USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 924 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 117 ASN : amide:sc= 0.796 K(o=2,f=-4.3!) USER MOD Set 1.2: A 119 THR OG1 : rot 79:sc= 1.19 USER MOD Set 2.1: A 103 THR OG1 : rot -0:sc= 1.52 USER MOD Set 2.2: A 105 GLN : amide:sc= 0.583 K(o=2.1,f=0.92) USER MOD Set 3.1: A 95 GLN : amide:sc= -1.49! X(o=0.44!,f=0.65) USER MOD Set 3.2: A 97 ASN : amide:sc= 0.689 K(o=0.44,f=-3.5!) USER MOD Set 3.3: A 108 THR OG1 : rot -81:sc= 1.24 USER MOD Set 4.1: A 13 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Set 4.2: A 17 ASN : amide:sc= 0 X(o=0,f=-0.0042) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 132:sc= 0.104 (180deg=-0.0581) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.0477 USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.54 K(o=-0.54,f=0) USER MOD Single : A 11 ASN : amide:sc= -1.13 K(o=-1.1,f=-6.4!) USER MOD Single : A 19 ASN : amide:sc= 0.038 K(o=0.038,f=-3.4!) USER MOD Single : A 20 ASN : amide:sc= -0.0027 K(o=-0.0027,f=-0.77) USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=-0.0031) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 GLN : amide:sc= -0.0784 K(o=-0.078,f=-0.74) USER MOD Single : A 32 ASN : amide:sc= 0.0635 X(o=0.064,f=-0.29) USER MOD Single : A 33 SER OG : rot 49:sc= 0.0185 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot -15:sc= 1.21 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= -0.113 X(o=-0.11,f=-0.35) USER MOD Single : A 59 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= -2.26 K(o=-2.3,f=-1.2) USER MOD Single : A 68 SER OG : rot 104:sc= 1.29 USER MOD Single : A 69 ASN : amide:sc= 0 X(o=0,f=-0.048) USER MOD Single : A 71 ASN : amide:sc= -0.122! K(o=-0.12!,f=-1.4) USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.249 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl -162:sc= -0.0973 (180deg=-0.477) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= -0.852 K(o=-0.85,f=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -3.72! C(o=-3.7!,f=-4.7!) USER MOD Single : A 93 GLN : amide:sc= -2.25! K(o=-2.2!,f=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 150:sc= 0.552 (180deg=-0.343!) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc= -0.893 K(o=-0.89,f=0) USER MOD Single : A 116 ASN : amide:sc= -0.671 X(o=-0.67,f=-0.86) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 122 HIS : no HD1:sc= -0.841 K(o=-0.84,f=-0.11) USER MOD Single : A 123 HIS : no HD1:sc= -0.22 K(o=-0.22,f=-1) USER MOD Single : A 124 HIS : no HD1:sc= 0 X(o=0,f=-0.089) USER MOD Single : A 125 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 126 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=-0.0031) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -25.528 63.202 -28.413 1.00 0.00 N ATOM 2 CA MET A 1 -24.101 63.592 -28.345 1.00 52.33 C ATOM 3 C MET A 1 -23.913 64.714 -27.339 1.00 71.33 C ATOM 4 O MET A 1 -24.882 65.379 -26.959 1.00 1.24 O ATOM 5 CB MET A 1 -23.599 64.040 -29.722 1.00 2.44 C ATOM 6 CG MET A 1 -24.331 65.253 -30.272 1.00 75.50 C ATOM 7 SD MET A 1 -23.651 65.817 -31.843 1.00 21.34 S ATOM 8 CE MET A 1 -24.790 67.141 -32.231 1.00 13.04 C ATOM 0 H1 MET A 1 -25.826 63.149 -29.408 1.00 0.00 H new ATOM 0 H2 MET A 1 -25.656 62.273 -27.963 1.00 0.00 H new ATOM 0 H3 MET A 1 -26.105 63.910 -27.916 1.00 0.00 H new ATOM 0 HA MET A 1 -23.522 62.725 -28.027 1.00 52.33 H new ATOM 0 HB2 MET A 1 -22.535 64.268 -29.655 1.00 2.44 H new ATOM 0 HB3 MET A 1 -23.704 63.213 -30.424 1.00 2.44 H new ATOM 0 HG2 MET A 1 -25.385 65.008 -30.403 1.00 75.50 H new ATOM 0 HG3 MET A 1 -24.280 66.064 -29.546 1.00 75.50 H new ATOM 0 HE1 MET A 1 -24.508 67.598 -33.180 1.00 13.04 H new ATOM 0 HE2 MET A 1 -25.801 66.741 -32.308 1.00 13.04 H new ATOM 0 HE3 MET A 1 -24.757 67.893 -31.442 1.00 13.04 H new ATOM 20 N ALA A 2 -22.663 64.912 -26.914 1.00 12.30 N ATOM 21 CA ALA A 2 -22.306 65.963 -25.965 1.00 21.34 C ATOM 22 C ALA A 2 -22.990 65.746 -24.616 1.00 14.20 C ATOM 23 O ALA A 2 -23.512 64.662 -24.340 1.00 72.13 O ATOM 24 CB ALA A 2 -22.644 67.336 -26.532 1.00 74.23 C ATOM 0 H ALA A 2 -21.871 64.347 -27.220 1.00 12.30 H new ATOM 0 HA ALA A 2 -21.229 65.916 -25.801 1.00 21.34 H new ATOM 0 HB1 ALA A 2 -22.370 68.105 -25.810 1.00 74.23 H new ATOM 0 HB2 ALA A 2 -22.090 67.494 -27.458 1.00 74.23 H new ATOM 0 HB3 ALA A 2 -23.713 67.393 -26.735 1.00 74.23 H new ATOM 30 N GLY A 3 -22.955 66.767 -23.771 1.00 50.23 N ATOM 31 CA GLY A 3 -23.581 66.678 -22.473 1.00 65.14 C ATOM 32 C GLY A 3 -22.561 66.542 -21.364 1.00 23.21 C ATOM 33 O GLY A 3 -22.035 65.452 -21.130 1.00 32.24 O ATOM 0 H GLY A 3 -22.501 67.659 -23.966 1.00 50.23 H new ATOM 0 HA2 GLY A 3 -24.188 67.567 -22.301 1.00 65.14 H new ATOM 0 HA3 GLY A 3 -24.256 65.822 -22.453 1.00 65.14 H new ATOM 37 N THR A 4 -22.275 67.648 -20.690 1.00 43.32 N ATOM 38 CA THR A 4 -21.301 67.658 -19.608 1.00 31.21 C ATOM 39 C THR A 4 -21.820 66.891 -18.396 1.00 2.41 C ATOM 40 O THR A 4 -22.640 67.394 -17.626 1.00 63.23 O ATOM 41 CB THR A 4 -20.932 69.100 -19.206 1.00 4.31 C ATOM 42 OG1 THR A 4 -22.085 69.949 -19.311 1.00 72.25 O ATOM 43 CG2 THR A 4 -19.818 69.640 -20.088 1.00 71.44 C ATOM 0 H THR A 4 -22.706 68.554 -20.875 1.00 43.32 H new ATOM 0 HA THR A 4 -20.402 67.161 -19.972 1.00 31.21 H new ATOM 0 HB THR A 4 -20.582 69.087 -18.174 1.00 4.31 H new ATOM 0 HG1 THR A 4 -21.843 70.863 -19.052 1.00 72.25 H new ATOM 0 HG21 THR A 4 -19.575 70.659 -19.785 1.00 71.44 H new ATOM 0 HG22 THR A 4 -18.934 69.010 -19.984 1.00 71.44 H new ATOM 0 HG23 THR A 4 -20.144 69.639 -21.128 1.00 71.44 H new ATOM 51 N MET A 5 -21.345 65.665 -18.247 1.00 11.31 N ATOM 52 CA MET A 5 -21.799 64.782 -17.186 1.00 75.43 C ATOM 53 C MET A 5 -20.608 64.067 -16.570 1.00 15.13 C ATOM 54 O MET A 5 -19.508 64.114 -17.125 1.00 24.32 O ATOM 55 CB MET A 5 -22.788 63.754 -17.745 1.00 22.24 C ATOM 56 CG MET A 5 -22.175 62.862 -18.812 1.00 23.44 C ATOM 57 SD MET A 5 -23.353 61.696 -19.522 1.00 11.43 S ATOM 58 CE MET A 5 -22.298 60.833 -20.684 1.00 45.42 C ATOM 0 H MET A 5 -20.637 65.255 -18.856 1.00 11.31 H new ATOM 0 HA MET A 5 -22.299 65.375 -16.420 1.00 75.43 H new ATOM 0 HB2 MET A 5 -23.159 63.134 -16.929 1.00 22.24 H new ATOM 0 HB3 MET A 5 -23.648 64.276 -18.165 1.00 22.24 H new ATOM 0 HG2 MET A 5 -21.766 63.485 -19.607 1.00 23.44 H new ATOM 0 HG3 MET A 5 -21.341 62.309 -18.380 1.00 23.44 H new ATOM 0 HE1 MET A 5 -22.879 60.074 -21.208 1.00 45.42 H new ATOM 0 HE2 MET A 5 -21.894 61.543 -21.406 1.00 45.42 H new ATOM 0 HE3 MET A 5 -21.478 60.356 -20.147 1.00 45.42 H new ATOM 68 N THR A 6 -20.834 63.419 -15.430 1.00 41.42 N ATOM 69 CA THR A 6 -19.816 62.607 -14.771 1.00 43.12 C ATOM 70 C THR A 6 -18.749 63.467 -14.082 1.00 64.43 C ATOM 71 O THR A 6 -18.217 64.419 -14.657 1.00 60.42 O ATOM 72 CB THR A 6 -19.158 61.626 -15.769 1.00 74.21 C ATOM 73 OG1 THR A 6 -20.164 60.765 -16.325 1.00 54.11 O ATOM 74 CG2 THR A 6 -18.084 60.785 -15.096 1.00 62.12 C ATOM 0 H THR A 6 -21.727 63.442 -14.938 1.00 41.42 H new ATOM 0 HA THR A 6 -20.322 62.030 -13.997 1.00 43.12 H new ATOM 0 HB THR A 6 -18.685 62.210 -16.559 1.00 74.21 H new ATOM 0 HG1 THR A 6 -19.749 60.144 -16.959 1.00 54.11 H new ATOM 0 HG21 THR A 6 -17.642 60.107 -15.826 1.00 62.12 H new ATOM 0 HG22 THR A 6 -17.310 61.438 -14.693 1.00 62.12 H new ATOM 0 HG23 THR A 6 -18.529 60.207 -14.286 1.00 62.12 H new ATOM 82 N PHE A 7 -18.453 63.133 -12.834 1.00 42.33 N ATOM 83 CA PHE A 7 -17.445 63.852 -12.076 1.00 74.33 C ATOM 84 C PHE A 7 -16.200 62.991 -11.871 1.00 63.13 C ATOM 85 O PHE A 7 -15.214 63.170 -12.577 1.00 64.35 O ATOM 86 CB PHE A 7 -18.016 64.365 -10.737 1.00 24.13 C ATOM 87 CG PHE A 7 -18.954 63.414 -10.029 1.00 71.12 C ATOM 88 CD1 PHE A 7 -18.522 62.657 -8.948 1.00 75.04 C ATOM 89 CD2 PHE A 7 -20.277 63.289 -10.437 1.00 54.44 C ATOM 90 CE1 PHE A 7 -19.386 61.796 -8.296 1.00 24.44 C ATOM 91 CE2 PHE A 7 -21.142 62.427 -9.789 1.00 13.11 C ATOM 92 CZ PHE A 7 -20.696 61.681 -8.717 1.00 63.23 C ATOM 0 H PHE A 7 -18.898 62.368 -12.327 1.00 42.33 H new ATOM 0 HA PHE A 7 -17.145 64.727 -12.653 1.00 74.33 H new ATOM 0 HB2 PHE A 7 -17.185 64.593 -10.070 1.00 24.13 H new ATOM 0 HB3 PHE A 7 -18.544 65.301 -10.921 1.00 24.13 H new ATOM 0 HD1 PHE A 7 -17.499 62.742 -8.612 1.00 75.04 H new ATOM 0 HD2 PHE A 7 -20.634 63.874 -11.272 1.00 54.44 H new ATOM 0 HE1 PHE A 7 -19.036 61.213 -7.457 1.00 24.44 H new ATOM 0 HE2 PHE A 7 -22.166 62.337 -10.121 1.00 13.11 H new ATOM 0 HZ PHE A 7 -21.371 61.008 -8.208 1.00 63.23 H new ATOM 102 N GLN A 8 -16.268 62.058 -10.915 1.00 31.11 N ATOM 103 CA GLN A 8 -15.166 61.139 -10.568 1.00 22.32 C ATOM 104 C GLN A 8 -13.826 61.859 -10.371 1.00 73.41 C ATOM 105 O GLN A 8 -12.769 61.227 -10.394 1.00 70.13 O ATOM 106 CB GLN A 8 -15.015 59.998 -11.599 1.00 44.31 C ATOM 107 CG GLN A 8 -14.500 60.424 -12.964 1.00 2.34 C ATOM 108 CD GLN A 8 -14.250 59.250 -13.887 1.00 35.43 C ATOM 109 OE1 GLN A 8 -13.150 58.700 -13.924 1.00 50.31 O ATOM 110 NE2 GLN A 8 -15.268 58.851 -14.632 1.00 14.45 N ATOM 0 H GLN A 8 -17.103 61.914 -10.348 1.00 31.11 H new ATOM 0 HA GLN A 8 -15.445 60.701 -9.609 1.00 22.32 H new ATOM 0 HB2 GLN A 8 -14.338 59.248 -11.191 1.00 44.31 H new ATOM 0 HB3 GLN A 8 -15.984 59.516 -11.728 1.00 44.31 H new ATOM 0 HG2 GLN A 8 -15.222 61.097 -13.426 1.00 2.34 H new ATOM 0 HG3 GLN A 8 -13.575 60.986 -12.839 1.00 2.34 H new ATOM 0 HE21 GLN A 8 -16.164 59.334 -14.572 1.00 14.45 H new ATOM 0 HE22 GLN A 8 -15.157 58.060 -15.267 1.00 14.45 H new ATOM 119 N PHE A 9 -13.869 63.164 -10.131 1.00 73.24 N ATOM 120 CA PHE A 9 -12.654 63.938 -9.930 1.00 4.13 C ATOM 121 C PHE A 9 -12.358 64.086 -8.446 1.00 32.53 C ATOM 122 O PHE A 9 -13.127 63.606 -7.610 1.00 20.24 O ATOM 123 CB PHE A 9 -12.769 65.316 -10.588 1.00 55.13 C ATOM 124 CG PHE A 9 -12.802 65.267 -12.088 1.00 3.12 C ATOM 125 CD1 PHE A 9 -11.799 64.624 -12.793 1.00 54.02 C ATOM 126 CD2 PHE A 9 -13.832 65.865 -12.793 1.00 53.11 C ATOM 127 CE1 PHE A 9 -11.822 64.579 -14.174 1.00 4.52 C ATOM 128 CE2 PHE A 9 -13.861 65.825 -14.173 1.00 31.40 C ATOM 129 CZ PHE A 9 -12.857 65.179 -14.864 1.00 63.11 C ATOM 0 H PHE A 9 -14.731 63.706 -10.071 1.00 73.24 H new ATOM 0 HA PHE A 9 -11.829 63.402 -10.400 1.00 4.13 H new ATOM 0 HB2 PHE A 9 -13.674 65.806 -10.229 1.00 55.13 H new ATOM 0 HB3 PHE A 9 -11.927 65.931 -10.272 1.00 55.13 H new ATOM 0 HD1 PHE A 9 -10.989 64.152 -12.257 1.00 54.02 H new ATOM 0 HD2 PHE A 9 -14.623 66.369 -12.257 1.00 53.11 H new ATOM 0 HE1 PHE A 9 -11.032 64.076 -14.712 1.00 4.52 H new ATOM 0 HE2 PHE A 9 -14.669 66.299 -14.711 1.00 31.40 H new ATOM 0 HZ PHE A 9 -12.880 65.142 -15.943 1.00 63.11 H new ATOM 139 N ARG A 10 -11.248 64.756 -8.133 1.00 62.51 N ATOM 140 CA ARG A 10 -10.798 64.938 -6.754 1.00 44.32 C ATOM 141 C ARG A 10 -10.489 63.594 -6.101 1.00 21.34 C ATOM 142 O ARG A 10 -11.308 63.027 -5.372 1.00 35.21 O ATOM 143 CB ARG A 10 -11.828 65.721 -5.933 1.00 21.20 C ATOM 144 CG ARG A 10 -12.022 67.147 -6.420 1.00 72.03 C ATOM 145 CD ARG A 10 -13.092 67.877 -5.626 1.00 53.43 C ATOM 146 NE ARG A 10 -12.833 67.840 -4.187 1.00 61.25 N ATOM 147 CZ ARG A 10 -12.078 68.729 -3.539 1.00 52.03 C ATOM 148 NH1 ARG A 10 -11.458 69.699 -4.204 1.00 11.40 N1+ ATOM 149 NH2 ARG A 10 -11.931 68.638 -2.227 1.00 60.33 N ATOM 0 H ARG A 10 -10.637 65.187 -8.827 1.00 62.51 H new ATOM 0 HA ARG A 10 -9.878 65.523 -6.778 1.00 44.32 H new ATOM 0 HB2 ARG A 10 -12.784 65.199 -5.968 1.00 21.20 H new ATOM 0 HB3 ARG A 10 -11.513 65.740 -4.890 1.00 21.20 H new ATOM 0 HG2 ARG A 10 -11.079 67.689 -6.342 1.00 72.03 H new ATOM 0 HG3 ARG A 10 -12.297 67.136 -7.475 1.00 72.03 H new ATOM 0 HD2 ARG A 10 -13.144 68.914 -5.958 1.00 53.43 H new ATOM 0 HD3 ARG A 10 -14.064 67.428 -5.830 1.00 53.43 H new ATOM 0 HE ARG A 10 -13.256 67.087 -3.645 1.00 61.25 H new ATOM 0 HH11 ARG A 10 -11.558 69.767 -5.217 1.00 11.40 H new ATOM 0 HH12 ARG A 10 -10.883 70.375 -3.701 1.00 11.40 H new ATOM 0 HH21 ARG A 10 -12.395 67.889 -1.713 1.00 60.33 H new ATOM 0 HH22 ARG A 10 -11.354 69.317 -1.730 1.00 60.33 H new ATOM 163 N ASN A 11 -9.303 63.087 -6.397 1.00 4.11 N ATOM 164 CA ASN A 11 -8.854 61.800 -5.886 1.00 44.33 C ATOM 165 C ASN A 11 -8.404 61.963 -4.431 1.00 62.55 C ATOM 166 O ASN A 11 -7.809 62.988 -4.083 1.00 3.33 O ATOM 167 CB ASN A 11 -7.698 61.313 -6.786 1.00 42.41 C ATOM 168 CG ASN A 11 -7.302 59.852 -6.609 1.00 62.50 C ATOM 169 OD1 ASN A 11 -7.277 59.313 -5.510 1.00 63.14 O ATOM 170 ND2 ASN A 11 -6.982 59.198 -7.715 1.00 43.24 N ATOM 0 H ASN A 11 -8.624 63.555 -6.998 1.00 4.11 H new ATOM 0 HA ASN A 11 -9.656 61.062 -5.903 1.00 44.33 H new ATOM 0 HB2 ASN A 11 -7.979 61.472 -7.827 1.00 42.41 H new ATOM 0 HB3 ASN A 11 -6.824 61.935 -6.593 1.00 42.41 H new ATOM 0 HD21 ASN A 11 -6.705 58.218 -7.666 1.00 43.24 H new ATOM 0 HD22 ASN A 11 -7.013 59.675 -8.616 1.00 43.24 H new ATOM 177 N PRO A 12 -8.714 60.978 -3.560 1.00 71.33 N ATOM 178 CA PRO A 12 -8.287 60.971 -2.154 1.00 34.14 C ATOM 179 C PRO A 12 -6.796 61.268 -1.968 1.00 51.42 C ATOM 180 O PRO A 12 -5.974 60.964 -2.838 1.00 63.23 O ATOM 181 CB PRO A 12 -8.609 59.546 -1.671 1.00 5.44 C ATOM 182 CG PRO A 12 -9.070 58.792 -2.877 1.00 13.40 C ATOM 183 CD PRO A 12 -9.568 59.819 -3.852 1.00 22.12 C ATOM 0 HA PRO A 12 -8.797 61.754 -1.593 1.00 34.14 H new ATOM 0 HB2 PRO A 12 -7.730 59.076 -1.231 1.00 5.44 H new ATOM 0 HB3 PRO A 12 -9.381 59.561 -0.902 1.00 5.44 H new ATOM 0 HG2 PRO A 12 -8.254 58.211 -3.307 1.00 13.40 H new ATOM 0 HG3 PRO A 12 -9.860 58.088 -2.617 1.00 13.40 H new ATOM 0 HD2 PRO A 12 -9.459 59.485 -4.884 1.00 22.12 H new ATOM 0 HD3 PRO A 12 -10.623 60.044 -3.700 1.00 22.12 H new ATOM 191 N ASN A 13 -6.472 61.847 -0.815 1.00 41.30 N ATOM 192 CA ASN A 13 -5.110 62.263 -0.476 1.00 75.43 C ATOM 193 C ASN A 13 -4.608 63.328 -1.444 1.00 53.44 C ATOM 194 O ASN A 13 -4.002 63.025 -2.475 1.00 60.03 O ATOM 195 CB ASN A 13 -4.132 61.084 -0.446 1.00 5.35 C ATOM 196 CG ASN A 13 -2.750 61.501 0.030 1.00 12.51 C ATOM 197 OD1 ASN A 13 -2.607 62.396 0.864 1.00 74.54 O ATOM 198 ND2 ASN A 13 -1.722 60.863 -0.507 1.00 31.22 N ATOM 0 H ASN A 13 -7.153 62.043 -0.081 1.00 41.30 H new ATOM 0 HA ASN A 13 -5.154 62.684 0.528 1.00 75.43 H new ATOM 0 HB2 ASN A 13 -4.522 60.306 0.211 1.00 5.35 H new ATOM 0 HB3 ASN A 13 -4.056 60.651 -1.443 1.00 5.35 H new ATOM 0 HD21 ASN A 13 -0.770 61.107 -0.233 1.00 31.22 H new ATOM 0 HD22 ASN A 13 -1.881 60.127 -1.195 1.00 31.22 H new ATOM 205 N PHE A 14 -4.879 64.576 -1.105 1.00 62.35 N ATOM 206 CA PHE A 14 -4.456 65.703 -1.915 1.00 0.14 C ATOM 207 C PHE A 14 -3.898 66.808 -1.026 1.00 75.23 C ATOM 208 O PHE A 14 -4.565 67.284 -0.106 1.00 23.43 O ATOM 209 CB PHE A 14 -5.610 66.224 -2.790 1.00 41.22 C ATOM 210 CG PHE A 14 -6.891 66.520 -2.048 1.00 21.33 C ATOM 211 CD1 PHE A 14 -7.798 65.507 -1.767 1.00 5.43 C ATOM 212 CD2 PHE A 14 -7.193 67.813 -1.641 1.00 23.12 C ATOM 213 CE1 PHE A 14 -8.976 65.778 -1.097 1.00 32.32 C ATOM 214 CE2 PHE A 14 -8.369 68.086 -0.970 1.00 54.41 C ATOM 215 CZ PHE A 14 -9.261 67.067 -0.696 1.00 3.14 C ATOM 0 H PHE A 14 -5.396 64.835 -0.265 1.00 62.35 H new ATOM 0 HA PHE A 14 -3.665 65.367 -2.586 1.00 0.14 H new ATOM 0 HB2 PHE A 14 -5.282 67.133 -3.294 1.00 41.22 H new ATOM 0 HB3 PHE A 14 -5.819 65.487 -3.565 1.00 41.22 H new ATOM 0 HD1 PHE A 14 -7.580 64.495 -2.076 1.00 5.43 H new ATOM 0 HD2 PHE A 14 -6.500 68.614 -1.852 1.00 23.12 H new ATOM 0 HE1 PHE A 14 -9.674 64.981 -0.887 1.00 32.32 H new ATOM 0 HE2 PHE A 14 -8.591 69.096 -0.659 1.00 54.41 H new ATOM 0 HZ PHE A 14 -10.180 67.279 -0.169 1.00 3.14 H new ATOM 225 N GLY A 15 -2.657 67.183 -1.289 1.00 54.15 N ATOM 226 CA GLY A 15 -2.001 68.206 -0.501 1.00 71.23 C ATOM 227 C GLY A 15 -0.549 67.870 -0.251 1.00 65.22 C ATOM 228 O GLY A 15 0.300 68.758 -0.173 1.00 42.44 O ATOM 0 H GLY A 15 -2.087 66.794 -2.040 1.00 54.15 H new ATOM 0 HA2 GLY A 15 -2.070 69.164 -1.017 1.00 71.23 H new ATOM 0 HA3 GLY A 15 -2.518 68.320 0.452 1.00 71.23 H new ATOM 232 N GLY A 16 -0.265 66.580 -0.133 1.00 14.53 N ATOM 233 CA GLY A 16 1.098 66.133 0.062 1.00 0.24 C ATOM 234 C GLY A 16 1.326 65.519 1.427 1.00 22.35 C ATOM 235 O GLY A 16 0.528 65.715 2.346 1.00 73.33 O ATOM 0 H GLY A 16 -0.958 65.833 -0.169 1.00 14.53 H new ATOM 0 HA2 GLY A 16 1.349 65.402 -0.706 1.00 0.24 H new ATOM 0 HA3 GLY A 16 1.774 66.978 -0.069 1.00 0.24 H new ATOM 239 N ASN A 17 2.403 64.760 1.553 1.00 43.33 N ATOM 240 CA ASN A 17 2.800 64.191 2.834 1.00 1.12 C ATOM 241 C ASN A 17 4.011 64.940 3.376 1.00 62.33 C ATOM 242 O ASN A 17 4.856 65.396 2.603 1.00 61.32 O ATOM 243 CB ASN A 17 3.130 62.700 2.693 1.00 21.55 C ATOM 244 CG ASN A 17 1.914 61.847 2.375 1.00 72.14 C ATOM 245 OD1 ASN A 17 1.569 61.643 1.209 1.00 51.22 O ATOM 246 ND2 ASN A 17 1.272 61.320 3.407 1.00 0.34 N ATOM 0 H ASN A 17 3.023 64.522 0.779 1.00 43.33 H new ATOM 0 HA ASN A 17 1.967 64.293 3.529 1.00 1.12 H new ATOM 0 HB2 ASN A 17 3.872 62.571 1.905 1.00 21.55 H new ATOM 0 HB3 ASN A 17 3.583 62.345 3.619 1.00 21.55 H new ATOM 0 HD21 ASN A 17 0.461 60.721 3.251 1.00 0.34 H new ATOM 0 HD22 ASN A 17 1.589 61.513 4.357 1.00 0.34 H new ATOM 253 N PRO A 18 4.097 65.105 4.706 1.00 24.35 N ATOM 254 CA PRO A 18 5.222 65.788 5.350 1.00 21.23 C ATOM 255 C PRO A 18 6.546 65.050 5.146 1.00 14.44 C ATOM 256 O PRO A 18 6.725 63.918 5.606 1.00 61.41 O ATOM 257 CB PRO A 18 4.837 65.815 6.833 1.00 45.30 C ATOM 258 CG PRO A 18 3.829 64.734 6.993 1.00 32.23 C ATOM 259 CD PRO A 18 3.097 64.649 5.686 1.00 15.21 C ATOM 0 HA PRO A 18 5.385 66.780 4.929 1.00 21.23 H new ATOM 0 HB2 PRO A 18 5.705 65.641 7.469 1.00 45.30 H new ATOM 0 HB3 PRO A 18 4.424 66.784 7.115 1.00 45.30 H new ATOM 0 HG2 PRO A 18 4.310 63.786 7.233 1.00 32.23 H new ATOM 0 HG3 PRO A 18 3.143 64.959 7.810 1.00 32.23 H new ATOM 0 HD2 PRO A 18 2.764 63.632 5.477 1.00 15.21 H new ATOM 0 HD3 PRO A 18 2.210 65.283 5.680 1.00 15.21 H new ATOM 267 N ASN A 19 7.468 65.694 4.447 1.00 23.42 N ATOM 268 CA ASN A 19 8.765 65.102 4.155 1.00 64.52 C ATOM 269 C ASN A 19 9.876 65.890 4.849 1.00 63.24 C ATOM 270 O ASN A 19 9.644 66.990 5.354 1.00 74.52 O ATOM 271 CB ASN A 19 8.985 65.069 2.637 1.00 34.52 C ATOM 272 CG ASN A 19 10.224 64.292 2.233 1.00 65.20 C ATOM 273 OD1 ASN A 19 10.649 63.367 2.927 1.00 30.24 O ATOM 274 ND2 ASN A 19 10.806 64.650 1.101 1.00 44.43 N ATOM 0 H ASN A 19 7.341 66.633 4.069 1.00 23.42 H new ATOM 0 HA ASN A 19 8.789 64.081 4.535 1.00 64.52 H new ATOM 0 HB2 ASN A 19 8.112 64.624 2.159 1.00 34.52 H new ATOM 0 HB3 ASN A 19 9.066 66.090 2.265 1.00 34.52 H new ATOM 0 HD21 ASN A 19 11.636 64.155 0.776 1.00 44.43 H new ATOM 0 HD22 ASN A 19 10.425 65.421 0.553 1.00 44.43 H new ATOM 281 N ASN A 20 11.066 65.312 4.901 1.00 0.34 N ATOM 282 CA ASN A 20 12.224 65.969 5.496 1.00 2.02 C ATOM 283 C ASN A 20 12.668 67.143 4.624 1.00 40.34 C ATOM 284 O ASN A 20 12.715 67.033 3.396 1.00 74.24 O ATOM 285 CB ASN A 20 13.360 64.953 5.667 1.00 1.51 C ATOM 286 CG ASN A 20 14.648 65.556 6.203 1.00 51.11 C ATOM 287 OD1 ASN A 20 14.641 66.536 6.948 1.00 52.43 O ATOM 288 ND2 ASN A 20 15.764 64.952 5.838 1.00 2.01 N ATOM 0 H ASN A 20 11.258 64.380 4.535 1.00 0.34 H new ATOM 0 HA ASN A 20 11.955 66.359 6.478 1.00 2.02 H new ATOM 0 HB2 ASN A 20 13.030 64.164 6.343 1.00 1.51 H new ATOM 0 HB3 ASN A 20 13.563 64.484 4.704 1.00 1.51 H new ATOM 0 HD21 ASN A 20 16.663 65.295 6.175 1.00 2.01 H new ATOM 0 HD22 ASN A 20 15.727 64.142 5.219 1.00 2.01 H new ATOM 295 N GLY A 21 12.970 68.268 5.258 1.00 62.44 N ATOM 296 CA GLY A 21 13.349 69.456 4.521 1.00 13.55 C ATOM 297 C GLY A 21 14.845 69.697 4.529 1.00 0.45 C ATOM 298 O GLY A 21 15.568 69.163 5.376 1.00 25.41 O ATOM 0 H GLY A 21 12.959 68.379 6.272 1.00 62.44 H new ATOM 0 HA2 GLY A 21 13.005 69.364 3.491 1.00 13.55 H new ATOM 0 HA3 GLY A 21 12.843 70.321 4.950 1.00 13.55 H new ATOM 302 N ALA A 22 15.311 70.490 3.576 1.00 11.14 N ATOM 303 CA ALA A 22 16.718 70.838 3.483 1.00 24.15 C ATOM 304 C ALA A 22 17.084 71.904 4.508 1.00 21.32 C ATOM 305 O ALA A 22 16.310 72.828 4.765 1.00 64.10 O ATOM 306 CB ALA A 22 17.049 71.317 2.079 1.00 21.11 C ATOM 0 H ALA A 22 14.728 70.907 2.851 1.00 11.14 H new ATOM 0 HA ALA A 22 17.306 69.946 3.698 1.00 24.15 H new ATOM 0 HB1 ALA A 22 18.107 71.575 2.022 1.00 21.11 H new ATOM 0 HB2 ALA A 22 16.830 70.525 1.363 1.00 21.11 H new ATOM 0 HB3 ALA A 22 16.448 72.195 1.843 1.00 21.11 H new ATOM 312 N PHE A 23 18.267 71.768 5.086 1.00 32.04 N ATOM 313 CA PHE A 23 18.742 72.696 6.101 1.00 53.22 C ATOM 314 C PHE A 23 20.022 73.386 5.639 1.00 65.32 C ATOM 315 O PHE A 23 21.097 72.786 5.623 1.00 62.34 O ATOM 316 CB PHE A 23 18.958 71.963 7.437 1.00 65.22 C ATOM 317 CG PHE A 23 19.702 70.657 7.320 1.00 71.25 C ATOM 318 CD1 PHE A 23 21.051 70.581 7.627 1.00 53.43 C ATOM 319 CD2 PHE A 23 19.050 69.506 6.902 1.00 21.43 C ATOM 320 CE1 PHE A 23 21.733 69.386 7.515 1.00 0.12 C ATOM 321 CE2 PHE A 23 19.729 68.311 6.791 1.00 3.24 C ATOM 322 CZ PHE A 23 21.071 68.249 7.097 1.00 64.54 C ATOM 0 H PHE A 23 18.921 71.017 4.867 1.00 32.04 H new ATOM 0 HA PHE A 23 17.984 73.464 6.255 1.00 53.22 H new ATOM 0 HB2 PHE A 23 19.506 72.620 8.113 1.00 65.22 H new ATOM 0 HB3 PHE A 23 17.987 71.774 7.894 1.00 65.22 H new ATOM 0 HD1 PHE A 23 21.574 71.466 7.957 1.00 53.43 H new ATOM 0 HD2 PHE A 23 17.998 69.546 6.661 1.00 21.43 H new ATOM 0 HE1 PHE A 23 22.785 69.341 7.755 1.00 0.12 H new ATOM 0 HE2 PHE A 23 19.209 67.423 6.464 1.00 3.24 H new ATOM 0 HZ PHE A 23 21.604 67.313 7.010 1.00 64.54 H new ATOM 332 N LEU A 24 19.892 74.644 5.235 1.00 53.34 N ATOM 333 CA LEU A 24 21.029 75.418 4.756 1.00 51.34 C ATOM 334 C LEU A 24 20.657 76.889 4.609 1.00 45.44 C ATOM 335 O LEU A 24 19.597 77.228 4.075 1.00 10.11 O ATOM 336 CB LEU A 24 21.564 74.878 3.414 1.00 62.32 C ATOM 337 CG LEU A 24 20.671 75.088 2.181 1.00 3.14 C ATOM 338 CD1 LEU A 24 21.456 74.817 0.909 1.00 23.03 C ATOM 339 CD2 LEU A 24 19.441 74.196 2.225 1.00 11.23 C ATOM 0 H LEU A 24 19.007 75.151 5.230 1.00 53.34 H new ATOM 0 HA LEU A 24 21.820 75.321 5.500 1.00 51.34 H new ATOM 0 HB2 LEU A 24 22.529 75.346 3.219 1.00 62.32 H new ATOM 0 HB3 LEU A 24 21.745 73.809 3.525 1.00 62.32 H new ATOM 0 HG LEU A 24 20.339 76.126 2.188 1.00 3.14 H new ATOM 0 HD11 LEU A 24 20.811 74.970 0.044 1.00 23.03 H new ATOM 0 HD12 LEU A 24 22.305 75.498 0.853 1.00 23.03 H new ATOM 0 HD13 LEU A 24 21.816 73.788 0.916 1.00 23.03 H new ATOM 0 HD21 LEU A 24 18.833 74.371 1.338 1.00 11.23 H new ATOM 0 HD22 LEU A 24 19.750 73.151 2.253 1.00 11.23 H new ATOM 0 HD23 LEU A 24 18.857 74.425 3.116 1.00 11.23 H new ATOM 351 N LEU A 25 21.528 77.755 5.097 1.00 14.23 N ATOM 352 CA LEU A 25 21.355 79.191 4.945 1.00 22.42 C ATOM 353 C LEU A 25 22.555 79.768 4.208 1.00 42.44 C ATOM 354 O LEU A 25 23.383 80.469 4.788 1.00 41.32 O ATOM 355 CB LEU A 25 21.187 79.873 6.308 1.00 52.44 C ATOM 356 CG LEU A 25 19.974 79.422 7.124 1.00 3.52 C ATOM 357 CD1 LEU A 25 19.978 80.094 8.487 1.00 35.34 C ATOM 358 CD2 LEU A 25 18.683 79.736 6.380 1.00 34.05 C ATOM 0 H LEU A 25 22.370 77.486 5.607 1.00 14.23 H new ATOM 0 HA LEU A 25 20.450 79.377 4.367 1.00 22.42 H new ATOM 0 HB2 LEU A 25 22.086 79.695 6.897 1.00 52.44 H new ATOM 0 HB3 LEU A 25 21.117 80.949 6.150 1.00 52.44 H new ATOM 0 HG LEU A 25 20.034 78.343 7.267 1.00 3.52 H new ATOM 0 HD11 LEU A 25 19.110 79.765 9.058 1.00 35.34 H new ATOM 0 HD12 LEU A 25 20.888 79.824 9.023 1.00 35.34 H new ATOM 0 HD13 LEU A 25 19.939 81.176 8.359 1.00 35.34 H new ATOM 0 HD21 LEU A 25 17.831 79.408 6.975 1.00 34.05 H new ATOM 0 HD22 LEU A 25 18.614 80.810 6.208 1.00 34.05 H new ATOM 0 HD23 LEU A 25 18.679 79.215 5.423 1.00 34.05 H new ATOM 370 N ASN A 26 22.654 79.442 2.931 1.00 73.20 N ATOM 371 CA ASN A 26 23.808 79.826 2.136 1.00 60.40 C ATOM 372 C ASN A 26 23.381 80.603 0.899 1.00 55.24 C ATOM 373 O ASN A 26 24.131 81.431 0.384 1.00 70.31 O ATOM 374 CB ASN A 26 24.603 78.581 1.733 1.00 52.12 C ATOM 375 CG ASN A 26 25.890 78.915 1.001 1.00 31.52 C ATOM 376 OD1 ASN A 26 25.925 78.977 -0.230 1.00 61.41 O ATOM 377 ND2 ASN A 26 26.955 79.125 1.757 1.00 0.40 N ATOM 0 H ASN A 26 21.948 78.911 2.421 1.00 73.20 H new ATOM 0 HA ASN A 26 24.443 80.474 2.740 1.00 60.40 H new ATOM 0 HB2 ASN A 26 24.838 78.001 2.626 1.00 52.12 H new ATOM 0 HB3 ASN A 26 23.982 77.950 1.097 1.00 52.12 H new ATOM 0 HD21 ASN A 26 27.851 79.349 1.325 1.00 0.40 H new ATOM 0 HD22 ASN A 26 26.880 79.063 2.772 1.00 0.40 H new ATOM 384 N SER A 27 22.169 80.346 0.433 1.00 41.42 N ATOM 385 CA SER A 27 21.663 81.004 -0.759 1.00 71.35 C ATOM 386 C SER A 27 20.690 82.119 -0.390 1.00 32.44 C ATOM 387 O SER A 27 19.589 81.861 0.101 1.00 10.41 O ATOM 388 CB SER A 27 20.977 79.986 -1.668 1.00 30.22 C ATOM 389 OG SER A 27 21.845 78.901 -1.956 1.00 62.34 O ATOM 0 H SER A 27 21.519 79.687 0.862 1.00 41.42 H new ATOM 0 HA SER A 27 22.505 81.447 -1.292 1.00 71.35 H new ATOM 0 HB2 SER A 27 20.071 79.615 -1.188 1.00 30.22 H new ATOM 0 HB3 SER A 27 20.671 80.469 -2.596 1.00 30.22 H new ATOM 0 HG SER A 27 21.386 78.260 -2.538 1.00 62.34 H new ATOM 395 N ALA A 28 21.111 83.355 -0.608 1.00 11.40 N ATOM 396 CA ALA A 28 20.255 84.503 -0.364 1.00 74.12 C ATOM 397 C ALA A 28 19.683 85.019 -1.677 1.00 32.20 C ATOM 398 O ALA A 28 20.223 84.738 -2.748 1.00 40.33 O ATOM 399 CB ALA A 28 21.028 85.600 0.352 1.00 11.11 C ATOM 0 H ALA A 28 22.042 83.588 -0.954 1.00 11.40 H new ATOM 0 HA ALA A 28 19.429 84.194 0.277 1.00 74.12 H new ATOM 0 HB1 ALA A 28 20.372 86.453 0.527 1.00 11.11 H new ATOM 0 HB2 ALA A 28 21.395 85.223 1.306 1.00 11.11 H new ATOM 0 HB3 ALA A 28 21.872 85.912 -0.264 1.00 11.11 H new ATOM 405 N GLN A 29 18.588 85.760 -1.599 1.00 51.32 N ATOM 406 CA GLN A 29 17.962 86.306 -2.791 1.00 50.44 C ATOM 407 C GLN A 29 18.599 87.635 -3.169 1.00 51.32 C ATOM 408 O GLN A 29 18.466 88.630 -2.453 1.00 65.31 O ATOM 409 CB GLN A 29 16.456 86.473 -2.587 1.00 25.01 C ATOM 410 CG GLN A 29 15.722 85.155 -2.396 1.00 22.41 C ATOM 411 CD GLN A 29 14.221 85.327 -2.315 1.00 13.34 C ATOM 412 OE1 GLN A 29 13.656 85.503 -1.234 1.00 43.24 O ATOM 413 NE2 GLN A 29 13.560 85.266 -3.457 1.00 45.43 N ATOM 0 H GLN A 29 18.117 85.996 -0.726 1.00 51.32 H new ATOM 0 HA GLN A 29 18.119 85.603 -3.609 1.00 50.44 H new ATOM 0 HB2 GLN A 29 16.283 87.106 -1.717 1.00 25.01 H new ATOM 0 HB3 GLN A 29 16.036 86.993 -3.448 1.00 25.01 H new ATOM 0 HG2 GLN A 29 15.963 84.487 -3.223 1.00 22.41 H new ATOM 0 HG3 GLN A 29 16.078 84.675 -1.485 1.00 22.41 H new ATOM 0 HE21 GLN A 29 14.065 85.119 -4.331 1.00 45.43 H new ATOM 0 HE22 GLN A 29 12.545 85.366 -3.465 1.00 45.43 H new ATOM 422 N ALA A 30 19.315 87.636 -4.283 1.00 32.35 N ATOM 423 CA ALA A 30 19.963 88.841 -4.773 1.00 75.25 C ATOM 424 C ALA A 30 18.940 89.778 -5.398 1.00 2.24 C ATOM 425 O ALA A 30 17.909 89.336 -5.908 1.00 44.53 O ATOM 426 CB ALA A 30 21.048 88.491 -5.781 1.00 53.52 C ATOM 0 H ALA A 30 19.462 86.812 -4.866 1.00 32.35 H new ATOM 0 HA ALA A 30 20.428 89.350 -3.929 1.00 75.25 H new ATOM 0 HB1 ALA A 30 21.522 89.405 -6.137 1.00 53.52 H new ATOM 0 HB2 ALA A 30 21.795 87.856 -5.305 1.00 53.52 H new ATOM 0 HB3 ALA A 30 20.604 87.960 -6.624 1.00 53.52 H new ATOM 432 N GLN A 31 19.222 91.069 -5.349 1.00 62.43 N ATOM 433 CA GLN A 31 18.331 92.063 -5.917 1.00 45.15 C ATOM 434 C GLN A 31 18.614 92.229 -7.405 1.00 11.34 C ATOM 435 O GLN A 31 19.406 93.081 -7.815 1.00 33.30 O ATOM 436 CB GLN A 31 18.476 93.403 -5.185 1.00 15.14 C ATOM 437 CG GLN A 31 18.297 93.293 -3.678 1.00 52.33 C ATOM 438 CD GLN A 31 16.972 92.668 -3.281 1.00 4.22 C ATOM 439 OE1 GLN A 31 15.971 92.797 -3.988 1.00 75.53 O ATOM 440 NE2 GLN A 31 16.954 91.995 -2.142 1.00 5.45 N ATOM 0 H GLN A 31 20.064 91.453 -4.920 1.00 62.43 H new ATOM 0 HA GLN A 31 17.303 91.721 -5.793 1.00 45.15 H new ATOM 0 HB2 GLN A 31 19.461 93.819 -5.397 1.00 15.14 H new ATOM 0 HB3 GLN A 31 17.742 94.105 -5.580 1.00 15.14 H new ATOM 0 HG2 GLN A 31 19.111 92.698 -3.264 1.00 52.33 H new ATOM 0 HG3 GLN A 31 18.371 94.286 -3.236 1.00 52.33 H new ATOM 0 HE21 GLN A 31 17.805 91.911 -1.586 1.00 5.45 H new ATOM 0 HE22 GLN A 31 16.089 91.560 -1.820 1.00 5.45 H new ATOM 449 N ASN A 32 17.984 91.387 -8.208 1.00 32.35 N ATOM 450 CA ASN A 32 18.200 91.396 -9.649 1.00 60.00 C ATOM 451 C ASN A 32 16.876 91.283 -10.393 1.00 24.31 C ATOM 452 O ASN A 32 16.832 90.768 -11.508 1.00 12.35 O ATOM 453 CB ASN A 32 19.143 90.253 -10.069 1.00 55.23 C ATOM 454 CG ASN A 32 18.598 88.871 -9.750 1.00 52.21 C ATOM 455 OD1 ASN A 32 18.856 88.316 -8.682 1.00 64.01 O ATOM 456 ND2 ASN A 32 17.844 88.300 -10.676 1.00 12.22 N ATOM 0 H ASN A 32 17.316 90.686 -7.887 1.00 32.35 H new ATOM 0 HA ASN A 32 18.668 92.345 -9.912 1.00 60.00 H new ATOM 0 HB2 ASN A 32 19.331 90.323 -11.140 1.00 55.23 H new ATOM 0 HB3 ASN A 32 20.103 90.381 -9.568 1.00 55.23 H new ATOM 0 HD21 ASN A 32 17.456 87.370 -10.516 1.00 12.22 H new ATOM 0 HD22 ASN A 32 17.651 88.790 -11.550 1.00 12.22 H new ATOM 463 N SER A 33 15.806 91.784 -9.779 1.00 43.41 N ATOM 464 CA SER A 33 14.481 91.752 -10.392 1.00 24.32 C ATOM 465 C SER A 33 14.494 92.419 -11.769 1.00 0.13 C ATOM 466 O SER A 33 14.563 93.642 -11.891 1.00 23.01 O ATOM 467 CB SER A 33 13.464 92.417 -9.465 1.00 74.21 C ATOM 468 OG SER A 33 14.018 93.563 -8.841 1.00 5.52 O ATOM 0 H SER A 33 15.832 92.217 -8.856 1.00 43.41 H new ATOM 0 HA SER A 33 14.189 90.712 -10.539 1.00 24.32 H new ATOM 0 HB2 SER A 33 12.579 92.701 -10.034 1.00 74.21 H new ATOM 0 HB3 SER A 33 13.140 91.706 -8.705 1.00 74.21 H new ATOM 0 HG SER A 33 14.453 94.125 -9.516 1.00 5.52 H new ATOM 474 N TYR A 34 14.436 91.590 -12.799 1.00 44.31 N ATOM 475 CA TYR A 34 14.598 92.041 -14.175 1.00 61.24 C ATOM 476 C TYR A 34 13.594 91.322 -15.075 1.00 73.24 C ATOM 477 O TYR A 34 13.671 91.389 -16.303 1.00 62.43 O ATOM 478 CB TYR A 34 16.050 91.753 -14.603 1.00 13.13 C ATOM 479 CG TYR A 34 16.395 92.076 -16.043 1.00 74.24 C ATOM 480 CD1 TYR A 34 16.513 93.388 -16.483 1.00 25.42 C ATOM 481 CD2 TYR A 34 16.611 91.056 -16.960 1.00 64.13 C ATOM 482 CE1 TYR A 34 16.845 93.670 -17.794 1.00 53.30 C ATOM 483 CE2 TYR A 34 16.941 91.329 -18.272 1.00 70.13 C ATOM 484 CZ TYR A 34 17.053 92.637 -18.686 1.00 21.34 C ATOM 485 OH TYR A 34 17.388 92.912 -19.990 1.00 74.43 O ATOM 0 H TYR A 34 14.276 90.587 -12.707 1.00 44.31 H new ATOM 0 HA TYR A 34 14.405 93.110 -14.261 1.00 61.24 H new ATOM 0 HB2 TYR A 34 16.718 92.320 -13.954 1.00 13.13 H new ATOM 0 HB3 TYR A 34 16.256 90.697 -14.429 1.00 13.13 H new ATOM 0 HD1 TYR A 34 16.343 94.199 -15.791 1.00 25.42 H new ATOM 0 HD2 TYR A 34 16.519 90.029 -16.640 1.00 64.13 H new ATOM 0 HE1 TYR A 34 16.942 94.695 -18.120 1.00 53.30 H new ATOM 0 HE2 TYR A 34 17.110 90.522 -18.969 1.00 70.13 H new ATOM 0 HH TYR A 34 17.500 92.072 -20.483 1.00 74.43 H new ATOM 495 N LYS A 35 12.627 90.664 -14.433 1.00 52.32 N ATOM 496 CA LYS A 35 11.664 89.800 -15.117 1.00 32.34 C ATOM 497 C LYS A 35 12.398 88.572 -15.647 1.00 3.52 C ATOM 498 O LYS A 35 12.102 88.048 -16.721 1.00 34.43 O ATOM 499 CB LYS A 35 10.946 90.559 -16.244 1.00 4.45 C ATOM 500 CG LYS A 35 9.717 89.847 -16.790 1.00 64.01 C ATOM 501 CD LYS A 35 8.651 89.664 -15.721 1.00 53.33 C ATOM 502 CE LYS A 35 7.422 88.964 -16.275 1.00 71.43 C ATOM 503 NZ LYS A 35 6.356 88.808 -15.251 1.00 25.44 N1+ ATOM 0 H LYS A 35 12.490 90.715 -13.424 1.00 52.32 H new ATOM 0 HA LYS A 35 10.894 89.480 -14.415 1.00 32.34 H new ATOM 0 HB2 LYS A 35 10.649 91.541 -15.874 1.00 4.45 H new ATOM 0 HB3 LYS A 35 11.649 90.725 -17.060 1.00 4.45 H new ATOM 0 HG2 LYS A 35 9.304 90.419 -17.621 1.00 64.01 H new ATOM 0 HG3 LYS A 35 10.006 88.873 -17.186 1.00 64.01 H new ATOM 0 HD2 LYS A 35 9.060 89.084 -14.894 1.00 53.33 H new ATOM 0 HD3 LYS A 35 8.367 90.636 -15.319 1.00 53.33 H new ATOM 0 HE2 LYS A 35 7.032 89.532 -17.119 1.00 71.43 H new ATOM 0 HE3 LYS A 35 7.705 87.982 -16.655 1.00 71.43 H new ATOM 0 HZ1 LYS A 35 5.537 88.326 -15.673 1.00 25.44 H new ATOM 0 HZ2 LYS A 35 6.718 88.244 -14.456 1.00 25.44 H new ATOM 0 HZ3 LYS A 35 6.066 89.745 -14.906 1.00 25.44 H new ATOM 517 N ASP A 36 13.354 88.114 -14.854 1.00 74.53 N ATOM 518 CA ASP A 36 14.184 86.972 -15.207 1.00 12.22 C ATOM 519 C ASP A 36 13.454 85.660 -14.927 1.00 2.12 C ATOM 520 O ASP A 36 12.510 85.620 -14.134 1.00 1.02 O ATOM 521 CB ASP A 36 15.498 87.017 -14.422 1.00 13.10 C ATOM 522 CG ASP A 36 15.291 86.885 -12.926 1.00 53.20 C ATOM 523 OD1 ASP A 36 14.997 87.905 -12.269 1.00 0.23 O ATOM 524 OD2 ASP A 36 15.426 85.762 -12.398 1.00 61.43 O1- ATOM 0 H ASP A 36 13.577 88.524 -13.947 1.00 74.53 H new ATOM 0 HA ASP A 36 14.400 87.023 -16.274 1.00 12.22 H new ATOM 0 HB2 ASP A 36 16.150 86.214 -14.767 1.00 13.10 H new ATOM 0 HB3 ASP A 36 16.010 87.956 -14.632 1.00 13.10 H new ATOM 529 N PRO A 37 13.872 84.570 -15.592 1.00 13.20 N ATOM 530 CA PRO A 37 13.276 83.246 -15.397 1.00 63.51 C ATOM 531 C PRO A 37 13.517 82.701 -13.992 1.00 54.33 C ATOM 532 O PRO A 37 12.691 81.956 -13.462 1.00 45.11 O ATOM 533 CB PRO A 37 13.977 82.369 -16.438 1.00 21.24 C ATOM 534 CG PRO A 37 15.243 83.085 -16.758 1.00 41.34 C ATOM 535 CD PRO A 37 14.943 84.547 -16.603 1.00 70.22 C ATOM 0 HA PRO A 37 12.192 83.274 -15.511 1.00 63.51 H new ATOM 0 HB2 PRO A 37 14.176 81.372 -16.044 1.00 21.24 H new ATOM 0 HB3 PRO A 37 13.360 82.243 -17.327 1.00 21.24 H new ATOM 0 HG2 PRO A 37 16.045 82.778 -16.087 1.00 41.34 H new ATOM 0 HG3 PRO A 37 15.573 82.860 -17.772 1.00 41.34 H new ATOM 0 HD2 PRO A 37 15.820 85.104 -16.273 1.00 70.22 H new ATOM 0 HD3 PRO A 37 14.618 84.992 -17.543 1.00 70.22 H new ATOM 543 N SER A 38 14.645 83.102 -13.396 1.00 14.04 N ATOM 544 CA SER A 38 15.065 82.643 -12.069 1.00 55.00 C ATOM 545 C SER A 38 15.403 81.151 -12.074 1.00 15.51 C ATOM 546 O SER A 38 16.571 80.771 -11.958 1.00 61.15 O ATOM 547 CB SER A 38 13.991 82.955 -11.019 1.00 62.11 C ATOM 548 OG SER A 38 13.702 84.344 -10.992 1.00 2.22 O ATOM 0 H SER A 38 15.297 83.759 -13.825 1.00 14.04 H new ATOM 0 HA SER A 38 15.972 83.186 -11.803 1.00 55.00 H new ATOM 0 HB2 SER A 38 13.083 82.394 -11.243 1.00 62.11 H new ATOM 0 HB3 SER A 38 14.332 82.631 -10.036 1.00 62.11 H new ATOM 0 HG SER A 38 14.403 84.833 -11.471 1.00 2.22 H new ATOM 554 N TYR A 39 14.388 80.316 -12.217 1.00 43.44 N ATOM 555 CA TYR A 39 14.577 78.876 -12.254 1.00 20.45 C ATOM 556 C TYR A 39 14.675 78.387 -13.688 1.00 62.10 C ATOM 557 O TYR A 39 14.106 78.997 -14.598 1.00 24.30 O ATOM 558 CB TYR A 39 13.425 78.164 -11.540 1.00 32.34 C ATOM 559 CG TYR A 39 13.630 78.009 -10.052 1.00 55.01 C ATOM 560 CD1 TYR A 39 13.984 76.778 -9.514 1.00 1.41 C ATOM 561 CD2 TYR A 39 13.479 79.085 -9.186 1.00 62.40 C ATOM 562 CE1 TYR A 39 14.180 76.623 -8.157 1.00 74.42 C ATOM 563 CE2 TYR A 39 13.673 78.938 -7.824 1.00 23.44 C ATOM 564 CZ TYR A 39 14.024 77.705 -7.315 1.00 40.22 C ATOM 565 OH TYR A 39 14.224 77.551 -5.960 1.00 3.35 O ATOM 0 H TYR A 39 13.417 80.614 -12.310 1.00 43.44 H new ATOM 0 HA TYR A 39 15.509 78.644 -11.738 1.00 20.45 H new ATOM 0 HB2 TYR A 39 12.504 78.720 -11.714 1.00 32.34 H new ATOM 0 HB3 TYR A 39 13.290 77.177 -11.983 1.00 32.34 H new ATOM 0 HD1 TYR A 39 14.108 75.928 -10.169 1.00 1.41 H new ATOM 0 HD2 TYR A 39 13.206 80.052 -9.582 1.00 62.40 H new ATOM 0 HE1 TYR A 39 14.454 75.659 -7.755 1.00 74.42 H new ATOM 0 HE2 TYR A 39 13.550 79.784 -7.163 1.00 23.44 H new ATOM 0 HH TYR A 39 14.076 78.408 -5.508 1.00 3.35 H new ATOM 575 N ASN A 40 15.409 77.295 -13.872 1.00 65.22 N ATOM 576 CA ASN A 40 15.556 76.643 -15.173 1.00 3.22 C ATOM 577 C ASN A 40 16.259 77.555 -16.170 1.00 70.45 C ATOM 578 O ASN A 40 15.623 78.119 -17.064 1.00 15.21 O ATOM 579 CB ASN A 40 14.199 76.189 -15.729 1.00 75.20 C ATOM 580 CG ASN A 40 13.530 75.140 -14.859 1.00 64.02 C ATOM 581 OD1 ASN A 40 12.747 75.463 -13.961 1.00 40.50 O ATOM 582 ND2 ASN A 40 13.831 73.875 -15.113 1.00 70.04 N ATOM 0 H ASN A 40 15.922 76.833 -13.121 1.00 65.22 H new ATOM 0 HA ASN A 40 16.174 75.758 -15.023 1.00 3.22 H new ATOM 0 HB2 ASN A 40 13.541 77.053 -15.820 1.00 75.20 H new ATOM 0 HB3 ASN A 40 14.338 75.787 -16.733 1.00 75.20 H new ATOM 0 HD21 ASN A 40 13.411 73.129 -14.558 1.00 70.04 H new ATOM 0 HD22 ASN A 40 14.483 73.647 -15.864 1.00 70.04 H new ATOM 589 N ASP A 41 17.571 77.697 -15.982 1.00 1.43 N ATOM 590 CA ASP A 41 18.429 78.516 -16.843 1.00 42.41 C ATOM 591 C ASP A 41 18.082 80.000 -16.739 1.00 73.04 C ATOM 592 O ASP A 41 16.978 80.430 -17.072 1.00 20.40 O ATOM 593 CB ASP A 41 18.358 78.049 -18.296 1.00 75.34 C ATOM 594 CG ASP A 41 19.270 78.848 -19.199 1.00 44.10 C ATOM 595 OD1 ASP A 41 20.493 78.608 -19.171 1.00 61.14 O ATOM 596 OD2 ASP A 41 18.768 79.709 -19.949 1.00 31.02 O1- ATOM 0 H ASP A 41 18.075 77.243 -15.220 1.00 1.43 H new ATOM 0 HA ASP A 41 19.453 78.388 -16.491 1.00 42.41 H new ATOM 0 HB2 ASP A 41 18.629 76.995 -18.350 1.00 75.34 H new ATOM 0 HB3 ASP A 41 17.332 78.133 -18.653 1.00 75.34 H new ATOM 601 N ASP A 42 19.042 80.787 -16.279 1.00 64.11 N ATOM 602 CA ASP A 42 18.820 82.211 -16.047 1.00 22.32 C ATOM 603 C ASP A 42 18.999 83.022 -17.327 1.00 12.21 C ATOM 604 O ASP A 42 18.888 84.248 -17.315 1.00 2.23 O ATOM 605 CB ASP A 42 19.744 82.729 -14.938 1.00 70.12 C ATOM 606 CG ASP A 42 21.219 82.507 -15.222 1.00 70.01 C ATOM 607 OD1 ASP A 42 21.642 81.333 -15.323 1.00 24.15 O ATOM 608 OD2 ASP A 42 21.967 83.500 -15.302 1.00 23.10 O1- ATOM 0 H ASP A 42 19.985 80.466 -16.058 1.00 64.11 H new ATOM 0 HA ASP A 42 17.787 82.337 -15.722 1.00 22.32 H new ATOM 0 HB2 ASP A 42 19.566 83.795 -14.797 1.00 70.12 H new ATOM 0 HB3 ASP A 42 19.485 82.236 -14.001 1.00 70.12 H new ATOM 613 N PHE A 43 19.238 82.334 -18.436 1.00 34.33 N ATOM 614 CA PHE A 43 19.352 82.986 -19.734 1.00 42.52 C ATOM 615 C PHE A 43 18.046 82.857 -20.511 1.00 55.15 C ATOM 616 O PHE A 43 17.961 83.265 -21.674 1.00 42.21 O ATOM 617 CB PHE A 43 20.495 82.377 -20.548 1.00 45.40 C ATOM 618 CG PHE A 43 21.857 82.629 -19.972 1.00 60.21 C ATOM 619 CD1 PHE A 43 22.468 81.685 -19.165 1.00 61.42 C ATOM 620 CD2 PHE A 43 22.529 83.810 -20.244 1.00 74.23 C ATOM 621 CE1 PHE A 43 23.724 81.915 -18.638 1.00 3.13 C ATOM 622 CE2 PHE A 43 23.785 84.047 -19.720 1.00 34.35 C ATOM 623 CZ PHE A 43 24.383 83.097 -18.916 1.00 75.22 C ATOM 0 H PHE A 43 19.357 81.321 -18.462 1.00 34.33 H new ATOM 0 HA PHE A 43 19.565 84.041 -19.563 1.00 42.52 H new ATOM 0 HB2 PHE A 43 20.338 81.301 -20.626 1.00 45.40 H new ATOM 0 HB3 PHE A 43 20.460 82.779 -21.561 1.00 45.40 H new ATOM 0 HD1 PHE A 43 21.958 80.759 -18.945 1.00 61.42 H new ATOM 0 HD2 PHE A 43 22.065 84.555 -20.874 1.00 74.23 H new ATOM 0 HE1 PHE A 43 24.191 81.171 -18.009 1.00 3.13 H new ATOM 0 HE2 PHE A 43 24.297 84.972 -19.938 1.00 34.35 H new ATOM 0 HZ PHE A 43 25.365 83.278 -18.505 1.00 75.22 H new ATOM 633 N GLY A 44 17.022 82.313 -19.857 1.00 3.11 N ATOM 634 CA GLY A 44 15.746 82.084 -20.513 1.00 42.15 C ATOM 635 C GLY A 44 14.916 83.350 -20.658 1.00 3.45 C ATOM 636 O GLY A 44 13.729 83.360 -20.344 1.00 74.52 O ATOM 0 H GLY A 44 17.055 82.025 -18.879 1.00 3.11 H new ATOM 0 HA2 GLY A 44 15.923 81.657 -21.500 1.00 42.15 H new ATOM 0 HA3 GLY A 44 15.179 81.347 -19.944 1.00 42.15 H new ATOM 640 N ILE A 45 15.549 84.414 -21.128 1.00 51.24 N ATOM 641 CA ILE A 45 14.876 85.684 -21.374 1.00 71.42 C ATOM 642 C ILE A 45 14.844 85.941 -22.880 1.00 20.41 C ATOM 643 O ILE A 45 14.449 87.011 -23.345 1.00 25.51 O ATOM 644 CB ILE A 45 15.618 86.850 -20.667 1.00 34.42 C ATOM 645 CG1 ILE A 45 16.041 86.441 -19.254 1.00 11.31 C ATOM 646 CG2 ILE A 45 14.739 88.093 -20.607 1.00 54.24 C ATOM 647 CD1 ILE A 45 16.875 87.484 -18.538 1.00 75.24 C ATOM 0 H ILE A 45 16.544 84.423 -21.350 1.00 51.24 H new ATOM 0 HA ILE A 45 13.863 85.631 -20.975 1.00 71.42 H new ATOM 0 HB ILE A 45 16.510 87.082 -21.248 1.00 34.42 H new ATOM 0 HG12 ILE A 45 15.148 86.235 -18.663 1.00 11.31 H new ATOM 0 HG13 ILE A 45 16.608 85.512 -19.309 1.00 11.31 H new ATOM 0 HG21 ILE A 45 15.279 88.897 -20.107 1.00 54.24 H new ATOM 0 HG22 ILE A 45 14.479 88.404 -21.619 1.00 54.24 H new ATOM 0 HG23 ILE A 45 13.828 87.868 -20.052 1.00 54.24 H new ATOM 0 HD11 ILE A 45 17.136 87.122 -17.544 1.00 75.24 H new ATOM 0 HD12 ILE A 45 17.786 87.674 -19.105 1.00 75.24 H new ATOM 0 HD13 ILE A 45 16.304 88.408 -18.449 1.00 75.24 H new ATOM 659 N GLU A 46 15.256 84.918 -23.630 1.00 65.21 N ATOM 660 CA GLU A 46 15.469 85.024 -25.070 1.00 41.54 C ATOM 661 C GLU A 46 16.414 86.185 -25.367 1.00 5.12 C ATOM 662 O GLU A 46 16.037 87.193 -25.962 1.00 43.23 O ATOM 663 CB GLU A 46 14.148 85.172 -25.835 1.00 55.55 C ATOM 664 CG GLU A 46 14.315 85.024 -27.340 1.00 14.53 C ATOM 665 CD GLU A 46 13.006 85.106 -28.097 1.00 0.14 C ATOM 666 OE1 GLU A 46 12.389 84.046 -28.343 1.00 65.32 O ATOM 667 OE2 GLU A 46 12.601 86.225 -28.466 1.00 5.55 O1- ATOM 0 H GLU A 46 15.451 83.991 -23.253 1.00 65.21 H new ATOM 0 HA GLU A 46 15.927 84.098 -25.416 1.00 41.54 H new ATOM 0 HB2 GLU A 46 13.441 84.423 -25.478 1.00 55.55 H new ATOM 0 HB3 GLU A 46 13.715 86.148 -25.617 1.00 55.55 H new ATOM 0 HG2 GLU A 46 14.986 85.802 -27.703 1.00 14.53 H new ATOM 0 HG3 GLU A 46 14.791 84.067 -27.554 1.00 14.53 H new ATOM 674 N THR A 47 17.641 86.038 -24.899 1.00 53.34 N ATOM 675 CA THR A 47 18.670 87.039 -25.094 1.00 11.21 C ATOM 676 C THR A 47 19.992 86.350 -25.439 1.00 2.33 C ATOM 677 O THR A 47 20.780 85.987 -24.564 1.00 31.14 O ATOM 678 CB THR A 47 18.810 87.961 -23.858 1.00 14.13 C ATOM 679 OG1 THR A 47 19.901 88.871 -24.029 1.00 60.32 O ATOM 680 CG2 THR A 47 18.996 87.163 -22.572 1.00 31.14 C ATOM 0 H THR A 47 17.950 85.220 -24.373 1.00 53.34 H new ATOM 0 HA THR A 47 18.383 87.681 -25.927 1.00 11.21 H new ATOM 0 HB THR A 47 17.882 88.526 -23.771 1.00 14.13 H new ATOM 0 HG1 THR A 47 19.974 89.447 -23.239 1.00 60.32 H new ATOM 0 HG21 THR A 47 19.090 87.848 -21.729 1.00 31.14 H new ATOM 0 HG22 THR A 47 18.133 86.515 -22.418 1.00 31.14 H new ATOM 0 HG23 THR A 47 19.898 86.555 -22.648 1.00 31.14 H new ATOM 688 N PRO A 48 20.207 86.085 -26.734 1.00 63.35 N ATOM 689 CA PRO A 48 21.352 85.306 -27.199 1.00 21.13 C ATOM 690 C PRO A 48 22.682 86.050 -27.067 1.00 23.22 C ATOM 691 O PRO A 48 23.157 86.678 -28.016 1.00 30.10 O ATOM 692 CB PRO A 48 21.017 85.037 -28.669 1.00 72.10 C ATOM 693 CG PRO A 48 20.139 86.168 -29.071 1.00 2.42 C ATOM 694 CD PRO A 48 19.350 86.533 -27.847 1.00 3.12 C ATOM 0 HA PRO A 48 21.494 84.403 -26.605 1.00 21.13 H new ATOM 0 HB2 PRO A 48 21.919 85.000 -29.280 1.00 72.10 H new ATOM 0 HB3 PRO A 48 20.510 84.080 -28.791 1.00 72.10 H new ATOM 0 HG2 PRO A 48 20.729 87.015 -29.422 1.00 2.42 H new ATOM 0 HG3 PRO A 48 19.479 85.878 -29.889 1.00 2.42 H new ATOM 0 HD2 PRO A 48 19.158 87.605 -27.799 1.00 3.12 H new ATOM 0 HD3 PRO A 48 18.381 86.035 -27.832 1.00 3.12 H new ATOM 702 N SER A 49 23.267 85.991 -25.877 1.00 1.52 N ATOM 703 CA SER A 49 24.590 86.550 -25.647 1.00 71.45 C ATOM 704 C SER A 49 25.657 85.475 -25.826 1.00 5.40 C ATOM 705 O SER A 49 26.432 85.519 -26.778 1.00 55.33 O ATOM 706 CB SER A 49 24.686 87.157 -24.245 1.00 4.01 C ATOM 707 OG SER A 49 23.660 88.108 -24.027 1.00 52.25 O ATOM 0 H SER A 49 22.843 85.560 -25.055 1.00 1.52 H new ATOM 0 HA SER A 49 24.758 87.341 -26.378 1.00 71.45 H new ATOM 0 HB2 SER A 49 24.617 86.366 -23.498 1.00 4.01 H new ATOM 0 HB3 SER A 49 25.659 87.632 -24.117 1.00 4.01 H new ATOM 0 HG SER A 49 23.744 88.479 -23.124 1.00 52.25 H new ATOM 713 N ALA A 50 25.675 84.503 -24.918 1.00 4.34 N ATOM 714 CA ALA A 50 26.644 83.413 -24.982 1.00 71.23 C ATOM 715 C ALA A 50 25.975 82.109 -25.404 1.00 52.43 C ATOM 716 O ALA A 50 26.633 81.085 -25.587 1.00 63.35 O ATOM 717 CB ALA A 50 27.326 83.242 -23.637 1.00 52.42 C ATOM 0 H ALA A 50 25.030 84.448 -24.130 1.00 4.34 H new ATOM 0 HA ALA A 50 27.393 83.667 -25.732 1.00 71.23 H new ATOM 0 HB1 ALA A 50 28.047 82.426 -23.696 1.00 52.42 H new ATOM 0 HB2 ALA A 50 27.842 84.164 -23.371 1.00 52.42 H new ATOM 0 HB3 ALA A 50 26.579 83.012 -22.877 1.00 52.42 H new ATOM 723 N LEU A 51 24.661 82.155 -25.556 1.00 14.24 N ATOM 724 CA LEU A 51 23.891 80.975 -25.934 1.00 65.24 C ATOM 725 C LEU A 51 23.404 81.105 -27.370 1.00 54.11 C ATOM 726 O LEU A 51 22.638 80.274 -27.857 1.00 73.42 O ATOM 727 CB LEU A 51 22.691 80.772 -24.995 1.00 34.13 C ATOM 728 CG LEU A 51 21.653 81.903 -24.989 1.00 14.14 C ATOM 729 CD1 LEU A 51 20.273 81.350 -24.674 1.00 42.24 C ATOM 730 CD2 LEU A 51 22.022 82.974 -23.973 1.00 32.32 C ATOM 0 H LEU A 51 24.102 82.998 -25.424 1.00 14.24 H new ATOM 0 HA LEU A 51 24.544 80.106 -25.850 1.00 65.24 H new ATOM 0 HB2 LEU A 51 22.189 79.845 -25.271 1.00 34.13 H new ATOM 0 HB3 LEU A 51 23.065 80.642 -23.980 1.00 34.13 H new ATOM 0 HG LEU A 51 21.641 82.355 -25.981 1.00 14.14 H new ATOM 0 HD11 LEU A 51 19.547 82.163 -24.673 1.00 42.24 H new ATOM 0 HD12 LEU A 51 19.994 80.615 -25.429 1.00 42.24 H new ATOM 0 HD13 LEU A 51 20.287 80.875 -23.693 1.00 42.24 H new ATOM 0 HD21 LEU A 51 21.271 83.764 -23.988 1.00 32.32 H new ATOM 0 HD22 LEU A 51 22.064 82.532 -22.977 1.00 32.32 H new ATOM 0 HD23 LEU A 51 22.996 83.394 -24.225 1.00 32.32 H new ATOM 742 N ASP A 52 23.884 82.139 -28.049 1.00 2.23 N ATOM 743 CA ASP A 52 23.418 82.469 -29.389 1.00 12.25 C ATOM 744 C ASP A 52 23.855 81.417 -30.400 1.00 34.31 C ATOM 745 O ASP A 52 23.026 80.867 -31.118 1.00 33.15 O ATOM 746 CB ASP A 52 23.910 83.861 -29.806 1.00 5.20 C ATOM 747 CG ASP A 52 25.420 83.973 -29.904 1.00 62.52 C ATOM 748 OD1 ASP A 52 26.121 83.451 -29.012 1.00 12.41 O ATOM 749 OD2 ASP A 52 25.905 84.595 -30.872 1.00 63.02 O1- ATOM 0 H ASP A 52 24.602 82.768 -27.690 1.00 2.23 H new ATOM 0 HA ASP A 52 22.328 82.481 -29.371 1.00 12.25 H new ATOM 0 HB2 ASP A 52 23.473 84.117 -30.771 1.00 5.20 H new ATOM 0 HB3 ASP A 52 23.546 84.595 -29.087 1.00 5.20 H new ATOM 754 N ASN A 53 25.146 81.119 -30.434 1.00 61.25 N ATOM 755 CA ASN A 53 25.669 80.111 -31.351 1.00 42.12 C ATOM 756 C ASN A 53 25.135 78.732 -30.986 1.00 63.01 C ATOM 757 O ASN A 53 24.954 77.873 -31.850 1.00 23.25 O ATOM 758 CB ASN A 53 27.206 80.095 -31.350 1.00 44.53 C ATOM 759 CG ASN A 53 27.805 81.389 -31.868 1.00 73.01 C ATOM 760 OD1 ASN A 53 27.956 81.580 -33.075 1.00 72.42 O ATOM 761 ND2 ASN A 53 28.177 82.278 -30.962 1.00 31.23 N ATOM 0 H ASN A 53 25.850 81.558 -29.840 1.00 61.25 H new ATOM 0 HA ASN A 53 25.333 80.371 -32.355 1.00 42.12 H new ATOM 0 HB2 ASN A 53 27.563 79.915 -30.336 1.00 44.53 H new ATOM 0 HB3 ASN A 53 27.557 79.265 -31.964 1.00 44.53 H new ATOM 0 HD21 ASN A 53 28.605 83.156 -31.255 1.00 31.23 H new ATOM 0 HD22 ASN A 53 28.036 82.085 -29.970 1.00 31.23 H new ATOM 768 N PHE A 54 24.855 78.544 -29.703 1.00 22.14 N ATOM 769 CA PHE A 54 24.360 77.271 -29.196 1.00 43.23 C ATOM 770 C PHE A 54 22.965 76.970 -29.746 1.00 0.30 C ATOM 771 O PHE A 54 22.780 76.006 -30.488 1.00 51.31 O ATOM 772 CB PHE A 54 24.339 77.290 -27.662 1.00 64.13 C ATOM 773 CG PHE A 54 23.829 76.016 -27.046 1.00 32.43 C ATOM 774 CD1 PHE A 54 22.626 75.997 -26.357 1.00 20.25 C ATOM 775 CD2 PHE A 54 24.550 74.840 -27.158 1.00 52.44 C ATOM 776 CE1 PHE A 54 22.156 74.828 -25.790 1.00 74.25 C ATOM 777 CE2 PHE A 54 24.084 73.667 -26.594 1.00 41.13 C ATOM 778 CZ PHE A 54 22.885 73.662 -25.909 1.00 1.54 C ATOM 0 H PHE A 54 24.964 79.264 -28.989 1.00 22.14 H new ATOM 0 HA PHE A 54 25.032 76.481 -29.531 1.00 43.23 H new ATOM 0 HB2 PHE A 54 25.348 77.481 -27.296 1.00 64.13 H new ATOM 0 HB3 PHE A 54 23.716 78.119 -27.327 1.00 64.13 H new ATOM 0 HD1 PHE A 54 22.050 76.906 -26.262 1.00 20.25 H new ATOM 0 HD2 PHE A 54 25.488 74.839 -27.693 1.00 52.44 H new ATOM 0 HE1 PHE A 54 21.218 74.827 -25.254 1.00 74.25 H new ATOM 0 HE2 PHE A 54 24.657 72.756 -26.689 1.00 41.13 H new ATOM 0 HZ PHE A 54 22.518 72.747 -25.467 1.00 1.54 H new ATOM 788 N THR A 55 21.995 77.815 -29.410 1.00 75.41 N ATOM 789 CA THR A 55 20.612 77.589 -29.823 1.00 62.12 C ATOM 790 C THR A 55 20.466 77.720 -31.344 1.00 21.25 C ATOM 791 O THR A 55 19.536 77.175 -31.942 1.00 1.24 O ATOM 792 CB THR A 55 19.645 78.563 -29.107 1.00 4.21 C ATOM 793 OG1 THR A 55 18.281 78.204 -29.375 1.00 21.43 O ATOM 794 CG2 THR A 55 19.886 80.001 -29.546 1.00 4.31 C ATOM 0 H THR A 55 22.139 78.659 -28.856 1.00 75.41 H new ATOM 0 HA THR A 55 20.347 76.572 -29.535 1.00 62.12 H new ATOM 0 HB THR A 55 19.836 78.489 -28.036 1.00 4.21 H new ATOM 0 HG1 THR A 55 17.682 78.828 -28.914 1.00 21.43 H new ATOM 0 HG21 THR A 55 19.192 80.661 -29.026 1.00 4.31 H new ATOM 0 HG22 THR A 55 20.910 80.288 -29.305 1.00 4.31 H new ATOM 0 HG23 THR A 55 19.729 80.084 -30.621 1.00 4.31 H new ATOM 802 N GLN A 56 21.413 78.417 -31.963 1.00 32.54 N ATOM 803 CA GLN A 56 21.394 78.630 -33.401 1.00 40.22 C ATOM 804 C GLN A 56 21.661 77.317 -34.120 1.00 42.31 C ATOM 805 O GLN A 56 20.997 76.979 -35.101 1.00 33.50 O ATOM 806 CB GLN A 56 22.449 79.660 -33.803 1.00 24.31 C ATOM 807 CG GLN A 56 22.192 80.297 -35.155 1.00 3.12 C ATOM 808 CD GLN A 56 21.000 81.236 -35.126 1.00 23.51 C ATOM 809 OE1 GLN A 56 19.866 80.830 -35.369 1.00 22.43 O ATOM 810 NE2 GLN A 56 21.255 82.502 -34.835 1.00 51.20 N ATOM 0 H GLN A 56 22.206 78.845 -31.486 1.00 32.54 H new ATOM 0 HA GLN A 56 20.411 79.006 -33.684 1.00 40.22 H new ATOM 0 HB2 GLN A 56 22.489 80.442 -33.044 1.00 24.31 H new ATOM 0 HB3 GLN A 56 23.427 79.179 -33.817 1.00 24.31 H new ATOM 0 HG2 GLN A 56 23.079 80.847 -35.471 1.00 3.12 H new ATOM 0 HG3 GLN A 56 22.020 79.517 -35.896 1.00 3.12 H new ATOM 0 HE21 GLN A 56 22.211 82.798 -34.639 1.00 51.20 H new ATOM 0 HE22 GLN A 56 20.495 83.182 -34.806 1.00 51.20 H new ATOM 819 N ALA A 57 22.637 76.574 -33.609 1.00 43.12 N ATOM 820 CA ALA A 57 22.985 75.273 -34.163 1.00 74.22 C ATOM 821 C ALA A 57 21.846 74.288 -33.950 1.00 13.44 C ATOM 822 O ALA A 57 21.606 73.411 -34.780 1.00 44.41 O ATOM 823 CB ALA A 57 24.268 74.750 -33.531 1.00 32.32 C ATOM 0 H ALA A 57 23.203 76.854 -32.808 1.00 43.12 H new ATOM 0 HA ALA A 57 23.152 75.385 -35.234 1.00 74.22 H new ATOM 0 HB1 ALA A 57 24.513 73.777 -33.957 1.00 32.32 H new ATOM 0 HB2 ALA A 57 25.082 75.448 -33.729 1.00 32.32 H new ATOM 0 HB3 ALA A 57 24.129 74.650 -32.455 1.00 32.32 H new ATOM 829 N ILE A 58 21.131 74.458 -32.843 1.00 52.41 N ATOM 830 CA ILE A 58 19.993 73.608 -32.527 1.00 43.42 C ATOM 831 C ILE A 58 18.895 73.768 -33.574 1.00 42.32 C ATOM 832 O ILE A 58 18.278 72.797 -33.993 1.00 2.22 O ATOM 833 CB ILE A 58 19.414 73.923 -31.134 1.00 4.31 C ATOM 834 CG1 ILE A 58 20.523 73.882 -30.080 1.00 33.32 C ATOM 835 CG2 ILE A 58 18.300 72.938 -30.791 1.00 22.11 C ATOM 836 CD1 ILE A 58 20.026 74.028 -28.658 1.00 75.03 C ATOM 0 H ILE A 58 21.322 75.180 -32.148 1.00 52.41 H new ATOM 0 HA ILE A 58 20.354 72.579 -32.528 1.00 43.42 H new ATOM 0 HB ILE A 58 18.990 74.927 -31.145 1.00 4.31 H new ATOM 0 HG12 ILE A 58 21.062 72.939 -30.171 1.00 33.32 H new ATOM 0 HG13 ILE A 58 21.237 74.678 -30.288 1.00 33.32 H new ATOM 0 HG21 ILE A 58 17.899 73.171 -29.805 1.00 22.11 H new ATOM 0 HG22 ILE A 58 17.505 73.015 -31.533 1.00 22.11 H new ATOM 0 HG23 ILE A 58 18.699 71.924 -30.790 1.00 22.11 H new ATOM 0 HD11 ILE A 58 20.872 73.989 -27.971 1.00 75.03 H new ATOM 0 HD12 ILE A 58 19.513 74.984 -28.548 1.00 75.03 H new ATOM 0 HD13 ILE A 58 19.335 73.217 -28.429 1.00 75.03 H new ATOM 848 N GLN A 59 18.680 75.000 -34.015 1.00 20.32 N ATOM 849 CA GLN A 59 17.677 75.284 -35.037 1.00 43.14 C ATOM 850 C GLN A 59 18.042 74.620 -36.364 1.00 30.01 C ATOM 851 O GLN A 59 17.170 74.330 -37.183 1.00 22.32 O ATOM 852 CB GLN A 59 17.535 76.794 -35.230 1.00 0.24 C ATOM 853 CG GLN A 59 17.031 77.528 -33.998 1.00 33.03 C ATOM 854 CD GLN A 59 16.990 79.029 -34.197 1.00 32.54 C ATOM 855 OE1 GLN A 59 16.799 79.512 -35.312 1.00 24.13 O ATOM 856 NE2 GLN A 59 17.171 79.774 -33.121 1.00 51.23 N ATOM 0 H GLN A 59 19.186 75.821 -33.682 1.00 20.32 H new ATOM 0 HA GLN A 59 16.725 74.874 -34.700 1.00 43.14 H new ATOM 0 HB2 GLN A 59 18.503 77.206 -35.516 1.00 0.24 H new ATOM 0 HB3 GLN A 59 16.851 76.982 -36.058 1.00 0.24 H new ATOM 0 HG2 GLN A 59 16.032 77.170 -33.748 1.00 33.03 H new ATOM 0 HG3 GLN A 59 17.675 77.294 -33.150 1.00 33.03 H new ATOM 0 HE21 GLN A 59 17.326 79.332 -32.215 1.00 51.23 H new ATOM 0 HE22 GLN A 59 17.155 80.791 -33.196 1.00 51.23 H new ATOM 865 N SER A 60 19.329 74.371 -36.562 1.00 51.04 N ATOM 866 CA SER A 60 19.814 73.780 -37.799 1.00 11.41 C ATOM 867 C SER A 60 19.821 72.255 -37.704 1.00 54.31 C ATOM 868 O SER A 60 19.467 71.563 -38.660 1.00 71.15 O ATOM 869 CB SER A 60 21.220 74.296 -38.106 1.00 73.34 C ATOM 870 OG SER A 60 21.639 73.920 -39.405 1.00 3.51 O ATOM 0 H SER A 60 20.058 74.571 -35.877 1.00 51.04 H new ATOM 0 HA SER A 60 19.143 74.069 -38.608 1.00 11.41 H new ATOM 0 HB2 SER A 60 21.237 75.382 -38.017 1.00 73.34 H new ATOM 0 HB3 SER A 60 21.921 73.905 -37.369 1.00 73.34 H new ATOM 0 HG SER A 60 22.541 74.266 -39.571 1.00 3.51 H new ATOM 876 N GLN A 61 20.194 71.733 -36.536 1.00 30.10 N ATOM 877 CA GLN A 61 20.290 70.285 -36.340 1.00 24.42 C ATOM 878 C GLN A 61 18.909 69.633 -36.410 1.00 14.32 C ATOM 879 O GLN A 61 18.791 68.416 -36.533 1.00 1.12 O ATOM 880 CB GLN A 61 20.980 69.958 -35.007 1.00 64.21 C ATOM 881 CG GLN A 61 20.189 70.383 -33.780 1.00 32.32 C ATOM 882 CD GLN A 61 20.934 70.158 -32.474 1.00 64.01 C ATOM 883 OE1 GLN A 61 20.322 69.904 -31.438 1.00 52.54 O ATOM 884 NE2 GLN A 61 22.255 70.262 -32.504 1.00 61.52 N ATOM 0 H GLN A 61 20.434 72.287 -35.714 1.00 30.10 H new ATOM 0 HA GLN A 61 20.899 69.876 -37.146 1.00 24.42 H new ATOM 0 HB2 GLN A 61 21.160 68.884 -34.957 1.00 64.21 H new ATOM 0 HB3 GLN A 61 21.955 70.446 -34.985 1.00 64.21 H new ATOM 0 HG2 GLN A 61 19.936 71.440 -33.868 1.00 32.32 H new ATOM 0 HG3 GLN A 61 19.249 69.831 -33.753 1.00 32.32 H new ATOM 0 HE21 GLN A 61 22.730 70.474 -33.381 1.00 61.52 H new ATOM 0 HE22 GLN A 61 22.796 70.130 -31.650 1.00 61.52 H new ATOM 893 N ILE A 62 17.866 70.457 -36.355 1.00 25.21 N ATOM 894 CA ILE A 62 16.500 69.972 -36.515 1.00 60.23 C ATOM 895 C ILE A 62 16.331 69.371 -37.907 1.00 4.22 C ATOM 896 O ILE A 62 15.612 68.388 -38.095 1.00 73.53 O ATOM 897 CB ILE A 62 15.462 71.105 -36.314 1.00 31.41 C ATOM 898 CG1 ILE A 62 15.593 71.699 -34.913 1.00 75.12 C ATOM 899 CG2 ILE A 62 14.043 70.593 -36.541 1.00 11.33 C ATOM 900 CD1 ILE A 62 14.677 72.880 -34.673 1.00 54.33 C ATOM 0 H ILE A 62 17.941 71.462 -36.201 1.00 25.21 H new ATOM 0 HA ILE A 62 16.323 69.213 -35.753 1.00 60.23 H new ATOM 0 HB ILE A 62 15.663 71.885 -37.049 1.00 31.41 H new ATOM 0 HG12 ILE A 62 15.376 70.925 -34.177 1.00 75.12 H new ATOM 0 HG13 ILE A 62 16.625 72.011 -34.754 1.00 75.12 H new ATOM 0 HG21 ILE A 62 13.334 71.408 -36.394 1.00 11.33 H new ATOM 0 HG22 ILE A 62 13.952 70.212 -37.558 1.00 11.33 H new ATOM 0 HG23 ILE A 62 13.828 69.792 -35.833 1.00 11.33 H new ATOM 0 HD11 ILE A 62 14.822 73.253 -33.659 1.00 54.33 H new ATOM 0 HD12 ILE A 62 14.908 73.671 -35.387 1.00 54.33 H new ATOM 0 HD13 ILE A 62 13.640 72.568 -34.800 1.00 54.33 H new ATOM 912 N LEU A 63 17.038 69.956 -38.865 1.00 64.35 N ATOM 913 CA LEU A 63 16.977 69.516 -40.249 1.00 53.53 C ATOM 914 C LEU A 63 17.602 68.138 -40.400 1.00 34.31 C ATOM 915 O LEU A 63 17.210 67.367 -41.271 1.00 74.53 O ATOM 916 CB LEU A 63 17.684 70.516 -41.175 1.00 24.15 C ATOM 917 CG LEU A 63 16.886 71.777 -41.534 1.00 14.34 C ATOM 918 CD1 LEU A 63 16.695 72.674 -40.321 1.00 52.54 C ATOM 919 CD2 LEU A 63 17.580 72.540 -42.653 1.00 61.01 C ATOM 0 H LEU A 63 17.666 70.744 -38.704 1.00 64.35 H new ATOM 0 HA LEU A 63 15.927 69.461 -40.536 1.00 53.53 H new ATOM 0 HB2 LEU A 63 18.617 70.822 -40.702 1.00 24.15 H new ATOM 0 HB3 LEU A 63 17.949 70.002 -42.099 1.00 24.15 H new ATOM 0 HG LEU A 63 15.900 71.464 -41.878 1.00 14.34 H new ATOM 0 HD11 LEU A 63 16.126 73.558 -40.608 1.00 52.54 H new ATOM 0 HD12 LEU A 63 16.153 72.130 -39.548 1.00 52.54 H new ATOM 0 HD13 LEU A 63 17.669 72.978 -39.936 1.00 52.54 H new ATOM 0 HD21 LEU A 63 17.003 73.432 -42.897 1.00 61.01 H new ATOM 0 HD22 LEU A 63 18.579 72.831 -42.329 1.00 61.01 H new ATOM 0 HD23 LEU A 63 17.655 71.904 -43.535 1.00 61.01 H new ATOM 931 N GLY A 64 18.563 67.831 -39.538 1.00 54.14 N ATOM 932 CA GLY A 64 19.202 66.533 -39.569 1.00 43.53 C ATOM 933 C GLY A 64 18.214 65.423 -39.275 1.00 42.50 C ATOM 934 O GLY A 64 18.154 64.425 -39.994 1.00 45.41 O ATOM 0 H GLY A 64 18.911 68.462 -38.816 1.00 54.14 H new ATOM 0 HA2 GLY A 64 19.653 66.371 -40.548 1.00 43.53 H new ATOM 0 HA3 GLY A 64 20.010 66.506 -38.838 1.00 43.53 H new ATOM 938 N GLY A 65 17.424 65.609 -38.222 1.00 25.24 N ATOM 939 CA GLY A 65 16.400 64.639 -37.879 1.00 5.50 C ATOM 940 C GLY A 65 15.237 64.685 -38.849 1.00 33.53 C ATOM 941 O GLY A 65 14.641 63.655 -39.172 1.00 11.34 O ATOM 0 H GLY A 65 17.475 66.415 -37.599 1.00 25.24 H new ATOM 0 HA2 GLY A 65 16.833 63.639 -37.877 1.00 5.50 H new ATOM 0 HA3 GLY A 65 16.039 64.833 -36.869 1.00 5.50 H new ATOM 945 N LEU A 66 14.923 65.887 -39.325 1.00 53.33 N ATOM 946 CA LEU A 66 13.858 66.079 -40.300 1.00 72.23 C ATOM 947 C LEU A 66 14.171 65.309 -41.580 1.00 34.12 C ATOM 948 O LEU A 66 13.349 64.538 -42.073 1.00 33.03 O ATOM 949 CB LEU A 66 13.682 67.568 -40.609 1.00 31.31 C ATOM 950 CG LEU A 66 12.512 67.912 -41.531 1.00 64.21 C ATOM 951 CD1 LEU A 66 11.190 67.531 -40.884 1.00 22.03 C ATOM 952 CD2 LEU A 66 12.529 69.390 -41.882 1.00 65.03 C ATOM 0 H LEU A 66 15.396 66.747 -39.048 1.00 53.33 H new ATOM 0 HA LEU A 66 12.927 65.698 -39.879 1.00 72.23 H new ATOM 0 HB2 LEU A 66 13.552 68.104 -39.669 1.00 31.31 H new ATOM 0 HB3 LEU A 66 14.601 67.939 -41.062 1.00 31.31 H new ATOM 0 HG LEU A 66 12.619 67.338 -42.451 1.00 64.21 H new ATOM 0 HD11 LEU A 66 10.370 67.784 -41.556 1.00 22.03 H new ATOM 0 HD12 LEU A 66 11.178 66.460 -40.684 1.00 22.03 H new ATOM 0 HD13 LEU A 66 11.073 68.076 -39.947 1.00 22.03 H new ATOM 0 HD21 LEU A 66 11.689 69.618 -42.539 1.00 65.03 H new ATOM 0 HD22 LEU A 66 12.447 69.981 -40.970 1.00 65.03 H new ATOM 0 HD23 LEU A 66 13.463 69.633 -42.389 1.00 65.03 H new ATOM 964 N LEU A 67 15.387 65.485 -42.087 1.00 53.21 N ATOM 965 CA LEU A 67 15.833 64.792 -43.292 1.00 64.45 C ATOM 966 C LEU A 67 16.254 63.359 -42.965 1.00 60.43 C ATOM 967 O LEU A 67 17.158 62.799 -43.593 1.00 44.24 O ATOM 968 CB LEU A 67 16.991 65.555 -43.942 1.00 51.43 C ATOM 969 CG LEU A 67 16.644 66.962 -44.434 1.00 3.00 C ATOM 970 CD1 LEU A 67 17.874 67.648 -45.000 1.00 70.32 C ATOM 971 CD2 LEU A 67 15.544 66.906 -45.483 1.00 22.21 C ATOM 0 H LEU A 67 16.086 66.106 -41.679 1.00 53.21 H new ATOM 0 HA LEU A 67 15.002 64.751 -43.996 1.00 64.45 H new ATOM 0 HB2 LEU A 67 17.807 65.629 -43.223 1.00 51.43 H new ATOM 0 HB3 LEU A 67 17.362 64.973 -44.786 1.00 51.43 H new ATOM 0 HG LEU A 67 16.284 67.541 -43.583 1.00 3.00 H new ATOM 0 HD11 LEU A 67 17.607 68.647 -45.345 1.00 70.32 H new ATOM 0 HD12 LEU A 67 18.637 67.723 -44.226 1.00 70.32 H new ATOM 0 HD13 LEU A 67 18.262 67.067 -45.837 1.00 70.32 H new ATOM 0 HD21 LEU A 67 15.311 67.916 -45.820 1.00 22.21 H new ATOM 0 HD22 LEU A 67 15.880 66.309 -46.331 1.00 22.21 H new ATOM 0 HD23 LEU A 67 14.652 66.453 -45.051 1.00 22.21 H new ATOM 983 N SER A 68 15.588 62.782 -41.976 1.00 40.32 N ATOM 984 CA SER A 68 15.768 61.389 -41.612 1.00 11.31 C ATOM 985 C SER A 68 14.405 60.741 -41.376 1.00 75.02 C ATOM 986 O SER A 68 14.090 59.701 -41.953 1.00 75.11 O ATOM 987 CB SER A 68 16.639 61.268 -40.359 1.00 0.14 C ATOM 988 OG SER A 68 17.932 61.815 -40.574 1.00 4.11 O ATOM 0 H SER A 68 14.903 63.273 -41.401 1.00 40.32 H new ATOM 0 HA SER A 68 16.274 60.873 -42.428 1.00 11.31 H new ATOM 0 HB2 SER A 68 16.158 61.783 -39.528 1.00 0.14 H new ATOM 0 HB3 SER A 68 16.728 60.219 -40.075 1.00 0.14 H new ATOM 0 HG SER A 68 17.993 62.691 -40.139 1.00 4.11 H new ATOM 994 N ASN A 69 13.587 61.387 -40.549 1.00 22.22 N ATOM 995 CA ASN A 69 12.267 60.863 -40.199 1.00 3.21 C ATOM 996 C ASN A 69 11.307 60.918 -41.385 1.00 33.23 C ATOM 997 O ASN A 69 10.383 60.115 -41.483 1.00 41.32 O ATOM 998 CB ASN A 69 11.686 61.655 -39.019 1.00 53.44 C ATOM 999 CG ASN A 69 10.286 61.209 -38.629 1.00 25.14 C ATOM 1000 OD1 ASN A 69 9.290 61.740 -39.125 1.00 41.35 O ATOM 1001 ND2 ASN A 69 10.199 60.240 -37.733 1.00 2.13 N ATOM 0 H ASN A 69 13.815 62.277 -40.107 1.00 22.22 H new ATOM 0 HA ASN A 69 12.387 59.818 -39.915 1.00 3.21 H new ATOM 0 HB2 ASN A 69 12.347 61.549 -38.159 1.00 53.44 H new ATOM 0 HB3 ASN A 69 11.664 62.714 -39.276 1.00 53.44 H new ATOM 0 HD21 ASN A 69 9.284 59.907 -37.429 1.00 2.13 H new ATOM 0 HD22 ASN A 69 11.047 59.826 -37.346 1.00 2.13 H new ATOM 1008 N ILE A 70 11.543 61.849 -42.300 1.00 71.41 N ATOM 1009 CA ILE A 70 10.667 62.015 -43.454 1.00 54.25 C ATOM 1010 C ILE A 70 11.033 61.017 -44.555 1.00 15.54 C ATOM 1011 O ILE A 70 10.221 60.708 -45.430 1.00 23.53 O ATOM 1012 CB ILE A 70 10.738 63.463 -44.005 1.00 3.10 C ATOM 1013 CG1 ILE A 70 10.354 64.470 -42.912 1.00 23.53 C ATOM 1014 CG2 ILE A 70 9.839 63.641 -45.224 1.00 12.32 C ATOM 1015 CD1 ILE A 70 8.954 64.279 -42.369 1.00 42.43 C ATOM 0 H ILE A 70 12.329 62.498 -42.267 1.00 71.41 H new ATOM 0 HA ILE A 70 9.645 61.822 -43.127 1.00 54.25 H new ATOM 0 HB ILE A 70 11.766 63.650 -44.316 1.00 3.10 H new ATOM 0 HG12 ILE A 70 11.066 64.390 -42.091 1.00 23.53 H new ATOM 0 HG13 ILE A 70 10.443 65.479 -43.314 1.00 23.53 H new ATOM 0 HG21 ILE A 70 9.913 64.667 -45.584 1.00 12.32 H new ATOM 0 HG22 ILE A 70 10.154 62.956 -46.011 1.00 12.32 H new ATOM 0 HG23 ILE A 70 8.806 63.427 -44.949 1.00 12.32 H new ATOM 0 HD11 ILE A 70 8.756 65.027 -41.601 1.00 42.43 H new ATOM 0 HD12 ILE A 70 8.232 64.389 -43.178 1.00 42.43 H new ATOM 0 HD13 ILE A 70 8.864 63.283 -41.936 1.00 42.43 H new ATOM 1027 N ASN A 71 12.248 60.489 -44.487 1.00 10.14 N ATOM 1028 CA ASN A 71 12.739 59.577 -45.514 1.00 44.34 C ATOM 1029 C ASN A 71 11.955 58.275 -45.501 1.00 55.34 C ATOM 1030 O ASN A 71 11.316 57.911 -46.489 1.00 20.43 O ATOM 1031 CB ASN A 71 14.225 59.269 -45.322 1.00 33.10 C ATOM 1032 CG ASN A 71 15.084 60.514 -45.269 1.00 24.15 C ATOM 1033 OD1 ASN A 71 14.723 61.556 -45.810 1.00 2.11 O ATOM 1034 ND2 ASN A 71 16.243 60.405 -44.643 1.00 61.43 N ATOM 0 H ASN A 71 12.911 60.675 -43.734 1.00 10.14 H new ATOM 0 HA ASN A 71 12.603 60.073 -46.475 1.00 44.34 H new ATOM 0 HB2 ASN A 71 14.357 58.703 -44.400 1.00 33.10 H new ATOM 0 HB3 ASN A 71 14.567 58.632 -46.138 1.00 33.10 H new ATOM 0 HD21 ASN A 71 16.875 61.204 -44.597 1.00 61.43 H new ATOM 0 HD22 ASN A 71 16.506 59.521 -44.206 1.00 61.43 H new ATOM 1041 N THR A 72 12.013 57.573 -44.382 1.00 12.11 N ATOM 1042 CA THR A 72 11.335 56.296 -44.235 1.00 23.30 C ATOM 1043 C THR A 72 11.041 56.040 -42.756 1.00 44.31 C ATOM 1044 O THR A 72 11.768 56.525 -41.888 1.00 44.23 O ATOM 1045 CB THR A 72 12.198 55.145 -44.808 1.00 2.13 C ATOM 1046 OG1 THR A 72 12.679 55.491 -46.115 1.00 14.23 O ATOM 1047 CG2 THR A 72 11.404 53.851 -44.907 1.00 53.31 C ATOM 0 H THR A 72 12.529 57.870 -43.554 1.00 12.11 H new ATOM 0 HA THR A 72 10.399 56.332 -44.793 1.00 23.30 H new ATOM 0 HB THR A 72 13.035 54.994 -44.126 1.00 2.13 H new ATOM 0 HG1 THR A 72 13.225 54.757 -46.468 1.00 14.23 H new ATOM 0 HG21 THR A 72 12.040 53.064 -45.313 1.00 53.31 H new ATOM 0 HG22 THR A 72 11.056 53.561 -43.916 1.00 53.31 H new ATOM 0 HG23 THR A 72 10.547 54.000 -45.564 1.00 53.31 H new ATOM 1055 N GLY A 73 9.975 55.298 -42.474 1.00 3.13 N ATOM 1056 CA GLY A 73 9.591 55.034 -41.101 1.00 42.41 C ATOM 1057 C GLY A 73 10.365 53.881 -40.494 1.00 24.53 C ATOM 1058 O GLY A 73 10.798 53.954 -39.343 1.00 71.02 O ATOM 0 H GLY A 73 9.368 54.874 -43.176 1.00 3.13 H new ATOM 0 HA2 GLY A 73 9.753 55.931 -40.503 1.00 42.41 H new ATOM 0 HA3 GLY A 73 8.524 54.812 -41.061 1.00 42.41 H new ATOM 1062 N LYS A 74 10.500 52.795 -41.253 1.00 31.51 N ATOM 1063 CA LYS A 74 11.304 51.658 -40.818 1.00 51.44 C ATOM 1064 C LYS A 74 12.744 52.098 -40.540 1.00 44.43 C ATOM 1065 O LYS A 74 13.285 52.959 -41.238 1.00 24.01 O ATOM 1066 CB LYS A 74 11.278 50.532 -41.860 1.00 23.21 C ATOM 1067 CG LYS A 74 11.845 50.924 -43.214 1.00 4.23 C ATOM 1068 CD LYS A 74 11.788 49.771 -44.199 1.00 20.20 C ATOM 1069 CE LYS A 74 12.321 50.182 -45.560 1.00 35.24 C ATOM 1070 NZ LYS A 74 12.292 49.054 -46.526 1.00 22.45 N1+ ATOM 0 H LYS A 74 10.064 52.680 -42.168 1.00 31.51 H new ATOM 0 HA LYS A 74 10.872 51.272 -39.895 1.00 51.44 H new ATOM 0 HB2 LYS A 74 11.842 49.682 -41.475 1.00 23.21 H new ATOM 0 HB3 LYS A 74 10.249 50.198 -41.992 1.00 23.21 H new ATOM 0 HG2 LYS A 74 11.286 51.771 -43.612 1.00 4.23 H new ATOM 0 HG3 LYS A 74 12.878 51.251 -43.096 1.00 4.23 H new ATOM 0 HD2 LYS A 74 12.370 48.933 -43.816 1.00 20.20 H new ATOM 0 HD3 LYS A 74 10.759 49.425 -44.298 1.00 20.20 H new ATOM 0 HE2 LYS A 74 11.727 51.009 -45.949 1.00 35.24 H new ATOM 0 HE3 LYS A 74 13.343 50.545 -45.456 1.00 35.24 H new ATOM 0 HZ1 LYS A 74 12.663 49.373 -47.444 1.00 22.45 H new ATOM 0 HZ2 LYS A 74 12.879 48.274 -46.167 1.00 22.45 H new ATOM 0 HZ3 LYS A 74 11.313 48.724 -46.645 1.00 22.45 H new ATOM 1084 N PRO A 75 13.387 51.507 -39.525 1.00 62.34 N ATOM 1085 CA PRO A 75 14.752 51.866 -39.143 1.00 2.31 C ATOM 1086 C PRO A 75 15.776 51.404 -40.172 1.00 25.45 C ATOM 1087 O PRO A 75 16.798 52.057 -40.387 1.00 34.43 O ATOM 1088 CB PRO A 75 14.971 51.130 -37.812 1.00 60.25 C ATOM 1089 CG PRO A 75 13.627 50.624 -37.400 1.00 23.21 C ATOM 1090 CD PRO A 75 12.842 50.452 -38.665 1.00 65.03 C ATOM 0 HA PRO A 75 14.877 52.946 -39.069 1.00 2.31 H new ATOM 0 HB2 PRO A 75 15.678 50.309 -37.931 1.00 60.25 H new ATOM 0 HB3 PRO A 75 15.384 51.800 -37.058 1.00 60.25 H new ATOM 0 HG2 PRO A 75 13.714 49.679 -36.864 1.00 23.21 H new ATOM 0 HG3 PRO A 75 13.135 51.327 -36.728 1.00 23.21 H new ATOM 0 HD2 PRO A 75 12.984 49.462 -39.099 1.00 65.03 H new ATOM 0 HD3 PRO A 75 11.772 50.577 -38.498 1.00 65.03 H new ATOM 1098 N GLY A 76 15.499 50.266 -40.798 1.00 12.10 N ATOM 1099 CA GLY A 76 16.421 49.701 -41.762 1.00 14.01 C ATOM 1100 C GLY A 76 17.435 48.785 -41.103 1.00 13.34 C ATOM 1101 O GLY A 76 17.945 47.853 -41.725 1.00 72.12 O ATOM 0 H GLY A 76 14.648 49.723 -40.653 1.00 12.10 H new ATOM 0 HA2 GLY A 76 15.863 49.144 -42.515 1.00 14.01 H new ATOM 0 HA3 GLY A 76 16.942 50.505 -42.282 1.00 14.01 H new ATOM 1105 N ARG A 77 17.719 49.058 -39.835 1.00 2.44 N ATOM 1106 CA ARG A 77 18.654 48.262 -39.053 1.00 13.33 C ATOM 1107 C ARG A 77 18.089 46.861 -38.835 1.00 22.11 C ATOM 1108 O ARG A 77 17.004 46.697 -38.274 1.00 0.25 O ATOM 1109 CB ARG A 77 18.930 48.970 -37.714 1.00 21.41 C ATOM 1110 CG ARG A 77 20.050 48.365 -36.877 1.00 30.43 C ATOM 1111 CD ARG A 77 19.569 47.184 -36.054 1.00 20.32 C ATOM 1112 NE ARG A 77 20.603 46.694 -35.145 1.00 45.02 N ATOM 1113 CZ ARG A 77 20.380 45.813 -34.169 1.00 1.11 C ATOM 1114 NH1 ARG A 77 19.166 45.309 -33.983 1.00 21.40 N1+ ATOM 1115 NH2 ARG A 77 21.368 45.440 -33.369 1.00 14.15 N ATOM 0 H ARG A 77 17.307 49.837 -39.321 1.00 2.44 H new ATOM 0 HA ARG A 77 19.597 48.162 -39.591 1.00 13.33 H new ATOM 0 HB2 ARG A 77 19.173 50.013 -37.917 1.00 21.41 H new ATOM 0 HB3 ARG A 77 18.014 48.965 -37.123 1.00 21.41 H new ATOM 0 HG2 ARG A 77 20.860 48.045 -37.532 1.00 30.43 H new ATOM 0 HG3 ARG A 77 20.459 49.127 -36.214 1.00 30.43 H new ATOM 0 HD2 ARG A 77 18.690 47.476 -35.480 1.00 20.32 H new ATOM 0 HD3 ARG A 77 19.261 46.379 -36.721 1.00 20.32 H new ATOM 0 HE ARG A 77 21.552 47.047 -35.264 1.00 45.02 H new ATOM 0 HH11 ARG A 77 18.397 45.595 -34.589 1.00 21.40 H new ATOM 0 HH12 ARG A 77 19.003 44.636 -33.235 1.00 21.40 H new ATOM 0 HH21 ARG A 77 22.303 45.827 -33.499 1.00 14.15 H new ATOM 0 HH22 ARG A 77 21.194 44.766 -32.624 1.00 14.15 H new ATOM 1129 N MET A 78 18.825 45.863 -39.290 1.00 12.00 N ATOM 1130 CA MET A 78 18.401 44.475 -39.178 1.00 2.03 C ATOM 1131 C MET A 78 19.354 43.705 -38.273 1.00 70.13 C ATOM 1132 O MET A 78 20.558 43.645 -38.533 1.00 44.34 O ATOM 1133 CB MET A 78 18.349 43.820 -40.562 1.00 63.14 C ATOM 1134 CG MET A 78 17.912 42.360 -40.539 1.00 52.15 C ATOM 1135 SD MET A 78 17.979 41.583 -42.166 1.00 73.31 S ATOM 1136 CE MET A 78 16.793 42.579 -43.065 1.00 35.54 C ATOM 0 H MET A 78 19.729 45.988 -39.746 1.00 12.00 H new ATOM 0 HA MET A 78 17.403 44.452 -38.741 1.00 2.03 H new ATOM 0 HB2 MET A 78 17.664 44.384 -41.194 1.00 63.14 H new ATOM 0 HB3 MET A 78 19.335 43.887 -41.022 1.00 63.14 H new ATOM 0 HG2 MET A 78 18.550 41.806 -39.850 1.00 52.15 H new ATOM 0 HG3 MET A 78 16.895 42.296 -40.153 1.00 52.15 H new ATOM 0 HE1 MET A 78 16.481 42.049 -43.965 1.00 35.54 H new ATOM 0 HE2 MET A 78 15.924 42.767 -42.435 1.00 35.54 H new ATOM 0 HE3 MET A 78 17.251 43.528 -43.343 1.00 35.54 H new ATOM 1146 N VAL A 79 18.819 43.117 -37.215 1.00 63.22 N ATOM 1147 CA VAL A 79 19.640 42.370 -36.277 1.00 53.31 C ATOM 1148 C VAL A 79 20.068 41.030 -36.878 1.00 34.33 C ATOM 1149 O VAL A 79 19.242 40.249 -37.346 1.00 23.05 O ATOM 1150 CB VAL A 79 18.919 42.149 -34.925 1.00 51.15 C ATOM 1151 CG1 VAL A 79 17.618 41.382 -35.104 1.00 62.34 C ATOM 1152 CG2 VAL A 79 19.836 41.435 -33.941 1.00 20.14 C ATOM 0 H VAL A 79 17.826 43.142 -36.985 1.00 63.22 H new ATOM 0 HA VAL A 79 20.530 42.968 -36.081 1.00 53.31 H new ATOM 0 HB VAL A 79 18.668 43.129 -34.518 1.00 51.15 H new ATOM 0 HG11 VAL A 79 17.140 41.246 -34.134 1.00 62.34 H new ATOM 0 HG12 VAL A 79 16.953 41.942 -35.761 1.00 62.34 H new ATOM 0 HG13 VAL A 79 17.828 40.408 -35.545 1.00 62.34 H new ATOM 0 HG21 VAL A 79 19.312 41.288 -32.996 1.00 20.14 H new ATOM 0 HG22 VAL A 79 20.125 40.467 -34.350 1.00 20.14 H new ATOM 0 HG23 VAL A 79 20.728 42.038 -33.771 1.00 20.14 H new ATOM 1162 N THR A 80 21.370 40.795 -36.892 1.00 24.24 N ATOM 1163 CA THR A 80 21.932 39.551 -37.390 1.00 43.31 C ATOM 1164 C THR A 80 23.068 39.122 -36.456 1.00 22.22 C ATOM 1165 O THR A 80 23.679 39.969 -35.806 1.00 20.53 O ATOM 1166 CB THR A 80 22.439 39.714 -38.843 1.00 4.42 C ATOM 1167 OG1 THR A 80 21.427 40.349 -39.641 1.00 23.43 O ATOM 1168 CG2 THR A 80 22.789 38.373 -39.465 1.00 23.11 C ATOM 0 H THR A 80 22.067 41.461 -36.558 1.00 24.24 H new ATOM 0 HA THR A 80 21.161 38.781 -37.405 1.00 43.31 H new ATOM 0 HB THR A 80 23.339 40.327 -38.814 1.00 4.42 H new ATOM 0 HG1 THR A 80 21.752 40.452 -40.560 1.00 23.43 H new ATOM 0 HG21 THR A 80 23.141 38.526 -40.485 1.00 23.11 H new ATOM 0 HG22 THR A 80 23.573 37.893 -38.879 1.00 23.11 H new ATOM 0 HG23 THR A 80 21.905 37.736 -39.478 1.00 23.11 H new ATOM 1176 N ASN A 81 23.335 37.820 -36.374 1.00 12.13 N ATOM 1177 CA ASN A 81 24.253 37.280 -35.368 1.00 13.33 C ATOM 1178 C ASN A 81 25.692 37.753 -35.570 1.00 53.52 C ATOM 1179 O ASN A 81 26.269 38.396 -34.693 1.00 72.31 O ATOM 1180 CB ASN A 81 24.203 35.745 -35.376 1.00 31.34 C ATOM 1181 CG ASN A 81 25.086 35.115 -34.313 1.00 23.22 C ATOM 1182 OD1 ASN A 81 25.604 34.012 -34.497 1.00 55.05 O ATOM 1183 ND2 ASN A 81 25.251 35.798 -33.190 1.00 51.02 N ATOM 0 H ASN A 81 22.929 37.117 -36.992 1.00 12.13 H new ATOM 0 HA ASN A 81 23.921 37.657 -34.401 1.00 13.33 H new ATOM 0 HB2 ASN A 81 23.174 35.420 -35.224 1.00 31.34 H new ATOM 0 HB3 ASN A 81 24.510 35.382 -36.357 1.00 31.34 H new ATOM 0 HD21 ASN A 81 25.824 35.414 -32.439 1.00 51.02 H new ATOM 0 HD22 ASN A 81 24.805 36.708 -33.077 1.00 51.02 H new ATOM 1190 N ASP A 82 26.265 37.441 -36.718 1.00 32.11 N ATOM 1191 CA ASP A 82 27.688 37.673 -36.939 1.00 24.13 C ATOM 1192 C ASP A 82 27.925 38.930 -37.770 1.00 61.51 C ATOM 1193 O ASP A 82 29.059 39.281 -38.094 1.00 75.51 O ATOM 1194 CB ASP A 82 28.301 36.448 -37.618 1.00 23.52 C ATOM 1195 CG ASP A 82 29.815 36.486 -37.662 1.00 72.21 C ATOM 1196 OD1 ASP A 82 30.440 36.869 -36.652 1.00 63.25 O ATOM 1197 OD2 ASP A 82 30.386 36.071 -38.692 1.00 30.43 O1- ATOM 0 H ASP A 82 25.773 37.028 -37.511 1.00 32.11 H new ATOM 0 HA ASP A 82 28.171 37.830 -35.974 1.00 24.13 H new ATOM 0 HB2 ASP A 82 27.982 35.550 -37.090 1.00 23.52 H new ATOM 0 HB3 ASP A 82 27.916 36.373 -38.635 1.00 23.52 H new ATOM 1202 N TYR A 83 26.847 39.615 -38.100 1.00 2.10 N ATOM 1203 CA TYR A 83 26.926 40.854 -38.855 1.00 61.22 C ATOM 1204 C TYR A 83 25.827 41.808 -38.411 1.00 25.13 C ATOM 1205 O TYR A 83 24.647 41.513 -38.567 1.00 35.42 O ATOM 1206 CB TYR A 83 26.789 40.592 -40.364 1.00 22.35 C ATOM 1207 CG TYR A 83 28.027 40.027 -41.026 1.00 63.34 C ATOM 1208 CD1 TYR A 83 28.973 40.872 -41.588 1.00 54.31 C ATOM 1209 CD2 TYR A 83 28.250 38.657 -41.096 1.00 61.31 C ATOM 1210 CE1 TYR A 83 30.101 40.372 -42.206 1.00 54.50 C ATOM 1211 CE2 TYR A 83 29.376 38.149 -41.709 1.00 43.02 C ATOM 1212 CZ TYR A 83 30.300 39.011 -42.260 1.00 0.23 C ATOM 1213 OH TYR A 83 31.426 38.508 -42.873 1.00 35.22 O ATOM 0 H TYR A 83 25.898 39.333 -37.855 1.00 2.10 H new ATOM 0 HA TYR A 83 27.902 41.300 -38.663 1.00 61.22 H new ATOM 0 HB2 TYR A 83 25.961 39.901 -40.525 1.00 22.35 H new ATOM 0 HB3 TYR A 83 26.525 41.527 -40.858 1.00 22.35 H new ATOM 0 HD1 TYR A 83 28.824 41.941 -41.541 1.00 54.31 H new ATOM 0 HD2 TYR A 83 27.529 37.979 -40.663 1.00 61.31 H new ATOM 0 HE1 TYR A 83 30.823 41.044 -42.645 1.00 54.50 H new ATOM 0 HE2 TYR A 83 29.533 37.082 -41.757 1.00 43.02 H new ATOM 0 HH TYR A 83 31.416 37.529 -42.824 1.00 35.22 H new ATOM 1223 N ILE A 84 26.205 42.946 -37.848 1.00 71.04 N ATOM 1224 CA ILE A 84 25.223 43.952 -37.479 1.00 33.43 C ATOM 1225 C ILE A 84 24.918 44.815 -38.696 1.00 24.33 C ATOM 1226 O ILE A 84 25.723 45.656 -39.097 1.00 13.30 O ATOM 1227 CB ILE A 84 25.676 44.844 -36.295 1.00 35.11 C ATOM 1228 CG1 ILE A 84 25.912 44.014 -35.025 1.00 70.51 C ATOM 1229 CG2 ILE A 84 24.643 45.928 -36.022 1.00 63.41 C ATOM 1230 CD1 ILE A 84 27.215 43.238 -35.019 1.00 21.15 C ATOM 0 H ILE A 84 27.172 43.193 -37.639 1.00 71.04 H new ATOM 0 HA ILE A 84 24.329 43.428 -37.142 1.00 33.43 H new ATOM 0 HB ILE A 84 26.620 45.311 -36.575 1.00 35.11 H new ATOM 0 HG12 ILE A 84 25.895 44.680 -34.162 1.00 70.51 H new ATOM 0 HG13 ILE A 84 25.085 43.314 -34.904 1.00 70.51 H new ATOM 0 HG21 ILE A 84 24.976 46.546 -35.188 1.00 63.41 H new ATOM 0 HG22 ILE A 84 24.525 46.550 -36.910 1.00 63.41 H new ATOM 0 HG23 ILE A 84 23.688 45.466 -35.773 1.00 63.41 H new ATOM 0 HD11 ILE A 84 27.302 42.680 -34.087 1.00 21.15 H new ATOM 0 HD12 ILE A 84 27.229 42.544 -35.860 1.00 21.15 H new ATOM 0 HD13 ILE A 84 28.052 43.931 -35.106 1.00 21.15 H new ATOM 1242 N VAL A 85 23.765 44.574 -39.296 1.00 45.21 N ATOM 1243 CA VAL A 85 23.390 45.233 -40.538 1.00 41.00 C ATOM 1244 C VAL A 85 22.544 46.471 -40.271 1.00 52.13 C ATOM 1245 O VAL A 85 21.410 46.371 -39.802 1.00 43.50 O ATOM 1246 CB VAL A 85 22.610 44.263 -41.451 1.00 62.43 C ATOM 1247 CG1 VAL A 85 22.197 44.941 -42.745 1.00 1.04 C ATOM 1248 CG2 VAL A 85 23.437 43.017 -41.741 1.00 64.33 C ATOM 0 H VAL A 85 23.066 43.921 -38.940 1.00 45.21 H new ATOM 0 HA VAL A 85 24.308 45.540 -41.038 1.00 41.00 H new ATOM 0 HB VAL A 85 21.704 43.963 -40.924 1.00 62.43 H new ATOM 0 HG11 VAL A 85 21.650 44.234 -43.368 1.00 1.04 H new ATOM 0 HG12 VAL A 85 21.559 45.796 -42.520 1.00 1.04 H new ATOM 0 HG13 VAL A 85 23.085 45.281 -43.277 1.00 1.04 H new ATOM 0 HG21 VAL A 85 22.870 42.346 -42.386 1.00 64.33 H new ATOM 0 HG22 VAL A 85 24.363 43.303 -42.240 1.00 64.33 H new ATOM 0 HG23 VAL A 85 23.671 42.509 -40.805 1.00 64.33 H new ATOM 1258 N ASP A 86 23.101 47.636 -40.554 1.00 31.13 N ATOM 1259 CA ASP A 86 22.356 48.880 -40.427 1.00 20.21 C ATOM 1260 C ASP A 86 22.091 49.483 -41.798 1.00 24.31 C ATOM 1261 O ASP A 86 22.976 50.087 -42.408 1.00 74.51 O ATOM 1262 CB ASP A 86 23.107 49.882 -39.546 1.00 4.42 C ATOM 1263 CG ASP A 86 22.372 51.207 -39.411 1.00 33.31 C ATOM 1264 OD1 ASP A 86 21.177 51.200 -39.042 1.00 21.44 O ATOM 1265 OD2 ASP A 86 22.995 52.266 -39.644 1.00 45.22 O1- ATOM 0 H ASP A 86 24.064 47.748 -40.872 1.00 31.13 H new ATOM 0 HA ASP A 86 21.402 48.654 -39.951 1.00 20.21 H new ATOM 0 HB2 ASP A 86 23.255 49.450 -38.556 1.00 4.42 H new ATOM 0 HB3 ASP A 86 24.096 50.061 -39.967 1.00 4.42 H new ATOM 1270 N ILE A 87 20.878 49.285 -42.296 1.00 70.13 N ATOM 1271 CA ILE A 87 20.470 49.879 -43.556 1.00 11.31 C ATOM 1272 C ILE A 87 19.862 51.251 -43.296 1.00 5.45 C ATOM 1273 O ILE A 87 18.690 51.369 -42.934 1.00 31.44 O ATOM 1274 CB ILE A 87 19.452 48.992 -44.311 1.00 73.15 C ATOM 1275 CG1 ILE A 87 20.008 47.576 -44.492 1.00 41.53 C ATOM 1276 CG2 ILE A 87 19.111 49.611 -45.662 1.00 33.35 C ATOM 1277 CD1 ILE A 87 19.033 46.619 -45.141 1.00 31.30 C ATOM 0 H ILE A 87 20.161 48.717 -41.844 1.00 70.13 H new ATOM 0 HA ILE A 87 21.356 49.972 -44.184 1.00 11.31 H new ATOM 0 HB ILE A 87 18.539 48.929 -43.720 1.00 73.15 H new ATOM 0 HG12 ILE A 87 20.913 47.625 -45.098 1.00 41.53 H new ATOM 0 HG13 ILE A 87 20.297 47.181 -43.518 1.00 41.53 H new ATOM 0 HG21 ILE A 87 18.394 48.976 -46.182 1.00 33.35 H new ATOM 0 HG22 ILE A 87 18.678 50.600 -45.510 1.00 33.35 H new ATOM 0 HG23 ILE A 87 20.018 49.700 -46.261 1.00 33.35 H new ATOM 0 HD11 ILE A 87 19.496 45.637 -45.236 1.00 31.30 H new ATOM 0 HD12 ILE A 87 18.137 46.539 -44.526 1.00 31.30 H new ATOM 0 HD13 ILE A 87 18.762 46.990 -46.130 1.00 31.30 H new ATOM 1289 N ALA A 88 20.669 52.282 -43.455 1.00 34.53 N ATOM 1290 CA ALA A 88 20.249 53.628 -43.124 1.00 21.21 C ATOM 1291 C ALA A 88 19.939 54.440 -44.371 1.00 23.43 C ATOM 1292 O ALA A 88 20.733 54.478 -45.312 1.00 54.14 O ATOM 1293 CB ALA A 88 21.331 54.315 -42.310 1.00 40.44 C ATOM 0 H ALA A 88 21.622 52.212 -43.812 1.00 34.53 H new ATOM 0 HA ALA A 88 19.333 53.562 -42.536 1.00 21.21 H new ATOM 0 HB1 ALA A 88 21.012 55.328 -42.062 1.00 40.44 H new ATOM 0 HB2 ALA A 88 21.506 53.755 -41.391 1.00 40.44 H new ATOM 0 HB3 ALA A 88 22.252 54.356 -42.891 1.00 40.44 H new ATOM 1299 N ASN A 89 18.781 55.076 -44.383 1.00 52.24 N ATOM 1300 CA ASN A 89 18.463 56.029 -45.430 1.00 21.13 C ATOM 1301 C ASN A 89 18.488 57.433 -44.856 1.00 22.12 C ATOM 1302 O ASN A 89 17.478 57.943 -44.371 1.00 62.21 O ATOM 1303 CB ASN A 89 17.103 55.742 -46.076 1.00 44.43 C ATOM 1304 CG ASN A 89 16.809 56.679 -47.240 1.00 51.24 C ATOM 1305 OD1 ASN A 89 16.213 57.740 -47.073 1.00 34.21 O ATOM 1306 ND2 ASN A 89 17.232 56.297 -48.436 1.00 52.10 N ATOM 0 H ASN A 89 18.049 54.951 -43.684 1.00 52.24 H new ATOM 0 HA ASN A 89 19.215 55.935 -46.213 1.00 21.13 H new ATOM 0 HB2 ASN A 89 17.080 54.711 -46.428 1.00 44.43 H new ATOM 0 HB3 ASN A 89 16.318 55.840 -45.326 1.00 44.43 H new ATOM 0 HD21 ASN A 89 17.065 56.890 -49.249 1.00 52.10 H new ATOM 0 HD22 ASN A 89 17.724 55.410 -48.544 1.00 52.10 H new ATOM 1313 N ARG A 90 19.665 58.028 -44.861 1.00 34.23 N ATOM 1314 CA ARG A 90 19.831 59.387 -44.388 1.00 61.53 C ATOM 1315 C ARG A 90 20.046 60.293 -45.589 1.00 14.51 C ATOM 1316 O ARG A 90 20.644 59.859 -46.580 1.00 31.12 O ATOM 1317 CB ARG A 90 21.020 59.484 -43.428 1.00 1.00 C ATOM 1318 CG ARG A 90 21.021 60.753 -42.594 1.00 75.44 C ATOM 1319 CD ARG A 90 22.316 60.911 -41.813 1.00 14.21 C ATOM 1320 NE ARG A 90 23.461 61.117 -42.697 1.00 45.22 N ATOM 1321 CZ ARG A 90 24.394 62.048 -42.508 1.00 45.51 C ATOM 1322 NH1 ARG A 90 24.349 62.834 -41.434 1.00 34.45 N1+ ATOM 1323 NH2 ARG A 90 25.371 62.183 -43.392 1.00 21.12 N ATOM 0 H ARG A 90 20.525 57.588 -45.190 1.00 34.23 H new ATOM 0 HA ARG A 90 18.939 59.697 -43.844 1.00 61.53 H new ATOM 0 HB2 ARG A 90 21.011 58.621 -42.762 1.00 1.00 H new ATOM 0 HB3 ARG A 90 21.945 59.435 -44.002 1.00 1.00 H new ATOM 0 HG2 ARG A 90 20.881 61.616 -43.245 1.00 75.44 H new ATOM 0 HG3 ARG A 90 20.179 60.735 -41.902 1.00 75.44 H new ATOM 0 HD2 ARG A 90 22.228 61.756 -41.130 1.00 14.21 H new ATOM 0 HD3 ARG A 90 22.483 60.023 -41.203 1.00 14.21 H new ATOM 0 HE ARG A 90 23.551 60.509 -43.511 1.00 45.22 H new ATOM 0 HH11 ARG A 90 23.598 62.724 -40.753 1.00 34.45 H new ATOM 0 HH12 ARG A 90 25.066 63.546 -41.293 1.00 34.45 H new ATOM 0 HH21 ARG A 90 25.405 61.576 -44.211 1.00 21.12 H new ATOM 0 HH22 ARG A 90 26.089 62.894 -43.254 1.00 21.12 H new ATOM 1337 N ASP A 91 19.548 61.529 -45.506 1.00 14.33 N ATOM 1338 CA ASP A 91 19.624 62.489 -46.615 1.00 71.02 C ATOM 1339 C ASP A 91 18.720 62.050 -47.767 1.00 43.52 C ATOM 1340 O ASP A 91 17.679 62.658 -48.017 1.00 61.51 O ATOM 1341 CB ASP A 91 21.075 62.668 -47.092 1.00 34.34 C ATOM 1342 CG ASP A 91 21.188 63.542 -48.322 1.00 2.00 C ATOM 1343 OD1 ASP A 91 20.866 64.745 -48.236 1.00 21.24 O ATOM 1344 OD2 ASP A 91 21.624 63.035 -49.375 1.00 32.31 O1- ATOM 0 H ASP A 91 19.083 61.893 -44.674 1.00 14.33 H new ATOM 0 HA ASP A 91 19.272 63.455 -46.253 1.00 71.02 H new ATOM 0 HB2 ASP A 91 21.665 63.105 -46.287 1.00 34.34 H new ATOM 0 HB3 ASP A 91 21.504 61.690 -47.307 1.00 34.34 H new ATOM 1349 N GLY A 92 19.108 60.984 -48.446 1.00 75.32 N ATOM 1350 CA GLY A 92 18.290 60.438 -49.508 1.00 62.34 C ATOM 1351 C GLY A 92 18.929 59.233 -50.165 1.00 52.21 C ATOM 1352 O GLY A 92 18.592 58.881 -51.294 1.00 23.30 O ATOM 0 H GLY A 92 19.981 60.483 -48.280 1.00 75.32 H new ATOM 0 HA2 GLY A 92 17.317 60.156 -49.106 1.00 62.34 H new ATOM 0 HA3 GLY A 92 18.113 61.208 -50.259 1.00 62.34 H new ATOM 1356 N GLN A 93 19.841 58.581 -49.453 1.00 55.42 N ATOM 1357 CA GLN A 93 20.582 57.462 -50.022 1.00 43.03 C ATOM 1358 C GLN A 93 20.462 56.232 -49.131 1.00 53.23 C ATOM 1359 O GLN A 93 20.464 56.343 -47.906 1.00 62.41 O ATOM 1360 CB GLN A 93 22.069 57.820 -50.188 1.00 32.14 C ATOM 1361 CG GLN A 93 22.335 59.159 -50.875 1.00 62.32 C ATOM 1362 CD GLN A 93 22.318 59.104 -52.398 1.00 5.43 C ATOM 1363 OE1 GLN A 93 23.037 59.856 -53.058 1.00 25.23 O ATOM 1364 NE2 GLN A 93 21.503 58.238 -52.973 1.00 33.20 N ATOM 0 H GLN A 93 20.084 58.806 -48.488 1.00 55.42 H new ATOM 0 HA GLN A 93 20.154 57.244 -51.000 1.00 43.03 H new ATOM 0 HB2 GLN A 93 22.537 57.834 -49.203 1.00 32.14 H new ATOM 0 HB3 GLN A 93 22.556 57.031 -50.761 1.00 32.14 H new ATOM 0 HG2 GLN A 93 21.587 59.878 -50.542 1.00 62.32 H new ATOM 0 HG3 GLN A 93 23.305 59.534 -50.549 1.00 62.32 H new ATOM 0 HE21 GLN A 93 20.920 57.628 -52.400 1.00 33.20 H new ATOM 0 HE22 GLN A 93 21.457 58.179 -53.990 1.00 33.20 H new ATOM 1373 N LEU A 94 20.346 55.063 -49.753 1.00 22.14 N ATOM 1374 CA LEU A 94 20.356 53.802 -49.022 1.00 50.31 C ATOM 1375 C LEU A 94 21.794 53.409 -48.723 1.00 43.43 C ATOM 1376 O LEU A 94 22.555 53.080 -49.631 1.00 52.24 O ATOM 1377 CB LEU A 94 19.669 52.678 -49.816 1.00 41.23 C ATOM 1378 CG LEU A 94 18.137 52.735 -49.891 1.00 41.02 C ATOM 1379 CD1 LEU A 94 17.536 52.813 -48.495 1.00 1.43 C ATOM 1380 CD2 LEU A 94 17.669 53.899 -50.755 1.00 42.11 C ATOM 0 H LEU A 94 20.244 54.963 -50.763 1.00 22.14 H new ATOM 0 HA LEU A 94 19.800 53.942 -48.095 1.00 50.31 H new ATOM 0 HB2 LEU A 94 20.062 52.688 -50.833 1.00 41.23 H new ATOM 0 HB3 LEU A 94 19.954 51.723 -49.374 1.00 41.23 H new ATOM 0 HG LEU A 94 17.788 51.816 -50.362 1.00 41.02 H new ATOM 0 HD11 LEU A 94 16.449 52.853 -48.568 1.00 1.43 H new ATOM 0 HD12 LEU A 94 17.829 51.933 -47.923 1.00 1.43 H new ATOM 0 HD13 LEU A 94 17.899 53.710 -47.992 1.00 1.43 H new ATOM 0 HD21 LEU A 94 16.580 53.912 -50.788 1.00 42.11 H new ATOM 0 HD22 LEU A 94 18.031 54.836 -50.331 1.00 42.11 H new ATOM 0 HD23 LEU A 94 18.062 53.783 -51.765 1.00 42.11 H new ATOM 1392 N GLN A 95 22.171 53.480 -47.464 1.00 22.34 N ATOM 1393 CA GLN A 95 23.531 53.179 -47.067 1.00 52.10 C ATOM 1394 C GLN A 95 23.574 51.926 -46.206 1.00 55.53 C ATOM 1395 O GLN A 95 23.081 51.912 -45.077 1.00 20.22 O ATOM 1396 CB GLN A 95 24.126 54.377 -46.333 1.00 54.30 C ATOM 1397 CG GLN A 95 25.569 54.186 -45.894 1.00 4.25 C ATOM 1398 CD GLN A 95 26.278 55.500 -45.608 1.00 5.40 C ATOM 1399 OE1 GLN A 95 27.122 55.579 -44.716 1.00 14.41 O ATOM 1400 NE2 GLN A 95 25.978 56.530 -46.391 1.00 5.31 N ATOM 0 H GLN A 95 21.554 53.744 -46.696 1.00 22.34 H new ATOM 0 HA GLN A 95 24.130 52.984 -47.957 1.00 52.10 H new ATOM 0 HB2 GLN A 95 24.068 55.251 -46.981 1.00 54.30 H new ATOM 0 HB3 GLN A 95 23.516 54.590 -45.455 1.00 54.30 H new ATOM 0 HG2 GLN A 95 25.592 53.564 -44.999 1.00 4.25 H new ATOM 0 HG3 GLN A 95 26.112 53.647 -46.671 1.00 4.25 H new ATOM 0 HE21 GLN A 95 25.273 56.428 -47.121 1.00 5.31 H new ATOM 0 HE22 GLN A 95 26.453 57.423 -46.263 1.00 5.31 H new ATOM 1409 N LEU A 96 24.139 50.867 -46.766 1.00 75.11 N ATOM 1410 CA LEU A 96 24.272 49.605 -46.062 1.00 53.33 C ATOM 1411 C LEU A 96 25.542 49.603 -45.221 1.00 12.32 C ATOM 1412 O LEU A 96 26.637 49.358 -45.729 1.00 51.50 O ATOM 1413 CB LEU A 96 24.298 48.439 -47.060 1.00 11.23 C ATOM 1414 CG LEU A 96 24.489 47.048 -46.452 1.00 54.15 C ATOM 1415 CD1 LEU A 96 23.291 46.670 -45.601 1.00 12.31 C ATOM 1416 CD2 LEU A 96 24.714 46.017 -47.548 1.00 11.35 C ATOM 0 H LEU A 96 24.515 50.860 -47.714 1.00 75.11 H new ATOM 0 HA LEU A 96 23.413 49.482 -45.402 1.00 53.33 H new ATOM 0 HB2 LEU A 96 23.364 48.445 -47.621 1.00 11.23 H new ATOM 0 HB3 LEU A 96 25.101 48.616 -47.776 1.00 11.23 H new ATOM 0 HG LEU A 96 25.371 47.068 -45.811 1.00 54.15 H new ATOM 0 HD11 LEU A 96 23.445 45.678 -45.177 1.00 12.31 H new ATOM 0 HD12 LEU A 96 23.174 47.395 -44.795 1.00 12.31 H new ATOM 0 HD13 LEU A 96 22.393 46.666 -46.219 1.00 12.31 H new ATOM 0 HD21 LEU A 96 24.848 45.033 -47.100 1.00 11.35 H new ATOM 0 HD22 LEU A 96 23.850 45.998 -48.213 1.00 11.35 H new ATOM 0 HD23 LEU A 96 25.605 46.280 -48.118 1.00 11.35 H new ATOM 1428 N ASN A 97 25.394 49.912 -43.945 1.00 24.34 N ATOM 1429 CA ASN A 97 26.516 49.898 -43.021 1.00 24.31 C ATOM 1430 C ASN A 97 26.572 48.570 -42.288 1.00 43.41 C ATOM 1431 O ASN A 97 25.808 48.327 -41.351 1.00 33.42 O ATOM 1432 CB ASN A 97 26.418 51.063 -42.030 1.00 32.34 C ATOM 1433 CG ASN A 97 27.202 52.279 -42.486 1.00 4.11 C ATOM 1434 OD1 ASN A 97 28.239 52.149 -43.128 1.00 11.22 O ATOM 1435 ND2 ASN A 97 26.710 53.468 -42.171 1.00 2.51 N ATOM 0 H ASN A 97 24.504 50.177 -43.523 1.00 24.34 H new ATOM 0 HA ASN A 97 27.437 50.019 -43.591 1.00 24.31 H new ATOM 0 HB2 ASN A 97 25.371 51.337 -41.899 1.00 32.34 H new ATOM 0 HB3 ASN A 97 26.787 50.740 -41.057 1.00 32.34 H new ATOM 0 HD21 ASN A 97 27.197 54.315 -42.464 1.00 2.51 H new ATOM 0 HD22 ASN A 97 25.845 53.536 -41.636 1.00 2.51 H new ATOM 1442 N VAL A 98 27.453 47.698 -42.744 1.00 45.14 N ATOM 1443 CA VAL A 98 27.607 46.389 -42.144 1.00 72.02 C ATOM 1444 C VAL A 98 28.725 46.406 -41.121 1.00 15.31 C ATOM 1445 O VAL A 98 29.897 46.567 -41.464 1.00 42.35 O ATOM 1446 CB VAL A 98 27.888 45.301 -43.205 1.00 44.14 C ATOM 1447 CG1 VAL A 98 28.319 43.997 -42.552 1.00 50.42 C ATOM 1448 CG2 VAL A 98 26.654 45.069 -44.046 1.00 24.02 C ATOM 0 H VAL A 98 28.075 47.876 -43.532 1.00 45.14 H new ATOM 0 HA VAL A 98 26.666 46.145 -41.651 1.00 72.02 H new ATOM 0 HB VAL A 98 28.701 45.650 -43.841 1.00 44.14 H new ATOM 0 HG11 VAL A 98 28.510 43.250 -43.322 1.00 50.42 H new ATOM 0 HG12 VAL A 98 29.228 44.163 -41.974 1.00 50.42 H new ATOM 0 HG13 VAL A 98 27.528 43.642 -41.891 1.00 50.42 H new ATOM 0 HG21 VAL A 98 26.861 44.301 -44.791 1.00 24.02 H new ATOM 0 HG22 VAL A 98 25.834 44.743 -43.406 1.00 24.02 H new ATOM 0 HG23 VAL A 98 26.376 45.996 -44.548 1.00 24.02 H new ATOM 1458 N THR A 99 28.356 46.265 -39.863 1.00 13.53 N ATOM 1459 CA THR A 99 29.327 46.177 -38.797 1.00 63.52 C ATOM 1460 C THR A 99 29.708 44.718 -38.569 1.00 34.14 C ATOM 1461 O THR A 99 28.932 43.945 -38.000 1.00 52.04 O ATOM 1462 CB THR A 99 28.769 46.779 -37.496 1.00 15.12 C ATOM 1463 OG1 THR A 99 28.231 48.085 -37.752 1.00 32.14 O ATOM 1464 CG2 THR A 99 29.853 46.871 -36.426 1.00 64.32 C ATOM 0 H THR A 99 27.385 46.209 -39.556 1.00 13.53 H new ATOM 0 HA THR A 99 30.211 46.745 -39.087 1.00 63.52 H new ATOM 0 HB THR A 99 27.978 46.124 -37.130 1.00 15.12 H new ATOM 0 HG1 THR A 99 27.876 48.461 -36.920 1.00 32.14 H new ATOM 0 HG21 THR A 99 29.431 47.300 -35.517 1.00 64.32 H new ATOM 0 HG22 THR A 99 30.239 45.874 -36.212 1.00 64.32 H new ATOM 0 HG23 THR A 99 30.664 47.505 -36.784 1.00 64.32 H new ATOM 1472 N ASP A 100 30.884 44.339 -39.054 1.00 61.11 N ATOM 1473 CA ASP A 100 31.386 42.977 -38.889 1.00 23.41 C ATOM 1474 C ASP A 100 31.494 42.613 -37.409 1.00 63.40 C ATOM 1475 O ASP A 100 31.751 43.477 -36.566 1.00 62.23 O ATOM 1476 CB ASP A 100 32.745 42.837 -39.572 1.00 14.41 C ATOM 1477 CG ASP A 100 33.466 41.564 -39.197 1.00 53.52 C ATOM 1478 OD1 ASP A 100 34.538 41.661 -38.578 1.00 4.12 O ATOM 1479 OD2 ASP A 100 32.959 40.467 -39.497 1.00 11.31 O1- ATOM 0 H ASP A 100 31.512 44.958 -39.567 1.00 61.11 H new ATOM 0 HA ASP A 100 30.681 42.289 -39.356 1.00 23.41 H new ATOM 0 HB2 ASP A 100 32.607 42.865 -40.653 1.00 14.41 H new ATOM 0 HB3 ASP A 100 33.368 43.692 -39.308 1.00 14.41 H new ATOM 1484 N ARG A 101 31.283 41.346 -37.093 1.00 1.22 N ATOM 1485 CA ARG A 101 31.302 40.906 -35.709 1.00 70.42 C ATOM 1486 C ARG A 101 32.480 39.967 -35.440 1.00 41.44 C ATOM 1487 O ARG A 101 32.765 39.624 -34.292 1.00 3.54 O ATOM 1488 CB ARG A 101 29.975 40.228 -35.356 1.00 70.04 C ATOM 1489 CG ARG A 101 29.797 39.972 -33.872 1.00 12.41 C ATOM 1490 CD ARG A 101 29.854 41.270 -33.087 1.00 13.24 C ATOM 1491 NE ARG A 101 30.037 41.051 -31.656 1.00 14.53 N ATOM 1492 CZ ARG A 101 30.377 42.013 -30.797 1.00 32.32 C ATOM 1493 NH1 ARG A 101 30.570 43.253 -31.231 1.00 20.33 N1+ ATOM 1494 NH2 ARG A 101 30.537 41.735 -29.509 1.00 52.25 N ATOM 0 H ARG A 101 31.098 40.608 -37.772 1.00 1.22 H new ATOM 0 HA ARG A 101 31.430 41.782 -35.073 1.00 70.42 H new ATOM 0 HB2 ARG A 101 29.153 40.851 -35.709 1.00 70.04 H new ATOM 0 HB3 ARG A 101 29.908 39.280 -35.890 1.00 70.04 H new ATOM 0 HG2 ARG A 101 28.841 39.478 -33.696 1.00 12.41 H new ATOM 0 HG3 ARG A 101 30.575 39.295 -33.520 1.00 12.41 H new ATOM 0 HD2 ARG A 101 30.672 41.883 -33.465 1.00 13.24 H new ATOM 0 HD3 ARG A 101 28.933 41.830 -33.251 1.00 13.24 H new ATOM 0 HE ARG A 101 29.897 40.109 -31.292 1.00 14.53 H new ATOM 0 HH11 ARG A 101 30.458 43.470 -32.221 1.00 20.33 H new ATOM 0 HH12 ARG A 101 30.830 43.989 -30.574 1.00 20.33 H new ATOM 0 HH21 ARG A 101 30.400 40.782 -29.172 1.00 52.25 H new ATOM 0 HH22 ARG A 101 30.797 42.474 -28.856 1.00 52.25 H new ATOM 1508 N LYS A 102 33.170 39.554 -36.495 1.00 25.22 N ATOM 1509 CA LYS A 102 34.337 38.693 -36.342 1.00 51.24 C ATOM 1510 C LYS A 102 35.555 39.503 -35.918 1.00 24.03 C ATOM 1511 O LYS A 102 36.242 39.159 -34.955 1.00 61.52 O ATOM 1512 CB LYS A 102 34.625 37.934 -37.639 1.00 63.24 C ATOM 1513 CG LYS A 102 33.811 36.659 -37.783 1.00 64.00 C ATOM 1514 CD LYS A 102 34.292 35.595 -36.810 1.00 42.35 C ATOM 1515 CE LYS A 102 33.326 34.427 -36.723 1.00 32.33 C ATOM 1516 NZ LYS A 102 32.038 34.822 -36.097 1.00 73.14 N1+ ATOM 0 H LYS A 102 32.945 39.799 -37.459 1.00 25.22 H new ATOM 0 HA LYS A 102 34.119 37.966 -35.560 1.00 51.24 H new ATOM 0 HB2 LYS A 102 34.418 38.587 -38.487 1.00 63.24 H new ATOM 0 HB3 LYS A 102 35.686 37.686 -37.679 1.00 63.24 H new ATOM 0 HG2 LYS A 102 32.758 36.873 -37.602 1.00 64.00 H new ATOM 0 HG3 LYS A 102 33.890 36.286 -38.804 1.00 64.00 H new ATOM 0 HD2 LYS A 102 35.271 35.233 -37.123 1.00 42.35 H new ATOM 0 HD3 LYS A 102 34.417 36.037 -35.822 1.00 42.35 H new ATOM 0 HE2 LYS A 102 33.139 34.035 -37.723 1.00 32.33 H new ATOM 0 HE3 LYS A 102 33.780 33.622 -36.144 1.00 32.33 H new ATOM 0 HZ1 LYS A 102 31.270 34.236 -36.483 1.00 73.14 H new ATOM 0 HZ2 LYS A 102 32.095 34.684 -35.068 1.00 73.14 H new ATOM 0 HZ3 LYS A 102 31.845 35.823 -36.302 1.00 73.14 H new ATOM 1530 N THR A 103 35.804 40.583 -36.636 1.00 32.11 N ATOM 1531 CA THR A 103 36.890 41.490 -36.316 1.00 65.25 C ATOM 1532 C THR A 103 36.330 42.836 -35.874 1.00 51.12 C ATOM 1533 O THR A 103 36.870 43.495 -34.984 1.00 72.12 O ATOM 1534 CB THR A 103 37.834 41.685 -37.522 1.00 3.51 C ATOM 1535 OG1 THR A 103 37.091 42.069 -38.692 1.00 71.14 O ATOM 1536 CG2 THR A 103 38.611 40.408 -37.809 1.00 15.44 C ATOM 0 H THR A 103 35.261 40.855 -37.455 1.00 32.11 H new ATOM 0 HA THR A 103 37.467 41.050 -35.503 1.00 65.25 H new ATOM 0 HB THR A 103 38.537 42.479 -37.271 1.00 3.51 H new ATOM 0 HG1 THR A 103 36.137 42.119 -38.472 1.00 71.14 H new ATOM 0 HG21 THR A 103 39.270 40.567 -38.662 1.00 15.44 H new ATOM 0 HG22 THR A 103 39.206 40.140 -36.936 1.00 15.44 H new ATOM 0 HG23 THR A 103 37.914 39.601 -38.035 1.00 15.44 H new ATOM 1544 N GLY A 104 35.225 43.226 -36.496 1.00 65.24 N ATOM 1545 CA GLY A 104 34.562 44.462 -36.149 1.00 42.41 C ATOM 1546 C GLY A 104 35.044 45.621 -36.982 1.00 24.42 C ATOM 1547 O GLY A 104 35.891 46.407 -36.554 1.00 13.23 O ATOM 0 H GLY A 104 34.774 42.699 -37.243 1.00 65.24 H new ATOM 0 HA2 GLY A 104 33.486 44.345 -36.281 1.00 42.41 H new ATOM 0 HA3 GLY A 104 34.732 44.680 -35.095 1.00 42.41 H new ATOM 1551 N GLN A 105 34.502 45.716 -38.180 1.00 51.35 N ATOM 1552 CA GLN A 105 34.837 46.773 -39.111 1.00 72.04 C ATOM 1553 C GLN A 105 33.565 47.280 -39.773 1.00 12.40 C ATOM 1554 O GLN A 105 32.670 46.491 -40.082 1.00 64.30 O ATOM 1555 CB GLN A 105 35.818 46.264 -40.173 1.00 71.44 C ATOM 1556 CG GLN A 105 37.198 45.928 -39.624 1.00 11.23 C ATOM 1557 CD GLN A 105 38.098 45.283 -40.658 1.00 44.43 C ATOM 1558 OE1 GLN A 105 38.805 45.963 -41.402 1.00 42.45 O ATOM 1559 NE2 GLN A 105 38.099 43.960 -40.698 1.00 23.32 N ATOM 0 H GLN A 105 33.811 45.056 -38.537 1.00 51.35 H new ATOM 0 HA GLN A 105 35.315 47.588 -38.568 1.00 72.04 H new ATOM 0 HB2 GLN A 105 35.399 45.376 -40.645 1.00 71.44 H new ATOM 0 HB3 GLN A 105 35.921 47.020 -40.951 1.00 71.44 H new ATOM 0 HG2 GLN A 105 37.670 46.839 -39.256 1.00 11.23 H new ATOM 0 HG3 GLN A 105 37.092 45.257 -38.772 1.00 11.23 H new ATOM 0 HE21 GLN A 105 37.499 43.430 -40.065 1.00 23.32 H new ATOM 0 HE22 GLN A 105 38.700 43.470 -41.361 1.00 23.32 H new ATOM 1568 N THR A 106 33.471 48.587 -39.957 1.00 25.35 N ATOM 1569 CA THR A 106 32.304 49.183 -40.585 1.00 43.25 C ATOM 1570 C THR A 106 32.421 49.147 -42.112 1.00 44.11 C ATOM 1571 O THR A 106 33.057 50.004 -42.732 1.00 33.22 O ATOM 1572 CB THR A 106 32.065 50.634 -40.083 1.00 61.32 C ATOM 1573 OG1 THR A 106 30.998 51.250 -40.814 1.00 1.35 O ATOM 1574 CG2 THR A 106 33.322 51.490 -40.197 1.00 5.13 C ATOM 0 H THR A 106 34.190 49.256 -39.680 1.00 25.35 H new ATOM 0 HA THR A 106 31.438 48.586 -40.297 1.00 43.25 H new ATOM 0 HB THR A 106 31.794 50.567 -39.029 1.00 61.32 H new ATOM 0 HG1 THR A 106 30.860 52.162 -40.484 1.00 1.35 H new ATOM 0 HG21 THR A 106 33.111 52.496 -39.836 1.00 5.13 H new ATOM 0 HG22 THR A 106 34.118 51.049 -39.598 1.00 5.13 H new ATOM 0 HG23 THR A 106 33.637 51.538 -41.240 1.00 5.13 H new ATOM 1582 N SER A 107 31.832 48.125 -42.712 1.00 30.10 N ATOM 1583 CA SER A 107 31.796 48.008 -44.158 1.00 71.15 C ATOM 1584 C SER A 107 30.630 48.813 -44.715 1.00 42.21 C ATOM 1585 O SER A 107 29.476 48.395 -44.622 1.00 53.14 O ATOM 1586 CB SER A 107 31.676 46.539 -44.573 1.00 62.32 C ATOM 1587 OG SER A 107 32.786 45.785 -44.111 1.00 35.01 O ATOM 0 H SER A 107 31.371 47.362 -42.216 1.00 30.10 H new ATOM 0 HA SER A 107 32.726 48.405 -44.566 1.00 71.15 H new ATOM 0 HB2 SER A 107 30.754 46.119 -44.171 1.00 62.32 H new ATOM 0 HB3 SER A 107 31.611 46.469 -45.659 1.00 62.32 H new ATOM 0 HG SER A 107 32.684 44.850 -44.388 1.00 35.01 H new ATOM 1593 N THR A 108 30.932 49.975 -45.268 1.00 61.34 N ATOM 1594 CA THR A 108 29.908 50.839 -45.817 1.00 45.01 C ATOM 1595 C THR A 108 29.701 50.560 -47.303 1.00 51.14 C ATOM 1596 O THR A 108 30.577 50.838 -48.123 1.00 24.12 O ATOM 1597 CB THR A 108 30.281 52.320 -45.622 1.00 51.54 C ATOM 1598 OG1 THR A 108 30.631 52.551 -44.250 1.00 42.23 O ATOM 1599 CG2 THR A 108 29.126 53.229 -46.012 1.00 12.31 C ATOM 0 H THR A 108 31.881 50.340 -45.348 1.00 61.34 H new ATOM 0 HA THR A 108 28.980 50.631 -45.284 1.00 45.01 H new ATOM 0 HB THR A 108 31.131 52.548 -46.265 1.00 51.54 H new ATOM 0 HG1 THR A 108 29.815 52.662 -43.719 1.00 42.23 H new ATOM 0 HG21 THR A 108 29.416 54.269 -45.865 1.00 12.31 H new ATOM 0 HG22 THR A 108 28.874 53.068 -47.060 1.00 12.31 H new ATOM 0 HG23 THR A 108 28.259 53.003 -45.391 1.00 12.31 H new ATOM 1607 N ILE A 109 28.561 49.977 -47.639 1.00 13.34 N ATOM 1608 CA ILE A 109 28.205 49.741 -49.029 1.00 55.11 C ATOM 1609 C ILE A 109 26.945 50.523 -49.383 1.00 14.15 C ATOM 1610 O ILE A 109 25.832 50.099 -49.080 1.00 1.14 O ATOM 1611 CB ILE A 109 27.976 48.239 -49.346 1.00 61.20 C ATOM 1612 CG1 ILE A 109 29.229 47.402 -49.064 1.00 73.01 C ATOM 1613 CG2 ILE A 109 27.558 48.056 -50.797 1.00 4.42 C ATOM 1614 CD1 ILE A 109 29.380 46.966 -47.621 1.00 12.41 C ATOM 0 H ILE A 109 27.865 49.658 -46.966 1.00 13.34 H new ATOM 0 HA ILE A 109 29.049 50.080 -49.630 1.00 55.11 H new ATOM 0 HB ILE A 109 27.177 47.890 -48.691 1.00 61.20 H new ATOM 0 HG12 ILE A 109 29.209 46.516 -49.698 1.00 73.01 H new ATOM 0 HG13 ILE A 109 30.108 47.979 -49.350 1.00 73.01 H new ATOM 0 HG21 ILE A 109 27.402 46.996 -51.000 1.00 4.42 H new ATOM 0 HG22 ILE A 109 26.632 48.601 -50.980 1.00 4.42 H new ATOM 0 HG23 ILE A 109 28.340 48.440 -51.452 1.00 4.42 H new ATOM 0 HD11 ILE A 109 30.292 46.379 -47.512 1.00 12.41 H new ATOM 0 HD12 ILE A 109 29.435 47.845 -46.979 1.00 12.41 H new ATOM 0 HD13 ILE A 109 28.522 46.359 -47.333 1.00 12.41 H new ATOM 1626 N GLN A 110 27.123 51.680 -49.995 1.00 42.43 N ATOM 1627 CA GLN A 110 25.992 52.490 -50.413 1.00 3.53 C ATOM 1628 C GLN A 110 25.325 51.897 -51.643 1.00 10.22 C ATOM 1629 O GLN A 110 25.960 51.180 -52.423 1.00 61.10 O ATOM 1630 CB GLN A 110 26.421 53.929 -50.691 1.00 51.25 C ATOM 1631 CG GLN A 110 26.443 54.787 -49.441 1.00 2.41 C ATOM 1632 CD GLN A 110 26.943 56.192 -49.705 1.00 4.14 C ATOM 1633 OE1 GLN A 110 26.164 57.095 -50.009 1.00 23.33 O ATOM 1634 NE2 GLN A 110 28.246 56.382 -49.597 1.00 32.10 N ATOM 0 H GLN A 110 28.036 52.079 -50.213 1.00 42.43 H new ATOM 0 HA GLN A 110 25.271 52.496 -49.596 1.00 3.53 H new ATOM 0 HB2 GLN A 110 27.413 53.927 -51.142 1.00 51.25 H new ATOM 0 HB3 GLN A 110 25.741 54.372 -51.418 1.00 51.25 H new ATOM 0 HG2 GLN A 110 25.438 54.836 -49.021 1.00 2.41 H new ATOM 0 HG3 GLN A 110 27.078 54.314 -48.692 1.00 2.41 H new ATOM 0 HE21 GLN A 110 28.855 55.605 -49.342 1.00 32.10 H new ATOM 0 HE22 GLN A 110 28.643 57.306 -49.768 1.00 32.10 H new ATOM 1643 N VAL A 111 24.041 52.179 -51.789 1.00 22.34 N ATOM 1644 CA VAL A 111 23.279 51.735 -52.940 1.00 74.24 C ATOM 1645 C VAL A 111 23.896 52.274 -54.229 1.00 21.00 C ATOM 1646 O VAL A 111 24.235 53.459 -54.324 1.00 75.11 O ATOM 1647 CB VAL A 111 21.799 52.173 -52.833 1.00 73.33 C ATOM 1648 CG1 VAL A 111 21.679 53.690 -52.750 1.00 13.23 C ATOM 1649 CG2 VAL A 111 20.988 51.636 -53.998 1.00 44.35 C ATOM 0 H VAL A 111 23.501 52.720 -51.114 1.00 22.34 H new ATOM 0 HA VAL A 111 23.310 50.646 -52.962 1.00 74.24 H new ATOM 0 HB VAL A 111 21.395 51.751 -51.913 1.00 73.33 H new ATOM 0 HG11 VAL A 111 20.628 53.968 -52.676 1.00 13.23 H new ATOM 0 HG12 VAL A 111 22.213 54.050 -51.870 1.00 13.23 H new ATOM 0 HG13 VAL A 111 22.111 54.139 -53.645 1.00 13.23 H new ATOM 0 HG21 VAL A 111 19.951 51.958 -53.899 1.00 44.35 H new ATOM 0 HG22 VAL A 111 21.398 52.017 -54.933 1.00 44.35 H new ATOM 0 HG23 VAL A 111 21.031 50.547 -54.000 1.00 44.35 H new ATOM 1659 N SER A 112 24.067 51.401 -55.204 1.00 13.43 N ATOM 1660 CA SER A 112 24.624 51.804 -56.477 1.00 25.44 C ATOM 1661 C SER A 112 23.524 52.405 -57.344 1.00 41.43 C ATOM 1662 O SER A 112 22.821 51.693 -58.065 1.00 54.32 O ATOM 1663 CB SER A 112 25.277 50.615 -57.185 1.00 73.52 C ATOM 1664 OG SER A 112 26.401 51.031 -57.944 1.00 50.04 O ATOM 0 H SER A 112 23.828 50.412 -55.137 1.00 13.43 H new ATOM 0 HA SER A 112 25.396 52.554 -56.305 1.00 25.44 H new ATOM 0 HB2 SER A 112 25.585 49.873 -56.448 1.00 73.52 H new ATOM 0 HB3 SER A 112 24.550 50.132 -57.839 1.00 73.52 H new ATOM 0 HG SER A 112 26.803 50.254 -58.386 1.00 50.04 H new ATOM 1670 N GLY A 113 23.360 53.719 -57.247 1.00 3.12 N ATOM 1671 CA GLY A 113 22.326 54.406 -58.003 1.00 51.54 C ATOM 1672 C GLY A 113 22.715 54.625 -59.452 1.00 51.43 C ATOM 1673 O GLY A 113 22.570 55.725 -59.986 1.00 53.21 O ATOM 0 H GLY A 113 23.928 54.325 -56.655 1.00 3.12 H new ATOM 0 HA2 GLY A 113 21.404 53.826 -57.961 1.00 51.54 H new ATOM 0 HA3 GLY A 113 22.118 55.369 -57.536 1.00 51.54 H new ATOM 1677 N LEU A 114 23.203 53.572 -60.087 1.00 24.32 N ATOM 1678 CA LEU A 114 23.639 53.642 -61.470 1.00 41.32 C ATOM 1679 C LEU A 114 22.905 52.602 -62.309 1.00 21.34 C ATOM 1680 O LEU A 114 23.393 51.493 -62.511 1.00 34.33 O ATOM 1681 CB LEU A 114 25.154 53.431 -61.565 1.00 64.43 C ATOM 1682 CG LEU A 114 26.005 54.490 -60.863 1.00 3.52 C ATOM 1683 CD1 LEU A 114 27.473 54.110 -60.912 1.00 71.24 C ATOM 1684 CD2 LEU A 114 25.791 55.851 -61.503 1.00 25.04 C ATOM 0 H LEU A 114 23.307 52.651 -59.661 1.00 24.32 H new ATOM 0 HA LEU A 114 23.403 54.633 -61.858 1.00 41.32 H new ATOM 0 HB2 LEU A 114 25.396 52.456 -61.143 1.00 64.43 H new ATOM 0 HB3 LEU A 114 25.435 53.401 -62.618 1.00 64.43 H new ATOM 0 HG LEU A 114 25.696 54.544 -59.819 1.00 3.52 H new ATOM 0 HD11 LEU A 114 28.064 54.875 -60.408 1.00 71.24 H new ATOM 0 HD12 LEU A 114 27.618 53.152 -60.413 1.00 71.24 H new ATOM 0 HD13 LEU A 114 27.794 54.030 -61.951 1.00 71.24 H new ATOM 0 HD21 LEU A 114 26.404 56.594 -60.992 1.00 25.04 H new ATOM 0 HD22 LEU A 114 26.075 55.807 -62.554 1.00 25.04 H new ATOM 0 HD23 LEU A 114 24.740 56.130 -61.422 1.00 25.04 H new ATOM 1696 N GLN A 115 21.705 52.953 -62.744 1.00 45.34 N ATOM 1697 CA GLN A 115 20.927 52.091 -63.625 1.00 40.42 C ATOM 1698 C GLN A 115 20.411 52.888 -64.817 1.00 4.04 C ATOM 1699 O GLN A 115 20.190 52.327 -65.890 1.00 53.53 O ATOM 1700 CB GLN A 115 19.762 51.441 -62.866 1.00 34.14 C ATOM 1701 CG GLN A 115 18.901 52.422 -62.081 1.00 25.34 C ATOM 1702 CD GLN A 115 17.725 51.753 -61.390 1.00 62.34 C ATOM 1703 OE1 GLN A 115 16.682 52.370 -61.175 1.00 30.31 O ATOM 1704 NE2 GLN A 115 17.876 50.483 -61.039 1.00 61.02 N ATOM 0 H GLN A 115 21.246 53.831 -62.501 1.00 45.34 H new ATOM 0 HA GLN A 115 21.576 51.295 -63.990 1.00 40.42 H new ATOM 0 HB2 GLN A 115 19.130 50.911 -63.579 1.00 34.14 H new ATOM 0 HB3 GLN A 115 20.162 50.696 -62.178 1.00 34.14 H new ATOM 0 HG2 GLN A 115 19.518 52.923 -61.335 1.00 25.34 H new ATOM 0 HG3 GLN A 115 18.529 53.193 -62.756 1.00 25.34 H new ATOM 0 HE21 GLN A 115 18.754 50.001 -61.232 1.00 61.02 H new ATOM 0 HE22 GLN A 115 17.114 49.988 -60.576 1.00 61.02 H new ATOM 1713 N ASN A 116 20.236 54.201 -64.597 1.00 43.54 N ATOM 1714 CA ASN A 116 19.802 55.172 -65.620 1.00 10.42 C ATOM 1715 C ASN A 116 18.548 54.729 -66.384 1.00 30.14 C ATOM 1716 O ASN A 116 17.977 53.667 -66.124 1.00 42.14 O ATOM 1717 CB ASN A 116 20.947 55.522 -66.599 1.00 13.45 C ATOM 1718 CG ASN A 116 21.327 54.406 -67.563 1.00 41.32 C ATOM 1719 OD1 ASN A 116 22.225 53.609 -67.288 1.00 22.52 O ATOM 1720 ND2 ASN A 116 20.662 54.353 -68.707 1.00 63.44 N ATOM 0 H ASN A 116 20.395 54.628 -63.685 1.00 43.54 H new ATOM 0 HA ASN A 116 19.531 56.074 -65.072 1.00 10.42 H new ATOM 0 HB2 ASN A 116 20.656 56.399 -67.177 1.00 13.45 H new ATOM 0 HB3 ASN A 116 21.828 55.799 -66.021 1.00 13.45 H new ATOM 0 HD21 ASN A 116 20.888 53.635 -69.395 1.00 63.44 H new ATOM 0 HD22 ASN A 116 19.924 55.030 -68.900 1.00 63.44 H new ATOM 1727 N ASN A 117 18.091 55.571 -67.305 1.00 33.24 N ATOM 1728 CA ASN A 117 16.913 55.252 -68.103 1.00 2.33 C ATOM 1729 C ASN A 117 16.806 56.175 -69.308 1.00 51.41 C ATOM 1730 O ASN A 117 16.771 57.399 -69.176 1.00 1.42 O ATOM 1731 CB ASN A 117 15.635 55.345 -67.257 1.00 61.13 C ATOM 1732 CG ASN A 117 14.426 54.711 -67.936 1.00 30.42 C ATOM 1733 OD1 ASN A 117 14.313 54.690 -69.164 1.00 34.24 O ATOM 1734 ND2 ASN A 117 13.516 54.171 -67.140 1.00 5.04 N ATOM 0 H ASN A 117 18.515 56.474 -67.516 1.00 33.24 H new ATOM 0 HA ASN A 117 17.023 54.227 -68.457 1.00 2.33 H new ATOM 0 HB2 ASN A 117 15.804 54.856 -66.298 1.00 61.13 H new ATOM 0 HB3 ASN A 117 15.420 56.393 -67.047 1.00 61.13 H new ATOM 0 HD21 ASN A 117 12.692 53.721 -67.539 1.00 5.04 H new ATOM 0 HD22 ASN A 117 13.639 54.205 -66.128 1.00 5.04 H new ATOM 1741 N SER A 118 16.796 55.575 -70.480 1.00 14.15 N ATOM 1742 CA SER A 118 16.540 56.286 -71.714 1.00 75.22 C ATOM 1743 C SER A 118 15.735 55.384 -72.639 1.00 42.11 C ATOM 1744 O SER A 118 16.294 54.569 -73.374 1.00 3.43 O ATOM 1745 CB SER A 118 17.850 56.722 -72.374 1.00 22.31 C ATOM 1746 OG SER A 118 18.587 57.569 -71.506 1.00 43.44 O ATOM 0 H SER A 118 16.966 54.577 -70.603 1.00 14.15 H new ATOM 0 HA SER A 118 15.969 57.190 -71.503 1.00 75.22 H new ATOM 0 HB2 SER A 118 18.446 55.845 -72.628 1.00 22.31 H new ATOM 0 HB3 SER A 118 17.638 57.244 -73.307 1.00 22.31 H new ATOM 0 HG SER A 118 19.422 57.837 -71.942 1.00 43.44 H new ATOM 1752 N THR A 119 14.419 55.497 -72.554 1.00 1.13 N ATOM 1753 CA THR A 119 13.530 54.612 -73.283 1.00 11.34 C ATOM 1754 C THR A 119 12.628 55.398 -74.224 1.00 73.20 C ATOM 1755 O THR A 119 11.611 55.953 -73.810 1.00 53.00 O ATOM 1756 CB THR A 119 12.664 53.790 -72.312 1.00 14.15 C ATOM 1757 OG1 THR A 119 13.494 53.205 -71.297 1.00 61.21 O ATOM 1758 CG2 THR A 119 11.912 52.691 -73.047 1.00 31.13 C ATOM 0 H THR A 119 13.943 56.197 -71.984 1.00 1.13 H new ATOM 0 HA THR A 119 14.150 53.935 -73.871 1.00 11.34 H new ATOM 0 HB THR A 119 11.937 54.460 -71.854 1.00 14.15 H new ATOM 0 HG1 THR A 119 13.707 53.880 -70.619 1.00 61.21 H new ATOM 0 HG21 THR A 119 11.308 52.126 -72.337 1.00 31.13 H new ATOM 0 HG22 THR A 119 11.263 53.136 -73.802 1.00 31.13 H new ATOM 0 HG23 THR A 119 12.625 52.023 -73.530 1.00 31.13 H new ATOM 1766 N ASP A 120 13.016 55.462 -75.487 1.00 14.24 N ATOM 1767 CA ASP A 120 12.213 56.143 -76.490 1.00 62.41 C ATOM 1768 C ASP A 120 12.411 55.523 -77.865 1.00 11.22 C ATOM 1769 O ASP A 120 13.450 55.709 -78.500 1.00 34.13 O ATOM 1770 CB ASP A 120 12.551 57.635 -76.543 1.00 21.11 C ATOM 1771 CG ASP A 120 11.764 58.367 -77.615 1.00 5.01 C ATOM 1772 OD1 ASP A 120 10.565 58.640 -77.401 1.00 42.22 O ATOM 1773 OD2 ASP A 120 12.342 58.686 -78.673 1.00 22.14 O1- ATOM 0 H ASP A 120 13.880 55.052 -75.842 1.00 14.24 H new ATOM 0 HA ASP A 120 11.168 56.029 -76.202 1.00 62.41 H new ATOM 0 HB2 ASP A 120 12.345 58.086 -75.572 1.00 21.11 H new ATOM 0 HB3 ASP A 120 13.618 57.757 -76.732 1.00 21.11 H new ATOM 1778 N PHE A 121 11.425 54.757 -78.300 1.00 13.21 N ATOM 1779 CA PHE A 121 11.396 54.246 -79.659 1.00 25.12 C ATOM 1780 C PHE A 121 9.961 54.267 -80.165 1.00 43.12 C ATOM 1781 O PHE A 121 9.170 53.372 -79.871 1.00 24.43 O ATOM 1782 CB PHE A 121 11.977 52.832 -79.733 1.00 11.52 C ATOM 1783 CG PHE A 121 12.165 52.347 -81.141 1.00 23.13 C ATOM 1784 CD1 PHE A 121 11.332 51.381 -81.676 1.00 75.24 C ATOM 1785 CD2 PHE A 121 13.168 52.875 -81.936 1.00 41.35 C ATOM 1786 CE1 PHE A 121 11.495 50.950 -82.976 1.00 60.15 C ATOM 1787 CE2 PHE A 121 13.337 52.445 -83.238 1.00 43.42 C ATOM 1788 CZ PHE A 121 12.498 51.481 -83.757 1.00 30.42 C ATOM 0 H PHE A 121 10.630 54.474 -77.727 1.00 13.21 H new ATOM 0 HA PHE A 121 12.015 54.882 -80.291 1.00 25.12 H new ATOM 0 HB2 PHE A 121 12.937 52.812 -79.217 1.00 11.52 H new ATOM 0 HB3 PHE A 121 11.316 52.146 -79.204 1.00 11.52 H new ATOM 0 HD1 PHE A 121 10.545 50.959 -81.069 1.00 75.24 H new ATOM 0 HD2 PHE A 121 13.826 53.631 -81.534 1.00 41.35 H new ATOM 0 HE1 PHE A 121 10.836 50.196 -83.382 1.00 60.15 H new ATOM 0 HE2 PHE A 121 14.124 52.863 -83.848 1.00 43.42 H new ATOM 0 HZ PHE A 121 12.627 51.143 -84.775 1.00 30.42 H new ATOM 1798 N HIS A 122 9.632 55.305 -80.912 1.00 74.33 N ATOM 1799 CA HIS A 122 8.259 55.563 -81.312 1.00 33.51 C ATOM 1800 C HIS A 122 7.813 54.631 -82.437 1.00 61.51 C ATOM 1801 O HIS A 122 8.217 54.796 -83.588 1.00 44.21 O ATOM 1802 CB HIS A 122 8.122 57.023 -81.759 1.00 14.54 C ATOM 1803 CG HIS A 122 6.723 57.553 -81.719 1.00 14.41 C ATOM 1804 ND1 HIS A 122 6.380 58.681 -81.011 1.00 72.31 N ATOM 1805 CD2 HIS A 122 5.587 57.122 -82.313 1.00 55.51 C ATOM 1806 CE1 HIS A 122 5.095 58.925 -81.170 1.00 74.34 C ATOM 1807 NE2 HIS A 122 4.588 57.993 -81.957 1.00 72.12 N ATOM 0 H HIS A 122 10.304 55.990 -81.257 1.00 74.33 H new ATOM 0 HA HIS A 122 7.616 55.375 -80.452 1.00 33.51 H new ATOM 0 HB2 HIS A 122 8.752 57.645 -81.123 1.00 14.54 H new ATOM 0 HB3 HIS A 122 8.504 57.116 -82.776 1.00 14.54 H new ATOM 0 HD2 HIS A 122 5.485 56.255 -82.949 1.00 55.51 H new ATOM 0 HE1 HIS A 122 4.549 59.747 -80.731 1.00 74.34 H new ATOM 0 HE2 HIS A 122 3.614 57.931 -82.252 1.00 72.12 H new ATOM 1816 N HIS A 123 6.983 53.652 -82.098 1.00 41.22 N ATOM 1817 CA HIS A 123 6.344 52.814 -83.103 1.00 40.20 C ATOM 1818 C HIS A 123 5.156 53.569 -83.682 1.00 14.21 C ATOM 1819 O HIS A 123 4.177 53.819 -82.981 1.00 55.44 O ATOM 1820 CB HIS A 123 5.864 51.482 -82.505 1.00 64.15 C ATOM 1821 CG HIS A 123 6.953 50.649 -81.899 1.00 33.35 C ATOM 1822 ND1 HIS A 123 6.919 50.209 -80.595 1.00 51.31 N ATOM 1823 CD2 HIS A 123 8.101 50.160 -82.427 1.00 23.32 C ATOM 1824 CE1 HIS A 123 7.996 49.491 -80.344 1.00 62.03 C ATOM 1825 NE2 HIS A 123 8.728 49.445 -81.437 1.00 11.12 N ATOM 0 H HIS A 123 6.737 53.420 -81.136 1.00 41.22 H new ATOM 0 HA HIS A 123 7.072 52.586 -83.881 1.00 40.20 H new ATOM 0 HB2 HIS A 123 5.114 51.689 -81.742 1.00 64.15 H new ATOM 0 HB3 HIS A 123 5.372 50.903 -83.286 1.00 64.15 H new ATOM 0 HD2 HIS A 123 8.456 50.305 -83.437 1.00 23.32 H new ATOM 0 HE1 HIS A 123 8.237 49.021 -79.402 1.00 62.03 H new ATOM 0 HE2 HIS A 123 9.618 48.956 -81.533 1.00 11.12 H new ATOM 1834 N HIS A 124 5.246 53.955 -84.945 1.00 75.21 N ATOM 1835 CA HIS A 124 4.183 54.747 -85.562 1.00 61.31 C ATOM 1836 C HIS A 124 3.733 54.143 -86.888 1.00 45.43 C ATOM 1837 O HIS A 124 2.609 54.381 -87.329 1.00 72.22 O ATOM 1838 CB HIS A 124 4.623 56.209 -85.758 1.00 55.11 C ATOM 1839 CG HIS A 124 5.721 56.412 -86.761 1.00 30.43 C ATOM 1840 ND1 HIS A 124 5.535 57.077 -87.953 1.00 72.32 N ATOM 1841 CD2 HIS A 124 7.026 56.055 -86.736 1.00 11.23 C ATOM 1842 CE1 HIS A 124 6.674 57.118 -88.615 1.00 60.11 C ATOM 1843 NE2 HIS A 124 7.596 56.507 -87.899 1.00 42.31 N ATOM 0 H HIS A 124 6.031 53.739 -85.559 1.00 75.21 H new ATOM 0 HA HIS A 124 3.332 54.733 -84.881 1.00 61.31 H new ATOM 0 HB2 HIS A 124 3.757 56.795 -86.066 1.00 55.11 H new ATOM 0 HB3 HIS A 124 4.951 56.606 -84.797 1.00 55.11 H new ATOM 0 HD2 HIS A 124 7.526 55.514 -85.946 1.00 11.23 H new ATOM 0 HE1 HIS A 124 6.826 57.575 -89.582 1.00 60.11 H new ATOM 0 HE2 HIS A 124 8.573 56.389 -88.166 1.00 42.31 H new ATOM 1852 N HIS A 125 4.617 53.357 -87.507 1.00 33.11 N ATOM 1853 CA HIS A 125 4.352 52.732 -88.809 1.00 42.42 C ATOM 1854 C HIS A 125 4.249 53.781 -89.911 1.00 12.25 C ATOM 1855 O HIS A 125 4.187 54.986 -89.649 1.00 65.23 O ATOM 1856 CB HIS A 125 3.058 51.897 -88.788 1.00 11.44 C ATOM 1857 CG HIS A 125 3.040 50.798 -87.772 1.00 60.43 C ATOM 1858 ND1 HIS A 125 1.951 50.537 -86.971 1.00 71.41 N ATOM 1859 CD2 HIS A 125 3.977 49.881 -87.439 1.00 3.32 C ATOM 1860 CE1 HIS A 125 2.219 49.511 -86.186 1.00 54.41 C ATOM 1861 NE2 HIS A 125 3.443 49.096 -86.450 1.00 54.24 N ATOM 0 H HIS A 125 5.535 53.135 -87.122 1.00 33.11 H new ATOM 0 HA HIS A 125 5.194 52.071 -89.015 1.00 42.42 H new ATOM 0 HB2 HIS A 125 2.215 52.562 -88.599 1.00 11.44 H new ATOM 0 HB3 HIS A 125 2.906 51.463 -89.776 1.00 11.44 H new ATOM 0 HD2 HIS A 125 4.962 49.785 -87.872 1.00 3.32 H new ATOM 0 HE1 HIS A 125 1.551 49.084 -85.453 1.00 54.41 H new ATOM 0 HE2 HIS A 125 3.916 48.317 -85.992 1.00 54.24 H new ATOM 1870 N HIS A 126 4.245 53.321 -91.149 1.00 22.41 N ATOM 1871 CA HIS A 126 3.987 54.197 -92.280 1.00 73.13 C ATOM 1872 C HIS A 126 2.808 53.650 -93.070 1.00 14.44 C ATOM 1873 O HIS A 126 2.686 52.433 -93.232 1.00 61.23 O ATOM 1874 CB HIS A 126 5.232 54.351 -93.178 1.00 23.41 C ATOM 1875 CG HIS A 126 5.537 53.175 -94.063 1.00 43.53 C ATOM 1876 ND1 HIS A 126 5.153 53.114 -95.388 1.00 63.22 N ATOM 1877 CD2 HIS A 126 6.203 52.022 -93.817 1.00 54.42 C ATOM 1878 CE1 HIS A 126 5.568 51.979 -95.914 1.00 42.22 C ATOM 1879 NE2 HIS A 126 6.206 51.299 -94.985 1.00 15.42 N ATOM 0 H HIS A 126 4.417 52.347 -91.398 1.00 22.41 H new ATOM 0 HA HIS A 126 3.745 55.192 -91.907 1.00 73.13 H new ATOM 0 HB2 HIS A 126 5.100 55.232 -93.806 1.00 23.41 H new ATOM 0 HB3 HIS A 126 6.097 54.540 -92.542 1.00 23.41 H new ATOM 0 HD2 HIS A 126 6.648 51.726 -92.879 1.00 54.42 H new ATOM 0 HE1 HIS A 126 5.411 51.661 -96.934 1.00 42.22 H new ATOM 0 HE2 HIS A 126 6.634 50.382 -95.112 1.00 15.42 H new ATOM 1888 N HIS A 127 1.945 54.548 -93.533 1.00 12.35 N ATOM 1889 CA HIS A 127 0.741 54.172 -94.279 1.00 31.34 C ATOM 1890 C HIS A 127 -0.220 53.390 -93.384 1.00 12.31 C ATOM 1891 O HIS A 127 -0.122 52.148 -93.331 1.00 54.42 O ATOM 1892 CB HIS A 127 1.105 53.355 -95.531 1.00 12.42 C ATOM 1893 CG HIS A 127 -0.064 52.996 -96.396 1.00 22.42 C ATOM 1894 ND1 HIS A 127 -0.589 51.726 -96.460 1.00 5.05 N ATOM 1895 CD2 HIS A 127 -0.795 53.745 -97.252 1.00 4.12 C ATOM 1896 CE1 HIS A 127 -1.590 51.708 -97.317 1.00 42.13 C ATOM 1897 NE2 HIS A 127 -1.737 52.919 -97.815 1.00 54.43 N ATOM 1898 OXT HIS A 127 -1.067 54.025 -92.723 1.00 0.00 O1- ATOM 0 H HIS A 127 2.056 55.554 -93.405 1.00 12.35 H new ATOM 0 HA HIS A 127 0.242 55.085 -94.605 1.00 31.34 H new ATOM 0 HB2 HIS A 127 1.821 53.923 -96.125 1.00 12.42 H new ATOM 0 HB3 HIS A 127 1.606 52.439 -95.219 1.00 12.42 H new ATOM 0 HD2 HIS A 127 -0.663 54.797 -97.455 1.00 4.12 H new ATOM 0 HE1 HIS A 127 -2.189 50.845 -97.569 1.00 42.13 H new ATOM 0 HE2 HIS A 127 -2.435 53.197 -98.505 1.00 54.43 H new TER 1907 HIS A 127