9 6.324 8.791 -16.969 1.00 0.00 H new ATOM 0 HG13 VAL A 9 5.574 7.960 -18.352 1.00 0.00 H new ATOM 0 HG21 VAL A 9 7.898 5.980 -18.797 1.00 0.00 H new ATOM 0 HG22 VAL A 9 7.107 6.880 -20.113 1.00 0.00 H new ATOM 0 HG23 VAL A 9 8.869 6.996 -19.888 1.00 0.00 H new ATOM 94 N ALA A 10 6.229 11.040 -18.262 1.00 0.00 N ATOM 95 CA ALA A 10 5.853 12.147 -17.392 1.00 0.00 C ATOM 96 C ALA A 10 4.344 12.370 -17.409 1.00 0.00 C ATOM 97 O ALA A 10 3.713 12.333 -18.465 1.00 0.00 O ATOM 98 CB ALA A 10 6.580 13.417 -17.808 1.00 0.00 C ATOM 0 H ALA A 10 5.466 10.671 -18.829 1.00 0.00 H new ATOM 0 HA ALA A 10 6.146 11.891 -16.374 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.289 14.235 -17.149 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.656 13.260 -17.738 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.316 13.667 -18.836 1.00 0.00 H new ATOM 104 N VAL A 11 3.771 12.600 -16.232 1.00 0.00 N ATOM 105 CA VAL A 11 2.336 12.829 -16.112 1.00 0.00 C ATOM 106 C VAL A 11 2.020 13.718 -14.914 1.00 0.00 C ATOM 107 O VAL A 11 2.522 13.494 -13.812 1.00 0.00 O ATOM 108 CB VAL A 11 1.566 11.503 -15.971 1.00 0.00 C ATOM 109 CG1 VAL A 11 0.068 11.759 -15.900 1.00 0.00 C ATOM 110 CG2 VAL A 11 1.901 10.567 -17.123 1.00 0.00 C ATOM 0 H VAL A 11 4.279 12.633 -15.348 1.00 0.00 H new ATOM 0 HA VAL A 11 2.018 13.330 -17.026 1.00 0.00 H new ATOM 0 HB VAL A 11 1.872 11.023 -15.042 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -0.459 10.810 -15.801 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -0.153 12.389 -15.038 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.259 12.262 -16.810 1.00 0.00 H new ATOM 0 HG21 VAL A 11 1.348 9.635 -17.007 1.00 0.00 H new ATOM 0 HG22 VAL A 11 1.625 11.038 -18.066 1.00 0.00 H new ATOM 0 HG23 VAL A 11 2.971 10.357 -17.122 1.00 0.00 H new ATOM 120 N ARG A 12 1.183 14.726 -15.137 1.00 0.00 N ATOM 121 CA ARG A 12 0.800 15.649 -14.076 1.00 0.00 C ATOM 122 C ARG A 12 -0.679 15.499 -13.732 1.00 0.00 C ATOM 123 O ARG A 12 -1.546 16.038 -14.419 1.00 0.00 O ATOM 124 CB ARG A 12 1.093 17.091 -14.495 1.00 0.00 C ATOM 125 CG ARG A 12 2.501 17.296 -15.030 1.00 0.00 C ATOM 126 CD ARG A 12 3.477 17.635 -13.915 1.00 0.00 C ATOM 127 NE ARG A 12 4.064 16.438 -13.319 1.00 0.00 N ATOM 128 CZ ARG A 12 4.841 16.459 -12.241 1.00 0.00 C ATOM 129 NH1 ARG A 12 5.122 17.610 -11.645 1.00 0.00 N ATOM 130 NH2 ARG A 12 5.338 15.328 -11.758 1.00 0.00 N ATOM 0 H ARG A 12 0.757 14.924 -16.043 1.00 0.00 H new ATOM 0 HA ARG A 12 1.388 15.408 -13.190 1.00 0.00 H new ATOM 0 HB2 ARG A 12 0.376 17.391 -15.259 1.00 0.00 H new ATOM 0 HB3 ARG A 12 0.940 17.748 -13.638 1.00 0.00 H new ATOM 0 HG2 ARG A 12 2.832 16.393 -15.542 1.00 0.00 H new ATOM 0 HG3 ARG A 12 2.498 18.098 -15.768 1.00 0.00 H new ATOM 0 HD2 ARG A 12 4.270 18.270 -14.308 1.00 0.00 H new ATOM 0 HD3 ARG A 12 2.962 18.208 -13.144 1.00 0.00 H new ATOM 0 HE ARG A 12 3.867 15.537 -13.754 1.00 0.00 H new ATOM 0 HH11 ARG A 12 4.742 18.482 -12.014 1.00 0.00 H new ATOM 0 HH12 ARG A 12 5.719 17.624 -10.818 1.00 0.00 H new ATOM 0 HH21 ARG A 12 5.124 14.441 -12.214 1.00 0.00 H new ATOM 0 HH22 ARG A 12 5.934 15.345 -10.931 1.00 0.00 H new ATOM 144 N THR A 13 -0.960 14.760 -12.662 1.00 0.00 N ATOM 145 CA THR A 13 -2.333 14.537 -12.228 1.00 0.00 C ATOM 146 C THR A 13 -2.835 15.695 -11.374 1.00 0.00 C ATOM 147 O THR A 13 -2.091 16.253 -10.566 1.00 0.00 O ATOM 148 CB THR A 13 -2.463 13.228 -11.425 1.00 0.00 C ATOM 149 OG1 THR A 13 -1.982 12.127 -12.204 1.00 0.00 O ATOM 150 CG2 THR A 13 -3.909 12.980 -11.024 1.00 0.00 C ATOM 0 H THR A 13 -0.255 14.307 -12.081 1.00 0.00 H new ATOM 0 HA THR A 13 -2.941 14.464 -13.130 1.00 0.00 H new ATOM 0 HB THR A 13 -1.864 13.321 -10.519 1.00 0.00 H new ATOM 0 HG1 THR A 13 -1.764 11.377 -11.611 1.00 0.00 H new ATOM 0 HG21 THR A 13 -3.975 12.051 -10.458 1.00 0.00 H new ATOM 0 HG22 THR A 13 -4.262 13.806 -10.407 1.00 0.00 H new ATOM 0 HG23 THR A 13 -4.527 12.905 -11.919 1.00 0.00 H new ATOM 158 N LEU A 14 -4.102 16.053 -11.555 1.00 0.00 N ATOM 159 CA LEU A 14 -4.704 17.146 -10.800 1.00 0.00 C ATOM 160 C LEU A 14 -5.383 16.625 -9.537 1.00 0.00 C ATOM 161 O LEU A 14 -6.539 16.949 -9.263 1.00 0.00 O ATOM 162 CB LEU A 14 -5.719 17.893 -11.667 1.00 0.00 C ATOM 163 CG LEU A 14 -5.138 18.738 -12.802 1.00 0.00 C ATOM 164 CD1 LEU A 14 -6.246 19.232 -13.720 1.00 0.00 C ATOM 165 CD2 LEU A 14 -4.344 19.909 -12.243 1.00 0.00 C ATOM 0 H LEU A 14 -4.732 15.602 -12.218 1.00 0.00 H new ATOM 0 HA LEU A 14 -3.910 17.833 -10.507 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -6.405 17.164 -12.098 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -6.309 18.544 -11.022 1.00 0.00 H new ATOM 0 HG LEU A 14 -4.462 18.113 -13.386 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -5.814 19.831 -14.522 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -6.772 18.378 -14.148 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -6.947 19.841 -13.149 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -3.938 20.499 -13.065 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -4.998 20.535 -11.635 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -3.526 19.534 -11.628 1.00 0.00 H new ATOM 177 N SER A 15 -4.657 15.819 -8.770 1.00 0.00 N ATOM 178 CA SER A 15 -5.189 15.252 -7.536 1.00 0.00 C ATOM 179 C SER A 15 -4.088 15.090 -6.493 1.00 0.00 C ATOM 180 O SER A 15 -2.917 14.917 -6.832 1.00 0.00 O ATOM 181 CB SER A 15 -5.847 13.900 -7.814 1.00 0.00 C ATOM 182 OG SER A 15 -6.948 14.039 -8.696 1.00 0.00 O ATOM 0 H SER A 15 -3.698 15.543 -8.981 1.00 0.00 H new ATOM 0 HA SER A 15 -5.938 15.939 -7.143 1.00 0.00 H new ATOM 0 HB2 SER A 15 -5.115 13.218 -8.246 1.00 0.00 H new ATOM 0 HB3 SER A 15 -6.182 13.456 -6.877 1.00 0.00 H new ATOM 0 HG SER A 15 -7.350 13.160 -8.859 1.00 0.00 H new ATOM 188 N ASP A 16 -4.472 15.148 -5.223 1.00 0.00 N ATOM 189 CA ASP A 16 -3.518 15.007 -4.129 1.00 0.00 C ATOM 190 C ASP A 16 -2.987 13.579 -4.052 1.00 0.00 C ATOM 191 O ASP A 16 -1.777 13.353 -4.091 1.00 0.00 O ATOM 192 CB ASP A 16 -4.173 15.393 -2.801 1.00 0.00 C ATOM 193 CG ASP A 16 -4.689 16.818 -2.802 1.00 0.00 C ATOM 194 OD1 ASP A 16 -5.161 17.278 -3.863 1.00 0.00 O ATOM 195 OD2 ASP A 16 -4.621 17.474 -1.742 1.00 0.00 O ATOM 0 H ASP A 16 -5.437 15.292 -4.925 1.00 0.00 H new ATOM 0 HA ASP A 16 -2.680 15.677 -4.321 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -4.998 14.711 -2.595 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -3.450 15.272 -1.994 1.00 0.00 H new ATOM 200 N VAL A 17 -3.899 12.618 -3.943 1.00 0.00 N ATOM 201 CA VAL A 17 -3.522 11.212 -3.860 1.00 0.00 C ATOM 202 C VAL A 17 -2.776 10.769 -5.114 1.00 0.00 C ATOM 203 O VAL A 17 -2.956 11.320 -6.201 1.00 0.00 O ATOM 204 CB VAL A 17 -4.755 10.311 -3.664 1.00 0.00 C ATOM 205 CG1 VAL A 17 -5.361 10.528 -2.286 1.00 0.00 C ATOM 206 CG2 VAL A 17 -5.783 10.571 -4.755 1.00 0.00 C ATOM 0 H VAL A 17 -4.904 12.788 -3.910 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.866 11.110 -2.995 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.439 9.270 -3.735 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -6.231 9.883 -2.166 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.622 10.287 -1.522 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -5.664 11.570 -2.182 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -6.648 9.926 -4.601 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -6.097 11.614 -4.718 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -5.341 10.360 -5.729 1.00 0.00 H new ATOM 216 N PRO A 18 -1.918 9.749 -4.963 1.00 0.00 N ATOM 217 CA PRO A 18 -1.129 9.208 -6.073 1.00 0.00 C ATOM 218 C PRO A 18 -1.989 8.462 -7.088 1.00 0.00 C ATOM 219 O PRO A 18 -2.933 7.763 -6.720 1.00 0.00 O ATOM 220 CB PRO A 18 -0.160 8.245 -5.383 1.00 0.00 C ATOM 221 CG PRO A 18 -0.853 7.847 -4.126 1.00 0.00 C ATOM 222 CD PRO A 18 -1.654 9.045 -3.697 1.00 0.00 C ATOM 0 HA PRO A 18 -0.636 9.995 -6.643 1.00 0.00 H new ATOM 0 HB2 PRO A 18 0.051 7.379 -6.010 1.00 0.00 H new ATOM 0 HB3 PRO A 18 0.795 8.727 -5.173 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -1.499 6.985 -4.293 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -0.134 7.563 -3.357 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -2.579 8.753 -3.199 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -1.099 9.670 -2.998 1.00 0.00 H new ATOM 230 N SER A 19 -1.657 8.616 -8.365 1.00 0.00 N ATOM 231 CA SER A 19 -2.402 7.959 -9.433 1.00 0.00 C ATOM 232 C SER A 19 -1.521 6.959 -10.175 1.00 0.00 C ATOM 233 O SER A 19 -1.322 7.067 -11.385 1.00 0.00 O ATOM 234 CB SER A 19 -2.951 8.998 -10.414 1.00 0.00 C ATOM 235 OG SER A 19 -4.076 8.494 -11.113 1.00 0.00 O ATOM 0 H SER A 19 -0.877 9.190 -8.686 1.00 0.00 H new ATOM 0 HA SER A 19 -3.234 7.419 -8.982 1.00 0.00 H new ATOM 0 HB2 SER A 19 -3.230 9.902 -9.873 1.00 0.00 H new ATOM 0 HB3 SER A 19 -2.173 9.279 -11.124 1.00 0.00 H new ATOM 0 HG SER A 19 -4.409 9.177 -11.732 1.00 0.00 H new ATOM 241 N ALA A 20 -0.994 5.985 -9.439 1.00 0.00 N ATOM 242 CA ALA A 20 -0.136 4.964 -10.026 1.00 0.00 C ATOM 243 C ALA A 20 -0.284 3.635 -9.293 1.00 0.00 C ATOM 244 O ALA A 20 -0.097 3.560 -8.079 1.00 0.00 O ATOM 245 CB ALA A 20 1.316 5.420 -10.008 1.00 0.00 C ATOM 0 H ALA A 20 -1.147 5.882 -8.436 1.00 0.00 H new ATOM 0 HA ALA A 20 -0.446 4.815 -11.060 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.945 4.647 -10.450 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.415 6.341 -10.582 1.00 0.00 H new ATOM 0 HB3 ALA A 20 1.629 5.599 -8.979 1.00 0.00 H new ATOM 251 N ALA A 21 -0.621 2.587 -10.039 1.00 0.00 N ATOM 252 CA ALA A 21 -0.793 1.261 -9.460 1.00 0.00 C ATOM 253 C ALA A 21 0.368 0.345 -9.831 1.00 0.00 C ATOM 254 O ALA A 21 1.075 0.566 -10.815 1.00 0.00 O ATOM 255 CB ALA A 21 -2.112 0.654 -9.913 1.00 0.00 C ATOM 0 H ALA A 21 -0.780 2.632 -11.046 1.00 0.00 H new ATOM 0 HA ALA A 21 -0.807 1.365 -8.375 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -2.227 -0.336 -9.473 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -2.935 1.292 -9.592 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -2.120 0.571 -11.000 1.00 0.00 H new ATOM 261 N PRO A 22 0.573 -0.708 -9.027 1.00 0.00 N ATOM 262 CA PRO A 22 1.649 -1.679 -9.251 1.00 0.00 C ATOM 263 C PRO A 22 1.401 -2.544 -10.483 1.00 0.00 C ATOM 264 O PRO A 22 0.308 -3.077 -10.667 1.00 0.00 O ATOM 265 CB PRO A 22 1.624 -2.535 -7.983 1.00 0.00 C ATOM 266 CG PRO A 22 0.229 -2.419 -7.474 1.00 0.00 C ATOM 267 CD PRO A 22 -0.230 -1.033 -7.836 1.00 0.00 C ATOM 0 HA PRO A 22 2.607 -1.192 -9.434 1.00 0.00 H new ATOM 0 HB2 PRO A 22 1.881 -3.572 -8.200 1.00 0.00 H new ATOM 0 HB3 PRO A 22 2.344 -2.175 -7.248 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -0.415 -3.174 -7.925 1.00 0.00 H new ATOM 0 HG3 PRO A 22 0.193 -2.573 -6.396 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -1.298 -1.007 -8.052 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -0.051 -0.326 -7.026 1.00 0.00 H new ATOM 275 N GLN A 23 2.424 -2.677 -11.321 1.00 0.00 N ATOM 276 CA GLN A 23 2.316 -3.478 -12.535 1.00 0.00 C ATOM 277 C GLN A 23 2.963 -4.846 -12.345 1.00 0.00 C ATOM 278 O GLN A 23 3.440 -5.172 -11.259 1.00 0.00 O ATOM 279 CB GLN A 23 2.971 -2.750 -13.711 1.00 0.00 C ATOM 280 CG GLN A 23 4.224 -1.980 -13.328 1.00 0.00 C ATOM 281 CD GLN A 23 4.900 -1.335 -14.521 1.00 0.00 C ATOM 282 OE1 GLN A 23 5.233 -2.007 -15.499 1.00 0.00 O ATOM 283 NE2 GLN A 23 5.108 -0.026 -14.449 1.00 0.00 N ATOM 0 H GLN A 23 3.336 -2.241 -11.182 1.00 0.00 H new ATOM 0 HA GLN A 23 1.258 -3.624 -12.750 1.00 0.00 H new ATOM 0 HB2 GLN A 23 3.223 -3.477 -14.483 1.00 0.00 H new ATOM 0 HB3 GLN A 23 2.249 -2.059 -14.147 1.00 0.00 H new ATOM 0 HG2 GLN A 23 3.965 -1.210 -12.602 1.00 0.00 H new ATOM 0 HG3 GLN A 23 4.926 -2.656 -12.839 1.00 0.00 H new ATOM 0 HE21 GLN A 23 4.816 0.492 -13.620 1.00 0.00 H new ATOM 0 HE22 GLN A 23 5.560 0.462 -15.223 1.00 0.00 H new ATOM 292 N ASN A 24 2.974 -5.643 -13.408 1.00 0.00 N ATOM 293 CA ASN A 24 3.561 -6.977 -13.358 1.00 0.00 C ATOM 294 C ASN A 24 3.007 -7.771 -12.179 1.00 0.00 C ATOM 295 O ASN A 24 3.725 -8.545 -11.544 1.00 0.00 O ATOM 296 CB ASN A 24 5.084 -6.882 -13.252 1.00 0.00 C ATOM 297 CG ASN A 24 5.757 -6.839 -14.611 1.00 0.00 C ATOM 298 OD1 ASN A 24 6.097 -7.875 -15.181 1.00 0.00 O ATOM 299 ND2 ASN A 24 5.952 -5.635 -15.136 1.00 0.00 N ATOM 0 H ASN A 24 2.583 -5.388 -14.315 1.00 0.00 H new ATOM 0 HA ASN A 24 3.299 -7.497 -14.279 1.00 0.00 H new ATOM 0 HB2 ASN A 24 5.351 -5.988 -12.689 1.00 0.00 H new ATOM 0 HB3 ASN A 24 5.460 -7.737 -12.690 1.00 0.00 H new ATOM 0 HD21 ASN A 24 6.400 -5.543 -16.048 1.00 0.00 H new ATOM 0 HD22 ASN A 24 5.654 -4.803 -14.628 1.00 0.00 H new ATOM 306 N LEU A 25 1.725 -7.575 -11.891 1.00 0.00 N ATOM 307 CA LEU A 25 1.072 -8.273 -10.789 1.00 0.00 C ATOM 308 C LEU A 25 1.058 -9.779 -11.031 1.00 0.00 C ATOM 309 O LEU A 25 1.160 -10.236 -12.169 1.00 0.00 O ATOM 310 CB LEU A 25 -0.358 -7.760 -10.610 1.00 0.00 C ATOM 311 CG LEU A 25 -1.203 -8.482 -9.559 1.00 0.00 C ATOM 312 CD1 LEU A 25 -0.576 -8.341 -8.181 1.00 0.00 C ATOM 313 CD2 LEU A 25 -2.626 -7.943 -9.558 1.00 0.00 C ATOM 0 H LEU A 25 1.117 -6.938 -12.406 1.00 0.00 H new ATOM 0 HA LEU A 25 1.639 -8.075 -9.879 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -0.313 -6.703 -10.348 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -0.870 -7.829 -11.570 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.237 -9.542 -9.813 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -1.191 -8.861 -7.446 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.424 -8.775 -8.190 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.511 -7.285 -7.917 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.213 -8.468 -8.804 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.611 -6.877 -9.329 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -3.074 -8.097 -10.540 1.00 0.00 H new ATOM 325 N SER A 26 0.929 -10.545 -9.952 1.00 0.00 N ATOM 326 CA SER A 26 0.902 -12.000 -10.047 1.00 0.00 C ATOM 327 C SER A 26 0.452 -12.622 -8.728 1.00 0.00 C ATOM 328 O SER A 26 0.636 -12.039 -7.658 1.00 0.00 O ATOM 329 CB SER A 26 2.285 -12.532 -10.429 1.00 0.00 C ATOM 330 OG SER A 26 3.305 -11.871 -9.701 1.00 0.00 O ATOM 0 H SER A 26 0.842 -10.182 -9.003 1.00 0.00 H new ATOM 0 HA SER A 26 0.187 -12.276 -10.822 1.00 0.00 H new ATOM 0 HB2 SER A 26 2.332 -13.604 -10.235 1.00 0.00 H new ATOM 0 HB3 SER A 26 2.449 -12.394 -11.498 1.00 0.00 H new ATOM 0 HG SER A 26 2.902 -11.215 -9.095 1.00 0.00 H new ATOM 336 N LEU A 27 -0.138 -13.809 -8.812 1.00 0.00 N ATOM 337 CA LEU A 27 -0.616 -14.512 -7.627 1.00 0.00 C ATOM 338 C LEU A 27 -0.018 -15.913 -7.547 1.00 0.00 C ATOM 339 O LEU A 27 -0.532 -16.852 -8.153 1.00 0.00 O ATOM 340 CB LEU A 27 -2.143 -14.597 -7.640 1.00 0.00 C ATOM 341 CG LEU A 27 -2.886 -13.278 -7.855 1.00 0.00 C ATOM 342 CD1 LEU A 27 -4.342 -13.537 -8.210 1.00 0.00 C ATOM 343 CD2 LEU A 27 -2.786 -12.401 -6.615 1.00 0.00 C ATOM 0 H LEU A 27 -0.297 -14.305 -9.689 1.00 0.00 H new ATOM 0 HA LEU A 27 -0.298 -13.950 -6.749 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.442 -15.292 -8.425 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -2.471 -15.026 -6.693 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.418 -12.752 -8.687 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -4.855 -12.587 -8.359 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -4.394 -14.125 -9.126 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -4.822 -14.085 -7.399 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -3.320 -11.467 -6.786 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -3.228 -12.921 -5.765 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -1.738 -12.186 -6.405 1.00 0.00 H new ATOM 355 N GLU A 28 1.069 -16.045 -6.793 1.00 0.00 N ATOM 356 CA GLU A 28 1.736 -17.332 -6.633 1.00 0.00 C ATOM 357 C GLU A 28 1.029 -18.184 -5.583 1.00 0.00 C ATOM 358 O GLU A 28 1.335 -18.103 -4.393 1.00 0.00 O ATOM 359 CB GLU A 28 3.200 -17.128 -6.239 1.00 0.00 C ATOM 360 CG GLU A 28 4.065 -18.358 -6.455 1.00 0.00 C ATOM 361 CD GLU A 28 4.063 -18.828 -7.897 1.00 0.00 C ATOM 362 OE1 GLU A 28 4.536 -18.070 -8.769 1.00 0.00 O ATOM 363 OE2 GLU A 28 3.587 -19.954 -8.152 1.00 0.00 O ATOM 0 H GLU A 28 1.506 -15.277 -6.284 1.00 0.00 H new ATOM 0 HA GLU A 28 1.694 -17.855 -7.589 1.00 0.00 H new ATOM 0 HB2 GLU A 28 3.611 -16.299 -6.816 1.00 0.00 H new ATOM 0 HB3 GLU A 28 3.248 -16.840 -5.189 1.00 0.00 H new ATOM 0 HG2 GLU A 28 5.088 -18.136 -6.151 1.00 0.00 H new ATOM 0 HG3 GLU A 28 3.710 -19.164 -5.814 1.00 0.00 H new ATOM 370 N VAL A 29 0.081 -19.000 -6.031 1.00 0.00 N ATOM 371 CA VAL A 29 -0.670 -19.868 -5.131 1.00 0.00 C ATOM 372 C VAL A 29 0.258 -20.820 -4.385 1.00 0.00 C ATOM 373 O VAL A 29 0.526 -21.930 -4.846 1.00 0.00 O ATOM 374 CB VAL A 29 -1.725 -20.690 -5.895 1.00 0.00 C ATOM 375 CG1 VAL A 29 -2.421 -21.666 -4.959 1.00 0.00 C ATOM 376 CG2 VAL A 29 -2.734 -19.769 -6.565 1.00 0.00 C ATOM 0 H VAL A 29 -0.186 -19.079 -7.012 1.00 0.00 H new ATOM 0 HA VAL A 29 -1.174 -19.221 -4.414 1.00 0.00 H new ATOM 0 HB VAL A 29 -1.221 -21.265 -6.671 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -3.163 -22.238 -5.516 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -1.685 -22.346 -4.530 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -2.914 -21.114 -4.159 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.472 -20.366 -7.100 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -3.235 -19.166 -5.808 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.218 -19.114 -7.268 1.00 0.00 H new ATOM 386 N ARG A 30 0.745 -20.379 -3.230 1.00 0.00 N ATOM 387 CA ARG A 30 1.643 -21.192 -2.419 1.00 0.00 C ATOM 388 C ARG A 30 0.960 -22.483 -1.980 1.00 0.00 C ATOM 389 O ARG A 30 1.494 -23.575 -2.170 1.00 0.00 O ATOM 390 CB ARG A 30 2.110 -20.406 -1.193 1.00 0.00 C ATOM 391 CG ARG A 30 3.072 -19.276 -1.522 1.00 0.00 C ATOM 392 CD ARG A 30 4.497 -19.785 -1.675 1.00 0.00 C ATOM 393 NE ARG A 30 4.712 -20.430 -2.967 1.00 0.00 N ATOM 394 CZ ARG A 30 5.768 -21.188 -3.243 1.00 0.00 C ATOM 395 NH1 ARG A 30 6.699 -21.394 -2.322 1.00 0.00 N ATOM 396 NH2 ARG A 30 5.894 -21.741 -4.443 1.00 0.00 N ATOM 0 H ARG A 30 0.533 -19.463 -2.835 1.00 0.00 H new ATOM 0 HA ARG A 30 2.510 -21.449 -3.028 1.00 0.00 H new ATOM 0 HB2 ARG A 30 1.239 -19.993 -0.684 1.00 0.00 H new ATOM 0 HB3 ARG A 30 2.593 -21.091 -0.496 1.00 0.00 H new ATOM 0 HG2 ARG A 30 2.758 -18.786 -2.444 1.00 0.00 H new ATOM 0 HG3 ARG A 30 3.036 -18.524 -0.733 1.00 0.00 H new ATOM 0 HD2 ARG A 30 5.193 -18.953 -1.565 1.00 0.00 H new ATOM 0 HD3 ARG A 30 4.717 -20.493 -0.876 1.00 0.00 H new ATOM 0 HE ARG A 30 4.014 -20.291 -3.697 1.00 0.00 H new ATOM 0 HH11 ARG A 30 6.606 -20.970 -1.399 1.00 0.00 H new ATOM 0 HH12 ARG A 30 7.509 -21.976 -2.536 1.00 0.00 H new ATOM 0 HH21 ARG A 30 5.180 -21.584 -5.154 1.00 0.00 H new ATOM 0 HH22 ARG A 30 6.705 -22.323 -4.654 1.00 0.00 H new ATOM 410 N ASN A 31 -0.223 -22.350 -1.390 1.00 0.00 N ATOM 411 CA ASN A 31 -0.979 -23.506 -0.922 1.00 0.00 C ATOM 412 C ASN A 31 -2.445 -23.400 -1.332 1.00 0.00 C ATOM 413 O ASN A 31 -2.860 -22.413 -1.940 1.00 0.00 O ATOM 414 CB ASN A 31 -0.871 -23.631 0.599 1.00 0.00 C ATOM 415 CG ASN A 31 0.476 -24.170 1.040 1.00 0.00 C ATOM 416 OD1 ASN A 31 1.041 -25.059 0.402 1.00 0.00 O ATOM 417 ND2 ASN A 31 0.997 -23.634 2.138 1.00 0.00 N ATOM 0 H ASN A 31 -0.679 -21.453 -1.224 1.00 0.00 H new ATOM 0 HA ASN A 31 -0.554 -24.397 -1.384 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -1.035 -22.654 1.054 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -1.660 -24.289 0.964 1.00 0.00 H new ATOM 0 HD21 ASN A 31 1.900 -23.957 2.484 1.00 0.00 H new ATOM 0 HD22 ASN A 31 0.494 -22.899 2.635 1.00 0.00 H new ATOM 424 N SER A 32 -3.223 -24.423 -0.994 1.00 0.00 N ATOM 425 CA SER A 32 -4.642 -24.447 -1.329 1.00 0.00 C ATOM 426 C SER A 32 -5.433 -23.520 -0.411 1.00 0.00 C ATOM 427 O SER A 32 -6.549 -23.111 -0.733 1.00 0.00 O ATOM 428 CB SER A 32 -5.188 -25.872 -1.227 1.00 0.00 C ATOM 429 OG SER A 32 -5.139 -26.343 0.109 1.00 0.00 O ATOM 0 H SER A 32 -2.895 -25.246 -0.489 1.00 0.00 H new ATOM 0 HA SER A 32 -4.754 -24.096 -2.355 1.00 0.00 H new ATOM 0 HB2 SER A 32 -6.216 -25.897 -1.587 1.00 0.00 H new ATOM 0 HB3 SER A 32 -4.608 -26.534 -1.871 1.00 0.00 H new ATOM 0 HG SER A 32 -5.495 -27.255 0.148 1.00 0.00 H new ATOM 435 N LYS A 33 -4.847 -23.193 0.736 1.00 0.00 N ATOM 436 CA LYS A 33 -5.494 -22.313 1.702 1.00 0.00 C ATOM 437 C LYS A 33 -4.790 -20.961 1.764 1.00 0.00 C ATOM 438 O LYS A 33 -5.329 -19.995 2.303 1.00 0.00 O ATOM 439 CB LYS A 33 -5.498 -22.961 3.089 1.00 0.00 C ATOM 440 CG LYS A 33 -4.109 -23.269 3.621 1.00 0.00 C ATOM 441 CD LYS A 33 -4.144 -23.623 5.098 1.00 0.00 C ATOM 442 CE LYS A 33 -4.346 -22.387 5.963 1.00 0.00 C ATOM 443 NZ LYS A 33 -4.625 -22.743 7.382 1.00 0.00 N ATOM 0 H LYS A 33 -3.925 -23.524 1.019 1.00 0.00 H new ATOM 0 HA LYS A 33 -6.522 -22.153 1.378 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -6.007 -22.298 3.789 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.075 -23.885 3.047 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -3.678 -24.097 3.058 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.460 -22.407 3.468 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -4.949 -24.334 5.284 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -3.213 -24.116 5.377 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -3.456 -21.760 5.914 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.173 -21.798 5.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -4.757 -21.874 7.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -5.489 -23.320 7.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -3.825 -23.284 7.768 1.00 0.00 H new ATOM 457 N SER A 34 -3.585 -20.901 1.207 1.00 0.00 N ATOM 458 CA SER A 34 -2.807 -19.667 1.201 1.00 0.00 C ATOM 459 C SER A 34 -2.426 -19.273 -0.223 1.00 0.00 C ATOM 460 O SER A 34 -2.149 -20.129 -1.063 1.00 0.00 O ATOM 461 CB SER A 34 -1.546 -19.830 2.052 1.00 0.00 C ATOM 462 OG SER A 34 -0.480 -20.366 1.287 1.00 0.00 O ATOM 0 H SER A 34 -3.126 -21.691 0.754 1.00 0.00 H new ATOM 0 HA SER A 34 -3.424 -18.875 1.626 1.00 0.00 H new ATOM 0 HB2 SER A 34 -1.253 -18.864 2.463 1.00 0.00 H new ATOM 0 HB3 SER A 34 -1.756 -20.485 2.897 1.00 0.00 H new ATOM 0 HG SER A 34 0.315 -20.459 1.853 1.00 0.00 H new ATOM 468 N ILE A 35 -2.414 -17.970 -0.486 1.00 0.00 N ATOM 469 CA ILE A 35 -2.066 -17.461 -1.807 1.00 0.00 C ATOM 470 C ILE A 35 -1.109 -16.278 -1.706 1.00 0.00 C ATOM 471 O ILE A 35 -1.450 -15.238 -1.144 1.00 0.00 O ATOM 472 CB ILE A 35 -3.318 -17.029 -2.592 1.00 0.00 C ATOM 473 CG1 ILE A 35 -4.241 -18.227 -2.824 1.00 0.00 C ATOM 474 CG2 ILE A 35 -2.921 -16.395 -3.916 1.00 0.00 C ATOM 475 CD1 ILE A 35 -5.607 -17.845 -3.348 1.00 0.00 C ATOM 0 H ILE A 35 -2.641 -17.248 0.198 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.577 -18.276 -2.340 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.858 -16.287 -2.004 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.767 -18.909 -3.531 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.359 -18.771 -1.887 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.817 -16.095 -4.459 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.300 -15.519 -3.728 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.361 -17.116 -4.511 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.207 -18.744 -3.489 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -6.101 -17.188 -2.632 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.499 -17.328 -4.301 1.00 0.00 H new ATOM 487 N MET A 36 0.090 -16.445 -2.254 1.00 0.00 N ATOM 488 CA MET A 36 1.095 -15.389 -2.228 1.00 0.00 C ATOM 489 C MET A 36 0.886 -14.411 -3.380 1.00 0.00 C ATOM 490 O MET A 36 0.655 -14.819 -4.518 1.00 0.00 O ATOM 491 CB MET A 36 2.500 -15.991 -2.303 1.00 0.00 C ATOM 492 CG MET A 36 3.593 -14.957 -2.517 1.00 0.00 C ATOM 493 SD MET A 36 5.170 -15.455 -1.798 1.00 0.00 S ATOM 494 CE MET A 36 5.155 -14.520 -0.270 1.00 0.00 C ATOM 0 H MET A 36 0.389 -17.301 -2.721 1.00 0.00 H new ATOM 0 HA MET A 36 0.990 -14.845 -1.289 1.00 0.00 H new ATOM 0 HB2 MET A 36 2.702 -16.536 -1.381 1.00 0.00 H new ATOM 0 HB3 MET A 36 2.533 -16.716 -3.116 1.00 0.00 H new ATOM 0 HG2 MET A 36 3.723 -14.787 -3.586 1.00 0.00 H new ATOM 0 HG3 MET A 36 3.282 -14.009 -2.079 1.00 0.00 H new ATOM 0 HE1 MET A 36 6.069 -14.722 0.289 1.00 0.00 H new ATOM 0 HE2 MET A 36 5.096 -13.455 -0.496 1.00 0.00 H new ATOM 0 HE3 MET A 36 4.292 -14.813 0.327 1.00 0.00 H new ATOM 504 N ILE A 37 0.969 -13.120 -3.076 1.00 0.00 N ATOM 505 CA ILE A 37 0.789 -12.085 -4.086 1.00 0.00 C ATOM 506 C ILE A 37 2.111 -11.397 -4.409 1.00 0.00 C ATOM 507 O ILE A 37 2.812 -10.924 -3.514 1.00 0.00 O ATOM 508 CB ILE A 37 -0.231 -11.025 -3.631 1.00 0.00 C ATOM 509 CG1 ILE A 37 -1.426 -11.695 -2.950 1.00 0.00 C ATOM 510 CG2 ILE A 37 -0.690 -10.189 -4.817 1.00 0.00 C ATOM 511 CD1 ILE A 37 -2.380 -10.716 -2.304 1.00 0.00 C ATOM 0 H ILE A 37 1.160 -12.766 -2.139 1.00 0.00 H new ATOM 0 HA ILE A 37 0.411 -12.580 -4.981 1.00 0.00 H new ATOM 0 HB ILE A 37 0.250 -10.364 -2.910 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.969 -12.287 -3.687 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.060 -12.388 -2.192 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.411 -9.444 -4.480 1.00 0.00 H new ATOM 0 HG22 ILE A 37 0.169 -9.687 -5.263 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.157 -10.836 -5.559 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.203 -11.261 -1.841 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.852 -10.141 -1.543 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.775 -10.039 -3.061 1.00 0.00 H new ATOM 523 N HIS A 38 2.445 -11.342 -5.695 1.00 0.00 N ATOM 524 CA HIS A 38 3.682 -10.708 -6.136 1.00 0.00 C ATOM 525 C HIS A 38 3.390 -9.542 -7.076 1.00 0.00 C ATOM 526 O HIS A 38 2.724 -9.708 -8.098 1.00 0.00 O ATOM 527 CB HIS A 38 4.581 -11.729 -6.835 1.00 0.00 C ATOM 528 CG HIS A 38 5.220 -12.706 -5.897 1.00 0.00 C ATOM 529 ND1 HIS A 38 6.409 -12.457 -5.245 1.00 0.00 N ATOM 530 CD2 HIS A 38 4.827 -13.939 -5.501 1.00 0.00 C ATOM 531 CE1 HIS A 38 6.721 -13.495 -4.490 1.00 0.00 C ATOM 532 NE2 HIS A 38 5.777 -14.408 -4.627 1.00 0.00 N ATOM 0 H HIS A 38 1.877 -11.728 -6.449 1.00 0.00 H new ATOM 0 HA HIS A 38 4.198 -10.322 -5.257 1.00 0.00 H new ATOM 0 HB2 HIS A 38 3.992 -12.276 -7.570 1.00 0.00 H new ATOM 0 HB3 HIS A 38 5.361 -11.200 -7.382 1.00 0.00 H new ATOM 0 HD2 HIS A 38 3.933 -14.458 -5.814 1.00 0.00 H new ATOM 0 HE1 HIS A 38 7.599 -13.582 -3.867 1.00 0.00 H new ATOM 0 HE2 HIS A 38 5.757 -15.314 -4.160 1.00 0.00 H new ATOM 541 N TRP A 39 3.892 -8.364 -6.723 1.00 0.00 N ATOM 542 CA TRP A 39 3.684 -7.171 -7.535 1.00 0.00 C ATOM 543 C TRP A 39 4.953 -6.328 -7.598 1.00 0.00 C ATOM 544 O TRP A 39 5.941 -6.627 -6.929 1.00 0.00 O ATOM 545 CB TRP A 39 2.532 -6.339 -6.969 1.00 0.00 C ATOM 546 CG TRP A 39 2.823 -5.762 -5.617 1.00 0.00 C ATOM 547 CD1 TRP A 39 3.356 -4.534 -5.348 1.00 0.00 C ATOM 548 CD2 TRP A 39 2.600 -6.391 -4.351 1.00 0.00 C ATOM 549 NE1 TRP A 39 3.478 -4.361 -3.990 1.00 0.00 N ATOM 550 CE2 TRP A 39 3.020 -5.486 -3.356 1.00 0.00 C ATOM 551 CE3 TRP A 39 2.084 -7.629 -3.960 1.00 0.00 C ATOM 552 CZ2 TRP A 39 2.940 -5.782 -1.998 1.00 0.00 C ATOM 553 CZ3 TRP A 39 2.006 -7.922 -2.612 1.00 0.00 C ATOM 554 CH2 TRP A 39 2.431 -7.002 -1.644 1.00 0.00 C ATOM 0 H TRP A 39 4.446 -8.210 -5.880 1.00 0.00 H new ATOM 0 HA TRP A 39 3.431 -7.489 -8.546 1.00 0.00 H new ATOM 0 HB2 TRP A 39 2.305 -5.528 -7.661 1.00 0.00 H new ATOM 0 HB3 TRP A 39 1.640 -6.963 -6.906 1.00 0.00 H new ATOM 0 HD1 TRP A 39 3.640 -3.806 -6.093 1.00 0.00 H new ATOM 0 HE1 TRP A 39 3.849 -3.530 -3.529 1.00 0.00 H new ATOM 0 HE3 TRP A 39 1.752 -8.344 -4.698 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 3.268 -5.074 -1.251 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 1.611 -8.877 -2.299 1.00 0.00 H new ATOM 0 HH2 TRP A 39 2.355 -7.261 -0.598 1.00 0.00 H new ATOM 565 N GLN A 40 4.917 -5.273 -8.407 1.00 0.00 N ATOM 566 CA GLN A 40 6.066 -4.388 -8.557 1.00 0.00 C ATOM 567 C GLN A 40 5.648 -2.927 -8.426 1.00 0.00 C ATOM 568 O GLN A 40 4.505 -2.556 -8.696 1.00 0.00 O ATOM 569 CB GLN A 40 6.741 -4.618 -9.910 1.00 0.00 C ATOM 570 CG GLN A 40 7.413 -5.976 -10.032 1.00 0.00 C ATOM 571 CD GLN A 40 8.515 -6.175 -9.011 1.00 0.00 C ATOM 572 OE1 GLN A 40 9.166 -5.219 -8.588 1.00 0.00 O ATOM 573 NE2 GLN A 40 8.732 -7.422 -8.609 1.00 0.00 N ATOM 0 H GLN A 40 4.106 -5.011 -8.967 1.00 0.00 H new ATOM 0 HA GLN A 40 6.775 -4.617 -7.762 1.00 0.00 H new ATOM 0 HB2 GLN A 40 5.996 -4.518 -10.700 1.00 0.00 H new ATOM 0 HB3 GLN A 40 7.485 -3.838 -10.073 1.00 0.00 H new ATOM 0 HG2 GLN A 40 6.665 -6.760 -9.911 1.00 0.00 H new ATOM 0 HG3 GLN A 40 7.828 -6.083 -11.034 1.00 0.00 H new ATOM 0 HE21 GLN A 40 8.169 -8.185 -8.986 1.00 0.00 H new ATOM 0 HE22 GLN A 40 9.462 -7.617 -7.924 1.00 0.00 H new ATOM 582 N PRO A 41 6.594 -2.076 -8.001 1.00 0.00 N ATOM 583 CA PRO A 41 6.347 -0.642 -7.824 1.00 0.00 C ATOM 584 C PRO A 41 6.155 0.081 -9.153 1.00 0.00 C ATOM 585 O PRO A 41 6.825 -0.205 -10.145 1.00 0.00 O ATOM 586 CB PRO A 41 7.615 -0.147 -7.124 1.00 0.00 C ATOM 587 CG PRO A 41 8.671 -1.122 -7.520 1.00 0.00 C ATOM 588 CD PRO A 41 7.977 -2.449 -7.661 1.00 0.00 C ATOM 0 HA PRO A 41 5.432 -0.452 -7.262 1.00 0.00 H new ATOM 0 HB2 PRO A 41 7.872 0.864 -7.439 1.00 0.00 H new ATOM 0 HB3 PRO A 41 7.486 -0.121 -6.042 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.143 -0.827 -8.457 1.00 0.00 H new ATOM 0 HG3 PRO A 41 9.459 -1.171 -6.768 1.00 0.00 H new ATOM 0 HD2 PRO A 41 8.432 -3.060 -8.441 1.00 0.00 H new ATOM 0 HD3 PRO A 41 8.022 -3.026 -6.737 1.00 0.00 H new ATOM 596 N PRO A 42 5.220 1.042 -9.175 1.00 0.00 N ATOM 597 CA PRO A 42 4.919 1.827 -10.376 1.00 0.00 C ATOM 598 C PRO A 42 6.049 2.783 -10.742 1.00 0.00 C ATOM 599 O PRO A 42 6.991 2.969 -9.972 1.00 0.00 O ATOM 600 CB PRO A 42 3.663 2.609 -9.983 1.00 0.00 C ATOM 601 CG PRO A 42 3.725 2.705 -8.498 1.00 0.00 C ATOM 602 CD PRO A 42 4.384 1.437 -8.028 1.00 0.00 C ATOM 0 HA PRO A 42 4.787 1.194 -11.254 1.00 0.00 H new ATOM 0 HB2 PRO A 42 3.652 3.597 -10.443 1.00 0.00 H new ATOM 0 HB3 PRO A 42 2.759 2.095 -10.309 1.00 0.00 H new ATOM 0 HG2 PRO A 42 4.296 3.580 -8.187 1.00 0.00 H new ATOM 0 HG3 PRO A 42 2.727 2.807 -8.072 1.00 0.00 H new ATOM 0 HD2 PRO A 42 4.983 1.603 -7.133 1.00 0.00 H new ATOM 0 HD3 PRO A 42 3.650 0.670 -7.783 1.00 0.00 H new ATOM 610 N ALA A 43 5.949 3.386 -11.921 1.00 0.00 N ATOM 611 CA ALA A 43 6.962 4.325 -12.388 1.00 0.00 C ATOM 612 C ALA A 43 7.110 5.497 -11.424 1.00 0.00 C ATOM 613 O ALA A 43 6.177 5.866 -10.710 1.00 0.00 O ATOM 614 CB ALA A 43 6.615 4.827 -13.782 1.00 0.00 C ATOM 0 H ALA A 43 5.176 3.241 -12.571 1.00 0.00 H new ATOM 0 HA ALA A 43 7.916 3.800 -12.430 1.00 0.00 H new ATOM 0 HB1 ALA A 43 7.380 5.527 -14.118 1.00 0.00 H new ATOM 0 HB2 ALA A 43 6.568 3.984 -14.471 1.00 0.00 H new ATOM 0 HB3 ALA A 43 5.648 5.330 -13.757 1.00 0.00 H new ATOM 620 N PRO A 44 8.309 6.097 -11.400 1.00 0.00 N ATOM 621 CA PRO A 44 8.607 7.236 -10.526 1.00 0.00 C ATOM 622 C PRO A 44 7.874 8.502 -10.955 1.00 0.00 C ATOM 623 O PRO A 44 7.280 9.196 -10.130 1.00 0.00 O ATOM 624 CB PRO A 44 10.120 7.416 -10.682 1.00 0.00 C ATOM 625 CG PRO A 44 10.434 6.843 -12.021 1.00 0.00 C ATOM 626 CD PRO A 44 9.467 5.709 -12.223 1.00 0.00 C ATOM 0 HA PRO A 44 8.288 7.057 -9.499 1.00 0.00 H new ATOM 0 HB2 PRO A 44 10.401 8.468 -10.626 1.00 0.00 H new ATOM 0 HB3 PRO A 44 10.664 6.898 -9.892 1.00 0.00 H new ATOM 0 HG2 PRO A 44 10.323 7.594 -12.803 1.00 0.00 H new ATOM 0 HG3 PRO A 44 11.464 6.489 -12.062 1.00 0.00 H new ATOM 0 HD2 PRO A 44 9.194 5.596 -13.272 1.00 0.00 H new ATOM 0 HD3 PRO A 44 9.890 4.758 -11.899 1.00 0.00 H new ATOM 634 N ALA A 45 7.918 8.797 -12.250 1.00 0.00 N ATOM 635 CA ALA A 45 7.256 9.979 -12.788 1.00 0.00 C ATOM 636 C ALA A 45 5.830 10.096 -12.260 1.00 0.00 C ATOM 637 O ALA A 45 5.424 11.149 -11.766 1.00 0.00 O ATOM 638 CB ALA A 45 7.256 9.938 -14.309 1.00 0.00 C ATOM 0 H ALA A 45 8.406 8.233 -12.946 1.00 0.00 H new ATOM 0 HA ALA A 45 7.811 10.858 -12.460 1.00 0.00 H new ATOM 0 HB1 ALA A 45 6.758 10.827 -14.697 1.00 0.00 H new ATOM 0 HB2 ALA A 45 8.283 9.910 -14.672 1.00 0.00 H new ATOM 0 HB3 ALA A 45 6.726 9.048 -14.649 1.00 0.00 H new ATOM 644 N THR A 46 5.072 9.009 -12.368 1.00 0.00 N ATOM 645 CA THR A 46 3.691 8.991 -11.903 1.00 0.00 C ATOM 646 C THR A 46 3.616 9.186 -10.393 1.00 0.00 C ATOM 647 O THR A 46 2.811 9.976 -9.900 1.00 0.00 O ATOM 648 CB THR A 46 2.990 7.670 -12.274 1.00 0.00 C ATOM 649 OG1 THR A 46 3.774 6.558 -11.828 1.00 0.00 O ATOM 650 CG2 THR A 46 2.776 7.575 -13.777 1.00 0.00 C ATOM 0 H THR A 46 5.392 8.129 -12.774 1.00 0.00 H new ATOM 0 HA THR A 46 3.180 9.817 -12.399 1.00 0.00 H new ATOM 0 HB THR A 46 2.017 7.649 -11.782 1.00 0.00 H new ATOM 0 HG1 THR A 46 3.321 5.722 -12.066 1.00 0.00 H new ATOM 0 HG21 THR A 46 2.280 6.634 -14.015 1.00 0.00 H new ATOM 0 HG22 THR A 46 2.155 8.407 -14.109 1.00 0.00 H new ATOM 0 HG23 THR A 46 3.740 7.616 -14.285 1.00 0.00 H new ATOM 658 N GLN A 47 4.460 8.462 -9.665 1.00 0.00 N ATOM 659 CA GLN A 47 4.489 8.557 -8.210 1.00 0.00 C ATOM 660 C GLN A 47 4.452 10.013 -7.759 1.00 0.00 C ATOM 661 O GLN A 47 5.314 10.809 -8.129 1.00 0.00 O ATOM 662 CB GLN A 47 5.739 7.870 -7.658 1.00 0.00 C ATOM 663 CG GLN A 47 5.589 6.364 -7.506 1.00 0.00 C ATOM 664 CD GLN A 47 6.795 5.721 -6.850 1.00 0.00 C ATOM 665 OE1 GLN A 47 7.410 6.300 -5.954 1.00 0.00 O ATOM 666 NE2 GLN A 47 7.139 4.518 -7.293 1.00 0.00 N ATOM 0 H GLN A 47 5.132 7.804 -10.058 1.00 0.00 H new ATOM 0 HA GLN A 47 3.605 8.053 -7.820 1.00 0.00 H new ATOM 0 HB2 GLN A 47 6.580 8.078 -8.320 1.00 0.00 H new ATOM 0 HB3 GLN A 47 5.982 8.302 -6.687 1.00 0.00 H new ATOM 0 HG2 GLN A 47 4.700 6.149 -6.913 1.00 0.00 H new ATOM 0 HG3 GLN A 47 5.433 5.917 -8.488 1.00 0.00 H new ATOM 0 HE21 GLN A 47 6.600 4.076 -8.038 1.00 0.00 H new ATOM 0 HE22 GLN A 47 7.942 4.036 -6.889 1.00 0.00 H new ATOM 675 N ASN A 48 3.449 10.354 -6.957 1.00 0.00 N ATOM 676 CA ASN A 48 3.300 11.715 -6.455 1.00 0.00 C ATOM 677 C ASN A 48 3.809 11.825 -5.021 1.00 0.00 C ATOM 678 O ASN A 48 3.261 12.573 -4.212 1.00 0.00 O ATOM 679 CB ASN A 48 1.834 12.148 -6.522 1.00 0.00 C ATOM 680 CG ASN A 48 1.293 12.139 -7.939 1.00 0.00 C ATOM 681 OD1 ASN A 48 2.036 12.335 -8.900 1.00 0.00 O ATOM 682 ND2 ASN A 48 -0.008 11.909 -8.073 1.00 0.00 N ATOM 0 H ASN A 48 2.727 9.707 -6.641 1.00 0.00 H new ATOM 0 HA ASN A 48 3.896 12.375 -7.085 1.00 0.00 H new ATOM 0 HB2 ASN A 48 1.233 11.483 -5.902 1.00 0.00 H new ATOM 0 HB3 ASN A 48 1.734 13.150 -6.104 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -0.429 11.890 -9.002 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -0.586 11.752 -7.247 1.00 0.00 H new ATOM 689 N GLY A 49 4.862 11.074 -4.713 1.00 0.00 N ATOM 690 CA GLY A 49 5.428 11.102 -3.377 1.00 0.00 C ATOM 691 C GLY A 49 6.211 9.845 -3.053 1.00 0.00 C ATOM 692 O GLY A 49 6.960 9.340 -3.889 1.00 0.00 O ATOM 0 H GLY A 49 5.333 10.447 -5.365 1.00 0.00 H new ATOM 0 HA2 GLY A 49 6.082 11.969 -3.281 1.00 0.00 H new ATOM 0 HA3 GLY A 49 4.627 11.225 -2.649 1.00 0.00 H new ATOM 696 N GLN A 50 6.039 9.340 -1.835 1.00 0.00 N ATOM 697 CA GLN A 50 6.738 8.136 -1.403 1.00 0.00 C ATOM 698 C GLN A 50 5.751 7.075 -0.925 1.00 0.00 C ATOM 699 O GLN A 50 4.776 7.385 -0.240 1.00 0.00 O ATOM 700 CB GLN A 50 7.728 8.469 -0.285 1.00 0.00 C ATOM 701 CG GLN A 50 8.313 7.241 0.395 1.00 0.00 C ATOM 702 CD GLN A 50 9.712 7.480 0.927 1.00 0.00 C ATOM 703 OE1 GLN A 50 10.530 8.137 0.282 1.00 0.00 O ATOM 704 NE2 GLN A 50 9.996 6.947 2.109 1.00 0.00 N ATOM 0 H GLN A 50 5.422 9.746 -1.131 1.00 0.00 H new ATOM 0 HA GLN A 50 7.286 7.738 -2.257 1.00 0.00 H new ATOM 0 HB2 GLN A 50 8.540 9.068 -0.697 1.00 0.00 H new ATOM 0 HB3 GLN A 50 7.226 9.084 0.462 1.00 0.00 H new ATOM 0 HG2 GLN A 50 7.662 6.941 1.216 1.00 0.00 H new ATOM 0 HG3 GLN A 50 8.334 6.413 -0.314 1.00 0.00 H new ATOM 0 HE21 GLN A 50 9.288 6.410 2.610 1.00 0.00 H new ATOM 0 HE22 GLN A 50 10.922 7.075 2.517 1.00 0.00 H new ATOM 713 N ILE A 51 6.010 5.825 -1.291 1.00 0.00 N ATOM 714 CA ILE A 51 5.145 4.719 -0.899 1.00 0.00 C ATOM 715 C ILE A 51 5.407 4.301 0.543 1.00 0.00 C ATOM 716 O ILE A 51 6.547 4.039 0.928 1.00 0.00 O ATOM 717 CB ILE A 51 5.338 3.500 -1.819 1.00 0.00 C ATOM 718 CG1 ILE A 51 4.920 3.842 -3.251 1.00 0.00 C ATOM 719 CG2 ILE A 51 4.542 2.312 -1.299 1.00 0.00 C ATOM 720 CD1 ILE A 51 5.434 2.861 -4.281 1.00 0.00 C ATOM 0 H ILE A 51 6.812 5.552 -1.859 1.00 0.00 H new ATOM 0 HA ILE A 51 4.118 5.073 -0.991 1.00 0.00 H new ATOM 0 HB ILE A 51 6.394 3.231 -1.823 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.832 3.876 -3.305 1.00 0.00 H new ATOM 0 HG13 ILE A 51 5.283 4.840 -3.498 1.00 0.00 H new ATOM 0 HG21 ILE A 51 4.689 1.458 -1.960 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.883 2.057 -0.296 1.00 0.00 H new ATOM 0 HG23 ILE A 51 3.483 2.569 -1.268 1.00 0.00 H new ATOM 0 HD11 ILE A 51 5.099 3.166 -5.273 1.00 0.00 H new ATOM 0 HD12 ILE A 51 6.524 2.844 -4.255 1.00 0.00 H new ATOM 0 HD13 ILE A 51 5.050 1.865 -4.059 1.00 0.00 H new ATOM 732 N THR A 52 4.344 4.238 1.338 1.00 0.00 N ATOM 733 CA THR A 52 4.458 3.850 2.739 1.00 0.00 C ATOM 734 C THR A 52 3.974 2.421 2.955 1.00 0.00 C ATOM 735 O THR A 52 4.554 1.670 3.737 1.00 0.00 O ATOM 736 CB THR A 52 3.654 4.796 3.651 1.00 0.00 C ATOM 737 OG1 THR A 52 2.283 4.823 3.241 1.00 0.00 O ATOM 738 CG2 THR A 52 4.229 6.204 3.611 1.00 0.00 C ATOM 0 H THR A 52 3.393 4.451 1.036 1.00 0.00 H new ATOM 0 HA THR A 52 5.514 3.916 3.000 1.00 0.00 H new ATOM 0 HB THR A 52 3.720 4.423 4.673 1.00 0.00 H new ATOM 0 HG1 THR A 52 1.778 5.425 3.827 1.00 0.00 H new ATOM 0 HG21 THR A 52 3.645 6.854 4.262 1.00 0.00 H new ATOM 0 HG22 THR A 52 5.264 6.184 3.952 1.00 0.00 H new ATOM 0 HG23 THR A 52 4.190 6.584 2.590 1.00 0.00 H new ATOM 746 N GLY A 53 2.906 2.050 2.255 1.00 0.00 N ATOM 747 CA GLY A 53 2.362 0.711 2.384 1.00 0.00 C ATOM 748 C GLY A 53 1.398 0.366 1.266 1.00 0.00 C ATOM 749 O GLY A 53 1.018 1.230 0.476 1.00 0.00 O ATOM 0 H GLY A 53 2.408 2.653 1.601 1.00 0.00 H new ATOM 0 HA2 GLY A 53 3.179 -0.011 2.391 1.00 0.00 H new ATOM 0 HA3 GLY A 53 1.850 0.621 3.342 1.00 0.00 H new ATOM 753 N TYR A 54 1.003 -0.900 1.198 1.00 0.00 N ATOM 754 CA TYR A 54 0.080 -1.358 0.166 1.00 0.00 C ATOM 755 C TYR A 54 -1.166 -1.981 0.787 1.00 0.00 C ATOM 756 O TYR A 54 -1.090 -2.671 1.804 1.00 0.00 O ATOM 757 CB TYR A 54 0.769 -2.372 -0.749 1.00 0.00 C ATOM 758 CG TYR A 54 1.874 -1.776 -1.591 1.00 0.00 C ATOM 759 CD1 TYR A 54 1.587 -1.075 -2.756 1.00 0.00 C ATOM 760 CD2 TYR A 54 3.207 -1.912 -1.220 1.00 0.00 C ATOM 761 CE1 TYR A 54 2.594 -0.529 -3.528 1.00 0.00 C ATOM 762 CE2 TYR A 54 4.220 -1.368 -1.985 1.00 0.00 C ATOM 763 CZ TYR A 54 3.909 -0.678 -3.139 1.00 0.00 C ATOM 764 OH TYR A 54 4.915 -0.134 -3.904 1.00 0.00 O ATOM 0 H TYR A 54 1.307 -1.628 1.845 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.224 -0.493 -0.424 1.00 0.00 H new ATOM 0 HB2 TYR A 54 1.182 -3.176 -0.140 1.00 0.00 H new ATOM 0 HB3 TYR A 54 0.024 -2.820 -1.407 1.00 0.00 H new ATOM 0 HD1 TYR A 54 0.559 -0.955 -3.063 1.00 0.00 H new ATOM 0 HD2 TYR A 54 3.455 -2.452 -0.318 1.00 0.00 H new ATOM 0 HE1 TYR A 54 2.353 0.012 -4.431 1.00 0.00 H new ATOM 0 HE2 TYR A 54 5.250 -1.482 -1.682 1.00 0.00 H new ATOM 0 HH TYR A 54 5.670 0.107 -3.328 1.00 0.00 H new ATOM 774 N LYS A 55 -2.315 -1.733 0.166 1.00 0.00 N ATOM 775 CA LYS A 55 -3.580 -2.270 0.654 1.00 0.00 C ATOM 776 C LYS A 55 -4.062 -3.415 -0.230 1.00 0.00 C ATOM 777 O LYS A 55 -4.617 -3.189 -1.306 1.00 0.00 O ATOM 778 CB LYS A 55 -4.640 -1.168 0.703 1.00 0.00 C ATOM 779 CG LYS A 55 -5.714 -1.402 1.752 1.00 0.00 C ATOM 780 CD LYS A 55 -6.359 -0.099 2.190 1.00 0.00 C ATOM 781 CE LYS A 55 -5.488 0.646 3.190 1.00 0.00 C ATOM 782 NZ LYS A 55 -6.211 1.789 3.814 1.00 0.00 N ATOM 0 H LYS A 55 -2.396 -1.163 -0.676 1.00 0.00 H new ATOM 0 HA LYS A 55 -3.418 -2.655 1.661 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -4.151 -0.214 0.902 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -5.112 -1.086 -0.276 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -6.477 -2.069 1.351 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -5.277 -1.901 2.617 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -6.535 0.532 1.319 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -7.332 -0.305 2.636 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -5.158 -0.043 3.968 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -4.593 1.013 2.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -5.583 2.270 4.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -6.504 2.460 3.075 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -7.052 1.436 4.314 1.00 0.00 H new ATOM 796 N ILE A 56 -3.849 -4.643 0.231 1.00 0.00 N ATOM 797 CA ILE A 56 -4.265 -5.822 -0.518 1.00 0.00 C ATOM 798 C ILE A 56 -5.614 -6.337 -0.028 1.00 0.00 C ATOM 799 O ILE A 56 -5.734 -6.817 1.100 1.00 0.00 O ATOM 800 CB ILE A 56 -3.226 -6.954 -0.409 1.00 0.00 C ATOM 801 CG1 ILE A 56 -1.854 -6.462 -0.873 1.00 0.00 C ATOM 802 CG2 ILE A 56 -3.667 -8.158 -1.227 1.00 0.00 C ATOM 803 CD1 ILE A 56 -0.724 -7.407 -0.528 1.00 0.00 C ATOM 0 H ILE A 56 -3.391 -4.847 1.119 1.00 0.00 H new ATOM 0 HA ILE A 56 -4.352 -5.518 -1.561 1.00 0.00 H new ATOM 0 HB ILE A 56 -3.149 -7.257 0.635 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -1.876 -6.314 -1.953 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -1.654 -5.490 -0.422 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -2.923 -8.949 -1.140 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -4.626 -8.519 -0.855 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -3.769 -7.869 -2.273 1.00 0.00 H new ATOM 0 HD11 ILE A 56 0.218 -6.994 -0.887 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -0.675 -7.536 0.553 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -0.900 -8.373 -1.001 1.00 0.00 H new ATOM 815 N ARG A 57 -6.626 -6.236 -0.883 1.00 0.00 N ATOM 816 CA ARG A 57 -7.967 -6.693 -0.537 1.00 0.00 C ATOM 817 C ARG A 57 -8.387 -7.865 -1.419 1.00 0.00 C ATOM 818 O ARG A 57 -8.148 -7.863 -2.627 1.00 0.00 O ATOM 819 CB ARG A 57 -8.971 -5.547 -0.680 1.00 0.00 C ATOM 820 CG ARG A 57 -8.995 -4.605 0.512 1.00 0.00 C ATOM 821 CD ARG A 57 -9.722 -3.310 0.184 1.00 0.00 C ATOM 822 NE ARG A 57 -10.297 -2.689 1.375 1.00 0.00 N ATOM 823 CZ ARG A 57 -11.384 -3.143 1.988 1.00 0.00 C ATOM 824 NH1 ARG A 57 -12.011 -4.216 1.526 1.00 0.00 N ATOM 825 NH2 ARG A 57 -11.846 -2.523 3.066 1.00 0.00 N ATOM 0 H ARG A 57 -6.543 -5.842 -1.820 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.953 -7.029 0.500 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -8.733 -4.977 -1.578 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -9.968 -5.964 -0.822 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -9.484 -5.095 1.354 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.974 -4.382 0.822 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -9.028 -2.615 -0.289 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -10.513 -3.511 -0.538 1.00 0.00 H new ATOM 0 HE ARG A 57 -9.838 -1.862 1.756 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -11.659 -4.695 0.697 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -12.846 -4.562 1.999 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -11.366 -1.697 3.424 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -12.681 -2.872 3.537 1.00 0.00 H new ATOM 839 N TYR A 58 -9.013 -8.864 -0.807 1.00 0.00 N ATOM 840 CA TYR A 58 -9.463 -10.044 -1.536 1.00 0.00 C ATOM 841 C TYR A 58 -10.879 -10.433 -1.121 1.00 0.00 C ATOM 842 O TYR A 58 -11.235 -10.361 0.055 1.00 0.00 O ATOM 843 CB TYR A 58 -8.509 -11.215 -1.292 1.00 0.00 C ATOM 844 CG TYR A 58 -8.403 -11.617 0.162 1.00 0.00 C ATOM 845 CD1 TYR A 58 -7.455 -11.036 0.996 1.00 0.00 C ATOM 846 CD2 TYR A 58 -9.249 -12.578 0.701 1.00 0.00 C ATOM 847 CE1 TYR A 58 -7.354 -11.400 2.324 1.00 0.00 C ATOM 848 CE2 TYR A 58 -9.155 -12.948 2.029 1.00 0.00 C ATOM 849 CZ TYR A 58 -8.206 -12.356 2.836 1.00 0.00 C ATOM 850 OH TYR A 58 -8.109 -12.723 4.159 1.00 0.00 O ATOM 0 H TYR A 58 -9.220 -8.880 0.192 1.00 0.00 H new ATOM 0 HA TYR A 58 -9.468 -9.803 -2.599 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -8.844 -12.073 -1.874 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -7.518 -10.948 -1.660 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -6.786 -10.287 0.599 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -9.993 -13.044 0.071 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -6.612 -10.939 2.958 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -9.821 -13.696 2.433 1.00 0.00 H new ATOM 0 HH TYR A 58 -8.782 -13.406 4.359 1.00 0.00 H new ATOM 860 N ARG A 59 -11.682 -10.845 -2.097 1.00 0.00 N ATOM 861 CA ARG A 59 -13.060 -11.245 -1.835 1.00 0.00 C ATOM 862 C ARG A 59 -13.352 -12.615 -2.440 1.00 0.00 C ATOM 863 O ARG A 59 -12.494 -13.217 -3.086 1.00 0.00 O ATOM 864 CB ARG A 59 -14.031 -10.207 -2.401 1.00 0.00 C ATOM 865 CG ARG A 59 -13.980 -10.088 -3.915 1.00 0.00 C ATOM 866 CD ARG A 59 -14.778 -8.891 -4.407 1.00 0.00 C ATOM 867 NE ARG A 59 -14.348 -8.454 -5.733 1.00 0.00 N ATOM 868 CZ ARG A 59 -14.650 -9.101 -6.853 1.00 0.00 C ATOM 869 NH1 ARG A 59 -15.378 -10.208 -6.808 1.00 0.00 N ATOM 870 NH2 ARG A 59 -14.222 -8.642 -8.022 1.00 0.00 N ATOM 0 H ARG A 59 -11.402 -10.911 -3.076 1.00 0.00 H new ATOM 0 HA ARG A 59 -13.195 -11.308 -0.755 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -15.045 -10.468 -2.099 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -13.808 -9.235 -1.961 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -12.944 -9.994 -4.239 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -14.373 -10.999 -4.366 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -15.837 -9.148 -4.436 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -14.669 -8.068 -3.701 1.00 0.00 H new ATOM 0 HE ARG A 59 -13.785 -7.606 -5.803 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -15.708 -10.565 -5.911 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -15.608 -10.702 -7.670 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -13.660 -7.791 -8.061 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -14.455 -9.140 -8.881 1.00 0.00 H new ATOM 884 N LYS A 60 -14.570 -13.102 -2.226 1.00 0.00 N ATOM 885 CA LYS A 60 -14.977 -14.400 -2.750 1.00 0.00 C ATOM 886 C LYS A 60 -15.812 -14.238 -4.016 1.00 0.00 C ATOM 887 O LYS A 60 -16.676 -13.365 -4.094 1.00 0.00 O ATOM 888 CB LYS A 60 -15.776 -15.171 -1.696 1.00 0.00 C ATOM 889 CG LYS A 60 -14.916 -16.050 -0.804 1.00 0.00 C ATOM 890 CD LYS A 60 -15.755 -16.796 0.219 1.00 0.00 C ATOM 891 CE LYS A 60 -16.366 -18.057 -0.374 1.00 0.00 C ATOM 892 NZ LYS A 60 -17.105 -18.849 0.648 1.00 0.00 N ATOM 0 H LYS A 60 -15.292 -12.617 -1.693 1.00 0.00 H new ATOM 0 HA LYS A 60 -14.077 -14.962 -2.998 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -16.322 -14.461 -1.075 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -16.518 -15.792 -2.197 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -14.367 -16.765 -1.417 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -14.176 -15.436 -0.291 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -15.136 -17.059 1.077 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -16.548 -16.144 0.586 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -17.044 -17.786 -1.183 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -15.579 -18.672 -0.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -17.506 -19.700 0.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -16.453 -19.130 1.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -17.873 -18.271 1.046 1.00 0.00 H new ATOM 906 N ALA A 61 -15.548 -15.085 -5.006 1.00 0.00 N ATOM 907 CA ALA A 61 -16.277 -15.038 -6.267 1.00 0.00 C ATOM 908 C ALA A 61 -17.783 -15.059 -6.032 1.00 0.00 C ATOM 909 O ALA A 61 -18.526 -14.280 -6.629 1.00 0.00 O ATOM 910 CB ALA A 61 -15.863 -16.198 -7.160 1.00 0.00 C ATOM 0 H ALA A 61 -14.834 -15.812 -4.959 1.00 0.00 H new ATOM 0 HA ALA A 61 -16.028 -14.102 -6.767 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -16.416 -16.150 -8.098 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -14.794 -16.136 -7.365 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -16.082 -17.140 -6.658 1.00 0.00 H new ATOM 916 N SER A 62 -18.228 -15.957 -5.158 1.00 0.00 N ATOM 917 CA SER A 62 -19.647 -16.083 -4.848 1.00 0.00 C ATOM 918 C SER A 62 -20.050 -15.110 -3.744 1.00 0.00 C ATOM 919 O SER A 62 -20.999 -14.340 -3.896 1.00 0.00 O ATOM 920 CB SER A 62 -19.973 -17.516 -4.423 1.00 0.00 C ATOM 921 OG SER A 62 -21.349 -17.802 -4.603 1.00 0.00 O ATOM 0 H SER A 62 -17.626 -16.607 -4.653 1.00 0.00 H new ATOM 0 HA SER A 62 -20.213 -15.841 -5.748 1.00 0.00 H new ATOM 0 HB2 SER A 62 -19.374 -18.216 -5.005 1.00 0.00 H new ATOM 0 HB3 SER A 62 -19.703 -17.658 -3.377 1.00 0.00 H new ATOM 0 HG SER A 62 -21.530 -18.724 -4.326 1.00 0.00 H new ATOM 927 N ARG A 63 -19.322 -15.151 -2.633 1.00 0.00 N ATOM 928 CA ARG A 63 -19.603 -14.274 -1.503 1.00 0.00 C ATOM 929 C ARG A 63 -18.763 -13.003 -1.578 1.00 0.00 C ATOM 930 O ARG A 63 -18.146 -12.594 -0.594 1.00 0.00 O ATOM 931 CB ARG A 63 -19.330 -15.001 -0.185 1.00 0.00 C ATOM 932 CG ARG A 63 -20.052 -14.395 1.007 1.00 0.00 C ATOM 933 CD ARG A 63 -21.545 -14.676 0.956 1.00 0.00 C ATOM 934 NE ARG A 63 -21.884 -15.950 1.585 1.00 0.00 N ATOM 935 CZ ARG A 63 -21.966 -16.123 2.899 1.00 0.00 C ATOM 936 NH1 ARG A 63 -21.736 -15.107 3.720 1.00 0.00 N ATOM 937 NH2 ARG A 63 -22.280 -17.313 3.395 1.00 0.00 N ATOM 0 H ARG A 63 -18.533 -15.782 -2.491 1.00 0.00 H new ATOM 0 HA ARG A 63 -20.656 -13.996 -1.546 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -19.628 -16.044 -0.287 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -18.257 -14.993 0.009 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -19.636 -14.799 1.930 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -19.884 -13.318 1.027 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -22.083 -13.870 1.456 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -21.877 -14.685 -0.082 1.00 0.00 H new ATOM 0 HE ARG A 63 -22.068 -16.751 0.981 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -21.496 -14.190 3.342 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -21.800 -15.242 4.729 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -22.459 -18.096 2.767 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -22.343 -17.444 4.405 1.00 0.00 H new ATOM 951 N LYS A 64 -18.742 -12.382 -2.752 1.00 0.00 N ATOM 952 CA LYS A 64 -17.979 -11.157 -2.958 1.00 0.00 C ATOM 953 C LYS A 64 -18.124 -10.219 -1.764 1.00 0.00 C ATOM 954 O LYS A 64 -17.155 -9.594 -1.332 1.00 0.00 O ATOM 955 CB LYS A 64 -18.442 -10.450 -4.234 1.00 0.00 C ATOM 956 CG LYS A 64 -18.423 -11.342 -5.464 1.00 0.00 C ATOM 957 CD LYS A 64 -18.849 -10.583 -6.709 1.00 0.00 C ATOM 958 CE LYS A 64 -18.634 -11.410 -7.967 1.00 0.00 C ATOM 959 NZ LYS A 64 -19.824 -12.243 -8.294 1.00 0.00 N ATOM 0 H LYS A 64 -19.246 -12.708 -3.577 1.00 0.00 H new ATOM 0 HA LYS A 64 -16.928 -11.427 -3.061 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -19.454 -10.073 -4.084 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -17.803 -9.585 -4.413 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -17.420 -11.744 -5.607 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -19.088 -12.191 -5.309 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -19.901 -10.310 -6.627 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -18.283 -9.654 -6.782 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -18.414 -10.747 -8.804 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -17.765 -12.055 -7.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -19.852 -12.421 -9.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -19.764 -13.149 -7.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -20.688 -11.742 -8.005 1.00 0.00 H new ATOM 973 N SER A 65 -19.339 -10.126 -1.234 1.00 0.00 N ATOM 974 CA SER A 65 -19.611 -9.262 -0.091 1.00 0.00 C ATOM 975 C SER A 65 -18.553 -9.447 0.993 1.00 0.00 C ATOM 976 O SER A 65 -18.062 -8.476 1.569 1.00 0.00 O ATOM 977 CB SER A 65 -20.999 -9.557 0.480 1.00 0.00 C ATOM 978 OG SER A 65 -21.357 -8.607 1.468 1.00 0.00 O ATOM 0 H SER A 65 -20.151 -10.638 -1.578 1.00 0.00 H new ATOM 0 HA SER A 65 -19.579 -8.228 -0.433 1.00 0.00 H new ATOM 0 HB2 SER A 65 -21.736 -9.546 -0.323 1.00 0.00 H new ATOM 0 HB3 SER A 65 -21.013 -10.558 0.912 1.00 0.00 H new ATOM 0 HG SER A 65 -22.249 -8.817 1.816 1.00 0.00 H new ATOM 984 N ASP A 66 -18.207 -10.700 1.265 1.00 0.00 N ATOM 985 CA ASP A 66 -17.207 -11.014 2.279 1.00 0.00 C ATOM 986 C ASP A 66 -15.801 -10.716 1.767 1.00 0.00 C ATOM 987 O ASP A 66 -15.186 -11.543 1.094 1.00 0.00 O ATOM 988 CB ASP A 66 -17.312 -12.483 2.692 1.00 0.00 C ATOM 989 CG ASP A 66 -16.511 -12.793 3.941 1.00 0.00 C ATOM 990 OD1 ASP A 66 -17.045 -12.595 5.053 1.00 0.00 O ATOM 991 OD2 ASP A 66 -15.350 -13.232 3.807 1.00 0.00 O ATOM 0 H ASP A 66 -18.604 -11.515 0.798 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.398 -10.386 3.149 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -18.359 -12.735 2.863 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -16.962 -13.113 1.874 1.00 0.00 H new ATOM 996 N VAL A 67 -15.299 -9.529 2.089 1.00 0.00 N ATOM 997 CA VAL A 67 -13.966 -9.121 1.661 1.00 0.00 C ATOM 998 C VAL A 67 -13.125 -8.660 2.847 1.00 0.00 C ATOM 999 O VAL A 67 -13.619 -7.977 3.745 1.00 0.00 O ATOM 1000 CB VAL A 67 -14.032 -7.987 0.621 1.00 0.00 C ATOM 1001 CG1 VAL A 67 -14.938 -6.866 1.110 1.00 0.00 C ATOM 1002 CG2 VAL A 67 -12.638 -7.461 0.316 1.00 0.00 C ATOM 0 H VAL A 67 -15.795 -8.832 2.645 1.00 0.00 H new ATOM 0 HA VAL A 67 -13.499 -9.994 1.205 1.00 0.00 H new ATOM 0 HB VAL A 67 -14.454 -8.388 -0.301 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -14.972 -6.074 0.362 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -15.943 -7.255 1.273 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -14.548 -6.465 2.046 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -12.704 -6.660 -0.421 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -12.186 -7.076 1.230 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -12.023 -8.269 -0.081 1.00 0.00 H new ATOM 1012 N THR A 68 -11.851 -9.037 2.844 1.00 0.00 N ATOM 1013 CA THR A 68 -10.940 -8.663 3.919 1.00 0.00 C ATOM 1014 C THR A 68 -9.857 -7.715 3.417 1.00 0.00 C ATOM 1015 O THR A 68 -9.416 -7.813 2.273 1.00 0.00 O ATOM 1016 CB THR A 68 -10.273 -9.902 4.546 1.00 0.00 C ATOM 1017 OG1 THR A 68 -11.274 -10.802 5.036 1.00 0.00 O ATOM 1018 CG2 THR A 68 -9.346 -9.499 5.683 1.00 0.00 C ATOM 0 H THR A 68 -11.426 -9.602 2.109 1.00 0.00 H new ATOM 0 HA THR A 68 -11.537 -8.158 4.678 1.00 0.00 H new ATOM 0 HB THR A 68 -9.683 -10.400 3.776 1.00 0.00 H new ATOM 0 HG1 THR A 68 -10.842 -11.588 5.431 1.00 0.00 H new ATOM 0 HG21 THR A 68 -8.886 -10.390 6.111 1.00 0.00 H new ATOM 0 HG22 THR A 68 -8.569 -8.837 5.301 1.00 0.00 H new ATOM 0 HG23 THR A 68 -9.918 -8.981 6.453 1.00 0.00 H new ATOM 1026 N GLU A 69 -9.431 -6.800 4.282 1.00 0.00 N ATOM 1027 CA GLU A 69 -8.398 -5.834 3.925 1.00 0.00 C ATOM 1028 C GLU A 69 -7.064 -6.203 4.568 1.00 0.00 C ATOM 1029 O GLU A 69 -6.994 -6.486 5.764 1.00 0.00 O ATOM 1030 CB GLU A 69 -8.814 -4.427 4.357 1.00 0.00 C ATOM 1031 CG GLU A 69 -7.782 -3.360 4.029 1.00 0.00 C ATOM 1032 CD GLU A 69 -8.033 -2.059 4.767 1.00 0.00 C ATOM 1033 OE1 GLU A 69 -9.169 -1.546 4.693 1.00 0.00 O ATOM 1034 OE2 GLU A 69 -7.094 -1.555 5.417 1.00 0.00 O ATOM 0 H GLU A 69 -9.785 -6.707 5.234 1.00 0.00 H new ATOM 0 HA GLU A 69 -8.277 -5.852 2.842 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.756 -4.171 3.872 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.998 -4.425 5.431 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -6.789 -3.731 4.282 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.788 -3.171 2.955 1.00 0.00 H new ATOM 1041 N THR A 70 -6.005 -6.198 3.763 1.00 0.00 N ATOM 1042 CA THR A 70 -4.673 -6.532 4.251 1.00 0.00 C ATOM 1043 C THR A 70 -3.706 -5.371 4.050 1.00 0.00 C ATOM 1044 O THR A 70 -3.769 -4.665 3.043 1.00 0.00 O ATOM 1045 CB THR A 70 -4.113 -7.781 3.543 1.00 0.00 C ATOM 1046 OG1 THR A 70 -4.952 -8.911 3.806 1.00 0.00 O ATOM 1047 CG2 THR A 70 -2.695 -8.076 4.009 1.00 0.00 C ATOM 0 H THR A 70 -6.045 -5.966 2.770 1.00 0.00 H new ATOM 0 HA THR A 70 -4.769 -6.740 5.317 1.00 0.00 H new ATOM 0 HB THR A 70 -4.093 -7.586 2.471 1.00 0.00 H new ATOM 0 HG1 THR A 70 -5.044 -9.447 2.991 1.00 0.00 H new ATOM 0 HG21 THR A 70 -2.320 -8.962 3.496 1.00 0.00 H new ATOM 0 HG22 THR A 70 -2.053 -7.225 3.781 1.00 0.00 H new ATOM 0 HG23 THR A 70 -2.695 -8.252 5.085 1.00 0.00 H new ATOM 1055 N LEU A 71 -2.812 -5.179 5.013 1.00 0.00 N ATOM 1056 CA LEU A 71 -1.830 -4.103 4.942 1.00 0.00 C ATOM 1057 C LEU A 71 -0.410 -4.655 5.028 1.00 0.00 C ATOM 1058 O LEU A 71 -0.116 -5.514 5.860 1.00 0.00 O ATOM 1059 CB LEU A 71 -2.066 -3.094 6.067 1.00 0.00 C ATOM 1060 CG LEU A 71 -1.574 -1.670 5.806 1.00 0.00 C ATOM 1061 CD1 LEU A 71 -0.069 -1.656 5.594 1.00 0.00 C ATOM 1062 CD2 LEU A 71 -2.290 -1.071 4.604 1.00 0.00 C ATOM 0 H LEU A 71 -2.747 -5.755 5.853 1.00 0.00 H new ATOM 0 HA LEU A 71 -1.948 -3.601 3.982 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -3.135 -3.055 6.275 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -1.580 -3.465 6.969 1.00 0.00 H new ATOM 0 HG LEU A 71 -1.802 -1.061 6.681 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.263 -0.634 5.410 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.427 -2.044 6.484 1.00 0.00 H new ATOM 0 HD13 LEU A 71 0.183 -2.280 4.737 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -1.928 -0.057 4.433 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -2.093 -1.681 3.722 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -3.363 -1.045 4.795 1.00 0.00 H new ATOM 1074 N VAL A 72 0.468 -4.154 4.165 1.00 0.00 N ATOM 1075 CA VAL A 72 1.858 -4.594 4.146 1.00 0.00 C ATOM 1076 C VAL A 72 2.811 -3.406 4.212 1.00 0.00 C ATOM 1077 O VAL A 72 2.381 -2.253 4.251 1.00 0.00 O ATOM 1078 CB VAL A 72 2.168 -5.417 2.882 1.00 0.00 C ATOM 1079 CG1 VAL A 72 1.309 -6.672 2.837 1.00 0.00 C ATOM 1080 CG2 VAL A 72 1.961 -4.574 1.633 1.00 0.00 C ATOM 0 H VAL A 72 0.241 -3.443 3.470 1.00 0.00 H new ATOM 0 HA VAL A 72 2.004 -5.222 5.025 1.00 0.00 H new ATOM 0 HB VAL A 72 3.214 -5.723 2.917 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.542 -7.241 1.937 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.513 -7.284 3.716 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.256 -6.392 2.826 1.00 0.00 H new ATOM 0 HG21 VAL A 72 2.185 -5.172 0.749 1.00 0.00 H new ATOM 0 HG22 VAL A 72 0.926 -4.236 1.590 1.00 0.00 H new ATOM 0 HG23 VAL A 72 2.624 -3.709 1.664 1.00 0.00 H new ATOM 1090 N SER A 73 4.108 -3.695 4.225 1.00 0.00 N ATOM 1091 CA SER A 73 5.124 -2.651 4.290 1.00 0.00 C ATOM 1092 C SER A 73 5.368 -2.044 2.912 1.00 0.00 C ATOM 1093 O SER A 73 4.928 -2.582 1.897 1.00 0.00 O ATOM 1094 CB SER A 73 6.431 -3.216 4.850 1.00 0.00 C ATOM 1095 OG SER A 73 6.456 -3.137 6.265 1.00 0.00 O ATOM 0 H SER A 73 4.480 -4.644 4.191 1.00 0.00 H new ATOM 0 HA SER A 73 4.762 -1.866 4.954 1.00 0.00 H new ATOM 0 HB2 SER A 73 6.545 -4.254 4.539 1.00 0.00 H new ATOM 0 HB3 SER A 73 7.276 -2.665 4.437 1.00 0.00 H new ATOM 0 HG SER A 73 7.301 -3.506 6.598 1.00 0.00 H new ATOM 1101 N GLY A 74 6.074 -0.917 2.885 1.00 0.00 N ATOM 1102 CA GLY A 74 6.365 -0.254 1.627 1.00 0.00 C ATOM 1103 C GLY A 74 7.345 -1.034 0.774 1.00 0.00 C ATOM 1104 O GLY A 74 7.045 -1.386 -0.367 1.00 0.00 O ATOM 0 H GLY A 74 6.449 -0.452 3.712 1.00 0.00 H new ATOM 0 HA2 GLY A 74 5.438 -0.112 1.072 1.00 0.00 H new ATOM 0 HA3 GLY A 74 6.772 0.737 1.828 1.00 0.00 H new ATOM 1108 N THR A 75 8.524 -1.305 1.327 1.00 0.00 N ATOM 1109 CA THR A 75 9.553 -2.045 0.608 1.00 0.00 C ATOM 1110 C THR A 75 9.065 -3.440 0.231 1.00 0.00 C ATOM 1111 O THR A 75 9.555 -4.040 -0.725 1.00 0.00 O ATOM 1112 CB THR A 75 10.841 -2.173 1.444 1.00 0.00 C ATOM 1113 OG1 THR A 75 11.820 -2.929 0.723 1.00 0.00 O ATOM 1114 CG2 THR A 75 10.555 -2.844 2.779 1.00 0.00 C ATOM 0 H THR A 75 8.789 -1.023 2.271 1.00 0.00 H new ATOM 0 HA THR A 75 9.772 -1.482 -0.299 1.00 0.00 H new ATOM 0 HB THR A 75 11.226 -1.171 1.635 1.00 0.00 H new ATOM 0 HG1 THR A 75 12.636 -3.004 1.260 1.00 0.00 H new ATOM 0 HG21 THR A 75 11.479 -2.923 3.352 1.00 0.00 H new ATOM 0 HG22 THR A 75 9.832 -2.250 3.337 1.00 0.00 H new ATOM 0 HG23 THR A 75 10.149 -3.841 2.606 1.00 0.00 H new ATOM 1122 N GLN A 76 8.098 -3.948 0.988 1.00 0.00 N ATOM 1123 CA GLN A 76 7.545 -5.272 0.732 1.00 0.00 C ATOM 1124 C GLN A 76 6.713 -5.277 -0.546 1.00 0.00 C ATOM 1125 O GLN A 76 5.669 -4.628 -0.623 1.00 0.00 O ATOM 1126 CB GLN A 76 6.687 -5.727 1.914 1.00 0.00 C ATOM 1127 CG GLN A 76 5.984 -7.054 1.681 1.00 0.00 C ATOM 1128 CD GLN A 76 5.730 -7.814 2.968 1.00 0.00 C ATOM 1129 OE1 GLN A 76 4.464 -8.110 3.241 1.00 0.00 O flip ATOM 1130 NE2 GLN A 76 6.660 -8.132 3.709 1.00 0.00 N flip ATOM 0 H GLN A 76 7.682 -3.463 1.783 1.00 0.00 H new ATOM 0 HA GLN A 76 8.376 -5.966 0.606 1.00 0.00 H new ATOM 0 HB2 GLN A 76 7.318 -5.810 2.799 1.00 0.00 H new ATOM 0 HB3 GLN A 76 5.940 -4.962 2.126 1.00 0.00 H new ATOM 0 HG2 GLN A 76 5.035 -6.874 1.176 1.00 0.00 H new ATOM 0 HG3 GLN A 76 6.588 -7.669 1.014 1.00 0.00 H new ATOM 0 HE21 GLN A 76 7.618 -7.884 3.460 1.00 0.00 H new ATOM 0 HE22 GLN A 76 6.473 -8.643 4.572 1.00 0.00 H new ATOM 1139 N LEU A 77 7.182 -6.013 -1.548 1.00 0.00 N ATOM 1140 CA LEU A 77 6.482 -6.102 -2.825 1.00 0.00 C ATOM 1141 C LEU A 77 5.777 -7.448 -2.966 1.00 0.00 C ATOM 1142 O LEU A 77 5.569 -7.937 -4.076 1.00 0.00 O ATOM 1143 CB LEU A 77 7.462 -5.904 -3.982 1.00 0.00 C ATOM 1144 CG LEU A 77 8.187 -4.558 -4.024 1.00 0.00 C ATOM 1145 CD1 LEU A 77 9.278 -4.572 -5.083 1.00 0.00 C ATOM 1146 CD2 LEU A 77 7.200 -3.429 -4.287 1.00 0.00 C ATOM 0 H LEU A 77 8.044 -6.557 -1.501 1.00 0.00 H new ATOM 0 HA LEU A 77 5.731 -5.313 -2.855 1.00 0.00 H new ATOM 0 HB2 LEU A 77 8.210 -6.696 -3.938 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.918 -6.031 -4.918 1.00 0.00 H new ATOM 0 HG LEU A 77 8.654 -4.388 -3.054 1.00 0.00 H new ATOM 0 HD11 LEU A 77 9.783 -3.606 -5.098 1.00 0.00 H new ATOM 0 HD12 LEU A 77 10.000 -5.355 -4.851 1.00 0.00 H new ATOM 0 HD13 LEU A 77 8.834 -4.765 -6.060 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.733 -2.479 -4.314 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.705 -3.594 -5.244 1.00 0.00 H new ATOM 0 HD23 LEU A 77 6.455 -3.405 -3.492 1.00 0.00 H new ATOM 1158 N SER A 78 5.410 -8.039 -1.834 1.00 0.00 N ATOM 1159 CA SER A 78 4.729 -9.329 -1.831 1.00 0.00 C ATOM 1160 C SER A 78 4.084 -9.600 -0.476 1.00 0.00 C ATOM 1161 O SER A 78 4.543 -9.103 0.552 1.00 0.00 O ATOM 1162 CB SER A 78 5.713 -10.450 -2.174 1.00 0.00 C ATOM 1163 OG SER A 78 6.062 -10.420 -3.547 1.00 0.00 O ATOM 0 H SER A 78 5.573 -7.646 -0.907 1.00 0.00 H new ATOM 0 HA SER A 78 3.945 -9.300 -2.587 1.00 0.00 H new ATOM 0 HB2 SER A 78 6.611 -10.349 -1.565 1.00 0.00 H new ATOM 0 HB3 SER A 78 5.269 -11.415 -1.929 1.00 0.00 H new ATOM 0 HG SER A 78 5.853 -11.285 -3.957 1.00 0.00 H new ATOM 1169 N GLN A 79 3.016 -10.392 -0.483 1.00 0.00 N ATOM 1170 CA GLN A 79 2.307 -10.729 0.745 1.00 0.00 C ATOM 1171 C GLN A 79 1.798 -12.166 0.704 1.00 0.00 C ATOM 1172 O GLN A 79 1.684 -12.764 -0.367 1.00 0.00 O ATOM 1173 CB GLN A 79 1.137 -9.767 0.964 1.00 0.00 C ATOM 1174 CG GLN A 79 0.388 -10.006 2.265 1.00 0.00 C ATOM 1175 CD GLN A 79 1.279 -9.871 3.484 1.00 0.00 C ATOM 1176 OE1 GLN A 79 2.446 -9.494 3.376 1.00 0.00 O ATOM 1177 NE2 GLN A 79 0.731 -10.177 4.655 1.00 0.00 N ATOM 0 H GLN A 79 2.623 -10.812 -1.326 1.00 0.00 H new ATOM 0 HA GLN A 79 3.007 -10.635 1.576 1.00 0.00 H new ATOM 0 HB2 GLN A 79 1.512 -8.744 0.953 1.00 0.00 H new ATOM 0 HB3 GLN A 79 0.440 -9.860 0.131 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -0.436 -9.296 2.341 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -0.051 -11.004 2.249 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -0.240 -10.485 4.699 1.00 0.00 H new ATOM 0 HE22 GLN A 79 1.282 -10.103 5.510 1.00 0.00 H new ATOM 1186 N LEU A 80 1.495 -12.715 1.875 1.00 0.00 N ATOM 1187 CA LEU A 80 0.999 -14.083 1.973 1.00 0.00 C ATOM 1188 C LEU A 80 -0.379 -14.117 2.627 1.00 0.00 C ATOM 1189 O LEU A 80 -0.510 -13.898 3.832 1.00 0.00 O ATOM 1190 CB LEU A 80 1.977 -14.945 2.772 1.00 0.00 C ATOM 1191 CG LEU A 80 1.675 -16.444 2.809 1.00 0.00 C ATOM 1192 CD1 LEU A 80 1.947 -17.077 1.453 1.00 0.00 C ATOM 1193 CD2 LEU A 80 2.497 -17.127 3.892 1.00 0.00 C ATOM 0 H LEU A 80 1.584 -12.234 2.770 1.00 0.00 H new ATOM 0 HA LEU A 80 0.912 -14.485 0.964 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.975 -14.806 2.357 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.003 -14.575 3.797 1.00 0.00 H new ATOM 0 HG LEU A 80 0.619 -16.576 3.044 1.00 0.00 H new ATOM 0 HD11 LEU A 80 1.727 -18.144 1.499 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.315 -16.608 0.699 1.00 0.00 H new ATOM 0 HD13 LEU A 80 2.995 -16.934 1.188 1.00 0.00 H new ATOM 0 HD21 LEU A 80 2.269 -18.193 3.904 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.558 -16.985 3.687 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.253 -16.693 4.862 1.00 0.00 H new ATOM 1205 N ILE A 81 -1.402 -14.395 1.826 1.00 0.00 N ATOM 1206 CA ILE A 81 -2.769 -14.461 2.329 1.00 0.00 C ATOM 1207 C ILE A 81 -3.164 -15.896 2.660 1.00 0.00 C ATOM 1208 O ILE A 81 -3.514 -16.673 1.773 1.00 0.00 O ATOM 1209 CB ILE A 81 -3.771 -13.886 1.310 1.00 0.00 C ATOM 1210 CG1 ILE A 81 -3.421 -12.433 0.982 1.00 0.00 C ATOM 1211 CG2 ILE A 81 -5.190 -13.986 1.850 1.00 0.00 C ATOM 1212 CD1 ILE A 81 -3.508 -11.506 2.174 1.00 0.00 C ATOM 0 H ILE A 81 -1.311 -14.578 0.827 1.00 0.00 H new ATOM 0 HA ILE A 81 -2.801 -13.860 3.237 1.00 0.00 H new ATOM 0 HB ILE A 81 -3.710 -14.470 0.392 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.411 -12.394 0.575 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -4.093 -12.073 0.203 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.887 -13.576 1.119 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -5.435 -15.031 2.038 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.266 -13.422 2.780 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -3.247 -10.493 1.867 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.524 -11.515 2.568 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.816 -11.841 2.947 1.00 0.00 H new ATOM 1224 N GLU A 82 -3.106 -16.239 3.943 1.00 0.00 N ATOM 1225 CA GLU A 82 -3.459 -17.581 4.391 1.00 0.00 C ATOM 1226 C GLU A 82 -4.892 -17.620 4.914 1.00 0.00 C ATOM 1227 O GLU A 82 -5.498 -16.582 5.176 1.00 0.00 O ATOM 1228 CB GLU A 82 -2.494 -18.049 5.482 1.00 0.00 C ATOM 1229 CG GLU A 82 -1.087 -18.318 4.974 1.00 0.00 C ATOM 1230 CD GLU A 82 -0.050 -18.276 6.080 1.00 0.00 C ATOM 1231 OE1 GLU A 82 0.075 -19.279 6.813 1.00 0.00 O ATOM 1232 OE2 GLU A 82 0.636 -17.241 6.212 1.00 0.00 O ATOM 0 H GLU A 82 -2.818 -15.607 4.690 1.00 0.00 H new ATOM 0 HA GLU A 82 -3.383 -18.253 3.536 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -2.450 -17.293 6.266 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -2.887 -18.958 5.938 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -1.059 -19.295 4.492 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -0.832 -17.580 4.213 1.00 0.00 H new ATOM 1239 N GLY A 83 -5.429 -18.827 5.063 1.00 0.00 N ATOM 1240 CA GLY A 83 -6.786 -18.981 5.553 1.00 0.00 C ATOM 1241 C GLY A 83 -7.810 -18.976 4.436 1.00 0.00 C ATOM 1242 O GLY A 83 -8.807 -18.255 4.499 1.00 0.00 O ATOM 0 H GLY A 83 -4.948 -19.702 4.853 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -6.864 -19.915 6.109 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -7.011 -18.175 6.251 1.00 0.00 H new ATOM 1246 N LEU A 84 -7.565 -19.782 3.408 1.00 0.00 N ATOM 1247 CA LEU A 84 -8.473 -19.868 2.270 1.00 0.00 C ATOM 1248 C LEU A 84 -8.999 -21.289 2.098 1.00 0.00 C ATOM 1249 O LEU A 84 -8.674 -22.181 2.883 1.00 0.00 O ATOM 1250 CB LEU A 84 -7.765 -19.416 0.992 1.00 0.00 C ATOM 1251 CG LEU A 84 -7.028 -18.078 1.070 1.00 0.00 C ATOM 1252 CD1 LEU A 84 -5.923 -18.016 0.027 1.00 0.00 C ATOM 1253 CD2 LEU A 84 -8.001 -16.922 0.888 1.00 0.00 C ATOM 0 H LEU A 84 -6.745 -20.385 3.340 1.00 0.00 H new ATOM 0 HA LEU A 84 -9.319 -19.208 2.462 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -7.049 -20.186 0.705 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -8.504 -19.355 0.193 1.00 0.00 H new ATOM 0 HG LEU A 84 -6.573 -17.992 2.057 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.410 -17.057 0.097 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -5.211 -18.822 0.203 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.355 -18.124 -0.968 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -7.459 -15.978 0.946 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -8.485 -17.003 -0.085 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -8.757 -16.956 1.673 1.00 0.00 H new ATOM 1265 N ASP A 85 -9.811 -21.494 1.067 1.00 0.00 N ATOM 1266 CA ASP A 85 -10.379 -22.808 0.790 1.00 0.00 C ATOM 1267 C ASP A 85 -9.874 -23.348 -0.545 1.00 0.00 C ATOM 1268 O ASP A 85 -9.627 -22.586 -1.480 1.00 0.00 O ATOM 1269 CB ASP A 85 -11.907 -22.734 0.779 1.00 0.00 C ATOM 1270 CG ASP A 85 -12.467 -22.137 2.055 1.00 0.00 C ATOM 1271 OD1 ASP A 85 -11.826 -22.295 3.115 1.00 0.00 O ATOM 1272 OD2 ASP A 85 -13.545 -21.511 1.993 1.00 0.00 O ATOM 0 H ASP A 85 -10.091 -20.767 0.409 1.00 0.00 H new ATOM 0 HA ASP A 85 -10.061 -23.488 1.580 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -12.233 -22.136 -0.072 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -12.315 -23.735 0.640 1.00 0.00 H new ATOM 1277 N ARG A 86 -9.722 -24.666 -0.625 1.00 0.00 N ATOM 1278 CA ARG A 86 -9.244 -25.307 -1.844 1.00 0.00 C ATOM 1279 C ARG A 86 -10.328 -25.310 -2.917 1.00 0.00 C ATOM 1280 O ARG A 86 -11.508 -25.124 -2.623 1.00 0.00 O ATOM 1281 CB ARG A 86 -8.799 -26.741 -1.550 1.00 0.00 C ATOM 1282 CG ARG A 86 -9.858 -27.575 -0.848 1.00 0.00 C ATOM 1283 CD ARG A 86 -9.716 -29.052 -1.183 1.00 0.00 C ATOM 1284 NE ARG A 86 -10.534 -29.892 -0.313 1.00 0.00 N ATOM 1285 CZ ARG A 86 -10.213 -30.180 0.943 1.00 0.00 C ATOM 1286 NH1 ARG A 86 -9.098 -29.698 1.474 1.00 0.00 N ATOM 1287 NH2 ARG A 86 -11.010 -30.952 1.672 1.00 0.00 N ATOM 0 H ARG A 86 -9.923 -25.310 0.140 1.00 0.00 H new ATOM 0 HA ARG A 86 -8.392 -24.738 -2.214 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -8.527 -27.228 -2.487 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -7.901 -26.715 -0.933 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -9.777 -27.436 0.230 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -10.849 -27.228 -1.140 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -10.004 -29.217 -2.221 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -8.670 -29.345 -1.091 1.00 0.00 H new ATOM 0 HE ARG A 86 -11.399 -30.279 -0.690 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -8.483 -29.104 0.918 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -8.855 -29.921 2.439 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -11.869 -31.324 1.267 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -10.763 -31.173 2.637 1.00 0.00 H new ATOM 1301 N GLY A 87 -9.918 -25.520 -4.165 1.00 0.00 N ATOM 1302 CA GLY A 87 -10.865 -25.542 -5.263 1.00 0.00 C ATOM 1303 C GLY A 87 -11.893 -24.432 -5.165 1.00 0.00 C ATOM 1304 O GLY A 87 -13.095 -24.675 -5.281 1.00 0.00 O ATOM 0 H GLY A 87 -8.946 -25.675 -4.434 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -10.326 -25.451 -6.206 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -11.375 -26.505 -5.279 1.00 0.00 H new ATOM 1308 N THR A 88 -11.421 -23.208 -4.949 1.00 0.00 N ATOM 1309 CA THR A 88 -12.306 -22.057 -4.832 1.00 0.00 C ATOM 1310 C THR A 88 -11.653 -20.801 -5.397 1.00 0.00 C ATOM 1311 O THR A 88 -10.542 -20.441 -5.010 1.00 0.00 O ATOM 1312 CB THR A 88 -12.704 -21.800 -3.366 1.00 0.00 C ATOM 1313 OG1 THR A 88 -13.415 -22.929 -2.847 1.00 0.00 O ATOM 1314 CG2 THR A 88 -13.567 -20.553 -3.250 1.00 0.00 C ATOM 0 H THR A 88 -10.430 -22.989 -4.852 1.00 0.00 H new ATOM 0 HA THR A 88 -13.202 -22.288 -5.409 1.00 0.00 H new ATOM 0 HB THR A 88 -11.794 -21.647 -2.787 1.00 0.00 H new ATOM 0 HG1 THR A 88 -12.799 -23.685 -2.745 1.00 0.00 H new ATOM 0 HG21 THR A 88 -13.835 -20.392 -2.206 1.00 0.00 H new ATOM 0 HG22 THR A 88 -13.012 -19.691 -3.619 1.00 0.00 H new ATOM 0 HG23 THR A 88 -14.473 -20.681 -3.842 1.00 0.00 H new ATOM 1322 N GLU A 89 -12.351 -20.138 -6.314 1.00 0.00 N ATOM 1323 CA GLU A 89 -11.836 -18.921 -6.932 1.00 0.00 C ATOM 1324 C GLU A 89 -11.808 -17.771 -5.929 1.00 0.00 C ATOM 1325 O GLU A 89 -12.700 -17.643 -5.090 1.00 0.00 O ATOM 1326 CB GLU A 89 -12.691 -18.536 -8.142 1.00 0.00 C ATOM 1327 CG GLU A 89 -12.244 -17.251 -8.819 1.00 0.00 C ATOM 1328 CD GLU A 89 -12.589 -17.219 -10.295 1.00 0.00 C ATOM 1329 OE1 GLU A 89 -12.044 -18.051 -11.049 1.00 0.00 O ATOM 1330 OE2 GLU A 89 -13.404 -16.362 -10.696 1.00 0.00 O ATOM 0 H GLU A 89 -13.273 -20.422 -6.645 1.00 0.00 H new ATOM 0 HA GLU A 89 -10.816 -19.116 -7.264 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -12.664 -19.348 -8.869 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -13.728 -18.427 -7.824 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -12.712 -16.401 -8.322 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -11.167 -17.137 -8.699 1.00 0.00 H new ATOM 1337 N TYR A 90 -10.778 -16.938 -6.022 1.00 0.00 N ATOM 1338 CA TYR A 90 -10.631 -15.801 -5.121 1.00 0.00 C ATOM 1339 C TYR A 90 -10.054 -14.595 -5.856 1.00 0.00 C ATOM 1340 O TYR A 90 -9.131 -14.726 -6.659 1.00 0.00 O ATOM 1341 CB TYR A 90 -9.730 -16.171 -3.941 1.00 0.00 C ATOM 1342 CG TYR A 90 -10.435 -16.973 -2.870 1.00 0.00 C ATOM 1343 CD1 TYR A 90 -11.228 -16.348 -1.916 1.00 0.00 C ATOM 1344 CD2 TYR A 90 -10.308 -18.356 -2.814 1.00 0.00 C ATOM 1345 CE1 TYR A 90 -11.873 -17.077 -0.935 1.00 0.00 C ATOM 1346 CE2 TYR A 90 -10.951 -19.092 -1.838 1.00 0.00 C ATOM 1347 CZ TYR A 90 -11.731 -18.449 -0.900 1.00 0.00 C ATOM 1348 OH TYR A 90 -12.373 -19.178 0.074 1.00 0.00 O ATOM 0 H TYR A 90 -10.032 -17.028 -6.712 1.00 0.00 H new ATOM 0 HA TYR A 90 -11.620 -15.537 -4.746 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -8.878 -16.743 -4.310 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -9.333 -15.258 -3.497 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -11.342 -15.274 -1.941 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -9.697 -18.863 -3.546 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -12.485 -16.576 -0.200 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -10.843 -20.166 -1.810 1.00 0.00 H new ATOM 0 HH TYR A 90 -13.201 -18.722 0.331 1.00 0.00 H new ATOM 1358 N ASN A 91 -10.606 -13.419 -5.575 1.00 0.00 N ATOM 1359 CA ASN A 91 -10.148 -12.188 -6.208 1.00 0.00 C ATOM 1360 C ASN A 91 -9.151 -11.455 -5.315 1.00 0.00 C ATOM 1361 O ASN A 91 -9.181 -11.591 -4.092 1.00 0.00 O ATOM 1362 CB ASN A 91 -11.337 -11.277 -6.520 1.00 0.00 C ATOM 1363 CG ASN A 91 -12.565 -12.056 -6.949 1.00 0.00 C ATOM 1364 OD1 ASN A 91 -13.570 -12.094 -6.239 1.00 0.00 O ATOM 1365 ND2 ASN A 91 -12.490 -12.683 -8.117 1.00 0.00 N ATOM 0 H ASN A 91 -11.371 -13.293 -4.913 1.00 0.00 H new ATOM 0 HA ASN A 91 -9.648 -12.452 -7.140 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -11.577 -10.682 -5.638 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -11.059 -10.579 -7.309 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -13.285 -13.223 -8.458 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -11.637 -12.625 -8.673 1.00 0.00 H new ATOM 1372 N PHE A 92 -8.270 -10.678 -5.936 1.00 0.00 N ATOM 1373 CA PHE A 92 -7.264 -9.923 -5.198 1.00 0.00 C ATOM 1374 C PHE A 92 -6.925 -8.621 -5.917 1.00 0.00 C ATOM 1375 O PHE A 92 -7.022 -8.532 -7.141 1.00 0.00 O ATOM 1376 CB PHE A 92 -5.998 -10.763 -5.016 1.00 0.00 C ATOM 1377 CG PHE A 92 -6.211 -11.995 -4.184 1.00 0.00 C ATOM 1378 CD1 PHE A 92 -6.793 -13.126 -4.733 1.00 0.00 C ATOM 1379 CD2 PHE A 92 -5.828 -12.023 -2.852 1.00 0.00 C ATOM 1380 CE1 PHE A 92 -6.990 -14.262 -3.971 1.00 0.00 C ATOM 1381 CE2 PHE A 92 -6.022 -13.156 -2.085 1.00 0.00 C ATOM 1382 CZ PHE A 92 -6.605 -14.276 -2.645 1.00 0.00 C ATOM 0 H PHE A 92 -8.232 -10.555 -6.948 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.675 -9.680 -4.218 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.622 -11.057 -5.996 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -5.228 -10.148 -4.550 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -7.097 -13.120 -5.769 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -5.373 -11.150 -2.409 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -7.444 -15.137 -4.412 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -5.718 -13.166 -1.049 1.00 0.00 H new ATOM 0 HZ PHE A 92 -6.760 -15.162 -2.046 1.00 0.00 H new ATOM 1392 N ARG A 93 -6.527 -7.613 -5.148 1.00 0.00 N ATOM 1393 CA ARG A 93 -6.175 -6.315 -5.711 1.00 0.00 C ATOM 1394 C ARG A 93 -5.148 -5.603 -4.835 1.00 0.00 C ATOM 1395 O ARG A 93 -5.351 -5.435 -3.633 1.00 0.00 O ATOM 1396 CB ARG A 93 -7.424 -5.444 -5.860 1.00 0.00 C ATOM 1397 CG ARG A 93 -7.970 -4.931 -4.537 1.00 0.00 C ATOM 1398 CD ARG A 93 -9.345 -4.303 -4.708 1.00 0.00 C ATOM 1399 NE ARG A 93 -9.307 -3.131 -5.579 1.00 0.00 N ATOM 1400 CZ ARG A 93 -10.392 -2.480 -5.983 1.00 0.00 C ATOM 1401 NH1 ARG A 93 -11.594 -2.884 -5.596 1.00 0.00 N ATOM 1402 NH2 ARG A 93 -10.276 -1.421 -6.774 1.00 0.00 N ATOM 0 H ARG A 93 -6.440 -7.670 -4.133 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.736 -6.481 -6.695 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -7.190 -4.594 -6.501 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -8.200 -6.019 -6.365 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -8.030 -5.753 -3.824 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -7.282 -4.196 -4.119 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -10.031 -5.041 -5.123 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -9.737 -4.017 -3.732 1.00 0.00 H new ATOM 0 HE ARG A 93 -8.397 -2.794 -5.894 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -11.687 -3.697 -4.987 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -12.426 -2.382 -5.908 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -9.353 -1.106 -7.072 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -11.110 -0.922 -7.084 1.00 0.00 H new ATOM 1416 N VAL A 94 -4.043 -5.187 -5.447 1.00 0.00 N ATOM 1417 CA VAL A 94 -2.984 -4.493 -4.724 1.00 0.00 C ATOM 1418 C VAL A 94 -3.026 -2.994 -4.994 1.00 0.00 C ATOM 1419 O VAL A 94 -3.084 -2.561 -6.145 1.00 0.00 O ATOM 1420 CB VAL A 94 -1.594 -5.035 -5.109 1.00 0.00 C ATOM 1421 CG1 VAL A 94 -0.501 -4.257 -4.392 1.00 0.00 C ATOM 1422 CG2 VAL A 94 -1.496 -6.520 -4.795 1.00 0.00 C ATOM 0 H VAL A 94 -3.858 -5.319 -6.441 1.00 0.00 H new ATOM 0 HA VAL A 94 -3.154 -4.672 -3.662 1.00 0.00 H new ATOM 0 HB VAL A 94 -1.456 -4.904 -6.182 1.00 0.00 H new ATOM 0 HG11 VAL A 94 0.474 -4.654 -4.676 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -0.560 -3.205 -4.671 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -0.632 -4.354 -3.314 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -0.508 -6.886 -5.073 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -1.654 -6.678 -3.728 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -2.256 -7.062 -5.358 1.00 0.00 H new ATOM 1432 N ALA A 95 -2.994 -2.204 -3.925 1.00 0.00 N ATOM 1433 CA ALA A 95 -3.026 -0.752 -4.047 1.00 0.00 C ATOM 1434 C ALA A 95 -1.906 -0.109 -3.235 1.00 0.00 C ATOM 1435 O ALA A 95 -1.506 -0.627 -2.193 1.00 0.00 O ATOM 1436 CB ALA A 95 -4.378 -0.215 -3.603 1.00 0.00 C ATOM 0 H ALA A 95 -2.946 -2.546 -2.965 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.873 -0.496 -5.095 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.388 0.871 -3.699 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -5.162 -0.642 -4.228 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.554 -0.488 -2.563 1.00 0.00 H new ATOM 1442 N ALA A 96 -1.405 1.022 -3.721 1.00 0.00 N ATOM 1443 CA ALA A 96 -0.332 1.736 -3.040 1.00 0.00 C ATOM 1444 C ALA A 96 -0.891 2.757 -2.055 1.00 0.00 C ATOM 1445 O ALA A 96 -1.990 3.281 -2.245 1.00 0.00 O ATOM 1446 CB ALA A 96 0.574 2.419 -4.053 1.00 0.00 C ATOM 0 H ALA A 96 -1.725 1.463 -4.583 1.00 0.00 H new ATOM 0 HA ALA A 96 0.254 1.009 -2.477 1.00 0.00 H new ATOM 0 HB1 ALA A 96 1.371 2.948 -3.530 1.00 0.00 H new ATOM 0 HB2 ALA A 96 1.009 1.670 -4.715 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -0.008 3.129 -4.641 1.00 0.00 H new ATOM 1452 N LEU A 97 -0.130 3.036 -1.003 1.00 0.00 N ATOM 1453 CA LEU A 97 -0.550 3.995 0.013 1.00 0.00 C ATOM 1454 C LEU A 97 0.540 5.030 0.269 1.00 0.00 C ATOM 1455 O LEU A 97 1.727 4.703 0.304 1.00 0.00 O ATOM 1456 CB LEU A 97 -0.896 3.270 1.315 1.00 0.00 C ATOM 1457 CG LEU A 97 -1.948 2.165 1.209 1.00 0.00 C ATOM 1458 CD1 LEU A 97 -1.693 1.084 2.247 1.00 0.00 C ATOM 1459 CD2 LEU A 97 -3.347 2.743 1.370 1.00 0.00 C ATOM 0 H LEU A 97 0.781 2.612 -0.831 1.00 0.00 H new ATOM 0 HA LEU A 97 -1.436 4.511 -0.355 1.00 0.00 H new ATOM 0 HB2 LEU A 97 0.018 2.836 1.720 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.245 4.008 2.037 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.875 1.714 0.219 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -2.451 0.306 2.156 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.707 0.649 2.085 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -1.738 1.520 3.245 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -4.083 1.942 1.292 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -3.433 3.221 2.346 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -3.528 3.480 0.588 1.00 0.00 H new ATOM 1471 N THR A 98 0.130 6.282 0.450 1.00 0.00 N ATOM 1472 CA THR A 98 1.071 7.365 0.704 1.00 0.00 C ATOM 1473 C THR A 98 0.512 8.352 1.723 1.00 0.00 C ATOM 1474 O THR A 98 -0.605 8.186 2.213 1.00 0.00 O ATOM 1475 CB THR A 98 1.418 8.124 -0.591 1.00 0.00 C ATOM 1476 OG1 THR A 98 0.228 8.666 -1.175 1.00 0.00 O ATOM 1477 CG2 THR A 98 2.105 7.204 -1.590 1.00 0.00 C ATOM 0 H THR A 98 -0.848 6.570 0.425 1.00 0.00 H new ATOM 0 HA THR A 98 1.977 6.909 1.103 1.00 0.00 H new ATOM 0 HB THR A 98 2.101 8.935 -0.339 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.373 9.610 -1.396 1.00 0.00 H new ATOM 0 HG21 THR A 98 2.340 7.762 -2.496 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.025 6.816 -1.154 1.00 0.00 H new ATOM 0 HG23 THR A 98 1.442 6.375 -1.836 1.00 0.00 H new ATOM 1485 N ILE A 99 1.295 9.378 2.037 1.00 0.00 N ATOM 1486 CA ILE A 99 0.877 10.393 2.996 1.00 0.00 C ATOM 1487 C ILE A 99 -0.392 11.100 2.531 1.00 0.00 C ATOM 1488 O ILE A 99 -1.210 11.528 3.344 1.00 0.00 O ATOM 1489 CB ILE A 99 1.981 11.441 3.225 1.00 0.00 C ATOM 1490 CG1 ILE A 99 1.556 12.433 4.310 1.00 0.00 C ATOM 1491 CG2 ILE A 99 2.296 12.170 1.927 1.00 0.00 C ATOM 1492 CD1 ILE A 99 2.719 13.131 4.979 1.00 0.00 C ATOM 0 H ILE A 99 2.223 9.529 1.641 1.00 0.00 H new ATOM 0 HA ILE A 99 0.679 9.876 3.935 1.00 0.00 H new ATOM 0 HB ILE A 99 2.883 10.930 3.560 1.00 0.00 H new ATOM 0 HG12 ILE A 99 0.898 13.182 3.869 1.00 0.00 H new ATOM 0 HG13 ILE A 99 0.976 11.905 5.067 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.078 12.908 2.105 1.00 0.00 H new ATOM 0 HG22 ILE A 99 2.637 11.453 1.180 1.00 0.00 H new ATOM 0 HG23 ILE A 99 1.399 12.672 1.565 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.344 13.819 5.737 1.00 0.00 H new ATOM 0 HD12 ILE A 99 3.366 12.391 5.450 1.00 0.00 H new ATOM 0 HD13 ILE A 99 3.287 13.687 4.233 1.00 0.00 H new ATOM 1504 N ASN A 100 -0.549 11.216 1.216 1.00 0.00 N ATOM 1505 CA ASN A 100 -1.719 11.871 0.641 1.00 0.00 C ATOM 1506 C ASN A 100 -2.982 11.058 0.908 1.00 0.00 C ATOM 1507 O ASN A 100 -4.095 11.576 0.825 1.00 0.00 O ATOM 1508 CB ASN A 100 -1.532 12.064 -0.865 1.00 0.00 C ATOM 1509 CG ASN A 100 -0.134 12.532 -1.219 1.00 0.00 C ATOM 1510 OD1 ASN A 100 0.575 11.880 -1.985 1.00 0.00 O ATOM 1511 ND2 ASN A 100 0.269 13.668 -0.660 1.00 0.00 N ATOM 0 H ASN A 100 0.119 10.865 0.529 1.00 0.00 H new ATOM 0 HA ASN A 100 -1.829 12.847 1.115 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -1.738 11.124 -1.377 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -2.258 12.791 -1.228 1.00 0.00 H new ATOM 0 HD21 ASN A 100 1.200 14.033 -0.860 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -0.353 14.175 -0.031 1.00 0.00 H new ATOM 1518 N GLY A 101 -2.801 9.781 1.230 1.00 0.00 N ATOM 1519 CA GLY A 101 -3.934 8.917 1.505 1.00 0.00 C ATOM 1520 C GLY A 101 -3.787 7.548 0.871 1.00 0.00 C ATOM 1521 O GLY A 101 -2.819 6.833 1.134 1.00 0.00 O ATOM 0 H GLY A 101 -1.890 9.329 1.305 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -4.048 8.804 2.583 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -4.845 9.389 1.136 1.00 0.00 H new ATOM 1525 N THR A 102 -4.751 7.179 0.032 1.00 0.00 N ATOM 1526 CA THR A 102 -4.726 5.886 -0.639 1.00 0.00 C ATOM 1527 C THR A 102 -4.395 6.040 -2.119 1.00 0.00 C ATOM 1528 O THR A 102 -4.449 7.142 -2.665 1.00 0.00 O ATOM 1529 CB THR A 102 -6.075 5.154 -0.500 1.00 0.00 C ATOM 1530 OG1 THR A 102 -7.149 6.040 -0.836 1.00 0.00 O ATOM 1531 CG2 THR A 102 -6.264 4.633 0.917 1.00 0.00 C ATOM 0 H THR A 102 -5.558 7.758 -0.198 1.00 0.00 H new ATOM 0 HA THR A 102 -3.948 5.295 -0.155 1.00 0.00 H new ATOM 0 HB THR A 102 -6.076 4.306 -1.185 1.00 0.00 H new ATOM 0 HG1 THR A 102 -8.003 5.567 -0.747 1.00 0.00 H new ATOM 0 HG21 THR A 102 -7.223 4.120 0.991 1.00 0.00 H new ATOM 0 HG22 THR A 102 -5.461 3.937 1.159 1.00 0.00 H new ATOM 0 HG23 THR A 102 -6.244 5.468 1.617 1.00 0.00 H new ATOM 1539 N GLY A 103 -4.053 4.929 -2.764 1.00 0.00 N ATOM 1540 CA GLY A 103 -3.719 4.964 -4.176 1.00 0.00 C ATOM 1541 C GLY A 103 -4.561 4.006 -4.994 1.00 0.00 C ATOM 1542 O GLY A 103 -5.495 3.381 -4.491 1.00 0.00 O ATOM 0 H GLY A 103 -4.001 4.005 -2.334 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -3.856 5.977 -4.554 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -2.665 4.716 -4.303 1.00 0.00 H new ATOM 1546 N PRO A 104 -4.233 3.881 -6.289 1.00 0.00 N ATOM 1547 CA PRO A 104 -4.955 2.995 -7.207 1.00 0.00 C ATOM 1548 C PRO A 104 -4.711 1.521 -6.902 1.00 0.00 C ATOM 1549 O PRO A 104 -3.737 1.168 -6.237 1.00 0.00 O ATOM 1550 CB PRO A 104 -4.380 3.360 -8.578 1.00 0.00 C ATOM 1551 CG PRO A 104 -3.024 3.904 -8.287 1.00 0.00 C ATOM 1552 CD PRO A 104 -3.131 4.595 -6.956 1.00 0.00 C ATOM 0 HA PRO A 104 -6.035 3.125 -7.134 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -4.325 2.488 -9.229 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -5.002 4.098 -9.085 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -2.282 3.106 -8.254 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -2.708 4.600 -9.064 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -2.203 4.521 -6.389 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -3.351 5.656 -7.071 1.00 0.00 H new ATOM 1560 N ALA A 105 -5.601 0.665 -7.392 1.00 0.00 N ATOM 1561 CA ALA A 105 -5.480 -0.771 -7.174 1.00 0.00 C ATOM 1562 C ALA A 105 -5.224 -1.506 -8.486 1.00 0.00 C ATOM 1563 O ALA A 105 -5.134 -0.890 -9.548 1.00 0.00 O ATOM 1564 CB ALA A 105 -6.734 -1.310 -6.501 1.00 0.00 C ATOM 0 H ALA A 105 -6.414 0.941 -7.943 1.00 0.00 H new ATOM 0 HA ALA A 105 -4.626 -0.943 -6.519 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -6.630 -2.384 -6.344 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.873 -0.815 -5.540 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -7.599 -1.118 -7.136 1.00 0.00 H new ATOM 1570 N THR A 106 -5.106 -2.828 -8.405 1.00 0.00 N ATOM 1571 CA THR A 106 -4.858 -3.647 -9.584 1.00 0.00 C ATOM 1572 C THR A 106 -6.119 -4.387 -10.015 1.00 0.00 C ATOM 1573 O THR A 106 -6.809 -4.989 -9.192 1.00 0.00 O ATOM 1574 CB THR A 106 -3.736 -4.672 -9.331 1.00 0.00 C ATOM 1575 OG1 THR A 106 -4.131 -5.587 -8.303 1.00 0.00 O ATOM 1576 CG2 THR A 106 -2.446 -3.974 -8.928 1.00 0.00 C ATOM 0 H THR A 106 -5.178 -3.354 -7.534 1.00 0.00 H new ATOM 0 HA THR A 106 -4.548 -2.969 -10.379 1.00 0.00 H new ATOM 0 HB THR A 106 -3.560 -5.220 -10.256 1.00 0.00 H new ATOM 0 HG1 THR A 106 -4.724 -6.269 -8.682 1.00 0.00 H new ATOM 0 HG21 THR A 106 -1.669 -4.718 -8.755 1.00 0.00 H new ATOM 0 HG22 THR A 106 -2.132 -3.300 -9.725 1.00 0.00 H new ATOM 0 HG23 THR A 106 -2.611 -3.403 -8.015 1.00 0.00 H new ATOM 1584 N ASP A 107 -6.415 -4.338 -11.309 1.00 0.00 N ATOM 1585 CA ASP A 107 -7.593 -5.006 -11.850 1.00 0.00 C ATOM 1586 C ASP A 107 -7.909 -6.273 -11.062 1.00 0.00 C ATOM 1587 O ASP A 107 -7.030 -7.102 -10.823 1.00 0.00 O ATOM 1588 CB ASP A 107 -7.380 -5.347 -13.326 1.00 0.00 C ATOM 1589 CG ASP A 107 -5.915 -5.517 -13.675 1.00 0.00 C ATOM 1590 OD1 ASP A 107 -5.179 -6.120 -12.867 1.00 0.00 O ATOM 1591 OD2 ASP A 107 -5.504 -5.046 -14.756 1.00 0.00 O ATOM 0 H ASP A 107 -5.855 -3.843 -12.003 1.00 0.00 H new ATOM 0 HA ASP A 107 -8.439 -4.325 -11.762 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -7.916 -6.265 -13.565 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -7.808 -4.558 -13.944 1.00 0.00 H new ATOM 1596 N TRP A 108 -9.167 -6.417 -10.662 1.00 0.00 N ATOM 1597 CA TRP A 108 -9.598 -7.583 -9.900 1.00 0.00 C ATOM 1598 C TRP A 108 -9.087 -8.870 -10.539 1.00 0.00 C ATOM 1599 O TRP A 108 -9.679 -9.380 -11.491 1.00 0.00 O ATOM 1600 CB TRP A 108 -11.124 -7.619 -9.802 1.00 0.00 C ATOM 1601 CG TRP A 108 -11.663 -6.839 -8.641 1.00 0.00 C ATOM 1602 CD1 TRP A 108 -12.471 -5.740 -8.697 1.00 0.00 C ATOM 1603 CD2 TRP A 108 -11.429 -7.098 -7.252 1.00 0.00 C ATOM 1604 NE1 TRP A 108 -12.755 -5.300 -7.426 1.00 0.00 N ATOM 1605 CE2 TRP A 108 -12.129 -6.117 -6.522 1.00 0.00 C ATOM 1606 CE3 TRP A 108 -10.700 -8.064 -6.554 1.00 0.00 C ATOM 1607 CZ2 TRP A 108 -12.117 -6.075 -5.131 1.00 0.00 C ATOM 1608 CZ3 TRP A 108 -10.689 -8.022 -5.173 1.00 0.00 C ATOM 1609 CH2 TRP A 108 -11.395 -7.034 -4.473 1.00 0.00 C ATOM 0 H TRP A 108 -9.907 -5.741 -10.853 1.00 0.00 H new ATOM 0 HA TRP A 108 -9.179 -7.506 -8.897 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -11.550 -7.224 -10.725 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -11.451 -8.655 -9.718 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -12.834 -5.283 -9.606 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -13.337 -4.496 -7.194 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -10.155 -8.830 -7.085 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -12.658 -5.313 -4.590 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -10.127 -8.763 -4.624 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -11.369 -7.029 -3.393 1.00 0.00 H new ATOM 1620 N LEU A 109 -7.985 -9.391 -10.010 1.00 0.00 N ATOM 1621 CA LEU A 109 -7.395 -10.620 -10.529 1.00 0.00 C ATOM 1622 C LEU A 109 -7.852 -11.829 -9.719 1.00 0.00 C ATOM 1623 O LEU A 109 -7.554 -11.941 -8.530 1.00 0.00 O ATOM 1624 CB LEU A 109 -5.868 -10.524 -10.507 1.00 0.00 C ATOM 1625 CG LEU A 109 -5.132 -11.281 -11.613 1.00 0.00 C ATOM 1626 CD1 LEU A 109 -5.654 -10.867 -12.981 1.00 0.00 C ATOM 1627 CD2 LEU A 109 -3.632 -11.039 -11.518 1.00 0.00 C ATOM 0 H LEU A 109 -7.482 -8.982 -9.222 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.731 -10.749 -11.558 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -5.589 -9.472 -10.567 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -5.515 -10.893 -9.544 1.00 0.00 H new ATOM 0 HG LEU A 109 -5.317 -12.347 -11.483 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -5.119 -11.416 -13.756 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -6.719 -11.091 -13.047 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -5.499 -9.797 -13.121 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -3.124 -11.585 -12.313 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -3.428 -9.973 -11.623 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.268 -11.385 -10.550 1.00 0.00 H new ATOM 1639 N SER A 110 -8.576 -12.732 -10.372 1.00 0.00 N ATOM 1640 CA SER A 110 -9.076 -13.932 -9.712 1.00 0.00 C ATOM 1641 C SER A 110 -8.051 -15.060 -9.786 1.00 0.00 C ATOM 1642 O SER A 110 -7.247 -15.123 -10.715 1.00 0.00 O ATOM 1643 CB SER A 110 -10.392 -14.381 -10.351 1.00 0.00 C ATOM 1644 OG SER A 110 -10.178 -14.881 -11.660 1.00 0.00 O ATOM 0 H SER A 110 -8.829 -12.655 -11.357 1.00 0.00 H new ATOM 0 HA SER A 110 -9.253 -13.693 -8.663 1.00 0.00 H new ATOM 0 HB2 SER A 110 -10.855 -15.152 -9.735 1.00 0.00 H new ATOM 0 HB3 SER A 110 -11.087 -13.542 -10.388 1.00 0.00 H new ATOM 0 HG SER A 110 -11.033 -15.163 -12.046 1.00 0.00 H new ATOM 1650 N ALA A 111 -8.086 -15.949 -8.798 1.00 0.00 N ATOM 1651 CA ALA A 111 -7.163 -17.075 -8.751 1.00 0.00 C ATOM 1652 C ALA A 111 -7.809 -18.288 -8.090 1.00 0.00 C ATOM 1653 O ALA A 111 -8.387 -18.182 -7.009 1.00 0.00 O ATOM 1654 CB ALA A 111 -5.891 -16.685 -8.012 1.00 0.00 C ATOM 0 H ALA A 111 -8.744 -15.910 -8.020 1.00 0.00 H new ATOM 0 HA ALA A 111 -6.907 -17.345 -9.776 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -5.211 -17.536 -7.985 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -5.411 -15.853 -8.528 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -6.139 -16.386 -6.994 1.00 0.00 H new ATOM 1660 N GLU A 112 -7.708 -19.439 -8.748 1.00 0.00 N ATOM 1661 CA GLU A 112 -8.285 -20.671 -8.223 1.00 0.00 C ATOM 1662 C GLU A 112 -7.224 -21.511 -7.518 1.00 0.00 C ATOM 1663 O GLU A 112 -6.236 -21.924 -8.126 1.00 0.00 O ATOM 1664 CB GLU A 112 -8.925 -21.481 -9.352 1.00 0.00 C ATOM 1665 CG GLU A 112 -9.853 -22.580 -8.862 1.00 0.00 C ATOM 1666 CD GLU A 112 -10.425 -23.409 -9.996 1.00 0.00 C ATOM 1667 OE1 GLU A 112 -9.638 -23.870 -10.849 1.00 0.00 O ATOM 1668 OE2 GLU A 112 -11.659 -23.597 -10.030 1.00 0.00 O ATOM 0 H GLU A 112 -7.233 -19.544 -9.644 1.00 0.00 H new ATOM 0 HA GLU A 112 -9.053 -20.403 -7.497 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -9.485 -20.806 -10.000 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -8.137 -21.926 -9.960 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -9.309 -23.232 -8.179 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -10.670 -22.134 -8.295 1.00 0.00 H new ATOM 1675 N THR A 113 -7.436 -21.761 -6.229 1.00 0.00 N ATOM 1676 CA THR A 113 -6.499 -22.550 -5.440 1.00 0.00 C ATOM 1677 C THR A 113 -6.436 -23.990 -5.938 1.00 0.00 C ATOM 1678 O THR A 113 -7.268 -24.417 -6.738 1.00 0.00 O ATOM 1679 CB THR A 113 -6.884 -22.552 -3.948 1.00 0.00 C ATOM 1680 OG1 THR A 113 -8.309 -22.528 -3.810 1.00 0.00 O ATOM 1681 CG2 THR A 113 -6.280 -21.353 -3.232 1.00 0.00 C ATOM 0 H THR A 113 -8.249 -21.428 -5.710 1.00 0.00 H new ATOM 0 HA THR A 113 -5.520 -22.085 -5.555 1.00 0.00 H new ATOM 0 HB THR A 113 -6.491 -23.462 -3.495 1.00 0.00 H new ATOM 0 HG1 THR A 113 -8.544 -22.335 -2.878 1.00 0.00 H new ATOM 0 HG21 THR A 113 -6.565 -21.376 -2.180 1.00 0.00 H new ATOM 0 HG22 THR A 113 -5.194 -21.389 -3.314 1.00 0.00 H new ATOM 0 HG23 THR A 113 -6.648 -20.434 -3.688 1.00 0.00 H new ATOM 1689 N PHE A 114 -5.444 -24.733 -5.459 1.00 0.00 N ATOM 1690 CA PHE A 114 -5.272 -26.126 -5.856 1.00 0.00 C ATOM 1691 C PHE A 114 -6.320 -27.014 -5.192 1.00 0.00 C ATOM 1692 O PHE A 114 -6.307 -27.204 -3.977 1.00 0.00 O ATOM 1693 CB PHE A 114 -3.868 -26.613 -5.491 1.00 0.00 C ATOM 1694 CG PHE A 114 -2.772 -25.736 -6.025 1.00 0.00 C ATOM 1695 CD1 PHE A 114 -2.721 -25.410 -7.371 1.00 0.00 C ATOM 1696 CD2 PHE A 114 -1.791 -25.240 -5.182 1.00 0.00 C ATOM 1697 CE1 PHE A 114 -1.714 -24.603 -7.865 1.00 0.00 C ATOM 1698 CE2 PHE A 114 -0.781 -24.433 -5.671 1.00 0.00 C ATOM 1699 CZ PHE A 114 -0.742 -24.115 -7.014 1.00 0.00 C ATOM 0 H PHE A 114 -4.747 -24.394 -4.796 1.00 0.00 H new ATOM 0 HA PHE A 114 -5.401 -26.189 -6.937 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -3.782 -26.668 -4.406 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -3.732 -27.625 -5.874 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -3.477 -25.791 -8.042 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -1.816 -25.487 -4.131 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -1.687 -24.354 -8.916 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -0.023 -24.051 -5.003 1.00 0.00 H new ATOM 0 HZ PHE A 114 0.047 -23.486 -7.398 1.00 0.00 H new ATOM 1709 N GLU A 115 -7.226 -27.555 -6.000 1.00 0.00 N ATOM 1710 CA GLU A 115 -8.282 -28.422 -5.491 1.00 0.00 C ATOM 1711 C GLU A 115 -7.720 -29.442 -4.505 1.00 0.00 C ATOM 1712 O GLU A 115 -8.440 -29.957 -3.649 1.00 0.00 O ATOM 1713 CB GLU A 115 -8.982 -29.144 -6.645 1.00 0.00 C ATOM 1714 CG GLU A 115 -10.460 -29.395 -6.399 1.00 0.00 C ATOM 1715 CD GLU A 115 -10.724 -30.740 -5.750 1.00 0.00 C ATOM 1716 OE1 GLU A 115 -9.872 -31.642 -5.887 1.00 0.00 O ATOM 1717 OE2 GLU A 115 -11.783 -30.889 -5.105 1.00 0.00 O ATOM 0 H GLU A 115 -7.250 -27.408 -7.009 1.00 0.00 H new ATOM 0 HA GLU A 115 -9.008 -27.799 -4.969 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -8.869 -28.553 -7.554 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -8.484 -30.098 -6.821 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -10.858 -28.605 -5.763 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -10.996 -29.342 -7.346 1.00 0.00 H new ATOM 1724 N SER A 116 -6.429 -29.731 -4.632 1.00 0.00 N ATOM 1725 CA SER A 116 -5.770 -30.692 -3.756 1.00 0.00 C ATOM 1726 C SER A 116 -4.281 -30.383 -3.632 1.00 0.00 C ATOM 1727 O SER A 116 -3.598 -30.158 -4.631 1.00 0.00 O ATOM 1728 CB SER A 116 -5.965 -32.114 -4.286 1.00 0.00 C ATOM 1729 OG SER A 116 -5.949 -33.059 -3.230 1.00 0.00 O ATOM 0 H SER A 116 -5.818 -29.313 -5.334 1.00 0.00 H new ATOM 0 HA SER A 116 -6.223 -30.615 -2.767 1.00 0.00 H new ATOM 0 HB2 SER A 116 -6.912 -32.179 -4.822 1.00 0.00 H new ATOM 0 HB3 SER A 116 -5.177 -32.350 -5.001 1.00 0.00 H new ATOM 0 HG SER A 116 -6.077 -33.959 -3.595 1.00 0.00 H new ATOM 1735 N ASP A 117 -3.786 -30.375 -2.400 1.00 0.00 N ATOM 1736 CA ASP A 117 -2.378 -30.094 -2.144 1.00 0.00 C ATOM 1737 C ASP A 117 -1.482 -31.006 -2.977 1.00 0.00 C ATOM 1738 O ASP A 117 -1.093 -32.087 -2.532 1.00 0.00 O ATOM 1739 CB ASP A 117 -2.063 -30.269 -0.657 1.00 0.00 C ATOM 1740 CG ASP A 117 -2.763 -31.472 -0.055 1.00 0.00 C ATOM 1741 OD1 ASP A 117 -2.422 -32.611 -0.438 1.00 0.00 O ATOM 1742 OD2 ASP A 117 -3.651 -31.274 0.800 1.00 0.00 O ATOM 0 H ASP A 117 -4.338 -30.560 -1.563 1.00 0.00 H new ATOM 0 HA ASP A 117 -2.181 -29.061 -2.430 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -0.986 -30.376 -0.527 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -2.362 -29.371 -0.117 1.00 0.00 H new ATOM 1747 N LEU A 118 -1.160 -30.564 -4.187 1.00 0.00 N ATOM 1748 CA LEU A 118 -0.310 -31.341 -5.084 1.00 0.00 C ATOM 1749 C LEU A 118 0.927 -30.545 -5.487 1.00 0.00 C ATOM 1750 O LEU A 118 0.824 -29.498 -6.125 1.00 0.00 O ATOM 1751 CB LEU A 118 -1.094 -31.753 -6.332 1.00 0.00 C ATOM 1752 CG LEU A 118 -2.062 -32.924 -6.160 1.00 0.00 C ATOM 1753 CD1 LEU A 118 -2.901 -33.111 -7.415 1.00 0.00 C ATOM 1754 CD2 LEU A 118 -1.302 -34.200 -5.829 1.00 0.00 C ATOM 0 H LEU A 118 -1.474 -29.672 -4.570 1.00 0.00 H new ATOM 0 HA LEU A 118 0.013 -32.236 -4.553 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -1.659 -30.889 -6.683 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -0.382 -32.009 -7.116 1.00 0.00 H new ATOM 0 HG LEU A 118 -2.732 -32.698 -5.330 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -3.584 -33.949 -7.275 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -3.474 -32.204 -7.608 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -2.247 -33.314 -8.263 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -2.007 -35.023 -5.710 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -0.608 -34.430 -6.638 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -0.746 -34.062 -4.902 1.00 0.00 H new ATOM 1766 N ASP A 119 2.097 -31.051 -5.111 1.00 0.00 N ATOM 1767 CA ASP A 119 3.356 -30.389 -5.435 1.00 0.00 C ATOM 1768 C ASP A 119 3.677 -30.531 -6.920 1.00 0.00 C ATOM 1769 O ASP A 119 3.976 -31.624 -7.398 1.00 0.00 O ATOM 1770 CB ASP A 119 4.494 -30.973 -4.597 1.00 0.00 C ATOM 1771 CG ASP A 119 5.777 -30.177 -4.730 1.00 0.00 C ATOM 1772 OD1 ASP A 119 5.695 -28.940 -4.882 1.00 0.00 O ATOM 1773 OD2 ASP A 119 6.864 -30.791 -4.684 1.00 0.00 O ATOM 0 H ASP A 119 2.200 -31.917 -4.582 1.00 0.00 H new ATOM 0 HA ASP A 119 3.252 -29.329 -5.203 1.00 0.00 H new ATOM 0 HB2 ASP A 119 4.193 -31.000 -3.550 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.675 -32.003 -4.903 1.00 0.00 H new ATOM 1778 N GLU A 120 3.611 -29.417 -7.643 1.00 0.00 N ATOM 1779 CA GLU A 120 3.893 -29.419 -9.074 1.00 0.00 C ATOM 1780 C GLU A 120 5.187 -28.667 -9.374 1.00 0.00 C ATOM 1781 O GLU A 120 5.491 -27.654 -8.743 1.00 0.00 O ATOM 1782 CB GLU A 120 2.733 -28.788 -9.846 1.00 0.00 C ATOM 1783 CG GLU A 120 1.475 -29.639 -9.857 1.00 0.00 C ATOM 1784 CD GLU A 120 0.220 -28.823 -10.099 1.00 0.00 C ATOM 1785 OE1 GLU A 120 0.286 -27.852 -10.882 1.00 0.00 O ATOM 1786 OE2 GLU A 120 -0.828 -29.154 -9.505 1.00 0.00 O ATOM 0 H GLU A 120 3.365 -28.503 -7.262 1.00 0.00 H new ATOM 0 HA GLU A 120 4.012 -30.454 -9.394 1.00 0.00 H new ATOM 0 HB2 GLU A 120 2.501 -27.817 -9.407 1.00 0.00 H new ATOM 0 HB3 GLU A 120 3.048 -28.606 -10.874 1.00 0.00 H new ATOM 0 HG2 GLU A 120 1.563 -30.401 -10.631 1.00 0.00 H new ATOM 0 HG3 GLU A 120 1.386 -30.161 -8.904 1.00 0.00 H new ATOM 1793 N THR A 121 5.946 -29.170 -10.343 1.00 0.00 N ATOM 1794 CA THR A 121 7.207 -28.549 -10.726 1.00 0.00 C ATOM 1795 C THR A 121 7.088 -27.850 -12.075 1.00 0.00 C ATOM 1796 O THR A 121 6.887 -28.496 -13.104 1.00 0.00 O ATOM 1797 CB THR A 121 8.345 -29.584 -10.796 1.00 0.00 C ATOM 1798 OG1 THR A 121 8.494 -30.236 -9.530 1.00 0.00 O ATOM 1799 CG2 THR A 121 9.657 -28.921 -11.187 1.00 0.00 C ATOM 0 H THR A 121 5.709 -30.006 -10.877 1.00 0.00 H new ATOM 0 HA THR A 121 7.442 -27.813 -9.958 1.00 0.00 H new ATOM 0 HB THR A 121 8.088 -30.322 -11.556 1.00 0.00 H new ATOM 0 HG1 THR A 121 9.219 -30.894 -9.584 1.00 0.00 H new ATOM 0 HG21 THR A 121 10.446 -29.672 -11.230 1.00 0.00 H new ATOM 0 HG22 THR A 121 9.550 -28.451 -12.165 1.00 0.00 H new ATOM 0 HG23 THR A 121 9.917 -28.164 -10.447 1.00 0.00 H new ATOM 1807 N ARG A 122 7.213 -26.527 -12.064 1.00 0.00 N ATOM 1808 CA ARG A 122 7.118 -25.740 -13.288 1.00 0.00 C ATOM 1809 C ARG A 122 7.542 -24.295 -13.040 1.00 0.00 C ATOM 1810 O ARG A 122 7.180 -23.696 -12.028 1.00 0.00 O ATOM 1811 CB ARG A 122 5.689 -25.777 -13.834 1.00 0.00 C ATOM 1812 CG ARG A 122 4.706 -24.947 -13.025 1.00 0.00 C ATOM 1813 CD ARG A 122 3.360 -24.840 -13.723 1.00 0.00 C ATOM 1814 NE ARG A 122 3.309 -23.705 -14.641 1.00 0.00 N ATOM 1815 CZ ARG A 122 2.278 -23.452 -15.440 1.00 0.00 C ATOM 1816 NH1 ARG A 122 1.219 -24.250 -15.434 1.00 0.00 N ATOM 1817 NH2 ARG A 122 2.306 -22.399 -16.247 1.00 0.00 N ATOM 0 H ARG A 122 7.380 -25.977 -11.221 1.00 0.00 H new ATOM 0 HA ARG A 122 7.792 -26.177 -14.024 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.693 -25.419 -14.863 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.345 -26.811 -13.858 1.00 0.00 H new ATOM 0 HG2 ARG A 122 4.572 -25.397 -12.041 1.00 0.00 H new ATOM 0 HG3 ARG A 122 5.115 -23.949 -12.866 1.00 0.00 H new ATOM 0 HD2 ARG A 122 3.162 -25.760 -14.273 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.572 -24.739 -12.977 1.00 0.00 H new ATOM 0 HE ARG A 122 4.108 -23.072 -14.670 1.00 0.00 H new ATOM 0 HH11 ARG A 122 1.195 -25.060 -14.815 1.00 0.00 H new ATOM 0 HH12 ARG A 122 0.429 -24.053 -16.048 1.00 0.00 H new ATOM 0 HH21 ARG A 122 3.119 -21.783 -16.254 1.00 0.00 H new ATOM 0 HH22 ARG A 122 1.514 -22.205 -16.860 1.00 0.00 H new ATOM 1831 N VAL A 123 8.313 -23.742 -13.971 1.00 0.00 N ATOM 1832 CA VAL A 123 8.786 -22.368 -13.854 1.00 0.00 C ATOM 1833 C VAL A 123 8.906 -21.710 -15.224 1.00 0.00 C ATOM 1834 O VAL A 123 9.408 -22.298 -16.182 1.00 0.00 O ATOM 1835 CB VAL A 123 10.152 -22.303 -13.145 1.00 0.00 C ATOM 1836 CG1 VAL A 123 10.632 -20.864 -13.041 1.00 0.00 C ATOM 1837 CG2 VAL A 123 10.068 -22.946 -11.769 1.00 0.00 C ATOM 0 H VAL A 123 8.623 -24.225 -14.814 1.00 0.00 H new ATOM 0 HA VAL A 123 8.049 -21.829 -13.258 1.00 0.00 H new ATOM 0 HB VAL A 123 10.877 -22.860 -13.738 1.00 0.00 H new ATOM 0 HG11 VAL A 123 11.598 -20.838 -12.537 1.00 0.00 H new ATOM 0 HG12 VAL A 123 10.732 -20.441 -14.040 1.00 0.00 H new ATOM 0 HG13 VAL A 123 9.910 -20.280 -12.471 1.00 0.00 H new ATOM 0 HG21 VAL A 123 11.042 -22.892 -11.282 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.330 -22.418 -11.165 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.772 -23.990 -11.873 1.00 0.00 H new ATOM 1847 N PRO A 124 8.434 -20.458 -15.322 1.00 0.00 N ATOM 1848 CA PRO A 124 8.478 -19.691 -16.571 1.00 0.00 C ATOM 1849 C PRO A 124 9.898 -19.291 -16.956 1.00 0.00 C ATOM 1850 O PRO A 124 10.864 -19.701 -16.312 1.00 0.00 O ATOM 1851 CB PRO A 124 7.640 -18.450 -16.254 1.00 0.00 C ATOM 1852 CG PRO A 124 7.730 -18.299 -14.775 1.00 0.00 C ATOM 1853 CD PRO A 124 7.823 -19.694 -14.221 1.00 0.00 C ATOM 0 HA PRO A 124 8.107 -20.268 -17.418 1.00 0.00 H new ATOM 0 HB2 PRO A 124 8.028 -17.569 -16.766 1.00 0.00 H new ATOM 0 HB3 PRO A 124 6.607 -18.577 -16.577 1.00 0.00 H new ATOM 0 HG2 PRO A 124 8.603 -17.709 -14.495 1.00 0.00 H new ATOM 0 HG3 PRO A 124 6.856 -17.780 -14.382 1.00 0.00 H new ATOM 0 HD2 PRO A 124 8.435 -19.729 -13.320 1.00 0.00 H new ATOM 0 HD3 PRO A 124 6.842 -20.087 -13.955 1.00 0.00 H new ATOM 1861 N GLU A 125 10.017 -18.488 -18.009 1.00 0.00 N ATOM 1862 CA GLU A 125 11.321 -18.033 -18.479 1.00 0.00 C ATOM 1863 C GLU A 125 11.170 -16.892 -19.480 1.00 0.00 C ATOM 1864 O GLU A 125 10.621 -17.073 -20.567 1.00 0.00 O ATOM 1865 CB GLU A 125 12.088 -19.191 -19.120 1.00 0.00 C ATOM 1866 CG GLU A 125 13.529 -18.851 -19.462 1.00 0.00 C ATOM 1867 CD GLU A 125 14.290 -20.034 -20.028 1.00 0.00 C ATOM 1868 OE1 GLU A 125 13.945 -21.183 -19.680 1.00 0.00 O ATOM 1869 OE2 GLU A 125 15.229 -19.810 -20.820 1.00 0.00 O ATOM 0 H GLU A 125 9.227 -18.139 -18.552 1.00 0.00 H new ATOM 0 HA GLU A 125 11.882 -17.667 -17.619 1.00 0.00 H new ATOM 0 HB2 GLU A 125 12.076 -20.044 -18.441 1.00 0.00 H new ATOM 0 HB3 GLU A 125 11.571 -19.500 -20.029 1.00 0.00 H new ATOM 0 HG2 GLU A 125 13.544 -18.035 -20.185 1.00 0.00 H new ATOM 0 HG3 GLU A 125 14.036 -18.493 -18.566 1.00 0.00 H new ATOM 1876 N VAL A 126 11.662 -15.715 -19.105 1.00 0.00 N ATOM 1877 CA VAL A 126 11.583 -14.543 -19.970 1.00 0.00 C ATOM 1878 C VAL A 126 12.954 -13.901 -20.150 1.00 0.00 C ATOM 1879 O VAL A 126 13.692 -13.708 -19.185 1.00 0.00 O ATOM 1880 CB VAL A 126 10.606 -13.494 -19.406 1.00 0.00 C ATOM 1881 CG1 VAL A 126 10.578 -12.260 -20.293 1.00 0.00 C ATOM 1882 CG2 VAL A 126 9.214 -14.088 -19.259 1.00 0.00 C ATOM 0 H VAL A 126 12.119 -15.548 -18.209 1.00 0.00 H new ATOM 0 HA VAL A 126 11.216 -14.886 -20.937 1.00 0.00 H new ATOM 0 HB VAL A 126 10.953 -13.193 -18.418 1.00 0.00 H new ATOM 0 HG11 VAL A 126 9.882 -11.530 -19.879 1.00 0.00 H new ATOM 0 HG12 VAL A 126 11.576 -11.824 -20.341 1.00 0.00 H new ATOM 0 HG13 VAL A 126 10.256 -12.540 -21.296 1.00 0.00 H new ATOM 0 HG21 VAL A 126 8.537 -13.333 -18.859 1.00 0.00 H new ATOM 0 HG22 VAL A 126 8.855 -14.418 -20.234 1.00 0.00 H new ATOM 0 HG23 VAL A 126 9.251 -14.939 -18.579 1.00 0.00 H new ATOM 1892 N SER A 127 13.287 -13.570 -21.394 1.00 0.00 N ATOM 1893 CA SER A 127 14.571 -12.952 -21.703 1.00 0.00 C ATOM 1894 C SER A 127 14.521 -12.240 -23.051 1.00 0.00 C ATOM 1895 O SER A 127 14.080 -12.808 -24.049 1.00 0.00 O ATOM 1896 CB SER A 127 15.680 -14.005 -21.710 1.00 0.00 C ATOM 1897 OG SER A 127 15.730 -14.685 -22.952 1.00 0.00 O ATOM 0 H SER A 127 12.685 -13.720 -22.204 1.00 0.00 H new ATOM 0 HA SER A 127 14.786 -12.214 -20.930 1.00 0.00 H new ATOM 0 HB2 SER A 127 16.640 -13.528 -21.514 1.00 0.00 H new ATOM 0 HB3 SER A 127 15.511 -14.721 -20.906 1.00 0.00 H new ATOM 0 HG SER A 127 16.448 -15.351 -22.931 1.00 0.00 H new ATOM 1903 N GLY A 128 14.977 -10.991 -23.072 1.00 0.00 N ATOM 1904 CA GLY A 128 14.976 -10.221 -24.302 1.00 0.00 C ATOM 1905 C GLY A 128 14.596 -8.771 -24.078 1.00 0.00 C ATOM 1906 O GLY A 128 13.483 -8.343 -24.386 1.00 0.00 O ATOM 0 H GLY A 128 15.347 -10.499 -22.259 1.00 0.00 H new ATOM 0 HA2 GLY A 128 15.965 -10.268 -24.757 1.00 0.00 H new ATOM 0 HA3 GLY A 128 14.278 -10.671 -25.008 1.00 0.00 H new ATOM 1910 N PRO A 129 15.536 -7.988 -23.528 1.00 0.00 N ATOM 1911 CA PRO A 129 15.317 -6.565 -23.249 1.00 0.00 C ATOM 1912 C PRO A 129 15.229 -5.732 -24.523 1.00 0.00 C ATOM 1913 O PRO A 129 15.319 -6.262 -25.631 1.00 0.00 O ATOM 1914 CB PRO A 129 16.552 -6.169 -22.436 1.00 0.00 C ATOM 1915 CG PRO A 129 17.603 -7.142 -22.845 1.00 0.00 C ATOM 1916 CD PRO A 129 16.884 -8.430 -23.136 1.00 0.00 C ATOM 0 HA PRO A 129 14.374 -6.392 -22.730 1.00 0.00 H new ATOM 0 HB2 PRO A 129 16.856 -5.145 -22.651 1.00 0.00 H new ATOM 0 HB3 PRO A 129 16.356 -6.225 -21.365 1.00 0.00 H new ATOM 0 HG2 PRO A 129 18.141 -6.788 -23.724 1.00 0.00 H new ATOM 0 HG3 PRO A 129 18.340 -7.277 -22.053 1.00 0.00 H new ATOM 0 HD2 PRO A 129 17.371 -8.990 -23.934 1.00 0.00 H new ATOM 0 HD3 PRO A 129 16.855 -9.080 -22.262 1.00 0.00 H new ATOM 1924 N SER A 130 15.054 -4.425 -24.359 1.00 0.00 N ATOM 1925 CA SER A 130 14.950 -3.518 -25.497 1.00 0.00 C ATOM 1926 C SER A 130 14.952 -2.064 -25.035 1.00 0.00 C ATOM 1927 O SER A 130 14.184 -1.680 -24.154 1.00 0.00 O ATOM 1928 CB SER A 130 13.678 -3.810 -26.294 1.00 0.00 C ATOM 1929 OG SER A 130 12.526 -3.693 -25.478 1.00 0.00 O ATOM 0 H SER A 130 14.981 -3.970 -23.449 1.00 0.00 H new ATOM 0 HA SER A 130 15.817 -3.678 -26.138 1.00 0.00 H new ATOM 0 HB2 SER A 130 13.604 -3.119 -27.133 1.00 0.00 H new ATOM 0 HB3 SER A 130 13.730 -4.815 -26.713 1.00 0.00 H new ATOM 0 HG SER A 130 12.675 -3.002 -24.799 1.00 0.00 H new ATOM 1935 N SER A 131 15.822 -1.260 -25.637 1.00 0.00 N ATOM 1936 CA SER A 131 15.929 0.151 -25.286 1.00 0.00 C ATOM 1937 C SER A 131 15.137 1.015 -26.263 1.00 0.00 C ATOM 1938 O SER A 131 14.344 1.864 -25.856 1.00 0.00 O ATOM 1939 CB SER A 131 17.395 0.587 -25.275 1.00 0.00 C ATOM 1940 OG SER A 131 17.569 1.774 -24.522 1.00 0.00 O ATOM 0 H SER A 131 16.463 -1.562 -26.371 1.00 0.00 H new ATOM 0 HA SER A 131 15.511 0.284 -24.288 1.00 0.00 H new ATOM 0 HB2 SER A 131 18.011 -0.208 -24.854 1.00 0.00 H new ATOM 0 HB3 SER A 131 17.737 0.748 -26.297 1.00 0.00 H new ATOM 0 HG SER A 131 18.515 2.030 -24.529 1.00 0.00 H new ATOM 1946 N GLY A 132 15.358 0.791 -27.555 1.00 0.00 N ATOM 1947 CA GLY A 132 14.658 1.557 -28.570 1.00 0.00 C ATOM 1948 C GLY A 132 15.185 1.286 -29.965 1.00 0.00 C ATOM 1949 O GLY A 132 14.656 0.436 -30.682 1.00 0.00 O ATOM 0 H GLY A 132 16.009 0.094 -27.917 1.00 0.00 H new ATOM 0 HA2 GLY A 132 13.595 1.318 -28.533 1.00 0.00 H new ATOM 0 HA3 GLY A 132 14.753 2.620 -28.349 1.00 0.00 H new TER 1953 GLY A 132