USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1069 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 89 LYS NZ :NH3+ 140:sc= -1.47 (180deg=-0.973) USER MOD Set 1.2: A 91 GLN : amide:sc= -1.44 K(o=-2.9,f=-1) USER MOD Set 2.1: A 78 SER OG : rot -103:sc= -0.948 USER MOD Set 2.2: A 80 TYR OH : rot 30:sc= 0 USER MOD Set 3.1: A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 61 GLN : amide:sc= -0.943 X(o=-0.94,f=-1.3) USER MOD Set 4.1: A 34 ASN : amide:sc= 0.0132 K(o=0.24,f=-6.2!) USER MOD Set 4.2: A 35 SER OG : rot 58:sc= 0.226 USER MOD Set 5.1: A 12 SER OG : rot 21:sc= -0.937 USER MOD Set 5.2: A 21 MET CE :methyl -155:sc= -0.195 (180deg=-1.23) USER MOD Single : A 1 ALA N :NH3+ 135:sc= 0.0863 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot -130:sc= 0 USER MOD Single : A 6 THR OG1 : rot 85:sc= -2.27 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.0311 K(o=-0.031,f=-0.78) USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 17 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.25) USER MOD Single : A 18 MET CE :methyl -155:sc= -0.24 (180deg=-1.33) USER MOD Single : A 19 ASN : amide:sc= -2.96! C(o=-3!,f=-12!) USER MOD Single : A 20 LYS NZ :NH3+ 164:sc=-0.00711 (180deg=-0.193) USER MOD Single : A 25 ASN : amide:sc= -1.98 K(o=-2,f=-11!) USER MOD Single : A 27 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0255) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= -1.1 USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.224 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 130:sc= -0.795 USER MOD Single : A 48 LYS NZ :NH3+ -138:sc= -1.75 (180deg=-3.77!) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0.00138 USER MOD Single : A 54 SER OG : rot -44:sc= 0.829 USER MOD Single : A 57 TYR OH : rot 165:sc= -0.886 USER MOD Single : A 58 ASN : amide:sc= -0.223 X(o=-0.22,f=0) USER MOD Single : A 60 ASN : amide:sc= -4.41 K(o=-4.4,f=-5.8!) USER MOD Single : A 62 TYR OH : rot -29:sc= 1.93 USER MOD Single : A 63 TYR OH : rot -163:sc= -0.263! USER MOD Single : A 66 THR OG1 : rot 30:sc= 0.214 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 HIS : no HD1:sc=-0.00422 X(o=-0.0042,f=-0.0042) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=-0.033) USER MOD Single : A 116 ASN : amide:sc= -0.276 X(o=-0.28,f=-0.028) USER MOD Single : A 118 MET CE :methyl 141:sc= -0.15 (180deg=-1.03) USER MOD Single : A 120 ASN : amide:sc= -0.645 K(o=-0.64,f=-5.5!) USER MOD Single : A 126 SER OG : rot 180:sc= -0.803 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= -0.319 X(o=-0.32,f=-0.011) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 56:sc= 1.2 USER MOD Single : A 139 THR OG1 : rot 180:sc= -0.818 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 116.636 -24.878 8.841 1.00 0.00 N ATOM 2 CA ALA A 1 116.021 -23.591 8.408 1.00 0.00 C ATOM 3 C ALA A 1 116.885 -22.956 7.324 1.00 0.00 C ATOM 4 O ALA A 1 118.095 -23.173 7.275 1.00 0.00 O ATOM 5 CB ALA A 1 115.915 -22.650 9.610 1.00 0.00 C ATOM 0 H1 ALA A 1 116.624 -24.936 9.879 1.00 0.00 H new ATOM 0 H2 ALA A 1 116.095 -25.672 8.443 1.00 0.00 H new ATOM 0 H3 ALA A 1 117.618 -24.924 8.503 1.00 0.00 H new ATOM 0 HA ALA A 1 115.024 -23.775 8.008 1.00 0.00 H new ATOM 0 HB1 ALA A 1 115.466 -21.708 9.296 1.00 0.00 H new ATOM 0 HB2 ALA A 1 115.294 -23.110 10.379 1.00 0.00 H new ATOM 0 HB3 ALA A 1 116.910 -22.461 10.013 1.00 0.00 H new ATOM 13 N THR A 2 116.253 -22.172 6.455 1.00 0.00 N ATOM 14 CA THR A 2 116.966 -21.505 5.367 1.00 0.00 C ATOM 15 C THR A 2 116.761 -19.995 5.445 1.00 0.00 C ATOM 16 O THR A 2 115.669 -19.524 5.759 1.00 0.00 O ATOM 17 CB THR A 2 116.455 -22.021 4.020 1.00 0.00 C ATOM 18 OG1 THR A 2 116.542 -23.438 3.995 1.00 0.00 O ATOM 19 CG2 THR A 2 117.305 -21.435 2.892 1.00 0.00 C ATOM 0 H THR A 2 115.251 -21.983 6.482 1.00 0.00 H new ATOM 0 HA THR A 2 118.030 -21.723 5.461 1.00 0.00 H new ATOM 0 HB THR A 2 115.417 -21.718 3.884 1.00 0.00 H new ATOM 0 HG1 THR A 2 116.214 -23.771 3.134 1.00 0.00 H new ATOM 0 HG21 THR A 2 116.940 -21.803 1.933 1.00 0.00 H new ATOM 0 HG22 THR A 2 117.237 -20.347 2.913 1.00 0.00 H new ATOM 0 HG23 THR A 2 118.344 -21.736 3.025 1.00 0.00 H new ATOM 27 N SER A 3 117.820 -19.241 5.156 1.00 0.00 N ATOM 28 CA SER A 3 117.755 -17.783 5.209 1.00 0.00 C ATOM 29 C SER A 3 118.175 -17.183 3.871 1.00 0.00 C ATOM 30 O SER A 3 119.046 -17.722 3.188 1.00 0.00 O ATOM 31 CB SER A 3 118.676 -17.262 6.313 1.00 0.00 C ATOM 32 OG SER A 3 118.279 -17.826 7.555 1.00 0.00 O ATOM 0 H SER A 3 118.729 -19.614 4.884 1.00 0.00 H new ATOM 0 HA SER A 3 116.727 -17.488 5.422 1.00 0.00 H new ATOM 0 HB2 SER A 3 119.711 -17.525 6.094 1.00 0.00 H new ATOM 0 HB3 SER A 3 118.627 -16.174 6.361 1.00 0.00 H new ATOM 0 HG SER A 3 118.867 -17.497 8.267 1.00 0.00 H new ATOM 38 N THR A 4 117.545 -16.070 3.503 1.00 0.00 N ATOM 39 CA THR A 4 117.864 -15.386 2.253 1.00 0.00 C ATOM 40 C THR A 4 118.098 -13.901 2.505 1.00 0.00 C ATOM 41 O THR A 4 117.317 -13.250 3.199 1.00 0.00 O ATOM 42 CB THR A 4 116.720 -15.561 1.252 1.00 0.00 C ATOM 43 OG1 THR A 4 116.423 -16.943 1.111 1.00 0.00 O ATOM 44 CG2 THR A 4 117.133 -14.987 -0.105 1.00 0.00 C ATOM 0 H THR A 4 116.811 -15.623 4.052 1.00 0.00 H new ATOM 0 HA THR A 4 118.774 -15.824 1.842 1.00 0.00 H new ATOM 0 HB THR A 4 115.838 -15.033 1.614 1.00 0.00 H new ATOM 0 HG1 THR A 4 116.395 -17.176 0.160 1.00 0.00 H new ATOM 0 HG21 THR A 4 116.317 -15.113 -0.817 1.00 0.00 H new ATOM 0 HG22 THR A 4 117.361 -13.927 0.003 1.00 0.00 H new ATOM 0 HG23 THR A 4 118.016 -15.513 -0.469 1.00 0.00 H new ATOM 52 N VAL A 5 119.177 -13.366 1.937 1.00 0.00 N ATOM 53 CA VAL A 5 119.504 -11.951 2.105 1.00 0.00 C ATOM 54 C VAL A 5 119.609 -11.299 0.733 1.00 0.00 C ATOM 55 O VAL A 5 120.246 -11.848 -0.164 1.00 0.00 O ATOM 56 CB VAL A 5 120.829 -11.796 2.859 1.00 0.00 C ATOM 57 CG1 VAL A 5 121.112 -10.312 3.105 1.00 0.00 C ATOM 58 CG2 VAL A 5 120.744 -12.517 4.207 1.00 0.00 C ATOM 0 H VAL A 5 119.837 -13.887 1.359 1.00 0.00 H new ATOM 0 HA VAL A 5 118.719 -11.466 2.685 1.00 0.00 H new ATOM 0 HB VAL A 5 121.630 -12.229 2.261 1.00 0.00 H new ATOM 0 HG11 VAL A 5 122.055 -10.205 3.641 1.00 0.00 H new ATOM 0 HG12 VAL A 5 121.177 -9.791 2.150 1.00 0.00 H new ATOM 0 HG13 VAL A 5 120.306 -9.882 3.699 1.00 0.00 H new ATOM 0 HG21 VAL A 5 121.688 -12.404 4.740 1.00 0.00 H new ATOM 0 HG22 VAL A 5 119.938 -12.085 4.801 1.00 0.00 H new ATOM 0 HG23 VAL A 5 120.545 -13.576 4.041 1.00 0.00 H new ATOM 68 N THR A 6 118.966 -10.145 0.560 1.00 0.00 N ATOM 69 CA THR A 6 118.973 -9.473 -0.740 1.00 0.00 C ATOM 70 C THR A 6 119.211 -7.977 -0.569 1.00 0.00 C ATOM 71 O THR A 6 119.036 -7.427 0.518 1.00 0.00 O ATOM 72 CB THR A 6 117.643 -9.681 -1.485 1.00 0.00 C ATOM 73 OG1 THR A 6 116.640 -8.886 -0.878 1.00 0.00 O ATOM 74 CG2 THR A 6 117.199 -11.150 -1.463 1.00 0.00 C ATOM 0 H THR A 6 118.442 -9.662 1.290 1.00 0.00 H new ATOM 0 HA THR A 6 119.781 -9.912 -1.325 1.00 0.00 H new ATOM 0 HB THR A 6 117.792 -9.389 -2.524 1.00 0.00 H new ATOM 0 HG1 THR A 6 116.672 -7.980 -1.249 1.00 0.00 H new ATOM 0 HG21 THR A 6 116.256 -11.253 -2.000 1.00 0.00 H new ATOM 0 HG22 THR A 6 117.959 -11.767 -1.943 1.00 0.00 H new ATOM 0 HG23 THR A 6 117.066 -11.475 -0.431 1.00 0.00 H new ATOM 82 N GLY A 7 119.611 -7.331 -1.658 1.00 0.00 N ATOM 83 CA GLY A 7 119.759 -5.881 -1.671 1.00 0.00 C ATOM 84 C GLY A 7 119.462 -5.358 -3.068 1.00 0.00 C ATOM 85 O GLY A 7 119.683 -6.071 -4.048 1.00 0.00 O ATOM 0 H GLY A 7 119.838 -7.787 -2.542 1.00 0.00 H new ATOM 0 HA2 GLY A 7 119.080 -5.428 -0.949 1.00 0.00 H new ATOM 0 HA3 GLY A 7 120.771 -5.605 -1.374 1.00 0.00 H new ATOM 89 N GLY A 8 118.969 -4.126 -3.163 1.00 0.00 N ATOM 90 CA GLY A 8 118.594 -3.583 -4.465 1.00 0.00 C ATOM 91 C GLY A 8 118.598 -2.062 -4.477 1.00 0.00 C ATOM 92 O GLY A 8 118.700 -1.418 -3.433 1.00 0.00 O ATOM 0 H GLY A 8 118.822 -3.497 -2.374 1.00 0.00 H new ATOM 0 HA2 GLY A 8 119.285 -3.952 -5.223 1.00 0.00 H new ATOM 0 HA3 GLY A 8 117.602 -3.944 -4.735 1.00 0.00 H new ATOM 96 N TYR A 9 118.467 -1.507 -5.676 1.00 0.00 N ATOM 97 CA TYR A 9 118.424 -0.062 -5.863 1.00 0.00 C ATOM 98 C TYR A 9 117.108 0.328 -6.523 1.00 0.00 C ATOM 99 O TYR A 9 116.563 -0.427 -7.331 1.00 0.00 O ATOM 100 CB TYR A 9 119.591 0.391 -6.742 1.00 0.00 C ATOM 101 CG TYR A 9 119.629 1.884 -6.967 1.00 0.00 C ATOM 102 CD1 TYR A 9 120.336 2.707 -6.083 1.00 0.00 C ATOM 103 CD2 TYR A 9 118.954 2.444 -8.059 1.00 0.00 C ATOM 104 CE1 TYR A 9 120.369 4.092 -6.291 1.00 0.00 C ATOM 105 CE2 TYR A 9 118.987 3.829 -8.267 1.00 0.00 C ATOM 106 CZ TYR A 9 119.695 4.652 -7.383 1.00 0.00 C ATOM 107 OH TYR A 9 119.727 6.016 -7.587 1.00 0.00 O ATOM 0 H TYR A 9 118.388 -2.042 -6.541 1.00 0.00 H new ATOM 0 HA TYR A 9 118.503 0.423 -4.890 1.00 0.00 H new ATOM 0 HB2 TYR A 9 120.527 0.077 -6.280 1.00 0.00 H new ATOM 0 HB3 TYR A 9 119.526 -0.113 -7.706 1.00 0.00 H new ATOM 0 HD1 TYR A 9 120.856 2.275 -5.241 1.00 0.00 H new ATOM 0 HD2 TYR A 9 118.408 1.808 -8.740 1.00 0.00 H new ATOM 0 HE1 TYR A 9 120.914 4.728 -5.609 1.00 0.00 H new ATOM 0 HE2 TYR A 9 118.467 4.262 -9.109 1.00 0.00 H new ATOM 0 HH TYR A 9 119.210 6.239 -8.389 1.00 0.00 H new ATOM 117 N ALA A 10 116.571 1.478 -6.128 1.00 0.00 N ATOM 118 CA ALA A 10 115.324 1.967 -6.707 1.00 0.00 C ATOM 119 C ALA A 10 115.385 3.471 -6.948 1.00 0.00 C ATOM 120 O ALA A 10 116.072 4.198 -6.232 1.00 0.00 O ATOM 121 CB ALA A 10 114.157 1.646 -5.770 1.00 0.00 C ATOM 0 H ALA A 10 116.976 2.085 -5.415 1.00 0.00 H new ATOM 0 HA ALA A 10 115.175 1.469 -7.665 1.00 0.00 H new ATOM 0 HB1 ALA A 10 113.228 2.013 -6.207 1.00 0.00 H new ATOM 0 HB2 ALA A 10 114.090 0.567 -5.629 1.00 0.00 H new ATOM 0 HB3 ALA A 10 114.321 2.129 -4.807 1.00 0.00 H new ATOM 127 N GLN A 11 114.650 3.926 -7.959 1.00 0.00 N ATOM 128 CA GLN A 11 114.530 5.352 -8.248 1.00 0.00 C ATOM 129 C GLN A 11 113.055 5.720 -8.401 1.00 0.00 C ATOM 130 O GLN A 11 112.284 4.962 -8.990 1.00 0.00 O ATOM 131 CB GLN A 11 115.324 5.701 -9.514 1.00 0.00 C ATOM 132 CG GLN A 11 114.725 5.006 -10.744 1.00 0.00 C ATOM 133 CD GLN A 11 115.678 5.129 -11.928 1.00 0.00 C ATOM 134 OE1 GLN A 11 116.890 4.983 -11.768 1.00 0.00 O ATOM 135 NE2 GLN A 11 115.200 5.390 -13.113 1.00 0.00 N ATOM 0 H GLN A 11 114.126 3.324 -8.595 1.00 0.00 H new ATOM 0 HA GLN A 11 114.945 5.929 -7.422 1.00 0.00 H new ATOM 0 HB2 GLN A 11 115.321 6.781 -9.664 1.00 0.00 H new ATOM 0 HB3 GLN A 11 116.364 5.399 -9.391 1.00 0.00 H new ATOM 0 HG2 GLN A 11 114.539 3.955 -10.524 1.00 0.00 H new ATOM 0 HG3 GLN A 11 113.763 5.454 -10.993 1.00 0.00 H new ATOM 0 HE21 GLN A 11 114.195 5.510 -13.243 1.00 0.00 H new ATOM 0 HE22 GLN A 11 115.831 5.474 -13.910 1.00 0.00 H new ATOM 144 N SER A 12 112.660 6.879 -7.876 1.00 0.00 N ATOM 145 CA SER A 12 111.248 7.256 -7.869 1.00 0.00 C ATOM 146 C SER A 12 111.036 8.604 -8.546 1.00 0.00 C ATOM 147 O SER A 12 111.871 9.503 -8.435 1.00 0.00 O ATOM 148 CB SER A 12 110.742 7.330 -6.428 1.00 0.00 C ATOM 149 OG SER A 12 111.419 8.378 -5.749 1.00 0.00 O ATOM 0 H SER A 12 113.288 7.564 -7.456 1.00 0.00 H new ATOM 0 HA SER A 12 110.692 6.499 -8.422 1.00 0.00 H new ATOM 0 HB2 SER A 12 109.667 7.508 -6.416 1.00 0.00 H new ATOM 0 HB3 SER A 12 110.914 6.381 -5.920 1.00 0.00 H new ATOM 0 HG SER A 12 111.782 9.011 -6.403 1.00 0.00 H new ATOM 155 N ASP A 13 109.895 8.728 -9.217 1.00 0.00 N ATOM 156 CA ASP A 13 109.519 9.968 -9.884 1.00 0.00 C ATOM 157 C ASP A 13 108.117 10.367 -9.441 1.00 0.00 C ATOM 158 O ASP A 13 107.240 9.515 -9.307 1.00 0.00 O ATOM 159 CB ASP A 13 109.549 9.781 -11.403 1.00 0.00 C ATOM 160 CG ASP A 13 109.296 11.110 -12.110 1.00 0.00 C ATOM 161 OD1 ASP A 13 109.669 12.137 -11.565 1.00 0.00 O ATOM 162 OD2 ASP A 13 108.731 11.081 -13.191 1.00 0.00 O ATOM 0 H ASP A 13 109.211 7.978 -9.313 1.00 0.00 H new ATOM 0 HA ASP A 13 110.227 10.752 -9.615 1.00 0.00 H new ATOM 0 HB2 ASP A 13 110.515 9.379 -11.707 1.00 0.00 H new ATOM 0 HB3 ASP A 13 108.793 9.054 -11.701 1.00 0.00 H new ATOM 167 N ALA A 14 107.914 11.657 -9.204 1.00 0.00 N ATOM 168 CA ALA A 14 106.654 12.144 -8.666 1.00 0.00 C ATOM 169 C ALA A 14 105.872 12.891 -9.736 1.00 0.00 C ATOM 170 O ALA A 14 106.228 14.002 -10.130 1.00 0.00 O ATOM 171 CB ALA A 14 106.923 13.078 -7.487 1.00 0.00 C ATOM 0 H ALA A 14 108.608 12.384 -9.377 1.00 0.00 H new ATOM 0 HA ALA A 14 106.066 11.290 -8.330 1.00 0.00 H new ATOM 0 HB1 ALA A 14 105.976 13.441 -7.087 1.00 0.00 H new ATOM 0 HB2 ALA A 14 107.462 12.537 -6.710 1.00 0.00 H new ATOM 0 HB3 ALA A 14 107.523 13.924 -7.822 1.00 0.00 H new ATOM 177 N GLN A 15 104.804 12.261 -10.200 1.00 0.00 N ATOM 178 CA GLN A 15 103.911 12.890 -11.163 1.00 0.00 C ATOM 179 C GLN A 15 103.079 13.966 -10.474 1.00 0.00 C ATOM 180 O GLN A 15 102.344 13.686 -9.523 1.00 0.00 O ATOM 181 CB GLN A 15 102.985 11.842 -11.783 1.00 0.00 C ATOM 182 CG GLN A 15 103.813 10.849 -12.604 1.00 0.00 C ATOM 183 CD GLN A 15 102.923 9.742 -13.163 1.00 0.00 C ATOM 184 OE1 GLN A 15 101.807 9.529 -12.686 1.00 0.00 O ATOM 185 NE2 GLN A 15 103.354 9.015 -14.158 1.00 0.00 N ATOM 0 H GLN A 15 104.534 11.316 -9.926 1.00 0.00 H new ATOM 0 HA GLN A 15 104.509 13.348 -11.951 1.00 0.00 H new ATOM 0 HB2 GLN A 15 102.438 11.316 -11.000 1.00 0.00 H new ATOM 0 HB3 GLN A 15 102.244 12.327 -12.419 1.00 0.00 H new ATOM 0 HG2 GLN A 15 104.311 11.371 -13.421 1.00 0.00 H new ATOM 0 HG3 GLN A 15 104.594 10.415 -11.980 1.00 0.00 H new ATOM 0 HE21 GLN A 15 104.277 9.189 -14.555 1.00 0.00 H new ATOM 0 HE22 GLN A 15 102.767 8.273 -14.539 1.00 0.00 H new ATOM 194 N GLY A 16 103.204 15.186 -10.987 1.00 0.00 N ATOM 195 CA GLY A 16 102.538 16.356 -10.414 1.00 0.00 C ATOM 196 C GLY A 16 103.418 17.108 -9.404 1.00 0.00 C ATOM 197 O GLY A 16 103.111 18.245 -9.046 1.00 0.00 O ATOM 0 H GLY A 16 103.769 15.394 -11.811 1.00 0.00 H new ATOM 0 HA2 GLY A 16 102.253 17.036 -11.217 1.00 0.00 H new ATOM 0 HA3 GLY A 16 101.618 16.040 -9.922 1.00 0.00 H new ATOM 201 N GLN A 17 104.506 16.486 -8.945 1.00 0.00 N ATOM 202 CA GLN A 17 105.516 17.177 -8.146 1.00 0.00 C ATOM 203 C GLN A 17 106.844 17.192 -8.895 1.00 0.00 C ATOM 204 O GLN A 17 107.092 16.327 -9.736 1.00 0.00 O ATOM 205 CB GLN A 17 105.682 16.488 -6.788 1.00 0.00 C ATOM 206 CG GLN A 17 104.353 16.491 -6.023 1.00 0.00 C ATOM 207 CD GLN A 17 103.867 17.919 -5.789 1.00 0.00 C ATOM 208 OE1 GLN A 17 104.626 18.764 -5.317 1.00 0.00 O ATOM 209 NE2 GLN A 17 102.637 18.237 -6.091 1.00 0.00 N ATOM 0 H GLN A 17 104.709 15.501 -9.115 1.00 0.00 H new ATOM 0 HA GLN A 17 105.192 18.204 -7.976 1.00 0.00 H new ATOM 0 HB2 GLN A 17 106.024 15.463 -6.932 1.00 0.00 H new ATOM 0 HB3 GLN A 17 106.447 17.000 -6.204 1.00 0.00 H new ATOM 0 HG2 GLN A 17 103.603 15.934 -6.585 1.00 0.00 H new ATOM 0 HG3 GLN A 17 104.477 15.983 -5.067 1.00 0.00 H new ATOM 0 HE21 GLN A 17 102.010 17.534 -6.482 1.00 0.00 H new ATOM 0 HE22 GLN A 17 102.303 19.188 -5.936 1.00 0.00 H new ATOM 218 N MET A 18 107.696 18.171 -8.600 1.00 0.00 N ATOM 219 CA MET A 18 109.010 18.238 -9.236 1.00 0.00 C ATOM 220 C MET A 18 110.097 17.732 -8.292 1.00 0.00 C ATOM 221 O MET A 18 110.588 18.482 -7.448 1.00 0.00 O ATOM 222 CB MET A 18 109.318 19.682 -9.637 1.00 0.00 C ATOM 223 CG MET A 18 108.315 20.141 -10.698 1.00 0.00 C ATOM 224 SD MET A 18 108.802 21.764 -11.339 1.00 0.00 S ATOM 225 CE MET A 18 108.719 22.674 -9.777 1.00 0.00 C ATOM 0 H MET A 18 107.505 18.919 -7.934 1.00 0.00 H new ATOM 0 HA MET A 18 108.994 17.604 -10.122 1.00 0.00 H new ATOM 0 HB2 MET A 18 109.264 20.333 -8.764 1.00 0.00 H new ATOM 0 HB3 MET A 18 110.334 19.754 -10.026 1.00 0.00 H new ATOM 0 HG2 MET A 18 108.274 19.416 -11.511 1.00 0.00 H new ATOM 0 HG3 MET A 18 107.315 20.195 -10.268 1.00 0.00 H new ATOM 0 HE1 MET A 18 108.544 23.730 -9.980 1.00 0.00 H new ATOM 0 HE2 MET A 18 107.903 22.281 -9.170 1.00 0.00 H new ATOM 0 HE3 MET A 18 109.660 22.559 -9.239 1.00 0.00 H new ATOM 235 N ASN A 19 110.487 16.469 -8.456 1.00 0.00 N ATOM 236 CA ASN A 19 111.549 15.888 -7.636 1.00 0.00 C ATOM 237 C ASN A 19 111.891 14.470 -8.094 1.00 0.00 C ATOM 238 O ASN A 19 111.044 13.756 -8.631 1.00 0.00 O ATOM 239 CB ASN A 19 111.133 15.867 -6.158 1.00 0.00 C ATOM 240 CG ASN A 19 109.928 14.954 -5.939 1.00 0.00 C ATOM 241 OD1 ASN A 19 109.262 14.553 -6.894 1.00 0.00 O ATOM 242 ND2 ASN A 19 109.606 14.598 -4.725 1.00 0.00 N ATOM 0 H ASN A 19 110.087 15.832 -9.145 1.00 0.00 H new ATOM 0 HA ASN A 19 112.436 16.511 -7.753 1.00 0.00 H new ATOM 0 HB2 ASN A 19 111.968 15.525 -5.547 1.00 0.00 H new ATOM 0 HB3 ASN A 19 110.891 16.878 -5.831 1.00 0.00 H new ATOM 0 HD21 ASN A 19 108.803 13.988 -4.568 1.00 0.00 H new ATOM 0 HD22 ASN A 19 110.157 14.930 -3.933 1.00 0.00 H new ATOM 249 N LYS A 20 113.140 14.075 -7.873 1.00 0.00 N ATOM 250 CA LYS A 20 113.583 12.716 -8.172 1.00 0.00 C ATOM 251 C LYS A 20 114.416 12.185 -7.008 1.00 0.00 C ATOM 252 O LYS A 20 115.249 12.910 -6.463 1.00 0.00 O ATOM 253 CB LYS A 20 114.420 12.704 -9.452 1.00 0.00 C ATOM 254 CG LYS A 20 114.759 11.259 -9.828 1.00 0.00 C ATOM 255 CD LYS A 20 115.667 11.251 -11.059 1.00 0.00 C ATOM 256 CE LYS A 20 115.880 9.810 -11.528 1.00 0.00 C ATOM 257 NZ LYS A 20 114.640 9.315 -12.191 1.00 0.00 N ATOM 0 H LYS A 20 113.866 14.678 -7.487 1.00 0.00 H new ATOM 0 HA LYS A 20 112.710 12.080 -8.316 1.00 0.00 H new ATOM 0 HB2 LYS A 20 113.871 13.182 -10.263 1.00 0.00 H new ATOM 0 HB3 LYS A 20 115.336 13.277 -9.306 1.00 0.00 H new ATOM 0 HG2 LYS A 20 115.255 10.762 -8.994 1.00 0.00 H new ATOM 0 HG3 LYS A 20 113.845 10.702 -10.034 1.00 0.00 H new ATOM 0 HD2 LYS A 20 115.219 11.842 -11.858 1.00 0.00 H new ATOM 0 HD3 LYS A 20 116.625 11.712 -10.820 1.00 0.00 H new ATOM 0 HE2 LYS A 20 116.720 9.762 -12.221 1.00 0.00 H new ATOM 0 HE3 LYS A 20 116.131 9.173 -10.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 114.858 8.460 -12.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 113.927 9.089 -11.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 114.269 10.050 -12.826 1.00 0.00 H new ATOM 271 N MET A 21 114.201 10.925 -6.625 1.00 0.00 N ATOM 272 CA MET A 21 114.889 10.371 -5.457 1.00 0.00 C ATOM 273 C MET A 21 115.563 9.044 -5.789 1.00 0.00 C ATOM 274 O MET A 21 115.083 8.291 -6.634 1.00 0.00 O ATOM 275 CB MET A 21 113.888 10.159 -4.320 1.00 0.00 C ATOM 276 CG MET A 21 113.317 11.510 -3.884 1.00 0.00 C ATOM 277 SD MET A 21 112.305 11.295 -2.397 1.00 0.00 S ATOM 278 CE MET A 21 111.089 10.154 -3.098 1.00 0.00 C ATOM 0 H MET A 21 113.568 10.279 -7.096 1.00 0.00 H new ATOM 0 HA MET A 21 115.657 11.081 -5.151 1.00 0.00 H new ATOM 0 HB2 MET A 21 113.083 9.501 -4.648 1.00 0.00 H new ATOM 0 HB3 MET A 21 114.377 9.670 -3.477 1.00 0.00 H new ATOM 0 HG2 MET A 21 114.128 12.211 -3.685 1.00 0.00 H new ATOM 0 HG3 MET A 21 112.715 11.937 -4.686 1.00 0.00 H new ATOM 0 HE1 MET A 21 110.156 10.228 -2.539 1.00 0.00 H new ATOM 0 HE2 MET A 21 110.908 10.411 -4.142 1.00 0.00 H new ATOM 0 HE3 MET A 21 111.469 9.134 -3.036 1.00 0.00 H new ATOM 288 N GLY A 22 116.666 8.764 -5.101 1.00 0.00 N ATOM 289 CA GLY A 22 117.383 7.506 -5.285 1.00 0.00 C ATOM 290 C GLY A 22 117.702 6.889 -3.929 1.00 0.00 C ATOM 291 O GLY A 22 118.197 7.577 -3.038 1.00 0.00 O ATOM 0 H GLY A 22 117.082 9.390 -4.412 1.00 0.00 H new ATOM 0 HA2 GLY A 22 116.780 6.816 -5.875 1.00 0.00 H new ATOM 0 HA3 GLY A 22 118.304 7.680 -5.841 1.00 0.00 H new ATOM 295 N GLY A 23 117.406 5.603 -3.768 1.00 0.00 N ATOM 296 CA GLY A 23 117.558 4.962 -2.466 1.00 0.00 C ATOM 297 C GLY A 23 117.961 3.498 -2.587 1.00 0.00 C ATOM 298 O GLY A 23 117.900 2.906 -3.664 1.00 0.00 O ATOM 0 H GLY A 23 117.065 4.992 -4.510 1.00 0.00 H new ATOM 0 HA2 GLY A 23 118.310 5.497 -1.886 1.00 0.00 H new ATOM 0 HA3 GLY A 23 116.620 5.034 -1.916 1.00 0.00 H new ATOM 302 N PHE A 24 118.350 2.923 -1.452 1.00 0.00 N ATOM 303 CA PHE A 24 118.775 1.528 -1.400 1.00 0.00 C ATOM 304 C PHE A 24 117.876 0.772 -0.430 1.00 0.00 C ATOM 305 O PHE A 24 117.329 1.371 0.495 1.00 0.00 O ATOM 306 CB PHE A 24 120.226 1.438 -0.922 1.00 0.00 C ATOM 307 CG PHE A 24 121.210 2.139 -1.829 1.00 0.00 C ATOM 308 CD1 PHE A 24 121.489 3.498 -1.640 1.00 0.00 C ATOM 309 CD2 PHE A 24 121.848 1.429 -2.854 1.00 0.00 C ATOM 310 CE1 PHE A 24 122.406 4.147 -2.476 1.00 0.00 C ATOM 311 CE2 PHE A 24 122.763 2.079 -3.691 1.00 0.00 C ATOM 312 CZ PHE A 24 123.043 3.437 -3.501 1.00 0.00 C ATOM 0 H PHE A 24 118.379 3.404 -0.553 1.00 0.00 H new ATOM 0 HA PHE A 24 118.702 1.091 -2.396 1.00 0.00 H new ATOM 0 HB2 PHE A 24 120.297 1.868 0.077 1.00 0.00 H new ATOM 0 HB3 PHE A 24 120.507 0.388 -0.838 1.00 0.00 H new ATOM 0 HD1 PHE A 24 120.997 4.046 -0.850 1.00 0.00 H new ATOM 0 HD2 PHE A 24 121.634 0.380 -2.999 1.00 0.00 H new ATOM 0 HE1 PHE A 24 122.622 5.195 -2.330 1.00 0.00 H new ATOM 0 HE2 PHE A 24 123.253 1.532 -4.483 1.00 0.00 H new ATOM 0 HZ PHE A 24 123.751 3.938 -4.145 1.00 0.00 H new ATOM 322 N ASN A 25 117.712 -0.533 -0.643 1.00 0.00 N ATOM 323 CA ASN A 25 116.846 -1.329 0.226 1.00 0.00 C ATOM 324 C ASN A 25 117.501 -2.657 0.590 1.00 0.00 C ATOM 325 O ASN A 25 118.160 -3.279 -0.242 1.00 0.00 O ATOM 326 CB ASN A 25 115.502 -1.576 -0.467 1.00 0.00 C ATOM 327 CG ASN A 25 115.684 -2.421 -1.727 1.00 0.00 C ATOM 328 OD1 ASN A 25 116.795 -2.546 -2.243 1.00 0.00 O ATOM 329 ND2 ASN A 25 114.649 -3.014 -2.256 1.00 0.00 N ATOM 0 H ASN A 25 118.159 -1.055 -1.397 1.00 0.00 H new ATOM 0 HA ASN A 25 116.681 -0.772 1.148 1.00 0.00 H new ATOM 0 HB2 ASN A 25 114.822 -2.081 0.219 1.00 0.00 H new ATOM 0 HB3 ASN A 25 115.042 -0.623 -0.727 1.00 0.00 H new ATOM 0 HD21 ASN A 25 114.760 -3.581 -3.097 1.00 0.00 H new ATOM 0 HD22 ASN A 25 113.729 -2.911 -1.829 1.00 0.00 H new ATOM 336 N LEU A 26 117.301 -3.078 1.838 1.00 0.00 N ATOM 337 CA LEU A 26 117.807 -4.363 2.306 1.00 0.00 C ATOM 338 C LEU A 26 116.667 -5.135 2.957 1.00 0.00 C ATOM 339 O LEU A 26 115.896 -4.564 3.728 1.00 0.00 O ATOM 340 CB LEU A 26 118.932 -4.151 3.323 1.00 0.00 C ATOM 341 CG LEU A 26 120.054 -3.325 2.691 1.00 0.00 C ATOM 342 CD1 LEU A 26 121.106 -2.999 3.752 1.00 0.00 C ATOM 343 CD2 LEU A 26 120.710 -4.130 1.566 1.00 0.00 C ATOM 0 H LEU A 26 116.791 -2.545 2.543 1.00 0.00 H new ATOM 0 HA LEU A 26 118.203 -4.926 1.461 1.00 0.00 H new ATOM 0 HB2 LEU A 26 118.545 -3.641 4.205 1.00 0.00 H new ATOM 0 HB3 LEU A 26 119.320 -5.114 3.656 1.00 0.00 H new ATOM 0 HG LEU A 26 119.639 -2.401 2.288 1.00 0.00 H new ATOM 0 HD11 LEU A 26 121.906 -2.410 3.303 1.00 0.00 H new ATOM 0 HD12 LEU A 26 120.645 -2.429 4.558 1.00 0.00 H new ATOM 0 HD13 LEU A 26 121.518 -3.925 4.152 1.00 0.00 H new ATOM 0 HD21 LEU A 26 121.509 -3.541 1.116 1.00 0.00 H new ATOM 0 HD22 LEU A 26 121.124 -5.053 1.972 1.00 0.00 H new ATOM 0 HD23 LEU A 26 119.965 -4.370 0.808 1.00 0.00 H new ATOM 355 N LYS A 27 116.559 -6.425 2.651 1.00 0.00 N ATOM 356 CA LYS A 27 115.437 -7.212 3.151 1.00 0.00 C ATOM 357 C LYS A 27 115.825 -8.660 3.444 1.00 0.00 C ATOM 358 O LYS A 27 116.806 -9.180 2.914 1.00 0.00 O ATOM 359 CB LYS A 27 114.283 -7.135 2.147 1.00 0.00 C ATOM 360 CG LYS A 27 114.681 -7.810 0.834 1.00 0.00 C ATOM 361 CD LYS A 27 113.574 -7.605 -0.202 1.00 0.00 C ATOM 362 CE LYS A 27 113.814 -8.528 -1.398 1.00 0.00 C ATOM 363 NZ LYS A 27 112.607 -8.535 -2.271 1.00 0.00 N ATOM 0 H LYS A 27 117.221 -6.939 2.070 1.00 0.00 H new ATOM 0 HA LYS A 27 115.118 -6.789 4.104 1.00 0.00 H new ATOM 0 HB2 LYS A 27 113.399 -7.620 2.560 1.00 0.00 H new ATOM 0 HB3 LYS A 27 114.019 -6.093 1.964 1.00 0.00 H new ATOM 0 HG2 LYS A 27 115.618 -7.392 0.468 1.00 0.00 H new ATOM 0 HG3 LYS A 27 114.849 -8.875 0.997 1.00 0.00 H new ATOM 0 HD2 LYS A 27 112.602 -7.815 0.243 1.00 0.00 H new ATOM 0 HD3 LYS A 27 113.556 -6.566 -0.530 1.00 0.00 H new ATOM 0 HE2 LYS A 27 114.683 -8.190 -1.963 1.00 0.00 H new ATOM 0 HE3 LYS A 27 114.032 -9.539 -1.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 112.723 -9.250 -3.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 111.767 -8.762 -1.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 112.487 -7.598 -2.705 1.00 0.00 H new ATOM 377 N TYR A 28 115.029 -9.293 4.300 1.00 0.00 N ATOM 378 CA TYR A 28 115.281 -10.670 4.718 1.00 0.00 C ATOM 379 C TYR A 28 114.006 -11.505 4.616 1.00 0.00 C ATOM 380 O TYR A 28 112.919 -11.020 4.931 1.00 0.00 O ATOM 381 CB TYR A 28 115.815 -10.688 6.155 1.00 0.00 C ATOM 382 CG TYR A 28 114.805 -10.263 7.196 1.00 0.00 C ATOM 383 CD1 TYR A 28 113.976 -11.217 7.798 1.00 0.00 C ATOM 384 CD2 TYR A 28 114.698 -8.915 7.558 1.00 0.00 C ATOM 385 CE1 TYR A 28 113.041 -10.823 8.763 1.00 0.00 C ATOM 386 CE2 TYR A 28 113.762 -8.520 8.522 1.00 0.00 C ATOM 387 CZ TYR A 28 112.934 -9.475 9.124 1.00 0.00 C ATOM 388 OH TYR A 28 112.011 -9.086 10.074 1.00 0.00 O ATOM 0 H TYR A 28 114.200 -8.873 4.720 1.00 0.00 H new ATOM 0 HA TYR A 28 116.028 -11.106 4.055 1.00 0.00 H new ATOM 0 HB2 TYR A 28 116.161 -11.695 6.390 1.00 0.00 H new ATOM 0 HB3 TYR A 28 116.682 -10.031 6.217 1.00 0.00 H new ATOM 0 HD1 TYR A 28 114.058 -12.257 7.518 1.00 0.00 H new ATOM 0 HD2 TYR A 28 115.338 -8.179 7.094 1.00 0.00 H new ATOM 0 HE1 TYR A 28 112.403 -11.559 9.229 1.00 0.00 H new ATOM 0 HE2 TYR A 28 113.679 -7.480 8.801 1.00 0.00 H new ATOM 0 HH TYR A 28 112.068 -8.117 10.208 1.00 0.00 H new ATOM 398 N ARG A 29 114.146 -12.744 4.144 1.00 0.00 N ATOM 399 CA ARG A 29 113.001 -13.642 3.993 1.00 0.00 C ATOM 400 C ARG A 29 113.239 -14.957 4.735 1.00 0.00 C ATOM 401 O ARG A 29 114.345 -15.496 4.723 1.00 0.00 O ATOM 402 CB ARG A 29 112.757 -13.936 2.511 1.00 0.00 C ATOM 403 CG ARG A 29 111.455 -14.725 2.358 1.00 0.00 C ATOM 404 CD ARG A 29 111.158 -14.957 0.876 1.00 0.00 C ATOM 405 NE ARG A 29 112.117 -15.907 0.303 1.00 0.00 N ATOM 406 CZ ARG A 29 113.269 -15.540 -0.276 1.00 0.00 C ATOM 407 NH1 ARG A 29 113.654 -14.289 -0.342 1.00 0.00 N ATOM 408 NH2 ARG A 29 114.039 -16.465 -0.785 1.00 0.00 N ATOM 0 H ARG A 29 115.039 -13.148 3.860 1.00 0.00 H new ATOM 0 HA ARG A 29 112.127 -13.150 4.419 1.00 0.00 H new ATOM 0 HB2 ARG A 29 112.699 -13.004 1.949 1.00 0.00 H new ATOM 0 HB3 ARG A 29 113.591 -14.505 2.100 1.00 0.00 H new ATOM 0 HG2 ARG A 29 111.536 -15.681 2.876 1.00 0.00 H new ATOM 0 HG3 ARG A 29 110.633 -14.180 2.822 1.00 0.00 H new ATOM 0 HD2 ARG A 29 110.144 -15.339 0.758 1.00 0.00 H new ATOM 0 HD3 ARG A 29 111.208 -14.011 0.337 1.00 0.00 H new ATOM 0 HE ARG A 29 111.895 -16.902 0.347 1.00 0.00 H new ATOM 0 HH11 ARG A 29 113.070 -13.554 0.056 1.00 0.00 H new ATOM 0 HH12 ARG A 29 114.538 -14.051 -0.791 1.00 0.00 H new ATOM 0 HH21 ARG A 29 113.759 -17.445 -0.737 1.00 0.00 H new ATOM 0 HH22 ARG A 29 114.920 -16.207 -1.230 1.00 0.00 H new ATOM 422 N TYR A 30 112.190 -15.466 5.381 1.00 0.00 N ATOM 423 CA TYR A 30 112.279 -16.723 6.123 1.00 0.00 C ATOM 424 C TYR A 30 111.243 -17.723 5.615 1.00 0.00 C ATOM 425 O TYR A 30 110.110 -17.352 5.305 1.00 0.00 O ATOM 426 CB TYR A 30 112.049 -16.463 7.612 1.00 0.00 C ATOM 427 CG TYR A 30 112.204 -17.697 8.468 1.00 0.00 C ATOM 428 CD1 TYR A 30 113.471 -18.076 8.928 1.00 0.00 C ATOM 429 CD2 TYR A 30 111.080 -18.462 8.804 1.00 0.00 C ATOM 430 CE1 TYR A 30 113.615 -19.220 9.722 1.00 0.00 C ATOM 431 CE2 TYR A 30 111.224 -19.606 9.598 1.00 0.00 C ATOM 432 CZ TYR A 30 112.491 -19.985 10.057 1.00 0.00 C ATOM 433 OH TYR A 30 112.632 -21.112 10.840 1.00 0.00 O ATOM 0 H TYR A 30 111.269 -15.027 5.405 1.00 0.00 H new ATOM 0 HA TYR A 30 113.274 -17.142 5.973 1.00 0.00 H new ATOM 0 HB2 TYR A 30 112.752 -15.703 7.953 1.00 0.00 H new ATOM 0 HB3 TYR A 30 111.047 -16.057 7.752 1.00 0.00 H new ATOM 0 HD1 TYR A 30 114.338 -17.485 8.670 1.00 0.00 H new ATOM 0 HD2 TYR A 30 110.102 -18.169 8.451 1.00 0.00 H new ATOM 0 HE1 TYR A 30 114.593 -19.512 10.076 1.00 0.00 H new ATOM 0 HE2 TYR A 30 110.357 -20.196 9.856 1.00 0.00 H new ATOM 0 HH TYR A 30 111.754 -21.526 10.979 1.00 0.00 H new ATOM 443 N GLU A 31 111.636 -18.993 5.533 1.00 0.00 N ATOM 444 CA GLU A 31 110.742 -20.038 5.034 1.00 0.00 C ATOM 445 C GLU A 31 110.742 -21.253 5.962 1.00 0.00 C ATOM 446 O GLU A 31 111.753 -21.565 6.591 1.00 0.00 O ATOM 447 CB GLU A 31 111.180 -20.470 3.634 1.00 0.00 C ATOM 448 CG GLU A 31 111.086 -19.274 2.677 1.00 0.00 C ATOM 449 CD GLU A 31 111.431 -19.670 1.237 1.00 0.00 C ATOM 450 OE1 GLU A 31 111.915 -20.772 1.020 1.00 0.00 O ATOM 451 OE2 GLU A 31 111.202 -18.853 0.361 1.00 0.00 O ATOM 0 H GLU A 31 112.562 -19.323 5.804 1.00 0.00 H new ATOM 0 HA GLU A 31 109.732 -19.630 4.997 1.00 0.00 H new ATOM 0 HB2 GLU A 31 112.202 -20.848 3.661 1.00 0.00 H new ATOM 0 HB3 GLU A 31 110.548 -21.284 3.279 1.00 0.00 H new ATOM 0 HG2 GLU A 31 110.078 -18.861 2.709 1.00 0.00 H new ATOM 0 HG3 GLU A 31 111.763 -18.488 3.010 1.00 0.00 H new ATOM 458 N GLU A 32 109.601 -21.933 6.037 1.00 0.00 N ATOM 459 CA GLU A 32 109.485 -23.139 6.854 1.00 0.00 C ATOM 460 C GLU A 32 109.861 -24.372 6.036 1.00 0.00 C ATOM 461 O GLU A 32 109.543 -24.463 4.851 1.00 0.00 O ATOM 462 CB GLU A 32 108.054 -23.283 7.377 1.00 0.00 C ATOM 463 CG GLU A 32 107.977 -24.468 8.346 1.00 0.00 C ATOM 464 CD GLU A 32 108.727 -24.163 9.642 1.00 0.00 C ATOM 465 OE1 GLU A 32 108.860 -22.998 9.983 1.00 0.00 O ATOM 466 OE2 GLU A 32 109.160 -25.108 10.281 1.00 0.00 O ATOM 0 H GLU A 32 108.747 -21.672 5.545 1.00 0.00 H new ATOM 0 HA GLU A 32 110.169 -23.053 7.699 1.00 0.00 H new ATOM 0 HB2 GLU A 32 107.747 -22.367 7.882 1.00 0.00 H new ATOM 0 HB3 GLU A 32 107.366 -23.435 6.545 1.00 0.00 H new ATOM 0 HG2 GLU A 32 106.934 -24.693 8.569 1.00 0.00 H new ATOM 0 HG3 GLU A 32 108.401 -25.355 7.876 1.00 0.00 H new ATOM 473 N ASP A 33 110.540 -25.319 6.678 1.00 0.00 N ATOM 474 CA ASP A 33 111.081 -26.476 5.970 1.00 0.00 C ATOM 475 C ASP A 33 109.994 -27.408 5.431 1.00 0.00 C ATOM 476 O ASP A 33 110.074 -27.846 4.282 1.00 0.00 O ATOM 477 CB ASP A 33 112.014 -27.261 6.897 1.00 0.00 C ATOM 478 CG ASP A 33 111.242 -27.840 8.081 1.00 0.00 C ATOM 479 OD1 ASP A 33 110.276 -27.222 8.498 1.00 0.00 O ATOM 480 OD2 ASP A 33 111.630 -28.896 8.553 1.00 0.00 O ATOM 0 H ASP A 33 110.728 -25.309 7.680 1.00 0.00 H new ATOM 0 HA ASP A 33 111.631 -26.092 5.111 1.00 0.00 H new ATOM 0 HB2 ASP A 33 112.493 -28.067 6.341 1.00 0.00 H new ATOM 0 HB3 ASP A 33 112.808 -26.608 7.259 1.00 0.00 H new ATOM 485 N ASN A 34 108.981 -27.715 6.242 1.00 0.00 N ATOM 486 CA ASN A 34 107.961 -28.689 5.834 1.00 0.00 C ATOM 487 C ASN A 34 106.631 -28.048 5.417 1.00 0.00 C ATOM 488 O ASN A 34 105.783 -28.717 4.827 1.00 0.00 O ATOM 489 CB ASN A 34 107.716 -29.674 6.984 1.00 0.00 C ATOM 490 CG ASN A 34 107.097 -28.964 8.187 1.00 0.00 C ATOM 491 OD1 ASN A 34 107.168 -27.739 8.295 1.00 0.00 O ATOM 492 ND2 ASN A 34 106.489 -29.667 9.103 1.00 0.00 N ATOM 0 H ASN A 34 108.843 -27.313 7.169 1.00 0.00 H new ATOM 0 HA ASN A 34 108.348 -29.201 4.953 1.00 0.00 H new ATOM 0 HB2 ASN A 34 107.055 -30.474 6.649 1.00 0.00 H new ATOM 0 HB3 ASN A 34 108.657 -30.140 7.276 1.00 0.00 H new ATOM 0 HD21 ASN A 34 106.072 -29.202 9.909 1.00 0.00 H new ATOM 0 HD22 ASN A 34 106.431 -30.681 9.012 1.00 0.00 H new ATOM 499 N SER A 35 106.442 -26.765 5.717 1.00 0.00 N ATOM 500 CA SER A 35 105.247 -26.052 5.276 1.00 0.00 C ATOM 501 C SER A 35 105.605 -24.587 5.008 1.00 0.00 C ATOM 502 O SER A 35 105.226 -23.701 5.780 1.00 0.00 O ATOM 503 CB SER A 35 104.152 -26.160 6.341 1.00 0.00 C ATOM 504 OG SER A 35 104.683 -25.771 7.600 1.00 0.00 O ATOM 0 H SER A 35 107.096 -26.202 6.260 1.00 0.00 H new ATOM 0 HA SER A 35 104.870 -26.497 4.355 1.00 0.00 H new ATOM 0 HB2 SER A 35 103.308 -25.523 6.077 1.00 0.00 H new ATOM 0 HB3 SER A 35 103.777 -27.182 6.391 1.00 0.00 H new ATOM 0 HG SER A 35 105.031 -24.857 7.540 1.00 0.00 H new ATOM 510 N PRO A 36 106.311 -24.303 3.933 1.00 0.00 N ATOM 511 CA PRO A 36 106.896 -22.944 3.738 1.00 0.00 C ATOM 512 C PRO A 36 105.844 -21.865 3.494 1.00 0.00 C ATOM 513 O PRO A 36 104.917 -22.039 2.704 1.00 0.00 O ATOM 514 CB PRO A 36 107.829 -23.093 2.524 1.00 0.00 C ATOM 515 CG PRO A 36 107.912 -24.555 2.232 1.00 0.00 C ATOM 516 CD PRO A 36 106.641 -25.182 2.798 1.00 0.00 C ATOM 0 HA PRO A 36 107.417 -22.614 4.637 1.00 0.00 H new ATOM 0 HB2 PRO A 36 107.439 -22.547 1.665 1.00 0.00 H new ATOM 0 HB3 PRO A 36 108.816 -22.684 2.740 1.00 0.00 H new ATOM 0 HG2 PRO A 36 107.988 -24.733 1.159 1.00 0.00 H new ATOM 0 HG3 PRO A 36 108.798 -24.993 2.691 1.00 0.00 H new ATOM 0 HD2 PRO A 36 105.840 -25.205 2.060 1.00 0.00 H new ATOM 0 HD3 PRO A 36 106.807 -26.210 3.120 1.00 0.00 H new ATOM 524 N LEU A 37 106.023 -20.749 4.190 1.00 0.00 N ATOM 525 CA LEU A 37 105.277 -19.527 3.924 1.00 0.00 C ATOM 526 C LEU A 37 106.286 -18.407 3.719 1.00 0.00 C ATOM 527 O LEU A 37 107.234 -18.300 4.500 1.00 0.00 O ATOM 528 CB LEU A 37 104.359 -19.193 5.103 1.00 0.00 C ATOM 529 CG LEU A 37 103.412 -20.363 5.371 1.00 0.00 C ATOM 530 CD1 LEU A 37 102.591 -20.076 6.630 1.00 0.00 C ATOM 531 CD2 LEU A 37 102.463 -20.535 4.183 1.00 0.00 C ATOM 0 H LEU A 37 106.691 -20.667 4.956 1.00 0.00 H new ATOM 0 HA LEU A 37 104.654 -19.652 3.039 1.00 0.00 H new ATOM 0 HB2 LEU A 37 104.955 -18.985 5.992 1.00 0.00 H new ATOM 0 HB3 LEU A 37 103.786 -18.292 4.885 1.00 0.00 H new ATOM 0 HG LEU A 37 103.994 -21.274 5.511 1.00 0.00 H new ATOM 0 HD11 LEU A 37 101.916 -20.910 6.822 1.00 0.00 H new ATOM 0 HD12 LEU A 37 103.261 -19.949 7.480 1.00 0.00 H new ATOM 0 HD13 LEU A 37 102.011 -19.165 6.486 1.00 0.00 H new ATOM 0 HD21 LEU A 37 101.788 -21.369 4.374 1.00 0.00 H new ATOM 0 HD22 LEU A 37 101.883 -19.623 4.046 1.00 0.00 H new ATOM 0 HD23 LEU A 37 103.042 -20.736 3.281 1.00 0.00 H new ATOM 543 N GLY A 38 106.096 -17.573 2.696 1.00 0.00 N ATOM 544 CA GLY A 38 107.102 -16.569 2.382 1.00 0.00 C ATOM 545 C GLY A 38 106.767 -15.253 3.061 1.00 0.00 C ATOM 546 O GLY A 38 105.740 -14.648 2.774 1.00 0.00 O ATOM 0 H GLY A 38 105.277 -17.573 2.088 1.00 0.00 H new ATOM 0 HA2 GLY A 38 108.083 -16.914 2.708 1.00 0.00 H new ATOM 0 HA3 GLY A 38 107.157 -16.425 1.303 1.00 0.00 H new ATOM 550 N VAL A 39 107.635 -14.814 3.962 1.00 0.00 N ATOM 551 CA VAL A 39 107.475 -13.504 4.583 1.00 0.00 C ATOM 552 C VAL A 39 108.774 -12.730 4.440 1.00 0.00 C ATOM 553 O VAL A 39 109.848 -13.238 4.757 1.00 0.00 O ATOM 554 CB VAL A 39 107.118 -13.659 6.064 1.00 0.00 C ATOM 555 CG1 VAL A 39 105.771 -14.374 6.191 1.00 0.00 C ATOM 556 CG2 VAL A 39 108.195 -14.483 6.776 1.00 0.00 C ATOM 0 H VAL A 39 108.450 -15.339 4.278 1.00 0.00 H new ATOM 0 HA VAL A 39 106.667 -12.963 4.089 1.00 0.00 H new ATOM 0 HB VAL A 39 107.057 -12.672 6.522 1.00 0.00 H new ATOM 0 HG11 VAL A 39 105.516 -14.485 7.245 1.00 0.00 H new ATOM 0 HG12 VAL A 39 105.000 -13.789 5.691 1.00 0.00 H new ATOM 0 HG13 VAL A 39 105.837 -15.359 5.728 1.00 0.00 H new ATOM 0 HG21 VAL A 39 107.935 -14.589 7.829 1.00 0.00 H new ATOM 0 HG22 VAL A 39 108.261 -15.469 6.317 1.00 0.00 H new ATOM 0 HG23 VAL A 39 109.157 -13.977 6.689 1.00 0.00 H new ATOM 566 N ILE A 40 108.668 -11.493 3.972 1.00 0.00 N ATOM 567 CA ILE A 40 109.850 -10.669 3.754 1.00 0.00 C ATOM 568 C ILE A 40 109.628 -9.254 4.275 1.00 0.00 C ATOM 569 O ILE A 40 108.537 -8.700 4.137 1.00 0.00 O ATOM 570 CB ILE A 40 110.185 -10.656 2.258 1.00 0.00 C ATOM 571 CG1 ILE A 40 111.481 -9.876 2.024 1.00 0.00 C ATOM 572 CG2 ILE A 40 109.047 -10.011 1.461 1.00 0.00 C ATOM 573 CD1 ILE A 40 112.144 -10.358 0.731 1.00 0.00 C ATOM 0 H ILE A 40 107.784 -11.041 3.738 1.00 0.00 H new ATOM 0 HA ILE A 40 110.690 -11.092 4.305 1.00 0.00 H new ATOM 0 HB ILE A 40 110.313 -11.685 1.921 1.00 0.00 H new ATOM 0 HG12 ILE A 40 111.269 -8.809 1.960 1.00 0.00 H new ATOM 0 HG13 ILE A 40 112.159 -10.016 2.866 1.00 0.00 H new ATOM 0 HG21 ILE A 40 109.301 -10.010 0.401 1.00 0.00 H new ATOM 0 HG22 ILE A 40 108.129 -10.578 1.614 1.00 0.00 H new ATOM 0 HG23 ILE A 40 108.901 -8.986 1.800 1.00 0.00 H new ATOM 0 HD11 ILE A 40 113.067 -9.802 0.566 1.00 0.00 H new ATOM 0 HD12 ILE A 40 112.371 -11.421 0.813 1.00 0.00 H new ATOM 0 HD13 ILE A 40 111.467 -10.195 -0.108 1.00 0.00 H new ATOM 585 N GLY A 41 110.667 -8.695 4.887 1.00 0.00 N ATOM 586 CA GLY A 41 110.626 -7.316 5.367 1.00 0.00 C ATOM 587 C GLY A 41 111.746 -6.508 4.722 1.00 0.00 C ATOM 588 O GLY A 41 112.893 -6.954 4.697 1.00 0.00 O ATOM 0 H GLY A 41 111.549 -9.176 5.063 1.00 0.00 H new ATOM 0 HA2 GLY A 41 109.661 -6.868 5.131 1.00 0.00 H new ATOM 0 HA3 GLY A 41 110.730 -7.296 6.452 1.00 0.00 H new ATOM 592 N SER A 42 111.404 -5.335 4.192 1.00 0.00 N ATOM 593 CA SER A 42 112.370 -4.506 3.473 1.00 0.00 C ATOM 594 C SER A 42 112.387 -3.080 4.021 1.00 0.00 C ATOM 595 O SER A 42 111.334 -2.501 4.292 1.00 0.00 O ATOM 596 CB SER A 42 112.004 -4.465 1.989 1.00 0.00 C ATOM 597 OG SER A 42 111.821 -5.792 1.515 1.00 0.00 O ATOM 0 H SER A 42 110.466 -4.937 4.247 1.00 0.00 H new ATOM 0 HA SER A 42 113.359 -4.944 3.607 1.00 0.00 H new ATOM 0 HB2 SER A 42 111.093 -3.885 1.843 1.00 0.00 H new ATOM 0 HB3 SER A 42 112.792 -3.969 1.422 1.00 0.00 H new ATOM 0 HG SER A 42 111.584 -5.770 0.564 1.00 0.00 H new ATOM 603 N PHE A 43 113.583 -2.517 4.183 1.00 0.00 N ATOM 604 CA PHE A 43 113.718 -1.132 4.634 1.00 0.00 C ATOM 605 C PHE A 43 114.440 -0.318 3.567 1.00 0.00 C ATOM 606 O PHE A 43 115.528 -0.694 3.136 1.00 0.00 O ATOM 607 CB PHE A 43 114.512 -1.084 5.940 1.00 0.00 C ATOM 608 CG PHE A 43 113.851 -1.835 7.072 1.00 0.00 C ATOM 609 CD1 PHE A 43 112.877 -1.205 7.857 1.00 0.00 C ATOM 610 CD2 PHE A 43 114.213 -3.161 7.338 1.00 0.00 C ATOM 611 CE1 PHE A 43 112.266 -1.900 8.906 1.00 0.00 C ATOM 612 CE2 PHE A 43 113.601 -3.857 8.387 1.00 0.00 C ATOM 613 CZ PHE A 43 112.628 -3.228 9.171 1.00 0.00 C ATOM 0 H PHE A 43 114.468 -2.994 4.010 1.00 0.00 H new ATOM 0 HA PHE A 43 112.727 -0.712 4.804 1.00 0.00 H new ATOM 0 HB2 PHE A 43 115.505 -1.500 5.769 1.00 0.00 H new ATOM 0 HB3 PHE A 43 114.649 -0.044 6.235 1.00 0.00 H new ATOM 0 HD1 PHE A 43 112.598 -0.182 7.652 1.00 0.00 H new ATOM 0 HD2 PHE A 43 114.965 -3.647 6.734 1.00 0.00 H new ATOM 0 HE1 PHE A 43 111.516 -1.414 9.512 1.00 0.00 H new ATOM 0 HE2 PHE A 43 113.880 -4.880 8.591 1.00 0.00 H new ATOM 0 HZ PHE A 43 112.156 -3.765 9.980 1.00 0.00 H new ATOM 623 N THR A 44 113.852 0.804 3.151 1.00 0.00 N ATOM 624 CA THR A 44 114.429 1.595 2.064 1.00 0.00 C ATOM 625 C THR A 44 114.673 3.032 2.508 1.00 0.00 C ATOM 626 O THR A 44 113.860 3.609 3.230 1.00 0.00 O ATOM 627 CB THR A 44 113.480 1.589 0.863 1.00 0.00 C ATOM 628 OG1 THR A 44 113.166 0.247 0.518 1.00 0.00 O ATOM 629 CG2 THR A 44 114.150 2.278 -0.328 1.00 0.00 C ATOM 0 H THR A 44 112.989 1.181 3.543 1.00 0.00 H new ATOM 0 HA THR A 44 115.384 1.150 1.785 1.00 0.00 H new ATOM 0 HB THR A 44 112.566 2.124 1.121 1.00 0.00 H new ATOM 0 HG1 THR A 44 112.557 0.241 -0.250 1.00 0.00 H new ATOM 0 HG21 THR A 44 113.471 2.272 -1.181 1.00 0.00 H new ATOM 0 HG22 THR A 44 114.392 3.308 -0.064 1.00 0.00 H new ATOM 0 HG23 THR A 44 115.065 1.746 -0.588 1.00 0.00 H new ATOM 637 N TYR A 45 115.793 3.600 2.070 1.00 0.00 N ATOM 638 CA TYR A 45 116.099 4.998 2.358 1.00 0.00 C ATOM 639 C TYR A 45 116.521 5.703 1.076 1.00 0.00 C ATOM 640 O TYR A 45 117.376 5.204 0.344 1.00 0.00 O ATOM 641 CB TYR A 45 117.221 5.095 3.394 1.00 0.00 C ATOM 642 CG TYR A 45 117.505 6.511 3.836 1.00 0.00 C ATOM 643 CD1 TYR A 45 116.739 7.094 4.854 1.00 0.00 C ATOM 644 CD2 TYR A 45 118.531 7.244 3.229 1.00 0.00 C ATOM 645 CE1 TYR A 45 116.999 8.407 5.264 1.00 0.00 C ATOM 646 CE2 TYR A 45 118.792 8.556 3.639 1.00 0.00 C ATOM 647 CZ TYR A 45 118.026 9.138 4.657 1.00 0.00 C ATOM 648 OH TYR A 45 118.284 10.433 5.061 1.00 0.00 O ATOM 0 H TYR A 45 116.501 3.117 1.517 1.00 0.00 H new ATOM 0 HA TYR A 45 115.207 5.478 2.761 1.00 0.00 H new ATOM 0 HB2 TYR A 45 116.955 4.496 4.265 1.00 0.00 H new ATOM 0 HB3 TYR A 45 118.130 4.663 2.976 1.00 0.00 H new ATOM 0 HD1 TYR A 45 115.947 6.530 5.323 1.00 0.00 H new ATOM 0 HD2 TYR A 45 119.122 6.797 2.443 1.00 0.00 H new ATOM 0 HE1 TYR A 45 116.407 8.855 6.048 1.00 0.00 H new ATOM 0 HE2 TYR A 45 119.585 9.120 3.170 1.00 0.00 H new ATOM 0 HH TYR A 45 119.029 10.796 4.538 1.00 0.00 H new ATOM 658 N THR A 46 115.911 6.854 0.809 1.00 0.00 N ATOM 659 CA THR A 46 116.191 7.605 -0.412 1.00 0.00 C ATOM 660 C THR A 46 116.673 9.011 -0.072 1.00 0.00 C ATOM 661 O THR A 46 116.238 9.601 0.920 1.00 0.00 O ATOM 662 CB THR A 46 114.927 7.716 -1.274 1.00 0.00 C ATOM 663 OG1 THR A 46 113.942 8.448 -0.562 1.00 0.00 O ATOM 664 CG2 THR A 46 114.378 6.329 -1.624 1.00 0.00 C ATOM 0 H THR A 46 115.220 7.287 1.421 1.00 0.00 H new ATOM 0 HA THR A 46 116.966 7.073 -0.963 1.00 0.00 H new ATOM 0 HB THR A 46 115.181 8.229 -2.202 1.00 0.00 H new ATOM 0 HG1 THR A 46 113.588 9.161 -1.133 1.00 0.00 H new ATOM 0 HG21 THR A 46 113.482 6.436 -2.235 1.00 0.00 H new ATOM 0 HG22 THR A 46 115.131 5.769 -2.178 1.00 0.00 H new ATOM 0 HG23 THR A 46 114.130 5.794 -0.707 1.00 0.00 H new ATOM 672 N GLU A 47 117.529 9.552 -0.935 1.00 0.00 N ATOM 673 CA GLU A 47 118.080 10.887 -0.744 1.00 0.00 C ATOM 674 C GLU A 47 117.891 11.709 -2.014 1.00 0.00 C ATOM 675 O GLU A 47 117.575 11.159 -3.070 1.00 0.00 O ATOM 676 CB GLU A 47 119.574 10.800 -0.422 1.00 0.00 C ATOM 677 CG GLU A 47 119.787 10.025 0.883 1.00 0.00 C ATOM 678 CD GLU A 47 121.267 9.988 1.283 1.00 0.00 C ATOM 679 OE1 GLU A 47 122.113 10.368 0.485 1.00 0.00 O ATOM 680 OE2 GLU A 47 121.538 9.575 2.398 1.00 0.00 O ATOM 0 H GLU A 47 117.857 9.081 -1.778 1.00 0.00 H new ATOM 0 HA GLU A 47 117.559 11.365 0.086 1.00 0.00 H new ATOM 0 HB2 GLU A 47 120.102 10.306 -1.238 1.00 0.00 H new ATOM 0 HB3 GLU A 47 119.993 11.802 -0.332 1.00 0.00 H new ATOM 0 HG2 GLU A 47 119.206 10.488 1.680 1.00 0.00 H new ATOM 0 HG3 GLU A 47 119.415 9.007 0.767 1.00 0.00 H new ATOM 687 N LYS A 48 118.088 13.017 -1.903 1.00 0.00 N ATOM 688 CA LYS A 48 117.971 13.899 -3.057 1.00 0.00 C ATOM 689 C LYS A 48 119.301 13.974 -3.802 1.00 0.00 C ATOM 690 O LYS A 48 120.362 14.081 -3.187 1.00 0.00 O ATOM 691 CB LYS A 48 117.556 15.301 -2.602 1.00 0.00 C ATOM 692 CG LYS A 48 117.285 16.190 -3.819 1.00 0.00 C ATOM 693 CD LYS A 48 115.942 15.813 -4.450 1.00 0.00 C ATOM 694 CE LYS A 48 115.636 16.768 -5.605 1.00 0.00 C ATOM 695 NZ LYS A 48 114.263 16.501 -6.119 1.00 0.00 N ATOM 0 H LYS A 48 118.328 13.488 -1.031 1.00 0.00 H new ATOM 0 HA LYS A 48 117.211 13.498 -3.728 1.00 0.00 H new ATOM 0 HB2 LYS A 48 116.663 15.241 -1.980 1.00 0.00 H new ATOM 0 HB3 LYS A 48 118.343 15.741 -1.989 1.00 0.00 H new ATOM 0 HG2 LYS A 48 117.275 17.238 -3.520 1.00 0.00 H new ATOM 0 HG3 LYS A 48 118.085 16.075 -4.550 1.00 0.00 H new ATOM 0 HD2 LYS A 48 115.974 14.785 -4.812 1.00 0.00 H new ATOM 0 HD3 LYS A 48 115.150 15.863 -3.703 1.00 0.00 H new ATOM 0 HE2 LYS A 48 115.715 17.801 -5.267 1.00 0.00 H new ATOM 0 HE3 LYS A 48 116.367 16.637 -6.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 114.270 16.531 -7.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 113.950 15.561 -5.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 113.610 17.224 -5.756 1.00 0.00 H new ATOM 709 N SER A 49 119.235 13.917 -5.128 1.00 0.00 N ATOM 710 CA SER A 49 120.441 13.972 -5.947 1.00 0.00 C ATOM 711 C SER A 49 120.652 15.383 -6.486 1.00 0.00 C ATOM 712 O SER A 49 119.691 16.101 -6.764 1.00 0.00 O ATOM 713 CB SER A 49 120.325 12.991 -7.114 1.00 0.00 C ATOM 714 OG SER A 49 121.553 12.973 -7.832 1.00 0.00 O ATOM 0 H SER A 49 118.366 13.833 -5.656 1.00 0.00 H new ATOM 0 HA SER A 49 121.294 13.697 -5.327 1.00 0.00 H new ATOM 0 HB2 SER A 49 120.091 11.993 -6.744 1.00 0.00 H new ATOM 0 HB3 SER A 49 119.508 13.286 -7.773 1.00 0.00 H new ATOM 0 HG SER A 49 121.485 12.344 -8.581 1.00 0.00 H new ATOM 720 N ARG A 50 121.913 15.776 -6.630 1.00 0.00 N ATOM 721 CA ARG A 50 122.232 17.118 -7.101 1.00 0.00 C ATOM 722 C ARG A 50 121.864 17.273 -8.574 1.00 0.00 C ATOM 723 O ARG A 50 122.154 16.401 -9.393 1.00 0.00 O ATOM 724 CB ARG A 50 123.724 17.398 -6.911 1.00 0.00 C ATOM 725 CG ARG A 50 124.023 18.857 -7.263 1.00 0.00 C ATOM 726 CD ARG A 50 125.529 19.105 -7.175 1.00 0.00 C ATOM 727 NE ARG A 50 126.006 18.850 -5.813 1.00 0.00 N ATOM 728 CZ ARG A 50 127.304 18.842 -5.472 1.00 0.00 C ATOM 729 NH1 ARG A 50 128.258 19.065 -6.343 1.00 0.00 N ATOM 730 NH2 ARG A 50 127.627 18.604 -4.231 1.00 0.00 N ATOM 0 H ARG A 50 122.724 15.190 -6.429 1.00 0.00 H new ATOM 0 HA ARG A 50 121.652 17.834 -6.518 1.00 0.00 H new ATOM 0 HB2 ARG A 50 124.014 17.196 -5.880 1.00 0.00 H new ATOM 0 HB3 ARG A 50 124.312 16.733 -7.543 1.00 0.00 H new ATOM 0 HG2 ARG A 50 123.665 19.080 -8.268 1.00 0.00 H new ATOM 0 HG3 ARG A 50 123.494 19.522 -6.581 1.00 0.00 H new ATOM 0 HD2 ARG A 50 126.053 18.458 -7.879 1.00 0.00 H new ATOM 0 HD3 ARG A 50 125.753 20.133 -7.460 1.00 0.00 H new ATOM 0 HE ARG A 50 125.315 18.669 -5.085 1.00 0.00 H new ATOM 0 HH11 ARG A 50 128.025 19.253 -7.318 1.00 0.00 H new ATOM 0 HH12 ARG A 50 129.234 19.051 -6.046 1.00 0.00 H new ATOM 0 HH21 ARG A 50 126.898 18.428 -3.539 1.00 0.00 H new ATOM 0 HH22 ARG A 50 128.608 18.594 -3.952 1.00 0.00 H new ATOM 744 N THR A 51 121.223 18.390 -8.897 1.00 0.00 N ATOM 745 CA THR A 51 120.809 18.668 -10.270 1.00 0.00 C ATOM 746 C THR A 51 121.215 20.083 -10.669 1.00 0.00 C ATOM 747 O THR A 51 121.250 20.984 -9.830 1.00 0.00 O ATOM 748 CB THR A 51 119.292 18.512 -10.399 1.00 0.00 C ATOM 749 OG1 THR A 51 118.910 17.228 -9.928 1.00 0.00 O ATOM 750 CG2 THR A 51 118.885 18.660 -11.866 1.00 0.00 C ATOM 0 H THR A 51 120.978 19.119 -8.227 1.00 0.00 H new ATOM 0 HA THR A 51 121.302 17.958 -10.934 1.00 0.00 H new ATOM 0 HB THR A 51 118.795 19.281 -9.807 1.00 0.00 H new ATOM 0 HG1 THR A 51 117.939 17.126 -10.008 1.00 0.00 H new ATOM 0 HG21 THR A 51 117.805 18.549 -11.957 1.00 0.00 H new ATOM 0 HG22 THR A 51 119.180 19.645 -12.228 1.00 0.00 H new ATOM 0 HG23 THR A 51 119.380 17.892 -12.460 1.00 0.00 H new ATOM 758 N ALA A 52 121.521 20.274 -11.949 1.00 0.00 N ATOM 759 CA ALA A 52 121.905 21.593 -12.435 1.00 0.00 C ATOM 760 C ALA A 52 120.679 22.497 -12.515 1.00 0.00 C ATOM 761 O ALA A 52 119.676 22.146 -13.136 1.00 0.00 O ATOM 762 CB ALA A 52 122.549 21.475 -13.818 1.00 0.00 C ATOM 0 H ALA A 52 121.511 19.542 -12.659 1.00 0.00 H new ATOM 0 HA ALA A 52 122.625 22.027 -11.741 1.00 0.00 H new ATOM 0 HB1 ALA A 52 122.833 22.466 -14.173 1.00 0.00 H new ATOM 0 HB2 ALA A 52 123.436 20.845 -13.754 1.00 0.00 H new ATOM 0 HB3 ALA A 52 121.838 21.030 -14.514 1.00 0.00 H new ATOM 768 N SER A 53 120.770 23.661 -11.882 1.00 0.00 N ATOM 769 CA SER A 53 119.637 24.577 -11.822 1.00 0.00 C ATOM 770 C SER A 53 120.113 26.010 -11.602 1.00 0.00 C ATOM 771 O SER A 53 121.313 26.283 -11.596 1.00 0.00 O ATOM 772 CB SER A 53 118.698 24.166 -10.687 1.00 0.00 C ATOM 773 OG SER A 53 119.321 24.447 -9.441 1.00 0.00 O ATOM 0 H SER A 53 121.610 23.991 -11.406 1.00 0.00 H new ATOM 0 HA SER A 53 119.104 24.530 -12.771 1.00 0.00 H new ATOM 0 HB2 SER A 53 117.755 24.706 -10.766 1.00 0.00 H new ATOM 0 HB3 SER A 53 118.464 23.104 -10.759 1.00 0.00 H new ATOM 0 HG SER A 53 118.722 24.187 -8.710 1.00 0.00 H new ATOM 779 N SER A 54 119.161 26.922 -11.423 1.00 0.00 N ATOM 780 CA SER A 54 119.486 28.330 -11.200 1.00 0.00 C ATOM 781 C SER A 54 119.870 28.628 -9.744 1.00 0.00 C ATOM 782 O SER A 54 119.845 29.786 -9.328 1.00 0.00 O ATOM 783 CB SER A 54 118.291 29.199 -11.592 1.00 0.00 C ATOM 784 OG SER A 54 117.301 29.117 -10.576 1.00 0.00 O ATOM 0 H SER A 54 118.162 26.714 -11.428 1.00 0.00 H new ATOM 0 HA SER A 54 120.352 28.560 -11.820 1.00 0.00 H new ATOM 0 HB2 SER A 54 118.607 30.234 -11.726 1.00 0.00 H new ATOM 0 HB3 SER A 54 117.880 28.865 -12.545 1.00 0.00 H new ATOM 0 HG SER A 54 117.200 28.185 -10.292 1.00 0.00 H new ATOM 790 N GLY A 55 120.221 27.602 -8.968 1.00 0.00 N ATOM 791 CA GLY A 55 120.610 27.803 -7.572 1.00 0.00 C ATOM 792 C GLY A 55 119.512 27.419 -6.571 1.00 0.00 C ATOM 793 O GLY A 55 119.751 27.445 -5.363 1.00 0.00 O ATOM 0 H GLY A 55 120.244 26.631 -9.279 1.00 0.00 H new ATOM 0 HA2 GLY A 55 121.503 27.214 -7.363 1.00 0.00 H new ATOM 0 HA3 GLY A 55 120.876 28.850 -7.424 1.00 0.00 H new ATOM 797 N ASP A 56 118.319 27.066 -7.053 1.00 0.00 N ATOM 798 CA ASP A 56 117.241 26.646 -6.164 1.00 0.00 C ATOM 799 C ASP A 56 117.279 25.134 -5.961 1.00 0.00 C ATOM 800 O ASP A 56 117.027 24.367 -6.890 1.00 0.00 O ATOM 801 CB ASP A 56 115.887 27.060 -6.746 1.00 0.00 C ATOM 802 CG ASP A 56 115.728 26.509 -8.160 1.00 0.00 C ATOM 803 OD1 ASP A 56 116.115 27.200 -9.090 1.00 0.00 O ATOM 804 OD2 ASP A 56 115.223 25.408 -8.294 1.00 0.00 O ATOM 0 H ASP A 56 118.079 27.063 -8.044 1.00 0.00 H new ATOM 0 HA ASP A 56 117.377 27.133 -5.199 1.00 0.00 H new ATOM 0 HB2 ASP A 56 115.082 26.689 -6.111 1.00 0.00 H new ATOM 0 HB3 ASP A 56 115.807 28.147 -6.761 1.00 0.00 H new ATOM 809 N TYR A 57 117.603 24.710 -4.743 1.00 0.00 N ATOM 810 CA TYR A 57 117.687 23.287 -4.431 1.00 0.00 C ATOM 811 C TYR A 57 116.957 22.974 -3.128 1.00 0.00 C ATOM 812 O TYR A 57 117.113 23.681 -2.132 1.00 0.00 O ATOM 813 CB TYR A 57 119.154 22.869 -4.304 1.00 0.00 C ATOM 814 CG TYR A 57 119.340 21.390 -4.063 1.00 0.00 C ATOM 815 CD1 TYR A 57 119.375 20.503 -5.145 1.00 0.00 C ATOM 816 CD2 TYR A 57 119.476 20.906 -2.756 1.00 0.00 C ATOM 817 CE1 TYR A 57 119.548 19.132 -4.921 1.00 0.00 C ATOM 818 CE2 TYR A 57 119.648 19.535 -2.532 1.00 0.00 C ATOM 819 CZ TYR A 57 119.684 18.648 -3.615 1.00 0.00 C ATOM 820 OH TYR A 57 119.854 17.296 -3.394 1.00 0.00 O ATOM 0 H TYR A 57 117.811 25.328 -3.959 1.00 0.00 H new ATOM 0 HA TYR A 57 117.214 22.731 -5.240 1.00 0.00 H new ATOM 0 HB2 TYR A 57 119.684 23.150 -5.214 1.00 0.00 H new ATOM 0 HB3 TYR A 57 119.612 23.423 -3.485 1.00 0.00 H new ATOM 0 HD1 TYR A 57 119.269 20.876 -6.153 1.00 0.00 H new ATOM 0 HD2 TYR A 57 119.448 21.590 -1.921 1.00 0.00 H new ATOM 0 HE1 TYR A 57 119.577 18.448 -5.756 1.00 0.00 H new ATOM 0 HE2 TYR A 57 119.753 19.161 -1.524 1.00 0.00 H new ATOM 0 HH TYR A 57 120.169 17.151 -2.477 1.00 0.00 H new ATOM 830 N ASN A 58 116.158 21.910 -3.145 1.00 0.00 N ATOM 831 CA ASN A 58 115.429 21.481 -1.954 1.00 0.00 C ATOM 832 C ASN A 58 115.902 20.101 -1.511 1.00 0.00 C ATOM 833 O ASN A 58 115.978 19.174 -2.318 1.00 0.00 O ATOM 834 CB ASN A 58 113.929 21.433 -2.252 1.00 0.00 C ATOM 835 CG ASN A 58 113.439 22.809 -2.690 1.00 0.00 C ATOM 836 OD1 ASN A 58 112.714 22.925 -3.678 1.00 0.00 O ATOM 837 ND2 ASN A 58 113.793 23.865 -2.011 1.00 0.00 N ATOM 0 H ASN A 58 115.999 21.330 -3.969 1.00 0.00 H new ATOM 0 HA ASN A 58 115.619 22.196 -1.154 1.00 0.00 H new ATOM 0 HB2 ASN A 58 113.729 20.701 -3.034 1.00 0.00 H new ATOM 0 HB3 ASN A 58 113.384 21.109 -1.365 1.00 0.00 H new ATOM 0 HD21 ASN A 58 113.469 24.788 -2.299 1.00 0.00 H new ATOM 0 HD22 ASN A 58 114.394 23.767 -1.193 1.00 0.00 H new ATOM 844 N LYS A 59 116.221 19.968 -0.228 1.00 0.00 N ATOM 845 CA LYS A 59 116.674 18.687 0.304 1.00 0.00 C ATOM 846 C LYS A 59 115.478 17.824 0.693 1.00 0.00 C ATOM 847 O LYS A 59 114.616 18.250 1.463 1.00 0.00 O ATOM 848 CB LYS A 59 117.570 18.915 1.523 1.00 0.00 C ATOM 849 CG LYS A 59 118.207 17.590 1.946 1.00 0.00 C ATOM 850 CD LYS A 59 119.041 17.807 3.210 1.00 0.00 C ATOM 851 CE LYS A 59 119.817 16.529 3.536 1.00 0.00 C ATOM 852 NZ LYS A 59 120.284 16.578 4.949 1.00 0.00 N ATOM 0 H LYS A 59 116.175 20.722 0.457 1.00 0.00 H new ATOM 0 HA LYS A 59 117.245 18.170 -0.467 1.00 0.00 H new ATOM 0 HB2 LYS A 59 118.345 19.644 1.286 1.00 0.00 H new ATOM 0 HB3 LYS A 59 116.985 19.328 2.345 1.00 0.00 H new ATOM 0 HG2 LYS A 59 117.433 16.845 2.131 1.00 0.00 H new ATOM 0 HG3 LYS A 59 118.836 17.204 1.144 1.00 0.00 H new ATOM 0 HD2 LYS A 59 119.732 18.637 3.064 1.00 0.00 H new ATOM 0 HD3 LYS A 59 118.393 18.074 4.045 1.00 0.00 H new ATOM 0 HE2 LYS A 59 119.182 15.656 3.382 1.00 0.00 H new ATOM 0 HE3 LYS A 59 120.669 16.427 2.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 120.811 15.709 5.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 120.904 17.403 5.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 119.464 16.656 5.583 1.00 0.00 H new ATOM 866 N ASN A 60 115.430 16.609 0.155 1.00 0.00 N ATOM 867 CA ASN A 60 114.305 15.708 0.396 1.00 0.00 C ATOM 868 C ASN A 60 114.789 14.344 0.879 1.00 0.00 C ATOM 869 O ASN A 60 115.624 13.710 0.232 1.00 0.00 O ATOM 870 CB ASN A 60 113.508 15.534 -0.899 1.00 0.00 C ATOM 871 CG ASN A 60 112.238 14.730 -0.642 1.00 0.00 C ATOM 872 OD1 ASN A 60 111.769 14.644 0.494 1.00 0.00 O ATOM 873 ND2 ASN A 60 111.649 14.132 -1.641 1.00 0.00 N ATOM 0 H ASN A 60 116.156 16.225 -0.450 1.00 0.00 H new ATOM 0 HA ASN A 60 113.674 16.144 1.170 1.00 0.00 H new ATOM 0 HB2 ASN A 60 113.250 16.511 -1.308 1.00 0.00 H new ATOM 0 HB3 ASN A 60 114.121 15.028 -1.645 1.00 0.00 H new ATOM 0 HD21 ASN A 60 110.798 13.592 -1.482 1.00 0.00 H new ATOM 0 HD22 ASN A 60 112.039 14.205 -2.581 1.00 0.00 H new ATOM 880 N GLN A 61 114.264 13.892 2.017 1.00 0.00 N ATOM 881 CA GLN A 61 114.608 12.568 2.535 1.00 0.00 C ATOM 882 C GLN A 61 113.346 11.743 2.755 1.00 0.00 C ATOM 883 O GLN A 61 112.317 12.287 3.150 1.00 0.00 O ATOM 884 CB GLN A 61 115.362 12.703 3.860 1.00 0.00 C ATOM 885 CG GLN A 61 116.703 13.403 3.623 1.00 0.00 C ATOM 886 CD GLN A 61 117.431 13.624 4.947 1.00 0.00 C ATOM 887 OE1 GLN A 61 116.817 13.598 6.015 1.00 0.00 O ATOM 888 NE2 GLN A 61 118.718 13.837 4.942 1.00 0.00 N ATOM 0 H GLN A 61 113.606 14.416 2.593 1.00 0.00 H new ATOM 0 HA GLN A 61 115.243 12.065 1.805 1.00 0.00 H new ATOM 0 HB2 GLN A 61 114.765 13.272 4.573 1.00 0.00 H new ATOM 0 HB3 GLN A 61 115.527 11.718 4.297 1.00 0.00 H new ATOM 0 HG2 GLN A 61 117.321 12.801 2.957 1.00 0.00 H new ATOM 0 HG3 GLN A 61 116.538 14.360 3.127 1.00 0.00 H new ATOM 0 HE21 GLN A 61 119.228 13.859 4.059 1.00 0.00 H new ATOM 0 HE22 GLN A 61 119.214 13.982 5.821 1.00 0.00 H new ATOM 897 N TYR A 62 113.432 10.438 2.498 1.00 0.00 N ATOM 898 CA TYR A 62 112.293 9.544 2.709 1.00 0.00 C ATOM 899 C TYR A 62 112.754 8.182 3.237 1.00 0.00 C ATOM 900 O TYR A 62 113.808 7.685 2.848 1.00 0.00 O ATOM 901 CB TYR A 62 111.522 9.363 1.394 1.00 0.00 C ATOM 902 CG TYR A 62 110.429 10.383 1.176 1.00 0.00 C ATOM 903 CD1 TYR A 62 110.738 11.653 0.674 1.00 0.00 C ATOM 904 CD2 TYR A 62 109.099 10.048 1.461 1.00 0.00 C ATOM 905 CE1 TYR A 62 109.717 12.587 0.459 1.00 0.00 C ATOM 906 CE2 TYR A 62 108.079 10.983 1.248 1.00 0.00 C ATOM 907 CZ TYR A 62 108.388 12.253 0.746 1.00 0.00 C ATOM 908 OH TYR A 62 107.382 13.174 0.533 1.00 0.00 O ATOM 0 H TYR A 62 114.272 9.979 2.146 1.00 0.00 H new ATOM 0 HA TYR A 62 111.637 9.994 3.454 1.00 0.00 H new ATOM 0 HB2 TYR A 62 112.225 9.416 0.563 1.00 0.00 H new ATOM 0 HB3 TYR A 62 111.083 8.366 1.377 1.00 0.00 H new ATOM 0 HD1 TYR A 62 111.763 11.912 0.453 1.00 0.00 H new ATOM 0 HD2 TYR A 62 108.860 9.067 1.845 1.00 0.00 H new ATOM 0 HE1 TYR A 62 109.955 13.566 0.071 1.00 0.00 H new ATOM 0 HE2 TYR A 62 107.054 10.725 1.471 1.00 0.00 H new ATOM 0 HH TYR A 62 107.740 14.080 0.638 1.00 0.00 H new ATOM 918 N TYR A 63 111.949 7.583 4.114 1.00 0.00 N ATOM 919 CA TYR A 63 112.220 6.236 4.613 1.00 0.00 C ATOM 920 C TYR A 63 110.928 5.425 4.620 1.00 0.00 C ATOM 921 O TYR A 63 109.874 5.957 4.966 1.00 0.00 O ATOM 922 CB TYR A 63 112.801 6.315 6.027 1.00 0.00 C ATOM 923 CG TYR A 63 113.166 4.972 6.614 1.00 0.00 C ATOM 924 CD1 TYR A 63 114.451 4.449 6.424 1.00 0.00 C ATOM 925 CD2 TYR A 63 112.220 4.250 7.352 1.00 0.00 C ATOM 926 CE1 TYR A 63 114.791 3.206 6.972 1.00 0.00 C ATOM 927 CE2 TYR A 63 112.560 3.008 7.900 1.00 0.00 C ATOM 928 CZ TYR A 63 113.845 2.486 7.710 1.00 0.00 C ATOM 929 OH TYR A 63 114.180 1.262 8.252 1.00 0.00 O ATOM 0 H TYR A 63 111.104 8.010 4.493 1.00 0.00 H new ATOM 0 HA TYR A 63 112.944 5.746 3.962 1.00 0.00 H new ATOM 0 HB2 TYR A 63 113.689 6.947 6.010 1.00 0.00 H new ATOM 0 HB3 TYR A 63 112.077 6.801 6.680 1.00 0.00 H new ATOM 0 HD1 TYR A 63 115.181 5.005 5.854 1.00 0.00 H new ATOM 0 HD2 TYR A 63 111.228 4.652 7.498 1.00 0.00 H new ATOM 0 HE1 TYR A 63 115.782 2.803 6.825 1.00 0.00 H new ATOM 0 HE2 TYR A 63 111.830 2.452 8.470 1.00 0.00 H new ATOM 0 HH TYR A 63 113.364 0.776 8.493 1.00 0.00 H new ATOM 939 N GLY A 64 110.998 4.146 4.244 1.00 0.00 N ATOM 940 CA GLY A 64 109.784 3.341 4.104 1.00 0.00 C ATOM 941 C GLY A 64 109.964 1.932 4.660 1.00 0.00 C ATOM 942 O GLY A 64 111.000 1.303 4.444 1.00 0.00 O ATOM 0 H GLY A 64 111.866 3.653 4.034 1.00 0.00 H new ATOM 0 HA2 GLY A 64 108.961 3.833 4.623 1.00 0.00 H new ATOM 0 HA3 GLY A 64 109.507 3.283 3.051 1.00 0.00 H new ATOM 946 N ILE A 65 108.952 1.452 5.384 1.00 0.00 N ATOM 947 CA ILE A 65 108.975 0.099 5.934 1.00 0.00 C ATOM 948 C ILE A 65 107.853 -0.714 5.299 1.00 0.00 C ATOM 949 O ILE A 65 106.712 -0.258 5.252 1.00 0.00 O ATOM 950 CB ILE A 65 108.784 0.137 7.455 1.00 0.00 C ATOM 951 CG1 ILE A 65 109.858 1.025 8.089 1.00 0.00 C ATOM 952 CG2 ILE A 65 108.904 -1.279 8.025 1.00 0.00 C ATOM 953 CD1 ILE A 65 109.567 1.196 9.582 1.00 0.00 C ATOM 0 H ILE A 65 108.107 1.981 5.602 1.00 0.00 H new ATOM 0 HA ILE A 65 109.939 -0.360 5.715 1.00 0.00 H new ATOM 0 HB ILE A 65 107.797 0.540 7.679 1.00 0.00 H new ATOM 0 HG12 ILE A 65 110.843 0.579 7.949 1.00 0.00 H new ATOM 0 HG13 ILE A 65 109.876 1.998 7.598 1.00 0.00 H new ATOM 0 HG21 ILE A 65 108.768 -1.249 9.106 1.00 0.00 H new ATOM 0 HG22 ILE A 65 108.139 -1.916 7.581 1.00 0.00 H new ATOM 0 HG23 ILE A 65 109.890 -1.682 7.795 1.00 0.00 H new ATOM 0 HD11 ILE A 65 110.332 1.828 10.032 1.00 0.00 H new ATOM 0 HD12 ILE A 65 108.590 1.661 9.711 1.00 0.00 H new ATOM 0 HD13 ILE A 65 109.571 0.220 10.068 1.00 0.00 H new ATOM 965 N THR A 66 108.176 -1.905 4.799 1.00 0.00 N ATOM 966 CA THR A 66 107.177 -2.732 4.128 1.00 0.00 C ATOM 967 C THR A 66 107.331 -4.209 4.486 1.00 0.00 C ATOM 968 O THR A 66 108.388 -4.649 4.937 1.00 0.00 O ATOM 969 CB THR A 66 107.279 -2.530 2.611 1.00 0.00 C ATOM 970 OG1 THR A 66 106.223 -3.230 1.972 1.00 0.00 O ATOM 971 CG2 THR A 66 108.628 -3.036 2.088 1.00 0.00 C ATOM 0 H THR A 66 109.109 -2.314 4.845 1.00 0.00 H new ATOM 0 HA THR A 66 106.190 -2.420 4.470 1.00 0.00 H new ATOM 0 HB THR A 66 107.202 -1.465 2.391 1.00 0.00 H new ATOM 0 HG1 THR A 66 105.446 -3.265 2.568 1.00 0.00 H new ATOM 0 HG21 THR A 66 108.681 -2.884 1.010 1.00 0.00 H new ATOM 0 HG22 THR A 66 109.435 -2.486 2.572 1.00 0.00 H new ATOM 0 HG23 THR A 66 108.729 -4.098 2.310 1.00 0.00 H new ATOM 979 N ALA A 67 106.257 -4.965 4.275 1.00 0.00 N ATOM 980 CA ALA A 67 106.269 -6.405 4.506 1.00 0.00 C ATOM 981 C ALA A 67 105.289 -7.067 3.546 1.00 0.00 C ATOM 982 O ALA A 67 104.303 -6.443 3.153 1.00 0.00 O ATOM 983 CB ALA A 67 105.871 -6.713 5.951 1.00 0.00 C ATOM 0 H ALA A 67 105.364 -4.601 3.943 1.00 0.00 H new ATOM 0 HA ALA A 67 107.273 -6.792 4.334 1.00 0.00 H new ATOM 0 HB1 ALA A 67 105.884 -7.791 6.110 1.00 0.00 H new ATOM 0 HB2 ALA A 67 106.577 -6.237 6.632 1.00 0.00 H new ATOM 0 HB3 ALA A 67 104.868 -6.330 6.142 1.00 0.00 H new ATOM 989 N GLY A 68 105.563 -8.311 3.152 1.00 0.00 N ATOM 990 CA GLY A 68 104.708 -8.977 2.172 1.00 0.00 C ATOM 991 C GLY A 68 104.664 -10.504 2.349 1.00 0.00 C ATOM 992 O GLY A 68 105.684 -11.097 2.703 1.00 0.00 O ATOM 0 H GLY A 68 106.351 -8.866 3.487 1.00 0.00 H new ATOM 0 HA2 GLY A 68 103.696 -8.579 2.251 1.00 0.00 H new ATOM 0 HA3 GLY A 68 105.065 -8.744 1.169 1.00 0.00 H new ATOM 996 N PRO A 69 103.527 -11.151 2.151 1.00 0.00 N ATOM 997 CA PRO A 69 103.481 -12.640 2.012 1.00 0.00 C ATOM 998 C PRO A 69 103.986 -13.093 0.641 1.00 0.00 C ATOM 999 O PRO A 69 104.047 -12.283 -0.288 1.00 0.00 O ATOM 1000 CB PRO A 69 102.004 -12.994 2.187 1.00 0.00 C ATOM 1001 CG PRO A 69 101.264 -11.784 1.736 1.00 0.00 C ATOM 1002 CD PRO A 69 102.163 -10.589 2.049 1.00 0.00 C ATOM 0 HA PRO A 69 104.122 -13.135 2.742 1.00 0.00 H new ATOM 0 HB2 PRO A 69 101.734 -13.867 1.592 1.00 0.00 H new ATOM 0 HB3 PRO A 69 101.775 -13.233 3.226 1.00 0.00 H new ATOM 0 HG2 PRO A 69 101.045 -11.837 0.669 1.00 0.00 H new ATOM 0 HG3 PRO A 69 100.308 -11.698 2.253 1.00 0.00 H new ATOM 0 HD2 PRO A 69 102.105 -9.835 1.264 1.00 0.00 H new ATOM 0 HD3 PRO A 69 101.865 -10.104 2.979 1.00 0.00 H new ATOM 1010 N ALA A 70 104.325 -14.379 0.494 1.00 0.00 N ATOM 1011 CA ALA A 70 104.773 -14.892 -0.802 1.00 0.00 C ATOM 1012 C ALA A 70 104.072 -16.208 -1.131 1.00 0.00 C ATOM 1013 O ALA A 70 103.630 -16.929 -0.237 1.00 0.00 O ATOM 1014 CB ALA A 70 106.294 -15.088 -0.797 1.00 0.00 C ATOM 0 H ALA A 70 104.298 -15.071 1.243 1.00 0.00 H new ATOM 0 HA ALA A 70 104.514 -14.163 -1.570 1.00 0.00 H new ATOM 0 HB1 ALA A 70 106.615 -15.470 -1.766 1.00 0.00 H new ATOM 0 HB2 ALA A 70 106.783 -14.133 -0.603 1.00 0.00 H new ATOM 0 HB3 ALA A 70 106.567 -15.800 -0.018 1.00 0.00 H new ATOM 1020 N TYR A 71 103.975 -16.515 -2.424 1.00 0.00 N ATOM 1021 CA TYR A 71 103.330 -17.747 -2.869 1.00 0.00 C ATOM 1022 C TYR A 71 104.330 -18.616 -3.622 1.00 0.00 C ATOM 1023 O TYR A 71 104.972 -18.154 -4.568 1.00 0.00 O ATOM 1024 CB TYR A 71 102.148 -17.419 -3.783 1.00 0.00 C ATOM 1025 CG TYR A 71 101.085 -16.581 -3.113 1.00 0.00 C ATOM 1026 CD1 TYR A 71 100.132 -17.190 -2.286 1.00 0.00 C ATOM 1027 CD2 TYR A 71 101.051 -15.197 -3.318 1.00 0.00 C ATOM 1028 CE1 TYR A 71 99.146 -16.414 -1.666 1.00 0.00 C ATOM 1029 CE2 TYR A 71 100.065 -14.421 -2.696 1.00 0.00 C ATOM 1030 CZ TYR A 71 99.112 -15.030 -1.871 1.00 0.00 C ATOM 1031 OH TYR A 71 98.140 -14.265 -1.259 1.00 0.00 O ATOM 0 H TYR A 71 104.334 -15.929 -3.178 1.00 0.00 H new ATOM 0 HA TYR A 71 102.969 -18.289 -1.995 1.00 0.00 H new ATOM 0 HB2 TYR A 71 102.515 -16.891 -4.663 1.00 0.00 H new ATOM 0 HB3 TYR A 71 101.700 -18.349 -4.133 1.00 0.00 H new ATOM 0 HD1 TYR A 71 100.158 -18.258 -2.127 1.00 0.00 H new ATOM 0 HD2 TYR A 71 101.785 -14.727 -3.956 1.00 0.00 H new ATOM 0 HE1 TYR A 71 98.411 -16.883 -1.029 1.00 0.00 H new ATOM 0 HE2 TYR A 71 100.040 -13.353 -2.853 1.00 0.00 H new ATOM 0 HH TYR A 71 98.260 -13.324 -1.506 1.00 0.00 H new ATOM 1041 N ARG A 72 104.474 -19.858 -3.166 1.00 0.00 N ATOM 1042 CA ARG A 72 105.380 -20.815 -3.794 1.00 0.00 C ATOM 1043 C ARG A 72 104.589 -21.967 -4.409 1.00 0.00 C ATOM 1044 O ARG A 72 103.619 -22.437 -3.818 1.00 0.00 O ATOM 1045 CB ARG A 72 106.359 -21.377 -2.757 1.00 0.00 C ATOM 1046 CG ARG A 72 107.107 -20.242 -2.047 1.00 0.00 C ATOM 1047 CD ARG A 72 108.106 -19.582 -3.001 1.00 0.00 C ATOM 1048 NE ARG A 72 109.157 -20.534 -3.377 1.00 0.00 N ATOM 1049 CZ ARG A 72 110.401 -20.167 -3.717 1.00 0.00 C ATOM 1050 NH1 ARG A 72 110.778 -18.912 -3.748 1.00 0.00 N ATOM 1051 NH2 ARG A 72 111.267 -21.092 -4.030 1.00 0.00 N ATOM 0 H ARG A 72 103.971 -20.226 -2.359 1.00 0.00 H new ATOM 0 HA ARG A 72 105.936 -20.298 -4.576 1.00 0.00 H new ATOM 0 HB2 ARG A 72 105.817 -21.976 -2.025 1.00 0.00 H new ATOM 0 HB3 ARG A 72 107.073 -22.040 -3.245 1.00 0.00 H new ATOM 0 HG2 ARG A 72 106.396 -19.500 -1.685 1.00 0.00 H new ATOM 0 HG3 ARG A 72 107.631 -20.633 -1.175 1.00 0.00 H new ATOM 0 HD2 ARG A 72 107.589 -19.230 -3.893 1.00 0.00 H new ATOM 0 HD3 ARG A 72 108.551 -18.708 -2.525 1.00 0.00 H new ATOM 0 HE ARG A 72 108.929 -21.528 -3.380 1.00 0.00 H new ATOM 0 HH11 ARG A 72 110.116 -18.174 -3.508 1.00 0.00 H new ATOM 0 HH12 ARG A 72 111.734 -18.673 -4.012 1.00 0.00 H new ATOM 0 HH21 ARG A 72 110.993 -22.074 -4.013 1.00 0.00 H new ATOM 0 HH22 ARG A 72 112.218 -20.833 -4.291 1.00 0.00 H new ATOM 1065 N ILE A 73 104.993 -22.384 -5.611 1.00 0.00 N ATOM 1066 CA ILE A 73 104.421 -23.550 -6.303 1.00 0.00 C ATOM 1067 C ILE A 73 103.094 -23.231 -6.998 1.00 0.00 C ATOM 1068 O ILE A 73 102.775 -23.850 -8.014 1.00 0.00 O ATOM 1069 CB ILE A 73 104.231 -24.754 -5.364 1.00 0.00 C ATOM 1070 CG1 ILE A 73 105.533 -25.033 -4.605 1.00 0.00 C ATOM 1071 CG2 ILE A 73 103.871 -25.989 -6.193 1.00 0.00 C ATOM 1072 CD1 ILE A 73 105.291 -26.119 -3.554 1.00 0.00 C ATOM 0 H ILE A 73 105.732 -21.921 -6.139 1.00 0.00 H new ATOM 0 HA ILE A 73 105.153 -23.816 -7.066 1.00 0.00 H new ATOM 0 HB ILE A 73 103.434 -24.531 -4.655 1.00 0.00 H new ATOM 0 HG12 ILE A 73 106.310 -25.352 -5.300 1.00 0.00 H new ATOM 0 HG13 ILE A 73 105.889 -24.121 -4.125 1.00 0.00 H new ATOM 0 HG21 ILE A 73 103.736 -26.845 -5.531 1.00 0.00 H new ATOM 0 HG22 ILE A 73 102.947 -25.803 -6.740 1.00 0.00 H new ATOM 0 HG23 ILE A 73 104.674 -26.200 -6.899 1.00 0.00 H new ATOM 0 HD11 ILE A 73 106.218 -26.317 -3.015 1.00 0.00 H new ATOM 0 HD12 ILE A 73 104.528 -25.783 -2.852 1.00 0.00 H new ATOM 0 HD13 ILE A 73 104.955 -27.032 -4.045 1.00 0.00 H new ATOM 1084 N ASN A 74 102.319 -22.283 -6.473 1.00 0.00 N ATOM 1085 CA ASN A 74 101.036 -21.930 -7.080 1.00 0.00 C ATOM 1086 C ASN A 74 101.201 -21.584 -8.560 1.00 0.00 C ATOM 1087 O ASN A 74 100.343 -21.909 -9.382 1.00 0.00 O ATOM 1088 CB ASN A 74 100.422 -20.739 -6.344 1.00 0.00 C ATOM 1089 CG ASN A 74 98.964 -20.566 -6.755 1.00 0.00 C ATOM 1090 OD1 ASN A 74 98.144 -21.455 -6.525 1.00 0.00 O ATOM 1091 ND2 ASN A 74 98.590 -19.468 -7.353 1.00 0.00 N ATOM 0 H ASN A 74 102.554 -21.750 -5.636 1.00 0.00 H new ATOM 0 HA ASN A 74 100.376 -22.794 -6.999 1.00 0.00 H new ATOM 0 HB2 ASN A 74 100.489 -20.893 -5.267 1.00 0.00 H new ATOM 0 HB3 ASN A 74 100.982 -19.832 -6.572 1.00 0.00 H new ATOM 0 HD21 ASN A 74 97.616 -19.345 -7.631 1.00 0.00 H new ATOM 0 HD22 ASN A 74 99.271 -18.733 -7.542 1.00 0.00 H new ATOM 1098 N ASP A 75 102.306 -20.925 -8.892 1.00 0.00 N ATOM 1099 CA ASP A 75 102.592 -20.569 -10.276 1.00 0.00 C ATOM 1100 C ASP A 75 104.093 -20.634 -10.540 1.00 0.00 C ATOM 1101 O ASP A 75 104.878 -20.900 -9.629 1.00 0.00 O ATOM 1102 CB ASP A 75 102.067 -19.160 -10.577 1.00 0.00 C ATOM 1103 CG ASP A 75 102.680 -18.116 -9.640 1.00 0.00 C ATOM 1104 OD1 ASP A 75 103.697 -18.396 -9.022 1.00 0.00 O ATOM 1105 OD2 ASP A 75 102.117 -17.038 -9.554 1.00 0.00 O ATOM 0 H ASP A 75 103.016 -20.627 -8.223 1.00 0.00 H new ATOM 0 HA ASP A 75 102.090 -21.282 -10.930 1.00 0.00 H new ATOM 0 HB2 ASP A 75 102.295 -18.900 -11.611 1.00 0.00 H new ATOM 0 HB3 ASP A 75 100.982 -19.147 -10.477 1.00 0.00 H new ATOM 1110 N TRP A 76 104.489 -20.392 -11.786 1.00 0.00 N ATOM 1111 CA TRP A 76 105.905 -20.410 -12.139 1.00 0.00 C ATOM 1112 C TRP A 76 106.669 -19.391 -11.299 1.00 0.00 C ATOM 1113 O TRP A 76 106.168 -18.299 -11.031 1.00 0.00 O ATOM 1114 CB TRP A 76 106.079 -20.092 -13.625 1.00 0.00 C ATOM 1115 CG TRP A 76 105.606 -18.724 -14.003 1.00 0.00 C ATOM 1116 CD1 TRP A 76 104.322 -18.392 -14.267 1.00 0.00 C ATOM 1117 CD2 TRP A 76 106.387 -17.504 -14.166 1.00 0.00 C ATOM 1118 NE1 TRP A 76 104.263 -17.047 -14.580 1.00 0.00 N ATOM 1119 CE2 TRP A 76 105.508 -16.454 -14.532 1.00 0.00 C ATOM 1120 CE3 TRP A 76 107.754 -17.208 -14.033 1.00 0.00 C ATOM 1121 CZ2 TRP A 76 105.975 -15.157 -14.758 1.00 0.00 C ATOM 1122 CZ3 TRP A 76 108.225 -15.907 -14.259 1.00 0.00 C ATOM 1123 CH2 TRP A 76 107.339 -14.882 -14.621 1.00 0.00 C ATOM 0 H TRP A 76 103.858 -20.183 -12.560 1.00 0.00 H new ATOM 0 HA TRP A 76 106.303 -21.405 -11.938 1.00 0.00 H new ATOM 0 HB2 TRP A 76 107.132 -20.189 -13.888 1.00 0.00 H new ATOM 0 HB3 TRP A 76 105.534 -20.831 -14.213 1.00 0.00 H new ATOM 0 HD1 TRP A 76 103.480 -19.068 -14.238 1.00 0.00 H new ATOM 0 HE1 TRP A 76 103.403 -16.553 -14.818 1.00 0.00 H new ATOM 0 HE3 TRP A 76 108.447 -17.988 -13.755 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 105.287 -14.372 -15.037 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 109.278 -15.693 -14.154 1.00 0.00 H new ATOM 0 HH2 TRP A 76 107.709 -13.882 -14.794 1.00 0.00 H new ATOM 1134 N ALA A 77 107.877 -19.756 -10.878 1.00 0.00 N ATOM 1135 CA ALA A 77 108.674 -18.886 -10.018 1.00 0.00 C ATOM 1136 C ALA A 77 107.897 -18.540 -8.748 1.00 0.00 C ATOM 1137 O ALA A 77 106.815 -19.077 -8.514 1.00 0.00 O ATOM 1138 CB ALA A 77 109.044 -17.606 -10.773 1.00 0.00 C ATOM 0 H ALA A 77 108.323 -20.642 -11.116 1.00 0.00 H new ATOM 0 HA ALA A 77 109.587 -19.410 -9.736 1.00 0.00 H new ATOM 0 HB1 ALA A 77 109.639 -16.961 -10.126 1.00 0.00 H new ATOM 0 HB2 ALA A 77 109.622 -17.862 -11.661 1.00 0.00 H new ATOM 0 HB3 ALA A 77 108.135 -17.083 -11.070 1.00 0.00 H new ATOM 1144 N SER A 78 108.447 -17.646 -7.932 1.00 0.00 N ATOM 1145 CA SER A 78 107.787 -17.242 -6.694 1.00 0.00 C ATOM 1146 C SER A 78 107.324 -15.796 -6.812 1.00 0.00 C ATOM 1147 O SER A 78 107.974 -14.987 -7.474 1.00 0.00 O ATOM 1148 CB SER A 78 108.753 -17.375 -5.517 1.00 0.00 C ATOM 1149 OG SER A 78 108.074 -17.042 -4.314 1.00 0.00 O ATOM 0 H SER A 78 109.343 -17.189 -8.104 1.00 0.00 H new ATOM 0 HA SER A 78 106.926 -17.888 -6.523 1.00 0.00 H new ATOM 0 HB2 SER A 78 109.139 -18.393 -5.461 1.00 0.00 H new ATOM 0 HB3 SER A 78 109.610 -16.717 -5.659 1.00 0.00 H new ATOM 0 HG SER A 78 108.336 -16.142 -4.029 1.00 0.00 H new ATOM 1155 N ILE A 79 106.202 -15.466 -6.172 1.00 0.00 N ATOM 1156 CA ILE A 79 105.662 -14.109 -6.265 1.00 0.00 C ATOM 1157 C ILE A 79 105.471 -13.515 -4.874 1.00 0.00 C ATOM 1158 O ILE A 79 105.236 -14.238 -3.909 1.00 0.00 O ATOM 1159 CB ILE A 79 104.330 -14.138 -7.029 1.00 0.00 C ATOM 1160 CG1 ILE A 79 103.792 -12.713 -7.194 1.00 0.00 C ATOM 1161 CG2 ILE A 79 103.302 -14.988 -6.275 1.00 0.00 C ATOM 1162 CD1 ILE A 79 102.713 -12.696 -8.279 1.00 0.00 C ATOM 0 H ILE A 79 105.658 -16.106 -5.594 1.00 0.00 H new ATOM 0 HA ILE A 79 106.368 -13.479 -6.807 1.00 0.00 H new ATOM 0 HB ILE A 79 104.502 -14.577 -8.012 1.00 0.00 H new ATOM 0 HG12 ILE A 79 103.379 -12.358 -6.250 1.00 0.00 H new ATOM 0 HG13 ILE A 79 104.603 -12.036 -7.462 1.00 0.00 H new ATOM 0 HG21 ILE A 79 102.363 -14.999 -6.828 1.00 0.00 H new ATOM 0 HG22 ILE A 79 103.676 -16.007 -6.174 1.00 0.00 H new ATOM 0 HG23 ILE A 79 103.135 -14.563 -5.285 1.00 0.00 H new ATOM 0 HD11 ILE A 79 102.331 -11.682 -8.396 1.00 0.00 H new ATOM 0 HD12 ILE A 79 103.141 -13.034 -9.223 1.00 0.00 H new ATOM 0 HD13 ILE A 79 101.898 -13.360 -7.992 1.00 0.00 H new ATOM 1174 N TYR A 80 105.560 -12.193 -4.790 1.00 0.00 N ATOM 1175 CA TYR A 80 105.389 -11.500 -3.520 1.00 0.00 C ATOM 1176 C TYR A 80 104.497 -10.280 -3.702 1.00 0.00 C ATOM 1177 O TYR A 80 104.502 -9.660 -4.764 1.00 0.00 O ATOM 1178 CB TYR A 80 106.748 -11.033 -2.994 1.00 0.00 C ATOM 1179 CG TYR A 80 107.739 -12.150 -2.770 1.00 0.00 C ATOM 1180 CD1 TYR A 80 108.329 -12.796 -3.864 1.00 0.00 C ATOM 1181 CD2 TYR A 80 108.077 -12.532 -1.466 1.00 0.00 C ATOM 1182 CE1 TYR A 80 109.255 -13.824 -3.653 1.00 0.00 C ATOM 1183 CE2 TYR A 80 109.002 -13.561 -1.257 1.00 0.00 C ATOM 1184 CZ TYR A 80 109.591 -14.208 -2.350 1.00 0.00 C ATOM 1185 OH TYR A 80 110.505 -15.222 -2.141 1.00 0.00 O ATOM 0 H TYR A 80 105.749 -11.581 -5.584 1.00 0.00 H new ATOM 0 HA TYR A 80 104.930 -12.190 -2.812 1.00 0.00 H new ATOM 0 HB2 TYR A 80 107.174 -10.320 -3.700 1.00 0.00 H new ATOM 0 HB3 TYR A 80 106.599 -10.500 -2.055 1.00 0.00 H new ATOM 0 HD1 TYR A 80 108.069 -12.501 -4.870 1.00 0.00 H new ATOM 0 HD2 TYR A 80 107.624 -12.033 -0.622 1.00 0.00 H new ATOM 0 HE1 TYR A 80 109.711 -14.321 -4.497 1.00 0.00 H new ATOM 0 HE2 TYR A 80 109.262 -13.856 -0.251 1.00 0.00 H new ATOM 0 HH TYR A 80 111.148 -15.240 -2.880 1.00 0.00 H new ATOM 1195 N GLY A 81 103.755 -9.930 -2.658 1.00 0.00 N ATOM 1196 CA GLY A 81 103.033 -8.660 -2.645 1.00 0.00 C ATOM 1197 C GLY A 81 103.278 -7.968 -1.313 1.00 0.00 C ATOM 1198 O GLY A 81 103.346 -8.627 -0.279 1.00 0.00 O ATOM 0 H GLY A 81 103.637 -10.498 -1.819 1.00 0.00 H new ATOM 0 HA2 GLY A 81 103.369 -8.027 -3.466 1.00 0.00 H new ATOM 0 HA3 GLY A 81 101.966 -8.831 -2.790 1.00 0.00 H new ATOM 1202 N VAL A 82 103.351 -6.640 -1.326 1.00 0.00 N ATOM 1203 CA VAL A 82 103.801 -5.903 -0.147 1.00 0.00 C ATOM 1204 C VAL A 82 102.959 -4.660 0.109 1.00 0.00 C ATOM 1205 O VAL A 82 102.418 -4.057 -0.819 1.00 0.00 O ATOM 1206 CB VAL A 82 105.262 -5.475 -0.323 1.00 0.00 C ATOM 1207 CG1 VAL A 82 106.170 -6.702 -0.438 1.00 0.00 C ATOM 1208 CG2 VAL A 82 105.404 -4.626 -1.591 1.00 0.00 C ATOM 0 H VAL A 82 103.108 -6.058 -2.128 1.00 0.00 H new ATOM 0 HA VAL A 82 103.696 -6.573 0.707 1.00 0.00 H new ATOM 0 HB VAL A 82 105.558 -4.892 0.549 1.00 0.00 H new ATOM 0 HG11 VAL A 82 107.204 -6.379 -0.562 1.00 0.00 H new ATOM 0 HG12 VAL A 82 106.084 -7.304 0.467 1.00 0.00 H new ATOM 0 HG13 VAL A 82 105.870 -7.297 -1.300 1.00 0.00 H new ATOM 0 HG21 VAL A 82 106.444 -4.324 -1.712 1.00 0.00 H new ATOM 0 HG22 VAL A 82 105.093 -5.210 -2.457 1.00 0.00 H new ATOM 0 HG23 VAL A 82 104.776 -3.739 -1.507 1.00 0.00 H new ATOM 1218 N VAL A 83 102.894 -4.283 1.382 1.00 0.00 N ATOM 1219 CA VAL A 83 102.294 -3.019 1.795 1.00 0.00 C ATOM 1220 C VAL A 83 103.270 -2.339 2.750 1.00 0.00 C ATOM 1221 O VAL A 83 104.058 -3.030 3.399 1.00 0.00 O ATOM 1222 CB VAL A 83 100.958 -3.272 2.509 1.00 0.00 C ATOM 1223 CG1 VAL A 83 100.332 -1.940 2.935 1.00 0.00 C ATOM 1224 CG2 VAL A 83 99.989 -4.004 1.573 1.00 0.00 C ATOM 0 H VAL A 83 103.255 -4.843 2.154 1.00 0.00 H new ATOM 0 HA VAL A 83 102.099 -2.390 0.927 1.00 0.00 H new ATOM 0 HB VAL A 83 101.146 -3.887 3.389 1.00 0.00 H new ATOM 0 HG11 VAL A 83 99.385 -2.128 3.441 1.00 0.00 H new ATOM 0 HG12 VAL A 83 101.009 -1.421 3.614 1.00 0.00 H new ATOM 0 HG13 VAL A 83 100.157 -1.322 2.054 1.00 0.00 H new ATOM 0 HG21 VAL A 83 99.045 -4.178 2.090 1.00 0.00 H new ATOM 0 HG22 VAL A 83 99.810 -3.396 0.686 1.00 0.00 H new ATOM 0 HG23 VAL A 83 100.422 -4.959 1.276 1.00 0.00 H new ATOM 1234 N GLY A 84 103.229 -1.009 2.841 1.00 0.00 N ATOM 1235 CA GLY A 84 104.121 -0.317 3.768 1.00 0.00 C ATOM 1236 C GLY A 84 103.753 1.148 3.930 1.00 0.00 C ATOM 1237 O GLY A 84 102.804 1.638 3.321 1.00 0.00 O ATOM 0 H GLY A 84 102.608 -0.406 2.302 1.00 0.00 H new ATOM 0 HA2 GLY A 84 104.085 -0.809 4.740 1.00 0.00 H new ATOM 0 HA3 GLY A 84 105.147 -0.395 3.409 1.00 0.00 H new ATOM 1241 N VAL A 85 104.546 1.843 4.739 1.00 0.00 N ATOM 1242 CA VAL A 85 104.313 3.254 5.006 1.00 0.00 C ATOM 1243 C VAL A 85 105.636 4.003 4.907 1.00 0.00 C ATOM 1244 O VAL A 85 106.670 3.504 5.347 1.00 0.00 O ATOM 1245 CB VAL A 85 103.687 3.428 6.397 1.00 0.00 C ATOM 1246 CG1 VAL A 85 104.635 2.895 7.476 1.00 0.00 C ATOM 1247 CG2 VAL A 85 103.405 4.911 6.655 1.00 0.00 C ATOM 0 H VAL A 85 105.355 1.450 5.220 1.00 0.00 H new ATOM 0 HA VAL A 85 103.619 3.662 4.271 1.00 0.00 H new ATOM 0 HB VAL A 85 102.754 2.866 6.434 1.00 0.00 H new ATOM 0 HG11 VAL A 85 104.179 3.025 8.457 1.00 0.00 H new ATOM 0 HG12 VAL A 85 104.826 1.836 7.302 1.00 0.00 H new ATOM 0 HG13 VAL A 85 105.576 3.445 7.438 1.00 0.00 H new ATOM 0 HG21 VAL A 85 102.961 5.030 7.643 1.00 0.00 H new ATOM 0 HG22 VAL A 85 104.338 5.473 6.606 1.00 0.00 H new ATOM 0 HG23 VAL A 85 102.715 5.287 5.899 1.00 0.00 H new ATOM 1257 N GLY A 86 105.600 5.188 4.314 1.00 0.00 N ATOM 1258 CA GLY A 86 106.813 5.979 4.142 1.00 0.00 C ATOM 1259 C GLY A 86 106.592 7.401 4.629 1.00 0.00 C ATOM 1260 O GLY A 86 105.496 7.938 4.496 1.00 0.00 O ATOM 0 H GLY A 86 104.753 5.621 3.946 1.00 0.00 H new ATOM 0 HA2 GLY A 86 107.634 5.522 4.695 1.00 0.00 H new ATOM 0 HA3 GLY A 86 107.102 5.989 3.091 1.00 0.00 H new ATOM 1264 N TYR A 87 107.635 8.000 5.194 1.00 0.00 N ATOM 1265 CA TYR A 87 107.557 9.374 5.677 1.00 0.00 C ATOM 1266 C TYR A 87 108.708 10.183 5.093 1.00 0.00 C ATOM 1267 O TYR A 87 109.791 9.645 4.865 1.00 0.00 O ATOM 1268 CB TYR A 87 107.606 9.394 7.209 1.00 0.00 C ATOM 1269 CG TYR A 87 108.932 8.962 7.793 1.00 0.00 C ATOM 1270 CD1 TYR A 87 109.932 9.911 8.036 1.00 0.00 C ATOM 1271 CD2 TYR A 87 109.160 7.614 8.091 1.00 0.00 C ATOM 1272 CE1 TYR A 87 111.160 9.512 8.577 1.00 0.00 C ATOM 1273 CE2 TYR A 87 110.388 7.214 8.632 1.00 0.00 C ATOM 1274 CZ TYR A 87 111.388 8.163 8.875 1.00 0.00 C ATOM 1275 OH TYR A 87 112.599 7.769 9.408 1.00 0.00 O ATOM 0 H TYR A 87 108.543 7.556 5.329 1.00 0.00 H new ATOM 0 HA TYR A 87 106.615 9.820 5.358 1.00 0.00 H new ATOM 0 HB2 TYR A 87 107.381 10.403 7.555 1.00 0.00 H new ATOM 0 HB3 TYR A 87 106.822 8.742 7.595 1.00 0.00 H new ATOM 0 HD1 TYR A 87 109.756 10.951 7.806 1.00 0.00 H new ATOM 0 HD2 TYR A 87 108.389 6.882 7.904 1.00 0.00 H new ATOM 0 HE1 TYR A 87 111.931 10.244 8.764 1.00 0.00 H new ATOM 0 HE2 TYR A 87 110.564 6.173 8.862 1.00 0.00 H new ATOM 0 HH TYR A 87 112.591 6.800 9.556 1.00 0.00 H new ATOM 1285 N GLY A 88 108.467 11.465 4.842 1.00 0.00 N ATOM 1286 CA GLY A 88 109.492 12.314 4.248 1.00 0.00 C ATOM 1287 C GLY A 88 109.477 13.722 4.828 1.00 0.00 C ATOM 1288 O GLY A 88 108.479 14.167 5.402 1.00 0.00 O ATOM 0 H GLY A 88 107.583 11.934 5.038 1.00 0.00 H new ATOM 0 HA2 GLY A 88 110.472 11.866 4.411 1.00 0.00 H new ATOM 0 HA3 GLY A 88 109.340 12.365 3.170 1.00 0.00 H new ATOM 1292 N LYS A 89 110.602 14.410 4.658 1.00 0.00 N ATOM 1293 CA LYS A 89 110.761 15.768 5.164 1.00 0.00 C ATOM 1294 C LYS A 89 111.388 16.656 4.095 1.00 0.00 C ATOM 1295 O LYS A 89 112.308 16.231 3.392 1.00 0.00 O ATOM 1296 CB LYS A 89 111.644 15.753 6.414 1.00 0.00 C ATOM 1297 CG LYS A 89 111.710 17.158 7.015 1.00 0.00 C ATOM 1298 CD LYS A 89 112.484 17.119 8.336 1.00 0.00 C ATOM 1299 CE LYS A 89 113.959 16.798 8.073 1.00 0.00 C ATOM 1300 NZ LYS A 89 114.526 17.791 7.118 1.00 0.00 N ATOM 0 H LYS A 89 111.421 14.046 4.171 1.00 0.00 H new ATOM 0 HA LYS A 89 109.781 16.168 5.422 1.00 0.00 H new ATOM 0 HB2 LYS A 89 111.243 15.052 7.146 1.00 0.00 H new ATOM 0 HB3 LYS A 89 112.646 15.409 6.159 1.00 0.00 H new ATOM 0 HG2 LYS A 89 112.196 17.840 6.317 1.00 0.00 H new ATOM 0 HG3 LYS A 89 110.703 17.539 7.184 1.00 0.00 H new ATOM 0 HD2 LYS A 89 112.398 18.079 8.845 1.00 0.00 H new ATOM 0 HD3 LYS A 89 112.053 16.367 8.997 1.00 0.00 H new ATOM 0 HE2 LYS A 89 114.518 16.818 9.008 1.00 0.00 H new ATOM 0 HE3 LYS A 89 114.055 15.791 7.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 115.490 18.046 7.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 114.554 17.378 6.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 113.930 18.643 7.109 1.00 0.00 H new ATOM 1314 N PHE A 90 110.868 17.875 3.968 1.00 0.00 N ATOM 1315 CA PHE A 90 111.352 18.824 2.968 1.00 0.00 C ATOM 1316 C PHE A 90 111.844 20.104 3.637 1.00 0.00 C ATOM 1317 O PHE A 90 111.425 20.433 4.748 1.00 0.00 O ATOM 1318 CB PHE A 90 110.225 19.170 1.994 1.00 0.00 C ATOM 1319 CG PHE A 90 109.698 17.982 1.224 1.00 0.00 C ATOM 1320 CD1 PHE A 90 110.270 17.634 -0.005 1.00 0.00 C ATOM 1321 CD2 PHE A 90 108.635 17.231 1.739 1.00 0.00 C ATOM 1322 CE1 PHE A 90 109.780 16.535 -0.719 1.00 0.00 C ATOM 1323 CE2 PHE A 90 108.145 16.131 1.024 1.00 0.00 C ATOM 1324 CZ PHE A 90 108.717 15.783 -0.204 1.00 0.00 C ATOM 0 H PHE A 90 110.108 18.230 4.548 1.00 0.00 H new ATOM 0 HA PHE A 90 112.179 18.363 2.429 1.00 0.00 H new ATOM 0 HB2 PHE A 90 109.404 19.624 2.549 1.00 0.00 H new ATOM 0 HB3 PHE A 90 110.585 19.918 1.288 1.00 0.00 H new ATOM 0 HD1 PHE A 90 111.090 18.214 -0.402 1.00 0.00 H new ATOM 0 HD2 PHE A 90 108.193 17.500 2.687 1.00 0.00 H new ATOM 0 HE1 PHE A 90 110.222 16.267 -1.667 1.00 0.00 H new ATOM 0 HE2 PHE A 90 107.325 15.551 1.421 1.00 0.00 H new ATOM 0 HZ PHE A 90 108.339 14.934 -0.755 1.00 0.00 H new ATOM 1334 N GLN A 91 112.732 20.825 2.958 1.00 0.00 N ATOM 1335 CA GLN A 91 113.237 22.088 3.488 1.00 0.00 C ATOM 1336 C GLN A 91 112.361 23.251 3.031 1.00 0.00 C ATOM 1337 O GLN A 91 112.203 23.491 1.834 1.00 0.00 O ATOM 1338 CB GLN A 91 114.676 22.321 3.013 1.00 0.00 C ATOM 1339 CG GLN A 91 115.589 21.193 3.506 1.00 0.00 C ATOM 1340 CD GLN A 91 115.584 21.117 5.030 1.00 0.00 C ATOM 1341 OE1 GLN A 91 115.757 22.133 5.704 1.00 0.00 O ATOM 1342 NE2 GLN A 91 115.394 19.967 5.616 1.00 0.00 N ATOM 0 H GLN A 91 113.113 20.560 2.050 1.00 0.00 H new ATOM 0 HA GLN A 91 113.216 22.033 4.576 1.00 0.00 H new ATOM 0 HB2 GLN A 91 114.703 22.370 1.924 1.00 0.00 H new ATOM 0 HB3 GLN A 91 115.038 23.280 3.385 1.00 0.00 H new ATOM 0 HG2 GLN A 91 115.257 20.242 3.089 1.00 0.00 H new ATOM 0 HG3 GLN A 91 116.605 21.360 3.149 1.00 0.00 H new ATOM 0 HE21 GLN A 91 115.251 19.127 5.056 1.00 0.00 H new ATOM 0 HE22 GLN A 91 115.389 19.908 6.634 1.00 0.00 H new ATOM 1351 N THR A 92 111.794 23.969 3.995 1.00 0.00 N ATOM 1352 CA THR A 92 110.934 25.108 3.691 1.00 0.00 C ATOM 1353 C THR A 92 111.260 26.286 4.605 1.00 0.00 C ATOM 1354 O THR A 92 111.774 26.099 5.707 1.00 0.00 O ATOM 1355 CB THR A 92 109.465 24.713 3.870 1.00 0.00 C ATOM 1356 OG1 THR A 92 109.192 23.553 3.097 1.00 0.00 O ATOM 1357 CG2 THR A 92 108.563 25.859 3.408 1.00 0.00 C ATOM 0 H THR A 92 111.914 23.783 4.991 1.00 0.00 H new ATOM 0 HA THR A 92 111.109 25.406 2.657 1.00 0.00 H new ATOM 0 HB THR A 92 109.271 24.505 4.922 1.00 0.00 H new ATOM 0 HG1 THR A 92 108.253 23.297 3.211 1.00 0.00 H new ATOM 0 HG21 THR A 92 107.519 25.575 3.537 1.00 0.00 H new ATOM 0 HG22 THR A 92 108.773 26.749 4.002 1.00 0.00 H new ATOM 0 HG23 THR A 92 108.754 26.071 2.356 1.00 0.00 H new ATOM 1365 N THR A 93 110.960 27.496 4.143 1.00 0.00 N ATOM 1366 CA THR A 93 111.166 28.683 4.966 1.00 0.00 C ATOM 1367 C THR A 93 109.846 29.099 5.606 1.00 0.00 C ATOM 1368 O THR A 93 108.852 29.313 4.913 1.00 0.00 O ATOM 1369 CB THR A 93 111.708 29.829 4.110 1.00 0.00 C ATOM 1370 OG1 THR A 93 112.882 29.401 3.435 1.00 0.00 O ATOM 1371 CG2 THR A 93 112.039 31.027 5.003 1.00 0.00 C ATOM 0 H THR A 93 110.578 27.680 3.215 1.00 0.00 H new ATOM 0 HA THR A 93 111.890 28.452 5.747 1.00 0.00 H new ATOM 0 HB THR A 93 110.954 30.122 3.379 1.00 0.00 H new ATOM 0 HG1 THR A 93 113.229 30.134 2.885 1.00 0.00 H new ATOM 0 HG21 THR A 93 112.425 31.842 4.390 1.00 0.00 H new ATOM 0 HG22 THR A 93 111.137 31.357 5.519 1.00 0.00 H new ATOM 0 HG23 THR A 93 112.791 30.737 5.737 1.00 0.00 H new ATOM 1379 N GLU A 94 109.855 29.232 6.930 1.00 0.00 N ATOM 1380 CA GLU A 94 108.629 29.474 7.683 1.00 0.00 C ATOM 1381 C GLU A 94 108.953 29.587 9.170 1.00 0.00 C ATOM 1382 O GLU A 94 109.900 28.960 9.648 1.00 0.00 O ATOM 1383 CB GLU A 94 107.645 28.318 7.454 1.00 0.00 C ATOM 1384 CG GLU A 94 106.274 28.654 8.051 1.00 0.00 C ATOM 1385 CD GLU A 94 105.600 29.784 7.274 1.00 0.00 C ATOM 1386 OE1 GLU A 94 105.905 29.954 6.102 1.00 0.00 O ATOM 1387 OE2 GLU A 94 104.783 30.471 7.865 1.00 0.00 O ATOM 0 H GLU A 94 110.697 29.176 7.502 1.00 0.00 H new ATOM 0 HA GLU A 94 108.175 30.405 7.342 1.00 0.00 H new ATOM 0 HB2 GLU A 94 107.545 28.124 6.386 1.00 0.00 H new ATOM 0 HB3 GLU A 94 108.033 27.407 7.909 1.00 0.00 H new ATOM 0 HG2 GLU A 94 105.639 27.768 8.035 1.00 0.00 H new ATOM 0 HG3 GLU A 94 106.389 28.944 9.095 1.00 0.00 H new ATOM 1394 N TYR A 95 108.173 30.381 9.899 1.00 0.00 N ATOM 1395 CA TYR A 95 108.360 30.489 11.340 1.00 0.00 C ATOM 1396 C TYR A 95 107.692 29.288 12.010 1.00 0.00 C ATOM 1397 O TYR A 95 106.628 28.855 11.565 1.00 0.00 O ATOM 1398 CB TYR A 95 107.741 31.787 11.862 1.00 0.00 C ATOM 1399 CG TYR A 95 108.515 33.024 11.469 1.00 0.00 C ATOM 1400 CD1 TYR A 95 109.538 33.501 12.296 1.00 0.00 C ATOM 1401 CD2 TYR A 95 108.208 33.693 10.279 1.00 0.00 C ATOM 1402 CE1 TYR A 95 110.255 34.647 11.933 1.00 0.00 C ATOM 1403 CE2 TYR A 95 108.925 34.839 9.915 1.00 0.00 C ATOM 1404 CZ TYR A 95 109.948 35.317 10.743 1.00 0.00 C ATOM 1405 OH TYR A 95 110.655 36.447 10.384 1.00 0.00 O ATOM 0 H TYR A 95 107.416 30.951 9.521 1.00 0.00 H new ATOM 0 HA TYR A 95 109.425 30.501 11.570 1.00 0.00 H new ATOM 0 HB2 TYR A 95 106.721 31.871 11.486 1.00 0.00 H new ATOM 0 HB3 TYR A 95 107.677 31.738 12.949 1.00 0.00 H new ATOM 0 HD1 TYR A 95 109.774 32.985 13.215 1.00 0.00 H new ATOM 0 HD2 TYR A 95 107.418 33.325 9.641 1.00 0.00 H new ATOM 0 HE1 TYR A 95 111.045 35.014 12.571 1.00 0.00 H new ATOM 0 HE2 TYR A 95 108.689 35.354 8.996 1.00 0.00 H new ATOM 0 HH TYR A 95 110.316 36.788 9.530 1.00 0.00 H new ATOM 1415 N PRO A 96 108.270 28.747 13.058 1.00 0.00 N ATOM 1416 CA PRO A 96 107.851 27.402 13.553 1.00 0.00 C ATOM 1417 C PRO A 96 106.361 27.321 13.871 1.00 0.00 C ATOM 1418 O PRO A 96 105.791 28.207 14.508 1.00 0.00 O ATOM 1419 CB PRO A 96 108.701 27.173 14.812 1.00 0.00 C ATOM 1420 CG PRO A 96 109.223 28.515 15.202 1.00 0.00 C ATOM 1421 CD PRO A 96 109.322 29.327 13.913 1.00 0.00 C ATOM 0 HA PRO A 96 108.007 26.638 12.791 1.00 0.00 H new ATOM 0 HB2 PRO A 96 108.103 26.738 15.613 1.00 0.00 H new ATOM 0 HB3 PRO A 96 109.518 26.479 14.611 1.00 0.00 H new ATOM 0 HG2 PRO A 96 108.557 28.999 15.916 1.00 0.00 H new ATOM 0 HG3 PRO A 96 110.197 28.429 15.683 1.00 0.00 H new ATOM 0 HD2 PRO A 96 109.152 30.388 14.093 1.00 0.00 H new ATOM 0 HD3 PRO A 96 110.307 29.235 13.455 1.00 0.00 H new ATOM 1429 N THR A 97 105.747 26.236 13.409 1.00 0.00 N ATOM 1430 CA THR A 97 104.363 25.920 13.739 1.00 0.00 C ATOM 1431 C THR A 97 104.312 24.591 14.483 1.00 0.00 C ATOM 1432 O THR A 97 105.224 23.774 14.343 1.00 0.00 O ATOM 1433 CB THR A 97 103.524 25.831 12.462 1.00 0.00 C ATOM 1434 OG1 THR A 97 103.660 27.036 11.724 1.00 0.00 O ATOM 1435 CG2 THR A 97 102.054 25.616 12.827 1.00 0.00 C ATOM 0 H THR A 97 106.194 25.553 12.797 1.00 0.00 H new ATOM 0 HA THR A 97 103.956 26.709 14.372 1.00 0.00 H new ATOM 0 HB THR A 97 103.871 24.993 11.857 1.00 0.00 H new ATOM 0 HG1 THR A 97 103.125 26.980 10.905 1.00 0.00 H new ATOM 0 HG21 THR A 97 101.458 25.553 11.916 1.00 0.00 H new ATOM 0 HG22 THR A 97 101.951 24.690 13.393 1.00 0.00 H new ATOM 0 HG23 THR A 97 101.703 26.452 13.433 1.00 0.00 H new ATOM 1443 N TYR A 98 103.259 24.371 15.268 1.00 0.00 N ATOM 1444 CA TYR A 98 103.092 23.082 15.932 1.00 0.00 C ATOM 1445 C TYR A 98 102.149 22.203 15.118 1.00 0.00 C ATOM 1446 O TYR A 98 101.001 22.571 14.865 1.00 0.00 O ATOM 1447 CB TYR A 98 102.522 23.285 17.337 1.00 0.00 C ATOM 1448 CG TYR A 98 102.444 22.010 18.144 1.00 0.00 C ATOM 1449 CD1 TYR A 98 103.526 21.620 18.942 1.00 0.00 C ATOM 1450 CD2 TYR A 98 101.290 21.219 18.094 1.00 0.00 C ATOM 1451 CE1 TYR A 98 103.455 20.439 19.690 1.00 0.00 C ATOM 1452 CE2 TYR A 98 101.219 20.037 18.843 1.00 0.00 C ATOM 1453 CZ TYR A 98 102.301 19.647 19.641 1.00 0.00 C ATOM 1454 OH TYR A 98 102.231 18.483 20.378 1.00 0.00 O ATOM 0 H TYR A 98 102.524 25.053 15.457 1.00 0.00 H new ATOM 0 HA TYR A 98 104.064 22.595 16.010 1.00 0.00 H new ATOM 0 HB2 TYR A 98 103.140 24.007 17.871 1.00 0.00 H new ATOM 0 HB3 TYR A 98 101.525 23.717 17.257 1.00 0.00 H new ATOM 0 HD1 TYR A 98 104.416 22.231 18.981 1.00 0.00 H new ATOM 0 HD2 TYR A 98 100.455 21.520 17.479 1.00 0.00 H new ATOM 0 HE1 TYR A 98 104.290 20.138 20.305 1.00 0.00 H new ATOM 0 HE2 TYR A 98 100.329 19.426 18.805 1.00 0.00 H new ATOM 0 HH TYR A 98 101.362 18.055 20.231 1.00 0.00 H new ATOM 1464 N LYS A 99 102.644 21.037 14.710 1.00 0.00 N ATOM 1465 CA LYS A 99 101.857 20.108 13.902 1.00 0.00 C ATOM 1466 C LYS A 99 101.574 18.822 14.671 1.00 0.00 C ATOM 1467 O LYS A 99 102.381 18.392 15.495 1.00 0.00 O ATOM 1468 CB LYS A 99 102.611 19.774 12.614 1.00 0.00 C ATOM 1469 CG LYS A 99 102.758 21.038 11.765 1.00 0.00 C ATOM 1470 CD LYS A 99 103.620 20.734 10.538 1.00 0.00 C ATOM 1471 CE LYS A 99 102.861 19.794 9.600 1.00 0.00 C ATOM 1472 NZ LYS A 99 103.620 19.642 8.327 1.00 0.00 N ATOM 0 H LYS A 99 103.587 20.713 14.926 1.00 0.00 H new ATOM 0 HA LYS A 99 100.908 20.586 13.661 1.00 0.00 H new ATOM 0 HB2 LYS A 99 103.594 19.366 12.851 1.00 0.00 H new ATOM 0 HB3 LYS A 99 102.074 19.008 12.054 1.00 0.00 H new ATOM 0 HG2 LYS A 99 101.777 21.395 11.453 1.00 0.00 H new ATOM 0 HG3 LYS A 99 103.214 21.833 12.355 1.00 0.00 H new ATOM 0 HD2 LYS A 99 103.870 21.659 10.018 1.00 0.00 H new ATOM 0 HD3 LYS A 99 104.560 20.276 10.846 1.00 0.00 H new ATOM 0 HE2 LYS A 99 102.726 18.822 10.074 1.00 0.00 H new ATOM 0 HE3 LYS A 99 101.866 20.191 9.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 103.104 19.003 7.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 103.727 20.572 7.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 104.560 19.245 8.529 1.00 0.00 H new ATOM 1486 N HIS A 100 100.425 18.212 14.398 1.00 0.00 N ATOM 1487 CA HIS A 100 100.116 16.905 14.970 1.00 0.00 C ATOM 1488 C HIS A 100 101.186 15.888 14.574 1.00 0.00 C ATOM 1489 O HIS A 100 101.607 15.067 15.388 1.00 0.00 O ATOM 1490 CB HIS A 100 98.748 16.431 14.483 1.00 0.00 C ATOM 1491 CG HIS A 100 97.619 17.334 14.900 1.00 0.00 C ATOM 1492 ND1 HIS A 100 97.205 17.439 16.218 1.00 0.00 N ATOM 1493 CD2 HIS A 100 96.808 18.180 14.184 1.00 0.00 C ATOM 1494 CE1 HIS A 100 96.190 18.319 16.256 1.00 0.00 C ATOM 1495 NE2 HIS A 100 95.905 18.801 15.044 1.00 0.00 N ATOM 0 H HIS A 100 99.700 18.595 13.792 1.00 0.00 H new ATOM 0 HA HIS A 100 100.098 16.995 16.056 1.00 0.00 H new ATOM 0 HB2 HIS A 100 98.763 16.359 13.395 1.00 0.00 H new ATOM 0 HB3 HIS A 100 98.562 15.428 14.867 1.00 0.00 H new ATOM 0 HD2 HIS A 100 96.862 18.339 13.117 1.00 0.00 H new ATOM 0 HE1 HIS A 100 95.668 18.602 17.158 1.00 0.00 H new ATOM 0 HE2 HIS A 100 95.182 19.478 14.800 1.00 0.00 H new ATOM 1503 N ASP A 101 101.619 15.952 13.317 1.00 0.00 N ATOM 1504 CA ASP A 101 102.680 15.078 12.823 1.00 0.00 C ATOM 1505 C ASP A 101 103.764 15.910 12.142 1.00 0.00 C ATOM 1506 O ASP A 101 103.479 16.692 11.234 1.00 0.00 O ATOM 1507 CB ASP A 101 102.104 14.063 11.832 1.00 0.00 C ATOM 1508 CG ASP A 101 103.154 13.022 11.444 1.00 0.00 C ATOM 1509 OD1 ASP A 101 104.051 12.774 12.236 1.00 0.00 O ATOM 1510 OD2 ASP A 101 103.042 12.482 10.357 1.00 0.00 O ATOM 0 H ASP A 101 101.251 16.601 12.621 1.00 0.00 H new ATOM 0 HA ASP A 101 103.118 14.542 13.665 1.00 0.00 H new ATOM 0 HB2 ASP A 101 101.240 13.567 12.275 1.00 0.00 H new ATOM 0 HB3 ASP A 101 101.752 14.580 10.939 1.00 0.00 H new ATOM 1515 N THR A 102 105.004 15.735 12.584 1.00 0.00 N ATOM 1516 CA THR A 102 106.114 16.533 12.068 1.00 0.00 C ATOM 1517 C THR A 102 106.427 16.207 10.608 1.00 0.00 C ATOM 1518 O THR A 102 106.879 17.075 9.860 1.00 0.00 O ATOM 1519 CB THR A 102 107.364 16.294 12.917 1.00 0.00 C ATOM 1520 OG1 THR A 102 107.740 14.927 12.829 1.00 0.00 O ATOM 1521 CG2 THR A 102 107.076 16.655 14.376 1.00 0.00 C ATOM 0 H THR A 102 105.267 15.052 13.294 1.00 0.00 H new ATOM 0 HA THR A 102 105.814 17.580 12.122 1.00 0.00 H new ATOM 0 HB THR A 102 108.177 16.920 12.548 1.00 0.00 H new ATOM 0 HG1 THR A 102 108.542 14.773 13.371 1.00 0.00 H new ATOM 0 HG21 THR A 102 107.969 16.483 14.977 1.00 0.00 H new ATOM 0 HG22 THR A 102 106.791 17.705 14.442 1.00 0.00 H new ATOM 0 HG23 THR A 102 106.262 16.034 14.751 1.00 0.00 H new ATOM 1529 N SER A 103 106.190 14.963 10.198 1.00 0.00 N ATOM 1530 CA SER A 103 106.525 14.530 8.841 1.00 0.00 C ATOM 1531 C SER A 103 105.272 14.154 8.060 1.00 0.00 C ATOM 1532 O SER A 103 104.219 13.893 8.640 1.00 0.00 O ATOM 1533 CB SER A 103 107.464 13.323 8.903 1.00 0.00 C ATOM 1534 OG SER A 103 106.773 12.222 9.477 1.00 0.00 O ATOM 0 H SER A 103 105.770 14.240 10.781 1.00 0.00 H new ATOM 0 HA SER A 103 107.016 15.359 8.331 1.00 0.00 H new ATOM 0 HB2 SER A 103 107.813 13.067 7.903 1.00 0.00 H new ATOM 0 HB3 SER A 103 108.346 13.564 9.497 1.00 0.00 H new ATOM 0 HG SER A 103 107.370 11.446 9.517 1.00 0.00 H new ATOM 1540 N ASP A 104 105.396 14.131 6.736 1.00 0.00 N ATOM 1541 CA ASP A 104 104.277 13.754 5.876 1.00 0.00 C ATOM 1542 C ASP A 104 104.385 12.278 5.518 1.00 0.00 C ATOM 1543 O ASP A 104 105.469 11.804 5.185 1.00 0.00 O ATOM 1544 CB ASP A 104 104.286 14.599 4.600 1.00 0.00 C ATOM 1545 CG ASP A 104 103.038 14.318 3.765 1.00 0.00 C ATOM 1546 OD1 ASP A 104 102.007 14.021 4.347 1.00 0.00 O ATOM 1547 OD2 ASP A 104 103.133 14.404 2.552 1.00 0.00 O ATOM 0 H ASP A 104 106.254 14.367 6.237 1.00 0.00 H new ATOM 0 HA ASP A 104 103.342 13.930 6.408 1.00 0.00 H new ATOM 0 HB2 ASP A 104 104.328 15.657 4.858 1.00 0.00 H new ATOM 0 HB3 ASP A 104 105.179 14.377 4.016 1.00 0.00 H new ATOM 1552 N TYR A 105 103.271 11.549 5.593 1.00 0.00 N ATOM 1553 CA TYR A 105 103.294 10.101 5.372 1.00 0.00 C ATOM 1554 C TYR A 105 102.383 9.686 4.216 1.00 0.00 C ATOM 1555 O TYR A 105 101.412 10.371 3.894 1.00 0.00 O ATOM 1556 CB TYR A 105 102.875 9.380 6.657 1.00 0.00 C ATOM 1557 CG TYR A 105 101.420 9.568 7.026 1.00 0.00 C ATOM 1558 CD1 TYR A 105 101.024 10.693 7.760 1.00 0.00 C ATOM 1559 CD2 TYR A 105 100.470 8.618 6.635 1.00 0.00 C ATOM 1560 CE1 TYR A 105 99.678 10.867 8.104 1.00 0.00 C ATOM 1561 CE2 TYR A 105 99.124 8.792 6.978 1.00 0.00 C ATOM 1562 CZ TYR A 105 98.728 9.916 7.713 1.00 0.00 C ATOM 1563 OH TYR A 105 97.401 10.088 8.052 1.00 0.00 O ATOM 0 H TYR A 105 102.349 11.932 5.803 1.00 0.00 H new ATOM 0 HA TYR A 105 104.312 9.818 5.103 1.00 0.00 H new ATOM 0 HB2 TYR A 105 103.075 8.314 6.544 1.00 0.00 H new ATOM 0 HB3 TYR A 105 103.496 9.736 7.479 1.00 0.00 H new ATOM 0 HD1 TYR A 105 101.757 11.427 8.061 1.00 0.00 H new ATOM 0 HD2 TYR A 105 100.775 7.751 6.069 1.00 0.00 H new ATOM 0 HE1 TYR A 105 99.373 11.734 8.671 1.00 0.00 H new ATOM 0 HE2 TYR A 105 98.391 8.059 6.676 1.00 0.00 H new ATOM 0 HH TYR A 105 96.874 9.339 7.703 1.00 0.00 H new ATOM 1573 N GLY A 106 102.713 8.552 3.603 1.00 0.00 N ATOM 1574 CA GLY A 106 101.928 8.020 2.494 1.00 0.00 C ATOM 1575 C GLY A 106 101.843 6.497 2.556 1.00 0.00 C ATOM 1576 O GLY A 106 102.596 5.856 3.292 1.00 0.00 O ATOM 0 H GLY A 106 103.521 7.983 3.857 1.00 0.00 H new ATOM 0 HA2 GLY A 106 100.924 8.444 2.520 1.00 0.00 H new ATOM 0 HA3 GLY A 106 102.378 8.323 1.549 1.00 0.00 H new ATOM 1580 N PHE A 107 100.960 5.933 1.736 1.00 0.00 N ATOM 1581 CA PHE A 107 100.721 4.489 1.731 1.00 0.00 C ATOM 1582 C PHE A 107 101.271 3.870 0.450 1.00 0.00 C ATOM 1583 O PHE A 107 101.116 4.450 -0.623 1.00 0.00 O ATOM 1584 CB PHE A 107 99.216 4.231 1.828 1.00 0.00 C ATOM 1585 CG PHE A 107 98.841 2.768 1.871 1.00 0.00 C ATOM 1586 CD1 PHE A 107 98.841 2.080 3.090 1.00 0.00 C ATOM 1587 CD2 PHE A 107 98.483 2.105 0.692 1.00 0.00 C ATOM 1588 CE1 PHE A 107 98.482 0.727 3.128 1.00 0.00 C ATOM 1589 CE2 PHE A 107 98.126 0.752 0.730 1.00 0.00 C ATOM 1590 CZ PHE A 107 98.124 0.064 1.948 1.00 0.00 C ATOM 0 H PHE A 107 100.396 6.454 1.064 1.00 0.00 H new ATOM 0 HA PHE A 107 101.228 4.035 2.583 1.00 0.00 H new ATOM 0 HB2 PHE A 107 98.832 4.720 2.723 1.00 0.00 H new ATOM 0 HB3 PHE A 107 98.723 4.696 0.974 1.00 0.00 H new ATOM 0 HD1 PHE A 107 99.117 2.592 4.000 1.00 0.00 H new ATOM 0 HD2 PHE A 107 98.482 2.637 -0.248 1.00 0.00 H new ATOM 0 HE1 PHE A 107 98.481 0.195 4.068 1.00 0.00 H new ATOM 0 HE2 PHE A 107 97.852 0.240 -0.180 1.00 0.00 H new ATOM 0 HZ PHE A 107 97.846 -0.979 1.978 1.00 0.00 H new ATOM 1600 N SER A 108 101.913 2.700 0.548 1.00 0.00 N ATOM 1601 CA SER A 108 102.529 2.087 -0.629 1.00 0.00 C ATOM 1602 C SER A 108 102.135 0.621 -0.771 1.00 0.00 C ATOM 1603 O SER A 108 101.963 -0.086 0.221 1.00 0.00 O ATOM 1604 CB SER A 108 104.051 2.191 -0.521 1.00 0.00 C ATOM 1605 OG SER A 108 104.497 1.395 0.568 1.00 0.00 O ATOM 0 H SER A 108 102.017 2.169 1.413 1.00 0.00 H new ATOM 0 HA SER A 108 102.173 2.622 -1.510 1.00 0.00 H new ATOM 0 HB2 SER A 108 104.517 1.855 -1.447 1.00 0.00 H new ATOM 0 HB3 SER A 108 104.347 3.230 -0.373 1.00 0.00 H new ATOM 0 HG SER A 108 105.472 1.457 0.641 1.00 0.00 H new ATOM 1611 N TYR A 109 102.010 0.183 -2.022 1.00 0.00 N ATOM 1612 CA TYR A 109 101.718 -1.212 -2.335 1.00 0.00 C ATOM 1613 C TYR A 109 102.411 -1.604 -3.637 1.00 0.00 C ATOM 1614 O TYR A 109 102.640 -0.753 -4.496 1.00 0.00 O ATOM 1615 CB TYR A 109 100.207 -1.414 -2.473 1.00 0.00 C ATOM 1616 CG TYR A 109 99.813 -2.825 -2.847 1.00 0.00 C ATOM 1617 CD1 TYR A 109 99.806 -3.834 -1.877 1.00 0.00 C ATOM 1618 CD2 TYR A 109 99.454 -3.123 -4.167 1.00 0.00 C ATOM 1619 CE1 TYR A 109 99.440 -5.140 -2.226 1.00 0.00 C ATOM 1620 CE2 TYR A 109 99.088 -4.429 -4.516 1.00 0.00 C ATOM 1621 CZ TYR A 109 99.082 -5.437 -3.546 1.00 0.00 C ATOM 1622 OH TYR A 109 98.720 -6.724 -3.890 1.00 0.00 O ATOM 0 H TYR A 109 102.108 0.782 -2.842 1.00 0.00 H new ATOM 0 HA TYR A 109 102.088 -1.842 -1.526 1.00 0.00 H new ATOM 0 HB2 TYR A 109 99.727 -1.150 -1.531 1.00 0.00 H new ATOM 0 HB3 TYR A 109 99.825 -0.727 -3.229 1.00 0.00 H new ATOM 0 HD1 TYR A 109 100.083 -3.605 -0.859 1.00 0.00 H new ATOM 0 HD2 TYR A 109 99.459 -2.345 -4.916 1.00 0.00 H new ATOM 0 HE1 TYR A 109 99.434 -5.918 -1.477 1.00 0.00 H new ATOM 0 HE2 TYR A 109 98.810 -4.658 -5.534 1.00 0.00 H new ATOM 0 HH TYR A 109 98.500 -6.758 -4.844 1.00 0.00 H new ATOM 1632 N GLY A 110 102.757 -2.882 -3.777 1.00 0.00 N ATOM 1633 CA GLY A 110 103.391 -3.350 -5.008 1.00 0.00 C ATOM 1634 C GLY A 110 103.555 -4.866 -5.025 1.00 0.00 C ATOM 1635 O GLY A 110 103.159 -5.552 -4.087 1.00 0.00 O ATOM 0 H GLY A 110 102.613 -3.601 -3.068 1.00 0.00 H new ATOM 0 HA2 GLY A 110 102.792 -3.040 -5.865 1.00 0.00 H new ATOM 0 HA3 GLY A 110 104.368 -2.878 -5.115 1.00 0.00 H new ATOM 1639 N ALA A 111 104.150 -5.375 -6.101 1.00 0.00 N ATOM 1640 CA ALA A 111 104.383 -6.809 -6.242 1.00 0.00 C ATOM 1641 C ALA A 111 105.671 -7.061 -7.020 1.00 0.00 C ATOM 1642 O ALA A 111 106.138 -6.190 -7.755 1.00 0.00 O ATOM 1643 CB ALA A 111 103.206 -7.461 -6.970 1.00 0.00 C ATOM 0 H ALA A 111 104.479 -4.815 -6.888 1.00 0.00 H new ATOM 0 HA ALA A 111 104.478 -7.246 -5.248 1.00 0.00 H new ATOM 0 HB1 ALA A 111 103.388 -8.531 -7.071 1.00 0.00 H new ATOM 0 HB2 ALA A 111 102.291 -7.301 -6.399 1.00 0.00 H new ATOM 0 HB3 ALA A 111 103.099 -7.016 -7.959 1.00 0.00 H new ATOM 1649 N GLY A 112 106.244 -8.251 -6.858 1.00 0.00 N ATOM 1650 CA GLY A 112 107.499 -8.575 -7.530 1.00 0.00 C ATOM 1651 C GLY A 112 107.615 -10.066 -7.826 1.00 0.00 C ATOM 1652 O GLY A 112 106.878 -10.879 -7.269 1.00 0.00 O ATOM 0 H GLY A 112 105.865 -8.998 -6.275 1.00 0.00 H new ATOM 0 HA2 GLY A 112 107.568 -8.013 -8.462 1.00 0.00 H new ATOM 0 HA3 GLY A 112 108.336 -8.262 -6.906 1.00 0.00 H new ATOM 1656 N LEU A 113 108.564 -10.410 -8.694 1.00 0.00 N ATOM 1657 CA LEU A 113 108.800 -11.800 -9.075 1.00 0.00 C ATOM 1658 C LEU A 113 110.279 -12.143 -8.919 1.00 0.00 C ATOM 1659 O LEU A 113 111.136 -11.268 -9.054 1.00 0.00 O ATOM 1660 CB LEU A 113 108.377 -12.027 -10.529 1.00 0.00 C ATOM 1661 CG LEU A 113 106.905 -11.652 -10.708 1.00 0.00 C ATOM 1662 CD1 LEU A 113 106.527 -11.764 -12.187 1.00 0.00 C ATOM 1663 CD2 LEU A 113 106.030 -12.608 -9.893 1.00 0.00 C ATOM 0 H LEU A 113 109.185 -9.741 -9.149 1.00 0.00 H new ATOM 0 HA LEU A 113 108.209 -12.443 -8.423 1.00 0.00 H new ATOM 0 HB2 LEU A 113 108.998 -11.428 -11.195 1.00 0.00 H new ATOM 0 HB3 LEU A 113 108.531 -13.071 -10.803 1.00 0.00 H new ATOM 0 HG LEU A 113 106.749 -10.629 -10.364 1.00 0.00 H new ATOM 0 HD11 LEU A 113 105.478 -11.497 -12.316 1.00 0.00 H new ATOM 0 HD12 LEU A 113 107.148 -11.087 -12.774 1.00 0.00 H new ATOM 0 HD13 LEU A 113 106.685 -12.788 -12.526 1.00 0.00 H new ATOM 0 HD21 LEU A 113 104.981 -12.340 -10.021 1.00 0.00 H new ATOM 0 HD22 LEU A 113 106.188 -13.630 -10.238 1.00 0.00 H new ATOM 0 HD23 LEU A 113 106.297 -12.536 -8.839 1.00 0.00 H new ATOM 1675 N GLN A 114 110.570 -13.410 -8.620 1.00 0.00 N ATOM 1676 CA GLN A 114 111.952 -13.862 -8.465 1.00 0.00 C ATOM 1677 C GLN A 114 112.297 -14.904 -9.526 1.00 0.00 C ATOM 1678 O GLN A 114 111.499 -15.797 -9.813 1.00 0.00 O ATOM 1679 CB GLN A 114 112.142 -14.469 -7.072 1.00 0.00 C ATOM 1680 CG GLN A 114 113.618 -14.816 -6.858 1.00 0.00 C ATOM 1681 CD GLN A 114 113.789 -15.579 -5.548 1.00 0.00 C ATOM 1682 OE1 GLN A 114 113.173 -16.627 -5.354 1.00 0.00 O ATOM 1683 NE2 GLN A 114 114.594 -15.112 -4.632 1.00 0.00 N ATOM 0 H GLN A 114 109.870 -14.138 -8.481 1.00 0.00 H new ATOM 0 HA GLN A 114 112.614 -13.005 -8.586 1.00 0.00 H new ATOM 0 HB2 GLN A 114 111.810 -13.765 -6.309 1.00 0.00 H new ATOM 0 HB3 GLN A 114 111.529 -15.364 -6.968 1.00 0.00 H new ATOM 0 HG2 GLN A 114 113.983 -15.418 -7.690 1.00 0.00 H new ATOM 0 HG3 GLN A 114 114.215 -13.905 -6.838 1.00 0.00 H new ATOM 0 HE21 GLN A 114 115.103 -14.243 -4.795 1.00 0.00 H new ATOM 0 HE22 GLN A 114 114.714 -15.616 -3.753 1.00 0.00 H new ATOM 1692 N PHE A 115 113.490 -14.787 -10.110 1.00 0.00 N ATOM 1693 CA PHE A 115 113.935 -15.733 -11.131 1.00 0.00 C ATOM 1694 C PHE A 115 115.252 -16.373 -10.705 1.00 0.00 C ATOM 1695 O PHE A 115 116.148 -15.687 -10.216 1.00 0.00 O ATOM 1696 CB PHE A 115 114.116 -15.008 -12.466 1.00 0.00 C ATOM 1697 CG PHE A 115 114.361 -15.939 -13.631 1.00 0.00 C ATOM 1698 CD1 PHE A 115 113.280 -16.439 -14.365 1.00 0.00 C ATOM 1699 CD2 PHE A 115 115.669 -16.303 -13.973 1.00 0.00 C ATOM 1700 CE1 PHE A 115 113.506 -17.304 -15.443 1.00 0.00 C ATOM 1701 CE2 PHE A 115 115.895 -17.167 -15.052 1.00 0.00 C ATOM 1702 CZ PHE A 115 114.813 -17.666 -15.787 1.00 0.00 C ATOM 0 H PHE A 115 114.162 -14.050 -9.894 1.00 0.00 H new ATOM 0 HA PHE A 115 113.182 -16.513 -11.248 1.00 0.00 H new ATOM 0 HB2 PHE A 115 113.227 -14.411 -12.669 1.00 0.00 H new ATOM 0 HB3 PHE A 115 114.953 -14.315 -12.383 1.00 0.00 H new ATOM 0 HD1 PHE A 115 112.271 -16.158 -14.100 1.00 0.00 H new ATOM 0 HD2 PHE A 115 116.503 -15.918 -13.405 1.00 0.00 H new ATOM 0 HE1 PHE A 115 112.672 -17.692 -16.009 1.00 0.00 H new ATOM 0 HE2 PHE A 115 116.904 -17.448 -15.317 1.00 0.00 H new ATOM 0 HZ PHE A 115 114.987 -18.331 -16.620 1.00 0.00 H new ATOM 1712 N ASN A 116 115.361 -17.686 -10.899 1.00 0.00 N ATOM 1713 CA ASN A 116 116.540 -18.432 -10.460 1.00 0.00 C ATOM 1714 C ASN A 116 117.209 -19.142 -11.641 1.00 0.00 C ATOM 1715 O ASN A 116 116.848 -20.281 -11.949 1.00 0.00 O ATOM 1716 CB ASN A 116 116.122 -19.472 -9.418 1.00 0.00 C ATOM 1717 CG ASN A 116 115.825 -18.787 -8.088 1.00 0.00 C ATOM 1718 OD1 ASN A 116 114.780 -18.155 -7.934 1.00 0.00 O ATOM 1719 ND2 ASN A 116 116.686 -18.876 -7.111 1.00 0.00 N ATOM 0 H ASN A 116 114.649 -18.255 -11.356 1.00 0.00 H new ATOM 0 HA ASN A 116 117.253 -17.730 -10.027 1.00 0.00 H new ATOM 0 HB2 ASN A 116 115.240 -20.011 -9.764 1.00 0.00 H new ATOM 0 HB3 ASN A 116 116.915 -20.208 -9.288 1.00 0.00 H new ATOM 0 HD21 ASN A 116 116.493 -18.422 -6.218 1.00 0.00 H new ATOM 0 HD22 ASN A 116 117.551 -19.400 -7.240 1.00 0.00 H new ATOM 1726 N PRO A 117 118.158 -18.520 -12.314 1.00 0.00 N ATOM 1727 CA PRO A 117 118.848 -19.169 -13.468 1.00 0.00 C ATOM 1728 C PRO A 117 119.903 -20.174 -13.012 1.00 0.00 C ATOM 1729 O PRO A 117 119.957 -20.539 -11.837 1.00 0.00 O ATOM 1730 CB PRO A 117 119.490 -17.999 -14.216 1.00 0.00 C ATOM 1731 CG PRO A 117 119.750 -16.966 -13.174 1.00 0.00 C ATOM 1732 CD PRO A 117 118.700 -17.163 -12.080 1.00 0.00 C ATOM 0 HA PRO A 117 118.159 -19.744 -14.087 1.00 0.00 H new ATOM 0 HB2 PRO A 117 120.414 -18.305 -14.707 1.00 0.00 H new ATOM 0 HB3 PRO A 117 118.828 -17.617 -14.993 1.00 0.00 H new ATOM 0 HG2 PRO A 117 120.756 -17.073 -12.767 1.00 0.00 H new ATOM 0 HG3 PRO A 117 119.682 -15.964 -13.598 1.00 0.00 H new ATOM 0 HD2 PRO A 117 119.143 -17.080 -11.087 1.00 0.00 H new ATOM 0 HD3 PRO A 117 117.916 -16.408 -12.144 1.00 0.00 H new ATOM 1740 N MET A 118 120.739 -20.619 -13.945 1.00 0.00 N ATOM 1741 CA MET A 118 121.788 -21.580 -13.621 1.00 0.00 C ATOM 1742 C MET A 118 122.696 -21.047 -12.514 1.00 0.00 C ATOM 1743 O MET A 118 123.139 -21.801 -11.647 1.00 0.00 O ATOM 1744 CB MET A 118 122.625 -21.876 -14.867 1.00 0.00 C ATOM 1745 CG MET A 118 121.744 -22.537 -15.930 1.00 0.00 C ATOM 1746 SD MET A 118 122.776 -23.088 -17.311 1.00 0.00 S ATOM 1747 CE MET A 118 123.560 -24.483 -16.467 1.00 0.00 C ATOM 0 H MET A 118 120.712 -20.333 -14.924 1.00 0.00 H new ATOM 0 HA MET A 118 121.313 -22.496 -13.270 1.00 0.00 H new ATOM 0 HB2 MET A 118 123.054 -20.953 -15.258 1.00 0.00 H new ATOM 0 HB3 MET A 118 123.458 -22.531 -14.611 1.00 0.00 H new ATOM 0 HG2 MET A 118 121.211 -23.385 -15.500 1.00 0.00 H new ATOM 0 HG3 MET A 118 120.991 -21.832 -16.283 1.00 0.00 H new ATOM 0 HE1 MET A 118 123.657 -25.319 -17.159 1.00 0.00 H new ATOM 0 HE2 MET A 118 124.548 -24.187 -16.116 1.00 0.00 H new ATOM 0 HE3 MET A 118 122.948 -24.785 -15.617 1.00 0.00 H new ATOM 1757 N GLU A 119 122.972 -19.747 -12.548 1.00 0.00 N ATOM 1758 CA GLU A 119 123.804 -19.120 -11.529 1.00 0.00 C ATOM 1759 C GLU A 119 123.195 -19.317 -10.145 1.00 0.00 C ATOM 1760 O GLU A 119 121.983 -19.482 -10.009 1.00 0.00 O ATOM 1761 CB GLU A 119 123.946 -17.624 -11.818 1.00 0.00 C ATOM 1762 CG GLU A 119 124.647 -17.426 -13.168 1.00 0.00 C ATOM 1763 CD GLU A 119 124.894 -15.944 -13.468 1.00 0.00 C ATOM 1764 OE1 GLU A 119 124.369 -15.095 -12.761 1.00 0.00 O ATOM 1765 OE2 GLU A 119 125.613 -15.676 -14.416 1.00 0.00 O ATOM 0 H GLU A 119 122.632 -19.110 -13.268 1.00 0.00 H new ATOM 0 HA GLU A 119 124.788 -19.589 -11.551 1.00 0.00 H new ATOM 0 HB2 GLU A 119 122.964 -17.151 -11.834 1.00 0.00 H new ATOM 0 HB3 GLU A 119 124.519 -17.143 -11.025 1.00 0.00 H new ATOM 0 HG2 GLU A 119 125.597 -17.960 -13.166 1.00 0.00 H new ATOM 0 HG3 GLU A 119 124.039 -17.861 -13.961 1.00 0.00 H new ATOM 1772 N ASN A 120 124.042 -19.301 -9.121 1.00 0.00 N ATOM 1773 CA ASN A 120 123.567 -19.474 -7.747 1.00 0.00 C ATOM 1774 C ASN A 120 122.993 -18.181 -7.144 1.00 0.00 C ATOM 1775 O ASN A 120 122.761 -18.114 -5.937 1.00 0.00 O ATOM 1776 CB ASN A 120 124.714 -19.991 -6.872 1.00 0.00 C ATOM 1777 CG ASN A 120 125.820 -18.944 -6.750 1.00 0.00 C ATOM 1778 OD1 ASN A 120 125.895 -18.016 -7.557 1.00 0.00 O ATOM 1779 ND2 ASN A 120 126.690 -19.039 -5.782 1.00 0.00 N ATOM 0 H ASN A 120 125.050 -19.172 -9.211 1.00 0.00 H new ATOM 0 HA ASN A 120 122.752 -20.198 -7.776 1.00 0.00 H new ATOM 0 HB2 ASN A 120 124.336 -20.244 -5.881 1.00 0.00 H new ATOM 0 HB3 ASN A 120 125.120 -20.907 -7.301 1.00 0.00 H new ATOM 0 HD21 ASN A 120 127.432 -18.345 -5.693 1.00 0.00 H new ATOM 0 HD22 ASN A 120 126.628 -19.807 -5.114 1.00 0.00 H new ATOM 1786 N VAL A 121 122.763 -17.159 -7.971 1.00 0.00 N ATOM 1787 CA VAL A 121 122.184 -15.903 -7.505 1.00 0.00 C ATOM 1788 C VAL A 121 120.817 -15.701 -8.149 1.00 0.00 C ATOM 1789 O VAL A 121 120.601 -16.089 -9.297 1.00 0.00 O ATOM 1790 CB VAL A 121 123.105 -14.728 -7.859 1.00 0.00 C ATOM 1791 CG1 VAL A 121 122.534 -13.430 -7.281 1.00 0.00 C ATOM 1792 CG2 VAL A 121 124.498 -14.965 -7.268 1.00 0.00 C ATOM 0 H VAL A 121 122.971 -17.180 -8.969 1.00 0.00 H new ATOM 0 HA VAL A 121 122.072 -15.945 -6.422 1.00 0.00 H new ATOM 0 HB VAL A 121 123.174 -14.648 -8.944 1.00 0.00 H new ATOM 0 HG11 VAL A 121 123.191 -12.598 -7.535 1.00 0.00 H new ATOM 0 HG12 VAL A 121 121.544 -13.250 -7.699 1.00 0.00 H new ATOM 0 HG13 VAL A 121 122.460 -13.516 -6.197 1.00 0.00 H new ATOM 0 HG21 VAL A 121 125.148 -14.128 -7.522 1.00 0.00 H new ATOM 0 HG22 VAL A 121 124.424 -15.051 -6.184 1.00 0.00 H new ATOM 0 HG23 VAL A 121 124.915 -15.885 -7.677 1.00 0.00 H new ATOM 1802 N ALA A 122 119.894 -15.094 -7.408 1.00 0.00 N ATOM 1803 CA ALA A 122 118.536 -14.885 -7.908 1.00 0.00 C ATOM 1804 C ALA A 122 118.257 -13.395 -8.066 1.00 0.00 C ATOM 1805 O ALA A 122 118.802 -12.576 -7.328 1.00 0.00 O ATOM 1806 CB ALA A 122 117.524 -15.491 -6.934 1.00 0.00 C ATOM 0 H ALA A 122 120.058 -14.740 -6.466 1.00 0.00 H new ATOM 0 HA ALA A 122 118.443 -15.372 -8.879 1.00 0.00 H new ATOM 0 HB1 ALA A 122 116.514 -15.332 -7.313 1.00 0.00 H new ATOM 0 HB2 ALA A 122 117.710 -16.560 -6.835 1.00 0.00 H new ATOM 0 HB3 ALA A 122 117.626 -15.013 -5.960 1.00 0.00 H new ATOM 1812 N LEU A 123 117.402 -13.056 -9.027 1.00 0.00 N ATOM 1813 CA LEU A 123 117.109 -11.659 -9.335 1.00 0.00 C ATOM 1814 C LEU A 123 115.652 -11.351 -9.010 1.00 0.00 C ATOM 1815 O LEU A 123 114.773 -12.163 -9.288 1.00 0.00 O ATOM 1816 CB LEU A 123 117.373 -11.387 -10.818 1.00 0.00 C ATOM 1817 CG LEU A 123 117.236 -9.890 -11.105 1.00 0.00 C ATOM 1818 CD1 LEU A 123 118.512 -9.164 -10.672 1.00 0.00 C ATOM 1819 CD2 LEU A 123 117.018 -9.680 -12.606 1.00 0.00 C ATOM 0 H LEU A 123 116.900 -13.729 -9.606 1.00 0.00 H new ATOM 0 HA LEU A 123 117.754 -11.020 -8.732 1.00 0.00 H new ATOM 0 HB2 LEU A 123 118.373 -11.728 -11.087 1.00 0.00 H new ATOM 0 HB3 LEU A 123 116.669 -11.950 -11.431 1.00 0.00 H new ATOM 0 HG LEU A 123 116.387 -9.491 -10.550 1.00 0.00 H new ATOM 0 HD11 LEU A 123 118.412 -8.098 -10.877 1.00 0.00 H new ATOM 0 HD12 LEU A 123 118.672 -9.314 -9.604 1.00 0.00 H new ATOM 0 HD13 LEU A 123 119.363 -9.562 -11.225 1.00 0.00 H new ATOM 0 HD21 LEU A 123 116.920 -8.615 -12.814 1.00 0.00 H new ATOM 0 HD22 LEU A 123 117.869 -10.080 -13.157 1.00 0.00 H new ATOM 0 HD23 LEU A 123 116.109 -10.195 -12.917 1.00 0.00 H new ATOM 1831 N ASP A 124 115.400 -10.188 -8.415 1.00 0.00 N ATOM 1832 CA ASP A 124 114.040 -9.813 -8.042 1.00 0.00 C ATOM 1833 C ASP A 124 113.706 -8.436 -8.596 1.00 0.00 C ATOM 1834 O ASP A 124 114.532 -7.525 -8.543 1.00 0.00 O ATOM 1835 CB ASP A 124 113.905 -9.795 -6.519 1.00 0.00 C ATOM 1836 CG ASP A 124 114.284 -11.155 -5.944 1.00 0.00 C ATOM 1837 OD1 ASP A 124 113.402 -11.988 -5.815 1.00 0.00 O ATOM 1838 OD2 ASP A 124 115.450 -11.344 -5.640 1.00 0.00 O ATOM 0 H ASP A 124 116.112 -9.496 -8.183 1.00 0.00 H new ATOM 0 HA ASP A 124 113.348 -10.545 -8.459 1.00 0.00 H new ATOM 0 HB2 ASP A 124 114.548 -9.022 -6.098 1.00 0.00 H new ATOM 0 HB3 ASP A 124 112.881 -9.546 -6.240 1.00 0.00 H new ATOM 1843 N PHE A 125 112.498 -8.295 -9.136 1.00 0.00 N ATOM 1844 CA PHE A 125 112.042 -7.001 -9.636 1.00 0.00 C ATOM 1845 C PHE A 125 110.603 -6.756 -9.198 1.00 0.00 C ATOM 1846 O PHE A 125 109.792 -7.680 -9.178 1.00 0.00 O ATOM 1847 CB PHE A 125 112.137 -6.963 -11.162 1.00 0.00 C ATOM 1848 CG PHE A 125 111.227 -7.949 -11.855 1.00 0.00 C ATOM 1849 CD1 PHE A 125 111.643 -9.272 -12.046 1.00 0.00 C ATOM 1850 CD2 PHE A 125 109.967 -7.540 -12.311 1.00 0.00 C ATOM 1851 CE1 PHE A 125 110.799 -10.185 -12.692 1.00 0.00 C ATOM 1852 CE2 PHE A 125 109.124 -8.452 -12.955 1.00 0.00 C ATOM 1853 CZ PHE A 125 109.540 -9.775 -13.146 1.00 0.00 C ATOM 0 H PHE A 125 111.823 -9.053 -9.238 1.00 0.00 H new ATOM 0 HA PHE A 125 112.679 -6.218 -9.225 1.00 0.00 H new ATOM 0 HB2 PHE A 125 111.897 -5.957 -11.507 1.00 0.00 H new ATOM 0 HB3 PHE A 125 113.167 -7.164 -11.458 1.00 0.00 H new ATOM 0 HD1 PHE A 125 112.614 -9.589 -11.696 1.00 0.00 H new ATOM 0 HD2 PHE A 125 109.646 -6.519 -12.165 1.00 0.00 H new ATOM 0 HE1 PHE A 125 111.120 -11.206 -12.840 1.00 0.00 H new ATOM 0 HE2 PHE A 125 108.152 -8.135 -13.305 1.00 0.00 H new ATOM 0 HZ PHE A 125 108.890 -10.479 -13.644 1.00 0.00 H new ATOM 1863 N SER A 126 110.295 -5.511 -8.847 1.00 0.00 N ATOM 1864 CA SER A 126 108.960 -5.178 -8.364 1.00 0.00 C ATOM 1865 C SER A 126 108.526 -3.803 -8.860 1.00 0.00 C ATOM 1866 O SER A 126 109.359 -2.945 -9.156 1.00 0.00 O ATOM 1867 CB SER A 126 108.945 -5.189 -6.835 1.00 0.00 C ATOM 1868 OG SER A 126 109.527 -6.400 -6.371 1.00 0.00 O ATOM 0 H SER A 126 110.943 -4.725 -8.887 1.00 0.00 H new ATOM 0 HA SER A 126 108.265 -5.924 -8.749 1.00 0.00 H new ATOM 0 HB2 SER A 126 109.499 -4.334 -6.448 1.00 0.00 H new ATOM 0 HB3 SER A 126 107.922 -5.099 -6.469 1.00 0.00 H new ATOM 0 HG SER A 126 109.521 -6.411 -5.391 1.00 0.00 H new ATOM 1874 N TYR A 127 107.215 -3.603 -8.948 1.00 0.00 N ATOM 1875 CA TYR A 127 106.662 -2.295 -9.290 1.00 0.00 C ATOM 1876 C TYR A 127 105.917 -1.729 -8.087 1.00 0.00 C ATOM 1877 O TYR A 127 104.936 -2.312 -7.625 1.00 0.00 O ATOM 1878 CB TYR A 127 105.704 -2.425 -10.474 1.00 0.00 C ATOM 1879 CG TYR A 127 105.137 -1.103 -10.936 1.00 0.00 C ATOM 1880 CD1 TYR A 127 105.864 -0.303 -11.827 1.00 0.00 C ATOM 1881 CD2 TYR A 127 103.885 -0.679 -10.476 1.00 0.00 C ATOM 1882 CE1 TYR A 127 105.338 0.921 -12.255 1.00 0.00 C ATOM 1883 CE2 TYR A 127 103.360 0.546 -10.904 1.00 0.00 C ATOM 1884 CZ TYR A 127 104.086 1.347 -11.794 1.00 0.00 C ATOM 1885 OH TYR A 127 103.569 2.554 -12.216 1.00 0.00 O ATOM 0 H TYR A 127 106.516 -4.328 -8.788 1.00 0.00 H new ATOM 0 HA TYR A 127 107.475 -1.623 -9.565 1.00 0.00 H new ATOM 0 HB2 TYR A 127 106.228 -2.897 -11.305 1.00 0.00 H new ATOM 0 HB3 TYR A 127 104.883 -3.087 -10.197 1.00 0.00 H new ATOM 0 HD1 TYR A 127 106.829 -0.631 -12.183 1.00 0.00 H new ATOM 0 HD2 TYR A 127 103.324 -1.297 -9.791 1.00 0.00 H new ATOM 0 HE1 TYR A 127 105.898 1.538 -12.942 1.00 0.00 H new ATOM 0 HE2 TYR A 127 102.395 0.874 -10.548 1.00 0.00 H new ATOM 0 HH TYR A 127 102.692 2.697 -11.802 1.00 0.00 H new ATOM 1895 N GLU A 128 106.385 -0.592 -7.581 1.00 0.00 N ATOM 1896 CA GLU A 128 105.805 0.001 -6.378 1.00 0.00 C ATOM 1897 C GLU A 128 105.134 1.334 -6.690 1.00 0.00 C ATOM 1898 O GLU A 128 105.693 2.174 -7.394 1.00 0.00 O ATOM 1899 CB GLU A 128 106.902 0.218 -5.332 1.00 0.00 C ATOM 1900 CG GLU A 128 106.272 0.678 -4.014 1.00 0.00 C ATOM 1901 CD GLU A 128 105.482 -0.456 -3.359 1.00 0.00 C ATOM 1902 OE1 GLU A 128 105.793 -1.609 -3.612 1.00 0.00 O ATOM 1903 OE2 GLU A 128 104.571 -0.151 -2.609 1.00 0.00 O ATOM 0 H GLU A 128 107.160 -0.064 -7.982 1.00 0.00 H new ATOM 0 HA GLU A 128 105.050 -0.683 -5.991 1.00 0.00 H new ATOM 0 HB2 GLU A 128 107.459 -0.706 -5.177 1.00 0.00 H new ATOM 0 HB3 GLU A 128 107.614 0.964 -5.686 1.00 0.00 H new ATOM 0 HG2 GLU A 128 107.052 1.022 -3.335 1.00 0.00 H new ATOM 0 HG3 GLU A 128 105.613 1.526 -4.198 1.00 0.00 H new ATOM 1910 N GLN A 129 103.929 1.515 -6.159 1.00 0.00 N ATOM 1911 CA GLN A 129 103.205 2.774 -6.304 1.00 0.00 C ATOM 1912 C GLN A 129 102.860 3.327 -4.926 1.00 0.00 C ATOM 1913 O GLN A 129 102.395 2.588 -4.058 1.00 0.00 O ATOM 1914 CB GLN A 129 101.921 2.550 -7.105 1.00 0.00 C ATOM 1915 CG GLN A 129 101.232 3.899 -7.359 1.00 0.00 C ATOM 1916 CD GLN A 129 99.870 3.758 -8.057 1.00 0.00 C ATOM 1917 OE1 GLN A 129 99.155 4.754 -8.180 1.00 0.00 O ATOM 1918 NE2 GLN A 129 99.451 2.615 -8.541 1.00 0.00 N ATOM 0 H GLN A 129 103.432 0.804 -5.623 1.00 0.00 H new ATOM 0 HA GLN A 129 103.835 3.488 -6.834 1.00 0.00 H new ATOM 0 HB2 GLN A 129 102.152 2.064 -8.053 1.00 0.00 H new ATOM 0 HB3 GLN A 129 101.251 1.885 -6.560 1.00 0.00 H new ATOM 0 HG2 GLN A 129 101.095 4.415 -6.409 1.00 0.00 H new ATOM 0 HG3 GLN A 129 101.884 4.524 -7.970 1.00 0.00 H new ATOM 0 HE21 GLN A 129 100.029 1.780 -8.449 1.00 0.00 H new ATOM 0 HE22 GLN A 129 98.547 2.561 -9.010 1.00 0.00 H new ATOM 1927 N SER A 130 103.108 4.617 -4.722 1.00 0.00 N ATOM 1928 CA SER A 130 102.812 5.257 -3.443 1.00 0.00 C ATOM 1929 C SER A 130 101.937 6.484 -3.666 1.00 0.00 C ATOM 1930 O SER A 130 102.158 7.249 -4.603 1.00 0.00 O ATOM 1931 CB SER A 130 104.112 5.673 -2.755 1.00 0.00 C ATOM 1932 OG SER A 130 104.918 4.523 -2.544 1.00 0.00 O ATOM 0 H SER A 130 103.512 5.239 -5.423 1.00 0.00 H new ATOM 0 HA SER A 130 102.281 4.548 -2.808 1.00 0.00 H new ATOM 0 HB2 SER A 130 104.646 6.398 -3.369 1.00 0.00 H new ATOM 0 HB3 SER A 130 103.895 6.159 -1.804 1.00 0.00 H new ATOM 0 HG SER A 130 105.754 4.785 -2.104 1.00 0.00 H new ATOM 1938 N ARG A 131 100.937 6.660 -2.808 1.00 0.00 N ATOM 1939 CA ARG A 131 100.019 7.789 -2.933 1.00 0.00 C ATOM 1940 C ARG A 131 100.067 8.678 -1.696 1.00 0.00 C ATOM 1941 O ARG A 131 99.999 8.186 -0.567 1.00 0.00 O ATOM 1942 CB ARG A 131 98.591 7.271 -3.126 1.00 0.00 C ATOM 1943 CG ARG A 131 98.508 6.473 -4.429 1.00 0.00 C ATOM 1944 CD ARG A 131 97.061 6.041 -4.672 1.00 0.00 C ATOM 1945 NE ARG A 131 96.992 5.108 -5.800 1.00 0.00 N ATOM 1946 CZ ARG A 131 95.858 4.514 -6.202 1.00 0.00 C ATOM 1947 NH1 ARG A 131 94.708 4.728 -5.608 1.00 0.00 N ATOM 1948 NH2 ARG A 131 95.900 3.698 -7.219 1.00 0.00 N ATOM 0 H ARG A 131 100.741 6.040 -2.022 1.00 0.00 H new ATOM 0 HA ARG A 131 100.324 8.380 -3.796 1.00 0.00 H new ATOM 0 HB2 ARG A 131 98.304 6.642 -2.283 1.00 0.00 H new ATOM 0 HB3 ARG A 131 97.891 8.106 -3.153 1.00 0.00 H new ATOM 0 HG2 ARG A 131 98.862 7.080 -5.262 1.00 0.00 H new ATOM 0 HG3 ARG A 131 99.155 5.598 -4.374 1.00 0.00 H new ATOM 0 HD2 ARG A 131 96.660 5.569 -3.775 1.00 0.00 H new ATOM 0 HD3 ARG A 131 96.443 6.915 -4.876 1.00 0.00 H new ATOM 0 HE ARG A 131 97.852 4.899 -6.307 1.00 0.00 H new ATOM 0 HH11 ARG A 131 94.656 5.364 -4.812 1.00 0.00 H new ATOM 0 HH12 ARG A 131 93.866 4.258 -5.942 1.00 0.00 H new ATOM 0 HH21 ARG A 131 96.785 3.521 -7.694 1.00 0.00 H new ATOM 0 HH22 ARG A 131 95.048 3.237 -7.539 1.00 0.00 H new ATOM 1962 N ILE A 132 100.222 9.982 -1.921 1.00 0.00 N ATOM 1963 CA ILE A 132 100.029 10.966 -0.865 1.00 0.00 C ATOM 1964 C ILE A 132 99.045 11.965 -1.434 1.00 0.00 C ATOM 1965 O ILE A 132 99.441 12.710 -2.324 1.00 0.00 O ATOM 1966 CB ILE A 132 101.346 11.668 -0.523 1.00 0.00 C ATOM 1967 CG1 ILE A 132 102.369 10.636 -0.048 1.00 0.00 C ATOM 1968 CG2 ILE A 132 101.108 12.692 0.588 1.00 0.00 C ATOM 1969 CD1 ILE A 132 103.748 11.290 0.051 1.00 0.00 C ATOM 0 H ILE A 132 100.480 10.378 -2.825 1.00 0.00 H new ATOM 0 HA ILE A 132 99.670 10.502 0.054 1.00 0.00 H new ATOM 0 HB ILE A 132 101.724 12.174 -1.411 1.00 0.00 H new ATOM 0 HG12 ILE A 132 102.074 10.236 0.922 1.00 0.00 H new ATOM 0 HG13 ILE A 132 102.402 9.796 -0.742 1.00 0.00 H new ATOM 0 HG21 ILE A 132 102.046 13.191 0.830 1.00 0.00 H new ATOM 0 HG22 ILE A 132 100.381 13.431 0.252 1.00 0.00 H new ATOM 0 HG23 ILE A 132 100.727 12.185 1.475 1.00 0.00 H new ATOM 0 HD11 ILE A 132 104.477 10.553 0.390 1.00 0.00 H new ATOM 0 HD12 ILE A 132 104.043 11.668 -0.928 1.00 0.00 H new ATOM 0 HD13 ILE A 132 103.709 12.115 0.762 1.00 0.00 H new ATOM 1981 N ARG A 133 97.807 11.994 -0.922 1.00 0.00 N ATOM 1982 CA ARG A 133 96.675 12.556 -1.674 1.00 0.00 C ATOM 1983 C ARG A 133 97.014 13.889 -2.339 1.00 0.00 C ATOM 1984 O ARG A 133 96.868 14.954 -1.737 1.00 0.00 O ATOM 1985 CB ARG A 133 95.484 12.747 -0.731 1.00 0.00 C ATOM 1986 CG ARG A 133 94.244 13.155 -1.532 1.00 0.00 C ATOM 1987 CD ARG A 133 93.091 13.453 -0.573 1.00 0.00 C ATOM 1988 NE ARG A 133 92.763 12.261 0.215 1.00 0.00 N ATOM 1989 CZ ARG A 133 91.735 12.202 1.073 1.00 0.00 C ATOM 1990 NH1 ARG A 133 90.933 13.219 1.278 1.00 0.00 N ATOM 1991 NH2 ARG A 133 91.524 11.093 1.729 1.00 0.00 N ATOM 0 H ARG A 133 97.564 11.638 0.003 1.00 0.00 H new ATOM 0 HA ARG A 133 96.430 11.850 -2.468 1.00 0.00 H new ATOM 0 HB2 ARG A 133 95.288 11.823 -0.187 1.00 0.00 H new ATOM 0 HB3 ARG A 133 95.716 13.511 0.011 1.00 0.00 H new ATOM 0 HG2 ARG A 133 94.463 14.034 -2.138 1.00 0.00 H new ATOM 0 HG3 ARG A 133 93.963 12.356 -2.218 1.00 0.00 H new ATOM 0 HD2 ARG A 133 93.364 14.273 0.092 1.00 0.00 H new ATOM 0 HD3 ARG A 133 92.216 13.777 -1.136 1.00 0.00 H new ATOM 0 HE ARG A 133 93.348 11.433 0.104 1.00 0.00 H new ATOM 0 HH11 ARG A 133 91.081 14.094 0.776 1.00 0.00 H new ATOM 0 HH12 ARG A 133 90.161 13.135 1.940 1.00 0.00 H new ATOM 0 HH21 ARG A 133 92.137 10.290 1.584 1.00 0.00 H new ATOM 0 HH22 ARG A 133 90.747 11.029 2.386 1.00 0.00 H new ATOM 2005 N SER A 134 97.402 13.766 -3.617 1.00 0.00 N ATOM 2006 CA SER A 134 97.846 14.865 -4.487 1.00 0.00 C ATOM 2007 C SER A 134 98.843 14.319 -5.510 1.00 0.00 C ATOM 2008 O SER A 134 98.670 14.498 -6.717 1.00 0.00 O ATOM 2009 CB SER A 134 98.533 16.012 -3.728 1.00 0.00 C ATOM 2010 OG SER A 134 97.540 16.874 -3.190 1.00 0.00 O ATOM 0 H SER A 134 97.416 12.863 -4.091 1.00 0.00 H new ATOM 0 HA SER A 134 96.949 15.269 -4.956 1.00 0.00 H new ATOM 0 HB2 SER A 134 99.158 15.613 -2.929 1.00 0.00 H new ATOM 0 HB3 SER A 134 99.189 16.567 -4.399 1.00 0.00 H new ATOM 0 HG SER A 134 96.925 16.355 -2.630 1.00 0.00 H new ATOM 2016 N VAL A 135 99.891 13.654 -5.017 1.00 0.00 N ATOM 2017 CA VAL A 135 101.010 13.246 -5.863 1.00 0.00 C ATOM 2018 C VAL A 135 101.030 11.732 -6.065 1.00 0.00 C ATOM 2019 O VAL A 135 100.822 10.968 -5.119 1.00 0.00 O ATOM 2020 CB VAL A 135 102.323 13.723 -5.224 1.00 0.00 C ATOM 2021 CG1 VAL A 135 102.518 13.057 -3.859 1.00 0.00 C ATOM 2022 CG2 VAL A 135 103.505 13.377 -6.133 1.00 0.00 C ATOM 0 H VAL A 135 99.986 13.388 -4.037 1.00 0.00 H new ATOM 0 HA VAL A 135 100.894 13.703 -6.846 1.00 0.00 H new ATOM 0 HB VAL A 135 102.273 14.804 -5.092 1.00 0.00 H new ATOM 0 HG11 VAL A 135 103.452 13.403 -3.416 1.00 0.00 H new ATOM 0 HG12 VAL A 135 101.687 13.319 -3.204 1.00 0.00 H new ATOM 0 HG13 VAL A 135 102.554 11.975 -3.984 1.00 0.00 H new ATOM 0 HG21 VAL A 135 104.431 13.719 -5.671 1.00 0.00 H new ATOM 0 HG22 VAL A 135 103.549 12.298 -6.278 1.00 0.00 H new ATOM 0 HG23 VAL A 135 103.378 13.868 -7.098 1.00 0.00 H new ATOM 2032 N ASP A 136 101.288 11.318 -7.303 1.00 0.00 N ATOM 2033 CA ASP A 136 101.449 9.900 -7.618 1.00 0.00 C ATOM 2034 C ASP A 136 102.928 9.575 -7.816 1.00 0.00 C ATOM 2035 O ASP A 136 103.565 10.127 -8.711 1.00 0.00 O ATOM 2036 CB ASP A 136 100.671 9.553 -8.888 1.00 0.00 C ATOM 2037 CG ASP A 136 100.728 8.050 -9.140 1.00 0.00 C ATOM 2038 OD1 ASP A 136 99.854 7.353 -8.650 1.00 0.00 O ATOM 2039 OD2 ASP A 136 101.644 7.617 -9.819 1.00 0.00 O ATOM 0 H ASP A 136 101.390 11.942 -8.103 1.00 0.00 H new ATOM 0 HA ASP A 136 101.060 9.309 -6.789 1.00 0.00 H new ATOM 0 HB2 ASP A 136 99.634 9.874 -8.788 1.00 0.00 H new ATOM 0 HB3 ASP A 136 101.091 10.089 -9.739 1.00 0.00 H new ATOM 2044 N VAL A 137 103.477 8.679 -6.999 1.00 0.00 N ATOM 2045 CA VAL A 137 104.901 8.351 -7.084 1.00 0.00 C ATOM 2046 C VAL A 137 105.088 6.928 -7.602 1.00 0.00 C ATOM 2047 O VAL A 137 104.448 5.998 -7.116 1.00 0.00 O ATOM 2048 CB VAL A 137 105.557 8.490 -5.703 1.00 0.00 C ATOM 2049 CG1 VAL A 137 107.066 8.249 -5.816 1.00 0.00 C ATOM 2050 CG2 VAL A 137 105.323 9.901 -5.154 1.00 0.00 C ATOM 0 H VAL A 137 102.965 8.171 -6.277 1.00 0.00 H new ATOM 0 HA VAL A 137 105.376 9.045 -7.778 1.00 0.00 H new ATOM 0 HB VAL A 137 105.115 7.754 -5.031 1.00 0.00 H new ATOM 0 HG11 VAL A 137 107.525 8.349 -4.832 1.00 0.00 H new ATOM 0 HG12 VAL A 137 107.246 7.245 -6.200 1.00 0.00 H new ATOM 0 HG13 VAL A 137 107.501 8.981 -6.496 1.00 0.00 H new ATOM 0 HG21 VAL A 137 105.791 9.992 -4.174 1.00 0.00 H new ATOM 0 HG22 VAL A 137 105.759 10.633 -5.834 1.00 0.00 H new ATOM 0 HG23 VAL A 137 104.252 10.083 -5.063 1.00 0.00 H new ATOM 2060 N GLY A 138 105.979 6.768 -8.577 1.00 0.00 N ATOM 2061 CA GLY A 138 106.262 5.453 -9.147 1.00 0.00 C ATOM 2062 C GLY A 138 107.738 5.114 -8.978 1.00 0.00 C ATOM 2063 O GLY A 138 108.600 5.946 -9.248 1.00 0.00 O ATOM 0 H GLY A 138 106.517 7.531 -8.989 1.00 0.00 H new ATOM 0 HA2 GLY A 138 105.649 4.696 -8.657 1.00 0.00 H new ATOM 0 HA3 GLY A 138 105.997 5.442 -10.204 1.00 0.00 H new ATOM 2067 N THR A 139 108.021 3.900 -8.513 1.00 0.00 N ATOM 2068 CA THR A 139 109.401 3.481 -8.283 1.00 0.00 C ATOM 2069 C THR A 139 109.655 2.091 -8.858 1.00 0.00 C ATOM 2070 O THR A 139 108.815 1.199 -8.747 1.00 0.00 O ATOM 2071 CB THR A 139 109.693 3.471 -6.781 1.00 0.00 C ATOM 2072 OG1 THR A 139 109.352 4.734 -6.225 1.00 0.00 O ATOM 2073 CG2 THR A 139 111.179 3.194 -6.547 1.00 0.00 C ATOM 0 H THR A 139 107.320 3.194 -8.290 1.00 0.00 H new ATOM 0 HA THR A 139 110.060 4.189 -8.785 1.00 0.00 H new ATOM 0 HB THR A 139 109.102 2.690 -6.303 1.00 0.00 H new ATOM 0 HG1 THR A 139 109.537 4.728 -5.263 1.00 0.00 H new ATOM 0 HG21 THR A 139 111.384 3.188 -5.476 1.00 0.00 H new ATOM 0 HG22 THR A 139 111.440 2.225 -6.972 1.00 0.00 H new ATOM 0 HG23 THR A 139 111.774 3.972 -7.025 1.00 0.00 H new ATOM 2081 N TRP A 140 110.821 1.918 -9.475 1.00 0.00 N ATOM 2082 CA TRP A 140 111.228 0.610 -9.980 1.00 0.00 C ATOM 2083 C TRP A 140 112.311 0.027 -9.077 1.00 0.00 C ATOM 2084 O TRP A 140 113.280 0.708 -8.747 1.00 0.00 O ATOM 2085 CB TRP A 140 111.768 0.745 -11.405 1.00 0.00 C ATOM 2086 CG TRP A 140 110.732 1.160 -12.400 1.00 0.00 C ATOM 2087 CD1 TRP A 140 110.545 2.423 -12.846 1.00 0.00 C ATOM 2088 CD2 TRP A 140 109.744 0.333 -13.084 1.00 0.00 C ATOM 2089 NE1 TRP A 140 109.503 2.428 -13.756 1.00 0.00 N ATOM 2090 CE2 TRP A 140 108.977 1.164 -13.937 1.00 0.00 C ATOM 2091 CE3 TRP A 140 109.441 -1.039 -13.047 1.00 0.00 C ATOM 2092 CZ2 TRP A 140 107.947 0.647 -14.726 1.00 0.00 C ATOM 2093 CZ3 TRP A 140 108.407 -1.560 -13.838 1.00 0.00 C ATOM 2094 CH2 TRP A 140 107.660 -0.720 -14.676 1.00 0.00 C ATOM 0 H TRP A 140 111.498 2.664 -9.637 1.00 0.00 H new ATOM 0 HA TRP A 140 110.364 -0.054 -9.987 1.00 0.00 H new ATOM 0 HB2 TRP A 140 112.578 1.475 -11.410 1.00 0.00 H new ATOM 0 HB3 TRP A 140 112.196 -0.209 -11.715 1.00 0.00 H new ATOM 0 HD1 TRP A 140 111.116 3.287 -12.541 1.00 0.00 H new ATOM 0 HE1 TRP A 140 109.165 3.263 -14.235 1.00 0.00 H new ATOM 0 HE3 TRP A 140 110.008 -1.696 -12.405 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 107.376 1.299 -15.370 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 108.184 -2.616 -13.801 1.00 0.00 H new ATOM 0 HH2 TRP A 140 106.864 -1.128 -15.282 1.00 0.00 H new ATOM 2105 N ILE A 141 112.146 -1.232 -8.681 1.00 0.00 N ATOM 2106 CA ILE A 141 113.091 -1.871 -7.763 1.00 0.00 C ATOM 2107 C ILE A 141 113.705 -3.113 -8.405 1.00 0.00 C ATOM 2108 O ILE A 141 112.994 -3.956 -8.952 1.00 0.00 O ATOM 2109 CB ILE A 141 112.377 -2.264 -6.462 1.00 0.00 C ATOM 2110 CG1 ILE A 141 111.710 -1.032 -5.840 1.00 0.00 C ATOM 2111 CG2 ILE A 141 113.387 -2.836 -5.464 1.00 0.00 C ATOM 2112 CD1 ILE A 141 110.850 -1.460 -4.649 1.00 0.00 C ATOM 0 H ILE A 141 111.373 -1.828 -8.977 1.00 0.00 H new ATOM 0 HA ILE A 141 113.886 -1.160 -7.539 1.00 0.00 H new ATOM 0 HB ILE A 141 111.622 -3.015 -6.692 1.00 0.00 H new ATOM 0 HG12 ILE A 141 112.469 -0.320 -5.516 1.00 0.00 H new ATOM 0 HG13 ILE A 141 111.094 -0.526 -6.583 1.00 0.00 H new ATOM 0 HG21 ILE A 141 112.873 -3.112 -4.544 1.00 0.00 H new ATOM 0 HG22 ILE A 141 113.863 -3.718 -5.893 1.00 0.00 H new ATOM 0 HG23 ILE A 141 114.146 -2.085 -5.244 1.00 0.00 H new ATOM 0 HD11 ILE A 141 110.377 -0.583 -4.208 1.00 0.00 H new ATOM 0 HD12 ILE A 141 110.082 -2.156 -4.986 1.00 0.00 H new ATOM 0 HD13 ILE A 141 111.478 -1.947 -3.903 1.00 0.00 H new ATOM 2124 N ALA A 142 115.029 -3.217 -8.335 1.00 0.00 N ATOM 2125 CA ALA A 142 115.714 -4.417 -8.804 1.00 0.00 C ATOM 2126 C ALA A 142 116.891 -4.737 -7.887 1.00 0.00 C ATOM 2127 O ALA A 142 117.609 -3.832 -7.461 1.00 0.00 O ATOM 2128 CB ALA A 142 116.217 -4.210 -10.233 1.00 0.00 C ATOM 0 H ALA A 142 115.643 -2.493 -7.962 1.00 0.00 H new ATOM 0 HA ALA A 142 115.011 -5.250 -8.790 1.00 0.00 H new ATOM 0 HB1 ALA A 142 116.727 -5.111 -10.573 1.00 0.00 H new ATOM 0 HB2 ALA A 142 115.372 -4.001 -10.889 1.00 0.00 H new ATOM 0 HB3 ALA A 142 116.911 -3.370 -10.256 1.00 0.00 H new ATOM 2134 N GLY A 143 117.089 -6.020 -7.586 1.00 0.00 N ATOM 2135 CA GLY A 143 118.168 -6.413 -6.685 1.00 0.00 C ATOM 2136 C GLY A 143 118.503 -7.893 -6.826 1.00 0.00 C ATOM 2137 O GLY A 143 117.901 -8.599 -7.632 1.00 0.00 O ATOM 0 H GLY A 143 116.527 -6.791 -7.946 1.00 0.00 H new ATOM 0 HA2 GLY A 143 119.055 -5.816 -6.897 1.00 0.00 H new ATOM 0 HA3 GLY A 143 117.879 -6.201 -5.656 1.00 0.00 H new ATOM 2141 N VAL A 144 119.448 -8.355 -6.013 1.00 0.00 N ATOM 2142 CA VAL A 144 119.898 -9.743 -6.071 1.00 0.00 C ATOM 2143 C VAL A 144 119.872 -10.356 -4.675 1.00 0.00 C ATOM 2144 O VAL A 144 119.952 -9.637 -3.680 1.00 0.00 O ATOM 2145 CB VAL A 144 121.314 -9.813 -6.646 1.00 0.00 C ATOM 2146 CG1 VAL A 144 121.311 -9.261 -8.073 1.00 0.00 C ATOM 2147 CG2 VAL A 144 122.264 -8.974 -5.787 1.00 0.00 C ATOM 0 H VAL A 144 119.917 -7.789 -5.306 1.00 0.00 H new ATOM 0 HA VAL A 144 119.226 -10.306 -6.719 1.00 0.00 H new ATOM 0 HB VAL A 144 121.648 -10.851 -6.651 1.00 0.00 H new ATOM 0 HG11 VAL A 144 122.319 -9.310 -8.484 1.00 0.00 H new ATOM 0 HG12 VAL A 144 120.638 -9.855 -8.691 1.00 0.00 H new ATOM 0 HG13 VAL A 144 120.974 -8.224 -8.061 1.00 0.00 H new ATOM 0 HG21 VAL A 144 123.271 -9.027 -6.200 1.00 0.00 H new ATOM 0 HG22 VAL A 144 121.929 -7.937 -5.780 1.00 0.00 H new ATOM 0 HG23 VAL A 144 122.270 -9.360 -4.768 1.00 0.00 H new ATOM 2157 N GLY A 145 119.756 -11.679 -4.609 1.00 0.00 N ATOM 2158 CA GLY A 145 119.685 -12.359 -3.322 1.00 0.00 C ATOM 2159 C GLY A 145 120.464 -13.668 -3.333 1.00 0.00 C ATOM 2160 O GLY A 145 120.679 -14.265 -4.388 1.00 0.00 O ATOM 0 H GLY A 145 119.710 -12.294 -5.421 1.00 0.00 H new ATOM 0 HA2 GLY A 145 120.080 -11.707 -2.543 1.00 0.00 H new ATOM 0 HA3 GLY A 145 118.643 -12.558 -3.072 1.00 0.00 H new ATOM 2164 N TYR A 146 120.860 -14.112 -2.142 1.00 0.00 N ATOM 2165 CA TYR A 146 121.568 -15.377 -1.991 1.00 0.00 C ATOM 2166 C TYR A 146 120.925 -16.189 -0.873 1.00 0.00 C ATOM 2167 O TYR A 146 120.499 -15.628 0.137 1.00 0.00 O ATOM 2168 CB TYR A 146 123.040 -15.121 -1.663 1.00 0.00 C ATOM 2169 CG TYR A 146 123.868 -16.382 -1.595 1.00 0.00 C ATOM 2170 CD1 TYR A 146 124.498 -16.870 -2.747 1.00 0.00 C ATOM 2171 CD2 TYR A 146 124.006 -17.065 -0.380 1.00 0.00 C ATOM 2172 CE1 TYR A 146 125.266 -18.039 -2.684 1.00 0.00 C ATOM 2173 CE2 TYR A 146 124.774 -18.234 -0.317 1.00 0.00 C ATOM 2174 CZ TYR A 146 125.403 -18.721 -1.469 1.00 0.00 C ATOM 2175 OH TYR A 146 126.160 -19.874 -1.407 1.00 0.00 O ATOM 0 H TYR A 146 120.701 -13.612 -1.267 1.00 0.00 H new ATOM 0 HA TYR A 146 121.507 -15.934 -2.926 1.00 0.00 H new ATOM 0 HB2 TYR A 146 123.463 -14.458 -2.418 1.00 0.00 H new ATOM 0 HB3 TYR A 146 123.106 -14.600 -0.708 1.00 0.00 H new ATOM 0 HD1 TYR A 146 124.391 -16.344 -3.684 1.00 0.00 H new ATOM 0 HD2 TYR A 146 123.520 -16.690 0.508 1.00 0.00 H new ATOM 0 HE1 TYR A 146 125.752 -18.414 -3.572 1.00 0.00 H new ATOM 0 HE2 TYR A 146 124.881 -18.760 0.620 1.00 0.00 H new ATOM 0 HH TYR A 146 126.153 -20.221 -0.491 1.00 0.00 H new ATOM 2185 N ARG A 147 120.853 -17.504 -1.058 1.00 0.00 N ATOM 2186 CA ARG A 147 120.211 -18.378 -0.079 1.00 0.00 C ATOM 2187 C ARG A 147 121.202 -19.405 0.457 1.00 0.00 C ATOM 2188 O ARG A 147 121.989 -19.978 -0.297 1.00 0.00 O ATOM 2189 CB ARG A 147 119.030 -19.099 -0.731 1.00 0.00 C ATOM 2190 CG ARG A 147 118.261 -19.888 0.330 1.00 0.00 C ATOM 2191 CD ARG A 147 117.017 -20.521 -0.296 1.00 0.00 C ATOM 2192 NE ARG A 147 117.397 -21.591 -1.223 1.00 0.00 N ATOM 2193 CZ ARG A 147 117.621 -21.395 -2.532 1.00 0.00 C ATOM 2194 NH1 ARG A 147 117.549 -20.209 -3.085 1.00 0.00 N ATOM 2195 NH2 ARG A 147 117.932 -22.420 -3.277 1.00 0.00 N ATOM 0 H ARG A 147 121.230 -17.987 -1.874 1.00 0.00 H new ATOM 0 HA ARG A 147 119.857 -17.768 0.752 1.00 0.00 H new ATOM 0 HB2 ARG A 147 118.370 -18.376 -1.211 1.00 0.00 H new ATOM 0 HB3 ARG A 147 119.387 -19.771 -1.511 1.00 0.00 H new ATOM 0 HG2 ARG A 147 118.900 -20.662 0.755 1.00 0.00 H new ATOM 0 HG3 ARG A 147 117.972 -19.229 1.149 1.00 0.00 H new ATOM 0 HD2 ARG A 147 116.373 -20.922 0.487 1.00 0.00 H new ATOM 0 HD3 ARG A 147 116.442 -19.761 -0.825 1.00 0.00 H new ATOM 0 HE ARG A 147 117.497 -22.536 -0.853 1.00 0.00 H new ATOM 0 HH11 ARG A 147 117.316 -19.395 -2.517 1.00 0.00 H new ATOM 0 HH12 ARG A 147 117.726 -20.100 -4.084 1.00 0.00 H new ATOM 0 HH21 ARG A 147 118.001 -23.349 -2.863 1.00 0.00 H new ATOM 0 HH22 ARG A 147 118.106 -22.292 -4.274 1.00 0.00 H new ATOM 2209 N PHE A 148 121.156 -19.632 1.765 1.00 0.00 N ATOM 2210 CA PHE A 148 122.050 -20.597 2.396 1.00 0.00 C ATOM 2211 C PHE A 148 121.343 -21.314 3.542 1.00 0.00 C ATOM 2212 O PHE A 148 120.406 -20.747 4.081 1.00 0.00 O ATOM 2213 CB PHE A 148 123.296 -19.885 2.926 1.00 0.00 C ATOM 2214 CG PHE A 148 123.002 -18.885 4.018 1.00 0.00 C ATOM 2215 CD1 PHE A 148 122.723 -17.552 3.691 1.00 0.00 C ATOM 2216 CD2 PHE A 148 123.008 -19.290 5.359 1.00 0.00 C ATOM 2217 CE1 PHE A 148 122.451 -16.625 4.705 1.00 0.00 C ATOM 2218 CE2 PHE A 148 122.736 -18.364 6.371 1.00 0.00 C ATOM 2219 CZ PHE A 148 122.456 -17.031 6.045 1.00 0.00 C ATOM 2220 OXT PHE A 148 121.748 -22.418 3.864 1.00 0.00 O ATOM 0 H PHE A 148 120.514 -19.165 2.406 1.00 0.00 H new ATOM 0 HA PHE A 148 122.344 -21.335 1.649 1.00 0.00 H new ATOM 0 HB2 PHE A 148 123.996 -20.629 3.305 1.00 0.00 H new ATOM 0 HB3 PHE A 148 123.791 -19.374 2.100 1.00 0.00 H new ATOM 0 HD1 PHE A 148 122.718 -17.239 2.657 1.00 0.00 H new ATOM 0 HD2 PHE A 148 123.223 -20.318 5.611 1.00 0.00 H new ATOM 0 HE1 PHE A 148 122.237 -15.597 4.453 1.00 0.00 H new ATOM 0 HE2 PHE A 148 122.742 -18.677 7.405 1.00 0.00 H new ATOM 0 HZ PHE A 148 122.244 -16.317 6.827 1.00 0.00 H new TER 2230 PHE A 148