USER MOD reduce.3.24.130724 H: found=0, std=0, add=1817, rem=0, adj=76 USER MOD reduce.3.24.130724 removed 1828 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 NoAdj-H: A 63 ASP H : A 63 ASP N : A 115 CACA :(H bumps) USER MOD Set 1.1: B 79 MET CE :methyl -163:sc= -0.502 (180deg=-1.54!) USER MOD Set 1.2: Y 112 THR OG1 : rot -179:sc= -0.387 USER MOD Set 2.1: B 55 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0419) USER MOD Set 2.2: Y 105 HIS : no HE2:sc= -4.63 K(o=-6.3,f=-12!) USER MOD Set 2.3: Y 109 MET CE :methyl -167:sc= -1.68 (180deg=0) USER MOD Set 3.1: A 55 LYS NZ :NH3+ 179:sc= -0.256 (180deg=-0.196) USER MOD Set 3.2: X 105 HIS : no HE2:sc= -3.05 K(o=-4.7,f=-9.3!) USER MOD Set 3.3: X 109 MET CE :methyl -166:sc= -1.37 (180deg=0) USER MOD Set 4.1: A 15 HIS : no HE2:sc= -3.62 K(o=-6.7,f=-12!) USER MOD Set 4.2: A 18 SER OG : rot 170:sc= -0.67 USER MOD Set 4.3: B 85 HIS : no HD1:sc= -2.39 K(o=-6.7,f=-8.4!) USER MOD Set 5.1: B 57 MET CE :methyl -118:sc= -4.78 (180deg=-7.72!) USER MOD Set 5.2: B 68 CYS SG : rot -110:sc= -2.26 USER MOD Set 6.1: B 33 LYS NZ :NH3+ -155:sc= 1.08 (180deg=0) USER MOD Set 6.2: B 37 ASN :FLIP amide:sc= -14.5! C(o=-14!,f=-13!) USER MOD Set 7.1: B 28 LYS NZ :NH3+ -162:sc= 0.549 (180deg=-0.85) USER MOD Set 7.2: B 30 SER OG : rot -160:sc= 0.779 USER MOD Set 8.1: A 85 HIS : no HD1:sc= -3.05 K(o=-7.7,f=-8.9!) USER MOD Set 8.2: B 15 HIS : no HE2:sc= -4.14 K(o=-7.7,f=-13!) USER MOD Set 8.3: B 18 SER OG : rot 170:sc= -0.545 USER MOD Set 9.1: A 81 THR OG1 : rot 93:sc= 0.735 USER MOD Set 9.2: B 7 MET CE :methyl 168:sc= -1.06 (180deg=-1.55) USER MOD Set10.1: A 79 MET CE :methyl -159:sc= -0.457 (180deg=-1.49!) USER MOD Set10.2: X 112 THR OG1 : rot -170:sc= -0.404 USER MOD Set11.1: A 57 MET CE :methyl -119:sc= -4.67 (180deg=-7.67!) USER MOD Set11.2: A 68 CYS SG : rot 65:sc= -2.3 USER MOD Set12.1: A 33 LYS NZ :NH3+ -154:sc= 1.15 (180deg=0) USER MOD Set12.2: A 37 ASN :FLIP amide:sc= -14.1! C(o=-14!,f=-13!) USER MOD Set13.1: A 28 LYS NZ :NH3+ -161:sc= 0.533 (180deg=-0.65) USER MOD Set13.2: A 30 SER OG : rot -170:sc= 0.713 USER MOD Set14.1: A 7 MET CE :methyl 168:sc= -1.3 (180deg=-2.06!) USER MOD Set14.2: B 81 THR OG1 : rot 69:sc= 0.615 USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 0 MET N :NH3+ -161:sc= -0.0319 (180deg=-0.811) USER MOD Single : A 1 SER OG : rot -53:sc= 0.0639 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= -0.126 X(o=-0.13,f=-0.46) USER MOD Single : A 17 TYR OH : rot 0:sc= -0.212 USER MOD Single : A 24 LYS NZ :NH3+ -127:sc= -1.29 (180deg=-3.43!) USER MOD Single : A 25 HIS : no HD1:sc= -0.412 K(o=-0.41,f=-1.6) USER MOD Single : A 26 LYS NZ :NH3+ 138:sc= 1.19 (180deg=0.555) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 ASN :FLIP amide:sc= -0.0751 F(o=-2.5!,f=-0.075) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= -0.266 X(o=-0.27,f=-0.27) USER MOD Single : A 48 LYS NZ :NH3+ 168:sc= -0.0323 (180deg=-0.342) USER MOD Single : A 50 GLN :FLIP amide:sc= -1.5 F(o=-2.2!,f=-1.5) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=-0.063) USER MOD Single : A 74 MET CE :methyl -165:sc= -1.37 (180deg=-2.28!) USER MOD Single : A 78 SER OG : rot -110:sc= -1.55 USER MOD Single : A 82 THR OG1 : rot 71:sc= 0.347 USER MOD Single : A 84 CYS SG : rot 62:sc= 0.108 USER MOD Single : A 90 HIS : no HD1:sc= -0.0575 X(o=-0.058,f=-0.006) USER MOD Single : B 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 0 MET N :NH3+ -161:sc= -0.0209 (180deg=-0.817) USER MOD Single : B 1 SER OG : rot -53:sc= 0.0594 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 16 GLN : amide:sc= -0.186 X(o=-0.19,f=-0.51) USER MOD Single : B 17 TYR OH : rot 0:sc= -0.231 USER MOD Single : B 24 LYS NZ :NH3+ -127:sc= -0.999 (180deg=-3!) USER MOD Single : B 25 HIS : no HD1:sc= -0.399 K(o=-0.4,f=-1.5) USER MOD Single : B 26 LYS NZ :NH3+ 160:sc= 1.26 (180deg=0.489) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 38 ASN :FLIP amide:sc= -0.0513 F(o=-2.5!,f=-0.051) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= -0.226 X(o=-0.23,f=-0.23) USER MOD Single : B 48 LYS NZ :NH3+ 165:sc=-0.000654 (180deg=-0.271) USER MOD Single : B 50 GLN :FLIP amide:sc= -1.33 F(o=-2.2!,f=-1.3) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 71 GLN : amide:sc= 0 X(o=0,f=-0.082) USER MOD Single : B 74 MET CE :methyl -162:sc= -1.45 (180deg=-2.34!) USER MOD Single : B 78 SER OG : rot -120:sc= -1.41 USER MOD Single : B 82 THR OG1 : rot 72:sc= 0.363 USER MOD Single : B 84 CYS SG : rot 63:sc= 0.118 USER MOD Single : B 90 HIS : no HD1:sc= -0.0332 X(o=-0.033,f=0) USER MOD Single : X 92 SER OG : rot -61:sc= 1.26 USER MOD Single : X 93 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : X 95 LYS NZ :NH3+ -153:sc= -0.14 (180deg=-1.08) USER MOD Single : X 96 SER OG : rot 180:sc= 0.25 USER MOD Single : X 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 98 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0271) USER MOD Single : X 100 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : X 101 SER OG : rot 180:sc= 0 USER MOD Single : X 102 THR OG1 : rot 102:sc= 1.08 USER MOD Single : X 103 SER OG : rot 180:sc= 0 USER MOD Single : X 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 107 LYS NZ :NH3+ 164:sc= -0.0161 (180deg=-0.246) USER MOD Single : X 111 LYS NZ :NH3+ -136:sc= -4.29! (180deg=-7.65!) USER MOD Single : Y 92 SER OG : rot -63:sc= 1.18 USER MOD Single : Y 93 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : Y 95 LYS NZ :NH3+ -151:sc= -0.201 (180deg=-1.11) USER MOD Single : Y 96 SER OG : rot 180:sc= 0.238 USER MOD Single : Y 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 98 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0181) USER MOD Single : Y 100 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : Y 101 SER OG : rot 180:sc= 0 USER MOD Single : Y 102 THR OG1 : rot 108:sc= 1.22 USER MOD Single : Y 103 SER OG : rot 180:sc= 0 USER MOD Single : Y 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 107 LYS NZ :NH3+ 164:sc= -0.0206 (180deg=-0.24) USER MOD Single : Y 111 LYS NZ :NH3+ -140:sc= -4.52! (180deg=-7.98!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 0.813 -2.198 -13.803 1.00 0.00 N ATOM 2 CA MET A 0 -0.097 -2.612 -14.908 1.00 0.00 C ATOM 3 C MET A 0 -1.320 -1.689 -14.929 1.00 0.00 C ATOM 4 O MET A 0 -2.377 -2.031 -14.435 1.00 0.00 O ATOM 5 CB MET A 0 -0.543 -4.061 -14.683 1.00 0.00 C ATOM 6 CG MET A 0 0.659 -4.997 -14.841 1.00 0.00 C ATOM 7 SD MET A 0 0.133 -6.709 -14.575 1.00 0.00 S ATOM 8 CE MET A 0 1.742 -7.491 -14.852 1.00 0.00 C ATOM 0 H1 MET A 0 1.763 -2.586 -13.972 1.00 0.00 H new ATOM 0 H2 MET A 0 0.864 -1.160 -13.766 1.00 0.00 H new ATOM 0 H3 MET A 0 0.448 -2.559 -12.899 1.00 0.00 H new ATOM 0 HA MET A 0 0.425 -2.541 -15.862 1.00 0.00 H new ATOM 0 HB2 MET A 0 -0.973 -4.170 -13.687 1.00 0.00 H new ATOM 0 HB3 MET A 0 -1.322 -4.328 -15.398 1.00 0.00 H new ATOM 0 HG2 MET A 0 1.089 -4.888 -15.837 1.00 0.00 H new ATOM 0 HG3 MET A 0 1.438 -4.730 -14.127 1.00 0.00 H new ATOM 0 HE1 MET A 0 1.647 -8.571 -14.735 1.00 0.00 H new ATOM 0 HE2 MET A 0 2.088 -7.264 -15.860 1.00 0.00 H new ATOM 0 HE3 MET A 0 2.461 -7.110 -14.127 1.00 0.00 H new ATOM 20 N SER A 1 -1.180 -0.515 -15.491 1.00 0.00 N ATOM 21 CA SER A 1 -2.332 0.441 -15.538 1.00 0.00 C ATOM 22 C SER A 1 -2.770 0.786 -14.113 1.00 0.00 C ATOM 23 O SER A 1 -3.911 1.118 -13.859 1.00 0.00 O ATOM 24 CB SER A 1 -3.504 -0.192 -16.294 1.00 0.00 C ATOM 25 OG SER A 1 -4.380 0.834 -16.743 1.00 0.00 O ATOM 0 H SER A 1 -0.319 -0.176 -15.920 1.00 0.00 H new ATOM 0 HA SER A 1 -2.022 1.350 -16.054 1.00 0.00 H new ATOM 0 HB2 SER A 1 -3.136 -0.769 -17.142 1.00 0.00 H new ATOM 0 HB3 SER A 1 -4.039 -0.885 -15.645 1.00 0.00 H new ATOM 0 HG SER A 1 -4.631 1.404 -15.986 1.00 0.00 H new ATOM 31 N GLU A 2 -1.860 0.722 -13.189 1.00 0.00 N ATOM 32 CA GLU A 2 -2.185 1.052 -11.776 1.00 0.00 C ATOM 33 C GLU A 2 -2.322 2.559 -11.636 1.00 0.00 C ATOM 34 O GLU A 2 -2.737 3.059 -10.620 1.00 0.00 O ATOM 35 CB GLU A 2 -1.052 0.558 -10.886 1.00 0.00 C ATOM 36 CG GLU A 2 -1.083 -0.964 -10.867 1.00 0.00 C ATOM 37 CD GLU A 2 0.118 -1.498 -10.086 1.00 0.00 C ATOM 38 OE1 GLU A 2 1.186 -1.592 -10.669 1.00 0.00 O ATOM 39 OE2 GLU A 2 -0.050 -1.806 -8.917 1.00 0.00 O ATOM 0 H GLU A 2 -0.890 0.451 -13.353 1.00 0.00 H new ATOM 0 HA GLU A 2 -3.120 0.575 -11.483 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -0.092 0.913 -11.262 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -1.164 0.952 -9.876 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -2.009 -1.312 -10.410 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -1.066 -1.350 -11.886 1.00 0.00 H new ATOM 46 N LEU A 3 -1.952 3.285 -12.648 1.00 0.00 N ATOM 47 CA LEU A 3 -2.027 4.771 -12.579 1.00 0.00 C ATOM 48 C LEU A 3 -3.340 5.212 -11.931 1.00 0.00 C ATOM 49 O LEU A 3 -3.433 6.283 -11.371 1.00 0.00 O ATOM 50 CB LEU A 3 -1.938 5.346 -14.000 1.00 0.00 C ATOM 51 CG LEU A 3 -1.691 6.867 -13.951 1.00 0.00 C ATOM 52 CD1 LEU A 3 -0.192 7.157 -13.775 1.00 0.00 C ATOM 53 CD2 LEU A 3 -2.187 7.518 -15.251 1.00 0.00 C ATOM 0 H LEU A 3 -1.597 2.912 -13.529 1.00 0.00 H new ATOM 0 HA LEU A 3 -1.199 5.141 -11.974 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -1.131 4.858 -14.547 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -2.861 5.138 -14.541 1.00 0.00 H new ATOM 0 HG LEU A 3 -2.237 7.282 -13.104 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -0.031 8.235 -13.742 1.00 0.00 H new ATOM 0 HD12 LEU A 3 0.159 6.709 -12.845 1.00 0.00 H new ATOM 0 HD13 LEU A 3 0.361 6.733 -14.613 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -2.010 8.593 -15.210 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -1.649 7.093 -16.099 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -3.254 7.330 -15.368 1.00 0.00 H new ATOM 65 N GLU A 4 -4.353 4.401 -11.988 1.00 0.00 N ATOM 66 CA GLU A 4 -5.641 4.800 -11.351 1.00 0.00 C ATOM 67 C GLU A 4 -5.510 4.742 -9.828 1.00 0.00 C ATOM 68 O GLU A 4 -6.072 5.554 -9.120 1.00 0.00 O ATOM 69 CB GLU A 4 -6.758 3.866 -11.823 1.00 0.00 C ATOM 70 CG GLU A 4 -6.408 2.422 -11.459 1.00 0.00 C ATOM 71 CD GLU A 4 -7.495 1.485 -11.987 1.00 0.00 C ATOM 72 OE1 GLU A 4 -8.586 1.964 -12.251 1.00 0.00 O ATOM 73 OE2 GLU A 4 -7.219 0.304 -12.120 1.00 0.00 O ATOM 0 H GLU A 4 -4.350 3.488 -12.442 1.00 0.00 H new ATOM 0 HA GLU A 4 -5.886 5.822 -11.641 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.703 4.150 -11.360 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.891 3.958 -12.901 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -5.442 2.152 -11.885 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -6.319 2.320 -10.377 1.00 0.00 H new ATOM 80 N LYS A 5 -4.779 3.791 -9.311 1.00 0.00 N ATOM 81 CA LYS A 5 -4.630 3.697 -7.828 1.00 0.00 C ATOM 82 C LYS A 5 -3.537 4.655 -7.341 1.00 0.00 C ATOM 83 O LYS A 5 -3.591 5.149 -6.235 1.00 0.00 O ATOM 84 CB LYS A 5 -4.284 2.257 -7.419 1.00 0.00 C ATOM 85 CG LYS A 5 -3.075 1.737 -8.218 1.00 0.00 C ATOM 86 CD LYS A 5 -2.362 0.587 -7.448 1.00 0.00 C ATOM 87 CE LYS A 5 -1.043 1.097 -6.851 1.00 0.00 C ATOM 88 NZ LYS A 5 -0.536 0.117 -5.849 1.00 0.00 N ATOM 0 H LYS A 5 -4.281 3.079 -9.846 1.00 0.00 H new ATOM 0 HA LYS A 5 -5.576 3.978 -7.366 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -4.064 2.220 -6.352 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -5.144 1.609 -7.589 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -3.404 1.379 -9.194 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -2.373 2.552 -8.397 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -3.009 0.213 -6.655 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -2.168 -0.248 -8.122 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -0.306 1.239 -7.641 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -1.197 2.068 -6.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 0.358 0.464 -5.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -1.237 0.002 -5.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -0.374 -0.800 -6.312 1.00 0.00 H new ATOM 102 N ALA A 6 -2.540 4.911 -8.143 1.00 0.00 N ATOM 103 CA ALA A 6 -1.449 5.826 -7.709 1.00 0.00 C ATOM 104 C ALA A 6 -1.957 7.262 -7.656 1.00 0.00 C ATOM 105 O ALA A 6 -1.629 8.009 -6.762 1.00 0.00 O ATOM 106 CB ALA A 6 -0.277 5.732 -8.688 1.00 0.00 C ATOM 0 H ALA A 6 -2.435 4.525 -9.081 1.00 0.00 H new ATOM 0 HA ALA A 6 -1.116 5.531 -6.714 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.520 6.403 -8.367 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.097 4.709 -8.710 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.612 6.017 -9.685 1.00 0.00 H new ATOM 112 N MET A 7 -2.754 7.654 -8.604 1.00 0.00 N ATOM 113 CA MET A 7 -3.283 9.042 -8.597 1.00 0.00 C ATOM 114 C MET A 7 -4.218 9.223 -7.413 1.00 0.00 C ATOM 115 O MET A 7 -4.230 10.250 -6.763 1.00 0.00 O ATOM 116 CB MET A 7 -4.053 9.314 -9.891 1.00 0.00 C ATOM 117 CG MET A 7 -3.084 9.393 -11.068 1.00 0.00 C ATOM 118 SD MET A 7 -4.020 9.726 -12.584 1.00 0.00 S ATOM 119 CE MET A 7 -2.661 10.406 -13.568 1.00 0.00 C ATOM 0 H MET A 7 -3.063 7.074 -9.384 1.00 0.00 H new ATOM 0 HA MET A 7 -2.449 9.739 -8.519 1.00 0.00 H new ATOM 0 HB2 MET A 7 -4.783 8.523 -10.063 1.00 0.00 H new ATOM 0 HB3 MET A 7 -4.609 10.247 -9.804 1.00 0.00 H new ATOM 0 HG2 MET A 7 -2.350 10.181 -10.899 1.00 0.00 H new ATOM 0 HG3 MET A 7 -2.532 8.458 -11.164 1.00 0.00 H new ATOM 0 HE1 MET A 7 -2.969 10.481 -14.611 1.00 0.00 H new ATOM 0 HE2 MET A 7 -2.401 11.396 -13.194 1.00 0.00 H new ATOM 0 HE3 MET A 7 -1.794 9.750 -13.492 1.00 0.00 H new ATOM 129 N VAL A 8 -5.010 8.237 -7.137 1.00 0.00 N ATOM 130 CA VAL A 8 -5.960 8.346 -6.002 1.00 0.00 C ATOM 131 C VAL A 8 -5.193 8.444 -4.679 1.00 0.00 C ATOM 132 O VAL A 8 -5.587 9.155 -3.778 1.00 0.00 O ATOM 133 CB VAL A 8 -6.878 7.123 -5.987 1.00 0.00 C ATOM 134 CG1 VAL A 8 -7.699 7.105 -4.693 1.00 0.00 C ATOM 135 CG2 VAL A 8 -7.820 7.196 -7.189 1.00 0.00 C ATOM 0 H VAL A 8 -5.043 7.355 -7.649 1.00 0.00 H new ATOM 0 HA VAL A 8 -6.562 9.247 -6.123 1.00 0.00 H new ATOM 0 HB VAL A 8 -6.278 6.214 -6.040 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -8.351 6.232 -4.688 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -7.027 7.061 -3.836 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -8.304 8.010 -4.633 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -8.479 6.328 -7.188 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.417 8.106 -7.128 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.236 7.206 -8.109 1.00 0.00 H new ATOM 145 N ALA A 9 -4.120 7.715 -4.544 1.00 0.00 N ATOM 146 CA ALA A 9 -3.350 7.748 -3.262 1.00 0.00 C ATOM 147 C ALA A 9 -2.643 9.088 -3.093 1.00 0.00 C ATOM 148 O ALA A 9 -2.525 9.610 -2.004 1.00 0.00 O ATOM 149 CB ALA A 9 -2.314 6.633 -3.253 1.00 0.00 C ATOM 0 H ALA A 9 -3.741 7.098 -5.262 1.00 0.00 H new ATOM 0 HA ALA A 9 -4.051 7.610 -2.438 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -1.756 6.662 -2.317 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.815 5.670 -3.347 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -1.627 6.768 -4.089 1.00 0.00 H new ATOM 155 N LEU A 10 -2.159 9.639 -4.163 1.00 0.00 N ATOM 156 CA LEU A 10 -1.442 10.935 -4.079 1.00 0.00 C ATOM 157 C LEU A 10 -2.400 11.964 -3.475 1.00 0.00 C ATOM 158 O LEU A 10 -2.030 12.786 -2.660 1.00 0.00 O ATOM 159 CB LEU A 10 -1.034 11.342 -5.509 1.00 0.00 C ATOM 160 CG LEU A 10 0.270 12.155 -5.509 1.00 0.00 C ATOM 161 CD1 LEU A 10 0.128 13.351 -4.558 1.00 0.00 C ATOM 162 CD2 LEU A 10 1.465 11.264 -5.086 1.00 0.00 C ATOM 0 H LEU A 10 -2.229 9.244 -5.101 1.00 0.00 H new ATOM 0 HA LEU A 10 -0.550 10.869 -3.456 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -0.908 10.449 -6.121 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -1.831 11.930 -5.963 1.00 0.00 H new ATOM 0 HG LEU A 10 0.462 12.522 -6.517 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.053 13.928 -4.558 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -0.695 13.984 -4.890 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -0.075 12.992 -3.549 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.380 11.856 -5.092 1.00 0.00 H new ATOM 0 HD22 LEU A 10 1.291 10.874 -4.083 1.00 0.00 H new ATOM 0 HD23 LEU A 10 1.566 10.434 -5.785 1.00 0.00 H new ATOM 174 N ILE A 11 -3.634 11.902 -3.874 1.00 0.00 N ATOM 175 CA ILE A 11 -4.660 12.839 -3.348 1.00 0.00 C ATOM 176 C ILE A 11 -4.977 12.538 -1.873 1.00 0.00 C ATOM 177 O ILE A 11 -5.187 13.438 -1.084 1.00 0.00 O ATOM 178 CB ILE A 11 -5.927 12.706 -4.206 1.00 0.00 C ATOM 179 CG1 ILE A 11 -5.649 13.299 -5.596 1.00 0.00 C ATOM 180 CG2 ILE A 11 -7.099 13.439 -3.545 1.00 0.00 C ATOM 181 CD1 ILE A 11 -6.796 12.968 -6.564 1.00 0.00 C ATOM 0 H ILE A 11 -3.983 11.229 -4.556 1.00 0.00 H new ATOM 0 HA ILE A 11 -4.280 13.859 -3.400 1.00 0.00 H new ATOM 0 HB ILE A 11 -6.194 11.653 -4.301 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -5.531 14.380 -5.519 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -4.711 12.903 -5.986 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -7.989 13.335 -4.165 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -7.289 13.008 -2.562 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -6.853 14.495 -3.437 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -6.581 13.396 -7.543 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -6.895 11.886 -6.655 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -7.727 13.386 -6.182 1.00 0.00 H new ATOM 193 N ASP A 12 -5.056 11.288 -1.498 1.00 0.00 N ATOM 194 CA ASP A 12 -5.409 10.953 -0.082 1.00 0.00 C ATOM 195 C ASP A 12 -4.397 11.532 0.913 1.00 0.00 C ATOM 196 O ASP A 12 -4.761 12.068 1.940 1.00 0.00 O ATOM 197 CB ASP A 12 -5.413 9.434 0.091 1.00 0.00 C ATOM 198 CG ASP A 12 -6.013 9.082 1.454 1.00 0.00 C ATOM 199 OD1 ASP A 12 -6.116 9.973 2.281 1.00 0.00 O ATOM 200 OD2 ASP A 12 -6.357 7.928 1.648 1.00 0.00 O ATOM 0 H ASP A 12 -4.892 10.486 -2.107 1.00 0.00 H new ATOM 0 HA ASP A 12 -6.390 11.384 0.119 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -5.992 8.967 -0.706 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -4.397 9.045 0.016 1.00 0.00 H new ATOM 205 N VAL A 13 -3.135 11.376 0.645 1.00 0.00 N ATOM 206 CA VAL A 13 -2.098 11.858 1.604 1.00 0.00 C ATOM 207 C VAL A 13 -2.088 13.395 1.691 1.00 0.00 C ATOM 208 O VAL A 13 -1.931 13.969 2.758 1.00 0.00 O ATOM 209 CB VAL A 13 -0.724 11.295 1.145 1.00 0.00 C ATOM 210 CG1 VAL A 13 0.127 12.356 0.429 1.00 0.00 C ATOM 211 CG2 VAL A 13 0.048 10.757 2.351 1.00 0.00 C ATOM 0 H VAL A 13 -2.771 10.934 -0.199 1.00 0.00 H new ATOM 0 HA VAL A 13 -2.321 11.501 2.609 1.00 0.00 H new ATOM 0 HB VAL A 13 -0.924 10.491 0.436 1.00 0.00 H new ATOM 0 HG11 VAL A 13 1.078 11.917 0.127 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -0.404 12.714 -0.453 1.00 0.00 H new ATOM 0 HG13 VAL A 13 0.312 13.191 1.105 1.00 0.00 H new ATOM 0 HG21 VAL A 13 1.010 10.364 2.022 1.00 0.00 H new ATOM 0 HG22 VAL A 13 0.211 11.562 3.067 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -0.526 9.961 2.825 1.00 0.00 H new ATOM 221 N PHE A 14 -2.244 14.064 0.589 1.00 0.00 N ATOM 222 CA PHE A 14 -2.224 15.550 0.628 1.00 0.00 C ATOM 223 C PHE A 14 -3.341 16.043 1.529 1.00 0.00 C ATOM 224 O PHE A 14 -3.172 16.982 2.264 1.00 0.00 O ATOM 225 CB PHE A 14 -2.408 16.123 -0.779 1.00 0.00 C ATOM 226 CG PHE A 14 -2.384 17.634 -0.708 1.00 0.00 C ATOM 227 CD1 PHE A 14 -1.168 18.315 -0.817 1.00 0.00 C ATOM 228 CD2 PHE A 14 -3.573 18.353 -0.518 1.00 0.00 C ATOM 229 CE1 PHE A 14 -1.136 19.712 -0.742 1.00 0.00 C ATOM 230 CE2 PHE A 14 -3.540 19.751 -0.441 1.00 0.00 C ATOM 231 CZ PHE A 14 -2.322 20.430 -0.554 1.00 0.00 C ATOM 0 H PHE A 14 -2.384 13.651 -0.333 1.00 0.00 H new ATOM 0 HA PHE A 14 -1.262 15.882 1.017 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -1.616 15.765 -1.437 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -3.353 15.782 -1.203 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -0.251 17.762 -0.959 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -4.513 17.829 -0.431 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -0.196 20.236 -0.829 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -4.455 20.305 -0.294 1.00 0.00 H new ATOM 0 HZ PHE A 14 -2.297 21.508 -0.496 1.00 0.00 H new ATOM 241 N HIS A 15 -4.483 15.430 1.470 1.00 0.00 N ATOM 242 CA HIS A 15 -5.607 15.885 2.327 1.00 0.00 C ATOM 243 C HIS A 15 -5.270 15.668 3.806 1.00 0.00 C ATOM 244 O HIS A 15 -5.767 16.368 4.666 1.00 0.00 O ATOM 245 CB HIS A 15 -6.870 15.105 1.963 1.00 0.00 C ATOM 246 CG HIS A 15 -7.332 15.531 0.598 1.00 0.00 C ATOM 247 ND1 HIS A 15 -7.506 16.867 0.262 1.00 0.00 N ATOM 248 CD2 HIS A 15 -7.653 14.815 -0.528 1.00 0.00 C ATOM 249 CE1 HIS A 15 -7.914 16.912 -1.020 1.00 0.00 C ATOM 250 NE2 HIS A 15 -8.018 15.690 -1.544 1.00 0.00 N ATOM 0 H HIS A 15 -4.689 14.634 0.866 1.00 0.00 H new ATOM 0 HA HIS A 15 -5.774 16.949 2.161 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -6.667 14.034 1.975 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -7.652 15.290 2.700 1.00 0.00 H new ATOM 0 HD1 HIS A 15 -7.353 17.668 0.875 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -7.626 13.739 -0.612 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -8.130 17.824 -1.557 1.00 0.00 H new ATOM 259 N GLN A 16 -4.447 14.702 4.124 1.00 0.00 N ATOM 260 CA GLN A 16 -4.119 14.468 5.558 1.00 0.00 C ATOM 261 C GLN A 16 -3.470 15.719 6.165 1.00 0.00 C ATOM 262 O GLN A 16 -3.746 16.077 7.293 1.00 0.00 O ATOM 263 CB GLN A 16 -3.154 13.286 5.675 1.00 0.00 C ATOM 264 CG GLN A 16 -3.882 11.989 5.313 1.00 0.00 C ATOM 265 CD GLN A 16 -4.914 11.659 6.393 1.00 0.00 C ATOM 266 OE1 GLN A 16 -4.612 11.691 7.569 1.00 0.00 O ATOM 267 NE2 GLN A 16 -6.129 11.337 6.041 1.00 0.00 N ATOM 0 H GLN A 16 -3.994 14.073 3.461 1.00 0.00 H new ATOM 0 HA GLN A 16 -5.039 14.247 6.100 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.301 13.433 5.012 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -2.762 13.223 6.690 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -4.374 12.094 4.346 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -3.166 11.173 5.219 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -6.384 11.310 5.054 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -6.824 11.113 6.753 1.00 0.00 H new ATOM 276 N TYR A 17 -2.598 16.383 5.442 1.00 0.00 N ATOM 277 CA TYR A 17 -1.932 17.604 6.015 1.00 0.00 C ATOM 278 C TYR A 17 -2.704 18.886 5.672 1.00 0.00 C ATOM 279 O TYR A 17 -2.671 19.844 6.413 1.00 0.00 O ATOM 280 CB TYR A 17 -0.507 17.706 5.459 1.00 0.00 C ATOM 281 CG TYR A 17 0.383 16.749 6.205 1.00 0.00 C ATOM 282 CD1 TYR A 17 0.472 15.419 5.795 1.00 0.00 C ATOM 283 CD2 TYR A 17 1.111 17.196 7.312 1.00 0.00 C ATOM 284 CE1 TYR A 17 1.291 14.528 6.490 1.00 0.00 C ATOM 285 CE2 TYR A 17 1.934 16.311 8.010 1.00 0.00 C ATOM 286 CZ TYR A 17 2.027 14.973 7.600 1.00 0.00 C ATOM 287 OH TYR A 17 2.838 14.093 8.289 1.00 0.00 O ATOM 0 H TYR A 17 -2.319 16.139 4.492 1.00 0.00 H new ATOM 0 HA TYR A 17 -1.914 17.503 7.100 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -0.501 17.472 4.394 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -0.135 18.725 5.564 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -0.093 15.079 4.940 1.00 0.00 H new ATOM 0 HD2 TYR A 17 1.036 18.226 7.627 1.00 0.00 H new ATOM 0 HE1 TYR A 17 1.359 13.497 6.174 1.00 0.00 H new ATOM 0 HE2 TYR A 17 2.498 16.656 8.864 1.00 0.00 H new ATOM 0 HH TYR A 17 2.784 13.206 7.876 1.00 0.00 H new ATOM 297 N SER A 18 -3.379 18.920 4.560 1.00 0.00 N ATOM 298 CA SER A 18 -4.129 20.154 4.172 1.00 0.00 C ATOM 299 C SER A 18 -5.175 20.481 5.237 1.00 0.00 C ATOM 300 O SER A 18 -5.405 21.626 5.570 1.00 0.00 O ATOM 301 CB SER A 18 -4.829 19.930 2.831 1.00 0.00 C ATOM 302 OG SER A 18 -5.971 19.109 3.029 1.00 0.00 O ATOM 0 H SER A 18 -3.447 18.147 3.898 1.00 0.00 H new ATOM 0 HA SER A 18 -3.428 20.984 4.085 1.00 0.00 H new ATOM 0 HB2 SER A 18 -5.125 20.886 2.398 1.00 0.00 H new ATOM 0 HB3 SER A 18 -4.145 19.458 2.125 1.00 0.00 H new ATOM 0 HG SER A 18 -6.510 19.095 2.210 1.00 0.00 H new ATOM 308 N GLY A 19 -5.820 19.484 5.762 1.00 0.00 N ATOM 309 CA GLY A 19 -6.859 19.729 6.803 1.00 0.00 C ATOM 310 C GLY A 19 -6.193 19.930 8.169 1.00 0.00 C ATOM 311 O GLY A 19 -6.846 20.246 9.143 1.00 0.00 O ATOM 0 H GLY A 19 -5.675 18.505 5.517 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -7.447 20.609 6.542 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -7.549 18.886 6.846 1.00 0.00 H new ATOM 315 N ARG A 20 -4.903 19.741 8.254 1.00 0.00 N ATOM 316 CA ARG A 20 -4.213 19.915 9.567 1.00 0.00 C ATOM 317 C ARG A 20 -4.411 21.348 10.069 1.00 0.00 C ATOM 318 O ARG A 20 -4.794 21.571 11.200 1.00 0.00 O ATOM 319 CB ARG A 20 -2.715 19.645 9.399 1.00 0.00 C ATOM 320 CG ARG A 20 -2.019 19.740 10.760 1.00 0.00 C ATOM 321 CD ARG A 20 -0.523 19.476 10.583 1.00 0.00 C ATOM 322 NE ARG A 20 0.133 19.341 11.929 1.00 0.00 N ATOM 323 CZ ARG A 20 0.045 20.283 12.835 1.00 0.00 C ATOM 324 NH1 ARG A 20 -0.437 21.456 12.530 1.00 0.00 N ATOM 325 NH2 ARG A 20 0.499 20.067 14.039 1.00 0.00 N ATOM 0 H ARG A 20 -4.299 19.475 7.476 1.00 0.00 H new ATOM 0 HA ARG A 20 -4.635 19.214 10.287 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -2.560 18.656 8.968 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -2.281 20.366 8.706 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -2.177 20.727 11.194 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -2.448 19.016 11.452 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -0.371 18.567 10.001 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -0.064 20.292 10.025 1.00 0.00 H new ATOM 0 HE ARG A 20 0.660 18.494 12.142 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -0.750 21.647 11.578 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -0.501 22.182 13.243 1.00 0.00 H new ATOM 0 HH21 ARG A 20 0.920 19.168 14.271 1.00 0.00 H new ATOM 0 HH22 ARG A 20 0.433 20.798 14.748 1.00 0.00 H new ATOM 339 N GLU A 21 -4.150 22.326 9.240 1.00 0.00 N ATOM 340 CA GLU A 21 -4.322 23.746 9.677 1.00 0.00 C ATOM 341 C GLU A 21 -5.736 24.209 9.323 1.00 0.00 C ATOM 342 O GLU A 21 -6.139 25.314 9.623 1.00 0.00 O ATOM 343 CB GLU A 21 -3.281 24.626 8.967 1.00 0.00 C ATOM 344 CG GLU A 21 -3.318 26.046 9.545 1.00 0.00 C ATOM 345 CD GLU A 21 -2.121 26.846 9.027 1.00 0.00 C ATOM 346 OE1 GLU A 21 -1.337 26.287 8.278 1.00 0.00 O ATOM 347 OE2 GLU A 21 -2.008 28.005 9.390 1.00 0.00 O ATOM 0 H GLU A 21 -3.826 22.204 8.281 1.00 0.00 H new ATOM 0 HA GLU A 21 -4.177 23.827 10.754 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -2.286 24.199 9.091 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -3.485 24.654 7.897 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -4.248 26.540 9.262 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -3.297 26.006 10.634 1.00 0.00 H new ATOM 354 N GLY A 22 -6.504 23.360 8.697 1.00 0.00 N ATOM 355 CA GLY A 22 -7.899 23.737 8.330 1.00 0.00 C ATOM 356 C GLY A 22 -7.904 24.372 6.942 1.00 0.00 C ATOM 357 O GLY A 22 -8.945 24.591 6.354 1.00 0.00 O ATOM 0 H GLY A 22 -6.225 22.418 8.423 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -8.540 22.856 8.341 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -8.304 24.435 9.063 1.00 0.00 H new ATOM 361 N ASP A 23 -6.749 24.667 6.405 1.00 0.00 N ATOM 362 CA ASP A 23 -6.698 25.280 5.052 1.00 0.00 C ATOM 363 C ASP A 23 -6.794 24.165 4.008 1.00 0.00 C ATOM 364 O ASP A 23 -5.848 23.858 3.314 1.00 0.00 O ATOM 365 CB ASP A 23 -5.382 26.038 4.896 1.00 0.00 C ATOM 366 CG ASP A 23 -5.240 27.042 6.041 1.00 0.00 C ATOM 367 OD1 ASP A 23 -6.185 27.776 6.279 1.00 0.00 O ATOM 368 OD2 ASP A 23 -4.190 27.058 6.662 1.00 0.00 O ATOM 0 H ASP A 23 -5.843 24.509 6.846 1.00 0.00 H new ATOM 0 HA ASP A 23 -7.525 25.977 4.916 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -4.544 25.341 4.902 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -5.359 26.556 3.937 1.00 0.00 H new ATOM 373 N LYS A 24 -7.934 23.548 3.911 1.00 0.00 N ATOM 374 CA LYS A 24 -8.117 22.441 2.933 1.00 0.00 C ATOM 375 C LYS A 24 -7.991 22.971 1.496 1.00 0.00 C ATOM 376 O LYS A 24 -7.439 22.320 0.631 1.00 0.00 O ATOM 377 CB LYS A 24 -9.505 21.827 3.139 1.00 0.00 C ATOM 378 CG LYS A 24 -9.715 20.680 2.151 1.00 0.00 C ATOM 379 CD LYS A 24 -10.990 19.910 2.520 1.00 0.00 C ATOM 380 CE LYS A 24 -12.214 20.837 2.441 1.00 0.00 C ATOM 381 NZ LYS A 24 -12.378 21.559 3.735 1.00 0.00 N ATOM 0 H LYS A 24 -8.757 23.765 4.473 1.00 0.00 H new ATOM 0 HA LYS A 24 -7.347 21.686 3.091 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -9.603 21.461 4.161 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -10.274 22.587 2.997 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -9.795 21.070 1.136 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -8.856 20.010 2.168 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -11.121 19.065 1.844 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -10.898 19.502 3.527 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -12.090 21.552 1.627 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -13.110 20.256 2.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.347 21.424 4.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -11.701 21.184 4.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -12.200 22.574 3.591 1.00 0.00 H new ATOM 395 N HIS A 25 -8.530 24.132 1.228 1.00 0.00 N ATOM 396 CA HIS A 25 -8.479 24.691 -0.160 1.00 0.00 C ATOM 397 C HIS A 25 -7.099 25.286 -0.486 1.00 0.00 C ATOM 398 O HIS A 25 -6.727 25.387 -1.638 1.00 0.00 O ATOM 399 CB HIS A 25 -9.542 25.783 -0.296 1.00 0.00 C ATOM 400 CG HIS A 25 -9.528 26.326 -1.698 1.00 0.00 C ATOM 401 ND1 HIS A 25 -8.678 27.353 -2.084 1.00 0.00 N ATOM 402 CD2 HIS A 25 -10.252 25.997 -2.818 1.00 0.00 C ATOM 403 CE1 HIS A 25 -8.910 27.605 -3.386 1.00 0.00 C ATOM 404 NE2 HIS A 25 -9.859 26.806 -3.878 1.00 0.00 N ATOM 0 H HIS A 25 -9.005 24.721 1.912 1.00 0.00 H new ATOM 0 HA HIS A 25 -8.668 23.877 -0.860 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -10.526 25.378 -0.062 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -9.349 26.584 0.417 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -11.009 25.229 -2.867 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -8.393 28.359 -3.960 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -10.220 26.792 -4.832 1.00 0.00 H new ATOM 413 N LYS A 26 -6.339 25.690 0.503 1.00 0.00 N ATOM 414 CA LYS A 26 -4.987 26.288 0.225 1.00 0.00 C ATOM 415 C LYS A 26 -3.981 25.770 1.252 1.00 0.00 C ATOM 416 O LYS A 26 -4.345 25.311 2.310 1.00 0.00 O ATOM 417 CB LYS A 26 -5.085 27.815 0.300 1.00 0.00 C ATOM 418 CG LYS A 26 -5.426 28.242 1.727 1.00 0.00 C ATOM 419 CD LYS A 26 -5.766 29.733 1.744 1.00 0.00 C ATOM 420 CE LYS A 26 -5.890 30.214 3.191 1.00 0.00 C ATOM 421 NZ LYS A 26 -4.538 30.278 3.813 1.00 0.00 N ATOM 0 H LYS A 26 -6.592 25.633 1.490 1.00 0.00 H new ATOM 0 HA LYS A 26 -4.652 26.002 -0.772 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.141 28.265 -0.008 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -5.849 28.174 -0.389 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -6.269 27.661 2.100 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -4.584 28.042 2.389 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -4.991 30.299 1.227 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -6.700 29.910 1.210 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -6.361 31.196 3.219 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -6.530 29.537 3.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -4.457 31.146 4.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -4.398 29.450 4.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -3.813 30.283 3.068 1.00 0.00 H new ATOM 435 N LEU A 27 -2.714 25.809 0.926 1.00 0.00 N ATOM 436 CA LEU A 27 -1.662 25.286 1.858 1.00 0.00 C ATOM 437 C LEU A 27 -0.640 26.390 2.160 1.00 0.00 C ATOM 438 O LEU A 27 -0.152 27.043 1.265 1.00 0.00 O ATOM 439 CB LEU A 27 -0.971 24.108 1.165 1.00 0.00 C ATOM 440 CG LEU A 27 -0.089 23.337 2.159 1.00 0.00 C ATOM 441 CD1 LEU A 27 -0.948 22.391 3.016 1.00 0.00 C ATOM 442 CD2 LEU A 27 0.935 22.505 1.381 1.00 0.00 C ATOM 0 H LEU A 27 -2.358 26.184 0.047 1.00 0.00 H new ATOM 0 HA LEU A 27 -2.108 24.965 2.799 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -1.720 23.439 0.740 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -0.362 24.472 0.337 1.00 0.00 H new ATOM 0 HG LEU A 27 0.416 24.051 2.810 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.309 21.852 3.715 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -1.685 22.971 3.571 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -1.460 21.678 2.369 1.00 0.00 H new ATOM 0 HD21 LEU A 27 1.564 21.955 2.081 1.00 0.00 H new ATOM 0 HD22 LEU A 27 0.414 21.801 0.732 1.00 0.00 H new ATOM 0 HD23 LEU A 27 1.556 23.165 0.776 1.00 0.00 H new ATOM 454 N LYS A 28 -0.312 26.608 3.415 1.00 0.00 N ATOM 455 CA LYS A 28 0.671 27.674 3.768 1.00 0.00 C ATOM 456 C LYS A 28 2.042 27.043 4.030 1.00 0.00 C ATOM 457 O LYS A 28 2.139 25.941 4.530 1.00 0.00 O ATOM 458 CB LYS A 28 0.188 28.391 5.035 1.00 0.00 C ATOM 459 CG LYS A 28 1.135 29.544 5.374 1.00 0.00 C ATOM 460 CD LYS A 28 0.647 30.254 6.637 1.00 0.00 C ATOM 461 CE LYS A 28 1.560 31.445 6.933 1.00 0.00 C ATOM 462 NZ LYS A 28 2.936 30.956 7.232 1.00 0.00 N ATOM 0 H LYS A 28 -0.687 26.089 4.209 1.00 0.00 H new ATOM 0 HA LYS A 28 0.756 28.385 2.947 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -0.823 28.771 4.885 1.00 0.00 H new ATOM 0 HB3 LYS A 28 0.144 27.688 5.867 1.00 0.00 H new ATOM 0 HG2 LYS A 28 2.146 29.165 5.525 1.00 0.00 H new ATOM 0 HG3 LYS A 28 1.179 30.248 4.543 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -0.380 30.593 6.503 1.00 0.00 H new ATOM 0 HD3 LYS A 28 0.647 29.563 7.480 1.00 0.00 H new ATOM 0 HE2 LYS A 28 1.581 32.122 6.079 1.00 0.00 H new ATOM 0 HE3 LYS A 28 1.172 32.012 7.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 3.466 31.696 7.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 2.880 30.104 7.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 3.424 30.726 6.343 1.00 0.00 H new ATOM 476 N LYS A 29 3.102 27.738 3.697 1.00 0.00 N ATOM 477 CA LYS A 29 4.472 27.186 3.928 1.00 0.00 C ATOM 478 C LYS A 29 4.545 26.555 5.315 1.00 0.00 C ATOM 479 O LYS A 29 5.363 25.698 5.581 1.00 0.00 O ATOM 480 CB LYS A 29 5.507 28.315 3.854 1.00 0.00 C ATOM 481 CG LYS A 29 5.179 29.400 4.885 1.00 0.00 C ATOM 482 CD LYS A 29 6.194 30.538 4.768 1.00 0.00 C ATOM 483 CE LYS A 29 5.922 31.578 5.857 1.00 0.00 C ATOM 484 NZ LYS A 29 6.992 32.614 5.831 1.00 0.00 N ATOM 0 H LYS A 29 3.077 28.666 3.274 1.00 0.00 H new ATOM 0 HA LYS A 29 4.681 26.438 3.164 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.505 27.917 4.039 1.00 0.00 H new ATOM 0 HB3 LYS A 29 5.516 28.745 2.853 1.00 0.00 H new ATOM 0 HG2 LYS A 29 4.171 29.780 4.721 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.202 28.980 5.891 1.00 0.00 H new ATOM 0 HD2 LYS A 29 7.207 30.148 4.868 1.00 0.00 H new ATOM 0 HD3 LYS A 29 6.126 31.001 3.783 1.00 0.00 H new ATOM 0 HE2 LYS A 29 4.948 32.041 5.698 1.00 0.00 H new ATOM 0 HE3 LYS A 29 5.890 31.097 6.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 6.808 33.322 6.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 7.914 32.165 6.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 7.002 33.080 4.901 1.00 0.00 H new ATOM 498 N SER A 30 3.696 26.982 6.202 1.00 0.00 N ATOM 499 CA SER A 30 3.719 26.413 7.580 1.00 0.00 C ATOM 500 C SER A 30 3.117 25.013 7.552 1.00 0.00 C ATOM 501 O SER A 30 3.693 24.059 8.038 1.00 0.00 O ATOM 502 CB SER A 30 2.900 27.303 8.514 1.00 0.00 C ATOM 503 OG SER A 30 3.568 28.547 8.681 1.00 0.00 O ATOM 0 H SER A 30 2.988 27.698 6.037 1.00 0.00 H new ATOM 0 HA SER A 30 4.747 26.364 7.940 1.00 0.00 H new ATOM 0 HB2 SER A 30 1.904 27.464 8.101 1.00 0.00 H new ATOM 0 HB3 SER A 30 2.770 26.814 9.480 1.00 0.00 H new ATOM 0 HG SER A 30 3.134 29.058 9.396 1.00 0.00 H new ATOM 509 N GLU A 31 1.964 24.888 6.968 1.00 0.00 N ATOM 510 CA GLU A 31 1.303 23.565 6.876 1.00 0.00 C ATOM 511 C GLU A 31 2.171 22.653 6.005 1.00 0.00 C ATOM 512 O GLU A 31 2.293 21.468 6.244 1.00 0.00 O ATOM 513 CB GLU A 31 -0.081 23.761 6.254 1.00 0.00 C ATOM 514 CG GLU A 31 -0.975 22.558 6.552 1.00 0.00 C ATOM 515 CD GLU A 31 -2.407 22.895 6.139 1.00 0.00 C ATOM 516 OE1 GLU A 31 -2.610 23.972 5.601 1.00 0.00 O ATOM 517 OE2 GLU A 31 -3.278 22.084 6.382 1.00 0.00 O ATOM 0 H GLU A 31 1.445 25.657 6.545 1.00 0.00 H new ATOM 0 HA GLU A 31 1.186 23.108 7.858 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -0.538 24.668 6.648 1.00 0.00 H new ATOM 0 HB3 GLU A 31 0.013 23.894 5.176 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.622 21.681 6.009 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.936 22.312 7.613 1.00 0.00 H new ATOM 524 N LEU A 32 2.780 23.217 4.997 1.00 0.00 N ATOM 525 CA LEU A 32 3.656 22.424 4.088 1.00 0.00 C ATOM 526 C LEU A 32 4.797 21.807 4.886 1.00 0.00 C ATOM 527 O LEU A 32 5.176 20.684 4.661 1.00 0.00 O ATOM 528 CB LEU A 32 4.234 23.359 3.020 1.00 0.00 C ATOM 529 CG LEU A 32 5.224 22.616 2.108 1.00 0.00 C ATOM 530 CD1 LEU A 32 4.545 21.409 1.450 1.00 0.00 C ATOM 531 CD2 LEU A 32 5.709 23.583 1.022 1.00 0.00 C ATOM 0 H LEU A 32 2.706 24.207 4.762 1.00 0.00 H new ATOM 0 HA LEU A 32 3.076 21.630 3.617 1.00 0.00 H new ATOM 0 HB2 LEU A 32 3.424 23.775 2.420 1.00 0.00 H new ATOM 0 HB3 LEU A 32 4.737 24.198 3.501 1.00 0.00 H new ATOM 0 HG LEU A 32 6.065 22.259 2.702 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.260 20.895 0.808 1.00 0.00 H new ATOM 0 HD12 LEU A 32 4.192 20.725 2.222 1.00 0.00 H new ATOM 0 HD13 LEU A 32 3.699 21.749 0.852 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.413 23.070 0.366 1.00 0.00 H new ATOM 0 HD22 LEU A 32 4.857 23.932 0.438 1.00 0.00 H new ATOM 0 HD23 LEU A 32 6.203 24.436 1.488 1.00 0.00 H new ATOM 543 N LYS A 33 5.354 22.536 5.807 1.00 0.00 N ATOM 544 CA LYS A 33 6.484 21.983 6.613 1.00 0.00 C ATOM 545 C LYS A 33 6.026 20.732 7.368 1.00 0.00 C ATOM 546 O LYS A 33 6.753 19.763 7.470 1.00 0.00 O ATOM 547 CB LYS A 33 6.955 23.044 7.610 1.00 0.00 C ATOM 548 CG LYS A 33 8.167 22.529 8.391 1.00 0.00 C ATOM 549 CD LYS A 33 8.614 23.606 9.383 1.00 0.00 C ATOM 550 CE LYS A 33 9.946 23.210 10.027 1.00 0.00 C ATOM 551 NZ LYS A 33 9.707 22.184 11.082 1.00 0.00 N ATOM 0 H LYS A 33 5.080 23.490 6.040 1.00 0.00 H new ATOM 0 HA LYS A 33 7.305 21.712 5.949 1.00 0.00 H new ATOM 0 HB2 LYS A 33 7.216 23.961 7.081 1.00 0.00 H new ATOM 0 HB3 LYS A 33 6.147 23.292 8.298 1.00 0.00 H new ATOM 0 HG2 LYS A 33 7.911 21.612 8.921 1.00 0.00 H new ATOM 0 HG3 LYS A 33 8.980 22.286 7.707 1.00 0.00 H new ATOM 0 HD2 LYS A 33 8.719 24.562 8.870 1.00 0.00 H new ATOM 0 HD3 LYS A 33 7.854 23.739 10.153 1.00 0.00 H new ATOM 0 HE2 LYS A 33 10.624 22.816 9.270 1.00 0.00 H new ATOM 0 HE3 LYS A 33 10.427 24.087 10.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 10.467 22.231 11.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 8.792 22.366 11.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 9.695 21.238 10.650 1.00 0.00 H new ATOM 565 N GLU A 34 4.835 20.734 7.898 1.00 0.00 N ATOM 566 CA GLU A 34 4.358 19.538 8.635 1.00 0.00 C ATOM 567 C GLU A 34 4.324 18.354 7.677 1.00 0.00 C ATOM 568 O GLU A 34 4.676 17.257 8.024 1.00 0.00 O ATOM 569 CB GLU A 34 2.964 19.798 9.222 1.00 0.00 C ATOM 570 CG GLU A 34 3.080 20.674 10.474 1.00 0.00 C ATOM 571 CD GLU A 34 3.540 22.077 10.081 1.00 0.00 C ATOM 572 OE1 GLU A 34 4.717 22.235 9.809 1.00 0.00 O ATOM 573 OE2 GLU A 34 2.709 22.970 10.061 1.00 0.00 O ATOM 0 H GLU A 34 4.175 21.511 7.852 1.00 0.00 H new ATOM 0 HA GLU A 34 5.035 19.318 9.461 1.00 0.00 H new ATOM 0 HB2 GLU A 34 2.334 20.290 8.481 1.00 0.00 H new ATOM 0 HB3 GLU A 34 2.483 18.852 9.473 1.00 0.00 H new ATOM 0 HG2 GLU A 34 2.118 20.726 10.984 1.00 0.00 H new ATOM 0 HG3 GLU A 34 3.788 20.232 11.175 1.00 0.00 H new ATOM 580 N LEU A 35 3.908 18.567 6.469 1.00 0.00 N ATOM 581 CA LEU A 35 3.879 17.446 5.493 1.00 0.00 C ATOM 582 C LEU A 35 5.293 16.912 5.274 1.00 0.00 C ATOM 583 O LEU A 35 5.539 15.728 5.302 1.00 0.00 O ATOM 584 CB LEU A 35 3.326 17.964 4.156 1.00 0.00 C ATOM 585 CG LEU A 35 3.512 16.897 3.036 1.00 0.00 C ATOM 586 CD1 LEU A 35 2.295 16.890 2.106 1.00 0.00 C ATOM 587 CD2 LEU A 35 4.767 17.206 2.195 1.00 0.00 C ATOM 0 H LEU A 35 3.586 19.466 6.111 1.00 0.00 H new ATOM 0 HA LEU A 35 3.247 16.646 5.878 1.00 0.00 H new ATOM 0 HB2 LEU A 35 2.269 18.206 4.263 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.838 18.885 3.877 1.00 0.00 H new ATOM 0 HG LEU A 35 3.623 15.924 3.515 1.00 0.00 H new ATOM 0 HD11 LEU A 35 2.436 16.140 1.327 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.400 16.652 2.680 1.00 0.00 H new ATOM 0 HD13 LEU A 35 2.182 17.872 1.648 1.00 0.00 H new ATOM 0 HD21 LEU A 35 4.880 16.450 1.418 1.00 0.00 H new ATOM 0 HD22 LEU A 35 4.663 18.188 1.733 1.00 0.00 H new ATOM 0 HD23 LEU A 35 5.647 17.199 2.838 1.00 0.00 H new ATOM 599 N ILE A 36 6.211 17.789 5.006 1.00 0.00 N ATOM 600 CA ILE A 36 7.608 17.367 4.716 1.00 0.00 C ATOM 601 C ILE A 36 8.327 16.824 5.949 1.00 0.00 C ATOM 602 O ILE A 36 9.040 15.843 5.868 1.00 0.00 O ATOM 603 CB ILE A 36 8.367 18.574 4.170 1.00 0.00 C ATOM 604 CG1 ILE A 36 7.702 19.036 2.870 1.00 0.00 C ATOM 605 CG2 ILE A 36 9.814 18.184 3.893 1.00 0.00 C ATOM 606 CD1 ILE A 36 8.286 20.383 2.439 1.00 0.00 C ATOM 0 H ILE A 36 6.053 18.796 4.974 1.00 0.00 H new ATOM 0 HA ILE A 36 7.575 16.556 3.988 1.00 0.00 H new ATOM 0 HB ILE A 36 8.347 19.383 4.901 1.00 0.00 H new ATOM 0 HG12 ILE A 36 7.859 18.294 2.087 1.00 0.00 H new ATOM 0 HG13 ILE A 36 6.625 19.125 3.013 1.00 0.00 H new ATOM 0 HG21 ILE A 36 10.355 19.046 3.503 1.00 0.00 H new ATOM 0 HG22 ILE A 36 10.284 17.848 4.818 1.00 0.00 H new ATOM 0 HG23 ILE A 36 9.840 17.378 3.160 1.00 0.00 H new ATOM 0 HD11 ILE A 36 7.809 20.707 1.514 1.00 0.00 H new ATOM 0 HD12 ILE A 36 8.106 21.124 3.218 1.00 0.00 H new ATOM 0 HD13 ILE A 36 9.359 20.279 2.277 1.00 0.00 H new ATOM 618 N ASN A 37 8.196 17.456 7.078 1.00 0.00 N ATOM 619 CA ASN A 37 8.939 16.952 8.275 1.00 0.00 C ATOM 620 C ASN A 37 8.282 15.714 8.888 1.00 0.00 C ATOM 621 O ASN A 37 8.952 14.852 9.423 1.00 0.00 O ATOM 622 CB ASN A 37 9.026 18.060 9.326 1.00 0.00 C ATOM 623 CG ASN A 37 9.994 19.134 8.833 1.00 0.00 C ATOM 624 OD1 ASN A 37 9.921 20.341 9.316 1.00 0.00 O flip ATOM 625 ND2 ASN A 37 10.832 18.866 7.997 1.00 0.00 N flip ATOM 0 H ASN A 37 7.620 18.284 7.229 1.00 0.00 H new ATOM 0 HA ASN A 37 9.937 16.663 7.945 1.00 0.00 H new ATOM 0 HB2 ASN A 37 8.041 18.492 9.501 1.00 0.00 H new ATOM 0 HB3 ASN A 37 9.368 17.652 10.277 1.00 0.00 H new ATOM 0 HD21 ASN A 37 10.890 17.921 7.618 1.00 0.00 H new ATOM 0 HD22 ASN A 37 11.478 19.586 7.674 1.00 0.00 H new ATOM 632 N ASN A 38 6.986 15.641 8.862 1.00 0.00 N ATOM 633 CA ASN A 38 6.276 14.477 9.499 1.00 0.00 C ATOM 634 C ASN A 38 5.866 13.397 8.487 1.00 0.00 C ATOM 635 O ASN A 38 5.786 12.235 8.833 1.00 0.00 O ATOM 636 CB ASN A 38 5.026 14.984 10.219 1.00 0.00 C ATOM 637 CG ASN A 38 5.440 15.923 11.355 1.00 0.00 C ATOM 638 OD1 ASN A 38 6.705 16.058 11.644 1.00 0.00 O flip ATOM 639 ND2 ASN A 38 4.604 16.542 11.982 1.00 0.00 N flip ATOM 0 H ASN A 38 6.375 16.334 8.429 1.00 0.00 H new ATOM 0 HA ASN A 38 6.976 14.018 10.197 1.00 0.00 H new ATOM 0 HB2 ASN A 38 4.376 15.508 9.518 1.00 0.00 H new ATOM 0 HB3 ASN A 38 4.456 14.144 10.616 1.00 0.00 H new ATOM 0 HD21 ASN A 38 3.615 16.436 11.756 1.00 0.00 H new ATOM 0 HD22 ASN A 38 4.891 17.168 12.735 1.00 0.00 H new ATOM 646 N GLU A 39 5.578 13.737 7.255 1.00 0.00 N ATOM 647 CA GLU A 39 5.152 12.671 6.295 1.00 0.00 C ATOM 648 C GLU A 39 6.394 11.997 5.712 1.00 0.00 C ATOM 649 O GLU A 39 6.307 10.978 5.059 1.00 0.00 O ATOM 650 CB GLU A 39 4.306 13.287 5.162 1.00 0.00 C ATOM 651 CG GLU A 39 3.438 12.205 4.513 1.00 0.00 C ATOM 652 CD GLU A 39 2.545 12.841 3.445 1.00 0.00 C ATOM 653 OE1 GLU A 39 1.499 13.355 3.806 1.00 0.00 O ATOM 654 OE2 GLU A 39 2.921 12.800 2.285 1.00 0.00 O ATOM 0 H GLU A 39 5.618 14.684 6.878 1.00 0.00 H new ATOM 0 HA GLU A 39 4.547 11.931 6.818 1.00 0.00 H new ATOM 0 HB2 GLU A 39 3.675 14.082 5.559 1.00 0.00 H new ATOM 0 HB3 GLU A 39 4.958 13.740 4.415 1.00 0.00 H new ATOM 0 HG2 GLU A 39 4.069 11.438 4.065 1.00 0.00 H new ATOM 0 HG3 GLU A 39 2.826 11.713 5.269 1.00 0.00 H new ATOM 661 N LEU A 40 7.551 12.564 5.952 1.00 0.00 N ATOM 662 CA LEU A 40 8.821 11.977 5.419 1.00 0.00 C ATOM 663 C LEU A 40 9.859 11.926 6.543 1.00 0.00 C ATOM 664 O LEU A 40 10.921 12.508 6.442 1.00 0.00 O ATOM 665 CB LEU A 40 9.360 12.866 4.294 1.00 0.00 C ATOM 666 CG LEU A 40 8.250 13.172 3.274 1.00 0.00 C ATOM 667 CD1 LEU A 40 8.705 14.288 2.333 1.00 0.00 C ATOM 668 CD2 LEU A 40 7.945 11.923 2.447 1.00 0.00 C ATOM 0 H LEU A 40 7.671 13.416 6.499 1.00 0.00 H new ATOM 0 HA LEU A 40 8.627 10.974 5.039 1.00 0.00 H new ATOM 0 HB2 LEU A 40 9.747 13.796 4.710 1.00 0.00 H new ATOM 0 HB3 LEU A 40 10.193 12.369 3.797 1.00 0.00 H new ATOM 0 HG LEU A 40 7.355 13.484 3.812 1.00 0.00 H new ATOM 0 HD11 LEU A 40 7.915 14.501 1.612 1.00 0.00 H new ATOM 0 HD12 LEU A 40 8.920 15.186 2.911 1.00 0.00 H new ATOM 0 HD13 LEU A 40 9.604 13.973 1.803 1.00 0.00 H new ATOM 0 HD21 LEU A 40 7.158 12.147 1.727 1.00 0.00 H new ATOM 0 HD22 LEU A 40 8.844 11.609 1.916 1.00 0.00 H new ATOM 0 HD23 LEU A 40 7.615 11.121 3.107 1.00 0.00 H new ATOM 680 N SER A 41 9.563 11.249 7.619 1.00 0.00 N ATOM 681 CA SER A 41 10.540 11.188 8.743 1.00 0.00 C ATOM 682 C SER A 41 11.851 10.559 8.265 1.00 0.00 C ATOM 683 O SER A 41 12.923 10.990 8.640 1.00 0.00 O ATOM 684 CB SER A 41 9.962 10.341 9.878 1.00 0.00 C ATOM 685 OG SER A 41 8.756 10.934 10.340 1.00 0.00 O ATOM 0 H SER A 41 8.693 10.739 7.768 1.00 0.00 H new ATOM 0 HA SER A 41 10.734 12.200 9.098 1.00 0.00 H new ATOM 0 HB2 SER A 41 9.771 9.326 9.529 1.00 0.00 H new ATOM 0 HB3 SER A 41 10.680 10.267 10.694 1.00 0.00 H new ATOM 0 HG SER A 41 8.382 10.392 11.066 1.00 0.00 H new ATOM 691 N HIS A 42 11.777 9.539 7.445 1.00 0.00 N ATOM 692 CA HIS A 42 13.026 8.876 6.946 1.00 0.00 C ATOM 693 C HIS A 42 12.898 8.555 5.452 1.00 0.00 C ATOM 694 O HIS A 42 13.865 8.209 4.802 1.00 0.00 O ATOM 695 CB HIS A 42 13.251 7.583 7.733 1.00 0.00 C ATOM 696 CG HIS A 42 13.397 7.913 9.194 1.00 0.00 C ATOM 697 ND1 HIS A 42 12.373 7.701 10.109 1.00 0.00 N ATOM 698 CD2 HIS A 42 14.436 8.452 9.913 1.00 0.00 C ATOM 699 CE1 HIS A 42 12.815 8.109 11.314 1.00 0.00 C ATOM 700 NE2 HIS A 42 14.064 8.573 11.247 1.00 0.00 N ATOM 0 H HIS A 42 10.906 9.136 7.099 1.00 0.00 H new ATOM 0 HA HIS A 42 13.872 9.549 7.086 1.00 0.00 H new ATOM 0 HB2 HIS A 42 12.413 6.902 7.584 1.00 0.00 H new ATOM 0 HB3 HIS A 42 14.144 7.074 7.372 1.00 0.00 H new ATOM 0 HD2 HIS A 42 15.394 8.738 9.505 1.00 0.00 H new ATOM 0 HE1 HIS A 42 12.231 8.066 12.221 1.00 0.00 H new ATOM 0 HE2 HIS A 42 14.628 8.940 12.014 1.00 0.00 H new ATOM 709 N PHE A 43 11.721 8.666 4.897 1.00 0.00 N ATOM 710 CA PHE A 43 11.554 8.365 3.445 1.00 0.00 C ATOM 711 C PHE A 43 12.245 9.460 2.623 1.00 0.00 C ATOM 712 O PHE A 43 12.705 9.226 1.523 1.00 0.00 O ATOM 713 CB PHE A 43 10.056 8.282 3.107 1.00 0.00 C ATOM 714 CG PHE A 43 9.808 8.216 1.603 1.00 0.00 C ATOM 715 CD1 PHE A 43 10.680 7.523 0.738 1.00 0.00 C ATOM 716 CD2 PHE A 43 8.673 8.847 1.073 1.00 0.00 C ATOM 717 CE1 PHE A 43 10.410 7.474 -0.636 1.00 0.00 C ATOM 718 CE2 PHE A 43 8.408 8.792 -0.300 1.00 0.00 C ATOM 719 CZ PHE A 43 9.275 8.107 -1.154 1.00 0.00 C ATOM 0 H PHE A 43 10.871 8.951 5.383 1.00 0.00 H new ATOM 0 HA PHE A 43 12.012 7.406 3.203 1.00 0.00 H new ATOM 0 HB2 PHE A 43 9.626 7.401 3.584 1.00 0.00 H new ATOM 0 HB3 PHE A 43 9.543 9.150 3.520 1.00 0.00 H new ATOM 0 HD1 PHE A 43 11.555 7.030 1.134 1.00 0.00 H new ATOM 0 HD2 PHE A 43 7.999 9.379 1.729 1.00 0.00 H new ATOM 0 HE1 PHE A 43 11.080 6.946 -1.298 1.00 0.00 H new ATOM 0 HE2 PHE A 43 7.531 9.280 -0.700 1.00 0.00 H new ATOM 0 HZ PHE A 43 9.069 8.066 -2.213 1.00 0.00 H new ATOM 729 N LEU A 44 12.334 10.655 3.159 1.00 0.00 N ATOM 730 CA LEU A 44 13.007 11.771 2.428 1.00 0.00 C ATOM 731 C LEU A 44 13.778 12.601 3.454 1.00 0.00 C ATOM 732 O LEU A 44 13.653 12.393 4.645 1.00 0.00 O ATOM 733 CB LEU A 44 11.957 12.654 1.717 1.00 0.00 C ATOM 734 CG LEU A 44 12.557 13.263 0.427 1.00 0.00 C ATOM 735 CD1 LEU A 44 12.421 12.266 -0.730 1.00 0.00 C ATOM 736 CD2 LEU A 44 11.817 14.555 0.056 1.00 0.00 C ATOM 0 H LEU A 44 11.966 10.904 4.077 1.00 0.00 H new ATOM 0 HA LEU A 44 13.683 11.374 1.671 1.00 0.00 H new ATOM 0 HB2 LEU A 44 11.077 12.059 1.472 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.628 13.450 2.385 1.00 0.00 H new ATOM 0 HG LEU A 44 13.609 13.484 0.606 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.845 12.700 -1.636 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.954 11.348 -0.484 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.367 12.041 -0.894 1.00 0.00 H new ATOM 0 HD21 LEU A 44 12.249 14.973 -0.853 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.763 14.335 -0.111 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.913 15.276 0.868 1.00 0.00 H new ATOM 748 N GLU A 45 14.576 13.530 3.019 1.00 0.00 N ATOM 749 CA GLU A 45 15.335 14.335 4.005 1.00 0.00 C ATOM 750 C GLU A 45 14.381 15.269 4.757 1.00 0.00 C ATOM 751 O GLU A 45 13.753 16.139 4.190 1.00 0.00 O ATOM 752 CB GLU A 45 16.425 15.151 3.291 1.00 0.00 C ATOM 753 CG GLU A 45 15.804 16.326 2.524 1.00 0.00 C ATOM 754 CD GLU A 45 16.803 16.850 1.489 1.00 0.00 C ATOM 755 OE1 GLU A 45 17.974 16.531 1.611 1.00 0.00 O ATOM 756 OE2 GLU A 45 16.380 17.562 0.593 1.00 0.00 O ATOM 0 H GLU A 45 14.734 13.764 2.039 1.00 0.00 H new ATOM 0 HA GLU A 45 15.812 13.666 4.721 1.00 0.00 H new ATOM 0 HB2 GLU A 45 17.144 15.525 4.020 1.00 0.00 H new ATOM 0 HB3 GLU A 45 16.975 14.510 2.602 1.00 0.00 H new ATOM 0 HG2 GLU A 45 14.887 16.006 2.029 1.00 0.00 H new ATOM 0 HG3 GLU A 45 15.532 17.122 3.217 1.00 0.00 H new ATOM 763 N GLU A 46 14.284 15.089 6.039 1.00 0.00 N ATOM 764 CA GLU A 46 13.404 15.963 6.864 1.00 0.00 C ATOM 765 C GLU A 46 13.943 17.398 6.794 1.00 0.00 C ATOM 766 O GLU A 46 15.106 17.604 6.517 1.00 0.00 O ATOM 767 CB GLU A 46 13.432 15.442 8.314 1.00 0.00 C ATOM 768 CG GLU A 46 12.919 16.506 9.292 1.00 0.00 C ATOM 769 CD GLU A 46 12.719 15.873 10.671 1.00 0.00 C ATOM 770 OE1 GLU A 46 12.795 14.659 10.761 1.00 0.00 O ATOM 771 OE2 GLU A 46 12.493 16.614 11.614 1.00 0.00 O ATOM 0 H GLU A 46 14.781 14.366 6.560 1.00 0.00 H new ATOM 0 HA GLU A 46 12.377 15.952 6.499 1.00 0.00 H new ATOM 0 HB2 GLU A 46 12.819 14.545 8.393 1.00 0.00 H new ATOM 0 HB3 GLU A 46 14.449 15.157 8.582 1.00 0.00 H new ATOM 0 HG2 GLU A 46 13.630 17.329 9.357 1.00 0.00 H new ATOM 0 HG3 GLU A 46 11.979 16.924 8.932 1.00 0.00 H new ATOM 778 N ILE A 47 13.117 18.396 7.038 1.00 0.00 N ATOM 779 CA ILE A 47 13.617 19.813 6.989 1.00 0.00 C ATOM 780 C ILE A 47 13.831 20.303 8.421 1.00 0.00 C ATOM 781 O ILE A 47 12.977 20.165 9.273 1.00 0.00 O ATOM 782 CB ILE A 47 12.622 20.705 6.241 1.00 0.00 C ATOM 783 CG1 ILE A 47 12.633 20.277 4.765 1.00 0.00 C ATOM 784 CG2 ILE A 47 13.049 22.176 6.381 1.00 0.00 C ATOM 785 CD1 ILE A 47 11.663 21.124 3.956 1.00 0.00 C ATOM 0 H ILE A 47 12.128 18.291 7.267 1.00 0.00 H new ATOM 0 HA ILE A 47 14.563 19.857 6.449 1.00 0.00 H new ATOM 0 HB ILE A 47 11.617 20.602 6.651 1.00 0.00 H new ATOM 0 HG12 ILE A 47 13.639 20.378 4.359 1.00 0.00 H new ATOM 0 HG13 ILE A 47 12.361 19.225 4.684 1.00 0.00 H new ATOM 0 HG21 ILE A 47 12.342 22.812 5.849 1.00 0.00 H new ATOM 0 HG22 ILE A 47 13.063 22.452 7.435 1.00 0.00 H new ATOM 0 HG23 ILE A 47 14.045 22.308 5.958 1.00 0.00 H new ATOM 0 HD11 ILE A 47 11.685 20.806 2.914 1.00 0.00 H new ATOM 0 HD12 ILE A 47 10.655 21.001 4.352 1.00 0.00 H new ATOM 0 HD13 ILE A 47 11.953 22.173 4.022 1.00 0.00 H new ATOM 797 N LYS A 48 15.000 20.820 8.700 1.00 0.00 N ATOM 798 CA LYS A 48 15.327 21.263 10.090 1.00 0.00 C ATOM 799 C LYS A 48 15.163 22.782 10.243 1.00 0.00 C ATOM 800 O LYS A 48 15.058 23.280 11.346 1.00 0.00 O ATOM 801 CB LYS A 48 16.798 20.894 10.390 1.00 0.00 C ATOM 802 CG LYS A 48 17.187 19.566 9.709 1.00 0.00 C ATOM 803 CD LYS A 48 16.388 18.404 10.301 1.00 0.00 C ATOM 804 CE LYS A 48 16.618 17.158 9.449 1.00 0.00 C ATOM 805 NZ LYS A 48 18.065 16.795 9.469 1.00 0.00 N ATOM 0 H LYS A 48 15.748 20.955 8.020 1.00 0.00 H new ATOM 0 HA LYS A 48 14.646 20.769 10.782 1.00 0.00 H new ATOM 0 HB2 LYS A 48 17.455 21.691 10.041 1.00 0.00 H new ATOM 0 HB3 LYS A 48 16.943 20.810 11.467 1.00 0.00 H new ATOM 0 HG2 LYS A 48 17.002 19.633 8.637 1.00 0.00 H new ATOM 0 HG3 LYS A 48 18.254 19.384 9.838 1.00 0.00 H new ATOM 0 HD2 LYS A 48 16.698 18.219 11.330 1.00 0.00 H new ATOM 0 HD3 LYS A 48 15.327 18.652 10.327 1.00 0.00 H new ATOM 0 HE2 LYS A 48 16.020 16.330 9.830 1.00 0.00 H new ATOM 0 HE3 LYS A 48 16.293 17.341 8.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 18.190 15.845 9.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 18.604 17.485 8.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 18.411 16.802 10.450 1.00 0.00 H new ATOM 819 N GLU A 49 15.174 23.525 9.162 1.00 0.00 N ATOM 820 CA GLU A 49 15.055 25.016 9.269 1.00 0.00 C ATOM 821 C GLU A 49 13.940 25.524 8.343 1.00 0.00 C ATOM 822 O GLU A 49 13.812 25.103 7.211 1.00 0.00 O ATOM 823 CB GLU A 49 16.405 25.625 8.879 1.00 0.00 C ATOM 824 CG GLU A 49 16.427 27.118 9.211 1.00 0.00 C ATOM 825 CD GLU A 49 17.852 27.652 9.049 1.00 0.00 C ATOM 826 OE1 GLU A 49 18.721 26.868 8.702 1.00 0.00 O ATOM 827 OE2 GLU A 49 18.050 28.834 9.275 1.00 0.00 O ATOM 0 H GLU A 49 15.260 23.165 8.211 1.00 0.00 H new ATOM 0 HA GLU A 49 14.798 25.307 10.287 1.00 0.00 H new ATOM 0 HB2 GLU A 49 17.209 25.115 9.410 1.00 0.00 H new ATOM 0 HB3 GLU A 49 16.584 25.479 7.814 1.00 0.00 H new ATOM 0 HG2 GLU A 49 15.747 27.659 8.553 1.00 0.00 H new ATOM 0 HG3 GLU A 49 16.079 27.280 10.231 1.00 0.00 H new ATOM 834 N GLN A 50 13.130 26.427 8.834 1.00 0.00 N ATOM 835 CA GLN A 50 12.005 26.983 8.019 1.00 0.00 C ATOM 836 C GLN A 50 12.553 27.662 6.761 1.00 0.00 C ATOM 837 O GLN A 50 11.868 27.788 5.772 1.00 0.00 O ATOM 838 CB GLN A 50 11.241 28.015 8.859 1.00 0.00 C ATOM 839 CG GLN A 50 9.944 28.418 8.149 1.00 0.00 C ATOM 840 CD GLN A 50 8.944 27.260 8.199 1.00 0.00 C ATOM 841 OE1 GLN A 50 8.585 26.674 7.090 1.00 0.00 O flip ATOM 842 NE2 GLN A 50 8.477 26.892 9.258 1.00 0.00 N flip ATOM 0 H GLN A 50 13.201 26.808 9.777 1.00 0.00 H new ATOM 0 HA GLN A 50 11.339 26.172 7.725 1.00 0.00 H new ATOM 0 HB2 GLN A 50 11.013 27.599 9.840 1.00 0.00 H new ATOM 0 HB3 GLN A 50 11.863 28.895 9.022 1.00 0.00 H new ATOM 0 HG2 GLN A 50 9.517 29.300 8.626 1.00 0.00 H new ATOM 0 HG3 GLN A 50 10.154 28.685 7.113 1.00 0.00 H new ATOM 0 HE21 GLN A 50 8.757 27.350 10.125 1.00 0.00 H new ATOM 0 HE22 GLN A 50 7.805 26.125 9.280 1.00 0.00 H new ATOM 851 N GLU A 51 13.774 28.115 6.798 1.00 0.00 N ATOM 852 CA GLU A 51 14.359 28.805 5.609 1.00 0.00 C ATOM 853 C GLU A 51 14.369 27.865 4.403 1.00 0.00 C ATOM 854 O GLU A 51 14.123 28.282 3.296 1.00 0.00 O ATOM 855 CB GLU A 51 15.792 29.255 5.935 1.00 0.00 C ATOM 856 CG GLU A 51 16.747 28.046 5.911 1.00 0.00 C ATOM 857 CD GLU A 51 17.240 27.779 4.482 1.00 0.00 C ATOM 858 OE1 GLU A 51 16.770 28.446 3.574 1.00 0.00 O ATOM 859 OE2 GLU A 51 18.085 26.914 4.322 1.00 0.00 O ATOM 0 H GLU A 51 14.397 28.038 7.602 1.00 0.00 H new ATOM 0 HA GLU A 51 13.751 29.676 5.365 1.00 0.00 H new ATOM 0 HB2 GLU A 51 16.120 30.001 5.212 1.00 0.00 H new ATOM 0 HB3 GLU A 51 15.818 29.729 6.916 1.00 0.00 H new ATOM 0 HG2 GLU A 51 17.598 28.234 6.566 1.00 0.00 H new ATOM 0 HG3 GLU A 51 16.236 27.164 6.297 1.00 0.00 H new ATOM 866 N VAL A 52 14.651 26.608 4.597 1.00 0.00 N ATOM 867 CA VAL A 52 14.664 25.677 3.438 1.00 0.00 C ATOM 868 C VAL A 52 13.282 25.689 2.824 1.00 0.00 C ATOM 869 O VAL A 52 13.124 25.672 1.628 1.00 0.00 O ATOM 870 CB VAL A 52 15.001 24.265 3.910 1.00 0.00 C ATOM 871 CG1 VAL A 52 14.947 23.295 2.728 1.00 0.00 C ATOM 872 CG2 VAL A 52 16.401 24.257 4.516 1.00 0.00 C ATOM 0 H VAL A 52 14.871 26.188 5.500 1.00 0.00 H new ATOM 0 HA VAL A 52 15.413 25.987 2.709 1.00 0.00 H new ATOM 0 HB VAL A 52 14.275 23.952 4.661 1.00 0.00 H new ATOM 0 HG11 VAL A 52 15.188 22.289 3.071 1.00 0.00 H new ATOM 0 HG12 VAL A 52 13.945 23.301 2.298 1.00 0.00 H new ATOM 0 HG13 VAL A 52 15.669 23.603 1.971 1.00 0.00 H new ATOM 0 HG21 VAL A 52 16.645 23.250 4.854 1.00 0.00 H new ATOM 0 HG22 VAL A 52 17.125 24.573 3.764 1.00 0.00 H new ATOM 0 HG23 VAL A 52 16.435 24.942 5.363 1.00 0.00 H new ATOM 882 N VAL A 53 12.284 25.720 3.646 1.00 0.00 N ATOM 883 CA VAL A 53 10.897 25.747 3.135 1.00 0.00 C ATOM 884 C VAL A 53 10.675 27.032 2.348 1.00 0.00 C ATOM 885 O VAL A 53 9.973 27.048 1.366 1.00 0.00 O ATOM 886 CB VAL A 53 9.937 25.699 4.313 1.00 0.00 C ATOM 887 CG1 VAL A 53 8.508 25.587 3.807 1.00 0.00 C ATOM 888 CG2 VAL A 53 10.263 24.492 5.175 1.00 0.00 C ATOM 0 H VAL A 53 12.370 25.728 4.662 1.00 0.00 H new ATOM 0 HA VAL A 53 10.723 24.891 2.484 1.00 0.00 H new ATOM 0 HB VAL A 53 10.039 26.611 4.901 1.00 0.00 H new ATOM 0 HG11 VAL A 53 7.824 25.553 4.655 1.00 0.00 H new ATOM 0 HG12 VAL A 53 8.273 26.451 3.186 1.00 0.00 H new ATOM 0 HG13 VAL A 53 8.401 24.676 3.217 1.00 0.00 H new ATOM 0 HG21 VAL A 53 9.577 24.453 6.021 1.00 0.00 H new ATOM 0 HG22 VAL A 53 10.160 23.583 4.582 1.00 0.00 H new ATOM 0 HG23 VAL A 53 11.287 24.572 5.541 1.00 0.00 H new ATOM 898 N ASP A 54 11.255 28.112 2.791 1.00 0.00 N ATOM 899 CA ASP A 54 11.079 29.410 2.084 1.00 0.00 C ATOM 900 C ASP A 54 11.691 29.330 0.686 1.00 0.00 C ATOM 901 O ASP A 54 11.170 29.865 -0.271 1.00 0.00 O ATOM 902 CB ASP A 54 11.758 30.527 2.880 1.00 0.00 C ATOM 903 CG ASP A 54 10.972 30.786 4.167 1.00 0.00 C ATOM 904 OD1 ASP A 54 9.813 30.408 4.216 1.00 0.00 O ATOM 905 OD2 ASP A 54 11.540 31.363 5.079 1.00 0.00 O ATOM 0 H ASP A 54 11.848 28.151 3.620 1.00 0.00 H new ATOM 0 HA ASP A 54 10.014 29.625 1.995 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.784 30.247 3.118 1.00 0.00 H new ATOM 0 HB3 ASP A 54 11.807 31.437 2.282 1.00 0.00 H new ATOM 910 N LYS A 55 12.798 28.668 0.568 1.00 0.00 N ATOM 911 CA LYS A 55 13.459 28.542 -0.760 1.00 0.00 C ATOM 912 C LYS A 55 12.596 27.645 -1.637 1.00 0.00 C ATOM 913 O LYS A 55 12.406 27.884 -2.817 1.00 0.00 O ATOM 914 CB LYS A 55 14.857 27.940 -0.596 1.00 0.00 C ATOM 915 CG LYS A 55 15.591 28.005 -1.937 1.00 0.00 C ATOM 916 CD LYS A 55 17.041 27.555 -1.761 1.00 0.00 C ATOM 917 CE LYS A 55 17.765 27.616 -3.110 1.00 0.00 C ATOM 918 NZ LYS A 55 17.266 26.525 -3.996 1.00 0.00 N ATOM 0 H LYS A 55 13.281 28.203 1.337 1.00 0.00 H new ATOM 0 HA LYS A 55 13.566 29.523 -1.223 1.00 0.00 H new ATOM 0 HB2 LYS A 55 15.415 28.486 0.165 1.00 0.00 H new ATOM 0 HB3 LYS A 55 14.784 26.907 -0.257 1.00 0.00 H new ATOM 0 HG2 LYS A 55 15.090 27.369 -2.666 1.00 0.00 H new ATOM 0 HG3 LYS A 55 15.562 29.022 -2.328 1.00 0.00 H new ATOM 0 HD2 LYS A 55 17.546 28.195 -1.037 1.00 0.00 H new ATOM 0 HD3 LYS A 55 17.072 26.540 -1.366 1.00 0.00 H new ATOM 0 HE2 LYS A 55 17.598 28.585 -3.580 1.00 0.00 H new ATOM 0 HE3 LYS A 55 18.840 27.515 -2.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 17.746 26.579 -4.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 17.462 25.603 -3.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 16.241 26.631 -4.134 1.00 0.00 H new ATOM 932 N VAL A 56 12.050 26.622 -1.049 1.00 0.00 N ATOM 933 CA VAL A 56 11.171 25.700 -1.807 1.00 0.00 C ATOM 934 C VAL A 56 9.924 26.478 -2.209 1.00 0.00 C ATOM 935 O VAL A 56 9.299 26.209 -3.214 1.00 0.00 O ATOM 936 CB VAL A 56 10.805 24.506 -0.918 1.00 0.00 C ATOM 937 CG1 VAL A 56 9.668 23.700 -1.554 1.00 0.00 C ATOM 938 CG2 VAL A 56 12.033 23.606 -0.763 1.00 0.00 C ATOM 0 H VAL A 56 12.177 26.384 -0.065 1.00 0.00 H new ATOM 0 HA VAL A 56 11.671 25.319 -2.698 1.00 0.00 H new ATOM 0 HB VAL A 56 10.479 24.871 0.056 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.418 22.855 -0.912 1.00 0.00 H new ATOM 0 HG12 VAL A 56 8.792 24.338 -1.672 1.00 0.00 H new ATOM 0 HG13 VAL A 56 9.984 23.333 -2.531 1.00 0.00 H new ATOM 0 HG21 VAL A 56 11.782 22.754 -0.132 1.00 0.00 H new ATOM 0 HG22 VAL A 56 12.350 23.251 -1.744 1.00 0.00 H new ATOM 0 HG23 VAL A 56 12.843 24.172 -0.303 1.00 0.00 H new ATOM 948 N MET A 57 9.572 27.458 -1.425 1.00 0.00 N ATOM 949 CA MET A 57 8.374 28.281 -1.749 1.00 0.00 C ATOM 950 C MET A 57 8.671 29.111 -2.995 1.00 0.00 C ATOM 951 O MET A 57 7.820 29.326 -3.819 1.00 0.00 O ATOM 952 CB MET A 57 8.028 29.207 -0.557 1.00 0.00 C ATOM 953 CG MET A 57 6.937 28.587 0.368 1.00 0.00 C ATOM 954 SD MET A 57 5.496 29.705 0.407 1.00 0.00 S ATOM 955 CE MET A 57 4.151 28.497 0.575 1.00 0.00 C ATOM 0 H MET A 57 10.063 27.725 -0.572 1.00 0.00 H new ATOM 0 HA MET A 57 7.519 27.632 -1.937 1.00 0.00 H new ATOM 0 HB2 MET A 57 8.929 29.401 0.025 1.00 0.00 H new ATOM 0 HB3 MET A 57 7.680 30.168 -0.934 1.00 0.00 H new ATOM 0 HG2 MET A 57 6.643 27.605 -0.001 1.00 0.00 H new ATOM 0 HG3 MET A 57 7.332 28.444 1.374 1.00 0.00 H new ATOM 0 HE1 MET A 57 3.484 28.573 -0.284 1.00 0.00 H new ATOM 0 HE2 MET A 57 4.569 27.491 0.622 1.00 0.00 H new ATOM 0 HE3 MET A 57 3.591 28.700 1.488 1.00 0.00 H new ATOM 965 N GLU A 58 9.871 29.565 -3.165 1.00 0.00 N ATOM 966 CA GLU A 58 10.168 30.360 -4.387 1.00 0.00 C ATOM 967 C GLU A 58 9.752 29.510 -5.571 1.00 0.00 C ATOM 968 O GLU A 58 9.230 29.982 -6.562 1.00 0.00 O ATOM 969 CB GLU A 58 11.670 30.617 -4.482 1.00 0.00 C ATOM 970 CG GLU A 58 12.138 31.344 -3.232 1.00 0.00 C ATOM 971 CD GLU A 58 13.643 31.602 -3.326 1.00 0.00 C ATOM 972 OE1 GLU A 58 14.262 31.059 -4.226 1.00 0.00 O ATOM 973 OE2 GLU A 58 14.152 32.337 -2.496 1.00 0.00 O ATOM 0 H GLU A 58 10.653 29.426 -2.525 1.00 0.00 H new ATOM 0 HA GLU A 58 9.643 31.315 -4.364 1.00 0.00 H new ATOM 0 HB2 GLU A 58 12.205 29.674 -4.589 1.00 0.00 H new ATOM 0 HB3 GLU A 58 11.893 31.213 -5.367 1.00 0.00 H new ATOM 0 HG2 GLU A 58 11.602 32.287 -3.125 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.915 30.748 -2.347 1.00 0.00 H new ATOM 980 N THR A 59 10.007 28.246 -5.454 1.00 0.00 N ATOM 981 CA THR A 59 9.671 27.297 -6.535 1.00 0.00 C ATOM 982 C THR A 59 8.184 26.908 -6.523 1.00 0.00 C ATOM 983 O THR A 59 7.529 26.920 -7.546 1.00 0.00 O ATOM 984 CB THR A 59 10.521 26.046 -6.331 1.00 0.00 C ATOM 985 OG1 THR A 59 11.851 26.430 -6.010 1.00 0.00 O ATOM 986 CG2 THR A 59 10.530 25.215 -7.604 1.00 0.00 C ATOM 0 H THR A 59 10.444 27.822 -4.636 1.00 0.00 H new ATOM 0 HA THR A 59 9.872 27.771 -7.496 1.00 0.00 H new ATOM 0 HB THR A 59 10.101 25.453 -5.518 1.00 0.00 H new ATOM 0 HG1 THR A 59 12.400 25.629 -5.877 1.00 0.00 H new ATOM 0 HG21 THR A 59 11.138 24.323 -7.452 1.00 0.00 H new ATOM 0 HG22 THR A 59 9.511 24.921 -7.854 1.00 0.00 H new ATOM 0 HG23 THR A 59 10.948 25.804 -8.420 1.00 0.00 H new ATOM 994 N LEU A 60 7.653 26.521 -5.392 1.00 0.00 N ATOM 995 CA LEU A 60 6.222 26.085 -5.348 1.00 0.00 C ATOM 996 C LEU A 60 5.300 27.267 -5.070 1.00 0.00 C ATOM 997 O LEU A 60 4.106 27.181 -5.269 1.00 0.00 O ATOM 998 CB LEU A 60 6.045 25.035 -4.249 1.00 0.00 C ATOM 999 CG LEU A 60 7.139 23.964 -4.359 1.00 0.00 C ATOM 1000 CD1 LEU A 60 6.801 22.804 -3.422 1.00 0.00 C ATOM 1001 CD2 LEU A 60 7.239 23.443 -5.800 1.00 0.00 C ATOM 0 H LEU A 60 8.145 26.487 -4.499 1.00 0.00 H new ATOM 0 HA LEU A 60 5.960 25.662 -6.318 1.00 0.00 H new ATOM 0 HB2 LEU A 60 6.090 25.512 -3.270 1.00 0.00 H new ATOM 0 HB3 LEU A 60 5.062 24.571 -4.333 1.00 0.00 H new ATOM 0 HG LEU A 60 8.096 24.405 -4.079 1.00 0.00 H new ATOM 0 HD11 LEU A 60 7.575 22.040 -3.496 1.00 0.00 H new ATOM 0 HD12 LEU A 60 6.747 23.169 -2.396 1.00 0.00 H new ATOM 0 HD13 LEU A 60 5.840 22.376 -3.705 1.00 0.00 H new ATOM 0 HD21 LEU A 60 8.020 22.685 -5.859 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.285 23.006 -6.096 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.483 24.268 -6.469 1.00 0.00 H new ATOM 1013 N ASP A 61 5.824 28.377 -4.633 1.00 0.00 N ATOM 1014 CA ASP A 61 4.929 29.545 -4.380 1.00 0.00 C ATOM 1015 C ASP A 61 4.691 30.226 -5.715 1.00 0.00 C ATOM 1016 O ASP A 61 5.039 31.371 -5.925 1.00 0.00 O ATOM 1017 CB ASP A 61 5.560 30.534 -3.390 1.00 0.00 C ATOM 1018 CG ASP A 61 4.481 31.487 -2.867 1.00 0.00 C ATOM 1019 OD1 ASP A 61 3.390 31.471 -3.412 1.00 0.00 O ATOM 1020 OD2 ASP A 61 4.765 32.215 -1.931 1.00 0.00 O ATOM 0 H ASP A 61 6.815 28.528 -4.442 1.00 0.00 H new ATOM 0 HA ASP A 61 3.993 29.204 -3.937 1.00 0.00 H new ATOM 0 HB2 ASP A 61 6.017 29.994 -2.561 1.00 0.00 H new ATOM 0 HB3 ASP A 61 6.354 31.099 -3.879 1.00 0.00 H new ATOM 1025 N GLU A 62 4.114 29.506 -6.627 1.00 0.00 N ATOM 1026 CA GLU A 62 3.857 30.070 -7.974 1.00 0.00 C ATOM 1027 C GLU A 62 2.961 31.294 -7.826 1.00 0.00 C ATOM 1028 O GLU A 62 3.154 32.302 -8.475 1.00 0.00 O ATOM 1029 CB GLU A 62 3.149 29.015 -8.818 1.00 0.00 C ATOM 1030 CG GLU A 62 4.000 27.744 -8.853 1.00 0.00 C ATOM 1031 CD GLU A 62 3.349 26.717 -9.781 1.00 0.00 C ATOM 1032 OE1 GLU A 62 2.237 26.964 -10.218 1.00 0.00 O ATOM 1033 OE2 GLU A 62 3.971 25.699 -10.035 1.00 0.00 O ATOM 0 H GLU A 62 3.806 28.542 -6.496 1.00 0.00 H new ATOM 0 HA GLU A 62 4.792 30.356 -8.455 1.00 0.00 H new ATOM 0 HB2 GLU A 62 2.166 28.797 -8.400 1.00 0.00 H new ATOM 0 HB3 GLU A 62 2.990 29.388 -9.830 1.00 0.00 H new ATOM 0 HG2 GLU A 62 5.006 27.977 -9.201 1.00 0.00 H new ATOM 0 HG3 GLU A 62 4.098 27.332 -7.849 1.00 0.00 H new ATOM 1040 N ASP A 63 1.997 31.222 -6.956 1.00 0.00 N ATOM 1041 CA ASP A 63 1.107 32.391 -6.745 1.00 0.00 C ATOM 1042 C ASP A 63 1.921 33.480 -6.050 1.00 0.00 C ATOM 1043 O ASP A 63 1.570 34.643 -6.062 1.00 0.00 O ATOM 1044 CB ASP A 63 -0.072 31.992 -5.854 1.00 0.00 C ATOM 1045 CG ASP A 63 -0.922 30.943 -6.570 1.00 0.00 C ATOM 1046 OD1 ASP A 63 -1.160 31.108 -7.755 1.00 0.00 O ATOM 1047 OD2 ASP A 63 -1.318 29.989 -5.920 1.00 0.00 O ATOM 0 HA ASP A 63 0.720 32.748 -7.699 1.00 0.00 H new ATOM 0 HB2 ASP A 63 0.293 31.595 -4.907 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -0.677 32.868 -5.620 1.00 0.00 H new ATOM 1052 N GLY A 64 3.013 33.102 -5.437 1.00 0.00 N ATOM 1053 CA GLY A 64 3.859 34.108 -4.733 1.00 0.00 C ATOM 1054 C GLY A 64 3.038 34.752 -3.616 1.00 0.00 C ATOM 1055 O GLY A 64 3.213 35.912 -3.298 1.00 0.00 O ATOM 0 H GLY A 64 3.354 32.142 -5.394 1.00 0.00 H new ATOM 0 HA2 GLY A 64 4.748 33.630 -4.320 1.00 0.00 H new ATOM 0 HA3 GLY A 64 4.203 34.868 -5.434 1.00 0.00 H new ATOM 1059 N ASP A 65 2.133 34.007 -3.024 1.00 0.00 N ATOM 1060 CA ASP A 65 1.277 34.565 -1.929 1.00 0.00 C ATOM 1061 C ASP A 65 1.704 33.978 -0.584 1.00 0.00 C ATOM 1062 O ASP A 65 1.024 34.126 0.412 1.00 0.00 O ATOM 1063 CB ASP A 65 -0.187 34.221 -2.217 1.00 0.00 C ATOM 1064 CG ASP A 65 -0.319 32.725 -2.509 1.00 0.00 C ATOM 1065 OD1 ASP A 65 0.703 32.065 -2.601 1.00 0.00 O ATOM 1066 OD2 ASP A 65 -1.441 32.268 -2.647 1.00 0.00 O ATOM 0 H ASP A 65 1.950 33.030 -3.255 1.00 0.00 H new ATOM 0 HA ASP A 65 1.393 35.648 -1.886 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -0.808 34.491 -1.363 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -0.546 34.800 -3.068 1.00 0.00 H new ATOM 1071 N GLY A 66 2.826 33.314 -0.544 1.00 0.00 N ATOM 1072 CA GLY A 66 3.296 32.721 0.740 1.00 0.00 C ATOM 1073 C GLY A 66 2.551 31.411 1.003 1.00 0.00 C ATOM 1074 O GLY A 66 2.744 30.765 2.013 1.00 0.00 O ATOM 0 H GLY A 66 3.438 33.156 -1.345 1.00 0.00 H new ATOM 0 HA2 GLY A 66 4.370 32.538 0.696 1.00 0.00 H new ATOM 0 HA3 GLY A 66 3.125 33.419 1.559 1.00 0.00 H new ATOM 1078 N GLU A 67 1.705 31.017 0.092 1.00 0.00 N ATOM 1079 CA GLU A 67 0.939 29.748 0.253 1.00 0.00 C ATOM 1080 C GLU A 67 0.762 29.105 -1.124 1.00 0.00 C ATOM 1081 O GLU A 67 0.412 29.761 -2.085 1.00 0.00 O ATOM 1082 CB GLU A 67 -0.424 30.049 0.891 1.00 0.00 C ATOM 1083 CG GLU A 67 -1.143 31.149 0.115 1.00 0.00 C ATOM 1084 CD GLU A 67 -2.391 31.577 0.890 1.00 0.00 C ATOM 1085 OE1 GLU A 67 -2.751 30.879 1.825 1.00 0.00 O ATOM 1086 OE2 GLU A 67 -2.961 32.598 0.542 1.00 0.00 O ATOM 0 H GLU A 67 1.509 31.527 -0.769 1.00 0.00 H new ATOM 0 HA GLU A 67 1.477 29.059 0.904 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.034 29.146 0.904 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -0.288 30.356 1.928 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.480 32.002 -0.030 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.421 30.790 -0.876 1.00 0.00 H new ATOM 1093 N CYS A 68 1.008 27.822 -1.226 1.00 0.00 N ATOM 1094 CA CYS A 68 0.864 27.116 -2.543 1.00 0.00 C ATOM 1095 C CYS A 68 -0.471 26.375 -2.553 1.00 0.00 C ATOM 1096 O CYS A 68 -0.888 25.807 -1.564 1.00 0.00 O ATOM 1097 CB CYS A 68 2.039 26.120 -2.758 1.00 0.00 C ATOM 1098 SG CYS A 68 3.181 26.193 -1.355 1.00 0.00 S ATOM 0 H CYS A 68 1.304 27.228 -0.451 1.00 0.00 H new ATOM 0 HA CYS A 68 0.889 27.843 -3.355 1.00 0.00 H new ATOM 0 HB2 CYS A 68 1.652 25.107 -2.869 1.00 0.00 H new ATOM 0 HB3 CYS A 68 2.567 26.362 -3.680 1.00 0.00 H new ATOM 0 HG CYS A 68 2.577 25.778 -0.281 1.00 0.00 H new ATOM 1104 N ASP A 69 -1.137 26.373 -3.666 1.00 0.00 N ATOM 1105 CA ASP A 69 -2.439 25.668 -3.750 1.00 0.00 C ATOM 1106 C ASP A 69 -2.163 24.178 -3.897 1.00 0.00 C ATOM 1107 O ASP A 69 -1.081 23.784 -4.284 1.00 0.00 O ATOM 1108 CB ASP A 69 -3.211 26.166 -4.973 1.00 0.00 C ATOM 1109 CG ASP A 69 -3.553 27.646 -4.796 1.00 0.00 C ATOM 1110 OD1 ASP A 69 -3.512 28.112 -3.669 1.00 0.00 O ATOM 1111 OD2 ASP A 69 -3.850 28.288 -5.790 1.00 0.00 O ATOM 0 H ASP A 69 -0.835 26.831 -4.526 1.00 0.00 H new ATOM 0 HA ASP A 69 -3.031 25.858 -2.854 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -2.614 26.026 -5.874 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -4.124 25.584 -5.101 1.00 0.00 H new ATOM 1116 N PHE A 70 -3.124 23.340 -3.605 1.00 0.00 N ATOM 1117 CA PHE A 70 -2.905 21.884 -3.748 1.00 0.00 C ATOM 1118 C PHE A 70 -2.245 21.628 -5.105 1.00 0.00 C ATOM 1119 O PHE A 70 -1.405 20.779 -5.240 1.00 0.00 O ATOM 1120 CB PHE A 70 -4.265 21.182 -3.656 1.00 0.00 C ATOM 1121 CG PHE A 70 -4.170 19.761 -4.164 1.00 0.00 C ATOM 1122 CD1 PHE A 70 -3.205 18.895 -3.643 1.00 0.00 C ATOM 1123 CD2 PHE A 70 -5.051 19.311 -5.154 1.00 0.00 C ATOM 1124 CE1 PHE A 70 -3.119 17.582 -4.109 1.00 0.00 C ATOM 1125 CE2 PHE A 70 -4.966 17.999 -5.619 1.00 0.00 C ATOM 1126 CZ PHE A 70 -4.000 17.131 -5.098 1.00 0.00 C ATOM 0 H PHE A 70 -4.050 23.609 -3.274 1.00 0.00 H new ATOM 0 HA PHE A 70 -2.255 21.498 -2.963 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -4.610 21.181 -2.622 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -5.004 21.733 -4.238 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -2.525 19.242 -2.879 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -5.797 19.980 -5.558 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -2.372 16.914 -3.706 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -5.647 17.652 -6.382 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.935 16.115 -5.459 1.00 0.00 H new ATOM 1136 N GLN A 71 -2.612 22.388 -6.098 1.00 0.00 N ATOM 1137 CA GLN A 71 -2.001 22.226 -7.450 1.00 0.00 C ATOM 1138 C GLN A 71 -0.484 22.453 -7.395 1.00 0.00 C ATOM 1139 O GLN A 71 0.287 21.678 -7.923 1.00 0.00 O ATOM 1140 CB GLN A 71 -2.638 23.255 -8.399 1.00 0.00 C ATOM 1141 CG GLN A 71 -1.855 23.324 -9.718 1.00 0.00 C ATOM 1142 CD GLN A 71 -2.638 24.158 -10.735 1.00 0.00 C ATOM 1143 OE1 GLN A 71 -3.091 25.243 -10.429 1.00 0.00 O ATOM 1144 NE2 GLN A 71 -2.813 23.695 -11.943 1.00 0.00 N ATOM 0 H GLN A 71 -3.316 23.123 -6.032 1.00 0.00 H new ATOM 0 HA GLN A 71 -2.182 21.212 -7.806 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -3.675 22.983 -8.598 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -2.652 24.236 -7.925 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.874 23.767 -9.548 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -1.688 22.320 -10.107 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -2.433 22.784 -12.200 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -3.330 24.244 -12.630 1.00 0.00 H new ATOM 1153 N GLU A 72 -0.052 23.529 -6.803 1.00 0.00 N ATOM 1154 CA GLU A 72 1.409 23.822 -6.764 1.00 0.00 C ATOM 1155 C GLU A 72 2.167 22.701 -6.050 1.00 0.00 C ATOM 1156 O GLU A 72 3.245 22.298 -6.461 1.00 0.00 O ATOM 1157 CB GLU A 72 1.628 25.148 -6.034 1.00 0.00 C ATOM 1158 CG GLU A 72 1.110 26.296 -6.904 1.00 0.00 C ATOM 1159 CD GLU A 72 1.098 27.594 -6.095 1.00 0.00 C ATOM 1160 OE1 GLU A 72 2.133 28.233 -6.021 1.00 0.00 O ATOM 1161 OE2 GLU A 72 0.051 27.929 -5.566 1.00 0.00 O ATOM 0 H GLU A 72 -0.646 24.219 -6.344 1.00 0.00 H new ATOM 0 HA GLU A 72 1.788 23.891 -7.784 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.108 25.139 -5.076 1.00 0.00 H new ATOM 0 HB3 GLU A 72 2.688 25.288 -5.820 1.00 0.00 H new ATOM 0 HG2 GLU A 72 1.742 26.411 -7.784 1.00 0.00 H new ATOM 0 HG3 GLU A 72 0.105 26.070 -7.261 1.00 0.00 H new ATOM 1168 N PHE A 73 1.619 22.182 -4.993 1.00 0.00 N ATOM 1169 CA PHE A 73 2.321 21.090 -4.272 1.00 0.00 C ATOM 1170 C PHE A 73 2.303 19.828 -5.126 1.00 0.00 C ATOM 1171 O PHE A 73 3.206 19.024 -5.066 1.00 0.00 O ATOM 1172 CB PHE A 73 1.641 20.802 -2.928 1.00 0.00 C ATOM 1173 CG PHE A 73 2.260 19.556 -2.333 1.00 0.00 C ATOM 1174 CD1 PHE A 73 3.412 19.651 -1.546 1.00 0.00 C ATOM 1175 CD2 PHE A 73 1.690 18.305 -2.593 1.00 0.00 C ATOM 1176 CE1 PHE A 73 3.995 18.493 -1.019 1.00 0.00 C ATOM 1177 CE2 PHE A 73 2.269 17.147 -2.063 1.00 0.00 C ATOM 1178 CZ PHE A 73 3.423 17.240 -1.276 1.00 0.00 C ATOM 0 H PHE A 73 0.722 22.463 -4.598 1.00 0.00 H new ATOM 0 HA PHE A 73 3.349 21.401 -4.084 1.00 0.00 H new ATOM 0 HB2 PHE A 73 1.767 21.647 -2.251 1.00 0.00 H new ATOM 0 HB3 PHE A 73 0.569 20.662 -3.068 1.00 0.00 H new ATOM 0 HD1 PHE A 73 3.851 20.617 -1.345 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.802 18.233 -3.204 1.00 0.00 H new ATOM 0 HE1 PHE A 73 4.887 18.565 -0.414 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.826 16.182 -2.261 1.00 0.00 H new ATOM 0 HZ PHE A 73 3.872 16.347 -0.867 1.00 0.00 H new ATOM 1188 N MET A 74 1.276 19.645 -5.904 1.00 0.00 N ATOM 1189 CA MET A 74 1.182 18.426 -6.746 1.00 0.00 C ATOM 1190 C MET A 74 2.369 18.364 -7.698 1.00 0.00 C ATOM 1191 O MET A 74 2.897 17.305 -7.984 1.00 0.00 O ATOM 1192 CB MET A 74 -0.133 18.422 -7.544 1.00 0.00 C ATOM 1193 CG MET A 74 -1.301 17.954 -6.655 1.00 0.00 C ATOM 1194 SD MET A 74 -1.044 16.246 -6.098 1.00 0.00 S ATOM 1195 CE MET A 74 -1.004 15.465 -7.726 1.00 0.00 C ATOM 0 H MET A 74 0.493 20.293 -5.993 1.00 0.00 H new ATOM 0 HA MET A 74 1.196 17.550 -6.097 1.00 0.00 H new ATOM 0 HB2 MET A 74 -0.337 19.422 -7.926 1.00 0.00 H new ATOM 0 HB3 MET A 74 -0.039 17.764 -8.408 1.00 0.00 H new ATOM 0 HG2 MET A 74 -1.393 18.613 -5.791 1.00 0.00 H new ATOM 0 HG3 MET A 74 -2.237 18.023 -7.210 1.00 0.00 H new ATOM 0 HE1 MET A 74 -1.120 14.387 -7.615 1.00 0.00 H new ATOM 0 HE2 MET A 74 -1.817 15.857 -8.338 1.00 0.00 H new ATOM 0 HE3 MET A 74 -0.051 15.679 -8.209 1.00 0.00 H new ATOM 1205 N ALA A 75 2.785 19.475 -8.217 1.00 0.00 N ATOM 1206 CA ALA A 75 3.926 19.435 -9.163 1.00 0.00 C ATOM 1207 C ALA A 75 5.208 19.007 -8.443 1.00 0.00 C ATOM 1208 O ALA A 75 6.030 18.297 -8.991 1.00 0.00 O ATOM 1209 CB ALA A 75 4.113 20.815 -9.804 1.00 0.00 C ATOM 0 H ALA A 75 2.393 20.398 -8.032 1.00 0.00 H new ATOM 0 HA ALA A 75 3.712 18.704 -9.942 1.00 0.00 H new ATOM 0 HB1 ALA A 75 4.952 20.783 -10.499 1.00 0.00 H new ATOM 0 HB2 ALA A 75 3.207 21.092 -10.342 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.313 21.553 -9.027 1.00 0.00 H new ATOM 1215 N PHE A 76 5.391 19.435 -7.233 1.00 0.00 N ATOM 1216 CA PHE A 76 6.634 19.053 -6.489 1.00 0.00 C ATOM 1217 C PHE A 76 6.723 17.535 -6.350 1.00 0.00 C ATOM 1218 O PHE A 76 7.774 16.953 -6.457 1.00 0.00 O ATOM 1219 CB PHE A 76 6.598 19.694 -5.102 1.00 0.00 C ATOM 1220 CG PHE A 76 7.860 19.350 -4.346 1.00 0.00 C ATOM 1221 CD1 PHE A 76 9.087 19.877 -4.768 1.00 0.00 C ATOM 1222 CD2 PHE A 76 7.807 18.514 -3.223 1.00 0.00 C ATOM 1223 CE1 PHE A 76 10.260 19.567 -4.070 1.00 0.00 C ATOM 1224 CE2 PHE A 76 8.980 18.204 -2.525 1.00 0.00 C ATOM 1225 CZ PHE A 76 10.207 18.731 -2.949 1.00 0.00 C ATOM 0 H PHE A 76 4.742 20.031 -6.720 1.00 0.00 H new ATOM 0 HA PHE A 76 7.507 19.404 -7.040 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.502 20.776 -5.194 1.00 0.00 H new ATOM 0 HB3 PHE A 76 5.726 19.342 -4.551 1.00 0.00 H new ATOM 0 HD1 PHE A 76 9.128 20.523 -5.633 1.00 0.00 H new ATOM 0 HD2 PHE A 76 6.861 18.109 -2.896 1.00 0.00 H new ATOM 0 HE1 PHE A 76 11.206 19.973 -4.397 1.00 0.00 H new ATOM 0 HE2 PHE A 76 8.939 17.559 -1.660 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.112 18.492 -2.411 1.00 0.00 H new ATOM 1235 N VAL A 77 5.623 16.911 -6.095 1.00 0.00 N ATOM 1236 CA VAL A 77 5.590 15.423 -5.913 1.00 0.00 C ATOM 1237 C VAL A 77 6.079 14.727 -7.174 1.00 0.00 C ATOM 1238 O VAL A 77 6.707 13.697 -7.116 1.00 0.00 O ATOM 1239 CB VAL A 77 4.148 14.971 -5.605 1.00 0.00 C ATOM 1240 CG1 VAL A 77 4.142 13.776 -4.648 1.00 0.00 C ATOM 1241 CG2 VAL A 77 3.397 16.132 -4.976 1.00 0.00 C ATOM 0 H VAL A 77 4.716 17.368 -6.000 1.00 0.00 H new ATOM 0 HA VAL A 77 6.244 15.156 -5.083 1.00 0.00 H new ATOM 0 HB VAL A 77 3.665 14.665 -6.533 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.114 13.476 -4.447 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.680 12.944 -5.102 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.628 14.056 -3.713 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.375 15.826 -4.753 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.896 16.431 -4.054 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.381 16.973 -5.669 1.00 0.00 H new ATOM 1251 N SER A 78 5.768 15.258 -8.312 1.00 0.00 N ATOM 1252 CA SER A 78 6.204 14.595 -9.565 1.00 0.00 C ATOM 1253 C SER A 78 7.726 14.575 -9.626 1.00 0.00 C ATOM 1254 O SER A 78 8.324 13.608 -10.056 1.00 0.00 O ATOM 1255 CB SER A 78 5.658 15.354 -10.775 1.00 0.00 C ATOM 1256 OG SER A 78 6.498 15.115 -11.895 1.00 0.00 O ATOM 0 H SER A 78 5.233 16.118 -8.433 1.00 0.00 H new ATOM 0 HA SER A 78 5.822 13.574 -9.580 1.00 0.00 H new ATOM 0 HB2 SER A 78 4.640 15.030 -10.993 1.00 0.00 H new ATOM 0 HB3 SER A 78 5.614 16.422 -10.560 1.00 0.00 H new ATOM 0 HG SER A 78 6.988 15.934 -12.117 1.00 0.00 H new ATOM 1262 N MET A 79 8.363 15.636 -9.219 1.00 0.00 N ATOM 1263 CA MET A 79 9.850 15.655 -9.287 1.00 0.00 C ATOM 1264 C MET A 79 10.461 14.727 -8.240 1.00 0.00 C ATOM 1265 O MET A 79 11.380 13.984 -8.523 1.00 0.00 O ATOM 1266 CB MET A 79 10.373 17.062 -9.030 1.00 0.00 C ATOM 1267 CG MET A 79 9.831 18.041 -10.071 1.00 0.00 C ATOM 1268 SD MET A 79 10.903 19.503 -10.121 1.00 0.00 S ATOM 1269 CE MET A 79 11.060 19.764 -8.333 1.00 0.00 C ATOM 0 H MET A 79 7.927 16.480 -8.847 1.00 0.00 H new ATOM 0 HA MET A 79 10.133 15.319 -10.285 1.00 0.00 H new ATOM 0 HB2 MET A 79 10.080 17.387 -8.032 1.00 0.00 H new ATOM 0 HB3 MET A 79 11.463 17.061 -9.058 1.00 0.00 H new ATOM 0 HG2 MET A 79 9.796 17.566 -11.052 1.00 0.00 H new ATOM 0 HG3 MET A 79 8.811 18.331 -9.820 1.00 0.00 H new ATOM 0 HE1 MET A 79 11.355 20.795 -8.140 1.00 0.00 H new ATOM 0 HE2 MET A 79 10.103 19.564 -7.851 1.00 0.00 H new ATOM 0 HE3 MET A 79 11.816 19.089 -7.932 1.00 0.00 H new ATOM 1279 N VAL A 80 9.988 14.777 -7.028 1.00 0.00 N ATOM 1280 CA VAL A 80 10.594 13.903 -5.979 1.00 0.00 C ATOM 1281 C VAL A 80 10.415 12.440 -6.368 1.00 0.00 C ATOM 1282 O VAL A 80 11.279 11.613 -6.157 1.00 0.00 O ATOM 1283 CB VAL A 80 9.951 14.146 -4.613 1.00 0.00 C ATOM 1284 CG1 VAL A 80 10.735 13.368 -3.551 1.00 0.00 C ATOM 1285 CG2 VAL A 80 9.992 15.636 -4.275 1.00 0.00 C ATOM 0 H VAL A 80 9.221 15.373 -6.718 1.00 0.00 H new ATOM 0 HA VAL A 80 11.654 14.145 -5.907 1.00 0.00 H new ATOM 0 HB VAL A 80 8.914 13.813 -4.636 1.00 0.00 H new ATOM 0 HG11 VAL A 80 10.285 13.534 -2.572 1.00 0.00 H new ATOM 0 HG12 VAL A 80 10.709 12.304 -3.786 1.00 0.00 H new ATOM 0 HG13 VAL A 80 11.769 13.712 -3.538 1.00 0.00 H new ATOM 0 HG21 VAL A 80 9.532 15.801 -3.301 1.00 0.00 H new ATOM 0 HG22 VAL A 80 11.028 15.975 -4.249 1.00 0.00 H new ATOM 0 HG23 VAL A 80 9.445 16.196 -5.034 1.00 0.00 H new ATOM 1295 N THR A 81 9.294 12.123 -6.933 1.00 0.00 N ATOM 1296 CA THR A 81 9.028 10.723 -7.345 1.00 0.00 C ATOM 1297 C THR A 81 10.092 10.312 -8.351 1.00 0.00 C ATOM 1298 O THR A 81 10.581 9.201 -8.344 1.00 0.00 O ATOM 1299 CB THR A 81 7.648 10.626 -7.986 1.00 0.00 C ATOM 1300 OG1 THR A 81 6.664 11.038 -7.052 1.00 0.00 O ATOM 1301 CG2 THR A 81 7.380 9.179 -8.401 1.00 0.00 C ATOM 0 H THR A 81 8.540 12.781 -7.131 1.00 0.00 H new ATOM 0 HA THR A 81 9.056 10.065 -6.477 1.00 0.00 H new ATOM 0 HB THR A 81 7.609 11.270 -8.865 1.00 0.00 H new ATOM 0 HG1 THR A 81 6.481 11.993 -7.170 1.00 0.00 H new ATOM 0 HG21 THR A 81 6.394 9.109 -8.859 1.00 0.00 H new ATOM 0 HG22 THR A 81 8.137 8.860 -9.118 1.00 0.00 H new ATOM 0 HG23 THR A 81 7.418 8.535 -7.522 1.00 0.00 H new ATOM 1309 N THR A 82 10.456 11.207 -9.218 1.00 0.00 N ATOM 1310 CA THR A 82 11.490 10.879 -10.223 1.00 0.00 C ATOM 1311 C THR A 82 12.752 10.447 -9.471 1.00 0.00 C ATOM 1312 O THR A 82 13.433 9.511 -9.851 1.00 0.00 O ATOM 1313 CB THR A 82 11.770 12.121 -11.077 1.00 0.00 C ATOM 1314 OG1 THR A 82 10.540 12.629 -11.575 1.00 0.00 O ATOM 1315 CG2 THR A 82 12.662 11.737 -12.252 1.00 0.00 C ATOM 0 H THR A 82 10.080 12.154 -9.273 1.00 0.00 H new ATOM 0 HA THR A 82 11.160 10.075 -10.881 1.00 0.00 H new ATOM 0 HB THR A 82 12.268 12.878 -10.471 1.00 0.00 H new ATOM 0 HG1 THR A 82 10.033 13.036 -10.841 1.00 0.00 H new ATOM 0 HG21 THR A 82 12.862 12.619 -12.860 1.00 0.00 H new ATOM 0 HG22 THR A 82 13.603 11.333 -11.878 1.00 0.00 H new ATOM 0 HG23 THR A 82 12.160 10.984 -12.859 1.00 0.00 H new ATOM 1323 N ALA A 83 13.050 11.109 -8.386 1.00 0.00 N ATOM 1324 CA ALA A 83 14.245 10.733 -7.581 1.00 0.00 C ATOM 1325 C ALA A 83 14.086 9.282 -7.104 1.00 0.00 C ATOM 1326 O ALA A 83 15.028 8.517 -7.083 1.00 0.00 O ATOM 1327 CB ALA A 83 14.350 11.679 -6.366 1.00 0.00 C ATOM 0 H ALA A 83 12.514 11.897 -8.022 1.00 0.00 H new ATOM 0 HA ALA A 83 15.150 10.819 -8.183 1.00 0.00 H new ATOM 0 HB1 ALA A 83 15.223 11.411 -5.770 1.00 0.00 H new ATOM 0 HB2 ALA A 83 14.450 12.707 -6.713 1.00 0.00 H new ATOM 0 HB3 ALA A 83 13.452 11.588 -5.755 1.00 0.00 H new ATOM 1333 N CYS A 84 12.895 8.908 -6.714 1.00 0.00 N ATOM 1334 CA CYS A 84 12.662 7.519 -6.220 1.00 0.00 C ATOM 1335 C CYS A 84 13.040 6.512 -7.304 1.00 0.00 C ATOM 1336 O CYS A 84 13.535 5.442 -7.018 1.00 0.00 O ATOM 1337 CB CYS A 84 11.185 7.340 -5.862 1.00 0.00 C ATOM 1338 SG CYS A 84 10.729 8.528 -4.577 1.00 0.00 S ATOM 0 H CYS A 84 12.070 9.508 -6.717 1.00 0.00 H new ATOM 0 HA CYS A 84 13.277 7.350 -5.336 1.00 0.00 H new ATOM 0 HB2 CYS A 84 10.565 7.488 -6.746 1.00 0.00 H new ATOM 0 HB3 CYS A 84 11.005 6.323 -5.513 1.00 0.00 H new ATOM 0 HG CYS A 84 10.887 9.737 -5.028 1.00 0.00 H new ATOM 1344 N HIS A 85 12.820 6.840 -8.546 1.00 0.00 N ATOM 1345 CA HIS A 85 13.177 5.882 -9.625 1.00 0.00 C ATOM 1346 C HIS A 85 14.673 5.606 -9.552 1.00 0.00 C ATOM 1347 O HIS A 85 15.113 4.488 -9.717 1.00 0.00 O ATOM 1348 CB HIS A 85 12.838 6.491 -10.988 1.00 0.00 C ATOM 1349 CG HIS A 85 13.259 5.547 -12.081 1.00 0.00 C ATOM 1350 ND1 HIS A 85 13.938 5.984 -13.210 1.00 0.00 N ATOM 1351 CD2 HIS A 85 13.119 4.188 -12.230 1.00 0.00 C ATOM 1352 CE1 HIS A 85 14.180 4.908 -13.981 1.00 0.00 C ATOM 1353 NE2 HIS A 85 13.702 3.792 -13.429 1.00 0.00 N ATOM 0 H HIS A 85 12.412 7.722 -8.858 1.00 0.00 H new ATOM 0 HA HIS A 85 12.617 4.955 -9.500 1.00 0.00 H new ATOM 0 HB2 HIS A 85 11.768 6.686 -11.054 1.00 0.00 H new ATOM 0 HB3 HIS A 85 13.345 7.449 -11.106 1.00 0.00 H new ATOM 0 HD2 HIS A 85 12.632 3.530 -11.526 1.00 0.00 H new ATOM 0 HE1 HIS A 85 14.697 4.944 -14.929 1.00 0.00 H new ATOM 0 HE2 HIS A 85 13.753 2.846 -13.807 1.00 0.00 H new ATOM 1362 N GLU A 86 15.457 6.611 -9.292 1.00 0.00 N ATOM 1363 CA GLU A 86 16.926 6.393 -9.195 1.00 0.00 C ATOM 1364 C GLU A 86 17.228 5.426 -8.044 1.00 0.00 C ATOM 1365 O GLU A 86 18.087 4.572 -8.148 1.00 0.00 O ATOM 1366 CB GLU A 86 17.619 7.731 -8.932 1.00 0.00 C ATOM 1367 CG GLU A 86 17.462 8.635 -10.156 1.00 0.00 C ATOM 1368 CD GLU A 86 18.292 8.081 -11.315 1.00 0.00 C ATOM 1369 OE1 GLU A 86 19.375 7.582 -11.057 1.00 0.00 O ATOM 1370 OE2 GLU A 86 17.832 8.167 -12.441 1.00 0.00 O ATOM 0 H GLU A 86 15.147 7.571 -9.143 1.00 0.00 H new ATOM 0 HA GLU A 86 17.293 5.968 -10.129 1.00 0.00 H new ATOM 0 HB2 GLU A 86 17.186 8.211 -8.054 1.00 0.00 H new ATOM 0 HB3 GLU A 86 18.676 7.570 -8.719 1.00 0.00 H new ATOM 0 HG2 GLU A 86 16.412 8.695 -10.444 1.00 0.00 H new ATOM 0 HG3 GLU A 86 17.785 9.648 -9.916 1.00 0.00 H new ATOM 1377 N PHE A 87 16.534 5.558 -6.942 1.00 0.00 N ATOM 1378 CA PHE A 87 16.790 4.650 -5.778 1.00 0.00 C ATOM 1379 C PHE A 87 16.013 3.339 -5.944 1.00 0.00 C ATOM 1380 O PHE A 87 16.440 2.293 -5.498 1.00 0.00 O ATOM 1381 CB PHE A 87 16.351 5.338 -4.480 1.00 0.00 C ATOM 1382 CG PHE A 87 17.288 6.480 -4.168 1.00 0.00 C ATOM 1383 CD1 PHE A 87 18.498 6.235 -3.509 1.00 0.00 C ATOM 1384 CD2 PHE A 87 16.949 7.785 -4.544 1.00 0.00 C ATOM 1385 CE1 PHE A 87 19.368 7.295 -3.224 1.00 0.00 C ATOM 1386 CE2 PHE A 87 17.818 8.844 -4.260 1.00 0.00 C ATOM 1387 CZ PHE A 87 19.027 8.600 -3.600 1.00 0.00 C ATOM 0 H PHE A 87 15.802 6.253 -6.796 1.00 0.00 H new ATOM 0 HA PHE A 87 17.857 4.429 -5.735 1.00 0.00 H new ATOM 0 HB2 PHE A 87 15.331 5.709 -4.581 1.00 0.00 H new ATOM 0 HB3 PHE A 87 16.350 4.621 -3.659 1.00 0.00 H new ATOM 0 HD1 PHE A 87 18.761 5.228 -3.220 1.00 0.00 H new ATOM 0 HD2 PHE A 87 16.016 7.975 -5.054 1.00 0.00 H new ATOM 0 HE1 PHE A 87 20.301 7.106 -2.715 1.00 0.00 H new ATOM 0 HE2 PHE A 87 17.555 9.850 -4.550 1.00 0.00 H new ATOM 0 HZ PHE A 87 19.697 9.418 -3.381 1.00 0.00 H new ATOM 1397 N PHE A 88 14.871 3.389 -6.575 1.00 0.00 N ATOM 1398 CA PHE A 88 14.052 2.152 -6.768 1.00 0.00 C ATOM 1399 C PHE A 88 14.396 1.548 -8.124 1.00 0.00 C ATOM 1400 O PHE A 88 13.751 0.631 -8.594 1.00 0.00 O ATOM 1401 CB PHE A 88 12.558 2.508 -6.722 1.00 0.00 C ATOM 1402 CG PHE A 88 12.125 2.704 -5.283 1.00 0.00 C ATOM 1403 CD1 PHE A 88 12.744 3.682 -4.497 1.00 0.00 C ATOM 1404 CD2 PHE A 88 11.118 1.899 -4.731 1.00 0.00 C ATOM 1405 CE1 PHE A 88 12.358 3.858 -3.162 1.00 0.00 C ATOM 1406 CE2 PHE A 88 10.734 2.074 -3.396 1.00 0.00 C ATOM 1407 CZ PHE A 88 11.354 3.054 -2.612 1.00 0.00 C ATOM 0 H PHE A 88 14.466 4.238 -6.969 1.00 0.00 H new ATOM 0 HA PHE A 88 14.268 1.435 -5.976 1.00 0.00 H new ATOM 0 HB2 PHE A 88 12.373 3.417 -7.295 1.00 0.00 H new ATOM 0 HB3 PHE A 88 11.971 1.715 -7.184 1.00 0.00 H new ATOM 0 HD1 PHE A 88 13.520 4.302 -4.920 1.00 0.00 H new ATOM 0 HD2 PHE A 88 10.638 1.144 -5.336 1.00 0.00 H new ATOM 0 HE1 PHE A 88 12.836 4.615 -2.557 1.00 0.00 H new ATOM 0 HE2 PHE A 88 9.959 1.453 -2.971 1.00 0.00 H new ATOM 0 HZ PHE A 88 11.057 3.189 -1.582 1.00 0.00 H new ATOM 1417 N GLU A 89 15.405 2.069 -8.760 1.00 0.00 N ATOM 1418 CA GLU A 89 15.792 1.542 -10.097 1.00 0.00 C ATOM 1419 C GLU A 89 16.057 0.044 -9.999 1.00 0.00 C ATOM 1420 O GLU A 89 17.124 -0.390 -9.610 1.00 0.00 O ATOM 1421 CB GLU A 89 17.065 2.232 -10.591 1.00 0.00 C ATOM 1422 CG GLU A 89 17.344 1.805 -12.033 1.00 0.00 C ATOM 1423 CD GLU A 89 18.590 2.528 -12.548 1.00 0.00 C ATOM 1424 OE1 GLU A 89 19.166 3.287 -11.786 1.00 0.00 O ATOM 1425 OE2 GLU A 89 18.950 2.306 -13.692 1.00 0.00 O ATOM 0 H GLU A 89 15.979 2.837 -8.413 1.00 0.00 H new ATOM 0 HA GLU A 89 14.978 1.736 -10.795 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.951 3.315 -10.536 1.00 0.00 H new ATOM 0 HB3 GLU A 89 17.907 1.968 -9.952 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.491 0.726 -12.082 1.00 0.00 H new ATOM 0 HG3 GLU A 89 16.487 2.039 -12.665 1.00 0.00 H new ATOM 1432 N HIS A 90 15.095 -0.745 -10.366 1.00 0.00 N ATOM 1433 CA HIS A 90 15.273 -2.219 -10.322 1.00 0.00 C ATOM 1434 C HIS A 90 16.440 -2.601 -11.232 1.00 0.00 C ATOM 1435 O HIS A 90 17.208 -3.492 -10.932 1.00 0.00 O ATOM 1436 CB HIS A 90 13.985 -2.894 -10.788 1.00 0.00 C ATOM 1437 CG HIS A 90 12.921 -2.658 -9.754 1.00 0.00 C ATOM 1438 ND1 HIS A 90 11.663 -2.171 -10.080 1.00 0.00 N ATOM 1439 CD2 HIS A 90 12.922 -2.811 -8.389 1.00 0.00 C ATOM 1440 CE1 HIS A 90 10.966 -2.047 -8.934 1.00 0.00 C ATOM 1441 NE2 HIS A 90 11.689 -2.424 -7.878 1.00 0.00 N ATOM 0 H HIS A 90 14.183 -0.431 -10.698 1.00 0.00 H new ATOM 0 HA HIS A 90 15.491 -2.547 -9.306 1.00 0.00 H new ATOM 0 HB2 HIS A 90 13.673 -2.490 -11.751 1.00 0.00 H new ATOM 0 HB3 HIS A 90 14.147 -3.963 -10.928 1.00 0.00 H new ATOM 0 HD2 HIS A 90 13.753 -3.176 -7.803 1.00 0.00 H new ATOM 0 HE1 HIS A 90 9.949 -1.687 -8.877 1.00 0.00 H new ATOM 0 HE2 HIS A 90 11.398 -2.427 -6.900 1.00 0.00 H new ATOM 1450 N GLU A 91 16.568 -1.924 -12.344 1.00 0.00 N ATOM 1451 CA GLU A 91 17.679 -2.214 -13.299 1.00 0.00 C ATOM 1452 CB GLU A 91 19.030 -2.050 -12.590 1.00 0.00 C ATOM 1453 CG GLU A 91 20.158 -2.033 -13.625 1.00 0.00 C ATOM 1454 CD GLU A 91 21.480 -1.705 -12.928 1.00 0.00 C ATOM 1455 OE1 GLU A 91 22.142 -2.630 -12.490 1.00 0.00 O ATOM 1456 OE2 GLU A 91 21.805 -0.532 -12.841 1.00 0.00 O ATOM 0 H GLU A 91 15.942 -1.173 -12.634 1.00 0.00 H new ATOM 0 HB2 GLU A 91 19.039 -1.125 -12.013 1.00 0.00 H new ATOM 0 HB3 GLU A 91 19.183 -2.867 -11.885 1.00 0.00 H new ATOM 0 HG2 GLU A 91 20.226 -3.001 -14.121 1.00 0.00 H new ATOM 0 HG3 GLU A 91 19.947 -1.293 -14.397 1.00 0.00 H new TER 1463 GLU A 91 ATOM 1464 N MET B 0 -2.575 7.949 4.695 1.00 0.00 N ATOM 1465 CA MET B 0 -1.774 8.043 5.948 1.00 0.00 C ATOM 1466 C MET B 0 -0.290 7.843 5.619 1.00 0.00 C ATOM 1467 O MET B 0 0.259 6.775 5.804 1.00 0.00 O ATOM 1468 CB MET B 0 -2.240 6.963 6.929 1.00 0.00 C ATOM 1469 CG MET B 0 -3.662 7.284 7.399 1.00 0.00 C ATOM 1470 SD MET B 0 -4.222 6.011 8.559 1.00 0.00 S ATOM 1471 CE MET B 0 -5.865 6.702 8.878 1.00 0.00 C ATOM 0 H1 MET B 0 -3.505 8.390 4.844 1.00 0.00 H new ATOM 0 H2 MET B 0 -2.077 8.442 3.927 1.00 0.00 H new ATOM 0 H3 MET B 0 -2.703 6.949 4.439 1.00 0.00 H new ATOM 0 HA MET B 0 -1.912 9.025 6.401 1.00 0.00 H new ATOM 0 HB2 MET B 0 -2.216 5.985 6.449 1.00 0.00 H new ATOM 0 HB3 MET B 0 -1.565 6.916 7.783 1.00 0.00 H new ATOM 0 HG2 MET B 0 -3.685 8.262 7.879 1.00 0.00 H new ATOM 0 HG3 MET B 0 -4.336 7.333 6.544 1.00 0.00 H new ATOM 0 HE1 MET B 0 -6.398 6.063 9.583 1.00 0.00 H new ATOM 0 HE2 MET B 0 -5.764 7.702 9.300 1.00 0.00 H new ATOM 0 HE3 MET B 0 -6.424 6.757 7.944 1.00 0.00 H new ATOM 1483 N SER B 1 0.360 8.866 5.126 1.00 0.00 N ATOM 1484 CA SER B 1 1.809 8.741 4.774 1.00 0.00 C ATOM 1485 C SER B 1 1.986 7.663 3.703 1.00 0.00 C ATOM 1486 O SER B 1 3.020 7.035 3.595 1.00 0.00 O ATOM 1487 CB SER B 1 2.615 8.362 6.020 1.00 0.00 C ATOM 1488 OG SER B 1 3.981 8.701 5.813 1.00 0.00 O ATOM 0 H SER B 1 -0.049 9.784 4.951 1.00 0.00 H new ATOM 0 HA SER B 1 2.168 9.696 4.391 1.00 0.00 H new ATOM 0 HB2 SER B 1 2.226 8.886 6.893 1.00 0.00 H new ATOM 0 HB3 SER B 1 2.519 7.295 6.220 1.00 0.00 H new ATOM 0 HG SER B 1 4.294 8.300 4.976 1.00 0.00 H new ATOM 1494 N GLU B 2 0.982 7.461 2.905 1.00 0.00 N ATOM 1495 CA GLU B 2 1.062 6.444 1.824 1.00 0.00 C ATOM 1496 C GLU B 2 1.936 6.979 0.701 1.00 0.00 C ATOM 1497 O GLU B 2 2.281 6.273 -0.215 1.00 0.00 O ATOM 1498 CB GLU B 2 -0.342 6.182 1.296 1.00 0.00 C ATOM 1499 CG GLU B 2 -1.130 5.447 2.373 1.00 0.00 C ATOM 1500 CD GLU B 2 -2.580 5.267 1.923 1.00 0.00 C ATOM 1501 OE1 GLU B 2 -3.352 6.197 2.093 1.00 0.00 O ATOM 1502 OE2 GLU B 2 -2.896 4.202 1.418 1.00 0.00 O ATOM 0 H GLU B 2 0.096 7.964 2.955 1.00 0.00 H new ATOM 0 HA GLU B 2 1.491 5.519 2.208 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -0.833 7.121 1.041 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -0.299 5.587 0.384 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -0.677 4.475 2.568 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -1.097 6.008 3.307 1.00 0.00 H new ATOM 1509 N LEU B 3 2.277 8.231 0.760 1.00 0.00 N ATOM 1510 CA LEU B 3 3.107 8.838 -0.317 1.00 0.00 C ATOM 1511 C LEU B 3 4.239 7.892 -0.719 1.00 0.00 C ATOM 1512 O LEU B 3 4.739 7.948 -1.821 1.00 0.00 O ATOM 1513 CB LEU B 3 3.702 10.159 0.190 1.00 0.00 C ATOM 1514 CG LEU B 3 4.291 10.969 -0.981 1.00 0.00 C ATOM 1515 CD1 LEU B 3 3.182 11.763 -1.689 1.00 0.00 C ATOM 1516 CD2 LEU B 3 5.362 11.941 -0.456 1.00 0.00 C ATOM 0 H LEU B 3 2.016 8.867 1.513 1.00 0.00 H new ATOM 0 HA LEU B 3 2.478 9.021 -1.188 1.00 0.00 H new ATOM 0 HB2 LEU B 3 2.931 10.743 0.693 1.00 0.00 H new ATOM 0 HB3 LEU B 3 4.479 9.956 0.927 1.00 0.00 H new ATOM 0 HG LEU B 3 4.744 10.278 -1.692 1.00 0.00 H new ATOM 0 HD11 LEU B 3 3.611 12.331 -2.514 1.00 0.00 H new ATOM 0 HD12 LEU B 3 2.431 11.074 -2.075 1.00 0.00 H new ATOM 0 HD13 LEU B 3 2.716 12.448 -0.981 1.00 0.00 H new ATOM 0 HD21 LEU B 3 5.775 12.511 -1.288 1.00 0.00 H new ATOM 0 HD22 LEU B 3 4.912 12.624 0.264 1.00 0.00 H new ATOM 0 HD23 LEU B 3 6.159 11.377 0.029 1.00 0.00 H new ATOM 1528 N GLU B 4 4.644 7.019 0.152 1.00 0.00 N ATOM 1529 CA GLU B 4 5.737 6.075 -0.220 1.00 0.00 C ATOM 1530 C GLU B 4 5.213 5.040 -1.216 1.00 0.00 C ATOM 1531 O GLU B 4 5.918 4.623 -2.112 1.00 0.00 O ATOM 1532 CB GLU B 4 6.268 5.378 1.035 1.00 0.00 C ATOM 1533 CG GLU B 4 5.120 4.666 1.750 1.00 0.00 C ATOM 1534 CD GLU B 4 5.645 3.999 3.022 1.00 0.00 C ATOM 1535 OE1 GLU B 4 6.849 3.830 3.126 1.00 0.00 O ATOM 1536 OE2 GLU B 4 4.834 3.672 3.873 1.00 0.00 O ATOM 0 H GLU B 4 4.274 6.914 1.097 1.00 0.00 H new ATOM 0 HA GLU B 4 6.550 6.632 -0.686 1.00 0.00 H new ATOM 0 HB2 GLU B 4 7.042 4.660 0.765 1.00 0.00 H new ATOM 0 HB3 GLU B 4 6.728 6.108 1.701 1.00 0.00 H new ATOM 0 HG2 GLU B 4 4.334 5.380 1.999 1.00 0.00 H new ATOM 0 HG3 GLU B 4 4.676 3.919 1.092 1.00 0.00 H new ATOM 1543 N LYS B 5 3.987 4.612 -1.071 1.00 0.00 N ATOM 1544 CA LYS B 5 3.443 3.596 -2.019 1.00 0.00 C ATOM 1545 C LYS B 5 2.944 4.275 -3.299 1.00 0.00 C ATOM 1546 O LYS B 5 2.974 3.695 -4.363 1.00 0.00 O ATOM 1547 CB LYS B 5 2.298 2.813 -1.361 1.00 0.00 C ATOM 1548 CG LYS B 5 1.245 3.772 -0.774 1.00 0.00 C ATOM 1549 CD LYS B 5 -0.134 3.063 -0.654 1.00 0.00 C ATOM 1550 CE LYS B 5 -1.073 3.556 -1.764 1.00 0.00 C ATOM 1551 NZ LYS B 5 -2.274 2.675 -1.826 1.00 0.00 N ATOM 0 H LYS B 5 3.343 4.919 -0.343 1.00 0.00 H new ATOM 0 HA LYS B 5 4.242 2.902 -2.278 1.00 0.00 H new ATOM 0 HB2 LYS B 5 1.830 2.158 -2.096 1.00 0.00 H new ATOM 0 HB3 LYS B 5 2.695 2.174 -0.572 1.00 0.00 H new ATOM 0 HG2 LYS B 5 1.568 4.119 0.207 1.00 0.00 H new ATOM 0 HG3 LYS B 5 1.153 4.653 -1.409 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -0.005 1.983 -0.728 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -0.573 3.266 0.323 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -1.374 4.586 -1.570 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -0.555 3.550 -2.723 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -2.911 3.008 -2.578 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -1.978 1.699 -2.030 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -2.772 2.702 -0.913 1.00 0.00 H new ATOM 1565 N ALA B 6 2.471 5.488 -3.209 1.00 0.00 N ATOM 1566 CA ALA B 6 1.965 6.182 -4.424 1.00 0.00 C ATOM 1567 C ALA B 6 3.125 6.550 -5.340 1.00 0.00 C ATOM 1568 O ALA B 6 3.031 6.439 -6.542 1.00 0.00 O ATOM 1569 CB ALA B 6 1.207 7.448 -4.020 1.00 0.00 C ATOM 0 H ALA B 6 2.414 6.028 -2.345 1.00 0.00 H new ATOM 0 HA ALA B 6 1.291 5.512 -4.957 1.00 0.00 H new ATOM 0 HB1 ALA B 6 0.839 7.952 -4.913 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.365 7.180 -3.382 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.876 8.115 -3.477 1.00 0.00 H new ATOM 1575 N MET B 7 4.216 6.988 -4.787 1.00 0.00 N ATOM 1576 CA MET B 7 5.378 7.356 -5.639 1.00 0.00 C ATOM 1577 C MET B 7 5.933 6.109 -6.308 1.00 0.00 C ATOM 1578 O MET B 7 6.321 6.124 -7.459 1.00 0.00 O ATOM 1579 CB MET B 7 6.473 7.996 -4.783 1.00 0.00 C ATOM 1580 CG MET B 7 6.022 9.375 -4.308 1.00 0.00 C ATOM 1581 SD MET B 7 7.334 10.118 -3.302 1.00 0.00 S ATOM 1582 CE MET B 7 6.862 11.851 -3.533 1.00 0.00 C ATOM 0 H MET B 7 4.355 7.108 -3.784 1.00 0.00 H new ATOM 0 HA MET B 7 5.050 8.067 -6.397 1.00 0.00 H new ATOM 0 HB2 MET B 7 6.694 7.361 -3.925 1.00 0.00 H new ATOM 0 HB3 MET B 7 7.393 8.084 -5.360 1.00 0.00 H new ATOM 0 HG2 MET B 7 5.798 10.012 -5.164 1.00 0.00 H new ATOM 0 HG3 MET B 7 5.105 9.290 -3.725 1.00 0.00 H new ATOM 0 HE1 MET B 7 7.411 12.475 -2.827 1.00 0.00 H new ATOM 0 HE2 MET B 7 7.099 12.160 -4.551 1.00 0.00 H new ATOM 0 HE3 MET B 7 5.792 11.963 -3.360 1.00 0.00 H new ATOM 1592 N VAL B 8 5.984 5.032 -5.590 1.00 0.00 N ATOM 1593 CA VAL B 8 6.526 3.779 -6.172 1.00 0.00 C ATOM 1594 C VAL B 8 5.620 3.291 -7.309 1.00 0.00 C ATOM 1595 O VAL B 8 6.085 2.777 -8.304 1.00 0.00 O ATOM 1596 CB VAL B 8 6.626 2.710 -5.079 1.00 0.00 C ATOM 1597 CG1 VAL B 8 6.951 1.350 -5.707 1.00 0.00 C ATOM 1598 CG2 VAL B 8 7.742 3.096 -4.106 1.00 0.00 C ATOM 0 H VAL B 8 5.673 4.962 -4.621 1.00 0.00 H new ATOM 0 HA VAL B 8 7.519 3.970 -6.578 1.00 0.00 H new ATOM 0 HB VAL B 8 5.675 2.642 -4.550 1.00 0.00 H new ATOM 0 HG11 VAL B 8 7.021 0.595 -4.924 1.00 0.00 H new ATOM 0 HG12 VAL B 8 6.162 1.075 -6.407 1.00 0.00 H new ATOM 0 HG13 VAL B 8 7.902 1.412 -6.237 1.00 0.00 H new ATOM 0 HG21 VAL B 8 7.821 2.341 -3.324 1.00 0.00 H new ATOM 0 HG22 VAL B 8 8.688 3.161 -4.644 1.00 0.00 H new ATOM 0 HG23 VAL B 8 7.514 4.062 -3.655 1.00 0.00 H new ATOM 1608 N ALA B 9 4.330 3.422 -7.156 1.00 0.00 N ATOM 1609 CA ALA B 9 3.397 2.935 -8.221 1.00 0.00 C ATOM 1610 C ALA B 9 3.494 3.814 -9.463 1.00 0.00 C ATOM 1611 O ALA B 9 3.401 3.346 -10.579 1.00 0.00 O ATOM 1612 CB ALA B 9 1.965 2.960 -7.705 1.00 0.00 C ATOM 0 H ALA B 9 3.880 3.843 -6.343 1.00 0.00 H new ATOM 0 HA ALA B 9 3.679 1.915 -8.483 1.00 0.00 H new ATOM 0 HB1 ALA B 9 1.291 2.605 -8.485 1.00 0.00 H new ATOM 0 HB2 ALA B 9 1.882 2.314 -6.831 1.00 0.00 H new ATOM 0 HB3 ALA B 9 1.695 3.980 -7.429 1.00 0.00 H new ATOM 1618 N LEU B 10 3.663 5.086 -9.274 1.00 0.00 N ATOM 1619 CA LEU B 10 3.748 6.012 -10.431 1.00 0.00 C ATOM 1620 C LEU B 10 4.916 5.560 -11.311 1.00 0.00 C ATOM 1621 O LEU B 10 4.846 5.564 -12.523 1.00 0.00 O ATOM 1622 CB LEU B 10 3.999 7.431 -9.884 1.00 0.00 C ATOM 1623 CG LEU B 10 3.367 8.499 -10.790 1.00 0.00 C ATOM 1624 CD1 LEU B 10 3.850 8.304 -12.234 1.00 0.00 C ATOM 1625 CD2 LEU B 10 1.822 8.422 -10.723 1.00 0.00 C ATOM 0 H LEU B 10 3.747 5.530 -8.359 1.00 0.00 H new ATOM 0 HA LEU B 10 2.832 6.010 -11.021 1.00 0.00 H new ATOM 0 HB2 LEU B 10 3.586 7.514 -8.879 1.00 0.00 H new ATOM 0 HB3 LEU B 10 5.072 7.608 -9.804 1.00 0.00 H new ATOM 0 HG LEU B 10 3.674 9.485 -10.442 1.00 0.00 H new ATOM 0 HD11 LEU B 10 3.400 9.063 -12.874 1.00 0.00 H new ATOM 0 HD12 LEU B 10 4.935 8.396 -12.270 1.00 0.00 H new ATOM 0 HD13 LEU B 10 3.558 7.314 -12.585 1.00 0.00 H new ATOM 0 HD21 LEU B 10 1.391 9.186 -11.371 1.00 0.00 H new ATOM 0 HD22 LEU B 10 1.492 7.437 -11.054 1.00 0.00 H new ATOM 0 HD23 LEU B 10 1.494 8.589 -9.697 1.00 0.00 H new ATOM 1637 N ILE B 11 5.982 5.163 -10.686 1.00 0.00 N ATOM 1638 CA ILE B 11 7.176 4.690 -11.431 1.00 0.00 C ATOM 1639 C ILE B 11 6.902 3.336 -12.110 1.00 0.00 C ATOM 1640 O ILE B 11 7.351 3.090 -13.212 1.00 0.00 O ATOM 1641 CB ILE B 11 8.346 4.568 -10.446 1.00 0.00 C ATOM 1642 CG1 ILE B 11 8.789 5.977 -10.027 1.00 0.00 C ATOM 1643 CG2 ILE B 11 9.514 3.822 -11.092 1.00 0.00 C ATOM 1644 CD1 ILE B 11 9.785 5.908 -8.861 1.00 0.00 C ATOM 0 H ILE B 11 6.079 5.146 -9.671 1.00 0.00 H new ATOM 0 HA ILE B 11 7.421 5.405 -12.216 1.00 0.00 H new ATOM 0 HB ILE B 11 8.025 4.004 -9.570 1.00 0.00 H new ATOM 0 HG12 ILE B 11 9.248 6.486 -10.874 1.00 0.00 H new ATOM 0 HG13 ILE B 11 7.919 6.565 -9.735 1.00 0.00 H new ATOM 0 HG21 ILE B 11 10.335 3.745 -10.379 1.00 0.00 H new ATOM 0 HG22 ILE B 11 9.191 2.823 -11.383 1.00 0.00 H new ATOM 0 HG23 ILE B 11 9.850 4.366 -11.975 1.00 0.00 H new ATOM 0 HD11 ILE B 11 10.086 6.917 -8.580 1.00 0.00 H new ATOM 0 HD12 ILE B 11 9.314 5.419 -8.008 1.00 0.00 H new ATOM 0 HD13 ILE B 11 10.663 5.339 -9.166 1.00 0.00 H new ATOM 1656 N ASP B 12 6.210 2.443 -11.453 1.00 0.00 N ATOM 1657 CA ASP B 12 5.961 1.096 -12.057 1.00 0.00 C ATOM 1658 C ASP B 12 5.196 1.195 -13.381 1.00 0.00 C ATOM 1659 O ASP B 12 5.516 0.527 -14.344 1.00 0.00 O ATOM 1660 CB ASP B 12 5.119 0.260 -11.095 1.00 0.00 C ATOM 1661 CG ASP B 12 5.071 -1.187 -11.589 1.00 0.00 C ATOM 1662 OD1 ASP B 12 5.414 -1.411 -12.738 1.00 0.00 O ATOM 1663 OD2 ASP B 12 4.691 -2.046 -10.810 1.00 0.00 O ATOM 0 H ASP B 12 5.807 2.585 -10.527 1.00 0.00 H new ATOM 0 HA ASP B 12 6.932 0.638 -12.243 1.00 0.00 H new ATOM 0 HB2 ASP B 12 5.545 0.300 -10.092 1.00 0.00 H new ATOM 0 HB3 ASP B 12 4.110 0.667 -11.029 1.00 0.00 H new ATOM 1668 N VAL B 13 4.159 1.977 -13.419 1.00 0.00 N ATOM 1669 CA VAL B 13 3.331 2.070 -14.657 1.00 0.00 C ATOM 1670 C VAL B 13 4.115 2.735 -15.803 1.00 0.00 C ATOM 1671 O VAL B 13 4.023 2.331 -16.953 1.00 0.00 O ATOM 1672 CB VAL B 13 2.035 2.854 -14.306 1.00 0.00 C ATOM 1673 CG1 VAL B 13 2.084 4.306 -14.809 1.00 0.00 C ATOM 1674 CG2 VAL B 13 0.818 2.151 -14.911 1.00 0.00 C ATOM 0 H VAL B 13 3.844 2.561 -12.644 1.00 0.00 H new ATOM 0 HA VAL B 13 3.068 1.073 -15.012 1.00 0.00 H new ATOM 0 HB VAL B 13 1.955 2.876 -13.219 1.00 0.00 H new ATOM 0 HG11 VAL B 13 1.158 4.815 -14.541 1.00 0.00 H new ATOM 0 HG12 VAL B 13 2.927 4.822 -14.350 1.00 0.00 H new ATOM 0 HG13 VAL B 13 2.201 4.312 -15.893 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -0.085 2.707 -14.660 1.00 0.00 H new ATOM 0 HG22 VAL B 13 0.926 2.104 -15.995 1.00 0.00 H new ATOM 0 HG23 VAL B 13 0.745 1.140 -14.510 1.00 0.00 H new ATOM 1684 N PHE B 14 4.874 3.748 -15.510 1.00 0.00 N ATOM 1685 CA PHE B 14 5.635 4.426 -16.591 1.00 0.00 C ATOM 1686 C PHE B 14 6.573 3.430 -17.246 1.00 0.00 C ATOM 1687 O PHE B 14 6.746 3.438 -18.438 1.00 0.00 O ATOM 1688 CB PHE B 14 6.442 5.595 -16.023 1.00 0.00 C ATOM 1689 CG PHE B 14 7.204 6.265 -17.144 1.00 0.00 C ATOM 1690 CD1 PHE B 14 6.609 7.304 -17.865 1.00 0.00 C ATOM 1691 CD2 PHE B 14 8.498 5.838 -17.474 1.00 0.00 C ATOM 1692 CE1 PHE B 14 7.303 7.922 -18.911 1.00 0.00 C ATOM 1693 CE2 PHE B 14 9.193 6.455 -18.521 1.00 0.00 C ATOM 1694 CZ PHE B 14 8.596 7.497 -19.239 1.00 0.00 C ATOM 0 H PHE B 14 5.001 4.135 -14.575 1.00 0.00 H new ATOM 0 HA PHE B 14 4.933 4.812 -17.330 1.00 0.00 H new ATOM 0 HB2 PHE B 14 5.777 6.311 -15.541 1.00 0.00 H new ATOM 0 HB3 PHE B 14 7.134 5.238 -15.260 1.00 0.00 H new ATOM 0 HD1 PHE B 14 5.611 7.631 -17.614 1.00 0.00 H new ATOM 0 HD2 PHE B 14 8.959 5.033 -16.921 1.00 0.00 H new ATOM 0 HE1 PHE B 14 6.842 8.726 -19.465 1.00 0.00 H new ATOM 0 HE2 PHE B 14 10.190 6.127 -18.775 1.00 0.00 H new ATOM 0 HZ PHE B 14 9.133 7.973 -20.046 1.00 0.00 H new ATOM 1704 N HIS B 15 7.189 2.582 -16.482 1.00 0.00 N ATOM 1705 CA HIS B 15 8.123 1.597 -17.083 1.00 0.00 C ATOM 1706 C HIS B 15 7.359 0.625 -17.989 1.00 0.00 C ATOM 1707 O HIS B 15 7.915 0.083 -18.923 1.00 0.00 O ATOM 1708 CB HIS B 15 8.830 0.820 -15.972 1.00 0.00 C ATOM 1709 CG HIS B 15 9.769 1.744 -15.252 1.00 0.00 C ATOM 1710 ND1 HIS B 15 10.682 2.539 -15.930 1.00 0.00 N ATOM 1711 CD2 HIS B 15 9.947 2.021 -13.919 1.00 0.00 C ATOM 1712 CE1 HIS B 15 11.359 3.251 -15.013 1.00 0.00 C ATOM 1713 NE2 HIS B 15 10.950 2.972 -13.774 1.00 0.00 N ATOM 0 H HIS B 15 7.088 2.527 -15.469 1.00 0.00 H new ATOM 0 HA HIS B 15 8.862 2.129 -17.683 1.00 0.00 H new ATOM 0 HB2 HIS B 15 8.099 0.409 -15.276 1.00 0.00 H new ATOM 0 HB3 HIS B 15 9.379 -0.023 -16.392 1.00 0.00 H new ATOM 0 HD1 HIS B 15 10.815 2.576 -16.941 1.00 0.00 H new ATOM 0 HD2 HIS B 15 9.393 1.570 -13.109 1.00 0.00 H new ATOM 0 HE1 HIS B 15 12.138 3.961 -15.250 1.00 0.00 H new ATOM 1722 N GLN B 16 6.101 0.381 -17.725 1.00 0.00 N ATOM 1723 CA GLN B 16 5.352 -0.573 -18.588 1.00 0.00 C ATOM 1724 C GLN B 16 5.334 -0.077 -20.040 1.00 0.00 C ATOM 1725 O GLN B 16 5.466 -0.853 -20.965 1.00 0.00 O ATOM 1726 CB GLN B 16 3.916 -0.703 -18.077 1.00 0.00 C ATOM 1727 CG GLN B 16 3.915 -1.437 -16.734 1.00 0.00 C ATOM 1728 CD GLN B 16 4.301 -2.902 -16.947 1.00 0.00 C ATOM 1729 OE1 GLN B 16 3.772 -3.561 -17.820 1.00 0.00 O ATOM 1730 NE2 GLN B 16 5.206 -3.444 -16.179 1.00 0.00 N ATOM 0 H GLN B 16 5.569 0.796 -16.960 1.00 0.00 H new ATOM 0 HA GLN B 16 5.846 -1.544 -18.552 1.00 0.00 H new ATOM 0 HB2 GLN B 16 3.468 0.284 -17.964 1.00 0.00 H new ATOM 0 HB3 GLN B 16 3.309 -1.247 -18.801 1.00 0.00 H new ATOM 0 HG2 GLN B 16 4.617 -0.962 -16.048 1.00 0.00 H new ATOM 0 HG3 GLN B 16 2.928 -1.374 -16.275 1.00 0.00 H new ATOM 0 HE21 GLN B 16 5.650 -2.891 -15.446 1.00 0.00 H new ATOM 0 HE22 GLN B 16 5.469 -4.421 -16.312 1.00 0.00 H new ATOM 1739 N TYR B 17 5.160 1.206 -20.258 1.00 0.00 N ATOM 1740 CA TYR B 17 5.122 1.723 -21.671 1.00 0.00 C ATOM 1741 C TYR B 17 6.512 2.158 -22.151 1.00 0.00 C ATOM 1742 O TYR B 17 6.807 2.100 -23.325 1.00 0.00 O ATOM 1743 CB TYR B 17 4.164 2.917 -21.742 1.00 0.00 C ATOM 1744 CG TYR B 17 2.748 2.410 -21.785 1.00 0.00 C ATOM 1745 CD1 TYR B 17 2.076 2.126 -20.597 1.00 0.00 C ATOM 1746 CD2 TYR B 17 2.116 2.218 -23.017 1.00 0.00 C ATOM 1747 CE1 TYR B 17 0.765 1.648 -20.635 1.00 0.00 C ATOM 1748 CE2 TYR B 17 0.805 1.742 -23.063 1.00 0.00 C ATOM 1749 CZ TYR B 17 0.125 1.456 -21.869 1.00 0.00 C ATOM 1750 OH TYR B 17 -1.172 0.983 -21.908 1.00 0.00 O ATOM 0 H TYR B 17 5.044 1.912 -19.531 1.00 0.00 H new ATOM 0 HA TYR B 17 4.779 0.917 -22.320 1.00 0.00 H new ATOM 0 HB2 TYR B 17 4.305 3.565 -20.877 1.00 0.00 H new ATOM 0 HB3 TYR B 17 4.376 3.517 -22.627 1.00 0.00 H new ATOM 0 HD1 TYR B 17 2.569 2.276 -19.648 1.00 0.00 H new ATOM 0 HD2 TYR B 17 2.643 2.438 -23.934 1.00 0.00 H new ATOM 0 HE1 TYR B 17 0.244 1.426 -19.716 1.00 0.00 H new ATOM 0 HE2 TYR B 17 0.315 1.594 -24.014 1.00 0.00 H new ATOM 0 HH TYR B 17 -1.493 0.833 -20.994 1.00 0.00 H new ATOM 1760 N SER B 18 7.353 2.608 -21.269 1.00 0.00 N ATOM 1761 CA SER B 18 8.711 3.069 -21.690 1.00 0.00 C ATOM 1762 C SER B 18 9.467 1.917 -22.352 1.00 0.00 C ATOM 1763 O SER B 18 10.176 2.097 -23.322 1.00 0.00 O ATOM 1764 CB SER B 18 9.488 3.550 -20.464 1.00 0.00 C ATOM 1765 OG SER B 18 9.969 2.426 -19.741 1.00 0.00 O ATOM 0 H SER B 18 7.163 2.679 -20.269 1.00 0.00 H new ATOM 0 HA SER B 18 8.608 3.888 -22.402 1.00 0.00 H new ATOM 0 HB2 SER B 18 10.321 4.182 -20.772 1.00 0.00 H new ATOM 0 HB3 SER B 18 8.845 4.158 -19.828 1.00 0.00 H new ATOM 0 HG SER B 18 10.598 2.725 -19.051 1.00 0.00 H new ATOM 1771 N GLY B 19 9.331 0.737 -21.829 1.00 0.00 N ATOM 1772 CA GLY B 19 10.043 -0.431 -22.424 1.00 0.00 C ATOM 1773 C GLY B 19 9.264 -0.955 -23.636 1.00 0.00 C ATOM 1774 O GLY B 19 9.715 -1.841 -24.335 1.00 0.00 O ATOM 0 H GLY B 19 8.757 0.525 -21.013 1.00 0.00 H new ATOM 0 HA2 GLY B 19 11.049 -0.140 -22.726 1.00 0.00 H new ATOM 0 HA3 GLY B 19 10.149 -1.221 -21.680 1.00 0.00 H new ATOM 1778 N ARG B 20 8.096 -0.426 -23.890 1.00 0.00 N ATOM 1779 CA ARG B 20 7.299 -0.913 -25.054 1.00 0.00 C ATOM 1780 C ARG B 20 8.090 -0.698 -26.348 1.00 0.00 C ATOM 1781 O ARG B 20 8.234 -1.597 -27.152 1.00 0.00 O ATOM 1782 CB ARG B 20 5.977 -0.142 -25.130 1.00 0.00 C ATOM 1783 CG ARG B 20 5.132 -0.677 -26.290 1.00 0.00 C ATOM 1784 CD ARG B 20 3.816 0.099 -26.357 1.00 0.00 C ATOM 1785 NE ARG B 20 2.878 -0.567 -27.323 1.00 0.00 N ATOM 1786 CZ ARG B 20 3.220 -0.808 -28.564 1.00 0.00 C ATOM 1787 NH1 ARG B 20 4.305 -0.290 -29.068 1.00 0.00 N ATOM 1788 NH2 ARG B 20 2.435 -1.524 -29.322 1.00 0.00 N ATOM 0 H ARG B 20 7.661 0.318 -23.345 1.00 0.00 H new ATOM 0 HA ARG B 20 7.093 -1.976 -24.929 1.00 0.00 H new ATOM 0 HB2 ARG B 20 5.431 -0.245 -24.192 1.00 0.00 H new ATOM 0 HB3 ARG B 20 6.173 0.921 -25.270 1.00 0.00 H new ATOM 0 HG2 ARG B 20 5.676 -0.574 -27.229 1.00 0.00 H new ATOM 0 HG3 ARG B 20 4.934 -1.740 -26.151 1.00 0.00 H new ATOM 0 HD2 ARG B 20 3.360 0.145 -25.368 1.00 0.00 H new ATOM 0 HD3 ARG B 20 4.005 1.126 -26.670 1.00 0.00 H new ATOM 0 HE ARG B 20 1.948 -0.839 -27.003 1.00 0.00 H new ATOM 0 HH11 ARG B 20 4.898 0.310 -28.494 1.00 0.00 H new ATOM 0 HH12 ARG B 20 4.561 -0.485 -30.036 1.00 0.00 H new ATOM 0 HH21 ARG B 20 1.561 -1.892 -28.947 1.00 0.00 H new ATOM 0 HH22 ARG B 20 2.696 -1.715 -30.289 1.00 0.00 H new ATOM 1802 N GLU B 21 8.604 0.486 -26.560 1.00 0.00 N ATOM 1803 CA GLU B 21 9.385 0.752 -27.809 1.00 0.00 C ATOM 1804 C GLU B 21 10.865 0.473 -27.540 1.00 0.00 C ATOM 1805 O GLU B 21 11.700 0.565 -28.417 1.00 0.00 O ATOM 1806 CB GLU B 21 9.190 2.216 -28.230 1.00 0.00 C ATOM 1807 CG GLU B 21 9.821 2.450 -29.608 1.00 0.00 C ATOM 1808 CD GLU B 21 9.409 3.823 -30.140 1.00 0.00 C ATOM 1809 OE1 GLU B 21 8.667 4.505 -29.453 1.00 0.00 O ATOM 1810 OE2 GLU B 21 9.840 4.168 -31.228 1.00 0.00 O ATOM 0 H GLU B 21 8.518 1.280 -25.925 1.00 0.00 H new ATOM 0 HA GLU B 21 9.037 0.104 -28.613 1.00 0.00 H new ATOM 0 HB2 GLU B 21 8.127 2.456 -28.261 1.00 0.00 H new ATOM 0 HB3 GLU B 21 9.645 2.879 -27.494 1.00 0.00 H new ATOM 0 HG2 GLU B 21 10.907 2.389 -29.536 1.00 0.00 H new ATOM 0 HG3 GLU B 21 9.503 1.671 -30.301 1.00 0.00 H new ATOM 1817 N GLY B 22 11.196 0.115 -26.330 1.00 0.00 N ATOM 1818 CA GLY B 22 12.619 -0.184 -25.998 1.00 0.00 C ATOM 1819 C GLY B 22 13.311 1.095 -25.532 1.00 0.00 C ATOM 1820 O GLY B 22 14.418 1.065 -25.033 1.00 0.00 O ATOM 0 H GLY B 22 10.541 0.016 -25.554 1.00 0.00 H new ATOM 0 HA2 GLY B 22 12.670 -0.943 -25.218 1.00 0.00 H new ATOM 0 HA3 GLY B 22 13.130 -0.590 -26.871 1.00 0.00 H new ATOM 1824 N ASP B 23 12.667 2.223 -25.684 1.00 0.00 N ATOM 1825 CA ASP B 23 13.292 3.496 -25.240 1.00 0.00 C ATOM 1826 C ASP B 23 13.042 3.663 -23.740 1.00 0.00 C ATOM 1827 O ASP B 23 12.289 4.509 -23.308 1.00 0.00 O ATOM 1828 CB ASP B 23 12.666 4.655 -26.012 1.00 0.00 C ATOM 1829 CG ASP B 23 12.794 4.388 -27.512 1.00 0.00 C ATOM 1830 OD1 ASP B 23 13.888 4.061 -27.944 1.00 0.00 O ATOM 1831 OD2 ASP B 23 11.797 4.511 -28.204 1.00 0.00 O ATOM 0 H ASP B 23 11.738 2.314 -26.096 1.00 0.00 H new ATOM 0 HA ASP B 23 14.365 3.483 -25.430 1.00 0.00 H new ATOM 0 HB2 ASP B 23 11.617 4.765 -25.738 1.00 0.00 H new ATOM 0 HB3 ASP B 23 13.163 5.590 -25.753 1.00 0.00 H new ATOM 1836 N LYS B 24 13.663 2.842 -22.946 1.00 0.00 N ATOM 1837 CA LYS B 24 13.471 2.919 -21.472 1.00 0.00 C ATOM 1838 C LYS B 24 14.013 4.252 -20.932 1.00 0.00 C ATOM 1839 O LYS B 24 13.441 4.849 -20.042 1.00 0.00 O ATOM 1840 CB LYS B 24 14.213 1.750 -20.819 1.00 0.00 C ATOM 1841 CG LYS B 24 14.032 1.801 -19.303 1.00 0.00 C ATOM 1842 CD LYS B 24 14.554 0.499 -18.684 1.00 0.00 C ATOM 1843 CE LYS B 24 16.063 0.356 -18.936 1.00 0.00 C ATOM 1844 NZ LYS B 24 16.288 -0.314 -20.249 1.00 0.00 N ATOM 0 H LYS B 24 14.303 2.112 -23.257 1.00 0.00 H new ATOM 0 HA LYS B 24 12.408 2.862 -21.238 1.00 0.00 H new ATOM 0 HB2 LYS B 24 13.834 0.805 -21.208 1.00 0.00 H new ATOM 0 HB3 LYS B 24 15.273 1.795 -21.069 1.00 0.00 H new ATOM 0 HG2 LYS B 24 14.570 2.654 -18.890 1.00 0.00 H new ATOM 0 HG3 LYS B 24 12.979 1.938 -19.056 1.00 0.00 H new ATOM 0 HD2 LYS B 24 14.355 0.493 -17.612 1.00 0.00 H new ATOM 0 HD3 LYS B 24 14.025 -0.353 -19.111 1.00 0.00 H new ATOM 0 HE2 LYS B 24 16.538 1.337 -18.931 1.00 0.00 H new ATOM 0 HE3 LYS B 24 16.522 -0.225 -18.136 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 16.917 -1.132 -20.118 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 15.377 -0.635 -20.635 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 16.727 0.358 -20.911 1.00 0.00 H new ATOM 1858 N HIS B 25 15.132 4.702 -21.439 1.00 0.00 N ATOM 1859 CA HIS B 25 15.737 5.974 -20.932 1.00 0.00 C ATOM 1860 C HIS B 25 15.016 7.211 -21.492 1.00 0.00 C ATOM 1861 O HIS B 25 15.058 8.271 -20.900 1.00 0.00 O ATOM 1862 CB HIS B 25 17.210 6.023 -21.344 1.00 0.00 C ATOM 1863 CG HIS B 25 17.839 7.279 -20.806 1.00 0.00 C ATOM 1864 ND1 HIS B 25 17.801 8.481 -21.501 1.00 0.00 N ATOM 1865 CD2 HIS B 25 18.525 7.538 -19.645 1.00 0.00 C ATOM 1866 CE1 HIS B 25 18.446 9.399 -20.757 1.00 0.00 C ATOM 1867 NE2 HIS B 25 18.904 8.876 -19.620 1.00 0.00 N ATOM 0 H HIS B 25 15.655 4.243 -22.184 1.00 0.00 H new ATOM 0 HA HIS B 25 15.637 5.989 -19.847 1.00 0.00 H new ATOM 0 HB2 HIS B 25 17.735 5.148 -20.961 1.00 0.00 H new ATOM 0 HB3 HIS B 25 17.296 5.997 -22.430 1.00 0.00 H new ATOM 0 HD2 HIS B 25 18.737 6.815 -18.871 1.00 0.00 H new ATOM 0 HE1 HIS B 25 18.576 10.431 -21.046 1.00 0.00 H new ATOM 0 HE2 HIS B 25 19.424 9.356 -18.885 1.00 0.00 H new ATOM 1876 N LYS B 26 14.364 7.100 -22.623 1.00 0.00 N ATOM 1877 CA LYS B 26 13.654 8.289 -23.210 1.00 0.00 C ATOM 1878 C LYS B 26 12.307 7.849 -23.780 1.00 0.00 C ATOM 1879 O LYS B 26 12.092 6.692 -24.059 1.00 0.00 O ATOM 1880 CB LYS B 26 14.522 8.902 -24.311 1.00 0.00 C ATOM 1881 CG LYS B 26 14.667 7.909 -25.466 1.00 0.00 C ATOM 1882 CD LYS B 26 15.728 8.414 -26.447 1.00 0.00 C ATOM 1883 CE LYS B 26 15.712 7.547 -27.708 1.00 0.00 C ATOM 1884 NZ LYS B 26 14.488 7.846 -28.503 1.00 0.00 N ATOM 0 H LYS B 26 14.290 6.241 -23.168 1.00 0.00 H new ATOM 0 HA LYS B 26 13.481 9.036 -22.436 1.00 0.00 H new ATOM 0 HB2 LYS B 26 14.072 9.828 -24.669 1.00 0.00 H new ATOM 0 HB3 LYS B 26 15.504 9.158 -23.913 1.00 0.00 H new ATOM 0 HG2 LYS B 26 14.949 6.928 -25.083 1.00 0.00 H new ATOM 0 HG3 LYS B 26 13.712 7.789 -25.978 1.00 0.00 H new ATOM 0 HD2 LYS B 26 15.533 9.455 -26.706 1.00 0.00 H new ATOM 0 HD3 LYS B 26 16.713 8.380 -25.982 1.00 0.00 H new ATOM 0 HE2 LYS B 26 16.603 7.740 -28.306 1.00 0.00 H new ATOM 0 HE3 LYS B 26 15.733 6.492 -27.436 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 14.628 7.535 -29.486 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 13.676 7.342 -28.093 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 14.305 8.870 -28.487 1.00 0.00 H new ATOM 1898 N LEU B 27 11.384 8.767 -23.920 1.00 0.00 N ATOM 1899 CA LEU B 27 10.020 8.415 -24.436 1.00 0.00 C ATOM 1900 C LEU B 27 9.702 9.257 -25.677 1.00 0.00 C ATOM 1901 O LEU B 27 9.877 10.455 -25.674 1.00 0.00 O ATOM 1902 CB LEU B 27 9.013 8.726 -23.326 1.00 0.00 C ATOM 1903 CG LEU B 27 7.640 8.120 -23.654 1.00 0.00 C ATOM 1904 CD1 LEU B 27 7.620 6.620 -23.318 1.00 0.00 C ATOM 1905 CD2 LEU B 27 6.571 8.827 -22.819 1.00 0.00 C ATOM 0 H LEU B 27 11.515 9.754 -23.698 1.00 0.00 H new ATOM 0 HA LEU B 27 9.973 7.362 -24.713 1.00 0.00 H new ATOM 0 HB2 LEU B 27 9.375 8.328 -22.378 1.00 0.00 H new ATOM 0 HB3 LEU B 27 8.920 9.805 -23.204 1.00 0.00 H new ATOM 0 HG LEU B 27 7.442 8.250 -24.718 1.00 0.00 H new ATOM 0 HD11 LEU B 27 6.640 6.207 -23.557 1.00 0.00 H new ATOM 0 HD12 LEU B 27 8.383 6.106 -23.903 1.00 0.00 H new ATOM 0 HD13 LEU B 27 7.823 6.482 -22.256 1.00 0.00 H new ATOM 0 HD21 LEU B 27 5.593 8.403 -23.046 1.00 0.00 H new ATOM 0 HD22 LEU B 27 6.788 8.692 -21.760 1.00 0.00 H new ATOM 0 HD23 LEU B 27 6.569 9.891 -23.056 1.00 0.00 H new ATOM 1917 N LYS B 28 9.234 8.644 -26.742 1.00 0.00 N ATOM 1918 CA LYS B 28 8.912 9.413 -27.981 1.00 0.00 C ATOM 1919 C LYS B 28 7.402 9.652 -28.059 1.00 0.00 C ATOM 1920 O LYS B 28 6.614 8.831 -27.632 1.00 0.00 O ATOM 1921 CB LYS B 28 9.367 8.602 -29.200 1.00 0.00 C ATOM 1922 CG LYS B 28 9.123 9.401 -30.483 1.00 0.00 C ATOM 1923 CD LYS B 28 9.582 8.577 -31.688 1.00 0.00 C ATOM 1924 CE LYS B 28 9.372 9.381 -32.974 1.00 0.00 C ATOM 1925 NZ LYS B 28 7.926 9.709 -33.129 1.00 0.00 N ATOM 0 H LYS B 28 9.062 7.640 -26.802 1.00 0.00 H new ATOM 0 HA LYS B 28 9.425 10.374 -27.963 1.00 0.00 H new ATOM 0 HB2 LYS B 28 10.425 8.358 -29.110 1.00 0.00 H new ATOM 0 HB3 LYS B 28 8.824 7.658 -29.242 1.00 0.00 H new ATOM 0 HG2 LYS B 28 8.065 9.645 -30.577 1.00 0.00 H new ATOM 0 HG3 LYS B 28 9.666 10.345 -30.446 1.00 0.00 H new ATOM 0 HD2 LYS B 28 10.634 8.313 -31.581 1.00 0.00 H new ATOM 0 HD3 LYS B 28 9.022 7.643 -31.736 1.00 0.00 H new ATOM 0 HE2 LYS B 28 9.962 10.297 -32.942 1.00 0.00 H new ATOM 0 HE3 LYS B 28 9.719 8.808 -33.834 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 7.734 9.974 -34.116 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 7.353 8.879 -32.876 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 7.681 10.503 -32.503 1.00 0.00 H new ATOM 1939 N LYS B 29 6.993 10.771 -28.603 1.00 0.00 N ATOM 1940 CA LYS B 29 5.534 11.070 -28.716 1.00 0.00 C ATOM 1941 C LYS B 29 4.791 9.830 -29.201 1.00 0.00 C ATOM 1942 O LYS B 29 3.606 9.673 -28.981 1.00 0.00 O ATOM 1943 CB LYS B 29 5.310 12.195 -29.733 1.00 0.00 C ATOM 1944 CG LYS B 29 5.910 11.808 -31.089 1.00 0.00 C ATOM 1945 CD LYS B 29 5.679 12.940 -32.092 1.00 0.00 C ATOM 1946 CE LYS B 29 6.215 12.523 -33.462 1.00 0.00 C ATOM 1947 NZ LYS B 29 5.901 13.581 -34.463 1.00 0.00 N ATOM 0 H LYS B 29 7.610 11.493 -28.975 1.00 0.00 H new ATOM 0 HA LYS B 29 5.163 11.372 -27.737 1.00 0.00 H new ATOM 0 HB2 LYS B 29 4.243 12.390 -29.841 1.00 0.00 H new ATOM 0 HB3 LYS B 29 5.768 13.117 -29.374 1.00 0.00 H new ATOM 0 HG2 LYS B 29 6.977 11.613 -30.984 1.00 0.00 H new ATOM 0 HG3 LYS B 29 5.452 10.888 -31.452 1.00 0.00 H new ATOM 0 HD2 LYS B 29 4.615 13.169 -32.160 1.00 0.00 H new ATOM 0 HD3 LYS B 29 6.180 13.847 -31.754 1.00 0.00 H new ATOM 0 HE2 LYS B 29 7.292 12.365 -33.410 1.00 0.00 H new ATOM 0 HE3 LYS B 29 5.769 11.576 -33.766 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 6.266 13.297 -35.395 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 4.871 13.711 -34.519 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 6.347 14.475 -34.175 1.00 0.00 H new ATOM 1961 N SER B 30 5.480 8.953 -29.867 1.00 0.00 N ATOM 1962 CA SER B 30 4.810 7.722 -30.377 1.00 0.00 C ATOM 1963 C SER B 30 4.567 6.767 -29.215 1.00 0.00 C ATOM 1964 O SER B 30 3.475 6.275 -29.009 1.00 0.00 O ATOM 1965 CB SER B 30 5.701 7.046 -31.420 1.00 0.00 C ATOM 1966 OG SER B 30 5.793 7.877 -32.569 1.00 0.00 O ATOM 0 H SER B 30 6.474 9.031 -30.082 1.00 0.00 H new ATOM 0 HA SER B 30 3.859 7.988 -30.838 1.00 0.00 H new ATOM 0 HB2 SER B 30 6.693 6.867 -31.006 1.00 0.00 H new ATOM 0 HB3 SER B 30 5.289 6.074 -31.692 1.00 0.00 H new ATOM 0 HG SER B 30 6.079 7.341 -33.338 1.00 0.00 H new ATOM 1972 N GLU B 31 5.583 6.518 -28.445 1.00 0.00 N ATOM 1973 CA GLU B 31 5.441 5.613 -27.281 1.00 0.00 C ATOM 1974 C GLU B 31 4.475 6.260 -26.285 1.00 0.00 C ATOM 1975 O GLU B 31 3.687 5.600 -25.637 1.00 0.00 O ATOM 1976 CB GLU B 31 6.823 5.417 -26.653 1.00 0.00 C ATOM 1977 CG GLU B 31 6.836 4.170 -25.770 1.00 0.00 C ATOM 1978 CD GLU B 31 8.279 3.868 -25.366 1.00 0.00 C ATOM 1979 OE1 GLU B 31 9.148 4.647 -25.721 1.00 0.00 O ATOM 1980 OE2 GLU B 31 8.493 2.858 -24.727 1.00 0.00 O ATOM 0 H GLU B 31 6.516 6.908 -28.575 1.00 0.00 H new ATOM 0 HA GLU B 31 5.046 4.641 -27.576 1.00 0.00 H new ATOM 0 HB2 GLU B 31 7.575 5.323 -27.436 1.00 0.00 H new ATOM 0 HB3 GLU B 31 7.087 6.293 -26.060 1.00 0.00 H new ATOM 0 HG2 GLU B 31 6.221 4.328 -24.884 1.00 0.00 H new ATOM 0 HG3 GLU B 31 6.409 3.323 -26.307 1.00 0.00 H new ATOM 1987 N LEU B 32 4.536 7.560 -26.174 1.00 0.00 N ATOM 1988 CA LEU B 32 3.636 8.292 -25.239 1.00 0.00 C ATOM 1989 C LEU B 32 2.183 8.041 -25.623 1.00 0.00 C ATOM 1990 O LEU B 32 1.339 7.872 -24.777 1.00 0.00 O ATOM 1991 CB LEU B 32 3.941 9.793 -25.330 1.00 0.00 C ATOM 1992 CG LEU B 32 2.960 10.611 -24.476 1.00 0.00 C ATOM 1993 CD1 LEU B 32 3.009 10.152 -23.016 1.00 0.00 C ATOM 1994 CD2 LEU B 32 3.353 12.090 -24.554 1.00 0.00 C ATOM 0 H LEU B 32 5.180 8.152 -26.699 1.00 0.00 H new ATOM 0 HA LEU B 32 3.800 7.942 -24.220 1.00 0.00 H new ATOM 0 HB2 LEU B 32 4.962 9.980 -24.996 1.00 0.00 H new ATOM 0 HB3 LEU B 32 3.881 10.117 -26.369 1.00 0.00 H new ATOM 0 HG LEU B 32 1.948 10.466 -24.855 1.00 0.00 H new ATOM 0 HD11 LEU B 32 2.308 10.742 -22.425 1.00 0.00 H new ATOM 0 HD12 LEU B 32 2.737 9.098 -22.957 1.00 0.00 H new ATOM 0 HD13 LEU B 32 4.017 10.289 -22.625 1.00 0.00 H new ATOM 0 HD21 LEU B 32 2.664 12.682 -23.952 1.00 0.00 H new ATOM 0 HD22 LEU B 32 4.367 12.217 -24.176 1.00 0.00 H new ATOM 0 HD23 LEU B 32 3.308 12.424 -25.590 1.00 0.00 H new ATOM 2006 N LYS B 33 1.884 8.026 -26.887 1.00 0.00 N ATOM 2007 CA LYS B 33 0.472 7.791 -27.315 1.00 0.00 C ATOM 2008 C LYS B 33 -0.008 6.427 -26.812 1.00 0.00 C ATOM 2009 O LYS B 33 -1.134 6.283 -26.379 1.00 0.00 O ATOM 2010 CB LYS B 33 0.396 7.840 -28.843 1.00 0.00 C ATOM 2011 CG LYS B 33 -1.055 7.672 -29.303 1.00 0.00 C ATOM 2012 CD LYS B 33 -1.102 7.725 -30.832 1.00 0.00 C ATOM 2013 CE LYS B 33 -2.554 7.771 -31.315 1.00 0.00 C ATOM 2014 NZ LYS B 33 -3.157 6.413 -31.213 1.00 0.00 N ATOM 0 H LYS B 33 2.551 8.166 -27.646 1.00 0.00 H new ATOM 0 HA LYS B 33 -0.169 8.564 -26.893 1.00 0.00 H new ATOM 0 HB2 LYS B 33 0.793 8.789 -29.204 1.00 0.00 H new ATOM 0 HB3 LYS B 33 1.015 7.052 -29.271 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -1.455 6.723 -28.947 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -1.678 8.460 -28.880 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -0.564 8.603 -31.189 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -0.600 6.852 -31.249 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -3.125 8.480 -30.715 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -2.594 8.121 -32.346 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -3.938 6.328 -31.894 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -2.434 5.696 -31.424 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -3.520 6.266 -30.250 1.00 0.00 H new ATOM 2028 N GLU B 34 0.824 5.426 -26.860 1.00 0.00 N ATOM 2029 CA GLU B 34 0.394 4.090 -26.378 1.00 0.00 C ATOM 2030 C GLU B 34 0.035 4.194 -24.900 1.00 0.00 C ATOM 2031 O GLU B 34 -0.918 3.619 -24.444 1.00 0.00 O ATOM 2032 CB GLU B 34 1.521 3.071 -26.586 1.00 0.00 C ATOM 2033 CG GLU B 34 1.579 2.646 -28.057 1.00 0.00 C ATOM 2034 CD GLU B 34 2.034 3.826 -28.915 1.00 0.00 C ATOM 2035 OE1 GLU B 34 1.227 4.710 -29.145 1.00 0.00 O ATOM 2036 OE2 GLU B 34 3.182 3.825 -29.326 1.00 0.00 O ATOM 0 H GLU B 34 1.780 5.477 -27.211 1.00 0.00 H new ATOM 0 HA GLU B 34 -0.477 3.754 -26.940 1.00 0.00 H new ATOM 0 HB2 GLU B 34 2.475 3.505 -26.287 1.00 0.00 H new ATOM 0 HB3 GLU B 34 1.355 2.199 -25.953 1.00 0.00 H new ATOM 0 HG2 GLU B 34 2.267 1.809 -28.177 1.00 0.00 H new ATOM 0 HG3 GLU B 34 0.598 2.302 -28.385 1.00 0.00 H new ATOM 2043 N LEU B 35 0.789 4.931 -24.148 1.00 0.00 N ATOM 2044 CA LEU B 35 0.465 5.083 -22.705 1.00 0.00 C ATOM 2045 C LEU B 35 -0.907 5.733 -22.546 1.00 0.00 C ATOM 2046 O LEU B 35 -1.740 5.288 -21.790 1.00 0.00 O ATOM 2047 CB LEU B 35 1.525 5.979 -22.048 1.00 0.00 C ATOM 2048 CG LEU B 35 1.092 6.371 -20.604 1.00 0.00 C ATOM 2049 CD1 LEU B 35 2.307 6.379 -19.671 1.00 0.00 C ATOM 2050 CD2 LEU B 35 0.457 7.777 -20.593 1.00 0.00 C ATOM 0 H LEU B 35 1.616 5.436 -24.466 1.00 0.00 H new ATOM 0 HA LEU B 35 0.455 4.102 -22.231 1.00 0.00 H new ATOM 0 HB2 LEU B 35 2.482 5.458 -22.018 1.00 0.00 H new ATOM 0 HB3 LEU B 35 1.671 6.878 -22.647 1.00 0.00 H new ATOM 0 HG LEU B 35 0.363 5.637 -20.261 1.00 0.00 H new ATOM 0 HD11 LEU B 35 1.991 6.654 -18.665 1.00 0.00 H new ATOM 0 HD12 LEU B 35 2.757 5.386 -19.651 1.00 0.00 H new ATOM 0 HD13 LEU B 35 3.038 7.102 -20.032 1.00 0.00 H new ATOM 0 HD21 LEU B 35 0.160 8.034 -19.576 1.00 0.00 H new ATOM 0 HD22 LEU B 35 1.182 8.506 -20.955 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -0.420 7.785 -21.240 1.00 0.00 H new ATOM 2062 N ILE B 36 -1.118 6.818 -23.226 1.00 0.00 N ATOM 2063 CA ILE B 36 -2.398 7.563 -23.093 1.00 0.00 C ATOM 2064 C ILE B 36 -3.581 6.815 -23.706 1.00 0.00 C ATOM 2065 O ILE B 36 -4.657 6.790 -23.142 1.00 0.00 O ATOM 2066 CB ILE B 36 -2.240 8.917 -23.781 1.00 0.00 C ATOM 2067 CG1 ILE B 36 -1.125 9.706 -23.088 1.00 0.00 C ATOM 2068 CG2 ILE B 36 -3.549 9.697 -23.691 1.00 0.00 C ATOM 2069 CD1 ILE B 36 -0.784 10.950 -23.910 1.00 0.00 C ATOM 0 H ILE B 36 -0.450 7.228 -23.878 1.00 0.00 H new ATOM 0 HA ILE B 36 -2.613 7.680 -22.031 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.986 8.765 -24.830 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -1.441 9.996 -22.086 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -0.240 9.080 -22.975 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -3.432 10.662 -24.183 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -4.343 9.134 -24.182 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -3.809 9.853 -22.644 1.00 0.00 H new ATOM 0 HD11 ILE B 36 0.010 11.508 -23.413 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -0.449 10.650 -24.903 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -1.669 11.580 -24.000 1.00 0.00 H new ATOM 2081 N ASN B 37 -3.426 6.239 -24.862 1.00 0.00 N ATOM 2082 CA ASN B 37 -4.598 5.547 -25.483 1.00 0.00 C ATOM 2083 C ASN B 37 -4.875 4.186 -24.843 1.00 0.00 C ATOM 2084 O ASN B 37 -6.008 3.756 -24.756 1.00 0.00 O ATOM 2085 CB ASN B 37 -4.352 5.367 -26.982 1.00 0.00 C ATOM 2086 CG ASN B 37 -4.440 6.731 -27.664 1.00 0.00 C ATOM 2087 OD1 ASN B 37 -3.861 6.916 -28.816 1.00 0.00 O flip ATOM 2088 ND2 ASN B 37 -5.049 7.640 -27.139 1.00 0.00 N flip ATOM 0 H ASN B 37 -2.559 6.214 -25.399 1.00 0.00 H new ATOM 0 HA ASN B 37 -5.474 6.173 -25.315 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -3.371 4.923 -27.153 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -5.089 4.685 -27.406 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -5.503 7.496 -26.237 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -5.107 8.548 -27.600 1.00 0.00 H new ATOM 2095 N ASN B 38 -3.857 3.487 -24.443 1.00 0.00 N ATOM 2096 CA ASN B 38 -4.058 2.115 -23.857 1.00 0.00 C ATOM 2097 C ASN B 38 -4.043 2.111 -22.322 1.00 0.00 C ATOM 2098 O ASN B 38 -4.682 1.280 -21.708 1.00 0.00 O ATOM 2099 CB ASN B 38 -2.960 1.183 -24.368 1.00 0.00 C ATOM 2100 CG ASN B 38 -3.086 1.035 -25.885 1.00 0.00 C ATOM 2101 OD1 ASN B 38 -4.120 1.549 -26.494 1.00 0.00 O flip ATOM 2102 ND2 ASN B 38 -2.235 0.448 -26.524 1.00 0.00 N flip ATOM 0 H ASN B 38 -2.887 3.797 -24.492 1.00 0.00 H new ATOM 0 HA ASN B 38 -5.044 1.773 -24.173 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -1.979 1.583 -24.111 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -3.043 0.208 -23.888 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -1.427 0.046 -26.049 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -2.329 0.357 -27.536 1.00 0.00 H new ATOM 2109 N GLU B 39 -3.317 2.991 -21.677 1.00 0.00 N ATOM 2110 CA GLU B 39 -3.295 2.948 -20.181 1.00 0.00 C ATOM 2111 C GLU B 39 -4.512 3.698 -19.641 1.00 0.00 C ATOM 2112 O GLU B 39 -4.817 3.635 -18.468 1.00 0.00 O ATOM 2113 CB GLU B 39 -2.000 3.596 -19.652 1.00 0.00 C ATOM 2114 CG GLU B 39 -1.706 3.091 -18.237 1.00 0.00 C ATOM 2115 CD GLU B 39 -0.376 3.673 -17.756 1.00 0.00 C ATOM 2116 OE1 GLU B 39 0.651 3.106 -18.090 1.00 0.00 O ATOM 2117 OE2 GLU B 39 -0.406 4.676 -17.062 1.00 0.00 O ATOM 0 H GLU B 39 -2.751 3.721 -22.109 1.00 0.00 H new ATOM 0 HA GLU B 39 -3.327 1.911 -19.847 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -1.167 3.357 -20.313 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -2.102 4.681 -19.647 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -2.509 3.383 -17.561 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -1.663 2.002 -18.229 1.00 0.00 H new ATOM 2124 N LEU B 40 -5.207 4.407 -20.496 1.00 0.00 N ATOM 2125 CA LEU B 40 -6.413 5.178 -20.056 1.00 0.00 C ATOM 2126 C LEU B 40 -7.564 4.906 -21.027 1.00 0.00 C ATOM 2127 O LEU B 40 -8.090 5.810 -21.645 1.00 0.00 O ATOM 2128 CB LEU B 40 -6.091 6.677 -20.075 1.00 0.00 C ATOM 2129 CG LEU B 40 -4.775 6.953 -19.331 1.00 0.00 C ATOM 2130 CD1 LEU B 40 -4.314 8.380 -19.614 1.00 0.00 C ATOM 2131 CD2 LEU B 40 -4.984 6.791 -17.826 1.00 0.00 C ATOM 0 H LEU B 40 -4.989 4.486 -21.489 1.00 0.00 H new ATOM 0 HA LEU B 40 -6.695 4.873 -19.048 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -6.014 7.026 -21.105 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -6.903 7.236 -19.610 1.00 0.00 H new ATOM 0 HG LEU B 40 -4.021 6.245 -19.675 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -3.381 8.572 -19.085 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -4.157 8.506 -20.685 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -5.075 9.082 -19.274 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -4.047 6.988 -17.305 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -5.743 7.495 -17.486 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -5.311 5.774 -17.612 1.00 0.00 H new ATOM 2143 N SER B 41 -7.955 3.670 -21.180 1.00 0.00 N ATOM 2144 CA SER B 41 -9.063 3.358 -22.128 1.00 0.00 C ATOM 2145 C SER B 41 -10.336 4.094 -21.705 1.00 0.00 C ATOM 2146 O SER B 41 -11.071 4.595 -22.533 1.00 0.00 O ATOM 2147 CB SER B 41 -9.331 1.853 -22.127 1.00 0.00 C ATOM 2148 OG SER B 41 -8.158 1.165 -22.539 1.00 0.00 O ATOM 0 H SER B 41 -7.558 2.867 -20.693 1.00 0.00 H new ATOM 0 HA SER B 41 -8.773 3.680 -23.128 1.00 0.00 H new ATOM 0 HB2 SER B 41 -9.627 1.526 -21.130 1.00 0.00 H new ATOM 0 HB3 SER B 41 -10.158 1.619 -22.798 1.00 0.00 H new ATOM 0 HG SER B 41 -8.327 0.200 -22.537 1.00 0.00 H new ATOM 2154 N HIS B 42 -10.610 4.159 -20.425 1.00 0.00 N ATOM 2155 CA HIS B 42 -11.847 4.862 -19.951 1.00 0.00 C ATOM 2156 C HIS B 42 -11.535 5.700 -18.705 1.00 0.00 C ATOM 2157 O HIS B 42 -12.338 6.506 -18.277 1.00 0.00 O ATOM 2158 CB HIS B 42 -12.916 3.819 -19.613 1.00 0.00 C ATOM 2159 CG HIS B 42 -13.226 3.010 -20.845 1.00 0.00 C ATOM 2160 ND1 HIS B 42 -12.732 1.726 -21.032 1.00 0.00 N ATOM 2161 CD2 HIS B 42 -13.969 3.293 -21.965 1.00 0.00 C ATOM 2162 CE1 HIS B 42 -13.178 1.289 -22.225 1.00 0.00 C ATOM 2163 NE2 HIS B 42 -13.934 2.206 -22.831 1.00 0.00 N ATOM 0 H HIS B 42 -10.032 3.757 -19.687 1.00 0.00 H new ATOM 0 HA HIS B 42 -12.209 5.524 -20.738 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -12.564 3.166 -18.814 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -13.818 4.310 -19.250 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -14.498 4.217 -22.145 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -12.952 0.318 -22.639 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -14.391 2.126 -23.740 1.00 0.00 H new ATOM 2172 N PHE B 43 -10.381 5.526 -18.117 1.00 0.00 N ATOM 2173 CA PHE B 43 -10.039 6.324 -16.904 1.00 0.00 C ATOM 2174 C PHE B 43 -9.815 7.784 -17.312 1.00 0.00 C ATOM 2175 O PHE B 43 -10.033 8.696 -16.539 1.00 0.00 O ATOM 2176 CB PHE B 43 -8.779 5.739 -16.243 1.00 0.00 C ATOM 2177 CG PHE B 43 -8.238 6.640 -15.137 1.00 0.00 C ATOM 2178 CD1 PHE B 43 -9.094 7.390 -14.305 1.00 0.00 C ATOM 2179 CD2 PHE B 43 -6.852 6.709 -14.937 1.00 0.00 C ATOM 2180 CE1 PHE B 43 -8.556 8.197 -13.292 1.00 0.00 C ATOM 2181 CE2 PHE B 43 -6.321 7.514 -13.923 1.00 0.00 C ATOM 2182 CZ PHE B 43 -7.172 8.258 -13.102 1.00 0.00 C ATOM 0 H PHE B 43 -9.663 4.869 -18.423 1.00 0.00 H new ATOM 0 HA PHE B 43 -10.855 6.282 -16.183 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -9.010 4.757 -15.829 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -8.008 5.593 -17.000 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -10.164 7.343 -14.448 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -6.190 6.137 -15.570 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -9.213 8.773 -12.657 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -5.252 7.560 -13.775 1.00 0.00 H new ATOM 0 HZ PHE B 43 -6.761 8.880 -12.321 1.00 0.00 H new ATOM 2192 N LEU B 44 -9.392 8.013 -18.534 1.00 0.00 N ATOM 2193 CA LEU B 44 -9.165 9.409 -19.014 1.00 0.00 C ATOM 2194 C LEU B 44 -9.610 9.476 -20.474 1.00 0.00 C ATOM 2195 O LEU B 44 -9.920 8.468 -21.079 1.00 0.00 O ATOM 2196 CB LEU B 44 -7.668 9.775 -18.908 1.00 0.00 C ATOM 2197 CG LEU B 44 -7.507 11.289 -18.635 1.00 0.00 C ATOM 2198 CD1 LEU B 44 -7.617 11.561 -17.131 1.00 0.00 C ATOM 2199 CD2 LEU B 44 -6.138 11.776 -19.129 1.00 0.00 C ATOM 0 H LEU B 44 -9.194 7.286 -19.221 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.731 10.113 -18.405 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.202 9.202 -18.107 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -7.154 9.508 -19.832 1.00 0.00 H new ATOM 0 HG LEU B 44 -8.295 11.822 -19.167 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.503 12.629 -16.945 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -8.592 11.232 -16.772 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -6.834 11.015 -16.604 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -6.038 12.843 -18.931 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -5.349 11.234 -18.607 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -6.053 11.597 -20.201 1.00 0.00 H new ATOM 2211 N GLU B 45 -9.653 10.639 -21.051 1.00 0.00 N ATOM 2212 CA GLU B 45 -10.089 10.717 -22.466 1.00 0.00 C ATOM 2213 C GLU B 45 -9.010 10.119 -23.375 1.00 0.00 C ATOM 2214 O GLU B 45 -7.896 10.595 -23.453 1.00 0.00 O ATOM 2215 CB GLU B 45 -10.358 12.181 -22.851 1.00 0.00 C ATOM 2216 CG GLU B 45 -9.039 12.951 -22.993 1.00 0.00 C ATOM 2217 CD GLU B 45 -9.313 14.456 -22.957 1.00 0.00 C ATOM 2218 OE1 GLU B 45 -10.461 14.834 -23.121 1.00 0.00 O ATOM 2219 OE2 GLU B 45 -8.368 15.204 -22.768 1.00 0.00 O ATOM 0 H GLU B 45 -9.409 11.527 -20.612 1.00 0.00 H new ATOM 0 HA GLU B 45 -11.010 10.147 -22.590 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -10.912 12.220 -23.789 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -10.982 12.654 -22.093 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -8.358 12.676 -22.187 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -8.550 12.683 -23.929 1.00 0.00 H new ATOM 2226 N GLU B 46 -9.350 9.076 -24.069 1.00 0.00 N ATOM 2227 CA GLU B 46 -8.381 8.435 -25.003 1.00 0.00 C ATOM 2228 C GLU B 46 -8.039 9.441 -26.110 1.00 0.00 C ATOM 2229 O GLU B 46 -8.805 10.342 -26.375 1.00 0.00 O ATOM 2230 CB GLU B 46 -9.046 7.180 -25.597 1.00 0.00 C ATOM 2231 CG GLU B 46 -8.314 6.713 -26.861 1.00 0.00 C ATOM 2232 CD GLU B 46 -8.839 5.336 -27.273 1.00 0.00 C ATOM 2233 OE1 GLU B 46 -9.569 4.745 -26.493 1.00 0.00 O ATOM 2234 OE2 GLU B 46 -8.503 4.896 -28.359 1.00 0.00 O ATOM 0 H GLU B 46 -10.268 8.632 -24.031 1.00 0.00 H new ATOM 0 HA GLU B 46 -7.464 8.146 -24.490 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -9.046 6.380 -24.857 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -10.088 7.395 -25.835 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -8.467 7.429 -27.668 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -7.241 6.665 -26.676 1.00 0.00 H new ATOM 2241 N ILE B 47 -6.902 9.304 -26.762 1.00 0.00 N ATOM 2242 CA ILE B 47 -6.547 10.266 -27.862 1.00 0.00 C ATOM 2243 C ILE B 47 -6.826 9.593 -29.204 1.00 0.00 C ATOM 2244 O ILE B 47 -6.427 8.471 -29.447 1.00 0.00 O ATOM 2245 CB ILE B 47 -5.080 10.689 -27.750 1.00 0.00 C ATOM 2246 CG1 ILE B 47 -4.934 11.537 -26.477 1.00 0.00 C ATOM 2247 CG2 ILE B 47 -4.692 11.513 -28.988 1.00 0.00 C ATOM 2248 CD1 ILE B 47 -3.487 11.972 -26.292 1.00 0.00 C ATOM 0 H ILE B 47 -6.211 8.575 -26.582 1.00 0.00 H new ATOM 0 HA ILE B 47 -7.153 11.169 -27.779 1.00 0.00 H new ATOM 0 HB ILE B 47 -4.425 9.819 -27.696 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -5.579 12.414 -26.541 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -5.261 10.963 -25.610 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -3.648 11.816 -28.911 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -4.830 10.909 -29.885 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -5.323 12.400 -29.047 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -3.400 12.572 -25.386 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -2.850 11.091 -26.206 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -3.173 12.565 -27.151 1.00 0.00 H new ATOM 2260 N LYS B 48 -7.565 10.256 -30.057 1.00 0.00 N ATOM 2261 CA LYS B 48 -7.948 9.648 -31.368 1.00 0.00 C ATOM 2262 C LYS B 48 -7.051 10.166 -32.500 1.00 0.00 C ATOM 2263 O LYS B 48 -6.981 9.562 -33.553 1.00 0.00 O ATOM 2264 CB LYS B 48 -9.413 10.030 -31.683 1.00 0.00 C ATOM 2265 CG LYS B 48 -10.256 10.104 -30.395 1.00 0.00 C ATOM 2266 CD LYS B 48 -10.403 8.715 -29.772 1.00 0.00 C ATOM 2267 CE LYS B 48 -11.008 8.858 -28.378 1.00 0.00 C ATOM 2268 NZ LYS B 48 -12.370 9.456 -28.482 1.00 0.00 N ATOM 0 H LYS B 48 -7.922 11.199 -29.901 1.00 0.00 H new ATOM 0 HA LYS B 48 -7.832 8.567 -31.298 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -9.439 10.992 -32.194 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -9.845 9.296 -32.363 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -9.784 10.781 -29.683 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -11.240 10.514 -30.620 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -11.039 8.088 -30.396 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -9.432 8.224 -29.712 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -11.064 7.883 -27.893 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -10.370 9.487 -27.757 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -12.878 9.322 -27.584 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -12.288 10.473 -28.685 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -12.896 8.991 -29.250 1.00 0.00 H new ATOM 2282 N GLU B 49 -6.395 11.287 -32.318 1.00 0.00 N ATOM 2283 CA GLU B 49 -5.538 11.847 -33.413 1.00 0.00 C ATOM 2284 C GLU B 49 -4.131 12.155 -32.878 1.00 0.00 C ATOM 2285 O GLU B 49 -3.963 12.692 -31.801 1.00 0.00 O ATOM 2286 CB GLU B 49 -6.212 13.120 -33.934 1.00 0.00 C ATOM 2287 CG GLU B 49 -5.521 13.598 -35.211 1.00 0.00 C ATOM 2288 CD GLU B 49 -6.350 14.713 -35.851 1.00 0.00 C ATOM 2289 OE1 GLU B 49 -7.383 15.049 -35.294 1.00 0.00 O ATOM 2290 OE2 GLU B 49 -5.939 15.211 -36.886 1.00 0.00 O ATOM 0 H GLU B 49 -6.415 11.838 -31.460 1.00 0.00 H new ATOM 0 HA GLU B 49 -5.433 11.125 -34.223 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -7.266 12.927 -34.133 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -6.169 13.900 -33.174 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -4.519 13.961 -34.981 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -5.407 12.768 -35.909 1.00 0.00 H new ATOM 2297 N GLN B 50 -3.120 11.803 -33.632 1.00 0.00 N ATOM 2298 CA GLN B 50 -1.708 12.047 -33.199 1.00 0.00 C ATOM 2299 C GLN B 50 -1.477 13.546 -32.990 1.00 0.00 C ATOM 2300 O GLN B 50 -0.605 13.945 -32.253 1.00 0.00 O ATOM 2301 CB GLN B 50 -0.754 11.534 -34.285 1.00 0.00 C ATOM 2302 CG GLN B 50 0.689 11.543 -33.769 1.00 0.00 C ATOM 2303 CD GLN B 50 0.872 10.436 -32.727 1.00 0.00 C ATOM 2304 OE1 GLN B 50 1.133 10.756 -31.490 1.00 0.00 O flip ATOM 2305 NE2 GLN B 50 0.788 9.267 -33.046 1.00 0.00 N flip ATOM 0 H GLN B 50 -3.214 11.351 -34.541 1.00 0.00 H new ATOM 0 HA GLN B 50 -1.522 11.523 -32.262 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -1.036 10.523 -34.579 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -0.834 12.159 -35.174 1.00 0.00 H new ATOM 0 HG2 GLN B 50 1.382 11.394 -34.597 1.00 0.00 H new ATOM 0 HG3 GLN B 50 0.922 12.512 -33.328 1.00 0.00 H new ATOM 0 HE21 GLN B 50 0.584 9.016 -34.013 1.00 0.00 H new ATOM 0 HE22 GLN B 50 0.922 8.537 -32.347 1.00 0.00 H new ATOM 2314 N GLU B 51 -2.236 14.376 -33.648 1.00 0.00 N ATOM 2315 CA GLU B 51 -2.045 15.851 -33.502 1.00 0.00 C ATOM 2316 C GLU B 51 -2.245 16.271 -32.046 1.00 0.00 C ATOM 2317 O GLU B 51 -1.543 17.120 -31.549 1.00 0.00 O ATOM 2318 CB GLU B 51 -3.051 16.587 -34.403 1.00 0.00 C ATOM 2319 CG GLU B 51 -4.458 16.541 -33.778 1.00 0.00 C ATOM 2320 CD GLU B 51 -4.637 17.688 -32.773 1.00 0.00 C ATOM 2321 OE1 GLU B 51 -3.674 18.395 -32.526 1.00 0.00 O ATOM 2322 OE2 GLU B 51 -5.739 17.841 -32.273 1.00 0.00 O ATOM 0 H GLU B 51 -2.984 14.098 -34.284 1.00 0.00 H new ATOM 0 HA GLU B 51 -1.030 16.111 -33.801 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -2.739 17.623 -34.538 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -3.069 16.128 -35.391 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -5.213 16.614 -34.561 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -4.609 15.584 -33.278 1.00 0.00 H new ATOM 2329 N VAL B 52 -3.188 15.695 -31.357 1.00 0.00 N ATOM 2330 CA VAL B 52 -3.396 16.086 -29.938 1.00 0.00 C ATOM 2331 C VAL B 52 -2.115 15.796 -29.189 1.00 0.00 C ATOM 2332 O VAL B 52 -1.691 16.552 -28.350 1.00 0.00 O ATOM 2333 CB VAL B 52 -4.537 15.271 -29.337 1.00 0.00 C ATOM 2334 CG1 VAL B 52 -4.711 15.628 -27.858 1.00 0.00 C ATOM 2335 CG2 VAL B 52 -5.826 15.577 -30.094 1.00 0.00 C ATOM 0 H VAL B 52 -3.819 14.976 -31.712 1.00 0.00 H new ATOM 0 HA VAL B 52 -3.652 17.143 -29.868 1.00 0.00 H new ATOM 0 HB VAL B 52 -4.306 14.209 -29.420 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -5.527 15.042 -27.436 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -3.789 15.407 -27.319 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -4.940 16.690 -27.764 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -6.645 14.997 -29.668 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -6.053 16.640 -30.011 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -5.702 15.313 -31.144 1.00 0.00 H new ATOM 2345 N VAL B 53 -1.499 14.700 -29.497 1.00 0.00 N ATOM 2346 CA VAL B 53 -0.231 14.343 -28.824 1.00 0.00 C ATOM 2347 C VAL B 53 0.824 15.391 -29.157 1.00 0.00 C ATOM 2348 O VAL B 53 1.648 15.727 -28.341 1.00 0.00 O ATOM 2349 CB VAL B 53 0.231 12.983 -29.323 1.00 0.00 C ATOM 2350 CG1 VAL B 53 1.447 12.525 -28.531 1.00 0.00 C ATOM 2351 CG2 VAL B 53 -0.888 11.977 -29.140 1.00 0.00 C ATOM 0 H VAL B 53 -1.823 14.029 -30.193 1.00 0.00 H new ATOM 0 HA VAL B 53 -0.381 14.306 -27.745 1.00 0.00 H new ATOM 0 HB VAL B 53 0.495 13.059 -30.378 1.00 0.00 H new ATOM 0 HG11 VAL B 53 1.772 11.550 -28.894 1.00 0.00 H new ATOM 0 HG12 VAL B 53 2.255 13.246 -28.655 1.00 0.00 H new ATOM 0 HG13 VAL B 53 1.187 12.450 -27.475 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -0.561 11.000 -29.497 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -1.147 11.909 -28.083 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -1.761 12.297 -29.708 1.00 0.00 H new ATOM 2361 N ASP B 54 0.815 15.887 -30.362 1.00 0.00 N ATOM 2362 CA ASP B 54 1.822 16.905 -30.770 1.00 0.00 C ATOM 2363 C ASP B 54 1.638 18.179 -29.949 1.00 0.00 C ATOM 2364 O ASP B 54 2.586 18.833 -29.564 1.00 0.00 O ATOM 2365 CB ASP B 54 1.661 17.223 -32.258 1.00 0.00 C ATOM 2366 CG ASP B 54 2.110 16.019 -33.088 1.00 0.00 C ATOM 2367 OD1 ASP B 54 2.835 15.194 -32.554 1.00 0.00 O ATOM 2368 OD2 ASP B 54 1.728 15.944 -34.244 1.00 0.00 O ATOM 0 H ASP B 54 0.147 15.628 -31.088 1.00 0.00 H new ATOM 0 HA ASP B 54 2.821 16.508 -30.592 1.00 0.00 H new ATOM 0 HB2 ASP B 54 0.621 17.463 -32.479 1.00 0.00 H new ATOM 0 HB3 ASP B 54 2.253 18.100 -32.520 1.00 0.00 H new ATOM 2373 N LYS B 55 0.422 18.536 -29.686 1.00 0.00 N ATOM 2374 CA LYS B 55 0.155 19.765 -28.894 1.00 0.00 C ATOM 2375 C LYS B 55 0.599 19.512 -27.458 1.00 0.00 C ATOM 2376 O LYS B 55 1.174 20.362 -26.801 1.00 0.00 O ATOM 2377 CB LYS B 55 -1.338 20.103 -28.939 1.00 0.00 C ATOM 2378 CG LYS B 55 -1.552 21.484 -28.322 1.00 0.00 C ATOM 2379 CD LYS B 55 -3.030 21.872 -28.400 1.00 0.00 C ATOM 2380 CE LYS B 55 -3.227 23.255 -27.772 1.00 0.00 C ATOM 2381 NZ LYS B 55 -3.206 23.128 -26.287 1.00 0.00 N ATOM 0 H LYS B 55 -0.409 18.027 -29.987 1.00 0.00 H new ATOM 0 HA LYS B 55 0.706 20.609 -29.309 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -1.696 20.090 -29.968 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -1.911 19.353 -28.393 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -1.223 21.481 -27.283 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -0.946 22.223 -28.846 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -3.360 21.882 -29.439 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -3.639 21.134 -27.879 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -2.440 23.933 -28.102 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -4.174 23.684 -28.099 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -3.473 24.036 -25.857 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -3.880 22.393 -25.992 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -2.249 22.865 -25.975 1.00 0.00 H new ATOM 2395 N VAL B 56 0.354 18.328 -26.983 1.00 0.00 N ATOM 2396 CA VAL B 56 0.769 17.972 -25.606 1.00 0.00 C ATOM 2397 C VAL B 56 2.291 17.965 -25.571 1.00 0.00 C ATOM 2398 O VAL B 56 2.908 18.224 -24.558 1.00 0.00 O ATOM 2399 CB VAL B 56 0.208 16.589 -25.250 1.00 0.00 C ATOM 2400 CG1 VAL B 56 0.869 16.063 -23.970 1.00 0.00 C ATOM 2401 CG2 VAL B 56 -1.304 16.706 -25.031 1.00 0.00 C ATOM 0 H VAL B 56 -0.121 17.585 -27.496 1.00 0.00 H new ATOM 0 HA VAL B 56 0.388 18.689 -24.879 1.00 0.00 H new ATOM 0 HB VAL B 56 0.416 15.895 -26.065 1.00 0.00 H new ATOM 0 HG11 VAL B 56 0.463 15.081 -23.728 1.00 0.00 H new ATOM 0 HG12 VAL B 56 1.945 15.983 -24.123 1.00 0.00 H new ATOM 0 HG13 VAL B 56 0.670 16.751 -23.148 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -1.712 15.727 -24.777 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -1.501 17.403 -24.217 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -1.777 17.071 -25.943 1.00 0.00 H new ATOM 2411 N MET B 57 2.897 17.681 -26.688 1.00 0.00 N ATOM 2412 CA MET B 57 4.384 17.665 -26.749 1.00 0.00 C ATOM 2413 C MET B 57 4.897 19.094 -26.593 1.00 0.00 C ATOM 2414 O MET B 57 5.908 19.331 -25.983 1.00 0.00 O ATOM 2415 CB MET B 57 4.852 17.070 -28.100 1.00 0.00 C ATOM 2416 CG MET B 57 5.178 15.549 -27.988 1.00 0.00 C ATOM 2417 SD MET B 57 6.927 15.288 -28.439 1.00 0.00 S ATOM 2418 CE MET B 57 7.337 13.892 -27.353 1.00 0.00 C ATOM 0 H MET B 57 2.425 17.458 -27.565 1.00 0.00 H new ATOM 0 HA MET B 57 4.782 17.045 -25.946 1.00 0.00 H new ATOM 0 HB2 MET B 57 4.076 17.220 -28.850 1.00 0.00 H new ATOM 0 HB3 MET B 57 5.736 17.606 -28.445 1.00 0.00 H new ATOM 0 HG2 MET B 57 4.993 15.197 -26.973 1.00 0.00 H new ATOM 0 HG3 MET B 57 4.528 14.974 -28.648 1.00 0.00 H new ATOM 0 HE1 MET B 57 8.123 14.189 -26.659 1.00 0.00 H new ATOM 0 HE2 MET B 57 6.451 13.595 -26.792 1.00 0.00 H new ATOM 0 HE3 MET B 57 7.683 13.052 -27.955 1.00 0.00 H new ATOM 2428 N GLU B 58 4.208 20.061 -27.111 1.00 0.00 N ATOM 2429 CA GLU B 58 4.696 21.456 -26.944 1.00 0.00 C ATOM 2430 C GLU B 58 4.883 21.678 -25.456 1.00 0.00 C ATOM 2431 O GLU B 58 5.806 22.325 -25.003 1.00 0.00 O ATOM 2432 CB GLU B 58 3.638 22.435 -27.447 1.00 0.00 C ATOM 2433 CG GLU B 58 3.333 22.140 -28.907 1.00 0.00 C ATOM 2434 CD GLU B 58 2.273 23.119 -29.415 1.00 0.00 C ATOM 2435 OE1 GLU B 58 1.706 23.825 -28.596 1.00 0.00 O ATOM 2436 OE2 GLU B 58 2.044 23.147 -30.613 1.00 0.00 O ATOM 0 H GLU B 58 3.340 19.954 -27.636 1.00 0.00 H new ATOM 0 HA GLU B 58 5.621 21.611 -27.500 1.00 0.00 H new ATOM 0 HB2 GLU B 58 2.731 22.347 -26.849 1.00 0.00 H new ATOM 0 HB3 GLU B 58 3.993 23.460 -27.338 1.00 0.00 H new ATOM 0 HG2 GLU B 58 4.241 22.228 -29.504 1.00 0.00 H new ATOM 0 HG3 GLU B 58 2.978 21.115 -29.016 1.00 0.00 H new ATOM 2443 N THR B 59 3.977 21.138 -24.704 1.00 0.00 N ATOM 2444 CA THR B 59 4.021 21.282 -23.234 1.00 0.00 C ATOM 2445 C THR B 59 5.016 20.307 -22.586 1.00 0.00 C ATOM 2446 O THR B 59 5.811 20.691 -21.752 1.00 0.00 O ATOM 2447 CB THR B 59 2.618 20.999 -22.703 1.00 0.00 C ATOM 2448 OG1 THR B 59 1.664 21.655 -23.525 1.00 0.00 O ATOM 2449 CG2 THR B 59 2.491 21.507 -21.277 1.00 0.00 C ATOM 0 H THR B 59 3.191 20.591 -25.055 1.00 0.00 H new ATOM 0 HA THR B 59 4.352 22.291 -22.986 1.00 0.00 H new ATOM 0 HB THR B 59 2.439 19.924 -22.716 1.00 0.00 H new ATOM 0 HG1 THR B 59 0.762 21.474 -23.188 1.00 0.00 H new ATOM 0 HG21 THR B 59 1.487 21.301 -20.906 1.00 0.00 H new ATOM 0 HG22 THR B 59 3.222 21.003 -20.645 1.00 0.00 H new ATOM 0 HG23 THR B 59 2.672 22.582 -21.256 1.00 0.00 H new ATOM 2457 N LEU B 60 4.955 19.044 -22.923 1.00 0.00 N ATOM 2458 CA LEU B 60 5.871 18.052 -22.277 1.00 0.00 C ATOM 2459 C LEU B 60 7.174 17.922 -23.058 1.00 0.00 C ATOM 2460 O LEU B 60 8.145 17.390 -22.560 1.00 0.00 O ATOM 2461 CB LEU B 60 5.178 16.690 -22.213 1.00 0.00 C ATOM 2462 CG LEU B 60 3.756 16.851 -21.662 1.00 0.00 C ATOM 2463 CD1 LEU B 60 3.163 15.468 -21.389 1.00 0.00 C ATOM 2464 CD2 LEU B 60 3.775 17.666 -20.362 1.00 0.00 C ATOM 0 H LEU B 60 4.313 18.656 -23.615 1.00 0.00 H new ATOM 0 HA LEU B 60 6.106 18.401 -21.271 1.00 0.00 H new ATOM 0 HB2 LEU B 60 5.144 16.243 -23.207 1.00 0.00 H new ATOM 0 HB3 LEU B 60 5.748 16.012 -21.578 1.00 0.00 H new ATOM 0 HG LEU B 60 3.147 17.378 -22.397 1.00 0.00 H new ATOM 0 HD11 LEU B 60 2.152 15.577 -20.997 1.00 0.00 H new ATOM 0 HD12 LEU B 60 3.133 14.895 -22.316 1.00 0.00 H new ATOM 0 HD13 LEU B 60 3.781 14.945 -20.659 1.00 0.00 H new ATOM 0 HD21 LEU B 60 2.758 17.771 -19.984 1.00 0.00 H new ATOM 0 HD22 LEU B 60 4.387 17.153 -19.620 1.00 0.00 H new ATOM 0 HD23 LEU B 60 4.193 18.653 -20.558 1.00 0.00 H new ATOM 2476 N ASP B 61 7.228 18.411 -24.264 1.00 0.00 N ATOM 2477 CA ASP B 61 8.507 18.306 -25.027 1.00 0.00 C ATOM 2478 C ASP B 61 9.398 19.445 -24.567 1.00 0.00 C ATOM 2479 O ASP B 61 9.779 20.312 -25.329 1.00 0.00 O ATOM 2480 CB ASP B 61 8.270 18.403 -26.540 1.00 0.00 C ATOM 2481 CG ASP B 61 9.516 17.911 -27.281 1.00 0.00 C ATOM 2482 OD1 ASP B 61 10.528 17.712 -26.630 1.00 0.00 O ATOM 2483 OD2 ASP B 61 9.436 17.742 -28.487 1.00 0.00 O ATOM 0 H ASP B 61 6.458 18.871 -24.750 1.00 0.00 H new ATOM 0 HA ASP B 61 8.971 17.338 -24.839 1.00 0.00 H new ATOM 0 HB2 ASP B 61 7.405 17.804 -26.823 1.00 0.00 H new ATOM 0 HB3 ASP B 61 8.050 19.433 -26.820 1.00 0.00 H new ATOM 2488 N GLU B 62 9.713 19.452 -23.308 1.00 0.00 N ATOM 2489 CA GLU B 62 10.561 20.537 -22.756 1.00 0.00 C ATOM 2490 C GLU B 62 11.896 20.532 -23.490 1.00 0.00 C ATOM 2491 O GLU B 62 12.438 21.567 -23.825 1.00 0.00 O ATOM 2492 CB GLU B 62 10.791 20.278 -21.270 1.00 0.00 C ATOM 2493 CG GLU B 62 9.439 20.129 -20.570 1.00 0.00 C ATOM 2494 CD GLU B 62 9.656 19.977 -19.063 1.00 0.00 C ATOM 2495 OE1 GLU B 62 10.798 19.821 -18.663 1.00 0.00 O ATOM 2496 OE2 GLU B 62 8.677 20.012 -18.336 1.00 0.00 O ATOM 0 H GLU B 62 9.418 18.748 -22.632 1.00 0.00 H new ATOM 0 HA GLU B 62 10.074 21.504 -22.884 1.00 0.00 H new ATOM 0 HB2 GLU B 62 11.386 19.375 -21.134 1.00 0.00 H new ATOM 0 HB3 GLU B 62 11.354 21.100 -20.828 1.00 0.00 H new ATOM 0 HG2 GLU B 62 8.815 21.000 -20.772 1.00 0.00 H new ATOM 0 HG3 GLU B 62 8.909 19.260 -20.961 1.00 0.00 H new ATOM 2503 N ASP B 63 12.420 19.374 -23.763 1.00 0.00 N ATOM 2504 CA ASP B 63 13.707 19.304 -24.501 1.00 0.00 C ATOM 2505 C ASP B 63 13.448 19.749 -25.938 1.00 0.00 C ATOM 2506 O ASP B 63 14.352 20.119 -26.661 1.00 0.00 O ATOM 2507 CB ASP B 63 14.223 17.863 -24.504 1.00 0.00 C ATOM 2508 CG ASP B 63 14.536 17.428 -23.073 1.00 0.00 C ATOM 2509 OD1 ASP B 63 15.120 18.217 -22.348 1.00 0.00 O ATOM 2510 OD2 ASP B 63 14.183 16.314 -22.725 1.00 0.00 O ATOM 0 H ASP B 63 12.014 18.474 -23.508 1.00 0.00 H new ATOM 0 HA ASP B 63 14.450 19.945 -24.026 1.00 0.00 H new ATOM 0 HB2 ASP B 63 13.477 17.200 -24.942 1.00 0.00 H new ATOM 0 HB3 ASP B 63 15.118 17.788 -25.122 1.00 0.00 H new ATOM 2515 N GLY B 64 12.209 19.713 -26.354 1.00 0.00 N ATOM 2516 CA GLY B 64 11.880 20.132 -27.747 1.00 0.00 C ATOM 2517 C GLY B 64 12.604 19.210 -28.728 1.00 0.00 C ATOM 2518 O GLY B 64 12.997 19.621 -29.802 1.00 0.00 O ATOM 0 H GLY B 64 11.413 19.412 -25.791 1.00 0.00 H new ATOM 0 HA2 GLY B 64 10.803 20.084 -27.910 1.00 0.00 H new ATOM 0 HA3 GLY B 64 12.182 21.167 -27.910 1.00 0.00 H new ATOM 2522 N ASP B 65 12.793 17.963 -28.359 1.00 0.00 N ATOM 2523 CA ASP B 65 13.505 16.998 -29.255 1.00 0.00 C ATOM 2524 C ASP B 65 12.509 15.994 -29.836 1.00 0.00 C ATOM 2525 O ASP B 65 12.887 15.000 -30.423 1.00 0.00 O ATOM 2526 CB ASP B 65 14.582 16.269 -28.447 1.00 0.00 C ATOM 2527 CG ASP B 65 13.972 15.705 -27.164 1.00 0.00 C ATOM 2528 OD1 ASP B 65 12.816 15.995 -26.902 1.00 0.00 O ATOM 2529 OD2 ASP B 65 14.676 15.000 -26.459 1.00 0.00 O ATOM 0 H ASP B 65 12.482 17.572 -27.470 1.00 0.00 H new ATOM 0 HA ASP B 65 13.973 17.537 -30.079 1.00 0.00 H new ATOM 0 HB2 ASP B 65 15.012 15.463 -29.041 1.00 0.00 H new ATOM 0 HB3 ASP B 65 15.394 16.954 -28.204 1.00 0.00 H new ATOM 2534 N GLY B 66 11.239 16.246 -29.679 1.00 0.00 N ATOM 2535 CA GLY B 66 10.220 15.305 -30.227 1.00 0.00 C ATOM 2536 C GLY B 66 10.063 14.113 -29.283 1.00 0.00 C ATOM 2537 O GLY B 66 9.310 13.196 -29.541 1.00 0.00 O ATOM 0 H GLY B 66 10.862 17.061 -29.196 1.00 0.00 H new ATOM 0 HA2 GLY B 66 9.265 15.816 -30.346 1.00 0.00 H new ATOM 0 HA3 GLY B 66 10.522 14.961 -31.216 1.00 0.00 H new ATOM 2541 N GLU B 67 10.770 14.127 -28.187 1.00 0.00 N ATOM 2542 CA GLU B 67 10.680 13.015 -27.198 1.00 0.00 C ATOM 2543 C GLU B 67 10.829 13.597 -25.790 1.00 0.00 C ATOM 2544 O GLU B 67 11.701 14.402 -25.531 1.00 0.00 O ATOM 2545 CB GLU B 67 11.783 11.986 -27.478 1.00 0.00 C ATOM 2546 CG GLU B 67 13.143 12.675 -27.565 1.00 0.00 C ATOM 2547 CD GLU B 67 14.185 11.668 -28.055 1.00 0.00 C ATOM 2548 OE1 GLU B 67 13.871 10.488 -28.083 1.00 0.00 O ATOM 2549 OE2 GLU B 67 15.275 12.092 -28.401 1.00 0.00 O ATOM 0 H GLU B 67 11.416 14.873 -27.931 1.00 0.00 H new ATOM 0 HA GLU B 67 9.715 12.514 -27.279 1.00 0.00 H new ATOM 0 HB2 GLU B 67 11.798 11.235 -26.688 1.00 0.00 H new ATOM 0 HB3 GLU B 67 11.573 11.463 -28.411 1.00 0.00 H new ATOM 0 HG2 GLU B 67 13.091 13.524 -28.247 1.00 0.00 H new ATOM 0 HG3 GLU B 67 13.429 13.067 -26.589 1.00 0.00 H new ATOM 2556 N CYS B 68 9.977 13.195 -24.878 1.00 0.00 N ATOM 2557 CA CYS B 68 10.052 13.722 -23.474 1.00 0.00 C ATOM 2558 C CYS B 68 10.746 12.680 -22.601 1.00 0.00 C ATOM 2559 O CYS B 68 10.532 11.493 -22.741 1.00 0.00 O ATOM 2560 CB CYS B 68 8.627 14.023 -22.927 1.00 0.00 C ATOM 2561 SG CYS B 68 7.388 13.675 -24.202 1.00 0.00 S ATOM 0 H CYS B 68 9.229 12.522 -25.044 1.00 0.00 H new ATOM 0 HA CYS B 68 10.619 14.653 -23.461 1.00 0.00 H new ATOM 0 HB2 CYS B 68 8.432 13.416 -22.043 1.00 0.00 H new ATOM 0 HB3 CYS B 68 8.560 15.066 -22.618 1.00 0.00 H new ATOM 0 HG CYS B 68 6.869 14.792 -24.619 1.00 0.00 H new ATOM 2567 N ASP B 69 11.567 13.118 -21.697 1.00 0.00 N ATOM 2568 CA ASP B 69 12.269 12.160 -20.809 1.00 0.00 C ATOM 2569 C ASP B 69 11.294 11.712 -19.730 1.00 0.00 C ATOM 2570 O ASP B 69 10.309 12.375 -19.471 1.00 0.00 O ATOM 2571 CB ASP B 69 13.469 12.850 -20.155 1.00 0.00 C ATOM 2572 CG ASP B 69 14.482 13.243 -21.231 1.00 0.00 C ATOM 2573 OD1 ASP B 69 14.410 12.689 -22.316 1.00 0.00 O ATOM 2574 OD2 ASP B 69 15.314 14.090 -20.952 1.00 0.00 O ATOM 0 H ASP B 69 11.783 14.101 -21.534 1.00 0.00 H new ATOM 0 HA ASP B 69 12.622 11.303 -21.383 1.00 0.00 H new ATOM 0 HB2 ASP B 69 13.140 13.735 -19.610 1.00 0.00 H new ATOM 0 HB3 ASP B 69 13.934 12.183 -19.429 1.00 0.00 H new ATOM 2579 N PHE B 70 11.553 10.605 -19.088 1.00 0.00 N ATOM 2580 CA PHE B 70 10.641 10.138 -18.019 1.00 0.00 C ATOM 2581 C PHE B 70 10.314 11.328 -17.111 1.00 0.00 C ATOM 2582 O PHE B 70 9.219 11.466 -16.635 1.00 0.00 O ATOM 2583 CB PHE B 70 11.349 9.028 -17.233 1.00 0.00 C ATOM 2584 CG PHE B 70 10.649 8.773 -15.918 1.00 0.00 C ATOM 2585 CD1 PHE B 70 9.276 8.508 -15.894 1.00 0.00 C ATOM 2586 CD2 PHE B 70 11.377 8.795 -14.723 1.00 0.00 C ATOM 2587 CE1 PHE B 70 8.632 8.265 -14.679 1.00 0.00 C ATOM 2588 CE2 PHE B 70 10.733 8.553 -13.510 1.00 0.00 C ATOM 2589 CZ PHE B 70 9.359 8.287 -13.485 1.00 0.00 C ATOM 0 H PHE B 70 12.360 10.006 -19.262 1.00 0.00 H new ATOM 0 HA PHE B 70 9.713 9.742 -18.431 1.00 0.00 H new ATOM 0 HB2 PHE B 70 11.367 8.112 -17.824 1.00 0.00 H new ATOM 0 HB3 PHE B 70 12.386 9.310 -17.050 1.00 0.00 H new ATOM 0 HD1 PHE B 70 8.713 8.491 -16.816 1.00 0.00 H new ATOM 0 HD2 PHE B 70 12.437 8.999 -14.740 1.00 0.00 H new ATOM 0 HE1 PHE B 70 7.572 8.060 -14.662 1.00 0.00 H new ATOM 0 HE2 PHE B 70 11.295 8.571 -12.588 1.00 0.00 H new ATOM 0 HZ PHE B 70 8.861 8.099 -12.545 1.00 0.00 H new ATOM 2599 N GLN B 71 11.264 12.195 -16.902 1.00 0.00 N ATOM 2600 CA GLN B 71 11.027 13.399 -16.052 1.00 0.00 C ATOM 2601 C GLN B 71 9.901 14.268 -16.633 1.00 0.00 C ATOM 2602 O GLN B 71 9.000 14.683 -15.933 1.00 0.00 O ATOM 2603 CB GLN B 71 12.324 14.222 -16.001 1.00 0.00 C ATOM 2604 CG GLN B 71 12.063 15.591 -15.358 1.00 0.00 C ATOM 2605 CD GLN B 71 13.393 16.297 -15.087 1.00 0.00 C ATOM 2606 OE1 GLN B 71 14.251 16.354 -15.945 1.00 0.00 O ATOM 2607 NE2 GLN B 71 13.601 16.843 -13.920 1.00 0.00 N ATOM 0 H GLN B 71 12.206 12.122 -17.287 1.00 0.00 H new ATOM 0 HA GLN B 71 10.732 13.077 -15.053 1.00 0.00 H new ATOM 0 HB2 GLN B 71 13.082 13.684 -15.431 1.00 0.00 H new ATOM 0 HB3 GLN B 71 12.718 14.355 -17.009 1.00 0.00 H new ATOM 0 HG2 GLN B 71 11.445 16.201 -16.017 1.00 0.00 H new ATOM 0 HG3 GLN B 71 11.510 15.466 -14.427 1.00 0.00 H new ATOM 0 HE21 GLN B 71 12.881 16.796 -13.199 1.00 0.00 H new ATOM 0 HE22 GLN B 71 14.484 17.317 -13.729 1.00 0.00 H new ATOM 2616 N GLU B 72 9.970 14.581 -17.895 1.00 0.00 N ATOM 2617 CA GLU B 72 8.929 15.461 -18.501 1.00 0.00 C ATOM 2618 C GLU B 72 7.543 14.827 -18.374 1.00 0.00 C ATOM 2619 O GLU B 72 6.561 15.498 -18.096 1.00 0.00 O ATOM 2620 CB GLU B 72 9.271 15.679 -19.976 1.00 0.00 C ATOM 2621 CG GLU B 72 10.518 16.561 -20.082 1.00 0.00 C ATOM 2622 CD GLU B 72 11.010 16.588 -21.530 1.00 0.00 C ATOM 2623 OE1 GLU B 72 10.491 17.382 -22.297 1.00 0.00 O ATOM 2624 OE2 GLU B 72 11.901 15.817 -21.847 1.00 0.00 O ATOM 0 H GLU B 72 10.700 14.267 -18.534 1.00 0.00 H new ATOM 0 HA GLU B 72 8.912 16.416 -17.975 1.00 0.00 H new ATOM 0 HB2 GLU B 72 9.446 14.721 -20.466 1.00 0.00 H new ATOM 0 HB3 GLU B 72 8.433 16.151 -20.489 1.00 0.00 H new ATOM 0 HG2 GLU B 72 10.289 17.573 -19.747 1.00 0.00 H new ATOM 0 HG3 GLU B 72 11.302 16.179 -19.429 1.00 0.00 H new ATOM 2631 N PHE B 73 7.447 13.547 -18.565 1.00 0.00 N ATOM 2632 CA PHE B 73 6.119 12.893 -18.448 1.00 0.00 C ATOM 2633 C PHE B 73 5.683 12.895 -16.987 1.00 0.00 C ATOM 2634 O PHE B 73 4.511 12.951 -16.690 1.00 0.00 O ATOM 2635 CB PHE B 73 6.178 11.450 -18.959 1.00 0.00 C ATOM 2636 CG PHE B 73 4.870 10.769 -18.627 1.00 0.00 C ATOM 2637 CD1 PHE B 73 3.785 10.865 -19.504 1.00 0.00 C ATOM 2638 CD2 PHE B 73 4.738 10.063 -17.426 1.00 0.00 C ATOM 2639 CE1 PHE B 73 2.567 10.256 -19.180 1.00 0.00 C ATOM 2640 CE2 PHE B 73 3.523 9.450 -17.103 1.00 0.00 C ATOM 2641 CZ PHE B 73 2.437 9.547 -17.979 1.00 0.00 C ATOM 0 H PHE B 73 8.224 12.927 -18.796 1.00 0.00 H new ATOM 0 HA PHE B 73 5.402 13.448 -19.053 1.00 0.00 H new ATOM 0 HB2 PHE B 73 6.350 11.436 -20.035 1.00 0.00 H new ATOM 0 HB3 PHE B 73 7.010 10.918 -18.497 1.00 0.00 H new ATOM 0 HD1 PHE B 73 3.887 11.409 -20.431 1.00 0.00 H new ATOM 0 HD2 PHE B 73 5.575 9.991 -16.748 1.00 0.00 H new ATOM 0 HE1 PHE B 73 1.728 10.333 -19.856 1.00 0.00 H new ATOM 0 HE2 PHE B 73 3.423 8.902 -16.178 1.00 0.00 H new ATOM 0 HZ PHE B 73 1.498 9.075 -17.729 1.00 0.00 H new ATOM 2651 N MET B 74 6.615 12.820 -16.082 1.00 0.00 N ATOM 2652 CA MET B 74 6.258 12.795 -14.641 1.00 0.00 C ATOM 2653 C MET B 74 5.503 14.067 -14.276 1.00 0.00 C ATOM 2654 O MET B 74 4.587 14.051 -13.475 1.00 0.00 O ATOM 2655 CB MET B 74 7.522 12.670 -13.772 1.00 0.00 C ATOM 2656 CG MET B 74 8.004 11.208 -13.723 1.00 0.00 C ATOM 2657 SD MET B 74 6.749 10.141 -12.958 1.00 0.00 S ATOM 2658 CE MET B 74 6.698 10.953 -11.347 1.00 0.00 C ATOM 0 H MET B 74 7.614 12.775 -16.281 1.00 0.00 H new ATOM 0 HA MET B 74 5.622 11.930 -14.454 1.00 0.00 H new ATOM 0 HB2 MET B 74 8.311 13.305 -14.175 1.00 0.00 H new ATOM 0 HB3 MET B 74 7.312 13.023 -12.762 1.00 0.00 H new ATOM 0 HG2 MET B 74 8.220 10.857 -14.732 1.00 0.00 H new ATOM 0 HG3 MET B 74 8.934 11.146 -13.158 1.00 0.00 H new ATOM 0 HE1 MET B 74 6.239 10.286 -10.618 1.00 0.00 H new ATOM 0 HE2 MET B 74 7.712 11.195 -11.029 1.00 0.00 H new ATOM 0 HE3 MET B 74 6.112 11.869 -11.420 1.00 0.00 H new ATOM 2668 N ALA B 75 5.886 15.174 -14.827 1.00 0.00 N ATOM 2669 CA ALA B 75 5.182 16.427 -14.470 1.00 0.00 C ATOM 2670 C ALA B 75 3.735 16.396 -14.972 1.00 0.00 C ATOM 2671 O ALA B 75 2.831 16.886 -14.321 1.00 0.00 O ATOM 2672 CB ALA B 75 5.931 17.626 -15.066 1.00 0.00 C ATOM 0 H ALA B 75 6.646 15.268 -15.501 1.00 0.00 H new ATOM 0 HA ALA B 75 5.160 16.523 -13.384 1.00 0.00 H new ATOM 0 HB1 ALA B 75 5.411 18.547 -14.802 1.00 0.00 H new ATOM 0 HB2 ALA B 75 6.946 17.655 -14.669 1.00 0.00 H new ATOM 0 HB3 ALA B 75 5.969 17.529 -16.151 1.00 0.00 H new ATOM 2678 N PHE B 76 3.506 15.830 -16.118 1.00 0.00 N ATOM 2679 CA PHE B 76 2.109 15.776 -16.657 1.00 0.00 C ATOM 2680 C PHE B 76 1.197 15.015 -15.696 1.00 0.00 C ATOM 2681 O PHE B 76 0.060 15.369 -15.490 1.00 0.00 O ATOM 2682 CB PHE B 76 2.127 15.066 -18.011 1.00 0.00 C ATOM 2683 CG PHE B 76 0.733 15.042 -18.593 1.00 0.00 C ATOM 2684 CD1 PHE B 76 0.131 16.238 -19.002 1.00 0.00 C ATOM 2685 CD2 PHE B 76 0.045 13.830 -18.732 1.00 0.00 C ATOM 2686 CE1 PHE B 76 -1.157 16.223 -19.547 1.00 0.00 C ATOM 2687 CE2 PHE B 76 -1.244 13.815 -19.278 1.00 0.00 C ATOM 2688 CZ PHE B 76 -1.845 15.012 -19.685 1.00 0.00 C ATOM 0 H PHE B 76 4.218 15.401 -16.709 1.00 0.00 H new ATOM 0 HA PHE B 76 1.729 16.791 -16.770 1.00 0.00 H new ATOM 0 HB2 PHE B 76 2.807 15.578 -18.692 1.00 0.00 H new ATOM 0 HB3 PHE B 76 2.500 14.049 -17.894 1.00 0.00 H new ATOM 0 HD1 PHE B 76 0.662 17.173 -18.897 1.00 0.00 H new ATOM 0 HD2 PHE B 76 0.509 12.907 -18.418 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -1.621 17.146 -19.861 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -1.774 12.880 -19.385 1.00 0.00 H new ATOM 0 HZ PHE B 76 -2.840 15.001 -20.106 1.00 0.00 H new ATOM 2698 N VAL B 77 1.694 13.964 -15.137 1.00 0.00 N ATOM 2699 CA VAL B 77 0.888 13.120 -14.196 1.00 0.00 C ATOM 2700 C VAL B 77 0.441 13.947 -13.000 1.00 0.00 C ATOM 2701 O VAL B 77 -0.627 13.755 -12.472 1.00 0.00 O ATOM 2702 CB VAL B 77 1.742 11.933 -13.706 1.00 0.00 C ATOM 2703 CG1 VAL B 77 0.872 10.695 -13.475 1.00 0.00 C ATOM 2704 CG2 VAL B 77 2.800 11.629 -14.753 1.00 0.00 C ATOM 0 H VAL B 77 2.648 13.635 -15.288 1.00 0.00 H new ATOM 0 HA VAL B 77 0.008 12.748 -14.721 1.00 0.00 H new ATOM 0 HB VAL B 77 2.213 12.198 -12.759 1.00 0.00 H new ATOM 0 HG11 VAL B 77 1.496 9.871 -13.130 1.00 0.00 H new ATOM 0 HG12 VAL B 77 0.116 10.917 -12.722 1.00 0.00 H new ATOM 0 HG13 VAL B 77 0.384 10.414 -14.408 1.00 0.00 H new ATOM 0 HG21 VAL B 77 3.412 10.791 -14.419 1.00 0.00 H new ATOM 0 HG22 VAL B 77 2.316 11.373 -15.695 1.00 0.00 H new ATOM 0 HG23 VAL B 77 3.432 12.505 -14.896 1.00 0.00 H new ATOM 2714 N SER B 78 1.263 14.839 -12.548 1.00 0.00 N ATOM 2715 CA SER B 78 0.875 15.647 -11.366 1.00 0.00 C ATOM 2716 C SER B 78 -0.352 16.482 -11.701 1.00 0.00 C ATOM 2717 O SER B 78 -1.241 16.646 -10.890 1.00 0.00 O ATOM 2718 CB SER B 78 2.022 16.578 -10.974 1.00 0.00 C ATOM 2719 OG SER B 78 1.497 17.693 -10.266 1.00 0.00 O ATOM 0 H SER B 78 2.182 15.045 -12.940 1.00 0.00 H new ATOM 0 HA SER B 78 0.651 14.977 -10.536 1.00 0.00 H new ATOM 0 HB2 SER B 78 2.743 16.045 -10.354 1.00 0.00 H new ATOM 0 HB3 SER B 78 2.554 16.915 -11.864 1.00 0.00 H new ATOM 0 HG SER B 78 1.717 18.519 -10.746 1.00 0.00 H new ATOM 2725 N MET B 79 -0.408 17.026 -12.883 1.00 0.00 N ATOM 2726 CA MET B 79 -1.586 17.865 -13.234 1.00 0.00 C ATOM 2727 C MET B 79 -2.835 17.008 -13.420 1.00 0.00 C ATOM 2728 O MET B 79 -3.899 17.341 -12.937 1.00 0.00 O ATOM 2729 CB MET B 79 -1.330 18.617 -14.534 1.00 0.00 C ATOM 2730 CG MET B 79 -0.112 19.529 -14.403 1.00 0.00 C ATOM 2731 SD MET B 79 -0.198 20.812 -15.681 1.00 0.00 S ATOM 2732 CE MET B 79 -0.607 19.737 -17.083 1.00 0.00 C ATOM 0 H MET B 79 0.299 16.929 -13.612 1.00 0.00 H new ATOM 0 HA MET B 79 -1.743 18.566 -12.414 1.00 0.00 H new ATOM 0 HB2 MET B 79 -1.172 17.906 -15.345 1.00 0.00 H new ATOM 0 HB3 MET B 79 -2.207 19.209 -14.795 1.00 0.00 H new ATOM 0 HG2 MET B 79 -0.087 19.984 -13.413 1.00 0.00 H new ATOM 0 HG3 MET B 79 0.805 18.950 -14.511 1.00 0.00 H new ATOM 0 HE1 MET B 79 -0.413 20.266 -18.016 1.00 0.00 H new ATOM 0 HE2 MET B 79 0.006 18.837 -17.042 1.00 0.00 H new ATOM 0 HE3 MET B 79 -1.660 19.461 -17.035 1.00 0.00 H new ATOM 2742 N VAL B 80 -2.732 15.927 -14.136 1.00 0.00 N ATOM 2743 CA VAL B 80 -3.948 15.091 -14.363 1.00 0.00 C ATOM 2744 C VAL B 80 -4.481 14.589 -13.027 1.00 0.00 C ATOM 2745 O VAL B 80 -5.673 14.507 -12.805 1.00 0.00 O ATOM 2746 CB VAL B 80 -3.642 13.899 -15.263 1.00 0.00 C ATOM 2747 CG1 VAL B 80 -4.958 13.201 -15.610 1.00 0.00 C ATOM 2748 CG2 VAL B 80 -2.969 14.375 -16.549 1.00 0.00 C ATOM 0 H VAL B 80 -1.874 15.586 -14.570 1.00 0.00 H new ATOM 0 HA VAL B 80 -4.696 15.711 -14.856 1.00 0.00 H new ATOM 0 HB VAL B 80 -2.972 13.211 -14.747 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -4.757 12.345 -16.254 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -5.442 12.861 -14.694 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.614 13.899 -16.129 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -2.754 13.517 -17.186 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -3.633 15.060 -17.075 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -2.039 14.888 -16.305 1.00 0.00 H new ATOM 2758 N THR B 81 -3.601 14.251 -12.141 1.00 0.00 N ATOM 2759 CA THR B 81 -4.023 13.746 -10.811 1.00 0.00 C ATOM 2760 C THR B 81 -4.849 14.827 -10.133 1.00 0.00 C ATOM 2761 O THR B 81 -5.838 14.560 -9.482 1.00 0.00 O ATOM 2762 CB THR B 81 -2.794 13.433 -9.964 1.00 0.00 C ATOM 2763 OG1 THR B 81 -2.011 12.446 -10.615 1.00 0.00 O ATOM 2764 CG2 THR B 81 -3.238 12.911 -8.597 1.00 0.00 C ATOM 0 H THR B 81 -2.592 14.303 -12.280 1.00 0.00 H new ATOM 0 HA THR B 81 -4.611 12.835 -10.924 1.00 0.00 H new ATOM 0 HB THR B 81 -2.202 14.339 -9.833 1.00 0.00 H new ATOM 0 HG1 THR B 81 -1.610 12.827 -11.424 1.00 0.00 H new ATOM 0 HG21 THR B 81 -2.360 12.687 -7.991 1.00 0.00 H new ATOM 0 HG22 THR B 81 -3.841 13.669 -8.097 1.00 0.00 H new ATOM 0 HG23 THR B 81 -3.829 12.005 -8.728 1.00 0.00 H new ATOM 2772 N THR B 82 -4.448 16.053 -10.284 1.00 0.00 N ATOM 2773 CA THR B 82 -5.206 17.159 -9.656 1.00 0.00 C ATOM 2774 C THR B 82 -6.647 17.088 -10.171 1.00 0.00 C ATOM 2775 O THR B 82 -7.599 17.276 -9.433 1.00 0.00 O ATOM 2776 CB THR B 82 -4.559 18.491 -10.050 1.00 0.00 C ATOM 2777 OG1 THR B 82 -3.170 18.439 -9.758 1.00 0.00 O ATOM 2778 CG2 THR B 82 -5.193 19.622 -9.247 1.00 0.00 C ATOM 0 H THR B 82 -3.626 16.336 -10.817 1.00 0.00 H new ATOM 0 HA THR B 82 -5.199 17.078 -8.569 1.00 0.00 H new ATOM 0 HB THR B 82 -4.710 18.668 -11.115 1.00 0.00 H new ATOM 0 HG1 THR B 82 -2.724 17.845 -10.397 1.00 0.00 H new ATOM 0 HG21 THR B 82 -4.733 20.570 -9.527 1.00 0.00 H new ATOM 0 HG22 THR B 82 -6.262 19.662 -9.456 1.00 0.00 H new ATOM 0 HG23 THR B 82 -5.038 19.444 -8.183 1.00 0.00 H new ATOM 2786 N ALA B 83 -6.812 16.788 -11.430 1.00 0.00 N ATOM 2787 CA ALA B 83 -8.182 16.671 -12.001 1.00 0.00 C ATOM 2788 C ALA B 83 -8.943 15.567 -11.250 1.00 0.00 C ATOM 2789 O ALA B 83 -10.116 15.691 -10.965 1.00 0.00 O ATOM 2790 CB ALA B 83 -8.074 16.315 -13.498 1.00 0.00 C ATOM 0 H ALA B 83 -6.053 16.618 -12.090 1.00 0.00 H new ATOM 0 HA ALA B 83 -8.718 17.614 -11.895 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -9.073 16.227 -13.924 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -7.525 17.099 -14.020 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -7.548 15.367 -13.610 1.00 0.00 H new ATOM 2796 N CYS B 84 -8.275 14.487 -10.938 1.00 0.00 N ATOM 2797 CA CYS B 84 -8.946 13.364 -10.221 1.00 0.00 C ATOM 2798 C CYS B 84 -9.509 13.859 -8.891 1.00 0.00 C ATOM 2799 O CYS B 84 -10.548 13.413 -8.448 1.00 0.00 O ATOM 2800 CB CYS B 84 -7.936 12.248 -9.950 1.00 0.00 C ATOM 2801 SG CYS B 84 -7.255 11.656 -11.519 1.00 0.00 S ATOM 0 H CYS B 84 -7.289 14.335 -11.150 1.00 0.00 H new ATOM 0 HA CYS B 84 -9.757 12.984 -10.842 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -7.135 12.616 -9.309 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -8.418 11.428 -9.418 1.00 0.00 H new ATOM 0 HG CYS B 84 -6.613 12.622 -12.106 1.00 0.00 H new ATOM 2807 N HIS B 85 -8.844 14.779 -8.248 1.00 0.00 N ATOM 2808 CA HIS B 85 -9.368 15.282 -6.952 1.00 0.00 C ATOM 2809 C HIS B 85 -10.745 15.886 -7.189 1.00 0.00 C ATOM 2810 O HIS B 85 -11.652 15.711 -6.402 1.00 0.00 O ATOM 2811 CB HIS B 85 -8.431 16.359 -6.401 1.00 0.00 C ATOM 2812 CG HIS B 85 -8.992 16.907 -5.117 1.00 0.00 C ATOM 2813 ND1 HIS B 85 -9.026 18.269 -4.850 1.00 0.00 N ATOM 2814 CD2 HIS B 85 -9.554 16.297 -4.022 1.00 0.00 C ATOM 2815 CE1 HIS B 85 -9.590 18.433 -3.639 1.00 0.00 C ATOM 2816 NE2 HIS B 85 -9.929 17.263 -3.095 1.00 0.00 N ATOM 0 H HIS B 85 -7.969 15.199 -8.562 1.00 0.00 H new ATOM 0 HA HIS B 85 -9.433 14.464 -6.235 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -7.440 15.939 -6.227 1.00 0.00 H new ATOM 0 HB3 HIS B 85 -8.314 17.161 -7.130 1.00 0.00 H new ATOM 0 HD2 HIS B 85 -9.684 15.232 -3.900 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -9.748 19.391 -3.167 1.00 0.00 H new ATOM 0 HE2 HIS B 85 -10.371 17.109 -2.189 1.00 0.00 H new ATOM 2825 N GLU B 86 -10.913 16.585 -8.273 1.00 0.00 N ATOM 2826 CA GLU B 86 -12.241 17.188 -8.561 1.00 0.00 C ATOM 2827 C GLU B 86 -13.289 16.078 -8.714 1.00 0.00 C ATOM 2828 O GLU B 86 -14.411 16.205 -8.263 1.00 0.00 O ATOM 2829 CB GLU B 86 -12.159 17.993 -9.859 1.00 0.00 C ATOM 2830 CG GLU B 86 -11.248 19.206 -9.652 1.00 0.00 C ATOM 2831 CD GLU B 86 -11.923 20.203 -8.709 1.00 0.00 C ATOM 2832 OE1 GLU B 86 -13.130 20.353 -8.801 1.00 0.00 O ATOM 2833 OE2 GLU B 86 -11.220 20.804 -7.913 1.00 0.00 O ATOM 0 H GLU B 86 -10.191 16.765 -8.971 1.00 0.00 H new ATOM 0 HA GLU B 86 -12.528 17.844 -7.739 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -11.772 17.367 -10.663 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -13.154 18.320 -10.160 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -10.292 18.888 -9.237 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -11.037 19.682 -10.610 1.00 0.00 H new ATOM 2840 N PHE B 87 -12.935 14.992 -9.353 1.00 0.00 N ATOM 2841 CA PHE B 87 -13.918 13.877 -9.543 1.00 0.00 C ATOM 2842 C PHE B 87 -13.940 12.971 -8.308 1.00 0.00 C ATOM 2843 O PHE B 87 -14.952 12.387 -7.974 1.00 0.00 O ATOM 2844 CB PHE B 87 -13.529 13.047 -10.772 1.00 0.00 C ATOM 2845 CG PHE B 87 -13.762 13.856 -12.026 1.00 0.00 C ATOM 2846 CD1 PHE B 87 -15.039 13.916 -12.597 1.00 0.00 C ATOM 2847 CD2 PHE B 87 -12.701 14.552 -12.615 1.00 0.00 C ATOM 2848 CE1 PHE B 87 -15.253 14.671 -13.757 1.00 0.00 C ATOM 2849 CE2 PHE B 87 -12.914 15.307 -13.773 1.00 0.00 C ATOM 2850 CZ PHE B 87 -14.190 15.366 -14.345 1.00 0.00 C ATOM 0 H PHE B 87 -12.011 14.827 -9.751 1.00 0.00 H new ATOM 0 HA PHE B 87 -14.909 14.307 -9.688 1.00 0.00 H new ATOM 0 HB2 PHE B 87 -12.482 12.752 -10.707 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -14.117 12.130 -10.805 1.00 0.00 H new ATOM 0 HD1 PHE B 87 -15.859 13.380 -12.143 1.00 0.00 H new ATOM 0 HD2 PHE B 87 -11.716 14.506 -12.175 1.00 0.00 H new ATOM 0 HE1 PHE B 87 -16.238 14.717 -14.198 1.00 0.00 H new ATOM 0 HE2 PHE B 87 -12.094 15.844 -14.226 1.00 0.00 H new ATOM 0 HZ PHE B 87 -14.354 15.948 -15.240 1.00 0.00 H new ATOM 2860 N PHE B 88 -12.830 12.841 -7.633 1.00 0.00 N ATOM 2861 CA PHE B 88 -12.774 11.966 -6.421 1.00 0.00 C ATOM 2862 C PHE B 88 -13.029 12.825 -5.189 1.00 0.00 C ATOM 2863 O PHE B 88 -12.875 12.388 -4.066 1.00 0.00 O ATOM 2864 CB PHE B 88 -11.387 11.311 -6.319 1.00 0.00 C ATOM 2865 CG PHE B 88 -11.298 10.157 -7.296 1.00 0.00 C ATOM 2866 CD1 PHE B 88 -11.472 10.388 -8.665 1.00 0.00 C ATOM 2867 CD2 PHE B 88 -11.059 8.855 -6.833 1.00 0.00 C ATOM 2868 CE1 PHE B 88 -11.404 9.322 -9.571 1.00 0.00 C ATOM 2869 CE2 PHE B 88 -10.996 7.789 -7.739 1.00 0.00 C ATOM 2870 CZ PHE B 88 -11.167 8.022 -9.108 1.00 0.00 C ATOM 0 H PHE B 88 -11.953 13.305 -7.869 1.00 0.00 H new ATOM 0 HA PHE B 88 -13.529 11.183 -6.491 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -10.610 12.045 -6.535 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -11.215 10.955 -5.303 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -11.659 11.389 -9.024 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -10.923 8.674 -5.777 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -11.534 9.503 -10.628 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -10.815 6.786 -7.381 1.00 0.00 H new ATOM 0 HZ PHE B 88 -11.116 7.200 -9.807 1.00 0.00 H new ATOM 2880 N GLU B 89 -13.409 14.052 -5.398 1.00 0.00 N ATOM 2881 CA GLU B 89 -13.665 14.956 -4.243 1.00 0.00 C ATOM 2882 C GLU B 89 -14.698 14.324 -3.317 1.00 0.00 C ATOM 2883 O GLU B 89 -15.889 14.407 -3.541 1.00 0.00 O ATOM 2884 CB GLU B 89 -14.203 16.302 -4.732 1.00 0.00 C ATOM 2885 CG GLU B 89 -14.306 17.267 -3.550 1.00 0.00 C ATOM 2886 CD GLU B 89 -14.794 18.630 -4.043 1.00 0.00 C ATOM 2887 OE1 GLU B 89 -15.049 18.751 -5.230 1.00 0.00 O ATOM 2888 OE2 GLU B 89 -14.910 19.527 -3.225 1.00 0.00 O ATOM 0 H GLU B 89 -13.554 14.469 -6.318 1.00 0.00 H new ATOM 0 HA GLU B 89 -12.727 15.111 -3.709 1.00 0.00 H new ATOM 0 HB2 GLU B 89 -13.543 16.714 -5.496 1.00 0.00 H new ATOM 0 HB3 GLU B 89 -15.181 16.169 -5.194 1.00 0.00 H new ATOM 0 HG2 GLU B 89 -14.994 16.871 -2.803 1.00 0.00 H new ATOM 0 HG3 GLU B 89 -13.335 17.370 -3.066 1.00 0.00 H new ATOM 2895 N HIS B 90 -14.244 13.707 -2.269 1.00 0.00 N ATOM 2896 CA HIS B 90 -15.182 13.078 -1.304 1.00 0.00 C ATOM 2897 C HIS B 90 -16.098 14.160 -0.733 1.00 0.00 C ATOM 2898 O HIS B 90 -17.267 13.935 -0.498 1.00 0.00 O ATOM 2899 CB HIS B 90 -14.383 12.408 -0.186 1.00 0.00 C ATOM 2900 CG HIS B 90 -13.651 11.228 -0.763 1.00 0.00 C ATOM 2901 ND1 HIS B 90 -12.291 11.031 -0.569 1.00 0.00 N ATOM 2902 CD2 HIS B 90 -14.073 10.188 -1.555 1.00 0.00 C ATOM 2903 CE1 HIS B 90 -11.945 9.912 -1.235 1.00 0.00 C ATOM 2904 NE2 HIS B 90 -12.994 9.363 -1.850 1.00 0.00 N ATOM 0 H HIS B 90 -13.256 13.610 -2.036 1.00 0.00 H new ATOM 0 HA HIS B 90 -15.788 12.321 -1.801 1.00 0.00 H new ATOM 0 HB2 HIS B 90 -13.677 13.115 0.251 1.00 0.00 H new ATOM 0 HB3 HIS B 90 -15.049 12.086 0.615 1.00 0.00 H new ATOM 0 HD2 HIS B 90 -15.086 10.035 -1.896 1.00 0.00 H new ATOM 0 HE1 HIS B 90 -10.943 9.510 -1.267 1.00 0.00 H new ATOM 0 HE2 HIS B 90 -13.002 8.516 -2.418 1.00 0.00 H new ATOM 2913 N GLU B 91 -15.562 15.332 -0.513 1.00 0.00 N ATOM 2914 CA GLU B 91 -16.375 16.459 0.036 1.00 0.00 C ATOM 2915 CB GLU B 91 -17.565 16.744 -0.890 1.00 0.00 C ATOM 2916 CG GLU B 91 -18.202 18.083 -0.515 1.00 0.00 C ATOM 2917 CD GLU B 91 -19.276 18.440 -1.545 1.00 0.00 C ATOM 2918 OE1 GLU B 91 -20.413 18.044 -1.348 1.00 0.00 O ATOM 2919 OE2 GLU B 91 -18.941 19.100 -2.515 1.00 0.00 O ATOM 0 H GLU B 91 -14.584 15.559 -0.692 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -17.233 16.766 -1.928 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -18.301 15.945 -0.808 1.00 0.00 H new ATOM 0 HG2 GLU B 91 -18.642 18.023 0.480 1.00 0.00 H new ATOM 0 HG3 GLU B 91 -17.442 18.863 -0.481 1.00 0.00 H new TER 2926 GLU B 91 ATOM 2927 N SER X 92 20.001 20.907 19.276 1.00 0.00 N ATOM 2928 CA SER X 92 20.307 21.949 18.255 1.00 0.00 C ATOM 2929 C SER X 92 21.821 22.153 18.177 1.00 0.00 C ATOM 2930 O SER X 92 22.295 23.214 17.820 1.00 0.00 O ATOM 2931 CB SER X 92 19.636 23.265 18.652 1.00 0.00 C ATOM 2932 OG SER X 92 20.042 24.289 17.755 1.00 0.00 O ATOM 0 HA SER X 92 19.931 21.629 17.283 1.00 0.00 H new ATOM 0 HB2 SER X 92 18.552 23.155 18.629 1.00 0.00 H new ATOM 0 HB3 SER X 92 19.908 23.532 19.673 1.00 0.00 H new ATOM 0 HG SER X 92 21.015 24.399 17.802 1.00 0.00 H new ATOM 2940 N HIS X 93 22.584 21.145 18.513 1.00 0.00 N ATOM 2941 CA HIS X 93 24.071 21.277 18.467 1.00 0.00 C ATOM 2942 C HIS X 93 24.486 22.610 19.099 1.00 0.00 C ATOM 2943 O HIS X 93 23.702 23.257 19.765 1.00 0.00 O ATOM 2944 CB HIS X 93 24.544 21.218 17.012 1.00 0.00 C ATOM 2945 CG HIS X 93 24.199 19.874 16.430 1.00 0.00 C ATOM 2946 ND1 HIS X 93 24.867 18.715 16.801 1.00 0.00 N ATOM 2947 CD2 HIS X 93 23.259 19.485 15.505 1.00 0.00 C ATOM 2948 CE1 HIS X 93 24.325 17.694 16.109 1.00 0.00 C ATOM 2949 NE2 HIS X 93 23.344 18.112 15.308 1.00 0.00 N ATOM 0 H HIS X 93 22.241 20.234 18.818 1.00 0.00 H new ATOM 0 HA HIS X 93 24.528 20.460 19.025 1.00 0.00 H new ATOM 0 HB2 HIS X 93 24.071 22.010 16.432 1.00 0.00 H new ATOM 0 HB3 HIS X 93 25.620 21.384 16.961 1.00 0.00 H new ATOM 0 HD2 HIS X 93 22.563 20.144 15.008 1.00 0.00 H new ATOM 0 HE1 HIS X 93 24.645 16.666 16.192 1.00 0.00 H new ATOM 0 HE2 HIS X 93 22.775 17.543 14.682 1.00 0.00 H new ATOM 2958 N LEU X 94 25.709 23.028 18.904 1.00 0.00 N ATOM 2959 CA LEU X 94 26.164 24.320 19.504 1.00 0.00 C ATOM 2960 C LEU X 94 25.940 25.460 18.502 1.00 0.00 C ATOM 2961 O LEU X 94 26.739 26.368 18.391 1.00 0.00 O ATOM 2962 CB LEU X 94 27.657 24.220 19.849 1.00 0.00 C ATOM 2963 CG LEU X 94 28.055 25.338 20.836 1.00 0.00 C ATOM 2964 CD1 LEU X 94 27.711 24.936 22.278 1.00 0.00 C ATOM 2965 CD2 LEU X 94 29.563 25.593 20.740 1.00 0.00 C ATOM 0 H LEU X 94 26.413 22.533 18.356 1.00 0.00 H new ATOM 0 HA LEU X 94 25.594 24.523 20.410 1.00 0.00 H new ATOM 0 HB2 LEU X 94 27.871 23.245 20.287 1.00 0.00 H new ATOM 0 HB3 LEU X 94 28.253 24.299 18.940 1.00 0.00 H new ATOM 0 HG LEU X 94 27.502 26.240 20.575 1.00 0.00 H new ATOM 0 HD11 LEU X 94 28.000 25.738 22.958 1.00 0.00 H new ATOM 0 HD12 LEU X 94 26.639 24.759 22.360 1.00 0.00 H new ATOM 0 HD13 LEU X 94 28.250 24.026 22.541 1.00 0.00 H new ATOM 0 HD21 LEU X 94 29.844 26.383 21.437 1.00 0.00 H new ATOM 0 HD22 LEU X 94 30.103 24.680 20.990 1.00 0.00 H new ATOM 0 HD23 LEU X 94 29.816 25.898 19.725 1.00 0.00 H new ATOM 2977 N LYS X 95 24.858 25.421 17.772 1.00 0.00 N ATOM 2978 CA LYS X 95 24.582 26.505 16.783 1.00 0.00 C ATOM 2979 C LYS X 95 25.798 26.692 15.870 1.00 0.00 C ATOM 2980 O LYS X 95 26.222 27.801 15.608 1.00 0.00 O ATOM 2981 CB LYS X 95 24.292 27.819 17.524 1.00 0.00 C ATOM 2982 CG LYS X 95 22.861 27.809 18.075 1.00 0.00 C ATOM 2983 CD LYS X 95 22.745 26.788 19.212 1.00 0.00 C ATOM 2984 CE LYS X 95 21.463 27.051 20.004 1.00 0.00 C ATOM 2985 NZ LYS X 95 21.532 28.407 20.620 1.00 0.00 N ATOM 0 H LYS X 95 24.153 24.686 17.817 1.00 0.00 H new ATOM 0 HA LYS X 95 23.716 26.229 16.181 1.00 0.00 H new ATOM 0 HB2 LYS X 95 25.003 27.950 18.340 1.00 0.00 H new ATOM 0 HB3 LYS X 95 24.424 28.664 16.848 1.00 0.00 H new ATOM 0 HG2 LYS X 95 22.595 28.802 18.438 1.00 0.00 H new ATOM 0 HG3 LYS X 95 22.158 27.562 17.280 1.00 0.00 H new ATOM 0 HD2 LYS X 95 22.734 25.776 18.807 1.00 0.00 H new ATOM 0 HD3 LYS X 95 23.612 26.859 19.869 1.00 0.00 H new ATOM 0 HE2 LYS X 95 20.596 26.981 19.347 1.00 0.00 H new ATOM 0 HE3 LYS X 95 21.338 26.294 20.778 1.00 0.00 H new ATOM 0 HZ1 LYS X 95 20.947 28.428 21.479 1.00 0.00 H new ATOM 0 HZ2 LYS X 95 22.518 28.626 20.867 1.00 0.00 H new ATOM 0 HZ3 LYS X 95 21.179 29.114 19.944 1.00 0.00 H new ATOM 2999 N SER X 96 26.365 25.624 15.381 1.00 0.00 N ATOM 3000 CA SER X 96 27.549 25.759 14.488 1.00 0.00 C ATOM 3001 C SER X 96 27.157 26.560 13.243 1.00 0.00 C ATOM 3002 O SER X 96 26.572 26.038 12.315 1.00 0.00 O ATOM 3003 CB SER X 96 28.028 24.368 14.070 1.00 0.00 C ATOM 3004 OG SER X 96 29.003 24.494 13.044 1.00 0.00 O ATOM 0 H SER X 96 26.061 24.667 15.560 1.00 0.00 H new ATOM 0 HA SER X 96 28.350 26.277 15.016 1.00 0.00 H new ATOM 0 HB2 SER X 96 28.451 23.844 14.927 1.00 0.00 H new ATOM 0 HB3 SER X 96 27.186 23.772 13.716 1.00 0.00 H new ATOM 0 HG SER X 96 29.312 23.604 12.776 1.00 0.00 H new ATOM 3010 N LYS X 97 27.473 27.828 13.218 1.00 0.00 N ATOM 3011 CA LYS X 97 27.118 28.665 12.036 1.00 0.00 C ATOM 3012 C LYS X 97 27.818 28.120 10.788 1.00 0.00 C ATOM 3013 O LYS X 97 27.256 28.084 9.712 1.00 0.00 O ATOM 3014 CB LYS X 97 27.571 30.110 12.290 1.00 0.00 C ATOM 3015 CG LYS X 97 27.225 31.014 11.095 1.00 0.00 C ATOM 3016 CD LYS X 97 25.707 31.045 10.867 1.00 0.00 C ATOM 3017 CE LYS X 97 25.333 32.274 10.033 1.00 0.00 C ATOM 3018 NZ LYS X 97 23.968 32.086 9.465 1.00 0.00 N ATOM 0 H LYS X 97 27.962 28.320 13.966 1.00 0.00 H new ATOM 0 HA LYS X 97 26.039 28.639 11.880 1.00 0.00 H new ATOM 0 HB2 LYS X 97 27.091 30.492 13.191 1.00 0.00 H new ATOM 0 HB3 LYS X 97 28.646 30.132 12.468 1.00 0.00 H new ATOM 0 HG2 LYS X 97 27.592 32.024 11.277 1.00 0.00 H new ATOM 0 HG3 LYS X 97 27.726 30.649 10.198 1.00 0.00 H new ATOM 0 HD2 LYS X 97 25.388 30.137 10.356 1.00 0.00 H new ATOM 0 HD3 LYS X 97 25.187 31.072 11.824 1.00 0.00 H new ATOM 0 HE2 LYS X 97 25.362 33.171 10.652 1.00 0.00 H new ATOM 0 HE3 LYS X 97 26.057 32.418 9.231 1.00 0.00 H new ATOM 0 HZ1 LYS X 97 23.710 32.919 8.898 1.00 0.00 H new ATOM 0 HZ2 LYS X 97 23.957 31.239 8.862 1.00 0.00 H new ATOM 0 HZ3 LYS X 97 23.283 31.969 10.239 1.00 0.00 H new ATOM 3032 N LYS X 98 29.046 27.705 10.928 1.00 0.00 N ATOM 3033 CA LYS X 98 29.799 27.171 9.758 1.00 0.00 C ATOM 3034 C LYS X 98 29.090 25.931 9.206 1.00 0.00 C ATOM 3035 O LYS X 98 29.003 25.735 8.009 1.00 0.00 O ATOM 3036 CB LYS X 98 31.209 26.794 10.211 1.00 0.00 C ATOM 3037 CG LYS X 98 31.976 28.062 10.592 1.00 0.00 C ATOM 3038 CD LYS X 98 33.389 27.691 11.047 1.00 0.00 C ATOM 3039 CE LYS X 98 34.147 28.956 11.459 1.00 0.00 C ATOM 3040 NZ LYS X 98 34.571 29.704 10.242 1.00 0.00 N ATOM 0 H LYS X 98 29.563 27.713 11.807 1.00 0.00 H new ATOM 0 HA LYS X 98 29.848 27.928 8.976 1.00 0.00 H new ATOM 0 HB2 LYS X 98 31.160 26.116 11.063 1.00 0.00 H new ATOM 0 HB3 LYS X 98 31.731 26.266 9.413 1.00 0.00 H new ATOM 0 HG2 LYS X 98 32.024 28.740 9.740 1.00 0.00 H new ATOM 0 HG3 LYS X 98 31.453 28.589 11.390 1.00 0.00 H new ATOM 0 HD2 LYS X 98 33.341 26.995 11.885 1.00 0.00 H new ATOM 0 HD3 LYS X 98 33.920 27.184 10.241 1.00 0.00 H new ATOM 0 HE2 LYS X 98 33.512 29.586 12.082 1.00 0.00 H new ATOM 0 HE3 LYS X 98 35.019 28.691 12.057 1.00 0.00 H new ATOM 0 HZ1 LYS X 98 35.199 30.486 10.517 1.00 0.00 H new ATOM 0 HZ2 LYS X 98 35.078 29.062 9.599 1.00 0.00 H new ATOM 0 HZ3 LYS X 98 33.733 30.086 9.760 1.00 0.00 H new ATOM 3054 N GLY X 99 28.587 25.088 10.067 1.00 0.00 N ATOM 3055 CA GLY X 99 27.891 23.859 9.589 1.00 0.00 C ATOM 3056 C GLY X 99 26.494 24.221 9.082 1.00 0.00 C ATOM 3057 O GLY X 99 25.556 24.326 9.848 1.00 0.00 O ATOM 0 H GLY X 99 28.628 25.197 11.080 1.00 0.00 H new ATOM 0 HA2 GLY X 99 28.467 23.390 8.792 1.00 0.00 H new ATOM 0 HA3 GLY X 99 27.818 23.133 10.399 1.00 0.00 H new ATOM 3061 N GLN X 100 26.348 24.411 7.794 1.00 0.00 N ATOM 3062 CA GLN X 100 25.009 24.767 7.226 1.00 0.00 C ATOM 3063 C GLN X 100 24.385 23.534 6.568 1.00 0.00 C ATOM 3064 O GLN X 100 24.882 23.020 5.586 1.00 0.00 O ATOM 3065 CB GLN X 100 25.186 25.868 6.179 1.00 0.00 C ATOM 3066 CG GLN X 100 25.585 27.170 6.875 1.00 0.00 C ATOM 3067 CD GLN X 100 25.764 28.274 5.832 1.00 0.00 C ATOM 3068 OE1 GLN X 100 25.999 27.999 4.672 1.00 0.00 O ATOM 3069 NE2 GLN X 100 25.660 29.522 6.200 1.00 0.00 N ATOM 0 H GLN X 100 27.100 24.335 7.109 1.00 0.00 H new ATOM 0 HA GLN X 100 24.355 25.118 8.024 1.00 0.00 H new ATOM 0 HB2 GLN X 100 25.950 25.579 5.457 1.00 0.00 H new ATOM 0 HB3 GLN X 100 24.259 26.009 5.623 1.00 0.00 H new ATOM 0 HG2 GLN X 100 24.820 27.458 7.597 1.00 0.00 H new ATOM 0 HG3 GLN X 100 26.511 27.028 7.432 1.00 0.00 H new ATOM 0 HE21 GLN X 100 25.463 29.752 7.174 1.00 0.00 H new ATOM 0 HE22 GLN X 100 25.776 30.267 5.514 1.00 0.00 H new ATOM 3078 N SER X 101 23.294 23.061 7.105 1.00 0.00 N ATOM 3079 CA SER X 101 22.625 21.866 6.520 1.00 0.00 C ATOM 3080 C SER X 101 21.951 22.243 5.197 1.00 0.00 C ATOM 3081 O SER X 101 21.733 21.407 4.345 1.00 0.00 O ATOM 3082 CB SER X 101 21.576 21.341 7.497 1.00 0.00 C ATOM 3083 OG SER X 101 20.470 22.233 7.523 1.00 0.00 O ATOM 0 H SER X 101 22.836 23.453 7.928 1.00 0.00 H new ATOM 0 HA SER X 101 23.370 21.092 6.334 1.00 0.00 H new ATOM 0 HB2 SER X 101 21.248 20.346 7.196 1.00 0.00 H new ATOM 0 HB3 SER X 101 22.006 21.247 8.494 1.00 0.00 H new ATOM 0 HG SER X 101 19.794 21.898 8.148 1.00 0.00 H new ATOM 3089 N THR X 102 21.612 23.498 5.028 1.00 0.00 N ATOM 3090 CA THR X 102 20.940 23.944 3.766 1.00 0.00 C ATOM 3091 C THR X 102 21.608 23.281 2.555 1.00 0.00 C ATOM 3092 O THR X 102 21.010 23.123 1.509 1.00 0.00 O ATOM 3093 CB THR X 102 21.046 25.473 3.646 1.00 0.00 C ATOM 3094 OG1 THR X 102 20.112 25.934 2.681 1.00 0.00 O ATOM 3095 CG2 THR X 102 22.463 25.873 3.218 1.00 0.00 C ATOM 0 H THR X 102 21.772 24.237 5.713 1.00 0.00 H new ATOM 0 HA THR X 102 19.890 23.653 3.794 1.00 0.00 H new ATOM 0 HB THR X 102 20.829 25.923 4.615 1.00 0.00 H new ATOM 0 HG1 THR X 102 19.330 26.311 3.136 1.00 0.00 H new ATOM 0 HG21 THR X 102 22.526 26.958 3.136 1.00 0.00 H new ATOM 0 HG22 THR X 102 23.180 25.523 3.961 1.00 0.00 H new ATOM 0 HG23 THR X 102 22.692 25.423 2.252 1.00 0.00 H new ATOM 3103 N SER X 103 22.845 22.899 2.696 1.00 0.00 N ATOM 3104 CA SER X 103 23.565 22.250 1.566 1.00 0.00 C ATOM 3105 C SER X 103 22.830 20.969 1.161 1.00 0.00 C ATOM 3106 O SER X 103 22.762 20.624 -0.002 1.00 0.00 O ATOM 3107 CB SER X 103 24.991 21.909 1.997 1.00 0.00 C ATOM 3108 OG SER X 103 25.713 23.113 2.222 1.00 0.00 O ATOM 0 H SER X 103 23.392 23.009 3.550 1.00 0.00 H new ATOM 0 HA SER X 103 23.598 22.932 0.717 1.00 0.00 H new ATOM 0 HB2 SER X 103 24.975 21.306 2.905 1.00 0.00 H new ATOM 0 HB3 SER X 103 25.484 21.314 1.228 1.00 0.00 H new ATOM 0 HG SER X 103 26.628 22.899 2.500 1.00 0.00 H new ATOM 3114 N ARG X 104 22.289 20.256 2.111 1.00 0.00 N ATOM 3115 CA ARG X 104 21.573 18.991 1.778 1.00 0.00 C ATOM 3116 C ARG X 104 20.402 19.302 0.831 1.00 0.00 C ATOM 3117 O ARG X 104 20.116 18.561 -0.091 1.00 0.00 O ATOM 3118 CB ARG X 104 21.047 18.346 3.077 1.00 0.00 C ATOM 3119 CG ARG X 104 19.774 19.060 3.555 1.00 0.00 C ATOM 3120 CD ARG X 104 19.413 18.619 4.986 1.00 0.00 C ATOM 3121 NE ARG X 104 17.928 18.490 5.100 1.00 0.00 N ATOM 3122 CZ ARG X 104 17.137 19.415 4.625 1.00 0.00 C ATOM 3123 NH1 ARG X 104 17.618 20.566 4.244 1.00 0.00 N ATOM 3124 NH2 ARG X 104 15.855 19.207 4.577 1.00 0.00 N ATOM 0 H ARG X 104 22.312 20.494 3.103 1.00 0.00 H new ATOM 0 HA ARG X 104 22.255 18.298 1.285 1.00 0.00 H new ATOM 0 HB2 ARG X 104 20.837 17.290 2.906 1.00 0.00 H new ATOM 0 HB3 ARG X 104 21.812 18.397 3.851 1.00 0.00 H new ATOM 0 HG2 ARG X 104 19.923 20.139 3.528 1.00 0.00 H new ATOM 0 HG3 ARG X 104 18.948 18.835 2.880 1.00 0.00 H new ATOM 0 HD2 ARG X 104 19.892 17.668 5.218 1.00 0.00 H new ATOM 0 HD3 ARG X 104 19.783 19.347 5.708 1.00 0.00 H new ATOM 0 HE ARG X 104 17.527 17.669 5.554 1.00 0.00 H new ATOM 0 HH11 ARG X 104 18.619 20.749 4.316 1.00 0.00 H new ATOM 0 HH12 ARG X 104 16.993 21.283 3.874 1.00 0.00 H new ATOM 0 HH21 ARG X 104 15.469 18.323 4.910 1.00 0.00 H new ATOM 0 HH22 ARG X 104 15.235 19.927 4.207 1.00 0.00 H new ATOM 3138 N HIS X 105 19.719 20.390 1.061 1.00 0.00 N ATOM 3139 CA HIS X 105 18.564 20.744 0.189 1.00 0.00 C ATOM 3140 C HIS X 105 19.052 20.907 -1.251 1.00 0.00 C ATOM 3141 O HIS X 105 18.397 20.494 -2.186 1.00 0.00 O ATOM 3142 CB HIS X 105 17.936 22.051 0.673 1.00 0.00 C ATOM 3143 CG HIS X 105 16.675 22.312 -0.102 1.00 0.00 C ATOM 3144 ND1 HIS X 105 15.652 21.377 -0.186 1.00 0.00 N ATOM 3145 CD2 HIS X 105 16.254 23.394 -0.829 1.00 0.00 C ATOM 3146 CE1 HIS X 105 14.674 21.913 -0.940 1.00 0.00 C ATOM 3147 NE2 HIS X 105 14.993 23.139 -1.355 1.00 0.00 N ATOM 0 H HIS X 105 19.911 21.049 1.815 1.00 0.00 H new ATOM 0 HA HIS X 105 17.816 19.952 0.233 1.00 0.00 H new ATOM 0 HB2 HIS X 105 17.716 21.989 1.739 1.00 0.00 H new ATOM 0 HB3 HIS X 105 18.636 22.876 0.540 1.00 0.00 H new ATOM 0 HD1 HIS X 105 15.643 20.453 0.245 1.00 0.00 H new ATOM 0 HD2 HIS X 105 16.816 24.305 -0.972 1.00 0.00 H new ATOM 0 HE1 HIS X 105 13.747 21.413 -1.179 1.00 0.00 H new ATOM 3156 N LYS X 106 20.201 21.498 -1.440 1.00 0.00 N ATOM 3157 CA LYS X 106 20.729 21.673 -2.824 1.00 0.00 C ATOM 3158 C LYS X 106 20.904 20.302 -3.478 1.00 0.00 C ATOM 3159 O LYS X 106 20.764 20.146 -4.679 1.00 0.00 O ATOM 3160 CB LYS X 106 22.077 22.394 -2.785 1.00 0.00 C ATOM 3161 CG LYS X 106 21.862 23.862 -2.416 1.00 0.00 C ATOM 3162 CD LYS X 106 23.212 24.590 -2.376 1.00 0.00 C ATOM 3163 CE LYS X 106 23.867 24.571 -3.767 1.00 0.00 C ATOM 3164 NZ LYS X 106 24.765 25.753 -3.909 1.00 0.00 N ATOM 0 H LYS X 106 20.796 21.866 -0.698 1.00 0.00 H new ATOM 0 HA LYS X 106 20.023 22.269 -3.402 1.00 0.00 H new ATOM 0 HB2 LYS X 106 22.735 21.918 -2.058 1.00 0.00 H new ATOM 0 HB3 LYS X 106 22.569 22.320 -3.755 1.00 0.00 H new ATOM 0 HG2 LYS X 106 21.204 24.337 -3.143 1.00 0.00 H new ATOM 0 HG3 LYS X 106 21.370 23.935 -1.446 1.00 0.00 H new ATOM 0 HD2 LYS X 106 23.069 25.619 -2.048 1.00 0.00 H new ATOM 0 HD3 LYS X 106 23.870 24.112 -1.650 1.00 0.00 H new ATOM 0 HE2 LYS X 106 24.436 23.651 -3.901 1.00 0.00 H new ATOM 0 HE3 LYS X 106 23.101 24.588 -4.542 1.00 0.00 H new ATOM 0 HZ1 LYS X 106 25.209 25.741 -4.850 1.00 0.00 H new ATOM 0 HZ2 LYS X 106 24.210 26.626 -3.799 1.00 0.00 H new ATOM 0 HZ3 LYS X 106 25.504 25.718 -3.178 1.00 0.00 H new ATOM 3178 N LYS X 107 21.202 19.296 -2.712 1.00 0.00 N ATOM 3179 CA LYS X 107 21.371 17.961 -3.330 1.00 0.00 C ATOM 3180 C LYS X 107 20.059 17.603 -4.020 1.00 0.00 C ATOM 3181 O LYS X 107 20.055 17.084 -5.111 1.00 0.00 O ATOM 3182 CB LYS X 107 21.680 16.926 -2.245 1.00 0.00 C ATOM 3183 CG LYS X 107 21.884 15.548 -2.878 1.00 0.00 C ATOM 3184 CD LYS X 107 22.191 14.530 -1.778 1.00 0.00 C ATOM 3185 CE LYS X 107 22.403 13.148 -2.398 1.00 0.00 C ATOM 3186 NZ LYS X 107 23.676 13.141 -3.172 1.00 0.00 N ATOM 0 H LYS X 107 21.334 19.339 -1.701 1.00 0.00 H new ATOM 0 HA LYS X 107 22.193 17.971 -4.046 1.00 0.00 H new ATOM 0 HB2 LYS X 107 22.575 17.219 -1.696 1.00 0.00 H new ATOM 0 HB3 LYS X 107 20.863 16.887 -1.525 1.00 0.00 H new ATOM 0 HG2 LYS X 107 20.990 15.250 -3.426 1.00 0.00 H new ATOM 0 HG3 LYS X 107 22.702 15.582 -3.597 1.00 0.00 H new ATOM 0 HD2 LYS X 107 23.082 14.833 -1.228 1.00 0.00 H new ATOM 0 HD3 LYS X 107 21.370 14.496 -1.062 1.00 0.00 H new ATOM 0 HE2 LYS X 107 22.436 12.388 -1.617 1.00 0.00 H new ATOM 0 HE3 LYS X 107 21.567 12.898 -3.051 1.00 0.00 H new ATOM 0 HZ1 LYS X 107 23.961 12.159 -3.363 1.00 0.00 H new ATOM 0 HZ2 LYS X 107 23.538 13.643 -4.072 1.00 0.00 H new ATOM 0 HZ3 LYS X 107 24.420 13.616 -2.621 1.00 0.00 H new ATOM 3200 N LEU X 108 18.947 17.909 -3.399 1.00 0.00 N ATOM 3201 CA LEU X 108 17.620 17.612 -4.024 1.00 0.00 C ATOM 3202 C LEU X 108 17.443 18.487 -5.272 1.00 0.00 C ATOM 3203 O LEU X 108 16.894 18.059 -6.266 1.00 0.00 O ATOM 3204 CB LEU X 108 16.499 17.905 -3.005 1.00 0.00 C ATOM 3205 CG LEU X 108 15.185 17.170 -3.385 1.00 0.00 C ATOM 3206 CD1 LEU X 108 14.365 16.873 -2.123 1.00 0.00 C ATOM 3207 CD2 LEU X 108 14.327 18.029 -4.332 1.00 0.00 C ATOM 0 H LEU X 108 18.901 18.354 -2.482 1.00 0.00 H new ATOM 0 HA LEU X 108 17.571 16.562 -4.314 1.00 0.00 H new ATOM 0 HB2 LEU X 108 16.818 17.593 -2.010 1.00 0.00 H new ATOM 0 HB3 LEU X 108 16.317 18.979 -2.960 1.00 0.00 H new ATOM 0 HG LEU X 108 15.457 16.241 -3.887 1.00 0.00 H new ATOM 0 HD11 LEU X 108 13.445 16.357 -2.400 1.00 0.00 H new ATOM 0 HD12 LEU X 108 14.947 16.242 -1.451 1.00 0.00 H new ATOM 0 HD13 LEU X 108 14.119 17.808 -1.620 1.00 0.00 H new ATOM 0 HD21 LEU X 108 13.413 17.491 -4.583 1.00 0.00 H new ATOM 0 HD22 LEU X 108 14.073 18.968 -3.841 1.00 0.00 H new ATOM 0 HD23 LEU X 108 14.888 18.236 -5.244 1.00 0.00 H new ATOM 3219 N MET X 109 17.907 19.710 -5.233 1.00 0.00 N ATOM 3220 CA MET X 109 17.756 20.604 -6.420 1.00 0.00 C ATOM 3221 C MET X 109 18.154 19.858 -7.692 1.00 0.00 C ATOM 3222 O MET X 109 17.724 20.211 -8.772 1.00 0.00 O ATOM 3223 CB MET X 109 18.613 21.864 -6.268 1.00 0.00 C ATOM 3224 CG MET X 109 18.019 22.750 -5.173 1.00 0.00 C ATOM 3225 SD MET X 109 16.474 23.481 -5.776 1.00 0.00 S ATOM 3226 CE MET X 109 15.549 23.411 -4.223 1.00 0.00 C ATOM 0 H MET X 109 18.383 20.127 -4.433 1.00 0.00 H new ATOM 0 HA MET X 109 16.710 20.904 -6.489 1.00 0.00 H new ATOM 0 HB2 MET X 109 19.638 21.592 -6.016 1.00 0.00 H new ATOM 0 HB3 MET X 109 18.651 22.408 -7.212 1.00 0.00 H new ATOM 0 HG2 MET X 109 17.832 22.163 -4.274 1.00 0.00 H new ATOM 0 HG3 MET X 109 18.725 23.534 -4.900 1.00 0.00 H new ATOM 0 HE1 MET X 109 14.491 23.582 -4.422 1.00 0.00 H new ATOM 0 HE2 MET X 109 15.679 22.430 -3.766 1.00 0.00 H new ATOM 0 HE3 MET X 109 15.919 24.179 -3.544 1.00 0.00 H new ATOM 3236 N PHE X 110 18.981 18.842 -7.583 1.00 0.00 N ATOM 3237 CA PHE X 110 19.410 18.084 -8.810 1.00 0.00 C ATOM 3238 C PHE X 110 18.211 17.913 -9.765 1.00 0.00 C ATOM 3239 O PHE X 110 18.298 18.200 -10.941 1.00 0.00 O ATOM 3240 CB PHE X 110 19.972 16.697 -8.396 1.00 0.00 C ATOM 3241 CG PHE X 110 18.870 15.646 -8.330 1.00 0.00 C ATOM 3242 CD1 PHE X 110 18.420 15.031 -9.506 1.00 0.00 C ATOM 3243 CD2 PHE X 110 18.298 15.291 -7.101 1.00 0.00 C ATOM 3244 CE1 PHE X 110 17.404 14.068 -9.448 1.00 0.00 C ATOM 3245 CE2 PHE X 110 17.284 14.337 -7.047 1.00 0.00 C ATOM 3246 CZ PHE X 110 16.837 13.724 -8.216 1.00 0.00 C ATOM 0 H PHE X 110 19.376 18.505 -6.705 1.00 0.00 H new ATOM 0 HA PHE X 110 20.191 18.642 -9.326 1.00 0.00 H new ATOM 0 HB2 PHE X 110 20.733 16.383 -9.110 1.00 0.00 H new ATOM 0 HB3 PHE X 110 20.460 16.776 -7.424 1.00 0.00 H new ATOM 0 HD1 PHE X 110 18.856 15.299 -10.457 1.00 0.00 H new ATOM 0 HD2 PHE X 110 18.645 15.759 -6.192 1.00 0.00 H new ATOM 0 HE1 PHE X 110 17.059 13.592 -10.354 1.00 0.00 H new ATOM 0 HE2 PHE X 110 16.843 14.072 -6.097 1.00 0.00 H new ATOM 0 HZ PHE X 110 16.053 12.983 -8.171 1.00 0.00 H new ATOM 3256 N LYS X 111 17.095 17.461 -9.258 1.00 0.00 N ATOM 3257 CA LYS X 111 15.888 17.287 -10.123 1.00 0.00 C ATOM 3258 C LYS X 111 15.282 18.653 -10.451 1.00 0.00 C ATOM 3259 O LYS X 111 14.769 18.879 -11.529 1.00 0.00 O ATOM 3260 CB LYS X 111 14.851 16.451 -9.373 1.00 0.00 C ATOM 3261 CG LYS X 111 14.275 17.265 -8.212 1.00 0.00 C ATOM 3262 CD LYS X 111 13.507 16.345 -7.254 1.00 0.00 C ATOM 3263 CE LYS X 111 14.483 15.465 -6.461 1.00 0.00 C ATOM 3264 NZ LYS X 111 13.849 15.035 -5.183 1.00 0.00 N ATOM 0 H LYS X 111 16.965 17.204 -8.280 1.00 0.00 H new ATOM 0 HA LYS X 111 16.177 16.787 -11.047 1.00 0.00 H new ATOM 0 HB2 LYS X 111 14.052 16.151 -10.051 1.00 0.00 H new ATOM 0 HB3 LYS X 111 15.310 15.537 -8.997 1.00 0.00 H new ATOM 0 HG2 LYS X 111 15.079 17.770 -7.677 1.00 0.00 H new ATOM 0 HG3 LYS X 111 13.611 18.040 -8.595 1.00 0.00 H new ATOM 0 HD2 LYS X 111 12.907 16.943 -6.568 1.00 0.00 H new ATOM 0 HD3 LYS X 111 12.817 15.717 -7.817 1.00 0.00 H new ATOM 0 HE2 LYS X 111 14.762 14.592 -7.051 1.00 0.00 H new ATOM 0 HE3 LYS X 111 15.400 16.017 -6.255 1.00 0.00 H new ATOM 0 HZ1 LYS X 111 14.533 15.132 -4.406 1.00 0.00 H new ATOM 0 HZ2 LYS X 111 13.019 15.631 -4.990 1.00 0.00 H new ATOM 0 HZ3 LYS X 111 13.552 14.041 -5.260 1.00 0.00 H new ATOM 3278 N THR X 112 15.314 19.553 -9.509 1.00 0.00 N ATOM 3279 CA THR X 112 14.723 20.898 -9.741 1.00 0.00 C ATOM 3280 C THR X 112 15.444 21.554 -10.916 1.00 0.00 C ATOM 3281 O THR X 112 14.840 22.191 -11.756 1.00 0.00 O ATOM 3282 CB THR X 112 14.902 21.747 -8.481 1.00 0.00 C ATOM 3283 OG1 THR X 112 14.519 20.983 -7.346 1.00 0.00 O ATOM 3284 CG2 THR X 112 14.020 22.990 -8.568 1.00 0.00 C ATOM 0 H THR X 112 15.725 19.414 -8.586 1.00 0.00 H new ATOM 0 HA THR X 112 13.660 20.811 -9.967 1.00 0.00 H new ATOM 0 HB THR X 112 15.946 22.048 -8.393 1.00 0.00 H new ATOM 0 HG1 THR X 112 14.480 21.565 -6.558 1.00 0.00 H new ATOM 0 HG21 THR X 112 14.150 23.592 -7.669 1.00 0.00 H new ATOM 0 HG22 THR X 112 14.303 23.577 -9.442 1.00 0.00 H new ATOM 0 HG23 THR X 112 12.976 22.690 -8.656 1.00 0.00 H new ATOM 3292 N GLU X 113 16.735 21.388 -10.986 1.00 0.00 N ATOM 3293 CA GLU X 113 17.506 21.983 -12.110 1.00 0.00 C ATOM 3294 CB GLU X 113 17.167 21.229 -13.396 1.00 0.00 C ATOM 3295 CG GLU X 113 17.463 19.739 -13.199 1.00 0.00 C ATOM 3296 CD GLU X 113 17.127 18.976 -14.481 1.00 0.00 C ATOM 3297 OE1 GLU X 113 16.526 19.570 -15.361 1.00 0.00 O ATOM 3298 OE2 GLU X 113 17.476 17.810 -14.561 1.00 0.00 O ATOM 0 H GLU X 113 17.290 20.864 -10.310 1.00 0.00 H new ATOM 0 HB2 GLU X 113 16.117 21.373 -13.650 1.00 0.00 H new ATOM 0 HB3 GLU X 113 17.753 21.622 -14.227 1.00 0.00 H new ATOM 0 HG2 GLU X 113 18.513 19.597 -12.944 1.00 0.00 H new ATOM 0 HG3 GLU X 113 16.877 19.348 -12.367 1.00 0.00 H new TER 3305 GLU X 113 ATOM 3306 N SER Y 92 -14.562 5.062 -37.952 1.00 0.00 N ATOM 3307 CA SER Y 92 -13.976 6.417 -38.151 1.00 0.00 C ATOM 3308 C SER Y 92 -15.062 7.372 -38.645 1.00 0.00 C ATOM 3309 O SER Y 92 -14.782 8.353 -39.305 1.00 0.00 O ATOM 3310 CB SER Y 92 -12.858 6.344 -39.192 1.00 0.00 C ATOM 3311 OG SER Y 92 -12.361 7.653 -39.437 1.00 0.00 O ATOM 0 HA SER Y 92 -13.571 6.778 -37.206 1.00 0.00 H new ATOM 0 HB2 SER Y 92 -12.055 5.698 -38.836 1.00 0.00 H new ATOM 0 HB3 SER Y 92 -13.234 5.906 -40.117 1.00 0.00 H new ATOM 0 HG SER Y 92 -13.074 8.207 -39.818 1.00 0.00 H new ATOM 3319 N HIS Y 93 -16.301 7.089 -38.336 1.00 0.00 N ATOM 3320 CA HIS Y 93 -17.411 7.976 -38.793 1.00 0.00 C ATOM 3321 C HIS Y 93 -17.203 8.335 -40.269 1.00 0.00 C ATOM 3322 O HIS Y 93 -16.407 7.724 -40.955 1.00 0.00 O ATOM 3323 CB HIS Y 93 -17.428 9.250 -37.943 1.00 0.00 C ATOM 3324 CG HIS Y 93 -17.715 8.888 -36.510 1.00 0.00 C ATOM 3325 ND1 HIS Y 93 -18.969 8.466 -36.089 1.00 0.00 N ATOM 3326 CD2 HIS Y 93 -16.919 8.874 -35.389 1.00 0.00 C ATOM 3327 CE1 HIS Y 93 -18.892 8.217 -34.768 1.00 0.00 C ATOM 3328 NE2 HIS Y 93 -17.666 8.450 -34.296 1.00 0.00 N ATOM 0 H HIS Y 93 -16.592 6.281 -37.786 1.00 0.00 H new ATOM 0 HA HIS Y 93 -18.364 7.458 -38.682 1.00 0.00 H new ATOM 0 HB2 HIS Y 93 -16.469 9.762 -38.016 1.00 0.00 H new ATOM 0 HB3 HIS Y 93 -18.186 9.939 -38.315 1.00 0.00 H new ATOM 0 HD2 HIS Y 93 -15.875 9.150 -35.362 1.00 0.00 H new ATOM 0 HE1 HIS Y 93 -19.719 7.872 -34.166 1.00 0.00 H new ATOM 0 HE2 HIS Y 93 -17.344 8.340 -33.334 1.00 0.00 H new ATOM 3337 N LEU Y 94 -17.911 9.313 -40.769 1.00 0.00 N ATOM 3338 CA LEU Y 94 -17.750 9.699 -42.205 1.00 0.00 C ATOM 3339 C LEU Y 94 -16.692 10.804 -42.325 1.00 0.00 C ATOM 3340 O LEU Y 94 -16.820 11.714 -43.120 1.00 0.00 O ATOM 3341 CB LEU Y 94 -19.093 10.209 -42.747 1.00 0.00 C ATOM 3342 CG LEU Y 94 -19.084 10.198 -44.291 1.00 0.00 C ATOM 3343 CD1 LEU Y 94 -19.400 8.792 -44.825 1.00 0.00 C ATOM 3344 CD2 LEU Y 94 -20.139 11.179 -44.815 1.00 0.00 C ATOM 0 H LEU Y 94 -18.594 9.862 -40.247 1.00 0.00 H new ATOM 0 HA LEU Y 94 -17.430 8.832 -42.783 1.00 0.00 H new ATOM 0 HB2 LEU Y 94 -19.904 9.583 -42.376 1.00 0.00 H new ATOM 0 HB3 LEU Y 94 -19.279 11.220 -42.384 1.00 0.00 H new ATOM 0 HG LEU Y 94 -18.092 10.493 -44.633 1.00 0.00 H new ATOM 0 HD11 LEU Y 94 -19.389 8.806 -45.915 1.00 0.00 H new ATOM 0 HD12 LEU Y 94 -18.650 8.088 -44.463 1.00 0.00 H new ATOM 0 HD13 LEU Y 94 -20.385 8.483 -44.476 1.00 0.00 H new ATOM 0 HD21 LEU Y 94 -20.133 11.172 -45.905 1.00 0.00 H new ATOM 0 HD22 LEU Y 94 -21.124 10.881 -44.455 1.00 0.00 H new ATOM 0 HD23 LEU Y 94 -19.911 12.183 -44.458 1.00 0.00 H new ATOM 3356 N LYS Y 95 -15.649 10.733 -41.543 1.00 0.00 N ATOM 3357 CA LYS Y 95 -14.584 11.778 -41.618 1.00 0.00 C ATOM 3358 C LYS Y 95 -15.215 13.168 -41.490 1.00 0.00 C ATOM 3359 O LYS Y 95 -14.897 14.073 -42.235 1.00 0.00 O ATOM 3360 CB LYS Y 95 -13.850 11.671 -42.963 1.00 0.00 C ATOM 3361 CG LYS Y 95 -12.853 10.506 -42.929 1.00 0.00 C ATOM 3362 CD LYS Y 95 -13.608 9.174 -42.895 1.00 0.00 C ATOM 3363 CE LYS Y 95 -12.648 8.035 -43.238 1.00 0.00 C ATOM 3364 NZ LYS Y 95 -12.138 8.218 -44.627 1.00 0.00 N ATOM 0 H LYS Y 95 -15.487 9.997 -40.855 1.00 0.00 H new ATOM 0 HA LYS Y 95 -13.875 11.626 -40.804 1.00 0.00 H new ATOM 0 HB2 LYS Y 95 -14.570 11.520 -43.768 1.00 0.00 H new ATOM 0 HB3 LYS Y 95 -13.325 12.603 -43.175 1.00 0.00 H new ATOM 0 HG2 LYS Y 95 -12.205 10.545 -43.805 1.00 0.00 H new ATOM 0 HG3 LYS Y 95 -12.210 10.592 -42.053 1.00 0.00 H new ATOM 0 HD2 LYS Y 95 -14.041 9.014 -41.907 1.00 0.00 H new ATOM 0 HD3 LYS Y 95 -14.434 9.194 -43.606 1.00 0.00 H new ATOM 0 HE2 LYS Y 95 -11.817 8.020 -42.533 1.00 0.00 H new ATOM 0 HE3 LYS Y 95 -13.158 7.076 -43.150 1.00 0.00 H new ATOM 0 HZ1 LYS Y 95 -11.915 7.290 -45.040 1.00 0.00 H new ATOM 0 HZ2 LYS Y 95 -12.864 8.689 -45.204 1.00 0.00 H new ATOM 0 HZ3 LYS Y 95 -11.278 8.803 -44.607 1.00 0.00 H new ATOM 3378 N SER Y 96 -16.105 13.348 -40.554 1.00 0.00 N ATOM 3379 CA SER Y 96 -16.745 14.683 -40.391 1.00 0.00 C ATOM 3380 C SER Y 96 -15.670 15.725 -40.071 1.00 0.00 C ATOM 3381 O SER Y 96 -15.232 15.854 -38.946 1.00 0.00 O ATOM 3382 CB SER Y 96 -17.750 14.624 -39.241 1.00 0.00 C ATOM 3383 OG SER Y 96 -18.211 15.937 -38.952 1.00 0.00 O ATOM 0 H SER Y 96 -16.416 12.632 -39.898 1.00 0.00 H new ATOM 0 HA SER Y 96 -17.258 14.958 -41.313 1.00 0.00 H new ATOM 0 HB2 SER Y 96 -18.589 13.982 -39.509 1.00 0.00 H new ATOM 0 HB3 SER Y 96 -17.284 14.187 -38.358 1.00 0.00 H new ATOM 0 HG SER Y 96 -18.857 15.902 -38.216 1.00 0.00 H new ATOM 3389 N LYS Y 97 -15.242 16.470 -41.054 1.00 0.00 N ATOM 3390 CA LYS Y 97 -14.197 17.506 -40.810 1.00 0.00 C ATOM 3391 C LYS Y 97 -14.715 18.537 -39.804 1.00 0.00 C ATOM 3392 O LYS Y 97 -13.993 18.998 -38.943 1.00 0.00 O ATOM 3393 CB LYS Y 97 -13.858 18.197 -42.137 1.00 0.00 C ATOM 3394 CG LYS Y 97 -12.781 19.277 -41.938 1.00 0.00 C ATOM 3395 CD LYS Y 97 -11.492 18.657 -41.381 1.00 0.00 C ATOM 3396 CE LYS Y 97 -10.312 19.594 -41.653 1.00 0.00 C ATOM 3397 NZ LYS Y 97 -9.147 19.183 -40.820 1.00 0.00 N ATOM 0 H LYS Y 97 -15.571 16.406 -42.017 1.00 0.00 H new ATOM 0 HA LYS Y 97 -13.302 17.036 -40.403 1.00 0.00 H new ATOM 0 HB2 LYS Y 97 -13.507 17.457 -42.857 1.00 0.00 H new ATOM 0 HB3 LYS Y 97 -14.757 18.648 -42.556 1.00 0.00 H new ATOM 0 HG2 LYS Y 97 -12.573 19.770 -42.887 1.00 0.00 H new ATOM 0 HG3 LYS Y 97 -13.148 20.043 -41.254 1.00 0.00 H new ATOM 0 HD2 LYS Y 97 -11.593 18.485 -40.309 1.00 0.00 H new ATOM 0 HD3 LYS Y 97 -11.313 17.687 -41.845 1.00 0.00 H new ATOM 0 HE2 LYS Y 97 -10.046 19.563 -42.710 1.00 0.00 H new ATOM 0 HE3 LYS Y 97 -10.591 20.623 -41.424 1.00 0.00 H new ATOM 0 HZ1 LYS Y 97 -8.346 19.820 -41.005 1.00 0.00 H new ATOM 0 HZ2 LYS Y 97 -9.404 19.234 -39.814 1.00 0.00 H new ATOM 0 HZ3 LYS Y 97 -8.876 18.208 -41.059 1.00 0.00 H new ATOM 3411 N LYS Y 98 -15.960 18.910 -39.916 1.00 0.00 N ATOM 3412 CA LYS Y 98 -16.529 19.919 -38.979 1.00 0.00 C ATOM 3413 C LYS Y 98 -16.473 19.387 -37.544 1.00 0.00 C ATOM 3414 O LYS Y 98 -16.183 20.113 -36.614 1.00 0.00 O ATOM 3415 CB LYS Y 98 -17.984 20.194 -39.362 1.00 0.00 C ATOM 3416 CG LYS Y 98 -18.027 20.855 -40.741 1.00 0.00 C ATOM 3417 CD LYS Y 98 -19.480 21.134 -41.133 1.00 0.00 C ATOM 3418 CE LYS Y 98 -19.523 21.797 -42.513 1.00 0.00 C ATOM 3419 NZ LYS Y 98 -19.155 23.235 -42.391 1.00 0.00 N ATOM 0 H LYS Y 98 -16.610 18.558 -40.619 1.00 0.00 H new ATOM 0 HA LYS Y 98 -15.948 20.839 -39.042 1.00 0.00 H new ATOM 0 HB2 LYS Y 98 -18.551 19.263 -39.374 1.00 0.00 H new ATOM 0 HB3 LYS Y 98 -18.451 20.842 -38.620 1.00 0.00 H new ATOM 0 HG2 LYS Y 98 -17.459 21.785 -40.727 1.00 0.00 H new ATOM 0 HG3 LYS Y 98 -17.559 20.206 -41.481 1.00 0.00 H new ATOM 0 HD2 LYS Y 98 -20.048 20.204 -41.148 1.00 0.00 H new ATOM 0 HD3 LYS Y 98 -19.949 21.782 -40.393 1.00 0.00 H new ATOM 0 HE2 LYS Y 98 -18.835 21.292 -43.191 1.00 0.00 H new ATOM 0 HE3 LYS Y 98 -20.521 21.702 -42.942 1.00 0.00 H new ATOM 0 HZ1 LYS Y 98 -19.283 23.705 -43.310 1.00 0.00 H new ATOM 0 HZ2 LYS Y 98 -19.764 23.690 -41.681 1.00 0.00 H new ATOM 0 HZ3 LYS Y 98 -18.161 23.315 -42.097 1.00 0.00 H new ATOM 3433 N GLY Y 99 -16.753 18.127 -37.356 1.00 0.00 N ATOM 3434 CA GLY Y 99 -16.721 17.554 -35.979 1.00 0.00 C ATOM 3435 C GLY Y 99 -15.272 17.332 -35.546 1.00 0.00 C ATOM 3436 O GLY Y 99 -14.670 16.325 -35.864 1.00 0.00 O ATOM 0 H GLY Y 99 -17.002 17.469 -38.095 1.00 0.00 H new ATOM 0 HA2 GLY Y 99 -17.219 18.228 -35.283 1.00 0.00 H new ATOM 0 HA3 GLY Y 99 -17.266 16.611 -35.955 1.00 0.00 H new ATOM 3440 N GLN Y 100 -14.704 18.265 -34.818 1.00 0.00 N ATOM 3441 CA GLN Y 100 -13.287 18.111 -34.357 1.00 0.00 C ATOM 3442 C GLN Y 100 -13.268 17.705 -32.882 1.00 0.00 C ATOM 3443 O GLN Y 100 -13.680 18.449 -32.014 1.00 0.00 O ATOM 3444 CB GLN Y 100 -12.552 19.442 -34.526 1.00 0.00 C ATOM 3445 CG GLN Y 100 -12.391 19.745 -36.017 1.00 0.00 C ATOM 3446 CD GLN Y 100 -11.656 21.075 -36.193 1.00 0.00 C ATOM 3447 OE1 GLN Y 100 -11.680 21.917 -35.317 1.00 0.00 O ATOM 3448 NE2 GLN Y 100 -10.998 21.299 -37.297 1.00 0.00 N ATOM 0 H GLN Y 100 -15.162 19.128 -34.523 1.00 0.00 H new ATOM 0 HA GLN Y 100 -12.794 17.341 -34.951 1.00 0.00 H new ATOM 0 HB2 GLN Y 100 -13.109 20.242 -34.039 1.00 0.00 H new ATOM 0 HB3 GLN Y 100 -11.575 19.395 -34.045 1.00 0.00 H new ATOM 0 HG2 GLN Y 100 -11.835 18.943 -36.504 1.00 0.00 H new ATOM 0 HG3 GLN Y 100 -13.369 19.792 -36.497 1.00 0.00 H new ATOM 0 HE21 GLN Y 100 -10.979 20.592 -38.032 1.00 0.00 H new ATOM 0 HE22 GLN Y 100 -10.503 22.182 -37.426 1.00 0.00 H new ATOM 3457 N SER Y 101 -12.787 16.527 -32.595 1.00 0.00 N ATOM 3458 CA SER Y 101 -12.731 16.060 -31.181 1.00 0.00 C ATOM 3459 C SER Y 101 -11.634 16.819 -30.429 1.00 0.00 C ATOM 3460 O SER Y 101 -11.677 16.948 -29.223 1.00 0.00 O ATOM 3461 CB SER Y 101 -12.430 14.564 -31.151 1.00 0.00 C ATOM 3462 OG SER Y 101 -11.076 14.348 -31.526 1.00 0.00 O ATOM 0 H SER Y 101 -12.428 15.864 -33.283 1.00 0.00 H new ATOM 0 HA SER Y 101 -13.691 16.248 -30.701 1.00 0.00 H new ATOM 0 HB2 SER Y 101 -12.611 14.165 -30.153 1.00 0.00 H new ATOM 0 HB3 SER Y 101 -13.096 14.034 -31.831 1.00 0.00 H new ATOM 0 HG SER Y 101 -10.880 13.388 -31.506 1.00 0.00 H new ATOM 3468 N THR Y 102 -10.648 17.314 -31.135 1.00 0.00 N ATOM 3469 CA THR Y 102 -9.533 18.062 -30.472 1.00 0.00 C ATOM 3470 C THR Y 102 -10.097 19.000 -29.397 1.00 0.00 C ATOM 3471 O THR Y 102 -9.422 19.364 -28.456 1.00 0.00 O ATOM 3472 CB THR Y 102 -8.774 18.879 -31.530 1.00 0.00 C ATOM 3473 OG1 THR Y 102 -7.523 19.291 -30.997 1.00 0.00 O ATOM 3474 CG2 THR Y 102 -9.591 20.113 -31.933 1.00 0.00 C ATOM 0 H THR Y 102 -10.566 17.232 -32.148 1.00 0.00 H new ATOM 0 HA THR Y 102 -8.853 17.354 -29.999 1.00 0.00 H new ATOM 0 HB THR Y 102 -8.613 18.259 -32.412 1.00 0.00 H new ATOM 0 HG1 THR Y 102 -6.803 18.776 -31.417 1.00 0.00 H new ATOM 0 HG21 THR Y 102 -9.043 20.683 -32.683 1.00 0.00 H new ATOM 0 HG22 THR Y 102 -10.548 19.796 -32.347 1.00 0.00 H new ATOM 0 HG23 THR Y 102 -9.763 20.738 -31.056 1.00 0.00 H new ATOM 3482 N SER Y 103 -11.332 19.389 -29.540 1.00 0.00 N ATOM 3483 CA SER Y 103 -11.953 20.301 -28.539 1.00 0.00 C ATOM 3484 C SER Y 103 -11.937 19.634 -27.161 1.00 0.00 C ATOM 3485 O SER Y 103 -11.755 20.282 -26.150 1.00 0.00 O ATOM 3486 CB SER Y 103 -13.396 20.602 -28.945 1.00 0.00 C ATOM 3487 OG SER Y 103 -13.396 21.355 -30.151 1.00 0.00 O ATOM 0 H SER Y 103 -11.941 19.114 -30.310 1.00 0.00 H new ATOM 0 HA SER Y 103 -11.388 21.232 -28.498 1.00 0.00 H new ATOM 0 HB2 SER Y 103 -13.949 19.673 -29.083 1.00 0.00 H new ATOM 0 HB3 SER Y 103 -13.900 21.159 -28.155 1.00 0.00 H new ATOM 0 HG SER Y 103 -14.319 21.549 -30.416 1.00 0.00 H new ATOM 3493 N ARG Y 104 -12.136 18.345 -27.111 1.00 0.00 N ATOM 3494 CA ARG Y 104 -12.145 17.641 -25.796 1.00 0.00 C ATOM 3495 C ARG Y 104 -10.786 17.835 -25.104 1.00 0.00 C ATOM 3496 O ARG Y 104 -10.704 18.016 -23.904 1.00 0.00 O ATOM 3497 CB ARG Y 104 -12.415 16.140 -26.023 1.00 0.00 C ATOM 3498 CG ARG Y 104 -11.141 15.430 -26.507 1.00 0.00 C ATOM 3499 CD ARG Y 104 -11.473 14.008 -26.998 1.00 0.00 C ATOM 3500 NE ARG Y 104 -10.374 13.078 -26.592 1.00 0.00 N ATOM 3501 CZ ARG Y 104 -9.120 13.407 -26.762 1.00 0.00 C ATOM 3502 NH1 ARG Y 104 -8.800 14.454 -27.468 1.00 0.00 N ATOM 3503 NH2 ARG Y 104 -8.182 12.659 -26.265 1.00 0.00 N ATOM 0 H ARG Y 104 -12.293 17.749 -27.923 1.00 0.00 H new ATOM 0 HA ARG Y 104 -12.929 18.053 -25.161 1.00 0.00 H new ATOM 0 HB2 ARG Y 104 -12.763 15.683 -25.097 1.00 0.00 H new ATOM 0 HB3 ARG Y 104 -13.210 16.015 -26.758 1.00 0.00 H new ATOM 0 HG2 ARG Y 104 -10.682 16.002 -27.313 1.00 0.00 H new ATOM 0 HG3 ARG Y 104 -10.414 15.381 -25.697 1.00 0.00 H new ATOM 0 HD2 ARG Y 104 -12.421 13.676 -26.575 1.00 0.00 H new ATOM 0 HD3 ARG Y 104 -11.588 14.002 -28.082 1.00 0.00 H new ATOM 0 HE ARG Y 104 -10.606 12.175 -26.177 1.00 0.00 H new ATOM 0 HH11 ARG Y 104 -9.530 15.025 -27.894 1.00 0.00 H new ATOM 0 HH12 ARG Y 104 -7.819 14.703 -27.595 1.00 0.00 H new ATOM 0 HH21 ARG Y 104 -8.424 11.817 -25.743 1.00 0.00 H new ATOM 0 HH22 ARG Y 104 -7.203 12.914 -26.396 1.00 0.00 H new ATOM 3517 N HIS Y 105 -9.720 17.786 -25.855 1.00 0.00 N ATOM 3518 CA HIS Y 105 -8.371 17.952 -25.248 1.00 0.00 C ATOM 3519 C HIS Y 105 -8.289 19.321 -24.572 1.00 0.00 C ATOM 3520 O HIS Y 105 -7.732 19.461 -23.502 1.00 0.00 O ATOM 3521 CB HIS Y 105 -7.299 17.847 -26.334 1.00 0.00 C ATOM 3522 CG HIS Y 105 -5.940 17.852 -25.692 1.00 0.00 C ATOM 3523 ND1 HIS Y 105 -5.587 16.939 -24.708 1.00 0.00 N ATOM 3524 CD2 HIS Y 105 -4.836 18.646 -25.881 1.00 0.00 C ATOM 3525 CE1 HIS Y 105 -4.319 17.203 -24.345 1.00 0.00 C ATOM 3526 NE2 HIS Y 105 -3.818 18.233 -25.030 1.00 0.00 N ATOM 0 H HIS Y 105 -9.726 17.638 -26.864 1.00 0.00 H new ATOM 0 HA HIS Y 105 -8.205 17.169 -24.508 1.00 0.00 H new ATOM 0 HB2 HIS Y 105 -7.438 16.933 -26.911 1.00 0.00 H new ATOM 0 HB3 HIS Y 105 -7.388 18.680 -27.031 1.00 0.00 H new ATOM 0 HD1 HIS Y 105 -6.181 16.202 -24.329 1.00 0.00 H new ATOM 0 HD2 HIS Y 105 -4.769 19.465 -26.582 1.00 0.00 H new ATOM 0 HE1 HIS Y 105 -3.775 16.651 -23.593 1.00 0.00 H new ATOM 3535 N LYS Y 106 -8.847 20.331 -25.180 1.00 0.00 N ATOM 3536 CA LYS Y 106 -8.808 21.687 -24.562 1.00 0.00 C ATOM 3537 C LYS Y 106 -9.502 21.647 -23.200 1.00 0.00 C ATOM 3538 O LYS Y 106 -9.152 22.370 -22.283 1.00 0.00 O ATOM 3539 CB LYS Y 106 -9.519 22.694 -25.466 1.00 0.00 C ATOM 3540 CG LYS Y 106 -8.651 22.979 -26.693 1.00 0.00 C ATOM 3541 CD LYS Y 106 -9.358 23.988 -27.606 1.00 0.00 C ATOM 3542 CE LYS Y 106 -9.540 25.327 -26.874 1.00 0.00 C ATOM 3543 NZ LYS Y 106 -9.601 26.432 -27.873 1.00 0.00 N ATOM 0 H LYS Y 106 -9.328 20.277 -26.078 1.00 0.00 H new ATOM 0 HA LYS Y 106 -7.769 21.992 -24.435 1.00 0.00 H new ATOM 0 HB2 LYS Y 106 -10.487 22.301 -25.776 1.00 0.00 H new ATOM 0 HB3 LYS Y 106 -9.710 23.618 -24.920 1.00 0.00 H new ATOM 0 HG2 LYS Y 106 -7.683 23.372 -26.382 1.00 0.00 H new ATOM 0 HG3 LYS Y 106 -8.459 22.054 -27.237 1.00 0.00 H new ATOM 0 HD2 LYS Y 106 -8.775 24.138 -28.515 1.00 0.00 H new ATOM 0 HD3 LYS Y 106 -10.329 23.596 -27.911 1.00 0.00 H new ATOM 0 HE2 LYS Y 106 -10.454 25.308 -26.280 1.00 0.00 H new ATOM 0 HE3 LYS Y 106 -8.713 25.492 -26.183 1.00 0.00 H new ATOM 0 HZ1 LYS Y 106 -9.724 27.339 -27.380 1.00 0.00 H new ATOM 0 HZ2 LYS Y 106 -8.718 26.453 -28.422 1.00 0.00 H new ATOM 0 HZ3 LYS Y 106 -10.404 26.275 -28.515 1.00 0.00 H new ATOM 3557 N LYS Y 107 -10.480 20.807 -23.041 1.00 0.00 N ATOM 3558 CA LYS Y 107 -11.161 20.753 -21.727 1.00 0.00 C ATOM 3559 C LYS Y 107 -10.116 20.386 -20.681 1.00 0.00 C ATOM 3560 O LYS Y 107 -10.094 20.940 -19.608 1.00 0.00 O ATOM 3561 CB LYS Y 107 -12.262 19.689 -21.765 1.00 0.00 C ATOM 3562 CG LYS Y 107 -12.982 19.631 -20.416 1.00 0.00 C ATOM 3563 CD LYS Y 107 -14.076 18.563 -20.477 1.00 0.00 C ATOM 3564 CE LYS Y 107 -14.804 18.495 -19.134 1.00 0.00 C ATOM 3565 NZ LYS Y 107 -15.623 19.726 -18.951 1.00 0.00 N ATOM 0 H LYS Y 107 -10.832 20.166 -23.752 1.00 0.00 H new ATOM 0 HA LYS Y 107 -11.617 21.713 -21.486 1.00 0.00 H new ATOM 0 HB2 LYS Y 107 -12.975 19.920 -22.557 1.00 0.00 H new ATOM 0 HB3 LYS Y 107 -11.830 18.716 -21.998 1.00 0.00 H new ATOM 0 HG2 LYS Y 107 -12.273 19.398 -19.621 1.00 0.00 H new ATOM 0 HG3 LYS Y 107 -13.417 20.602 -20.180 1.00 0.00 H new ATOM 0 HD2 LYS Y 107 -14.783 18.797 -21.273 1.00 0.00 H new ATOM 0 HD3 LYS Y 107 -13.638 17.593 -20.714 1.00 0.00 H new ATOM 0 HE2 LYS Y 107 -15.442 17.612 -19.098 1.00 0.00 H new ATOM 0 HE3 LYS Y 107 -14.083 18.401 -18.322 1.00 0.00 H new ATOM 0 HZ1 LYS Y 107 -16.316 19.572 -18.191 1.00 0.00 H new ATOM 0 HZ2 LYS Y 107 -15.003 20.521 -18.698 1.00 0.00 H new ATOM 0 HZ3 LYS Y 107 -16.123 19.945 -19.836 1.00 0.00 H new ATOM 3579 N LEU Y 108 -9.228 19.480 -21.006 1.00 0.00 N ATOM 3580 CA LEU Y 108 -8.153 19.091 -20.041 1.00 0.00 C ATOM 3581 C LEU Y 108 -7.213 20.286 -19.825 1.00 0.00 C ATOM 3582 O LEU Y 108 -6.736 20.521 -18.734 1.00 0.00 O ATOM 3583 CB LEU Y 108 -7.366 17.891 -20.612 1.00 0.00 C ATOM 3584 CG LEU Y 108 -6.604 17.135 -19.491 1.00 0.00 C ATOM 3585 CD1 LEU Y 108 -6.443 15.659 -19.868 1.00 0.00 C ATOM 3586 CD2 LEU Y 108 -5.205 17.733 -19.283 1.00 0.00 C ATOM 0 H LEU Y 108 -9.201 18.991 -21.901 1.00 0.00 H new ATOM 0 HA LEU Y 108 -8.594 18.806 -19.086 1.00 0.00 H new ATOM 0 HB2 LEU Y 108 -8.052 17.208 -21.113 1.00 0.00 H new ATOM 0 HB3 LEU Y 108 -6.659 18.241 -21.364 1.00 0.00 H new ATOM 0 HG LEU Y 108 -7.183 17.231 -18.573 1.00 0.00 H new ATOM 0 HD11 LEU Y 108 -5.907 15.137 -19.075 1.00 0.00 H new ATOM 0 HD12 LEU Y 108 -7.426 15.208 -19.999 1.00 0.00 H new ATOM 0 HD13 LEU Y 108 -5.881 15.580 -20.798 1.00 0.00 H new ATOM 0 HD21 LEU Y 108 -4.690 17.187 -18.493 1.00 0.00 H new ATOM 0 HD22 LEU Y 108 -4.635 17.655 -20.209 1.00 0.00 H new ATOM 0 HD23 LEU Y 108 -5.296 18.782 -19.000 1.00 0.00 H new ATOM 3598 N MET Y 109 -6.941 21.047 -20.857 1.00 0.00 N ATOM 3599 CA MET Y 109 -6.026 22.217 -20.701 1.00 0.00 C ATOM 3600 C MET Y 109 -6.402 23.014 -19.452 1.00 0.00 C ATOM 3601 O MET Y 109 -5.579 23.718 -18.901 1.00 0.00 O ATOM 3602 CB MET Y 109 -6.085 23.127 -21.933 1.00 0.00 C ATOM 3603 CG MET Y 109 -5.436 22.417 -23.122 1.00 0.00 C ATOM 3604 SD MET Y 109 -3.644 22.319 -22.847 1.00 0.00 S ATOM 3605 CE MET Y 109 -3.351 20.683 -23.570 1.00 0.00 C ATOM 0 H MET Y 109 -7.312 20.908 -21.797 1.00 0.00 H new ATOM 0 HA MET Y 109 -5.008 21.841 -20.598 1.00 0.00 H new ATOM 0 HB2 MET Y 109 -7.120 23.376 -22.165 1.00 0.00 H new ATOM 0 HB3 MET Y 109 -5.569 24.066 -21.730 1.00 0.00 H new ATOM 0 HG2 MET Y 109 -5.854 21.417 -23.237 1.00 0.00 H new ATOM 0 HG3 MET Y 109 -5.646 22.959 -24.044 1.00 0.00 H new ATOM 0 HE1 MET Y 109 -2.354 20.337 -23.296 1.00 0.00 H new ATOM 0 HE2 MET Y 109 -4.095 19.981 -23.194 1.00 0.00 H new ATOM 0 HE3 MET Y 109 -3.427 20.746 -24.655 1.00 0.00 H new ATOM 3615 N PHE Y 110 -7.637 22.927 -19.009 1.00 0.00 N ATOM 3616 CA PHE Y 110 -8.055 23.703 -17.789 1.00 0.00 C ATOM 3617 C PHE Y 110 -6.930 23.673 -16.736 1.00 0.00 C ATOM 3618 O PHE Y 110 -6.533 24.693 -16.211 1.00 0.00 O ATOM 3619 CB PHE Y 110 -9.356 23.092 -17.202 1.00 0.00 C ATOM 3620 CG PHE Y 110 -9.050 21.988 -16.197 1.00 0.00 C ATOM 3621 CD1 PHE Y 110 -8.699 22.320 -14.881 1.00 0.00 C ATOM 3622 CD2 PHE Y 110 -9.114 20.641 -16.577 1.00 0.00 C ATOM 3623 CE1 PHE Y 110 -8.413 21.307 -13.956 1.00 0.00 C ATOM 3624 CE2 PHE Y 110 -8.826 19.636 -15.656 1.00 0.00 C ATOM 3625 CZ PHE Y 110 -8.477 19.965 -14.348 1.00 0.00 C ATOM 0 H PHE Y 110 -8.369 22.358 -19.434 1.00 0.00 H new ATOM 0 HA PHE Y 110 -8.244 24.739 -18.069 1.00 0.00 H new ATOM 0 HB2 PHE Y 110 -9.941 23.874 -16.718 1.00 0.00 H new ATOM 0 HB3 PHE Y 110 -9.968 22.691 -18.010 1.00 0.00 H new ATOM 0 HD1 PHE Y 110 -8.649 23.356 -14.580 1.00 0.00 H new ATOM 0 HD2 PHE Y 110 -9.388 20.380 -17.589 1.00 0.00 H new ATOM 0 HE1 PHE Y 110 -8.143 21.562 -12.942 1.00 0.00 H new ATOM 0 HE2 PHE Y 110 -8.873 18.600 -15.957 1.00 0.00 H new ATOM 0 HZ PHE Y 110 -8.256 19.184 -13.636 1.00 0.00 H new ATOM 3635 N LYS Y 111 -6.410 22.512 -16.441 1.00 0.00 N ATOM 3636 CA LYS Y 111 -5.304 22.412 -15.442 1.00 0.00 C ATOM 3637 C LYS Y 111 -4.002 22.929 -16.056 1.00 0.00 C ATOM 3638 O LYS Y 111 -3.180 23.531 -15.394 1.00 0.00 O ATOM 3639 CB LYS Y 111 -5.119 20.950 -15.043 1.00 0.00 C ATOM 3640 CG LYS Y 111 -4.535 20.165 -16.218 1.00 0.00 C ATOM 3641 CD LYS Y 111 -4.664 18.660 -15.959 1.00 0.00 C ATOM 3642 CE LYS Y 111 -6.121 18.210 -16.127 1.00 0.00 C ATOM 3643 NZ LYS Y 111 -6.167 16.757 -16.450 1.00 0.00 N ATOM 0 H LYS Y 111 -6.704 21.625 -16.850 1.00 0.00 H new ATOM 0 HA LYS Y 111 -5.555 23.010 -14.566 1.00 0.00 H new ATOM 0 HB2 LYS Y 111 -4.456 20.879 -14.181 1.00 0.00 H new ATOM 0 HB3 LYS Y 111 -6.076 20.520 -14.746 1.00 0.00 H new ATOM 0 HG2 LYS Y 111 -5.056 20.430 -17.138 1.00 0.00 H new ATOM 0 HG3 LYS Y 111 -3.487 20.430 -16.358 1.00 0.00 H new ATOM 0 HD2 LYS Y 111 -4.025 18.110 -16.650 1.00 0.00 H new ATOM 0 HD3 LYS Y 111 -4.319 18.427 -14.952 1.00 0.00 H new ATOM 0 HE2 LYS Y 111 -6.679 18.406 -15.212 1.00 0.00 H new ATOM 0 HE3 LYS Y 111 -6.599 18.784 -16.921 1.00 0.00 H new ATOM 0 HZ1 LYS Y 111 -6.899 16.584 -17.169 1.00 0.00 H new ATOM 0 HZ2 LYS Y 111 -5.242 16.454 -16.817 1.00 0.00 H new ATOM 0 HZ3 LYS Y 111 -6.392 16.217 -15.590 1.00 0.00 H new ATOM 3657 N THR Y 112 -3.801 22.667 -17.318 1.00 0.00 N ATOM 3658 CA THR Y 112 -2.548 23.114 -17.981 1.00 0.00 C ATOM 3659 C THR Y 112 -2.461 24.635 -17.892 1.00 0.00 C ATOM 3660 O THR Y 112 -1.411 25.198 -17.653 1.00 0.00 O ATOM 3661 CB THR Y 112 -2.573 22.680 -19.447 1.00 0.00 C ATOM 3662 OG1 THR Y 112 -2.970 21.318 -19.525 1.00 0.00 O ATOM 3663 CG2 THR Y 112 -1.178 22.830 -20.051 1.00 0.00 C ATOM 0 H THR Y 112 -4.453 22.162 -17.918 1.00 0.00 H new ATOM 0 HA THR Y 112 -1.682 22.669 -17.491 1.00 0.00 H new ATOM 0 HB THR Y 112 -3.277 23.304 -19.997 1.00 0.00 H new ATOM 0 HG1 THR Y 112 -2.974 21.031 -20.462 1.00 0.00 H new ATOM 0 HG21 THR Y 112 -1.199 22.520 -21.096 1.00 0.00 H new ATOM 0 HG22 THR Y 112 -0.864 23.872 -19.988 1.00 0.00 H new ATOM 0 HG23 THR Y 112 -0.474 22.205 -19.501 1.00 0.00 H new ATOM 3671 N GLU Y 113 -3.567 25.302 -18.069 1.00 0.00 N ATOM 3672 CA GLU Y 113 -3.568 26.786 -17.981 1.00 0.00 C ATOM 3673 CB GLU Y 113 -3.354 27.195 -16.523 1.00 0.00 C ATOM 3674 CG GLU Y 113 -4.439 26.552 -15.654 1.00 0.00 C ATOM 3675 CD GLU Y 113 -4.231 26.957 -14.194 1.00 0.00 C ATOM 3676 OE1 GLU Y 113 -3.195 27.531 -13.901 1.00 0.00 O ATOM 3677 OE2 GLU Y 113 -5.111 26.686 -13.395 1.00 0.00 O ATOM 0 H GLU Y 113 -4.473 24.880 -18.272 1.00 0.00 H new ATOM 0 HB2 GLU Y 113 -2.367 26.879 -16.186 1.00 0.00 H new ATOM 0 HB3 GLU Y 113 -3.391 28.280 -16.428 1.00 0.00 H new ATOM 0 HG2 GLU Y 113 -5.426 26.868 -15.993 1.00 0.00 H new ATOM 0 HG3 GLU Y 113 -4.401 25.467 -15.750 1.00 0.00 H new TER 3684 GLU Y 113 HETATM 3685 CA CA A 114 -4.041 23.293 4.135 1.00 0.00 CA HETATM 3686 CA CA A 115 1.257 30.099 -4.645 1.00 0.00 CA HETATM 3687 CA CA B 116 10.378 4.636 -23.878 1.00 0.00 CA HETATM 3688 CA CA B 117 11.839 16.721 -24.344 1.00 0.00 CA