USER MOD reduce.3.24.130724 H: found=0, std=0, add=2001, rem=0, adj=63 USER MOD reduce.3.24.130724 removed 2000 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 54 TYR OH : rot -142:sc= 1.63 USER MOD Set 1.2: B 119 HIS : no HE2:sc= -7.31! C(o=-8.4!,f=-16!) USER MOD Set 1.3: B 122 CYS SG : rot 30:sc= -3.28! USER MOD Set 1.4: B 128 THR OG1 : rot -136:sc= 0.611 USER MOD Set 2.1: A 10 THR OG1 : rot 78:sc= 0.00247 USER MOD Set 2.2: B 80 THR OG1 : rot 180:sc= 0.00277 USER MOD Set 3.1: B 57 CYS SG : rot 85:sc= -0.882 USER MOD Set 3.2: B 124 TYR OH : rot 180:sc= 0.109 USER MOD Set 4.1: A 55 SER OG : rot -89:sc= 0.939 USER MOD Set 4.2: B 11 SER OG : rot 29:sc= 1.51 USER MOD Set 5.1: A 126 ASN : amide:sc= -0.413 K(o=-0.57,f=-1.2!) USER MOD Set 5.2: A 130 ASN : amide:sc= -0.155 X(o=-0.57,f=-0.89) USER MOD Set 6.1: A 125 SER OG : rot 180:sc= 0.908 USER MOD Set 6.2: B 131 ASN :FLIP amide:sc= 1.13 F(o=1.3,f=2) USER MOD Set 7.1: A 80 THR OG1 : rot 180:sc= 0 USER MOD Set 7.2: B 10 THR OG1 : rot -130:sc= 0.777 USER MOD Set 7.3: B 22 HIS : no HE2:sc= 0.782 K(o=1.6,f=-5.1!) USER MOD Set 8.1: A 78 THR OG1 : rot 180:sc= -0.867 USER MOD Set 8.2: B 12 THR OG1 : rot -75:sc= 0.172 USER MOD Set 9.1: A 57 CYS SG : rot -15:sc= -7.31! USER MOD Set 9.2: A 124 TYR OH : rot -116:sc= 1.39 USER MOD Set10.1: A 54 TYR OH : rot -119:sc= 0.269 USER MOD Set10.2: A 119 HIS : no HD1:sc= -2.72 K(o=-2.5,f=-7.3!) USER MOD Set11.1: A 45 ASN : amide:sc= 0.251 X(o=0.54,f=0.4) USER MOD Set11.2: B 5 TYR OH : rot 180:sc= 0.286 USER MOD Set12.1: A 29 LYS NZ :NH3+ -130:sc= 0.188 (180deg=-1.09) USER MOD Set12.2: A 31 SER OG : rot 139:sc= -1.58 USER MOD Set13.1: A 21 SER OG : rot 40:sc= -1.8! USER MOD Set13.2: B 48 GLN :FLIP amide:sc= -4.01! C(o=-9.5!,f=-5.8!) USER MOD Set14.1: A 5 TYR OH : rot 180:sc= 0.922 USER MOD Set14.2: A 7 THR OG1 : rot 23:sc= 1.82 USER MOD Set14.3: A 25 LYS NZ :NH3+ 171:sc= 3.42 (180deg=-0.0163) USER MOD Set14.4: B 45 ASN : amide:sc= 1.05 K(o=7.2,f=-1.7!) USER MOD Single : A 1 MET CE :methyl 168:sc= -3.67! (180deg=-4.37) USER MOD Single : A 1 MET N :NH3+ -118:sc= 0.0678 (180deg=-0.0164) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 6 LYS NZ :NH3+ -130:sc= 0.963 (180deg=0.337!) USER MOD Single : A 11 SER OG : rot 20:sc= 0.0432 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot -120:sc= 0.961 USER MOD Single : A 22 HIS : no HD1:sc= -0.0174 X(o=-0.017,f=-0.017) USER MOD Single : A 24 GLN : amide:sc= 0.274 X(o=0.27,f=-0.077) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.7 USER MOD Single : A 48 GLN : amide:sc= -4.81! C(o=-4.8!,f=-7.9!) USER MOD Single : A 60 SER OG : rot 104:sc= 0.748 USER MOD Single : A 62 MET CE :methyl 167:sc= -1.32 (180deg=-1.76) USER MOD Single : A 63 LYS NZ :NH3+ -165:sc= -0.0877 (180deg=-0.283) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0.14) USER MOD Single : A 69 ASN : amide:sc= -1.18 K(o=-1.2,f=-2.4!) USER MOD Single : A 70 LYS NZ :NH3+ -168:sc= 0.195 (180deg=0.0993) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=-0.069) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 48:sc= 1.07 USER MOD Single : A 88 ASN : amide:sc= -0.518 K(o=-0.52,f=-11!) USER MOD Single : A 112 LYS NZ :NH3+ 157:sc= -0.155 (180deg=-0.741) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 HIS : no HD1:sc= -0.435 X(o=-0.44,f=-0.041) USER MOD Single : A 122 CYS SG : rot -51:sc= -0.28 USER MOD Single : A 128 THR OG1 : rot -47:sc= 0.0225 USER MOD Single : A 131 ASN : amide:sc= -0.158! X(o=-0.16!,f=-0.022) USER MOD Single : B 1 MET CE :methyl 163:sc= -2.52 (180deg=-3.32) USER MOD Single : B 1 MET N :NH3+ -121:sc= 0.136 (180deg=-0.00813) USER MOD Single : B 2 ASN : amide:sc= -0.0124 X(o=-0.012,f=-0.46) USER MOD Single : B 6 LYS NZ :NH3+ 175:sc= 1.27 (180deg=1.23) USER MOD Single : B 7 THR OG1 : rot 38:sc= 0.685 USER MOD Single : B 20 THR OG1 : rot -73:sc= 0.0409 USER MOD Single : B 21 SER OG : rot -70:sc= -0.783 USER MOD Single : B 24 GLN : amide:sc= -0.266 K(o=-0.27,f=-0.77) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ -107:sc= -2.29! (180deg=-5.15!) USER MOD Single : B 31 SER OG : rot -16:sc= 0.38 USER MOD Single : B 44 THR OG1 : rot 180:sc= 0 USER MOD Single : B 55 SER OG : rot -0:sc= 0.55 USER MOD Single : B 60 SER OG : rot -93:sc= 0.612 USER MOD Single : B 62 MET CE :methyl 168:sc= -1.47 (180deg=-2.11!) USER MOD Single : B 63 LYS NZ :NH3+ 140:sc= 1.41 (180deg=1.05) USER MOD Single : B 68 GLN : amide:sc= -0.172 X(o=-0.17,f=0.21) USER MOD Single : B 69 ASN : amide:sc= -1.58 K(o=-1.6,f=-6.5!) USER MOD Single : B 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 71 GLN : amide:sc= -0.0915 X(o=-0.091,f=-0.0056) USER MOD Single : B 72 THR OG1 : rot 180:sc= 0 USER MOD Single : B 77 THR OG1 : rot 47:sc= 0.775 USER MOD Single : B 78 THR OG1 : rot 180:sc= -0.401 USER MOD Single : B 88 ASN : amide:sc= -0.17 K(o=-0.17,f=-11!) USER MOD Single : B 112 LYS NZ :NH3+ -166:sc= -0.0119 (180deg=-0.177) USER MOD Single : B 113 THR OG1 : rot 180:sc= 0 USER MOD Single : B 120 HIS : no HD1:sc= -0.853 X(o=-0.85,f=-0.96) USER MOD Single : B 130 ASN : amide:sc= -1.8 K(o=-1.8,f=-5.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.566 1.015 2.648 1.00 60.05 N ATOM 2 CA MET A 1 2.753 1.436 1.235 1.00 3.23 C ATOM 3 C MET A 1 3.395 0.315 0.413 1.00 42.13 C ATOM 4 O MET A 1 3.563 -0.802 0.901 1.00 30.31 O ATOM 5 CB MET A 1 3.639 2.679 1.163 1.00 13.52 C ATOM 6 CG MET A 1 5.042 2.409 1.647 1.00 60.32 C ATOM 7 SD MET A 1 6.182 3.756 1.304 1.00 71.43 S ATOM 8 CE MET A 1 7.724 2.887 1.532 1.00 20.11 C ATOM 0 H1 MET A 1 1.552 1.020 2.881 1.00 60.05 H new ATOM 0 H2 MET A 1 2.946 0.056 2.778 1.00 60.05 H new ATOM 0 H3 MET A 1 3.069 1.674 3.276 1.00 60.05 H new ATOM 0 HA MET A 1 1.770 1.663 0.822 1.00 3.23 H new ATOM 0 HB2 MET A 1 3.674 3.038 0.135 1.00 13.52 H new ATOM 0 HB3 MET A 1 3.196 3.474 1.763 1.00 13.52 H new ATOM 0 HG2 MET A 1 5.020 2.225 2.721 1.00 60.32 H new ATOM 0 HG3 MET A 1 5.413 1.499 1.176 1.00 60.32 H new ATOM 0 HE1 MET A 1 8.545 3.498 1.157 1.00 20.11 H new ATOM 0 HE2 MET A 1 7.876 2.687 2.593 1.00 20.11 H new ATOM 0 HE3 MET A 1 7.694 1.944 0.986 1.00 20.11 H new ATOM 20 N ASN A 2 3.762 0.618 -0.834 1.00 22.52 N ATOM 21 CA ASN A 2 4.458 -0.344 -1.694 1.00 14.33 C ATOM 22 C ASN A 2 5.905 -0.544 -1.228 1.00 22.14 C ATOM 23 O ASN A 2 6.838 0.052 -1.766 1.00 72.55 O ATOM 24 CB ASN A 2 4.437 0.115 -3.159 1.00 31.34 C ATOM 25 CG ASN A 2 5.113 -0.883 -4.090 1.00 75.52 C ATOM 26 OD1 ASN A 2 5.067 -2.093 -3.862 1.00 52.13 O ATOM 27 ND2 ASN A 2 5.760 -0.388 -5.135 1.00 35.23 N ATOM 0 H ASN A 2 3.589 1.523 -1.272 1.00 22.52 H new ATOM 0 HA ASN A 2 3.932 -1.296 -1.621 1.00 14.33 H new ATOM 0 HB2 ASN A 2 3.405 0.262 -3.476 1.00 31.34 H new ATOM 0 HB3 ASN A 2 4.936 1.080 -3.242 1.00 31.34 H new ATOM 0 HD21 ASN A 2 6.240 -1.014 -5.781 1.00 35.23 H new ATOM 0 HD22 ASN A 2 5.778 0.619 -5.294 1.00 35.23 H new ATOM 34 N ILE A 3 6.068 -1.338 -0.182 1.00 0.23 N ATOM 35 CA ILE A 3 7.383 -1.699 0.337 1.00 51.02 C ATOM 36 C ILE A 3 8.109 -2.686 -0.575 1.00 3.13 C ATOM 37 O ILE A 3 7.525 -3.664 -1.049 1.00 22.24 O ATOM 38 CB ILE A 3 7.253 -2.328 1.744 1.00 43.32 C ATOM 39 CG1 ILE A 3 6.562 -1.349 2.696 1.00 25.54 C ATOM 40 CG2 ILE A 3 8.619 -2.733 2.285 1.00 24.42 C ATOM 41 CD1 ILE A 3 7.380 -0.118 2.988 1.00 23.10 C ATOM 0 H ILE A 3 5.292 -1.753 0.334 1.00 0.23 H new ATOM 0 HA ILE A 3 7.966 -0.779 0.386 1.00 51.02 H new ATOM 0 HB ILE A 3 6.643 -3.228 1.666 1.00 43.32 H new ATOM 0 HG12 ILE A 3 5.607 -1.048 2.265 1.00 25.54 H new ATOM 0 HG13 ILE A 3 6.341 -1.860 3.633 1.00 25.54 H new ATOM 0 HG21 ILE A 3 8.502 -3.173 3.275 1.00 24.42 H new ATOM 0 HG22 ILE A 3 9.074 -3.463 1.615 1.00 24.42 H new ATOM 0 HG23 ILE A 3 9.259 -1.853 2.352 1.00 24.42 H new ATOM 0 HD11 ILE A 3 6.830 0.531 3.669 1.00 23.10 H new ATOM 0 HD12 ILE A 3 8.324 -0.409 3.448 1.00 23.10 H new ATOM 0 HD13 ILE A 3 7.579 0.416 2.059 1.00 23.10 H new ATOM 53 N LEU A 4 9.387 -2.414 -0.809 1.00 41.13 N ATOM 54 CA LEU A 4 10.265 -3.324 -1.535 1.00 42.04 C ATOM 55 C LEU A 4 10.914 -4.308 -0.566 1.00 41.22 C ATOM 56 O LEU A 4 11.015 -5.502 -0.855 1.00 74.21 O ATOM 57 CB LEU A 4 11.351 -2.543 -2.283 1.00 22.30 C ATOM 58 CG LEU A 4 10.841 -1.517 -3.300 1.00 5.11 C ATOM 59 CD1 LEU A 4 12.010 -0.783 -3.957 1.00 73.22 C ATOM 60 CD2 LEU A 4 9.956 -2.187 -4.353 1.00 52.13 C ATOM 0 H LEU A 4 9.844 -1.556 -0.501 1.00 41.13 H new ATOM 0 HA LEU A 4 9.666 -3.874 -2.261 1.00 42.04 H new ATOM 0 HB2 LEU A 4 11.972 -2.026 -1.551 1.00 22.30 H new ATOM 0 HB3 LEU A 4 11.994 -3.254 -2.801 1.00 22.30 H new ATOM 0 HG LEU A 4 10.234 -0.784 -2.769 1.00 5.11 H new ATOM 0 HD11 LEU A 4 11.627 -0.059 -4.676 1.00 73.22 H new ATOM 0 HD12 LEU A 4 12.589 -0.264 -3.193 1.00 73.22 H new ATOM 0 HD13 LEU A 4 12.648 -1.502 -4.471 1.00 73.22 H new ATOM 0 HD21 LEU A 4 9.606 -1.438 -5.064 1.00 52.13 H new ATOM 0 HD22 LEU A 4 10.531 -2.948 -4.881 1.00 52.13 H new ATOM 0 HD23 LEU A 4 9.100 -2.653 -3.865 1.00 52.13 H new ATOM 72 N TYR A 5 11.363 -3.801 0.584 1.00 24.01 N ATOM 73 CA TYR A 5 11.980 -4.653 1.605 1.00 4.44 C ATOM 74 C TYR A 5 11.599 -4.175 2.999 1.00 12.52 C ATOM 75 O TYR A 5 11.610 -2.984 3.271 1.00 21.34 O ATOM 76 CB TYR A 5 13.509 -4.664 1.453 1.00 54.43 C ATOM 77 CG TYR A 5 14.236 -5.549 2.461 1.00 2.54 C ATOM 78 CD1 TYR A 5 14.638 -5.047 3.697 1.00 4.50 C ATOM 79 CD2 TYR A 5 14.530 -6.878 2.169 1.00 14.20 C ATOM 80 CE1 TYR A 5 15.310 -5.840 4.609 1.00 2.54 C ATOM 81 CE2 TYR A 5 15.200 -7.678 3.081 1.00 4.33 C ATOM 82 CZ TYR A 5 15.589 -7.154 4.297 1.00 33.20 C ATOM 83 OH TYR A 5 16.262 -7.946 5.206 1.00 31.30 O ATOM 0 H TYR A 5 11.312 -2.813 0.831 1.00 24.01 H new ATOM 0 HA TYR A 5 11.610 -5.669 1.467 1.00 4.44 H new ATOM 0 HB2 TYR A 5 13.760 -4.999 0.446 1.00 54.43 H new ATOM 0 HB3 TYR A 5 13.879 -3.643 1.551 1.00 54.43 H new ATOM 0 HD1 TYR A 5 14.421 -4.019 3.947 1.00 4.50 H new ATOM 0 HD2 TYR A 5 14.231 -7.292 1.217 1.00 14.20 H new ATOM 0 HE1 TYR A 5 15.615 -5.432 5.561 1.00 2.54 H new ATOM 0 HE2 TYR A 5 15.417 -8.708 2.841 1.00 4.33 H new ATOM 0 HH TYR A 5 16.378 -8.845 4.833 1.00 31.30 H new ATOM 93 N LYS A 6 11.266 -5.112 3.869 1.00 51.40 N ATOM 94 CA LYS A 6 10.910 -4.810 5.255 1.00 43.32 C ATOM 95 C LYS A 6 11.476 -5.873 6.192 1.00 62.42 C ATOM 96 O LYS A 6 11.449 -7.065 5.885 1.00 13.53 O ATOM 97 CB LYS A 6 9.381 -4.688 5.418 1.00 1.54 C ATOM 98 CG LYS A 6 8.908 -4.519 6.866 1.00 51.03 C ATOM 99 CD LYS A 6 7.490 -3.941 6.955 1.00 30.33 C ATOM 100 CE LYS A 6 7.440 -2.473 6.526 1.00 61.32 C ATOM 101 NZ LYS A 6 6.085 -1.881 6.692 1.00 4.41 N1+ ATOM 0 H LYS A 6 11.233 -6.105 3.640 1.00 51.40 H new ATOM 0 HA LYS A 6 11.350 -3.849 5.521 1.00 43.32 H new ATOM 0 HB2 LYS A 6 9.033 -3.836 4.834 1.00 1.54 H new ATOM 0 HB3 LYS A 6 8.911 -5.577 4.997 1.00 1.54 H new ATOM 0 HG2 LYS A 6 8.936 -5.485 7.369 1.00 51.03 H new ATOM 0 HG3 LYS A 6 9.598 -3.863 7.397 1.00 51.03 H new ATOM 0 HD2 LYS A 6 6.820 -4.526 6.324 1.00 30.33 H new ATOM 0 HD3 LYS A 6 7.125 -4.032 7.978 1.00 30.33 H new ATOM 0 HE2 LYS A 6 8.158 -1.901 7.113 1.00 61.32 H new ATOM 0 HE3 LYS A 6 7.744 -2.391 5.482 1.00 61.32 H new ATOM 0 HZ1 LYS A 6 5.805 -1.403 5.812 1.00 4.41 H new ATOM 0 HZ2 LYS A 6 5.401 -2.634 6.909 1.00 4.41 H new ATOM 0 HZ3 LYS A 6 6.100 -1.192 7.471 1.00 4.41 H new ATOM 115 N THR A 7 12.006 -5.417 7.316 1.00 30.21 N ATOM 116 CA THR A 7 12.623 -6.282 8.308 1.00 33.22 C ATOM 117 C THR A 7 12.148 -5.864 9.705 1.00 54.23 C ATOM 118 O THR A 7 11.875 -4.680 9.948 1.00 73.02 O ATOM 119 CB THR A 7 14.169 -6.206 8.189 1.00 43.13 C ATOM 120 OG1 THR A 7 14.814 -7.058 9.150 1.00 11.53 O ATOM 121 CG2 THR A 7 14.662 -4.772 8.349 1.00 62.33 C ATOM 0 H THR A 7 12.020 -4.428 7.567 1.00 30.21 H new ATOM 0 HA THR A 7 12.328 -7.317 8.137 1.00 33.22 H new ATOM 0 HB THR A 7 14.432 -6.557 7.191 1.00 43.13 H new ATOM 0 HG1 THR A 7 14.196 -7.767 9.426 1.00 11.53 H new ATOM 0 HG21 THR A 7 15.748 -4.749 8.261 1.00 62.33 H new ATOM 0 HG22 THR A 7 14.222 -4.147 7.572 1.00 62.33 H new ATOM 0 HG23 THR A 7 14.369 -4.394 9.328 1.00 62.33 H new ATOM 129 N ALA A 8 12.026 -6.829 10.614 1.00 51.42 N ATOM 130 CA ALA A 8 11.404 -6.577 11.913 1.00 62.45 C ATOM 131 C ALA A 8 12.403 -6.654 13.062 1.00 64.34 C ATOM 132 O ALA A 8 13.452 -7.296 12.965 1.00 4.53 O ATOM 133 CB ALA A 8 10.264 -7.561 12.145 1.00 11.23 C ATOM 0 H ALA A 8 12.347 -7.787 10.477 1.00 51.42 H new ATOM 0 HA ALA A 8 11.014 -5.559 11.892 1.00 62.45 H new ATOM 0 HB1 ALA A 8 9.807 -7.366 13.115 1.00 11.23 H new ATOM 0 HB2 ALA A 8 9.516 -7.443 11.361 1.00 11.23 H new ATOM 0 HB3 ALA A 8 10.653 -8.579 12.125 1.00 11.23 H new ATOM 139 N ALA A 9 12.059 -5.985 14.154 1.00 62.04 N ATOM 140 CA ALA A 9 12.831 -6.031 15.384 1.00 13.24 C ATOM 141 C ALA A 9 11.898 -5.928 16.581 1.00 53.42 C ATOM 142 O ALA A 9 11.101 -5.002 16.667 1.00 45.34 O ATOM 143 CB ALA A 9 13.854 -4.907 15.413 1.00 65.14 C ATOM 0 H ALA A 9 11.231 -5.392 14.210 1.00 62.04 H new ATOM 0 HA ALA A 9 13.365 -6.980 15.430 1.00 13.24 H new ATOM 0 HB1 ALA A 9 14.423 -4.957 16.341 1.00 65.14 H new ATOM 0 HB2 ALA A 9 14.532 -5.010 14.566 1.00 65.14 H new ATOM 0 HB3 ALA A 9 13.341 -3.947 15.353 1.00 65.14 H new ATOM 149 N THR A 10 11.981 -6.885 17.488 1.00 61.23 N ATOM 150 CA THR A 10 11.165 -6.872 18.688 1.00 51.35 C ATOM 151 C THR A 10 12.027 -6.502 19.894 1.00 43.21 C ATOM 152 O THR A 10 13.112 -7.056 20.092 1.00 73.43 O ATOM 153 CB THR A 10 10.466 -8.239 18.910 1.00 34.35 C ATOM 154 OG1 THR A 10 9.590 -8.169 20.041 1.00 3.15 O ATOM 155 CG2 THR A 10 11.477 -9.366 19.112 1.00 70.40 C ATOM 0 H THR A 10 12.609 -7.685 17.415 1.00 61.23 H new ATOM 0 HA THR A 10 10.383 -6.122 18.566 1.00 51.35 H new ATOM 0 HB THR A 10 9.889 -8.461 18.012 1.00 34.35 H new ATOM 0 HG1 THR A 10 8.761 -7.714 19.785 1.00 3.15 H new ATOM 0 HG21 THR A 10 10.948 -10.307 19.264 1.00 70.40 H new ATOM 0 HG22 THR A 10 12.113 -9.446 18.231 1.00 70.40 H new ATOM 0 HG23 THR A 10 12.092 -9.151 19.985 1.00 70.40 H new ATOM 163 N SER A 11 11.566 -5.529 20.668 1.00 71.32 N ATOM 164 CA SER A 11 12.280 -5.093 21.855 1.00 2.43 C ATOM 165 C SER A 11 11.477 -5.438 23.107 1.00 11.12 C ATOM 166 O SER A 11 10.341 -4.989 23.270 1.00 53.54 O ATOM 167 CB SER A 11 12.560 -3.585 21.789 1.00 22.21 C ATOM 168 OG SER A 11 13.409 -3.178 22.849 1.00 52.01 O ATOM 0 H SER A 11 10.696 -5.026 20.492 1.00 71.32 H new ATOM 0 HA SER A 11 13.236 -5.615 21.901 1.00 2.43 H new ATOM 0 HB2 SER A 11 13.023 -3.339 20.833 1.00 22.21 H new ATOM 0 HB3 SER A 11 11.620 -3.035 21.839 1.00 22.21 H new ATOM 0 HG SER A 11 13.883 -3.958 23.206 1.00 52.01 H new ATOM 174 N THR A 12 12.061 -6.256 23.971 1.00 54.12 N ATOM 175 CA THR A 12 11.422 -6.665 25.207 1.00 52.53 C ATOM 176 C THR A 12 11.922 -5.816 26.376 1.00 72.12 C ATOM 177 O THR A 12 13.023 -5.252 26.326 1.00 13.04 O ATOM 178 CB THR A 12 11.720 -8.150 25.503 1.00 35.03 C ATOM 179 OG1 THR A 12 11.610 -8.923 24.295 1.00 61.53 O ATOM 180 CG2 THR A 12 10.769 -8.714 26.551 1.00 33.34 C ATOM 0 H THR A 12 12.990 -6.653 23.832 1.00 54.12 H new ATOM 0 HA THR A 12 10.347 -6.525 25.090 1.00 52.53 H new ATOM 0 HB THR A 12 12.736 -8.212 25.894 1.00 35.03 H new ATOM 0 HG1 THR A 12 11.802 -9.864 24.490 1.00 61.53 H new ATOM 0 HG21 THR A 12 11.009 -9.761 26.734 1.00 33.34 H new ATOM 0 HG22 THR A 12 10.874 -8.151 27.478 1.00 33.34 H new ATOM 0 HG23 THR A 12 9.743 -8.634 26.192 1.00 33.34 H new ATOM 188 N GLY A 13 11.115 -5.736 27.420 1.00 62.44 N ATOM 189 CA GLY A 13 11.510 -5.041 28.627 1.00 34.44 C ATOM 190 C GLY A 13 12.197 -5.974 29.606 1.00 13.14 C ATOM 191 O GLY A 13 11.575 -6.446 30.559 1.00 50.55 O ATOM 0 H GLY A 13 10.181 -6.145 27.453 1.00 62.44 H new ATOM 0 HA2 GLY A 13 12.181 -4.221 28.373 1.00 34.44 H new ATOM 0 HA3 GLY A 13 10.632 -4.600 29.098 1.00 34.44 H new ATOM 195 N GLY A 14 13.465 -6.286 29.338 1.00 62.02 N ATOM 196 CA GLY A 14 14.246 -7.109 30.253 1.00 43.32 C ATOM 197 C GLY A 14 14.423 -6.444 31.607 1.00 33.13 C ATOM 198 O GLY A 14 13.471 -6.342 32.383 1.00 44.52 O ATOM 0 H GLY A 14 13.967 -5.984 28.503 1.00 62.02 H new ATOM 0 HA2 GLY A 14 13.754 -8.073 30.384 1.00 43.32 H new ATOM 0 HA3 GLY A 14 15.225 -7.308 29.816 1.00 43.32 H new ATOM 202 N ARG A 15 15.641 -5.996 31.909 1.00 24.13 N ATOM 203 CA ARG A 15 15.876 -5.216 33.120 1.00 34.21 C ATOM 204 C ARG A 15 15.665 -3.731 32.832 1.00 4.22 C ATOM 205 O ARG A 15 14.952 -3.049 33.567 1.00 73.04 O ATOM 206 CB ARG A 15 17.288 -5.444 33.684 1.00 34.44 C ATOM 207 CG ARG A 15 17.533 -4.687 34.992 1.00 1.44 C ATOM 208 CD ARG A 15 18.963 -4.833 35.502 1.00 44.04 C ATOM 209 NE ARG A 15 19.270 -6.195 35.952 1.00 64.51 N ATOM 210 CZ ARG A 15 20.359 -6.515 36.661 1.00 22.54 C ATOM 211 NH1 ARG A 15 21.236 -5.577 37.004 1.00 12.40 N1+ ATOM 212 NH2 ARG A 15 20.570 -7.769 37.038 1.00 44.23 N ATOM 0 H ARG A 15 16.471 -6.158 31.338 1.00 24.13 H new ATOM 0 HA ARG A 15 15.161 -5.550 33.872 1.00 34.21 H new ATOM 0 HB2 ARG A 15 17.439 -6.510 33.853 1.00 34.44 H new ATOM 0 HB3 ARG A 15 18.025 -5.131 32.944 1.00 34.44 H new ATOM 0 HG2 ARG A 15 17.312 -3.630 34.841 1.00 1.44 H new ATOM 0 HG3 ARG A 15 16.842 -5.052 35.752 1.00 1.44 H new ATOM 0 HD2 ARG A 15 19.657 -4.552 34.710 1.00 44.04 H new ATOM 0 HD3 ARG A 15 19.122 -4.138 36.327 1.00 44.04 H new ATOM 0 HE ARG A 15 18.617 -6.940 35.711 1.00 64.51 H new ATOM 0 HH11 ARG A 15 21.081 -4.608 36.727 1.00 12.40 H new ATOM 0 HH12 ARG A 15 22.064 -5.826 37.544 1.00 12.40 H new ATOM 0 HH21 ARG A 15 19.900 -8.496 36.788 1.00 44.23 H new ATOM 0 HH22 ARG A 15 21.402 -8.006 37.578 1.00 44.23 H new ATOM 226 N ASP A 16 16.289 -3.236 31.758 1.00 4.14 N ATOM 227 CA ASP A 16 16.124 -1.833 31.364 1.00 22.02 C ATOM 228 C ASP A 16 15.666 -1.751 29.905 1.00 52.02 C ATOM 229 O ASP A 16 14.747 -0.999 29.578 1.00 74.22 O ATOM 230 CB ASP A 16 17.454 -1.093 31.553 1.00 50.13 C ATOM 231 CG ASP A 16 17.335 0.418 31.398 1.00 53.42 C ATOM 232 OD1 ASP A 16 17.531 1.137 32.399 1.00 45.04 O ATOM 233 OD2 ASP A 16 17.097 0.890 30.269 1.00 61.02 O1- ATOM 0 H ASP A 16 16.906 -3.778 31.153 1.00 4.14 H new ATOM 0 HA ASP A 16 15.365 -1.364 31.990 1.00 22.02 H new ATOM 0 HB2 ASP A 16 17.849 -1.319 32.543 1.00 50.13 H new ATOM 0 HB3 ASP A 16 18.176 -1.469 30.828 1.00 50.13 H new ATOM 238 N GLY A 17 16.280 -2.561 29.030 1.00 73.12 N ATOM 239 CA GLY A 17 15.673 -2.842 27.742 1.00 31.14 C ATOM 240 C GLY A 17 16.396 -3.955 27.022 1.00 63.12 C ATOM 241 O GLY A 17 17.556 -4.232 27.319 1.00 34.35 O ATOM 0 H GLY A 17 17.176 -3.019 29.194 1.00 73.12 H new ATOM 0 HA2 GLY A 17 14.628 -3.117 27.883 1.00 31.14 H new ATOM 0 HA3 GLY A 17 15.686 -1.941 27.128 1.00 31.14 H new ATOM 245 N ARG A 18 15.724 -4.612 26.087 1.00 71.41 N ATOM 246 CA ARG A 18 16.352 -5.672 25.301 1.00 64.41 C ATOM 247 C ARG A 18 15.832 -5.635 23.865 1.00 2.04 C ATOM 248 O ARG A 18 14.634 -5.756 23.631 1.00 73.24 O ATOM 249 CB ARG A 18 16.101 -7.045 25.955 1.00 30.54 C ATOM 250 CG ARG A 18 16.956 -8.181 25.382 1.00 21.30 C ATOM 251 CD ARG A 18 16.212 -9.018 24.345 1.00 2.42 C ATOM 252 NE ARG A 18 15.251 -9.925 24.975 1.00 61.43 N ATOM 253 CZ ARG A 18 14.447 -10.752 24.308 1.00 42.21 C ATOM 254 NH1 ARG A 18 14.431 -10.759 22.979 1.00 65.11 N1+ ATOM 255 NH2 ARG A 18 13.658 -11.583 24.974 1.00 11.32 N ATOM 0 H ARG A 18 14.748 -4.433 25.853 1.00 71.41 H new ATOM 0 HA ARG A 18 17.429 -5.509 25.275 1.00 64.41 H new ATOM 0 HB2 ARG A 18 16.293 -6.965 27.025 1.00 30.54 H new ATOM 0 HB3 ARG A 18 15.049 -7.303 25.838 1.00 30.54 H new ATOM 0 HG2 ARG A 18 17.853 -7.760 24.927 1.00 21.30 H new ATOM 0 HG3 ARG A 18 17.285 -8.828 26.196 1.00 21.30 H new ATOM 0 HD2 ARG A 18 15.690 -8.359 23.651 1.00 2.42 H new ATOM 0 HD3 ARG A 18 16.928 -9.595 23.760 1.00 2.42 H new ATOM 0 HE ARG A 18 15.193 -9.924 25.993 1.00 61.43 H new ATOM 0 HH11 ARG A 18 15.039 -10.127 22.458 1.00 65.11 H new ATOM 0 HH12 ARG A 18 13.811 -11.397 22.480 1.00 65.11 H new ATOM 0 HH21 ARG A 18 13.668 -11.588 25.994 1.00 11.32 H new ATOM 0 HH22 ARG A 18 13.041 -12.217 24.467 1.00 11.32 H new ATOM 269 N ALA A 19 16.742 -5.455 22.912 1.00 71.12 N ATOM 270 CA ALA A 19 16.386 -5.338 21.499 1.00 34.25 C ATOM 271 C ALA A 19 16.798 -6.592 20.736 1.00 41.03 C ATOM 272 O ALA A 19 17.897 -7.114 20.925 1.00 12.34 O ATOM 273 CB ALA A 19 17.045 -4.106 20.890 1.00 5.35 C ATOM 0 H ALA A 19 17.743 -5.386 23.095 1.00 71.12 H new ATOM 0 HA ALA A 19 15.304 -5.230 21.423 1.00 34.25 H new ATOM 0 HB1 ALA A 19 16.772 -4.030 19.837 1.00 5.35 H new ATOM 0 HB2 ALA A 19 16.707 -3.214 21.418 1.00 5.35 H new ATOM 0 HB3 ALA A 19 18.128 -4.191 20.979 1.00 5.35 H new ATOM 279 N THR A 20 15.912 -7.075 19.878 1.00 63.53 N ATOM 280 CA THR A 20 16.176 -8.270 19.091 1.00 0.02 C ATOM 281 C THR A 20 15.636 -8.112 17.672 1.00 61.21 C ATOM 282 O THR A 20 14.429 -8.016 17.463 1.00 50.32 O ATOM 283 CB THR A 20 15.545 -9.513 19.766 1.00 22.13 C ATOM 284 OG1 THR A 20 15.979 -9.585 21.134 1.00 4.20 O ATOM 285 CG2 THR A 20 15.933 -10.800 19.041 1.00 30.30 C ATOM 0 H THR A 20 14.998 -6.654 19.709 1.00 63.53 H new ATOM 0 HA THR A 20 17.256 -8.410 19.037 1.00 0.02 H new ATOM 0 HB THR A 20 14.461 -9.411 19.719 1.00 22.13 H new ATOM 0 HG1 THR A 20 16.457 -10.428 21.282 1.00 4.20 H new ATOM 0 HG21 THR A 20 15.473 -11.652 19.541 1.00 30.30 H new ATOM 0 HG22 THR A 20 15.586 -10.755 18.009 1.00 30.30 H new ATOM 0 HG23 THR A 20 17.017 -10.913 19.055 1.00 30.30 H new ATOM 293 N SER A 21 16.541 -8.070 16.699 1.00 52.22 N ATOM 294 CA SER A 21 16.147 -8.027 15.303 1.00 61.23 C ATOM 295 C SER A 21 15.564 -9.378 14.940 1.00 4.01 C ATOM 296 O SER A 21 16.315 -10.369 14.857 1.00 53.51 O ATOM 297 CB SER A 21 17.334 -7.685 14.398 1.00 62.30 C ATOM 298 OG SER A 21 16.954 -7.680 13.033 1.00 0.33 O ATOM 0 H SER A 21 17.549 -8.065 16.855 1.00 52.22 H new ATOM 0 HA SER A 21 15.404 -7.244 15.155 1.00 61.23 H new ATOM 0 HB2 SER A 21 17.733 -6.708 14.671 1.00 62.30 H new ATOM 0 HB3 SER A 21 18.133 -8.410 14.553 1.00 62.30 H new ATOM 0 HG SER A 21 16.068 -7.272 12.942 1.00 0.33 H new ATOM 304 N HIS A 22 14.232 -9.369 14.724 1.00 22.03 N ATOM 305 CA HIS A 22 13.387 -10.570 14.631 1.00 2.11 C ATOM 306 C HIS A 22 13.851 -11.530 13.550 1.00 71.44 C ATOM 307 O HIS A 22 13.599 -12.731 13.631 1.00 63.31 O ATOM 308 CB HIS A 22 11.928 -10.159 14.371 1.00 42.33 C ATOM 309 CG HIS A 22 10.990 -11.312 14.133 1.00 64.41 C ATOM 310 ND1 HIS A 22 10.465 -11.612 12.894 1.00 70.44 N ATOM 311 CD2 HIS A 22 10.467 -12.227 14.988 1.00 33.23 C ATOM 312 CE1 HIS A 22 9.661 -12.653 12.996 1.00 21.33 C ATOM 313 NE2 HIS A 22 9.645 -13.048 14.256 1.00 41.54 N ATOM 0 H HIS A 22 13.705 -8.504 14.607 1.00 22.03 H new ATOM 0 HA HIS A 22 13.467 -11.095 15.583 1.00 2.11 H new ATOM 0 HB2 HIS A 22 11.568 -9.584 15.224 1.00 42.33 H new ATOM 0 HB3 HIS A 22 11.898 -9.498 13.505 1.00 42.33 H new ATOM 0 HD2 HIS A 22 10.661 -12.297 16.048 1.00 33.23 H new ATOM 0 HE1 HIS A 22 9.109 -13.106 12.186 1.00 21.33 H new ATOM 0 HE2 HIS A 22 9.110 -13.834 14.625 1.00 41.54 H new ATOM 322 N ASP A 23 14.564 -11.009 12.566 1.00 65.30 N ATOM 323 CA ASP A 23 15.090 -11.837 11.480 1.00 52.23 C ATOM 324 C ASP A 23 16.356 -12.550 11.944 1.00 2.53 C ATOM 325 O ASP A 23 17.149 -13.044 11.135 1.00 21.54 O ATOM 326 CB ASP A 23 15.392 -10.970 10.257 1.00 41.44 C ATOM 327 CG ASP A 23 14.150 -10.339 9.649 1.00 73.43 C ATOM 328 OD1 ASP A 23 13.734 -10.785 8.559 1.00 71.33 O ATOM 329 OD2 ASP A 23 13.599 -9.390 10.255 1.00 13.13 O1- ATOM 0 H ASP A 23 14.795 -10.018 12.492 1.00 65.30 H new ATOM 0 HA ASP A 23 14.343 -12.581 11.204 1.00 52.23 H new ATOM 0 HB2 ASP A 23 16.090 -10.182 10.541 1.00 41.44 H new ATOM 0 HB3 ASP A 23 15.889 -11.579 9.502 1.00 41.44 H new ATOM 334 N GLN A 24 16.528 -12.570 13.268 1.00 30.45 N ATOM 335 CA GLN A 24 17.636 -13.240 13.936 1.00 23.53 C ATOM 336 C GLN A 24 18.928 -12.506 13.629 1.00 71.34 C ATOM 337 O GLN A 24 20.027 -13.030 13.809 1.00 22.01 O ATOM 338 CB GLN A 24 17.709 -14.724 13.538 1.00 42.54 C ATOM 339 CG GLN A 24 16.427 -15.502 13.833 1.00 72.53 C ATOM 340 CD GLN A 24 15.998 -15.420 15.293 1.00 14.50 C ATOM 341 OE1 GLN A 24 16.407 -16.237 16.122 1.00 45.33 O ATOM 342 NE2 GLN A 24 15.156 -14.448 15.618 1.00 4.22 N ATOM 0 H GLN A 24 15.886 -12.111 13.914 1.00 30.45 H new ATOM 0 HA GLN A 24 17.474 -13.215 15.014 1.00 23.53 H new ATOM 0 HB2 GLN A 24 17.930 -14.795 12.473 1.00 42.54 H new ATOM 0 HB3 GLN A 24 18.538 -15.193 14.068 1.00 42.54 H new ATOM 0 HG2 GLN A 24 15.624 -15.119 13.203 1.00 72.53 H new ATOM 0 HG3 GLN A 24 16.574 -16.548 13.562 1.00 72.53 H new ATOM 0 HE21 GLN A 24 14.838 -13.790 14.907 1.00 4.22 H new ATOM 0 HE22 GLN A 24 14.826 -14.359 16.579 1.00 4.22 H new ATOM 351 N LYS A 25 18.769 -11.261 13.187 1.00 22.35 N ATOM 352 CA LYS A 25 19.893 -10.414 12.855 1.00 24.04 C ATOM 353 C LYS A 25 20.548 -9.882 14.120 1.00 45.31 C ATOM 354 O LYS A 25 21.754 -9.627 14.132 1.00 73.44 O ATOM 355 CB LYS A 25 19.447 -9.250 11.967 1.00 30.31 C ATOM 356 CG LYS A 25 18.854 -9.708 10.648 1.00 12.14 C ATOM 357 CD LYS A 25 18.329 -8.546 9.820 1.00 61.23 C ATOM 358 CE LYS A 25 17.675 -9.056 8.554 1.00 52.51 C ATOM 359 NZ LYS A 25 17.042 -7.964 7.762 1.00 22.01 N1+ ATOM 0 H LYS A 25 17.859 -10.820 13.052 1.00 22.35 H new ATOM 0 HA LYS A 25 20.620 -11.012 12.306 1.00 24.04 H new ATOM 0 HB2 LYS A 25 18.710 -8.652 12.503 1.00 30.31 H new ATOM 0 HB3 LYS A 25 20.301 -8.602 11.770 1.00 30.31 H new ATOM 0 HG2 LYS A 25 19.612 -10.245 10.078 1.00 12.14 H new ATOM 0 HG3 LYS A 25 18.043 -10.410 10.841 1.00 12.14 H new ATOM 0 HD2 LYS A 25 17.609 -7.971 10.403 1.00 61.23 H new ATOM 0 HD3 LYS A 25 19.147 -7.871 9.568 1.00 61.23 H new ATOM 0 HE2 LYS A 25 18.422 -9.560 7.940 1.00 52.51 H new ATOM 0 HE3 LYS A 25 16.920 -9.799 8.812 1.00 52.51 H new ATOM 0 HZ1 LYS A 25 16.743 -8.334 6.837 1.00 22.01 H new ATOM 0 HZ2 LYS A 25 16.213 -7.600 8.274 1.00 22.01 H new ATOM 0 HZ3 LYS A 25 17.728 -7.195 7.622 1.00 22.01 H new ATOM 373 N LEU A 26 19.762 -9.704 15.199 1.00 32.33 N ATOM 374 CA LEU A 26 20.325 -9.123 16.418 1.00 24.31 C ATOM 375 C LEU A 26 19.579 -9.562 17.655 1.00 21.31 C ATOM 376 O LEU A 26 18.379 -9.797 17.613 1.00 11.34 O ATOM 377 CB LEU A 26 20.314 -7.595 16.297 1.00 35.55 C ATOM 378 CG LEU A 26 20.719 -6.818 17.555 1.00 2.25 C ATOM 379 CD1 LEU A 26 22.197 -7.031 17.882 1.00 31.22 C ATOM 380 CD2 LEU A 26 20.394 -5.340 17.376 1.00 74.42 C ATOM 0 H LEU A 26 18.772 -9.946 15.247 1.00 32.33 H new ATOM 0 HA LEU A 26 21.349 -9.480 16.525 1.00 24.31 H new ATOM 0 HB2 LEU A 26 20.985 -7.310 15.486 1.00 35.55 H new ATOM 0 HB3 LEU A 26 19.311 -7.281 16.007 1.00 35.55 H new ATOM 0 HG LEU A 26 20.147 -7.197 18.402 1.00 2.25 H new ATOM 0 HD11 LEU A 26 22.456 -6.468 18.779 1.00 31.22 H new ATOM 0 HD12 LEU A 26 22.383 -8.091 18.053 1.00 31.22 H new ATOM 0 HD13 LEU A 26 22.808 -6.686 17.048 1.00 31.22 H new ATOM 0 HD21 LEU A 26 20.684 -4.793 18.273 1.00 74.42 H new ATOM 0 HD22 LEU A 26 20.942 -4.948 16.519 1.00 74.42 H new ATOM 0 HD23 LEU A 26 19.324 -5.221 17.208 1.00 74.42 H new ATOM 392 N ASP A 27 20.318 -9.649 18.752 1.00 3.11 N ATOM 393 CA ASP A 27 19.780 -10.074 20.028 1.00 12.11 C ATOM 394 C ASP A 27 20.669 -9.574 21.173 1.00 11.44 C ATOM 395 O ASP A 27 21.641 -10.221 21.556 1.00 42.31 O ATOM 396 CB ASP A 27 19.639 -11.604 20.052 1.00 5.04 C ATOM 397 CG ASP A 27 20.902 -12.350 19.632 1.00 74.13 C ATOM 398 OD1 ASP A 27 21.669 -12.796 20.512 1.00 54.23 O ATOM 399 OD2 ASP A 27 21.126 -12.517 18.412 1.00 11.42 O1- ATOM 0 H ASP A 27 21.313 -9.425 18.778 1.00 3.11 H new ATOM 0 HA ASP A 27 18.789 -9.640 20.165 1.00 12.11 H new ATOM 0 HB2 ASP A 27 19.362 -11.917 21.059 1.00 5.04 H new ATOM 0 HB3 ASP A 27 18.822 -11.894 19.392 1.00 5.04 H new ATOM 404 N VAL A 28 20.353 -8.384 21.687 1.00 5.03 N ATOM 405 CA VAL A 28 21.113 -7.783 22.793 1.00 42.02 C ATOM 406 C VAL A 28 20.211 -6.986 23.729 1.00 62.12 C ATOM 407 O VAL A 28 19.015 -6.832 23.488 1.00 32.30 O ATOM 408 CB VAL A 28 22.249 -6.850 22.295 1.00 24.24 C ATOM 409 CG1 VAL A 28 23.414 -7.654 21.726 1.00 34.22 C ATOM 410 CG2 VAL A 28 21.714 -5.850 21.271 1.00 1.00 C ATOM 0 H VAL A 28 19.575 -7.814 21.357 1.00 5.03 H new ATOM 0 HA VAL A 28 21.555 -8.622 23.331 1.00 42.02 H new ATOM 0 HB VAL A 28 22.626 -6.289 23.150 1.00 24.24 H new ATOM 0 HG11 VAL A 28 24.194 -6.973 21.385 1.00 34.22 H new ATOM 0 HG12 VAL A 28 23.816 -8.309 22.499 1.00 34.22 H new ATOM 0 HG13 VAL A 28 23.065 -8.255 20.886 1.00 34.22 H new ATOM 0 HG21 VAL A 28 22.525 -5.205 20.934 1.00 1.00 H new ATOM 0 HG22 VAL A 28 21.300 -6.388 20.418 1.00 1.00 H new ATOM 0 HG23 VAL A 28 20.934 -5.242 21.729 1.00 1.00 H new ATOM 420 N LYS A 29 20.816 -6.465 24.790 1.00 24.10 N ATOM 421 CA LYS A 29 20.115 -5.715 25.824 1.00 44.35 C ATOM 422 C LYS A 29 20.751 -4.341 26.007 1.00 43.02 C ATOM 423 O LYS A 29 21.971 -4.199 25.909 1.00 12.55 O ATOM 424 CB LYS A 29 20.162 -6.502 27.143 1.00 13.02 C ATOM 425 CG LYS A 29 19.994 -5.644 28.393 1.00 22.53 C ATOM 426 CD LYS A 29 20.176 -6.452 29.669 1.00 24.23 C ATOM 427 CE LYS A 29 19.967 -5.589 30.904 1.00 1.41 C ATOM 428 NZ LYS A 29 20.884 -4.417 30.922 1.00 62.42 N1+ ATOM 0 H LYS A 29 21.818 -6.553 24.958 1.00 24.10 H new ATOM 0 HA LYS A 29 19.077 -5.574 25.524 1.00 44.35 H new ATOM 0 HB2 LYS A 29 19.378 -7.259 27.129 1.00 13.02 H new ATOM 0 HB3 LYS A 29 21.114 -7.029 27.204 1.00 13.02 H new ATOM 0 HG2 LYS A 29 20.718 -4.830 28.373 1.00 22.53 H new ATOM 0 HG3 LYS A 29 19.003 -5.190 28.390 1.00 22.53 H new ATOM 0 HD2 LYS A 29 19.471 -7.283 29.680 1.00 24.23 H new ATOM 0 HD3 LYS A 29 21.177 -6.883 29.689 1.00 24.23 H new ATOM 0 HE2 LYS A 29 18.934 -5.243 30.935 1.00 1.41 H new ATOM 0 HE3 LYS A 29 20.128 -6.190 31.799 1.00 1.41 H new ATOM 0 HZ1 LYS A 29 21.361 -4.363 31.845 1.00 62.42 H new ATOM 0 HZ2 LYS A 29 21.595 -4.521 30.170 1.00 62.42 H new ATOM 0 HZ3 LYS A 29 20.338 -3.546 30.764 1.00 62.42 H new ATOM 442 N LEU A 30 19.927 -3.333 26.278 1.00 2.53 N ATOM 443 CA LEU A 30 20.418 -1.997 26.548 1.00 41.03 C ATOM 444 C LEU A 30 19.891 -1.478 27.890 1.00 64.12 C ATOM 445 O LEU A 30 18.969 -2.077 28.504 1.00 54.30 O ATOM 446 CB LEU A 30 20.113 -1.020 25.385 1.00 11.12 C ATOM 447 CG LEU A 30 18.726 -1.098 24.710 1.00 54.41 C ATOM 448 CD1 LEU A 30 18.560 -2.382 23.897 1.00 21.32 C ATOM 449 CD2 LEU A 30 17.603 -0.936 25.727 1.00 54.12 C ATOM 0 H LEU A 30 18.912 -3.423 26.315 1.00 2.53 H new ATOM 0 HA LEU A 30 21.504 -2.055 26.624 1.00 41.03 H new ATOM 0 HB2 LEU A 30 20.244 -0.005 25.760 1.00 11.12 H new ATOM 0 HB3 LEU A 30 20.868 -1.175 24.614 1.00 11.12 H new ATOM 0 HG LEU A 30 18.662 -0.264 24.011 1.00 54.41 H new ATOM 0 HD11 LEU A 30 17.571 -2.397 23.439 1.00 21.32 H new ATOM 0 HD12 LEU A 30 19.321 -2.420 23.118 1.00 21.32 H new ATOM 0 HD13 LEU A 30 18.669 -3.245 24.554 1.00 21.32 H new ATOM 0 HD21 LEU A 30 16.641 -0.996 25.219 1.00 54.12 H new ATOM 0 HD22 LEU A 30 17.670 -1.729 26.472 1.00 54.12 H new ATOM 0 HD23 LEU A 30 17.694 0.033 26.219 1.00 54.12 H new ATOM 461 N SER A 31 20.501 -0.380 28.342 1.00 75.34 N ATOM 462 CA SER A 31 20.236 0.183 29.656 1.00 34.22 C ATOM 463 C SER A 31 20.392 1.708 29.626 1.00 62.41 C ATOM 464 O SER A 31 21.216 2.236 28.877 1.00 64.13 O ATOM 465 CB SER A 31 21.208 -0.411 30.687 1.00 52.23 C ATOM 466 OG SER A 31 21.319 -1.826 30.557 1.00 11.31 O ATOM 0 H SER A 31 21.193 0.140 27.802 1.00 75.34 H new ATOM 0 HA SER A 31 19.212 -0.064 29.938 1.00 34.22 H new ATOM 0 HB2 SER A 31 22.191 0.043 30.563 1.00 52.23 H new ATOM 0 HB3 SER A 31 20.867 -0.164 31.692 1.00 52.23 H new ATOM 0 HG SER A 31 22.256 -2.092 30.665 1.00 11.31 H new ATOM 472 N ALA A 32 19.604 2.402 30.442 1.00 52.21 N ATOM 473 CA ALA A 32 19.693 3.852 30.564 1.00 43.51 C ATOM 474 C ALA A 32 20.887 4.250 31.442 1.00 25.12 C ATOM 475 O ALA A 32 21.122 3.638 32.496 1.00 4.30 O ATOM 476 CB ALA A 32 18.393 4.406 31.138 1.00 22.44 C ATOM 0 H ALA A 32 18.890 1.977 31.034 1.00 52.21 H new ATOM 0 HA ALA A 32 19.848 4.278 29.573 1.00 43.51 H new ATOM 0 HB1 ALA A 32 18.467 5.490 31.226 1.00 22.44 H new ATOM 0 HB2 ALA A 32 17.565 4.151 30.476 1.00 22.44 H new ATOM 0 HB3 ALA A 32 18.216 3.973 32.123 1.00 22.44 H new ATOM 482 N PRO A 33 21.653 5.283 31.031 1.00 32.33 N ATOM 483 CA PRO A 33 22.857 5.716 31.752 1.00 35.40 C ATOM 484 C PRO A 33 22.536 6.192 33.172 1.00 50.42 C ATOM 485 O PRO A 33 21.841 7.194 33.368 1.00 70.53 O ATOM 486 CB PRO A 33 23.411 6.868 30.895 1.00 73.33 C ATOM 487 CG PRO A 33 22.252 7.333 30.076 1.00 10.15 C ATOM 488 CD PRO A 33 21.398 6.115 29.837 1.00 32.53 C ATOM 0 HA PRO A 33 23.570 4.902 31.881 1.00 35.40 H new ATOM 0 HB2 PRO A 33 23.801 7.672 31.519 1.00 73.33 H new ATOM 0 HB3 PRO A 33 24.231 6.530 30.262 1.00 73.33 H new ATOM 0 HG2 PRO A 33 21.690 8.107 30.599 1.00 10.15 H new ATOM 0 HG3 PRO A 33 22.588 7.765 29.133 1.00 10.15 H new ATOM 0 HD2 PRO A 33 20.343 6.375 29.745 1.00 32.53 H new ATOM 0 HD3 PRO A 33 21.680 5.599 28.919 1.00 32.53 H new ATOM 496 N ARG A 34 23.055 5.471 34.159 1.00 10.53 N ATOM 497 CA ARG A 34 22.776 5.764 35.561 1.00 33.33 C ATOM 498 C ARG A 34 23.675 6.892 36.078 1.00 40.12 C ATOM 499 O ARG A 34 24.407 6.732 37.060 1.00 0.24 O ATOM 500 CB ARG A 34 22.942 4.508 36.403 1.00 35.21 C ATOM 501 CG ARG A 34 22.454 4.673 37.831 1.00 34.41 C ATOM 502 CD ARG A 34 22.477 3.355 38.566 1.00 50.12 C ATOM 503 NE ARG A 34 22.220 3.511 39.999 1.00 3.50 N ATOM 504 CZ ARG A 34 23.170 3.740 40.909 1.00 2.33 C ATOM 505 NH1 ARG A 34 24.437 3.904 40.540 1.00 23.02 N1+ ATOM 506 NH2 ARG A 34 22.851 3.821 42.193 1.00 21.42 N ATOM 0 H ARG A 34 23.675 4.674 34.013 1.00 10.53 H new ATOM 0 HA ARG A 34 21.743 6.102 35.642 1.00 33.33 H new ATOM 0 HB2 ARG A 34 22.397 3.689 35.933 1.00 35.21 H new ATOM 0 HB3 ARG A 34 23.994 4.225 36.417 1.00 35.21 H new ATOM 0 HG2 ARG A 34 23.082 5.395 38.353 1.00 34.41 H new ATOM 0 HG3 ARG A 34 21.441 5.075 37.829 1.00 34.41 H new ATOM 0 HD2 ARG A 34 21.729 2.689 38.136 1.00 50.12 H new ATOM 0 HD3 ARG A 34 23.447 2.879 38.423 1.00 50.12 H new ATOM 0 HE ARG A 34 21.255 3.440 40.322 1.00 3.50 H new ATOM 0 HH11 ARG A 34 24.691 3.855 39.553 1.00 23.02 H new ATOM 0 HH12 ARG A 34 25.155 4.078 41.244 1.00 23.02 H new ATOM 0 HH21 ARG A 34 21.880 3.708 42.485 1.00 21.42 H new ATOM 0 HH22 ARG A 34 23.576 3.996 42.889 1.00 21.42 H new ATOM 520 N GLU A 35 23.633 8.022 35.385 1.00 72.31 N ATOM 521 CA GLU A 35 24.328 9.231 35.820 1.00 75.14 C ATOM 522 C GLU A 35 23.312 10.337 36.085 1.00 65.21 C ATOM 523 O GLU A 35 23.578 11.285 36.826 1.00 33.12 O ATOM 524 CB GLU A 35 25.327 9.691 34.748 1.00 20.34 C ATOM 525 CG GLU A 35 26.461 8.705 34.482 1.00 71.30 C ATOM 526 CD GLU A 35 27.343 8.483 35.698 1.00 31.03 C ATOM 527 OE1 GLU A 35 27.876 9.474 36.240 1.00 31.45 O ATOM 528 OE2 GLU A 35 27.528 7.316 36.107 1.00 43.03 O1- ATOM 0 H GLU A 35 23.120 8.129 34.510 1.00 72.31 H new ATOM 0 HA GLU A 35 24.876 9.011 36.736 1.00 75.14 H new ATOM 0 HB2 GLU A 35 24.788 9.866 33.817 1.00 20.34 H new ATOM 0 HB3 GLU A 35 25.755 10.646 35.053 1.00 20.34 H new ATOM 0 HG2 GLU A 35 26.040 7.751 34.165 1.00 71.30 H new ATOM 0 HG3 GLU A 35 27.072 9.074 33.658 1.00 71.30 H new ATOM 535 N LEU A 36 22.137 10.196 35.472 1.00 33.22 N ATOM 536 CA LEU A 36 21.089 11.211 35.552 1.00 32.24 C ATOM 537 C LEU A 36 19.805 10.610 36.123 1.00 55.25 C ATOM 538 O LEU A 36 18.745 11.238 36.093 1.00 40.24 O ATOM 539 CB LEU A 36 20.830 11.793 34.154 1.00 11.21 C ATOM 540 CG LEU A 36 22.081 12.290 33.407 1.00 24.22 C ATOM 541 CD1 LEU A 36 21.722 12.775 32.007 1.00 52.21 C ATOM 542 CD2 LEU A 36 22.785 13.394 34.195 1.00 63.44 C ATOM 0 H LEU A 36 21.887 9.382 34.911 1.00 33.22 H new ATOM 0 HA LEU A 36 21.417 12.009 36.218 1.00 32.24 H new ATOM 0 HB2 LEU A 36 20.342 11.031 33.546 1.00 11.21 H new ATOM 0 HB3 LEU A 36 20.129 12.623 34.248 1.00 11.21 H new ATOM 0 HG LEU A 36 22.769 11.450 33.310 1.00 24.22 H new ATOM 0 HD11 LEU A 36 22.623 13.121 31.500 1.00 52.21 H new ATOM 0 HD12 LEU A 36 21.279 11.956 31.441 1.00 52.21 H new ATOM 0 HD13 LEU A 36 21.008 13.595 32.078 1.00 52.21 H new ATOM 0 HD21 LEU A 36 23.665 13.728 33.646 1.00 63.44 H new ATOM 0 HD22 LEU A 36 22.104 14.233 34.333 1.00 63.44 H new ATOM 0 HD23 LEU A 36 23.089 13.009 35.168 1.00 63.44 H new ATOM 554 N GLY A 37 19.916 9.395 36.656 1.00 72.22 N ATOM 555 CA GLY A 37 18.761 8.697 37.199 1.00 12.23 C ATOM 556 C GLY A 37 18.306 7.559 36.305 1.00 31.23 C ATOM 557 O GLY A 37 17.215 7.607 35.740 1.00 41.24 O ATOM 0 H GLY A 37 20.793 8.878 36.722 1.00 72.22 H new ATOM 0 HA2 GLY A 37 19.006 8.305 38.186 1.00 12.23 H new ATOM 0 HA3 GLY A 37 17.941 9.403 37.331 1.00 12.23 H new ATOM 561 N GLY A 38 19.148 6.532 36.167 1.00 73.44 N ATOM 562 CA GLY A 38 18.804 5.384 35.353 1.00 31.42 C ATOM 563 C GLY A 38 19.091 4.084 36.077 1.00 22.15 C ATOM 564 O GLY A 38 18.844 3.968 37.279 1.00 21.21 O ATOM 0 H GLY A 38 20.066 6.480 36.609 1.00 73.44 H new ATOM 0 HA2 GLY A 38 17.748 5.428 35.087 1.00 31.42 H new ATOM 0 HA3 GLY A 38 19.369 5.415 34.421 1.00 31.42 H new ATOM 568 N ALA A 39 19.647 3.123 35.355 1.00 14.21 N ATOM 569 CA ALA A 39 19.924 1.795 35.907 1.00 43.43 C ATOM 570 C ALA A 39 21.399 1.425 35.763 1.00 63.22 C ATOM 571 O ALA A 39 21.934 0.664 36.570 1.00 3.43 O ATOM 572 CB ALA A 39 19.046 0.748 35.229 1.00 5.43 C ATOM 0 H ALA A 39 19.919 3.234 34.378 1.00 14.21 H new ATOM 0 HA ALA A 39 19.690 1.820 36.971 1.00 43.43 H new ATOM 0 HB1 ALA A 39 19.262 -0.235 35.648 1.00 5.43 H new ATOM 0 HB2 ALA A 39 17.996 0.991 35.395 1.00 5.43 H new ATOM 0 HB3 ALA A 39 19.252 0.739 34.159 1.00 5.43 H new ATOM 578 N GLY A 40 22.058 1.992 34.748 1.00 15.31 N ATOM 579 CA GLY A 40 23.461 1.680 34.478 1.00 42.15 C ATOM 580 C GLY A 40 23.741 0.189 34.465 1.00 45.53 C ATOM 581 O GLY A 40 24.760 -0.268 34.986 1.00 15.12 O ATOM 0 H GLY A 40 21.643 2.666 34.104 1.00 15.31 H new ATOM 0 HA2 GLY A 40 23.744 2.106 33.516 1.00 42.15 H new ATOM 0 HA3 GLY A 40 24.086 2.156 35.234 1.00 42.15 H new ATOM 585 N ALA A 41 22.822 -0.570 33.885 1.00 5.32 N ATOM 586 CA ALA A 41 22.945 -2.021 33.818 1.00 5.21 C ATOM 587 C ALA A 41 23.834 -2.439 32.655 1.00 44.21 C ATOM 588 O ALA A 41 24.258 -1.600 31.858 1.00 13.22 O ATOM 589 CB ALA A 41 21.571 -2.648 33.661 1.00 40.21 C ATOM 0 H ALA A 41 21.976 -0.202 33.450 1.00 5.32 H new ATOM 0 HA ALA A 41 23.402 -2.368 34.745 1.00 5.21 H new ATOM 0 HB1 ALA A 41 21.669 -3.732 33.611 1.00 40.21 H new ATOM 0 HB2 ALA A 41 20.949 -2.379 34.514 1.00 40.21 H new ATOM 0 HB3 ALA A 41 21.107 -2.284 32.744 1.00 40.21 H new ATOM 595 N GLU A 42 24.098 -3.738 32.553 1.00 32.32 N ATOM 596 CA GLU A 42 24.849 -4.280 31.428 1.00 71.23 C ATOM 597 C GLU A 42 24.056 -4.093 30.129 1.00 1.12 C ATOM 598 O GLU A 42 23.281 -4.956 29.711 1.00 55.43 O ATOM 599 CB GLU A 42 25.195 -5.761 31.671 1.00 42.31 C ATOM 600 CG GLU A 42 23.980 -6.657 31.887 1.00 52.14 C ATOM 601 CD GLU A 42 24.336 -8.004 32.492 1.00 31.41 C ATOM 602 OE1 GLU A 42 24.883 -8.865 31.774 1.00 24.22 O ATOM 603 OE2 GLU A 42 24.062 -8.205 33.695 1.00 54.53 O1- ATOM 0 H GLU A 42 23.802 -4.435 33.237 1.00 32.32 H new ATOM 0 HA GLU A 42 25.789 -3.736 31.332 1.00 71.23 H new ATOM 0 HB2 GLU A 42 25.762 -6.135 30.819 1.00 42.31 H new ATOM 0 HB3 GLU A 42 25.845 -5.833 32.543 1.00 42.31 H new ATOM 0 HG2 GLU A 42 23.271 -6.148 32.540 1.00 52.14 H new ATOM 0 HG3 GLU A 42 23.478 -6.815 30.933 1.00 52.14 H new ATOM 610 N GLY A 43 24.169 -2.904 29.564 1.00 3.30 N ATOM 611 CA GLY A 43 23.578 -2.619 28.272 1.00 20.41 C ATOM 612 C GLY A 43 24.138 -1.352 27.667 1.00 55.55 C ATOM 613 O GLY A 43 25.052 -0.746 28.227 1.00 25.21 O ATOM 0 H GLY A 43 24.667 -2.119 29.983 1.00 3.30 H new ATOM 0 HA2 GLY A 43 23.759 -3.455 27.597 1.00 20.41 H new ATOM 0 HA3 GLY A 43 22.497 -2.524 28.379 1.00 20.41 H new ATOM 617 N THR A 44 23.581 -0.949 26.537 1.00 1.14 N ATOM 618 CA THR A 44 24.041 0.232 25.821 1.00 0.00 C ATOM 619 C THR A 44 23.071 1.389 26.036 1.00 54.32 C ATOM 620 O THR A 44 21.893 1.167 26.315 1.00 53.24 O ATOM 621 CB THR A 44 24.166 -0.071 24.309 1.00 74.01 C ATOM 622 OG1 THR A 44 22.971 -0.712 23.840 1.00 60.01 O ATOM 623 CG2 THR A 44 25.372 -0.963 24.018 1.00 54.14 C ATOM 0 H THR A 44 22.800 -1.429 26.090 1.00 1.14 H new ATOM 0 HA THR A 44 25.021 0.511 26.208 1.00 0.00 H new ATOM 0 HB THR A 44 24.307 0.876 23.787 1.00 74.01 H new ATOM 0 HG1 THR A 44 23.055 -0.900 22.882 1.00 60.01 H new ATOM 0 HG21 THR A 44 25.431 -1.157 22.947 1.00 54.14 H new ATOM 0 HG22 THR A 44 26.283 -0.462 24.347 1.00 54.14 H new ATOM 0 HG23 THR A 44 25.264 -1.907 24.552 1.00 54.14 H new ATOM 631 N ASN A 45 23.563 2.616 25.915 1.00 72.33 N ATOM 632 CA ASN A 45 22.703 3.788 26.034 1.00 33.43 C ATOM 633 C ASN A 45 21.871 3.927 24.760 1.00 24.30 C ATOM 634 O ASN A 45 22.430 3.990 23.667 1.00 63.01 O ATOM 635 CB ASN A 45 23.536 5.061 26.261 1.00 4.20 C ATOM 636 CG ASN A 45 24.335 5.035 27.554 1.00 5.33 C ATOM 637 OD1 ASN A 45 23.929 4.429 28.541 1.00 50.31 O ATOM 638 ND2 ASN A 45 25.482 5.699 27.555 1.00 41.45 N ATOM 0 H ASN A 45 24.545 2.825 25.736 1.00 72.33 H new ATOM 0 HA ASN A 45 22.046 3.659 26.894 1.00 33.43 H new ATOM 0 HB2 ASN A 45 24.220 5.194 25.422 1.00 4.20 H new ATOM 0 HB3 ASN A 45 22.871 5.925 26.270 1.00 4.20 H new ATOM 0 HD21 ASN A 45 26.060 5.718 28.395 1.00 41.45 H new ATOM 0 HD22 ASN A 45 25.787 6.191 26.715 1.00 41.45 H new ATOM 645 N PRO A 46 20.527 3.964 24.873 1.00 63.04 N ATOM 646 CA PRO A 46 19.632 4.056 23.706 1.00 61.02 C ATOM 647 C PRO A 46 20.035 5.183 22.751 1.00 4.44 C ATOM 648 O PRO A 46 20.119 4.990 21.531 1.00 23.02 O ATOM 649 CB PRO A 46 18.262 4.335 24.336 1.00 23.35 C ATOM 650 CG PRO A 46 18.344 3.722 25.692 1.00 42.23 C ATOM 651 CD PRO A 46 19.770 3.916 26.144 1.00 1.14 C ATOM 0 HA PRO A 46 19.656 3.154 23.095 1.00 61.02 H new ATOM 0 HB2 PRO A 46 18.063 5.405 24.395 1.00 23.35 H new ATOM 0 HB3 PRO A 46 17.457 3.893 23.748 1.00 23.35 H new ATOM 0 HG2 PRO A 46 17.647 4.200 26.380 1.00 42.23 H new ATOM 0 HG3 PRO A 46 18.084 2.664 25.659 1.00 42.23 H new ATOM 0 HD2 PRO A 46 19.889 4.835 26.718 1.00 1.14 H new ATOM 0 HD3 PRO A 46 20.105 3.097 26.781 1.00 1.14 H new ATOM 659 N GLU A 47 20.317 6.347 23.325 1.00 25.31 N ATOM 660 CA GLU A 47 20.710 7.524 22.555 1.00 53.11 C ATOM 661 C GLU A 47 22.039 7.267 21.846 1.00 42.42 C ATOM 662 O GLU A 47 22.247 7.693 20.708 1.00 0.52 O ATOM 663 CB GLU A 47 20.824 8.753 23.472 1.00 52.55 C ATOM 664 CG GLU A 47 19.501 9.188 24.112 1.00 35.10 C ATOM 665 CD GLU A 47 18.839 8.091 24.939 1.00 32.04 C ATOM 666 OE1 GLU A 47 17.672 7.743 24.654 1.00 53.13 O ATOM 667 OE2 GLU A 47 19.500 7.549 25.855 1.00 62.13 O1- ATOM 0 H GLU A 47 20.280 6.502 24.332 1.00 25.31 H new ATOM 0 HA GLU A 47 19.944 7.723 21.806 1.00 53.11 H new ATOM 0 HB2 GLU A 47 21.542 8.536 24.263 1.00 52.55 H new ATOM 0 HB3 GLU A 47 21.226 9.586 22.895 1.00 52.55 H new ATOM 0 HG2 GLU A 47 19.681 10.054 24.749 1.00 35.10 H new ATOM 0 HG3 GLU A 47 18.814 9.506 23.328 1.00 35.10 H new ATOM 674 N GLN A 48 22.928 6.551 22.530 1.00 41.14 N ATOM 675 CA GLN A 48 24.211 6.166 21.970 1.00 71.11 C ATOM 676 C GLN A 48 24.016 5.150 20.850 1.00 34.04 C ATOM 677 O GLN A 48 24.771 5.132 19.879 1.00 32.22 O ATOM 678 CB GLN A 48 25.102 5.599 23.088 1.00 12.45 C ATOM 679 CG GLN A 48 26.300 4.789 22.608 1.00 72.35 C ATOM 680 CD GLN A 48 25.975 3.313 22.401 1.00 3.55 C ATOM 681 OE1 GLN A 48 25.170 2.736 23.128 1.00 43.42 O ATOM 682 NE2 GLN A 48 26.571 2.706 21.387 1.00 72.04 N ATOM 0 H GLN A 48 22.776 6.225 23.484 1.00 41.14 H new ATOM 0 HA GLN A 48 24.702 7.040 21.541 1.00 71.11 H new ATOM 0 HB2 GLN A 48 25.463 6.426 23.699 1.00 12.45 H new ATOM 0 HB3 GLN A 48 24.491 4.968 23.734 1.00 12.45 H new ATOM 0 HG2 GLN A 48 26.665 5.210 21.671 1.00 72.35 H new ATOM 0 HG3 GLN A 48 27.108 4.879 23.334 1.00 72.35 H new ATOM 0 HE21 GLN A 48 27.234 3.218 20.805 1.00 72.04 H new ATOM 0 HE22 GLN A 48 26.367 1.727 21.188 1.00 72.04 H new ATOM 691 N LEU A 49 23.000 4.307 20.995 1.00 51.33 N ATOM 692 CA LEU A 49 22.699 3.284 20.002 1.00 61.13 C ATOM 693 C LEU A 49 22.250 3.953 18.703 1.00 21.55 C ATOM 694 O LEU A 49 22.736 3.616 17.621 1.00 71.11 O ATOM 695 CB LEU A 49 21.620 2.324 20.546 1.00 4.20 C ATOM 696 CG LEU A 49 21.525 0.938 19.869 1.00 31.10 C ATOM 697 CD1 LEU A 49 20.958 1.036 18.455 1.00 0.52 C ATOM 698 CD2 LEU A 49 22.890 0.252 19.853 1.00 52.41 C ATOM 0 H LEU A 49 22.368 4.313 21.796 1.00 51.33 H new ATOM 0 HA LEU A 49 23.592 2.696 19.793 1.00 61.13 H new ATOM 0 HB2 LEU A 49 21.804 2.172 21.610 1.00 4.20 H new ATOM 0 HB3 LEU A 49 20.651 2.814 20.457 1.00 4.20 H new ATOM 0 HG LEU A 49 20.836 0.333 20.458 1.00 31.10 H new ATOM 0 HD11 LEU A 49 20.907 0.041 18.014 1.00 0.52 H new ATOM 0 HD12 LEU A 49 19.958 1.467 18.493 1.00 0.52 H new ATOM 0 HD13 LEU A 49 21.604 1.670 17.847 1.00 0.52 H new ATOM 0 HD21 LEU A 49 22.802 -0.722 19.372 1.00 52.41 H new ATOM 0 HD22 LEU A 49 23.600 0.867 19.300 1.00 52.41 H new ATOM 0 HD23 LEU A 49 23.244 0.121 20.876 1.00 52.41 H new ATOM 710 N PHE A 50 21.333 4.915 18.819 1.00 3.42 N ATOM 711 CA PHE A 50 20.873 5.681 17.659 1.00 25.51 C ATOM 712 C PHE A 50 22.027 6.477 17.045 1.00 64.45 C ATOM 713 O PHE A 50 22.212 6.470 15.830 1.00 15.22 O ATOM 714 CB PHE A 50 19.719 6.619 18.046 1.00 52.14 C ATOM 715 CG PHE A 50 19.377 7.648 16.985 1.00 40.34 C ATOM 716 CD1 PHE A 50 18.880 7.268 15.744 1.00 40.14 C ATOM 717 CD2 PHE A 50 19.556 8.999 17.238 1.00 31.01 C ATOM 718 CE1 PHE A 50 18.576 8.216 14.781 1.00 11.20 C ATOM 719 CE2 PHE A 50 19.252 9.949 16.281 1.00 34.34 C ATOM 720 CZ PHE A 50 18.764 9.558 15.050 1.00 61.21 C ATOM 0 H PHE A 50 20.895 5.182 19.701 1.00 3.42 H new ATOM 0 HA PHE A 50 20.505 4.976 16.913 1.00 25.51 H new ATOM 0 HB2 PHE A 50 18.833 6.020 18.256 1.00 52.14 H new ATOM 0 HB3 PHE A 50 19.979 7.137 18.969 1.00 52.14 H new ATOM 0 HD1 PHE A 50 18.729 6.221 15.528 1.00 40.14 H new ATOM 0 HD2 PHE A 50 19.939 9.314 18.197 1.00 31.01 H new ATOM 0 HE1 PHE A 50 18.192 7.906 13.820 1.00 11.20 H new ATOM 0 HE2 PHE A 50 19.396 10.997 16.496 1.00 34.34 H new ATOM 0 HZ PHE A 50 18.530 10.299 14.300 1.00 61.21 H new ATOM 730 N ALA A 51 22.797 7.160 17.891 1.00 33.43 N ATOM 731 CA ALA A 51 23.961 7.929 17.438 1.00 33.33 C ATOM 732 C ALA A 51 24.944 7.042 16.673 1.00 4.13 C ATOM 733 O ALA A 51 25.334 7.362 15.553 1.00 52.03 O ATOM 734 CB ALA A 51 24.653 8.583 18.630 1.00 51.41 C ATOM 0 H ALA A 51 22.637 7.198 18.898 1.00 33.43 H new ATOM 0 HA ALA A 51 23.612 8.707 16.759 1.00 33.33 H new ATOM 0 HB1 ALA A 51 25.516 9.151 18.283 1.00 51.41 H new ATOM 0 HB2 ALA A 51 23.956 9.253 19.133 1.00 51.41 H new ATOM 0 HB3 ALA A 51 24.983 7.813 19.327 1.00 51.41 H new ATOM 740 N ALA A 52 25.328 5.923 17.282 1.00 32.43 N ATOM 741 CA ALA A 52 26.279 4.993 16.675 1.00 41.10 C ATOM 742 C ALA A 52 25.725 4.422 15.374 1.00 30.53 C ATOM 743 O ALA A 52 26.422 4.369 14.356 1.00 13.40 O ATOM 744 CB ALA A 52 26.616 3.867 17.648 1.00 51.43 C ATOM 0 H ALA A 52 24.993 5.636 18.202 1.00 32.43 H new ATOM 0 HA ALA A 52 27.192 5.542 16.445 1.00 41.10 H new ATOM 0 HB1 ALA A 52 27.325 3.183 17.181 1.00 51.43 H new ATOM 0 HB2 ALA A 52 27.058 4.287 18.552 1.00 51.43 H new ATOM 0 HB3 ALA A 52 25.706 3.325 17.907 1.00 51.43 H new ATOM 750 N GLY A 53 24.466 4.000 15.420 1.00 32.23 N ATOM 751 CA GLY A 53 23.819 3.434 14.253 1.00 45.35 C ATOM 752 C GLY A 53 23.716 4.430 13.116 1.00 24.44 C ATOM 753 O GLY A 53 24.015 4.101 11.969 1.00 23.31 O ATOM 0 H GLY A 53 23.879 4.041 16.253 1.00 32.23 H new ATOM 0 HA2 GLY A 53 24.377 2.560 13.918 1.00 45.35 H new ATOM 0 HA3 GLY A 53 22.821 3.090 14.524 1.00 45.35 H new ATOM 757 N TYR A 54 23.310 5.655 13.444 1.00 20.42 N ATOM 758 CA TYR A 54 23.155 6.714 12.450 1.00 1.52 C ATOM 759 C TYR A 54 24.520 7.158 11.930 1.00 10.14 C ATOM 760 O TYR A 54 24.668 7.499 10.757 1.00 3.35 O ATOM 761 CB TYR A 54 22.382 7.907 13.043 1.00 4.31 C ATOM 762 CG TYR A 54 22.156 9.063 12.076 1.00 71.40 C ATOM 763 CD1 TYR A 54 22.024 8.845 10.707 1.00 61.33 C ATOM 764 CD2 TYR A 54 22.069 10.374 12.536 1.00 12.15 C ATOM 765 CE1 TYR A 54 21.820 9.891 9.830 1.00 65.13 C ATOM 766 CE2 TYR A 54 21.861 11.427 11.662 1.00 14.31 C ATOM 767 CZ TYR A 54 21.739 11.179 10.310 1.00 61.32 C ATOM 768 OH TYR A 54 21.533 12.219 9.428 1.00 14.13 O ATOM 0 H TYR A 54 23.081 5.939 14.397 1.00 20.42 H new ATOM 0 HA TYR A 54 22.579 6.321 11.612 1.00 1.52 H new ATOM 0 HB2 TYR A 54 21.414 7.554 13.399 1.00 4.31 H new ATOM 0 HB3 TYR A 54 22.925 8.279 13.912 1.00 4.31 H new ATOM 0 HD1 TYR A 54 22.082 7.837 10.324 1.00 61.33 H new ATOM 0 HD2 TYR A 54 22.165 10.573 13.593 1.00 12.15 H new ATOM 0 HE1 TYR A 54 21.724 9.700 8.771 1.00 65.13 H new ATOM 0 HE2 TYR A 54 21.795 12.438 12.036 1.00 14.31 H new ATOM 0 HH TYR A 54 22.286 12.844 9.477 1.00 14.13 H new ATOM 778 N SER A 55 25.516 7.140 12.804 1.00 11.10 N ATOM 779 CA SER A 55 26.873 7.503 12.421 1.00 22.53 C ATOM 780 C SER A 55 27.383 6.526 11.360 1.00 50.31 C ATOM 781 O SER A 55 27.846 6.934 10.298 1.00 23.31 O ATOM 782 CB SER A 55 27.793 7.493 13.651 1.00 0.44 C ATOM 783 OG SER A 55 29.029 8.137 13.388 1.00 35.10 O ATOM 0 H SER A 55 25.410 6.878 13.784 1.00 11.10 H new ATOM 0 HA SER A 55 26.873 8.510 12.004 1.00 22.53 H new ATOM 0 HB2 SER A 55 27.294 7.990 14.483 1.00 0.44 H new ATOM 0 HB3 SER A 55 27.977 6.464 13.959 1.00 0.44 H new ATOM 0 HG SER A 55 29.670 7.484 13.038 1.00 35.10 H new ATOM 789 N ALA A 56 27.249 5.234 11.648 1.00 25.24 N ATOM 790 CA ALA A 56 27.719 4.186 10.748 1.00 63.14 C ATOM 791 C ALA A 56 26.857 4.108 9.489 1.00 34.41 C ATOM 792 O ALA A 56 27.371 3.925 8.385 1.00 72.41 O ATOM 793 CB ALA A 56 27.736 2.844 11.468 1.00 2.41 C ATOM 0 H ALA A 56 26.816 4.887 12.504 1.00 25.24 H new ATOM 0 HA ALA A 56 28.735 4.434 10.440 1.00 63.14 H new ATOM 0 HB1 ALA A 56 28.088 2.070 10.786 1.00 2.41 H new ATOM 0 HB2 ALA A 56 28.403 2.901 12.328 1.00 2.41 H new ATOM 0 HB3 ALA A 56 26.729 2.599 11.805 1.00 2.41 H new ATOM 799 N CYS A 57 25.546 4.252 9.659 1.00 43.11 N ATOM 800 CA CYS A 57 24.624 4.213 8.530 1.00 65.50 C ATOM 801 C CYS A 57 24.904 5.385 7.598 1.00 1.30 C ATOM 802 O CYS A 57 24.765 5.265 6.386 1.00 31.43 O ATOM 803 CB CYS A 57 23.161 4.235 8.985 1.00 74.40 C ATOM 804 SG CYS A 57 22.591 5.832 9.592 1.00 3.24 S ATOM 0 H CYS A 57 25.100 4.396 10.565 1.00 43.11 H new ATOM 0 HA CYS A 57 24.784 3.275 7.998 1.00 65.50 H new ATOM 0 HB2 CYS A 57 22.530 3.932 8.150 1.00 74.40 H new ATOM 0 HB3 CYS A 57 23.027 3.493 9.772 1.00 74.40 H new ATOM 0 HG CYS A 57 23.615 6.595 9.834 1.00 3.24 H new ATOM 810 N PHE A 58 25.270 6.527 8.181 1.00 12.51 N ATOM 811 CA PHE A 58 25.604 7.724 7.411 1.00 55.51 C ATOM 812 C PHE A 58 26.660 7.399 6.349 1.00 60.31 C ATOM 813 O PHE A 58 26.631 7.950 5.245 1.00 54.45 O ATOM 814 CB PHE A 58 26.106 8.837 8.345 1.00 64.12 C ATOM 815 CG PHE A 58 26.037 10.218 7.742 1.00 32.51 C ATOM 816 CD1 PHE A 58 27.165 10.820 7.198 1.00 53.31 C ATOM 817 CD2 PHE A 58 24.837 10.916 7.723 1.00 40.52 C ATOM 818 CE1 PHE A 58 27.093 12.088 6.649 1.00 60.42 C ATOM 819 CE2 PHE A 58 24.761 12.182 7.177 1.00 51.42 C ATOM 820 CZ PHE A 58 25.890 12.770 6.639 1.00 5.31 C ATOM 0 H PHE A 58 25.343 6.648 9.191 1.00 12.51 H new ATOM 0 HA PHE A 58 24.704 8.075 6.906 1.00 55.51 H new ATOM 0 HB2 PHE A 58 25.517 8.822 9.262 1.00 64.12 H new ATOM 0 HB3 PHE A 58 27.138 8.625 8.625 1.00 64.12 H new ATOM 0 HD1 PHE A 58 28.108 10.293 7.204 1.00 53.31 H new ATOM 0 HD2 PHE A 58 23.951 10.462 8.141 1.00 40.52 H new ATOM 0 HE1 PHE A 58 27.976 12.545 6.228 1.00 60.42 H new ATOM 0 HE2 PHE A 58 23.820 12.712 7.170 1.00 51.42 H new ATOM 0 HZ PHE A 58 25.833 13.760 6.212 1.00 5.31 H new ATOM 830 N LEU A 59 27.580 6.487 6.680 1.00 64.51 N ATOM 831 CA LEU A 59 28.570 6.011 5.711 1.00 63.33 C ATOM 832 C LEU A 59 27.869 5.265 4.579 1.00 14.15 C ATOM 833 O LEU A 59 28.197 5.446 3.409 1.00 3.51 O ATOM 834 CB LEU A 59 29.623 5.092 6.367 1.00 74.12 C ATOM 835 CG LEU A 59 30.688 5.786 7.242 1.00 31.41 C ATOM 836 CD1 LEU A 59 31.368 6.920 6.477 1.00 61.22 C ATOM 837 CD2 LEU A 59 30.089 6.293 8.548 1.00 2.33 C ATOM 0 H LEU A 59 27.659 6.066 7.606 1.00 64.51 H new ATOM 0 HA LEU A 59 29.091 6.883 5.315 1.00 63.33 H new ATOM 0 HB2 LEU A 59 29.101 4.358 6.981 1.00 74.12 H new ATOM 0 HB3 LEU A 59 30.135 4.541 5.578 1.00 74.12 H new ATOM 0 HG LEU A 59 31.446 5.043 7.492 1.00 31.41 H new ATOM 0 HD11 LEU A 59 32.114 7.393 7.115 1.00 61.22 H new ATOM 0 HD12 LEU A 59 31.853 6.519 5.587 1.00 61.22 H new ATOM 0 HD13 LEU A 59 30.622 7.658 6.182 1.00 61.22 H new ATOM 0 HD21 LEU A 59 30.865 6.776 9.141 1.00 2.33 H new ATOM 0 HD22 LEU A 59 29.298 7.011 8.331 1.00 2.33 H new ATOM 0 HD23 LEU A 59 29.674 5.455 9.108 1.00 2.33 H new ATOM 849 N SER A 60 26.890 4.439 4.942 1.00 34.05 N ATOM 850 CA SER A 60 26.107 3.676 3.969 1.00 74.40 C ATOM 851 C SER A 60 25.264 4.624 3.110 1.00 42.34 C ATOM 852 O SER A 60 25.070 4.400 1.914 1.00 41.15 O ATOM 853 CB SER A 60 25.207 2.663 4.693 1.00 52.34 C ATOM 854 OG SER A 60 24.527 1.822 3.776 1.00 74.20 O ATOM 0 H SER A 60 26.617 4.279 5.912 1.00 34.05 H new ATOM 0 HA SER A 60 26.789 3.131 3.316 1.00 74.40 H new ATOM 0 HB2 SER A 60 25.811 2.055 5.367 1.00 52.34 H new ATOM 0 HB3 SER A 60 24.481 3.195 5.308 1.00 52.34 H new ATOM 0 HG SER A 60 24.955 0.941 3.761 1.00 74.20 H new ATOM 860 N ALA A 61 24.783 5.697 3.729 1.00 5.22 N ATOM 861 CA ALA A 61 24.007 6.708 3.029 1.00 61.10 C ATOM 862 C ALA A 61 24.891 7.444 2.035 1.00 23.52 C ATOM 863 O ALA A 61 24.489 7.691 0.909 1.00 64.15 O ATOM 864 CB ALA A 61 23.373 7.682 4.015 1.00 23.00 C ATOM 0 H ALA A 61 24.920 5.887 4.722 1.00 5.22 H new ATOM 0 HA ALA A 61 23.202 6.216 2.483 1.00 61.10 H new ATOM 0 HB1 ALA A 61 22.797 8.429 3.469 1.00 23.00 H new ATOM 0 HB2 ALA A 61 22.713 7.138 4.690 1.00 23.00 H new ATOM 0 HB3 ALA A 61 24.155 8.176 4.592 1.00 23.00 H new ATOM 870 N MET A 62 26.104 7.789 2.458 1.00 1.42 N ATOM 871 CA MET A 62 27.080 8.406 1.561 1.00 22.23 C ATOM 872 C MET A 62 27.479 7.421 0.468 1.00 52.25 C ATOM 873 O MET A 62 27.694 7.800 -0.686 1.00 52.11 O ATOM 874 CB MET A 62 28.321 8.867 2.343 1.00 12.31 C ATOM 875 CG MET A 62 28.115 10.146 3.154 1.00 13.45 C ATOM 876 SD MET A 62 28.584 11.647 2.253 1.00 13.34 S ATOM 877 CE MET A 62 27.476 11.621 0.842 1.00 61.32 C ATOM 0 H MET A 62 26.435 7.653 3.413 1.00 1.42 H new ATOM 0 HA MET A 62 26.623 9.281 1.099 1.00 22.23 H new ATOM 0 HB2 MET A 62 28.628 8.068 3.018 1.00 12.31 H new ATOM 0 HB3 MET A 62 29.140 9.024 1.641 1.00 12.31 H new ATOM 0 HG2 MET A 62 27.067 10.218 3.446 1.00 13.45 H new ATOM 0 HG3 MET A 62 28.699 10.084 4.072 1.00 13.45 H new ATOM 0 HE1 MET A 62 27.500 12.590 0.343 1.00 61.32 H new ATOM 0 HE2 MET A 62 27.793 10.846 0.145 1.00 61.32 H new ATOM 0 HE3 MET A 62 26.461 11.412 1.180 1.00 61.32 H new ATOM 887 N LYS A 63 27.559 6.154 0.855 1.00 50.31 N ATOM 888 CA LYS A 63 27.876 5.058 -0.052 1.00 32.21 C ATOM 889 C LYS A 63 26.883 5.039 -1.215 1.00 55.33 C ATOM 890 O LYS A 63 27.271 4.995 -2.385 1.00 31.21 O ATOM 891 CB LYS A 63 27.803 3.736 0.731 1.00 32.54 C ATOM 892 CG LYS A 63 28.387 2.513 0.028 1.00 62.32 C ATOM 893 CD LYS A 63 29.917 2.527 0.025 1.00 52.53 C ATOM 894 CE LYS A 63 30.492 1.127 0.234 1.00 52.13 C ATOM 895 NZ LYS A 63 30.179 0.601 1.595 1.00 51.23 N1+ ATOM 0 H LYS A 63 27.404 5.855 1.818 1.00 50.31 H new ATOM 0 HA LYS A 63 28.879 5.189 -0.459 1.00 32.21 H new ATOM 0 HB2 LYS A 63 28.323 3.869 1.680 1.00 32.54 H new ATOM 0 HB3 LYS A 63 26.758 3.532 0.966 1.00 32.54 H new ATOM 0 HG2 LYS A 63 28.034 1.608 0.523 1.00 62.32 H new ATOM 0 HG3 LYS A 63 28.023 2.477 -0.999 1.00 62.32 H new ATOM 0 HD2 LYS A 63 30.276 2.931 -0.922 1.00 52.53 H new ATOM 0 HD3 LYS A 63 30.277 3.190 0.812 1.00 52.53 H new ATOM 0 HE2 LYS A 63 30.088 0.451 -0.520 1.00 52.13 H new ATOM 0 HE3 LYS A 63 31.573 1.152 0.093 1.00 52.13 H new ATOM 0 HZ1 LYS A 63 30.783 -0.221 1.797 1.00 51.23 H new ATOM 0 HZ2 LYS A 63 30.355 1.342 2.303 1.00 51.23 H new ATOM 0 HZ3 LYS A 63 29.180 0.314 1.635 1.00 51.23 H new ATOM 909 N PHE A 64 25.597 5.089 -0.871 1.00 54.13 N ATOM 910 CA PHE A 64 24.521 5.048 -1.858 1.00 15.41 C ATOM 911 C PHE A 64 24.369 6.388 -2.587 1.00 43.31 C ATOM 912 O PHE A 64 24.287 6.429 -3.818 1.00 31.42 O ATOM 913 CB PHE A 64 23.197 4.668 -1.180 1.00 54.23 C ATOM 914 CG PHE A 64 22.045 4.587 -2.149 1.00 22.52 C ATOM 915 CD1 PHE A 64 22.031 3.626 -3.149 1.00 70.34 C ATOM 916 CD2 PHE A 64 20.987 5.480 -2.069 1.00 44.41 C ATOM 917 CE1 PHE A 64 20.988 3.558 -4.049 1.00 70.35 C ATOM 918 CE2 PHE A 64 19.942 5.412 -2.966 1.00 31.33 C ATOM 919 CZ PHE A 64 19.944 4.452 -3.956 1.00 62.32 C ATOM 0 H PHE A 64 25.274 5.159 0.094 1.00 54.13 H new ATOM 0 HA PHE A 64 24.781 4.292 -2.599 1.00 15.41 H new ATOM 0 HB2 PHE A 64 23.313 3.706 -0.680 1.00 54.23 H new ATOM 0 HB3 PHE A 64 22.966 5.402 -0.408 1.00 54.23 H new ATOM 0 HD1 PHE A 64 22.847 2.922 -3.224 1.00 70.34 H new ATOM 0 HD2 PHE A 64 20.982 6.235 -1.297 1.00 44.41 H new ATOM 0 HE1 PHE A 64 20.990 2.806 -4.824 1.00 70.35 H new ATOM 0 HE2 PHE A 64 19.122 6.111 -2.893 1.00 31.33 H new ATOM 0 HZ PHE A 64 19.126 4.401 -4.659 1.00 62.32 H new ATOM 929 N VAL A 65 24.326 7.479 -1.821 1.00 22.12 N ATOM 930 CA VAL A 65 24.141 8.819 -2.384 1.00 1.13 C ATOM 931 C VAL A 65 25.200 9.116 -3.440 1.00 2.04 C ATOM 932 O VAL A 65 24.901 9.693 -4.485 1.00 1.42 O ATOM 933 CB VAL A 65 24.174 9.922 -1.291 1.00 51.41 C ATOM 934 CG1 VAL A 65 24.291 11.311 -1.917 1.00 35.23 C ATOM 935 CG2 VAL A 65 22.928 9.841 -0.402 1.00 41.32 C ATOM 0 H VAL A 65 24.417 7.461 -0.805 1.00 22.12 H new ATOM 0 HA VAL A 65 23.154 8.830 -2.847 1.00 1.13 H new ATOM 0 HB VAL A 65 25.054 9.752 -0.671 1.00 51.41 H new ATOM 0 HG11 VAL A 65 24.312 12.064 -1.130 1.00 35.23 H new ATOM 0 HG12 VAL A 65 25.209 11.371 -2.501 1.00 35.23 H new ATOM 0 HG13 VAL A 65 23.435 11.490 -2.568 1.00 35.23 H new ATOM 0 HG21 VAL A 65 22.971 10.622 0.357 1.00 41.32 H new ATOM 0 HG22 VAL A 65 22.036 9.977 -1.013 1.00 41.32 H new ATOM 0 HG23 VAL A 65 22.890 8.866 0.083 1.00 41.32 H new ATOM 945 N ALA A 66 26.434 8.705 -3.171 1.00 10.53 N ATOM 946 CA ALA A 66 27.521 8.871 -4.127 1.00 34.24 C ATOM 947 C ALA A 66 27.144 8.250 -5.474 1.00 52.01 C ATOM 948 O ALA A 66 27.484 8.775 -6.536 1.00 55.45 O ATOM 949 CB ALA A 66 28.797 8.247 -3.574 1.00 2.15 C ATOM 0 H ALA A 66 26.706 8.254 -2.298 1.00 10.53 H new ATOM 0 HA ALA A 66 27.699 9.935 -4.286 1.00 34.24 H new ATOM 0 HB1 ALA A 66 29.606 8.374 -4.294 1.00 2.15 H new ATOM 0 HB2 ALA A 66 29.064 8.736 -2.637 1.00 2.15 H new ATOM 0 HB3 ALA A 66 28.634 7.184 -3.395 1.00 2.15 H new ATOM 955 N GLY A 67 26.378 7.165 -5.411 1.00 41.30 N ATOM 956 CA GLY A 67 25.979 6.440 -6.606 1.00 41.44 C ATOM 957 C GLY A 67 24.952 7.195 -7.428 1.00 65.01 C ATOM 958 O GLY A 67 24.934 7.100 -8.658 1.00 24.21 O ATOM 0 H GLY A 67 26.022 6.770 -4.541 1.00 41.30 H new ATOM 0 HA2 GLY A 67 26.859 6.245 -7.220 1.00 41.44 H new ATOM 0 HA3 GLY A 67 25.569 5.471 -6.320 1.00 41.44 H new ATOM 962 N GLN A 68 24.100 7.968 -6.756 1.00 2.22 N ATOM 963 CA GLN A 68 23.080 8.758 -7.439 1.00 3.22 C ATOM 964 C GLN A 68 23.631 10.149 -7.708 1.00 13.50 C ATOM 965 O GLN A 68 23.055 10.936 -8.456 1.00 73.33 O ATOM 966 CB GLN A 68 21.793 8.832 -6.605 1.00 70.02 C ATOM 967 CG GLN A 68 22.011 9.329 -5.182 1.00 23.14 C ATOM 968 CD GLN A 68 20.717 9.574 -4.427 1.00 11.52 C ATOM 969 OE1 GLN A 68 20.185 8.681 -3.772 1.00 54.51 O ATOM 970 NE2 GLN A 68 20.211 10.791 -4.514 1.00 55.13 N ATOM 0 H GLN A 68 24.097 8.063 -5.740 1.00 2.22 H new ATOM 0 HA GLN A 68 22.827 8.279 -8.385 1.00 3.22 H new ATOM 0 HB2 GLN A 68 21.084 9.491 -7.106 1.00 70.02 H new ATOM 0 HB3 GLN A 68 21.337 7.843 -6.569 1.00 70.02 H new ATOM 0 HG2 GLN A 68 22.609 8.599 -4.637 1.00 23.14 H new ATOM 0 HG3 GLN A 68 22.587 10.254 -5.212 1.00 23.14 H new ATOM 0 HE21 GLN A 68 20.686 11.502 -5.069 1.00 55.13 H new ATOM 0 HE22 GLN A 68 19.345 11.019 -4.026 1.00 55.13 H new ATOM 979 N ASN A 69 24.762 10.432 -7.077 1.00 45.10 N ATOM 980 CA ASN A 69 25.490 11.676 -7.286 1.00 61.12 C ATOM 981 C ASN A 69 26.579 11.489 -8.340 1.00 41.24 C ATOM 982 O ASN A 69 27.243 12.450 -8.724 1.00 42.44 O ATOM 983 CB ASN A 69 26.102 12.163 -5.962 1.00 43.31 C ATOM 984 CG ASN A 69 25.125 12.946 -5.089 1.00 21.20 C ATOM 985 OD1 ASN A 69 25.521 13.866 -4.374 1.00 73.01 O ATOM 986 ND2 ASN A 69 23.850 12.581 -5.120 1.00 73.35 N ATOM 0 H ASN A 69 25.202 9.804 -6.404 1.00 45.10 H new ATOM 0 HA ASN A 69 24.791 12.431 -7.646 1.00 61.12 H new ATOM 0 HB2 ASN A 69 26.467 11.302 -5.402 1.00 43.31 H new ATOM 0 HB3 ASN A 69 26.966 12.791 -6.180 1.00 43.31 H new ATOM 0 HD21 ASN A 69 23.166 13.067 -4.540 1.00 73.35 H new ATOM 0 HD22 ASN A 69 23.554 11.814 -5.724 1.00 73.35 H new ATOM 993 N LYS A 70 26.752 10.241 -8.797 1.00 63.25 N ATOM 994 CA LYS A 70 27.728 9.905 -9.840 1.00 32.31 C ATOM 995 C LYS A 70 29.137 10.291 -9.419 1.00 12.34 C ATOM 996 O LYS A 70 30.003 10.575 -10.247 1.00 70.50 O ATOM 997 CB LYS A 70 27.332 10.557 -11.173 1.00 4.35 C ATOM 998 CG LYS A 70 26.323 9.731 -11.966 1.00 13.20 C ATOM 999 CD LYS A 70 25.206 9.187 -11.081 1.00 32.43 C ATOM 1000 CE LYS A 70 24.160 8.428 -11.888 1.00 4.32 C ATOM 1001 NZ LYS A 70 23.075 7.893 -11.026 1.00 52.12 N1+ ATOM 0 H LYS A 70 26.221 9.440 -8.455 1.00 63.25 H new ATOM 0 HA LYS A 70 27.723 8.824 -9.983 1.00 32.31 H new ATOM 0 HB2 LYS A 70 26.912 11.543 -10.978 1.00 4.35 H new ATOM 0 HB3 LYS A 70 28.226 10.706 -11.778 1.00 4.35 H new ATOM 0 HG2 LYS A 70 25.892 10.346 -12.756 1.00 13.20 H new ATOM 0 HG3 LYS A 70 26.836 8.902 -12.452 1.00 13.20 H new ATOM 0 HD2 LYS A 70 25.631 8.526 -10.325 1.00 32.43 H new ATOM 0 HD3 LYS A 70 24.728 10.011 -10.552 1.00 32.43 H new ATOM 0 HE2 LYS A 70 23.732 9.090 -12.641 1.00 4.32 H new ATOM 0 HE3 LYS A 70 24.639 7.606 -12.421 1.00 4.32 H new ATOM 0 HZ1 LYS A 70 22.499 7.219 -11.570 1.00 52.12 H new ATOM 0 HZ2 LYS A 70 23.491 7.409 -10.205 1.00 52.12 H new ATOM 0 HZ3 LYS A 70 22.474 8.676 -10.698 1.00 52.12 H new ATOM 1015 N GLN A 71 29.354 10.257 -8.117 1.00 41.25 N ATOM 1016 CA GLN A 71 30.661 10.508 -7.533 1.00 41.44 C ATOM 1017 C GLN A 71 31.064 9.325 -6.660 1.00 11.15 C ATOM 1018 O GLN A 71 30.214 8.543 -6.239 1.00 3.32 O ATOM 1019 CB GLN A 71 30.651 11.800 -6.711 1.00 65.11 C ATOM 1020 CG GLN A 71 29.665 11.777 -5.555 1.00 11.32 C ATOM 1021 CD GLN A 71 30.161 12.547 -4.347 1.00 14.24 C ATOM 1022 OE1 GLN A 71 30.812 13.583 -4.469 1.00 4.02 O ATOM 1023 NE2 GLN A 71 29.920 11.991 -3.179 1.00 60.02 N ATOM 0 H GLN A 71 28.627 10.054 -7.431 1.00 41.25 H new ATOM 0 HA GLN A 71 31.389 10.627 -8.336 1.00 41.44 H new ATOM 0 HB2 GLN A 71 31.652 11.980 -6.320 1.00 65.11 H new ATOM 0 HB3 GLN A 71 30.410 12.636 -7.367 1.00 65.11 H new ATOM 0 HG2 GLN A 71 28.715 12.199 -5.885 1.00 11.32 H new ATOM 0 HG3 GLN A 71 29.472 10.743 -5.268 1.00 11.32 H new ATOM 0 HE21 GLN A 71 29.375 11.131 -3.127 1.00 60.02 H new ATOM 0 HE22 GLN A 71 30.279 12.420 -2.326 1.00 60.02 H new ATOM 1032 N THR A 72 32.355 9.184 -6.404 1.00 0.13 N ATOM 1033 CA THR A 72 32.853 8.119 -5.543 1.00 33.54 C ATOM 1034 C THR A 72 33.702 8.698 -4.414 1.00 64.51 C ATOM 1035 O THR A 72 34.616 9.493 -4.651 1.00 2.32 O ATOM 1036 CB THR A 72 33.672 7.078 -6.348 1.00 55.21 C ATOM 1037 OG1 THR A 72 34.511 7.746 -7.302 1.00 1.42 O ATOM 1038 CG2 THR A 72 32.757 6.091 -7.071 1.00 71.13 C ATOM 0 H THR A 72 33.080 9.795 -6.781 1.00 0.13 H new ATOM 0 HA THR A 72 31.991 7.610 -5.113 1.00 33.54 H new ATOM 0 HB THR A 72 34.289 6.520 -5.644 1.00 55.21 H new ATOM 0 HG1 THR A 72 35.027 7.082 -7.806 1.00 1.42 H new ATOM 0 HG21 THR A 72 33.362 5.374 -7.626 1.00 71.13 H new ATOM 0 HG22 THR A 72 32.145 5.561 -6.341 1.00 71.13 H new ATOM 0 HG23 THR A 72 32.111 6.633 -7.762 1.00 71.13 H new ATOM 1046 N LEU A 73 33.374 8.314 -3.184 1.00 24.22 N ATOM 1047 CA LEU A 73 34.096 8.781 -2.003 1.00 2.33 C ATOM 1048 C LEU A 73 34.923 7.645 -1.396 1.00 44.11 C ATOM 1049 O LEU A 73 34.517 6.482 -1.455 1.00 52.40 O ATOM 1050 CB LEU A 73 33.123 9.386 -0.972 1.00 54.54 C ATOM 1051 CG LEU A 73 31.673 8.918 -1.101 1.00 53.14 C ATOM 1052 CD1 LEU A 73 31.506 7.476 -0.623 1.00 63.13 C ATOM 1053 CD2 LEU A 73 30.726 9.856 -0.356 1.00 44.41 C ATOM 0 H LEU A 73 32.606 7.675 -2.978 1.00 24.22 H new ATOM 0 HA LEU A 73 34.785 9.569 -2.306 1.00 2.33 H new ATOM 0 HB2 LEU A 73 33.480 9.143 0.029 1.00 54.54 H new ATOM 0 HB3 LEU A 73 33.148 10.472 -1.064 1.00 54.54 H new ATOM 0 HG LEU A 73 31.411 8.946 -2.159 1.00 53.14 H new ATOM 0 HD11 LEU A 73 30.463 7.176 -0.729 1.00 63.13 H new ATOM 0 HD12 LEU A 73 32.135 6.819 -1.223 1.00 63.13 H new ATOM 0 HD13 LEU A 73 31.800 7.403 0.424 1.00 63.13 H new ATOM 0 HD21 LEU A 73 29.702 9.500 -0.464 1.00 44.41 H new ATOM 0 HD22 LEU A 73 30.993 9.878 0.701 1.00 44.41 H new ATOM 0 HD23 LEU A 73 30.807 10.860 -0.772 1.00 44.41 H new ATOM 1065 N PRO A 74 36.107 7.965 -0.833 1.00 14.33 N ATOM 1066 CA PRO A 74 36.997 6.962 -0.228 1.00 71.54 C ATOM 1067 C PRO A 74 36.312 6.167 0.883 1.00 22.35 C ATOM 1068 O PRO A 74 35.712 6.747 1.789 1.00 71.04 O ATOM 1069 CB PRO A 74 38.148 7.802 0.350 1.00 0.31 C ATOM 1070 CG PRO A 74 38.125 9.070 -0.436 1.00 75.32 C ATOM 1071 CD PRO A 74 36.677 9.327 -0.748 1.00 21.31 C ATOM 0 HA PRO A 74 37.318 6.217 -0.956 1.00 71.54 H new ATOM 0 HB2 PRO A 74 38.003 7.993 1.413 1.00 0.31 H new ATOM 0 HB3 PRO A 74 39.104 7.289 0.245 1.00 0.31 H new ATOM 0 HG2 PRO A 74 38.555 9.893 0.135 1.00 75.32 H new ATOM 0 HG3 PRO A 74 38.712 8.975 -1.350 1.00 75.32 H new ATOM 0 HD2 PRO A 74 36.195 9.918 0.031 1.00 21.31 H new ATOM 0 HD3 PRO A 74 36.557 9.874 -1.683 1.00 21.31 H new ATOM 1079 N ALA A 75 36.419 4.842 0.819 1.00 74.43 N ATOM 1080 CA ALA A 75 35.847 3.961 1.839 1.00 72.21 C ATOM 1081 C ALA A 75 36.712 3.950 3.096 1.00 34.41 C ATOM 1082 O ALA A 75 36.385 3.307 4.093 1.00 42.34 O ATOM 1083 CB ALA A 75 35.679 2.549 1.290 1.00 2.05 C ATOM 0 H ALA A 75 36.900 4.350 0.066 1.00 74.43 H new ATOM 0 HA ALA A 75 34.864 4.346 2.109 1.00 72.21 H new ATOM 0 HB1 ALA A 75 35.253 1.907 2.061 1.00 2.05 H new ATOM 0 HB2 ALA A 75 35.013 2.571 0.427 1.00 2.05 H new ATOM 0 HB3 ALA A 75 36.651 2.158 0.989 1.00 2.05 H new ATOM 1089 N ASP A 76 37.805 4.692 3.036 1.00 35.21 N ATOM 1090 CA ASP A 76 38.750 4.803 4.144 1.00 24.42 C ATOM 1091 C ASP A 76 38.301 5.893 5.121 1.00 33.35 C ATOM 1092 O ASP A 76 39.073 6.370 5.952 1.00 61.01 O ATOM 1093 CB ASP A 76 40.133 5.121 3.565 1.00 72.44 C ATOM 1094 CG ASP A 76 41.249 5.047 4.596 1.00 23.12 C ATOM 1095 OD1 ASP A 76 41.573 3.927 5.047 1.00 55.31 O ATOM 1096 OD2 ASP A 76 41.820 6.102 4.943 1.00 42.23 O1- ATOM 0 H ASP A 76 38.067 5.238 2.215 1.00 35.21 H new ATOM 0 HA ASP A 76 38.792 3.865 4.698 1.00 24.42 H new ATOM 0 HB2 ASP A 76 40.349 4.424 2.755 1.00 72.44 H new ATOM 0 HB3 ASP A 76 40.116 6.120 3.130 1.00 72.44 H new ATOM 1101 N THR A 77 37.031 6.259 5.025 1.00 11.55 N ATOM 1102 CA THR A 77 36.466 7.360 5.791 1.00 12.43 C ATOM 1103 C THR A 77 35.868 6.891 7.117 1.00 50.31 C ATOM 1104 O THR A 77 35.533 5.713 7.284 1.00 30.02 O ATOM 1105 CB THR A 77 35.385 8.080 4.957 1.00 41.10 C ATOM 1106 OG1 THR A 77 34.769 9.125 5.718 1.00 73.42 O ATOM 1107 CG2 THR A 77 34.314 7.108 4.470 1.00 73.22 C ATOM 0 H THR A 77 36.360 5.798 4.410 1.00 11.55 H new ATOM 0 HA THR A 77 37.278 8.049 6.021 1.00 12.43 H new ATOM 0 HB THR A 77 35.883 8.511 4.089 1.00 41.10 H new ATOM 0 HG1 THR A 77 35.462 9.672 6.143 1.00 73.42 H new ATOM 0 HG21 THR A 77 33.569 7.649 3.886 1.00 73.22 H new ATOM 0 HG22 THR A 77 34.775 6.341 3.848 1.00 73.22 H new ATOM 0 HG23 THR A 77 33.832 6.639 5.327 1.00 73.22 H new ATOM 1115 N THR A 78 35.726 7.832 8.050 1.00 13.54 N ATOM 1116 CA THR A 78 35.169 7.551 9.367 1.00 2.03 C ATOM 1117 C THR A 78 34.311 8.724 9.843 1.00 41.21 C ATOM 1118 O THR A 78 34.569 9.879 9.506 1.00 33.42 O ATOM 1119 CB THR A 78 36.283 7.288 10.411 1.00 65.01 C ATOM 1120 OG1 THR A 78 37.140 6.227 9.965 1.00 41.13 O ATOM 1121 CG2 THR A 78 35.702 6.923 11.775 1.00 52.04 C ATOM 0 H THR A 78 35.994 8.807 7.912 1.00 13.54 H new ATOM 0 HA THR A 78 34.556 6.654 9.275 1.00 2.03 H new ATOM 0 HB THR A 78 36.856 8.210 10.515 1.00 65.01 H new ATOM 0 HG1 THR A 78 37.841 6.070 10.632 1.00 41.13 H new ATOM 0 HG21 THR A 78 36.514 6.746 12.481 1.00 52.04 H new ATOM 0 HG22 THR A 78 35.079 7.742 12.136 1.00 52.04 H new ATOM 0 HG23 THR A 78 35.098 6.021 11.683 1.00 52.04 H new ATOM 1129 N VAL A 79 33.299 8.406 10.631 1.00 13.33 N ATOM 1130 CA VAL A 79 32.411 9.398 11.224 1.00 51.35 C ATOM 1131 C VAL A 79 32.211 9.067 12.698 1.00 40.33 C ATOM 1132 O VAL A 79 31.987 7.911 13.051 1.00 15.54 O ATOM 1133 CB VAL A 79 31.031 9.447 10.510 1.00 73.54 C ATOM 1134 CG1 VAL A 79 30.079 10.414 11.215 1.00 32.33 C ATOM 1135 CG2 VAL A 79 31.191 9.836 9.041 1.00 4.51 C ATOM 0 H VAL A 79 33.066 7.445 10.881 1.00 13.33 H new ATOM 0 HA VAL A 79 32.874 10.378 11.110 1.00 51.35 H new ATOM 0 HB VAL A 79 30.599 8.447 10.558 1.00 73.54 H new ATOM 0 HG11 VAL A 79 29.122 10.427 10.693 1.00 32.33 H new ATOM 0 HG12 VAL A 79 29.927 10.089 12.244 1.00 32.33 H new ATOM 0 HG13 VAL A 79 30.509 11.416 11.211 1.00 32.33 H new ATOM 0 HG21 VAL A 79 30.212 9.863 8.563 1.00 4.51 H new ATOM 0 HG22 VAL A 79 31.655 10.820 8.974 1.00 4.51 H new ATOM 0 HG23 VAL A 79 31.820 9.103 8.537 1.00 4.51 H new ATOM 1145 N THR A 80 32.335 10.070 13.553 1.00 3.21 N ATOM 1146 CA THR A 80 32.142 9.886 14.983 1.00 52.54 C ATOM 1147 C THR A 80 30.918 10.656 15.459 1.00 43.34 C ATOM 1148 O THR A 80 30.882 11.885 15.388 1.00 4.30 O ATOM 1149 CB THR A 80 33.378 10.351 15.789 1.00 61.00 C ATOM 1150 OG1 THR A 80 34.547 9.628 15.363 1.00 41.24 O ATOM 1151 CG2 THR A 80 33.165 10.148 17.288 1.00 20.33 C ATOM 0 H THR A 80 32.570 11.024 13.280 1.00 3.21 H new ATOM 0 HA THR A 80 31.996 8.819 15.154 1.00 52.54 H new ATOM 0 HB THR A 80 33.521 11.415 15.602 1.00 61.00 H new ATOM 0 HG1 THR A 80 35.324 9.930 15.878 1.00 41.24 H new ATOM 0 HG21 THR A 80 34.049 10.483 17.830 1.00 20.33 H new ATOM 0 HG22 THR A 80 32.299 10.725 17.614 1.00 20.33 H new ATOM 0 HG23 THR A 80 32.994 9.091 17.491 1.00 20.33 H new ATOM 1159 N ALA A 81 29.918 9.934 15.934 1.00 63.21 N ATOM 1160 CA ALA A 81 28.741 10.552 16.516 1.00 75.00 C ATOM 1161 C ALA A 81 28.928 10.672 18.018 1.00 14.40 C ATOM 1162 O ALA A 81 28.883 9.675 18.744 1.00 73.21 O ATOM 1163 CB ALA A 81 27.489 9.746 16.201 1.00 42.42 C ATOM 0 H ALA A 81 29.899 8.914 15.927 1.00 63.21 H new ATOM 0 HA ALA A 81 28.615 11.545 16.084 1.00 75.00 H new ATOM 0 HB1 ALA A 81 26.622 10.231 16.649 1.00 42.42 H new ATOM 0 HB2 ALA A 81 27.355 9.689 15.121 1.00 42.42 H new ATOM 0 HB3 ALA A 81 27.592 8.740 16.608 1.00 42.42 H new ATOM 1169 N GLU A 82 29.192 11.886 18.472 1.00 71.31 N ATOM 1170 CA GLU A 82 29.324 12.154 19.892 1.00 72.51 C ATOM 1171 C GLU A 82 28.036 12.801 20.384 1.00 53.13 C ATOM 1172 O GLU A 82 27.748 13.958 20.076 1.00 25.01 O ATOM 1173 CB GLU A 82 30.545 13.050 20.144 1.00 74.00 C ATOM 1174 CG GLU A 82 30.980 13.122 21.603 1.00 3.23 C ATOM 1175 CD GLU A 82 32.352 13.761 21.774 1.00 23.22 C ATOM 1176 OE1 GLU A 82 33.348 13.161 21.317 1.00 3.55 O ATOM 1177 OE2 GLU A 82 32.445 14.856 22.372 1.00 51.44 O1- ATOM 0 H GLU A 82 29.319 12.703 17.875 1.00 71.31 H new ATOM 0 HA GLU A 82 29.483 11.228 20.444 1.00 72.51 H new ATOM 0 HB2 GLU A 82 31.379 12.684 19.546 1.00 74.00 H new ATOM 0 HB3 GLU A 82 30.320 14.057 19.794 1.00 74.00 H new ATOM 0 HG2 GLU A 82 30.244 13.692 22.170 1.00 3.23 H new ATOM 0 HG3 GLU A 82 30.997 12.116 22.023 1.00 3.23 H new ATOM 1184 N VAL A 83 27.256 12.038 21.134 1.00 31.40 N ATOM 1185 CA VAL A 83 25.924 12.464 21.545 1.00 74.25 C ATOM 1186 C VAL A 83 25.917 12.908 23.001 1.00 12.15 C ATOM 1187 O VAL A 83 26.438 12.217 23.879 1.00 3.30 O ATOM 1188 CB VAL A 83 24.877 11.336 21.331 1.00 22.15 C ATOM 1189 CG1 VAL A 83 25.267 10.063 22.082 1.00 60.03 C ATOM 1190 CG2 VAL A 83 23.480 11.798 21.744 1.00 42.03 C ATOM 0 H VAL A 83 27.524 11.114 21.473 1.00 31.40 H new ATOM 0 HA VAL A 83 25.649 13.312 20.918 1.00 74.25 H new ATOM 0 HB VAL A 83 24.859 11.105 20.266 1.00 22.15 H new ATOM 0 HG11 VAL A 83 24.513 9.294 21.911 1.00 60.03 H new ATOM 0 HG12 VAL A 83 26.234 9.710 21.722 1.00 60.03 H new ATOM 0 HG13 VAL A 83 25.333 10.276 23.149 1.00 60.03 H new ATOM 0 HG21 VAL A 83 22.767 10.989 21.584 1.00 42.03 H new ATOM 0 HG22 VAL A 83 23.485 12.074 22.799 1.00 42.03 H new ATOM 0 HG23 VAL A 83 23.190 12.661 21.145 1.00 42.03 H new ATOM 1200 N GLY A 84 25.336 14.071 23.245 1.00 33.12 N ATOM 1201 CA GLY A 84 25.232 14.593 24.589 1.00 23.12 C ATOM 1202 C GLY A 84 23.796 14.858 24.979 1.00 64.22 C ATOM 1203 O GLY A 84 22.923 14.979 24.122 1.00 21.33 O ATOM 0 H GLY A 84 24.930 14.669 22.526 1.00 33.12 H new ATOM 0 HA2 GLY A 84 25.674 13.884 25.289 1.00 23.12 H new ATOM 0 HA3 GLY A 84 25.806 15.517 24.666 1.00 23.12 H new ATOM 1207 N ILE A 85 23.559 14.954 26.275 1.00 23.52 N ATOM 1208 CA ILE A 85 22.239 15.234 26.812 1.00 1.40 C ATOM 1209 C ILE A 85 22.375 16.236 27.949 1.00 61.15 C ATOM 1210 O ILE A 85 23.214 16.062 28.844 1.00 10.52 O ATOM 1211 CB ILE A 85 21.526 13.931 27.286 1.00 52.02 C ATOM 1212 CG1 ILE A 85 20.107 14.215 27.831 1.00 53.33 C ATOM 1213 CG2 ILE A 85 22.370 13.197 28.325 1.00 35.55 C ATOM 1214 CD1 ILE A 85 20.062 14.623 29.290 1.00 71.32 C ATOM 0 H ILE A 85 24.280 14.839 26.988 1.00 23.52 H new ATOM 0 HA ILE A 85 21.615 15.661 26.026 1.00 1.40 H new ATOM 0 HB ILE A 85 21.415 13.287 26.414 1.00 52.02 H new ATOM 0 HG12 ILE A 85 19.653 15.005 27.232 1.00 53.33 H new ATOM 0 HG13 ILE A 85 19.495 13.323 27.698 1.00 53.33 H new ATOM 0 HG21 ILE A 85 21.852 12.291 28.641 1.00 35.55 H new ATOM 0 HG22 ILE A 85 23.333 12.931 27.889 1.00 35.55 H new ATOM 0 HG23 ILE A 85 22.528 13.844 29.188 1.00 35.55 H new ATOM 0 HD11 ILE A 85 19.028 14.802 29.586 1.00 71.32 H new ATOM 0 HD12 ILE A 85 20.483 13.826 29.904 1.00 71.32 H new ATOM 0 HD13 ILE A 85 20.643 15.535 29.431 1.00 71.32 H new ATOM 1226 N GLY A 86 21.563 17.286 27.886 1.00 43.44 N ATOM 1227 CA GLY A 86 21.622 18.371 28.851 1.00 64.20 C ATOM 1228 C GLY A 86 20.248 18.959 29.111 1.00 43.21 C ATOM 1229 O GLY A 86 19.297 18.623 28.404 1.00 31.32 O ATOM 0 H GLY A 86 20.850 17.406 27.167 1.00 43.44 H new ATOM 0 HA2 GLY A 86 22.045 18.005 29.786 1.00 64.20 H new ATOM 0 HA3 GLY A 86 22.289 19.151 28.483 1.00 64.20 H new ATOM 1233 N PRO A 87 20.105 19.828 30.126 1.00 20.43 N ATOM 1234 CA PRO A 87 18.812 20.400 30.499 1.00 73.43 C ATOM 1235 C PRO A 87 18.318 21.401 29.459 1.00 33.24 C ATOM 1236 O PRO A 87 18.981 22.402 29.180 1.00 11.41 O ATOM 1237 CB PRO A 87 19.083 21.104 31.846 1.00 75.13 C ATOM 1238 CG PRO A 87 20.468 20.698 32.240 1.00 24.22 C ATOM 1239 CD PRO A 87 21.184 20.362 30.963 1.00 44.21 C ATOM 0 HA PRO A 87 18.035 19.639 30.567 1.00 73.43 H new ATOM 0 HB2 PRO A 87 19.006 22.187 31.745 1.00 75.13 H new ATOM 0 HB3 PRO A 87 18.356 20.801 32.600 1.00 75.13 H new ATOM 0 HG2 PRO A 87 20.974 21.505 32.770 1.00 24.22 H new ATOM 0 HG3 PRO A 87 20.446 19.840 32.912 1.00 24.22 H new ATOM 0 HD2 PRO A 87 21.649 21.240 30.515 1.00 44.21 H new ATOM 0 HD3 PRO A 87 21.975 19.629 31.122 1.00 44.21 H new ATOM 1247 N ASN A 88 17.160 21.115 28.884 1.00 50.13 N ATOM 1248 CA ASN A 88 16.540 22.006 27.912 1.00 62.23 C ATOM 1249 C ASN A 88 15.984 23.228 28.634 1.00 31.22 C ATOM 1250 O ASN A 88 15.466 23.111 29.745 1.00 11.01 O ATOM 1251 CB ASN A 88 15.419 21.265 27.160 1.00 63.43 C ATOM 1252 CG ASN A 88 14.868 22.041 25.971 1.00 21.32 C ATOM 1253 OD1 ASN A 88 14.907 23.269 25.935 1.00 63.22 O ATOM 1254 ND2 ASN A 88 14.326 21.324 24.998 1.00 22.41 N ATOM 0 H ASN A 88 16.626 20.267 29.075 1.00 50.13 H new ATOM 0 HA ASN A 88 17.284 22.331 27.185 1.00 62.23 H new ATOM 0 HB2 ASN A 88 15.799 20.305 26.812 1.00 63.43 H new ATOM 0 HB3 ASN A 88 14.605 21.053 27.854 1.00 63.43 H new ATOM 0 HD21 ASN A 88 13.923 21.790 24.185 1.00 22.41 H new ATOM 0 HD22 ASN A 88 14.311 20.306 25.062 1.00 22.41 H new ATOM 1261 N GLU A 89 16.089 24.395 28.004 1.00 43.32 N ATOM 1262 CA GLU A 89 15.598 25.640 28.595 1.00 2.23 C ATOM 1263 C GLU A 89 14.071 25.615 28.729 1.00 10.40 C ATOM 1264 O GLU A 89 13.475 26.457 29.408 1.00 74.31 O ATOM 1265 CB GLU A 89 16.056 26.845 27.762 1.00 13.04 C ATOM 1266 CG GLU A 89 15.744 26.721 26.274 1.00 64.14 C ATOM 1267 CD GLU A 89 16.250 27.907 25.470 1.00 35.31 C ATOM 1268 OE1 GLU A 89 15.423 28.646 24.899 1.00 70.11 O ATOM 1269 OE2 GLU A 89 17.481 28.109 25.407 1.00 74.23 O1- ATOM 0 H GLU A 89 16.511 24.506 27.082 1.00 43.32 H new ATOM 0 HA GLU A 89 16.020 25.736 29.596 1.00 2.23 H new ATOM 0 HB2 GLU A 89 15.579 27.745 28.150 1.00 13.04 H new ATOM 0 HB3 GLU A 89 17.131 26.974 27.888 1.00 13.04 H new ATOM 0 HG2 GLU A 89 16.193 25.806 25.887 1.00 64.14 H new ATOM 0 HG3 GLU A 89 14.666 26.628 26.139 1.00 64.14 H new ATOM 1276 N GLU A 90 13.453 24.645 28.060 1.00 62.24 N ATOM 1277 CA GLU A 90 12.022 24.385 28.182 1.00 33.11 C ATOM 1278 C GLU A 90 11.704 23.763 29.551 1.00 41.22 C ATOM 1279 O GLU A 90 10.572 23.821 30.032 1.00 23.51 O ATOM 1280 CB GLU A 90 11.582 23.456 27.043 1.00 62.35 C ATOM 1281 CG GLU A 90 10.168 22.915 27.187 1.00 2.12 C ATOM 1282 CD GLU A 90 9.737 22.079 25.993 1.00 32.41 C ATOM 1283 OE1 GLU A 90 9.051 22.621 25.094 1.00 34.55 O ATOM 1284 OE2 GLU A 90 10.085 20.883 25.939 1.00 15.02 O1- ATOM 0 H GLU A 90 13.932 24.016 27.416 1.00 62.24 H new ATOM 0 HA GLU A 90 11.473 25.324 28.109 1.00 33.11 H new ATOM 0 HB2 GLU A 90 11.657 23.997 26.099 1.00 62.35 H new ATOM 0 HB3 GLU A 90 12.275 22.617 26.986 1.00 62.35 H new ATOM 0 HG2 GLU A 90 10.105 22.310 28.091 1.00 2.12 H new ATOM 0 HG3 GLU A 90 9.476 23.747 27.312 1.00 2.12 H new ATOM 1291 N GLY A 91 12.728 23.198 30.180 1.00 4.53 N ATOM 1292 CA GLY A 91 12.576 22.574 31.490 1.00 50.31 C ATOM 1293 C GLY A 91 12.569 21.058 31.418 1.00 52.42 C ATOM 1294 O GLY A 91 12.050 20.384 32.311 1.00 50.31 O ATOM 0 H GLY A 91 13.675 23.159 29.803 1.00 4.53 H new ATOM 0 HA2 GLY A 91 13.389 22.899 32.140 1.00 50.31 H new ATOM 0 HA3 GLY A 91 11.647 22.917 31.946 1.00 50.31 H new ATOM 1298 N GLY A 92 13.160 20.522 30.358 1.00 31.10 N ATOM 1299 CA GLY A 92 13.269 19.082 30.199 1.00 44.24 C ATOM 1300 C GLY A 92 14.677 18.667 29.825 1.00 74.12 C ATOM 1301 O GLY A 92 15.650 19.234 30.327 1.00 42.22 O ATOM 0 H GLY A 92 13.570 21.064 29.598 1.00 31.10 H new ATOM 0 HA2 GLY A 92 12.979 18.590 31.127 1.00 44.24 H new ATOM 0 HA3 GLY A 92 12.574 18.747 29.429 1.00 44.24 H new ATOM 1305 N PHE A 93 14.793 17.691 28.933 1.00 65.13 N ATOM 1306 CA PHE A 93 16.092 17.222 28.459 1.00 72.25 C ATOM 1307 C PHE A 93 16.233 17.488 26.965 1.00 30.35 C ATOM 1308 O PHE A 93 15.251 17.446 26.221 1.00 35.35 O ATOM 1309 CB PHE A 93 16.281 15.723 28.751 1.00 70.53 C ATOM 1310 CG PHE A 93 16.438 15.394 30.217 1.00 33.33 C ATOM 1311 CD1 PHE A 93 15.713 14.359 30.800 1.00 41.34 C ATOM 1312 CD2 PHE A 93 17.318 16.118 31.011 1.00 64.21 C ATOM 1313 CE1 PHE A 93 15.865 14.057 32.141 1.00 2.11 C ATOM 1314 CE2 PHE A 93 17.471 15.819 32.352 1.00 3.04 C ATOM 1315 CZ PHE A 93 16.745 14.789 32.918 1.00 12.34 C ATOM 0 H PHE A 93 13.997 17.205 28.520 1.00 65.13 H new ATOM 0 HA PHE A 93 16.866 17.771 28.994 1.00 72.25 H new ATOM 0 HB2 PHE A 93 15.424 15.176 28.357 1.00 70.53 H new ATOM 0 HB3 PHE A 93 17.160 15.367 28.214 1.00 70.53 H new ATOM 0 HD1 PHE A 93 15.024 13.785 30.198 1.00 41.34 H new ATOM 0 HD2 PHE A 93 17.890 16.924 30.576 1.00 64.21 H new ATOM 0 HE1 PHE A 93 15.297 13.251 32.581 1.00 2.11 H new ATOM 0 HE2 PHE A 93 18.158 16.391 32.957 1.00 3.04 H new ATOM 0 HZ PHE A 93 16.864 14.555 33.966 1.00 12.34 H new ATOM 1325 N ALA A 94 17.456 17.766 26.539 1.00 73.43 N ATOM 1326 CA ALA A 94 17.752 18.045 25.141 1.00 60.33 C ATOM 1327 C ALA A 94 18.960 17.236 24.688 1.00 65.32 C ATOM 1328 O ALA A 94 19.974 17.176 25.389 1.00 32.10 O ATOM 1329 CB ALA A 94 17.999 19.536 24.939 1.00 64.21 C ATOM 0 H ALA A 94 18.271 17.805 27.152 1.00 73.43 H new ATOM 0 HA ALA A 94 16.894 17.754 24.536 1.00 60.33 H new ATOM 0 HB1 ALA A 94 18.219 19.729 23.889 1.00 64.21 H new ATOM 0 HB2 ALA A 94 17.110 20.095 25.232 1.00 64.21 H new ATOM 0 HB3 ALA A 94 18.844 19.851 25.551 1.00 64.21 H new ATOM 1335 N LEU A 95 18.832 16.600 23.528 1.00 31.23 N ATOM 1336 CA LEU A 95 19.910 15.810 22.946 1.00 75.45 C ATOM 1337 C LEU A 95 20.683 16.645 21.936 1.00 41.42 C ATOM 1338 O LEU A 95 20.105 17.203 21.000 1.00 2.34 O ATOM 1339 CB LEU A 95 19.355 14.535 22.284 1.00 51.22 C ATOM 1340 CG LEU A 95 19.085 13.355 23.239 1.00 42.15 C ATOM 1341 CD1 LEU A 95 20.396 12.800 23.789 1.00 64.34 C ATOM 1342 CD2 LEU A 95 18.167 13.775 24.383 1.00 71.23 C ATOM 0 H LEU A 95 17.981 16.618 22.967 1.00 31.23 H new ATOM 0 HA LEU A 95 20.589 15.508 23.743 1.00 75.45 H new ATOM 0 HB2 LEU A 95 18.425 14.787 21.774 1.00 51.22 H new ATOM 0 HB3 LEU A 95 20.060 14.207 21.520 1.00 51.22 H new ATOM 0 HG LEU A 95 18.584 12.571 22.671 1.00 42.15 H new ATOM 0 HD11 LEU A 95 20.185 11.968 24.461 1.00 64.34 H new ATOM 0 HD12 LEU A 95 21.018 12.452 22.964 1.00 64.34 H new ATOM 0 HD13 LEU A 95 20.922 13.583 24.335 1.00 64.34 H new ATOM 0 HD21 LEU A 95 17.993 12.924 25.041 1.00 71.23 H new ATOM 0 HD22 LEU A 95 18.635 14.581 24.948 1.00 71.23 H new ATOM 0 HD23 LEU A 95 17.216 14.121 23.978 1.00 71.23 H new ATOM 1354 N ASP A 96 21.983 16.735 22.152 1.00 51.32 N ATOM 1355 CA ASP A 96 22.876 17.504 21.289 1.00 15.24 C ATOM 1356 C ASP A 96 23.891 16.553 20.662 1.00 33.43 C ATOM 1357 O ASP A 96 24.752 16.012 21.357 1.00 1.11 O ATOM 1358 CB ASP A 96 23.586 18.582 22.122 1.00 62.10 C ATOM 1359 CG ASP A 96 24.215 19.681 21.282 1.00 42.14 C ATOM 1360 OD1 ASP A 96 23.545 20.713 21.053 1.00 0.44 O ATOM 1361 OD2 ASP A 96 25.382 19.536 20.865 1.00 11.32 O1- ATOM 0 H ASP A 96 22.455 16.277 22.932 1.00 51.32 H new ATOM 0 HA ASP A 96 22.310 17.995 20.497 1.00 15.24 H new ATOM 0 HB2 ASP A 96 22.869 19.028 22.811 1.00 62.10 H new ATOM 0 HB3 ASP A 96 24.360 18.111 22.728 1.00 62.10 H new ATOM 1366 N VAL A 97 23.777 16.328 19.356 1.00 3.45 N ATOM 1367 CA VAL A 97 24.588 15.315 18.682 1.00 33.41 C ATOM 1368 C VAL A 97 25.650 15.959 17.795 1.00 35.23 C ATOM 1369 O VAL A 97 25.333 16.558 16.774 1.00 5.33 O ATOM 1370 CB VAL A 97 23.706 14.374 17.816 1.00 12.11 C ATOM 1371 CG1 VAL A 97 24.549 13.267 17.179 1.00 31.40 C ATOM 1372 CG2 VAL A 97 22.564 13.784 18.644 1.00 41.42 C ATOM 0 H VAL A 97 23.134 16.831 18.744 1.00 3.45 H new ATOM 0 HA VAL A 97 25.078 14.730 19.461 1.00 33.41 H new ATOM 0 HB VAL A 97 23.269 14.967 17.013 1.00 12.11 H new ATOM 0 HG11 VAL A 97 23.908 12.622 16.578 1.00 31.40 H new ATOM 0 HG12 VAL A 97 25.314 13.713 16.543 1.00 31.40 H new ATOM 0 HG13 VAL A 97 25.026 12.677 17.962 1.00 31.40 H new ATOM 0 HG21 VAL A 97 21.960 13.129 18.016 1.00 41.42 H new ATOM 0 HG22 VAL A 97 22.975 13.212 19.476 1.00 41.42 H new ATOM 0 HG23 VAL A 97 21.941 14.590 19.031 1.00 41.42 H new ATOM 1382 N GLU A 98 26.909 15.828 18.186 1.00 23.12 N ATOM 1383 CA GLU A 98 28.023 16.314 17.379 1.00 44.32 C ATOM 1384 C GLU A 98 28.459 15.232 16.398 1.00 21.31 C ATOM 1385 O GLU A 98 29.094 14.248 16.786 1.00 34.12 O ATOM 1386 CB GLU A 98 29.204 16.737 18.269 1.00 13.10 C ATOM 1387 CG GLU A 98 28.862 17.847 19.257 1.00 35.31 C ATOM 1388 CD GLU A 98 30.078 18.371 20.000 1.00 11.53 C ATOM 1389 OE1 GLU A 98 30.683 19.369 19.544 1.00 51.52 O ATOM 1390 OE2 GLU A 98 30.440 17.790 21.043 1.00 21.24 O1- ATOM 0 H GLU A 98 27.188 15.387 19.062 1.00 23.12 H new ATOM 0 HA GLU A 98 27.692 17.190 16.822 1.00 44.32 H new ATOM 0 HB2 GLU A 98 29.560 15.868 18.822 1.00 13.10 H new ATOM 0 HB3 GLU A 98 30.025 17.069 17.634 1.00 13.10 H new ATOM 0 HG2 GLU A 98 28.387 18.669 18.722 1.00 35.31 H new ATOM 0 HG3 GLU A 98 28.135 17.474 19.978 1.00 35.31 H new ATOM 1397 N LEU A 99 28.092 15.402 15.132 1.00 4.53 N ATOM 1398 CA LEU A 99 28.425 14.424 14.102 1.00 32.31 C ATOM 1399 C LEU A 99 29.724 14.846 13.409 1.00 52.01 C ATOM 1400 O LEU A 99 29.751 15.813 12.642 1.00 21.43 O ATOM 1401 CB LEU A 99 27.270 14.295 13.092 1.00 42.25 C ATOM 1402 CG LEU A 99 27.169 12.935 12.376 1.00 64.41 C ATOM 1403 CD1 LEU A 99 26.886 11.815 13.382 1.00 73.33 C ATOM 1404 CD2 LEU A 99 26.090 12.972 11.293 1.00 23.33 C ATOM 0 H LEU A 99 27.564 16.207 14.795 1.00 4.53 H new ATOM 0 HA LEU A 99 28.573 13.445 14.559 1.00 32.31 H new ATOM 0 HB2 LEU A 99 26.331 14.483 13.613 1.00 42.25 H new ATOM 0 HB3 LEU A 99 27.379 15.076 12.339 1.00 42.25 H new ATOM 0 HG LEU A 99 28.126 12.731 11.896 1.00 64.41 H new ATOM 0 HD11 LEU A 99 26.818 10.862 12.856 1.00 73.33 H new ATOM 0 HD12 LEU A 99 27.694 11.770 14.113 1.00 73.33 H new ATOM 0 HD13 LEU A 99 25.945 12.015 13.894 1.00 73.33 H new ATOM 0 HD21 LEU A 99 26.036 12.001 10.800 1.00 23.33 H new ATOM 0 HD22 LEU A 99 25.126 13.203 11.747 1.00 23.33 H new ATOM 0 HD23 LEU A 99 26.338 13.738 10.559 1.00 23.33 H new ATOM 1416 N ARG A 100 30.795 14.119 13.708 1.00 15.15 N ATOM 1417 CA ARG A 100 32.148 14.469 13.276 1.00 11.05 C ATOM 1418 C ARG A 100 32.534 13.650 12.049 1.00 44.33 C ATOM 1419 O ARG A 100 32.719 12.437 12.142 1.00 60.34 O ATOM 1420 CB ARG A 100 33.118 14.201 14.439 1.00 62.13 C ATOM 1421 CG ARG A 100 34.469 14.905 14.343 1.00 11.51 C ATOM 1422 CD ARG A 100 35.303 14.627 15.591 1.00 61.51 C ATOM 1423 NE ARG A 100 36.528 15.426 15.652 1.00 42.53 N ATOM 1424 CZ ARG A 100 37.360 15.440 16.700 1.00 32.53 C ATOM 1425 NH1 ARG A 100 37.103 14.699 17.775 1.00 73.43 N1+ ATOM 1426 NH2 ARG A 100 38.447 16.201 16.675 1.00 1.52 N ATOM 0 H ARG A 100 30.751 13.263 14.261 1.00 15.15 H new ATOM 0 HA ARG A 100 32.194 15.523 13.002 1.00 11.05 H new ATOM 0 HB2 ARG A 100 32.636 14.503 15.369 1.00 62.13 H new ATOM 0 HB3 ARG A 100 33.291 13.127 14.504 1.00 62.13 H new ATOM 0 HG2 ARG A 100 35.003 14.562 13.457 1.00 11.51 H new ATOM 0 HG3 ARG A 100 34.320 15.979 14.229 1.00 11.51 H new ATOM 0 HD2 ARG A 100 34.700 14.829 16.476 1.00 61.51 H new ATOM 0 HD3 ARG A 100 35.564 13.569 15.618 1.00 61.51 H new ATOM 0 HE ARG A 100 36.762 16.007 14.847 1.00 42.53 H new ATOM 0 HH11 ARG A 100 36.267 14.115 17.804 1.00 73.43 H new ATOM 0 HH12 ARG A 100 37.742 14.715 18.570 1.00 73.43 H new ATOM 0 HH21 ARG A 100 38.649 16.776 15.857 1.00 1.52 H new ATOM 0 HH22 ARG A 100 39.081 16.211 17.474 1.00 1.52 H new ATOM 1440 N VAL A 101 32.660 14.310 10.901 1.00 42.14 N ATOM 1441 CA VAL A 101 32.841 13.613 9.631 1.00 72.23 C ATOM 1442 C VAL A 101 34.276 13.736 9.135 1.00 42.25 C ATOM 1443 O VAL A 101 34.735 14.832 8.825 1.00 41.22 O ATOM 1444 CB VAL A 101 31.891 14.179 8.549 1.00 14.41 C ATOM 1445 CG1 VAL A 101 32.025 13.394 7.244 1.00 25.41 C ATOM 1446 CG2 VAL A 101 30.444 14.179 9.047 1.00 42.30 C ATOM 0 H VAL A 101 32.640 15.327 10.824 1.00 42.14 H new ATOM 0 HA VAL A 101 32.609 12.563 9.807 1.00 72.23 H new ATOM 0 HB VAL A 101 32.177 15.211 8.348 1.00 14.41 H new ATOM 0 HG11 VAL A 101 31.348 13.810 6.498 1.00 25.41 H new ATOM 0 HG12 VAL A 101 33.051 13.463 6.881 1.00 25.41 H new ATOM 0 HG13 VAL A 101 31.772 12.349 7.421 1.00 25.41 H new ATOM 0 HG21 VAL A 101 29.792 14.581 8.271 1.00 42.30 H new ATOM 0 HG22 VAL A 101 30.141 13.159 9.284 1.00 42.30 H new ATOM 0 HG23 VAL A 101 30.367 14.797 9.941 1.00 42.30 H new ATOM 1456 N ALA A 102 34.980 12.613 9.057 1.00 43.12 N ATOM 1457 CA ALA A 102 36.340 12.601 8.532 1.00 40.03 C ATOM 1458 C ALA A 102 36.384 11.854 7.204 1.00 12.52 C ATOM 1459 O ALA A 102 36.382 10.618 7.172 1.00 73.10 O ATOM 1460 CB ALA A 102 37.294 11.963 9.542 1.00 44.05 C ATOM 0 H ALA A 102 34.632 11.700 9.350 1.00 43.12 H new ATOM 0 HA ALA A 102 36.660 13.629 8.361 1.00 40.03 H new ATOM 0 HB1 ALA A 102 38.306 11.961 9.136 1.00 44.05 H new ATOM 0 HB2 ALA A 102 37.277 12.534 10.470 1.00 44.05 H new ATOM 0 HB3 ALA A 102 36.981 10.938 9.741 1.00 44.05 H new ATOM 1466 N LEU A 103 36.423 12.616 6.111 1.00 73.31 N ATOM 1467 CA LEU A 103 36.500 12.056 4.763 1.00 63.24 C ATOM 1468 C LEU A 103 37.877 12.376 4.177 1.00 11.33 C ATOM 1469 O LEU A 103 38.212 13.545 3.976 1.00 24.41 O ATOM 1470 CB LEU A 103 35.373 12.628 3.875 1.00 41.13 C ATOM 1471 CG LEU A 103 35.231 12.002 2.469 1.00 32.24 C ATOM 1472 CD1 LEU A 103 34.914 10.516 2.558 1.00 55.32 C ATOM 1473 CD2 LEU A 103 34.150 12.712 1.655 1.00 41.41 C ATOM 0 H LEU A 103 36.402 13.635 6.135 1.00 73.31 H new ATOM 0 HA LEU A 103 36.368 10.975 4.803 1.00 63.24 H new ATOM 0 HB2 LEU A 103 34.426 12.507 4.402 1.00 41.13 H new ATOM 0 HB3 LEU A 103 35.538 13.699 3.759 1.00 41.13 H new ATOM 0 HG LEU A 103 36.188 12.126 1.963 1.00 32.24 H new ATOM 0 HD11 LEU A 103 34.820 10.103 1.554 1.00 55.32 H new ATOM 0 HD12 LEU A 103 35.718 10.004 3.087 1.00 55.32 H new ATOM 0 HD13 LEU A 103 33.977 10.375 3.097 1.00 55.32 H new ATOM 0 HD21 LEU A 103 34.073 12.250 0.671 1.00 41.41 H new ATOM 0 HD22 LEU A 103 33.193 12.629 2.171 1.00 41.41 H new ATOM 0 HD23 LEU A 103 34.412 13.764 1.542 1.00 41.41 H new ATOM 1485 N PRO A 104 38.701 11.346 3.918 1.00 73.52 N ATOM 1486 CA PRO A 104 40.080 11.534 3.466 1.00 62.42 C ATOM 1487 C PRO A 104 40.155 12.065 2.039 1.00 45.15 C ATOM 1488 O PRO A 104 39.292 11.772 1.208 1.00 0.45 O ATOM 1489 CB PRO A 104 40.684 10.130 3.564 1.00 24.31 C ATOM 1490 CG PRO A 104 39.526 9.204 3.426 1.00 63.40 C ATOM 1491 CD PRO A 104 38.345 9.922 4.021 1.00 45.41 C ATOM 0 HA PRO A 104 40.610 12.275 4.065 1.00 62.42 H new ATOM 0 HB2 PRO A 104 41.421 9.961 2.779 1.00 24.31 H new ATOM 0 HB3 PRO A 104 41.194 9.985 4.516 1.00 24.31 H new ATOM 0 HG2 PRO A 104 39.346 8.958 2.379 1.00 63.40 H new ATOM 0 HG3 PRO A 104 39.714 8.265 3.946 1.00 63.40 H new ATOM 0 HD2 PRO A 104 37.428 9.700 3.476 1.00 45.41 H new ATOM 0 HD3 PRO A 104 38.179 9.626 5.057 1.00 45.41 H new ATOM 1499 N GLY A 105 41.193 12.843 1.771 1.00 54.45 N ATOM 1500 CA GLY A 105 41.364 13.444 0.461 1.00 13.33 C ATOM 1501 C GLY A 105 40.385 14.578 0.216 1.00 43.42 C ATOM 1502 O GLY A 105 40.201 15.019 -0.921 1.00 1.41 O ATOM 0 H GLY A 105 41.926 13.071 2.442 1.00 54.45 H new ATOM 0 HA2 GLY A 105 42.383 13.820 0.366 1.00 13.33 H new ATOM 0 HA3 GLY A 105 41.233 12.681 -0.306 1.00 13.33 H new ATOM 1506 N LEU A 106 39.761 15.057 1.289 1.00 4.51 N ATOM 1507 CA LEU A 106 38.748 16.107 1.203 1.00 40.14 C ATOM 1508 C LEU A 106 39.096 17.286 2.114 1.00 43.11 C ATOM 1509 O LEU A 106 39.599 17.102 3.226 1.00 42.33 O ATOM 1510 CB LEU A 106 37.367 15.535 1.574 1.00 65.03 C ATOM 1511 CG LEU A 106 36.270 16.580 1.865 1.00 43.51 C ATOM 1512 CD1 LEU A 106 35.962 17.426 0.633 1.00 44.14 C ATOM 1513 CD2 LEU A 106 35.007 15.906 2.383 1.00 41.21 C ATOM 0 H LEU A 106 39.942 14.731 2.238 1.00 4.51 H new ATOM 0 HA LEU A 106 38.721 16.473 0.177 1.00 40.14 H new ATOM 0 HB2 LEU A 106 37.028 14.895 0.759 1.00 65.03 H new ATOM 0 HB3 LEU A 106 37.481 14.899 2.452 1.00 65.03 H new ATOM 0 HG LEU A 106 36.648 17.248 2.639 1.00 43.51 H new ATOM 0 HD11 LEU A 106 35.185 18.151 0.875 1.00 44.14 H new ATOM 0 HD12 LEU A 106 36.863 17.951 0.318 1.00 44.14 H new ATOM 0 HD13 LEU A 106 35.617 16.780 -0.175 1.00 44.14 H new ATOM 0 HD21 LEU A 106 34.247 16.661 2.582 1.00 41.21 H new ATOM 0 HD22 LEU A 106 34.636 15.205 1.635 1.00 41.21 H new ATOM 0 HD23 LEU A 106 35.233 15.368 3.304 1.00 41.21 H new ATOM 1525 N ASP A 107 38.832 18.495 1.620 1.00 72.42 N ATOM 1526 CA ASP A 107 38.990 19.718 2.399 1.00 14.02 C ATOM 1527 C ASP A 107 37.769 19.946 3.278 1.00 1.12 C ATOM 1528 O ASP A 107 36.643 19.705 2.849 1.00 10.24 O ATOM 1529 CB ASP A 107 39.162 20.928 1.474 1.00 13.35 C ATOM 1530 CG ASP A 107 40.516 20.963 0.791 1.00 12.43 C ATOM 1531 OD1 ASP A 107 40.610 20.542 -0.383 1.00 14.01 O ATOM 1532 OD2 ASP A 107 41.493 21.409 1.428 1.00 2.52 O1- ATOM 0 H ASP A 107 38.502 18.652 0.668 1.00 72.42 H new ATOM 0 HA ASP A 107 39.878 19.606 3.021 1.00 14.02 H new ATOM 0 HB2 ASP A 107 38.379 20.913 0.716 1.00 13.35 H new ATOM 0 HB3 ASP A 107 39.029 21.842 2.052 1.00 13.35 H new ATOM 1537 N ALA A 108 37.994 20.437 4.492 1.00 41.30 N ATOM 1538 CA ALA A 108 36.906 20.745 5.416 1.00 54.32 C ATOM 1539 C ALA A 108 35.957 21.779 4.811 1.00 74.35 C ATOM 1540 O ALA A 108 34.746 21.723 5.021 1.00 33.14 O ATOM 1541 CB ALA A 108 37.464 21.241 6.748 1.00 73.33 C ATOM 0 H ALA A 108 38.925 20.631 4.861 1.00 41.30 H new ATOM 0 HA ALA A 108 36.340 19.831 5.597 1.00 54.32 H new ATOM 0 HB1 ALA A 108 36.641 21.466 7.426 1.00 73.33 H new ATOM 0 HB2 ALA A 108 38.096 20.469 7.188 1.00 73.33 H new ATOM 0 HB3 ALA A 108 38.055 22.142 6.582 1.00 73.33 H new ATOM 1547 N ALA A 109 36.524 22.707 4.042 1.00 23.13 N ATOM 1548 CA ALA A 109 35.750 23.759 3.385 1.00 64.13 C ATOM 1549 C ALA A 109 34.679 23.157 2.473 1.00 31.24 C ATOM 1550 O ALA A 109 33.520 23.569 2.501 1.00 41.21 O ATOM 1551 CB ALA A 109 36.674 24.677 2.593 1.00 33.23 C ATOM 0 H ALA A 109 37.526 22.751 3.858 1.00 23.13 H new ATOM 0 HA ALA A 109 35.248 24.348 4.153 1.00 64.13 H new ATOM 0 HB1 ALA A 109 36.085 25.456 2.109 1.00 33.23 H new ATOM 0 HB2 ALA A 109 37.397 25.135 3.268 1.00 33.23 H new ATOM 0 HB3 ALA A 109 37.201 24.097 1.836 1.00 33.23 H new ATOM 1557 N ALA A 110 35.077 22.173 1.670 1.00 73.25 N ATOM 1558 CA ALA A 110 34.145 21.480 0.787 1.00 12.34 C ATOM 1559 C ALA A 110 33.291 20.508 1.593 1.00 44.05 C ATOM 1560 O ALA A 110 32.101 20.327 1.324 1.00 34.04 O ATOM 1561 CB ALA A 110 34.901 20.749 -0.319 1.00 53.00 C ATOM 0 H ALA A 110 36.039 21.838 1.613 1.00 73.25 H new ATOM 0 HA ALA A 110 33.489 22.214 0.319 1.00 12.34 H new ATOM 0 HB1 ALA A 110 34.191 20.237 -0.969 1.00 53.00 H new ATOM 0 HB2 ALA A 110 35.475 21.468 -0.904 1.00 53.00 H new ATOM 0 HB3 ALA A 110 35.578 20.019 0.124 1.00 53.00 H new ATOM 1567 N ALA A 111 33.910 19.903 2.603 1.00 5.14 N ATOM 1568 CA ALA A 111 33.221 18.966 3.483 1.00 43.54 C ATOM 1569 C ALA A 111 32.000 19.621 4.116 1.00 4.44 C ATOM 1570 O ALA A 111 30.986 18.965 4.356 1.00 54.13 O ATOM 1571 CB ALA A 111 34.170 18.448 4.556 1.00 13.31 C ATOM 0 H ALA A 111 34.893 20.047 2.833 1.00 5.14 H new ATOM 0 HA ALA A 111 32.881 18.120 2.886 1.00 43.54 H new ATOM 0 HB1 ALA A 111 33.640 17.750 5.204 1.00 13.31 H new ATOM 0 HB2 ALA A 111 35.010 17.938 4.084 1.00 13.31 H new ATOM 0 HB3 ALA A 111 34.540 19.284 5.149 1.00 13.31 H new ATOM 1577 N LYS A 112 32.105 20.927 4.364 1.00 1.14 N ATOM 1578 CA LYS A 112 30.999 21.711 4.900 1.00 13.13 C ATOM 1579 C LYS A 112 29.732 21.493 4.078 1.00 74.23 C ATOM 1580 O LYS A 112 28.660 21.227 4.626 1.00 4.50 O ATOM 1581 CB LYS A 112 31.346 23.210 4.894 1.00 13.05 C ATOM 1582 CG LYS A 112 32.425 23.616 5.889 1.00 32.13 C ATOM 1583 CD LYS A 112 31.953 23.474 7.333 1.00 10.41 C ATOM 1584 CE LYS A 112 32.934 24.114 8.307 1.00 22.11 C ATOM 1585 NZ LYS A 112 33.168 25.548 7.988 1.00 2.23 N1+ ATOM 0 H LYS A 112 32.955 21.466 4.199 1.00 1.14 H new ATOM 0 HA LYS A 112 30.826 21.381 5.924 1.00 13.13 H new ATOM 0 HB2 LYS A 112 31.671 23.490 3.892 1.00 13.05 H new ATOM 0 HB3 LYS A 112 30.441 23.780 5.107 1.00 13.05 H new ATOM 0 HG2 LYS A 112 33.311 23.000 5.735 1.00 32.13 H new ATOM 0 HG3 LYS A 112 32.719 24.649 5.704 1.00 32.13 H new ATOM 0 HD2 LYS A 112 30.973 23.939 7.444 1.00 10.41 H new ATOM 0 HD3 LYS A 112 31.834 22.418 7.576 1.00 10.41 H new ATOM 0 HE2 LYS A 112 32.549 24.025 9.323 1.00 22.11 H new ATOM 0 HE3 LYS A 112 33.881 23.575 8.277 1.00 22.11 H new ATOM 0 HZ1 LYS A 112 33.500 26.043 8.840 1.00 2.23 H new ATOM 0 HZ2 LYS A 112 33.887 25.625 7.240 1.00 2.23 H new ATOM 0 HZ3 LYS A 112 32.281 25.980 7.660 1.00 2.23 H new ATOM 1599 N THR A 113 29.865 21.604 2.759 1.00 31.43 N ATOM 1600 CA THR A 113 28.716 21.520 1.871 1.00 60.21 C ATOM 1601 C THR A 113 28.346 20.066 1.596 1.00 74.22 C ATOM 1602 O THR A 113 27.171 19.727 1.488 1.00 73.22 O ATOM 1603 CB THR A 113 28.964 22.270 0.540 1.00 31.33 C ATOM 1604 OG1 THR A 113 27.710 22.634 -0.056 1.00 10.35 O ATOM 1605 CG2 THR A 113 29.763 21.429 -0.445 1.00 32.43 C ATOM 0 H THR A 113 30.756 21.752 2.285 1.00 31.43 H new ATOM 0 HA THR A 113 27.882 22.005 2.378 1.00 60.21 H new ATOM 0 HB THR A 113 29.544 23.163 0.771 1.00 31.33 H new ATOM 0 HG1 THR A 113 27.873 23.110 -0.897 1.00 10.35 H new ATOM 0 HG21 THR A 113 29.915 21.993 -1.365 1.00 32.43 H new ATOM 0 HG22 THR A 113 30.730 21.179 -0.009 1.00 32.43 H new ATOM 0 HG23 THR A 113 29.217 20.512 -0.667 1.00 32.43 H new ATOM 1613 N LEU A 114 29.357 19.208 1.497 1.00 23.12 N ATOM 1614 CA LEU A 114 29.129 17.787 1.223 1.00 20.51 C ATOM 1615 C LEU A 114 28.302 17.146 2.336 1.00 41.04 C ATOM 1616 O LEU A 114 27.306 16.470 2.071 1.00 13.34 O ATOM 1617 CB LEU A 114 30.459 17.042 1.037 1.00 61.01 C ATOM 1618 CG LEU A 114 31.351 17.566 -0.103 1.00 11.45 C ATOM 1619 CD1 LEU A 114 32.536 16.634 -0.339 1.00 1.51 C ATOM 1620 CD2 LEU A 114 30.543 17.759 -1.387 1.00 50.51 C ATOM 0 H LEU A 114 30.338 19.467 1.601 1.00 23.12 H new ATOM 0 HA LEU A 114 28.566 17.711 0.292 1.00 20.51 H new ATOM 0 HB2 LEU A 114 31.020 17.096 1.970 1.00 61.01 H new ATOM 0 HB3 LEU A 114 30.245 15.989 0.854 1.00 61.01 H new ATOM 0 HG LEU A 114 31.742 18.539 0.196 1.00 11.45 H new ATOM 0 HD11 LEU A 114 33.151 17.026 -1.149 1.00 1.51 H new ATOM 0 HD12 LEU A 114 33.133 16.567 0.570 1.00 1.51 H new ATOM 0 HD13 LEU A 114 32.171 15.642 -0.607 1.00 1.51 H new ATOM 0 HD21 LEU A 114 31.197 18.130 -2.176 1.00 50.51 H new ATOM 0 HD22 LEU A 114 30.111 16.806 -1.692 1.00 50.51 H new ATOM 0 HD23 LEU A 114 29.744 18.479 -1.209 1.00 50.51 H new ATOM 1632 N VAL A 115 28.704 17.383 3.579 1.00 72.22 N ATOM 1633 CA VAL A 115 27.972 16.866 4.731 1.00 32.34 C ATOM 1634 C VAL A 115 26.604 17.542 4.832 1.00 1.13 C ATOM 1635 O VAL A 115 25.619 16.921 5.239 1.00 25.22 O ATOM 1636 CB VAL A 115 28.764 17.073 6.048 1.00 63.01 C ATOM 1637 CG1 VAL A 115 27.982 16.538 7.247 1.00 14.41 C ATOM 1638 CG2 VAL A 115 30.137 16.406 5.958 1.00 35.24 C ATOM 0 H VAL A 115 29.532 17.929 3.816 1.00 72.22 H new ATOM 0 HA VAL A 115 27.836 15.794 4.586 1.00 32.34 H new ATOM 0 HB VAL A 115 28.909 18.144 6.192 1.00 63.01 H new ATOM 0 HG11 VAL A 115 28.560 16.696 8.158 1.00 14.41 H new ATOM 0 HG12 VAL A 115 27.031 17.064 7.325 1.00 14.41 H new ATOM 0 HG13 VAL A 115 27.797 15.472 7.114 1.00 14.41 H new ATOM 0 HG21 VAL A 115 30.679 16.561 6.891 1.00 35.24 H new ATOM 0 HG22 VAL A 115 30.012 15.337 5.785 1.00 35.24 H new ATOM 0 HG23 VAL A 115 30.701 16.843 5.134 1.00 35.24 H new ATOM 1648 N ASP A 116 26.552 18.811 4.432 1.00 34.11 N ATOM 1649 CA ASP A 116 25.306 19.576 4.433 1.00 22.44 C ATOM 1650 C ASP A 116 24.274 18.935 3.514 1.00 4.20 C ATOM 1651 O ASP A 116 23.179 18.567 3.954 1.00 63.50 O ATOM 1652 CB ASP A 116 25.561 21.019 3.983 1.00 1.42 C ATOM 1653 CG ASP A 116 24.283 21.841 3.903 1.00 43.12 C ATOM 1654 OD1 ASP A 116 23.845 22.168 2.778 1.00 62.34 O ATOM 1655 OD2 ASP A 116 23.707 22.156 4.967 1.00 50.12 O1- ATOM 0 H ASP A 116 27.363 19.334 4.101 1.00 34.11 H new ATOM 0 HA ASP A 116 24.919 19.579 5.452 1.00 22.44 H new ATOM 0 HB2 ASP A 116 26.252 21.496 4.678 1.00 1.42 H new ATOM 0 HB3 ASP A 116 26.045 21.011 3.007 1.00 1.42 H new ATOM 1660 N ARG A 117 24.643 18.795 2.240 1.00 43.12 N ATOM 1661 CA ARG A 117 23.749 18.250 1.225 1.00 25.23 C ATOM 1662 C ARG A 117 23.412 16.797 1.534 1.00 51.42 C ATOM 1663 O ARG A 117 22.274 16.371 1.363 1.00 42.42 O ATOM 1664 CB ARG A 117 24.374 18.380 -0.176 1.00 4.30 C ATOM 1665 CG ARG A 117 25.739 17.715 -0.311 1.00 3.24 C ATOM 1666 CD ARG A 117 26.420 18.048 -1.636 1.00 12.41 C ATOM 1667 NE ARG A 117 25.891 17.265 -2.758 1.00 15.40 N ATOM 1668 CZ ARG A 117 26.352 17.350 -4.011 1.00 54.12 C ATOM 1669 NH1 ARG A 117 27.263 18.260 -4.332 1.00 44.31 N1+ ATOM 1670 NH2 ARG A 117 25.882 16.543 -4.952 1.00 65.24 N ATOM 0 H ARG A 117 25.564 19.055 1.887 1.00 43.12 H new ATOM 0 HA ARG A 117 22.823 18.825 1.238 1.00 25.23 H new ATOM 0 HB2 ARG A 117 23.694 17.943 -0.908 1.00 4.30 H new ATOM 0 HB3 ARG A 117 24.471 19.437 -0.423 1.00 4.30 H new ATOM 0 HG2 ARG A 117 26.378 18.033 0.513 1.00 3.24 H new ATOM 0 HG3 ARG A 117 25.624 16.634 -0.226 1.00 3.24 H new ATOM 0 HD2 ARG A 117 26.293 19.110 -1.848 1.00 12.41 H new ATOM 0 HD3 ARG A 117 27.491 17.867 -1.545 1.00 12.41 H new ATOM 0 HE ARG A 117 25.126 16.617 -2.572 1.00 15.40 H new ATOM 0 HH11 ARG A 117 27.616 18.901 -3.621 1.00 44.31 H new ATOM 0 HH12 ARG A 117 27.610 18.319 -5.289 1.00 44.31 H new ATOM 0 HH21 ARG A 117 25.166 15.854 -4.722 1.00 65.24 H new ATOM 0 HH22 ARG A 117 26.236 16.611 -5.906 1.00 65.24 H new ATOM 1684 N ALA A 118 24.401 16.049 2.008 1.00 40.10 N ATOM 1685 CA ALA A 118 24.194 14.658 2.410 1.00 45.33 C ATOM 1686 C ALA A 118 23.125 14.574 3.503 1.00 63.41 C ATOM 1687 O ALA A 118 22.145 13.838 3.381 1.00 0.11 O ATOM 1688 CB ALA A 118 25.507 14.045 2.889 1.00 44.02 C ATOM 0 H ALA A 118 25.358 16.381 2.125 1.00 40.10 H new ATOM 0 HA ALA A 118 23.846 14.091 1.547 1.00 45.33 H new ATOM 0 HB1 ALA A 118 25.338 13.010 3.185 1.00 44.02 H new ATOM 0 HB2 ALA A 118 26.239 14.077 2.082 1.00 44.02 H new ATOM 0 HB3 ALA A 118 25.882 14.610 3.742 1.00 44.02 H new ATOM 1694 N HIS A 119 23.301 15.384 4.544 1.00 52.13 N ATOM 1695 CA HIS A 119 22.370 15.435 5.673 1.00 15.33 C ATOM 1696 C HIS A 119 21.137 16.278 5.308 1.00 0.40 C ATOM 1697 O HIS A 119 20.317 16.612 6.166 1.00 63.33 O ATOM 1698 CB HIS A 119 23.101 16.018 6.904 1.00 54.45 C ATOM 1699 CG HIS A 119 22.341 15.954 8.203 1.00 21.21 C ATOM 1700 ND1 HIS A 119 22.268 14.817 8.983 1.00 2.34 N ATOM 1701 CD2 HIS A 119 21.660 16.911 8.883 1.00 20.34 C ATOM 1702 CE1 HIS A 119 21.580 15.078 10.081 1.00 52.23 C ATOM 1703 NE2 HIS A 119 21.199 16.339 10.045 1.00 74.13 N ATOM 0 H HIS A 119 24.091 16.023 4.631 1.00 52.13 H new ATOM 0 HA HIS A 119 22.024 14.430 5.912 1.00 15.33 H new ATOM 0 HB2 HIS A 119 24.044 15.487 7.029 1.00 54.45 H new ATOM 0 HB3 HIS A 119 23.347 17.060 6.698 1.00 54.45 H new ATOM 0 HD2 HIS A 119 21.508 17.933 8.569 1.00 20.34 H new ATOM 0 HE1 HIS A 119 21.366 14.376 10.874 1.00 52.23 H new ATOM 0 HE2 HIS A 119 20.651 16.814 10.763 1.00 74.13 H new ATOM 1712 N HIS A 120 21.034 16.649 4.029 1.00 43.52 N ATOM 1713 CA HIS A 120 19.887 17.405 3.516 1.00 31.45 C ATOM 1714 C HIS A 120 19.012 16.522 2.621 1.00 61.14 C ATOM 1715 O HIS A 120 17.788 16.559 2.713 1.00 43.11 O ATOM 1716 CB HIS A 120 20.373 18.633 2.725 1.00 2.24 C ATOM 1717 CG HIS A 120 19.298 19.628 2.375 1.00 45.12 C ATOM 1718 ND1 HIS A 120 19.431 20.980 2.606 1.00 44.32 N ATOM 1719 CD2 HIS A 120 18.082 19.472 1.793 1.00 50.50 C ATOM 1720 CE1 HIS A 120 18.349 21.608 2.187 1.00 65.24 C ATOM 1721 NE2 HIS A 120 17.516 20.716 1.689 1.00 75.14 N ATOM 0 H HIS A 120 21.739 16.436 3.323 1.00 43.52 H new ATOM 0 HA HIS A 120 19.290 17.739 4.365 1.00 31.45 H new ATOM 0 HB2 HIS A 120 21.142 19.141 3.307 1.00 2.24 H new ATOM 0 HB3 HIS A 120 20.844 18.290 1.804 1.00 2.24 H new ATOM 0 HD2 HIS A 120 17.642 18.540 1.471 1.00 50.50 H new ATOM 0 HE1 HIS A 120 18.175 22.672 2.243 1.00 65.24 H new ATOM 0 HE2 HIS A 120 16.599 20.919 1.291 1.00 75.14 H new ATOM 1730 N VAL A 121 19.653 15.741 1.751 1.00 33.11 N ATOM 1731 CA VAL A 121 18.939 14.950 0.743 1.00 23.21 C ATOM 1732 C VAL A 121 18.563 13.566 1.269 1.00 3.02 C ATOM 1733 O VAL A 121 17.656 12.919 0.739 1.00 30.52 O ATOM 1734 CB VAL A 121 19.771 14.792 -0.557 1.00 61.42 C ATOM 1735 CG1 VAL A 121 20.108 16.158 -1.154 1.00 74.54 C ATOM 1736 CG2 VAL A 121 21.042 13.979 -0.300 1.00 44.31 C ATOM 0 H VAL A 121 20.667 15.638 1.723 1.00 33.11 H new ATOM 0 HA VAL A 121 18.026 15.501 0.515 1.00 23.21 H new ATOM 0 HB VAL A 121 19.166 14.246 -1.280 1.00 61.42 H new ATOM 0 HG11 VAL A 121 20.692 16.023 -2.065 1.00 74.54 H new ATOM 0 HG12 VAL A 121 19.186 16.690 -1.389 1.00 74.54 H new ATOM 0 HG13 VAL A 121 20.687 16.737 -0.434 1.00 74.54 H new ATOM 0 HG21 VAL A 121 21.607 13.883 -1.228 1.00 44.31 H new ATOM 0 HG22 VAL A 121 21.654 14.486 0.446 1.00 44.31 H new ATOM 0 HG23 VAL A 121 20.772 12.988 0.064 1.00 44.31 H new ATOM 1746 N CYS A 122 19.264 13.116 2.309 1.00 31.44 N ATOM 1747 CA CYS A 122 18.991 11.820 2.924 1.00 53.14 C ATOM 1748 C CYS A 122 19.064 11.921 4.453 1.00 23.34 C ATOM 1749 O CYS A 122 19.896 11.268 5.092 1.00 24.32 O ATOM 1750 CB CYS A 122 19.986 10.773 2.400 1.00 50.43 C ATOM 1751 SG CYS A 122 19.734 9.105 3.057 1.00 72.12 S ATOM 0 H CYS A 122 20.028 13.633 2.744 1.00 31.44 H new ATOM 0 HA CYS A 122 17.981 11.509 2.656 1.00 53.14 H new ATOM 0 HB2 CYS A 122 19.917 10.736 1.313 1.00 50.43 H new ATOM 0 HB3 CYS A 122 20.998 11.097 2.644 1.00 50.43 H new ATOM 0 HG CYS A 122 19.668 9.155 4.354 1.00 72.12 H new ATOM 1757 N PRO A 123 18.210 12.764 5.069 1.00 50.40 N ATOM 1758 CA PRO A 123 18.159 12.928 6.512 1.00 60.03 C ATOM 1759 C PRO A 123 17.040 12.104 7.158 1.00 74.45 C ATOM 1760 O PRO A 123 16.032 11.791 6.517 1.00 30.15 O ATOM 1761 CB PRO A 123 17.864 14.422 6.631 1.00 24.23 C ATOM 1762 CG PRO A 123 16.967 14.724 5.465 1.00 34.14 C ATOM 1763 CD PRO A 123 17.229 13.655 4.417 1.00 45.03 C ATOM 0 HA PRO A 123 19.066 12.594 7.016 1.00 60.03 H new ATOM 0 HB2 PRO A 123 17.376 14.656 7.577 1.00 24.23 H new ATOM 0 HB3 PRO A 123 18.780 15.012 6.590 1.00 24.23 H new ATOM 0 HG2 PRO A 123 15.921 14.717 5.771 1.00 34.14 H new ATOM 0 HG3 PRO A 123 17.175 15.716 5.065 1.00 34.14 H new ATOM 0 HD2 PRO A 123 16.316 13.121 4.152 1.00 45.03 H new ATOM 0 HD3 PRO A 123 17.626 14.084 3.497 1.00 45.03 H new ATOM 1771 N TYR A 124 17.221 11.753 8.429 1.00 53.44 N ATOM 1772 CA TYR A 124 16.159 11.123 9.206 1.00 1.24 C ATOM 1773 C TYR A 124 15.114 12.179 9.556 1.00 42.34 C ATOM 1774 O TYR A 124 15.036 12.634 10.696 1.00 23.13 O ATOM 1775 CB TYR A 124 16.727 10.463 10.476 1.00 65.44 C ATOM 1776 CG TYR A 124 17.481 9.164 10.221 1.00 10.42 C ATOM 1777 CD1 TYR A 124 17.374 8.091 11.103 1.00 42.12 C ATOM 1778 CD2 TYR A 124 18.284 9.001 9.092 1.00 13.25 C ATOM 1779 CE1 TYR A 124 18.042 6.906 10.870 1.00 14.31 C ATOM 1780 CE2 TYR A 124 18.956 7.815 8.858 1.00 12.12 C ATOM 1781 CZ TYR A 124 18.830 6.772 9.750 1.00 5.42 C ATOM 1782 OH TYR A 124 19.494 5.588 9.518 1.00 60.35 O ATOM 0 H TYR A 124 18.092 11.894 8.941 1.00 53.44 H new ATOM 0 HA TYR A 124 15.692 10.335 8.615 1.00 1.24 H new ATOM 0 HB2 TYR A 124 17.396 11.168 10.970 1.00 65.44 H new ATOM 0 HB3 TYR A 124 15.907 10.265 11.167 1.00 65.44 H new ATOM 0 HD1 TYR A 124 16.758 8.188 11.984 1.00 42.12 H new ATOM 0 HD2 TYR A 124 18.383 9.815 8.389 1.00 13.25 H new ATOM 0 HE1 TYR A 124 17.946 6.085 11.566 1.00 14.31 H new ATOM 0 HE2 TYR A 124 19.576 7.707 7.981 1.00 12.12 H new ATOM 0 HH TYR A 124 20.461 5.745 9.540 1.00 60.35 H new ATOM 1792 N SER A 125 14.342 12.573 8.536 1.00 23.21 N ATOM 1793 CA SER A 125 13.415 13.704 8.615 1.00 62.44 C ATOM 1794 C SER A 125 14.183 15.023 8.505 1.00 2.13 C ATOM 1795 O SER A 125 15.342 15.113 8.905 1.00 5.11 O ATOM 1796 CB SER A 125 12.579 13.673 9.910 1.00 61.32 C ATOM 1797 OG SER A 125 11.692 14.779 9.979 1.00 44.54 O ATOM 0 H SER A 125 14.345 12.111 7.627 1.00 23.21 H new ATOM 0 HA SER A 125 12.721 13.623 7.779 1.00 62.44 H new ATOM 0 HB2 SER A 125 12.010 12.745 9.956 1.00 61.32 H new ATOM 0 HB3 SER A 125 13.243 13.683 10.774 1.00 61.32 H new ATOM 0 HG SER A 125 11.174 14.732 10.810 1.00 44.54 H new ATOM 1803 N ASN A 126 13.540 16.042 7.942 1.00 23.44 N ATOM 1804 CA ASN A 126 14.139 17.376 7.853 1.00 73.42 C ATOM 1805 C ASN A 126 14.389 17.895 9.267 1.00 24.25 C ATOM 1806 O ASN A 126 15.349 18.621 9.537 1.00 64.13 O ATOM 1807 CB ASN A 126 13.222 18.344 7.076 1.00 54.23 C ATOM 1808 CG ASN A 126 13.894 19.674 6.743 1.00 23.41 C ATOM 1809 OD1 ASN A 126 14.809 20.119 7.434 1.00 4.50 O ATOM 1810 ND2 ASN A 126 13.436 20.327 5.683 1.00 5.31 N ATOM 0 H ASN A 126 12.605 15.973 7.540 1.00 23.44 H new ATOM 0 HA ASN A 126 15.082 17.312 7.310 1.00 73.42 H new ATOM 0 HB2 ASN A 126 12.900 17.865 6.151 1.00 54.23 H new ATOM 0 HB3 ASN A 126 12.325 18.535 7.665 1.00 54.23 H new ATOM 0 HD21 ASN A 126 13.844 21.224 5.421 1.00 5.31 H new ATOM 0 HD22 ASN A 126 12.676 19.932 5.130 1.00 5.31 H new ATOM 1817 N ALA A 127 13.522 17.474 10.177 1.00 54.04 N ATOM 1818 CA ALA A 127 13.586 17.874 11.574 1.00 54.10 C ATOM 1819 C ALA A 127 14.839 17.334 12.282 1.00 52.15 C ATOM 1820 O ALA A 127 15.029 17.589 13.464 1.00 1.24 O ATOM 1821 CB ALA A 127 12.330 17.400 12.295 1.00 41.33 C ATOM 0 H ALA A 127 12.750 16.842 9.965 1.00 54.04 H new ATOM 0 HA ALA A 127 13.648 18.962 11.605 1.00 54.10 H new ATOM 0 HB1 ALA A 127 12.377 17.699 13.342 1.00 41.33 H new ATOM 0 HB2 ALA A 127 11.452 17.847 11.829 1.00 41.33 H new ATOM 0 HB3 ALA A 127 12.261 16.314 12.231 1.00 41.33 H new ATOM 1827 N THR A 128 15.721 16.649 11.551 1.00 1.20 N ATOM 1828 CA THR A 128 16.873 15.984 12.159 1.00 2.03 C ATOM 1829 C THR A 128 18.066 16.923 12.100 1.00 41.31 C ATOM 1830 O THR A 128 19.194 16.573 12.452 1.00 64.41 O ATOM 1831 CB THR A 128 17.210 14.652 11.435 1.00 53.22 C ATOM 1832 OG1 THR A 128 17.981 13.799 12.293 1.00 44.43 O ATOM 1833 CG2 THR A 128 17.992 14.893 10.146 1.00 73.21 C ATOM 0 H THR A 128 15.659 16.541 10.539 1.00 1.20 H new ATOM 0 HA THR A 128 16.632 15.742 13.194 1.00 2.03 H new ATOM 0 HB THR A 128 16.263 14.173 11.185 1.00 53.22 H new ATOM 0 HG1 THR A 128 18.709 14.315 12.698 1.00 44.43 H new ATOM 0 HG21 THR A 128 18.209 13.938 9.668 1.00 73.21 H new ATOM 0 HG22 THR A 128 17.399 15.510 9.471 1.00 73.21 H new ATOM 0 HG23 THR A 128 18.927 15.404 10.378 1.00 73.21 H new ATOM 1841 N ARG A 129 17.797 18.126 11.617 1.00 15.30 N ATOM 1842 CA ARG A 129 18.809 19.148 11.486 1.00 1.24 C ATOM 1843 C ARG A 129 18.269 20.495 11.952 1.00 21.22 C ATOM 1844 O ARG A 129 18.936 21.216 12.697 1.00 60.25 O ATOM 1845 CB ARG A 129 19.286 19.214 10.033 1.00 61.34 C ATOM 1846 CG ARG A 129 18.179 19.392 9.000 1.00 45.30 C ATOM 1847 CD ARG A 129 18.745 19.436 7.587 1.00 1.10 C ATOM 1848 NE ARG A 129 19.717 20.521 7.429 1.00 10.14 N ATOM 1849 CZ ARG A 129 20.798 20.473 6.646 1.00 72.04 C ATOM 1850 NH1 ARG A 129 21.082 19.374 5.951 1.00 12.15 N1+ ATOM 1851 NH2 ARG A 129 21.601 21.525 6.579 1.00 55.55 N ATOM 0 H ARG A 129 16.870 18.416 11.306 1.00 15.30 H new ATOM 0 HA ARG A 129 19.660 18.897 12.119 1.00 1.24 H new ATOM 0 HB2 ARG A 129 19.991 20.040 9.935 1.00 61.34 H new ATOM 0 HB3 ARG A 129 19.833 18.299 9.804 1.00 61.34 H new ATOM 0 HG2 ARG A 129 17.465 18.572 9.083 1.00 45.30 H new ATOM 0 HG3 ARG A 129 17.632 20.313 9.204 1.00 45.30 H new ATOM 0 HD2 ARG A 129 19.221 18.483 7.355 1.00 1.10 H new ATOM 0 HD3 ARG A 129 17.932 19.568 6.873 1.00 1.10 H new ATOM 0 HE ARG A 129 19.556 21.378 7.957 1.00 10.14 H new ATOM 0 HH11 ARG A 129 20.472 18.559 6.014 1.00 12.15 H new ATOM 0 HH12 ARG A 129 21.910 19.347 5.356 1.00 12.15 H new ATOM 0 HH21 ARG A 129 21.391 22.362 7.123 1.00 55.55 H new ATOM 0 HH22 ARG A 129 22.429 21.498 5.984 1.00 55.55 H new ATOM 1865 N ASN A 130 17.066 20.838 11.505 1.00 53.23 N ATOM 1866 CA ASN A 130 16.434 22.097 11.906 1.00 71.44 C ATOM 1867 C ASN A 130 15.828 22.006 13.304 1.00 71.52 C ATOM 1868 O ASN A 130 15.965 22.928 14.108 1.00 41.25 O ATOM 1869 CB ASN A 130 15.365 22.529 10.886 1.00 51.21 C ATOM 1870 CG ASN A 130 15.970 23.035 9.584 1.00 65.44 C ATOM 1871 OD1 ASN A 130 16.316 24.210 9.466 1.00 64.05 O ATOM 1872 ND2 ASN A 130 16.083 22.168 8.590 1.00 32.23 N ATOM 0 H ASN A 130 16.509 20.268 10.868 1.00 53.23 H new ATOM 0 HA ASN A 130 17.217 22.855 11.930 1.00 71.44 H new ATOM 0 HB2 ASN A 130 14.708 21.685 10.674 1.00 51.21 H new ATOM 0 HB3 ASN A 130 14.746 23.312 11.323 1.00 51.21 H new ATOM 0 HD21 ASN A 130 16.466 22.467 7.693 1.00 32.23 H new ATOM 0 HD22 ASN A 130 15.787 21.201 8.721 1.00 32.23 H new ATOM 1879 N ASN A 131 15.165 20.893 13.595 1.00 23.53 N ATOM 1880 CA ASN A 131 14.467 20.723 14.874 1.00 43.51 C ATOM 1881 C ASN A 131 15.393 20.070 15.901 1.00 71.03 C ATOM 1882 O ASN A 131 15.386 20.431 17.079 1.00 72.12 O ATOM 1883 CB ASN A 131 13.205 19.866 14.676 1.00 43.33 C ATOM 1884 CG ASN A 131 12.143 20.047 15.767 1.00 4.41 C ATOM 1885 OD1 ASN A 131 10.949 19.929 15.496 1.00 52.34 O ATOM 1886 ND2 ASN A 131 12.553 20.323 16.999 1.00 53.22 N ATOM 0 H ASN A 131 15.093 20.093 12.967 1.00 23.53 H new ATOM 0 HA ASN A 131 14.172 21.704 15.246 1.00 43.51 H new ATOM 0 HB2 ASN A 131 12.762 20.110 13.710 1.00 43.33 H new ATOM 0 HB3 ASN A 131 13.495 18.816 14.638 1.00 43.33 H new ATOM 0 HD21 ASN A 131 11.872 20.443 17.748 1.00 53.22 H new ATOM 0 HD22 ASN A 131 13.549 20.415 17.196 1.00 53.22 H new ATOM 1893 N VAL A 132 16.190 19.109 15.444 1.00 22.24 N ATOM 1894 CA VAL A 132 17.105 18.380 16.317 1.00 51.15 C ATOM 1895 C VAL A 132 18.512 18.962 16.197 1.00 30.12 C ATOM 1896 O VAL A 132 19.049 19.089 15.093 1.00 33.10 O ATOM 1897 CB VAL A 132 17.131 16.863 15.984 1.00 54.43 C ATOM 1898 CG1 VAL A 132 18.116 16.121 16.888 1.00 31.31 C ATOM 1899 CG2 VAL A 132 15.727 16.258 16.099 1.00 70.22 C ATOM 0 H VAL A 132 16.221 18.815 14.468 1.00 22.24 H new ATOM 0 HA VAL A 132 16.748 18.490 17.341 1.00 51.15 H new ATOM 0 HB VAL A 132 17.468 16.750 14.954 1.00 54.43 H new ATOM 0 HG11 VAL A 132 18.115 15.061 16.634 1.00 31.31 H new ATOM 0 HG12 VAL A 132 19.117 16.527 16.746 1.00 31.31 H new ATOM 0 HG13 VAL A 132 17.819 16.245 17.929 1.00 31.31 H new ATOM 0 HG21 VAL A 132 15.768 15.195 15.862 1.00 70.22 H new ATOM 0 HG22 VAL A 132 15.357 16.389 17.116 1.00 70.22 H new ATOM 0 HG23 VAL A 132 15.056 16.760 15.401 1.00 70.22 H new ATOM 1909 N ALA A 133 19.093 19.327 17.335 1.00 44.32 N ATOM 1910 CA ALA A 133 20.402 19.969 17.365 1.00 45.42 C ATOM 1911 C ALA A 133 21.516 18.970 17.097 1.00 30.31 C ATOM 1912 O ALA A 133 21.961 18.249 17.994 1.00 14.22 O ATOM 1913 CB ALA A 133 20.623 20.680 18.699 1.00 22.23 C ATOM 0 H ALA A 133 18.674 19.188 18.255 1.00 44.32 H new ATOM 0 HA ALA A 133 20.426 20.713 16.569 1.00 45.42 H new ATOM 0 HB1 ALA A 133 21.605 21.152 18.701 1.00 22.23 H new ATOM 0 HB2 ALA A 133 19.854 21.440 18.838 1.00 22.23 H new ATOM 0 HB3 ALA A 133 20.567 19.955 19.511 1.00 22.23 H new ATOM 1919 N VAL A 134 21.941 18.916 15.844 1.00 55.21 N ATOM 1920 CA VAL A 134 23.061 18.088 15.447 1.00 14.23 C ATOM 1921 C VAL A 134 24.205 18.965 14.942 1.00 75.02 C ATOM 1922 O VAL A 134 24.112 19.576 13.874 1.00 44.45 O ATOM 1923 CB VAL A 134 22.666 17.072 14.349 1.00 13.33 C ATOM 1924 CG1 VAL A 134 23.861 16.195 13.997 1.00 2.32 C ATOM 1925 CG2 VAL A 134 21.475 16.222 14.793 1.00 40.12 C ATOM 0 H VAL A 134 21.519 19.444 15.080 1.00 55.21 H new ATOM 0 HA VAL A 134 23.381 17.527 16.325 1.00 14.23 H new ATOM 0 HB VAL A 134 22.364 17.622 13.458 1.00 13.33 H new ATOM 0 HG11 VAL A 134 23.574 15.483 13.223 1.00 2.32 H new ATOM 0 HG12 VAL A 134 24.676 16.820 13.631 1.00 2.32 H new ATOM 0 HG13 VAL A 134 24.189 15.654 14.885 1.00 2.32 H new ATOM 0 HG21 VAL A 134 21.217 15.516 14.003 1.00 40.12 H new ATOM 0 HG22 VAL A 134 21.736 15.674 15.698 1.00 40.12 H new ATOM 0 HG23 VAL A 134 20.621 16.869 14.994 1.00 40.12 H new ATOM 1935 N ARG A 135 25.271 19.036 15.728 1.00 5.32 N ATOM 1936 CA ARG A 135 26.448 19.813 15.373 1.00 35.41 C ATOM 1937 C ARG A 135 27.209 19.108 14.260 1.00 62.34 C ATOM 1938 O ARG A 135 27.943 18.151 14.517 1.00 24.24 O ATOM 1939 CB ARG A 135 27.376 19.977 16.588 1.00 72.41 C ATOM 1940 CG ARG A 135 26.661 20.334 17.883 1.00 24.53 C ATOM 1941 CD ARG A 135 25.992 21.697 17.824 1.00 72.30 C ATOM 1942 NE ARG A 135 25.255 21.966 19.055 1.00 54.11 N ATOM 1943 CZ ARG A 135 24.894 23.174 19.479 1.00 2.05 C ATOM 1944 NH1 ARG A 135 25.195 24.261 18.777 1.00 12.22 N1+ ATOM 1945 NH2 ARG A 135 24.224 23.285 20.613 1.00 32.21 N ATOM 0 H ARG A 135 25.343 18.558 16.626 1.00 5.32 H new ATOM 0 HA ARG A 135 26.123 20.798 15.038 1.00 35.41 H new ATOM 0 HB2 ARG A 135 27.928 19.049 16.736 1.00 72.41 H new ATOM 0 HB3 ARG A 135 28.110 20.752 16.367 1.00 72.41 H new ATOM 0 HG2 ARG A 135 25.911 19.574 18.101 1.00 24.53 H new ATOM 0 HG3 ARG A 135 27.377 20.320 18.705 1.00 24.53 H new ATOM 0 HD2 ARG A 135 26.745 22.470 17.669 1.00 72.30 H new ATOM 0 HD3 ARG A 135 25.313 21.737 16.972 1.00 72.30 H new ATOM 0 HE ARG A 135 24.997 21.167 19.634 1.00 54.11 H new ATOM 0 HH11 ARG A 135 25.709 24.176 17.900 1.00 12.22 H new ATOM 0 HH12 ARG A 135 24.912 25.181 19.115 1.00 12.22 H new ATOM 0 HH21 ARG A 135 23.990 22.451 21.151 1.00 32.21 H new ATOM 0 HH22 ARG A 135 23.941 24.205 20.950 1.00 32.21 H new ATOM 1959 N LEU A 136 27.005 19.541 13.027 1.00 14.32 N ATOM 1960 CA LEU A 136 27.753 18.994 11.914 1.00 2.32 C ATOM 1961 C LEU A 136 29.170 19.535 11.928 1.00 50.04 C ATOM 1962 O LEU A 136 29.432 20.667 11.518 1.00 1.31 O ATOM 1963 CB LEU A 136 27.053 19.286 10.586 1.00 33.50 C ATOM 1964 CG LEU A 136 25.769 18.478 10.369 1.00 40.54 C ATOM 1965 CD1 LEU A 136 25.148 18.790 9.008 1.00 3.54 C ATOM 1966 CD2 LEU A 136 26.061 16.982 10.511 1.00 32.41 C ATOM 0 H LEU A 136 26.332 20.265 12.775 1.00 14.32 H new ATOM 0 HA LEU A 136 27.800 17.910 12.020 1.00 2.32 H new ATOM 0 HB2 LEU A 136 26.814 20.348 10.539 1.00 33.50 H new ATOM 0 HB3 LEU A 136 27.744 19.078 9.769 1.00 33.50 H new ATOM 0 HG LEU A 136 25.045 18.764 11.132 1.00 40.54 H new ATOM 0 HD11 LEU A 136 24.238 18.203 8.880 1.00 3.54 H new ATOM 0 HD12 LEU A 136 24.906 19.851 8.953 1.00 3.54 H new ATOM 0 HD13 LEU A 136 25.856 18.538 8.219 1.00 3.54 H new ATOM 0 HD21 LEU A 136 25.143 16.416 10.355 1.00 32.41 H new ATOM 0 HD22 LEU A 136 26.802 16.684 9.769 1.00 32.41 H new ATOM 0 HD23 LEU A 136 26.447 16.780 11.510 1.00 32.41 H new ATOM 1978 N VAL A 137 30.070 18.712 12.431 1.00 24.14 N ATOM 1979 CA VAL A 137 31.473 19.063 12.546 1.00 11.21 C ATOM 1980 C VAL A 137 32.286 18.252 11.548 1.00 22.22 C ATOM 1981 O VAL A 137 32.406 17.031 11.658 1.00 60.11 O ATOM 1982 CB VAL A 137 31.997 18.857 13.998 1.00 74.42 C ATOM 1983 CG1 VAL A 137 31.287 17.688 14.678 1.00 2.12 C ATOM 1984 CG2 VAL A 137 33.514 18.650 14.007 1.00 51.44 C ATOM 0 H VAL A 137 29.848 17.777 12.773 1.00 24.14 H new ATOM 0 HA VAL A 137 31.585 20.122 12.316 1.00 11.21 H new ATOM 0 HB VAL A 137 31.774 19.761 14.564 1.00 74.42 H new ATOM 0 HG11 VAL A 137 31.673 17.567 15.690 1.00 2.12 H new ATOM 0 HG12 VAL A 137 30.216 17.887 14.719 1.00 2.12 H new ATOM 0 HG13 VAL A 137 31.465 16.774 14.111 1.00 2.12 H new ATOM 0 HG21 VAL A 137 33.856 18.508 15.032 1.00 51.44 H new ATOM 0 HG22 VAL A 137 33.765 17.769 13.416 1.00 51.44 H new ATOM 0 HG23 VAL A 137 34.003 19.525 13.579 1.00 51.44 H new ATOM 1994 N VAL A 138 32.822 18.941 10.555 1.00 43.23 N ATOM 1995 CA VAL A 138 33.562 18.299 9.485 1.00 53.11 C ATOM 1996 C VAL A 138 35.058 18.356 9.775 1.00 13.33 C ATOM 1997 O VAL A 138 35.579 19.362 10.269 1.00 44.02 O ATOM 1998 CB VAL A 138 33.268 18.931 8.106 1.00 15.42 C ATOM 1999 CG1 VAL A 138 31.768 19.100 7.893 1.00 20.25 C ATOM 2000 CG2 VAL A 138 34.007 20.248 7.955 1.00 13.44 C ATOM 0 H VAL A 138 32.757 19.955 10.469 1.00 43.23 H new ATOM 0 HA VAL A 138 33.234 17.260 9.444 1.00 53.11 H new ATOM 0 HB VAL A 138 33.632 18.256 7.332 1.00 15.42 H new ATOM 0 HG11 VAL A 138 31.587 19.547 6.915 1.00 20.25 H new ATOM 0 HG12 VAL A 138 31.281 18.126 7.942 1.00 20.25 H new ATOM 0 HG13 VAL A 138 31.361 19.748 8.669 1.00 20.25 H new ATOM 0 HG21 VAL A 138 33.788 20.678 6.978 1.00 13.44 H new ATOM 0 HG22 VAL A 138 33.685 20.937 8.736 1.00 13.44 H new ATOM 0 HG23 VAL A 138 35.080 20.076 8.043 1.00 13.44 H new ATOM 2010 N ALA A 139 35.724 17.261 9.494 1.00 53.03 N ATOM 2011 CA ALA A 139 37.146 17.106 9.789 1.00 12.31 C ATOM 2012 C ALA A 139 37.964 17.110 8.501 1.00 73.13 C ATOM 2013 O ALA A 139 37.448 16.776 7.431 1.00 43.50 O ATOM 2014 CB ALA A 139 37.383 15.817 10.571 1.00 22.50 C ATOM 0 H ALA A 139 35.302 16.444 9.053 1.00 53.03 H new ATOM 0 HA ALA A 139 37.469 17.949 10.400 1.00 12.31 H new ATOM 0 HB1 ALA A 139 38.447 15.712 10.785 1.00 22.50 H new ATOM 0 HB2 ALA A 139 36.826 15.852 11.507 1.00 22.50 H new ATOM 0 HB3 ALA A 139 37.046 14.966 9.980 1.00 22.50 H new ATOM 2021 N MET B 1 26.329 22.981 24.118 1.00 72.34 N ATOM 2022 CA MET B 1 25.423 23.539 25.117 1.00 63.32 C ATOM 2023 C MET B 1 25.748 22.982 26.507 1.00 71.35 C ATOM 2024 O MET B 1 26.762 22.304 26.689 1.00 2.40 O ATOM 2025 CB MET B 1 23.974 23.207 24.763 1.00 41.04 C ATOM 2026 CG MET B 1 23.665 21.738 24.925 1.00 5.33 C ATOM 2027 SD MET B 1 21.917 21.353 24.736 1.00 24.33 S ATOM 2028 CE MET B 1 21.881 19.732 25.495 1.00 72.42 C ATOM 0 H1 MET B 1 26.847 23.752 23.650 1.00 72.34 H new ATOM 0 H2 MET B 1 27.005 22.341 24.581 1.00 72.34 H new ATOM 0 H3 MET B 1 25.781 22.452 23.409 1.00 72.34 H new ATOM 0 HA MET B 1 25.553 24.621 25.127 1.00 63.32 H new ATOM 0 HB2 MET B 1 23.305 23.788 25.398 1.00 41.04 H new ATOM 0 HB3 MET B 1 23.777 23.506 23.734 1.00 41.04 H new ATOM 0 HG2 MET B 1 24.236 21.171 24.190 1.00 5.33 H new ATOM 0 HG3 MET B 1 23.998 21.410 25.910 1.00 5.33 H new ATOM 0 HE1 MET B 1 20.852 19.468 25.740 1.00 72.42 H new ATOM 0 HE2 MET B 1 22.289 18.997 24.802 1.00 72.42 H new ATOM 0 HE3 MET B 1 22.479 19.743 26.406 1.00 72.42 H new ATOM 2038 N ASN B 2 24.876 23.260 27.478 1.00 33.33 N ATOM 2039 CA ASN B 2 25.031 22.735 28.838 1.00 51.30 C ATOM 2040 C ASN B 2 24.727 21.232 28.878 1.00 60.31 C ATOM 2041 O ASN B 2 23.650 20.809 29.296 1.00 61.35 O ATOM 2042 CB ASN B 2 24.114 23.484 29.821 1.00 21.53 C ATOM 2043 CG ASN B 2 24.280 23.007 31.259 1.00 32.42 C ATOM 2044 OD1 ASN B 2 25.367 22.601 31.673 1.00 51.33 O ATOM 2045 ND2 ASN B 2 23.202 23.042 32.029 1.00 42.33 N ATOM 0 H ASN B 2 24.052 23.847 27.348 1.00 33.33 H new ATOM 0 HA ASN B 2 26.067 22.890 29.140 1.00 51.30 H new ATOM 0 HB2 ASN B 2 24.328 24.552 29.770 1.00 21.53 H new ATOM 0 HB3 ASN B 2 23.076 23.352 29.516 1.00 21.53 H new ATOM 0 HD21 ASN B 2 23.257 22.727 32.997 1.00 42.33 H new ATOM 0 HD22 ASN B 2 22.318 23.384 31.653 1.00 42.33 H new ATOM 2052 N ILE B 3 25.664 20.444 28.374 1.00 21.23 N ATOM 2053 CA ILE B 3 25.580 18.991 28.414 1.00 72.42 C ATOM 2054 C ILE B 3 25.848 18.449 29.818 1.00 64.03 C ATOM 2055 O ILE B 3 26.784 18.881 30.495 1.00 40.30 O ATOM 2056 CB ILE B 3 26.598 18.372 27.429 1.00 60.30 C ATOM 2057 CG1 ILE B 3 26.296 18.847 26.001 1.00 50.54 C ATOM 2058 CG2 ILE B 3 26.580 16.848 27.508 1.00 62.10 C ATOM 2059 CD1 ILE B 3 25.002 18.296 25.443 1.00 13.01 C ATOM 0 H ILE B 3 26.509 20.796 27.923 1.00 21.23 H new ATOM 0 HA ILE B 3 24.566 18.715 28.125 1.00 72.42 H new ATOM 0 HB ILE B 3 27.598 18.705 27.707 1.00 60.30 H new ATOM 0 HG12 ILE B 3 26.253 19.936 25.990 1.00 50.54 H new ATOM 0 HG13 ILE B 3 27.118 18.554 25.348 1.00 50.54 H new ATOM 0 HG21 ILE B 3 27.305 16.439 26.805 1.00 62.10 H new ATOM 0 HG22 ILE B 3 26.837 16.533 28.519 1.00 62.10 H new ATOM 0 HG23 ILE B 3 25.584 16.482 27.256 1.00 62.10 H new ATOM 0 HD11 ILE B 3 24.852 18.673 24.431 1.00 13.01 H new ATOM 0 HD12 ILE B 3 25.049 17.207 25.421 1.00 13.01 H new ATOM 0 HD13 ILE B 3 24.171 18.610 26.074 1.00 13.01 H new ATOM 2071 N LEU B 4 25.015 17.504 30.241 1.00 23.11 N ATOM 2072 CA LEU B 4 25.201 16.797 31.507 1.00 23.43 C ATOM 2073 C LEU B 4 25.938 15.481 31.270 1.00 41.14 C ATOM 2074 O LEU B 4 26.886 15.146 31.985 1.00 62.34 O ATOM 2075 CB LEU B 4 23.848 16.511 32.175 1.00 50.44 C ATOM 2076 CG LEU B 4 22.980 17.742 32.466 1.00 31.23 C ATOM 2077 CD1 LEU B 4 21.657 17.324 33.099 1.00 75.25 C ATOM 2078 CD2 LEU B 4 23.718 18.738 33.362 1.00 11.04 C ATOM 0 H LEU B 4 24.192 17.205 29.718 1.00 23.11 H new ATOM 0 HA LEU B 4 25.792 17.432 32.167 1.00 23.43 H new ATOM 0 HB2 LEU B 4 23.283 15.833 31.535 1.00 50.44 H new ATOM 0 HB3 LEU B 4 24.030 15.987 33.113 1.00 50.44 H new ATOM 0 HG LEU B 4 22.769 18.239 31.519 1.00 31.23 H new ATOM 0 HD11 LEU B 4 21.054 18.209 33.299 1.00 75.25 H new ATOM 0 HD12 LEU B 4 21.120 16.665 32.417 1.00 75.25 H new ATOM 0 HD13 LEU B 4 21.851 16.798 34.034 1.00 75.25 H new ATOM 0 HD21 LEU B 4 23.079 19.600 33.551 1.00 11.04 H new ATOM 0 HD22 LEU B 4 23.970 18.259 34.308 1.00 11.04 H new ATOM 0 HD23 LEU B 4 24.632 19.066 32.866 1.00 11.04 H new ATOM 2090 N TYR B 5 25.499 14.742 30.253 1.00 23.42 N ATOM 2091 CA TYR B 5 26.087 13.442 29.931 1.00 44.15 C ATOM 2092 C TYR B 5 26.376 13.371 28.438 1.00 24.15 C ATOM 2093 O TYR B 5 25.515 13.688 27.625 1.00 75.34 O ATOM 2094 CB TYR B 5 25.133 12.306 30.341 1.00 21.21 C ATOM 2095 CG TYR B 5 25.686 10.907 30.109 1.00 10.12 C ATOM 2096 CD1 TYR B 5 25.721 10.346 28.834 1.00 52.12 C ATOM 2097 CD2 TYR B 5 26.178 10.149 31.166 1.00 71.12 C ATOM 2098 CE1 TYR B 5 26.229 9.079 28.623 1.00 75.45 C ATOM 2099 CE2 TYR B 5 26.686 8.878 30.960 1.00 10.31 C ATOM 2100 CZ TYR B 5 26.713 8.349 29.687 1.00 52.51 C ATOM 2101 OH TYR B 5 27.225 7.087 29.476 1.00 25.44 O ATOM 0 H TYR B 5 24.736 15.022 29.636 1.00 23.42 H new ATOM 0 HA TYR B 5 27.019 13.325 30.484 1.00 44.15 H new ATOM 0 HB2 TYR B 5 24.889 12.416 31.398 1.00 21.21 H new ATOM 0 HB3 TYR B 5 24.201 12.412 29.786 1.00 21.21 H new ATOM 0 HD1 TYR B 5 25.344 10.912 27.995 1.00 52.12 H new ATOM 0 HD2 TYR B 5 26.163 10.559 32.165 1.00 71.12 H new ATOM 0 HE1 TYR B 5 26.247 8.662 27.627 1.00 75.45 H new ATOM 0 HE2 TYR B 5 27.060 8.302 31.794 1.00 10.31 H new ATOM 0 HH TYR B 5 27.525 6.709 30.329 1.00 25.44 H new ATOM 2111 N LYS B 6 27.585 12.972 28.082 1.00 30.03 N ATOM 2112 CA LYS B 6 27.961 12.819 26.680 1.00 63.12 C ATOM 2113 C LYS B 6 28.767 11.538 26.462 1.00 12.41 C ATOM 2114 O LYS B 6 29.677 11.219 27.234 1.00 54.02 O ATOM 2115 CB LYS B 6 28.756 14.042 26.202 1.00 22.40 C ATOM 2116 CG LYS B 6 29.221 13.949 24.751 1.00 43.31 C ATOM 2117 CD LYS B 6 29.839 15.257 24.258 1.00 65.01 C ATOM 2118 CE LYS B 6 28.808 16.374 24.130 1.00 23.11 C ATOM 2119 NZ LYS B 6 29.408 17.625 23.588 1.00 52.41 N1+ ATOM 0 H LYS B 6 28.328 12.747 28.744 1.00 30.03 H new ATOM 0 HA LYS B 6 27.046 12.745 26.092 1.00 63.12 H new ATOM 0 HB2 LYS B 6 28.139 14.933 26.319 1.00 22.40 H new ATOM 0 HB3 LYS B 6 29.627 14.171 26.845 1.00 22.40 H new ATOM 0 HG2 LYS B 6 29.951 13.146 24.656 1.00 43.31 H new ATOM 0 HG3 LYS B 6 28.375 13.687 24.116 1.00 43.31 H new ATOM 0 HD2 LYS B 6 30.624 15.568 24.948 1.00 65.01 H new ATOM 0 HD3 LYS B 6 30.312 15.090 23.290 1.00 65.01 H new ATOM 0 HE2 LYS B 6 27.998 16.047 23.477 1.00 23.11 H new ATOM 0 HE3 LYS B 6 28.368 16.576 25.107 1.00 23.11 H new ATOM 0 HZ1 LYS B 6 28.660 18.332 23.437 1.00 52.41 H new ATOM 0 HZ2 LYS B 6 30.105 17.997 24.265 1.00 52.41 H new ATOM 0 HZ3 LYS B 6 29.879 17.421 22.684 1.00 52.41 H new ATOM 2133 N THR B 7 28.421 10.816 25.404 1.00 10.14 N ATOM 2134 CA THR B 7 29.106 9.586 25.027 1.00 42.05 C ATOM 2135 C THR B 7 29.363 9.593 23.521 1.00 63.52 C ATOM 2136 O THR B 7 28.532 10.074 22.744 1.00 72.52 O ATOM 2137 CB THR B 7 28.283 8.333 25.433 1.00 0.35 C ATOM 2138 OG1 THR B 7 28.931 7.136 24.983 1.00 0.11 O ATOM 2139 CG2 THR B 7 26.864 8.387 24.873 1.00 24.11 C ATOM 0 H THR B 7 27.654 11.068 24.780 1.00 10.14 H new ATOM 0 HA THR B 7 30.056 9.538 25.559 1.00 42.05 H new ATOM 0 HB THR B 7 28.223 8.325 26.521 1.00 0.35 H new ATOM 0 HG1 THR B 7 29.901 7.233 25.080 1.00 0.11 H new ATOM 0 HG21 THR B 7 26.318 7.494 25.178 1.00 24.11 H new ATOM 0 HG22 THR B 7 26.355 9.271 25.256 1.00 24.11 H new ATOM 0 HG23 THR B 7 26.904 8.434 23.785 1.00 24.11 H new ATOM 2147 N ALA B 8 30.516 9.078 23.112 1.00 4.15 N ATOM 2148 CA ALA B 8 30.929 9.139 21.713 1.00 51.31 C ATOM 2149 C ALA B 8 30.874 7.765 21.061 1.00 33.43 C ATOM 2150 O ALA B 8 31.001 6.737 21.734 1.00 64.22 O ATOM 2151 CB ALA B 8 32.336 9.717 21.607 1.00 24.44 C ATOM 0 H ALA B 8 31.183 8.613 23.728 1.00 4.15 H new ATOM 0 HA ALA B 8 30.234 9.790 21.183 1.00 51.31 H new ATOM 0 HB1 ALA B 8 32.634 9.758 20.559 1.00 24.44 H new ATOM 0 HB2 ALA B 8 32.349 10.722 22.028 1.00 24.44 H new ATOM 0 HB3 ALA B 8 33.032 9.084 22.158 1.00 24.44 H new ATOM 2157 N ALA B 9 30.676 7.750 19.749 1.00 21.22 N ATOM 2158 CA ALA B 9 30.704 6.516 18.978 1.00 20.22 C ATOM 2159 C ALA B 9 31.429 6.732 17.652 1.00 31.45 C ATOM 2160 O ALA B 9 30.996 7.523 16.817 1.00 1.21 O ATOM 2161 CB ALA B 9 29.289 6.000 18.754 1.00 3.15 C ATOM 0 H ALA B 9 30.493 8.586 19.194 1.00 21.22 H new ATOM 0 HA ALA B 9 31.253 5.762 19.541 1.00 20.22 H new ATOM 0 HB1 ALA B 9 29.326 5.077 18.176 1.00 3.15 H new ATOM 0 HB2 ALA B 9 28.815 5.807 19.717 1.00 3.15 H new ATOM 0 HB3 ALA B 9 28.712 6.747 18.209 1.00 3.15 H new ATOM 2167 N THR B 10 32.540 6.029 17.481 1.00 33.23 N ATOM 2168 CA THR B 10 33.359 6.127 16.281 1.00 64.31 C ATOM 2169 C THR B 10 32.977 5.026 15.292 1.00 63.33 C ATOM 2170 O THR B 10 32.994 3.847 15.641 1.00 30.04 O ATOM 2171 CB THR B 10 34.857 5.998 16.643 1.00 62.43 C ATOM 2172 OG1 THR B 10 35.188 6.929 17.688 1.00 21.44 O ATOM 2173 CG2 THR B 10 35.746 6.253 15.428 1.00 23.24 C ATOM 0 H THR B 10 32.900 5.372 18.173 1.00 33.23 H new ATOM 0 HA THR B 10 33.184 7.100 15.822 1.00 64.31 H new ATOM 0 HB THR B 10 35.034 4.979 16.987 1.00 62.43 H new ATOM 0 HG1 THR B 10 35.986 7.437 17.433 1.00 21.44 H new ATOM 0 HG21 THR B 10 36.793 6.155 15.716 1.00 23.24 H new ATOM 0 HG22 THR B 10 35.514 5.527 14.649 1.00 23.24 H new ATOM 0 HG23 THR B 10 35.566 7.260 15.051 1.00 23.24 H new ATOM 2181 N SER B 11 32.625 5.404 14.069 1.00 64.42 N ATOM 2182 CA SER B 11 32.200 4.436 13.064 1.00 20.54 C ATOM 2183 C SER B 11 32.923 4.652 11.735 1.00 44.42 C ATOM 2184 O SER B 11 32.769 5.694 11.101 1.00 74.01 O ATOM 2185 CB SER B 11 30.684 4.532 12.863 1.00 74.14 C ATOM 2186 OG SER B 11 30.299 5.853 12.527 1.00 11.25 O ATOM 0 H SER B 11 32.625 6.373 13.749 1.00 64.42 H new ATOM 0 HA SER B 11 32.458 3.439 13.422 1.00 20.54 H new ATOM 0 HB2 SER B 11 30.374 3.847 12.074 1.00 74.14 H new ATOM 0 HB3 SER B 11 30.172 4.221 13.774 1.00 74.14 H new ATOM 0 HG SER B 11 31.033 6.297 12.053 1.00 11.25 H new ATOM 2192 N THR B 12 33.722 3.670 11.328 1.00 44.31 N ATOM 2193 CA THR B 12 34.409 3.708 10.042 1.00 14.13 C ATOM 2194 C THR B 12 33.588 2.970 8.993 1.00 53.42 C ATOM 2195 O THR B 12 32.762 2.120 9.327 1.00 32.44 O ATOM 2196 CB THR B 12 35.792 3.035 10.138 1.00 2.30 C ATOM 2197 OG1 THR B 12 36.490 3.512 11.297 1.00 14.42 O ATOM 2198 CG2 THR B 12 36.636 3.302 8.898 1.00 31.31 C ATOM 0 H THR B 12 33.910 2.831 11.877 1.00 44.31 H new ATOM 0 HA THR B 12 34.533 4.754 9.760 1.00 14.13 H new ATOM 0 HB THR B 12 35.629 1.960 10.216 1.00 2.30 H new ATOM 0 HG1 THR B 12 36.824 4.418 11.128 1.00 14.42 H new ATOM 0 HG21 THR B 12 37.603 2.811 9.004 1.00 31.31 H new ATOM 0 HG22 THR B 12 36.125 2.911 8.019 1.00 31.31 H new ATOM 0 HG23 THR B 12 36.785 4.376 8.783 1.00 31.31 H new ATOM 2206 N GLY B 13 33.826 3.277 7.730 1.00 25.11 N ATOM 2207 CA GLY B 13 33.139 2.591 6.656 1.00 71.12 C ATOM 2208 C GLY B 13 33.888 1.352 6.211 1.00 70.11 C ATOM 2209 O GLY B 13 34.273 1.248 5.048 1.00 42.34 O ATOM 0 H GLY B 13 34.486 3.993 7.426 1.00 25.11 H new ATOM 0 HA2 GLY B 13 32.138 2.312 6.984 1.00 71.12 H new ATOM 0 HA3 GLY B 13 33.020 3.268 5.810 1.00 71.12 H new ATOM 2213 N GLY B 14 34.087 0.416 7.152 1.00 21.54 N ATOM 2214 CA GLY B 14 34.836 -0.811 6.880 1.00 31.21 C ATOM 2215 C GLY B 14 34.406 -1.493 5.595 1.00 73.40 C ATOM 2216 O GLY B 14 34.989 -1.254 4.537 1.00 13.01 O ATOM 0 H GLY B 14 33.737 0.490 8.107 1.00 21.54 H new ATOM 0 HA2 GLY B 14 35.899 -0.577 6.823 1.00 31.21 H new ATOM 0 HA3 GLY B 14 34.706 -1.502 7.713 1.00 31.21 H new ATOM 2220 N ARG B 15 33.407 -2.366 5.676 1.00 12.42 N ATOM 2221 CA ARG B 15 32.817 -2.924 4.466 1.00 62.32 C ATOM 2222 C ARG B 15 31.686 -2.019 4.004 1.00 53.41 C ATOM 2223 O ARG B 15 31.682 -1.535 2.864 1.00 34.04 O ATOM 2224 CB ARG B 15 32.297 -4.349 4.730 1.00 22.32 C ATOM 2225 CG ARG B 15 31.442 -4.935 3.603 1.00 23.03 C ATOM 2226 CD ARG B 15 32.113 -4.824 2.234 1.00 52.22 C ATOM 2227 NE ARG B 15 33.459 -5.394 2.224 1.00 65.14 N ATOM 2228 CZ ARG B 15 34.129 -5.713 1.117 1.00 55.23 C ATOM 2229 NH1 ARG B 15 33.577 -5.542 -0.082 1.00 21.14 N1+ ATOM 2230 NH2 ARG B 15 35.357 -6.204 1.215 1.00 51.30 N ATOM 0 H ARG B 15 32.996 -2.697 6.549 1.00 12.42 H new ATOM 0 HA ARG B 15 33.575 -2.983 3.685 1.00 62.32 H new ATOM 0 HB2 ARG B 15 33.149 -5.007 4.901 1.00 22.32 H new ATOM 0 HB3 ARG B 15 31.710 -4.343 5.648 1.00 22.32 H new ATOM 0 HG2 ARG B 15 31.235 -5.983 3.817 1.00 23.03 H new ATOM 0 HG3 ARG B 15 30.482 -4.420 3.575 1.00 23.03 H new ATOM 0 HD2 ARG B 15 31.500 -5.333 1.490 1.00 52.22 H new ATOM 0 HD3 ARG B 15 32.164 -3.775 1.941 1.00 52.22 H new ATOM 0 HE ARG B 15 33.915 -5.558 3.122 1.00 65.14 H new ATOM 0 HH11 ARG B 15 32.633 -5.164 -0.160 1.00 21.14 H new ATOM 0 HH12 ARG B 15 34.098 -5.789 -0.923 1.00 21.14 H new ATOM 0 HH21 ARG B 15 35.782 -6.335 2.133 1.00 51.30 H new ATOM 0 HH22 ARG B 15 35.876 -6.451 0.372 1.00 51.30 H new ATOM 2244 N ASP B 16 30.725 -1.784 4.885 1.00 43.23 N ATOM 2245 CA ASP B 16 29.721 -0.758 4.651 1.00 64.45 C ATOM 2246 C ASP B 16 29.647 0.196 5.840 1.00 45.23 C ATOM 2247 O ASP B 16 29.590 1.411 5.665 1.00 44.01 O ATOM 2248 CB ASP B 16 28.374 -1.404 4.373 1.00 65.33 C ATOM 2249 CG ASP B 16 27.354 -0.430 3.814 1.00 54.31 C ATOM 2250 OD1 ASP B 16 27.695 0.298 2.853 1.00 24.34 O ATOM 2251 OD2 ASP B 16 26.206 -0.417 4.301 1.00 12.23 O1- ATOM 0 H ASP B 16 30.620 -2.288 5.765 1.00 43.23 H new ATOM 0 HA ASP B 16 30.004 -0.173 3.776 1.00 64.45 H new ATOM 0 HB2 ASP B 16 28.509 -2.224 3.668 1.00 65.33 H new ATOM 0 HB3 ASP B 16 27.987 -1.837 5.296 1.00 65.33 H new ATOM 2256 N GLY B 17 29.673 -0.364 7.061 1.00 22.41 N ATOM 2257 CA GLY B 17 29.836 0.460 8.242 1.00 74.22 C ATOM 2258 C GLY B 17 30.295 -0.353 9.436 1.00 32.04 C ATOM 2259 O GLY B 17 29.958 -1.527 9.556 1.00 11.23 O ATOM 0 H GLY B 17 29.584 -1.364 7.242 1.00 22.41 H new ATOM 0 HA2 GLY B 17 30.561 1.248 8.038 1.00 74.22 H new ATOM 0 HA3 GLY B 17 28.891 0.949 8.477 1.00 74.22 H new ATOM 2263 N ARG B 18 31.071 0.267 10.309 1.00 41.41 N ATOM 2264 CA ARG B 18 31.570 -0.382 11.513 1.00 45.30 C ATOM 2265 C ARG B 18 31.475 0.601 12.670 1.00 1.35 C ATOM 2266 O ARG B 18 32.247 1.552 12.735 1.00 0.54 O ATOM 2267 CB ARG B 18 33.022 -0.855 11.292 1.00 74.40 C ATOM 2268 CG ARG B 18 33.631 -1.653 12.452 1.00 53.04 C ATOM 2269 CD ARG B 18 34.255 -0.758 13.522 1.00 43.11 C ATOM 2270 NE ARG B 18 34.833 -1.537 14.621 1.00 64.22 N ATOM 2271 CZ ARG B 18 36.139 -1.622 14.884 1.00 63.34 C ATOM 2272 NH1 ARG B 18 37.018 -0.970 14.133 1.00 23.22 N1+ ATOM 2273 NH2 ARG B 18 36.562 -2.346 15.912 1.00 54.01 N ATOM 0 H ARG B 18 31.374 1.235 10.204 1.00 41.41 H new ATOM 0 HA ARG B 18 30.970 -1.261 11.748 1.00 45.30 H new ATOM 0 HB2 ARG B 18 33.054 -1.470 10.392 1.00 74.40 H new ATOM 0 HB3 ARG B 18 33.647 0.018 11.104 1.00 74.40 H new ATOM 0 HG2 ARG B 18 32.857 -2.271 12.908 1.00 53.04 H new ATOM 0 HG3 ARG B 18 34.391 -2.330 12.062 1.00 53.04 H new ATOM 0 HD2 ARG B 18 35.030 -0.139 13.070 1.00 43.11 H new ATOM 0 HD3 ARG B 18 33.496 -0.082 13.917 1.00 43.11 H new ATOM 0 HE ARG B 18 34.193 -2.050 15.227 1.00 64.22 H new ATOM 0 HH11 ARG B 18 36.697 -0.400 13.350 1.00 23.22 H new ATOM 0 HH12 ARG B 18 38.015 -1.039 14.339 1.00 23.22 H new ATOM 0 HH21 ARG B 18 35.889 -2.837 16.501 1.00 54.01 H new ATOM 0 HH22 ARG B 18 37.560 -2.411 16.114 1.00 54.01 H new ATOM 2287 N ALA B 19 30.519 0.376 13.565 1.00 25.44 N ATOM 2288 CA ALA B 19 30.234 1.321 14.639 1.00 25.14 C ATOM 2289 C ALA B 19 30.791 0.827 15.966 1.00 64.21 C ATOM 2290 O ALA B 19 30.462 -0.267 16.425 1.00 14.23 O ATOM 2291 CB ALA B 19 28.731 1.551 14.751 1.00 63.23 C ATOM 0 H ALA B 19 29.927 -0.455 13.568 1.00 25.44 H new ATOM 0 HA ALA B 19 30.722 2.266 14.398 1.00 25.14 H new ATOM 0 HB1 ALA B 19 28.530 2.258 15.556 1.00 63.23 H new ATOM 0 HB2 ALA B 19 28.354 1.954 13.811 1.00 63.23 H new ATOM 0 HB3 ALA B 19 28.233 0.605 14.966 1.00 63.23 H new ATOM 2297 N THR B 20 31.620 1.650 16.581 1.00 63.15 N ATOM 2298 CA THR B 20 32.188 1.357 17.883 1.00 31.24 C ATOM 2299 C THR B 20 31.893 2.502 18.845 1.00 2.34 C ATOM 2300 O THR B 20 32.394 3.614 18.673 1.00 75.11 O ATOM 2301 CB THR B 20 33.720 1.135 17.781 1.00 15.15 C ATOM 2302 OG1 THR B 20 34.003 0.179 16.747 1.00 53.32 O ATOM 2303 CG2 THR B 20 34.304 0.633 19.101 1.00 14.05 C ATOM 0 H THR B 20 31.919 2.543 16.190 1.00 63.15 H new ATOM 0 HA THR B 20 31.733 0.441 18.259 1.00 31.24 H new ATOM 0 HB THR B 20 34.180 2.094 17.545 1.00 15.15 H new ATOM 0 HG1 THR B 20 33.746 -0.717 17.051 1.00 53.32 H new ATOM 0 HG21 THR B 20 35.379 0.489 18.992 1.00 14.05 H new ATOM 0 HG22 THR B 20 34.114 1.366 19.885 1.00 14.05 H new ATOM 0 HG23 THR B 20 33.836 -0.314 19.369 1.00 14.05 H new ATOM 2311 N SER B 21 31.064 2.239 19.851 1.00 21.31 N ATOM 2312 CA SER B 21 30.799 3.227 20.873 1.00 32.44 C ATOM 2313 C SER B 21 32.099 3.466 21.607 1.00 11.23 C ATOM 2314 O SER B 21 32.554 2.584 22.361 1.00 42.34 O ATOM 2315 CB SER B 21 29.698 2.776 21.836 1.00 31.41 C ATOM 2316 OG SER B 21 29.451 3.751 22.836 1.00 74.21 O ATOM 0 H SER B 21 30.571 1.355 19.974 1.00 21.31 H new ATOM 0 HA SER B 21 30.436 4.147 20.415 1.00 32.44 H new ATOM 0 HB2 SER B 21 28.781 2.585 21.278 1.00 31.41 H new ATOM 0 HB3 SER B 21 29.987 1.836 22.306 1.00 31.41 H new ATOM 0 HG SER B 21 30.213 3.789 23.451 1.00 74.21 H new ATOM 2322 N HIS B 22 32.653 4.665 21.348 1.00 5.04 N ATOM 2323 CA HIS B 22 34.036 5.053 21.648 1.00 32.51 C ATOM 2324 C HIS B 22 34.402 4.827 23.105 1.00 35.24 C ATOM 2325 O HIS B 22 35.576 4.675 23.441 1.00 73.12 O ATOM 2326 CB HIS B 22 34.222 6.536 21.273 1.00 3.43 C ATOM 2327 CG HIS B 22 35.630 7.051 21.366 1.00 12.52 C ATOM 2328 ND1 HIS B 22 36.419 7.281 20.258 1.00 31.42 N ATOM 2329 CD2 HIS B 22 36.375 7.416 22.436 1.00 34.34 C ATOM 2330 CE1 HIS B 22 37.585 7.764 20.645 1.00 23.12 C ATOM 2331 NE2 HIS B 22 37.584 7.856 21.961 1.00 12.42 N ATOM 0 H HIS B 22 32.125 5.417 20.906 1.00 5.04 H new ATOM 0 HA HIS B 22 34.703 4.422 21.061 1.00 32.51 H new ATOM 0 HB2 HIS B 22 33.866 6.683 20.253 1.00 3.43 H new ATOM 0 HB3 HIS B 22 33.588 7.140 21.922 1.00 3.43 H new ATOM 0 HD1 HIS B 22 36.145 7.105 19.291 1.00 31.42 H new ATOM 0 HD2 HIS B 22 36.073 7.369 23.472 1.00 34.34 H new ATOM 0 HE1 HIS B 22 38.402 8.038 19.994 1.00 23.12 H new ATOM 2340 N ASP B 23 33.402 4.784 23.965 1.00 44.12 N ATOM 2341 CA ASP B 23 33.625 4.508 25.381 1.00 0.24 C ATOM 2342 C ASP B 23 33.784 3.006 25.604 1.00 62.21 C ATOM 2343 O ASP B 23 33.648 2.517 26.728 1.00 40.03 O ATOM 2344 CB ASP B 23 32.451 5.040 26.218 1.00 12.04 C ATOM 2345 CG ASP B 23 32.315 6.554 26.169 1.00 5.31 C ATOM 2346 OD1 ASP B 23 31.842 7.084 25.138 1.00 63.54 O ATOM 2347 OD2 ASP B 23 32.667 7.218 27.166 1.00 33.23 O1- ATOM 0 H ASP B 23 32.425 4.936 23.713 1.00 44.12 H new ATOM 0 HA ASP B 23 34.539 5.012 25.695 1.00 0.24 H new ATOM 0 HB2 ASP B 23 31.526 4.587 25.862 1.00 12.04 H new ATOM 0 HB3 ASP B 23 32.581 4.727 27.254 1.00 12.04 H new ATOM 2352 N GLN B 24 34.097 2.282 24.521 1.00 3.35 N ATOM 2353 CA GLN B 24 34.206 0.831 24.548 1.00 64.10 C ATOM 2354 C GLN B 24 32.918 0.219 25.063 1.00 11.02 C ATOM 2355 O GLN B 24 32.899 -0.875 25.625 1.00 0.33 O ATOM 2356 CB GLN B 24 35.434 0.408 25.365 1.00 41.34 C ATOM 2357 CG GLN B 24 36.719 0.943 24.749 1.00 71.43 C ATOM 2358 CD GLN B 24 36.859 0.526 23.289 1.00 54.02 C ATOM 2359 OE1 GLN B 24 36.479 -0.582 22.908 1.00 54.01 O ATOM 2360 NE2 GLN B 24 37.332 1.432 22.449 1.00 4.32 N ATOM 0 H GLN B 24 34.280 2.693 23.606 1.00 3.35 H new ATOM 0 HA GLN B 24 34.353 0.454 23.536 1.00 64.10 H new ATOM 0 HB2 GLN B 24 35.338 0.775 26.387 1.00 41.34 H new ATOM 0 HB3 GLN B 24 35.480 -0.680 25.420 1.00 41.34 H new ATOM 0 HG2 GLN B 24 36.732 2.031 24.820 1.00 71.43 H new ATOM 0 HG3 GLN B 24 37.575 0.577 25.316 1.00 71.43 H new ATOM 0 HE21 GLN B 24 37.638 2.340 22.798 1.00 4.32 H new ATOM 0 HE22 GLN B 24 37.390 1.222 21.452 1.00 4.32 H new ATOM 2369 N LYS B 25 31.828 0.944 24.827 1.00 34.11 N ATOM 2370 CA LYS B 25 30.503 0.470 25.170 1.00 33.22 C ATOM 2371 C LYS B 25 29.987 -0.434 24.066 1.00 40.01 C ATOM 2372 O LYS B 25 29.168 -1.317 24.319 1.00 34.42 O ATOM 2373 CB LYS B 25 29.533 1.644 25.370 1.00 20.21 C ATOM 2374 CG LYS B 25 29.988 2.699 26.382 1.00 22.43 C ATOM 2375 CD LYS B 25 29.778 2.289 27.848 1.00 41.25 C ATOM 2376 CE LYS B 25 30.783 1.245 28.337 1.00 25.52 C ATOM 2377 NZ LYS B 25 30.708 1.054 29.812 1.00 5.33 N1+ ATOM 0 H LYS B 25 31.844 1.868 24.396 1.00 34.11 H new ATOM 0 HA LYS B 25 30.567 -0.086 26.105 1.00 33.22 H new ATOM 0 HB2 LYS B 25 29.374 2.131 24.408 1.00 20.21 H new ATOM 0 HB3 LYS B 25 28.569 1.248 25.690 1.00 20.21 H new ATOM 0 HG2 LYS B 25 31.046 2.909 26.222 1.00 22.43 H new ATOM 0 HG3 LYS B 25 29.447 3.626 26.193 1.00 22.43 H new ATOM 0 HD2 LYS B 25 29.850 3.175 28.479 1.00 41.25 H new ATOM 0 HD3 LYS B 25 28.769 1.894 27.966 1.00 41.25 H new ATOM 0 HE2 LYS B 25 30.593 0.295 27.837 1.00 25.52 H new ATOM 0 HE3 LYS B 25 31.791 1.554 28.061 1.00 25.52 H new ATOM 0 HZ1 LYS B 25 31.404 0.339 30.105 1.00 5.33 H new ATOM 0 HZ2 LYS B 25 30.914 1.955 30.290 1.00 5.33 H new ATOM 0 HZ3 LYS B 25 29.753 0.735 30.073 1.00 5.33 H new ATOM 2391 N LEU B 26 30.458 -0.218 22.829 1.00 71.52 N ATOM 2392 CA LEU B 26 29.971 -1.034 21.714 1.00 40.15 C ATOM 2393 C LEU B 26 31.026 -1.180 20.631 1.00 62.33 C ATOM 2394 O LEU B 26 31.812 -0.268 20.415 1.00 50.50 O ATOM 2395 CB LEU B 26 28.698 -0.397 21.136 1.00 64.14 C ATOM 2396 CG LEU B 26 28.171 -1.002 19.827 1.00 70.42 C ATOM 2397 CD1 LEU B 26 27.697 -2.438 20.033 1.00 23.12 C ATOM 2398 CD2 LEU B 26 27.057 -0.128 19.263 1.00 31.22 C ATOM 0 H LEU B 26 31.151 0.489 22.583 1.00 71.52 H new ATOM 0 HA LEU B 26 29.745 -2.032 22.088 1.00 40.15 H new ATOM 0 HB2 LEU B 26 27.910 -0.465 21.886 1.00 64.14 H new ATOM 0 HB3 LEU B 26 28.890 0.663 20.970 1.00 64.14 H new ATOM 0 HG LEU B 26 28.987 -1.033 19.105 1.00 70.42 H new ATOM 0 HD11 LEU B 26 27.330 -2.839 19.088 1.00 23.12 H new ATOM 0 HD12 LEU B 26 28.528 -3.048 20.388 1.00 23.12 H new ATOM 0 HD13 LEU B 26 26.895 -2.454 20.770 1.00 23.12 H new ATOM 0 HD21 LEU B 26 26.688 -0.563 18.334 1.00 31.22 H new ATOM 0 HD22 LEU B 26 26.242 -0.067 19.984 1.00 31.22 H new ATOM 0 HD23 LEU B 26 27.443 0.872 19.067 1.00 31.22 H new ATOM 2410 N ASP B 27 31.035 -2.331 19.962 1.00 22.45 N ATOM 2411 CA ASP B 27 31.890 -2.547 18.796 1.00 53.33 C ATOM 2412 C ASP B 27 31.246 -3.575 17.861 1.00 42.15 C ATOM 2413 O ASP B 27 31.310 -4.783 18.102 1.00 22.10 O ATOM 2414 CB ASP B 27 33.299 -3.004 19.219 1.00 24.13 C ATOM 2415 CG ASP B 27 34.292 -3.079 18.059 1.00 15.20 C ATOM 2416 OD1 ASP B 27 35.491 -3.325 18.315 1.00 3.40 O ATOM 2417 OD2 ASP B 27 33.897 -2.877 16.892 1.00 21.30 O1- ATOM 0 H ASP B 27 30.456 -3.133 20.209 1.00 22.45 H new ATOM 0 HA ASP B 27 31.995 -1.602 18.264 1.00 53.33 H new ATOM 0 HB2 ASP B 27 33.684 -2.316 19.972 1.00 24.13 H new ATOM 0 HB3 ASP B 27 33.228 -3.985 19.689 1.00 24.13 H new ATOM 2422 N VAL B 28 30.600 -3.071 16.812 1.00 42.42 N ATOM 2423 CA VAL B 28 29.942 -3.911 15.802 1.00 61.03 C ATOM 2424 C VAL B 28 30.062 -3.310 14.405 1.00 62.05 C ATOM 2425 O VAL B 28 30.638 -2.238 14.216 1.00 71.42 O ATOM 2426 CB VAL B 28 28.440 -4.148 16.102 1.00 35.33 C ATOM 2427 CG1 VAL B 28 28.266 -5.189 17.196 1.00 44.41 C ATOM 2428 CG2 VAL B 28 27.741 -2.839 16.467 1.00 74.12 C ATOM 0 H VAL B 28 30.515 -2.070 16.634 1.00 42.42 H new ATOM 0 HA VAL B 28 30.463 -4.868 15.843 1.00 61.03 H new ATOM 0 HB VAL B 28 27.970 -4.532 15.197 1.00 35.33 H new ATOM 0 HG11 VAL B 28 27.204 -5.339 17.390 1.00 44.41 H new ATOM 0 HG12 VAL B 28 28.713 -6.130 16.877 1.00 44.41 H new ATOM 0 HG13 VAL B 28 28.756 -4.845 18.107 1.00 44.41 H new ATOM 0 HG21 VAL B 28 26.688 -3.034 16.673 1.00 74.12 H new ATOM 0 HG22 VAL B 28 28.211 -2.410 17.352 1.00 74.12 H new ATOM 0 HG23 VAL B 28 27.825 -2.138 15.637 1.00 74.12 H new ATOM 2438 N LYS B 29 29.524 -4.031 13.430 1.00 64.31 N ATOM 2439 CA LYS B 29 29.537 -3.609 12.036 1.00 24.45 C ATOM 2440 C LYS B 29 28.168 -3.828 11.408 1.00 31.35 C ATOM 2441 O LYS B 29 27.465 -4.777 11.755 1.00 25.23 O ATOM 2442 CB LYS B 29 30.640 -4.375 11.275 1.00 11.40 C ATOM 2443 CG LYS B 29 30.394 -4.603 9.775 1.00 53.23 C ATOM 2444 CD LYS B 29 29.599 -5.882 9.463 1.00 3.25 C ATOM 2445 CE LYS B 29 30.335 -7.161 9.877 1.00 32.51 C ATOM 2446 NZ LYS B 29 30.263 -7.418 11.342 1.00 50.55 N1+ ATOM 0 H LYS B 29 29.065 -4.928 13.585 1.00 64.31 H new ATOM 0 HA LYS B 29 29.759 -2.543 11.977 1.00 24.45 H new ATOM 0 HB2 LYS B 29 31.577 -3.831 11.390 1.00 11.40 H new ATOM 0 HB3 LYS B 29 30.775 -5.346 11.752 1.00 11.40 H new ATOM 0 HG2 LYS B 29 29.857 -3.745 9.370 1.00 53.23 H new ATOM 0 HG3 LYS B 29 31.355 -4.649 9.262 1.00 53.23 H new ATOM 0 HD2 LYS B 29 28.638 -5.840 9.976 1.00 3.25 H new ATOM 0 HD3 LYS B 29 29.388 -5.920 8.394 1.00 3.25 H new ATOM 0 HE2 LYS B 29 29.909 -8.010 9.342 1.00 32.51 H new ATOM 0 HE3 LYS B 29 31.380 -7.087 9.576 1.00 32.51 H new ATOM 0 HZ1 LYS B 29 31.188 -7.223 11.775 1.00 50.55 H new ATOM 0 HZ2 LYS B 29 29.544 -6.799 11.768 1.00 50.55 H new ATOM 0 HZ3 LYS B 29 30.006 -8.412 11.508 1.00 50.55 H new ATOM 2460 N LEU B 30 27.788 -2.941 10.498 1.00 60.42 N ATOM 2461 CA LEU B 30 26.552 -3.076 9.757 1.00 43.12 C ATOM 2462 C LEU B 30 26.801 -2.874 8.262 1.00 50.11 C ATOM 2463 O LEU B 30 27.837 -2.302 7.852 1.00 72.32 O ATOM 2464 CB LEU B 30 25.465 -2.117 10.296 1.00 4.40 C ATOM 2465 CG LEU B 30 25.886 -0.664 10.630 1.00 61.23 C ATOM 2466 CD1 LEU B 30 26.797 -0.596 11.857 1.00 42.23 C ATOM 2467 CD2 LEU B 30 26.530 0.014 9.428 1.00 52.40 C ATOM 0 H LEU B 30 28.330 -2.111 10.257 1.00 60.42 H new ATOM 0 HA LEU B 30 26.176 -4.089 9.898 1.00 43.12 H new ATOM 0 HB2 LEU B 30 24.662 -2.072 9.560 1.00 4.40 H new ATOM 0 HB3 LEU B 30 25.045 -2.560 11.199 1.00 4.40 H new ATOM 0 HG LEU B 30 24.976 -0.118 10.877 1.00 61.23 H new ATOM 0 HD11 LEU B 30 27.066 0.442 12.053 1.00 42.23 H new ATOM 0 HD12 LEU B 30 26.274 -1.005 12.722 1.00 42.23 H new ATOM 0 HD13 LEU B 30 27.701 -1.177 11.672 1.00 42.23 H new ATOM 0 HD21 LEU B 30 26.815 1.032 9.694 1.00 52.40 H new ATOM 0 HD22 LEU B 30 27.417 -0.544 9.127 1.00 52.40 H new ATOM 0 HD23 LEU B 30 25.820 0.040 8.601 1.00 52.40 H new ATOM 2479 N SER B 31 25.860 -3.360 7.455 1.00 24.22 N ATOM 2480 CA SER B 31 25.975 -3.313 6.007 1.00 21.40 C ATOM 2481 C SER B 31 24.621 -3.526 5.348 1.00 43.34 C ATOM 2482 O SER B 31 23.840 -4.376 5.779 1.00 1.33 O ATOM 2483 CB SER B 31 26.959 -4.386 5.504 1.00 62.35 C ATOM 2484 OG SER B 31 28.241 -4.251 6.097 1.00 3.34 O ATOM 0 H SER B 31 25.000 -3.795 7.790 1.00 24.22 H new ATOM 0 HA SER B 31 26.351 -2.326 5.738 1.00 21.40 H new ATOM 0 HB2 SER B 31 26.560 -5.376 5.725 1.00 62.35 H new ATOM 0 HB3 SER B 31 27.051 -4.314 4.420 1.00 62.35 H new ATOM 0 HG SER B 31 28.319 -3.365 6.509 1.00 3.34 H new ATOM 2490 N ALA B 32 24.349 -2.741 4.314 1.00 40.52 N ATOM 2491 CA ALA B 32 23.174 -2.945 3.484 1.00 75.13 C ATOM 2492 C ALA B 32 23.374 -4.181 2.605 1.00 31.44 C ATOM 2493 O ALA B 32 24.280 -4.211 1.763 1.00 42.31 O ATOM 2494 CB ALA B 32 22.913 -1.714 2.626 1.00 44.15 C ATOM 0 H ALA B 32 24.931 -1.953 4.031 1.00 40.52 H new ATOM 0 HA ALA B 32 22.306 -3.104 4.124 1.00 75.13 H new ATOM 0 HB1 ALA B 32 22.030 -1.881 2.009 1.00 44.15 H new ATOM 0 HB2 ALA B 32 22.748 -0.850 3.270 1.00 44.15 H new ATOM 0 HB3 ALA B 32 23.774 -1.529 1.984 1.00 44.15 H new ATOM 2500 N PRO B 33 22.564 -5.237 2.811 1.00 64.54 N ATOM 2501 CA PRO B 33 22.652 -6.462 2.011 1.00 71.30 C ATOM 2502 C PRO B 33 22.268 -6.208 0.549 1.00 44.54 C ATOM 2503 O PRO B 33 22.338 -5.083 0.066 1.00 60.20 O ATOM 2504 CB PRO B 33 21.662 -7.418 2.697 1.00 5.21 C ATOM 2505 CG PRO B 33 20.713 -6.532 3.433 1.00 53.32 C ATOM 2506 CD PRO B 33 21.501 -5.314 3.833 1.00 34.02 C ATOM 0 HA PRO B 33 23.664 -6.865 1.971 1.00 71.30 H new ATOM 0 HB2 PRO B 33 21.139 -8.035 1.966 1.00 5.21 H new ATOM 0 HB3 PRO B 33 22.176 -8.097 3.378 1.00 5.21 H new ATOM 0 HG2 PRO B 33 19.867 -6.259 2.802 1.00 53.32 H new ATOM 0 HG3 PRO B 33 20.307 -7.038 4.309 1.00 53.32 H new ATOM 0 HD2 PRO B 33 20.881 -4.418 3.834 1.00 34.02 H new ATOM 0 HD3 PRO B 33 21.916 -5.416 4.836 1.00 34.02 H new ATOM 2514 N ARG B 34 21.906 -7.258 -0.164 1.00 0.10 N ATOM 2515 CA ARG B 34 21.488 -7.143 -1.560 1.00 23.43 C ATOM 2516 C ARG B 34 19.993 -7.425 -1.658 1.00 64.55 C ATOM 2517 O ARG B 34 19.533 -8.201 -2.499 1.00 62.12 O ATOM 2518 CB ARG B 34 22.312 -8.103 -2.433 1.00 33.02 C ATOM 2519 CG ARG B 34 23.360 -7.426 -3.325 1.00 11.34 C ATOM 2520 CD ARG B 34 22.738 -6.454 -4.324 1.00 70.25 C ATOM 2521 NE ARG B 34 23.563 -6.305 -5.529 1.00 41.11 N ATOM 2522 CZ ARG B 34 23.976 -5.142 -6.043 1.00 71.43 C ATOM 2523 NH1 ARG B 34 23.762 -3.997 -5.407 1.00 70.13 N1+ ATOM 2524 NH2 ARG B 34 24.639 -5.131 -7.189 1.00 21.32 N ATOM 0 H ARG B 34 21.891 -8.211 0.199 1.00 0.10 H new ATOM 0 HA ARG B 34 21.668 -6.133 -1.927 1.00 23.43 H new ATOM 0 HB2 ARG B 34 22.816 -8.819 -1.784 1.00 33.02 H new ATOM 0 HB3 ARG B 34 21.630 -8.671 -3.066 1.00 33.02 H new ATOM 0 HG2 ARG B 34 24.074 -6.891 -2.699 1.00 11.34 H new ATOM 0 HG3 ARG B 34 23.920 -8.189 -3.866 1.00 11.34 H new ATOM 0 HD2 ARG B 34 21.746 -6.807 -4.605 1.00 70.25 H new ATOM 0 HD3 ARG B 34 22.608 -5.481 -3.851 1.00 70.25 H new ATOM 0 HE ARG B 34 23.844 -7.158 -6.013 1.00 41.11 H new ATOM 0 HH11 ARG B 34 23.275 -3.995 -4.511 1.00 70.13 H new ATOM 0 HH12 ARG B 34 24.084 -3.119 -5.815 1.00 70.13 H new ATOM 0 HH21 ARG B 34 24.832 -6.007 -7.675 1.00 21.32 H new ATOM 0 HH22 ARG B 34 24.957 -4.247 -7.586 1.00 21.32 H new ATOM 2538 N GLU B 35 19.257 -6.767 -0.772 1.00 42.24 N ATOM 2539 CA GLU B 35 17.798 -6.857 -0.705 1.00 63.02 C ATOM 2540 C GLU B 35 17.198 -6.674 -2.095 1.00 12.03 C ATOM 2541 O GLU B 35 16.650 -7.608 -2.684 1.00 54.43 O ATOM 2542 CB GLU B 35 17.224 -5.786 0.235 1.00 72.41 C ATOM 2543 CG GLU B 35 18.232 -5.198 1.199 1.00 31.33 C ATOM 2544 CD GLU B 35 19.140 -4.149 0.551 1.00 34.33 C ATOM 2545 OE1 GLU B 35 19.868 -3.465 1.288 1.00 72.42 O ATOM 2546 OE2 GLU B 35 19.138 -4.036 -0.704 1.00 24.25 O1- ATOM 0 H GLU B 35 19.659 -6.147 -0.069 1.00 42.24 H new ATOM 0 HA GLU B 35 17.540 -7.843 -0.318 1.00 63.02 H new ATOM 0 HB2 GLU B 35 16.801 -4.981 -0.366 1.00 72.41 H new ATOM 0 HB3 GLU B 35 16.404 -6.222 0.806 1.00 72.41 H new ATOM 0 HG2 GLU B 35 17.703 -4.744 2.037 1.00 31.33 H new ATOM 0 HG3 GLU B 35 18.847 -6.000 1.607 1.00 31.33 H new ATOM 2553 N LEU B 36 17.319 -5.453 -2.606 1.00 53.04 N ATOM 2554 CA LEU B 36 16.899 -5.128 -3.966 1.00 1.52 C ATOM 2555 C LEU B 36 18.124 -4.758 -4.790 1.00 52.10 C ATOM 2556 O LEU B 36 18.179 -5.012 -5.993 1.00 30.14 O ATOM 2557 CB LEU B 36 15.898 -3.955 -3.999 1.00 63.52 C ATOM 2558 CG LEU B 36 14.565 -4.145 -3.246 1.00 20.23 C ATOM 2559 CD1 LEU B 36 13.928 -5.495 -3.564 1.00 52.43 C ATOM 2560 CD2 LEU B 36 14.747 -3.975 -1.744 1.00 15.21 C ATOM 0 H LEU B 36 17.709 -4.663 -2.092 1.00 53.04 H new ATOM 0 HA LEU B 36 16.401 -6.005 -4.380 1.00 1.52 H new ATOM 0 HB2 LEU B 36 16.395 -3.075 -3.590 1.00 63.52 H new ATOM 0 HB3 LEU B 36 15.669 -3.736 -5.042 1.00 63.52 H new ATOM 0 HG LEU B 36 13.886 -3.366 -3.594 1.00 20.23 H new ATOM 0 HD11 LEU B 36 12.991 -5.593 -3.016 1.00 52.43 H new ATOM 0 HD12 LEU B 36 13.731 -5.561 -4.634 1.00 52.43 H new ATOM 0 HD13 LEU B 36 14.606 -6.296 -3.270 1.00 52.43 H new ATOM 0 HD21 LEU B 36 13.789 -4.115 -1.243 1.00 15.21 H new ATOM 0 HD22 LEU B 36 15.459 -4.714 -1.378 1.00 15.21 H new ATOM 0 HD23 LEU B 36 15.123 -2.974 -1.534 1.00 15.21 H new ATOM 2572 N GLY B 37 19.103 -4.146 -4.128 1.00 22.45 N ATOM 2573 CA GLY B 37 20.316 -3.732 -4.802 1.00 25.41 C ATOM 2574 C GLY B 37 21.223 -2.911 -3.910 1.00 51.22 C ATOM 2575 O GLY B 37 21.729 -1.870 -4.325 1.00 30.40 O ATOM 0 H GLY B 37 19.074 -3.930 -3.132 1.00 22.45 H new ATOM 0 HA2 GLY B 37 20.854 -4.614 -5.149 1.00 25.41 H new ATOM 0 HA3 GLY B 37 20.056 -3.149 -5.686 1.00 25.41 H new ATOM 2579 N GLY B 38 21.435 -3.384 -2.681 1.00 53.33 N ATOM 2580 CA GLY B 38 22.335 -2.701 -1.763 1.00 54.12 C ATOM 2581 C GLY B 38 23.788 -3.021 -2.061 1.00 61.21 C ATOM 2582 O GLY B 38 24.255 -2.822 -3.183 1.00 64.12 O ATOM 0 H GLY B 38 21.000 -4.227 -2.306 1.00 53.33 H new ATOM 0 HA2 GLY B 38 22.178 -1.625 -1.832 1.00 54.12 H new ATOM 0 HA3 GLY B 38 22.101 -2.992 -0.739 1.00 54.12 H new ATOM 2586 N ALA B 39 24.501 -3.549 -1.074 1.00 3.10 N ATOM 2587 CA ALA B 39 25.909 -3.901 -1.249 1.00 71.25 C ATOM 2588 C ALA B 39 26.081 -5.415 -1.287 1.00 4.43 C ATOM 2589 O ALA B 39 26.884 -5.948 -2.059 1.00 31.41 O ATOM 2590 CB ALA B 39 26.756 -3.287 -0.137 1.00 12.41 C ATOM 0 H ALA B 39 24.130 -3.744 -0.144 1.00 3.10 H new ATOM 0 HA ALA B 39 26.251 -3.496 -2.201 1.00 71.25 H new ATOM 0 HB1 ALA B 39 27.801 -3.559 -0.283 1.00 12.41 H new ATOM 0 HB2 ALA B 39 26.657 -2.202 -0.161 1.00 12.41 H new ATOM 0 HB3 ALA B 39 26.415 -3.661 0.829 1.00 12.41 H new ATOM 2596 N GLY B 40 25.303 -6.102 -0.462 1.00 23.34 N ATOM 2597 CA GLY B 40 25.380 -7.549 -0.387 1.00 31.44 C ATOM 2598 C GLY B 40 26.442 -8.003 0.584 1.00 1.42 C ATOM 2599 O GLY B 40 27.535 -8.409 0.183 1.00 53.13 O ATOM 0 H GLY B 40 24.615 -5.680 0.161 1.00 23.34 H new ATOM 0 HA2 GLY B 40 24.413 -7.949 -0.082 1.00 31.44 H new ATOM 0 HA3 GLY B 40 25.595 -7.954 -1.376 1.00 31.44 H new ATOM 2603 N ALA B 41 26.113 -7.944 1.867 1.00 13.10 N ATOM 2604 CA ALA B 41 27.075 -8.239 2.924 1.00 45.11 C ATOM 2605 C ALA B 41 26.390 -8.895 4.117 1.00 24.05 C ATOM 2606 O ALA B 41 25.161 -8.915 4.203 1.00 14.44 O ATOM 2607 CB ALA B 41 27.795 -6.965 3.354 1.00 11.53 C ATOM 0 H ALA B 41 25.183 -7.694 2.204 1.00 13.10 H new ATOM 0 HA ALA B 41 27.811 -8.940 2.531 1.00 45.11 H new ATOM 0 HB1 ALA B 41 28.510 -7.200 4.143 1.00 11.53 H new ATOM 0 HB2 ALA B 41 28.323 -6.540 2.501 1.00 11.53 H new ATOM 0 HB3 ALA B 41 27.067 -6.244 3.726 1.00 11.53 H new ATOM 2613 N GLU B 42 27.197 -9.412 5.038 1.00 15.20 N ATOM 2614 CA GLU B 42 26.705 -10.144 6.205 1.00 53.20 C ATOM 2615 C GLU B 42 26.410 -9.199 7.372 1.00 74.14 C ATOM 2616 O GLU B 42 26.157 -9.645 8.494 1.00 53.42 O ATOM 2617 CB GLU B 42 27.753 -11.187 6.620 1.00 21.14 C ATOM 2618 CG GLU B 42 29.091 -10.575 7.032 1.00 73.23 C ATOM 2619 CD GLU B 42 30.225 -11.586 7.057 1.00 72.34 C ATOM 2620 OE1 GLU B 42 30.450 -12.211 8.114 1.00 61.42 O ATOM 2621 OE2 GLU B 42 30.901 -11.757 6.016 1.00 61.14 O1- ATOM 0 H GLU B 42 28.213 -9.336 4.998 1.00 15.20 H new ATOM 0 HA GLU B 42 25.771 -10.640 5.939 1.00 53.20 H new ATOM 0 HB2 GLU B 42 27.360 -11.775 7.450 1.00 21.14 H new ATOM 0 HB3 GLU B 42 27.917 -11.875 5.791 1.00 21.14 H new ATOM 0 HG2 GLU B 42 29.344 -9.771 6.341 1.00 73.23 H new ATOM 0 HG3 GLU B 42 28.990 -10.126 8.020 1.00 73.23 H new ATOM 2628 N GLY B 43 26.435 -7.898 7.098 1.00 33.24 N ATOM 2629 CA GLY B 43 26.236 -6.905 8.141 1.00 35.43 C ATOM 2630 C GLY B 43 24.780 -6.743 8.536 1.00 2.13 C ATOM 2631 O GLY B 43 23.914 -7.502 8.087 1.00 72.12 O ATOM 0 H GLY B 43 26.590 -7.511 6.167 1.00 33.24 H new ATOM 0 HA2 GLY B 43 26.816 -7.188 9.020 1.00 35.43 H new ATOM 0 HA3 GLY B 43 26.623 -5.945 7.799 1.00 35.43 H new ATOM 2635 N THR B 44 24.510 -5.751 9.379 1.00 33.20 N ATOM 2636 CA THR B 44 23.159 -5.478 9.854 1.00 33.40 C ATOM 2637 C THR B 44 22.531 -4.350 9.036 1.00 35.03 C ATOM 2638 O THR B 44 23.233 -3.445 8.578 1.00 4.14 O ATOM 2639 CB THR B 44 23.177 -5.087 11.352 1.00 13.15 C ATOM 2640 OG1 THR B 44 23.886 -6.085 12.100 1.00 1.03 O ATOM 2641 CG2 THR B 44 21.763 -4.938 11.913 1.00 34.45 C ATOM 0 H THR B 44 25.218 -5.117 9.750 1.00 33.20 H new ATOM 0 HA THR B 44 22.564 -6.384 9.734 1.00 33.40 H new ATOM 0 HB THR B 44 23.678 -4.123 11.442 1.00 13.15 H new ATOM 0 HG1 THR B 44 23.899 -5.836 13.048 1.00 1.03 H new ATOM 0 HG21 THR B 44 21.817 -4.663 12.966 1.00 34.45 H new ATOM 0 HG22 THR B 44 21.233 -4.161 11.362 1.00 34.45 H new ATOM 0 HG23 THR B 44 21.230 -5.883 11.811 1.00 34.45 H new ATOM 2649 N ASN B 45 21.215 -4.417 8.848 1.00 4.01 N ATOM 2650 CA ASN B 45 20.484 -3.397 8.101 1.00 51.43 C ATOM 2651 C ASN B 45 20.524 -2.053 8.837 1.00 21.43 C ATOM 2652 O ASN B 45 20.165 -1.982 10.011 1.00 31.35 O ATOM 2653 CB ASN B 45 19.025 -3.837 7.892 1.00 71.14 C ATOM 2654 CG ASN B 45 18.846 -4.825 6.755 1.00 11.33 C ATOM 2655 OD1 ASN B 45 18.904 -6.044 6.953 1.00 33.20 O ATOM 2656 ND2 ASN B 45 18.606 -4.304 5.561 1.00 55.34 N ATOM 0 H ASN B 45 20.630 -5.172 9.205 1.00 4.01 H new ATOM 0 HA ASN B 45 20.963 -3.275 7.130 1.00 51.43 H new ATOM 0 HB2 ASN B 45 18.654 -4.285 8.814 1.00 71.14 H new ATOM 0 HB3 ASN B 45 18.413 -2.956 7.697 1.00 71.14 H new ATOM 0 HD21 ASN B 45 18.460 -4.915 4.758 1.00 55.34 H new ATOM 0 HD22 ASN B 45 18.567 -3.291 5.445 1.00 55.34 H new ATOM 2663 N PRO B 46 20.980 -0.974 8.161 1.00 54.41 N ATOM 2664 CA PRO B 46 21.029 0.378 8.746 1.00 2.04 C ATOM 2665 C PRO B 46 19.666 0.844 9.280 1.00 14.41 C ATOM 2666 O PRO B 46 19.540 1.227 10.455 1.00 12.32 O ATOM 2667 CB PRO B 46 21.478 1.261 7.567 1.00 21.50 C ATOM 2668 CG PRO B 46 22.206 0.332 6.655 1.00 13.22 C ATOM 2669 CD PRO B 46 21.499 -0.993 6.777 1.00 31.44 C ATOM 0 HA PRO B 46 21.694 0.421 9.608 1.00 2.04 H new ATOM 0 HB2 PRO B 46 20.624 1.719 7.067 1.00 21.50 H new ATOM 0 HB3 PRO B 46 22.123 2.073 7.903 1.00 21.50 H new ATOM 0 HG2 PRO B 46 22.184 0.695 5.627 1.00 13.22 H new ATOM 0 HG3 PRO B 46 23.254 0.245 6.940 1.00 13.22 H new ATOM 0 HD2 PRO B 46 20.695 -1.089 6.047 1.00 31.44 H new ATOM 0 HD3 PRO B 46 22.179 -1.829 6.614 1.00 31.44 H new ATOM 2677 N GLU B 47 18.649 0.805 8.417 1.00 51.12 N ATOM 2678 CA GLU B 47 17.301 1.233 8.802 1.00 42.23 C ATOM 2679 C GLU B 47 16.759 0.344 9.918 1.00 51.31 C ATOM 2680 O GLU B 47 16.103 0.827 10.846 1.00 51.34 O ATOM 2681 CB GLU B 47 16.318 1.264 7.600 1.00 43.35 C ATOM 2682 CG GLU B 47 16.781 0.530 6.338 1.00 13.13 C ATOM 2683 CD GLU B 47 17.159 -0.922 6.583 1.00 41.12 C ATOM 2684 OE1 GLU B 47 18.343 -1.262 6.381 1.00 53.12 O ATOM 2685 OE2 GLU B 47 16.292 -1.713 7.002 1.00 73.03 O1- ATOM 0 H GLU B 47 18.731 0.484 7.452 1.00 51.12 H new ATOM 0 HA GLU B 47 17.383 2.257 9.168 1.00 42.23 H new ATOM 0 HB2 GLU B 47 15.369 0.833 7.920 1.00 43.35 H new ATOM 0 HB3 GLU B 47 16.124 2.305 7.341 1.00 43.35 H new ATOM 0 HG2 GLU B 47 15.986 0.569 5.593 1.00 13.13 H new ATOM 0 HG3 GLU B 47 17.639 1.054 5.917 1.00 13.13 H new ATOM 2692 N GLN B 48 17.048 -0.951 9.827 1.00 65.22 N ATOM 2693 CA GLN B 48 16.661 -1.898 10.864 1.00 23.21 C ATOM 2694 C GLN B 48 17.319 -1.523 12.187 1.00 44.13 C ATOM 2695 O GLN B 48 16.680 -1.558 13.237 1.00 15.51 O ATOM 2696 CB GLN B 48 17.057 -3.327 10.458 1.00 21.32 C ATOM 2697 CG GLN B 48 16.469 -4.419 11.349 1.00 64.34 C ATOM 2698 CD GLN B 48 17.190 -4.562 12.677 1.00 23.41 C ATOM 2699 OE1 GLN B 48 16.442 -4.852 13.723 1.00 3.40 O flip ATOM 2700 NE2 GLN B 48 18.404 -4.390 12.766 1.00 12.54 N flip ATOM 0 H GLN B 48 17.550 -1.368 9.043 1.00 65.22 H new ATOM 0 HA GLN B 48 15.579 -1.860 10.987 1.00 23.21 H new ATOM 0 HB2 GLN B 48 16.738 -3.502 9.430 1.00 21.32 H new ATOM 0 HB3 GLN B 48 18.144 -3.408 10.473 1.00 21.32 H new ATOM 0 HG2 GLN B 48 15.418 -4.199 11.536 1.00 64.34 H new ATOM 0 HG3 GLN B 48 16.506 -5.371 10.819 1.00 64.34 H new ATOM 0 HE21 GLN B 48 18.950 -4.167 11.934 1.00 12.54 H new ATOM 0 HE22 GLN B 48 18.865 -4.470 13.672 1.00 12.54 H new ATOM 2709 N LEU B 49 18.598 -1.167 12.121 1.00 25.52 N ATOM 2710 CA LEU B 49 19.366 -0.804 13.307 1.00 12.42 C ATOM 2711 C LEU B 49 18.705 0.391 13.996 1.00 73.15 C ATOM 2712 O LEU B 49 18.476 0.375 15.209 1.00 22.33 O ATOM 2713 CB LEU B 49 20.826 -0.494 12.913 1.00 25.41 C ATOM 2714 CG LEU B 49 21.869 -0.507 14.055 1.00 55.21 C ATOM 2715 CD1 LEU B 49 21.698 0.684 14.995 1.00 20.42 C ATOM 2716 CD2 LEU B 49 21.795 -1.822 14.832 1.00 31.54 C ATOM 0 H LEU B 49 19.128 -1.122 11.251 1.00 25.52 H new ATOM 0 HA LEU B 49 19.381 -1.638 14.009 1.00 12.42 H new ATOM 0 HB2 LEU B 49 21.137 -1.218 12.160 1.00 25.41 H new ATOM 0 HB3 LEU B 49 20.850 0.488 12.441 1.00 25.41 H new ATOM 0 HG LEU B 49 22.856 -0.422 13.599 1.00 55.21 H new ATOM 0 HD11 LEU B 49 22.450 0.637 15.783 1.00 20.42 H new ATOM 0 HD12 LEU B 49 21.818 1.611 14.434 1.00 20.42 H new ATOM 0 HD13 LEU B 49 20.704 0.656 15.441 1.00 20.42 H new ATOM 0 HD21 LEU B 49 22.536 -1.814 15.632 1.00 31.54 H new ATOM 0 HD22 LEU B 49 20.799 -1.936 15.261 1.00 31.54 H new ATOM 0 HD23 LEU B 49 21.997 -2.655 14.158 1.00 31.54 H new ATOM 2728 N PHE B 50 18.384 1.416 13.205 1.00 74.53 N ATOM 2729 CA PHE B 50 17.672 2.590 13.716 1.00 13.24 C ATOM 2730 C PHE B 50 16.340 2.183 14.349 1.00 54.12 C ATOM 2731 O PHE B 50 16.009 2.621 15.450 1.00 20.22 O ATOM 2732 CB PHE B 50 17.443 3.607 12.585 1.00 14.34 C ATOM 2733 CG PHE B 50 16.393 4.659 12.877 1.00 61.31 C ATOM 2734 CD1 PHE B 50 16.525 5.545 13.947 1.00 53.13 C ATOM 2735 CD2 PHE B 50 15.272 4.769 12.066 1.00 53.22 C ATOM 2736 CE1 PHE B 50 15.566 6.505 14.192 1.00 14.14 C ATOM 2737 CE2 PHE B 50 14.312 5.729 12.313 1.00 22.12 C ATOM 2738 CZ PHE B 50 14.460 6.598 13.376 1.00 62.30 C ATOM 0 H PHE B 50 18.605 1.458 12.210 1.00 74.53 H new ATOM 0 HA PHE B 50 18.285 3.057 14.487 1.00 13.24 H new ATOM 0 HB2 PHE B 50 18.387 4.107 12.369 1.00 14.34 H new ATOM 0 HB3 PHE B 50 17.155 3.067 11.683 1.00 14.34 H new ATOM 0 HD1 PHE B 50 17.389 5.478 14.591 1.00 53.13 H new ATOM 0 HD2 PHE B 50 15.150 4.095 11.231 1.00 53.22 H new ATOM 0 HE1 PHE B 50 15.682 7.184 15.024 1.00 14.14 H new ATOM 0 HE2 PHE B 50 13.444 5.801 11.674 1.00 22.12 H new ATOM 0 HZ PHE B 50 13.709 7.350 13.568 1.00 62.30 H new ATOM 2748 N ALA B 51 15.590 1.335 13.649 1.00 24.13 N ATOM 2749 CA ALA B 51 14.290 0.871 14.130 1.00 31.22 C ATOM 2750 C ALA B 51 14.423 0.161 15.478 1.00 63.22 C ATOM 2751 O ALA B 51 13.709 0.481 16.429 1.00 61.14 O ATOM 2752 CB ALA B 51 13.644 -0.051 13.102 1.00 4.33 C ATOM 0 H ALA B 51 15.861 0.954 12.743 1.00 24.13 H new ATOM 0 HA ALA B 51 13.650 1.742 14.271 1.00 31.22 H new ATOM 0 HB1 ALA B 51 12.677 -0.389 13.473 1.00 4.33 H new ATOM 0 HB2 ALA B 51 13.505 0.489 12.166 1.00 4.33 H new ATOM 0 HB3 ALA B 51 14.288 -0.913 12.931 1.00 4.33 H new ATOM 2758 N ALA B 52 15.354 -0.787 15.551 1.00 2.41 N ATOM 2759 CA ALA B 52 15.586 -1.563 16.768 1.00 55.02 C ATOM 2760 C ALA B 52 15.999 -0.657 17.927 1.00 53.11 C ATOM 2761 O ALA B 52 15.502 -0.798 19.051 1.00 74.31 O ATOM 2762 CB ALA B 52 16.649 -2.630 16.518 1.00 43.35 C ATOM 0 H ALA B 52 15.966 -1.038 14.774 1.00 2.41 H new ATOM 0 HA ALA B 52 14.652 -2.054 17.043 1.00 55.02 H new ATOM 0 HB1 ALA B 52 16.813 -3.201 17.432 1.00 43.35 H new ATOM 0 HB2 ALA B 52 16.313 -3.300 15.727 1.00 43.35 H new ATOM 0 HB3 ALA B 52 17.581 -2.152 16.217 1.00 43.35 H new ATOM 2768 N GLY B 53 16.906 0.274 17.643 1.00 41.34 N ATOM 2769 CA GLY B 53 17.348 1.225 18.648 1.00 4.13 C ATOM 2770 C GLY B 53 16.233 2.155 19.076 1.00 15.42 C ATOM 2771 O GLY B 53 16.157 2.555 20.237 1.00 73.22 O ATOM 0 H GLY B 53 17.345 0.387 16.729 1.00 41.34 H new ATOM 0 HA2 GLY B 53 17.724 0.686 19.517 1.00 4.13 H new ATOM 0 HA3 GLY B 53 18.178 1.811 18.253 1.00 4.13 H new ATOM 2775 N TYR B 54 15.360 2.485 18.133 1.00 15.35 N ATOM 2776 CA TYR B 54 14.221 3.358 18.394 1.00 21.24 C ATOM 2777 C TYR B 54 13.214 2.650 19.305 1.00 2.44 C ATOM 2778 O TYR B 54 12.756 3.217 20.302 1.00 55.40 O ATOM 2779 CB TYR B 54 13.572 3.767 17.059 1.00 22.10 C ATOM 2780 CG TYR B 54 12.442 4.785 17.160 1.00 24.43 C ATOM 2781 CD1 TYR B 54 12.275 5.590 18.287 1.00 33.43 C ATOM 2782 CD2 TYR B 54 11.548 4.952 16.106 1.00 20.22 C ATOM 2783 CE1 TYR B 54 11.254 6.522 18.356 1.00 54.12 C ATOM 2784 CE2 TYR B 54 10.527 5.879 16.171 1.00 11.21 C ATOM 2785 CZ TYR B 54 10.385 6.660 17.295 1.00 15.31 C ATOM 2786 OH TYR B 54 9.370 7.584 17.359 1.00 73.14 O ATOM 0 H TYR B 54 15.420 2.157 17.169 1.00 15.35 H new ATOM 0 HA TYR B 54 14.559 4.259 18.905 1.00 21.24 H new ATOM 0 HB2 TYR B 54 14.346 4.174 16.409 1.00 22.10 H new ATOM 0 HB3 TYR B 54 13.187 2.870 16.573 1.00 22.10 H new ATOM 0 HD1 TYR B 54 12.954 5.484 19.120 1.00 33.43 H new ATOM 0 HD2 TYR B 54 11.655 4.344 15.220 1.00 20.22 H new ATOM 0 HE1 TYR B 54 11.139 7.137 19.236 1.00 54.12 H new ATOM 0 HE2 TYR B 54 9.843 5.991 15.343 1.00 11.21 H new ATOM 0 HH TYR B 54 8.567 7.218 16.934 1.00 73.14 H new ATOM 2796 N SER B 55 12.890 1.403 18.971 1.00 62.44 N ATOM 2797 CA SER B 55 11.966 0.613 19.773 1.00 11.44 C ATOM 2798 C SER B 55 12.536 0.391 21.171 1.00 45.34 C ATOM 2799 O SER B 55 11.834 0.543 22.168 1.00 23.33 O ATOM 2800 CB SER B 55 11.670 -0.728 19.086 1.00 71.55 C ATOM 2801 OG SER B 55 12.865 -1.387 18.697 1.00 22.42 O ATOM 0 H SER B 55 13.255 0.920 18.150 1.00 62.44 H new ATOM 0 HA SER B 55 11.028 1.161 19.867 1.00 11.44 H new ATOM 0 HB2 SER B 55 11.104 -1.368 19.763 1.00 71.55 H new ATOM 0 HB3 SER B 55 11.044 -0.559 18.210 1.00 71.55 H new ATOM 0 HG SER B 55 13.637 -0.838 18.947 1.00 22.42 H new ATOM 2807 N ALA B 56 13.824 0.067 21.234 1.00 72.32 N ATOM 2808 CA ALA B 56 14.493 -0.174 22.506 1.00 72.14 C ATOM 2809 C ALA B 56 14.543 1.105 23.334 1.00 34.31 C ATOM 2810 O ALA B 56 14.340 1.081 24.549 1.00 51.54 O ATOM 2811 CB ALA B 56 15.891 -0.724 22.267 1.00 11.32 C ATOM 0 H ALA B 56 14.426 -0.035 20.417 1.00 72.32 H new ATOM 0 HA ALA B 56 13.925 -0.915 23.068 1.00 72.14 H new ATOM 0 HB1 ALA B 56 16.381 -0.900 23.224 1.00 11.32 H new ATOM 0 HB2 ALA B 56 15.824 -1.662 21.716 1.00 11.32 H new ATOM 0 HB3 ALA B 56 16.471 -0.004 21.689 1.00 11.32 H new ATOM 2817 N CYS B 57 14.796 2.225 22.660 1.00 24.02 N ATOM 2818 CA CYS B 57 14.801 3.530 23.307 1.00 54.22 C ATOM 2819 C CYS B 57 13.418 3.832 23.867 1.00 22.14 C ATOM 2820 O CYS B 57 13.285 4.417 24.938 1.00 1.03 O ATOM 2821 CB CYS B 57 15.220 4.620 22.310 1.00 72.40 C ATOM 2822 SG CYS B 57 15.175 6.305 22.970 1.00 42.35 S ATOM 0 H CYS B 57 15.001 2.252 21.661 1.00 24.02 H new ATOM 0 HA CYS B 57 15.521 3.516 24.125 1.00 54.22 H new ATOM 0 HB2 CYS B 57 16.231 4.407 21.963 1.00 72.40 H new ATOM 0 HB3 CYS B 57 14.567 4.568 21.439 1.00 72.40 H new ATOM 0 HG CYS B 57 16.289 6.558 23.591 1.00 42.35 H new ATOM 2828 N PHE B 58 12.393 3.408 23.132 1.00 34.03 N ATOM 2829 CA PHE B 58 11.008 3.612 23.538 1.00 42.11 C ATOM 2830 C PHE B 58 10.744 2.942 24.893 1.00 1.15 C ATOM 2831 O PHE B 58 10.068 3.509 25.754 1.00 52.32 O ATOM 2832 CB PHE B 58 10.057 3.058 22.461 1.00 13.13 C ATOM 2833 CG PHE B 58 8.764 3.821 22.335 1.00 50.11 C ATOM 2834 CD1 PHE B 58 7.608 3.384 22.968 1.00 2.44 C ATOM 2835 CD2 PHE B 58 8.709 4.981 21.577 1.00 25.34 C ATOM 2836 CE1 PHE B 58 6.424 4.093 22.844 1.00 5.05 C ATOM 2837 CE2 PHE B 58 7.534 5.691 21.450 1.00 25.32 C ATOM 2838 CZ PHE B 58 6.388 5.248 22.083 1.00 52.03 C ATOM 0 H PHE B 58 12.499 2.917 22.244 1.00 34.03 H new ATOM 0 HA PHE B 58 10.825 4.681 23.646 1.00 42.11 H new ATOM 0 HB2 PHE B 58 10.569 3.069 21.499 1.00 13.13 H new ATOM 0 HB3 PHE B 58 9.832 2.017 22.691 1.00 13.13 H new ATOM 0 HD1 PHE B 58 7.632 2.483 23.563 1.00 2.44 H new ATOM 0 HD2 PHE B 58 9.600 5.334 21.079 1.00 25.34 H new ATOM 0 HE1 PHE B 58 5.531 3.745 23.341 1.00 5.05 H new ATOM 0 HE2 PHE B 58 7.509 6.593 20.856 1.00 25.32 H new ATOM 0 HZ PHE B 58 5.466 5.802 21.984 1.00 52.03 H new ATOM 2848 N LEU B 59 11.300 1.739 25.078 1.00 60.43 N ATOM 2849 CA LEU B 59 11.176 1.016 26.347 1.00 11.12 C ATOM 2850 C LEU B 59 11.809 1.816 27.486 1.00 60.54 C ATOM 2851 O LEU B 59 11.115 2.237 28.415 1.00 64.41 O ATOM 2852 CB LEU B 59 11.822 -0.384 26.269 1.00 33.41 C ATOM 2853 CG LEU B 59 10.949 -1.505 25.665 1.00 23.42 C ATOM 2854 CD1 LEU B 59 9.662 -1.689 26.469 1.00 12.45 C ATOM 2855 CD2 LEU B 59 10.637 -1.230 24.200 1.00 24.24 C ATOM 0 H LEU B 59 11.839 1.247 24.366 1.00 60.43 H new ATOM 0 HA LEU B 59 10.112 0.889 26.546 1.00 11.12 H new ATOM 0 HB2 LEU B 59 12.736 -0.307 25.680 1.00 33.41 H new ATOM 0 HB3 LEU B 59 12.115 -0.683 27.276 1.00 33.41 H new ATOM 0 HG LEU B 59 11.517 -2.434 25.718 1.00 23.42 H new ATOM 0 HD11 LEU B 59 9.065 -2.484 26.023 1.00 12.45 H new ATOM 0 HD12 LEU B 59 9.910 -1.954 27.497 1.00 12.45 H new ATOM 0 HD13 LEU B 59 9.092 -0.760 26.461 1.00 12.45 H new ATOM 0 HD21 LEU B 59 10.021 -2.036 23.802 1.00 24.24 H new ATOM 0 HD22 LEU B 59 10.099 -0.286 24.114 1.00 24.24 H new ATOM 0 HD23 LEU B 59 11.567 -1.171 23.635 1.00 24.24 H new ATOM 2867 N SER B 60 13.123 2.030 27.397 1.00 44.21 N ATOM 2868 CA SER B 60 13.869 2.750 28.429 1.00 2.40 C ATOM 2869 C SER B 60 13.242 4.122 28.702 1.00 73.23 C ATOM 2870 O SER B 60 13.112 4.542 29.857 1.00 65.55 O ATOM 2871 CB SER B 60 15.332 2.906 27.998 1.00 63.24 C ATOM 2872 OG SER B 60 15.907 1.645 27.692 1.00 24.13 O ATOM 0 H SER B 60 13.695 1.712 26.615 1.00 44.21 H new ATOM 0 HA SER B 60 13.829 2.173 29.353 1.00 2.40 H new ATOM 0 HB2 SER B 60 15.391 3.558 27.127 1.00 63.24 H new ATOM 0 HB3 SER B 60 15.901 3.386 28.794 1.00 63.24 H new ATOM 0 HG SER B 60 16.345 1.283 28.490 1.00 24.13 H new ATOM 2878 N ALA B 61 12.829 4.797 27.632 1.00 21.42 N ATOM 2879 CA ALA B 61 12.175 6.098 27.741 1.00 31.00 C ATOM 2880 C ALA B 61 10.910 5.989 28.583 1.00 42.41 C ATOM 2881 O ALA B 61 10.701 6.773 29.503 1.00 44.10 O ATOM 2882 CB ALA B 61 11.851 6.657 26.359 1.00 4.34 C ATOM 0 H ALA B 61 12.937 4.462 26.675 1.00 21.42 H new ATOM 0 HA ALA B 61 12.861 6.786 28.235 1.00 31.00 H new ATOM 0 HB1 ALA B 61 11.364 7.627 26.464 1.00 4.34 H new ATOM 0 HB2 ALA B 61 12.772 6.773 25.788 1.00 4.34 H new ATOM 0 HB3 ALA B 61 11.185 5.971 25.836 1.00 4.34 H new ATOM 2888 N MET B 62 10.080 4.997 28.275 1.00 64.12 N ATOM 2889 CA MET B 62 8.834 4.781 29.008 1.00 62.41 C ATOM 2890 C MET B 62 9.106 4.452 30.473 1.00 51.11 C ATOM 2891 O MET B 62 8.350 4.859 31.356 1.00 53.32 O ATOM 2892 CB MET B 62 7.999 3.669 28.350 1.00 4.11 C ATOM 2893 CG MET B 62 7.235 4.111 27.099 1.00 71.00 C ATOM 2894 SD MET B 62 5.564 4.719 27.454 1.00 51.43 S ATOM 2895 CE MET B 62 5.873 6.170 28.463 1.00 33.40 C ATOM 0 H MET B 62 10.247 4.329 27.523 1.00 64.12 H new ATOM 0 HA MET B 62 8.262 5.708 28.972 1.00 62.41 H new ATOM 0 HB2 MET B 62 8.659 2.843 28.085 1.00 4.11 H new ATOM 0 HB3 MET B 62 7.286 3.286 29.080 1.00 4.11 H new ATOM 0 HG2 MET B 62 7.800 4.896 26.595 1.00 71.00 H new ATOM 0 HG3 MET B 62 7.169 3.271 26.407 1.00 71.00 H new ATOM 0 HE1 MET B 62 4.953 6.745 28.564 1.00 33.40 H new ATOM 0 HE2 MET B 62 6.218 5.860 29.450 1.00 33.40 H new ATOM 0 HE3 MET B 62 6.636 6.787 27.989 1.00 33.40 H new ATOM 2905 N LYS B 63 10.192 3.723 30.726 1.00 72.03 N ATOM 2906 CA LYS B 63 10.580 3.367 32.092 1.00 43.00 C ATOM 2907 C LYS B 63 10.893 4.636 32.890 1.00 70.35 C ATOM 2908 O LYS B 63 10.374 4.838 33.989 1.00 23.43 O ATOM 2909 CB LYS B 63 11.807 2.433 32.082 1.00 31.31 C ATOM 2910 CG LYS B 63 11.657 1.156 31.240 1.00 20.13 C ATOM 2911 CD LYS B 63 10.943 0.010 31.972 1.00 10.22 C ATOM 2912 CE LYS B 63 9.433 0.209 32.078 1.00 1.23 C ATOM 2913 NZ LYS B 63 8.757 -0.991 32.650 1.00 55.13 N1+ ATOM 0 H LYS B 63 10.819 3.367 30.004 1.00 72.03 H new ATOM 0 HA LYS B 63 9.750 2.841 32.564 1.00 43.00 H new ATOM 0 HB2 LYS B 63 12.666 2.993 31.712 1.00 31.31 H new ATOM 0 HB3 LYS B 63 12.032 2.146 33.109 1.00 31.31 H new ATOM 0 HG2 LYS B 63 11.104 1.394 30.331 1.00 20.13 H new ATOM 0 HG3 LYS B 63 12.646 0.817 30.932 1.00 20.13 H new ATOM 0 HD2 LYS B 63 11.143 -0.926 31.450 1.00 10.22 H new ATOM 0 HD3 LYS B 63 11.361 -0.088 32.974 1.00 10.22 H new ATOM 0 HE2 LYS B 63 9.223 1.077 32.703 1.00 1.23 H new ATOM 0 HE3 LYS B 63 9.024 0.421 31.090 1.00 1.23 H new ATOM 0 HZ1 LYS B 63 8.008 -0.688 33.304 1.00 55.13 H new ATOM 0 HZ2 LYS B 63 8.339 -1.553 31.881 1.00 55.13 H new ATOM 0 HZ3 LYS B 63 9.452 -1.569 33.164 1.00 55.13 H new ATOM 2927 N PHE B 64 11.736 5.490 32.310 1.00 21.33 N ATOM 2928 CA PHE B 64 12.139 6.750 32.938 1.00 32.24 C ATOM 2929 C PHE B 64 10.942 7.689 33.104 1.00 14.21 C ATOM 2930 O PHE B 64 10.669 8.181 34.202 1.00 73.11 O ATOM 2931 CB PHE B 64 13.226 7.427 32.089 1.00 30.41 C ATOM 2932 CG PHE B 64 13.664 8.775 32.612 1.00 63.34 C ATOM 2933 CD1 PHE B 64 14.433 8.874 33.764 1.00 43.42 C ATOM 2934 CD2 PHE B 64 13.304 9.945 31.954 1.00 31.33 C ATOM 2935 CE1 PHE B 64 14.829 10.107 34.246 1.00 55.11 C ATOM 2936 CE2 PHE B 64 13.700 11.177 32.434 1.00 33.41 C ATOM 2937 CZ PHE B 64 14.461 11.259 33.581 1.00 14.04 C ATOM 0 H PHE B 64 12.158 5.330 31.395 1.00 21.33 H new ATOM 0 HA PHE B 64 12.536 6.530 33.929 1.00 32.24 H new ATOM 0 HB2 PHE B 64 14.094 6.770 32.037 1.00 30.41 H new ATOM 0 HB3 PHE B 64 12.855 7.547 31.071 1.00 30.41 H new ATOM 0 HD1 PHE B 64 14.725 7.977 34.289 1.00 43.42 H new ATOM 0 HD2 PHE B 64 12.707 9.890 31.056 1.00 31.33 H new ATOM 0 HE1 PHE B 64 15.427 10.169 35.143 1.00 55.11 H new ATOM 0 HE2 PHE B 64 13.414 12.077 31.911 1.00 33.41 H new ATOM 0 HZ PHE B 64 14.769 12.223 33.958 1.00 14.04 H new ATOM 2947 N VAL B 65 10.230 7.923 32.006 1.00 75.05 N ATOM 2948 CA VAL B 65 9.087 8.829 31.998 1.00 40.30 C ATOM 2949 C VAL B 65 8.059 8.427 33.051 1.00 43.44 C ATOM 2950 O VAL B 65 7.594 9.265 33.827 1.00 35.52 O ATOM 2951 CB VAL B 65 8.409 8.875 30.607 1.00 54.45 C ATOM 2952 CG1 VAL B 65 7.082 9.624 30.677 1.00 70.43 C ATOM 2953 CG2 VAL B 65 9.338 9.515 29.574 1.00 51.21 C ATOM 0 H VAL B 65 10.427 7.493 31.102 1.00 75.05 H new ATOM 0 HA VAL B 65 9.468 9.823 32.234 1.00 40.30 H new ATOM 0 HB VAL B 65 8.205 7.851 30.294 1.00 54.45 H new ATOM 0 HG11 VAL B 65 6.623 9.644 29.689 1.00 70.43 H new ATOM 0 HG12 VAL B 65 6.416 9.119 31.376 1.00 70.43 H new ATOM 0 HG13 VAL B 65 7.258 10.645 31.016 1.00 70.43 H new ATOM 0 HG21 VAL B 65 8.842 9.538 28.603 1.00 51.21 H new ATOM 0 HG22 VAL B 65 9.579 10.532 29.882 1.00 51.21 H new ATOM 0 HG23 VAL B 65 10.256 8.932 29.499 1.00 51.21 H new ATOM 2963 N ALA B 66 7.724 7.143 33.088 1.00 30.22 N ATOM 2964 CA ALA B 66 6.770 6.629 34.064 1.00 74.13 C ATOM 2965 C ALA B 66 7.217 6.985 35.478 1.00 44.35 C ATOM 2966 O ALA B 66 6.403 7.318 36.343 1.00 34.23 O ATOM 2967 CB ALA B 66 6.620 5.118 33.916 1.00 23.44 C ATOM 0 H ALA B 66 8.099 6.438 32.453 1.00 30.22 H new ATOM 0 HA ALA B 66 5.800 7.091 33.880 1.00 74.13 H new ATOM 0 HB1 ALA B 66 5.905 4.750 34.651 1.00 23.44 H new ATOM 0 HB2 ALA B 66 6.262 4.884 32.913 1.00 23.44 H new ATOM 0 HB3 ALA B 66 7.586 4.639 34.078 1.00 23.44 H new ATOM 2973 N GLY B 67 8.530 6.980 35.672 1.00 23.35 N ATOM 2974 CA GLY B 67 9.103 7.214 36.986 1.00 73.24 C ATOM 2975 C GLY B 67 8.910 8.641 37.457 1.00 45.13 C ATOM 2976 O GLY B 67 8.804 8.901 38.657 1.00 75.04 O ATOM 0 H GLY B 67 9.216 6.816 34.935 1.00 23.35 H new ATOM 0 HA2 GLY B 67 8.647 6.533 37.704 1.00 73.24 H new ATOM 0 HA3 GLY B 67 10.168 6.984 36.961 1.00 73.24 H new ATOM 2980 N GLN B 68 8.851 9.573 36.509 1.00 2.12 N ATOM 2981 CA GLN B 68 8.653 10.983 36.827 1.00 44.13 C ATOM 2982 C GLN B 68 7.187 11.361 36.633 1.00 40.32 C ATOM 2983 O GLN B 68 6.746 12.422 37.066 1.00 64.50 O ATOM 2984 CB GLN B 68 9.549 11.873 35.956 1.00 33.05 C ATOM 2985 CG GLN B 68 9.370 11.661 34.460 1.00 52.44 C ATOM 2986 CD GLN B 68 10.024 12.755 33.632 1.00 54.32 C ATOM 2987 OE1 GLN B 68 11.186 12.659 33.249 1.00 53.51 O ATOM 2988 NE2 GLN B 68 9.278 13.818 33.368 1.00 53.21 N ATOM 0 H GLN B 68 8.938 9.376 35.512 1.00 2.12 H new ATOM 0 HA GLN B 68 8.928 11.141 37.870 1.00 44.13 H new ATOM 0 HB2 GLN B 68 9.344 12.917 36.191 1.00 33.05 H new ATOM 0 HB3 GLN B 68 10.591 11.687 36.216 1.00 33.05 H new ATOM 0 HG2 GLN B 68 9.794 10.696 34.180 1.00 52.44 H new ATOM 0 HG3 GLN B 68 8.306 11.621 34.227 1.00 52.44 H new ATOM 0 HE21 GLN B 68 8.316 13.862 33.703 1.00 53.21 H new ATOM 0 HE22 GLN B 68 9.666 14.592 32.829 1.00 53.21 H new ATOM 2997 N ASN B 69 6.448 10.475 35.971 1.00 21.43 N ATOM 2998 CA ASN B 69 5.020 10.675 35.712 1.00 41.54 C ATOM 2999 C ASN B 69 4.178 10.121 36.856 1.00 23.00 C ATOM 3000 O ASN B 69 2.948 10.224 36.835 1.00 34.41 O ATOM 3001 CB ASN B 69 4.614 10.005 34.387 1.00 65.13 C ATOM 3002 CG ASN B 69 4.907 10.855 33.158 1.00 21.52 C ATOM 3003 OD1 ASN B 69 4.182 10.798 32.163 1.00 65.21 O ATOM 3004 ND2 ASN B 69 5.978 11.630 33.201 1.00 45.52 N ATOM 0 H ASN B 69 6.818 9.600 35.599 1.00 21.43 H new ATOM 0 HA ASN B 69 4.838 11.747 35.636 1.00 41.54 H new ATOM 0 HB2 ASN B 69 5.139 9.054 34.294 1.00 65.13 H new ATOM 0 HB3 ASN B 69 3.548 9.779 34.416 1.00 65.13 H new ATOM 0 HD21 ASN B 69 6.225 12.204 32.395 1.00 45.52 H new ATOM 0 HD22 ASN B 69 6.557 11.654 34.040 1.00 45.52 H new ATOM 3011 N LYS B 70 4.850 9.533 37.848 1.00 4.22 N ATOM 3012 CA LYS B 70 4.182 8.963 39.023 1.00 71.04 C ATOM 3013 C LYS B 70 3.300 7.779 38.624 1.00 55.13 C ATOM 3014 O LYS B 70 2.237 7.548 39.206 1.00 71.33 O ATOM 3015 CB LYS B 70 3.358 10.034 39.762 1.00 43.15 C ATOM 3016 CG LYS B 70 4.194 10.977 40.631 1.00 61.50 C ATOM 3017 CD LYS B 70 5.403 11.529 39.882 1.00 21.25 C ATOM 3018 CE LYS B 70 5.977 12.770 40.554 1.00 20.34 C ATOM 3019 NZ LYS B 70 6.509 12.475 41.912 1.00 73.12 N1+ ATOM 0 H LYS B 70 5.865 9.438 37.861 1.00 4.22 H new ATOM 0 HA LYS B 70 4.951 8.600 39.705 1.00 71.04 H new ATOM 0 HB2 LYS B 70 2.809 10.624 39.029 1.00 43.15 H new ATOM 0 HB3 LYS B 70 2.618 9.538 40.391 1.00 43.15 H new ATOM 0 HG2 LYS B 70 3.570 11.804 40.971 1.00 61.50 H new ATOM 0 HG3 LYS B 70 4.531 10.445 41.521 1.00 61.50 H new ATOM 0 HD2 LYS B 70 6.174 10.760 39.822 1.00 21.25 H new ATOM 0 HD3 LYS B 70 5.115 11.772 38.859 1.00 21.25 H new ATOM 0 HE2 LYS B 70 6.774 13.182 39.934 1.00 20.34 H new ATOM 0 HE3 LYS B 70 5.203 13.534 40.626 1.00 20.34 H new ATOM 0 HZ1 LYS B 70 6.890 13.347 42.333 1.00 73.12 H new ATOM 0 HZ2 LYS B 70 5.744 12.106 42.512 1.00 73.12 H new ATOM 0 HZ3 LYS B 70 7.266 11.765 41.842 1.00 73.12 H new ATOM 3033 N GLN B 71 3.758 7.032 37.626 1.00 41.03 N ATOM 3034 CA GLN B 71 3.053 5.849 37.140 1.00 14.44 C ATOM 3035 C GLN B 71 4.038 4.702 36.935 1.00 73.31 C ATOM 3036 O GLN B 71 5.248 4.918 36.870 1.00 34.15 O ATOM 3037 CB GLN B 71 2.321 6.160 35.829 1.00 1.40 C ATOM 3038 CG GLN B 71 3.214 6.827 34.804 1.00 33.32 C ATOM 3039 CD GLN B 71 2.665 6.778 33.393 1.00 34.04 C ATOM 3040 OE1 GLN B 71 1.894 7.641 32.974 1.00 74.24 O ATOM 3041 NE2 GLN B 71 3.103 5.786 32.645 1.00 0.43 N ATOM 0 H GLN B 71 4.628 7.228 37.130 1.00 41.03 H new ATOM 0 HA GLN B 71 2.314 5.553 37.885 1.00 14.44 H new ATOM 0 HB2 GLN B 71 1.924 5.235 35.411 1.00 1.40 H new ATOM 0 HB3 GLN B 71 1.469 6.807 36.038 1.00 1.40 H new ATOM 0 HG2 GLN B 71 3.365 7.868 35.090 1.00 33.32 H new ATOM 0 HG3 GLN B 71 4.192 6.347 34.820 1.00 33.32 H new ATOM 0 HE21 GLN B 71 3.742 5.094 33.038 1.00 0.43 H new ATOM 0 HE22 GLN B 71 2.804 5.709 31.673 1.00 0.43 H new ATOM 3050 N THR B 72 3.524 3.486 36.845 1.00 1.35 N ATOM 3051 CA THR B 72 4.357 2.311 36.624 1.00 51.41 C ATOM 3052 C THR B 72 3.887 1.533 35.401 1.00 74.12 C ATOM 3053 O THR B 72 2.705 1.213 35.268 1.00 25.05 O ATOM 3054 CB THR B 72 4.362 1.382 37.858 1.00 13.02 C ATOM 3055 OG1 THR B 72 3.049 1.327 38.437 1.00 4.22 O ATOM 3056 CG2 THR B 72 5.369 1.852 38.903 1.00 71.50 C ATOM 0 H THR B 72 2.527 3.284 36.922 1.00 1.35 H new ATOM 0 HA THR B 72 5.373 2.665 36.452 1.00 51.41 H new ATOM 0 HB THR B 72 4.656 0.386 37.527 1.00 13.02 H new ATOM 0 HG1 THR B 72 3.060 0.735 39.218 1.00 4.22 H new ATOM 0 HG21 THR B 72 5.348 1.177 39.758 1.00 71.50 H new ATOM 0 HG22 THR B 72 6.369 1.856 38.469 1.00 71.50 H new ATOM 0 HG23 THR B 72 5.111 2.859 39.229 1.00 71.50 H new ATOM 3064 N LEU B 73 4.822 1.254 34.502 1.00 74.12 N ATOM 3065 CA LEU B 73 4.541 0.479 33.301 1.00 52.35 C ATOM 3066 C LEU B 73 5.201 -0.897 33.412 1.00 64.24 C ATOM 3067 O LEU B 73 6.353 -0.996 33.843 1.00 14.14 O ATOM 3068 CB LEU B 73 5.052 1.237 32.070 1.00 75.15 C ATOM 3069 CG LEU B 73 4.422 2.623 31.872 1.00 62.34 C ATOM 3070 CD1 LEU B 73 5.137 3.395 30.768 1.00 33.12 C ATOM 3071 CD2 LEU B 73 2.929 2.502 31.569 1.00 51.14 C ATOM 0 H LEU B 73 5.792 1.557 34.584 1.00 74.12 H new ATOM 0 HA LEU B 73 3.466 0.336 33.195 1.00 52.35 H new ATOM 0 HB2 LEU B 73 6.133 1.351 32.151 1.00 75.15 H new ATOM 0 HB3 LEU B 73 4.861 0.634 31.182 1.00 75.15 H new ATOM 0 HG LEU B 73 4.537 3.181 32.802 1.00 62.34 H new ATOM 0 HD11 LEU B 73 4.671 4.373 30.648 1.00 33.12 H new ATOM 0 HD12 LEU B 73 6.186 3.523 31.034 1.00 33.12 H new ATOM 0 HD13 LEU B 73 5.065 2.841 29.832 1.00 33.12 H new ATOM 0 HD21 LEU B 73 2.504 3.496 31.432 1.00 51.14 H new ATOM 0 HD22 LEU B 73 2.789 1.919 30.659 1.00 51.14 H new ATOM 0 HD23 LEU B 73 2.428 2.004 32.399 1.00 51.14 H new ATOM 3083 N PRO B 74 4.489 -1.966 33.001 1.00 22.31 N ATOM 3084 CA PRO B 74 4.937 -3.360 33.191 1.00 33.15 C ATOM 3085 C PRO B 74 6.319 -3.650 32.599 1.00 51.21 C ATOM 3086 O PRO B 74 6.757 -2.986 31.655 1.00 62.01 O ATOM 3087 CB PRO B 74 3.862 -4.183 32.463 1.00 23.12 C ATOM 3088 CG PRO B 74 2.658 -3.305 32.452 1.00 12.13 C ATOM 3089 CD PRO B 74 3.184 -1.903 32.312 1.00 51.43 C ATOM 0 HA PRO B 74 5.044 -3.595 34.250 1.00 33.15 H new ATOM 0 HB2 PRO B 74 4.176 -4.438 31.451 1.00 23.12 H new ATOM 0 HB3 PRO B 74 3.663 -5.121 32.981 1.00 23.12 H new ATOM 0 HG2 PRO B 74 1.994 -3.559 31.626 1.00 12.13 H new ATOM 0 HG3 PRO B 74 2.082 -3.418 33.370 1.00 12.13 H new ATOM 0 HD2 PRO B 74 3.293 -1.616 31.266 1.00 51.43 H new ATOM 0 HD3 PRO B 74 2.518 -1.174 32.775 1.00 51.43 H new ATOM 3097 N ALA B 75 7.018 -4.612 33.196 1.00 24.41 N ATOM 3098 CA ALA B 75 8.287 -5.107 32.662 1.00 71.53 C ATOM 3099 C ALA B 75 8.054 -6.055 31.490 1.00 71.01 C ATOM 3100 O ALA B 75 8.843 -6.119 30.550 1.00 12.42 O ATOM 3101 CB ALA B 75 9.091 -5.800 33.756 1.00 50.55 C ATOM 0 H ALA B 75 6.724 -5.069 34.059 1.00 24.41 H new ATOM 0 HA ALA B 75 8.858 -4.253 32.298 1.00 71.53 H new ATOM 0 HB1 ALA B 75 10.032 -6.162 33.342 1.00 50.55 H new ATOM 0 HB2 ALA B 75 9.297 -5.093 34.560 1.00 50.55 H new ATOM 0 HB3 ALA B 75 8.520 -6.641 34.150 1.00 50.55 H new ATOM 3107 N ASP B 76 6.934 -6.759 31.545 1.00 24.20 N ATOM 3108 CA ASP B 76 6.621 -7.833 30.591 1.00 60.22 C ATOM 3109 C ASP B 76 6.067 -7.276 29.274 1.00 14.12 C ATOM 3110 O ASP B 76 5.406 -7.979 28.508 1.00 34.13 O ATOM 3111 CB ASP B 76 5.614 -8.807 31.227 1.00 21.51 C ATOM 3112 CG ASP B 76 5.356 -10.042 30.371 1.00 33.51 C ATOM 3113 OD1 ASP B 76 6.314 -10.803 30.116 1.00 23.44 O ATOM 3114 OD2 ASP B 76 4.193 -10.272 29.972 1.00 41.11 O1- ATOM 0 H ASP B 76 6.211 -6.609 32.249 1.00 24.20 H new ATOM 0 HA ASP B 76 7.544 -8.363 30.357 1.00 60.22 H new ATOM 0 HB2 ASP B 76 5.986 -9.120 32.203 1.00 21.51 H new ATOM 0 HB3 ASP B 76 4.672 -8.286 31.397 1.00 21.51 H new ATOM 3119 N THR B 77 6.361 -6.017 29.001 1.00 44.41 N ATOM 3120 CA THR B 77 5.877 -5.355 27.802 1.00 1.21 C ATOM 3121 C THR B 77 6.897 -5.461 26.668 1.00 31.44 C ATOM 3122 O THR B 77 8.095 -5.664 26.907 1.00 72.52 O ATOM 3123 CB THR B 77 5.553 -3.874 28.099 1.00 44.03 C ATOM 3124 OG1 THR B 77 5.127 -3.200 26.911 1.00 73.25 O ATOM 3125 CG2 THR B 77 6.758 -3.145 28.684 1.00 30.02 C ATOM 0 H THR B 77 6.939 -5.427 29.600 1.00 44.41 H new ATOM 0 HA THR B 77 4.963 -5.856 27.483 1.00 1.21 H new ATOM 0 HB THR B 77 4.747 -3.863 28.833 1.00 44.03 H new ATOM 0 HG1 THR B 77 4.458 -3.746 26.447 1.00 73.25 H new ATOM 0 HG21 THR B 77 6.494 -2.106 28.881 1.00 30.02 H new ATOM 0 HG22 THR B 77 7.057 -3.626 29.615 1.00 30.02 H new ATOM 0 HG23 THR B 77 7.585 -3.181 27.975 1.00 30.02 H new ATOM 3133 N THR B 78 6.411 -5.335 25.436 1.00 70.31 N ATOM 3134 CA THR B 78 7.254 -5.423 24.250 1.00 64.53 C ATOM 3135 C THR B 78 6.859 -4.377 23.218 1.00 71.23 C ATOM 3136 O THR B 78 5.697 -3.974 23.136 1.00 64.44 O ATOM 3137 CB THR B 78 7.177 -6.823 23.598 1.00 53.44 C ATOM 3138 OG1 THR B 78 5.838 -7.332 23.656 1.00 34.22 O ATOM 3139 CG2 THR B 78 8.131 -7.790 24.275 1.00 23.30 C ATOM 0 H THR B 78 5.425 -5.170 25.233 1.00 70.31 H new ATOM 0 HA THR B 78 8.277 -5.241 24.580 1.00 64.53 H new ATOM 0 HB THR B 78 7.471 -6.723 22.553 1.00 53.44 H new ATOM 0 HG1 THR B 78 5.806 -8.218 23.238 1.00 34.22 H new ATOM 0 HG21 THR B 78 8.058 -8.767 23.798 1.00 23.30 H new ATOM 0 HG22 THR B 78 9.151 -7.418 24.185 1.00 23.30 H new ATOM 0 HG23 THR B 78 7.870 -7.880 25.329 1.00 23.30 H new ATOM 3147 N VAL B 79 7.835 -3.951 22.433 1.00 22.45 N ATOM 3148 CA VAL B 79 7.601 -3.033 21.322 1.00 23.02 C ATOM 3149 C VAL B 79 8.319 -3.545 20.083 1.00 31.21 C ATOM 3150 O VAL B 79 9.547 -3.649 20.061 1.00 14.34 O ATOM 3151 CB VAL B 79 8.060 -1.585 21.643 1.00 21.11 C ATOM 3152 CG1 VAL B 79 8.004 -0.701 20.395 1.00 1.41 C ATOM 3153 CG2 VAL B 79 7.197 -0.991 22.754 1.00 54.24 C ATOM 0 H VAL B 79 8.810 -4.229 22.544 1.00 22.45 H new ATOM 0 HA VAL B 79 6.526 -2.995 21.145 1.00 23.02 H new ATOM 0 HB VAL B 79 9.095 -1.624 21.983 1.00 21.11 H new ATOM 0 HG11 VAL B 79 8.331 0.308 20.649 1.00 1.41 H new ATOM 0 HG12 VAL B 79 8.660 -1.113 19.628 1.00 1.41 H new ATOM 0 HG13 VAL B 79 6.982 -0.667 20.019 1.00 1.41 H new ATOM 0 HG21 VAL B 79 7.529 0.024 22.969 1.00 54.24 H new ATOM 0 HG22 VAL B 79 6.155 -0.972 22.434 1.00 54.24 H new ATOM 0 HG23 VAL B 79 7.290 -1.601 23.652 1.00 54.24 H new ATOM 3163 N THR B 80 7.547 -3.894 19.067 1.00 72.42 N ATOM 3164 CA THR B 80 8.097 -4.454 17.843 1.00 23.21 C ATOM 3165 C THR B 80 8.137 -3.404 16.733 1.00 63.22 C ATOM 3166 O THR B 80 7.095 -2.977 16.237 1.00 42.43 O ATOM 3167 CB THR B 80 7.272 -5.676 17.384 1.00 22.40 C ATOM 3168 OG1 THR B 80 7.128 -6.593 18.481 1.00 71.34 O ATOM 3169 CG2 THR B 80 7.942 -6.385 16.208 1.00 64.25 C ATOM 0 H THR B 80 6.531 -3.799 19.066 1.00 72.42 H new ATOM 0 HA THR B 80 9.117 -4.777 18.052 1.00 23.21 H new ATOM 0 HB THR B 80 6.292 -5.327 17.057 1.00 22.40 H new ATOM 0 HG1 THR B 80 6.603 -7.369 18.192 1.00 71.34 H new ATOM 0 HG21 THR B 80 7.338 -7.241 15.907 1.00 64.25 H new ATOM 0 HG22 THR B 80 8.034 -5.693 15.371 1.00 64.25 H new ATOM 0 HG23 THR B 80 8.933 -6.727 16.506 1.00 64.25 H new ATOM 3177 N ALA B 81 9.345 -2.986 16.370 1.00 41.34 N ATOM 3178 CA ALA B 81 9.557 -2.047 15.278 1.00 73.43 C ATOM 3179 C ALA B 81 9.817 -2.813 13.986 1.00 13.31 C ATOM 3180 O ALA B 81 10.841 -3.487 13.849 1.00 32.14 O ATOM 3181 CB ALA B 81 10.733 -1.126 15.590 1.00 31.52 C ATOM 0 H ALA B 81 10.205 -3.290 16.826 1.00 41.34 H new ATOM 0 HA ALA B 81 8.663 -1.436 15.158 1.00 73.43 H new ATOM 0 HB1 ALA B 81 10.879 -0.430 14.764 1.00 31.52 H new ATOM 0 HB2 ALA B 81 10.526 -0.568 16.503 1.00 31.52 H new ATOM 0 HB3 ALA B 81 11.636 -1.722 15.726 1.00 31.52 H new ATOM 3187 N GLU B 82 8.877 -2.737 13.058 1.00 50.12 N ATOM 3188 CA GLU B 82 9.012 -3.399 11.768 1.00 53.10 C ATOM 3189 C GLU B 82 9.161 -2.336 10.684 1.00 51.21 C ATOM 3190 O GLU B 82 8.203 -1.639 10.352 1.00 13.21 O ATOM 3191 CB GLU B 82 7.789 -4.295 11.521 1.00 51.24 C ATOM 3192 CG GLU B 82 7.935 -5.260 10.352 1.00 31.41 C ATOM 3193 CD GLU B 82 6.840 -6.318 10.342 1.00 63.34 C ATOM 3194 OE1 GLU B 82 5.884 -6.198 9.549 1.00 35.34 O ATOM 3195 OE2 GLU B 82 6.914 -7.262 11.159 1.00 71.23 O1- ATOM 0 H GLU B 82 8.006 -2.220 13.174 1.00 50.12 H new ATOM 0 HA GLU B 82 9.897 -4.035 11.752 1.00 53.10 H new ATOM 0 HB2 GLU B 82 7.587 -4.869 12.425 1.00 51.24 H new ATOM 0 HB3 GLU B 82 6.920 -3.661 11.345 1.00 51.24 H new ATOM 0 HG2 GLU B 82 7.908 -4.702 9.416 1.00 31.41 H new ATOM 0 HG3 GLU B 82 8.909 -5.747 10.404 1.00 31.41 H new ATOM 3202 N VAL B 83 10.371 -2.212 10.147 1.00 40.31 N ATOM 3203 CA VAL B 83 10.714 -1.111 9.246 1.00 71.44 C ATOM 3204 C VAL B 83 10.870 -1.603 7.814 1.00 35.11 C ATOM 3205 O VAL B 83 11.394 -2.691 7.578 1.00 1.44 O ATOM 3206 CB VAL B 83 12.021 -0.400 9.695 1.00 65.23 C ATOM 3207 CG1 VAL B 83 13.208 -1.363 9.683 1.00 71.22 C ATOM 3208 CG2 VAL B 83 12.305 0.830 8.830 1.00 51.35 C ATOM 0 H VAL B 83 11.136 -2.864 10.320 1.00 40.31 H new ATOM 0 HA VAL B 83 9.893 -0.395 9.288 1.00 71.44 H new ATOM 0 HB VAL B 83 11.877 -0.062 10.721 1.00 65.23 H new ATOM 0 HG11 VAL B 83 14.107 -0.836 10.002 1.00 71.22 H new ATOM 0 HG12 VAL B 83 13.012 -2.191 10.364 1.00 71.22 H new ATOM 0 HG13 VAL B 83 13.353 -1.750 8.674 1.00 71.22 H new ATOM 0 HG21 VAL B 83 13.225 1.307 9.167 1.00 51.35 H new ATOM 0 HG22 VAL B 83 12.414 0.525 7.789 1.00 51.35 H new ATOM 0 HG23 VAL B 83 11.478 1.535 8.917 1.00 51.35 H new ATOM 3218 N GLY B 84 10.400 -0.805 6.860 1.00 51.11 N ATOM 3219 CA GLY B 84 10.504 -1.169 5.468 1.00 52.45 C ATOM 3220 C GLY B 84 10.899 -0.003 4.596 1.00 30.33 C ATOM 3221 O GLY B 84 10.867 1.150 5.027 1.00 4.21 O ATOM 0 H GLY B 84 9.947 0.092 7.033 1.00 51.11 H new ATOM 0 HA2 GLY B 84 11.239 -1.967 5.358 1.00 52.45 H new ATOM 0 HA3 GLY B 84 9.548 -1.567 5.127 1.00 52.45 H new ATOM 3225 N ILE B 85 11.246 -0.316 3.362 1.00 72.33 N ATOM 3226 CA ILE B 85 11.690 0.661 2.390 1.00 70.35 C ATOM 3227 C ILE B 85 11.037 0.349 1.053 1.00 24.30 C ATOM 3228 O ILE B 85 11.013 -0.818 0.622 1.00 65.43 O ATOM 3229 CB ILE B 85 13.245 0.667 2.263 1.00 43.15 C ATOM 3230 CG1 ILE B 85 13.735 1.666 1.186 1.00 73.10 C ATOM 3231 CG2 ILE B 85 13.767 -0.741 1.978 1.00 2.22 C ATOM 3232 CD1 ILE B 85 13.809 1.095 -0.221 1.00 22.31 C ATOM 0 H ILE B 85 11.227 -1.270 3.003 1.00 72.33 H new ATOM 0 HA ILE B 85 11.394 1.657 2.719 1.00 70.35 H new ATOM 0 HB ILE B 85 13.649 1.001 3.219 1.00 43.15 H new ATOM 0 HG12 ILE B 85 13.068 2.528 1.179 1.00 73.10 H new ATOM 0 HG13 ILE B 85 14.723 2.029 1.469 1.00 73.10 H new ATOM 0 HG21 ILE B 85 14.853 -0.716 1.893 1.00 2.22 H new ATOM 0 HG22 ILE B 85 13.482 -1.407 2.793 1.00 2.22 H new ATOM 0 HG23 ILE B 85 13.338 -1.106 1.045 1.00 2.22 H new ATOM 0 HD11 ILE B 85 14.161 1.864 -0.908 1.00 22.31 H new ATOM 0 HD12 ILE B 85 14.499 0.252 -0.236 1.00 22.31 H new ATOM 0 HD13 ILE B 85 12.819 0.759 -0.530 1.00 22.31 H new ATOM 3244 N GLY B 86 10.489 1.388 0.430 1.00 43.24 N ATOM 3245 CA GLY B 86 9.789 1.255 -0.837 1.00 50.02 C ATOM 3246 C GLY B 86 9.929 2.507 -1.682 1.00 52.30 C ATOM 3247 O GLY B 86 10.424 3.525 -1.189 1.00 42.02 O ATOM 0 H GLY B 86 10.519 2.342 0.790 1.00 43.24 H new ATOM 0 HA2 GLY B 86 10.184 0.399 -1.384 1.00 50.02 H new ATOM 0 HA3 GLY B 86 8.734 1.056 -0.652 1.00 50.02 H new ATOM 3251 N PRO B 87 9.519 2.473 -2.962 1.00 42.21 N ATOM 3252 CA PRO B 87 9.662 3.607 -3.865 1.00 30.25 C ATOM 3253 C PRO B 87 8.563 4.645 -3.669 1.00 61.30 C ATOM 3254 O PRO B 87 7.373 4.345 -3.803 1.00 52.32 O ATOM 3255 CB PRO B 87 9.568 2.982 -5.271 1.00 44.10 C ATOM 3256 CG PRO B 87 9.332 1.516 -5.060 1.00 14.42 C ATOM 3257 CD PRO B 87 8.861 1.354 -3.638 1.00 45.13 C ATOM 0 HA PRO B 87 10.596 4.141 -3.691 1.00 30.25 H new ATOM 0 HB2 PRO B 87 8.755 3.429 -5.843 1.00 44.10 H new ATOM 0 HB3 PRO B 87 10.485 3.152 -5.835 1.00 44.10 H new ATOM 0 HG2 PRO B 87 8.586 1.139 -5.760 1.00 14.42 H new ATOM 0 HG3 PRO B 87 10.246 0.948 -5.232 1.00 14.42 H new ATOM 0 HD2 PRO B 87 7.775 1.413 -3.560 1.00 45.13 H new ATOM 0 HD3 PRO B 87 9.159 0.393 -3.218 1.00 45.13 H new ATOM 3265 N ASN B 88 8.978 5.860 -3.350 1.00 53.24 N ATOM 3266 CA ASN B 88 8.063 6.987 -3.229 1.00 21.43 C ATOM 3267 C ASN B 88 7.566 7.370 -4.617 1.00 21.10 C ATOM 3268 O ASN B 88 8.347 7.398 -5.570 1.00 51.23 O ATOM 3269 CB ASN B 88 8.780 8.181 -2.575 1.00 72.30 C ATOM 3270 CG ASN B 88 7.858 9.353 -2.252 1.00 63.22 C ATOM 3271 OD1 ASN B 88 6.837 9.567 -2.903 1.00 5.32 O ATOM 3272 ND2 ASN B 88 8.231 10.134 -1.249 1.00 3.11 N ATOM 0 H ASN B 88 9.954 6.094 -3.168 1.00 53.24 H new ATOM 0 HA ASN B 88 7.217 6.707 -2.602 1.00 21.43 H new ATOM 0 HB2 ASN B 88 9.260 7.845 -1.656 1.00 72.30 H new ATOM 0 HB3 ASN B 88 9.571 8.526 -3.240 1.00 72.30 H new ATOM 0 HD21 ASN B 88 7.665 10.943 -0.995 1.00 3.11 H new ATOM 0 HD22 ASN B 88 9.085 9.926 -0.731 1.00 3.11 H new ATOM 3279 N GLU B 89 6.280 7.676 -4.722 1.00 65.22 N ATOM 3280 CA GLU B 89 5.670 8.037 -5.999 1.00 51.32 C ATOM 3281 C GLU B 89 6.332 9.283 -6.596 1.00 22.42 C ATOM 3282 O GLU B 89 6.243 9.536 -7.798 1.00 11.02 O ATOM 3283 CB GLU B 89 4.162 8.258 -5.813 1.00 62.31 C ATOM 3284 CG GLU B 89 3.818 9.255 -4.709 1.00 11.15 C ATOM 3285 CD GLU B 89 2.320 9.415 -4.510 1.00 24.23 C ATOM 3286 OE1 GLU B 89 1.711 8.572 -3.817 1.00 4.32 O ATOM 3287 OE2 GLU B 89 1.745 10.385 -5.049 1.00 35.35 O1- ATOM 0 H GLU B 89 5.633 7.682 -3.933 1.00 65.22 H new ATOM 0 HA GLU B 89 5.823 7.216 -6.699 1.00 51.32 H new ATOM 0 HB2 GLU B 89 3.737 8.610 -6.753 1.00 62.31 H new ATOM 0 HB3 GLU B 89 3.689 7.302 -5.587 1.00 62.31 H new ATOM 0 HG2 GLU B 89 4.272 8.926 -3.774 1.00 11.15 H new ATOM 0 HG3 GLU B 89 4.254 10.224 -4.951 1.00 11.15 H new ATOM 3294 N GLU B 90 7.002 10.047 -5.740 1.00 52.12 N ATOM 3295 CA GLU B 90 7.729 11.245 -6.154 1.00 15.12 C ATOM 3296 C GLU B 90 8.961 10.884 -6.998 1.00 74.05 C ATOM 3297 O GLU B 90 9.488 11.708 -7.751 1.00 53.12 O ATOM 3298 CB GLU B 90 8.122 12.045 -4.906 1.00 14.23 C ATOM 3299 CG GLU B 90 9.141 13.144 -5.155 1.00 30.33 C ATOM 3300 CD GLU B 90 9.255 14.102 -3.980 1.00 5.15 C ATOM 3301 OE1 GLU B 90 9.872 13.738 -2.962 1.00 54.43 O ATOM 3302 OE2 GLU B 90 8.697 15.220 -4.064 1.00 12.50 O1- ATOM 0 H GLU B 90 7.057 9.855 -4.740 1.00 52.12 H new ATOM 0 HA GLU B 90 7.084 11.858 -6.784 1.00 15.12 H new ATOM 0 HB2 GLU B 90 7.224 12.490 -4.478 1.00 14.23 H new ATOM 0 HB3 GLU B 90 8.523 11.358 -4.161 1.00 14.23 H new ATOM 0 HG2 GLU B 90 10.115 12.696 -5.351 1.00 30.33 H new ATOM 0 HG3 GLU B 90 8.860 13.701 -6.049 1.00 30.33 H new ATOM 3309 N GLY B 91 9.388 9.635 -6.893 1.00 72.20 N ATOM 3310 CA GLY B 91 10.536 9.156 -7.647 1.00 12.11 C ATOM 3311 C GLY B 91 11.773 9.015 -6.788 1.00 71.02 C ATOM 3312 O GLY B 91 12.894 9.250 -7.244 1.00 5.53 O ATOM 0 H GLY B 91 8.956 8.934 -6.292 1.00 72.20 H new ATOM 0 HA2 GLY B 91 10.296 8.192 -8.095 1.00 12.11 H new ATOM 0 HA3 GLY B 91 10.742 9.845 -8.466 1.00 12.11 H new ATOM 3316 N GLY B 92 11.562 8.623 -5.538 1.00 60.34 N ATOM 3317 CA GLY B 92 12.657 8.370 -4.620 1.00 61.32 C ATOM 3318 C GLY B 92 12.356 7.175 -3.741 1.00 12.52 C ATOM 3319 O GLY B 92 11.536 6.334 -4.106 1.00 70.13 O ATOM 0 H GLY B 92 10.636 8.474 -5.138 1.00 60.34 H new ATOM 0 HA2 GLY B 92 13.574 8.192 -5.181 1.00 61.32 H new ATOM 0 HA3 GLY B 92 12.828 9.250 -4.000 1.00 61.32 H new ATOM 3323 N PHE B 93 12.999 7.096 -2.585 1.00 71.13 N ATOM 3324 CA PHE B 93 12.732 6.020 -1.635 1.00 4.00 C ATOM 3325 C PHE B 93 11.978 6.561 -0.430 1.00 73.12 C ATOM 3326 O PHE B 93 11.994 7.765 -0.168 1.00 63.14 O ATOM 3327 CB PHE B 93 14.037 5.350 -1.187 1.00 42.41 C ATOM 3328 CG PHE B 93 14.786 4.683 -2.314 1.00 52.32 C ATOM 3329 CD1 PHE B 93 16.025 5.156 -2.723 1.00 72.40 C ATOM 3330 CD2 PHE B 93 14.246 3.583 -2.966 1.00 72.15 C ATOM 3331 CE1 PHE B 93 16.707 4.544 -3.755 1.00 54.33 C ATOM 3332 CE2 PHE B 93 14.928 2.968 -4.000 1.00 20.53 C ATOM 3333 CZ PHE B 93 16.159 3.449 -4.395 1.00 20.53 C ATOM 0 H PHE B 93 13.709 7.762 -2.280 1.00 71.13 H new ATOM 0 HA PHE B 93 12.117 5.270 -2.131 1.00 4.00 H new ATOM 0 HB2 PHE B 93 14.681 6.098 -0.726 1.00 42.41 H new ATOM 0 HB3 PHE B 93 13.811 4.608 -0.421 1.00 42.41 H new ATOM 0 HD1 PHE B 93 16.460 6.012 -2.229 1.00 72.40 H new ATOM 0 HD2 PHE B 93 13.282 3.203 -2.662 1.00 72.15 H new ATOM 0 HE1 PHE B 93 17.671 4.922 -4.063 1.00 54.33 H new ATOM 0 HE2 PHE B 93 14.497 2.112 -4.498 1.00 20.53 H new ATOM 0 HZ PHE B 93 16.693 2.971 -5.203 1.00 20.53 H new ATOM 3343 N ALA B 94 11.314 5.670 0.290 1.00 22.42 N ATOM 3344 CA ALA B 94 10.541 6.047 1.463 1.00 62.21 C ATOM 3345 C ALA B 94 10.627 4.956 2.521 1.00 42.21 C ATOM 3346 O ALA B 94 10.649 3.763 2.196 1.00 61.15 O ATOM 3347 CB ALA B 94 9.089 6.318 1.080 1.00 43.22 C ATOM 0 H ALA B 94 11.295 4.672 0.080 1.00 22.42 H new ATOM 0 HA ALA B 94 10.959 6.964 1.879 1.00 62.21 H new ATOM 0 HB1 ALA B 94 8.525 6.599 1.969 1.00 43.22 H new ATOM 0 HB2 ALA B 94 9.050 7.130 0.354 1.00 43.22 H new ATOM 0 HB3 ALA B 94 8.654 5.419 0.643 1.00 43.22 H new ATOM 3353 N LEU B 95 10.711 5.376 3.780 1.00 51.40 N ATOM 3354 CA LEU B 95 10.781 4.456 4.909 1.00 52.52 C ATOM 3355 C LEU B 95 9.423 4.355 5.591 1.00 31.45 C ATOM 3356 O LEU B 95 8.734 5.358 5.784 1.00 74.21 O ATOM 3357 CB LEU B 95 11.864 4.901 5.912 1.00 5.44 C ATOM 3358 CG LEU B 95 13.308 4.486 5.566 1.00 70.54 C ATOM 3359 CD1 LEU B 95 13.479 2.976 5.701 1.00 3.52 C ATOM 3360 CD2 LEU B 95 13.685 4.944 4.158 1.00 13.14 C ATOM 0 H LEU B 95 10.732 6.361 4.045 1.00 51.40 H new ATOM 0 HA LEU B 95 11.055 3.470 4.534 1.00 52.52 H new ATOM 0 HB2 LEU B 95 11.829 5.987 5.998 1.00 5.44 H new ATOM 0 HB3 LEU B 95 11.614 4.495 6.892 1.00 5.44 H new ATOM 0 HG LEU B 95 13.979 4.975 6.273 1.00 70.54 H new ATOM 0 HD11 LEU B 95 14.504 2.702 5.453 1.00 3.52 H new ATOM 0 HD12 LEU B 95 13.261 2.675 6.726 1.00 3.52 H new ATOM 0 HD13 LEU B 95 12.794 2.470 5.021 1.00 3.52 H new ATOM 0 HD21 LEU B 95 14.708 4.639 3.938 1.00 13.14 H new ATOM 0 HD22 LEU B 95 13.008 4.491 3.434 1.00 13.14 H new ATOM 0 HD23 LEU B 95 13.609 6.030 4.096 1.00 13.14 H new ATOM 3372 N ASP B 96 9.063 3.135 5.958 1.00 51.23 N ATOM 3373 CA ASP B 96 7.751 2.829 6.528 1.00 11.24 C ATOM 3374 C ASP B 96 7.908 1.851 7.677 1.00 14.30 C ATOM 3375 O ASP B 96 8.249 0.690 7.462 1.00 55.22 O ATOM 3376 CB ASP B 96 6.873 2.201 5.453 1.00 22.11 C ATOM 3377 CG ASP B 96 5.479 1.826 5.931 1.00 4.43 C ATOM 3378 OD1 ASP B 96 4.709 2.729 6.315 1.00 73.12 O ATOM 3379 OD2 ASP B 96 5.140 0.620 5.896 1.00 73.53 O1- ATOM 0 H ASP B 96 9.673 2.322 5.870 1.00 51.23 H new ATOM 0 HA ASP B 96 7.292 3.747 6.894 1.00 11.24 H new ATOM 0 HB2 ASP B 96 6.784 2.897 4.619 1.00 22.11 H new ATOM 0 HB3 ASP B 96 7.367 1.308 5.071 1.00 22.11 H new ATOM 3384 N VAL B 97 7.665 2.311 8.885 1.00 43.21 N ATOM 3385 CA VAL B 97 7.895 1.486 10.071 1.00 65.34 C ATOM 3386 C VAL B 97 6.671 1.437 10.982 1.00 4.12 C ATOM 3387 O VAL B 97 6.094 2.465 11.336 1.00 1.23 O ATOM 3388 CB VAL B 97 9.140 1.967 10.871 1.00 44.15 C ATOM 3389 CG1 VAL B 97 9.050 3.455 11.189 1.00 31.14 C ATOM 3390 CG2 VAL B 97 9.327 1.145 12.150 1.00 13.32 C ATOM 0 H VAL B 97 7.310 3.247 9.081 1.00 43.21 H new ATOM 0 HA VAL B 97 8.086 0.475 9.710 1.00 65.34 H new ATOM 0 HB VAL B 97 10.016 1.812 10.242 1.00 44.15 H new ATOM 0 HG11 VAL B 97 9.934 3.762 11.748 1.00 31.14 H new ATOM 0 HG12 VAL B 97 8.993 4.023 10.260 1.00 31.14 H new ATOM 0 HG13 VAL B 97 8.158 3.646 11.786 1.00 31.14 H new ATOM 0 HG21 VAL B 97 10.204 1.504 12.688 1.00 13.32 H new ATOM 0 HG22 VAL B 97 8.445 1.250 12.782 1.00 13.32 H new ATOM 0 HG23 VAL B 97 9.464 0.095 11.891 1.00 13.32 H new ATOM 3400 N GLU B 98 6.277 0.220 11.336 1.00 55.41 N ATOM 3401 CA GLU B 98 5.188 -0.014 12.273 1.00 61.25 C ATOM 3402 C GLU B 98 5.754 -0.226 13.670 1.00 55.42 C ATOM 3403 O GLU B 98 6.580 -1.119 13.881 1.00 74.01 O ATOM 3404 CB GLU B 98 4.353 -1.248 11.874 1.00 43.20 C ATOM 3405 CG GLU B 98 3.600 -1.117 10.553 1.00 33.43 C ATOM 3406 CD GLU B 98 4.467 -1.393 9.332 1.00 35.25 C ATOM 3407 OE1 GLU B 98 4.457 -2.538 8.830 1.00 70.42 O ATOM 3408 OE2 GLU B 98 5.143 -0.468 8.851 1.00 74.42 O1- ATOM 0 H GLU B 98 6.706 -0.634 10.980 1.00 55.41 H new ATOM 0 HA GLU B 98 4.538 0.861 12.256 1.00 61.25 H new ATOM 0 HB2 GLU B 98 5.015 -2.112 11.814 1.00 43.20 H new ATOM 0 HB3 GLU B 98 3.633 -1.453 12.667 1.00 43.20 H new ATOM 0 HG2 GLU B 98 2.757 -1.808 10.554 1.00 33.43 H new ATOM 0 HG3 GLU B 98 3.188 -0.111 10.477 1.00 33.43 H new ATOM 3415 N LEU B 99 5.320 0.594 14.616 1.00 61.12 N ATOM 3416 CA LEU B 99 5.698 0.421 16.014 1.00 54.24 C ATOM 3417 C LEU B 99 4.565 -0.267 16.757 1.00 51.12 C ATOM 3418 O LEU B 99 3.522 0.338 17.008 1.00 12.44 O ATOM 3419 CB LEU B 99 6.028 1.769 16.675 1.00 60.12 C ATOM 3420 CG LEU B 99 7.297 2.466 16.157 1.00 42.10 C ATOM 3421 CD1 LEU B 99 7.537 3.773 16.908 1.00 24.34 C ATOM 3422 CD2 LEU B 99 8.508 1.545 16.279 1.00 1.13 C ATOM 0 H LEU B 99 4.704 1.388 14.442 1.00 61.12 H new ATOM 0 HA LEU B 99 6.596 -0.196 16.059 1.00 54.24 H new ATOM 0 HB2 LEU B 99 5.181 2.441 16.533 1.00 60.12 H new ATOM 0 HB3 LEU B 99 6.133 1.612 17.748 1.00 60.12 H new ATOM 0 HG LEU B 99 7.151 2.699 15.102 1.00 42.10 H new ATOM 0 HD11 LEU B 99 8.439 4.251 16.527 1.00 24.34 H new ATOM 0 HD12 LEU B 99 6.685 4.438 16.763 1.00 24.34 H new ATOM 0 HD13 LEU B 99 7.658 3.565 17.971 1.00 24.34 H new ATOM 0 HD21 LEU B 99 9.395 2.058 15.907 1.00 1.13 H new ATOM 0 HD22 LEU B 99 8.657 1.276 17.325 1.00 1.13 H new ATOM 0 HD23 LEU B 99 8.339 0.642 15.693 1.00 1.13 H new ATOM 3434 N ARG B 100 4.771 -1.532 17.097 1.00 53.41 N ATOM 3435 CA ARG B 100 3.743 -2.335 17.748 1.00 2.45 C ATOM 3436 C ARG B 100 3.992 -2.377 19.243 1.00 14.01 C ATOM 3437 O ARG B 100 4.977 -2.958 19.699 1.00 24.14 O ATOM 3438 CB ARG B 100 3.737 -3.759 17.185 1.00 53.52 C ATOM 3439 CG ARG B 100 3.474 -3.829 15.688 1.00 13.43 C ATOM 3440 CD ARG B 100 3.545 -5.262 15.188 1.00 64.11 C ATOM 3441 NE ARG B 100 3.311 -5.367 13.744 1.00 3.43 N ATOM 3442 CZ ARG B 100 4.209 -5.825 12.864 1.00 52.33 C ATOM 3443 NH1 ARG B 100 5.414 -6.207 13.268 1.00 41.53 N1+ ATOM 3444 NH2 ARG B 100 3.898 -5.903 11.576 1.00 11.32 N ATOM 0 H ARG B 100 5.647 -2.028 16.932 1.00 53.41 H new ATOM 0 HA ARG B 100 2.772 -1.879 17.555 1.00 2.45 H new ATOM 0 HB2 ARG B 100 4.698 -4.227 17.397 1.00 53.52 H new ATOM 0 HB3 ARG B 100 2.977 -4.342 17.705 1.00 53.52 H new ATOM 0 HG2 ARG B 100 2.491 -3.412 15.468 1.00 13.43 H new ATOM 0 HG3 ARG B 100 4.205 -3.219 15.158 1.00 13.43 H new ATOM 0 HD2 ARG B 100 4.524 -5.678 15.425 1.00 64.11 H new ATOM 0 HD3 ARG B 100 2.807 -5.865 15.717 1.00 64.11 H new ATOM 0 HE ARG B 100 2.403 -5.071 13.386 1.00 3.43 H new ATOM 0 HH11 ARG B 100 5.662 -6.153 14.256 1.00 41.53 H new ATOM 0 HH12 ARG B 100 6.093 -6.555 12.591 1.00 41.53 H new ATOM 0 HH21 ARG B 100 2.974 -5.614 11.256 1.00 11.32 H new ATOM 0 HH22 ARG B 100 4.583 -6.252 10.906 1.00 11.32 H new ATOM 3458 N VAL B 101 3.100 -1.758 19.999 1.00 41.00 N ATOM 3459 CA VAL B 101 3.267 -1.625 21.435 1.00 50.20 C ATOM 3460 C VAL B 101 2.389 -2.624 22.177 1.00 3.30 C ATOM 3461 O VAL B 101 1.185 -2.412 22.321 1.00 1.54 O ATOM 3462 CB VAL B 101 2.914 -0.193 21.900 1.00 60.12 C ATOM 3463 CG1 VAL B 101 3.048 -0.064 23.414 1.00 22.35 C ATOM 3464 CG2 VAL B 101 3.790 0.837 21.185 1.00 51.31 C ATOM 0 H VAL B 101 2.245 -1.336 19.636 1.00 41.00 H new ATOM 0 HA VAL B 101 4.313 -1.828 21.664 1.00 50.20 H new ATOM 0 HB VAL B 101 1.874 0.004 21.638 1.00 60.12 H new ATOM 0 HG11 VAL B 101 2.794 0.952 23.716 1.00 22.35 H new ATOM 0 HG12 VAL B 101 2.372 -0.767 23.900 1.00 22.35 H new ATOM 0 HG13 VAL B 101 4.074 -0.285 23.709 1.00 22.35 H new ATOM 0 HG21 VAL B 101 3.526 1.838 21.526 1.00 51.31 H new ATOM 0 HG22 VAL B 101 4.839 0.642 21.410 1.00 51.31 H new ATOM 0 HG23 VAL B 101 3.630 0.766 20.109 1.00 51.31 H new ATOM 3474 N ALA B 102 2.987 -3.718 22.630 1.00 24.03 N ATOM 3475 CA ALA B 102 2.262 -4.707 23.415 1.00 53.32 C ATOM 3476 C ALA B 102 2.455 -4.424 24.898 1.00 44.40 C ATOM 3477 O ALA B 102 3.493 -4.757 25.475 1.00 4.42 O ATOM 3478 CB ALA B 102 2.732 -6.116 23.064 1.00 42.24 C ATOM 0 H ALA B 102 3.969 -3.942 22.468 1.00 24.03 H new ATOM 0 HA ALA B 102 1.199 -4.641 23.181 1.00 53.32 H new ATOM 0 HB1 ALA B 102 2.180 -6.843 23.660 1.00 42.24 H new ATOM 0 HB2 ALA B 102 2.555 -6.305 22.005 1.00 42.24 H new ATOM 0 HB3 ALA B 102 3.797 -6.208 23.276 1.00 42.24 H new ATOM 3484 N LEU B 103 1.444 -3.813 25.503 1.00 61.44 N ATOM 3485 CA LEU B 103 1.477 -3.449 26.916 1.00 72.24 C ATOM 3486 C LEU B 103 0.456 -4.277 27.690 1.00 41.41 C ATOM 3487 O LEU B 103 -0.753 -4.121 27.498 1.00 40.11 O ATOM 3488 CB LEU B 103 1.207 -1.942 27.094 1.00 55.34 C ATOM 3489 CG LEU B 103 2.449 -1.032 27.005 1.00 34.43 C ATOM 3490 CD1 LEU B 103 2.046 0.428 26.809 1.00 40.33 C ATOM 3491 CD2 LEU B 103 3.302 -1.175 28.267 1.00 1.40 C ATOM 0 H LEU B 103 0.578 -3.556 25.029 1.00 61.44 H new ATOM 0 HA LEU B 103 2.470 -3.662 27.312 1.00 72.24 H new ATOM 0 HB2 LEU B 103 0.491 -1.626 26.335 1.00 55.34 H new ATOM 0 HB3 LEU B 103 0.733 -1.787 28.063 1.00 55.34 H new ATOM 0 HG LEU B 103 3.035 -1.344 26.141 1.00 34.43 H new ATOM 0 HD11 LEU B 103 2.941 1.048 26.750 1.00 40.33 H new ATOM 0 HD12 LEU B 103 1.474 0.527 25.886 1.00 40.33 H new ATOM 0 HD13 LEU B 103 1.435 0.753 27.651 1.00 40.33 H new ATOM 0 HD21 LEU B 103 4.175 -0.527 28.191 1.00 1.40 H new ATOM 0 HD22 LEU B 103 2.713 -0.889 29.139 1.00 1.40 H new ATOM 0 HD23 LEU B 103 3.626 -2.210 28.372 1.00 1.40 H new ATOM 3503 N PRO B 104 0.932 -5.190 28.555 1.00 3.11 N ATOM 3504 CA PRO B 104 0.060 -6.056 29.350 1.00 24.44 C ATOM 3505 C PRO B 104 -0.679 -5.300 30.451 1.00 5.10 C ATOM 3506 O PRO B 104 -0.166 -4.329 31.011 1.00 15.44 O ATOM 3507 CB PRO B 104 1.024 -7.079 29.950 1.00 10.11 C ATOM 3508 CG PRO B 104 2.337 -6.379 30.006 1.00 31.23 C ATOM 3509 CD PRO B 104 2.363 -5.462 28.814 1.00 74.24 C ATOM 0 HA PRO B 104 -0.729 -6.500 28.743 1.00 24.44 H new ATOM 0 HB2 PRO B 104 0.700 -7.392 30.943 1.00 10.11 H new ATOM 0 HB3 PRO B 104 1.081 -7.977 29.335 1.00 10.11 H new ATOM 0 HG2 PRO B 104 2.441 -5.817 30.934 1.00 31.23 H new ATOM 0 HG3 PRO B 104 3.162 -7.091 29.970 1.00 31.23 H new ATOM 0 HD2 PRO B 104 2.914 -4.545 29.025 1.00 74.24 H new ATOM 0 HD3 PRO B 104 2.844 -5.932 27.956 1.00 74.24 H new ATOM 3517 N GLY B 105 -1.885 -5.764 30.748 1.00 72.34 N ATOM 3518 CA GLY B 105 -2.699 -5.149 31.787 1.00 21.00 C ATOM 3519 C GLY B 105 -3.206 -3.769 31.399 1.00 53.31 C ATOM 3520 O GLY B 105 -3.657 -3.004 32.254 1.00 21.33 O ATOM 0 H GLY B 105 -2.320 -6.562 30.286 1.00 72.34 H new ATOM 0 HA2 GLY B 105 -3.549 -5.795 32.006 1.00 21.00 H new ATOM 0 HA3 GLY B 105 -2.113 -5.072 32.703 1.00 21.00 H new ATOM 3524 N LEU B 106 -3.123 -3.449 30.113 1.00 45.40 N ATOM 3525 CA LEU B 106 -3.509 -2.132 29.608 1.00 45.21 C ATOM 3526 C LEU B 106 -4.577 -2.249 28.519 1.00 60.53 C ATOM 3527 O LEU B 106 -4.530 -3.152 27.681 1.00 55.33 O ATOM 3528 CB LEU B 106 -2.264 -1.405 29.069 1.00 22.13 C ATOM 3529 CG LEU B 106 -2.521 -0.150 28.211 1.00 5.55 C ATOM 3530 CD1 LEU B 106 -3.288 0.921 28.977 1.00 53.52 C ATOM 3531 CD2 LEU B 106 -1.208 0.416 27.689 1.00 55.01 C ATOM 0 H LEU B 106 -2.789 -4.089 29.393 1.00 45.40 H new ATOM 0 HA LEU B 106 -3.937 -1.555 30.427 1.00 45.21 H new ATOM 0 HB2 LEU B 106 -1.642 -1.118 29.917 1.00 22.13 H new ATOM 0 HB3 LEU B 106 -1.686 -2.113 28.475 1.00 22.13 H new ATOM 0 HG LEU B 106 -3.140 -0.457 27.368 1.00 5.55 H new ATOM 0 HD11 LEU B 106 -3.446 1.786 28.333 1.00 53.52 H new ATOM 0 HD12 LEU B 106 -4.252 0.523 29.292 1.00 53.52 H new ATOM 0 HD13 LEU B 106 -2.715 1.221 29.854 1.00 53.52 H new ATOM 0 HD21 LEU B 106 -1.408 1.301 27.085 1.00 55.01 H new ATOM 0 HD22 LEU B 106 -0.569 0.686 28.529 1.00 55.01 H new ATOM 0 HD23 LEU B 106 -0.706 -0.334 27.078 1.00 55.01 H new ATOM 3543 N ASP B 107 -5.546 -1.336 28.555 1.00 0.12 N ATOM 3544 CA ASP B 107 -6.583 -1.246 27.533 1.00 50.41 C ATOM 3545 C ASP B 107 -6.011 -0.638 26.262 1.00 24.13 C ATOM 3546 O ASP B 107 -5.180 0.267 26.327 1.00 45.41 O ATOM 3547 CB ASP B 107 -7.741 -0.369 28.021 1.00 1.44 C ATOM 3548 CG ASP B 107 -8.486 -0.959 29.205 1.00 20.21 C ATOM 3549 OD1 ASP B 107 -9.532 -1.608 29.000 1.00 63.12 O ATOM 3550 OD2 ASP B 107 -8.033 -0.768 30.351 1.00 14.11 O1- ATOM 0 H ASP B 107 -5.633 -0.639 29.294 1.00 0.12 H new ATOM 0 HA ASP B 107 -6.949 -2.252 27.330 1.00 50.41 H new ATOM 0 HB2 ASP B 107 -7.353 0.612 28.297 1.00 1.44 H new ATOM 0 HB3 ASP B 107 -8.442 -0.215 27.200 1.00 1.44 H new ATOM 3555 N ALA B 108 -6.475 -1.113 25.116 1.00 12.24 N ATOM 3556 CA ALA B 108 -6.029 -0.590 23.829 1.00 21.33 C ATOM 3557 C ALA B 108 -6.412 0.879 23.687 1.00 4.44 C ATOM 3558 O ALA B 108 -5.641 1.685 23.163 1.00 12.01 O ATOM 3559 CB ALA B 108 -6.625 -1.413 22.698 1.00 34.32 C ATOM 0 H ALA B 108 -7.163 -1.863 25.049 1.00 12.24 H new ATOM 0 HA ALA B 108 -4.943 -0.663 23.777 1.00 21.33 H new ATOM 0 HB1 ALA B 108 -6.287 -1.015 21.741 1.00 34.32 H new ATOM 0 HB2 ALA B 108 -6.303 -2.450 22.794 1.00 34.32 H new ATOM 0 HB3 ALA B 108 -7.713 -1.364 22.747 1.00 34.32 H new ATOM 3565 N ALA B 109 -7.603 1.221 24.177 1.00 61.34 N ATOM 3566 CA ALA B 109 -8.095 2.595 24.123 1.00 64.51 C ATOM 3567 C ALA B 109 -7.118 3.545 24.814 1.00 34.40 C ATOM 3568 O ALA B 109 -6.699 4.550 24.236 1.00 22.24 O ATOM 3569 CB ALA B 109 -9.477 2.692 24.761 1.00 34.53 C ATOM 0 H ALA B 109 -8.246 0.562 24.617 1.00 61.34 H new ATOM 0 HA ALA B 109 -8.176 2.890 23.077 1.00 64.51 H new ATOM 0 HB1 ALA B 109 -9.829 3.723 24.712 1.00 34.53 H new ATOM 0 HB2 ALA B 109 -10.172 2.046 24.224 1.00 34.53 H new ATOM 0 HB3 ALA B 109 -9.420 2.377 25.803 1.00 34.53 H new ATOM 3575 N ALA B 110 -6.749 3.210 26.046 1.00 13.42 N ATOM 3576 CA ALA B 110 -5.791 4.006 26.807 1.00 72.03 C ATOM 3577 C ALA B 110 -4.403 3.917 26.180 1.00 4.25 C ATOM 3578 O ALA B 110 -3.671 4.908 26.109 1.00 22.41 O ATOM 3579 CB ALA B 110 -5.754 3.541 28.257 1.00 4.12 C ATOM 0 H ALA B 110 -7.100 2.390 26.541 1.00 13.42 H new ATOM 0 HA ALA B 110 -6.109 5.048 26.785 1.00 72.03 H new ATOM 0 HB1 ALA B 110 -5.036 4.143 28.814 1.00 4.12 H new ATOM 0 HB2 ALA B 110 -6.743 3.654 28.701 1.00 4.12 H new ATOM 0 HB3 ALA B 110 -5.457 2.493 28.296 1.00 4.12 H new ATOM 3585 N ALA B 111 -4.061 2.724 25.704 1.00 64.14 N ATOM 3586 CA ALA B 111 -2.761 2.476 25.088 1.00 51.51 C ATOM 3587 C ALA B 111 -2.512 3.446 23.940 1.00 2.23 C ATOM 3588 O ALA B 111 -1.401 3.943 23.770 1.00 42.41 O ATOM 3589 CB ALA B 111 -2.674 1.033 24.610 1.00 4.22 C ATOM 0 H ALA B 111 -4.671 1.907 25.733 1.00 64.14 H new ATOM 0 HA ALA B 111 -1.985 2.639 25.836 1.00 51.51 H new ATOM 0 HB1 ALA B 111 -1.700 0.859 24.152 1.00 4.22 H new ATOM 0 HB2 ALA B 111 -2.801 0.360 25.458 1.00 4.22 H new ATOM 0 HB3 ALA B 111 -3.458 0.845 23.877 1.00 4.22 H new ATOM 3595 N LYS B 112 -3.561 3.723 23.170 1.00 32.30 N ATOM 3596 CA LYS B 112 -3.487 4.689 22.076 1.00 34.20 C ATOM 3597 C LYS B 112 -2.937 6.026 22.572 1.00 24.41 C ATOM 3598 O LYS B 112 -2.020 6.588 21.971 1.00 32.01 O ATOM 3599 CB LYS B 112 -4.873 4.895 21.443 1.00 45.31 C ATOM 3600 CG LYS B 112 -5.405 3.669 20.711 1.00 74.45 C ATOM 3601 CD LYS B 112 -6.811 3.902 20.162 1.00 63.04 C ATOM 3602 CE LYS B 112 -7.308 2.711 19.351 1.00 72.33 C ATOM 3603 NZ LYS B 112 -6.493 2.494 18.124 1.00 62.21 N1+ ATOM 0 H LYS B 112 -4.477 3.290 23.284 1.00 32.30 H new ATOM 0 HA LYS B 112 -2.810 4.292 21.320 1.00 34.20 H new ATOM 0 HB2 LYS B 112 -5.580 5.175 22.224 1.00 45.31 H new ATOM 0 HB3 LYS B 112 -4.822 5.730 20.744 1.00 45.31 H new ATOM 0 HG2 LYS B 112 -4.732 3.415 19.892 1.00 74.45 H new ATOM 0 HG3 LYS B 112 -5.417 2.817 21.390 1.00 74.45 H new ATOM 0 HD2 LYS B 112 -7.497 4.091 20.988 1.00 63.04 H new ATOM 0 HD3 LYS B 112 -6.813 4.794 19.536 1.00 63.04 H new ATOM 0 HE2 LYS B 112 -7.279 1.814 19.969 1.00 72.33 H new ATOM 0 HE3 LYS B 112 -8.349 2.872 19.071 1.00 72.33 H new ATOM 0 HZ1 LYS B 112 -6.992 1.841 17.487 1.00 62.21 H new ATOM 0 HZ2 LYS B 112 -6.344 3.403 17.641 1.00 62.21 H new ATOM 0 HZ3 LYS B 112 -5.573 2.086 18.386 1.00 62.21 H new ATOM 3617 N THR B 113 -3.481 6.515 23.686 1.00 71.03 N ATOM 3618 CA THR B 113 -3.098 7.819 24.210 1.00 12.30 C ATOM 3619 C THR B 113 -1.708 7.758 24.852 1.00 72.03 C ATOM 3620 O THR B 113 -0.947 8.727 24.795 1.00 34.03 O ATOM 3621 CB THR B 113 -4.144 8.364 25.225 1.00 51.23 C ATOM 3622 OG1 THR B 113 -4.184 9.799 25.172 1.00 15.33 O ATOM 3623 CG2 THR B 113 -3.840 7.931 26.658 1.00 55.23 C ATOM 0 H THR B 113 -4.186 6.027 24.239 1.00 71.03 H new ATOM 0 HA THR B 113 -3.065 8.511 23.368 1.00 12.30 H new ATOM 0 HB THR B 113 -5.109 7.946 24.940 1.00 51.23 H new ATOM 0 HG1 THR B 113 -4.846 10.132 25.813 1.00 15.33 H new ATOM 0 HG21 THR B 113 -4.598 8.336 27.329 1.00 55.23 H new ATOM 0 HG22 THR B 113 -3.846 6.843 26.718 1.00 55.23 H new ATOM 0 HG23 THR B 113 -2.859 8.305 26.951 1.00 55.23 H new ATOM 3631 N LEU B 114 -1.378 6.613 25.455 1.00 42.02 N ATOM 3632 CA LEU B 114 -0.072 6.429 26.088 1.00 34.43 C ATOM 3633 C LEU B 114 1.033 6.426 25.037 1.00 70.23 C ATOM 3634 O LEU B 114 2.058 7.089 25.198 1.00 14.10 O ATOM 3635 CB LEU B 114 -0.037 5.134 26.913 1.00 61.41 C ATOM 3636 CG LEU B 114 -1.079 5.050 28.043 1.00 44.12 C ATOM 3637 CD1 LEU B 114 -0.836 3.820 28.915 1.00 65.44 C ATOM 3638 CD2 LEU B 114 -1.077 6.326 28.885 1.00 20.12 C ATOM 0 H LEU B 114 -1.995 5.803 25.518 1.00 42.02 H new ATOM 0 HA LEU B 114 0.097 7.265 26.767 1.00 34.43 H new ATOM 0 HB2 LEU B 114 -0.185 4.289 26.240 1.00 61.41 H new ATOM 0 HB3 LEU B 114 0.957 5.025 27.348 1.00 61.41 H new ATOM 0 HG LEU B 114 -2.064 4.951 27.587 1.00 44.12 H new ATOM 0 HD11 LEU B 114 -1.584 3.782 29.707 1.00 65.44 H new ATOM 0 HD12 LEU B 114 -0.908 2.921 28.304 1.00 65.44 H new ATOM 0 HD13 LEU B 114 0.158 3.879 29.358 1.00 65.44 H new ATOM 0 HD21 LEU B 114 -1.822 6.241 29.676 1.00 20.12 H new ATOM 0 HD22 LEU B 114 -0.091 6.468 29.328 1.00 20.12 H new ATOM 0 HD23 LEU B 114 -1.316 7.180 28.252 1.00 20.12 H new ATOM 3650 N VAL B 115 0.807 5.695 23.952 1.00 61.11 N ATOM 3651 CA VAL B 115 1.753 5.651 22.847 1.00 23.35 C ATOM 3652 C VAL B 115 1.843 7.021 22.180 1.00 63.55 C ATOM 3653 O VAL B 115 2.913 7.437 21.748 1.00 10.54 O ATOM 3654 CB VAL B 115 1.359 4.581 21.797 1.00 32.23 C ATOM 3655 CG1 VAL B 115 2.333 4.573 20.619 1.00 53.51 C ATOM 3656 CG2 VAL B 115 1.291 3.199 22.442 1.00 32.34 C ATOM 0 H VAL B 115 -0.027 5.123 23.815 1.00 61.11 H new ATOM 0 HA VAL B 115 2.726 5.378 23.256 1.00 23.35 H new ATOM 0 HB VAL B 115 0.372 4.838 21.413 1.00 32.23 H new ATOM 0 HG11 VAL B 115 2.029 3.812 19.901 1.00 53.51 H new ATOM 0 HG12 VAL B 115 2.328 5.550 20.136 1.00 53.51 H new ATOM 0 HG13 VAL B 115 3.338 4.351 20.979 1.00 53.51 H new ATOM 0 HG21 VAL B 115 1.013 2.460 21.690 1.00 32.34 H new ATOM 0 HG22 VAL B 115 2.265 2.944 22.859 1.00 32.34 H new ATOM 0 HG23 VAL B 115 0.546 3.205 23.238 1.00 32.34 H new ATOM 3666 N ASP B 116 0.710 7.718 22.112 1.00 33.05 N ATOM 3667 CA ASP B 116 0.661 9.065 21.538 1.00 4.03 C ATOM 3668 C ASP B 116 1.596 10.004 22.291 1.00 43.14 C ATOM 3669 O ASP B 116 2.536 10.554 21.713 1.00 21.31 O ATOM 3670 CB ASP B 116 -0.770 9.619 21.581 1.00 75.43 C ATOM 3671 CG ASP B 116 -0.876 11.026 21.008 1.00 20.42 C ATOM 3672 OD1 ASP B 116 -0.908 11.997 21.799 1.00 45.35 O ATOM 3673 OD2 ASP B 116 -0.933 11.166 19.766 1.00 32.45 O1- ATOM 0 H ASP B 116 -0.189 7.373 22.448 1.00 33.05 H new ATOM 0 HA ASP B 116 0.985 9.000 20.499 1.00 4.03 H new ATOM 0 HB2 ASP B 116 -1.429 8.954 21.023 1.00 75.43 H new ATOM 0 HB3 ASP B 116 -1.122 9.624 22.613 1.00 75.43 H new ATOM 3678 N ARG B 117 1.344 10.160 23.589 1.00 65.05 N ATOM 3679 CA ARG B 117 2.131 11.063 24.427 1.00 30.34 C ATOM 3680 C ARG B 117 3.601 10.644 24.445 1.00 41.22 C ATOM 3681 O ARG B 117 4.499 11.481 24.325 1.00 22.44 O ATOM 3682 CB ARG B 117 1.558 11.112 25.857 1.00 5.33 C ATOM 3683 CG ARG B 117 1.436 9.743 26.520 1.00 52.02 C ATOM 3684 CD ARG B 117 0.601 9.775 27.802 1.00 70.20 C ATOM 3685 NE ARG B 117 1.383 10.145 28.988 1.00 35.41 N ATOM 3686 CZ ARG B 117 0.950 9.965 30.242 1.00 33.14 C ATOM 3687 NH1 ARG B 117 -0.302 9.581 30.460 1.00 12.31 N1+ ATOM 3688 NH2 ARG B 117 1.750 10.205 31.276 1.00 12.43 N ATOM 0 H ARG B 117 0.599 9.671 24.085 1.00 65.05 H new ATOM 0 HA ARG B 117 2.071 12.064 24.001 1.00 30.34 H new ATOM 0 HB2 ARG B 117 2.195 11.747 26.472 1.00 5.33 H new ATOM 0 HB3 ARG B 117 0.574 11.580 25.828 1.00 5.33 H new ATOM 0 HG2 ARG B 117 0.986 9.043 25.816 1.00 52.02 H new ATOM 0 HG3 ARG B 117 2.433 9.366 26.751 1.00 52.02 H new ATOM 0 HD2 ARG B 117 -0.218 10.484 27.678 1.00 70.20 H new ATOM 0 HD3 ARG B 117 0.152 8.794 27.961 1.00 70.20 H new ATOM 0 HE ARG B 117 2.304 10.561 28.849 1.00 35.41 H new ATOM 0 HH11 ARG B 117 -0.932 9.424 29.673 1.00 12.31 H new ATOM 0 HH12 ARG B 117 -0.634 9.443 31.414 1.00 12.31 H new ATOM 0 HH21 ARG B 117 2.704 10.530 31.118 1.00 12.43 H new ATOM 0 HH22 ARG B 117 1.410 10.065 32.227 1.00 12.43 H new ATOM 3702 N ALA B 118 3.840 9.340 24.569 1.00 61.11 N ATOM 3703 CA ALA B 118 5.199 8.806 24.596 1.00 4.01 C ATOM 3704 C ALA B 118 5.914 9.076 23.273 1.00 4.12 C ATOM 3705 O ALA B 118 7.093 9.429 23.248 1.00 22.32 O ATOM 3706 CB ALA B 118 5.170 7.311 24.892 1.00 4.44 C ATOM 0 H ALA B 118 3.109 8.634 24.652 1.00 61.11 H new ATOM 0 HA ALA B 118 5.752 9.310 25.389 1.00 4.01 H new ATOM 0 HB1 ALA B 118 6.189 6.924 24.910 1.00 4.44 H new ATOM 0 HB2 ALA B 118 4.700 7.141 25.861 1.00 4.44 H new ATOM 0 HB3 ALA B 118 4.600 6.798 24.117 1.00 4.44 H new ATOM 3712 N HIS B 119 5.176 8.936 22.178 1.00 53.54 N ATOM 3713 CA HIS B 119 5.724 9.125 20.834 1.00 31.05 C ATOM 3714 C HIS B 119 5.626 10.598 20.426 1.00 22.51 C ATOM 3715 O HIS B 119 5.831 10.949 19.261 1.00 73.21 O ATOM 3716 CB HIS B 119 4.960 8.241 19.837 1.00 24.30 C ATOM 3717 CG HIS B 119 5.691 7.970 18.560 1.00 50.32 C ATOM 3718 ND1 HIS B 119 5.597 8.769 17.448 1.00 33.22 N ATOM 3719 CD2 HIS B 119 6.512 6.954 18.219 1.00 55.12 C ATOM 3720 CE1 HIS B 119 6.328 8.252 16.476 1.00 74.31 C ATOM 3721 NE2 HIS B 119 6.898 7.149 16.917 1.00 22.51 N ATOM 0 H HIS B 119 4.186 8.690 22.193 1.00 53.54 H new ATOM 0 HA HIS B 119 6.775 8.836 20.831 1.00 31.05 H new ATOM 0 HB2 HIS B 119 4.729 7.290 20.317 1.00 24.30 H new ATOM 0 HB3 HIS B 119 4.009 8.719 19.602 1.00 24.30 H new ATOM 0 HD1 HIS B 119 5.049 9.627 17.382 1.00 33.22 H new ATOM 0 HD2 HIS B 119 6.811 6.135 18.856 1.00 55.12 H new ATOM 0 HE1 HIS B 119 6.440 8.665 15.484 1.00 74.31 H new ATOM 3730 N HIS B 120 5.281 11.443 21.394 1.00 35.12 N ATOM 3731 CA HIS B 120 5.205 12.889 21.193 1.00 61.52 C ATOM 3732 C HIS B 120 6.378 13.566 21.902 1.00 22.12 C ATOM 3733 O HIS B 120 6.886 14.590 21.449 1.00 21.30 O ATOM 3734 CB HIS B 120 3.867 13.419 21.745 1.00 61.10 C ATOM 3735 CG HIS B 120 3.588 14.871 21.460 1.00 45.20 C ATOM 3736 ND1 HIS B 120 2.433 15.304 20.846 1.00 23.40 N ATOM 3737 CD2 HIS B 120 4.298 15.991 21.740 1.00 61.34 C ATOM 3738 CE1 HIS B 120 2.446 16.619 20.758 1.00 14.23 C ATOM 3739 NE2 HIS B 120 3.566 17.062 21.293 1.00 33.30 N ATOM 0 H HIS B 120 5.046 11.145 22.341 1.00 35.12 H new ATOM 0 HA HIS B 120 5.259 13.114 20.128 1.00 61.52 H new ATOM 0 HB2 HIS B 120 3.057 12.821 21.327 1.00 61.10 H new ATOM 0 HB3 HIS B 120 3.852 13.267 22.824 1.00 61.10 H new ATOM 0 HD2 HIS B 120 5.262 16.033 22.225 1.00 61.34 H new ATOM 0 HE1 HIS B 120 1.670 17.230 20.321 1.00 14.23 H new ATOM 0 HE2 HIS B 120 3.843 18.041 21.363 1.00 33.30 H new ATOM 3748 N VAL B 121 6.798 12.979 23.019 1.00 53.34 N ATOM 3749 CA VAL B 121 7.881 13.532 23.834 1.00 2.11 C ATOM 3750 C VAL B 121 9.199 12.800 23.581 1.00 31.12 C ATOM 3751 O VAL B 121 10.190 13.028 24.279 1.00 43.14 O ATOM 3752 CB VAL B 121 7.537 13.463 25.346 1.00 52.03 C ATOM 3753 CG1 VAL B 121 6.266 14.257 25.648 1.00 41.33 C ATOM 3754 CG2 VAL B 121 7.402 12.011 25.811 1.00 63.42 C ATOM 0 H VAL B 121 6.402 12.113 23.385 1.00 53.34 H new ATOM 0 HA VAL B 121 7.996 14.576 23.542 1.00 2.11 H new ATOM 0 HB VAL B 121 8.358 13.916 25.902 1.00 52.03 H new ATOM 0 HG11 VAL B 121 6.043 14.195 26.713 1.00 41.33 H new ATOM 0 HG12 VAL B 121 6.413 15.300 25.368 1.00 41.33 H new ATOM 0 HG13 VAL B 121 5.434 13.842 25.079 1.00 41.33 H new ATOM 0 HG21 VAL B 121 7.161 11.990 26.874 1.00 63.42 H new ATOM 0 HG22 VAL B 121 6.607 11.521 25.249 1.00 63.42 H new ATOM 0 HG23 VAL B 121 8.342 11.486 25.642 1.00 63.42 H new ATOM 3764 N CYS B 122 9.207 11.923 22.581 1.00 64.23 N ATOM 3765 CA CYS B 122 10.399 11.154 22.239 1.00 24.42 C ATOM 3766 C CYS B 122 11.510 12.077 21.725 1.00 23.34 C ATOM 3767 O CYS B 122 11.241 13.023 20.981 1.00 74.53 O ATOM 3768 CB CYS B 122 10.052 10.091 21.187 1.00 15.34 C ATOM 3769 SG CYS B 122 9.256 10.754 19.706 1.00 14.44 S ATOM 0 H CYS B 122 8.398 11.727 21.992 1.00 64.23 H new ATOM 0 HA CYS B 122 10.763 10.655 23.137 1.00 24.42 H new ATOM 0 HB2 CYS B 122 10.965 9.572 20.895 1.00 15.34 H new ATOM 0 HB3 CYS B 122 9.394 9.349 21.639 1.00 15.34 H new ATOM 0 HG CYS B 122 9.661 11.973 19.504 1.00 14.44 H new ATOM 3775 N PRO B 123 12.781 11.809 22.102 1.00 45.45 N ATOM 3776 CA PRO B 123 13.925 12.657 21.715 1.00 1.30 C ATOM 3777 C PRO B 123 14.167 12.675 20.201 1.00 21.43 C ATOM 3778 O PRO B 123 15.000 13.434 19.708 1.00 1.12 O ATOM 3779 CB PRO B 123 15.115 12.018 22.451 1.00 65.25 C ATOM 3780 CG PRO B 123 14.693 10.613 22.718 1.00 12.41 C ATOM 3781 CD PRO B 123 13.206 10.669 22.943 1.00 30.51 C ATOM 0 HA PRO B 123 13.758 13.701 21.978 1.00 1.30 H new ATOM 0 HB2 PRO B 123 16.019 12.050 21.843 1.00 65.25 H new ATOM 0 HB3 PRO B 123 15.336 12.547 23.378 1.00 65.25 H new ATOM 0 HG2 PRO B 123 14.937 9.964 21.877 1.00 12.41 H new ATOM 0 HG3 PRO B 123 15.206 10.210 23.591 1.00 12.41 H new ATOM 0 HD2 PRO B 123 12.718 9.742 22.642 1.00 30.51 H new ATOM 0 HD3 PRO B 123 12.963 10.831 23.993 1.00 30.51 H new ATOM 3789 N TYR B 124 13.430 11.838 19.473 1.00 44.15 N ATOM 3790 CA TYR B 124 13.519 11.786 18.014 1.00 41.53 C ATOM 3791 C TYR B 124 12.551 12.800 17.390 1.00 41.03 C ATOM 3792 O TYR B 124 12.238 12.733 16.199 1.00 24.42 O ATOM 3793 CB TYR B 124 13.240 10.353 17.519 1.00 11.44 C ATOM 3794 CG TYR B 124 14.189 9.319 18.113 1.00 34.02 C ATOM 3795 CD1 TYR B 124 15.283 8.825 17.394 1.00 62.34 C ATOM 3796 CD2 TYR B 124 14.007 8.858 19.415 1.00 4.11 C ATOM 3797 CE1 TYR B 124 16.152 7.913 17.962 1.00 22.14 C ATOM 3798 CE2 TYR B 124 14.873 7.941 19.979 1.00 2.53 C ATOM 3799 CZ TYR B 124 15.942 7.473 19.248 1.00 65.35 C ATOM 3800 OH TYR B 124 16.816 6.572 19.808 1.00 21.31 O ATOM 0 H TYR B 124 12.760 11.182 19.873 1.00 44.15 H new ATOM 0 HA TYR B 124 14.528 12.056 17.702 1.00 41.53 H new ATOM 0 HB2 TYR B 124 12.214 10.082 17.769 1.00 11.44 H new ATOM 0 HB3 TYR B 124 13.320 10.329 16.432 1.00 11.44 H new ATOM 0 HD1 TYR B 124 15.451 9.161 16.381 1.00 62.34 H new ATOM 0 HD2 TYR B 124 13.173 9.225 19.995 1.00 4.11 H new ATOM 0 HE1 TYR B 124 16.996 7.546 17.396 1.00 22.14 H new ATOM 0 HE2 TYR B 124 14.712 7.593 20.989 1.00 2.53 H new ATOM 0 HH TYR B 124 16.529 6.362 20.721 1.00 21.31 H new ATOM 3845 N THR B 128 8.495 12.703 14.145 1.00 13.32 N ATOM 3846 CA THR B 128 8.817 11.295 14.039 1.00 55.14 C ATOM 3847 C THR B 128 7.535 10.537 13.765 1.00 13.14 C ATOM 3848 O THR B 128 7.545 9.359 13.413 1.00 21.45 O ATOM 3849 CB THR B 128 9.473 10.778 15.345 1.00 41.45 C ATOM 3850 OG1 THR B 128 9.972 9.445 15.167 1.00 41.22 O ATOM 3851 CG2 THR B 128 8.479 10.788 16.501 1.00 11.25 C ATOM 0 HA THR B 128 9.530 11.143 13.228 1.00 55.14 H new ATOM 0 HB THR B 128 10.300 11.448 15.582 1.00 41.45 H new ATOM 0 HG1 THR B 128 9.741 8.902 15.949 1.00 41.22 H new ATOM 0 HG21 THR B 128 8.967 10.420 17.404 1.00 11.25 H new ATOM 0 HG22 THR B 128 8.126 11.805 16.668 1.00 11.25 H new ATOM 0 HG23 THR B 128 7.633 10.145 16.259 1.00 11.25 H new ATOM 3859 N ARG B 129 6.422 11.242 13.939 1.00 41.51 N ATOM 3860 CA ARG B 129 5.110 10.667 13.748 1.00 75.21 C ATOM 3861 C ARG B 129 4.355 11.377 12.623 1.00 73.32 C ATOM 3862 O ARG B 129 3.787 10.732 11.742 1.00 44.41 O ATOM 3863 CB ARG B 129 4.330 10.761 15.061 1.00 21.01 C ATOM 3864 CG ARG B 129 4.105 12.177 15.566 1.00 45.10 C ATOM 3865 CD ARG B 129 3.282 12.192 16.841 1.00 21.21 C ATOM 3866 NE ARG B 129 2.792 13.531 17.165 1.00 2.44 N ATOM 3867 CZ ARG B 129 1.708 13.772 17.906 1.00 0.21 C ATOM 3868 NH1 ARG B 129 1.020 12.764 18.433 1.00 5.12 N1+ ATOM 3869 NH2 ARG B 129 1.309 15.019 18.115 1.00 44.44 N ATOM 0 H ARG B 129 6.412 12.224 14.215 1.00 41.51 H new ATOM 0 HA ARG B 129 5.218 9.621 13.460 1.00 75.21 H new ATOM 0 HB2 ARG B 129 3.361 10.279 14.928 1.00 21.01 H new ATOM 0 HB3 ARG B 129 4.864 10.197 15.826 1.00 21.01 H new ATOM 0 HG2 ARG B 129 5.067 12.656 15.748 1.00 45.10 H new ATOM 0 HG3 ARG B 129 3.598 12.761 14.798 1.00 45.10 H new ATOM 0 HD2 ARG B 129 2.436 11.513 16.734 1.00 21.21 H new ATOM 0 HD3 ARG B 129 3.887 11.819 17.667 1.00 21.21 H new ATOM 0 HE ARG B 129 3.311 14.331 16.802 1.00 2.44 H new ATOM 0 HH11 ARG B 129 1.320 11.802 18.272 1.00 5.12 H new ATOM 0 HH12 ARG B 129 0.192 12.952 18.999 1.00 5.12 H new ATOM 0 HH21 ARG B 129 1.830 15.796 17.709 1.00 44.44 H new ATOM 0 HH22 ARG B 129 0.481 15.201 18.681 1.00 44.44 H new ATOM 3883 N ASN B 130 4.348 12.707 12.664 1.00 21.53 N ATOM 3884 CA ASN B 130 3.575 13.501 11.711 1.00 53.34 C ATOM 3885 C ASN B 130 4.295 13.598 10.371 1.00 22.35 C ATOM 3886 O ASN B 130 3.663 13.606 9.314 1.00 70.41 O ATOM 3887 CB ASN B 130 3.301 14.908 12.273 1.00 70.21 C ATOM 3888 CG ASN B 130 2.857 14.877 13.730 1.00 33.52 C ATOM 3889 OD1 ASN B 130 3.674 15.024 14.637 1.00 60.32 O ATOM 3890 ND2 ASN B 130 1.575 14.657 13.967 1.00 74.14 N ATOM 0 H ASN B 130 4.869 13.258 13.346 1.00 21.53 H new ATOM 0 HA ASN B 130 2.621 12.998 11.551 1.00 53.34 H new ATOM 0 HB2 ASN B 130 4.203 15.513 12.184 1.00 70.21 H new ATOM 0 HB3 ASN B 130 2.531 15.392 11.672 1.00 70.21 H new ATOM 0 HD21 ASN B 130 1.236 14.605 14.927 1.00 74.14 H new ATOM 0 HD22 ASN B 130 0.925 14.540 13.189 1.00 74.14 H new ATOM 3897 N ASN B 131 5.620 13.667 10.428 1.00 34.23 N ATOM 3898 CA ASN B 131 6.435 13.865 9.231 1.00 31.43 C ATOM 3899 C ASN B 131 6.866 12.528 8.636 1.00 54.44 C ATOM 3900 O ASN B 131 6.836 12.336 7.417 1.00 13.44 O ATOM 3901 CB ASN B 131 7.679 14.697 9.575 1.00 3.33 C ATOM 3902 CG ASN B 131 8.443 15.168 8.342 1.00 61.21 C ATOM 3903 OD1 ASN B 131 7.733 15.477 7.267 1.00 75.43 O flip ATOM 3904 ND2 ASN B 131 9.668 15.279 8.366 1.00 34.33 N flip ATOM 0 H ASN B 131 6.156 13.589 11.292 1.00 34.23 H new ATOM 0 HA ASN B 131 5.831 14.395 8.494 1.00 31.43 H new ATOM 0 HB2 ASN B 131 7.378 15.565 10.162 1.00 3.33 H new ATOM 0 HB3 ASN B 131 8.344 14.103 10.202 1.00 3.33 H new ATOM 0 HD21 ASN B 131 10.186 15.033 9.209 1.00 34.33 H new ATOM 0 HD22 ASN B 131 10.166 15.617 7.542 1.00 34.33 H new ATOM 3911 N VAL B 132 7.263 11.609 9.508 1.00 52.13 N ATOM 3912 CA VAL B 132 7.802 10.315 9.088 1.00 11.30 C ATOM 3913 C VAL B 132 6.711 9.246 9.106 1.00 11.32 C ATOM 3914 O VAL B 132 5.807 9.281 9.946 1.00 35.23 O ATOM 3915 CB VAL B 132 8.983 9.876 9.999 1.00 15.30 C ATOM 3916 CG1 VAL B 132 9.592 8.556 9.520 1.00 32.53 C ATOM 3917 CG2 VAL B 132 10.050 10.973 10.065 1.00 3.12 C ATOM 0 H VAL B 132 7.222 11.735 10.519 1.00 52.13 H new ATOM 0 HA VAL B 132 8.174 10.428 8.070 1.00 11.30 H new ATOM 0 HB VAL B 132 8.590 9.716 11.003 1.00 15.30 H new ATOM 0 HG11 VAL B 132 10.415 8.275 10.177 1.00 32.53 H new ATOM 0 HG12 VAL B 132 8.831 7.776 9.539 1.00 32.53 H new ATOM 0 HG13 VAL B 132 9.964 8.675 8.503 1.00 32.53 H new ATOM 0 HG21 VAL B 132 10.868 10.647 10.707 1.00 3.12 H new ATOM 0 HG22 VAL B 132 10.432 11.170 9.063 1.00 3.12 H new ATOM 0 HG23 VAL B 132 9.611 11.884 10.472 1.00 3.12 H new ATOM 3927 N ALA B 133 6.800 8.302 8.173 1.00 53.04 N ATOM 3928 CA ALA B 133 5.809 7.244 8.055 1.00 53.01 C ATOM 3929 C ALA B 133 6.047 6.157 9.084 1.00 72.23 C ATOM 3930 O ALA B 133 6.676 5.124 8.815 1.00 0.23 O ATOM 3931 CB ALA B 133 5.790 6.678 6.639 1.00 11.23 C ATOM 0 H ALA B 133 7.553 8.251 7.486 1.00 53.04 H new ATOM 0 HA ALA B 133 4.827 7.673 8.255 1.00 53.01 H new ATOM 0 HB1 ALA B 133 5.042 5.888 6.573 1.00 11.23 H new ATOM 0 HB2 ALA B 133 5.543 7.471 5.933 1.00 11.23 H new ATOM 0 HB3 ALA B 133 6.771 6.269 6.397 1.00 11.23 H new ATOM 3937 N VAL B 134 5.557 6.418 10.283 1.00 34.41 N ATOM 3938 CA VAL B 134 5.624 5.463 11.364 1.00 31.34 C ATOM 3939 C VAL B 134 4.218 5.107 11.831 1.00 33.12 C ATOM 3940 O VAL B 134 3.548 5.905 12.491 1.00 12.15 O ATOM 3941 CB VAL B 134 6.435 6.002 12.559 1.00 33.43 C ATOM 3942 CG1 VAL B 134 6.616 4.896 13.584 1.00 61.10 C ATOM 3943 CG2 VAL B 134 7.783 6.561 12.109 1.00 5.41 C ATOM 0 H VAL B 134 5.103 7.297 10.530 1.00 34.41 H new ATOM 0 HA VAL B 134 6.130 4.575 10.984 1.00 31.34 H new ATOM 0 HB VAL B 134 5.885 6.825 13.016 1.00 33.43 H new ATOM 0 HG11 VAL B 134 7.189 5.274 14.430 1.00 61.10 H new ATOM 0 HG12 VAL B 134 5.639 4.557 13.930 1.00 61.10 H new ATOM 0 HG13 VAL B 134 7.149 4.062 13.129 1.00 61.10 H new ATOM 0 HG21 VAL B 134 8.330 6.933 12.975 1.00 5.41 H new ATOM 0 HG22 VAL B 134 8.361 5.773 11.626 1.00 5.41 H new ATOM 0 HG23 VAL B 134 7.622 7.377 11.404 1.00 5.41 H new ATOM 3953 N ARG B 135 3.774 3.910 11.477 1.00 11.21 N ATOM 3954 CA ARG B 135 2.442 3.451 11.836 1.00 24.23 C ATOM 3955 C ARG B 135 2.442 2.985 13.291 1.00 24.22 C ATOM 3956 O ARG B 135 2.953 1.909 13.611 1.00 54.44 O ATOM 3957 CB ARG B 135 1.996 2.310 10.897 1.00 74.32 C ATOM 3958 CG ARG B 135 0.481 2.209 10.682 1.00 34.13 C ATOM 3959 CD ARG B 135 -0.292 1.928 11.969 1.00 2.43 C ATOM 3960 NE ARG B 135 -1.739 1.874 11.734 1.00 1.50 N ATOM 3961 CZ ARG B 135 -2.651 2.476 12.504 1.00 23.13 C ATOM 3962 NH1 ARG B 135 -2.280 3.146 13.590 1.00 1.54 N1+ ATOM 3963 NH2 ARG B 135 -3.938 2.391 12.193 1.00 14.33 N ATOM 0 H ARG B 135 4.320 3.237 10.939 1.00 11.21 H new ATOM 0 HA ARG B 135 1.734 4.273 11.726 1.00 24.23 H new ATOM 0 HB2 ARG B 135 2.478 2.446 9.929 1.00 74.32 H new ATOM 0 HB3 ARG B 135 2.355 1.364 11.302 1.00 74.32 H new ATOM 0 HG2 ARG B 135 0.120 3.140 10.245 1.00 34.13 H new ATOM 0 HG3 ARG B 135 0.275 1.417 9.962 1.00 34.13 H new ATOM 0 HD2 ARG B 135 0.043 0.982 12.395 1.00 2.43 H new ATOM 0 HD3 ARG B 135 -0.071 2.704 12.702 1.00 2.43 H new ATOM 0 HE ARG B 135 -2.071 1.342 10.930 1.00 1.50 H new ATOM 0 HH11 ARG B 135 -1.293 3.204 13.841 1.00 1.54 H new ATOM 0 HH12 ARG B 135 -2.982 3.603 14.172 1.00 1.54 H new ATOM 0 HH21 ARG B 135 -4.230 1.867 11.368 1.00 14.33 H new ATOM 0 HH22 ARG B 135 -4.636 2.849 12.779 1.00 14.33 H new ATOM 3977 N LEU B 136 1.903 3.816 14.174 1.00 62.51 N ATOM 3978 CA LEU B 136 1.759 3.456 15.574 1.00 72.41 C ATOM 3979 C LEU B 136 0.618 2.461 15.748 1.00 41.21 C ATOM 3980 O LEU B 136 -0.541 2.775 15.483 1.00 33.52 O ATOM 3981 CB LEU B 136 1.538 4.710 16.429 1.00 60.04 C ATOM 3982 CG LEU B 136 2.769 5.622 16.547 1.00 34.22 C ATOM 3983 CD1 LEU B 136 2.464 6.855 17.393 1.00 41.31 C ATOM 3984 CD2 LEU B 136 3.948 4.846 17.130 1.00 0.00 C ATOM 0 H LEU B 136 1.558 4.747 13.942 1.00 62.51 H new ATOM 0 HA LEU B 136 2.678 2.978 15.912 1.00 72.41 H new ATOM 0 HB2 LEU B 136 0.715 5.284 16.004 1.00 60.04 H new ATOM 0 HB3 LEU B 136 1.230 4.404 17.429 1.00 60.04 H new ATOM 0 HG LEU B 136 3.035 5.964 15.547 1.00 34.22 H new ATOM 0 HD11 LEU B 136 3.354 7.481 17.458 1.00 41.31 H new ATOM 0 HD12 LEU B 136 1.655 7.422 16.932 1.00 41.31 H new ATOM 0 HD13 LEU B 136 2.165 6.544 18.394 1.00 41.31 H new ATOM 0 HD21 LEU B 136 4.814 5.504 17.208 1.00 0.00 H new ATOM 0 HD22 LEU B 136 3.685 4.474 18.120 1.00 0.00 H new ATOM 0 HD23 LEU B 136 4.189 4.006 16.478 1.00 0.00 H new ATOM 3996 N VAL B 137 0.974 1.257 16.164 1.00 22.01 N ATOM 3997 CA VAL B 137 0.020 0.172 16.360 1.00 61.13 C ATOM 3998 C VAL B 137 0.114 -0.347 17.795 1.00 31.22 C ATOM 3999 O VAL B 137 1.157 -0.831 18.230 1.00 63.04 O ATOM 4000 CB VAL B 137 0.249 -0.981 15.325 1.00 72.22 C ATOM 4001 CG1 VAL B 137 1.678 -0.957 14.788 1.00 20.11 C ATOM 4002 CG2 VAL B 137 -0.063 -2.356 15.925 1.00 5.14 C ATOM 0 H VAL B 137 1.938 1.001 16.377 1.00 22.01 H new ATOM 0 HA VAL B 137 -0.985 0.559 16.193 1.00 61.13 H new ATOM 0 HB VAL B 137 -0.442 -0.810 14.499 1.00 72.22 H new ATOM 0 HG11 VAL B 137 1.811 -1.767 14.071 1.00 20.11 H new ATOM 0 HG12 VAL B 137 1.866 -0.003 14.296 1.00 20.11 H new ATOM 0 HG13 VAL B 137 2.379 -1.084 15.613 1.00 20.11 H new ATOM 0 HG21 VAL B 137 0.109 -3.128 15.175 1.00 5.14 H new ATOM 0 HG22 VAL B 137 0.585 -2.534 16.783 1.00 5.14 H new ATOM 0 HG23 VAL B 137 -1.105 -2.386 16.244 1.00 5.14 H new ATOM 4012 N VAL B 138 -0.979 -0.212 18.532 1.00 51.04 N ATOM 4013 CA VAL B 138 -1.034 -0.638 19.923 1.00 24.22 C ATOM 4014 C VAL B 138 -1.671 -2.020 20.013 1.00 70.52 C ATOM 4015 O VAL B 138 -2.629 -2.326 19.294 1.00 62.24 O ATOM 4016 CB VAL B 138 -1.810 0.358 20.818 1.00 51.45 C ATOM 4017 CG1 VAL B 138 -1.392 1.794 20.523 1.00 13.13 C ATOM 4018 CG2 VAL B 138 -3.311 0.172 20.663 1.00 0.20 C ATOM 0 H VAL B 138 -1.848 0.194 18.185 1.00 51.04 H new ATOM 0 HA VAL B 138 -0.009 -0.672 20.293 1.00 24.22 H new ATOM 0 HB VAL B 138 -1.558 0.148 21.858 1.00 51.45 H new ATOM 0 HG11 VAL B 138 -1.951 2.475 21.165 1.00 13.13 H new ATOM 0 HG12 VAL B 138 -0.325 1.909 20.715 1.00 13.13 H new ATOM 0 HG13 VAL B 138 -1.600 2.026 19.479 1.00 13.13 H new ATOM 0 HG21 VAL B 138 -3.834 0.884 21.302 1.00 0.20 H new ATOM 0 HG22 VAL B 138 -3.593 0.342 19.624 1.00 0.20 H new ATOM 0 HG23 VAL B 138 -3.584 -0.843 20.952 1.00 0.20 H new ATOM 4028 N ALA B 139 -1.108 -2.860 20.854 1.00 41.23 N ATOM 4029 CA ALA B 139 -1.556 -4.241 20.979 1.00 52.34 C ATOM 4030 C ALA B 139 -2.291 -4.442 22.305 1.00 22.31 C ATOM 4031 O ALA B 139 -1.636 -4.783 23.315 1.00 10.42 O ATOM 4032 CB ALA B 139 -0.372 -5.197 20.842 1.00 71.35 C ATOM 4033 OXT ALA B 139 -3.525 -4.257 22.330 1.00 0.00 O1- ATOM 0 H ALA B 139 -0.332 -2.613 21.469 1.00 41.23 H new ATOM 0 HA ALA B 139 -2.256 -4.463 20.174 1.00 52.34 H new ATOM 0 HB1 ALA B 139 -0.721 -6.225 20.937 1.00 71.35 H new ATOM 0 HB2 ALA B 139 0.094 -5.061 19.866 1.00 71.35 H new ATOM 0 HB3 ALA B 139 0.357 -4.988 21.625 1.00 71.35 H new