USER MOD reduce.3.24.130724 H: found=0, std=0, add=834, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 832 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 67 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 115 LYS NZ :NH3+ 149:sc= -0.19 (180deg=-1.79!) USER MOD Set 2.1: A 55 THR OG1 : rot -159:sc= -6.78! USER MOD Set 2.2: A 57 GLN : amide:sc= -0.486 K(o=-7.3,f=-11!) USER MOD Set 3.1: A 5 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 14 HIS : no HD1:sc= -10.4! C(o=-10!,f=-14!) USER MOD Single : A 1 VAL N :NH3+ -157:sc= -0.291 (180deg=-1.62!) USER MOD Single : A 2 LYS NZ :NH3+ 145:sc= -0.0269 (180deg=-0.659) USER MOD Single : A 4 GLN : amide:sc= -0.309 K(o=-0.31,f=-2.8!) USER MOD Single : A 8 SER OG : rot 180:sc= 0.175 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 ASN : amide:sc= -0.0152 K(o=-0.015,f=-0.97) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot -89:sc= -0.164 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot -140:sc= 0 USER MOD Single : A 28 THR OG1 : rot -73:sc= 0.132 USER MOD Single : A 29 TYR OH : rot 180:sc= -1.76! USER MOD Single : A 30 SER OG : rot 180:sc= -0.0343 USER MOD Single : A 32 ASN : amide:sc= -0.0927 X(o=-0.093,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 60:sc= -6.64! USER MOD Single : A 40 ASN : amide:sc= -0.252 K(o=-0.25,f=-3!) USER MOD Single : A 41 SER OG : rot 63:sc= 0.353 USER MOD Single : A 46 SER OG : rot 55:sc= 0.267 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -138:sc= 0 (180deg=-0.0802) USER MOD Single : A 63 HIS : no HE2:sc= -5.98 K(o=-6,f=-11!) USER MOD Single : A 65 THR OG1 : rot 180:sc=-0.00253 USER MOD Single : A 68 ASN : amide:sc= -0.357 X(o=-0.36,f=0) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc=-0.00119 USER MOD Single : A 73 SER OG : rot 180:sc= -0.172 USER MOD Single : A 76 LYS NZ :NH3+ -115:sc=-0.00389 (180deg=-0.115) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot -3:sc= -2.9! USER MOD Single : A 80 SER OG : rot 51:sc= 0.175 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -0.975 K(o=-0.98,f=-1.9!) USER MOD Single : A 84 ASN : amide:sc= -0.424! C(o=-0.42!,f=-7.7!) USER MOD Single : A 88 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.139) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 180:sc= -0.0135 USER MOD Single : A 98 SER OG : rot 110:sc= -1.89! USER MOD Single : A 99 SER OG : rot 180:sc= 0.00429 USER MOD Single : A 100 SER OG : rot -1:sc= 0.786 USER MOD Single : A 101 SER OG : rot 104:sc= -0.0347! USER MOD Single : A 102 THR OG1 : rot -44:sc= -1.3! USER MOD Single : A 104 SER OG : rot -60:sc= -1.46! USER MOD Single : A 107 ASN : amide:sc= -2.63! C(o=-2.6!,f=-3.5!) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.46 USER MOD Single : A 110 LYS NZ :NH3+ 166:sc= 1.28 (180deg=1.18) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 0.255 -14.426 -24.671 1.00 0.00 N ATOM 2 CA VAL A 1 0.042 -14.438 -23.196 1.00 0.00 C ATOM 3 C VAL A 1 1.379 -14.597 -22.470 1.00 0.00 C ATOM 4 O VAL A 1 1.816 -15.694 -22.182 1.00 0.00 O ATOM 5 CB VAL A 1 -0.859 -15.643 -22.934 1.00 0.00 C ATOM 6 CG1 VAL A 1 -1.242 -15.677 -21.454 1.00 0.00 C ATOM 7 CG2 VAL A 1 -2.125 -15.525 -23.786 1.00 0.00 C ATOM 0 H1 VAL A 1 -0.543 -13.945 -25.133 1.00 0.00 H new ATOM 0 H2 VAL A 1 1.137 -13.921 -24.890 1.00 0.00 H new ATOM 0 H3 VAL A 1 0.319 -15.403 -25.020 1.00 0.00 H new ATOM 0 HA VAL A 1 -0.405 -13.511 -22.836 1.00 0.00 H new ATOM 0 HB VAL A 1 -0.329 -16.559 -23.194 1.00 0.00 H new ATOM 0 HG11 VAL A 1 -1.885 -16.536 -21.264 1.00 0.00 H new ATOM 0 HG12 VAL A 1 -0.340 -15.757 -20.847 1.00 0.00 H new ATOM 0 HG13 VAL A 1 -1.774 -14.762 -21.195 1.00 0.00 H new ATOM 0 HG21 VAL A 1 -2.770 -16.384 -23.601 1.00 0.00 H new ATOM 0 HG22 VAL A 1 -2.656 -14.610 -23.524 1.00 0.00 H new ATOM 0 HG23 VAL A 1 -1.852 -15.497 -24.841 1.00 0.00 H new ATOM 19 N LYS A 2 2.032 -13.509 -22.173 1.00 0.00 N ATOM 20 CA LYS A 2 3.341 -13.592 -21.465 1.00 0.00 C ATOM 21 C LYS A 2 3.314 -12.720 -20.208 1.00 0.00 C ATOM 22 O LYS A 2 2.687 -11.681 -20.171 1.00 0.00 O ATOM 23 CB LYS A 2 4.369 -13.063 -22.466 1.00 0.00 C ATOM 24 CG LYS A 2 4.143 -11.567 -22.698 1.00 0.00 C ATOM 25 CD LYS A 2 5.376 -10.967 -23.375 1.00 0.00 C ATOM 26 CE LYS A 2 4.963 -10.286 -24.683 1.00 0.00 C ATOM 27 NZ LYS A 2 4.044 -9.182 -24.280 1.00 0.00 N ATOM 0 H LYS A 2 1.716 -12.564 -22.390 1.00 0.00 H new ATOM 0 HA LYS A 2 3.575 -14.607 -21.143 1.00 0.00 H new ATOM 0 HB2 LYS A 2 5.378 -13.234 -22.090 1.00 0.00 H new ATOM 0 HB3 LYS A 2 4.284 -13.604 -23.409 1.00 0.00 H new ATOM 0 HG2 LYS A 2 3.262 -11.413 -23.320 1.00 0.00 H new ATOM 0 HG3 LYS A 2 3.955 -11.065 -21.749 1.00 0.00 H new ATOM 0 HD2 LYS A 2 5.852 -10.245 -22.712 1.00 0.00 H new ATOM 0 HD3 LYS A 2 6.110 -11.748 -23.576 1.00 0.00 H new ATOM 0 HE2 LYS A 2 5.832 -9.900 -25.216 1.00 0.00 H new ATOM 0 HE3 LYS A 2 4.465 -10.988 -25.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 4.180 -8.369 -24.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 3.059 -9.510 -24.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 4.252 -8.897 -23.302 1.00 0.00 H new ATOM 41 N CYS A 3 3.986 -13.145 -19.179 1.00 0.00 N ATOM 42 CA CYS A 3 4.007 -12.363 -17.915 1.00 0.00 C ATOM 43 C CYS A 3 4.791 -11.063 -18.089 1.00 0.00 C ATOM 44 O CYS A 3 5.637 -10.940 -18.951 1.00 0.00 O ATOM 45 CB CYS A 3 4.714 -13.277 -16.921 1.00 0.00 C ATOM 46 SG CYS A 3 3.490 -14.297 -16.070 1.00 0.00 S ATOM 0 H CYS A 3 4.527 -14.009 -19.159 1.00 0.00 H new ATOM 0 HA CYS A 3 3.006 -12.077 -17.591 1.00 0.00 H new ATOM 0 HB2 CYS A 3 5.434 -13.910 -17.440 1.00 0.00 H new ATOM 0 HB3 CYS A 3 5.274 -12.683 -16.199 1.00 0.00 H new ATOM 51 N GLN A 4 4.519 -10.095 -17.263 1.00 0.00 N ATOM 52 CA GLN A 4 5.249 -8.803 -17.356 1.00 0.00 C ATOM 53 C GLN A 4 5.816 -8.452 -15.980 1.00 0.00 C ATOM 54 O GLN A 4 5.463 -9.058 -14.987 1.00 0.00 O ATOM 55 CB GLN A 4 4.200 -7.777 -17.786 1.00 0.00 C ATOM 56 CG GLN A 4 3.466 -8.280 -19.033 1.00 0.00 C ATOM 57 CD GLN A 4 1.981 -7.916 -18.934 1.00 0.00 C ATOM 58 OE1 GLN A 4 1.576 -7.211 -18.032 1.00 0.00 O ATOM 59 NE2 GLN A 4 1.147 -8.371 -19.830 1.00 0.00 N ATOM 0 H GLN A 4 3.818 -10.143 -16.523 1.00 0.00 H new ATOM 0 HA GLN A 4 6.081 -8.836 -18.059 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.489 -7.609 -16.977 1.00 0.00 H new ATOM 0 HB3 GLN A 4 4.678 -6.820 -17.995 1.00 0.00 H new ATOM 0 HG2 GLN A 4 3.901 -7.836 -19.928 1.00 0.00 H new ATOM 0 HG3 GLN A 4 3.581 -9.360 -19.125 1.00 0.00 H new ATOM 0 HE21 GLN A 4 1.486 -8.963 -20.588 1.00 0.00 H new ATOM 0 HE22 GLN A 4 0.157 -8.134 -19.772 1.00 0.00 H new ATOM 68 N SER A 5 6.687 -7.487 -15.900 1.00 0.00 N ATOM 69 CA SER A 5 7.255 -7.127 -14.571 1.00 0.00 C ATOM 70 C SER A 5 6.124 -7.042 -13.540 1.00 0.00 C ATOM 71 O SER A 5 5.060 -6.529 -13.826 1.00 0.00 O ATOM 72 CB SER A 5 7.932 -5.771 -14.773 1.00 0.00 C ATOM 73 OG SER A 5 6.982 -4.733 -14.566 1.00 0.00 O ATOM 0 H SER A 5 7.028 -6.936 -16.688 1.00 0.00 H new ATOM 0 HA SER A 5 7.967 -7.865 -14.201 1.00 0.00 H new ATOM 0 HB2 SER A 5 8.765 -5.661 -14.078 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.346 -5.705 -15.779 1.00 0.00 H new ATOM 0 HG SER A 5 7.415 -3.863 -14.694 1.00 0.00 H new ATOM 79 N PRO A 6 6.388 -7.580 -12.381 1.00 0.00 N ATOM 80 CA PRO A 6 5.374 -7.604 -11.292 1.00 0.00 C ATOM 81 C PRO A 6 5.117 -6.206 -10.724 1.00 0.00 C ATOM 82 O PRO A 6 5.921 -5.312 -10.875 1.00 0.00 O ATOM 83 CB PRO A 6 6.018 -8.495 -10.234 1.00 0.00 C ATOM 84 CG PRO A 6 7.485 -8.386 -10.484 1.00 0.00 C ATOM 85 CD PRO A 6 7.647 -8.213 -11.971 1.00 0.00 C ATOM 0 HA PRO A 6 4.404 -7.962 -11.637 1.00 0.00 H new ATOM 0 HB2 PRO A 6 5.763 -8.162 -9.228 1.00 0.00 H new ATOM 0 HB3 PRO A 6 5.677 -9.526 -10.325 1.00 0.00 H new ATOM 0 HG2 PRO A 6 7.910 -7.539 -9.945 1.00 0.00 H new ATOM 0 HG3 PRO A 6 8.006 -9.278 -10.137 1.00 0.00 H new ATOM 0 HD2 PRO A 6 8.507 -7.588 -12.211 1.00 0.00 H new ATOM 0 HD3 PRO A 6 7.798 -9.169 -12.472 1.00 0.00 H new ATOM 93 N PRO A 7 3.995 -6.080 -10.067 1.00 0.00 N ATOM 94 CA PRO A 7 3.615 -4.792 -9.438 1.00 0.00 C ATOM 95 C PRO A 7 4.427 -4.574 -8.159 1.00 0.00 C ATOM 96 O PRO A 7 5.204 -5.415 -7.754 1.00 0.00 O ATOM 97 CB PRO A 7 2.136 -4.976 -9.111 1.00 0.00 C ATOM 98 CG PRO A 7 1.946 -6.455 -8.983 1.00 0.00 C ATOM 99 CD PRO A 7 2.980 -7.118 -9.858 1.00 0.00 C ATOM 0 HA PRO A 7 3.801 -3.928 -10.076 1.00 0.00 H new ATOM 0 HB2 PRO A 7 1.870 -4.463 -8.187 1.00 0.00 H new ATOM 0 HB3 PRO A 7 1.504 -4.564 -9.898 1.00 0.00 H new ATOM 0 HG2 PRO A 7 2.062 -6.769 -7.946 1.00 0.00 H new ATOM 0 HG3 PRO A 7 0.941 -6.741 -9.292 1.00 0.00 H new ATOM 0 HD2 PRO A 7 3.404 -7.998 -9.375 1.00 0.00 H new ATOM 0 HD3 PRO A 7 2.549 -7.449 -10.803 1.00 0.00 H new ATOM 107 N SER A 8 4.252 -3.452 -7.519 1.00 0.00 N ATOM 108 CA SER A 8 5.014 -3.183 -6.262 1.00 0.00 C ATOM 109 C SER A 8 4.418 -3.978 -5.099 1.00 0.00 C ATOM 110 O SER A 8 3.426 -4.666 -5.246 1.00 0.00 O ATOM 111 CB SER A 8 4.868 -1.682 -6.009 1.00 0.00 C ATOM 112 OG SER A 8 4.109 -1.091 -7.056 1.00 0.00 O ATOM 0 H SER A 8 3.616 -2.709 -7.809 1.00 0.00 H new ATOM 0 HA SER A 8 6.059 -3.479 -6.351 1.00 0.00 H new ATOM 0 HB2 SER A 8 4.378 -1.511 -5.050 1.00 0.00 H new ATOM 0 HB3 SER A 8 5.852 -1.216 -5.952 1.00 0.00 H new ATOM 0 HG SER A 8 4.016 -0.130 -6.890 1.00 0.00 H new ATOM 118 N ILE A 9 5.014 -3.887 -3.942 1.00 0.00 N ATOM 119 CA ILE A 9 4.479 -4.638 -2.767 1.00 0.00 C ATOM 120 C ILE A 9 4.638 -3.850 -1.481 1.00 0.00 C ATOM 121 O ILE A 9 4.967 -2.680 -1.475 1.00 0.00 O ATOM 122 CB ILE A 9 5.274 -5.940 -2.657 1.00 0.00 C ATOM 123 CG1 ILE A 9 6.710 -5.767 -3.176 1.00 0.00 C ATOM 124 CG2 ILE A 9 4.557 -7.018 -3.452 1.00 0.00 C ATOM 125 CD1 ILE A 9 7.689 -6.204 -2.083 1.00 0.00 C ATOM 0 H ILE A 9 5.846 -3.327 -3.758 1.00 0.00 H new ATOM 0 HA ILE A 9 3.415 -4.823 -2.911 1.00 0.00 H new ATOM 0 HB ILE A 9 5.338 -6.226 -1.607 1.00 0.00 H new ATOM 0 HG12 ILE A 9 6.860 -6.363 -4.076 1.00 0.00 H new ATOM 0 HG13 ILE A 9 6.889 -4.727 -3.449 1.00 0.00 H new ATOM 0 HG21 ILE A 9 5.114 -7.953 -3.382 1.00 0.00 H new ATOM 0 HG22 ILE A 9 3.555 -7.162 -3.049 1.00 0.00 H new ATOM 0 HG23 ILE A 9 4.488 -6.714 -4.497 1.00 0.00 H new ATOM 0 HD11 ILE A 9 8.711 -6.085 -2.442 1.00 0.00 H new ATOM 0 HD12 ILE A 9 7.542 -5.589 -1.195 1.00 0.00 H new ATOM 0 HD13 ILE A 9 7.512 -7.250 -1.833 1.00 0.00 H new ATOM 137 N SER A 10 4.386 -4.504 -0.391 1.00 0.00 N ATOM 138 CA SER A 10 4.492 -3.839 0.927 1.00 0.00 C ATOM 139 C SER A 10 5.760 -2.983 1.004 1.00 0.00 C ATOM 140 O SER A 10 6.818 -3.459 1.365 1.00 0.00 O ATOM 141 CB SER A 10 4.546 -4.976 1.946 1.00 0.00 C ATOM 142 OG SER A 10 3.567 -4.754 2.953 1.00 0.00 O ATOM 0 H SER A 10 4.107 -5.485 -0.357 1.00 0.00 H new ATOM 0 HA SER A 10 3.654 -3.167 1.110 1.00 0.00 H new ATOM 0 HB2 SER A 10 4.366 -5.931 1.452 1.00 0.00 H new ATOM 0 HB3 SER A 10 5.538 -5.031 2.394 1.00 0.00 H new ATOM 0 HG SER A 10 3.599 -5.483 3.607 1.00 0.00 H new ATOM 148 N ASN A 11 5.657 -1.723 0.676 1.00 0.00 N ATOM 149 CA ASN A 11 6.853 -0.830 0.735 1.00 0.00 C ATOM 150 C ASN A 11 8.096 -1.562 0.220 1.00 0.00 C ATOM 151 O ASN A 11 9.119 -1.603 0.874 1.00 0.00 O ATOM 152 CB ASN A 11 7.012 -0.480 2.215 1.00 0.00 C ATOM 153 CG ASN A 11 6.246 0.808 2.520 1.00 0.00 C ATOM 154 OD1 ASN A 11 6.840 1.842 2.748 1.00 0.00 O ATOM 155 ND2 ASN A 11 4.940 0.789 2.533 1.00 0.00 N ATOM 0 H ASN A 11 4.795 -1.272 0.369 1.00 0.00 H new ATOM 0 HA ASN A 11 6.733 0.058 0.114 1.00 0.00 H new ATOM 0 HB2 ASN A 11 6.636 -1.294 2.835 1.00 0.00 H new ATOM 0 HB3 ASN A 11 8.067 -0.355 2.459 1.00 0.00 H new ATOM 0 HD21 ASN A 11 4.420 1.643 2.735 1.00 0.00 H new ATOM 0 HD22 ASN A 11 4.441 -0.080 2.341 1.00 0.00 H new ATOM 162 N GLY A 12 8.015 -2.137 -0.947 1.00 0.00 N ATOM 163 CA GLY A 12 9.192 -2.861 -1.504 1.00 0.00 C ATOM 164 C GLY A 12 9.172 -2.763 -3.031 1.00 0.00 C ATOM 165 O GLY A 12 8.208 -2.314 -3.619 1.00 0.00 O ATOM 0 H GLY A 12 7.185 -2.137 -1.540 1.00 0.00 H new ATOM 0 HA2 GLY A 12 10.115 -2.433 -1.113 1.00 0.00 H new ATOM 0 HA3 GLY A 12 9.170 -3.906 -1.195 1.00 0.00 H new ATOM 169 N ARG A 13 10.227 -3.177 -3.680 1.00 0.00 N ATOM 170 CA ARG A 13 10.260 -3.101 -5.170 1.00 0.00 C ATOM 171 C ARG A 13 10.332 -4.495 -5.781 1.00 0.00 C ATOM 172 O ARG A 13 10.139 -5.494 -5.119 1.00 0.00 O ATOM 173 CB ARG A 13 11.519 -2.302 -5.509 1.00 0.00 C ATOM 174 CG ARG A 13 11.120 -0.887 -5.931 1.00 0.00 C ATOM 175 CD ARG A 13 12.146 0.119 -5.405 1.00 0.00 C ATOM 176 NE ARG A 13 12.031 1.292 -6.315 1.00 0.00 N ATOM 177 CZ ARG A 13 12.074 2.503 -5.829 1.00 0.00 C ATOM 178 NH1 ARG A 13 12.701 2.735 -4.709 1.00 0.00 N ATOM 179 NH2 ARG A 13 11.491 3.483 -6.464 1.00 0.00 N ATOM 0 H ARG A 13 11.065 -3.563 -3.245 1.00 0.00 H new ATOM 0 HA ARG A 13 9.361 -2.631 -5.568 1.00 0.00 H new ATOM 0 HB2 ARG A 13 12.183 -2.263 -4.645 1.00 0.00 H new ATOM 0 HB3 ARG A 13 12.070 -2.792 -6.312 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.060 -0.825 -7.018 1.00 0.00 H new ATOM 0 HG3 ARG A 13 10.130 -0.647 -5.543 1.00 0.00 H new ATOM 0 HD2 ARG A 13 11.934 0.397 -4.373 1.00 0.00 H new ATOM 0 HD3 ARG A 13 13.153 -0.298 -5.422 1.00 0.00 H new ATOM 0 HE ARG A 13 11.919 1.149 -7.319 1.00 0.00 H new ATOM 0 HH11 ARG A 13 13.158 1.970 -4.212 1.00 0.00 H new ATOM 0 HH12 ARG A 13 12.734 3.681 -4.330 1.00 0.00 H new ATOM 0 HH21 ARG A 13 11.001 3.303 -7.341 1.00 0.00 H new ATOM 0 HH22 ARG A 13 11.525 4.429 -6.084 1.00 0.00 H new ATOM 193 N HIS A 14 10.596 -4.555 -7.048 1.00 0.00 N ATOM 194 CA HIS A 14 10.674 -5.874 -7.740 1.00 0.00 C ATOM 195 C HIS A 14 11.532 -5.767 -9.005 1.00 0.00 C ATOM 196 O HIS A 14 11.307 -4.925 -9.852 1.00 0.00 O ATOM 197 CB HIS A 14 9.228 -6.213 -8.095 1.00 0.00 C ATOM 198 CG HIS A 14 8.775 -5.365 -9.250 1.00 0.00 C ATOM 199 ND1 HIS A 14 8.904 -5.786 -10.561 1.00 0.00 N ATOM 200 CD2 HIS A 14 8.160 -4.139 -9.308 1.00 0.00 C ATOM 201 CE1 HIS A 14 8.372 -4.839 -11.347 1.00 0.00 C ATOM 202 NE2 HIS A 14 7.906 -3.808 -10.636 1.00 0.00 N ATOM 0 H HIS A 14 10.763 -3.744 -7.644 1.00 0.00 H new ATOM 0 HA HIS A 14 11.134 -6.641 -7.117 1.00 0.00 H new ATOM 0 HB2 HIS A 14 9.145 -7.269 -8.353 1.00 0.00 H new ATOM 0 HB3 HIS A 14 8.583 -6.044 -7.233 1.00 0.00 H new ATOM 0 HD2 HIS A 14 7.911 -3.526 -8.455 1.00 0.00 H new ATOM 0 HE1 HIS A 14 8.326 -4.902 -12.424 1.00 0.00 H new ATOM 0 HE2 HIS A 14 7.460 -2.961 -10.990 1.00 0.00 H new ATOM 210 N ASN A 15 12.514 -6.617 -9.139 1.00 0.00 N ATOM 211 CA ASN A 15 13.385 -6.567 -10.348 1.00 0.00 C ATOM 212 C ASN A 15 13.387 -7.930 -11.047 1.00 0.00 C ATOM 213 O ASN A 15 13.320 -8.018 -12.257 1.00 0.00 O ATOM 214 CB ASN A 15 14.780 -6.232 -9.818 1.00 0.00 C ATOM 215 CG ASN A 15 15.686 -5.829 -10.983 1.00 0.00 C ATOM 216 OD1 ASN A 15 15.260 -5.144 -11.892 1.00 0.00 O ATOM 217 ND2 ASN A 15 16.929 -6.226 -10.993 1.00 0.00 N ATOM 0 H ASN A 15 12.751 -7.344 -8.464 1.00 0.00 H new ATOM 0 HA ASN A 15 13.042 -5.834 -11.078 1.00 0.00 H new ATOM 0 HB2 ASN A 15 14.720 -5.420 -9.093 1.00 0.00 H new ATOM 0 HB3 ASN A 15 15.200 -7.093 -9.298 1.00 0.00 H new ATOM 0 HD21 ASN A 15 17.543 -5.961 -11.764 1.00 0.00 H new ATOM 0 HD22 ASN A 15 17.287 -6.801 -10.230 1.00 0.00 H new ATOM 224 N GLY A 16 13.460 -8.993 -10.294 1.00 0.00 N ATOM 225 CA GLY A 16 13.462 -10.348 -10.913 1.00 0.00 C ATOM 226 C GLY A 16 14.756 -10.550 -11.703 1.00 0.00 C ATOM 227 O GLY A 16 15.802 -10.813 -11.145 1.00 0.00 O ATOM 0 H GLY A 16 13.518 -8.981 -9.276 1.00 0.00 H new ATOM 0 HA2 GLY A 16 13.373 -11.112 -10.140 1.00 0.00 H new ATOM 0 HA3 GLY A 16 12.601 -10.459 -11.572 1.00 0.00 H new ATOM 231 N TYR A 17 14.692 -10.431 -13.001 1.00 0.00 N ATOM 232 CA TYR A 17 15.918 -10.617 -13.829 1.00 0.00 C ATOM 233 C TYR A 17 15.629 -10.251 -15.287 1.00 0.00 C ATOM 234 O TYR A 17 16.226 -10.785 -16.200 1.00 0.00 O ATOM 235 CB TYR A 17 16.256 -12.103 -13.708 1.00 0.00 C ATOM 236 CG TYR A 17 17.578 -12.263 -12.996 1.00 0.00 C ATOM 237 CD1 TYR A 17 18.677 -11.481 -13.373 1.00 0.00 C ATOM 238 CD2 TYR A 17 17.704 -13.194 -11.957 1.00 0.00 C ATOM 239 CE1 TYR A 17 19.902 -11.631 -12.711 1.00 0.00 C ATOM 240 CE2 TYR A 17 18.929 -13.344 -11.296 1.00 0.00 C ATOM 241 CZ TYR A 17 20.028 -12.562 -11.673 1.00 0.00 C ATOM 242 OH TYR A 17 21.236 -12.708 -11.022 1.00 0.00 O ATOM 0 H TYR A 17 13.844 -10.213 -13.524 1.00 0.00 H new ATOM 0 HA TYR A 17 16.741 -9.983 -13.498 1.00 0.00 H new ATOM 0 HB2 TYR A 17 15.470 -12.622 -13.159 1.00 0.00 H new ATOM 0 HB3 TYR A 17 16.307 -12.557 -14.698 1.00 0.00 H new ATOM 0 HD1 TYR A 17 18.580 -10.763 -14.174 1.00 0.00 H new ATOM 0 HD2 TYR A 17 16.856 -13.796 -11.666 1.00 0.00 H new ATOM 0 HE1 TYR A 17 20.750 -11.028 -13.001 1.00 0.00 H new ATOM 0 HE2 TYR A 17 19.026 -14.063 -10.496 1.00 0.00 H new ATOM 0 HH TYR A 17 21.152 -13.394 -10.327 1.00 0.00 H new ATOM 252 N GLU A 18 14.714 -9.349 -15.512 1.00 0.00 N ATOM 253 CA GLU A 18 14.386 -8.957 -16.911 1.00 0.00 C ATOM 254 C GLU A 18 13.318 -7.858 -16.905 1.00 0.00 C ATOM 255 O GLU A 18 13.276 -7.030 -16.017 1.00 0.00 O ATOM 256 CB GLU A 18 13.856 -10.239 -17.555 1.00 0.00 C ATOM 257 CG GLU A 18 12.683 -10.775 -16.731 1.00 0.00 C ATOM 258 CD GLU A 18 12.219 -12.112 -17.312 1.00 0.00 C ATOM 259 OE1 GLU A 18 12.853 -13.113 -17.021 1.00 0.00 O ATOM 260 OE2 GLU A 18 11.238 -12.112 -18.038 1.00 0.00 O ATOM 0 H GLU A 18 14.180 -8.867 -14.789 1.00 0.00 H new ATOM 0 HA GLU A 18 15.242 -8.557 -17.454 1.00 0.00 H new ATOM 0 HB2 GLU A 18 13.535 -10.040 -18.577 1.00 0.00 H new ATOM 0 HB3 GLU A 18 14.648 -10.986 -17.609 1.00 0.00 H new ATOM 0 HG2 GLU A 18 12.984 -10.903 -15.691 1.00 0.00 H new ATOM 0 HG3 GLU A 18 11.862 -10.058 -16.739 1.00 0.00 H new ATOM 267 N ASP A 19 12.452 -7.842 -17.881 1.00 0.00 N ATOM 268 CA ASP A 19 11.392 -6.796 -17.915 1.00 0.00 C ATOM 269 C ASP A 19 10.016 -7.451 -18.062 1.00 0.00 C ATOM 270 O ASP A 19 9.068 -7.080 -17.399 1.00 0.00 O ATOM 271 CB ASP A 19 11.722 -5.937 -19.137 1.00 0.00 C ATOM 272 CG ASP A 19 10.520 -5.058 -19.487 1.00 0.00 C ATOM 273 OD1 ASP A 19 10.444 -3.959 -18.964 1.00 0.00 O ATOM 274 OD2 ASP A 19 9.698 -5.499 -20.273 1.00 0.00 O ATOM 0 H ASP A 19 12.433 -8.507 -18.655 1.00 0.00 H new ATOM 0 HA ASP A 19 11.362 -6.201 -17.002 1.00 0.00 H new ATOM 0 HB2 ASP A 19 12.593 -5.314 -18.932 1.00 0.00 H new ATOM 0 HB3 ASP A 19 11.978 -6.574 -19.983 1.00 0.00 H new ATOM 279 N PHE A 20 9.903 -8.431 -18.916 1.00 0.00 N ATOM 280 CA PHE A 20 8.591 -9.119 -19.093 1.00 0.00 C ATOM 281 C PHE A 20 8.780 -10.632 -18.963 1.00 0.00 C ATOM 282 O PHE A 20 9.499 -11.246 -19.726 1.00 0.00 O ATOM 283 CB PHE A 20 8.125 -8.749 -20.502 1.00 0.00 C ATOM 284 CG PHE A 20 8.993 -9.443 -21.520 1.00 0.00 C ATOM 285 CD1 PHE A 20 10.262 -8.935 -21.819 1.00 0.00 C ATOM 286 CD2 PHE A 20 8.528 -10.593 -22.171 1.00 0.00 C ATOM 287 CE1 PHE A 20 11.067 -9.576 -22.767 1.00 0.00 C ATOM 288 CE2 PHE A 20 9.332 -11.234 -23.120 1.00 0.00 C ATOM 289 CZ PHE A 20 10.602 -10.725 -23.418 1.00 0.00 C ATOM 0 H PHE A 20 10.661 -8.786 -19.499 1.00 0.00 H new ATOM 0 HA PHE A 20 7.860 -8.820 -18.342 1.00 0.00 H new ATOM 0 HB2 PHE A 20 7.083 -9.039 -20.639 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.176 -7.669 -20.641 1.00 0.00 H new ATOM 0 HD1 PHE A 20 10.620 -8.048 -21.318 1.00 0.00 H new ATOM 0 HD2 PHE A 20 7.548 -10.985 -21.940 1.00 0.00 H new ATOM 0 HE1 PHE A 20 12.047 -9.184 -22.997 1.00 0.00 H new ATOM 0 HE2 PHE A 20 8.973 -12.120 -23.622 1.00 0.00 H new ATOM 0 HZ PHE A 20 11.223 -11.219 -24.150 1.00 0.00 H new ATOM 299 N TYR A 21 8.149 -11.235 -17.995 1.00 0.00 N ATOM 300 CA TYR A 21 8.300 -12.706 -17.805 1.00 0.00 C ATOM 301 C TYR A 21 7.355 -13.471 -18.747 1.00 0.00 C ATOM 302 O TYR A 21 6.700 -12.886 -19.585 1.00 0.00 O ATOM 303 CB TYR A 21 7.956 -12.932 -16.336 1.00 0.00 C ATOM 304 CG TYR A 21 9.213 -12.742 -15.525 1.00 0.00 C ATOM 305 CD1 TYR A 21 10.224 -13.704 -15.588 1.00 0.00 C ATOM 306 CD2 TYR A 21 9.369 -11.614 -14.713 1.00 0.00 C ATOM 307 CE1 TYR A 21 11.394 -13.544 -14.839 1.00 0.00 C ATOM 308 CE2 TYR A 21 10.540 -11.452 -13.963 1.00 0.00 C ATOM 309 CZ TYR A 21 11.552 -12.417 -14.024 1.00 0.00 C ATOM 310 OH TYR A 21 12.706 -12.257 -13.283 1.00 0.00 O ATOM 0 H TYR A 21 7.534 -10.773 -17.326 1.00 0.00 H new ATOM 0 HA TYR A 21 9.300 -13.069 -18.042 1.00 0.00 H new ATOM 0 HB2 TYR A 21 7.186 -12.232 -16.014 1.00 0.00 H new ATOM 0 HB3 TYR A 21 7.556 -13.935 -16.189 1.00 0.00 H new ATOM 0 HD1 TYR A 21 10.102 -14.574 -16.217 1.00 0.00 H new ATOM 0 HD2 TYR A 21 8.588 -10.870 -14.665 1.00 0.00 H new ATOM 0 HE1 TYR A 21 12.174 -14.289 -14.889 1.00 0.00 H new ATOM 0 HE2 TYR A 21 10.663 -10.581 -13.336 1.00 0.00 H new ATOM 0 HH TYR A 21 12.597 -12.689 -12.410 1.00 0.00 H new ATOM 320 N THR A 22 7.291 -14.773 -18.638 1.00 0.00 N ATOM 321 CA THR A 22 6.398 -15.549 -19.556 1.00 0.00 C ATOM 322 C THR A 22 5.557 -16.566 -18.777 1.00 0.00 C ATOM 323 O THR A 22 4.347 -16.599 -18.881 1.00 0.00 O ATOM 324 CB THR A 22 7.345 -16.269 -20.521 1.00 0.00 C ATOM 325 OG1 THR A 22 8.647 -15.707 -20.416 1.00 0.00 O ATOM 326 CG2 THR A 22 6.834 -16.110 -21.954 1.00 0.00 C ATOM 0 H THR A 22 7.812 -15.330 -17.961 1.00 0.00 H new ATOM 0 HA THR A 22 5.694 -14.898 -20.075 1.00 0.00 H new ATOM 0 HB THR A 22 7.385 -17.328 -20.266 1.00 0.00 H new ATOM 0 HG1 THR A 22 9.253 -16.169 -21.032 1.00 0.00 H new ATOM 0 HG21 THR A 22 7.509 -16.623 -22.640 1.00 0.00 H new ATOM 0 HG22 THR A 22 5.837 -16.543 -22.035 1.00 0.00 H new ATOM 0 HG23 THR A 22 6.792 -15.051 -22.210 1.00 0.00 H new ATOM 334 N ASP A 23 6.196 -17.398 -18.011 1.00 0.00 N ATOM 335 CA ASP A 23 5.456 -18.433 -17.224 1.00 0.00 C ATOM 336 C ASP A 23 6.460 -19.313 -16.476 1.00 0.00 C ATOM 337 O ASP A 23 7.481 -19.694 -17.012 1.00 0.00 O ATOM 338 CB ASP A 23 4.689 -19.248 -18.269 1.00 0.00 C ATOM 339 CG ASP A 23 4.312 -20.614 -17.688 1.00 0.00 C ATOM 340 OD1 ASP A 23 5.206 -21.423 -17.500 1.00 0.00 O ATOM 341 OD2 ASP A 23 3.137 -20.827 -17.440 1.00 0.00 O ATOM 0 H ASP A 23 7.209 -17.411 -17.891 1.00 0.00 H new ATOM 0 HA ASP A 23 4.785 -18.004 -16.480 1.00 0.00 H new ATOM 0 HB2 ASP A 23 3.790 -18.712 -18.574 1.00 0.00 H new ATOM 0 HB3 ASP A 23 5.300 -19.379 -19.162 1.00 0.00 H new ATOM 346 N GLY A 24 6.191 -19.627 -15.239 1.00 0.00 N ATOM 347 CA GLY A 24 7.148 -20.467 -14.469 1.00 0.00 C ATOM 348 C GLY A 24 8.349 -19.608 -14.080 1.00 0.00 C ATOM 349 O GLY A 24 9.397 -20.107 -13.719 1.00 0.00 O ATOM 0 H GLY A 24 5.354 -19.340 -14.731 1.00 0.00 H new ATOM 0 HA2 GLY A 24 6.666 -20.869 -13.578 1.00 0.00 H new ATOM 0 HA3 GLY A 24 7.470 -21.319 -15.068 1.00 0.00 H new ATOM 353 N SER A 25 8.201 -18.313 -14.154 1.00 0.00 N ATOM 354 CA SER A 25 9.327 -17.406 -13.793 1.00 0.00 C ATOM 355 C SER A 25 9.138 -16.872 -12.380 1.00 0.00 C ATOM 356 O SER A 25 8.159 -17.160 -11.721 1.00 0.00 O ATOM 357 CB SER A 25 9.266 -16.275 -14.812 1.00 0.00 C ATOM 358 OG SER A 25 8.666 -16.751 -16.009 1.00 0.00 O ATOM 0 H SER A 25 7.346 -17.843 -14.450 1.00 0.00 H new ATOM 0 HA SER A 25 10.291 -17.914 -13.811 1.00 0.00 H new ATOM 0 HB2 SER A 25 8.691 -15.440 -14.411 1.00 0.00 H new ATOM 0 HB3 SER A 25 10.269 -15.902 -15.018 1.00 0.00 H new ATOM 0 HG SER A 25 9.137 -16.376 -16.782 1.00 0.00 H new ATOM 364 N VAL A 26 10.077 -16.108 -11.903 1.00 0.00 N ATOM 365 CA VAL A 26 9.953 -15.575 -10.523 1.00 0.00 C ATOM 366 C VAL A 26 10.588 -14.194 -10.413 1.00 0.00 C ATOM 367 O VAL A 26 11.368 -13.784 -11.250 1.00 0.00 O ATOM 368 CB VAL A 26 10.703 -16.592 -9.657 1.00 0.00 C ATOM 369 CG1 VAL A 26 11.101 -15.960 -8.321 1.00 0.00 C ATOM 370 CG2 VAL A 26 9.806 -17.801 -9.402 1.00 0.00 C ATOM 0 H VAL A 26 10.920 -15.831 -12.406 1.00 0.00 H new ATOM 0 HA VAL A 26 8.914 -15.452 -10.216 1.00 0.00 H new ATOM 0 HB VAL A 26 11.605 -16.907 -10.181 1.00 0.00 H new ATOM 0 HG11 VAL A 26 11.633 -16.694 -7.716 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.748 -15.102 -8.503 1.00 0.00 H new ATOM 0 HG13 VAL A 26 10.206 -15.634 -7.792 1.00 0.00 H new ATOM 0 HG21 VAL A 26 10.338 -18.526 -8.786 1.00 0.00 H new ATOM 0 HG22 VAL A 26 8.901 -17.480 -8.885 1.00 0.00 H new ATOM 0 HG23 VAL A 26 9.537 -18.261 -10.353 1.00 0.00 H new ATOM 380 N VAL A 27 10.253 -13.472 -9.381 1.00 0.00 N ATOM 381 CA VAL A 27 10.835 -12.114 -9.215 1.00 0.00 C ATOM 382 C VAL A 27 11.237 -11.860 -7.775 1.00 0.00 C ATOM 383 O VAL A 27 10.404 -11.755 -6.897 1.00 0.00 O ATOM 384 CB VAL A 27 9.727 -11.155 -9.625 1.00 0.00 C ATOM 385 CG1 VAL A 27 10.015 -9.753 -9.080 1.00 0.00 C ATOM 386 CG2 VAL A 27 9.685 -11.101 -11.131 1.00 0.00 C ATOM 0 H VAL A 27 9.605 -13.762 -8.649 1.00 0.00 H new ATOM 0 HA VAL A 27 11.737 -11.992 -9.815 1.00 0.00 H new ATOM 0 HB VAL A 27 8.774 -11.499 -9.224 1.00 0.00 H new ATOM 0 HG11 VAL A 27 9.216 -9.075 -9.379 1.00 0.00 H new ATOM 0 HG12 VAL A 27 10.071 -9.790 -7.992 1.00 0.00 H new ATOM 0 HG13 VAL A 27 10.964 -9.395 -9.480 1.00 0.00 H new ATOM 0 HG21 VAL A 27 8.897 -10.418 -11.449 1.00 0.00 H new ATOM 0 HG22 VAL A 27 10.645 -10.749 -11.509 1.00 0.00 H new ATOM 0 HG23 VAL A 27 9.483 -12.097 -11.525 1.00 0.00 H new ATOM 396 N THR A 28 12.501 -11.719 -7.525 1.00 0.00 N ATOM 397 CA THR A 28 12.920 -11.428 -6.143 1.00 0.00 C ATOM 398 C THR A 28 12.522 -9.992 -5.829 1.00 0.00 C ATOM 399 O THR A 28 13.122 -9.051 -6.312 1.00 0.00 O ATOM 400 CB THR A 28 14.438 -11.603 -6.114 1.00 0.00 C ATOM 401 OG1 THR A 28 14.901 -11.963 -7.408 1.00 0.00 O ATOM 402 CG2 THR A 28 14.802 -12.700 -5.115 1.00 0.00 C ATOM 0 H THR A 28 13.252 -11.792 -8.211 1.00 0.00 H new ATOM 0 HA THR A 28 12.456 -12.082 -5.404 1.00 0.00 H new ATOM 0 HB THR A 28 14.907 -10.666 -5.812 1.00 0.00 H new ATOM 0 HG1 THR A 28 14.653 -12.892 -7.597 1.00 0.00 H new ATOM 0 HG21 THR A 28 15.884 -12.827 -5.092 1.00 0.00 H new ATOM 0 HG22 THR A 28 14.449 -12.420 -4.123 1.00 0.00 H new ATOM 0 HG23 THR A 28 14.333 -13.637 -5.416 1.00 0.00 H new ATOM 410 N TYR A 29 11.498 -9.812 -5.051 1.00 0.00 N ATOM 411 CA TYR A 29 11.047 -8.429 -4.743 1.00 0.00 C ATOM 412 C TYR A 29 12.095 -7.720 -3.881 1.00 0.00 C ATOM 413 O TYR A 29 13.029 -8.326 -3.397 1.00 0.00 O ATOM 414 CB TYR A 29 9.751 -8.596 -3.945 1.00 0.00 C ATOM 415 CG TYR A 29 8.543 -8.654 -4.858 1.00 0.00 C ATOM 416 CD1 TYR A 29 8.683 -8.595 -6.253 1.00 0.00 C ATOM 417 CD2 TYR A 29 7.267 -8.770 -4.292 1.00 0.00 C ATOM 418 CE1 TYR A 29 7.550 -8.648 -7.071 1.00 0.00 C ATOM 419 CE2 TYR A 29 6.136 -8.826 -5.112 1.00 0.00 C ATOM 420 CZ TYR A 29 6.277 -8.764 -6.502 1.00 0.00 C ATOM 421 OH TYR A 29 5.160 -8.816 -7.311 1.00 0.00 O ATOM 0 H TYR A 29 10.955 -10.557 -4.616 1.00 0.00 H new ATOM 0 HA TYR A 29 10.901 -7.836 -5.646 1.00 0.00 H new ATOM 0 HB2 TYR A 29 9.803 -9.508 -3.350 1.00 0.00 H new ATOM 0 HB3 TYR A 29 9.642 -7.766 -3.247 1.00 0.00 H new ATOM 0 HD1 TYR A 29 9.665 -8.509 -6.695 1.00 0.00 H new ATOM 0 HD2 TYR A 29 7.156 -8.816 -3.219 1.00 0.00 H new ATOM 0 HE1 TYR A 29 7.658 -8.599 -8.144 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.154 -8.917 -4.672 1.00 0.00 H new ATOM 0 HH TYR A 29 4.357 -8.898 -6.755 1.00 0.00 H new ATOM 431 N SER A 30 11.940 -6.441 -3.680 1.00 0.00 N ATOM 432 CA SER A 30 12.918 -5.691 -2.843 1.00 0.00 C ATOM 433 C SER A 30 12.189 -5.000 -1.690 1.00 0.00 C ATOM 434 O SER A 30 11.051 -4.596 -1.818 1.00 0.00 O ATOM 435 CB SER A 30 13.541 -4.658 -3.782 1.00 0.00 C ATOM 436 OG SER A 30 13.262 -5.013 -5.130 1.00 0.00 O ATOM 0 H SER A 30 11.177 -5.881 -4.060 1.00 0.00 H new ATOM 0 HA SER A 30 13.674 -6.341 -2.403 1.00 0.00 H new ATOM 0 HB2 SER A 30 13.142 -3.667 -3.566 1.00 0.00 H new ATOM 0 HB3 SER A 30 14.618 -4.609 -3.623 1.00 0.00 H new ATOM 0 HG SER A 30 13.660 -4.350 -5.732 1.00 0.00 H new ATOM 442 N CYS A 31 12.830 -4.863 -0.563 1.00 0.00 N ATOM 443 CA CYS A 31 12.163 -4.200 0.595 1.00 0.00 C ATOM 444 C CYS A 31 13.009 -3.024 1.088 1.00 0.00 C ATOM 445 O CYS A 31 14.223 -3.072 1.073 1.00 0.00 O ATOM 446 CB CYS A 31 12.072 -5.281 1.674 1.00 0.00 C ATOM 447 SG CYS A 31 11.427 -6.808 0.947 1.00 0.00 S ATOM 0 H CYS A 31 13.784 -5.180 -0.393 1.00 0.00 H new ATOM 0 HA CYS A 31 11.183 -3.801 0.333 1.00 0.00 H new ATOM 0 HB2 CYS A 31 13.056 -5.460 2.108 1.00 0.00 H new ATOM 0 HB3 CYS A 31 11.422 -4.948 2.483 1.00 0.00 H new ATOM 452 N ASN A 32 12.380 -1.968 1.528 1.00 0.00 N ATOM 453 CA ASN A 32 13.156 -0.795 2.024 1.00 0.00 C ATOM 454 C ASN A 32 14.202 -1.251 3.045 1.00 0.00 C ATOM 455 O ASN A 32 14.010 -2.220 3.752 1.00 0.00 O ATOM 456 CB ASN A 32 12.124 0.119 2.686 1.00 0.00 C ATOM 457 CG ASN A 32 11.977 1.403 1.868 1.00 0.00 C ATOM 458 OD1 ASN A 32 11.975 2.488 2.413 1.00 0.00 O ATOM 459 ND2 ASN A 32 11.851 1.324 0.571 1.00 0.00 N ATOM 0 H ASN A 32 11.366 -1.867 1.566 1.00 0.00 H new ATOM 0 HA ASN A 32 13.691 -0.286 1.222 1.00 0.00 H new ATOM 0 HB2 ASN A 32 11.163 -0.391 2.757 1.00 0.00 H new ATOM 0 HB3 ASN A 32 12.434 0.357 3.703 1.00 0.00 H new ATOM 0 HD21 ASN A 32 11.751 2.174 0.016 1.00 0.00 H new ATOM 0 HD22 ASN A 32 11.853 0.413 0.113 1.00 0.00 H new ATOM 466 N SER A 33 15.306 -0.562 3.125 1.00 0.00 N ATOM 467 CA SER A 33 16.362 -0.959 4.100 1.00 0.00 C ATOM 468 C SER A 33 15.769 -1.081 5.507 1.00 0.00 C ATOM 469 O SER A 33 15.548 -0.098 6.185 1.00 0.00 O ATOM 470 CB SER A 33 17.393 0.167 4.047 1.00 0.00 C ATOM 471 OG SER A 33 18.020 0.170 2.771 1.00 0.00 O ATOM 0 H SER A 33 15.523 0.258 2.559 1.00 0.00 H new ATOM 0 HA SER A 33 16.802 -1.927 3.859 1.00 0.00 H new ATOM 0 HB2 SER A 33 16.910 1.127 4.230 1.00 0.00 H new ATOM 0 HB3 SER A 33 18.138 0.031 4.831 1.00 0.00 H new ATOM 0 HG SER A 33 18.681 0.893 2.733 1.00 0.00 H new ATOM 477 N GLY A 34 15.510 -2.282 5.950 1.00 0.00 N ATOM 478 CA GLY A 34 14.934 -2.467 7.313 1.00 0.00 C ATOM 479 C GLY A 34 13.759 -3.447 7.249 1.00 0.00 C ATOM 480 O GLY A 34 13.169 -3.788 8.256 1.00 0.00 O ATOM 0 H GLY A 34 15.672 -3.143 5.427 1.00 0.00 H new ATOM 0 HA2 GLY A 34 15.698 -2.844 7.993 1.00 0.00 H new ATOM 0 HA3 GLY A 34 14.599 -1.509 7.710 1.00 0.00 H new ATOM 484 N TYR A 35 13.415 -3.905 6.077 1.00 0.00 N ATOM 485 CA TYR A 35 12.279 -4.865 5.958 1.00 0.00 C ATOM 486 C TYR A 35 12.758 -6.176 5.331 1.00 0.00 C ATOM 487 O TYR A 35 13.348 -6.191 4.270 1.00 0.00 O ATOM 488 CB TYR A 35 11.266 -4.172 5.046 1.00 0.00 C ATOM 489 CG TYR A 35 10.457 -3.182 5.850 1.00 0.00 C ATOM 490 CD1 TYR A 35 9.955 -3.543 7.108 1.00 0.00 C ATOM 491 CD2 TYR A 35 10.210 -1.902 5.340 1.00 0.00 C ATOM 492 CE1 TYR A 35 9.206 -2.624 7.853 1.00 0.00 C ATOM 493 CE2 TYR A 35 9.461 -0.984 6.085 1.00 0.00 C ATOM 494 CZ TYR A 35 8.959 -1.345 7.342 1.00 0.00 C ATOM 495 OH TYR A 35 8.221 -0.439 8.076 1.00 0.00 O ATOM 0 H TYR A 35 13.869 -3.657 5.198 1.00 0.00 H new ATOM 0 HA TYR A 35 11.848 -5.116 6.927 1.00 0.00 H new ATOM 0 HB2 TYR A 35 11.783 -3.661 4.234 1.00 0.00 H new ATOM 0 HB3 TYR A 35 10.607 -4.911 4.590 1.00 0.00 H new ATOM 0 HD1 TYR A 35 10.146 -4.530 7.503 1.00 0.00 H new ATOM 0 HD2 TYR A 35 10.598 -1.623 4.371 1.00 0.00 H new ATOM 0 HE1 TYR A 35 8.819 -2.902 8.822 1.00 0.00 H new ATOM 0 HE2 TYR A 35 9.270 0.003 5.691 1.00 0.00 H new ATOM 0 HH TYR A 35 8.144 0.401 7.577 1.00 0.00 H new ATOM 505 N SER A 36 12.506 -7.279 5.982 1.00 0.00 N ATOM 506 CA SER A 36 12.945 -8.590 5.426 1.00 0.00 C ATOM 507 C SER A 36 12.028 -9.022 4.283 1.00 0.00 C ATOM 508 O SER A 36 10.850 -8.720 4.268 1.00 0.00 O ATOM 509 CB SER A 36 12.833 -9.573 6.589 1.00 0.00 C ATOM 510 OG SER A 36 14.136 -10.007 6.954 1.00 0.00 O ATOM 0 H SER A 36 12.015 -7.329 6.875 1.00 0.00 H new ATOM 0 HA SER A 36 13.956 -8.541 5.022 1.00 0.00 H new ATOM 0 HB2 SER A 36 12.343 -9.097 7.438 1.00 0.00 H new ATOM 0 HB3 SER A 36 12.218 -10.426 6.303 1.00 0.00 H new ATOM 0 HG SER A 36 14.675 -9.234 7.224 1.00 0.00 H new ATOM 516 N LEU A 37 12.558 -9.745 3.334 1.00 0.00 N ATOM 517 CA LEU A 37 11.711 -10.218 2.208 1.00 0.00 C ATOM 518 C LEU A 37 11.167 -11.602 2.547 1.00 0.00 C ATOM 519 O LEU A 37 11.822 -12.606 2.349 1.00 0.00 O ATOM 520 CB LEU A 37 12.635 -10.286 0.991 1.00 0.00 C ATOM 521 CG LEU A 37 11.873 -10.905 -0.184 1.00 0.00 C ATOM 522 CD1 LEU A 37 11.772 -9.890 -1.323 1.00 0.00 C ATOM 523 CD2 LEU A 37 12.613 -12.151 -0.678 1.00 0.00 C ATOM 0 H LEU A 37 13.537 -10.027 3.292 1.00 0.00 H new ATOM 0 HA LEU A 37 10.863 -9.561 2.017 1.00 0.00 H new ATOM 0 HB2 LEU A 37 12.984 -9.288 0.728 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.518 -10.882 1.222 1.00 0.00 H new ATOM 0 HG LEU A 37 10.872 -11.183 0.145 1.00 0.00 H new ATOM 0 HD11 LEU A 37 11.229 -10.333 -2.158 1.00 0.00 H new ATOM 0 HD12 LEU A 37 11.242 -9.004 -0.975 1.00 0.00 H new ATOM 0 HD13 LEU A 37 12.773 -9.609 -1.649 1.00 0.00 H new ATOM 0 HD21 LEU A 37 12.069 -12.590 -1.514 1.00 0.00 H new ATOM 0 HD22 LEU A 37 13.616 -11.874 -1.003 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.682 -12.878 0.131 1.00 0.00 H new ATOM 535 N ILE A 38 9.974 -11.661 3.061 1.00 0.00 N ATOM 536 CA ILE A 38 9.386 -12.984 3.418 1.00 0.00 C ATOM 537 C ILE A 38 8.697 -13.574 2.191 1.00 0.00 C ATOM 538 O ILE A 38 8.192 -12.857 1.355 1.00 0.00 O ATOM 539 CB ILE A 38 8.353 -12.733 4.531 1.00 0.00 C ATOM 540 CG1 ILE A 38 8.634 -11.418 5.279 1.00 0.00 C ATOM 541 CG2 ILE A 38 8.408 -13.880 5.529 1.00 0.00 C ATOM 542 CD1 ILE A 38 10.098 -11.368 5.710 1.00 0.00 C ATOM 0 H ILE A 38 9.379 -10.854 3.250 1.00 0.00 H new ATOM 0 HA ILE A 38 10.152 -13.682 3.755 1.00 0.00 H new ATOM 0 HB ILE A 38 7.369 -12.664 4.068 1.00 0.00 H new ATOM 0 HG12 ILE A 38 8.406 -10.568 4.636 1.00 0.00 H new ATOM 0 HG13 ILE A 38 7.986 -11.340 6.152 1.00 0.00 H new ATOM 0 HG21 ILE A 38 7.679 -13.709 6.321 1.00 0.00 H new ATOM 0 HG22 ILE A 38 8.178 -14.816 5.020 1.00 0.00 H new ATOM 0 HG23 ILE A 38 9.407 -13.938 5.962 1.00 0.00 H new ATOM 0 HD11 ILE A 38 10.290 -10.434 6.239 1.00 0.00 H new ATOM 0 HD12 ILE A 38 10.312 -12.209 6.369 1.00 0.00 H new ATOM 0 HD13 ILE A 38 10.739 -11.425 4.830 1.00 0.00 H new ATOM 554 N GLY A 39 8.673 -14.871 2.071 1.00 0.00 N ATOM 555 CA GLY A 39 8.015 -15.493 0.889 1.00 0.00 C ATOM 556 C GLY A 39 8.968 -16.506 0.256 1.00 0.00 C ATOM 557 O GLY A 39 9.909 -16.958 0.877 1.00 0.00 O ATOM 0 H GLY A 39 9.080 -15.526 2.738 1.00 0.00 H new ATOM 0 HA2 GLY A 39 7.090 -15.985 1.190 1.00 0.00 H new ATOM 0 HA3 GLY A 39 7.746 -14.726 0.163 1.00 0.00 H new ATOM 561 N ASN A 40 8.738 -16.865 -0.977 1.00 0.00 N ATOM 562 CA ASN A 40 9.643 -17.846 -1.640 1.00 0.00 C ATOM 563 C ASN A 40 10.752 -17.109 -2.383 1.00 0.00 C ATOM 564 O ASN A 40 10.975 -17.316 -3.559 1.00 0.00 O ATOM 565 CB ASN A 40 8.753 -18.621 -2.612 1.00 0.00 C ATOM 566 CG ASN A 40 8.229 -19.886 -1.929 1.00 0.00 C ATOM 567 OD1 ASN A 40 8.727 -20.283 -0.895 1.00 0.00 O ATOM 568 ND2 ASN A 40 7.238 -20.541 -2.470 1.00 0.00 N ATOM 0 H ASN A 40 7.967 -16.524 -1.551 1.00 0.00 H new ATOM 0 HA ASN A 40 10.129 -18.513 -0.927 1.00 0.00 H new ATOM 0 HB2 ASN A 40 7.919 -17.997 -2.934 1.00 0.00 H new ATOM 0 HB3 ASN A 40 9.317 -18.885 -3.506 1.00 0.00 H new ATOM 0 HD21 ASN A 40 6.882 -21.386 -2.024 1.00 0.00 H new ATOM 0 HD22 ASN A 40 6.820 -20.207 -3.338 1.00 0.00 H new ATOM 575 N SER A 41 11.447 -16.258 -1.681 1.00 0.00 N ATOM 576 CA SER A 41 12.569 -15.478 -2.291 1.00 0.00 C ATOM 577 C SER A 41 12.312 -15.196 -3.777 1.00 0.00 C ATOM 578 O SER A 41 13.168 -15.412 -4.611 1.00 0.00 O ATOM 579 CB SER A 41 13.802 -16.364 -2.119 1.00 0.00 C ATOM 580 OG SER A 41 13.699 -17.488 -2.984 1.00 0.00 O ATOM 0 H SER A 41 11.285 -16.064 -0.693 1.00 0.00 H new ATOM 0 HA SER A 41 12.686 -14.504 -1.815 1.00 0.00 H new ATOM 0 HB2 SER A 41 14.705 -15.798 -2.346 1.00 0.00 H new ATOM 0 HB3 SER A 41 13.885 -16.694 -1.084 1.00 0.00 H new ATOM 0 HG SER A 41 13.694 -17.184 -3.916 1.00 0.00 H new ATOM 586 N GLY A 42 11.146 -14.713 -4.120 1.00 0.00 N ATOM 587 CA GLY A 42 10.862 -14.422 -5.556 1.00 0.00 C ATOM 588 C GLY A 42 9.401 -14.742 -5.886 1.00 0.00 C ATOM 589 O GLY A 42 8.888 -15.782 -5.523 1.00 0.00 O ATOM 0 H GLY A 42 10.384 -14.509 -3.473 1.00 0.00 H new ATOM 0 HA2 GLY A 42 11.068 -13.373 -5.769 1.00 0.00 H new ATOM 0 HA3 GLY A 42 11.523 -15.012 -6.191 1.00 0.00 H new ATOM 593 N VAL A 43 8.734 -13.867 -6.595 1.00 0.00 N ATOM 594 CA VAL A 43 7.313 -14.150 -6.967 1.00 0.00 C ATOM 595 C VAL A 43 7.296 -15.326 -7.934 1.00 0.00 C ATOM 596 O VAL A 43 8.331 -15.820 -8.320 1.00 0.00 O ATOM 597 CB VAL A 43 6.775 -12.914 -7.698 1.00 0.00 C ATOM 598 CG1 VAL A 43 5.256 -12.858 -7.532 1.00 0.00 C ATOM 599 CG2 VAL A 43 7.381 -11.634 -7.131 1.00 0.00 C ATOM 0 H VAL A 43 9.106 -12.978 -6.930 1.00 0.00 H new ATOM 0 HA VAL A 43 6.713 -14.377 -6.086 1.00 0.00 H new ATOM 0 HB VAL A 43 7.045 -12.991 -8.751 1.00 0.00 H new ATOM 0 HG11 VAL A 43 4.866 -11.982 -8.049 1.00 0.00 H new ATOM 0 HG12 VAL A 43 4.810 -13.758 -7.956 1.00 0.00 H new ATOM 0 HG13 VAL A 43 5.008 -12.795 -6.473 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.982 -10.774 -7.668 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.130 -11.550 -6.074 1.00 0.00 H new ATOM 0 HG23 VAL A 43 8.465 -11.663 -7.246 1.00 0.00 H new ATOM 609 N LEU A 44 6.145 -15.758 -8.361 1.00 0.00 N ATOM 610 CA LEU A 44 6.115 -16.877 -9.341 1.00 0.00 C ATOM 611 C LEU A 44 5.045 -16.624 -10.396 1.00 0.00 C ATOM 612 O LEU A 44 3.878 -16.890 -10.187 1.00 0.00 O ATOM 613 CB LEU A 44 5.785 -18.142 -8.551 1.00 0.00 C ATOM 614 CG LEU A 44 5.538 -19.291 -9.538 1.00 0.00 C ATOM 615 CD1 LEU A 44 6.855 -20.001 -9.848 1.00 0.00 C ATOM 616 CD2 LEU A 44 4.549 -20.289 -8.933 1.00 0.00 C ATOM 0 H LEU A 44 5.236 -15.392 -8.079 1.00 0.00 H new ATOM 0 HA LEU A 44 7.071 -16.973 -9.856 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.606 -18.392 -7.879 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.903 -17.981 -7.931 1.00 0.00 H new ATOM 0 HG LEU A 44 5.123 -18.884 -10.460 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.673 -20.816 -10.549 1.00 0.00 H new ATOM 0 HD12 LEU A 44 7.555 -19.292 -10.289 1.00 0.00 H new ATOM 0 HD13 LEU A 44 7.277 -20.403 -8.927 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.377 -21.103 -9.637 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.959 -20.691 -8.007 1.00 0.00 H new ATOM 0 HD23 LEU A 44 3.606 -19.785 -8.723 1.00 0.00 H new ATOM 628 N CYS A 45 5.431 -16.137 -11.538 1.00 0.00 N ATOM 629 CA CYS A 45 4.423 -15.902 -12.603 1.00 0.00 C ATOM 630 C CYS A 45 4.172 -17.202 -13.358 1.00 0.00 C ATOM 631 O CYS A 45 5.049 -17.727 -14.019 1.00 0.00 O ATOM 632 CB CYS A 45 5.025 -14.858 -13.535 1.00 0.00 C ATOM 633 SG CYS A 45 3.703 -13.778 -14.134 1.00 0.00 S ATOM 0 H CYS A 45 6.392 -15.893 -11.779 1.00 0.00 H new ATOM 0 HA CYS A 45 3.472 -15.561 -12.195 1.00 0.00 H new ATOM 0 HB2 CYS A 45 5.780 -14.274 -13.009 1.00 0.00 H new ATOM 0 HB3 CYS A 45 5.524 -15.344 -14.373 1.00 0.00 H new ATOM 638 N SER A 46 2.988 -17.728 -13.262 1.00 0.00 N ATOM 639 CA SER A 46 2.687 -19.000 -13.975 1.00 0.00 C ATOM 640 C SER A 46 1.358 -18.881 -14.727 1.00 0.00 C ATOM 641 O SER A 46 0.327 -19.321 -14.258 1.00 0.00 O ATOM 642 CB SER A 46 2.590 -20.059 -12.878 1.00 0.00 C ATOM 643 OG SER A 46 1.742 -19.585 -11.840 1.00 0.00 O ATOM 0 H SER A 46 2.216 -17.336 -12.723 1.00 0.00 H new ATOM 0 HA SER A 46 3.449 -19.250 -14.713 1.00 0.00 H new ATOM 0 HB2 SER A 46 2.196 -20.989 -13.288 1.00 0.00 H new ATOM 0 HB3 SER A 46 3.581 -20.280 -12.481 1.00 0.00 H new ATOM 0 HG SER A 46 0.873 -19.333 -12.217 1.00 0.00 H new ATOM 649 N GLY A 47 1.372 -18.287 -15.889 1.00 0.00 N ATOM 650 CA GLY A 47 0.109 -18.138 -16.665 1.00 0.00 C ATOM 651 C GLY A 47 -0.298 -16.664 -16.696 1.00 0.00 C ATOM 652 O GLY A 47 -1.356 -16.290 -16.227 1.00 0.00 O ATOM 0 H GLY A 47 2.203 -17.899 -16.334 1.00 0.00 H new ATOM 0 HA2 GLY A 47 0.247 -18.510 -17.680 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -0.682 -18.735 -16.212 1.00 0.00 H new ATOM 656 N GLY A 48 0.535 -15.821 -17.243 1.00 0.00 N ATOM 657 CA GLY A 48 0.197 -14.371 -17.301 1.00 0.00 C ATOM 658 C GLY A 48 -0.371 -13.927 -15.952 1.00 0.00 C ATOM 659 O GLY A 48 -1.178 -13.021 -15.874 1.00 0.00 O ATOM 0 H GLY A 48 1.435 -16.074 -17.652 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.086 -13.789 -17.543 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -0.530 -14.187 -18.092 1.00 0.00 H new ATOM 663 N GLU A 49 0.045 -14.558 -14.887 1.00 0.00 N ATOM 664 CA GLU A 49 -0.471 -14.173 -13.542 1.00 0.00 C ATOM 665 C GLU A 49 0.611 -14.382 -12.480 1.00 0.00 C ATOM 666 O GLU A 49 1.271 -15.402 -12.446 1.00 0.00 O ATOM 667 CB GLU A 49 -1.653 -15.108 -13.286 1.00 0.00 C ATOM 668 CG GLU A 49 -2.956 -14.410 -13.682 1.00 0.00 C ATOM 669 CD GLU A 49 -4.087 -14.883 -12.767 1.00 0.00 C ATOM 670 OE1 GLU A 49 -4.272 -14.278 -11.724 1.00 0.00 O ATOM 671 OE2 GLU A 49 -4.748 -15.845 -13.124 1.00 0.00 O ATOM 0 H GLU A 49 0.720 -15.323 -14.890 1.00 0.00 H new ATOM 0 HA GLU A 49 -0.763 -13.124 -13.500 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -1.533 -16.028 -13.859 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -1.685 -15.390 -12.234 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -2.840 -13.329 -13.605 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.198 -14.631 -14.721 1.00 0.00 H new ATOM 678 N TRP A 50 0.795 -13.428 -11.610 1.00 0.00 N ATOM 679 CA TRP A 50 1.831 -13.579 -10.549 1.00 0.00 C ATOM 680 C TRP A 50 1.199 -14.155 -9.283 1.00 0.00 C ATOM 681 O TRP A 50 0.100 -13.794 -8.909 1.00 0.00 O ATOM 682 CB TRP A 50 2.348 -12.163 -10.290 1.00 0.00 C ATOM 683 CG TRP A 50 3.241 -11.750 -11.412 1.00 0.00 C ATOM 684 CD1 TRP A 50 2.879 -10.951 -12.441 1.00 0.00 C ATOM 685 CD2 TRP A 50 4.635 -12.104 -11.639 1.00 0.00 C ATOM 686 NE1 TRP A 50 3.961 -10.796 -13.288 1.00 0.00 N ATOM 687 CE2 TRP A 50 5.067 -11.487 -12.836 1.00 0.00 C ATOM 688 CE3 TRP A 50 5.555 -12.895 -10.930 1.00 0.00 C ATOM 689 CZ2 TRP A 50 6.367 -11.651 -13.314 1.00 0.00 C ATOM 690 CZ3 TRP A 50 6.864 -13.063 -11.405 1.00 0.00 C ATOM 691 CH2 TRP A 50 7.269 -12.443 -12.595 1.00 0.00 C ATOM 0 H TRP A 50 0.274 -12.551 -11.587 1.00 0.00 H new ATOM 0 HA TRP A 50 2.633 -14.255 -10.847 1.00 0.00 H new ATOM 0 HB2 TRP A 50 1.512 -11.469 -10.201 1.00 0.00 H new ATOM 0 HB3 TRP A 50 2.892 -12.129 -9.346 1.00 0.00 H new ATOM 0 HD1 TRP A 50 1.904 -10.507 -12.579 1.00 0.00 H new ATOM 0 HE1 TRP A 50 3.944 -10.239 -14.142 1.00 0.00 H new ATOM 0 HE3 TRP A 50 5.252 -13.377 -10.012 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 6.675 -11.171 -14.231 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 7.563 -13.673 -10.851 1.00 0.00 H new ATOM 0 HH2 TRP A 50 8.278 -12.577 -12.957 1.00 0.00 H new ATOM 702 N SER A 51 1.877 -15.047 -8.619 1.00 0.00 N ATOM 703 CA SER A 51 1.297 -15.637 -7.381 1.00 0.00 C ATOM 704 C SER A 51 2.365 -15.795 -6.296 1.00 0.00 C ATOM 705 O SER A 51 3.551 -15.824 -6.567 1.00 0.00 O ATOM 706 CB SER A 51 0.762 -17.003 -7.805 1.00 0.00 C ATOM 707 OG SER A 51 1.804 -17.965 -7.712 1.00 0.00 O ATOM 0 H SER A 51 2.802 -15.392 -8.877 1.00 0.00 H new ATOM 0 HA SER A 51 0.519 -15.002 -6.958 1.00 0.00 H new ATOM 0 HB2 SER A 51 -0.074 -17.293 -7.168 1.00 0.00 H new ATOM 0 HB3 SER A 51 0.384 -16.957 -8.826 1.00 0.00 H new ATOM 0 HG SER A 51 1.463 -18.843 -7.982 1.00 0.00 H new ATOM 713 N ASP A 52 1.934 -15.907 -5.070 1.00 0.00 N ATOM 714 CA ASP A 52 2.883 -16.079 -3.933 1.00 0.00 C ATOM 715 C ASP A 52 4.022 -15.060 -3.992 1.00 0.00 C ATOM 716 O ASP A 52 5.159 -15.408 -4.242 1.00 0.00 O ATOM 717 CB ASP A 52 3.426 -17.501 -4.079 1.00 0.00 C ATOM 718 CG ASP A 52 3.307 -18.232 -2.741 1.00 0.00 C ATOM 719 OD1 ASP A 52 2.220 -18.692 -2.433 1.00 0.00 O ATOM 720 OD2 ASP A 52 4.307 -18.320 -2.046 1.00 0.00 O ATOM 0 H ASP A 52 0.950 -15.886 -4.804 1.00 0.00 H new ATOM 0 HA ASP A 52 2.388 -15.921 -2.975 1.00 0.00 H new ATOM 0 HB2 ASP A 52 2.870 -18.037 -4.849 1.00 0.00 H new ATOM 0 HB3 ASP A 52 4.468 -17.473 -4.399 1.00 0.00 H new ATOM 725 N PRO A 53 3.673 -13.832 -3.730 1.00 0.00 N ATOM 726 CA PRO A 53 4.658 -12.738 -3.716 1.00 0.00 C ATOM 727 C PRO A 53 5.231 -12.599 -2.304 1.00 0.00 C ATOM 728 O PRO A 53 4.498 -12.647 -1.336 1.00 0.00 O ATOM 729 CB PRO A 53 3.824 -11.517 -4.081 1.00 0.00 C ATOM 730 CG PRO A 53 2.414 -11.853 -3.672 1.00 0.00 C ATOM 731 CD PRO A 53 2.331 -13.347 -3.431 1.00 0.00 C ATOM 0 HA PRO A 53 5.501 -12.888 -4.390 1.00 0.00 H new ATOM 0 HB2 PRO A 53 4.182 -10.628 -3.561 1.00 0.00 H new ATOM 0 HB3 PRO A 53 3.883 -11.307 -5.149 1.00 0.00 H new ATOM 0 HG2 PRO A 53 2.140 -11.307 -2.769 1.00 0.00 H new ATOM 0 HG3 PRO A 53 1.712 -11.554 -4.450 1.00 0.00 H new ATOM 0 HD2 PRO A 53 2.047 -13.569 -2.402 1.00 0.00 H new ATOM 0 HD3 PRO A 53 1.586 -13.814 -4.075 1.00 0.00 H new ATOM 739 N PRO A 54 6.520 -12.442 -2.226 1.00 0.00 N ATOM 740 CA PRO A 54 7.180 -12.309 -0.908 1.00 0.00 C ATOM 741 C PRO A 54 6.872 -10.945 -0.282 1.00 0.00 C ATOM 742 O PRO A 54 6.706 -9.955 -0.968 1.00 0.00 O ATOM 743 CB PRO A 54 8.662 -12.453 -1.231 1.00 0.00 C ATOM 744 CG PRO A 54 8.787 -12.047 -2.664 1.00 0.00 C ATOM 745 CD PRO A 54 7.475 -12.370 -3.336 1.00 0.00 C ATOM 0 HA PRO A 54 6.839 -13.047 -0.182 1.00 0.00 H new ATOM 0 HB2 PRO A 54 9.270 -11.818 -0.586 1.00 0.00 H new ATOM 0 HB3 PRO A 54 9.001 -13.478 -1.080 1.00 0.00 H new ATOM 0 HG2 PRO A 54 9.009 -10.983 -2.744 1.00 0.00 H new ATOM 0 HG3 PRO A 54 9.607 -12.580 -3.145 1.00 0.00 H new ATOM 0 HD2 PRO A 54 7.194 -11.601 -4.055 1.00 0.00 H new ATOM 0 HD3 PRO A 54 7.526 -13.313 -3.881 1.00 0.00 H new ATOM 753 N THR A 55 6.777 -10.896 1.019 1.00 0.00 N ATOM 754 CA THR A 55 6.458 -9.609 1.709 1.00 0.00 C ATOM 755 C THR A 55 7.723 -8.838 2.078 1.00 0.00 C ATOM 756 O THR A 55 8.827 -9.336 1.992 1.00 0.00 O ATOM 757 CB THR A 55 5.748 -10.024 3.000 1.00 0.00 C ATOM 758 OG1 THR A 55 6.580 -10.906 3.732 1.00 0.00 O ATOM 759 CG2 THR A 55 4.438 -10.729 2.668 1.00 0.00 C ATOM 0 H THR A 55 6.907 -11.696 1.639 1.00 0.00 H new ATOM 0 HA THR A 55 5.862 -8.962 1.066 1.00 0.00 H new ATOM 0 HB THR A 55 5.538 -9.135 3.595 1.00 0.00 H new ATOM 0 HG1 THR A 55 6.035 -11.425 4.359 1.00 0.00 H new ATOM 0 HG21 THR A 55 3.938 -11.022 3.591 1.00 0.00 H new ATOM 0 HG22 THR A 55 3.794 -10.054 2.105 1.00 0.00 H new ATOM 0 HG23 THR A 55 4.644 -11.617 2.070 1.00 0.00 H new ATOM 767 N CYS A 56 7.544 -7.634 2.535 1.00 0.00 N ATOM 768 CA CYS A 56 8.693 -6.805 2.976 1.00 0.00 C ATOM 769 C CYS A 56 8.364 -6.268 4.359 1.00 0.00 C ATOM 770 O CYS A 56 7.963 -5.134 4.530 1.00 0.00 O ATOM 771 CB CYS A 56 8.813 -5.680 1.949 1.00 0.00 C ATOM 772 SG CYS A 56 9.535 -6.337 0.425 1.00 0.00 S ATOM 0 H CYS A 56 6.634 -7.182 2.623 1.00 0.00 H new ATOM 0 HA CYS A 56 9.634 -7.352 3.037 1.00 0.00 H new ATOM 0 HB2 CYS A 56 7.832 -5.252 1.745 1.00 0.00 H new ATOM 0 HB3 CYS A 56 9.436 -4.877 2.343 1.00 0.00 H new ATOM 777 N GLN A 57 8.495 -7.106 5.342 1.00 0.00 N ATOM 778 CA GLN A 57 8.153 -6.695 6.729 1.00 0.00 C ATOM 779 C GLN A 57 9.394 -6.730 7.620 1.00 0.00 C ATOM 780 O GLN A 57 10.508 -6.661 7.149 1.00 0.00 O ATOM 781 CB GLN A 57 7.114 -7.718 7.229 1.00 0.00 C ATOM 782 CG GLN A 57 6.908 -8.856 6.218 1.00 0.00 C ATOM 783 CD GLN A 57 5.805 -9.792 6.714 1.00 0.00 C ATOM 784 OE1 GLN A 57 4.954 -10.206 5.952 1.00 0.00 O ATOM 785 NE2 GLN A 57 5.784 -10.145 7.969 1.00 0.00 N ATOM 0 H GLN A 57 8.827 -8.066 5.245 1.00 0.00 H new ATOM 0 HA GLN A 57 7.764 -5.677 6.756 1.00 0.00 H new ATOM 0 HB2 GLN A 57 7.441 -8.133 8.183 1.00 0.00 H new ATOM 0 HB3 GLN A 57 6.164 -7.214 7.409 1.00 0.00 H new ATOM 0 HG2 GLN A 57 6.640 -8.446 5.244 1.00 0.00 H new ATOM 0 HG3 GLN A 57 7.837 -9.411 6.086 1.00 0.00 H new ATOM 0 HE21 GLN A 57 6.498 -9.797 8.609 1.00 0.00 H new ATOM 0 HE22 GLN A 57 5.053 -10.769 8.311 1.00 0.00 H new ATOM 794 N ILE A 58 9.207 -6.845 8.905 1.00 0.00 N ATOM 795 CA ILE A 58 10.376 -6.896 9.824 1.00 0.00 C ATOM 796 C ILE A 58 10.478 -8.306 10.404 1.00 0.00 C ATOM 797 O ILE A 58 9.484 -8.931 10.714 1.00 0.00 O ATOM 798 CB ILE A 58 10.120 -5.865 10.937 1.00 0.00 C ATOM 799 CG1 ILE A 58 8.994 -4.892 10.550 1.00 0.00 C ATOM 800 CG2 ILE A 58 11.398 -5.064 11.169 1.00 0.00 C ATOM 801 CD1 ILE A 58 7.646 -5.467 10.990 1.00 0.00 C ATOM 0 H ILE A 58 8.295 -6.906 9.358 1.00 0.00 H new ATOM 0 HA ILE A 58 11.310 -6.666 9.312 1.00 0.00 H new ATOM 0 HB ILE A 58 9.822 -6.399 11.839 1.00 0.00 H new ATOM 0 HG12 ILE A 58 9.159 -3.923 11.021 1.00 0.00 H new ATOM 0 HG13 ILE A 58 8.996 -4.727 9.473 1.00 0.00 H new ATOM 0 HG21 ILE A 58 11.229 -4.329 11.956 1.00 0.00 H new ATOM 0 HG22 ILE A 58 12.201 -5.738 11.468 1.00 0.00 H new ATOM 0 HG23 ILE A 58 11.678 -4.552 10.249 1.00 0.00 H new ATOM 0 HD11 ILE A 58 6.849 -4.776 10.715 1.00 0.00 H new ATOM 0 HD12 ILE A 58 7.481 -6.426 10.498 1.00 0.00 H new ATOM 0 HD13 ILE A 58 7.646 -5.609 12.071 1.00 0.00 H new ATOM 813 N VAL A 59 11.664 -8.826 10.525 1.00 0.00 N ATOM 814 CA VAL A 59 11.806 -10.211 11.053 1.00 0.00 C ATOM 815 C VAL A 59 12.820 -10.265 12.171 1.00 0.00 C ATOM 816 O VAL A 59 13.637 -11.159 12.239 1.00 0.00 O ATOM 817 CB VAL A 59 12.327 -11.003 9.872 1.00 0.00 C ATOM 818 CG1 VAL A 59 11.318 -10.957 8.724 1.00 0.00 C ATOM 819 CG2 VAL A 59 13.637 -10.375 9.433 1.00 0.00 C ATOM 0 H VAL A 59 12.537 -8.357 10.283 1.00 0.00 H new ATOM 0 HA VAL A 59 10.867 -10.590 11.455 1.00 0.00 H new ATOM 0 HB VAL A 59 12.479 -12.045 10.153 1.00 0.00 H new ATOM 0 HG11 VAL A 59 11.702 -11.529 7.879 1.00 0.00 H new ATOM 0 HG12 VAL A 59 10.372 -11.386 9.054 1.00 0.00 H new ATOM 0 HG13 VAL A 59 11.160 -9.922 8.420 1.00 0.00 H new ATOM 0 HG21 VAL A 59 14.037 -10.926 8.582 1.00 0.00 H new ATOM 0 HG22 VAL A 59 13.465 -9.338 9.146 1.00 0.00 H new ATOM 0 HG23 VAL A 59 14.351 -10.410 10.256 1.00 0.00 H new ATOM 829 N LYS A 60 12.773 -9.334 13.048 1.00 0.00 N ATOM 830 CA LYS A 60 13.754 -9.355 14.162 1.00 0.00 C ATOM 831 C LYS A 60 13.436 -10.525 15.099 1.00 0.00 C ATOM 832 O LYS A 60 12.563 -10.441 15.941 1.00 0.00 O ATOM 833 CB LYS A 60 13.595 -8.012 14.876 1.00 0.00 C ATOM 834 CG LYS A 60 14.045 -6.883 13.946 1.00 0.00 C ATOM 835 CD LYS A 60 14.829 -5.840 14.745 1.00 0.00 C ATOM 836 CE LYS A 60 15.161 -4.648 13.842 1.00 0.00 C ATOM 837 NZ LYS A 60 13.934 -3.803 13.855 1.00 0.00 N ATOM 0 H LYS A 60 12.109 -8.560 13.055 1.00 0.00 H new ATOM 0 HA LYS A 60 14.779 -9.491 13.816 1.00 0.00 H new ATOM 0 HB2 LYS A 60 12.555 -7.864 15.168 1.00 0.00 H new ATOM 0 HB3 LYS A 60 14.188 -8.002 15.791 1.00 0.00 H new ATOM 0 HG2 LYS A 60 14.666 -7.284 13.145 1.00 0.00 H new ATOM 0 HG3 LYS A 60 13.178 -6.419 13.475 1.00 0.00 H new ATOM 0 HD2 LYS A 60 14.244 -5.508 15.603 1.00 0.00 H new ATOM 0 HD3 LYS A 60 15.746 -6.280 15.136 1.00 0.00 H new ATOM 0 HE2 LYS A 60 16.024 -4.097 14.216 1.00 0.00 H new ATOM 0 HE3 LYS A 60 15.405 -4.974 12.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 13.740 -3.458 12.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 13.127 -4.368 14.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 14.077 -2.993 14.491 1.00 0.00 H new ATOM 851 N CYS A 61 14.129 -11.621 14.944 1.00 0.00 N ATOM 852 CA CYS A 61 13.863 -12.808 15.808 1.00 0.00 C ATOM 853 C CYS A 61 14.302 -12.541 17.246 1.00 0.00 C ATOM 854 O CYS A 61 15.048 -11.619 17.512 1.00 0.00 O ATOM 855 CB CYS A 61 14.692 -13.934 15.193 1.00 0.00 C ATOM 856 SG CYS A 61 14.282 -14.090 13.438 1.00 0.00 S ATOM 0 H CYS A 61 14.870 -11.746 14.254 1.00 0.00 H new ATOM 0 HA CYS A 61 12.802 -13.053 15.850 1.00 0.00 H new ATOM 0 HB2 CYS A 61 15.755 -13.725 15.313 1.00 0.00 H new ATOM 0 HB3 CYS A 61 14.491 -14.873 15.710 1.00 0.00 H new ATOM 861 N PRO A 62 13.812 -13.368 18.127 1.00 0.00 N ATOM 862 CA PRO A 62 14.140 -13.242 19.568 1.00 0.00 C ATOM 863 C PRO A 62 15.598 -13.633 19.824 1.00 0.00 C ATOM 864 O PRO A 62 16.494 -12.813 19.779 1.00 0.00 O ATOM 865 CB PRO A 62 13.188 -14.234 20.236 1.00 0.00 C ATOM 866 CG PRO A 62 12.861 -15.232 19.174 1.00 0.00 C ATOM 867 CD PRO A 62 12.910 -14.497 17.864 1.00 0.00 C ATOM 0 HA PRO A 62 14.029 -12.226 19.945 1.00 0.00 H new ATOM 0 HB2 PRO A 62 13.656 -14.712 21.096 1.00 0.00 H new ATOM 0 HB3 PRO A 62 12.289 -13.735 20.599 1.00 0.00 H new ATOM 0 HG2 PRO A 62 13.575 -16.055 19.183 1.00 0.00 H new ATOM 0 HG3 PRO A 62 11.874 -15.664 19.339 1.00 0.00 H new ATOM 0 HD2 PRO A 62 13.288 -15.132 17.063 1.00 0.00 H new ATOM 0 HD3 PRO A 62 11.920 -14.156 17.560 1.00 0.00 H new ATOM 875 N HIS A 63 15.832 -14.884 20.095 1.00 0.00 N ATOM 876 CA HIS A 63 17.214 -15.362 20.360 1.00 0.00 C ATOM 877 C HIS A 63 17.233 -16.880 20.241 1.00 0.00 C ATOM 878 O HIS A 63 16.385 -17.553 20.793 1.00 0.00 O ATOM 879 CB HIS A 63 17.509 -14.942 21.796 1.00 0.00 C ATOM 880 CG HIS A 63 18.590 -13.897 21.814 1.00 0.00 C ATOM 881 ND1 HIS A 63 19.329 -13.621 22.953 1.00 0.00 N ATOM 882 CD2 HIS A 63 19.067 -13.053 20.844 1.00 0.00 C ATOM 883 CE1 HIS A 63 20.203 -12.647 22.643 1.00 0.00 C ATOM 884 NE2 HIS A 63 20.086 -12.263 21.369 1.00 0.00 N ATOM 0 H HIS A 63 15.113 -15.606 20.145 1.00 0.00 H new ATOM 0 HA HIS A 63 17.949 -14.956 19.665 1.00 0.00 H new ATOM 0 HB2 HIS A 63 16.605 -14.550 22.262 1.00 0.00 H new ATOM 0 HB3 HIS A 63 17.819 -15.808 22.381 1.00 0.00 H new ATOM 0 HD1 HIS A 63 19.228 -14.074 23.861 1.00 0.00 H new ATOM 0 HD2 HIS A 63 18.707 -13.008 19.827 1.00 0.00 H new ATOM 0 HE1 HIS A 63 20.913 -12.226 23.340 1.00 0.00 H new ATOM 892 N PRO A 64 18.186 -17.380 19.516 1.00 0.00 N ATOM 893 CA PRO A 64 18.279 -18.838 19.328 1.00 0.00 C ATOM 894 C PRO A 64 18.871 -19.488 20.576 1.00 0.00 C ATOM 895 O PRO A 64 19.971 -20.003 20.558 1.00 0.00 O ATOM 896 CB PRO A 64 19.221 -18.983 18.148 1.00 0.00 C ATOM 897 CG PRO A 64 20.063 -17.746 18.161 1.00 0.00 C ATOM 898 CD PRO A 64 19.251 -16.657 18.813 1.00 0.00 C ATOM 0 HA PRO A 64 17.314 -19.316 19.157 1.00 0.00 H new ATOM 0 HB2 PRO A 64 19.836 -19.878 18.243 1.00 0.00 H new ATOM 0 HB3 PRO A 64 18.669 -19.073 17.213 1.00 0.00 H new ATOM 0 HG2 PRO A 64 20.988 -17.917 18.711 1.00 0.00 H new ATOM 0 HG3 PRO A 64 20.343 -17.461 17.147 1.00 0.00 H new ATOM 0 HD2 PRO A 64 19.855 -16.067 19.502 1.00 0.00 H new ATOM 0 HD3 PRO A 64 18.844 -15.966 18.075 1.00 0.00 H new ATOM 906 N THR A 65 18.152 -19.466 21.660 1.00 0.00 N ATOM 907 CA THR A 65 18.677 -20.086 22.914 1.00 0.00 C ATOM 908 C THR A 65 18.275 -21.553 22.958 1.00 0.00 C ATOM 909 O THR A 65 17.645 -22.059 22.052 1.00 0.00 O ATOM 910 CB THR A 65 18.022 -19.336 24.082 1.00 0.00 C ATOM 911 OG1 THR A 65 16.854 -20.033 24.489 1.00 0.00 O ATOM 912 CG2 THR A 65 17.644 -17.917 23.664 1.00 0.00 C ATOM 0 H THR A 65 17.225 -19.048 21.736 1.00 0.00 H new ATOM 0 HA THR A 65 19.764 -20.023 22.965 1.00 0.00 H new ATOM 0 HB THR A 65 18.732 -19.281 24.907 1.00 0.00 H new ATOM 0 HG1 THR A 65 16.433 -19.558 25.236 1.00 0.00 H new ATOM 0 HG21 THR A 65 17.181 -17.401 24.505 1.00 0.00 H new ATOM 0 HG22 THR A 65 18.540 -17.378 23.356 1.00 0.00 H new ATOM 0 HG23 THR A 65 16.941 -17.958 22.832 1.00 0.00 H new ATOM 920 N ILE A 66 18.620 -22.245 24.002 1.00 0.00 N ATOM 921 CA ILE A 66 18.230 -23.677 24.080 1.00 0.00 C ATOM 922 C ILE A 66 18.657 -24.280 25.427 1.00 0.00 C ATOM 923 O ILE A 66 19.473 -23.728 26.138 1.00 0.00 O ATOM 924 CB ILE A 66 18.921 -24.379 22.880 1.00 0.00 C ATOM 925 CG1 ILE A 66 19.415 -25.774 23.277 1.00 0.00 C ATOM 926 CG2 ILE A 66 20.108 -23.563 22.363 1.00 0.00 C ATOM 927 CD1 ILE A 66 19.759 -26.558 22.010 1.00 0.00 C ATOM 0 H ILE A 66 19.149 -21.888 24.797 1.00 0.00 H new ATOM 0 HA ILE A 66 17.149 -23.807 24.024 1.00 0.00 H new ATOM 0 HB ILE A 66 18.177 -24.464 22.088 1.00 0.00 H new ATOM 0 HG12 ILE A 66 20.291 -25.694 23.920 1.00 0.00 H new ATOM 0 HG13 ILE A 66 18.647 -26.297 23.847 1.00 0.00 H new ATOM 0 HG21 ILE A 66 20.569 -24.083 21.523 1.00 0.00 H new ATOM 0 HG22 ILE A 66 19.761 -22.583 22.037 1.00 0.00 H new ATOM 0 HG23 ILE A 66 20.841 -23.441 23.161 1.00 0.00 H new ATOM 0 HD11 ILE A 66 20.112 -27.553 22.282 1.00 0.00 H new ATOM 0 HD12 ILE A 66 18.871 -26.647 21.384 1.00 0.00 H new ATOM 0 HD13 ILE A 66 20.540 -26.034 21.459 1.00 0.00 H new ATOM 939 N SER A 67 18.101 -25.410 25.778 1.00 0.00 N ATOM 940 CA SER A 67 18.460 -26.054 27.074 1.00 0.00 C ATOM 941 C SER A 67 19.888 -26.599 27.022 1.00 0.00 C ATOM 942 O SER A 67 20.129 -27.690 26.550 1.00 0.00 O ATOM 943 CB SER A 67 17.457 -27.195 27.245 1.00 0.00 C ATOM 944 OG SER A 67 16.488 -26.827 28.218 1.00 0.00 O ATOM 0 H SER A 67 17.412 -25.915 25.221 1.00 0.00 H new ATOM 0 HA SER A 67 18.421 -25.350 27.905 1.00 0.00 H new ATOM 0 HB2 SER A 67 16.970 -27.412 26.294 1.00 0.00 H new ATOM 0 HB3 SER A 67 17.972 -28.104 27.554 1.00 0.00 H new ATOM 0 HG SER A 67 15.842 -27.556 28.329 1.00 0.00 H new ATOM 950 N ASN A 68 20.836 -25.847 27.510 1.00 0.00 N ATOM 951 CA ASN A 68 22.250 -26.321 27.495 1.00 0.00 C ATOM 952 C ASN A 68 22.616 -26.867 26.112 1.00 0.00 C ATOM 953 O ASN A 68 23.238 -27.903 25.990 1.00 0.00 O ATOM 954 CB ASN A 68 22.304 -27.436 28.541 1.00 0.00 C ATOM 955 CG ASN A 68 22.181 -26.832 29.941 1.00 0.00 C ATOM 956 OD1 ASN A 68 21.106 -26.792 30.506 1.00 0.00 O ATOM 957 ND2 ASN A 68 23.245 -26.358 30.529 1.00 0.00 N ATOM 0 H ASN A 68 20.693 -24.924 27.919 1.00 0.00 H new ATOM 0 HA ASN A 68 22.954 -25.519 27.714 1.00 0.00 H new ATOM 0 HB2 ASN A 68 21.498 -28.149 28.369 1.00 0.00 H new ATOM 0 HB3 ASN A 68 23.241 -27.987 28.452 1.00 0.00 H new ATOM 0 HD21 ASN A 68 23.174 -25.954 31.463 1.00 0.00 H new ATOM 0 HD22 ASN A 68 24.147 -26.392 30.055 1.00 0.00 H new ATOM 964 N GLY A 69 22.241 -26.180 25.070 1.00 0.00 N ATOM 965 CA GLY A 69 22.575 -26.664 23.702 1.00 0.00 C ATOM 966 C GLY A 69 22.728 -25.466 22.766 1.00 0.00 C ATOM 967 O GLY A 69 22.407 -25.538 21.599 1.00 0.00 O ATOM 0 H GLY A 69 21.718 -25.305 25.106 1.00 0.00 H new ATOM 0 HA2 GLY A 69 23.498 -27.243 23.724 1.00 0.00 H new ATOM 0 HA3 GLY A 69 21.791 -27.328 23.337 1.00 0.00 H new ATOM 971 N TYR A 70 23.196 -24.361 23.284 1.00 0.00 N ATOM 972 CA TYR A 70 23.362 -23.131 22.450 1.00 0.00 C ATOM 973 C TYR A 70 24.016 -23.421 21.115 1.00 0.00 C ATOM 974 O TYR A 70 24.232 -24.545 20.728 1.00 0.00 O ATOM 975 CB TYR A 70 24.250 -22.186 23.255 1.00 0.00 C ATOM 976 CG TYR A 70 25.678 -22.683 23.251 1.00 0.00 C ATOM 977 CD1 TYR A 70 26.025 -23.844 23.955 1.00 0.00 C ATOM 978 CD2 TYR A 70 26.657 -21.976 22.544 1.00 0.00 C ATOM 979 CE1 TYR A 70 27.351 -24.295 23.950 1.00 0.00 C ATOM 980 CE2 TYR A 70 27.982 -22.427 22.538 1.00 0.00 C ATOM 981 CZ TYR A 70 28.329 -23.587 23.241 1.00 0.00 C ATOM 982 OH TYR A 70 29.636 -24.031 23.235 1.00 0.00 O ATOM 0 H TYR A 70 23.474 -24.256 24.260 1.00 0.00 H new ATOM 0 HA TYR A 70 22.384 -22.703 22.229 1.00 0.00 H new ATOM 0 HB2 TYR A 70 24.205 -21.183 22.831 1.00 0.00 H new ATOM 0 HB3 TYR A 70 23.884 -22.116 24.279 1.00 0.00 H new ATOM 0 HD1 TYR A 70 25.270 -24.391 24.501 1.00 0.00 H new ATOM 0 HD2 TYR A 70 26.390 -21.081 22.002 1.00 0.00 H new ATOM 0 HE1 TYR A 70 27.619 -25.189 24.493 1.00 0.00 H new ATOM 0 HE2 TYR A 70 28.736 -21.880 21.991 1.00 0.00 H new ATOM 0 HH TYR A 70 30.185 -23.425 22.695 1.00 0.00 H new ATOM 992 N LEU A 71 24.328 -22.383 20.412 1.00 0.00 N ATOM 993 CA LEU A 71 24.968 -22.553 19.077 1.00 0.00 C ATOM 994 C LEU A 71 26.393 -21.991 19.069 1.00 0.00 C ATOM 995 O LEU A 71 26.786 -21.246 19.944 1.00 0.00 O ATOM 996 CB LEU A 71 24.048 -21.825 18.068 1.00 0.00 C ATOM 997 CG LEU A 71 23.694 -20.390 18.504 1.00 0.00 C ATOM 998 CD1 LEU A 71 22.529 -20.426 19.487 1.00 0.00 C ATOM 999 CD2 LEU A 71 24.892 -19.689 19.153 1.00 0.00 C ATOM 0 H LEU A 71 24.170 -21.417 20.698 1.00 0.00 H new ATOM 0 HA LEU A 71 25.072 -23.605 18.813 1.00 0.00 H new ATOM 0 HB2 LEU A 71 24.538 -21.793 17.095 1.00 0.00 H new ATOM 0 HB3 LEU A 71 23.129 -22.398 17.943 1.00 0.00 H new ATOM 0 HG LEU A 71 23.414 -19.826 17.614 1.00 0.00 H new ATOM 0 HD11 LEU A 71 22.280 -19.410 19.794 1.00 0.00 H new ATOM 0 HD12 LEU A 71 21.663 -20.883 19.008 1.00 0.00 H new ATOM 0 HD13 LEU A 71 22.810 -21.011 20.363 1.00 0.00 H new ATOM 0 HD21 LEU A 71 24.607 -18.679 19.448 1.00 0.00 H new ATOM 0 HD22 LEU A 71 25.208 -20.249 20.033 1.00 0.00 H new ATOM 0 HD23 LEU A 71 25.715 -19.640 18.440 1.00 0.00 H new ATOM 1011 N SER A 72 27.170 -22.353 18.087 1.00 0.00 N ATOM 1012 CA SER A 72 28.571 -21.849 18.018 1.00 0.00 C ATOM 1013 C SER A 72 28.819 -21.179 16.663 1.00 0.00 C ATOM 1014 O SER A 72 29.848 -20.573 16.436 1.00 0.00 O ATOM 1015 CB SER A 72 29.445 -23.092 18.177 1.00 0.00 C ATOM 1016 OG SER A 72 30.416 -23.124 17.139 1.00 0.00 O ATOM 0 H SER A 72 26.896 -22.977 17.328 1.00 0.00 H new ATOM 0 HA SER A 72 28.786 -21.104 18.784 1.00 0.00 H new ATOM 0 HB2 SER A 72 29.937 -23.082 19.150 1.00 0.00 H new ATOM 0 HB3 SER A 72 28.829 -23.990 18.141 1.00 0.00 H new ATOM 0 HG SER A 72 30.978 -23.920 17.241 1.00 0.00 H new ATOM 1022 N SER A 73 27.881 -21.285 15.760 1.00 0.00 N ATOM 1023 CA SER A 73 28.058 -20.655 14.421 1.00 0.00 C ATOM 1024 C SER A 73 28.251 -19.146 14.571 1.00 0.00 C ATOM 1025 O SER A 73 29.352 -18.639 14.489 1.00 0.00 O ATOM 1026 CB SER A 73 26.764 -20.962 13.667 1.00 0.00 C ATOM 1027 OG SER A 73 26.566 -19.982 12.657 1.00 0.00 O ATOM 0 H SER A 73 27.000 -21.781 15.893 1.00 0.00 H new ATOM 0 HA SER A 73 28.934 -21.035 13.895 1.00 0.00 H new ATOM 0 HB2 SER A 73 26.816 -21.955 13.221 1.00 0.00 H new ATOM 0 HB3 SER A 73 25.920 -20.966 14.357 1.00 0.00 H new ATOM 0 HG SER A 73 25.738 -20.177 12.170 1.00 0.00 H new ATOM 1033 N GLY A 74 27.189 -18.425 14.792 1.00 0.00 N ATOM 1034 CA GLY A 74 27.313 -16.948 14.949 1.00 0.00 C ATOM 1035 C GLY A 74 26.006 -16.369 15.494 1.00 0.00 C ATOM 1036 O GLY A 74 25.097 -16.055 14.750 1.00 0.00 O ATOM 0 H GLY A 74 26.241 -18.793 14.871 1.00 0.00 H new ATOM 0 HA2 GLY A 74 28.135 -16.714 15.626 1.00 0.00 H new ATOM 0 HA3 GLY A 74 27.551 -16.490 13.989 1.00 0.00 H new ATOM 1040 N PHE A 75 25.906 -16.217 16.786 1.00 0.00 N ATOM 1041 CA PHE A 75 24.661 -15.648 17.374 1.00 0.00 C ATOM 1042 C PHE A 75 24.777 -14.121 17.445 1.00 0.00 C ATOM 1043 O PHE A 75 25.784 -13.546 17.085 1.00 0.00 O ATOM 1044 CB PHE A 75 24.551 -16.296 18.768 1.00 0.00 C ATOM 1045 CG PHE A 75 24.114 -15.287 19.808 1.00 0.00 C ATOM 1046 CD1 PHE A 75 25.005 -14.298 20.242 1.00 0.00 C ATOM 1047 CD2 PHE A 75 22.820 -15.343 20.337 1.00 0.00 C ATOM 1048 CE1 PHE A 75 24.600 -13.366 21.205 1.00 0.00 C ATOM 1049 CE2 PHE A 75 22.415 -14.412 21.299 1.00 0.00 C ATOM 1050 CZ PHE A 75 23.304 -13.423 21.733 1.00 0.00 C ATOM 0 H PHE A 75 26.632 -16.462 17.459 1.00 0.00 H new ATOM 0 HA PHE A 75 23.768 -15.854 16.783 1.00 0.00 H new ATOM 0 HB2 PHE A 75 23.837 -17.119 18.734 1.00 0.00 H new ATOM 0 HB3 PHE A 75 25.514 -16.721 19.052 1.00 0.00 H new ATOM 0 HD1 PHE A 75 26.004 -14.254 19.834 1.00 0.00 H new ATOM 0 HD2 PHE A 75 22.133 -16.106 20.002 1.00 0.00 H new ATOM 0 HE1 PHE A 75 25.287 -12.603 21.541 1.00 0.00 H new ATOM 0 HE2 PHE A 75 21.416 -14.457 21.707 1.00 0.00 H new ATOM 0 HZ PHE A 75 22.991 -12.703 22.475 1.00 0.00 H new ATOM 1060 N LYS A 76 23.748 -13.466 17.897 1.00 0.00 N ATOM 1061 CA LYS A 76 23.787 -11.979 17.982 1.00 0.00 C ATOM 1062 C LYS A 76 22.614 -11.467 18.821 1.00 0.00 C ATOM 1063 O LYS A 76 21.580 -12.099 18.913 1.00 0.00 O ATOM 1064 CB LYS A 76 23.657 -11.502 16.534 1.00 0.00 C ATOM 1065 CG LYS A 76 24.670 -10.388 16.262 1.00 0.00 C ATOM 1066 CD LYS A 76 24.132 -9.466 15.165 1.00 0.00 C ATOM 1067 CE LYS A 76 24.631 -8.039 15.406 1.00 0.00 C ATOM 1068 NZ LYS A 76 23.739 -7.479 16.464 1.00 0.00 N ATOM 0 H LYS A 76 22.878 -13.896 18.213 1.00 0.00 H new ATOM 0 HA LYS A 76 24.699 -11.614 18.455 1.00 0.00 H new ATOM 0 HB2 LYS A 76 23.826 -12.334 15.851 1.00 0.00 H new ATOM 0 HB3 LYS A 76 22.646 -11.139 16.350 1.00 0.00 H new ATOM 0 HG2 LYS A 76 24.854 -9.818 17.173 1.00 0.00 H new ATOM 0 HG3 LYS A 76 25.624 -10.816 15.956 1.00 0.00 H new ATOM 0 HD2 LYS A 76 24.461 -9.817 14.187 1.00 0.00 H new ATOM 0 HD3 LYS A 76 23.042 -9.486 15.161 1.00 0.00 H new ATOM 0 HE2 LYS A 76 25.672 -8.036 15.728 1.00 0.00 H new ATOM 0 HE3 LYS A 76 24.578 -7.445 14.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 23.186 -6.691 16.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 23.093 -8.221 16.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 24.316 -7.134 17.258 1.00 0.00 H new ATOM 1082 N ARG A 77 22.766 -10.325 19.432 1.00 0.00 N ATOM 1083 CA ARG A 77 21.661 -9.770 20.264 1.00 0.00 C ATOM 1084 C ARG A 77 20.331 -9.863 19.512 1.00 0.00 C ATOM 1085 O ARG A 77 19.293 -10.110 20.093 1.00 0.00 O ATOM 1086 CB ARG A 77 22.043 -8.309 20.501 1.00 0.00 C ATOM 1087 CG ARG A 77 23.175 -8.236 21.528 1.00 0.00 C ATOM 1088 CD ARG A 77 23.324 -6.797 22.024 1.00 0.00 C ATOM 1089 NE ARG A 77 24.124 -6.108 20.974 1.00 0.00 N ATOM 1090 CZ ARG A 77 25.334 -5.698 21.241 1.00 0.00 C ATOM 1091 NH1 ARG A 77 26.119 -6.425 21.987 1.00 0.00 N ATOM 1092 NH2 ARG A 77 25.757 -4.559 20.765 1.00 0.00 N ATOM 0 H ARG A 77 23.608 -9.751 19.391 1.00 0.00 H new ATOM 0 HA ARG A 77 21.533 -10.316 21.199 1.00 0.00 H new ATOM 0 HB2 ARG A 77 22.357 -7.848 19.565 1.00 0.00 H new ATOM 0 HB3 ARG A 77 21.178 -7.749 20.857 1.00 0.00 H new ATOM 0 HG2 ARG A 77 22.963 -8.900 22.366 1.00 0.00 H new ATOM 0 HG3 ARG A 77 24.109 -8.576 21.080 1.00 0.00 H new ATOM 0 HD2 ARG A 77 22.352 -6.322 22.155 1.00 0.00 H new ATOM 0 HD3 ARG A 77 23.828 -6.763 22.990 1.00 0.00 H new ATOM 0 HE ARG A 77 23.727 -5.957 20.047 1.00 0.00 H new ATOM 0 HH11 ARG A 77 25.787 -7.314 22.362 1.00 0.00 H new ATOM 0 HH12 ARG A 77 27.065 -6.105 22.196 1.00 0.00 H new ATOM 0 HH21 ARG A 77 25.142 -3.989 20.184 1.00 0.00 H new ATOM 0 HH22 ARG A 77 26.703 -4.239 20.974 1.00 0.00 H new ATOM 1106 N SER A 78 20.355 -9.663 18.223 1.00 0.00 N ATOM 1107 CA SER A 78 19.091 -9.736 17.432 1.00 0.00 C ATOM 1108 C SER A 78 19.362 -10.297 16.031 1.00 0.00 C ATOM 1109 O SER A 78 20.453 -10.190 15.508 1.00 0.00 O ATOM 1110 CB SER A 78 18.602 -8.291 17.337 1.00 0.00 C ATOM 1111 OG SER A 78 19.554 -7.521 16.615 1.00 0.00 O ATOM 0 H SER A 78 21.194 -9.452 17.682 1.00 0.00 H new ATOM 0 HA SER A 78 18.356 -10.392 17.898 1.00 0.00 H new ATOM 0 HB2 SER A 78 17.634 -8.254 16.838 1.00 0.00 H new ATOM 0 HB3 SER A 78 18.462 -7.876 18.335 1.00 0.00 H new ATOM 0 HG SER A 78 19.243 -6.594 16.550 1.00 0.00 H new ATOM 1117 N TYR A 79 18.371 -10.889 15.420 1.00 0.00 N ATOM 1118 CA TYR A 79 18.560 -11.452 14.051 1.00 0.00 C ATOM 1119 C TYR A 79 17.532 -10.840 13.095 1.00 0.00 C ATOM 1120 O TYR A 79 16.867 -9.878 13.423 1.00 0.00 O ATOM 1121 CB TYR A 79 18.310 -12.952 14.199 1.00 0.00 C ATOM 1122 CG TYR A 79 19.276 -13.541 15.197 1.00 0.00 C ATOM 1123 CD1 TYR A 79 19.075 -13.352 16.572 1.00 0.00 C ATOM 1124 CD2 TYR A 79 20.371 -14.286 14.745 1.00 0.00 C ATOM 1125 CE1 TYR A 79 19.972 -13.911 17.490 1.00 0.00 C ATOM 1126 CE2 TYR A 79 21.266 -14.842 15.664 1.00 0.00 C ATOM 1127 CZ TYR A 79 21.066 -14.655 17.034 1.00 0.00 C ATOM 1128 OH TYR A 79 21.949 -15.205 17.938 1.00 0.00 O ATOM 0 H TYR A 79 17.436 -11.007 15.811 1.00 0.00 H new ATOM 0 HA TYR A 79 19.551 -11.241 13.649 1.00 0.00 H new ATOM 0 HB2 TYR A 79 17.285 -13.128 14.526 1.00 0.00 H new ATOM 0 HB3 TYR A 79 18.426 -13.445 13.234 1.00 0.00 H new ATOM 0 HD1 TYR A 79 18.230 -12.777 16.922 1.00 0.00 H new ATOM 0 HD2 TYR A 79 20.525 -14.432 13.686 1.00 0.00 H new ATOM 0 HE1 TYR A 79 19.820 -13.768 18.550 1.00 0.00 H new ATOM 0 HE2 TYR A 79 22.112 -15.416 15.315 1.00 0.00 H new ATOM 0 HH TYR A 79 21.689 -14.947 18.847 1.00 0.00 H new ATOM 1138 N SER A 80 17.384 -11.393 11.919 1.00 0.00 N ATOM 1139 CA SER A 80 16.383 -10.834 10.966 1.00 0.00 C ATOM 1140 C SER A 80 16.202 -11.777 9.758 1.00 0.00 C ATOM 1141 O SER A 80 16.907 -11.664 8.777 1.00 0.00 O ATOM 1142 CB SER A 80 16.976 -9.500 10.514 1.00 0.00 C ATOM 1143 OG SER A 80 18.359 -9.671 10.237 1.00 0.00 O ATOM 0 H SER A 80 17.908 -12.200 11.581 1.00 0.00 H new ATOM 0 HA SER A 80 15.401 -10.716 11.424 1.00 0.00 H new ATOM 0 HB2 SER A 80 16.457 -9.141 9.625 1.00 0.00 H new ATOM 0 HB3 SER A 80 16.839 -8.747 11.290 1.00 0.00 H new ATOM 0 HG SER A 80 18.480 -10.433 9.633 1.00 0.00 H new ATOM 1149 N TYR A 81 15.264 -12.701 9.820 1.00 0.00 N ATOM 1150 CA TYR A 81 15.050 -13.653 8.674 1.00 0.00 C ATOM 1151 C TYR A 81 16.359 -14.395 8.358 1.00 0.00 C ATOM 1152 O TYR A 81 17.424 -13.816 8.312 1.00 0.00 O ATOM 1153 CB TYR A 81 14.606 -12.783 7.494 1.00 0.00 C ATOM 1154 CG TYR A 81 14.926 -13.465 6.184 1.00 0.00 C ATOM 1155 CD1 TYR A 81 14.214 -14.607 5.796 1.00 0.00 C ATOM 1156 CD2 TYR A 81 15.932 -12.953 5.358 1.00 0.00 C ATOM 1157 CE1 TYR A 81 14.511 -15.237 4.581 1.00 0.00 C ATOM 1158 CE2 TYR A 81 16.229 -13.582 4.144 1.00 0.00 C ATOM 1159 CZ TYR A 81 15.518 -14.724 3.755 1.00 0.00 C ATOM 1160 OH TYR A 81 15.812 -15.344 2.558 1.00 0.00 O ATOM 0 H TYR A 81 14.638 -12.837 10.614 1.00 0.00 H new ATOM 0 HA TYR A 81 14.304 -14.414 8.901 1.00 0.00 H new ATOM 0 HB2 TYR A 81 13.535 -12.591 7.559 1.00 0.00 H new ATOM 0 HB3 TYR A 81 15.106 -11.816 7.539 1.00 0.00 H new ATOM 0 HD1 TYR A 81 13.436 -15.001 6.433 1.00 0.00 H new ATOM 0 HD2 TYR A 81 16.480 -12.072 5.657 1.00 0.00 H new ATOM 0 HE1 TYR A 81 13.963 -16.118 4.281 1.00 0.00 H new ATOM 0 HE2 TYR A 81 17.006 -13.187 3.507 1.00 0.00 H new ATOM 0 HH TYR A 81 16.535 -14.859 2.107 1.00 0.00 H new ATOM 1170 N ASN A 82 16.287 -15.679 8.154 1.00 0.00 N ATOM 1171 CA ASN A 82 17.524 -16.455 7.860 1.00 0.00 C ATOM 1172 C ASN A 82 18.460 -16.434 9.073 1.00 0.00 C ATOM 1173 O ASN A 82 18.065 -16.783 10.165 1.00 0.00 O ATOM 1174 CB ASN A 82 18.166 -15.770 6.658 1.00 0.00 C ATOM 1175 CG ASN A 82 19.203 -16.707 6.035 1.00 0.00 C ATOM 1176 OD1 ASN A 82 18.985 -17.900 5.948 1.00 0.00 O ATOM 1177 ND2 ASN A 82 20.330 -16.216 5.600 1.00 0.00 N ATOM 0 H ASN A 82 15.426 -16.226 8.178 1.00 0.00 H new ATOM 0 HA ASN A 82 17.310 -17.502 7.646 1.00 0.00 H new ATOM 0 HB2 ASN A 82 17.404 -15.512 5.922 1.00 0.00 H new ATOM 0 HB3 ASN A 82 18.640 -14.838 6.966 1.00 0.00 H new ATOM 0 HD21 ASN A 82 21.029 -16.833 5.186 1.00 0.00 H new ATOM 0 HD22 ASN A 82 20.512 -15.215 5.673 1.00 0.00 H new ATOM 1184 N ASP A 83 19.695 -16.058 8.902 1.00 0.00 N ATOM 1185 CA ASP A 83 20.622 -16.064 10.064 1.00 0.00 C ATOM 1186 C ASP A 83 20.588 -17.444 10.721 1.00 0.00 C ATOM 1187 O ASP A 83 20.057 -17.621 11.799 1.00 0.00 O ATOM 1188 CB ASP A 83 20.089 -14.991 11.016 1.00 0.00 C ATOM 1189 CG ASP A 83 20.857 -13.686 10.801 1.00 0.00 C ATOM 1190 OD1 ASP A 83 22.074 -13.741 10.741 1.00 0.00 O ATOM 1191 OD2 ASP A 83 20.216 -12.653 10.700 1.00 0.00 O ATOM 0 H ASP A 83 20.099 -15.750 8.018 1.00 0.00 H new ATOM 0 HA ASP A 83 21.655 -15.859 9.783 1.00 0.00 H new ATOM 0 HB2 ASP A 83 19.025 -14.831 10.841 1.00 0.00 H new ATOM 0 HB3 ASP A 83 20.196 -15.322 12.049 1.00 0.00 H new ATOM 1196 N ASN A 84 21.136 -18.427 10.062 1.00 0.00 N ATOM 1197 CA ASN A 84 21.123 -19.807 10.622 1.00 0.00 C ATOM 1198 C ASN A 84 22.101 -19.940 11.796 1.00 0.00 C ATOM 1199 O ASN A 84 23.201 -19.426 11.760 1.00 0.00 O ATOM 1200 CB ASN A 84 21.564 -20.701 9.465 1.00 0.00 C ATOM 1201 CG ASN A 84 22.963 -20.287 9.003 1.00 0.00 C ATOM 1202 OD1 ASN A 84 23.289 -19.117 8.989 1.00 0.00 O ATOM 1203 ND2 ASN A 84 23.810 -21.205 8.622 1.00 0.00 N ATOM 0 H ASN A 84 21.594 -18.333 9.156 1.00 0.00 H new ATOM 0 HA ASN A 84 20.140 -20.075 11.009 1.00 0.00 H new ATOM 0 HB2 ASN A 84 21.567 -21.745 9.779 1.00 0.00 H new ATOM 0 HB3 ASN A 84 20.858 -20.619 8.639 1.00 0.00 H new ATOM 0 HD21 ASN A 84 24.745 -20.939 8.313 1.00 0.00 H new ATOM 0 HD22 ASN A 84 23.537 -22.188 8.634 1.00 0.00 H new ATOM 1210 N VAL A 85 21.717 -20.650 12.827 1.00 0.00 N ATOM 1211 CA VAL A 85 22.639 -20.840 13.986 1.00 0.00 C ATOM 1212 C VAL A 85 22.762 -22.331 14.320 1.00 0.00 C ATOM 1213 O VAL A 85 21.797 -22.985 14.663 1.00 0.00 O ATOM 1214 CB VAL A 85 22.028 -20.078 15.160 1.00 0.00 C ATOM 1215 CG1 VAL A 85 22.268 -18.580 14.973 1.00 0.00 C ATOM 1216 CG2 VAL A 85 20.525 -20.347 15.247 1.00 0.00 C ATOM 0 H VAL A 85 20.808 -21.104 12.915 1.00 0.00 H new ATOM 0 HA VAL A 85 23.639 -20.470 13.761 1.00 0.00 H new ATOM 0 HB VAL A 85 22.499 -20.416 16.083 1.00 0.00 H new ATOM 0 HG11 VAL A 85 21.832 -18.034 15.810 1.00 0.00 H new ATOM 0 HG12 VAL A 85 23.340 -18.386 14.931 1.00 0.00 H new ATOM 0 HG13 VAL A 85 21.803 -18.250 14.044 1.00 0.00 H new ATOM 0 HG21 VAL A 85 20.105 -19.797 16.089 1.00 0.00 H new ATOM 0 HG22 VAL A 85 20.043 -20.022 14.325 1.00 0.00 H new ATOM 0 HG23 VAL A 85 20.354 -21.414 15.390 1.00 0.00 H new ATOM 1226 N ASP A 86 23.947 -22.867 14.225 1.00 0.00 N ATOM 1227 CA ASP A 86 24.149 -24.315 14.540 1.00 0.00 C ATOM 1228 C ASP A 86 24.191 -24.503 16.054 1.00 0.00 C ATOM 1229 O ASP A 86 24.920 -23.827 16.749 1.00 0.00 O ATOM 1230 CB ASP A 86 25.496 -24.675 13.914 1.00 0.00 C ATOM 1231 CG ASP A 86 25.977 -26.014 14.475 1.00 0.00 C ATOM 1232 OD1 ASP A 86 25.472 -27.034 14.036 1.00 0.00 O ATOM 1233 OD2 ASP A 86 26.842 -25.996 15.335 1.00 0.00 O ATOM 0 H ASP A 86 24.789 -22.365 13.942 1.00 0.00 H new ATOM 0 HA ASP A 86 23.348 -24.946 14.155 1.00 0.00 H new ATOM 0 HB2 ASP A 86 25.401 -24.736 12.830 1.00 0.00 H new ATOM 0 HB3 ASP A 86 26.228 -23.896 14.126 1.00 0.00 H new ATOM 1238 N PHE A 87 23.398 -25.395 16.575 1.00 0.00 N ATOM 1239 CA PHE A 87 23.374 -25.589 18.049 1.00 0.00 C ATOM 1240 C PHE A 87 24.400 -26.619 18.512 1.00 0.00 C ATOM 1241 O PHE A 87 24.405 -27.761 18.097 1.00 0.00 O ATOM 1242 CB PHE A 87 21.949 -26.026 18.359 1.00 0.00 C ATOM 1243 CG PHE A 87 21.103 -24.783 18.371 1.00 0.00 C ATOM 1244 CD1 PHE A 87 21.256 -23.857 19.406 1.00 0.00 C ATOM 1245 CD2 PHE A 87 20.202 -24.534 17.331 1.00 0.00 C ATOM 1246 CE1 PHE A 87 20.510 -22.678 19.403 1.00 0.00 C ATOM 1247 CE2 PHE A 87 19.448 -23.356 17.333 1.00 0.00 C ATOM 1248 CZ PHE A 87 19.606 -22.428 18.368 1.00 0.00 C ATOM 0 H PHE A 87 22.767 -25.997 16.045 1.00 0.00 H new ATOM 0 HA PHE A 87 23.645 -24.677 18.580 1.00 0.00 H new ATOM 0 HB2 PHE A 87 21.589 -26.730 17.609 1.00 0.00 H new ATOM 0 HB3 PHE A 87 21.902 -26.534 19.322 1.00 0.00 H new ATOM 0 HD1 PHE A 87 21.952 -24.054 20.208 1.00 0.00 H new ATOM 0 HD2 PHE A 87 20.089 -25.249 16.529 1.00 0.00 H new ATOM 0 HE1 PHE A 87 20.631 -21.959 20.200 1.00 0.00 H new ATOM 0 HE2 PHE A 87 18.745 -23.163 16.537 1.00 0.00 H new ATOM 0 HZ PHE A 87 19.028 -21.516 18.367 1.00 0.00 H new ATOM 1258 N LYS A 88 25.264 -26.197 19.390 1.00 0.00 N ATOM 1259 CA LYS A 88 26.312 -27.092 19.938 1.00 0.00 C ATOM 1260 C LYS A 88 25.863 -27.648 21.290 1.00 0.00 C ATOM 1261 O LYS A 88 26.044 -27.021 22.315 1.00 0.00 O ATOM 1262 CB LYS A 88 27.516 -26.175 20.126 1.00 0.00 C ATOM 1263 CG LYS A 88 28.716 -26.745 19.366 1.00 0.00 C ATOM 1264 CD LYS A 88 29.891 -26.932 20.326 1.00 0.00 C ATOM 1265 CE LYS A 88 31.190 -26.536 19.621 1.00 0.00 C ATOM 1266 NZ LYS A 88 31.419 -27.605 18.610 1.00 0.00 N ATOM 0 H LYS A 88 25.286 -25.246 19.758 1.00 0.00 H new ATOM 0 HA LYS A 88 26.525 -27.944 19.292 1.00 0.00 H new ATOM 0 HB2 LYS A 88 27.284 -25.174 19.763 1.00 0.00 H new ATOM 0 HB3 LYS A 88 27.754 -26.082 21.186 1.00 0.00 H new ATOM 0 HG2 LYS A 88 28.451 -27.699 18.910 1.00 0.00 H new ATOM 0 HG3 LYS A 88 28.999 -26.073 18.556 1.00 0.00 H new ATOM 0 HD2 LYS A 88 29.747 -26.322 21.218 1.00 0.00 H new ATOM 0 HD3 LYS A 88 29.945 -27.970 20.655 1.00 0.00 H new ATOM 0 HE2 LYS A 88 31.101 -25.558 19.148 1.00 0.00 H new ATOM 0 HE3 LYS A 88 32.019 -26.475 20.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 32.399 -27.552 18.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 31.255 -28.535 19.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 30.764 -27.475 17.813 1.00 0.00 H new ATOM 1280 N CYS A 89 25.275 -28.810 21.308 1.00 0.00 N ATOM 1281 CA CYS A 89 24.821 -29.381 22.606 1.00 0.00 C ATOM 1282 C CYS A 89 25.908 -29.198 23.667 1.00 0.00 C ATOM 1283 O CYS A 89 27.056 -29.535 23.456 1.00 0.00 O ATOM 1284 CB CYS A 89 24.571 -30.861 22.332 1.00 0.00 C ATOM 1285 SG CYS A 89 22.984 -31.325 23.060 1.00 0.00 S ATOM 0 H CYS A 89 25.090 -29.386 20.487 1.00 0.00 H new ATOM 0 HA CYS A 89 23.924 -28.889 22.983 1.00 0.00 H new ATOM 0 HB2 CYS A 89 24.564 -31.051 21.259 1.00 0.00 H new ATOM 0 HB3 CYS A 89 25.373 -31.465 22.757 1.00 0.00 H new ATOM 1290 N LYS A 90 25.554 -28.659 24.804 1.00 0.00 N ATOM 1291 CA LYS A 90 26.567 -28.443 25.879 1.00 0.00 C ATOM 1292 C LYS A 90 27.521 -29.638 25.966 1.00 0.00 C ATOM 1293 O LYS A 90 28.583 -29.640 25.377 1.00 0.00 O ATOM 1294 CB LYS A 90 25.756 -28.307 27.168 1.00 0.00 C ATOM 1295 CG LYS A 90 25.526 -26.824 27.471 1.00 0.00 C ATOM 1296 CD LYS A 90 26.832 -26.197 27.969 1.00 0.00 C ATOM 1297 CE LYS A 90 26.849 -24.703 27.632 1.00 0.00 C ATOM 1298 NZ LYS A 90 27.357 -24.037 28.864 1.00 0.00 N ATOM 0 H LYS A 90 24.607 -28.359 25.035 1.00 0.00 H new ATOM 0 HA LYS A 90 27.183 -27.564 25.690 1.00 0.00 H new ATOM 0 HB2 LYS A 90 24.800 -28.821 27.065 1.00 0.00 H new ATOM 0 HB3 LYS A 90 26.285 -28.781 27.995 1.00 0.00 H new ATOM 0 HG2 LYS A 90 25.181 -26.308 26.575 1.00 0.00 H new ATOM 0 HG3 LYS A 90 24.746 -26.712 28.224 1.00 0.00 H new ATOM 0 HD2 LYS A 90 26.927 -26.338 29.046 1.00 0.00 H new ATOM 0 HD3 LYS A 90 27.685 -26.694 27.506 1.00 0.00 H new ATOM 0 HE2 LYS A 90 27.494 -24.498 26.778 1.00 0.00 H new ATOM 0 HE3 LYS A 90 25.853 -24.345 27.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 27.397 -23.009 28.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 26.719 -24.244 29.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 28.310 -24.392 29.083 1.00 0.00 H new ATOM 1312 N TYR A 91 27.152 -30.653 26.696 1.00 0.00 N ATOM 1313 CA TYR A 91 28.042 -31.845 26.816 1.00 0.00 C ATOM 1314 C TYR A 91 27.231 -33.071 27.249 1.00 0.00 C ATOM 1315 O TYR A 91 26.355 -32.984 28.085 1.00 0.00 O ATOM 1316 CB TYR A 91 29.062 -31.465 27.890 1.00 0.00 C ATOM 1317 CG TYR A 91 30.457 -31.739 27.381 1.00 0.00 C ATOM 1318 CD1 TYR A 91 30.916 -33.056 27.271 1.00 0.00 C ATOM 1319 CD2 TYR A 91 31.292 -30.675 27.017 1.00 0.00 C ATOM 1320 CE1 TYR A 91 32.208 -33.311 26.798 1.00 0.00 C ATOM 1321 CE2 TYR A 91 32.586 -30.930 26.543 1.00 0.00 C ATOM 1322 CZ TYR A 91 33.043 -32.249 26.433 1.00 0.00 C ATOM 1323 OH TYR A 91 34.318 -32.502 25.966 1.00 0.00 O ATOM 0 H TYR A 91 26.275 -30.710 27.214 1.00 0.00 H new ATOM 0 HA TYR A 91 28.521 -32.103 25.871 1.00 0.00 H new ATOM 0 HB2 TYR A 91 28.958 -30.411 28.148 1.00 0.00 H new ATOM 0 HB3 TYR A 91 28.877 -32.036 28.800 1.00 0.00 H new ATOM 0 HD1 TYR A 91 30.272 -33.877 27.551 1.00 0.00 H new ATOM 0 HD2 TYR A 91 30.939 -29.658 27.102 1.00 0.00 H new ATOM 0 HE1 TYR A 91 32.561 -34.328 26.715 1.00 0.00 H new ATOM 0 HE2 TYR A 91 33.230 -30.110 26.263 1.00 0.00 H new ATOM 0 HH TYR A 91 34.764 -31.655 25.756 1.00 0.00 H new ATOM 1333 N GLY A 92 27.516 -34.213 26.682 1.00 0.00 N ATOM 1334 CA GLY A 92 26.760 -35.443 27.059 1.00 0.00 C ATOM 1335 C GLY A 92 25.258 -35.172 26.955 1.00 0.00 C ATOM 1336 O GLY A 92 24.503 -35.452 27.864 1.00 0.00 O ATOM 0 H GLY A 92 28.239 -34.347 25.975 1.00 0.00 H new ATOM 0 HA2 GLY A 92 27.037 -36.268 26.403 1.00 0.00 H new ATOM 0 HA3 GLY A 92 27.017 -35.743 28.075 1.00 0.00 H new ATOM 1340 N TYR A 93 24.822 -34.624 25.854 1.00 0.00 N ATOM 1341 CA TYR A 93 23.371 -34.320 25.679 1.00 0.00 C ATOM 1342 C TYR A 93 23.031 -34.283 24.184 1.00 0.00 C ATOM 1343 O TYR A 93 23.846 -33.905 23.365 1.00 0.00 O ATOM 1344 CB TYR A 93 23.192 -32.938 26.307 1.00 0.00 C ATOM 1345 CG TYR A 93 23.215 -33.038 27.817 1.00 0.00 C ATOM 1346 CD1 TYR A 93 22.474 -34.029 28.474 1.00 0.00 C ATOM 1347 CD2 TYR A 93 23.982 -32.131 28.560 1.00 0.00 C ATOM 1348 CE1 TYR A 93 22.505 -34.112 29.874 1.00 0.00 C ATOM 1349 CE2 TYR A 93 24.011 -32.215 29.957 1.00 0.00 C ATOM 1350 CZ TYR A 93 23.273 -33.205 30.614 1.00 0.00 C ATOM 1351 OH TYR A 93 23.303 -33.288 31.991 1.00 0.00 O ATOM 0 H TYR A 93 25.412 -34.371 25.061 1.00 0.00 H new ATOM 0 HA TYR A 93 22.720 -35.064 26.138 1.00 0.00 H new ATOM 0 HB2 TYR A 93 23.986 -32.272 25.968 1.00 0.00 H new ATOM 0 HB3 TYR A 93 22.248 -32.502 25.979 1.00 0.00 H new ATOM 0 HD1 TYR A 93 21.880 -34.728 27.904 1.00 0.00 H new ATOM 0 HD2 TYR A 93 24.552 -31.366 28.054 1.00 0.00 H new ATOM 0 HE1 TYR A 93 21.936 -34.877 30.382 1.00 0.00 H new ATOM 0 HE2 TYR A 93 24.603 -31.515 30.528 1.00 0.00 H new ATOM 0 HH TYR A 93 23.885 -32.585 32.348 1.00 0.00 H new ATOM 1361 N LYS A 94 21.840 -34.674 23.816 1.00 0.00 N ATOM 1362 CA LYS A 94 21.465 -34.658 22.370 1.00 0.00 C ATOM 1363 C LYS A 94 20.525 -33.485 22.079 1.00 0.00 C ATOM 1364 O LYS A 94 19.751 -33.074 22.920 1.00 0.00 O ATOM 1365 CB LYS A 94 20.756 -35.992 22.126 1.00 0.00 C ATOM 1366 CG LYS A 94 21.321 -36.646 20.862 1.00 0.00 C ATOM 1367 CD LYS A 94 20.263 -37.560 20.238 1.00 0.00 C ATOM 1368 CE LYS A 94 20.360 -38.954 20.862 1.00 0.00 C ATOM 1369 NZ LYS A 94 19.520 -39.823 19.991 1.00 0.00 N ATOM 0 H LYS A 94 21.112 -35.003 24.451 1.00 0.00 H new ATOM 0 HA LYS A 94 22.332 -34.536 21.721 1.00 0.00 H new ATOM 0 HB2 LYS A 94 20.894 -36.652 22.983 1.00 0.00 H new ATOM 0 HB3 LYS A 94 19.683 -35.832 22.017 1.00 0.00 H new ATOM 0 HG2 LYS A 94 21.621 -35.880 20.147 1.00 0.00 H new ATOM 0 HG3 LYS A 94 22.214 -37.221 21.106 1.00 0.00 H new ATOM 0 HD2 LYS A 94 19.268 -37.146 20.400 1.00 0.00 H new ATOM 0 HD3 LYS A 94 20.411 -37.622 19.160 1.00 0.00 H new ATOM 0 HE2 LYS A 94 21.392 -39.303 20.891 1.00 0.00 H new ATOM 0 HE3 LYS A 94 19.995 -38.953 21.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 19.536 -40.797 20.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 18.542 -39.470 19.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 19.895 -39.809 19.021 1.00 0.00 H new ATOM 1383 N LEU A 95 20.590 -32.940 20.895 1.00 0.00 N ATOM 1384 CA LEU A 95 19.702 -31.789 20.557 1.00 0.00 C ATOM 1385 C LEU A 95 18.341 -32.283 20.070 1.00 0.00 C ATOM 1386 O LEU A 95 18.116 -32.436 18.886 1.00 0.00 O ATOM 1387 CB LEU A 95 20.416 -31.044 19.428 1.00 0.00 C ATOM 1388 CG LEU A 95 21.586 -30.242 19.994 1.00 0.00 C ATOM 1389 CD1 LEU A 95 22.841 -30.521 19.164 1.00 0.00 C ATOM 1390 CD2 LEU A 95 21.256 -28.748 19.932 1.00 0.00 C ATOM 0 H LEU A 95 21.217 -33.240 20.149 1.00 0.00 H new ATOM 0 HA LEU A 95 19.523 -31.154 21.425 1.00 0.00 H new ATOM 0 HB2 LEU A 95 20.776 -31.754 18.683 1.00 0.00 H new ATOM 0 HB3 LEU A 95 19.718 -30.377 18.922 1.00 0.00 H new ATOM 0 HG LEU A 95 21.761 -30.533 21.030 1.00 0.00 H new ATOM 0 HD11 LEU A 95 23.678 -29.950 19.566 1.00 0.00 H new ATOM 0 HD12 LEU A 95 23.075 -31.585 19.205 1.00 0.00 H new ATOM 0 HD13 LEU A 95 22.665 -30.228 18.129 1.00 0.00 H new ATOM 0 HD21 LEU A 95 22.090 -28.174 20.336 1.00 0.00 H new ATOM 0 HD22 LEU A 95 21.082 -28.456 18.896 1.00 0.00 H new ATOM 0 HD23 LEU A 95 20.360 -28.549 20.520 1.00 0.00 H new ATOM 1402 N SER A 96 17.425 -32.518 20.965 1.00 0.00 N ATOM 1403 CA SER A 96 16.080 -32.981 20.530 1.00 0.00 C ATOM 1404 C SER A 96 15.351 -31.830 19.833 1.00 0.00 C ATOM 1405 O SER A 96 14.909 -30.892 20.465 1.00 0.00 O ATOM 1406 CB SER A 96 15.355 -33.382 21.813 1.00 0.00 C ATOM 1407 OG SER A 96 13.964 -33.125 21.666 1.00 0.00 O ATOM 0 H SER A 96 17.548 -32.411 21.972 1.00 0.00 H new ATOM 0 HA SER A 96 16.129 -33.813 19.827 1.00 0.00 H new ATOM 0 HB2 SER A 96 15.521 -34.439 22.023 1.00 0.00 H new ATOM 0 HB3 SER A 96 15.753 -32.822 22.659 1.00 0.00 H new ATOM 0 HG SER A 96 13.495 -33.383 22.487 1.00 0.00 H new ATOM 1413 N GLY A 97 15.233 -31.887 18.534 1.00 0.00 N ATOM 1414 CA GLY A 97 14.541 -30.789 17.803 1.00 0.00 C ATOM 1415 C GLY A 97 15.288 -30.476 16.504 1.00 0.00 C ATOM 1416 O GLY A 97 14.970 -30.997 15.453 1.00 0.00 O ATOM 0 H GLY A 97 15.585 -32.645 17.949 1.00 0.00 H new ATOM 0 HA2 GLY A 97 13.514 -31.079 17.581 1.00 0.00 H new ATOM 0 HA3 GLY A 97 14.493 -29.898 18.429 1.00 0.00 H new ATOM 1420 N SER A 98 16.275 -29.623 16.564 1.00 0.00 N ATOM 1421 CA SER A 98 17.034 -29.272 15.326 1.00 0.00 C ATOM 1422 C SER A 98 18.372 -28.613 15.680 1.00 0.00 C ATOM 1423 O SER A 98 18.418 -27.539 16.248 1.00 0.00 O ATOM 1424 CB SER A 98 16.133 -28.285 14.590 1.00 0.00 C ATOM 1425 OG SER A 98 15.906 -28.754 13.267 1.00 0.00 O ATOM 0 H SER A 98 16.589 -29.154 17.414 1.00 0.00 H new ATOM 0 HA SER A 98 17.269 -30.150 14.724 1.00 0.00 H new ATOM 0 HB2 SER A 98 15.185 -28.177 15.118 1.00 0.00 H new ATOM 0 HB3 SER A 98 16.598 -27.300 14.564 1.00 0.00 H new ATOM 0 HG SER A 98 14.974 -29.045 13.178 1.00 0.00 H new ATOM 1431 N SER A 99 19.462 -29.249 15.343 1.00 0.00 N ATOM 1432 CA SER A 99 20.800 -28.665 15.656 1.00 0.00 C ATOM 1433 C SER A 99 21.011 -27.356 14.898 1.00 0.00 C ATOM 1434 O SER A 99 21.551 -26.407 15.424 1.00 0.00 O ATOM 1435 CB SER A 99 21.807 -29.719 15.194 1.00 0.00 C ATOM 1436 OG SER A 99 21.489 -30.967 15.795 1.00 0.00 O ATOM 0 H SER A 99 19.484 -30.149 14.864 1.00 0.00 H new ATOM 0 HA SER A 99 20.905 -28.430 16.715 1.00 0.00 H new ATOM 0 HB2 SER A 99 21.784 -29.809 14.108 1.00 0.00 H new ATOM 0 HB3 SER A 99 22.818 -29.417 15.468 1.00 0.00 H new ATOM 0 HG SER A 99 22.132 -31.645 15.500 1.00 0.00 H new ATOM 1442 N SER A 100 20.599 -27.293 13.668 1.00 0.00 N ATOM 1443 CA SER A 100 20.795 -26.036 12.892 1.00 0.00 C ATOM 1444 C SER A 100 19.465 -25.310 12.690 1.00 0.00 C ATOM 1445 O SER A 100 18.558 -25.815 12.060 1.00 0.00 O ATOM 1446 CB SER A 100 21.372 -26.483 11.553 1.00 0.00 C ATOM 1447 OG SER A 100 20.334 -27.034 10.754 1.00 0.00 O ATOM 0 H SER A 100 20.137 -28.051 13.165 1.00 0.00 H new ATOM 0 HA SER A 100 21.453 -25.337 13.409 1.00 0.00 H new ATOM 0 HB2 SER A 100 21.830 -25.637 11.041 1.00 0.00 H new ATOM 0 HB3 SER A 100 22.157 -27.223 11.711 1.00 0.00 H new ATOM 0 HG SER A 100 19.492 -27.019 11.255 1.00 0.00 H new ATOM 1453 N SER A 101 19.350 -24.121 13.215 1.00 0.00 N ATOM 1454 CA SER A 101 18.086 -23.350 13.049 1.00 0.00 C ATOM 1455 C SER A 101 18.366 -22.050 12.319 1.00 0.00 C ATOM 1456 O SER A 101 19.444 -21.840 11.801 1.00 0.00 O ATOM 1457 CB SER A 101 17.588 -23.074 14.464 1.00 0.00 C ATOM 1458 OG SER A 101 17.584 -24.287 15.204 1.00 0.00 O ATOM 0 H SER A 101 20.078 -23.650 13.752 1.00 0.00 H new ATOM 0 HA SER A 101 17.345 -23.896 12.464 1.00 0.00 H new ATOM 0 HB2 SER A 101 18.229 -22.339 14.951 1.00 0.00 H new ATOM 0 HB3 SER A 101 16.584 -22.650 14.433 1.00 0.00 H new ATOM 0 HG SER A 101 18.350 -24.300 15.815 1.00 0.00 H new ATOM 1464 N THR A 102 17.403 -21.180 12.254 1.00 0.00 N ATOM 1465 CA THR A 102 17.631 -19.910 11.529 1.00 0.00 C ATOM 1466 C THR A 102 16.581 -18.860 11.898 1.00 0.00 C ATOM 1467 O THR A 102 15.395 -19.130 11.933 1.00 0.00 O ATOM 1468 CB THR A 102 17.522 -20.301 10.058 1.00 0.00 C ATOM 1469 OG1 THR A 102 18.277 -21.481 9.821 1.00 0.00 O ATOM 1470 CG2 THR A 102 18.062 -19.168 9.203 1.00 0.00 C ATOM 0 H THR A 102 16.477 -21.293 12.668 1.00 0.00 H new ATOM 0 HA THR A 102 18.592 -19.459 11.775 1.00 0.00 H new ATOM 0 HB THR A 102 16.479 -20.488 9.803 1.00 0.00 H new ATOM 0 HG1 THR A 102 19.146 -21.408 10.268 1.00 0.00 H new ATOM 0 HG21 THR A 102 17.988 -19.440 8.150 1.00 0.00 H new ATOM 0 HG22 THR A 102 17.481 -18.265 9.387 1.00 0.00 H new ATOM 0 HG23 THR A 102 19.106 -18.986 9.458 1.00 0.00 H new ATOM 1478 N CYS A 103 17.018 -17.655 12.157 1.00 0.00 N ATOM 1479 CA CYS A 103 16.065 -16.565 12.504 1.00 0.00 C ATOM 1480 C CYS A 103 15.138 -16.322 11.313 1.00 0.00 C ATOM 1481 O CYS A 103 15.435 -15.548 10.429 1.00 0.00 O ATOM 1482 CB CYS A 103 16.957 -15.346 12.781 1.00 0.00 C ATOM 1483 SG CYS A 103 16.039 -13.808 12.491 1.00 0.00 S ATOM 0 H CYS A 103 18.000 -17.380 12.142 1.00 0.00 H new ATOM 0 HA CYS A 103 15.432 -16.792 13.361 1.00 0.00 H new ATOM 0 HB2 CYS A 103 17.313 -15.375 13.811 1.00 0.00 H new ATOM 0 HB3 CYS A 103 17.837 -15.378 12.138 1.00 0.00 H new ATOM 1488 N SER A 104 14.031 -16.997 11.276 1.00 0.00 N ATOM 1489 CA SER A 104 13.091 -16.836 10.132 1.00 0.00 C ATOM 1490 C SER A 104 12.512 -15.435 10.063 1.00 0.00 C ATOM 1491 O SER A 104 12.697 -14.626 10.950 1.00 0.00 O ATOM 1492 CB SER A 104 11.997 -17.873 10.386 1.00 0.00 C ATOM 1493 OG SER A 104 12.581 -19.039 10.953 1.00 0.00 O ATOM 0 H SER A 104 13.731 -17.659 11.992 1.00 0.00 H new ATOM 0 HA SER A 104 13.593 -16.983 9.176 1.00 0.00 H new ATOM 0 HB2 SER A 104 11.242 -17.466 11.059 1.00 0.00 H new ATOM 0 HB3 SER A 104 11.491 -18.122 9.453 1.00 0.00 H new ATOM 0 HG SER A 104 13.244 -19.408 10.332 1.00 0.00 H new ATOM 1499 N PRO A 105 11.843 -15.200 8.969 1.00 0.00 N ATOM 1500 CA PRO A 105 11.236 -13.886 8.713 1.00 0.00 C ATOM 1501 C PRO A 105 9.907 -13.718 9.452 1.00 0.00 C ATOM 1502 O PRO A 105 9.023 -13.011 9.010 1.00 0.00 O ATOM 1503 CB PRO A 105 11.029 -13.877 7.213 1.00 0.00 C ATOM 1504 CG PRO A 105 10.931 -15.317 6.808 1.00 0.00 C ATOM 1505 CD PRO A 105 11.599 -16.142 7.874 1.00 0.00 C ATOM 0 HA PRO A 105 11.861 -13.065 9.065 1.00 0.00 H new ATOM 0 HB2 PRO A 105 10.123 -13.333 6.946 1.00 0.00 H new ATOM 0 HB3 PRO A 105 11.858 -13.383 6.706 1.00 0.00 H new ATOM 0 HG2 PRO A 105 9.888 -15.612 6.695 1.00 0.00 H new ATOM 0 HG3 PRO A 105 11.413 -15.476 5.844 1.00 0.00 H new ATOM 0 HD2 PRO A 105 10.962 -16.967 8.195 1.00 0.00 H new ATOM 0 HD3 PRO A 105 12.529 -16.580 7.512 1.00 0.00 H new ATOM 1513 N GLY A 106 9.765 -14.342 10.581 1.00 0.00 N ATOM 1514 CA GLY A 106 8.513 -14.196 11.359 1.00 0.00 C ATOM 1515 C GLY A 106 8.887 -13.862 12.801 1.00 0.00 C ATOM 1516 O GLY A 106 8.068 -13.911 13.696 1.00 0.00 O ATOM 0 H GLY A 106 10.467 -14.951 11.001 1.00 0.00 H new ATOM 0 HA2 GLY A 106 7.891 -13.408 10.935 1.00 0.00 H new ATOM 0 HA3 GLY A 106 7.931 -15.117 11.320 1.00 0.00 H new ATOM 1520 N ASN A 107 10.133 -13.526 13.025 1.00 0.00 N ATOM 1521 CA ASN A 107 10.595 -13.187 14.404 1.00 0.00 C ATOM 1522 C ASN A 107 10.658 -14.450 15.267 1.00 0.00 C ATOM 1523 O ASN A 107 9.878 -14.627 16.181 1.00 0.00 O ATOM 1524 CB ASN A 107 9.557 -12.203 14.958 1.00 0.00 C ATOM 1525 CG ASN A 107 9.151 -11.210 13.865 1.00 0.00 C ATOM 1526 OD1 ASN A 107 9.892 -10.301 13.548 1.00 0.00 O ATOM 1527 ND2 ASN A 107 7.996 -11.346 13.273 1.00 0.00 N ATOM 0 H ASN A 107 10.854 -13.472 12.306 1.00 0.00 H new ATOM 0 HA ASN A 107 11.595 -12.753 14.402 1.00 0.00 H new ATOM 0 HB2 ASN A 107 8.681 -12.746 15.313 1.00 0.00 H new ATOM 0 HB3 ASN A 107 9.969 -11.668 15.814 1.00 0.00 H new ATOM 0 HD21 ASN A 107 7.716 -10.689 12.545 1.00 0.00 H new ATOM 0 HD22 ASN A 107 7.373 -12.109 13.539 1.00 0.00 H new ATOM 1534 N THR A 108 11.582 -15.332 14.982 1.00 0.00 N ATOM 1535 CA THR A 108 11.690 -16.582 15.788 1.00 0.00 C ATOM 1536 C THR A 108 12.905 -17.412 15.363 1.00 0.00 C ATOM 1537 O THR A 108 13.805 -16.929 14.706 1.00 0.00 O ATOM 1538 CB THR A 108 10.403 -17.346 15.498 1.00 0.00 C ATOM 1539 OG1 THR A 108 9.824 -16.861 14.294 1.00 0.00 O ATOM 1540 CG2 THR A 108 9.433 -17.141 16.654 1.00 0.00 C ATOM 0 H THR A 108 12.263 -15.240 14.229 1.00 0.00 H new ATOM 0 HA THR A 108 11.820 -16.367 16.849 1.00 0.00 H new ATOM 0 HB THR A 108 10.621 -18.408 15.387 1.00 0.00 H new ATOM 0 HG1 THR A 108 8.998 -17.353 14.107 1.00 0.00 H new ATOM 0 HG21 THR A 108 8.509 -17.684 16.455 1.00 0.00 H new ATOM 0 HG22 THR A 108 9.881 -17.513 17.575 1.00 0.00 H new ATOM 0 HG23 THR A 108 9.213 -16.079 16.761 1.00 0.00 H new ATOM 1548 N TRP A 109 12.928 -18.664 15.739 1.00 0.00 N ATOM 1549 CA TRP A 109 14.073 -19.542 15.369 1.00 0.00 C ATOM 1550 C TRP A 109 13.561 -20.876 14.827 1.00 0.00 C ATOM 1551 O TRP A 109 13.322 -21.812 15.565 1.00 0.00 O ATOM 1552 CB TRP A 109 14.858 -19.731 16.663 1.00 0.00 C ATOM 1553 CG TRP A 109 15.814 -18.594 16.793 1.00 0.00 C ATOM 1554 CD1 TRP A 109 15.775 -17.639 17.751 1.00 0.00 C ATOM 1555 CD2 TRP A 109 16.947 -18.274 15.942 1.00 0.00 C ATOM 1556 NE1 TRP A 109 16.800 -16.740 17.524 1.00 0.00 N ATOM 1557 CE2 TRP A 109 17.559 -17.097 16.427 1.00 0.00 C ATOM 1558 CE3 TRP A 109 17.498 -18.888 14.806 1.00 0.00 C ATOM 1559 CZ2 TRP A 109 18.678 -16.547 15.803 1.00 0.00 C ATOM 1560 CZ3 TRP A 109 18.628 -18.340 14.180 1.00 0.00 C ATOM 1561 CH2 TRP A 109 19.218 -17.174 14.677 1.00 0.00 C ATOM 0 H TRP A 109 12.198 -19.117 16.289 1.00 0.00 H new ATOM 0 HA TRP A 109 14.696 -19.111 14.585 1.00 0.00 H new ATOM 0 HB2 TRP A 109 14.182 -19.760 17.518 1.00 0.00 H new ATOM 0 HB3 TRP A 109 15.394 -20.680 16.648 1.00 0.00 H new ATOM 0 HD1 TRP A 109 15.061 -17.588 18.560 1.00 0.00 H new ATOM 0 HE1 TRP A 109 16.974 -15.914 18.097 1.00 0.00 H new ATOM 0 HE3 TRP A 109 17.049 -19.788 14.411 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 19.125 -15.642 16.188 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 19.045 -18.822 13.308 1.00 0.00 H new ATOM 0 HH2 TRP A 109 20.089 -16.759 14.192 1.00 0.00 H new ATOM 1572 N LYS A 110 13.386 -20.965 13.535 1.00 0.00 N ATOM 1573 CA LYS A 110 12.883 -22.232 12.934 1.00 0.00 C ATOM 1574 C LYS A 110 14.033 -22.987 12.251 1.00 0.00 C ATOM 1575 O LYS A 110 14.916 -22.372 11.686 1.00 0.00 O ATOM 1576 CB LYS A 110 11.840 -21.793 11.904 1.00 0.00 C ATOM 1577 CG LYS A 110 10.719 -21.026 12.610 1.00 0.00 C ATOM 1578 CD LYS A 110 9.406 -21.803 12.487 1.00 0.00 C ATOM 1579 CE LYS A 110 8.894 -22.169 13.882 1.00 0.00 C ATOM 1580 NZ LYS A 110 9.230 -23.610 14.048 1.00 0.00 N ATOM 0 H LYS A 110 13.570 -20.213 12.870 1.00 0.00 H new ATOM 0 HA LYS A 110 12.461 -22.906 13.679 1.00 0.00 H new ATOM 0 HB2 LYS A 110 12.305 -21.163 11.145 1.00 0.00 H new ATOM 0 HB3 LYS A 110 11.432 -22.663 11.390 1.00 0.00 H new ATOM 0 HG2 LYS A 110 10.970 -20.881 13.661 1.00 0.00 H new ATOM 0 HG3 LYS A 110 10.609 -20.035 12.169 1.00 0.00 H new ATOM 0 HD2 LYS A 110 8.664 -21.202 11.962 1.00 0.00 H new ATOM 0 HD3 LYS A 110 9.560 -22.706 11.896 1.00 0.00 H new ATOM 0 HE2 LYS A 110 9.372 -21.561 14.650 1.00 0.00 H new ATOM 0 HE3 LYS A 110 7.820 -22.002 13.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 9.132 -23.876 15.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 8.584 -24.186 13.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 10.209 -23.776 13.740 1.00 0.00 H new ATOM 1594 N PRO A 111 13.989 -24.299 12.313 1.00 0.00 N ATOM 1595 CA PRO A 111 12.891 -25.018 13.016 1.00 0.00 C ATOM 1596 C PRO A 111 13.003 -24.852 14.538 1.00 0.00 C ATOM 1597 O PRO A 111 13.990 -24.364 15.053 1.00 0.00 O ATOM 1598 CB PRO A 111 13.100 -26.474 12.610 1.00 0.00 C ATOM 1599 CG PRO A 111 14.548 -26.572 12.264 1.00 0.00 C ATOM 1600 CD PRO A 111 14.959 -25.230 11.724 1.00 0.00 C ATOM 0 HA PRO A 111 11.903 -24.639 12.752 1.00 0.00 H new ATOM 0 HB2 PRO A 111 12.841 -27.152 13.423 1.00 0.00 H new ATOM 0 HB3 PRO A 111 12.472 -26.741 11.760 1.00 0.00 H new ATOM 0 HG2 PRO A 111 15.138 -26.832 13.143 1.00 0.00 H new ATOM 0 HG3 PRO A 111 14.716 -27.354 11.524 1.00 0.00 H new ATOM 0 HD2 PRO A 111 15.980 -24.979 12.013 1.00 0.00 H new ATOM 0 HD3 PRO A 111 14.922 -25.209 10.635 1.00 0.00 H new ATOM 1608 N GLU A 112 11.979 -25.242 15.249 1.00 0.00 N ATOM 1609 CA GLU A 112 11.976 -25.104 16.737 1.00 0.00 C ATOM 1610 C GLU A 112 13.369 -25.334 17.334 1.00 0.00 C ATOM 1611 O GLU A 112 14.006 -26.339 17.089 1.00 0.00 O ATOM 1612 CB GLU A 112 11.008 -26.183 17.223 1.00 0.00 C ATOM 1613 CG GLU A 112 10.136 -25.619 18.347 1.00 0.00 C ATOM 1614 CD GLU A 112 8.943 -24.875 17.743 1.00 0.00 C ATOM 1615 OE1 GLU A 112 9.108 -24.292 16.684 1.00 0.00 O ATOM 1616 OE2 GLU A 112 7.885 -24.900 18.350 1.00 0.00 O ATOM 0 H GLU A 112 11.133 -25.656 14.858 1.00 0.00 H new ATOM 0 HA GLU A 112 11.682 -24.100 17.042 1.00 0.00 H new ATOM 0 HB2 GLU A 112 10.382 -26.523 16.398 1.00 0.00 H new ATOM 0 HB3 GLU A 112 11.563 -27.051 17.580 1.00 0.00 H new ATOM 0 HG2 GLU A 112 9.787 -26.426 18.991 1.00 0.00 H new ATOM 0 HG3 GLU A 112 10.721 -24.944 18.972 1.00 0.00 H new ATOM 1623 N LEU A 113 13.831 -24.409 18.135 1.00 0.00 N ATOM 1624 CA LEU A 113 15.169 -24.565 18.777 1.00 0.00 C ATOM 1625 C LEU A 113 15.343 -26.001 19.262 1.00 0.00 C ATOM 1626 O LEU A 113 14.408 -26.621 19.729 1.00 0.00 O ATOM 1627 CB LEU A 113 15.141 -23.601 19.966 1.00 0.00 C ATOM 1628 CG LEU A 113 16.147 -22.455 19.766 1.00 0.00 C ATOM 1629 CD1 LEU A 113 16.217 -22.046 18.290 1.00 0.00 C ATOM 1630 CD2 LEU A 113 15.702 -21.250 20.597 1.00 0.00 C ATOM 0 H LEU A 113 13.337 -23.549 18.373 1.00 0.00 H new ATOM 0 HA LEU A 113 15.992 -24.352 18.094 1.00 0.00 H new ATOM 0 HB2 LEU A 113 14.137 -23.193 20.085 1.00 0.00 H new ATOM 0 HB3 LEU A 113 15.376 -24.141 20.883 1.00 0.00 H new ATOM 0 HG LEU A 113 17.133 -22.794 20.083 1.00 0.00 H new ATOM 0 HD11 LEU A 113 16.934 -21.234 18.171 1.00 0.00 H new ATOM 0 HD12 LEU A 113 16.533 -22.900 17.690 1.00 0.00 H new ATOM 0 HD13 LEU A 113 15.234 -21.713 17.958 1.00 0.00 H new ATOM 0 HD21 LEU A 113 16.410 -20.433 20.461 1.00 0.00 H new ATOM 0 HD22 LEU A 113 14.712 -20.930 20.273 1.00 0.00 H new ATOM 0 HD23 LEU A 113 15.667 -21.528 21.650 1.00 0.00 H new ATOM 1642 N PRO A 114 16.544 -26.479 19.131 1.00 0.00 N ATOM 1643 CA PRO A 114 16.863 -27.859 19.557 1.00 0.00 C ATOM 1644 C PRO A 114 16.865 -27.972 21.082 1.00 0.00 C ATOM 1645 O PRO A 114 16.805 -26.987 21.791 1.00 0.00 O ATOM 1646 CB PRO A 114 18.259 -28.092 18.987 1.00 0.00 C ATOM 1647 CG PRO A 114 18.851 -26.729 18.827 1.00 0.00 C ATOM 1648 CD PRO A 114 17.709 -25.781 18.580 1.00 0.00 C ATOM 0 HA PRO A 114 16.136 -28.592 19.209 1.00 0.00 H new ATOM 0 HB2 PRO A 114 18.860 -28.706 19.657 1.00 0.00 H new ATOM 0 HB3 PRO A 114 18.212 -28.615 18.032 1.00 0.00 H new ATOM 0 HG2 PRO A 114 19.405 -26.441 19.721 1.00 0.00 H new ATOM 0 HG3 PRO A 114 19.555 -26.709 17.995 1.00 0.00 H new ATOM 0 HD2 PRO A 114 17.871 -24.823 19.074 1.00 0.00 H new ATOM 0 HD3 PRO A 114 17.585 -25.574 17.517 1.00 0.00 H new ATOM 1656 N LYS A 115 16.931 -29.171 21.591 1.00 0.00 N ATOM 1657 CA LYS A 115 16.939 -29.357 23.069 1.00 0.00 C ATOM 1658 C LYS A 115 18.082 -30.288 23.476 1.00 0.00 C ATOM 1659 O LYS A 115 18.025 -31.482 23.261 1.00 0.00 O ATOM 1660 CB LYS A 115 15.587 -29.991 23.394 1.00 0.00 C ATOM 1661 CG LYS A 115 15.269 -29.784 24.875 1.00 0.00 C ATOM 1662 CD LYS A 115 13.789 -29.431 25.034 1.00 0.00 C ATOM 1663 CE LYS A 115 13.244 -30.080 26.307 1.00 0.00 C ATOM 1664 NZ LYS A 115 14.263 -29.789 27.354 1.00 0.00 N ATOM 0 H LYS A 115 16.980 -30.032 21.046 1.00 0.00 H new ATOM 0 HA LYS A 115 17.088 -28.419 23.605 1.00 0.00 H new ATOM 0 HB2 LYS A 115 14.807 -29.545 22.778 1.00 0.00 H new ATOM 0 HB3 LYS A 115 15.607 -31.056 23.161 1.00 0.00 H new ATOM 0 HG2 LYS A 115 15.501 -30.688 25.438 1.00 0.00 H new ATOM 0 HG3 LYS A 115 15.890 -28.987 25.283 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.665 -28.349 25.083 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.226 -29.777 24.167 1.00 0.00 H new ATOM 0 HE2 LYS A 115 12.272 -29.666 26.576 1.00 0.00 H new ATOM 0 HE3 LYS A 115 13.108 -31.154 26.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 13.796 -29.706 28.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 14.959 -30.561 27.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 14.747 -28.896 27.129 1.00 0.00 H new ATOM 1678 N CYS A 116 19.119 -29.756 24.068 1.00 0.00 N ATOM 1679 CA CYS A 116 20.254 -30.625 24.490 1.00 0.00 C ATOM 1680 C CYS A 116 19.774 -31.578 25.581 1.00 0.00 C ATOM 1681 O CYS A 116 20.071 -31.417 26.749 1.00 0.00 O ATOM 1682 CB CYS A 116 21.313 -29.658 25.017 1.00 0.00 C ATOM 1683 SG CYS A 116 22.972 -30.371 24.843 1.00 0.00 S ATOM 0 H CYS A 116 19.228 -28.763 24.276 1.00 0.00 H new ATOM 0 HA CYS A 116 20.652 -31.240 23.683 1.00 0.00 H new ATOM 0 HB2 CYS A 116 21.257 -28.716 24.471 1.00 0.00 H new ATOM 0 HB3 CYS A 116 21.117 -29.431 26.065 1.00 0.00 H new ATOM 1688 N VAL A 117 19.017 -32.561 25.194 1.00 0.00 N ATOM 1689 CA VAL A 117 18.478 -33.540 26.185 1.00 0.00 C ATOM 1690 C VAL A 117 19.491 -34.612 26.510 1.00 0.00 C ATOM 1691 O VAL A 117 20.621 -34.588 26.064 1.00 0.00 O ATOM 1692 CB VAL A 117 17.260 -34.186 25.533 1.00 0.00 C ATOM 1693 CG1 VAL A 117 16.074 -33.266 25.715 1.00 0.00 C ATOM 1694 CG2 VAL A 117 17.502 -34.419 24.039 1.00 0.00 C ATOM 0 H VAL A 117 18.744 -32.734 24.227 1.00 0.00 H new ATOM 0 HA VAL A 117 18.230 -33.032 27.117 1.00 0.00 H new ATOM 0 HB VAL A 117 17.071 -35.151 26.002 1.00 0.00 H new ATOM 0 HG11 VAL A 117 15.193 -33.713 25.254 1.00 0.00 H new ATOM 0 HG12 VAL A 117 15.890 -33.115 26.779 1.00 0.00 H new ATOM 0 HG13 VAL A 117 16.283 -32.306 25.243 1.00 0.00 H new ATOM 0 HG21 VAL A 117 16.620 -34.881 23.595 1.00 0.00 H new ATOM 0 HG22 VAL A 117 17.698 -33.465 23.549 1.00 0.00 H new ATOM 0 HG23 VAL A 117 18.361 -35.077 23.908 1.00 0.00 H new ATOM 1704 N ARG A 118 19.082 -35.563 27.291 1.00 0.00 N ATOM 1705 CA ARG A 118 20.009 -36.650 27.655 1.00 0.00 C ATOM 1706 C ARG A 118 19.384 -38.016 27.354 1.00 0.00 C ATOM 1707 O ARG A 118 18.787 -38.153 26.299 1.00 0.00 O ATOM 1708 CB ARG A 118 20.247 -36.479 29.154 1.00 0.00 C ATOM 1709 CG ARG A 118 18.957 -36.795 29.913 1.00 0.00 C ATOM 1710 CD ARG A 118 19.252 -37.797 31.031 1.00 0.00 C ATOM 1711 NE ARG A 118 17.921 -38.340 31.421 1.00 0.00 N ATOM 1712 CZ ARG A 118 17.200 -37.721 32.314 1.00 0.00 C ATOM 1713 NH1 ARG A 118 17.422 -37.919 33.585 1.00 0.00 N ATOM 1714 NH2 ARG A 118 16.256 -36.901 31.937 1.00 0.00 N ATOM 1715 OXT ARG A 118 19.515 -38.900 28.184 1.00 0.00 O ATOM 0 H ARG A 118 18.146 -35.632 27.691 1.00 0.00 H new ATOM 0 HA ARG A 118 20.938 -36.605 27.087 1.00 0.00 H new ATOM 0 HB2 ARG A 118 21.048 -37.141 29.484 1.00 0.00 H new ATOM 0 HB3 ARG A 118 20.568 -35.460 29.368 1.00 0.00 H new ATOM 0 HG2 ARG A 118 18.536 -35.881 30.332 1.00 0.00 H new ATOM 0 HG3 ARG A 118 18.213 -37.205 29.230 1.00 0.00 H new ATOM 0 HD2 ARG A 118 19.916 -38.589 30.686 1.00 0.00 H new ATOM 0 HD3 ARG A 118 19.744 -37.314 31.875 1.00 0.00 H new ATOM 0 HE ARG A 118 17.573 -39.196 30.989 1.00 0.00 H new ATOM 0 HH11 ARG A 118 18.160 -38.558 33.880 1.00 0.00 H new ATOM 0 HH12 ARG A 118 16.858 -37.434 34.283 1.00 0.00 H new ATOM 0 HH21 ARG A 118 16.083 -36.745 30.944 1.00 0.00 H new ATOM 0 HH22 ARG A 118 15.692 -36.417 32.636 1.00 0.00 H new