USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1090 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 72 THR OG1 : rot 77:sc= 1.35 USER MOD Set 1.2: A 119 ASN : amide:sc= -1.76 K(o=-0.41,f=-1!) USER MOD Set 2.1: A 87 MET CE :methyl 165:sc= -3.49! (180deg=-3.63!) USER MOD Set 2.2: A 91 GLN : amide:sc= -0.262 K(o=-4.5,f=-5.3) USER MOD Set 2.3: A 106 MET CE :methyl -172:sc= -0.723 (180deg=-1.15) USER MOD Set 3.1: A 25 LYS NZ :NH3+ -169:sc= -0.0443 (180deg=0) USER MOD Set 3.2: A 111 HIS :FLIP no HD1:sc= -0.0694 F(o=-1.2,f=-0.11) USER MOD Single : A 1 ALA N :NH3+ -117:sc= 0.078 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= -0.14 K(o=-0.14,f=-1.9!) USER MOD Single : A 6 THR OG1 : rot -77:sc= 0.599 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 MET CE :methyl 150:sc= -0.253 (180deg=-0.988) USER MOD Single : A 26 ASN :FLIP amide:sc=-0.00993 F(o=-1.3,f=-0.0099) USER MOD Single : A 29 SER OG : rot -59:sc= 0.00191 USER MOD Single : A 30 GLN : amide:sc= -0.229 X(o=-0.23,f=0) USER MOD Single : A 36 TYR OH : rot 0:sc= -0.216 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -0.783 X(o=-0.78,f=-0.5) USER MOD Single : A 46 THR OG1 : rot -160:sc= -0.804 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot -61:sc= -0.202! USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= -0.13 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0.036 USER MOD Single : A 73 GLN : amide:sc= -4.02 K(o=-4,f=-11!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 ASN : amide:sc= -0.0028 X(o=-0.0028,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= -0.232 X(o=-0.23,f=-0.0097) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 GLN : amide:sc= -3.78! C(o=-3.8!,f=-8.5!) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.0191 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= -0.468 X(o=-0.47,f=-0.37) USER MOD Single : A 108 THR OG1 : rot 65:sc= 0.0272 USER MOD Single : A 110 SER OG : rot -51:sc= -2.65! USER MOD Single : A 112 THR OG1 : rot 180:sc=-0.00932 USER MOD Single : A 118 LYS NZ :NH3+ -110:sc= -0.359 (180deg=-1.7!) USER MOD Single : A 126 GLN : amide:sc= -0.601 X(o=-0.6,f=-0.17) USER MOD Single : A 128 LYS NZ :NH3+ -168:sc= -0.641 (180deg=-0.945) USER MOD Single : A 132 ASN : amide:sc= -0.105 X(o=-0.1,f=0) USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=-0.0096) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 7.439 -13.098 3.383 1.00 10.12 N ATOM 2 CA ALA A 1 7.954 -12.845 2.043 1.00 34.30 C ATOM 3 C ALA A 1 8.913 -11.660 2.038 1.00 60.03 C ATOM 4 O ALA A 1 8.951 -10.876 2.985 1.00 71.01 O ATOM 5 CB ALA A 1 6.806 -12.602 1.074 1.00 31.12 C ATOM 0 H1 ALA A 1 7.746 -14.040 3.701 1.00 10.12 H new ATOM 0 H2 ALA A 1 7.804 -12.376 4.037 1.00 10.12 H new ATOM 0 H3 ALA A 1 6.400 -13.059 3.369 1.00 10.12 H new ATOM 0 HA ALA A 1 8.507 -13.727 1.720 1.00 34.30 H new ATOM 0 HB1 ALA A 1 7.205 -12.414 0.077 1.00 31.12 H new ATOM 0 HB2 ALA A 1 6.160 -13.480 1.047 1.00 31.12 H new ATOM 0 HB3 ALA A 1 6.229 -11.737 1.403 1.00 31.12 H new ATOM 11 N ASN A 2 9.687 -11.536 0.965 1.00 64.34 N ATOM 12 CA ASN A 2 10.648 -10.447 0.837 1.00 4.31 C ATOM 13 C ASN A 2 10.524 -9.768 -0.524 1.00 22.32 C ATOM 14 O ASN A 2 10.740 -10.393 -1.563 1.00 75.13 O ATOM 15 CB ASN A 2 12.073 -10.970 1.030 1.00 20.24 C ATOM 16 CG ASN A 2 13.065 -9.858 1.310 1.00 51.43 C ATOM 17 OD1 ASN A 2 13.141 -8.878 0.568 1.00 64.35 O ATOM 18 ND2 ASN A 2 13.831 -10.004 2.385 1.00 71.05 N ATOM 0 H ASN A 2 9.667 -12.176 0.171 1.00 64.34 H new ATOM 0 HA ASN A 2 10.430 -9.712 1.611 1.00 4.31 H new ATOM 0 HB2 ASN A 2 12.087 -11.682 1.855 1.00 20.24 H new ATOM 0 HB3 ASN A 2 12.382 -11.512 0.136 1.00 20.24 H new ATOM 0 HD21 ASN A 2 14.516 -9.287 2.624 1.00 71.05 H new ATOM 0 HD22 ASN A 2 13.734 -10.833 2.972 1.00 71.05 H new ATOM 25 N LEU A 3 10.176 -8.486 -0.510 1.00 23.31 N ATOM 26 CA LEU A 3 10.024 -7.722 -1.743 1.00 11.52 C ATOM 27 C LEU A 3 11.014 -6.562 -1.790 1.00 72.02 C ATOM 28 O LEU A 3 10.687 -5.438 -1.408 1.00 64.10 O ATOM 29 CB LEU A 3 8.594 -7.192 -1.864 1.00 0.40 C ATOM 30 CG LEU A 3 7.484 -8.242 -1.828 1.00 74.22 C ATOM 31 CD1 LEU A 3 6.217 -7.660 -1.220 1.00 24.05 C ATOM 32 CD2 LEU A 3 7.209 -8.776 -3.227 1.00 11.43 C ATOM 0 H LEU A 3 9.994 -7.954 0.341 1.00 23.31 H new ATOM 0 HA LEU A 3 10.231 -8.387 -2.582 1.00 11.52 H new ATOM 0 HB2 LEU A 3 8.421 -6.482 -1.055 1.00 0.40 H new ATOM 0 HB3 LEU A 3 8.511 -6.637 -2.798 1.00 0.40 H new ATOM 0 HG LEU A 3 7.815 -9.071 -1.202 1.00 74.22 H new ATOM 0 HD11 LEU A 3 5.438 -8.422 -1.203 1.00 24.05 H new ATOM 0 HD12 LEU A 3 6.421 -7.327 -0.202 1.00 24.05 H new ATOM 0 HD13 LEU A 3 5.882 -6.813 -1.818 1.00 24.05 H new ATOM 0 HD21 LEU A 3 6.416 -9.522 -3.182 1.00 11.43 H new ATOM 0 HD22 LEU A 3 6.899 -7.956 -3.875 1.00 11.43 H new ATOM 0 HD23 LEU A 3 8.115 -9.232 -3.627 1.00 11.43 H new ATOM 44 N ASP A 4 12.223 -6.842 -2.263 1.00 60.42 N ATOM 45 CA ASP A 4 13.260 -5.822 -2.364 1.00 61.21 C ATOM 46 C ASP A 4 13.193 -5.111 -3.712 1.00 65.11 C ATOM 47 O ASP A 4 12.337 -5.414 -4.543 1.00 50.20 O ATOM 48 CB ASP A 4 14.642 -6.449 -2.172 1.00 1.53 C ATOM 49 CG ASP A 4 14.831 -7.702 -3.004 1.00 12.41 C ATOM 50 OD1 ASP A 4 15.264 -7.581 -4.169 1.00 50.32 O ATOM 51 OD2 ASP A 4 14.546 -8.803 -2.490 1.00 21.22 O ATOM 0 H ASP A 4 12.509 -7.767 -2.583 1.00 60.42 H new ATOM 0 HA ASP A 4 13.091 -5.087 -1.577 1.00 61.21 H new ATOM 0 HB2 ASP A 4 15.408 -5.721 -2.438 1.00 1.53 H new ATOM 0 HB3 ASP A 4 14.785 -6.691 -1.119 1.00 1.53 H new ATOM 56 N ARG A 5 14.102 -4.164 -3.921 1.00 41.03 N ATOM 57 CA ARG A 5 14.145 -3.408 -5.167 1.00 71.23 C ATOM 58 C ARG A 5 15.515 -3.527 -5.828 1.00 41.42 C ATOM 59 O ARG A 5 16.394 -2.691 -5.615 1.00 24.23 O ATOM 60 CB ARG A 5 13.818 -1.937 -4.907 1.00 54.44 C ATOM 61 CG ARG A 5 14.544 -1.354 -3.706 1.00 44.13 C ATOM 62 CD ARG A 5 13.734 -1.520 -2.430 1.00 60.44 C ATOM 63 NE ARG A 5 14.129 -0.562 -1.402 1.00 3.30 N ATOM 64 CZ ARG A 5 13.589 -0.520 -0.189 1.00 73.13 C ATOM 65 NH1 ARG A 5 12.636 -1.379 0.145 1.00 33.01 N ATOM 66 NH2 ARG A 5 14.002 0.382 0.692 1.00 72.20 N ATOM 0 H ARG A 5 14.818 -3.902 -3.244 1.00 41.03 H new ATOM 0 HA ARG A 5 13.398 -3.825 -5.842 1.00 71.23 H new ATOM 0 HB2 ARG A 5 14.073 -1.355 -5.793 1.00 54.44 H new ATOM 0 HB3 ARG A 5 12.743 -1.834 -4.756 1.00 54.44 H new ATOM 0 HG2 ARG A 5 15.511 -1.844 -3.591 1.00 44.13 H new ATOM 0 HG3 ARG A 5 14.742 -0.296 -3.878 1.00 44.13 H new ATOM 0 HD2 ARG A 5 12.675 -1.395 -2.654 1.00 60.44 H new ATOM 0 HD3 ARG A 5 13.861 -2.533 -2.049 1.00 60.44 H new ATOM 0 HE ARG A 5 14.860 0.113 -1.627 1.00 3.30 H new ATOM 0 HH11 ARG A 5 12.316 -2.074 -0.530 1.00 33.01 H new ATOM 0 HH12 ARG A 5 12.223 -1.345 1.077 1.00 33.01 H new ATOM 0 HH21 ARG A 5 14.735 1.044 0.438 1.00 72.20 H new ATOM 0 HH22 ARG A 5 13.586 0.413 1.623 1.00 72.20 H new ATOM 80 N THR A 6 15.691 -4.571 -6.632 1.00 55.11 N ATOM 81 CA THR A 6 16.953 -4.800 -7.323 1.00 22.22 C ATOM 82 C THR A 6 16.722 -5.382 -8.713 1.00 30.14 C ATOM 83 O THR A 6 15.581 -5.573 -9.134 1.00 41.32 O ATOM 84 CB THR A 6 17.865 -5.752 -6.525 1.00 41.34 C ATOM 85 OG1 THR A 6 17.133 -6.919 -6.135 1.00 42.10 O ATOM 86 CG2 THR A 6 18.422 -5.059 -5.291 1.00 32.45 C ATOM 0 H THR A 6 14.974 -5.272 -6.820 1.00 55.11 H new ATOM 0 HA THR A 6 17.443 -3.831 -7.415 1.00 22.22 H new ATOM 0 HB THR A 6 18.698 -6.044 -7.165 1.00 41.34 H new ATOM 0 HG1 THR A 6 16.554 -6.703 -5.374 1.00 42.10 H new ATOM 0 HG21 THR A 6 19.063 -5.750 -4.744 1.00 32.45 H new ATOM 0 HG22 THR A 6 19.003 -4.188 -5.594 1.00 32.45 H new ATOM 0 HG23 THR A 6 17.600 -4.741 -4.650 1.00 32.45 H new ATOM 94 N ASP A 7 17.811 -5.663 -9.420 1.00 32.22 N ATOM 95 CA ASP A 7 17.726 -6.226 -10.763 1.00 3.35 C ATOM 96 C ASP A 7 17.905 -7.740 -10.729 1.00 64.34 C ATOM 97 O ASP A 7 18.418 -8.336 -11.677 1.00 53.45 O ATOM 98 CB ASP A 7 18.783 -5.595 -11.670 1.00 40.54 C ATOM 99 CG ASP A 7 18.765 -4.080 -11.614 1.00 10.44 C ATOM 100 OD1 ASP A 7 17.814 -3.477 -12.155 1.00 5.51 O ATOM 101 OD2 ASP A 7 19.701 -3.497 -11.027 1.00 72.21 O ATOM 0 H ASP A 7 18.763 -5.510 -9.086 1.00 32.22 H new ATOM 0 HA ASP A 7 16.736 -6.004 -11.162 1.00 3.35 H new ATOM 0 HB2 ASP A 7 19.770 -5.955 -11.378 1.00 40.54 H new ATOM 0 HB3 ASP A 7 18.617 -5.920 -12.697 1.00 40.54 H new ATOM 106 N ASP A 8 17.481 -8.357 -9.632 1.00 61.11 N ATOM 107 CA ASP A 8 17.594 -9.802 -9.475 1.00 64.50 C ATOM 108 C ASP A 8 16.990 -10.528 -10.673 1.00 64.31 C ATOM 109 O ASP A 8 15.850 -10.269 -11.059 1.00 73.12 O ATOM 110 CB ASP A 8 16.902 -10.253 -8.188 1.00 11.11 C ATOM 111 CG ASP A 8 15.603 -9.512 -7.939 1.00 41.52 C ATOM 112 OD1 ASP A 8 14.947 -9.117 -8.926 1.00 5.02 O ATOM 113 OD2 ASP A 8 15.243 -9.325 -6.758 1.00 33.01 O ATOM 0 H ASP A 8 17.056 -7.879 -8.838 1.00 61.11 H new ATOM 0 HA ASP A 8 18.653 -10.054 -9.416 1.00 64.50 H new ATOM 0 HB2 ASP A 8 16.702 -11.323 -8.242 1.00 11.11 H new ATOM 0 HB3 ASP A 8 17.574 -10.097 -7.344 1.00 11.11 H new ATOM 118 N LEU A 9 17.762 -11.437 -11.258 1.00 64.33 N ATOM 119 CA LEU A 9 17.304 -12.201 -12.414 1.00 1.40 C ATOM 120 C LEU A 9 17.441 -13.699 -12.166 1.00 23.32 C ATOM 121 O LEU A 9 16.618 -14.493 -12.623 1.00 3.23 O ATOM 122 CB LEU A 9 18.098 -11.804 -13.660 1.00 3.54 C ATOM 123 CG LEU A 9 18.237 -12.879 -14.738 1.00 50.41 C ATOM 124 CD1 LEU A 9 16.871 -13.271 -15.280 1.00 0.33 C ATOM 125 CD2 LEU A 9 19.139 -12.392 -15.863 1.00 22.31 C ATOM 0 H LEU A 9 18.708 -11.663 -10.951 1.00 64.33 H new ATOM 0 HA LEU A 9 16.250 -11.973 -12.574 1.00 1.40 H new ATOM 0 HB2 LEU A 9 17.623 -10.930 -14.106 1.00 3.54 H new ATOM 0 HB3 LEU A 9 19.097 -11.499 -13.348 1.00 3.54 H new ATOM 0 HG LEU A 9 18.694 -13.761 -14.288 1.00 50.41 H new ATOM 0 HD11 LEU A 9 16.990 -14.037 -16.046 1.00 0.33 H new ATOM 0 HD12 LEU A 9 16.256 -13.661 -14.469 1.00 0.33 H new ATOM 0 HD13 LEU A 9 16.387 -12.396 -15.714 1.00 0.33 H new ATOM 0 HD21 LEU A 9 19.227 -13.170 -16.622 1.00 22.31 H new ATOM 0 HD22 LEU A 9 18.710 -11.495 -16.311 1.00 22.31 H new ATOM 0 HD23 LEU A 9 20.127 -12.162 -15.464 1.00 22.31 H new ATOM 137 N VAL A 10 18.486 -14.080 -11.437 1.00 73.21 N ATOM 138 CA VAL A 10 18.729 -15.483 -11.125 1.00 22.41 C ATOM 139 C VAL A 10 17.633 -16.044 -10.226 1.00 24.45 C ATOM 140 O VAL A 10 17.515 -17.258 -10.057 1.00 72.31 O ATOM 141 CB VAL A 10 20.093 -15.677 -10.435 1.00 51.45 C ATOM 142 CG1 VAL A 10 21.200 -15.022 -11.248 1.00 14.21 C ATOM 143 CG2 VAL A 10 20.058 -15.119 -9.020 1.00 72.35 C ATOM 0 H VAL A 10 19.177 -13.436 -11.052 1.00 73.21 H new ATOM 0 HA VAL A 10 18.729 -16.022 -12.072 1.00 22.41 H new ATOM 0 HB VAL A 10 20.302 -16.745 -10.375 1.00 51.45 H new ATOM 0 HG11 VAL A 10 22.156 -15.169 -10.746 1.00 14.21 H new ATOM 0 HG12 VAL A 10 21.238 -15.472 -12.240 1.00 14.21 H new ATOM 0 HG13 VAL A 10 21.000 -13.955 -11.342 1.00 14.21 H new ATOM 0 HG21 VAL A 10 21.029 -15.264 -8.547 1.00 72.35 H new ATOM 0 HG22 VAL A 10 19.827 -14.054 -9.054 1.00 72.35 H new ATOM 0 HG23 VAL A 10 19.293 -15.638 -8.443 1.00 72.35 H new ATOM 153 N TYR A 11 16.834 -15.153 -9.650 1.00 60.03 N ATOM 154 CA TYR A 11 15.748 -15.559 -8.766 1.00 1.31 C ATOM 155 C TYR A 11 14.445 -15.721 -9.542 1.00 71.13 C ATOM 156 O TYR A 11 13.411 -16.078 -8.976 1.00 21.40 O ATOM 157 CB TYR A 11 15.563 -14.532 -7.647 1.00 24.53 C ATOM 158 CG TYR A 11 14.549 -13.459 -7.971 1.00 31.23 C ATOM 159 CD1 TYR A 11 14.668 -12.687 -9.119 1.00 51.23 C ATOM 160 CD2 TYR A 11 13.470 -13.218 -7.128 1.00 64.41 C ATOM 161 CE1 TYR A 11 13.744 -11.705 -9.419 1.00 13.34 C ATOM 162 CE2 TYR A 11 12.541 -12.239 -7.420 1.00 75.32 C ATOM 163 CZ TYR A 11 12.682 -11.485 -8.566 1.00 53.13 C ATOM 164 OH TYR A 11 11.758 -10.509 -8.862 1.00 2.54 O ATOM 0 H TYR A 11 16.918 -14.145 -9.779 1.00 60.03 H new ATOM 0 HA TYR A 11 16.011 -16.522 -8.328 1.00 1.31 H new ATOM 0 HB2 TYR A 11 15.255 -15.049 -6.738 1.00 24.53 H new ATOM 0 HB3 TYR A 11 16.523 -14.061 -7.435 1.00 24.53 H new ATOM 0 HD1 TYR A 11 15.498 -12.857 -9.789 1.00 51.23 H new ATOM 0 HD2 TYR A 11 13.357 -13.806 -6.230 1.00 64.41 H new ATOM 0 HE1 TYR A 11 13.852 -11.113 -10.316 1.00 13.34 H new ATOM 0 HE2 TYR A 11 11.708 -12.065 -6.754 1.00 75.32 H new ATOM 0 HH TYR A 11 11.074 -10.483 -8.161 1.00 2.54 H new ATOM 174 N LEU A 12 14.502 -15.457 -10.843 1.00 2.21 N ATOM 175 CA LEU A 12 13.327 -15.574 -11.700 1.00 5.21 C ATOM 176 C LEU A 12 13.268 -16.949 -12.357 1.00 52.24 C ATOM 177 O LEU A 12 12.253 -17.640 -12.283 1.00 13.41 O ATOM 178 CB LEU A 12 13.344 -14.483 -12.773 1.00 33.35 C ATOM 179 CG LEU A 12 12.485 -13.250 -12.489 1.00 71.32 C ATOM 180 CD1 LEU A 12 12.640 -12.225 -13.601 1.00 41.33 C ATOM 181 CD2 LEU A 12 11.024 -13.644 -12.324 1.00 62.14 C ATOM 0 H LEU A 12 15.349 -15.161 -11.327 1.00 2.21 H new ATOM 0 HA LEU A 12 12.440 -15.450 -11.079 1.00 5.21 H new ATOM 0 HB2 LEU A 12 14.375 -14.158 -12.916 1.00 33.35 H new ATOM 0 HB3 LEU A 12 13.014 -14.922 -13.715 1.00 33.35 H new ATOM 0 HG LEU A 12 12.826 -12.800 -11.557 1.00 71.32 H new ATOM 0 HD11 LEU A 12 12.022 -11.354 -13.382 1.00 41.33 H new ATOM 0 HD12 LEU A 12 13.684 -11.920 -13.672 1.00 41.33 H new ATOM 0 HD13 LEU A 12 12.326 -12.665 -14.548 1.00 41.33 H new ATOM 0 HD21 LEU A 12 10.428 -12.754 -12.122 1.00 62.14 H new ATOM 0 HD22 LEU A 12 10.670 -14.119 -13.239 1.00 62.14 H new ATOM 0 HD23 LEU A 12 10.927 -14.342 -11.492 1.00 62.14 H new ATOM 193 N ASN A 13 14.364 -17.340 -12.999 1.00 71.22 N ATOM 194 CA ASN A 13 14.437 -18.634 -13.668 1.00 52.04 C ATOM 195 C ASN A 13 14.410 -19.773 -12.654 1.00 64.42 C ATOM 196 O ASN A 13 14.096 -20.914 -12.994 1.00 31.13 O ATOM 197 CB ASN A 13 15.707 -18.721 -14.517 1.00 74.55 C ATOM 198 CG ASN A 13 15.647 -17.827 -15.741 1.00 30.12 C ATOM 199 OD1 ASN A 13 16.301 -16.785 -15.794 1.00 73.33 O ATOM 200 ND2 ASN A 13 14.860 -18.231 -16.731 1.00 71.20 N ATOM 0 H ASN A 13 15.213 -16.780 -13.070 1.00 71.22 H new ATOM 0 HA ASN A 13 13.567 -18.729 -14.317 1.00 52.04 H new ATOM 0 HB2 ASN A 13 16.567 -18.442 -13.909 1.00 74.55 H new ATOM 0 HB3 ASN A 13 15.860 -19.753 -14.832 1.00 74.55 H new ATOM 0 HD21 ASN A 13 14.779 -17.670 -17.579 1.00 71.20 H new ATOM 0 HD22 ASN A 13 14.336 -19.102 -16.643 1.00 71.20 H new ATOM 207 N VAL A 14 14.742 -19.456 -11.407 1.00 2.23 N ATOM 208 CA VAL A 14 14.755 -20.452 -10.342 1.00 0.31 C ATOM 209 C VAL A 14 13.366 -20.631 -9.741 1.00 34.42 C ATOM 210 O VAL A 14 13.036 -21.697 -9.221 1.00 23.11 O ATOM 211 CB VAL A 14 15.740 -20.065 -9.223 1.00 43.41 C ATOM 212 CG1 VAL A 14 15.160 -18.953 -8.362 1.00 24.02 C ATOM 213 CG2 VAL A 14 16.089 -21.280 -8.377 1.00 13.53 C ATOM 0 H VAL A 14 15.006 -18.517 -11.109 1.00 2.23 H new ATOM 0 HA VAL A 14 15.078 -21.391 -10.791 1.00 0.31 H new ATOM 0 HB VAL A 14 16.657 -19.695 -9.681 1.00 43.41 H new ATOM 0 HG11 VAL A 14 15.870 -18.693 -7.577 1.00 24.02 H new ATOM 0 HG12 VAL A 14 14.966 -18.077 -8.981 1.00 24.02 H new ATOM 0 HG13 VAL A 14 14.227 -19.291 -7.910 1.00 24.02 H new ATOM 0 HG21 VAL A 14 16.786 -20.988 -7.591 1.00 13.53 H new ATOM 0 HG22 VAL A 14 15.182 -21.682 -7.926 1.00 13.53 H new ATOM 0 HG23 VAL A 14 16.550 -22.041 -9.006 1.00 13.53 H new ATOM 223 N MET A 15 12.554 -19.582 -9.816 1.00 40.42 N ATOM 224 CA MET A 15 11.198 -19.624 -9.281 1.00 23.34 C ATOM 225 C MET A 15 10.264 -20.372 -10.226 1.00 74.12 C ATOM 226 O MET A 15 9.235 -20.901 -9.806 1.00 22.11 O ATOM 227 CB MET A 15 10.676 -18.206 -9.044 1.00 34.10 C ATOM 228 CG MET A 15 9.543 -18.137 -8.033 1.00 10.34 C ATOM 229 SD MET A 15 10.132 -17.902 -6.345 1.00 3.32 S ATOM 230 CE MET A 15 10.863 -16.271 -6.465 1.00 50.24 C ATOM 0 H MET A 15 12.811 -18.692 -10.242 1.00 40.42 H new ATOM 0 HA MET A 15 11.225 -20.156 -8.330 1.00 23.34 H new ATOM 0 HB2 MET A 15 11.498 -17.578 -8.700 1.00 34.10 H new ATOM 0 HB3 MET A 15 10.332 -17.791 -9.992 1.00 34.10 H new ATOM 0 HG2 MET A 15 8.874 -17.318 -8.298 1.00 10.34 H new ATOM 0 HG3 MET A 15 8.958 -19.055 -8.085 1.00 10.34 H new ATOM 0 HE1 MET A 15 10.787 -15.766 -5.502 1.00 50.24 H new ATOM 0 HE2 MET A 15 11.912 -16.362 -6.745 1.00 50.24 H new ATOM 0 HE3 MET A 15 10.335 -15.690 -7.221 1.00 50.24 H new ATOM 240 N GLU A 16 10.628 -20.411 -11.504 1.00 4.11 N ATOM 241 CA GLU A 16 9.820 -21.093 -12.508 1.00 25.21 C ATOM 242 C GLU A 16 9.985 -22.607 -12.402 1.00 44.43 C ATOM 243 O GLU A 16 9.114 -23.369 -12.823 1.00 51.52 O ATOM 244 CB GLU A 16 10.208 -20.624 -13.912 1.00 10.33 C ATOM 245 CG GLU A 16 9.603 -19.283 -14.294 1.00 25.04 C ATOM 246 CD GLU A 16 9.487 -19.102 -15.795 1.00 5.24 C ATOM 247 OE1 GLU A 16 10.056 -19.928 -16.538 1.00 74.43 O ATOM 248 OE2 GLU A 16 8.828 -18.133 -16.225 1.00 52.43 O ATOM 0 H GLU A 16 11.477 -19.978 -11.868 1.00 4.11 H new ATOM 0 HA GLU A 16 8.774 -20.845 -12.326 1.00 25.21 H new ATOM 0 HB2 GLU A 16 11.294 -20.555 -13.976 1.00 10.33 H new ATOM 0 HB3 GLU A 16 9.893 -21.375 -14.637 1.00 10.33 H new ATOM 0 HG2 GLU A 16 8.615 -19.193 -13.843 1.00 25.04 H new ATOM 0 HG3 GLU A 16 10.216 -18.481 -13.881 1.00 25.04 H new ATOM 255 N LEU A 17 11.109 -23.035 -11.838 1.00 61.20 N ATOM 256 CA LEU A 17 11.390 -24.458 -11.677 1.00 1.42 C ATOM 257 C LEU A 17 10.676 -25.018 -10.451 1.00 72.22 C ATOM 258 O LEU A 17 10.082 -26.095 -10.504 1.00 62.52 O ATOM 259 CB LEU A 17 12.897 -24.689 -11.553 1.00 61.02 C ATOM 260 CG LEU A 17 13.325 -26.067 -11.048 1.00 23.13 C ATOM 261 CD1 LEU A 17 12.694 -27.165 -11.890 1.00 41.43 C ATOM 262 CD2 LEU A 17 14.842 -26.191 -11.057 1.00 10.13 C ATOM 0 H LEU A 17 11.840 -22.418 -11.485 1.00 61.20 H new ATOM 0 HA LEU A 17 11.020 -24.979 -12.560 1.00 1.42 H new ATOM 0 HB2 LEU A 17 13.351 -24.525 -12.530 1.00 61.02 H new ATOM 0 HB3 LEU A 17 13.306 -23.935 -10.881 1.00 61.02 H new ATOM 0 HG LEU A 17 12.977 -26.180 -10.021 1.00 23.13 H new ATOM 0 HD11 LEU A 17 13.011 -28.138 -11.515 1.00 41.43 H new ATOM 0 HD12 LEU A 17 11.608 -27.089 -11.832 1.00 41.43 H new ATOM 0 HD13 LEU A 17 13.010 -27.055 -12.927 1.00 41.43 H new ATOM 0 HD21 LEU A 17 15.129 -27.178 -10.694 1.00 10.13 H new ATOM 0 HD22 LEU A 17 15.212 -26.056 -12.073 1.00 10.13 H new ATOM 0 HD23 LEU A 17 15.273 -25.427 -10.410 1.00 10.13 H new ATOM 274 N VAL A 18 10.735 -24.279 -9.348 1.00 45.00 N ATOM 275 CA VAL A 18 10.092 -24.700 -8.110 1.00 33.44 C ATOM 276 C VAL A 18 8.616 -25.011 -8.335 1.00 63.24 C ATOM 277 O VAL A 18 8.019 -25.801 -7.604 1.00 11.10 O ATOM 278 CB VAL A 18 10.216 -23.622 -7.017 1.00 44.10 C ATOM 279 CG1 VAL A 18 9.547 -24.084 -5.732 1.00 2.14 C ATOM 280 CG2 VAL A 18 11.678 -23.278 -6.773 1.00 40.10 C ATOM 0 H VAL A 18 11.222 -23.385 -9.287 1.00 45.00 H new ATOM 0 HA VAL A 18 10.605 -25.603 -7.779 1.00 33.44 H new ATOM 0 HB VAL A 18 9.706 -22.722 -7.359 1.00 44.10 H new ATOM 0 HG11 VAL A 18 9.645 -23.309 -4.972 1.00 2.14 H new ATOM 0 HG12 VAL A 18 8.491 -24.276 -5.920 1.00 2.14 H new ATOM 0 HG13 VAL A 18 10.025 -24.999 -5.381 1.00 2.14 H new ATOM 0 HG21 VAL A 18 11.748 -22.515 -5.998 1.00 40.10 H new ATOM 0 HG22 VAL A 18 12.213 -24.171 -6.452 1.00 40.10 H new ATOM 0 HG23 VAL A 18 12.122 -22.901 -7.694 1.00 40.10 H new ATOM 290 N ARG A 19 8.034 -24.385 -9.353 1.00 64.11 N ATOM 291 CA ARG A 19 6.628 -24.594 -9.675 1.00 60.33 C ATOM 292 C ARG A 19 6.429 -25.919 -10.406 1.00 32.01 C ATOM 293 O ARG A 19 5.662 -26.774 -9.964 1.00 13.31 O ATOM 294 CB ARG A 19 6.103 -23.442 -10.534 1.00 34.14 C ATOM 295 CG ARG A 19 5.436 -22.338 -9.729 1.00 72.33 C ATOM 296 CD ARG A 19 6.462 -21.403 -9.110 1.00 0.51 C ATOM 297 NE ARG A 19 5.943 -20.730 -7.922 1.00 53.43 N ATOM 298 CZ ARG A 19 5.749 -21.339 -6.758 1.00 3.21 C ATOM 299 NH1 ARG A 19 6.031 -22.628 -6.625 1.00 42.53 N ATOM 300 NH2 ARG A 19 5.273 -20.659 -5.723 1.00 5.52 N ATOM 0 H ARG A 19 8.515 -23.729 -9.969 1.00 64.11 H new ATOM 0 HA ARG A 19 6.068 -24.626 -8.740 1.00 60.33 H new ATOM 0 HB2 ARG A 19 6.930 -23.017 -11.102 1.00 34.14 H new ATOM 0 HB3 ARG A 19 5.389 -23.835 -11.257 1.00 34.14 H new ATOM 0 HG2 ARG A 19 4.766 -21.769 -10.374 1.00 72.33 H new ATOM 0 HG3 ARG A 19 4.823 -22.779 -8.943 1.00 72.33 H new ATOM 0 HD2 ARG A 19 7.355 -21.969 -8.845 1.00 0.51 H new ATOM 0 HD3 ARG A 19 6.764 -20.658 -9.846 1.00 0.51 H new ATOM 0 HE ARG A 19 5.717 -19.738 -7.990 1.00 53.43 H new ATOM 0 HH11 ARG A 19 6.398 -23.154 -7.418 1.00 42.53 H new ATOM 0 HH12 ARG A 19 5.881 -23.093 -5.730 1.00 42.53 H new ATOM 0 HH21 ARG A 19 5.056 -19.667 -5.821 1.00 5.52 H new ATOM 0 HH22 ARG A 19 5.124 -21.128 -4.829 1.00 5.52 H new ATOM 314 N ALA A 20 7.125 -26.081 -11.527 1.00 34.24 N ATOM 315 CA ALA A 20 7.025 -27.302 -12.317 1.00 43.55 C ATOM 316 C ALA A 20 7.350 -28.530 -11.474 1.00 71.04 C ATOM 317 O ALA A 20 6.741 -29.587 -11.639 1.00 62.35 O ATOM 318 CB ALA A 20 7.951 -27.226 -13.522 1.00 63.24 C ATOM 0 H ALA A 20 7.763 -25.383 -11.908 1.00 34.24 H new ATOM 0 HA ALA A 20 5.997 -27.397 -12.667 1.00 43.55 H new ATOM 0 HB1 ALA A 20 7.867 -28.144 -14.104 1.00 63.24 H new ATOM 0 HB2 ALA A 20 7.670 -26.376 -14.143 1.00 63.24 H new ATOM 0 HB3 ALA A 20 8.980 -27.104 -13.183 1.00 63.24 H new ATOM 324 N VAL A 21 8.314 -28.384 -10.571 1.00 34.05 N ATOM 325 CA VAL A 21 8.719 -29.482 -9.701 1.00 50.00 C ATOM 326 C VAL A 21 7.743 -29.654 -8.542 1.00 63.33 C ATOM 327 O VAL A 21 7.820 -30.628 -7.791 1.00 54.25 O ATOM 328 CB VAL A 21 10.135 -29.258 -9.137 1.00 15.22 C ATOM 329 CG1 VAL A 21 10.129 -28.136 -8.109 1.00 74.14 C ATOM 330 CG2 VAL A 21 10.676 -30.544 -8.531 1.00 51.10 C ATOM 0 H VAL A 21 8.829 -27.516 -10.423 1.00 34.05 H new ATOM 0 HA VAL A 21 8.717 -30.386 -10.310 1.00 50.00 H new ATOM 0 HB VAL A 21 10.792 -28.965 -9.956 1.00 15.22 H new ATOM 0 HG11 VAL A 21 11.138 -27.992 -7.722 1.00 74.14 H new ATOM 0 HG12 VAL A 21 9.786 -27.214 -8.579 1.00 74.14 H new ATOM 0 HG13 VAL A 21 9.459 -28.397 -7.289 1.00 74.14 H new ATOM 0 HG21 VAL A 21 11.677 -30.368 -8.137 1.00 51.10 H new ATOM 0 HG22 VAL A 21 10.021 -30.869 -7.723 1.00 51.10 H new ATOM 0 HG23 VAL A 21 10.719 -31.318 -9.298 1.00 51.10 H new ATOM 340 N LEU A 22 6.826 -28.704 -8.402 1.00 50.24 N ATOM 341 CA LEU A 22 5.833 -28.750 -7.335 1.00 0.04 C ATOM 342 C LEU A 22 4.557 -29.440 -7.807 1.00 25.43 C ATOM 343 O LEU A 22 3.818 -30.012 -7.007 1.00 32.05 O ATOM 344 CB LEU A 22 5.511 -27.336 -6.849 1.00 42.51 C ATOM 345 CG LEU A 22 4.353 -27.213 -5.859 1.00 33.23 C ATOM 346 CD1 LEU A 22 4.719 -27.851 -4.527 1.00 41.44 C ATOM 347 CD2 LEU A 22 3.968 -25.754 -5.665 1.00 41.44 C ATOM 0 H LEU A 22 6.749 -27.892 -9.014 1.00 50.24 H new ATOM 0 HA LEU A 22 6.251 -29.325 -6.509 1.00 0.04 H new ATOM 0 HB2 LEU A 22 6.405 -26.921 -6.384 1.00 42.51 H new ATOM 0 HB3 LEU A 22 5.287 -26.717 -7.718 1.00 42.51 H new ATOM 0 HG LEU A 22 3.493 -27.743 -6.269 1.00 33.23 H new ATOM 0 HD11 LEU A 22 3.883 -27.754 -3.835 1.00 41.44 H new ATOM 0 HD12 LEU A 22 4.944 -28.907 -4.679 1.00 41.44 H new ATOM 0 HD13 LEU A 22 5.594 -27.350 -4.112 1.00 41.44 H new ATOM 0 HD21 LEU A 22 3.142 -25.687 -4.957 1.00 41.44 H new ATOM 0 HD22 LEU A 22 4.824 -25.200 -5.278 1.00 41.44 H new ATOM 0 HD23 LEU A 22 3.662 -25.328 -6.621 1.00 41.44 H new ATOM 359 N GLU A 23 4.308 -29.384 -9.111 1.00 64.43 N ATOM 360 CA GLU A 23 3.123 -30.006 -9.689 1.00 73.03 C ATOM 361 C GLU A 23 3.269 -31.524 -9.729 1.00 60.51 C ATOM 362 O GLU A 23 2.282 -32.257 -9.647 1.00 23.24 O ATOM 363 CB GLU A 23 2.875 -29.469 -11.101 1.00 32.34 C ATOM 364 CG GLU A 23 3.061 -27.966 -11.221 1.00 73.25 C ATOM 365 CD GLU A 23 2.526 -27.214 -10.019 1.00 14.52 C ATOM 366 OE1 GLU A 23 1.481 -27.630 -9.475 1.00 62.54 O ATOM 367 OE2 GLU A 23 3.150 -26.208 -9.621 1.00 64.31 O ATOM 0 H GLU A 23 4.911 -28.915 -9.787 1.00 64.43 H new ATOM 0 HA GLU A 23 2.270 -29.757 -9.058 1.00 73.03 H new ATOM 0 HB2 GLU A 23 3.553 -29.967 -11.794 1.00 32.34 H new ATOM 0 HB3 GLU A 23 1.861 -29.727 -11.406 1.00 32.34 H new ATOM 0 HG2 GLU A 23 4.121 -27.743 -11.342 1.00 73.25 H new ATOM 0 HG3 GLU A 23 2.557 -27.612 -12.120 1.00 73.25 H new ATOM 374 N LEU A 24 4.506 -31.990 -9.857 1.00 25.32 N ATOM 375 CA LEU A 24 4.784 -33.422 -9.908 1.00 53.43 C ATOM 376 C LEU A 24 4.770 -34.030 -8.509 1.00 41.35 C ATOM 377 O LEU A 24 4.944 -35.237 -8.344 1.00 31.24 O ATOM 378 CB LEU A 24 6.137 -33.675 -10.574 1.00 24.31 C ATOM 379 CG LEU A 24 7.368 -33.485 -9.686 1.00 71.13 C ATOM 380 CD1 LEU A 24 7.731 -34.788 -8.991 1.00 62.01 C ATOM 381 CD2 LEU A 24 8.542 -32.970 -10.506 1.00 22.32 C ATOM 0 H LEU A 24 5.333 -31.397 -9.927 1.00 25.32 H new ATOM 0 HA LEU A 24 4.001 -33.898 -10.498 1.00 53.43 H new ATOM 0 HB2 LEU A 24 6.145 -34.695 -10.959 1.00 24.31 H new ATOM 0 HB3 LEU A 24 6.227 -33.010 -11.433 1.00 24.31 H new ATOM 0 HG LEU A 24 7.131 -32.744 -8.922 1.00 71.13 H new ATOM 0 HD11 LEU A 24 8.609 -34.633 -8.364 1.00 62.01 H new ATOM 0 HD12 LEU A 24 6.896 -35.115 -8.372 1.00 62.01 H new ATOM 0 HD13 LEU A 24 7.949 -35.551 -9.739 1.00 62.01 H new ATOM 0 HD21 LEU A 24 9.409 -32.841 -9.858 1.00 22.32 H new ATOM 0 HD22 LEU A 24 8.780 -33.687 -11.292 1.00 22.32 H new ATOM 0 HD23 LEU A 24 8.279 -32.013 -10.956 1.00 22.32 H new ATOM 393 N LYS A 25 4.560 -33.185 -7.505 1.00 62.51 N ATOM 394 CA LYS A 25 4.520 -33.639 -6.120 1.00 12.42 C ATOM 395 C LYS A 25 3.155 -34.229 -5.780 1.00 61.53 C ATOM 396 O LYS A 25 3.037 -35.421 -5.497 1.00 4.32 O ATOM 397 CB LYS A 25 4.835 -32.479 -5.173 1.00 1.42 C ATOM 398 CG LYS A 25 6.185 -31.832 -5.432 1.00 14.42 C ATOM 399 CD LYS A 25 6.552 -30.849 -4.333 1.00 11.42 C ATOM 400 CE LYS A 25 7.164 -31.556 -3.134 1.00 24.31 C ATOM 401 NZ LYS A 25 7.037 -30.749 -1.889 1.00 22.31 N ATOM 0 H LYS A 25 4.415 -32.182 -7.625 1.00 62.51 H new ATOM 0 HA LYS A 25 5.274 -34.417 -5.997 1.00 12.42 H new ATOM 0 HB2 LYS A 25 4.055 -31.723 -5.266 1.00 1.42 H new ATOM 0 HB3 LYS A 25 4.806 -32.842 -4.146 1.00 1.42 H new ATOM 0 HG2 LYS A 25 6.952 -32.604 -5.502 1.00 14.42 H new ATOM 0 HG3 LYS A 25 6.164 -31.315 -6.391 1.00 14.42 H new ATOM 0 HD2 LYS A 25 7.257 -30.114 -4.722 1.00 11.42 H new ATOM 0 HD3 LYS A 25 5.662 -30.303 -4.020 1.00 11.42 H new ATOM 0 HE2 LYS A 25 6.676 -32.520 -2.993 1.00 24.31 H new ATOM 0 HE3 LYS A 25 8.217 -31.758 -3.330 1.00 24.31 H new ATOM 0 HZ1 LYS A 25 7.622 -31.171 -1.140 1.00 22.31 H new ATOM 0 HZ2 LYS A 25 7.357 -29.776 -2.072 1.00 22.31 H new ATOM 0 HZ3 LYS A 25 6.043 -30.735 -1.584 1.00 22.31 H new ATOM 415 N ASN A 26 2.127 -33.388 -5.813 1.00 35.35 N ATOM 416 CA ASN A 26 0.770 -33.828 -5.509 1.00 34.31 C ATOM 417 C ASN A 26 0.235 -34.740 -6.609 1.00 34.43 C ATOM 418 O ASN A 26 -0.667 -35.545 -6.377 1.00 24.34 O ATOM 419 CB ASN A 26 -0.154 -32.621 -5.338 1.00 52.30 C ATOM 420 CG ASN A 26 0.003 -31.959 -3.982 1.00 63.54 C ATOM 421 OD1 ASN A 26 1.247 -31.735 -3.575 1.00 63.30 O flip ATOM 422 ND2 ASN A 26 -0.982 -31.654 -3.310 1.00 1.22 N flip ATOM 0 H ASN A 26 2.207 -32.398 -6.047 1.00 35.35 H new ATOM 0 HA ASN A 26 0.798 -34.391 -4.576 1.00 34.31 H new ATOM 0 HB2 ASN A 26 0.056 -31.893 -6.121 1.00 52.30 H new ATOM 0 HB3 ASN A 26 -1.189 -32.938 -5.467 1.00 52.30 H new ATOM 0 HD21 ASN A 26 -1.920 -31.845 -3.663 1.00 1.22 H new ATOM 0 HD22 ASN A 26 -0.861 -31.210 -2.400 1.00 1.22 H new ATOM 429 N GLU A 27 0.797 -34.608 -7.806 1.00 3.12 N ATOM 430 CA GLU A 27 0.376 -35.420 -8.941 1.00 62.22 C ATOM 431 C GLU A 27 1.265 -36.652 -9.088 1.00 74.20 C ATOM 432 O GLU A 27 1.356 -37.241 -10.166 1.00 41.12 O ATOM 433 CB GLU A 27 0.413 -34.595 -10.229 1.00 3.30 C ATOM 434 CG GLU A 27 -0.514 -33.391 -10.208 1.00 33.44 C ATOM 435 CD GLU A 27 -0.980 -32.989 -11.593 1.00 44.25 C ATOM 436 OE1 GLU A 27 -0.147 -32.993 -12.524 1.00 1.30 O ATOM 437 OE2 GLU A 27 -2.177 -32.670 -11.747 1.00 53.11 O ATOM 0 H GLU A 27 1.545 -33.947 -8.015 1.00 3.12 H new ATOM 0 HA GLU A 27 -0.647 -35.750 -8.759 1.00 62.22 H new ATOM 0 HB2 GLU A 27 1.434 -34.254 -10.403 1.00 3.30 H new ATOM 0 HB3 GLU A 27 0.144 -35.236 -11.069 1.00 3.30 H new ATOM 0 HG2 GLU A 27 -1.382 -33.616 -9.588 1.00 33.44 H new ATOM 0 HG3 GLU A 27 0.000 -32.550 -9.743 1.00 33.44 H new ATOM 444 N LEU A 28 1.918 -37.036 -7.997 1.00 70.31 N ATOM 445 CA LEU A 28 2.800 -38.198 -8.003 1.00 23.01 C ATOM 446 C LEU A 28 2.014 -39.481 -7.752 1.00 53.41 C ATOM 447 O LEU A 28 2.416 -40.561 -8.183 1.00 34.43 O ATOM 448 CB LEU A 28 3.891 -38.040 -6.943 1.00 4.25 C ATOM 449 CG LEU A 28 4.952 -39.140 -6.902 1.00 23.24 C ATOM 450 CD1 LEU A 28 4.441 -40.346 -6.129 1.00 20.13 C ATOM 451 CD2 LEU A 28 5.359 -39.542 -8.312 1.00 11.30 C ATOM 0 H LEU A 28 1.854 -36.560 -7.097 1.00 70.31 H new ATOM 0 HA LEU A 28 3.264 -38.265 -8.987 1.00 23.01 H new ATOM 0 HB2 LEU A 28 4.392 -37.086 -7.106 1.00 4.25 H new ATOM 0 HB3 LEU A 28 3.414 -37.987 -5.964 1.00 4.25 H new ATOM 0 HG LEU A 28 5.831 -38.751 -6.389 1.00 23.24 H new ATOM 0 HD11 LEU A 28 5.210 -41.119 -6.110 1.00 20.13 H new ATOM 0 HD12 LEU A 28 4.201 -40.049 -5.108 1.00 20.13 H new ATOM 0 HD13 LEU A 28 3.546 -40.736 -6.614 1.00 20.13 H new ATOM 0 HD21 LEU A 28 6.115 -40.326 -8.263 1.00 11.30 H new ATOM 0 HD22 LEU A 28 4.487 -39.912 -8.851 1.00 11.30 H new ATOM 0 HD23 LEU A 28 5.767 -38.676 -8.834 1.00 11.30 H new ATOM 463 N SER A 29 0.890 -39.352 -7.055 1.00 35.35 N ATOM 464 CA SER A 29 0.047 -40.501 -6.745 1.00 73.40 C ATOM 465 C SER A 29 -1.291 -40.405 -7.472 1.00 71.41 C ATOM 466 O SER A 29 -2.351 -40.550 -6.864 1.00 11.41 O ATOM 467 CB SER A 29 -0.186 -40.598 -5.236 1.00 61.20 C ATOM 468 OG SER A 29 -0.602 -41.901 -4.867 1.00 32.52 O ATOM 0 H SER A 29 0.542 -38.464 -6.694 1.00 35.35 H new ATOM 0 HA SER A 29 0.562 -41.400 -7.084 1.00 73.40 H new ATOM 0 HB2 SER A 29 0.731 -40.342 -4.706 1.00 61.20 H new ATOM 0 HB3 SER A 29 -0.941 -39.873 -4.934 1.00 61.20 H new ATOM 0 HG SER A 29 -1.430 -42.126 -5.340 1.00 32.52 H new ATOM 474 N GLN A 30 -1.232 -40.161 -8.777 1.00 41.22 N ATOM 475 CA GLN A 30 -2.438 -40.045 -9.588 1.00 14.44 C ATOM 476 C GLN A 30 -2.172 -40.477 -11.026 1.00 20.03 C ATOM 477 O GLN A 30 -2.983 -41.175 -11.636 1.00 21.34 O ATOM 478 CB GLN A 30 -2.958 -38.606 -9.563 1.00 72.21 C ATOM 479 CG GLN A 30 -4.073 -38.379 -8.555 1.00 32.40 C ATOM 480 CD GLN A 30 -4.002 -37.012 -7.904 1.00 22.34 C ATOM 481 OE1 GLN A 30 -4.773 -36.112 -8.237 1.00 45.25 O ATOM 482 NE2 GLN A 30 -3.074 -36.850 -6.968 1.00 3.30 N ATOM 0 H GLN A 30 -0.362 -40.040 -9.295 1.00 41.22 H new ATOM 0 HA GLN A 30 -3.195 -40.705 -9.164 1.00 14.44 H new ATOM 0 HB2 GLN A 30 -2.131 -37.934 -9.335 1.00 72.21 H new ATOM 0 HB3 GLN A 30 -3.319 -38.342 -10.557 1.00 72.21 H new ATOM 0 HG2 GLN A 30 -5.036 -38.490 -9.053 1.00 32.40 H new ATOM 0 HG3 GLN A 30 -4.022 -39.148 -7.784 1.00 32.40 H new ATOM 0 HE21 GLN A 30 -2.456 -37.624 -6.723 1.00 3.30 H new ATOM 0 HE22 GLN A 30 -2.979 -35.952 -6.494 1.00 3.30 H new ATOM 491 N LEU A 31 -1.031 -40.058 -11.562 1.00 54.25 N ATOM 492 CA LEU A 31 -0.658 -40.402 -12.930 1.00 44.50 C ATOM 493 C LEU A 31 0.419 -41.482 -12.945 1.00 42.31 C ATOM 494 O LEU A 31 1.131 -41.697 -11.964 1.00 32.23 O ATOM 495 CB LEU A 31 -0.160 -39.159 -13.671 1.00 72.22 C ATOM 496 CG LEU A 31 -1.240 -38.261 -14.275 1.00 51.23 C ATOM 497 CD1 LEU A 31 -0.624 -36.986 -14.832 1.00 34.43 C ATOM 498 CD2 LEU A 31 -2.006 -39.003 -15.360 1.00 70.35 C ATOM 0 H LEU A 31 -0.349 -39.480 -11.071 1.00 54.25 H new ATOM 0 HA LEU A 31 -1.542 -40.789 -13.436 1.00 44.50 H new ATOM 0 HB2 LEU A 31 0.436 -38.563 -12.980 1.00 72.22 H new ATOM 0 HB3 LEU A 31 0.507 -39.480 -14.471 1.00 72.22 H new ATOM 0 HG LEU A 31 -1.941 -37.988 -13.486 1.00 51.23 H new ATOM 0 HD11 LEU A 31 -1.408 -36.359 -15.258 1.00 34.43 H new ATOM 0 HD12 LEU A 31 -0.121 -36.444 -14.031 1.00 34.43 H new ATOM 0 HD13 LEU A 31 0.099 -37.240 -15.607 1.00 34.43 H new ATOM 0 HD21 LEU A 31 -2.770 -38.348 -15.778 1.00 70.35 H new ATOM 0 HD22 LEU A 31 -1.317 -39.307 -16.148 1.00 70.35 H new ATOM 0 HD23 LEU A 31 -2.480 -39.886 -14.932 1.00 70.35 H new ATOM 510 N PRO A 32 0.545 -42.177 -14.085 1.00 53.34 N ATOM 511 CA PRO A 32 1.535 -43.244 -14.257 1.00 35.30 C ATOM 512 C PRO A 32 2.961 -42.709 -14.312 1.00 2.24 C ATOM 513 O PRO A 32 3.194 -41.505 -14.428 1.00 22.42 O ATOM 514 CB PRO A 32 1.148 -43.874 -15.597 1.00 61.25 C ATOM 515 CG PRO A 32 0.445 -42.789 -16.337 1.00 73.12 C ATOM 516 CD PRO A 32 -0.270 -41.973 -15.295 1.00 63.43 C ATOM 0 HA PRO A 32 1.527 -43.945 -13.422 1.00 35.30 H new ATOM 0 HB2 PRO A 32 2.027 -44.219 -16.141 1.00 61.25 H new ATOM 0 HB3 PRO A 32 0.501 -44.740 -15.455 1.00 61.25 H new ATOM 0 HG2 PRO A 32 1.152 -42.176 -16.895 1.00 73.12 H new ATOM 0 HG3 PRO A 32 -0.259 -43.202 -17.060 1.00 73.12 H new ATOM 0 HD2 PRO A 32 -0.320 -40.920 -15.573 1.00 63.43 H new ATOM 0 HD3 PRO A 32 -1.295 -42.314 -15.151 1.00 63.43 H new ATOM 524 N PRO A 33 3.940 -43.621 -14.226 1.00 64.54 N ATOM 525 CA PRO A 33 5.361 -43.264 -14.265 1.00 45.21 C ATOM 526 C PRO A 33 5.800 -42.778 -15.643 1.00 31.54 C ATOM 527 O PRO A 33 6.904 -42.260 -15.805 1.00 71.21 O ATOM 528 CB PRO A 33 6.067 -44.575 -13.911 1.00 21.15 C ATOM 529 CG PRO A 33 5.109 -45.642 -14.314 1.00 52.01 C ATOM 530 CD PRO A 33 3.736 -45.073 -14.086 1.00 53.05 C ATOM 0 HA PRO A 33 5.593 -42.443 -13.587 1.00 45.21 H new ATOM 0 HB2 PRO A 33 7.013 -44.671 -14.443 1.00 21.15 H new ATOM 0 HB3 PRO A 33 6.293 -44.628 -12.846 1.00 21.15 H new ATOM 0 HG2 PRO A 33 5.249 -45.917 -15.359 1.00 52.01 H new ATOM 0 HG3 PRO A 33 5.260 -46.546 -13.723 1.00 52.01 H new ATOM 0 HD2 PRO A 33 3.019 -45.450 -14.815 1.00 53.05 H new ATOM 0 HD3 PRO A 33 3.353 -45.332 -13.099 1.00 53.05 H new ATOM 538 N GLU A 34 4.927 -42.950 -16.631 1.00 3.12 N ATOM 539 CA GLU A 34 5.226 -42.529 -17.994 1.00 43.05 C ATOM 540 C GLU A 34 5.097 -41.015 -18.137 1.00 74.24 C ATOM 541 O GLU A 34 5.716 -40.408 -19.009 1.00 44.34 O ATOM 542 CB GLU A 34 4.292 -43.228 -18.984 1.00 54.31 C ATOM 543 CG GLU A 34 4.141 -44.718 -18.730 1.00 72.24 C ATOM 544 CD GLU A 34 3.628 -45.468 -19.945 1.00 12.42 C ATOM 545 OE1 GLU A 34 2.610 -45.033 -20.523 1.00 35.12 O ATOM 546 OE2 GLU A 34 4.244 -46.488 -20.317 1.00 32.02 O ATOM 0 H GLU A 34 4.008 -43.377 -16.513 1.00 3.12 H new ATOM 0 HA GLU A 34 6.255 -42.811 -18.216 1.00 43.05 H new ATOM 0 HB2 GLU A 34 3.309 -42.759 -18.937 1.00 54.31 H new ATOM 0 HB3 GLU A 34 4.669 -43.077 -19.995 1.00 54.31 H new ATOM 0 HG2 GLU A 34 5.105 -45.132 -18.433 1.00 72.24 H new ATOM 0 HG3 GLU A 34 3.456 -44.873 -17.896 1.00 72.24 H new ATOM 553 N GLY A 35 4.285 -40.412 -17.274 1.00 30.32 N ATOM 554 CA GLY A 35 4.087 -38.975 -17.321 1.00 24.45 C ATOM 555 C GLY A 35 5.112 -38.222 -16.495 1.00 73.22 C ATOM 556 O GLY A 35 5.302 -37.019 -16.677 1.00 21.35 O ATOM 0 H GLY A 35 3.761 -40.893 -16.543 1.00 30.32 H new ATOM 0 HA2 GLY A 35 4.140 -38.638 -18.356 1.00 24.45 H new ATOM 0 HA3 GLY A 35 3.087 -38.737 -16.959 1.00 24.45 H new ATOM 560 N TYR A 36 5.772 -38.930 -15.585 1.00 52.23 N ATOM 561 CA TYR A 36 6.779 -38.320 -14.726 1.00 3.51 C ATOM 562 C TYR A 36 8.128 -38.247 -15.435 1.00 2.42 C ATOM 563 O TYR A 36 8.848 -37.254 -15.324 1.00 24.41 O ATOM 564 CB TYR A 36 6.917 -39.111 -13.424 1.00 73.13 C ATOM 565 CG TYR A 36 5.615 -39.267 -12.670 1.00 65.54 C ATOM 566 CD1 TYR A 36 4.682 -38.239 -12.637 1.00 34.02 C ATOM 567 CD2 TYR A 36 5.320 -40.443 -11.991 1.00 1.20 C ATOM 568 CE1 TYR A 36 3.492 -38.377 -11.949 1.00 14.03 C ATOM 569 CE2 TYR A 36 4.132 -40.590 -11.302 1.00 21.13 C ATOM 570 CZ TYR A 36 3.221 -39.554 -11.283 1.00 62.53 C ATOM 571 OH TYR A 36 2.037 -39.697 -10.597 1.00 3.25 O ATOM 0 H TYR A 36 5.627 -39.927 -15.424 1.00 52.23 H new ATOM 0 HA TYR A 36 6.455 -37.305 -14.494 1.00 3.51 H new ATOM 0 HB2 TYR A 36 7.317 -40.099 -13.650 1.00 73.13 H new ATOM 0 HB3 TYR A 36 7.642 -38.613 -12.781 1.00 73.13 H new ATOM 0 HD1 TYR A 36 4.890 -37.316 -13.158 1.00 34.02 H new ATOM 0 HD2 TYR A 36 6.031 -41.255 -12.002 1.00 1.20 H new ATOM 0 HE1 TYR A 36 2.777 -37.567 -11.933 1.00 14.03 H new ATOM 0 HE2 TYR A 36 3.917 -41.511 -10.781 1.00 21.13 H new ATOM 0 HH TYR A 36 1.508 -38.877 -10.684 1.00 3.25 H new ATOM 581 N VAL A 37 8.464 -39.306 -16.165 1.00 13.41 N ATOM 582 CA VAL A 37 9.725 -39.363 -16.894 1.00 53.14 C ATOM 583 C VAL A 37 9.832 -38.219 -17.896 1.00 45.13 C ATOM 584 O VAL A 37 10.906 -37.649 -18.092 1.00 23.42 O ATOM 585 CB VAL A 37 9.881 -40.701 -17.641 1.00 60.00 C ATOM 586 CG1 VAL A 37 8.705 -40.930 -18.579 1.00 4.13 C ATOM 587 CG2 VAL A 37 11.197 -40.734 -18.404 1.00 74.41 C ATOM 0 H VAL A 37 7.880 -40.136 -16.267 1.00 13.41 H new ATOM 0 HA VAL A 37 10.522 -39.272 -16.156 1.00 53.14 H new ATOM 0 HB VAL A 37 9.892 -41.508 -16.908 1.00 60.00 H new ATOM 0 HG11 VAL A 37 8.833 -41.880 -19.098 1.00 4.13 H new ATOM 0 HG12 VAL A 37 7.780 -40.953 -18.003 1.00 4.13 H new ATOM 0 HG13 VAL A 37 8.659 -40.122 -19.309 1.00 4.13 H new ATOM 0 HG21 VAL A 37 11.291 -41.686 -18.926 1.00 74.41 H new ATOM 0 HG22 VAL A 37 11.218 -39.920 -19.128 1.00 74.41 H new ATOM 0 HG23 VAL A 37 12.026 -40.620 -17.705 1.00 74.41 H new ATOM 597 N VAL A 38 8.712 -37.886 -18.529 1.00 71.33 N ATOM 598 CA VAL A 38 8.679 -36.808 -19.511 1.00 22.53 C ATOM 599 C VAL A 38 8.793 -35.447 -18.835 1.00 43.41 C ATOM 600 O VAL A 38 9.162 -34.457 -19.468 1.00 12.35 O ATOM 601 CB VAL A 38 7.385 -36.849 -20.345 1.00 43.54 C ATOM 602 CG1 VAL A 38 7.403 -38.031 -21.302 1.00 44.33 C ATOM 603 CG2 VAL A 38 6.167 -36.906 -19.436 1.00 70.33 C ATOM 0 H VAL A 38 7.815 -38.347 -18.379 1.00 71.33 H new ATOM 0 HA VAL A 38 9.533 -36.954 -20.172 1.00 22.53 H new ATOM 0 HB VAL A 38 7.326 -35.935 -20.936 1.00 43.54 H new ATOM 0 HG11 VAL A 38 6.481 -38.043 -21.883 1.00 44.33 H new ATOM 0 HG12 VAL A 38 8.255 -37.940 -21.976 1.00 44.33 H new ATOM 0 HG13 VAL A 38 7.487 -38.958 -20.734 1.00 44.33 H new ATOM 0 HG21 VAL A 38 5.262 -36.934 -20.042 1.00 70.33 H new ATOM 0 HG22 VAL A 38 6.217 -37.801 -18.816 1.00 70.33 H new ATOM 0 HG23 VAL A 38 6.148 -36.023 -18.797 1.00 70.33 H new ATOM 613 N VAL A 39 8.475 -35.403 -17.545 1.00 71.33 N ATOM 614 CA VAL A 39 8.543 -34.163 -16.782 1.00 41.22 C ATOM 615 C VAL A 39 9.912 -33.992 -16.132 1.00 54.13 C ATOM 616 O VAL A 39 10.403 -32.874 -15.980 1.00 44.43 O ATOM 617 CB VAL A 39 7.459 -34.116 -15.689 1.00 54.35 C ATOM 618 CG1 VAL A 39 7.568 -32.830 -14.883 1.00 61.43 C ATOM 619 CG2 VAL A 39 6.075 -34.251 -16.307 1.00 31.43 C ATOM 0 H VAL A 39 8.168 -36.213 -17.006 1.00 71.33 H new ATOM 0 HA VAL A 39 8.374 -33.349 -17.486 1.00 41.22 H new ATOM 0 HB VAL A 39 7.614 -34.955 -15.011 1.00 54.35 H new ATOM 0 HG11 VAL A 39 6.794 -32.815 -14.116 1.00 61.43 H new ATOM 0 HG12 VAL A 39 8.549 -32.779 -14.410 1.00 61.43 H new ATOM 0 HG13 VAL A 39 7.439 -31.974 -15.545 1.00 61.43 H new ATOM 0 HG21 VAL A 39 5.321 -34.216 -15.521 1.00 31.43 H new ATOM 0 HG22 VAL A 39 5.908 -33.433 -17.007 1.00 31.43 H new ATOM 0 HG23 VAL A 39 6.004 -35.201 -16.836 1.00 31.43 H new ATOM 629 N VAL A 40 10.523 -35.109 -15.750 1.00 50.24 N ATOM 630 CA VAL A 40 11.836 -35.083 -15.118 1.00 24.51 C ATOM 631 C VAL A 40 12.830 -34.277 -15.947 1.00 11.15 C ATOM 632 O VAL A 40 13.768 -33.686 -15.410 1.00 74.03 O ATOM 633 CB VAL A 40 12.390 -36.507 -14.916 1.00 15.32 C ATOM 634 CG1 VAL A 40 13.784 -36.457 -14.310 1.00 13.25 C ATOM 635 CG2 VAL A 40 11.449 -37.324 -14.044 1.00 31.54 C ATOM 0 H VAL A 40 10.130 -36.043 -15.867 1.00 50.24 H new ATOM 0 HA VAL A 40 11.709 -34.608 -14.145 1.00 24.51 H new ATOM 0 HB VAL A 40 12.461 -36.993 -15.889 1.00 15.32 H new ATOM 0 HG11 VAL A 40 14.159 -37.472 -14.175 1.00 13.25 H new ATOM 0 HG12 VAL A 40 14.451 -35.910 -14.976 1.00 13.25 H new ATOM 0 HG13 VAL A 40 13.743 -35.954 -13.344 1.00 13.25 H new ATOM 0 HG21 VAL A 40 11.855 -38.327 -13.911 1.00 31.54 H new ATOM 0 HG22 VAL A 40 11.345 -36.843 -13.071 1.00 31.54 H new ATOM 0 HG23 VAL A 40 10.472 -37.388 -14.524 1.00 31.54 H new ATOM 645 N LYS A 41 12.618 -34.256 -17.258 1.00 43.21 N ATOM 646 CA LYS A 41 13.493 -33.520 -18.163 1.00 65.21 C ATOM 647 C LYS A 41 13.235 -32.020 -18.070 1.00 3.21 C ATOM 648 O LYS A 41 14.170 -31.221 -18.039 1.00 40.40 O ATOM 649 CB LYS A 41 13.288 -33.995 -19.603 1.00 75.42 C ATOM 650 CG LYS A 41 14.557 -34.506 -20.262 1.00 71.44 C ATOM 651 CD LYS A 41 14.736 -36.000 -20.045 1.00 50.51 C ATOM 652 CE LYS A 41 14.982 -36.324 -18.580 1.00 13.04 C ATOM 653 NZ LYS A 41 15.744 -37.592 -18.412 1.00 44.05 N ATOM 0 H LYS A 41 11.847 -34.740 -17.718 1.00 43.21 H new ATOM 0 HA LYS A 41 14.524 -33.712 -17.867 1.00 65.21 H new ATOM 0 HB2 LYS A 41 12.540 -34.787 -19.612 1.00 75.42 H new ATOM 0 HB3 LYS A 41 12.888 -33.172 -20.195 1.00 75.42 H new ATOM 0 HG2 LYS A 41 14.524 -34.294 -21.331 1.00 71.44 H new ATOM 0 HG3 LYS A 41 15.418 -33.973 -19.858 1.00 71.44 H new ATOM 0 HD2 LYS A 41 13.848 -36.528 -20.391 1.00 50.51 H new ATOM 0 HD3 LYS A 41 15.574 -36.358 -20.644 1.00 50.51 H new ATOM 0 HE2 LYS A 41 15.532 -35.506 -18.115 1.00 13.04 H new ATOM 0 HE3 LYS A 41 14.027 -36.403 -18.060 1.00 13.04 H new ATOM 0 HZ1 LYS A 41 15.891 -37.777 -17.399 1.00 44.05 H new ATOM 0 HZ2 LYS A 41 15.208 -38.377 -18.833 1.00 44.05 H new ATOM 0 HZ3 LYS A 41 16.666 -37.508 -18.886 1.00 44.05 H new ATOM 667 N ASN A 42 11.961 -31.645 -18.024 1.00 10.10 N ATOM 668 CA ASN A 42 11.580 -30.240 -17.933 1.00 44.11 C ATOM 669 C ASN A 42 11.875 -29.686 -16.542 1.00 55.55 C ATOM 670 O ASN A 42 12.135 -28.493 -16.380 1.00 34.21 O ATOM 671 CB ASN A 42 10.095 -30.070 -18.258 1.00 60.33 C ATOM 672 CG ASN A 42 9.636 -31.000 -19.365 1.00 35.34 C ATOM 673 OD1 ASN A 42 10.334 -31.191 -20.360 1.00 71.23 O ATOM 674 ND2 ASN A 42 8.455 -31.584 -19.194 1.00 51.14 N ATOM 0 H ASN A 42 11.175 -32.294 -18.048 1.00 10.10 H new ATOM 0 HA ASN A 42 12.170 -29.681 -18.660 1.00 44.11 H new ATOM 0 HB2 ASN A 42 9.505 -30.259 -17.361 1.00 60.33 H new ATOM 0 HB3 ASN A 42 9.906 -29.038 -18.552 1.00 60.33 H new ATOM 0 HD21 ASN A 42 8.093 -32.220 -19.904 1.00 51.14 H new ATOM 0 HD22 ASN A 42 7.910 -31.396 -18.352 1.00 51.14 H new ATOM 681 N VAL A 43 11.832 -30.559 -15.542 1.00 20.43 N ATOM 682 CA VAL A 43 12.096 -30.158 -14.165 1.00 35.51 C ATOM 683 C VAL A 43 13.593 -30.115 -13.882 1.00 50.13 C ATOM 684 O VAL A 43 14.035 -29.496 -12.916 1.00 2.35 O ATOM 685 CB VAL A 43 11.423 -31.116 -13.163 1.00 53.41 C ATOM 686 CG1 VAL A 43 11.722 -30.689 -11.734 1.00 33.31 C ATOM 687 CG2 VAL A 43 9.923 -31.174 -13.408 1.00 75.00 C ATOM 0 H VAL A 43 11.617 -31.549 -15.659 1.00 20.43 H new ATOM 0 HA VAL A 43 11.677 -29.160 -14.040 1.00 35.51 H new ATOM 0 HB VAL A 43 11.831 -32.116 -13.311 1.00 53.41 H new ATOM 0 HG11 VAL A 43 11.239 -31.377 -11.040 1.00 33.31 H new ATOM 0 HG12 VAL A 43 12.799 -30.703 -11.568 1.00 33.31 H new ATOM 0 HG13 VAL A 43 11.343 -29.681 -11.569 1.00 33.31 H new ATOM 0 HG21 VAL A 43 9.463 -31.855 -12.692 1.00 75.00 H new ATOM 0 HG22 VAL A 43 9.496 -30.178 -13.288 1.00 75.00 H new ATOM 0 HG23 VAL A 43 9.733 -31.530 -14.421 1.00 75.00 H new ATOM 697 N GLY A 44 14.370 -30.777 -14.734 1.00 62.20 N ATOM 698 CA GLY A 44 15.811 -30.801 -14.559 1.00 74.30 C ATOM 699 C GLY A 44 16.532 -29.927 -15.566 1.00 33.12 C ATOM 700 O GLY A 44 17.703 -29.592 -15.382 1.00 73.14 O ATOM 0 H GLY A 44 14.028 -31.297 -15.542 1.00 62.20 H new ATOM 0 HA2 GLY A 44 16.057 -30.467 -13.551 1.00 74.30 H new ATOM 0 HA3 GLY A 44 16.168 -31.827 -14.651 1.00 74.30 H new ATOM 704 N LEU A 45 15.833 -29.558 -16.633 1.00 50.55 N ATOM 705 CA LEU A 45 16.414 -28.718 -17.675 1.00 43.22 C ATOM 706 C LEU A 45 16.302 -27.241 -17.310 1.00 73.12 C ATOM 707 O LEU A 45 16.794 -26.372 -18.031 1.00 24.42 O ATOM 708 CB LEU A 45 15.721 -28.978 -19.014 1.00 22.43 C ATOM 709 CG LEU A 45 16.219 -30.190 -19.803 1.00 1.32 C ATOM 710 CD1 LEU A 45 15.133 -30.702 -20.737 1.00 3.45 C ATOM 711 CD2 LEU A 45 17.475 -29.837 -20.586 1.00 4.44 C ATOM 0 H LEU A 45 14.863 -29.827 -16.800 1.00 50.55 H new ATOM 0 HA LEU A 45 17.470 -28.972 -17.764 1.00 43.22 H new ATOM 0 HB2 LEU A 45 14.654 -29.103 -18.830 1.00 22.43 H new ATOM 0 HB3 LEU A 45 15.835 -28.091 -19.638 1.00 22.43 H new ATOM 0 HG LEU A 45 16.466 -30.983 -19.097 1.00 1.32 H new ATOM 0 HD11 LEU A 45 15.505 -31.564 -21.290 1.00 3.45 H new ATOM 0 HD12 LEU A 45 14.260 -30.994 -20.154 1.00 3.45 H new ATOM 0 HD13 LEU A 45 14.854 -29.915 -21.437 1.00 3.45 H new ATOM 0 HD21 LEU A 45 17.815 -30.711 -21.141 1.00 4.44 H new ATOM 0 HD22 LEU A 45 17.254 -29.028 -21.282 1.00 4.44 H new ATOM 0 HD23 LEU A 45 18.256 -29.519 -19.896 1.00 4.44 H new ATOM 723 N THR A 46 15.651 -26.963 -16.185 1.00 4.25 N ATOM 724 CA THR A 46 15.475 -25.592 -15.723 1.00 11.23 C ATOM 725 C THR A 46 16.678 -25.126 -14.911 1.00 0.12 C ATOM 726 O THR A 46 17.188 -24.023 -15.114 1.00 60.32 O ATOM 727 CB THR A 46 14.204 -25.447 -14.865 1.00 32.22 C ATOM 728 OG1 THR A 46 13.266 -26.475 -15.202 1.00 34.01 O ATOM 729 CG2 THR A 46 13.564 -24.082 -15.071 1.00 23.33 C ATOM 0 H THR A 46 15.237 -27.669 -15.577 1.00 4.25 H new ATOM 0 HA THR A 46 15.377 -24.969 -16.612 1.00 11.23 H new ATOM 0 HB THR A 46 14.487 -25.543 -13.817 1.00 32.22 H new ATOM 0 HG1 THR A 46 12.370 -26.209 -14.909 1.00 34.01 H new ATOM 0 HG21 THR A 46 12.668 -24.003 -14.455 1.00 23.33 H new ATOM 0 HG22 THR A 46 14.270 -23.302 -14.786 1.00 23.33 H new ATOM 0 HG23 THR A 46 13.294 -23.961 -16.120 1.00 23.33 H new ATOM 737 N LEU A 47 17.128 -25.972 -13.991 1.00 3.12 N ATOM 738 CA LEU A 47 18.274 -25.647 -13.148 1.00 14.13 C ATOM 739 C LEU A 47 19.539 -25.490 -13.985 1.00 20.52 C ATOM 740 O LEU A 47 20.285 -24.524 -13.826 1.00 11.03 O ATOM 741 CB LEU A 47 18.479 -26.734 -12.091 1.00 14.41 C ATOM 742 CG LEU A 47 18.510 -28.173 -12.606 1.00 31.13 C ATOM 743 CD1 LEU A 47 19.945 -28.644 -12.786 1.00 75.40 C ATOM 744 CD2 LEU A 47 17.759 -29.095 -11.656 1.00 71.44 C ATOM 0 H LEU A 47 16.717 -26.888 -13.810 1.00 3.12 H new ATOM 0 HA LEU A 47 18.070 -24.699 -12.650 1.00 14.13 H new ATOM 0 HB2 LEU A 47 19.416 -26.535 -11.571 1.00 14.41 H new ATOM 0 HB3 LEU A 47 17.681 -26.650 -11.353 1.00 14.41 H new ATOM 0 HG LEU A 47 18.015 -28.203 -13.577 1.00 31.13 H new ATOM 0 HD11 LEU A 47 19.948 -29.670 -13.153 1.00 75.40 H new ATOM 0 HD12 LEU A 47 20.452 -28.000 -13.505 1.00 75.40 H new ATOM 0 HD13 LEU A 47 20.465 -28.600 -11.829 1.00 75.40 H new ATOM 0 HD21 LEU A 47 17.791 -30.115 -12.038 1.00 71.44 H new ATOM 0 HD22 LEU A 47 18.226 -29.061 -10.671 1.00 71.44 H new ATOM 0 HD23 LEU A 47 16.722 -28.770 -11.577 1.00 71.44 H new ATOM 756 N ARG A 48 19.773 -26.446 -14.878 1.00 24.31 N ATOM 757 CA ARG A 48 20.948 -26.414 -15.741 1.00 30.20 C ATOM 758 C ARG A 48 20.859 -25.262 -16.738 1.00 34.40 C ATOM 759 O ARG A 48 21.841 -24.919 -17.397 1.00 35.42 O ATOM 760 CB ARG A 48 21.094 -27.740 -16.489 1.00 72.43 C ATOM 761 CG ARG A 48 19.897 -28.082 -17.363 1.00 5.25 C ATOM 762 CD ARG A 48 20.015 -29.481 -17.946 1.00 71.11 C ATOM 763 NE ARG A 48 21.240 -29.649 -18.723 1.00 22.23 N ATOM 764 CZ ARG A 48 21.737 -30.833 -19.066 1.00 14.35 C ATOM 765 NH1 ARG A 48 21.115 -31.946 -18.702 1.00 61.24 N ATOM 766 NH2 ARG A 48 22.857 -30.904 -19.773 1.00 54.04 N ATOM 0 H ARG A 48 19.165 -27.252 -15.023 1.00 24.31 H new ATOM 0 HA ARG A 48 21.825 -26.261 -15.113 1.00 30.20 H new ATOM 0 HB2 ARG A 48 21.988 -27.700 -17.111 1.00 72.43 H new ATOM 0 HB3 ARG A 48 21.245 -28.541 -15.765 1.00 72.43 H new ATOM 0 HG2 ARG A 48 18.982 -28.008 -16.775 1.00 5.25 H new ATOM 0 HG3 ARG A 48 19.816 -27.355 -18.171 1.00 5.25 H new ATOM 0 HD2 ARG A 48 19.995 -30.213 -17.139 1.00 71.11 H new ATOM 0 HD3 ARG A 48 19.152 -29.683 -18.581 1.00 71.11 H new ATOM 0 HE ARG A 48 21.742 -28.812 -19.019 1.00 22.23 H new ATOM 0 HH11 ARG A 48 20.254 -31.894 -18.158 1.00 61.24 H new ATOM 0 HH12 ARG A 48 21.498 -32.854 -18.966 1.00 61.24 H new ATOM 0 HH21 ARG A 48 23.338 -30.049 -20.054 1.00 54.04 H new ATOM 0 HH22 ARG A 48 23.238 -31.813 -20.036 1.00 54.04 H new ATOM 780 N LYS A 49 19.674 -24.669 -16.844 1.00 65.20 N ATOM 781 CA LYS A 49 19.455 -23.556 -17.759 1.00 43.44 C ATOM 782 C LYS A 49 19.556 -22.221 -17.027 1.00 32.40 C ATOM 783 O LYS A 49 19.953 -21.211 -17.608 1.00 44.23 O ATOM 784 CB LYS A 49 18.085 -23.680 -18.428 1.00 75.41 C ATOM 785 CG LYS A 49 17.814 -22.605 -19.466 1.00 71.22 C ATOM 786 CD LYS A 49 16.350 -22.200 -19.480 1.00 54.34 C ATOM 787 CE LYS A 49 15.450 -23.372 -19.840 1.00 20.31 C ATOM 788 NZ LYS A 49 14.089 -22.924 -20.245 1.00 0.54 N ATOM 0 H LYS A 49 18.851 -24.941 -16.307 1.00 65.20 H new ATOM 0 HA LYS A 49 20.230 -23.590 -18.524 1.00 43.44 H new ATOM 0 HB2 LYS A 49 18.009 -24.658 -18.903 1.00 75.41 H new ATOM 0 HB3 LYS A 49 17.311 -23.637 -17.662 1.00 75.41 H new ATOM 0 HG2 LYS A 49 18.432 -21.732 -19.257 1.00 71.22 H new ATOM 0 HG3 LYS A 49 18.101 -22.970 -20.452 1.00 71.22 H new ATOM 0 HD2 LYS A 49 16.070 -21.812 -18.501 1.00 54.34 H new ATOM 0 HD3 LYS A 49 16.202 -21.393 -20.197 1.00 54.34 H new ATOM 0 HE2 LYS A 49 15.902 -23.940 -20.653 1.00 20.31 H new ATOM 0 HE3 LYS A 49 15.371 -24.045 -18.986 1.00 20.31 H new ATOM 0 HZ1 LYS A 49 13.507 -23.753 -20.482 1.00 0.54 H new ATOM 0 HZ2 LYS A 49 13.647 -22.404 -19.460 1.00 0.54 H new ATOM 0 HZ3 LYS A 49 14.161 -22.302 -21.076 1.00 0.54 H new ATOM 802 N LEU A 50 19.195 -22.225 -15.749 1.00 14.14 N ATOM 803 CA LEU A 50 19.246 -21.015 -14.936 1.00 14.52 C ATOM 804 C LEU A 50 20.593 -20.888 -14.232 1.00 13.05 C ATOM 805 O LEU A 50 20.978 -19.802 -13.798 1.00 51.44 O ATOM 806 CB LEU A 50 18.116 -21.022 -13.904 1.00 4.50 C ATOM 807 CG LEU A 50 18.266 -22.016 -12.752 1.00 51.01 C ATOM 808 CD1 LEU A 50 19.071 -21.402 -11.618 1.00 3.23 C ATOM 809 CD2 LEU A 50 16.900 -22.466 -12.256 1.00 33.43 C ATOM 0 H LEU A 50 18.864 -23.053 -15.253 1.00 14.14 H new ATOM 0 HA LEU A 50 19.121 -20.157 -15.597 1.00 14.52 H new ATOM 0 HB2 LEU A 50 18.028 -20.020 -13.484 1.00 4.50 H new ATOM 0 HB3 LEU A 50 17.180 -21.234 -14.421 1.00 4.50 H new ATOM 0 HG LEU A 50 18.804 -22.890 -13.119 1.00 51.01 H new ATOM 0 HD11 LEU A 50 19.167 -22.124 -10.807 1.00 3.23 H new ATOM 0 HD12 LEU A 50 20.062 -21.130 -11.981 1.00 3.23 H new ATOM 0 HD13 LEU A 50 18.562 -20.511 -11.251 1.00 3.23 H new ATOM 0 HD21 LEU A 50 17.025 -23.173 -11.436 1.00 33.43 H new ATOM 0 HD22 LEU A 50 16.337 -21.601 -11.906 1.00 33.43 H new ATOM 0 HD23 LEU A 50 16.358 -22.947 -13.070 1.00 33.43 H new ATOM 821 N ILE A 51 21.305 -22.004 -14.123 1.00 33.53 N ATOM 822 CA ILE A 51 22.610 -22.017 -13.474 1.00 61.33 C ATOM 823 C ILE A 51 23.543 -20.984 -14.097 1.00 23.33 C ATOM 824 O ILE A 51 24.407 -20.426 -13.421 1.00 54.55 O ATOM 825 CB ILE A 51 23.269 -23.407 -13.562 1.00 52.43 C ATOM 826 CG1 ILE A 51 22.780 -24.300 -12.420 1.00 43.02 C ATOM 827 CG2 ILE A 51 24.784 -23.277 -13.530 1.00 23.23 C ATOM 828 CD1 ILE A 51 22.772 -25.773 -12.766 1.00 3.40 C ATOM 0 H ILE A 51 21.000 -22.911 -14.476 1.00 33.53 H new ATOM 0 HA ILE A 51 22.444 -21.769 -12.426 1.00 61.33 H new ATOM 0 HB ILE A 51 22.984 -23.870 -14.507 1.00 52.43 H new ATOM 0 HG12 ILE A 51 23.416 -24.143 -11.549 1.00 43.02 H new ATOM 0 HG13 ILE A 51 21.772 -23.996 -12.138 1.00 43.02 H new ATOM 0 HG21 ILE A 51 25.236 -24.267 -13.593 1.00 23.23 H new ATOM 0 HG22 ILE A 51 25.115 -22.673 -14.375 1.00 23.23 H new ATOM 0 HG23 ILE A 51 25.088 -22.798 -12.600 1.00 23.23 H new ATOM 0 HD11 ILE A 51 22.414 -26.346 -11.910 1.00 3.40 H new ATOM 0 HD12 ILE A 51 22.113 -25.943 -13.618 1.00 3.40 H new ATOM 0 HD13 ILE A 51 23.783 -26.093 -13.020 1.00 3.40 H new ATOM 840 N GLY A 52 23.362 -20.734 -15.390 1.00 11.21 N ATOM 841 CA GLY A 52 24.194 -19.767 -16.082 1.00 13.30 C ATOM 842 C GLY A 52 23.927 -18.344 -15.631 1.00 23.55 C ATOM 843 O GLY A 52 24.755 -17.456 -15.834 1.00 74.13 O ATOM 0 H GLY A 52 22.654 -21.184 -15.971 1.00 11.21 H new ATOM 0 HA2 GLY A 52 25.243 -20.008 -15.912 1.00 13.30 H new ATOM 0 HA3 GLY A 52 24.019 -19.844 -17.155 1.00 13.30 H new ATOM 847 N SER A 53 22.768 -18.127 -15.017 1.00 24.21 N ATOM 848 CA SER A 53 22.393 -16.801 -14.540 1.00 74.33 C ATOM 849 C SER A 53 23.292 -16.363 -13.389 1.00 45.41 C ATOM 850 O SER A 53 23.745 -15.219 -13.341 1.00 10.33 O ATOM 851 CB SER A 53 20.930 -16.793 -14.091 1.00 61.31 C ATOM 852 OG SER A 53 20.783 -17.408 -12.823 1.00 10.45 O ATOM 0 H SER A 53 22.073 -18.852 -14.838 1.00 24.21 H new ATOM 0 HA SER A 53 22.518 -16.097 -15.363 1.00 74.33 H new ATOM 0 HB2 SER A 53 20.566 -15.767 -14.045 1.00 61.31 H new ATOM 0 HB3 SER A 53 20.318 -17.316 -14.826 1.00 61.31 H new ATOM 0 HG SER A 53 21.072 -18.343 -12.877 1.00 10.45 H new ATOM 858 N VAL A 54 23.548 -17.281 -12.463 1.00 30.12 N ATOM 859 CA VAL A 54 24.394 -16.991 -11.312 1.00 24.14 C ATOM 860 C VAL A 54 25.869 -17.162 -11.657 1.00 64.10 C ATOM 861 O VAL A 54 26.729 -16.464 -11.118 1.00 73.05 O ATOM 862 CB VAL A 54 24.049 -17.901 -10.118 1.00 2.03 C ATOM 863 CG1 VAL A 54 24.728 -17.401 -8.852 1.00 22.44 C ATOM 864 CG2 VAL A 54 22.542 -17.981 -9.928 1.00 60.41 C ATOM 0 H VAL A 54 23.181 -18.232 -12.488 1.00 30.12 H new ATOM 0 HA VAL A 54 24.206 -15.954 -11.035 1.00 24.14 H new ATOM 0 HB VAL A 54 24.420 -18.904 -10.329 1.00 2.03 H new ATOM 0 HG11 VAL A 54 24.473 -18.056 -8.019 1.00 22.44 H new ATOM 0 HG12 VAL A 54 25.809 -17.400 -8.995 1.00 22.44 H new ATOM 0 HG13 VAL A 54 24.390 -16.388 -8.634 1.00 22.44 H new ATOM 0 HG21 VAL A 54 22.316 -18.628 -9.080 1.00 60.41 H new ATOM 0 HG22 VAL A 54 22.146 -16.983 -9.739 1.00 60.41 H new ATOM 0 HG23 VAL A 54 22.083 -18.389 -10.828 1.00 60.41 H new ATOM 874 N ASP A 55 26.156 -18.095 -12.559 1.00 12.43 N ATOM 875 CA ASP A 55 27.528 -18.357 -12.978 1.00 54.02 C ATOM 876 C ASP A 55 28.179 -17.092 -13.529 1.00 32.12 C ATOM 877 O ASP A 55 29.386 -16.894 -13.393 1.00 3.03 O ATOM 878 CB ASP A 55 27.558 -19.463 -14.035 1.00 11.53 C ATOM 879 CG ASP A 55 27.484 -20.848 -13.425 1.00 23.54 C ATOM 880 OD1 ASP A 55 27.546 -20.953 -12.182 1.00 34.30 O ATOM 881 OD2 ASP A 55 27.366 -21.828 -14.190 1.00 23.50 O ATOM 0 H ASP A 55 25.457 -18.682 -13.014 1.00 12.43 H new ATOM 0 HA ASP A 55 28.093 -18.684 -12.105 1.00 54.02 H new ATOM 0 HB2 ASP A 55 26.723 -19.327 -14.723 1.00 11.53 H new ATOM 0 HB3 ASP A 55 28.472 -19.376 -14.622 1.00 11.53 H new ATOM 886 N ASP A 56 27.372 -16.240 -14.151 1.00 73.43 N ATOM 887 CA ASP A 56 27.869 -14.994 -14.723 1.00 21.31 C ATOM 888 C ASP A 56 28.213 -13.992 -13.625 1.00 70.24 C ATOM 889 O ASP A 56 28.877 -12.985 -13.875 1.00 63.40 O ATOM 890 CB ASP A 56 26.831 -14.394 -15.672 1.00 42.32 C ATOM 891 CG ASP A 56 26.899 -14.997 -17.061 1.00 64.04 C ATOM 892 OD1 ASP A 56 27.186 -16.208 -17.169 1.00 42.13 O ATOM 893 OD2 ASP A 56 26.665 -14.259 -18.041 1.00 2.44 O ATOM 0 H ASP A 56 26.370 -16.389 -14.272 1.00 73.43 H new ATOM 0 HA ASP A 56 28.776 -15.216 -15.284 1.00 21.31 H new ATOM 0 HB2 ASP A 56 25.834 -14.549 -15.260 1.00 42.32 H new ATOM 0 HB3 ASP A 56 26.984 -13.317 -15.739 1.00 42.32 H new ATOM 898 N LEU A 57 27.756 -14.274 -12.410 1.00 50.42 N ATOM 899 CA LEU A 57 28.014 -13.396 -11.274 1.00 21.34 C ATOM 900 C LEU A 57 29.004 -14.036 -10.306 1.00 30.45 C ATOM 901 O LEU A 57 29.464 -13.397 -9.358 1.00 61.43 O ATOM 902 CB LEU A 57 26.708 -13.074 -10.546 1.00 52.30 C ATOM 903 CG LEU A 57 26.481 -11.603 -10.195 1.00 14.01 C ATOM 904 CD1 LEU A 57 25.022 -11.224 -10.401 1.00 62.10 C ATOM 905 CD2 LEU A 57 26.908 -11.325 -8.761 1.00 43.43 C ATOM 0 H LEU A 57 27.205 -15.103 -12.186 1.00 50.42 H new ATOM 0 HA LEU A 57 28.449 -12.471 -11.652 1.00 21.34 H new ATOM 0 HB2 LEU A 57 25.877 -13.411 -11.166 1.00 52.30 H new ATOM 0 HB3 LEU A 57 26.676 -13.656 -9.625 1.00 52.30 H new ATOM 0 HG LEU A 57 27.092 -10.992 -10.860 1.00 14.01 H new ATOM 0 HD11 LEU A 57 24.879 -10.174 -10.146 1.00 62.10 H new ATOM 0 HD12 LEU A 57 24.748 -11.385 -11.444 1.00 62.10 H new ATOM 0 HD13 LEU A 57 24.392 -11.841 -9.761 1.00 62.10 H new ATOM 0 HD21 LEU A 57 26.739 -10.274 -8.529 1.00 43.43 H new ATOM 0 HD22 LEU A 57 26.324 -11.945 -8.081 1.00 43.43 H new ATOM 0 HD23 LEU A 57 27.967 -11.557 -8.645 1.00 43.43 H new ATOM 917 N LEU A 58 29.329 -15.301 -10.550 1.00 44.25 N ATOM 918 CA LEU A 58 30.267 -16.028 -9.702 1.00 2.33 C ATOM 919 C LEU A 58 31.528 -15.205 -9.455 1.00 20.52 C ATOM 920 O LEU A 58 31.889 -14.903 -8.317 1.00 73.21 O ATOM 921 CB LEU A 58 30.635 -17.366 -10.344 1.00 62.23 C ATOM 922 CG LEU A 58 30.307 -18.616 -9.527 1.00 3.03 C ATOM 923 CD1 LEU A 58 30.862 -19.859 -10.206 1.00 15.33 C ATOM 924 CD2 LEU A 58 30.857 -18.488 -8.113 1.00 60.15 C ATOM 0 H LEU A 58 28.956 -15.845 -11.329 1.00 44.25 H new ATOM 0 HA LEU A 58 29.783 -16.214 -8.743 1.00 2.33 H new ATOM 0 HB2 LEU A 58 30.123 -17.439 -11.303 1.00 62.23 H new ATOM 0 HB3 LEU A 58 31.705 -17.364 -10.553 1.00 62.23 H new ATOM 0 HG LEU A 58 29.223 -18.713 -9.467 1.00 3.03 H new ATOM 0 HD11 LEU A 58 30.619 -20.739 -9.610 1.00 15.33 H new ATOM 0 HD12 LEU A 58 30.421 -19.959 -11.198 1.00 15.33 H new ATOM 0 HD13 LEU A 58 31.945 -19.771 -10.298 1.00 15.33 H new ATOM 0 HD21 LEU A 58 30.614 -19.386 -7.546 1.00 60.15 H new ATOM 0 HD22 LEU A 58 31.939 -18.365 -8.153 1.00 60.15 H new ATOM 0 HD23 LEU A 58 30.412 -17.620 -7.626 1.00 60.15 H new ATOM 936 N PRO A 59 32.214 -14.832 -10.545 1.00 64.21 N ATOM 937 CA PRO A 59 33.444 -14.037 -10.473 1.00 31.32 C ATOM 938 C PRO A 59 33.181 -12.603 -10.027 1.00 5.11 C ATOM 939 O PRO A 59 34.115 -11.836 -9.790 1.00 34.04 O ATOM 940 CB PRO A 59 33.968 -14.063 -11.911 1.00 11.12 C ATOM 941 CG PRO A 59 32.759 -14.289 -12.751 1.00 35.43 C ATOM 942 CD PRO A 59 31.843 -15.157 -11.932 1.00 73.04 C ATOM 0 HA PRO A 59 34.147 -14.438 -9.742 1.00 31.32 H new ATOM 0 HB2 PRO A 59 34.460 -13.126 -12.170 1.00 11.12 H new ATOM 0 HB3 PRO A 59 34.701 -14.857 -12.051 1.00 11.12 H new ATOM 0 HG2 PRO A 59 32.278 -13.344 -13.005 1.00 35.43 H new ATOM 0 HG3 PRO A 59 33.022 -14.776 -13.690 1.00 35.43 H new ATOM 0 HD2 PRO A 59 30.795 -14.934 -12.130 1.00 73.04 H new ATOM 0 HD3 PRO A 59 31.991 -16.215 -12.150 1.00 73.04 H new ATOM 950 N SER A 60 31.906 -12.247 -9.914 1.00 72.05 N ATOM 951 CA SER A 60 31.521 -10.903 -9.500 1.00 52.00 C ATOM 952 C SER A 60 31.037 -10.898 -8.053 1.00 60.41 C ATOM 953 O SER A 60 30.252 -10.039 -7.651 1.00 52.53 O ATOM 954 CB SER A 60 30.425 -10.358 -10.418 1.00 11.32 C ATOM 955 OG SER A 60 30.973 -9.854 -11.623 1.00 44.43 O ATOM 0 H SER A 60 31.121 -12.871 -10.103 1.00 72.05 H new ATOM 0 HA SER A 60 32.399 -10.261 -9.574 1.00 52.00 H new ATOM 0 HB2 SER A 60 29.709 -11.148 -10.643 1.00 11.32 H new ATOM 0 HB3 SER A 60 29.877 -9.567 -9.906 1.00 11.32 H new ATOM 0 HG SER A 60 30.252 -9.513 -12.193 1.00 44.43 H new ATOM 961 N LEU A 61 31.511 -11.865 -7.275 1.00 1.35 N ATOM 962 CA LEU A 61 31.128 -11.974 -5.871 1.00 40.31 C ATOM 963 C LEU A 61 32.198 -11.372 -4.966 1.00 43.02 C ATOM 964 O LEU A 61 33.336 -11.142 -5.377 1.00 51.10 O ATOM 965 CB LEU A 61 30.894 -13.439 -5.498 1.00 55.34 C ATOM 966 CG LEU A 61 29.436 -13.855 -5.298 1.00 20.15 C ATOM 967 CD1 LEU A 61 28.731 -13.995 -6.638 1.00 23.31 C ATOM 968 CD2 LEU A 61 29.357 -15.156 -4.512 1.00 75.34 C ATOM 0 H LEU A 61 32.161 -12.585 -7.592 1.00 1.35 H new ATOM 0 HA LEU A 61 30.202 -11.417 -5.728 1.00 40.31 H new ATOM 0 HB2 LEU A 61 31.326 -14.065 -6.278 1.00 55.34 H new ATOM 0 HB3 LEU A 61 31.441 -13.651 -4.579 1.00 55.34 H new ATOM 0 HG LEU A 61 28.931 -13.076 -4.726 1.00 20.15 H new ATOM 0 HD11 LEU A 61 27.695 -14.292 -6.475 1.00 23.31 H new ATOM 0 HD12 LEU A 61 28.757 -13.041 -7.164 1.00 23.31 H new ATOM 0 HD13 LEU A 61 29.235 -14.753 -7.237 1.00 23.31 H new ATOM 0 HD21 LEU A 61 28.313 -15.438 -4.379 1.00 75.34 H new ATOM 0 HD22 LEU A 61 29.878 -15.943 -5.057 1.00 75.34 H new ATOM 0 HD23 LEU A 61 29.824 -15.021 -3.536 1.00 75.34 H new ATOM 980 N PRO A 62 31.828 -11.112 -3.703 1.00 63.34 N ATOM 981 CA PRO A 62 32.743 -10.537 -2.713 1.00 11.41 C ATOM 982 C PRO A 62 33.835 -11.515 -2.295 1.00 44.13 C ATOM 983 O PRO A 62 34.667 -11.204 -1.442 1.00 70.54 O ATOM 984 CB PRO A 62 31.828 -10.219 -1.528 1.00 11.04 C ATOM 985 CG PRO A 62 30.685 -11.164 -1.667 1.00 61.42 C ATOM 986 CD PRO A 62 30.489 -11.361 -3.145 1.00 74.20 C ATOM 0 HA PRO A 62 33.274 -9.669 -3.105 1.00 11.41 H new ATOM 0 HB2 PRO A 62 32.346 -10.361 -0.579 1.00 11.04 H new ATOM 0 HB3 PRO A 62 31.491 -9.183 -1.555 1.00 11.04 H new ATOM 0 HG2 PRO A 62 30.899 -12.111 -1.172 1.00 61.42 H new ATOM 0 HG3 PRO A 62 29.785 -10.759 -1.204 1.00 61.42 H new ATOM 0 HD2 PRO A 62 30.139 -12.368 -3.373 1.00 74.20 H new ATOM 0 HD3 PRO A 62 29.750 -10.668 -3.548 1.00 74.20 H new ATOM 994 N SER A 63 33.828 -12.698 -2.902 1.00 11.41 N ATOM 995 CA SER A 63 34.817 -13.723 -2.590 1.00 52.11 C ATOM 996 C SER A 63 34.557 -14.328 -1.214 1.00 10.43 C ATOM 997 O SER A 63 35.365 -15.102 -0.701 1.00 1.30 O ATOM 998 CB SER A 63 36.228 -13.134 -2.643 1.00 14.53 C ATOM 999 OG SER A 63 36.348 -12.191 -3.694 1.00 14.32 O ATOM 0 H SER A 63 33.148 -12.970 -3.612 1.00 11.41 H new ATOM 0 HA SER A 63 34.733 -14.513 -3.336 1.00 52.11 H new ATOM 0 HB2 SER A 63 36.461 -12.655 -1.692 1.00 14.53 H new ATOM 0 HB3 SER A 63 36.954 -13.934 -2.784 1.00 14.53 H new ATOM 0 HG SER A 63 37.258 -11.828 -3.705 1.00 14.32 H new ATOM 1005 N SER A 64 33.423 -13.968 -0.621 1.00 31.11 N ATOM 1006 CA SER A 64 33.057 -14.471 0.698 1.00 72.31 C ATOM 1007 C SER A 64 31.872 -15.428 0.605 1.00 53.43 C ATOM 1008 O SER A 64 31.793 -16.410 1.342 1.00 64.21 O ATOM 1009 CB SER A 64 32.717 -13.310 1.634 1.00 41.10 C ATOM 1010 OG SER A 64 32.233 -13.783 2.879 1.00 73.13 O ATOM 0 H SER A 64 32.742 -13.330 -1.033 1.00 31.11 H new ATOM 0 HA SER A 64 33.911 -15.015 1.102 1.00 72.31 H new ATOM 0 HB2 SER A 64 33.604 -12.697 1.794 1.00 41.10 H new ATOM 0 HB3 SER A 64 31.967 -12.671 1.168 1.00 41.10 H new ATOM 0 HG SER A 64 32.024 -13.022 3.460 1.00 73.13 H new ATOM 1016 N SER A 65 30.951 -15.132 -0.307 1.00 41.23 N ATOM 1017 CA SER A 65 29.767 -15.962 -0.496 1.00 22.14 C ATOM 1018 C SER A 65 29.878 -16.783 -1.777 1.00 34.01 C ATOM 1019 O SER A 65 28.875 -17.254 -2.314 1.00 12.03 O ATOM 1020 CB SER A 65 28.510 -15.092 -0.541 1.00 12.21 C ATOM 1021 OG SER A 65 27.979 -14.895 0.758 1.00 34.21 O ATOM 0 H SER A 65 31.002 -14.323 -0.927 1.00 41.23 H new ATOM 0 HA SER A 65 29.695 -16.647 0.349 1.00 22.14 H new ATOM 0 HB2 SER A 65 28.747 -14.128 -0.990 1.00 12.21 H new ATOM 0 HB3 SER A 65 27.760 -15.564 -1.176 1.00 12.21 H new ATOM 0 HG SER A 65 27.177 -14.334 0.702 1.00 34.21 H new ATOM 1027 N ARG A 66 31.104 -16.950 -2.261 1.00 51.03 N ATOM 1028 CA ARG A 66 31.347 -17.713 -3.480 1.00 13.51 C ATOM 1029 C ARG A 66 31.120 -19.203 -3.243 1.00 5.21 C ATOM 1030 O ARG A 66 30.534 -19.894 -4.077 1.00 2.22 O ATOM 1031 CB ARG A 66 32.773 -17.475 -3.980 1.00 30.44 C ATOM 1032 CG ARG A 66 32.938 -17.692 -5.475 1.00 24.41 C ATOM 1033 CD ARG A 66 34.356 -17.382 -5.929 1.00 60.04 C ATOM 1034 NE ARG A 66 34.645 -17.946 -7.245 1.00 71.21 N ATOM 1035 CZ ARG A 66 35.868 -18.030 -7.756 1.00 61.32 C ATOM 1036 NH1 ARG A 66 36.910 -17.589 -7.066 1.00 25.44 N ATOM 1037 NH2 ARG A 66 36.050 -18.557 -8.961 1.00 4.35 N ATOM 0 H ARG A 66 31.945 -16.567 -1.828 1.00 51.03 H new ATOM 0 HA ARG A 66 30.642 -17.373 -4.239 1.00 13.51 H new ATOM 0 HB2 ARG A 66 33.070 -16.455 -3.734 1.00 30.44 H new ATOM 0 HB3 ARG A 66 33.452 -18.141 -3.448 1.00 30.44 H new ATOM 0 HG2 ARG A 66 32.693 -18.725 -5.723 1.00 24.41 H new ATOM 0 HG3 ARG A 66 32.235 -17.059 -6.016 1.00 24.41 H new ATOM 0 HD2 ARG A 66 34.499 -16.302 -5.958 1.00 60.04 H new ATOM 0 HD3 ARG A 66 35.064 -17.778 -5.201 1.00 60.04 H new ATOM 0 HE ARG A 66 33.865 -18.294 -7.802 1.00 71.21 H new ATOM 0 HH11 ARG A 66 36.774 -17.184 -6.140 1.00 25.44 H new ATOM 0 HH12 ARG A 66 37.848 -17.655 -7.461 1.00 25.44 H new ATOM 0 HH21 ARG A 66 35.250 -18.898 -9.495 1.00 4.35 H new ATOM 0 HH22 ARG A 66 36.989 -18.621 -9.353 1.00 4.35 H new ATOM 1051 N THR A 67 31.590 -19.693 -2.100 1.00 20.03 N ATOM 1052 CA THR A 67 31.441 -21.101 -1.753 1.00 51.23 C ATOM 1053 C THR A 67 29.979 -21.529 -1.811 1.00 21.41 C ATOM 1054 O THR A 67 29.676 -22.710 -1.975 1.00 72.52 O ATOM 1055 CB THR A 67 31.995 -21.395 -0.347 1.00 2.15 C ATOM 1056 OG1 THR A 67 33.173 -20.616 -0.111 1.00 43.54 O ATOM 1057 CG2 THR A 67 32.319 -22.873 -0.191 1.00 25.02 C ATOM 0 H THR A 67 32.077 -19.135 -1.399 1.00 20.03 H new ATOM 0 HA THR A 67 32.013 -21.670 -2.486 1.00 51.23 H new ATOM 0 HB THR A 67 31.231 -21.128 0.383 1.00 2.15 H new ATOM 0 HG1 THR A 67 33.518 -20.808 0.786 1.00 43.54 H new ATOM 0 HG21 THR A 67 32.709 -23.056 0.810 1.00 25.02 H new ATOM 0 HG22 THR A 67 31.414 -23.462 -0.342 1.00 25.02 H new ATOM 0 HG23 THR A 67 33.067 -23.162 -0.930 1.00 25.02 H new ATOM 1065 N GLU A 68 29.078 -20.562 -1.675 1.00 53.33 N ATOM 1066 CA GLU A 68 27.647 -20.841 -1.712 1.00 50.01 C ATOM 1067 C GLU A 68 27.195 -21.179 -3.130 1.00 31.12 C ATOM 1068 O GLU A 68 26.656 -22.258 -3.380 1.00 12.41 O ATOM 1069 CB GLU A 68 26.857 -19.641 -1.186 1.00 31.04 C ATOM 1070 CG GLU A 68 26.404 -19.796 0.257 1.00 43.44 C ATOM 1071 CD GLU A 68 27.564 -19.984 1.215 1.00 2.20 C ATOM 1072 OE1 GLU A 68 28.078 -21.118 1.310 1.00 11.23 O ATOM 1073 OE2 GLU A 68 27.958 -18.996 1.870 1.00 42.23 O ATOM 0 H GLU A 68 29.313 -19.579 -1.538 1.00 53.33 H new ATOM 0 HA GLU A 68 27.454 -21.702 -1.072 1.00 50.01 H new ATOM 0 HB2 GLU A 68 27.473 -18.746 -1.271 1.00 31.04 H new ATOM 0 HB3 GLU A 68 25.982 -19.487 -1.818 1.00 31.04 H new ATOM 0 HG2 GLU A 68 25.833 -18.915 0.551 1.00 43.44 H new ATOM 0 HG3 GLU A 68 25.732 -20.651 0.333 1.00 43.44 H new ATOM 1080 N ILE A 69 27.418 -20.250 -4.053 1.00 0.20 N ATOM 1081 CA ILE A 69 27.034 -20.449 -5.445 1.00 65.10 C ATOM 1082 C ILE A 69 27.834 -21.582 -6.079 1.00 24.12 C ATOM 1083 O ILE A 69 27.267 -22.496 -6.677 1.00 3.30 O ATOM 1084 CB ILE A 69 27.237 -19.167 -6.274 1.00 13.22 C ATOM 1085 CG1 ILE A 69 26.355 -18.039 -5.733 1.00 31.51 C ATOM 1086 CG2 ILE A 69 26.929 -19.430 -7.740 1.00 62.03 C ATOM 1087 CD1 ILE A 69 26.935 -16.660 -5.952 1.00 64.04 C ATOM 0 H ILE A 69 27.863 -19.352 -3.862 1.00 0.20 H new ATOM 0 HA ILE A 69 25.975 -20.709 -5.446 1.00 65.10 H new ATOM 0 HB ILE A 69 28.280 -18.860 -6.191 1.00 13.22 H new ATOM 0 HG12 ILE A 69 25.377 -18.093 -6.211 1.00 31.51 H new ATOM 0 HG13 ILE A 69 26.197 -18.192 -4.665 1.00 31.51 H new ATOM 0 HG21 ILE A 69 27.077 -18.515 -8.313 1.00 62.03 H new ATOM 0 HG22 ILE A 69 27.594 -20.206 -8.118 1.00 62.03 H new ATOM 0 HG23 ILE A 69 25.894 -19.758 -7.841 1.00 62.03 H new ATOM 0 HD11 ILE A 69 26.257 -15.911 -5.544 1.00 64.04 H new ATOM 0 HD12 ILE A 69 27.900 -16.587 -5.451 1.00 64.04 H new ATOM 0 HD13 ILE A 69 27.067 -16.486 -7.020 1.00 64.04 H new ATOM 1099 N GLU A 70 29.155 -21.516 -5.941 1.00 50.15 N ATOM 1100 CA GLU A 70 30.033 -22.537 -6.500 1.00 73.53 C ATOM 1101 C GLU A 70 29.586 -23.932 -6.072 1.00 74.32 C ATOM 1102 O GLU A 70 29.790 -24.910 -6.791 1.00 1.50 O ATOM 1103 CB GLU A 70 31.478 -22.296 -6.060 1.00 41.24 C ATOM 1104 CG GLU A 70 32.470 -22.277 -7.212 1.00 34.34 C ATOM 1105 CD GLU A 70 33.681 -23.152 -6.952 1.00 41.43 C ATOM 1106 OE1 GLU A 70 33.525 -24.391 -6.938 1.00 45.31 O ATOM 1107 OE2 GLU A 70 34.784 -22.597 -6.763 1.00 70.54 O ATOM 0 H GLU A 70 29.640 -20.767 -5.447 1.00 50.15 H new ATOM 0 HA GLU A 70 29.976 -22.473 -7.587 1.00 73.53 H new ATOM 0 HB2 GLU A 70 31.533 -21.346 -5.528 1.00 41.24 H new ATOM 0 HB3 GLU A 70 31.769 -23.074 -5.354 1.00 41.24 H new ATOM 0 HG2 GLU A 70 31.972 -22.613 -8.121 1.00 34.34 H new ATOM 0 HG3 GLU A 70 32.798 -21.252 -7.388 1.00 34.34 H new ATOM 1114 N GLY A 71 28.974 -24.016 -4.894 1.00 40.04 N ATOM 1115 CA GLY A 71 28.508 -25.294 -4.390 1.00 22.43 C ATOM 1116 C GLY A 71 27.070 -25.580 -4.774 1.00 60.21 C ATOM 1117 O GLY A 71 26.692 -26.734 -4.982 1.00 12.32 O ATOM 0 H GLY A 71 28.793 -23.222 -4.280 1.00 40.04 H new ATOM 0 HA2 GLY A 71 29.148 -26.088 -4.775 1.00 22.43 H new ATOM 0 HA3 GLY A 71 28.600 -25.308 -3.304 1.00 22.43 H new ATOM 1121 N THR A 72 26.264 -24.527 -4.868 1.00 34.40 N ATOM 1122 CA THR A 72 24.858 -24.671 -5.227 1.00 4.31 C ATOM 1123 C THR A 72 24.705 -25.187 -6.653 1.00 0.10 C ATOM 1124 O THR A 72 23.998 -26.165 -6.895 1.00 43.34 O ATOM 1125 CB THR A 72 24.105 -23.334 -5.093 1.00 43.42 C ATOM 1126 OG1 THR A 72 24.161 -22.873 -3.738 1.00 61.25 O ATOM 1127 CG2 THR A 72 22.654 -23.485 -5.523 1.00 40.45 C ATOM 0 H THR A 72 26.560 -23.565 -4.701 1.00 34.40 H new ATOM 0 HA THR A 72 24.427 -25.394 -4.534 1.00 4.31 H new ATOM 0 HB THR A 72 24.587 -22.605 -5.744 1.00 43.42 H new ATOM 0 HG1 THR A 72 25.043 -22.485 -3.561 1.00 61.25 H new ATOM 0 HG21 THR A 72 22.142 -22.528 -5.420 1.00 40.45 H new ATOM 0 HG22 THR A 72 22.615 -23.807 -6.564 1.00 40.45 H new ATOM 0 HG23 THR A 72 22.164 -24.228 -4.894 1.00 40.45 H new ATOM 1135 N GLN A 73 25.372 -24.524 -7.592 1.00 52.13 N ATOM 1136 CA GLN A 73 25.309 -24.917 -8.995 1.00 34.11 C ATOM 1137 C GLN A 73 25.837 -26.335 -9.187 1.00 51.11 C ATOM 1138 O GLN A 73 25.562 -26.980 -10.199 1.00 54.21 O ATOM 1139 CB GLN A 73 26.110 -23.940 -9.857 1.00 21.20 C ATOM 1140 CG GLN A 73 25.794 -22.480 -9.575 1.00 64.14 C ATOM 1141 CD GLN A 73 24.337 -22.256 -9.222 1.00 44.31 C ATOM 1142 OE1 GLN A 73 23.971 -22.211 -8.047 1.00 62.43 O ATOM 1143 NE2 GLN A 73 23.497 -22.112 -10.240 1.00 35.22 N ATOM 0 H GLN A 73 25.962 -23.713 -7.407 1.00 52.13 H new ATOM 0 HA GLN A 73 24.265 -24.893 -9.307 1.00 34.11 H new ATOM 0 HB2 GLN A 73 27.174 -24.111 -9.693 1.00 21.20 H new ATOM 0 HB3 GLN A 73 25.912 -24.149 -10.908 1.00 21.20 H new ATOM 0 HG2 GLN A 73 26.421 -22.128 -8.755 1.00 64.14 H new ATOM 0 HG3 GLN A 73 26.048 -21.882 -10.450 1.00 64.14 H new ATOM 0 HE21 GLN A 73 23.844 -22.156 -11.198 1.00 35.22 H new ATOM 0 HE22 GLN A 73 22.504 -21.957 -10.064 1.00 35.22 H new ATOM 1152 N LYS A 74 26.598 -26.815 -8.209 1.00 51.15 N ATOM 1153 CA LYS A 74 27.165 -28.157 -8.269 1.00 40.13 C ATOM 1154 C LYS A 74 26.172 -29.191 -7.747 1.00 44.23 C ATOM 1155 O LYS A 74 25.974 -30.241 -8.360 1.00 51.43 O ATOM 1156 CB LYS A 74 28.460 -28.222 -7.457 1.00 23.11 C ATOM 1157 CG LYS A 74 28.869 -29.635 -7.077 1.00 4.31 C ATOM 1158 CD LYS A 74 28.347 -30.016 -5.702 1.00 3.43 C ATOM 1159 CE LYS A 74 29.471 -30.086 -4.679 1.00 12.12 C ATOM 1160 NZ LYS A 74 30.162 -31.404 -4.704 1.00 64.55 N ATOM 0 H LYS A 74 26.836 -26.294 -7.365 1.00 51.15 H new ATOM 0 HA LYS A 74 27.385 -28.385 -9.312 1.00 40.13 H new ATOM 0 HB2 LYS A 74 29.263 -27.762 -8.033 1.00 23.11 H new ATOM 0 HB3 LYS A 74 28.340 -27.631 -6.549 1.00 23.11 H new ATOM 0 HG2 LYS A 74 28.488 -30.337 -7.819 1.00 4.31 H new ATOM 0 HG3 LYS A 74 29.956 -29.716 -7.090 1.00 4.31 H new ATOM 0 HD2 LYS A 74 27.604 -29.287 -5.379 1.00 3.43 H new ATOM 0 HD3 LYS A 74 27.843 -30.981 -5.757 1.00 3.43 H new ATOM 0 HE2 LYS A 74 30.193 -29.294 -4.878 1.00 12.12 H new ATOM 0 HE3 LYS A 74 29.067 -29.907 -3.683 1.00 12.12 H new ATOM 0 HZ1 LYS A 74 30.921 -31.412 -3.993 1.00 64.55 H new ATOM 0 HZ2 LYS A 74 29.479 -32.158 -4.489 1.00 64.55 H new ATOM 0 HZ3 LYS A 74 30.570 -31.564 -5.647 1.00 64.55 H new ATOM 1174 N LEU A 75 25.550 -28.887 -6.613 1.00 65.25 N ATOM 1175 CA LEU A 75 24.576 -29.790 -6.010 1.00 5.14 C ATOM 1176 C LEU A 75 23.254 -29.752 -6.769 1.00 45.25 C ATOM 1177 O LEU A 75 22.433 -30.663 -6.654 1.00 43.43 O ATOM 1178 CB LEU A 75 24.346 -29.417 -4.544 1.00 64.10 C ATOM 1179 CG LEU A 75 23.912 -27.975 -4.278 1.00 72.44 C ATOM 1180 CD1 LEU A 75 22.419 -27.815 -4.519 1.00 33.04 C ATOM 1181 CD2 LEU A 75 24.273 -27.562 -2.859 1.00 31.40 C ATOM 0 H LEU A 75 25.703 -28.023 -6.093 1.00 65.25 H new ATOM 0 HA LEU A 75 24.975 -30.803 -6.064 1.00 5.14 H new ATOM 0 HB2 LEU A 75 23.588 -30.085 -4.135 1.00 64.10 H new ATOM 0 HB3 LEU A 75 25.268 -29.605 -3.993 1.00 64.10 H new ATOM 0 HG LEU A 75 24.443 -27.322 -4.970 1.00 72.44 H new ATOM 0 HD11 LEU A 75 22.128 -26.783 -4.325 1.00 33.04 H new ATOM 0 HD12 LEU A 75 22.188 -28.069 -5.554 1.00 33.04 H new ATOM 0 HD13 LEU A 75 21.870 -28.479 -3.851 1.00 33.04 H new ATOM 0 HD21 LEU A 75 23.957 -26.533 -2.688 1.00 31.40 H new ATOM 0 HD22 LEU A 75 23.770 -28.219 -2.150 1.00 31.40 H new ATOM 0 HD23 LEU A 75 25.352 -27.638 -2.721 1.00 31.40 H new ATOM 1193 N LEU A 76 23.056 -28.694 -7.548 1.00 12.44 N ATOM 1194 CA LEU A 76 21.834 -28.537 -8.329 1.00 70.43 C ATOM 1195 C LEU A 76 21.655 -29.701 -9.299 1.00 24.20 C ATOM 1196 O LEU A 76 20.541 -30.002 -9.724 1.00 50.14 O ATOM 1197 CB LEU A 76 21.864 -27.216 -9.100 1.00 73.41 C ATOM 1198 CG LEU A 76 20.612 -26.346 -8.989 1.00 15.04 C ATOM 1199 CD1 LEU A 76 20.356 -25.962 -7.540 1.00 11.35 C ATOM 1200 CD2 LEU A 76 20.747 -25.103 -9.856 1.00 1.00 C ATOM 0 H LEU A 76 23.726 -27.932 -7.656 1.00 12.44 H new ATOM 0 HA LEU A 76 20.990 -28.529 -7.640 1.00 70.43 H new ATOM 0 HB2 LEU A 76 22.718 -26.635 -8.752 1.00 73.41 H new ATOM 0 HB3 LEU A 76 22.036 -27.437 -10.153 1.00 73.41 H new ATOM 0 HG LEU A 76 19.759 -26.923 -9.347 1.00 15.04 H new ATOM 0 HD11 LEU A 76 19.461 -25.343 -7.480 1.00 11.35 H new ATOM 0 HD12 LEU A 76 20.214 -26.864 -6.944 1.00 11.35 H new ATOM 0 HD13 LEU A 76 21.210 -25.404 -7.155 1.00 11.35 H new ATOM 0 HD21 LEU A 76 19.846 -24.496 -9.764 1.00 1.00 H new ATOM 0 HD22 LEU A 76 21.610 -24.523 -9.529 1.00 1.00 H new ATOM 0 HD23 LEU A 76 20.881 -25.398 -10.897 1.00 1.00 H new ATOM 1212 N ASN A 77 22.761 -30.354 -9.642 1.00 42.44 N ATOM 1213 CA ASN A 77 22.726 -31.486 -10.561 1.00 25.13 C ATOM 1214 C ASN A 77 22.610 -32.802 -9.797 1.00 54.04 C ATOM 1215 O ASN A 77 22.656 -33.881 -10.388 1.00 30.53 O ATOM 1216 CB ASN A 77 23.983 -31.500 -11.434 1.00 33.00 C ATOM 1217 CG ASN A 77 23.989 -30.379 -12.455 1.00 61.25 C ATOM 1218 OD1 ASN A 77 23.677 -30.591 -13.627 1.00 42.35 O ATOM 1219 ND2 ASN A 77 24.346 -29.179 -12.014 1.00 51.41 N ATOM 0 H ASN A 77 23.692 -30.119 -9.298 1.00 42.44 H new ATOM 0 HA ASN A 77 21.849 -31.377 -11.200 1.00 25.13 H new ATOM 0 HB2 ASN A 77 24.865 -31.414 -10.799 1.00 33.00 H new ATOM 0 HB3 ASN A 77 24.054 -32.458 -11.949 1.00 33.00 H new ATOM 0 HD21 ASN A 77 24.370 -28.386 -12.655 1.00 51.41 H new ATOM 0 HD22 ASN A 77 24.597 -29.050 -11.034 1.00 51.41 H new ATOM 1226 N LYS A 78 22.457 -32.704 -8.481 1.00 62.51 N ATOM 1227 CA LYS A 78 22.331 -33.886 -7.635 1.00 45.54 C ATOM 1228 C LYS A 78 20.896 -34.057 -7.150 1.00 75.03 C ATOM 1229 O LYS A 78 20.474 -35.162 -6.809 1.00 14.05 O ATOM 1230 CB LYS A 78 23.277 -33.783 -6.437 1.00 1.35 C ATOM 1231 CG LYS A 78 24.682 -33.339 -6.806 1.00 60.43 C ATOM 1232 CD LYS A 78 25.386 -34.376 -7.666 1.00 55.13 C ATOM 1233 CE LYS A 78 25.765 -35.607 -6.857 1.00 55.05 C ATOM 1234 NZ LYS A 78 26.891 -36.355 -7.481 1.00 3.13 N ATOM 0 H LYS A 78 22.417 -31.818 -7.977 1.00 62.51 H new ATOM 0 HA LYS A 78 22.601 -34.759 -8.230 1.00 45.54 H new ATOM 0 HB2 LYS A 78 22.861 -33.080 -5.716 1.00 1.35 H new ATOM 0 HB3 LYS A 78 23.330 -34.753 -5.942 1.00 1.35 H new ATOM 0 HG2 LYS A 78 24.636 -32.391 -7.342 1.00 60.43 H new ATOM 0 HG3 LYS A 78 25.260 -33.165 -5.898 1.00 60.43 H new ATOM 0 HD2 LYS A 78 24.736 -34.668 -8.491 1.00 55.13 H new ATOM 0 HD3 LYS A 78 26.282 -33.938 -8.105 1.00 55.13 H new ATOM 0 HE2 LYS A 78 26.044 -35.306 -5.847 1.00 55.05 H new ATOM 0 HE3 LYS A 78 24.899 -36.263 -6.766 1.00 55.05 H new ATOM 0 HZ1 LYS A 78 27.119 -37.187 -6.900 1.00 3.13 H new ATOM 0 HZ2 LYS A 78 26.616 -36.664 -8.435 1.00 3.13 H new ATOM 0 HZ3 LYS A 78 27.725 -35.737 -7.544 1.00 3.13 H new ATOM 1248 N ASP A 79 20.150 -32.958 -7.124 1.00 74.23 N ATOM 1249 CA ASP A 79 18.760 -32.988 -6.684 1.00 13.34 C ATOM 1250 C ASP A 79 17.904 -33.815 -7.638 1.00 44.35 C ATOM 1251 O ASP A 79 16.881 -34.376 -7.245 1.00 11.43 O ATOM 1252 CB ASP A 79 18.204 -31.566 -6.582 1.00 62.34 C ATOM 1253 CG ASP A 79 19.018 -30.692 -5.649 1.00 12.22 C ATOM 1254 OD1 ASP A 79 19.594 -31.232 -4.681 1.00 43.13 O ATOM 1255 OD2 ASP A 79 19.079 -29.467 -5.886 1.00 72.51 O ATOM 0 H ASP A 79 20.484 -32.035 -7.402 1.00 74.23 H new ATOM 0 HA ASP A 79 18.727 -33.454 -5.699 1.00 13.34 H new ATOM 0 HB2 ASP A 79 18.185 -31.114 -7.574 1.00 62.34 H new ATOM 0 HB3 ASP A 79 17.173 -31.606 -6.230 1.00 62.34 H new ATOM 1260 N LEU A 80 18.330 -33.885 -8.895 1.00 75.30 N ATOM 1261 CA LEU A 80 17.602 -34.643 -9.907 1.00 61.14 C ATOM 1262 C LEU A 80 18.258 -35.999 -10.148 1.00 34.21 C ATOM 1263 O LEU A 80 17.658 -36.892 -10.747 1.00 2.15 O ATOM 1264 CB LEU A 80 17.540 -33.854 -11.217 1.00 24.34 C ATOM 1265 CG LEU A 80 18.740 -32.954 -11.515 1.00 70.42 C ATOM 1266 CD1 LEU A 80 20.021 -33.772 -11.564 1.00 45.20 C ATOM 1267 CD2 LEU A 80 18.532 -32.206 -12.824 1.00 5.22 C ATOM 0 H LEU A 80 19.175 -33.427 -9.237 1.00 75.30 H new ATOM 0 HA LEU A 80 16.589 -34.810 -9.542 1.00 61.14 H new ATOM 0 HB2 LEU A 80 17.428 -34.561 -12.039 1.00 24.34 H new ATOM 0 HB3 LEU A 80 16.642 -33.236 -11.204 1.00 24.34 H new ATOM 0 HG LEU A 80 18.831 -32.223 -10.712 1.00 70.42 H new ATOM 0 HD11 LEU A 80 20.864 -33.115 -11.777 1.00 45.20 H new ATOM 0 HD12 LEU A 80 20.177 -34.262 -10.603 1.00 45.20 H new ATOM 0 HD13 LEU A 80 19.941 -34.526 -12.347 1.00 45.20 H new ATOM 0 HD21 LEU A 80 19.395 -31.570 -13.021 1.00 5.22 H new ATOM 0 HD22 LEU A 80 18.416 -32.922 -13.638 1.00 5.22 H new ATOM 0 HD23 LEU A 80 17.636 -31.589 -12.752 1.00 5.22 H new ATOM 1279 N ALA A 81 19.491 -36.147 -9.675 1.00 51.32 N ATOM 1280 CA ALA A 81 20.226 -37.395 -9.835 1.00 70.20 C ATOM 1281 C ALA A 81 19.471 -38.561 -9.205 1.00 63.13 C ATOM 1282 O ALA A 81 19.107 -39.518 -9.889 1.00 3.54 O ATOM 1283 CB ALA A 81 21.615 -37.272 -9.225 1.00 55.14 C ATOM 0 H ALA A 81 20.002 -35.418 -9.178 1.00 51.32 H new ATOM 0 HA ALA A 81 20.326 -37.595 -10.902 1.00 70.20 H new ATOM 0 HB1 ALA A 81 22.153 -38.212 -9.352 1.00 55.14 H new ATOM 0 HB2 ALA A 81 22.162 -36.471 -9.723 1.00 55.14 H new ATOM 0 HB3 ALA A 81 21.527 -37.045 -8.163 1.00 55.14 H new ATOM 1289 N GLU A 82 19.241 -38.474 -7.899 1.00 33.40 N ATOM 1290 CA GLU A 82 18.530 -39.524 -7.178 1.00 24.10 C ATOM 1291 C GLU A 82 17.066 -39.580 -7.602 1.00 34.00 C ATOM 1292 O GLU A 82 16.388 -40.590 -7.405 1.00 3.24 O ATOM 1293 CB GLU A 82 18.627 -39.292 -5.669 1.00 24.34 C ATOM 1294 CG GLU A 82 20.008 -39.568 -5.098 1.00 22.21 C ATOM 1295 CD GLU A 82 20.303 -41.051 -4.975 1.00 43.53 C ATOM 1296 OE1 GLU A 82 19.420 -41.862 -5.320 1.00 73.53 O ATOM 1297 OE2 GLU A 82 21.419 -41.398 -4.534 1.00 71.23 O ATOM 0 H GLU A 82 19.536 -37.689 -7.319 1.00 33.40 H new ATOM 0 HA GLU A 82 18.997 -40.478 -7.423 1.00 24.10 H new ATOM 0 HB2 GLU A 82 18.352 -38.260 -5.450 1.00 24.34 H new ATOM 0 HB3 GLU A 82 17.901 -39.929 -5.165 1.00 24.34 H new ATOM 0 HG2 GLU A 82 20.760 -39.103 -5.736 1.00 22.21 H new ATOM 0 HG3 GLU A 82 20.091 -39.102 -4.116 1.00 22.21 H new ATOM 1304 N LEU A 83 16.583 -38.488 -8.185 1.00 33.40 N ATOM 1305 CA LEU A 83 15.198 -38.411 -8.637 1.00 71.41 C ATOM 1306 C LEU A 83 15.016 -39.147 -9.961 1.00 15.11 C ATOM 1307 O LEU A 83 13.958 -39.722 -10.222 1.00 43.42 O ATOM 1308 CB LEU A 83 14.771 -36.950 -8.789 1.00 71.43 C ATOM 1309 CG LEU A 83 13.717 -36.667 -9.860 1.00 70.24 C ATOM 1310 CD1 LEU A 83 12.723 -35.627 -9.369 1.00 15.11 C ATOM 1311 CD2 LEU A 83 14.379 -36.207 -11.151 1.00 74.22 C ATOM 0 H LEU A 83 17.130 -37.644 -8.356 1.00 33.40 H new ATOM 0 HA LEU A 83 14.569 -38.890 -7.887 1.00 71.41 H new ATOM 0 HB2 LEU A 83 14.388 -36.603 -7.830 1.00 71.43 H new ATOM 0 HB3 LEU A 83 15.656 -36.355 -9.013 1.00 71.43 H new ATOM 0 HG LEU A 83 13.175 -37.591 -10.062 1.00 70.24 H new ATOM 0 HD11 LEU A 83 11.981 -35.439 -10.145 1.00 15.11 H new ATOM 0 HD12 LEU A 83 12.225 -35.995 -8.472 1.00 15.11 H new ATOM 0 HD13 LEU A 83 13.250 -34.701 -9.138 1.00 15.11 H new ATOM 0 HD21 LEU A 83 13.614 -36.010 -11.902 1.00 74.22 H new ATOM 0 HD22 LEU A 83 14.947 -35.296 -10.964 1.00 74.22 H new ATOM 0 HD23 LEU A 83 15.051 -36.985 -11.513 1.00 74.22 H new ATOM 1323 N ILE A 84 16.053 -39.126 -10.791 1.00 32.31 N ATOM 1324 CA ILE A 84 16.008 -39.794 -12.086 1.00 32.12 C ATOM 1325 C ILE A 84 16.229 -41.296 -11.938 1.00 1.40 C ATOM 1326 O ILE A 84 15.745 -42.087 -12.746 1.00 2.00 O ATOM 1327 CB ILE A 84 17.064 -39.223 -13.051 1.00 30.45 C ATOM 1328 CG1 ILE A 84 16.761 -37.757 -13.363 1.00 41.42 C ATOM 1329 CG2 ILE A 84 17.111 -40.045 -14.330 1.00 50.34 C ATOM 1330 CD1 ILE A 84 17.994 -36.938 -13.675 1.00 24.04 C ATOM 0 H ILE A 84 16.935 -38.654 -10.590 1.00 32.31 H new ATOM 0 HA ILE A 84 15.016 -39.615 -12.499 1.00 32.12 H new ATOM 0 HB ILE A 84 18.041 -39.278 -12.572 1.00 30.45 H new ATOM 0 HG12 ILE A 84 16.078 -37.708 -14.211 1.00 41.42 H new ATOM 0 HG13 ILE A 84 16.245 -37.312 -12.512 1.00 41.42 H new ATOM 0 HG21 ILE A 84 17.862 -39.629 -15.002 1.00 50.34 H new ATOM 0 HG22 ILE A 84 17.370 -41.076 -14.090 1.00 50.34 H new ATOM 0 HG23 ILE A 84 16.135 -40.019 -14.815 1.00 50.34 H new ATOM 0 HD11 ILE A 84 17.703 -35.909 -13.886 1.00 24.04 H new ATOM 0 HD12 ILE A 84 18.669 -36.956 -12.819 1.00 24.04 H new ATOM 0 HD13 ILE A 84 18.499 -37.358 -14.545 1.00 24.04 H new ATOM 1342 N ASN A 85 16.963 -41.681 -10.899 1.00 13.44 N ATOM 1343 CA ASN A 85 17.247 -43.088 -10.643 1.00 43.04 C ATOM 1344 C ASN A 85 15.969 -43.848 -10.302 1.00 25.15 C ATOM 1345 O ASN A 85 15.667 -44.879 -10.903 1.00 51.11 O ATOM 1346 CB ASN A 85 18.257 -43.227 -9.503 1.00 4.24 C ATOM 1347 CG ASN A 85 19.691 -43.102 -9.981 1.00 71.43 C ATOM 1348 OD1 ASN A 85 20.523 -43.971 -9.717 1.00 53.15 O ATOM 1349 ND2 ASN A 85 19.986 -42.018 -10.689 1.00 63.30 N ATOM 0 H ASN A 85 17.372 -41.038 -10.221 1.00 13.44 H new ATOM 0 HA ASN A 85 17.672 -43.518 -11.550 1.00 43.04 H new ATOM 0 HB2 ASN A 85 18.060 -42.463 -8.751 1.00 4.24 H new ATOM 0 HB3 ASN A 85 18.122 -44.194 -9.018 1.00 4.24 H new ATOM 0 HD21 ASN A 85 20.934 -41.879 -11.038 1.00 63.30 H new ATOM 0 HD22 ASN A 85 19.264 -41.324 -10.884 1.00 63.30 H new ATOM 1356 N LYS A 86 15.222 -43.332 -9.332 1.00 1.02 N ATOM 1357 CA LYS A 86 13.975 -43.959 -8.910 1.00 24.33 C ATOM 1358 C LYS A 86 12.934 -43.905 -10.023 1.00 45.33 C ATOM 1359 O LYS A 86 11.996 -44.700 -10.048 1.00 21.42 O ATOM 1360 CB LYS A 86 13.433 -43.270 -7.656 1.00 32.24 C ATOM 1361 CG LYS A 86 12.598 -44.182 -6.774 1.00 33.24 C ATOM 1362 CD LYS A 86 13.457 -45.226 -6.079 1.00 55.31 C ATOM 1363 CE LYS A 86 14.343 -44.599 -5.014 1.00 42.32 C ATOM 1364 NZ LYS A 86 14.654 -45.556 -3.917 1.00 33.32 N ATOM 0 H LYS A 86 15.459 -42.480 -8.823 1.00 1.02 H new ATOM 0 HA LYS A 86 14.182 -45.005 -8.682 1.00 24.33 H new ATOM 0 HB2 LYS A 86 14.269 -42.882 -7.074 1.00 32.24 H new ATOM 0 HB3 LYS A 86 12.828 -42.414 -7.955 1.00 32.24 H new ATOM 0 HG2 LYS A 86 12.073 -43.586 -6.027 1.00 33.24 H new ATOM 0 HG3 LYS A 86 11.838 -44.678 -7.378 1.00 33.24 H new ATOM 0 HD2 LYS A 86 12.816 -45.981 -5.623 1.00 55.31 H new ATOM 0 HD3 LYS A 86 14.077 -45.737 -6.815 1.00 55.31 H new ATOM 0 HE2 LYS A 86 15.271 -44.256 -5.470 1.00 42.32 H new ATOM 0 HE3 LYS A 86 13.847 -43.721 -4.600 1.00 42.32 H new ATOM 0 HZ1 LYS A 86 15.260 -45.090 -3.211 1.00 33.32 H new ATOM 0 HZ2 LYS A 86 13.770 -45.865 -3.465 1.00 33.32 H new ATOM 0 HZ3 LYS A 86 15.150 -46.383 -4.308 1.00 33.32 H new ATOM 1378 N MET A 87 13.108 -42.962 -10.944 1.00 1.24 N ATOM 1379 CA MET A 87 12.184 -42.806 -12.061 1.00 64.14 C ATOM 1380 C MET A 87 12.223 -44.028 -12.973 1.00 64.41 C ATOM 1381 O MET A 87 11.186 -44.606 -13.297 1.00 34.34 O ATOM 1382 CB MET A 87 12.526 -41.548 -12.861 1.00 52.54 C ATOM 1383 CG MET A 87 11.634 -41.338 -14.074 1.00 54.31 C ATOM 1384 SD MET A 87 10.054 -40.579 -13.651 1.00 13.10 S ATOM 1385 CE MET A 87 9.076 -42.028 -13.261 1.00 11.14 C ATOM 0 H MET A 87 13.880 -42.295 -10.938 1.00 1.24 H new ATOM 0 HA MET A 87 11.177 -42.708 -11.656 1.00 64.14 H new ATOM 0 HB2 MET A 87 12.447 -40.679 -12.208 1.00 52.54 H new ATOM 0 HB3 MET A 87 13.564 -41.607 -13.189 1.00 52.54 H new ATOM 0 HG2 MET A 87 12.153 -40.709 -14.797 1.00 54.31 H new ATOM 0 HG3 MET A 87 11.454 -42.298 -14.558 1.00 54.31 H new ATOM 0 HE1 MET A 87 8.172 -41.725 -12.732 1.00 11.14 H new ATOM 0 HE2 MET A 87 8.802 -42.541 -14.183 1.00 11.14 H new ATOM 0 HE3 MET A 87 9.657 -42.700 -12.630 1.00 11.14 H new ATOM 1395 N ARG A 88 13.426 -44.416 -13.384 1.00 62.51 N ATOM 1396 CA ARG A 88 13.599 -45.569 -14.260 1.00 23.22 C ATOM 1397 C ARG A 88 13.440 -46.872 -13.481 1.00 44.04 C ATOM 1398 O ARG A 88 13.295 -47.945 -14.069 1.00 14.23 O ATOM 1399 CB ARG A 88 14.975 -45.527 -14.928 1.00 54.44 C ATOM 1400 CG ARG A 88 16.128 -45.435 -13.943 1.00 63.21 C ATOM 1401 CD ARG A 88 17.447 -45.829 -14.591 1.00 35.02 C ATOM 1402 NE ARG A 88 17.497 -47.254 -14.907 1.00 52.11 N ATOM 1403 CZ ARG A 88 18.608 -47.889 -15.263 1.00 21.04 C ATOM 1404 NH1 ARG A 88 19.755 -47.229 -15.346 1.00 71.02 N ATOM 1405 NH2 ARG A 88 18.574 -49.187 -15.535 1.00 34.22 N ATOM 0 H ARG A 88 14.295 -43.949 -13.125 1.00 62.51 H new ATOM 0 HA ARG A 88 12.828 -45.528 -15.029 1.00 23.22 H new ATOM 0 HB2 ARG A 88 15.100 -46.421 -15.538 1.00 54.44 H new ATOM 0 HB3 ARG A 88 15.016 -44.672 -15.603 1.00 54.44 H new ATOM 0 HG2 ARG A 88 16.200 -44.417 -13.559 1.00 63.21 H new ATOM 0 HG3 ARG A 88 15.932 -46.085 -13.090 1.00 63.21 H new ATOM 0 HD2 ARG A 88 17.590 -45.250 -15.503 1.00 35.02 H new ATOM 0 HD3 ARG A 88 18.269 -45.577 -13.922 1.00 35.02 H new ATOM 0 HE ARG A 88 16.632 -47.791 -14.851 1.00 52.11 H new ATOM 0 HH11 ARG A 88 19.786 -46.231 -15.136 1.00 71.02 H new ATOM 0 HH12 ARG A 88 20.607 -47.719 -15.620 1.00 71.02 H new ATOM 0 HH21 ARG A 88 17.694 -49.699 -15.471 1.00 34.22 H new ATOM 0 HH22 ARG A 88 19.428 -49.673 -15.808 1.00 34.22 H new ATOM 1419 N LEU A 89 13.470 -46.771 -12.157 1.00 62.12 N ATOM 1420 CA LEU A 89 13.330 -47.941 -11.297 1.00 71.34 C ATOM 1421 C LEU A 89 11.895 -48.082 -10.798 1.00 44.35 C ATOM 1422 O LEU A 89 11.539 -49.082 -10.177 1.00 71.45 O ATOM 1423 CB LEU A 89 14.288 -47.843 -10.109 1.00 30.11 C ATOM 1424 CG LEU A 89 14.226 -48.990 -9.100 1.00 73.51 C ATOM 1425 CD1 LEU A 89 14.448 -50.325 -9.795 1.00 12.11 C ATOM 1426 CD2 LEU A 89 15.252 -48.785 -7.995 1.00 74.30 C ATOM 0 H LEU A 89 13.590 -45.891 -11.655 1.00 62.12 H new ATOM 0 HA LEU A 89 13.579 -48.825 -11.884 1.00 71.34 H new ATOM 0 HB2 LEU A 89 15.306 -47.778 -10.493 1.00 30.11 H new ATOM 0 HB3 LEU A 89 14.087 -46.911 -9.582 1.00 30.11 H new ATOM 0 HG LEU A 89 13.233 -48.999 -8.650 1.00 73.51 H new ATOM 0 HD11 LEU A 89 14.400 -51.130 -9.061 1.00 12.11 H new ATOM 0 HD12 LEU A 89 13.675 -50.476 -10.549 1.00 12.11 H new ATOM 0 HD13 LEU A 89 15.427 -50.328 -10.273 1.00 12.11 H new ATOM 0 HD21 LEU A 89 15.193 -49.611 -7.286 1.00 74.30 H new ATOM 0 HD22 LEU A 89 16.251 -48.749 -8.429 1.00 74.30 H new ATOM 0 HD23 LEU A 89 15.047 -47.848 -7.478 1.00 74.30 H new ATOM 1438 N ALA A 90 11.076 -47.073 -11.077 1.00 2.35 N ATOM 1439 CA ALA A 90 9.680 -47.086 -10.660 1.00 15.42 C ATOM 1440 C ALA A 90 8.764 -47.456 -11.821 1.00 55.24 C ATOM 1441 O ALA A 90 7.557 -47.618 -11.644 1.00 34.12 O ATOM 1442 CB ALA A 90 9.287 -45.732 -10.087 1.00 3.14 C ATOM 0 H ALA A 90 11.356 -46.237 -11.590 1.00 2.35 H new ATOM 0 HA ALA A 90 9.566 -47.844 -9.885 1.00 15.42 H new ATOM 0 HB1 ALA A 90 8.242 -45.757 -9.780 1.00 3.14 H new ATOM 0 HB2 ALA A 90 9.914 -45.506 -9.224 1.00 3.14 H new ATOM 0 HB3 ALA A 90 9.424 -44.962 -10.846 1.00 3.14 H new ATOM 1448 N GLN A 91 9.345 -47.587 -13.009 1.00 42.22 N ATOM 1449 CA GLN A 91 8.580 -47.936 -14.200 1.00 34.52 C ATOM 1450 C GLN A 91 9.092 -49.235 -14.814 1.00 54.04 C ATOM 1451 O GLN A 91 8.480 -49.780 -15.733 1.00 25.42 O ATOM 1452 CB GLN A 91 8.653 -46.807 -15.229 1.00 63.42 C ATOM 1453 CG GLN A 91 9.958 -46.779 -16.009 1.00 1.25 C ATOM 1454 CD GLN A 91 10.130 -45.505 -16.812 1.00 5.44 C ATOM 1455 OE1 GLN A 91 10.321 -45.544 -18.027 1.00 65.54 O ATOM 1456 NE2 GLN A 91 10.064 -44.364 -16.135 1.00 34.24 N ATOM 0 H GLN A 91 10.343 -47.457 -13.172 1.00 42.22 H new ATOM 0 HA GLN A 91 7.541 -48.080 -13.904 1.00 34.52 H new ATOM 0 HB2 GLN A 91 7.823 -46.910 -15.928 1.00 63.42 H new ATOM 0 HB3 GLN A 91 8.524 -45.852 -14.719 1.00 63.42 H new ATOM 0 HG2 GLN A 91 10.793 -46.883 -15.316 1.00 1.25 H new ATOM 0 HG3 GLN A 91 9.993 -47.636 -16.682 1.00 1.25 H new ATOM 0 HE21 GLN A 91 9.904 -44.377 -15.128 1.00 34.24 H new ATOM 0 HE22 GLN A 91 10.173 -43.475 -16.622 1.00 34.24 H new ATOM 1465 N GLN A 92 10.216 -49.724 -14.301 1.00 42.45 N ATOM 1466 CA GLN A 92 10.810 -50.958 -14.801 1.00 43.35 C ATOM 1467 C GLN A 92 9.771 -52.072 -14.874 1.00 2.31 C ATOM 1468 O GLN A 92 8.721 -51.997 -14.237 1.00 43.42 O ATOM 1469 CB GLN A 92 11.974 -51.387 -13.907 1.00 22.33 C ATOM 1470 CG GLN A 92 11.690 -51.231 -12.422 1.00 10.34 C ATOM 1471 CD GLN A 92 10.402 -51.910 -11.999 1.00 41.22 C ATOM 1472 OE1 GLN A 92 10.179 -53.084 -12.296 1.00 44.24 O ATOM 1473 NE2 GLN A 92 9.545 -51.173 -11.301 1.00 64.25 N ATOM 0 H GLN A 92 10.734 -49.285 -13.540 1.00 42.45 H new ATOM 0 HA GLN A 92 11.185 -50.770 -15.807 1.00 43.35 H new ATOM 0 HB2 GLN A 92 12.216 -52.429 -14.115 1.00 22.33 H new ATOM 0 HB3 GLN A 92 12.855 -50.798 -14.164 1.00 22.33 H new ATOM 0 HG2 GLN A 92 12.520 -51.648 -11.852 1.00 10.34 H new ATOM 0 HG3 GLN A 92 11.635 -50.171 -12.176 1.00 10.34 H new ATOM 0 HE21 GLN A 92 9.770 -50.204 -11.077 1.00 64.25 H new ATOM 0 HE22 GLN A 92 8.662 -51.576 -10.989 1.00 64.25 H new ATOM 1482 N ASN A 93 10.072 -53.105 -15.655 1.00 14.44 N ATOM 1483 CA ASN A 93 9.163 -54.234 -15.811 1.00 74.31 C ATOM 1484 C ASN A 93 9.602 -55.410 -14.944 1.00 31.21 C ATOM 1485 O ASN A 93 10.192 -56.371 -15.436 1.00 70.24 O ATOM 1486 CB ASN A 93 9.098 -54.664 -17.278 1.00 73.10 C ATOM 1487 CG ASN A 93 8.995 -53.482 -18.223 1.00 34.33 C ATOM 1488 OD1 ASN A 93 9.990 -53.048 -18.802 1.00 62.14 O ATOM 1489 ND2 ASN A 93 7.786 -52.956 -18.382 1.00 11.33 N ATOM 0 H ASN A 93 10.938 -53.183 -16.189 1.00 14.44 H new ATOM 0 HA ASN A 93 8.171 -53.917 -15.488 1.00 74.31 H new ATOM 0 HB2 ASN A 93 9.987 -55.245 -17.523 1.00 73.10 H new ATOM 0 HB3 ASN A 93 8.239 -55.319 -17.424 1.00 73.10 H new ATOM 0 HD21 ASN A 93 7.654 -52.159 -19.005 1.00 11.33 H new ATOM 0 HD22 ASN A 93 6.989 -53.349 -17.881 1.00 11.33 H new ATOM 1496 N ALA A 94 9.309 -55.326 -13.650 1.00 62.23 N ATOM 1497 CA ALA A 94 9.671 -56.384 -12.715 1.00 2.10 C ATOM 1498 C ALA A 94 8.442 -56.918 -11.987 1.00 41.32 C ATOM 1499 O ALA A 94 7.609 -56.148 -11.509 1.00 34.44 O ATOM 1500 CB ALA A 94 10.699 -55.875 -11.715 1.00 64.33 C ATOM 0 H ALA A 94 8.822 -54.536 -13.226 1.00 62.23 H new ATOM 0 HA ALA A 94 10.108 -57.204 -13.284 1.00 2.10 H new ATOM 0 HB1 ALA A 94 10.960 -56.675 -11.023 1.00 64.33 H new ATOM 0 HB2 ALA A 94 11.593 -55.549 -12.246 1.00 64.33 H new ATOM 0 HB3 ALA A 94 10.281 -55.036 -11.159 1.00 64.33 H new ATOM 1506 N VAL A 95 8.335 -58.240 -11.908 1.00 31.31 N ATOM 1507 CA VAL A 95 7.207 -58.877 -11.238 1.00 63.10 C ATOM 1508 C VAL A 95 7.074 -58.387 -9.801 1.00 14.33 C ATOM 1509 O VAL A 95 5.988 -58.417 -9.220 1.00 52.15 O ATOM 1510 CB VAL A 95 7.350 -60.411 -11.234 1.00 52.34 C ATOM 1511 CG1 VAL A 95 7.189 -60.965 -12.642 1.00 34.44 C ATOM 1512 CG2 VAL A 95 8.690 -60.819 -10.642 1.00 32.54 C ATOM 0 H VAL A 95 9.015 -58.891 -12.300 1.00 31.31 H new ATOM 0 HA VAL A 95 6.312 -58.604 -11.797 1.00 63.10 H new ATOM 0 HB VAL A 95 6.560 -60.831 -10.611 1.00 52.34 H new ATOM 0 HG11 VAL A 95 7.293 -62.050 -12.620 1.00 34.44 H new ATOM 0 HG12 VAL A 95 6.203 -60.703 -13.026 1.00 34.44 H new ATOM 0 HG13 VAL A 95 7.955 -60.540 -13.290 1.00 34.44 H new ATOM 0 HG21 VAL A 95 8.774 -61.906 -10.647 1.00 32.54 H new ATOM 0 HG22 VAL A 95 9.496 -60.390 -11.237 1.00 32.54 H new ATOM 0 HG23 VAL A 95 8.761 -60.454 -9.617 1.00 32.54 H new ATOM 1522 N THR A 96 8.186 -57.934 -9.230 1.00 14.22 N ATOM 1523 CA THR A 96 8.194 -57.437 -7.860 1.00 33.03 C ATOM 1524 C THR A 96 7.106 -56.390 -7.648 1.00 45.33 C ATOM 1525 O THR A 96 6.847 -55.565 -8.524 1.00 41.33 O ATOM 1526 CB THR A 96 9.559 -56.825 -7.492 1.00 74.10 C ATOM 1527 OG1 THR A 96 10.616 -57.633 -8.020 1.00 61.41 O ATOM 1528 CG2 THR A 96 9.709 -56.706 -5.983 1.00 25.20 C ATOM 0 H THR A 96 9.093 -57.901 -9.696 1.00 14.22 H new ATOM 0 HA THR A 96 8.002 -58.293 -7.213 1.00 33.03 H new ATOM 0 HB THR A 96 9.614 -55.827 -7.926 1.00 74.10 H new ATOM 0 HG1 THR A 96 11.480 -57.236 -7.783 1.00 61.41 H new ATOM 0 HG21 THR A 96 10.680 -56.271 -5.747 1.00 25.20 H new ATOM 0 HG22 THR A 96 8.920 -56.066 -5.588 1.00 25.20 H new ATOM 0 HG23 THR A 96 9.635 -57.695 -5.531 1.00 25.20 H new ATOM 1536 N SER A 97 6.474 -56.428 -6.480 1.00 13.21 N ATOM 1537 CA SER A 97 5.412 -55.483 -6.155 1.00 34.13 C ATOM 1538 C SER A 97 5.954 -54.316 -5.335 1.00 24.51 C ATOM 1539 O SER A 97 5.223 -53.686 -4.570 1.00 20.52 O ATOM 1540 CB SER A 97 4.293 -56.186 -5.383 1.00 61.44 C ATOM 1541 OG SER A 97 3.823 -57.321 -6.089 1.00 75.53 O ATOM 0 H SER A 97 6.679 -57.103 -5.743 1.00 13.21 H new ATOM 0 HA SER A 97 5.010 -55.092 -7.090 1.00 34.13 H new ATOM 0 HB2 SER A 97 4.659 -56.489 -4.402 1.00 61.44 H new ATOM 0 HB3 SER A 97 3.470 -55.491 -5.216 1.00 61.44 H new ATOM 0 HG SER A 97 3.110 -57.754 -5.575 1.00 75.53 H new ATOM 1547 N LEU A 98 7.242 -54.034 -5.500 1.00 71.21 N ATOM 1548 CA LEU A 98 7.885 -52.943 -4.776 1.00 61.21 C ATOM 1549 C LEU A 98 7.971 -51.691 -5.642 1.00 41.25 C ATOM 1550 O LEU A 98 8.777 -50.798 -5.382 1.00 44.11 O ATOM 1551 CB LEU A 98 9.285 -53.361 -4.323 1.00 41.02 C ATOM 1552 CG LEU A 98 9.377 -54.013 -2.943 1.00 64.54 C ATOM 1553 CD1 LEU A 98 9.105 -52.992 -1.850 1.00 41.34 C ATOM 1554 CD2 LEU A 98 8.406 -55.180 -2.839 1.00 61.32 C ATOM 0 H LEU A 98 7.861 -54.546 -6.129 1.00 71.21 H new ATOM 0 HA LEU A 98 7.279 -52.715 -3.899 1.00 61.21 H new ATOM 0 HB2 LEU A 98 9.691 -54.055 -5.059 1.00 41.02 H new ATOM 0 HB3 LEU A 98 9.926 -52.479 -4.330 1.00 41.02 H new ATOM 0 HG LEU A 98 10.389 -54.395 -2.810 1.00 64.54 H new ATOM 0 HD11 LEU A 98 9.175 -53.475 -0.875 1.00 41.34 H new ATOM 0 HD12 LEU A 98 9.840 -52.189 -1.911 1.00 41.34 H new ATOM 0 HD13 LEU A 98 8.105 -52.579 -1.979 1.00 41.34 H new ATOM 0 HD21 LEU A 98 8.485 -55.632 -1.850 1.00 61.32 H new ATOM 0 HD22 LEU A 98 7.388 -54.821 -2.994 1.00 61.32 H new ATOM 0 HD23 LEU A 98 8.648 -55.924 -3.598 1.00 61.32 H new ATOM 1566 N SER A 99 7.133 -51.631 -6.673 1.00 20.35 N ATOM 1567 CA SER A 99 7.115 -50.489 -7.579 1.00 3.15 C ATOM 1568 C SER A 99 6.391 -49.305 -6.945 1.00 42.44 C ATOM 1569 O SER A 99 6.664 -48.150 -7.272 1.00 62.35 O ATOM 1570 CB SER A 99 6.440 -50.868 -8.898 1.00 1.10 C ATOM 1571 OG SER A 99 5.096 -50.419 -8.930 1.00 63.35 O ATOM 0 H SER A 99 6.458 -52.361 -6.901 1.00 20.35 H new ATOM 0 HA SER A 99 8.146 -50.198 -7.778 1.00 3.15 H new ATOM 0 HB2 SER A 99 6.992 -50.433 -9.731 1.00 1.10 H new ATOM 0 HB3 SER A 99 6.469 -51.950 -9.027 1.00 1.10 H new ATOM 0 HG SER A 99 4.687 -50.672 -9.784 1.00 63.35 H new ATOM 1577 N GLU A 100 5.467 -49.601 -6.037 1.00 74.03 N ATOM 1578 CA GLU A 100 4.702 -48.561 -5.359 1.00 23.03 C ATOM 1579 C GLU A 100 5.584 -47.786 -4.384 1.00 43.11 C ATOM 1580 O GLU A 100 5.313 -46.627 -4.074 1.00 1.53 O ATOM 1581 CB GLU A 100 3.515 -49.174 -4.613 1.00 23.13 C ATOM 1582 CG GLU A 100 2.498 -49.836 -5.527 1.00 20.02 C ATOM 1583 CD GLU A 100 1.893 -48.867 -6.524 1.00 75.41 C ATOM 1584 OE1 GLU A 100 0.885 -48.214 -6.181 1.00 70.52 O ATOM 1585 OE2 GLU A 100 2.427 -48.763 -7.648 1.00 3.51 O ATOM 0 H GLU A 100 5.230 -50.552 -5.754 1.00 74.03 H new ATOM 0 HA GLU A 100 4.329 -47.869 -6.114 1.00 23.03 H new ATOM 0 HB2 GLU A 100 3.886 -49.912 -3.901 1.00 23.13 H new ATOM 0 HB3 GLU A 100 3.018 -48.395 -4.035 1.00 23.13 H new ATOM 0 HG2 GLU A 100 2.977 -50.654 -6.065 1.00 20.02 H new ATOM 0 HG3 GLU A 100 1.703 -50.274 -4.923 1.00 20.02 H new ATOM 1592 N GLU A 101 6.640 -48.436 -3.905 1.00 63.12 N ATOM 1593 CA GLU A 101 7.561 -47.808 -2.965 1.00 21.42 C ATOM 1594 C GLU A 101 8.453 -46.793 -3.673 1.00 3.23 C ATOM 1595 O GLU A 101 8.675 -45.690 -3.173 1.00 31.53 O ATOM 1596 CB GLU A 101 8.423 -48.869 -2.276 1.00 42.52 C ATOM 1597 CG GLU A 101 9.555 -48.287 -1.445 1.00 72.13 C ATOM 1598 CD GLU A 101 10.430 -49.357 -0.822 1.00 1.11 C ATOM 1599 OE1 GLU A 101 11.146 -50.050 -1.575 1.00 3.31 O ATOM 1600 OE2 GLU A 101 10.399 -49.502 0.418 1.00 50.21 O ATOM 0 H GLU A 101 6.879 -49.396 -4.152 1.00 63.12 H new ATOM 0 HA GLU A 101 6.971 -47.284 -2.213 1.00 21.42 H new ATOM 0 HB2 GLU A 101 7.789 -49.480 -1.634 1.00 42.52 H new ATOM 0 HB3 GLU A 101 8.842 -49.532 -3.033 1.00 42.52 H new ATOM 0 HG2 GLU A 101 10.168 -47.642 -2.074 1.00 72.13 H new ATOM 0 HG3 GLU A 101 9.137 -47.660 -0.657 1.00 72.13 H new ATOM 1607 N ALA A 102 8.963 -47.174 -4.840 1.00 11.34 N ATOM 1608 CA ALA A 102 9.830 -46.297 -5.617 1.00 55.13 C ATOM 1609 C ALA A 102 9.125 -44.988 -5.956 1.00 14.21 C ATOM 1610 O ALA A 102 9.769 -43.964 -6.185 1.00 64.32 O ATOM 1611 CB ALA A 102 10.285 -46.998 -6.889 1.00 11.42 C ATOM 0 H ALA A 102 8.791 -48.084 -5.268 1.00 11.34 H new ATOM 0 HA ALA A 102 10.705 -46.062 -5.011 1.00 55.13 H new ATOM 0 HB1 ALA A 102 10.932 -46.332 -7.460 1.00 11.42 H new ATOM 0 HB2 ALA A 102 10.835 -47.903 -6.629 1.00 11.42 H new ATOM 0 HB3 ALA A 102 9.415 -47.262 -7.490 1.00 11.42 H new ATOM 1617 N LYS A 103 7.797 -45.027 -5.987 1.00 12.05 N ATOM 1618 CA LYS A 103 7.003 -43.844 -6.297 1.00 11.03 C ATOM 1619 C LYS A 103 7.191 -42.768 -5.232 1.00 33.23 C ATOM 1620 O LYS A 103 7.742 -41.702 -5.504 1.00 52.40 O ATOM 1621 CB LYS A 103 5.522 -44.213 -6.408 1.00 70.22 C ATOM 1622 CG LYS A 103 5.113 -44.673 -7.797 1.00 33.43 C ATOM 1623 CD LYS A 103 3.610 -44.871 -7.898 1.00 74.31 C ATOM 1624 CE LYS A 103 2.899 -43.573 -8.248 1.00 12.23 C ATOM 1625 NZ LYS A 103 1.613 -43.818 -8.957 1.00 72.24 N ATOM 0 H LYS A 103 7.248 -45.866 -5.801 1.00 12.05 H new ATOM 0 HA LYS A 103 7.345 -43.448 -7.253 1.00 11.03 H new ATOM 0 HB2 LYS A 103 5.298 -45.004 -5.692 1.00 70.22 H new ATOM 0 HB3 LYS A 103 4.919 -43.349 -6.128 1.00 70.22 H new ATOM 0 HG2 LYS A 103 5.434 -43.937 -8.534 1.00 33.43 H new ATOM 0 HG3 LYS A 103 5.621 -45.607 -8.036 1.00 33.43 H new ATOM 0 HD2 LYS A 103 3.391 -45.623 -8.656 1.00 74.31 H new ATOM 0 HD3 LYS A 103 3.228 -45.253 -6.951 1.00 74.31 H new ATOM 0 HE2 LYS A 103 2.709 -43.006 -7.337 1.00 12.23 H new ATOM 0 HE3 LYS A 103 3.548 -42.961 -8.874 1.00 12.23 H new ATOM 0 HZ1 LYS A 103 1.160 -42.908 -9.178 1.00 72.24 H new ATOM 0 HZ2 LYS A 103 1.796 -44.337 -9.840 1.00 72.24 H new ATOM 0 HZ3 LYS A 103 0.983 -44.380 -8.350 1.00 72.24 H new ATOM 1639 N ARG A 104 6.730 -43.056 -4.019 1.00 24.13 N ATOM 1640 CA ARG A 104 6.848 -42.113 -2.913 1.00 62.01 C ATOM 1641 C ARG A 104 8.290 -41.640 -2.753 1.00 41.14 C ATOM 1642 O ARG A 104 8.544 -40.454 -2.547 1.00 2.30 O ATOM 1643 CB ARG A 104 6.364 -42.756 -1.612 1.00 63.33 C ATOM 1644 CG ARG A 104 6.988 -44.115 -1.336 1.00 12.42 C ATOM 1645 CD ARG A 104 6.414 -44.745 -0.077 1.00 35.31 C ATOM 1646 NE ARG A 104 5.033 -45.184 -0.265 1.00 43.10 N ATOM 1647 CZ ARG A 104 4.294 -45.720 0.700 1.00 4.11 C ATOM 1648 NH1 ARG A 104 4.801 -45.882 1.915 1.00 72.24 N ATOM 1649 NH2 ARG A 104 3.046 -46.094 0.451 1.00 30.22 N ATOM 0 H ARG A 104 6.271 -43.934 -3.777 1.00 24.13 H new ATOM 0 HA ARG A 104 6.223 -41.249 -3.138 1.00 62.01 H new ATOM 0 HB2 ARG A 104 6.588 -42.087 -0.781 1.00 63.33 H new ATOM 0 HB3 ARG A 104 5.280 -42.864 -1.651 1.00 63.33 H new ATOM 0 HG2 ARG A 104 6.816 -44.775 -2.186 1.00 12.42 H new ATOM 0 HG3 ARG A 104 8.067 -44.006 -1.230 1.00 12.42 H new ATOM 0 HD2 ARG A 104 7.029 -45.597 0.215 1.00 35.31 H new ATOM 0 HD3 ARG A 104 6.458 -44.026 0.741 1.00 35.31 H new ATOM 0 HE ARG A 104 4.613 -45.073 -1.188 1.00 43.10 H new ATOM 0 HH11 ARG A 104 5.760 -45.595 2.110 1.00 72.24 H new ATOM 0 HH12 ARG A 104 4.232 -46.294 2.654 1.00 72.24 H new ATOM 0 HH21 ARG A 104 2.653 -45.970 -0.482 1.00 30.22 H new ATOM 0 HH22 ARG A 104 2.479 -46.505 1.193 1.00 30.22 H new ATOM 1663 N GLN A 105 9.229 -42.576 -2.850 1.00 53.01 N ATOM 1664 CA GLN A 105 10.644 -42.254 -2.715 1.00 25.20 C ATOM 1665 C GLN A 105 11.092 -41.294 -3.813 1.00 33.54 C ATOM 1666 O GLN A 105 12.010 -40.499 -3.618 1.00 41.31 O ATOM 1667 CB GLN A 105 11.486 -43.531 -2.763 1.00 41.31 C ATOM 1668 CG GLN A 105 11.413 -44.356 -1.488 1.00 43.25 C ATOM 1669 CD GLN A 105 11.710 -43.539 -0.247 1.00 11.55 C ATOM 1670 OE1 GLN A 105 10.983 -43.609 0.745 1.00 41.40 O ATOM 1671 NE2 GLN A 105 12.782 -42.757 -0.294 1.00 25.11 N ATOM 0 H GLN A 105 9.035 -43.563 -3.021 1.00 53.01 H new ATOM 0 HA GLN A 105 10.789 -41.767 -1.751 1.00 25.20 H new ATOM 0 HB2 GLN A 105 11.155 -44.143 -3.602 1.00 41.31 H new ATOM 0 HB3 GLN A 105 12.525 -43.264 -2.954 1.00 41.31 H new ATOM 0 HG2 GLN A 105 10.419 -44.795 -1.400 1.00 43.25 H new ATOM 0 HG3 GLN A 105 12.122 -45.182 -1.553 1.00 43.25 H new ATOM 0 HE21 GLN A 105 13.357 -42.730 -1.136 1.00 25.11 H new ATOM 0 HE22 GLN A 105 13.031 -42.184 0.512 1.00 25.11 H new ATOM 1680 N MET A 106 10.437 -41.376 -4.966 1.00 54.20 N ATOM 1681 CA MET A 106 10.767 -40.513 -6.095 1.00 31.24 C ATOM 1682 C MET A 106 10.464 -39.054 -5.770 1.00 45.21 C ATOM 1683 O MET A 106 11.280 -38.168 -6.030 1.00 12.32 O ATOM 1684 CB MET A 106 9.987 -40.944 -7.338 1.00 51.53 C ATOM 1685 CG MET A 106 10.475 -40.287 -8.619 1.00 42.23 C ATOM 1686 SD MET A 106 9.362 -40.564 -10.010 1.00 71.32 S ATOM 1687 CE MET A 106 9.002 -42.308 -9.813 1.00 43.14 C ATOM 0 H MET A 106 9.675 -42.031 -5.144 1.00 54.20 H new ATOM 0 HA MET A 106 11.834 -40.608 -6.294 1.00 31.24 H new ATOM 0 HB2 MET A 106 10.058 -42.026 -7.444 1.00 51.53 H new ATOM 0 HB3 MET A 106 8.933 -40.706 -7.196 1.00 51.53 H new ATOM 0 HG2 MET A 106 10.584 -39.215 -8.454 1.00 42.23 H new ATOM 0 HG3 MET A 106 11.463 -40.674 -8.867 1.00 42.23 H new ATOM 0 HE1 MET A 106 8.440 -42.663 -10.677 1.00 43.14 H new ATOM 0 HE2 MET A 106 9.935 -42.865 -9.732 1.00 43.14 H new ATOM 0 HE3 MET A 106 8.411 -42.458 -8.910 1.00 43.14 H new ATOM 1697 N LEU A 107 9.289 -38.810 -5.202 1.00 33.22 N ATOM 1698 CA LEU A 107 8.879 -37.457 -4.842 1.00 35.20 C ATOM 1699 C LEU A 107 9.833 -36.853 -3.817 1.00 63.22 C ATOM 1700 O LEU A 107 10.056 -35.642 -3.797 1.00 73.12 O ATOM 1701 CB LEU A 107 7.454 -37.466 -4.285 1.00 72.23 C ATOM 1702 CG LEU A 107 7.039 -36.232 -3.483 1.00 31.51 C ATOM 1703 CD1 LEU A 107 7.173 -34.976 -4.329 1.00 13.22 C ATOM 1704 CD2 LEU A 107 5.614 -36.384 -2.971 1.00 11.33 C ATOM 0 H LEU A 107 8.603 -39.531 -4.980 1.00 33.22 H new ATOM 0 HA LEU A 107 8.907 -36.844 -5.743 1.00 35.20 H new ATOM 0 HB2 LEU A 107 6.761 -37.583 -5.118 1.00 72.23 H new ATOM 0 HB3 LEU A 107 7.340 -38.344 -3.649 1.00 72.23 H new ATOM 0 HG LEU A 107 7.704 -36.139 -2.625 1.00 31.51 H new ATOM 0 HD11 LEU A 107 6.873 -34.108 -3.742 1.00 13.22 H new ATOM 0 HD12 LEU A 107 8.209 -34.860 -4.646 1.00 13.22 H new ATOM 0 HD13 LEU A 107 6.532 -35.059 -5.207 1.00 13.22 H new ATOM 0 HD21 LEU A 107 5.335 -35.497 -2.402 1.00 11.33 H new ATOM 0 HD22 LEU A 107 4.935 -36.502 -3.815 1.00 11.33 H new ATOM 0 HD23 LEU A 107 5.550 -37.262 -2.328 1.00 11.33 H new ATOM 1716 N THR A 108 10.398 -37.706 -2.967 1.00 51.43 N ATOM 1717 CA THR A 108 11.330 -37.257 -1.941 1.00 13.25 C ATOM 1718 C THR A 108 12.570 -36.625 -2.562 1.00 0.01 C ATOM 1719 O THR A 108 13.279 -35.858 -1.912 1.00 3.13 O ATOM 1720 CB THR A 108 11.762 -38.420 -1.028 1.00 3.55 C ATOM 1721 OG1 THR A 108 10.612 -39.027 -0.430 1.00 33.13 O ATOM 1722 CG2 THR A 108 12.707 -37.931 0.060 1.00 11.22 C ATOM 0 H THR A 108 10.226 -38.711 -2.970 1.00 51.43 H new ATOM 0 HA THR A 108 10.807 -36.510 -1.344 1.00 13.25 H new ATOM 0 HB THR A 108 12.285 -39.157 -1.638 1.00 3.55 H new ATOM 0 HG1 THR A 108 10.060 -39.439 -1.127 1.00 33.13 H new ATOM 0 HG21 THR A 108 12.999 -38.769 0.692 1.00 11.22 H new ATOM 0 HG22 THR A 108 13.595 -37.496 -0.398 1.00 11.22 H new ATOM 0 HG23 THR A 108 12.205 -37.177 0.666 1.00 11.22 H new ATOM 1730 N ALA A 109 12.826 -36.952 -3.824 1.00 55.25 N ATOM 1731 CA ALA A 109 13.979 -36.414 -4.534 1.00 42.44 C ATOM 1732 C ALA A 109 13.591 -35.201 -5.373 1.00 51.31 C ATOM 1733 O ALA A 109 14.427 -34.349 -5.675 1.00 62.40 O ATOM 1734 CB ALA A 109 14.606 -37.486 -5.413 1.00 30.33 C ATOM 0 H ALA A 109 12.250 -37.587 -4.376 1.00 55.25 H new ATOM 0 HA ALA A 109 14.711 -36.092 -3.794 1.00 42.44 H new ATOM 0 HB1 ALA A 109 15.466 -37.069 -5.937 1.00 30.33 H new ATOM 0 HB2 ALA A 109 14.929 -38.322 -4.793 1.00 30.33 H new ATOM 0 HB3 ALA A 109 13.873 -37.836 -6.140 1.00 30.33 H new ATOM 1740 N SER A 110 12.317 -35.129 -5.747 1.00 45.21 N ATOM 1741 CA SER A 110 11.820 -34.022 -6.555 1.00 55.13 C ATOM 1742 C SER A 110 11.894 -32.708 -5.783 1.00 22.44 C ATOM 1743 O SER A 110 12.399 -31.705 -6.288 1.00 72.20 O ATOM 1744 CB SER A 110 10.378 -34.289 -6.991 1.00 75.10 C ATOM 1745 OG SER A 110 9.487 -34.191 -5.893 1.00 74.24 O ATOM 0 H SER A 110 11.611 -35.824 -5.503 1.00 45.21 H new ATOM 0 HA SER A 110 12.451 -33.939 -7.440 1.00 55.13 H new ATOM 0 HB2 SER A 110 10.090 -33.575 -7.762 1.00 75.10 H new ATOM 0 HB3 SER A 110 10.307 -35.282 -7.434 1.00 75.10 H new ATOM 0 HG SER A 110 9.812 -34.750 -5.157 1.00 74.24 H new ATOM 1751 N HIS A 111 11.388 -32.723 -4.554 1.00 12.54 N ATOM 1752 CA HIS A 111 11.397 -31.533 -3.709 1.00 60.23 C ATOM 1753 C HIS A 111 12.822 -31.034 -3.489 1.00 30.53 C ATOM 1754 O HIS A 111 13.038 -29.873 -3.142 1.00 43.30 O ATOM 1755 CB HIS A 111 10.735 -31.832 -2.364 1.00 13.20 C ATOM 1756 CG HIS A 111 10.245 -30.608 -1.653 1.00 22.14 C ATOM 1757 ND1 HIS A 111 9.904 -29.386 -2.125 1.00 75.03 N flip ATOM 1758 CD2 HIS A 111 10.060 -30.555 -0.287 1.00 21.40 C flip ATOM 1759 CE1 HIS A 111 9.521 -28.626 -1.048 1.00 33.22 C flip ATOM 1760 NE2 HIS A 111 9.624 -29.354 0.049 1.00 3.42 N flip ATOM 0 H HIS A 111 10.967 -33.545 -4.121 1.00 12.54 H new ATOM 0 HA HIS A 111 10.832 -30.752 -4.217 1.00 60.23 H new ATOM 0 HB2 HIS A 111 9.896 -32.510 -2.524 1.00 13.20 H new ATOM 0 HB3 HIS A 111 11.448 -32.353 -1.725 1.00 13.20 H new ATOM 0 HD2 HIS A 111 10.243 -31.368 0.400 1.00 21.40 H new ATOM 0 HE1 HIS A 111 9.189 -27.599 -1.091 1.00 33.22 H new ATOM 0 HE2 HIS A 111 9.404 -29.042 0.995 1.00 3.42 H new ATOM 1768 N THR A 112 13.792 -31.921 -3.691 1.00 41.31 N ATOM 1769 CA THR A 112 15.196 -31.572 -3.513 1.00 13.44 C ATOM 1770 C THR A 112 15.648 -30.560 -4.559 1.00 50.50 C ATOM 1771 O THR A 112 16.553 -29.761 -4.315 1.00 5.02 O ATOM 1772 CB THR A 112 16.099 -32.816 -3.595 1.00 22.42 C ATOM 1773 OG1 THR A 112 15.525 -33.889 -2.840 1.00 74.44 O ATOM 1774 CG2 THR A 112 17.493 -32.509 -3.068 1.00 70.34 C ATOM 0 H THR A 112 13.631 -32.886 -3.978 1.00 41.31 H new ATOM 0 HA THR A 112 15.288 -31.130 -2.521 1.00 13.44 H new ATOM 0 HB THR A 112 16.179 -33.110 -4.641 1.00 22.42 H new ATOM 0 HG1 THR A 112 16.105 -34.677 -2.899 1.00 74.44 H new ATOM 0 HG21 THR A 112 18.113 -33.403 -3.136 1.00 70.34 H new ATOM 0 HG22 THR A 112 17.939 -31.712 -3.663 1.00 70.34 H new ATOM 0 HG23 THR A 112 17.427 -32.192 -2.027 1.00 70.34 H new ATOM 1782 N LEU A 113 15.012 -30.597 -5.725 1.00 24.11 N ATOM 1783 CA LEU A 113 15.349 -29.682 -6.810 1.00 1.33 C ATOM 1784 C LEU A 113 14.875 -28.267 -6.495 1.00 53.51 C ATOM 1785 O LEU A 113 15.416 -27.290 -7.013 1.00 21.31 O ATOM 1786 CB LEU A 113 14.724 -30.162 -8.121 1.00 2.41 C ATOM 1787 CG LEU A 113 15.444 -31.312 -8.826 1.00 0.20 C ATOM 1788 CD1 LEU A 113 14.863 -32.649 -8.395 1.00 21.45 C ATOM 1789 CD2 LEU A 113 15.354 -31.151 -10.337 1.00 33.35 C ATOM 0 H LEU A 113 14.260 -31.251 -5.943 1.00 24.11 H new ATOM 0 HA LEU A 113 16.434 -29.667 -6.916 1.00 1.33 H new ATOM 0 HB2 LEU A 113 13.698 -30.471 -7.920 1.00 2.41 H new ATOM 0 HB3 LEU A 113 14.673 -29.317 -8.807 1.00 2.41 H new ATOM 0 HG LEU A 113 16.496 -31.287 -8.540 1.00 0.20 H new ATOM 0 HD11 LEU A 113 15.388 -33.456 -8.907 1.00 21.45 H new ATOM 0 HD12 LEU A 113 14.980 -32.766 -7.318 1.00 21.45 H new ATOM 0 HD13 LEU A 113 13.804 -32.685 -8.651 1.00 21.45 H new ATOM 0 HD21 LEU A 113 15.872 -31.978 -10.823 1.00 33.35 H new ATOM 0 HD22 LEU A 113 14.307 -31.150 -10.641 1.00 33.35 H new ATOM 0 HD23 LEU A 113 15.818 -30.210 -10.631 1.00 33.35 H new ATOM 1801 N ALA A 114 13.861 -28.164 -5.641 1.00 44.23 N ATOM 1802 CA ALA A 114 13.317 -26.868 -5.254 1.00 61.22 C ATOM 1803 C ALA A 114 13.923 -26.389 -3.940 1.00 2.34 C ATOM 1804 O ALA A 114 14.284 -25.220 -3.801 1.00 23.14 O ATOM 1805 CB ALA A 114 11.802 -26.945 -5.142 1.00 54.30 C ATOM 0 H ALA A 114 13.400 -28.962 -5.204 1.00 44.23 H new ATOM 0 HA ALA A 114 13.577 -26.146 -6.028 1.00 61.22 H new ATOM 0 HB1 ALA A 114 11.409 -25.971 -4.852 1.00 54.30 H new ATOM 0 HB2 ALA A 114 11.380 -27.235 -6.104 1.00 54.30 H new ATOM 0 HB3 ALA A 114 11.530 -27.685 -4.389 1.00 54.30 H new ATOM 1811 N VAL A 115 14.031 -27.299 -2.977 1.00 5.55 N ATOM 1812 CA VAL A 115 14.594 -26.968 -1.673 1.00 24.33 C ATOM 1813 C VAL A 115 16.004 -26.403 -1.810 1.00 33.33 C ATOM 1814 O VAL A 115 16.460 -25.634 -0.964 1.00 0.12 O ATOM 1815 CB VAL A 115 14.635 -28.201 -0.750 1.00 72.13 C ATOM 1816 CG1 VAL A 115 15.834 -29.077 -1.081 1.00 10.51 C ATOM 1817 CG2 VAL A 115 14.663 -27.773 0.709 1.00 31.23 C ATOM 0 H VAL A 115 13.736 -28.271 -3.075 1.00 5.55 H new ATOM 0 HA VAL A 115 13.944 -26.213 -1.230 1.00 24.33 H new ATOM 0 HB VAL A 115 13.731 -28.787 -0.915 1.00 72.13 H new ATOM 0 HG11 VAL A 115 15.846 -29.943 -0.419 1.00 10.51 H new ATOM 0 HG12 VAL A 115 15.765 -29.413 -2.116 1.00 10.51 H new ATOM 0 HG13 VAL A 115 16.751 -28.504 -0.946 1.00 10.51 H new ATOM 0 HG21 VAL A 115 14.692 -28.656 1.347 1.00 31.23 H new ATOM 0 HG22 VAL A 115 15.548 -27.164 0.893 1.00 31.23 H new ATOM 0 HG23 VAL A 115 13.769 -27.191 0.935 1.00 31.23 H new ATOM 1827 N ASP A 116 16.688 -26.790 -2.881 1.00 3.45 N ATOM 1828 CA ASP A 116 18.046 -26.320 -3.130 1.00 63.31 C ATOM 1829 C ASP A 116 18.037 -25.062 -3.993 1.00 74.41 C ATOM 1830 O ASP A 116 19.062 -24.402 -4.156 1.00 11.42 O ATOM 1831 CB ASP A 116 18.870 -27.415 -3.811 1.00 52.40 C ATOM 1832 CG ASP A 116 19.837 -28.089 -2.858 1.00 34.31 C ATOM 1833 OD1 ASP A 116 20.548 -27.369 -2.126 1.00 74.34 O ATOM 1834 OD2 ASP A 116 19.883 -29.337 -2.844 1.00 71.40 O ATOM 0 H ASP A 116 16.325 -27.427 -3.590 1.00 3.45 H new ATOM 0 HA ASP A 116 18.501 -26.076 -2.170 1.00 63.31 H new ATOM 0 HB2 ASP A 116 18.198 -28.163 -4.231 1.00 52.40 H new ATOM 0 HB3 ASP A 116 19.426 -26.983 -4.643 1.00 52.40 H new ATOM 1839 N ALA A 117 16.872 -24.738 -4.545 1.00 33.34 N ATOM 1840 CA ALA A 117 16.728 -23.560 -5.390 1.00 44.31 C ATOM 1841 C ALA A 117 16.313 -22.343 -4.570 1.00 3.01 C ATOM 1842 O ALA A 117 16.288 -21.220 -5.074 1.00 71.24 O ATOM 1843 CB ALA A 117 15.717 -23.823 -6.496 1.00 21.21 C ATOM 0 H ALA A 117 16.014 -25.276 -4.422 1.00 33.34 H new ATOM 0 HA ALA A 117 17.697 -23.348 -5.842 1.00 44.31 H new ATOM 0 HB1 ALA A 117 15.620 -22.934 -7.119 1.00 21.21 H new ATOM 0 HB2 ALA A 117 16.056 -24.659 -7.107 1.00 21.21 H new ATOM 0 HB3 ALA A 117 14.750 -24.064 -6.055 1.00 21.21 H new ATOM 1849 N LYS A 118 15.987 -22.573 -3.302 1.00 45.25 N ATOM 1850 CA LYS A 118 15.574 -21.496 -2.411 1.00 14.21 C ATOM 1851 C LYS A 118 16.780 -20.861 -1.727 1.00 65.33 C ATOM 1852 O LYS A 118 16.933 -19.641 -1.725 1.00 3.31 O ATOM 1853 CB LYS A 118 14.597 -22.025 -1.358 1.00 2.42 C ATOM 1854 CG LYS A 118 13.144 -21.700 -1.658 1.00 1.50 C ATOM 1855 CD LYS A 118 12.520 -22.734 -2.580 1.00 2.13 C ATOM 1856 CE LYS A 118 11.749 -23.786 -1.796 1.00 45.35 C ATOM 1857 NZ LYS A 118 10.837 -24.571 -2.672 1.00 71.45 N ATOM 0 H LYS A 118 16.001 -23.496 -2.869 1.00 45.25 H new ATOM 0 HA LYS A 118 15.076 -20.734 -3.010 1.00 14.21 H new ATOM 0 HB2 LYS A 118 14.710 -23.106 -1.280 1.00 2.42 H new ATOM 0 HB3 LYS A 118 14.861 -21.606 -0.387 1.00 2.42 H new ATOM 0 HG2 LYS A 118 12.580 -21.655 -0.726 1.00 1.50 H new ATOM 0 HG3 LYS A 118 13.078 -20.714 -2.118 1.00 1.50 H new ATOM 0 HD2 LYS A 118 11.850 -22.239 -3.283 1.00 2.13 H new ATOM 0 HD3 LYS A 118 13.300 -23.216 -3.169 1.00 2.13 H new ATOM 0 HE2 LYS A 118 12.451 -24.460 -1.305 1.00 45.35 H new ATOM 0 HE3 LYS A 118 11.170 -23.301 -1.010 1.00 45.35 H new ATOM 0 HZ1 LYS A 118 9.850 -24.324 -2.456 1.00 71.45 H new ATOM 0 HZ2 LYS A 118 11.039 -24.352 -3.668 1.00 71.45 H new ATOM 0 HZ3 LYS A 118 10.984 -25.587 -2.504 1.00 71.45 H new ATOM 1871 N ASN A 119 17.636 -21.699 -1.150 1.00 13.35 N ATOM 1872 CA ASN A 119 18.830 -21.219 -0.463 1.00 51.15 C ATOM 1873 C ASN A 119 19.639 -20.291 -1.365 1.00 22.33 C ATOM 1874 O ASN A 119 20.255 -19.333 -0.895 1.00 60.33 O ATOM 1875 CB ASN A 119 19.696 -22.399 -0.018 1.00 1.22 C ATOM 1876 CG ASN A 119 20.544 -22.952 -1.146 1.00 65.14 C ATOM 1877 OD1 ASN A 119 21.532 -22.339 -1.554 1.00 34.54 O ATOM 1878 ND2 ASN A 119 20.162 -24.116 -1.658 1.00 21.42 N ATOM 0 H ASN A 119 17.525 -22.713 -1.145 1.00 13.35 H new ATOM 0 HA ASN A 119 18.513 -20.658 0.416 1.00 51.15 H new ATOM 0 HB2 ASN A 119 20.345 -22.082 0.799 1.00 1.22 H new ATOM 0 HB3 ASN A 119 19.055 -23.190 0.372 1.00 1.22 H new ATOM 0 HD21 ASN A 119 20.694 -24.537 -2.420 1.00 21.42 H new ATOM 0 HD22 ASN A 119 19.337 -24.589 -1.289 1.00 21.42 H new ATOM 1885 N LEU A 120 19.633 -20.582 -2.661 1.00 2.41 N ATOM 1886 CA LEU A 120 20.366 -19.773 -3.629 1.00 61.44 C ATOM 1887 C LEU A 120 19.757 -18.380 -3.748 1.00 31.11 C ATOM 1888 O LEU A 120 20.474 -17.381 -3.812 1.00 1.41 O ATOM 1889 CB LEU A 120 20.369 -20.459 -4.997 1.00 3.01 C ATOM 1890 CG LEU A 120 21.636 -20.279 -5.835 1.00 14.01 C ATOM 1891 CD1 LEU A 120 21.440 -20.857 -7.228 1.00 23.00 C ATOM 1892 CD2 LEU A 120 22.018 -18.808 -5.915 1.00 32.24 C ATOM 0 H LEU A 120 19.129 -21.371 -3.066 1.00 2.41 H new ATOM 0 HA LEU A 120 21.393 -19.671 -3.277 1.00 61.44 H new ATOM 0 HB2 LEU A 120 20.205 -21.526 -4.847 1.00 3.01 H new ATOM 0 HB3 LEU A 120 19.521 -20.084 -5.571 1.00 3.01 H new ATOM 0 HG LEU A 120 22.449 -20.819 -5.350 1.00 14.01 H new ATOM 0 HD11 LEU A 120 22.351 -20.720 -7.810 1.00 23.00 H new ATOM 0 HD12 LEU A 120 21.214 -21.921 -7.152 1.00 23.00 H new ATOM 0 HD13 LEU A 120 20.614 -20.345 -7.721 1.00 23.00 H new ATOM 0 HD21 LEU A 120 22.922 -18.699 -6.515 1.00 32.24 H new ATOM 0 HD22 LEU A 120 21.206 -18.246 -6.376 1.00 32.24 H new ATOM 0 HD23 LEU A 120 22.200 -18.424 -4.911 1.00 32.24 H new ATOM 1904 N LEU A 121 18.430 -18.321 -3.774 1.00 41.54 N ATOM 1905 CA LEU A 121 17.723 -17.049 -3.883 1.00 3.04 C ATOM 1906 C LEU A 121 18.213 -16.062 -2.828 1.00 22.22 C ATOM 1907 O LEU A 121 18.423 -14.884 -3.116 1.00 15.45 O ATOM 1908 CB LEU A 121 16.217 -17.266 -3.733 1.00 75.34 C ATOM 1909 CG LEU A 121 15.360 -16.002 -3.657 1.00 43.41 C ATOM 1910 CD1 LEU A 121 14.012 -16.229 -4.323 1.00 11.04 C ATOM 1911 CD2 LEU A 121 15.177 -15.568 -2.210 1.00 33.51 C ATOM 0 H LEU A 121 17.822 -19.138 -3.721 1.00 41.54 H new ATOM 0 HA LEU A 121 17.928 -16.631 -4.869 1.00 3.04 H new ATOM 0 HB2 LEU A 121 15.871 -17.865 -4.575 1.00 75.34 H new ATOM 0 HB3 LEU A 121 16.043 -17.853 -2.831 1.00 75.34 H new ATOM 0 HG LEU A 121 15.875 -15.204 -4.192 1.00 43.41 H new ATOM 0 HD11 LEU A 121 13.416 -15.318 -4.259 1.00 11.04 H new ATOM 0 HD12 LEU A 121 14.163 -16.491 -5.370 1.00 11.04 H new ATOM 0 HD13 LEU A 121 13.489 -17.041 -3.818 1.00 11.04 H new ATOM 0 HD21 LEU A 121 14.565 -14.667 -2.175 1.00 33.51 H new ATOM 0 HD22 LEU A 121 14.684 -16.364 -1.651 1.00 33.51 H new ATOM 0 HD23 LEU A 121 16.151 -15.362 -1.766 1.00 33.51 H new ATOM 1923 N ASP A 122 18.396 -16.552 -1.607 1.00 30.04 N ATOM 1924 CA ASP A 122 18.865 -15.714 -0.509 1.00 31.21 C ATOM 1925 C ASP A 122 20.375 -15.514 -0.585 1.00 23.12 C ATOM 1926 O ASP A 122 20.890 -14.458 -0.220 1.00 44.32 O ATOM 1927 CB ASP A 122 18.488 -16.339 0.835 1.00 34.21 C ATOM 1928 CG ASP A 122 18.492 -15.329 1.965 1.00 11.51 C ATOM 1929 OD1 ASP A 122 18.531 -14.114 1.675 1.00 21.24 O ATOM 1930 OD2 ASP A 122 18.455 -15.752 3.139 1.00 3.12 O ATOM 0 H ASP A 122 18.227 -17.525 -1.352 1.00 30.04 H new ATOM 0 HA ASP A 122 18.383 -14.740 -0.596 1.00 31.21 H new ATOM 0 HB2 ASP A 122 17.498 -16.790 0.758 1.00 34.21 H new ATOM 0 HB3 ASP A 122 19.187 -17.143 1.067 1.00 34.21 H new ATOM 1935 N ALA A 123 21.079 -16.536 -1.060 1.00 23.31 N ATOM 1936 CA ALA A 123 22.530 -16.472 -1.184 1.00 62.35 C ATOM 1937 C ALA A 123 22.949 -15.398 -2.183 1.00 33.41 C ATOM 1938 O ALA A 123 23.688 -14.475 -1.843 1.00 42.30 O ATOM 1939 CB ALA A 123 23.084 -17.827 -1.600 1.00 44.01 C ATOM 0 H ALA A 123 20.668 -17.418 -1.365 1.00 23.31 H new ATOM 0 HA ALA A 123 22.942 -16.206 -0.210 1.00 62.35 H new ATOM 0 HB1 ALA A 123 24.169 -17.765 -1.689 1.00 44.01 H new ATOM 0 HB2 ALA A 123 22.824 -18.573 -0.849 1.00 44.01 H new ATOM 0 HB3 ALA A 123 22.657 -18.115 -2.561 1.00 44.01 H new ATOM 1945 N VAL A 124 22.471 -15.526 -3.417 1.00 65.01 N ATOM 1946 CA VAL A 124 22.796 -14.566 -4.465 1.00 50.03 C ATOM 1947 C VAL A 124 22.187 -13.200 -4.167 1.00 63.43 C ATOM 1948 O VAL A 124 22.685 -12.173 -4.628 1.00 65.34 O ATOM 1949 CB VAL A 124 22.299 -15.048 -5.841 1.00 64.12 C ATOM 1950 CG1 VAL A 124 20.779 -15.071 -5.882 1.00 60.42 C ATOM 1951 CG2 VAL A 124 22.857 -14.166 -6.948 1.00 3.43 C ATOM 0 H VAL A 124 21.858 -16.285 -3.715 1.00 65.01 H new ATOM 0 HA VAL A 124 23.882 -14.479 -4.489 1.00 50.03 H new ATOM 0 HB VAL A 124 22.658 -16.064 -6.002 1.00 64.12 H new ATOM 0 HG11 VAL A 124 20.447 -15.414 -6.862 1.00 60.42 H new ATOM 0 HG12 VAL A 124 20.405 -15.748 -5.114 1.00 60.42 H new ATOM 0 HG13 VAL A 124 20.395 -14.067 -5.699 1.00 60.42 H new ATOM 0 HG21 VAL A 124 22.496 -14.521 -7.913 1.00 3.43 H new ATOM 0 HG22 VAL A 124 22.530 -13.138 -6.794 1.00 3.43 H new ATOM 0 HG23 VAL A 124 23.946 -14.206 -6.931 1.00 3.43 H new ATOM 1961 N ASP A 125 21.108 -13.196 -3.393 1.00 74.34 N ATOM 1962 CA ASP A 125 20.431 -11.956 -3.032 1.00 33.32 C ATOM 1963 C ASP A 125 21.393 -10.993 -2.343 1.00 54.14 C ATOM 1964 O ASP A 125 21.464 -9.816 -2.696 1.00 24.12 O ATOM 1965 CB ASP A 125 19.240 -12.248 -2.117 1.00 70.23 C ATOM 1966 CG ASP A 125 18.769 -11.017 -1.369 1.00 3.32 C ATOM 1967 OD1 ASP A 125 18.499 -9.990 -2.027 1.00 20.44 O ATOM 1968 OD2 ASP A 125 18.672 -11.079 -0.125 1.00 40.11 O ATOM 0 H ASP A 125 20.683 -14.037 -3.003 1.00 74.34 H new ATOM 0 HA ASP A 125 20.070 -11.488 -3.948 1.00 33.32 H new ATOM 0 HB2 ASP A 125 18.417 -12.645 -2.712 1.00 70.23 H new ATOM 0 HB3 ASP A 125 19.517 -13.021 -1.400 1.00 70.23 H new ATOM 1973 N GLN A 126 22.128 -11.501 -1.360 1.00 63.21 N ATOM 1974 CA GLN A 126 23.084 -10.685 -0.621 1.00 42.34 C ATOM 1975 C GLN A 126 24.413 -10.596 -1.365 1.00 11.33 C ATOM 1976 O GLN A 126 25.070 -9.555 -1.359 1.00 21.33 O ATOM 1977 CB GLN A 126 23.307 -11.262 0.777 1.00 35.25 C ATOM 1978 CG GLN A 126 22.068 -11.217 1.658 1.00 22.21 C ATOM 1979 CD GLN A 126 21.622 -9.801 1.966 1.00 61.51 C ATOM 1980 OE1 GLN A 126 21.968 -9.242 3.006 1.00 2.55 O ATOM 1981 NE2 GLN A 126 20.849 -9.214 1.060 1.00 42.11 N ATOM 0 H GLN A 126 22.080 -12.474 -1.057 1.00 63.21 H new ATOM 0 HA GLN A 126 22.671 -9.680 -0.530 1.00 42.34 H new ATOM 0 HB2 GLN A 126 23.640 -12.296 0.686 1.00 35.25 H new ATOM 0 HB3 GLN A 126 24.110 -10.710 1.265 1.00 35.25 H new ATOM 0 HG2 GLN A 126 21.256 -11.750 1.164 1.00 22.21 H new ATOM 0 HG3 GLN A 126 22.272 -11.741 2.592 1.00 22.21 H new ATOM 0 HE21 GLN A 126 20.587 -9.716 0.211 1.00 42.11 H new ATOM 0 HE22 GLN A 126 20.518 -8.261 1.213 1.00 42.11 H new ATOM 1990 N ALA A 127 24.803 -11.694 -2.004 1.00 15.12 N ATOM 1991 CA ALA A 127 26.052 -11.739 -2.753 1.00 70.11 C ATOM 1992 C ALA A 127 26.057 -10.707 -3.875 1.00 54.25 C ATOM 1993 O ALA A 127 27.054 -10.020 -4.098 1.00 63.50 O ATOM 1994 CB ALA A 127 26.280 -13.134 -3.316 1.00 31.34 C ATOM 0 H ALA A 127 24.271 -12.564 -2.018 1.00 15.12 H new ATOM 0 HA ALA A 127 26.866 -11.497 -2.069 1.00 70.11 H new ATOM 0 HB1 ALA A 127 27.217 -13.153 -3.873 1.00 31.34 H new ATOM 0 HB2 ALA A 127 26.330 -13.853 -2.498 1.00 31.34 H new ATOM 0 HB3 ALA A 127 25.457 -13.397 -3.981 1.00 31.34 H new ATOM 2000 N LYS A 128 24.936 -10.602 -4.581 1.00 53.02 N ATOM 2001 CA LYS A 128 24.809 -9.653 -5.681 1.00 64.10 C ATOM 2002 C LYS A 128 24.970 -8.220 -5.184 1.00 41.13 C ATOM 2003 O LYS A 128 25.493 -7.361 -5.894 1.00 62.14 O ATOM 2004 CB LYS A 128 23.452 -9.816 -6.369 1.00 63.43 C ATOM 2005 CG LYS A 128 23.377 -9.149 -7.732 1.00 22.42 C ATOM 2006 CD LYS A 128 22.364 -9.835 -8.633 1.00 64.23 C ATOM 2007 CE LYS A 128 20.943 -9.631 -8.132 1.00 1.25 C ATOM 2008 NZ LYS A 128 20.343 -8.376 -8.662 1.00 54.33 N ATOM 0 H LYS A 128 24.101 -11.163 -4.411 1.00 53.02 H new ATOM 0 HA LYS A 128 25.601 -9.861 -6.400 1.00 64.10 H new ATOM 0 HB2 LYS A 128 23.236 -10.879 -6.481 1.00 63.43 H new ATOM 0 HB3 LYS A 128 22.676 -9.399 -5.727 1.00 63.43 H new ATOM 0 HG2 LYS A 128 23.106 -8.100 -7.611 1.00 22.42 H new ATOM 0 HG3 LYS A 128 24.359 -9.172 -8.204 1.00 22.42 H new ATOM 0 HD2 LYS A 128 22.453 -9.443 -9.646 1.00 64.23 H new ATOM 0 HD3 LYS A 128 22.584 -10.901 -8.683 1.00 64.23 H new ATOM 0 HE2 LYS A 128 20.328 -10.481 -8.428 1.00 1.25 H new ATOM 0 HE3 LYS A 128 20.943 -9.602 -7.042 1.00 1.25 H new ATOM 0 HZ1 LYS A 128 19.464 -8.167 -8.147 1.00 54.33 H new ATOM 0 HZ2 LYS A 128 21.013 -7.591 -8.536 1.00 54.33 H new ATOM 0 HZ3 LYS A 128 20.132 -8.492 -9.674 1.00 54.33 H new ATOM 2022 N VAL A 129 24.518 -7.969 -3.960 1.00 1.53 N ATOM 2023 CA VAL A 129 24.614 -6.640 -3.367 1.00 43.10 C ATOM 2024 C VAL A 129 26.038 -6.344 -2.909 1.00 20.43 C ATOM 2025 O VAL A 129 26.513 -5.213 -3.013 1.00 2.32 O ATOM 2026 CB VAL A 129 23.659 -6.490 -2.168 1.00 42.31 C ATOM 2027 CG1 VAL A 129 23.787 -5.104 -1.554 1.00 13.11 C ATOM 2028 CG2 VAL A 129 22.224 -6.764 -2.593 1.00 4.41 C ATOM 0 H VAL A 129 24.082 -8.668 -3.359 1.00 1.53 H new ATOM 0 HA VAL A 129 24.329 -5.927 -4.140 1.00 43.10 H new ATOM 0 HB VAL A 129 23.936 -7.223 -1.411 1.00 42.31 H new ATOM 0 HG11 VAL A 129 23.105 -5.016 -0.708 1.00 13.11 H new ATOM 0 HG12 VAL A 129 24.811 -4.951 -1.212 1.00 13.11 H new ATOM 0 HG13 VAL A 129 23.537 -4.351 -2.301 1.00 13.11 H new ATOM 0 HG21 VAL A 129 21.563 -6.654 -1.734 1.00 4.41 H new ATOM 0 HG22 VAL A 129 21.933 -6.056 -3.368 1.00 4.41 H new ATOM 0 HG23 VAL A 129 22.147 -7.779 -2.982 1.00 4.41 H new ATOM 2038 N LEU A 130 26.715 -7.369 -2.402 1.00 11.35 N ATOM 2039 CA LEU A 130 28.086 -7.220 -1.927 1.00 43.30 C ATOM 2040 C LEU A 130 29.037 -6.944 -3.087 1.00 40.25 C ATOM 2041 O LEU A 130 30.112 -6.375 -2.900 1.00 62.21 O ATOM 2042 CB LEU A 130 28.528 -8.479 -1.180 1.00 32.25 C ATOM 2043 CG LEU A 130 27.860 -8.725 0.174 1.00 63.10 C ATOM 2044 CD1 LEU A 130 28.441 -9.964 0.838 1.00 11.34 C ATOM 2045 CD2 LEU A 130 28.019 -7.510 1.076 1.00 44.32 C ATOM 0 H LEU A 130 26.337 -8.312 -2.309 1.00 11.35 H new ATOM 0 HA LEU A 130 28.117 -6.370 -1.245 1.00 43.30 H new ATOM 0 HB2 LEU A 130 28.338 -9.342 -1.819 1.00 32.25 H new ATOM 0 HB3 LEU A 130 29.606 -8.427 -1.027 1.00 32.25 H new ATOM 0 HG LEU A 130 26.796 -8.892 0.008 1.00 63.10 H new ATOM 0 HD11 LEU A 130 27.954 -10.123 1.800 1.00 11.34 H new ATOM 0 HD12 LEU A 130 28.275 -10.831 0.199 1.00 11.34 H new ATOM 0 HD13 LEU A 130 29.511 -9.826 0.992 1.00 11.34 H new ATOM 0 HD21 LEU A 130 27.538 -7.703 2.035 1.00 44.32 H new ATOM 0 HD22 LEU A 130 29.079 -7.311 1.235 1.00 44.32 H new ATOM 0 HD23 LEU A 130 27.555 -6.644 0.605 1.00 44.32 H new ATOM 2057 N ALA A 131 28.632 -7.349 -4.287 1.00 11.43 N ATOM 2058 CA ALA A 131 29.446 -7.141 -5.478 1.00 75.22 C ATOM 2059 C ALA A 131 29.718 -5.658 -5.705 1.00 64.22 C ATOM 2060 O ALA A 131 30.870 -5.225 -5.721 1.00 54.21 O ATOM 2061 CB ALA A 131 28.763 -7.747 -6.696 1.00 15.54 C ATOM 0 H ALA A 131 27.745 -7.823 -4.459 1.00 11.43 H new ATOM 0 HA ALA A 131 30.403 -7.640 -5.326 1.00 75.22 H new ATOM 0 HB1 ALA A 131 29.382 -7.584 -7.579 1.00 15.54 H new ATOM 0 HB2 ALA A 131 28.626 -8.817 -6.541 1.00 15.54 H new ATOM 0 HB3 ALA A 131 27.792 -7.274 -6.842 1.00 15.54 H new ATOM 2067 N ASN A 132 28.652 -4.885 -5.881 1.00 72.01 N ATOM 2068 CA ASN A 132 28.777 -3.450 -6.109 1.00 1.03 C ATOM 2069 C ASN A 132 29.549 -2.784 -4.973 1.00 71.53 C ATOM 2070 O ASN A 132 30.453 -1.981 -5.209 1.00 74.42 O ATOM 2071 CB ASN A 132 27.393 -2.811 -6.243 1.00 24.01 C ATOM 2072 CG ASN A 132 26.687 -3.224 -7.520 1.00 20.44 C ATOM 2073 OD1 ASN A 132 25.584 -3.769 -7.483 1.00 55.13 O ATOM 2074 ND2 ASN A 132 27.322 -2.967 -8.657 1.00 43.00 N ATOM 0 H ASN A 132 27.691 -5.228 -5.870 1.00 72.01 H new ATOM 0 HA ASN A 132 29.330 -3.302 -7.037 1.00 1.03 H new ATOM 0 HB2 ASN A 132 26.781 -3.092 -5.386 1.00 24.01 H new ATOM 0 HB3 ASN A 132 27.493 -1.726 -6.221 1.00 24.01 H new ATOM 0 HD21 ASN A 132 26.897 -3.223 -9.548 1.00 43.00 H new ATOM 0 HD22 ASN A 132 28.235 -2.513 -8.640 1.00 43.00 H new ATOM 2081 N LEU A 133 29.187 -3.124 -3.741 1.00 42.00 N ATOM 2082 CA LEU A 133 29.846 -2.560 -2.568 1.00 33.44 C ATOM 2083 C LEU A 133 31.358 -2.738 -2.654 1.00 62.31 C ATOM 2084 O LEU A 133 32.119 -1.932 -2.120 1.00 64.21 O ATOM 2085 CB LEU A 133 29.315 -3.221 -1.294 1.00 40.21 C ATOM 2086 CG LEU A 133 27.844 -2.962 -0.967 1.00 0.24 C ATOM 2087 CD1 LEU A 133 27.442 -3.697 0.303 1.00 63.04 C ATOM 2088 CD2 LEU A 133 27.584 -1.469 -0.825 1.00 71.15 C ATOM 0 H LEU A 133 28.441 -3.787 -3.528 1.00 42.00 H new ATOM 0 HA LEU A 133 29.626 -1.493 -2.536 1.00 33.44 H new ATOM 0 HB2 LEU A 133 29.464 -4.298 -1.378 1.00 40.21 H new ATOM 0 HB3 LEU A 133 29.919 -2.880 -0.453 1.00 40.21 H new ATOM 0 HG LEU A 133 27.237 -3.340 -1.790 1.00 0.24 H new ATOM 0 HD11 LEU A 133 26.392 -3.501 0.520 1.00 63.04 H new ATOM 0 HD12 LEU A 133 27.590 -4.768 0.166 1.00 63.04 H new ATOM 0 HD13 LEU A 133 28.055 -3.349 1.134 1.00 63.04 H new ATOM 0 HD21 LEU A 133 26.532 -1.303 -0.592 1.00 71.15 H new ATOM 0 HD22 LEU A 133 28.201 -1.067 -0.021 1.00 71.15 H new ATOM 0 HD23 LEU A 133 27.832 -0.966 -1.759 1.00 71.15 H new ATOM 2100 N ALA A 134 31.786 -3.798 -3.332 1.00 24.21 N ATOM 2101 CA ALA A 134 33.208 -4.079 -3.492 1.00 74.41 C ATOM 2102 C ALA A 134 33.743 -3.479 -4.787 1.00 64.14 C ATOM 2103 O ALA A 134 32.985 -3.212 -5.720 1.00 51.11 O ATOM 2104 CB ALA A 134 33.455 -5.580 -3.462 1.00 23.43 C ATOM 0 H ALA A 134 31.169 -4.476 -3.779 1.00 24.21 H new ATOM 0 HA ALA A 134 33.741 -3.617 -2.661 1.00 74.41 H new ATOM 0 HB1 ALA A 134 34.520 -5.776 -3.582 1.00 23.43 H new ATOM 0 HB2 ALA A 134 33.117 -5.985 -2.508 1.00 23.43 H new ATOM 0 HB3 ALA A 134 32.905 -6.056 -4.274 1.00 23.43 H new ATOM 2110 N HIS A 135 35.055 -3.268 -4.839 1.00 31.54 N ATOM 2111 CA HIS A 135 35.692 -2.699 -6.021 1.00 22.14 C ATOM 2112 C HIS A 135 37.211 -2.814 -5.928 1.00 33.41 C ATOM 2113 O HIS A 135 37.835 -2.222 -5.047 1.00 70.00 O ATOM 2114 CB HIS A 135 35.290 -1.233 -6.187 1.00 34.41 C ATOM 2115 CG HIS A 135 35.870 -0.588 -7.407 1.00 42.42 C ATOM 2116 ND1 HIS A 135 35.790 -1.147 -8.665 1.00 50.20 N ATOM 2117 CD2 HIS A 135 36.541 0.578 -7.557 1.00 43.24 C ATOM 2118 CE1 HIS A 135 36.388 -0.354 -9.536 1.00 2.21 C ATOM 2119 NE2 HIS A 135 36.852 0.700 -8.889 1.00 44.34 N ATOM 0 H HIS A 135 35.697 -3.483 -4.076 1.00 31.54 H new ATOM 0 HA HIS A 135 35.355 -3.262 -6.891 1.00 22.14 H new ATOM 0 HB2 HIS A 135 34.203 -1.166 -6.232 1.00 34.41 H new ATOM 0 HB3 HIS A 135 35.607 -0.676 -5.306 1.00 34.41 H new ATOM 0 HD2 HIS A 135 36.786 1.281 -6.775 1.00 43.24 H new ATOM 0 HE1 HIS A 135 36.482 -0.536 -10.596 1.00 2.21 H new ATOM 0 HE2 HIS A 135 37.359 1.478 -9.310 1.00 44.34 H new TER 2127 HIS A 135