USER MOD reduce.3.24.130724 H: found=0, std=0, add=1266, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1272 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 37 LYS NZ :NH3+ 155:sc= 1.27 (180deg=0.694) USER MOD Set 1.2: B 91 TYR OH : rot -14:sc= 0.35 USER MOD Set 2.1: B 45 GLN : amide:sc= -0.532 K(o=-0.48,f=-1.8) USER MOD Set 2.2: B 59 LYS NZ :NH3+ -148:sc= 0.049 (180deg=0) USER MOD Set 3.1: B 46 SER OG : rot 180:sc= 0 USER MOD Set 3.2: B 83 ASN : amide:sc=-0.00385 K(o=-0.0039,f=-1.7) USER MOD Set 4.1: A 26 SER OG : rot 84:sc= 0.344 USER MOD Set 4.2: B 24 GLN : amide:sc= 0.269 K(o=0.61,f=-0.2) USER MOD Set 5.1: A 24 GLN : amide:sc= -1.8! C(o=1.5!,f=-1.4!) USER MOD Set 5.2: A 61 SER OG : rot 94:sc= 2.17 USER MOD Set 5.3: A 72 TYR OH : rot 159:sc= 1.09 USER MOD Set 6.1: A 44 SER OG : rot 139:sc= 0.555 USER MOD Set 6.2: A 46 SER OG : rot 180:sc= 0 USER MOD Set 6.3: A 83 ASN : amide:sc= 0 X(o=0.55,f=0.34) USER MOD Single : A 27 LYS NZ :NH3+ -173:sc= -0.258 (180deg=-0.317) USER MOD Single : A 28 GLN : amide:sc= 0.654 K(o=0.65,f=-7.9!) USER MOD Single : A 31 SER OG : rot -83:sc= 1.2 USER MOD Single : A 32 HIS : no HD1:sc= -1.08! C(o=-1.1!,f=-4.7!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 174:sc= 0.925 (180deg=0.876) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 ASN : amide:sc=-0.00817 X(o=-0.0082,f=-0.074) USER MOD Single : A 45 GLN : amide:sc= -0.216 K(o=-0.22,f=-0.8) USER MOD Single : A 49 GLN : amide:sc= -0.369 X(o=-0.37,f=-0.53) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot -64:sc= 1.22 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ -148:sc= 1.17 (180deg=0.854) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ -109:sc= 0.966 (180deg=-0.174) USER MOD Single : A 71 TYR OH : rot -148:sc= 0.824 USER MOD Single : A 73 HIS : no HE2:sc= -0.745 K(o=-0.75,f=-1.4) USER MOD Single : A 80 HIS : no HE2:sc= 1.11 K(o=1.1,f=-4.1!) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0.726 K(o=0.73,f=-7.7!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -167:sc= -0.0191 (180deg=-0.205) USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 100 HIS : no HD1:sc= -0.0129 X(o=-0.013,f=-0.00035) USER MOD Single : A 101 HIS : no HE2:sc= -0.0957 K(o=-0.096,f=-6!) USER MOD Single : A 102 HIS : no HD1:sc= -0.735 K(o=-0.74,f=-2.6) USER MOD Single : A 103 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 104 HIS : no HE2:sc= -0.0459 X(o=-0.046,f=-0.52) USER MOD Single : B 26 SER OG : rot 75:sc= 0.201 USER MOD Single : B 27 LYS NZ :NH3+ -137:sc= 0.223 (180deg=0.0114) USER MOD Single : B 28 GLN : amide:sc= 0.968 K(o=0.97,f=-6.8!) USER MOD Single : B 31 SER OG : rot 71:sc= 0.0812 USER MOD Single : B 32 HIS : no HD1:sc= 1.16 K(o=1.2,f=-5.8!) USER MOD Single : B 34 LYS NZ :NH3+ -118:sc= 0.198 (180deg=-0.571) USER MOD Single : B 40 THR OG1 : rot 180:sc= 0 USER MOD Single : B 42 ASN :FLIP amide:sc= 0.453 F(o=-0.25,f=0.45) USER MOD Single : B 44 SER OG : rot 111:sc= 1.08 USER MOD Single : B 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 51 SER OG : rot 180:sc= 0 USER MOD Single : B 52 SER OG : rot -57:sc= 0.859 USER MOD Single : B 54 SER OG : rot 180:sc=0.000806 USER MOD Single : B 61 SER OG : rot -110:sc= 1.22 USER MOD Single : B 67 LYS NZ :NH3+ 171:sc= -0.0226 (180deg=-0.126) USER MOD Single : B 70 LYS NZ :NH3+ 157:sc= 1.2 (180deg=1.13) USER MOD Single : B 71 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 TYR OH : rot 180:sc= 0 USER MOD Single : B 73 HIS : no HE2:sc= 0.959 K(o=0.96,f=-5.9!) USER MOD Single : B 80 HIS : no HE2:sc= 1.02 K(o=1,f=-4.9!) USER MOD Single : B 92 ASN : amide:sc= 1.06 K(o=1.1,f=-8.7!) USER MOD Single : B 95 THR OG1 : rot 180:sc= 0.172 USER MOD Single : B 96 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0564) USER MOD Single : B 99 HIS : no HD1:sc= 0 X(o=0,f=-0.0047) USER MOD Single : B 100 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 101 HIS : no HE2:sc= 0.945 K(o=0.95,f=-4.5!) USER MOD Single : B 102 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : B 103 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 104 HIS : no HD1:sc= -0.372 K(o=-0.37,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 22 -7.693 -5.753 -8.345 1.00 0.00 N ATOM 2 CA ALA A 22 -8.048 -4.698 -7.371 1.00 0.00 C ATOM 3 C ALA A 22 -6.816 -3.889 -7.007 1.00 0.00 C ATOM 4 O ALA A 22 -5.708 -4.424 -6.954 1.00 0.00 O ATOM 5 CB ALA A 22 -8.673 -5.307 -6.126 1.00 0.00 C ATOM 0 HA ALA A 22 -8.781 -4.033 -7.829 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -8.927 -4.515 -5.422 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -9.576 -5.851 -6.401 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -7.964 -5.992 -5.661 1.00 0.00 H new ATOM 13 N GLU A 23 -7.010 -2.608 -6.747 1.00 0.00 N ATOM 14 CA GLU A 23 -5.904 -1.704 -6.492 1.00 0.00 C ATOM 15 C GLU A 23 -5.691 -1.521 -4.998 1.00 0.00 C ATOM 16 O GLU A 23 -6.647 -1.376 -4.235 1.00 0.00 O ATOM 17 CB GLU A 23 -6.183 -0.342 -7.132 1.00 0.00 C ATOM 18 CG GLU A 23 -6.662 -0.422 -8.573 1.00 0.00 C ATOM 19 CD GLU A 23 -5.652 -1.064 -9.499 1.00 0.00 C ATOM 20 OE1 GLU A 23 -4.818 -0.329 -10.073 1.00 0.00 O ATOM 21 OE2 GLU A 23 -5.703 -2.298 -9.676 1.00 0.00 O ATOM 0 H GLU A 23 -7.930 -2.169 -6.707 1.00 0.00 H new ATOM 0 HA GLU A 23 -5.004 -2.137 -6.927 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -6.934 0.180 -6.539 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -5.274 0.258 -7.095 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -7.592 -0.990 -8.610 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -6.887 0.583 -8.931 1.00 0.00 H new ATOM 28 N GLN A 24 -4.438 -1.544 -4.575 1.00 0.00 N ATOM 29 CA GLN A 24 -4.102 -1.231 -3.199 1.00 0.00 C ATOM 30 C GLN A 24 -4.017 0.272 -3.026 1.00 0.00 C ATOM 31 O GLN A 24 -3.367 0.950 -3.816 1.00 0.00 O ATOM 32 CB GLN A 24 -2.779 -1.871 -2.787 1.00 0.00 C ATOM 33 CG GLN A 24 -2.828 -3.384 -2.733 1.00 0.00 C ATOM 34 CD GLN A 24 -1.574 -3.987 -2.134 1.00 0.00 C ATOM 35 OE1 GLN A 24 -0.482 -3.433 -2.254 1.00 0.00 O ATOM 36 NE2 GLN A 24 -1.721 -5.130 -1.487 1.00 0.00 N ATOM 0 H GLN A 24 -3.639 -1.776 -5.165 1.00 0.00 H new ATOM 0 HA GLN A 24 -4.886 -1.636 -2.559 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -2.003 -1.566 -3.489 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -2.490 -1.490 -1.807 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -3.692 -3.695 -2.146 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -2.969 -3.775 -3.740 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -2.644 -5.557 -1.410 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -0.911 -5.585 -1.065 1.00 0.00 H new ATOM 45 N VAL A 25 -4.685 0.783 -2.010 1.00 0.00 N ATOM 46 CA VAL A 25 -4.672 2.212 -1.723 1.00 0.00 C ATOM 47 C VAL A 25 -4.415 2.457 -0.243 1.00 0.00 C ATOM 48 O VAL A 25 -5.076 1.874 0.614 1.00 0.00 O ATOM 49 CB VAL A 25 -5.995 2.894 -2.140 1.00 0.00 C ATOM 50 CG1 VAL A 25 -6.076 3.033 -3.653 1.00 0.00 C ATOM 51 CG2 VAL A 25 -7.192 2.113 -1.619 1.00 0.00 C ATOM 0 H VAL A 25 -5.248 0.230 -1.364 1.00 0.00 H new ATOM 0 HA VAL A 25 -3.865 2.651 -2.310 1.00 0.00 H new ATOM 0 HB VAL A 25 -6.013 3.891 -1.699 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -7.015 3.515 -3.924 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -5.242 3.638 -4.008 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.030 2.045 -4.112 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -8.112 2.611 -1.924 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -7.173 1.103 -2.028 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -7.149 2.065 -0.531 1.00 0.00 H new ATOM 61 N SER A 26 -3.444 3.307 0.055 1.00 0.00 N ATOM 62 CA SER A 26 -3.076 3.600 1.432 1.00 0.00 C ATOM 63 C SER A 26 -4.188 4.363 2.148 1.00 0.00 C ATOM 64 O SER A 26 -5.093 4.904 1.512 1.00 0.00 O ATOM 65 CB SER A 26 -1.776 4.406 1.461 1.00 0.00 C ATOM 66 OG SER A 26 -0.744 3.720 0.775 1.00 0.00 O ATOM 0 H SER A 26 -2.894 3.808 -0.642 1.00 0.00 H new ATOM 0 HA SER A 26 -2.926 2.656 1.956 1.00 0.00 H new ATOM 0 HB2 SER A 26 -1.937 5.382 1.003 1.00 0.00 H new ATOM 0 HB3 SER A 26 -1.476 4.584 2.494 1.00 0.00 H new ATOM 0 HG SER A 26 -0.813 3.901 -0.186 1.00 0.00 H new ATOM 72 N LYS A 27 -4.107 4.412 3.474 1.00 0.00 N ATOM 73 CA LYS A 27 -5.122 5.077 4.286 1.00 0.00 C ATOM 74 C LYS A 27 -5.195 6.556 3.927 1.00 0.00 C ATOM 75 O LYS A 27 -6.267 7.162 3.915 1.00 0.00 O ATOM 76 CB LYS A 27 -4.791 4.928 5.774 1.00 0.00 C ATOM 77 CG LYS A 27 -4.406 3.511 6.179 1.00 0.00 C ATOM 78 CD LYS A 27 -4.154 3.407 7.676 1.00 0.00 C ATOM 79 CE LYS A 27 -5.378 2.904 8.430 1.00 0.00 C ATOM 80 NZ LYS A 27 -6.584 3.752 8.214 1.00 0.00 N ATOM 0 H LYS A 27 -3.346 3.997 4.012 1.00 0.00 H new ATOM 0 HA LYS A 27 -6.086 4.610 4.085 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -3.972 5.603 6.024 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -5.653 5.242 6.362 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -5.201 2.822 5.894 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -3.511 3.207 5.636 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -3.316 2.734 7.856 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -3.867 4.384 8.063 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -5.597 1.883 8.116 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -5.152 2.868 9.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -7.350 3.433 8.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -6.354 4.744 8.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -6.892 3.672 7.224 1.00 0.00 H new ATOM 94 N GLN A 28 -4.037 7.116 3.616 1.00 0.00 N ATOM 95 CA GLN A 28 -3.920 8.516 3.250 1.00 0.00 C ATOM 96 C GLN A 28 -4.522 8.757 1.869 1.00 0.00 C ATOM 97 O GLN A 28 -4.961 9.861 1.561 1.00 0.00 O ATOM 98 CB GLN A 28 -2.448 8.953 3.268 1.00 0.00 C ATOM 99 CG GLN A 28 -1.732 8.683 4.588 1.00 0.00 C ATOM 100 CD GLN A 28 -1.116 7.291 4.676 1.00 0.00 C ATOM 101 OE1 GLN A 28 -1.592 6.335 4.064 1.00 0.00 O ATOM 102 NE2 GLN A 28 -0.054 7.169 5.449 1.00 0.00 N ATOM 0 H GLN A 28 -3.151 6.611 3.611 1.00 0.00 H new ATOM 0 HA GLN A 28 -4.470 9.110 3.980 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -1.918 8.437 2.468 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -2.395 10.020 3.050 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -0.948 9.427 4.725 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -2.439 8.811 5.408 1.00 0.00 H new ATOM 0 HE21 GLN A 28 0.314 7.983 5.942 1.00 0.00 H new ATOM 0 HE22 GLN A 28 0.399 6.261 5.554 1.00 0.00 H new ATOM 111 N GLU A 29 -4.546 7.713 1.049 1.00 0.00 N ATOM 112 CA GLU A 29 -5.133 7.794 -0.282 1.00 0.00 C ATOM 113 C GLU A 29 -6.651 7.661 -0.191 1.00 0.00 C ATOM 114 O GLU A 29 -7.392 8.447 -0.785 1.00 0.00 O ATOM 115 CB GLU A 29 -4.554 6.702 -1.191 1.00 0.00 C ATOM 116 CG GLU A 29 -3.045 6.797 -1.382 1.00 0.00 C ATOM 117 CD GLU A 29 -2.491 5.686 -2.256 1.00 0.00 C ATOM 118 OE1 GLU A 29 -2.558 5.808 -3.497 1.00 0.00 O ATOM 119 OE2 GLU A 29 -1.992 4.679 -1.706 1.00 0.00 O ATOM 0 H GLU A 29 -4.164 6.797 1.284 1.00 0.00 H new ATOM 0 HA GLU A 29 -4.890 8.765 -0.714 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -4.797 5.726 -0.771 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -5.039 6.759 -2.166 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -2.800 7.761 -1.829 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -2.557 6.764 -0.408 1.00 0.00 H new ATOM 126 N ILE A 30 -7.103 6.675 0.583 1.00 0.00 N ATOM 127 CA ILE A 30 -8.530 6.424 0.783 1.00 0.00 C ATOM 128 C ILE A 30 -9.233 7.662 1.332 1.00 0.00 C ATOM 129 O ILE A 30 -10.315 8.035 0.866 1.00 0.00 O ATOM 130 CB ILE A 30 -8.763 5.248 1.758 1.00 0.00 C ATOM 131 CG1 ILE A 30 -8.082 3.980 1.241 1.00 0.00 C ATOM 132 CG2 ILE A 30 -10.255 5.006 1.957 1.00 0.00 C ATOM 133 CD1 ILE A 30 -8.154 2.813 2.203 1.00 0.00 C ATOM 0 H ILE A 30 -6.494 6.030 1.087 1.00 0.00 H new ATOM 0 HA ILE A 30 -8.946 6.171 -0.192 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.324 5.508 2.721 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -8.543 3.690 0.297 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.036 4.201 1.030 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -10.400 4.174 2.647 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -10.717 5.903 2.368 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -10.716 4.767 0.999 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -7.650 1.950 1.767 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -7.667 3.083 3.140 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.198 2.564 2.396 1.00 0.00 H new ATOM 145 N SER A 31 -8.600 8.303 2.306 1.00 0.00 N ATOM 146 CA SER A 31 -9.176 9.465 2.964 1.00 0.00 C ATOM 147 C SER A 31 -9.002 10.729 2.125 1.00 0.00 C ATOM 148 O SER A 31 -9.684 11.729 2.347 1.00 0.00 O ATOM 149 CB SER A 31 -8.534 9.654 4.341 1.00 0.00 C ATOM 150 OG SER A 31 -7.119 9.725 4.242 1.00 0.00 O ATOM 0 H SER A 31 -7.681 8.034 2.659 1.00 0.00 H new ATOM 0 HA SER A 31 -10.245 9.290 3.082 1.00 0.00 H new ATOM 0 HB2 SER A 31 -8.915 10.566 4.801 1.00 0.00 H new ATOM 0 HB3 SER A 31 -8.815 8.827 4.993 1.00 0.00 H new ATOM 0 HG SER A 31 -6.748 8.819 4.204 1.00 0.00 H new ATOM 156 N HIS A 32 -8.094 10.684 1.159 1.00 0.00 N ATOM 157 CA HIS A 32 -7.814 11.850 0.330 1.00 0.00 C ATOM 158 C HIS A 32 -8.812 11.932 -0.815 1.00 0.00 C ATOM 159 O HIS A 32 -9.348 12.999 -1.112 1.00 0.00 O ATOM 160 CB HIS A 32 -6.386 11.790 -0.225 1.00 0.00 C ATOM 161 CG HIS A 32 -5.853 13.113 -0.690 1.00 0.00 C ATOM 162 ND1 HIS A 32 -4.750 13.716 -0.123 1.00 0.00 N ATOM 163 CD2 HIS A 32 -6.268 13.946 -1.674 1.00 0.00 C ATOM 164 CE1 HIS A 32 -4.515 14.861 -0.735 1.00 0.00 C ATOM 165 NE2 HIS A 32 -5.420 15.027 -1.682 1.00 0.00 N ATOM 0 H HIS A 32 -7.541 9.858 0.931 1.00 0.00 H new ATOM 0 HA HIS A 32 -7.908 12.741 0.950 1.00 0.00 H new ATOM 0 HB2 HIS A 32 -5.724 11.395 0.546 1.00 0.00 H new ATOM 0 HB3 HIS A 32 -6.361 11.087 -1.058 1.00 0.00 H new ATOM 0 HD2 HIS A 32 -7.110 13.789 -2.331 1.00 0.00 H new ATOM 0 HE1 HIS A 32 -3.715 15.548 -0.500 1.00 0.00 H new ATOM 0 HE2 HIS A 32 -5.480 15.825 -2.314 1.00 0.00 H new ATOM 174 N PHE A 33 -9.060 10.800 -1.456 1.00 0.00 N ATOM 175 CA PHE A 33 -9.968 10.758 -2.595 1.00 0.00 C ATOM 176 C PHE A 33 -11.394 10.452 -2.149 1.00 0.00 C ATOM 177 O PHE A 33 -12.335 10.603 -2.930 1.00 0.00 O ATOM 178 CB PHE A 33 -9.500 9.718 -3.616 1.00 0.00 C ATOM 179 CG PHE A 33 -8.167 10.040 -4.231 1.00 0.00 C ATOM 180 CD1 PHE A 33 -8.067 10.972 -5.252 1.00 0.00 C ATOM 181 CD2 PHE A 33 -7.013 9.415 -3.786 1.00 0.00 C ATOM 182 CE1 PHE A 33 -6.842 11.275 -5.816 1.00 0.00 C ATOM 183 CE2 PHE A 33 -5.786 9.713 -4.346 1.00 0.00 C ATOM 184 CZ PHE A 33 -5.701 10.644 -5.363 1.00 0.00 C ATOM 0 H PHE A 33 -8.648 9.900 -1.209 1.00 0.00 H new ATOM 0 HA PHE A 33 -9.961 11.741 -3.065 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -9.441 8.744 -3.130 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -10.246 9.635 -4.407 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -8.957 11.467 -5.611 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -7.074 8.686 -2.992 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -6.778 12.004 -6.610 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -4.894 9.219 -3.989 1.00 0.00 H new ATOM 0 HZ PHE A 33 -4.743 10.878 -5.803 1.00 0.00 H new ATOM 194 N LYS A 34 -11.540 10.035 -0.888 1.00 0.00 N ATOM 195 CA LYS A 34 -12.835 9.685 -0.318 1.00 0.00 C ATOM 196 C LYS A 34 -13.456 8.519 -1.084 1.00 0.00 C ATOM 197 O LYS A 34 -14.316 8.708 -1.949 1.00 0.00 O ATOM 198 CB LYS A 34 -13.777 10.896 -0.308 1.00 0.00 C ATOM 199 CG LYS A 34 -15.056 10.663 0.475 1.00 0.00 C ATOM 200 CD LYS A 34 -14.776 10.529 1.960 1.00 0.00 C ATOM 201 CE LYS A 34 -15.565 9.385 2.564 1.00 0.00 C ATOM 202 NZ LYS A 34 -15.415 9.322 4.040 1.00 0.00 N ATOM 0 H LYS A 34 -10.761 9.932 -0.237 1.00 0.00 H new ATOM 0 HA LYS A 34 -12.681 9.375 0.716 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -13.251 11.751 0.117 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -14.032 11.156 -1.335 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -15.745 11.491 0.306 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -15.548 9.760 0.112 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -13.710 10.363 2.119 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -15.033 11.459 2.467 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -16.619 9.499 2.312 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -15.232 8.444 2.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -15.971 8.526 4.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -14.412 9.187 4.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -15.756 10.209 4.462 1.00 0.00 H new ATOM 216 N LEU A 35 -12.991 7.319 -0.779 1.00 0.00 N ATOM 217 CA LEU A 35 -13.459 6.120 -1.467 1.00 0.00 C ATOM 218 C LEU A 35 -14.733 5.576 -0.826 1.00 0.00 C ATOM 219 O LEU A 35 -15.070 5.922 0.307 1.00 0.00 O ATOM 220 CB LEU A 35 -12.370 5.047 -1.464 1.00 0.00 C ATOM 221 CG LEU A 35 -11.091 5.419 -2.217 1.00 0.00 C ATOM 222 CD1 LEU A 35 -10.059 4.311 -2.089 1.00 0.00 C ATOM 223 CD2 LEU A 35 -11.394 5.697 -3.682 1.00 0.00 C ATOM 0 H LEU A 35 -12.289 7.146 -0.059 1.00 0.00 H new ATOM 0 HA LEU A 35 -13.688 6.393 -2.497 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -12.111 4.817 -0.431 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -12.778 4.136 -1.901 1.00 0.00 H new ATOM 0 HG LEU A 35 -10.682 6.326 -1.773 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -9.155 4.591 -2.630 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -9.819 4.157 -1.037 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -10.461 3.389 -2.508 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -10.472 5.960 -4.201 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -11.827 4.807 -4.139 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.101 6.523 -3.757 1.00 0.00 H new ATOM 235 N VAL A 36 -15.429 4.721 -1.561 1.00 0.00 N ATOM 236 CA VAL A 36 -16.676 4.133 -1.088 1.00 0.00 C ATOM 237 C VAL A 36 -16.401 2.795 -0.407 1.00 0.00 C ATOM 238 O VAL A 36 -15.821 1.894 -1.008 1.00 0.00 O ATOM 239 CB VAL A 36 -17.666 3.928 -2.258 1.00 0.00 C ATOM 240 CG1 VAL A 36 -18.990 3.364 -1.767 1.00 0.00 C ATOM 241 CG2 VAL A 36 -17.890 5.234 -3.003 1.00 0.00 C ATOM 0 H VAL A 36 -15.150 4.417 -2.494 1.00 0.00 H new ATOM 0 HA VAL A 36 -17.124 4.819 -0.369 1.00 0.00 H new ATOM 0 HB VAL A 36 -17.226 3.205 -2.945 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -19.665 3.231 -2.613 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -18.819 2.402 -1.284 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -19.437 4.054 -1.051 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -18.589 5.070 -3.823 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -18.300 5.977 -2.319 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -16.941 5.593 -3.402 1.00 0.00 H new ATOM 251 N LYS A 37 -16.809 2.671 0.847 1.00 0.00 N ATOM 252 CA LYS A 37 -16.555 1.459 1.618 1.00 0.00 C ATOM 253 C LYS A 37 -17.531 0.356 1.207 1.00 0.00 C ATOM 254 O LYS A 37 -18.741 0.571 1.171 1.00 0.00 O ATOM 255 CB LYS A 37 -16.686 1.766 3.115 1.00 0.00 C ATOM 256 CG LYS A 37 -15.746 0.967 4.009 1.00 0.00 C ATOM 257 CD LYS A 37 -16.106 -0.508 4.060 1.00 0.00 C ATOM 258 CE LYS A 37 -15.165 -1.274 4.974 1.00 0.00 C ATOM 259 NZ LYS A 37 -15.177 -0.739 6.358 1.00 0.00 N ATOM 0 H LYS A 37 -17.318 3.395 1.355 1.00 0.00 H new ATOM 0 HA LYS A 37 -15.542 1.110 1.416 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -16.501 2.829 3.273 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -17.713 1.572 3.424 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -14.724 1.076 3.646 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -15.771 1.379 5.018 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -17.131 -0.622 4.412 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -16.065 -0.930 3.056 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -15.451 -2.326 4.989 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -14.152 -1.225 4.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -14.601 -1.350 6.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -14.784 0.224 6.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -16.154 -0.715 6.712 1.00 0.00 H new ATOM 273 N VAL A 38 -16.996 -0.818 0.883 1.00 0.00 N ATOM 274 CA VAL A 38 -17.825 -1.942 0.457 1.00 0.00 C ATOM 275 C VAL A 38 -17.941 -2.993 1.560 1.00 0.00 C ATOM 276 O VAL A 38 -19.043 -3.352 1.978 1.00 0.00 O ATOM 277 CB VAL A 38 -17.258 -2.610 -0.818 1.00 0.00 C ATOM 278 CG1 VAL A 38 -18.138 -3.769 -1.263 1.00 0.00 C ATOM 279 CG2 VAL A 38 -17.113 -1.591 -1.935 1.00 0.00 C ATOM 0 H VAL A 38 -15.996 -1.016 0.907 1.00 0.00 H new ATOM 0 HA VAL A 38 -18.814 -1.539 0.239 1.00 0.00 H new ATOM 0 HB VAL A 38 -16.271 -3.006 -0.581 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -17.717 -4.221 -2.161 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -18.186 -4.515 -0.470 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -19.142 -3.402 -1.478 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -16.713 -2.079 -2.823 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -18.088 -1.162 -2.165 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -16.434 -0.799 -1.619 1.00 0.00 H new ATOM 289 N GLY A 39 -16.800 -3.482 2.029 1.00 0.00 N ATOM 290 CA GLY A 39 -16.797 -4.524 3.035 1.00 0.00 C ATOM 291 C GLY A 39 -15.399 -4.833 3.526 1.00 0.00 C ATOM 292 O GLY A 39 -14.498 -4.004 3.394 1.00 0.00 O ATOM 0 H GLY A 39 -15.875 -3.174 1.729 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -17.418 -4.217 3.877 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -17.244 -5.428 2.622 1.00 0.00 H new ATOM 296 N THR A 40 -15.213 -6.017 4.082 1.00 0.00 N ATOM 297 CA THR A 40 -13.919 -6.420 4.616 1.00 0.00 C ATOM 298 C THR A 40 -13.559 -7.835 4.154 1.00 0.00 C ATOM 299 O THR A 40 -14.433 -8.697 4.029 1.00 0.00 O ATOM 300 CB THR A 40 -13.931 -6.363 6.162 1.00 0.00 C ATOM 301 OG1 THR A 40 -14.364 -5.067 6.601 1.00 0.00 O ATOM 302 CG2 THR A 40 -12.554 -6.653 6.742 1.00 0.00 C ATOM 0 H THR A 40 -15.945 -6.721 4.177 1.00 0.00 H new ATOM 0 HA THR A 40 -13.168 -5.726 4.240 1.00 0.00 H new ATOM 0 HB THR A 40 -14.622 -7.128 6.516 1.00 0.00 H new ATOM 0 HG1 THR A 40 -14.371 -5.039 7.581 1.00 0.00 H new ATOM 0 HG21 THR A 40 -12.600 -6.604 7.830 1.00 0.00 H new ATOM 0 HG22 THR A 40 -12.233 -7.649 6.436 1.00 0.00 H new ATOM 0 HG23 THR A 40 -11.842 -5.914 6.376 1.00 0.00 H new ATOM 310 N ILE A 41 -12.280 -8.059 3.876 1.00 0.00 N ATOM 311 CA ILE A 41 -11.788 -9.382 3.515 1.00 0.00 C ATOM 312 C ILE A 41 -10.684 -9.811 4.470 1.00 0.00 C ATOM 313 O ILE A 41 -10.014 -8.973 5.080 1.00 0.00 O ATOM 314 CB ILE A 41 -11.242 -9.440 2.069 1.00 0.00 C ATOM 315 CG1 ILE A 41 -10.252 -8.296 1.819 1.00 0.00 C ATOM 316 CG2 ILE A 41 -12.382 -9.411 1.060 1.00 0.00 C ATOM 317 CD1 ILE A 41 -9.590 -8.345 0.458 1.00 0.00 C ATOM 0 H ILE A 41 -11.561 -7.336 3.894 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.640 -10.059 3.583 1.00 0.00 H new ATOM 0 HB ILE A 41 -10.707 -10.381 1.941 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -10.776 -7.346 1.924 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -9.481 -8.321 2.589 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -11.975 -9.453 0.050 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -13.035 -10.268 1.224 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -12.954 -8.491 1.183 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -8.904 -7.504 0.356 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -9.037 -9.279 0.356 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -10.352 -8.288 -0.319 1.00 0.00 H new ATOM 329 N ASN A 42 -10.496 -11.110 4.603 1.00 0.00 N ATOM 330 CA ASN A 42 -9.453 -11.642 5.459 1.00 0.00 C ATOM 331 C ASN A 42 -8.843 -12.880 4.825 1.00 0.00 C ATOM 332 O ASN A 42 -9.545 -13.693 4.223 1.00 0.00 O ATOM 333 CB ASN A 42 -10.002 -11.974 6.856 1.00 0.00 C ATOM 334 CG ASN A 42 -10.941 -13.172 6.865 1.00 0.00 C ATOM 335 OD1 ASN A 42 -10.509 -14.311 7.043 1.00 0.00 O ATOM 336 ND2 ASN A 42 -12.228 -12.925 6.681 1.00 0.00 N ATOM 0 H ASN A 42 -11.054 -11.819 4.127 1.00 0.00 H new ATOM 0 HA ASN A 42 -8.681 -10.881 5.572 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -9.168 -12.170 7.529 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -10.530 -11.104 7.247 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -12.900 -13.692 6.684 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -12.548 -11.967 6.537 1.00 0.00 H new ATOM 343 N VAL A 43 -7.532 -13.000 4.928 1.00 0.00 N ATOM 344 CA VAL A 43 -6.833 -14.172 4.434 1.00 0.00 C ATOM 345 C VAL A 43 -6.094 -14.847 5.576 1.00 0.00 C ATOM 346 O VAL A 43 -5.056 -14.360 6.017 1.00 0.00 O ATOM 347 CB VAL A 43 -5.827 -13.822 3.315 1.00 0.00 C ATOM 348 CG1 VAL A 43 -5.148 -15.079 2.788 1.00 0.00 C ATOM 349 CG2 VAL A 43 -6.514 -13.077 2.182 1.00 0.00 C ATOM 0 H VAL A 43 -6.927 -12.296 5.352 1.00 0.00 H new ATOM 0 HA VAL A 43 -7.581 -14.844 4.014 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.064 -13.170 3.741 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.444 -14.809 2.001 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.613 -15.571 3.600 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -5.900 -15.757 2.385 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.785 -12.842 1.407 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -7.302 -13.701 1.761 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -6.948 -12.153 2.564 1.00 0.00 H new ATOM 359 N SER A 44 -6.658 -15.932 6.078 1.00 0.00 N ATOM 360 CA SER A 44 -6.021 -16.712 7.125 1.00 0.00 C ATOM 361 C SER A 44 -5.705 -18.107 6.601 1.00 0.00 C ATOM 362 O SER A 44 -6.592 -18.954 6.483 1.00 0.00 O ATOM 363 CB SER A 44 -6.932 -16.792 8.357 1.00 0.00 C ATOM 364 OG SER A 44 -6.309 -17.488 9.427 1.00 0.00 O ATOM 0 H SER A 44 -7.562 -16.295 5.775 1.00 0.00 H new ATOM 0 HA SER A 44 -5.091 -16.226 7.420 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.194 -15.785 8.682 1.00 0.00 H new ATOM 0 HB3 SER A 44 -7.862 -17.293 8.090 1.00 0.00 H new ATOM 0 HG SER A 44 -6.498 -17.027 10.271 1.00 0.00 H new ATOM 370 N GLN A 45 -4.446 -18.331 6.252 1.00 0.00 N ATOM 371 CA GLN A 45 -4.024 -19.611 5.703 1.00 0.00 C ATOM 372 C GLN A 45 -2.805 -20.143 6.435 1.00 0.00 C ATOM 373 O GLN A 45 -1.909 -19.385 6.809 1.00 0.00 O ATOM 374 CB GLN A 45 -3.720 -19.488 4.211 1.00 0.00 C ATOM 375 CG GLN A 45 -4.952 -19.260 3.348 1.00 0.00 C ATOM 376 CD GLN A 45 -5.986 -20.366 3.500 1.00 0.00 C ATOM 377 OE1 GLN A 45 -5.649 -21.527 3.745 1.00 0.00 O ATOM 378 NE2 GLN A 45 -7.254 -20.011 3.361 1.00 0.00 N ATOM 0 H GLN A 45 -3.699 -17.642 6.340 1.00 0.00 H new ATOM 0 HA GLN A 45 -4.846 -20.314 5.838 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -3.024 -18.663 4.059 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -3.217 -20.395 3.877 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -5.405 -18.305 3.614 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -4.651 -19.190 2.303 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -7.493 -19.040 3.159 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.992 -20.708 3.456 1.00 0.00 H new ATOM 387 N SER A 46 -2.781 -21.449 6.637 1.00 0.00 N ATOM 388 CA SER A 46 -1.694 -22.098 7.345 1.00 0.00 C ATOM 389 C SER A 46 -0.575 -22.496 6.389 1.00 0.00 C ATOM 390 O SER A 46 -0.729 -23.412 5.580 1.00 0.00 O ATOM 391 CB SER A 46 -2.216 -23.334 8.080 1.00 0.00 C ATOM 392 OG SER A 46 -3.353 -23.018 8.867 1.00 0.00 O ATOM 0 H SER A 46 -3.511 -22.085 6.316 1.00 0.00 H new ATOM 0 HA SER A 46 -1.288 -21.390 8.068 1.00 0.00 H new ATOM 0 HB2 SER A 46 -2.474 -24.109 7.358 1.00 0.00 H new ATOM 0 HB3 SER A 46 -1.431 -23.741 8.717 1.00 0.00 H new ATOM 0 HG SER A 46 -3.668 -23.825 9.325 1.00 0.00 H new ATOM 398 N GLY A 47 0.541 -21.790 6.472 1.00 0.00 N ATOM 399 CA GLY A 47 1.720 -22.181 5.732 1.00 0.00 C ATOM 400 C GLY A 47 1.895 -21.445 4.418 1.00 0.00 C ATOM 401 O GLY A 47 1.650 -20.240 4.327 1.00 0.00 O ATOM 0 H GLY A 47 0.651 -20.950 7.041 1.00 0.00 H new ATOM 0 HA2 GLY A 47 2.600 -22.010 6.353 1.00 0.00 H new ATOM 0 HA3 GLY A 47 1.674 -23.252 5.534 1.00 0.00 H new ATOM 405 N GLY A 48 2.289 -22.188 3.391 1.00 0.00 N ATOM 406 CA GLY A 48 2.729 -21.589 2.148 1.00 0.00 C ATOM 407 C GLY A 48 1.611 -21.260 1.179 1.00 0.00 C ATOM 408 O GLY A 48 1.758 -21.455 -0.026 1.00 0.00 O ATOM 0 H GLY A 48 2.311 -23.208 3.400 1.00 0.00 H new ATOM 0 HA2 GLY A 48 3.278 -20.675 2.374 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.428 -22.268 1.660 1.00 0.00 H new ATOM 412 N GLN A 49 0.489 -20.775 1.687 1.00 0.00 N ATOM 413 CA GLN A 49 -0.533 -20.211 0.820 1.00 0.00 C ATOM 414 C GLN A 49 -0.165 -18.769 0.520 1.00 0.00 C ATOM 415 O GLN A 49 -0.527 -18.211 -0.517 1.00 0.00 O ATOM 416 CB GLN A 49 -1.916 -20.299 1.460 1.00 0.00 C ATOM 417 CG GLN A 49 -2.413 -21.726 1.623 1.00 0.00 C ATOM 418 CD GLN A 49 -2.399 -22.491 0.314 1.00 0.00 C ATOM 419 OE1 GLN A 49 -1.410 -23.139 -0.029 1.00 0.00 O ATOM 420 NE2 GLN A 49 -3.484 -22.405 -0.436 1.00 0.00 N ATOM 0 H GLN A 49 0.264 -20.760 2.682 1.00 0.00 H new ATOM 0 HA GLN A 49 -0.577 -20.783 -0.107 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -1.888 -19.818 2.438 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -2.627 -19.741 0.850 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -1.790 -22.245 2.352 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -3.427 -21.712 2.023 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -4.283 -21.858 -0.116 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -3.522 -22.886 -1.335 1.00 0.00 H new ATOM 429 N ILE A 50 0.550 -18.176 1.467 1.00 0.00 N ATOM 430 CA ILE A 50 1.203 -16.895 1.268 1.00 0.00 C ATOM 431 C ILE A 50 2.691 -17.065 1.548 1.00 0.00 C ATOM 432 O ILE A 50 3.127 -17.025 2.699 1.00 0.00 O ATOM 433 CB ILE A 50 0.638 -15.769 2.175 1.00 0.00 C ATOM 434 CG1 ILE A 50 -0.834 -15.471 1.856 1.00 0.00 C ATOM 435 CG2 ILE A 50 1.468 -14.499 2.029 1.00 0.00 C ATOM 436 CD1 ILE A 50 -1.804 -16.488 2.415 1.00 0.00 C ATOM 0 H ILE A 50 0.692 -18.573 2.396 1.00 0.00 H new ATOM 0 HA ILE A 50 1.018 -16.589 0.238 1.00 0.00 H new ATOM 0 HB ILE A 50 0.696 -16.119 3.205 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -1.088 -14.487 2.250 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.958 -15.423 0.774 1.00 0.00 H new ATOM 0 HG21 ILE A 50 1.058 -13.720 2.672 1.00 0.00 H new ATOM 0 HG22 ILE A 50 2.499 -14.703 2.319 1.00 0.00 H new ATOM 0 HG23 ILE A 50 1.442 -14.164 0.992 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.822 -16.206 2.146 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.579 -17.471 2.002 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.711 -16.521 3.501 1.00 0.00 H new ATOM 448 N SER A 51 3.455 -17.313 0.501 1.00 0.00 N ATOM 449 CA SER A 51 4.890 -17.499 0.633 1.00 0.00 C ATOM 450 C SER A 51 5.611 -16.170 0.463 1.00 0.00 C ATOM 451 O SER A 51 6.601 -15.887 1.142 1.00 0.00 O ATOM 452 CB SER A 51 5.376 -18.506 -0.407 1.00 0.00 C ATOM 453 OG SER A 51 4.678 -19.736 -0.283 1.00 0.00 O ATOM 0 H SER A 51 3.106 -17.391 -0.454 1.00 0.00 H new ATOM 0 HA SER A 51 5.110 -17.884 1.629 1.00 0.00 H new ATOM 0 HB2 SER A 51 5.231 -18.100 -1.408 1.00 0.00 H new ATOM 0 HB3 SER A 51 6.446 -18.676 -0.283 1.00 0.00 H new ATOM 0 HG SER A 51 5.003 -20.366 -0.959 1.00 0.00 H new ATOM 459 N SER A 52 5.086 -15.349 -0.428 1.00 0.00 N ATOM 460 CA SER A 52 5.674 -14.060 -0.725 1.00 0.00 C ATOM 461 C SER A 52 4.582 -12.994 -0.767 1.00 0.00 C ATOM 462 O SER A 52 3.393 -13.328 -0.734 1.00 0.00 O ATOM 463 CB SER A 52 6.412 -14.136 -2.067 1.00 0.00 C ATOM 464 OG SER A 52 5.533 -14.508 -3.119 1.00 0.00 O ATOM 0 H SER A 52 4.243 -15.558 -0.963 1.00 0.00 H new ATOM 0 HA SER A 52 6.388 -13.790 0.053 1.00 0.00 H new ATOM 0 HB2 SER A 52 6.863 -13.169 -2.292 1.00 0.00 H new ATOM 0 HB3 SER A 52 7.225 -14.859 -1.997 1.00 0.00 H new ATOM 0 HG SER A 52 5.197 -15.414 -2.959 1.00 0.00 H new ATOM 470 N PRO A 53 4.955 -11.700 -0.821 1.00 0.00 N ATOM 471 CA PRO A 53 3.986 -10.610 -0.982 1.00 0.00 C ATOM 472 C PRO A 53 3.096 -10.822 -2.204 1.00 0.00 C ATOM 473 O PRO A 53 1.933 -10.413 -2.217 1.00 0.00 O ATOM 474 CB PRO A 53 4.864 -9.370 -1.164 1.00 0.00 C ATOM 475 CG PRO A 53 6.153 -9.715 -0.505 1.00 0.00 C ATOM 476 CD PRO A 53 6.337 -11.194 -0.705 1.00 0.00 C ATOM 0 HA PRO A 53 3.305 -10.535 -0.135 1.00 0.00 H new ATOM 0 HB2 PRO A 53 5.009 -9.140 -2.219 1.00 0.00 H new ATOM 0 HB3 PRO A 53 4.408 -8.492 -0.706 1.00 0.00 H new ATOM 0 HG2 PRO A 53 6.978 -9.156 -0.946 1.00 0.00 H new ATOM 0 HG3 PRO A 53 6.128 -9.465 0.556 1.00 0.00 H new ATOM 0 HD2 PRO A 53 6.920 -11.409 -1.601 1.00 0.00 H new ATOM 0 HD3 PRO A 53 6.863 -11.650 0.134 1.00 0.00 H new ATOM 484 N SER A 54 3.653 -11.477 -3.218 1.00 0.00 N ATOM 485 CA SER A 54 2.922 -11.792 -4.435 1.00 0.00 C ATOM 486 C SER A 54 1.755 -12.733 -4.144 1.00 0.00 C ATOM 487 O SER A 54 0.635 -12.496 -4.594 1.00 0.00 O ATOM 488 CB SER A 54 3.874 -12.420 -5.454 1.00 0.00 C ATOM 489 OG SER A 54 5.006 -11.592 -5.655 1.00 0.00 O ATOM 0 H SER A 54 4.620 -11.802 -3.217 1.00 0.00 H new ATOM 0 HA SER A 54 2.511 -10.870 -4.846 1.00 0.00 H new ATOM 0 HB2 SER A 54 4.193 -13.402 -5.105 1.00 0.00 H new ATOM 0 HB3 SER A 54 3.354 -12.571 -6.400 1.00 0.00 H new ATOM 0 HG SER A 54 5.605 -12.010 -6.308 1.00 0.00 H new ATOM 495 N ASP A 55 2.018 -13.789 -3.372 1.00 0.00 N ATOM 496 CA ASP A 55 0.977 -14.745 -2.992 1.00 0.00 C ATOM 497 C ASP A 55 -0.139 -14.039 -2.238 1.00 0.00 C ATOM 498 O ASP A 55 -1.322 -14.303 -2.456 1.00 0.00 O ATOM 499 CB ASP A 55 1.539 -15.857 -2.098 1.00 0.00 C ATOM 500 CG ASP A 55 2.579 -16.716 -2.780 1.00 0.00 C ATOM 501 OD1 ASP A 55 2.202 -17.708 -3.434 1.00 0.00 O ATOM 502 OD2 ASP A 55 3.782 -16.425 -2.630 1.00 0.00 O ATOM 0 H ASP A 55 2.942 -14.004 -2.998 1.00 0.00 H new ATOM 0 HA ASP A 55 0.591 -15.185 -3.911 1.00 0.00 H new ATOM 0 HB2 ASP A 55 1.978 -15.408 -1.207 1.00 0.00 H new ATOM 0 HB3 ASP A 55 0.719 -16.492 -1.763 1.00 0.00 H new ATOM 507 N LEU A 56 0.256 -13.137 -1.350 1.00 0.00 N ATOM 508 CA LEU A 56 -0.691 -12.393 -0.533 1.00 0.00 C ATOM 509 C LEU A 56 -1.533 -11.454 -1.390 1.00 0.00 C ATOM 510 O LEU A 56 -2.759 -11.437 -1.289 1.00 0.00 O ATOM 511 CB LEU A 56 0.053 -11.593 0.539 1.00 0.00 C ATOM 512 CG LEU A 56 -0.840 -10.803 1.496 1.00 0.00 C ATOM 513 CD1 LEU A 56 -1.780 -11.736 2.242 1.00 0.00 C ATOM 514 CD2 LEU A 56 0.007 -10.002 2.473 1.00 0.00 C ATOM 0 H LEU A 56 1.233 -12.902 -1.177 1.00 0.00 H new ATOM 0 HA LEU A 56 -1.357 -13.108 -0.051 1.00 0.00 H new ATOM 0 HB2 LEU A 56 0.666 -12.280 1.123 1.00 0.00 H new ATOM 0 HB3 LEU A 56 0.733 -10.899 0.045 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.442 -10.107 0.912 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -2.408 -11.156 2.918 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -2.410 -12.266 1.527 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -1.198 -12.457 2.816 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -0.644 -9.445 3.147 1.00 0.00 H new ATOM 0 HD22 LEU A 56 0.634 -10.680 3.052 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.638 -9.306 1.921 1.00 0.00 H new ATOM 526 N ARG A 57 -0.870 -10.688 -2.243 1.00 0.00 N ATOM 527 CA ARG A 57 -1.552 -9.708 -3.077 1.00 0.00 C ATOM 528 C ARG A 57 -2.375 -10.379 -4.168 1.00 0.00 C ATOM 529 O ARG A 57 -3.324 -9.791 -4.684 1.00 0.00 O ATOM 530 CB ARG A 57 -0.544 -8.715 -3.657 1.00 0.00 C ATOM 531 CG ARG A 57 -0.111 -7.683 -2.631 1.00 0.00 C ATOM 532 CD ARG A 57 1.081 -6.855 -3.088 1.00 0.00 C ATOM 533 NE ARG A 57 1.318 -5.721 -2.187 1.00 0.00 N ATOM 534 CZ ARG A 57 1.676 -5.834 -0.903 1.00 0.00 C ATOM 535 NH1 ARG A 57 1.934 -7.025 -0.376 1.00 0.00 N ATOM 536 NH2 ARG A 57 1.793 -4.750 -0.149 1.00 0.00 N ATOM 0 H ARG A 57 0.141 -10.726 -2.377 1.00 0.00 H new ATOM 0 HA ARG A 57 -2.253 -9.154 -2.452 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.330 -9.255 -4.020 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.985 -8.210 -4.516 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -0.948 -7.018 -2.417 1.00 0.00 H new ATOM 0 HG3 ARG A 57 0.141 -8.189 -1.699 1.00 0.00 H new ATOM 0 HD2 ARG A 57 1.970 -7.484 -3.126 1.00 0.00 H new ATOM 0 HD3 ARG A 57 0.906 -6.488 -4.099 1.00 0.00 H new ATOM 0 HE ARG A 57 1.202 -4.781 -2.566 1.00 0.00 H new ATOM 0 HH11 ARG A 57 1.860 -7.864 -0.951 1.00 0.00 H new ATOM 0 HH12 ARG A 57 2.206 -7.101 0.604 1.00 0.00 H new ATOM 0 HH21 ARG A 57 1.610 -3.829 -0.548 1.00 0.00 H new ATOM 0 HH22 ARG A 57 2.066 -4.837 0.830 1.00 0.00 H new ATOM 550 N GLU A 58 -2.017 -11.611 -4.508 1.00 0.00 N ATOM 551 CA GLU A 58 -2.837 -12.424 -5.395 1.00 0.00 C ATOM 552 C GLU A 58 -4.174 -12.705 -4.722 1.00 0.00 C ATOM 553 O GLU A 58 -5.234 -12.435 -5.287 1.00 0.00 O ATOM 554 CB GLU A 58 -2.108 -13.733 -5.743 1.00 0.00 C ATOM 555 CG GLU A 58 -2.890 -14.686 -6.641 1.00 0.00 C ATOM 556 CD GLU A 58 -3.729 -15.689 -5.867 1.00 0.00 C ATOM 557 OE1 GLU A 58 -3.144 -16.590 -5.227 1.00 0.00 O ATOM 558 OE2 GLU A 58 -4.974 -15.602 -5.913 1.00 0.00 O ATOM 0 H GLU A 58 -1.165 -12.068 -4.183 1.00 0.00 H new ATOM 0 HA GLU A 58 -3.017 -11.886 -6.326 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -1.165 -13.488 -6.232 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.861 -14.251 -4.816 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -3.541 -14.106 -7.295 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -2.192 -15.225 -7.282 1.00 0.00 H new ATOM 565 N LYS A 59 -4.104 -13.214 -3.495 1.00 0.00 N ATOM 566 CA LYS A 59 -5.297 -13.510 -2.710 1.00 0.00 C ATOM 567 C LYS A 59 -6.135 -12.257 -2.502 1.00 0.00 C ATOM 568 O LYS A 59 -7.314 -12.221 -2.845 1.00 0.00 O ATOM 569 CB LYS A 59 -4.907 -14.087 -1.345 1.00 0.00 C ATOM 570 CG LYS A 59 -4.141 -15.394 -1.419 1.00 0.00 C ATOM 571 CD LYS A 59 -4.972 -16.485 -2.069 1.00 0.00 C ATOM 572 CE LYS A 59 -4.229 -17.808 -2.101 1.00 0.00 C ATOM 573 NZ LYS A 59 -2.958 -17.719 -2.871 1.00 0.00 N ATOM 0 H LYS A 59 -3.227 -13.431 -3.021 1.00 0.00 H new ATOM 0 HA LYS A 59 -5.886 -14.243 -3.262 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -4.302 -13.354 -0.812 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -5.811 -14.242 -0.756 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -3.222 -15.248 -1.986 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.850 -15.705 -0.416 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -5.907 -16.605 -1.522 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -5.232 -16.188 -3.085 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -4.013 -18.126 -1.081 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -4.868 -18.571 -2.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -2.765 -18.633 -3.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -3.043 -16.979 -3.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -2.177 -17.483 -2.226 1.00 0.00 H new ATOM 587 N LEU A 60 -5.504 -11.229 -1.952 1.00 0.00 N ATOM 588 CA LEU A 60 -6.193 -9.997 -1.588 1.00 0.00 C ATOM 589 C LEU A 60 -6.925 -9.377 -2.777 1.00 0.00 C ATOM 590 O LEU A 60 -8.099 -9.028 -2.670 1.00 0.00 O ATOM 591 CB LEU A 60 -5.200 -8.993 -1.008 1.00 0.00 C ATOM 592 CG LEU A 60 -4.551 -9.404 0.314 1.00 0.00 C ATOM 593 CD1 LEU A 60 -3.508 -8.381 0.727 1.00 0.00 C ATOM 594 CD2 LEU A 60 -5.603 -9.559 1.402 1.00 0.00 C ATOM 0 H LEU A 60 -4.505 -11.224 -1.746 1.00 0.00 H new ATOM 0 HA LEU A 60 -6.940 -10.250 -0.836 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -4.413 -8.820 -1.742 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -5.713 -8.043 -0.862 1.00 0.00 H new ATOM 0 HG LEU A 60 -4.060 -10.367 0.174 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -3.053 -8.685 1.670 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -2.739 -8.315 -0.042 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -3.982 -7.407 0.850 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -5.121 -9.852 2.335 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -6.122 -8.611 1.544 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -6.320 -10.325 1.108 1.00 0.00 H new ATOM 606 N SER A 61 -6.238 -9.249 -3.907 1.00 0.00 N ATOM 607 CA SER A 61 -6.834 -8.643 -5.091 1.00 0.00 C ATOM 608 C SER A 61 -7.972 -9.505 -5.631 1.00 0.00 C ATOM 609 O SER A 61 -9.030 -8.993 -5.995 1.00 0.00 O ATOM 610 CB SER A 61 -5.776 -8.435 -6.175 1.00 0.00 C ATOM 611 OG SER A 61 -4.678 -7.691 -5.675 1.00 0.00 O ATOM 0 H SER A 61 -5.273 -9.555 -4.028 1.00 0.00 H new ATOM 0 HA SER A 61 -7.242 -7.674 -4.804 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.429 -9.402 -6.540 1.00 0.00 H new ATOM 0 HB3 SER A 61 -6.217 -7.913 -7.024 1.00 0.00 H new ATOM 0 HG SER A 61 -3.979 -8.306 -5.367 1.00 0.00 H new ATOM 617 N GLU A 62 -7.753 -10.814 -5.655 1.00 0.00 N ATOM 618 CA GLU A 62 -8.725 -11.747 -6.204 1.00 0.00 C ATOM 619 C GLU A 62 -9.992 -11.770 -5.344 1.00 0.00 C ATOM 620 O GLU A 62 -11.106 -11.726 -5.868 1.00 0.00 O ATOM 621 CB GLU A 62 -8.088 -13.139 -6.304 1.00 0.00 C ATOM 622 CG GLU A 62 -8.871 -14.143 -7.135 1.00 0.00 C ATOM 623 CD GLU A 62 -9.925 -14.879 -6.340 1.00 0.00 C ATOM 624 OE1 GLU A 62 -9.632 -15.289 -5.200 1.00 0.00 O ATOM 625 OE2 GLU A 62 -11.042 -15.071 -6.862 1.00 0.00 O ATOM 0 H GLU A 62 -6.905 -11.254 -5.298 1.00 0.00 H new ATOM 0 HA GLU A 62 -9.018 -11.425 -7.203 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.090 -13.036 -6.730 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -7.965 -13.539 -5.298 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -9.348 -13.624 -7.966 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -8.179 -14.866 -7.566 1.00 0.00 H new ATOM 632 N LEU A 63 -9.818 -11.802 -4.026 1.00 0.00 N ATOM 633 CA LEU A 63 -10.953 -11.828 -3.112 1.00 0.00 C ATOM 634 C LEU A 63 -11.690 -10.490 -3.132 1.00 0.00 C ATOM 635 O LEU A 63 -12.909 -10.439 -2.958 1.00 0.00 O ATOM 636 CB LEU A 63 -10.498 -12.148 -1.683 1.00 0.00 C ATOM 637 CG LEU A 63 -9.687 -13.440 -1.513 1.00 0.00 C ATOM 638 CD1 LEU A 63 -9.328 -13.650 -0.053 1.00 0.00 C ATOM 639 CD2 LEU A 63 -10.449 -14.644 -2.049 1.00 0.00 C ATOM 0 H LEU A 63 -8.906 -11.810 -3.570 1.00 0.00 H new ATOM 0 HA LEU A 63 -11.632 -12.612 -3.446 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -9.898 -11.314 -1.318 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -11.380 -12.209 -1.046 1.00 0.00 H new ATOM 0 HG LEU A 63 -8.769 -13.339 -2.091 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -8.753 -14.570 0.052 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -8.733 -12.808 0.300 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -10.240 -13.723 0.539 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -9.849 -15.544 -1.914 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -11.389 -14.750 -1.507 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -10.656 -14.501 -3.110 1.00 0.00 H new ATOM 651 N ALA A 64 -10.945 -9.411 -3.353 1.00 0.00 N ATOM 652 CA ALA A 64 -11.527 -8.075 -3.404 1.00 0.00 C ATOM 653 C ALA A 64 -12.411 -7.909 -4.635 1.00 0.00 C ATOM 654 O ALA A 64 -13.553 -7.455 -4.531 1.00 0.00 O ATOM 655 CB ALA A 64 -10.438 -7.015 -3.385 1.00 0.00 C ATOM 0 H ALA A 64 -9.936 -9.436 -3.500 1.00 0.00 H new ATOM 0 HA ALA A 64 -12.151 -7.947 -2.519 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -10.893 -6.025 -3.424 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -9.854 -7.110 -2.470 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -9.785 -7.148 -4.248 1.00 0.00 H new ATOM 661 N ASP A 65 -11.886 -8.287 -5.799 1.00 0.00 N ATOM 662 CA ASP A 65 -12.652 -8.216 -7.042 1.00 0.00 C ATOM 663 C ASP A 65 -13.836 -9.171 -7.001 1.00 0.00 C ATOM 664 O ASP A 65 -14.886 -8.899 -7.588 1.00 0.00 O ATOM 665 CB ASP A 65 -11.776 -8.532 -8.261 1.00 0.00 C ATOM 666 CG ASP A 65 -10.912 -7.360 -8.689 1.00 0.00 C ATOM 667 OD1 ASP A 65 -11.462 -6.370 -9.214 1.00 0.00 O ATOM 668 OD2 ASP A 65 -9.678 -7.428 -8.509 1.00 0.00 O ATOM 0 H ASP A 65 -10.937 -8.644 -5.908 1.00 0.00 H new ATOM 0 HA ASP A 65 -13.019 -7.194 -7.138 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -11.136 -9.383 -8.031 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -12.414 -8.829 -9.093 1.00 0.00 H new ATOM 673 N ALA A 66 -13.664 -10.290 -6.306 1.00 0.00 N ATOM 674 CA ALA A 66 -14.742 -11.255 -6.127 1.00 0.00 C ATOM 675 C ALA A 66 -15.875 -10.651 -5.303 1.00 0.00 C ATOM 676 O ALA A 66 -17.045 -10.978 -5.504 1.00 0.00 O ATOM 677 CB ALA A 66 -14.222 -12.524 -5.471 1.00 0.00 C ATOM 0 H ALA A 66 -12.786 -10.551 -5.857 1.00 0.00 H new ATOM 0 HA ALA A 66 -15.135 -11.513 -7.110 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -15.042 -13.231 -5.346 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -13.451 -12.969 -6.100 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -13.800 -12.283 -4.496 1.00 0.00 H new ATOM 683 N LYS A 67 -15.519 -9.776 -4.367 1.00 0.00 N ATOM 684 CA LYS A 67 -16.510 -9.033 -3.600 1.00 0.00 C ATOM 685 C LYS A 67 -17.116 -7.932 -4.461 1.00 0.00 C ATOM 686 O LYS A 67 -18.309 -7.649 -4.379 1.00 0.00 O ATOM 687 CB LYS A 67 -15.884 -8.419 -2.341 1.00 0.00 C ATOM 688 CG LYS A 67 -15.488 -9.435 -1.281 1.00 0.00 C ATOM 689 CD LYS A 67 -16.693 -10.205 -0.767 1.00 0.00 C ATOM 690 CE LYS A 67 -16.336 -11.073 0.430 1.00 0.00 C ATOM 691 NZ LYS A 67 -17.495 -11.881 0.893 1.00 0.00 N ATOM 0 H LYS A 67 -14.551 -9.565 -4.122 1.00 0.00 H new ATOM 0 HA LYS A 67 -17.292 -9.727 -3.293 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -15.001 -7.849 -2.629 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -16.591 -7.713 -1.905 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -14.761 -10.132 -1.698 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -15.000 -8.924 -0.451 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -17.480 -9.505 -0.487 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -17.092 -10.831 -1.565 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -15.513 -11.737 0.165 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -15.985 -10.441 1.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -17.211 -12.459 1.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -18.271 -11.247 1.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -17.814 -12.503 0.123 1.00 0.00 H new ATOM 705 N GLY A 68 -16.280 -7.320 -5.288 1.00 0.00 N ATOM 706 CA GLY A 68 -16.739 -6.272 -6.175 1.00 0.00 C ATOM 707 C GLY A 68 -15.932 -5.001 -6.020 1.00 0.00 C ATOM 708 O GLY A 68 -15.999 -4.104 -6.859 1.00 0.00 O ATOM 0 H GLY A 68 -15.285 -7.533 -5.360 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -16.676 -6.617 -7.207 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.789 -6.061 -5.973 1.00 0.00 H new ATOM 712 N GLY A 69 -15.145 -4.939 -4.956 1.00 0.00 N ATOM 713 CA GLY A 69 -14.386 -3.742 -4.662 1.00 0.00 C ATOM 714 C GLY A 69 -13.233 -3.534 -5.621 1.00 0.00 C ATOM 715 O GLY A 69 -12.598 -4.491 -6.058 1.00 0.00 O ATOM 0 H GLY A 69 -15.019 -5.700 -4.289 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -15.048 -2.877 -4.703 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -14.001 -3.801 -3.644 1.00 0.00 H new ATOM 719 N LYS A 70 -12.966 -2.280 -5.951 1.00 0.00 N ATOM 720 CA LYS A 70 -11.888 -1.944 -6.868 1.00 0.00 C ATOM 721 C LYS A 70 -10.620 -1.587 -6.105 1.00 0.00 C ATOM 722 O LYS A 70 -9.526 -1.602 -6.664 1.00 0.00 O ATOM 723 CB LYS A 70 -12.298 -0.777 -7.773 1.00 0.00 C ATOM 724 CG LYS A 70 -13.409 -1.102 -8.766 1.00 0.00 C ATOM 725 CD LYS A 70 -12.964 -2.119 -9.810 1.00 0.00 C ATOM 726 CE LYS A 70 -13.298 -3.547 -9.404 1.00 0.00 C ATOM 727 NZ LYS A 70 -14.760 -3.814 -9.447 1.00 0.00 N ATOM 0 H LYS A 70 -13.483 -1.476 -5.596 1.00 0.00 H new ATOM 0 HA LYS A 70 -11.687 -2.819 -7.487 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -12.621 0.055 -7.147 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.422 -0.439 -8.326 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -14.274 -1.490 -8.228 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -13.728 -0.187 -9.265 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -13.444 -1.893 -10.762 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -11.889 -2.030 -9.966 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -12.784 -4.242 -10.068 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -12.925 -3.733 -8.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -15.124 -3.907 -8.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -15.243 -3.026 -9.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -14.937 -4.696 -9.970 1.00 0.00 H new ATOM 741 N TYR A 71 -10.772 -1.271 -4.827 1.00 0.00 N ATOM 742 CA TYR A 71 -9.644 -0.868 -4.000 1.00 0.00 C ATOM 743 C TYR A 71 -9.657 -1.643 -2.691 1.00 0.00 C ATOM 744 O TYR A 71 -10.715 -2.050 -2.219 1.00 0.00 O ATOM 745 CB TYR A 71 -9.706 0.635 -3.695 1.00 0.00 C ATOM 746 CG TYR A 71 -10.022 1.505 -4.892 1.00 0.00 C ATOM 747 CD1 TYR A 71 -9.035 1.866 -5.802 1.00 0.00 C ATOM 748 CD2 TYR A 71 -11.311 1.969 -5.107 1.00 0.00 C ATOM 749 CE1 TYR A 71 -9.330 2.664 -6.892 1.00 0.00 C ATOM 750 CE2 TYR A 71 -11.613 2.764 -6.194 1.00 0.00 C ATOM 751 CZ TYR A 71 -10.620 3.111 -7.082 1.00 0.00 C ATOM 752 OH TYR A 71 -10.921 3.903 -8.165 1.00 0.00 O ATOM 0 H TYR A 71 -11.668 -1.286 -4.339 1.00 0.00 H new ATOM 0 HA TYR A 71 -8.726 -1.083 -4.547 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -10.461 0.806 -2.928 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -8.749 0.948 -3.277 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -8.023 1.518 -5.655 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -12.093 1.703 -4.411 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -8.553 2.936 -7.591 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -12.624 3.112 -6.347 1.00 0.00 H new ATOM 0 HH TYR A 71 -11.645 4.520 -7.928 1.00 0.00 H new ATOM 762 N TYR A 72 -8.486 -1.866 -2.117 1.00 0.00 N ATOM 763 CA TYR A 72 -8.393 -2.478 -0.801 1.00 0.00 C ATOM 764 C TYR A 72 -7.084 -2.088 -0.129 1.00 0.00 C ATOM 765 O TYR A 72 -6.139 -1.658 -0.795 1.00 0.00 O ATOM 766 CB TYR A 72 -8.506 -4.008 -0.892 1.00 0.00 C ATOM 767 CG TYR A 72 -7.307 -4.685 -1.517 1.00 0.00 C ATOM 768 CD1 TYR A 72 -6.226 -5.074 -0.736 1.00 0.00 C ATOM 769 CD2 TYR A 72 -7.253 -4.936 -2.881 1.00 0.00 C ATOM 770 CE1 TYR A 72 -5.129 -5.692 -1.296 1.00 0.00 C ATOM 771 CE2 TYR A 72 -6.159 -5.555 -3.449 1.00 0.00 C ATOM 772 CZ TYR A 72 -5.099 -5.929 -2.651 1.00 0.00 C ATOM 773 OH TYR A 72 -4.006 -6.554 -3.207 1.00 0.00 O ATOM 0 H TYR A 72 -7.588 -1.633 -2.541 1.00 0.00 H new ATOM 0 HA TYR A 72 -9.225 -2.111 -0.199 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -8.654 -4.410 0.110 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -9.394 -4.261 -1.471 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -6.246 -4.889 0.328 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -8.082 -4.642 -3.508 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -4.297 -5.989 -0.675 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -6.133 -5.745 -4.512 1.00 0.00 H new ATOM 0 HH TYR A 72 -4.257 -6.947 -4.069 1.00 0.00 H new ATOM 783 N HIS A 73 -7.030 -2.221 1.188 1.00 0.00 N ATOM 784 CA HIS A 73 -5.787 -2.017 1.915 1.00 0.00 C ATOM 785 C HIS A 73 -5.767 -2.856 3.183 1.00 0.00 C ATOM 786 O HIS A 73 -6.782 -2.976 3.868 1.00 0.00 O ATOM 787 CB HIS A 73 -5.586 -0.545 2.270 1.00 0.00 C ATOM 788 CG HIS A 73 -4.188 -0.231 2.712 1.00 0.00 C ATOM 789 ND1 HIS A 73 -3.808 -0.165 4.035 1.00 0.00 N ATOM 790 CD2 HIS A 73 -3.069 0.023 1.991 1.00 0.00 C ATOM 791 CE1 HIS A 73 -2.521 0.117 4.108 1.00 0.00 C ATOM 792 NE2 HIS A 73 -2.048 0.235 2.883 1.00 0.00 N ATOM 0 H HIS A 73 -7.829 -2.468 1.772 1.00 0.00 H new ATOM 0 HA HIS A 73 -4.971 -2.329 1.264 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -5.833 0.068 1.403 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -6.281 -0.271 3.063 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -4.425 -0.311 4.834 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -2.995 0.053 0.914 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -1.951 0.232 5.018 1.00 0.00 H new ATOM 801 N ILE A 74 -4.612 -3.432 3.488 1.00 0.00 N ATOM 802 CA ILE A 74 -4.439 -4.200 4.714 1.00 0.00 C ATOM 803 C ILE A 74 -4.478 -3.272 5.926 1.00 0.00 C ATOM 804 O ILE A 74 -3.849 -2.213 5.927 1.00 0.00 O ATOM 805 CB ILE A 74 -3.099 -4.967 4.711 1.00 0.00 C ATOM 806 CG1 ILE A 74 -2.971 -5.816 3.444 1.00 0.00 C ATOM 807 CG2 ILE A 74 -2.982 -5.843 5.952 1.00 0.00 C ATOM 808 CD1 ILE A 74 -1.637 -6.520 3.320 1.00 0.00 C ATOM 0 H ILE A 74 -3.779 -3.382 2.902 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.255 -4.920 4.770 1.00 0.00 H new ATOM 0 HB ILE A 74 -2.287 -4.240 4.724 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -3.768 -6.560 3.433 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.118 -5.178 2.573 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -2.031 -6.376 5.933 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -3.030 -5.218 6.844 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -3.801 -6.562 5.968 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.617 -7.103 2.399 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.836 -5.781 3.299 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -1.495 -7.184 4.173 1.00 0.00 H new ATOM 820 N ILE A 75 -5.233 -3.657 6.942 1.00 0.00 N ATOM 821 CA ILE A 75 -5.302 -2.878 8.168 1.00 0.00 C ATOM 822 C ILE A 75 -4.624 -3.621 9.312 1.00 0.00 C ATOM 823 O ILE A 75 -4.156 -3.009 10.273 1.00 0.00 O ATOM 824 CB ILE A 75 -6.758 -2.542 8.555 1.00 0.00 C ATOM 825 CG1 ILE A 75 -7.585 -3.821 8.735 1.00 0.00 C ATOM 826 CG2 ILE A 75 -7.381 -1.639 7.499 1.00 0.00 C ATOM 827 CD1 ILE A 75 -8.998 -3.574 9.221 1.00 0.00 C ATOM 0 H ILE A 75 -5.805 -4.501 6.943 1.00 0.00 H new ATOM 0 HA ILE A 75 -4.778 -1.940 7.983 1.00 0.00 H new ATOM 0 HB ILE A 75 -6.752 -2.013 9.508 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -7.626 -4.353 7.784 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -7.076 -4.474 9.444 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -8.408 -1.406 7.779 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -6.807 -0.715 7.426 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -7.374 -2.148 6.535 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -9.519 -4.526 9.324 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -8.968 -3.071 10.187 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -9.526 -2.947 8.502 1.00 0.00 H new ATOM 839 N ALA A 76 -4.565 -4.941 9.195 1.00 0.00 N ATOM 840 CA ALA A 76 -3.938 -5.772 10.208 1.00 0.00 C ATOM 841 C ALA A 76 -3.317 -7.009 9.577 1.00 0.00 C ATOM 842 O ALA A 76 -4.024 -7.912 9.131 1.00 0.00 O ATOM 843 CB ALA A 76 -4.953 -6.170 11.272 1.00 0.00 C ATOM 0 H ALA A 76 -4.947 -5.459 8.404 1.00 0.00 H new ATOM 0 HA ALA A 76 -3.145 -5.195 10.684 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -4.467 -6.792 12.024 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -5.353 -5.274 11.746 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -5.766 -6.729 10.808 1.00 0.00 H new ATOM 849 N ALA A 77 -1.997 -7.033 9.516 1.00 0.00 N ATOM 850 CA ALA A 77 -1.275 -8.185 8.997 1.00 0.00 C ATOM 851 C ALA A 77 -0.486 -8.843 10.116 1.00 0.00 C ATOM 852 O ALA A 77 0.533 -8.316 10.562 1.00 0.00 O ATOM 853 CB ALA A 77 -0.352 -7.771 7.860 1.00 0.00 C ATOM 0 H ALA A 77 -1.400 -6.265 9.821 1.00 0.00 H new ATOM 0 HA ALA A 77 -1.993 -8.904 8.602 1.00 0.00 H new ATOM 0 HB1 ALA A 77 0.179 -8.646 7.485 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -0.941 -7.332 7.055 1.00 0.00 H new ATOM 0 HB3 ALA A 77 0.368 -7.038 8.224 1.00 0.00 H new ATOM 859 N ARG A 78 -0.968 -9.983 10.580 1.00 0.00 N ATOM 860 CA ARG A 78 -0.359 -10.654 11.715 1.00 0.00 C ATOM 861 C ARG A 78 -0.158 -12.134 11.432 1.00 0.00 C ATOM 862 O ARG A 78 -0.967 -12.770 10.754 1.00 0.00 O ATOM 863 CB ARG A 78 -1.219 -10.464 12.969 1.00 0.00 C ATOM 864 CG ARG A 78 -2.655 -10.936 12.807 1.00 0.00 C ATOM 865 CD ARG A 78 -3.466 -10.694 14.070 1.00 0.00 C ATOM 866 NE ARG A 78 -3.544 -9.272 14.416 1.00 0.00 N ATOM 867 CZ ARG A 78 -4.315 -8.780 15.389 1.00 0.00 C ATOM 868 NH1 ARG A 78 -5.057 -9.592 16.131 1.00 0.00 N ATOM 869 NH2 ARG A 78 -4.333 -7.474 15.622 1.00 0.00 N ATOM 0 H ARG A 78 -1.779 -10.463 10.189 1.00 0.00 H new ATOM 0 HA ARG A 78 0.620 -10.207 11.887 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -0.761 -11.004 13.798 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -1.222 -9.408 13.239 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -3.119 -10.414 11.970 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -2.665 -11.999 12.565 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -4.473 -11.088 13.934 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -3.018 -11.243 14.898 1.00 0.00 H new ATOM 0 HE ARG A 78 -2.974 -8.617 13.880 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -5.040 -10.597 15.960 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -5.644 -9.211 16.873 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -3.759 -6.847 15.058 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -4.921 -7.097 16.365 1.00 0.00 H new ATOM 883 N GLU A 79 0.933 -12.673 11.940 1.00 0.00 N ATOM 884 CA GLU A 79 1.231 -14.079 11.765 1.00 0.00 C ATOM 885 C GLU A 79 0.787 -14.862 12.994 1.00 0.00 C ATOM 886 O GLU A 79 1.441 -14.840 14.040 1.00 0.00 O ATOM 887 CB GLU A 79 2.721 -14.273 11.500 1.00 0.00 C ATOM 888 CG GLU A 79 3.086 -15.675 11.058 1.00 0.00 C ATOM 889 CD GLU A 79 4.517 -15.768 10.592 1.00 0.00 C ATOM 890 OE1 GLU A 79 4.764 -15.524 9.397 1.00 0.00 O ATOM 891 OE2 GLU A 79 5.400 -16.076 11.414 1.00 0.00 O ATOM 0 H GLU A 79 1.629 -12.156 12.478 1.00 0.00 H new ATOM 0 HA GLU A 79 0.682 -14.457 10.902 1.00 0.00 H new ATOM 0 HB2 GLU A 79 3.039 -13.566 10.734 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.276 -14.032 12.406 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.929 -16.368 11.885 1.00 0.00 H new ATOM 0 HG3 GLU A 79 2.422 -15.985 10.251 1.00 0.00 H new ATOM 898 N HIS A 80 -0.336 -15.540 12.854 1.00 0.00 N ATOM 899 CA HIS A 80 -0.951 -16.285 13.943 1.00 0.00 C ATOM 900 C HIS A 80 -0.382 -17.701 13.977 1.00 0.00 C ATOM 901 O HIS A 80 -1.100 -18.680 13.754 1.00 0.00 O ATOM 902 CB HIS A 80 -2.467 -16.322 13.719 1.00 0.00 C ATOM 903 CG HIS A 80 -3.290 -16.644 14.928 1.00 0.00 C ATOM 904 ND1 HIS A 80 -4.553 -16.135 15.110 1.00 0.00 N ATOM 905 CD2 HIS A 80 -3.047 -17.433 16.001 1.00 0.00 C ATOM 906 CE1 HIS A 80 -5.052 -16.591 16.240 1.00 0.00 C ATOM 907 NE2 HIS A 80 -4.159 -17.382 16.801 1.00 0.00 N ATOM 0 H HIS A 80 -0.853 -15.592 11.976 1.00 0.00 H new ATOM 0 HA HIS A 80 -0.739 -15.803 14.898 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -2.783 -15.353 13.333 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -2.685 -17.059 12.946 1.00 0.00 H new ATOM 0 HD1 HIS A 80 -5.030 -15.502 14.469 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -2.146 -17.997 16.191 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -6.028 -16.357 16.640 1.00 0.00 H new ATOM 916 N GLY A 81 0.913 -17.802 14.227 1.00 0.00 N ATOM 917 CA GLY A 81 1.573 -19.088 14.183 1.00 0.00 C ATOM 918 C GLY A 81 1.752 -19.552 12.755 1.00 0.00 C ATOM 919 O GLY A 81 2.360 -18.846 11.948 1.00 0.00 O ATOM 0 H GLY A 81 1.519 -17.016 14.460 1.00 0.00 H new ATOM 0 HA2 GLY A 81 2.545 -19.020 14.672 1.00 0.00 H new ATOM 0 HA3 GLY A 81 0.987 -19.821 14.738 1.00 0.00 H new ATOM 923 N PRO A 82 1.222 -20.729 12.401 1.00 0.00 N ATOM 924 CA PRO A 82 1.211 -21.210 11.022 1.00 0.00 C ATOM 925 C PRO A 82 0.190 -20.453 10.182 1.00 0.00 C ATOM 926 O PRO A 82 0.305 -20.372 8.958 1.00 0.00 O ATOM 927 CB PRO A 82 0.809 -22.689 11.144 1.00 0.00 C ATOM 928 CG PRO A 82 0.843 -22.999 12.605 1.00 0.00 C ATOM 929 CD PRO A 82 0.615 -21.700 13.318 1.00 0.00 C ATOM 0 HA PRO A 82 2.173 -21.069 10.530 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -0.185 -22.860 10.731 1.00 0.00 H new ATOM 0 HB3 PRO A 82 1.498 -23.329 10.592 1.00 0.00 H new ATOM 0 HG2 PRO A 82 0.074 -23.726 12.866 1.00 0.00 H new ATOM 0 HG3 PRO A 82 1.802 -23.434 12.888 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -0.445 -21.503 13.475 1.00 0.00 H new ATOM 0 HD3 PRO A 82 1.091 -21.685 14.299 1.00 0.00 H new ATOM 937 N ASN A 83 -0.805 -19.889 10.856 1.00 0.00 N ATOM 938 CA ASN A 83 -1.874 -19.159 10.187 1.00 0.00 C ATOM 939 C ASN A 83 -1.455 -17.730 9.904 1.00 0.00 C ATOM 940 O ASN A 83 -1.408 -16.902 10.809 1.00 0.00 O ATOM 941 CB ASN A 83 -3.143 -19.140 11.042 1.00 0.00 C ATOM 942 CG ASN A 83 -3.821 -20.490 11.146 1.00 0.00 C ATOM 943 OD1 ASN A 83 -3.496 -21.295 12.018 1.00 0.00 O ATOM 944 ND2 ASN A 83 -4.789 -20.735 10.278 1.00 0.00 N ATOM 0 H ASN A 83 -0.893 -19.924 11.872 1.00 0.00 H new ATOM 0 HA ASN A 83 -2.078 -19.672 9.247 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -2.892 -18.790 12.043 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -3.845 -18.421 10.620 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -5.297 -21.619 10.317 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -5.027 -20.040 9.570 1.00 0.00 H new ATOM 951 N PHE A 84 -1.140 -17.440 8.661 1.00 0.00 N ATOM 952 CA PHE A 84 -0.857 -16.075 8.271 1.00 0.00 C ATOM 953 C PHE A 84 -2.176 -15.360 8.026 1.00 0.00 C ATOM 954 O PHE A 84 -2.928 -15.740 7.130 1.00 0.00 O ATOM 955 CB PHE A 84 0.023 -16.032 7.022 1.00 0.00 C ATOM 956 CG PHE A 84 0.421 -14.634 6.638 1.00 0.00 C ATOM 957 CD1 PHE A 84 1.380 -13.949 7.369 1.00 0.00 C ATOM 958 CD2 PHE A 84 -0.168 -14.003 5.555 1.00 0.00 C ATOM 959 CE1 PHE A 84 1.744 -12.663 7.024 1.00 0.00 C ATOM 960 CE2 PHE A 84 0.194 -12.716 5.205 1.00 0.00 C ATOM 961 CZ PHE A 84 1.151 -12.045 5.942 1.00 0.00 C ATOM 0 H PHE A 84 -1.073 -18.124 7.908 1.00 0.00 H new ATOM 0 HA PHE A 84 -0.308 -15.575 9.069 1.00 0.00 H new ATOM 0 HB2 PHE A 84 0.920 -16.626 7.195 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -0.510 -16.494 6.191 1.00 0.00 H new ATOM 0 HD1 PHE A 84 1.847 -14.427 8.217 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -0.918 -14.522 4.978 1.00 0.00 H new ATOM 0 HE1 PHE A 84 2.493 -12.141 7.601 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -0.270 -12.235 4.357 1.00 0.00 H new ATOM 0 HZ PHE A 84 1.434 -11.039 5.672 1.00 0.00 H new ATOM 971 N GLU A 85 -2.465 -14.350 8.839 1.00 0.00 N ATOM 972 CA GLU A 85 -3.753 -13.679 8.778 1.00 0.00 C ATOM 973 C GLU A 85 -3.601 -12.234 8.327 1.00 0.00 C ATOM 974 O GLU A 85 -3.073 -11.388 9.052 1.00 0.00 O ATOM 975 CB GLU A 85 -4.449 -13.731 10.140 1.00 0.00 C ATOM 976 CG GLU A 85 -4.519 -15.130 10.725 1.00 0.00 C ATOM 977 CD GLU A 85 -5.520 -15.250 11.852 1.00 0.00 C ATOM 978 OE1 GLU A 85 -5.277 -14.697 12.944 1.00 0.00 O ATOM 979 OE2 GLU A 85 -6.556 -15.917 11.652 1.00 0.00 O ATOM 0 H GLU A 85 -1.827 -13.981 9.544 1.00 0.00 H new ATOM 0 HA GLU A 85 -4.366 -14.203 8.045 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -3.920 -13.080 10.836 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -5.460 -13.336 10.039 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -4.782 -15.835 9.936 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -3.532 -15.415 11.091 1.00 0.00 H new ATOM 986 N ALA A 86 -4.062 -11.964 7.118 1.00 0.00 N ATOM 987 CA ALA A 86 -4.063 -10.615 6.584 1.00 0.00 C ATOM 988 C ALA A 86 -5.486 -10.084 6.514 1.00 0.00 C ATOM 989 O ALA A 86 -6.327 -10.623 5.793 1.00 0.00 O ATOM 990 CB ALA A 86 -3.413 -10.586 5.211 1.00 0.00 C ATOM 0 H ALA A 86 -4.443 -12.667 6.485 1.00 0.00 H new ATOM 0 HA ALA A 86 -3.484 -9.974 7.248 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -3.422 -9.567 4.825 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -2.383 -10.935 5.288 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -3.966 -11.235 4.533 1.00 0.00 H new ATOM 996 N VAL A 87 -5.758 -9.045 7.285 1.00 0.00 N ATOM 997 CA VAL A 87 -7.075 -8.430 7.303 1.00 0.00 C ATOM 998 C VAL A 87 -7.052 -7.120 6.524 1.00 0.00 C ATOM 999 O VAL A 87 -6.266 -6.219 6.831 1.00 0.00 O ATOM 1000 CB VAL A 87 -7.552 -8.165 8.747 1.00 0.00 C ATOM 1001 CG1 VAL A 87 -8.965 -7.598 8.755 1.00 0.00 C ATOM 1002 CG2 VAL A 87 -7.479 -9.439 9.577 1.00 0.00 C ATOM 0 H VAL A 87 -5.081 -8.608 7.910 1.00 0.00 H new ATOM 0 HA VAL A 87 -7.773 -9.123 6.833 1.00 0.00 H new ATOM 0 HB VAL A 87 -6.888 -7.425 9.195 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -9.280 -7.419 9.783 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -8.983 -6.659 8.202 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -9.645 -8.309 8.286 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -7.819 -9.232 10.592 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -8.116 -10.202 9.129 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -6.450 -9.796 9.605 1.00 0.00 H new ATOM 1012 N ALA A 88 -7.908 -7.020 5.518 1.00 0.00 N ATOM 1013 CA ALA A 88 -7.942 -5.849 4.654 1.00 0.00 C ATOM 1014 C ALA A 88 -9.376 -5.389 4.422 1.00 0.00 C ATOM 1015 O ALA A 88 -10.301 -6.196 4.429 1.00 0.00 O ATOM 1016 CB ALA A 88 -7.265 -6.160 3.326 1.00 0.00 C ATOM 0 H ALA A 88 -8.591 -7.739 5.279 1.00 0.00 H new ATOM 0 HA ALA A 88 -7.401 -5.041 5.147 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -7.296 -5.278 2.687 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -6.228 -6.443 3.504 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.787 -6.982 2.835 1.00 0.00 H new ATOM 1022 N GLU A 89 -9.560 -4.094 4.214 1.00 0.00 N ATOM 1023 CA GLU A 89 -10.888 -3.562 3.951 1.00 0.00 C ATOM 1024 C GLU A 89 -11.059 -3.289 2.464 1.00 0.00 C ATOM 1025 O GLU A 89 -10.113 -2.883 1.784 1.00 0.00 O ATOM 1026 CB GLU A 89 -11.144 -2.288 4.758 1.00 0.00 C ATOM 1027 CG GLU A 89 -11.058 -2.494 6.261 1.00 0.00 C ATOM 1028 CD GLU A 89 -11.715 -1.376 7.040 1.00 0.00 C ATOM 1029 OE1 GLU A 89 -11.075 -0.324 7.247 1.00 0.00 O ATOM 1030 OE2 GLU A 89 -12.885 -1.545 7.447 1.00 0.00 O ATOM 0 H GLU A 89 -8.814 -3.398 4.222 1.00 0.00 H new ATOM 0 HA GLU A 89 -11.619 -4.308 4.262 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -10.421 -1.528 4.462 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -12.132 -1.902 4.508 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -11.531 -3.441 6.522 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -10.011 -2.570 6.554 1.00 0.00 H new ATOM 1037 N VAL A 90 -12.268 -3.520 1.971 1.00 0.00 N ATOM 1038 CA VAL A 90 -12.561 -3.405 0.549 1.00 0.00 C ATOM 1039 C VAL A 90 -13.301 -2.105 0.251 1.00 0.00 C ATOM 1040 O VAL A 90 -14.304 -1.783 0.896 1.00 0.00 O ATOM 1041 CB VAL A 90 -13.412 -4.597 0.061 1.00 0.00 C ATOM 1042 CG1 VAL A 90 -13.616 -4.538 -1.445 1.00 0.00 C ATOM 1043 CG2 VAL A 90 -12.768 -5.913 0.460 1.00 0.00 C ATOM 0 H VAL A 90 -13.069 -3.791 2.542 1.00 0.00 H new ATOM 0 HA VAL A 90 -11.609 -3.406 0.019 1.00 0.00 H new ATOM 0 HB VAL A 90 -14.389 -4.532 0.539 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -14.218 -5.388 -1.764 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -14.128 -3.612 -1.707 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -12.648 -4.571 -1.945 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -13.383 -6.741 0.107 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -11.776 -5.982 0.014 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -12.682 -5.962 1.546 1.00 0.00 H new ATOM 1053 N TYR A 91 -12.800 -1.373 -0.730 1.00 0.00 N ATOM 1054 CA TYR A 91 -13.384 -0.103 -1.129 1.00 0.00 C ATOM 1055 C TYR A 91 -13.681 -0.102 -2.623 1.00 0.00 C ATOM 1056 O TYR A 91 -13.149 -0.918 -3.377 1.00 0.00 O ATOM 1057 CB TYR A 91 -12.434 1.051 -0.792 1.00 0.00 C ATOM 1058 CG TYR A 91 -12.221 1.262 0.690 1.00 0.00 C ATOM 1059 CD1 TYR A 91 -11.274 0.523 1.388 1.00 0.00 C ATOM 1060 CD2 TYR A 91 -12.968 2.199 1.390 1.00 0.00 C ATOM 1061 CE1 TYR A 91 -11.082 0.711 2.744 1.00 0.00 C ATOM 1062 CE2 TYR A 91 -12.782 2.394 2.743 1.00 0.00 C ATOM 1063 CZ TYR A 91 -11.838 1.648 3.416 1.00 0.00 C ATOM 1064 OH TYR A 91 -11.655 1.836 4.767 1.00 0.00 O ATOM 0 H TYR A 91 -11.978 -1.642 -1.272 1.00 0.00 H new ATOM 0 HA TYR A 91 -14.316 0.032 -0.581 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -11.469 0.863 -1.264 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -12.828 1.970 -1.226 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -10.679 -0.210 0.863 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -13.708 2.786 0.866 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -10.344 0.127 3.274 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -13.373 3.127 3.272 1.00 0.00 H new ATOM 0 HH TYR A 91 -12.266 2.533 5.086 1.00 0.00 H new ATOM 1074 N ASN A 92 -14.535 0.809 -3.044 1.00 0.00 N ATOM 1075 CA ASN A 92 -14.856 0.962 -4.452 1.00 0.00 C ATOM 1076 C ASN A 92 -14.880 2.443 -4.806 1.00 0.00 C ATOM 1077 O ASN A 92 -14.721 3.300 -3.935 1.00 0.00 O ATOM 1078 CB ASN A 92 -16.208 0.312 -4.769 1.00 0.00 C ATOM 1079 CG ASN A 92 -16.323 -0.141 -6.216 1.00 0.00 C ATOM 1080 OD1 ASN A 92 -15.702 0.423 -7.115 1.00 0.00 O ATOM 1081 ND2 ASN A 92 -17.115 -1.171 -6.448 1.00 0.00 N ATOM 0 H ASN A 92 -15.023 1.459 -2.428 1.00 0.00 H new ATOM 0 HA ASN A 92 -14.094 0.463 -5.050 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -16.356 -0.545 -4.112 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -17.006 1.022 -4.551 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -17.227 -1.524 -7.398 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -17.615 -1.614 -5.677 1.00 0.00 H new ATOM 1088 N ASP A 93 -15.072 2.736 -6.078 1.00 0.00 N ATOM 1089 CA ASP A 93 -15.110 4.105 -6.559 1.00 0.00 C ATOM 1090 C ASP A 93 -16.553 4.600 -6.560 1.00 0.00 C ATOM 1091 O ASP A 93 -17.467 3.860 -6.193 1.00 0.00 O ATOM 1092 CB ASP A 93 -14.521 4.158 -7.973 1.00 0.00 C ATOM 1093 CG ASP A 93 -14.098 5.551 -8.390 1.00 0.00 C ATOM 1094 OD1 ASP A 93 -14.929 6.284 -8.965 1.00 0.00 O ATOM 1095 OD2 ASP A 93 -12.925 5.908 -8.155 1.00 0.00 O ATOM 0 H ASP A 93 -15.206 2.034 -6.806 1.00 0.00 H new ATOM 0 HA ASP A 93 -14.520 4.749 -5.907 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -13.660 3.492 -8.026 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -15.259 3.782 -8.682 1.00 0.00 H new ATOM 1100 N ALA A 94 -16.771 5.832 -6.994 1.00 0.00 N ATOM 1101 CA ALA A 94 -18.114 6.391 -7.057 1.00 0.00 C ATOM 1102 C ALA A 94 -18.807 5.950 -8.344 1.00 0.00 C ATOM 1103 O ALA A 94 -19.843 6.490 -8.734 1.00 0.00 O ATOM 1104 CB ALA A 94 -18.061 7.908 -6.958 1.00 0.00 C ATOM 0 H ALA A 94 -16.035 6.465 -7.308 1.00 0.00 H new ATOM 0 HA ALA A 94 -18.693 6.018 -6.212 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -19.072 8.311 -7.007 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -17.601 8.195 -6.012 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -17.472 8.306 -7.784 1.00 0.00 H new ATOM 1110 N THR A 95 -18.220 4.946 -8.987 1.00 0.00 N ATOM 1111 CA THR A 95 -18.771 4.363 -10.199 1.00 0.00 C ATOM 1112 C THR A 95 -20.107 3.681 -9.901 1.00 0.00 C ATOM 1113 O THR A 95 -20.964 3.555 -10.777 1.00 0.00 O ATOM 1114 CB THR A 95 -17.776 3.354 -10.828 1.00 0.00 C ATOM 1115 OG1 THR A 95 -18.322 2.780 -12.022 1.00 0.00 O ATOM 1116 CG2 THR A 95 -17.418 2.246 -9.845 1.00 0.00 C ATOM 0 H THR A 95 -17.348 4.515 -8.680 1.00 0.00 H new ATOM 0 HA THR A 95 -18.941 5.165 -10.917 1.00 0.00 H new ATOM 0 HB THR A 95 -16.868 3.903 -11.079 1.00 0.00 H new ATOM 0 HG1 THR A 95 -17.679 2.147 -12.405 1.00 0.00 H new ATOM 0 HG21 THR A 95 -16.719 1.554 -10.315 1.00 0.00 H new ATOM 0 HG22 THR A 95 -16.957 2.681 -8.958 1.00 0.00 H new ATOM 0 HG23 THR A 95 -18.322 1.709 -9.557 1.00 0.00 H new ATOM 1124 N LYS A 96 -20.284 3.260 -8.654 1.00 0.00 N ATOM 1125 CA LYS A 96 -21.546 2.694 -8.209 1.00 0.00 C ATOM 1126 C LYS A 96 -22.109 3.523 -7.062 1.00 0.00 C ATOM 1127 O LYS A 96 -22.111 3.096 -5.903 1.00 0.00 O ATOM 1128 CB LYS A 96 -21.379 1.235 -7.785 1.00 0.00 C ATOM 1129 CG LYS A 96 -21.089 0.291 -8.940 1.00 0.00 C ATOM 1130 CD LYS A 96 -20.947 -1.141 -8.458 1.00 0.00 C ATOM 1131 CE LYS A 96 -20.772 -2.114 -9.613 1.00 0.00 C ATOM 1132 NZ LYS A 96 -21.977 -2.178 -10.482 1.00 0.00 N ATOM 0 H LYS A 96 -19.564 3.302 -7.932 1.00 0.00 H new ATOM 0 HA LYS A 96 -22.247 2.718 -9.043 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -20.568 1.167 -7.060 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -22.287 0.907 -7.279 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -21.893 0.352 -9.673 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -20.173 0.600 -9.444 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -20.090 -1.215 -7.788 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -21.829 -1.419 -7.880 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -19.911 -1.815 -10.211 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -20.557 -3.107 -9.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -21.905 -2.999 -11.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -22.827 -2.271 -9.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -22.043 -1.308 -11.048 1.00 0.00 H new ATOM 1146 N LEU A 97 -22.554 4.721 -7.394 1.00 0.00 N ATOM 1147 CA LEU A 97 -23.121 5.631 -6.419 1.00 0.00 C ATOM 1148 C LEU A 97 -24.637 5.621 -6.523 1.00 0.00 C ATOM 1149 O LEU A 97 -25.205 6.063 -7.525 1.00 0.00 O ATOM 1150 CB LEU A 97 -22.587 7.048 -6.638 1.00 0.00 C ATOM 1151 CG LEU A 97 -23.104 8.101 -5.655 1.00 0.00 C ATOM 1152 CD1 LEU A 97 -22.630 7.797 -4.242 1.00 0.00 C ATOM 1153 CD2 LEU A 97 -22.659 9.492 -6.083 1.00 0.00 C ATOM 0 H LEU A 97 -22.532 5.089 -8.345 1.00 0.00 H new ATOM 0 HA LEU A 97 -22.831 5.302 -5.421 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -21.499 7.022 -6.578 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -22.843 7.363 -7.650 1.00 0.00 H new ATOM 0 HG LEU A 97 -24.194 8.071 -5.661 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -23.009 8.558 -3.560 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -23.001 6.819 -3.937 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -21.540 7.796 -4.216 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -23.035 10.229 -5.373 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -21.570 9.534 -6.107 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -23.053 9.711 -7.076 1.00 0.00 H new ATOM 1165 N GLU A 98 -25.285 5.097 -5.498 1.00 0.00 N ATOM 1166 CA GLU A 98 -26.734 5.032 -5.468 1.00 0.00 C ATOM 1167 C GLU A 98 -27.311 6.362 -5.012 1.00 0.00 C ATOM 1168 O GLU A 98 -27.003 6.841 -3.920 1.00 0.00 O ATOM 1169 CB GLU A 98 -27.202 3.914 -4.544 1.00 0.00 C ATOM 1170 CG GLU A 98 -26.657 2.549 -4.923 1.00 0.00 C ATOM 1171 CD GLU A 98 -27.184 1.451 -4.031 1.00 0.00 C ATOM 1172 OE1 GLU A 98 -26.754 1.375 -2.862 1.00 0.00 O ATOM 1173 OE2 GLU A 98 -28.029 0.660 -4.491 1.00 0.00 O ATOM 0 H GLU A 98 -24.828 4.709 -4.673 1.00 0.00 H new ATOM 0 HA GLU A 98 -27.089 4.820 -6.476 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -26.900 4.147 -3.523 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -28.291 3.877 -4.554 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -26.920 2.330 -5.958 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -25.569 2.567 -4.868 1.00 0.00 H new ATOM 1180 N HIS A 99 -28.144 6.951 -5.853 1.00 0.00 N ATOM 1181 CA HIS A 99 -28.741 8.247 -5.558 1.00 0.00 C ATOM 1182 C HIS A 99 -29.740 8.137 -4.417 1.00 0.00 C ATOM 1183 O HIS A 99 -29.646 8.857 -3.424 1.00 0.00 O ATOM 1184 CB HIS A 99 -29.418 8.828 -6.802 1.00 0.00 C ATOM 1185 CG HIS A 99 -28.453 9.393 -7.798 1.00 0.00 C ATOM 1186 ND1 HIS A 99 -28.446 10.720 -8.166 1.00 0.00 N ATOM 1187 CD2 HIS A 99 -27.459 8.805 -8.505 1.00 0.00 C ATOM 1188 CE1 HIS A 99 -27.493 10.925 -9.054 1.00 0.00 C ATOM 1189 NE2 HIS A 99 -26.878 9.778 -9.276 1.00 0.00 N ATOM 0 H HIS A 99 -28.424 6.552 -6.749 1.00 0.00 H new ATOM 0 HA HIS A 99 -27.942 8.922 -5.251 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -30.009 8.048 -7.282 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -30.112 9.611 -6.496 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -27.177 7.763 -8.468 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -27.256 11.870 -9.520 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -26.097 9.639 -9.917 1.00 0.00 H new ATOM 1198 N HIS A 100 -30.692 7.229 -4.548 1.00 0.00 N ATOM 1199 CA HIS A 100 -31.685 7.033 -3.507 1.00 0.00 C ATOM 1200 C HIS A 100 -31.789 5.563 -3.146 1.00 0.00 C ATOM 1201 O HIS A 100 -32.329 4.764 -3.908 1.00 0.00 O ATOM 1202 CB HIS A 100 -33.055 7.569 -3.943 1.00 0.00 C ATOM 1203 CG HIS A 100 -34.101 7.494 -2.867 1.00 0.00 C ATOM 1204 ND1 HIS A 100 -34.377 8.539 -2.013 1.00 0.00 N ATOM 1205 CD2 HIS A 100 -34.938 6.489 -2.507 1.00 0.00 C ATOM 1206 CE1 HIS A 100 -35.330 8.181 -1.174 1.00 0.00 C ATOM 1207 NE2 HIS A 100 -35.691 6.943 -1.452 1.00 0.00 N ATOM 0 H HIS A 100 -30.798 6.620 -5.359 1.00 0.00 H new ATOM 0 HA HIS A 100 -31.365 7.592 -2.627 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -32.946 8.606 -4.260 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -33.397 7.005 -4.811 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -35.001 5.513 -2.965 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -35.745 8.798 -0.391 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -36.411 6.411 -0.964 1.00 0.00 H new ATOM 1216 N HIS A 101 -31.268 5.207 -1.985 1.00 0.00 N ATOM 1217 CA HIS A 101 -31.393 3.844 -1.495 1.00 0.00 C ATOM 1218 C HIS A 101 -31.928 3.840 -0.071 1.00 0.00 C ATOM 1219 O HIS A 101 -31.590 4.706 0.735 1.00 0.00 O ATOM 1220 CB HIS A 101 -30.067 3.058 -1.605 1.00 0.00 C ATOM 1221 CG HIS A 101 -28.867 3.669 -0.930 1.00 0.00 C ATOM 1222 ND1 HIS A 101 -27.578 3.260 -1.197 1.00 0.00 N ATOM 1223 CD2 HIS A 101 -28.754 4.645 0.001 1.00 0.00 C ATOM 1224 CE1 HIS A 101 -26.733 3.951 -0.458 1.00 0.00 C ATOM 1225 NE2 HIS A 101 -27.420 4.799 0.277 1.00 0.00 N ATOM 0 H HIS A 101 -30.757 5.837 -1.367 1.00 0.00 H new ATOM 0 HA HIS A 101 -32.110 3.328 -2.134 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -30.224 2.063 -1.187 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -29.834 2.927 -2.662 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -27.318 2.534 -1.864 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -29.566 5.201 0.445 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -25.659 3.840 -0.456 1.00 0.00 H new ATOM 1234 N HIS A 102 -32.785 2.879 0.220 1.00 0.00 N ATOM 1235 CA HIS A 102 -33.394 2.760 1.539 1.00 0.00 C ATOM 1236 C HIS A 102 -33.541 1.284 1.878 1.00 0.00 C ATOM 1237 O HIS A 102 -34.575 0.670 1.618 1.00 0.00 O ATOM 1238 CB HIS A 102 -34.743 3.512 1.598 1.00 0.00 C ATOM 1239 CG HIS A 102 -35.839 2.978 0.707 1.00 0.00 C ATOM 1240 ND1 HIS A 102 -35.631 2.487 -0.569 1.00 0.00 N ATOM 1241 CD2 HIS A 102 -37.170 2.864 0.933 1.00 0.00 C ATOM 1242 CE1 HIS A 102 -36.785 2.102 -1.081 1.00 0.00 C ATOM 1243 NE2 HIS A 102 -37.735 2.318 -0.191 1.00 0.00 N ATOM 0 H HIS A 102 -33.079 2.162 -0.443 1.00 0.00 H new ATOM 0 HA HIS A 102 -32.753 3.227 2.287 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -35.100 3.497 2.628 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -34.566 4.555 1.337 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -37.691 3.151 1.834 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -36.928 1.680 -2.065 1.00 0.00 H new ATOM 0 HE2 HIS A 102 -38.726 2.113 -0.318 1.00 0.00 H new ATOM 1252 N HIS A 103 -32.466 0.717 2.427 1.00 0.00 N ATOM 1253 CA HIS A 103 -32.284 -0.737 2.507 1.00 0.00 C ATOM 1254 C HIS A 103 -32.040 -1.274 1.100 1.00 0.00 C ATOM 1255 O HIS A 103 -31.037 -1.936 0.834 1.00 0.00 O ATOM 1256 CB HIS A 103 -33.486 -1.436 3.157 1.00 0.00 C ATOM 1257 CG HIS A 103 -33.685 -1.070 4.596 1.00 0.00 C ATOM 1258 ND1 HIS A 103 -34.623 -0.154 5.024 1.00 0.00 N ATOM 1259 CD2 HIS A 103 -33.053 -1.504 5.710 1.00 0.00 C ATOM 1260 CE1 HIS A 103 -34.558 -0.043 6.336 1.00 0.00 C ATOM 1261 NE2 HIS A 103 -33.615 -0.851 6.776 1.00 0.00 N ATOM 0 H HIS A 103 -31.696 1.251 2.829 1.00 0.00 H new ATOM 0 HA HIS A 103 -31.425 -0.948 3.143 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -34.388 -1.185 2.599 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -33.354 -2.515 3.080 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -32.254 -2.230 5.752 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -35.173 0.601 6.947 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -33.346 -0.971 7.753 1.00 0.00 H new ATOM 1270 N HIS A 104 -32.963 -0.964 0.206 1.00 0.00 N ATOM 1271 CA HIS A 104 -32.779 -1.173 -1.213 1.00 0.00 C ATOM 1272 C HIS A 104 -33.617 -0.142 -1.967 1.00 0.00 C ATOM 1273 O HIS A 104 -33.326 1.073 -1.839 1.00 0.00 O ATOM 1274 CB HIS A 104 -33.177 -2.599 -1.610 1.00 0.00 C ATOM 1275 CG HIS A 104 -32.751 -2.979 -2.996 1.00 0.00 C ATOM 1276 ND1 HIS A 104 -33.551 -2.809 -4.104 1.00 0.00 N ATOM 1277 CD2 HIS A 104 -31.599 -3.527 -3.449 1.00 0.00 C ATOM 1278 CE1 HIS A 104 -32.913 -3.236 -5.176 1.00 0.00 C ATOM 1279 NE2 HIS A 104 -31.727 -3.677 -4.807 1.00 0.00 N ATOM 1280 OXT HIS A 104 -34.574 -0.532 -2.657 1.00 0.00 O ATOM 0 H HIS A 104 -33.866 -0.558 0.450 1.00 0.00 H new ATOM 0 HA HIS A 104 -31.727 -1.048 -1.470 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -32.739 -3.300 -0.900 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -34.259 -2.700 -1.531 1.00 0.00 H new ATOM 0 HD1 HIS A 104 -34.491 -2.414 -4.097 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -30.740 -3.796 -2.853 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -33.297 -3.226 -6.185 1.00 0.00 H new TER 1289 HIS A 104 ATOM 1290 N ALA B 22 7.510 0.329 -8.636 1.00 0.00 N ATOM 1291 CA ALA B 22 7.613 -0.221 -7.269 1.00 0.00 C ATOM 1292 C ALA B 22 6.222 -0.380 -6.678 1.00 0.00 C ATOM 1293 O ALA B 22 5.276 0.259 -7.140 1.00 0.00 O ATOM 1294 CB ALA B 22 8.466 0.691 -6.398 1.00 0.00 C ATOM 0 HA ALA B 22 8.092 -1.199 -7.309 1.00 0.00 H new ATOM 0 HB1 ALA B 22 8.534 0.275 -5.393 1.00 0.00 H new ATOM 0 HB2 ALA B 22 9.465 0.772 -6.826 1.00 0.00 H new ATOM 0 HB3 ALA B 22 8.010 1.680 -6.351 1.00 0.00 H new ATOM 1302 N GLU B 23 6.088 -1.222 -5.663 1.00 0.00 N ATOM 1303 CA GLU B 23 4.781 -1.472 -5.066 1.00 0.00 C ATOM 1304 C GLU B 23 4.716 -0.903 -3.655 1.00 0.00 C ATOM 1305 O GLU B 23 5.745 -0.740 -2.996 1.00 0.00 O ATOM 1306 CB GLU B 23 4.470 -2.970 -5.044 1.00 0.00 C ATOM 1307 CG GLU B 23 4.510 -3.623 -6.418 1.00 0.00 C ATOM 1308 CD GLU B 23 3.732 -2.843 -7.461 1.00 0.00 C ATOM 1309 OE1 GLU B 23 2.571 -2.473 -7.192 1.00 0.00 O ATOM 1310 OE2 GLU B 23 4.295 -2.579 -8.546 1.00 0.00 O ATOM 0 H GLU B 23 6.858 -1.739 -5.239 1.00 0.00 H new ATOM 0 HA GLU B 23 4.031 -0.972 -5.679 1.00 0.00 H new ATOM 0 HB2 GLU B 23 5.186 -3.471 -4.392 1.00 0.00 H new ATOM 0 HB3 GLU B 23 3.482 -3.121 -4.608 1.00 0.00 H new ATOM 0 HG2 GLU B 23 5.547 -3.718 -6.740 1.00 0.00 H new ATOM 0 HG3 GLU B 23 4.104 -4.632 -6.348 1.00 0.00 H new ATOM 1317 N GLN B 24 3.512 -0.583 -3.200 1.00 0.00 N ATOM 1318 CA GLN B 24 3.333 -0.051 -1.859 1.00 0.00 C ATOM 1319 C GLN B 24 3.086 -1.188 -0.871 1.00 0.00 C ATOM 1320 O GLN B 24 2.325 -2.119 -1.146 1.00 0.00 O ATOM 1321 CB GLN B 24 2.183 0.969 -1.805 1.00 0.00 C ATOM 1322 CG GLN B 24 0.796 0.356 -1.904 1.00 0.00 C ATOM 1323 CD GLN B 24 -0.322 1.377 -1.770 1.00 0.00 C ATOM 1324 OE1 GLN B 24 -1.397 1.064 -1.260 1.00 0.00 O ATOM 1325 NE2 GLN B 24 -0.086 2.597 -2.237 1.00 0.00 N ATOM 0 H GLN B 24 2.651 -0.682 -3.737 1.00 0.00 H new ATOM 0 HA GLN B 24 4.249 0.470 -1.579 1.00 0.00 H new ATOM 0 HB2 GLN B 24 2.254 1.529 -0.873 1.00 0.00 H new ATOM 0 HB3 GLN B 24 2.310 1.685 -2.617 1.00 0.00 H new ATOM 0 HG2 GLN B 24 0.699 -0.155 -2.862 1.00 0.00 H new ATOM 0 HG3 GLN B 24 0.684 -0.400 -1.127 1.00 0.00 H new ATOM 0 HE21 GLN B 24 0.819 2.818 -2.653 1.00 0.00 H new ATOM 0 HE22 GLN B 24 -0.809 3.314 -2.180 1.00 0.00 H new ATOM 1334 N VAL B 25 3.750 -1.120 0.268 1.00 0.00 N ATOM 1335 CA VAL B 25 3.601 -2.137 1.296 1.00 0.00 C ATOM 1336 C VAL B 25 3.117 -1.523 2.599 1.00 0.00 C ATOM 1337 O VAL B 25 3.320 -0.332 2.853 1.00 0.00 O ATOM 1338 CB VAL B 25 4.920 -2.901 1.551 1.00 0.00 C ATOM 1339 CG1 VAL B 25 5.282 -3.762 0.351 1.00 0.00 C ATOM 1340 CG2 VAL B 25 6.054 -1.933 1.875 1.00 0.00 C ATOM 0 H VAL B 25 4.399 -0.370 0.506 1.00 0.00 H new ATOM 0 HA VAL B 25 2.859 -2.846 0.929 1.00 0.00 H new ATOM 0 HB VAL B 25 4.772 -3.554 2.411 1.00 0.00 H new ATOM 0 HG11 VAL B 25 6.214 -4.291 0.551 1.00 0.00 H new ATOM 0 HG12 VAL B 25 4.486 -4.484 0.168 1.00 0.00 H new ATOM 0 HG13 VAL B 25 5.406 -3.128 -0.527 1.00 0.00 H new ATOM 0 HG21 VAL B 25 6.972 -2.494 2.051 1.00 0.00 H new ATOM 0 HG22 VAL B 25 6.200 -1.251 1.038 1.00 0.00 H new ATOM 0 HG23 VAL B 25 5.801 -1.362 2.768 1.00 0.00 H new ATOM 1350 N SER B 26 2.464 -2.332 3.409 1.00 0.00 N ATOM 1351 CA SER B 26 2.011 -1.904 4.717 1.00 0.00 C ATOM 1352 C SER B 26 3.174 -1.973 5.701 1.00 0.00 C ATOM 1353 O SER B 26 4.100 -2.763 5.515 1.00 0.00 O ATOM 1354 CB SER B 26 0.859 -2.796 5.178 1.00 0.00 C ATOM 1355 OG SER B 26 -0.112 -2.930 4.152 1.00 0.00 O ATOM 0 H SER B 26 2.234 -3.299 3.181 1.00 0.00 H new ATOM 0 HA SER B 26 1.653 -0.876 4.668 1.00 0.00 H new ATOM 0 HB2 SER B 26 1.241 -3.779 5.455 1.00 0.00 H new ATOM 0 HB3 SER B 26 0.397 -2.371 6.069 1.00 0.00 H new ATOM 0 HG SER B 26 0.223 -3.541 3.463 1.00 0.00 H new ATOM 1361 N LYS B 27 3.135 -1.153 6.743 1.00 0.00 N ATOM 1362 CA LYS B 27 4.244 -1.088 7.686 1.00 0.00 C ATOM 1363 C LYS B 27 4.368 -2.408 8.446 1.00 0.00 C ATOM 1364 O LYS B 27 5.454 -2.789 8.877 1.00 0.00 O ATOM 1365 CB LYS B 27 4.066 0.084 8.655 1.00 0.00 C ATOM 1366 CG LYS B 27 5.380 0.603 9.222 1.00 0.00 C ATOM 1367 CD LYS B 27 5.159 1.750 10.198 1.00 0.00 C ATOM 1368 CE LYS B 27 6.476 2.350 10.672 1.00 0.00 C ATOM 1369 NZ LYS B 27 7.132 3.180 9.622 1.00 0.00 N ATOM 0 H LYS B 27 2.356 -0.530 6.956 1.00 0.00 H new ATOM 0 HA LYS B 27 5.165 -0.923 7.127 1.00 0.00 H new ATOM 0 HB2 LYS B 27 3.554 0.897 8.140 1.00 0.00 H new ATOM 0 HB3 LYS B 27 3.422 -0.228 9.477 1.00 0.00 H new ATOM 0 HG2 LYS B 27 5.904 -0.208 9.727 1.00 0.00 H new ATOM 0 HG3 LYS B 27 6.021 0.938 8.407 1.00 0.00 H new ATOM 0 HD2 LYS B 27 4.558 2.524 9.720 1.00 0.00 H new ATOM 0 HD3 LYS B 27 4.592 1.392 11.058 1.00 0.00 H new ATOM 0 HE2 LYS B 27 6.296 2.962 11.556 1.00 0.00 H new ATOM 0 HE3 LYS B 27 7.151 1.548 10.972 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 8.151 2.975 9.604 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 6.718 2.958 8.694 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 6.985 4.188 9.834 1.00 0.00 H new ATOM 1383 N GLN B 28 3.248 -3.111 8.580 1.00 0.00 N ATOM 1384 CA GLN B 28 3.230 -4.423 9.212 1.00 0.00 C ATOM 1385 C GLN B 28 3.997 -5.433 8.365 1.00 0.00 C ATOM 1386 O GLN B 28 4.691 -6.304 8.893 1.00 0.00 O ATOM 1387 CB GLN B 28 1.793 -4.913 9.421 1.00 0.00 C ATOM 1388 CG GLN B 28 0.961 -4.039 10.347 1.00 0.00 C ATOM 1389 CD GLN B 28 0.229 -2.916 9.629 1.00 0.00 C ATOM 1390 OE1 GLN B 28 0.685 -2.398 8.607 1.00 0.00 O ATOM 1391 NE2 GLN B 28 -0.916 -2.534 10.167 1.00 0.00 N ATOM 0 H GLN B 28 2.336 -2.790 8.256 1.00 0.00 H new ATOM 0 HA GLN B 28 3.712 -4.330 10.185 1.00 0.00 H new ATOM 0 HB2 GLN B 28 1.297 -4.970 8.452 1.00 0.00 H new ATOM 0 HB3 GLN B 28 1.822 -5.925 9.825 1.00 0.00 H new ATOM 0 HG2 GLN B 28 0.233 -4.663 10.865 1.00 0.00 H new ATOM 0 HG3 GLN B 28 1.611 -3.609 11.109 1.00 0.00 H new ATOM 0 HE21 GLN B 28 -1.259 -2.989 11.013 1.00 0.00 H new ATOM 0 HE22 GLN B 28 -1.457 -1.785 9.736 1.00 0.00 H new ATOM 1400 N GLU B 29 3.875 -5.306 7.046 1.00 0.00 N ATOM 1401 CA GLU B 29 4.584 -6.183 6.125 1.00 0.00 C ATOM 1402 C GLU B 29 6.082 -5.955 6.260 1.00 0.00 C ATOM 1403 O GLU B 29 6.874 -6.899 6.244 1.00 0.00 O ATOM 1404 CB GLU B 29 4.141 -5.927 4.681 1.00 0.00 C ATOM 1405 CG GLU B 29 2.657 -6.155 4.444 1.00 0.00 C ATOM 1406 CD GLU B 29 2.258 -5.917 3.001 1.00 0.00 C ATOM 1407 OE1 GLU B 29 2.418 -6.840 2.179 1.00 0.00 O ATOM 1408 OE2 GLU B 29 1.790 -4.801 2.681 1.00 0.00 O ATOM 0 H GLU B 29 3.291 -4.603 6.593 1.00 0.00 H new ATOM 0 HA GLU B 29 4.349 -7.218 6.374 1.00 0.00 H new ATOM 0 HB2 GLU B 29 4.389 -4.900 4.412 1.00 0.00 H new ATOM 0 HB3 GLU B 29 4.710 -6.577 4.016 1.00 0.00 H new ATOM 0 HG2 GLU B 29 2.400 -7.176 4.725 1.00 0.00 H new ATOM 0 HG3 GLU B 29 2.083 -5.492 5.091 1.00 0.00 H new ATOM 1415 N ILE B 30 6.449 -4.692 6.427 1.00 0.00 N ATOM 1416 CA ILE B 30 7.837 -4.303 6.624 1.00 0.00 C ATOM 1417 C ILE B 30 8.428 -4.998 7.847 1.00 0.00 C ATOM 1418 O ILE B 30 9.538 -5.530 7.794 1.00 0.00 O ATOM 1419 CB ILE B 30 7.958 -2.775 6.796 1.00 0.00 C ATOM 1420 CG1 ILE B 30 7.414 -2.060 5.556 1.00 0.00 C ATOM 1421 CG2 ILE B 30 9.404 -2.380 7.058 1.00 0.00 C ATOM 1422 CD1 ILE B 30 7.357 -0.554 5.692 1.00 0.00 C ATOM 0 H ILE B 30 5.794 -3.910 6.430 1.00 0.00 H new ATOM 0 HA ILE B 30 8.393 -4.608 5.738 1.00 0.00 H new ATOM 0 HB ILE B 30 7.364 -2.471 7.658 1.00 0.00 H new ATOM 0 HG12 ILE B 30 8.038 -2.314 4.699 1.00 0.00 H new ATOM 0 HG13 ILE B 30 6.413 -2.434 5.343 1.00 0.00 H new ATOM 0 HG21 ILE B 30 9.470 -1.298 7.177 1.00 0.00 H new ATOM 0 HG22 ILE B 30 9.755 -2.867 7.968 1.00 0.00 H new ATOM 0 HG23 ILE B 30 10.024 -2.691 6.217 1.00 0.00 H new ATOM 0 HD11 ILE B 30 6.961 -0.120 4.774 1.00 0.00 H new ATOM 0 HD12 ILE B 30 6.709 -0.288 6.527 1.00 0.00 H new ATOM 0 HD13 ILE B 30 8.360 -0.167 5.873 1.00 0.00 H new ATOM 1434 N SER B 31 7.677 -5.002 8.940 1.00 0.00 N ATOM 1435 CA SER B 31 8.120 -5.637 10.174 1.00 0.00 C ATOM 1436 C SER B 31 8.118 -7.162 10.046 1.00 0.00 C ATOM 1437 O SER B 31 8.938 -7.846 10.663 1.00 0.00 O ATOM 1438 CB SER B 31 7.218 -5.210 11.330 1.00 0.00 C ATOM 1439 OG SER B 31 7.145 -3.797 11.424 1.00 0.00 O ATOM 0 H SER B 31 6.754 -4.571 8.997 1.00 0.00 H new ATOM 0 HA SER B 31 9.143 -5.316 10.372 1.00 0.00 H new ATOM 0 HB2 SER B 31 6.218 -5.620 11.186 1.00 0.00 H new ATOM 0 HB3 SER B 31 7.600 -5.621 12.265 1.00 0.00 H new ATOM 0 HG SER B 31 6.624 -3.446 10.672 1.00 0.00 H new ATOM 1445 N HIS B 32 7.201 -7.688 9.240 1.00 0.00 N ATOM 1446 CA HIS B 32 7.056 -9.132 9.080 1.00 0.00 C ATOM 1447 C HIS B 32 8.187 -9.716 8.238 1.00 0.00 C ATOM 1448 O HIS B 32 8.753 -10.752 8.582 1.00 0.00 O ATOM 1449 CB HIS B 32 5.704 -9.470 8.444 1.00 0.00 C ATOM 1450 CG HIS B 32 5.466 -10.944 8.291 1.00 0.00 C ATOM 1451 ND1 HIS B 32 5.501 -11.592 7.073 1.00 0.00 N ATOM 1452 CD2 HIS B 32 5.190 -11.897 9.213 1.00 0.00 C ATOM 1453 CE1 HIS B 32 5.258 -12.876 7.255 1.00 0.00 C ATOM 1454 NE2 HIS B 32 5.066 -13.086 8.542 1.00 0.00 N ATOM 0 H HIS B 32 6.546 -7.136 8.687 1.00 0.00 H new ATOM 0 HA HIS B 32 7.105 -9.579 10.073 1.00 0.00 H new ATOM 0 HB2 HIS B 32 4.908 -9.043 9.054 1.00 0.00 H new ATOM 0 HB3 HIS B 32 5.644 -8.997 7.464 1.00 0.00 H new ATOM 0 HD2 HIS B 32 5.087 -11.748 10.278 1.00 0.00 H new ATOM 0 HE1 HIS B 32 5.222 -13.628 6.480 1.00 0.00 H new ATOM 0 HE2 HIS B 32 4.858 -13.988 8.970 1.00 0.00 H new ATOM 1463 N PHE B 33 8.498 -9.066 7.126 1.00 0.00 N ATOM 1464 CA PHE B 33 9.561 -9.543 6.248 1.00 0.00 C ATOM 1465 C PHE B 33 10.911 -9.009 6.706 1.00 0.00 C ATOM 1466 O PHE B 33 11.957 -9.523 6.312 1.00 0.00 O ATOM 1467 CB PHE B 33 9.290 -9.134 4.796 1.00 0.00 C ATOM 1468 CG PHE B 33 8.050 -9.757 4.216 1.00 0.00 C ATOM 1469 CD1 PHE B 33 8.041 -11.090 3.834 1.00 0.00 C ATOM 1470 CD2 PHE B 33 6.892 -9.013 4.056 1.00 0.00 C ATOM 1471 CE1 PHE B 33 6.901 -11.666 3.303 1.00 0.00 C ATOM 1472 CE2 PHE B 33 5.751 -9.582 3.526 1.00 0.00 C ATOM 1473 CZ PHE B 33 5.755 -10.911 3.150 1.00 0.00 C ATOM 0 H PHE B 33 8.035 -8.214 6.810 1.00 0.00 H new ATOM 0 HA PHE B 33 9.582 -10.632 6.300 1.00 0.00 H new ATOM 0 HB2 PHE B 33 9.200 -8.049 4.744 1.00 0.00 H new ATOM 0 HB3 PHE B 33 10.147 -9.412 4.183 1.00 0.00 H new ATOM 0 HD1 PHE B 33 8.934 -11.685 3.952 1.00 0.00 H new ATOM 0 HD2 PHE B 33 6.882 -7.974 4.350 1.00 0.00 H new ATOM 0 HE1 PHE B 33 6.907 -12.705 3.008 1.00 0.00 H new ATOM 0 HE2 PHE B 33 4.857 -8.989 3.406 1.00 0.00 H new ATOM 0 HZ PHE B 33 4.863 -11.359 2.737 1.00 0.00 H new ATOM 1483 N LYS B 34 10.866 -7.984 7.556 1.00 0.00 N ATOM 1484 CA LYS B 34 12.064 -7.339 8.087 1.00 0.00 C ATOM 1485 C LYS B 34 12.907 -6.769 6.948 1.00 0.00 C ATOM 1486 O LYS B 34 14.043 -7.182 6.713 1.00 0.00 O ATOM 1487 CB LYS B 34 12.874 -8.317 8.953 1.00 0.00 C ATOM 1488 CG LYS B 34 14.077 -7.703 9.672 1.00 0.00 C ATOM 1489 CD LYS B 34 13.678 -6.597 10.644 1.00 0.00 C ATOM 1490 CE LYS B 34 13.640 -5.228 9.976 1.00 0.00 C ATOM 1491 NZ LYS B 34 14.982 -4.803 9.492 1.00 0.00 N ATOM 0 H LYS B 34 9.995 -7.577 7.896 1.00 0.00 H new ATOM 0 HA LYS B 34 11.760 -6.511 8.728 1.00 0.00 H new ATOM 0 HB2 LYS B 34 12.209 -8.755 9.698 1.00 0.00 H new ATOM 0 HB3 LYS B 34 13.225 -9.133 8.321 1.00 0.00 H new ATOM 0 HG2 LYS B 34 14.609 -8.484 10.215 1.00 0.00 H new ATOM 0 HG3 LYS B 34 14.770 -7.300 8.934 1.00 0.00 H new ATOM 0 HD2 LYS B 34 12.698 -6.821 11.064 1.00 0.00 H new ATOM 0 HD3 LYS B 34 14.383 -6.574 11.475 1.00 0.00 H new ATOM 0 HE2 LYS B 34 12.944 -5.254 9.137 1.00 0.00 H new ATOM 0 HE3 LYS B 34 13.260 -4.491 10.683 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 15.270 -3.934 9.986 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 15.674 -5.555 9.683 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 14.941 -4.622 8.469 1.00 0.00 H new ATOM 1505 N LEU B 35 12.327 -5.813 6.240 1.00 0.00 N ATOM 1506 CA LEU B 35 12.991 -5.190 5.105 1.00 0.00 C ATOM 1507 C LEU B 35 14.052 -4.203 5.577 1.00 0.00 C ATOM 1508 O LEU B 35 14.079 -3.814 6.749 1.00 0.00 O ATOM 1509 CB LEU B 35 11.967 -4.477 4.220 1.00 0.00 C ATOM 1510 CG LEU B 35 10.909 -5.384 3.586 1.00 0.00 C ATOM 1511 CD1 LEU B 35 9.901 -4.560 2.801 1.00 0.00 C ATOM 1512 CD2 LEU B 35 11.564 -6.420 2.683 1.00 0.00 C ATOM 0 H LEU B 35 11.393 -5.450 6.432 1.00 0.00 H new ATOM 0 HA LEU B 35 13.480 -5.971 4.523 1.00 0.00 H new ATOM 0 HB2 LEU B 35 11.461 -3.718 4.817 1.00 0.00 H new ATOM 0 HB3 LEU B 35 12.499 -3.955 3.424 1.00 0.00 H new ATOM 0 HG LEU B 35 10.382 -5.906 4.385 1.00 0.00 H new ATOM 0 HD11 LEU B 35 9.157 -5.222 2.358 1.00 0.00 H new ATOM 0 HD12 LEU B 35 9.407 -3.855 3.470 1.00 0.00 H new ATOM 0 HD13 LEU B 35 10.415 -4.012 2.012 1.00 0.00 H new ATOM 0 HD21 LEU B 35 10.796 -7.055 2.242 1.00 0.00 H new ATOM 0 HD22 LEU B 35 12.117 -5.915 1.891 1.00 0.00 H new ATOM 0 HD23 LEU B 35 12.249 -7.033 3.269 1.00 0.00 H new ATOM 1524 N VAL B 36 14.923 -3.811 4.662 1.00 0.00 N ATOM 1525 CA VAL B 36 15.968 -2.847 4.956 1.00 0.00 C ATOM 1526 C VAL B 36 15.547 -1.468 4.465 1.00 0.00 C ATOM 1527 O VAL B 36 15.189 -1.298 3.297 1.00 0.00 O ATOM 1528 CB VAL B 36 17.304 -3.246 4.291 1.00 0.00 C ATOM 1529 CG1 VAL B 36 18.409 -2.264 4.653 1.00 0.00 C ATOM 1530 CG2 VAL B 36 17.696 -4.664 4.680 1.00 0.00 C ATOM 0 H VAL B 36 14.925 -4.150 3.700 1.00 0.00 H new ATOM 0 HA VAL B 36 16.116 -2.828 6.036 1.00 0.00 H new ATOM 0 HB VAL B 36 17.165 -3.213 3.210 1.00 0.00 H new ATOM 0 HG11 VAL B 36 19.338 -2.568 4.172 1.00 0.00 H new ATOM 0 HG12 VAL B 36 18.134 -1.266 4.313 1.00 0.00 H new ATOM 0 HG13 VAL B 36 18.547 -2.254 5.734 1.00 0.00 H new ATOM 0 HG21 VAL B 36 18.640 -4.925 4.201 1.00 0.00 H new ATOM 0 HG22 VAL B 36 17.809 -4.726 5.762 1.00 0.00 H new ATOM 0 HG23 VAL B 36 16.920 -5.358 4.356 1.00 0.00 H new ATOM 1540 N LYS B 37 15.571 -0.490 5.357 1.00 0.00 N ATOM 1541 CA LYS B 37 15.168 0.860 5.003 1.00 0.00 C ATOM 1542 C LYS B 37 16.296 1.569 4.273 1.00 0.00 C ATOM 1543 O LYS B 37 17.351 1.851 4.846 1.00 0.00 O ATOM 1544 CB LYS B 37 14.751 1.647 6.248 1.00 0.00 C ATOM 1545 CG LYS B 37 14.054 2.963 5.935 1.00 0.00 C ATOM 1546 CD LYS B 37 13.312 3.494 7.151 1.00 0.00 C ATOM 1547 CE LYS B 37 12.490 4.730 6.822 1.00 0.00 C ATOM 1548 NZ LYS B 37 11.556 5.077 7.928 1.00 0.00 N ATOM 0 H LYS B 37 15.864 -0.606 6.327 1.00 0.00 H new ATOM 0 HA LYS B 37 14.306 0.801 4.338 1.00 0.00 H new ATOM 0 HB2 LYS B 37 14.087 1.029 6.852 1.00 0.00 H new ATOM 0 HB3 LYS B 37 15.635 1.849 6.852 1.00 0.00 H new ATOM 0 HG2 LYS B 37 14.789 3.697 5.605 1.00 0.00 H new ATOM 0 HG3 LYS B 37 13.354 2.820 5.112 1.00 0.00 H new ATOM 0 HD2 LYS B 37 12.656 2.717 7.544 1.00 0.00 H new ATOM 0 HD3 LYS B 37 14.028 3.734 7.937 1.00 0.00 H new ATOM 0 HE2 LYS B 37 13.157 5.571 6.631 1.00 0.00 H new ATOM 0 HE3 LYS B 37 11.923 4.558 5.907 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 11.334 6.092 7.889 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 10.679 4.527 7.828 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 12.002 4.855 8.841 1.00 0.00 H new ATOM 1562 N VAL B 38 16.071 1.834 2.997 1.00 0.00 N ATOM 1563 CA VAL B 38 17.065 2.484 2.166 1.00 0.00 C ATOM 1564 C VAL B 38 17.079 3.978 2.447 1.00 0.00 C ATOM 1565 O VAL B 38 18.139 4.606 2.483 1.00 0.00 O ATOM 1566 CB VAL B 38 16.792 2.240 0.668 1.00 0.00 C ATOM 1567 CG1 VAL B 38 17.912 2.812 -0.187 1.00 0.00 C ATOM 1568 CG2 VAL B 38 16.609 0.756 0.395 1.00 0.00 C ATOM 0 H VAL B 38 15.202 1.606 2.513 1.00 0.00 H new ATOM 0 HA VAL B 38 18.037 2.056 2.409 1.00 0.00 H new ATOM 0 HB VAL B 38 15.869 2.754 0.401 1.00 0.00 H new ATOM 0 HG11 VAL B 38 17.697 2.627 -1.239 1.00 0.00 H new ATOM 0 HG12 VAL B 38 17.989 3.886 -0.015 1.00 0.00 H new ATOM 0 HG13 VAL B 38 18.854 2.333 0.080 1.00 0.00 H new ATOM 0 HG21 VAL B 38 16.417 0.602 -0.667 1.00 0.00 H new ATOM 0 HG22 VAL B 38 17.513 0.219 0.682 1.00 0.00 H new ATOM 0 HG23 VAL B 38 15.765 0.381 0.974 1.00 0.00 H new ATOM 1578 N GLY B 39 15.897 4.533 2.672 1.00 0.00 N ATOM 1579 CA GLY B 39 15.779 5.945 2.955 1.00 0.00 C ATOM 1580 C GLY B 39 14.337 6.400 2.967 1.00 0.00 C ATOM 1581 O GLY B 39 13.423 5.577 3.044 1.00 0.00 O ATOM 0 H GLY B 39 15.013 4.025 2.663 1.00 0.00 H new ATOM 0 HA2 GLY B 39 16.236 6.161 3.921 1.00 0.00 H new ATOM 0 HA3 GLY B 39 16.332 6.513 2.207 1.00 0.00 H new ATOM 1585 N THR B 40 14.132 7.703 2.882 1.00 0.00 N ATOM 1586 CA THR B 40 12.793 8.270 2.883 1.00 0.00 C ATOM 1587 C THR B 40 12.669 9.296 1.760 1.00 0.00 C ATOM 1588 O THR B 40 13.601 10.065 1.513 1.00 0.00 O ATOM 1589 CB THR B 40 12.479 8.937 4.240 1.00 0.00 C ATOM 1590 OG1 THR B 40 12.705 8.003 5.307 1.00 0.00 O ATOM 1591 CG2 THR B 40 11.039 9.427 4.295 1.00 0.00 C ATOM 0 H THR B 40 14.880 8.393 2.811 1.00 0.00 H new ATOM 0 HA THR B 40 12.076 7.465 2.723 1.00 0.00 H new ATOM 0 HB THR B 40 13.140 9.796 4.352 1.00 0.00 H new ATOM 0 HG1 THR B 40 12.506 8.432 6.165 1.00 0.00 H new ATOM 0 HG21 THR B 40 10.849 9.891 5.263 1.00 0.00 H new ATOM 0 HG22 THR B 40 10.873 10.157 3.503 1.00 0.00 H new ATOM 0 HG23 THR B 40 10.362 8.584 4.159 1.00 0.00 H new ATOM 1599 N ILE B 41 11.537 9.293 1.070 1.00 0.00 N ATOM 1600 CA ILE B 41 11.326 10.201 -0.050 1.00 0.00 C ATOM 1601 C ILE B 41 10.107 11.081 0.181 1.00 0.00 C ATOM 1602 O ILE B 41 9.128 10.656 0.795 1.00 0.00 O ATOM 1603 CB ILE B 41 11.148 9.445 -1.386 1.00 0.00 C ATOM 1604 CG1 ILE B 41 10.028 8.404 -1.272 1.00 0.00 C ATOM 1605 CG2 ILE B 41 12.456 8.790 -1.810 1.00 0.00 C ATOM 1606 CD1 ILE B 41 9.726 7.683 -2.567 1.00 0.00 C ATOM 0 H ILE B 41 10.751 8.673 1.265 1.00 0.00 H new ATOM 0 HA ILE B 41 12.221 10.820 -0.115 1.00 0.00 H new ATOM 0 HB ILE B 41 10.865 10.165 -2.154 1.00 0.00 H new ATOM 0 HG12 ILE B 41 10.304 7.670 -0.515 1.00 0.00 H new ATOM 0 HG13 ILE B 41 9.121 8.897 -0.922 1.00 0.00 H new ATOM 0 HG21 ILE B 41 12.310 8.263 -2.753 1.00 0.00 H new ATOM 0 HG22 ILE B 41 13.222 9.555 -1.937 1.00 0.00 H new ATOM 0 HG23 ILE B 41 12.774 8.083 -1.044 1.00 0.00 H new ATOM 0 HD11 ILE B 41 8.923 6.964 -2.404 1.00 0.00 H new ATOM 0 HD12 ILE B 41 9.418 8.406 -3.323 1.00 0.00 H new ATOM 0 HD13 ILE B 41 10.619 7.159 -2.909 1.00 0.00 H new ATOM 1618 N ASN B 42 10.179 12.309 -0.302 1.00 0.00 N ATOM 1619 CA ASN B 42 9.047 13.220 -0.249 1.00 0.00 C ATOM 1620 C ASN B 42 8.780 13.808 -1.628 1.00 0.00 C ATOM 1621 O ASN B 42 9.672 14.366 -2.264 1.00 0.00 O ATOM 1622 CB ASN B 42 9.251 14.335 0.801 1.00 0.00 C ATOM 1623 CG ASN B 42 10.610 15.026 0.749 1.00 0.00 C ATOM 1624 OD1 ASN B 42 11.037 15.560 1.884 1.00 0.00 O flip ATOM 1625 ND2 ASN B 42 11.268 15.095 -0.288 1.00 0.00 N flip ATOM 0 H ASN B 42 11.014 12.701 -0.738 1.00 0.00 H new ATOM 0 HA ASN B 42 8.173 12.648 0.063 1.00 0.00 H new ATOM 0 HB2 ASN B 42 8.473 15.086 0.668 1.00 0.00 H new ATOM 0 HB3 ASN B 42 9.115 13.908 1.794 1.00 0.00 H new ATOM 0 HD21 ASN B 42 10.913 14.674 -1.146 1.00 0.00 H new ATOM 0 HD22 ASN B 42 12.169 15.573 -0.289 1.00 0.00 H new ATOM 1632 N VAL B 43 7.558 13.652 -2.101 1.00 0.00 N ATOM 1633 CA VAL B 43 7.174 14.176 -3.398 1.00 0.00 C ATOM 1634 C VAL B 43 6.390 15.465 -3.218 1.00 0.00 C ATOM 1635 O VAL B 43 5.208 15.442 -2.877 1.00 0.00 O ATOM 1636 CB VAL B 43 6.324 13.162 -4.199 1.00 0.00 C ATOM 1637 CG1 VAL B 43 6.002 13.700 -5.585 1.00 0.00 C ATOM 1638 CG2 VAL B 43 7.038 11.823 -4.300 1.00 0.00 C ATOM 0 H VAL B 43 6.812 13.165 -1.604 1.00 0.00 H new ATOM 0 HA VAL B 43 8.087 14.368 -3.962 1.00 0.00 H new ATOM 0 HB VAL B 43 5.386 13.012 -3.665 1.00 0.00 H new ATOM 0 HG11 VAL B 43 5.404 12.969 -6.129 1.00 0.00 H new ATOM 0 HG12 VAL B 43 5.442 14.631 -5.493 1.00 0.00 H new ATOM 0 HG13 VAL B 43 6.929 13.886 -6.128 1.00 0.00 H new ATOM 0 HG21 VAL B 43 6.423 11.124 -4.867 1.00 0.00 H new ATOM 0 HG22 VAL B 43 7.994 11.958 -4.806 1.00 0.00 H new ATOM 0 HG23 VAL B 43 7.209 11.426 -3.300 1.00 0.00 H new ATOM 1648 N SER B 44 7.063 16.582 -3.418 1.00 0.00 N ATOM 1649 CA SER B 44 6.440 17.885 -3.264 1.00 0.00 C ATOM 1650 C SER B 44 6.198 18.492 -4.639 1.00 0.00 C ATOM 1651 O SER B 44 7.127 18.950 -5.305 1.00 0.00 O ATOM 1652 CB SER B 44 7.333 18.798 -2.411 1.00 0.00 C ATOM 1653 OG SER B 44 6.683 20.020 -2.095 1.00 0.00 O ATOM 0 H SER B 44 8.046 16.614 -3.689 1.00 0.00 H new ATOM 0 HA SER B 44 5.483 17.777 -2.754 1.00 0.00 H new ATOM 0 HB2 SER B 44 7.607 18.283 -1.490 1.00 0.00 H new ATOM 0 HB3 SER B 44 8.259 19.006 -2.947 1.00 0.00 H new ATOM 0 HG SER B 44 6.473 20.041 -1.138 1.00 0.00 H new ATOM 1659 N GLN B 45 4.953 18.450 -5.080 1.00 0.00 N ATOM 1660 CA GLN B 45 4.597 18.928 -6.402 1.00 0.00 C ATOM 1661 C GLN B 45 3.768 20.195 -6.310 1.00 0.00 C ATOM 1662 O GLN B 45 2.593 20.158 -5.937 1.00 0.00 O ATOM 1663 CB GLN B 45 3.829 17.851 -7.168 1.00 0.00 C ATOM 1664 CG GLN B 45 4.628 16.578 -7.389 1.00 0.00 C ATOM 1665 CD GLN B 45 5.846 16.791 -8.268 1.00 0.00 C ATOM 1666 OE1 GLN B 45 5.775 16.660 -9.486 1.00 0.00 O ATOM 1667 NE2 GLN B 45 6.972 17.124 -7.656 1.00 0.00 N ATOM 0 H GLN B 45 4.169 18.088 -4.538 1.00 0.00 H new ATOM 0 HA GLN B 45 5.517 19.156 -6.941 1.00 0.00 H new ATOM 0 HB2 GLN B 45 2.918 17.608 -6.622 1.00 0.00 H new ATOM 0 HB3 GLN B 45 3.524 18.252 -8.135 1.00 0.00 H new ATOM 0 HG2 GLN B 45 4.947 16.183 -6.424 1.00 0.00 H new ATOM 0 HG3 GLN B 45 3.984 15.825 -7.845 1.00 0.00 H new ATOM 0 HE21 GLN B 45 6.991 17.223 -6.641 1.00 0.00 H new ATOM 0 HE22 GLN B 45 7.821 17.281 -8.200 1.00 0.00 H new ATOM 1676 N SER B 46 4.392 21.316 -6.623 1.00 0.00 N ATOM 1677 CA SER B 46 3.708 22.593 -6.631 1.00 0.00 C ATOM 1678 C SER B 46 2.712 22.662 -7.788 1.00 0.00 C ATOM 1679 O SER B 46 3.095 22.867 -8.941 1.00 0.00 O ATOM 1680 CB SER B 46 4.727 23.728 -6.734 1.00 0.00 C ATOM 1681 OG SER B 46 5.719 23.611 -5.725 1.00 0.00 O ATOM 0 H SER B 46 5.379 21.366 -6.877 1.00 0.00 H new ATOM 0 HA SER B 46 3.154 22.700 -5.699 1.00 0.00 H new ATOM 0 HB2 SER B 46 5.198 23.711 -7.717 1.00 0.00 H new ATOM 0 HB3 SER B 46 4.219 24.688 -6.641 1.00 0.00 H new ATOM 0 HG SER B 46 6.361 24.346 -5.811 1.00 0.00 H new ATOM 1687 N GLY B 47 1.445 22.436 -7.474 1.00 0.00 N ATOM 1688 CA GLY B 47 0.389 22.594 -8.448 1.00 0.00 C ATOM 1689 C GLY B 47 0.068 21.327 -9.213 1.00 0.00 C ATOM 1690 O GLY B 47 0.204 20.216 -8.692 1.00 0.00 O ATOM 0 H GLY B 47 1.129 22.142 -6.550 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -0.512 22.939 -7.941 1.00 0.00 H new ATOM 0 HA3 GLY B 47 0.674 23.372 -9.156 1.00 0.00 H new ATOM 1694 N GLY B 48 -0.342 21.498 -10.463 1.00 0.00 N ATOM 1695 CA GLY B 48 -0.841 20.388 -11.250 1.00 0.00 C ATOM 1696 C GLY B 48 0.252 19.570 -11.905 1.00 0.00 C ATOM 1697 O GLY B 48 0.326 19.489 -13.130 1.00 0.00 O ATOM 0 H GLY B 48 -0.337 22.395 -10.949 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -1.436 19.737 -10.609 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -1.508 20.772 -12.022 1.00 0.00 H new ATOM 1701 N GLN B 49 1.112 18.973 -11.095 1.00 0.00 N ATOM 1702 CA GLN B 49 2.106 18.038 -11.605 1.00 0.00 C ATOM 1703 C GLN B 49 1.665 16.610 -11.306 1.00 0.00 C ATOM 1704 O GLN B 49 2.291 15.639 -11.734 1.00 0.00 O ATOM 1705 CB GLN B 49 3.481 18.317 -11.001 1.00 0.00 C ATOM 1706 CG GLN B 49 4.047 19.676 -11.388 1.00 0.00 C ATOM 1707 CD GLN B 49 5.483 19.853 -10.941 1.00 0.00 C ATOM 1708 OE1 GLN B 49 6.417 19.521 -11.670 1.00 0.00 O ATOM 1709 NE2 GLN B 49 5.670 20.386 -9.746 1.00 0.00 N ATOM 0 H GLN B 49 1.143 19.117 -10.086 1.00 0.00 H new ATOM 0 HA GLN B 49 2.188 18.167 -12.684 1.00 0.00 H new ATOM 0 HB2 GLN B 49 3.412 18.257 -9.915 1.00 0.00 H new ATOM 0 HB3 GLN B 49 4.174 17.539 -11.320 1.00 0.00 H new ATOM 0 HG2 GLN B 49 3.989 19.796 -12.470 1.00 0.00 H new ATOM 0 HG3 GLN B 49 3.433 20.461 -10.947 1.00 0.00 H new ATOM 0 HE21 GLN B 49 4.868 20.647 -9.173 1.00 0.00 H new ATOM 0 HE22 GLN B 49 6.617 20.536 -9.397 1.00 0.00 H new ATOM 1718 N ILE B 50 0.576 16.505 -10.556 1.00 0.00 N ATOM 1719 CA ILE B 50 -0.058 15.230 -10.258 1.00 0.00 C ATOM 1720 C ILE B 50 -1.568 15.397 -10.334 1.00 0.00 C ATOM 1721 O ILE B 50 -2.128 16.282 -9.687 1.00 0.00 O ATOM 1722 CB ILE B 50 0.324 14.699 -8.853 1.00 0.00 C ATOM 1723 CG1 ILE B 50 1.816 14.359 -8.791 1.00 0.00 C ATOM 1724 CG2 ILE B 50 -0.515 13.479 -8.486 1.00 0.00 C ATOM 1725 CD1 ILE B 50 2.248 13.760 -7.473 1.00 0.00 C ATOM 0 H ILE B 50 0.106 17.307 -10.136 1.00 0.00 H new ATOM 0 HA ILE B 50 0.292 14.505 -10.993 1.00 0.00 H new ATOM 0 HB ILE B 50 0.118 15.486 -8.128 1.00 0.00 H new ATOM 0 HG12 ILE B 50 2.054 13.660 -9.593 1.00 0.00 H new ATOM 0 HG13 ILE B 50 2.394 15.265 -8.975 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -0.228 13.125 -7.496 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -1.571 13.751 -8.483 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -0.346 12.688 -9.217 1.00 0.00 H new ATOM 0 HD11 ILE B 50 3.316 13.545 -7.504 1.00 0.00 H new ATOM 0 HD12 ILE B 50 2.043 14.466 -6.668 1.00 0.00 H new ATOM 0 HD13 ILE B 50 1.697 12.836 -7.295 1.00 0.00 H new ATOM 1737 N SER B 51 -2.218 14.572 -11.137 1.00 0.00 N ATOM 1738 CA SER B 51 -3.664 14.650 -11.283 1.00 0.00 C ATOM 1739 C SER B 51 -4.307 13.332 -10.877 1.00 0.00 C ATOM 1740 O SER B 51 -5.457 13.292 -10.437 1.00 0.00 O ATOM 1741 CB SER B 51 -4.032 14.982 -12.728 1.00 0.00 C ATOM 1742 OG SER B 51 -3.159 15.963 -13.263 1.00 0.00 O ATOM 0 H SER B 51 -1.772 13.844 -11.695 1.00 0.00 H new ATOM 0 HA SER B 51 -4.036 15.441 -10.631 1.00 0.00 H new ATOM 0 HB2 SER B 51 -3.985 14.078 -13.336 1.00 0.00 H new ATOM 0 HB3 SER B 51 -5.060 15.342 -12.772 1.00 0.00 H new ATOM 0 HG SER B 51 -3.414 16.157 -14.189 1.00 0.00 H new ATOM 1748 N SER B 52 -3.552 12.256 -11.025 1.00 0.00 N ATOM 1749 CA SER B 52 -4.047 10.932 -10.716 1.00 0.00 C ATOM 1750 C SER B 52 -3.093 10.212 -9.765 1.00 0.00 C ATOM 1751 O SER B 52 -1.916 10.584 -9.654 1.00 0.00 O ATOM 1752 CB SER B 52 -4.202 10.134 -12.013 1.00 0.00 C ATOM 1753 OG SER B 52 -2.966 10.042 -12.705 1.00 0.00 O ATOM 0 H SER B 52 -2.589 12.278 -11.360 1.00 0.00 H new ATOM 0 HA SER B 52 -5.016 11.019 -10.225 1.00 0.00 H new ATOM 0 HB2 SER B 52 -4.571 9.134 -11.787 1.00 0.00 H new ATOM 0 HB3 SER B 52 -4.945 10.612 -12.651 1.00 0.00 H new ATOM 0 HG SER B 52 -2.622 10.943 -12.881 1.00 0.00 H new ATOM 1759 N PRO B 53 -3.583 9.176 -9.058 1.00 0.00 N ATOM 1760 CA PRO B 53 -2.727 8.312 -8.241 1.00 0.00 C ATOM 1761 C PRO B 53 -1.616 7.691 -9.082 1.00 0.00 C ATOM 1762 O PRO B 53 -0.556 7.328 -8.570 1.00 0.00 O ATOM 1763 CB PRO B 53 -3.683 7.229 -7.727 1.00 0.00 C ATOM 1764 CG PRO B 53 -5.037 7.843 -7.806 1.00 0.00 C ATOM 1765 CD PRO B 53 -5.002 8.778 -8.983 1.00 0.00 C ATOM 0 HA PRO B 53 -2.229 8.856 -7.438 1.00 0.00 H new ATOM 0 HB2 PRO B 53 -3.622 6.327 -8.336 1.00 0.00 H new ATOM 0 HB3 PRO B 53 -3.439 6.940 -6.705 1.00 0.00 H new ATOM 0 HG2 PRO B 53 -5.804 7.080 -7.937 1.00 0.00 H new ATOM 0 HG3 PRO B 53 -5.276 8.380 -6.888 1.00 0.00 H new ATOM 0 HD2 PRO B 53 -5.331 8.285 -9.898 1.00 0.00 H new ATOM 0 HD3 PRO B 53 -5.654 9.639 -8.833 1.00 0.00 H new ATOM 1773 N SER B 54 -1.874 7.590 -10.383 1.00 0.00 N ATOM 1774 CA SER B 54 -0.895 7.104 -11.334 1.00 0.00 C ATOM 1775 C SER B 54 0.350 7.989 -11.312 1.00 0.00 C ATOM 1776 O SER B 54 1.452 7.499 -11.083 1.00 0.00 O ATOM 1777 CB SER B 54 -1.508 7.077 -12.734 1.00 0.00 C ATOM 1778 OG SER B 54 -2.768 6.424 -12.716 1.00 0.00 O ATOM 0 H SER B 54 -2.769 7.844 -10.801 1.00 0.00 H new ATOM 0 HA SER B 54 -0.600 6.092 -11.057 1.00 0.00 H new ATOM 0 HB2 SER B 54 -1.625 8.095 -13.105 1.00 0.00 H new ATOM 0 HB3 SER B 54 -0.836 6.563 -13.421 1.00 0.00 H new ATOM 0 HG SER B 54 -3.146 6.418 -13.620 1.00 0.00 H new ATOM 1784 N ASP B 55 0.153 9.297 -11.510 1.00 0.00 N ATOM 1785 CA ASP B 55 1.262 10.259 -11.514 1.00 0.00 C ATOM 1786 C ASP B 55 2.051 10.162 -10.219 1.00 0.00 C ATOM 1787 O ASP B 55 3.288 10.140 -10.218 1.00 0.00 O ATOM 1788 CB ASP B 55 0.753 11.698 -11.657 1.00 0.00 C ATOM 1789 CG ASP B 55 -0.118 11.918 -12.873 1.00 0.00 C ATOM 1790 OD1 ASP B 55 0.400 11.852 -14.004 1.00 0.00 O ATOM 1791 OD2 ASP B 55 -1.330 12.177 -12.696 1.00 0.00 O ATOM 0 H ASP B 55 -0.764 9.714 -11.670 1.00 0.00 H new ATOM 0 HA ASP B 55 1.897 10.014 -12.365 1.00 0.00 H new ATOM 0 HB2 ASP B 55 0.188 11.964 -10.764 1.00 0.00 H new ATOM 0 HB3 ASP B 55 1.608 12.373 -11.707 1.00 0.00 H new ATOM 1796 N LEU B 56 1.314 10.108 -9.115 1.00 0.00 N ATOM 1797 CA LEU B 56 1.906 9.991 -7.791 1.00 0.00 C ATOM 1798 C LEU B 56 2.842 8.789 -7.712 1.00 0.00 C ATOM 1799 O LEU B 56 4.018 8.925 -7.372 1.00 0.00 O ATOM 1800 CB LEU B 56 0.799 9.867 -6.738 1.00 0.00 C ATOM 1801 CG LEU B 56 1.274 9.533 -5.323 1.00 0.00 C ATOM 1802 CD1 LEU B 56 2.236 10.594 -4.815 1.00 0.00 C ATOM 1803 CD2 LEU B 56 0.086 9.391 -4.381 1.00 0.00 C ATOM 0 H LEU B 56 0.295 10.144 -9.114 1.00 0.00 H new ATOM 0 HA LEU B 56 2.493 10.889 -7.596 1.00 0.00 H new ATOM 0 HB2 LEU B 56 0.245 10.805 -6.705 1.00 0.00 H new ATOM 0 HB3 LEU B 56 0.100 9.095 -7.060 1.00 0.00 H new ATOM 0 HG LEU B 56 1.803 8.581 -5.355 1.00 0.00 H new ATOM 0 HD11 LEU B 56 2.562 10.337 -3.807 1.00 0.00 H new ATOM 0 HD12 LEU B 56 3.102 10.645 -5.474 1.00 0.00 H new ATOM 0 HD13 LEU B 56 1.735 11.562 -4.799 1.00 0.00 H new ATOM 0 HD21 LEU B 56 0.443 9.153 -3.379 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -0.472 10.327 -4.355 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -0.565 8.591 -4.734 1.00 0.00 H new ATOM 1815 N ARG B 57 2.320 7.622 -8.055 1.00 0.00 N ATOM 1816 CA ARG B 57 3.069 6.382 -7.915 1.00 0.00 C ATOM 1817 C ARG B 57 4.167 6.263 -8.965 1.00 0.00 C ATOM 1818 O ARG B 57 5.079 5.446 -8.821 1.00 0.00 O ATOM 1819 CB ARG B 57 2.114 5.192 -7.969 1.00 0.00 C ATOM 1820 CG ARG B 57 1.095 5.226 -6.845 1.00 0.00 C ATOM 1821 CD ARG B 57 0.114 4.074 -6.918 1.00 0.00 C ATOM 1822 NE ARG B 57 -0.892 4.172 -5.863 1.00 0.00 N ATOM 1823 CZ ARG B 57 -1.603 3.149 -5.410 1.00 0.00 C ATOM 1824 NH1 ARG B 57 -1.440 1.935 -5.920 1.00 0.00 N ATOM 1825 NH2 ARG B 57 -2.478 3.343 -4.440 1.00 0.00 N ATOM 0 H ARG B 57 1.380 7.507 -8.433 1.00 0.00 H new ATOM 0 HA ARG B 57 3.565 6.389 -6.945 1.00 0.00 H new ATOM 0 HB2 ARG B 57 1.595 5.187 -8.928 1.00 0.00 H new ATOM 0 HB3 ARG B 57 2.686 4.266 -7.911 1.00 0.00 H new ATOM 0 HG2 ARG B 57 1.614 5.197 -5.887 1.00 0.00 H new ATOM 0 HG3 ARG B 57 0.548 6.168 -6.883 1.00 0.00 H new ATOM 0 HD2 ARG B 57 -0.375 4.070 -7.892 1.00 0.00 H new ATOM 0 HD3 ARG B 57 0.650 3.129 -6.827 1.00 0.00 H new ATOM 0 HE ARG B 57 -1.058 5.089 -5.447 1.00 0.00 H new ATOM 0 HH11 ARG B 57 -0.763 1.783 -6.667 1.00 0.00 H new ATOM 0 HH12 ARG B 57 -1.992 1.154 -5.565 1.00 0.00 H new ATOM 0 HH21 ARG B 57 -2.603 4.275 -4.045 1.00 0.00 H new ATOM 0 HH22 ARG B 57 -3.029 2.561 -4.086 1.00 0.00 H new ATOM 1839 N GLU B 58 4.085 7.079 -10.012 1.00 0.00 N ATOM 1840 CA GLU B 58 5.168 7.177 -10.980 1.00 0.00 C ATOM 1841 C GLU B 58 6.418 7.703 -10.292 1.00 0.00 C ATOM 1842 O GLU B 58 7.455 7.038 -10.275 1.00 0.00 O ATOM 1843 CB GLU B 58 4.789 8.098 -12.142 1.00 0.00 C ATOM 1844 CG GLU B 58 3.717 7.532 -13.054 1.00 0.00 C ATOM 1845 CD GLU B 58 4.145 6.244 -13.720 1.00 0.00 C ATOM 1846 OE1 GLU B 58 4.993 6.300 -14.633 1.00 0.00 O ATOM 1847 OE2 GLU B 58 3.637 5.170 -13.332 1.00 0.00 O ATOM 0 H GLU B 58 3.284 7.678 -10.210 1.00 0.00 H new ATOM 0 HA GLU B 58 5.359 6.183 -11.384 1.00 0.00 H new ATOM 0 HB2 GLU B 58 4.443 9.050 -11.740 1.00 0.00 H new ATOM 0 HB3 GLU B 58 5.681 8.307 -12.733 1.00 0.00 H new ATOM 0 HG2 GLU B 58 2.810 7.355 -12.477 1.00 0.00 H new ATOM 0 HG3 GLU B 58 3.469 8.268 -13.819 1.00 0.00 H new ATOM 1854 N LYS B 59 6.313 8.896 -9.709 1.00 0.00 N ATOM 1855 CA LYS B 59 7.424 9.476 -8.974 1.00 0.00 C ATOM 1856 C LYS B 59 7.785 8.651 -7.743 1.00 0.00 C ATOM 1857 O LYS B 59 8.960 8.520 -7.414 1.00 0.00 O ATOM 1858 CB LYS B 59 7.113 10.914 -8.576 1.00 0.00 C ATOM 1859 CG LYS B 59 7.106 11.866 -9.754 1.00 0.00 C ATOM 1860 CD LYS B 59 7.060 13.305 -9.292 1.00 0.00 C ATOM 1861 CE LYS B 59 7.464 14.251 -10.405 1.00 0.00 C ATOM 1862 NZ LYS B 59 6.418 14.385 -11.452 1.00 0.00 N ATOM 0 H LYS B 59 5.473 9.473 -9.734 1.00 0.00 H new ATOM 0 HA LYS B 59 8.288 9.472 -9.638 1.00 0.00 H new ATOM 0 HB2 LYS B 59 6.141 10.947 -8.084 1.00 0.00 H new ATOM 0 HB3 LYS B 59 7.851 11.251 -7.848 1.00 0.00 H new ATOM 0 HG2 LYS B 59 7.997 11.704 -10.361 1.00 0.00 H new ATOM 0 HG3 LYS B 59 6.245 11.657 -10.389 1.00 0.00 H new ATOM 0 HD2 LYS B 59 6.054 13.548 -8.952 1.00 0.00 H new ATOM 0 HD3 LYS B 59 7.726 13.437 -8.439 1.00 0.00 H new ATOM 0 HE2 LYS B 59 7.677 15.233 -9.982 1.00 0.00 H new ATOM 0 HE3 LYS B 59 8.387 13.894 -10.863 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 6.869 14.551 -12.374 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 5.855 13.512 -11.494 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 5.797 15.187 -11.222 1.00 0.00 H new ATOM 1876 N LEU B 60 6.782 8.093 -7.068 1.00 0.00 N ATOM 1877 CA LEU B 60 7.031 7.248 -5.900 1.00 0.00 C ATOM 1878 C LEU B 60 7.951 6.086 -6.257 1.00 0.00 C ATOM 1879 O LEU B 60 8.966 5.864 -5.601 1.00 0.00 O ATOM 1880 CB LEU B 60 5.722 6.708 -5.317 1.00 0.00 C ATOM 1881 CG LEU B 60 4.844 7.739 -4.608 1.00 0.00 C ATOM 1882 CD1 LEU B 60 3.564 7.087 -4.110 1.00 0.00 C ATOM 1883 CD2 LEU B 60 5.598 8.379 -3.452 1.00 0.00 C ATOM 0 H LEU B 60 5.797 8.209 -7.306 1.00 0.00 H new ATOM 0 HA LEU B 60 7.518 7.868 -5.147 1.00 0.00 H new ATOM 0 HB2 LEU B 60 5.144 6.257 -6.124 1.00 0.00 H new ATOM 0 HB3 LEU B 60 5.960 5.912 -4.611 1.00 0.00 H new ATOM 0 HG LEU B 60 4.583 8.520 -5.322 1.00 0.00 H new ATOM 0 HD11 LEU B 60 2.948 7.832 -3.607 1.00 0.00 H new ATOM 0 HD12 LEU B 60 3.014 6.672 -4.955 1.00 0.00 H new ATOM 0 HD13 LEU B 60 3.811 6.288 -3.410 1.00 0.00 H new ATOM 0 HD21 LEU B 60 4.957 9.110 -2.960 1.00 0.00 H new ATOM 0 HD22 LEU B 60 5.888 7.610 -2.736 1.00 0.00 H new ATOM 0 HD23 LEU B 60 6.491 8.876 -3.831 1.00 0.00 H new ATOM 1895 N SER B 61 7.600 5.361 -7.311 1.00 0.00 N ATOM 1896 CA SER B 61 8.405 4.239 -7.767 1.00 0.00 C ATOM 1897 C SER B 61 9.775 4.710 -8.243 1.00 0.00 C ATOM 1898 O SER B 61 10.792 4.068 -7.977 1.00 0.00 O ATOM 1899 CB SER B 61 7.688 3.502 -8.898 1.00 0.00 C ATOM 1900 OG SER B 61 6.450 2.973 -8.454 1.00 0.00 O ATOM 0 H SER B 61 6.761 5.531 -7.866 1.00 0.00 H new ATOM 0 HA SER B 61 8.546 3.559 -6.927 1.00 0.00 H new ATOM 0 HB2 SER B 61 7.518 4.184 -9.731 1.00 0.00 H new ATOM 0 HB3 SER B 61 8.320 2.695 -9.270 1.00 0.00 H new ATOM 0 HG SER B 61 6.508 1.996 -8.412 1.00 0.00 H new ATOM 1906 N GLU B 62 9.788 5.843 -8.932 1.00 0.00 N ATOM 1907 CA GLU B 62 11.015 6.391 -9.488 1.00 0.00 C ATOM 1908 C GLU B 62 11.990 6.780 -8.383 1.00 0.00 C ATOM 1909 O GLU B 62 13.157 6.388 -8.409 1.00 0.00 O ATOM 1910 CB GLU B 62 10.688 7.601 -10.365 1.00 0.00 C ATOM 1911 CG GLU B 62 11.876 8.141 -11.141 1.00 0.00 C ATOM 1912 CD GLU B 62 11.468 9.199 -12.141 1.00 0.00 C ATOM 1913 OE1 GLU B 62 10.794 8.851 -13.134 1.00 0.00 O ATOM 1914 OE2 GLU B 62 11.818 10.380 -11.952 1.00 0.00 O ATOM 0 H GLU B 62 8.956 6.403 -9.119 1.00 0.00 H new ATOM 0 HA GLU B 62 11.493 5.625 -10.099 1.00 0.00 H new ATOM 0 HB2 GLU B 62 9.903 7.325 -11.069 1.00 0.00 H new ATOM 0 HB3 GLU B 62 10.287 8.395 -9.735 1.00 0.00 H new ATOM 0 HG2 GLU B 62 12.602 8.561 -10.445 1.00 0.00 H new ATOM 0 HG3 GLU B 62 12.371 7.322 -11.662 1.00 0.00 H new ATOM 1921 N LEU B 63 11.505 7.530 -7.401 1.00 0.00 N ATOM 1922 CA LEU B 63 12.353 8.005 -6.315 1.00 0.00 C ATOM 1923 C LEU B 63 12.762 6.860 -5.393 1.00 0.00 C ATOM 1924 O LEU B 63 13.867 6.859 -4.848 1.00 0.00 O ATOM 1925 CB LEU B 63 11.643 9.101 -5.516 1.00 0.00 C ATOM 1926 CG LEU B 63 11.262 10.349 -6.318 1.00 0.00 C ATOM 1927 CD1 LEU B 63 10.625 11.390 -5.413 1.00 0.00 C ATOM 1928 CD2 LEU B 63 12.481 10.926 -7.025 1.00 0.00 C ATOM 0 H LEU B 63 10.530 7.822 -7.334 1.00 0.00 H new ATOM 0 HA LEU B 63 13.257 8.424 -6.758 1.00 0.00 H new ATOM 0 HB2 LEU B 63 10.738 8.680 -5.077 1.00 0.00 H new ATOM 0 HB3 LEU B 63 12.288 9.402 -4.690 1.00 0.00 H new ATOM 0 HG LEU B 63 10.533 10.061 -7.076 1.00 0.00 H new ATOM 0 HD11 LEU B 63 10.361 12.270 -6.000 1.00 0.00 H new ATOM 0 HD12 LEU B 63 9.726 10.975 -4.957 1.00 0.00 H new ATOM 0 HD13 LEU B 63 11.330 11.673 -4.632 1.00 0.00 H new ATOM 0 HD21 LEU B 63 12.189 11.812 -7.589 1.00 0.00 H new ATOM 0 HD22 LEU B 63 13.235 11.198 -6.286 1.00 0.00 H new ATOM 0 HD23 LEU B 63 12.893 10.181 -7.706 1.00 0.00 H new ATOM 1940 N ALA B 64 11.876 5.886 -5.224 1.00 0.00 N ATOM 1941 CA ALA B 64 12.184 4.713 -4.416 1.00 0.00 C ATOM 1942 C ALA B 64 13.319 3.919 -5.048 1.00 0.00 C ATOM 1943 O ALA B 64 14.290 3.559 -4.377 1.00 0.00 O ATOM 1944 CB ALA B 64 10.952 3.837 -4.245 1.00 0.00 C ATOM 0 H ALA B 64 10.942 5.885 -5.634 1.00 0.00 H new ATOM 0 HA ALA B 64 12.501 5.050 -3.429 1.00 0.00 H new ATOM 0 HB1 ALA B 64 11.205 2.967 -3.639 1.00 0.00 H new ATOM 0 HB2 ALA B 64 10.166 4.407 -3.751 1.00 0.00 H new ATOM 0 HB3 ALA B 64 10.601 3.508 -5.223 1.00 0.00 H new ATOM 1950 N ASP B 65 13.204 3.676 -6.347 1.00 0.00 N ATOM 1951 CA ASP B 65 14.222 2.933 -7.080 1.00 0.00 C ATOM 1952 C ASP B 65 15.504 3.754 -7.182 1.00 0.00 C ATOM 1953 O ASP B 65 16.610 3.207 -7.198 1.00 0.00 O ATOM 1954 CB ASP B 65 13.717 2.570 -8.478 1.00 0.00 C ATOM 1955 CG ASP B 65 14.625 1.582 -9.183 1.00 0.00 C ATOM 1956 OD1 ASP B 65 14.413 0.361 -9.023 1.00 0.00 O ATOM 1957 OD2 ASP B 65 15.553 2.020 -9.897 1.00 0.00 O ATOM 0 H ASP B 65 12.415 3.983 -6.916 1.00 0.00 H new ATOM 0 HA ASP B 65 14.436 2.012 -6.537 1.00 0.00 H new ATOM 0 HB2 ASP B 65 12.715 2.147 -8.401 1.00 0.00 H new ATOM 0 HB3 ASP B 65 13.635 3.476 -9.078 1.00 0.00 H new ATOM 1962 N ALA B 66 15.345 5.074 -7.239 1.00 0.00 N ATOM 1963 CA ALA B 66 16.475 5.993 -7.275 1.00 0.00 C ATOM 1964 C ALA B 66 17.332 5.840 -6.025 1.00 0.00 C ATOM 1965 O ALA B 66 18.562 5.851 -6.099 1.00 0.00 O ATOM 1966 CB ALA B 66 15.991 7.427 -7.408 1.00 0.00 C ATOM 0 H ALA B 66 14.434 5.533 -7.261 1.00 0.00 H new ATOM 0 HA ALA B 66 17.085 5.749 -8.145 1.00 0.00 H new ATOM 0 HB1 ALA B 66 16.848 8.100 -7.433 1.00 0.00 H new ATOM 0 HB2 ALA B 66 15.419 7.534 -8.329 1.00 0.00 H new ATOM 0 HB3 ALA B 66 15.358 7.678 -6.557 1.00 0.00 H new ATOM 1972 N LYS B 67 16.674 5.707 -4.880 1.00 0.00 N ATOM 1973 CA LYS B 67 17.375 5.458 -3.630 1.00 0.00 C ATOM 1974 C LYS B 67 17.932 4.041 -3.630 1.00 0.00 C ATOM 1975 O LYS B 67 19.113 3.825 -3.357 1.00 0.00 O ATOM 1976 CB LYS B 67 16.440 5.651 -2.429 1.00 0.00 C ATOM 1977 CG LYS B 67 15.901 7.067 -2.280 1.00 0.00 C ATOM 1978 CD LYS B 67 17.021 8.078 -2.080 1.00 0.00 C ATOM 1979 CE LYS B 67 16.482 9.485 -1.846 1.00 0.00 C ATOM 1980 NZ LYS B 67 15.735 9.597 -0.563 1.00 0.00 N ATOM 0 H LYS B 67 15.660 5.767 -4.793 1.00 0.00 H new ATOM 0 HA LYS B 67 18.193 6.173 -3.544 1.00 0.00 H new ATOM 0 HB2 LYS B 67 15.600 4.962 -2.522 1.00 0.00 H new ATOM 0 HB3 LYS B 67 16.975 5.380 -1.519 1.00 0.00 H new ATOM 0 HG2 LYS B 67 15.325 7.332 -3.167 1.00 0.00 H new ATOM 0 HG3 LYS B 67 15.217 7.109 -1.432 1.00 0.00 H new ATOM 0 HD2 LYS B 67 17.633 7.778 -1.230 1.00 0.00 H new ATOM 0 HD3 LYS B 67 17.670 8.079 -2.956 1.00 0.00 H new ATOM 0 HE2 LYS B 67 17.310 10.194 -1.845 1.00 0.00 H new ATOM 0 HE3 LYS B 67 15.826 9.763 -2.671 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 15.520 10.597 -0.373 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 14.848 9.058 -0.630 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 16.315 9.214 0.211 1.00 0.00 H new ATOM 1994 N GLY B 68 17.075 3.083 -3.954 1.00 0.00 N ATOM 1995 CA GLY B 68 17.497 1.701 -4.020 1.00 0.00 C ATOM 1996 C GLY B 68 16.509 0.761 -3.360 1.00 0.00 C ATOM 1997 O GLY B 68 16.907 -0.216 -2.730 1.00 0.00 O ATOM 0 H GLY B 68 16.091 3.241 -4.173 1.00 0.00 H new ATOM 0 HA2 GLY B 68 17.626 1.413 -5.063 1.00 0.00 H new ATOM 0 HA3 GLY B 68 18.469 1.598 -3.538 1.00 0.00 H new ATOM 2001 N GLY B 69 15.224 1.062 -3.491 1.00 0.00 N ATOM 2002 CA GLY B 69 14.197 0.201 -2.931 1.00 0.00 C ATOM 2003 C GLY B 69 13.153 -0.182 -3.960 1.00 0.00 C ATOM 2004 O GLY B 69 12.905 0.567 -4.905 1.00 0.00 O ATOM 0 H GLY B 69 14.873 1.888 -3.976 1.00 0.00 H new ATOM 0 HA2 GLY B 69 14.659 -0.701 -2.531 1.00 0.00 H new ATOM 0 HA3 GLY B 69 13.714 0.709 -2.096 1.00 0.00 H new ATOM 2008 N LYS B 70 12.542 -1.348 -3.785 1.00 0.00 N ATOM 2009 CA LYS B 70 11.543 -1.837 -4.730 1.00 0.00 C ATOM 2010 C LYS B 70 10.143 -1.736 -4.133 1.00 0.00 C ATOM 2011 O LYS B 70 9.139 -1.949 -4.821 1.00 0.00 O ATOM 2012 CB LYS B 70 11.848 -3.286 -5.118 1.00 0.00 C ATOM 2013 CG LYS B 70 13.253 -3.488 -5.669 1.00 0.00 C ATOM 2014 CD LYS B 70 13.472 -2.712 -6.960 1.00 0.00 C ATOM 2015 CE LYS B 70 14.910 -2.829 -7.440 1.00 0.00 C ATOM 2016 NZ LYS B 70 15.119 -2.147 -8.744 1.00 0.00 N ATOM 0 H LYS B 70 12.720 -1.972 -2.998 1.00 0.00 H new ATOM 0 HA LYS B 70 11.582 -1.216 -5.625 1.00 0.00 H new ATOM 0 HB2 LYS B 70 11.715 -3.923 -4.244 1.00 0.00 H new ATOM 0 HB3 LYS B 70 11.124 -3.613 -5.864 1.00 0.00 H new ATOM 0 HG2 LYS B 70 13.984 -3.170 -4.926 1.00 0.00 H new ATOM 0 HG3 LYS B 70 13.423 -4.549 -5.850 1.00 0.00 H new ATOM 0 HD2 LYS B 70 12.798 -3.087 -7.730 1.00 0.00 H new ATOM 0 HD3 LYS B 70 13.224 -1.662 -6.802 1.00 0.00 H new ATOM 0 HE2 LYS B 70 15.577 -2.397 -6.694 1.00 0.00 H new ATOM 0 HE3 LYS B 70 15.176 -3.882 -7.535 1.00 0.00 H new ATOM 0 HZ1 LYS B 70 16.125 -1.905 -8.852 1.00 0.00 H new ATOM 0 HZ2 LYS B 70 14.830 -2.780 -9.517 1.00 0.00 H new ATOM 0 HZ3 LYS B 70 14.549 -1.278 -8.776 1.00 0.00 H new ATOM 2030 N TYR B 71 10.080 -1.415 -2.849 1.00 0.00 N ATOM 2031 CA TYR B 71 8.809 -1.251 -2.162 1.00 0.00 C ATOM 2032 C TYR B 71 8.784 0.069 -1.407 1.00 0.00 C ATOM 2033 O TYR B 71 9.771 0.452 -0.773 1.00 0.00 O ATOM 2034 CB TYR B 71 8.556 -2.406 -1.187 1.00 0.00 C ATOM 2035 CG TYR B 71 8.333 -3.746 -1.854 1.00 0.00 C ATOM 2036 CD1 TYR B 71 7.316 -3.922 -2.786 1.00 0.00 C ATOM 2037 CD2 TYR B 71 9.135 -4.839 -1.548 1.00 0.00 C ATOM 2038 CE1 TYR B 71 7.107 -5.146 -3.392 1.00 0.00 C ATOM 2039 CE2 TYR B 71 8.931 -6.066 -2.150 1.00 0.00 C ATOM 2040 CZ TYR B 71 7.917 -6.213 -3.070 1.00 0.00 C ATOM 2041 OH TYR B 71 7.710 -7.435 -3.671 1.00 0.00 O ATOM 0 H TYR B 71 10.899 -1.263 -2.260 1.00 0.00 H new ATOM 0 HA TYR B 71 8.020 -1.253 -2.914 1.00 0.00 H new ATOM 0 HB2 TYR B 71 9.406 -2.487 -0.510 1.00 0.00 H new ATOM 0 HB3 TYR B 71 7.685 -2.167 -0.577 1.00 0.00 H new ATOM 0 HD1 TYR B 71 6.679 -3.088 -3.040 1.00 0.00 H new ATOM 0 HD2 TYR B 71 9.931 -4.727 -0.827 1.00 0.00 H new ATOM 0 HE1 TYR B 71 6.313 -5.266 -4.114 1.00 0.00 H new ATOM 0 HE2 TYR B 71 9.563 -6.905 -1.900 1.00 0.00 H new ATOM 0 HH TYR B 71 8.367 -8.080 -3.335 1.00 0.00 H new ATOM 2051 N TYR B 72 7.660 0.760 -1.477 1.00 0.00 N ATOM 2052 CA TYR B 72 7.506 2.024 -0.780 1.00 0.00 C ATOM 2053 C TYR B 72 6.276 1.988 0.118 1.00 0.00 C ATOM 2054 O TYR B 72 5.351 1.210 -0.106 1.00 0.00 O ATOM 2055 CB TYR B 72 7.417 3.197 -1.770 1.00 0.00 C ATOM 2056 CG TYR B 72 6.266 3.112 -2.750 1.00 0.00 C ATOM 2057 CD1 TYR B 72 5.017 3.636 -2.436 1.00 0.00 C ATOM 2058 CD2 TYR B 72 6.431 2.518 -3.995 1.00 0.00 C ATOM 2059 CE1 TYR B 72 3.966 3.564 -3.332 1.00 0.00 C ATOM 2060 CE2 TYR B 72 5.386 2.443 -4.895 1.00 0.00 C ATOM 2061 CZ TYR B 72 4.156 2.967 -4.560 1.00 0.00 C ATOM 2062 OH TYR B 72 3.112 2.892 -5.456 1.00 0.00 O ATOM 0 H TYR B 72 6.841 0.467 -2.009 1.00 0.00 H new ATOM 0 HA TYR B 72 8.388 2.177 -0.159 1.00 0.00 H new ATOM 0 HB2 TYR B 72 7.328 4.125 -1.205 1.00 0.00 H new ATOM 0 HB3 TYR B 72 8.350 3.253 -2.330 1.00 0.00 H new ATOM 0 HD1 TYR B 72 4.865 4.107 -1.476 1.00 0.00 H new ATOM 0 HD2 TYR B 72 7.393 2.108 -4.264 1.00 0.00 H new ATOM 0 HE1 TYR B 72 3.001 3.973 -3.071 1.00 0.00 H new ATOM 0 HE2 TYR B 72 5.532 1.976 -5.858 1.00 0.00 H new ATOM 0 HH TYR B 72 3.414 2.443 -6.273 1.00 0.00 H new ATOM 2072 N HIS B 73 6.279 2.818 1.143 1.00 0.00 N ATOM 2073 CA HIS B 73 5.151 2.915 2.056 1.00 0.00 C ATOM 2074 C HIS B 73 4.812 4.377 2.303 1.00 0.00 C ATOM 2075 O HIS B 73 5.581 5.092 2.939 1.00 0.00 O ATOM 2076 CB HIS B 73 5.474 2.209 3.384 1.00 0.00 C ATOM 2077 CG HIS B 73 4.461 2.446 4.468 1.00 0.00 C ATOM 2078 ND1 HIS B 73 4.785 2.988 5.693 1.00 0.00 N ATOM 2079 CD2 HIS B 73 3.127 2.218 4.504 1.00 0.00 C ATOM 2080 CE1 HIS B 73 3.698 3.083 6.433 1.00 0.00 C ATOM 2081 NE2 HIS B 73 2.676 2.623 5.737 1.00 0.00 N ATOM 0 H HIS B 73 7.055 3.440 1.367 1.00 0.00 H new ATOM 0 HA HIS B 73 4.289 2.423 1.606 1.00 0.00 H new ATOM 0 HB2 HIS B 73 5.553 1.137 3.203 1.00 0.00 H new ATOM 0 HB3 HIS B 73 6.450 2.546 3.734 1.00 0.00 H new ATOM 0 HD1 HIS B 73 5.721 3.272 5.982 1.00 0.00 H new ATOM 0 HD2 HIS B 73 2.528 1.796 3.710 1.00 0.00 H new ATOM 0 HE1 HIS B 73 3.652 3.472 7.439 1.00 0.00 H new ATOM 2090 N ILE B 74 3.677 4.816 1.784 1.00 0.00 N ATOM 2091 CA ILE B 74 3.229 6.189 1.983 1.00 0.00 C ATOM 2092 C ILE B 74 2.912 6.431 3.454 1.00 0.00 C ATOM 2093 O ILE B 74 2.144 5.681 4.065 1.00 0.00 O ATOM 2094 CB ILE B 74 1.984 6.507 1.126 1.00 0.00 C ATOM 2095 CG1 ILE B 74 2.269 6.217 -0.351 1.00 0.00 C ATOM 2096 CG2 ILE B 74 1.563 7.960 1.313 1.00 0.00 C ATOM 2097 CD1 ILE B 74 1.075 6.433 -1.257 1.00 0.00 C ATOM 0 H ILE B 74 3.048 4.243 1.221 1.00 0.00 H new ATOM 0 HA ILE B 74 4.038 6.849 1.670 1.00 0.00 H new ATOM 0 HB ILE B 74 1.164 5.868 1.454 1.00 0.00 H new ATOM 0 HG12 ILE B 74 3.087 6.855 -0.686 1.00 0.00 H new ATOM 0 HG13 ILE B 74 2.607 5.186 -0.451 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.684 8.166 0.702 1.00 0.00 H new ATOM 0 HG22 ILE B 74 1.325 8.138 2.362 1.00 0.00 H new ATOM 0 HG23 ILE B 74 2.378 8.617 1.010 1.00 0.00 H new ATOM 0 HD11 ILE B 74 1.354 6.208 -2.286 1.00 0.00 H new ATOM 0 HD12 ILE B 74 0.261 5.776 -0.949 1.00 0.00 H new ATOM 0 HD13 ILE B 74 0.749 7.471 -1.188 1.00 0.00 H new ATOM 2109 N ILE B 75 3.519 7.460 4.030 1.00 0.00 N ATOM 2110 CA ILE B 75 3.289 7.783 5.429 1.00 0.00 C ATOM 2111 C ILE B 75 2.453 9.050 5.572 1.00 0.00 C ATOM 2112 O ILE B 75 1.701 9.199 6.538 1.00 0.00 O ATOM 2113 CB ILE B 75 4.611 7.936 6.216 1.00 0.00 C ATOM 2114 CG1 ILE B 75 5.508 9.008 5.586 1.00 0.00 C ATOM 2115 CG2 ILE B 75 5.336 6.601 6.284 1.00 0.00 C ATOM 2116 CD1 ILE B 75 6.796 9.246 6.346 1.00 0.00 C ATOM 0 H ILE B 75 4.171 8.082 3.552 1.00 0.00 H new ATOM 0 HA ILE B 75 2.738 6.944 5.855 1.00 0.00 H new ATOM 0 HB ILE B 75 4.372 8.258 7.230 1.00 0.00 H new ATOM 0 HG12 ILE B 75 5.748 8.714 4.564 1.00 0.00 H new ATOM 0 HG13 ILE B 75 4.953 9.944 5.526 1.00 0.00 H new ATOM 0 HG21 ILE B 75 6.266 6.720 6.840 1.00 0.00 H new ATOM 0 HG22 ILE B 75 4.704 5.869 6.786 1.00 0.00 H new ATOM 0 HG23 ILE B 75 5.559 6.256 5.274 1.00 0.00 H new ATOM 0 HD11 ILE B 75 7.379 10.017 5.842 1.00 0.00 H new ATOM 0 HD12 ILE B 75 6.565 9.571 7.360 1.00 0.00 H new ATOM 0 HD13 ILE B 75 7.372 8.322 6.384 1.00 0.00 H new ATOM 2128 N ALA B 76 2.564 9.951 4.603 1.00 0.00 N ATOM 2129 CA ALA B 76 1.808 11.195 4.637 1.00 0.00 C ATOM 2130 C ALA B 76 1.628 11.772 3.237 1.00 0.00 C ATOM 2131 O ALA B 76 2.552 12.352 2.672 1.00 0.00 O ATOM 2132 CB ALA B 76 2.494 12.211 5.542 1.00 0.00 C ATOM 0 H ALA B 76 3.168 9.843 3.788 1.00 0.00 H new ATOM 0 HA ALA B 76 0.820 10.974 5.040 1.00 0.00 H new ATOM 0 HB1 ALA B 76 1.916 13.135 5.556 1.00 0.00 H new ATOM 0 HB2 ALA B 76 2.562 11.810 6.553 1.00 0.00 H new ATOM 0 HB3 ALA B 76 3.496 12.416 5.165 1.00 0.00 H new ATOM 2138 N ALA B 77 0.443 11.588 2.674 1.00 0.00 N ATOM 2139 CA ALA B 77 0.110 12.185 1.388 1.00 0.00 C ATOM 2140 C ALA B 77 -0.783 13.399 1.604 1.00 0.00 C ATOM 2141 O ALA B 77 -2.013 13.298 1.579 1.00 0.00 O ATOM 2142 CB ALA B 77 -0.566 11.168 0.478 1.00 0.00 C ATOM 0 H ALA B 77 -0.304 11.030 3.087 1.00 0.00 H new ATOM 0 HA ALA B 77 1.029 12.506 0.898 1.00 0.00 H new ATOM 0 HB1 ALA B 77 -0.805 11.636 -0.477 1.00 0.00 H new ATOM 0 HB2 ALA B 77 0.106 10.326 0.311 1.00 0.00 H new ATOM 0 HB3 ALA B 77 -1.483 10.812 0.948 1.00 0.00 H new ATOM 2148 N ARG B 78 -0.155 14.541 1.835 1.00 0.00 N ATOM 2149 CA ARG B 78 -0.882 15.731 2.242 1.00 0.00 C ATOM 2150 C ARG B 78 -1.161 16.640 1.056 1.00 0.00 C ATOM 2151 O ARG B 78 -0.418 16.658 0.073 1.00 0.00 O ATOM 2152 CB ARG B 78 -0.089 16.508 3.302 1.00 0.00 C ATOM 2153 CG ARG B 78 1.126 17.239 2.745 1.00 0.00 C ATOM 2154 CD ARG B 78 1.856 18.032 3.818 1.00 0.00 C ATOM 2155 NE ARG B 78 2.566 17.169 4.758 1.00 0.00 N ATOM 2156 CZ ARG B 78 2.498 17.293 6.083 1.00 0.00 C ATOM 2157 NH1 ARG B 78 1.713 18.216 6.628 1.00 0.00 N ATOM 2158 NH2 ARG B 78 3.213 16.489 6.859 1.00 0.00 N ATOM 0 H ARG B 78 0.853 14.668 1.748 1.00 0.00 H new ATOM 0 HA ARG B 78 -1.833 15.406 2.664 1.00 0.00 H new ATOM 0 HB2 ARG B 78 -0.750 17.232 3.779 1.00 0.00 H new ATOM 0 HB3 ARG B 78 0.239 15.816 4.078 1.00 0.00 H new ATOM 0 HG2 ARG B 78 1.810 16.517 2.299 1.00 0.00 H new ATOM 0 HG3 ARG B 78 0.810 17.913 1.948 1.00 0.00 H new ATOM 0 HD2 ARG B 78 2.565 18.712 3.345 1.00 0.00 H new ATOM 0 HD3 ARG B 78 1.140 18.647 4.363 1.00 0.00 H new ATOM 0 HE ARG B 78 3.150 16.425 4.377 1.00 0.00 H new ATOM 0 HH11 ARG B 78 1.160 18.832 6.032 1.00 0.00 H new ATOM 0 HH12 ARG B 78 1.663 18.309 7.643 1.00 0.00 H new ATOM 0 HH21 ARG B 78 3.813 15.778 6.441 1.00 0.00 H new ATOM 0 HH22 ARG B 78 3.163 16.582 7.874 1.00 0.00 H new ATOM 2172 N GLU B 79 -2.242 17.391 1.159 1.00 0.00 N ATOM 2173 CA GLU B 79 -2.546 18.414 0.182 1.00 0.00 C ATOM 2174 C GLU B 79 -2.257 19.771 0.811 1.00 0.00 C ATOM 2175 O GLU B 79 -3.122 20.383 1.441 1.00 0.00 O ATOM 2176 CB GLU B 79 -4.005 18.308 -0.261 1.00 0.00 C ATOM 2177 CG GLU B 79 -4.295 18.987 -1.586 1.00 0.00 C ATOM 2178 CD GLU B 79 -5.696 18.700 -2.072 1.00 0.00 C ATOM 2179 OE1 GLU B 79 -5.997 17.522 -2.358 1.00 0.00 O ATOM 2180 OE2 GLU B 79 -6.514 19.642 -2.146 1.00 0.00 O ATOM 0 H GLU B 79 -2.924 17.309 1.913 1.00 0.00 H new ATOM 0 HA GLU B 79 -1.928 18.287 -0.707 1.00 0.00 H new ATOM 0 HB2 GLU B 79 -4.276 17.255 -0.336 1.00 0.00 H new ATOM 0 HB3 GLU B 79 -4.641 18.747 0.508 1.00 0.00 H new ATOM 0 HG2 GLU B 79 -4.161 20.063 -1.479 1.00 0.00 H new ATOM 0 HG3 GLU B 79 -3.576 18.649 -2.332 1.00 0.00 H new ATOM 2187 N HIS B 80 -1.014 20.206 0.665 1.00 0.00 N ATOM 2188 CA HIS B 80 -0.525 21.407 1.329 1.00 0.00 C ATOM 2189 C HIS B 80 -0.898 22.639 0.512 1.00 0.00 C ATOM 2190 O HIS B 80 -0.039 23.291 -0.083 1.00 0.00 O ATOM 2191 CB HIS B 80 1.000 21.302 1.495 1.00 0.00 C ATOM 2192 CG HIS B 80 1.608 22.270 2.467 1.00 0.00 C ATOM 2193 ND1 HIS B 80 2.869 22.095 2.989 1.00 0.00 N ATOM 2194 CD2 HIS B 80 1.134 23.416 3.008 1.00 0.00 C ATOM 2195 CE1 HIS B 80 3.145 23.087 3.812 1.00 0.00 C ATOM 2196 NE2 HIS B 80 2.109 23.906 3.842 1.00 0.00 N ATOM 0 H HIS B 80 -0.317 19.739 0.085 1.00 0.00 H new ATOM 0 HA HIS B 80 -0.983 21.501 2.313 1.00 0.00 H new ATOM 0 HB2 HIS B 80 1.245 20.289 1.815 1.00 0.00 H new ATOM 0 HB3 HIS B 80 1.466 21.450 0.521 1.00 0.00 H new ATOM 0 HD1 HIS B 80 3.493 21.318 2.773 1.00 0.00 H new ATOM 0 HD2 HIS B 80 0.169 23.862 2.819 1.00 0.00 H new ATOM 0 HE1 HIS B 80 4.063 23.209 4.368 1.00 0.00 H new ATOM 2205 N GLY B 81 -2.189 22.930 0.466 1.00 0.00 N ATOM 2206 CA GLY B 81 -2.673 24.030 -0.336 1.00 0.00 C ATOM 2207 C GLY B 81 -2.643 23.681 -1.806 1.00 0.00 C ATOM 2208 O GLY B 81 -3.300 22.727 -2.228 1.00 0.00 O ATOM 0 H GLY B 81 -2.912 22.420 0.973 1.00 0.00 H new ATOM 0 HA2 GLY B 81 -3.691 24.281 -0.039 1.00 0.00 H new ATOM 0 HA3 GLY B 81 -2.061 24.914 -0.156 1.00 0.00 H new ATOM 2212 N PRO B 82 -1.880 24.428 -2.610 1.00 0.00 N ATOM 2213 CA PRO B 82 -1.664 24.118 -4.012 1.00 0.00 C ATOM 2214 C PRO B 82 -0.478 23.173 -4.197 1.00 0.00 C ATOM 2215 O PRO B 82 -0.231 22.666 -5.288 1.00 0.00 O ATOM 2216 CB PRO B 82 -1.362 25.485 -4.643 1.00 0.00 C ATOM 2217 CG PRO B 82 -1.194 26.455 -3.507 1.00 0.00 C ATOM 2218 CD PRO B 82 -1.182 25.657 -2.231 1.00 0.00 C ATOM 0 HA PRO B 82 -2.520 23.614 -4.462 1.00 0.00 H new ATOM 0 HB2 PRO B 82 -0.458 25.440 -5.251 1.00 0.00 H new ATOM 0 HB3 PRO B 82 -2.174 25.796 -5.301 1.00 0.00 H new ATOM 0 HG2 PRO B 82 -0.267 27.017 -3.617 1.00 0.00 H new ATOM 0 HG3 PRO B 82 -2.008 27.180 -3.498 1.00 0.00 H new ATOM 0 HD2 PRO B 82 -0.167 25.456 -1.889 1.00 0.00 H new ATOM 0 HD3 PRO B 82 -1.693 26.179 -1.422 1.00 0.00 H new ATOM 2226 N ASN B 83 0.253 22.943 -3.115 1.00 0.00 N ATOM 2227 CA ASN B 83 1.430 22.091 -3.151 1.00 0.00 C ATOM 2228 C ASN B 83 1.105 20.713 -2.608 1.00 0.00 C ATOM 2229 O ASN B 83 0.907 20.536 -1.408 1.00 0.00 O ATOM 2230 CB ASN B 83 2.577 22.709 -2.343 1.00 0.00 C ATOM 2231 CG ASN B 83 3.212 23.901 -3.033 1.00 0.00 C ATOM 2232 OD1 ASN B 83 2.565 24.615 -3.800 1.00 0.00 O ATOM 2233 ND2 ASN B 83 4.485 24.132 -2.754 1.00 0.00 N ATOM 0 H ASN B 83 0.049 23.338 -2.197 1.00 0.00 H new ATOM 0 HA ASN B 83 1.745 21.999 -4.190 1.00 0.00 H new ATOM 0 HB2 ASN B 83 2.202 23.018 -1.367 1.00 0.00 H new ATOM 0 HB3 ASN B 83 3.339 21.950 -2.165 1.00 0.00 H new ATOM 0 HD21 ASN B 83 4.965 24.925 -3.180 1.00 0.00 H new ATOM 0 HD22 ASN B 83 4.986 23.517 -2.113 1.00 0.00 H new ATOM 2240 N PHE B 84 1.034 19.741 -3.492 1.00 0.00 N ATOM 2241 CA PHE B 84 0.755 18.379 -3.091 1.00 0.00 C ATOM 2242 C PHE B 84 2.044 17.702 -2.640 1.00 0.00 C ATOM 2243 O PHE B 84 3.008 17.624 -3.401 1.00 0.00 O ATOM 2244 CB PHE B 84 0.115 17.610 -4.248 1.00 0.00 C ATOM 2245 CG PHE B 84 -0.222 16.191 -3.895 1.00 0.00 C ATOM 2246 CD1 PHE B 84 -1.358 15.898 -3.158 1.00 0.00 C ATOM 2247 CD2 PHE B 84 0.602 15.152 -4.294 1.00 0.00 C ATOM 2248 CE1 PHE B 84 -1.665 14.594 -2.825 1.00 0.00 C ATOM 2249 CE2 PHE B 84 0.297 13.847 -3.964 1.00 0.00 C ATOM 2250 CZ PHE B 84 -0.837 13.566 -3.230 1.00 0.00 C ATOM 0 H PHE B 84 1.166 19.869 -4.495 1.00 0.00 H new ATOM 0 HA PHE B 84 0.054 18.385 -2.257 1.00 0.00 H new ATOM 0 HB2 PHE B 84 -0.793 18.126 -4.561 1.00 0.00 H new ATOM 0 HB3 PHE B 84 0.795 17.615 -5.100 1.00 0.00 H new ATOM 0 HD1 PHE B 84 -2.010 16.698 -2.841 1.00 0.00 H new ATOM 0 HD2 PHE B 84 1.491 15.365 -4.869 1.00 0.00 H new ATOM 0 HE1 PHE B 84 -2.552 14.378 -2.248 1.00 0.00 H new ATOM 0 HE2 PHE B 84 0.947 13.045 -4.281 1.00 0.00 H new ATOM 0 HZ PHE B 84 -1.076 12.545 -2.973 1.00 0.00 H new ATOM 2260 N GLU B 85 2.065 17.222 -1.403 1.00 0.00 N ATOM 2261 CA GLU B 85 3.275 16.640 -0.840 1.00 0.00 C ATOM 2262 C GLU B 85 3.006 15.242 -0.297 1.00 0.00 C ATOM 2263 O GLU B 85 2.348 15.076 0.730 1.00 0.00 O ATOM 2264 CB GLU B 85 3.835 17.532 0.269 1.00 0.00 C ATOM 2265 CG GLU B 85 4.046 18.972 -0.162 1.00 0.00 C ATOM 2266 CD GLU B 85 4.791 19.790 0.868 1.00 0.00 C ATOM 2267 OE1 GLU B 85 4.227 20.061 1.949 1.00 0.00 O ATOM 2268 OE2 GLU B 85 5.953 20.165 0.600 1.00 0.00 O ATOM 0 H GLU B 85 1.262 17.224 -0.774 1.00 0.00 H new ATOM 0 HA GLU B 85 4.013 16.565 -1.639 1.00 0.00 H new ATOM 0 HB2 GLU B 85 3.154 17.512 1.120 1.00 0.00 H new ATOM 0 HB3 GLU B 85 4.785 17.120 0.611 1.00 0.00 H new ATOM 0 HG2 GLU B 85 4.599 18.988 -1.101 1.00 0.00 H new ATOM 0 HG3 GLU B 85 3.078 19.434 -0.355 1.00 0.00 H new ATOM 2275 N ALA B 86 3.513 14.243 -0.997 1.00 0.00 N ATOM 2276 CA ALA B 86 3.359 12.862 -0.576 1.00 0.00 C ATOM 2277 C ALA B 86 4.694 12.290 -0.119 1.00 0.00 C ATOM 2278 O ALA B 86 5.630 12.158 -0.905 1.00 0.00 O ATOM 2279 CB ALA B 86 2.774 12.022 -1.698 1.00 0.00 C ATOM 0 H ALA B 86 4.037 14.363 -1.864 1.00 0.00 H new ATOM 0 HA ALA B 86 2.668 12.836 0.266 1.00 0.00 H new ATOM 0 HB1 ALA B 86 2.667 10.991 -1.362 1.00 0.00 H new ATOM 0 HB2 ALA B 86 1.797 12.417 -1.976 1.00 0.00 H new ATOM 0 HB3 ALA B 86 3.438 12.055 -2.562 1.00 0.00 H new ATOM 2285 N VAL B 87 4.780 11.975 1.161 1.00 0.00 N ATOM 2286 CA VAL B 87 5.999 11.435 1.739 1.00 0.00 C ATOM 2287 C VAL B 87 5.854 9.934 1.975 1.00 0.00 C ATOM 2288 O VAL B 87 4.818 9.471 2.466 1.00 0.00 O ATOM 2289 CB VAL B 87 6.340 12.142 3.067 1.00 0.00 C ATOM 2290 CG1 VAL B 87 7.679 11.669 3.610 1.00 0.00 C ATOM 2291 CG2 VAL B 87 6.337 13.651 2.875 1.00 0.00 C ATOM 0 H VAL B 87 4.014 12.085 1.825 1.00 0.00 H new ATOM 0 HA VAL B 87 6.812 11.610 1.034 1.00 0.00 H new ATOM 0 HB VAL B 87 5.575 11.883 3.799 1.00 0.00 H new ATOM 0 HG11 VAL B 87 7.894 12.184 4.546 1.00 0.00 H new ATOM 0 HG12 VAL B 87 7.641 10.594 3.787 1.00 0.00 H new ATOM 0 HG13 VAL B 87 8.464 11.890 2.886 1.00 0.00 H new ATOM 0 HG21 VAL B 87 6.579 14.138 3.819 1.00 0.00 H new ATOM 0 HG22 VAL B 87 7.079 13.924 2.125 1.00 0.00 H new ATOM 0 HG23 VAL B 87 5.350 13.974 2.543 1.00 0.00 H new ATOM 2301 N ALA B 88 6.886 9.181 1.622 1.00 0.00 N ATOM 2302 CA ALA B 88 6.848 7.731 1.733 1.00 0.00 C ATOM 2303 C ALA B 88 8.187 7.173 2.204 1.00 0.00 C ATOM 2304 O ALA B 88 9.203 7.870 2.192 1.00 0.00 O ATOM 2305 CB ALA B 88 6.464 7.117 0.394 1.00 0.00 C ATOM 0 H ALA B 88 7.762 9.552 1.255 1.00 0.00 H new ATOM 0 HA ALA B 88 6.097 7.469 2.478 1.00 0.00 H new ATOM 0 HB1 ALA B 88 6.438 6.031 0.486 1.00 0.00 H new ATOM 0 HB2 ALA B 88 5.480 7.480 0.096 1.00 0.00 H new ATOM 0 HB3 ALA B 88 7.199 7.400 -0.360 1.00 0.00 H new ATOM 2311 N GLU B 89 8.179 5.908 2.597 1.00 0.00 N ATOM 2312 CA GLU B 89 9.387 5.225 3.035 1.00 0.00 C ATOM 2313 C GLU B 89 9.907 4.337 1.913 1.00 0.00 C ATOM 2314 O GLU B 89 9.123 3.805 1.126 1.00 0.00 O ATOM 2315 CB GLU B 89 9.105 4.348 4.258 1.00 0.00 C ATOM 2316 CG GLU B 89 8.538 5.077 5.466 1.00 0.00 C ATOM 2317 CD GLU B 89 8.243 4.127 6.617 1.00 0.00 C ATOM 2318 OE1 GLU B 89 9.146 3.898 7.452 1.00 0.00 O ATOM 2319 OE2 GLU B 89 7.112 3.595 6.687 1.00 0.00 O ATOM 0 H GLU B 89 7.340 5.329 2.621 1.00 0.00 H new ATOM 0 HA GLU B 89 10.127 5.981 3.298 1.00 0.00 H new ATOM 0 HB2 GLU B 89 8.407 3.563 3.968 1.00 0.00 H new ATOM 0 HB3 GLU B 89 10.032 3.857 4.553 1.00 0.00 H new ATOM 0 HG2 GLU B 89 9.246 5.838 5.796 1.00 0.00 H new ATOM 0 HG3 GLU B 89 7.623 5.596 5.180 1.00 0.00 H new ATOM 2326 N VAL B 90 11.221 4.177 1.842 1.00 0.00 N ATOM 2327 CA VAL B 90 11.838 3.336 0.825 1.00 0.00 C ATOM 2328 C VAL B 90 12.482 2.110 1.466 1.00 0.00 C ATOM 2329 O VAL B 90 13.423 2.234 2.254 1.00 0.00 O ATOM 2330 CB VAL B 90 12.908 4.111 0.027 1.00 0.00 C ATOM 2331 CG1 VAL B 90 13.530 3.229 -1.044 1.00 0.00 C ATOM 2332 CG2 VAL B 90 12.310 5.365 -0.592 1.00 0.00 C ATOM 0 H VAL B 90 11.883 4.620 2.479 1.00 0.00 H new ATOM 0 HA VAL B 90 11.050 3.022 0.140 1.00 0.00 H new ATOM 0 HB VAL B 90 13.696 4.411 0.718 1.00 0.00 H new ATOM 0 HG11 VAL B 90 14.281 3.798 -1.593 1.00 0.00 H new ATOM 0 HG12 VAL B 90 14.000 2.364 -0.575 1.00 0.00 H new ATOM 0 HG13 VAL B 90 12.755 2.892 -1.733 1.00 0.00 H new ATOM 0 HG21 VAL B 90 13.080 5.898 -1.150 1.00 0.00 H new ATOM 0 HG22 VAL B 90 11.500 5.087 -1.266 1.00 0.00 H new ATOM 0 HG23 VAL B 90 11.922 6.010 0.196 1.00 0.00 H new ATOM 2342 N TYR B 91 11.975 0.931 1.129 1.00 0.00 N ATOM 2343 CA TYR B 91 12.496 -0.311 1.687 1.00 0.00 C ATOM 2344 C TYR B 91 12.897 -1.282 0.585 1.00 0.00 C ATOM 2345 O TYR B 91 12.290 -1.312 -0.488 1.00 0.00 O ATOM 2346 CB TYR B 91 11.461 -0.980 2.598 1.00 0.00 C ATOM 2347 CG TYR B 91 11.252 -0.276 3.919 1.00 0.00 C ATOM 2348 CD1 TYR B 91 10.368 0.786 4.033 1.00 0.00 C ATOM 2349 CD2 TYR B 91 11.942 -0.678 5.054 1.00 0.00 C ATOM 2350 CE1 TYR B 91 10.177 1.426 5.240 1.00 0.00 C ATOM 2351 CE2 TYR B 91 11.755 -0.041 6.267 1.00 0.00 C ATOM 2352 CZ TYR B 91 10.873 1.013 6.351 1.00 0.00 C ATOM 2353 OH TYR B 91 10.682 1.657 7.552 1.00 0.00 O ATOM 0 H TYR B 91 11.204 0.808 0.472 1.00 0.00 H new ATOM 0 HA TYR B 91 13.378 -0.056 2.274 1.00 0.00 H new ATOM 0 HB2 TYR B 91 10.508 -1.030 2.071 1.00 0.00 H new ATOM 0 HB3 TYR B 91 11.773 -2.006 2.791 1.00 0.00 H new ATOM 0 HD1 TYR B 91 9.820 1.117 3.163 1.00 0.00 H new ATOM 0 HD2 TYR B 91 12.637 -1.502 4.989 1.00 0.00 H new ATOM 0 HE1 TYR B 91 9.482 2.250 5.312 1.00 0.00 H new ATOM 0 HE2 TYR B 91 12.297 -0.368 7.142 1.00 0.00 H new ATOM 0 HH TYR B 91 10.209 2.502 7.399 1.00 0.00 H new ATOM 2363 N ASN B 92 13.925 -2.070 0.860 1.00 0.00 N ATOM 2364 CA ASN B 92 14.357 -3.123 -0.048 1.00 0.00 C ATOM 2365 C ASN B 92 14.671 -4.373 0.765 1.00 0.00 C ATOM 2366 O ASN B 92 14.847 -4.297 1.980 1.00 0.00 O ATOM 2367 CB ASN B 92 15.591 -2.685 -0.854 1.00 0.00 C ATOM 2368 CG ASN B 92 15.791 -3.481 -2.143 1.00 0.00 C ATOM 2369 OD1 ASN B 92 15.384 -4.634 -2.260 1.00 0.00 O ATOM 2370 ND2 ASN B 92 16.426 -2.863 -3.124 1.00 0.00 N ATOM 0 H ASN B 92 14.480 -1.999 1.713 1.00 0.00 H new ATOM 0 HA ASN B 92 13.558 -3.334 -0.759 1.00 0.00 H new ATOM 0 HB2 ASN B 92 15.498 -1.627 -1.100 1.00 0.00 H new ATOM 0 HB3 ASN B 92 16.479 -2.790 -0.230 1.00 0.00 H new ATOM 0 HD21 ASN B 92 16.590 -3.344 -4.008 1.00 0.00 H new ATOM 0 HD22 ASN B 92 16.752 -1.905 -2.997 1.00 0.00 H new ATOM 2377 N ASP B 93 14.719 -5.512 0.103 1.00 0.00 N ATOM 2378 CA ASP B 93 15.051 -6.766 0.757 1.00 0.00 C ATOM 2379 C ASP B 93 16.569 -6.918 0.814 1.00 0.00 C ATOM 2380 O ASP B 93 17.294 -6.118 0.219 1.00 0.00 O ATOM 2381 CB ASP B 93 14.405 -7.935 -0.003 1.00 0.00 C ATOM 2382 CG ASP B 93 14.631 -9.278 0.661 1.00 0.00 C ATOM 2383 OD1 ASP B 93 14.661 -9.335 1.905 1.00 0.00 O ATOM 2384 OD2 ASP B 93 14.799 -10.281 -0.064 1.00 0.00 O ATOM 0 H ASP B 93 14.531 -5.597 -0.896 1.00 0.00 H new ATOM 0 HA ASP B 93 14.663 -6.769 1.776 1.00 0.00 H new ATOM 0 HB2 ASP B 93 13.333 -7.756 -0.089 1.00 0.00 H new ATOM 0 HB3 ASP B 93 14.805 -7.966 -1.016 1.00 0.00 H new ATOM 2389 N ALA B 94 17.050 -7.928 1.529 1.00 0.00 N ATOM 2390 CA ALA B 94 18.484 -8.158 1.665 1.00 0.00 C ATOM 2391 C ALA B 94 19.078 -8.736 0.380 1.00 0.00 C ATOM 2392 O ALA B 94 19.564 -9.867 0.355 1.00 0.00 O ATOM 2393 CB ALA B 94 18.760 -9.077 2.848 1.00 0.00 C ATOM 0 H ALA B 94 16.467 -8.602 2.025 1.00 0.00 H new ATOM 0 HA ALA B 94 18.966 -7.198 1.848 1.00 0.00 H new ATOM 0 HB1 ALA B 94 19.834 -9.241 2.939 1.00 0.00 H new ATOM 0 HB2 ALA B 94 18.385 -8.616 3.762 1.00 0.00 H new ATOM 0 HB3 ALA B 94 18.259 -10.032 2.691 1.00 0.00 H new ATOM 2399 N THR B 95 19.020 -7.950 -0.685 1.00 0.00 N ATOM 2400 CA THR B 95 19.555 -8.346 -1.975 1.00 0.00 C ATOM 2401 C THR B 95 21.080 -8.262 -1.971 1.00 0.00 C ATOM 2402 O THR B 95 21.774 -9.279 -2.030 1.00 0.00 O ATOM 2403 CB THR B 95 18.983 -7.451 -3.090 1.00 0.00 C ATOM 2404 OG1 THR B 95 18.980 -6.082 -2.657 1.00 0.00 O ATOM 2405 CG2 THR B 95 17.568 -7.871 -3.456 1.00 0.00 C ATOM 0 H THR B 95 18.600 -7.020 -0.677 1.00 0.00 H new ATOM 0 HA THR B 95 19.261 -9.378 -2.165 1.00 0.00 H new ATOM 0 HB THR B 95 19.614 -7.559 -3.972 1.00 0.00 H new ATOM 0 HG1 THR B 95 18.617 -5.515 -3.369 1.00 0.00 H new ATOM 0 HG21 THR B 95 17.189 -7.222 -4.246 1.00 0.00 H new ATOM 0 HG22 THR B 95 17.574 -8.903 -3.806 1.00 0.00 H new ATOM 0 HG23 THR B 95 16.926 -7.789 -2.579 1.00 0.00 H new ATOM 2413 N LYS B 96 21.589 -7.043 -1.892 1.00 0.00 N ATOM 2414 CA LYS B 96 23.018 -6.810 -1.769 1.00 0.00 C ATOM 2415 C LYS B 96 23.348 -6.428 -0.328 1.00 0.00 C ATOM 2416 O LYS B 96 23.210 -5.270 0.076 1.00 0.00 O ATOM 2417 CB LYS B 96 23.473 -5.726 -2.758 1.00 0.00 C ATOM 2418 CG LYS B 96 22.605 -4.474 -2.749 1.00 0.00 C ATOM 2419 CD LYS B 96 23.017 -3.496 -3.839 1.00 0.00 C ATOM 2420 CE LYS B 96 22.136 -2.255 -3.834 1.00 0.00 C ATOM 2421 NZ LYS B 96 22.351 -1.421 -2.621 1.00 0.00 N ATOM 0 H LYS B 96 21.027 -6.192 -1.911 1.00 0.00 H new ATOM 0 HA LYS B 96 23.559 -7.723 -2.016 1.00 0.00 H new ATOM 0 HB2 LYS B 96 24.500 -5.445 -2.526 1.00 0.00 H new ATOM 0 HB3 LYS B 96 23.477 -6.145 -3.764 1.00 0.00 H new ATOM 0 HG2 LYS B 96 21.561 -4.754 -2.887 1.00 0.00 H new ATOM 0 HG3 LYS B 96 22.678 -3.987 -1.777 1.00 0.00 H new ATOM 0 HD2 LYS B 96 24.058 -3.206 -3.695 1.00 0.00 H new ATOM 0 HD3 LYS B 96 22.954 -3.985 -4.811 1.00 0.00 H new ATOM 0 HE2 LYS B 96 22.343 -1.660 -4.724 1.00 0.00 H new ATOM 0 HE3 LYS B 96 21.089 -2.554 -3.887 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 21.849 -0.516 -2.728 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 21.986 -1.922 -1.786 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 23.368 -1.240 -2.500 1.00 0.00 H new ATOM 2435 N LEU B 97 23.750 -7.417 0.456 1.00 0.00 N ATOM 2436 CA LEU B 97 23.948 -7.221 1.882 1.00 0.00 C ATOM 2437 C LEU B 97 25.410 -7.408 2.267 1.00 0.00 C ATOM 2438 O LEU B 97 26.103 -8.278 1.736 1.00 0.00 O ATOM 2439 CB LEU B 97 23.067 -8.194 2.672 1.00 0.00 C ATOM 2440 CG LEU B 97 23.110 -8.035 4.195 1.00 0.00 C ATOM 2441 CD1 LEU B 97 22.583 -6.668 4.608 1.00 0.00 C ATOM 2442 CD2 LEU B 97 22.311 -9.141 4.868 1.00 0.00 C ATOM 0 H LEU B 97 23.945 -8.363 0.128 1.00 0.00 H new ATOM 0 HA LEU B 97 23.663 -6.198 2.126 1.00 0.00 H new ATOM 0 HB2 LEU B 97 22.036 -8.074 2.341 1.00 0.00 H new ATOM 0 HB3 LEU B 97 23.366 -9.212 2.422 1.00 0.00 H new ATOM 0 HG LEU B 97 24.148 -8.113 4.519 1.00 0.00 H new ATOM 0 HD11 LEU B 97 22.622 -6.576 5.693 1.00 0.00 H new ATOM 0 HD12 LEU B 97 23.197 -5.889 4.155 1.00 0.00 H new ATOM 0 HD13 LEU B 97 21.552 -6.559 4.272 1.00 0.00 H new ATOM 0 HD21 LEU B 97 22.352 -9.013 5.950 1.00 0.00 H new ATOM 0 HD22 LEU B 97 21.274 -9.094 4.536 1.00 0.00 H new ATOM 0 HD23 LEU B 97 22.734 -10.109 4.601 1.00 0.00 H new ATOM 2454 N GLU B 98 25.869 -6.573 3.185 1.00 0.00 N ATOM 2455 CA GLU B 98 27.215 -6.671 3.727 1.00 0.00 C ATOM 2456 C GLU B 98 27.192 -7.422 5.055 1.00 0.00 C ATOM 2457 O GLU B 98 26.122 -7.755 5.568 1.00 0.00 O ATOM 2458 CB GLU B 98 27.802 -5.277 3.929 1.00 0.00 C ATOM 2459 CG GLU B 98 26.830 -4.312 4.585 1.00 0.00 C ATOM 2460 CD GLU B 98 27.524 -3.208 5.346 1.00 0.00 C ATOM 2461 OE1 GLU B 98 28.378 -2.510 4.757 1.00 0.00 O ATOM 2462 OE2 GLU B 98 27.222 -3.050 6.547 1.00 0.00 O ATOM 0 H GLU B 98 25.319 -5.808 3.576 1.00 0.00 H new ATOM 0 HA GLU B 98 27.838 -7.219 3.020 1.00 0.00 H new ATOM 0 HB2 GLU B 98 28.700 -5.352 4.542 1.00 0.00 H new ATOM 0 HB3 GLU B 98 28.109 -4.875 2.963 1.00 0.00 H new ATOM 0 HG2 GLU B 98 26.190 -3.873 3.820 1.00 0.00 H new ATOM 0 HG3 GLU B 98 26.181 -4.864 5.265 1.00 0.00 H new ATOM 2469 N HIS B 99 28.365 -7.682 5.616 1.00 0.00 N ATOM 2470 CA HIS B 99 28.455 -8.407 6.881 1.00 0.00 C ATOM 2471 C HIS B 99 29.384 -7.697 7.862 1.00 0.00 C ATOM 2472 O HIS B 99 29.345 -7.957 9.067 1.00 0.00 O ATOM 2473 CB HIS B 99 28.944 -9.841 6.655 1.00 0.00 C ATOM 2474 CG HIS B 99 28.022 -10.677 5.817 1.00 0.00 C ATOM 2475 ND1 HIS B 99 28.366 -11.159 4.573 1.00 0.00 N ATOM 2476 CD2 HIS B 99 26.765 -11.120 6.055 1.00 0.00 C ATOM 2477 CE1 HIS B 99 27.362 -11.861 4.082 1.00 0.00 C ATOM 2478 NE2 HIS B 99 26.379 -11.851 4.961 1.00 0.00 N ATOM 0 H HIS B 99 29.263 -7.405 5.220 1.00 0.00 H new ATOM 0 HA HIS B 99 27.453 -8.436 7.310 1.00 0.00 H new ATOM 0 HB2 HIS B 99 29.923 -9.809 6.177 1.00 0.00 H new ATOM 0 HB3 HIS B 99 29.077 -10.325 7.623 1.00 0.00 H new ATOM 0 HD2 HIS B 99 26.176 -10.933 6.941 1.00 0.00 H new ATOM 0 HE1 HIS B 99 27.348 -12.359 3.124 1.00 0.00 H new ATOM 0 HE2 HIS B 99 25.477 -12.313 4.846 1.00 0.00 H new ATOM 2487 N HIS B 100 30.216 -6.803 7.349 1.00 0.00 N ATOM 2488 CA HIS B 100 31.165 -6.073 8.177 1.00 0.00 C ATOM 2489 C HIS B 100 31.182 -4.608 7.756 1.00 0.00 C ATOM 2490 O HIS B 100 31.911 -4.223 6.841 1.00 0.00 O ATOM 2491 CB HIS B 100 32.559 -6.694 8.036 1.00 0.00 C ATOM 2492 CG HIS B 100 33.466 -6.439 9.200 1.00 0.00 C ATOM 2493 ND1 HIS B 100 33.475 -7.232 10.323 1.00 0.00 N ATOM 2494 CD2 HIS B 100 34.416 -5.496 9.404 1.00 0.00 C ATOM 2495 CE1 HIS B 100 34.388 -6.793 11.167 1.00 0.00 C ATOM 2496 NE2 HIS B 100 34.978 -5.739 10.635 1.00 0.00 N ATOM 0 H HIS B 100 30.253 -6.565 6.358 1.00 0.00 H new ATOM 0 HA HIS B 100 30.865 -6.134 9.223 1.00 0.00 H new ATOM 0 HB2 HIS B 100 32.453 -7.770 7.902 1.00 0.00 H new ATOM 0 HB3 HIS B 100 33.028 -6.305 7.132 1.00 0.00 H new ATOM 0 HD2 HIS B 100 34.683 -4.700 8.725 1.00 0.00 H new ATOM 0 HE1 HIS B 100 34.615 -7.223 12.131 1.00 0.00 H new ATOM 0 HE2 HIS B 100 35.726 -5.195 11.065 1.00 0.00 H new ATOM 2505 N HIS B 101 30.360 -3.802 8.417 1.00 0.00 N ATOM 2506 CA HIS B 101 30.129 -2.419 8.001 1.00 0.00 C ATOM 2507 C HIS B 101 31.379 -1.562 8.155 1.00 0.00 C ATOM 2508 O HIS B 101 31.934 -1.095 7.161 1.00 0.00 O ATOM 2509 CB HIS B 101 28.987 -1.796 8.807 1.00 0.00 C ATOM 2510 CG HIS B 101 28.427 -0.537 8.203 1.00 0.00 C ATOM 2511 ND1 HIS B 101 29.107 0.662 8.161 1.00 0.00 N ATOM 2512 CD2 HIS B 101 27.229 -0.300 7.625 1.00 0.00 C ATOM 2513 CE1 HIS B 101 28.348 1.577 7.587 1.00 0.00 C ATOM 2514 NE2 HIS B 101 27.200 1.019 7.252 1.00 0.00 N ATOM 0 H HIS B 101 29.839 -4.082 9.248 1.00 0.00 H new ATOM 0 HA HIS B 101 29.860 -2.447 6.945 1.00 0.00 H new ATOM 0 HB2 HIS B 101 28.185 -2.527 8.906 1.00 0.00 H new ATOM 0 HB3 HIS B 101 29.344 -1.576 9.813 1.00 0.00 H new ATOM 0 HD1 HIS B 101 30.050 0.818 8.518 1.00 0.00 H new ATOM 0 HD2 HIS B 101 26.437 -1.020 7.482 1.00 0.00 H new ATOM 0 HE1 HIS B 101 28.621 2.609 7.420 1.00 0.00 H new ATOM 2523 N HIS B 102 31.803 -1.352 9.406 1.00 0.00 N ATOM 2524 CA HIS B 102 32.888 -0.418 9.720 1.00 0.00 C ATOM 2525 C HIS B 102 32.430 1.018 9.455 1.00 0.00 C ATOM 2526 O HIS B 102 31.744 1.292 8.473 1.00 0.00 O ATOM 2527 CB HIS B 102 34.160 -0.758 8.917 1.00 0.00 C ATOM 2528 CG HIS B 102 35.236 0.286 8.981 1.00 0.00 C ATOM 2529 ND1 HIS B 102 35.491 1.156 7.946 1.00 0.00 N ATOM 2530 CD2 HIS B 102 36.121 0.595 9.957 1.00 0.00 C ATOM 2531 CE1 HIS B 102 36.487 1.951 8.278 1.00 0.00 C ATOM 2532 NE2 HIS B 102 36.886 1.635 9.494 1.00 0.00 N ATOM 0 H HIS B 102 31.408 -1.820 10.222 1.00 0.00 H new ATOM 0 HA HIS B 102 33.138 -0.512 10.777 1.00 0.00 H new ATOM 0 HB2 HIS B 102 34.565 -1.701 9.284 1.00 0.00 H new ATOM 0 HB3 HIS B 102 33.885 -0.914 7.874 1.00 0.00 H new ATOM 0 HD2 HIS B 102 36.208 0.113 10.920 1.00 0.00 H new ATOM 0 HE1 HIS B 102 36.906 2.730 7.659 1.00 0.00 H new ATOM 0 HE2 HIS B 102 37.641 2.090 10.007 1.00 0.00 H new ATOM 2541 N HIS B 103 32.782 1.929 10.341 1.00 0.00 N ATOM 2542 CA HIS B 103 32.345 3.310 10.205 1.00 0.00 C ATOM 2543 C HIS B 103 33.256 4.077 9.263 1.00 0.00 C ATOM 2544 O HIS B 103 34.398 4.392 9.599 1.00 0.00 O ATOM 2545 CB HIS B 103 32.287 3.998 11.569 1.00 0.00 C ATOM 2546 CG HIS B 103 31.272 3.396 12.487 1.00 0.00 C ATOM 2547 ND1 HIS B 103 31.584 2.442 13.430 1.00 0.00 N ATOM 2548 CD2 HIS B 103 29.938 3.603 12.592 1.00 0.00 C ATOM 2549 CE1 HIS B 103 30.487 2.086 14.072 1.00 0.00 C ATOM 2550 NE2 HIS B 103 29.476 2.778 13.583 1.00 0.00 N ATOM 0 H HIS B 103 33.365 1.743 11.157 1.00 0.00 H new ATOM 0 HA HIS B 103 31.341 3.303 9.780 1.00 0.00 H new ATOM 0 HB2 HIS B 103 33.269 3.945 12.038 1.00 0.00 H new ATOM 0 HB3 HIS B 103 32.059 5.054 11.427 1.00 0.00 H new ATOM 0 HD2 HIS B 103 29.348 4.291 12.004 1.00 0.00 H new ATOM 0 HE1 HIS B 103 30.427 1.353 14.863 1.00 0.00 H new ATOM 0 HE2 HIS B 103 28.507 2.710 13.893 1.00 0.00 H new ATOM 2559 N HIS B 104 32.751 4.346 8.072 1.00 0.00 N ATOM 2560 CA HIS B 104 33.472 5.133 7.092 1.00 0.00 C ATOM 2561 C HIS B 104 32.500 6.060 6.385 1.00 0.00 C ATOM 2562 O HIS B 104 31.661 5.562 5.604 1.00 0.00 O ATOM 2563 CB HIS B 104 34.174 4.236 6.073 1.00 0.00 C ATOM 2564 CG HIS B 104 35.171 4.955 5.212 1.00 0.00 C ATOM 2565 ND1 HIS B 104 35.226 6.331 5.090 1.00 0.00 N ATOM 2566 CD2 HIS B 104 36.173 4.475 4.442 1.00 0.00 C ATOM 2567 CE1 HIS B 104 36.218 6.658 4.283 1.00 0.00 C ATOM 2568 NE2 HIS B 104 36.809 5.552 3.878 1.00 0.00 N ATOM 2569 OXT HIS B 104 32.568 7.277 6.616 1.00 0.00 O ATOM 0 H HIS B 104 31.834 4.026 7.760 1.00 0.00 H new ATOM 0 HA HIS B 104 34.236 5.717 7.605 1.00 0.00 H new ATOM 0 HB2 HIS B 104 34.681 3.430 6.603 1.00 0.00 H new ATOM 0 HB3 HIS B 104 33.423 3.774 5.433 1.00 0.00 H new ATOM 0 HD2 HIS B 104 36.426 3.435 4.297 1.00 0.00 H new ATOM 0 HE1 HIS B 104 36.498 7.663 4.002 1.00 0.00 H new ATOM 0 HE2 HIS B 104 37.609 5.504 3.248 1.00 0.00 H new TER 2578 HIS B 104