USER MOD reduce.3.24.130724 H: found=0, std=0, add=1488, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1486 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: B 98 THR OG1 : rot 35:sc= 0.553 USER MOD Set 1.2: B 100 GLN : amide:sc= 0 X(o=0.55,f=0.92) USER MOD Set 2.1: A 91 GLN : amide:sc= -0.659 K(o=-2.1,f=-4.7) USER MOD Set 2.2: B 81 HIS : no HD1:sc= -1.39 K(o=-2.1,f=-4.3) USER MOD Set 3.1: B 22 THR OG1 : rot 180:sc= 1.07 USER MOD Set 3.2: B 54 HIS : no HD1:sc= 0.382 K(o=1.5,f=-3.7) USER MOD Set 4.1: B 47 THR OG1 : rot -170:sc= 0.311 USER MOD Set 4.2: B 49 SER OG : rot 180:sc= 0.00884 USER MOD Set 5.1: B 35 CYS SG : rot 105:sc=-0.00167 USER MOD Set 5.2: B 39 GLN :FLIP amide:sc= -2.36! X(o=-2.5,f=-2.3!) USER MOD Set 5.3: B 43 HIS :FLIP no HD1:sc= 0.0723 F(o=-4,f=-2.3) USER MOD Set 6.1: A 98 THR OG1 : rot 134:sc= 0.443 USER MOD Set 6.2: A 100 GLN :FLIP amide:sc= 0.401 F(o=0.32,f=0.84) USER MOD Set 7.1: A 81 HIS : no HE2:sc= -1.07 K(o=-1.9,f=-4.5) USER MOD Set 7.2: B 91 GLN : amide:sc= -0.802 K(o=-1.9,f=-4.4) USER MOD Set 8.1: A 47 THR OG1 : rot 180:sc= 0.253 USER MOD Set 8.2: A 49 SER OG : rot 180:sc= 0 USER MOD Set 9.1: A 35 CYS SG : rot 103:sc= 0.0921 USER MOD Set 9.2: A 39 GLN :FLIP amide:sc= -2.22! X(o=-3.1,f=-2.7!) USER MOD Set 9.3: A 43 HIS :FLIP no HD1:sc= -0.561 F(o=-4.8!,f=-2.7) USER MOD Set10.1: A 22 THR OG1 : rot -179:sc= 0.792 USER MOD Set10.2: A 54 HIS : no HD1:sc= 0.265 K(o=1.1,f=-4.4) USER MOD Single : A 24 CYS SG : rot 116:sc= 0.236 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 52 SER OG : rot 76:sc= 0.963 USER MOD Single : A 53 ASN : amide:sc= 0.436 X(o=0.44,f=0) USER MOD Single : A 56 SER OG : rot 170:sc= 0 USER MOD Single : A 67 THR OG1 : rot -130:sc= 0.204 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= 0.396 K(o=0.4,f=-4.8!) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : B 24 CYS SG : rot 103:sc= 0.147 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 50 ASN : amide:sc= -0.0449 K(o=-0.045,f=-2.2!) USER MOD Single : B 52 SER OG : rot 76:sc= 1.28 USER MOD Single : B 53 ASN : amide:sc= 0.935 K(o=0.94,f=0) USER MOD Single : B 56 SER OG : rot -117:sc= 1.16 USER MOD Single : B 67 THR OG1 : rot -130:sc= 0.242 USER MOD Single : B 68 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 GLN : amide:sc= 0.341 K(o=0.34,f=-5.1!) USER MOD Single : B 75 TYR OH : rot 180:sc=0.000256 USER MOD Single : B 80 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 10 9.481 2.665 -8.803 1.00 0.00 N ATOM 2 CA ALA A 10 9.365 1.276 -8.342 1.00 0.00 C ATOM 3 C ALA A 10 7.960 0.874 -7.836 1.00 0.00 C ATOM 4 O ALA A 10 7.748 0.592 -6.656 1.00 0.00 O ATOM 5 CB ALA A 10 10.514 1.070 -7.351 1.00 0.00 C ATOM 0 HA ALA A 10 9.465 0.580 -9.175 1.00 0.00 H new ATOM 0 HB1 ALA A 10 10.485 0.050 -6.968 1.00 0.00 H new ATOM 0 HB2 ALA A 10 11.465 1.242 -7.856 1.00 0.00 H new ATOM 0 HB3 ALA A 10 10.411 1.772 -6.523 1.00 0.00 H new ATOM 11 N LEU A 11 6.991 0.840 -8.759 1.00 0.00 N ATOM 12 CA LEU A 11 5.550 0.755 -8.486 1.00 0.00 C ATOM 13 C LEU A 11 5.119 -0.391 -7.553 1.00 0.00 C ATOM 14 O LEU A 11 4.243 -0.175 -6.716 1.00 0.00 O ATOM 15 CB LEU A 11 4.767 0.697 -9.820 1.00 0.00 C ATOM 16 CG LEU A 11 4.839 1.918 -10.771 1.00 0.00 C ATOM 17 CD1 LEU A 11 4.534 3.243 -10.057 1.00 0.00 C ATOM 18 CD2 LEU A 11 6.163 2.024 -11.548 1.00 0.00 C ATOM 0 H LEU A 11 7.197 0.872 -9.757 1.00 0.00 H new ATOM 0 HA LEU A 11 5.306 1.662 -7.933 1.00 0.00 H new ATOM 0 HB2 LEU A 11 5.117 -0.175 -10.372 1.00 0.00 H new ATOM 0 HB3 LEU A 11 3.718 0.523 -9.582 1.00 0.00 H new ATOM 0 HG LEU A 11 4.053 1.735 -11.504 1.00 0.00 H new ATOM 0 HD11 LEU A 11 4.599 4.064 -10.771 1.00 0.00 H new ATOM 0 HD12 LEU A 11 3.529 3.207 -9.636 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.257 3.400 -9.257 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.138 2.903 -12.192 1.00 0.00 H new ATOM 0 HD22 LEU A 11 6.991 2.113 -10.845 1.00 0.00 H new ATOM 0 HD23 LEU A 11 6.299 1.131 -12.158 1.00 0.00 H new ATOM 30 N ALA A 12 5.701 -1.591 -7.661 1.00 0.00 N ATOM 31 CA ALA A 12 5.417 -2.678 -6.714 1.00 0.00 C ATOM 32 C ALA A 12 6.160 -2.479 -5.377 1.00 0.00 C ATOM 33 O ALA A 12 5.617 -2.739 -4.299 1.00 0.00 O ATOM 34 CB ALA A 12 5.783 -4.008 -7.381 1.00 0.00 C ATOM 0 H ALA A 12 6.370 -1.835 -8.392 1.00 0.00 H new ATOM 0 HA ALA A 12 4.355 -2.679 -6.467 1.00 0.00 H new ATOM 0 HB1 ALA A 12 5.579 -4.828 -6.693 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.189 -4.137 -8.286 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.842 -4.006 -7.640 1.00 0.00 H new ATOM 40 N ARG A 13 7.392 -1.958 -5.439 1.00 0.00 N ATOM 41 CA ARG A 13 8.238 -1.644 -4.277 1.00 0.00 C ATOM 42 C ARG A 13 7.624 -0.570 -3.377 1.00 0.00 C ATOM 43 O ARG A 13 7.824 -0.647 -2.165 1.00 0.00 O ATOM 44 CB ARG A 13 9.659 -1.251 -4.702 1.00 0.00 C ATOM 45 CG ARG A 13 10.310 -2.255 -5.667 1.00 0.00 C ATOM 46 CD ARG A 13 10.597 -3.607 -5.002 1.00 0.00 C ATOM 47 NE ARG A 13 11.015 -4.600 -6.000 1.00 0.00 N ATOM 48 CZ ARG A 13 12.021 -5.458 -5.970 1.00 0.00 C ATOM 49 NH1 ARG A 13 12.939 -5.429 -5.024 1.00 0.00 N ATOM 50 NH2 ARG A 13 12.090 -6.368 -6.912 1.00 0.00 N ATOM 0 H ARG A 13 7.843 -1.736 -6.326 1.00 0.00 H new ATOM 0 HA ARG A 13 8.300 -2.560 -3.689 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.630 -0.270 -5.176 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.283 -1.157 -3.813 1.00 0.00 H new ATOM 0 HG2 ARG A 13 9.654 -2.407 -6.524 1.00 0.00 H new ATOM 0 HG3 ARG A 13 11.241 -1.836 -6.048 1.00 0.00 H new ATOM 0 HD2 ARG A 13 11.377 -3.489 -4.250 1.00 0.00 H new ATOM 0 HD3 ARG A 13 9.705 -3.959 -4.483 1.00 0.00 H new ATOM 0 HE ARG A 13 10.443 -4.633 -6.844 1.00 0.00 H new ATOM 0 HH11 ARG A 13 12.887 -4.729 -4.284 1.00 0.00 H new ATOM 0 HH12 ARG A 13 13.701 -6.107 -5.032 1.00 0.00 H new ATOM 0 HH21 ARG A 13 11.379 -6.401 -7.642 1.00 0.00 H new ATOM 0 HH22 ARG A 13 12.855 -7.043 -6.914 1.00 0.00 H new ATOM 64 N LEU A 14 6.806 0.340 -3.920 1.00 0.00 N ATOM 65 CA LEU A 14 5.960 1.285 -3.182 1.00 0.00 C ATOM 66 C LEU A 14 5.196 0.533 -2.085 1.00 0.00 C ATOM 67 O LEU A 14 5.377 0.816 -0.901 1.00 0.00 O ATOM 68 CB LEU A 14 5.029 1.973 -4.211 1.00 0.00 C ATOM 69 CG LEU A 14 4.143 3.150 -3.746 1.00 0.00 C ATOM 70 CD1 LEU A 14 3.084 2.771 -2.703 1.00 0.00 C ATOM 71 CD2 LEU A 14 4.977 4.340 -3.256 1.00 0.00 C ATOM 0 H LEU A 14 6.712 0.442 -4.931 1.00 0.00 H new ATOM 0 HA LEU A 14 6.543 2.055 -2.677 1.00 0.00 H new ATOM 0 HB2 LEU A 14 5.652 2.333 -5.030 1.00 0.00 H new ATOM 0 HB3 LEU A 14 4.371 1.208 -4.623 1.00 0.00 H new ATOM 0 HG LEU A 14 3.596 3.448 -4.640 1.00 0.00 H new ATOM 0 HD11 LEU A 14 2.507 3.655 -2.432 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.417 2.016 -3.119 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.574 2.372 -1.815 1.00 0.00 H new ATOM 0 HD21 LEU A 14 4.313 5.144 -2.939 1.00 0.00 H new ATOM 0 HD22 LEU A 14 5.597 4.028 -2.415 1.00 0.00 H new ATOM 0 HD23 LEU A 14 5.615 4.695 -4.065 1.00 0.00 H new ATOM 83 N GLY A 15 4.414 -0.487 -2.457 1.00 0.00 N ATOM 84 CA GLY A 15 3.619 -1.242 -1.486 1.00 0.00 C ATOM 85 C GLY A 15 4.435 -2.236 -0.665 1.00 0.00 C ATOM 86 O GLY A 15 3.958 -2.686 0.372 1.00 0.00 O ATOM 0 H GLY A 15 4.316 -0.807 -3.421 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.128 -0.542 -0.810 1.00 0.00 H new ATOM 0 HA3 GLY A 15 2.832 -1.780 -2.014 1.00 0.00 H new ATOM 90 N ARG A 16 5.674 -2.556 -1.075 1.00 0.00 N ATOM 91 CA ARG A 16 6.604 -3.265 -0.188 1.00 0.00 C ATOM 92 C ARG A 16 6.937 -2.298 0.949 1.00 0.00 C ATOM 93 O ARG A 16 6.518 -2.532 2.075 1.00 0.00 O ATOM 94 CB ARG A 16 7.888 -3.752 -0.893 1.00 0.00 C ATOM 95 CG ARG A 16 7.670 -4.604 -2.149 1.00 0.00 C ATOM 96 CD ARG A 16 6.861 -5.872 -1.914 1.00 0.00 C ATOM 97 NE ARG A 16 6.581 -6.560 -3.183 1.00 0.00 N ATOM 98 CZ ARG A 16 5.498 -6.403 -3.935 1.00 0.00 C ATOM 99 NH1 ARG A 16 4.615 -5.456 -3.724 1.00 0.00 N ATOM 100 NH2 ARG A 16 5.278 -7.225 -4.925 1.00 0.00 N ATOM 0 H ARG A 16 6.048 -2.339 -1.999 1.00 0.00 H new ATOM 0 HA ARG A 16 6.130 -4.177 0.174 1.00 0.00 H new ATOM 0 HB2 ARG A 16 8.485 -2.881 -1.165 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.476 -4.331 -0.180 1.00 0.00 H new ATOM 0 HG2 ARG A 16 7.164 -3.999 -2.901 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.641 -4.878 -2.561 1.00 0.00 H new ATOM 0 HD2 ARG A 16 7.408 -6.539 -1.248 1.00 0.00 H new ATOM 0 HD3 ARG A 16 5.924 -5.623 -1.417 1.00 0.00 H new ATOM 0 HE ARG A 16 7.284 -7.219 -3.517 1.00 0.00 H new ATOM 0 HH11 ARG A 16 4.745 -4.800 -2.954 1.00 0.00 H new ATOM 0 HH12 ARG A 16 3.798 -5.376 -4.330 1.00 0.00 H new ATOM 0 HH21 ARG A 16 5.936 -7.981 -5.116 1.00 0.00 H new ATOM 0 HH22 ARG A 16 4.448 -7.111 -5.507 1.00 0.00 H new ATOM 114 N ALA A 17 7.560 -1.159 0.621 1.00 0.00 N ATOM 115 CA ALA A 17 8.086 -0.156 1.545 1.00 0.00 C ATOM 116 C ALA A 17 7.036 0.499 2.455 1.00 0.00 C ATOM 117 O ALA A 17 7.349 0.755 3.618 1.00 0.00 O ATOM 118 CB ALA A 17 8.820 0.903 0.712 1.00 0.00 C ATOM 0 H ALA A 17 7.718 -0.902 -0.353 1.00 0.00 H new ATOM 0 HA ALA A 17 8.756 -0.667 2.236 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.226 1.669 1.373 1.00 0.00 H new ATOM 0 HB2 ALA A 17 9.633 0.432 0.160 1.00 0.00 H new ATOM 0 HB3 ALA A 17 8.123 1.362 0.011 1.00 0.00 H new ATOM 124 N LEU A 18 5.822 0.782 1.966 1.00 0.00 N ATOM 125 CA LEU A 18 4.774 1.423 2.777 1.00 0.00 C ATOM 126 C LEU A 18 4.059 0.432 3.703 1.00 0.00 C ATOM 127 O LEU A 18 3.373 0.868 4.623 1.00 0.00 O ATOM 128 CB LEU A 18 3.778 2.185 1.875 1.00 0.00 C ATOM 129 CG LEU A 18 4.176 3.651 1.603 1.00 0.00 C ATOM 130 CD1 LEU A 18 5.423 3.788 0.718 1.00 0.00 C ATOM 131 CD2 LEU A 18 3.002 4.396 0.950 1.00 0.00 C ATOM 0 H LEU A 18 5.538 0.577 1.008 1.00 0.00 H new ATOM 0 HA LEU A 18 5.264 2.146 3.429 1.00 0.00 H new ATOM 0 HB2 LEU A 18 3.690 1.660 0.924 1.00 0.00 H new ATOM 0 HB3 LEU A 18 2.793 2.167 2.342 1.00 0.00 H new ATOM 0 HG LEU A 18 4.422 4.091 2.569 1.00 0.00 H new ATOM 0 HD11 LEU A 18 5.647 4.844 0.566 1.00 0.00 H new ATOM 0 HD12 LEU A 18 6.269 3.303 1.205 1.00 0.00 H new ATOM 0 HD13 LEU A 18 5.239 3.314 -0.246 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.288 5.430 0.760 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.743 3.912 0.008 1.00 0.00 H new ATOM 0 HD23 LEU A 18 2.141 4.375 1.618 1.00 0.00 H new ATOM 143 N ALA A 19 4.225 -0.878 3.490 1.00 0.00 N ATOM 144 CA ALA A 19 3.774 -1.927 4.401 1.00 0.00 C ATOM 145 C ALA A 19 4.946 -2.780 4.928 1.00 0.00 C ATOM 146 O ALA A 19 4.763 -3.952 5.253 1.00 0.00 O ATOM 147 CB ALA A 19 2.676 -2.732 3.698 1.00 0.00 C ATOM 0 H ALA A 19 4.688 -1.243 2.658 1.00 0.00 H new ATOM 0 HA ALA A 19 3.346 -1.489 5.302 1.00 0.00 H new ATOM 0 HB1 ALA A 19 2.323 -3.522 4.361 1.00 0.00 H new ATOM 0 HB2 ALA A 19 1.846 -2.072 3.446 1.00 0.00 H new ATOM 0 HB3 ALA A 19 3.077 -3.175 2.786 1.00 0.00 H new ATOM 153 N ASP A 20 6.162 -2.235 4.943 1.00 0.00 N ATOM 154 CA ASP A 20 7.312 -2.766 5.669 1.00 0.00 C ATOM 155 C ASP A 20 7.249 -2.096 7.057 1.00 0.00 C ATOM 156 O ASP A 20 6.798 -0.951 7.130 1.00 0.00 O ATOM 157 CB ASP A 20 8.615 -2.447 4.910 1.00 0.00 C ATOM 158 CG ASP A 20 8.960 -3.448 3.798 1.00 0.00 C ATOM 159 OD1 ASP A 20 8.862 -4.676 4.027 1.00 0.00 O ATOM 160 OD2 ASP A 20 9.410 -2.973 2.727 1.00 0.00 O ATOM 0 H ASP A 20 6.380 -1.380 4.431 1.00 0.00 H new ATOM 0 HA ASP A 20 7.294 -3.852 5.766 1.00 0.00 H new ATOM 0 HB2 ASP A 20 8.533 -1.451 4.474 1.00 0.00 H new ATOM 0 HB3 ASP A 20 9.439 -2.416 5.623 1.00 0.00 H new ATOM 165 N PRO A 21 7.707 -2.763 8.134 1.00 0.00 N ATOM 166 CA PRO A 21 7.489 -2.411 9.549 1.00 0.00 C ATOM 167 C PRO A 21 7.916 -0.971 9.905 1.00 0.00 C ATOM 168 O PRO A 21 7.216 0.009 9.627 1.00 0.00 O ATOM 169 CB PRO A 21 8.264 -3.506 10.320 1.00 0.00 C ATOM 170 CG PRO A 21 9.414 -3.806 9.352 1.00 0.00 C ATOM 171 CD PRO A 21 8.626 -3.889 8.057 1.00 0.00 C ATOM 0 HA PRO A 21 6.432 -2.396 9.813 1.00 0.00 H new ATOM 0 HB2 PRO A 21 8.623 -3.151 11.286 1.00 0.00 H new ATOM 0 HB3 PRO A 21 7.649 -4.385 10.512 1.00 0.00 H new ATOM 0 HG2 PRO A 21 10.166 -3.017 9.336 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.931 -4.736 9.589 1.00 0.00 H new ATOM 0 HD2 PRO A 21 9.278 -3.814 7.187 1.00 0.00 H new ATOM 0 HD3 PRO A 21 8.092 -4.836 7.974 1.00 0.00 H new ATOM 179 N THR A 22 9.104 -0.839 10.493 1.00 0.00 N ATOM 180 CA THR A 22 9.812 0.414 10.731 1.00 0.00 C ATOM 181 C THR A 22 9.828 1.302 9.506 1.00 0.00 C ATOM 182 O THR A 22 9.742 2.514 9.660 1.00 0.00 O ATOM 183 CB THR A 22 11.257 0.112 11.098 1.00 0.00 C ATOM 184 OG1 THR A 22 11.783 -0.796 10.160 1.00 0.00 O ATOM 185 CG2 THR A 22 11.372 -0.489 12.486 1.00 0.00 C ATOM 0 H THR A 22 9.625 -1.647 10.834 1.00 0.00 H new ATOM 0 HA THR A 22 9.289 0.932 11.535 1.00 0.00 H new ATOM 0 HB THR A 22 11.813 1.049 11.090 1.00 0.00 H new ATOM 0 HG1 THR A 22 12.709 -1.012 10.397 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.420 -0.690 12.710 1.00 0.00 H new ATOM 0 HG22 THR A 22 10.972 0.211 13.220 1.00 0.00 H new ATOM 0 HG23 THR A 22 10.807 -1.420 12.527 1.00 0.00 H new ATOM 193 N ARG A 23 9.948 0.743 8.297 1.00 0.00 N ATOM 194 CA ARG A 23 10.087 1.533 7.071 1.00 0.00 C ATOM 195 C ARG A 23 8.812 2.358 6.782 1.00 0.00 C ATOM 196 O ARG A 23 8.925 3.536 6.442 1.00 0.00 O ATOM 197 CB ARG A 23 10.596 0.629 5.928 1.00 0.00 C ATOM 198 CG ARG A 23 11.467 1.412 4.931 1.00 0.00 C ATOM 199 CD ARG A 23 12.456 0.577 4.092 1.00 0.00 C ATOM 200 NE ARG A 23 11.859 -0.534 3.314 1.00 0.00 N ATOM 201 CZ ARG A 23 12.479 -1.216 2.348 1.00 0.00 C ATOM 202 NH1 ARG A 23 13.696 -0.925 1.936 1.00 0.00 N ATOM 203 NH2 ARG A 23 11.875 -2.233 1.777 1.00 0.00 N ATOM 0 H ARG A 23 9.951 -0.265 8.142 1.00 0.00 H new ATOM 0 HA ARG A 23 10.852 2.300 7.189 1.00 0.00 H new ATOM 0 HB2 ARG A 23 11.173 -0.196 6.346 1.00 0.00 H new ATOM 0 HB3 ARG A 23 9.746 0.191 5.404 1.00 0.00 H new ATOM 0 HG2 ARG A 23 10.809 1.951 4.249 1.00 0.00 H new ATOM 0 HG3 ARG A 23 12.034 2.161 5.485 1.00 0.00 H new ATOM 0 HD2 ARG A 23 12.972 1.244 3.401 1.00 0.00 H new ATOM 0 HD3 ARG A 23 13.212 0.164 4.760 1.00 0.00 H new ATOM 0 HE ARG A 23 10.899 -0.799 3.534 1.00 0.00 H new ATOM 0 HH11 ARG A 23 14.206 -0.149 2.359 1.00 0.00 H new ATOM 0 HH12 ARG A 23 14.129 -1.475 1.194 1.00 0.00 H new ATOM 0 HH21 ARG A 23 10.936 -2.499 2.072 1.00 0.00 H new ATOM 0 HH22 ARG A 23 12.345 -2.756 1.039 1.00 0.00 H new ATOM 217 N CYS A 24 7.610 1.827 7.059 1.00 0.00 N ATOM 218 CA CYS A 24 6.365 2.611 7.088 1.00 0.00 C ATOM 219 C CYS A 24 6.378 3.606 8.260 1.00 0.00 C ATOM 220 O CYS A 24 6.087 4.793 8.082 1.00 0.00 O ATOM 221 CB CYS A 24 5.185 1.638 7.220 1.00 0.00 C ATOM 222 SG CYS A 24 3.615 2.556 7.218 1.00 0.00 S ATOM 0 H CYS A 24 7.474 0.838 7.270 1.00 0.00 H new ATOM 0 HA CYS A 24 6.270 3.188 6.168 1.00 0.00 H new ATOM 0 HB2 CYS A 24 5.199 0.924 6.397 1.00 0.00 H new ATOM 0 HB3 CYS A 24 5.278 1.064 8.142 1.00 0.00 H new ATOM 0 HG CYS A 24 2.921 2.226 6.170 1.00 0.00 H new ATOM 228 N ARG A 25 6.790 3.152 9.452 1.00 0.00 N ATOM 229 CA ARG A 25 6.889 4.002 10.640 1.00 0.00 C ATOM 230 C ARG A 25 7.741 5.256 10.397 1.00 0.00 C ATOM 231 O ARG A 25 7.302 6.346 10.732 1.00 0.00 O ATOM 232 CB ARG A 25 7.345 3.183 11.859 1.00 0.00 C ATOM 233 CG ARG A 25 6.434 3.394 13.083 1.00 0.00 C ATOM 234 CD ARG A 25 5.135 2.578 13.011 1.00 0.00 C ATOM 235 NE ARG A 25 4.146 3.097 12.048 1.00 0.00 N ATOM 236 CZ ARG A 25 3.179 2.370 11.491 1.00 0.00 C ATOM 237 NH1 ARG A 25 2.948 1.122 11.826 1.00 0.00 N ATOM 238 NH2 ARG A 25 2.404 2.889 10.566 1.00 0.00 N ATOM 0 H ARG A 25 7.064 2.183 9.617 1.00 0.00 H new ATOM 0 HA ARG A 25 5.891 4.379 10.865 1.00 0.00 H new ATOM 0 HB2 ARG A 25 7.358 2.125 11.598 1.00 0.00 H new ATOM 0 HB3 ARG A 25 8.367 3.460 12.118 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.979 3.120 13.986 1.00 0.00 H new ATOM 0 HG3 ARG A 25 6.188 4.452 13.168 1.00 0.00 H new ATOM 0 HD2 ARG A 25 5.380 1.550 12.744 1.00 0.00 H new ATOM 0 HD3 ARG A 25 4.681 2.551 14.002 1.00 0.00 H new ATOM 0 HE ARG A 25 4.207 4.082 11.790 1.00 0.00 H new ATOM 0 HH11 ARG A 25 3.521 0.671 12.540 1.00 0.00 H new ATOM 0 HH12 ARG A 25 2.196 0.603 11.373 1.00 0.00 H new ATOM 0 HH21 ARG A 25 2.541 3.855 10.269 1.00 0.00 H new ATOM 0 HH22 ARG A 25 1.666 2.326 10.144 1.00 0.00 H new ATOM 252 N ILE A 26 8.887 5.144 9.720 1.00 0.00 N ATOM 253 CA ILE A 26 9.721 6.268 9.249 1.00 0.00 C ATOM 254 C ILE A 26 8.921 7.235 8.377 1.00 0.00 C ATOM 255 O ILE A 26 8.972 8.429 8.621 1.00 0.00 O ATOM 256 CB ILE A 26 10.940 5.756 8.449 1.00 0.00 C ATOM 257 CG1 ILE A 26 11.882 4.867 9.282 1.00 0.00 C ATOM 258 CG2 ILE A 26 11.733 6.893 7.786 1.00 0.00 C ATOM 259 CD1 ILE A 26 12.977 5.515 10.131 1.00 0.00 C ATOM 0 H ILE A 26 9.280 4.236 9.472 1.00 0.00 H new ATOM 0 HA ILE A 26 10.066 6.798 10.136 1.00 0.00 H new ATOM 0 HB ILE A 26 10.514 5.135 7.661 1.00 0.00 H new ATOM 0 HG12 ILE A 26 11.261 4.270 9.950 1.00 0.00 H new ATOM 0 HG13 ILE A 26 12.369 4.174 8.595 1.00 0.00 H new ATOM 0 HG21 ILE A 26 12.578 6.476 7.238 1.00 0.00 H new ATOM 0 HG22 ILE A 26 11.085 7.435 7.097 1.00 0.00 H new ATOM 0 HG23 ILE A 26 12.100 7.576 8.552 1.00 0.00 H new ATOM 0 HD11 ILE A 26 13.543 4.740 10.648 1.00 0.00 H new ATOM 0 HD12 ILE A 26 13.647 6.085 9.487 1.00 0.00 H new ATOM 0 HD13 ILE A 26 12.523 6.182 10.863 1.00 0.00 H new ATOM 271 N LEU A 27 8.199 6.751 7.361 1.00 0.00 N ATOM 272 CA LEU A 27 7.440 7.612 6.449 1.00 0.00 C ATOM 273 C LEU A 27 6.355 8.413 7.183 1.00 0.00 C ATOM 274 O LEU A 27 6.198 9.597 6.905 1.00 0.00 O ATOM 275 CB LEU A 27 6.834 6.762 5.316 1.00 0.00 C ATOM 276 CG LEU A 27 7.827 6.206 4.283 1.00 0.00 C ATOM 277 CD1 LEU A 27 7.108 5.232 3.344 1.00 0.00 C ATOM 278 CD2 LEU A 27 8.434 7.336 3.441 1.00 0.00 C ATOM 0 H LEU A 27 8.125 5.756 7.149 1.00 0.00 H new ATOM 0 HA LEU A 27 8.127 8.341 6.019 1.00 0.00 H new ATOM 0 HB2 LEU A 27 6.300 5.924 5.764 1.00 0.00 H new ATOM 0 HB3 LEU A 27 6.095 7.367 4.791 1.00 0.00 H new ATOM 0 HG LEU A 27 8.623 5.695 4.824 1.00 0.00 H new ATOM 0 HD11 LEU A 27 7.816 4.841 2.614 1.00 0.00 H new ATOM 0 HD12 LEU A 27 6.692 4.408 3.924 1.00 0.00 H new ATOM 0 HD13 LEU A 27 6.303 5.753 2.826 1.00 0.00 H new ATOM 0 HD21 LEU A 27 9.133 6.916 2.718 1.00 0.00 H new ATOM 0 HD22 LEU A 27 7.639 7.864 2.913 1.00 0.00 H new ATOM 0 HD23 LEU A 27 8.961 8.033 4.093 1.00 0.00 H new ATOM 290 N VAL A 28 5.647 7.803 8.137 1.00 0.00 N ATOM 291 CA VAL A 28 4.570 8.480 8.894 1.00 0.00 C ATOM 292 C VAL A 28 5.107 9.359 10.038 1.00 0.00 C ATOM 293 O VAL A 28 4.559 10.419 10.313 1.00 0.00 O ATOM 294 CB VAL A 28 3.492 7.480 9.371 1.00 0.00 C ATOM 295 CG1 VAL A 28 3.953 6.517 10.472 1.00 0.00 C ATOM 296 CG2 VAL A 28 2.196 8.176 9.805 1.00 0.00 C ATOM 0 H VAL A 28 5.796 6.832 8.412 1.00 0.00 H new ATOM 0 HA VAL A 28 4.083 9.165 8.200 1.00 0.00 H new ATOM 0 HB VAL A 28 3.296 6.875 8.485 1.00 0.00 H new ATOM 0 HG11 VAL A 28 3.131 5.854 10.743 1.00 0.00 H new ATOM 0 HG12 VAL A 28 4.793 5.925 10.109 1.00 0.00 H new ATOM 0 HG13 VAL A 28 4.263 7.087 11.348 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.473 7.428 10.131 1.00 0.00 H new ATOM 0 HG22 VAL A 28 2.408 8.859 10.628 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.785 8.736 8.965 1.00 0.00 H new ATOM 306 N ALA A 29 6.224 8.966 10.660 1.00 0.00 N ATOM 307 CA ALA A 29 6.919 9.768 11.662 1.00 0.00 C ATOM 308 C ALA A 29 7.683 10.949 11.044 1.00 0.00 C ATOM 309 O ALA A 29 7.825 11.984 11.689 1.00 0.00 O ATOM 310 CB ALA A 29 7.842 8.830 12.443 1.00 0.00 C ATOM 0 H ALA A 29 6.673 8.069 10.476 1.00 0.00 H new ATOM 0 HA ALA A 29 6.193 10.226 12.334 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.379 9.398 13.203 1.00 0.00 H new ATOM 0 HB2 ALA A 29 7.248 8.052 12.923 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.557 8.371 11.760 1.00 0.00 H new ATOM 316 N LEU A 30 8.139 10.854 9.789 1.00 0.00 N ATOM 317 CA LEU A 30 8.668 11.988 9.082 1.00 0.00 C ATOM 318 C LEU A 30 7.593 13.029 8.809 1.00 0.00 C ATOM 319 O LEU A 30 7.919 14.203 8.940 1.00 0.00 O ATOM 320 CB LEU A 30 9.281 11.483 7.792 1.00 0.00 C ATOM 321 CG LEU A 30 10.174 12.527 7.125 1.00 0.00 C ATOM 322 CD1 LEU A 30 11.292 13.074 8.028 1.00 0.00 C ATOM 323 CD2 LEU A 30 10.783 11.768 5.970 1.00 0.00 C ATOM 0 H LEU A 30 8.145 9.987 9.252 1.00 0.00 H new ATOM 0 HA LEU A 30 9.425 12.483 9.691 1.00 0.00 H new ATOM 0 HB2 LEU A 30 9.866 10.586 7.997 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.487 11.195 7.104 1.00 0.00 H new ATOM 0 HG LEU A 30 9.595 13.408 6.850 1.00 0.00 H new ATOM 0 HD11 LEU A 30 11.878 13.809 7.477 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.852 13.546 8.906 1.00 0.00 H new ATOM 0 HD13 LEU A 30 11.939 12.255 8.342 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.450 12.426 5.414 1.00 0.00 H new ATOM 0 HD22 LEU A 30 11.347 10.917 6.351 1.00 0.00 H new ATOM 0 HD23 LEU A 30 9.991 11.412 5.311 1.00 0.00 H new ATOM 335 N LEU A 31 6.369 12.604 8.458 1.00 0.00 N ATOM 336 CA LEU A 31 5.179 13.435 8.250 1.00 0.00 C ATOM 337 C LEU A 31 5.015 14.427 9.418 1.00 0.00 C ATOM 338 O LEU A 31 5.203 15.627 9.232 1.00 0.00 O ATOM 339 CB LEU A 31 3.985 12.460 8.086 1.00 0.00 C ATOM 340 CG LEU A 31 3.030 12.679 6.902 1.00 0.00 C ATOM 341 CD1 LEU A 31 2.073 11.484 6.877 1.00 0.00 C ATOM 342 CD2 LEU A 31 2.270 14.006 7.003 1.00 0.00 C ATOM 0 H LEU A 31 6.175 11.615 8.304 1.00 0.00 H new ATOM 0 HA LEU A 31 5.252 14.056 7.357 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.387 11.450 8.008 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.395 12.498 9.002 1.00 0.00 H new ATOM 0 HG LEU A 31 3.596 12.744 5.973 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.373 11.596 6.049 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.643 10.564 6.748 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.521 11.440 7.816 1.00 0.00 H new ATOM 0 HD21 LEU A 31 1.609 14.113 6.143 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.679 14.018 7.919 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.981 14.832 7.019 1.00 0.00 H new ATOM 354 N ASP A 32 4.821 13.887 10.624 1.00 0.00 N ATOM 355 CA ASP A 32 4.747 14.607 11.907 1.00 0.00 C ATOM 356 C ASP A 32 6.143 14.905 12.518 1.00 0.00 C ATOM 357 O ASP A 32 6.320 15.002 13.734 1.00 0.00 O ATOM 358 CB ASP A 32 3.841 13.806 12.866 1.00 0.00 C ATOM 359 CG ASP A 32 2.387 13.676 12.384 1.00 0.00 C ATOM 360 OD1 ASP A 32 1.855 14.673 11.842 1.00 0.00 O ATOM 361 OD2 ASP A 32 1.801 12.591 12.601 1.00 0.00 O ATOM 0 H ASP A 32 4.704 12.881 10.743 1.00 0.00 H new ATOM 0 HA ASP A 32 4.310 15.590 11.734 1.00 0.00 H new ATOM 0 HB2 ASP A 32 4.260 12.809 12.999 1.00 0.00 H new ATOM 0 HB3 ASP A 32 3.848 14.287 13.844 1.00 0.00 H new ATOM 366 N GLY A 33 7.171 15.001 11.668 1.00 0.00 N ATOM 367 CA GLY A 33 8.570 15.229 12.038 1.00 0.00 C ATOM 368 C GLY A 33 9.234 16.308 11.193 1.00 0.00 C ATOM 369 O GLY A 33 9.339 17.459 11.605 1.00 0.00 O ATOM 0 H GLY A 33 7.044 14.918 10.659 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.622 15.513 13.089 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.126 14.297 11.932 1.00 0.00 H new ATOM 373 N VAL A 34 9.784 15.897 10.049 1.00 0.00 N ATOM 374 CA VAL A 34 10.645 16.676 9.135 1.00 0.00 C ATOM 375 C VAL A 34 11.664 17.593 9.840 1.00 0.00 C ATOM 376 O VAL A 34 11.886 18.722 9.409 1.00 0.00 O ATOM 377 CB VAL A 34 9.829 17.398 8.030 1.00 0.00 C ATOM 378 CG1 VAL A 34 9.140 16.423 7.072 1.00 0.00 C ATOM 379 CG2 VAL A 34 8.750 18.336 8.591 1.00 0.00 C ATOM 0 H VAL A 34 9.634 14.948 9.707 1.00 0.00 H new ATOM 0 HA VAL A 34 11.266 15.936 8.630 1.00 0.00 H new ATOM 0 HB VAL A 34 10.575 17.983 7.493 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.584 16.983 6.320 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.891 15.803 6.581 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.454 15.787 7.631 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.216 18.810 7.767 1.00 0.00 H new ATOM 0 HG22 VAL A 34 8.048 17.762 9.197 1.00 0.00 H new ATOM 0 HG23 VAL A 34 9.219 19.103 9.208 1.00 0.00 H new ATOM 389 N CYS A 35 12.302 17.110 10.919 1.00 0.00 N ATOM 390 CA CYS A 35 13.255 17.900 11.709 1.00 0.00 C ATOM 391 C CYS A 35 14.701 17.757 11.212 1.00 0.00 C ATOM 392 O CYS A 35 15.269 18.697 10.676 1.00 0.00 O ATOM 393 CB CYS A 35 13.124 17.581 13.219 1.00 0.00 C ATOM 394 SG CYS A 35 11.489 16.979 13.732 1.00 0.00 S ATOM 0 H CYS A 35 12.170 16.160 11.266 1.00 0.00 H new ATOM 0 HA CYS A 35 12.994 18.949 11.567 1.00 0.00 H new ATOM 0 HB2 CYS A 35 13.871 16.832 13.484 1.00 0.00 H new ATOM 0 HB3 CYS A 35 13.359 18.481 13.788 1.00 0.00 H new ATOM 0 HG CYS A 35 11.538 15.693 13.914 1.00 0.00 H new ATOM 400 N TYR A 36 15.295 16.568 11.372 1.00 0.00 N ATOM 401 CA TYR A 36 16.732 16.335 11.137 1.00 0.00 C ATOM 402 C TYR A 36 17.076 14.852 10.891 1.00 0.00 C ATOM 403 O TYR A 36 16.310 13.979 11.316 1.00 0.00 O ATOM 404 CB TYR A 36 17.572 16.950 12.282 1.00 0.00 C ATOM 405 CG TYR A 36 17.148 16.647 13.705 1.00 0.00 C ATOM 406 CD1 TYR A 36 16.245 17.511 14.352 1.00 0.00 C ATOM 407 CD2 TYR A 36 17.680 15.542 14.399 1.00 0.00 C ATOM 408 CE1 TYR A 36 15.827 17.244 15.668 1.00 0.00 C ATOM 409 CE2 TYR A 36 17.284 15.280 15.726 1.00 0.00 C ATOM 410 CZ TYR A 36 16.345 16.128 16.361 1.00 0.00 C ATOM 411 OH TYR A 36 15.945 15.888 17.639 1.00 0.00 O ATOM 0 H TYR A 36 14.792 15.732 11.670 1.00 0.00 H new ATOM 0 HA TYR A 36 16.994 16.844 10.210 1.00 0.00 H new ATOM 0 HB2 TYR A 36 18.602 16.615 12.160 1.00 0.00 H new ATOM 0 HB3 TYR A 36 17.572 18.033 12.155 1.00 0.00 H new ATOM 0 HD1 TYR A 36 15.871 18.383 13.836 1.00 0.00 H new ATOM 0 HD2 TYR A 36 18.394 14.894 13.912 1.00 0.00 H new ATOM 0 HE1 TYR A 36 15.110 17.893 16.149 1.00 0.00 H new ATOM 0 HE2 TYR A 36 17.696 14.435 16.257 1.00 0.00 H new ATOM 0 HH TYR A 36 16.391 15.083 17.976 1.00 0.00 H new ATOM 421 N PRO A 37 18.212 14.530 10.234 1.00 0.00 N ATOM 422 CA PRO A 37 18.689 13.157 10.123 1.00 0.00 C ATOM 423 C PRO A 37 18.859 12.568 11.521 1.00 0.00 C ATOM 424 O PRO A 37 19.444 13.201 12.397 1.00 0.00 O ATOM 425 CB PRO A 37 20.009 13.223 9.343 1.00 0.00 C ATOM 426 CG PRO A 37 20.487 14.656 9.558 1.00 0.00 C ATOM 427 CD PRO A 37 19.174 15.433 9.618 1.00 0.00 C ATOM 0 HA PRO A 37 17.989 12.507 9.598 1.00 0.00 H new ATOM 0 HB2 PRO A 37 20.732 12.499 9.719 1.00 0.00 H new ATOM 0 HB3 PRO A 37 19.860 13.005 8.285 1.00 0.00 H new ATOM 0 HG2 PRO A 37 21.062 14.759 10.478 1.00 0.00 H new ATOM 0 HG3 PRO A 37 21.125 14.998 8.743 1.00 0.00 H new ATOM 0 HD2 PRO A 37 19.285 16.346 10.203 1.00 0.00 H new ATOM 0 HD3 PRO A 37 18.849 15.731 8.621 1.00 0.00 H new ATOM 435 N GLY A 38 18.278 11.387 11.750 1.00 0.00 N ATOM 436 CA GLY A 38 18.274 10.759 13.071 1.00 0.00 C ATOM 437 C GLY A 38 17.224 11.311 14.043 1.00 0.00 C ATOM 438 O GLY A 38 17.125 10.775 15.140 1.00 0.00 O ATOM 0 H GLY A 38 17.801 10.844 11.030 1.00 0.00 H new ATOM 0 HA2 GLY A 38 18.108 9.689 12.948 1.00 0.00 H new ATOM 0 HA3 GLY A 38 19.261 10.879 13.518 1.00 0.00 H new ATOM 442 N GLN A 39 16.400 12.306 13.669 1.00 0.00 N ATOM 443 CA GLN A 39 15.252 12.731 14.496 1.00 0.00 C ATOM 444 C GLN A 39 14.283 11.568 14.724 1.00 0.00 C ATOM 445 O GLN A 39 13.777 11.404 15.828 1.00 0.00 O ATOM 446 CB GLN A 39 14.514 13.956 13.922 1.00 0.00 C ATOM 447 CG GLN A 39 13.551 13.708 12.743 1.00 0.00 C ATOM 448 CD GLN A 39 12.132 13.234 13.079 1.00 0.00 C ATOM 449 OE1 GLN A 39 11.524 13.614 14.179 1.00 0.00 O flip ATOM 450 NE2 GLN A 39 11.525 12.520 12.305 1.00 0.00 N flip ATOM 0 H GLN A 39 16.506 12.831 12.801 1.00 0.00 H new ATOM 0 HA GLN A 39 15.663 13.041 15.457 1.00 0.00 H new ATOM 0 HB2 GLN A 39 13.947 14.419 14.730 1.00 0.00 H new ATOM 0 HB3 GLN A 39 15.262 14.681 13.601 1.00 0.00 H new ATOM 0 HG2 GLN A 39 13.471 14.634 12.173 1.00 0.00 H new ATOM 0 HG3 GLN A 39 14.007 12.967 12.086 1.00 0.00 H new ATOM 0 HE21 GLN A 39 11.971 12.208 11.442 1.00 0.00 H new ATOM 0 HE22 GLN A 39 10.570 12.232 12.518 1.00 0.00 H new ATOM 459 N LEU A 40 14.085 10.728 13.698 1.00 0.00 N ATOM 460 CA LEU A 40 13.183 9.573 13.731 1.00 0.00 C ATOM 461 C LEU A 40 13.588 8.554 14.804 1.00 0.00 C ATOM 462 O LEU A 40 12.766 7.734 15.186 1.00 0.00 O ATOM 463 CB LEU A 40 13.124 8.885 12.353 1.00 0.00 C ATOM 464 CG LEU A 40 12.792 9.815 11.167 1.00 0.00 C ATOM 465 CD1 LEU A 40 13.680 9.491 9.963 1.00 0.00 C ATOM 466 CD2 LEU A 40 11.307 9.733 10.805 1.00 0.00 C ATOM 0 H LEU A 40 14.560 10.837 12.802 1.00 0.00 H new ATOM 0 HA LEU A 40 12.194 9.953 13.986 1.00 0.00 H new ATOM 0 HB2 LEU A 40 14.085 8.408 12.162 1.00 0.00 H new ATOM 0 HB3 LEU A 40 12.377 8.092 12.392 1.00 0.00 H new ATOM 0 HG LEU A 40 12.999 10.842 11.468 1.00 0.00 H new ATOM 0 HD11 LEU A 40 13.431 10.157 9.137 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.727 9.627 10.236 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.516 8.458 9.658 1.00 0.00 H new ATOM 0 HD21 LEU A 40 11.100 10.398 9.966 1.00 0.00 H new ATOM 0 HD22 LEU A 40 11.056 8.709 10.527 1.00 0.00 H new ATOM 0 HD23 LEU A 40 10.706 10.033 11.663 1.00 0.00 H new ATOM 478 N ALA A 41 14.827 8.607 15.305 1.00 0.00 N ATOM 479 CA ALA A 41 15.270 7.760 16.416 1.00 0.00 C ATOM 480 C ALA A 41 14.478 8.065 17.704 1.00 0.00 C ATOM 481 O ALA A 41 14.219 7.159 18.488 1.00 0.00 O ATOM 482 CB ALA A 41 16.775 7.965 16.620 1.00 0.00 C ATOM 0 H ALA A 41 15.548 9.236 14.953 1.00 0.00 H new ATOM 0 HA ALA A 41 15.079 6.714 16.174 1.00 0.00 H new ATOM 0 HB1 ALA A 41 17.119 7.340 17.444 1.00 0.00 H new ATOM 0 HB2 ALA A 41 17.307 7.689 15.709 1.00 0.00 H new ATOM 0 HB3 ALA A 41 16.972 9.012 16.852 1.00 0.00 H new ATOM 488 N ALA A 42 14.052 9.321 17.896 1.00 0.00 N ATOM 489 CA ALA A 42 13.173 9.714 18.996 1.00 0.00 C ATOM 490 C ALA A 42 11.737 9.240 18.749 1.00 0.00 C ATOM 491 O ALA A 42 11.169 8.580 19.610 1.00 0.00 O ATOM 492 CB ALA A 42 13.255 11.236 19.182 1.00 0.00 C ATOM 0 H ALA A 42 14.312 10.096 17.285 1.00 0.00 H new ATOM 0 HA ALA A 42 13.502 9.234 19.918 1.00 0.00 H new ATOM 0 HB1 ALA A 42 12.602 11.538 20.001 1.00 0.00 H new ATOM 0 HB2 ALA A 42 14.282 11.520 19.413 1.00 0.00 H new ATOM 0 HB3 ALA A 42 12.939 11.732 18.264 1.00 0.00 H new ATOM 498 N HIS A 43 11.169 9.517 17.571 1.00 0.00 N ATOM 499 CA HIS A 43 9.812 9.074 17.218 1.00 0.00 C ATOM 500 C HIS A 43 9.606 7.546 17.284 1.00 0.00 C ATOM 501 O HIS A 43 8.516 7.082 17.621 1.00 0.00 O ATOM 502 CB HIS A 43 9.504 9.527 15.787 1.00 0.00 C ATOM 503 CG HIS A 43 9.099 10.962 15.604 1.00 0.00 C ATOM 504 ND1 HIS A 43 9.132 11.600 14.401 1.00 0.00 N flip ATOM 505 CD2 HIS A 43 8.315 11.701 16.488 1.00 0.00 C flip ATOM 506 CE1 HIS A 43 8.334 12.718 14.527 1.00 0.00 C flip ATOM 507 NE2 HIS A 43 7.871 12.756 15.786 1.00 0.00 N flip ATOM 0 H HIS A 43 11.633 10.052 16.837 1.00 0.00 H new ATOM 0 HA HIS A 43 9.145 9.520 17.956 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.387 9.342 15.175 1.00 0.00 H new ATOM 0 HB3 HIS A 43 8.706 8.896 15.395 1.00 0.00 H new ATOM 0 HD2 HIS A 43 8.108 11.473 17.523 1.00 0.00 H new ATOM 0 HE1 HIS A 43 8.120 13.436 13.749 1.00 0.00 H new ATOM 0 HE2 HIS A 43 7.265 13.487 16.159 1.00 0.00 H new ATOM 515 N LEU A 44 10.623 6.770 16.885 1.00 0.00 N ATOM 516 CA LEU A 44 10.539 5.310 16.772 1.00 0.00 C ATOM 517 C LEU A 44 11.120 4.576 17.986 1.00 0.00 C ATOM 518 O LEU A 44 10.782 3.417 18.191 1.00 0.00 O ATOM 519 CB LEU A 44 11.226 4.839 15.466 1.00 0.00 C ATOM 520 CG LEU A 44 10.679 5.461 14.161 1.00 0.00 C ATOM 521 CD1 LEU A 44 11.171 4.719 12.925 1.00 0.00 C ATOM 522 CD2 LEU A 44 9.146 5.540 14.094 1.00 0.00 C ATOM 0 H LEU A 44 11.537 7.144 16.629 1.00 0.00 H new ATOM 0 HA LEU A 44 9.480 5.054 16.741 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.290 5.063 15.536 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.132 3.755 15.398 1.00 0.00 H new ATOM 0 HG LEU A 44 11.069 6.479 14.174 1.00 0.00 H new ATOM 0 HD11 LEU A 44 10.762 5.190 12.031 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.260 4.755 12.888 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.844 3.680 12.970 1.00 0.00 H new ATOM 0 HD21 LEU A 44 8.846 5.988 13.147 1.00 0.00 H new ATOM 0 HD22 LEU A 44 8.726 4.537 14.170 1.00 0.00 H new ATOM 0 HD23 LEU A 44 8.777 6.151 14.918 1.00 0.00 H new ATOM 534 N GLY A 45 12.023 5.191 18.760 1.00 0.00 N ATOM 535 CA GLY A 45 12.785 4.506 19.815 1.00 0.00 C ATOM 536 C GLY A 45 13.896 3.590 19.285 1.00 0.00 C ATOM 537 O GLY A 45 14.518 2.866 20.062 1.00 0.00 O ATOM 0 H GLY A 45 12.248 6.182 18.673 1.00 0.00 H new ATOM 0 HA2 GLY A 45 13.227 5.253 20.474 1.00 0.00 H new ATOM 0 HA3 GLY A 45 12.098 3.915 20.420 1.00 0.00 H new ATOM 541 N LEU A 46 14.151 3.602 17.971 1.00 0.00 N ATOM 542 CA LEU A 46 15.182 2.783 17.330 1.00 0.00 C ATOM 543 C LEU A 46 16.475 3.572 17.125 1.00 0.00 C ATOM 544 O LEU A 46 16.459 4.796 16.997 1.00 0.00 O ATOM 545 CB LEU A 46 14.659 2.231 15.998 1.00 0.00 C ATOM 546 CG LEU A 46 13.884 0.910 16.158 1.00 0.00 C ATOM 547 CD1 LEU A 46 12.577 1.022 16.950 1.00 0.00 C ATOM 548 CD2 LEU A 46 13.567 0.415 14.755 1.00 0.00 C ATOM 0 H LEU A 46 13.638 4.191 17.315 1.00 0.00 H new ATOM 0 HA LEU A 46 15.415 1.947 17.990 1.00 0.00 H new ATOM 0 HB2 LEU A 46 14.010 2.973 15.533 1.00 0.00 H new ATOM 0 HB3 LEU A 46 15.499 2.074 15.321 1.00 0.00 H new ATOM 0 HG LEU A 46 14.512 0.228 16.731 1.00 0.00 H new ATOM 0 HD11 LEU A 46 12.103 0.042 17.010 1.00 0.00 H new ATOM 0 HD12 LEU A 46 12.791 1.384 17.956 1.00 0.00 H new ATOM 0 HD13 LEU A 46 11.906 1.720 16.449 1.00 0.00 H new ATOM 0 HD21 LEU A 46 13.016 -0.523 14.816 1.00 0.00 H new ATOM 0 HD22 LEU A 46 12.962 1.158 14.235 1.00 0.00 H new ATOM 0 HD23 LEU A 46 14.496 0.255 14.207 1.00 0.00 H new ATOM 560 N THR A 47 17.601 2.851 17.038 1.00 0.00 N ATOM 561 CA THR A 47 18.930 3.459 16.856 1.00 0.00 C ATOM 562 C THR A 47 18.994 4.305 15.590 1.00 0.00 C ATOM 563 O THR A 47 18.441 3.938 14.547 1.00 0.00 O ATOM 564 CB THR A 47 20.060 2.420 16.928 1.00 0.00 C ATOM 565 OG1 THR A 47 21.260 2.989 16.464 1.00 0.00 O ATOM 566 CG2 THR A 47 19.826 1.153 16.111 1.00 0.00 C ATOM 0 H THR A 47 17.619 1.833 17.091 1.00 0.00 H new ATOM 0 HA THR A 47 19.089 4.137 17.695 1.00 0.00 H new ATOM 0 HB THR A 47 20.101 2.132 17.978 1.00 0.00 H new ATOM 0 HG1 THR A 47 21.978 2.324 16.513 1.00 0.00 H new ATOM 0 HG21 THR A 47 20.678 0.483 16.227 1.00 0.00 H new ATOM 0 HG22 THR A 47 18.922 0.655 16.463 1.00 0.00 H new ATOM 0 HG23 THR A 47 19.710 1.415 15.059 1.00 0.00 H new ATOM 574 N ARG A 48 19.753 5.405 15.668 1.00 0.00 N ATOM 575 CA ARG A 48 20.102 6.275 14.532 1.00 0.00 C ATOM 576 C ARG A 48 20.769 5.487 13.386 1.00 0.00 C ATOM 577 O ARG A 48 20.679 5.884 12.221 1.00 0.00 O ATOM 578 CB ARG A 48 21.025 7.416 15.011 1.00 0.00 C ATOM 579 CG ARG A 48 20.381 8.293 16.102 1.00 0.00 C ATOM 580 CD ARG A 48 21.325 9.378 16.647 1.00 0.00 C ATOM 581 NE ARG A 48 21.005 9.660 18.062 1.00 0.00 N ATOM 582 CZ ARG A 48 21.720 9.234 19.098 1.00 0.00 C ATOM 583 NH1 ARG A 48 23.005 8.968 19.012 1.00 0.00 N ATOM 584 NH2 ARG A 48 21.131 9.017 20.250 1.00 0.00 N ATOM 0 H ARG A 48 20.155 5.726 16.549 1.00 0.00 H new ATOM 0 HA ARG A 48 19.178 6.697 14.138 1.00 0.00 H new ATOM 0 HB2 ARG A 48 21.951 6.989 15.395 1.00 0.00 H new ATOM 0 HB3 ARG A 48 21.292 8.042 14.160 1.00 0.00 H new ATOM 0 HG2 ARG A 48 19.488 8.769 15.696 1.00 0.00 H new ATOM 0 HG3 ARG A 48 20.057 7.657 16.925 1.00 0.00 H new ATOM 0 HD2 ARG A 48 22.360 9.049 16.558 1.00 0.00 H new ATOM 0 HD3 ARG A 48 21.227 10.288 16.055 1.00 0.00 H new ATOM 0 HE ARG A 48 20.176 10.222 18.257 1.00 0.00 H new ATOM 0 HH11 ARG A 48 23.492 9.087 18.124 1.00 0.00 H new ATOM 0 HH12 ARG A 48 23.515 8.643 19.834 1.00 0.00 H new ATOM 0 HH21 ARG A 48 20.128 9.175 20.348 1.00 0.00 H new ATOM 0 HH22 ARG A 48 21.676 8.690 21.048 1.00 0.00 H new ATOM 598 N SER A 49 21.386 4.344 13.694 1.00 0.00 N ATOM 599 CA SER A 49 21.907 3.377 12.720 1.00 0.00 C ATOM 600 C SER A 49 20.770 2.740 11.903 1.00 0.00 C ATOM 601 O SER A 49 20.667 2.960 10.695 1.00 0.00 O ATOM 602 CB SER A 49 22.712 2.292 13.454 1.00 0.00 C ATOM 603 OG SER A 49 23.726 2.887 14.244 1.00 0.00 O ATOM 0 H SER A 49 21.543 4.055 14.660 1.00 0.00 H new ATOM 0 HA SER A 49 22.559 3.904 12.023 1.00 0.00 H new ATOM 0 HB2 SER A 49 22.049 1.701 14.085 1.00 0.00 H new ATOM 0 HB3 SER A 49 23.158 1.608 12.732 1.00 0.00 H new ATOM 0 HG SER A 49 24.232 2.188 14.708 1.00 0.00 H new ATOM 609 N ASN A 50 19.863 2.008 12.557 1.00 0.00 N ATOM 610 CA ASN A 50 18.747 1.340 11.885 1.00 0.00 C ATOM 611 C ASN A 50 17.767 2.359 11.289 1.00 0.00 C ATOM 612 O ASN A 50 17.306 2.173 10.166 1.00 0.00 O ATOM 613 CB ASN A 50 18.061 0.326 12.818 1.00 0.00 C ATOM 614 CG ASN A 50 18.927 -0.917 13.025 1.00 0.00 C ATOM 615 OD1 ASN A 50 20.100 -0.825 13.367 1.00 0.00 O ATOM 616 ND2 ASN A 50 18.390 -2.099 12.788 1.00 0.00 N ATOM 0 H ASN A 50 19.883 1.863 13.566 1.00 0.00 H new ATOM 0 HA ASN A 50 19.146 0.768 11.047 1.00 0.00 H new ATOM 0 HB2 ASN A 50 17.859 0.795 13.781 1.00 0.00 H new ATOM 0 HB3 ASN A 50 17.099 0.035 12.397 1.00 0.00 H new ATOM 0 HD21 ASN A 50 18.952 -2.944 12.889 1.00 0.00 H new ATOM 0 HD22 ASN A 50 17.413 -2.167 12.504 1.00 0.00 H new ATOM 623 N VAL A 51 17.511 3.496 11.944 1.00 0.00 N ATOM 624 CA VAL A 51 16.759 4.599 11.330 1.00 0.00 C ATOM 625 C VAL A 51 17.396 5.110 10.028 1.00 0.00 C ATOM 626 O VAL A 51 16.656 5.472 9.119 1.00 0.00 O ATOM 627 CB VAL A 51 16.566 5.743 12.360 1.00 0.00 C ATOM 628 CG1 VAL A 51 16.440 7.157 11.768 1.00 0.00 C ATOM 629 CG2 VAL A 51 15.350 5.437 13.248 1.00 0.00 C ATOM 0 H VAL A 51 17.813 3.678 12.901 1.00 0.00 H new ATOM 0 HA VAL A 51 15.782 4.210 11.044 1.00 0.00 H new ATOM 0 HB VAL A 51 17.489 5.764 12.940 1.00 0.00 H new ATOM 0 HG11 VAL A 51 16.309 7.879 12.574 1.00 0.00 H new ATOM 0 HG12 VAL A 51 17.343 7.399 11.208 1.00 0.00 H new ATOM 0 HG13 VAL A 51 15.578 7.197 11.102 1.00 0.00 H new ATOM 0 HG21 VAL A 51 15.216 6.242 13.971 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.458 5.354 12.627 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.513 4.498 13.777 1.00 0.00 H new ATOM 639 N SER A 52 18.723 5.074 9.866 1.00 0.00 N ATOM 640 CA SER A 52 19.338 5.379 8.562 1.00 0.00 C ATOM 641 C SER A 52 19.192 4.245 7.547 1.00 0.00 C ATOM 642 O SER A 52 18.944 4.534 6.381 1.00 0.00 O ATOM 643 CB SER A 52 20.821 5.701 8.673 1.00 0.00 C ATOM 644 OG SER A 52 21.035 6.788 9.557 1.00 0.00 O ATOM 0 H SER A 52 19.386 4.841 10.606 1.00 0.00 H new ATOM 0 HA SER A 52 18.790 6.254 8.213 1.00 0.00 H new ATOM 0 HB2 SER A 52 21.362 4.825 9.029 1.00 0.00 H new ATOM 0 HB3 SER A 52 21.220 5.943 7.688 1.00 0.00 H new ATOM 0 HG SER A 52 20.928 6.483 10.482 1.00 0.00 H new ATOM 650 N ASN A 53 19.284 2.983 7.982 1.00 0.00 N ATOM 651 CA ASN A 53 19.010 1.813 7.139 1.00 0.00 C ATOM 652 C ASN A 53 17.613 1.925 6.518 1.00 0.00 C ATOM 653 O ASN A 53 17.452 1.852 5.302 1.00 0.00 O ATOM 654 CB ASN A 53 19.119 0.528 7.977 1.00 0.00 C ATOM 655 CG ASN A 53 20.545 0.021 8.136 1.00 0.00 C ATOM 656 OD1 ASN A 53 20.898 -1.041 7.652 1.00 0.00 O ATOM 657 ND2 ASN A 53 21.406 0.746 8.826 1.00 0.00 N ATOM 0 H ASN A 53 19.553 2.743 8.936 1.00 0.00 H new ATOM 0 HA ASN A 53 19.746 1.774 6.336 1.00 0.00 H new ATOM 0 HB2 ASN A 53 18.696 0.712 8.965 1.00 0.00 H new ATOM 0 HB3 ASN A 53 18.515 -0.251 7.512 1.00 0.00 H new ATOM 0 HD21 ASN A 53 22.363 0.417 8.953 1.00 0.00 H new ATOM 0 HD22 ASN A 53 21.114 1.635 9.232 1.00 0.00 H new ATOM 664 N HIS A 54 16.599 2.220 7.336 1.00 0.00 N ATOM 665 CA HIS A 54 15.242 2.413 6.827 1.00 0.00 C ATOM 666 C HIS A 54 15.097 3.627 5.884 1.00 0.00 C ATOM 667 O HIS A 54 14.145 3.655 5.107 1.00 0.00 O ATOM 668 CB HIS A 54 14.272 2.557 8.002 1.00 0.00 C ATOM 669 CG HIS A 54 14.383 1.566 9.134 1.00 0.00 C ATOM 670 ND1 HIS A 54 14.517 1.898 10.465 1.00 0.00 N ATOM 671 CD2 HIS A 54 14.348 0.199 9.066 1.00 0.00 C ATOM 672 CE1 HIS A 54 14.623 0.763 11.170 1.00 0.00 C ATOM 673 NE2 HIS A 54 14.501 -0.297 10.362 1.00 0.00 N ATOM 0 H HIS A 54 16.692 2.329 8.346 1.00 0.00 H new ATOM 0 HA HIS A 54 15.006 1.531 6.232 1.00 0.00 H new ATOM 0 HB2 HIS A 54 14.398 3.556 8.419 1.00 0.00 H new ATOM 0 HB3 HIS A 54 13.258 2.501 7.607 1.00 0.00 H new ATOM 0 HD2 HIS A 54 14.224 -0.391 8.170 1.00 0.00 H new ATOM 0 HE1 HIS A 54 14.784 0.711 12.237 1.00 0.00 H new ATOM 0 HE2 HIS A 54 14.517 -1.278 10.640 1.00 0.00 H new ATOM 681 N LEU A 55 16.009 4.609 5.930 1.00 0.00 N ATOM 682 CA LEU A 55 16.055 5.750 5.014 1.00 0.00 C ATOM 683 C LEU A 55 16.878 5.511 3.745 1.00 0.00 C ATOM 684 O LEU A 55 16.728 6.308 2.825 1.00 0.00 O ATOM 685 CB LEU A 55 16.619 6.989 5.731 1.00 0.00 C ATOM 686 CG LEU A 55 15.715 7.579 6.823 1.00 0.00 C ATOM 687 CD1 LEU A 55 16.555 8.536 7.674 1.00 0.00 C ATOM 688 CD2 LEU A 55 14.547 8.333 6.181 1.00 0.00 C ATOM 0 H LEU A 55 16.754 4.629 6.626 1.00 0.00 H new ATOM 0 HA LEU A 55 15.022 5.904 4.703 1.00 0.00 H new ATOM 0 HB2 LEU A 55 17.578 6.726 6.178 1.00 0.00 H new ATOM 0 HB3 LEU A 55 16.816 7.761 4.988 1.00 0.00 H new ATOM 0 HG LEU A 55 15.308 6.783 7.447 1.00 0.00 H new ATOM 0 HD11 LEU A 55 15.932 8.968 8.458 1.00 0.00 H new ATOM 0 HD12 LEU A 55 17.382 7.989 8.127 1.00 0.00 H new ATOM 0 HD13 LEU A 55 16.949 9.333 7.043 1.00 0.00 H new ATOM 0 HD21 LEU A 55 13.910 8.749 6.961 1.00 0.00 H new ATOM 0 HD22 LEU A 55 14.933 9.141 5.559 1.00 0.00 H new ATOM 0 HD23 LEU A 55 13.966 7.647 5.565 1.00 0.00 H new ATOM 700 N SER A 56 17.781 4.532 3.662 1.00 0.00 N ATOM 701 CA SER A 56 18.581 4.294 2.443 1.00 0.00 C ATOM 702 C SER A 56 17.707 4.141 1.204 1.00 0.00 C ATOM 703 O SER A 56 17.801 4.946 0.273 1.00 0.00 O ATOM 704 CB SER A 56 19.428 3.031 2.582 1.00 0.00 C ATOM 705 OG SER A 56 20.482 3.165 3.510 1.00 0.00 O ATOM 0 H SER A 56 17.982 3.885 4.424 1.00 0.00 H new ATOM 0 HA SER A 56 19.221 5.169 2.325 1.00 0.00 H new ATOM 0 HB2 SER A 56 18.787 2.204 2.888 1.00 0.00 H new ATOM 0 HB3 SER A 56 19.842 2.770 1.608 1.00 0.00 H new ATOM 0 HG SER A 56 20.885 2.287 3.676 1.00 0.00 H new ATOM 711 N CYS A 57 16.802 3.165 1.249 1.00 0.00 N ATOM 712 CA CYS A 57 15.940 2.825 0.126 1.00 0.00 C ATOM 713 C CYS A 57 14.969 3.982 -0.173 1.00 0.00 C ATOM 714 O CYS A 57 14.821 4.455 -1.299 1.00 0.00 O ATOM 715 CB CYS A 57 15.248 1.534 0.562 1.00 0.00 C ATOM 716 SG CYS A 57 13.999 0.958 -0.637 1.00 0.00 S ATOM 0 H CYS A 57 16.648 2.585 2.074 1.00 0.00 H new ATOM 0 HA CYS A 57 16.474 2.673 -0.812 1.00 0.00 H new ATOM 0 HB2 CYS A 57 15.998 0.755 0.701 1.00 0.00 H new ATOM 0 HB3 CYS A 57 14.770 1.692 1.529 1.00 0.00 H new ATOM 721 N LEU A 58 14.391 4.504 0.909 1.00 0.00 N ATOM 722 CA LEU A 58 13.406 5.578 0.969 1.00 0.00 C ATOM 723 C LEU A 58 13.822 6.831 0.182 1.00 0.00 C ATOM 724 O LEU A 58 12.991 7.448 -0.488 1.00 0.00 O ATOM 725 CB LEU A 58 13.226 5.876 2.474 1.00 0.00 C ATOM 726 CG LEU A 58 11.779 5.775 2.967 1.00 0.00 C ATOM 727 CD1 LEU A 58 11.287 4.325 2.913 1.00 0.00 C ATOM 728 CD2 LEU A 58 11.715 6.293 4.408 1.00 0.00 C ATOM 0 H LEU A 58 14.620 4.157 1.840 1.00 0.00 H new ATOM 0 HA LEU A 58 12.473 5.272 0.495 1.00 0.00 H new ATOM 0 HB2 LEU A 58 13.842 5.182 3.046 1.00 0.00 H new ATOM 0 HB3 LEU A 58 13.599 6.879 2.681 1.00 0.00 H new ATOM 0 HG LEU A 58 11.136 6.375 2.322 1.00 0.00 H new ATOM 0 HD11 LEU A 58 10.257 4.277 3.268 1.00 0.00 H new ATOM 0 HD12 LEU A 58 11.335 3.963 1.886 1.00 0.00 H new ATOM 0 HD13 LEU A 58 11.919 3.703 3.547 1.00 0.00 H new ATOM 0 HD21 LEU A 58 10.690 6.227 4.773 1.00 0.00 H new ATOM 0 HD22 LEU A 58 12.365 5.689 5.041 1.00 0.00 H new ATOM 0 HD23 LEU A 58 12.044 7.332 4.436 1.00 0.00 H new ATOM 740 N ARG A 59 15.102 7.205 0.280 1.00 0.00 N ATOM 741 CA ARG A 59 15.660 8.398 -0.360 1.00 0.00 C ATOM 742 C ARG A 59 16.078 8.177 -1.821 1.00 0.00 C ATOM 743 O ARG A 59 16.162 9.151 -2.563 1.00 0.00 O ATOM 744 CB ARG A 59 16.831 8.910 0.479 1.00 0.00 C ATOM 745 CG ARG A 59 16.350 9.366 1.872 1.00 0.00 C ATOM 746 CD ARG A 59 17.519 9.801 2.739 1.00 0.00 C ATOM 747 NE ARG A 59 18.342 8.633 3.086 1.00 0.00 N ATOM 748 CZ ARG A 59 19.642 8.576 3.320 1.00 0.00 C ATOM 749 NH1 ARG A 59 20.380 9.666 3.359 1.00 0.00 N ATOM 750 NH2 ARG A 59 20.208 7.404 3.510 1.00 0.00 N ATOM 0 H ARG A 59 15.790 6.677 0.816 1.00 0.00 H new ATOM 0 HA ARG A 59 14.870 9.148 -0.401 1.00 0.00 H new ATOM 0 HB2 ARG A 59 17.578 8.124 0.587 1.00 0.00 H new ATOM 0 HB3 ARG A 59 17.315 9.741 -0.033 1.00 0.00 H new ATOM 0 HG2 ARG A 59 15.646 10.191 1.765 1.00 0.00 H new ATOM 0 HG3 ARG A 59 15.815 8.551 2.360 1.00 0.00 H new ATOM 0 HD2 ARG A 59 18.122 10.538 2.209 1.00 0.00 H new ATOM 0 HD3 ARG A 59 17.152 10.282 3.646 1.00 0.00 H new ATOM 0 HE ARG A 59 17.842 7.747 3.156 1.00 0.00 H new ATOM 0 HH11 ARG A 59 19.950 10.579 3.207 1.00 0.00 H new ATOM 0 HH12 ARG A 59 21.381 9.598 3.541 1.00 0.00 H new ATOM 0 HH21 ARG A 59 19.645 6.554 3.476 1.00 0.00 H new ATOM 0 HH22 ARG A 59 21.210 7.345 3.691 1.00 0.00 H new ATOM 764 N GLY A 60 16.317 6.931 -2.253 1.00 0.00 N ATOM 765 CA GLY A 60 16.721 6.598 -3.630 1.00 0.00 C ATOM 766 C GLY A 60 15.558 6.192 -4.535 1.00 0.00 C ATOM 767 O GLY A 60 15.442 6.710 -5.642 1.00 0.00 O ATOM 0 H GLY A 60 16.235 6.113 -1.649 1.00 0.00 H new ATOM 0 HA2 GLY A 60 17.226 7.459 -4.068 1.00 0.00 H new ATOM 0 HA3 GLY A 60 17.446 5.784 -3.599 1.00 0.00 H new ATOM 771 N CYS A 61 14.656 5.335 -4.047 1.00 0.00 N ATOM 772 CA CYS A 61 13.432 4.927 -4.732 1.00 0.00 C ATOM 773 C CYS A 61 12.434 6.117 -4.896 1.00 0.00 C ATOM 774 O CYS A 61 11.482 6.053 -5.683 1.00 0.00 O ATOM 775 CB CYS A 61 12.933 3.668 -3.985 1.00 0.00 C ATOM 776 SG CYS A 61 13.886 2.151 -4.386 1.00 0.00 S ATOM 0 H CYS A 61 14.764 4.893 -3.134 1.00 0.00 H new ATOM 0 HA CYS A 61 13.584 4.647 -5.774 1.00 0.00 H new ATOM 0 HB2 CYS A 61 12.986 3.848 -2.911 1.00 0.00 H new ATOM 0 HB3 CYS A 61 11.883 3.503 -4.229 1.00 0.00 H new ATOM 781 N GLY A 62 12.702 7.208 -4.155 1.00 0.00 N ATOM 782 CA GLY A 62 12.111 8.544 -4.289 1.00 0.00 C ATOM 783 C GLY A 62 10.957 8.858 -3.344 1.00 0.00 C ATOM 784 O GLY A 62 10.258 9.837 -3.565 1.00 0.00 O ATOM 0 H GLY A 62 13.384 7.173 -3.397 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.895 9.285 -4.133 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.759 8.664 -5.314 1.00 0.00 H new ATOM 788 N LEU A 63 10.750 8.058 -2.293 1.00 0.00 N ATOM 789 CA LEU A 63 9.686 8.258 -1.301 1.00 0.00 C ATOM 790 C LEU A 63 9.926 9.465 -0.376 1.00 0.00 C ATOM 791 O LEU A 63 8.972 10.089 0.087 1.00 0.00 O ATOM 792 CB LEU A 63 9.526 6.962 -0.517 1.00 0.00 C ATOM 793 CG LEU A 63 9.269 5.746 -1.432 1.00 0.00 C ATOM 794 CD1 LEU A 63 9.150 4.559 -0.507 1.00 0.00 C ATOM 795 CD2 LEU A 63 8.009 5.843 -2.303 1.00 0.00 C ATOM 0 H LEU A 63 11.327 7.238 -2.104 1.00 0.00 H new ATOM 0 HA LEU A 63 8.762 8.500 -1.825 1.00 0.00 H new ATOM 0 HB2 LEU A 63 10.425 6.785 0.073 1.00 0.00 H new ATOM 0 HB3 LEU A 63 8.699 7.066 0.185 1.00 0.00 H new ATOM 0 HG LEU A 63 10.089 5.674 -2.146 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.966 3.658 -1.093 1.00 0.00 H new ATOM 0 HD12 LEU A 63 10.076 4.443 0.057 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.322 4.718 0.184 1.00 0.00 H new ATOM 0 HD21 LEU A 63 7.916 4.942 -2.909 1.00 0.00 H new ATOM 0 HD22 LEU A 63 7.132 5.943 -1.664 1.00 0.00 H new ATOM 0 HD23 LEU A 63 8.084 6.713 -2.955 1.00 0.00 H new ATOM 807 N VAL A 64 11.190 9.818 -0.132 1.00 0.00 N ATOM 808 CA VAL A 64 11.629 10.933 0.732 1.00 0.00 C ATOM 809 C VAL A 64 12.829 11.673 0.142 1.00 0.00 C ATOM 810 O VAL A 64 13.544 11.123 -0.690 1.00 0.00 O ATOM 811 CB VAL A 64 12.007 10.461 2.154 1.00 0.00 C ATOM 812 CG1 VAL A 64 10.767 10.187 3.005 1.00 0.00 C ATOM 813 CG2 VAL A 64 12.836 9.195 2.161 1.00 0.00 C ATOM 0 H VAL A 64 11.976 9.317 -0.546 1.00 0.00 H new ATOM 0 HA VAL A 64 10.773 11.606 0.791 1.00 0.00 H new ATOM 0 HB VAL A 64 12.593 11.281 2.568 1.00 0.00 H new ATOM 0 HG11 VAL A 64 11.073 9.857 3.998 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.176 11.099 3.091 1.00 0.00 H new ATOM 0 HG13 VAL A 64 10.167 9.409 2.533 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.068 8.917 3.189 1.00 0.00 H new ATOM 0 HG22 VAL A 64 12.275 8.390 1.685 1.00 0.00 H new ATOM 0 HG23 VAL A 64 13.763 9.364 1.613 1.00 0.00 H new ATOM 823 N VAL A 65 13.048 12.918 0.576 1.00 0.00 N ATOM 824 CA VAL A 65 14.056 13.851 0.032 1.00 0.00 C ATOM 825 C VAL A 65 14.712 14.647 1.174 1.00 0.00 C ATOM 826 O VAL A 65 14.161 14.715 2.272 1.00 0.00 O ATOM 827 CB VAL A 65 13.418 14.827 -0.999 1.00 0.00 C ATOM 828 CG1 VAL A 65 14.500 15.466 -1.891 1.00 0.00 C ATOM 829 CG2 VAL A 65 12.405 14.137 -1.939 1.00 0.00 C ATOM 0 H VAL A 65 12.512 13.324 1.343 1.00 0.00 H new ATOM 0 HA VAL A 65 14.818 13.264 -0.481 1.00 0.00 H new ATOM 0 HB VAL A 65 12.899 15.577 -0.402 1.00 0.00 H new ATOM 0 HG11 VAL A 65 14.030 16.144 -2.604 1.00 0.00 H new ATOM 0 HG12 VAL A 65 15.202 16.022 -1.270 1.00 0.00 H new ATOM 0 HG13 VAL A 65 15.034 14.685 -2.432 1.00 0.00 H new ATOM 0 HG21 VAL A 65 11.996 14.870 -2.634 1.00 0.00 H new ATOM 0 HG22 VAL A 65 12.907 13.348 -2.498 1.00 0.00 H new ATOM 0 HG23 VAL A 65 11.597 13.705 -1.349 1.00 0.00 H new ATOM 839 N ALA A 66 15.892 15.234 0.937 1.00 0.00 N ATOM 840 CA ALA A 66 16.542 16.202 1.830 1.00 0.00 C ATOM 841 C ALA A 66 16.062 17.647 1.578 1.00 0.00 C ATOM 842 O ALA A 66 15.802 18.051 0.446 1.00 0.00 O ATOM 843 CB ALA A 66 18.061 16.082 1.643 1.00 0.00 C ATOM 0 H ALA A 66 16.436 15.043 0.095 1.00 0.00 H new ATOM 0 HA ALA A 66 16.270 15.972 2.860 1.00 0.00 H new ATOM 0 HB1 ALA A 66 18.565 16.793 2.297 1.00 0.00 H new ATOM 0 HB2 ALA A 66 18.379 15.070 1.893 1.00 0.00 H new ATOM 0 HB3 ALA A 66 18.318 16.298 0.606 1.00 0.00 H new ATOM 849 N THR A 67 16.000 18.442 2.650 1.00 0.00 N ATOM 850 CA THR A 67 15.777 19.902 2.629 1.00 0.00 C ATOM 851 C THR A 67 16.680 20.519 3.703 1.00 0.00 C ATOM 852 O THR A 67 17.268 19.786 4.487 1.00 0.00 O ATOM 853 CB THR A 67 14.308 20.254 2.917 1.00 0.00 C ATOM 854 OG1 THR A 67 13.379 19.302 2.447 1.00 0.00 O ATOM 855 CG2 THR A 67 13.878 21.631 2.434 1.00 0.00 C ATOM 0 H THR A 67 16.107 18.078 3.597 1.00 0.00 H new ATOM 0 HA THR A 67 16.013 20.294 1.640 1.00 0.00 H new ATOM 0 HB THR A 67 14.290 20.252 4.007 1.00 0.00 H new ATOM 0 HG1 THR A 67 12.678 19.755 1.933 1.00 0.00 H new ATOM 0 HG21 THR A 67 12.828 21.792 2.680 1.00 0.00 H new ATOM 0 HG22 THR A 67 14.486 22.394 2.921 1.00 0.00 H new ATOM 0 HG23 THR A 67 14.011 21.696 1.354 1.00 0.00 H new ATOM 863 N TYR A 68 16.740 21.843 3.807 1.00 0.00 N ATOM 864 CA TYR A 68 17.379 22.555 4.923 1.00 0.00 C ATOM 865 C TYR A 68 16.349 23.289 5.803 1.00 0.00 C ATOM 866 O TYR A 68 15.574 24.100 5.298 1.00 0.00 O ATOM 867 CB TYR A 68 18.378 23.581 4.362 1.00 0.00 C ATOM 868 CG TYR A 68 19.756 23.055 4.018 1.00 0.00 C ATOM 869 CD1 TYR A 68 19.991 22.428 2.778 1.00 0.00 C ATOM 870 CD2 TYR A 68 20.825 23.258 4.916 1.00 0.00 C ATOM 871 CE1 TYR A 68 21.289 21.997 2.438 1.00 0.00 C ATOM 872 CE2 TYR A 68 22.123 22.832 4.583 1.00 0.00 C ATOM 873 CZ TYR A 68 22.357 22.194 3.342 1.00 0.00 C ATOM 874 OH TYR A 68 23.607 21.756 3.030 1.00 0.00 O ATOM 0 H TYR A 68 16.340 22.469 3.108 1.00 0.00 H new ATOM 0 HA TYR A 68 17.887 21.816 5.543 1.00 0.00 H new ATOM 0 HB2 TYR A 68 17.946 24.024 3.464 1.00 0.00 H new ATOM 0 HB3 TYR A 68 18.490 24.384 5.091 1.00 0.00 H new ATOM 0 HD1 TYR A 68 19.175 22.277 2.087 1.00 0.00 H new ATOM 0 HD2 TYR A 68 20.645 23.743 5.864 1.00 0.00 H new ATOM 0 HE1 TYR A 68 21.467 21.517 1.487 1.00 0.00 H new ATOM 0 HE2 TYR A 68 22.939 22.991 5.272 1.00 0.00 H new ATOM 0 HH TYR A 68 24.222 21.974 3.761 1.00 0.00 H new ATOM 884 N GLU A 69 16.380 23.056 7.122 1.00 0.00 N ATOM 885 CA GLU A 69 15.678 23.888 8.122 1.00 0.00 C ATOM 886 C GLU A 69 16.490 25.172 8.446 1.00 0.00 C ATOM 887 O GLU A 69 16.268 25.823 9.463 1.00 0.00 O ATOM 888 CB GLU A 69 15.321 23.082 9.397 1.00 0.00 C ATOM 889 CG GLU A 69 16.530 22.551 10.185 1.00 0.00 C ATOM 890 CD GLU A 69 16.418 22.668 11.709 1.00 0.00 C ATOM 891 OE1 GLU A 69 15.377 22.342 12.316 1.00 0.00 O ATOM 892 OE2 GLU A 69 17.412 23.113 12.327 1.00 0.00 O ATOM 0 H GLU A 69 16.896 22.279 7.534 1.00 0.00 H new ATOM 0 HA GLU A 69 14.731 24.204 7.684 1.00 0.00 H new ATOM 0 HB2 GLU A 69 14.726 23.715 10.055 1.00 0.00 H new ATOM 0 HB3 GLU A 69 14.692 22.239 9.112 1.00 0.00 H new ATOM 0 HG2 GLU A 69 16.679 21.503 9.927 1.00 0.00 H new ATOM 0 HG3 GLU A 69 17.420 23.089 9.860 1.00 0.00 H new ATOM 899 N GLY A 70 17.491 25.517 7.620 1.00 0.00 N ATOM 900 CA GLY A 70 18.372 26.683 7.758 1.00 0.00 C ATOM 901 C GLY A 70 19.493 26.439 8.766 1.00 0.00 C ATOM 902 O GLY A 70 20.669 26.535 8.425 1.00 0.00 O ATOM 0 H GLY A 70 17.717 24.960 6.796 1.00 0.00 H new ATOM 0 HA2 GLY A 70 18.804 26.927 6.788 1.00 0.00 H new ATOM 0 HA3 GLY A 70 17.784 27.546 8.072 1.00 0.00 H new ATOM 906 N ARG A 71 19.114 26.085 9.995 1.00 0.00 N ATOM 907 CA ARG A 71 20.006 25.742 11.114 1.00 0.00 C ATOM 908 C ARG A 71 20.617 24.329 10.974 1.00 0.00 C ATOM 909 O ARG A 71 21.636 24.030 11.597 1.00 0.00 O ATOM 910 CB ARG A 71 19.165 25.921 12.392 1.00 0.00 C ATOM 911 CG ARG A 71 19.790 25.428 13.713 1.00 0.00 C ATOM 912 CD ARG A 71 18.786 25.483 14.874 1.00 0.00 C ATOM 913 NE ARG A 71 17.674 24.554 14.629 1.00 0.00 N ATOM 914 CZ ARG A 71 16.643 24.231 15.390 1.00 0.00 C ATOM 915 NH1 ARG A 71 16.483 24.721 16.605 1.00 0.00 N ATOM 916 NH2 ARG A 71 15.749 23.399 14.909 1.00 0.00 N ATOM 0 H ARG A 71 18.129 26.025 10.254 1.00 0.00 H new ATOM 0 HA ARG A 71 20.879 26.394 11.139 1.00 0.00 H new ATOM 0 HB2 ARG A 71 18.934 26.981 12.501 1.00 0.00 H new ATOM 0 HB3 ARG A 71 18.217 25.401 12.250 1.00 0.00 H new ATOM 0 HG2 ARG A 71 20.145 24.405 13.588 1.00 0.00 H new ATOM 0 HG3 ARG A 71 20.659 26.040 13.955 1.00 0.00 H new ATOM 0 HD2 ARG A 71 19.285 25.226 15.808 1.00 0.00 H new ATOM 0 HD3 ARG A 71 18.404 26.498 14.986 1.00 0.00 H new ATOM 0 HE ARG A 71 17.703 24.082 13.725 1.00 0.00 H new ATOM 0 HH11 ARG A 71 17.169 25.373 16.986 1.00 0.00 H new ATOM 0 HH12 ARG A 71 15.674 24.448 17.163 1.00 0.00 H new ATOM 0 HH21 ARG A 71 15.860 23.019 13.969 1.00 0.00 H new ATOM 0 HH22 ARG A 71 14.943 23.133 15.475 1.00 0.00 H new ATOM 930 N GLN A 72 20.025 23.466 10.147 1.00 0.00 N ATOM 931 CA GLN A 72 20.357 22.055 9.971 1.00 0.00 C ATOM 932 C GLN A 72 19.726 21.531 8.672 1.00 0.00 C ATOM 933 O GLN A 72 18.879 22.205 8.084 1.00 0.00 O ATOM 934 CB GLN A 72 19.865 21.290 11.231 1.00 0.00 C ATOM 935 CG GLN A 72 20.376 19.856 11.414 1.00 0.00 C ATOM 936 CD GLN A 72 21.840 19.768 11.040 1.00 0.00 C ATOM 937 OE1 GLN A 72 22.177 19.386 9.931 1.00 0.00 O ATOM 938 NE2 GLN A 72 22.739 20.281 11.846 1.00 0.00 N ATOM 0 H GLN A 72 19.253 23.754 9.546 1.00 0.00 H new ATOM 0 HA GLN A 72 21.432 21.905 9.874 1.00 0.00 H new ATOM 0 HB2 GLN A 72 20.150 21.867 12.111 1.00 0.00 H new ATOM 0 HB3 GLN A 72 18.776 21.262 11.207 1.00 0.00 H new ATOM 0 HG2 GLN A 72 20.239 19.543 12.449 1.00 0.00 H new ATOM 0 HG3 GLN A 72 19.794 19.173 10.795 1.00 0.00 H new ATOM 0 HE21 GLN A 72 22.467 20.603 12.775 1.00 0.00 H new ATOM 0 HE22 GLN A 72 23.710 20.358 11.544 1.00 0.00 H new ATOM 947 N VAL A 73 20.125 20.345 8.208 1.00 0.00 N ATOM 948 CA VAL A 73 19.406 19.636 7.135 1.00 0.00 C ATOM 949 C VAL A 73 18.283 18.779 7.731 1.00 0.00 C ATOM 950 O VAL A 73 18.374 18.354 8.881 1.00 0.00 O ATOM 951 CB VAL A 73 20.320 18.788 6.228 1.00 0.00 C ATOM 952 CG1 VAL A 73 21.362 19.650 5.511 1.00 0.00 C ATOM 953 CG2 VAL A 73 21.013 17.617 6.944 1.00 0.00 C ATOM 0 H VAL A 73 20.945 19.849 8.557 1.00 0.00 H new ATOM 0 HA VAL A 73 18.980 20.403 6.489 1.00 0.00 H new ATOM 0 HB VAL A 73 19.645 18.347 5.494 1.00 0.00 H new ATOM 0 HG11 VAL A 73 21.987 19.017 4.881 1.00 0.00 H new ATOM 0 HG12 VAL A 73 20.857 20.392 4.892 1.00 0.00 H new ATOM 0 HG13 VAL A 73 21.985 20.156 6.248 1.00 0.00 H new ATOM 0 HG21 VAL A 73 21.636 17.074 6.234 1.00 0.00 H new ATOM 0 HG22 VAL A 73 21.635 18.002 7.752 1.00 0.00 H new ATOM 0 HG23 VAL A 73 20.260 16.945 7.355 1.00 0.00 H new ATOM 963 N ARG A 74 17.243 18.489 6.943 1.00 0.00 N ATOM 964 CA ARG A 74 16.080 17.693 7.336 1.00 0.00 C ATOM 965 C ARG A 74 15.793 16.658 6.254 1.00 0.00 C ATOM 966 O ARG A 74 16.304 16.734 5.136 1.00 0.00 O ATOM 967 CB ARG A 74 14.837 18.586 7.562 1.00 0.00 C ATOM 968 CG ARG A 74 14.166 19.124 6.283 1.00 0.00 C ATOM 969 CD ARG A 74 12.751 19.640 6.502 1.00 0.00 C ATOM 970 NE ARG A 74 12.034 19.778 5.221 1.00 0.00 N ATOM 971 CZ ARG A 74 10.758 20.090 5.038 1.00 0.00 C ATOM 972 NH1 ARG A 74 9.950 20.336 6.052 1.00 0.00 N ATOM 973 NH2 ARG A 74 10.287 20.138 3.806 1.00 0.00 N ATOM 0 H ARG A 74 17.188 18.815 5.978 1.00 0.00 H new ATOM 0 HA ARG A 74 16.303 17.192 8.278 1.00 0.00 H new ATOM 0 HB2 ARG A 74 14.099 18.016 8.126 1.00 0.00 H new ATOM 0 HB3 ARG A 74 15.128 19.433 8.183 1.00 0.00 H new ATOM 0 HG2 ARG A 74 14.777 19.929 5.874 1.00 0.00 H new ATOM 0 HG3 ARG A 74 14.142 18.331 5.535 1.00 0.00 H new ATOM 0 HD2 ARG A 74 12.208 18.957 7.155 1.00 0.00 H new ATOM 0 HD3 ARG A 74 12.786 20.604 7.009 1.00 0.00 H new ATOM 0 HE ARG A 74 12.583 19.614 4.377 1.00 0.00 H new ATOM 0 HH11 ARG A 74 10.302 20.289 7.008 1.00 0.00 H new ATOM 0 HH12 ARG A 74 8.973 20.574 5.880 1.00 0.00 H new ATOM 0 HH21 ARG A 74 10.901 19.937 3.017 1.00 0.00 H new ATOM 0 HH22 ARG A 74 9.309 20.376 3.643 1.00 0.00 H new ATOM 987 N TYR A 75 14.905 15.718 6.559 1.00 0.00 N ATOM 988 CA TYR A 75 14.276 14.873 5.540 1.00 0.00 C ATOM 989 C TYR A 75 12.803 15.300 5.388 1.00 0.00 C ATOM 990 O TYR A 75 12.260 15.975 6.262 1.00 0.00 O ATOM 991 CB TYR A 75 14.453 13.380 5.867 1.00 0.00 C ATOM 992 CG TYR A 75 15.891 12.888 5.834 1.00 0.00 C ATOM 993 CD1 TYR A 75 16.690 13.090 4.689 1.00 0.00 C ATOM 994 CD2 TYR A 75 16.431 12.211 6.945 1.00 0.00 C ATOM 995 CE1 TYR A 75 18.027 12.651 4.665 1.00 0.00 C ATOM 996 CE2 TYR A 75 17.765 11.756 6.921 1.00 0.00 C ATOM 997 CZ TYR A 75 18.568 11.978 5.781 1.00 0.00 C ATOM 998 OH TYR A 75 19.857 11.541 5.759 1.00 0.00 O ATOM 0 H TYR A 75 14.600 15.518 7.512 1.00 0.00 H new ATOM 0 HA TYR A 75 14.766 15.012 4.576 1.00 0.00 H new ATOM 0 HB2 TYR A 75 14.040 13.188 6.857 1.00 0.00 H new ATOM 0 HB3 TYR A 75 13.867 12.795 5.158 1.00 0.00 H new ATOM 0 HD1 TYR A 75 16.273 13.585 3.825 1.00 0.00 H new ATOM 0 HD2 TYR A 75 15.820 12.040 7.819 1.00 0.00 H new ATOM 0 HE1 TYR A 75 18.639 12.829 3.793 1.00 0.00 H new ATOM 0 HE2 TYR A 75 18.173 11.237 7.776 1.00 0.00 H new ATOM 0 HH TYR A 75 20.067 11.100 6.608 1.00 0.00 H new ATOM 1008 N ALA A 76 12.157 14.926 4.287 1.00 0.00 N ATOM 1009 CA ALA A 76 10.761 15.230 3.968 1.00 0.00 C ATOM 1010 C ALA A 76 10.180 14.149 3.056 1.00 0.00 C ATOM 1011 O ALA A 76 10.943 13.547 2.303 1.00 0.00 O ATOM 1012 CB ALA A 76 10.700 16.606 3.291 1.00 0.00 C ATOM 0 H ALA A 76 12.612 14.377 3.558 1.00 0.00 H new ATOM 0 HA ALA A 76 10.166 15.250 4.881 1.00 0.00 H new ATOM 0 HB1 ALA A 76 9.665 16.846 3.047 1.00 0.00 H new ATOM 0 HB2 ALA A 76 11.098 17.362 3.967 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.293 16.588 2.377 1.00 0.00 H new ATOM 1018 N LEU A 77 8.865 13.910 3.128 1.00 0.00 N ATOM 1019 CA LEU A 77 8.126 13.079 2.168 1.00 0.00 C ATOM 1020 C LEU A 77 8.177 13.742 0.777 1.00 0.00 C ATOM 1021 O LEU A 77 8.195 14.967 0.708 1.00 0.00 O ATOM 1022 CB LEU A 77 6.670 12.925 2.663 1.00 0.00 C ATOM 1023 CG LEU A 77 6.178 11.473 2.717 1.00 0.00 C ATOM 1024 CD1 LEU A 77 6.837 10.667 3.828 1.00 0.00 C ATOM 1025 CD2 LEU A 77 4.686 11.501 3.024 1.00 0.00 C ATOM 0 H LEU A 77 8.275 14.294 3.866 1.00 0.00 H new ATOM 0 HA LEU A 77 8.575 12.089 2.089 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.587 13.363 3.658 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.012 13.496 2.008 1.00 0.00 H new ATOM 0 HG LEU A 77 6.419 11.008 1.761 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.450 9.648 3.817 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.916 10.647 3.672 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.618 11.128 4.791 1.00 0.00 H new ATOM 0 HD21 LEU A 77 4.305 10.481 3.069 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.521 11.993 3.983 1.00 0.00 H new ATOM 0 HD23 LEU A 77 4.163 12.049 2.240 1.00 0.00 H new ATOM 1037 N ALA A 78 8.177 12.976 -0.322 1.00 0.00 N ATOM 1038 CA ALA A 78 8.457 13.530 -1.660 1.00 0.00 C ATOM 1039 C ALA A 78 7.330 14.330 -2.356 1.00 0.00 C ATOM 1040 O ALA A 78 7.583 14.907 -3.416 1.00 0.00 O ATOM 1041 CB ALA A 78 8.948 12.375 -2.535 1.00 0.00 C ATOM 0 H ALA A 78 7.987 11.974 -0.315 1.00 0.00 H new ATOM 0 HA ALA A 78 9.211 14.304 -1.515 1.00 0.00 H new ATOM 0 HB1 ALA A 78 9.167 12.745 -3.537 1.00 0.00 H new ATOM 0 HB2 ALA A 78 9.852 11.948 -2.100 1.00 0.00 H new ATOM 0 HB3 ALA A 78 8.176 11.608 -2.592 1.00 0.00 H new ATOM 1047 N ASP A 79 6.109 14.354 -1.806 1.00 0.00 N ATOM 1048 CA ASP A 79 4.944 15.165 -2.226 1.00 0.00 C ATOM 1049 C ASP A 79 3.711 14.915 -1.323 1.00 0.00 C ATOM 1050 O ASP A 79 3.601 13.918 -0.601 1.00 0.00 O ATOM 1051 CB ASP A 79 4.583 14.959 -3.726 1.00 0.00 C ATOM 1052 CG ASP A 79 3.304 15.679 -4.188 1.00 0.00 C ATOM 1053 OD1 ASP A 79 3.179 16.896 -3.926 1.00 0.00 O ATOM 1054 OD2 ASP A 79 2.375 14.978 -4.645 1.00 0.00 O ATOM 0 H ASP A 79 5.887 13.769 -1.000 1.00 0.00 H new ATOM 0 HA ASP A 79 5.242 16.206 -2.106 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.418 15.304 -4.336 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.470 13.891 -3.914 1.00 0.00 H new ATOM 1059 N SER A 80 2.743 15.828 -1.426 1.00 0.00 N ATOM 1060 CA SER A 80 1.373 15.727 -0.921 1.00 0.00 C ATOM 1061 C SER A 80 0.709 14.386 -1.286 1.00 0.00 C ATOM 1062 O SER A 80 -0.100 13.872 -0.514 1.00 0.00 O ATOM 1063 CB SER A 80 0.569 16.891 -1.513 1.00 0.00 C ATOM 1064 OG SER A 80 -0.739 16.944 -0.973 1.00 0.00 O ATOM 0 H SER A 80 2.907 16.718 -1.897 1.00 0.00 H new ATOM 0 HA SER A 80 1.395 15.775 0.168 1.00 0.00 H new ATOM 0 HB2 SER A 80 1.085 17.830 -1.313 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.513 16.782 -2.596 1.00 0.00 H new ATOM 0 HG SER A 80 -1.226 17.697 -1.369 1.00 0.00 H new ATOM 1070 N HIS A 81 1.105 13.769 -2.409 1.00 0.00 N ATOM 1071 CA HIS A 81 0.750 12.407 -2.799 1.00 0.00 C ATOM 1072 C HIS A 81 0.979 11.409 -1.669 1.00 0.00 C ATOM 1073 O HIS A 81 0.008 10.840 -1.171 1.00 0.00 O ATOM 1074 CB HIS A 81 1.541 12.022 -4.071 1.00 0.00 C ATOM 1075 CG HIS A 81 0.845 12.367 -5.364 1.00 0.00 C ATOM 1076 ND1 HIS A 81 -0.411 12.925 -5.489 1.00 0.00 N ATOM 1077 CD2 HIS A 81 1.188 11.857 -6.582 1.00 0.00 C ATOM 1078 CE1 HIS A 81 -0.864 12.662 -6.725 1.00 0.00 C ATOM 1079 NE2 HIS A 81 0.123 12.084 -7.438 1.00 0.00 N ATOM 0 H HIS A 81 1.705 14.228 -3.094 1.00 0.00 H new ATOM 0 HA HIS A 81 -0.317 12.373 -3.018 1.00 0.00 H new ATOM 0 HB2 HIS A 81 2.509 12.523 -4.048 1.00 0.00 H new ATOM 0 HB3 HIS A 81 1.737 10.950 -4.052 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -0.909 13.447 -4.768 1.00 0.00 H new ATOM 0 HD2 HIS A 81 2.117 11.367 -6.832 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -1.858 12.878 -7.089 1.00 0.00 H new ATOM 1088 N LEU A 82 2.227 11.190 -1.241 1.00 0.00 N ATOM 1089 CA LEU A 82 2.480 10.241 -0.154 1.00 0.00 C ATOM 1090 C LEU A 82 1.919 10.783 1.158 1.00 0.00 C ATOM 1091 O LEU A 82 1.402 10.003 1.942 1.00 0.00 O ATOM 1092 CB LEU A 82 3.965 9.873 0.018 1.00 0.00 C ATOM 1093 CG LEU A 82 4.768 9.435 -1.217 1.00 0.00 C ATOM 1094 CD1 LEU A 82 5.991 8.641 -0.750 1.00 0.00 C ATOM 1095 CD2 LEU A 82 3.993 8.579 -2.228 1.00 0.00 C ATOM 0 H LEU A 82 3.058 11.644 -1.620 1.00 0.00 H new ATOM 0 HA LEU A 82 1.968 9.319 -0.431 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.471 10.736 0.451 1.00 0.00 H new ATOM 0 HB3 LEU A 82 4.023 9.069 0.751 1.00 0.00 H new ATOM 0 HG LEU A 82 5.034 10.354 -1.739 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.571 8.323 -1.616 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.610 9.269 -0.110 1.00 0.00 H new ATOM 0 HD13 LEU A 82 5.664 7.764 -0.191 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.645 8.321 -3.062 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.647 7.666 -1.743 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.135 9.140 -2.598 1.00 0.00 H new ATOM 1107 N ALA A 83 1.945 12.101 1.384 1.00 0.00 N ATOM 1108 CA ALA A 83 1.521 12.669 2.667 1.00 0.00 C ATOM 1109 C ALA A 83 0.028 12.429 2.913 1.00 0.00 C ATOM 1110 O ALA A 83 -0.354 12.004 4.000 1.00 0.00 O ATOM 1111 CB ALA A 83 1.881 14.157 2.707 1.00 0.00 C ATOM 0 H ALA A 83 2.254 12.791 0.699 1.00 0.00 H new ATOM 0 HA ALA A 83 2.050 12.166 3.477 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.567 14.582 3.660 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.959 14.274 2.596 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.374 14.676 1.894 1.00 0.00 H new ATOM 1117 N ARG A 84 -0.806 12.636 1.886 1.00 0.00 N ATOM 1118 CA ARG A 84 -2.251 12.433 1.973 1.00 0.00 C ATOM 1119 C ARG A 84 -2.646 10.960 1.846 1.00 0.00 C ATOM 1120 O ARG A 84 -3.614 10.573 2.476 1.00 0.00 O ATOM 1121 CB ARG A 84 -2.996 13.384 1.013 1.00 0.00 C ATOM 1122 CG ARG A 84 -3.295 12.891 -0.416 1.00 0.00 C ATOM 1123 CD ARG A 84 -4.633 12.131 -0.500 1.00 0.00 C ATOM 1124 NE ARG A 84 -5.179 12.072 -1.866 1.00 0.00 N ATOM 1125 CZ ARG A 84 -5.796 13.028 -2.548 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -5.824 14.276 -2.130 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -6.423 12.733 -3.662 1.00 0.00 N ATOM 0 H ARG A 84 -0.492 12.951 0.968 1.00 0.00 H new ATOM 0 HA ARG A 84 -2.576 12.705 2.977 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -3.945 13.650 1.478 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -2.412 14.301 0.933 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -3.320 13.743 -1.095 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -2.487 12.240 -0.751 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -4.492 11.116 -0.128 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -5.359 12.613 0.155 1.00 0.00 H new ATOM 0 HE ARG A 84 -5.069 11.181 -2.350 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -5.362 14.532 -1.257 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -6.308 14.987 -2.679 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -6.435 11.771 -4.001 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -6.899 13.466 -4.189 1.00 0.00 H new ATOM 1141 N ALA A 85 -1.920 10.125 1.091 1.00 0.00 N ATOM 1142 CA ALA A 85 -2.206 8.687 0.997 1.00 0.00 C ATOM 1143 C ALA A 85 -1.793 7.921 2.263 1.00 0.00 C ATOM 1144 O ALA A 85 -2.539 7.074 2.747 1.00 0.00 O ATOM 1145 CB ALA A 85 -1.500 8.122 -0.240 1.00 0.00 C ATOM 0 H ALA A 85 -1.122 10.425 0.531 1.00 0.00 H new ATOM 0 HA ALA A 85 -3.284 8.557 0.903 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -1.705 7.054 -0.320 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -1.867 8.630 -1.132 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -0.425 8.279 -0.149 1.00 0.00 H new ATOM 1151 N LEU A 86 -0.618 8.217 2.827 1.00 0.00 N ATOM 1152 CA LEU A 86 -0.187 7.633 4.098 1.00 0.00 C ATOM 1153 C LEU A 86 -1.046 8.179 5.248 1.00 0.00 C ATOM 1154 O LEU A 86 -1.497 7.411 6.091 1.00 0.00 O ATOM 1155 CB LEU A 86 1.317 7.909 4.316 1.00 0.00 C ATOM 1156 CG LEU A 86 2.059 6.787 5.067 1.00 0.00 C ATOM 1157 CD1 LEU A 86 3.470 7.288 5.368 1.00 0.00 C ATOM 1158 CD2 LEU A 86 1.408 6.316 6.375 1.00 0.00 C ATOM 0 H LEU A 86 0.056 8.864 2.418 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.326 6.552 4.073 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.792 8.059 3.347 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.428 8.839 4.873 1.00 0.00 H new ATOM 0 HG LEU A 86 2.038 5.915 4.413 1.00 0.00 H new ATOM 0 HD11 LEU A 86 4.024 6.516 5.901 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.980 7.522 4.434 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.414 8.185 5.985 1.00 0.00 H new ATOM 0 HD21 LEU A 86 2.013 5.526 6.819 1.00 0.00 H new ATOM 0 HD22 LEU A 86 1.339 7.153 7.069 1.00 0.00 H new ATOM 0 HD23 LEU A 86 0.409 5.934 6.167 1.00 0.00 H new ATOM 1170 N GLY A 87 -1.311 9.489 5.240 1.00 0.00 N ATOM 1171 CA GLY A 87 -2.015 10.230 6.293 1.00 0.00 C ATOM 1172 C GLY A 87 -3.522 9.928 6.349 1.00 0.00 C ATOM 1173 O GLY A 87 -4.086 9.921 7.437 1.00 0.00 O ATOM 0 H GLY A 87 -1.028 10.089 4.465 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -1.568 9.989 7.257 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -1.872 11.299 6.133 1.00 0.00 H new ATOM 1177 N GLU A 88 -4.157 9.603 5.213 1.00 0.00 N ATOM 1178 CA GLU A 88 -5.515 9.013 5.136 1.00 0.00 C ATOM 1179 C GLU A 88 -5.569 7.630 5.813 1.00 0.00 C ATOM 1180 O GLU A 88 -6.634 7.185 6.251 1.00 0.00 O ATOM 1181 CB GLU A 88 -5.871 8.890 3.634 1.00 0.00 C ATOM 1182 CG GLU A 88 -6.889 7.847 3.145 1.00 0.00 C ATOM 1183 CD GLU A 88 -8.261 7.894 3.800 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -8.744 9.008 4.095 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -8.937 6.836 3.838 1.00 0.00 O ATOM 0 H GLU A 88 -3.735 9.744 4.295 1.00 0.00 H new ATOM 0 HA GLU A 88 -6.229 9.648 5.661 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -6.233 9.866 3.311 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.940 8.703 3.099 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -7.018 7.971 2.070 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -6.467 6.855 3.303 1.00 0.00 H new ATOM 1192 N LEU A 89 -4.404 6.965 5.862 1.00 0.00 N ATOM 1193 CA LEU A 89 -4.155 5.573 6.203 1.00 0.00 C ATOM 1194 C LEU A 89 -4.531 4.718 4.991 1.00 0.00 C ATOM 1195 O LEU A 89 -5.534 4.946 4.329 1.00 0.00 O ATOM 1196 CB LEU A 89 -4.938 5.130 7.465 1.00 0.00 C ATOM 1197 CG LEU A 89 -4.613 3.724 7.997 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -3.215 3.668 8.626 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -5.692 3.279 8.991 1.00 0.00 C ATOM 0 H LEU A 89 -3.532 7.445 5.640 1.00 0.00 H new ATOM 0 HA LEU A 89 -3.100 5.444 6.446 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -4.747 5.851 8.260 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -6.004 5.176 7.242 1.00 0.00 H new ATOM 0 HG LEU A 89 -4.609 3.031 7.156 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -3.020 2.659 8.991 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -2.468 3.934 7.878 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -3.162 4.371 9.457 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -5.455 2.282 9.363 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -5.729 3.979 9.826 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -6.661 3.259 8.492 1.00 0.00 H new ATOM 1211 N VAL A 90 -3.840 3.599 4.801 1.00 0.00 N ATOM 1212 CA VAL A 90 -4.269 2.514 3.875 1.00 0.00 C ATOM 1213 C VAL A 90 -5.676 1.941 4.185 1.00 0.00 C ATOM 1214 O VAL A 90 -6.073 0.909 3.640 1.00 0.00 O ATOM 1215 CB VAL A 90 -3.292 1.324 3.903 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -2.007 1.642 3.129 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -2.960 0.904 5.344 1.00 0.00 C ATOM 0 H VAL A 90 -2.961 3.402 5.279 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.286 2.996 2.897 1.00 0.00 H new ATOM 0 HB VAL A 90 -3.789 0.487 3.412 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -1.337 0.783 3.167 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -2.253 1.865 2.091 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -1.516 2.505 3.578 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -2.268 0.062 5.327 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -2.500 1.741 5.870 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -3.876 0.611 5.858 1.00 0.00 H new ATOM 1227 N GLN A 91 -6.385 2.531 5.153 1.00 0.00 N ATOM 1228 CA GLN A 91 -7.670 2.189 5.722 1.00 0.00 C ATOM 1229 C GLN A 91 -7.569 0.931 6.592 1.00 0.00 C ATOM 1230 O GLN A 91 -8.098 0.911 7.698 1.00 0.00 O ATOM 1231 CB GLN A 91 -8.710 2.104 4.595 1.00 0.00 C ATOM 1232 CG GLN A 91 -9.256 3.480 4.154 1.00 0.00 C ATOM 1233 CD GLN A 91 -10.151 4.151 5.194 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -11.336 3.866 5.284 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -9.627 4.987 6.060 1.00 0.00 N ATOM 0 H GLN A 91 -6.012 3.366 5.606 1.00 0.00 H new ATOM 0 HA GLN A 91 -8.008 2.969 6.404 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -8.262 1.607 3.735 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -9.541 1.481 4.925 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -8.417 4.139 3.931 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -9.819 3.357 3.229 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -8.639 5.234 5.997 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -10.208 5.390 6.796 1.00 0.00 H new ATOM 1244 N VAL A 92 -6.854 -0.093 6.129 1.00 0.00 N ATOM 1245 CA VAL A 92 -6.778 -1.425 6.725 1.00 0.00 C ATOM 1246 C VAL A 92 -6.341 -1.398 8.197 1.00 0.00 C ATOM 1247 O VAL A 92 -5.178 -1.184 8.527 1.00 0.00 O ATOM 1248 CB VAL A 92 -5.942 -2.361 5.809 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -4.476 -2.567 6.211 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -6.647 -3.711 5.662 1.00 0.00 C ATOM 0 H VAL A 92 -6.284 -0.012 5.287 1.00 0.00 H new ATOM 0 HA VAL A 92 -7.780 -1.850 6.776 1.00 0.00 H new ATOM 0 HB VAL A 92 -5.887 -1.838 4.854 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.994 -3.238 5.499 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.960 -1.607 6.211 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -4.430 -3.003 7.209 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -6.055 -4.362 5.019 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -6.757 -4.173 6.643 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -7.632 -3.561 5.219 1.00 0.00 H new ATOM 1260 N VAL A 93 -7.333 -1.580 9.070 1.00 0.00 N ATOM 1261 CA VAL A 93 -7.299 -1.834 10.521 1.00 0.00 C ATOM 1262 C VAL A 93 -6.669 -0.746 11.427 1.00 0.00 C ATOM 1263 O VAL A 93 -7.105 -0.582 12.560 1.00 0.00 O ATOM 1264 CB VAL A 93 -6.619 -3.200 10.832 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -7.031 -3.717 12.219 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -6.960 -4.313 9.819 1.00 0.00 C ATOM 0 H VAL A 93 -8.298 -1.550 8.742 1.00 0.00 H new ATOM 0 HA VAL A 93 -8.358 -1.831 10.780 1.00 0.00 H new ATOM 0 HB VAL A 93 -5.550 -2.992 10.778 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -6.542 -4.672 12.411 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -6.731 -2.996 12.980 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -8.112 -3.850 12.251 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -6.449 -5.233 10.103 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -8.037 -4.483 9.814 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -6.635 -4.011 8.823 1.00 0.00 H new ATOM 1276 N LEU A 94 -5.681 -0.010 10.905 1.00 0.00 N ATOM 1277 CA LEU A 94 -4.665 0.857 11.517 1.00 0.00 C ATOM 1278 C LEU A 94 -3.384 0.041 11.303 1.00 0.00 C ATOM 1279 O LEU A 94 -3.085 -0.882 12.055 1.00 0.00 O ATOM 1280 CB LEU A 94 -4.927 1.251 12.991 1.00 0.00 C ATOM 1281 CG LEU A 94 -4.008 2.339 13.595 1.00 0.00 C ATOM 1282 CD1 LEU A 94 -2.533 1.924 13.703 1.00 0.00 C ATOM 1283 CD2 LEU A 94 -4.115 3.670 12.834 1.00 0.00 C ATOM 0 H LEU A 94 -5.559 -0.010 9.892 1.00 0.00 H new ATOM 0 HA LEU A 94 -4.636 1.848 11.065 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -5.959 1.593 13.073 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -4.839 0.354 13.603 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.378 2.473 14.612 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.956 2.741 14.136 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -2.449 1.043 14.340 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -2.147 1.693 12.710 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -3.453 4.405 13.292 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -3.825 3.519 11.794 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.143 4.031 12.876 1.00 0.00 H new ATOM 1295 N ALA A 95 -2.676 0.302 10.204 1.00 0.00 N ATOM 1296 CA ALA A 95 -1.564 -0.524 9.725 1.00 0.00 C ATOM 1297 C ALA A 95 -0.352 -0.611 10.689 1.00 0.00 C ATOM 1298 O ALA A 95 0.643 0.099 10.522 1.00 0.00 O ATOM 1299 CB ALA A 95 -1.178 -0.021 8.331 1.00 0.00 C ATOM 0 H ALA A 95 -2.862 1.109 9.609 1.00 0.00 H new ATOM 0 HA ALA A 95 -1.904 -1.559 9.678 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -0.351 -0.617 7.945 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -2.033 -0.112 7.662 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.875 1.024 8.392 1.00 0.00 H new ATOM 1305 N VAL A 96 -0.446 -1.504 11.678 1.00 0.00 N ATOM 1306 CA VAL A 96 0.635 -1.934 12.589 1.00 0.00 C ATOM 1307 C VAL A 96 1.778 -2.633 11.833 1.00 0.00 C ATOM 1308 O VAL A 96 1.550 -3.336 10.851 1.00 0.00 O ATOM 1309 CB VAL A 96 0.116 -2.906 13.688 1.00 0.00 C ATOM 1310 CG1 VAL A 96 1.129 -3.113 14.832 1.00 0.00 C ATOM 1311 CG2 VAL A 96 -1.205 -2.440 14.321 1.00 0.00 C ATOM 0 H VAL A 96 -1.326 -1.977 11.882 1.00 0.00 H new ATOM 0 HA VAL A 96 1.008 -1.022 13.054 1.00 0.00 H new ATOM 0 HB VAL A 96 -0.039 -3.846 13.158 1.00 0.00 H new ATOM 0 HG11 VAL A 96 0.711 -3.800 15.568 1.00 0.00 H new ATOM 0 HG12 VAL A 96 2.052 -3.530 14.429 1.00 0.00 H new ATOM 0 HG13 VAL A 96 1.340 -2.156 15.308 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -1.518 -3.157 15.080 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.063 -1.463 14.782 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -1.973 -2.369 13.550 1.00 0.00 H new ATOM 1321 N ASP A 97 2.995 -2.495 12.367 1.00 0.00 N ATOM 1322 CA ASP A 97 4.264 -3.114 11.948 1.00 0.00 C ATOM 1323 C ASP A 97 4.284 -4.663 11.961 1.00 0.00 C ATOM 1324 O ASP A 97 5.270 -5.260 11.531 1.00 0.00 O ATOM 1325 CB ASP A 97 5.376 -2.607 12.899 1.00 0.00 C ATOM 1326 CG ASP A 97 5.478 -1.082 13.034 1.00 0.00 C ATOM 1327 OD1 ASP A 97 4.478 -0.473 13.489 1.00 0.00 O ATOM 1328 OD2 ASP A 97 6.543 -0.518 12.696 1.00 0.00 O ATOM 0 H ASP A 97 3.134 -1.893 13.178 1.00 0.00 H new ATOM 0 HA ASP A 97 4.414 -2.825 10.908 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.207 -3.032 13.888 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.334 -2.989 12.547 1.00 0.00 H new ATOM 1333 N THR A 98 3.233 -5.322 12.470 1.00 0.00 N ATOM 1334 CA THR A 98 3.164 -6.784 12.627 1.00 0.00 C ATOM 1335 C THR A 98 2.913 -7.495 11.306 1.00 0.00 C ATOM 1336 O THR A 98 1.805 -7.440 10.764 1.00 0.00 O ATOM 1337 CB THR A 98 2.090 -7.214 13.632 1.00 0.00 C ATOM 1338 OG1 THR A 98 0.901 -6.521 13.345 1.00 0.00 O ATOM 1339 CG2 THR A 98 2.498 -6.916 15.072 1.00 0.00 C ATOM 0 H THR A 98 2.390 -4.845 12.791 1.00 0.00 H new ATOM 0 HA THR A 98 4.142 -7.077 13.008 1.00 0.00 H new ATOM 0 HB THR A 98 1.954 -8.291 13.539 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.147 -7.147 13.355 1.00 0.00 H new ATOM 0 HG21 THR A 98 1.706 -7.238 15.749 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.417 -7.452 15.308 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.662 -5.845 15.189 1.00 0.00 H new ATOM 1347 N ASP A 99 3.905 -8.254 10.855 1.00 0.00 N ATOM 1348 CA ASP A 99 3.793 -9.208 9.751 1.00 0.00 C ATOM 1349 C ASP A 99 3.042 -10.478 10.212 1.00 0.00 C ATOM 1350 O ASP A 99 3.618 -11.554 10.396 1.00 0.00 O ATOM 1351 CB ASP A 99 5.198 -9.474 9.189 1.00 0.00 C ATOM 1352 CG ASP A 99 5.198 -10.342 7.927 1.00 0.00 C ATOM 1353 OD1 ASP A 99 4.232 -10.300 7.135 1.00 0.00 O ATOM 1354 OD2 ASP A 99 6.204 -11.046 7.698 1.00 0.00 O ATOM 0 H ASP A 99 4.841 -8.223 11.259 1.00 0.00 H new ATOM 0 HA ASP A 99 3.194 -8.801 8.936 1.00 0.00 H new ATOM 0 HB2 ASP A 99 5.677 -8.521 8.965 1.00 0.00 H new ATOM 0 HB3 ASP A 99 5.801 -9.961 9.955 1.00 0.00 H new ATOM 1359 N GLN A 100 1.736 -10.320 10.466 1.00 0.00 N ATOM 1360 CA GLN A 100 0.840 -11.433 10.788 1.00 0.00 C ATOM 1361 C GLN A 100 0.865 -12.467 9.634 1.00 0.00 C ATOM 1362 O GLN A 100 0.978 -12.069 8.473 1.00 0.00 O ATOM 1363 CB GLN A 100 -0.592 -10.917 11.057 1.00 0.00 C ATOM 1364 CG GLN A 100 -1.092 -11.138 12.493 1.00 0.00 C ATOM 1365 CD GLN A 100 -0.417 -10.197 13.477 1.00 0.00 C ATOM 1366 OE1 GLN A 100 -0.807 -8.944 13.501 1.00 0.00 O flip ATOM 1367 NE2 GLN A 100 0.500 -10.559 14.192 1.00 0.00 N flip ATOM 0 H GLN A 100 1.272 -9.412 10.453 1.00 0.00 H new ATOM 0 HA GLN A 100 1.184 -11.924 11.698 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -0.628 -9.851 10.834 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -1.277 -11.410 10.368 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -2.171 -10.989 12.529 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -0.903 -12.170 12.789 1.00 0.00 H new ATOM 0 HE21 GLN A 100 0.806 -11.532 14.176 1.00 0.00 H new ATOM 0 HE22 GLN A 100 0.962 -9.889 14.807 1.00 0.00 H new ATOM 1376 N PRO A 101 0.748 -13.781 9.919 1.00 0.00 N ATOM 1377 CA PRO A 101 0.999 -14.835 8.940 1.00 0.00 C ATOM 1378 C PRO A 101 0.028 -14.814 7.761 1.00 0.00 C ATOM 1379 O PRO A 101 -1.186 -14.708 7.934 1.00 0.00 O ATOM 1380 CB PRO A 101 0.959 -16.159 9.711 1.00 0.00 C ATOM 1381 CG PRO A 101 0.091 -15.835 10.924 1.00 0.00 C ATOM 1382 CD PRO A 101 0.422 -14.371 11.206 1.00 0.00 C ATOM 0 HA PRO A 101 1.972 -14.685 8.471 1.00 0.00 H new ATOM 0 HB2 PRO A 101 0.528 -16.961 9.111 1.00 0.00 H new ATOM 0 HB3 PRO A 101 1.957 -16.483 10.006 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -0.969 -15.975 10.710 1.00 0.00 H new ATOM 0 HG3 PRO A 101 0.332 -16.474 11.774 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -0.424 -13.861 11.666 1.00 0.00 H new ATOM 0 HD3 PRO A 101 1.260 -14.286 11.898 1.00 0.00 H new ATOM 1390 N CYS A 102 0.608 -14.988 6.569 1.00 0.00 N ATOM 1391 CA CYS A 102 -0.038 -14.997 5.267 1.00 0.00 C ATOM 1392 C CYS A 102 -0.913 -16.269 5.085 1.00 0.00 C ATOM 1393 O CYS A 102 -0.582 -17.152 4.303 1.00 0.00 O ATOM 1394 CB CYS A 102 1.109 -14.843 4.245 1.00 0.00 C ATOM 1395 SG CYS A 102 0.560 -14.071 2.690 1.00 0.00 S ATOM 0 H CYS A 102 1.614 -15.136 6.491 1.00 0.00 H new ATOM 0 HA CYS A 102 -0.751 -14.184 5.134 1.00 0.00 H new ATOM 0 HB2 CYS A 102 1.904 -14.241 4.685 1.00 0.00 H new ATOM 0 HB3 CYS A 102 1.533 -15.824 4.030 1.00 0.00 H new ATOM 1400 N VAL A 103 -1.979 -16.371 5.875 1.00 0.00 N ATOM 1401 CA VAL A 103 -2.820 -17.561 6.111 1.00 0.00 C ATOM 1402 C VAL A 103 -3.035 -18.533 4.927 1.00 0.00 C ATOM 1403 O VAL A 103 -2.796 -19.729 5.099 1.00 0.00 O ATOM 1404 CB VAL A 103 -4.147 -17.137 6.776 1.00 0.00 C ATOM 1405 CG1 VAL A 103 -5.082 -16.320 5.875 1.00 0.00 C ATOM 1406 CG2 VAL A 103 -4.879 -18.363 7.326 1.00 0.00 C ATOM 0 H VAL A 103 -2.309 -15.569 6.411 1.00 0.00 H new ATOM 0 HA VAL A 103 -2.232 -18.181 6.788 1.00 0.00 H new ATOM 0 HB VAL A 103 -3.866 -16.467 7.588 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.988 -16.067 6.425 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -4.579 -15.405 5.564 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -5.344 -16.907 4.995 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -5.813 -18.050 7.792 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.094 -19.054 6.511 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -4.252 -18.859 8.067 1.00 0.00 H new ATOM 1416 N ALA A 104 -3.443 -18.056 3.745 1.00 0.00 N ATOM 1417 CA ALA A 104 -3.559 -18.878 2.535 1.00 0.00 C ATOM 1418 C ALA A 104 -2.244 -18.888 1.737 1.00 0.00 C ATOM 1419 O ALA A 104 -1.593 -17.862 1.564 1.00 0.00 O ATOM 1420 CB ALA A 104 -4.738 -18.388 1.700 1.00 0.00 C ATOM 0 H ALA A 104 -3.704 -17.081 3.600 1.00 0.00 H new ATOM 0 HA ALA A 104 -3.750 -19.913 2.821 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -4.825 -18.998 0.801 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -5.655 -18.468 2.283 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.577 -17.347 1.418 1.00 0.00 H new ATOM 1426 N GLU A 105 -1.829 -20.087 1.317 1.00 0.00 N ATOM 1427 CA GLU A 105 -0.536 -20.354 0.672 1.00 0.00 C ATOM 1428 C GLU A 105 0.689 -19.894 1.496 1.00 0.00 C ATOM 1429 O GLU A 105 1.715 -19.483 0.947 1.00 0.00 O ATOM 1430 CB GLU A 105 -0.520 -19.860 -0.793 1.00 0.00 C ATOM 1431 CG GLU A 105 -1.647 -20.434 -1.679 1.00 0.00 C ATOM 1432 CD GLU A 105 -2.994 -19.706 -1.568 1.00 0.00 C ATOM 1433 OE1 GLU A 105 -2.973 -18.471 -1.392 1.00 0.00 O ATOM 1434 OE2 GLU A 105 -4.045 -20.383 -1.729 1.00 0.00 O ATOM 0 H GLU A 105 -2.400 -20.926 1.419 1.00 0.00 H new ATOM 0 HA GLU A 105 -0.431 -21.438 0.639 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -0.592 -18.772 -0.796 1.00 0.00 H new ATOM 0 HB3 GLU A 105 0.441 -20.117 -1.239 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -1.321 -20.407 -2.719 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -1.795 -21.482 -1.419 1.00 0.00 H new ATOM 1441 N ARG A 106 0.606 -20.001 2.833 1.00 0.00 N ATOM 1442 CA ARG A 106 1.609 -19.509 3.787 1.00 0.00 C ATOM 1443 C ARG A 106 2.989 -20.180 3.666 1.00 0.00 C ATOM 1444 O ARG A 106 3.366 -21.002 4.498 1.00 0.00 O ATOM 1445 CB ARG A 106 1.043 -19.586 5.223 1.00 0.00 C ATOM 1446 CG ARG A 106 1.690 -18.517 6.122 1.00 0.00 C ATOM 1447 CD ARG A 106 2.771 -19.030 7.087 1.00 0.00 C ATOM 1448 NE ARG A 106 2.175 -19.558 8.324 1.00 0.00 N ATOM 1449 CZ ARG A 106 2.836 -19.960 9.405 1.00 0.00 C ATOM 1450 NH1 ARG A 106 4.152 -20.018 9.451 1.00 0.00 N ATOM 1451 NH2 ARG A 106 2.165 -20.308 10.481 1.00 0.00 N ATOM 0 H ARG A 106 -0.188 -20.447 3.292 1.00 0.00 H new ATOM 0 HA ARG A 106 1.803 -18.467 3.532 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -0.038 -19.444 5.201 1.00 0.00 H new ATOM 0 HB3 ARG A 106 1.226 -20.577 5.639 1.00 0.00 H new ATOM 0 HG2 ARG A 106 2.131 -17.750 5.485 1.00 0.00 H new ATOM 0 HG3 ARG A 106 0.906 -18.035 6.706 1.00 0.00 H new ATOM 0 HD2 ARG A 106 3.355 -19.811 6.600 1.00 0.00 H new ATOM 0 HD3 ARG A 106 3.460 -18.220 7.329 1.00 0.00 H new ATOM 0 HE ARG A 106 1.157 -19.622 8.355 1.00 0.00 H new ATOM 0 HH11 ARG A 106 4.703 -19.748 8.636 1.00 0.00 H new ATOM 0 HH12 ARG A 106 4.619 -20.333 10.301 1.00 0.00 H new ATOM 0 HH21 ARG A 106 1.146 -20.268 10.482 1.00 0.00 H new ATOM 0 HH22 ARG A 106 2.664 -20.618 11.315 1.00 0.00 H new TER 1465 ARG A 106 ATOM 1466 N ALA B 10 -3.048 -9.834 8.393 1.00 0.00 N ATOM 1467 CA ALA B 10 -1.732 -9.934 7.740 1.00 0.00 C ATOM 1468 C ALA B 10 -1.174 -8.598 7.196 1.00 0.00 C ATOM 1469 O ALA B 10 -0.800 -8.508 6.028 1.00 0.00 O ATOM 1470 CB ALA B 10 -1.819 -11.072 6.715 1.00 0.00 C ATOM 0 HA ALA B 10 -0.972 -10.179 8.483 1.00 0.00 H new ATOM 0 HB1 ALA B 10 -0.860 -11.179 6.208 1.00 0.00 H new ATOM 0 HB2 ALA B 10 -2.065 -12.003 7.225 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -2.594 -10.844 5.983 1.00 0.00 H new ATOM 1476 N LEU B 11 -1.109 -7.572 8.064 1.00 0.00 N ATOM 1477 CA LEU B 11 -0.864 -6.154 7.741 1.00 0.00 C ATOM 1478 C LEU B 11 0.277 -5.876 6.750 1.00 0.00 C ATOM 1479 O LEU B 11 0.110 -5.031 5.870 1.00 0.00 O ATOM 1480 CB LEU B 11 -0.620 -5.339 9.034 1.00 0.00 C ATOM 1481 CG LEU B 11 -1.767 -5.194 10.058 1.00 0.00 C ATOM 1482 CD1 LEU B 11 -3.058 -4.666 9.417 1.00 0.00 C ATOM 1483 CD2 LEU B 11 -2.060 -6.480 10.847 1.00 0.00 C ATOM 0 H LEU B 11 -1.233 -7.718 9.066 1.00 0.00 H new ATOM 0 HA LEU B 11 -1.775 -5.839 7.233 1.00 0.00 H new ATOM 0 HB2 LEU B 11 0.227 -5.789 9.551 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -0.316 -4.335 8.737 1.00 0.00 H new ATOM 0 HG LEU B 11 -1.403 -4.455 10.772 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -3.834 -4.582 10.178 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -2.872 -3.686 8.978 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -3.386 -5.355 8.639 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -2.877 -6.300 11.546 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -2.342 -7.275 10.156 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -1.169 -6.779 11.400 1.00 0.00 H new ATOM 1495 N ALA B 12 1.419 -6.557 6.856 1.00 0.00 N ATOM 1496 CA ALA B 12 2.477 -6.429 5.850 1.00 0.00 C ATOM 1497 C ALA B 12 2.100 -7.145 4.536 1.00 0.00 C ATOM 1498 O ALA B 12 2.114 -6.541 3.462 1.00 0.00 O ATOM 1499 CB ALA B 12 3.787 -6.936 6.458 1.00 0.00 C ATOM 0 H ALA B 12 1.635 -7.197 7.620 1.00 0.00 H new ATOM 0 HA ALA B 12 2.608 -5.382 5.575 1.00 0.00 H new ATOM 0 HB1 ALA B 12 4.587 -6.848 5.723 1.00 0.00 H new ATOM 0 HB2 ALA B 12 4.035 -6.341 7.337 1.00 0.00 H new ATOM 0 HB3 ALA B 12 3.673 -7.981 6.748 1.00 0.00 H new ATOM 1505 N ARG B 13 1.712 -8.425 4.606 1.00 0.00 N ATOM 1506 CA ARG B 13 1.293 -9.257 3.458 1.00 0.00 C ATOM 1507 C ARG B 13 0.168 -8.617 2.624 1.00 0.00 C ATOM 1508 O ARG B 13 0.199 -8.690 1.394 1.00 0.00 O ATOM 1509 CB ARG B 13 0.829 -10.640 3.947 1.00 0.00 C ATOM 1510 CG ARG B 13 1.803 -11.361 4.896 1.00 0.00 C ATOM 1511 CD ARG B 13 3.099 -11.806 4.201 1.00 0.00 C ATOM 1512 NE ARG B 13 4.108 -12.227 5.183 1.00 0.00 N ATOM 1513 CZ ARG B 13 5.090 -13.109 5.056 1.00 0.00 C ATOM 1514 NH1 ARG B 13 5.168 -13.966 4.060 1.00 0.00 N ATOM 1515 NH2 ARG B 13 6.042 -13.140 5.951 1.00 0.00 N ATOM 0 H ARG B 13 1.678 -8.932 5.491 1.00 0.00 H new ATOM 0 HA ARG B 13 2.167 -9.350 2.813 1.00 0.00 H new ATOM 0 HB2 ARG B 13 -0.129 -10.526 4.454 1.00 0.00 H new ATOM 0 HB3 ARG B 13 0.656 -11.275 3.078 1.00 0.00 H new ATOM 0 HG2 ARG B 13 2.051 -10.699 5.725 1.00 0.00 H new ATOM 0 HG3 ARG B 13 1.308 -12.233 5.322 1.00 0.00 H new ATOM 0 HD2 ARG B 13 2.885 -12.629 3.519 1.00 0.00 H new ATOM 0 HD3 ARG B 13 3.492 -10.987 3.599 1.00 0.00 H new ATOM 0 HE ARG B 13 4.044 -11.775 6.095 1.00 0.00 H new ATOM 0 HH11 ARG B 13 4.450 -13.973 3.336 1.00 0.00 H new ATOM 0 HH12 ARG B 13 5.947 -14.623 4.012 1.00 0.00 H new ATOM 0 HH21 ARG B 13 6.024 -12.490 6.737 1.00 0.00 H new ATOM 0 HH22 ARG B 13 6.802 -13.814 5.864 1.00 0.00 H new ATOM 1529 N LEU B 14 -0.751 -7.903 3.282 1.00 0.00 N ATOM 1530 CA LEU B 14 -1.779 -7.033 2.714 1.00 0.00 C ATOM 1531 C LEU B 14 -1.156 -6.058 1.708 1.00 0.00 C ATOM 1532 O LEU B 14 -1.533 -6.079 0.541 1.00 0.00 O ATOM 1533 CB LEU B 14 -2.458 -6.341 3.917 1.00 0.00 C ATOM 1534 CG LEU B 14 -3.601 -5.338 3.686 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -3.197 -4.038 2.971 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -4.792 -5.985 2.989 1.00 0.00 C ATOM 0 H LEU B 14 -0.797 -7.921 4.301 1.00 0.00 H new ATOM 0 HA LEU B 14 -2.529 -7.580 2.142 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -2.843 -7.127 4.567 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.678 -5.821 4.473 1.00 0.00 H new ATOM 0 HG LEU B 14 -3.893 -5.037 4.692 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -4.072 -3.399 2.856 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -2.443 -3.518 3.561 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -2.789 -4.275 1.988 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -5.577 -5.242 2.845 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -4.479 -6.375 2.020 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -5.173 -6.801 3.603 1.00 0.00 H new ATOM 1548 N GLY B 15 -0.158 -5.263 2.119 1.00 0.00 N ATOM 1549 CA GLY B 15 0.544 -4.333 1.229 1.00 0.00 C ATOM 1550 C GLY B 15 1.464 -5.021 0.220 1.00 0.00 C ATOM 1551 O GLY B 15 1.766 -4.424 -0.810 1.00 0.00 O ATOM 0 H GLY B 15 0.184 -5.248 3.080 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -0.191 -3.737 0.689 1.00 0.00 H new ATOM 0 HA3 GLY B 15 1.133 -3.642 1.832 1.00 0.00 H new ATOM 1555 N ARG B 16 1.874 -6.280 0.451 1.00 0.00 N ATOM 1556 CA ARG B 16 2.542 -7.066 -0.600 1.00 0.00 C ATOM 1557 C ARG B 16 1.533 -7.345 -1.718 1.00 0.00 C ATOM 1558 O ARG B 16 1.811 -7.017 -2.862 1.00 0.00 O ATOM 1559 CB ARG B 16 3.155 -8.388 -0.091 1.00 0.00 C ATOM 1560 CG ARG B 16 4.115 -8.260 1.101 1.00 0.00 C ATOM 1561 CD ARG B 16 5.314 -7.350 0.818 1.00 0.00 C ATOM 1562 NE ARG B 16 6.056 -7.021 2.043 1.00 0.00 N ATOM 1563 CZ ARG B 16 5.696 -6.102 2.928 1.00 0.00 C ATOM 1564 NH1 ARG B 16 4.586 -5.416 2.837 1.00 0.00 N ATOM 1565 NH2 ARG B 16 6.444 -5.819 3.955 1.00 0.00 N ATOM 0 H ARG B 16 1.758 -6.768 1.339 1.00 0.00 H new ATOM 0 HA ARG B 16 3.380 -6.474 -0.967 1.00 0.00 H new ATOM 0 HB2 ARG B 16 2.343 -9.059 0.190 1.00 0.00 H new ATOM 0 HB3 ARG B 16 3.689 -8.861 -0.915 1.00 0.00 H new ATOM 0 HG2 ARG B 16 3.567 -7.871 1.960 1.00 0.00 H new ATOM 0 HG3 ARG B 16 4.477 -9.251 1.376 1.00 0.00 H new ATOM 0 HD2 ARG B 16 5.982 -7.840 0.110 1.00 0.00 H new ATOM 0 HD3 ARG B 16 4.968 -6.431 0.346 1.00 0.00 H new ATOM 0 HE ARG B 16 6.915 -7.540 2.227 1.00 0.00 H new ATOM 0 HH11 ARG B 16 3.949 -5.577 2.057 1.00 0.00 H new ATOM 0 HH12 ARG B 16 4.357 -4.720 3.547 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.328 -6.308 4.092 1.00 0.00 H new ATOM 0 HH22 ARG B 16 6.146 -5.108 4.623 1.00 0.00 H new ATOM 1579 N ALA B 17 0.337 -7.832 -1.367 1.00 0.00 N ATOM 1580 CA ALA B 17 -0.743 -8.198 -2.282 1.00 0.00 C ATOM 1581 C ALA B 17 -1.426 -6.995 -2.956 1.00 0.00 C ATOM 1582 O ALA B 17 -1.764 -7.079 -4.134 1.00 0.00 O ATOM 1583 CB ALA B 17 -1.747 -9.039 -1.483 1.00 0.00 C ATOM 0 H ALA B 17 0.087 -7.988 -0.390 1.00 0.00 H new ATOM 0 HA ALA B 17 -0.322 -8.765 -3.112 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -2.572 -9.334 -2.131 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -1.251 -9.930 -1.099 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -2.133 -8.451 -0.650 1.00 0.00 H new ATOM 1589 N LEU B 18 -1.612 -5.871 -2.258 1.00 0.00 N ATOM 1590 CA LEU B 18 -2.194 -4.655 -2.847 1.00 0.00 C ATOM 1591 C LEU B 18 -1.238 -3.933 -3.812 1.00 0.00 C ATOM 1592 O LEU B 18 -1.693 -3.102 -4.596 1.00 0.00 O ATOM 1593 CB LEU B 18 -2.697 -3.703 -1.740 1.00 0.00 C ATOM 1594 CG LEU B 18 -4.200 -3.858 -1.433 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -4.536 -5.203 -0.778 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -4.673 -2.714 -0.524 1.00 0.00 C ATOM 0 H LEU B 18 -1.366 -5.775 -1.273 1.00 0.00 H new ATOM 0 HA LEU B 18 -3.044 -4.974 -3.450 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -2.127 -3.885 -0.829 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -2.499 -2.674 -2.039 1.00 0.00 H new ATOM 0 HG LEU B 18 -4.722 -3.821 -2.389 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -5.607 -5.256 -0.585 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -4.247 -6.015 -1.445 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.993 -5.295 0.162 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -5.736 -2.833 -0.313 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -4.113 -2.737 0.411 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -4.507 -1.760 -1.024 1.00 0.00 H new ATOM 1608 N ALA B 19 0.055 -4.266 -3.791 1.00 0.00 N ATOM 1609 CA ALA B 19 1.037 -3.807 -4.775 1.00 0.00 C ATOM 1610 C ALA B 19 1.733 -4.968 -5.504 1.00 0.00 C ATOM 1611 O ALA B 19 2.905 -4.870 -5.863 1.00 0.00 O ATOM 1612 CB ALA B 19 2.011 -2.855 -4.088 1.00 0.00 C ATOM 0 H ALA B 19 0.456 -4.873 -3.076 1.00 0.00 H new ATOM 0 HA ALA B 19 0.523 -3.263 -5.568 1.00 0.00 H new ATOM 0 HB1 ALA B 19 2.749 -2.505 -4.810 1.00 0.00 H new ATOM 0 HB2 ALA B 19 1.464 -2.002 -3.686 1.00 0.00 H new ATOM 0 HB3 ALA B 19 2.518 -3.376 -3.276 1.00 0.00 H new ATOM 1618 N ASP B 20 1.043 -6.094 -5.656 1.00 0.00 N ATOM 1619 CA ASP B 20 1.417 -7.170 -6.567 1.00 0.00 C ATOM 1620 C ASP B 20 0.718 -6.875 -7.906 1.00 0.00 C ATOM 1621 O ASP B 20 -0.351 -6.261 -7.886 1.00 0.00 O ATOM 1622 CB ASP B 20 0.975 -8.522 -5.992 1.00 0.00 C ATOM 1623 CG ASP B 20 1.990 -9.174 -5.058 1.00 0.00 C ATOM 1624 OD1 ASP B 20 3.208 -8.909 -5.179 1.00 0.00 O ATOM 1625 OD2 ASP B 20 1.515 -9.995 -4.238 1.00 0.00 O ATOM 0 H ASP B 20 0.187 -6.288 -5.136 1.00 0.00 H new ATOM 0 HA ASP B 20 2.497 -7.222 -6.707 1.00 0.00 H new ATOM 0 HB2 ASP B 20 0.039 -8.384 -5.451 1.00 0.00 H new ATOM 0 HB3 ASP B 20 0.769 -9.204 -6.817 1.00 0.00 H new ATOM 1630 N PRO B 21 1.270 -7.340 -9.043 1.00 0.00 N ATOM 1631 CA PRO B 21 0.891 -6.960 -10.411 1.00 0.00 C ATOM 1632 C PRO B 21 -0.607 -7.157 -10.707 1.00 0.00 C ATOM 1633 O PRO B 21 -1.455 -6.318 -10.386 1.00 0.00 O ATOM 1634 CB PRO B 21 1.826 -7.811 -11.304 1.00 0.00 C ATOM 1635 CG PRO B 21 2.061 -9.051 -10.435 1.00 0.00 C ATOM 1636 CD PRO B 21 2.300 -8.370 -9.100 1.00 0.00 C ATOM 0 HA PRO B 21 1.017 -5.893 -10.595 1.00 0.00 H new ATOM 0 HB2 PRO B 21 1.361 -8.064 -12.257 1.00 0.00 H new ATOM 0 HB3 PRO B 21 2.756 -7.291 -11.532 1.00 0.00 H new ATOM 0 HG2 PRO B 21 1.201 -9.721 -10.417 1.00 0.00 H new ATOM 0 HG3 PRO B 21 2.917 -9.640 -10.766 1.00 0.00 H new ATOM 0 HD2 PRO B 21 2.209 -9.072 -8.271 1.00 0.00 H new ATOM 0 HD3 PRO B 21 3.300 -7.939 -9.045 1.00 0.00 H new ATOM 1644 N THR B 22 -0.937 -8.316 -11.274 1.00 0.00 N ATOM 1645 CA THR B 22 -2.286 -8.830 -11.474 1.00 0.00 C ATOM 1646 C THR B 22 -3.109 -8.815 -10.204 1.00 0.00 C ATOM 1647 O THR B 22 -4.318 -8.667 -10.295 1.00 0.00 O ATOM 1648 CB THR B 22 -2.197 -10.275 -11.940 1.00 0.00 C ATOM 1649 OG1 THR B 22 -1.274 -10.943 -11.111 1.00 0.00 O ATOM 1650 CG2 THR B 22 -1.741 -10.362 -13.387 1.00 0.00 C ATOM 0 H THR B 22 -0.226 -8.957 -11.626 1.00 0.00 H new ATOM 0 HA THR B 22 -2.769 -8.186 -12.209 1.00 0.00 H new ATOM 0 HB THR B 22 -3.183 -10.735 -11.877 1.00 0.00 H new ATOM 0 HG1 THR B 22 -1.205 -11.881 -11.387 1.00 0.00 H new ATOM 0 HG21 THR B 22 -1.688 -11.408 -13.689 1.00 0.00 H new ATOM 0 HG22 THR B 22 -2.451 -9.836 -14.025 1.00 0.00 H new ATOM 0 HG23 THR B 22 -0.756 -9.905 -13.486 1.00 0.00 H new ATOM 1658 N ARG B 23 -2.503 -8.976 -9.024 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.233 -9.056 -7.753 1.00 0.00 C ATOM 1660 C ARG B 23 -3.872 -7.709 -7.378 1.00 0.00 C ATOM 1661 O ARG B 23 -5.063 -7.680 -7.058 1.00 0.00 O ATOM 1662 CB ARG B 23 -2.321 -9.642 -6.662 1.00 0.00 C ATOM 1663 CG ARG B 23 -2.967 -10.815 -5.899 1.00 0.00 C ATOM 1664 CD ARG B 23 -2.016 -11.994 -5.701 1.00 0.00 C ATOM 1665 NE ARG B 23 -0.950 -11.707 -4.728 1.00 0.00 N ATOM 1666 CZ ARG B 23 -0.824 -12.248 -3.523 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -1.710 -13.096 -3.042 1.00 0.00 N ATOM 1668 NH2 ARG B 23 0.226 -11.921 -2.802 1.00 0.00 N ATOM 0 H ARG B 23 -1.491 -9.055 -8.922 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.074 -9.741 -7.862 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -1.391 -9.981 -7.118 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -2.060 -8.855 -5.954 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -3.309 -10.464 -4.925 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -3.849 -11.154 -6.443 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -2.584 -12.862 -5.366 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -1.567 -12.258 -6.658 1.00 0.00 H new ATOM 0 HE ARG B 23 -0.241 -11.028 -5.006 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -2.523 -13.355 -3.600 1.00 0.00 H new ATOM 0 HH12 ARG B 23 -1.583 -13.494 -2.111 1.00 0.00 H new ATOM 0 HH21 ARG B 23 0.916 -11.268 -3.173 1.00 0.00 H new ATOM 0 HH22 ARG B 23 0.350 -12.321 -1.872 1.00 0.00 H new ATOM 1682 N CYS B 24 -3.168 -6.585 -7.556 1.00 0.00 N ATOM 1683 CA CYS B 24 -3.759 -5.242 -7.486 1.00 0.00 C ATOM 1684 C CYS B 24 -4.828 -5.079 -8.584 1.00 0.00 C ATOM 1685 O CYS B 24 -5.942 -4.617 -8.318 1.00 0.00 O ATOM 1686 CB CYS B 24 -2.626 -4.212 -7.631 1.00 0.00 C ATOM 1687 SG CYS B 24 -3.271 -2.542 -7.329 1.00 0.00 S ATOM 0 H CYS B 24 -2.167 -6.581 -7.754 1.00 0.00 H new ATOM 0 HA CYS B 24 -4.258 -5.087 -6.529 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -1.826 -4.436 -6.925 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -2.195 -4.270 -8.630 1.00 0.00 H new ATOM 0 HG CYS B 24 -2.916 -2.148 -6.142 1.00 0.00 H new ATOM 1693 N ARG B 25 -4.528 -5.560 -9.801 1.00 0.00 N ATOM 1694 CA ARG B 25 -5.472 -5.566 -10.921 1.00 0.00 C ATOM 1695 C ARG B 25 -6.781 -6.311 -10.604 1.00 0.00 C ATOM 1696 O ARG B 25 -7.840 -5.736 -10.817 1.00 0.00 O ATOM 1697 CB ARG B 25 -4.786 -6.053 -12.213 1.00 0.00 C ATOM 1698 CG ARG B 25 -5.032 -5.108 -13.407 1.00 0.00 C ATOM 1699 CD ARG B 25 -4.077 -3.904 -13.451 1.00 0.00 C ATOM 1700 NE ARG B 25 -4.239 -2.986 -12.310 1.00 0.00 N ATOM 1701 CZ ARG B 25 -3.283 -2.231 -11.776 1.00 0.00 C ATOM 1702 NH1 ARG B 25 -2.074 -2.133 -12.274 1.00 0.00 N ATOM 1703 NH2 ARG B 25 -3.532 -1.532 -10.692 1.00 0.00 N ATOM 0 H ARG B 25 -3.618 -5.957 -10.033 1.00 0.00 H new ATOM 0 HA ARG B 25 -5.782 -4.535 -11.093 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -3.714 -6.142 -12.039 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -5.152 -7.049 -12.461 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -4.932 -5.674 -14.333 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -6.059 -4.744 -13.365 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -3.049 -4.266 -13.473 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -4.241 -3.353 -14.377 1.00 0.00 H new ATOM 0 HE ARG B 25 -5.167 -2.924 -11.892 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -1.825 -2.653 -13.116 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -1.382 -1.537 -11.820 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -4.456 -1.569 -10.262 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -2.801 -0.952 -10.280 1.00 0.00 H new ATOM 1717 N ILE B 26 -6.753 -7.511 -10.016 1.00 0.00 N ATOM 1718 CA ILE B 26 -7.940 -8.253 -9.543 1.00 0.00 C ATOM 1719 C ILE B 26 -8.739 -7.396 -8.568 1.00 0.00 C ATOM 1720 O ILE B 26 -9.933 -7.227 -8.764 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.550 -9.586 -8.853 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -6.806 -10.571 -9.778 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -8.765 -10.266 -8.200 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -7.597 -11.638 -10.534 1.00 0.00 C ATOM 0 H ILE B 26 -5.881 -8.013 -9.848 1.00 0.00 H new ATOM 0 HA ILE B 26 -8.547 -8.487 -10.417 1.00 0.00 H new ATOM 0 HB ILE B 26 -6.844 -9.307 -8.071 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -6.266 -9.980 -10.518 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -6.059 -11.085 -9.174 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -8.451 -11.197 -7.727 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -9.192 -9.603 -7.448 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -9.514 -10.481 -8.962 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -6.915 -12.240 -11.134 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -8.116 -12.280 -9.822 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -8.326 -11.157 -11.186 1.00 0.00 H new ATOM 1736 N LEU B 27 -8.092 -6.842 -7.537 1.00 0.00 N ATOM 1737 CA LEU B 27 -8.761 -6.037 -6.514 1.00 0.00 C ATOM 1738 C LEU B 27 -9.459 -4.803 -7.104 1.00 0.00 C ATOM 1739 O LEU B 27 -10.597 -4.536 -6.730 1.00 0.00 O ATOM 1740 CB LEU B 27 -7.741 -5.639 -5.433 1.00 0.00 C ATOM 1741 CG LEU B 27 -7.273 -6.776 -4.512 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -6.092 -6.299 -3.662 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -8.402 -7.227 -3.576 1.00 0.00 C ATOM 0 H LEU B 27 -7.087 -6.941 -7.390 1.00 0.00 H new ATOM 0 HA LEU B 27 -9.548 -6.643 -6.064 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -6.867 -5.210 -5.924 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -8.179 -4.853 -4.817 1.00 0.00 H new ATOM 0 HG LEU B 27 -6.975 -7.616 -5.139 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -5.763 -7.108 -3.010 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -5.271 -6.002 -4.314 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -6.401 -5.447 -3.056 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -8.043 -8.033 -2.935 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -8.720 -6.387 -2.959 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -9.245 -7.582 -4.168 1.00 0.00 H new ATOM 1755 N VAL B 28 -8.825 -4.088 -8.038 1.00 0.00 N ATOM 1756 CA VAL B 28 -9.419 -2.867 -8.632 1.00 0.00 C ATOM 1757 C VAL B 28 -10.445 -3.181 -9.735 1.00 0.00 C ATOM 1758 O VAL B 28 -11.417 -2.451 -9.899 1.00 0.00 O ATOM 1759 CB VAL B 28 -8.338 -1.864 -9.099 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -7.609 -2.280 -10.386 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -8.900 -0.444 -9.263 1.00 0.00 C ATOM 0 H VAL B 28 -7.903 -4.325 -8.404 1.00 0.00 H new ATOM 0 HA VAL B 28 -9.978 -2.377 -7.834 1.00 0.00 H new ATOM 0 HB VAL B 28 -7.601 -1.871 -8.296 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -6.868 -1.524 -10.645 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -7.111 -3.237 -10.229 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -8.330 -2.375 -11.198 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -8.106 0.226 -9.592 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -9.698 -0.452 -10.005 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -9.295 -0.097 -8.308 1.00 0.00 H new ATOM 1771 N ALA B 29 -10.275 -4.294 -10.457 1.00 0.00 N ATOM 1772 CA ALA B 29 -11.250 -4.776 -11.432 1.00 0.00 C ATOM 1773 C ALA B 29 -12.505 -5.355 -10.761 1.00 0.00 C ATOM 1774 O ALA B 29 -13.614 -5.157 -11.258 1.00 0.00 O ATOM 1775 CB ALA B 29 -10.551 -5.814 -12.311 1.00 0.00 C ATOM 0 H ALA B 29 -9.449 -4.888 -10.378 1.00 0.00 H new ATOM 0 HA ALA B 29 -11.603 -3.943 -12.040 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -11.253 -6.195 -13.052 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -9.704 -5.351 -12.818 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -10.196 -6.637 -11.690 1.00 0.00 H new ATOM 1781 N LEU B 30 -12.361 -6.027 -9.612 1.00 0.00 N ATOM 1782 CA LEU B 30 -13.493 -6.550 -8.882 1.00 0.00 C ATOM 1783 C LEU B 30 -14.444 -5.455 -8.419 1.00 0.00 C ATOM 1784 O LEU B 30 -15.644 -5.706 -8.455 1.00 0.00 O ATOM 1785 CB LEU B 30 -12.951 -7.320 -7.694 1.00 0.00 C ATOM 1786 CG LEU B 30 -14.021 -8.158 -6.992 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -14.790 -9.125 -7.906 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -13.219 -8.946 -5.981 1.00 0.00 C ATOM 0 H LEU B 30 -11.459 -6.216 -9.176 1.00 0.00 H new ATOM 0 HA LEU B 30 -14.075 -7.196 -9.539 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -12.145 -7.974 -8.028 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -12.518 -6.620 -6.980 1.00 0.00 H new ATOM 0 HG LEU B 30 -14.799 -7.515 -6.581 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -15.526 -9.674 -7.318 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -15.298 -8.560 -8.687 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -14.092 -9.828 -8.362 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -13.887 -9.591 -5.410 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -12.480 -9.557 -6.499 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -12.712 -8.259 -5.304 1.00 0.00 H new ATOM 1800 N LEU B 31 -13.899 -4.304 -8.001 1.00 0.00 N ATOM 1801 CA LEU B 31 -14.574 -3.122 -7.462 1.00 0.00 C ATOM 1802 C LEU B 31 -15.827 -2.744 -8.274 1.00 0.00 C ATOM 1803 O LEU B 31 -16.922 -2.707 -7.717 1.00 0.00 O ATOM 1804 CB LEU B 31 -13.488 -2.018 -7.443 1.00 0.00 C ATOM 1805 CG LEU B 31 -13.451 -1.070 -6.233 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -12.228 -0.171 -6.428 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -14.735 -0.246 -6.081 1.00 0.00 C ATOM 0 H LEU B 31 -12.889 -4.168 -8.036 1.00 0.00 H new ATOM 0 HA LEU B 31 -14.969 -3.293 -6.461 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -12.515 -2.504 -7.518 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -13.611 -1.411 -8.340 1.00 0.00 H new ATOM 0 HG LEU B 31 -13.380 -1.646 -5.310 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -12.152 0.526 -5.593 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -11.328 -0.785 -6.471 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -12.331 0.387 -7.359 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -14.649 0.404 -5.210 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -14.885 0.361 -6.974 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -15.584 -0.917 -5.951 1.00 0.00 H new ATOM 1819 N ASP B 32 -15.652 -2.579 -9.588 1.00 0.00 N ATOM 1820 CA ASP B 32 -16.705 -2.235 -10.560 1.00 0.00 C ATOM 1821 C ASP B 32 -17.416 -3.484 -11.126 1.00 0.00 C ATOM 1822 O ASP B 32 -18.480 -3.389 -11.738 1.00 0.00 O ATOM 1823 CB ASP B 32 -16.072 -1.436 -11.721 1.00 0.00 C ATOM 1824 CG ASP B 32 -15.645 0.009 -11.402 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -15.708 0.423 -10.223 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -15.259 0.704 -12.371 1.00 0.00 O ATOM 0 H ASP B 32 -14.737 -2.685 -10.026 1.00 0.00 H new ATOM 0 HA ASP B 32 -17.457 -1.641 -10.041 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -15.197 -1.981 -12.074 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -16.784 -1.408 -12.545 1.00 0.00 H new ATOM 1831 N GLY B 33 -16.823 -4.670 -10.945 1.00 0.00 N ATOM 1832 CA GLY B 33 -17.329 -5.944 -11.452 1.00 0.00 C ATOM 1833 C GLY B 33 -18.310 -6.601 -10.488 1.00 0.00 C ATOM 1834 O GLY B 33 -19.509 -6.641 -10.740 1.00 0.00 O ATOM 0 H GLY B 33 -15.951 -4.769 -10.425 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -17.820 -5.782 -12.412 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -16.492 -6.619 -11.632 1.00 0.00 H new ATOM 1838 N VAL B 34 -17.768 -7.215 -9.432 1.00 0.00 N ATOM 1839 CA VAL B 34 -18.464 -8.109 -8.477 1.00 0.00 C ATOM 1840 C VAL B 34 -19.523 -9.028 -9.117 1.00 0.00 C ATOM 1841 O VAL B 34 -20.599 -9.222 -8.558 1.00 0.00 O ATOM 1842 CB VAL B 34 -18.996 -7.350 -7.233 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -17.851 -6.777 -6.395 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -19.973 -6.216 -7.584 1.00 0.00 C ATOM 0 H VAL B 34 -16.781 -7.102 -9.201 1.00 0.00 H new ATOM 0 HA VAL B 34 -17.693 -8.792 -8.122 1.00 0.00 H new ATOM 0 HB VAL B 34 -19.542 -8.096 -6.655 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -18.259 -6.252 -5.532 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -17.207 -7.588 -6.055 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -17.269 -6.082 -7.001 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -20.307 -5.727 -6.669 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -19.472 -5.488 -8.222 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -20.834 -6.628 -8.110 1.00 0.00 H new ATOM 1854 N CYS B 35 -19.226 -9.600 -10.294 1.00 0.00 N ATOM 1855 CA CYS B 35 -20.203 -10.383 -11.059 1.00 0.00 C ATOM 1856 C CYS B 35 -20.212 -11.856 -10.642 1.00 0.00 C ATOM 1857 O CYS B 35 -21.137 -12.316 -9.987 1.00 0.00 O ATOM 1858 CB CYS B 35 -20.006 -10.193 -12.585 1.00 0.00 C ATOM 1859 SG CYS B 35 -19.258 -8.608 -13.065 1.00 0.00 S ATOM 0 H CYS B 35 -18.310 -9.533 -10.737 1.00 0.00 H new ATOM 0 HA CYS B 35 -21.194 -9.998 -10.819 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -19.380 -11.003 -12.960 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -20.975 -10.285 -13.076 1.00 0.00 H new ATOM 0 HG CYS B 35 -18.017 -8.798 -13.401 1.00 0.00 H new ATOM 1865 N TYR B 36 -19.168 -12.599 -11.023 1.00 0.00 N ATOM 1866 CA TYR B 36 -19.125 -14.059 -10.884 1.00 0.00 C ATOM 1867 C TYR B 36 -17.688 -14.604 -10.821 1.00 0.00 C ATOM 1868 O TYR B 36 -16.770 -13.918 -11.288 1.00 0.00 O ATOM 1869 CB TYR B 36 -19.947 -14.709 -12.019 1.00 0.00 C ATOM 1870 CG TYR B 36 -19.544 -14.365 -13.437 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -18.568 -15.124 -14.110 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -20.182 -13.298 -14.097 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -18.208 -14.800 -15.433 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -19.815 -12.955 -15.411 1.00 0.00 C ATOM 1875 CZ TYR B 36 -18.825 -13.704 -16.083 1.00 0.00 C ATOM 1876 OH TYR B 36 -18.466 -13.357 -17.348 1.00 0.00 O ATOM 0 H TYR B 36 -18.325 -12.203 -11.439 1.00 0.00 H new ATOM 0 HA TYR B 36 -19.577 -14.326 -9.929 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -19.890 -15.791 -11.903 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -20.992 -14.429 -11.885 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -18.094 -15.956 -13.611 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -20.957 -12.740 -13.592 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -17.463 -15.386 -15.950 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -20.290 -12.120 -15.905 1.00 0.00 H new ATOM 0 HH TYR B 36 -18.993 -12.583 -17.637 1.00 0.00 H new ATOM 1886 N PRO B 37 -17.448 -15.806 -10.255 1.00 0.00 N ATOM 1887 CA PRO B 37 -16.115 -16.395 -10.198 1.00 0.00 C ATOM 1888 C PRO B 37 -15.580 -16.596 -11.614 1.00 0.00 C ATOM 1889 O PRO B 37 -16.243 -17.193 -12.458 1.00 0.00 O ATOM 1890 CB PRO B 37 -16.258 -17.710 -9.423 1.00 0.00 C ATOM 1891 CG PRO B 37 -17.729 -18.073 -9.609 1.00 0.00 C ATOM 1892 CD PRO B 37 -18.398 -16.702 -9.615 1.00 0.00 C ATOM 0 HA PRO B 37 -15.394 -15.753 -9.692 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -15.600 -18.483 -9.819 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -16.005 -17.585 -8.370 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -17.901 -18.614 -10.539 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -18.099 -18.703 -8.800 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -19.341 -16.728 -10.161 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -18.626 -16.373 -8.601 1.00 0.00 H new ATOM 1900 N GLY B 38 -14.397 -16.041 -11.887 1.00 0.00 N ATOM 1901 CA GLY B 38 -13.815 -16.059 -13.228 1.00 0.00 C ATOM 1902 C GLY B 38 -14.286 -14.930 -14.146 1.00 0.00 C ATOM 1903 O GLY B 38 -13.744 -14.825 -15.239 1.00 0.00 O ATOM 0 H GLY B 38 -13.820 -15.570 -11.190 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -12.730 -16.007 -13.139 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -14.051 -17.013 -13.699 1.00 0.00 H new ATOM 1907 N GLN B 39 -15.192 -14.036 -13.713 1.00 0.00 N ATOM 1908 CA GLN B 39 -15.514 -12.810 -14.468 1.00 0.00 C ATOM 1909 C GLN B 39 -14.254 -11.968 -14.714 1.00 0.00 C ATOM 1910 O GLN B 39 -14.099 -11.410 -15.795 1.00 0.00 O ATOM 1911 CB GLN B 39 -16.611 -11.968 -13.791 1.00 0.00 C ATOM 1912 CG GLN B 39 -16.173 -11.099 -12.595 1.00 0.00 C ATOM 1913 CD GLN B 39 -15.561 -9.729 -12.920 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -16.015 -8.995 -13.908 1.00 0.00 O flip ATOM 1915 NE2 GLN B 39 -14.657 -9.275 -12.246 1.00 0.00 N flip ATOM 0 H GLN B 39 -15.715 -14.139 -12.843 1.00 0.00 H new ATOM 0 HA GLN B 39 -15.911 -13.132 -15.431 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -17.052 -11.315 -14.544 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -17.398 -12.642 -13.453 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -17.041 -10.940 -11.955 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -15.447 -11.665 -12.012 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -14.278 -9.817 -11.469 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -14.277 -8.352 -12.457 1.00 0.00 H new ATOM 1924 N LEU B 40 -13.330 -11.939 -13.738 1.00 0.00 N ATOM 1925 CA LEU B 40 -12.096 -11.149 -13.794 1.00 0.00 C ATOM 1926 C LEU B 40 -11.196 -11.568 -14.957 1.00 0.00 C ATOM 1927 O LEU B 40 -10.335 -10.793 -15.348 1.00 0.00 O ATOM 1928 CB LEU B 40 -11.296 -11.252 -12.479 1.00 0.00 C ATOM 1929 CG LEU B 40 -12.073 -10.856 -11.209 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -11.753 -11.822 -10.066 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -11.772 -9.400 -10.837 1.00 0.00 C ATOM 0 H LEU B 40 -13.425 -12.474 -12.875 1.00 0.00 H new ATOM 0 HA LEU B 40 -12.408 -10.116 -13.947 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.943 -12.277 -12.366 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -10.413 -10.618 -12.558 1.00 0.00 H new ATOM 0 HG LEU B 40 -13.143 -10.929 -11.403 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -12.309 -11.529 -9.176 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -12.037 -12.834 -10.355 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -10.685 -11.792 -9.852 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -12.327 -9.132 -9.938 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.704 -9.285 -10.652 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -12.071 -8.746 -11.656 1.00 0.00 H new ATOM 1943 N ALA B 41 -11.395 -12.761 -15.521 1.00 0.00 N ATOM 1944 CA ALA B 41 -10.650 -13.203 -16.700 1.00 0.00 C ATOM 1945 C ALA B 41 -10.910 -12.271 -17.900 1.00 0.00 C ATOM 1946 O ALA B 41 -9.998 -12.008 -18.677 1.00 0.00 O ATOM 1947 CB ALA B 41 -11.052 -14.647 -17.013 1.00 0.00 C ATOM 0 H ALA B 41 -12.071 -13.442 -15.176 1.00 0.00 H new ATOM 0 HA ALA B 41 -9.580 -13.162 -16.499 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -10.506 -14.995 -17.890 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -10.813 -15.284 -16.161 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -12.123 -14.692 -17.211 1.00 0.00 H new ATOM 1953 N ALA B 42 -12.131 -11.730 -18.019 1.00 0.00 N ATOM 1954 CA ALA B 42 -12.502 -10.758 -19.049 1.00 0.00 C ATOM 1955 C ALA B 42 -12.039 -9.329 -18.713 1.00 0.00 C ATOM 1956 O ALA B 42 -11.564 -8.630 -19.599 1.00 0.00 O ATOM 1957 CB ALA B 42 -14.020 -10.839 -19.255 1.00 0.00 C ATOM 0 H ALA B 42 -12.899 -11.962 -17.390 1.00 0.00 H new ATOM 0 HA ALA B 42 -11.989 -11.008 -19.978 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -14.322 -10.123 -20.019 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -14.291 -11.846 -19.574 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -14.527 -10.606 -18.319 1.00 0.00 H new ATOM 1963 N HIS B 43 -12.111 -8.907 -17.445 1.00 0.00 N ATOM 1964 CA HIS B 43 -11.537 -7.623 -17.014 1.00 0.00 C ATOM 1965 C HIS B 43 -10.003 -7.533 -17.198 1.00 0.00 C ATOM 1966 O HIS B 43 -9.475 -6.446 -17.437 1.00 0.00 O ATOM 1967 CB HIS B 43 -11.866 -7.398 -15.530 1.00 0.00 C ATOM 1968 CG HIS B 43 -13.213 -6.808 -15.200 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -13.727 -6.750 -13.935 1.00 0.00 N flip ATOM 1970 CD2 HIS B 43 -13.957 -5.963 -16.022 1.00 0.00 C flip ATOM 1971 CE1 HIS B 43 -14.761 -5.842 -13.966 1.00 0.00 C flip ATOM 1972 NE2 HIS B 43 -14.881 -5.398 -15.229 1.00 0.00 N flip ATOM 0 H HIS B 43 -12.561 -9.435 -16.698 1.00 0.00 H new ATOM 0 HA HIS B 43 -11.981 -6.856 -17.649 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -11.783 -8.357 -15.018 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -11.100 -6.745 -15.110 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -13.818 -5.797 -17.080 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -15.368 -5.540 -13.125 1.00 0.00 H new ATOM 0 HE2 HIS B 43 -15.579 -4.724 -15.542 1.00 0.00 H new ATOM 1980 N LEU B 44 -9.282 -8.651 -17.014 1.00 0.00 N ATOM 1981 CA LEU B 44 -7.810 -8.694 -17.008 1.00 0.00 C ATOM 1982 C LEU B 44 -7.187 -9.256 -18.291 1.00 0.00 C ATOM 1983 O LEU B 44 -6.011 -9.005 -18.534 1.00 0.00 O ATOM 1984 CB LEU B 44 -7.319 -9.514 -15.792 1.00 0.00 C ATOM 1985 CG LEU B 44 -7.807 -9.007 -14.420 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -7.065 -9.688 -13.278 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -7.684 -7.487 -14.236 1.00 0.00 C ATOM 0 H LEU B 44 -9.711 -9.564 -16.863 1.00 0.00 H new ATOM 0 HA LEU B 44 -7.480 -7.657 -16.943 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.643 -10.547 -15.916 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.229 -9.519 -15.793 1.00 0.00 H new ATOM 0 HG LEU B 44 -8.866 -9.263 -14.396 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.434 -9.307 -12.326 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.231 -10.764 -13.327 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -5.998 -9.481 -13.363 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -8.047 -7.210 -13.247 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -6.639 -7.192 -14.335 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -8.278 -6.979 -14.996 1.00 0.00 H new ATOM 1999 N GLY B 45 -7.916 -10.061 -19.072 1.00 0.00 N ATOM 2000 CA GLY B 45 -7.368 -10.811 -20.211 1.00 0.00 C ATOM 2001 C GLY B 45 -6.564 -12.054 -19.811 1.00 0.00 C ATOM 2002 O GLY B 45 -5.900 -12.646 -20.662 1.00 0.00 O ATOM 0 H GLY B 45 -8.915 -10.213 -18.930 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -8.188 -11.115 -20.861 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -6.728 -10.149 -20.794 1.00 0.00 H new ATOM 2006 N LEU B 46 -6.575 -12.434 -18.526 1.00 0.00 N ATOM 2007 CA LEU B 46 -5.808 -13.572 -18.005 1.00 0.00 C ATOM 2008 C LEU B 46 -6.690 -14.790 -17.725 1.00 0.00 C ATOM 2009 O LEU B 46 -7.886 -14.670 -17.457 1.00 0.00 O ATOM 2010 CB LEU B 46 -5.042 -13.159 -16.739 1.00 0.00 C ATOM 2011 CG LEU B 46 -3.654 -12.560 -17.040 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -3.702 -11.173 -17.694 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -2.921 -12.447 -15.708 1.00 0.00 C ATOM 0 H LEU B 46 -7.123 -11.954 -17.812 1.00 0.00 H new ATOM 0 HA LEU B 46 -5.097 -13.865 -18.777 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -5.633 -12.430 -16.185 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -4.923 -14.029 -16.093 1.00 0.00 H new ATOM 0 HG LEU B 46 -3.153 -13.215 -17.753 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -2.686 -10.820 -17.874 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -4.237 -11.236 -18.641 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -4.216 -10.476 -17.032 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -1.929 -12.026 -15.873 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -3.484 -11.798 -15.037 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -2.825 -13.436 -15.260 1.00 0.00 H new ATOM 2025 N THR B 47 -6.064 -15.974 -17.743 1.00 0.00 N ATOM 2026 CA THR B 47 -6.733 -17.265 -17.514 1.00 0.00 C ATOM 2027 C THR B 47 -7.403 -17.335 -16.143 1.00 0.00 C ATOM 2028 O THR B 47 -6.863 -16.835 -15.154 1.00 0.00 O ATOM 2029 CB THR B 47 -5.783 -18.454 -17.776 1.00 0.00 C ATOM 2030 OG1 THR B 47 -6.346 -19.655 -17.290 1.00 0.00 O ATOM 2031 CG2 THR B 47 -4.411 -18.293 -17.129 1.00 0.00 C ATOM 0 H THR B 47 -5.064 -16.065 -17.920 1.00 0.00 H new ATOM 0 HA THR B 47 -7.538 -17.343 -18.244 1.00 0.00 H new ATOM 0 HB THR B 47 -5.651 -18.483 -18.858 1.00 0.00 H new ATOM 0 HG1 THR B 47 -5.673 -20.367 -17.319 1.00 0.00 H new ATOM 0 HG21 THR B 47 -3.798 -19.165 -17.355 1.00 0.00 H new ATOM 0 HG22 THR B 47 -3.927 -17.398 -17.520 1.00 0.00 H new ATOM 0 HG23 THR B 47 -4.527 -18.201 -16.049 1.00 0.00 H new ATOM 2039 N ARG B 48 -8.543 -18.032 -16.062 1.00 0.00 N ATOM 2040 CA ARG B 48 -9.220 -18.406 -14.810 1.00 0.00 C ATOM 2041 C ARG B 48 -8.318 -19.216 -13.877 1.00 0.00 C ATOM 2042 O ARG B 48 -8.520 -19.177 -12.663 1.00 0.00 O ATOM 2043 CB ARG B 48 -10.494 -19.204 -15.136 1.00 0.00 C ATOM 2044 CG ARG B 48 -11.722 -18.279 -15.158 1.00 0.00 C ATOM 2045 CD ARG B 48 -12.885 -18.857 -15.967 1.00 0.00 C ATOM 2046 NE ARG B 48 -12.519 -18.889 -17.384 1.00 0.00 N ATOM 2047 CZ ARG B 48 -13.144 -19.456 -18.397 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -14.323 -20.030 -18.284 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -12.534 -19.448 -19.554 1.00 0.00 N ATOM 0 H ARG B 48 -9.037 -18.363 -16.891 1.00 0.00 H new ATOM 0 HA ARG B 48 -9.477 -17.486 -14.285 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -10.385 -19.695 -16.103 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -10.637 -19.990 -14.394 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -12.052 -18.096 -14.135 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -11.437 -17.314 -15.578 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -13.122 -19.862 -15.618 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -13.779 -18.251 -15.824 1.00 0.00 H new ATOM 0 HE ARG B 48 -11.655 -18.402 -17.622 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -14.796 -20.050 -17.380 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -14.764 -20.455 -19.100 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -11.615 -19.015 -19.643 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -12.978 -19.875 -20.367 1.00 0.00 H new ATOM 2063 N SER B 49 -7.306 -19.894 -14.413 1.00 0.00 N ATOM 2064 CA SER B 49 -6.233 -20.536 -13.644 1.00 0.00 C ATOM 2065 C SER B 49 -5.486 -19.484 -12.813 1.00 0.00 C ATOM 2066 O SER B 49 -5.493 -19.520 -11.581 1.00 0.00 O ATOM 2067 CB SER B 49 -5.255 -21.253 -14.598 1.00 0.00 C ATOM 2068 OG SER B 49 -5.938 -21.973 -15.609 1.00 0.00 O ATOM 0 H SER B 49 -7.203 -20.018 -15.420 1.00 0.00 H new ATOM 0 HA SER B 49 -6.670 -21.274 -12.971 1.00 0.00 H new ATOM 0 HB2 SER B 49 -4.593 -20.519 -15.058 1.00 0.00 H new ATOM 0 HB3 SER B 49 -4.626 -21.936 -14.027 1.00 0.00 H new ATOM 0 HG SER B 49 -5.287 -22.412 -16.195 1.00 0.00 H new ATOM 2074 N ASN B 50 -4.911 -18.486 -13.487 1.00 0.00 N ATOM 2075 CA ASN B 50 -4.120 -17.434 -12.865 1.00 0.00 C ATOM 2076 C ASN B 50 -5.019 -16.460 -12.092 1.00 0.00 C ATOM 2077 O ASN B 50 -4.698 -16.136 -10.953 1.00 0.00 O ATOM 2078 CB ASN B 50 -3.219 -16.743 -13.902 1.00 0.00 C ATOM 2079 CG ASN B 50 -2.117 -17.676 -14.412 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -2.347 -18.834 -14.739 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -0.886 -17.216 -14.453 1.00 0.00 N ATOM 0 H ASN B 50 -4.986 -18.389 -14.500 1.00 0.00 H new ATOM 0 HA ASN B 50 -3.451 -17.879 -12.129 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -3.826 -16.404 -14.742 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -2.767 -15.856 -13.457 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -0.125 -17.823 -14.757 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -0.692 -16.252 -14.181 1.00 0.00 H new ATOM 2088 N VAL B 51 -6.181 -16.042 -12.616 1.00 0.00 N ATOM 2089 CA VAL B 51 -7.162 -15.254 -11.852 1.00 0.00 C ATOM 2090 C VAL B 51 -7.546 -15.941 -10.529 1.00 0.00 C ATOM 2091 O VAL B 51 -7.586 -15.257 -9.510 1.00 0.00 O ATOM 2092 CB VAL B 51 -8.403 -14.928 -12.728 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -9.716 -14.717 -11.953 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -8.144 -13.706 -13.630 1.00 0.00 C ATOM 0 H VAL B 51 -6.467 -16.239 -13.575 1.00 0.00 H new ATOM 0 HA VAL B 51 -6.694 -14.308 -11.578 1.00 0.00 H new ATOM 0 HB VAL B 51 -8.545 -15.826 -13.329 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -10.521 -14.495 -12.654 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -9.959 -15.622 -11.396 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -9.599 -13.884 -11.259 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -9.030 -13.503 -14.231 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -7.919 -12.838 -13.011 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -7.299 -13.912 -14.288 1.00 0.00 H new ATOM 2104 N SER B 52 -7.731 -17.270 -10.490 1.00 0.00 N ATOM 2105 CA SER B 52 -7.995 -17.972 -9.218 1.00 0.00 C ATOM 2106 C SER B 52 -6.792 -17.991 -8.272 1.00 0.00 C ATOM 2107 O SER B 52 -6.969 -17.792 -7.075 1.00 0.00 O ATOM 2108 CB SER B 52 -8.430 -19.419 -9.421 1.00 0.00 C ATOM 2109 OG SER B 52 -9.604 -19.483 -10.210 1.00 0.00 O ATOM 0 H SER B 52 -7.704 -17.875 -11.310 1.00 0.00 H new ATOM 0 HA SER B 52 -8.803 -17.394 -8.770 1.00 0.00 H new ATOM 0 HB2 SER B 52 -7.630 -19.980 -9.904 1.00 0.00 H new ATOM 0 HB3 SER B 52 -8.610 -19.889 -8.454 1.00 0.00 H new ATOM 0 HG SER B 52 -9.376 -19.319 -11.149 1.00 0.00 H new ATOM 2115 N ASN B 53 -5.581 -18.176 -8.799 1.00 0.00 N ATOM 2116 CA ASN B 53 -4.334 -18.070 -8.039 1.00 0.00 C ATOM 2117 C ASN B 53 -4.192 -16.685 -7.393 1.00 0.00 C ATOM 2118 O ASN B 53 -3.975 -16.570 -6.188 1.00 0.00 O ATOM 2119 CB ASN B 53 -3.162 -18.356 -8.988 1.00 0.00 C ATOM 2120 CG ASN B 53 -2.810 -19.836 -9.021 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -1.968 -20.300 -8.274 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -3.442 -20.618 -9.875 1.00 0.00 N ATOM 0 H ASN B 53 -5.436 -18.407 -9.782 1.00 0.00 H new ATOM 0 HA ASN B 53 -4.339 -18.798 -7.228 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -3.418 -18.021 -9.993 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -2.291 -17.782 -8.673 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -3.226 -21.614 -9.911 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -4.147 -20.226 -10.500 1.00 0.00 H new ATOM 2129 N HIS B 54 -4.407 -15.622 -8.171 1.00 0.00 N ATOM 2130 CA HIS B 54 -4.427 -14.268 -7.639 1.00 0.00 C ATOM 2131 C HIS B 54 -5.531 -14.077 -6.582 1.00 0.00 C ATOM 2132 O HIS B 54 -5.271 -13.401 -5.593 1.00 0.00 O ATOM 2133 CB HIS B 54 -4.601 -13.248 -8.769 1.00 0.00 C ATOM 2134 CG HIS B 54 -3.698 -13.383 -9.968 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -4.120 -13.365 -11.278 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -2.333 -13.524 -9.991 1.00 0.00 C ATOM 2137 CE1 HIS B 54 -3.054 -13.546 -12.068 1.00 0.00 C ATOM 2138 NE2 HIS B 54 -1.942 -13.635 -11.327 1.00 0.00 N ATOM 0 H HIS B 54 -4.570 -15.679 -9.176 1.00 0.00 H new ATOM 0 HA HIS B 54 -3.467 -14.102 -7.149 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -5.633 -13.302 -9.116 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -4.458 -12.252 -8.349 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -1.680 -13.545 -9.131 1.00 0.00 H new ATOM 0 HE1 HIS B 54 -3.086 -13.611 -13.146 1.00 0.00 H new ATOM 0 HE2 HIS B 54 -0.991 -13.760 -11.673 1.00 0.00 H new ATOM 2146 N LEU B 55 -6.721 -14.676 -6.769 1.00 0.00 N ATOM 2147 CA LEU B 55 -7.823 -14.686 -5.799 1.00 0.00 C ATOM 2148 C LEU B 55 -7.563 -15.555 -4.566 1.00 0.00 C ATOM 2149 O LEU B 55 -8.265 -15.372 -3.582 1.00 0.00 O ATOM 2150 CB LEU B 55 -9.118 -15.196 -6.454 1.00 0.00 C ATOM 2151 CG LEU B 55 -9.826 -14.222 -7.407 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -10.810 -15.030 -8.261 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -10.584 -13.153 -6.607 1.00 0.00 C ATOM 0 H LEU B 55 -6.946 -15.181 -7.626 1.00 0.00 H new ATOM 0 HA LEU B 55 -7.914 -13.650 -5.473 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -8.887 -16.107 -7.005 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -9.817 -15.470 -5.663 1.00 0.00 H new ATOM 0 HG LEU B 55 -9.096 -13.718 -8.040 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -11.328 -14.362 -8.949 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -10.265 -15.784 -8.829 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -11.537 -15.519 -7.613 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -11.081 -12.469 -7.294 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -11.328 -13.633 -5.971 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -9.881 -12.597 -5.986 1.00 0.00 H new ATOM 2165 N SER B 56 -6.661 -16.533 -4.583 1.00 0.00 N ATOM 2166 CA SER B 56 -6.517 -17.481 -3.466 1.00 0.00 C ATOM 2167 C SER B 56 -6.137 -16.793 -2.152 1.00 0.00 C ATOM 2168 O SER B 56 -6.954 -16.763 -1.226 1.00 0.00 O ATOM 2169 CB SER B 56 -5.596 -18.645 -3.849 1.00 0.00 C ATOM 2170 OG SER B 56 -6.154 -19.857 -3.368 1.00 0.00 O ATOM 0 H SER B 56 -6.015 -16.695 -5.356 1.00 0.00 H new ATOM 0 HA SER B 56 -7.497 -17.917 -3.270 1.00 0.00 H new ATOM 0 HB2 SER B 56 -5.477 -18.690 -4.932 1.00 0.00 H new ATOM 0 HB3 SER B 56 -4.603 -18.494 -3.425 1.00 0.00 H new ATOM 0 HG SER B 56 -5.549 -20.257 -2.709 1.00 0.00 H new ATOM 2176 N CYS B 57 -4.998 -16.095 -2.125 1.00 0.00 N ATOM 2177 CA CYS B 57 -4.549 -15.389 -0.921 1.00 0.00 C ATOM 2178 C CYS B 57 -5.393 -14.123 -0.660 1.00 0.00 C ATOM 2179 O CYS B 57 -5.628 -13.718 0.474 1.00 0.00 O ATOM 2180 CB CYS B 57 -3.038 -15.181 -1.069 1.00 0.00 C ATOM 2181 SG CYS B 57 -2.280 -13.824 -0.094 1.00 0.00 S ATOM 0 H CYS B 57 -4.370 -16.004 -2.923 1.00 0.00 H new ATOM 0 HA CYS B 57 -4.711 -15.966 -0.010 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -2.540 -16.112 -0.797 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -2.823 -15.001 -2.122 1.00 0.00 H new ATOM 2186 N LEU B 58 -5.959 -13.567 -1.735 1.00 0.00 N ATOM 2187 CA LEU B 58 -6.965 -12.510 -1.715 1.00 0.00 C ATOM 2188 C LEU B 58 -8.165 -12.902 -0.843 1.00 0.00 C ATOM 2189 O LEU B 58 -8.609 -12.102 -0.019 1.00 0.00 O ATOM 2190 CB LEU B 58 -7.392 -12.249 -3.175 1.00 0.00 C ATOM 2191 CG LEU B 58 -7.250 -10.791 -3.627 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -5.777 -10.420 -3.802 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -7.968 -10.609 -4.968 1.00 0.00 C ATOM 0 H LEU B 58 -5.716 -13.856 -2.682 1.00 0.00 H new ATOM 0 HA LEU B 58 -6.551 -11.602 -1.277 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -6.795 -12.880 -3.833 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -8.431 -12.554 -3.297 1.00 0.00 H new ATOM 0 HG LEU B 58 -7.690 -10.146 -2.867 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -5.699 -9.381 -4.123 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -5.255 -10.547 -2.854 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -5.326 -11.067 -4.554 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -7.871 -9.574 -5.295 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -7.521 -11.268 -5.712 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -9.023 -10.855 -4.852 1.00 0.00 H new ATOM 2205 N ARG B 59 -8.697 -14.114 -1.033 1.00 0.00 N ATOM 2206 CA ARG B 59 -9.826 -14.652 -0.275 1.00 0.00 C ATOM 2207 C ARG B 59 -9.396 -15.257 1.068 1.00 0.00 C ATOM 2208 O ARG B 59 -10.222 -15.330 1.970 1.00 0.00 O ATOM 2209 CB ARG B 59 -10.568 -15.691 -1.123 1.00 0.00 C ATOM 2210 CG ARG B 59 -11.139 -15.124 -2.446 1.00 0.00 C ATOM 2211 CD ARG B 59 -11.639 -16.251 -3.358 1.00 0.00 C ATOM 2212 NE ARG B 59 -10.538 -17.162 -3.737 1.00 0.00 N ATOM 2213 CZ ARG B 59 -10.633 -18.419 -4.157 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -11.801 -18.973 -4.390 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -9.560 -19.158 -4.344 1.00 0.00 N ATOM 0 H ARG B 59 -8.344 -14.763 -1.737 1.00 0.00 H new ATOM 0 HA ARG B 59 -10.495 -13.823 -0.044 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -9.888 -16.511 -1.353 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -11.385 -16.110 -0.535 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -11.957 -14.438 -2.228 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -10.370 -14.549 -2.961 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -12.421 -16.814 -2.849 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -12.086 -15.824 -4.256 1.00 0.00 H new ATOM 0 HE ARG B 59 -9.594 -16.781 -3.668 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -12.657 -18.437 -4.249 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -11.852 -19.939 -4.712 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -8.635 -18.768 -4.166 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -9.654 -20.121 -4.667 1.00 0.00 H new ATOM 2229 N GLY B 60 -8.127 -15.641 1.238 1.00 0.00 N ATOM 2230 CA GLY B 60 -7.598 -16.181 2.498 1.00 0.00 C ATOM 2231 C GLY B 60 -7.308 -15.104 3.540 1.00 0.00 C ATOM 2232 O GLY B 60 -7.927 -15.093 4.599 1.00 0.00 O ATOM 0 H GLY B 60 -7.429 -15.586 0.497 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -8.314 -16.892 2.910 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -6.682 -16.734 2.292 1.00 0.00 H new ATOM 2236 N CYS B 61 -6.412 -14.167 3.221 1.00 0.00 N ATOM 2237 CA CYS B 61 -5.987 -13.077 4.093 1.00 0.00 C ATOM 2238 C CYS B 61 -7.100 -12.016 4.378 1.00 0.00 C ATOM 2239 O CYS B 61 -6.913 -11.112 5.199 1.00 0.00 O ATOM 2240 CB CYS B 61 -4.699 -12.525 3.445 1.00 0.00 C ATOM 2241 SG CYS B 61 -3.179 -13.488 3.797 1.00 0.00 S ATOM 0 H CYS B 61 -5.947 -14.149 2.313 1.00 0.00 H new ATOM 0 HA CYS B 61 -5.783 -13.427 5.105 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -4.843 -12.484 2.365 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -4.549 -11.501 3.786 1.00 0.00 H new ATOM 2246 N GLY B 62 -8.242 -12.126 3.677 1.00 0.00 N ATOM 2247 CA GLY B 62 -9.484 -11.364 3.882 1.00 0.00 C ATOM 2248 C GLY B 62 -9.698 -10.170 2.946 1.00 0.00 C ATOM 2249 O GLY B 62 -10.642 -9.414 3.145 1.00 0.00 O ATOM 0 H GLY B 62 -8.327 -12.789 2.907 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -10.328 -12.045 3.770 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -9.500 -11.003 4.910 1.00 0.00 H new ATOM 2253 N LEU B 63 -8.853 -9.993 1.920 1.00 0.00 N ATOM 2254 CA LEU B 63 -8.874 -8.871 0.976 1.00 0.00 C ATOM 2255 C LEU B 63 -10.127 -8.859 0.086 1.00 0.00 C ATOM 2256 O LEU B 63 -10.558 -7.802 -0.374 1.00 0.00 O ATOM 2257 CB LEU B 63 -7.609 -8.959 0.119 1.00 0.00 C ATOM 2258 CG LEU B 63 -6.333 -9.487 0.819 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -5.183 -9.077 -0.067 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -6.078 -8.942 2.231 1.00 0.00 C ATOM 0 H LEU B 63 -8.105 -10.657 1.719 1.00 0.00 H new ATOM 0 HA LEU B 63 -8.903 -7.940 1.542 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.820 -9.603 -0.735 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -7.395 -7.966 -0.276 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.449 -10.563 0.952 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -4.246 -9.420 0.371 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.307 -9.523 -1.054 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.164 -7.991 -0.159 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -5.160 -9.376 2.628 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -5.978 -7.857 2.190 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -6.914 -9.205 2.879 1.00 0.00 H new ATOM 2272 N VAL B 64 -10.710 -10.036 -0.131 1.00 0.00 N ATOM 2273 CA VAL B 64 -11.973 -10.290 -0.838 1.00 0.00 C ATOM 2274 C VAL B 64 -12.753 -11.415 -0.163 1.00 0.00 C ATOM 2275 O VAL B 64 -12.181 -12.231 0.553 1.00 0.00 O ATOM 2276 CB VAL B 64 -11.763 -10.681 -2.322 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -11.466 -9.461 -3.195 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -10.623 -11.656 -2.506 1.00 0.00 C ATOM 0 H VAL B 64 -10.286 -10.901 0.204 1.00 0.00 H new ATOM 0 HA VAL B 64 -12.528 -9.353 -0.798 1.00 0.00 H new ATOM 0 HB VAL B 64 -12.699 -11.148 -2.628 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -11.325 -9.779 -4.228 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -12.301 -8.763 -3.141 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -10.560 -8.971 -2.839 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -10.518 -11.898 -3.564 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -9.698 -11.207 -2.143 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -10.829 -12.567 -1.944 1.00 0.00 H new ATOM 2288 N VAL B 65 -14.058 -11.473 -0.421 1.00 0.00 N ATOM 2289 CA VAL B 65 -14.992 -12.505 0.054 1.00 0.00 C ATOM 2290 C VAL B 65 -15.880 -12.973 -1.118 1.00 0.00 C ATOM 2291 O VAL B 65 -15.886 -12.352 -2.184 1.00 0.00 O ATOM 2292 CB VAL B 65 -15.840 -11.981 1.249 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -16.535 -13.151 1.975 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -15.001 -11.211 2.293 1.00 0.00 C ATOM 0 H VAL B 65 -14.521 -10.769 -0.995 1.00 0.00 H new ATOM 0 HA VAL B 65 -14.426 -13.362 0.421 1.00 0.00 H new ATOM 0 HB VAL B 65 -16.570 -11.297 0.815 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -17.123 -12.765 2.807 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -17.191 -13.673 1.279 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -15.783 -13.843 2.353 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -15.649 -10.871 3.101 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -14.231 -11.868 2.697 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -14.531 -10.350 1.818 1.00 0.00 H new ATOM 2304 N ALA B 66 -16.604 -14.086 -0.946 1.00 0.00 N ATOM 2305 CA ALA B 66 -17.631 -14.590 -1.867 1.00 0.00 C ATOM 2306 C ALA B 66 -19.055 -14.308 -1.348 1.00 0.00 C ATOM 2307 O ALA B 66 -19.380 -14.665 -0.216 1.00 0.00 O ATOM 2308 CB ALA B 66 -17.402 -16.094 -2.075 1.00 0.00 C ATOM 0 H ALA B 66 -16.486 -14.684 -0.128 1.00 0.00 H new ATOM 0 HA ALA B 66 -17.544 -14.068 -2.820 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -18.156 -16.486 -2.757 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -16.411 -16.256 -2.498 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -17.476 -16.609 -1.117 1.00 0.00 H new ATOM 2314 N THR B 67 -19.911 -13.742 -2.210 1.00 0.00 N ATOM 2315 CA THR B 67 -21.327 -13.423 -1.933 1.00 0.00 C ATOM 2316 C THR B 67 -22.192 -14.180 -2.937 1.00 0.00 C ATOM 2317 O THR B 67 -21.669 -14.887 -3.792 1.00 0.00 O ATOM 2318 CB THR B 67 -21.591 -11.905 -2.017 1.00 0.00 C ATOM 2319 OG1 THR B 67 -20.515 -11.099 -1.590 1.00 0.00 O ATOM 2320 CG2 THR B 67 -22.885 -11.395 -1.385 1.00 0.00 C ATOM 0 H THR B 67 -19.630 -13.482 -3.156 1.00 0.00 H new ATOM 0 HA THR B 67 -21.576 -13.730 -0.917 1.00 0.00 H new ATOM 0 HB THR B 67 -21.712 -11.795 -3.095 1.00 0.00 H new ATOM 0 HG1 THR B 67 -20.840 -10.432 -0.950 1.00 0.00 H new ATOM 0 HG21 THR B 67 -22.951 -10.314 -1.512 1.00 0.00 H new ATOM 0 HG22 THR B 67 -23.738 -11.870 -1.869 1.00 0.00 H new ATOM 0 HG23 THR B 67 -22.891 -11.637 -0.322 1.00 0.00 H new ATOM 2328 N TYR B 68 -23.507 -14.001 -2.882 1.00 0.00 N ATOM 2329 CA TYR B 68 -24.451 -14.480 -3.899 1.00 0.00 C ATOM 2330 C TYR B 68 -25.177 -13.320 -4.604 1.00 0.00 C ATOM 2331 O TYR B 68 -25.730 -12.441 -3.943 1.00 0.00 O ATOM 2332 CB TYR B 68 -25.492 -15.394 -3.231 1.00 0.00 C ATOM 2333 CG TYR B 68 -25.031 -16.800 -2.891 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -24.118 -17.018 -1.840 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -25.558 -17.902 -3.596 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -23.715 -18.324 -1.510 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -25.174 -19.214 -3.259 1.00 0.00 C ATOM 2338 CZ TYR B 68 -24.247 -19.427 -2.214 1.00 0.00 C ATOM 2339 OH TYR B 68 -23.866 -20.691 -1.883 1.00 0.00 O ATOM 0 H TYR B 68 -23.962 -13.508 -2.114 1.00 0.00 H new ATOM 0 HA TYR B 68 -23.882 -15.026 -4.652 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -25.831 -14.913 -2.313 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -26.357 -15.467 -3.890 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -23.726 -16.178 -1.285 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -26.261 -17.738 -4.400 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -22.998 -18.484 -0.718 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -25.586 -20.055 -3.797 1.00 0.00 H new ATOM 0 HH TYR B 68 -24.325 -21.334 -2.463 1.00 0.00 H new ATOM 2349 N GLU B 69 -25.216 -13.345 -5.942 1.00 0.00 N ATOM 2350 CA GLU B 69 -26.123 -12.507 -6.747 1.00 0.00 C ATOM 2351 C GLU B 69 -27.488 -13.217 -6.942 1.00 0.00 C ATOM 2352 O GLU B 69 -28.296 -12.814 -7.773 1.00 0.00 O ATOM 2353 CB GLU B 69 -25.487 -12.086 -8.094 1.00 0.00 C ATOM 2354 CG GLU B 69 -25.181 -13.251 -9.050 1.00 0.00 C ATOM 2355 CD GLU B 69 -25.519 -12.988 -10.521 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -25.356 -11.859 -11.033 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -26.003 -13.938 -11.178 1.00 0.00 O ATOM 0 H GLU B 69 -24.617 -13.950 -6.503 1.00 0.00 H new ATOM 0 HA GLU B 69 -26.302 -11.583 -6.196 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -26.158 -11.389 -8.595 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -24.561 -11.547 -7.891 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -24.121 -13.494 -8.974 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -25.734 -14.129 -8.717 1.00 0.00 H new ATOM 2364 N GLY B 70 -27.738 -14.323 -6.221 1.00 0.00 N ATOM 2365 CA GLY B 70 -28.973 -15.117 -6.260 1.00 0.00 C ATOM 2366 C GLY B 70 -28.994 -16.093 -7.434 1.00 0.00 C ATOM 2367 O GLY B 70 -29.107 -17.298 -7.235 1.00 0.00 O ATOM 0 H GLY B 70 -27.053 -14.703 -5.567 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -29.076 -15.671 -5.327 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -29.831 -14.448 -6.330 1.00 0.00 H new ATOM 2371 N ARG B 71 -28.835 -15.566 -8.651 1.00 0.00 N ATOM 2372 CA ARG B 71 -28.699 -16.327 -9.905 1.00 0.00 C ATOM 2373 C ARG B 71 -27.347 -17.070 -10.004 1.00 0.00 C ATOM 2374 O ARG B 71 -27.225 -18.036 -10.759 1.00 0.00 O ATOM 2375 CB ARG B 71 -28.933 -15.326 -11.056 1.00 0.00 C ATOM 2376 CG ARG B 71 -28.591 -15.821 -12.475 1.00 0.00 C ATOM 2377 CD ARG B 71 -28.718 -14.707 -13.525 1.00 0.00 C ATOM 2378 NE ARG B 71 -27.719 -13.655 -13.290 1.00 0.00 N ATOM 2379 CZ ARG B 71 -27.498 -12.534 -13.955 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -28.150 -12.230 -15.061 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -26.609 -11.691 -13.493 1.00 0.00 N ATOM 0 H ARG B 71 -28.795 -14.558 -8.800 1.00 0.00 H new ATOM 0 HA ARG B 71 -29.437 -17.128 -9.953 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -29.981 -15.028 -11.042 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -28.344 -14.431 -10.855 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -27.574 -16.214 -12.486 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -29.254 -16.645 -12.740 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -28.586 -15.125 -14.523 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -29.720 -14.279 -13.489 1.00 0.00 H new ATOM 0 HE ARG B 71 -27.103 -13.814 -12.493 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -28.853 -12.870 -15.431 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -27.951 -11.355 -15.546 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -26.101 -11.905 -12.634 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -26.424 -10.821 -13.992 1.00 0.00 H new ATOM 2395 N GLN B 72 -26.346 -16.649 -9.230 1.00 0.00 N ATOM 2396 CA GLN B 72 -24.965 -17.123 -9.240 1.00 0.00 C ATOM 2397 C GLN B 72 -24.247 -16.649 -7.965 1.00 0.00 C ATOM 2398 O GLN B 72 -24.776 -15.813 -7.231 1.00 0.00 O ATOM 2399 CB GLN B 72 -24.290 -16.602 -10.541 1.00 0.00 C ATOM 2400 CG GLN B 72 -22.951 -17.241 -10.928 1.00 0.00 C ATOM 2401 CD GLN B 72 -22.968 -18.730 -10.648 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -22.491 -19.173 -9.617 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -23.651 -19.528 -11.435 1.00 0.00 N ATOM 0 H GLN B 72 -26.490 -15.918 -8.533 1.00 0.00 H new ATOM 0 HA GLN B 72 -24.914 -18.212 -9.239 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -24.987 -16.747 -11.367 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -24.137 -15.528 -10.438 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -22.751 -17.067 -11.985 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -22.142 -16.770 -10.369 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -24.055 -19.168 -12.300 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -23.778 -20.508 -11.182 1.00 0.00 H new ATOM 2412 N VAL B 73 -23.054 -17.173 -7.678 1.00 0.00 N ATOM 2413 CA VAL B 73 -22.163 -16.618 -6.645 1.00 0.00 C ATOM 2414 C VAL B 73 -21.259 -15.535 -7.250 1.00 0.00 C ATOM 2415 O VAL B 73 -21.010 -15.557 -8.455 1.00 0.00 O ATOM 2416 CB VAL B 73 -21.335 -17.696 -5.916 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -22.240 -18.718 -5.214 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -20.315 -18.427 -6.801 1.00 0.00 C ATOM 0 H VAL B 73 -22.674 -17.993 -8.152 1.00 0.00 H new ATOM 0 HA VAL B 73 -22.799 -16.166 -5.884 1.00 0.00 H new ATOM 0 HB VAL B 73 -20.757 -17.142 -5.176 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -21.625 -19.463 -4.710 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -22.865 -18.208 -4.481 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -22.874 -19.210 -5.952 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -19.780 -19.166 -6.205 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -20.835 -18.928 -7.618 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -19.606 -17.707 -7.209 1.00 0.00 H new ATOM 2428 N ARG B 74 -20.737 -14.606 -6.438 1.00 0.00 N ATOM 2429 CA ARG B 74 -19.858 -13.514 -6.879 1.00 0.00 C ATOM 2430 C ARG B 74 -18.656 -13.434 -5.943 1.00 0.00 C ATOM 2431 O ARG B 74 -18.629 -14.056 -4.880 1.00 0.00 O ATOM 2432 CB ARG B 74 -20.608 -12.160 -6.899 1.00 0.00 C ATOM 2433 CG ARG B 74 -20.805 -11.539 -5.508 1.00 0.00 C ATOM 2434 CD ARG B 74 -21.409 -10.138 -5.479 1.00 0.00 C ATOM 2435 NE ARG B 74 -21.203 -9.520 -4.150 1.00 0.00 N ATOM 2436 CZ ARG B 74 -21.359 -8.254 -3.795 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -21.712 -7.332 -4.668 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -21.159 -7.923 -2.534 1.00 0.00 N ATOM 0 H ARG B 74 -20.918 -14.592 -5.434 1.00 0.00 H new ATOM 0 HA ARG B 74 -19.525 -13.722 -7.896 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -20.056 -11.459 -7.525 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -21.583 -12.303 -7.364 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -21.445 -12.201 -4.924 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -19.838 -11.506 -5.006 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -20.950 -9.520 -6.251 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -22.474 -10.189 -5.703 1.00 0.00 H new ATOM 0 HE ARG B 74 -20.901 -10.153 -3.410 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -21.872 -7.587 -5.643 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -21.826 -6.363 -4.369 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -20.890 -8.636 -1.856 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -21.273 -6.954 -2.237 1.00 0.00 H new ATOM 2452 N TYR B 75 -17.694 -12.585 -6.292 1.00 0.00 N ATOM 2453 CA TYR B 75 -16.648 -12.138 -5.364 1.00 0.00 C ATOM 2454 C TYR B 75 -16.866 -10.644 -5.063 1.00 0.00 C ATOM 2455 O TYR B 75 -17.550 -9.961 -5.823 1.00 0.00 O ATOM 2456 CB TYR B 75 -15.246 -12.428 -5.922 1.00 0.00 C ATOM 2457 CG TYR B 75 -14.889 -13.902 -6.018 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -14.976 -14.735 -4.884 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -14.434 -14.437 -7.239 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -14.637 -16.099 -4.974 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -14.074 -15.796 -7.329 1.00 0.00 C ATOM 2462 CZ TYR B 75 -14.179 -16.633 -6.198 1.00 0.00 C ATOM 2463 OH TYR B 75 -13.829 -17.945 -6.282 1.00 0.00 O ATOM 0 H TYR B 75 -17.613 -12.184 -7.226 1.00 0.00 H new ATOM 0 HA TYR B 75 -16.716 -12.695 -4.430 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -15.167 -11.984 -6.914 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -14.509 -11.931 -5.291 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -15.305 -14.325 -3.941 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -14.361 -13.803 -8.110 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -14.727 -16.736 -4.107 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -13.717 -16.198 -8.266 1.00 0.00 H new ATOM 0 HH TYR B 75 -13.537 -18.148 -7.195 1.00 0.00 H new ATOM 2473 N ALA B 76 -16.302 -10.129 -3.974 1.00 0.00 N ATOM 2474 CA ALA B 76 -16.407 -8.735 -3.536 1.00 0.00 C ATOM 2475 C ALA B 76 -15.219 -8.368 -2.644 1.00 0.00 C ATOM 2476 O ALA B 76 -14.655 -9.252 -2.004 1.00 0.00 O ATOM 2477 CB ALA B 76 -17.739 -8.541 -2.800 1.00 0.00 C ATOM 0 H ALA B 76 -15.734 -10.694 -3.343 1.00 0.00 H new ATOM 0 HA ALA B 76 -16.384 -8.072 -4.401 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -17.825 -7.506 -2.470 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -18.564 -8.778 -3.472 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -17.776 -9.202 -1.934 1.00 0.00 H new ATOM 2483 N LEU B 77 -14.848 -7.083 -2.614 1.00 0.00 N ATOM 2484 CA LEU B 77 -13.789 -6.523 -1.766 1.00 0.00 C ATOM 2485 C LEU B 77 -14.104 -6.654 -0.258 1.00 0.00 C ATOM 2486 O LEU B 77 -15.268 -6.756 0.113 1.00 0.00 O ATOM 2487 CB LEU B 77 -13.608 -5.046 -2.175 1.00 0.00 C ATOM 2488 CG LEU B 77 -12.144 -4.625 -2.316 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -11.478 -5.222 -3.548 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -12.136 -3.115 -2.494 1.00 0.00 C ATOM 0 H LEU B 77 -15.294 -6.378 -3.201 1.00 0.00 H new ATOM 0 HA LEU B 77 -12.866 -7.083 -1.917 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -14.120 -4.875 -3.122 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -14.090 -4.410 -1.433 1.00 0.00 H new ATOM 0 HG LEU B 77 -11.601 -4.969 -1.436 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -10.441 -4.890 -3.598 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -11.508 -6.310 -3.487 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -12.007 -4.894 -4.443 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -11.109 -2.766 -2.599 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -12.702 -2.851 -3.387 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -12.592 -2.644 -1.623 1.00 0.00 H new ATOM 2502 N ALA B 78 -13.077 -6.601 0.602 1.00 0.00 N ATOM 2503 CA ALA B 78 -13.173 -6.797 2.059 1.00 0.00 C ATOM 2504 C ALA B 78 -14.157 -5.887 2.824 1.00 0.00 C ATOM 2505 O ALA B 78 -14.613 -6.267 3.900 1.00 0.00 O ATOM 2506 CB ALA B 78 -11.772 -6.565 2.644 1.00 0.00 C ATOM 0 H ALA B 78 -12.123 -6.414 0.294 1.00 0.00 H new ATOM 0 HA ALA B 78 -13.565 -7.806 2.189 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -11.802 -6.701 3.725 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -11.073 -7.278 2.207 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -11.446 -5.550 2.415 1.00 0.00 H new ATOM 2512 N ASP B 79 -14.380 -4.666 2.333 1.00 0.00 N ATOM 2513 CA ASP B 79 -15.095 -3.528 2.941 1.00 0.00 C ATOM 2514 C ASP B 79 -14.838 -2.256 2.106 1.00 0.00 C ATOM 2515 O ASP B 79 -13.910 -2.189 1.290 1.00 0.00 O ATOM 2516 CB ASP B 79 -14.709 -3.318 4.436 1.00 0.00 C ATOM 2517 CG ASP B 79 -15.219 -2.007 5.064 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -16.434 -1.723 4.933 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -14.366 -1.218 5.527 1.00 0.00 O ATOM 0 H ASP B 79 -14.032 -4.419 1.407 1.00 0.00 H new ATOM 0 HA ASP B 79 -16.162 -3.751 2.934 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -15.096 -4.156 5.016 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -13.623 -3.346 4.522 1.00 0.00 H new ATOM 2524 N SER B 80 -15.639 -1.222 2.369 1.00 0.00 N ATOM 2525 CA SER B 80 -15.445 0.162 1.931 1.00 0.00 C ATOM 2526 C SER B 80 -14.000 0.643 2.153 1.00 0.00 C ATOM 2527 O SER B 80 -13.471 1.382 1.323 1.00 0.00 O ATOM 2528 CB SER B 80 -16.415 1.053 2.719 1.00 0.00 C ATOM 2529 OG SER B 80 -16.291 2.411 2.331 1.00 0.00 O ATOM 0 H SER B 80 -16.487 -1.334 2.924 1.00 0.00 H new ATOM 0 HA SER B 80 -15.640 0.220 0.860 1.00 0.00 H new ATOM 0 HB2 SER B 80 -17.438 0.716 2.554 1.00 0.00 H new ATOM 0 HB3 SER B 80 -16.216 0.957 3.786 1.00 0.00 H new ATOM 0 HG SER B 80 -16.921 2.957 2.846 1.00 0.00 H new ATOM 2535 N HIS B 81 -13.326 0.169 3.213 1.00 0.00 N ATOM 2536 CA HIS B 81 -11.901 0.385 3.473 1.00 0.00 C ATOM 2537 C HIS B 81 -11.031 0.161 2.237 1.00 0.00 C ATOM 2538 O HIS B 81 -10.422 1.119 1.762 1.00 0.00 O ATOM 2539 CB HIS B 81 -11.453 -0.506 4.654 1.00 0.00 C ATOM 2540 CG HIS B 81 -11.567 0.149 6.010 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -12.116 1.388 6.282 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -10.796 -0.198 7.081 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -11.602 1.824 7.448 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -10.853 0.845 7.987 1.00 0.00 N ATOM 0 H HIS B 81 -13.777 -0.394 3.935 1.00 0.00 H new ATOM 0 HA HIS B 81 -11.764 1.433 3.741 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -12.051 -1.417 4.653 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -10.417 -0.805 4.495 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -10.243 -1.118 7.199 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -11.765 2.800 7.880 1.00 0.00 H new ATOM 0 HE2 HIS B 81 -10.406 0.868 8.903 1.00 0.00 H new ATOM 2553 N LEU B 82 -10.957 -1.064 1.697 1.00 0.00 N ATOM 2554 CA LEU B 82 -10.157 -1.297 0.487 1.00 0.00 C ATOM 2555 C LEU B 82 -10.783 -0.600 -0.722 1.00 0.00 C ATOM 2556 O LEU B 82 -10.044 -0.124 -1.570 1.00 0.00 O ATOM 2557 CB LEU B 82 -9.920 -2.789 0.182 1.00 0.00 C ATOM 2558 CG LEU B 82 -9.288 -3.653 1.284 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -8.776 -4.962 0.668 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -8.151 -2.972 2.059 1.00 0.00 C ATOM 0 H LEU B 82 -11.428 -1.889 2.067 1.00 0.00 H new ATOM 0 HA LEU B 82 -9.177 -0.864 0.689 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -10.879 -3.233 -0.083 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -9.284 -2.854 -0.701 1.00 0.00 H new ATOM 0 HG LEU B 82 -10.076 -3.835 2.014 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -8.326 -5.579 1.446 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -9.608 -5.500 0.214 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -8.029 -4.738 -0.094 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -7.766 -3.656 2.816 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -7.350 -2.705 1.370 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -8.529 -2.071 2.543 1.00 0.00 H new ATOM 2572 N ALA B 83 -12.111 -0.467 -0.788 1.00 0.00 N ATOM 2573 CA ALA B 83 -12.765 0.116 -1.958 1.00 0.00 C ATOM 2574 C ALA B 83 -12.315 1.575 -2.149 1.00 0.00 C ATOM 2575 O ALA B 83 -11.912 1.961 -3.240 1.00 0.00 O ATOM 2576 CB ALA B 83 -14.282 -0.028 -1.810 1.00 0.00 C ATOM 0 H ALA B 83 -12.750 -0.755 -0.047 1.00 0.00 H new ATOM 0 HA ALA B 83 -12.471 -0.417 -2.862 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -14.775 0.405 -2.680 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -14.542 -1.084 -1.734 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -14.611 0.492 -0.910 1.00 0.00 H new ATOM 2582 N ARG B 84 -12.282 2.362 -1.063 1.00 0.00 N ATOM 2583 CA ARG B 84 -11.856 3.766 -1.091 1.00 0.00 C ATOM 2584 C ARG B 84 -10.323 3.924 -1.100 1.00 0.00 C ATOM 2585 O ARG B 84 -9.820 4.752 -1.851 1.00 0.00 O ATOM 2586 CB ARG B 84 -12.626 4.562 -0.010 1.00 0.00 C ATOM 2587 CG ARG B 84 -11.869 5.163 1.188 1.00 0.00 C ATOM 2588 CD ARG B 84 -11.119 6.460 0.842 1.00 0.00 C ATOM 2589 NE ARG B 84 -10.953 7.316 2.027 1.00 0.00 N ATOM 2590 CZ ARG B 84 -11.756 8.274 2.475 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -12.932 8.538 1.939 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -11.377 8.995 3.499 1.00 0.00 N ATOM 0 H ARG B 84 -12.553 2.038 -0.135 1.00 0.00 H new ATOM 0 HA ARG B 84 -12.133 4.220 -2.042 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -13.138 5.382 -0.514 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -13.396 3.903 0.391 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -12.576 5.364 1.993 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -11.157 4.429 1.565 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -10.141 6.217 0.427 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -11.666 7.004 0.072 1.00 0.00 H new ATOM 0 HE ARG B 84 -10.110 7.152 2.577 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -13.263 7.994 1.142 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -13.511 9.286 2.322 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -10.475 8.818 3.942 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -11.983 9.734 3.854 1.00 0.00 H new ATOM 2606 N ALA B 85 -9.567 3.124 -0.337 1.00 0.00 N ATOM 2607 CA ALA B 85 -8.097 3.203 -0.294 1.00 0.00 C ATOM 2608 C ALA B 85 -7.413 2.719 -1.584 1.00 0.00 C ATOM 2609 O ALA B 85 -6.381 3.261 -1.972 1.00 0.00 O ATOM 2610 CB ALA B 85 -7.594 2.401 0.910 1.00 0.00 C ATOM 0 H ALA B 85 -9.956 2.402 0.270 1.00 0.00 H new ATOM 0 HA ALA B 85 -7.831 4.256 -0.198 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -6.506 2.452 0.952 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -8.013 2.818 1.826 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -7.905 1.361 0.810 1.00 0.00 H new ATOM 2616 N LEU B 86 -7.979 1.722 -2.272 1.00 0.00 N ATOM 2617 CA LEU B 86 -7.525 1.325 -3.604 1.00 0.00 C ATOM 2618 C LEU B 86 -8.016 2.336 -4.656 1.00 0.00 C ATOM 2619 O LEU B 86 -7.248 2.731 -5.524 1.00 0.00 O ATOM 2620 CB LEU B 86 -8.028 -0.106 -3.900 1.00 0.00 C ATOM 2621 CG LEU B 86 -7.120 -0.958 -4.807 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -7.905 -2.211 -5.199 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -6.613 -0.269 -6.078 1.00 0.00 C ATOM 0 H LEU B 86 -8.762 1.171 -1.921 1.00 0.00 H new ATOM 0 HA LEU B 86 -6.436 1.322 -3.645 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -8.158 -0.629 -2.953 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -9.012 -0.037 -4.364 1.00 0.00 H new ATOM 0 HG LEU B 86 -6.221 -1.172 -4.228 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -7.290 -2.839 -5.843 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -8.175 -2.767 -4.301 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -8.810 -1.921 -5.732 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -5.984 -0.960 -6.640 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -7.462 0.031 -6.692 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -6.032 0.612 -5.807 1.00 0.00 H new ATOM 2635 N GLY B 87 -9.274 2.773 -4.539 1.00 0.00 N ATOM 2636 CA GLY B 87 -10.006 3.555 -5.547 1.00 0.00 C ATOM 2637 C GLY B 87 -9.546 5.018 -5.667 1.00 0.00 C ATOM 2638 O GLY B 87 -9.437 5.517 -6.781 1.00 0.00 O ATOM 0 H GLY B 87 -9.834 2.586 -3.708 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -9.895 3.070 -6.517 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -11.068 3.539 -5.302 1.00 0.00 H new ATOM 2642 N GLU B 88 -9.226 5.695 -4.554 1.00 0.00 N ATOM 2643 CA GLU B 88 -8.500 6.987 -4.570 1.00 0.00 C ATOM 2644 C GLU B 88 -7.004 6.739 -4.865 1.00 0.00 C ATOM 2645 O GLU B 88 -6.336 7.551 -5.512 1.00 0.00 O ATOM 2646 CB GLU B 88 -8.732 7.737 -3.236 1.00 0.00 C ATOM 2647 CG GLU B 88 -7.520 8.399 -2.556 1.00 0.00 C ATOM 2648 CD GLU B 88 -6.900 9.553 -3.340 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -7.634 10.345 -3.969 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -5.678 9.774 -3.202 1.00 0.00 O ATOM 0 H GLU B 88 -9.460 5.369 -3.616 1.00 0.00 H new ATOM 0 HA GLU B 88 -8.883 7.626 -5.365 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -9.478 8.511 -3.414 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -9.167 7.032 -2.528 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -7.826 8.766 -1.576 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -6.756 7.640 -2.388 1.00 0.00 H new ATOM 2657 N LEU B 89 -6.512 5.578 -4.411 1.00 0.00 N ATOM 2658 CA LEU B 89 -5.224 4.956 -4.691 1.00 0.00 C ATOM 2659 C LEU B 89 -4.122 5.540 -3.808 1.00 0.00 C ATOM 2660 O LEU B 89 -4.159 6.673 -3.346 1.00 0.00 O ATOM 2661 CB LEU B 89 -4.910 5.009 -6.211 1.00 0.00 C ATOM 2662 CG LEU B 89 -3.772 4.113 -6.736 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -3.983 2.621 -6.444 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -3.619 4.300 -8.249 1.00 0.00 C ATOM 0 H LEU B 89 -7.065 5.000 -3.778 1.00 0.00 H new ATOM 0 HA LEU B 89 -5.274 3.899 -4.429 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -5.820 4.748 -6.751 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -4.671 6.041 -6.469 1.00 0.00 H new ATOM 0 HG LEU B 89 -2.872 4.424 -6.207 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -3.144 2.050 -6.842 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -4.049 2.467 -5.367 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -4.906 2.285 -6.916 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -2.813 3.664 -8.615 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -4.550 4.027 -8.745 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -3.385 5.342 -8.465 1.00 0.00 H new ATOM 2676 N VAL B 90 -3.034 4.785 -3.703 1.00 0.00 N ATOM 2677 CA VAL B 90 -1.734 5.165 -3.101 1.00 0.00 C ATOM 2678 C VAL B 90 -1.075 6.411 -3.727 1.00 0.00 C ATOM 2679 O VAL B 90 0.107 6.674 -3.505 1.00 0.00 O ATOM 2680 CB VAL B 90 -0.707 4.017 -3.200 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -1.062 2.836 -2.285 1.00 0.00 C ATOM 2682 CG2 VAL B 90 -0.563 3.541 -4.656 1.00 0.00 C ATOM 0 H VAL B 90 -3.022 3.828 -4.055 1.00 0.00 H new ATOM 0 HA VAL B 90 -1.989 5.392 -2.066 1.00 0.00 H new ATOM 0 HB VAL B 90 0.249 4.415 -2.859 1.00 0.00 H new ATOM 0 HG11 VAL B 90 -0.309 2.055 -2.391 1.00 0.00 H new ATOM 0 HG12 VAL B 90 -1.091 3.174 -1.249 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -2.038 2.440 -2.565 1.00 0.00 H new ATOM 0 HG21 VAL B 90 0.165 2.732 -4.704 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -1.527 3.184 -5.019 1.00 0.00 H new ATOM 0 HG23 VAL B 90 -0.226 4.370 -5.278 1.00 0.00 H new ATOM 2692 N GLN B 91 -1.778 7.129 -4.604 1.00 0.00 N ATOM 2693 CA GLN B 91 -1.398 8.412 -5.172 1.00 0.00 C ATOM 2694 C GLN B 91 -0.244 8.354 -6.190 1.00 0.00 C ATOM 2695 O GLN B 91 -0.172 9.262 -7.004 1.00 0.00 O ATOM 2696 CB GLN B 91 -1.141 9.406 -4.026 1.00 0.00 C ATOM 2697 CG GLN B 91 -2.428 10.055 -3.481 1.00 0.00 C ATOM 2698 CD GLN B 91 -3.092 11.055 -4.422 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -2.809 12.245 -4.391 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -3.933 10.627 -5.335 1.00 0.00 N ATOM 0 H GLN B 91 -2.680 6.807 -4.954 1.00 0.00 H new ATOM 0 HA GLN B 91 -2.234 8.762 -5.778 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -0.631 8.889 -3.213 1.00 0.00 H new ATOM 0 HB3 GLN B 91 -0.468 10.189 -4.377 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -3.144 9.267 -3.248 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -2.194 10.560 -2.544 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -4.181 9.638 -5.377 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -4.338 11.283 -6.003 1.00 0.00 H new ATOM 2709 N VAL B 92 0.588 7.303 -6.196 1.00 0.00 N ATOM 2710 CA VAL B 92 1.809 7.017 -7.002 1.00 0.00 C ATOM 2711 C VAL B 92 1.701 7.077 -8.539 1.00 0.00 C ATOM 2712 O VAL B 92 2.403 6.383 -9.262 1.00 0.00 O ATOM 2713 CB VAL B 92 2.444 5.684 -6.514 1.00 0.00 C ATOM 2714 CG1 VAL B 92 1.754 4.446 -7.122 1.00 0.00 C ATOM 2715 CG2 VAL B 92 3.972 5.626 -6.688 1.00 0.00 C ATOM 0 H VAL B 92 0.407 6.528 -5.558 1.00 0.00 H new ATOM 0 HA VAL B 92 2.462 7.868 -6.809 1.00 0.00 H new ATOM 0 HB VAL B 92 2.264 5.662 -5.439 1.00 0.00 H new ATOM 0 HG11 VAL B 92 2.235 3.542 -6.749 1.00 0.00 H new ATOM 0 HG12 VAL B 92 0.701 4.440 -6.839 1.00 0.00 H new ATOM 0 HG13 VAL B 92 1.837 4.480 -8.208 1.00 0.00 H new ATOM 0 HG21 VAL B 92 4.343 4.667 -6.326 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.223 5.737 -7.743 1.00 0.00 H new ATOM 0 HG23 VAL B 92 4.434 6.432 -6.119 1.00 0.00 H new ATOM 2725 N VAL B 93 0.809 7.905 -9.065 1.00 0.00 N ATOM 2726 CA VAL B 93 0.676 8.221 -10.492 1.00 0.00 C ATOM 2727 C VAL B 93 0.151 7.009 -11.290 1.00 0.00 C ATOM 2728 O VAL B 93 0.245 6.994 -12.512 1.00 0.00 O ATOM 2729 CB VAL B 93 1.979 8.832 -11.103 1.00 0.00 C ATOM 2730 CG1 VAL B 93 1.625 9.783 -12.257 1.00 0.00 C ATOM 2731 CG2 VAL B 93 2.783 9.700 -10.103 1.00 0.00 C ATOM 0 H VAL B 93 0.127 8.399 -8.490 1.00 0.00 H new ATOM 0 HA VAL B 93 -0.076 9.006 -10.575 1.00 0.00 H new ATOM 0 HB VAL B 93 2.573 7.973 -11.414 1.00 0.00 H new ATOM 0 HG11 VAL B 93 2.539 10.203 -12.676 1.00 0.00 H new ATOM 0 HG12 VAL B 93 1.091 9.232 -13.031 1.00 0.00 H new ATOM 0 HG13 VAL B 93 0.993 10.589 -11.884 1.00 0.00 H new ATOM 0 HG21 VAL B 93 3.674 10.091 -10.595 1.00 0.00 H new ATOM 0 HG22 VAL B 93 2.164 10.529 -9.761 1.00 0.00 H new ATOM 0 HG23 VAL B 93 3.078 9.091 -9.248 1.00 0.00 H new ATOM 2741 N LEU B 94 -0.402 6.013 -10.566 1.00 0.00 N ATOM 2742 CA LEU B 94 -0.956 4.720 -10.987 1.00 0.00 C ATOM 2743 C LEU B 94 0.072 3.616 -10.698 1.00 0.00 C ATOM 2744 O LEU B 94 1.081 3.474 -11.384 1.00 0.00 O ATOM 2745 CB LEU B 94 -1.474 4.716 -12.451 1.00 0.00 C ATOM 2746 CG LEU B 94 -2.441 3.595 -12.893 1.00 0.00 C ATOM 2747 CD1 LEU B 94 -1.776 2.217 -12.993 1.00 0.00 C ATOM 2748 CD2 LEU B 94 -3.684 3.499 -11.996 1.00 0.00 C ATOM 0 H LEU B 94 -0.477 6.114 -9.554 1.00 0.00 H new ATOM 0 HA LEU B 94 -1.852 4.520 -10.399 1.00 0.00 H new ATOM 0 HB2 LEU B 94 -1.971 5.670 -12.628 1.00 0.00 H new ATOM 0 HB3 LEU B 94 -0.606 4.682 -13.109 1.00 0.00 H new ATOM 0 HG LEU B 94 -2.753 3.888 -13.895 1.00 0.00 H new ATOM 0 HD11 LEU B 94 -2.514 1.479 -13.308 1.00 0.00 H new ATOM 0 HD12 LEU B 94 -0.967 2.256 -13.722 1.00 0.00 H new ATOM 0 HD13 LEU B 94 -1.374 1.935 -12.020 1.00 0.00 H new ATOM 0 HD21 LEU B 94 -4.329 2.695 -12.352 1.00 0.00 H new ATOM 0 HD22 LEU B 94 -3.378 3.291 -10.971 1.00 0.00 H new ATOM 0 HD23 LEU B 94 -4.229 4.442 -12.028 1.00 0.00 H new ATOM 2760 N ALA B 95 -0.188 2.792 -9.682 1.00 0.00 N ATOM 2761 CA ALA B 95 0.558 1.557 -9.441 1.00 0.00 C ATOM 2762 C ALA B 95 0.399 0.573 -10.625 1.00 0.00 C ATOM 2763 O ALA B 95 -0.529 -0.242 -10.651 1.00 0.00 O ATOM 2764 CB ALA B 95 0.106 0.960 -8.101 1.00 0.00 C ATOM 0 H ALA B 95 -0.926 2.964 -9.000 1.00 0.00 H new ATOM 0 HA ALA B 95 1.625 1.769 -9.374 1.00 0.00 H new ATOM 0 HB1 ALA B 95 0.655 0.038 -7.910 1.00 0.00 H new ATOM 0 HB2 ALA B 95 0.303 1.673 -7.300 1.00 0.00 H new ATOM 0 HB3 ALA B 95 -0.962 0.745 -8.140 1.00 0.00 H new ATOM 2770 N VAL B 96 1.288 0.692 -11.614 1.00 0.00 N ATOM 2771 CA VAL B 96 1.426 -0.218 -12.769 1.00 0.00 C ATOM 2772 C VAL B 96 1.874 -1.611 -12.300 1.00 0.00 C ATOM 2773 O VAL B 96 2.635 -1.729 -11.341 1.00 0.00 O ATOM 2774 CB VAL B 96 2.446 0.313 -13.818 1.00 0.00 C ATOM 2775 CG1 VAL B 96 2.412 -0.485 -15.134 1.00 0.00 C ATOM 2776 CG2 VAL B 96 2.234 1.792 -14.176 1.00 0.00 C ATOM 0 H VAL B 96 1.963 1.456 -11.639 1.00 0.00 H new ATOM 0 HA VAL B 96 0.446 -0.276 -13.243 1.00 0.00 H new ATOM 0 HB VAL B 96 3.412 0.191 -13.328 1.00 0.00 H new ATOM 0 HG11 VAL B 96 3.143 -0.072 -15.829 1.00 0.00 H new ATOM 0 HG12 VAL B 96 2.652 -1.529 -14.933 1.00 0.00 H new ATOM 0 HG13 VAL B 96 1.417 -0.420 -15.573 1.00 0.00 H new ATOM 0 HG21 VAL B 96 2.978 2.099 -14.912 1.00 0.00 H new ATOM 0 HG22 VAL B 96 1.235 1.926 -14.592 1.00 0.00 H new ATOM 0 HG23 VAL B 96 2.338 2.402 -13.279 1.00 0.00 H new ATOM 2786 N ASP B 97 1.454 -2.653 -13.026 1.00 0.00 N ATOM 2787 CA ASP B 97 1.850 -4.062 -12.875 1.00 0.00 C ATOM 2788 C ASP B 97 3.371 -4.339 -13.003 1.00 0.00 C ATOM 2789 O ASP B 97 3.797 -5.484 -12.864 1.00 0.00 O ATOM 2790 CB ASP B 97 1.088 -4.904 -13.925 1.00 0.00 C ATOM 2791 CG ASP B 97 -0.437 -4.718 -13.915 1.00 0.00 C ATOM 2792 OD1 ASP B 97 -0.890 -3.599 -14.264 1.00 0.00 O ATOM 2793 OD2 ASP B 97 -1.163 -5.668 -13.553 1.00 0.00 O ATOM 0 H ASP B 97 0.784 -2.529 -13.785 1.00 0.00 H new ATOM 0 HA ASP B 97 1.591 -4.340 -11.853 1.00 0.00 H new ATOM 0 HB2 ASP B 97 1.464 -4.651 -14.916 1.00 0.00 H new ATOM 0 HB3 ASP B 97 1.313 -5.957 -13.758 1.00 0.00 H new ATOM 2798 N THR B 98 4.202 -3.325 -13.287 1.00 0.00 N ATOM 2799 CA THR B 98 5.658 -3.454 -13.462 1.00 0.00 C ATOM 2800 C THR B 98 6.403 -3.342 -12.139 1.00 0.00 C ATOM 2801 O THR B 98 6.410 -2.268 -11.531 1.00 0.00 O ATOM 2802 CB THR B 98 6.209 -2.393 -14.424 1.00 0.00 C ATOM 2803 OG1 THR B 98 5.790 -1.122 -13.984 1.00 0.00 O ATOM 2804 CG2 THR B 98 5.736 -2.599 -15.861 1.00 0.00 C ATOM 0 H THR B 98 3.872 -2.367 -13.405 1.00 0.00 H new ATOM 0 HA THR B 98 5.822 -4.446 -13.882 1.00 0.00 H new ATOM 0 HB THR B 98 7.296 -2.478 -14.422 1.00 0.00 H new ATOM 0 HG1 THR B 98 5.763 -1.107 -13.004 1.00 0.00 H new ATOM 0 HG21 THR B 98 6.156 -1.820 -16.497 1.00 0.00 H new ATOM 0 HG22 THR B 98 6.066 -3.575 -16.216 1.00 0.00 H new ATOM 0 HG23 THR B 98 4.648 -2.549 -15.897 1.00 0.00 H new ATOM 2812 N ASP B 99 7.126 -4.394 -11.753 1.00 0.00 N ATOM 2813 CA ASP B 99 8.099 -4.345 -10.653 1.00 0.00 C ATOM 2814 C ASP B 99 9.392 -3.648 -11.130 1.00 0.00 C ATOM 2815 O ASP B 99 10.453 -4.254 -11.293 1.00 0.00 O ATOM 2816 CB ASP B 99 8.322 -5.749 -10.066 1.00 0.00 C ATOM 2817 CG ASP B 99 9.216 -5.744 -8.815 1.00 0.00 C ATOM 2818 OD1 ASP B 99 9.162 -4.788 -8.010 1.00 0.00 O ATOM 2819 OD2 ASP B 99 9.971 -6.721 -8.622 1.00 0.00 O ATOM 0 H ASP B 99 7.055 -5.311 -12.195 1.00 0.00 H new ATOM 0 HA ASP B 99 7.710 -3.743 -9.832 1.00 0.00 H new ATOM 0 HB2 ASP B 99 7.357 -6.189 -9.814 1.00 0.00 H new ATOM 0 HB3 ASP B 99 8.774 -6.387 -10.826 1.00 0.00 H new ATOM 2824 N GLN B 100 9.261 -2.344 -11.411 1.00 0.00 N ATOM 2825 CA GLN B 100 10.387 -1.466 -11.721 1.00 0.00 C ATOM 2826 C GLN B 100 11.404 -1.566 -10.572 1.00 0.00 C ATOM 2827 O GLN B 100 10.983 -1.509 -9.413 1.00 0.00 O ATOM 2828 CB GLN B 100 9.919 -0.005 -11.908 1.00 0.00 C ATOM 2829 CG GLN B 100 10.258 0.587 -13.284 1.00 0.00 C ATOM 2830 CD GLN B 100 9.401 -0.022 -14.381 1.00 0.00 C ATOM 2831 OE1 GLN B 100 9.754 -1.001 -15.011 1.00 0.00 O ATOM 2832 NE2 GLN B 100 8.218 0.506 -14.593 1.00 0.00 N ATOM 0 H GLN B 100 8.359 -1.869 -11.428 1.00 0.00 H new ATOM 0 HA GLN B 100 10.848 -1.778 -12.658 1.00 0.00 H new ATOM 0 HB2 GLN B 100 8.840 0.042 -11.759 1.00 0.00 H new ATOM 0 HB3 GLN B 100 10.375 0.614 -11.135 1.00 0.00 H new ATOM 0 HG2 GLN B 100 10.110 1.667 -13.263 1.00 0.00 H new ATOM 0 HG3 GLN B 100 11.311 0.414 -13.506 1.00 0.00 H new ATOM 0 HE21 GLN B 100 7.924 1.327 -14.064 1.00 0.00 H new ATOM 0 HE22 GLN B 100 7.593 0.095 -15.287 1.00 0.00 H new ATOM 2841 N PRO B 101 12.714 -1.694 -10.863 1.00 0.00 N ATOM 2842 CA PRO B 101 13.726 -2.026 -9.871 1.00 0.00 C ATOM 2843 C PRO B 101 13.769 -1.036 -8.714 1.00 0.00 C ATOM 2844 O PRO B 101 13.765 0.177 -8.919 1.00 0.00 O ATOM 2845 CB PRO B 101 15.059 -2.121 -10.621 1.00 0.00 C ATOM 2846 CG PRO B 101 14.814 -1.336 -11.907 1.00 0.00 C ATOM 2847 CD PRO B 101 13.333 -1.586 -12.175 1.00 0.00 C ATOM 0 HA PRO B 101 13.490 -2.976 -9.392 1.00 0.00 H new ATOM 0 HB2 PRO B 101 15.875 -1.692 -10.040 1.00 0.00 H new ATOM 0 HB3 PRO B 101 15.327 -3.157 -10.830 1.00 0.00 H new ATOM 0 HG2 PRO B 101 15.029 -0.275 -11.781 1.00 0.00 H new ATOM 0 HG3 PRO B 101 15.440 -1.693 -12.725 1.00 0.00 H new ATOM 0 HD2 PRO B 101 12.895 -0.770 -12.750 1.00 0.00 H new ATOM 0 HD3 PRO B 101 13.187 -2.498 -12.754 1.00 0.00 H new ATOM 2855 N CYS B 102 13.886 -1.613 -7.512 1.00 0.00 N ATOM 2856 CA CYS B 102 14.043 -0.982 -6.208 1.00 0.00 C ATOM 2857 C CYS B 102 15.396 -0.234 -6.103 1.00 0.00 C ATOM 2858 O CYS B 102 16.218 -0.553 -5.251 1.00 0.00 O ATOM 2859 CB CYS B 102 13.891 -2.138 -5.200 1.00 0.00 C ATOM 2860 SG CYS B 102 13.566 -1.571 -3.502 1.00 0.00 S ATOM 0 H CYS B 102 13.871 -2.629 -7.427 1.00 0.00 H new ATOM 0 HA CYS B 102 13.303 -0.205 -6.016 1.00 0.00 H new ATOM 0 HB2 CYS B 102 13.076 -2.787 -5.522 1.00 0.00 H new ATOM 0 HB3 CYS B 102 14.800 -2.740 -5.207 1.00 0.00 H new ATOM 2865 N VAL B 103 15.645 0.681 -7.039 1.00 0.00 N ATOM 2866 CA VAL B 103 16.916 1.348 -7.360 1.00 0.00 C ATOM 2867 C VAL B 103 17.920 1.429 -6.198 1.00 0.00 C ATOM 2868 O VAL B 103 19.014 0.876 -6.319 1.00 0.00 O ATOM 2869 CB VAL B 103 16.666 2.699 -8.065 1.00 0.00 C ATOM 2870 CG1 VAL B 103 15.799 3.693 -7.283 1.00 0.00 C ATOM 2871 CG2 VAL B 103 18.004 3.334 -8.447 1.00 0.00 C ATOM 0 H VAL B 103 14.897 1.007 -7.650 1.00 0.00 H new ATOM 0 HA VAL B 103 17.428 0.698 -8.070 1.00 0.00 H new ATOM 0 HB VAL B 103 16.081 2.465 -8.955 1.00 0.00 H new ATOM 0 HG11 VAL B 103 15.683 4.609 -7.862 1.00 0.00 H new ATOM 0 HG12 VAL B 103 14.819 3.254 -7.098 1.00 0.00 H new ATOM 0 HG13 VAL B 103 16.278 3.924 -6.332 1.00 0.00 H new ATOM 0 HG21 VAL B 103 17.825 4.287 -8.944 1.00 0.00 H new ATOM 0 HG22 VAL B 103 18.598 3.499 -7.548 1.00 0.00 H new ATOM 0 HG23 VAL B 103 18.543 2.668 -9.121 1.00 0.00 H new ATOM 2881 N ALA B 104 17.551 2.042 -5.067 1.00 0.00 N ATOM 2882 CA ALA B 104 18.345 1.935 -3.845 1.00 0.00 C ATOM 2883 C ALA B 104 18.072 0.578 -3.174 1.00 0.00 C ATOM 2884 O ALA B 104 16.973 0.328 -2.679 1.00 0.00 O ATOM 2885 CB ALA B 104 18.051 3.128 -2.936 1.00 0.00 C ATOM 0 H ALA B 104 16.711 2.614 -4.976 1.00 0.00 H new ATOM 0 HA ALA B 104 19.411 1.968 -4.072 1.00 0.00 H new ATOM 0 HB1 ALA B 104 18.644 3.046 -2.025 1.00 0.00 H new ATOM 0 HB2 ALA B 104 18.307 4.052 -3.454 1.00 0.00 H new ATOM 0 HB3 ALA B 104 16.992 3.138 -2.679 1.00 0.00 H new ATOM 2891 N GLU B 105 19.088 -0.295 -3.199 1.00 0.00 N ATOM 2892 CA GLU B 105 19.154 -1.583 -2.482 1.00 0.00 C ATOM 2893 C GLU B 105 18.345 -2.708 -3.153 1.00 0.00 C ATOM 2894 O GLU B 105 17.907 -3.682 -2.534 1.00 0.00 O ATOM 2895 CB GLU B 105 18.920 -1.403 -0.965 1.00 0.00 C ATOM 2896 CG GLU B 105 19.985 -0.458 -0.367 1.00 0.00 C ATOM 2897 CD GLU B 105 19.652 0.073 1.024 1.00 0.00 C ATOM 2898 OE1 GLU B 105 18.448 0.209 1.337 1.00 0.00 O ATOM 2899 OE2 GLU B 105 20.611 0.455 1.729 1.00 0.00 O ATOM 0 H GLU B 105 19.930 -0.116 -3.746 1.00 0.00 H new ATOM 0 HA GLU B 105 20.177 -1.950 -2.567 1.00 0.00 H new ATOM 0 HB2 GLU B 105 17.924 -0.997 -0.789 1.00 0.00 H new ATOM 0 HB3 GLU B 105 18.962 -2.371 -0.466 1.00 0.00 H new ATOM 0 HG2 GLU B 105 20.937 -0.987 -0.322 1.00 0.00 H new ATOM 0 HG3 GLU B 105 20.122 0.387 -1.041 1.00 0.00 H new ATOM 2906 N ARG B 106 18.240 -2.629 -4.486 1.00 0.00 N ATOM 2907 CA ARG B 106 17.702 -3.685 -5.344 1.00 0.00 C ATOM 2908 C ARG B 106 18.547 -4.970 -5.299 1.00 0.00 C ATOM 2909 O ARG B 106 19.352 -5.218 -6.193 1.00 0.00 O ATOM 2910 CB ARG B 106 17.565 -3.158 -6.785 1.00 0.00 C ATOM 2911 CG ARG B 106 16.635 -4.060 -7.610 1.00 0.00 C ATOM 2912 CD ARG B 106 17.337 -4.813 -8.742 1.00 0.00 C ATOM 2913 NE ARG B 106 17.850 -3.910 -9.784 1.00 0.00 N ATOM 2914 CZ ARG B 106 18.487 -4.301 -10.882 1.00 0.00 C ATOM 2915 NH1 ARG B 106 18.723 -5.573 -11.132 1.00 0.00 N ATOM 2916 NH2 ARG B 106 18.894 -3.404 -11.756 1.00 0.00 N ATOM 0 H ARG B 106 18.536 -1.805 -5.009 1.00 0.00 H new ATOM 0 HA ARG B 106 16.717 -3.957 -4.964 1.00 0.00 H new ATOM 0 HB2 ARG B 106 17.173 -2.141 -6.769 1.00 0.00 H new ATOM 0 HB3 ARG B 106 18.547 -3.113 -7.256 1.00 0.00 H new ATOM 0 HG2 ARG B 106 16.164 -4.783 -6.944 1.00 0.00 H new ATOM 0 HG3 ARG B 106 15.837 -3.450 -8.034 1.00 0.00 H new ATOM 0 HD2 ARG B 106 18.162 -5.394 -8.331 1.00 0.00 H new ATOM 0 HD3 ARG B 106 16.640 -5.521 -9.190 1.00 0.00 H new ATOM 0 HE ARG B 106 17.706 -2.909 -9.653 1.00 0.00 H new ATOM 0 HH11 ARG B 106 18.414 -6.288 -10.474 1.00 0.00 H new ATOM 0 HH12 ARG B 106 19.215 -5.843 -11.984 1.00 0.00 H new ATOM 0 HH21 ARG B 106 18.720 -2.413 -11.589 1.00 0.00 H new ATOM 0 HH22 ARG B 106 19.384 -3.700 -12.600 1.00 0.00 H new TER 2930 ARG B 106 HETATM 2931 CD CD A 107 14.838 0.448 -2.870 1.00 0.00 CD HETATM 2932 CD CD B 107 -1.743 -14.520 2.138 1.00 0.00 CD