USER MOD reduce.3.24.130724 H: found=0, std=0, add=1732, rem=0, adj=63 USER MOD reduce.3.24.130724 removed 1738 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 85 GLN : amide:sc= -0.316 K(o=-2.8,f=-6.2!) USER MOD Set 1.2: B 114 MET CE :methyl -114:sc= -2.46! (180deg=-2.7!) USER MOD Set 2.1: A 96 ASN : amide:sc= 1.01 K(o=2.6,f=-3.6) USER MOD Set 2.2: B 101 LYS NZ :NH3+ 169:sc= 1.61 (180deg=0.502) USER MOD Set 3.1: B 30 MET CE :methyl -134:sc= 0 (180deg=-0.965) USER MOD Set 3.2: B 97 TYR OH : rot 180:sc= -0.28 USER MOD Set 4.1: B 81 CYS SG : rot 73:sc= 1.29 USER MOD Set 4.2: B 110 THR OG1 : rot -148:sc= 0.996 USER MOD Set 5.1: B 57 TYR OH : rot 0:sc= -1.09 USER MOD Set 5.2: B 61 HIS : no HE2:sc= 0.325 K(o=-0.77,f=-2.2) USER MOD Set 6.1: B 47 THR OG1 : rot 180:sc= -0.0179 USER MOD Set 6.2: B 49 THR OG1 : rot 180:sc= 0 USER MOD Set 7.1: B 37 SER OG : rot 180:sc= 0.119 USER MOD Set 7.2: B 39 SER OG : rot 180:sc= 0 USER MOD Set 8.1: B 28 LYS NZ :NH3+ -117:sc= 1.41 (180deg=0.103) USER MOD Set 8.2: B 29 ASN : amide:sc= -0.739 K(o=0.67,f=-3.7) USER MOD Set 9.1: A 101 LYS NZ :NH3+ 178:sc= 1.73 (180deg=1.38) USER MOD Set 9.2: B 96 ASN : amide:sc= -0.139 K(o=1.6,f=-0.51) USER MOD Set10.1: A 85 GLN : amide:sc= -0.248 K(o=-2.7,f=-5.9!) USER MOD Set10.2: A 114 MET CE :methyl -112:sc= -2.44! (180deg=-2.74!) USER MOD Set11.1: A 81 CYS SG : rot 72:sc= 1.3 USER MOD Set11.2: A 110 THR OG1 : rot -149:sc= 1.03 USER MOD Set12.1: A 57 TYR OH : rot 15:sc= -1.05 USER MOD Set12.2: A 61 HIS : no HE2:sc= 0.327 K(o=-0.72,f=-2.2) USER MOD Set13.1: A 37 SER OG : rot 180:sc= 0.156 USER MOD Set13.2: A 39 SER OG : rot 180:sc= 0 USER MOD Set14.1: A 30 MET CE :methyl -132:sc= 0 (180deg=-1.2) USER MOD Set14.2: A 97 TYR OH : rot 180:sc= -0.286 USER MOD Set15.1: A 28 LYS NZ :NH3+ -117:sc= 1.35 (180deg=0.0916) USER MOD Set15.2: A 29 ASN : amide:sc= -0.706 K(o=0.65,f=-3.5) USER MOD Single : A 5 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0351) USER MOD Single : A 8 SER OG : rot -77:sc= 0.145 USER MOD Single : A 9 SER OG : rot 76:sc= 0.337 USER MOD Single : A 12 LYS NZ :NH3+ 156:sc= 0.551 (180deg=0.202) USER MOD Single : A 18 LYS NZ :NH3+ -178:sc= 0.994 (180deg=0.991) USER MOD Single : A 22 CYS SG : rot 71:sc= 1.29 USER MOD Single : A 23 MET CE :methyl -144:sc= -0.456 (180deg=-0.615) USER MOD Single : A 24 SER OG : rot 19:sc= -0.625 USER MOD Single : A 26 THR OG1 : rot 174:sc= 0.289 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.0114 USER MOD Single : A 48 SER OG : rot -147:sc= 0.136 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 170:sc=-0.00722 (180deg=-0.103) USER MOD Single : A 58 CYS SG : rot 75:sc= 1.14 USER MOD Single : A 60 HIS : no HE2:sc= -0.897 X(o=-0.9,f=-1.1) USER MOD Single : A 62 HIS : no HD1:sc= -0.0578 K(o=-0.058,f=-1.1) USER MOD Single : A 63 GLN : amide:sc= -0.0481 X(o=-0.048,f=-0.36) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 76 TYR OH : rot 74:sc= 0.296 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 80:sc= 0.71 USER MOD Single : A 108 CYS SG : rot 75:sc= 0.398 USER MOD Single : A 109 LYS NZ :NH3+ -153:sc= 0.324 (180deg=-0.468) USER MOD Single : A 113 ASN : amide:sc= -0.0122 K(o=-0.012,f=-0.52) USER MOD Single : B 2 SER OG : rot 24:sc= 0.11 USER MOD Single : B 5 LYS NZ :NH3+ 174:sc= -0.0144 (180deg=-0.101) USER MOD Single : B 8 SER OG : rot 130:sc= 0.0138 USER MOD Single : B 9 SER OG : rot 75:sc= 0.305 USER MOD Single : B 12 LYS NZ :NH3+ 159:sc= 0.658 (180deg=0.36) USER MOD Single : B 18 LYS NZ :NH3+ -177:sc= 0.777 (180deg=0.768) USER MOD Single : B 22 CYS SG : rot 74:sc= 1.27 USER MOD Single : B 23 MET CE :methyl -145:sc= -0.507 (180deg=-0.709) USER MOD Single : B 24 SER OG : rot 21:sc= -0.623 USER MOD Single : B 26 THR OG1 : rot 176:sc= 0.315 USER MOD Single : B 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 48 SER OG : rot -142:sc= 0.234 USER MOD Single : B 53 LYS NZ :NH3+ 172:sc=-0.000357 (180deg=-0.086) USER MOD Single : B 58 CYS SG : rot 71:sc= 1.12 USER MOD Single : B 60 HIS : no HE2:sc= -0.742 X(o=-0.74,f=-1.2) USER MOD Single : B 62 HIS : no HD1:sc= 0.0243 K(o=0.024,f=-1.1) USER MOD Single : B 63 GLN : amide:sc= -0.0617 X(o=-0.062,f=-0.29) USER MOD Single : B 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 76 TYR OH : rot 72:sc= 0.312 USER MOD Single : B 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 87 THR OG1 : rot 180:sc= 0 USER MOD Single : B 107 THR OG1 : rot 80:sc= 0.694 USER MOD Single : B 108 CYS SG : rot 82:sc= 0.68 USER MOD Single : B 109 LYS NZ :NH3+ -154:sc= 0.315 (180deg=-0.424) USER MOD Single : B 113 ASN : amide:sc= -0.0157 K(o=-0.016,f=-0.56) USER MOD ----------------------------------------------------------------- ATOM 14 N LEU A 3 -18.987 -11.358 -17.229 1.00 22.23 N ATOM 15 CA LEU A 3 -18.698 -10.109 -16.503 1.00 42.35 C ATOM 16 C LEU A 3 -19.169 -10.238 -15.044 1.00 50.42 C ATOM 17 O LEU A 3 -20.314 -10.634 -14.791 1.00 31.43 O ATOM 18 CB LEU A 3 -19.412 -8.909 -17.186 1.00 74.33 C ATOM 19 CG LEU A 3 -19.073 -8.655 -18.684 1.00 33.23 C ATOM 20 CD1 LEU A 3 -19.945 -7.525 -19.262 1.00 72.10 C ATOM 21 CD2 LEU A 3 -17.581 -8.338 -18.877 1.00 13.13 C ATOM 0 HA LEU A 3 -17.623 -9.931 -16.521 1.00 42.35 H new ATOM 0 HB2 LEU A 3 -20.488 -9.060 -17.101 1.00 74.33 H new ATOM 0 HB3 LEU A 3 -19.172 -8.006 -16.625 1.00 74.33 H new ATOM 0 HG LEU A 3 -19.293 -9.573 -19.229 1.00 33.23 H new ATOM 0 HD11 LEU A 3 -19.689 -7.367 -20.310 1.00 72.10 H new ATOM 0 HD12 LEU A 3 -20.997 -7.800 -19.183 1.00 72.10 H new ATOM 0 HD13 LEU A 3 -19.768 -6.606 -18.703 1.00 72.10 H new ATOM 0 HD21 LEU A 3 -17.379 -8.166 -19.934 1.00 13.13 H new ATOM 0 HD22 LEU A 3 -17.322 -7.445 -18.308 1.00 13.13 H new ATOM 0 HD23 LEU A 3 -16.982 -9.178 -18.525 1.00 13.13 H new ATOM 33 N VAL A 4 -18.283 -9.927 -14.092 1.00 44.21 N ATOM 34 CA VAL A 4 -18.631 -9.911 -12.661 1.00 62.05 C ATOM 35 C VAL A 4 -19.142 -8.506 -12.271 1.00 31.53 C ATOM 36 O VAL A 4 -18.509 -7.486 -12.567 1.00 20.32 O ATOM 37 CB VAL A 4 -17.434 -10.385 -11.745 1.00 51.34 C ATOM 38 CG1 VAL A 4 -17.217 -11.914 -11.886 1.00 53.00 C ATOM 39 CG2 VAL A 4 -16.128 -9.617 -12.064 1.00 41.32 C ATOM 0 H VAL A 4 -17.312 -9.681 -14.285 1.00 44.21 H new ATOM 0 HA VAL A 4 -19.430 -10.633 -12.493 1.00 62.05 H new ATOM 0 HB VAL A 4 -17.700 -10.161 -10.712 1.00 51.34 H new ATOM 0 HG11 VAL A 4 -16.389 -12.224 -11.249 1.00 53.00 H new ATOM 0 HG12 VAL A 4 -18.123 -12.439 -11.585 1.00 53.00 H new ATOM 0 HG13 VAL A 4 -16.986 -12.155 -12.924 1.00 53.00 H new ATOM 0 HG21 VAL A 4 -15.329 -9.972 -11.413 1.00 41.32 H new ATOM 0 HG22 VAL A 4 -15.851 -9.787 -13.104 1.00 41.32 H new ATOM 0 HG23 VAL A 4 -16.283 -8.551 -11.899 1.00 41.32 H new ATOM 49 N LYS A 5 -20.329 -8.486 -11.652 1.00 74.30 N ATOM 50 CA LYS A 5 -21.044 -7.263 -11.274 1.00 31.25 C ATOM 51 C LYS A 5 -20.510 -6.724 -9.935 1.00 35.44 C ATOM 52 O LYS A 5 -20.712 -7.338 -8.891 1.00 41.35 O ATOM 53 CB LYS A 5 -22.564 -7.575 -11.176 1.00 54.13 C ATOM 54 CG LYS A 5 -23.216 -8.012 -12.507 1.00 43.33 C ATOM 55 CD LYS A 5 -24.712 -8.380 -12.342 1.00 65.01 C ATOM 56 CE LYS A 5 -25.399 -8.675 -13.686 1.00 40.20 C ATOM 57 NZ LYS A 5 -24.722 -9.758 -14.448 1.00 72.15 N ATOM 0 H LYS A 5 -20.828 -9.337 -11.395 1.00 74.30 H new ATOM 0 HA LYS A 5 -20.884 -6.495 -12.031 1.00 31.25 H new ATOM 0 HB2 LYS A 5 -22.713 -8.362 -10.437 1.00 54.13 H new ATOM 0 HB3 LYS A 5 -23.081 -6.689 -10.807 1.00 54.13 H new ATOM 0 HG2 LYS A 5 -23.121 -7.207 -13.236 1.00 43.33 H new ATOM 0 HG3 LYS A 5 -22.676 -8.870 -12.908 1.00 43.33 H new ATOM 0 HD2 LYS A 5 -24.799 -9.252 -11.694 1.00 65.01 H new ATOM 0 HD3 LYS A 5 -25.231 -7.561 -11.845 1.00 65.01 H new ATOM 0 HE2 LYS A 5 -26.436 -8.956 -13.506 1.00 40.20 H new ATOM 0 HE3 LYS A 5 -25.415 -7.767 -14.289 1.00 40.20 H new ATOM 0 HZ1 LYS A 5 -25.262 -9.964 -15.312 1.00 72.15 H new ATOM 0 HZ2 LYS A 5 -23.761 -9.454 -14.704 1.00 72.15 H new ATOM 0 HZ3 LYS A 5 -24.669 -10.615 -13.861 1.00 72.15 H new ATOM 71 N LEU A 6 -19.790 -5.598 -9.989 1.00 52.40 N ATOM 72 CA LEU A 6 -19.251 -4.926 -8.792 1.00 52.54 C ATOM 73 C LEU A 6 -20.076 -3.671 -8.499 1.00 54.00 C ATOM 74 O LEU A 6 -19.888 -2.636 -9.141 1.00 10.03 O ATOM 75 CB LEU A 6 -17.748 -4.563 -8.987 1.00 63.03 C ATOM 76 CG LEU A 6 -16.715 -5.704 -8.708 1.00 63.41 C ATOM 77 CD1 LEU A 6 -16.875 -6.912 -9.646 1.00 63.30 C ATOM 78 CD2 LEU A 6 -15.291 -5.148 -8.765 1.00 32.33 C ATOM 0 H LEU A 6 -19.562 -5.123 -10.863 1.00 52.40 H new ATOM 0 HA LEU A 6 -19.319 -5.606 -7.943 1.00 52.54 H new ATOM 0 HB2 LEU A 6 -17.610 -4.220 -10.012 1.00 63.03 H new ATOM 0 HB3 LEU A 6 -17.512 -3.722 -8.335 1.00 63.03 H new ATOM 0 HG LEU A 6 -16.917 -6.078 -7.704 1.00 63.41 H new ATOM 0 HD11 LEU A 6 -16.128 -7.666 -9.399 1.00 63.30 H new ATOM 0 HD12 LEU A 6 -17.872 -7.336 -9.527 1.00 63.30 H new ATOM 0 HD13 LEU A 6 -16.738 -6.591 -10.679 1.00 63.30 H new ATOM 0 HD21 LEU A 6 -14.579 -5.950 -8.569 1.00 32.33 H new ATOM 0 HD22 LEU A 6 -15.103 -4.729 -9.754 1.00 32.33 H new ATOM 0 HD23 LEU A 6 -15.175 -4.368 -8.013 1.00 32.33 H new ATOM 90 N GLU A 7 -21.014 -3.783 -7.552 1.00 65.33 N ATOM 91 CA GLU A 7 -21.800 -2.637 -7.082 1.00 4.41 C ATOM 92 C GLU A 7 -20.953 -1.812 -6.089 1.00 21.12 C ATOM 93 O GLU A 7 -20.462 -2.345 -5.100 1.00 22.21 O ATOM 94 CB GLU A 7 -23.115 -3.110 -6.416 1.00 61.21 C ATOM 95 CG GLU A 7 -24.012 -1.952 -5.925 1.00 30.43 C ATOM 96 CD GLU A 7 -25.240 -2.427 -5.143 1.00 43.34 C ATOM 97 OE1 GLU A 7 -26.323 -2.570 -5.742 1.00 44.11 O ATOM 98 OE2 GLU A 7 -25.115 -2.685 -3.929 1.00 35.01 O ATOM 0 H GLU A 7 -21.248 -4.663 -7.093 1.00 65.33 H new ATOM 0 HA GLU A 7 -22.066 -2.012 -7.934 1.00 4.41 H new ATOM 0 HB2 GLU A 7 -23.676 -3.716 -7.128 1.00 61.21 H new ATOM 0 HB3 GLU A 7 -22.873 -3.754 -5.571 1.00 61.21 H new ATOM 0 HG2 GLU A 7 -23.422 -1.287 -5.293 1.00 30.43 H new ATOM 0 HG3 GLU A 7 -24.341 -1.367 -6.784 1.00 30.43 H new ATOM 105 N SER A 8 -20.788 -0.518 -6.376 1.00 53.20 N ATOM 106 CA SER A 8 -20.019 0.410 -5.533 1.00 65.34 C ATOM 107 C SER A 8 -20.870 0.929 -4.357 1.00 63.45 C ATOM 108 O SER A 8 -22.045 0.577 -4.222 1.00 35.41 O ATOM 109 CB SER A 8 -19.530 1.578 -6.415 1.00 12.04 C ATOM 110 OG SER A 8 -20.616 2.230 -7.057 1.00 30.22 O ATOM 0 H SER A 8 -21.186 -0.079 -7.206 1.00 53.20 H new ATOM 0 HA SER A 8 -19.164 -0.112 -5.102 1.00 65.34 H new ATOM 0 HB2 SER A 8 -18.983 2.295 -5.802 1.00 12.04 H new ATOM 0 HB3 SER A 8 -18.833 1.203 -7.165 1.00 12.04 H new ATOM 0 HG SER A 8 -20.926 1.685 -7.810 1.00 30.22 H new ATOM 116 N SER A 9 -20.255 1.788 -3.522 1.00 31.21 N ATOM 117 CA SER A 9 -20.926 2.467 -2.388 1.00 75.30 C ATOM 118 C SER A 9 -21.968 3.495 -2.874 1.00 11.53 C ATOM 119 O SER A 9 -22.844 3.918 -2.111 1.00 24.43 O ATOM 120 CB SER A 9 -19.870 3.158 -1.505 1.00 51.23 C ATOM 121 OG SER A 9 -18.883 2.235 -1.078 1.00 51.34 O ATOM 0 H SER A 9 -19.270 2.035 -3.613 1.00 31.21 H new ATOM 0 HA SER A 9 -21.457 1.713 -1.807 1.00 75.30 H new ATOM 0 HB2 SER A 9 -19.399 3.968 -2.062 1.00 51.23 H new ATOM 0 HB3 SER A 9 -20.353 3.607 -0.637 1.00 51.23 H new ATOM 0 HG SER A 9 -18.273 2.042 -1.820 1.00 51.34 H new ATOM 127 N ASP A 10 -21.850 3.886 -4.150 1.00 13.02 N ATOM 128 CA ASP A 10 -22.787 4.805 -4.818 1.00 74.54 C ATOM 129 C ASP A 10 -23.866 4.000 -5.592 1.00 65.14 C ATOM 130 O ASP A 10 -24.580 4.548 -6.439 1.00 10.32 O ATOM 131 CB ASP A 10 -21.972 5.738 -5.759 1.00 11.31 C ATOM 132 CG ASP A 10 -22.776 6.917 -6.351 1.00 62.43 C ATOM 133 OD1 ASP A 10 -22.995 6.967 -7.578 1.00 22.14 O ATOM 134 OD2 ASP A 10 -23.189 7.799 -5.588 1.00 61.35 O ATOM 0 H ASP A 10 -21.093 3.570 -4.756 1.00 13.02 H new ATOM 0 HA ASP A 10 -23.312 5.417 -4.085 1.00 74.54 H new ATOM 0 HB2 ASP A 10 -21.122 6.137 -5.206 1.00 11.31 H new ATOM 0 HB3 ASP A 10 -21.569 5.143 -6.578 1.00 11.31 H new ATOM 139 N GLU A 11 -23.963 2.676 -5.281 1.00 1.12 N ATOM 140 CA GLU A 11 -24.994 1.748 -5.826 1.00 52.31 C ATOM 141 C GLU A 11 -24.836 1.496 -7.345 1.00 31.22 C ATOM 142 O GLU A 11 -25.729 0.915 -7.977 1.00 63.35 O ATOM 143 CB GLU A 11 -26.430 2.252 -5.486 1.00 14.21 C ATOM 144 CG GLU A 11 -26.728 2.344 -3.975 1.00 44.11 C ATOM 145 CD GLU A 11 -28.081 3.000 -3.659 1.00 13.55 C ATOM 146 OE1 GLU A 11 -28.127 4.235 -3.487 1.00 64.25 O ATOM 147 OE2 GLU A 11 -29.107 2.290 -3.591 1.00 41.13 O ATOM 0 H GLU A 11 -23.318 2.219 -4.636 1.00 1.12 H new ATOM 0 HA GLU A 11 -24.838 0.786 -5.338 1.00 52.31 H new ATOM 0 HB2 GLU A 11 -26.573 3.236 -5.933 1.00 14.21 H new ATOM 0 HB3 GLU A 11 -27.156 1.583 -5.948 1.00 14.21 H new ATOM 0 HG2 GLU A 11 -26.710 1.342 -3.547 1.00 44.11 H new ATOM 0 HG3 GLU A 11 -25.935 2.913 -3.490 1.00 44.11 H new ATOM 154 N LYS A 12 -23.687 1.896 -7.912 1.00 63.41 N ATOM 155 CA LYS A 12 -23.417 1.778 -9.357 1.00 40.22 C ATOM 156 C LYS A 12 -22.711 0.454 -9.652 1.00 12.14 C ATOM 157 O LYS A 12 -21.632 0.189 -9.116 1.00 12.51 O ATOM 158 CB LYS A 12 -22.562 2.975 -9.830 1.00 24.34 C ATOM 159 CG LYS A 12 -23.227 4.344 -9.606 1.00 53.04 C ATOM 160 CD LYS A 12 -24.535 4.525 -10.403 1.00 73.51 C ATOM 161 CE LYS A 12 -25.247 5.847 -10.084 1.00 43.51 C ATOM 162 NZ LYS A 12 -24.351 7.023 -10.252 1.00 55.44 N ATOM 0 H LYS A 12 -22.919 2.310 -7.384 1.00 63.41 H new ATOM 0 HA LYS A 12 -24.361 1.791 -9.902 1.00 40.22 H new ATOM 0 HB2 LYS A 12 -21.607 2.956 -9.306 1.00 24.34 H new ATOM 0 HB3 LYS A 12 -22.345 2.857 -10.892 1.00 24.34 H new ATOM 0 HG2 LYS A 12 -23.437 4.469 -8.544 1.00 53.04 H new ATOM 0 HG3 LYS A 12 -22.527 5.131 -9.887 1.00 53.04 H new ATOM 0 HD2 LYS A 12 -24.314 4.485 -11.470 1.00 73.51 H new ATOM 0 HD3 LYS A 12 -25.206 3.694 -10.185 1.00 73.51 H new ATOM 0 HE2 LYS A 12 -26.114 5.957 -10.735 1.00 43.51 H new ATOM 0 HE3 LYS A 12 -25.619 5.819 -9.060 1.00 43.51 H new ATOM 0 HZ1 LYS A 12 -24.923 7.873 -10.430 1.00 55.44 H new ATOM 0 HZ2 LYS A 12 -23.790 7.158 -9.387 1.00 55.44 H new ATOM 0 HZ3 LYS A 12 -23.712 6.861 -11.057 1.00 55.44 H new ATOM 176 N VAL A 13 -23.327 -0.362 -10.514 1.00 71.43 N ATOM 177 CA VAL A 13 -22.832 -1.693 -10.871 1.00 52.22 C ATOM 178 C VAL A 13 -21.899 -1.584 -12.091 1.00 4.15 C ATOM 179 O VAL A 13 -22.311 -1.099 -13.148 1.00 10.40 O ATOM 180 CB VAL A 13 -24.032 -2.661 -11.173 1.00 0.22 C ATOM 181 CG1 VAL A 13 -23.540 -4.090 -11.487 1.00 12.44 C ATOM 182 CG2 VAL A 13 -25.050 -2.651 -10.003 1.00 34.02 C ATOM 0 H VAL A 13 -24.195 -0.112 -10.989 1.00 71.43 H new ATOM 0 HA VAL A 13 -22.271 -2.105 -10.032 1.00 52.22 H new ATOM 0 HB VAL A 13 -24.543 -2.297 -12.064 1.00 0.22 H new ATOM 0 HG11 VAL A 13 -24.396 -4.733 -11.691 1.00 12.44 H new ATOM 0 HG12 VAL A 13 -22.888 -4.067 -12.360 1.00 12.44 H new ATOM 0 HG13 VAL A 13 -22.988 -4.481 -10.632 1.00 12.44 H new ATOM 0 HG21 VAL A 13 -25.873 -3.328 -10.231 1.00 34.02 H new ATOM 0 HG22 VAL A 13 -24.556 -2.977 -9.088 1.00 34.02 H new ATOM 0 HG23 VAL A 13 -25.437 -1.641 -9.866 1.00 34.02 H new ATOM 192 N PHE A 14 -20.636 -2.002 -11.911 1.00 43.13 N ATOM 193 CA PHE A 14 -19.618 -2.017 -12.966 1.00 43.44 C ATOM 194 C PHE A 14 -19.284 -3.476 -13.299 1.00 2.05 C ATOM 195 O PHE A 14 -18.613 -4.168 -12.520 1.00 25.13 O ATOM 196 CB PHE A 14 -18.357 -1.238 -12.500 1.00 54.23 C ATOM 197 CG PHE A 14 -18.649 0.214 -12.124 1.00 71.44 C ATOM 198 CD1 PHE A 14 -18.679 0.622 -10.791 1.00 31.32 C ATOM 199 CD2 PHE A 14 -18.925 1.161 -13.111 1.00 41.23 C ATOM 200 CE1 PHE A 14 -18.972 1.926 -10.459 1.00 74.13 C ATOM 201 CE2 PHE A 14 -19.215 2.468 -12.776 1.00 1.34 C ATOM 202 CZ PHE A 14 -19.241 2.850 -11.453 1.00 50.11 C ATOM 0 H PHE A 14 -20.291 -2.344 -11.014 1.00 43.13 H new ATOM 0 HA PHE A 14 -19.993 -1.525 -13.863 1.00 43.44 H new ATOM 0 HB2 PHE A 14 -17.920 -1.748 -11.641 1.00 54.23 H new ATOM 0 HB3 PHE A 14 -17.612 -1.257 -13.295 1.00 54.23 H new ATOM 0 HD1 PHE A 14 -18.470 -0.093 -10.009 1.00 31.32 H new ATOM 0 HD2 PHE A 14 -18.911 0.867 -14.150 1.00 41.23 H new ATOM 0 HE1 PHE A 14 -18.992 2.228 -9.422 1.00 74.13 H new ATOM 0 HE2 PHE A 14 -19.422 3.191 -13.551 1.00 1.34 H new ATOM 0 HZ PHE A 14 -19.472 3.872 -11.191 1.00 50.11 H new ATOM 212 N GLU A 15 -19.807 -3.941 -14.440 1.00 51.32 N ATOM 213 CA GLU A 15 -19.651 -5.323 -14.903 1.00 53.55 C ATOM 214 C GLU A 15 -18.295 -5.477 -15.624 1.00 62.25 C ATOM 215 O GLU A 15 -18.210 -5.439 -16.860 1.00 21.44 O ATOM 216 CB GLU A 15 -20.835 -5.711 -15.827 1.00 43.20 C ATOM 217 CG GLU A 15 -22.228 -5.462 -15.223 1.00 44.22 C ATOM 218 CD GLU A 15 -23.368 -5.862 -16.176 1.00 13.14 C ATOM 219 OE1 GLU A 15 -23.778 -7.039 -16.166 1.00 30.33 O ATOM 220 OE2 GLU A 15 -23.843 -5.004 -16.955 1.00 24.32 O ATOM 0 H GLU A 15 -20.356 -3.361 -15.074 1.00 51.32 H new ATOM 0 HA GLU A 15 -19.661 -6.001 -14.049 1.00 53.55 H new ATOM 0 HB2 GLU A 15 -20.751 -5.150 -16.758 1.00 43.20 H new ATOM 0 HB3 GLU A 15 -20.748 -6.767 -16.083 1.00 43.20 H new ATOM 0 HG2 GLU A 15 -22.322 -6.024 -14.294 1.00 44.22 H new ATOM 0 HG3 GLU A 15 -22.326 -4.407 -14.969 1.00 44.22 H new ATOM 227 N ILE A 16 -17.229 -5.588 -14.821 1.00 71.31 N ATOM 228 CA ILE A 16 -15.854 -5.752 -15.323 1.00 55.04 C ATOM 229 C ILE A 16 -15.618 -7.222 -15.724 1.00 23.21 C ATOM 230 O ILE A 16 -16.241 -8.135 -15.171 1.00 34.25 O ATOM 231 CB ILE A 16 -14.778 -5.292 -14.252 1.00 54.15 C ATOM 232 CG1 ILE A 16 -13.314 -5.458 -14.808 1.00 42.00 C ATOM 233 CG2 ILE A 16 -14.968 -6.035 -12.906 1.00 52.50 C ATOM 234 CD1 ILE A 16 -12.195 -5.152 -13.828 1.00 54.02 C ATOM 0 H ILE A 16 -17.293 -5.567 -13.803 1.00 71.31 H new ATOM 0 HA ILE A 16 -15.736 -5.113 -16.198 1.00 55.04 H new ATOM 0 HB ILE A 16 -14.934 -4.231 -14.059 1.00 54.15 H new ATOM 0 HG12 ILE A 16 -13.193 -6.483 -15.159 1.00 42.00 H new ATOM 0 HG13 ILE A 16 -13.199 -4.808 -15.675 1.00 42.00 H new ATOM 0 HG21 ILE A 16 -14.215 -5.697 -12.194 1.00 52.50 H new ATOM 0 HG22 ILE A 16 -15.962 -5.824 -12.511 1.00 52.50 H new ATOM 0 HG23 ILE A 16 -14.861 -7.108 -13.065 1.00 52.50 H new ATOM 0 HD11 ILE A 16 -11.232 -5.299 -14.317 1.00 54.02 H new ATOM 0 HD12 ILE A 16 -12.277 -4.118 -13.493 1.00 54.02 H new ATOM 0 HD13 ILE A 16 -12.271 -5.819 -12.969 1.00 54.02 H new ATOM 246 N GLU A 17 -14.744 -7.416 -16.725 1.00 63.51 N ATOM 247 CA GLU A 17 -14.240 -8.736 -17.130 1.00 51.11 C ATOM 248 C GLU A 17 -13.560 -9.425 -15.927 1.00 42.22 C ATOM 249 O GLU A 17 -12.651 -8.848 -15.309 1.00 11.45 O ATOM 250 CB GLU A 17 -13.260 -8.568 -18.330 1.00 10.32 C ATOM 251 CG GLU A 17 -13.895 -7.883 -19.558 1.00 61.41 C ATOM 252 CD GLU A 17 -12.903 -7.600 -20.698 1.00 72.42 C ATOM 253 OE1 GLU A 17 -12.387 -6.468 -20.786 1.00 64.34 O ATOM 254 OE2 GLU A 17 -12.646 -8.502 -21.520 1.00 35.34 O ATOM 0 H GLU A 17 -14.364 -6.651 -17.282 1.00 63.51 H new ATOM 0 HA GLU A 17 -15.065 -9.371 -17.453 1.00 51.11 H new ATOM 0 HB2 GLU A 17 -12.398 -7.985 -18.005 1.00 10.32 H new ATOM 0 HB3 GLU A 17 -12.888 -9.549 -18.624 1.00 10.32 H new ATOM 0 HG2 GLU A 17 -14.699 -8.514 -19.938 1.00 61.41 H new ATOM 0 HG3 GLU A 17 -14.349 -6.943 -19.243 1.00 61.41 H new ATOM 261 N LYS A 18 -14.035 -10.647 -15.606 1.00 63.44 N ATOM 262 CA LYS A 18 -13.611 -11.414 -14.418 1.00 13.42 C ATOM 263 C LYS A 18 -12.080 -11.616 -14.375 1.00 4.21 C ATOM 264 O LYS A 18 -11.468 -11.456 -13.317 1.00 44.52 O ATOM 265 CB LYS A 18 -14.336 -12.788 -14.377 1.00 34.22 C ATOM 266 CG LYS A 18 -13.934 -13.689 -13.181 1.00 42.30 C ATOM 267 CD LYS A 18 -14.589 -15.089 -13.235 1.00 31.24 C ATOM 268 CE LYS A 18 -14.043 -16.034 -12.157 1.00 22.05 C ATOM 269 NZ LYS A 18 -14.623 -17.398 -12.271 1.00 0.51 N ATOM 0 H LYS A 18 -14.731 -11.133 -16.171 1.00 63.44 H new ATOM 0 HA LYS A 18 -13.889 -10.833 -13.538 1.00 13.42 H new ATOM 0 HB2 LYS A 18 -15.412 -12.616 -14.341 1.00 34.22 H new ATOM 0 HB3 LYS A 18 -14.129 -13.322 -15.304 1.00 34.22 H new ATOM 0 HG2 LYS A 18 -12.850 -13.801 -13.165 1.00 42.30 H new ATOM 0 HG3 LYS A 18 -14.217 -13.197 -12.251 1.00 42.30 H new ATOM 0 HD2 LYS A 18 -15.667 -14.987 -13.112 1.00 31.24 H new ATOM 0 HD3 LYS A 18 -14.420 -15.528 -14.218 1.00 31.24 H new ATOM 0 HE2 LYS A 18 -12.958 -16.093 -12.241 1.00 22.05 H new ATOM 0 HE3 LYS A 18 -14.265 -15.626 -11.171 1.00 22.05 H new ATOM 0 HZ1 LYS A 18 -14.255 -17.997 -11.505 1.00 0.51 H new ATOM 0 HZ2 LYS A 18 -15.659 -17.342 -12.199 1.00 0.51 H new ATOM 0 HZ3 LYS A 18 -14.361 -17.811 -13.189 1.00 0.51 H new ATOM 283 N GLU A 19 -11.487 -11.924 -15.551 1.00 5.45 N ATOM 284 CA GLU A 19 -10.028 -12.170 -15.712 1.00 31.32 C ATOM 285 C GLU A 19 -9.192 -10.953 -15.252 1.00 33.34 C ATOM 286 O GLU A 19 -8.097 -11.092 -14.691 1.00 0.25 O ATOM 287 CB GLU A 19 -9.717 -12.512 -17.204 1.00 51.44 C ATOM 288 CG GLU A 19 -8.222 -12.741 -17.527 1.00 33.11 C ATOM 289 CD GLU A 19 -7.965 -13.114 -18.994 1.00 3.53 C ATOM 290 OE1 GLU A 19 -7.667 -14.293 -19.285 1.00 20.02 O ATOM 291 OE2 GLU A 19 -8.054 -12.224 -19.865 1.00 21.30 O ATOM 0 H GLU A 19 -12.008 -12.010 -16.424 1.00 5.45 H new ATOM 0 HA GLU A 19 -9.751 -13.014 -15.080 1.00 31.32 H new ATOM 0 HB2 GLU A 19 -10.273 -13.408 -17.479 1.00 51.44 H new ATOM 0 HB3 GLU A 19 -10.088 -11.702 -17.831 1.00 51.44 H new ATOM 0 HG2 GLU A 19 -7.663 -11.836 -17.287 1.00 33.11 H new ATOM 0 HG3 GLU A 19 -7.837 -13.534 -16.886 1.00 33.11 H new ATOM 298 N ILE A 20 -9.746 -9.765 -15.497 1.00 15.01 N ATOM 299 CA ILE A 20 -9.122 -8.483 -15.156 1.00 63.11 C ATOM 300 C ILE A 20 -9.360 -8.135 -13.664 1.00 70.42 C ATOM 301 O ILE A 20 -8.480 -7.577 -12.998 1.00 52.53 O ATOM 302 CB ILE A 20 -9.675 -7.364 -16.108 1.00 44.53 C ATOM 303 CG1 ILE A 20 -9.421 -7.768 -17.602 1.00 72.45 C ATOM 304 CG2 ILE A 20 -9.056 -6.001 -15.777 1.00 24.55 C ATOM 305 CD1 ILE A 20 -9.878 -6.766 -18.651 1.00 25.21 C ATOM 0 H ILE A 20 -10.656 -9.663 -15.946 1.00 15.01 H new ATOM 0 HA ILE A 20 -8.044 -8.556 -15.299 1.00 63.11 H new ATOM 0 HB ILE A 20 -10.750 -7.269 -15.955 1.00 44.53 H new ATOM 0 HG12 ILE A 20 -8.353 -7.941 -17.734 1.00 72.45 H new ATOM 0 HG13 ILE A 20 -9.923 -8.717 -17.791 1.00 72.45 H new ATOM 0 HG21 ILE A 20 -9.458 -5.245 -16.452 1.00 24.55 H new ATOM 0 HG22 ILE A 20 -9.296 -5.733 -14.748 1.00 24.55 H new ATOM 0 HG23 ILE A 20 -7.974 -6.055 -15.895 1.00 24.55 H new ATOM 0 HD11 ILE A 20 -9.651 -7.151 -19.645 1.00 25.21 H new ATOM 0 HD12 ILE A 20 -10.953 -6.608 -18.559 1.00 25.21 H new ATOM 0 HD13 ILE A 20 -9.358 -5.820 -18.501 1.00 25.21 H new ATOM 317 N ALA A 21 -10.550 -8.510 -13.147 1.00 31.51 N ATOM 318 CA ALA A 21 -10.908 -8.344 -11.718 1.00 12.44 C ATOM 319 C ALA A 21 -10.063 -9.266 -10.804 1.00 71.31 C ATOM 320 O ALA A 21 -9.976 -9.043 -9.591 1.00 22.13 O ATOM 321 CB ALA A 21 -12.407 -8.611 -11.522 1.00 22.45 C ATOM 0 H ALA A 21 -11.290 -8.936 -13.706 1.00 31.51 H new ATOM 0 HA ALA A 21 -10.687 -7.316 -11.431 1.00 12.44 H new ATOM 0 HB1 ALA A 21 -12.664 -8.488 -10.470 1.00 22.45 H new ATOM 0 HB2 ALA A 21 -12.983 -7.907 -12.122 1.00 22.45 H new ATOM 0 HB3 ALA A 21 -12.639 -9.629 -11.835 1.00 22.45 H new ATOM 327 N CYS A 22 -9.446 -10.298 -11.415 1.00 62.11 N ATOM 328 CA CYS A 22 -8.544 -11.234 -10.730 1.00 23.14 C ATOM 329 C CYS A 22 -7.202 -10.579 -10.325 1.00 34.12 C ATOM 330 O CYS A 22 -6.540 -11.060 -9.396 1.00 54.10 O ATOM 331 CB CYS A 22 -8.303 -12.463 -11.624 1.00 5.34 C ATOM 332 SG CYS A 22 -9.801 -13.414 -11.976 1.00 65.32 S ATOM 0 H CYS A 22 -9.564 -10.503 -12.407 1.00 62.11 H new ATOM 0 HA CYS A 22 -9.028 -11.543 -9.803 1.00 23.14 H new ATOM 0 HB2 CYS A 22 -7.862 -12.135 -12.565 1.00 5.34 H new ATOM 0 HB3 CYS A 22 -7.575 -13.115 -11.141 1.00 5.34 H new ATOM 0 HG CYS A 22 -10.564 -12.739 -12.783 1.00 65.32 H new ATOM 338 N MET A 23 -6.799 -9.487 -11.020 1.00 13.42 N ATOM 339 CA MET A 23 -5.568 -8.729 -10.671 1.00 30.32 C ATOM 340 C MET A 23 -5.726 -8.042 -9.299 1.00 71.34 C ATOM 341 O MET A 23 -4.744 -7.824 -8.576 1.00 23.25 O ATOM 342 CB MET A 23 -5.213 -7.671 -11.746 1.00 55.21 C ATOM 343 CG MET A 23 -5.029 -8.208 -13.178 1.00 45.35 C ATOM 344 SD MET A 23 -3.986 -7.138 -14.204 1.00 31.55 S ATOM 345 CE MET A 23 -4.646 -5.498 -13.887 1.00 64.11 C ATOM 0 H MET A 23 -7.305 -9.111 -11.822 1.00 13.42 H new ATOM 0 HA MET A 23 -4.751 -9.449 -10.626 1.00 30.32 H new ATOM 0 HB2 MET A 23 -5.999 -6.916 -11.759 1.00 55.21 H new ATOM 0 HB3 MET A 23 -4.293 -7.169 -11.445 1.00 55.21 H new ATOM 0 HG2 MET A 23 -4.587 -9.203 -13.133 1.00 45.35 H new ATOM 0 HG3 MET A 23 -6.006 -8.314 -13.649 1.00 45.35 H new ATOM 0 HE1 MET A 23 -4.602 -4.905 -14.801 1.00 64.11 H new ATOM 0 HE2 MET A 23 -5.682 -5.580 -13.557 1.00 64.11 H new ATOM 0 HE3 MET A 23 -4.055 -5.012 -13.111 1.00 64.11 H new ATOM 355 N SER A 24 -6.974 -7.689 -8.968 1.00 35.30 N ATOM 356 CA SER A 24 -7.339 -7.263 -7.623 1.00 14.54 C ATOM 357 C SER A 24 -7.418 -8.507 -6.735 1.00 64.24 C ATOM 358 O SER A 24 -8.264 -9.377 -6.968 1.00 31.14 O ATOM 359 CB SER A 24 -8.684 -6.516 -7.624 1.00 65.30 C ATOM 360 OG SER A 24 -9.039 -6.108 -6.310 1.00 72.53 O ATOM 0 H SER A 24 -7.753 -7.693 -9.627 1.00 35.30 H new ATOM 0 HA SER A 24 -6.587 -6.573 -7.241 1.00 14.54 H new ATOM 0 HB2 SER A 24 -8.620 -5.644 -8.275 1.00 65.30 H new ATOM 0 HB3 SER A 24 -9.462 -7.161 -8.031 1.00 65.30 H new ATOM 0 HG SER A 24 -8.242 -6.111 -5.740 1.00 72.53 H new ATOM 366 N VAL A 25 -6.513 -8.594 -5.746 1.00 31.24 N ATOM 367 CA VAL A 25 -6.395 -9.764 -4.868 1.00 51.00 C ATOM 368 C VAL A 25 -7.685 -9.949 -4.040 1.00 64.12 C ATOM 369 O VAL A 25 -8.247 -11.037 -4.025 1.00 42.41 O ATOM 370 CB VAL A 25 -5.130 -9.661 -3.931 1.00 23.51 C ATOM 371 CG1 VAL A 25 -4.926 -10.957 -3.107 1.00 42.42 C ATOM 372 CG2 VAL A 25 -3.858 -9.316 -4.753 1.00 42.52 C ATOM 0 H VAL A 25 -5.844 -7.854 -5.535 1.00 31.24 H new ATOM 0 HA VAL A 25 -6.260 -10.643 -5.498 1.00 51.00 H new ATOM 0 HB VAL A 25 -5.308 -8.850 -3.225 1.00 23.51 H new ATOM 0 HG11 VAL A 25 -4.046 -10.850 -2.473 1.00 42.42 H new ATOM 0 HG12 VAL A 25 -5.803 -11.134 -2.484 1.00 42.42 H new ATOM 0 HG13 VAL A 25 -4.786 -11.800 -3.784 1.00 42.42 H new ATOM 0 HG21 VAL A 25 -3.000 -9.251 -4.085 1.00 42.52 H new ATOM 0 HG22 VAL A 25 -3.682 -10.095 -5.495 1.00 42.52 H new ATOM 0 HG23 VAL A 25 -3.999 -8.360 -5.257 1.00 42.52 H new ATOM 382 N THR A 26 -8.177 -8.849 -3.427 1.00 20.14 N ATOM 383 CA THR A 26 -9.384 -8.869 -2.566 1.00 5.21 C ATOM 384 C THR A 26 -10.652 -9.286 -3.350 1.00 41.14 C ATOM 385 O THR A 26 -11.367 -10.182 -2.909 1.00 60.34 O ATOM 386 CB THR A 26 -9.620 -7.482 -1.883 1.00 23.05 C ATOM 387 OG1 THR A 26 -8.478 -7.121 -1.100 1.00 3.24 O ATOM 388 CG2 THR A 26 -10.870 -7.454 -0.981 1.00 44.42 C ATOM 0 H THR A 26 -7.752 -7.926 -3.514 1.00 20.14 H new ATOM 0 HA THR A 26 -9.199 -9.617 -1.795 1.00 5.21 H new ATOM 0 HB THR A 26 -9.780 -6.767 -2.690 1.00 23.05 H new ATOM 0 HG1 THR A 26 -8.594 -6.213 -0.751 1.00 3.24 H new ATOM 0 HG21 THR A 26 -10.977 -6.464 -0.538 1.00 44.42 H new ATOM 0 HG22 THR A 26 -11.754 -7.682 -1.577 1.00 44.42 H new ATOM 0 HG23 THR A 26 -10.765 -8.196 -0.190 1.00 44.42 H new ATOM 396 N ILE A 27 -10.896 -8.644 -4.518 1.00 70.43 N ATOM 397 CA ILE A 27 -12.087 -8.921 -5.362 1.00 45.20 C ATOM 398 C ILE A 27 -12.076 -10.389 -5.839 1.00 51.24 C ATOM 399 O ILE A 27 -13.101 -11.073 -5.780 1.00 32.11 O ATOM 400 CB ILE A 27 -12.156 -7.946 -6.601 1.00 40.21 C ATOM 401 CG1 ILE A 27 -12.305 -6.465 -6.122 1.00 40.33 C ATOM 402 CG2 ILE A 27 -13.296 -8.332 -7.585 1.00 3.12 C ATOM 403 CD1 ILE A 27 -12.154 -5.418 -7.218 1.00 64.30 C ATOM 0 H ILE A 27 -10.280 -7.926 -4.900 1.00 70.43 H new ATOM 0 HA ILE A 27 -12.974 -8.751 -4.752 1.00 45.20 H new ATOM 0 HB ILE A 27 -11.219 -8.043 -7.149 1.00 40.21 H new ATOM 0 HG12 ILE A 27 -13.284 -6.345 -5.658 1.00 40.33 H new ATOM 0 HG13 ILE A 27 -11.560 -6.272 -5.350 1.00 40.33 H new ATOM 0 HG21 ILE A 27 -13.306 -7.634 -8.422 1.00 3.12 H new ATOM 0 HG22 ILE A 27 -13.129 -9.343 -7.957 1.00 3.12 H new ATOM 0 HG23 ILE A 27 -14.254 -8.290 -7.066 1.00 3.12 H new ATOM 0 HD11 ILE A 27 -12.273 -4.423 -6.789 1.00 64.30 H new ATOM 0 HD12 ILE A 27 -11.165 -5.503 -7.669 1.00 64.30 H new ATOM 0 HD13 ILE A 27 -12.915 -5.578 -7.981 1.00 64.30 H new ATOM 415 N LYS A 28 -10.884 -10.858 -6.268 1.00 44.04 N ATOM 416 CA LYS A 28 -10.662 -12.257 -6.689 1.00 54.32 C ATOM 417 C LYS A 28 -10.995 -13.228 -5.535 1.00 31.34 C ATOM 418 O LYS A 28 -11.714 -14.207 -5.734 1.00 41.21 O ATOM 419 CB LYS A 28 -9.189 -12.442 -7.141 1.00 1.12 C ATOM 420 CG LYS A 28 -8.824 -13.859 -7.640 1.00 74.45 C ATOM 421 CD LYS A 28 -7.318 -14.020 -7.946 1.00 14.42 C ATOM 422 CE LYS A 28 -6.419 -13.751 -6.722 1.00 53.21 C ATOM 423 NZ LYS A 28 -6.717 -14.657 -5.578 1.00 32.41 N ATOM 0 H LYS A 28 -10.049 -10.276 -6.332 1.00 44.04 H new ATOM 0 HA LYS A 28 -11.322 -12.482 -7.527 1.00 54.32 H new ATOM 0 HB2 LYS A 28 -8.978 -11.729 -7.938 1.00 1.12 H new ATOM 0 HB3 LYS A 28 -8.536 -12.189 -6.306 1.00 1.12 H new ATOM 0 HG2 LYS A 28 -9.117 -14.590 -6.887 1.00 74.45 H new ATOM 0 HG3 LYS A 28 -9.398 -14.081 -8.540 1.00 74.45 H new ATOM 0 HD2 LYS A 28 -7.133 -15.031 -8.310 1.00 14.42 H new ATOM 0 HD3 LYS A 28 -7.042 -13.337 -8.749 1.00 14.42 H new ATOM 0 HE2 LYS A 28 -5.375 -13.869 -7.011 1.00 53.21 H new ATOM 0 HE3 LYS A 28 -6.547 -12.716 -6.403 1.00 53.21 H new ATOM 0 HZ1 LYS A 28 -7.052 -14.096 -4.769 1.00 32.41 H new ATOM 0 HZ2 LYS A 28 -7.453 -15.337 -5.856 1.00 32.41 H new ATOM 0 HZ3 LYS A 28 -5.854 -15.172 -5.309 1.00 32.41 H new ATOM 437 N ASN A 29 -10.510 -12.890 -4.318 1.00 40.55 N ATOM 438 CA ASN A 29 -10.699 -13.721 -3.104 1.00 64.44 C ATOM 439 C ASN A 29 -12.166 -13.719 -2.647 1.00 72.22 C ATOM 440 O ASN A 29 -12.626 -14.696 -2.068 1.00 31.54 O ATOM 441 CB ASN A 29 -9.794 -13.245 -1.930 1.00 2.13 C ATOM 442 CG ASN A 29 -8.287 -13.377 -2.201 1.00 61.01 C ATOM 443 OD1 ASN A 29 -7.843 -14.186 -3.016 1.00 41.54 O ATOM 444 ND2 ASN A 29 -7.484 -12.583 -1.502 1.00 32.01 N ATOM 0 H ASN A 29 -9.978 -12.036 -4.149 1.00 40.55 H new ATOM 0 HA ASN A 29 -10.411 -14.736 -3.377 1.00 64.44 H new ATOM 0 HB2 ASN A 29 -10.022 -12.202 -1.710 1.00 2.13 H new ATOM 0 HB3 ASN A 29 -10.043 -13.820 -1.038 1.00 2.13 H new ATOM 0 HD21 ASN A 29 -6.474 -12.635 -1.634 1.00 32.01 H new ATOM 0 HD22 ASN A 29 -7.877 -11.921 -0.833 1.00 32.01 H new ATOM 451 N MET A 30 -12.884 -12.604 -2.911 1.00 54.45 N ATOM 452 CA MET A 30 -14.329 -12.485 -2.627 1.00 75.23 C ATOM 453 C MET A 30 -15.107 -13.497 -3.485 1.00 45.14 C ATOM 454 O MET A 30 -15.940 -14.244 -2.972 1.00 13.22 O ATOM 455 CB MET A 30 -14.853 -11.036 -2.894 1.00 34.50 C ATOM 456 CG MET A 30 -14.421 -9.975 -1.866 1.00 72.25 C ATOM 457 SD MET A 30 -15.112 -8.341 -2.231 1.00 74.10 S ATOM 458 CE MET A 30 -14.607 -7.395 -0.793 1.00 34.42 C ATOM 0 H MET A 30 -12.478 -11.765 -3.325 1.00 54.45 H new ATOM 0 HA MET A 30 -14.486 -12.701 -1.570 1.00 75.23 H new ATOM 0 HB2 MET A 30 -14.512 -10.721 -3.880 1.00 34.50 H new ATOM 0 HB3 MET A 30 -15.942 -11.063 -2.927 1.00 34.50 H new ATOM 0 HG2 MET A 30 -14.738 -10.287 -0.871 1.00 72.25 H new ATOM 0 HG3 MET A 30 -13.333 -9.911 -1.849 1.00 72.25 H new ATOM 0 HE1 MET A 30 -15.461 -6.840 -0.404 1.00 34.42 H new ATOM 0 HE2 MET A 30 -14.234 -8.072 -0.025 1.00 34.42 H new ATOM 0 HE3 MET A 30 -13.819 -6.697 -1.075 1.00 34.42 H new ATOM 468 N ILE A 31 -14.765 -13.536 -4.788 1.00 1.54 N ATOM 469 CA ILE A 31 -15.393 -14.433 -5.777 1.00 61.14 C ATOM 470 C ILE A 31 -15.108 -15.911 -5.417 1.00 22.35 C ATOM 471 O ILE A 31 -16.011 -16.740 -5.424 1.00 33.40 O ATOM 472 CB ILE A 31 -14.880 -14.107 -7.240 1.00 42.04 C ATOM 473 CG1 ILE A 31 -15.215 -12.627 -7.622 1.00 5.34 C ATOM 474 CG2 ILE A 31 -15.459 -15.091 -8.288 1.00 64.22 C ATOM 475 CD1 ILE A 31 -14.629 -12.154 -8.947 1.00 22.44 C ATOM 0 H ILE A 31 -14.039 -12.941 -5.186 1.00 1.54 H new ATOM 0 HA ILE A 31 -16.470 -14.270 -5.753 1.00 61.14 H new ATOM 0 HB ILE A 31 -13.797 -14.232 -7.244 1.00 42.04 H new ATOM 0 HG12 ILE A 31 -16.298 -12.514 -7.661 1.00 5.34 H new ATOM 0 HG13 ILE A 31 -14.854 -11.973 -6.828 1.00 5.34 H new ATOM 0 HG21 ILE A 31 -15.082 -14.832 -9.277 1.00 64.22 H new ATOM 0 HG22 ILE A 31 -15.156 -16.108 -8.039 1.00 64.22 H new ATOM 0 HG23 ILE A 31 -16.547 -15.026 -8.286 1.00 64.22 H new ATOM 0 HD11 ILE A 31 -14.917 -11.117 -9.123 1.00 22.44 H new ATOM 0 HD12 ILE A 31 -13.542 -12.228 -8.911 1.00 22.44 H new ATOM 0 HD13 ILE A 31 -15.009 -12.778 -9.756 1.00 22.44 H new ATOM 487 N GLU A 32 -13.842 -16.203 -5.057 1.00 34.42 N ATOM 488 CA GLU A 32 -13.389 -17.564 -4.684 1.00 13.43 C ATOM 489 C GLU A 32 -14.058 -18.044 -3.378 1.00 14.44 C ATOM 490 O GLU A 32 -14.476 -19.205 -3.279 1.00 33.40 O ATOM 491 CB GLU A 32 -11.842 -17.598 -4.551 1.00 43.21 C ATOM 492 CG GLU A 32 -11.080 -17.327 -5.867 1.00 43.45 C ATOM 493 CD GLU A 32 -9.560 -17.270 -5.668 1.00 2.21 C ATOM 494 OE1 GLU A 32 -8.863 -18.262 -5.965 1.00 31.33 O ATOM 495 OE2 GLU A 32 -9.058 -16.236 -5.185 1.00 75.15 O ATOM 0 H GLU A 32 -13.102 -15.503 -5.016 1.00 34.42 H new ATOM 0 HA GLU A 32 -13.689 -18.248 -5.478 1.00 13.43 H new ATOM 0 HB2 GLU A 32 -11.537 -16.858 -3.811 1.00 43.21 H new ATOM 0 HB3 GLU A 32 -11.544 -18.574 -4.168 1.00 43.21 H new ATOM 0 HG2 GLU A 32 -11.319 -18.108 -6.588 1.00 43.45 H new ATOM 0 HG3 GLU A 32 -11.422 -16.384 -6.293 1.00 43.45 H new ATOM 502 N ASP A 33 -14.187 -17.121 -2.403 1.00 14.13 N ATOM 503 CA ASP A 33 -14.778 -17.403 -1.076 1.00 34.34 C ATOM 504 C ASP A 33 -16.272 -17.741 -1.212 1.00 21.00 C ATOM 505 O ASP A 33 -16.756 -18.700 -0.604 1.00 73.03 O ATOM 506 CB ASP A 33 -14.582 -16.177 -0.140 1.00 53.34 C ATOM 507 CG ASP A 33 -15.206 -16.359 1.253 1.00 11.03 C ATOM 508 OD1 ASP A 33 -16.283 -15.789 1.520 1.00 53.32 O ATOM 509 OD2 ASP A 33 -14.625 -17.086 2.080 1.00 41.52 O ATOM 0 H ASP A 33 -13.883 -16.154 -2.513 1.00 14.13 H new ATOM 0 HA ASP A 33 -14.272 -18.265 -0.641 1.00 34.34 H new ATOM 0 HB2 ASP A 33 -13.515 -15.983 -0.028 1.00 53.34 H new ATOM 0 HB3 ASP A 33 -15.018 -15.297 -0.612 1.00 53.34 H new ATOM 514 N ILE A 34 -16.977 -16.947 -2.036 1.00 13.21 N ATOM 515 CA ILE A 34 -18.396 -17.180 -2.377 1.00 14.31 C ATOM 516 C ILE A 34 -18.537 -18.476 -3.209 1.00 23.11 C ATOM 517 O ILE A 34 -19.525 -19.208 -3.082 1.00 31.20 O ATOM 518 CB ILE A 34 -18.986 -15.939 -3.178 1.00 4.13 C ATOM 519 CG1 ILE A 34 -18.991 -14.648 -2.296 1.00 10.45 C ATOM 520 CG2 ILE A 34 -20.400 -16.215 -3.748 1.00 22.11 C ATOM 521 CD1 ILE A 34 -19.877 -14.695 -1.058 1.00 62.44 C ATOM 0 H ILE A 34 -16.580 -16.123 -2.487 1.00 13.21 H new ATOM 0 HA ILE A 34 -18.963 -17.294 -1.453 1.00 14.31 H new ATOM 0 HB ILE A 34 -18.324 -15.778 -4.029 1.00 4.13 H new ATOM 0 HG12 ILE A 34 -17.968 -14.442 -1.980 1.00 10.45 H new ATOM 0 HG13 ILE A 34 -19.308 -13.809 -2.915 1.00 10.45 H new ATOM 0 HG21 ILE A 34 -20.754 -15.335 -4.285 1.00 22.11 H new ATOM 0 HG22 ILE A 34 -20.358 -17.064 -4.431 1.00 22.11 H new ATOM 0 HG23 ILE A 34 -21.084 -16.441 -2.930 1.00 22.11 H new ATOM 0 HD11 ILE A 34 -19.804 -13.749 -0.522 1.00 62.44 H new ATOM 0 HD12 ILE A 34 -20.912 -14.863 -1.357 1.00 62.44 H new ATOM 0 HD13 ILE A 34 -19.551 -15.507 -0.408 1.00 62.44 H new ATOM 533 N GLY A 35 -17.498 -18.771 -4.016 1.00 53.24 N ATOM 534 CA GLY A 35 -17.553 -19.832 -5.023 1.00 4.10 C ATOM 535 C GLY A 35 -18.187 -19.335 -6.320 1.00 10.30 C ATOM 536 O GLY A 35 -18.601 -20.148 -7.162 1.00 51.23 O ATOM 0 H GLY A 35 -16.605 -18.279 -3.983 1.00 53.24 H new ATOM 0 HA2 GLY A 35 -16.546 -20.197 -5.225 1.00 4.10 H new ATOM 0 HA3 GLY A 35 -18.126 -20.675 -4.635 1.00 4.10 H new ATOM 540 N GLU A 36 -18.246 -17.981 -6.452 1.00 64.31 N ATOM 541 CA GLU A 36 -18.886 -17.237 -7.548 1.00 15.13 C ATOM 542 C GLU A 36 -20.424 -17.324 -7.456 1.00 31.45 C ATOM 543 O GLU A 36 -20.982 -18.373 -7.133 1.00 54.24 O ATOM 544 CB GLU A 36 -18.376 -17.670 -8.947 1.00 4.24 C ATOM 545 CG GLU A 36 -18.893 -16.798 -10.105 1.00 24.34 C ATOM 546 CD GLU A 36 -18.480 -17.342 -11.470 1.00 43.42 C ATOM 547 OE1 GLU A 36 -19.175 -18.231 -12.002 1.00 12.10 O ATOM 548 OE2 GLU A 36 -17.448 -16.909 -12.002 1.00 35.51 O ATOM 0 H GLU A 36 -17.826 -17.360 -5.760 1.00 64.31 H new ATOM 0 HA GLU A 36 -18.597 -16.193 -7.427 1.00 15.13 H new ATOM 0 HB2 GLU A 36 -17.286 -17.646 -8.947 1.00 4.24 H new ATOM 0 HB3 GLU A 36 -18.672 -18.704 -9.125 1.00 4.24 H new ATOM 0 HG2 GLU A 36 -19.980 -16.738 -10.054 1.00 24.34 H new ATOM 0 HG3 GLU A 36 -18.512 -15.783 -9.991 1.00 24.34 H new ATOM 555 N SER A 37 -21.097 -16.210 -7.760 1.00 40.42 N ATOM 556 CA SER A 37 -22.558 -16.117 -7.717 1.00 54.33 C ATOM 557 C SER A 37 -23.033 -15.097 -8.755 1.00 22.41 C ATOM 558 O SER A 37 -22.247 -14.259 -9.231 1.00 73.33 O ATOM 559 CB SER A 37 -23.032 -15.727 -6.289 1.00 52.21 C ATOM 560 OG SER A 37 -24.448 -15.644 -6.200 1.00 30.54 O ATOM 0 H SER A 37 -20.640 -15.343 -8.044 1.00 40.42 H new ATOM 0 HA SER A 37 -22.993 -17.087 -7.957 1.00 54.33 H new ATOM 0 HB2 SER A 37 -22.667 -16.463 -5.573 1.00 52.21 H new ATOM 0 HB3 SER A 37 -22.595 -14.768 -6.012 1.00 52.21 H new ATOM 0 HG SER A 37 -24.705 -15.398 -5.287 1.00 30.54 H new ATOM 566 N ASP A 38 -24.321 -15.191 -9.108 1.00 32.31 N ATOM 567 CA ASP A 38 -24.993 -14.210 -9.970 1.00 21.24 C ATOM 568 C ASP A 38 -25.309 -12.921 -9.179 1.00 42.55 C ATOM 569 O ASP A 38 -25.679 -11.901 -9.772 1.00 41.42 O ATOM 570 CB ASP A 38 -26.289 -14.812 -10.570 1.00 15.32 C ATOM 571 CG ASP A 38 -27.346 -15.153 -9.501 1.00 1.44 C ATOM 572 OD1 ASP A 38 -27.183 -16.177 -8.808 1.00 32.35 O ATOM 573 OD2 ASP A 38 -28.340 -14.413 -9.352 1.00 24.21 O ATOM 0 H ASP A 38 -24.928 -15.952 -8.803 1.00 32.31 H new ATOM 0 HA ASP A 38 -24.321 -13.954 -10.790 1.00 21.24 H new ATOM 0 HB2 ASP A 38 -26.715 -14.105 -11.282 1.00 15.32 H new ATOM 0 HB3 ASP A 38 -26.039 -15.715 -11.127 1.00 15.32 H new ATOM 578 N SER A 39 -25.187 -12.997 -7.836 1.00 11.04 N ATOM 579 CA SER A 39 -25.365 -11.848 -6.941 1.00 60.43 C ATOM 580 C SER A 39 -24.263 -10.780 -7.192 1.00 34.40 C ATOM 581 O SER A 39 -23.075 -11.119 -7.129 1.00 25.23 O ATOM 582 CB SER A 39 -25.292 -12.328 -5.473 1.00 65.14 C ATOM 583 OG SER A 39 -26.215 -13.379 -5.234 1.00 31.12 O ATOM 0 H SER A 39 -24.961 -13.863 -7.347 1.00 11.04 H new ATOM 0 HA SER A 39 -26.338 -11.397 -7.138 1.00 60.43 H new ATOM 0 HB2 SER A 39 -24.281 -12.669 -5.248 1.00 65.14 H new ATOM 0 HB3 SER A 39 -25.504 -11.494 -4.803 1.00 65.14 H new ATOM 0 HG SER A 39 -26.149 -13.666 -4.299 1.00 31.12 H new ATOM 589 N PRO A 40 -24.639 -9.495 -7.502 1.00 74.13 N ATOM 590 CA PRO A 40 -23.666 -8.378 -7.625 1.00 11.42 C ATOM 591 C PRO A 40 -22.875 -8.160 -6.320 1.00 20.01 C ATOM 592 O PRO A 40 -23.474 -7.883 -5.279 1.00 62.41 O ATOM 593 CB PRO A 40 -24.563 -7.150 -7.968 1.00 51.44 C ATOM 594 CG PRO A 40 -25.803 -7.749 -8.567 1.00 23.44 C ATOM 595 CD PRO A 40 -26.022 -9.042 -7.808 1.00 71.11 C ATOM 0 HA PRO A 40 -22.903 -8.567 -8.380 1.00 11.42 H new ATOM 0 HB2 PRO A 40 -24.794 -6.566 -7.077 1.00 51.44 H new ATOM 0 HB3 PRO A 40 -24.067 -6.479 -8.669 1.00 51.44 H new ATOM 0 HG2 PRO A 40 -26.656 -7.079 -8.459 1.00 23.44 H new ATOM 0 HG3 PRO A 40 -25.676 -7.934 -9.634 1.00 23.44 H new ATOM 0 HD2 PRO A 40 -26.604 -8.882 -6.900 1.00 71.11 H new ATOM 0 HD3 PRO A 40 -26.562 -9.774 -8.408 1.00 71.11 H new ATOM 603 N ILE A 41 -21.537 -8.338 -6.394 1.00 53.42 N ATOM 604 CA ILE A 41 -20.623 -8.148 -5.254 1.00 51.24 C ATOM 605 C ILE A 41 -20.669 -6.668 -4.786 1.00 24.33 C ATOM 606 O ILE A 41 -20.248 -5.783 -5.533 1.00 73.34 O ATOM 607 CB ILE A 41 -19.142 -8.577 -5.631 1.00 45.10 C ATOM 608 CG1 ILE A 41 -19.097 -10.062 -6.137 1.00 51.44 C ATOM 609 CG2 ILE A 41 -18.165 -8.375 -4.444 1.00 64.31 C ATOM 610 CD1 ILE A 41 -19.583 -11.119 -5.143 1.00 42.14 C ATOM 0 H ILE A 41 -21.062 -8.619 -7.252 1.00 53.42 H new ATOM 0 HA ILE A 41 -20.950 -8.788 -4.434 1.00 51.24 H new ATOM 0 HB ILE A 41 -18.815 -7.927 -6.442 1.00 45.10 H new ATOM 0 HG12 ILE A 41 -19.701 -10.136 -7.042 1.00 51.44 H new ATOM 0 HG13 ILE A 41 -18.071 -10.299 -6.418 1.00 51.44 H new ATOM 0 HG21 ILE A 41 -17.162 -8.680 -4.742 1.00 64.31 H new ATOM 0 HG22 ILE A 41 -18.154 -7.324 -4.157 1.00 64.31 H new ATOM 0 HG23 ILE A 41 -18.491 -8.979 -3.597 1.00 64.31 H new ATOM 0 HD11 ILE A 41 -19.508 -12.107 -5.597 1.00 42.14 H new ATOM 0 HD12 ILE A 41 -18.966 -11.085 -4.245 1.00 42.14 H new ATOM 0 HD13 ILE A 41 -20.621 -10.919 -4.878 1.00 42.14 H new ATOM 622 N PRO A 42 -21.244 -6.377 -3.571 1.00 71.04 N ATOM 623 CA PRO A 42 -21.360 -5.004 -3.057 1.00 32.11 C ATOM 624 C PRO A 42 -20.121 -4.594 -2.215 1.00 1.45 C ATOM 625 O PRO A 42 -19.812 -5.212 -1.185 1.00 71.12 O ATOM 626 CB PRO A 42 -22.661 -5.091 -2.221 1.00 10.01 C ATOM 627 CG PRO A 42 -22.694 -6.497 -1.674 1.00 23.42 C ATOM 628 CD PRO A 42 -21.834 -7.353 -2.605 1.00 23.05 C ATOM 0 HA PRO A 42 -21.399 -4.237 -3.831 1.00 32.11 H new ATOM 0 HB2 PRO A 42 -22.660 -4.356 -1.416 1.00 10.01 H new ATOM 0 HB3 PRO A 42 -23.538 -4.888 -2.836 1.00 10.01 H new ATOM 0 HG2 PRO A 42 -22.307 -6.525 -0.655 1.00 23.42 H new ATOM 0 HG3 PRO A 42 -23.716 -6.874 -1.637 1.00 23.42 H new ATOM 0 HD2 PRO A 42 -21.058 -7.883 -2.053 1.00 23.05 H new ATOM 0 HD3 PRO A 42 -22.432 -8.106 -3.117 1.00 23.05 H new ATOM 636 N LEU A 43 -19.388 -3.578 -2.699 1.00 63.15 N ATOM 637 CA LEU A 43 -18.202 -3.030 -2.024 1.00 60.44 C ATOM 638 C LEU A 43 -18.623 -1.755 -1.239 1.00 71.33 C ATOM 639 O LEU A 43 -18.775 -0.681 -1.842 1.00 51.24 O ATOM 640 CB LEU A 43 -17.052 -2.714 -3.044 1.00 31.41 C ATOM 641 CG LEU A 43 -16.476 -3.920 -3.889 1.00 71.11 C ATOM 642 CD1 LEU A 43 -17.457 -4.409 -4.970 1.00 11.54 C ATOM 643 CD2 LEU A 43 -15.117 -3.557 -4.522 1.00 30.31 C ATOM 0 H LEU A 43 -19.605 -3.110 -3.579 1.00 63.15 H new ATOM 0 HA LEU A 43 -17.807 -3.773 -1.331 1.00 60.44 H new ATOM 0 HB2 LEU A 43 -17.418 -1.959 -3.740 1.00 31.41 H new ATOM 0 HB3 LEU A 43 -16.226 -2.265 -2.492 1.00 31.41 H new ATOM 0 HG LEU A 43 -16.330 -4.743 -3.190 1.00 71.11 H new ATOM 0 HD11 LEU A 43 -17.010 -5.238 -5.519 1.00 11.54 H new ATOM 0 HD12 LEU A 43 -18.381 -4.743 -4.498 1.00 11.54 H new ATOM 0 HD13 LEU A 43 -17.676 -3.593 -5.659 1.00 11.54 H new ATOM 0 HD21 LEU A 43 -14.745 -4.405 -5.097 1.00 30.31 H new ATOM 0 HD22 LEU A 43 -15.241 -2.698 -5.181 1.00 30.31 H new ATOM 0 HD23 LEU A 43 -14.403 -3.311 -3.736 1.00 30.31 H new ATOM 655 N PRO A 44 -18.833 -1.847 0.121 1.00 74.33 N ATOM 656 CA PRO A 44 -19.351 -0.726 0.943 1.00 70.40 C ATOM 657 C PRO A 44 -18.224 0.199 1.463 1.00 44.33 C ATOM 658 O PRO A 44 -18.268 0.675 2.607 1.00 70.13 O ATOM 659 CB PRO A 44 -20.061 -1.490 2.084 1.00 52.40 C ATOM 660 CG PRO A 44 -19.196 -2.694 2.324 1.00 35.35 C ATOM 661 CD PRO A 44 -18.581 -3.049 0.972 1.00 51.24 C ATOM 0 HA PRO A 44 -20.000 -0.041 0.397 1.00 70.40 H new ATOM 0 HB2 PRO A 44 -20.145 -0.876 2.981 1.00 52.40 H new ATOM 0 HB3 PRO A 44 -21.073 -1.778 1.799 1.00 52.40 H new ATOM 0 HG2 PRO A 44 -18.422 -2.477 3.060 1.00 35.35 H new ATOM 0 HG3 PRO A 44 -19.784 -3.525 2.715 1.00 35.35 H new ATOM 0 HD2 PRO A 44 -17.514 -3.255 1.063 1.00 51.24 H new ATOM 0 HD3 PRO A 44 -19.043 -3.940 0.547 1.00 51.24 H new ATOM 669 N ASN A 45 -17.250 0.495 0.590 1.00 74.24 N ATOM 670 CA ASN A 45 -16.076 1.320 0.922 1.00 4.44 C ATOM 671 C ASN A 45 -15.755 2.249 -0.260 1.00 45.34 C ATOM 672 O ASN A 45 -15.699 3.476 -0.110 1.00 35.34 O ATOM 673 CB ASN A 45 -14.868 0.401 1.261 1.00 43.23 C ATOM 674 CG ASN A 45 -13.594 1.166 1.643 1.00 23.31 C ATOM 675 OD1 ASN A 45 -12.760 1.484 0.789 1.00 65.35 O ATOM 676 ND2 ASN A 45 -13.425 1.459 2.927 1.00 24.12 N ATOM 0 H ASN A 45 -17.254 0.166 -0.376 1.00 74.24 H new ATOM 0 HA ASN A 45 -16.288 1.936 1.796 1.00 4.44 H new ATOM 0 HB2 ASN A 45 -15.145 -0.258 2.084 1.00 43.23 H new ATOM 0 HB3 ASN A 45 -14.655 -0.234 0.401 1.00 43.23 H new ATOM 0 HD21 ASN A 45 -12.589 1.959 3.230 1.00 24.12 H new ATOM 0 HD22 ASN A 45 -14.131 1.184 3.610 1.00 24.12 H new ATOM 683 N VAL A 46 -15.588 1.652 -1.453 1.00 3.25 N ATOM 684 CA VAL A 46 -15.156 2.373 -2.661 1.00 24.10 C ATOM 685 C VAL A 46 -16.382 2.952 -3.427 1.00 72.23 C ATOM 686 O VAL A 46 -17.367 2.247 -3.668 1.00 52.13 O ATOM 687 CB VAL A 46 -14.276 1.427 -3.574 1.00 11.23 C ATOM 688 CG1 VAL A 46 -15.061 0.203 -4.077 1.00 23.42 C ATOM 689 CG2 VAL A 46 -13.629 2.204 -4.736 1.00 44.35 C ATOM 0 H VAL A 46 -15.749 0.656 -1.606 1.00 3.25 H new ATOM 0 HA VAL A 46 -14.536 3.220 -2.368 1.00 24.10 H new ATOM 0 HB VAL A 46 -13.471 1.045 -2.946 1.00 11.23 H new ATOM 0 HG11 VAL A 46 -14.413 -0.414 -4.699 1.00 23.42 H new ATOM 0 HG12 VAL A 46 -15.410 -0.381 -3.225 1.00 23.42 H new ATOM 0 HG13 VAL A 46 -15.917 0.536 -4.664 1.00 23.42 H new ATOM 0 HG21 VAL A 46 -13.032 1.522 -5.342 1.00 44.35 H new ATOM 0 HG22 VAL A 46 -14.408 2.651 -5.354 1.00 44.35 H new ATOM 0 HG23 VAL A 46 -12.988 2.990 -4.336 1.00 44.35 H new ATOM 699 N THR A 47 -16.315 4.248 -3.781 1.00 43.05 N ATOM 700 CA THR A 47 -17.401 4.980 -4.476 1.00 71.31 C ATOM 701 C THR A 47 -17.417 4.650 -5.983 1.00 40.01 C ATOM 702 O THR A 47 -16.531 3.942 -6.462 1.00 25.35 O ATOM 703 CB THR A 47 -17.236 6.515 -4.264 1.00 74.43 C ATOM 704 OG1 THR A 47 -15.942 6.925 -4.724 1.00 44.31 O ATOM 705 CG2 THR A 47 -17.406 6.922 -2.786 1.00 62.23 C ATOM 0 H THR A 47 -15.497 4.828 -3.592 1.00 43.05 H new ATOM 0 HA THR A 47 -18.352 4.661 -4.049 1.00 71.31 H new ATOM 0 HB THR A 47 -18.020 7.012 -4.836 1.00 74.43 H new ATOM 0 HG1 THR A 47 -15.839 7.891 -4.592 1.00 44.31 H new ATOM 0 HG21 THR A 47 -17.282 8.001 -2.689 1.00 62.23 H new ATOM 0 HG22 THR A 47 -18.401 6.639 -2.443 1.00 62.23 H new ATOM 0 HG23 THR A 47 -16.655 6.415 -2.180 1.00 62.23 H new ATOM 713 N SER A 48 -18.423 5.176 -6.722 1.00 53.12 N ATOM 714 CA SER A 48 -18.633 4.845 -8.151 1.00 10.40 C ATOM 715 C SER A 48 -17.468 5.287 -9.039 1.00 41.55 C ATOM 716 O SER A 48 -16.963 4.495 -9.834 1.00 44.41 O ATOM 717 CB SER A 48 -19.947 5.473 -8.665 1.00 53.22 C ATOM 718 OG SER A 48 -19.990 6.872 -8.438 1.00 42.42 O ATOM 0 H SER A 48 -19.106 5.835 -6.348 1.00 53.12 H new ATOM 0 HA SER A 48 -18.695 3.758 -8.212 1.00 10.40 H new ATOM 0 HB2 SER A 48 -20.051 5.275 -9.732 1.00 53.22 H new ATOM 0 HB3 SER A 48 -20.794 4.999 -8.169 1.00 53.22 H new ATOM 0 HG SER A 48 -20.915 7.148 -8.272 1.00 42.42 H new ATOM 724 N THR A 49 -17.038 6.543 -8.871 1.00 71.12 N ATOM 725 CA THR A 49 -15.987 7.149 -9.699 1.00 62.42 C ATOM 726 C THR A 49 -14.637 6.451 -9.471 1.00 42.50 C ATOM 727 O THR A 49 -13.897 6.194 -10.420 1.00 62.31 O ATOM 728 CB THR A 49 -15.856 8.672 -9.396 1.00 22.42 C ATOM 729 OG1 THR A 49 -15.605 8.855 -7.995 1.00 2.03 O ATOM 730 CG2 THR A 49 -17.121 9.461 -9.786 1.00 63.40 C ATOM 0 H THR A 49 -17.409 7.169 -8.156 1.00 71.12 H new ATOM 0 HA THR A 49 -16.272 7.022 -10.743 1.00 62.42 H new ATOM 0 HB THR A 49 -15.029 9.054 -9.995 1.00 22.42 H new ATOM 0 HG1 THR A 49 -15.520 9.812 -7.800 1.00 2.03 H new ATOM 0 HG21 THR A 49 -16.977 10.516 -9.554 1.00 63.40 H new ATOM 0 HG22 THR A 49 -17.307 9.346 -10.854 1.00 63.40 H new ATOM 0 HG23 THR A 49 -17.975 9.080 -9.226 1.00 63.40 H new ATOM 738 N ILE A 50 -14.360 6.115 -8.198 1.00 25.04 N ATOM 739 CA ILE A 50 -13.088 5.507 -7.789 1.00 50.21 C ATOM 740 C ILE A 50 -13.038 4.025 -8.217 1.00 24.14 C ATOM 741 O ILE A 50 -12.021 3.575 -8.733 1.00 12.13 O ATOM 742 CB ILE A 50 -12.856 5.662 -6.237 1.00 23.12 C ATOM 743 CG1 ILE A 50 -12.896 7.167 -5.819 1.00 22.13 C ATOM 744 CG2 ILE A 50 -11.529 5.005 -5.778 1.00 12.43 C ATOM 745 CD1 ILE A 50 -11.844 8.053 -6.476 1.00 11.32 C ATOM 0 H ILE A 50 -15.013 6.258 -7.428 1.00 25.04 H new ATOM 0 HA ILE A 50 -12.279 6.035 -8.294 1.00 50.21 H new ATOM 0 HB ILE A 50 -13.669 5.137 -5.736 1.00 23.12 H new ATOM 0 HG12 ILE A 50 -13.882 7.567 -6.055 1.00 22.13 H new ATOM 0 HG13 ILE A 50 -12.777 7.230 -4.737 1.00 22.13 H new ATOM 0 HG21 ILE A 50 -11.411 5.136 -4.702 1.00 12.43 H new ATOM 0 HG22 ILE A 50 -11.549 3.941 -6.014 1.00 12.43 H new ATOM 0 HG23 ILE A 50 -10.692 5.475 -6.295 1.00 12.43 H new ATOM 0 HD11 ILE A 50 -11.957 9.077 -6.120 1.00 11.32 H new ATOM 0 HD12 ILE A 50 -10.849 7.687 -6.221 1.00 11.32 H new ATOM 0 HD13 ILE A 50 -11.973 8.029 -7.558 1.00 11.32 H new ATOM 757 N LEU A 51 -14.168 3.291 -8.043 1.00 41.24 N ATOM 758 CA LEU A 51 -14.259 1.864 -8.428 1.00 62.20 C ATOM 759 C LEU A 51 -14.163 1.729 -9.957 1.00 51.52 C ATOM 760 O LEU A 51 -13.421 0.890 -10.451 1.00 61.01 O ATOM 761 CB LEU A 51 -15.571 1.197 -7.913 1.00 34.34 C ATOM 762 CG LEU A 51 -15.703 -0.339 -8.202 1.00 15.13 C ATOM 763 CD1 LEU A 51 -14.526 -1.144 -7.604 1.00 11.14 C ATOM 764 CD2 LEU A 51 -17.060 -0.894 -7.717 1.00 3.31 C ATOM 0 H LEU A 51 -15.026 3.667 -7.639 1.00 41.24 H new ATOM 0 HA LEU A 51 -13.425 1.343 -7.958 1.00 62.20 H new ATOM 0 HB2 LEU A 51 -15.640 1.354 -6.837 1.00 34.34 H new ATOM 0 HB3 LEU A 51 -16.420 1.709 -8.365 1.00 34.34 H new ATOM 0 HG LEU A 51 -15.662 -0.460 -9.284 1.00 15.13 H new ATOM 0 HD11 LEU A 51 -14.658 -2.203 -7.828 1.00 11.14 H new ATOM 0 HD12 LEU A 51 -13.589 -0.795 -8.038 1.00 11.14 H new ATOM 0 HD13 LEU A 51 -14.500 -1.002 -6.524 1.00 11.14 H new ATOM 0 HD21 LEU A 51 -17.115 -1.961 -7.934 1.00 3.31 H new ATOM 0 HD22 LEU A 51 -17.154 -0.737 -6.642 1.00 3.31 H new ATOM 0 HD23 LEU A 51 -17.870 -0.377 -8.232 1.00 3.31 H new ATOM 776 N GLU A 52 -14.898 2.608 -10.683 1.00 34.11 N ATOM 777 CA GLU A 52 -14.861 2.676 -12.165 1.00 73.14 C ATOM 778 C GLU A 52 -13.423 2.871 -12.652 1.00 13.31 C ATOM 779 O GLU A 52 -12.969 2.197 -13.570 1.00 63.40 O ATOM 780 CB GLU A 52 -15.697 3.874 -12.697 1.00 50.34 C ATOM 781 CG GLU A 52 -15.805 3.938 -14.241 1.00 34.42 C ATOM 782 CD GLU A 52 -16.379 5.262 -14.763 1.00 63.51 C ATOM 783 OE1 GLU A 52 -17.614 5.447 -14.727 1.00 55.24 O ATOM 784 OE2 GLU A 52 -15.588 6.129 -15.199 1.00 72.11 O ATOM 0 H GLU A 52 -15.530 3.287 -10.259 1.00 34.11 H new ATOM 0 HA GLU A 52 -15.275 1.739 -12.537 1.00 73.14 H new ATOM 0 HB2 GLU A 52 -16.701 3.817 -12.276 1.00 50.34 H new ATOM 0 HB3 GLU A 52 -15.252 4.801 -12.336 1.00 50.34 H new ATOM 0 HG2 GLU A 52 -14.816 3.785 -14.673 1.00 34.42 H new ATOM 0 HG3 GLU A 52 -16.434 3.118 -14.587 1.00 34.42 H new ATOM 791 N LYS A 53 -12.740 3.804 -11.977 1.00 30.23 N ATOM 792 CA LYS A 53 -11.406 4.269 -12.350 1.00 52.41 C ATOM 793 C LYS A 53 -10.376 3.144 -12.180 1.00 24.30 C ATOM 794 O LYS A 53 -9.565 2.906 -13.068 1.00 35.31 O ATOM 795 CB LYS A 53 -11.014 5.507 -11.490 1.00 71.32 C ATOM 796 CG LYS A 53 -10.169 6.536 -12.241 1.00 71.12 C ATOM 797 CD LYS A 53 -9.673 7.685 -11.343 1.00 31.30 C ATOM 798 CE LYS A 53 -8.813 8.686 -12.119 1.00 62.05 C ATOM 799 NZ LYS A 53 -9.596 9.382 -13.174 1.00 74.11 N ATOM 0 H LYS A 53 -13.108 4.262 -11.143 1.00 30.23 H new ATOM 0 HA LYS A 53 -11.417 4.562 -13.400 1.00 52.41 H new ATOM 0 HB2 LYS A 53 -11.922 5.990 -11.129 1.00 71.32 H new ATOM 0 HB3 LYS A 53 -10.463 5.169 -10.613 1.00 71.32 H new ATOM 0 HG2 LYS A 53 -9.310 6.035 -12.687 1.00 71.12 H new ATOM 0 HG3 LYS A 53 -10.757 6.951 -13.060 1.00 71.12 H new ATOM 0 HD2 LYS A 53 -10.529 8.202 -10.909 1.00 31.30 H new ATOM 0 HD3 LYS A 53 -9.095 7.275 -10.515 1.00 31.30 H new ATOM 0 HE2 LYS A 53 -8.398 9.421 -11.429 1.00 62.05 H new ATOM 0 HE3 LYS A 53 -7.971 8.166 -12.575 1.00 62.05 H new ATOM 0 HZ1 LYS A 53 -9.034 10.166 -13.563 1.00 74.11 H new ATOM 0 HZ2 LYS A 53 -9.827 8.711 -13.934 1.00 74.11 H new ATOM 0 HZ3 LYS A 53 -10.475 9.756 -12.764 1.00 74.11 H new ATOM 813 N VAL A 54 -10.449 2.462 -11.022 1.00 23.13 N ATOM 814 CA VAL A 54 -9.558 1.343 -10.673 1.00 21.01 C ATOM 815 C VAL A 54 -9.747 0.168 -11.655 1.00 1.13 C ATOM 816 O VAL A 54 -8.767 -0.351 -12.197 1.00 3.42 O ATOM 817 CB VAL A 54 -9.801 0.872 -9.182 1.00 5.22 C ATOM 818 CG1 VAL A 54 -9.071 -0.452 -8.865 1.00 20.34 C ATOM 819 CG2 VAL A 54 -9.380 1.977 -8.181 1.00 41.10 C ATOM 0 H VAL A 54 -11.134 2.675 -10.297 1.00 23.13 H new ATOM 0 HA VAL A 54 -8.529 1.692 -10.753 1.00 21.01 H new ATOM 0 HB VAL A 54 -10.870 0.689 -9.074 1.00 5.22 H new ATOM 0 HG11 VAL A 54 -9.266 -0.737 -7.831 1.00 20.34 H new ATOM 0 HG12 VAL A 54 -9.432 -1.235 -9.531 1.00 20.34 H new ATOM 0 HG13 VAL A 54 -7.999 -0.320 -9.008 1.00 20.34 H new ATOM 0 HG21 VAL A 54 -9.556 1.631 -7.162 1.00 41.10 H new ATOM 0 HG22 VAL A 54 -8.321 2.201 -8.310 1.00 41.10 H new ATOM 0 HG23 VAL A 54 -9.966 2.877 -8.365 1.00 41.10 H new ATOM 829 N LEU A 55 -11.024 -0.201 -11.902 1.00 34.52 N ATOM 830 CA LEU A 55 -11.376 -1.336 -12.777 1.00 52.43 C ATOM 831 C LEU A 55 -10.953 -1.060 -14.236 1.00 75.44 C ATOM 832 O LEU A 55 -10.382 -1.931 -14.888 1.00 31.21 O ATOM 833 CB LEU A 55 -12.902 -1.644 -12.708 1.00 31.53 C ATOM 834 CG LEU A 55 -13.467 -2.076 -11.314 1.00 45.02 C ATOM 835 CD1 LEU A 55 -14.974 -2.401 -11.402 1.00 5.34 C ATOM 836 CD2 LEU A 55 -12.658 -3.243 -10.698 1.00 1.52 C ATOM 0 H LEU A 55 -11.832 0.277 -11.503 1.00 34.52 H new ATOM 0 HA LEU A 55 -10.832 -2.210 -12.418 1.00 52.43 H new ATOM 0 HB2 LEU A 55 -13.444 -0.757 -13.035 1.00 31.53 H new ATOM 0 HB3 LEU A 55 -13.123 -2.435 -13.425 1.00 31.53 H new ATOM 0 HG LEU A 55 -13.353 -1.229 -10.637 1.00 45.02 H new ATOM 0 HD11 LEU A 55 -15.340 -2.698 -10.419 1.00 5.34 H new ATOM 0 HD12 LEU A 55 -15.517 -1.519 -11.740 1.00 5.34 H new ATOM 0 HD13 LEU A 55 -15.130 -3.216 -12.109 1.00 5.34 H new ATOM 0 HD21 LEU A 55 -13.084 -3.511 -9.731 1.00 1.52 H new ATOM 0 HD22 LEU A 55 -12.698 -4.105 -11.364 1.00 1.52 H new ATOM 0 HD23 LEU A 55 -11.621 -2.936 -10.565 1.00 1.52 H new ATOM 848 N ASP A 56 -11.199 0.181 -14.703 1.00 52.24 N ATOM 849 CA ASP A 56 -10.919 0.607 -16.098 1.00 3.40 C ATOM 850 C ASP A 56 -9.406 0.756 -16.328 1.00 44.23 C ATOM 851 O ASP A 56 -8.908 0.516 -17.431 1.00 34.13 O ATOM 852 CB ASP A 56 -11.641 1.940 -16.419 1.00 71.34 C ATOM 853 CG ASP A 56 -11.546 2.327 -17.907 1.00 51.03 C ATOM 854 OD1 ASP A 56 -10.813 3.277 -18.250 1.00 51.40 O ATOM 855 OD2 ASP A 56 -12.211 1.675 -18.742 1.00 41.31 O ATOM 0 H ASP A 56 -11.598 0.921 -14.126 1.00 52.24 H new ATOM 0 HA ASP A 56 -11.298 -0.164 -16.768 1.00 3.40 H new ATOM 0 HB2 ASP A 56 -12.690 1.857 -16.136 1.00 71.34 H new ATOM 0 HB3 ASP A 56 -11.210 2.737 -15.813 1.00 71.34 H new ATOM 860 N TYR A 57 -8.695 1.167 -15.262 1.00 63.24 N ATOM 861 CA TYR A 57 -7.221 1.194 -15.228 1.00 34.52 C ATOM 862 C TYR A 57 -6.663 -0.217 -15.377 1.00 24.14 C ATOM 863 O TYR A 57 -5.724 -0.442 -16.145 1.00 41.10 O ATOM 864 CB TYR A 57 -6.722 1.832 -13.906 1.00 75.33 C ATOM 865 CG TYR A 57 -5.199 1.752 -13.669 1.00 21.11 C ATOM 866 CD1 TYR A 57 -4.329 2.674 -14.252 1.00 61.34 C ATOM 867 CD2 TYR A 57 -4.640 0.743 -12.870 1.00 55.22 C ATOM 868 CE1 TYR A 57 -2.963 2.590 -14.049 1.00 14.40 C ATOM 869 CE2 TYR A 57 -3.277 0.662 -12.668 1.00 61.53 C ATOM 870 CZ TYR A 57 -2.443 1.584 -13.257 1.00 50.24 C ATOM 871 OH TYR A 57 -1.082 1.487 -13.068 1.00 64.22 O ATOM 0 H TYR A 57 -9.128 1.491 -14.397 1.00 63.24 H new ATOM 0 HA TYR A 57 -6.866 1.800 -16.061 1.00 34.52 H new ATOM 0 HB2 TYR A 57 -7.021 2.880 -13.892 1.00 75.33 H new ATOM 0 HB3 TYR A 57 -7.229 1.345 -13.073 1.00 75.33 H new ATOM 0 HD1 TYR A 57 -4.728 3.465 -14.871 1.00 61.34 H new ATOM 0 HD2 TYR A 57 -5.289 0.016 -12.404 1.00 55.22 H new ATOM 0 HE1 TYR A 57 -2.303 3.310 -14.509 1.00 14.40 H new ATOM 0 HE2 TYR A 57 -2.867 -0.123 -12.050 1.00 61.53 H new ATOM 0 HH TYR A 57 -0.652 2.320 -13.353 1.00 64.22 H new ATOM 881 N CYS A 58 -7.260 -1.150 -14.623 1.00 60.25 N ATOM 882 CA CYS A 58 -6.877 -2.554 -14.652 1.00 62.01 C ATOM 883 C CYS A 58 -7.141 -3.160 -16.048 1.00 33.42 C ATOM 884 O CYS A 58 -6.342 -3.963 -16.530 1.00 43.12 O ATOM 885 CB CYS A 58 -7.637 -3.330 -13.551 1.00 51.11 C ATOM 886 SG CYS A 58 -7.204 -2.847 -11.858 1.00 15.01 S ATOM 0 H CYS A 58 -8.022 -0.944 -13.977 1.00 60.25 H new ATOM 0 HA CYS A 58 -5.808 -2.635 -14.453 1.00 62.01 H new ATOM 0 HB2 CYS A 58 -8.708 -3.185 -13.695 1.00 51.11 H new ATOM 0 HB3 CYS A 58 -7.441 -4.395 -13.673 1.00 51.11 H new ATOM 0 HG CYS A 58 -7.742 -1.696 -11.584 1.00 15.01 H new ATOM 892 N ARG A 59 -8.258 -2.734 -16.695 1.00 51.33 N ATOM 893 CA ARG A 59 -8.643 -3.212 -18.041 1.00 1.04 C ATOM 894 C ARG A 59 -7.636 -2.715 -19.090 1.00 60.41 C ATOM 895 O ARG A 59 -7.118 -3.508 -19.875 1.00 42.42 O ATOM 896 CB ARG A 59 -10.097 -2.780 -18.408 1.00 31.30 C ATOM 897 CG ARG A 59 -11.208 -3.422 -17.535 1.00 63.34 C ATOM 898 CD ARG A 59 -12.633 -3.124 -18.037 1.00 20.12 C ATOM 899 NE ARG A 59 -12.936 -3.809 -19.312 1.00 44.03 N ATOM 900 CZ ARG A 59 -13.865 -3.416 -20.205 1.00 63.52 C ATOM 901 NH1 ARG A 59 -14.611 -2.331 -19.994 1.00 75.20 N ATOM 902 NH2 ARG A 59 -14.040 -4.118 -21.312 1.00 62.05 N ATOM 0 H ARG A 59 -8.909 -2.056 -16.299 1.00 51.33 H new ATOM 0 HA ARG A 59 -8.624 -4.302 -18.032 1.00 1.04 H new ATOM 0 HB2 ARG A 59 -10.171 -1.696 -18.325 1.00 31.30 H new ATOM 0 HB3 ARG A 59 -10.283 -3.033 -19.452 1.00 31.30 H new ATOM 0 HG2 ARG A 59 -11.059 -4.501 -17.508 1.00 63.34 H new ATOM 0 HG3 ARG A 59 -11.109 -3.061 -16.511 1.00 63.34 H new ATOM 0 HD2 ARG A 59 -13.354 -3.434 -17.281 1.00 20.12 H new ATOM 0 HD3 ARG A 59 -12.752 -2.048 -18.168 1.00 20.12 H new ATOM 0 HE ARG A 59 -12.398 -4.647 -19.533 1.00 44.03 H new ATOM 0 HH11 ARG A 59 -14.483 -1.782 -19.144 1.00 75.20 H new ATOM 0 HH12 ARG A 59 -15.309 -2.050 -20.683 1.00 75.20 H new ATOM 0 HH21 ARG A 59 -13.474 -4.949 -21.484 1.00 62.05 H new ATOM 0 HH22 ARG A 59 -14.741 -3.828 -21.994 1.00 62.05 H new ATOM 916 N HIS A 60 -7.322 -1.409 -19.032 1.00 41.12 N ATOM 917 CA HIS A 60 -6.367 -0.752 -19.947 1.00 43.04 C ATOM 918 C HIS A 60 -4.959 -1.365 -19.819 1.00 33.32 C ATOM 919 O HIS A 60 -4.291 -1.628 -20.828 1.00 14.55 O ATOM 920 CB HIS A 60 -6.310 0.774 -19.662 1.00 52.32 C ATOM 921 CG HIS A 60 -5.276 1.505 -20.485 1.00 11.04 C ATOM 922 ND1 HIS A 60 -4.087 1.969 -19.965 1.00 52.34 N ATOM 923 CD2 HIS A 60 -5.238 1.805 -21.803 1.00 62.55 C ATOM 924 CE1 HIS A 60 -3.371 2.512 -20.925 1.00 44.43 C ATOM 925 NE2 HIS A 60 -4.044 2.421 -22.046 1.00 2.52 N ATOM 0 H HIS A 60 -7.726 -0.773 -18.344 1.00 41.12 H new ATOM 0 HA HIS A 60 -6.717 -0.913 -20.967 1.00 43.04 H new ATOM 0 HB2 HIS A 60 -7.291 1.208 -19.857 1.00 52.32 H new ATOM 0 HB3 HIS A 60 -6.097 0.930 -18.604 1.00 52.32 H new ATOM 0 HD1 HIS A 60 -3.806 1.902 -18.987 1.00 52.34 H new ATOM 0 HD2 HIS A 60 -6.010 1.596 -22.529 1.00 62.55 H new ATOM 0 HE1 HIS A 60 -2.394 2.957 -20.809 1.00 44.43 H new ATOM 934 N HIS A 61 -4.542 -1.603 -18.568 1.00 52.21 N ATOM 935 CA HIS A 61 -3.204 -2.132 -18.249 1.00 72.25 C ATOM 936 C HIS A 61 -3.126 -3.630 -18.611 1.00 74.54 C ATOM 937 O HIS A 61 -2.042 -4.153 -18.873 1.00 22.50 O ATOM 938 CB HIS A 61 -2.874 -1.895 -16.742 1.00 71.42 C ATOM 939 CG HIS A 61 -1.399 -1.786 -16.424 1.00 42.40 C ATOM 940 ND1 HIS A 61 -0.457 -2.678 -16.887 1.00 50.25 N ATOM 941 CD2 HIS A 61 -0.708 -0.863 -15.706 1.00 13.12 C ATOM 942 CE1 HIS A 61 0.736 -2.309 -16.477 1.00 24.20 C ATOM 943 NE2 HIS A 61 0.616 -1.212 -15.765 1.00 33.21 N ATOM 0 H HIS A 61 -5.122 -1.435 -17.746 1.00 52.21 H new ATOM 0 HA HIS A 61 -2.459 -1.602 -18.842 1.00 72.25 H new ATOM 0 HB2 HIS A 61 -3.370 -0.981 -16.416 1.00 71.42 H new ATOM 0 HB3 HIS A 61 -3.297 -2.713 -16.159 1.00 71.42 H new ATOM 0 HD1 HIS A 61 -0.655 -3.498 -17.460 1.00 50.25 H new ATOM 0 HD2 HIS A 61 -1.124 -0.013 -15.186 1.00 13.12 H new ATOM 0 HE1 HIS A 61 1.662 -2.823 -16.690 1.00 24.20 H new ATOM 952 N HIS A 62 -4.288 -4.305 -18.620 1.00 1.44 N ATOM 953 CA HIS A 62 -4.394 -5.712 -19.055 1.00 34.25 C ATOM 954 C HIS A 62 -4.344 -5.796 -20.592 1.00 1.23 C ATOM 955 O HIS A 62 -3.850 -6.772 -21.150 1.00 64.32 O ATOM 956 CB HIS A 62 -5.700 -6.342 -18.504 1.00 3.42 C ATOM 957 CG HIS A 62 -5.854 -7.819 -18.766 1.00 3.34 C ATOM 958 ND1 HIS A 62 -5.351 -8.786 -17.919 1.00 32.21 N ATOM 959 CD2 HIS A 62 -6.477 -8.493 -19.764 1.00 23.03 C ATOM 960 CE1 HIS A 62 -5.655 -9.976 -18.386 1.00 42.01 C ATOM 961 NE2 HIS A 62 -6.338 -9.825 -19.496 1.00 75.22 N ATOM 0 H HIS A 62 -5.176 -3.896 -18.328 1.00 1.44 H new ATOM 0 HA HIS A 62 -3.550 -6.275 -18.657 1.00 34.25 H new ATOM 0 HB2 HIS A 62 -5.742 -6.173 -17.428 1.00 3.42 H new ATOM 0 HB3 HIS A 62 -6.551 -5.820 -18.942 1.00 3.42 H new ATOM 0 HD2 HIS A 62 -6.987 -8.059 -20.611 1.00 23.03 H new ATOM 0 HE1 HIS A 62 -5.388 -10.919 -17.933 1.00 42.01 H new ATOM 0 HE2 HIS A 62 -6.707 -10.584 -20.069 1.00 75.22 H new ATOM 970 N GLN A 63 -4.869 -4.754 -21.262 1.00 73.42 N ATOM 971 CA GLN A 63 -4.862 -4.643 -22.737 1.00 2.11 C ATOM 972 C GLN A 63 -3.516 -4.091 -23.252 1.00 13.14 C ATOM 973 O GLN A 63 -3.263 -4.099 -24.460 1.00 61.12 O ATOM 974 CB GLN A 63 -6.044 -3.761 -23.228 1.00 10.11 C ATOM 975 CG GLN A 63 -7.449 -4.326 -22.903 1.00 23.41 C ATOM 976 CD GLN A 63 -7.700 -5.735 -23.459 1.00 62.41 C ATOM 977 OE1 GLN A 63 -7.162 -6.115 -24.501 1.00 22.12 O ATOM 978 NE2 GLN A 63 -8.528 -6.514 -22.781 1.00 11.41 N ATOM 0 H GLN A 63 -5.312 -3.962 -20.797 1.00 73.42 H new ATOM 0 HA GLN A 63 -4.988 -5.645 -23.147 1.00 2.11 H new ATOM 0 HB2 GLN A 63 -5.952 -2.772 -22.780 1.00 10.11 H new ATOM 0 HB3 GLN A 63 -5.960 -3.631 -24.307 1.00 10.11 H new ATOM 0 HG2 GLN A 63 -7.580 -4.345 -21.821 1.00 23.41 H new ATOM 0 HG3 GLN A 63 -8.203 -3.649 -23.304 1.00 23.41 H new ATOM 0 HE21 GLN A 63 -8.959 -6.174 -21.922 1.00 11.41 H new ATOM 0 HE22 GLN A 63 -8.735 -7.454 -23.118 1.00 11.41 H new ATOM 987 N HIS A 64 -2.668 -3.591 -22.329 1.00 63.44 N ATOM 988 CA HIS A 64 -1.274 -3.197 -22.622 1.00 32.10 C ATOM 989 C HIS A 64 -0.326 -3.846 -21.579 1.00 3.24 C ATOM 990 O HIS A 64 0.129 -3.174 -20.635 1.00 43.32 O ATOM 991 CB HIS A 64 -1.121 -1.641 -22.658 1.00 44.24 C ATOM 992 CG HIS A 64 -1.782 -0.980 -23.844 1.00 73.15 C ATOM 993 ND1 HIS A 64 -1.089 -0.615 -24.979 1.00 65.12 N ATOM 994 CD2 HIS A 64 -3.074 -0.636 -24.072 1.00 61.12 C ATOM 995 CE1 HIS A 64 -1.925 -0.083 -25.850 1.00 12.55 C ATOM 996 NE2 HIS A 64 -3.131 -0.082 -25.326 1.00 10.52 N ATOM 0 H HIS A 64 -2.933 -3.449 -21.354 1.00 63.44 H new ATOM 0 HA HIS A 64 -1.000 -3.560 -23.613 1.00 32.10 H new ATOM 0 HB2 HIS A 64 -1.542 -1.225 -21.743 1.00 44.24 H new ATOM 0 HB3 HIS A 64 -0.060 -1.392 -22.662 1.00 44.24 H new ATOM 0 HD2 HIS A 64 -3.903 -0.773 -23.393 1.00 61.12 H new ATOM 0 HE1 HIS A 64 -1.663 0.289 -26.829 1.00 12.55 H new ATOM 0 HE2 HIS A 64 -3.973 0.273 -25.779 1.00 10.52 H new ATOM 1094 N ILE A 73 5.072 4.432 -18.510 1.00 51.25 N ATOM 1095 CA ILE A 73 3.932 5.265 -18.101 1.00 73.12 C ATOM 1096 C ILE A 73 3.070 5.545 -19.354 1.00 3.34 C ATOM 1097 O ILE A 73 3.345 6.501 -20.092 1.00 60.52 O ATOM 1098 CB ILE A 73 4.393 6.621 -17.426 1.00 43.30 C ATOM 1099 CG1 ILE A 73 5.388 6.342 -16.251 1.00 42.14 C ATOM 1100 CG2 ILE A 73 3.170 7.444 -16.934 1.00 55.14 C ATOM 1101 CD1 ILE A 73 6.019 7.583 -15.629 1.00 4.34 C ATOM 0 HA ILE A 73 3.353 4.730 -17.348 1.00 73.12 H new ATOM 0 HB ILE A 73 4.912 7.214 -18.179 1.00 43.30 H new ATOM 0 HG12 ILE A 73 4.860 5.792 -15.472 1.00 42.14 H new ATOM 0 HG13 ILE A 73 6.184 5.693 -16.616 1.00 42.14 H new ATOM 0 HG21 ILE A 73 3.516 8.370 -16.475 1.00 55.14 H new ATOM 0 HG22 ILE A 73 2.524 7.678 -17.781 1.00 55.14 H new ATOM 0 HG23 ILE A 73 2.611 6.862 -16.201 1.00 55.14 H new ATOM 0 HD11 ILE A 73 6.692 7.285 -14.825 1.00 4.34 H new ATOM 0 HD12 ILE A 73 6.580 8.126 -16.389 1.00 4.34 H new ATOM 0 HD13 ILE A 73 5.236 8.227 -15.227 1.00 4.34 H new ATOM 1113 N PRO A 74 2.066 4.657 -19.666 1.00 12.34 N ATOM 1114 CA PRO A 74 1.093 4.876 -20.773 1.00 22.02 C ATOM 1115 C PRO A 74 0.282 6.193 -20.605 1.00 32.02 C ATOM 1116 O PRO A 74 0.097 6.652 -19.470 1.00 22.12 O ATOM 1117 CB PRO A 74 0.175 3.622 -20.690 1.00 24.24 C ATOM 1118 CG PRO A 74 1.021 2.582 -20.020 1.00 51.54 C ATOM 1119 CD PRO A 74 1.824 3.342 -19.001 1.00 45.25 C ATOM 0 HA PRO A 74 1.583 4.990 -21.740 1.00 22.02 H new ATOM 0 HB2 PRO A 74 -0.729 3.829 -20.116 1.00 24.24 H new ATOM 0 HB3 PRO A 74 -0.144 3.297 -21.680 1.00 24.24 H new ATOM 0 HG2 PRO A 74 0.406 1.815 -19.548 1.00 51.54 H new ATOM 0 HG3 PRO A 74 1.668 2.076 -20.737 1.00 51.54 H new ATOM 0 HD2 PRO A 74 1.278 3.459 -18.065 1.00 45.25 H new ATOM 0 HD3 PRO A 74 2.758 2.833 -18.764 1.00 45.25 H new ATOM 1127 N PRO A 75 -0.192 6.818 -21.739 1.00 21.52 N ATOM 1128 CA PRO A 75 -0.986 8.082 -21.724 1.00 42.32 C ATOM 1129 C PRO A 75 -2.131 8.079 -20.687 1.00 5.33 C ATOM 1130 O PRO A 75 -2.212 8.985 -19.854 1.00 2.12 O ATOM 1131 CB PRO A 75 -1.535 8.157 -23.168 1.00 31.11 C ATOM 1132 CG PRO A 75 -0.488 7.479 -24.001 1.00 62.12 C ATOM 1133 CD PRO A 75 0.043 6.351 -23.141 1.00 75.12 C ATOM 0 HA PRO A 75 -0.381 8.940 -21.432 1.00 42.32 H new ATOM 0 HB2 PRO A 75 -2.498 7.654 -23.254 1.00 31.11 H new ATOM 0 HB3 PRO A 75 -1.686 9.190 -23.483 1.00 31.11 H new ATOM 0 HG2 PRO A 75 -0.911 7.098 -24.931 1.00 62.12 H new ATOM 0 HG3 PRO A 75 0.307 8.173 -24.274 1.00 62.12 H new ATOM 0 HD2 PRO A 75 -0.480 5.416 -23.343 1.00 75.12 H new ATOM 0 HD3 PRO A 75 1.101 6.171 -23.329 1.00 75.12 H new ATOM 1141 N TYR A 76 -2.981 7.026 -20.727 1.00 71.55 N ATOM 1142 CA TYR A 76 -4.132 6.884 -19.804 1.00 21.10 C ATOM 1143 C TYR A 76 -3.679 6.786 -18.336 1.00 55.44 C ATOM 1144 O TYR A 76 -4.313 7.364 -17.462 1.00 2.50 O ATOM 1145 CB TYR A 76 -5.015 5.655 -20.172 1.00 62.02 C ATOM 1146 CG TYR A 76 -6.136 5.368 -19.147 1.00 41.53 C ATOM 1147 CD1 TYR A 76 -7.342 6.074 -19.178 1.00 2.34 C ATOM 1148 CD2 TYR A 76 -5.959 4.430 -18.121 1.00 63.31 C ATOM 1149 CE1 TYR A 76 -8.319 5.857 -18.226 1.00 43.23 C ATOM 1150 CE2 TYR A 76 -6.937 4.213 -17.179 1.00 35.31 C ATOM 1151 CZ TYR A 76 -8.111 4.924 -17.229 1.00 64.24 C ATOM 1152 OH TYR A 76 -9.080 4.723 -16.267 1.00 61.14 O ATOM 0 H TYR A 76 -2.890 6.258 -21.393 1.00 71.55 H new ATOM 0 HA TYR A 76 -4.733 7.787 -19.917 1.00 21.10 H new ATOM 0 HB2 TYR A 76 -5.464 5.821 -21.151 1.00 62.02 H new ATOM 0 HB3 TYR A 76 -4.379 4.774 -20.258 1.00 62.02 H new ATOM 0 HD1 TYR A 76 -7.513 6.801 -19.959 1.00 2.34 H new ATOM 0 HD2 TYR A 76 -5.038 3.868 -18.069 1.00 63.31 H new ATOM 0 HE1 TYR A 76 -9.243 6.415 -18.261 1.00 43.23 H new ATOM 0 HE2 TYR A 76 -6.782 3.483 -16.399 1.00 35.31 H new ATOM 0 HH TYR A 76 -9.833 4.234 -16.659 1.00 61.14 H new ATOM 1162 N ASP A 77 -2.603 6.026 -18.083 1.00 24.41 N ATOM 1163 CA ASP A 77 -2.087 5.789 -16.715 1.00 52.53 C ATOM 1164 C ASP A 77 -1.553 7.096 -16.094 1.00 13.51 C ATOM 1165 O ASP A 77 -1.567 7.270 -14.871 1.00 11.22 O ATOM 1166 CB ASP A 77 -0.983 4.692 -16.745 1.00 14.13 C ATOM 1167 CG ASP A 77 -1.478 3.274 -17.140 1.00 1.14 C ATOM 1168 OD1 ASP A 77 -2.556 3.138 -17.765 1.00 72.31 O ATOM 1169 OD2 ASP A 77 -0.767 2.287 -16.850 1.00 31.01 O ATOM 0 H ASP A 77 -2.065 5.558 -18.812 1.00 24.41 H new ATOM 0 HA ASP A 77 -2.907 5.438 -16.088 1.00 52.53 H new ATOM 0 HB2 ASP A 77 -0.207 4.998 -17.446 1.00 14.13 H new ATOM 0 HB3 ASP A 77 -0.519 4.637 -15.760 1.00 14.13 H new ATOM 1174 N ARG A 78 -1.087 8.011 -16.962 1.00 41.42 N ATOM 1175 CA ARG A 78 -0.668 9.371 -16.569 1.00 13.23 C ATOM 1176 C ARG A 78 -1.931 10.249 -16.317 1.00 10.20 C ATOM 1177 O ARG A 78 -1.972 11.038 -15.364 1.00 44.32 O ATOM 1178 CB ARG A 78 0.268 9.956 -17.677 1.00 63.43 C ATOM 1179 CG ARG A 78 1.232 11.095 -17.238 1.00 13.02 C ATOM 1180 CD ARG A 78 0.552 12.460 -17.017 1.00 2.03 C ATOM 1181 NE ARG A 78 1.513 13.499 -16.625 1.00 2.45 N ATOM 1182 CZ ARG A 78 1.205 14.775 -16.350 1.00 14.03 C ATOM 1183 NH1 ARG A 78 -0.058 15.212 -16.410 1.00 24.02 N ATOM 1184 NH2 ARG A 78 2.174 15.620 -16.038 1.00 32.21 N ATOM 0 H ARG A 78 -0.989 7.829 -17.961 1.00 41.42 H new ATOM 0 HA ARG A 78 -0.101 9.353 -15.638 1.00 13.23 H new ATOM 0 HB2 ARG A 78 0.866 9.141 -18.085 1.00 63.43 H new ATOM 0 HB3 ARG A 78 -0.356 10.330 -18.489 1.00 63.43 H new ATOM 0 HG2 ARG A 78 1.729 10.797 -16.315 1.00 13.02 H new ATOM 0 HG3 ARG A 78 2.008 11.209 -17.995 1.00 13.02 H new ATOM 0 HD2 ARG A 78 0.044 12.764 -17.932 1.00 2.03 H new ATOM 0 HD3 ARG A 78 -0.212 12.363 -16.245 1.00 2.03 H new ATOM 0 HE ARG A 78 2.494 13.228 -16.556 1.00 2.45 H new ATOM 0 HH11 ARG A 78 -0.808 14.571 -16.669 1.00 24.02 H new ATOM 0 HH12 ARG A 78 -0.271 16.186 -16.197 1.00 24.02 H new ATOM 0 HH21 ARG A 78 3.141 15.298 -16.009 1.00 32.21 H new ATOM 0 HH22 ARG A 78 1.954 16.593 -15.827 1.00 32.21 H new ATOM 1198 N ASP A 79 -2.966 10.066 -17.168 1.00 42.12 N ATOM 1199 CA ASP A 79 -4.279 10.764 -17.040 1.00 2.04 C ATOM 1200 C ASP A 79 -5.064 10.261 -15.807 1.00 45.43 C ATOM 1201 O ASP A 79 -5.954 10.952 -15.305 1.00 44.52 O ATOM 1202 CB ASP A 79 -5.146 10.592 -18.325 1.00 75.52 C ATOM 1203 CG ASP A 79 -4.601 11.350 -19.554 1.00 24.15 C ATOM 1204 OD1 ASP A 79 -4.375 10.732 -20.616 1.00 0.33 O ATOM 1205 OD2 ASP A 79 -4.400 12.576 -19.463 1.00 72.11 O ATOM 0 H ASP A 79 -2.921 9.431 -17.965 1.00 42.12 H new ATOM 0 HA ASP A 79 -4.063 11.824 -16.909 1.00 2.04 H new ATOM 0 HB2 ASP A 79 -5.214 9.531 -18.566 1.00 75.52 H new ATOM 0 HB3 ASP A 79 -6.159 10.938 -18.117 1.00 75.52 H new ATOM 1210 N PHE A 80 -4.735 9.039 -15.360 1.00 21.12 N ATOM 1211 CA PHE A 80 -5.315 8.405 -14.160 1.00 22.32 C ATOM 1212 C PHE A 80 -4.911 9.193 -12.896 1.00 2.44 C ATOM 1213 O PHE A 80 -5.687 9.314 -11.940 1.00 34.01 O ATOM 1214 CB PHE A 80 -4.836 6.919 -14.082 1.00 3.25 C ATOM 1215 CG PHE A 80 -5.367 6.128 -12.888 1.00 41.23 C ATOM 1216 CD1 PHE A 80 -6.605 5.494 -12.946 1.00 0.05 C ATOM 1217 CD2 PHE A 80 -4.633 6.030 -11.704 1.00 4.04 C ATOM 1218 CE1 PHE A 80 -7.089 4.791 -11.860 1.00 0.53 C ATOM 1219 CE2 PHE A 80 -5.123 5.330 -10.624 1.00 71.22 C ATOM 1220 CZ PHE A 80 -6.351 4.711 -10.701 1.00 71.43 C ATOM 0 H PHE A 80 -4.046 8.451 -15.829 1.00 21.12 H new ATOM 0 HA PHE A 80 -6.403 8.417 -14.223 1.00 22.32 H new ATOM 0 HB2 PHE A 80 -5.135 6.409 -14.998 1.00 3.25 H new ATOM 0 HB3 PHE A 80 -3.747 6.906 -14.051 1.00 3.25 H new ATOM 0 HD1 PHE A 80 -7.193 5.552 -13.850 1.00 0.05 H new ATOM 0 HD2 PHE A 80 -3.668 6.510 -11.634 1.00 4.04 H new ATOM 0 HE1 PHE A 80 -8.050 4.302 -11.921 1.00 0.53 H new ATOM 0 HE2 PHE A 80 -4.543 5.266 -9.715 1.00 71.22 H new ATOM 0 HZ PHE A 80 -6.734 4.163 -9.853 1.00 71.43 H new ATOM 1230 N CYS A 81 -3.691 9.744 -12.934 1.00 35.44 N ATOM 1231 CA CYS A 81 -3.104 10.520 -11.835 1.00 55.34 C ATOM 1232 C CYS A 81 -3.631 11.984 -11.810 1.00 74.30 C ATOM 1233 O CYS A 81 -3.342 12.727 -10.864 1.00 61.15 O ATOM 1234 CB CYS A 81 -1.566 10.488 -11.981 1.00 61.14 C ATOM 1235 SG CYS A 81 -0.859 8.818 -12.005 1.00 1.44 S ATOM 0 H CYS A 81 -3.075 9.662 -13.742 1.00 35.44 H new ATOM 0 HA CYS A 81 -3.398 10.071 -10.886 1.00 55.34 H new ATOM 0 HB2 CYS A 81 -1.288 11.002 -12.901 1.00 61.14 H new ATOM 0 HB3 CYS A 81 -1.122 11.047 -11.157 1.00 61.14 H new ATOM 0 HG CYS A 81 -1.152 8.239 -13.131 1.00 1.44 H new ATOM 1241 N LYS A 82 -4.405 12.385 -12.849 1.00 41.10 N ATOM 1242 CA LYS A 82 -5.010 13.734 -12.952 1.00 10.51 C ATOM 1243 C LYS A 82 -6.285 13.833 -12.090 1.00 10.12 C ATOM 1244 O LYS A 82 -7.411 13.834 -12.603 1.00 34.31 O ATOM 1245 CB LYS A 82 -5.326 14.066 -14.444 1.00 62.34 C ATOM 1246 CG LYS A 82 -4.090 14.210 -15.349 1.00 64.32 C ATOM 1247 CD LYS A 82 -3.208 15.416 -14.974 1.00 43.14 C ATOM 1248 CE LYS A 82 -3.942 16.762 -15.115 1.00 64.00 C ATOM 1249 NZ LYS A 82 -3.084 17.905 -14.696 1.00 73.32 N ATOM 0 H LYS A 82 -4.627 11.780 -13.640 1.00 41.10 H new ATOM 0 HA LYS A 82 -4.294 14.464 -12.574 1.00 10.51 H new ATOM 0 HB2 LYS A 82 -5.966 13.281 -14.848 1.00 62.34 H new ATOM 0 HB3 LYS A 82 -5.897 14.994 -14.482 1.00 62.34 H new ATOM 0 HG2 LYS A 82 -3.495 13.299 -15.290 1.00 64.32 H new ATOM 0 HG3 LYS A 82 -4.414 14.312 -16.385 1.00 64.32 H new ATOM 0 HD2 LYS A 82 -2.863 15.302 -13.946 1.00 43.14 H new ATOM 0 HD3 LYS A 82 -2.322 15.423 -15.609 1.00 43.14 H new ATOM 0 HE2 LYS A 82 -4.252 16.900 -16.151 1.00 64.00 H new ATOM 0 HE3 LYS A 82 -4.849 16.747 -14.510 1.00 64.00 H new ATOM 0 HZ1 LYS A 82 -3.613 18.794 -14.805 1.00 73.32 H new ATOM 0 HZ2 LYS A 82 -2.809 17.786 -13.700 1.00 73.32 H new ATOM 0 HZ3 LYS A 82 -2.231 17.935 -15.290 1.00 73.32 H new ATOM 1263 N VAL A 83 -6.084 13.886 -10.767 1.00 13.11 N ATOM 1264 CA VAL A 83 -7.171 13.934 -9.774 1.00 20.00 C ATOM 1265 C VAL A 83 -6.788 14.850 -8.607 1.00 64.23 C ATOM 1266 O VAL A 83 -5.601 15.075 -8.339 1.00 41.21 O ATOM 1267 CB VAL A 83 -7.537 12.501 -9.223 1.00 34.43 C ATOM 1268 CG1 VAL A 83 -8.383 11.706 -10.237 1.00 44.52 C ATOM 1269 CG2 VAL A 83 -6.271 11.712 -8.815 1.00 35.01 C ATOM 0 H VAL A 83 -5.154 13.897 -10.349 1.00 13.11 H new ATOM 0 HA VAL A 83 -8.050 14.332 -10.281 1.00 20.00 H new ATOM 0 HB VAL A 83 -8.142 12.643 -8.327 1.00 34.43 H new ATOM 0 HG11 VAL A 83 -8.617 10.724 -9.825 1.00 44.52 H new ATOM 0 HG12 VAL A 83 -9.309 12.244 -10.440 1.00 44.52 H new ATOM 0 HG13 VAL A 83 -7.822 11.586 -11.164 1.00 44.52 H new ATOM 0 HG21 VAL A 83 -6.559 10.730 -8.440 1.00 35.01 H new ATOM 0 HG22 VAL A 83 -5.621 11.593 -9.682 1.00 35.01 H new ATOM 0 HG23 VAL A 83 -5.739 12.256 -8.035 1.00 35.01 H new ATOM 1279 N ASP A 84 -7.817 15.353 -7.915 1.00 20.45 N ATOM 1280 CA ASP A 84 -7.658 16.247 -6.751 1.00 74.00 C ATOM 1281 C ASP A 84 -7.186 15.426 -5.538 1.00 64.42 C ATOM 1282 O ASP A 84 -7.395 14.211 -5.523 1.00 63.13 O ATOM 1283 CB ASP A 84 -9.017 16.949 -6.482 1.00 73.14 C ATOM 1284 CG ASP A 84 -9.013 17.972 -5.334 1.00 30.34 C ATOM 1285 OD1 ASP A 84 -10.003 18.035 -4.581 1.00 33.52 O ATOM 1286 OD2 ASP A 84 -8.019 18.716 -5.174 1.00 0.00 O ATOM 0 H ASP A 84 -8.791 15.153 -8.144 1.00 20.45 H new ATOM 0 HA ASP A 84 -6.906 17.012 -6.944 1.00 74.00 H new ATOM 0 HB2 ASP A 84 -9.333 17.453 -7.395 1.00 73.14 H new ATOM 0 HB3 ASP A 84 -9.764 16.186 -6.264 1.00 73.14 H new ATOM 1291 N GLN A 85 -6.573 16.092 -4.528 1.00 4.03 N ATOM 1292 CA GLN A 85 -5.944 15.412 -3.365 1.00 64.04 C ATOM 1293 C GLN A 85 -6.885 14.377 -2.666 1.00 21.14 C ATOM 1294 O GLN A 85 -6.492 13.217 -2.602 1.00 53.44 O ATOM 1295 CB GLN A 85 -5.352 16.439 -2.347 1.00 13.21 C ATOM 1296 CG GLN A 85 -4.096 17.190 -2.836 1.00 74.34 C ATOM 1297 CD GLN A 85 -2.895 16.263 -3.041 1.00 15.44 C ATOM 1298 OE1 GLN A 85 -2.673 15.730 -4.123 1.00 14.12 O ATOM 1299 NE2 GLN A 85 -2.125 16.049 -1.988 1.00 63.31 N ATOM 0 H GLN A 85 -6.500 17.109 -4.495 1.00 4.03 H new ATOM 0 HA GLN A 85 -5.116 14.831 -3.771 1.00 64.04 H new ATOM 0 HB2 GLN A 85 -6.122 17.170 -2.102 1.00 13.21 H new ATOM 0 HB3 GLN A 85 -5.107 15.913 -1.424 1.00 13.21 H new ATOM 0 HG2 GLN A 85 -4.323 17.697 -3.774 1.00 74.34 H new ATOM 0 HG3 GLN A 85 -3.834 17.962 -2.112 1.00 74.34 H new ATOM 0 HE21 GLN A 85 -2.335 16.507 -1.101 1.00 63.31 H new ATOM 0 HE22 GLN A 85 -1.321 15.426 -2.062 1.00 63.31 H new ATOM 1308 N PRO A 86 -8.144 14.729 -2.186 1.00 0.34 N ATOM 1309 CA PRO A 86 -9.074 13.724 -1.598 1.00 25.45 C ATOM 1310 C PRO A 86 -9.271 12.504 -2.526 1.00 53.01 C ATOM 1311 O PRO A 86 -9.061 11.375 -2.100 1.00 72.03 O ATOM 1312 CB PRO A 86 -10.390 14.514 -1.383 1.00 32.13 C ATOM 1313 CG PRO A 86 -9.936 15.930 -1.201 1.00 24.43 C ATOM 1314 CD PRO A 86 -8.757 16.092 -2.141 1.00 1.31 C ATOM 0 HA PRO A 86 -8.692 13.297 -0.671 1.00 25.45 H new ATOM 0 HB2 PRO A 86 -11.059 14.416 -2.238 1.00 32.13 H new ATOM 0 HB3 PRO A 86 -10.934 14.154 -0.510 1.00 32.13 H new ATOM 0 HG2 PRO A 86 -10.733 16.633 -1.443 1.00 24.43 H new ATOM 0 HG3 PRO A 86 -9.645 16.121 -0.168 1.00 24.43 H new ATOM 0 HD2 PRO A 86 -9.077 16.419 -3.130 1.00 1.31 H new ATOM 0 HD3 PRO A 86 -8.051 16.836 -1.772 1.00 1.31 H new ATOM 1322 N THR A 87 -9.544 12.779 -3.824 1.00 4.14 N ATOM 1323 CA THR A 87 -9.794 11.746 -4.855 1.00 71.01 C ATOM 1324 C THR A 87 -8.548 10.840 -5.079 1.00 24.23 C ATOM 1325 O THR A 87 -8.674 9.635 -5.335 1.00 62.32 O ATOM 1326 CB THR A 87 -10.204 12.425 -6.206 1.00 73.11 C ATOM 1327 OG1 THR A 87 -11.267 13.375 -5.985 1.00 51.12 O ATOM 1328 CG2 THR A 87 -10.655 11.406 -7.264 1.00 62.50 C ATOM 0 H THR A 87 -9.597 13.731 -4.186 1.00 4.14 H new ATOM 0 HA THR A 87 -10.608 11.114 -4.498 1.00 71.01 H new ATOM 0 HB THR A 87 -9.316 12.931 -6.584 1.00 73.11 H new ATOM 0 HG1 THR A 87 -11.513 13.794 -6.836 1.00 51.12 H new ATOM 0 HG21 THR A 87 -10.928 11.929 -8.180 1.00 62.50 H new ATOM 0 HG22 THR A 87 -9.840 10.712 -7.471 1.00 62.50 H new ATOM 0 HG23 THR A 87 -11.517 10.853 -6.892 1.00 62.50 H new ATOM 1336 N LEU A 88 -7.359 11.439 -4.935 1.00 3.34 N ATOM 1337 CA LEU A 88 -6.062 10.777 -5.175 1.00 44.10 C ATOM 1338 C LEU A 88 -5.776 9.773 -4.042 1.00 3.14 C ATOM 1339 O LEU A 88 -5.352 8.641 -4.290 1.00 14.02 O ATOM 1340 CB LEU A 88 -4.951 11.873 -5.300 1.00 32.22 C ATOM 1341 CG LEU A 88 -3.639 11.491 -6.076 1.00 51.44 C ATOM 1342 CD1 LEU A 88 -2.833 12.753 -6.445 1.00 64.50 C ATOM 1343 CD2 LEU A 88 -2.762 10.503 -5.289 1.00 31.30 C ATOM 0 H LEU A 88 -7.265 12.412 -4.644 1.00 3.34 H new ATOM 0 HA LEU A 88 -6.081 10.211 -6.107 1.00 44.10 H new ATOM 0 HB2 LEU A 88 -5.390 12.743 -5.789 1.00 32.22 H new ATOM 0 HB3 LEU A 88 -4.669 12.182 -4.294 1.00 32.22 H new ATOM 0 HG LEU A 88 -3.948 10.990 -6.993 1.00 51.44 H new ATOM 0 HD11 LEU A 88 -1.929 12.464 -6.981 1.00 64.50 H new ATOM 0 HD12 LEU A 88 -3.440 13.400 -7.079 1.00 64.50 H new ATOM 0 HD13 LEU A 88 -2.560 13.289 -5.536 1.00 64.50 H new ATOM 0 HD21 LEU A 88 -1.868 10.270 -5.867 1.00 31.30 H new ATOM 0 HD22 LEU A 88 -2.473 10.951 -4.338 1.00 31.30 H new ATOM 0 HD23 LEU A 88 -3.323 9.587 -5.103 1.00 31.30 H new ATOM 1355 N PHE A 89 -6.034 10.201 -2.796 1.00 31.02 N ATOM 1356 CA PHE A 89 -5.875 9.354 -1.600 1.00 0.44 C ATOM 1357 C PHE A 89 -6.997 8.305 -1.514 1.00 41.53 C ATOM 1358 O PHE A 89 -6.803 7.265 -0.901 1.00 45.21 O ATOM 1359 CB PHE A 89 -5.756 10.210 -0.313 1.00 32.32 C ATOM 1360 CG PHE A 89 -4.459 11.033 -0.256 1.00 42.21 C ATOM 1361 CD1 PHE A 89 -3.265 10.455 0.161 1.00 52.22 C ATOM 1362 CD2 PHE A 89 -4.432 12.370 -0.644 1.00 4.10 C ATOM 1363 CE1 PHE A 89 -2.095 11.186 0.183 1.00 14.41 C ATOM 1364 CE2 PHE A 89 -3.265 13.103 -0.618 1.00 71.25 C ATOM 1365 CZ PHE A 89 -2.094 12.511 -0.205 1.00 41.01 C ATOM 0 H PHE A 89 -6.359 11.145 -2.588 1.00 31.02 H new ATOM 0 HA PHE A 89 -4.938 8.806 -1.692 1.00 0.44 H new ATOM 0 HB2 PHE A 89 -6.610 10.884 -0.252 1.00 32.32 H new ATOM 0 HB3 PHE A 89 -5.803 9.556 0.557 1.00 32.32 H new ATOM 0 HD1 PHE A 89 -3.253 9.421 0.472 1.00 52.22 H new ATOM 0 HD2 PHE A 89 -5.346 12.843 -0.973 1.00 4.10 H new ATOM 0 HE1 PHE A 89 -1.176 10.720 0.505 1.00 14.41 H new ATOM 0 HE2 PHE A 89 -3.270 14.140 -0.921 1.00 71.25 H new ATOM 0 HZ PHE A 89 -1.177 13.081 -0.184 1.00 41.01 H new ATOM 1375 N GLU A 90 -8.177 8.604 -2.107 1.00 34.21 N ATOM 1376 CA GLU A 90 -9.258 7.608 -2.291 1.00 71.41 C ATOM 1377 C GLU A 90 -8.780 6.426 -3.169 1.00 53.44 C ATOM 1378 O GLU A 90 -9.204 5.293 -2.963 1.00 14.01 O ATOM 1379 CB GLU A 90 -10.531 8.231 -2.928 1.00 12.13 C ATOM 1380 CG GLU A 90 -11.296 9.229 -2.040 1.00 73.33 C ATOM 1381 CD GLU A 90 -11.822 8.611 -0.732 1.00 12.21 C ATOM 1382 OE1 GLU A 90 -12.746 7.768 -0.796 1.00 35.52 O ATOM 1383 OE2 GLU A 90 -11.317 8.959 0.358 1.00 34.21 O ATOM 0 H GLU A 90 -8.404 9.531 -2.467 1.00 34.21 H new ATOM 0 HA GLU A 90 -9.514 7.246 -1.295 1.00 71.41 H new ATOM 0 HB2 GLU A 90 -10.244 8.737 -3.850 1.00 12.13 H new ATOM 0 HB3 GLU A 90 -11.209 7.424 -3.205 1.00 12.13 H new ATOM 0 HG2 GLU A 90 -10.640 10.065 -1.799 1.00 73.33 H new ATOM 0 HG3 GLU A 90 -12.136 9.635 -2.604 1.00 73.33 H new ATOM 1390 N LEU A 91 -7.918 6.725 -4.162 1.00 12.23 N ATOM 1391 CA LEU A 91 -7.284 5.699 -5.024 1.00 2.05 C ATOM 1392 C LEU A 91 -6.277 4.833 -4.222 1.00 32.01 C ATOM 1393 O LEU A 91 -6.131 3.646 -4.497 1.00 53.50 O ATOM 1394 CB LEU A 91 -6.575 6.374 -6.235 1.00 53.21 C ATOM 1395 CG LEU A 91 -7.488 7.154 -7.238 1.00 51.01 C ATOM 1396 CD1 LEU A 91 -6.643 7.875 -8.320 1.00 61.43 C ATOM 1397 CD2 LEU A 91 -8.536 6.211 -7.869 1.00 72.41 C ATOM 0 H LEU A 91 -7.641 7.680 -4.391 1.00 12.23 H new ATOM 0 HA LEU A 91 -8.069 5.041 -5.396 1.00 2.05 H new ATOM 0 HB2 LEU A 91 -5.826 7.065 -5.849 1.00 53.21 H new ATOM 0 HB3 LEU A 91 -6.041 5.603 -6.790 1.00 53.21 H new ATOM 0 HG LEU A 91 -8.025 7.923 -6.683 1.00 51.01 H new ATOM 0 HD11 LEU A 91 -7.305 8.408 -9.003 1.00 61.43 H new ATOM 0 HD12 LEU A 91 -5.967 8.584 -7.841 1.00 61.43 H new ATOM 0 HD13 LEU A 91 -6.062 7.140 -8.878 1.00 61.43 H new ATOM 0 HD21 LEU A 91 -9.160 6.773 -8.563 1.00 72.41 H new ATOM 0 HD22 LEU A 91 -8.028 5.410 -8.405 1.00 72.41 H new ATOM 0 HD23 LEU A 91 -9.160 5.784 -7.084 1.00 72.41 H new ATOM 1409 N ILE A 92 -5.587 5.456 -3.237 1.00 13.51 N ATOM 1410 CA ILE A 92 -4.653 4.753 -2.316 1.00 52.33 C ATOM 1411 C ILE A 92 -5.442 3.850 -1.339 1.00 41.33 C ATOM 1412 O ILE A 92 -5.072 2.696 -1.100 1.00 24.05 O ATOM 1413 CB ILE A 92 -3.760 5.780 -1.503 1.00 71.54 C ATOM 1414 CG1 ILE A 92 -2.939 6.682 -2.480 1.00 4.22 C ATOM 1415 CG2 ILE A 92 -2.825 5.056 -0.495 1.00 23.15 C ATOM 1416 CD1 ILE A 92 -2.008 7.695 -1.827 1.00 53.35 C ATOM 0 H ILE A 92 -5.660 6.457 -3.056 1.00 13.51 H new ATOM 0 HA ILE A 92 -3.991 4.135 -2.922 1.00 52.33 H new ATOM 0 HB ILE A 92 -4.428 6.416 -0.923 1.00 71.54 H new ATOM 0 HG12 ILE A 92 -2.345 6.036 -3.127 1.00 4.22 H new ATOM 0 HG13 ILE A 92 -3.638 7.220 -3.121 1.00 4.22 H new ATOM 0 HG21 ILE A 92 -2.229 5.793 0.043 1.00 23.15 H new ATOM 0 HG22 ILE A 92 -3.426 4.487 0.215 1.00 23.15 H new ATOM 0 HG23 ILE A 92 -2.163 4.379 -1.035 1.00 23.15 H new ATOM 0 HD11 ILE A 92 -1.491 8.264 -2.599 1.00 53.35 H new ATOM 0 HD12 ILE A 92 -2.589 8.374 -1.203 1.00 53.35 H new ATOM 0 HD13 ILE A 92 -1.277 7.172 -1.210 1.00 53.35 H new ATOM 1428 N LEU A 93 -6.561 4.395 -0.817 1.00 34.24 N ATOM 1429 CA LEU A 93 -7.475 3.681 0.097 1.00 12.24 C ATOM 1430 C LEU A 93 -8.148 2.498 -0.633 1.00 72.44 C ATOM 1431 O LEU A 93 -8.362 1.444 -0.038 1.00 31.03 O ATOM 1432 CB LEU A 93 -8.543 4.666 0.677 1.00 54.43 C ATOM 1433 CG LEU A 93 -8.028 5.747 1.688 1.00 40.41 C ATOM 1434 CD1 LEU A 93 -9.138 6.768 2.042 1.00 64.54 C ATOM 1435 CD2 LEU A 93 -7.448 5.086 2.961 1.00 13.13 C ATOM 0 H LEU A 93 -6.857 5.350 -1.020 1.00 34.24 H new ATOM 0 HA LEU A 93 -6.898 3.280 0.930 1.00 12.24 H new ATOM 0 HB2 LEU A 93 -9.020 5.180 -0.157 1.00 54.43 H new ATOM 0 HB3 LEU A 93 -9.315 4.077 1.172 1.00 54.43 H new ATOM 0 HG LEU A 93 -7.223 6.297 1.200 1.00 40.41 H new ATOM 0 HD11 LEU A 93 -8.746 7.503 2.745 1.00 64.54 H new ATOM 0 HD12 LEU A 93 -9.469 7.274 1.135 1.00 64.54 H new ATOM 0 HD13 LEU A 93 -9.981 6.246 2.495 1.00 64.54 H new ATOM 0 HD21 LEU A 93 -7.098 5.859 3.645 1.00 13.13 H new ATOM 0 HD22 LEU A 93 -8.222 4.494 3.448 1.00 13.13 H new ATOM 0 HD23 LEU A 93 -6.614 4.439 2.688 1.00 13.13 H new ATOM 1447 N ALA A 94 -8.451 2.695 -1.933 1.00 41.12 N ATOM 1448 CA ALA A 94 -9.049 1.657 -2.796 1.00 23.55 C ATOM 1449 C ALA A 94 -7.998 0.617 -3.211 1.00 13.23 C ATOM 1450 O ALA A 94 -8.316 -0.553 -3.353 1.00 11.02 O ATOM 1451 CB ALA A 94 -9.706 2.291 -4.028 1.00 1.12 C ATOM 0 H ALA A 94 -8.287 3.580 -2.414 1.00 41.12 H new ATOM 0 HA ALA A 94 -9.822 1.143 -2.224 1.00 23.55 H new ATOM 0 HB1 ALA A 94 -10.141 1.510 -4.651 1.00 1.12 H new ATOM 0 HB2 ALA A 94 -10.489 2.979 -3.709 1.00 1.12 H new ATOM 0 HB3 ALA A 94 -8.956 2.836 -4.601 1.00 1.12 H new ATOM 1457 N ALA A 95 -6.740 1.064 -3.390 1.00 31.50 N ATOM 1458 CA ALA A 95 -5.614 0.168 -3.739 1.00 44.11 C ATOM 1459 C ALA A 95 -5.254 -0.751 -2.556 1.00 52.24 C ATOM 1460 O ALA A 95 -4.794 -1.872 -2.757 1.00 41.54 O ATOM 1461 CB ALA A 95 -4.390 0.983 -4.169 1.00 53.02 C ATOM 0 H ALA A 95 -6.475 2.045 -3.299 1.00 31.50 H new ATOM 0 HA ALA A 95 -5.929 -0.457 -4.575 1.00 44.11 H new ATOM 0 HB1 ALA A 95 -3.573 0.307 -4.421 1.00 53.02 H new ATOM 0 HB2 ALA A 95 -4.643 1.587 -5.040 1.00 53.02 H new ATOM 0 HB3 ALA A 95 -4.082 1.635 -3.352 1.00 53.02 H new ATOM 1467 N ASN A 96 -5.451 -0.233 -1.326 1.00 13.51 N ATOM 1468 CA ASN A 96 -5.222 -0.984 -0.068 1.00 73.14 C ATOM 1469 C ASN A 96 -6.418 -1.923 0.232 1.00 61.51 C ATOM 1470 O ASN A 96 -6.224 -3.083 0.613 1.00 74.11 O ATOM 1471 CB ASN A 96 -4.969 0.017 1.106 1.00 12.54 C ATOM 1472 CG ASN A 96 -4.612 -0.645 2.452 1.00 40.10 C ATOM 1473 OD1 ASN A 96 -4.095 -1.760 2.506 1.00 12.25 O ATOM 1474 ND2 ASN A 96 -4.820 0.071 3.548 1.00 75.43 N ATOM 0 H ASN A 96 -5.775 0.722 -1.174 1.00 13.51 H new ATOM 0 HA ASN A 96 -4.337 -1.610 -0.179 1.00 73.14 H new ATOM 0 HB2 ASN A 96 -4.161 0.691 0.823 1.00 12.54 H new ATOM 0 HB3 ASN A 96 -5.861 0.628 1.243 1.00 12.54 H new ATOM 0 HD21 ASN A 96 -4.550 -0.300 4.459 1.00 75.43 H new ATOM 0 HD22 ASN A 96 -5.250 0.993 3.481 1.00 75.43 H new ATOM 1481 N TYR A 97 -7.651 -1.404 0.020 1.00 64.35 N ATOM 1482 CA TYR A 97 -8.917 -2.152 0.253 1.00 30.44 C ATOM 1483 C TYR A 97 -9.050 -3.329 -0.731 1.00 45.44 C ATOM 1484 O TYR A 97 -9.487 -4.419 -0.351 1.00 55.32 O ATOM 1485 CB TYR A 97 -10.145 -1.194 0.126 1.00 31.24 C ATOM 1486 CG TYR A 97 -11.532 -1.877 0.218 1.00 74.22 C ATOM 1487 CD1 TYR A 97 -12.412 -1.901 -0.876 1.00 32.33 C ATOM 1488 CD2 TYR A 97 -11.951 -2.507 1.394 1.00 24.53 C ATOM 1489 CE1 TYR A 97 -13.646 -2.528 -0.796 1.00 72.34 C ATOM 1490 CE2 TYR A 97 -13.187 -3.131 1.475 1.00 0.25 C ATOM 1491 CZ TYR A 97 -14.030 -3.141 0.378 1.00 61.05 C ATOM 1492 OH TYR A 97 -15.259 -3.769 0.456 1.00 65.31 O ATOM 0 H TYR A 97 -7.800 -0.453 -0.318 1.00 64.35 H new ATOM 0 HA TYR A 97 -8.892 -2.557 1.265 1.00 30.44 H new ATOM 0 HB2 TYR A 97 -10.078 -0.439 0.909 1.00 31.24 H new ATOM 0 HB3 TYR A 97 -10.079 -0.671 -0.828 1.00 31.24 H new ATOM 0 HD1 TYR A 97 -12.122 -1.421 -1.799 1.00 32.33 H new ATOM 0 HD2 TYR A 97 -11.300 -2.508 2.256 1.00 24.53 H new ATOM 0 HE1 TYR A 97 -14.305 -2.536 -1.651 1.00 72.34 H new ATOM 0 HE2 TYR A 97 -13.491 -3.609 2.394 1.00 0.25 H new ATOM 0 HH TYR A 97 -15.375 -4.151 1.351 1.00 65.31 H new ATOM 1502 N LEU A 98 -8.671 -3.085 -1.996 1.00 52.23 N ATOM 1503 CA LEU A 98 -8.728 -4.096 -3.076 1.00 12.44 C ATOM 1504 C LEU A 98 -7.401 -4.874 -3.173 1.00 52.04 C ATOM 1505 O LEU A 98 -7.285 -5.826 -3.962 1.00 0.44 O ATOM 1506 CB LEU A 98 -9.081 -3.414 -4.429 1.00 73.14 C ATOM 1507 CG LEU A 98 -10.431 -2.627 -4.464 1.00 41.33 C ATOM 1508 CD1 LEU A 98 -10.731 -2.055 -5.869 1.00 23.10 C ATOM 1509 CD2 LEU A 98 -11.585 -3.502 -3.944 1.00 33.15 C ATOM 0 H LEU A 98 -8.315 -2.180 -2.304 1.00 52.23 H new ATOM 0 HA LEU A 98 -9.512 -4.815 -2.839 1.00 12.44 H new ATOM 0 HB2 LEU A 98 -8.275 -2.727 -4.689 1.00 73.14 H new ATOM 0 HB3 LEU A 98 -9.109 -4.180 -5.204 1.00 73.14 H new ATOM 0 HG LEU A 98 -10.333 -1.771 -3.796 1.00 41.33 H new ATOM 0 HD11 LEU A 98 -11.678 -1.516 -5.848 1.00 23.10 H new ATOM 0 HD12 LEU A 98 -9.932 -1.374 -6.163 1.00 23.10 H new ATOM 0 HD13 LEU A 98 -10.794 -2.871 -6.588 1.00 23.10 H new ATOM 0 HD21 LEU A 98 -12.515 -2.935 -3.977 1.00 33.15 H new ATOM 0 HD22 LEU A 98 -11.679 -4.390 -4.570 1.00 33.15 H new ATOM 0 HD23 LEU A 98 -11.379 -3.802 -2.917 1.00 33.15 H new ATOM 1521 N ASP A 99 -6.410 -4.432 -2.364 1.00 33.51 N ATOM 1522 CA ASP A 99 -5.105 -5.100 -2.165 1.00 62.40 C ATOM 1523 C ASP A 99 -4.294 -5.169 -3.482 1.00 25.41 C ATOM 1524 O ASP A 99 -3.434 -6.036 -3.667 1.00 55.21 O ATOM 1525 CB ASP A 99 -5.317 -6.504 -1.507 1.00 4.23 C ATOM 1526 CG ASP A 99 -4.074 -7.049 -0.769 1.00 61.14 C ATOM 1527 OD1 ASP A 99 -3.753 -6.514 0.324 1.00 54.30 O ATOM 1528 OD2 ASP A 99 -3.451 -8.030 -1.237 1.00 52.12 O ATOM 0 H ASP A 99 -6.500 -3.576 -1.817 1.00 33.51 H new ATOM 0 HA ASP A 99 -4.504 -4.504 -1.478 1.00 62.40 H new ATOM 0 HB2 ASP A 99 -6.146 -6.442 -0.802 1.00 4.23 H new ATOM 0 HB3 ASP A 99 -5.608 -7.215 -2.280 1.00 4.23 H new ATOM 1533 N ILE A 100 -4.561 -4.203 -4.385 1.00 4.25 N ATOM 1534 CA ILE A 100 -3.868 -4.095 -5.671 1.00 51.44 C ATOM 1535 C ILE A 100 -2.530 -3.380 -5.441 1.00 53.12 C ATOM 1536 O ILE A 100 -2.459 -2.147 -5.459 1.00 4.40 O ATOM 1537 CB ILE A 100 -4.711 -3.334 -6.763 1.00 72.44 C ATOM 1538 CG1 ILE A 100 -6.180 -3.831 -6.758 1.00 43.21 C ATOM 1539 CG2 ILE A 100 -4.073 -3.506 -8.169 1.00 74.34 C ATOM 1540 CD1 ILE A 100 -7.091 -3.158 -7.767 1.00 55.33 C ATOM 0 H ILE A 100 -5.264 -3.479 -4.236 1.00 4.25 H new ATOM 0 HA ILE A 100 -3.711 -5.103 -6.056 1.00 51.44 H new ATOM 0 HB ILE A 100 -4.709 -2.271 -6.520 1.00 72.44 H new ATOM 0 HG12 ILE A 100 -6.185 -4.904 -6.947 1.00 43.21 H new ATOM 0 HG13 ILE A 100 -6.594 -3.681 -5.761 1.00 43.21 H new ATOM 0 HG21 ILE A 100 -4.671 -2.973 -8.908 1.00 74.34 H new ATOM 0 HG22 ILE A 100 -3.061 -3.102 -8.161 1.00 74.34 H new ATOM 0 HG23 ILE A 100 -4.039 -4.565 -8.426 1.00 74.34 H new ATOM 0 HD11 ILE A 100 -8.095 -3.574 -7.685 1.00 55.33 H new ATOM 0 HD12 ILE A 100 -7.125 -2.087 -7.569 1.00 55.33 H new ATOM 0 HD13 ILE A 100 -6.709 -3.329 -8.773 1.00 55.33 H new ATOM 1552 N LYS A 101 -1.501 -4.185 -5.155 1.00 41.20 N ATOM 1553 CA LYS A 101 -0.129 -3.716 -4.912 1.00 43.54 C ATOM 1554 C LYS A 101 0.481 -2.922 -6.115 1.00 44.33 C ATOM 1555 O LYS A 101 1.122 -1.893 -5.865 1.00 43.13 O ATOM 1556 CB LYS A 101 0.772 -4.914 -4.517 1.00 20.41 C ATOM 1557 CG LYS A 101 2.165 -4.509 -3.995 1.00 70.53 C ATOM 1558 CD LYS A 101 3.052 -5.720 -3.652 1.00 52.41 C ATOM 1559 CE LYS A 101 4.392 -5.288 -3.054 1.00 21.22 C ATOM 1560 NZ LYS A 101 4.218 -4.552 -1.775 1.00 72.03 N ATOM 0 H LYS A 101 -1.598 -5.198 -5.084 1.00 41.20 H new ATOM 0 HA LYS A 101 -0.175 -3.006 -4.087 1.00 43.54 H new ATOM 0 HB2 LYS A 101 0.264 -5.499 -3.750 1.00 20.41 H new ATOM 0 HB3 LYS A 101 0.895 -5.563 -5.384 1.00 20.41 H new ATOM 0 HG2 LYS A 101 2.666 -3.899 -4.747 1.00 70.53 H new ATOM 0 HG3 LYS A 101 2.048 -3.888 -3.107 1.00 70.53 H new ATOM 0 HD2 LYS A 101 2.530 -6.365 -2.946 1.00 52.41 H new ATOM 0 HD3 LYS A 101 3.228 -6.309 -4.552 1.00 52.41 H new ATOM 0 HE2 LYS A 101 5.014 -6.167 -2.885 1.00 21.22 H new ATOM 0 HE3 LYS A 101 4.921 -4.656 -3.767 1.00 21.22 H new ATOM 0 HZ1 LYS A 101 5.151 -4.307 -1.386 1.00 72.03 H new ATOM 0 HZ2 LYS A 101 3.675 -3.682 -1.946 1.00 72.03 H new ATOM 0 HZ3 LYS A 101 3.707 -5.151 -1.096 1.00 72.03 H new ATOM 1574 N PRO A 102 0.316 -3.349 -7.425 1.00 51.50 N ATOM 1575 CA PRO A 102 0.823 -2.543 -8.575 1.00 20.45 C ATOM 1576 C PRO A 102 0.198 -1.127 -8.634 1.00 61.20 C ATOM 1577 O PRO A 102 0.906 -0.154 -8.892 1.00 21.42 O ATOM 1578 CB PRO A 102 0.450 -3.388 -9.822 1.00 41.54 C ATOM 1579 CG PRO A 102 -0.610 -4.345 -9.352 1.00 52.34 C ATOM 1580 CD PRO A 102 -0.287 -4.635 -7.908 1.00 35.33 C ATOM 0 HA PRO A 102 1.894 -2.358 -8.497 1.00 20.45 H new ATOM 0 HB2 PRO A 102 0.079 -2.756 -10.629 1.00 41.54 H new ATOM 0 HB3 PRO A 102 1.318 -3.922 -10.209 1.00 41.54 H new ATOM 0 HG2 PRO A 102 -1.604 -3.908 -9.451 1.00 52.34 H new ATOM 0 HG3 PRO A 102 -0.603 -5.259 -9.946 1.00 52.34 H new ATOM 0 HD2 PRO A 102 -1.180 -4.899 -7.341 1.00 35.33 H new ATOM 0 HD3 PRO A 102 0.410 -5.468 -7.811 1.00 35.33 H new ATOM 1588 N LEU A 103 -1.126 -1.030 -8.363 1.00 3.01 N ATOM 1589 CA LEU A 103 -1.859 0.255 -8.360 1.00 73.23 C ATOM 1590 C LEU A 103 -1.360 1.153 -7.218 1.00 21.44 C ATOM 1591 O LEU A 103 -1.133 2.353 -7.414 1.00 50.20 O ATOM 1592 CB LEU A 103 -3.383 0.015 -8.201 1.00 41.35 C ATOM 1593 CG LEU A 103 -4.276 1.295 -8.116 1.00 25.41 C ATOM 1594 CD1 LEU A 103 -4.137 2.156 -9.382 1.00 42.43 C ATOM 1595 CD2 LEU A 103 -5.749 0.939 -7.826 1.00 70.43 C ATOM 0 H LEU A 103 -1.711 -1.836 -8.142 1.00 3.01 H new ATOM 0 HA LEU A 103 -1.676 0.751 -9.313 1.00 73.23 H new ATOM 0 HB2 LEU A 103 -3.725 -0.587 -9.043 1.00 41.35 H new ATOM 0 HB3 LEU A 103 -3.545 -0.577 -7.300 1.00 41.35 H new ATOM 0 HG LEU A 103 -3.919 1.891 -7.276 1.00 25.41 H new ATOM 0 HD11 LEU A 103 -4.770 3.039 -9.293 1.00 42.43 H new ATOM 0 HD12 LEU A 103 -3.098 2.465 -9.500 1.00 42.43 H new ATOM 0 HD13 LEU A 103 -4.444 1.576 -10.252 1.00 42.43 H new ATOM 0 HD21 LEU A 103 -6.341 1.853 -7.774 1.00 70.43 H new ATOM 0 HD22 LEU A 103 -6.133 0.303 -8.623 1.00 70.43 H new ATOM 0 HD23 LEU A 103 -5.815 0.409 -6.876 1.00 70.43 H new ATOM 1607 N LEU A 104 -1.193 0.529 -6.035 1.00 3.11 N ATOM 1608 CA LEU A 104 -0.677 1.184 -4.824 1.00 61.02 C ATOM 1609 C LEU A 104 0.686 1.827 -5.113 1.00 10.15 C ATOM 1610 O LEU A 104 0.907 2.988 -4.786 1.00 13.44 O ATOM 1611 CB LEU A 104 -0.548 0.141 -3.677 1.00 44.41 C ATOM 1612 CG LEU A 104 -0.011 0.664 -2.304 1.00 51.21 C ATOM 1613 CD1 LEU A 104 -0.998 1.656 -1.644 1.00 42.14 C ATOM 1614 CD2 LEU A 104 0.339 -0.517 -1.369 1.00 71.12 C ATOM 0 H LEU A 104 -1.417 -0.456 -5.896 1.00 3.11 H new ATOM 0 HA LEU A 104 -1.372 1.965 -4.516 1.00 61.02 H new ATOM 0 HB2 LEU A 104 -1.529 -0.304 -3.511 1.00 44.41 H new ATOM 0 HB3 LEU A 104 0.111 -0.658 -4.017 1.00 44.41 H new ATOM 0 HG LEU A 104 0.908 1.220 -2.491 1.00 51.21 H new ATOM 0 HD11 LEU A 104 -0.590 1.997 -0.693 1.00 42.14 H new ATOM 0 HD12 LEU A 104 -1.148 2.512 -2.302 1.00 42.14 H new ATOM 0 HD13 LEU A 104 -1.953 1.159 -1.472 1.00 42.14 H new ATOM 0 HD21 LEU A 104 0.711 -0.132 -0.420 1.00 71.12 H new ATOM 0 HD22 LEU A 104 -0.553 -1.118 -1.192 1.00 71.12 H new ATOM 0 HD23 LEU A 104 1.106 -1.135 -1.835 1.00 71.12 H new ATOM 1626 N ASP A 105 1.550 1.061 -5.806 1.00 42.34 N ATOM 1627 CA ASP A 105 2.923 1.468 -6.146 1.00 15.23 C ATOM 1628 C ASP A 105 2.933 2.684 -7.090 1.00 63.42 C ATOM 1629 O ASP A 105 3.634 3.660 -6.825 1.00 55.52 O ATOM 1630 CB ASP A 105 3.692 0.277 -6.778 1.00 33.33 C ATOM 1631 CG ASP A 105 5.162 0.615 -7.100 1.00 52.25 C ATOM 1632 OD1 ASP A 105 5.491 0.915 -8.275 1.00 25.33 O ATOM 1633 OD2 ASP A 105 6.002 0.591 -6.171 1.00 51.33 O ATOM 0 H ASP A 105 1.309 0.131 -6.149 1.00 42.34 H new ATOM 0 HA ASP A 105 3.426 1.764 -5.225 1.00 15.23 H new ATOM 0 HB2 ASP A 105 3.661 -0.572 -6.095 1.00 33.33 H new ATOM 0 HB3 ASP A 105 3.186 -0.031 -7.693 1.00 33.33 H new ATOM 1638 N VAL A 106 2.129 2.614 -8.174 1.00 34.31 N ATOM 1639 CA VAL A 106 2.009 3.705 -9.172 1.00 15.04 C ATOM 1640 C VAL A 106 1.577 5.025 -8.497 1.00 72.41 C ATOM 1641 O VAL A 106 2.209 6.068 -8.694 1.00 0.22 O ATOM 1642 CB VAL A 106 0.991 3.321 -10.318 1.00 0.14 C ATOM 1643 CG1 VAL A 106 0.724 4.494 -11.301 1.00 53.53 C ATOM 1644 CG2 VAL A 106 1.475 2.067 -11.085 1.00 14.23 C ATOM 0 H VAL A 106 1.546 1.804 -8.383 1.00 34.31 H new ATOM 0 HA VAL A 106 2.992 3.849 -9.620 1.00 15.04 H new ATOM 0 HB VAL A 106 0.043 3.094 -9.831 1.00 0.14 H new ATOM 0 HG11 VAL A 106 0.018 4.173 -12.067 1.00 53.53 H new ATOM 0 HG12 VAL A 106 0.307 5.339 -10.754 1.00 53.53 H new ATOM 0 HG13 VAL A 106 1.660 4.793 -11.773 1.00 53.53 H new ATOM 0 HG21 VAL A 106 0.759 1.821 -11.869 1.00 14.23 H new ATOM 0 HG22 VAL A 106 2.448 2.267 -11.533 1.00 14.23 H new ATOM 0 HG23 VAL A 106 1.559 1.228 -10.394 1.00 14.23 H new ATOM 1654 N THR A 107 0.523 4.942 -7.670 1.00 23.34 N ATOM 1655 CA THR A 107 -0.056 6.108 -6.978 1.00 33.32 C ATOM 1656 C THR A 107 0.888 6.647 -5.863 1.00 33.23 C ATOM 1657 O THR A 107 0.933 7.862 -5.605 1.00 13.01 O ATOM 1658 CB THR A 107 -1.464 5.738 -6.400 1.00 42.42 C ATOM 1659 OG1 THR A 107 -2.227 5.050 -7.411 1.00 34.40 O ATOM 1660 CG2 THR A 107 -2.266 6.971 -5.956 1.00 2.14 C ATOM 0 H THR A 107 0.047 4.065 -7.461 1.00 23.34 H new ATOM 0 HA THR A 107 -0.174 6.912 -7.705 1.00 33.32 H new ATOM 0 HB THR A 107 -1.293 5.110 -5.526 1.00 42.42 H new ATOM 0 HG1 THR A 107 -1.951 4.110 -7.446 1.00 34.40 H new ATOM 0 HG21 THR A 107 -3.233 6.655 -5.564 1.00 2.14 H new ATOM 0 HG22 THR A 107 -1.716 7.502 -5.179 1.00 2.14 H new ATOM 0 HG23 THR A 107 -2.419 7.632 -6.809 1.00 2.14 H new ATOM 1668 N CYS A 108 1.672 5.735 -5.241 1.00 25.34 N ATOM 1669 CA CYS A 108 2.681 6.088 -4.215 1.00 74.15 C ATOM 1670 C CYS A 108 3.908 6.780 -4.851 1.00 14.51 C ATOM 1671 O CYS A 108 4.579 7.587 -4.200 1.00 34.55 O ATOM 1672 CB CYS A 108 3.121 4.838 -3.412 1.00 73.11 C ATOM 1673 SG CYS A 108 1.831 4.145 -2.349 1.00 10.43 S ATOM 0 H CYS A 108 1.623 4.735 -5.436 1.00 25.34 H new ATOM 0 HA CYS A 108 2.214 6.791 -3.525 1.00 74.15 H new ATOM 0 HB2 CYS A 108 3.452 4.069 -4.111 1.00 73.11 H new ATOM 0 HB3 CYS A 108 3.981 5.100 -2.796 1.00 73.11 H new ATOM 0 HG CYS A 108 0.960 3.514 -3.079 1.00 10.43 H new ATOM 1679 N LYS A 109 4.206 6.439 -6.117 1.00 10.52 N ATOM 1680 CA LYS A 109 5.268 7.102 -6.901 1.00 24.44 C ATOM 1681 C LYS A 109 4.795 8.502 -7.336 1.00 12.22 C ATOM 1682 O LYS A 109 5.567 9.455 -7.275 1.00 54.02 O ATOM 1683 CB LYS A 109 5.699 6.219 -8.129 1.00 43.21 C ATOM 1684 CG LYS A 109 6.911 5.275 -7.878 1.00 70.24 C ATOM 1685 CD LYS A 109 6.766 4.403 -6.608 1.00 52.14 C ATOM 1686 CE LYS A 109 7.946 3.437 -6.414 1.00 3.11 C ATOM 1687 NZ LYS A 109 8.012 2.418 -7.498 1.00 0.54 N ATOM 0 H LYS A 109 3.721 5.700 -6.626 1.00 10.52 H new ATOM 0 HA LYS A 109 6.152 7.221 -6.275 1.00 24.44 H new ATOM 0 HB2 LYS A 109 4.846 5.614 -8.437 1.00 43.21 H new ATOM 0 HB3 LYS A 109 5.940 6.879 -8.963 1.00 43.21 H new ATOM 0 HG2 LYS A 109 7.039 4.624 -8.743 1.00 70.24 H new ATOM 0 HG3 LYS A 109 7.817 5.875 -7.795 1.00 70.24 H new ATOM 0 HD2 LYS A 109 6.685 5.051 -5.735 1.00 52.14 H new ATOM 0 HD3 LYS A 109 5.840 3.831 -6.668 1.00 52.14 H new ATOM 0 HE2 LYS A 109 8.878 4.002 -6.389 1.00 3.11 H new ATOM 0 HE3 LYS A 109 7.851 2.937 -5.450 1.00 3.11 H new ATOM 0 HZ1 LYS A 109 8.473 1.558 -7.138 1.00 0.54 H new ATOM 0 HZ2 LYS A 109 7.049 2.187 -7.816 1.00 0.54 H new ATOM 0 HZ3 LYS A 109 8.560 2.796 -8.297 1.00 0.54 H new ATOM 1701 N THR A 110 3.506 8.611 -7.726 1.00 0.44 N ATOM 1702 CA THR A 110 2.890 9.881 -8.162 1.00 21.01 C ATOM 1703 C THR A 110 2.957 10.959 -7.054 1.00 60.24 C ATOM 1704 O THR A 110 3.415 12.080 -7.308 1.00 64.01 O ATOM 1705 CB THR A 110 1.408 9.658 -8.610 1.00 0.25 C ATOM 1706 OG1 THR A 110 1.369 8.712 -9.690 1.00 72.11 O ATOM 1707 CG2 THR A 110 0.720 10.966 -9.055 1.00 4.12 C ATOM 0 H THR A 110 2.864 7.819 -7.747 1.00 0.44 H new ATOM 0 HA THR A 110 3.464 10.241 -9.016 1.00 21.01 H new ATOM 0 HB THR A 110 0.864 9.278 -7.745 1.00 0.25 H new ATOM 0 HG1 THR A 110 0.615 8.921 -10.281 1.00 72.11 H new ATOM 0 HG21 THR A 110 -0.306 10.753 -9.355 1.00 4.12 H new ATOM 0 HG22 THR A 110 0.716 11.675 -8.227 1.00 4.12 H new ATOM 0 HG23 THR A 110 1.263 11.395 -9.897 1.00 4.12 H new ATOM 1715 N VAL A 111 2.529 10.596 -5.820 1.00 1.52 N ATOM 1716 CA VAL A 111 2.575 11.517 -4.661 1.00 72.21 C ATOM 1717 C VAL A 111 4.031 11.901 -4.326 1.00 3.43 C ATOM 1718 O VAL A 111 4.307 13.065 -4.025 1.00 34.42 O ATOM 1719 CB VAL A 111 1.843 10.933 -3.387 1.00 31.35 C ATOM 1720 CG1 VAL A 111 0.324 10.796 -3.620 1.00 74.54 C ATOM 1721 CG2 VAL A 111 2.439 9.582 -2.950 1.00 23.53 C ATOM 0 H VAL A 111 2.149 9.674 -5.604 1.00 1.52 H new ATOM 0 HA VAL A 111 2.031 12.415 -4.952 1.00 72.21 H new ATOM 0 HB VAL A 111 2.004 11.648 -2.580 1.00 31.35 H new ATOM 0 HG11 VAL A 111 -0.147 10.392 -2.724 1.00 74.54 H new ATOM 0 HG12 VAL A 111 -0.100 11.775 -3.842 1.00 74.54 H new ATOM 0 HG13 VAL A 111 0.144 10.124 -4.459 1.00 74.54 H new ATOM 0 HG21 VAL A 111 1.907 9.217 -2.072 1.00 23.53 H new ATOM 0 HG22 VAL A 111 2.339 8.861 -3.761 1.00 23.53 H new ATOM 0 HG23 VAL A 111 3.494 9.711 -2.708 1.00 23.53 H new ATOM 1731 N ALA A 112 4.949 10.923 -4.459 1.00 23.12 N ATOM 1732 CA ALA A 112 6.390 11.119 -4.214 1.00 61.43 C ATOM 1733 C ALA A 112 7.021 12.075 -5.247 1.00 21.21 C ATOM 1734 O ALA A 112 8.006 12.749 -4.948 1.00 51.32 O ATOM 1735 CB ALA A 112 7.104 9.765 -4.210 1.00 40.55 C ATOM 0 H ALA A 112 4.710 9.972 -4.740 1.00 23.12 H new ATOM 0 HA ALA A 112 6.509 11.586 -3.236 1.00 61.43 H new ATOM 0 HB1 ALA A 112 8.168 9.915 -4.029 1.00 40.55 H new ATOM 0 HB2 ALA A 112 6.687 9.136 -3.423 1.00 40.55 H new ATOM 0 HB3 ALA A 112 6.966 9.278 -5.175 1.00 40.55 H new ATOM 1741 N ASN A 113 6.431 12.115 -6.459 1.00 42.14 N ATOM 1742 CA ASN A 113 6.871 13.001 -7.559 1.00 11.34 C ATOM 1743 C ASN A 113 6.331 14.436 -7.381 1.00 33.12 C ATOM 1744 O ASN A 113 7.000 15.404 -7.758 1.00 72.42 O ATOM 1745 CB ASN A 113 6.424 12.430 -8.936 1.00 24.12 C ATOM 1746 CG ASN A 113 7.125 11.126 -9.325 1.00 41.33 C ATOM 1747 OD1 ASN A 113 8.288 10.898 -8.980 1.00 31.55 O ATOM 1748 ND2 ASN A 113 6.423 10.252 -10.045 1.00 3.24 N ATOM 0 H ASN A 113 5.632 11.531 -6.705 1.00 42.14 H new ATOM 0 HA ASN A 113 7.960 13.043 -7.529 1.00 11.34 H new ATOM 0 HB2 ASN A 113 5.348 12.260 -8.915 1.00 24.12 H new ATOM 0 HB3 ASN A 113 6.614 13.177 -9.707 1.00 24.12 H new ATOM 0 HD21 ASN A 113 6.845 9.367 -10.326 1.00 3.24 H new ATOM 0 HD22 ASN A 113 5.464 10.468 -10.315 1.00 3.24 H new ATOM 1755 N MET A 114 5.116 14.565 -6.810 1.00 33.43 N ATOM 1756 CA MET A 114 4.473 15.883 -6.582 1.00 73.52 C ATOM 1757 C MET A 114 5.189 16.650 -5.458 1.00 75.01 C ATOM 1758 O MET A 114 5.368 17.867 -5.532 1.00 55.12 O ATOM 1759 CB MET A 114 2.970 15.729 -6.231 1.00 50.15 C ATOM 1760 CG MET A 114 2.110 15.063 -7.316 1.00 3.42 C ATOM 1761 SD MET A 114 0.336 15.157 -6.957 1.00 33.41 S ATOM 1762 CE MET A 114 0.231 14.477 -5.297 1.00 23.12 C ATOM 0 H MET A 114 4.556 13.772 -6.496 1.00 33.43 H new ATOM 0 HA MET A 114 4.554 16.448 -7.511 1.00 73.52 H new ATOM 0 HB2 MET A 114 2.885 15.146 -5.314 1.00 50.15 H new ATOM 0 HB3 MET A 114 2.560 16.716 -6.020 1.00 50.15 H new ATOM 0 HG2 MET A 114 2.308 15.541 -8.275 1.00 3.42 H new ATOM 0 HG3 MET A 114 2.402 14.017 -7.414 1.00 3.42 H new ATOM 0 HE1 MET A 114 -0.291 13.521 -5.328 1.00 23.12 H new ATOM 0 HE2 MET A 114 1.235 14.329 -4.900 1.00 23.12 H new ATOM 0 HE3 MET A 114 -0.315 15.168 -4.655 1.00 23.12 H new ATOM 1772 N ILE A 115 5.590 15.912 -4.417 1.00 22.45 N ATOM 1773 CA ILE A 115 6.288 16.472 -3.242 1.00 3.31 C ATOM 1774 C ILE A 115 7.821 16.481 -3.442 1.00 25.14 C ATOM 1775 O ILE A 115 8.546 16.932 -2.551 1.00 21.55 O ATOM 1776 CB ILE A 115 5.958 15.633 -1.953 1.00 4.53 C ATOM 1777 CG1 ILE A 115 6.586 14.213 -2.086 1.00 4.13 C ATOM 1778 CG2 ILE A 115 4.428 15.558 -1.706 1.00 62.44 C ATOM 1779 CD1 ILE A 115 6.321 13.267 -0.953 1.00 12.03 C ATOM 0 H ILE A 115 5.441 14.904 -4.360 1.00 22.45 H new ATOM 0 HA ILE A 115 5.938 17.497 -3.123 1.00 3.31 H new ATOM 0 HB ILE A 115 6.393 16.129 -1.085 1.00 4.53 H new ATOM 0 HG12 ILE A 115 6.217 13.759 -3.006 1.00 4.13 H new ATOM 0 HG13 ILE A 115 7.665 14.324 -2.196 1.00 4.13 H new ATOM 0 HG21 ILE A 115 4.233 14.972 -0.808 1.00 62.44 H new ATOM 0 HG22 ILE A 115 4.031 16.565 -1.575 1.00 62.44 H new ATOM 0 HG23 ILE A 115 3.944 15.085 -2.561 1.00 62.44 H new ATOM 0 HD11 ILE A 115 6.806 12.312 -1.155 1.00 12.03 H new ATOM 0 HD12 ILE A 115 6.717 13.687 -0.028 1.00 12.03 H new ATOM 0 HD13 ILE A 115 5.247 13.114 -0.851 1.00 12.03 H new ATOM 1791 N ARG A 116 8.294 15.950 -4.596 1.00 52.22 N ATOM 1792 CA ARG A 116 9.723 15.663 -4.833 1.00 21.52 C ATOM 1793 C ARG A 116 10.581 16.936 -4.719 1.00 4.11 C ATOM 1794 O ARG A 116 10.624 17.752 -5.646 1.00 55.13 O ATOM 1795 CB ARG A 116 9.925 14.988 -6.222 1.00 62.35 C ATOM 1796 CG ARG A 116 11.350 14.444 -6.468 1.00 54.13 C ATOM 1797 CD ARG A 116 11.733 13.328 -5.473 1.00 21.12 C ATOM 1798 NE ARG A 116 13.169 13.038 -5.499 1.00 30.44 N ATOM 1799 CZ ARG A 116 13.895 12.632 -4.450 1.00 21.42 C ATOM 1800 NH1 ARG A 116 13.337 12.445 -3.248 1.00 41.33 N ATOM 1801 NH2 ARG A 116 15.195 12.435 -4.605 1.00 40.43 N ATOM 0 H ARG A 116 7.694 15.710 -5.385 1.00 52.22 H new ATOM 0 HA ARG A 116 10.054 14.971 -4.059 1.00 21.52 H new ATOM 0 HB2 ARG A 116 9.214 14.167 -6.320 1.00 62.35 H new ATOM 0 HB3 ARG A 116 9.686 15.711 -7.002 1.00 62.35 H new ATOM 0 HG2 ARG A 116 11.419 14.059 -7.486 1.00 54.13 H new ATOM 0 HG3 ARG A 116 12.067 15.261 -6.387 1.00 54.13 H new ATOM 0 HD2 ARG A 116 11.441 13.625 -4.466 1.00 21.12 H new ATOM 0 HD3 ARG A 116 11.176 12.422 -5.712 1.00 21.12 H new ATOM 0 HE ARG A 116 13.655 13.155 -6.388 1.00 30.44 H new ATOM 0 HH11 ARG A 116 12.339 12.612 -3.117 1.00 41.33 H new ATOM 0 HH12 ARG A 116 13.909 12.135 -2.463 1.00 41.33 H new ATOM 0 HH21 ARG A 116 15.630 12.593 -5.514 1.00 40.43 H new ATOM 0 HH22 ARG A 116 15.762 12.126 -3.815 1.00 40.43 H new ATOM 1815 N GLY A 117 11.204 17.105 -3.542 1.00 25.41 N ATOM 1816 CA GLY A 117 12.106 18.215 -3.271 1.00 53.42 C ATOM 1817 C GLY A 117 13.476 17.988 -3.911 1.00 55.20 C ATOM 1818 O GLY A 117 14.314 17.314 -3.317 1.00 44.24 O ATOM 1819 OXT GLY A 117 13.723 18.473 -5.012 1.00 37.76 O ATOM 0 H GLY A 117 11.090 16.468 -2.754 1.00 25.41 H new ATOM 0 HA2 GLY A 117 11.673 19.140 -3.653 1.00 53.42 H new ATOM 0 HA3 GLY A 117 12.221 18.338 -2.194 1.00 53.42 H new ATOM 1824 N SER B 2 18.263 -14.217 17.788 1.00 43.12 N ATOM 1825 CA SER B 2 19.353 -13.393 17.230 1.00 42.44 C ATOM 1826 C SER B 2 18.801 -12.139 16.517 1.00 13.10 C ATOM 1827 O SER B 2 17.707 -12.166 15.937 1.00 64.15 O ATOM 1828 CB SER B 2 20.209 -14.247 16.266 1.00 15.42 C ATOM 1829 OG SER B 2 20.686 -15.428 16.908 1.00 30.35 O ATOM 0 HA SER B 2 19.982 -13.047 18.050 1.00 42.44 H new ATOM 0 HB2 SER B 2 19.616 -14.519 15.393 1.00 15.42 H new ATOM 0 HB3 SER B 2 21.053 -13.659 15.907 1.00 15.42 H new ATOM 0 HG SER B 2 20.093 -15.657 17.654 1.00 30.35 H new ATOM 1837 N LEU B 3 19.567 -11.037 16.588 1.00 33.42 N ATOM 1838 CA LEU B 3 19.240 -9.788 15.883 1.00 10.13 C ATOM 1839 C LEU B 3 19.617 -9.920 14.394 1.00 50.31 C ATOM 1840 O LEU B 3 20.742 -10.311 14.071 1.00 72.44 O ATOM 1841 CB LEU B 3 19.997 -8.589 16.517 1.00 10.20 C ATOM 1842 CG LEU B 3 19.753 -8.333 18.033 1.00 42.31 C ATOM 1843 CD1 LEU B 3 20.652 -7.192 18.554 1.00 15.21 C ATOM 1844 CD2 LEU B 3 18.271 -8.046 18.317 1.00 14.11 C ATOM 0 H LEU B 3 20.427 -10.988 17.134 1.00 33.42 H new ATOM 0 HA LEU B 3 18.169 -9.605 15.971 1.00 10.13 H new ATOM 0 HB2 LEU B 3 21.065 -8.742 16.365 1.00 10.20 H new ATOM 0 HB3 LEU B 3 19.723 -7.686 15.971 1.00 10.20 H new ATOM 0 HG LEU B 3 20.022 -9.242 18.571 1.00 42.31 H new ATOM 0 HD11 LEU B 3 20.461 -7.034 19.615 1.00 15.21 H new ATOM 0 HD12 LEU B 3 21.699 -7.459 18.409 1.00 15.21 H new ATOM 0 HD13 LEU B 3 20.432 -6.276 18.006 1.00 15.21 H new ATOM 0 HD21 LEU B 3 18.132 -7.871 19.384 1.00 14.11 H new ATOM 0 HD22 LEU B 3 17.958 -7.162 17.761 1.00 14.11 H new ATOM 0 HD23 LEU B 3 17.669 -8.901 18.008 1.00 14.11 H new ATOM 1856 N VAL B 4 18.669 -9.618 13.499 1.00 2.12 N ATOM 1857 CA VAL B 4 18.922 -9.604 12.045 1.00 33.11 C ATOM 1858 C VAL B 4 19.393 -8.197 11.621 1.00 51.04 C ATOM 1859 O VAL B 4 18.769 -7.182 11.952 1.00 34.02 O ATOM 1860 CB VAL B 4 17.666 -10.084 11.213 1.00 4.23 C ATOM 1861 CG1 VAL B 4 17.464 -11.614 11.367 1.00 65.24 C ATOM 1862 CG2 VAL B 4 16.382 -9.321 11.620 1.00 10.54 C ATOM 0 H VAL B 4 17.711 -9.378 13.755 1.00 2.12 H new ATOM 0 HA VAL B 4 19.713 -10.321 11.824 1.00 33.11 H new ATOM 0 HB VAL B 4 17.861 -9.860 10.164 1.00 4.23 H new ATOM 0 HG11 VAL B 4 16.595 -11.926 10.788 1.00 65.24 H new ATOM 0 HG12 VAL B 4 18.349 -12.136 11.004 1.00 65.24 H new ATOM 0 HG13 VAL B 4 17.305 -11.856 12.418 1.00 65.24 H new ATOM 0 HG21 VAL B 4 15.542 -9.680 11.026 1.00 10.54 H new ATOM 0 HG22 VAL B 4 16.177 -9.491 12.677 1.00 10.54 H new ATOM 0 HG23 VAL B 4 16.521 -8.254 11.444 1.00 10.54 H new ATOM 1872 N LYS B 5 20.542 -8.166 10.931 1.00 72.11 N ATOM 1873 CA LYS B 5 21.210 -6.932 10.499 1.00 64.12 C ATOM 1874 C LYS B 5 20.584 -6.408 9.198 1.00 53.55 C ATOM 1875 O LYS B 5 20.708 -7.034 8.147 1.00 33.04 O ATOM 1876 CB LYS B 5 22.722 -7.217 10.303 1.00 42.25 C ATOM 1877 CG LYS B 5 23.469 -7.639 11.581 1.00 61.33 C ATOM 1878 CD LYS B 5 24.946 -7.996 11.311 1.00 54.33 C ATOM 1879 CE LYS B 5 25.716 -8.312 12.595 1.00 51.00 C ATOM 1880 NZ LYS B 5 25.097 -9.430 13.350 1.00 45.50 N ATOM 0 H LYS B 5 21.040 -9.012 10.653 1.00 72.11 H new ATOM 0 HA LYS B 5 21.084 -6.164 11.262 1.00 64.12 H new ATOM 0 HB2 LYS B 5 22.836 -8.003 9.556 1.00 42.25 H new ATOM 0 HB3 LYS B 5 23.197 -6.323 9.900 1.00 42.25 H new ATOM 0 HG2 LYS B 5 23.421 -6.830 12.310 1.00 61.33 H new ATOM 0 HG3 LYS B 5 22.966 -8.498 12.025 1.00 61.33 H new ATOM 0 HD2 LYS B 5 24.992 -8.856 10.642 1.00 54.33 H new ATOM 0 HD3 LYS B 5 25.429 -7.165 10.796 1.00 54.33 H new ATOM 0 HE2 LYS B 5 26.746 -8.568 12.347 1.00 51.00 H new ATOM 0 HE3 LYS B 5 25.751 -7.424 13.225 1.00 51.00 H new ATOM 0 HZ1 LYS B 5 25.702 -9.681 14.158 1.00 45.50 H new ATOM 0 HZ2 LYS B 5 24.161 -9.139 13.696 1.00 45.50 H new ATOM 0 HZ3 LYS B 5 24.994 -10.255 12.726 1.00 45.50 H new ATOM 1894 N LEU B 6 19.875 -5.278 9.294 1.00 12.41 N ATOM 1895 CA LEU B 6 19.258 -4.605 8.138 1.00 33.13 C ATOM 1896 C LEU B 6 20.055 -3.342 7.799 1.00 5.15 C ATOM 1897 O LEU B 6 19.899 -2.308 8.455 1.00 20.41 O ATOM 1898 CB LEU B 6 17.765 -4.251 8.426 1.00 44.44 C ATOM 1899 CG LEU B 6 16.722 -5.398 8.217 1.00 60.12 C ATOM 1900 CD1 LEU B 6 16.959 -6.600 9.146 1.00 12.32 C ATOM 1901 CD2 LEU B 6 15.300 -4.850 8.376 1.00 3.32 C ATOM 0 H LEU B 6 19.710 -4.799 10.179 1.00 12.41 H new ATOM 0 HA LEU B 6 19.277 -5.283 7.285 1.00 33.13 H new ATOM 0 HB2 LEU B 6 17.689 -3.905 9.457 1.00 44.44 H new ATOM 0 HB3 LEU B 6 17.484 -3.414 7.787 1.00 44.44 H new ATOM 0 HG LEU B 6 16.851 -5.771 7.201 1.00 60.12 H new ATOM 0 HD11 LEU B 6 16.204 -7.363 8.954 1.00 12.32 H new ATOM 0 HD12 LEU B 6 17.950 -7.015 8.959 1.00 12.32 H new ATOM 0 HD13 LEU B 6 16.892 -6.276 10.185 1.00 12.32 H new ATOM 0 HD21 LEU B 6 14.581 -5.656 8.229 1.00 3.32 H new ATOM 0 HD22 LEU B 6 15.180 -4.435 9.377 1.00 3.32 H new ATOM 0 HD23 LEU B 6 15.126 -4.069 7.636 1.00 3.32 H new ATOM 1913 N GLU B 7 20.937 -3.450 6.797 1.00 31.14 N ATOM 1914 CA GLU B 7 21.692 -2.303 6.281 1.00 74.21 C ATOM 1915 C GLU B 7 20.791 -1.482 5.333 1.00 73.13 C ATOM 1916 O GLU B 7 20.260 -2.019 4.365 1.00 54.14 O ATOM 1917 CB GLU B 7 22.970 -2.773 5.544 1.00 61.24 C ATOM 1918 CG GLU B 7 23.829 -1.611 5.002 1.00 2.24 C ATOM 1919 CD GLU B 7 25.033 -2.066 4.166 1.00 63.01 C ATOM 1920 OE1 GLU B 7 26.173 -2.035 4.675 1.00 50.15 O ATOM 1921 OE2 GLU B 7 24.838 -2.438 2.986 1.00 34.34 O ATOM 0 H GLU B 7 21.146 -4.329 6.324 1.00 31.14 H new ATOM 0 HA GLU B 7 22.001 -1.676 7.117 1.00 74.21 H new ATOM 0 HB2 GLU B 7 23.573 -3.373 6.225 1.00 61.24 H new ATOM 0 HB3 GLU B 7 22.685 -3.421 4.715 1.00 61.24 H new ATOM 0 HG2 GLU B 7 23.201 -0.961 4.393 1.00 2.24 H new ATOM 0 HG3 GLU B 7 24.186 -1.014 5.841 1.00 2.24 H new ATOM 1928 N SER B 8 20.628 -0.190 5.629 1.00 32.03 N ATOM 1929 CA SER B 8 19.798 0.731 4.832 1.00 35.44 C ATOM 1930 C SER B 8 20.565 1.260 3.606 1.00 5.00 C ATOM 1931 O SER B 8 21.735 0.917 3.388 1.00 55.55 O ATOM 1932 CB SER B 8 19.344 1.891 5.745 1.00 54.44 C ATOM 1933 OG SER B 8 20.456 2.555 6.326 1.00 63.20 O ATOM 0 H SER B 8 21.070 0.254 6.434 1.00 32.03 H new ATOM 0 HA SER B 8 18.927 0.198 4.451 1.00 35.44 H new ATOM 0 HB2 SER B 8 18.754 2.602 5.167 1.00 54.44 H new ATOM 0 HB3 SER B 8 18.696 1.505 6.532 1.00 54.44 H new ATOM 0 HG SER B 8 20.368 3.521 6.189 1.00 63.20 H new ATOM 1939 N SER B 9 19.887 2.110 2.818 1.00 24.04 N ATOM 1940 CA SER B 9 20.476 2.789 1.648 1.00 41.25 C ATOM 1941 C SER B 9 21.551 3.817 2.067 1.00 52.24 C ATOM 1942 O SER B 9 22.409 4.196 1.261 1.00 72.33 O ATOM 1943 CB SER B 9 19.358 3.468 0.834 1.00 54.41 C ATOM 1944 OG SER B 9 18.352 2.535 0.478 1.00 5.20 O ATOM 0 H SER B 9 18.908 2.348 2.974 1.00 24.04 H new ATOM 0 HA SER B 9 20.972 2.042 1.028 1.00 41.25 H new ATOM 0 HB2 SER B 9 18.919 4.277 1.417 1.00 54.41 H new ATOM 0 HB3 SER B 9 19.779 3.916 -0.066 1.00 54.41 H new ATOM 0 HG SER B 9 17.801 2.332 1.263 1.00 5.20 H new ATOM 1950 N ASP B 10 21.488 4.246 3.342 1.00 1.11 N ATOM 1951 CA ASP B 10 22.473 5.161 3.961 1.00 55.12 C ATOM 1952 C ASP B 10 23.604 4.356 4.660 1.00 35.30 C ATOM 1953 O ASP B 10 24.390 4.908 5.438 1.00 35.02 O ATOM 1954 CB ASP B 10 21.726 6.094 4.957 1.00 35.20 C ATOM 1955 CG ASP B 10 22.579 7.263 5.513 1.00 75.23 C ATOM 1956 OD1 ASP B 10 22.756 7.374 6.750 1.00 33.22 O ATOM 1957 OD2 ASP B 10 23.068 8.080 4.707 1.00 2.04 O ATOM 0 H ASP B 10 20.744 3.965 3.981 1.00 1.11 H new ATOM 0 HA ASP B 10 22.950 5.773 3.195 1.00 55.12 H new ATOM 0 HB2 ASP B 10 20.849 6.507 4.459 1.00 35.20 H new ATOM 0 HB3 ASP B 10 21.365 5.496 5.793 1.00 35.20 H new ATOM 1962 N GLU B 11 23.664 3.026 4.358 1.00 14.02 N ATOM 1963 CA GLU B 11 24.726 2.089 4.826 1.00 32.23 C ATOM 1964 C GLU B 11 24.671 1.824 6.350 1.00 4.40 C ATOM 1965 O GLU B 11 25.586 1.208 6.907 1.00 52.02 O ATOM 1966 CB GLU B 11 26.136 2.586 4.390 1.00 75.44 C ATOM 1967 CG GLU B 11 26.332 2.678 2.861 1.00 13.11 C ATOM 1968 CD GLU B 11 27.662 3.332 2.468 1.00 32.30 C ATOM 1969 OE1 GLU B 11 27.682 4.555 2.213 1.00 2.21 O ATOM 1970 OE2 GLU B 11 28.701 2.633 2.437 1.00 32.31 O ATOM 0 H GLU B 11 22.964 2.569 3.773 1.00 14.02 H new ATOM 0 HA GLU B 11 24.531 1.131 4.344 1.00 32.23 H new ATOM 0 HB2 GLU B 11 26.313 3.569 4.827 1.00 75.44 H new ATOM 0 HB3 GLU B 11 26.889 1.914 4.801 1.00 75.44 H new ATOM 0 HG2 GLU B 11 26.285 1.677 2.433 1.00 13.11 H new ATOM 0 HG3 GLU B 11 25.510 3.249 2.428 1.00 13.11 H new ATOM 1977 N LYS B 12 23.576 2.243 6.997 1.00 43.22 N ATOM 1978 CA LYS B 12 23.403 2.123 8.455 1.00 43.22 C ATOM 1979 C LYS B 12 22.729 0.790 8.795 1.00 62.31 C ATOM 1980 O LYS B 12 21.619 0.515 8.331 1.00 73.20 O ATOM 1981 CB LYS B 12 22.570 3.319 8.975 1.00 51.02 C ATOM 1982 CG LYS B 12 23.210 4.696 8.698 1.00 54.33 C ATOM 1983 CD LYS B 12 24.570 4.886 9.402 1.00 73.12 C ATOM 1984 CE LYS B 12 25.276 6.195 9.004 1.00 55.53 C ATOM 1985 NZ LYS B 12 24.418 7.399 9.216 1.00 70.21 N ATOM 0 H LYS B 12 22.782 2.676 6.525 1.00 43.22 H new ATOM 0 HA LYS B 12 24.377 2.141 8.944 1.00 43.22 H new ATOM 0 HB2 LYS B 12 21.583 3.289 8.514 1.00 51.02 H new ATOM 0 HB3 LYS B 12 22.424 3.207 10.049 1.00 51.02 H new ATOM 0 HG2 LYS B 12 23.344 4.818 7.623 1.00 54.33 H new ATOM 0 HG3 LYS B 12 22.526 5.480 9.024 1.00 54.33 H new ATOM 0 HD2 LYS B 12 24.419 4.875 10.481 1.00 73.12 H new ATOM 0 HD3 LYS B 12 25.218 4.043 9.162 1.00 73.12 H new ATOM 0 HE2 LYS B 12 26.192 6.300 9.585 1.00 55.53 H new ATOM 0 HE3 LYS B 12 25.568 6.142 7.955 1.00 55.53 H new ATOM 0 HZ1 LYS B 12 25.018 8.246 9.281 1.00 70.21 H new ATOM 0 HZ2 LYS B 12 23.760 7.502 8.417 1.00 70.21 H new ATOM 0 HZ3 LYS B 12 23.877 7.289 10.098 1.00 70.21 H new ATOM 1999 N VAL B 13 23.410 -0.021 9.615 1.00 40.51 N ATOM 2000 CA VAL B 13 22.955 -1.358 10.002 1.00 44.41 C ATOM 2001 C VAL B 13 22.100 -1.261 11.281 1.00 4.20 C ATOM 2002 O VAL B 13 22.579 -0.793 12.320 1.00 23.43 O ATOM 2003 CB VAL B 13 24.184 -2.317 10.227 1.00 24.10 C ATOM 2004 CG1 VAL B 13 23.732 -3.751 10.581 1.00 33.00 C ATOM 2005 CG2 VAL B 13 25.118 -2.307 8.993 1.00 51.30 C ATOM 0 H VAL B 13 24.304 0.239 10.032 1.00 40.51 H new ATOM 0 HA VAL B 13 22.347 -1.774 9.199 1.00 44.41 H new ATOM 0 HB VAL B 13 24.748 -1.941 11.081 1.00 24.10 H new ATOM 0 HG11 VAL B 13 24.608 -4.383 10.729 1.00 33.00 H new ATOM 0 HG12 VAL B 13 23.141 -3.731 11.497 1.00 33.00 H new ATOM 0 HG13 VAL B 13 23.128 -4.153 9.768 1.00 33.00 H new ATOM 0 HG21 VAL B 13 25.961 -2.976 9.169 1.00 51.30 H new ATOM 0 HG22 VAL B 13 24.565 -2.643 8.116 1.00 51.30 H new ATOM 0 HG23 VAL B 13 25.487 -1.295 8.824 1.00 51.30 H new ATOM 2015 N PHE B 14 20.829 -1.674 11.176 1.00 25.22 N ATOM 2016 CA PHE B 14 19.876 -1.701 12.294 1.00 64.54 C ATOM 2017 C PHE B 14 19.575 -3.163 12.637 1.00 44.32 C ATOM 2018 O PHE B 14 18.868 -3.859 11.893 1.00 32.24 O ATOM 2019 CB PHE B 14 18.580 -0.936 11.908 1.00 43.02 C ATOM 2020 CG PHE B 14 18.836 0.516 11.506 1.00 54.32 C ATOM 2021 CD1 PHE B 14 18.775 0.922 10.172 1.00 42.24 C ATOM 2022 CD2 PHE B 14 19.175 1.465 12.468 1.00 14.31 C ATOM 2023 CE1 PHE B 14 19.045 2.226 9.820 1.00 33.13 C ATOM 2024 CE2 PHE B 14 19.440 2.771 12.112 1.00 14.41 C ATOM 2025 CZ PHE B 14 19.376 3.152 10.792 1.00 4.15 C ATOM 0 H PHE B 14 20.428 -2.004 10.298 1.00 25.22 H new ATOM 0 HA PHE B 14 20.301 -1.207 13.168 1.00 64.54 H new ATOM 0 HB2 PHE B 14 18.092 -1.454 11.083 1.00 43.02 H new ATOM 0 HB3 PHE B 14 17.889 -0.957 12.751 1.00 43.02 H new ATOM 0 HD1 PHE B 14 18.513 0.206 9.407 1.00 42.24 H new ATOM 0 HD2 PHE B 14 19.231 1.174 13.507 1.00 14.31 H new ATOM 0 HE1 PHE B 14 18.998 2.526 8.783 1.00 33.13 H new ATOM 0 HE2 PHE B 14 19.698 3.495 12.871 1.00 14.41 H new ATOM 0 HZ PHE B 14 19.584 4.175 10.515 1.00 4.15 H new ATOM 2035 N GLU B 15 20.159 -3.622 13.747 1.00 34.12 N ATOM 2036 CA GLU B 15 20.039 -5.007 14.209 1.00 40.12 C ATOM 2037 C GLU B 15 18.739 -5.164 15.018 1.00 2.43 C ATOM 2038 O GLU B 15 18.738 -5.117 16.255 1.00 43.15 O ATOM 2039 CB GLU B 15 21.283 -5.396 15.050 1.00 70.02 C ATOM 2040 CG GLU B 15 22.629 -5.130 14.352 1.00 14.42 C ATOM 2041 CD GLU B 15 23.837 -5.537 15.209 1.00 31.52 C ATOM 2042 OE1 GLU B 15 24.264 -6.698 15.131 1.00 31.52 O ATOM 2043 OE2 GLU B 15 24.341 -4.701 15.982 1.00 75.04 O ATOM 0 H GLU B 15 20.733 -3.038 14.355 1.00 34.12 H new ATOM 0 HA GLU B 15 19.994 -5.681 13.353 1.00 40.12 H new ATOM 0 HB2 GLU B 15 21.259 -4.844 15.989 1.00 70.02 H new ATOM 0 HB3 GLU B 15 21.220 -6.455 15.301 1.00 70.02 H new ATOM 0 HG2 GLU B 15 22.658 -5.676 13.409 1.00 14.42 H new ATOM 0 HG3 GLU B 15 22.703 -4.070 14.108 1.00 14.42 H new ATOM 2050 N ILE B 16 17.625 -5.280 14.291 1.00 41.44 N ATOM 2051 CA ILE B 16 16.290 -5.453 14.888 1.00 72.04 C ATOM 2052 C ILE B 16 16.093 -6.926 15.303 1.00 31.31 C ATOM 2053 O ILE B 16 16.683 -7.837 14.711 1.00 72.31 O ATOM 2054 CB ILE B 16 15.140 -5.001 13.893 1.00 32.32 C ATOM 2055 CG1 ILE B 16 13.716 -5.180 14.541 1.00 1.41 C ATOM 2056 CG2 ILE B 16 15.249 -5.740 12.535 1.00 61.42 C ATOM 2057 CD1 ILE B 16 12.534 -4.881 13.631 1.00 13.41 C ATOM 0 H ILE B 16 17.619 -5.257 13.271 1.00 41.44 H new ATOM 0 HA ILE B 16 16.228 -4.815 15.770 1.00 72.04 H new ATOM 0 HB ILE B 16 15.273 -3.937 13.696 1.00 32.32 H new ATOM 0 HG12 ILE B 16 13.626 -6.206 14.897 1.00 1.41 H new ATOM 0 HG13 ILE B 16 13.651 -4.532 15.415 1.00 1.41 H new ATOM 0 HG21 ILE B 16 14.447 -5.409 11.875 1.00 61.42 H new ATOM 0 HG22 ILE B 16 16.212 -5.517 12.076 1.00 61.42 H new ATOM 0 HG23 ILE B 16 15.164 -6.814 12.698 1.00 61.42 H new ATOM 0 HD11 ILE B 16 11.605 -5.036 14.179 1.00 13.41 H new ATOM 0 HD12 ILE B 16 12.587 -3.846 13.293 1.00 13.41 H new ATOM 0 HD13 ILE B 16 12.562 -5.546 12.768 1.00 13.41 H new ATOM 2069 N GLU B 17 15.294 -7.125 16.363 1.00 43.11 N ATOM 2070 CA GLU B 17 14.826 -8.446 16.805 1.00 74.44 C ATOM 2071 C GLU B 17 14.072 -9.144 15.651 1.00 23.21 C ATOM 2072 O GLU B 17 13.122 -8.573 15.095 1.00 33.53 O ATOM 2073 CB GLU B 17 13.924 -8.273 18.063 1.00 40.43 C ATOM 2074 CG GLU B 17 14.629 -7.585 19.252 1.00 14.41 C ATOM 2075 CD GLU B 17 13.692 -7.284 20.435 1.00 74.52 C ATOM 2076 OE1 GLU B 17 13.221 -6.134 20.564 1.00 72.13 O ATOM 2077 OE2 GLU B 17 13.418 -8.196 21.241 1.00 32.24 O ATOM 0 H GLU B 17 14.951 -6.361 16.945 1.00 43.11 H new ATOM 0 HA GLU B 17 15.672 -9.077 17.076 1.00 74.44 H new ATOM 0 HB2 GLU B 17 13.044 -7.691 17.789 1.00 40.43 H new ATOM 0 HB3 GLU B 17 13.571 -9.254 18.382 1.00 40.43 H new ATOM 0 HG2 GLU B 17 15.444 -8.221 19.598 1.00 14.41 H new ATOM 0 HG3 GLU B 17 15.077 -6.653 18.908 1.00 14.41 H new ATOM 2084 N LYS B 18 14.531 -10.365 15.300 1.00 10.13 N ATOM 2085 CA LYS B 18 14.033 -11.132 14.138 1.00 70.22 C ATOM 2086 C LYS B 18 12.504 -11.344 14.195 1.00 5.45 C ATOM 2087 O LYS B 18 11.822 -11.187 13.182 1.00 3.22 O ATOM 2088 CB LYS B 18 14.757 -12.501 14.042 1.00 61.34 C ATOM 2089 CG LYS B 18 14.281 -13.405 12.874 1.00 40.22 C ATOM 2090 CD LYS B 18 14.956 -14.797 12.888 1.00 72.21 C ATOM 2091 CE LYS B 18 14.365 -15.753 11.847 1.00 65.12 C ATOM 2092 NZ LYS B 18 14.995 -17.096 11.929 1.00 75.21 N ATOM 0 H LYS B 18 15.263 -10.849 15.819 1.00 10.13 H new ATOM 0 HA LYS B 18 14.252 -10.545 13.246 1.00 70.22 H new ATOM 0 HB2 LYS B 18 15.827 -12.324 13.934 1.00 61.34 H new ATOM 0 HB3 LYS B 18 14.616 -13.038 14.980 1.00 61.34 H new ATOM 0 HG2 LYS B 18 13.200 -13.529 12.932 1.00 40.22 H new ATOM 0 HG3 LYS B 18 14.495 -12.911 11.926 1.00 40.22 H new ATOM 0 HD2 LYS B 18 16.024 -14.680 12.703 1.00 72.21 H new ATOM 0 HD3 LYS B 18 14.851 -15.237 13.880 1.00 72.21 H new ATOM 0 HE2 LYS B 18 13.290 -15.843 12.002 1.00 65.12 H new ATOM 0 HE3 LYS B 18 14.510 -15.341 10.848 1.00 65.12 H new ATOM 0 HZ1 LYS B 18 14.611 -17.706 11.179 1.00 75.21 H new ATOM 0 HZ2 LYS B 18 16.024 -17.005 11.808 1.00 75.21 H new ATOM 0 HZ3 LYS B 18 14.792 -17.519 12.857 1.00 75.21 H new ATOM 2106 N GLU B 19 11.995 -11.654 15.408 1.00 64.12 N ATOM 2107 CA GLU B 19 10.552 -11.908 15.664 1.00 51.11 C ATOM 2108 C GLU B 19 9.680 -10.695 15.268 1.00 4.23 C ATOM 2109 O GLU B 19 8.546 -10.840 14.794 1.00 41.41 O ATOM 2110 CB GLU B 19 10.346 -12.265 17.166 1.00 43.31 C ATOM 2111 CG GLU B 19 8.882 -12.513 17.593 1.00 61.31 C ATOM 2112 CD GLU B 19 8.739 -12.878 19.078 1.00 22.31 C ATOM 2113 OE1 GLU B 19 8.556 -14.069 19.405 1.00 63.41 O ATOM 2114 OE2 GLU B 19 8.823 -11.966 19.933 1.00 14.33 O ATOM 0 H GLU B 19 12.573 -11.736 16.244 1.00 64.12 H new ATOM 0 HA GLU B 19 10.236 -12.747 15.045 1.00 51.11 H new ATOM 0 HB2 GLU B 19 10.929 -13.157 17.393 1.00 43.31 H new ATOM 0 HB3 GLU B 19 10.752 -11.456 17.773 1.00 43.31 H new ATOM 0 HG2 GLU B 19 8.294 -11.619 17.387 1.00 61.31 H new ATOM 0 HG3 GLU B 19 8.464 -13.316 16.986 1.00 61.31 H new ATOM 2121 N ILE B 20 10.245 -9.505 15.467 1.00 64.34 N ATOM 2122 CA ILE B 20 9.593 -8.227 15.166 1.00 54.01 C ATOM 2123 C ILE B 20 9.734 -7.877 13.661 1.00 52.15 C ATOM 2124 O ILE B 20 8.815 -7.316 13.055 1.00 3.13 O ATOM 2125 CB ILE B 20 10.196 -7.108 16.084 1.00 33.31 C ATOM 2126 CG1 ILE B 20 10.045 -7.517 17.592 1.00 33.12 C ATOM 2127 CG2 ILE B 20 9.549 -5.747 15.794 1.00 62.35 C ATOM 2128 CD1 ILE B 20 10.563 -6.512 18.607 1.00 32.44 C ATOM 0 H ILE B 20 11.185 -9.398 15.848 1.00 64.34 H new ATOM 0 HA ILE B 20 8.526 -8.305 15.374 1.00 54.01 H new ATOM 0 HB ILE B 20 11.259 -7.005 15.865 1.00 33.31 H new ATOM 0 HG12 ILE B 20 8.990 -7.699 17.795 1.00 33.12 H new ATOM 0 HG13 ILE B 20 10.566 -8.462 17.746 1.00 33.12 H new ATOM 0 HG21 ILE B 20 9.986 -4.990 16.445 1.00 62.35 H new ATOM 0 HG22 ILE B 20 9.724 -5.475 14.753 1.00 62.35 H new ATOM 0 HG23 ILE B 20 8.476 -5.808 15.978 1.00 62.35 H new ATOM 0 HD11 ILE B 20 10.407 -6.899 19.614 1.00 32.44 H new ATOM 0 HD12 ILE B 20 11.628 -6.345 18.443 1.00 32.44 H new ATOM 0 HD13 ILE B 20 10.026 -5.570 18.493 1.00 32.44 H new ATOM 2140 N ALA B 21 10.887 -8.253 13.067 1.00 64.12 N ATOM 2141 CA ALA B 21 11.152 -8.083 11.616 1.00 4.02 C ATOM 2142 C ALA B 21 10.259 -9.010 10.758 1.00 52.05 C ATOM 2143 O ALA B 21 10.097 -8.788 9.552 1.00 1.41 O ATOM 2144 CB ALA B 21 12.636 -8.339 11.323 1.00 61.01 C ATOM 0 H ALA B 21 11.660 -8.682 13.575 1.00 64.12 H new ATOM 0 HA ALA B 21 10.905 -7.056 11.346 1.00 4.02 H new ATOM 0 HB1 ALA B 21 12.823 -8.213 10.257 1.00 61.01 H new ATOM 0 HB2 ALA B 21 13.245 -7.631 11.885 1.00 61.01 H new ATOM 0 HB3 ALA B 21 12.895 -9.356 11.619 1.00 61.01 H new ATOM 2150 N CYS B 22 9.688 -10.047 11.404 1.00 61.22 N ATOM 2151 CA CYS B 22 8.748 -10.987 10.778 1.00 32.22 C ATOM 2152 C CYS B 22 7.376 -10.346 10.468 1.00 4.43 C ATOM 2153 O CYS B 22 6.648 -10.845 9.599 1.00 42.54 O ATOM 2154 CB CYS B 22 8.586 -12.228 11.674 1.00 44.24 C ATOM 2155 SG CYS B 22 10.101 -13.194 11.854 1.00 64.33 S ATOM 0 H CYS B 22 9.872 -10.254 12.386 1.00 61.22 H new ATOM 0 HA CYS B 22 9.168 -11.282 9.817 1.00 32.22 H new ATOM 0 HB2 CYS B 22 8.248 -11.912 12.661 1.00 44.24 H new ATOM 0 HB3 CYS B 22 7.806 -12.866 11.259 1.00 44.24 H new ATOM 0 HG CYS B 22 10.929 -12.562 12.632 1.00 64.33 H new ATOM 2161 N MET B 23 7.015 -9.254 11.188 1.00 2.33 N ATOM 2162 CA MET B 23 5.759 -8.502 10.921 1.00 54.42 C ATOM 2163 C MET B 23 5.817 -7.817 9.540 1.00 54.32 C ATOM 2164 O MET B 23 4.783 -7.604 8.884 1.00 72.43 O ATOM 2165 CB MET B 23 5.473 -7.444 12.016 1.00 72.54 C ATOM 2166 CG MET B 23 5.395 -7.980 13.457 1.00 44.45 C ATOM 2167 SD MET B 23 4.422 -6.911 14.553 1.00 63.24 S ATOM 2168 CE MET B 23 5.040 -5.269 14.183 1.00 71.01 C ATOM 0 H MET B 23 7.571 -8.875 11.954 1.00 2.33 H new ATOM 0 HA MET B 23 4.946 -9.227 10.931 1.00 54.42 H new ATOM 0 HB2 MET B 23 6.252 -6.683 11.973 1.00 72.54 H new ATOM 0 HB3 MET B 23 4.531 -6.949 11.780 1.00 72.54 H new ATOM 0 HG2 MET B 23 4.955 -8.977 13.446 1.00 44.45 H new ATOM 0 HG3 MET B 23 6.404 -8.081 13.857 1.00 44.45 H new ATOM 0 HE1 MET B 23 5.042 -4.668 15.092 1.00 71.01 H new ATOM 0 HE2 MET B 23 6.056 -5.342 13.794 1.00 71.01 H new ATOM 0 HE3 MET B 23 4.399 -4.798 13.438 1.00 71.01 H new ATOM 2178 N SER B 24 7.038 -7.460 9.126 1.00 63.44 N ATOM 2179 CA SER B 24 7.313 -7.028 7.763 1.00 65.53 C ATOM 2180 C SER B 24 7.347 -8.269 6.872 1.00 43.53 C ATOM 2181 O SER B 24 8.218 -9.129 7.046 1.00 4.02 O ATOM 2182 CB SER B 24 8.649 -6.271 7.682 1.00 72.43 C ATOM 2183 OG SER B 24 8.919 -5.859 6.350 1.00 74.14 O ATOM 0 H SER B 24 7.859 -7.465 9.731 1.00 63.44 H new ATOM 0 HA SER B 24 6.533 -6.343 7.429 1.00 65.53 H new ATOM 0 HB2 SER B 24 8.618 -5.400 8.337 1.00 72.43 H new ATOM 0 HB3 SER B 24 9.456 -6.910 8.040 1.00 72.43 H new ATOM 0 HG SER B 24 8.084 -5.844 5.837 1.00 74.14 H new ATOM 2189 N VAL B 25 6.381 -8.361 5.946 1.00 54.32 N ATOM 2190 CA VAL B 25 6.215 -9.530 5.075 1.00 71.10 C ATOM 2191 C VAL B 25 7.448 -9.706 4.165 1.00 12.33 C ATOM 2192 O VAL B 25 8.012 -10.792 4.110 1.00 35.13 O ATOM 2193 CB VAL B 25 4.894 -9.426 4.222 1.00 73.25 C ATOM 2194 CG1 VAL B 25 4.645 -10.717 3.406 1.00 1.22 C ATOM 2195 CG2 VAL B 25 3.674 -9.090 5.124 1.00 63.42 C ATOM 0 H VAL B 25 5.693 -7.626 5.781 1.00 54.32 H new ATOM 0 HA VAL B 25 6.127 -10.413 5.709 1.00 71.10 H new ATOM 0 HB VAL B 25 5.023 -8.609 3.512 1.00 73.25 H new ATOM 0 HG11 VAL B 25 3.726 -10.611 2.829 1.00 1.22 H new ATOM 0 HG12 VAL B 25 5.482 -10.886 2.728 1.00 1.22 H new ATOM 0 HG13 VAL B 25 4.552 -11.564 4.085 1.00 1.22 H new ATOM 0 HG21 VAL B 25 2.775 -9.024 4.511 1.00 63.42 H new ATOM 0 HG22 VAL B 25 3.547 -9.874 5.871 1.00 63.42 H new ATOM 0 HG23 VAL B 25 3.843 -8.136 5.624 1.00 63.42 H new ATOM 2205 N THR B 26 7.893 -8.601 3.527 1.00 60.44 N ATOM 2206 CA THR B 26 9.041 -8.608 2.593 1.00 24.11 C ATOM 2207 C THR B 26 10.356 -9.027 3.288 1.00 55.40 C ATOM 2208 O THR B 26 11.041 -9.921 2.797 1.00 24.21 O ATOM 2209 CB THR B 26 9.233 -7.215 1.910 1.00 12.21 C ATOM 2210 OG1 THR B 26 8.037 -6.844 1.209 1.00 12.11 O ATOM 2211 CG2 THR B 26 10.417 -7.185 0.925 1.00 43.44 C ATOM 0 H THR B 26 7.468 -7.681 3.644 1.00 60.44 H new ATOM 0 HA THR B 26 8.806 -9.349 1.829 1.00 24.11 H new ATOM 0 HB THR B 26 9.450 -6.506 2.709 1.00 12.21 H new ATOM 0 HG1 THR B 26 8.139 -5.940 0.844 1.00 12.11 H new ATOM 0 HG21 THR B 26 10.498 -6.192 0.484 1.00 43.44 H new ATOM 0 HG22 THR B 26 11.339 -7.422 1.456 1.00 43.44 H new ATOM 0 HG23 THR B 26 10.253 -7.920 0.137 1.00 43.44 H new ATOM 2219 N ILE B 27 10.676 -8.386 4.437 1.00 71.12 N ATOM 2220 CA ILE B 27 11.922 -8.654 5.199 1.00 34.45 C ATOM 2221 C ILE B 27 11.952 -10.122 5.674 1.00 33.11 C ATOM 2222 O ILE B 27 12.972 -10.803 5.542 1.00 12.14 O ATOM 2223 CB ILE B 27 12.062 -7.678 6.430 1.00 24.33 C ATOM 2224 CG1 ILE B 27 12.168 -6.197 5.941 1.00 74.23 C ATOM 2225 CG2 ILE B 27 13.265 -8.054 7.339 1.00 71.32 C ATOM 2226 CD1 ILE B 27 12.079 -5.150 7.042 1.00 52.24 C ATOM 0 H ILE B 27 10.083 -7.673 4.861 1.00 71.12 H new ATOM 0 HA ILE B 27 12.767 -8.478 4.534 1.00 34.45 H new ATOM 0 HB ILE B 27 11.163 -7.781 7.037 1.00 24.33 H new ATOM 0 HG12 ILE B 27 13.114 -6.070 5.415 1.00 74.23 H new ATOM 0 HG13 ILE B 27 11.374 -6.011 5.218 1.00 74.23 H new ATOM 0 HG21 ILE B 27 13.323 -7.355 8.174 1.00 71.32 H new ATOM 0 HG22 ILE B 27 13.130 -9.066 7.721 1.00 71.32 H new ATOM 0 HG23 ILE B 27 14.187 -8.005 6.760 1.00 71.32 H new ATOM 0 HD11 ILE B 27 12.163 -4.155 6.605 1.00 52.24 H new ATOM 0 HD12 ILE B 27 11.122 -5.242 7.555 1.00 52.24 H new ATOM 0 HD13 ILE B 27 12.889 -5.302 7.755 1.00 52.24 H new ATOM 2238 N LYS B 28 10.794 -10.597 6.181 1.00 40.44 N ATOM 2239 CA LYS B 28 10.605 -12.000 6.608 1.00 1.45 C ATOM 2240 C LYS B 28 10.859 -12.963 5.429 1.00 42.32 C ATOM 2241 O LYS B 28 11.591 -13.942 5.571 1.00 1.33 O ATOM 2242 CB LYS B 28 9.167 -12.191 7.161 1.00 74.41 C ATOM 2243 CG LYS B 28 8.844 -13.615 7.672 1.00 40.32 C ATOM 2244 CD LYS B 28 7.361 -13.791 8.069 1.00 21.32 C ATOM 2245 CE LYS B 28 6.384 -13.519 6.906 1.00 41.13 C ATOM 2246 NZ LYS B 28 6.618 -14.416 5.739 1.00 72.30 N ATOM 0 H LYS B 28 9.964 -10.018 6.306 1.00 40.44 H new ATOM 0 HA LYS B 28 11.322 -12.228 7.396 1.00 1.45 H new ATOM 0 HB2 LYS B 28 9.011 -11.485 7.977 1.00 74.41 H new ATOM 0 HB3 LYS B 28 8.456 -11.933 6.376 1.00 74.41 H new ATOM 0 HG2 LYS B 28 9.096 -14.339 6.897 1.00 40.32 H new ATOM 0 HG3 LYS B 28 9.474 -13.838 8.533 1.00 40.32 H new ATOM 0 HD2 LYS B 28 7.207 -14.806 8.434 1.00 21.32 H new ATOM 0 HD3 LYS B 28 7.130 -13.117 8.894 1.00 21.32 H new ATOM 0 HE2 LYS B 28 5.361 -13.647 7.259 1.00 41.13 H new ATOM 0 HE3 LYS B 28 6.484 -12.481 6.588 1.00 41.13 H new ATOM 0 HZ1 LYS B 28 6.898 -13.847 4.915 1.00 72.30 H new ATOM 0 HZ2 LYS B 28 7.375 -15.092 5.967 1.00 72.30 H new ATOM 0 HZ3 LYS B 28 5.744 -14.936 5.520 1.00 72.30 H new ATOM 2260 N ASN B 29 10.289 -12.624 4.249 1.00 72.25 N ATOM 2261 CA ASN B 29 10.400 -13.448 3.022 1.00 24.34 C ATOM 2262 C ASN B 29 11.833 -13.438 2.467 1.00 54.42 C ATOM 2263 O ASN B 29 12.249 -14.406 1.838 1.00 41.52 O ATOM 2264 CB ASN B 29 9.421 -12.971 1.912 1.00 11.33 C ATOM 2265 CG ASN B 29 7.934 -13.111 2.269 1.00 55.32 C ATOM 2266 OD1 ASN B 29 7.544 -13.923 3.109 1.00 53.03 O ATOM 2267 ND2 ASN B 29 7.086 -12.321 1.618 1.00 33.11 N ATOM 0 H ASN B 29 9.740 -11.774 4.121 1.00 72.25 H new ATOM 0 HA ASN B 29 10.133 -14.465 3.311 1.00 24.34 H new ATOM 0 HB2 ASN B 29 9.630 -11.925 1.686 1.00 11.33 H new ATOM 0 HB3 ASN B 29 9.618 -13.539 1.003 1.00 11.33 H new ATOM 0 HD21 ASN B 29 6.086 -12.379 1.809 1.00 33.11 H new ATOM 0 HD22 ASN B 29 7.436 -11.657 0.927 1.00 33.11 H new ATOM 2274 N MET B 30 12.565 -12.326 2.694 1.00 14.42 N ATOM 2275 CA MET B 30 13.987 -12.204 2.318 1.00 41.53 C ATOM 2276 C MET B 30 14.823 -13.217 3.122 1.00 73.02 C ATOM 2277 O MET B 30 15.621 -13.959 2.554 1.00 14.45 O ATOM 2278 CB MET B 30 14.520 -10.752 2.556 1.00 53.42 C ATOM 2279 CG MET B 30 14.007 -9.689 1.570 1.00 3.44 C ATOM 2280 SD MET B 30 14.700 -8.050 1.898 1.00 21.31 S ATOM 2281 CE MET B 30 14.144 -7.117 0.468 1.00 53.31 C ATOM 0 H MET B 30 12.187 -11.491 3.142 1.00 14.42 H new ATOM 0 HA MET B 30 14.079 -12.419 1.253 1.00 41.53 H new ATOM 0 HB2 MET B 30 14.250 -10.446 3.567 1.00 53.42 H new ATOM 0 HB3 MET B 30 15.609 -10.771 2.509 1.00 53.42 H new ATOM 0 HG2 MET B 30 14.259 -9.990 0.553 1.00 3.44 H new ATOM 0 HG3 MET B 30 12.920 -9.639 1.628 1.00 3.44 H new ATOM 0 HE1 MET B 30 14.974 -6.534 0.069 1.00 53.31 H new ATOM 0 HE2 MET B 30 13.783 -7.804 -0.297 1.00 53.31 H new ATOM 0 HE3 MET B 30 13.338 -6.446 0.763 1.00 53.31 H new ATOM 2291 N ILE B 31 14.569 -13.261 4.444 1.00 62.42 N ATOM 2292 CA ILE B 31 15.261 -14.162 5.388 1.00 54.22 C ATOM 2293 C ILE B 31 14.956 -15.640 5.036 1.00 35.11 C ATOM 2294 O ILE B 31 15.864 -16.462 4.965 1.00 24.14 O ATOM 2295 CB ILE B 31 14.846 -13.836 6.884 1.00 35.13 C ATOM 2296 CG1 ILE B 31 15.202 -12.353 7.244 1.00 42.01 C ATOM 2297 CG2 ILE B 31 15.493 -14.820 7.894 1.00 53.44 C ATOM 2298 CD1 ILE B 31 14.703 -11.875 8.603 1.00 50.13 C ATOM 0 H ILE B 31 13.871 -12.667 4.892 1.00 62.42 H new ATOM 0 HA ILE B 31 16.335 -14.002 5.299 1.00 54.22 H new ATOM 0 HB ILE B 31 13.766 -13.963 6.958 1.00 35.13 H new ATOM 0 HG12 ILE B 31 16.286 -12.239 7.212 1.00 42.01 H new ATOM 0 HG13 ILE B 31 14.790 -11.701 6.474 1.00 42.01 H new ATOM 0 HG21 ILE B 31 15.182 -14.560 8.906 1.00 53.44 H new ATOM 0 HG22 ILE B 31 15.174 -15.837 7.666 1.00 53.44 H new ATOM 0 HG23 ILE B 31 16.579 -14.755 7.820 1.00 53.44 H new ATOM 0 HD11 ILE B 31 15.001 -10.838 8.756 1.00 50.13 H new ATOM 0 HD12 ILE B 31 13.616 -11.949 8.638 1.00 50.13 H new ATOM 0 HD13 ILE B 31 15.135 -12.496 9.388 1.00 50.13 H new ATOM 2310 N GLU B 32 13.668 -15.935 4.759 1.00 53.11 N ATOM 2311 CA GLU B 32 13.194 -17.299 4.417 1.00 3.13 C ATOM 2312 C GLU B 32 13.770 -17.781 3.069 1.00 11.34 C ATOM 2313 O GLU B 32 14.154 -18.947 2.935 1.00 4.34 O ATOM 2314 CB GLU B 32 11.642 -17.340 4.389 1.00 42.44 C ATOM 2315 CG GLU B 32 10.972 -17.074 5.756 1.00 72.04 C ATOM 2316 CD GLU B 32 9.438 -17.010 5.666 1.00 74.24 C ATOM 2317 OE1 GLU B 32 8.750 -17.987 6.047 1.00 72.01 O ATOM 2318 OE2 GLU B 32 8.913 -15.983 5.193 1.00 22.23 O ATOM 0 H GLU B 32 12.925 -15.236 4.765 1.00 53.11 H new ATOM 0 HA GLU B 32 13.553 -17.978 5.190 1.00 3.13 H new ATOM 0 HB2 GLU B 32 11.284 -16.601 3.673 1.00 42.44 H new ATOM 0 HB3 GLU B 32 11.323 -18.317 4.026 1.00 42.44 H new ATOM 0 HG2 GLU B 32 11.258 -17.860 6.455 1.00 72.04 H new ATOM 0 HG3 GLU B 32 11.347 -16.135 6.163 1.00 72.04 H new ATOM 2325 N ASP B 33 13.852 -16.853 2.096 1.00 14.42 N ATOM 2326 CA ASP B 33 14.354 -17.139 0.733 1.00 53.05 C ATOM 2327 C ASP B 33 15.854 -17.462 0.771 1.00 21.02 C ATOM 2328 O ASP B 33 16.311 -18.414 0.132 1.00 12.21 O ATOM 2329 CB ASP B 33 14.073 -15.930 -0.200 1.00 74.45 C ATOM 2330 CG ASP B 33 14.581 -16.127 -1.643 1.00 4.54 C ATOM 2331 OD1 ASP B 33 15.559 -15.470 -2.050 1.00 33.30 O ATOM 2332 OD2 ASP B 33 13.995 -16.943 -2.380 1.00 62.44 O ATOM 0 H ASP B 33 13.572 -15.881 2.231 1.00 14.42 H new ATOM 0 HA ASP B 33 13.831 -18.010 0.339 1.00 53.05 H new ATOM 0 HB2 ASP B 33 12.999 -15.744 -0.225 1.00 74.45 H new ATOM 0 HB3 ASP B 33 14.541 -15.041 0.222 1.00 74.45 H new ATOM 2337 N ILE B 34 16.603 -16.659 1.546 1.00 14.15 N ATOM 2338 CA ILE B 34 18.043 -16.880 1.797 1.00 65.43 C ATOM 2339 C ILE B 34 18.250 -18.174 2.621 1.00 3.43 C ATOM 2340 O ILE B 34 19.241 -18.890 2.442 1.00 52.12 O ATOM 2341 CB ILE B 34 18.675 -15.635 2.551 1.00 54.44 C ATOM 2342 CG1 ILE B 34 18.613 -14.349 1.666 1.00 24.42 C ATOM 2343 CG2 ILE B 34 20.125 -15.894 3.035 1.00 63.51 C ATOM 2344 CD1 ILE B 34 19.409 -14.411 0.370 1.00 32.03 C ATOM 0 H ILE B 34 16.229 -15.836 2.018 1.00 14.15 H new ATOM 0 HA ILE B 34 18.549 -16.992 0.838 1.00 65.43 H new ATOM 0 HB ILE B 34 18.067 -15.478 3.442 1.00 54.44 H new ATOM 0 HG12 ILE B 34 17.570 -14.145 1.423 1.00 24.42 H new ATOM 0 HG13 ILE B 34 18.974 -13.505 2.254 1.00 24.42 H new ATOM 0 HG21 ILE B 34 20.503 -15.007 3.543 1.00 63.51 H new ATOM 0 HG22 ILE B 34 20.133 -16.738 3.725 1.00 63.51 H new ATOM 0 HG23 ILE B 34 20.760 -16.120 2.178 1.00 63.51 H new ATOM 0 HD11 ILE B 34 19.300 -13.470 -0.170 1.00 32.03 H new ATOM 0 HD12 ILE B 34 20.462 -14.579 0.597 1.00 32.03 H new ATOM 0 HD13 ILE B 34 19.036 -15.229 -0.247 1.00 32.03 H new ATOM 2356 N GLY B 35 17.266 -18.480 3.488 1.00 14.12 N ATOM 2357 CA GLY B 35 17.393 -19.536 4.495 1.00 20.12 C ATOM 2358 C GLY B 35 18.127 -19.042 5.741 1.00 42.41 C ATOM 2359 O GLY B 35 18.617 -19.854 6.541 1.00 70.41 O ATOM 0 H GLY B 35 16.366 -18.001 3.505 1.00 14.12 H new ATOM 0 HA2 GLY B 35 16.402 -19.894 4.774 1.00 20.12 H new ATOM 0 HA3 GLY B 35 17.930 -20.383 4.068 1.00 20.12 H new ATOM 2363 N GLU B 36 18.182 -17.689 5.874 1.00 74.12 N ATOM 2364 CA GLU B 36 18.892 -16.937 6.924 1.00 63.10 C ATOM 2365 C GLU B 36 20.423 -17.020 6.734 1.00 52.14 C ATOM 2366 O GLU B 36 20.958 -18.064 6.362 1.00 52.31 O ATOM 2367 CB GLU B 36 18.472 -17.365 8.361 1.00 23.12 C ATOM 2368 CG GLU B 36 19.052 -16.479 9.484 1.00 23.54 C ATOM 2369 CD GLU B 36 18.718 -16.994 10.890 1.00 3.20 C ATOM 2370 OE1 GLU B 36 19.344 -17.986 11.327 1.00 55.41 O ATOM 2371 OE2 GLU B 36 17.835 -16.422 11.560 1.00 62.20 O ATOM 0 H GLU B 36 17.707 -17.071 5.216 1.00 74.12 H new ATOM 0 HA GLU B 36 18.594 -15.894 6.815 1.00 63.10 H new ATOM 0 HB2 GLU B 36 17.384 -17.350 8.428 1.00 23.12 H new ATOM 0 HB3 GLU B 36 18.788 -18.395 8.527 1.00 23.12 H new ATOM 0 HG2 GLU B 36 20.135 -16.423 9.372 1.00 23.54 H new ATOM 0 HG3 GLU B 36 18.667 -15.465 9.374 1.00 23.54 H new ATOM 2378 N SER B 37 21.114 -15.904 6.998 1.00 42.13 N ATOM 2379 CA SER B 37 22.566 -15.790 6.836 1.00 55.02 C ATOM 2380 C SER B 37 23.109 -14.762 7.828 1.00 54.52 C ATOM 2381 O SER B 37 22.356 -13.923 8.344 1.00 60.22 O ATOM 2382 CB SER B 37 22.905 -15.383 5.375 1.00 42.12 C ATOM 2383 OG SER B 37 24.300 -15.277 5.161 1.00 54.45 O ATOM 0 H SER B 37 20.675 -15.047 7.333 1.00 42.13 H new ATOM 0 HA SER B 37 23.035 -16.753 7.039 1.00 55.02 H new ATOM 0 HB2 SER B 37 22.488 -16.120 4.688 1.00 42.12 H new ATOM 0 HB3 SER B 37 22.430 -14.429 5.146 1.00 42.12 H new ATOM 0 HG SER B 37 24.470 -15.021 4.230 1.00 54.45 H new ATOM 2389 N ASP B 38 24.423 -14.834 8.089 1.00 11.45 N ATOM 2390 CA ASP B 38 25.138 -13.844 8.910 1.00 63.43 C ATOM 2391 C ASP B 38 25.409 -12.558 8.100 1.00 23.23 C ATOM 2392 O ASP B 38 25.837 -11.543 8.658 1.00 1.13 O ATOM 2393 CB ASP B 38 26.462 -14.443 9.451 1.00 74.25 C ATOM 2394 CG ASP B 38 27.443 -14.865 8.338 1.00 42.10 C ATOM 2395 OD1 ASP B 38 27.250 -15.954 7.749 1.00 21.11 O ATOM 2396 OD2 ASP B 38 28.414 -14.122 8.048 1.00 31.35 O ATOM 0 H ASP B 38 25.021 -15.581 7.736 1.00 11.45 H new ATOM 0 HA ASP B 38 24.508 -13.582 9.760 1.00 63.43 H new ATOM 0 HB2 ASP B 38 26.948 -13.710 10.094 1.00 74.25 H new ATOM 0 HB3 ASP B 38 26.233 -15.310 10.071 1.00 74.25 H new ATOM 2401 N SER B 39 25.179 -12.630 6.776 1.00 11.11 N ATOM 2402 CA SER B 39 25.281 -11.481 5.873 1.00 1.32 C ATOM 2403 C SER B 39 24.187 -10.425 6.219 1.00 64.35 C ATOM 2404 O SER B 39 23.000 -10.779 6.285 1.00 65.31 O ATOM 2405 CB SER B 39 25.116 -11.970 4.412 1.00 22.43 C ATOM 2406 OG SER B 39 26.015 -13.037 4.124 1.00 22.15 O ATOM 0 H SER B 39 24.916 -13.495 6.305 1.00 11.11 H new ATOM 0 HA SER B 39 26.257 -11.011 5.989 1.00 1.32 H new ATOM 0 HB2 SER B 39 24.090 -12.301 4.250 1.00 22.43 H new ATOM 0 HB3 SER B 39 25.297 -11.143 3.726 1.00 22.43 H new ATOM 0 HG SER B 39 25.890 -13.329 3.197 1.00 22.15 H new ATOM 2412 N PRO B 40 24.575 -9.135 6.503 1.00 75.04 N ATOM 2413 CA PRO B 40 23.609 -8.021 6.677 1.00 52.40 C ATOM 2414 C PRO B 40 22.740 -7.814 5.422 1.00 64.42 C ATOM 2415 O PRO B 40 23.274 -7.550 4.340 1.00 11.42 O ATOM 2416 CB PRO B 40 24.518 -6.788 6.963 1.00 23.02 C ATOM 2417 CG PRO B 40 25.792 -7.378 7.489 1.00 74.24 C ATOM 2418 CD PRO B 40 25.969 -8.678 6.731 1.00 64.52 C ATOM 0 HA PRO B 40 22.893 -8.208 7.477 1.00 52.40 H new ATOM 0 HB2 PRO B 40 24.694 -6.205 6.059 1.00 23.02 H new ATOM 0 HB3 PRO B 40 24.061 -6.117 7.690 1.00 23.02 H new ATOM 0 HG2 PRO B 40 26.635 -6.707 7.323 1.00 74.24 H new ATOM 0 HG3 PRO B 40 25.731 -7.553 8.563 1.00 74.24 H new ATOM 0 HD2 PRO B 40 26.501 -8.526 5.792 1.00 64.52 H new ATOM 0 HD3 PRO B 40 26.541 -9.405 7.308 1.00 64.52 H new ATOM 2426 N ILE B 41 21.414 -8.000 5.586 1.00 11.52 N ATOM 2427 CA ILE B 41 20.420 -7.817 4.516 1.00 41.31 C ATOM 2428 C ILE B 41 20.425 -6.335 4.053 1.00 34.44 C ATOM 2429 O ILE B 41 20.051 -5.454 4.833 1.00 73.54 O ATOM 2430 CB ILE B 41 18.971 -8.257 4.995 1.00 41.14 C ATOM 2431 CG1 ILE B 41 18.970 -9.740 5.512 1.00 75.22 C ATOM 2432 CG2 ILE B 41 17.917 -8.068 3.873 1.00 73.45 C ATOM 2433 CD1 ILE B 41 19.393 -10.797 4.489 1.00 41.33 C ATOM 0 H ILE B 41 21.002 -8.284 6.475 1.00 11.52 H new ATOM 0 HA ILE B 41 20.689 -8.455 3.674 1.00 41.31 H new ATOM 0 HB ILE B 41 18.694 -7.607 5.825 1.00 41.14 H new ATOM 0 HG12 ILE B 41 19.636 -9.806 6.373 1.00 75.22 H new ATOM 0 HG13 ILE B 41 17.968 -9.982 5.865 1.00 75.22 H new ATOM 0 HG21 ILE B 41 16.938 -8.379 4.237 1.00 73.45 H new ATOM 0 HG22 ILE B 41 17.879 -7.018 3.583 1.00 73.45 H new ATOM 0 HG23 ILE B 41 18.192 -8.674 3.009 1.00 73.45 H new ATOM 0 HD11 ILE B 41 19.357 -11.784 4.950 1.00 41.33 H new ATOM 0 HD12 ILE B 41 18.715 -10.770 3.636 1.00 41.33 H new ATOM 0 HD13 ILE B 41 20.409 -10.591 4.152 1.00 41.33 H new ATOM 2445 N PRO B 42 20.910 -6.038 2.801 1.00 73.25 N ATOM 2446 CA PRO B 42 20.994 -4.662 2.293 1.00 21.30 C ATOM 2447 C PRO B 42 19.714 -4.246 1.523 1.00 11.43 C ATOM 2448 O PRO B 42 19.377 -4.825 0.487 1.00 3.15 O ATOM 2449 CB PRO B 42 22.244 -4.742 1.385 1.00 45.14 C ATOM 2450 CG PRO B 42 22.242 -6.142 0.821 1.00 71.43 C ATOM 2451 CD PRO B 42 21.430 -7.006 1.789 1.00 53.21 C ATOM 0 HA PRO B 42 21.073 -3.903 3.071 1.00 21.30 H new ATOM 0 HB2 PRO B 42 22.200 -3.998 0.590 1.00 45.14 H new ATOM 0 HB3 PRO B 42 23.154 -4.548 1.952 1.00 45.14 H new ATOM 0 HG2 PRO B 42 21.800 -6.157 -0.175 1.00 71.43 H new ATOM 0 HG3 PRO B 42 23.259 -6.521 0.724 1.00 71.43 H new ATOM 0 HD2 PRO B 42 20.617 -7.521 1.277 1.00 53.21 H new ATOM 0 HD3 PRO B 42 22.050 -7.773 2.254 1.00 53.21 H new ATOM 2459 N LEU B 43 18.985 -3.263 2.073 1.00 44.13 N ATOM 2460 CA LEU B 43 17.760 -2.718 1.467 1.00 13.33 C ATOM 2461 C LEU B 43 18.127 -1.435 0.662 1.00 13.31 C ATOM 2462 O LEU B 43 18.322 -0.367 1.262 1.00 65.52 O ATOM 2463 CB LEU B 43 16.673 -2.412 2.558 1.00 22.33 C ATOM 2464 CG LEU B 43 16.159 -3.622 3.437 1.00 62.15 C ATOM 2465 CD1 LEU B 43 17.209 -4.106 4.455 1.00 60.12 C ATOM 2466 CD2 LEU B 43 14.842 -3.267 4.158 1.00 75.02 C ATOM 0 H LEU B 43 19.231 -2.820 2.958 1.00 44.13 H new ATOM 0 HA LEU B 43 17.330 -3.459 0.792 1.00 13.33 H new ATOM 0 HB2 LEU B 43 17.076 -1.655 3.231 1.00 22.33 H new ATOM 0 HB3 LEU B 43 15.811 -1.969 2.059 1.00 22.33 H new ATOM 0 HG LEU B 43 15.974 -4.444 2.746 1.00 62.15 H new ATOM 0 HD11 LEU B 43 16.802 -4.937 5.030 1.00 60.12 H new ATOM 0 HD12 LEU B 43 18.104 -4.434 3.926 1.00 60.12 H new ATOM 0 HD13 LEU B 43 17.465 -3.289 5.130 1.00 60.12 H new ATOM 0 HD21 LEU B 43 14.513 -4.118 4.754 1.00 75.02 H new ATOM 0 HD22 LEU B 43 15.004 -2.408 4.809 1.00 75.02 H new ATOM 0 HD23 LEU B 43 14.077 -3.024 3.420 1.00 75.02 H new ATOM 2478 N PRO B 44 18.239 -1.516 -0.712 1.00 53.34 N ATOM 2479 CA PRO B 44 18.691 -0.388 -1.567 1.00 63.42 C ATOM 2480 C PRO B 44 17.521 0.530 -2.005 1.00 60.41 C ATOM 2481 O PRO B 44 17.462 0.992 -3.155 1.00 3.53 O ATOM 2482 CB PRO B 44 19.327 -1.143 -2.758 1.00 2.24 C ATOM 2483 CG PRO B 44 18.459 -2.357 -2.937 1.00 40.02 C ATOM 2484 CD PRO B 44 17.930 -2.713 -1.548 1.00 2.13 C ATOM 0 HA PRO B 44 19.372 0.300 -1.066 1.00 63.42 H new ATOM 0 HB2 PRO B 44 19.340 -0.528 -3.657 1.00 2.24 H new ATOM 0 HB3 PRO B 44 20.360 -1.420 -2.547 1.00 2.24 H new ATOM 0 HG2 PRO B 44 17.639 -2.151 -3.625 1.00 40.02 H new ATOM 0 HG3 PRO B 44 19.029 -3.184 -3.360 1.00 40.02 H new ATOM 0 HD2 PRO B 44 16.859 -2.915 -1.571 1.00 2.13 H new ATOM 0 HD3 PRO B 44 18.415 -3.607 -1.156 1.00 2.13 H new ATOM 2492 N ASN B 45 16.616 0.827 -1.060 1.00 14.31 N ATOM 2493 CA ASN B 45 15.405 1.625 -1.315 1.00 52.21 C ATOM 2494 C ASN B 45 15.126 2.551 -0.121 1.00 5.42 C ATOM 2495 O ASN B 45 14.971 3.768 -0.276 1.00 53.22 O ATOM 2496 CB ASN B 45 14.203 0.676 -1.575 1.00 41.43 C ATOM 2497 CG ASN B 45 12.895 1.411 -1.886 1.00 33.31 C ATOM 2498 OD1 ASN B 45 12.110 1.728 -0.986 1.00 22.30 O ATOM 2499 ND2 ASN B 45 12.649 1.685 -3.164 1.00 32.34 N ATOM 0 H ASN B 45 16.703 0.519 -0.092 1.00 14.31 H new ATOM 0 HA ASN B 45 15.555 2.246 -2.198 1.00 52.21 H new ATOM 0 HB2 ASN B 45 14.446 0.016 -2.408 1.00 41.43 H new ATOM 0 HB3 ASN B 45 14.055 0.043 -0.700 1.00 41.43 H new ATOM 0 HD21 ASN B 45 11.791 2.171 -3.425 1.00 32.34 H new ATOM 0 HD22 ASN B 45 13.318 1.409 -3.883 1.00 32.34 H new ATOM 2506 N VAL B 46 15.076 1.953 1.078 1.00 14.00 N ATOM 2507 CA VAL B 46 14.723 2.664 2.314 1.00 4.12 C ATOM 2508 C VAL B 46 15.991 3.252 2.993 1.00 2.24 C ATOM 2509 O VAL B 46 16.997 2.555 3.157 1.00 43.44 O ATOM 2510 CB VAL B 46 13.914 1.708 3.274 1.00 71.43 C ATOM 2511 CG1 VAL B 46 14.735 0.484 3.719 1.00 14.32 C ATOM 2512 CG2 VAL B 46 13.331 2.476 4.474 1.00 22.31 C ATOM 0 H VAL B 46 15.279 0.963 1.218 1.00 14.00 H new ATOM 0 HA VAL B 46 14.078 3.508 2.072 1.00 4.12 H new ATOM 0 HB VAL B 46 13.076 1.319 2.696 1.00 71.43 H new ATOM 0 HG11 VAL B 46 14.131 -0.140 4.378 1.00 14.32 H new ATOM 0 HG12 VAL B 46 15.031 -0.094 2.843 1.00 14.32 H new ATOM 0 HG13 VAL B 46 15.626 0.817 4.252 1.00 14.32 H new ATOM 0 HG21 VAL B 46 12.780 1.787 5.114 1.00 22.31 H new ATOM 0 HG22 VAL B 46 14.142 2.931 5.043 1.00 22.31 H new ATOM 0 HG23 VAL B 46 12.658 3.255 4.115 1.00 22.31 H new ATOM 2522 N THR B 47 15.936 4.547 3.359 1.00 11.10 N ATOM 2523 CA THR B 47 17.064 5.279 3.979 1.00 50.22 C ATOM 2524 C THR B 47 17.184 4.941 5.479 1.00 23.41 C ATOM 2525 O THR B 47 16.341 4.220 6.011 1.00 21.44 O ATOM 2526 CB THR B 47 16.888 6.816 3.786 1.00 52.34 C ATOM 2527 OG1 THR B 47 15.636 7.226 4.349 1.00 41.31 O ATOM 2528 CG2 THR B 47 16.956 7.221 2.298 1.00 14.25 C ATOM 0 H THR B 47 15.103 5.121 3.233 1.00 11.10 H new ATOM 0 HA THR B 47 17.983 4.965 3.483 1.00 50.22 H new ATOM 0 HB THR B 47 17.709 7.317 4.298 1.00 52.34 H new ATOM 0 HG1 THR B 47 15.525 8.192 4.230 1.00 41.31 H new ATOM 0 HG21 THR B 47 16.829 8.300 2.208 1.00 14.25 H new ATOM 0 HG22 THR B 47 17.924 6.934 1.887 1.00 14.25 H new ATOM 0 HG23 THR B 47 16.163 6.715 1.747 1.00 14.25 H new ATOM 2536 N SER B 48 18.232 5.472 6.147 1.00 15.32 N ATOM 2537 CA SER B 48 18.539 5.152 7.560 1.00 5.00 C ATOM 2538 C SER B 48 17.423 5.584 8.517 1.00 52.41 C ATOM 2539 O SER B 48 16.973 4.790 9.336 1.00 11.21 O ATOM 2540 CB SER B 48 19.861 5.816 7.982 1.00 21.45 C ATOM 2541 OG SER B 48 19.845 7.214 7.725 1.00 23.31 O ATOM 0 H SER B 48 18.886 6.131 5.725 1.00 15.32 H new ATOM 0 HA SER B 48 18.628 4.068 7.624 1.00 5.00 H new ATOM 0 HB2 SER B 48 20.035 5.642 9.044 1.00 21.45 H new ATOM 0 HB3 SER B 48 20.689 5.355 7.444 1.00 21.45 H new ATOM 0 HG SER B 48 20.731 7.501 7.420 1.00 23.31 H new ATOM 2547 N THR B 49 16.975 6.837 8.378 1.00 62.40 N ATOM 2548 CA THR B 49 15.974 7.436 9.268 1.00 70.13 C ATOM 2549 C THR B 49 14.619 6.728 9.127 1.00 1.51 C ATOM 2550 O THR B 49 13.949 6.459 10.121 1.00 74.33 O ATOM 2551 CB THR B 49 15.814 8.959 8.967 1.00 55.22 C ATOM 2552 OG1 THR B 49 15.478 9.146 7.582 1.00 60.42 O ATOM 2553 CG2 THR B 49 17.093 9.755 9.284 1.00 2.43 C ATOM 0 H THR B 49 17.298 7.466 7.643 1.00 62.40 H new ATOM 0 HA THR B 49 16.322 7.313 10.294 1.00 70.13 H new ATOM 0 HB THR B 49 15.017 9.333 9.610 1.00 55.22 H new ATOM 0 HG1 THR B 49 15.376 10.103 7.396 1.00 60.42 H new ATOM 0 HG21 THR B 49 16.931 10.809 9.058 1.00 2.43 H new ATOM 0 HG22 THR B 49 17.338 9.644 10.340 1.00 2.43 H new ATOM 0 HG23 THR B 49 17.917 9.376 8.679 1.00 2.43 H new ATOM 2561 N ILE B 50 14.257 6.394 7.874 1.00 23.52 N ATOM 2562 CA ILE B 50 12.966 5.781 7.552 1.00 73.24 C ATOM 2563 C ILE B 50 12.955 4.297 7.980 1.00 41.24 C ATOM 2564 O ILE B 50 11.976 3.836 8.557 1.00 14.12 O ATOM 2565 CB ILE B 50 12.639 5.934 6.019 1.00 44.23 C ATOM 2566 CG1 ILE B 50 12.645 7.439 5.600 1.00 31.51 C ATOM 2567 CG2 ILE B 50 11.292 5.268 5.643 1.00 34.51 C ATOM 2568 CD1 ILE B 50 11.634 8.320 6.322 1.00 51.53 C ATOM 0 H ILE B 50 14.855 6.544 7.061 1.00 23.52 H new ATOM 0 HA ILE B 50 12.187 6.301 8.109 1.00 73.24 H new ATOM 0 HB ILE B 50 13.423 5.414 5.468 1.00 44.23 H new ATOM 0 HG12 ILE B 50 13.643 7.843 5.772 1.00 31.51 H new ATOM 0 HG13 ILE B 50 12.457 7.501 4.528 1.00 31.51 H new ATOM 0 HG21 ILE B 50 11.107 5.398 4.577 1.00 34.51 H new ATOM 0 HG22 ILE B 50 11.334 4.204 5.877 1.00 34.51 H new ATOM 0 HG23 ILE B 50 10.486 5.732 6.210 1.00 34.51 H new ATOM 0 HD11 ILE B 50 11.719 9.344 5.959 1.00 51.53 H new ATOM 0 HD12 ILE B 50 10.627 7.950 6.130 1.00 51.53 H new ATOM 0 HD13 ILE B 50 11.831 8.297 7.394 1.00 51.53 H new ATOM 2580 N LEU B 51 14.079 3.575 7.735 1.00 65.31 N ATOM 2581 CA LEU B 51 14.206 2.147 8.109 1.00 14.22 C ATOM 2582 C LEU B 51 14.210 2.008 9.639 1.00 55.15 C ATOM 2583 O LEU B 51 13.497 1.168 10.176 1.00 53.24 O ATOM 2584 CB LEU B 51 15.484 1.484 7.508 1.00 31.41 C ATOM 2585 CG LEU B 51 15.648 -0.053 7.790 1.00 53.35 C ATOM 2586 CD1 LEU B 51 14.440 -0.869 7.268 1.00 53.12 C ATOM 2587 CD2 LEU B 51 16.973 -0.597 7.215 1.00 55.44 C ATOM 0 H LEU B 51 14.907 3.960 7.281 1.00 65.31 H new ATOM 0 HA LEU B 51 13.346 1.623 7.691 1.00 14.22 H new ATOM 0 HB2 LEU B 51 15.479 1.639 6.429 1.00 31.41 H new ATOM 0 HB3 LEU B 51 16.359 2.002 7.900 1.00 31.41 H new ATOM 0 HG LEU B 51 15.680 -0.173 8.873 1.00 53.35 H new ATOM 0 HD11 LEU B 51 14.595 -1.926 7.484 1.00 53.12 H new ATOM 0 HD12 LEU B 51 13.530 -0.527 7.761 1.00 53.12 H new ATOM 0 HD13 LEU B 51 14.344 -0.729 6.191 1.00 53.12 H new ATOM 0 HD21 LEU B 51 17.052 -1.663 7.429 1.00 55.44 H new ATOM 0 HD22 LEU B 51 16.993 -0.441 6.136 1.00 55.44 H new ATOM 0 HD23 LEU B 51 17.811 -0.072 7.673 1.00 55.44 H new ATOM 2599 N GLU B 52 14.988 2.886 10.321 1.00 53.24 N ATOM 2600 CA GLU B 52 15.044 2.952 11.798 1.00 34.02 C ATOM 2601 C GLU B 52 13.637 3.144 12.368 1.00 54.24 C ATOM 2602 O GLU B 52 13.243 2.471 13.312 1.00 43.41 O ATOM 2603 CB GLU B 52 15.905 4.153 12.274 1.00 42.42 C ATOM 2604 CG GLU B 52 16.098 4.224 13.807 1.00 75.32 C ATOM 2605 CD GLU B 52 16.714 5.545 14.287 1.00 4.23 C ATOM 2606 OE1 GLU B 52 17.948 5.640 14.379 1.00 32.14 O ATOM 2607 OE2 GLU B 52 15.960 6.496 14.570 1.00 22.15 O ATOM 0 H GLU B 52 15.592 3.566 9.860 1.00 53.24 H new ATOM 0 HA GLU B 52 15.484 2.018 12.147 1.00 34.02 H new ATOM 0 HB2 GLU B 52 16.884 4.096 11.798 1.00 42.42 H new ATOM 0 HB3 GLU B 52 15.439 5.078 11.934 1.00 42.42 H new ATOM 0 HG2 GLU B 52 15.133 4.085 14.293 1.00 75.32 H new ATOM 0 HG3 GLU B 52 16.736 3.399 14.123 1.00 75.32 H new ATOM 2614 N LYS B 53 12.908 4.073 11.733 1.00 62.43 N ATOM 2615 CA LYS B 53 11.597 4.531 12.191 1.00 20.42 C ATOM 2616 C LYS B 53 10.565 3.400 12.093 1.00 64.31 C ATOM 2617 O LYS B 53 9.818 3.161 13.035 1.00 30.15 O ATOM 2618 CB LYS B 53 11.139 5.771 11.368 1.00 75.14 C ATOM 2619 CG LYS B 53 10.360 6.801 12.187 1.00 51.13 C ATOM 2620 CD LYS B 53 9.786 7.942 11.326 1.00 10.14 C ATOM 2621 CE LYS B 53 8.962 8.927 12.154 1.00 31.02 C ATOM 2622 NZ LYS B 53 9.795 9.623 13.168 1.00 44.32 N ATOM 0 H LYS B 53 13.220 4.531 10.876 1.00 62.43 H new ATOM 0 HA LYS B 53 11.678 4.825 13.238 1.00 20.42 H new ATOM 0 HB2 LYS B 53 12.016 6.252 10.935 1.00 75.14 H new ATOM 0 HB3 LYS B 53 10.518 5.435 10.538 1.00 75.14 H new ATOM 0 HG2 LYS B 53 9.544 6.301 12.709 1.00 51.13 H new ATOM 0 HG3 LYS B 53 11.015 7.222 12.949 1.00 51.13 H new ATOM 0 HD2 LYS B 53 10.603 8.474 10.838 1.00 10.14 H new ATOM 0 HD3 LYS B 53 9.163 7.522 10.537 1.00 10.14 H new ATOM 0 HE2 LYS B 53 8.502 9.662 11.494 1.00 31.02 H new ATOM 0 HE3 LYS B 53 8.151 8.395 12.652 1.00 31.02 H new ATOM 0 HZ1 LYS B 53 9.237 10.377 13.617 1.00 44.32 H new ATOM 0 HZ2 LYS B 53 10.103 8.942 13.891 1.00 44.32 H new ATOM 0 HZ3 LYS B 53 10.629 10.038 12.706 1.00 44.32 H new ATOM 2636 N VAL B 54 10.567 2.712 10.938 1.00 64.05 N ATOM 2637 CA VAL B 54 9.662 1.587 10.655 1.00 53.20 C ATOM 2638 C VAL B 54 9.926 0.417 11.626 1.00 12.34 C ATOM 2639 O VAL B 54 8.987 -0.110 12.233 1.00 12.12 O ATOM 2640 CB VAL B 54 9.812 1.117 9.153 1.00 65.25 C ATOM 2641 CG1 VAL B 54 9.071 -0.209 8.884 1.00 34.20 C ATOM 2642 CG2 VAL B 54 9.323 2.219 8.179 1.00 30.41 C ATOM 0 H VAL B 54 11.203 2.924 10.169 1.00 64.05 H new ATOM 0 HA VAL B 54 8.637 1.925 10.805 1.00 53.20 H new ATOM 0 HB VAL B 54 10.873 0.940 8.978 1.00 65.25 H new ATOM 0 HG11 VAL B 54 9.201 -0.493 7.840 1.00 34.20 H new ATOM 0 HG12 VAL B 54 9.478 -0.990 9.526 1.00 34.20 H new ATOM 0 HG13 VAL B 54 8.009 -0.082 9.095 1.00 34.20 H new ATOM 0 HG21 VAL B 54 9.436 1.873 7.152 1.00 30.41 H new ATOM 0 HG22 VAL B 54 8.273 2.438 8.375 1.00 30.41 H new ATOM 0 HG23 VAL B 54 9.915 3.122 8.325 1.00 30.41 H new ATOM 2652 N LEU B 55 11.219 0.058 11.791 1.00 51.54 N ATOM 2653 CA LEU B 55 11.634 -1.070 12.649 1.00 54.24 C ATOM 2654 C LEU B 55 11.311 -0.781 14.130 1.00 22.41 C ATOM 2655 O LEU B 55 10.786 -1.647 14.827 1.00 2.04 O ATOM 2656 CB LEU B 55 13.155 -1.371 12.477 1.00 15.24 C ATOM 2657 CG LEU B 55 13.628 -1.798 11.046 1.00 14.11 C ATOM 2658 CD1 LEU B 55 15.140 -2.115 11.034 1.00 21.32 C ATOM 2659 CD2 LEU B 55 12.789 -2.971 10.486 1.00 73.23 C ATOM 0 H LEU B 55 11.996 0.538 11.337 1.00 51.54 H new ATOM 0 HA LEU B 55 11.071 -1.950 12.337 1.00 54.24 H new ATOM 0 HB2 LEU B 55 13.713 -0.482 12.769 1.00 15.24 H new ATOM 0 HB3 LEU B 55 13.427 -2.162 13.176 1.00 15.24 H new ATOM 0 HG LEU B 55 13.463 -0.951 10.380 1.00 14.11 H new ATOM 0 HD11 LEU B 55 15.442 -2.409 10.029 1.00 21.32 H new ATOM 0 HD12 LEU B 55 15.700 -1.230 11.337 1.00 21.32 H new ATOM 0 HD13 LEU B 55 15.346 -2.930 11.728 1.00 21.32 H new ATOM 0 HD21 LEU B 55 13.151 -3.235 9.492 1.00 73.23 H new ATOM 0 HD22 LEU B 55 12.882 -3.833 11.147 1.00 73.23 H new ATOM 0 HD23 LEU B 55 11.742 -2.673 10.424 1.00 73.23 H new ATOM 2671 N ASP B 56 11.585 0.463 14.568 1.00 0.13 N ATOM 2672 CA ASP B 56 11.402 0.902 15.977 1.00 42.33 C ATOM 2673 C ASP B 56 9.905 1.036 16.308 1.00 63.52 C ATOM 2674 O ASP B 56 9.484 0.787 17.442 1.00 25.10 O ATOM 2675 CB ASP B 56 12.141 2.247 16.232 1.00 50.31 C ATOM 2676 CG ASP B 56 12.177 2.645 17.719 1.00 54.05 C ATOM 2677 OD1 ASP B 56 11.433 3.559 18.135 1.00 51.42 O ATOM 2678 OD2 ASP B 56 12.941 2.023 18.489 1.00 31.44 O ATOM 0 H ASP B 56 11.941 1.199 13.958 1.00 0.13 H new ATOM 0 HA ASP B 56 11.834 0.145 16.632 1.00 42.33 H new ATOM 0 HB2 ASP B 56 13.162 2.170 15.858 1.00 50.31 H new ATOM 0 HB3 ASP B 56 11.652 3.037 15.662 1.00 50.31 H new ATOM 2683 N TYR B 57 9.114 1.420 15.292 1.00 70.33 N ATOM 2684 CA TYR B 57 7.641 1.435 15.361 1.00 72.14 C ATOM 2685 C TYR B 57 7.106 0.020 15.552 1.00 44.33 C ATOM 2686 O TYR B 57 6.228 -0.210 16.390 1.00 73.31 O ATOM 2687 CB TYR B 57 7.051 2.065 14.074 1.00 12.15 C ATOM 2688 CG TYR B 57 5.518 1.974 13.941 1.00 34.31 C ATOM 2689 CD1 TYR B 57 4.682 2.891 14.579 1.00 65.14 C ATOM 2690 CD2 TYR B 57 4.914 0.962 13.181 1.00 41.21 C ATOM 2691 CE1 TYR B 57 3.306 2.800 14.466 1.00 2.03 C ATOM 2692 CE2 TYR B 57 3.542 0.872 13.067 1.00 21.42 C ATOM 2693 CZ TYR B 57 2.743 1.790 13.709 1.00 14.01 C ATOM 2694 OH TYR B 57 1.372 1.686 13.608 1.00 24.43 O ATOM 0 H TYR B 57 9.481 1.731 14.392 1.00 70.33 H new ATOM 0 HA TYR B 57 7.337 2.039 16.216 1.00 72.14 H new ATOM 0 HB2 TYR B 57 7.341 3.115 14.037 1.00 12.15 H new ATOM 0 HB3 TYR B 57 7.504 1.579 13.210 1.00 12.15 H new ATOM 0 HD1 TYR B 57 5.116 3.684 15.170 1.00 65.14 H new ATOM 0 HD2 TYR B 57 5.535 0.238 12.675 1.00 41.21 H new ATOM 0 HE1 TYR B 57 2.673 3.517 14.968 1.00 2.03 H new ATOM 0 HE2 TYR B 57 3.097 0.085 12.477 1.00 21.42 H new ATOM 0 HH TYR B 57 0.950 2.400 14.130 1.00 24.43 H new ATOM 2704 N CYS B 58 7.652 -0.910 14.759 1.00 54.23 N ATOM 2705 CA CYS B 58 7.282 -2.317 14.813 1.00 22.01 C ATOM 2706 C CYS B 58 7.640 -2.918 16.189 1.00 13.40 C ATOM 2707 O CYS B 58 6.875 -3.720 16.727 1.00 31.22 O ATOM 2708 CB CYS B 58 7.971 -3.089 13.665 1.00 42.55 C ATOM 2709 SG CYS B 58 7.418 -2.612 12.008 1.00 43.31 S ATOM 0 H CYS B 58 8.365 -0.700 14.061 1.00 54.23 H new ATOM 0 HA CYS B 58 6.203 -2.407 14.684 1.00 22.01 H new ATOM 0 HB2 CYS B 58 9.048 -2.935 13.734 1.00 42.55 H new ATOM 0 HB3 CYS B 58 7.792 -4.156 13.802 1.00 42.55 H new ATOM 0 HG CYS B 58 7.860 -1.422 11.729 1.00 43.31 H new ATOM 2715 N ARG B 59 8.798 -2.489 16.760 1.00 13.14 N ATOM 2716 CA ARG B 59 9.268 -2.959 18.080 1.00 60.11 C ATOM 2717 C ARG B 59 8.326 -2.469 19.189 1.00 51.14 C ATOM 2718 O ARG B 59 7.871 -3.262 20.012 1.00 21.51 O ATOM 2719 CB ARG B 59 10.741 -2.518 18.357 1.00 45.51 C ATOM 2720 CG ARG B 59 11.792 -3.150 17.409 1.00 13.21 C ATOM 2721 CD ARG B 59 13.245 -2.837 17.804 1.00 64.40 C ATOM 2722 NE ARG B 59 13.635 -3.494 19.064 1.00 12.43 N ATOM 2723 CZ ARG B 59 14.608 -3.072 19.888 1.00 11.33 C ATOM 2724 NH1 ARG B 59 15.324 -1.974 19.616 1.00 61.12 N ATOM 2725 NH2 ARG B 59 14.860 -3.759 20.989 1.00 13.41 N ATOM 0 H ARG B 59 9.422 -1.814 16.318 1.00 13.14 H new ATOM 0 HA ARG B 59 9.255 -4.049 18.072 1.00 60.11 H new ATOM 0 HB2 ARG B 59 10.803 -1.433 18.275 1.00 45.51 H new ATOM 0 HB3 ARG B 59 10.996 -2.775 19.385 1.00 45.51 H new ATOM 0 HG2 ARG B 59 11.653 -4.231 17.395 1.00 13.21 H new ATOM 0 HG3 ARG B 59 11.615 -2.793 16.394 1.00 13.21 H new ATOM 0 HD2 ARG B 59 13.914 -3.160 17.006 1.00 64.40 H new ATOM 0 HD3 ARG B 59 13.367 -1.759 17.906 1.00 64.40 H new ATOM 0 HE ARG B 59 13.126 -4.336 19.332 1.00 12.43 H new ATOM 0 HH11 ARG B 59 15.135 -1.439 18.768 1.00 61.12 H new ATOM 0 HH12 ARG B 59 16.058 -1.672 20.257 1.00 61.12 H new ATOM 0 HH21 ARG B 59 14.319 -4.597 21.203 1.00 13.41 H new ATOM 0 HH22 ARG B 59 15.596 -3.451 21.625 1.00 13.41 H new ATOM 2739 N HIS B 60 7.994 -1.167 19.145 1.00 22.40 N ATOM 2740 CA HIS B 60 7.092 -0.520 20.118 1.00 1.14 C ATOM 2741 C HIS B 60 5.685 -1.149 20.091 1.00 20.34 C ATOM 2742 O HIS B 60 5.088 -1.417 21.142 1.00 1.31 O ATOM 2743 CB HIS B 60 6.995 1.003 19.834 1.00 15.04 C ATOM 2744 CG HIS B 60 6.005 1.711 20.721 1.00 31.50 C ATOM 2745 ND1 HIS B 60 4.792 2.175 20.272 1.00 61.42 N ATOM 2746 CD2 HIS B 60 6.035 1.973 22.044 1.00 52.32 C ATOM 2747 CE1 HIS B 60 4.119 2.676 21.281 1.00 22.50 C ATOM 2748 NE2 HIS B 60 4.848 2.568 22.366 1.00 35.31 N ATOM 0 H HIS B 60 8.345 -0.529 18.430 1.00 22.40 H new ATOM 0 HA HIS B 60 7.513 -0.676 21.111 1.00 1.14 H new ATOM 0 HB2 HIS B 60 7.979 1.454 19.966 1.00 15.04 H new ATOM 0 HB3 HIS B 60 6.712 1.154 18.792 1.00 15.04 H new ATOM 0 HD1 HIS B 60 4.466 2.136 19.306 1.00 61.42 H new ATOM 0 HD2 HIS B 60 6.846 1.753 22.722 1.00 52.32 H new ATOM 0 HE1 HIS B 60 3.130 3.106 21.227 1.00 22.50 H new ATOM 2757 N HIS B 61 5.182 -1.386 18.872 1.00 14.52 N ATOM 2758 CA HIS B 61 3.825 -1.918 18.645 1.00 22.33 C ATOM 2759 C HIS B 61 3.782 -3.422 19.004 1.00 65.25 C ATOM 2760 O HIS B 61 2.720 -3.959 19.326 1.00 15.34 O ATOM 2761 CB HIS B 61 3.400 -1.684 17.160 1.00 4.12 C ATOM 2762 CG HIS B 61 1.908 -1.578 16.935 1.00 3.12 C ATOM 2763 ND1 HIS B 61 0.997 -2.464 17.465 1.00 60.35 N ATOM 2764 CD2 HIS B 61 1.172 -0.659 16.257 1.00 64.31 C ATOM 2765 CE1 HIS B 61 -0.223 -2.095 17.133 1.00 23.34 C ATOM 2766 NE2 HIS B 61 -0.147 -1.002 16.406 1.00 54.30 N ATOM 0 H HIS B 61 5.703 -1.215 18.012 1.00 14.52 H new ATOM 0 HA HIS B 61 3.119 -1.392 19.288 1.00 22.33 H new ATOM 0 HB2 HIS B 61 3.873 -0.770 16.802 1.00 4.12 H new ATOM 0 HB3 HIS B 61 3.787 -2.502 16.553 1.00 4.12 H new ATOM 0 HD1 HIS B 61 1.231 -3.281 18.029 1.00 60.35 H new ATOM 0 HD2 HIS B 61 1.555 0.185 15.703 1.00 64.31 H new ATOM 0 HE1 HIS B 61 -1.133 -2.605 17.411 1.00 23.34 H new ATOM 2775 N HIS B 62 4.952 -4.089 18.933 1.00 31.52 N ATOM 2776 CA HIS B 62 5.099 -5.495 19.357 1.00 24.44 C ATOM 2777 C HIS B 62 5.151 -5.582 20.894 1.00 5.23 C ATOM 2778 O HIS B 62 4.692 -6.560 21.484 1.00 24.51 O ATOM 2779 CB HIS B 62 6.366 -6.117 18.722 1.00 32.21 C ATOM 2780 CG HIS B 62 6.538 -7.592 18.973 1.00 35.12 C ATOM 2781 ND1 HIS B 62 5.973 -8.562 18.168 1.00 21.44 N ATOM 2782 CD2 HIS B 62 7.231 -8.260 19.927 1.00 41.05 C ATOM 2783 CE1 HIS B 62 6.313 -9.752 18.615 1.00 1.14 C ATOM 2784 NE2 HIS B 62 7.071 -9.593 19.678 1.00 23.11 N ATOM 0 H HIS B 62 5.814 -3.672 18.583 1.00 31.52 H new ATOM 0 HA HIS B 62 4.235 -6.063 19.012 1.00 24.44 H new ATOM 0 HB2 HIS B 62 6.337 -5.947 17.646 1.00 32.21 H new ATOM 0 HB3 HIS B 62 7.242 -5.593 19.104 1.00 32.21 H new ATOM 0 HD2 HIS B 62 7.802 -7.821 20.732 1.00 41.05 H new ATOM 0 HE1 HIS B 62 6.020 -10.697 18.183 1.00 1.14 H new ATOM 0 HE2 HIS B 62 7.476 -10.348 20.231 1.00 23.11 H new ATOM 2793 N GLN B 63 5.725 -4.539 21.530 1.00 23.33 N ATOM 2794 CA GLN B 63 5.819 -4.428 23.000 1.00 50.22 C ATOM 2795 C GLN B 63 4.503 -3.898 23.612 1.00 55.21 C ATOM 2796 O GLN B 63 4.335 -3.923 24.833 1.00 31.32 O ATOM 2797 CB GLN B 63 7.022 -3.527 23.411 1.00 51.23 C ATOM 2798 CG GLN B 63 8.407 -4.080 22.995 1.00 61.53 C ATOM 2799 CD GLN B 63 8.723 -5.476 23.546 1.00 51.23 C ATOM 2800 OE1 GLN B 63 8.266 -5.861 24.619 1.00 45.11 O ATOM 2801 NE2 GLN B 63 9.497 -6.254 22.809 1.00 72.33 N ATOM 0 H GLN B 63 6.138 -3.748 21.036 1.00 23.33 H new ATOM 0 HA GLN B 63 5.989 -5.429 23.397 1.00 50.22 H new ATOM 0 HB2 GLN B 63 6.890 -2.541 22.967 1.00 51.23 H new ATOM 0 HB3 GLN B 63 7.008 -3.394 24.493 1.00 51.23 H new ATOM 0 HG2 GLN B 63 8.460 -4.112 21.907 1.00 61.53 H new ATOM 0 HG3 GLN B 63 9.178 -3.387 23.332 1.00 61.53 H new ATOM 0 HE21 GLN B 63 9.865 -5.913 21.921 1.00 72.33 H new ATOM 0 HE22 GLN B 63 9.726 -7.195 23.128 1.00 72.33 H new ATOM 2810 N HIS B 64 3.587 -3.390 22.754 1.00 23.43 N ATOM 2811 CA HIS B 64 2.207 -3.013 23.143 1.00 64.31 C ATOM 2812 C HIS B 64 1.193 -3.676 22.166 1.00 60.45 C ATOM 2813 O HIS B 64 0.705 -3.019 21.229 1.00 25.31 O ATOM 2814 CB HIS B 64 2.037 -1.456 23.184 1.00 73.31 C ATOM 2815 CG HIS B 64 2.776 -0.784 24.322 1.00 62.10 C ATOM 2816 ND1 HIS B 64 2.162 -0.419 25.500 1.00 62.23 N ATOM 2817 CD2 HIS B 64 4.081 -0.450 24.468 1.00 42.32 C ATOM 2818 CE1 HIS B 64 3.055 0.100 26.316 1.00 4.23 C ATOM 2819 NE2 HIS B 64 4.224 0.095 25.720 1.00 21.41 N ATOM 0 H HIS B 64 3.786 -3.229 21.767 1.00 23.43 H new ATOM 0 HA HIS B 64 2.008 -3.379 24.150 1.00 64.31 H new ATOM 0 HB2 HIS B 64 2.387 -1.038 22.240 1.00 73.31 H new ATOM 0 HB3 HIS B 64 0.976 -1.219 23.263 1.00 73.31 H new ATOM 0 HD2 HIS B 64 4.863 -0.587 23.736 1.00 42.32 H new ATOM 0 HE1 HIS B 64 2.858 0.469 27.312 1.00 4.23 H new ATOM 0 HE2 HIS B 64 5.096 0.440 26.121 1.00 21.41 H new ATOM 2917 N ILE B 73 -4.442 4.571 19.431 1.00 32.25 N ATOM 2918 CA ILE B 73 -3.333 5.414 18.957 1.00 11.25 C ATOM 2919 C ILE B 73 -2.395 5.696 20.159 1.00 45.10 C ATOM 2920 O ILE B 73 -2.641 6.637 20.926 1.00 0.05 O ATOM 2921 CB ILE B 73 -3.843 6.773 18.321 1.00 25.21 C ATOM 2922 CG1 ILE B 73 -4.916 6.499 17.212 1.00 22.31 C ATOM 2923 CG2 ILE B 73 -2.660 7.606 17.755 1.00 74.13 C ATOM 2924 CD1 ILE B 73 -5.585 7.742 16.635 1.00 22.35 C ATOM 0 HA ILE B 73 -2.799 4.885 18.168 1.00 11.25 H new ATOM 0 HB ILE B 73 -4.313 7.358 19.112 1.00 25.21 H new ATOM 0 HG12 ILE B 73 -4.442 5.950 16.398 1.00 22.31 H new ATOM 0 HG13 ILE B 73 -5.687 5.850 17.627 1.00 22.31 H new ATOM 0 HG21 ILE B 73 -3.040 8.533 17.325 1.00 74.13 H new ATOM 0 HG22 ILE B 73 -1.961 7.839 18.559 1.00 74.13 H new ATOM 0 HG23 ILE B 73 -2.147 7.032 16.983 1.00 74.13 H new ATOM 0 HD11 ILE B 73 -6.310 7.446 15.877 1.00 22.35 H new ATOM 0 HD12 ILE B 73 -6.094 8.284 17.432 1.00 22.35 H new ATOM 0 HD13 ILE B 73 -4.830 8.385 16.183 1.00 22.35 H new ATOM 2936 N PRO B 74 -1.361 4.817 20.406 1.00 32.23 N ATOM 2937 CA PRO B 74 -0.318 5.048 21.445 1.00 62.04 C ATOM 2938 C PRO B 74 0.467 6.372 21.224 1.00 52.03 C ATOM 2939 O PRO B 74 0.584 6.821 20.075 1.00 10.34 O ATOM 2940 CB PRO B 74 0.600 3.798 21.312 1.00 72.13 C ATOM 2941 CG PRO B 74 -0.275 2.749 20.694 1.00 11.22 C ATOM 2942 CD PRO B 74 -1.153 3.504 19.727 1.00 62.54 C ATOM 0 HA PRO B 74 -0.743 5.163 22.442 1.00 62.04 H new ATOM 0 HB2 PRO B 74 1.468 4.008 20.687 1.00 72.13 H new ATOM 0 HB3 PRO B 74 0.977 3.478 22.283 1.00 72.13 H new ATOM 0 HG2 PRO B 74 0.317 1.991 20.182 1.00 11.22 H new ATOM 0 HG3 PRO B 74 -0.869 2.234 21.449 1.00 11.22 H new ATOM 0 HD2 PRO B 74 -0.672 3.625 18.757 1.00 62.54 H new ATOM 0 HD3 PRO B 74 -2.097 2.987 19.553 1.00 62.54 H new ATOM 2950 N PRO B 75 0.995 7.015 22.326 1.00 22.02 N ATOM 2951 CA PRO B 75 1.778 8.285 22.254 1.00 61.24 C ATOM 2952 C PRO B 75 2.854 8.288 21.141 1.00 2.42 C ATOM 2953 O PRO B 75 2.861 9.182 20.292 1.00 33.41 O ATOM 2954 CB PRO B 75 2.417 8.374 23.659 1.00 75.23 C ATOM 2955 CG PRO B 75 1.427 7.697 24.564 1.00 74.13 C ATOM 2956 CD PRO B 75 0.837 6.565 23.746 1.00 0.41 C ATOM 0 HA PRO B 75 1.149 9.137 21.998 1.00 61.24 H new ATOM 0 HB2 PRO B 75 3.386 7.876 23.687 1.00 75.23 H new ATOM 0 HB3 PRO B 75 2.582 9.410 23.955 1.00 75.23 H new ATOM 0 HG2 PRO B 75 1.913 7.319 25.464 1.00 74.13 H new ATOM 0 HG3 PRO B 75 0.652 8.392 24.888 1.00 74.13 H new ATOM 0 HD2 PRO B 75 1.362 5.627 23.927 1.00 0.41 H new ATOM 0 HD3 PRO B 75 -0.211 6.397 23.996 1.00 0.41 H new ATOM 2964 N TYR B 76 3.718 7.245 21.134 1.00 13.14 N ATOM 2965 CA TYR B 76 4.810 7.103 20.142 1.00 13.14 C ATOM 2966 C TYR B 76 4.267 7.005 18.704 1.00 64.34 C ATOM 2967 O TYR B 76 4.841 7.590 17.791 1.00 72.31 O ATOM 2968 CB TYR B 76 5.717 5.871 20.455 1.00 31.13 C ATOM 2969 CG TYR B 76 6.772 5.586 19.364 1.00 62.42 C ATOM 2970 CD1 TYR B 76 7.977 6.290 19.314 1.00 13.24 C ATOM 2971 CD2 TYR B 76 6.525 4.651 18.351 1.00 24.15 C ATOM 2972 CE1 TYR B 76 8.887 6.074 18.300 1.00 31.43 C ATOM 2973 CE2 TYR B 76 7.433 4.434 17.344 1.00 33.41 C ATOM 2974 CZ TYR B 76 8.610 5.146 17.316 1.00 2.23 C ATOM 2975 OH TYR B 76 9.510 4.943 16.289 1.00 73.33 O ATOM 0 H TYR B 76 3.678 6.483 21.811 1.00 13.14 H new ATOM 0 HA TYR B 76 5.416 8.006 20.218 1.00 13.14 H new ATOM 0 HB2 TYR B 76 6.225 6.037 21.405 1.00 31.13 H new ATOM 0 HB3 TYR B 76 5.088 4.990 20.579 1.00 31.13 H new ATOM 0 HD1 TYR B 76 8.200 7.016 20.082 1.00 13.24 H new ATOM 0 HD2 TYR B 76 5.602 4.090 18.362 1.00 24.15 H new ATOM 0 HE1 TYR B 76 9.813 6.629 18.276 1.00 31.43 H new ATOM 0 HE2 TYR B 76 7.224 3.705 16.575 1.00 33.41 H new ATOM 0 HH TYR B 76 10.299 4.474 16.633 1.00 73.33 H new ATOM 2985 N ASP B 77 3.181 6.240 18.520 1.00 14.42 N ATOM 2986 CA ASP B 77 2.578 5.994 17.190 1.00 41.32 C ATOM 2987 C ASP B 77 1.996 7.297 16.602 1.00 51.31 C ATOM 2988 O ASP B 77 1.932 7.470 15.379 1.00 75.52 O ATOM 2989 CB ASP B 77 1.487 4.885 17.294 1.00 23.42 C ATOM 2990 CG ASP B 77 2.022 3.473 17.653 1.00 11.12 C ATOM 2991 OD1 ASP B 77 3.139 3.352 18.209 1.00 72.32 O ATOM 2992 OD2 ASP B 77 1.309 2.475 17.402 1.00 33.21 O ATOM 0 H ASP B 77 2.692 5.773 19.284 1.00 14.42 H new ATOM 0 HA ASP B 77 3.357 5.646 16.511 1.00 41.32 H new ATOM 0 HB2 ASP B 77 0.757 5.183 18.047 1.00 23.42 H new ATOM 0 HB3 ASP B 77 0.958 4.826 16.343 1.00 23.42 H new ATOM 2997 N ARG B 78 1.580 8.213 17.496 1.00 10.44 N ATOM 2998 CA ARG B 78 1.127 9.568 17.125 1.00 64.12 C ATOM 2999 C ARG B 78 2.361 10.451 16.778 1.00 54.40 C ATOM 3000 O ARG B 78 2.331 11.236 15.820 1.00 74.32 O ATOM 3001 CB ARG B 78 0.272 10.157 18.294 1.00 53.41 C ATOM 3002 CG ARG B 78 -0.723 11.292 17.919 1.00 71.32 C ATOM 3003 CD ARG B 78 -0.071 12.665 17.673 1.00 55.40 C ATOM 3004 NE ARG B 78 -1.069 13.695 17.356 1.00 45.01 N ATOM 3005 CZ ARG B 78 -0.799 14.980 17.072 1.00 11.11 C ATOM 3006 NH1 ARG B 78 0.454 15.442 17.042 1.00 24.12 N ATOM 3007 NH2 ARG B 78 -1.803 15.807 16.829 1.00 33.41 N ATOM 0 H ARG B 78 1.548 8.034 18.500 1.00 10.44 H new ATOM 0 HA ARG B 78 0.495 9.538 16.238 1.00 64.12 H new ATOM 0 HB2 ARG B 78 -0.293 9.343 18.748 1.00 53.41 H new ATOM 0 HB3 ARG B 78 0.952 10.537 19.057 1.00 53.41 H new ATOM 0 HG2 ARG B 78 -1.267 10.998 17.022 1.00 71.32 H new ATOM 0 HG3 ARG B 78 -1.457 11.392 18.719 1.00 71.32 H new ATOM 0 HD2 ARG B 78 0.491 12.964 18.558 1.00 55.40 H new ATOM 0 HD3 ARG B 78 0.643 12.586 16.853 1.00 55.40 H new ATOM 0 HE ARG B 78 -2.049 13.411 17.351 1.00 45.01 H new ATOM 0 HH11 ARG B 78 1.234 14.814 17.238 1.00 24.12 H new ATOM 0 HH12 ARG B 78 0.631 16.422 16.823 1.00 24.12 H new ATOM 0 HH21 ARG B 78 -2.764 15.466 16.859 1.00 33.41 H new ATOM 0 HH22 ARG B 78 -1.616 16.786 16.612 1.00 33.41 H new ATOM 3021 N ASP B 79 3.455 10.279 17.556 1.00 5.30 N ATOM 3022 CA ASP B 79 4.749 10.987 17.336 1.00 63.30 C ATOM 3023 C ASP B 79 5.460 10.482 16.062 1.00 60.34 C ATOM 3024 O ASP B 79 6.313 11.175 15.500 1.00 31.22 O ATOM 3025 CB ASP B 79 5.700 10.834 18.559 1.00 44.11 C ATOM 3026 CG ASP B 79 5.239 11.611 19.808 1.00 24.15 C ATOM 3027 OD1 ASP B 79 4.997 10.995 20.866 1.00 13.42 O ATOM 3028 OD2 ASP B 79 5.118 12.849 19.729 1.00 2.23 O ATOM 0 H ASP B 79 3.471 9.646 18.356 1.00 5.30 H new ATOM 0 HA ASP B 79 4.510 12.043 17.209 1.00 63.30 H new ATOM 0 HB2 ASP B 79 5.785 9.777 18.811 1.00 44.11 H new ATOM 0 HB3 ASP B 79 6.696 11.175 18.278 1.00 44.11 H new ATOM 3033 N PHE B 80 5.117 9.252 15.648 1.00 12.14 N ATOM 3034 CA PHE B 80 5.619 8.619 14.415 1.00 21.42 C ATOM 3035 C PHE B 80 5.126 9.403 13.180 1.00 34.44 C ATOM 3036 O PHE B 80 5.839 9.538 12.177 1.00 45.44 O ATOM 3037 CB PHE B 80 5.146 7.130 14.372 1.00 55.12 C ATOM 3038 CG PHE B 80 5.602 6.346 13.145 1.00 50.24 C ATOM 3039 CD1 PHE B 80 6.845 5.725 13.120 1.00 61.31 C ATOM 3040 CD2 PHE B 80 4.792 6.242 12.014 1.00 2.04 C ATOM 3041 CE1 PHE B 80 7.264 5.029 12.004 1.00 75.25 C ATOM 3042 CE2 PHE B 80 5.212 5.547 10.904 1.00 0.15 C ATOM 3043 CZ PHE B 80 6.451 4.940 10.898 1.00 73.52 C ATOM 0 H PHE B 80 4.472 8.658 16.169 1.00 12.14 H new ATOM 0 HA PHE B 80 6.709 8.636 14.405 1.00 21.42 H new ATOM 0 HB2 PHE B 80 5.510 6.622 15.265 1.00 55.12 H new ATOM 0 HB3 PHE B 80 4.057 7.109 14.415 1.00 55.12 H new ATOM 0 HD1 PHE B 80 7.491 5.788 13.984 1.00 61.31 H new ATOM 0 HD2 PHE B 80 3.821 6.714 12.010 1.00 2.04 H new ATOM 0 HE1 PHE B 80 8.233 4.553 11.999 1.00 75.25 H new ATOM 0 HE2 PHE B 80 4.572 5.476 10.037 1.00 0.15 H new ATOM 0 HZ PHE B 80 6.782 4.396 10.026 1.00 73.52 H new ATOM 3053 N CYS B 81 3.904 9.934 13.296 1.00 61.22 N ATOM 3054 CA CYS B 81 3.244 10.704 12.238 1.00 74.41 C ATOM 3055 C CYS B 81 3.766 12.166 12.174 1.00 53.42 C ATOM 3056 O CYS B 81 3.434 12.895 11.234 1.00 21.03 O ATOM 3057 CB CYS B 81 1.719 10.663 12.485 1.00 13.44 C ATOM 3058 SG CYS B 81 1.029 8.988 12.553 1.00 13.43 S ATOM 0 H CYS B 81 3.338 9.839 14.140 1.00 61.22 H new ATOM 0 HA CYS B 81 3.475 10.257 11.271 1.00 74.41 H new ATOM 0 HB2 CYS B 81 1.499 11.174 13.422 1.00 13.44 H new ATOM 0 HB3 CYS B 81 1.218 11.220 11.693 1.00 13.44 H new ATOM 0 HG CYS B 81 1.376 8.421 13.670 1.00 13.43 H new ATOM 3064 N LYS B 82 4.586 12.582 13.174 1.00 44.32 N ATOM 3065 CA LYS B 82 5.193 13.935 13.234 1.00 51.43 C ATOM 3066 C LYS B 82 6.418 14.031 12.298 1.00 41.03 C ATOM 3067 O LYS B 82 7.573 14.004 12.745 1.00 14.42 O ATOM 3068 CB LYS B 82 5.596 14.281 14.698 1.00 12.04 C ATOM 3069 CG LYS B 82 4.417 14.420 15.677 1.00 65.55 C ATOM 3070 CD LYS B 82 3.507 15.623 15.362 1.00 4.45 C ATOM 3071 CE LYS B 82 4.241 16.974 15.474 1.00 4.43 C ATOM 3072 NZ LYS B 82 3.351 18.115 15.125 1.00 33.33 N ATOM 0 H LYS B 82 4.844 11.987 13.961 1.00 44.32 H new ATOM 0 HA LYS B 82 4.452 14.659 12.895 1.00 51.43 H new ATOM 0 HB2 LYS B 82 6.267 13.506 15.068 1.00 12.04 H new ATOM 0 HB3 LYS B 82 6.158 15.215 14.694 1.00 12.04 H new ATOM 0 HG2 LYS B 82 3.823 13.507 15.652 1.00 65.55 H new ATOM 0 HG3 LYS B 82 4.805 14.521 16.691 1.00 65.55 H new ATOM 0 HD2 LYS B 82 3.106 15.515 14.354 1.00 4.45 H new ATOM 0 HD3 LYS B 82 2.658 15.619 16.045 1.00 4.45 H new ATOM 0 HE2 LYS B 82 4.615 17.102 16.490 1.00 4.43 H new ATOM 0 HE3 LYS B 82 5.108 16.973 14.813 1.00 4.43 H new ATOM 0 HZ1 LYS B 82 3.879 19.007 15.212 1.00 33.33 H new ATOM 0 HZ2 LYS B 82 3.014 18.006 14.147 1.00 33.33 H new ATOM 0 HZ3 LYS B 82 2.537 18.131 15.772 1.00 33.33 H new ATOM 3086 N VAL B 83 6.138 14.104 10.992 1.00 65.30 N ATOM 3087 CA VAL B 83 7.160 14.166 9.935 1.00 14.15 C ATOM 3088 C VAL B 83 6.684 15.080 8.800 1.00 71.22 C ATOM 3089 O VAL B 83 5.477 15.292 8.628 1.00 70.41 O ATOM 3090 CB VAL B 83 7.500 12.734 9.357 1.00 20.54 C ATOM 3091 CG1 VAL B 83 8.419 11.945 10.309 1.00 34.32 C ATOM 3092 CG2 VAL B 83 6.214 11.933 9.042 1.00 25.12 C ATOM 0 H VAL B 83 5.184 14.122 10.632 1.00 65.30 H new ATOM 0 HA VAL B 83 8.069 14.570 10.381 1.00 14.15 H new ATOM 0 HB VAL B 83 8.039 12.883 8.421 1.00 20.54 H new ATOM 0 HG11 VAL B 83 8.632 10.966 9.880 1.00 34.32 H new ATOM 0 HG12 VAL B 83 9.352 12.491 10.449 1.00 34.32 H new ATOM 0 HG13 VAL B 83 7.924 11.820 11.272 1.00 34.32 H new ATOM 0 HG21 VAL B 83 6.483 10.954 8.646 1.00 25.12 H new ATOM 0 HG22 VAL B 83 5.631 11.808 9.954 1.00 25.12 H new ATOM 0 HG23 VAL B 83 5.621 12.472 8.303 1.00 25.12 H new ATOM 3102 N ASP B 84 7.653 15.591 8.029 1.00 1.34 N ATOM 3103 CA ASP B 84 7.407 16.485 6.878 1.00 11.54 C ATOM 3104 C ASP B 84 6.868 15.660 5.693 1.00 64.31 C ATOM 3105 O ASP B 84 7.085 14.447 5.667 1.00 64.30 O ATOM 3106 CB ASP B 84 8.737 17.208 6.527 1.00 11.34 C ATOM 3107 CG ASP B 84 8.623 18.285 5.434 1.00 24.25 C ATOM 3108 OD1 ASP B 84 9.532 18.389 4.585 1.00 44.33 O ATOM 3109 OD2 ASP B 84 7.624 19.039 5.426 1.00 11.41 O ATOM 0 H ASP B 84 8.642 15.396 8.184 1.00 1.34 H new ATOM 0 HA ASP B 84 6.657 17.238 7.119 1.00 11.54 H new ATOM 0 HB2 ASP B 84 9.131 17.670 7.432 1.00 11.34 H new ATOM 0 HB3 ASP B 84 9.465 16.462 6.207 1.00 11.34 H new ATOM 3114 N GLN B 85 6.181 16.319 4.721 1.00 1.55 N ATOM 3115 CA GLN B 85 5.490 15.628 3.598 1.00 63.00 C ATOM 3116 C GLN B 85 6.406 14.606 2.851 1.00 24.30 C ATOM 3117 O GLN B 85 6.024 13.442 2.800 1.00 33.34 O ATOM 3118 CB GLN B 85 4.825 16.643 2.612 1.00 14.42 C ATOM 3119 CG GLN B 85 3.579 17.373 3.163 1.00 25.15 C ATOM 3120 CD GLN B 85 2.398 16.436 3.427 1.00 65.45 C ATOM 3121 OE1 GLN B 85 2.242 15.887 4.515 1.00 50.21 O ATOM 3122 NE2 GLN B 85 1.565 16.237 2.425 1.00 73.31 N ATOM 0 H GLN B 85 6.091 17.335 4.693 1.00 1.55 H new ATOM 0 HA GLN B 85 4.691 15.041 4.051 1.00 63.00 H new ATOM 0 HB2 GLN B 85 5.567 17.389 2.328 1.00 14.42 H new ATOM 0 HB3 GLN B 85 4.543 16.111 1.703 1.00 14.42 H new ATOM 0 HG2 GLN B 85 3.844 17.882 4.089 1.00 25.15 H new ATOM 0 HG3 GLN B 85 3.273 18.142 2.453 1.00 25.15 H new ATOM 0 HE21 GLN B 85 1.719 16.706 1.533 1.00 73.31 H new ATOM 0 HE22 GLN B 85 0.766 15.614 2.542 1.00 73.31 H new ATOM 3131 N PRO B 86 7.638 14.975 2.312 1.00 40.34 N ATOM 3132 CA PRO B 86 8.554 13.978 1.687 1.00 61.42 C ATOM 3133 C PRO B 86 8.807 12.760 2.594 1.00 12.31 C ATOM 3134 O PRO B 86 8.559 11.633 2.181 1.00 64.25 O ATOM 3135 CB PRO B 86 9.844 14.780 1.395 1.00 1.44 C ATOM 3136 CG PRO B 86 9.358 16.185 1.224 1.00 4.33 C ATOM 3137 CD PRO B 86 8.228 16.345 2.224 1.00 54.31 C ATOM 0 HA PRO B 86 8.130 13.541 0.783 1.00 61.42 H new ATOM 0 HB2 PRO B 86 10.559 14.701 2.214 1.00 1.44 H new ATOM 0 HB3 PRO B 86 10.346 14.418 0.498 1.00 1.44 H new ATOM 0 HG2 PRO B 86 10.156 16.903 1.415 1.00 4.33 H new ATOM 0 HG3 PRO B 86 9.009 16.359 0.206 1.00 4.33 H new ATOM 0 HD2 PRO B 86 8.595 16.686 3.192 1.00 54.31 H new ATOM 0 HD3 PRO B 86 7.494 17.076 1.886 1.00 54.31 H new ATOM 3145 N THR B 87 9.169 13.032 3.863 1.00 34.34 N ATOM 3146 CA THR B 87 9.477 11.998 4.874 1.00 42.23 C ATOM 3147 C THR B 87 8.246 11.086 5.170 1.00 62.23 C ATOM 3148 O THR B 87 8.392 9.885 5.422 1.00 24.02 O ATOM 3149 CB THR B 87 9.965 12.682 6.193 1.00 52.33 C ATOM 3150 OG1 THR B 87 11.003 13.635 5.902 1.00 43.24 O ATOM 3151 CG2 THR B 87 10.493 11.678 7.228 1.00 51.43 C ATOM 0 H THR B 87 9.257 13.984 4.220 1.00 34.34 H new ATOM 0 HA THR B 87 10.266 11.362 4.472 1.00 42.23 H new ATOM 0 HB THR B 87 9.094 13.178 6.623 1.00 52.33 H new ATOM 0 HG1 THR B 87 11.300 14.059 6.734 1.00 43.24 H new ATOM 0 HG21 THR B 87 10.817 12.212 8.121 1.00 51.43 H new ATOM 0 HG22 THR B 87 9.701 10.977 7.492 1.00 51.43 H new ATOM 0 HG23 THR B 87 11.336 11.131 6.807 1.00 51.43 H new ATOM 3159 N LEU B 88 7.044 11.679 5.090 1.00 75.32 N ATOM 3160 CA LEU B 88 5.769 11.010 5.419 1.00 1.54 C ATOM 3161 C LEU B 88 5.413 9.993 4.319 1.00 71.41 C ATOM 3162 O LEU B 88 5.001 8.865 4.606 1.00 21.13 O ATOM 3163 CB LEU B 88 4.654 12.098 5.605 1.00 55.22 C ATOM 3164 CG LEU B 88 3.396 11.709 6.463 1.00 51.23 C ATOM 3165 CD1 LEU B 88 2.608 12.964 6.885 1.00 21.25 C ATOM 3166 CD2 LEU B 88 2.472 10.714 5.734 1.00 43.40 C ATOM 0 H LEU B 88 6.926 12.647 4.792 1.00 75.32 H new ATOM 0 HA LEU B 88 5.859 10.455 6.353 1.00 1.54 H new ATOM 0 HB2 LEU B 88 5.113 12.976 6.060 1.00 55.22 H new ATOM 0 HB3 LEU B 88 4.307 12.397 4.616 1.00 55.22 H new ATOM 0 HG LEU B 88 3.769 11.209 7.357 1.00 51.23 H new ATOM 0 HD11 LEU B 88 1.742 12.668 7.478 1.00 21.25 H new ATOM 0 HD12 LEU B 88 3.250 13.614 7.480 1.00 21.25 H new ATOM 0 HD13 LEU B 88 2.273 13.499 5.996 1.00 21.25 H new ATOM 0 HD21 LEU B 88 1.618 10.478 6.369 1.00 43.40 H new ATOM 0 HD22 LEU B 88 2.120 11.159 4.804 1.00 43.40 H new ATOM 0 HD23 LEU B 88 3.024 9.800 5.513 1.00 43.40 H new ATOM 3178 N PHE B 89 5.578 10.411 3.059 1.00 32.22 N ATOM 3179 CA PHE B 89 5.336 9.551 1.889 1.00 63.22 C ATOM 3180 C PHE B 89 6.463 8.520 1.712 1.00 72.24 C ATOM 3181 O PHE B 89 6.237 7.482 1.109 1.00 13.30 O ATOM 3182 CB PHE B 89 5.088 10.387 0.620 1.00 65.01 C ATOM 3183 CG PHE B 89 3.784 11.207 0.676 1.00 1.14 C ATOM 3184 CD1 PHE B 89 2.571 10.638 0.328 1.00 71.34 C ATOM 3185 CD2 PHE B 89 3.776 12.538 1.080 1.00 12.14 C ATOM 3186 CE1 PHE B 89 1.404 11.367 0.385 1.00 62.31 C ATOM 3187 CE2 PHE B 89 2.617 13.272 1.132 1.00 54.35 C ATOM 3188 CZ PHE B 89 1.427 12.687 0.786 1.00 63.14 C ATOM 0 H PHE B 89 5.883 11.354 2.819 1.00 32.22 H new ATOM 0 HA PHE B 89 4.422 8.984 2.068 1.00 63.22 H new ATOM 0 HB2 PHE B 89 5.929 11.064 0.469 1.00 65.01 H new ATOM 0 HB3 PHE B 89 5.055 9.723 -0.244 1.00 65.01 H new ATOM 0 HD1 PHE B 89 2.539 9.607 0.007 1.00 71.34 H new ATOM 0 HD2 PHE B 89 4.707 13.007 1.361 1.00 12.14 H new ATOM 0 HE1 PHE B 89 0.467 10.903 0.115 1.00 62.31 H new ATOM 0 HE2 PHE B 89 2.643 14.306 1.444 1.00 54.35 H new ATOM 0 HZ PHE B 89 0.511 13.257 0.827 1.00 63.14 H new ATOM 3198 N GLU B 90 7.682 8.836 2.206 1.00 35.51 N ATOM 3199 CA GLU B 90 8.785 7.845 2.314 1.00 13.03 C ATOM 3200 C GLU B 90 8.376 6.661 3.223 1.00 44.43 C ATOM 3201 O GLU B 90 8.792 5.530 2.989 1.00 33.13 O ATOM 3202 CB GLU B 90 10.090 8.480 2.862 1.00 21.14 C ATOM 3203 CG GLU B 90 10.775 9.491 1.926 1.00 32.40 C ATOM 3204 CD GLU B 90 11.216 8.892 0.581 1.00 13.44 C ATOM 3205 OE1 GLU B 90 12.175 8.088 0.573 1.00 40.43 O ATOM 3206 OE2 GLU B 90 10.629 9.241 -0.468 1.00 75.50 O ATOM 0 H GLU B 90 7.930 9.768 2.537 1.00 35.51 H new ATOM 0 HA GLU B 90 8.977 7.483 1.304 1.00 13.03 H new ATOM 0 HB2 GLU B 90 9.864 8.979 3.804 1.00 21.14 H new ATOM 0 HB3 GLU B 90 10.797 7.681 3.086 1.00 21.14 H new ATOM 0 HG2 GLU B 90 10.091 10.319 1.738 1.00 32.40 H new ATOM 0 HG3 GLU B 90 11.647 9.907 2.431 1.00 32.40 H new ATOM 3213 N LEU B 91 7.575 6.959 4.270 1.00 4.31 N ATOM 3214 CA LEU B 91 7.002 5.934 5.175 1.00 50.31 C ATOM 3215 C LEU B 91 5.947 5.060 4.446 1.00 12.25 C ATOM 3216 O LEU B 91 5.827 3.875 4.735 1.00 3.24 O ATOM 3217 CB LEU B 91 6.371 6.603 6.434 1.00 14.30 C ATOM 3218 CG LEU B 91 7.344 7.390 7.372 1.00 41.14 C ATOM 3219 CD1 LEU B 91 6.568 8.105 8.506 1.00 24.01 C ATOM 3220 CD2 LEU B 91 8.436 6.456 7.934 1.00 4.15 C ATOM 0 H LEU B 91 7.307 7.913 4.512 1.00 4.31 H new ATOM 0 HA LEU B 91 7.817 5.284 5.493 1.00 50.31 H new ATOM 0 HB2 LEU B 91 5.591 7.288 6.101 1.00 14.30 H new ATOM 0 HB3 LEU B 91 5.883 5.827 7.024 1.00 14.30 H new ATOM 0 HG LEU B 91 7.839 8.160 6.781 1.00 41.14 H new ATOM 0 HD11 LEU B 91 7.269 8.644 9.143 1.00 24.01 H new ATOM 0 HD12 LEU B 91 5.857 8.808 8.073 1.00 24.01 H new ATOM 0 HD13 LEU B 91 6.031 7.366 9.101 1.00 24.01 H new ATOM 0 HD21 LEU B 91 9.102 7.024 8.584 1.00 4.15 H new ATOM 0 HD22 LEU B 91 7.970 5.653 8.505 1.00 4.15 H new ATOM 0 HD23 LEU B 91 9.009 6.030 7.111 1.00 4.15 H new ATOM 3232 N ILE B 92 5.191 5.676 3.506 1.00 42.12 N ATOM 3233 CA ILE B 92 4.200 4.968 2.652 1.00 40.21 C ATOM 3234 C ILE B 92 4.930 4.066 1.626 1.00 24.55 C ATOM 3235 O ILE B 92 4.545 2.911 1.406 1.00 64.15 O ATOM 3236 CB ILE B 92 3.249 5.989 1.898 1.00 32.31 C ATOM 3237 CG1 ILE B 92 2.491 6.885 2.929 1.00 75.05 C ATOM 3238 CG2 ILE B 92 2.258 5.262 0.952 1.00 14.34 C ATOM 3239 CD1 ILE B 92 1.507 7.886 2.339 1.00 14.43 C ATOM 0 H ILE B 92 5.249 6.677 3.317 1.00 42.12 H new ATOM 0 HA ILE B 92 3.581 4.349 3.301 1.00 40.21 H new ATOM 0 HB ILE B 92 3.872 6.629 1.274 1.00 32.31 H new ATOM 0 HG12 ILE B 92 1.951 6.236 3.618 1.00 75.05 H new ATOM 0 HG13 ILE B 92 3.228 7.432 3.518 1.00 75.05 H new ATOM 0 HG21 ILE B 92 1.625 5.996 0.455 1.00 14.34 H new ATOM 0 HG22 ILE B 92 2.816 4.698 0.204 1.00 14.34 H new ATOM 0 HG23 ILE B 92 1.636 4.580 1.531 1.00 14.34 H new ATOM 0 HD11 ILE B 92 1.039 8.453 3.143 1.00 14.43 H new ATOM 0 HD12 ILE B 92 2.037 8.568 1.674 1.00 14.43 H new ATOM 0 HD13 ILE B 92 0.740 7.354 1.776 1.00 14.43 H new ATOM 3251 N LEU B 93 6.013 4.617 1.041 1.00 53.20 N ATOM 3252 CA LEU B 93 6.873 3.914 0.070 1.00 41.22 C ATOM 3253 C LEU B 93 7.595 2.733 0.746 1.00 21.54 C ATOM 3254 O LEU B 93 7.775 1.683 0.133 1.00 75.11 O ATOM 3255 CB LEU B 93 7.910 4.902 -0.553 1.00 32.33 C ATOM 3256 CG LEU B 93 7.348 5.981 -1.536 1.00 24.04 C ATOM 3257 CD1 LEU B 93 8.449 6.985 -1.950 1.00 1.22 C ATOM 3258 CD2 LEU B 93 6.707 5.319 -2.772 1.00 14.44 C ATOM 0 H LEU B 93 6.317 5.572 1.232 1.00 53.20 H new ATOM 0 HA LEU B 93 6.244 3.522 -0.729 1.00 41.22 H new ATOM 0 HB2 LEU B 93 8.422 5.416 0.261 1.00 32.33 H new ATOM 0 HB3 LEU B 93 8.662 4.317 -1.083 1.00 32.33 H new ATOM 0 HG LEU B 93 6.571 6.538 -1.013 1.00 24.04 H new ATOM 0 HD11 LEU B 93 8.030 7.723 -2.633 1.00 1.22 H new ATOM 0 HD12 LEU B 93 8.834 7.489 -1.063 1.00 1.22 H new ATOM 0 HD13 LEU B 93 9.260 6.452 -2.445 1.00 1.22 H new ATOM 0 HD21 LEU B 93 6.324 6.090 -3.440 1.00 14.44 H new ATOM 0 HD22 LEU B 93 7.456 4.724 -3.296 1.00 14.44 H new ATOM 0 HD23 LEU B 93 5.888 4.674 -2.455 1.00 14.44 H new ATOM 3270 N ALA B 94 7.986 2.931 2.021 1.00 71.12 N ATOM 3271 CA ALA B 94 8.645 1.899 2.840 1.00 63.22 C ATOM 3272 C ALA B 94 7.630 0.857 3.326 1.00 43.14 C ATOM 3273 O ALA B 94 7.963 -0.309 3.456 1.00 71.05 O ATOM 3274 CB ALA B 94 9.377 2.539 4.026 1.00 13.25 C ATOM 0 H ALA B 94 7.852 3.815 2.512 1.00 71.12 H new ATOM 0 HA ALA B 94 9.380 1.389 2.218 1.00 63.22 H new ATOM 0 HB1 ALA B 94 9.858 1.761 4.620 1.00 13.25 H new ATOM 0 HB2 ALA B 94 10.132 3.232 3.656 1.00 13.25 H new ATOM 0 HB3 ALA B 94 8.662 3.079 4.646 1.00 13.25 H new ATOM 3280 N ALA B 95 6.384 1.298 3.586 1.00 20.21 N ATOM 3281 CA ALA B 95 5.288 0.399 4.006 1.00 5.44 C ATOM 3282 C ALA B 95 4.858 -0.526 2.851 1.00 63.52 C ATOM 3283 O ALA B 95 4.415 -1.648 3.083 1.00 31.31 O ATOM 3284 CB ALA B 95 4.088 1.206 4.511 1.00 15.42 C ATOM 0 H ALA B 95 6.109 2.277 3.512 1.00 20.21 H new ATOM 0 HA ALA B 95 5.660 -0.221 4.822 1.00 5.44 H new ATOM 0 HB1 ALA B 95 3.293 0.525 4.815 1.00 15.42 H new ATOM 0 HB2 ALA B 95 4.391 1.813 5.364 1.00 15.42 H new ATOM 0 HB3 ALA B 95 3.725 1.855 3.714 1.00 15.42 H new ATOM 3290 N ASN B 96 4.973 -0.007 1.612 1.00 34.53 N ATOM 3291 CA ASN B 96 4.680 -0.767 0.376 1.00 42.52 C ATOM 3292 C ASN B 96 5.872 -1.682 0.014 1.00 42.13 C ATOM 3293 O ASN B 96 5.677 -2.842 -0.335 1.00 4.31 O ATOM 3294 CB ASN B 96 4.339 0.214 -0.790 1.00 45.21 C ATOM 3295 CG ASN B 96 3.958 -0.479 -2.118 1.00 63.41 C ATOM 3296 OD1 ASN B 96 3.480 -1.619 -2.138 1.00 12.15 O ATOM 3297 ND2 ASN B 96 4.120 0.220 -3.230 1.00 22.31 N ATOM 0 H ASN B 96 5.272 0.953 1.438 1.00 34.53 H new ATOM 0 HA ASN B 96 3.811 -1.403 0.545 1.00 42.52 H new ATOM 0 HB2 ASN B 96 3.514 0.855 -0.479 1.00 45.21 H new ATOM 0 HB3 ASN B 96 5.198 0.862 -0.966 1.00 45.21 H new ATOM 0 HD21 ASN B 96 3.848 -0.180 -4.128 1.00 22.31 H new ATOM 0 HD22 ASN B 96 4.517 1.159 -3.189 1.00 22.31 H new ATOM 3304 N TYR B 97 7.103 -1.148 0.143 1.00 22.24 N ATOM 3305 CA TYR B 97 8.357 -1.887 -0.172 1.00 11.34 C ATOM 3306 C TYR B 97 8.580 -3.053 0.811 1.00 63.43 C ATOM 3307 O TYR B 97 9.059 -4.122 0.420 1.00 4.04 O ATOM 3308 CB TYR B 97 9.581 -0.919 -0.149 1.00 44.35 C ATOM 3309 CG TYR B 97 10.960 -1.598 -0.329 1.00 10.24 C ATOM 3310 CD1 TYR B 97 11.906 -1.623 0.705 1.00 34.35 C ATOM 3311 CD2 TYR B 97 11.304 -2.229 -1.530 1.00 33.54 C ATOM 3312 CE1 TYR B 97 13.132 -2.247 0.548 1.00 3.44 C ATOM 3313 CE2 TYR B 97 12.532 -2.850 -1.689 1.00 32.42 C ATOM 3314 CZ TYR B 97 13.441 -2.857 -0.649 1.00 41.42 C ATOM 3315 OH TYR B 97 14.662 -3.481 -0.806 1.00 3.13 O ATOM 0 H TYR B 97 7.263 -0.194 0.467 1.00 22.24 H new ATOM 0 HA TYR B 97 8.256 -2.304 -1.174 1.00 11.34 H new ATOM 0 HB2 TYR B 97 9.453 -0.178 -0.938 1.00 44.35 H new ATOM 0 HB3 TYR B 97 9.580 -0.380 0.798 1.00 44.35 H new ATOM 0 HD1 TYR B 97 11.673 -1.145 1.645 1.00 34.35 H new ATOM 0 HD2 TYR B 97 10.599 -2.232 -2.348 1.00 33.54 H new ATOM 0 HE1 TYR B 97 13.844 -2.256 1.360 1.00 3.44 H new ATOM 0 HE2 TYR B 97 12.778 -3.328 -2.625 1.00 32.42 H new ATOM 0 HH TYR B 97 14.721 -3.862 -1.707 1.00 3.13 H new ATOM 3325 N LEU B 98 8.236 -2.827 2.084 1.00 40.32 N ATOM 3326 CA LEU B 98 8.365 -3.841 3.151 1.00 73.42 C ATOM 3327 C LEU B 98 7.054 -4.628 3.326 1.00 23.52 C ATOM 3328 O LEU B 98 6.994 -5.572 4.127 1.00 14.33 O ATOM 3329 CB LEU B 98 8.808 -3.162 4.476 1.00 62.21 C ATOM 3330 CG LEU B 98 10.155 -2.372 4.414 1.00 34.42 C ATOM 3331 CD1 LEU B 98 10.551 -1.795 5.794 1.00 41.20 C ATOM 3332 CD2 LEU B 98 11.273 -3.242 3.813 1.00 64.15 C ATOM 0 H LEU B 98 7.859 -1.937 2.410 1.00 40.32 H new ATOM 0 HA LEU B 98 9.133 -4.560 2.864 1.00 73.42 H new ATOM 0 HB2 LEU B 98 8.021 -2.478 4.793 1.00 62.21 H new ATOM 0 HB3 LEU B 98 8.893 -3.929 5.246 1.00 62.21 H new ATOM 0 HG LEU B 98 10.008 -1.518 3.752 1.00 34.42 H new ATOM 0 HD11 LEU B 98 11.493 -1.254 5.705 1.00 41.20 H new ATOM 0 HD12 LEU B 98 9.773 -1.115 6.141 1.00 41.20 H new ATOM 0 HD13 LEU B 98 10.666 -2.609 6.509 1.00 41.20 H new ATOM 0 HD21 LEU B 98 12.201 -2.671 3.780 1.00 64.15 H new ATOM 0 HD22 LEU B 98 11.415 -4.129 4.430 1.00 64.15 H new ATOM 0 HD23 LEU B 98 10.996 -3.543 2.803 1.00 64.15 H new ATOM 3344 N ASP B 99 6.017 -4.212 2.559 1.00 51.30 N ATOM 3345 CA ASP B 99 4.704 -4.889 2.455 1.00 62.13 C ATOM 3346 C ASP B 99 3.981 -4.951 3.825 1.00 54.42 C ATOM 3347 O ASP B 99 3.127 -5.810 4.068 1.00 21.40 O ATOM 3348 CB ASP B 99 4.876 -6.294 1.789 1.00 55.10 C ATOM 3349 CG ASP B 99 3.566 -6.876 1.212 1.00 61.13 C ATOM 3350 OD1 ASP B 99 3.091 -6.362 0.179 1.00 61.44 O ATOM 3351 OD2 ASP B 99 3.019 -7.847 1.762 1.00 55.14 O ATOM 0 H ASP B 99 6.074 -3.374 1.981 1.00 51.30 H new ATOM 0 HA ASP B 99 4.054 -4.300 1.808 1.00 62.13 H new ATOM 0 HB2 ASP B 99 5.612 -6.219 0.989 1.00 55.10 H new ATOM 0 HB3 ASP B 99 5.277 -6.989 2.527 1.00 55.10 H new ATOM 3356 N ILE B 100 4.309 -3.987 4.709 1.00 32.24 N ATOM 3357 CA ILE B 100 3.697 -3.880 6.041 1.00 43.54 C ATOM 3358 C ILE B 100 2.340 -3.173 5.898 1.00 43.32 C ATOM 3359 O ILE B 100 2.261 -1.941 5.929 1.00 63.34 O ATOM 3360 CB ILE B 100 4.608 -3.110 7.075 1.00 55.14 C ATOM 3361 CG1 ILE B 100 6.076 -3.600 6.977 1.00 23.11 C ATOM 3362 CG2 ILE B 100 4.065 -3.282 8.522 1.00 15.54 C ATOM 3363 CD1 ILE B 100 7.049 -2.923 7.926 1.00 41.31 C ATOM 0 H ILE B 100 5.003 -3.265 4.517 1.00 32.24 H new ATOM 0 HA ILE B 100 3.570 -4.887 6.437 1.00 43.54 H new ATOM 0 HB ILE B 100 4.584 -2.048 6.829 1.00 55.14 H new ATOM 0 HG12 ILE B 100 6.097 -4.673 7.165 1.00 23.11 H new ATOM 0 HG13 ILE B 100 6.425 -3.449 5.956 1.00 23.11 H new ATOM 0 HG21 ILE B 100 4.708 -2.743 9.218 1.00 15.54 H new ATOM 0 HG22 ILE B 100 3.052 -2.883 8.580 1.00 15.54 H new ATOM 0 HG23 ILE B 100 4.054 -4.340 8.783 1.00 15.54 H new ATOM 0 HD11 ILE B 100 8.047 -3.336 7.779 1.00 41.31 H new ATOM 0 HD12 ILE B 100 7.066 -1.852 7.726 1.00 41.31 H new ATOM 0 HD13 ILE B 100 6.733 -3.095 8.955 1.00 41.31 H new ATOM 3375 N LYS B 101 1.296 -3.984 5.674 1.00 73.15 N ATOM 3376 CA LYS B 101 -0.096 -3.522 5.521 1.00 22.23 C ATOM 3377 C LYS B 101 -0.632 -2.736 6.762 1.00 3.04 C ATOM 3378 O LYS B 101 -1.294 -1.713 6.559 1.00 10.14 O ATOM 3379 CB LYS B 101 -1.019 -4.722 5.175 1.00 14.22 C ATOM 3380 CG LYS B 101 -2.448 -4.331 4.730 1.00 3.41 C ATOM 3381 CD LYS B 101 -3.340 -5.559 4.433 1.00 60.11 C ATOM 3382 CE LYS B 101 -4.714 -5.170 3.867 1.00 62.32 C ATOM 3383 NZ LYS B 101 -4.611 -4.495 2.542 1.00 21.31 N ATOM 0 H LYS B 101 1.394 -4.996 5.592 1.00 73.15 H new ATOM 0 HA LYS B 101 -0.104 -2.809 4.697 1.00 22.23 H new ATOM 0 HB2 LYS B 101 -0.552 -5.305 4.381 1.00 14.22 H new ATOM 0 HB3 LYS B 101 -1.090 -5.372 6.047 1.00 14.22 H new ATOM 0 HG2 LYS B 101 -2.914 -3.729 5.510 1.00 3.41 H new ATOM 0 HG3 LYS B 101 -2.388 -3.707 3.838 1.00 3.41 H new ATOM 0 HD2 LYS B 101 -2.830 -6.210 3.723 1.00 60.11 H new ATOM 0 HD3 LYS B 101 -3.478 -6.133 5.349 1.00 60.11 H new ATOM 0 HE2 LYS B 101 -5.330 -6.064 3.770 1.00 62.32 H new ATOM 0 HE3 LYS B 101 -5.220 -4.509 4.570 1.00 62.32 H new ATOM 0 HZ1 LYS B 101 -5.557 -4.420 2.116 1.00 21.31 H new ATOM 0 HZ2 LYS B 101 -4.211 -3.543 2.667 1.00 21.31 H new ATOM 0 HZ3 LYS B 101 -3.993 -5.051 1.916 1.00 21.31 H new ATOM 3397 N PRO B 102 -0.378 -3.162 8.060 1.00 44.31 N ATOM 3398 CA PRO B 102 -0.810 -2.357 9.243 1.00 24.33 C ATOM 3399 C PRO B 102 -0.190 -0.936 9.264 1.00 15.24 C ATOM 3400 O PRO B 102 -0.888 0.031 9.579 1.00 22.35 O ATOM 3401 CB PRO B 102 -0.355 -3.201 10.463 1.00 44.21 C ATOM 3402 CG PRO B 102 0.680 -4.148 9.921 1.00 45.01 C ATOM 3403 CD PRO B 102 0.259 -4.446 8.503 1.00 53.41 C ATOM 0 HA PRO B 102 -1.885 -2.175 9.234 1.00 24.33 H new ATOM 0 HB2 PRO B 102 0.062 -2.568 11.247 1.00 44.21 H new ATOM 0 HB3 PRO B 102 -1.193 -3.742 10.902 1.00 44.21 H new ATOM 0 HG2 PRO B 102 1.673 -3.700 9.948 1.00 45.01 H new ATOM 0 HG3 PRO B 102 0.725 -5.060 10.516 1.00 45.01 H new ATOM 0 HD2 PRO B 102 1.111 -4.710 7.877 1.00 53.41 H new ATOM 0 HD3 PRO B 102 -0.441 -5.280 8.457 1.00 53.41 H new ATOM 3411 N LEU B 103 1.113 -0.830 8.907 1.00 75.33 N ATOM 3412 CA LEU B 103 1.835 0.461 8.857 1.00 61.25 C ATOM 3413 C LEU B 103 1.255 1.354 7.749 1.00 12.43 C ATOM 3414 O LEU B 103 1.028 2.552 7.962 1.00 62.22 O ATOM 3415 CB LEU B 103 3.348 0.230 8.598 1.00 15.13 C ATOM 3416 CG LEU B 103 4.229 1.514 8.456 1.00 62.33 C ATOM 3417 CD1 LEU B 103 4.166 2.374 9.728 1.00 20.34 C ATOM 3418 CD2 LEU B 103 5.681 1.165 8.071 1.00 11.35 C ATOM 0 H LEU B 103 1.688 -1.632 8.648 1.00 75.33 H new ATOM 0 HA LEU B 103 1.712 0.957 9.820 1.00 61.25 H new ATOM 0 HB2 LEU B 103 3.747 -0.371 9.415 1.00 15.13 H new ATOM 0 HB3 LEU B 103 3.453 -0.360 7.688 1.00 15.13 H new ATOM 0 HG LEU B 103 3.818 2.109 7.640 1.00 62.33 H new ATOM 0 HD11 LEU B 103 4.788 3.260 9.600 1.00 20.34 H new ATOM 0 HD12 LEU B 103 3.135 2.678 9.911 1.00 20.34 H new ATOM 0 HD13 LEU B 103 4.530 1.795 10.577 1.00 20.34 H new ATOM 0 HD21 LEU B 103 6.264 2.082 7.981 1.00 11.35 H new ATOM 0 HD22 LEU B 103 6.119 0.530 8.841 1.00 11.35 H new ATOM 0 HD23 LEU B 103 5.688 0.636 7.118 1.00 11.35 H new ATOM 3430 N LEU B 104 1.018 0.731 6.578 1.00 54.13 N ATOM 3431 CA LEU B 104 0.412 1.379 5.403 1.00 15.44 C ATOM 3432 C LEU B 104 -0.928 2.020 5.783 1.00 20.33 C ATOM 3433 O LEU B 104 -1.171 3.182 5.479 1.00 22.53 O ATOM 3434 CB LEU B 104 0.197 0.334 4.271 1.00 2.32 C ATOM 3435 CG LEU B 104 -0.428 0.856 2.935 1.00 61.03 C ATOM 3436 CD1 LEU B 104 0.518 1.846 2.213 1.00 22.52 C ATOM 3437 CD2 LEU B 104 -0.835 -0.325 2.026 1.00 2.03 C ATOM 0 H LEU B 104 1.246 -0.251 6.422 1.00 54.13 H new ATOM 0 HA LEU B 104 1.086 2.158 5.046 1.00 15.44 H new ATOM 0 HB2 LEU B 104 1.161 -0.119 4.040 1.00 2.32 H new ATOM 0 HB3 LEU B 104 -0.443 -0.459 4.658 1.00 2.32 H new ATOM 0 HG LEU B 104 -1.334 1.412 3.179 1.00 61.03 H new ATOM 0 HD11 LEU B 104 0.051 2.188 1.289 1.00 22.52 H new ATOM 0 HD12 LEU B 104 0.712 2.702 2.860 1.00 22.52 H new ATOM 0 HD13 LEU B 104 1.459 1.347 1.981 1.00 22.52 H new ATOM 0 HD21 LEU B 104 -1.267 0.059 1.102 1.00 2.03 H new ATOM 0 HD22 LEU B 104 0.045 -0.925 1.793 1.00 2.03 H new ATOM 0 HD23 LEU B 104 -1.570 -0.944 2.541 1.00 2.03 H new ATOM 3449 N ASP B 105 -1.740 1.243 6.524 1.00 44.33 N ATOM 3450 CA ASP B 105 -3.091 1.638 6.949 1.00 35.12 C ATOM 3451 C ASP B 105 -3.047 2.849 7.902 1.00 34.34 C ATOM 3452 O ASP B 105 -3.779 3.812 7.696 1.00 42.21 O ATOM 3453 CB ASP B 105 -3.812 0.440 7.623 1.00 61.24 C ATOM 3454 CG ASP B 105 -5.263 0.771 8.033 1.00 20.31 C ATOM 3455 OD1 ASP B 105 -5.527 1.035 9.229 1.00 63.54 O ATOM 3456 OD2 ASP B 105 -6.147 0.788 7.151 1.00 60.21 O ATOM 0 H ASP B 105 -1.471 0.314 6.847 1.00 44.33 H new ATOM 0 HA ASP B 105 -3.652 1.934 6.062 1.00 35.12 H new ATOM 0 HB2 ASP B 105 -3.817 -0.408 6.938 1.00 61.24 H new ATOM 0 HB3 ASP B 105 -3.251 0.133 8.506 1.00 61.24 H new ATOM 3461 N VAL B 106 -2.158 2.788 8.920 1.00 30.13 N ATOM 3462 CA VAL B 106 -1.983 3.878 9.912 1.00 24.13 C ATOM 3463 C VAL B 106 -1.611 5.201 9.211 1.00 61.10 C ATOM 3464 O VAL B 106 -2.245 6.233 9.440 1.00 52.20 O ATOM 3465 CB VAL B 106 -0.886 3.507 10.992 1.00 55.20 C ATOM 3466 CG1 VAL B 106 -0.573 4.689 11.952 1.00 51.21 C ATOM 3467 CG2 VAL B 106 -1.306 2.255 11.796 1.00 34.33 C ATOM 0 H VAL B 106 -1.545 1.988 9.078 1.00 30.13 H new ATOM 0 HA VAL B 106 -2.935 4.008 10.426 1.00 24.13 H new ATOM 0 HB VAL B 106 0.030 3.285 10.445 1.00 55.20 H new ATOM 0 HG11 VAL B 106 0.185 4.382 12.672 1.00 51.21 H new ATOM 0 HG12 VAL B 106 -0.203 5.537 11.376 1.00 51.21 H new ATOM 0 HG13 VAL B 106 -1.481 4.978 12.482 1.00 51.21 H new ATOM 0 HG21 VAL B 106 -0.537 2.020 12.531 1.00 34.33 H new ATOM 0 HG22 VAL B 106 -2.249 2.450 12.307 1.00 34.33 H new ATOM 0 HG23 VAL B 106 -1.429 1.411 11.117 1.00 34.33 H new ATOM 3477 N THR B 107 -0.610 5.130 8.318 1.00 15.11 N ATOM 3478 CA THR B 107 -0.090 6.301 7.590 1.00 4.44 C ATOM 3479 C THR B 107 -1.110 6.832 6.537 1.00 71.33 C ATOM 3480 O THR B 107 -1.177 8.047 6.279 1.00 12.41 O ATOM 3481 CB THR B 107 1.282 5.942 6.924 1.00 4.23 C ATOM 3482 OG1 THR B 107 2.111 5.256 7.884 1.00 45.04 O ATOM 3483 CG2 THR B 107 2.049 7.179 6.435 1.00 64.44 C ATOM 0 H THR B 107 -0.137 4.258 8.080 1.00 15.11 H new ATOM 0 HA THR B 107 0.065 7.108 8.306 1.00 4.44 H new ATOM 0 HB THR B 107 1.060 5.316 6.060 1.00 4.23 H new ATOM 0 HG1 THR B 107 1.840 4.316 7.937 1.00 45.04 H new ATOM 0 HG21 THR B 107 2.991 6.868 5.983 1.00 64.44 H new ATOM 0 HG22 THR B 107 1.450 7.710 5.696 1.00 64.44 H new ATOM 0 HG23 THR B 107 2.252 7.838 7.279 1.00 64.44 H new ATOM 3491 N CYS B 108 -1.932 5.916 5.970 1.00 52.11 N ATOM 3492 CA CYS B 108 -3.011 6.263 5.010 1.00 3.35 C ATOM 3493 C CYS B 108 -4.194 6.950 5.725 1.00 74.54 C ATOM 3494 O CYS B 108 -4.918 7.743 5.116 1.00 1.01 O ATOM 3495 CB CYS B 108 -3.502 5.015 4.239 1.00 71.33 C ATOM 3496 SG CYS B 108 -2.279 4.327 3.092 1.00 51.41 S ATOM 0 H CYS B 108 -1.867 4.917 6.164 1.00 52.11 H new ATOM 0 HA CYS B 108 -2.590 6.965 4.290 1.00 3.35 H new ATOM 0 HB2 CYS B 108 -3.785 4.245 4.957 1.00 71.33 H new ATOM 0 HB3 CYS B 108 -4.401 5.276 3.681 1.00 71.33 H new ATOM 0 HG CYS B 108 -1.451 3.567 3.745 1.00 51.41 H new ATOM 3502 N LYS B 109 -4.401 6.609 7.008 1.00 23.35 N ATOM 3503 CA LYS B 109 -5.408 7.269 7.861 1.00 32.35 C ATOM 3504 C LYS B 109 -4.911 8.670 8.262 1.00 24.05 C ATOM 3505 O LYS B 109 -5.687 9.623 8.246 1.00 10.34 O ATOM 3506 CB LYS B 109 -5.749 6.383 9.112 1.00 31.34 C ATOM 3507 CG LYS B 109 -6.962 5.427 8.934 1.00 12.30 C ATOM 3508 CD LYS B 109 -6.892 4.560 7.654 1.00 1.54 C ATOM 3509 CE LYS B 109 -8.065 3.578 7.540 1.00 54.05 C ATOM 3510 NZ LYS B 109 -8.067 2.578 8.639 1.00 51.24 N ATOM 0 H LYS B 109 -3.879 5.872 7.483 1.00 23.35 H new ATOM 0 HA LYS B 109 -6.334 7.388 7.298 1.00 32.35 H new ATOM 0 HB2 LYS B 109 -4.872 5.788 9.366 1.00 31.34 H new ATOM 0 HB3 LYS B 109 -5.945 7.039 9.960 1.00 31.34 H new ATOM 0 HG2 LYS B 109 -7.026 4.771 9.802 1.00 12.30 H new ATOM 0 HG3 LYS B 109 -7.878 6.018 8.912 1.00 12.30 H new ATOM 0 HD2 LYS B 109 -6.882 5.211 6.779 1.00 1.54 H new ATOM 0 HD3 LYS B 109 -5.955 4.003 7.648 1.00 1.54 H new ATOM 0 HE2 LYS B 109 -9.003 4.132 7.553 1.00 54.05 H new ATOM 0 HE3 LYS B 109 -8.013 3.062 6.581 1.00 54.05 H new ATOM 0 HZ1 LYS B 109 -8.551 1.714 8.321 1.00 51.24 H new ATOM 0 HZ2 LYS B 109 -7.087 2.349 8.902 1.00 51.24 H new ATOM 0 HZ3 LYS B 109 -8.564 2.970 9.464 1.00 51.24 H new ATOM 3524 N THR B 110 -3.602 8.783 8.571 1.00 2.21 N ATOM 3525 CA THR B 110 -2.966 10.055 8.966 1.00 33.43 C ATOM 3526 C THR B 110 -3.114 11.134 7.861 1.00 42.14 C ATOM 3527 O THR B 110 -3.560 12.254 8.146 1.00 20.24 O ATOM 3528 CB THR B 110 -1.456 9.840 9.305 1.00 54.24 C ATOM 3529 OG1 THR B 110 -1.331 8.876 10.360 1.00 71.51 O ATOM 3530 CG2 THR B 110 -0.753 11.150 9.719 1.00 72.52 C ATOM 0 H THR B 110 -2.957 7.993 8.553 1.00 2.21 H new ATOM 0 HA THR B 110 -3.481 10.411 9.858 1.00 33.43 H new ATOM 0 HB THR B 110 -0.968 9.478 8.400 1.00 54.24 H new ATOM 0 HG1 THR B 110 -0.549 9.093 10.910 1.00 71.51 H new ATOM 0 HG21 THR B 110 0.294 10.946 9.944 1.00 72.52 H new ATOM 0 HG22 THR B 110 -0.815 11.870 8.903 1.00 72.52 H new ATOM 0 HG23 THR B 110 -1.241 11.561 10.603 1.00 72.52 H new ATOM 3538 N VAL B 111 -2.771 10.772 6.600 1.00 42.32 N ATOM 3539 CA VAL B 111 -2.906 11.691 5.447 1.00 32.00 C ATOM 3540 C VAL B 111 -4.384 12.063 5.206 1.00 41.22 C ATOM 3541 O VAL B 111 -4.687 13.222 4.919 1.00 74.21 O ATOM 3542 CB VAL B 111 -2.252 11.118 4.122 1.00 72.42 C ATOM 3543 CG1 VAL B 111 -0.722 10.981 4.260 1.00 40.14 C ATOM 3544 CG2 VAL B 111 -2.875 9.772 3.709 1.00 0.35 C ATOM 0 H VAL B 111 -2.400 9.853 6.358 1.00 42.32 H new ATOM 0 HA VAL B 111 -2.353 12.594 5.707 1.00 32.00 H new ATOM 0 HB VAL B 111 -2.462 11.840 3.333 1.00 72.42 H new ATOM 0 HG11 VAL B 111 -0.307 10.585 3.333 1.00 40.14 H new ATOM 0 HG12 VAL B 111 -0.286 11.959 4.464 1.00 40.14 H new ATOM 0 HG13 VAL B 111 -0.490 10.302 5.080 1.00 40.14 H new ATOM 0 HG21 VAL B 111 -2.398 9.415 2.796 1.00 0.35 H new ATOM 0 HG22 VAL B 111 -2.726 9.043 4.505 1.00 0.35 H new ATOM 0 HG23 VAL B 111 -3.942 9.904 3.533 1.00 0.35 H new ATOM 3554 N ALA B 112 -5.288 11.078 5.398 1.00 40.44 N ATOM 3555 CA ALA B 112 -6.744 11.264 5.239 1.00 45.23 C ATOM 3556 C ALA B 112 -7.309 12.219 6.309 1.00 53.45 C ATOM 3557 O ALA B 112 -8.305 12.904 6.070 1.00 24.31 O ATOM 3558 CB ALA B 112 -7.457 9.907 5.284 1.00 23.13 C ATOM 0 H ALA B 112 -5.026 10.130 5.668 1.00 40.44 H new ATOM 0 HA ALA B 112 -6.925 11.722 4.267 1.00 45.23 H new ATOM 0 HB1 ALA B 112 -8.530 10.056 5.166 1.00 23.13 H new ATOM 0 HB2 ALA B 112 -7.087 9.275 4.477 1.00 23.13 H new ATOM 0 HB3 ALA B 112 -7.261 9.425 6.242 1.00 23.13 H new ATOM 3564 N ASN B 113 -6.647 12.242 7.484 1.00 21.51 N ATOM 3565 CA ASN B 113 -7.003 13.128 8.618 1.00 55.32 C ATOM 3566 C ASN B 113 -6.477 14.568 8.406 1.00 1.03 C ATOM 3567 O ASN B 113 -7.129 15.530 8.822 1.00 70.35 O ATOM 3568 CB ASN B 113 -6.468 12.558 9.967 1.00 33.11 C ATOM 3569 CG ASN B 113 -7.142 11.248 10.400 1.00 64.12 C ATOM 3570 OD1 ASN B 113 -8.318 11.015 10.124 1.00 53.43 O ATOM 3571 ND2 ASN B 113 -6.404 10.382 11.085 1.00 53.41 N ATOM 0 H ASN B 113 -5.844 11.643 7.677 1.00 21.51 H new ATOM 0 HA ASN B 113 -8.091 13.167 8.661 1.00 55.32 H new ATOM 0 HB2 ASN B 113 -5.394 12.391 9.879 1.00 33.11 H new ATOM 0 HB3 ASN B 113 -6.612 13.305 10.748 1.00 33.11 H new ATOM 0 HD21 ASN B 113 -6.810 9.499 11.395 1.00 53.41 H new ATOM 0 HD22 ASN B 113 -5.431 10.600 11.301 1.00 53.41 H new ATOM 3578 N MET B 114 -5.297 14.711 7.763 1.00 13.02 N ATOM 3579 CA MET B 114 -4.692 16.043 7.489 1.00 51.12 C ATOM 3580 C MET B 114 -5.498 16.793 6.408 1.00 31.01 C ATOM 3581 O MET B 114 -5.699 18.011 6.491 1.00 65.42 O ATOM 3582 CB MET B 114 -3.207 15.912 7.041 1.00 60.31 C ATOM 3583 CG MET B 114 -2.262 15.263 8.066 1.00 44.42 C ATOM 3584 SD MET B 114 -0.519 15.367 7.579 1.00 74.00 S ATOM 3585 CE MET B 114 -0.531 14.659 5.925 1.00 21.35 C ATOM 0 H MET B 114 -4.742 13.925 7.423 1.00 13.02 H new ATOM 0 HA MET B 114 -4.721 16.612 8.418 1.00 51.12 H new ATOM 0 HB2 MET B 114 -3.173 15.328 6.121 1.00 60.31 H new ATOM 0 HB3 MET B 114 -2.829 16.906 6.802 1.00 60.31 H new ATOM 0 HG2 MET B 114 -2.394 15.748 9.033 1.00 44.42 H new ATOM 0 HG3 MET B 114 -2.537 14.216 8.195 1.00 44.42 H new ATOM 0 HE1 MET B 114 0.031 13.725 5.925 1.00 21.35 H new ATOM 0 HE2 MET B 114 -1.559 14.464 5.620 1.00 21.35 H new ATOM 0 HE3 MET B 114 -0.072 15.359 5.226 1.00 21.35 H new ATOM 3595 N ILE B 115 -5.957 16.037 5.396 1.00 12.23 N ATOM 3596 CA ILE B 115 -6.741 16.574 4.259 1.00 71.34 C ATOM 3597 C ILE B 115 -8.260 16.565 4.558 1.00 41.31 C ATOM 3598 O ILE B 115 -9.057 16.978 3.705 1.00 22.13 O ATOM 3599 CB ILE B 115 -6.474 15.752 2.933 1.00 72.11 C ATOM 3600 CG1 ILE B 115 -7.075 14.314 3.050 1.00 15.52 C ATOM 3601 CG2 ILE B 115 -4.959 15.708 2.600 1.00 32.20 C ATOM 3602 CD1 ILE B 115 -6.896 13.412 1.839 1.00 63.10 C ATOM 0 H ILE B 115 -5.797 15.031 5.339 1.00 12.23 H new ATOM 0 HA ILE B 115 -6.412 17.603 4.117 1.00 71.34 H new ATOM 0 HB ILE B 115 -6.974 16.259 2.108 1.00 72.11 H new ATOM 0 HG12 ILE B 115 -6.624 13.823 3.913 1.00 15.52 H new ATOM 0 HG13 ILE B 115 -8.142 14.404 3.256 1.00 15.52 H new ATOM 0 HG21 ILE B 115 -4.804 15.137 1.684 1.00 32.20 H new ATOM 0 HG22 ILE B 115 -4.587 16.723 2.462 1.00 32.20 H new ATOM 0 HG23 ILE B 115 -4.420 15.233 3.420 1.00 32.20 H new ATOM 0 HD11 ILE B 115 -7.353 12.442 2.037 1.00 63.10 H new ATOM 0 HD12 ILE B 115 -7.374 13.868 0.972 1.00 63.10 H new ATOM 0 HD13 ILE B 115 -5.833 13.278 1.639 1.00 63.10 H new ATOM 3614 N ARG B 116 -8.641 16.061 5.754 1.00 70.53 N ATOM 3615 CA ARG B 116 -10.046 15.783 6.110 1.00 34.12 C ATOM 3616 C ARG B 116 -10.906 17.061 6.065 1.00 71.11 C ATOM 3617 O ARG B 116 -10.908 17.854 7.016 1.00 51.11 O ATOM 3618 CB ARG B 116 -10.140 15.117 7.512 1.00 52.34 C ATOM 3619 CG ARG B 116 -11.544 14.575 7.866 1.00 54.32 C ATOM 3620 CD ARG B 116 -11.996 13.452 6.907 1.00 60.34 C ATOM 3621 NE ARG B 116 -13.427 13.165 7.031 1.00 30.42 N ATOM 3622 CZ ARG B 116 -14.229 12.773 6.034 1.00 53.44 C ATOM 3623 NH1 ARG B 116 -13.760 12.595 4.789 1.00 51.41 N ATOM 3624 NH2 ARG B 116 -15.519 12.580 6.280 1.00 22.01 N ATOM 0 H ARG B 116 -7.980 15.836 6.498 1.00 70.53 H new ATOM 0 HA ARG B 116 -10.439 15.089 5.367 1.00 34.12 H new ATOM 0 HB2 ARG B 116 -9.424 14.297 7.560 1.00 52.34 H new ATOM 0 HB3 ARG B 116 -9.843 15.844 8.268 1.00 52.34 H new ATOM 0 HG2 ARG B 116 -11.538 14.197 8.888 1.00 54.32 H new ATOM 0 HG3 ARG B 116 -12.266 15.391 7.832 1.00 54.32 H new ATOM 0 HD2 ARG B 116 -11.772 13.741 5.880 1.00 60.34 H new ATOM 0 HD3 ARG B 116 -11.426 12.547 7.115 1.00 60.34 H new ATOM 0 HE ARG B 116 -13.847 13.273 7.954 1.00 30.42 H new ATOM 0 HH11 ARG B 116 -12.774 12.759 4.587 1.00 51.41 H new ATOM 0 HH12 ARG B 116 -14.390 12.296 4.045 1.00 51.41 H new ATOM 0 HH21 ARG B 116 -15.887 12.731 7.219 1.00 22.01 H new ATOM 0 HH22 ARG B 116 -16.142 12.281 5.530 1.00 22.01 H new