USER MOD reduce.3.24.130724 H: found=0, std=0, add=1500, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1484 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 66 CYS SG : rot 180:sc= -0.489 USER MOD Set 1.2: B 68 HIS : no HE2:sc= -0.663 K(o=-1.7,f=-13!) USER MOD Set 1.3: B 83 CYS SG : rot 110:sc= 0.809 USER MOD Set 1.4: B 86 CYS SG : rot 94:sc= -1.34 USER MOD Set 2.1: B 50 CYS SG : rot -163:sc= 0.465 USER MOD Set 2.2: B 53 CYS SG : rot 153:sc= 1.98 USER MOD Set 2.3: B 71 CYS SG : rot 51:sc= 0.622 USER MOD Set 2.4: B 74 CYS SG : rot 180:sc= -1.42 USER MOD Set 3.1: A 19 GLN : amide:sc= 0.234 K(o=0.012,f=-3.7!) USER MOD Set 3.2: A 101 TYR OH : rot -106:sc= -0.223 USER MOD Set 4.1: A 91 CYS SG : rot 180:sc= 0 USER MOD Set 4.2: A 94 GLN : amide:sc= -0.0472 K(o=-0.047,f=-1.2) USER MOD Set 5.1: A 80 SER OG : rot -60:sc= -3! USER MOD Set 5.2: A 81 GLN : amide:sc= -0.115 X(o=-3.1,f=-3) USER MOD Set 6.1: A 69 THR OG1 : rot 180:sc= 1.04 USER MOD Set 6.2: A 72 SER OG : rot -96:sc= 1.31 USER MOD Set 7.1: A 55 LYS NZ :NH3+ -139:sc= 0.304 (180deg=-1.44) USER MOD Set 7.2: A 60 GLN : amide:sc= 0.263 K(o=0.57,f=-2.4) USER MOD Set 8.1: A 39 CYS SG : rot 68:sc= -0.16 USER MOD Set 8.2: A 41 HIS : no HD1:sc= -12.8! C(o=-13!,f=-25!) USER MOD Set 8.3: A 61 CYS SG : rot -149:sc= -0.347 USER MOD Set 8.4: A 64 CYS SG : rot -18:sc= 0.456 USER MOD Set 9.1: A 24 CYS SG : rot 110:sc= 0.7 USER MOD Set 9.2: A 27 CYS SG : rot -30:sc= -1.58 USER MOD Set 9.3: A 44 CYS SG : rot 180:sc= -4.39! USER MOD Set 9.4: A 47 CYS SG : rot 135:sc= -2.65! USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 MET CE :methyl -126:sc= -2.44! (180deg=-6.93!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 11:sc= -0.721! USER MOD Single : A 37 THR OG1 : rot 166:sc= -1.15 USER MOD Single : A 38 LYS NZ :NH3+ -146:sc= -0.596 (180deg=-1.14!) USER MOD Single : A 45 LYS NZ :NH3+ 145:sc= -0.955 (180deg=-2.06!) USER MOD Single : A 48 MET CE :methyl -122:sc= -5.66! (180deg=-13.8!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.318 X(o=-0.32,f=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= -2.31 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -0.283 X(o=-0.28,f=-0.36) USER MOD Single : A 70 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00361) USER MOD Single : A 74 GLN : amide:sc= -0.105 K(o=-0.11,f=-1.6!) USER MOD Single : A 76 SER OG : rot 120:sc= -1.58 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot -46:sc= -0.727 USER MOD Single : B 36 HIS : no HD1:sc= -7.62 K(o=-7.6,f=-15!) USER MOD Single : B 37 SER OG : rot 180:sc= 0 USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 SER OG : rot 180:sc= 0 USER MOD Single : B 54 THR OG1 : rot -60:sc= 0.76 USER MOD Single : B 55 ASN : amide:sc= 0.522 K(o=0.52,f=-4.7!) USER MOD Single : B 62 CYS SG : rot 21:sc= -1.83! USER MOD Single : B 72 SER OG : rot 180:sc= 0 USER MOD Single : B 73 ASN : amide:sc= -0.156 K(o=-0.16,f=-1.5!) USER MOD Single : B 76 SER OG : rot 180:sc= -0.883 USER MOD Single : B 78 CYS SG : rot 180:sc= 0 USER MOD Single : B 81 THR OG1 : rot -29:sc= 0.693 USER MOD Single : B 87 TYR OH : rot 180:sc= 0 USER MOD Single : B 88 THR OG1 : rot -140:sc= -1.39 USER MOD Single : B 93 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 98 ASN : amide:sc= -1.25 K(o=-1.2,f=-3.2!) USER MOD Single : B 100 GLN : amide:sc= -4.8! K(o=-4.8!,f=-1.1) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 104 MET CE :methyl -123:sc= -4.57 (180deg=-7.51!) USER MOD Single : B 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 108 CYS SG : rot -120:sc= -2.16 USER MOD Single : B 109 SER OG : rot 180:sc= 0 USER MOD Single : B 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 113 ASN : amide:sc= 0 X(o=0,f=0.41) USER MOD Single : B 116 HIS : no HE2:sc= -0.121 X(o=-0.12,f=-0.56) USER MOD ----------------------------------------------------------------- ATOM 32 N LEU A 3 -0.148 26.199 -5.230 1.00 0.00 N ATOM 33 CA LEU A 3 -1.481 25.886 -5.733 1.00 0.00 C ATOM 34 C LEU A 3 -2.524 26.818 -5.123 1.00 0.00 C ATOM 35 O LEU A 3 -3.641 26.400 -4.813 1.00 0.00 O ATOM 36 CB LEU A 3 -1.835 24.430 -5.424 1.00 0.00 C ATOM 37 CG LEU A 3 -2.609 23.704 -6.526 1.00 0.00 C ATOM 38 CD1 LEU A 3 -1.691 23.370 -7.691 1.00 0.00 C ATOM 39 CD2 LEU A 3 -3.258 22.443 -5.977 1.00 0.00 C ATOM 0 HA LEU A 3 -1.480 26.030 -6.813 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -0.914 23.882 -5.227 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -2.425 24.402 -4.508 1.00 0.00 H new ATOM 0 HG LEU A 3 -3.396 24.366 -6.889 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -2.259 22.854 -8.465 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -1.273 24.290 -8.100 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -0.882 22.727 -7.344 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -3.805 21.939 -6.774 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -2.488 21.777 -5.588 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -3.948 22.708 -5.176 1.00 0.00 H new ATOM 51 N SER A 4 -2.151 28.081 -4.950 1.00 0.00 N ATOM 52 CA SER A 4 -3.051 29.074 -4.374 1.00 0.00 C ATOM 53 C SER A 4 -3.438 28.701 -2.945 1.00 0.00 C ATOM 54 O SER A 4 -4.454 29.163 -2.428 1.00 0.00 O ATOM 55 CB SER A 4 -4.308 29.215 -5.234 1.00 0.00 C ATOM 56 OG SER A 4 -3.980 29.609 -6.555 1.00 0.00 O ATOM 0 H SER A 4 -1.231 28.442 -5.201 1.00 0.00 H new ATOM 0 HA SER A 4 -2.526 30.029 -4.350 1.00 0.00 H new ATOM 0 HB2 SER A 4 -4.845 28.267 -5.257 1.00 0.00 H new ATOM 0 HB3 SER A 4 -4.978 29.950 -4.787 1.00 0.00 H new ATOM 0 HG SER A 4 -4.800 29.691 -7.085 1.00 0.00 H new ATOM 62 N ALA A 5 -2.621 27.863 -2.310 1.00 0.00 N ATOM 63 CA ALA A 5 -2.881 27.432 -0.941 1.00 0.00 C ATOM 64 C ALA A 5 -4.269 26.812 -0.806 1.00 0.00 C ATOM 65 O ALA A 5 -4.841 26.781 0.283 1.00 0.00 O ATOM 66 CB ALA A 5 -2.733 28.605 0.013 1.00 0.00 C ATOM 0 H ALA A 5 -1.775 27.470 -2.722 1.00 0.00 H new ATOM 0 HA ALA A 5 -2.148 26.667 -0.684 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -2.929 28.272 1.032 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -1.719 29.000 -0.051 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -3.444 29.386 -0.257 1.00 0.00 H new ATOM 72 N LEU A 6 -4.806 26.321 -1.918 1.00 0.00 N ATOM 73 CA LEU A 6 -6.127 25.704 -1.922 1.00 0.00 C ATOM 74 C LEU A 6 -6.183 24.525 -0.956 1.00 0.00 C ATOM 75 O LEU A 6 -7.057 24.459 -0.090 1.00 0.00 O ATOM 76 CB LEU A 6 -6.491 25.238 -3.334 1.00 0.00 C ATOM 77 CG LEU A 6 -6.791 26.359 -4.328 1.00 0.00 C ATOM 78 CD1 LEU A 6 -6.447 25.923 -5.744 1.00 0.00 C ATOM 79 CD2 LEU A 6 -8.252 26.774 -4.238 1.00 0.00 C ATOM 0 H LEU A 6 -4.346 26.339 -2.828 1.00 0.00 H new ATOM 0 HA LEU A 6 -6.849 26.452 -1.595 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -5.670 24.637 -3.725 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -7.362 24.586 -3.272 1.00 0.00 H new ATOM 0 HG LEU A 6 -6.172 27.219 -4.073 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -6.667 26.734 -6.438 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -5.387 25.674 -5.801 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -7.040 25.048 -6.009 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -8.448 27.573 -4.953 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -8.888 25.919 -4.467 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -8.468 27.128 -3.230 1.00 0.00 H new ATOM 91 N ARG A 7 -5.244 23.596 -1.109 1.00 0.00 N ATOM 92 CA ARG A 7 -5.186 22.420 -0.249 1.00 0.00 C ATOM 93 C ARG A 7 -3.953 21.579 -0.563 1.00 0.00 C ATOM 94 O ARG A 7 -4.045 20.366 -0.756 1.00 0.00 O ATOM 95 CB ARG A 7 -6.453 21.576 -0.417 1.00 0.00 C ATOM 96 CG ARG A 7 -6.835 20.799 0.832 1.00 0.00 C ATOM 97 CD ARG A 7 -8.344 20.698 0.984 1.00 0.00 C ATOM 98 NE ARG A 7 -8.757 20.724 2.385 1.00 0.00 N ATOM 99 CZ ARG A 7 -9.957 20.340 2.813 1.00 0.00 C ATOM 100 NH1 ARG A 7 -10.866 19.899 1.951 1.00 0.00 N ATOM 101 NH2 ARG A 7 -10.250 20.395 4.105 1.00 0.00 N ATOM 0 H ARG A 7 -4.514 23.635 -1.820 1.00 0.00 H new ATOM 0 HA ARG A 7 -5.119 22.758 0.785 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -7.280 22.229 -0.696 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -6.307 20.876 -1.240 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -6.405 19.798 0.785 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -6.412 21.287 1.710 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -8.818 21.523 0.451 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -8.694 19.776 0.520 1.00 0.00 H new ATOM 0 HE ARG A 7 -8.085 21.056 3.077 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -10.646 19.854 0.956 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -11.784 19.606 2.284 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -9.555 20.732 4.772 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -11.170 20.100 4.432 1.00 0.00 H new ATOM 115 N VAL A 8 -2.797 22.232 -0.615 1.00 0.00 N ATOM 116 CA VAL A 8 -1.544 21.546 -0.906 1.00 0.00 C ATOM 117 C VAL A 8 -0.936 20.949 0.359 1.00 0.00 C ATOM 118 O VAL A 8 -0.265 19.917 0.309 1.00 0.00 O ATOM 119 CB VAL A 8 -0.520 22.498 -1.552 1.00 0.00 C ATOM 120 CG1 VAL A 8 0.701 21.727 -2.031 1.00 0.00 C ATOM 121 CG2 VAL A 8 -1.157 23.269 -2.698 1.00 0.00 C ATOM 0 H VAL A 8 -2.702 23.236 -0.459 1.00 0.00 H new ATOM 0 HA VAL A 8 -1.778 20.745 -1.607 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.194 23.215 -0.799 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.412 22.417 -2.484 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.170 21.226 -1.184 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.396 20.984 -2.768 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.419 23.937 -3.142 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -1.514 22.569 -3.453 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -1.995 23.855 -2.321 1.00 0.00 H new ATOM 131 N GLU A 9 -1.178 21.601 1.491 1.00 0.00 N ATOM 132 CA GLU A 9 -0.653 21.133 2.769 1.00 0.00 C ATOM 133 C GLU A 9 -1.363 19.859 3.215 1.00 0.00 C ATOM 134 O GLU A 9 -0.740 18.949 3.763 1.00 0.00 O ATOM 135 CB GLU A 9 -0.809 22.218 3.837 1.00 0.00 C ATOM 136 CG GLU A 9 -2.245 22.682 4.027 1.00 0.00 C ATOM 137 CD GLU A 9 -2.347 24.175 4.273 1.00 0.00 C ATOM 138 OE1 GLU A 9 -1.913 24.952 3.397 1.00 0.00 O ATOM 139 OE2 GLU A 9 -2.861 24.566 5.341 1.00 0.00 O ATOM 0 H GLU A 9 -1.734 22.454 1.550 1.00 0.00 H new ATOM 0 HA GLU A 9 0.406 20.911 2.639 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -0.430 21.839 4.786 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.192 23.075 3.566 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -2.827 22.423 3.143 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -2.687 22.148 4.868 1.00 0.00 H new ATOM 146 N GLU A 10 -2.669 19.800 2.978 1.00 0.00 N ATOM 147 CA GLU A 10 -3.463 18.637 3.356 1.00 0.00 C ATOM 148 C GLU A 10 -3.097 17.426 2.504 1.00 0.00 C ATOM 149 O GLU A 10 -2.792 16.355 3.027 1.00 0.00 O ATOM 150 CB GLU A 10 -4.956 18.943 3.212 1.00 0.00 C ATOM 151 CG GLU A 10 -5.401 20.175 3.984 1.00 0.00 C ATOM 152 CD GLU A 10 -5.029 20.108 5.452 1.00 0.00 C ATOM 153 OE1 GLU A 10 -3.896 20.508 5.797 1.00 0.00 O ATOM 154 OE2 GLU A 10 -5.870 19.658 6.257 1.00 0.00 O ATOM 0 H GLU A 10 -3.200 20.544 2.526 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.245 18.404 4.398 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -5.190 19.082 2.156 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -5.530 18.082 3.555 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.949 21.061 3.538 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -6.481 20.287 3.891 1.00 0.00 H new ATOM 161 N VAL A 11 -3.128 17.605 1.187 1.00 0.00 N ATOM 162 CA VAL A 11 -2.799 16.526 0.262 1.00 0.00 C ATOM 163 C VAL A 11 -1.381 16.015 0.498 1.00 0.00 C ATOM 164 O VAL A 11 -1.151 14.808 0.573 1.00 0.00 O ATOM 165 CB VAL A 11 -2.932 16.982 -1.204 1.00 0.00 C ATOM 166 CG1 VAL A 11 -2.712 15.812 -2.151 1.00 0.00 C ATOM 167 CG2 VAL A 11 -4.291 17.622 -1.444 1.00 0.00 C ATOM 0 H VAL A 11 -3.377 18.486 0.737 1.00 0.00 H new ATOM 0 HA VAL A 11 -3.509 15.720 0.449 1.00 0.00 H new ATOM 0 HB VAL A 11 -2.164 17.729 -1.402 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -2.810 16.154 -3.181 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -1.713 15.403 -1.998 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -3.455 15.039 -1.953 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -4.366 17.937 -2.485 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -5.077 16.899 -1.226 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -4.405 18.489 -0.793 1.00 0.00 H new ATOM 177 N GLN A 12 -0.433 16.942 0.613 1.00 0.00 N ATOM 178 CA GLN A 12 0.964 16.585 0.840 1.00 0.00 C ATOM 179 C GLN A 12 1.106 15.661 2.046 1.00 0.00 C ATOM 180 O GLN A 12 1.958 14.772 2.063 1.00 0.00 O ATOM 181 CB GLN A 12 1.805 17.847 1.048 1.00 0.00 C ATOM 182 CG GLN A 12 3.302 17.603 0.951 1.00 0.00 C ATOM 183 CD GLN A 12 4.097 18.471 1.905 1.00 0.00 C ATOM 184 OE1 GLN A 12 4.719 19.452 1.498 1.00 0.00 O ATOM 185 NE2 GLN A 12 4.080 18.114 3.184 1.00 0.00 N ATOM 0 H GLN A 12 -0.607 17.945 0.553 1.00 0.00 H new ATOM 0 HA GLN A 12 1.324 16.055 -0.042 1.00 0.00 H new ATOM 0 HB2 GLN A 12 1.518 18.591 0.305 1.00 0.00 H new ATOM 0 HB3 GLN A 12 1.577 18.269 2.027 1.00 0.00 H new ATOM 0 HG2 GLN A 12 3.510 16.554 1.161 1.00 0.00 H new ATOM 0 HG3 GLN A 12 3.632 17.795 -0.070 1.00 0.00 H new ATOM 0 HE21 GLN A 12 3.551 17.293 3.477 1.00 0.00 H new ATOM 0 HE22 GLN A 12 4.596 18.661 3.873 1.00 0.00 H new ATOM 194 N ASN A 13 0.266 15.876 3.053 1.00 0.00 N ATOM 195 CA ASN A 13 0.297 15.060 4.261 1.00 0.00 C ATOM 196 C ASN A 13 -0.189 13.644 3.973 1.00 0.00 C ATOM 197 O ASN A 13 0.249 12.685 4.607 1.00 0.00 O ATOM 198 CB ASN A 13 -0.565 15.696 5.353 1.00 0.00 C ATOM 199 CG ASN A 13 0.190 16.744 6.149 1.00 0.00 C ATOM 200 OD1 ASN A 13 1.134 17.357 5.651 1.00 0.00 O ATOM 201 ND2 ASN A 13 -0.224 16.954 7.393 1.00 0.00 N ATOM 0 H ASN A 13 -0.444 16.608 3.056 1.00 0.00 H new ATOM 0 HA ASN A 13 1.329 15.007 4.608 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.444 16.153 4.898 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.923 14.919 6.028 1.00 0.00 H new ATOM 0 HD21 ASN A 13 0.245 17.647 7.977 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -1.011 16.423 7.765 1.00 0.00 H new ATOM 208 N VAL A 14 -1.099 13.521 3.011 1.00 0.00 N ATOM 209 CA VAL A 14 -1.647 12.222 2.638 1.00 0.00 C ATOM 210 C VAL A 14 -0.631 11.404 1.847 1.00 0.00 C ATOM 211 O VAL A 14 -0.545 10.186 1.999 1.00 0.00 O ATOM 212 CB VAL A 14 -2.932 12.374 1.802 1.00 0.00 C ATOM 213 CG1 VAL A 14 -3.568 11.015 1.543 1.00 0.00 C ATOM 214 CG2 VAL A 14 -3.915 13.305 2.496 1.00 0.00 C ATOM 0 H VAL A 14 -1.472 14.305 2.476 1.00 0.00 H new ATOM 0 HA VAL A 14 -1.886 11.701 3.565 1.00 0.00 H new ATOM 0 HB VAL A 14 -2.666 12.814 0.841 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -4.474 11.144 0.951 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -2.866 10.383 0.999 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -3.819 10.544 2.493 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -4.816 13.400 1.890 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -4.175 12.897 3.472 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.459 14.287 2.623 1.00 0.00 H new ATOM 224 N ILE A 15 0.138 12.082 0.999 1.00 0.00 N ATOM 225 CA ILE A 15 1.146 11.414 0.184 1.00 0.00 C ATOM 226 C ILE A 15 2.246 10.815 1.054 1.00 0.00 C ATOM 227 O ILE A 15 2.822 9.780 0.720 1.00 0.00 O ATOM 228 CB ILE A 15 1.782 12.380 -0.834 1.00 0.00 C ATOM 229 CG1 ILE A 15 0.701 13.168 -1.578 1.00 0.00 C ATOM 230 CG2 ILE A 15 2.654 11.612 -1.817 1.00 0.00 C ATOM 231 CD1 ILE A 15 -0.352 12.293 -2.226 1.00 0.00 C ATOM 0 H ILE A 15 0.082 13.091 0.859 1.00 0.00 H new ATOM 0 HA ILE A 15 0.636 10.616 -0.356 1.00 0.00 H new ATOM 0 HB ILE A 15 2.409 13.088 -0.293 1.00 0.00 H new ATOM 0 HG12 ILE A 15 0.215 13.850 -0.880 1.00 0.00 H new ATOM 0 HG13 ILE A 15 1.174 13.781 -2.345 1.00 0.00 H new ATOM 0 HG21 ILE A 15 3.097 12.307 -2.530 1.00 0.00 H new ATOM 0 HG22 ILE A 15 3.446 11.095 -1.274 1.00 0.00 H new ATOM 0 HG23 ILE A 15 2.045 10.883 -2.351 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.084 12.921 -2.734 1.00 0.00 H new ATOM 0 HD12 ILE A 15 0.121 11.629 -2.949 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -0.852 11.699 -1.461 1.00 0.00 H new ATOM 243 N ASN A 16 2.533 11.474 2.172 1.00 0.00 N ATOM 244 CA ASN A 16 3.566 11.007 3.090 1.00 0.00 C ATOM 245 C ASN A 16 3.108 9.758 3.837 1.00 0.00 C ATOM 246 O ASN A 16 3.854 8.787 3.958 1.00 0.00 O ATOM 247 CB ASN A 16 3.926 12.109 4.089 1.00 0.00 C ATOM 248 CG ASN A 16 5.385 12.068 4.495 1.00 0.00 C ATOM 249 OD1 ASN A 16 5.823 11.150 5.190 1.00 0.00 O ATOM 250 ND2 ASN A 16 6.149 13.064 4.062 1.00 0.00 N ATOM 0 H ASN A 16 2.065 12.332 2.464 1.00 0.00 H new ATOM 0 HA ASN A 16 4.449 10.754 2.504 1.00 0.00 H new ATOM 0 HB2 ASN A 16 3.701 13.081 3.650 1.00 0.00 H new ATOM 0 HB3 ASN A 16 3.302 12.008 4.977 1.00 0.00 H new ATOM 0 HD21 ASN A 16 7.140 13.089 4.303 1.00 0.00 H new ATOM 0 HD22 ASN A 16 5.745 13.804 3.488 1.00 0.00 H new ATOM 257 N ALA A 17 1.876 9.792 4.336 1.00 0.00 N ATOM 258 CA ALA A 17 1.319 8.662 5.071 1.00 0.00 C ATOM 259 C ALA A 17 1.304 7.401 4.214 1.00 0.00 C ATOM 260 O ALA A 17 1.667 6.320 4.676 1.00 0.00 O ATOM 261 CB ALA A 17 -0.086 8.991 5.555 1.00 0.00 C ATOM 0 H ALA A 17 1.245 10.589 4.245 1.00 0.00 H new ATOM 0 HA ALA A 17 1.956 8.473 5.935 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -0.491 8.140 6.102 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -0.050 9.861 6.211 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.724 9.209 4.699 1.00 0.00 H new ATOM 267 N MET A 18 0.880 7.547 2.962 1.00 0.00 N ATOM 268 CA MET A 18 0.817 6.421 2.039 1.00 0.00 C ATOM 269 C MET A 18 2.186 5.765 1.881 1.00 0.00 C ATOM 270 O MET A 18 2.296 4.539 1.838 1.00 0.00 O ATOM 271 CB MET A 18 0.297 6.883 0.675 1.00 0.00 C ATOM 272 CG MET A 18 -0.709 5.929 0.054 1.00 0.00 C ATOM 273 SD MET A 18 -1.635 6.680 -1.301 1.00 0.00 S ATOM 274 CE MET A 18 -2.507 7.982 -0.434 1.00 0.00 C ATOM 0 H MET A 18 0.575 8.435 2.564 1.00 0.00 H new ATOM 0 HA MET A 18 0.129 5.683 2.452 1.00 0.00 H new ATOM 0 HB2 MET A 18 -0.165 7.864 0.785 1.00 0.00 H new ATOM 0 HB3 MET A 18 1.140 7.002 -0.005 1.00 0.00 H new ATOM 0 HG2 MET A 18 -0.187 5.046 -0.314 1.00 0.00 H new ATOM 0 HG3 MET A 18 -1.405 5.591 0.822 1.00 0.00 H new ATOM 0 HE1 MET A 18 -3.576 7.898 -0.631 1.00 0.00 H new ATOM 0 HE2 MET A 18 -2.328 7.889 0.637 1.00 0.00 H new ATOM 0 HE3 MET A 18 -2.149 8.952 -0.779 1.00 0.00 H new ATOM 284 N GLN A 19 3.227 6.588 1.797 1.00 0.00 N ATOM 285 CA GLN A 19 4.587 6.084 1.645 1.00 0.00 C ATOM 286 C GLN A 19 4.965 5.180 2.814 1.00 0.00 C ATOM 287 O GLN A 19 5.610 4.148 2.630 1.00 0.00 O ATOM 288 CB GLN A 19 5.578 7.245 1.541 1.00 0.00 C ATOM 289 CG GLN A 19 6.798 6.929 0.692 1.00 0.00 C ATOM 290 CD GLN A 19 7.897 7.962 0.843 1.00 0.00 C ATOM 291 OE1 GLN A 19 7.635 9.124 1.154 1.00 0.00 O ATOM 292 NE2 GLN A 19 9.138 7.543 0.623 1.00 0.00 N ATOM 0 H GLN A 19 3.155 7.605 1.832 1.00 0.00 H new ATOM 0 HA GLN A 19 4.629 5.498 0.727 1.00 0.00 H new ATOM 0 HB2 GLN A 19 5.067 8.111 1.120 1.00 0.00 H new ATOM 0 HB3 GLN A 19 5.905 7.523 2.543 1.00 0.00 H new ATOM 0 HG2 GLN A 19 7.185 5.949 0.970 1.00 0.00 H new ATOM 0 HG3 GLN A 19 6.502 6.870 -0.355 1.00 0.00 H new ATOM 0 HE21 GLN A 19 9.310 6.571 0.367 1.00 0.00 H new ATOM 0 HE22 GLN A 19 9.919 8.193 0.710 1.00 0.00 H new ATOM 301 N LYS A 20 4.554 5.573 4.016 1.00 0.00 N ATOM 302 CA LYS A 20 4.848 4.795 5.215 1.00 0.00 C ATOM 303 C LYS A 20 4.273 3.388 5.098 1.00 0.00 C ATOM 304 O LYS A 20 4.833 2.430 5.630 1.00 0.00 O ATOM 305 CB LYS A 20 4.278 5.492 6.453 1.00 0.00 C ATOM 306 CG LYS A 20 5.249 6.461 7.107 1.00 0.00 C ATOM 307 CD LYS A 20 4.622 7.154 8.306 1.00 0.00 C ATOM 308 CE LYS A 20 5.651 7.433 9.389 1.00 0.00 C ATOM 309 NZ LYS A 20 6.330 8.743 9.186 1.00 0.00 N ATOM 0 H LYS A 20 4.017 6.424 4.186 1.00 0.00 H new ATOM 0 HA LYS A 20 5.931 4.720 5.317 1.00 0.00 H new ATOM 0 HB2 LYS A 20 3.374 6.031 6.172 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.985 4.737 7.182 1.00 0.00 H new ATOM 0 HG2 LYS A 20 6.143 5.924 7.423 1.00 0.00 H new ATOM 0 HG3 LYS A 20 5.566 7.207 6.379 1.00 0.00 H new ATOM 0 HD2 LYS A 20 4.164 8.091 7.988 1.00 0.00 H new ATOM 0 HD3 LYS A 20 3.825 6.531 8.712 1.00 0.00 H new ATOM 0 HE2 LYS A 20 5.163 7.424 10.364 1.00 0.00 H new ATOM 0 HE3 LYS A 20 6.395 6.636 9.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 7.024 8.896 9.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 6.817 8.743 8.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 5.624 9.506 9.204 1.00 0.00 H new ATOM 323 N ILE A 21 3.151 3.272 4.395 1.00 0.00 N ATOM 324 CA ILE A 21 2.498 1.983 4.200 1.00 0.00 C ATOM 325 C ILE A 21 3.316 1.099 3.265 1.00 0.00 C ATOM 326 O ILE A 21 3.314 -0.126 3.393 1.00 0.00 O ATOM 327 CB ILE A 21 1.080 2.159 3.622 1.00 0.00 C ATOM 328 CG1 ILE A 21 0.284 3.151 4.470 1.00 0.00 C ATOM 329 CG2 ILE A 21 0.360 0.820 3.550 1.00 0.00 C ATOM 330 CD1 ILE A 21 -0.923 3.722 3.761 1.00 0.00 C ATOM 0 H ILE A 21 2.675 4.057 3.950 1.00 0.00 H new ATOM 0 HA ILE A 21 2.424 1.505 5.177 1.00 0.00 H new ATOM 0 HB ILE A 21 1.165 2.555 2.610 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -0.043 2.655 5.384 1.00 0.00 H new ATOM 0 HG13 ILE A 21 0.940 3.969 4.769 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -0.639 0.966 3.139 1.00 0.00 H new ATOM 0 HG22 ILE A 21 0.920 0.140 2.909 1.00 0.00 H new ATOM 0 HG23 ILE A 21 0.283 0.394 4.550 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -1.439 4.417 4.423 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -0.602 4.248 2.862 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -1.600 2.913 3.486 1.00 0.00 H new ATOM 342 N LEU A 22 4.016 1.729 2.329 1.00 0.00 N ATOM 343 CA LEU A 22 4.844 1.002 1.373 1.00 0.00 C ATOM 344 C LEU A 22 6.322 1.143 1.721 1.00 0.00 C ATOM 345 O LEU A 22 7.182 1.109 0.841 1.00 0.00 O ATOM 346 CB LEU A 22 4.593 1.519 -0.044 1.00 0.00 C ATOM 347 CG LEU A 22 3.382 0.910 -0.753 1.00 0.00 C ATOM 348 CD1 LEU A 22 3.461 -0.607 -0.732 1.00 0.00 C ATOM 349 CD2 LEU A 22 2.091 1.388 -0.105 1.00 0.00 C ATOM 0 H LEU A 22 4.027 2.742 2.211 1.00 0.00 H new ATOM 0 HA LEU A 22 4.574 -0.053 1.422 1.00 0.00 H new ATOM 0 HB2 LEU A 22 4.464 2.600 -0.002 1.00 0.00 H new ATOM 0 HB3 LEU A 22 5.481 1.328 -0.646 1.00 0.00 H new ATOM 0 HG LEU A 22 3.388 1.239 -1.792 1.00 0.00 H new ATOM 0 HD11 LEU A 22 2.592 -1.024 -1.241 1.00 0.00 H new ATOM 0 HD12 LEU A 22 4.369 -0.931 -1.241 1.00 0.00 H new ATOM 0 HD13 LEU A 22 3.479 -0.956 0.300 1.00 0.00 H new ATOM 0 HD21 LEU A 22 1.239 0.945 -0.621 1.00 0.00 H new ATOM 0 HD22 LEU A 22 2.077 1.087 0.943 1.00 0.00 H new ATOM 0 HD23 LEU A 22 2.031 2.474 -0.171 1.00 0.00 H new ATOM 361 N GLU A 23 6.611 1.305 3.008 1.00 0.00 N ATOM 362 CA GLU A 23 7.986 1.457 3.468 1.00 0.00 C ATOM 363 C GLU A 23 8.634 0.100 3.722 1.00 0.00 C ATOM 364 O GLU A 23 8.089 -0.942 3.355 1.00 0.00 O ATOM 365 CB GLU A 23 8.031 2.308 4.739 1.00 0.00 C ATOM 366 CG GLU A 23 9.114 3.374 4.716 1.00 0.00 C ATOM 367 CD GLU A 23 8.806 4.539 5.636 1.00 0.00 C ATOM 368 OE1 GLU A 23 9.155 4.459 6.832 1.00 0.00 O ATOM 369 OE2 GLU A 23 8.214 5.531 5.160 1.00 0.00 O ATOM 0 H GLU A 23 5.912 1.334 3.750 1.00 0.00 H new ATOM 0 HA GLU A 23 8.549 1.961 2.683 1.00 0.00 H new ATOM 0 HB2 GLU A 23 7.063 2.788 4.880 1.00 0.00 H new ATOM 0 HB3 GLU A 23 8.192 1.656 5.598 1.00 0.00 H new ATOM 0 HG2 GLU A 23 10.064 2.927 5.008 1.00 0.00 H new ATOM 0 HG3 GLU A 23 9.234 3.742 3.697 1.00 0.00 H new ATOM 376 N CYS A 24 9.806 0.124 4.347 1.00 0.00 N ATOM 377 CA CYS A 24 10.544 -1.095 4.648 1.00 0.00 C ATOM 378 C CYS A 24 10.650 -1.311 6.158 1.00 0.00 C ATOM 379 O CYS A 24 10.884 -0.365 6.910 1.00 0.00 O ATOM 380 CB CYS A 24 11.936 -1.008 4.033 1.00 0.00 C ATOM 381 SG CYS A 24 12.810 -2.582 3.929 1.00 0.00 S ATOM 0 H CYS A 24 10.267 0.980 4.656 1.00 0.00 H new ATOM 0 HA CYS A 24 10.008 -1.943 4.223 1.00 0.00 H new ATOM 0 HB2 CYS A 24 11.851 -0.588 3.031 1.00 0.00 H new ATOM 0 HB3 CYS A 24 12.536 -0.312 4.620 1.00 0.00 H new ATOM 0 HG CYS A 24 12.900 -2.947 2.685 1.00 0.00 H new ATOM 386 N PRO A 25 10.459 -2.557 6.627 1.00 0.00 N ATOM 387 CA PRO A 25 10.509 -2.887 8.046 1.00 0.00 C ATOM 388 C PRO A 25 11.881 -3.368 8.526 1.00 0.00 C ATOM 389 O PRO A 25 11.996 -3.904 9.628 1.00 0.00 O ATOM 390 CB PRO A 25 9.499 -4.024 8.132 1.00 0.00 C ATOM 391 CG PRO A 25 9.642 -4.752 6.833 1.00 0.00 C ATOM 392 CD PRO A 25 10.143 -3.748 5.817 1.00 0.00 C ATOM 0 HA PRO A 25 10.302 -2.020 8.673 1.00 0.00 H new ATOM 0 HB2 PRO A 25 9.709 -4.678 8.978 1.00 0.00 H new ATOM 0 HB3 PRO A 25 8.486 -3.645 8.265 1.00 0.00 H new ATOM 0 HG2 PRO A 25 10.341 -5.583 6.931 1.00 0.00 H new ATOM 0 HG3 PRO A 25 8.687 -5.174 6.520 1.00 0.00 H new ATOM 0 HD2 PRO A 25 11.022 -4.118 5.289 1.00 0.00 H new ATOM 0 HD3 PRO A 25 9.387 -3.530 5.063 1.00 0.00 H new ATOM 400 N ILE A 26 12.921 -3.186 7.712 1.00 0.00 N ATOM 401 CA ILE A 26 14.258 -3.627 8.108 1.00 0.00 C ATOM 402 C ILE A 26 15.342 -2.608 7.751 1.00 0.00 C ATOM 403 O ILE A 26 16.267 -2.385 8.534 1.00 0.00 O ATOM 404 CB ILE A 26 14.616 -4.995 7.488 1.00 0.00 C ATOM 405 CG1 ILE A 26 14.742 -4.890 5.967 1.00 0.00 C ATOM 406 CG2 ILE A 26 13.571 -6.034 7.865 1.00 0.00 C ATOM 407 CD1 ILE A 26 16.169 -4.722 5.491 1.00 0.00 C ATOM 0 H ILE A 26 12.867 -2.746 6.793 1.00 0.00 H new ATOM 0 HA ILE A 26 14.227 -3.725 9.193 1.00 0.00 H new ATOM 0 HB ILE A 26 15.581 -5.308 7.886 1.00 0.00 H new ATOM 0 HG12 ILE A 26 14.318 -5.786 5.512 1.00 0.00 H new ATOM 0 HG13 ILE A 26 14.149 -4.045 5.618 1.00 0.00 H new ATOM 0 HG21 ILE A 26 13.836 -6.994 7.421 1.00 0.00 H new ATOM 0 HG22 ILE A 26 13.532 -6.134 8.950 1.00 0.00 H new ATOM 0 HG23 ILE A 26 12.595 -5.720 7.494 1.00 0.00 H new ATOM 0 HD11 ILE A 26 16.184 -4.654 4.403 1.00 0.00 H new ATOM 0 HD12 ILE A 26 16.590 -3.811 5.917 1.00 0.00 H new ATOM 0 HD13 ILE A 26 16.762 -5.579 5.809 1.00 0.00 H new ATOM 419 N CYS A 27 15.237 -1.992 6.577 1.00 0.00 N ATOM 420 CA CYS A 27 16.227 -1.006 6.149 1.00 0.00 C ATOM 421 C CYS A 27 15.575 0.327 5.785 1.00 0.00 C ATOM 422 O CYS A 27 16.257 1.264 5.368 1.00 0.00 O ATOM 423 CB CYS A 27 17.031 -1.537 4.960 1.00 0.00 C ATOM 424 SG CYS A 27 16.038 -1.888 3.491 1.00 0.00 S ATOM 0 H CYS A 27 14.483 -2.155 5.909 1.00 0.00 H new ATOM 0 HA CYS A 27 16.900 -0.832 6.989 1.00 0.00 H new ATOM 0 HB2 CYS A 27 17.798 -0.808 4.700 1.00 0.00 H new ATOM 0 HB3 CYS A 27 17.547 -2.448 5.263 1.00 0.00 H new ATOM 0 HG CYS A 27 14.840 -2.240 3.851 1.00 0.00 H new ATOM 429 N LEU A 28 14.260 0.413 5.950 1.00 0.00 N ATOM 430 CA LEU A 28 13.528 1.638 5.643 1.00 0.00 C ATOM 431 C LEU A 28 13.744 2.066 4.193 1.00 0.00 C ATOM 432 O LEU A 28 13.699 3.256 3.879 1.00 0.00 O ATOM 433 CB LEU A 28 13.960 2.762 6.587 1.00 0.00 C ATOM 434 CG LEU A 28 13.232 2.794 7.931 1.00 0.00 C ATOM 435 CD1 LEU A 28 11.764 3.143 7.734 1.00 0.00 C ATOM 436 CD2 LEU A 28 13.373 1.459 8.646 1.00 0.00 C ATOM 0 H LEU A 28 13.678 -0.351 6.295 1.00 0.00 H new ATOM 0 HA LEU A 28 12.466 1.436 5.783 1.00 0.00 H new ATOM 0 HB2 LEU A 28 15.030 2.669 6.773 1.00 0.00 H new ATOM 0 HB3 LEU A 28 13.806 3.717 6.085 1.00 0.00 H new ATOM 0 HG LEU A 28 13.688 3.565 8.552 1.00 0.00 H new ATOM 0 HD11 LEU A 28 11.261 3.161 8.701 1.00 0.00 H new ATOM 0 HD12 LEU A 28 11.683 4.123 7.264 1.00 0.00 H new ATOM 0 HD13 LEU A 28 11.295 2.395 7.095 1.00 0.00 H new ATOM 0 HD21 LEU A 28 12.849 1.500 9.601 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.943 0.669 8.030 1.00 0.00 H new ATOM 0 HD23 LEU A 28 14.428 1.249 8.821 1.00 0.00 H new ATOM 448 N GLU A 29 13.973 1.097 3.311 1.00 0.00 N ATOM 449 CA GLU A 29 14.186 1.394 1.898 1.00 0.00 C ATOM 450 C GLU A 29 12.945 1.056 1.079 1.00 0.00 C ATOM 451 O GLU A 29 12.509 -0.094 1.048 1.00 0.00 O ATOM 452 CB GLU A 29 15.390 0.616 1.363 1.00 0.00 C ATOM 453 CG GLU A 29 16.680 0.900 2.115 1.00 0.00 C ATOM 454 CD GLU A 29 17.454 2.063 1.528 1.00 0.00 C ATOM 455 OE1 GLU A 29 16.859 3.148 1.362 1.00 0.00 O ATOM 456 OE2 GLU A 29 18.655 1.889 1.233 1.00 0.00 O ATOM 0 H GLU A 29 14.016 0.106 3.548 1.00 0.00 H new ATOM 0 HA GLU A 29 14.384 2.462 1.805 1.00 0.00 H new ATOM 0 HB2 GLU A 29 15.175 -0.451 1.416 1.00 0.00 H new ATOM 0 HB3 GLU A 29 15.531 0.860 0.310 1.00 0.00 H new ATOM 0 HG2 GLU A 29 16.448 1.113 3.159 1.00 0.00 H new ATOM 0 HG3 GLU A 29 17.307 0.008 2.103 1.00 0.00 H new ATOM 463 N LEU A 30 12.380 2.068 0.419 1.00 0.00 N ATOM 464 CA LEU A 30 11.181 1.886 -0.405 1.00 0.00 C ATOM 465 C LEU A 30 11.218 0.557 -1.156 1.00 0.00 C ATOM 466 O LEU A 30 11.849 0.440 -2.206 1.00 0.00 O ATOM 467 CB LEU A 30 11.040 3.043 -1.398 1.00 0.00 C ATOM 468 CG LEU A 30 9.679 3.139 -2.093 1.00 0.00 C ATOM 469 CD1 LEU A 30 8.553 3.128 -1.071 1.00 0.00 C ATOM 470 CD2 LEU A 30 9.607 4.393 -2.952 1.00 0.00 C ATOM 0 H LEU A 30 12.733 3.025 0.438 1.00 0.00 H new ATOM 0 HA LEU A 30 10.318 1.875 0.261 1.00 0.00 H new ATOM 0 HB2 LEU A 30 11.229 3.979 -0.871 1.00 0.00 H new ATOM 0 HB3 LEU A 30 11.814 2.944 -2.160 1.00 0.00 H new ATOM 0 HG LEU A 30 9.562 2.270 -2.740 1.00 0.00 H new ATOM 0 HD11 LEU A 30 7.594 3.197 -1.585 1.00 0.00 H new ATOM 0 HD12 LEU A 30 8.591 2.202 -0.497 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.665 3.977 -0.397 1.00 0.00 H new ATOM 0 HD21 LEU A 30 8.633 4.445 -3.439 1.00 0.00 H new ATOM 0 HD22 LEU A 30 9.747 5.273 -2.324 1.00 0.00 H new ATOM 0 HD23 LEU A 30 10.390 4.360 -3.710 1.00 0.00 H new ATOM 482 N ILE A 31 10.542 -0.444 -0.598 1.00 0.00 N ATOM 483 CA ILE A 31 10.497 -1.773 -1.197 1.00 0.00 C ATOM 484 C ILE A 31 10.128 -1.711 -2.678 1.00 0.00 C ATOM 485 O ILE A 31 9.189 -1.015 -3.067 1.00 0.00 O ATOM 486 CB ILE A 31 9.498 -2.687 -0.453 1.00 0.00 C ATOM 487 CG1 ILE A 31 8.056 -2.235 -0.702 1.00 0.00 C ATOM 488 CG2 ILE A 31 9.802 -2.696 1.041 1.00 0.00 C ATOM 489 CD1 ILE A 31 7.020 -3.135 -0.060 1.00 0.00 C ATOM 0 H ILE A 31 10.016 -0.358 0.272 1.00 0.00 H new ATOM 0 HA ILE A 31 11.498 -2.194 -1.107 1.00 0.00 H new ATOM 0 HB ILE A 31 9.608 -3.700 -0.839 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.931 -1.221 -0.321 1.00 0.00 H new ATOM 0 HG13 ILE A 31 7.876 -2.197 -1.776 1.00 0.00 H new ATOM 0 HG21 ILE A 31 9.091 -3.344 1.553 1.00 0.00 H new ATOM 0 HG22 ILE A 31 10.814 -3.067 1.204 1.00 0.00 H new ATOM 0 HG23 ILE A 31 9.719 -1.683 1.435 1.00 0.00 H new ATOM 0 HD11 ILE A 31 6.022 -2.754 -0.278 1.00 0.00 H new ATOM 0 HD12 ILE A 31 7.118 -4.145 -0.459 1.00 0.00 H new ATOM 0 HD13 ILE A 31 7.173 -3.154 1.019 1.00 0.00 H new ATOM 501 N LYS A 32 10.876 -2.442 -3.499 1.00 0.00 N ATOM 502 CA LYS A 32 10.631 -2.474 -4.935 1.00 0.00 C ATOM 503 C LYS A 32 10.068 -3.827 -5.357 1.00 0.00 C ATOM 504 O LYS A 32 9.256 -3.914 -6.279 1.00 0.00 O ATOM 505 CB LYS A 32 11.923 -2.183 -5.702 1.00 0.00 C ATOM 506 CG LYS A 32 11.714 -1.345 -6.951 1.00 0.00 C ATOM 507 CD LYS A 32 12.022 0.122 -6.697 1.00 0.00 C ATOM 508 CE LYS A 32 10.760 0.910 -6.385 1.00 0.00 C ATOM 509 NZ LYS A 32 10.211 1.582 -7.595 1.00 0.00 N ATOM 0 H LYS A 32 11.658 -3.021 -3.193 1.00 0.00 H new ATOM 0 HA LYS A 32 9.897 -1.704 -5.172 1.00 0.00 H new ATOM 0 HB2 LYS A 32 12.619 -1.667 -5.041 1.00 0.00 H new ATOM 0 HB3 LYS A 32 12.390 -3.127 -5.982 1.00 0.00 H new ATOM 0 HG2 LYS A 32 12.352 -1.718 -7.752 1.00 0.00 H new ATOM 0 HG3 LYS A 32 10.683 -1.448 -7.291 1.00 0.00 H new ATOM 0 HD2 LYS A 32 12.722 0.209 -5.866 1.00 0.00 H new ATOM 0 HD3 LYS A 32 12.512 0.549 -7.572 1.00 0.00 H new ATOM 0 HE2 LYS A 32 10.007 0.240 -5.969 1.00 0.00 H new ATOM 0 HE3 LYS A 32 10.978 1.657 -5.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 9.351 2.108 -7.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 10.919 2.240 -7.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 9.979 0.867 -8.314 1.00 0.00 H new ATOM 523 N GLU A 33 10.502 -4.880 -4.673 1.00 0.00 N ATOM 524 CA GLU A 33 10.041 -6.230 -4.970 1.00 0.00 C ATOM 525 C GLU A 33 9.264 -6.808 -3.789 1.00 0.00 C ATOM 526 O GLU A 33 9.806 -7.576 -2.994 1.00 0.00 O ATOM 527 CB GLU A 33 11.227 -7.136 -5.306 1.00 0.00 C ATOM 528 CG GLU A 33 12.135 -6.573 -6.389 1.00 0.00 C ATOM 529 CD GLU A 33 13.141 -7.589 -6.893 1.00 0.00 C ATOM 530 OE1 GLU A 33 12.921 -8.800 -6.678 1.00 0.00 O ATOM 531 OE2 GLU A 33 14.149 -7.174 -7.503 1.00 0.00 O ATOM 0 H GLU A 33 11.174 -4.824 -3.908 1.00 0.00 H new ATOM 0 HA GLU A 33 9.377 -6.180 -5.833 1.00 0.00 H new ATOM 0 HB2 GLU A 33 11.813 -7.303 -4.402 1.00 0.00 H new ATOM 0 HB3 GLU A 33 10.852 -8.108 -5.627 1.00 0.00 H new ATOM 0 HG2 GLU A 33 11.526 -6.225 -7.224 1.00 0.00 H new ATOM 0 HG3 GLU A 33 12.666 -5.705 -5.998 1.00 0.00 H new ATOM 538 N PRO A 34 7.978 -6.440 -3.656 1.00 0.00 N ATOM 539 CA PRO A 34 7.128 -6.921 -2.563 1.00 0.00 C ATOM 540 C PRO A 34 7.153 -8.439 -2.428 1.00 0.00 C ATOM 541 O PRO A 34 6.996 -9.164 -3.411 1.00 0.00 O ATOM 542 CB PRO A 34 5.730 -6.446 -2.964 1.00 0.00 C ATOM 543 CG PRO A 34 5.968 -5.256 -3.828 1.00 0.00 C ATOM 544 CD PRO A 34 7.255 -5.525 -4.559 1.00 0.00 C ATOM 0 HA PRO A 34 7.462 -6.545 -1.596 1.00 0.00 H new ATOM 0 HB2 PRO A 34 5.187 -7.223 -3.501 1.00 0.00 H new ATOM 0 HB3 PRO A 34 5.134 -6.187 -2.089 1.00 0.00 H new ATOM 0 HG2 PRO A 34 5.145 -5.111 -4.528 1.00 0.00 H new ATOM 0 HG3 PRO A 34 6.042 -4.348 -3.230 1.00 0.00 H new ATOM 0 HD2 PRO A 34 7.076 -5.980 -5.533 1.00 0.00 H new ATOM 0 HD3 PRO A 34 7.816 -4.607 -4.735 1.00 0.00 H new ATOM 552 N VAL A 35 7.348 -8.912 -1.203 1.00 0.00 N ATOM 553 CA VAL A 35 7.389 -10.343 -0.932 1.00 0.00 C ATOM 554 C VAL A 35 6.791 -10.654 0.436 1.00 0.00 C ATOM 555 O VAL A 35 7.264 -10.158 1.460 1.00 0.00 O ATOM 556 CB VAL A 35 8.831 -10.887 -0.995 1.00 0.00 C ATOM 557 CG1 VAL A 35 9.704 -10.220 0.056 1.00 0.00 C ATOM 558 CG2 VAL A 35 8.841 -12.400 -0.827 1.00 0.00 C ATOM 0 H VAL A 35 7.480 -8.324 -0.380 1.00 0.00 H new ATOM 0 HA VAL A 35 6.796 -10.833 -1.704 1.00 0.00 H new ATOM 0 HB VAL A 35 9.243 -10.651 -1.976 1.00 0.00 H new ATOM 0 HG11 VAL A 35 10.717 -10.618 -0.006 1.00 0.00 H new ATOM 0 HG12 VAL A 35 9.726 -9.144 -0.119 1.00 0.00 H new ATOM 0 HG13 VAL A 35 9.296 -10.419 1.047 1.00 0.00 H new ATOM 0 HG21 VAL A 35 9.867 -12.765 -0.874 1.00 0.00 H new ATOM 0 HG22 VAL A 35 8.407 -12.662 0.138 1.00 0.00 H new ATOM 0 HG23 VAL A 35 8.256 -12.858 -1.624 1.00 0.00 H new ATOM 568 N SER A 36 5.744 -11.474 0.448 1.00 0.00 N ATOM 569 CA SER A 36 5.079 -11.844 1.691 1.00 0.00 C ATOM 570 C SER A 36 5.903 -12.861 2.474 1.00 0.00 C ATOM 571 O SER A 36 6.319 -13.886 1.935 1.00 0.00 O ATOM 572 CB SER A 36 3.689 -12.412 1.399 1.00 0.00 C ATOM 573 OG SER A 36 3.761 -13.781 1.040 1.00 0.00 O ATOM 0 H SER A 36 5.339 -11.894 -0.389 1.00 0.00 H new ATOM 0 HA SER A 36 4.978 -10.945 2.299 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.054 -12.296 2.277 1.00 0.00 H new ATOM 0 HB3 SER A 36 3.224 -11.846 0.592 1.00 0.00 H new ATOM 0 HG SER A 36 4.664 -14.118 1.217 1.00 0.00 H new ATOM 579 N THR A 37 6.132 -12.569 3.751 1.00 0.00 N ATOM 580 CA THR A 37 6.902 -13.459 4.613 1.00 0.00 C ATOM 581 C THR A 37 5.977 -14.371 5.409 1.00 0.00 C ATOM 582 O THR A 37 4.781 -14.104 5.526 1.00 0.00 O ATOM 583 CB THR A 37 7.785 -12.650 5.567 1.00 0.00 C ATOM 584 OG1 THR A 37 7.039 -12.206 6.686 1.00 0.00 O ATOM 585 CG2 THR A 37 8.413 -11.433 4.922 1.00 0.00 C ATOM 0 H THR A 37 5.795 -11.723 4.211 1.00 0.00 H new ATOM 0 HA THR A 37 7.540 -14.076 3.979 1.00 0.00 H new ATOM 0 HB THR A 37 8.581 -13.331 5.867 1.00 0.00 H new ATOM 0 HG1 THR A 37 7.651 -11.892 7.384 1.00 0.00 H new ATOM 0 HG21 THR A 37 9.025 -10.907 5.655 1.00 0.00 H new ATOM 0 HG22 THR A 37 9.038 -11.746 4.086 1.00 0.00 H new ATOM 0 HG23 THR A 37 7.629 -10.768 4.560 1.00 0.00 H new ATOM 593 N LYS A 38 6.539 -15.447 5.955 1.00 0.00 N ATOM 594 CA LYS A 38 5.769 -16.408 6.741 1.00 0.00 C ATOM 595 C LYS A 38 4.889 -15.709 7.776 1.00 0.00 C ATOM 596 O LYS A 38 3.839 -16.224 8.158 1.00 0.00 O ATOM 597 CB LYS A 38 6.709 -17.395 7.437 1.00 0.00 C ATOM 598 CG LYS A 38 6.353 -18.852 7.190 1.00 0.00 C ATOM 599 CD LYS A 38 5.116 -19.263 7.970 1.00 0.00 C ATOM 600 CE LYS A 38 5.483 -19.976 9.261 1.00 0.00 C ATOM 601 NZ LYS A 38 6.447 -21.087 9.027 1.00 0.00 N ATOM 0 H LYS A 38 7.529 -15.676 5.867 1.00 0.00 H new ATOM 0 HA LYS A 38 5.117 -16.950 6.056 1.00 0.00 H new ATOM 0 HB2 LYS A 38 7.728 -17.216 7.095 1.00 0.00 H new ATOM 0 HB3 LYS A 38 6.694 -17.203 8.510 1.00 0.00 H new ATOM 0 HG2 LYS A 38 6.182 -19.010 6.125 1.00 0.00 H new ATOM 0 HG3 LYS A 38 7.192 -19.486 7.476 1.00 0.00 H new ATOM 0 HD2 LYS A 38 4.518 -18.380 8.198 1.00 0.00 H new ATOM 0 HD3 LYS A 38 4.497 -19.917 7.355 1.00 0.00 H new ATOM 0 HE2 LYS A 38 5.916 -19.261 9.960 1.00 0.00 H new ATOM 0 HE3 LYS A 38 4.580 -20.371 9.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 6.254 -21.861 9.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 6.344 -21.437 8.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 7.417 -20.741 9.170 1.00 0.00 H new ATOM 615 N CYS A 39 5.324 -14.537 8.228 1.00 0.00 N ATOM 616 CA CYS A 39 4.572 -13.776 9.219 1.00 0.00 C ATOM 617 C CYS A 39 3.697 -12.718 8.552 1.00 0.00 C ATOM 618 O CYS A 39 3.373 -11.695 9.157 1.00 0.00 O ATOM 619 CB CYS A 39 5.526 -13.115 10.215 1.00 0.00 C ATOM 620 SG CYS A 39 5.909 -14.134 11.658 1.00 0.00 S ATOM 0 H CYS A 39 6.191 -14.095 7.924 1.00 0.00 H new ATOM 0 HA CYS A 39 3.922 -14.469 9.753 1.00 0.00 H new ATOM 0 HB2 CYS A 39 6.455 -12.867 9.702 1.00 0.00 H new ATOM 0 HB3 CYS A 39 5.088 -12.176 10.553 1.00 0.00 H new ATOM 0 HG CYS A 39 6.618 -15.160 11.289 1.00 0.00 H new ATOM 625 N ASP A 40 3.314 -12.970 7.303 1.00 0.00 N ATOM 626 CA ASP A 40 2.474 -12.043 6.554 1.00 0.00 C ATOM 627 C ASP A 40 3.083 -10.642 6.525 1.00 0.00 C ATOM 628 O ASP A 40 2.417 -9.657 6.841 1.00 0.00 O ATOM 629 CB ASP A 40 1.070 -11.990 7.163 1.00 0.00 C ATOM 630 CG ASP A 40 0.125 -11.114 6.365 1.00 0.00 C ATOM 631 OD1 ASP A 40 -0.230 -11.502 5.232 1.00 0.00 O ATOM 632 OD2 ASP A 40 -0.260 -10.040 6.872 1.00 0.00 O ATOM 0 H ASP A 40 3.574 -13.811 6.788 1.00 0.00 H new ATOM 0 HA ASP A 40 2.408 -12.406 5.528 1.00 0.00 H new ATOM 0 HB2 ASP A 40 0.664 -13.000 7.220 1.00 0.00 H new ATOM 0 HB3 ASP A 40 1.134 -11.614 8.184 1.00 0.00 H new ATOM 637 N HIS A 41 4.354 -10.560 6.140 1.00 0.00 N ATOM 638 CA HIS A 41 5.046 -9.275 6.070 1.00 0.00 C ATOM 639 C HIS A 41 5.661 -9.058 4.692 1.00 0.00 C ATOM 640 O HIS A 41 6.018 -10.011 4.001 1.00 0.00 O ATOM 641 CB HIS A 41 6.132 -9.193 7.142 1.00 0.00 C ATOM 642 CG HIS A 41 5.596 -9.197 8.539 1.00 0.00 C ATOM 643 ND1 HIS A 41 4.718 -8.255 9.029 1.00 0.00 N ATOM 644 CD2 HIS A 41 5.833 -10.055 9.562 1.00 0.00 C ATOM 645 CE1 HIS A 41 4.456 -8.564 10.306 1.00 0.00 C ATOM 646 NE2 HIS A 41 5.107 -9.649 10.678 1.00 0.00 N ATOM 0 H HIS A 41 4.923 -11.363 5.873 1.00 0.00 H new ATOM 0 HA HIS A 41 4.311 -8.490 6.247 1.00 0.00 H new ATOM 0 HB2 HIS A 41 6.814 -10.034 7.021 1.00 0.00 H new ATOM 0 HB3 HIS A 41 6.715 -8.285 6.988 1.00 0.00 H new ATOM 0 HD2 HIS A 41 6.482 -10.917 9.518 1.00 0.00 H new ATOM 0 HE1 HIS A 41 3.797 -7.998 10.948 1.00 0.00 H new ATOM 0 HE2 HIS A 41 5.083 -10.098 11.594 1.00 0.00 H new ATOM 654 N ILE A 42 5.784 -7.793 4.298 1.00 0.00 N ATOM 655 CA ILE A 42 6.355 -7.447 3.003 1.00 0.00 C ATOM 656 C ILE A 42 7.829 -7.073 3.133 1.00 0.00 C ATOM 657 O ILE A 42 8.223 -6.371 4.065 1.00 0.00 O ATOM 658 CB ILE A 42 5.596 -6.275 2.352 1.00 0.00 C ATOM 659 CG1 ILE A 42 4.090 -6.541 2.372 1.00 0.00 C ATOM 660 CG2 ILE A 42 6.083 -6.052 0.927 1.00 0.00 C ATOM 661 CD1 ILE A 42 3.692 -7.810 1.650 1.00 0.00 C ATOM 0 H ILE A 42 5.495 -6.991 4.859 1.00 0.00 H new ATOM 0 HA ILE A 42 6.262 -8.329 2.370 1.00 0.00 H new ATOM 0 HB ILE A 42 5.794 -5.370 2.927 1.00 0.00 H new ATOM 0 HG12 ILE A 42 3.753 -6.600 3.407 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.574 -5.696 1.917 1.00 0.00 H new ATOM 0 HG21 ILE A 42 5.537 -5.221 0.482 1.00 0.00 H new ATOM 0 HG22 ILE A 42 7.148 -5.821 0.938 1.00 0.00 H new ATOM 0 HG23 ILE A 42 5.913 -6.954 0.339 1.00 0.00 H new ATOM 0 HD11 ILE A 42 2.611 -7.936 1.704 1.00 0.00 H new ATOM 0 HD12 ILE A 42 3.998 -7.746 0.606 1.00 0.00 H new ATOM 0 HD13 ILE A 42 4.180 -8.664 2.119 1.00 0.00 H new ATOM 673 N PHE A 43 8.638 -7.545 2.190 1.00 0.00 N ATOM 674 CA PHE A 43 10.068 -7.260 2.194 1.00 0.00 C ATOM 675 C PHE A 43 10.554 -6.903 0.793 1.00 0.00 C ATOM 676 O PHE A 43 9.783 -6.928 -0.167 1.00 0.00 O ATOM 677 CB PHE A 43 10.847 -8.465 2.728 1.00 0.00 C ATOM 678 CG PHE A 43 10.914 -8.522 4.227 1.00 0.00 C ATOM 679 CD1 PHE A 43 9.774 -8.766 4.976 1.00 0.00 C ATOM 680 CD2 PHE A 43 12.118 -8.335 4.887 1.00 0.00 C ATOM 681 CE1 PHE A 43 9.833 -8.820 6.357 1.00 0.00 C ATOM 682 CE2 PHE A 43 12.183 -8.388 6.267 1.00 0.00 C ATOM 683 CZ PHE A 43 11.041 -8.631 7.002 1.00 0.00 C ATOM 0 H PHE A 43 8.327 -8.127 1.412 1.00 0.00 H new ATOM 0 HA PHE A 43 10.243 -6.405 2.848 1.00 0.00 H new ATOM 0 HB2 PHE A 43 10.383 -9.380 2.358 1.00 0.00 H new ATOM 0 HB3 PHE A 43 11.861 -8.438 2.328 1.00 0.00 H new ATOM 0 HD1 PHE A 43 8.829 -8.916 4.476 1.00 0.00 H new ATOM 0 HD2 PHE A 43 13.016 -8.146 4.317 1.00 0.00 H new ATOM 0 HE1 PHE A 43 8.937 -9.009 6.930 1.00 0.00 H new ATOM 0 HE2 PHE A 43 13.127 -8.239 6.769 1.00 0.00 H new ATOM 0 HZ PHE A 43 11.091 -8.674 8.080 1.00 0.00 H new ATOM 693 N CYS A 44 11.837 -6.571 0.683 1.00 0.00 N ATOM 694 CA CYS A 44 12.423 -6.208 -0.604 1.00 0.00 C ATOM 695 C CYS A 44 13.180 -7.387 -1.209 1.00 0.00 C ATOM 696 O CYS A 44 14.158 -7.199 -1.932 1.00 0.00 O ATOM 697 CB CYS A 44 13.368 -5.013 -0.445 1.00 0.00 C ATOM 698 SG CYS A 44 12.784 -3.747 0.707 1.00 0.00 S ATOM 0 H CYS A 44 12.489 -6.546 1.467 1.00 0.00 H new ATOM 0 HA CYS A 44 11.610 -5.933 -1.276 1.00 0.00 H new ATOM 0 HB2 CYS A 44 14.339 -5.375 -0.106 1.00 0.00 H new ATOM 0 HB3 CYS A 44 13.522 -4.555 -1.422 1.00 0.00 H new ATOM 0 HG CYS A 44 13.654 -2.783 0.771 1.00 0.00 H new ATOM 703 N LYS A 45 12.719 -8.599 -0.908 1.00 0.00 N ATOM 704 CA LYS A 45 13.350 -9.812 -1.420 1.00 0.00 C ATOM 705 C LYS A 45 14.773 -9.957 -0.888 1.00 0.00 C ATOM 706 O LYS A 45 15.034 -10.767 0.001 1.00 0.00 O ATOM 707 CB LYS A 45 13.362 -9.806 -2.951 1.00 0.00 C ATOM 708 CG LYS A 45 11.987 -9.993 -3.570 1.00 0.00 C ATOM 709 CD LYS A 45 11.746 -11.441 -3.966 1.00 0.00 C ATOM 710 CE LYS A 45 10.751 -11.547 -5.110 1.00 0.00 C ATOM 711 NZ LYS A 45 11.132 -12.609 -6.082 1.00 0.00 N ATOM 0 H LYS A 45 11.909 -8.767 -0.311 1.00 0.00 H new ATOM 0 HA LYS A 45 12.765 -10.664 -1.074 1.00 0.00 H new ATOM 0 HB2 LYS A 45 13.783 -8.863 -3.299 1.00 0.00 H new ATOM 0 HB3 LYS A 45 14.021 -10.599 -3.304 1.00 0.00 H new ATOM 0 HG2 LYS A 45 11.222 -9.676 -2.861 1.00 0.00 H new ATOM 0 HG3 LYS A 45 11.892 -9.354 -4.448 1.00 0.00 H new ATOM 0 HD2 LYS A 45 12.690 -11.901 -4.259 1.00 0.00 H new ATOM 0 HD3 LYS A 45 11.374 -11.998 -3.106 1.00 0.00 H new ATOM 0 HE2 LYS A 45 9.760 -11.760 -4.710 1.00 0.00 H new ATOM 0 HE3 LYS A 45 10.688 -10.589 -5.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.274 -13.062 -6.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 11.669 -12.186 -6.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 11.720 -13.322 -5.605 1.00 0.00 H new ATOM 725 N PHE A 46 15.691 -9.166 -1.438 1.00 0.00 N ATOM 726 CA PHE A 46 17.088 -9.205 -1.019 1.00 0.00 C ATOM 727 C PHE A 46 17.215 -9.052 0.495 1.00 0.00 C ATOM 728 O PHE A 46 18.181 -9.521 1.096 1.00 0.00 O ATOM 729 CB PHE A 46 17.883 -8.103 -1.722 1.00 0.00 C ATOM 730 CG PHE A 46 19.288 -8.505 -2.069 1.00 0.00 C ATOM 731 CD1 PHE A 46 20.226 -8.722 -1.073 1.00 0.00 C ATOM 732 CD2 PHE A 46 19.671 -8.664 -3.391 1.00 0.00 C ATOM 733 CE1 PHE A 46 21.520 -9.093 -1.389 1.00 0.00 C ATOM 734 CE2 PHE A 46 20.962 -9.034 -3.713 1.00 0.00 C ATOM 735 CZ PHE A 46 21.889 -9.249 -2.711 1.00 0.00 C ATOM 0 H PHE A 46 15.492 -8.490 -2.175 1.00 0.00 H new ATOM 0 HA PHE A 46 17.495 -10.177 -1.300 1.00 0.00 H new ATOM 0 HB2 PHE A 46 17.360 -7.815 -2.634 1.00 0.00 H new ATOM 0 HB3 PHE A 46 17.914 -7.222 -1.080 1.00 0.00 H new ATOM 0 HD1 PHE A 46 19.943 -8.600 -0.038 1.00 0.00 H new ATOM 0 HD2 PHE A 46 18.952 -8.497 -4.179 1.00 0.00 H new ATOM 0 HE1 PHE A 46 22.241 -9.261 -0.603 1.00 0.00 H new ATOM 0 HE2 PHE A 46 21.247 -9.155 -4.748 1.00 0.00 H new ATOM 0 HZ PHE A 46 22.899 -9.538 -2.961 1.00 0.00 H new ATOM 745 N CYS A 47 16.232 -8.396 1.106 1.00 0.00 N ATOM 746 CA CYS A 47 16.236 -8.185 2.549 1.00 0.00 C ATOM 747 C CYS A 47 16.308 -9.514 3.293 1.00 0.00 C ATOM 748 O CYS A 47 16.876 -9.599 4.381 1.00 0.00 O ATOM 749 CB CYS A 47 14.984 -7.416 2.977 1.00 0.00 C ATOM 750 SG CYS A 47 14.979 -5.678 2.479 1.00 0.00 S ATOM 0 H CYS A 47 15.424 -8.002 0.624 1.00 0.00 H new ATOM 0 HA CYS A 47 17.119 -7.598 2.802 1.00 0.00 H new ATOM 0 HB2 CYS A 47 14.107 -7.906 2.554 1.00 0.00 H new ATOM 0 HB3 CYS A 47 14.889 -7.472 4.061 1.00 0.00 H new ATOM 0 HG CYS A 47 13.814 -5.370 1.991 1.00 0.00 H new ATOM 755 N MET A 48 15.729 -10.552 2.695 1.00 0.00 N ATOM 756 CA MET A 48 15.728 -11.879 3.300 1.00 0.00 C ATOM 757 C MET A 48 17.134 -12.471 3.310 1.00 0.00 C ATOM 758 O MET A 48 17.527 -13.147 4.260 1.00 0.00 O ATOM 759 CB MET A 48 14.777 -12.807 2.542 1.00 0.00 C ATOM 760 CG MET A 48 13.328 -12.682 2.983 1.00 0.00 C ATOM 761 SD MET A 48 13.091 -13.111 4.719 1.00 0.00 S ATOM 762 CE MET A 48 11.912 -11.857 5.218 1.00 0.00 C ATOM 0 H MET A 48 15.255 -10.499 1.793 1.00 0.00 H new ATOM 0 HA MET A 48 15.385 -11.782 4.330 1.00 0.00 H new ATOM 0 HB2 MET A 48 14.844 -12.591 1.476 1.00 0.00 H new ATOM 0 HB3 MET A 48 15.102 -13.838 2.679 1.00 0.00 H new ATOM 0 HG2 MET A 48 12.988 -11.660 2.816 1.00 0.00 H new ATOM 0 HG3 MET A 48 12.707 -13.330 2.365 1.00 0.00 H new ATOM 0 HE1 MET A 48 12.325 -11.278 6.044 1.00 0.00 H new ATOM 0 HE2 MET A 48 11.708 -11.195 4.377 1.00 0.00 H new ATOM 0 HE3 MET A 48 10.986 -12.335 5.537 1.00 0.00 H new ATOM 772 N LEU A 49 17.887 -12.210 2.246 1.00 0.00 N ATOM 773 CA LEU A 49 19.251 -12.715 2.133 1.00 0.00 C ATOM 774 C LEU A 49 20.114 -12.208 3.283 1.00 0.00 C ATOM 775 O LEU A 49 20.711 -12.995 4.018 1.00 0.00 O ATOM 776 CB LEU A 49 19.863 -12.294 0.796 1.00 0.00 C ATOM 777 CG LEU A 49 19.580 -13.239 -0.373 1.00 0.00 C ATOM 778 CD1 LEU A 49 18.265 -12.878 -1.044 1.00 0.00 C ATOM 779 CD2 LEU A 49 20.722 -13.199 -1.378 1.00 0.00 C ATOM 0 H LEU A 49 17.576 -11.652 1.451 1.00 0.00 H new ATOM 0 HA LEU A 49 19.215 -13.803 2.181 1.00 0.00 H new ATOM 0 HB2 LEU A 49 19.490 -11.302 0.540 1.00 0.00 H new ATOM 0 HB3 LEU A 49 20.942 -12.207 0.920 1.00 0.00 H new ATOM 0 HG LEU A 49 19.499 -14.254 0.016 1.00 0.00 H new ATOM 0 HD11 LEU A 49 18.080 -13.561 -1.873 1.00 0.00 H new ATOM 0 HD12 LEU A 49 17.454 -12.958 -0.321 1.00 0.00 H new ATOM 0 HD13 LEU A 49 18.317 -11.856 -1.420 1.00 0.00 H new ATOM 0 HD21 LEU A 49 20.504 -13.877 -2.203 1.00 0.00 H new ATOM 0 HD22 LEU A 49 20.834 -12.185 -1.762 1.00 0.00 H new ATOM 0 HD23 LEU A 49 21.647 -13.506 -0.890 1.00 0.00 H new ATOM 791 N LYS A 50 20.174 -10.889 3.433 1.00 0.00 N ATOM 792 CA LYS A 50 20.964 -10.276 4.495 1.00 0.00 C ATOM 793 C LYS A 50 20.473 -10.729 5.865 1.00 0.00 C ATOM 794 O LYS A 50 21.267 -10.962 6.775 1.00 0.00 O ATOM 795 CB LYS A 50 20.896 -8.751 4.394 1.00 0.00 C ATOM 796 CG LYS A 50 21.916 -8.158 3.438 1.00 0.00 C ATOM 797 CD LYS A 50 21.300 -7.861 2.080 1.00 0.00 C ATOM 798 CE LYS A 50 20.656 -6.484 2.050 1.00 0.00 C ATOM 799 NZ LYS A 50 21.537 -5.472 1.403 1.00 0.00 N ATOM 0 H LYS A 50 19.685 -10.224 2.833 1.00 0.00 H new ATOM 0 HA LYS A 50 22.000 -10.595 4.376 1.00 0.00 H new ATOM 0 HB2 LYS A 50 19.896 -8.461 4.071 1.00 0.00 H new ATOM 0 HB3 LYS A 50 21.047 -8.323 5.385 1.00 0.00 H new ATOM 0 HG2 LYS A 50 22.324 -7.240 3.862 1.00 0.00 H new ATOM 0 HG3 LYS A 50 22.749 -8.851 3.317 1.00 0.00 H new ATOM 0 HD2 LYS A 50 22.069 -7.921 1.310 1.00 0.00 H new ATOM 0 HD3 LYS A 50 20.553 -8.619 1.845 1.00 0.00 H new ATOM 0 HE2 LYS A 50 19.709 -6.538 1.512 1.00 0.00 H new ATOM 0 HE3 LYS A 50 20.427 -6.168 3.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 21.061 -4.547 1.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 22.431 -5.402 1.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 21.735 -5.760 0.423 1.00 0.00 H new ATOM 813 N LEU A 51 19.157 -10.853 6.006 1.00 0.00 N ATOM 814 CA LEU A 51 18.558 -11.279 7.265 1.00 0.00 C ATOM 815 C LEU A 51 18.856 -12.749 7.539 1.00 0.00 C ATOM 816 O LEU A 51 18.998 -13.160 8.690 1.00 0.00 O ATOM 817 CB LEU A 51 17.045 -11.048 7.237 1.00 0.00 C ATOM 818 CG LEU A 51 16.337 -11.236 8.581 1.00 0.00 C ATOM 819 CD1 LEU A 51 16.659 -10.084 9.518 1.00 0.00 C ATOM 820 CD2 LEU A 51 14.834 -11.356 8.377 1.00 0.00 C ATOM 0 H LEU A 51 18.485 -10.664 5.263 1.00 0.00 H new ATOM 0 HA LEU A 51 18.994 -10.684 8.067 1.00 0.00 H new ATOM 0 HB2 LEU A 51 16.854 -10.036 6.881 1.00 0.00 H new ATOM 0 HB3 LEU A 51 16.602 -11.730 6.511 1.00 0.00 H new ATOM 0 HG LEU A 51 16.697 -12.159 9.036 1.00 0.00 H new ATOM 0 HD11 LEU A 51 16.147 -10.234 10.469 1.00 0.00 H new ATOM 0 HD12 LEU A 51 17.735 -10.043 9.688 1.00 0.00 H new ATOM 0 HD13 LEU A 51 16.326 -9.147 9.071 1.00 0.00 H new ATOM 0 HD21 LEU A 51 14.345 -11.489 9.342 1.00 0.00 H new ATOM 0 HD22 LEU A 51 14.458 -10.450 7.902 1.00 0.00 H new ATOM 0 HD23 LEU A 51 14.621 -12.215 7.741 1.00 0.00 H new ATOM 832 N LEU A 52 18.951 -13.536 6.472 1.00 0.00 N ATOM 833 CA LEU A 52 19.233 -14.962 6.596 1.00 0.00 C ATOM 834 C LEU A 52 20.715 -15.201 6.871 1.00 0.00 C ATOM 835 O LEU A 52 21.085 -16.168 7.537 1.00 0.00 O ATOM 836 CB LEU A 52 18.813 -15.699 5.323 1.00 0.00 C ATOM 837 CG LEU A 52 17.307 -15.922 5.170 1.00 0.00 C ATOM 838 CD1 LEU A 52 16.920 -15.965 3.701 1.00 0.00 C ATOM 839 CD2 LEU A 52 16.886 -17.205 5.873 1.00 0.00 C ATOM 0 H LEU A 52 18.837 -13.211 5.512 1.00 0.00 H new ATOM 0 HA LEU A 52 18.658 -15.349 7.437 1.00 0.00 H new ATOM 0 HB2 LEU A 52 19.171 -15.136 4.461 1.00 0.00 H new ATOM 0 HB3 LEU A 52 19.312 -16.668 5.301 1.00 0.00 H new ATOM 0 HG LEU A 52 16.785 -15.086 5.636 1.00 0.00 H new ATOM 0 HD11 LEU A 52 15.845 -16.124 3.612 1.00 0.00 H new ATOM 0 HD12 LEU A 52 17.187 -15.021 3.227 1.00 0.00 H new ATOM 0 HD13 LEU A 52 17.450 -16.781 3.209 1.00 0.00 H new ATOM 0 HD21 LEU A 52 15.812 -17.349 5.755 1.00 0.00 H new ATOM 0 HD22 LEU A 52 17.416 -18.051 5.435 1.00 0.00 H new ATOM 0 HD23 LEU A 52 17.128 -17.135 6.933 1.00 0.00 H new ATOM 851 N ASN A 53 21.557 -14.315 6.351 1.00 0.00 N ATOM 852 CA ASN A 53 22.999 -14.429 6.538 1.00 0.00 C ATOM 853 C ASN A 53 23.465 -13.620 7.748 1.00 0.00 C ATOM 854 O ASN A 53 24.543 -13.864 8.289 1.00 0.00 O ATOM 855 CB ASN A 53 23.736 -13.958 5.284 1.00 0.00 C ATOM 856 CG ASN A 53 23.880 -15.059 4.251 1.00 0.00 C ATOM 857 OD1 ASN A 53 24.985 -15.367 3.805 1.00 0.00 O ATOM 858 ND2 ASN A 53 22.759 -15.658 3.865 1.00 0.00 N ATOM 0 H ASN A 53 21.266 -13.510 5.797 1.00 0.00 H new ATOM 0 HA ASN A 53 23.230 -15.479 6.718 1.00 0.00 H new ATOM 0 HB2 ASN A 53 23.198 -13.118 4.844 1.00 0.00 H new ATOM 0 HB3 ASN A 53 24.725 -13.593 5.562 1.00 0.00 H new ATOM 0 HD21 ASN A 53 22.793 -16.406 3.172 1.00 0.00 H new ATOM 0 HD22 ASN A 53 21.864 -15.370 4.261 1.00 0.00 H new ATOM 865 N GLN A 54 22.648 -12.656 8.167 1.00 0.00 N ATOM 866 CA GLN A 54 22.981 -11.813 9.311 1.00 0.00 C ATOM 867 C GLN A 54 23.296 -12.657 10.542 1.00 0.00 C ATOM 868 O GLN A 54 24.096 -12.260 11.390 1.00 0.00 O ATOM 869 CB GLN A 54 21.828 -10.854 9.616 1.00 0.00 C ATOM 870 CG GLN A 54 21.986 -9.487 8.971 1.00 0.00 C ATOM 871 CD GLN A 54 22.476 -8.435 9.947 1.00 0.00 C ATOM 872 OE1 GLN A 54 23.434 -8.657 10.688 1.00 0.00 O ATOM 873 NE2 GLN A 54 21.817 -7.282 9.953 1.00 0.00 N ATOM 0 H GLN A 54 21.751 -12.440 7.731 1.00 0.00 H new ATOM 0 HA GLN A 54 23.869 -11.235 9.056 1.00 0.00 H new ATOM 0 HB2 GLN A 54 20.894 -11.302 9.275 1.00 0.00 H new ATOM 0 HB3 GLN A 54 21.746 -10.730 10.696 1.00 0.00 H new ATOM 0 HG2 GLN A 54 22.687 -9.560 8.140 1.00 0.00 H new ATOM 0 HG3 GLN A 54 21.029 -9.173 8.554 1.00 0.00 H new ATOM 0 HE21 GLN A 54 21.029 -7.142 9.321 1.00 0.00 H new ATOM 0 HE22 GLN A 54 22.099 -6.537 10.589 1.00 0.00 H new ATOM 882 N LYS A 55 22.664 -13.822 10.635 1.00 0.00 N ATOM 883 CA LYS A 55 22.880 -14.719 11.765 1.00 0.00 C ATOM 884 C LYS A 55 23.016 -16.166 11.299 1.00 0.00 C ATOM 885 O LYS A 55 22.770 -17.099 12.065 1.00 0.00 O ATOM 886 CB LYS A 55 21.726 -14.600 12.764 1.00 0.00 C ATOM 887 CG LYS A 55 20.353 -14.676 12.119 1.00 0.00 C ATOM 888 CD LYS A 55 19.272 -14.141 13.044 1.00 0.00 C ATOM 889 CE LYS A 55 18.938 -12.692 12.732 1.00 0.00 C ATOM 890 NZ LYS A 55 18.169 -12.049 13.834 1.00 0.00 N ATOM 0 H LYS A 55 21.999 -14.167 9.943 1.00 0.00 H new ATOM 0 HA LYS A 55 23.809 -14.427 12.254 1.00 0.00 H new ATOM 0 HB2 LYS A 55 21.815 -15.395 13.505 1.00 0.00 H new ATOM 0 HB3 LYS A 55 21.815 -13.654 13.298 1.00 0.00 H new ATOM 0 HG2 LYS A 55 20.354 -14.105 11.191 1.00 0.00 H new ATOM 0 HG3 LYS A 55 20.130 -15.710 11.857 1.00 0.00 H new ATOM 0 HD2 LYS A 55 18.374 -14.751 12.947 1.00 0.00 H new ATOM 0 HD3 LYS A 55 19.604 -14.224 14.079 1.00 0.00 H new ATOM 0 HE2 LYS A 55 19.860 -12.136 12.560 1.00 0.00 H new ATOM 0 HE3 LYS A 55 18.360 -12.643 11.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 17.418 -11.453 13.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 17.744 -12.783 14.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 18.808 -11.461 14.406 1.00 0.00 H new ATOM 904 N LYS A 56 23.412 -16.348 10.042 1.00 0.00 N ATOM 905 CA LYS A 56 23.581 -17.683 9.480 1.00 0.00 C ATOM 906 C LYS A 56 22.267 -18.456 9.504 1.00 0.00 C ATOM 907 O LYS A 56 21.390 -18.185 10.324 1.00 0.00 O ATOM 908 CB LYS A 56 24.653 -18.452 10.255 1.00 0.00 C ATOM 909 CG LYS A 56 26.070 -18.159 9.787 1.00 0.00 C ATOM 910 CD LYS A 56 26.439 -18.993 8.571 1.00 0.00 C ATOM 911 CE LYS A 56 26.137 -18.253 7.277 1.00 0.00 C ATOM 912 NZ LYS A 56 26.962 -18.756 6.145 1.00 0.00 N ATOM 0 H LYS A 56 23.621 -15.588 9.395 1.00 0.00 H new ATOM 0 HA LYS A 56 23.898 -17.575 8.443 1.00 0.00 H new ATOM 0 HB2 LYS A 56 24.571 -18.206 11.314 1.00 0.00 H new ATOM 0 HB3 LYS A 56 24.462 -19.521 10.160 1.00 0.00 H new ATOM 0 HG2 LYS A 56 26.163 -17.100 9.545 1.00 0.00 H new ATOM 0 HG3 LYS A 56 26.771 -18.364 10.596 1.00 0.00 H new ATOM 0 HD2 LYS A 56 27.499 -19.245 8.609 1.00 0.00 H new ATOM 0 HD3 LYS A 56 25.887 -19.933 8.592 1.00 0.00 H new ATOM 0 HE2 LYS A 56 25.080 -18.364 7.034 1.00 0.00 H new ATOM 0 HE3 LYS A 56 26.322 -17.188 7.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 26.726 -18.226 5.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 27.970 -18.627 6.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 26.767 -19.766 5.995 1.00 0.00 H new ATOM 926 N GLY A 57 22.136 -19.422 8.600 1.00 0.00 N ATOM 927 CA GLY A 57 20.926 -20.220 8.534 1.00 0.00 C ATOM 928 C GLY A 57 19.679 -19.374 8.358 1.00 0.00 C ATOM 929 O GLY A 57 19.755 -18.249 7.863 1.00 0.00 O ATOM 0 H GLY A 57 22.848 -19.666 7.911 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.004 -20.923 7.705 1.00 0.00 H new ATOM 0 HA3 GLY A 57 20.834 -20.811 9.445 1.00 0.00 H new ATOM 933 N PRO A 58 18.505 -19.892 8.759 1.00 0.00 N ATOM 934 CA PRO A 58 17.238 -19.164 8.638 1.00 0.00 C ATOM 935 C PRO A 58 17.317 -17.760 9.229 1.00 0.00 C ATOM 936 O PRO A 58 18.180 -17.473 10.058 1.00 0.00 O ATOM 937 CB PRO A 58 16.257 -20.026 9.434 1.00 0.00 C ATOM 938 CG PRO A 58 16.829 -21.399 9.380 1.00 0.00 C ATOM 939 CD PRO A 58 18.323 -21.226 9.361 1.00 0.00 C ATOM 0 HA PRO A 58 16.950 -19.017 7.597 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.166 -19.675 10.462 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.259 -19.996 8.997 1.00 0.00 H new ATOM 0 HG2 PRO A 58 16.515 -21.986 10.243 1.00 0.00 H new ATOM 0 HG3 PRO A 58 16.486 -21.930 8.492 1.00 0.00 H new ATOM 0 HD2 PRO A 58 18.746 -21.275 10.364 1.00 0.00 H new ATOM 0 HD3 PRO A 58 18.810 -22.003 8.771 1.00 0.00 H new ATOM 947 N SER A 59 16.411 -16.890 8.797 1.00 0.00 N ATOM 948 CA SER A 59 16.378 -15.516 9.284 1.00 0.00 C ATOM 949 C SER A 59 15.464 -15.391 10.499 1.00 0.00 C ATOM 950 O SER A 59 14.945 -16.388 11.003 1.00 0.00 O ATOM 951 CB SER A 59 15.909 -14.571 8.176 1.00 0.00 C ATOM 952 OG SER A 59 15.174 -15.270 7.186 1.00 0.00 O ATOM 0 H SER A 59 15.690 -17.112 8.111 1.00 0.00 H new ATOM 0 HA SER A 59 17.389 -15.238 9.584 1.00 0.00 H new ATOM 0 HB2 SER A 59 15.290 -13.783 8.604 1.00 0.00 H new ATOM 0 HB3 SER A 59 16.771 -14.086 7.718 1.00 0.00 H new ATOM 0 HG SER A 59 14.884 -14.643 6.490 1.00 0.00 H new ATOM 958 N GLN A 60 15.270 -14.161 10.962 1.00 0.00 N ATOM 959 CA GLN A 60 14.418 -13.907 12.118 1.00 0.00 C ATOM 960 C GLN A 60 13.471 -12.741 11.850 1.00 0.00 C ATOM 961 O GLN A 60 13.903 -11.598 11.709 1.00 0.00 O ATOM 962 CB GLN A 60 15.272 -13.612 13.353 1.00 0.00 C ATOM 963 CG GLN A 60 14.692 -14.173 14.641 1.00 0.00 C ATOM 964 CD GLN A 60 15.669 -14.102 15.799 1.00 0.00 C ATOM 965 OE1 GLN A 60 16.874 -14.280 15.621 1.00 0.00 O ATOM 966 NE2 GLN A 60 15.153 -13.842 16.994 1.00 0.00 N ATOM 0 H GLN A 60 15.690 -13.325 10.555 1.00 0.00 H new ATOM 0 HA GLN A 60 13.822 -14.801 12.302 1.00 0.00 H new ATOM 0 HB2 GLN A 60 16.269 -14.026 13.203 1.00 0.00 H new ATOM 0 HB3 GLN A 60 15.387 -12.533 13.456 1.00 0.00 H new ATOM 0 HG2 GLN A 60 13.788 -13.621 14.899 1.00 0.00 H new ATOM 0 HG3 GLN A 60 14.398 -15.210 14.481 1.00 0.00 H new ATOM 0 HE21 GLN A 60 14.148 -13.701 17.096 1.00 0.00 H new ATOM 0 HE22 GLN A 60 15.762 -13.783 17.810 1.00 0.00 H new ATOM 975 N CYS A 61 12.178 -13.039 11.784 1.00 0.00 N ATOM 976 CA CYS A 61 11.168 -12.017 11.535 1.00 0.00 C ATOM 977 C CYS A 61 11.244 -10.909 12.587 1.00 0.00 C ATOM 978 O CYS A 61 10.901 -11.124 13.749 1.00 0.00 O ATOM 979 CB CYS A 61 9.771 -12.641 11.535 1.00 0.00 C ATOM 980 SG CYS A 61 8.430 -11.458 11.264 1.00 0.00 S ATOM 0 H CYS A 61 11.804 -13.981 11.900 1.00 0.00 H new ATOM 0 HA CYS A 61 11.363 -11.579 10.556 1.00 0.00 H new ATOM 0 HB2 CYS A 61 9.727 -13.406 10.760 1.00 0.00 H new ATOM 0 HB3 CYS A 61 9.610 -13.143 12.489 1.00 0.00 H new ATOM 0 HG CYS A 61 7.364 -11.859 11.891 1.00 0.00 H new ATOM 985 N PRO A 62 11.701 -9.705 12.195 1.00 0.00 N ATOM 986 CA PRO A 62 11.821 -8.569 13.116 1.00 0.00 C ATOM 987 C PRO A 62 10.471 -7.945 13.460 1.00 0.00 C ATOM 988 O PRO A 62 10.361 -7.176 14.415 1.00 0.00 O ATOM 989 CB PRO A 62 12.684 -7.578 12.335 1.00 0.00 C ATOM 990 CG PRO A 62 12.390 -7.872 10.905 1.00 0.00 C ATOM 991 CD PRO A 62 12.139 -9.354 10.829 1.00 0.00 C ATOM 0 HA PRO A 62 12.243 -8.866 14.076 1.00 0.00 H new ATOM 0 HB2 PRO A 62 12.433 -6.548 12.588 1.00 0.00 H new ATOM 0 HB3 PRO A 62 13.742 -7.712 12.558 1.00 0.00 H new ATOM 0 HG2 PRO A 62 11.521 -7.311 10.562 1.00 0.00 H new ATOM 0 HG3 PRO A 62 13.226 -7.585 10.268 1.00 0.00 H new ATOM 0 HD2 PRO A 62 11.375 -9.593 10.089 1.00 0.00 H new ATOM 0 HD3 PRO A 62 13.039 -9.899 10.545 1.00 0.00 H new ATOM 999 N LEU A 63 9.448 -8.272 12.676 1.00 0.00 N ATOM 1000 CA LEU A 63 8.112 -7.734 12.901 1.00 0.00 C ATOM 1001 C LEU A 63 7.399 -8.478 14.027 1.00 0.00 C ATOM 1002 O LEU A 63 6.546 -7.914 14.712 1.00 0.00 O ATOM 1003 CB LEU A 63 7.284 -7.812 11.617 1.00 0.00 C ATOM 1004 CG LEU A 63 7.834 -6.995 10.445 1.00 0.00 C ATOM 1005 CD1 LEU A 63 8.664 -7.874 9.523 1.00 0.00 C ATOM 1006 CD2 LEU A 63 6.701 -6.330 9.675 1.00 0.00 C ATOM 0 H LEU A 63 9.519 -8.906 11.880 1.00 0.00 H new ATOM 0 HA LEU A 63 8.218 -6.690 13.196 1.00 0.00 H new ATOM 0 HB2 LEU A 63 7.212 -8.856 11.311 1.00 0.00 H new ATOM 0 HB3 LEU A 63 6.271 -7.473 11.834 1.00 0.00 H new ATOM 0 HG LEU A 63 8.479 -6.213 10.846 1.00 0.00 H new ATOM 0 HD11 LEU A 63 9.046 -7.275 8.696 1.00 0.00 H new ATOM 0 HD12 LEU A 63 9.499 -8.299 10.080 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.042 -8.679 9.131 1.00 0.00 H new ATOM 0 HD21 LEU A 63 7.113 -5.754 8.846 1.00 0.00 H new ATOM 0 HD22 LEU A 63 6.028 -7.094 9.287 1.00 0.00 H new ATOM 0 HD23 LEU A 63 6.150 -5.665 10.340 1.00 0.00 H new ATOM 1018 N CYS A 64 7.751 -9.746 14.215 1.00 0.00 N ATOM 1019 CA CYS A 64 7.138 -10.560 15.260 1.00 0.00 C ATOM 1020 C CYS A 64 8.176 -11.430 15.965 1.00 0.00 C ATOM 1021 O CYS A 64 7.835 -12.441 16.578 1.00 0.00 O ATOM 1022 CB CYS A 64 6.037 -11.440 14.667 1.00 0.00 C ATOM 1023 SG CYS A 64 4.910 -10.567 13.557 1.00 0.00 S ATOM 0 H CYS A 64 8.455 -10.231 13.659 1.00 0.00 H new ATOM 0 HA CYS A 64 6.702 -9.886 15.997 1.00 0.00 H new ATOM 0 HB2 CYS A 64 6.499 -12.264 14.123 1.00 0.00 H new ATOM 0 HB3 CYS A 64 5.460 -11.879 15.481 1.00 0.00 H new ATOM 0 HG CYS A 64 5.009 -9.286 13.757 1.00 0.00 H new ATOM 1028 N LYS A 65 9.443 -11.033 15.876 1.00 0.00 N ATOM 1029 CA LYS A 65 10.528 -11.779 16.507 1.00 0.00 C ATOM 1030 C LYS A 65 10.443 -13.268 16.174 1.00 0.00 C ATOM 1031 O LYS A 65 10.888 -14.114 16.950 1.00 0.00 O ATOM 1032 CB LYS A 65 10.492 -11.584 18.024 1.00 0.00 C ATOM 1033 CG LYS A 65 11.871 -11.535 18.663 1.00 0.00 C ATOM 1034 CD LYS A 65 12.339 -10.103 18.869 1.00 0.00 C ATOM 1035 CE LYS A 65 13.849 -9.987 18.738 1.00 0.00 C ATOM 1036 NZ LYS A 65 14.254 -9.522 17.382 1.00 0.00 N ATOM 0 H LYS A 65 9.743 -10.198 15.373 1.00 0.00 H new ATOM 0 HA LYS A 65 11.470 -11.394 16.116 1.00 0.00 H new ATOM 0 HB2 LYS A 65 9.962 -10.659 18.251 1.00 0.00 H new ATOM 0 HB3 LYS A 65 9.921 -12.397 18.473 1.00 0.00 H new ATOM 0 HG2 LYS A 65 11.847 -12.053 19.622 1.00 0.00 H new ATOM 0 HG3 LYS A 65 12.585 -12.065 18.032 1.00 0.00 H new ATOM 0 HD2 LYS A 65 11.858 -9.453 18.138 1.00 0.00 H new ATOM 0 HD3 LYS A 65 12.030 -9.756 19.855 1.00 0.00 H new ATOM 0 HE2 LYS A 65 14.226 -9.292 19.488 1.00 0.00 H new ATOM 0 HE3 LYS A 65 14.307 -10.955 18.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 15.291 -9.456 17.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 13.916 -10.198 16.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 13.838 -8.587 17.197 1.00 0.00 H new ATOM 1050 N ASN A 66 9.869 -13.579 15.016 1.00 0.00 N ATOM 1051 CA ASN A 66 9.726 -14.965 14.582 1.00 0.00 C ATOM 1052 C ASN A 66 11.008 -15.466 13.924 1.00 0.00 C ATOM 1053 O ASN A 66 12.048 -14.810 13.987 1.00 0.00 O ATOM 1054 CB ASN A 66 8.552 -15.097 13.609 1.00 0.00 C ATOM 1055 CG ASN A 66 7.755 -16.366 13.835 1.00 0.00 C ATOM 1056 OD1 ASN A 66 7.266 -16.618 14.935 1.00 0.00 O ATOM 1057 ND2 ASN A 66 7.620 -17.174 12.789 1.00 0.00 N ATOM 0 H ASN A 66 9.496 -12.891 14.362 1.00 0.00 H new ATOM 0 HA ASN A 66 9.530 -15.577 15.462 1.00 0.00 H new ATOM 0 HB2 ASN A 66 7.895 -14.234 13.717 1.00 0.00 H new ATOM 0 HB3 ASN A 66 8.928 -15.085 12.586 1.00 0.00 H new ATOM 0 HD21 ASN A 66 7.094 -18.043 12.880 1.00 0.00 H new ATOM 0 HD22 ASN A 66 8.043 -16.925 11.895 1.00 0.00 H new ATOM 1064 N ASP A 67 10.926 -16.632 13.292 1.00 0.00 N ATOM 1065 CA ASP A 67 12.079 -17.221 12.621 1.00 0.00 C ATOM 1066 C ASP A 67 11.766 -17.517 11.158 1.00 0.00 C ATOM 1067 O ASP A 67 11.102 -18.505 10.842 1.00 0.00 O ATOM 1068 CB ASP A 67 12.508 -18.506 13.332 1.00 0.00 C ATOM 1069 CG ASP A 67 13.846 -19.022 12.839 1.00 0.00 C ATOM 1070 OD1 ASP A 67 14.866 -18.340 13.072 1.00 0.00 O ATOM 1071 OD2 ASP A 67 13.872 -20.106 12.221 1.00 0.00 O ATOM 0 H ASP A 67 10.073 -17.188 13.230 1.00 0.00 H new ATOM 0 HA ASP A 67 12.896 -16.501 12.660 1.00 0.00 H new ATOM 0 HB2 ASP A 67 12.566 -18.322 14.405 1.00 0.00 H new ATOM 0 HB3 ASP A 67 11.748 -19.273 13.180 1.00 0.00 H new ATOM 1076 N ILE A 68 12.249 -16.655 10.270 1.00 0.00 N ATOM 1077 CA ILE A 68 12.021 -16.821 8.840 1.00 0.00 C ATOM 1078 C ILE A 68 13.019 -17.803 8.236 1.00 0.00 C ATOM 1079 O ILE A 68 14.088 -18.043 8.798 1.00 0.00 O ATOM 1080 CB ILE A 68 12.123 -15.476 8.095 1.00 0.00 C ATOM 1081 CG1 ILE A 68 11.236 -14.428 8.768 1.00 0.00 C ATOM 1082 CG2 ILE A 68 11.736 -15.646 6.633 1.00 0.00 C ATOM 1083 CD1 ILE A 68 11.615 -13.004 8.424 1.00 0.00 C ATOM 0 H ILE A 68 12.801 -15.834 10.516 1.00 0.00 H new ATOM 0 HA ILE A 68 11.012 -17.215 8.723 1.00 0.00 H new ATOM 0 HB ILE A 68 13.157 -15.133 8.138 1.00 0.00 H new ATOM 0 HG12 ILE A 68 10.200 -14.600 8.477 1.00 0.00 H new ATOM 0 HG13 ILE A 68 11.289 -14.559 9.849 1.00 0.00 H new ATOM 0 HG21 ILE A 68 11.814 -14.686 6.122 1.00 0.00 H new ATOM 0 HG22 ILE A 68 12.406 -16.364 6.160 1.00 0.00 H new ATOM 0 HG23 ILE A 68 10.710 -16.010 6.568 1.00 0.00 H new ATOM 0 HD11 ILE A 68 10.944 -12.315 8.936 1.00 0.00 H new ATOM 0 HD12 ILE A 68 12.641 -12.814 8.740 1.00 0.00 H new ATOM 0 HD13 ILE A 68 11.534 -12.856 7.347 1.00 0.00 H new ATOM 1095 N THR A 69 12.664 -18.370 7.087 1.00 0.00 N ATOM 1096 CA THR A 69 13.528 -19.327 6.406 1.00 0.00 C ATOM 1097 C THR A 69 13.617 -19.016 4.916 1.00 0.00 C ATOM 1098 O THR A 69 13.086 -18.007 4.449 1.00 0.00 O ATOM 1099 CB THR A 69 13.008 -20.752 6.614 1.00 0.00 C ATOM 1100 OG1 THR A 69 11.618 -20.743 6.887 1.00 0.00 O ATOM 1101 CG2 THR A 69 13.695 -21.480 7.750 1.00 0.00 C ATOM 0 H THR A 69 11.783 -18.183 6.608 1.00 0.00 H new ATOM 0 HA THR A 69 14.527 -19.246 6.834 1.00 0.00 H new ATOM 0 HB THR A 69 13.224 -21.278 5.684 1.00 0.00 H new ATOM 0 HG1 THR A 69 11.304 -21.662 7.015 1.00 0.00 H new ATOM 0 HG21 THR A 69 13.280 -22.483 7.843 1.00 0.00 H new ATOM 0 HG22 THR A 69 14.764 -21.547 7.546 1.00 0.00 H new ATOM 0 HG23 THR A 69 13.537 -20.934 8.680 1.00 0.00 H new ATOM 1109 N LYS A 70 14.290 -19.889 4.172 1.00 0.00 N ATOM 1110 CA LYS A 70 14.448 -19.706 2.734 1.00 0.00 C ATOM 1111 C LYS A 70 13.425 -20.536 1.964 1.00 0.00 C ATOM 1112 O LYS A 70 13.707 -21.028 0.871 1.00 0.00 O ATOM 1113 CB LYS A 70 15.864 -20.092 2.302 1.00 0.00 C ATOM 1114 CG LYS A 70 16.949 -19.548 3.218 1.00 0.00 C ATOM 1115 CD LYS A 70 18.296 -20.187 2.926 1.00 0.00 C ATOM 1116 CE LYS A 70 19.443 -19.301 3.382 1.00 0.00 C ATOM 1117 NZ LYS A 70 19.844 -18.325 2.332 1.00 0.00 N ATOM 0 H LYS A 70 14.734 -20.730 4.542 1.00 0.00 H new ATOM 0 HA LYS A 70 14.280 -18.653 2.507 1.00 0.00 H new ATOM 0 HB2 LYS A 70 15.941 -21.179 2.267 1.00 0.00 H new ATOM 0 HB3 LYS A 70 16.038 -19.727 1.290 1.00 0.00 H new ATOM 0 HG2 LYS A 70 17.023 -18.468 3.094 1.00 0.00 H new ATOM 0 HG3 LYS A 70 16.675 -19.732 4.257 1.00 0.00 H new ATOM 0 HD2 LYS A 70 18.359 -21.152 3.428 1.00 0.00 H new ATOM 0 HD3 LYS A 70 18.385 -20.378 1.857 1.00 0.00 H new ATOM 0 HE2 LYS A 70 19.150 -18.764 4.284 1.00 0.00 H new ATOM 0 HE3 LYS A 70 20.299 -19.922 3.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 20.606 -17.718 2.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 20.180 -18.838 1.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 19.026 -17.737 2.074 1.00 0.00 H new ATOM 1131 N ARG A 71 12.239 -20.688 2.542 1.00 0.00 N ATOM 1132 CA ARG A 71 11.173 -21.459 1.911 1.00 0.00 C ATOM 1133 C ARG A 71 9.846 -21.241 2.630 1.00 0.00 C ATOM 1134 O ARG A 71 9.025 -22.153 2.730 1.00 0.00 O ATOM 1135 CB ARG A 71 11.527 -22.947 1.905 1.00 0.00 C ATOM 1136 CG ARG A 71 12.310 -23.382 0.677 1.00 0.00 C ATOM 1137 CD ARG A 71 11.962 -24.804 0.270 1.00 0.00 C ATOM 1138 NE ARG A 71 12.733 -25.792 1.020 1.00 0.00 N ATOM 1139 CZ ARG A 71 14.038 -26.002 0.848 1.00 0.00 C ATOM 1140 NH1 ARG A 71 14.718 -25.294 -0.045 1.00 0.00 N ATOM 1141 NH2 ARG A 71 14.663 -26.919 1.572 1.00 0.00 N ATOM 0 H ARG A 71 11.991 -20.288 3.447 1.00 0.00 H new ATOM 0 HA ARG A 71 11.068 -21.114 0.882 1.00 0.00 H new ATOM 0 HB2 ARG A 71 12.110 -23.177 2.797 1.00 0.00 H new ATOM 0 HB3 ARG A 71 10.608 -23.531 1.965 1.00 0.00 H new ATOM 0 HG2 ARG A 71 12.099 -22.704 -0.150 1.00 0.00 H new ATOM 0 HG3 ARG A 71 13.378 -23.312 0.882 1.00 0.00 H new ATOM 0 HD2 ARG A 71 10.898 -24.977 0.430 1.00 0.00 H new ATOM 0 HD3 ARG A 71 12.149 -24.932 -0.796 1.00 0.00 H new ATOM 0 HE ARG A 71 12.244 -26.354 1.716 1.00 0.00 H new ATOM 0 HH11 ARG A 71 14.242 -24.585 -0.603 1.00 0.00 H new ATOM 0 HH12 ARG A 71 15.717 -25.458 -0.173 1.00 0.00 H new ATOM 0 HH21 ARG A 71 14.145 -27.464 2.261 1.00 0.00 H new ATOM 0 HH22 ARG A 71 15.662 -27.079 1.440 1.00 0.00 H new ATOM 1155 N SER A 72 9.642 -20.026 3.129 1.00 0.00 N ATOM 1156 CA SER A 72 8.415 -19.687 3.841 1.00 0.00 C ATOM 1157 C SER A 72 7.689 -18.536 3.152 1.00 0.00 C ATOM 1158 O SER A 72 6.468 -18.562 2.998 1.00 0.00 O ATOM 1159 CB SER A 72 8.728 -19.316 5.292 1.00 0.00 C ATOM 1160 OG SER A 72 10.114 -19.076 5.472 1.00 0.00 O ATOM 0 H SER A 72 10.311 -19.260 3.053 1.00 0.00 H new ATOM 0 HA SER A 72 7.764 -20.561 3.831 1.00 0.00 H new ATOM 0 HB2 SER A 72 8.163 -18.427 5.573 1.00 0.00 H new ATOM 0 HB3 SER A 72 8.407 -20.121 5.953 1.00 0.00 H new ATOM 0 HG SER A 72 10.547 -19.890 5.804 1.00 0.00 H new ATOM 1166 N LEU A 73 8.449 -17.526 2.742 1.00 0.00 N ATOM 1167 CA LEU A 73 7.879 -16.364 2.070 1.00 0.00 C ATOM 1168 C LEU A 73 7.169 -16.771 0.784 1.00 0.00 C ATOM 1169 O LEU A 73 7.291 -17.908 0.329 1.00 0.00 O ATOM 1170 CB LEU A 73 8.975 -15.343 1.760 1.00 0.00 C ATOM 1171 CG LEU A 73 9.827 -14.920 2.961 1.00 0.00 C ATOM 1172 CD1 LEU A 73 11.219 -15.526 2.871 1.00 0.00 C ATOM 1173 CD2 LEU A 73 9.911 -13.403 3.049 1.00 0.00 C ATOM 0 H LEU A 73 9.461 -17.489 2.863 1.00 0.00 H new ATOM 0 HA LEU A 73 7.147 -15.912 2.738 1.00 0.00 H new ATOM 0 HB2 LEU A 73 9.632 -15.759 0.996 1.00 0.00 H new ATOM 0 HB3 LEU A 73 8.512 -14.454 1.332 1.00 0.00 H new ATOM 0 HG LEU A 73 9.349 -15.292 3.867 1.00 0.00 H new ATOM 0 HD11 LEU A 73 11.808 -15.214 3.733 1.00 0.00 H new ATOM 0 HD12 LEU A 73 11.142 -16.613 2.859 1.00 0.00 H new ATOM 0 HD13 LEU A 73 11.705 -15.186 1.957 1.00 0.00 H new ATOM 0 HD21 LEU A 73 10.520 -13.122 3.908 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.364 -13.010 2.139 1.00 0.00 H new ATOM 0 HD23 LEU A 73 8.909 -12.989 3.163 1.00 0.00 H new ATOM 1185 N GLN A 74 6.429 -15.834 0.201 1.00 0.00 N ATOM 1186 CA GLN A 74 5.701 -16.094 -1.035 1.00 0.00 C ATOM 1187 C GLN A 74 5.746 -14.879 -1.956 1.00 0.00 C ATOM 1188 O GLN A 74 4.892 -13.996 -1.877 1.00 0.00 O ATOM 1189 CB GLN A 74 4.248 -16.464 -0.728 1.00 0.00 C ATOM 1190 CG GLN A 74 4.100 -17.795 -0.009 1.00 0.00 C ATOM 1191 CD GLN A 74 3.654 -18.911 -0.934 1.00 0.00 C ATOM 1192 OE1 GLN A 74 3.725 -18.786 -2.156 1.00 0.00 O ATOM 1193 NE2 GLN A 74 3.190 -20.011 -0.352 1.00 0.00 N ATOM 0 H GLN A 74 6.318 -14.888 0.565 1.00 0.00 H new ATOM 0 HA GLN A 74 6.181 -16.931 -1.542 1.00 0.00 H new ATOM 0 HB2 GLN A 74 3.803 -15.679 -0.117 1.00 0.00 H new ATOM 0 HB3 GLN A 74 3.686 -16.500 -1.661 1.00 0.00 H new ATOM 0 HG2 GLN A 74 5.052 -18.065 0.447 1.00 0.00 H new ATOM 0 HG3 GLN A 74 3.378 -17.688 0.800 1.00 0.00 H new ATOM 0 HE21 GLN A 74 3.149 -20.071 0.665 1.00 0.00 H new ATOM 0 HE22 GLN A 74 2.875 -20.796 -0.922 1.00 0.00 H new ATOM 1202 N GLU A 75 6.749 -14.842 -2.827 1.00 0.00 N ATOM 1203 CA GLU A 75 6.910 -13.735 -3.763 1.00 0.00 C ATOM 1204 C GLU A 75 5.665 -13.565 -4.628 1.00 0.00 C ATOM 1205 O GLU A 75 5.448 -14.318 -5.578 1.00 0.00 O ATOM 1206 CB GLU A 75 8.133 -13.967 -4.652 1.00 0.00 C ATOM 1207 CG GLU A 75 9.380 -14.360 -3.878 1.00 0.00 C ATOM 1208 CD GLU A 75 9.640 -15.854 -3.911 1.00 0.00 C ATOM 1209 OE1 GLU A 75 9.623 -16.435 -5.017 1.00 0.00 O ATOM 1210 OE2 GLU A 75 9.861 -16.442 -2.832 1.00 0.00 O ATOM 0 H GLU A 75 7.463 -15.566 -2.904 1.00 0.00 H new ATOM 0 HA GLU A 75 7.055 -12.823 -3.185 1.00 0.00 H new ATOM 0 HB2 GLU A 75 7.903 -14.749 -5.376 1.00 0.00 H new ATOM 0 HB3 GLU A 75 8.338 -13.059 -5.218 1.00 0.00 H new ATOM 0 HG2 GLU A 75 10.241 -13.836 -4.293 1.00 0.00 H new ATOM 0 HG3 GLU A 75 9.278 -14.035 -2.842 1.00 0.00 H new ATOM 1217 N SER A 76 4.848 -12.571 -4.293 1.00 0.00 N ATOM 1218 CA SER A 76 3.625 -12.302 -5.039 1.00 0.00 C ATOM 1219 C SER A 76 3.529 -10.826 -5.412 1.00 0.00 C ATOM 1220 O SER A 76 4.448 -10.049 -5.153 1.00 0.00 O ATOM 1221 CB SER A 76 2.401 -12.715 -4.220 1.00 0.00 C ATOM 1222 OG SER A 76 2.005 -14.041 -4.528 1.00 0.00 O ATOM 0 H SER A 76 5.012 -11.939 -3.509 1.00 0.00 H new ATOM 0 HA SER A 76 3.653 -12.889 -5.957 1.00 0.00 H new ATOM 0 HB2 SER A 76 2.628 -12.638 -3.157 1.00 0.00 H new ATOM 0 HB3 SER A 76 1.577 -12.030 -4.421 1.00 0.00 H new ATOM 0 HG SER A 76 2.048 -14.592 -3.719 1.00 0.00 H new ATOM 1228 N THR A 77 2.410 -10.445 -6.021 1.00 0.00 N ATOM 1229 CA THR A 77 2.194 -9.063 -6.430 1.00 0.00 C ATOM 1230 C THR A 77 1.047 -8.434 -5.646 1.00 0.00 C ATOM 1231 O THR A 77 -0.098 -8.430 -6.098 1.00 0.00 O ATOM 1232 CB THR A 77 1.902 -8.993 -7.929 1.00 0.00 C ATOM 1233 OG1 THR A 77 2.956 -9.575 -8.674 1.00 0.00 O ATOM 1234 CG2 THR A 77 1.707 -7.580 -8.437 1.00 0.00 C ATOM 0 H THR A 77 1.639 -11.075 -6.242 1.00 0.00 H new ATOM 0 HA THR A 77 3.104 -8.502 -6.217 1.00 0.00 H new ATOM 0 HB THR A 77 0.971 -9.543 -8.066 1.00 0.00 H new ATOM 0 HG1 THR A 77 2.749 -9.522 -9.630 1.00 0.00 H new ATOM 0 HG21 THR A 77 1.504 -7.603 -9.508 1.00 0.00 H new ATOM 0 HG22 THR A 77 0.867 -7.119 -7.918 1.00 0.00 H new ATOM 0 HG23 THR A 77 2.610 -6.999 -8.252 1.00 0.00 H new ATOM 1242 N ARG A 78 1.362 -7.903 -4.469 1.00 0.00 N ATOM 1243 CA ARG A 78 0.357 -7.268 -3.623 1.00 0.00 C ATOM 1244 C ARG A 78 0.644 -5.779 -3.465 1.00 0.00 C ATOM 1245 O ARG A 78 -0.220 -4.939 -3.718 1.00 0.00 O ATOM 1246 CB ARG A 78 0.316 -7.940 -2.249 1.00 0.00 C ATOM 1247 CG ARG A 78 -0.188 -9.375 -2.288 1.00 0.00 C ATOM 1248 CD ARG A 78 -1.304 -9.608 -1.280 1.00 0.00 C ATOM 1249 NE ARG A 78 -0.871 -10.454 -0.170 1.00 0.00 N ATOM 1250 CZ ARG A 78 -0.173 -10.011 0.873 1.00 0.00 C ATOM 1251 NH1 ARG A 78 0.176 -8.733 0.954 1.00 0.00 N ATOM 1252 NH2 ARG A 78 0.179 -10.850 1.839 1.00 0.00 N ATOM 0 H ARG A 78 2.305 -7.900 -4.079 1.00 0.00 H new ATOM 0 HA ARG A 78 -0.614 -7.385 -4.105 1.00 0.00 H new ATOM 0 HB2 ARG A 78 1.317 -7.927 -1.817 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -0.324 -7.357 -1.587 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -0.549 -9.607 -3.290 1.00 0.00 H new ATOM 0 HG3 ARG A 78 0.637 -10.056 -2.081 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -1.648 -8.649 -0.892 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -2.153 -10.073 -1.780 1.00 0.00 H new ATOM 0 HE ARG A 78 -1.118 -11.443 -0.196 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -0.091 -8.084 0.214 1.00 0.00 H new ATOM 0 HH12 ARG A 78 0.711 -8.400 1.756 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -0.085 -11.833 1.782 1.00 0.00 H new ATOM 0 HH22 ARG A 78 0.714 -10.511 2.639 1.00 0.00 H new ATOM 1266 N PHE A 79 1.865 -5.459 -3.049 1.00 0.00 N ATOM 1267 CA PHE A 79 2.270 -4.071 -2.859 1.00 0.00 C ATOM 1268 C PHE A 79 3.252 -3.642 -3.943 1.00 0.00 C ATOM 1269 O PHE A 79 4.149 -2.834 -3.697 1.00 0.00 O ATOM 1270 CB PHE A 79 2.904 -3.887 -1.479 1.00 0.00 C ATOM 1271 CG PHE A 79 1.903 -3.790 -0.361 1.00 0.00 C ATOM 1272 CD1 PHE A 79 1.156 -2.637 -0.177 1.00 0.00 C ATOM 1273 CD2 PHE A 79 1.711 -4.853 0.506 1.00 0.00 C ATOM 1274 CE1 PHE A 79 0.237 -2.548 0.851 1.00 0.00 C ATOM 1275 CE2 PHE A 79 0.795 -4.768 1.537 1.00 0.00 C ATOM 1276 CZ PHE A 79 0.057 -3.614 1.709 1.00 0.00 C ATOM 0 H PHE A 79 2.592 -6.143 -2.837 1.00 0.00 H new ATOM 0 HA PHE A 79 1.381 -3.445 -2.928 1.00 0.00 H new ATOM 0 HB2 PHE A 79 3.574 -4.724 -1.283 1.00 0.00 H new ATOM 0 HB3 PHE A 79 3.515 -2.984 -1.487 1.00 0.00 H new ATOM 0 HD1 PHE A 79 1.294 -1.799 -0.844 1.00 0.00 H new ATOM 0 HD2 PHE A 79 2.284 -5.759 0.375 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.340 -1.645 0.983 1.00 0.00 H new ATOM 0 HE2 PHE A 79 0.657 -5.603 2.207 1.00 0.00 H new ATOM 0 HZ PHE A 79 -0.660 -3.545 2.514 1.00 0.00 H new ATOM 1286 N SER A 80 3.079 -4.187 -5.142 1.00 0.00 N ATOM 1287 CA SER A 80 3.953 -3.860 -6.264 1.00 0.00 C ATOM 1288 C SER A 80 3.474 -2.602 -6.979 1.00 0.00 C ATOM 1289 O SER A 80 4.275 -1.749 -7.359 1.00 0.00 O ATOM 1290 CB SER A 80 4.011 -5.029 -7.250 1.00 0.00 C ATOM 1291 OG SER A 80 2.872 -5.043 -8.093 1.00 0.00 O ATOM 0 H SER A 80 2.342 -4.857 -5.363 1.00 0.00 H new ATOM 0 HA SER A 80 4.952 -3.674 -5.871 1.00 0.00 H new ATOM 0 HB2 SER A 80 4.914 -4.954 -7.855 1.00 0.00 H new ATOM 0 HB3 SER A 80 4.073 -5.969 -6.701 1.00 0.00 H new ATOM 0 HG SER A 80 2.063 -5.135 -7.548 1.00 0.00 H new ATOM 1297 N GLN A 81 2.162 -2.493 -7.158 1.00 0.00 N ATOM 1298 CA GLN A 81 1.577 -1.338 -7.826 1.00 0.00 C ATOM 1299 C GLN A 81 1.390 -0.182 -6.850 1.00 0.00 C ATOM 1300 O GLN A 81 1.467 0.985 -7.232 1.00 0.00 O ATOM 1301 CB GLN A 81 0.233 -1.713 -8.454 1.00 0.00 C ATOM 1302 CG GLN A 81 0.285 -2.980 -9.293 1.00 0.00 C ATOM 1303 CD GLN A 81 1.040 -2.787 -10.594 1.00 0.00 C ATOM 1304 OE1 GLN A 81 0.439 -2.604 -11.653 1.00 0.00 O ATOM 1305 NE2 GLN A 81 2.365 -2.828 -10.521 1.00 0.00 N ATOM 0 H GLN A 81 1.485 -3.190 -6.850 1.00 0.00 H new ATOM 0 HA GLN A 81 2.261 -1.019 -8.612 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -0.505 -1.842 -7.662 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -0.110 -0.888 -9.078 1.00 0.00 H new ATOM 0 HG2 GLN A 81 0.759 -3.774 -8.716 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -0.731 -3.308 -9.512 1.00 0.00 H new ATOM 0 HE21 GLN A 81 2.822 -2.982 -9.622 1.00 0.00 H new ATOM 0 HE22 GLN A 81 2.926 -2.705 -11.364 1.00 0.00 H new ATOM 1314 N LEU A 82 1.143 -0.515 -5.587 1.00 0.00 N ATOM 1315 CA LEU A 82 0.944 0.497 -4.556 1.00 0.00 C ATOM 1316 C LEU A 82 2.205 1.336 -4.366 1.00 0.00 C ATOM 1317 O LEU A 82 2.131 2.515 -4.022 1.00 0.00 O ATOM 1318 CB LEU A 82 0.546 -0.165 -3.234 1.00 0.00 C ATOM 1319 CG LEU A 82 -0.831 -0.833 -3.239 1.00 0.00 C ATOM 1320 CD1 LEU A 82 -0.953 -1.820 -2.088 1.00 0.00 C ATOM 1321 CD2 LEU A 82 -1.930 0.215 -3.160 1.00 0.00 C ATOM 0 H LEU A 82 1.076 -1.477 -5.253 1.00 0.00 H new ATOM 0 HA LEU A 82 0.139 1.158 -4.878 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.296 -0.913 -2.978 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.566 0.588 -2.446 1.00 0.00 H new ATOM 0 HG LEU A 82 -0.942 -1.382 -4.174 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -1.939 -2.284 -2.109 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -0.188 -2.590 -2.186 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -0.820 -1.294 -1.142 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -2.903 -0.277 -3.165 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.819 0.790 -2.241 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -1.857 0.884 -4.018 1.00 0.00 H new ATOM 1333 N VAL A 83 3.360 0.720 -4.596 1.00 0.00 N ATOM 1334 CA VAL A 83 4.636 1.413 -4.454 1.00 0.00 C ATOM 1335 C VAL A 83 4.963 2.208 -5.713 1.00 0.00 C ATOM 1336 O VAL A 83 5.556 3.285 -5.644 1.00 0.00 O ATOM 1337 CB VAL A 83 5.785 0.428 -4.171 1.00 0.00 C ATOM 1338 CG1 VAL A 83 7.072 1.180 -3.864 1.00 0.00 C ATOM 1339 CG2 VAL A 83 5.421 -0.504 -3.025 1.00 0.00 C ATOM 0 H VAL A 83 3.439 -0.256 -4.881 1.00 0.00 H new ATOM 0 HA VAL A 83 4.537 2.092 -3.607 1.00 0.00 H new ATOM 0 HB VAL A 83 5.947 -0.176 -5.064 1.00 0.00 H new ATOM 0 HG11 VAL A 83 7.872 0.467 -3.667 1.00 0.00 H new ATOM 0 HG12 VAL A 83 7.342 1.802 -4.717 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.924 1.811 -2.988 1.00 0.00 H new ATOM 0 HG21 VAL A 83 6.245 -1.193 -2.840 1.00 0.00 H new ATOM 0 HG22 VAL A 83 5.229 0.082 -2.126 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.527 -1.070 -3.286 1.00 0.00 H new ATOM 1349 N GLU A 84 4.573 1.670 -6.864 1.00 0.00 N ATOM 1350 CA GLU A 84 4.823 2.328 -8.141 1.00 0.00 C ATOM 1351 C GLU A 84 3.850 3.482 -8.359 1.00 0.00 C ATOM 1352 O GLU A 84 4.257 4.596 -8.689 1.00 0.00 O ATOM 1353 CB GLU A 84 4.705 1.322 -9.288 1.00 0.00 C ATOM 1354 CG GLU A 84 6.008 0.609 -9.608 1.00 0.00 C ATOM 1355 CD GLU A 84 6.870 1.382 -10.586 1.00 0.00 C ATOM 1356 OE1 GLU A 84 6.317 1.922 -11.567 1.00 0.00 O ATOM 1357 OE2 GLU A 84 8.099 1.447 -10.371 1.00 0.00 O ATOM 0 H GLU A 84 4.082 0.779 -6.938 1.00 0.00 H new ATOM 0 HA GLU A 84 5.836 2.730 -8.122 1.00 0.00 H new ATOM 0 HB2 GLU A 84 3.948 0.580 -9.033 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.356 1.841 -10.181 1.00 0.00 H new ATOM 0 HG2 GLU A 84 6.566 0.448 -8.686 1.00 0.00 H new ATOM 0 HG3 GLU A 84 5.787 -0.375 -10.022 1.00 0.00 H new ATOM 1364 N GLU A 85 2.563 3.209 -8.169 1.00 0.00 N ATOM 1365 CA GLU A 85 1.534 4.227 -8.343 1.00 0.00 C ATOM 1366 C GLU A 85 1.768 5.401 -7.399 1.00 0.00 C ATOM 1367 O GLU A 85 1.613 6.560 -7.782 1.00 0.00 O ATOM 1368 CB GLU A 85 0.146 3.631 -8.103 1.00 0.00 C ATOM 1369 CG GLU A 85 -0.510 3.084 -9.361 1.00 0.00 C ATOM 1370 CD GLU A 85 0.369 2.088 -10.092 1.00 0.00 C ATOM 1371 OE1 GLU A 85 1.522 2.441 -10.420 1.00 0.00 O ATOM 1372 OE2 GLU A 85 -0.095 0.955 -10.336 1.00 0.00 O ATOM 0 H GLU A 85 2.209 2.293 -7.895 1.00 0.00 H new ATOM 0 HA GLU A 85 1.589 4.591 -9.369 1.00 0.00 H new ATOM 0 HB2 GLU A 85 0.226 2.830 -7.368 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -0.499 4.396 -7.671 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -1.452 2.605 -9.096 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -0.750 3.911 -10.030 1.00 0.00 H new ATOM 1379 N LEU A 86 2.145 5.092 -6.161 1.00 0.00 N ATOM 1380 CA LEU A 86 2.404 6.121 -5.162 1.00 0.00 C ATOM 1381 C LEU A 86 3.483 7.084 -5.645 1.00 0.00 C ATOM 1382 O LEU A 86 3.324 8.302 -5.563 1.00 0.00 O ATOM 1383 CB LEU A 86 2.829 5.482 -3.838 1.00 0.00 C ATOM 1384 CG LEU A 86 2.921 6.442 -2.650 1.00 0.00 C ATOM 1385 CD1 LEU A 86 1.641 7.253 -2.517 1.00 0.00 C ATOM 1386 CD2 LEU A 86 3.203 5.674 -1.368 1.00 0.00 C ATOM 0 H LEU A 86 2.277 4.137 -5.827 1.00 0.00 H new ATOM 0 HA LEU A 86 1.483 6.682 -5.006 1.00 0.00 H new ATOM 0 HB2 LEU A 86 2.121 4.691 -3.591 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.801 5.008 -3.977 1.00 0.00 H new ATOM 0 HG LEU A 86 3.746 7.132 -2.827 1.00 0.00 H new ATOM 0 HD11 LEU A 86 1.726 7.930 -1.667 1.00 0.00 H new ATOM 0 HD12 LEU A 86 1.481 7.832 -3.427 1.00 0.00 H new ATOM 0 HD13 LEU A 86 0.798 6.580 -2.362 1.00 0.00 H new ATOM 0 HD21 LEU A 86 3.266 6.371 -0.532 1.00 0.00 H new ATOM 0 HD22 LEU A 86 2.399 4.961 -1.186 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.147 5.138 -1.465 1.00 0.00 H new ATOM 1398 N LEU A 87 4.579 6.528 -6.150 1.00 0.00 N ATOM 1399 CA LEU A 87 5.686 7.336 -6.651 1.00 0.00 C ATOM 1400 C LEU A 87 5.210 8.289 -7.743 1.00 0.00 C ATOM 1401 O LEU A 87 5.747 9.386 -7.902 1.00 0.00 O ATOM 1402 CB LEU A 87 6.797 6.435 -7.194 1.00 0.00 C ATOM 1403 CG LEU A 87 7.611 5.699 -6.128 1.00 0.00 C ATOM 1404 CD1 LEU A 87 8.686 4.839 -6.777 1.00 0.00 C ATOM 1405 CD2 LEU A 87 8.234 6.690 -5.156 1.00 0.00 C ATOM 0 H LEU A 87 4.725 5.521 -6.223 1.00 0.00 H new ATOM 0 HA LEU A 87 6.078 7.926 -5.823 1.00 0.00 H new ATOM 0 HB2 LEU A 87 6.352 5.698 -7.863 1.00 0.00 H new ATOM 0 HB3 LEU A 87 7.476 7.042 -7.794 1.00 0.00 H new ATOM 0 HG LEU A 87 6.939 5.046 -5.571 1.00 0.00 H new ATOM 0 HD11 LEU A 87 9.255 4.323 -6.004 1.00 0.00 H new ATOM 0 HD12 LEU A 87 8.218 4.106 -7.434 1.00 0.00 H new ATOM 0 HD13 LEU A 87 9.356 5.472 -7.359 1.00 0.00 H new ATOM 0 HD21 LEU A 87 8.809 6.150 -4.404 1.00 0.00 H new ATOM 0 HD22 LEU A 87 8.893 7.368 -5.699 1.00 0.00 H new ATOM 0 HD23 LEU A 87 7.447 7.264 -4.667 1.00 0.00 H new ATOM 1417 N LYS A 88 4.196 7.865 -8.491 1.00 0.00 N ATOM 1418 CA LYS A 88 3.645 8.681 -9.566 1.00 0.00 C ATOM 1419 C LYS A 88 2.818 9.831 -9.002 1.00 0.00 C ATOM 1420 O LYS A 88 2.833 10.941 -9.535 1.00 0.00 O ATOM 1421 CB LYS A 88 2.782 7.825 -10.495 1.00 0.00 C ATOM 1422 CG LYS A 88 3.589 6.915 -11.408 1.00 0.00 C ATOM 1423 CD LYS A 88 3.782 7.534 -12.782 1.00 0.00 C ATOM 1424 CE LYS A 88 3.811 6.475 -13.871 1.00 0.00 C ATOM 1425 NZ LYS A 88 3.563 7.056 -15.219 1.00 0.00 N ATOM 0 H LYS A 88 3.740 6.961 -8.372 1.00 0.00 H new ATOM 0 HA LYS A 88 4.476 9.097 -10.136 1.00 0.00 H new ATOM 0 HB2 LYS A 88 2.108 7.216 -9.893 1.00 0.00 H new ATOM 0 HB3 LYS A 88 2.160 8.480 -11.106 1.00 0.00 H new ATOM 0 HG2 LYS A 88 4.561 6.716 -10.958 1.00 0.00 H new ATOM 0 HG3 LYS A 88 3.082 5.956 -11.508 1.00 0.00 H new ATOM 0 HD2 LYS A 88 2.975 8.240 -12.981 1.00 0.00 H new ATOM 0 HD3 LYS A 88 4.713 8.101 -12.799 1.00 0.00 H new ATOM 0 HE2 LYS A 88 4.779 5.974 -13.864 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.058 5.716 -13.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 3.591 6.301 -15.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 2.628 7.512 -15.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 4.296 7.762 -15.433 1.00 0.00 H new ATOM 1439 N ILE A 89 2.100 9.559 -7.916 1.00 0.00 N ATOM 1440 CA ILE A 89 1.270 10.571 -7.276 1.00 0.00 C ATOM 1441 C ILE A 89 2.130 11.673 -6.665 1.00 0.00 C ATOM 1442 O ILE A 89 1.730 12.837 -6.625 1.00 0.00 O ATOM 1443 CB ILE A 89 0.378 9.957 -6.178 1.00 0.00 C ATOM 1444 CG1 ILE A 89 -0.414 8.772 -6.737 1.00 0.00 C ATOM 1445 CG2 ILE A 89 -0.564 11.006 -5.605 1.00 0.00 C ATOM 1446 CD1 ILE A 89 -0.831 7.770 -5.681 1.00 0.00 C ATOM 0 H ILE A 89 2.077 8.646 -7.462 1.00 0.00 H new ATOM 0 HA ILE A 89 0.632 10.997 -8.050 1.00 0.00 H new ATOM 0 HB ILE A 89 1.019 9.597 -5.373 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -1.304 9.147 -7.242 1.00 0.00 H new ATOM 0 HG13 ILE A 89 0.190 8.265 -7.489 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -1.185 10.554 -4.832 1.00 0.00 H new ATOM 0 HG22 ILE A 89 0.018 11.820 -5.173 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.200 11.396 -6.399 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -1.388 6.958 -6.149 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.056 7.367 -5.192 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -1.462 8.263 -4.941 1.00 0.00 H new ATOM 1458 N ILE A 90 3.315 11.299 -6.195 1.00 0.00 N ATOM 1459 CA ILE A 90 4.234 12.255 -5.590 1.00 0.00 C ATOM 1460 C ILE A 90 4.772 13.228 -6.634 1.00 0.00 C ATOM 1461 O ILE A 90 4.871 14.430 -6.384 1.00 0.00 O ATOM 1462 CB ILE A 90 5.419 11.544 -4.907 1.00 0.00 C ATOM 1463 CG1 ILE A 90 4.913 10.462 -3.951 1.00 0.00 C ATOM 1464 CG2 ILE A 90 6.285 12.550 -4.162 1.00 0.00 C ATOM 1465 CD1 ILE A 90 5.882 9.313 -3.771 1.00 0.00 C ATOM 0 H ILE A 90 3.661 10.340 -6.222 1.00 0.00 H new ATOM 0 HA ILE A 90 3.670 12.805 -4.836 1.00 0.00 H new ATOM 0 HB ILE A 90 6.027 11.068 -5.676 1.00 0.00 H new ATOM 0 HG12 ILE A 90 4.712 10.913 -2.979 1.00 0.00 H new ATOM 0 HG13 ILE A 90 3.966 10.073 -4.324 1.00 0.00 H new ATOM 0 HG21 ILE A 90 7.117 12.031 -3.686 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.672 13.288 -4.865 1.00 0.00 H new ATOM 0 HG23 ILE A 90 5.687 13.052 -3.401 1.00 0.00 H new ATOM 0 HD11 ILE A 90 5.458 8.584 -3.081 1.00 0.00 H new ATOM 0 HD12 ILE A 90 6.065 8.837 -4.734 1.00 0.00 H new ATOM 0 HD13 ILE A 90 6.822 9.690 -3.368 1.00 0.00 H new ATOM 1477 N CYS A 91 5.119 12.701 -7.804 1.00 0.00 N ATOM 1478 CA CYS A 91 5.646 13.523 -8.886 1.00 0.00 C ATOM 1479 C CYS A 91 4.593 14.511 -9.379 1.00 0.00 C ATOM 1480 O CYS A 91 4.912 15.645 -9.736 1.00 0.00 O ATOM 1481 CB CYS A 91 6.117 12.640 -10.042 1.00 0.00 C ATOM 1482 SG CYS A 91 7.786 11.977 -9.834 1.00 0.00 S ATOM 0 H CYS A 91 5.044 11.708 -8.026 1.00 0.00 H new ATOM 0 HA CYS A 91 6.496 14.087 -8.501 1.00 0.00 H new ATOM 0 HB2 CYS A 91 5.420 11.810 -10.158 1.00 0.00 H new ATOM 0 HB3 CYS A 91 6.080 13.219 -10.965 1.00 0.00 H new ATOM 0 HG CYS A 91 8.092 11.242 -10.862 1.00 0.00 H new ATOM 1488 N ALA A 92 3.340 14.072 -9.395 1.00 0.00 N ATOM 1489 CA ALA A 92 2.241 14.918 -9.842 1.00 0.00 C ATOM 1490 C ALA A 92 2.133 16.174 -8.986 1.00 0.00 C ATOM 1491 O ALA A 92 1.893 17.268 -9.496 1.00 0.00 O ATOM 1492 CB ALA A 92 0.931 14.143 -9.812 1.00 0.00 C ATOM 0 H ALA A 92 3.060 13.135 -9.104 1.00 0.00 H new ATOM 0 HA ALA A 92 2.446 15.225 -10.868 1.00 0.00 H new ATOM 0 HB1 ALA A 92 0.119 14.788 -10.148 1.00 0.00 H new ATOM 0 HB2 ALA A 92 1.005 13.278 -10.471 1.00 0.00 H new ATOM 0 HB3 ALA A 92 0.730 13.807 -8.795 1.00 0.00 H new ATOM 1498 N PHE A 93 2.315 16.009 -7.679 1.00 0.00 N ATOM 1499 CA PHE A 93 2.241 17.129 -6.749 1.00 0.00 C ATOM 1500 C PHE A 93 3.272 18.197 -7.101 1.00 0.00 C ATOM 1501 O PHE A 93 2.927 19.360 -7.315 1.00 0.00 O ATOM 1502 CB PHE A 93 2.461 16.644 -5.315 1.00 0.00 C ATOM 1503 CG PHE A 93 1.575 17.321 -4.309 1.00 0.00 C ATOM 1504 CD1 PHE A 93 0.198 17.204 -4.389 1.00 0.00 C ATOM 1505 CD2 PHE A 93 2.122 18.075 -3.281 1.00 0.00 C ATOM 1506 CE1 PHE A 93 -0.620 17.826 -3.464 1.00 0.00 C ATOM 1507 CE2 PHE A 93 1.310 18.699 -2.354 1.00 0.00 C ATOM 1508 CZ PHE A 93 -0.063 18.574 -2.445 1.00 0.00 C ATOM 0 H PHE A 93 2.515 15.110 -7.241 1.00 0.00 H new ATOM 0 HA PHE A 93 1.247 17.569 -6.827 1.00 0.00 H new ATOM 0 HB2 PHE A 93 2.288 15.569 -5.273 1.00 0.00 H new ATOM 0 HB3 PHE A 93 3.502 16.810 -5.040 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -0.243 16.620 -5.183 1.00 0.00 H new ATOM 0 HD2 PHE A 93 3.195 18.175 -3.205 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -1.693 17.727 -3.538 1.00 0.00 H new ATOM 0 HE2 PHE A 93 1.748 19.284 -1.559 1.00 0.00 H new ATOM 0 HZ PHE A 93 -0.700 19.060 -1.721 1.00 0.00 H new ATOM 1518 N GLN A 94 4.536 17.795 -7.160 1.00 0.00 N ATOM 1519 CA GLN A 94 5.618 18.718 -7.487 1.00 0.00 C ATOM 1520 C GLN A 94 5.441 19.288 -8.891 1.00 0.00 C ATOM 1521 O GLN A 94 5.838 20.420 -9.167 1.00 0.00 O ATOM 1522 CB GLN A 94 6.970 18.011 -7.377 1.00 0.00 C ATOM 1523 CG GLN A 94 7.124 16.841 -8.336 1.00 0.00 C ATOM 1524 CD GLN A 94 8.554 16.345 -8.423 1.00 0.00 C ATOM 1525 OE1 GLN A 94 9.453 16.886 -7.778 1.00 0.00 O ATOM 1526 NE2 GLN A 94 8.773 15.307 -9.223 1.00 0.00 N ATOM 0 H GLN A 94 4.838 16.836 -6.986 1.00 0.00 H new ATOM 0 HA GLN A 94 5.588 19.542 -6.774 1.00 0.00 H new ATOM 0 HB2 GLN A 94 7.765 18.733 -7.567 1.00 0.00 H new ATOM 0 HB3 GLN A 94 7.102 17.653 -6.356 1.00 0.00 H new ATOM 0 HG2 GLN A 94 6.479 16.024 -8.014 1.00 0.00 H new ATOM 0 HG3 GLN A 94 6.786 17.142 -9.328 1.00 0.00 H new ATOM 0 HE21 GLN A 94 7.999 14.889 -9.739 1.00 0.00 H new ATOM 0 HE22 GLN A 94 9.715 14.928 -9.321 1.00 0.00 H new ATOM 1535 N LEU A 95 4.842 18.496 -9.775 1.00 0.00 N ATOM 1536 CA LEU A 95 4.612 18.923 -11.149 1.00 0.00 C ATOM 1537 C LEU A 95 3.736 20.170 -11.194 1.00 0.00 C ATOM 1538 O LEU A 95 3.991 21.093 -11.968 1.00 0.00 O ATOM 1539 CB LEU A 95 3.956 17.796 -11.951 1.00 0.00 C ATOM 1540 CG LEU A 95 4.285 17.787 -13.445 1.00 0.00 C ATOM 1541 CD1 LEU A 95 5.758 17.478 -13.664 1.00 0.00 C ATOM 1542 CD2 LEU A 95 3.412 16.780 -14.177 1.00 0.00 C ATOM 0 H LEU A 95 4.508 17.556 -9.564 1.00 0.00 H new ATOM 0 HA LEU A 95 5.577 19.164 -11.594 1.00 0.00 H new ATOM 0 HB2 LEU A 95 4.260 16.841 -11.522 1.00 0.00 H new ATOM 0 HB3 LEU A 95 2.875 17.869 -11.833 1.00 0.00 H new ATOM 0 HG LEU A 95 4.078 18.778 -13.850 1.00 0.00 H new ATOM 0 HD11 LEU A 95 5.974 17.476 -14.732 1.00 0.00 H new ATOM 0 HD12 LEU A 95 6.366 18.237 -13.172 1.00 0.00 H new ATOM 0 HD13 LEU A 95 5.991 16.499 -13.245 1.00 0.00 H new ATOM 0 HD21 LEU A 95 3.660 16.787 -15.238 1.00 0.00 H new ATOM 0 HD22 LEU A 95 3.587 15.784 -13.770 1.00 0.00 H new ATOM 0 HD23 LEU A 95 2.363 17.046 -14.048 1.00 0.00 H new ATOM 1554 N ASP A 96 2.703 20.191 -10.359 1.00 0.00 N ATOM 1555 CA ASP A 96 1.789 21.326 -10.302 1.00 0.00 C ATOM 1556 C ASP A 96 2.143 22.255 -9.145 1.00 0.00 C ATOM 1557 O ASP A 96 2.543 23.400 -9.355 1.00 0.00 O ATOM 1558 CB ASP A 96 0.346 20.839 -10.156 1.00 0.00 C ATOM 1559 CG ASP A 96 -0.665 21.919 -10.486 1.00 0.00 C ATOM 1560 OD1 ASP A 96 -0.293 22.891 -11.176 1.00 0.00 O ATOM 1561 OD2 ASP A 96 -1.830 21.794 -10.054 1.00 0.00 O ATOM 0 H ASP A 96 2.478 19.435 -9.712 1.00 0.00 H new ATOM 0 HA ASP A 96 1.885 21.883 -11.234 1.00 0.00 H new ATOM 0 HB2 ASP A 96 0.186 19.983 -10.812 1.00 0.00 H new ATOM 0 HB3 ASP A 96 0.184 20.493 -9.135 1.00 0.00 H new ATOM 1566 N THR A 97 1.992 21.754 -7.923 1.00 0.00 N ATOM 1567 CA THR A 97 2.296 22.538 -6.731 1.00 0.00 C ATOM 1568 C THR A 97 3.750 22.999 -6.737 1.00 0.00 C ATOM 1569 O THR A 97 4.035 24.193 -6.654 1.00 0.00 O ATOM 1570 CB THR A 97 2.014 21.721 -5.471 1.00 0.00 C ATOM 1571 OG1 THR A 97 3.033 20.760 -5.257 1.00 0.00 O ATOM 1572 CG2 THR A 97 0.692 20.986 -5.516 1.00 0.00 C ATOM 0 H THR A 97 1.661 20.808 -7.732 1.00 0.00 H new ATOM 0 HA THR A 97 1.655 23.419 -6.735 1.00 0.00 H new ATOM 0 HB THR A 97 1.979 22.447 -4.659 1.00 0.00 H new ATOM 0 HG1 THR A 97 3.227 20.296 -6.098 1.00 0.00 H new ATOM 0 HG21 THR A 97 0.555 20.426 -4.591 1.00 0.00 H new ATOM 0 HG22 THR A 97 -0.120 21.704 -5.629 1.00 0.00 H new ATOM 0 HG23 THR A 97 0.687 20.297 -6.361 1.00 0.00 H new ATOM 1580 N GLY A 98 4.668 22.042 -6.836 1.00 0.00 N ATOM 1581 CA GLY A 98 6.081 22.369 -6.850 1.00 0.00 C ATOM 1582 C GLY A 98 6.686 22.393 -5.460 1.00 0.00 C ATOM 1583 O GLY A 98 7.669 23.093 -5.216 1.00 0.00 O ATOM 0 H GLY A 98 4.458 21.046 -6.907 1.00 0.00 H new ATOM 0 HA2 GLY A 98 6.613 21.640 -7.462 1.00 0.00 H new ATOM 0 HA3 GLY A 98 6.221 23.342 -7.320 1.00 0.00 H new ATOM 1587 N LEU A 99 6.099 21.626 -4.547 1.00 0.00 N ATOM 1588 CA LEU A 99 6.586 21.564 -3.175 1.00 0.00 C ATOM 1589 C LEU A 99 7.552 20.397 -2.993 1.00 0.00 C ATOM 1590 O LEU A 99 7.636 19.511 -3.842 1.00 0.00 O ATOM 1591 CB LEU A 99 5.413 21.426 -2.201 1.00 0.00 C ATOM 1592 CG LEU A 99 4.607 22.705 -1.972 1.00 0.00 C ATOM 1593 CD1 LEU A 99 4.020 23.208 -3.282 1.00 0.00 C ATOM 1594 CD2 LEU A 99 3.508 22.465 -0.949 1.00 0.00 C ATOM 0 H LEU A 99 5.286 21.039 -4.733 1.00 0.00 H new ATOM 0 HA LEU A 99 7.119 22.491 -2.963 1.00 0.00 H new ATOM 0 HB2 LEU A 99 4.741 20.653 -2.573 1.00 0.00 H new ATOM 0 HB3 LEU A 99 5.796 21.080 -1.241 1.00 0.00 H new ATOM 0 HG LEU A 99 5.278 23.470 -1.582 1.00 0.00 H new ATOM 0 HD11 LEU A 99 3.450 24.119 -3.099 1.00 0.00 H new ATOM 0 HD12 LEU A 99 4.826 23.419 -3.985 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.363 22.447 -3.702 1.00 0.00 H new ATOM 0 HD21 LEU A 99 2.944 23.386 -0.798 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.838 21.685 -1.311 1.00 0.00 H new ATOM 0 HD23 LEU A 99 3.952 22.153 -0.004 1.00 0.00 H new ATOM 1606 N GLU A 100 8.279 20.405 -1.881 1.00 0.00 N ATOM 1607 CA GLU A 100 9.240 19.349 -1.587 1.00 0.00 C ATOM 1608 C GLU A 100 8.558 18.168 -0.903 1.00 0.00 C ATOM 1609 O GLU A 100 7.813 18.343 0.061 1.00 0.00 O ATOM 1610 CB GLU A 100 10.367 19.886 -0.702 1.00 0.00 C ATOM 1611 CG GLU A 100 11.182 20.988 -1.357 1.00 0.00 C ATOM 1612 CD GLU A 100 12.366 21.416 -0.513 1.00 0.00 C ATOM 1613 OE1 GLU A 100 13.241 20.567 -0.244 1.00 0.00 O ATOM 1614 OE2 GLU A 100 12.419 22.602 -0.122 1.00 0.00 O ATOM 0 H GLU A 100 8.221 21.132 -1.168 1.00 0.00 H new ATOM 0 HA GLU A 100 9.663 19.004 -2.531 1.00 0.00 H new ATOM 0 HB2 GLU A 100 9.940 20.265 0.226 1.00 0.00 H new ATOM 0 HB3 GLU A 100 11.031 19.064 -0.435 1.00 0.00 H new ATOM 0 HG2 GLU A 100 11.538 20.644 -2.328 1.00 0.00 H new ATOM 0 HG3 GLU A 100 10.540 21.850 -1.540 1.00 0.00 H new ATOM 1621 N TYR A 101 8.820 16.967 -1.408 1.00 0.00 N ATOM 1622 CA TYR A 101 8.232 15.757 -0.844 1.00 0.00 C ATOM 1623 C TYR A 101 9.076 15.227 0.310 1.00 0.00 C ATOM 1624 O TYR A 101 8.546 14.745 1.311 1.00 0.00 O ATOM 1625 CB TYR A 101 8.091 14.683 -1.925 1.00 0.00 C ATOM 1626 CG TYR A 101 7.434 13.412 -1.433 1.00 0.00 C ATOM 1627 CD1 TYR A 101 6.178 13.441 -0.840 1.00 0.00 C ATOM 1628 CD2 TYR A 101 8.069 12.184 -1.565 1.00 0.00 C ATOM 1629 CE1 TYR A 101 5.574 12.283 -0.390 1.00 0.00 C ATOM 1630 CE2 TYR A 101 7.472 11.020 -1.119 1.00 0.00 C ATOM 1631 CZ TYR A 101 6.225 11.075 -0.532 1.00 0.00 C ATOM 1632 OH TYR A 101 5.627 9.919 -0.085 1.00 0.00 O ATOM 0 H TYR A 101 9.435 16.805 -2.206 1.00 0.00 H new ATOM 0 HA TYR A 101 7.244 16.008 -0.460 1.00 0.00 H new ATOM 0 HB2 TYR A 101 7.508 15.087 -2.753 1.00 0.00 H new ATOM 0 HB3 TYR A 101 9.079 14.443 -2.318 1.00 0.00 H new ATOM 0 HD1 TYR A 101 5.665 14.385 -0.729 1.00 0.00 H new ATOM 0 HD2 TYR A 101 9.046 12.138 -2.024 1.00 0.00 H new ATOM 0 HE1 TYR A 101 4.598 12.323 0.070 1.00 0.00 H new ATOM 0 HE2 TYR A 101 7.979 10.073 -1.229 1.00 0.00 H new ATOM 0 HH TYR A 101 6.068 9.619 0.737 1.00 0.00 H new ATOM 1765 N ALA B 33 -7.519 22.548 -11.469 1.00 0.00 N ATOM 1766 CA ALA B 33 -6.687 22.180 -10.330 1.00 0.00 C ATOM 1767 C ALA B 33 -7.114 20.836 -9.750 1.00 0.00 C ATOM 1768 O ALA B 33 -8.259 20.414 -9.913 1.00 0.00 O ATOM 1769 CB ALA B 33 -6.749 23.262 -9.262 1.00 0.00 C ATOM 0 HA ALA B 33 -5.658 22.085 -10.677 1.00 0.00 H new ATOM 0 HB1 ALA B 33 -6.123 22.975 -8.417 1.00 0.00 H new ATOM 0 HB2 ALA B 33 -6.389 24.204 -9.677 1.00 0.00 H new ATOM 0 HB3 ALA B 33 -7.779 23.383 -8.926 1.00 0.00 H new ATOM 1775 N TRP B 34 -6.187 20.169 -9.072 1.00 0.00 N ATOM 1776 CA TRP B 34 -6.468 18.872 -8.467 1.00 0.00 C ATOM 1777 C TRP B 34 -6.882 17.855 -9.526 1.00 0.00 C ATOM 1778 O TRP B 34 -7.675 16.952 -9.257 1.00 0.00 O ATOM 1779 CB TRP B 34 -7.568 19.005 -7.413 1.00 0.00 C ATOM 1780 CG TRP B 34 -7.231 19.974 -6.321 1.00 0.00 C ATOM 1781 CD1 TRP B 34 -7.995 21.018 -5.887 1.00 0.00 C ATOM 1782 CD2 TRP B 34 -6.040 19.988 -5.525 1.00 0.00 C ATOM 1783 NE1 TRP B 34 -7.353 21.682 -4.869 1.00 0.00 N ATOM 1784 CE2 TRP B 34 -6.151 21.069 -4.629 1.00 0.00 C ATOM 1785 CE3 TRP B 34 -4.892 19.193 -5.482 1.00 0.00 C ATOM 1786 CZ2 TRP B 34 -5.158 21.372 -3.701 1.00 0.00 C ATOM 1787 CZ3 TRP B 34 -3.907 19.495 -4.560 1.00 0.00 C ATOM 1788 CH2 TRP B 34 -4.046 20.576 -3.681 1.00 0.00 C ATOM 0 H TRP B 34 -5.235 20.505 -8.927 1.00 0.00 H new ATOM 0 HA TRP B 34 -5.556 18.518 -7.987 1.00 0.00 H new ATOM 0 HB2 TRP B 34 -8.490 19.323 -7.899 1.00 0.00 H new ATOM 0 HB3 TRP B 34 -7.760 18.026 -6.974 1.00 0.00 H new ATOM 0 HD1 TRP B 34 -8.963 21.284 -6.285 1.00 0.00 H new ATOM 0 HE1 TRP B 34 -7.712 22.498 -4.373 1.00 0.00 H new ATOM 0 HE3 TRP B 34 -4.776 18.358 -6.157 1.00 0.00 H new ATOM 0 HZ2 TRP B 34 -5.262 22.205 -3.022 1.00 0.00 H new ATOM 0 HZ3 TRP B 34 -3.015 18.887 -4.517 1.00 0.00 H new ATOM 0 HH2 TRP B 34 -3.259 20.786 -2.972 1.00 0.00 H new ATOM 1799 N ALA B 35 -6.341 18.008 -10.730 1.00 0.00 N ATOM 1800 CA ALA B 35 -6.654 17.104 -11.829 1.00 0.00 C ATOM 1801 C ALA B 35 -5.769 15.862 -11.787 1.00 0.00 C ATOM 1802 O ALA B 35 -6.261 14.740 -11.667 1.00 0.00 O ATOM 1803 CB ALA B 35 -6.501 17.821 -13.161 1.00 0.00 C ATOM 0 H ALA B 35 -5.683 18.750 -10.969 1.00 0.00 H new ATOM 0 HA ALA B 35 -7.690 16.783 -11.720 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -6.738 17.134 -13.973 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -7.181 18.672 -13.196 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -5.475 18.171 -13.270 1.00 0.00 H new ATOM 1809 N HIS B 36 -4.461 16.071 -11.888 1.00 0.00 N ATOM 1810 CA HIS B 36 -3.506 14.968 -11.861 1.00 0.00 C ATOM 1811 C HIS B 36 -3.607 14.192 -10.552 1.00 0.00 C ATOM 1812 O HIS B 36 -3.359 12.987 -10.513 1.00 0.00 O ATOM 1813 CB HIS B 36 -2.082 15.494 -12.049 1.00 0.00 C ATOM 1814 CG HIS B 36 -1.701 16.557 -11.065 1.00 0.00 C ATOM 1815 ND1 HIS B 36 -2.624 17.108 -10.211 1.00 0.00 N ATOM 1816 CD2 HIS B 36 -0.493 17.131 -10.843 1.00 0.00 C ATOM 1817 CE1 HIS B 36 -1.965 17.999 -9.491 1.00 0.00 C ATOM 1818 NE2 HIS B 36 -0.670 18.049 -9.839 1.00 0.00 N ATOM 0 H HIS B 36 -4.037 16.993 -11.989 1.00 0.00 H new ATOM 0 HA HIS B 36 -3.747 14.292 -12.681 1.00 0.00 H new ATOM 0 HB2 HIS B 36 -1.382 14.663 -11.963 1.00 0.00 H new ATOM 0 HB3 HIS B 36 -1.981 15.892 -13.059 1.00 0.00 H new ATOM 0 HD2 HIS B 36 0.430 16.909 -11.357 1.00 0.00 H new ATOM 0 HE1 HIS B 36 -2.412 18.609 -8.720 1.00 0.00 H new ATOM 0 HE2 HIS B 36 0.045 18.653 -9.435 1.00 0.00 H new ATOM 1826 N SER B 37 -3.973 14.890 -9.482 1.00 0.00 N ATOM 1827 CA SER B 37 -4.107 14.264 -8.171 1.00 0.00 C ATOM 1828 C SER B 37 -5.313 13.332 -8.134 1.00 0.00 C ATOM 1829 O SER B 37 -5.285 12.289 -7.481 1.00 0.00 O ATOM 1830 CB SER B 37 -4.240 15.333 -7.084 1.00 0.00 C ATOM 1831 OG SER B 37 -3.597 14.927 -5.888 1.00 0.00 O ATOM 0 H SER B 37 -4.182 15.888 -9.496 1.00 0.00 H new ATOM 0 HA SER B 37 -3.209 13.675 -7.984 1.00 0.00 H new ATOM 0 HB2 SER B 37 -3.805 16.269 -7.435 1.00 0.00 H new ATOM 0 HB3 SER B 37 -5.294 15.526 -6.886 1.00 0.00 H new ATOM 0 HG SER B 37 -3.695 15.628 -5.210 1.00 0.00 H new ATOM 1837 N ARG B 38 -6.373 13.715 -8.839 1.00 0.00 N ATOM 1838 CA ARG B 38 -7.590 12.913 -8.887 1.00 0.00 C ATOM 1839 C ARG B 38 -7.395 11.680 -9.763 1.00 0.00 C ATOM 1840 O ARG B 38 -7.799 10.576 -9.396 1.00 0.00 O ATOM 1841 CB ARG B 38 -8.756 13.750 -9.416 1.00 0.00 C ATOM 1842 CG ARG B 38 -10.113 13.295 -8.904 1.00 0.00 C ATOM 1843 CD ARG B 38 -10.660 12.138 -9.724 1.00 0.00 C ATOM 1844 NE ARG B 38 -12.118 12.156 -9.793 1.00 0.00 N ATOM 1845 CZ ARG B 38 -12.913 11.786 -8.792 1.00 0.00 C ATOM 1846 NH1 ARG B 38 -12.394 11.368 -7.643 1.00 0.00 N ATOM 1847 NH2 ARG B 38 -14.230 11.834 -8.938 1.00 0.00 N ATOM 0 H ARG B 38 -6.413 14.576 -9.385 1.00 0.00 H new ATOM 0 HA ARG B 38 -7.819 12.583 -7.874 1.00 0.00 H new ATOM 0 HB2 ARG B 38 -8.602 14.792 -9.135 1.00 0.00 H new ATOM 0 HB3 ARG B 38 -8.756 13.710 -10.505 1.00 0.00 H new ATOM 0 HG2 ARG B 38 -10.026 12.993 -7.860 1.00 0.00 H new ATOM 0 HG3 ARG B 38 -10.814 14.129 -8.938 1.00 0.00 H new ATOM 0 HD2 ARG B 38 -10.249 12.183 -10.733 1.00 0.00 H new ATOM 0 HD3 ARG B 38 -10.330 11.196 -9.287 1.00 0.00 H new ATOM 0 HE ARG B 38 -12.553 12.471 -10.660 1.00 0.00 H new ATOM 0 HH11 ARG B 38 -11.382 11.329 -7.525 1.00 0.00 H new ATOM 0 HH12 ARG B 38 -13.008 11.086 -6.879 1.00 0.00 H new ATOM 0 HH21 ARG B 38 -14.634 12.155 -9.818 1.00 0.00 H new ATOM 0 HH22 ARG B 38 -14.839 11.550 -8.170 1.00 0.00 H new ATOM 1861 N ALA B 39 -6.774 11.876 -10.921 1.00 0.00 N ATOM 1862 CA ALA B 39 -6.524 10.779 -11.849 1.00 0.00 C ATOM 1863 C ALA B 39 -5.651 9.706 -11.209 1.00 0.00 C ATOM 1864 O ALA B 39 -5.980 8.520 -11.247 1.00 0.00 O ATOM 1865 CB ALA B 39 -5.874 11.303 -13.120 1.00 0.00 C ATOM 0 H ALA B 39 -6.435 12.784 -11.239 1.00 0.00 H new ATOM 0 HA ALA B 39 -7.482 10.325 -12.104 1.00 0.00 H new ATOM 0 HB1 ALA B 39 -5.693 10.474 -13.804 1.00 0.00 H new ATOM 0 HB2 ALA B 39 -6.535 12.028 -13.595 1.00 0.00 H new ATOM 0 HB3 ALA B 39 -4.927 11.783 -12.873 1.00 0.00 H new ATOM 1871 N ALA B 40 -4.538 10.129 -10.619 1.00 0.00 N ATOM 1872 CA ALA B 40 -3.617 9.204 -9.971 1.00 0.00 C ATOM 1873 C ALA B 40 -4.308 8.442 -8.845 1.00 0.00 C ATOM 1874 O ALA B 40 -3.973 7.291 -8.565 1.00 0.00 O ATOM 1875 CB ALA B 40 -2.405 9.953 -9.436 1.00 0.00 C ATOM 0 H ALA B 40 -4.252 11.107 -10.577 1.00 0.00 H new ATOM 0 HA ALA B 40 -3.284 8.481 -10.715 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -1.726 9.249 -8.955 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -1.891 10.448 -10.260 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -2.729 10.699 -8.710 1.00 0.00 H new ATOM 1881 N LEU B 41 -5.275 9.091 -8.205 1.00 0.00 N ATOM 1882 CA LEU B 41 -6.014 8.473 -7.110 1.00 0.00 C ATOM 1883 C LEU B 41 -6.745 7.221 -7.584 1.00 0.00 C ATOM 1884 O LEU B 41 -6.687 6.175 -6.938 1.00 0.00 O ATOM 1885 CB LEU B 41 -7.014 9.467 -6.517 1.00 0.00 C ATOM 1886 CG LEU B 41 -7.843 8.932 -5.350 1.00 0.00 C ATOM 1887 CD1 LEU B 41 -6.962 8.697 -4.132 1.00 0.00 C ATOM 1888 CD2 LEU B 41 -8.974 9.894 -5.014 1.00 0.00 C ATOM 0 H LEU B 41 -5.565 10.044 -8.425 1.00 0.00 H new ATOM 0 HA LEU B 41 -5.298 8.184 -6.340 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -6.470 10.350 -6.182 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -7.692 9.791 -7.306 1.00 0.00 H new ATOM 0 HG LEU B 41 -8.279 7.978 -5.647 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -7.570 8.316 -3.311 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -6.188 7.970 -4.378 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -6.496 9.636 -3.833 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -9.554 9.497 -4.181 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -8.558 10.863 -4.737 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -9.621 10.012 -5.883 1.00 0.00 H new ATOM 1900 N ASP B 42 -7.430 7.336 -8.717 1.00 0.00 N ATOM 1901 CA ASP B 42 -8.172 6.213 -9.278 1.00 0.00 C ATOM 1902 C ASP B 42 -7.243 5.041 -9.574 1.00 0.00 C ATOM 1903 O ASP B 42 -7.619 3.881 -9.411 1.00 0.00 O ATOM 1904 CB ASP B 42 -8.896 6.641 -10.557 1.00 0.00 C ATOM 1905 CG ASP B 42 -9.966 5.651 -10.973 1.00 0.00 C ATOM 1906 OD1 ASP B 42 -9.829 4.455 -10.643 1.00 0.00 O ATOM 1907 OD2 ASP B 42 -10.942 6.074 -11.630 1.00 0.00 O ATOM 0 H ASP B 42 -7.487 8.195 -9.264 1.00 0.00 H new ATOM 0 HA ASP B 42 -8.909 5.892 -8.542 1.00 0.00 H new ATOM 0 HB2 ASP B 42 -9.350 7.620 -10.404 1.00 0.00 H new ATOM 0 HB3 ASP B 42 -8.171 6.748 -11.363 1.00 0.00 H new ATOM 1912 N ARG B 43 -6.027 5.352 -10.009 1.00 0.00 N ATOM 1913 CA ARG B 43 -5.042 4.324 -10.328 1.00 0.00 C ATOM 1914 C ARG B 43 -4.704 3.495 -9.092 1.00 0.00 C ATOM 1915 O ARG B 43 -4.565 2.275 -9.171 1.00 0.00 O ATOM 1916 CB ARG B 43 -3.771 4.961 -10.892 1.00 0.00 C ATOM 1917 CG ARG B 43 -4.011 5.792 -12.142 1.00 0.00 C ATOM 1918 CD ARG B 43 -2.746 5.920 -12.975 1.00 0.00 C ATOM 1919 NE ARG B 43 -2.828 7.023 -13.930 1.00 0.00 N ATOM 1920 CZ ARG B 43 -3.588 7.002 -15.023 1.00 0.00 C ATOM 1921 NH1 ARG B 43 -4.332 5.939 -15.302 1.00 0.00 N ATOM 1922 NH2 ARG B 43 -3.604 8.047 -15.839 1.00 0.00 N ATOM 0 H ARG B 43 -5.699 6.308 -10.149 1.00 0.00 H new ATOM 0 HA ARG B 43 -5.473 3.664 -11.081 1.00 0.00 H new ATOM 0 HB2 ARG B 43 -3.321 5.593 -10.127 1.00 0.00 H new ATOM 0 HB3 ARG B 43 -3.051 4.175 -11.121 1.00 0.00 H new ATOM 0 HG2 ARG B 43 -4.798 5.332 -12.741 1.00 0.00 H new ATOM 0 HG3 ARG B 43 -4.364 6.784 -11.859 1.00 0.00 H new ATOM 0 HD2 ARG B 43 -1.892 6.074 -12.316 1.00 0.00 H new ATOM 0 HD3 ARG B 43 -2.570 4.988 -13.512 1.00 0.00 H new ATOM 0 HE ARG B 43 -2.270 7.858 -13.749 1.00 0.00 H new ATOM 0 HH11 ARG B 43 -4.324 5.132 -14.678 1.00 0.00 H new ATOM 0 HH12 ARG B 43 -4.912 5.929 -16.141 1.00 0.00 H new ATOM 0 HH21 ARG B 43 -3.034 8.867 -15.629 1.00 0.00 H new ATOM 0 HH22 ARG B 43 -4.186 8.031 -16.676 1.00 0.00 H new ATOM 1936 N LEU B 44 -4.573 4.168 -7.953 1.00 0.00 N ATOM 1937 CA LEU B 44 -4.250 3.493 -6.701 1.00 0.00 C ATOM 1938 C LEU B 44 -5.435 2.669 -6.205 1.00 0.00 C ATOM 1939 O LEU B 44 -5.259 1.635 -5.562 1.00 0.00 O ATOM 1940 CB LEU B 44 -3.845 4.514 -5.636 1.00 0.00 C ATOM 1941 CG LEU B 44 -3.344 3.912 -4.322 1.00 0.00 C ATOM 1942 CD1 LEU B 44 -2.205 4.742 -3.751 1.00 0.00 C ATOM 1943 CD2 LEU B 44 -4.483 3.804 -3.319 1.00 0.00 C ATOM 0 H LEU B 44 -4.685 5.178 -7.871 1.00 0.00 H new ATOM 0 HA LEU B 44 -3.413 2.819 -6.887 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -3.064 5.154 -6.046 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -4.702 5.153 -5.422 1.00 0.00 H new ATOM 0 HG LEU B 44 -2.967 2.910 -4.525 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -1.863 4.297 -2.817 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -1.381 4.768 -4.464 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -2.554 5.757 -3.563 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -4.110 3.374 -2.390 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -4.890 4.796 -3.122 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -5.267 3.165 -3.726 1.00 0.00 H new ATOM 1955 N GLU B 45 -6.642 3.136 -6.508 1.00 0.00 N ATOM 1956 CA GLU B 45 -7.857 2.444 -6.092 1.00 0.00 C ATOM 1957 C GLU B 45 -7.893 1.023 -6.646 1.00 0.00 C ATOM 1958 O GLU B 45 -8.308 0.090 -5.960 1.00 0.00 O ATOM 1959 CB GLU B 45 -9.093 3.217 -6.557 1.00 0.00 C ATOM 1960 CG GLU B 45 -9.334 4.502 -5.781 1.00 0.00 C ATOM 1961 CD GLU B 45 -10.438 5.348 -6.384 1.00 0.00 C ATOM 1962 OE1 GLU B 45 -11.420 4.768 -6.893 1.00 0.00 O ATOM 1963 OE2 GLU B 45 -10.320 6.591 -6.348 1.00 0.00 O ATOM 0 H GLU B 45 -6.805 3.991 -7.040 1.00 0.00 H new ATOM 0 HA GLU B 45 -7.859 2.389 -5.003 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -8.985 3.456 -7.615 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -9.969 2.576 -6.463 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -9.591 4.257 -4.750 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -8.412 5.082 -5.751 1.00 0.00 H new ATOM 1970 N LYS B 46 -7.457 0.867 -7.893 1.00 0.00 N ATOM 1971 CA LYS B 46 -7.440 -0.440 -8.540 1.00 0.00 C ATOM 1972 C LYS B 46 -6.618 -1.441 -7.730 1.00 0.00 C ATOM 1973 O LYS B 46 -6.846 -2.649 -7.803 1.00 0.00 O ATOM 1974 CB LYS B 46 -6.871 -0.324 -9.955 1.00 0.00 C ATOM 1975 CG LYS B 46 -7.931 -0.088 -11.018 1.00 0.00 C ATOM 1976 CD LYS B 46 -8.372 1.366 -11.053 1.00 0.00 C ATOM 1977 CE LYS B 46 -7.441 2.212 -11.906 1.00 0.00 C ATOM 1978 NZ LYS B 46 -7.821 2.177 -13.345 1.00 0.00 N ATOM 0 H LYS B 46 -7.111 1.630 -8.475 1.00 0.00 H new ATOM 0 HA LYS B 46 -8.467 -0.802 -8.596 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -6.152 0.495 -9.983 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -6.325 -1.236 -10.194 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -7.539 -0.374 -11.994 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -8.793 -0.726 -10.822 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -9.386 1.430 -11.447 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -8.399 1.763 -10.038 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -7.459 3.242 -11.551 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -6.418 1.853 -11.792 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -7.162 2.766 -13.893 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -7.779 1.197 -13.691 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -8.788 2.543 -13.458 1.00 0.00 H new ATOM 1992 N LEU B 47 -5.661 -0.931 -6.961 1.00 0.00 N ATOM 1993 CA LEU B 47 -4.806 -1.780 -6.139 1.00 0.00 C ATOM 1994 C LEU B 47 -5.518 -2.196 -4.857 1.00 0.00 C ATOM 1995 O LEU B 47 -5.259 -3.269 -4.311 1.00 0.00 O ATOM 1996 CB LEU B 47 -3.505 -1.050 -5.798 1.00 0.00 C ATOM 1997 CG LEU B 47 -2.940 -0.173 -6.918 1.00 0.00 C ATOM 1998 CD1 LEU B 47 -1.615 0.441 -6.497 1.00 0.00 C ATOM 1999 CD2 LEU B 47 -2.774 -0.984 -8.194 1.00 0.00 C ATOM 0 H LEU B 47 -5.458 0.066 -6.890 1.00 0.00 H new ATOM 0 HA LEU B 47 -4.574 -2.678 -6.711 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -3.676 -0.426 -4.920 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -2.753 -1.789 -5.522 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.644 0.635 -7.114 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -1.228 1.061 -7.306 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.764 1.055 -5.609 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.901 -0.352 -6.274 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -2.371 -0.346 -8.981 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -2.089 -1.812 -8.012 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -3.743 -1.376 -8.505 1.00 0.00 H new ATOM 2011 N LEU B 48 -6.412 -1.338 -4.376 1.00 0.00 N ATOM 2012 CA LEU B 48 -7.158 -1.617 -3.154 1.00 0.00 C ATOM 2013 C LEU B 48 -8.496 -2.281 -3.464 1.00 0.00 C ATOM 2014 O LEU B 48 -9.051 -2.995 -2.629 1.00 0.00 O ATOM 2015 CB LEU B 48 -7.384 -0.325 -2.368 1.00 0.00 C ATOM 2016 CG LEU B 48 -6.122 0.292 -1.762 1.00 0.00 C ATOM 2017 CD1 LEU B 48 -6.260 1.804 -1.670 1.00 0.00 C ATOM 2018 CD2 LEU B 48 -5.839 -0.308 -0.392 1.00 0.00 C ATOM 0 H LEU B 48 -6.637 -0.444 -4.813 1.00 0.00 H new ATOM 0 HA LEU B 48 -6.569 -2.307 -2.549 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -7.848 0.408 -3.028 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -8.094 -0.525 -1.565 1.00 0.00 H new ATOM 0 HG LEU B 48 -5.279 0.065 -2.414 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -5.353 2.226 -1.237 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -6.412 2.217 -2.667 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -7.114 2.054 -1.040 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -4.938 0.143 0.024 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -6.681 -0.113 0.272 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -5.695 -1.384 -0.489 1.00 0.00 H new ATOM 2030 N ARG B 49 -9.011 -2.043 -4.667 1.00 0.00 N ATOM 2031 CA ARG B 49 -10.285 -2.622 -5.083 1.00 0.00 C ATOM 2032 C ARG B 49 -10.288 -4.135 -4.886 1.00 0.00 C ATOM 2033 O ARG B 49 -9.443 -4.844 -5.432 1.00 0.00 O ATOM 2034 CB ARG B 49 -10.567 -2.287 -6.548 1.00 0.00 C ATOM 2035 CG ARG B 49 -12.045 -2.300 -6.903 1.00 0.00 C ATOM 2036 CD ARG B 49 -12.379 -1.238 -7.937 1.00 0.00 C ATOM 2037 NE ARG B 49 -11.975 -1.637 -9.283 1.00 0.00 N ATOM 2038 CZ ARG B 49 -12.444 -1.077 -10.395 1.00 0.00 C ATOM 2039 NH1 ARG B 49 -13.334 -0.095 -10.327 1.00 0.00 N ATOM 2040 NH2 ARG B 49 -12.024 -1.500 -11.579 1.00 0.00 N ATOM 0 H ARG B 49 -8.566 -1.454 -5.371 1.00 0.00 H new ATOM 0 HA ARG B 49 -11.070 -2.192 -4.461 1.00 0.00 H new ATOM 0 HB2 ARG B 49 -10.157 -1.302 -6.772 1.00 0.00 H new ATOM 0 HB3 ARG B 49 -10.043 -3.002 -7.183 1.00 0.00 H new ATOM 0 HG2 ARG B 49 -12.319 -3.282 -7.287 1.00 0.00 H new ATOM 0 HG3 ARG B 49 -12.638 -2.133 -6.004 1.00 0.00 H new ATOM 0 HD2 ARG B 49 -13.451 -1.044 -7.923 1.00 0.00 H new ATOM 0 HD3 ARG B 49 -11.882 -0.305 -7.671 1.00 0.00 H new ATOM 0 HE ARG B 49 -11.293 -2.390 -9.376 1.00 0.00 H new ATOM 0 HH11 ARG B 49 -13.662 0.234 -9.419 1.00 0.00 H new ATOM 0 HH12 ARG B 49 -13.690 0.331 -11.183 1.00 0.00 H new ATOM 0 HH21 ARG B 49 -11.341 -2.255 -11.638 1.00 0.00 H new ATOM 0 HH22 ARG B 49 -12.384 -1.070 -12.431 1.00 0.00 H new ATOM 2054 N CYS B 50 -11.244 -4.623 -4.099 1.00 0.00 N ATOM 2055 CA CYS B 50 -11.357 -6.052 -3.827 1.00 0.00 C ATOM 2056 C CYS B 50 -11.473 -6.848 -5.123 1.00 0.00 C ATOM 2057 O CYS B 50 -12.000 -6.357 -6.121 1.00 0.00 O ATOM 2058 CB CYS B 50 -12.567 -6.330 -2.934 1.00 0.00 C ATOM 2059 SG CYS B 50 -12.686 -8.043 -2.365 1.00 0.00 S ATOM 0 H CYS B 50 -11.951 -4.049 -3.639 1.00 0.00 H new ATOM 0 HA CYS B 50 -10.452 -6.368 -3.309 1.00 0.00 H new ATOM 0 HB2 CYS B 50 -12.523 -5.672 -2.066 1.00 0.00 H new ATOM 0 HB3 CYS B 50 -13.475 -6.076 -3.481 1.00 0.00 H new ATOM 0 HG CYS B 50 -13.889 -8.272 -1.928 1.00 0.00 H new ATOM 2064 N SER B 51 -10.976 -8.081 -5.099 1.00 0.00 N ATOM 2065 CA SER B 51 -11.024 -8.946 -6.272 1.00 0.00 C ATOM 2066 C SER B 51 -12.430 -9.499 -6.488 1.00 0.00 C ATOM 2067 O SER B 51 -12.835 -9.766 -7.618 1.00 0.00 O ATOM 2068 CB SER B 51 -10.028 -10.097 -6.122 1.00 0.00 C ATOM 2069 OG SER B 51 -9.398 -10.393 -7.357 1.00 0.00 O ATOM 0 H SER B 51 -10.536 -8.503 -4.281 1.00 0.00 H new ATOM 0 HA SER B 51 -10.753 -8.349 -7.143 1.00 0.00 H new ATOM 0 HB2 SER B 51 -9.274 -9.835 -5.380 1.00 0.00 H new ATOM 0 HB3 SER B 51 -10.545 -10.983 -5.753 1.00 0.00 H new ATOM 0 HG SER B 51 -8.765 -11.131 -7.233 1.00 0.00 H new ATOM 2075 N ARG B 52 -13.169 -9.668 -5.396 1.00 0.00 N ATOM 2076 CA ARG B 52 -14.529 -10.190 -5.469 1.00 0.00 C ATOM 2077 C ARG B 52 -15.548 -9.056 -5.435 1.00 0.00 C ATOM 2078 O ARG B 52 -16.347 -8.897 -6.358 1.00 0.00 O ATOM 2079 CB ARG B 52 -14.786 -11.162 -4.314 1.00 0.00 C ATOM 2080 CG ARG B 52 -14.892 -12.614 -4.754 1.00 0.00 C ATOM 2081 CD ARG B 52 -13.580 -13.353 -4.554 1.00 0.00 C ATOM 2082 NE ARG B 52 -13.602 -14.683 -5.161 1.00 0.00 N ATOM 2083 CZ ARG B 52 -12.752 -15.657 -4.844 1.00 0.00 C ATOM 2084 NH1 ARG B 52 -11.812 -15.455 -3.929 1.00 0.00 N ATOM 2085 NH2 ARG B 52 -12.843 -16.837 -5.444 1.00 0.00 N ATOM 0 H ARG B 52 -12.850 -9.452 -4.452 1.00 0.00 H new ATOM 0 HA ARG B 52 -14.639 -10.723 -6.413 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -13.980 -11.069 -3.586 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -15.708 -10.876 -3.807 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -15.680 -13.110 -4.188 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -15.179 -12.657 -5.805 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -12.766 -12.771 -4.986 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -13.375 -13.445 -3.487 1.00 0.00 H new ATOM 0 HE ARG B 52 -14.310 -14.876 -5.869 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -11.738 -14.550 -3.465 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -11.163 -16.205 -3.690 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -13.564 -16.997 -6.148 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -12.192 -17.584 -5.202 1.00 0.00 H new ATOM 2099 N CYS B 53 -15.515 -8.269 -4.365 1.00 0.00 N ATOM 2100 CA CYS B 53 -16.433 -7.147 -4.208 1.00 0.00 C ATOM 2101 C CYS B 53 -16.209 -6.091 -5.289 1.00 0.00 C ATOM 2102 O CYS B 53 -17.063 -5.233 -5.512 1.00 0.00 O ATOM 2103 CB CYS B 53 -16.269 -6.517 -2.824 1.00 0.00 C ATOM 2104 SG CYS B 53 -16.211 -7.716 -1.470 1.00 0.00 S ATOM 0 H CYS B 53 -14.861 -8.388 -3.592 1.00 0.00 H new ATOM 0 HA CYS B 53 -17.448 -7.530 -4.311 1.00 0.00 H new ATOM 0 HB2 CYS B 53 -15.353 -5.926 -2.812 1.00 0.00 H new ATOM 0 HB3 CYS B 53 -17.095 -5.828 -2.650 1.00 0.00 H new ATOM 0 HG CYS B 53 -15.534 -7.218 -0.478 1.00 0.00 H new ATOM 2109 N THR B 54 -15.055 -6.157 -5.955 1.00 0.00 N ATOM 2110 CA THR B 54 -14.714 -5.207 -7.013 1.00 0.00 C ATOM 2111 C THR B 54 -15.045 -3.773 -6.602 1.00 0.00 C ATOM 2112 O THR B 54 -15.621 -3.009 -7.378 1.00 0.00 O ATOM 2113 CB THR B 54 -15.446 -5.565 -8.310 1.00 0.00 C ATOM 2114 OG1 THR B 54 -15.080 -4.679 -9.353 1.00 0.00 O ATOM 2115 CG2 THR B 54 -16.954 -5.524 -8.182 1.00 0.00 C ATOM 0 H THR B 54 -14.339 -6.862 -5.779 1.00 0.00 H new ATOM 0 HA THR B 54 -13.639 -5.271 -7.182 1.00 0.00 H new ATOM 0 HB THR B 54 -15.146 -6.588 -8.535 1.00 0.00 H new ATOM 0 HG1 THR B 54 -15.319 -3.762 -9.103 1.00 0.00 H new ATOM 0 HG21 THR B 54 -17.408 -5.788 -9.137 1.00 0.00 H new ATOM 0 HG22 THR B 54 -17.274 -6.234 -7.420 1.00 0.00 H new ATOM 0 HG23 THR B 54 -17.268 -4.520 -7.897 1.00 0.00 H new ATOM 2123 N ASN B 55 -14.675 -3.417 -5.377 1.00 0.00 N ATOM 2124 CA ASN B 55 -14.929 -2.079 -4.858 1.00 0.00 C ATOM 2125 C ASN B 55 -13.968 -1.747 -3.722 1.00 0.00 C ATOM 2126 O ASN B 55 -13.034 -2.500 -3.445 1.00 0.00 O ATOM 2127 CB ASN B 55 -16.375 -1.963 -4.371 1.00 0.00 C ATOM 2128 CG ASN B 55 -16.986 -0.612 -4.688 1.00 0.00 C ATOM 2129 OD1 ASN B 55 -16.300 0.410 -4.679 1.00 0.00 O ATOM 2130 ND2 ASN B 55 -18.283 -0.601 -4.972 1.00 0.00 N ATOM 0 H ASN B 55 -14.197 -4.038 -4.724 1.00 0.00 H new ATOM 0 HA ASN B 55 -14.769 -1.365 -5.666 1.00 0.00 H new ATOM 0 HB2 ASN B 55 -16.975 -2.747 -4.833 1.00 0.00 H new ATOM 0 HB3 ASN B 55 -16.407 -2.129 -3.294 1.00 0.00 H new ATOM 0 HD21 ASN B 55 -18.749 0.279 -5.194 1.00 0.00 H new ATOM 0 HD22 ASN B 55 -18.813 -1.472 -4.968 1.00 0.00 H new ATOM 2137 N ILE B 56 -14.203 -0.616 -3.064 1.00 0.00 N ATOM 2138 CA ILE B 56 -13.358 -0.187 -1.957 1.00 0.00 C ATOM 2139 C ILE B 56 -13.519 -1.112 -0.755 1.00 0.00 C ATOM 2140 O ILE B 56 -14.636 -1.382 -0.313 1.00 0.00 O ATOM 2141 CB ILE B 56 -13.682 1.256 -1.528 1.00 0.00 C ATOM 2142 CG1 ILE B 56 -13.703 2.183 -2.746 1.00 0.00 C ATOM 2143 CG2 ILE B 56 -12.669 1.746 -0.502 1.00 0.00 C ATOM 2144 CD1 ILE B 56 -12.409 2.181 -3.530 1.00 0.00 C ATOM 0 H ILE B 56 -14.972 0.019 -3.279 1.00 0.00 H new ATOM 0 HA ILE B 56 -12.328 -0.229 -2.310 1.00 0.00 H new ATOM 0 HB ILE B 56 -14.670 1.267 -1.069 1.00 0.00 H new ATOM 0 HG12 ILE B 56 -14.518 1.885 -3.405 1.00 0.00 H new ATOM 0 HG13 ILE B 56 -13.916 3.199 -2.415 1.00 0.00 H new ATOM 0 HG21 ILE B 56 -12.912 2.767 -0.209 1.00 0.00 H new ATOM 0 HG22 ILE B 56 -12.699 1.100 0.376 1.00 0.00 H new ATOM 0 HG23 ILE B 56 -11.670 1.722 -0.937 1.00 0.00 H new ATOM 0 HD11 ILE B 56 -12.496 2.860 -4.378 1.00 0.00 H new ATOM 0 HD12 ILE B 56 -11.593 2.508 -2.886 1.00 0.00 H new ATOM 0 HD13 ILE B 56 -12.204 1.173 -3.891 1.00 0.00 H new ATOM 2156 N LEU B 57 -12.396 -1.592 -0.229 1.00 0.00 N ATOM 2157 CA LEU B 57 -12.414 -2.487 0.924 1.00 0.00 C ATOM 2158 C LEU B 57 -11.813 -1.805 2.148 1.00 0.00 C ATOM 2159 O LEU B 57 -10.959 -0.927 2.025 1.00 0.00 O ATOM 2160 CB LEU B 57 -11.649 -3.778 0.616 1.00 0.00 C ATOM 2161 CG LEU B 57 -10.508 -3.641 -0.396 1.00 0.00 C ATOM 2162 CD1 LEU B 57 -9.342 -2.878 0.212 1.00 0.00 C ATOM 2163 CD2 LEU B 57 -10.056 -5.012 -0.879 1.00 0.00 C ATOM 0 H LEU B 57 -11.463 -1.377 -0.582 1.00 0.00 H new ATOM 0 HA LEU B 57 -13.453 -2.737 1.140 1.00 0.00 H new ATOM 0 HB2 LEU B 57 -11.240 -4.169 1.548 1.00 0.00 H new ATOM 0 HB3 LEU B 57 -12.356 -4.519 0.242 1.00 0.00 H new ATOM 0 HG LEU B 57 -10.876 -3.078 -1.254 1.00 0.00 H new ATOM 0 HD11 LEU B 57 -8.541 -2.791 -0.523 1.00 0.00 H new ATOM 0 HD12 LEU B 57 -9.673 -1.882 0.507 1.00 0.00 H new ATOM 0 HD13 LEU B 57 -8.974 -3.413 1.088 1.00 0.00 H new ATOM 0 HD21 LEU B 57 -9.245 -4.895 -1.598 1.00 0.00 H new ATOM 0 HD22 LEU B 57 -9.707 -5.600 -0.030 1.00 0.00 H new ATOM 0 HD23 LEU B 57 -10.892 -5.524 -1.356 1.00 0.00 H new ATOM 2175 N ARG B 58 -12.264 -2.215 3.329 1.00 0.00 N ATOM 2176 CA ARG B 58 -11.771 -1.644 4.577 1.00 0.00 C ATOM 2177 C ARG B 58 -11.307 -2.742 5.529 1.00 0.00 C ATOM 2178 O ARG B 58 -12.090 -3.605 5.924 1.00 0.00 O ATOM 2179 CB ARG B 58 -12.860 -0.801 5.243 1.00 0.00 C ATOM 2180 CG ARG B 58 -14.198 -1.514 5.354 1.00 0.00 C ATOM 2181 CD ARG B 58 -15.201 -0.693 6.147 1.00 0.00 C ATOM 2182 NE ARG B 58 -16.074 -1.534 6.962 1.00 0.00 N ATOM 2183 CZ ARG B 58 -17.077 -2.258 6.470 1.00 0.00 C ATOM 2184 NH1 ARG B 58 -17.337 -2.246 5.169 1.00 0.00 N ATOM 2185 NH2 ARG B 58 -17.822 -2.997 7.282 1.00 0.00 N ATOM 0 H ARG B 58 -12.971 -2.941 3.448 1.00 0.00 H new ATOM 0 HA ARG B 58 -10.920 -1.004 4.345 1.00 0.00 H new ATOM 0 HB2 ARG B 58 -12.527 -0.514 6.240 1.00 0.00 H new ATOM 0 HB3 ARG B 58 -12.994 0.119 4.675 1.00 0.00 H new ATOM 0 HG2 ARG B 58 -14.592 -1.708 4.356 1.00 0.00 H new ATOM 0 HG3 ARG B 58 -14.057 -2.482 5.835 1.00 0.00 H new ATOM 0 HD2 ARG B 58 -14.668 0.007 6.790 1.00 0.00 H new ATOM 0 HD3 ARG B 58 -15.806 -0.099 5.462 1.00 0.00 H new ATOM 0 HE ARG B 58 -15.905 -1.569 7.967 1.00 0.00 H new ATOM 0 HH11 ARG B 58 -16.767 -1.680 4.540 1.00 0.00 H new ATOM 0 HH12 ARG B 58 -18.107 -2.803 4.798 1.00 0.00 H new ATOM 0 HH21 ARG B 58 -17.626 -3.010 8.283 1.00 0.00 H new ATOM 0 HH22 ARG B 58 -18.591 -3.552 6.905 1.00 0.00 H new ATOM 2199 N GLU B 59 -10.028 -2.704 5.891 1.00 0.00 N ATOM 2200 CA GLU B 59 -9.462 -3.698 6.795 1.00 0.00 C ATOM 2201 C GLU B 59 -9.619 -5.105 6.218 1.00 0.00 C ATOM 2202 O GLU B 59 -10.165 -5.995 6.870 1.00 0.00 O ATOM 2203 CB GLU B 59 -10.133 -3.614 8.167 1.00 0.00 C ATOM 2204 CG GLU B 59 -9.283 -4.171 9.295 1.00 0.00 C ATOM 2205 CD GLU B 59 -9.718 -3.663 10.657 1.00 0.00 C ATOM 2206 OE1 GLU B 59 -9.605 -2.444 10.900 1.00 0.00 O ATOM 2207 OE2 GLU B 59 -10.169 -4.486 11.481 1.00 0.00 O ATOM 0 H GLU B 59 -9.366 -1.997 5.573 1.00 0.00 H new ATOM 0 HA GLU B 59 -8.399 -3.488 6.910 1.00 0.00 H new ATOM 0 HB2 GLU B 59 -10.371 -2.572 8.383 1.00 0.00 H new ATOM 0 HB3 GLU B 59 -11.078 -4.156 8.134 1.00 0.00 H new ATOM 0 HG2 GLU B 59 -9.337 -5.260 9.283 1.00 0.00 H new ATOM 0 HG3 GLU B 59 -8.240 -3.902 9.127 1.00 0.00 H new ATOM 2214 N PRO B 60 -9.140 -5.321 4.981 1.00 0.00 N ATOM 2215 CA PRO B 60 -9.230 -6.625 4.315 1.00 0.00 C ATOM 2216 C PRO B 60 -8.368 -7.683 4.993 1.00 0.00 C ATOM 2217 O PRO B 60 -7.656 -7.396 5.955 1.00 0.00 O ATOM 2218 CB PRO B 60 -8.717 -6.342 2.901 1.00 0.00 C ATOM 2219 CG PRO B 60 -7.855 -5.137 3.041 1.00 0.00 C ATOM 2220 CD PRO B 60 -8.474 -4.314 4.135 1.00 0.00 C ATOM 0 HA PRO B 60 -10.244 -7.025 4.341 1.00 0.00 H new ATOM 0 HB2 PRO B 60 -8.153 -7.188 2.509 1.00 0.00 H new ATOM 0 HB3 PRO B 60 -9.541 -6.161 2.211 1.00 0.00 H new ATOM 0 HG2 PRO B 60 -6.832 -5.416 3.293 1.00 0.00 H new ATOM 0 HG3 PRO B 60 -7.812 -4.577 2.107 1.00 0.00 H new ATOM 0 HD2 PRO B 60 -7.722 -3.754 4.692 1.00 0.00 H new ATOM 0 HD3 PRO B 60 -9.184 -3.588 3.739 1.00 0.00 H new ATOM 2228 N VAL B 61 -8.440 -8.909 4.484 1.00 0.00 N ATOM 2229 CA VAL B 61 -7.667 -10.014 5.038 1.00 0.00 C ATOM 2230 C VAL B 61 -6.811 -10.677 3.964 1.00 0.00 C ATOM 2231 O VAL B 61 -7.204 -10.747 2.799 1.00 0.00 O ATOM 2232 CB VAL B 61 -8.585 -11.074 5.677 1.00 0.00 C ATOM 2233 CG1 VAL B 61 -7.761 -12.152 6.367 1.00 0.00 C ATOM 2234 CG2 VAL B 61 -9.551 -10.423 6.654 1.00 0.00 C ATOM 0 H VAL B 61 -9.026 -9.162 3.688 1.00 0.00 H new ATOM 0 HA VAL B 61 -7.018 -9.595 5.807 1.00 0.00 H new ATOM 0 HB VAL B 61 -9.167 -11.547 4.886 1.00 0.00 H new ATOM 0 HG11 VAL B 61 -8.428 -12.891 6.812 1.00 0.00 H new ATOM 0 HG12 VAL B 61 -7.115 -12.639 5.637 1.00 0.00 H new ATOM 0 HG13 VAL B 61 -7.149 -11.699 7.147 1.00 0.00 H new ATOM 0 HG21 VAL B 61 -10.191 -11.186 7.096 1.00 0.00 H new ATOM 0 HG22 VAL B 61 -8.989 -9.921 7.441 1.00 0.00 H new ATOM 0 HG23 VAL B 61 -10.166 -9.694 6.126 1.00 0.00 H new ATOM 2244 N CYS B 62 -5.642 -11.166 4.364 1.00 0.00 N ATOM 2245 CA CYS B 62 -4.732 -11.825 3.436 1.00 0.00 C ATOM 2246 C CYS B 62 -5.203 -13.244 3.133 1.00 0.00 C ATOM 2247 O CYS B 62 -5.578 -13.990 4.037 1.00 0.00 O ATOM 2248 CB CYS B 62 -3.316 -11.858 4.014 1.00 0.00 C ATOM 2249 SG CYS B 62 -3.168 -12.794 5.554 1.00 0.00 S ATOM 0 H CYS B 62 -5.303 -11.118 5.325 1.00 0.00 H new ATOM 0 HA CYS B 62 -4.723 -11.256 2.506 1.00 0.00 H new ATOM 0 HB2 CYS B 62 -2.643 -12.289 3.273 1.00 0.00 H new ATOM 0 HB3 CYS B 62 -2.983 -10.835 4.190 1.00 0.00 H new ATOM 0 HG CYS B 62 -4.162 -13.626 5.653 1.00 0.00 H new ATOM 2255 N LEU B 63 -5.182 -13.609 1.855 1.00 0.00 N ATOM 2256 CA LEU B 63 -5.609 -14.937 1.433 1.00 0.00 C ATOM 2257 C LEU B 63 -4.777 -16.020 2.113 1.00 0.00 C ATOM 2258 O LEU B 63 -5.313 -16.881 2.812 1.00 0.00 O ATOM 2259 CB LEU B 63 -5.500 -15.073 -0.086 1.00 0.00 C ATOM 2260 CG LEU B 63 -6.413 -16.130 -0.710 1.00 0.00 C ATOM 2261 CD1 LEU B 63 -6.123 -17.501 -0.120 1.00 0.00 C ATOM 2262 CD2 LEU B 63 -7.873 -15.757 -0.504 1.00 0.00 C ATOM 0 H LEU B 63 -4.874 -13.003 1.094 1.00 0.00 H new ATOM 0 HA LEU B 63 -6.650 -15.066 1.729 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -5.725 -14.107 -0.539 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -4.467 -15.311 -0.341 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.215 -16.170 -1.781 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -6.782 -18.240 -0.576 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.085 -17.770 -0.317 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -6.294 -17.477 0.956 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -8.510 -16.519 -0.954 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -8.084 -15.691 0.563 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -8.072 -14.794 -0.974 1.00 0.00 H new ATOM 2274 N GLY B 64 -3.466 -15.971 1.903 1.00 0.00 N ATOM 2275 CA GLY B 64 -2.583 -16.954 2.503 1.00 0.00 C ATOM 2276 C GLY B 64 -1.160 -16.844 1.993 1.00 0.00 C ATOM 2277 O GLY B 64 -0.249 -16.498 2.746 1.00 0.00 O ATOM 0 H GLY B 64 -2.999 -15.269 1.329 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -2.588 -16.829 3.586 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -2.964 -17.954 2.296 1.00 0.00 H new ATOM 2281 N GLY B 65 -0.967 -17.138 0.711 1.00 0.00 N ATOM 2282 CA GLY B 65 0.358 -17.065 0.126 1.00 0.00 C ATOM 2283 C GLY B 65 0.321 -16.897 -1.380 1.00 0.00 C ATOM 2284 O GLY B 65 1.111 -17.509 -2.099 1.00 0.00 O ATOM 0 H GLY B 65 -1.705 -17.425 0.068 1.00 0.00 H new ATOM 0 HA2 GLY B 65 0.901 -16.230 0.568 1.00 0.00 H new ATOM 0 HA3 GLY B 65 0.911 -17.971 0.373 1.00 0.00 H new ATOM 2288 N CYS B 66 -0.597 -16.064 -1.860 1.00 0.00 N ATOM 2289 CA CYS B 66 -0.732 -15.816 -3.287 1.00 0.00 C ATOM 2290 C CYS B 66 -0.598 -14.319 -3.582 1.00 0.00 C ATOM 2291 O CYS B 66 0.160 -13.617 -2.913 1.00 0.00 O ATOM 2292 CB CYS B 66 -2.074 -16.364 -3.788 1.00 0.00 C ATOM 2293 SG CYS B 66 -3.519 -15.443 -3.208 1.00 0.00 S ATOM 0 H CYS B 66 -1.259 -15.550 -1.279 1.00 0.00 H new ATOM 0 HA CYS B 66 0.067 -16.333 -3.818 1.00 0.00 H new ATOM 0 HB2 CYS B 66 -2.070 -16.361 -4.878 1.00 0.00 H new ATOM 0 HB3 CYS B 66 -2.169 -17.403 -3.472 1.00 0.00 H new ATOM 0 HG CYS B 66 -4.599 -15.984 -3.688 1.00 0.00 H new ATOM 2298 N GLU B 67 -1.329 -13.832 -4.581 1.00 0.00 N ATOM 2299 CA GLU B 67 -1.274 -12.421 -4.947 1.00 0.00 C ATOM 2300 C GLU B 67 -2.676 -11.833 -5.078 1.00 0.00 C ATOM 2301 O GLU B 67 -2.958 -11.074 -6.005 1.00 0.00 O ATOM 2302 CB GLU B 67 -0.510 -12.245 -6.261 1.00 0.00 C ATOM 2303 CG GLU B 67 -1.188 -12.900 -7.453 1.00 0.00 C ATOM 2304 CD GLU B 67 -0.515 -14.194 -7.868 1.00 0.00 C ATOM 2305 OE1 GLU B 67 -0.652 -15.195 -7.134 1.00 0.00 O ATOM 2306 OE2 GLU B 67 0.148 -14.205 -8.926 1.00 0.00 O ATOM 0 H GLU B 67 -1.964 -14.392 -5.150 1.00 0.00 H new ATOM 0 HA GLU B 67 -0.751 -11.887 -4.154 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -0.390 -11.180 -6.462 1.00 0.00 H new ATOM 0 HB3 GLU B 67 0.490 -12.663 -6.148 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -2.231 -13.100 -7.208 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -1.185 -12.207 -8.294 1.00 0.00 H new ATOM 2313 N HIS B 68 -3.551 -12.187 -4.142 1.00 0.00 N ATOM 2314 CA HIS B 68 -4.923 -11.692 -4.155 1.00 0.00 C ATOM 2315 C HIS B 68 -5.358 -11.253 -2.760 1.00 0.00 C ATOM 2316 O HIS B 68 -5.081 -11.931 -1.770 1.00 0.00 O ATOM 2317 CB HIS B 68 -5.871 -12.769 -4.683 1.00 0.00 C ATOM 2318 CG HIS B 68 -5.829 -12.923 -6.171 1.00 0.00 C ATOM 2319 ND1 HIS B 68 -6.162 -14.109 -6.778 1.00 0.00 N ATOM 2320 CD2 HIS B 68 -5.486 -12.020 -7.121 1.00 0.00 C ATOM 2321 CE1 HIS B 68 -6.016 -13.904 -8.076 1.00 0.00 C ATOM 2322 NE2 HIS B 68 -5.607 -12.652 -8.332 1.00 0.00 N ATOM 0 H HIS B 68 -3.335 -12.813 -3.367 1.00 0.00 H new ATOM 0 HA HIS B 68 -4.964 -10.827 -4.816 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -5.619 -13.723 -4.220 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -6.889 -12.526 -4.379 1.00 0.00 H new ATOM 0 HD1 HIS B 68 -6.461 -14.971 -6.321 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -5.177 -10.998 -6.956 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -6.202 -14.650 -8.834 1.00 0.00 H new ATOM 2330 N ILE B 69 -6.042 -10.116 -2.691 1.00 0.00 N ATOM 2331 CA ILE B 69 -6.518 -9.585 -1.418 1.00 0.00 C ATOM 2332 C ILE B 69 -8.018 -9.317 -1.464 1.00 0.00 C ATOM 2333 O ILE B 69 -8.546 -8.856 -2.475 1.00 0.00 O ATOM 2334 CB ILE B 69 -5.789 -8.281 -1.042 1.00 0.00 C ATOM 2335 CG1 ILE B 69 -4.283 -8.426 -1.266 1.00 0.00 C ATOM 2336 CG2 ILE B 69 -6.081 -7.910 0.405 1.00 0.00 C ATOM 2337 CD1 ILE B 69 -3.825 -7.944 -2.625 1.00 0.00 C ATOM 0 H ILE B 69 -6.279 -9.544 -3.501 1.00 0.00 H new ATOM 0 HA ILE B 69 -6.306 -10.341 -0.662 1.00 0.00 H new ATOM 0 HB ILE B 69 -6.156 -7.481 -1.685 1.00 0.00 H new ATOM 0 HG12 ILE B 69 -3.754 -7.868 -0.494 1.00 0.00 H new ATOM 0 HG13 ILE B 69 -4.006 -9.474 -1.149 1.00 0.00 H new ATOM 0 HG21 ILE B 69 -5.559 -6.987 0.656 1.00 0.00 H new ATOM 0 HG22 ILE B 69 -7.154 -7.767 0.535 1.00 0.00 H new ATOM 0 HG23 ILE B 69 -5.739 -8.710 1.062 1.00 0.00 H new ATOM 0 HD11 ILE B 69 -2.747 -8.077 -2.714 1.00 0.00 H new ATOM 0 HD12 ILE B 69 -4.327 -8.519 -3.403 1.00 0.00 H new ATOM 0 HD13 ILE B 69 -4.071 -6.888 -2.738 1.00 0.00 H new ATOM 2349 N PHE B 70 -8.701 -9.609 -0.362 1.00 0.00 N ATOM 2350 CA PHE B 70 -10.143 -9.398 -0.278 1.00 0.00 C ATOM 2351 C PHE B 70 -10.528 -8.832 1.084 1.00 0.00 C ATOM 2352 O PHE B 70 -9.697 -8.735 1.986 1.00 0.00 O ATOM 2353 CB PHE B 70 -10.894 -10.709 -0.523 1.00 0.00 C ATOM 2354 CG PHE B 70 -10.268 -11.584 -1.574 1.00 0.00 C ATOM 2355 CD1 PHE B 70 -9.078 -12.247 -1.323 1.00 0.00 C ATOM 2356 CD2 PHE B 70 -10.872 -11.743 -2.810 1.00 0.00 C ATOM 2357 CE1 PHE B 70 -8.502 -13.053 -2.287 1.00 0.00 C ATOM 2358 CE2 PHE B 70 -10.301 -12.547 -3.778 1.00 0.00 C ATOM 2359 CZ PHE B 70 -9.114 -13.202 -3.516 1.00 0.00 C ATOM 0 H PHE B 70 -8.280 -9.992 0.485 1.00 0.00 H new ATOM 0 HA PHE B 70 -10.422 -8.680 -1.049 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -10.949 -11.265 0.413 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -11.918 -10.480 -0.818 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -8.595 -12.133 -0.364 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -11.800 -11.233 -3.020 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -7.574 -13.566 -2.079 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -10.782 -12.663 -4.738 1.00 0.00 H new ATOM 0 HZ PHE B 70 -8.665 -13.830 -4.271 1.00 0.00 H new ATOM 2369 N CYS B 71 -11.797 -8.463 1.228 1.00 0.00 N ATOM 2370 CA CYS B 71 -12.294 -7.910 2.482 1.00 0.00 C ATOM 2371 C CYS B 71 -12.166 -8.929 3.609 1.00 0.00 C ATOM 2372 O CYS B 71 -11.630 -10.021 3.413 1.00 0.00 O ATOM 2373 CB CYS B 71 -13.755 -7.479 2.332 1.00 0.00 C ATOM 2374 SG CYS B 71 -14.089 -6.513 0.841 1.00 0.00 S ATOM 0 H CYS B 71 -12.499 -8.537 0.492 1.00 0.00 H new ATOM 0 HA CYS B 71 -11.691 -7.037 2.732 1.00 0.00 H new ATOM 0 HB2 CYS B 71 -14.386 -8.368 2.325 1.00 0.00 H new ATOM 0 HB3 CYS B 71 -14.041 -6.891 3.204 1.00 0.00 H new ATOM 0 HG CYS B 71 -13.608 -7.134 -0.195 1.00 0.00 H new ATOM 2379 N SER B 72 -12.658 -8.568 4.789 1.00 0.00 N ATOM 2380 CA SER B 72 -12.596 -9.454 5.946 1.00 0.00 C ATOM 2381 C SER B 72 -13.944 -10.122 6.200 1.00 0.00 C ATOM 2382 O SER B 72 -14.257 -10.497 7.330 1.00 0.00 O ATOM 2383 CB SER B 72 -12.158 -8.674 7.186 1.00 0.00 C ATOM 2384 OG SER B 72 -13.206 -7.850 7.666 1.00 0.00 O ATOM 0 H SER B 72 -13.104 -7.669 4.970 1.00 0.00 H new ATOM 0 HA SER B 72 -11.863 -10.233 5.735 1.00 0.00 H new ATOM 0 HB2 SER B 72 -11.851 -9.369 7.967 1.00 0.00 H new ATOM 0 HB3 SER B 72 -11.290 -8.061 6.946 1.00 0.00 H new ATOM 0 HG SER B 72 -12.902 -7.363 8.460 1.00 0.00 H new ATOM 2390 N ASN B 73 -14.740 -10.268 5.144 1.00 0.00 N ATOM 2391 CA ASN B 73 -16.054 -10.892 5.262 1.00 0.00 C ATOM 2392 C ASN B 73 -16.439 -11.631 3.981 1.00 0.00 C ATOM 2393 O ASN B 73 -17.611 -11.938 3.763 1.00 0.00 O ATOM 2394 CB ASN B 73 -17.110 -9.836 5.588 1.00 0.00 C ATOM 2395 CG ASN B 73 -18.084 -10.299 6.654 1.00 0.00 C ATOM 2396 OD1 ASN B 73 -18.175 -11.490 6.951 1.00 0.00 O ATOM 2397 ND2 ASN B 73 -18.818 -9.358 7.234 1.00 0.00 N ATOM 0 H ASN B 73 -14.499 -9.964 4.201 1.00 0.00 H new ATOM 0 HA ASN B 73 -16.005 -11.620 6.072 1.00 0.00 H new ATOM 0 HB2 ASN B 73 -16.616 -8.924 5.923 1.00 0.00 H new ATOM 0 HB3 ASN B 73 -17.661 -9.585 4.681 1.00 0.00 H new ATOM 0 HD21 ASN B 73 -19.491 -9.610 7.958 1.00 0.00 H new ATOM 0 HD22 ASN B 73 -18.709 -8.383 6.956 1.00 0.00 H new ATOM 2404 N CYS B 74 -15.452 -11.913 3.136 1.00 0.00 N ATOM 2405 CA CYS B 74 -15.699 -12.612 1.882 1.00 0.00 C ATOM 2406 C CYS B 74 -14.690 -13.738 1.674 1.00 0.00 C ATOM 2407 O CYS B 74 -15.055 -14.849 1.290 1.00 0.00 O ATOM 2408 CB CYS B 74 -15.634 -11.631 0.712 1.00 0.00 C ATOM 2409 SG CYS B 74 -14.169 -10.571 0.715 1.00 0.00 S ATOM 0 H CYS B 74 -14.475 -11.668 3.298 1.00 0.00 H new ATOM 0 HA CYS B 74 -16.696 -13.050 1.929 1.00 0.00 H new ATOM 0 HB2 CYS B 74 -15.660 -12.194 -0.221 1.00 0.00 H new ATOM 0 HB3 CYS B 74 -16.524 -11.002 0.730 1.00 0.00 H new ATOM 0 HG CYS B 74 -14.205 -9.778 -0.315 1.00 0.00 H new ATOM 2414 N VAL B 75 -13.420 -13.442 1.929 1.00 0.00 N ATOM 2415 CA VAL B 75 -12.358 -14.428 1.769 1.00 0.00 C ATOM 2416 C VAL B 75 -12.548 -15.604 2.722 1.00 0.00 C ATOM 2417 O VAL B 75 -12.168 -16.734 2.414 1.00 0.00 O ATOM 2418 CB VAL B 75 -10.972 -13.800 2.010 1.00 0.00 C ATOM 2419 CG1 VAL B 75 -10.858 -13.278 3.435 1.00 0.00 C ATOM 2420 CG2 VAL B 75 -9.867 -14.802 1.709 1.00 0.00 C ATOM 0 H VAL B 75 -13.101 -12.527 2.247 1.00 0.00 H new ATOM 0 HA VAL B 75 -12.412 -14.789 0.742 1.00 0.00 H new ATOM 0 HB VAL B 75 -10.857 -12.956 1.330 1.00 0.00 H new ATOM 0 HG11 VAL B 75 -9.872 -12.839 3.584 1.00 0.00 H new ATOM 0 HG12 VAL B 75 -11.622 -12.520 3.607 1.00 0.00 H new ATOM 0 HG13 VAL B 75 -10.998 -14.101 4.136 1.00 0.00 H new ATOM 0 HG21 VAL B 75 -8.897 -14.338 1.886 1.00 0.00 H new ATOM 0 HG22 VAL B 75 -9.977 -15.671 2.358 1.00 0.00 H new ATOM 0 HG23 VAL B 75 -9.935 -15.116 0.667 1.00 0.00 H new ATOM 2430 N SER B 76 -13.138 -15.329 3.883 1.00 0.00 N ATOM 2431 CA SER B 76 -13.377 -16.363 4.885 1.00 0.00 C ATOM 2432 C SER B 76 -14.123 -17.550 4.282 1.00 0.00 C ATOM 2433 O SER B 76 -13.948 -18.690 4.714 1.00 0.00 O ATOM 2434 CB SER B 76 -14.172 -15.789 6.059 1.00 0.00 C ATOM 2435 OG SER B 76 -13.482 -14.709 6.664 1.00 0.00 O ATOM 0 H SER B 76 -13.459 -14.399 4.152 1.00 0.00 H new ATOM 0 HA SER B 76 -12.410 -16.713 5.245 1.00 0.00 H new ATOM 0 HB2 SER B 76 -15.148 -15.451 5.711 1.00 0.00 H new ATOM 0 HB3 SER B 76 -14.350 -16.570 6.798 1.00 0.00 H new ATOM 0 HG SER B 76 -14.012 -14.359 7.410 1.00 0.00 H new ATOM 2441 N ASP B 77 -14.955 -17.276 3.282 1.00 0.00 N ATOM 2442 CA ASP B 77 -15.726 -18.323 2.620 1.00 0.00 C ATOM 2443 C ASP B 77 -14.803 -19.371 2.008 1.00 0.00 C ATOM 2444 O ASP B 77 -14.170 -19.130 0.979 1.00 0.00 O ATOM 2445 CB ASP B 77 -16.621 -17.719 1.537 1.00 0.00 C ATOM 2446 CG ASP B 77 -17.970 -17.286 2.077 1.00 0.00 C ATOM 2447 OD1 ASP B 77 -17.997 -16.506 3.052 1.00 0.00 O ATOM 2448 OD2 ASP B 77 -19.000 -17.727 1.525 1.00 0.00 O ATOM 0 H ASP B 77 -15.113 -16.338 2.912 1.00 0.00 H new ATOM 0 HA ASP B 77 -16.352 -18.808 3.369 1.00 0.00 H new ATOM 0 HB2 ASP B 77 -16.119 -16.860 1.091 1.00 0.00 H new ATOM 0 HB3 ASP B 77 -16.769 -18.450 0.742 1.00 0.00 H new ATOM 2453 N CYS B 78 -14.727 -20.533 2.648 1.00 0.00 N ATOM 2454 CA CYS B 78 -13.876 -21.617 2.167 1.00 0.00 C ATOM 2455 C CYS B 78 -12.417 -21.174 2.102 1.00 0.00 C ATOM 2456 O CYS B 78 -11.630 -21.711 1.322 1.00 0.00 O ATOM 2457 CB CYS B 78 -14.342 -22.084 0.787 1.00 0.00 C ATOM 2458 SG CYS B 78 -15.666 -23.316 0.832 1.00 0.00 S ATOM 0 H CYS B 78 -15.244 -20.749 3.501 1.00 0.00 H new ATOM 0 HA CYS B 78 -13.954 -22.447 2.869 1.00 0.00 H new ATOM 0 HB2 CYS B 78 -14.684 -21.219 0.219 1.00 0.00 H new ATOM 0 HB3 CYS B 78 -13.490 -22.501 0.250 1.00 0.00 H new ATOM 0 HG CYS B 78 -15.993 -23.646 -0.382 1.00 0.00 H new ATOM 2464 N ILE B 79 -12.065 -20.191 2.926 1.00 0.00 N ATOM 2465 CA ILE B 79 -10.707 -19.670 2.964 1.00 0.00 C ATOM 2466 C ILE B 79 -9.686 -20.786 3.190 1.00 0.00 C ATOM 2467 O ILE B 79 -8.625 -20.806 2.566 1.00 0.00 O ATOM 2468 CB ILE B 79 -10.570 -18.588 4.063 1.00 0.00 C ATOM 2469 CG1 ILE B 79 -9.680 -17.448 3.570 1.00 0.00 C ATOM 2470 CG2 ILE B 79 -10.035 -19.172 5.366 1.00 0.00 C ATOM 2471 CD1 ILE B 79 -8.206 -17.791 3.536 1.00 0.00 C ATOM 0 H ILE B 79 -12.706 -19.739 3.578 1.00 0.00 H new ATOM 0 HA ILE B 79 -10.500 -19.217 1.995 1.00 0.00 H new ATOM 0 HB ILE B 79 -11.564 -18.193 4.272 1.00 0.00 H new ATOM 0 HG12 ILE B 79 -9.999 -17.158 2.569 1.00 0.00 H new ATOM 0 HG13 ILE B 79 -9.826 -16.581 4.214 1.00 0.00 H new ATOM 0 HG21 ILE B 79 -9.953 -18.382 6.112 1.00 0.00 H new ATOM 0 HG22 ILE B 79 -10.717 -19.942 5.726 1.00 0.00 H new ATOM 0 HG23 ILE B 79 -9.052 -19.610 5.192 1.00 0.00 H new ATOM 0 HD11 ILE B 79 -7.641 -16.932 3.175 1.00 0.00 H new ATOM 0 HD12 ILE B 79 -7.870 -18.051 4.540 1.00 0.00 H new ATOM 0 HD13 ILE B 79 -8.045 -18.637 2.868 1.00 0.00 H new ATOM 2483 N GLY B 80 -10.016 -21.712 4.085 1.00 0.00 N ATOM 2484 CA GLY B 80 -9.119 -22.815 4.375 1.00 0.00 C ATOM 2485 C GLY B 80 -9.083 -23.843 3.261 1.00 0.00 C ATOM 2486 O GLY B 80 -9.572 -24.961 3.424 1.00 0.00 O ATOM 0 H GLY B 80 -10.888 -21.718 4.614 1.00 0.00 H new ATOM 0 HA2 GLY B 80 -8.114 -22.428 4.540 1.00 0.00 H new ATOM 0 HA3 GLY B 80 -9.430 -23.298 5.301 1.00 0.00 H new ATOM 2490 N THR B 81 -8.504 -23.465 2.127 1.00 0.00 N ATOM 2491 CA THR B 81 -8.408 -24.363 0.982 1.00 0.00 C ATOM 2492 C THR B 81 -7.377 -23.858 -0.023 1.00 0.00 C ATOM 2493 O THR B 81 -6.566 -24.628 -0.535 1.00 0.00 O ATOM 2494 CB THR B 81 -9.770 -24.506 0.303 1.00 0.00 C ATOM 2495 OG1 THR B 81 -10.750 -24.942 1.230 1.00 0.00 O ATOM 2496 CG2 THR B 81 -9.765 -25.486 -0.851 1.00 0.00 C ATOM 0 H THR B 81 -8.094 -22.543 1.976 1.00 0.00 H new ATOM 0 HA THR B 81 -8.086 -25.339 1.345 1.00 0.00 H new ATOM 0 HB THR B 81 -10.004 -23.514 -0.084 1.00 0.00 H new ATOM 0 HG1 THR B 81 -10.323 -25.479 1.930 1.00 0.00 H new ATOM 0 HG21 THR B 81 -10.762 -25.539 -1.287 1.00 0.00 H new ATOM 0 HG22 THR B 81 -9.055 -25.153 -1.608 1.00 0.00 H new ATOM 0 HG23 THR B 81 -9.474 -26.472 -0.489 1.00 0.00 H new ATOM 2504 N GLY B 82 -7.418 -22.558 -0.303 1.00 0.00 N ATOM 2505 CA GLY B 82 -6.484 -21.972 -1.246 1.00 0.00 C ATOM 2506 C GLY B 82 -7.185 -21.259 -2.384 1.00 0.00 C ATOM 2507 O GLY B 82 -8.205 -21.730 -2.889 1.00 0.00 O ATOM 0 H GLY B 82 -8.082 -21.901 0.107 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -5.837 -21.268 -0.723 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -5.842 -22.754 -1.651 1.00 0.00 H new ATOM 2511 N CYS B 83 -6.639 -20.117 -2.789 1.00 0.00 N ATOM 2512 CA CYS B 83 -7.221 -19.333 -3.875 1.00 0.00 C ATOM 2513 C CYS B 83 -7.342 -20.169 -5.150 1.00 0.00 C ATOM 2514 O CYS B 83 -6.397 -20.854 -5.542 1.00 0.00 O ATOM 2515 CB CYS B 83 -6.371 -18.091 -4.148 1.00 0.00 C ATOM 2516 SG CYS B 83 -7.028 -17.018 -5.448 1.00 0.00 S ATOM 0 H CYS B 83 -5.795 -19.713 -2.383 1.00 0.00 H new ATOM 0 HA CYS B 83 -8.220 -19.023 -3.568 1.00 0.00 H new ATOM 0 HB2 CYS B 83 -6.282 -17.515 -3.227 1.00 0.00 H new ATOM 0 HB3 CYS B 83 -5.365 -18.406 -4.426 1.00 0.00 H new ATOM 0 HG CYS B 83 -7.467 -15.914 -4.919 1.00 0.00 H new ATOM 2521 N PRO B 84 -8.510 -20.125 -5.816 1.00 0.00 N ATOM 2522 CA PRO B 84 -8.745 -20.882 -7.046 1.00 0.00 C ATOM 2523 C PRO B 84 -8.159 -20.200 -8.278 1.00 0.00 C ATOM 2524 O PRO B 84 -7.952 -20.836 -9.311 1.00 0.00 O ATOM 2525 CB PRO B 84 -10.269 -20.921 -7.132 1.00 0.00 C ATOM 2526 CG PRO B 84 -10.709 -19.648 -6.495 1.00 0.00 C ATOM 2527 CD PRO B 84 -9.695 -19.337 -5.422 1.00 0.00 C ATOM 0 HA PRO B 84 -8.271 -21.863 -7.021 1.00 0.00 H new ATOM 0 HB2 PRO B 84 -10.607 -20.985 -8.166 1.00 0.00 H new ATOM 0 HB3 PRO B 84 -10.674 -21.788 -6.610 1.00 0.00 H new ATOM 0 HG2 PRO B 84 -10.758 -18.843 -7.228 1.00 0.00 H new ATOM 0 HG3 PRO B 84 -11.707 -19.752 -6.068 1.00 0.00 H new ATOM 0 HD2 PRO B 84 -9.471 -18.271 -5.381 1.00 0.00 H new ATOM 0 HD3 PRO B 84 -10.056 -19.625 -4.435 1.00 0.00 H new ATOM 2535 N VAL B 85 -7.895 -18.900 -8.166 1.00 0.00 N ATOM 2536 CA VAL B 85 -7.337 -18.137 -9.278 1.00 0.00 C ATOM 2537 C VAL B 85 -5.813 -18.121 -9.230 1.00 0.00 C ATOM 2538 O VAL B 85 -5.151 -17.974 -10.258 1.00 0.00 O ATOM 2539 CB VAL B 85 -7.855 -16.687 -9.279 1.00 0.00 C ATOM 2540 CG1 VAL B 85 -7.432 -15.970 -10.551 1.00 0.00 C ATOM 2541 CG2 VAL B 85 -9.367 -16.659 -9.120 1.00 0.00 C ATOM 0 H VAL B 85 -8.058 -18.355 -7.319 1.00 0.00 H new ATOM 0 HA VAL B 85 -7.661 -18.633 -10.193 1.00 0.00 H new ATOM 0 HB VAL B 85 -7.415 -16.163 -8.431 1.00 0.00 H new ATOM 0 HG11 VAL B 85 -7.807 -14.947 -10.534 1.00 0.00 H new ATOM 0 HG12 VAL B 85 -6.344 -15.957 -10.616 1.00 0.00 H new ATOM 0 HG13 VAL B 85 -7.841 -16.492 -11.416 1.00 0.00 H new ATOM 0 HG21 VAL B 85 -9.714 -15.626 -9.123 1.00 0.00 H new ATOM 0 HG22 VAL B 85 -9.830 -17.200 -9.946 1.00 0.00 H new ATOM 0 HG23 VAL B 85 -9.643 -17.132 -8.177 1.00 0.00 H new ATOM 2551 N CYS B 86 -5.259 -18.271 -8.030 1.00 0.00 N ATOM 2552 CA CYS B 86 -3.811 -18.273 -7.852 1.00 0.00 C ATOM 2553 C CYS B 86 -3.286 -19.691 -7.646 1.00 0.00 C ATOM 2554 O CYS B 86 -2.112 -19.969 -7.893 1.00 0.00 O ATOM 2555 CB CYS B 86 -3.423 -17.394 -6.662 1.00 0.00 C ATOM 2556 SG CYS B 86 -3.559 -15.619 -6.981 1.00 0.00 S ATOM 0 H CYS B 86 -5.790 -18.393 -7.168 1.00 0.00 H new ATOM 0 HA CYS B 86 -3.359 -17.869 -8.758 1.00 0.00 H new ATOM 0 HB2 CYS B 86 -4.057 -17.649 -5.813 1.00 0.00 H new ATOM 0 HB3 CYS B 86 -2.397 -17.623 -6.374 1.00 0.00 H new ATOM 0 HG CYS B 86 -4.720 -15.194 -6.580 1.00 0.00 H new ATOM 2561 N TYR B 87 -4.161 -20.586 -7.193 1.00 0.00 N ATOM 2562 CA TYR B 87 -3.781 -21.974 -6.957 1.00 0.00 C ATOM 2563 C TYR B 87 -2.704 -22.069 -5.880 1.00 0.00 C ATOM 2564 O TYR B 87 -1.784 -22.880 -5.976 1.00 0.00 O ATOM 2565 CB TYR B 87 -3.282 -22.618 -8.252 1.00 0.00 C ATOM 2566 CG TYR B 87 -4.383 -23.245 -9.080 1.00 0.00 C ATOM 2567 CD1 TYR B 87 -5.340 -22.456 -9.706 1.00 0.00 C ATOM 2568 CD2 TYR B 87 -4.464 -24.622 -9.234 1.00 0.00 C ATOM 2569 CE1 TYR B 87 -6.347 -23.025 -10.463 1.00 0.00 C ATOM 2570 CE2 TYR B 87 -5.467 -25.198 -9.990 1.00 0.00 C ATOM 2571 CZ TYR B 87 -6.407 -24.396 -10.602 1.00 0.00 C ATOM 2572 OH TYR B 87 -7.408 -24.964 -11.355 1.00 0.00 O ATOM 0 H TYR B 87 -5.136 -20.374 -6.983 1.00 0.00 H new ATOM 0 HA TYR B 87 -4.664 -22.511 -6.611 1.00 0.00 H new ATOM 0 HB2 TYR B 87 -2.773 -21.863 -8.851 1.00 0.00 H new ATOM 0 HB3 TYR B 87 -2.543 -23.381 -8.007 1.00 0.00 H new ATOM 0 HD1 TYR B 87 -5.297 -21.382 -9.600 1.00 0.00 H new ATOM 0 HD2 TYR B 87 -3.731 -25.254 -8.755 1.00 0.00 H new ATOM 0 HE1 TYR B 87 -7.084 -22.399 -10.944 1.00 0.00 H new ATOM 0 HE2 TYR B 87 -5.514 -26.271 -10.101 1.00 0.00 H new ATOM 0 HH TYR B 87 -7.306 -25.939 -11.352 1.00 0.00 H new ATOM 2582 N THR B 88 -2.829 -21.234 -4.853 1.00 0.00 N ATOM 2583 CA THR B 88 -1.869 -21.223 -3.755 1.00 0.00 C ATOM 2584 C THR B 88 -2.530 -21.664 -2.451 1.00 0.00 C ATOM 2585 O THR B 88 -3.688 -21.333 -2.192 1.00 0.00 O ATOM 2586 CB THR B 88 -1.266 -19.826 -3.590 1.00 0.00 C ATOM 2587 OG1 THR B 88 -1.452 -19.056 -4.765 1.00 0.00 O ATOM 2588 CG2 THR B 88 0.215 -19.843 -3.283 1.00 0.00 C ATOM 0 H THR B 88 -3.586 -20.556 -4.758 1.00 0.00 H new ATOM 0 HA THR B 88 -1.072 -21.928 -3.994 1.00 0.00 H new ATOM 0 HB THR B 88 -1.791 -19.386 -2.742 1.00 0.00 H new ATOM 0 HG1 THR B 88 -0.644 -18.531 -4.943 1.00 0.00 H new ATOM 0 HG21 THR B 88 0.577 -18.820 -3.179 1.00 0.00 H new ATOM 0 HG22 THR B 88 0.388 -20.385 -2.353 1.00 0.00 H new ATOM 0 HG23 THR B 88 0.749 -20.336 -4.095 1.00 0.00 H new ATOM 2596 N PRO B 89 -1.803 -22.419 -1.608 1.00 0.00 N ATOM 2597 CA PRO B 89 -2.332 -22.901 -0.329 1.00 0.00 C ATOM 2598 C PRO B 89 -2.476 -21.782 0.696 1.00 0.00 C ATOM 2599 O PRO B 89 -1.657 -20.865 0.749 1.00 0.00 O ATOM 2600 CB PRO B 89 -1.282 -23.913 0.130 1.00 0.00 C ATOM 2601 CG PRO B 89 -0.017 -23.463 -0.515 1.00 0.00 C ATOM 2602 CD PRO B 89 -0.414 -22.862 -1.835 1.00 0.00 C ATOM 0 HA PRO B 89 -3.332 -23.322 -0.434 1.00 0.00 H new ATOM 0 HB2 PRO B 89 -1.191 -23.924 1.216 1.00 0.00 H new ATOM 0 HB3 PRO B 89 -1.546 -24.925 -0.178 1.00 0.00 H new ATOM 0 HG2 PRO B 89 0.499 -22.732 0.107 1.00 0.00 H new ATOM 0 HG3 PRO B 89 0.667 -24.300 -0.657 1.00 0.00 H new ATOM 0 HD2 PRO B 89 0.234 -22.029 -2.108 1.00 0.00 H new ATOM 0 HD3 PRO B 89 -0.352 -23.591 -2.643 1.00 0.00 H new ATOM 2610 N ALA B 90 -3.523 -21.864 1.511 1.00 0.00 N ATOM 2611 CA ALA B 90 -3.775 -20.859 2.536 1.00 0.00 C ATOM 2612 C ALA B 90 -2.871 -21.073 3.747 1.00 0.00 C ATOM 2613 O ALA B 90 -2.992 -22.072 4.455 1.00 0.00 O ATOM 2614 CB ALA B 90 -5.237 -20.886 2.954 1.00 0.00 C ATOM 0 H ALA B 90 -4.211 -22.617 1.481 1.00 0.00 H new ATOM 0 HA ALA B 90 -3.548 -19.880 2.114 1.00 0.00 H new ATOM 0 HB1 ALA B 90 -5.410 -20.130 3.720 1.00 0.00 H new ATOM 0 HB2 ALA B 90 -5.867 -20.677 2.089 1.00 0.00 H new ATOM 0 HB3 ALA B 90 -5.483 -21.870 3.353 1.00 0.00 H new ATOM 2620 N TRP B 91 -1.966 -20.127 3.977 1.00 0.00 N ATOM 2621 CA TRP B 91 -1.041 -20.213 5.101 1.00 0.00 C ATOM 2622 C TRP B 91 -1.567 -19.442 6.311 1.00 0.00 C ATOM 2623 O TRP B 91 -0.809 -19.109 7.222 1.00 0.00 O ATOM 2624 CB TRP B 91 0.332 -19.675 4.697 1.00 0.00 C ATOM 2625 CG TRP B 91 1.430 -20.684 4.839 1.00 0.00 C ATOM 2626 CD1 TRP B 91 2.022 -21.398 3.837 1.00 0.00 C ATOM 2627 CD2 TRP B 91 2.067 -21.093 6.054 1.00 0.00 C ATOM 2628 NE1 TRP B 91 2.988 -22.226 4.355 1.00 0.00 N ATOM 2629 CE2 TRP B 91 3.036 -22.057 5.714 1.00 0.00 C ATOM 2630 CE3 TRP B 91 1.915 -20.738 7.398 1.00 0.00 C ATOM 2631 CZ2 TRP B 91 3.845 -22.669 6.668 1.00 0.00 C ATOM 2632 CZ3 TRP B 91 2.719 -21.346 8.343 1.00 0.00 C ATOM 2633 CH2 TRP B 91 3.673 -22.301 7.974 1.00 0.00 C ATOM 0 H TRP B 91 -1.854 -19.293 3.401 1.00 0.00 H new ATOM 0 HA TRP B 91 -0.949 -21.263 5.380 1.00 0.00 H new ATOM 0 HB2 TRP B 91 0.291 -19.336 3.662 1.00 0.00 H new ATOM 0 HB3 TRP B 91 0.567 -18.804 5.309 1.00 0.00 H new ATOM 0 HD1 TRP B 91 1.768 -21.323 2.790 1.00 0.00 H new ATOM 0 HE1 TRP B 91 3.574 -22.863 3.816 1.00 0.00 H new ATOM 0 HE3 TRP B 91 1.182 -20.001 7.692 1.00 0.00 H new ATOM 0 HZ2 TRP B 91 4.581 -23.407 6.387 1.00 0.00 H new ATOM 0 HZ3 TRP B 91 2.609 -21.080 9.384 1.00 0.00 H new ATOM 0 HH2 TRP B 91 4.287 -22.757 8.737 1.00 0.00 H new ATOM 2644 N ILE B 92 -2.866 -19.160 6.316 1.00 0.00 N ATOM 2645 CA ILE B 92 -3.484 -18.429 7.416 1.00 0.00 C ATOM 2646 C ILE B 92 -4.687 -19.185 7.971 1.00 0.00 C ATOM 2647 O ILE B 92 -5.807 -19.031 7.485 1.00 0.00 O ATOM 2648 CB ILE B 92 -3.934 -17.023 6.977 1.00 0.00 C ATOM 2649 CG1 ILE B 92 -4.750 -17.101 5.686 1.00 0.00 C ATOM 2650 CG2 ILE B 92 -2.727 -16.115 6.793 1.00 0.00 C ATOM 2651 CD1 ILE B 92 -5.942 -16.170 5.667 1.00 0.00 C ATOM 0 H ILE B 92 -3.510 -19.426 5.571 1.00 0.00 H new ATOM 0 HA ILE B 92 -2.727 -18.332 8.194 1.00 0.00 H new ATOM 0 HB ILE B 92 -4.567 -16.602 7.758 1.00 0.00 H new ATOM 0 HG12 ILE B 92 -4.102 -16.866 4.842 1.00 0.00 H new ATOM 0 HG13 ILE B 92 -5.097 -18.125 5.546 1.00 0.00 H new ATOM 0 HG21 ILE B 92 -3.061 -15.125 6.483 1.00 0.00 H new ATOM 0 HG22 ILE B 92 -2.184 -16.036 7.735 1.00 0.00 H new ATOM 0 HG23 ILE B 92 -2.071 -16.533 6.029 1.00 0.00 H new ATOM 0 HD11 ILE B 92 -6.474 -16.279 4.722 1.00 0.00 H new ATOM 0 HD12 ILE B 92 -6.611 -16.419 6.491 1.00 0.00 H new ATOM 0 HD13 ILE B 92 -5.601 -15.140 5.775 1.00 0.00 H new ATOM 2663 N GLN B 93 -4.446 -20.001 8.992 1.00 0.00 N ATOM 2664 CA GLN B 93 -5.509 -20.781 9.615 1.00 0.00 C ATOM 2665 C GLN B 93 -6.603 -19.871 10.167 1.00 0.00 C ATOM 2666 O GLN B 93 -7.770 -20.256 10.230 1.00 0.00 O ATOM 2667 CB GLN B 93 -4.940 -21.651 10.737 1.00 0.00 C ATOM 2668 CG GLN B 93 -5.720 -22.935 10.967 1.00 0.00 C ATOM 2669 CD GLN B 93 -5.456 -23.541 12.331 1.00 0.00 C ATOM 2670 OE1 GLN B 93 -4.799 -24.576 12.446 1.00 0.00 O ATOM 2671 NE2 GLN B 93 -5.968 -22.899 13.374 1.00 0.00 N ATOM 0 H GLN B 93 -3.524 -20.139 9.405 1.00 0.00 H new ATOM 0 HA GLN B 93 -5.948 -21.424 8.852 1.00 0.00 H new ATOM 0 HB2 GLN B 93 -3.906 -21.901 10.502 1.00 0.00 H new ATOM 0 HB3 GLN B 93 -4.926 -21.074 11.661 1.00 0.00 H new ATOM 0 HG2 GLN B 93 -6.786 -22.732 10.864 1.00 0.00 H new ATOM 0 HG3 GLN B 93 -5.457 -23.658 10.195 1.00 0.00 H new ATOM 0 HE21 GLN B 93 -6.506 -22.044 13.233 1.00 0.00 H new ATOM 0 HE22 GLN B 93 -5.823 -23.260 14.317 1.00 0.00 H new ATOM 2680 N ASP B 94 -6.216 -18.662 10.564 1.00 0.00 N ATOM 2681 CA ASP B 94 -7.164 -17.699 11.110 1.00 0.00 C ATOM 2682 C ASP B 94 -7.418 -16.566 10.122 1.00 0.00 C ATOM 2683 O ASP B 94 -6.895 -16.572 9.008 1.00 0.00 O ATOM 2684 CB ASP B 94 -6.642 -17.131 12.432 1.00 0.00 C ATOM 2685 CG ASP B 94 -7.081 -17.952 13.628 1.00 0.00 C ATOM 2686 OD1 ASP B 94 -8.289 -17.935 13.948 1.00 0.00 O ATOM 2687 OD2 ASP B 94 -6.219 -18.610 14.246 1.00 0.00 O ATOM 0 H ASP B 94 -5.254 -18.327 10.517 1.00 0.00 H new ATOM 0 HA ASP B 94 -8.106 -18.217 11.292 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -5.553 -17.091 12.402 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -6.995 -16.107 12.549 1.00 0.00 H new ATOM 2692 N LEU B 95 -8.224 -15.595 10.537 1.00 0.00 N ATOM 2693 CA LEU B 95 -8.547 -14.454 9.687 1.00 0.00 C ATOM 2694 C LEU B 95 -7.724 -13.232 10.080 1.00 0.00 C ATOM 2695 O LEU B 95 -8.203 -12.350 10.792 1.00 0.00 O ATOM 2696 CB LEU B 95 -10.039 -14.129 9.780 1.00 0.00 C ATOM 2697 CG LEU B 95 -10.666 -13.597 8.491 1.00 0.00 C ATOM 2698 CD1 LEU B 95 -10.712 -14.687 7.430 1.00 0.00 C ATOM 2699 CD2 LEU B 95 -12.061 -13.056 8.762 1.00 0.00 C ATOM 0 H LEU B 95 -8.666 -15.575 11.456 1.00 0.00 H new ATOM 0 HA LEU B 95 -8.303 -14.719 8.658 1.00 0.00 H new ATOM 0 HB2 LEU B 95 -10.574 -15.030 10.081 1.00 0.00 H new ATOM 0 HB3 LEU B 95 -10.186 -13.392 10.569 1.00 0.00 H new ATOM 0 HG LEU B 95 -10.047 -12.781 8.118 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -11.161 -14.290 6.520 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -9.699 -15.029 7.216 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -11.308 -15.524 7.794 1.00 0.00 H new ATOM 0 HD21 LEU B 95 -12.493 -12.681 7.834 1.00 0.00 H new ATOM 0 HD22 LEU B 95 -12.690 -13.853 9.159 1.00 0.00 H new ATOM 0 HD23 LEU B 95 -12.002 -12.245 9.488 1.00 0.00 H new ATOM 2711 N LYS B 96 -6.481 -13.187 9.611 1.00 0.00 N ATOM 2712 CA LYS B 96 -5.591 -12.072 9.913 1.00 0.00 C ATOM 2713 C LYS B 96 -6.130 -10.772 9.328 1.00 0.00 C ATOM 2714 O LYS B 96 -7.152 -10.765 8.642 1.00 0.00 O ATOM 2715 CB LYS B 96 -4.189 -12.349 9.365 1.00 0.00 C ATOM 2716 CG LYS B 96 -3.673 -13.741 9.689 1.00 0.00 C ATOM 2717 CD LYS B 96 -2.163 -13.748 9.865 1.00 0.00 C ATOM 2718 CE LYS B 96 -1.724 -14.806 10.866 1.00 0.00 C ATOM 2719 NZ LYS B 96 -0.401 -15.390 10.511 1.00 0.00 N ATOM 0 H LYS B 96 -6.068 -13.909 9.021 1.00 0.00 H new ATOM 0 HA LYS B 96 -5.536 -11.966 10.996 1.00 0.00 H new ATOM 0 HB2 LYS B 96 -4.198 -12.217 8.283 1.00 0.00 H new ATOM 0 HB3 LYS B 96 -3.497 -11.611 9.770 1.00 0.00 H new ATOM 0 HG2 LYS B 96 -4.148 -14.103 10.600 1.00 0.00 H new ATOM 0 HG3 LYS B 96 -3.950 -14.428 8.890 1.00 0.00 H new ATOM 0 HD2 LYS B 96 -1.684 -13.934 8.904 1.00 0.00 H new ATOM 0 HD3 LYS B 96 -1.830 -12.766 10.202 1.00 0.00 H new ATOM 0 HE2 LYS B 96 -1.671 -14.365 11.861 1.00 0.00 H new ATOM 0 HE3 LYS B 96 -2.471 -15.598 10.908 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 -0.137 -16.107 11.217 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 -0.458 -15.834 9.572 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 0.317 -14.638 10.496 1.00 0.00 H new ATOM 2733 N ILE B 97 -5.439 -9.671 9.605 1.00 0.00 N ATOM 2734 CA ILE B 97 -5.852 -8.365 9.107 1.00 0.00 C ATOM 2735 C ILE B 97 -4.680 -7.622 8.477 1.00 0.00 C ATOM 2736 O ILE B 97 -3.587 -7.574 9.040 1.00 0.00 O ATOM 2737 CB ILE B 97 -6.446 -7.499 10.234 1.00 0.00 C ATOM 2738 CG1 ILE B 97 -7.497 -8.293 11.014 1.00 0.00 C ATOM 2739 CG2 ILE B 97 -7.049 -6.226 9.663 1.00 0.00 C ATOM 2740 CD1 ILE B 97 -8.715 -8.655 10.192 1.00 0.00 C ATOM 0 H ILE B 97 -4.591 -9.658 10.171 1.00 0.00 H new ATOM 0 HA ILE B 97 -6.617 -8.541 8.350 1.00 0.00 H new ATOM 0 HB ILE B 97 -5.646 -7.220 10.920 1.00 0.00 H new ATOM 0 HG12 ILE B 97 -7.041 -9.207 11.395 1.00 0.00 H new ATOM 0 HG13 ILE B 97 -7.813 -7.710 11.879 1.00 0.00 H new ATOM 0 HG21 ILE B 97 -7.464 -5.625 10.472 1.00 0.00 H new ATOM 0 HG22 ILE B 97 -6.276 -5.656 9.148 1.00 0.00 H new ATOM 0 HG23 ILE B 97 -7.840 -6.482 8.958 1.00 0.00 H new ATOM 0 HD11 ILE B 97 -9.417 -9.216 10.809 1.00 0.00 H new ATOM 0 HD12 ILE B 97 -9.195 -7.745 9.833 1.00 0.00 H new ATOM 0 HD13 ILE B 97 -8.412 -9.265 9.341 1.00 0.00 H new ATOM 2752 N ASN B 98 -4.915 -7.040 7.306 1.00 0.00 N ATOM 2753 CA ASN B 98 -3.878 -6.296 6.599 1.00 0.00 C ATOM 2754 C ASN B 98 -3.762 -4.877 7.148 1.00 0.00 C ATOM 2755 O ASN B 98 -4.440 -3.962 6.681 1.00 0.00 O ATOM 2756 CB ASN B 98 -4.182 -6.253 5.101 1.00 0.00 C ATOM 2757 CG ASN B 98 -4.483 -7.627 4.533 1.00 0.00 C ATOM 2758 OD1 ASN B 98 -4.103 -8.646 5.108 1.00 0.00 O ATOM 2759 ND2 ASN B 98 -5.169 -7.660 3.396 1.00 0.00 N ATOM 0 H ASN B 98 -5.815 -7.069 6.826 1.00 0.00 H new ATOM 0 HA ASN B 98 -2.928 -6.807 6.753 1.00 0.00 H new ATOM 0 HB2 ASN B 98 -5.033 -5.595 4.924 1.00 0.00 H new ATOM 0 HB3 ASN B 98 -3.331 -5.823 4.572 1.00 0.00 H new ATOM 0 HD21 ASN B 98 -5.400 -8.555 2.966 1.00 0.00 H new ATOM 0 HD22 ASN B 98 -5.464 -6.790 2.953 1.00 0.00 H new ATOM 2766 N ARG B 99 -2.898 -4.704 8.143 1.00 0.00 N ATOM 2767 CA ARG B 99 -2.691 -3.398 8.759 1.00 0.00 C ATOM 2768 C ARG B 99 -2.228 -2.373 7.729 1.00 0.00 C ATOM 2769 O ARG B 99 -2.646 -1.215 7.761 1.00 0.00 O ATOM 2770 CB ARG B 99 -1.666 -3.502 9.889 1.00 0.00 C ATOM 2771 CG ARG B 99 -2.192 -4.208 11.128 1.00 0.00 C ATOM 2772 CD ARG B 99 -1.545 -3.671 12.393 1.00 0.00 C ATOM 2773 NE ARG B 99 -1.272 -4.731 13.361 1.00 0.00 N ATOM 2774 CZ ARG B 99 -0.415 -4.609 14.373 1.00 0.00 C ATOM 2775 NH1 ARG B 99 0.253 -3.476 14.552 1.00 0.00 N ATOM 2776 NH2 ARG B 99 -0.227 -5.621 15.208 1.00 0.00 N ATOM 0 H ARG B 99 -2.330 -5.452 8.540 1.00 0.00 H new ATOM 0 HA ARG B 99 -3.644 -3.064 9.170 1.00 0.00 H new ATOM 0 HB2 ARG B 99 -0.788 -4.035 9.523 1.00 0.00 H new ATOM 0 HB3 ARG B 99 -1.339 -2.499 10.164 1.00 0.00 H new ATOM 0 HG2 ARG B 99 -3.273 -4.081 11.189 1.00 0.00 H new ATOM 0 HG3 ARG B 99 -2.001 -5.278 11.047 1.00 0.00 H new ATOM 0 HD2 ARG B 99 -0.614 -3.165 12.137 1.00 0.00 H new ATOM 0 HD3 ARG B 99 -2.199 -2.926 12.846 1.00 0.00 H new ATOM 0 HE ARG B 99 -1.767 -5.617 13.255 1.00 0.00 H new ATOM 0 HH11 ARG B 99 0.111 -2.694 13.913 1.00 0.00 H new ATOM 0 HH12 ARG B 99 0.908 -3.388 15.329 1.00 0.00 H new ATOM 0 HH21 ARG B 99 -0.739 -6.493 15.075 1.00 0.00 H new ATOM 0 HH22 ARG B 99 0.429 -5.527 15.983 1.00 0.00 H new ATOM 2790 N GLN B 100 -1.363 -2.804 6.816 1.00 0.00 N ATOM 2791 CA GLN B 100 -0.846 -1.919 5.779 1.00 0.00 C ATOM 2792 C GLN B 100 -1.938 -1.549 4.782 1.00 0.00 C ATOM 2793 O GLN B 100 -2.218 -0.370 4.564 1.00 0.00 O ATOM 2794 CB GLN B 100 0.326 -2.582 5.050 1.00 0.00 C ATOM 2795 CG GLN B 100 1.524 -2.863 5.946 1.00 0.00 C ATOM 2796 CD GLN B 100 1.900 -1.679 6.816 1.00 0.00 C ATOM 2797 OE1 GLN B 100 2.253 -1.839 7.985 1.00 0.00 O ATOM 2798 NE2 GLN B 100 1.826 -0.479 6.250 1.00 0.00 N ATOM 0 H GLN B 100 -1.006 -3.759 6.773 1.00 0.00 H new ATOM 0 HA GLN B 100 -0.496 -1.005 6.259 1.00 0.00 H new ATOM 0 HB2 GLN B 100 -0.015 -3.519 4.610 1.00 0.00 H new ATOM 0 HB3 GLN B 100 0.641 -1.940 4.228 1.00 0.00 H new ATOM 0 HG2 GLN B 100 1.302 -3.720 6.583 1.00 0.00 H new ATOM 0 HG3 GLN B 100 2.378 -3.138 5.327 1.00 0.00 H new ATOM 0 HE21 GLN B 100 1.529 -0.391 5.278 1.00 0.00 H new ATOM 0 HE22 GLN B 100 2.067 0.354 6.787 1.00 0.00 H new ATOM 2807 N LEU B 101 -2.553 -2.561 4.179 1.00 0.00 N ATOM 2808 CA LEU B 101 -3.616 -2.337 3.207 1.00 0.00 C ATOM 2809 C LEU B 101 -4.783 -1.587 3.841 1.00 0.00 C ATOM 2810 O LEU B 101 -5.413 -0.745 3.201 1.00 0.00 O ATOM 2811 CB LEU B 101 -4.102 -3.668 2.630 1.00 0.00 C ATOM 2812 CG LEU B 101 -3.292 -4.195 1.443 1.00 0.00 C ATOM 2813 CD1 LEU B 101 -3.917 -5.467 0.893 1.00 0.00 C ATOM 2814 CD2 LEU B 101 -3.190 -3.137 0.355 1.00 0.00 C ATOM 0 H LEU B 101 -2.334 -3.543 4.346 1.00 0.00 H new ATOM 0 HA LEU B 101 -3.211 -1.728 2.399 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -4.086 -4.417 3.422 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -5.141 -3.554 2.319 1.00 0.00 H new ATOM 0 HG LEU B 101 -2.286 -4.429 1.791 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -3.328 -5.827 0.050 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -3.938 -6.229 1.672 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -4.934 -5.259 0.562 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -2.611 -3.529 -0.481 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -4.190 -2.871 0.011 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -2.696 -2.251 0.754 1.00 0.00 H new ATOM 2826 N ASP B 102 -5.065 -1.898 5.103 1.00 0.00 N ATOM 2827 CA ASP B 102 -6.157 -1.252 5.824 1.00 0.00 C ATOM 2828 C ASP B 102 -5.978 0.263 5.837 1.00 0.00 C ATOM 2829 O ASP B 102 -6.822 1.002 5.328 1.00 0.00 O ATOM 2830 CB ASP B 102 -6.232 -1.780 7.258 1.00 0.00 C ATOM 2831 CG ASP B 102 -7.417 -1.220 8.019 1.00 0.00 C ATOM 2832 OD1 ASP B 102 -8.453 -0.937 7.380 1.00 0.00 O ATOM 2833 OD2 ASP B 102 -7.310 -1.065 9.253 1.00 0.00 O ATOM 0 H ASP B 102 -4.553 -2.593 5.647 1.00 0.00 H new ATOM 0 HA ASP B 102 -7.089 -1.486 5.309 1.00 0.00 H new ATOM 0 HB2 ASP B 102 -6.297 -2.868 7.239 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -5.312 -1.525 7.785 1.00 0.00 H new ATOM 2838 N SER B 103 -4.872 0.719 6.416 1.00 0.00 N ATOM 2839 CA SER B 103 -4.582 2.145 6.491 1.00 0.00 C ATOM 2840 C SER B 103 -4.476 2.749 5.094 1.00 0.00 C ATOM 2841 O SER B 103 -4.803 3.916 4.884 1.00 0.00 O ATOM 2842 CB SER B 103 -3.284 2.384 7.263 1.00 0.00 C ATOM 2843 OG SER B 103 -3.525 2.460 8.657 1.00 0.00 O ATOM 0 H SER B 103 -4.162 0.121 6.840 1.00 0.00 H new ATOM 0 HA SER B 103 -5.403 2.631 7.018 1.00 0.00 H new ATOM 0 HB2 SER B 103 -2.581 1.577 7.056 1.00 0.00 H new ATOM 0 HB3 SER B 103 -2.819 3.308 6.921 1.00 0.00 H new ATOM 0 HG SER B 103 -2.679 2.611 9.127 1.00 0.00 H new ATOM 2849 N MET B 104 -4.018 1.942 4.142 1.00 0.00 N ATOM 2850 CA MET B 104 -3.869 2.393 2.763 1.00 0.00 C ATOM 2851 C MET B 104 -5.213 2.831 2.189 1.00 0.00 C ATOM 2852 O MET B 104 -5.293 3.809 1.445 1.00 0.00 O ATOM 2853 CB MET B 104 -3.266 1.279 1.904 1.00 0.00 C ATOM 2854 CG MET B 104 -3.167 1.626 0.426 1.00 0.00 C ATOM 2855 SD MET B 104 -2.320 3.190 0.132 1.00 0.00 S ATOM 2856 CE MET B 104 -0.638 2.623 -0.102 1.00 0.00 C ATOM 0 H MET B 104 -3.744 0.972 4.300 1.00 0.00 H new ATOM 0 HA MET B 104 -3.196 3.250 2.754 1.00 0.00 H new ATOM 0 HB2 MET B 104 -2.270 1.043 2.279 1.00 0.00 H new ATOM 0 HB3 MET B 104 -3.871 0.379 2.016 1.00 0.00 H new ATOM 0 HG2 MET B 104 -2.638 0.828 -0.095 1.00 0.00 H new ATOM 0 HG3 MET B 104 -4.169 1.675 0.001 1.00 0.00 H new ATOM 0 HE1 MET B 104 0.016 3.116 0.617 1.00 0.00 H new ATOM 0 HE2 MET B 104 -0.594 1.544 0.048 1.00 0.00 H new ATOM 0 HE3 MET B 104 -0.311 2.863 -1.114 1.00 0.00 H new ATOM 2866 N ILE B 105 -6.269 2.106 2.544 1.00 0.00 N ATOM 2867 CA ILE B 105 -7.608 2.425 2.066 1.00 0.00 C ATOM 2868 C ILE B 105 -8.080 3.763 2.625 1.00 0.00 C ATOM 2869 O ILE B 105 -8.634 4.591 1.901 1.00 0.00 O ATOM 2870 CB ILE B 105 -8.623 1.331 2.453 1.00 0.00 C ATOM 2871 CG1 ILE B 105 -8.115 -0.045 2.016 1.00 0.00 C ATOM 2872 CG2 ILE B 105 -9.982 1.620 1.831 1.00 0.00 C ATOM 2873 CD1 ILE B 105 -8.413 -1.145 3.012 1.00 0.00 C ATOM 0 H ILE B 105 -6.223 1.295 3.160 1.00 0.00 H new ATOM 0 HA ILE B 105 -7.552 2.484 0.979 1.00 0.00 H new ATOM 0 HB ILE B 105 -8.735 1.331 3.537 1.00 0.00 H new ATOM 0 HG12 ILE B 105 -8.566 -0.302 1.058 1.00 0.00 H new ATOM 0 HG13 ILE B 105 -7.038 0.008 1.857 1.00 0.00 H new ATOM 0 HG21 ILE B 105 -10.686 0.838 2.115 1.00 0.00 H new ATOM 0 HG22 ILE B 105 -10.347 2.583 2.187 1.00 0.00 H new ATOM 0 HG23 ILE B 105 -9.887 1.646 0.745 1.00 0.00 H new ATOM 0 HD11 ILE B 105 -8.024 -2.091 2.636 1.00 0.00 H new ATOM 0 HD12 ILE B 105 -7.939 -0.911 3.965 1.00 0.00 H new ATOM 0 HD13 ILE B 105 -9.491 -1.226 3.153 1.00 0.00 H new ATOM 2885 N GLN B 106 -7.854 3.969 3.919 1.00 0.00 N ATOM 2886 CA GLN B 106 -8.254 5.208 4.576 1.00 0.00 C ATOM 2887 C GLN B 106 -7.574 6.409 3.925 1.00 0.00 C ATOM 2888 O GLN B 106 -8.128 7.508 3.897 1.00 0.00 O ATOM 2889 CB GLN B 106 -7.907 5.154 6.066 1.00 0.00 C ATOM 2890 CG GLN B 106 -9.005 5.698 6.965 1.00 0.00 C ATOM 2891 CD GLN B 106 -8.684 7.078 7.507 1.00 0.00 C ATOM 2892 OE1 GLN B 106 -9.230 8.080 7.048 1.00 0.00 O ATOM 2893 NE2 GLN B 106 -7.793 7.136 8.490 1.00 0.00 N ATOM 0 H GLN B 106 -7.397 3.295 4.532 1.00 0.00 H new ATOM 0 HA GLN B 106 -9.333 5.319 4.466 1.00 0.00 H new ATOM 0 HB2 GLN B 106 -7.699 4.121 6.345 1.00 0.00 H new ATOM 0 HB3 GLN B 106 -6.993 5.722 6.239 1.00 0.00 H new ATOM 0 HG2 GLN B 106 -9.940 5.739 6.406 1.00 0.00 H new ATOM 0 HG3 GLN B 106 -9.161 5.012 7.797 1.00 0.00 H new ATOM 0 HE21 GLN B 106 -7.364 6.280 8.841 1.00 0.00 H new ATOM 0 HE22 GLN B 106 -7.537 8.037 8.894 1.00 0.00 H new ATOM 2902 N LEU B 107 -6.372 6.190 3.402 1.00 0.00 N ATOM 2903 CA LEU B 107 -5.617 7.253 2.750 1.00 0.00 C ATOM 2904 C LEU B 107 -6.307 7.698 1.463 1.00 0.00 C ATOM 2905 O LEU B 107 -6.426 8.892 1.192 1.00 0.00 O ATOM 2906 CB LEU B 107 -4.193 6.781 2.444 1.00 0.00 C ATOM 2907 CG LEU B 107 -3.153 7.127 3.511 1.00 0.00 C ATOM 2908 CD1 LEU B 107 -2.938 8.630 3.579 1.00 0.00 C ATOM 2909 CD2 LEU B 107 -3.580 6.584 4.868 1.00 0.00 C ATOM 0 H LEU B 107 -5.900 5.286 3.417 1.00 0.00 H new ATOM 0 HA LEU B 107 -5.572 8.104 3.430 1.00 0.00 H new ATOM 0 HB2 LEU B 107 -4.206 5.700 2.308 1.00 0.00 H new ATOM 0 HB3 LEU B 107 -3.878 7.217 1.496 1.00 0.00 H new ATOM 0 HG LEU B 107 -2.208 6.658 3.236 1.00 0.00 H new ATOM 0 HD11 LEU B 107 -2.195 8.857 4.344 1.00 0.00 H new ATOM 0 HD12 LEU B 107 -2.586 8.991 2.613 1.00 0.00 H new ATOM 0 HD13 LEU B 107 -3.878 9.121 3.830 1.00 0.00 H new ATOM 0 HD21 LEU B 107 -2.828 6.839 5.615 1.00 0.00 H new ATOM 0 HD22 LEU B 107 -4.537 7.023 5.151 1.00 0.00 H new ATOM 0 HD23 LEU B 107 -3.681 5.500 4.811 1.00 0.00 H new ATOM 2921 N CYS B 108 -6.762 6.727 0.677 1.00 0.00 N ATOM 2922 CA CYS B 108 -7.442 7.018 -0.580 1.00 0.00 C ATOM 2923 C CYS B 108 -8.685 7.869 -0.339 1.00 0.00 C ATOM 2924 O CYS B 108 -9.018 8.740 -1.142 1.00 0.00 O ATOM 2925 CB CYS B 108 -7.828 5.718 -1.287 1.00 0.00 C ATOM 2926 SG CYS B 108 -8.645 5.960 -2.883 1.00 0.00 S ATOM 0 H CYS B 108 -6.672 5.733 0.888 1.00 0.00 H new ATOM 0 HA CYS B 108 -6.757 7.579 -1.216 1.00 0.00 H new ATOM 0 HB2 CYS B 108 -6.930 5.118 -1.438 1.00 0.00 H new ATOM 0 HB3 CYS B 108 -8.488 5.145 -0.636 1.00 0.00 H new ATOM 0 HG CYS B 108 -9.829 5.425 -2.850 1.00 0.00 H new ATOM 2932 N SER B 109 -9.364 7.612 0.774 1.00 0.00 N ATOM 2933 CA SER B 109 -10.568 8.356 1.123 1.00 0.00 C ATOM 2934 C SER B 109 -10.234 9.810 1.434 1.00 0.00 C ATOM 2935 O SER B 109 -11.037 10.709 1.183 1.00 0.00 O ATOM 2936 CB SER B 109 -11.262 7.710 2.324 1.00 0.00 C ATOM 2937 OG SER B 109 -11.884 6.490 1.958 1.00 0.00 O ATOM 0 H SER B 109 -9.101 6.894 1.449 1.00 0.00 H new ATOM 0 HA SER B 109 -11.243 8.331 0.268 1.00 0.00 H new ATOM 0 HB2 SER B 109 -10.534 7.528 3.114 1.00 0.00 H new ATOM 0 HB3 SER B 109 -12.007 8.395 2.729 1.00 0.00 H new ATOM 0 HG SER B 109 -12.319 6.096 2.743 1.00 0.00 H new ATOM 2943 N LYS B 110 -9.045 10.034 1.982 1.00 0.00 N ATOM 2944 CA LYS B 110 -8.603 11.380 2.328 1.00 0.00 C ATOM 2945 C LYS B 110 -8.545 12.265 1.087 1.00 0.00 C ATOM 2946 O LYS B 110 -9.064 13.382 1.085 1.00 0.00 O ATOM 2947 CB LYS B 110 -7.229 11.333 2.998 1.00 0.00 C ATOM 2948 CG LYS B 110 -7.218 10.559 4.307 1.00 0.00 C ATOM 2949 CD LYS B 110 -6.172 11.103 5.267 1.00 0.00 C ATOM 2950 CE LYS B 110 -4.819 10.447 5.047 1.00 0.00 C ATOM 2951 NZ LYS B 110 -3.957 10.530 6.258 1.00 0.00 N ATOM 0 H LYS B 110 -8.369 9.300 2.196 1.00 0.00 H new ATOM 0 HA LYS B 110 -9.324 11.805 3.026 1.00 0.00 H new ATOM 0 HB2 LYS B 110 -6.514 10.880 2.311 1.00 0.00 H new ATOM 0 HB3 LYS B 110 -6.890 12.352 3.185 1.00 0.00 H new ATOM 0 HG2 LYS B 110 -8.203 10.613 4.771 1.00 0.00 H new ATOM 0 HG3 LYS B 110 -7.017 9.506 4.107 1.00 0.00 H new ATOM 0 HD2 LYS B 110 -6.081 12.181 5.134 1.00 0.00 H new ATOM 0 HD3 LYS B 110 -6.496 10.935 6.294 1.00 0.00 H new ATOM 0 HE2 LYS B 110 -4.963 9.401 4.775 1.00 0.00 H new ATOM 0 HE3 LYS B 110 -4.315 10.928 4.209 1.00 0.00 H new ATOM 0 HZ1 LYS B 110 -3.044 10.071 6.066 1.00 0.00 H new ATOM 0 HZ2 LYS B 110 -3.798 11.528 6.503 1.00 0.00 H new ATOM 0 HZ3 LYS B 110 -4.426 10.049 7.052 1.00 0.00 H new ATOM 2965 N LEU B 111 -7.911 11.759 0.034 1.00 0.00 N ATOM 2966 CA LEU B 111 -7.786 12.504 -1.213 1.00 0.00 C ATOM 2967 C LEU B 111 -9.161 12.834 -1.788 1.00 0.00 C ATOM 2968 O LEU B 111 -9.361 13.899 -2.373 1.00 0.00 O ATOM 2969 CB LEU B 111 -6.969 11.701 -2.230 1.00 0.00 C ATOM 2970 CG LEU B 111 -5.619 12.316 -2.602 1.00 0.00 C ATOM 2971 CD1 LEU B 111 -4.710 12.386 -1.385 1.00 0.00 C ATOM 2972 CD2 LEU B 111 -4.959 11.517 -3.716 1.00 0.00 C ATOM 0 H LEU B 111 -7.476 10.836 0.020 1.00 0.00 H new ATOM 0 HA LEU B 111 -7.268 13.440 -1.001 1.00 0.00 H new ATOM 0 HB2 LEU B 111 -6.798 10.702 -1.829 1.00 0.00 H new ATOM 0 HB3 LEU B 111 -7.561 11.584 -3.138 1.00 0.00 H new ATOM 0 HG LEU B 111 -5.790 13.331 -2.961 1.00 0.00 H new ATOM 0 HD11 LEU B 111 -3.754 12.826 -1.670 1.00 0.00 H new ATOM 0 HD12 LEU B 111 -5.178 13.001 -0.616 1.00 0.00 H new ATOM 0 HD13 LEU B 111 -4.545 11.381 -0.996 1.00 0.00 H new ATOM 0 HD21 LEU B 111 -3.999 11.968 -3.968 1.00 0.00 H new ATOM 0 HD22 LEU B 111 -4.801 10.491 -3.384 1.00 0.00 H new ATOM 0 HD23 LEU B 111 -5.603 11.518 -4.595 1.00 0.00 H new ATOM 2984 N ARG B 112 -10.105 11.914 -1.616 1.00 0.00 N ATOM 2985 CA ARG B 112 -11.461 12.108 -2.116 1.00 0.00 C ATOM 2986 C ARG B 112 -12.097 13.349 -1.498 1.00 0.00 C ATOM 2987 O ARG B 112 -12.807 14.097 -2.171 1.00 0.00 O ATOM 2988 CB ARG B 112 -12.319 10.878 -1.814 1.00 0.00 C ATOM 2989 CG ARG B 112 -12.160 9.760 -2.831 1.00 0.00 C ATOM 2990 CD ARG B 112 -13.322 8.782 -2.770 1.00 0.00 C ATOM 2991 NE ARG B 112 -13.011 7.520 -3.439 1.00 0.00 N ATOM 2992 CZ ARG B 112 -13.809 6.455 -3.419 1.00 0.00 C ATOM 2993 NH1 ARG B 112 -14.965 6.495 -2.768 1.00 0.00 N ATOM 2994 NH2 ARG B 112 -13.451 5.347 -4.053 1.00 0.00 N ATOM 0 H ARG B 112 -9.956 11.027 -1.134 1.00 0.00 H new ATOM 0 HA ARG B 112 -11.406 12.249 -3.195 1.00 0.00 H new ATOM 0 HB2 ARG B 112 -12.060 10.498 -0.826 1.00 0.00 H new ATOM 0 HB3 ARG B 112 -13.367 11.177 -1.776 1.00 0.00 H new ATOM 0 HG2 ARG B 112 -12.093 10.185 -3.833 1.00 0.00 H new ATOM 0 HG3 ARG B 112 -11.226 9.229 -2.647 1.00 0.00 H new ATOM 0 HD2 ARG B 112 -13.577 8.587 -1.728 1.00 0.00 H new ATOM 0 HD3 ARG B 112 -14.199 9.232 -3.234 1.00 0.00 H new ATOM 0 HE ARG B 112 -12.131 7.452 -3.951 1.00 0.00 H new ATOM 0 HH11 ARG B 112 -15.246 7.345 -2.279 1.00 0.00 H new ATOM 0 HH12 ARG B 112 -15.572 5.676 -2.756 1.00 0.00 H new ATOM 0 HH21 ARG B 112 -12.564 5.311 -4.556 1.00 0.00 H new ATOM 0 HH22 ARG B 112 -14.062 4.531 -4.038 1.00 0.00 H new ATOM 3008 N ASN B 113 -11.835 13.563 -0.213 1.00 0.00 N ATOM 3009 CA ASN B 113 -12.380 14.715 0.497 1.00 0.00 C ATOM 3010 C ASN B 113 -11.647 15.993 0.104 1.00 0.00 C ATOM 3011 O ASN B 113 -12.263 17.044 -0.076 1.00 0.00 O ATOM 3012 CB ASN B 113 -12.283 14.501 2.009 1.00 0.00 C ATOM 3013 CG ASN B 113 -13.369 13.585 2.535 1.00 0.00 C ATOM 3014 OD1 ASN B 113 -13.297 12.365 2.379 1.00 0.00 O ATOM 3015 ND2 ASN B 113 -14.384 14.168 3.160 1.00 0.00 N ATOM 0 H ASN B 113 -11.249 12.954 0.358 1.00 0.00 H new ATOM 0 HA ASN B 113 -13.429 14.819 0.219 1.00 0.00 H new ATOM 0 HB2 ASN B 113 -11.307 14.080 2.251 1.00 0.00 H new ATOM 0 HB3 ASN B 113 -12.348 15.465 2.514 1.00 0.00 H new ATOM 0 HD21 ASN B 113 -15.146 13.602 3.534 1.00 0.00 H new ATOM 0 HD22 ASN B 113 -14.403 15.182 3.267 1.00 0.00 H new ATOM 3022 N LEU B 114 -10.328 15.896 -0.029 1.00 0.00 N ATOM 3023 CA LEU B 114 -9.510 17.043 -0.401 1.00 0.00 C ATOM 3024 C LEU B 114 -9.767 17.448 -1.850 1.00 0.00 C ATOM 3025 O LEU B 114 -9.671 18.622 -2.203 1.00 0.00 O ATOM 3026 CB LEU B 114 -8.027 16.725 -0.203 1.00 0.00 C ATOM 3027 CG LEU B 114 -7.671 16.110 1.150 1.00 0.00 C ATOM 3028 CD1 LEU B 114 -6.462 15.196 1.022 1.00 0.00 C ATOM 3029 CD2 LEU B 114 -7.410 17.201 2.178 1.00 0.00 C ATOM 0 H LEU B 114 -9.803 15.033 0.116 1.00 0.00 H new ATOM 0 HA LEU B 114 -9.784 17.877 0.245 1.00 0.00 H new ATOM 0 HB2 LEU B 114 -7.710 16.041 -0.990 1.00 0.00 H new ATOM 0 HB3 LEU B 114 -7.454 17.644 -0.329 1.00 0.00 H new ATOM 0 HG LEU B 114 -8.517 15.512 1.489 1.00 0.00 H new ATOM 0 HD11 LEU B 114 -6.225 14.768 1.996 1.00 0.00 H new ATOM 0 HD12 LEU B 114 -6.685 14.394 0.318 1.00 0.00 H new ATOM 0 HD13 LEU B 114 -5.609 15.770 0.660 1.00 0.00 H new ATOM 0 HD21 LEU B 114 -7.158 16.746 3.136 1.00 0.00 H new ATOM 0 HD22 LEU B 114 -6.581 17.825 1.844 1.00 0.00 H new ATOM 0 HD23 LEU B 114 -8.304 17.815 2.292 1.00 0.00 H new ATOM 3041 N LEU B 115 -10.094 16.466 -2.684 1.00 0.00 N ATOM 3042 CA LEU B 115 -10.365 16.719 -4.094 1.00 0.00 C ATOM 3043 C LEU B 115 -11.742 17.348 -4.279 1.00 0.00 C ATOM 3044 O LEU B 115 -11.873 18.415 -4.879 1.00 0.00 O ATOM 3045 CB LEU B 115 -10.275 15.418 -4.894 1.00 0.00 C ATOM 3046 CG LEU B 115 -8.884 14.783 -4.944 1.00 0.00 C ATOM 3047 CD1 LEU B 115 -8.992 13.268 -5.017 1.00 0.00 C ATOM 3048 CD2 LEU B 115 -8.096 15.321 -6.128 1.00 0.00 C ATOM 0 H LEU B 115 -10.178 15.488 -2.407 1.00 0.00 H new ATOM 0 HA LEU B 115 -9.614 17.417 -4.463 1.00 0.00 H new ATOM 0 HB2 LEU B 115 -10.971 14.697 -4.466 1.00 0.00 H new ATOM 0 HB3 LEU B 115 -10.605 15.613 -5.914 1.00 0.00 H new ATOM 0 HG LEU B 115 -8.352 15.045 -4.030 1.00 0.00 H new ATOM 0 HD11 LEU B 115 -7.993 12.833 -5.052 1.00 0.00 H new ATOM 0 HD12 LEU B 115 -9.518 12.898 -4.137 1.00 0.00 H new ATOM 0 HD13 LEU B 115 -9.542 12.985 -5.914 1.00 0.00 H new ATOM 0 HD21 LEU B 115 -7.109 14.859 -6.148 1.00 0.00 H new ATOM 0 HD22 LEU B 115 -8.625 15.089 -7.053 1.00 0.00 H new ATOM 0 HD23 LEU B 115 -7.989 16.402 -6.033 1.00 0.00 H new ATOM 3060 N HIS B 116 -12.766 16.680 -3.760 1.00 0.00 N ATOM 3061 CA HIS B 116 -14.134 17.174 -3.868 1.00 0.00 C ATOM 3062 C HIS B 116 -14.359 18.365 -2.943 1.00 0.00 C ATOM 3063 O HIS B 116 -15.152 19.256 -3.244 1.00 0.00 O ATOM 3064 CB HIS B 116 -15.128 16.060 -3.533 1.00 0.00 C ATOM 3065 CG HIS B 116 -14.916 14.810 -4.330 1.00 0.00 C ATOM 3066 ND1 HIS B 116 -15.351 13.588 -3.875 1.00 0.00 N ATOM 3067 CD2 HIS B 116 -14.316 14.646 -5.534 1.00 0.00 C ATOM 3068 CE1 HIS B 116 -15.009 12.714 -4.805 1.00 0.00 C ATOM 3069 NE2 HIS B 116 -14.379 13.308 -5.830 1.00 0.00 N ATOM 0 H HIS B 116 -12.675 15.795 -3.260 1.00 0.00 H new ATOM 0 HA HIS B 116 -14.295 17.500 -4.896 1.00 0.00 H new ATOM 0 HB2 HIS B 116 -15.051 15.822 -2.472 1.00 0.00 H new ATOM 0 HB3 HIS B 116 -16.141 16.424 -3.705 1.00 0.00 H new ATOM 0 HD1 HIS B 116 -15.838 13.396 -3.000 1.00 0.00 H new ATOM 0 HD2 HIS B 116 -13.873 15.420 -6.143 1.00 0.00 H new ATOM 0 HE1 HIS B 116 -15.211 11.655 -4.747 1.00 0.00 H new ATOM 3077 N ASP B 117 -13.655 18.374 -1.816 1.00 0.00 N ATOM 3078 CA ASP B 117 -13.777 19.457 -0.846 1.00 0.00 C ATOM 3079 C ASP B 117 -15.204 19.552 -0.315 1.00 0.00 C ATOM 3080 O ASP B 117 -16.149 19.101 -0.961 1.00 0.00 O ATOM 3081 CB ASP B 117 -13.367 20.786 -1.481 1.00 0.00 C ATOM 3082 CG ASP B 117 -12.038 20.696 -2.206 1.00 0.00 C ATOM 3083 OD1 ASP B 117 -10.990 20.695 -1.528 1.00 0.00 O ATOM 3084 OD2 ASP B 117 -12.047 20.625 -3.454 1.00 0.00 O ATOM 0 H ASP B 117 -12.994 17.644 -1.551 1.00 0.00 H new ATOM 0 HA ASP B 117 -13.111 19.241 -0.011 1.00 0.00 H new ATOM 0 HB2 ASP B 117 -14.139 21.104 -2.182 1.00 0.00 H new ATOM 0 HB3 ASP B 117 -13.304 21.551 -0.707 1.00 0.00 H new