USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1020 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 6 THR OG1 : rot 170:sc= 0.00267 USER MOD Set 1.2: A 123 ASN : amide:sc= -0.885 X(o=-0.88,f=-1.2) USER MOD Set 2.1: A 28 CYS SG : rot -32:sc= 0.876 USER MOD Set 2.2: A 61 TYR OH : rot 10:sc= 1.94 USER MOD Set 3.1: A 25 MET CE :methyl 169:sc= 0 (180deg=-0.00669) USER MOD Set 3.2: A 84 MET CE :methyl -167:sc= 0 (180deg=-0.0752) USER MOD Single : A 1 GLY N :NH3+ -104:sc= 0.115 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -0.0193 X(o=-0.019,f=-0.019) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc=-0.00891 X(o=-0.0089,f=0) USER MOD Single : A 14 MET CE :methyl 175:sc= -1.93 (180deg=-2.07) USER MOD Single : A 17 HIS : no HD1:sc= -0.941 K(o=-0.94,f=-0.36) USER MOD Single : A 21 THR OG1 : rot -83:sc= 1.28 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 MET CE :methyl -169:sc= -0.294 (180deg=-0.872) USER MOD Single : A 35 MET CE :methyl -170:sc= -0.132 (180deg=-0.242) USER MOD Single : A 37 THR OG1 : rot 84:sc= 0.493 USER MOD Single : A 39 GLN : amide:sc= -4.29! C(o=-4.3!,f=-11!) USER MOD Single : A 41 LYS NZ :NH3+ -157:sc= 1.5 (180deg=0.581) USER MOD Single : A 42 TYR OH : rot 28:sc= 1.19 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0277) USER MOD Single : A 48 GLN : amide:sc= -0.189 K(o=-0.19,f=-3.2!) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -128:sc= 1.3 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.0117) USER MOD Single : A 69 SER OG : rot 180:sc= -0.174 USER MOD Single : A 72 THR OG1 : rot 85:sc= 1.26 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= 0.0702 K(o=0.07,f=-7.9!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= 0.0858 X(o=0.086,f=0) USER MOD Single : A 83 THR OG1 : rot 168:sc= 1.05 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.408 USER MOD Single : A 91 HIS : no HE2:sc= 0.108 K(o=0.11,f=-1.2) USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 CYS SG : rot 158:sc= 0.708 USER MOD Single : A 102 MET CE :methyl 166:sc= -0.0037 (180deg=-0.413) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ -161:sc= -0.0717 (180deg=-0.411) USER MOD Single : A 112 SER OG : rot -153:sc= 1.22 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 35:sc= 0.488 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 84:sc= 1.27 USER MOD Single : A 122 TYR OH : rot 165:sc= -0.213 USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.853 -17.917 -0.109 1.00 32.22 N ATOM 2 CA GLY A 1 2.873 -17.863 0.945 1.00 65.41 C ATOM 3 C GLY A 1 2.603 -16.713 1.889 1.00 71.22 C ATOM 4 O GLY A 1 1.836 -15.811 1.554 1.00 63.24 O ATOM 0 H1 GLY A 1 1.187 -18.690 0.091 1.00 32.22 H new ATOM 0 H2 GLY A 1 1.337 -17.015 -0.139 1.00 32.22 H new ATOM 0 H3 GLY A 1 2.311 -18.084 -1.027 1.00 32.22 H new ATOM 0 HA2 GLY A 1 2.881 -18.801 1.499 1.00 65.41 H new ATOM 0 HA3 GLY A 1 3.860 -17.749 0.497 1.00 65.41 H new ATOM 8 N SER A 2 3.243 -16.722 3.057 1.00 60.32 N ATOM 9 CA SER A 2 3.044 -15.746 4.117 1.00 0.25 C ATOM 10 C SER A 2 4.421 -15.273 4.562 1.00 64.14 C ATOM 11 O SER A 2 5.105 -15.975 5.308 1.00 42.03 O ATOM 12 CB SER A 2 2.250 -16.378 5.265 1.00 34.40 C ATOM 13 OG SER A 2 1.115 -17.054 4.757 1.00 22.23 O ATOM 0 H SER A 2 3.935 -17.432 3.295 1.00 60.32 H new ATOM 0 HA SER A 2 2.465 -14.890 3.771 1.00 0.25 H new ATOM 0 HB2 SER A 2 2.883 -17.075 5.814 1.00 34.40 H new ATOM 0 HB3 SER A 2 1.939 -15.607 5.970 1.00 34.40 H new ATOM 0 HG SER A 2 0.615 -17.456 5.498 1.00 22.23 H new ATOM 19 N HIS A 3 4.849 -14.125 4.043 1.00 42.11 N ATOM 20 CA HIS A 3 6.150 -13.522 4.291 1.00 23.42 C ATOM 21 C HIS A 3 5.934 -12.018 4.501 1.00 62.33 C ATOM 22 O HIS A 3 4.812 -11.531 4.321 1.00 45.15 O ATOM 23 CB HIS A 3 7.092 -13.807 3.109 1.00 32.23 C ATOM 24 CG HIS A 3 7.242 -15.278 2.742 1.00 32.15 C ATOM 25 ND1 HIS A 3 8.193 -16.151 3.233 1.00 50.02 N ATOM 26 CD2 HIS A 3 6.440 -15.998 1.892 1.00 42.24 C ATOM 27 CE1 HIS A 3 7.944 -17.367 2.717 1.00 61.15 C ATOM 28 NE2 HIS A 3 6.897 -17.323 1.873 1.00 74.33 N ATOM 0 H HIS A 3 4.272 -13.568 3.412 1.00 42.11 H new ATOM 0 HA HIS A 3 6.618 -13.944 5.180 1.00 23.42 H new ATOM 0 HB2 HIS A 3 6.728 -13.266 2.236 1.00 32.23 H new ATOM 0 HB3 HIS A 3 8.077 -13.405 3.345 1.00 32.23 H new ATOM 0 HD2 HIS A 3 5.601 -15.610 1.334 1.00 42.24 H new ATOM 0 HE1 HIS A 3 8.508 -18.259 2.948 1.00 61.15 H new ATOM 0 HE2 HIS A 3 6.514 -18.097 1.330 1.00 74.33 H new ATOM 36 N MET A 4 6.983 -11.288 4.891 1.00 14.21 N ATOM 37 CA MET A 4 6.908 -9.872 5.243 1.00 3.22 C ATOM 38 C MET A 4 8.075 -9.111 4.618 1.00 44.22 C ATOM 39 O MET A 4 9.002 -9.723 4.081 1.00 3.40 O ATOM 40 CB MET A 4 6.882 -9.677 6.773 1.00 64.15 C ATOM 41 CG MET A 4 5.648 -10.292 7.439 1.00 20.33 C ATOM 42 SD MET A 4 5.775 -12.063 7.805 1.00 42.31 S ATOM 43 CE MET A 4 4.017 -12.468 7.888 1.00 53.45 C ATOM 0 H MET A 4 7.924 -11.674 4.972 1.00 14.21 H new ATOM 0 HA MET A 4 5.976 -9.470 4.845 1.00 3.22 H new ATOM 0 HB2 MET A 4 7.779 -10.121 7.205 1.00 64.15 H new ATOM 0 HB3 MET A 4 6.915 -8.611 6.997 1.00 64.15 H new ATOM 0 HG2 MET A 4 5.452 -9.758 8.369 1.00 20.33 H new ATOM 0 HG3 MET A 4 4.786 -10.131 6.791 1.00 20.33 H new ATOM 0 HE1 MET A 4 3.898 -13.529 8.107 1.00 53.45 H new ATOM 0 HE2 MET A 4 3.545 -11.880 8.675 1.00 53.45 H new ATOM 0 HE3 MET A 4 3.546 -12.240 6.932 1.00 53.45 H new ATOM 53 N GLY A 5 8.047 -7.777 4.707 1.00 21.35 N ATOM 54 CA GLY A 5 8.898 -6.919 3.900 1.00 24.32 C ATOM 55 C GLY A 5 8.441 -7.010 2.452 1.00 44.44 C ATOM 56 O GLY A 5 7.240 -7.083 2.185 1.00 4.00 O ATOM 0 H GLY A 5 7.431 -7.269 5.342 1.00 21.35 H new ATOM 0 HA2 GLY A 5 8.840 -5.889 4.252 1.00 24.32 H new ATOM 0 HA3 GLY A 5 9.940 -7.227 3.989 1.00 24.32 H new ATOM 60 N THR A 6 9.380 -6.963 1.514 1.00 42.03 N ATOM 61 CA THR A 6 9.054 -7.057 0.106 1.00 62.11 C ATOM 62 C THR A 6 8.589 -8.486 -0.204 1.00 75.12 C ATOM 63 O THR A 6 9.127 -9.459 0.339 1.00 74.03 O ATOM 64 CB THR A 6 10.290 -6.699 -0.734 1.00 31.14 C ATOM 65 OG1 THR A 6 11.062 -5.670 -0.142 1.00 45.21 O ATOM 66 CG2 THR A 6 9.886 -6.206 -2.120 1.00 42.05 C ATOM 0 H THR A 6 10.376 -6.860 1.710 1.00 42.03 H new ATOM 0 HA THR A 6 8.254 -6.359 -0.140 1.00 62.11 H new ATOM 0 HB THR A 6 10.878 -7.615 -0.797 1.00 31.14 H new ATOM 0 HG1 THR A 6 11.914 -5.585 -0.618 1.00 45.21 H new ATOM 0 HG21 THR A 6 10.780 -5.960 -2.693 1.00 42.05 H new ATOM 0 HG22 THR A 6 9.328 -6.987 -2.636 1.00 42.05 H new ATOM 0 HG23 THR A 6 9.261 -5.318 -2.023 1.00 42.05 H new ATOM 74 N VAL A 7 7.669 -8.629 -1.157 1.00 22.22 N ATOM 75 CA VAL A 7 7.238 -9.888 -1.758 1.00 1.41 C ATOM 76 C VAL A 7 7.057 -9.693 -3.281 1.00 22.03 C ATOM 77 O VAL A 7 7.379 -8.621 -3.796 1.00 71.10 O ATOM 78 CB VAL A 7 5.975 -10.392 -1.036 1.00 65.23 C ATOM 79 CG1 VAL A 7 6.214 -10.720 0.448 1.00 63.11 C ATOM 80 CG2 VAL A 7 4.798 -9.409 -1.124 1.00 33.44 C ATOM 0 H VAL A 7 7.179 -7.826 -1.551 1.00 22.22 H new ATOM 0 HA VAL A 7 7.993 -10.665 -1.635 1.00 1.41 H new ATOM 0 HB VAL A 7 5.721 -11.308 -1.569 1.00 65.23 H new ATOM 0 HG11 VAL A 7 5.285 -11.070 0.898 1.00 63.11 H new ATOM 0 HG12 VAL A 7 6.972 -11.498 0.531 1.00 63.11 H new ATOM 0 HG13 VAL A 7 6.554 -9.825 0.968 1.00 63.11 H new ATOM 0 HG21 VAL A 7 3.939 -9.822 -0.596 1.00 33.44 H new ATOM 0 HG22 VAL A 7 5.082 -8.460 -0.669 1.00 33.44 H new ATOM 0 HG23 VAL A 7 4.537 -9.246 -2.170 1.00 33.44 H new ATOM 90 N SER A 8 6.551 -10.698 -4.011 1.00 43.44 N ATOM 91 CA SER A 8 6.199 -10.582 -5.437 1.00 1.10 C ATOM 92 C SER A 8 4.729 -10.967 -5.694 1.00 45.42 C ATOM 93 O SER A 8 4.370 -11.458 -6.766 1.00 74.21 O ATOM 94 CB SER A 8 7.219 -11.338 -6.304 1.00 45.45 C ATOM 95 OG SER A 8 7.384 -12.689 -5.898 1.00 24.10 O ATOM 0 H SER A 8 6.372 -11.625 -3.625 1.00 43.44 H new ATOM 0 HA SER A 8 6.265 -9.537 -5.739 1.00 1.10 H new ATOM 0 HB2 SER A 8 6.896 -11.312 -7.345 1.00 45.45 H new ATOM 0 HB3 SER A 8 8.181 -10.828 -6.256 1.00 45.45 H new ATOM 0 HG SER A 8 8.040 -13.128 -6.479 1.00 24.10 H new ATOM 101 N TRP A 9 3.879 -10.792 -4.681 1.00 44.43 N ATOM 102 CA TRP A 9 2.440 -11.016 -4.721 1.00 61.25 C ATOM 103 C TRP A 9 1.768 -10.207 -5.826 1.00 64.21 C ATOM 104 O TRP A 9 2.128 -9.049 -6.055 1.00 24.22 O ATOM 105 CB TRP A 9 1.873 -10.604 -3.357 1.00 43.11 C ATOM 106 CG TRP A 9 2.128 -11.556 -2.231 1.00 60.33 C ATOM 107 CD1 TRP A 9 2.839 -12.708 -2.291 1.00 53.32 C ATOM 108 CD2 TRP A 9 1.700 -11.426 -0.846 1.00 11.22 C ATOM 109 NE1 TRP A 9 2.913 -13.270 -1.037 1.00 1.12 N ATOM 110 CE2 TRP A 9 2.257 -12.504 -0.100 1.00 73.25 C ATOM 111 CE3 TRP A 9 0.926 -10.482 -0.137 1.00 23.41 C ATOM 112 CZ2 TRP A 9 2.084 -12.619 1.283 1.00 13.32 C ATOM 113 CZ3 TRP A 9 0.739 -10.596 1.251 1.00 73.34 C ATOM 114 CH2 TRP A 9 1.317 -11.662 1.963 1.00 25.41 C ATOM 0 H TRP A 9 4.196 -10.474 -3.765 1.00 44.43 H new ATOM 0 HA TRP A 9 2.244 -12.067 -4.933 1.00 61.25 H new ATOM 0 HB2 TRP A 9 2.291 -9.634 -3.089 1.00 43.11 H new ATOM 0 HB3 TRP A 9 0.796 -10.470 -3.458 1.00 43.11 H new ATOM 0 HD1 TRP A 9 3.280 -13.122 -3.186 1.00 53.32 H new ATOM 0 HE1 TRP A 9 3.394 -14.145 -0.828 1.00 1.12 H new ATOM 0 HE3 TRP A 9 0.471 -9.660 -0.669 1.00 23.41 H new ATOM 0 HZ2 TRP A 9 2.537 -13.438 1.823 1.00 13.32 H new ATOM 0 HZ3 TRP A 9 0.147 -9.860 1.775 1.00 73.34 H new ATOM 0 HH2 TRP A 9 1.171 -11.743 3.030 1.00 25.41 H new ATOM 125 N ASN A 10 0.728 -10.780 -6.439 1.00 4.14 N ATOM 126 CA ASN A 10 -0.164 -10.014 -7.306 1.00 63.45 C ATOM 127 C ASN A 10 -1.010 -9.110 -6.420 1.00 21.34 C ATOM 128 O ASN A 10 -1.196 -9.428 -5.244 1.00 53.14 O ATOM 129 CB ASN A 10 -1.117 -10.944 -8.078 1.00 42.14 C ATOM 130 CG ASN A 10 -0.383 -11.887 -9.012 1.00 3.01 C ATOM 131 OD1 ASN A 10 0.300 -11.444 -9.934 1.00 71.50 O ATOM 132 ND2 ASN A 10 -0.499 -13.187 -8.793 1.00 24.30 N ATOM 0 H ASN A 10 0.486 -11.767 -6.350 1.00 4.14 H new ATOM 0 HA ASN A 10 0.434 -9.447 -8.020 1.00 63.45 H new ATOM 0 HB2 ASN A 10 -1.705 -11.526 -7.368 1.00 42.14 H new ATOM 0 HB3 ASN A 10 -1.819 -10.341 -8.654 1.00 42.14 H new ATOM 0 HD21 ASN A 10 -0.015 -13.851 -9.397 1.00 24.30 H new ATOM 0 HD22 ASN A 10 -1.073 -13.525 -8.020 1.00 24.30 H new ATOM 139 N LEU A 11 -1.664 -8.098 -6.995 1.00 54.34 N ATOM 140 CA LEU A 11 -2.767 -7.391 -6.337 1.00 4.23 C ATOM 141 C LEU A 11 -3.762 -8.391 -5.762 1.00 42.21 C ATOM 142 O LEU A 11 -4.165 -8.255 -4.613 1.00 63.30 O ATOM 143 CB LEU A 11 -3.414 -6.383 -7.309 1.00 34.25 C ATOM 144 CG LEU A 11 -4.584 -5.526 -6.765 1.00 64.43 C ATOM 145 CD1 LEU A 11 -5.950 -6.222 -6.817 1.00 3.13 C ATOM 146 CD2 LEU A 11 -4.339 -4.979 -5.355 1.00 74.42 C ATOM 0 H LEU A 11 -1.445 -7.746 -7.927 1.00 54.34 H new ATOM 0 HA LEU A 11 -2.384 -6.811 -5.498 1.00 4.23 H new ATOM 0 HB2 LEU A 11 -2.635 -5.707 -7.662 1.00 34.25 H new ATOM 0 HB3 LEU A 11 -3.775 -6.935 -8.177 1.00 34.25 H new ATOM 0 HG LEU A 11 -4.616 -4.685 -7.458 1.00 64.43 H new ATOM 0 HD11 LEU A 11 -6.714 -5.555 -6.418 1.00 3.13 H new ATOM 0 HD12 LEU A 11 -6.191 -6.473 -7.850 1.00 3.13 H new ATOM 0 HD13 LEU A 11 -5.917 -7.133 -6.220 1.00 3.13 H new ATOM 0 HD21 LEU A 11 -5.199 -4.389 -5.039 1.00 74.42 H new ATOM 0 HD22 LEU A 11 -4.194 -5.809 -4.663 1.00 74.42 H new ATOM 0 HD23 LEU A 11 -3.449 -4.350 -5.358 1.00 74.42 H new ATOM 158 N ARG A 12 -4.107 -9.439 -6.511 1.00 71.11 N ATOM 159 CA ARG A 12 -5.036 -10.449 -6.029 1.00 4.42 C ATOM 160 C ARG A 12 -4.514 -11.190 -4.794 1.00 44.23 C ATOM 161 O ARG A 12 -5.308 -11.573 -3.936 1.00 3.44 O ATOM 162 CB ARG A 12 -5.350 -11.409 -7.190 1.00 10.34 C ATOM 163 CG ARG A 12 -6.731 -12.052 -7.050 1.00 55.22 C ATOM 164 CD ARG A 12 -7.166 -12.765 -8.340 1.00 34.04 C ATOM 165 NE ARG A 12 -8.622 -12.643 -8.521 1.00 52.24 N ATOM 166 CZ ARG A 12 -9.276 -12.606 -9.686 1.00 72.21 C ATOM 167 NH1 ARG A 12 -8.736 -13.126 -10.783 1.00 51.55 N ATOM 168 NH2 ARG A 12 -10.469 -12.025 -9.736 1.00 2.10 N ATOM 0 H ARG A 12 -3.754 -9.606 -7.453 1.00 71.11 H new ATOM 0 HA ARG A 12 -5.953 -9.961 -5.698 1.00 4.42 H new ATOM 0 HB2 ARG A 12 -5.298 -10.865 -8.133 1.00 10.34 H new ATOM 0 HB3 ARG A 12 -4.590 -12.189 -7.230 1.00 10.34 H new ATOM 0 HG2 ARG A 12 -6.717 -12.767 -6.227 1.00 55.22 H new ATOM 0 HG3 ARG A 12 -7.463 -11.286 -6.794 1.00 55.22 H new ATOM 0 HD2 ARG A 12 -6.648 -12.332 -9.196 1.00 34.04 H new ATOM 0 HD3 ARG A 12 -6.884 -13.817 -8.296 1.00 34.04 H new ATOM 0 HE ARG A 12 -9.187 -12.581 -7.674 1.00 52.24 H new ATOM 0 HH11 ARG A 12 -7.813 -13.559 -10.741 1.00 51.55 H new ATOM 0 HH12 ARG A 12 -9.244 -13.092 -11.667 1.00 51.55 H new ATOM 0 HH21 ARG A 12 -10.873 -11.616 -8.893 1.00 2.10 H new ATOM 0 HH22 ARG A 12 -10.982 -11.988 -10.617 1.00 2.10 H new ATOM 182 N GLU A 13 -3.199 -11.389 -4.677 1.00 52.32 N ATOM 183 CA GLU A 13 -2.609 -12.058 -3.523 1.00 13.51 C ATOM 184 C GLU A 13 -2.509 -11.118 -2.323 1.00 52.23 C ATOM 185 O GLU A 13 -2.557 -11.584 -1.186 1.00 15.10 O ATOM 186 CB GLU A 13 -1.240 -12.667 -3.856 1.00 11.04 C ATOM 187 CG GLU A 13 -1.213 -13.708 -4.981 1.00 75.34 C ATOM 188 CD GLU A 13 -2.537 -14.434 -5.189 1.00 71.24 C ATOM 189 OE1 GLU A 13 -3.040 -15.072 -4.237 1.00 43.31 O ATOM 190 OE2 GLU A 13 -3.105 -14.319 -6.299 1.00 42.33 O ATOM 0 H GLU A 13 -2.519 -11.092 -5.377 1.00 52.32 H new ATOM 0 HA GLU A 13 -3.277 -12.876 -3.254 1.00 13.51 H new ATOM 0 HB2 GLU A 13 -0.562 -11.857 -4.124 1.00 11.04 H new ATOM 0 HB3 GLU A 13 -0.843 -13.130 -2.953 1.00 11.04 H new ATOM 0 HG2 GLU A 13 -0.931 -13.215 -5.911 1.00 75.34 H new ATOM 0 HG3 GLU A 13 -0.438 -14.443 -4.763 1.00 75.34 H new ATOM 197 N MET A 14 -2.387 -9.807 -2.548 1.00 74.42 N ATOM 198 CA MET A 14 -2.437 -8.834 -1.468 1.00 23.31 C ATOM 199 C MET A 14 -3.872 -8.671 -0.973 1.00 13.54 C ATOM 200 O MET A 14 -4.091 -8.658 0.233 1.00 60.15 O ATOM 201 CB MET A 14 -1.901 -7.469 -1.902 1.00 61.22 C ATOM 202 CG MET A 14 -0.501 -7.470 -2.513 1.00 70.31 C ATOM 203 SD MET A 14 0.013 -5.828 -3.049 1.00 3.11 S ATOM 204 CE MET A 14 0.407 -5.089 -1.444 1.00 42.01 C ATOM 0 H MET A 14 -2.253 -9.400 -3.474 1.00 74.42 H new ATOM 0 HA MET A 14 -1.803 -9.211 -0.666 1.00 23.31 H new ATOM 0 HB2 MET A 14 -2.593 -7.041 -2.627 1.00 61.22 H new ATOM 0 HB3 MET A 14 -1.899 -6.808 -1.035 1.00 61.22 H new ATOM 0 HG2 MET A 14 0.212 -7.851 -1.782 1.00 70.31 H new ATOM 0 HG3 MET A 14 -0.479 -8.151 -3.364 1.00 70.31 H new ATOM 0 HE1 MET A 14 0.828 -4.095 -1.595 1.00 42.01 H new ATOM 0 HE2 MET A 14 -0.501 -5.011 -0.846 1.00 42.01 H new ATOM 0 HE3 MET A 14 1.131 -5.715 -0.923 1.00 42.01 H new ATOM 214 N LEU A 15 -4.839 -8.534 -1.887 1.00 53.43 N ATOM 215 CA LEU A 15 -6.225 -8.193 -1.576 1.00 43.34 C ATOM 216 C LEU A 15 -6.843 -9.258 -0.669 1.00 62.22 C ATOM 217 O LEU A 15 -7.366 -8.932 0.391 1.00 54.11 O ATOM 218 CB LEU A 15 -7.029 -8.029 -2.882 1.00 3.44 C ATOM 219 CG LEU A 15 -8.398 -7.351 -2.648 1.00 41.11 C ATOM 220 CD1 LEU A 15 -8.348 -5.865 -3.039 1.00 21.32 C ATOM 221 CD2 LEU A 15 -9.495 -8.021 -3.483 1.00 4.42 C ATOM 0 H LEU A 15 -4.672 -8.661 -2.885 1.00 53.43 H new ATOM 0 HA LEU A 15 -6.252 -7.245 -1.039 1.00 43.34 H new ATOM 0 HB2 LEU A 15 -6.450 -7.437 -3.591 1.00 3.44 H new ATOM 0 HB3 LEU A 15 -7.184 -9.008 -3.336 1.00 3.44 H new ATOM 0 HG LEU A 15 -8.624 -7.452 -1.587 1.00 41.11 H new ATOM 0 HD11 LEU A 15 -9.323 -5.410 -2.865 1.00 21.32 H new ATOM 0 HD12 LEU A 15 -7.597 -5.355 -2.436 1.00 21.32 H new ATOM 0 HD13 LEU A 15 -8.088 -5.775 -4.094 1.00 21.32 H new ATOM 0 HD21 LEU A 15 -10.447 -7.524 -3.299 1.00 4.42 H new ATOM 0 HD22 LEU A 15 -9.245 -7.945 -4.541 1.00 4.42 H new ATOM 0 HD23 LEU A 15 -9.574 -9.072 -3.204 1.00 4.42 H new ATOM 233 N ALA A 16 -6.765 -10.530 -1.072 1.00 23.13 N ATOM 234 CA ALA A 16 -7.299 -11.638 -0.287 1.00 24.22 C ATOM 235 C ALA A 16 -6.548 -11.809 1.035 1.00 24.45 C ATOM 236 O ALA A 16 -7.149 -12.186 2.037 1.00 73.30 O ATOM 237 CB ALA A 16 -7.206 -12.920 -1.112 1.00 41.14 C ATOM 0 H ALA A 16 -6.331 -10.816 -1.949 1.00 23.13 H new ATOM 0 HA ALA A 16 -8.339 -11.421 -0.044 1.00 24.22 H new ATOM 0 HB1 ALA A 16 -7.603 -13.754 -0.534 1.00 41.14 H new ATOM 0 HB2 ALA A 16 -7.785 -12.806 -2.028 1.00 41.14 H new ATOM 0 HB3 ALA A 16 -6.164 -13.116 -1.363 1.00 41.14 H new ATOM 243 N HIS A 17 -5.245 -11.518 1.065 1.00 51.31 N ATOM 244 CA HIS A 17 -4.491 -11.565 2.306 1.00 51.04 C ATOM 245 C HIS A 17 -4.927 -10.448 3.248 1.00 42.04 C ATOM 246 O HIS A 17 -5.015 -10.666 4.451 1.00 42.52 O ATOM 247 CB HIS A 17 -3.002 -11.472 2.004 1.00 43.33 C ATOM 248 CG HIS A 17 -2.152 -11.555 3.239 1.00 33.44 C ATOM 249 ND1 HIS A 17 -1.936 -12.675 4.009 1.00 70.54 N ATOM 250 CD2 HIS A 17 -1.454 -10.521 3.793 1.00 11.22 C ATOM 251 CE1 HIS A 17 -1.079 -12.331 4.983 1.00 65.10 C ATOM 252 NE2 HIS A 17 -0.751 -11.028 4.889 1.00 31.20 N ATOM 0 H HIS A 17 -4.699 -11.250 0.246 1.00 51.31 H new ATOM 0 HA HIS A 17 -4.690 -12.513 2.805 1.00 51.04 H new ATOM 0 HB2 HIS A 17 -2.723 -12.275 1.322 1.00 43.33 H new ATOM 0 HB3 HIS A 17 -2.798 -10.532 1.490 1.00 43.33 H new ATOM 0 HD2 HIS A 17 -1.446 -9.498 3.447 1.00 11.22 H new ATOM 0 HE1 HIS A 17 -0.704 -13.006 5.738 1.00 65.10 H new ATOM 0 HE2 HIS A 17 -0.115 -10.513 5.498 1.00 31.20 H new ATOM 260 N ALA A 18 -5.208 -9.253 2.733 1.00 11.50 N ATOM 261 CA ALA A 18 -5.714 -8.144 3.524 1.00 34.00 C ATOM 262 C ALA A 18 -7.124 -8.459 4.029 1.00 60.42 C ATOM 263 O ALA A 18 -7.447 -8.081 5.148 1.00 41.24 O ATOM 264 CB ALA A 18 -5.686 -6.852 2.704 1.00 60.23 C ATOM 0 H ALA A 18 -5.088 -9.030 1.745 1.00 11.50 H new ATOM 0 HA ALA A 18 -5.072 -7.999 4.393 1.00 34.00 H new ATOM 0 HB1 ALA A 18 -6.068 -6.029 3.308 1.00 60.23 H new ATOM 0 HB2 ALA A 18 -4.662 -6.635 2.401 1.00 60.23 H new ATOM 0 HB3 ALA A 18 -6.309 -6.970 1.817 1.00 60.23 H new ATOM 270 N GLU A 19 -7.944 -9.192 3.268 1.00 25.22 N ATOM 271 CA GLU A 19 -9.220 -9.710 3.746 1.00 1.10 C ATOM 272 C GLU A 19 -9.012 -10.717 4.886 1.00 45.12 C ATOM 273 O GLU A 19 -9.767 -10.702 5.857 1.00 50.53 O ATOM 274 CB GLU A 19 -10.011 -10.347 2.589 1.00 63.24 C ATOM 275 CG GLU A 19 -10.769 -9.313 1.748 1.00 33.25 C ATOM 276 CD GLU A 19 -11.698 -9.909 0.684 1.00 44.14 C ATOM 277 OE1 GLU A 19 -11.507 -11.067 0.255 1.00 65.33 O ATOM 278 OE2 GLU A 19 -12.581 -9.182 0.173 1.00 51.12 O ATOM 0 H GLU A 19 -7.736 -9.441 2.301 1.00 25.22 H new ATOM 0 HA GLU A 19 -9.801 -8.876 4.139 1.00 1.10 H new ATOM 0 HB2 GLU A 19 -9.325 -10.899 1.946 1.00 63.24 H new ATOM 0 HB3 GLU A 19 -10.720 -11.070 2.994 1.00 63.24 H new ATOM 0 HG2 GLU A 19 -11.359 -8.684 2.415 1.00 33.25 H new ATOM 0 HG3 GLU A 19 -10.045 -8.664 1.256 1.00 33.25 H new ATOM 285 N GLU A 20 -7.998 -11.579 4.794 1.00 5.32 N ATOM 286 CA GLU A 20 -7.717 -12.606 5.795 1.00 2.52 C ATOM 287 C GLU A 20 -7.083 -12.018 7.065 1.00 51.34 C ATOM 288 O GLU A 20 -7.328 -12.490 8.176 1.00 40.43 O ATOM 289 CB GLU A 20 -6.768 -13.639 5.167 1.00 73.33 C ATOM 290 CG GLU A 20 -6.479 -14.839 6.075 1.00 20.31 C ATOM 291 CD GLU A 20 -7.701 -15.738 6.240 1.00 15.12 C ATOM 292 OE1 GLU A 20 -8.634 -15.386 7.004 1.00 42.44 O ATOM 293 OE2 GLU A 20 -7.698 -16.798 5.576 1.00 62.32 O ATOM 0 H GLU A 20 -7.342 -11.583 4.013 1.00 5.32 H new ATOM 0 HA GLU A 20 -8.657 -13.070 6.094 1.00 2.52 H new ATOM 0 HB2 GLU A 20 -7.201 -13.997 4.233 1.00 73.33 H new ATOM 0 HB3 GLU A 20 -5.827 -13.150 4.915 1.00 73.33 H new ATOM 0 HG2 GLU A 20 -5.656 -15.419 5.658 1.00 20.31 H new ATOM 0 HG3 GLU A 20 -6.155 -14.484 7.053 1.00 20.31 H new ATOM 300 N THR A 21 -6.230 -11.005 6.930 1.00 51.13 N ATOM 301 CA THR A 21 -5.463 -10.441 8.041 1.00 23.34 C ATOM 302 C THR A 21 -6.071 -9.143 8.565 1.00 44.43 C ATOM 303 O THR A 21 -5.624 -8.645 9.596 1.00 62.54 O ATOM 304 CB THR A 21 -3.989 -10.260 7.644 1.00 74.14 C ATOM 305 OG1 THR A 21 -3.849 -9.454 6.490 1.00 20.13 O ATOM 306 CG2 THR A 21 -3.302 -11.603 7.393 1.00 73.33 C ATOM 0 H THR A 21 -6.049 -10.547 6.037 1.00 51.13 H new ATOM 0 HA THR A 21 -5.507 -11.153 8.865 1.00 23.34 H new ATOM 0 HB THR A 21 -3.509 -9.762 8.487 1.00 74.14 H new ATOM 0 HG1 THR A 21 -3.978 -10.004 5.689 1.00 20.13 H new ATOM 0 HG21 THR A 21 -2.262 -11.433 7.115 1.00 73.33 H new ATOM 0 HG22 THR A 21 -3.341 -12.207 8.300 1.00 73.33 H new ATOM 0 HG23 THR A 21 -3.813 -12.128 6.585 1.00 73.33 H new ATOM 314 N ARG A 22 -7.086 -8.599 7.883 1.00 70.44 N ATOM 315 CA ARG A 22 -7.728 -7.318 8.174 1.00 72.44 C ATOM 316 C ARG A 22 -6.703 -6.190 8.305 1.00 34.21 C ATOM 317 O ARG A 22 -6.901 -5.233 9.055 1.00 62.41 O ATOM 318 CB ARG A 22 -8.711 -7.456 9.350 1.00 34.41 C ATOM 319 CG ARG A 22 -9.995 -8.176 8.906 1.00 25.02 C ATOM 320 CD ARG A 22 -9.924 -9.709 8.814 1.00 21.03 C ATOM 321 NE ARG A 22 -10.119 -10.354 10.121 1.00 32.51 N ATOM 322 CZ ARG A 22 -11.300 -10.474 10.739 1.00 63.35 C ATOM 323 NH1 ARG A 22 -12.412 -10.045 10.147 1.00 23.05 N ATOM 324 NH2 ARG A 22 -11.362 -11.012 11.948 1.00 52.12 N ATOM 0 H ARG A 22 -7.499 -9.065 7.075 1.00 70.44 H new ATOM 0 HA ARG A 22 -8.342 -7.020 7.324 1.00 72.44 H new ATOM 0 HB2 ARG A 22 -8.239 -8.011 10.161 1.00 34.41 H new ATOM 0 HB3 ARG A 22 -8.959 -6.469 9.741 1.00 34.41 H new ATOM 0 HG2 ARG A 22 -10.792 -7.912 9.601 1.00 25.02 H new ATOM 0 HG3 ARG A 22 -10.283 -7.788 7.929 1.00 25.02 H new ATOM 0 HD2 ARG A 22 -10.684 -10.065 8.118 1.00 21.03 H new ATOM 0 HD3 ARG A 22 -8.956 -10.002 8.407 1.00 21.03 H new ATOM 0 HE ARG A 22 -9.297 -10.736 10.589 1.00 32.51 H new ATOM 0 HH11 ARG A 22 -12.366 -9.623 9.219 1.00 23.05 H new ATOM 0 HH12 ARG A 22 -13.310 -10.138 10.621 1.00 23.05 H new ATOM 0 HH21 ARG A 22 -10.510 -11.334 12.407 1.00 52.12 H new ATOM 0 HH22 ARG A 22 -12.262 -11.104 12.420 1.00 52.12 H new ATOM 338 N LYS A 23 -5.597 -6.302 7.569 1.00 63.30 N ATOM 339 CA LYS A 23 -4.578 -5.271 7.526 1.00 14.01 C ATOM 340 C LYS A 23 -5.118 -4.069 6.784 1.00 21.33 C ATOM 341 O LYS A 23 -5.907 -4.200 5.846 1.00 21.34 O ATOM 342 CB LYS A 23 -3.295 -5.809 6.886 1.00 12.33 C ATOM 343 CG LYS A 23 -2.595 -6.700 7.911 1.00 22.35 C ATOM 344 CD LYS A 23 -1.297 -7.315 7.402 1.00 54.21 C ATOM 345 CE LYS A 23 -0.775 -8.163 8.557 1.00 2.02 C ATOM 346 NZ LYS A 23 0.679 -8.369 8.503 1.00 35.44 N ATOM 0 H LYS A 23 -5.389 -7.114 6.988 1.00 63.30 H new ATOM 0 HA LYS A 23 -4.322 -4.963 8.540 1.00 14.01 H new ATOM 0 HB2 LYS A 23 -3.527 -6.375 5.984 1.00 12.33 H new ATOM 0 HB3 LYS A 23 -2.644 -4.987 6.588 1.00 12.33 H new ATOM 0 HG2 LYS A 23 -2.383 -6.113 8.805 1.00 22.35 H new ATOM 0 HG3 LYS A 23 -3.274 -7.500 8.208 1.00 22.35 H new ATOM 0 HD2 LYS A 23 -1.471 -7.923 6.514 1.00 54.21 H new ATOM 0 HD3 LYS A 23 -0.579 -6.544 7.124 1.00 54.21 H new ATOM 0 HE2 LYS A 23 -1.034 -7.682 9.500 1.00 2.02 H new ATOM 0 HE3 LYS A 23 -1.275 -9.132 8.545 1.00 2.02 H new ATOM 0 HZ1 LYS A 23 0.977 -8.951 9.311 1.00 35.44 H new ATOM 0 HZ2 LYS A 23 0.928 -8.853 7.617 1.00 35.44 H new ATOM 0 HZ3 LYS A 23 1.162 -7.449 8.543 1.00 35.44 H new ATOM 360 N LEU A 24 -4.642 -2.902 7.192 1.00 42.20 N ATOM 361 CA LEU A 24 -4.873 -1.655 6.497 1.00 34.31 C ATOM 362 C LEU A 24 -4.124 -1.710 5.169 1.00 63.22 C ATOM 363 O LEU A 24 -2.908 -1.881 5.135 1.00 60.41 O ATOM 364 CB LEU A 24 -4.410 -0.524 7.414 1.00 25.42 C ATOM 365 CG LEU A 24 -4.302 0.881 6.799 1.00 14.20 C ATOM 366 CD1 LEU A 24 -5.447 1.377 5.915 1.00 31.25 C ATOM 367 CD2 LEU A 24 -4.137 1.906 7.921 1.00 53.13 C ATOM 0 H LEU A 24 -4.074 -2.799 8.033 1.00 42.20 H new ATOM 0 HA LEU A 24 -5.924 -1.481 6.265 1.00 34.31 H new ATOM 0 HB2 LEU A 24 -5.097 -0.471 8.258 1.00 25.42 H new ATOM 0 HB3 LEU A 24 -3.433 -0.793 7.815 1.00 25.42 H new ATOM 0 HG LEU A 24 -3.447 0.783 6.130 1.00 14.20 H new ATOM 0 HD11 LEU A 24 -5.222 2.382 5.558 1.00 31.25 H new ATOM 0 HD12 LEU A 24 -5.565 0.708 5.063 1.00 31.25 H new ATOM 0 HD13 LEU A 24 -6.371 1.395 6.493 1.00 31.25 H new ATOM 0 HD21 LEU A 24 -4.060 2.905 7.492 1.00 53.13 H new ATOM 0 HD22 LEU A 24 -5.001 1.861 8.584 1.00 53.13 H new ATOM 0 HD23 LEU A 24 -3.233 1.683 8.487 1.00 53.13 H new ATOM 379 N MET A 25 -4.830 -1.546 4.059 1.00 32.32 N ATOM 380 CA MET A 25 -4.257 -1.533 2.725 1.00 30.52 C ATOM 381 C MET A 25 -4.373 -0.103 2.173 1.00 51.24 C ATOM 382 O MET A 25 -5.357 0.247 1.525 1.00 52.32 O ATOM 383 CB MET A 25 -4.920 -2.675 1.935 1.00 31.14 C ATOM 384 CG MET A 25 -4.606 -2.747 0.442 1.00 43.50 C ATOM 385 SD MET A 25 -5.231 -4.277 -0.307 1.00 55.10 S ATOM 386 CE MET A 25 -4.489 -4.155 -1.948 1.00 32.34 C ATOM 0 H MET A 25 -5.842 -1.415 4.064 1.00 32.32 H new ATOM 0 HA MET A 25 -3.189 -1.745 2.670 1.00 30.52 H new ATOM 0 HB2 MET A 25 -4.625 -3.620 2.391 1.00 31.14 H new ATOM 0 HB3 MET A 25 -6.000 -2.588 2.052 1.00 31.14 H new ATOM 0 HG2 MET A 25 -5.048 -1.888 -0.064 1.00 43.50 H new ATOM 0 HG3 MET A 25 -3.528 -2.684 0.294 1.00 43.50 H new ATOM 0 HE1 MET A 25 -4.609 -5.103 -2.473 1.00 32.34 H new ATOM 0 HE2 MET A 25 -4.982 -3.363 -2.512 1.00 32.34 H new ATOM 0 HE3 MET A 25 -3.428 -3.925 -1.851 1.00 32.34 H new ATOM 396 N PRO A 26 -3.428 0.803 2.491 1.00 75.43 N ATOM 397 CA PRO A 26 -3.511 2.209 2.108 1.00 64.13 C ATOM 398 C PRO A 26 -3.222 2.371 0.602 1.00 65.22 C ATOM 399 O PRO A 26 -2.076 2.577 0.194 1.00 43.42 O ATOM 400 CB PRO A 26 -2.535 2.928 3.054 1.00 51.12 C ATOM 401 CG PRO A 26 -1.478 1.877 3.344 1.00 71.13 C ATOM 402 CD PRO A 26 -2.288 0.591 3.372 1.00 71.11 C ATOM 0 HA PRO A 26 -4.502 2.649 2.220 1.00 64.13 H new ATOM 0 HB2 PRO A 26 -2.103 3.813 2.587 1.00 51.12 H new ATOM 0 HB3 PRO A 26 -3.032 3.259 3.966 1.00 51.12 H new ATOM 0 HG2 PRO A 26 -0.707 1.854 2.574 1.00 71.13 H new ATOM 0 HG3 PRO A 26 -0.974 2.060 4.293 1.00 71.13 H new ATOM 0 HD2 PRO A 26 -1.688 -0.253 3.034 1.00 71.11 H new ATOM 0 HD3 PRO A 26 -2.618 0.362 4.385 1.00 71.11 H new ATOM 410 N ILE A 27 -4.268 2.248 -0.215 1.00 32.31 N ATOM 411 CA ILE A 27 -4.289 2.416 -1.669 1.00 73.34 C ATOM 412 C ILE A 27 -4.124 3.908 -1.995 1.00 12.02 C ATOM 413 O ILE A 27 -4.701 4.745 -1.297 1.00 2.55 O ATOM 414 CB ILE A 27 -5.649 1.867 -2.183 1.00 31.34 C ATOM 415 CG1 ILE A 27 -5.689 0.330 -2.023 1.00 75.24 C ATOM 416 CG2 ILE A 27 -5.967 2.244 -3.644 1.00 22.14 C ATOM 417 CD1 ILE A 27 -7.110 -0.240 -2.058 1.00 4.31 C ATOM 0 H ILE A 27 -5.191 2.011 0.149 1.00 32.31 H new ATOM 0 HA ILE A 27 -3.477 1.874 -2.154 1.00 73.34 H new ATOM 0 HB ILE A 27 -6.416 2.340 -1.570 1.00 31.34 H new ATOM 0 HG12 ILE A 27 -5.101 -0.128 -2.818 1.00 75.24 H new ATOM 0 HG13 ILE A 27 -5.217 0.056 -1.079 1.00 75.24 H new ATOM 0 HG21 ILE A 27 -6.932 1.823 -3.926 1.00 22.14 H new ATOM 0 HG22 ILE A 27 -6.002 3.329 -3.740 1.00 22.14 H new ATOM 0 HG23 ILE A 27 -5.192 1.846 -4.299 1.00 22.14 H new ATOM 0 HD11 ILE A 27 -7.071 -1.323 -1.941 1.00 4.31 H new ATOM 0 HD12 ILE A 27 -7.695 0.192 -1.246 1.00 4.31 H new ATOM 0 HD13 ILE A 27 -7.577 0.005 -3.012 1.00 4.31 H new ATOM 429 N CYS A 28 -3.413 4.234 -3.078 1.00 52.00 N ATOM 430 CA CYS A 28 -3.306 5.590 -3.592 1.00 44.41 C ATOM 431 C CYS A 28 -4.569 5.893 -4.399 1.00 33.53 C ATOM 432 O CYS A 28 -4.946 5.109 -5.276 1.00 3.43 O ATOM 433 CB CYS A 28 -2.087 5.730 -4.521 1.00 24.42 C ATOM 434 SG CYS A 28 -0.646 4.775 -3.969 1.00 2.53 S ATOM 0 H CYS A 28 -2.891 3.550 -3.625 1.00 52.00 H new ATOM 0 HA CYS A 28 -3.191 6.281 -2.757 1.00 44.41 H new ATOM 0 HB2 CYS A 28 -2.365 5.407 -5.524 1.00 24.42 H new ATOM 0 HB3 CYS A 28 -1.811 6.782 -4.590 1.00 24.42 H new ATOM 0 HG CYS A 28 -0.633 4.721 -2.670 1.00 2.53 H new ATOM 440 N MET A 29 -5.193 7.049 -4.175 1.00 62.31 N ATOM 441 CA MET A 29 -6.341 7.490 -4.959 1.00 21.53 C ATOM 442 C MET A 29 -5.999 7.668 -6.451 1.00 51.11 C ATOM 443 O MET A 29 -6.911 7.699 -7.268 1.00 25.30 O ATOM 444 CB MET A 29 -6.896 8.786 -4.348 1.00 12.42 C ATOM 445 CG MET A 29 -8.336 9.077 -4.761 1.00 45.43 C ATOM 446 SD MET A 29 -9.073 10.544 -3.983 1.00 41.42 S ATOM 447 CE MET A 29 -9.095 10.045 -2.241 1.00 41.45 C ATOM 0 H MET A 29 -4.915 7.704 -3.445 1.00 62.31 H new ATOM 0 HA MET A 29 -7.106 6.715 -4.920 1.00 21.53 H new ATOM 0 HB2 MET A 29 -6.843 8.719 -3.261 1.00 12.42 H new ATOM 0 HB3 MET A 29 -6.263 9.621 -4.648 1.00 12.42 H new ATOM 0 HG2 MET A 29 -8.370 9.202 -5.843 1.00 45.43 H new ATOM 0 HG3 MET A 29 -8.950 8.209 -4.521 1.00 45.43 H new ATOM 0 HE1 MET A 29 -9.693 10.753 -1.667 1.00 41.45 H new ATOM 0 HE2 MET A 29 -9.529 9.049 -2.153 1.00 41.45 H new ATOM 0 HE3 MET A 29 -8.076 10.032 -1.853 1.00 41.45 H new ATOM 457 N ASP A 30 -4.726 7.806 -6.841 1.00 72.35 N ATOM 458 CA ASP A 30 -4.314 8.045 -8.235 1.00 41.51 C ATOM 459 C ASP A 30 -4.194 6.781 -9.074 1.00 74.13 C ATOM 460 O ASP A 30 -4.275 6.847 -10.306 1.00 4.24 O ATOM 461 CB ASP A 30 -2.960 8.767 -8.262 1.00 42.21 C ATOM 462 CG ASP A 30 -2.582 9.223 -9.670 1.00 61.12 C ATOM 463 OD1 ASP A 30 -3.372 9.968 -10.298 1.00 11.44 O ATOM 464 OD2 ASP A 30 -1.474 8.900 -10.142 1.00 73.14 O ATOM 0 H ASP A 30 -3.941 7.755 -6.191 1.00 72.35 H new ATOM 0 HA ASP A 30 -5.106 8.652 -8.674 1.00 41.51 H new ATOM 0 HB2 ASP A 30 -2.997 9.631 -7.599 1.00 42.21 H new ATOM 0 HB3 ASP A 30 -2.187 8.102 -7.877 1.00 42.21 H new ATOM 469 N VAL A 31 -3.985 5.624 -8.444 1.00 55.41 N ATOM 470 CA VAL A 31 -3.566 4.445 -9.181 1.00 35.54 C ATOM 471 C VAL A 31 -4.828 3.730 -9.657 1.00 41.32 C ATOM 472 O VAL A 31 -5.401 2.885 -8.965 1.00 42.11 O ATOM 473 CB VAL A 31 -2.565 3.607 -8.362 1.00 3.13 C ATOM 474 CG1 VAL A 31 -2.100 2.368 -9.137 1.00 74.45 C ATOM 475 CG2 VAL A 31 -1.306 4.444 -8.061 1.00 61.43 C ATOM 0 H VAL A 31 -4.099 5.485 -7.440 1.00 55.41 H new ATOM 0 HA VAL A 31 -2.993 4.691 -10.075 1.00 35.54 H new ATOM 0 HB VAL A 31 -3.076 3.304 -7.448 1.00 3.13 H new ATOM 0 HG11 VAL A 31 -1.395 1.801 -8.528 1.00 74.45 H new ATOM 0 HG12 VAL A 31 -2.961 1.742 -9.373 1.00 74.45 H new ATOM 0 HG13 VAL A 31 -1.613 2.679 -10.061 1.00 74.45 H new ATOM 0 HG21 VAL A 31 -0.602 3.847 -7.482 1.00 61.43 H new ATOM 0 HG22 VAL A 31 -0.839 4.748 -8.998 1.00 61.43 H new ATOM 0 HG23 VAL A 31 -1.586 5.330 -7.490 1.00 61.43 H new ATOM 485 N ARG A 32 -5.281 4.122 -10.852 1.00 71.13 N ATOM 486 CA ARG A 32 -6.517 3.692 -11.498 1.00 41.22 C ATOM 487 C ARG A 32 -6.676 2.179 -11.466 1.00 61.15 C ATOM 488 O ARG A 32 -7.788 1.726 -11.213 1.00 24.33 O ATOM 489 CB ARG A 32 -6.530 4.190 -12.959 1.00 14.34 C ATOM 490 CG ARG A 32 -7.848 4.795 -13.457 1.00 11.23 C ATOM 491 CD ARG A 32 -8.074 6.233 -12.958 1.00 23.13 C ATOM 492 NE ARG A 32 -8.896 6.294 -11.748 1.00 30.15 N ATOM 493 CZ ARG A 32 -10.229 6.230 -11.673 1.00 42.03 C ATOM 494 NH1 ARG A 32 -10.980 6.040 -12.750 1.00 0.22 N ATOM 495 NH2 ARG A 32 -10.798 6.388 -10.488 1.00 52.11 N ATOM 0 H ARG A 32 -4.761 4.787 -11.425 1.00 71.13 H new ATOM 0 HA ARG A 32 -7.354 4.122 -10.948 1.00 41.22 H new ATOM 0 HB2 ARG A 32 -5.745 4.938 -13.073 1.00 14.34 H new ATOM 0 HB3 ARG A 32 -6.270 3.354 -13.608 1.00 14.34 H new ATOM 0 HG2 ARG A 32 -7.856 4.789 -14.547 1.00 11.23 H new ATOM 0 HG3 ARG A 32 -8.677 4.168 -13.129 1.00 11.23 H new ATOM 0 HD2 ARG A 32 -7.109 6.699 -12.759 1.00 23.13 H new ATOM 0 HD3 ARG A 32 -8.553 6.815 -13.746 1.00 23.13 H new ATOM 0 HE ARG A 32 -8.396 6.397 -10.865 1.00 30.15 H new ATOM 0 HH11 ARG A 32 -10.542 5.938 -13.666 1.00 0.22 H new ATOM 0 HH12 ARG A 32 -11.995 5.995 -12.662 1.00 0.22 H new ATOM 0 HH21 ARG A 32 -10.221 6.553 -9.663 1.00 52.11 H new ATOM 0 HH22 ARG A 32 -11.813 6.344 -10.400 1.00 52.11 H new ATOM 509 N ALA A 33 -5.607 1.417 -11.710 1.00 1.12 N ATOM 510 CA ALA A 33 -5.638 -0.037 -11.793 1.00 43.45 C ATOM 511 C ALA A 33 -6.078 -0.662 -10.468 1.00 45.54 C ATOM 512 O ALA A 33 -6.986 -1.500 -10.430 1.00 21.23 O ATOM 513 CB ALA A 33 -4.249 -0.545 -12.205 1.00 14.31 C ATOM 0 H ALA A 33 -4.676 1.807 -11.858 1.00 1.12 H new ATOM 0 HA ALA A 33 -6.370 -0.334 -12.544 1.00 43.45 H new ATOM 0 HB1 ALA A 33 -4.264 -1.633 -12.269 1.00 14.31 H new ATOM 0 HB2 ALA A 33 -3.982 -0.128 -13.176 1.00 14.31 H new ATOM 0 HB3 ALA A 33 -3.513 -0.235 -11.463 1.00 14.31 H new ATOM 519 N ILE A 34 -5.426 -0.252 -9.378 1.00 63.20 N ATOM 520 CA ILE A 34 -5.740 -0.730 -8.039 1.00 52.30 C ATOM 521 C ILE A 34 -7.140 -0.216 -7.700 1.00 73.30 C ATOM 522 O ILE A 34 -8.041 -1.013 -7.432 1.00 31.42 O ATOM 523 CB ILE A 34 -4.660 -0.281 -7.023 1.00 65.42 C ATOM 524 CG1 ILE A 34 -3.221 -0.691 -7.428 1.00 71.00 C ATOM 525 CG2 ILE A 34 -4.986 -0.822 -5.619 1.00 23.31 C ATOM 526 CD1 ILE A 34 -2.964 -2.194 -7.577 1.00 22.02 C ATOM 0 H ILE A 34 -4.663 0.424 -9.404 1.00 63.20 H new ATOM 0 HA ILE A 34 -5.737 -1.819 -7.991 1.00 52.30 H new ATOM 0 HB ILE A 34 -4.683 0.809 -7.017 1.00 65.42 H new ATOM 0 HG12 ILE A 34 -2.980 -0.206 -8.374 1.00 71.00 H new ATOM 0 HG13 ILE A 34 -2.530 -0.297 -6.683 1.00 71.00 H new ATOM 0 HG21 ILE A 34 -4.218 -0.498 -4.917 1.00 23.31 H new ATOM 0 HG22 ILE A 34 -5.955 -0.441 -5.298 1.00 23.31 H new ATOM 0 HG23 ILE A 34 -5.016 -1.911 -5.647 1.00 23.31 H new ATOM 0 HD11 ILE A 34 -1.925 -2.359 -7.862 1.00 22.02 H new ATOM 0 HD12 ILE A 34 -3.163 -2.693 -6.629 1.00 22.02 H new ATOM 0 HD13 ILE A 34 -3.620 -2.601 -8.346 1.00 22.02 H new ATOM 538 N MET A 35 -7.334 1.106 -7.781 1.00 62.13 N ATOM 539 CA MET A 35 -8.583 1.793 -7.483 1.00 41.55 C ATOM 540 C MET A 35 -9.777 1.095 -8.149 1.00 53.14 C ATOM 541 O MET A 35 -10.771 0.825 -7.474 1.00 4.54 O ATOM 542 CB MET A 35 -8.448 3.265 -7.920 1.00 55.32 C ATOM 543 CG MET A 35 -9.708 4.101 -7.650 1.00 15.02 C ATOM 544 SD MET A 35 -9.535 5.488 -6.496 1.00 52.32 S ATOM 545 CE MET A 35 -8.930 4.660 -5.003 1.00 30.30 C ATOM 0 H MET A 35 -6.593 1.745 -8.068 1.00 62.13 H new ATOM 0 HA MET A 35 -8.778 1.760 -6.411 1.00 41.55 H new ATOM 0 HB2 MET A 35 -7.604 3.715 -7.398 1.00 55.32 H new ATOM 0 HB3 MET A 35 -8.219 3.300 -8.985 1.00 55.32 H new ATOM 0 HG2 MET A 35 -10.066 4.493 -8.602 1.00 15.02 H new ATOM 0 HG3 MET A 35 -10.482 3.435 -7.268 1.00 15.02 H new ATOM 0 HE1 MET A 35 -8.949 5.358 -4.166 1.00 30.30 H new ATOM 0 HE2 MET A 35 -9.568 3.805 -4.777 1.00 30.30 H new ATOM 0 HE3 MET A 35 -7.908 4.317 -5.166 1.00 30.30 H new ATOM 555 N ALA A 36 -9.690 0.795 -9.450 1.00 5.11 N ATOM 556 CA ALA A 36 -10.747 0.176 -10.242 1.00 32.23 C ATOM 557 C ALA A 36 -11.164 -1.144 -9.620 1.00 4.13 C ATOM 558 O ALA A 36 -12.354 -1.406 -9.486 1.00 32.24 O ATOM 559 CB ALA A 36 -10.282 -0.096 -11.683 1.00 54.53 C ATOM 0 H ALA A 36 -8.849 0.985 -9.995 1.00 5.11 H new ATOM 0 HA ALA A 36 -11.587 0.871 -10.260 1.00 32.23 H new ATOM 0 HB1 ALA A 36 -11.093 -0.557 -12.246 1.00 54.53 H new ATOM 0 HB2 ALA A 36 -9.999 0.844 -12.158 1.00 54.53 H new ATOM 0 HB3 ALA A 36 -9.423 -0.767 -11.668 1.00 54.53 H new ATOM 565 N THR A 37 -10.190 -1.976 -9.260 1.00 62.14 N ATOM 566 CA THR A 37 -10.447 -3.337 -8.838 1.00 43.42 C ATOM 567 C THR A 37 -11.305 -3.365 -7.578 1.00 53.10 C ATOM 568 O THR A 37 -12.280 -4.120 -7.527 1.00 1.14 O ATOM 569 CB THR A 37 -9.106 -4.069 -8.710 1.00 43.12 C ATOM 570 OG1 THR A 37 -8.477 -4.061 -9.987 1.00 71.00 O ATOM 571 CG2 THR A 37 -9.321 -5.512 -8.249 1.00 13.05 C ATOM 0 H THR A 37 -9.203 -1.719 -9.255 1.00 62.14 H new ATOM 0 HA THR A 37 -11.036 -3.872 -9.583 1.00 43.42 H new ATOM 0 HB THR A 37 -8.482 -3.568 -7.970 1.00 43.12 H new ATOM 0 HG1 THR A 37 -7.998 -3.215 -10.110 1.00 71.00 H new ATOM 0 HG21 THR A 37 -8.357 -6.014 -8.164 1.00 13.05 H new ATOM 0 HG22 THR A 37 -9.818 -5.514 -7.279 1.00 13.05 H new ATOM 0 HG23 THR A 37 -9.941 -6.037 -8.975 1.00 13.05 H new ATOM 579 N ILE A 38 -11.012 -2.487 -6.618 1.00 15.42 N ATOM 580 CA ILE A 38 -11.793 -2.390 -5.399 1.00 4.21 C ATOM 581 C ILE A 38 -13.211 -1.971 -5.791 1.00 43.41 C ATOM 582 O ILE A 38 -14.162 -2.671 -5.458 1.00 0.12 O ATOM 583 CB ILE A 38 -11.070 -1.472 -4.383 1.00 22.01 C ATOM 584 CG1 ILE A 38 -9.867 -2.212 -3.748 1.00 1.40 C ATOM 585 CG2 ILE A 38 -11.968 -0.949 -3.251 1.00 75.43 C ATOM 586 CD1 ILE A 38 -8.601 -2.185 -4.606 1.00 22.13 C ATOM 0 H ILE A 38 -10.232 -1.831 -6.669 1.00 15.42 H new ATOM 0 HA ILE A 38 -11.886 -3.341 -4.875 1.00 4.21 H new ATOM 0 HB ILE A 38 -10.745 -0.608 -4.963 1.00 22.01 H new ATOM 0 HG12 ILE A 38 -9.647 -1.764 -2.779 1.00 1.40 H new ATOM 0 HG13 ILE A 38 -10.147 -3.249 -3.563 1.00 1.40 H new ATOM 0 HG21 ILE A 38 -11.382 -0.315 -2.585 1.00 75.43 H new ATOM 0 HG22 ILE A 38 -12.788 -0.370 -3.675 1.00 75.43 H new ATOM 0 HG23 ILE A 38 -12.371 -1.791 -2.688 1.00 75.43 H new ATOM 0 HD11 ILE A 38 -7.803 -2.723 -4.094 1.00 22.13 H new ATOM 0 HD12 ILE A 38 -8.802 -2.660 -5.566 1.00 22.13 H new ATOM 0 HD13 ILE A 38 -8.294 -1.152 -4.770 1.00 22.13 H new ATOM 598 N GLN A 39 -13.358 -0.896 -6.568 1.00 0.02 N ATOM 599 CA GLN A 39 -14.661 -0.318 -6.898 1.00 72.03 C ATOM 600 C GLN A 39 -15.509 -1.265 -7.763 1.00 51.51 C ATOM 601 O GLN A 39 -16.739 -1.149 -7.807 1.00 3.25 O ATOM 602 CB GLN A 39 -14.448 1.038 -7.594 1.00 4.02 C ATOM 603 CG GLN A 39 -13.682 2.119 -6.795 1.00 60.33 C ATOM 604 CD GLN A 39 -13.291 1.753 -5.384 1.00 44.51 C ATOM 605 OE1 GLN A 39 -14.146 1.517 -4.553 1.00 1.33 O ATOM 606 NE2 GLN A 39 -12.009 1.740 -5.067 1.00 34.00 N ATOM 0 H GLN A 39 -12.572 -0.400 -6.988 1.00 0.02 H new ATOM 0 HA GLN A 39 -15.220 -0.166 -5.974 1.00 72.03 H new ATOM 0 HB2 GLN A 39 -13.912 0.861 -8.526 1.00 4.02 H new ATOM 0 HB3 GLN A 39 -15.425 1.441 -7.860 1.00 4.02 H new ATOM 0 HG2 GLN A 39 -12.777 2.375 -7.346 1.00 60.33 H new ATOM 0 HG3 GLN A 39 -14.297 3.018 -6.758 1.00 60.33 H new ATOM 0 HE21 GLN A 39 -11.306 1.941 -5.778 1.00 34.00 H new ATOM 0 HE22 GLN A 39 -11.722 1.529 -4.111 1.00 34.00 H new ATOM 615 N ARG A 40 -14.859 -2.197 -8.463 1.00 23.40 N ATOM 616 CA ARG A 40 -15.465 -3.271 -9.239 1.00 32.43 C ATOM 617 C ARG A 40 -15.965 -4.373 -8.319 1.00 13.51 C ATOM 618 O ARG A 40 -17.083 -4.854 -8.487 1.00 5.20 O ATOM 619 CB ARG A 40 -14.412 -3.831 -10.217 1.00 3.43 C ATOM 620 CG ARG A 40 -14.318 -2.970 -11.483 1.00 50.13 C ATOM 621 CD ARG A 40 -15.361 -3.471 -12.478 1.00 33.45 C ATOM 622 NE ARG A 40 -15.847 -2.411 -13.374 1.00 71.33 N ATOM 623 CZ ARG A 40 -16.686 -2.608 -14.399 1.00 34.53 C ATOM 624 NH1 ARG A 40 -17.145 -3.817 -14.701 1.00 55.42 N ATOM 625 NH2 ARG A 40 -17.079 -1.579 -15.138 1.00 4.04 N ATOM 0 H ARG A 40 -13.840 -2.220 -8.503 1.00 23.40 H new ATOM 0 HA ARG A 40 -16.317 -2.883 -9.797 1.00 32.43 H new ATOM 0 HB2 ARG A 40 -13.439 -3.868 -9.726 1.00 3.43 H new ATOM 0 HB3 ARG A 40 -14.672 -4.854 -10.488 1.00 3.43 H new ATOM 0 HG2 ARG A 40 -14.494 -1.921 -11.244 1.00 50.13 H new ATOM 0 HG3 ARG A 40 -13.319 -3.035 -11.914 1.00 50.13 H new ATOM 0 HD2 ARG A 40 -14.931 -4.276 -13.074 1.00 33.45 H new ATOM 0 HD3 ARG A 40 -16.204 -3.894 -11.932 1.00 33.45 H new ATOM 0 HE ARG A 40 -15.522 -1.459 -13.203 1.00 71.33 H new ATOM 0 HH11 ARG A 40 -16.859 -4.624 -14.147 1.00 55.42 H new ATOM 0 HH12 ARG A 40 -17.783 -3.938 -15.487 1.00 55.42 H new ATOM 0 HH21 ARG A 40 -16.742 -0.640 -14.925 1.00 4.04 H new ATOM 0 HH22 ARG A 40 -17.718 -1.727 -15.919 1.00 4.04 H new ATOM 639 N LYS A 41 -15.113 -4.850 -7.415 1.00 71.35 N ATOM 640 CA LYS A 41 -15.395 -5.983 -6.545 1.00 11.11 C ATOM 641 C LYS A 41 -16.453 -5.564 -5.525 1.00 41.32 C ATOM 642 O LYS A 41 -17.549 -6.123 -5.504 1.00 22.32 O ATOM 643 CB LYS A 41 -14.046 -6.416 -5.940 1.00 41.42 C ATOM 644 CG LYS A 41 -13.991 -7.775 -5.234 1.00 4.42 C ATOM 645 CD LYS A 41 -14.598 -7.799 -3.824 1.00 53.43 C ATOM 646 CE LYS A 41 -13.813 -8.809 -2.973 1.00 64.32 C ATOM 647 NZ LYS A 41 -14.496 -9.190 -1.722 1.00 14.15 N ATOM 0 H LYS A 41 -14.187 -4.449 -7.266 1.00 71.35 H new ATOM 0 HA LYS A 41 -15.816 -6.845 -7.062 1.00 11.11 H new ATOM 0 HB2 LYS A 41 -13.305 -6.422 -6.740 1.00 41.42 H new ATOM 0 HB3 LYS A 41 -13.737 -5.653 -5.225 1.00 41.42 H new ATOM 0 HG2 LYS A 41 -14.511 -8.509 -5.850 1.00 4.42 H new ATOM 0 HG3 LYS A 41 -12.950 -8.093 -5.171 1.00 4.42 H new ATOM 0 HD2 LYS A 41 -14.551 -6.807 -3.374 1.00 53.43 H new ATOM 0 HD3 LYS A 41 -15.650 -8.079 -3.869 1.00 53.43 H new ATOM 0 HE2 LYS A 41 -13.632 -9.706 -3.565 1.00 64.32 H new ATOM 0 HE3 LYS A 41 -12.839 -8.386 -2.730 1.00 64.32 H new ATOM 0 HZ1 LYS A 41 -13.796 -9.536 -1.036 1.00 14.15 H new ATOM 0 HZ2 LYS A 41 -14.986 -8.362 -1.328 1.00 14.15 H new ATOM 0 HZ3 LYS A 41 -15.188 -9.941 -1.919 1.00 14.15 H new ATOM 661 N TYR A 42 -16.107 -4.591 -4.692 1.00 15.54 N ATOM 662 CA TYR A 42 -16.896 -4.049 -3.601 1.00 63.25 C ATOM 663 C TYR A 42 -17.827 -2.954 -4.143 1.00 54.00 C ATOM 664 O TYR A 42 -17.361 -1.884 -4.526 1.00 12.45 O ATOM 665 CB TYR A 42 -15.919 -3.453 -2.581 1.00 11.12 C ATOM 666 CG TYR A 42 -14.855 -4.383 -2.034 1.00 42.01 C ATOM 667 CD1 TYR A 42 -15.131 -5.306 -1.008 1.00 30.55 C ATOM 668 CD2 TYR A 42 -13.558 -4.299 -2.567 1.00 34.45 C ATOM 669 CE1 TYR A 42 -14.109 -6.159 -0.539 1.00 4.04 C ATOM 670 CE2 TYR A 42 -12.536 -5.132 -2.099 1.00 50.23 C ATOM 671 CZ TYR A 42 -12.806 -6.072 -1.088 1.00 61.33 C ATOM 672 OH TYR A 42 -11.806 -6.913 -0.716 1.00 54.22 O ATOM 0 H TYR A 42 -15.201 -4.129 -4.770 1.00 15.54 H new ATOM 0 HA TYR A 42 -17.506 -4.822 -3.135 1.00 63.25 H new ATOM 0 HB2 TYR A 42 -15.421 -2.601 -3.044 1.00 11.12 H new ATOM 0 HB3 TYR A 42 -16.497 -3.066 -1.742 1.00 11.12 H new ATOM 0 HD1 TYR A 42 -16.121 -5.361 -0.581 1.00 30.55 H new ATOM 0 HD2 TYR A 42 -13.347 -3.583 -3.347 1.00 34.45 H new ATOM 0 HE1 TYR A 42 -14.320 -6.878 0.239 1.00 4.04 H new ATOM 0 HE2 TYR A 42 -11.542 -5.053 -2.513 1.00 50.23 H new ATOM 0 HH TYR A 42 -12.188 -7.768 -0.426 1.00 54.22 H new ATOM 682 N LYS A 43 -19.140 -3.190 -4.205 1.00 31.43 N ATOM 683 CA LYS A 43 -20.064 -2.271 -4.893 1.00 32.04 C ATOM 684 C LYS A 43 -20.487 -1.026 -4.104 1.00 15.14 C ATOM 685 O LYS A 43 -21.235 -0.214 -4.653 1.00 35.11 O ATOM 686 CB LYS A 43 -21.316 -3.029 -5.373 1.00 22.14 C ATOM 687 CG LYS A 43 -20.970 -4.111 -6.404 1.00 21.24 C ATOM 688 CD LYS A 43 -22.195 -4.564 -7.207 1.00 22.34 C ATOM 689 CE LYS A 43 -22.718 -3.474 -8.158 1.00 42.35 C ATOM 690 NZ LYS A 43 -22.657 -3.905 -9.571 1.00 14.13 N ATOM 0 H LYS A 43 -19.591 -4.006 -3.790 1.00 31.43 H new ATOM 0 HA LYS A 43 -19.484 -1.890 -5.734 1.00 32.04 H new ATOM 0 HB2 LYS A 43 -21.812 -3.488 -4.518 1.00 22.14 H new ATOM 0 HB3 LYS A 43 -22.022 -2.323 -5.811 1.00 22.14 H new ATOM 0 HG2 LYS A 43 -20.212 -3.729 -7.087 1.00 21.24 H new ATOM 0 HG3 LYS A 43 -20.535 -4.970 -5.893 1.00 21.24 H new ATOM 0 HD2 LYS A 43 -21.937 -5.452 -7.785 1.00 22.34 H new ATOM 0 HD3 LYS A 43 -22.990 -4.851 -6.518 1.00 22.34 H new ATOM 0 HE2 LYS A 43 -23.747 -3.227 -7.897 1.00 42.35 H new ATOM 0 HE3 LYS A 43 -22.129 -2.566 -8.029 1.00 42.35 H new ATOM 0 HZ1 LYS A 43 -23.018 -3.144 -10.182 1.00 14.13 H new ATOM 0 HZ2 LYS A 43 -21.672 -4.117 -9.827 1.00 14.13 H new ATOM 0 HZ3 LYS A 43 -23.239 -4.757 -9.699 1.00 14.13 H new ATOM 704 N GLY A 44 -20.071 -0.863 -2.846 1.00 23.44 N ATOM 705 CA GLY A 44 -20.641 0.151 -1.959 1.00 1.24 C ATOM 706 C GLY A 44 -19.630 0.981 -1.182 1.00 43.14 C ATOM 707 O GLY A 44 -20.030 1.772 -0.326 1.00 73.51 O ATOM 0 H GLY A 44 -19.336 -1.425 -2.417 1.00 23.44 H new ATOM 0 HA2 GLY A 44 -21.258 0.824 -2.554 1.00 1.24 H new ATOM 0 HA3 GLY A 44 -21.303 -0.343 -1.248 1.00 1.24 H new ATOM 711 N ILE A 45 -18.339 0.796 -1.441 1.00 52.34 N ATOM 712 CA ILE A 45 -17.280 1.588 -0.826 1.00 10.21 C ATOM 713 C ILE A 45 -17.204 2.934 -1.550 1.00 50.42 C ATOM 714 O ILE A 45 -17.415 3.003 -2.764 1.00 42.32 O ATOM 715 CB ILE A 45 -15.963 0.778 -0.802 1.00 74.42 C ATOM 716 CG1 ILE A 45 -14.706 1.607 -0.468 1.00 14.34 C ATOM 717 CG2 ILE A 45 -15.758 -0.100 -2.048 1.00 71.54 C ATOM 718 CD1 ILE A 45 -13.988 2.192 -1.685 1.00 11.41 C ATOM 0 H ILE A 45 -17.996 0.087 -2.089 1.00 52.34 H new ATOM 0 HA ILE A 45 -17.489 1.811 0.220 1.00 10.21 H new ATOM 0 HB ILE A 45 -16.097 0.100 0.041 1.00 74.42 H new ATOM 0 HG12 ILE A 45 -14.991 2.423 0.196 1.00 14.34 H new ATOM 0 HG13 ILE A 45 -14.007 0.977 0.082 1.00 14.34 H new ATOM 0 HG21 ILE A 45 -14.814 -0.639 -1.962 1.00 71.54 H new ATOM 0 HG22 ILE A 45 -16.578 -0.814 -2.129 1.00 71.54 H new ATOM 0 HG23 ILE A 45 -15.736 0.530 -2.937 1.00 71.54 H new ATOM 0 HD11 ILE A 45 -13.117 2.759 -1.356 1.00 11.41 H new ATOM 0 HD12 ILE A 45 -13.668 1.383 -2.342 1.00 11.41 H new ATOM 0 HD13 ILE A 45 -14.667 2.851 -2.226 1.00 11.41 H new ATOM 730 N LYS A 46 -16.900 4.002 -0.811 1.00 2.33 N ATOM 731 CA LYS A 46 -16.818 5.370 -1.314 1.00 3.43 C ATOM 732 C LYS A 46 -15.364 5.828 -1.257 1.00 51.12 C ATOM 733 O LYS A 46 -14.599 5.339 -0.424 1.00 22.14 O ATOM 734 CB LYS A 46 -17.767 6.239 -0.468 1.00 63.22 C ATOM 735 CG LYS A 46 -17.728 7.741 -0.798 1.00 5.12 C ATOM 736 CD LYS A 46 -16.894 8.557 0.208 1.00 14.14 C ATOM 737 CE LYS A 46 -17.696 8.894 1.480 1.00 44.32 C ATOM 738 NZ LYS A 46 -18.732 9.931 1.260 1.00 12.24 N ATOM 0 H LYS A 46 -16.698 3.934 0.186 1.00 2.33 H new ATOM 0 HA LYS A 46 -17.132 5.451 -2.355 1.00 3.43 H new ATOM 0 HB2 LYS A 46 -18.786 5.877 -0.603 1.00 63.22 H new ATOM 0 HB3 LYS A 46 -17.518 6.106 0.585 1.00 63.22 H new ATOM 0 HG2 LYS A 46 -17.316 7.877 -1.798 1.00 5.12 H new ATOM 0 HG3 LYS A 46 -18.746 8.130 -0.817 1.00 5.12 H new ATOM 0 HD2 LYS A 46 -16.001 7.994 0.480 1.00 14.14 H new ATOM 0 HD3 LYS A 46 -16.557 9.480 -0.264 1.00 14.14 H new ATOM 0 HE2 LYS A 46 -18.172 7.987 1.852 1.00 44.32 H new ATOM 0 HE3 LYS A 46 -17.009 9.234 2.255 1.00 44.32 H new ATOM 0 HZ1 LYS A 46 -19.143 10.211 2.174 1.00 12.24 H new ATOM 0 HZ2 LYS A 46 -18.301 10.761 0.805 1.00 12.24 H new ATOM 0 HZ3 LYS A 46 -19.480 9.550 0.646 1.00 12.24 H new ATOM 752 N ILE A 47 -14.997 6.794 -2.103 1.00 12.05 N ATOM 753 CA ILE A 47 -13.657 7.353 -2.202 1.00 60.13 C ATOM 754 C ILE A 47 -13.711 8.806 -1.718 1.00 23.10 C ATOM 755 O ILE A 47 -14.411 9.644 -2.294 1.00 32.51 O ATOM 756 CB ILE A 47 -13.113 7.215 -3.646 1.00 51.32 C ATOM 757 CG1 ILE A 47 -13.396 5.843 -4.300 1.00 23.10 C ATOM 758 CG2 ILE A 47 -11.596 7.462 -3.666 1.00 31.02 C ATOM 759 CD1 ILE A 47 -12.684 4.680 -3.610 1.00 61.23 C ATOM 0 H ILE A 47 -15.652 7.220 -2.759 1.00 12.05 H new ATOM 0 HA ILE A 47 -12.959 6.805 -1.569 1.00 60.13 H new ATOM 0 HB ILE A 47 -13.646 7.966 -4.230 1.00 51.32 H new ATOM 0 HG12 ILE A 47 -14.470 5.659 -4.289 1.00 23.10 H new ATOM 0 HG13 ILE A 47 -13.089 5.878 -5.345 1.00 23.10 H new ATOM 0 HG21 ILE A 47 -11.225 7.362 -4.686 1.00 31.02 H new ATOM 0 HG22 ILE A 47 -11.386 8.467 -3.300 1.00 31.02 H new ATOM 0 HG23 ILE A 47 -11.100 6.732 -3.026 1.00 31.02 H new ATOM 0 HD11 ILE A 47 -12.928 3.749 -4.122 1.00 61.23 H new ATOM 0 HD12 ILE A 47 -11.607 4.841 -3.644 1.00 61.23 H new ATOM 0 HD13 ILE A 47 -13.009 4.619 -2.571 1.00 61.23 H new ATOM 771 N GLN A 48 -12.996 9.074 -0.635 1.00 72.13 N ATOM 772 CA GLN A 48 -12.676 10.340 0.000 1.00 64.34 C ATOM 773 C GLN A 48 -11.240 10.199 0.520 1.00 52.21 C ATOM 774 O GLN A 48 -10.625 9.149 0.356 1.00 64.44 O ATOM 775 CB GLN A 48 -13.691 10.648 1.120 1.00 70.03 C ATOM 776 CG GLN A 48 -13.712 9.594 2.239 1.00 72.43 C ATOM 777 CD GLN A 48 -14.233 10.086 3.567 1.00 33.12 C ATOM 778 OE1 GLN A 48 -15.372 9.808 3.950 1.00 70.21 O ATOM 779 NE2 GLN A 48 -13.424 10.778 4.326 1.00 41.11 N ATOM 0 H GLN A 48 -12.573 8.305 -0.115 1.00 72.13 H new ATOM 0 HA GLN A 48 -12.740 11.181 -0.691 1.00 64.34 H new ATOM 0 HB2 GLN A 48 -13.457 11.621 1.553 1.00 70.03 H new ATOM 0 HB3 GLN A 48 -14.688 10.724 0.685 1.00 70.03 H new ATOM 0 HG2 GLN A 48 -14.325 8.753 1.914 1.00 72.43 H new ATOM 0 HG3 GLN A 48 -12.700 9.215 2.380 1.00 72.43 H new ATOM 0 HE21 GLN A 48 -12.484 11.002 3.999 1.00 41.11 H new ATOM 0 HE22 GLN A 48 -13.733 11.094 5.245 1.00 41.11 H new ATOM 788 N GLU A 49 -10.687 11.229 1.147 1.00 71.32 N ATOM 789 CA GLU A 49 -9.309 11.231 1.626 1.00 25.55 C ATOM 790 C GLU A 49 -9.286 10.854 3.105 1.00 2.12 C ATOM 791 O GLU A 49 -8.698 11.563 3.927 1.00 10.14 O ATOM 792 CB GLU A 49 -8.676 12.602 1.375 1.00 13.32 C ATOM 793 CG GLU A 49 -8.658 12.941 -0.109 1.00 33.45 C ATOM 794 CD GLU A 49 -8.075 14.330 -0.323 1.00 25.31 C ATOM 795 OE1 GLU A 49 -6.838 14.485 -0.215 1.00 31.13 O ATOM 796 OE2 GLU A 49 -8.844 15.288 -0.558 1.00 15.45 O ATOM 0 H GLU A 49 -11.187 12.097 1.340 1.00 71.32 H new ATOM 0 HA GLU A 49 -8.720 10.492 1.082 1.00 25.55 H new ATOM 0 HB2 GLU A 49 -9.232 13.366 1.918 1.00 13.32 H new ATOM 0 HB3 GLU A 49 -7.658 12.611 1.765 1.00 13.32 H new ATOM 0 HG2 GLU A 49 -8.067 12.203 -0.651 1.00 33.45 H new ATOM 0 HG3 GLU A 49 -9.670 12.897 -0.512 1.00 33.45 H new ATOM 803 N GLY A 50 -9.991 9.781 3.449 1.00 65.44 N ATOM 804 CA GLY A 50 -10.118 9.288 4.814 1.00 22.22 C ATOM 805 C GLY A 50 -10.316 7.794 4.854 1.00 3.32 C ATOM 806 O GLY A 50 -10.759 7.198 3.869 1.00 32.32 O ATOM 0 H GLY A 50 -10.502 9.217 2.769 1.00 65.44 H new ATOM 0 HA2 GLY A 50 -9.225 9.551 5.380 1.00 22.22 H new ATOM 0 HA3 GLY A 50 -10.960 9.779 5.301 1.00 22.22 H new ATOM 810 N ILE A 51 -10.075 7.224 6.042 1.00 14.44 N ATOM 811 CA ILE A 51 -10.190 5.797 6.273 1.00 35.14 C ATOM 812 C ILE A 51 -11.589 5.365 5.887 1.00 2.45 C ATOM 813 O ILE A 51 -12.602 6.045 6.109 1.00 50.52 O ATOM 814 CB ILE A 51 -9.895 5.373 7.743 1.00 3.11 C ATOM 815 CG1 ILE A 51 -8.413 5.505 8.128 1.00 4.25 C ATOM 816 CG2 ILE A 51 -10.231 3.899 8.060 1.00 22.12 C ATOM 817 CD1 ILE A 51 -8.078 6.940 8.448 1.00 21.41 C ATOM 0 H ILE A 51 -9.794 7.752 6.868 1.00 14.44 H new ATOM 0 HA ILE A 51 -9.434 5.304 5.662 1.00 35.14 H new ATOM 0 HB ILE A 51 -10.534 6.056 8.302 1.00 3.11 H new ATOM 0 HG12 ILE A 51 -8.197 4.874 8.990 1.00 4.25 H new ATOM 0 HG13 ILE A 51 -7.785 5.152 7.310 1.00 4.25 H new ATOM 0 HG21 ILE A 51 -9.996 3.688 9.103 1.00 22.12 H new ATOM 0 HG22 ILE A 51 -11.292 3.722 7.885 1.00 22.12 H new ATOM 0 HG23 ILE A 51 -9.643 3.245 7.416 1.00 22.12 H new ATOM 0 HD11 ILE A 51 -7.025 7.016 8.719 1.00 21.41 H new ATOM 0 HD12 ILE A 51 -8.274 7.563 7.575 1.00 21.41 H new ATOM 0 HD13 ILE A 51 -8.692 7.280 9.282 1.00 21.41 H new ATOM 829 N VAL A 52 -11.587 4.139 5.423 1.00 12.30 N ATOM 830 CA VAL A 52 -12.769 3.336 5.216 1.00 62.44 C ATOM 831 C VAL A 52 -12.553 1.968 5.864 1.00 11.35 C ATOM 832 O VAL A 52 -11.424 1.497 6.038 1.00 10.44 O ATOM 833 CB VAL A 52 -13.106 3.283 3.710 1.00 30.31 C ATOM 834 CG1 VAL A 52 -13.137 4.680 3.067 1.00 32.32 C ATOM 835 CG2 VAL A 52 -12.176 2.371 2.913 1.00 23.10 C ATOM 0 H VAL A 52 -10.727 3.653 5.169 1.00 12.30 H new ATOM 0 HA VAL A 52 -13.643 3.775 5.697 1.00 62.44 H new ATOM 0 HB VAL A 52 -14.107 2.855 3.666 1.00 30.31 H new ATOM 0 HG11 VAL A 52 -13.378 4.588 2.008 1.00 32.32 H new ATOM 0 HG12 VAL A 52 -13.894 5.291 3.560 1.00 32.32 H new ATOM 0 HG13 VAL A 52 -12.161 5.153 3.177 1.00 32.32 H new ATOM 0 HG21 VAL A 52 -12.469 2.380 1.863 1.00 23.10 H new ATOM 0 HG22 VAL A 52 -11.150 2.726 3.006 1.00 23.10 H new ATOM 0 HG23 VAL A 52 -12.244 1.354 3.300 1.00 23.10 H new ATOM 845 N ASP A 53 -13.640 1.292 6.201 1.00 1.13 N ATOM 846 CA ASP A 53 -13.746 -0.145 6.113 1.00 11.24 C ATOM 847 C ASP A 53 -14.831 -0.450 5.085 1.00 35.02 C ATOM 848 O ASP A 53 -15.810 0.298 4.988 1.00 62.13 O ATOM 849 CB ASP A 53 -14.090 -0.739 7.481 1.00 75.34 C ATOM 850 CG ASP A 53 -15.586 -0.875 7.759 1.00 4.31 C ATOM 851 OD1 ASP A 53 -16.199 -1.876 7.327 1.00 5.25 O ATOM 852 OD2 ASP A 53 -16.140 -0.005 8.470 1.00 62.22 O ATOM 0 H ASP A 53 -14.487 1.741 6.550 1.00 1.13 H new ATOM 0 HA ASP A 53 -12.801 -0.592 5.805 1.00 11.24 H new ATOM 0 HB2 ASP A 53 -13.628 -1.723 7.561 1.00 75.34 H new ATOM 0 HB3 ASP A 53 -13.645 -0.114 8.256 1.00 75.34 H new ATOM 857 N TYR A 54 -14.637 -1.529 4.329 1.00 14.53 N ATOM 858 CA TYR A 54 -15.635 -2.252 3.555 1.00 65.00 C ATOM 859 C TYR A 54 -14.913 -3.501 3.043 1.00 13.31 C ATOM 860 O TYR A 54 -14.091 -3.399 2.128 1.00 63.41 O ATOM 861 CB TYR A 54 -16.196 -1.416 2.392 1.00 43.25 C ATOM 862 CG TYR A 54 -17.623 -1.726 2.005 1.00 71.13 C ATOM 863 CD1 TYR A 54 -18.683 -1.390 2.865 1.00 24.23 C ATOM 864 CD2 TYR A 54 -17.893 -2.284 0.747 1.00 43.22 C ATOM 865 CE1 TYR A 54 -20.012 -1.580 2.448 1.00 4.32 C ATOM 866 CE2 TYR A 54 -19.217 -2.489 0.323 1.00 73.40 C ATOM 867 CZ TYR A 54 -20.286 -2.110 1.169 1.00 5.02 C ATOM 868 OH TYR A 54 -21.575 -2.252 0.759 1.00 63.42 O ATOM 0 H TYR A 54 -13.711 -1.948 4.237 1.00 14.53 H new ATOM 0 HA TYR A 54 -16.503 -2.498 4.167 1.00 65.00 H new ATOM 0 HB2 TYR A 54 -16.130 -0.361 2.659 1.00 43.25 H new ATOM 0 HB3 TYR A 54 -15.560 -1.564 1.519 1.00 43.25 H new ATOM 0 HD1 TYR A 54 -18.477 -0.986 3.845 1.00 24.23 H new ATOM 0 HD2 TYR A 54 -17.075 -2.559 0.098 1.00 43.22 H new ATOM 0 HE1 TYR A 54 -20.826 -1.320 3.108 1.00 4.32 H new ATOM 0 HE2 TYR A 54 -19.417 -2.932 -0.641 1.00 73.40 H new ATOM 0 HH TYR A 54 -21.591 -2.630 -0.145 1.00 63.42 H new ATOM 878 N GLY A 55 -15.121 -4.649 3.688 1.00 32.41 N ATOM 879 CA GLY A 55 -14.368 -5.874 3.425 1.00 35.14 C ATOM 880 C GLY A 55 -12.962 -5.776 4.018 1.00 12.11 C ATOM 881 O GLY A 55 -12.691 -6.391 5.054 1.00 45.44 O ATOM 0 H GLY A 55 -15.826 -4.755 4.417 1.00 32.41 H new ATOM 0 HA2 GLY A 55 -14.891 -6.729 3.854 1.00 35.14 H new ATOM 0 HA3 GLY A 55 -14.305 -6.045 2.350 1.00 35.14 H new ATOM 885 N VAL A 56 -12.109 -4.957 3.408 1.00 12.54 N ATOM 886 CA VAL A 56 -10.775 -4.582 3.867 1.00 70.41 C ATOM 887 C VAL A 56 -10.866 -3.176 4.478 1.00 60.30 C ATOM 888 O VAL A 56 -11.875 -2.483 4.333 1.00 2.04 O ATOM 889 CB VAL A 56 -9.774 -4.701 2.694 1.00 43.13 C ATOM 890 CG1 VAL A 56 -8.317 -4.403 3.081 1.00 74.23 C ATOM 891 CG2 VAL A 56 -9.787 -6.113 2.097 1.00 54.41 C ATOM 0 H VAL A 56 -12.347 -4.509 2.523 1.00 12.54 H new ATOM 0 HA VAL A 56 -10.401 -5.250 4.642 1.00 70.41 H new ATOM 0 HB VAL A 56 -10.111 -3.951 1.978 1.00 43.13 H new ATOM 0 HG11 VAL A 56 -7.679 -4.508 2.204 1.00 74.23 H new ATOM 0 HG12 VAL A 56 -8.243 -3.385 3.464 1.00 74.23 H new ATOM 0 HG13 VAL A 56 -7.994 -5.104 3.851 1.00 74.23 H new ATOM 0 HG21 VAL A 56 -9.074 -6.167 1.275 1.00 54.41 H new ATOM 0 HG22 VAL A 56 -9.510 -6.835 2.865 1.00 54.41 H new ATOM 0 HG23 VAL A 56 -10.786 -6.342 1.726 1.00 54.41 H new ATOM 901 N ARG A 57 -9.836 -2.764 5.212 1.00 14.02 N ATOM 902 CA ARG A 57 -9.655 -1.423 5.750 1.00 74.13 C ATOM 903 C ARG A 57 -8.701 -0.687 4.803 1.00 43.53 C ATOM 904 O ARG A 57 -7.587 -1.172 4.591 1.00 52.35 O ATOM 905 CB ARG A 57 -9.087 -1.576 7.181 1.00 45.53 C ATOM 906 CG ARG A 57 -10.125 -2.160 8.175 1.00 43.44 C ATOM 907 CD ARG A 57 -9.534 -3.074 9.271 1.00 13.12 C ATOM 908 NE ARG A 57 -8.412 -2.453 9.994 1.00 33.33 N ATOM 909 CZ ARG A 57 -8.479 -1.379 10.787 1.00 74.41 C ATOM 910 NH1 ARG A 57 -9.635 -0.946 11.283 1.00 74.33 N ATOM 911 NH2 ARG A 57 -7.362 -0.720 11.048 1.00 73.52 N ATOM 0 H ARG A 57 -9.068 -3.389 5.459 1.00 14.02 H new ATOM 0 HA ARG A 57 -10.578 -0.847 5.817 1.00 74.13 H new ATOM 0 HB2 ARG A 57 -8.211 -2.224 7.153 1.00 45.53 H new ATOM 0 HB3 ARG A 57 -8.752 -0.603 7.541 1.00 45.53 H new ATOM 0 HG2 ARG A 57 -10.651 -1.335 8.655 1.00 43.44 H new ATOM 0 HG3 ARG A 57 -10.867 -2.726 7.612 1.00 43.44 H new ATOM 0 HD2 ARG A 57 -10.318 -3.333 9.982 1.00 13.12 H new ATOM 0 HD3 ARG A 57 -9.195 -4.005 8.816 1.00 13.12 H new ATOM 0 HE ARG A 57 -7.495 -2.884 9.879 1.00 33.33 H new ATOM 0 HH11 ARG A 57 -10.501 -1.437 11.061 1.00 74.33 H new ATOM 0 HH12 ARG A 57 -9.655 -0.123 11.886 1.00 74.33 H new ATOM 0 HH21 ARG A 57 -6.479 -1.035 10.647 1.00 73.52 H new ATOM 0 HH22 ARG A 57 -7.384 0.103 11.650 1.00 73.52 H new ATOM 925 N PHE A 58 -9.081 0.473 4.249 1.00 64.03 N ATOM 926 CA PHE A 58 -8.198 1.291 3.402 1.00 32.20 C ATOM 927 C PHE A 58 -8.083 2.702 3.983 1.00 30.34 C ATOM 928 O PHE A 58 -8.915 3.072 4.809 1.00 42.32 O ATOM 929 CB PHE A 58 -8.690 1.347 1.945 1.00 41.23 C ATOM 930 CG PHE A 58 -9.129 0.056 1.276 1.00 71.42 C ATOM 931 CD1 PHE A 58 -8.258 -1.043 1.205 1.00 1.25 C ATOM 932 CD2 PHE A 58 -10.389 -0.031 0.657 1.00 34.32 C ATOM 933 CE1 PHE A 58 -8.620 -2.203 0.497 1.00 1.00 C ATOM 934 CE2 PHE A 58 -10.776 -1.209 -0.006 1.00 32.32 C ATOM 935 CZ PHE A 58 -9.888 -2.292 -0.100 1.00 32.42 C ATOM 0 H PHE A 58 -10.011 0.872 4.375 1.00 64.03 H new ATOM 0 HA PHE A 58 -7.214 0.822 3.392 1.00 32.20 H new ATOM 0 HB2 PHE A 58 -9.529 2.042 1.905 1.00 41.23 H new ATOM 0 HB3 PHE A 58 -7.890 1.777 1.342 1.00 41.23 H new ATOM 0 HD1 PHE A 58 -7.299 -0.997 1.700 1.00 1.25 H new ATOM 0 HD2 PHE A 58 -11.063 0.812 0.691 1.00 34.32 H new ATOM 0 HE1 PHE A 58 -7.924 -3.024 0.413 1.00 1.00 H new ATOM 0 HE2 PHE A 58 -11.760 -1.281 -0.445 1.00 32.32 H new ATOM 0 HZ PHE A 58 -10.178 -3.188 -0.628 1.00 32.42 H new ATOM 945 N PHE A 59 -7.107 3.509 3.531 1.00 30.12 N ATOM 946 CA PHE A 59 -6.942 4.878 4.054 1.00 43.23 C ATOM 947 C PHE A 59 -7.215 5.998 3.051 1.00 33.30 C ATOM 948 O PHE A 59 -7.792 7.011 3.428 1.00 1.41 O ATOM 949 CB PHE A 59 -5.487 5.003 4.554 1.00 33.24 C ATOM 950 CG PHE A 59 -4.990 6.391 4.906 1.00 1.53 C ATOM 951 CD1 PHE A 59 -5.819 7.265 5.621 1.00 15.55 C ATOM 952 CD2 PHE A 59 -3.692 6.809 4.549 1.00 74.30 C ATOM 953 CE1 PHE A 59 -5.376 8.547 5.964 1.00 64.33 C ATOM 954 CE2 PHE A 59 -3.243 8.095 4.901 1.00 23.12 C ATOM 955 CZ PHE A 59 -4.087 8.966 5.610 1.00 23.32 C ATOM 0 H PHE A 59 -6.430 3.243 2.816 1.00 30.12 H new ATOM 0 HA PHE A 59 -7.687 5.009 4.839 1.00 43.23 H new ATOM 0 HB2 PHE A 59 -5.378 4.372 5.436 1.00 33.24 H new ATOM 0 HB3 PHE A 59 -4.830 4.594 3.786 1.00 33.24 H new ATOM 0 HD1 PHE A 59 -6.810 6.946 5.910 1.00 15.55 H new ATOM 0 HD2 PHE A 59 -3.041 6.141 4.004 1.00 74.30 H new ATOM 0 HE1 PHE A 59 -6.030 9.216 6.504 1.00 64.33 H new ATOM 0 HE2 PHE A 59 -2.248 8.413 4.626 1.00 23.12 H new ATOM 0 HZ PHE A 59 -3.744 9.954 5.881 1.00 23.32 H new ATOM 965 N PHE A 60 -6.983 5.702 1.778 1.00 13.15 N ATOM 966 CA PHE A 60 -6.935 6.609 0.625 1.00 62.13 C ATOM 967 C PHE A 60 -6.154 7.933 0.855 1.00 22.12 C ATOM 968 O PHE A 60 -6.002 8.426 1.967 1.00 52.52 O ATOM 969 CB PHE A 60 -8.350 6.819 0.080 1.00 70.14 C ATOM 970 CG PHE A 60 -9.050 5.529 -0.322 1.00 24.05 C ATOM 971 CD1 PHE A 60 -8.534 4.736 -1.365 1.00 42.22 C ATOM 972 CD2 PHE A 60 -10.205 5.102 0.359 1.00 32.13 C ATOM 973 CE1 PHE A 60 -9.172 3.538 -1.731 1.00 43.43 C ATOM 974 CE2 PHE A 60 -10.872 3.933 -0.039 1.00 43.42 C ATOM 975 CZ PHE A 60 -10.349 3.146 -1.077 1.00 74.41 C ATOM 0 H PHE A 60 -6.808 4.738 1.496 1.00 13.15 H new ATOM 0 HA PHE A 60 -6.333 6.118 -0.140 1.00 62.13 H new ATOM 0 HB2 PHE A 60 -8.949 7.326 0.836 1.00 70.14 H new ATOM 0 HB3 PHE A 60 -8.302 7.480 -0.785 1.00 70.14 H new ATOM 0 HD1 PHE A 60 -7.642 5.050 -1.887 1.00 42.22 H new ATOM 0 HD2 PHE A 60 -10.580 5.677 1.193 1.00 32.13 H new ATOM 0 HE1 PHE A 60 -8.757 2.921 -2.514 1.00 43.43 H new ATOM 0 HE2 PHE A 60 -11.787 3.639 0.453 1.00 43.42 H new ATOM 0 HZ PHE A 60 -10.853 2.238 -1.372 1.00 74.41 H new ATOM 985 N TYR A 61 -5.604 8.533 -0.202 1.00 50.23 N ATOM 986 CA TYR A 61 -4.843 9.788 -0.151 1.00 15.03 C ATOM 987 C TYR A 61 -4.584 10.262 -1.574 1.00 42.41 C ATOM 988 O TYR A 61 -4.535 9.439 -2.494 1.00 53.13 O ATOM 989 CB TYR A 61 -3.492 9.607 0.568 1.00 3.43 C ATOM 990 CG TYR A 61 -2.728 8.349 0.202 1.00 63.02 C ATOM 991 CD1 TYR A 61 -2.983 7.170 0.923 1.00 11.42 C ATOM 992 CD2 TYR A 61 -1.801 8.335 -0.859 1.00 5.51 C ATOM 993 CE1 TYR A 61 -2.353 5.975 0.565 1.00 71.44 C ATOM 994 CE2 TYR A 61 -1.119 7.147 -1.183 1.00 31.51 C ATOM 995 CZ TYR A 61 -1.404 5.956 -0.476 1.00 15.10 C ATOM 996 OH TYR A 61 -0.764 4.798 -0.781 1.00 61.44 O ATOM 0 H TYR A 61 -5.676 8.151 -1.145 1.00 50.23 H new ATOM 0 HA TYR A 61 -5.428 10.519 0.406 1.00 15.03 H new ATOM 0 HB2 TYR A 61 -2.864 10.471 0.349 1.00 3.43 H new ATOM 0 HB3 TYR A 61 -3.669 9.605 1.644 1.00 3.43 H new ATOM 0 HD1 TYR A 61 -3.669 7.187 1.757 1.00 11.42 H new ATOM 0 HD2 TYR A 61 -1.614 9.236 -1.424 1.00 5.51 H new ATOM 0 HE1 TYR A 61 -2.595 5.062 1.089 1.00 71.44 H new ATOM 0 HE2 TYR A 61 -0.379 7.145 -1.970 1.00 31.51 H new ATOM 0 HH TYR A 61 -1.182 4.056 -0.297 1.00 61.44 H new ATOM 1006 N THR A 62 -4.403 11.567 -1.763 1.00 30.50 N ATOM 1007 CA THR A 62 -4.250 12.192 -3.068 1.00 73.00 C ATOM 1008 C THR A 62 -2.770 12.351 -3.431 1.00 4.01 C ATOM 1009 O THR A 62 -1.923 12.527 -2.554 1.00 11.13 O ATOM 1010 CB THR A 62 -4.989 13.543 -3.044 1.00 65.43 C ATOM 1011 OG1 THR A 62 -4.757 14.220 -1.822 1.00 13.23 O ATOM 1012 CG2 THR A 62 -6.487 13.312 -3.241 1.00 63.05 C ATOM 0 H THR A 62 -4.358 12.233 -0.992 1.00 30.50 H new ATOM 0 HA THR A 62 -4.686 11.560 -3.842 1.00 73.00 H new ATOM 0 HB THR A 62 -4.609 14.164 -3.855 1.00 65.43 H new ATOM 0 HG1 THR A 62 -5.614 14.488 -1.429 1.00 13.23 H new ATOM 0 HG21 THR A 62 -7.008 14.269 -3.224 1.00 63.05 H new ATOM 0 HG22 THR A 62 -6.657 12.824 -4.201 1.00 63.05 H new ATOM 0 HG23 THR A 62 -6.866 12.678 -2.439 1.00 63.05 H new ATOM 1020 N SER A 63 -2.454 12.326 -4.732 1.00 21.52 N ATOM 1021 CA SER A 63 -1.081 12.428 -5.226 1.00 72.41 C ATOM 1022 C SER A 63 -0.453 13.796 -4.906 1.00 31.14 C ATOM 1023 O SER A 63 0.768 13.945 -4.937 1.00 32.14 O ATOM 1024 CB SER A 63 -1.064 12.095 -6.733 1.00 13.45 C ATOM 1025 OG SER A 63 -1.088 13.230 -7.576 1.00 13.13 O ATOM 0 H SER A 63 -3.149 12.234 -5.473 1.00 21.52 H new ATOM 0 HA SER A 63 -0.455 11.701 -4.707 1.00 72.41 H new ATOM 0 HB2 SER A 63 -0.171 11.510 -6.955 1.00 13.45 H new ATOM 0 HB3 SER A 63 -1.923 11.466 -6.965 1.00 13.45 H new ATOM 0 HG SER A 63 -1.074 12.942 -8.513 1.00 13.13 H new ATOM 1031 N LYS A 64 -1.288 14.801 -4.620 1.00 70.31 N ATOM 1032 CA LYS A 64 -0.869 16.145 -4.255 1.00 1.15 C ATOM 1033 C LYS A 64 -0.283 16.216 -2.849 1.00 51.22 C ATOM 1034 O LYS A 64 0.417 17.189 -2.543 1.00 20.44 O ATOM 1035 CB LYS A 64 -2.059 17.105 -4.400 1.00 33.21 C ATOM 1036 CG LYS A 64 -3.185 16.860 -3.375 1.00 42.23 C ATOM 1037 CD LYS A 64 -3.273 17.934 -2.291 1.00 41.01 C ATOM 1038 CE LYS A 64 -3.720 19.307 -2.814 1.00 2.52 C ATOM 1039 NZ LYS A 64 -2.652 20.326 -2.744 1.00 41.54 N ATOM 0 H LYS A 64 -2.302 14.691 -4.639 1.00 70.31 H new ATOM 0 HA LYS A 64 -0.070 16.442 -4.934 1.00 1.15 H new ATOM 0 HB2 LYS A 64 -1.702 18.130 -4.296 1.00 33.21 H new ATOM 0 HB3 LYS A 64 -2.469 17.011 -5.406 1.00 33.21 H new ATOM 0 HG2 LYS A 64 -4.138 16.808 -3.901 1.00 42.23 H new ATOM 0 HG3 LYS A 64 -3.029 15.891 -2.902 1.00 42.23 H new ATOM 0 HD2 LYS A 64 -3.971 17.604 -1.521 1.00 41.01 H new ATOM 0 HD3 LYS A 64 -2.298 18.037 -1.814 1.00 41.01 H new ATOM 0 HE2 LYS A 64 -4.051 19.206 -3.848 1.00 2.52 H new ATOM 0 HE3 LYS A 64 -4.579 19.648 -2.236 1.00 2.52 H new ATOM 0 HZ1 LYS A 64 -2.890 21.122 -3.370 1.00 41.54 H new ATOM 0 HZ2 LYS A 64 -2.563 20.669 -1.766 1.00 41.54 H new ATOM 0 HZ3 LYS A 64 -1.750 19.905 -3.047 1.00 41.54 H new ATOM 1053 N GLU A 65 -0.585 15.258 -1.971 1.00 4.31 N ATOM 1054 CA GLU A 65 0.024 15.261 -0.656 1.00 1.32 C ATOM 1055 C GLU A 65 1.445 14.686 -0.792 1.00 23.41 C ATOM 1056 O GLU A 65 1.662 13.772 -1.599 1.00 55.24 O ATOM 1057 CB GLU A 65 -0.842 14.493 0.353 1.00 34.21 C ATOM 1058 CG GLU A 65 -1.281 15.403 1.513 1.00 73.11 C ATOM 1059 CD GLU A 65 -2.414 16.370 1.168 1.00 52.01 C ATOM 1060 OE1 GLU A 65 -2.129 17.481 0.662 1.00 44.50 O ATOM 1061 OE2 GLU A 65 -3.588 16.042 1.475 1.00 63.23 O ATOM 0 H GLU A 65 -1.233 14.490 -2.147 1.00 4.31 H new ATOM 0 HA GLU A 65 0.094 16.276 -0.264 1.00 1.32 H new ATOM 0 HB2 GLU A 65 -1.721 14.091 -0.150 1.00 34.21 H new ATOM 0 HB3 GLU A 65 -0.282 13.644 0.745 1.00 34.21 H new ATOM 0 HG2 GLU A 65 -1.596 14.778 2.349 1.00 73.11 H new ATOM 0 HG3 GLU A 65 -0.420 15.979 1.852 1.00 73.11 H new ATOM 1068 N PRO A 66 2.432 15.180 -0.025 1.00 5.03 N ATOM 1069 CA PRO A 66 3.777 14.644 -0.093 1.00 73.12 C ATOM 1070 C PRO A 66 3.802 13.270 0.562 1.00 11.22 C ATOM 1071 O PRO A 66 3.079 12.994 1.527 1.00 54.00 O ATOM 1072 CB PRO A 66 4.675 15.627 0.655 1.00 72.31 C ATOM 1073 CG PRO A 66 3.736 16.334 1.619 1.00 72.15 C ATOM 1074 CD PRO A 66 2.333 16.178 1.026 1.00 13.50 C ATOM 0 HA PRO A 66 4.121 14.526 -1.121 1.00 73.12 H new ATOM 0 HB2 PRO A 66 5.475 15.111 1.186 1.00 72.31 H new ATOM 0 HB3 PRO A 66 5.149 16.332 -0.028 1.00 72.31 H new ATOM 0 HG2 PRO A 66 3.791 15.892 2.614 1.00 72.15 H new ATOM 0 HG3 PRO A 66 4.002 17.386 1.723 1.00 72.15 H new ATOM 0 HD2 PRO A 66 1.622 15.865 1.791 1.00 13.50 H new ATOM 0 HD3 PRO A 66 1.974 17.126 0.626 1.00 13.50 H new ATOM 1082 N VAL A 67 4.710 12.429 0.072 1.00 2.14 N ATOM 1083 CA VAL A 67 4.845 11.047 0.517 1.00 71.22 C ATOM 1084 C VAL A 67 5.112 11.028 2.031 1.00 52.31 C ATOM 1085 O VAL A 67 4.530 10.216 2.745 1.00 4.25 O ATOM 1086 CB VAL A 67 5.921 10.307 -0.318 1.00 34.33 C ATOM 1087 CG1 VAL A 67 5.690 8.793 -0.345 1.00 63.11 C ATOM 1088 CG2 VAL A 67 5.975 10.778 -1.779 1.00 51.54 C ATOM 0 H VAL A 67 5.379 12.692 -0.652 1.00 2.14 H new ATOM 0 HA VAL A 67 3.918 10.499 0.349 1.00 71.22 H new ATOM 0 HB VAL A 67 6.861 10.544 0.181 1.00 34.33 H new ATOM 0 HG11 VAL A 67 6.468 8.317 -0.942 1.00 63.11 H new ATOM 0 HG12 VAL A 67 5.722 8.402 0.672 1.00 63.11 H new ATOM 0 HG13 VAL A 67 4.715 8.581 -0.785 1.00 63.11 H new ATOM 0 HG21 VAL A 67 6.747 10.223 -2.312 1.00 51.54 H new ATOM 0 HG22 VAL A 67 5.010 10.603 -2.254 1.00 51.54 H new ATOM 0 HG23 VAL A 67 6.207 11.843 -1.810 1.00 51.54 H new ATOM 1098 N ALA A 68 5.904 11.977 2.546 1.00 73.14 N ATOM 1099 CA ALA A 68 6.199 12.088 3.968 1.00 3.31 C ATOM 1100 C ALA A 68 4.955 12.376 4.815 1.00 43.11 C ATOM 1101 O ALA A 68 4.813 11.771 5.883 1.00 4.21 O ATOM 1102 CB ALA A 68 7.243 13.180 4.192 1.00 51.33 C ATOM 0 H ALA A 68 6.358 12.692 1.978 1.00 73.14 H new ATOM 0 HA ALA A 68 6.586 11.122 4.292 1.00 3.31 H new ATOM 0 HB1 ALA A 68 7.462 13.261 5.257 1.00 51.33 H new ATOM 0 HB2 ALA A 68 8.156 12.927 3.652 1.00 51.33 H new ATOM 0 HB3 ALA A 68 6.858 14.132 3.827 1.00 51.33 H new ATOM 1108 N SER A 69 4.055 13.267 4.372 1.00 13.34 N ATOM 1109 CA SER A 69 2.801 13.474 5.088 1.00 62.44 C ATOM 1110 C SER A 69 2.064 12.147 5.183 1.00 5.05 C ATOM 1111 O SER A 69 1.754 11.725 6.293 1.00 11.33 O ATOM 1112 CB SER A 69 1.910 14.532 4.432 1.00 64.10 C ATOM 1113 OG SER A 69 2.439 15.827 4.637 1.00 65.45 O ATOM 0 H SER A 69 4.174 13.842 3.538 1.00 13.34 H new ATOM 0 HA SER A 69 3.041 13.849 6.083 1.00 62.44 H new ATOM 0 HB2 SER A 69 1.826 14.333 3.364 1.00 64.10 H new ATOM 0 HB3 SER A 69 0.904 14.475 4.847 1.00 64.10 H new ATOM 0 HG SER A 69 1.857 16.490 4.209 1.00 65.45 H new ATOM 1119 N ILE A 70 1.833 11.479 4.051 1.00 4.21 N ATOM 1120 CA ILE A 70 1.030 10.263 3.970 1.00 45.31 C ATOM 1121 C ILE A 70 1.575 9.221 4.960 1.00 61.13 C ATOM 1122 O ILE A 70 0.807 8.680 5.758 1.00 2.42 O ATOM 1123 CB ILE A 70 0.993 9.777 2.497 1.00 52.14 C ATOM 1124 CG1 ILE A 70 0.260 10.804 1.598 1.00 61.13 C ATOM 1125 CG2 ILE A 70 0.317 8.399 2.362 1.00 55.03 C ATOM 1126 CD1 ILE A 70 0.650 10.713 0.116 1.00 13.33 C ATOM 0 H ILE A 70 2.207 11.776 3.150 1.00 4.21 H new ATOM 0 HA ILE A 70 -0.003 10.448 4.263 1.00 45.31 H new ATOM 0 HB ILE A 70 2.028 9.682 2.169 1.00 52.14 H new ATOM 0 HG12 ILE A 70 -0.816 10.654 1.692 1.00 61.13 H new ATOM 0 HG13 ILE A 70 0.474 11.809 1.960 1.00 61.13 H new ATOM 0 HG21 ILE A 70 0.313 8.097 1.315 1.00 55.03 H new ATOM 0 HG22 ILE A 70 0.868 7.664 2.949 1.00 55.03 H new ATOM 0 HG23 ILE A 70 -0.708 8.460 2.726 1.00 55.03 H new ATOM 0 HD11 ILE A 70 0.098 11.461 -0.452 1.00 13.33 H new ATOM 0 HD12 ILE A 70 1.720 10.893 0.010 1.00 13.33 H new ATOM 0 HD13 ILE A 70 0.410 9.720 -0.263 1.00 13.33 H new ATOM 1138 N ILE A 71 2.894 8.981 4.964 1.00 34.24 N ATOM 1139 CA ILE A 71 3.554 8.041 5.877 1.00 2.14 C ATOM 1140 C ILE A 71 3.221 8.381 7.342 1.00 54.14 C ATOM 1141 O ILE A 71 2.974 7.488 8.155 1.00 14.23 O ATOM 1142 CB ILE A 71 5.086 8.062 5.611 1.00 60.03 C ATOM 1143 CG1 ILE A 71 5.449 7.591 4.177 1.00 1.15 C ATOM 1144 CG2 ILE A 71 5.854 7.244 6.666 1.00 44.11 C ATOM 1145 CD1 ILE A 71 5.705 6.094 4.007 1.00 1.44 C ATOM 0 H ILE A 71 3.540 9.442 4.323 1.00 34.24 H new ATOM 0 HA ILE A 71 3.186 7.031 5.695 1.00 2.14 H new ATOM 0 HB ILE A 71 5.396 9.104 5.694 1.00 60.03 H new ATOM 0 HG12 ILE A 71 4.640 7.879 3.506 1.00 1.15 H new ATOM 0 HG13 ILE A 71 6.339 8.130 3.853 1.00 1.15 H new ATOM 0 HG21 ILE A 71 6.921 7.281 6.449 1.00 44.11 H new ATOM 0 HG22 ILE A 71 5.670 7.663 7.655 1.00 44.11 H new ATOM 0 HG23 ILE A 71 5.514 6.209 6.642 1.00 44.11 H new ATOM 0 HD11 ILE A 71 5.949 5.883 2.966 1.00 1.44 H new ATOM 0 HD12 ILE A 71 6.537 5.793 4.643 1.00 1.44 H new ATOM 0 HD13 ILE A 71 4.812 5.538 4.290 1.00 1.44 H new ATOM 1157 N THR A 72 3.204 9.667 7.691 1.00 12.12 N ATOM 1158 CA THR A 72 3.044 10.114 9.066 1.00 63.51 C ATOM 1159 C THR A 72 1.673 9.713 9.650 1.00 22.31 C ATOM 1160 O THR A 72 1.582 9.494 10.862 1.00 11.23 O ATOM 1161 CB THR A 72 3.331 11.629 9.139 1.00 65.35 C ATOM 1162 OG1 THR A 72 4.594 11.936 8.555 1.00 53.11 O ATOM 1163 CG2 THR A 72 3.404 12.149 10.576 1.00 31.44 C ATOM 0 H THR A 72 3.302 10.429 7.020 1.00 12.12 H new ATOM 0 HA THR A 72 3.769 9.607 9.702 1.00 63.51 H new ATOM 0 HB THR A 72 2.505 12.100 8.606 1.00 65.35 H new ATOM 0 HG1 THR A 72 4.490 12.039 7.586 1.00 53.11 H new ATOM 0 HG21 THR A 72 3.608 13.220 10.566 1.00 31.44 H new ATOM 0 HG22 THR A 72 2.454 11.965 11.078 1.00 31.44 H new ATOM 0 HG23 THR A 72 4.202 11.633 11.110 1.00 31.44 H new ATOM 1171 N LYS A 73 0.611 9.557 8.845 1.00 32.30 N ATOM 1172 CA LYS A 73 -0.683 9.110 9.346 1.00 11.42 C ATOM 1173 C LYS A 73 -0.636 7.630 9.719 1.00 54.45 C ATOM 1174 O LYS A 73 -1.075 7.265 10.810 1.00 15.12 O ATOM 1175 CB LYS A 73 -1.774 9.374 8.305 1.00 43.45 C ATOM 1176 CG LYS A 73 -2.089 10.866 8.107 1.00 13.14 C ATOM 1177 CD LYS A 73 -1.342 11.411 6.889 1.00 33.25 C ATOM 1178 CE LYS A 73 -0.925 12.871 7.058 1.00 74.24 C ATOM 1179 NZ LYS A 73 -1.941 13.817 6.576 1.00 23.11 N ATOM 0 H LYS A 73 0.631 9.737 7.841 1.00 32.30 H new ATOM 0 HA LYS A 73 -0.921 9.676 10.246 1.00 11.42 H new ATOM 0 HB2 LYS A 73 -1.465 8.947 7.351 1.00 43.45 H new ATOM 0 HB3 LYS A 73 -2.685 8.856 8.606 1.00 43.45 H new ATOM 0 HG2 LYS A 73 -3.162 11.003 7.975 1.00 13.14 H new ATOM 0 HG3 LYS A 73 -1.803 11.426 8.997 1.00 13.14 H new ATOM 0 HD2 LYS A 73 -0.456 10.803 6.709 1.00 33.25 H new ATOM 0 HD3 LYS A 73 -1.976 11.318 6.007 1.00 33.25 H new ATOM 0 HE2 LYS A 73 -0.725 13.067 8.112 1.00 74.24 H new ATOM 0 HE3 LYS A 73 0.007 13.042 6.520 1.00 74.24 H new ATOM 0 HZ1 LYS A 73 -1.603 14.791 6.716 1.00 23.11 H new ATOM 0 HZ2 LYS A 73 -2.115 13.653 5.564 1.00 23.11 H new ATOM 0 HZ3 LYS A 73 -2.825 13.677 7.106 1.00 23.11 H new ATOM 1193 N LEU A 74 -0.026 6.794 8.875 1.00 71.32 N ATOM 1194 CA LEU A 74 0.149 5.372 9.156 1.00 44.01 C ATOM 1195 C LEU A 74 0.977 5.189 10.422 1.00 62.53 C ATOM 1196 O LEU A 74 0.697 4.287 11.213 1.00 55.23 O ATOM 1197 CB LEU A 74 0.855 4.650 7.999 1.00 73.41 C ATOM 1198 CG LEU A 74 0.030 4.354 6.741 1.00 30.24 C ATOM 1199 CD1 LEU A 74 -1.287 3.645 7.037 1.00 21.24 C ATOM 1200 CD2 LEU A 74 -0.246 5.594 5.901 1.00 12.20 C ATOM 0 H LEU A 74 0.360 7.087 7.977 1.00 71.32 H new ATOM 0 HA LEU A 74 -0.844 4.941 9.285 1.00 44.01 H new ATOM 0 HB2 LEU A 74 1.716 5.250 7.703 1.00 73.41 H new ATOM 0 HB3 LEU A 74 1.241 3.704 8.378 1.00 73.41 H new ATOM 0 HG LEU A 74 0.662 3.678 6.164 1.00 30.24 H new ATOM 0 HD11 LEU A 74 -1.821 3.465 6.104 1.00 21.24 H new ATOM 0 HD12 LEU A 74 -1.085 2.693 7.529 1.00 21.24 H new ATOM 0 HD13 LEU A 74 -1.897 4.269 7.690 1.00 21.24 H new ATOM 0 HD21 LEU A 74 -0.834 5.317 5.026 1.00 12.20 H new ATOM 0 HD22 LEU A 74 -0.801 6.320 6.495 1.00 12.20 H new ATOM 0 HD23 LEU A 74 0.698 6.034 5.580 1.00 12.20 H new ATOM 1212 N ASN A 75 1.984 6.043 10.632 1.00 30.41 N ATOM 1213 CA ASN A 75 2.740 6.049 11.883 1.00 10.20 C ATOM 1214 C ASN A 75 1.811 6.265 13.086 1.00 45.51 C ATOM 1215 O ASN A 75 2.045 5.656 14.125 1.00 15.51 O ATOM 1216 CB ASN A 75 3.867 7.106 11.882 1.00 22.11 C ATOM 1217 CG ASN A 75 5.189 6.614 11.295 1.00 74.51 C ATOM 1218 OD1 ASN A 75 5.505 5.430 11.327 1.00 73.32 O ATOM 1219 ND2 ASN A 75 6.016 7.488 10.745 1.00 70.51 N ATOM 0 H ASN A 75 2.292 6.737 9.951 1.00 30.41 H new ATOM 0 HA ASN A 75 3.209 5.069 11.970 1.00 10.20 H new ATOM 0 HB2 ASN A 75 3.533 7.976 11.316 1.00 22.11 H new ATOM 0 HB3 ASN A 75 4.039 7.438 12.906 1.00 22.11 H new ATOM 0 HD21 ASN A 75 6.904 7.174 10.354 1.00 70.51 H new ATOM 0 HD22 ASN A 75 5.765 8.476 10.712 1.00 70.51 H new ATOM 1226 N SER A 76 0.776 7.110 12.985 1.00 22.33 N ATOM 1227 CA SER A 76 -0.162 7.376 14.066 1.00 50.45 C ATOM 1228 C SER A 76 -1.119 6.195 14.283 1.00 3.35 C ATOM 1229 O SER A 76 -1.368 5.830 15.435 1.00 71.20 O ATOM 1230 CB SER A 76 -0.931 8.664 13.750 1.00 71.12 C ATOM 1231 OG SER A 76 -0.468 9.748 14.539 1.00 1.02 O ATOM 0 H SER A 76 0.570 7.632 12.133 1.00 22.33 H new ATOM 0 HA SER A 76 0.392 7.505 14.996 1.00 50.45 H new ATOM 0 HB2 SER A 76 -0.819 8.907 12.693 1.00 71.12 H new ATOM 0 HB3 SER A 76 -1.995 8.508 13.930 1.00 71.12 H new ATOM 0 HG SER A 76 -0.975 10.556 14.315 1.00 1.02 H new ATOM 1237 N LEU A 77 -1.662 5.587 13.220 1.00 15.35 N ATOM 1238 CA LEU A 77 -2.563 4.436 13.360 1.00 11.04 C ATOM 1239 C LEU A 77 -1.821 3.214 13.912 1.00 61.15 C ATOM 1240 O LEU A 77 -2.409 2.409 14.629 1.00 33.40 O ATOM 1241 CB LEU A 77 -3.224 4.057 12.023 1.00 4.50 C ATOM 1242 CG LEU A 77 -4.167 5.099 11.393 1.00 54.41 C ATOM 1243 CD1 LEU A 77 -4.794 4.489 10.137 1.00 1.31 C ATOM 1244 CD2 LEU A 77 -5.292 5.551 12.324 1.00 14.23 C ATOM 0 H LEU A 77 -1.493 5.873 12.255 1.00 15.35 H new ATOM 0 HA LEU A 77 -3.340 4.738 14.062 1.00 11.04 H new ATOM 0 HB2 LEU A 77 -2.435 3.836 11.305 1.00 4.50 H new ATOM 0 HB3 LEU A 77 -3.787 3.136 12.172 1.00 4.50 H new ATOM 0 HG LEU A 77 -3.565 5.980 11.170 1.00 54.41 H new ATOM 0 HD11 LEU A 77 -5.466 5.214 9.677 1.00 1.31 H new ATOM 0 HD12 LEU A 77 -4.008 4.223 9.430 1.00 1.31 H new ATOM 0 HD13 LEU A 77 -5.356 3.595 10.408 1.00 1.31 H new ATOM 0 HD21 LEU A 77 -5.915 6.284 11.812 1.00 14.23 H new ATOM 0 HD22 LEU A 77 -5.900 4.691 12.604 1.00 14.23 H new ATOM 0 HD23 LEU A 77 -4.864 6.000 13.220 1.00 14.23 H new ATOM 1256 N ASN A 78 -0.526 3.083 13.599 1.00 25.14 N ATOM 1257 CA ASN A 78 0.392 2.008 14.012 1.00 2.31 C ATOM 1258 C ASN A 78 -0.007 0.603 13.521 1.00 22.45 C ATOM 1259 O ASN A 78 0.736 -0.351 13.756 1.00 23.12 O ATOM 1260 CB ASN A 78 0.590 2.010 15.540 1.00 22.14 C ATOM 1261 CG ASN A 78 1.385 3.171 16.066 1.00 45.33 C ATOM 1262 OD1 ASN A 78 2.611 3.125 16.127 1.00 40.01 O ATOM 1263 ND2 ASN A 78 0.713 4.194 16.541 1.00 4.21 N ATOM 0 H ASN A 78 -0.057 3.771 13.010 1.00 25.14 H new ATOM 0 HA ASN A 78 1.338 2.235 13.519 1.00 2.31 H new ATOM 0 HB2 ASN A 78 -0.389 2.009 16.020 1.00 22.14 H new ATOM 0 HB3 ASN A 78 1.088 1.085 15.830 1.00 22.14 H new ATOM 0 HD21 ASN A 78 1.209 4.974 16.973 1.00 4.21 H new ATOM 0 HD22 ASN A 78 -0.305 4.209 16.478 1.00 4.21 H new ATOM 1270 N GLU A 79 -1.142 0.451 12.840 1.00 64.22 N ATOM 1271 CA GLU A 79 -1.651 -0.815 12.324 1.00 42.50 C ATOM 1272 C GLU A 79 -0.704 -1.407 11.267 1.00 1.23 C ATOM 1273 O GLU A 79 -0.049 -0.639 10.555 1.00 75.44 O ATOM 1274 CB GLU A 79 -3.043 -0.593 11.707 1.00 71.53 C ATOM 1275 CG GLU A 79 -4.204 -1.224 12.501 1.00 63.31 C ATOM 1276 CD GLU A 79 -4.736 -2.513 11.850 1.00 62.40 C ATOM 1277 OE1 GLU A 79 -5.246 -2.421 10.714 1.00 53.13 O ATOM 1278 OE2 GLU A 79 -4.683 -3.602 12.475 1.00 5.40 O ATOM 0 H GLU A 79 -1.754 1.238 12.625 1.00 64.22 H new ATOM 0 HA GLU A 79 -1.719 -1.521 13.151 1.00 42.50 H new ATOM 0 HB2 GLU A 79 -3.220 0.479 11.619 1.00 71.53 H new ATOM 0 HB3 GLU A 79 -3.047 -1.001 10.696 1.00 71.53 H new ATOM 0 HG2 GLU A 79 -3.868 -1.445 13.514 1.00 63.31 H new ATOM 0 HG3 GLU A 79 -5.016 -0.502 12.585 1.00 63.31 H new ATOM 1285 N PRO A 80 -0.658 -2.745 11.134 1.00 34.20 N ATOM 1286 CA PRO A 80 0.068 -3.456 10.090 1.00 63.30 C ATOM 1287 C PRO A 80 -0.566 -3.256 8.718 1.00 75.33 C ATOM 1288 O PRO A 80 -1.794 -3.217 8.588 1.00 43.50 O ATOM 1289 CB PRO A 80 -0.018 -4.934 10.483 1.00 21.42 C ATOM 1290 CG PRO A 80 -1.316 -5.018 11.274 1.00 35.20 C ATOM 1291 CD PRO A 80 -1.296 -3.699 12.023 1.00 4.42 C ATOM 0 HA PRO A 80 1.092 -3.091 10.013 1.00 63.30 H new ATOM 0 HB2 PRO A 80 -0.040 -5.582 9.606 1.00 21.42 H new ATOM 0 HB3 PRO A 80 0.838 -5.240 11.084 1.00 21.42 H new ATOM 0 HG2 PRO A 80 -2.187 -5.109 10.625 1.00 35.20 H new ATOM 0 HG3 PRO A 80 -1.331 -5.874 11.949 1.00 35.20 H new ATOM 0 HD2 PRO A 80 -2.306 -3.380 12.278 1.00 4.42 H new ATOM 0 HD3 PRO A 80 -0.745 -3.790 12.959 1.00 4.42 H new ATOM 1299 N LEU A 81 0.276 -3.196 7.684 1.00 63.41 N ATOM 1300 CA LEU A 81 -0.118 -2.777 6.348 1.00 2.21 C ATOM 1301 C LEU A 81 0.306 -3.789 5.299 1.00 41.24 C ATOM 1302 O LEU A 81 1.268 -4.540 5.500 1.00 21.02 O ATOM 1303 CB LEU A 81 0.536 -1.437 5.958 1.00 1.11 C ATOM 1304 CG LEU A 81 0.565 -0.376 7.063 1.00 75.04 C ATOM 1305 CD1 LEU A 81 1.231 0.877 6.528 1.00 43.00 C ATOM 1306 CD2 LEU A 81 -0.840 0.011 7.491 1.00 72.51 C ATOM 0 H LEU A 81 1.263 -3.442 7.758 1.00 63.41 H new ATOM 0 HA LEU A 81 -1.203 -2.682 6.376 1.00 2.21 H new ATOM 0 HB2 LEU A 81 1.559 -1.631 5.637 1.00 1.11 H new ATOM 0 HB3 LEU A 81 0.004 -1.029 5.099 1.00 1.11 H new ATOM 0 HG LEU A 81 1.106 -0.793 7.912 1.00 75.04 H new ATOM 0 HD11 LEU A 81 1.256 1.637 7.308 1.00 43.00 H new ATOM 0 HD12 LEU A 81 2.249 0.643 6.217 1.00 43.00 H new ATOM 0 HD13 LEU A 81 0.667 1.252 5.674 1.00 43.00 H new ATOM 0 HD21 LEU A 81 -0.786 0.765 8.276 1.00 72.51 H new ATOM 0 HD22 LEU A 81 -1.383 0.415 6.636 1.00 72.51 H new ATOM 0 HD23 LEU A 81 -1.361 -0.869 7.868 1.00 72.51 H new ATOM 1318 N VAL A 82 -0.336 -3.708 4.134 1.00 4.44 N ATOM 1319 CA VAL A 82 0.085 -4.358 2.902 1.00 30.22 C ATOM 1320 C VAL A 82 -0.280 -3.367 1.785 1.00 13.31 C ATOM 1321 O VAL A 82 -1.460 -3.155 1.516 1.00 65.13 O ATOM 1322 CB VAL A 82 -0.587 -5.751 2.737 1.00 14.21 C ATOM 1323 CG1 VAL A 82 0.159 -6.668 1.759 1.00 3.33 C ATOM 1324 CG2 VAL A 82 -0.795 -6.527 4.043 1.00 30.30 C ATOM 0 H VAL A 82 -1.194 -3.168 4.023 1.00 4.44 H new ATOM 0 HA VAL A 82 1.153 -4.576 2.887 1.00 30.22 H new ATOM 0 HB VAL A 82 -1.567 -5.490 2.336 1.00 14.21 H new ATOM 0 HG11 VAL A 82 -0.360 -7.624 1.688 1.00 3.33 H new ATOM 0 HG12 VAL A 82 0.193 -6.200 0.775 1.00 3.33 H new ATOM 0 HG13 VAL A 82 1.175 -6.833 2.118 1.00 3.33 H new ATOM 0 HG21 VAL A 82 -1.269 -7.484 3.826 1.00 30.30 H new ATOM 0 HG22 VAL A 82 0.169 -6.700 4.521 1.00 30.30 H new ATOM 0 HG23 VAL A 82 -1.433 -5.949 4.712 1.00 30.30 H new ATOM 1334 N THR A 83 0.694 -2.685 1.184 1.00 64.23 N ATOM 1335 CA THR A 83 0.487 -1.762 0.059 1.00 61.53 C ATOM 1336 C THR A 83 1.748 -1.669 -0.804 1.00 23.52 C ATOM 1337 O THR A 83 2.825 -2.061 -0.366 1.00 1.33 O ATOM 1338 CB THR A 83 0.027 -0.373 0.543 1.00 72.14 C ATOM 1339 OG1 THR A 83 -0.655 0.264 -0.520 1.00 62.03 O ATOM 1340 CG2 THR A 83 1.156 0.544 1.032 1.00 71.01 C ATOM 0 H THR A 83 1.671 -2.757 1.468 1.00 64.23 H new ATOM 0 HA THR A 83 -0.314 -2.164 -0.561 1.00 61.53 H new ATOM 0 HB THR A 83 -0.613 -0.543 1.409 1.00 72.14 H new ATOM 0 HG1 THR A 83 -1.122 1.056 -0.181 1.00 62.03 H new ATOM 0 HG21 THR A 83 0.737 1.498 1.352 1.00 71.01 H new ATOM 0 HG22 THR A 83 1.670 0.073 1.870 1.00 71.01 H new ATOM 0 HG23 THR A 83 1.865 0.713 0.221 1.00 71.01 H new ATOM 1348 N MET A 84 1.630 -1.130 -2.013 1.00 71.33 N ATOM 1349 CA MET A 84 2.687 -1.019 -3.017 1.00 3.20 C ATOM 1350 C MET A 84 3.717 0.052 -2.656 1.00 12.41 C ATOM 1351 O MET A 84 3.452 0.877 -1.778 1.00 63.32 O ATOM 1352 CB MET A 84 2.037 -0.713 -4.380 1.00 11.52 C ATOM 1353 CG MET A 84 0.796 -1.556 -4.688 1.00 4.22 C ATOM 1354 SD MET A 84 -0.764 -0.862 -4.054 1.00 43.53 S ATOM 1355 CE MET A 84 -1.733 -2.369 -3.804 1.00 61.14 C ATOM 0 H MET A 84 0.747 -0.737 -2.338 1.00 71.33 H new ATOM 0 HA MET A 84 3.228 -1.964 -3.061 1.00 3.20 H new ATOM 0 HB2 MET A 84 1.763 0.341 -4.410 1.00 11.52 H new ATOM 0 HB3 MET A 84 2.775 -0.873 -5.166 1.00 11.52 H new ATOM 0 HG2 MET A 84 0.713 -1.677 -5.768 1.00 4.22 H new ATOM 0 HG3 MET A 84 0.934 -2.551 -4.266 1.00 4.22 H new ATOM 0 HE1 MET A 84 -2.778 -2.107 -3.642 1.00 61.14 H new ATOM 0 HE2 MET A 84 -1.651 -3.005 -4.686 1.00 61.14 H new ATOM 0 HE3 MET A 84 -1.354 -2.905 -2.934 1.00 61.14 H new ATOM 1365 N PRO A 85 4.895 0.064 -3.311 1.00 22.05 N ATOM 1366 CA PRO A 85 5.952 1.007 -2.961 1.00 20.14 C ATOM 1367 C PRO A 85 5.607 2.416 -3.469 1.00 71.34 C ATOM 1368 O PRO A 85 5.991 2.801 -4.568 1.00 73.41 O ATOM 1369 CB PRO A 85 7.233 0.398 -3.534 1.00 72.44 C ATOM 1370 CG PRO A 85 6.772 -0.455 -4.709 1.00 64.40 C ATOM 1371 CD PRO A 85 5.377 -0.921 -4.290 1.00 24.01 C ATOM 0 HA PRO A 85 6.079 1.152 -1.888 1.00 20.14 H new ATOM 0 HB2 PRO A 85 7.928 1.173 -3.857 1.00 72.44 H new ATOM 0 HB3 PRO A 85 7.752 -0.204 -2.788 1.00 72.44 H new ATOM 0 HG2 PRO A 85 6.741 0.120 -5.634 1.00 64.40 H new ATOM 0 HG3 PRO A 85 7.442 -1.298 -4.880 1.00 64.40 H new ATOM 0 HD2 PRO A 85 4.709 -0.975 -5.150 1.00 24.01 H new ATOM 0 HD3 PRO A 85 5.414 -1.919 -3.853 1.00 24.01 H new ATOM 1379 N ILE A 86 4.852 3.166 -2.664 1.00 13.03 N ATOM 1380 CA ILE A 86 4.069 4.351 -3.022 1.00 71.51 C ATOM 1381 C ILE A 86 4.832 5.321 -3.920 1.00 23.41 C ATOM 1382 O ILE A 86 4.340 5.684 -4.983 1.00 40.43 O ATOM 1383 CB ILE A 86 3.545 5.050 -1.741 1.00 72.34 C ATOM 1384 CG1 ILE A 86 2.707 4.071 -0.891 1.00 33.14 C ATOM 1385 CG2 ILE A 86 2.717 6.308 -2.073 1.00 60.04 C ATOM 1386 CD1 ILE A 86 2.291 4.642 0.461 1.00 34.14 C ATOM 0 H ILE A 86 4.765 2.945 -1.672 1.00 13.03 H new ATOM 0 HA ILE A 86 3.217 4.012 -3.612 1.00 71.51 H new ATOM 0 HB ILE A 86 4.415 5.366 -1.165 1.00 72.34 H new ATOM 0 HG12 ILE A 86 1.813 3.791 -1.449 1.00 33.14 H new ATOM 0 HG13 ILE A 86 3.281 3.159 -0.730 1.00 33.14 H new ATOM 0 HG21 ILE A 86 2.368 6.768 -1.149 1.00 60.04 H new ATOM 0 HG22 ILE A 86 3.337 7.018 -2.620 1.00 60.04 H new ATOM 0 HG23 ILE A 86 1.859 6.028 -2.685 1.00 60.04 H new ATOM 0 HD11 ILE A 86 1.705 3.901 1.004 1.00 34.14 H new ATOM 0 HD12 ILE A 86 3.180 4.896 1.038 1.00 34.14 H new ATOM 0 HD13 ILE A 86 1.690 5.538 0.308 1.00 34.14 H new ATOM 1398 N GLY A 87 5.996 5.795 -3.480 1.00 72.22 N ATOM 1399 CA GLY A 87 6.677 6.911 -4.117 1.00 42.02 C ATOM 1400 C GLY A 87 7.212 6.573 -5.508 1.00 34.41 C ATOM 1401 O GLY A 87 7.446 7.486 -6.295 1.00 71.24 O ATOM 0 H GLY A 87 6.490 5.414 -2.673 1.00 72.22 H new ATOM 0 HA2 GLY A 87 5.989 7.753 -4.194 1.00 42.02 H new ATOM 0 HA3 GLY A 87 7.504 7.233 -3.484 1.00 42.02 H new ATOM 1405 N TYR A 88 7.339 5.281 -5.833 1.00 74.01 N ATOM 1406 CA TYR A 88 7.833 4.764 -7.110 1.00 41.44 C ATOM 1407 C TYR A 88 6.955 5.179 -8.303 1.00 1.24 C ATOM 1408 O TYR A 88 7.329 4.971 -9.453 1.00 40.33 O ATOM 1409 CB TYR A 88 7.899 3.230 -6.996 1.00 60.52 C ATOM 1410 CG TYR A 88 8.563 2.496 -8.144 1.00 43.53 C ATOM 1411 CD1 TYR A 88 9.966 2.427 -8.237 1.00 72.20 C ATOM 1412 CD2 TYR A 88 7.767 1.877 -9.122 1.00 35.23 C ATOM 1413 CE1 TYR A 88 10.573 1.730 -9.300 1.00 4.40 C ATOM 1414 CE2 TYR A 88 8.356 1.238 -10.221 1.00 43.52 C ATOM 1415 CZ TYR A 88 9.769 1.151 -10.312 1.00 55.05 C ATOM 1416 OH TYR A 88 10.364 0.495 -11.349 1.00 32.32 O ATOM 0 H TYR A 88 7.089 4.536 -5.183 1.00 74.01 H new ATOM 0 HA TYR A 88 8.818 5.189 -7.305 1.00 41.44 H new ATOM 0 HB2 TYR A 88 8.429 2.978 -6.078 1.00 60.52 H new ATOM 0 HB3 TYR A 88 6.882 2.851 -6.891 1.00 60.52 H new ATOM 0 HD1 TYR A 88 10.579 2.910 -7.491 1.00 72.20 H new ATOM 0 HD2 TYR A 88 6.691 1.894 -9.026 1.00 35.23 H new ATOM 0 HE1 TYR A 88 11.648 1.637 -9.343 1.00 4.40 H new ATOM 0 HE2 TYR A 88 7.736 0.813 -10.997 1.00 43.52 H new ATOM 0 HH TYR A 88 9.676 0.154 -11.958 1.00 32.32 H new ATOM 1426 N VAL A 89 5.767 5.727 -8.044 1.00 2.24 N ATOM 1427 CA VAL A 89 4.736 5.971 -9.041 1.00 1.42 C ATOM 1428 C VAL A 89 4.216 7.407 -8.914 1.00 34.11 C ATOM 1429 O VAL A 89 4.476 8.197 -9.817 1.00 72.12 O ATOM 1430 CB VAL A 89 3.682 4.842 -9.073 1.00 20.31 C ATOM 1431 CG1 VAL A 89 4.138 3.671 -9.964 1.00 21.11 C ATOM 1432 CG2 VAL A 89 3.388 4.257 -7.698 1.00 70.22 C ATOM 0 H VAL A 89 5.492 6.020 -7.106 1.00 2.24 H new ATOM 0 HA VAL A 89 5.156 5.919 -10.045 1.00 1.42 H new ATOM 0 HB VAL A 89 2.783 5.315 -9.468 1.00 20.31 H new ATOM 0 HG11 VAL A 89 3.373 2.894 -9.964 1.00 21.11 H new ATOM 0 HG12 VAL A 89 4.293 4.028 -10.982 1.00 21.11 H new ATOM 0 HG13 VAL A 89 5.071 3.261 -9.577 1.00 21.11 H new ATOM 0 HG21 VAL A 89 2.640 3.469 -7.790 1.00 70.22 H new ATOM 0 HG22 VAL A 89 4.303 3.841 -7.276 1.00 70.22 H new ATOM 0 HG23 VAL A 89 3.010 5.041 -7.042 1.00 70.22 H new ATOM 1442 N THR A 90 3.542 7.797 -7.823 1.00 21.21 N ATOM 1443 CA THR A 90 3.010 9.161 -7.648 1.00 40.10 C ATOM 1444 C THR A 90 4.102 10.225 -7.843 1.00 25.52 C ATOM 1445 O THR A 90 3.861 11.256 -8.480 1.00 24.13 O ATOM 1446 CB THR A 90 2.299 9.290 -6.279 1.00 13.32 C ATOM 1447 OG1 THR A 90 1.799 10.584 -6.046 1.00 32.40 O ATOM 1448 CG2 THR A 90 3.169 8.911 -5.077 1.00 53.50 C ATOM 0 H THR A 90 3.349 7.178 -7.036 1.00 21.21 H new ATOM 0 HA THR A 90 2.267 9.343 -8.424 1.00 40.10 H new ATOM 0 HB THR A 90 1.482 8.573 -6.359 1.00 13.32 H new ATOM 0 HG1 THR A 90 1.359 10.612 -5.171 1.00 32.40 H new ATOM 0 HG21 THR A 90 2.593 9.030 -4.159 1.00 53.50 H new ATOM 0 HG22 THR A 90 3.489 7.873 -5.172 1.00 53.50 H new ATOM 0 HG23 THR A 90 4.045 9.559 -5.043 1.00 53.50 H new ATOM 1456 N HIS A 91 5.309 9.956 -7.327 1.00 45.13 N ATOM 1457 CA HIS A 91 6.419 10.902 -7.290 1.00 15.23 C ATOM 1458 C HIS A 91 7.519 10.535 -8.295 1.00 5.03 C ATOM 1459 O HIS A 91 8.490 11.280 -8.428 1.00 63.11 O ATOM 1460 CB HIS A 91 6.967 10.957 -5.854 1.00 55.14 C ATOM 1461 CG HIS A 91 7.499 12.310 -5.461 1.00 52.21 C ATOM 1462 ND1 HIS A 91 8.466 13.039 -6.115 1.00 62.21 N ATOM 1463 CD2 HIS A 91 7.094 13.037 -4.377 1.00 3.21 C ATOM 1464 CE1 HIS A 91 8.645 14.183 -5.436 1.00 23.15 C ATOM 1465 NE2 HIS A 91 7.852 14.218 -4.345 1.00 4.13 N ATOM 0 H HIS A 91 5.540 9.052 -6.916 1.00 45.13 H new ATOM 0 HA HIS A 91 6.058 11.888 -7.583 1.00 15.23 H new ATOM 0 HB2 HIS A 91 6.175 10.672 -5.161 1.00 55.14 H new ATOM 0 HB3 HIS A 91 7.762 10.219 -5.749 1.00 55.14 H new ATOM 0 HD1 HIS A 91 8.958 12.760 -6.964 1.00 62.21 H new ATOM 0 HD2 HIS A 91 6.328 12.753 -3.671 1.00 3.21 H new ATOM 0 HE1 HIS A 91 9.330 14.967 -5.723 1.00 23.15 H new ATOM 1473 N GLY A 92 7.383 9.399 -8.990 1.00 54.41 N ATOM 1474 CA GLY A 92 8.365 8.920 -9.950 1.00 15.42 C ATOM 1475 C GLY A 92 9.703 8.525 -9.326 1.00 12.32 C ATOM 1476 O GLY A 92 10.696 8.515 -10.051 1.00 5.23 O ATOM 0 H GLY A 92 6.575 8.784 -8.895 1.00 54.41 H new ATOM 0 HA2 GLY A 92 7.953 8.059 -10.477 1.00 15.42 H new ATOM 0 HA3 GLY A 92 8.538 9.696 -10.695 1.00 15.42 H new ATOM 1480 N PHE A 93 9.766 8.230 -8.020 1.00 52.41 N ATOM 1481 CA PHE A 93 11.037 7.911 -7.371 1.00 43.12 C ATOM 1482 C PHE A 93 11.633 6.637 -7.970 1.00 13.42 C ATOM 1483 O PHE A 93 10.894 5.726 -8.352 1.00 53.10 O ATOM 1484 CB PHE A 93 10.849 7.722 -5.862 1.00 21.24 C ATOM 1485 CG PHE A 93 10.604 8.978 -5.051 1.00 72.41 C ATOM 1486 CD1 PHE A 93 11.189 10.208 -5.404 1.00 35.23 C ATOM 1487 CD2 PHE A 93 9.813 8.901 -3.895 1.00 44.02 C ATOM 1488 CE1 PHE A 93 10.922 11.360 -4.655 1.00 21.14 C ATOM 1489 CE2 PHE A 93 9.538 10.055 -3.147 1.00 21.24 C ATOM 1490 CZ PHE A 93 10.085 11.292 -3.526 1.00 74.42 C ATOM 0 H PHE A 93 8.957 8.207 -7.400 1.00 52.41 H new ATOM 0 HA PHE A 93 11.717 8.746 -7.540 1.00 43.12 H new ATOM 0 HB2 PHE A 93 10.010 7.045 -5.705 1.00 21.24 H new ATOM 0 HB3 PHE A 93 11.736 7.228 -5.466 1.00 21.24 H new ATOM 0 HD1 PHE A 93 11.848 10.264 -6.258 1.00 35.23 H new ATOM 0 HD2 PHE A 93 9.414 7.948 -3.580 1.00 44.02 H new ATOM 0 HE1 PHE A 93 11.360 12.304 -4.945 1.00 21.14 H new ATOM 0 HE2 PHE A 93 8.903 9.992 -2.276 1.00 21.24 H new ATOM 0 HZ PHE A 93 9.865 12.183 -2.956 1.00 74.42 H new ATOM 1500 N ASN A 94 12.964 6.526 -7.984 1.00 21.41 N ATOM 1501 CA ASN A 94 13.601 5.270 -8.368 1.00 30.05 C ATOM 1502 C ASN A 94 13.344 4.195 -7.314 1.00 2.31 C ATOM 1503 O ASN A 94 12.831 4.461 -6.227 1.00 13.24 O ATOM 1504 CB ASN A 94 15.104 5.421 -8.624 1.00 70.23 C ATOM 1505 CG ASN A 94 15.384 6.124 -9.939 1.00 4.12 C ATOM 1506 OD1 ASN A 94 15.710 7.303 -9.967 1.00 11.02 O ATOM 1507 ND2 ASN A 94 15.244 5.433 -11.061 1.00 15.02 N ATOM 0 H ASN A 94 13.609 7.277 -7.738 1.00 21.41 H new ATOM 0 HA ASN A 94 13.149 4.964 -9.312 1.00 30.05 H new ATOM 0 HB2 ASN A 94 15.557 5.983 -7.808 1.00 70.23 H new ATOM 0 HB3 ASN A 94 15.572 4.437 -8.631 1.00 70.23 H new ATOM 0 HD21 ASN A 94 15.408 5.883 -11.961 1.00 15.02 H new ATOM 0 HD22 ASN A 94 14.972 4.451 -11.024 1.00 15.02 H new ATOM 1514 N LEU A 95 13.712 2.955 -7.630 1.00 52.24 N ATOM 1515 CA LEU A 95 13.373 1.789 -6.832 1.00 42.51 C ATOM 1516 C LEU A 95 13.910 1.906 -5.401 1.00 4.31 C ATOM 1517 O LEU A 95 13.178 1.651 -4.442 1.00 41.31 O ATOM 1518 CB LEU A 95 13.870 0.524 -7.554 1.00 11.14 C ATOM 1519 CG LEU A 95 13.164 -0.747 -7.041 1.00 42.20 C ATOM 1520 CD1 LEU A 95 12.280 -1.393 -8.115 1.00 2.05 C ATOM 1521 CD2 LEU A 95 14.187 -1.779 -6.566 1.00 5.45 C ATOM 0 H LEU A 95 14.262 2.734 -8.460 1.00 52.24 H new ATOM 0 HA LEU A 95 12.290 1.721 -6.731 1.00 42.51 H new ATOM 0 HB2 LEU A 95 13.699 0.627 -8.626 1.00 11.14 H new ATOM 0 HB3 LEU A 95 14.946 0.424 -7.411 1.00 11.14 H new ATOM 0 HG LEU A 95 12.531 -0.434 -6.211 1.00 42.20 H new ATOM 0 HD11 LEU A 95 11.804 -2.284 -7.707 1.00 2.05 H new ATOM 0 HD12 LEU A 95 11.514 -0.685 -8.430 1.00 2.05 H new ATOM 0 HD13 LEU A 95 12.893 -1.670 -8.973 1.00 2.05 H new ATOM 0 HD21 LEU A 95 13.668 -2.668 -6.208 1.00 5.45 H new ATOM 0 HD22 LEU A 95 14.842 -2.050 -7.394 1.00 5.45 H new ATOM 0 HD23 LEU A 95 14.782 -1.356 -5.757 1.00 5.45 H new ATOM 1533 N GLU A 96 15.173 2.302 -5.245 1.00 32.25 N ATOM 1534 CA GLU A 96 15.832 2.411 -3.950 1.00 13.02 C ATOM 1535 C GLU A 96 15.471 3.713 -3.218 1.00 33.40 C ATOM 1536 O GLU A 96 15.514 3.773 -1.990 1.00 2.43 O ATOM 1537 CB GLU A 96 17.340 2.240 -4.174 1.00 64.33 C ATOM 1538 CG GLU A 96 18.205 3.475 -4.329 1.00 20.41 C ATOM 1539 CD GLU A 96 17.846 4.384 -5.507 1.00 22.03 C ATOM 1540 OE1 GLU A 96 17.251 3.926 -6.511 1.00 54.34 O ATOM 1541 OE2 GLU A 96 18.256 5.566 -5.442 1.00 44.13 O ATOM 0 H GLU A 96 15.773 2.559 -6.028 1.00 32.25 H new ATOM 0 HA GLU A 96 15.479 1.623 -3.284 1.00 13.02 H new ATOM 0 HB2 GLU A 96 17.734 1.666 -3.336 1.00 64.33 H new ATOM 0 HB3 GLU A 96 17.473 1.631 -5.068 1.00 64.33 H new ATOM 0 HG2 GLU A 96 18.144 4.058 -3.410 1.00 20.41 H new ATOM 0 HG3 GLU A 96 19.243 3.160 -4.438 1.00 20.41 H new ATOM 1548 N GLU A 97 15.086 4.753 -3.958 1.00 30.40 N ATOM 1549 CA GLU A 97 14.539 5.977 -3.365 1.00 14.11 C ATOM 1550 C GLU A 97 13.187 5.651 -2.721 1.00 50.44 C ATOM 1551 O GLU A 97 12.947 5.908 -1.539 1.00 52.51 O ATOM 1552 CB GLU A 97 14.336 7.069 -4.421 1.00 20.31 C ATOM 1553 CG GLU A 97 15.614 7.649 -5.020 1.00 75.33 C ATOM 1554 CD GLU A 97 15.284 8.854 -5.901 1.00 63.43 C ATOM 1555 OE1 GLU A 97 14.391 8.745 -6.776 1.00 33.23 O ATOM 1556 OE2 GLU A 97 15.926 9.910 -5.694 1.00 62.22 O ATOM 0 H GLU A 97 15.143 4.773 -4.976 1.00 30.40 H new ATOM 0 HA GLU A 97 15.246 6.347 -2.623 1.00 14.11 H new ATOM 0 HB2 GLU A 97 13.730 6.660 -5.229 1.00 20.31 H new ATOM 0 HB3 GLU A 97 13.764 7.882 -3.973 1.00 20.31 H new ATOM 0 HG2 GLU A 97 16.295 7.948 -4.223 1.00 75.33 H new ATOM 0 HG3 GLU A 97 16.126 6.888 -5.609 1.00 75.33 H new ATOM 1563 N ALA A 98 12.300 5.017 -3.493 1.00 22.42 N ATOM 1564 CA ALA A 98 11.007 4.570 -3.012 1.00 33.33 C ATOM 1565 C ALA A 98 11.157 3.633 -1.811 1.00 63.35 C ATOM 1566 O ALA A 98 10.293 3.652 -0.932 1.00 35.45 O ATOM 1567 CB ALA A 98 10.238 3.891 -4.146 1.00 62.34 C ATOM 0 H ALA A 98 12.468 4.802 -4.476 1.00 22.42 H new ATOM 0 HA ALA A 98 10.441 5.439 -2.677 1.00 33.33 H new ATOM 0 HB1 ALA A 98 9.268 3.557 -3.779 1.00 62.34 H new ATOM 0 HB2 ALA A 98 10.093 4.599 -4.962 1.00 62.34 H new ATOM 0 HB3 ALA A 98 10.804 3.032 -4.506 1.00 62.34 H new ATOM 1573 N ALA A 99 12.227 2.829 -1.768 1.00 1.25 N ATOM 1574 CA ALA A 99 12.567 2.006 -0.615 1.00 22.11 C ATOM 1575 C ALA A 99 12.762 2.863 0.636 1.00 65.03 C ATOM 1576 O ALA A 99 12.179 2.557 1.674 1.00 73.24 O ATOM 1577 CB ALA A 99 13.803 1.146 -0.909 1.00 11.41 C ATOM 0 H ALA A 99 12.883 2.735 -2.543 1.00 1.25 H new ATOM 0 HA ALA A 99 11.733 1.333 -0.418 1.00 22.11 H new ATOM 0 HB1 ALA A 99 14.040 0.539 -0.035 1.00 11.41 H new ATOM 0 HB2 ALA A 99 13.599 0.495 -1.759 1.00 11.41 H new ATOM 0 HB3 ALA A 99 14.649 1.793 -1.142 1.00 11.41 H new ATOM 1583 N ARG A 100 13.551 3.939 0.561 1.00 44.30 N ATOM 1584 CA ARG A 100 13.802 4.828 1.700 1.00 14.32 C ATOM 1585 C ARG A 100 12.517 5.461 2.210 1.00 34.45 C ATOM 1586 O ARG A 100 12.319 5.538 3.429 1.00 73.40 O ATOM 1587 CB ARG A 100 14.812 5.915 1.316 1.00 71.24 C ATOM 1588 CG ARG A 100 16.210 5.319 1.156 1.00 1.25 C ATOM 1589 CD ARG A 100 17.247 6.383 0.786 1.00 30.32 C ATOM 1590 NE ARG A 100 18.575 5.909 1.180 1.00 61.10 N ATOM 1591 CZ ARG A 100 19.280 4.971 0.549 1.00 43.31 C ATOM 1592 NH1 ARG A 100 19.069 4.667 -0.724 1.00 44.22 N ATOM 1593 NH2 ARG A 100 20.207 4.319 1.225 1.00 45.51 N ATOM 0 H ARG A 100 14.035 4.219 -0.292 1.00 44.30 H new ATOM 0 HA ARG A 100 14.218 4.223 2.506 1.00 14.32 H new ATOM 0 HB2 ARG A 100 14.505 6.391 0.385 1.00 71.24 H new ATOM 0 HB3 ARG A 100 14.827 6.691 2.081 1.00 71.24 H new ATOM 0 HG2 ARG A 100 16.505 4.832 2.086 1.00 1.25 H new ATOM 0 HG3 ARG A 100 16.190 4.549 0.385 1.00 1.25 H new ATOM 0 HD2 ARG A 100 17.220 6.579 -0.286 1.00 30.32 H new ATOM 0 HD3 ARG A 100 17.018 7.323 1.288 1.00 30.32 H new ATOM 0 HE ARG A 100 18.996 6.332 2.007 1.00 61.10 H new ATOM 0 HH11 ARG A 100 18.347 5.157 -1.253 1.00 44.22 H new ATOM 0 HH12 ARG A 100 19.628 3.943 -1.175 1.00 44.22 H new ATOM 0 HH21 ARG A 100 20.370 4.538 2.208 1.00 45.51 H new ATOM 0 HH22 ARG A 100 20.760 3.596 0.765 1.00 45.51 H new ATOM 1607 N CYS A 101 11.638 5.877 1.294 1.00 31.21 N ATOM 1608 CA CYS A 101 10.314 6.370 1.636 1.00 43.53 C ATOM 1609 C CYS A 101 9.581 5.378 2.535 1.00 1.14 C ATOM 1610 O CYS A 101 9.160 5.760 3.630 1.00 51.42 O ATOM 1611 CB CYS A 101 9.515 6.654 0.361 1.00 65.23 C ATOM 1612 SG CYS A 101 9.949 8.287 -0.274 1.00 54.41 S ATOM 0 H CYS A 101 11.832 5.879 0.293 1.00 31.21 H new ATOM 0 HA CYS A 101 10.420 7.302 2.191 1.00 43.53 H new ATOM 0 HB2 CYS A 101 9.726 5.893 -0.390 1.00 65.23 H new ATOM 0 HB3 CYS A 101 8.446 6.607 0.571 1.00 65.23 H new ATOM 0 HG CYS A 101 9.665 8.349 -1.541 1.00 54.41 H new ATOM 1618 N MET A 102 9.423 4.131 2.080 1.00 63.41 N ATOM 1619 CA MET A 102 8.703 3.111 2.837 1.00 10.23 C ATOM 1620 C MET A 102 9.430 2.807 4.148 1.00 30.02 C ATOM 1621 O MET A 102 8.787 2.758 5.192 1.00 21.43 O ATOM 1622 CB MET A 102 8.496 1.831 2.009 1.00 64.34 C ATOM 1623 CG MET A 102 7.757 2.092 0.689 1.00 33.32 C ATOM 1624 SD MET A 102 6.094 2.827 0.780 1.00 13.51 S ATOM 1625 CE MET A 102 5.101 1.355 1.149 1.00 31.12 C ATOM 0 H MET A 102 9.788 3.806 1.185 1.00 63.41 H new ATOM 0 HA MET A 102 7.715 3.505 3.074 1.00 10.23 H new ATOM 0 HB2 MET A 102 9.465 1.381 1.795 1.00 64.34 H new ATOM 0 HB3 MET A 102 7.932 1.108 2.599 1.00 64.34 H new ATOM 0 HG2 MET A 102 8.380 2.747 0.080 1.00 33.32 H new ATOM 0 HG3 MET A 102 7.676 1.144 0.157 1.00 33.32 H new ATOM 0 HE1 MET A 102 4.108 1.659 1.479 1.00 31.12 H new ATOM 0 HE2 MET A 102 5.013 0.741 0.252 1.00 31.12 H new ATOM 0 HE3 MET A 102 5.585 0.778 1.937 1.00 31.12 H new ATOM 1635 N ARG A 103 10.762 2.659 4.133 1.00 61.24 N ATOM 1636 CA ARG A 103 11.544 2.238 5.288 1.00 71.44 C ATOM 1637 C ARG A 103 11.307 3.129 6.505 1.00 4.42 C ATOM 1638 O ARG A 103 11.236 2.618 7.620 1.00 23.22 O ATOM 1639 CB ARG A 103 13.029 2.249 4.912 1.00 74.12 C ATOM 1640 CG ARG A 103 13.835 1.397 5.896 1.00 43.41 C ATOM 1641 CD ARG A 103 15.231 1.980 6.108 1.00 53.23 C ATOM 1642 NE ARG A 103 15.269 3.163 6.988 1.00 23.04 N ATOM 1643 CZ ARG A 103 14.991 3.199 8.301 1.00 51.04 C ATOM 1644 NH1 ARG A 103 14.504 2.148 8.947 1.00 44.14 N ATOM 1645 NH2 ARG A 103 15.186 4.311 8.998 1.00 1.31 N ATOM 0 H ARG A 103 11.328 2.833 3.303 1.00 61.24 H new ATOM 0 HA ARG A 103 11.227 1.232 5.564 1.00 71.44 H new ATOM 0 HB2 ARG A 103 13.157 1.866 3.900 1.00 74.12 H new ATOM 0 HB3 ARG A 103 13.404 3.272 4.915 1.00 74.12 H new ATOM 0 HG2 ARG A 103 13.311 1.343 6.850 1.00 43.41 H new ATOM 0 HG3 ARG A 103 13.916 0.378 5.519 1.00 43.41 H new ATOM 0 HD2 ARG A 103 15.874 1.208 6.530 1.00 53.23 H new ATOM 0 HD3 ARG A 103 15.650 2.250 5.139 1.00 53.23 H new ATOM 0 HE ARG A 103 15.534 4.047 6.553 1.00 23.04 H new ATOM 0 HH11 ARG A 103 14.329 1.277 8.446 1.00 44.14 H new ATOM 0 HH12 ARG A 103 14.304 2.211 9.945 1.00 44.14 H new ATOM 0 HH21 ARG A 103 15.549 5.145 8.537 1.00 1.31 H new ATOM 0 HH22 ARG A 103 14.973 4.332 9.995 1.00 1.31 H new ATOM 1659 N SER A 104 11.184 4.444 6.291 1.00 71.43 N ATOM 1660 CA SER A 104 10.893 5.431 7.332 1.00 64.23 C ATOM 1661 C SER A 104 9.712 5.036 8.229 1.00 64.35 C ATOM 1662 O SER A 104 9.720 5.355 9.422 1.00 13.45 O ATOM 1663 CB SER A 104 10.638 6.804 6.686 1.00 64.21 C ATOM 1664 OG SER A 104 11.489 7.796 7.235 1.00 51.15 O ATOM 0 H SER A 104 11.287 4.860 5.365 1.00 71.43 H new ATOM 0 HA SER A 104 11.767 5.478 7.981 1.00 64.23 H new ATOM 0 HB2 SER A 104 10.799 6.738 5.610 1.00 64.21 H new ATOM 0 HB3 SER A 104 9.597 7.091 6.835 1.00 64.21 H new ATOM 0 HG SER A 104 11.307 8.658 6.805 1.00 51.15 H new ATOM 1670 N LEU A 105 8.697 4.379 7.664 1.00 62.25 N ATOM 1671 CA LEU A 105 7.476 4.017 8.358 1.00 34.50 C ATOM 1672 C LEU A 105 7.785 3.031 9.486 1.00 30.44 C ATOM 1673 O LEU A 105 8.472 2.027 9.276 1.00 0.53 O ATOM 1674 CB LEU A 105 6.502 3.420 7.333 1.00 74.00 C ATOM 1675 CG LEU A 105 5.112 3.105 7.897 1.00 32.04 C ATOM 1676 CD1 LEU A 105 4.341 4.328 8.402 1.00 54.44 C ATOM 1677 CD2 LEU A 105 4.275 2.481 6.787 1.00 22.52 C ATOM 0 H LEU A 105 8.709 4.081 6.689 1.00 62.25 H new ATOM 0 HA LEU A 105 7.018 4.894 8.816 1.00 34.50 H new ATOM 0 HB2 LEU A 105 6.395 4.117 6.501 1.00 74.00 H new ATOM 0 HB3 LEU A 105 6.934 2.505 6.928 1.00 74.00 H new ATOM 0 HG LEU A 105 5.274 2.444 8.749 1.00 32.04 H new ATOM 0 HD11 LEU A 105 3.369 4.014 8.783 1.00 54.44 H new ATOM 0 HD12 LEU A 105 4.905 4.810 9.200 1.00 54.44 H new ATOM 0 HD13 LEU A 105 4.199 5.032 7.582 1.00 54.44 H new ATOM 0 HD21 LEU A 105 3.280 2.249 7.168 1.00 22.52 H new ATOM 0 HD22 LEU A 105 4.191 3.182 5.957 1.00 22.52 H new ATOM 0 HD23 LEU A 105 4.754 1.565 6.441 1.00 22.52 H new ATOM 1689 N LYS A 106 7.301 3.330 10.692 1.00 22.30 N ATOM 1690 CA LYS A 106 7.462 2.493 11.878 1.00 55.52 C ATOM 1691 C LYS A 106 6.498 1.316 11.859 1.00 22.15 C ATOM 1692 O LYS A 106 6.878 0.226 12.292 1.00 63.41 O ATOM 1693 CB LYS A 106 7.254 3.325 13.139 1.00 40.35 C ATOM 1694 CG LYS A 106 8.324 4.421 13.199 1.00 63.11 C ATOM 1695 CD LYS A 106 8.492 4.895 14.637 1.00 4.33 C ATOM 1696 CE LYS A 106 9.714 5.809 14.786 1.00 3.51 C ATOM 1697 NZ LYS A 106 10.977 5.098 14.479 1.00 51.54 N ATOM 0 H LYS A 106 6.773 4.183 10.874 1.00 22.30 H new ATOM 0 HA LYS A 106 8.477 2.095 11.875 1.00 55.52 H new ATOM 0 HB2 LYS A 106 6.259 3.770 13.136 1.00 40.35 H new ATOM 0 HB3 LYS A 106 7.316 2.690 14.023 1.00 40.35 H new ATOM 0 HG2 LYS A 106 9.271 4.039 12.819 1.00 63.11 H new ATOM 0 HG3 LYS A 106 8.038 5.257 12.561 1.00 63.11 H new ATOM 0 HD2 LYS A 106 7.596 5.429 14.953 1.00 4.33 H new ATOM 0 HD3 LYS A 106 8.598 4.033 15.296 1.00 4.33 H new ATOM 0 HE2 LYS A 106 9.609 6.666 14.121 1.00 3.51 H new ATOM 0 HE3 LYS A 106 9.754 6.198 15.803 1.00 3.51 H new ATOM 0 HZ1 LYS A 106 11.778 5.621 14.888 1.00 51.54 H new ATOM 0 HZ2 LYS A 106 10.944 4.141 14.885 1.00 51.54 H new ATOM 0 HZ3 LYS A 106 11.097 5.032 13.448 1.00 51.54 H new ATOM 1711 N ALA A 107 5.273 1.537 11.376 1.00 12.15 N ATOM 1712 CA ALA A 107 4.289 0.476 11.259 1.00 41.00 C ATOM 1713 C ALA A 107 4.800 -0.588 10.276 1.00 74.25 C ATOM 1714 O ALA A 107 5.428 -0.225 9.276 1.00 13.34 O ATOM 1715 CB ALA A 107 2.959 1.071 10.786 1.00 43.41 C ATOM 0 H ALA A 107 4.944 2.449 11.060 1.00 12.15 H new ATOM 0 HA ALA A 107 4.130 0.000 12.227 1.00 41.00 H new ATOM 0 HB1 ALA A 107 2.217 0.278 10.697 1.00 43.41 H new ATOM 0 HB2 ALA A 107 2.614 1.811 11.508 1.00 43.41 H new ATOM 0 HB3 ALA A 107 3.098 1.548 9.816 1.00 43.41 H new ATOM 1721 N PRO A 108 4.519 -1.880 10.517 1.00 30.45 N ATOM 1722 CA PRO A 108 5.009 -2.949 9.660 1.00 32.43 C ATOM 1723 C PRO A 108 4.221 -2.991 8.348 1.00 60.14 C ATOM 1724 O PRO A 108 3.008 -2.778 8.358 1.00 75.13 O ATOM 1725 CB PRO A 108 4.869 -4.225 10.495 1.00 52.02 C ATOM 1726 CG PRO A 108 3.713 -3.919 11.442 1.00 24.32 C ATOM 1727 CD PRO A 108 3.828 -2.416 11.683 1.00 71.42 C ATOM 0 HA PRO A 108 6.046 -2.810 9.355 1.00 32.43 H new ATOM 0 HB2 PRO A 108 4.654 -5.091 9.869 1.00 52.02 H new ATOM 0 HB3 PRO A 108 5.785 -4.447 11.042 1.00 52.02 H new ATOM 0 HG2 PRO A 108 2.752 -4.181 10.998 1.00 24.32 H new ATOM 0 HG3 PRO A 108 3.798 -4.481 12.372 1.00 24.32 H new ATOM 0 HD2 PRO A 108 2.844 -1.962 11.798 1.00 71.42 H new ATOM 0 HD3 PRO A 108 4.384 -2.208 12.597 1.00 71.42 H new ATOM 1735 N ALA A 109 4.891 -3.259 7.222 1.00 42.05 N ATOM 1736 CA ALA A 109 4.376 -2.998 5.891 1.00 35.21 C ATOM 1737 C ALA A 109 4.960 -4.020 4.912 1.00 43.40 C ATOM 1738 O ALA A 109 6.160 -4.319 4.940 1.00 13.21 O ATOM 1739 CB ALA A 109 4.761 -1.564 5.506 1.00 13.35 C ATOM 0 H ALA A 109 5.824 -3.671 7.220 1.00 42.05 H new ATOM 0 HA ALA A 109 3.291 -3.094 5.861 1.00 35.21 H new ATOM 0 HB1 ALA A 109 4.385 -1.342 4.507 1.00 13.35 H new ATOM 0 HB2 ALA A 109 4.326 -0.866 6.221 1.00 13.35 H new ATOM 0 HB3 ALA A 109 5.846 -1.464 5.516 1.00 13.35 H new ATOM 1745 N VAL A 110 4.101 -4.545 4.048 1.00 13.33 N ATOM 1746 CA VAL A 110 4.408 -5.539 3.023 1.00 4.35 C ATOM 1747 C VAL A 110 4.190 -4.912 1.645 1.00 52.10 C ATOM 1748 O VAL A 110 3.050 -4.623 1.266 1.00 72.31 O ATOM 1749 CB VAL A 110 3.574 -6.820 3.260 1.00 30.02 C ATOM 1750 CG1 VAL A 110 3.712 -7.838 2.114 1.00 71.33 C ATOM 1751 CG2 VAL A 110 4.061 -7.501 4.552 1.00 53.33 C ATOM 0 H VAL A 110 3.117 -4.275 4.042 1.00 13.33 H new ATOM 0 HA VAL A 110 5.452 -5.846 3.077 1.00 4.35 H new ATOM 0 HB VAL A 110 2.529 -6.515 3.325 1.00 30.02 H new ATOM 0 HG11 VAL A 110 3.106 -8.717 2.333 1.00 71.33 H new ATOM 0 HG12 VAL A 110 3.372 -7.386 1.183 1.00 71.33 H new ATOM 0 HG13 VAL A 110 4.756 -8.133 2.014 1.00 71.33 H new ATOM 0 HG21 VAL A 110 3.479 -8.406 4.728 1.00 53.33 H new ATOM 0 HG22 VAL A 110 5.115 -7.761 4.451 1.00 53.33 H new ATOM 0 HG23 VAL A 110 3.935 -6.819 5.393 1.00 53.33 H new ATOM 1761 N VAL A 111 5.271 -4.708 0.886 1.00 1.42 N ATOM 1762 CA VAL A 111 5.199 -4.158 -0.467 1.00 61.25 C ATOM 1763 C VAL A 111 5.489 -5.269 -1.467 1.00 45.44 C ATOM 1764 O VAL A 111 6.128 -6.259 -1.116 1.00 21.14 O ATOM 1765 CB VAL A 111 6.117 -2.922 -0.649 1.00 44.22 C ATOM 1766 CG1 VAL A 111 6.050 -1.928 0.517 1.00 32.00 C ATOM 1767 CG2 VAL A 111 7.586 -3.247 -0.928 1.00 13.44 C ATOM 0 H VAL A 111 6.220 -4.920 1.194 1.00 1.42 H new ATOM 0 HA VAL A 111 4.192 -3.784 -0.650 1.00 61.25 H new ATOM 0 HB VAL A 111 5.700 -2.457 -1.543 1.00 44.22 H new ATOM 0 HG11 VAL A 111 6.718 -1.090 0.319 1.00 32.00 H new ATOM 0 HG12 VAL A 111 5.029 -1.561 0.624 1.00 32.00 H new ATOM 0 HG13 VAL A 111 6.355 -2.426 1.437 1.00 32.00 H new ATOM 0 HG21 VAL A 111 8.149 -2.320 -1.040 1.00 13.44 H new ATOM 0 HG22 VAL A 111 7.996 -3.822 -0.097 1.00 13.44 H new ATOM 0 HG23 VAL A 111 7.662 -3.831 -1.845 1.00 13.44 H new ATOM 1777 N SER A 112 5.081 -5.098 -2.723 1.00 23.42 N ATOM 1778 CA SER A 112 5.300 -6.082 -3.762 1.00 64.55 C ATOM 1779 C SER A 112 5.937 -5.414 -4.974 1.00 3.12 C ATOM 1780 O SER A 112 5.720 -4.227 -5.257 1.00 54.31 O ATOM 1781 CB SER A 112 3.985 -6.803 -4.091 1.00 25.41 C ATOM 1782 OG SER A 112 4.254 -7.909 -4.917 1.00 4.14 O ATOM 0 H SER A 112 4.587 -4.265 -3.043 1.00 23.42 H new ATOM 0 HA SER A 112 5.996 -6.847 -3.417 1.00 64.55 H new ATOM 0 HB2 SER A 112 3.497 -7.131 -3.173 1.00 25.41 H new ATOM 0 HB3 SER A 112 3.298 -6.120 -4.591 1.00 25.41 H new ATOM 0 HG SER A 112 3.467 -8.106 -5.466 1.00 4.14 H new ATOM 1788 N VAL A 113 6.722 -6.197 -5.703 1.00 4.34 N ATOM 1789 CA VAL A 113 7.428 -5.807 -6.908 1.00 65.42 C ATOM 1790 C VAL A 113 7.282 -6.923 -7.951 1.00 5.34 C ATOM 1791 O VAL A 113 6.744 -7.991 -7.658 1.00 43.42 O ATOM 1792 CB VAL A 113 8.910 -5.537 -6.605 1.00 44.41 C ATOM 1793 CG1 VAL A 113 9.112 -4.226 -5.831 1.00 42.44 C ATOM 1794 CG2 VAL A 113 9.606 -6.681 -5.851 1.00 4.33 C ATOM 0 H VAL A 113 6.889 -7.172 -5.453 1.00 4.34 H new ATOM 0 HA VAL A 113 6.998 -4.885 -7.300 1.00 65.42 H new ATOM 0 HB VAL A 113 9.378 -5.455 -7.586 1.00 44.41 H new ATOM 0 HG11 VAL A 113 10.175 -4.077 -5.639 1.00 42.44 H new ATOM 0 HG12 VAL A 113 8.729 -3.393 -6.420 1.00 42.44 H new ATOM 0 HG13 VAL A 113 8.576 -4.277 -4.883 1.00 42.44 H new ATOM 0 HG21 VAL A 113 10.649 -6.418 -5.673 1.00 4.33 H new ATOM 0 HG22 VAL A 113 9.105 -6.846 -4.897 1.00 4.33 H new ATOM 0 HG23 VAL A 113 9.558 -7.592 -6.448 1.00 4.33 H new ATOM 1804 N SER A 114 7.765 -6.684 -9.172 1.00 73.41 N ATOM 1805 CA SER A 114 7.204 -7.362 -10.324 1.00 1.35 C ATOM 1806 C SER A 114 7.770 -8.758 -10.646 1.00 73.22 C ATOM 1807 O SER A 114 7.246 -9.420 -11.543 1.00 72.53 O ATOM 1808 CB SER A 114 7.250 -6.413 -11.521 1.00 33.53 C ATOM 1809 OG SER A 114 8.575 -6.104 -11.914 1.00 3.32 O ATOM 0 H SER A 114 8.527 -6.039 -9.379 1.00 73.41 H new ATOM 0 HA SER A 114 6.173 -7.602 -10.064 1.00 1.35 H new ATOM 0 HB2 SER A 114 6.721 -6.865 -12.360 1.00 33.53 H new ATOM 0 HB3 SER A 114 6.724 -5.492 -11.271 1.00 33.53 H new ATOM 0 HG SER A 114 8.555 -5.497 -12.683 1.00 3.32 H new ATOM 1815 N SER A 115 8.824 -9.217 -9.964 1.00 11.15 N ATOM 1816 CA SER A 115 9.377 -10.567 -10.081 1.00 11.45 C ATOM 1817 C SER A 115 10.172 -10.903 -8.811 1.00 42.42 C ATOM 1818 O SER A 115 10.597 -9.982 -8.107 1.00 33.25 O ATOM 1819 CB SER A 115 10.281 -10.671 -11.321 1.00 72.43 C ATOM 1820 OG SER A 115 9.526 -11.005 -12.471 1.00 43.04 O ATOM 0 H SER A 115 9.331 -8.639 -9.294 1.00 11.15 H new ATOM 0 HA SER A 115 8.561 -11.280 -10.194 1.00 11.45 H new ATOM 0 HB2 SER A 115 10.795 -9.723 -11.481 1.00 72.43 H new ATOM 0 HB3 SER A 115 11.049 -11.426 -11.154 1.00 72.43 H new ATOM 0 HG SER A 115 8.646 -10.577 -12.420 1.00 43.04 H new ATOM 1826 N PRO A 116 10.419 -12.194 -8.516 1.00 32.03 N ATOM 1827 CA PRO A 116 10.992 -12.628 -7.245 1.00 12.53 C ATOM 1828 C PRO A 116 12.404 -12.098 -6.978 1.00 31.02 C ATOM 1829 O PRO A 116 12.761 -11.884 -5.823 1.00 40.32 O ATOM 1830 CB PRO A 116 10.956 -14.156 -7.252 1.00 34.23 C ATOM 1831 CG PRO A 116 10.828 -14.521 -8.721 1.00 70.01 C ATOM 1832 CD PRO A 116 10.028 -13.358 -9.297 1.00 45.21 C ATOM 0 HA PRO A 116 10.402 -12.212 -6.428 1.00 12.53 H new ATOM 0 HB2 PRO A 116 11.861 -14.577 -6.815 1.00 34.23 H new ATOM 0 HB3 PRO A 116 10.115 -14.537 -6.673 1.00 34.23 H new ATOM 0 HG2 PRO A 116 11.803 -14.616 -9.199 1.00 70.01 H new ATOM 0 HG3 PRO A 116 10.312 -15.472 -8.857 1.00 70.01 H new ATOM 0 HD2 PRO A 116 10.250 -13.214 -10.354 1.00 45.21 H new ATOM 0 HD3 PRO A 116 8.956 -13.542 -9.219 1.00 45.21 H new ATOM 1840 N ASP A 117 13.216 -11.855 -8.004 1.00 70.54 N ATOM 1841 CA ASP A 117 14.595 -11.413 -7.791 1.00 5.23 C ATOM 1842 C ASP A 117 14.625 -9.938 -7.349 1.00 63.24 C ATOM 1843 O ASP A 117 15.529 -9.495 -6.632 1.00 22.34 O ATOM 1844 CB ASP A 117 15.422 -11.628 -9.066 1.00 42.54 C ATOM 1845 CG ASP A 117 15.311 -13.067 -9.585 1.00 12.24 C ATOM 1846 OD1 ASP A 117 15.835 -13.987 -8.922 1.00 54.22 O ATOM 1847 OD2 ASP A 117 14.621 -13.275 -10.610 1.00 63.33 O ATOM 0 H ASP A 117 12.948 -11.955 -8.983 1.00 70.54 H new ATOM 0 HA ASP A 117 15.039 -12.009 -6.994 1.00 5.23 H new ATOM 0 HB2 ASP A 117 15.085 -10.937 -9.838 1.00 42.54 H new ATOM 0 HB3 ASP A 117 16.467 -11.395 -8.864 1.00 42.54 H new ATOM 1852 N ALA A 118 13.596 -9.159 -7.712 1.00 22.33 N ATOM 1853 CA ALA A 118 13.475 -7.767 -7.294 1.00 74.43 C ATOM 1854 C ALA A 118 13.139 -7.663 -5.801 1.00 5.41 C ATOM 1855 O ALA A 118 13.371 -6.623 -5.189 1.00 42.35 O ATOM 1856 CB ALA A 118 12.425 -7.047 -8.144 1.00 75.10 C ATOM 0 H ALA A 118 12.829 -9.481 -8.302 1.00 22.33 H new ATOM 0 HA ALA A 118 14.438 -7.279 -7.448 1.00 74.43 H new ATOM 0 HB1 ALA A 118 12.345 -6.009 -7.821 1.00 75.10 H new ATOM 0 HB2 ALA A 118 12.721 -7.079 -9.192 1.00 75.10 H new ATOM 0 HB3 ALA A 118 11.460 -7.540 -8.024 1.00 75.10 H new ATOM 1862 N VAL A 119 12.614 -8.730 -5.200 1.00 25.14 N ATOM 1863 CA VAL A 119 12.113 -8.761 -3.833 1.00 73.51 C ATOM 1864 C VAL A 119 13.265 -8.534 -2.859 1.00 42.33 C ATOM 1865 O VAL A 119 13.195 -7.672 -1.978 1.00 44.51 O ATOM 1866 CB VAL A 119 11.416 -10.115 -3.601 1.00 14.21 C ATOM 1867 CG1 VAL A 119 10.708 -10.205 -2.248 1.00 24.14 C ATOM 1868 CG2 VAL A 119 10.298 -10.319 -4.635 1.00 74.34 C ATOM 0 H VAL A 119 12.524 -9.629 -5.673 1.00 25.14 H new ATOM 0 HA VAL A 119 11.387 -7.965 -3.665 1.00 73.51 H new ATOM 0 HB VAL A 119 12.212 -10.857 -3.667 1.00 14.21 H new ATOM 0 HG11 VAL A 119 10.238 -11.183 -2.148 1.00 24.14 H new ATOM 0 HG12 VAL A 119 11.435 -10.068 -1.447 1.00 24.14 H new ATOM 0 HG13 VAL A 119 9.946 -9.428 -2.184 1.00 24.14 H new ATOM 0 HG21 VAL A 119 9.812 -11.279 -4.461 1.00 74.34 H new ATOM 0 HG22 VAL A 119 9.564 -9.519 -4.540 1.00 74.34 H new ATOM 0 HG23 VAL A 119 10.723 -10.304 -5.638 1.00 74.34 H new ATOM 1878 N THR A 120 14.332 -9.318 -3.004 1.00 42.45 N ATOM 1879 CA THR A 120 15.541 -9.147 -2.223 1.00 1.13 C ATOM 1880 C THR A 120 16.183 -7.808 -2.572 1.00 61.22 C ATOM 1881 O THR A 120 16.588 -7.089 -1.666 1.00 73.15 O ATOM 1882 CB THR A 120 16.484 -10.322 -2.484 1.00 2.11 C ATOM 1883 OG1 THR A 120 15.816 -11.548 -2.259 1.00 75.23 O ATOM 1884 CG2 THR A 120 17.708 -10.248 -1.560 1.00 42.13 C ATOM 0 H THR A 120 14.376 -10.090 -3.670 1.00 42.45 H new ATOM 0 HA THR A 120 15.310 -9.137 -1.158 1.00 1.13 H new ATOM 0 HB THR A 120 16.809 -10.266 -3.523 1.00 2.11 H new ATOM 0 HG1 THR A 120 16.430 -12.292 -2.431 1.00 75.23 H new ATOM 0 HG21 THR A 120 18.367 -11.093 -1.761 1.00 42.13 H new ATOM 0 HG22 THR A 120 18.245 -9.317 -1.742 1.00 42.13 H new ATOM 0 HG23 THR A 120 17.382 -10.282 -0.521 1.00 42.13 H new ATOM 1892 N THR A 121 16.240 -7.459 -3.860 1.00 13.12 N ATOM 1893 CA THR A 121 16.889 -6.247 -4.342 1.00 72.14 C ATOM 1894 C THR A 121 16.306 -5.017 -3.626 1.00 43.24 C ATOM 1895 O THR A 121 17.052 -4.242 -3.031 1.00 62.41 O ATOM 1896 CB THR A 121 16.753 -6.206 -5.878 1.00 3.51 C ATOM 1897 OG1 THR A 121 17.255 -7.403 -6.456 1.00 62.04 O ATOM 1898 CG2 THR A 121 17.509 -5.041 -6.517 1.00 2.30 C ATOM 0 H THR A 121 15.829 -8.022 -4.605 1.00 13.12 H new ATOM 0 HA THR A 121 17.954 -6.240 -4.109 1.00 72.14 H new ATOM 0 HB THR A 121 15.687 -6.084 -6.073 1.00 3.51 H new ATOM 0 HG1 THR A 121 16.559 -8.093 -6.436 1.00 62.04 H new ATOM 0 HG21 THR A 121 17.373 -5.069 -7.598 1.00 2.30 H new ATOM 0 HG22 THR A 121 17.123 -4.099 -6.127 1.00 2.30 H new ATOM 0 HG23 THR A 121 18.570 -5.123 -6.282 1.00 2.30 H new ATOM 1906 N TYR A 122 14.976 -4.878 -3.625 1.00 0.00 N ATOM 1907 CA TYR A 122 14.260 -3.784 -2.987 1.00 14.14 C ATOM 1908 C TYR A 122 14.560 -3.734 -1.490 1.00 22.32 C ATOM 1909 O TYR A 122 14.942 -2.691 -0.971 1.00 60.41 O ATOM 1910 CB TYR A 122 12.757 -3.966 -3.225 1.00 52.11 C ATOM 1911 CG TYR A 122 11.908 -2.765 -2.845 1.00 2.32 C ATOM 1912 CD1 TYR A 122 11.493 -2.537 -1.516 1.00 61.41 C ATOM 1913 CD2 TYR A 122 11.553 -1.844 -3.845 1.00 63.03 C ATOM 1914 CE1 TYR A 122 10.752 -1.385 -1.198 1.00 64.05 C ATOM 1915 CE2 TYR A 122 10.852 -0.669 -3.530 1.00 2.11 C ATOM 1916 CZ TYR A 122 10.458 -0.432 -2.196 1.00 23.54 C ATOM 1917 OH TYR A 122 9.804 0.712 -1.866 1.00 43.51 O ATOM 0 H TYR A 122 14.356 -5.546 -4.083 1.00 0.00 H new ATOM 0 HA TYR A 122 14.589 -2.840 -3.422 1.00 14.14 H new ATOM 0 HB2 TYR A 122 12.594 -4.191 -4.279 1.00 52.11 H new ATOM 0 HB3 TYR A 122 12.414 -4.831 -2.657 1.00 52.11 H new ATOM 0 HD1 TYR A 122 11.745 -3.248 -0.743 1.00 61.41 H new ATOM 0 HD2 TYR A 122 11.823 -2.043 -4.871 1.00 63.03 H new ATOM 0 HE1 TYR A 122 10.407 -1.229 -0.187 1.00 64.05 H new ATOM 0 HE2 TYR A 122 10.616 0.048 -4.303 1.00 2.11 H new ATOM 0 HH TYR A 122 9.889 1.360 -2.597 1.00 43.51 H new ATOM 1927 N ASN A 123 14.384 -4.855 -0.781 1.00 24.54 N ATOM 1928 CA ASN A 123 14.604 -4.924 0.670 1.00 11.10 C ATOM 1929 C ASN A 123 16.070 -4.643 1.009 1.00 31.41 C ATOM 1930 O ASN A 123 16.364 -4.097 2.068 1.00 60.24 O ATOM 1931 CB ASN A 123 14.235 -6.326 1.201 1.00 20.00 C ATOM 1932 CG ASN A 123 13.048 -6.388 2.159 1.00 41.51 C ATOM 1933 OD1 ASN A 123 12.628 -5.396 2.748 1.00 42.43 O ATOM 1934 ND2 ASN A 123 12.450 -7.563 2.288 1.00 1.01 N ATOM 0 H ASN A 123 14.086 -5.738 -1.195 1.00 24.54 H new ATOM 0 HA ASN A 123 13.971 -4.171 1.139 1.00 11.10 H new ATOM 0 HB2 ASN A 123 14.022 -6.971 0.349 1.00 20.00 H new ATOM 0 HB3 ASN A 123 15.106 -6.742 1.706 1.00 20.00 H new ATOM 0 HD21 ASN A 123 11.627 -7.654 2.884 1.00 1.01 H new ATOM 0 HD22 ASN A 123 12.812 -8.377 1.791 1.00 1.01 H new ATOM 1941 N GLY A 124 17.002 -4.967 0.115 1.00 33.43 N ATOM 1942 CA GLY A 124 18.397 -4.610 0.272 1.00 73.31 C ATOM 1943 C GLY A 124 18.582 -3.097 0.341 1.00 11.22 C ATOM 1944 O GLY A 124 19.511 -2.635 0.998 1.00 24.43 O ATOM 0 H GLY A 124 16.803 -5.487 -0.740 1.00 33.43 H new ATOM 0 HA2 GLY A 124 18.791 -5.068 1.179 1.00 73.31 H new ATOM 0 HA3 GLY A 124 18.972 -5.010 -0.563 1.00 73.31 H new ATOM 1948 N TYR A 125 17.719 -2.304 -0.296 1.00 21.43 N ATOM 1949 CA TYR A 125 17.753 -0.852 -0.175 1.00 74.35 C ATOM 1950 C TYR A 125 17.135 -0.369 1.133 1.00 54.13 C ATOM 1951 O TYR A 125 17.510 0.704 1.607 1.00 54.33 O ATOM 1952 CB TYR A 125 17.107 -0.213 -1.408 1.00 12.21 C ATOM 1953 CG TYR A 125 17.774 -0.644 -2.706 1.00 15.53 C ATOM 1954 CD1 TYR A 125 19.173 -0.620 -2.797 1.00 71.53 C ATOM 1955 CD2 TYR A 125 17.021 -1.024 -3.831 1.00 52.35 C ATOM 1956 CE1 TYR A 125 19.824 -1.183 -3.900 1.00 43.04 C ATOM 1957 CE2 TYR A 125 17.669 -1.475 -5.001 1.00 43.42 C ATOM 1958 CZ TYR A 125 19.077 -1.640 -5.002 1.00 52.43 C ATOM 1959 OH TYR A 125 19.752 -2.232 -6.028 1.00 53.22 O ATOM 0 H TYR A 125 16.981 -2.652 -0.907 1.00 21.43 H new ATOM 0 HA TYR A 125 18.794 -0.531 -0.138 1.00 74.35 H new ATOM 0 HB2 TYR A 125 16.051 -0.480 -1.440 1.00 12.21 H new ATOM 0 HB3 TYR A 125 17.159 0.872 -1.320 1.00 12.21 H new ATOM 0 HD1 TYR A 125 19.753 -0.163 -2.009 1.00 71.53 H new ATOM 0 HD2 TYR A 125 15.943 -0.971 -3.800 1.00 52.35 H new ATOM 0 HE1 TYR A 125 20.901 -1.267 -3.906 1.00 43.04 H new ATOM 0 HE2 TYR A 125 17.096 -1.693 -5.890 1.00 43.42 H new ATOM 0 HH TYR A 125 19.117 -2.502 -6.724 1.00 53.22 H new ATOM 1969 N LEU A 126 16.262 -1.162 1.766 1.00 11.22 N ATOM 1970 CA LEU A 126 15.832 -0.906 3.134 1.00 23.41 C ATOM 1971 C LEU A 126 17.005 -1.091 4.104 1.00 14.24 C ATOM 1972 O LEU A 126 17.069 -0.374 5.101 1.00 52.11 O ATOM 1973 CB LEU A 126 14.623 -1.771 3.548 1.00 73.54 C ATOM 1974 CG LEU A 126 13.309 -1.244 2.949 1.00 71.23 C ATOM 1975 CD1 LEU A 126 12.966 -1.719 1.550 1.00 62.15 C ATOM 1976 CD2 LEU A 126 12.124 -1.538 3.858 1.00 62.34 C ATOM 0 H LEU A 126 15.841 -1.990 1.344 1.00 11.22 H new ATOM 0 HA LEU A 126 15.497 0.130 3.180 1.00 23.41 H new ATOM 0 HB2 LEU A 126 14.784 -2.799 3.223 1.00 73.54 H new ATOM 0 HB3 LEU A 126 14.545 -1.789 4.635 1.00 73.54 H new ATOM 0 HG LEU A 126 13.498 -0.174 2.868 1.00 71.23 H new ATOM 0 HD11 LEU A 126 12.018 -1.280 1.239 1.00 62.15 H new ATOM 0 HD12 LEU A 126 13.752 -1.414 0.859 1.00 62.15 H new ATOM 0 HD13 LEU A 126 12.881 -2.806 1.545 1.00 62.15 H new ATOM 0 HD21 LEU A 126 11.212 -1.151 3.403 1.00 62.34 H new ATOM 0 HD22 LEU A 126 12.031 -2.615 3.998 1.00 62.34 H new ATOM 0 HD23 LEU A 126 12.279 -1.058 4.824 1.00 62.34 H new ATOM 1988 N THR A 127 17.915 -2.037 3.851 1.00 22.02 N ATOM 1989 CA THR A 127 18.974 -2.384 4.793 1.00 42.55 C ATOM 1990 C THR A 127 20.075 -3.174 4.063 1.00 41.31 C ATOM 1991 O THR A 127 19.867 -4.333 3.683 1.00 43.31 O ATOM 1992 CB THR A 127 18.364 -3.108 6.022 1.00 4.11 C ATOM 1993 OG1 THR A 127 19.341 -3.829 6.749 1.00 2.01 O ATOM 1994 CG2 THR A 127 17.235 -4.107 5.705 1.00 1.31 C ATOM 0 H THR A 127 17.935 -2.581 2.988 1.00 22.02 H new ATOM 0 HA THR A 127 19.460 -1.491 5.187 1.00 42.55 H new ATOM 0 HB THR A 127 17.946 -2.284 6.600 1.00 4.11 H new ATOM 0 HG1 THR A 127 18.919 -4.270 7.516 1.00 2.01 H new ATOM 0 HG21 THR A 127 16.878 -4.558 6.631 1.00 1.31 H new ATOM 0 HG22 THR A 127 16.413 -3.584 5.215 1.00 1.31 H new ATOM 0 HG23 THR A 127 17.614 -4.887 5.044 1.00 1.31 H new ATOM 2002 N SER A 128 21.263 -2.585 3.889 1.00 14.34 N ATOM 2003 CA SER A 128 22.450 -3.242 3.356 1.00 1.42 C ATOM 2004 C SER A 128 23.691 -2.653 4.028 1.00 54.30 C ATOM 2005 O SER A 128 24.107 -1.545 3.685 1.00 44.41 O ATOM 2006 CB SER A 128 22.470 -3.104 1.830 1.00 41.41 C ATOM 2007 OG SER A 128 23.648 -3.626 1.248 1.00 53.12 O ATOM 0 H SER A 128 21.425 -1.606 4.125 1.00 14.34 H new ATOM 0 HA SER A 128 22.438 -4.310 3.576 1.00 1.42 H new ATOM 0 HB2 SER A 128 21.605 -3.619 1.412 1.00 41.41 H new ATOM 0 HB3 SER A 128 22.374 -2.051 1.564 1.00 41.41 H new ATOM 0 HG SER A 128 23.609 -3.515 0.275 1.00 53.12 H new ATOM 2013 N SER A 129 24.277 -3.432 4.946 1.00 72.54 N ATOM 2014 CA SER A 129 25.322 -3.049 5.892 1.00 30.10 C ATOM 2015 C SER A 129 24.860 -1.932 6.825 1.00 41.01 C ATOM 2016 O SER A 129 24.584 -2.263 7.997 1.00 62.34 O ATOM 2017 CB SER A 129 26.635 -2.704 5.195 1.00 23.12 C ATOM 2018 OG SER A 129 27.068 -3.759 4.335 1.00 41.43 O ATOM 0 H SER A 129 24.013 -4.412 5.051 1.00 72.54 H new ATOM 0 HA SER A 129 25.520 -3.923 6.512 1.00 30.10 H new ATOM 0 HB2 SER A 129 26.510 -1.789 4.615 1.00 23.12 H new ATOM 0 HB3 SER A 129 27.403 -2.505 5.943 1.00 23.12 H new ATOM 0 HG SER A 129 27.910 -3.504 3.903 1.00 41.43 H new TER 2024 SER A 129