USER MOD reduce.3.24.130724 H: found=0, std=0, add=1207, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1208 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 18 HIS : no HE2:sc= -1.71! C(o=-0.42!,f=-11!) USER MOD Set 1.2: A 81 SER OG : rot -28:sc= 1.29 USER MOD Set 2.1: A 51 GLN : amide:sc= 0.735 K(o=1.6,f=-2) USER MOD Set 2.2: A 66 SER OG : rot 179:sc= 0.891 USER MOD Set 3.1: A 46 THR OG1 : rot 180:sc=-0.00446 USER MOD Set 3.2: A 72 HIS : no HE2:sc= 1.03 K(o=1,f=-5.5!) USER MOD Set 4.1: A 33 ASN :FLIP amide:sc= 0.608 F(o=0.021,f=1.3) USER MOD Set 4.2: A 39 THR OG1 : rot 122:sc= 0.65 USER MOD Set 5.1: A 35 MET CE :methyl -130:sc= -1.69! (180deg=-1.45) USER MOD Set 5.2: A 86 ASN : amide:sc= 1.11 K(o=-0.58,f=-9.2!) USER MOD Set 6.1: A 14 SER OG : rot 50:sc= 0 USER MOD Set 6.2: A 19 ASN : amide:sc= -1.53 X(o=-1.5,f=-1.9!) USER MOD Set 7.1: A 10 CYS SG : rot 159:sc= -1.7 USER MOD Set 7.2: A 77 MET CE :methyl 163:sc= -0.323 (180deg=-0.999) USER MOD Set 7.3: A 111 MET CE :methyl 145:sc= -0.719 (180deg=-0.84) USER MOD Single : A 11 SER OG : rot 180:sc=-0.00015 USER MOD Single : A 12 SER OG : rot -140:sc= 0.904 USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 TYR OH : rot 73:sc= 0.939 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 27 GLN : amide:sc= -0.326 K(o=-0.33,f=-3.9!) USER MOD Single : A 44 SER OG : rot 180:sc= -0.233 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 CYS SG : rot 146:sc= -1.52! USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 80:sc= 1.32 USER MOD Single : A 93 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= -0.184 X(o=-0.18,f=0) USER MOD Single : A 108 SER OG : rot 2:sc= 0.352 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 166:sc= -0.0557 (180deg=-0.263) USER MOD Single : A 115 THR OG1 : rot 70:sc= 1.25 USER MOD Single : A 116 TYR OH : rot 0:sc= 0 USER MOD Single : A 117 MET CE :methyl -118:sc= -4.71! (180deg=-5.45!) USER MOD Single : A 120 ASN : amide:sc= -0.308 X(o=-0.31,f=-0.74) USER MOD Single : A 121 LYS NZ :NH3+ -136:sc= 0.895 (180deg=-0.36) USER MOD Single : A 126 MET CE :methyl -119:sc= -0.675 (180deg=-3.3!) USER MOD Single : A 131 ASN : amide:sc= 0.181 K(o=0.18,f=-6.6!) USER MOD Single : A 136 LYS NZ :NH3+ -169:sc= 1.21 (180deg=0.688) USER MOD Single : A 139 HIS :FLIP no HD1:sc= -0.151 F(o=-0.69,f=-0.15) USER MOD Single : A 140 LYS NZ :NH3+ -143:sc= -1.39 (180deg=-3.52!) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 167:sc= 1.26 (180deg=1.07) USER MOD Single : A 149 LYS NZ :NH3+ -144:sc= 1.26 (180deg=0.0688) USER MOD Single : A 151 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 153 CYS SG : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 167:sc= -0.0251 (180deg=-0.25) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 158 GLN :FLIP amide:sc= -0.645 F(o=-3.9!,f=-0.64) USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 10 -11.810 -16.060 -10.199 1.00 21.33 N ATOM 2 CA CYS A 10 -13.240 -15.839 -10.150 1.00 1.12 C ATOM 3 C CYS A 10 -14.004 -17.153 -10.267 1.00 40.45 C ATOM 4 O CYS A 10 -13.795 -17.935 -11.199 1.00 13.51 O ATOM 5 CB CYS A 10 -13.666 -14.900 -11.263 1.00 64.20 C ATOM 6 SG CYS A 10 -12.839 -13.314 -11.214 1.00 55.34 S ATOM 0 HA CYS A 10 -13.475 -15.387 -9.186 1.00 1.12 H new ATOM 0 HB2 CYS A 10 -13.468 -15.375 -12.224 1.00 64.20 H new ATOM 0 HB3 CYS A 10 -14.743 -14.742 -11.202 1.00 64.20 H new ATOM 0 HG CYS A 10 -12.906 -12.753 -12.385 1.00 55.34 H new ATOM 12 N SER A 11 -14.834 -17.413 -9.298 1.00 52.23 N ATOM 13 CA SER A 11 -15.709 -18.567 -9.289 1.00 52.01 C ATOM 14 C SER A 11 -17.018 -18.188 -8.588 1.00 42.11 C ATOM 15 O SER A 11 -17.805 -19.040 -8.180 1.00 72.12 O ATOM 16 CB SER A 11 -15.013 -19.736 -8.587 1.00 4.23 C ATOM 17 OG SER A 11 -13.804 -20.072 -9.279 1.00 31.45 O ATOM 0 H SER A 11 -14.929 -16.822 -8.472 1.00 52.23 H new ATOM 0 HA SER A 11 -15.938 -18.881 -10.307 1.00 52.01 H new ATOM 0 HB2 SER A 11 -14.789 -19.470 -7.554 1.00 4.23 H new ATOM 0 HB3 SER A 11 -15.677 -20.600 -8.556 1.00 4.23 H new ATOM 0 HG SER A 11 -13.363 -20.819 -8.823 1.00 31.45 H new ATOM 23 N SER A 12 -17.241 -16.889 -8.497 1.00 72.00 N ATOM 24 CA SER A 12 -18.405 -16.330 -7.858 1.00 4.10 C ATOM 25 C SER A 12 -19.596 -16.273 -8.812 1.00 23.42 C ATOM 26 O SER A 12 -20.732 -16.067 -8.377 1.00 72.45 O ATOM 27 CB SER A 12 -18.048 -14.944 -7.326 1.00 23.11 C ATOM 28 OG SER A 12 -17.383 -14.176 -8.337 1.00 22.44 O ATOM 0 H SER A 12 -16.604 -16.187 -8.873 1.00 72.00 H new ATOM 0 HA SER A 12 -18.706 -16.971 -7.030 1.00 4.10 H new ATOM 0 HB2 SER A 12 -18.952 -14.427 -7.004 1.00 23.11 H new ATOM 0 HB3 SER A 12 -17.406 -15.038 -6.451 1.00 23.11 H new ATOM 0 HG SER A 12 -16.659 -13.656 -7.930 1.00 22.44 H new ATOM 34 N ASP A 13 -19.316 -16.474 -10.115 1.00 32.42 N ATOM 35 CA ASP A 13 -20.334 -16.455 -11.181 1.00 43.01 C ATOM 36 C ASP A 13 -20.938 -15.057 -11.307 1.00 11.30 C ATOM 37 O ASP A 13 -21.905 -14.710 -10.628 1.00 44.53 O ATOM 38 CB ASP A 13 -21.424 -17.538 -10.935 1.00 63.21 C ATOM 39 CG ASP A 13 -22.488 -17.656 -12.019 1.00 43.42 C ATOM 40 OD1 ASP A 13 -22.293 -18.447 -12.958 1.00 1.13 O ATOM 41 OD2 ASP A 13 -23.554 -17.007 -11.916 1.00 42.23 O ATOM 0 H ASP A 13 -18.372 -16.655 -10.458 1.00 32.42 H new ATOM 0 HA ASP A 13 -19.853 -16.699 -12.128 1.00 43.01 H new ATOM 0 HB2 ASP A 13 -20.933 -18.505 -10.826 1.00 63.21 H new ATOM 0 HB3 ASP A 13 -21.918 -17.323 -9.987 1.00 63.21 H new ATOM 46 N SER A 14 -20.330 -14.232 -12.125 1.00 22.52 N ATOM 47 CA SER A 14 -20.806 -12.892 -12.293 1.00 65.23 C ATOM 48 C SER A 14 -21.508 -12.656 -13.623 1.00 52.44 C ATOM 49 O SER A 14 -20.940 -12.115 -14.571 1.00 63.45 O ATOM 50 CB SER A 14 -19.730 -11.835 -11.964 1.00 35.20 C ATOM 51 OG SER A 14 -18.505 -12.067 -12.667 1.00 62.25 O ATOM 0 H SER A 14 -19.508 -14.469 -12.680 1.00 22.52 H new ATOM 0 HA SER A 14 -21.588 -12.760 -11.545 1.00 65.23 H new ATOM 0 HB2 SER A 14 -20.109 -10.844 -12.216 1.00 35.20 H new ATOM 0 HB3 SER A 14 -19.537 -11.839 -10.891 1.00 35.20 H new ATOM 0 HG SER A 14 -18.694 -12.197 -13.620 1.00 62.25 H new ATOM 57 N LEU A 15 -22.708 -13.170 -13.704 1.00 41.43 N ATOM 58 CA LEU A 15 -23.565 -12.979 -14.805 1.00 23.41 C ATOM 59 C LEU A 15 -24.706 -12.110 -14.403 1.00 13.25 C ATOM 60 O LEU A 15 -24.869 -10.994 -14.886 1.00 1.30 O ATOM 61 CB LEU A 15 -24.057 -14.296 -15.326 1.00 51.25 C ATOM 62 CG LEU A 15 -23.026 -15.123 -16.076 1.00 13.43 C ATOM 63 CD1 LEU A 15 -22.036 -15.833 -15.173 1.00 23.12 C ATOM 64 CD2 LEU A 15 -23.698 -16.031 -17.022 1.00 55.13 C ATOM 0 H LEU A 15 -23.113 -13.751 -12.970 1.00 41.43 H new ATOM 0 HA LEU A 15 -23.012 -12.489 -15.607 1.00 23.41 H new ATOM 0 HB2 LEU A 15 -24.430 -14.884 -14.487 1.00 51.25 H new ATOM 0 HB3 LEU A 15 -24.903 -14.113 -15.988 1.00 51.25 H new ATOM 0 HG LEU A 15 -22.409 -14.431 -16.649 1.00 13.43 H new ATOM 0 HD11 LEU A 15 -21.333 -16.402 -15.781 1.00 23.12 H new ATOM 0 HD12 LEU A 15 -21.491 -15.098 -14.581 1.00 23.12 H new ATOM 0 HD13 LEU A 15 -22.571 -16.510 -14.508 1.00 23.12 H new ATOM 0 HD21 LEU A 15 -22.951 -16.619 -17.555 1.00 55.13 H new ATOM 0 HD22 LEU A 15 -24.363 -16.699 -16.475 1.00 55.13 H new ATOM 0 HD23 LEU A 15 -24.278 -15.447 -17.737 1.00 55.13 H new ATOM 76 N GLN A 16 -25.473 -12.618 -13.492 1.00 13.44 N ATOM 77 CA GLN A 16 -26.578 -11.877 -12.893 1.00 71.51 C ATOM 78 C GLN A 16 -26.117 -11.261 -11.589 1.00 11.14 C ATOM 79 O GLN A 16 -26.786 -10.428 -10.981 1.00 54.31 O ATOM 80 CB GLN A 16 -27.836 -12.741 -12.735 1.00 12.54 C ATOM 81 CG GLN A 16 -27.628 -14.016 -11.935 1.00 70.11 C ATOM 82 CD GLN A 16 -28.885 -14.851 -11.839 1.00 74.24 C ATOM 83 OE1 GLN A 16 -29.145 -15.701 -12.691 1.00 64.20 O ATOM 84 NE2 GLN A 16 -29.663 -14.631 -10.815 1.00 34.52 N ATOM 0 H GLN A 16 -25.364 -13.565 -13.128 1.00 13.44 H new ATOM 0 HA GLN A 16 -26.872 -11.071 -13.565 1.00 71.51 H new ATOM 0 HB2 GLN A 16 -28.611 -12.146 -12.252 1.00 12.54 H new ATOM 0 HB3 GLN A 16 -28.207 -13.005 -13.725 1.00 12.54 H new ATOM 0 HG2 GLN A 16 -26.838 -14.607 -12.398 1.00 70.11 H new ATOM 0 HG3 GLN A 16 -27.288 -13.760 -10.931 1.00 70.11 H new ATOM 0 HE21 GLN A 16 -29.414 -13.918 -10.129 1.00 34.52 H new ATOM 0 HE22 GLN A 16 -30.520 -15.172 -10.700 1.00 34.52 H new ATOM 93 N LEU A 17 -24.965 -11.680 -11.200 1.00 21.52 N ATOM 94 CA LEU A 17 -24.276 -11.143 -10.063 1.00 70.35 C ATOM 95 C LEU A 17 -23.279 -10.145 -10.560 1.00 24.32 C ATOM 96 O LEU A 17 -22.820 -10.232 -11.704 1.00 1.41 O ATOM 97 CB LEU A 17 -23.593 -12.210 -9.217 1.00 62.34 C ATOM 98 CG LEU A 17 -24.509 -13.210 -8.510 1.00 62.33 C ATOM 99 CD1 LEU A 17 -23.688 -14.219 -7.730 1.00 62.53 C ATOM 100 CD2 LEU A 17 -25.460 -12.482 -7.577 1.00 53.31 C ATOM 0 H LEU A 17 -24.455 -12.427 -11.672 1.00 21.52 H new ATOM 0 HA LEU A 17 -25.008 -10.673 -9.406 1.00 70.35 H new ATOM 0 HB2 LEU A 17 -22.909 -12.767 -9.857 1.00 62.34 H new ATOM 0 HB3 LEU A 17 -22.986 -11.710 -8.462 1.00 62.34 H new ATOM 0 HG LEU A 17 -25.091 -13.740 -9.264 1.00 62.33 H new ATOM 0 HD11 LEU A 17 -24.354 -14.924 -7.233 1.00 62.53 H new ATOM 0 HD12 LEU A 17 -23.032 -14.760 -8.412 1.00 62.53 H new ATOM 0 HD13 LEU A 17 -23.087 -13.700 -6.984 1.00 62.53 H new ATOM 0 HD21 LEU A 17 -26.107 -13.205 -7.080 1.00 53.31 H new ATOM 0 HD22 LEU A 17 -24.887 -11.933 -6.829 1.00 53.31 H new ATOM 0 HD23 LEU A 17 -26.070 -11.784 -8.151 1.00 53.31 H new ATOM 112 N HIS A 18 -22.959 -9.206 -9.743 1.00 74.31 N ATOM 113 CA HIS A 18 -22.149 -8.094 -10.166 1.00 75.03 C ATOM 114 C HIS A 18 -20.892 -7.997 -9.345 1.00 53.44 C ATOM 115 O HIS A 18 -20.804 -8.583 -8.248 1.00 34.52 O ATOM 116 CB HIS A 18 -22.947 -6.795 -10.031 1.00 52.43 C ATOM 117 CG HIS A 18 -24.276 -6.817 -10.731 1.00 33.45 C ATOM 118 ND1 HIS A 18 -24.518 -6.198 -11.927 1.00 3.44 N ATOM 119 CD2 HIS A 18 -25.448 -7.378 -10.361 1.00 34.34 C ATOM 120 CE1 HIS A 18 -25.781 -6.374 -12.261 1.00 53.54 C ATOM 121 NE2 HIS A 18 -26.359 -7.089 -11.327 1.00 4.12 N ATOM 0 H HIS A 18 -23.244 -9.176 -8.764 1.00 74.31 H new ATOM 0 HA HIS A 18 -21.870 -8.252 -11.208 1.00 75.03 H new ATOM 0 HB2 HIS A 18 -23.109 -6.589 -8.973 1.00 52.43 H new ATOM 0 HB3 HIS A 18 -22.352 -5.973 -10.429 1.00 52.43 H new ATOM 0 HD1 HIS A 18 -23.829 -5.682 -12.474 1.00 3.44 H new ATOM 0 HD2 HIS A 18 -25.628 -7.951 -9.463 1.00 34.34 H new ATOM 0 HE1 HIS A 18 -26.258 -5.994 -13.152 1.00 53.54 H new ATOM 130 N ASN A 19 -19.922 -7.299 -9.877 1.00 71.33 N ATOM 131 CA ASN A 19 -18.687 -7.035 -9.187 1.00 2.43 C ATOM 132 C ASN A 19 -18.304 -5.563 -9.275 1.00 54.22 C ATOM 133 O ASN A 19 -18.334 -4.948 -10.352 1.00 52.40 O ATOM 134 CB ASN A 19 -17.545 -8.005 -9.579 1.00 3.02 C ATOM 135 CG ASN A 19 -17.269 -8.157 -11.066 1.00 5.11 C ATOM 136 OD1 ASN A 19 -17.479 -7.248 -11.867 1.00 51.31 O ATOM 137 ND2 ASN A 19 -16.800 -9.333 -11.439 1.00 52.15 N ATOM 0 H ASN A 19 -19.969 -6.894 -10.812 1.00 71.33 H new ATOM 0 HA ASN A 19 -18.861 -7.244 -8.132 1.00 2.43 H new ATOM 0 HB2 ASN A 19 -16.629 -7.668 -9.094 1.00 3.02 H new ATOM 0 HB3 ASN A 19 -17.778 -8.989 -9.172 1.00 3.02 H new ATOM 0 HD21 ASN A 19 -16.598 -9.513 -12.423 1.00 52.15 H new ATOM 0 HD22 ASN A 19 -16.639 -10.062 -10.744 1.00 52.15 H new ATOM 144 N VAL A 20 -17.985 -4.993 -8.132 1.00 72.35 N ATOM 145 CA VAL A 20 -17.721 -3.570 -8.009 1.00 43.10 C ATOM 146 C VAL A 20 -16.426 -3.345 -7.235 1.00 64.45 C ATOM 147 O VAL A 20 -16.139 -4.062 -6.288 1.00 71.32 O ATOM 148 CB VAL A 20 -18.900 -2.851 -7.252 1.00 1.22 C ATOM 149 CG1 VAL A 20 -18.660 -1.351 -7.112 1.00 54.10 C ATOM 150 CG2 VAL A 20 -20.236 -3.105 -7.939 1.00 63.25 C ATOM 0 H VAL A 20 -17.900 -5.506 -7.254 1.00 72.35 H new ATOM 0 HA VAL A 20 -17.631 -3.153 -9.012 1.00 43.10 H new ATOM 0 HB VAL A 20 -18.935 -3.280 -6.251 1.00 1.22 H new ATOM 0 HG11 VAL A 20 -19.498 -0.896 -6.584 1.00 54.10 H new ATOM 0 HG12 VAL A 20 -17.742 -1.180 -6.550 1.00 54.10 H new ATOM 0 HG13 VAL A 20 -18.569 -0.903 -8.102 1.00 54.10 H new ATOM 0 HG21 VAL A 20 -21.029 -2.595 -7.392 1.00 63.25 H new ATOM 0 HG22 VAL A 20 -20.198 -2.726 -8.960 1.00 63.25 H new ATOM 0 HG23 VAL A 20 -20.438 -4.176 -7.957 1.00 63.25 H new ATOM 160 N PHE A 21 -15.668 -2.361 -7.645 1.00 54.11 N ATOM 161 CA PHE A 21 -14.440 -1.989 -6.982 1.00 74.52 C ATOM 162 C PHE A 21 -14.764 -0.880 -5.995 1.00 25.30 C ATOM 163 O PHE A 21 -15.297 0.171 -6.379 1.00 51.14 O ATOM 164 CB PHE A 21 -13.425 -1.516 -8.044 1.00 34.45 C ATOM 165 CG PHE A 21 -12.082 -1.038 -7.540 1.00 3.51 C ATOM 166 CD1 PHE A 21 -11.122 -1.938 -7.101 1.00 50.25 C ATOM 167 CD2 PHE A 21 -11.773 0.315 -7.532 1.00 22.42 C ATOM 168 CE1 PHE A 21 -9.895 -1.499 -6.665 1.00 24.24 C ATOM 169 CE2 PHE A 21 -10.542 0.756 -7.098 1.00 44.32 C ATOM 170 CZ PHE A 21 -9.602 -0.152 -6.665 1.00 31.43 C ATOM 0 H PHE A 21 -15.887 -1.787 -8.459 1.00 54.11 H new ATOM 0 HA PHE A 21 -14.002 -2.830 -6.445 1.00 74.52 H new ATOM 0 HB2 PHE A 21 -13.254 -2.338 -8.740 1.00 34.45 H new ATOM 0 HB3 PHE A 21 -13.882 -0.706 -8.613 1.00 34.45 H new ATOM 0 HD1 PHE A 21 -11.341 -2.995 -7.102 1.00 50.25 H new ATOM 0 HD2 PHE A 21 -12.507 1.031 -7.870 1.00 22.42 H new ATOM 0 HE1 PHE A 21 -9.159 -2.211 -6.322 1.00 24.24 H new ATOM 0 HE2 PHE A 21 -10.315 1.812 -7.097 1.00 44.32 H new ATOM 0 HZ PHE A 21 -8.636 0.191 -6.326 1.00 31.43 H new ATOM 180 N VAL A 22 -14.456 -1.109 -4.745 1.00 11.44 N ATOM 181 CA VAL A 22 -14.787 -0.172 -3.701 1.00 54.15 C ATOM 182 C VAL A 22 -13.626 0.725 -3.345 1.00 12.54 C ATOM 183 O VAL A 22 -12.459 0.414 -3.637 1.00 53.41 O ATOM 184 CB VAL A 22 -15.372 -0.854 -2.446 1.00 5.52 C ATOM 185 CG1 VAL A 22 -16.700 -1.503 -2.787 1.00 42.34 C ATOM 186 CG2 VAL A 22 -14.407 -1.887 -1.877 1.00 34.23 C ATOM 0 H VAL A 22 -13.971 -1.946 -4.422 1.00 11.44 H new ATOM 0 HA VAL A 22 -15.574 0.460 -4.113 1.00 54.15 H new ATOM 0 HB VAL A 22 -15.529 -0.092 -1.683 1.00 5.52 H new ATOM 0 HG11 VAL A 22 -17.109 -1.983 -1.898 1.00 42.34 H new ATOM 0 HG12 VAL A 22 -17.396 -0.743 -3.142 1.00 42.34 H new ATOM 0 HG13 VAL A 22 -16.550 -2.250 -3.567 1.00 42.34 H new ATOM 0 HG21 VAL A 22 -14.848 -2.349 -0.994 1.00 34.23 H new ATOM 0 HG22 VAL A 22 -14.210 -2.653 -2.627 1.00 34.23 H new ATOM 0 HG23 VAL A 22 -13.472 -1.399 -1.602 1.00 34.23 H new ATOM 196 N TYR A 23 -13.935 1.826 -2.703 1.00 3.12 N ATOM 197 CA TYR A 23 -12.953 2.841 -2.453 1.00 22.40 C ATOM 198 C TYR A 23 -13.135 3.538 -1.093 1.00 53.23 C ATOM 199 O TYR A 23 -12.251 3.489 -0.246 1.00 62.34 O ATOM 200 CB TYR A 23 -12.953 3.855 -3.631 1.00 44.33 C ATOM 201 CG TYR A 23 -14.304 4.513 -3.901 1.00 5.44 C ATOM 202 CD1 TYR A 23 -15.360 3.791 -4.451 1.00 43.44 C ATOM 203 CD2 TYR A 23 -14.520 5.840 -3.587 1.00 75.20 C ATOM 204 CE1 TYR A 23 -16.577 4.372 -4.667 1.00 24.34 C ATOM 205 CE2 TYR A 23 -15.740 6.429 -3.809 1.00 23.13 C ATOM 206 CZ TYR A 23 -16.766 5.693 -4.346 1.00 52.13 C ATOM 207 OH TYR A 23 -17.984 6.273 -4.544 1.00 33.21 O ATOM 0 H TYR A 23 -14.866 2.038 -2.344 1.00 3.12 H new ATOM 0 HA TYR A 23 -11.978 2.358 -2.394 1.00 22.40 H new ATOM 0 HB2 TYR A 23 -12.219 4.634 -3.423 1.00 44.33 H new ATOM 0 HB3 TYR A 23 -12.626 3.342 -4.535 1.00 44.33 H new ATOM 0 HD1 TYR A 23 -15.214 2.753 -4.711 1.00 43.44 H new ATOM 0 HD2 TYR A 23 -13.717 6.423 -3.160 1.00 75.20 H new ATOM 0 HE1 TYR A 23 -17.387 3.795 -5.088 1.00 24.34 H new ATOM 0 HE2 TYR A 23 -15.892 7.469 -3.562 1.00 23.13 H new ATOM 0 HH TYR A 23 -18.615 5.948 -3.868 1.00 33.21 H new ATOM 217 N GLY A 24 -14.270 4.165 -0.888 1.00 54.43 N ATOM 218 CA GLY A 24 -14.469 4.908 0.324 1.00 42.10 C ATOM 219 C GLY A 24 -15.296 4.179 1.343 1.00 41.43 C ATOM 220 O GLY A 24 -14.817 3.257 2.000 1.00 34.44 O ATOM 0 H GLY A 24 -15.057 4.173 -1.537 1.00 54.43 H new ATOM 0 HA2 GLY A 24 -13.498 5.146 0.758 1.00 42.10 H new ATOM 0 HA3 GLY A 24 -14.953 5.855 0.085 1.00 42.10 H new ATOM 224 N SER A 25 -16.547 4.563 1.425 1.00 14.14 N ATOM 225 CA SER A 25 -17.475 4.081 2.429 1.00 42.15 C ATOM 226 C SER A 25 -17.662 2.550 2.379 1.00 60.21 C ATOM 227 O SER A 25 -17.756 1.896 3.415 1.00 33.45 O ATOM 228 CB SER A 25 -18.821 4.817 2.247 1.00 50.32 C ATOM 229 OG SER A 25 -19.802 4.425 3.196 1.00 14.11 O ATOM 0 H SER A 25 -16.962 5.236 0.781 1.00 14.14 H new ATOM 0 HA SER A 25 -17.063 4.295 3.415 1.00 42.15 H new ATOM 0 HB2 SER A 25 -18.655 5.891 2.327 1.00 50.32 H new ATOM 0 HB3 SER A 25 -19.199 4.627 1.243 1.00 50.32 H new ATOM 0 HG SER A 25 -20.631 4.923 3.035 1.00 14.11 H new ATOM 235 N PHE A 26 -17.658 1.985 1.190 1.00 42.32 N ATOM 236 CA PHE A 26 -17.900 0.551 1.039 1.00 34.22 C ATOM 237 C PHE A 26 -16.628 -0.287 1.042 1.00 55.55 C ATOM 238 O PHE A 26 -16.663 -1.444 0.658 1.00 62.50 O ATOM 239 CB PHE A 26 -18.711 0.254 -0.228 1.00 72.12 C ATOM 240 CG PHE A 26 -20.107 0.792 -0.220 1.00 73.12 C ATOM 241 CD1 PHE A 26 -20.916 0.637 0.892 1.00 34.11 C ATOM 242 CD2 PHE A 26 -20.622 1.426 -1.330 1.00 44.22 C ATOM 243 CE1 PHE A 26 -22.204 1.104 0.898 1.00 1.04 C ATOM 244 CE2 PHE A 26 -21.919 1.900 -1.328 1.00 70.23 C ATOM 245 CZ PHE A 26 -22.709 1.737 -0.211 1.00 1.31 C ATOM 0 H PHE A 26 -17.492 2.485 0.316 1.00 42.32 H new ATOM 0 HA PHE A 26 -18.475 0.262 1.919 1.00 34.22 H new ATOM 0 HB2 PHE A 26 -18.182 0.668 -1.086 1.00 72.12 H new ATOM 0 HB3 PHE A 26 -18.754 -0.826 -0.370 1.00 72.12 H new ATOM 0 HD1 PHE A 26 -20.526 0.140 1.768 1.00 34.11 H new ATOM 0 HD2 PHE A 26 -20.006 1.553 -2.208 1.00 44.22 H new ATOM 0 HE1 PHE A 26 -22.822 0.974 1.774 1.00 1.04 H new ATOM 0 HE2 PHE A 26 -22.314 2.398 -2.201 1.00 70.23 H new ATOM 0 HZ PHE A 26 -23.724 2.107 -0.208 1.00 1.31 H new ATOM 255 N GLN A 27 -15.519 0.257 1.515 1.00 1.33 N ATOM 256 CA GLN A 27 -14.286 -0.514 1.518 1.00 10.44 C ATOM 257 C GLN A 27 -14.208 -1.383 2.798 1.00 64.24 C ATOM 258 O GLN A 27 -13.195 -2.028 3.087 1.00 35.24 O ATOM 259 CB GLN A 27 -13.071 0.409 1.413 1.00 42.23 C ATOM 260 CG GLN A 27 -11.792 -0.328 1.055 1.00 54.45 C ATOM 261 CD GLN A 27 -10.555 0.543 1.034 1.00 22.50 C ATOM 262 OE1 GLN A 27 -9.627 0.304 0.252 1.00 61.20 O ATOM 263 NE2 GLN A 27 -10.500 1.525 1.893 1.00 30.34 N ATOM 0 H GLN A 27 -15.445 1.202 1.892 1.00 1.33 H new ATOM 0 HA GLN A 27 -14.282 -1.172 0.649 1.00 10.44 H new ATOM 0 HB2 GLN A 27 -13.266 1.172 0.660 1.00 42.23 H new ATOM 0 HB3 GLN A 27 -12.932 0.926 2.362 1.00 42.23 H new ATOM 0 HG2 GLN A 27 -11.640 -1.137 1.770 1.00 54.45 H new ATOM 0 HG3 GLN A 27 -11.914 -0.788 0.075 1.00 54.45 H new ATOM 0 HE21 GLN A 27 -11.283 1.695 2.524 1.00 30.34 H new ATOM 0 HE22 GLN A 27 -9.674 2.122 1.933 1.00 30.34 H new ATOM 272 N ASP A 28 -15.277 -1.392 3.546 1.00 15.42 N ATOM 273 CA ASP A 28 -15.361 -2.149 4.781 1.00 12.34 C ATOM 274 C ASP A 28 -16.491 -3.170 4.687 1.00 65.32 C ATOM 275 O ASP A 28 -17.602 -2.816 4.361 1.00 51.41 O ATOM 276 CB ASP A 28 -15.599 -1.197 5.957 1.00 3.43 C ATOM 277 CG ASP A 28 -15.791 -1.921 7.264 1.00 25.23 C ATOM 278 OD1 ASP A 28 -14.784 -2.261 7.923 1.00 73.24 O ATOM 279 OD2 ASP A 28 -16.946 -2.143 7.655 1.00 1.22 O ATOM 0 H ASP A 28 -16.125 -0.872 3.320 1.00 15.42 H new ATOM 0 HA ASP A 28 -14.423 -2.680 4.943 1.00 12.34 H new ATOM 0 HB2 ASP A 28 -14.752 -0.516 6.045 1.00 3.43 H new ATOM 0 HB3 ASP A 28 -16.479 -0.587 5.752 1.00 3.43 H new ATOM 284 N PRO A 29 -16.221 -4.455 4.964 1.00 62.23 N ATOM 285 CA PRO A 29 -17.241 -5.507 4.860 1.00 22.43 C ATOM 286 C PRO A 29 -18.335 -5.408 5.934 1.00 41.10 C ATOM 287 O PRO A 29 -19.461 -5.854 5.729 1.00 72.40 O ATOM 288 CB PRO A 29 -16.449 -6.798 5.022 1.00 54.41 C ATOM 289 CG PRO A 29 -15.216 -6.417 5.754 1.00 2.24 C ATOM 290 CD PRO A 29 -14.912 -4.991 5.378 1.00 35.11 C ATOM 0 HA PRO A 29 -17.782 -5.435 3.916 1.00 22.43 H new ATOM 0 HB2 PRO A 29 -17.021 -7.542 5.577 1.00 54.41 H new ATOM 0 HB3 PRO A 29 -16.211 -7.236 4.053 1.00 54.41 H new ATOM 0 HG2 PRO A 29 -15.360 -6.511 6.830 1.00 2.24 H new ATOM 0 HG3 PRO A 29 -14.388 -7.073 5.485 1.00 2.24 H new ATOM 0 HD2 PRO A 29 -14.499 -4.434 6.219 1.00 35.11 H new ATOM 0 HD3 PRO A 29 -14.183 -4.936 4.570 1.00 35.11 H new ATOM 298 N ASP A 30 -18.023 -4.807 7.058 1.00 72.15 N ATOM 299 CA ASP A 30 -19.002 -4.686 8.127 1.00 11.21 C ATOM 300 C ASP A 30 -20.126 -3.764 7.723 1.00 14.24 C ATOM 301 O ASP A 30 -21.299 -4.062 7.961 1.00 60.44 O ATOM 302 CB ASP A 30 -18.371 -4.235 9.437 1.00 51.54 C ATOM 303 CG ASP A 30 -19.406 -3.933 10.495 1.00 53.35 C ATOM 304 OD1 ASP A 30 -19.903 -4.877 11.134 1.00 65.14 O ATOM 305 OD2 ASP A 30 -19.739 -2.746 10.688 1.00 21.01 O ATOM 0 H ASP A 30 -17.111 -4.397 7.261 1.00 72.15 H new ATOM 0 HA ASP A 30 -19.415 -5.680 8.298 1.00 11.21 H new ATOM 0 HB2 ASP A 30 -17.698 -5.012 9.801 1.00 51.54 H new ATOM 0 HB3 ASP A 30 -17.765 -3.346 9.260 1.00 51.54 H new ATOM 310 N VAL A 31 -19.782 -2.671 7.066 1.00 62.03 N ATOM 311 CA VAL A 31 -20.793 -1.740 6.609 1.00 71.54 C ATOM 312 C VAL A 31 -21.617 -2.390 5.496 1.00 61.30 C ATOM 313 O VAL A 31 -22.793 -2.095 5.332 1.00 40.41 O ATOM 314 CB VAL A 31 -20.217 -0.350 6.153 1.00 3.12 C ATOM 315 CG1 VAL A 31 -19.368 -0.453 4.909 1.00 62.31 C ATOM 316 CG2 VAL A 31 -21.329 0.680 5.977 1.00 3.33 C ATOM 0 H VAL A 31 -18.822 -2.410 6.840 1.00 62.03 H new ATOM 0 HA VAL A 31 -21.433 -1.517 7.463 1.00 71.54 H new ATOM 0 HB VAL A 31 -19.561 -0.008 6.953 1.00 3.12 H new ATOM 0 HG11 VAL A 31 -18.996 0.536 4.639 1.00 62.31 H new ATOM 0 HG12 VAL A 31 -18.525 -1.118 5.098 1.00 62.31 H new ATOM 0 HG13 VAL A 31 -19.968 -0.851 4.091 1.00 62.31 H new ATOM 0 HG21 VAL A 31 -20.898 1.630 5.661 1.00 3.33 H new ATOM 0 HG22 VAL A 31 -22.032 0.331 5.220 1.00 3.33 H new ATOM 0 HG23 VAL A 31 -21.853 0.816 6.923 1.00 3.33 H new ATOM 326 N ILE A 32 -20.993 -3.307 4.758 1.00 23.34 N ATOM 327 CA ILE A 32 -21.653 -4.000 3.685 1.00 10.13 C ATOM 328 C ILE A 32 -22.758 -4.919 4.239 1.00 34.14 C ATOM 329 O ILE A 32 -23.898 -4.888 3.762 1.00 62.22 O ATOM 330 CB ILE A 32 -20.626 -4.789 2.835 1.00 22.53 C ATOM 331 CG1 ILE A 32 -19.593 -3.829 2.240 1.00 44.54 C ATOM 332 CG2 ILE A 32 -21.300 -5.558 1.725 1.00 0.21 C ATOM 333 CD1 ILE A 32 -20.191 -2.749 1.360 1.00 32.43 C ATOM 0 H ILE A 32 -20.020 -3.580 4.897 1.00 23.34 H new ATOM 0 HA ILE A 32 -22.128 -3.268 3.031 1.00 10.13 H new ATOM 0 HB ILE A 32 -20.130 -5.504 3.491 1.00 22.53 H new ATOM 0 HG12 ILE A 32 -19.040 -3.357 3.052 1.00 44.54 H new ATOM 0 HG13 ILE A 32 -18.873 -4.402 1.656 1.00 44.54 H new ATOM 0 HG21 ILE A 32 -20.549 -6.099 1.149 1.00 0.21 H new ATOM 0 HG22 ILE A 32 -22.010 -6.266 2.152 1.00 0.21 H new ATOM 0 HG23 ILE A 32 -21.828 -4.865 1.071 1.00 0.21 H new ATOM 0 HD11 ILE A 32 -19.395 -2.110 0.977 1.00 32.43 H new ATOM 0 HD12 ILE A 32 -20.719 -3.211 0.526 1.00 32.43 H new ATOM 0 HD13 ILE A 32 -20.889 -2.149 1.944 1.00 32.43 H new ATOM 345 N ASN A 33 -22.438 -5.693 5.276 1.00 54.13 N ATOM 346 CA ASN A 33 -23.439 -6.554 5.929 1.00 43.34 C ATOM 347 C ASN A 33 -24.626 -5.752 6.433 1.00 51.42 C ATOM 348 O ASN A 33 -25.762 -6.216 6.404 1.00 31.30 O ATOM 349 CB ASN A 33 -22.861 -7.347 7.106 1.00 12.41 C ATOM 350 CG ASN A 33 -21.939 -8.488 6.733 1.00 63.42 C ATOM 351 OD1 ASN A 33 -20.658 -8.244 6.707 1.00 15.43 O flip ATOM 352 ND2 ASN A 33 -22.393 -9.604 6.495 1.00 64.14 N flip ATOM 0 H ASN A 33 -21.504 -5.746 5.683 1.00 54.13 H new ATOM 0 HA ASN A 33 -23.762 -7.253 5.158 1.00 43.34 H new ATOM 0 HB2 ASN A 33 -22.316 -6.659 7.752 1.00 12.41 H new ATOM 0 HB3 ASN A 33 -23.688 -7.748 7.692 1.00 12.41 H new ATOM 0 HD21 ASN A 33 -23.400 -9.762 6.524 1.00 64.14 H new ATOM 0 HD22 ASN A 33 -21.763 -10.373 6.269 1.00 64.14 H new ATOM 359 N VAL A 34 -24.366 -4.558 6.888 1.00 51.21 N ATOM 360 CA VAL A 34 -25.418 -3.727 7.428 1.00 13.53 C ATOM 361 C VAL A 34 -26.204 -3.006 6.328 1.00 40.51 C ATOM 362 O VAL A 34 -27.440 -3.030 6.324 1.00 32.23 O ATOM 363 CB VAL A 34 -24.874 -2.702 8.464 1.00 62.51 C ATOM 364 CG1 VAL A 34 -25.999 -1.847 9.041 1.00 14.12 C ATOM 365 CG2 VAL A 34 -24.127 -3.417 9.579 1.00 62.00 C ATOM 0 H VAL A 34 -23.438 -4.135 6.898 1.00 51.21 H new ATOM 0 HA VAL A 34 -26.103 -4.400 7.944 1.00 13.53 H new ATOM 0 HB VAL A 34 -24.181 -2.040 7.946 1.00 62.51 H new ATOM 0 HG11 VAL A 34 -25.586 -1.141 9.762 1.00 14.12 H new ATOM 0 HG12 VAL A 34 -26.489 -1.299 8.236 1.00 14.12 H new ATOM 0 HG13 VAL A 34 -26.726 -2.489 9.538 1.00 14.12 H new ATOM 0 HG21 VAL A 34 -23.753 -2.685 10.295 1.00 62.00 H new ATOM 0 HG22 VAL A 34 -24.802 -4.107 10.085 1.00 62.00 H new ATOM 0 HG23 VAL A 34 -23.289 -3.973 9.158 1.00 62.00 H new ATOM 375 N MET A 35 -25.490 -2.395 5.385 1.00 50.14 N ATOM 376 CA MET A 35 -26.119 -1.578 4.354 1.00 53.33 C ATOM 377 C MET A 35 -27.007 -2.446 3.455 1.00 14.25 C ATOM 378 O MET A 35 -28.072 -2.020 3.039 1.00 2.15 O ATOM 379 CB MET A 35 -25.031 -0.826 3.549 1.00 30.21 C ATOM 380 CG MET A 35 -25.496 0.428 2.788 1.00 32.14 C ATOM 381 SD MET A 35 -26.643 0.142 1.429 1.00 4.43 S ATOM 382 CE MET A 35 -25.597 -0.777 0.323 1.00 14.24 C ATOM 0 H MET A 35 -24.474 -2.451 5.315 1.00 50.14 H new ATOM 0 HA MET A 35 -26.764 -0.833 4.818 1.00 53.33 H new ATOM 0 HB2 MET A 35 -24.236 -0.535 4.236 1.00 30.21 H new ATOM 0 HB3 MET A 35 -24.594 -1.520 2.831 1.00 30.21 H new ATOM 0 HG2 MET A 35 -25.967 1.107 3.499 1.00 32.14 H new ATOM 0 HG3 MET A 35 -24.617 0.938 2.395 1.00 32.14 H new ATOM 0 HE1 MET A 35 -25.647 -0.339 -0.674 1.00 14.24 H new ATOM 0 HE2 MET A 35 -24.569 -0.744 0.683 1.00 14.24 H new ATOM 0 HE3 MET A 35 -25.933 -1.813 0.281 1.00 14.24 H new ATOM 392 N LEU A 36 -26.589 -3.674 3.192 1.00 23.10 N ATOM 393 CA LEU A 36 -27.430 -4.583 2.452 1.00 34.30 C ATOM 394 C LEU A 36 -27.853 -5.775 3.286 1.00 3.24 C ATOM 395 O LEU A 36 -29.002 -5.827 3.749 1.00 71.44 O ATOM 396 CB LEU A 36 -26.890 -5.001 1.044 1.00 35.11 C ATOM 397 CG LEU A 36 -25.420 -5.442 0.918 1.00 45.31 C ATOM 398 CD1 LEU A 36 -25.224 -6.248 -0.353 1.00 64.13 C ATOM 399 CD2 LEU A 36 -24.534 -4.213 0.833 1.00 42.42 C ATOM 0 H LEU A 36 -25.686 -4.054 3.477 1.00 23.10 H new ATOM 0 HA LEU A 36 -28.323 -4.000 2.227 1.00 34.30 H new ATOM 0 HB2 LEU A 36 -27.513 -5.818 0.680 1.00 35.11 H new ATOM 0 HB3 LEU A 36 -27.042 -4.159 0.368 1.00 35.11 H new ATOM 0 HG LEU A 36 -25.161 -6.047 1.787 1.00 45.31 H new ATOM 0 HD11 LEU A 36 -24.181 -6.555 -0.432 1.00 64.13 H new ATOM 0 HD12 LEU A 36 -25.861 -7.132 -0.325 1.00 64.13 H new ATOM 0 HD13 LEU A 36 -25.489 -5.637 -1.216 1.00 64.13 H new ATOM 0 HD21 LEU A 36 -23.492 -4.521 0.744 1.00 42.42 H new ATOM 0 HD22 LEU A 36 -24.814 -3.622 -0.039 1.00 42.42 H new ATOM 0 HD23 LEU A 36 -24.659 -3.612 1.734 1.00 42.42 H new ATOM 411 N ASP A 37 -26.927 -6.693 3.547 1.00 64.12 N ATOM 412 CA ASP A 37 -27.256 -7.933 4.273 1.00 41.31 C ATOM 413 C ASP A 37 -26.021 -8.792 4.409 1.00 24.24 C ATOM 414 O ASP A 37 -25.668 -9.243 5.501 1.00 31.33 O ATOM 415 CB ASP A 37 -28.331 -8.735 3.520 1.00 43.00 C ATOM 416 CG ASP A 37 -28.847 -9.932 4.296 1.00 1.20 C ATOM 417 OD1 ASP A 37 -29.836 -9.779 5.045 1.00 72.12 O ATOM 418 OD2 ASP A 37 -28.312 -11.042 4.138 1.00 4.23 O ATOM 0 H ASP A 37 -25.948 -6.611 3.273 1.00 64.12 H new ATOM 0 HA ASP A 37 -27.634 -7.658 5.258 1.00 41.31 H new ATOM 0 HB2 ASP A 37 -29.167 -8.076 3.286 1.00 43.00 H new ATOM 0 HB3 ASP A 37 -27.919 -9.077 2.571 1.00 43.00 H new ATOM 423 N ARG A 38 -25.348 -8.985 3.299 1.00 11.45 N ATOM 424 CA ARG A 38 -24.178 -9.843 3.234 1.00 43.54 C ATOM 425 C ARG A 38 -23.057 -9.095 2.591 1.00 11.30 C ATOM 426 O ARG A 38 -23.262 -7.993 2.091 1.00 71.43 O ATOM 427 CB ARG A 38 -24.456 -11.081 2.380 1.00 11.43 C ATOM 428 CG ARG A 38 -25.567 -11.971 2.864 1.00 71.54 C ATOM 429 CD ARG A 38 -25.757 -13.116 1.904 1.00 20.13 C ATOM 430 NE ARG A 38 -26.836 -14.010 2.295 1.00 24.11 N ATOM 431 CZ ARG A 38 -27.263 -15.032 1.551 1.00 13.21 C ATOM 432 NH1 ARG A 38 -26.687 -15.289 0.380 1.00 11.14 N ATOM 433 NH2 ARG A 38 -28.255 -15.792 1.984 1.00 40.22 N ATOM 0 H ARG A 38 -25.594 -8.551 2.409 1.00 11.45 H new ATOM 0 HA ARG A 38 -23.924 -10.147 4.249 1.00 43.54 H new ATOM 0 HB2 ARG A 38 -24.691 -10.755 1.367 1.00 11.43 H new ATOM 0 HB3 ARG A 38 -23.542 -11.672 2.321 1.00 11.43 H new ATOM 0 HG2 ARG A 38 -25.333 -12.352 3.858 1.00 71.54 H new ATOM 0 HG3 ARG A 38 -26.491 -11.400 2.951 1.00 71.54 H new ATOM 0 HD2 ARG A 38 -25.963 -12.719 0.910 1.00 20.13 H new ATOM 0 HD3 ARG A 38 -24.829 -13.683 1.835 1.00 20.13 H new ATOM 0 HE ARG A 38 -27.294 -13.846 3.192 1.00 24.11 H new ATOM 0 HH11 ARG A 38 -25.919 -14.705 0.050 1.00 11.14 H new ATOM 0 HH12 ARG A 38 -27.014 -16.070 -0.188 1.00 11.14 H new ATOM 0 HH21 ARG A 38 -28.692 -15.596 2.885 1.00 40.22 H new ATOM 0 HH22 ARG A 38 -28.583 -16.574 1.417 1.00 40.22 H new ATOM 447 N THR A 39 -21.888 -9.687 2.586 1.00 1.33 N ATOM 448 CA THR A 39 -20.753 -9.096 1.942 1.00 41.23 C ATOM 449 C THR A 39 -20.212 -10.030 0.853 1.00 70.14 C ATOM 450 O THR A 39 -19.703 -11.127 1.153 1.00 73.14 O ATOM 451 CB THR A 39 -19.652 -8.769 2.960 1.00 24.35 C ATOM 452 OG1 THR A 39 -20.222 -7.974 3.983 1.00 21.34 O ATOM 453 CG2 THR A 39 -18.530 -7.966 2.322 1.00 75.34 C ATOM 0 H THR A 39 -21.702 -10.588 3.027 1.00 1.33 H new ATOM 0 HA THR A 39 -21.074 -8.163 1.478 1.00 41.23 H new ATOM 0 HB THR A 39 -19.245 -9.704 3.344 1.00 24.35 H new ATOM 0 HG1 THR A 39 -20.108 -8.422 4.847 1.00 21.34 H new ATOM 0 HG21 THR A 39 -17.766 -7.751 3.069 1.00 75.34 H new ATOM 0 HG22 THR A 39 -18.089 -8.541 1.508 1.00 75.34 H new ATOM 0 HG23 THR A 39 -18.929 -7.030 1.931 1.00 75.34 H new ATOM 461 N PRO A 40 -20.361 -9.617 -0.423 1.00 71.31 N ATOM 462 CA PRO A 40 -19.834 -10.342 -1.600 1.00 4.23 C ATOM 463 C PRO A 40 -18.340 -10.651 -1.449 1.00 5.04 C ATOM 464 O PRO A 40 -17.635 -9.941 -0.720 1.00 73.52 O ATOM 465 CB PRO A 40 -20.050 -9.352 -2.740 1.00 55.04 C ATOM 466 CG PRO A 40 -21.214 -8.545 -2.309 1.00 61.51 C ATOM 467 CD PRO A 40 -21.079 -8.391 -0.829 1.00 53.42 C ATOM 0 HA PRO A 40 -20.323 -11.304 -1.751 1.00 4.23 H new ATOM 0 HB2 PRO A 40 -19.170 -8.728 -2.897 1.00 55.04 H new ATOM 0 HB3 PRO A 40 -20.249 -9.866 -3.681 1.00 55.04 H new ATOM 0 HG2 PRO A 40 -21.221 -7.574 -2.804 1.00 61.51 H new ATOM 0 HG3 PRO A 40 -22.150 -9.041 -2.567 1.00 61.51 H new ATOM 0 HD2 PRO A 40 -20.520 -7.492 -0.568 1.00 53.42 H new ATOM 0 HD3 PRO A 40 -22.051 -8.315 -0.342 1.00 53.42 H new ATOM 475 N GLU A 41 -17.876 -11.722 -2.098 1.00 23.23 N ATOM 476 CA GLU A 41 -16.477 -12.136 -2.016 1.00 53.11 C ATOM 477 C GLU A 41 -15.584 -10.981 -2.440 1.00 41.31 C ATOM 478 O GLU A 41 -15.764 -10.397 -3.514 1.00 10.41 O ATOM 479 CB GLU A 41 -16.202 -13.370 -2.891 1.00 14.40 C ATOM 480 CG GLU A 41 -14.774 -13.901 -2.767 1.00 14.13 C ATOM 481 CD GLU A 41 -14.513 -15.115 -3.625 1.00 54.24 C ATOM 482 OE1 GLU A 41 -14.984 -16.219 -3.271 1.00 34.40 O ATOM 483 OE2 GLU A 41 -13.803 -14.997 -4.654 1.00 62.32 O ATOM 0 H GLU A 41 -18.454 -12.320 -2.689 1.00 23.23 H new ATOM 0 HA GLU A 41 -16.259 -12.410 -0.984 1.00 53.11 H new ATOM 0 HB2 GLU A 41 -16.900 -14.161 -2.618 1.00 14.40 H new ATOM 0 HB3 GLU A 41 -16.398 -13.117 -3.933 1.00 14.40 H new ATOM 0 HG2 GLU A 41 -14.075 -13.112 -3.044 1.00 14.13 H new ATOM 0 HG3 GLU A 41 -14.576 -14.152 -1.725 1.00 14.13 H new ATOM 490 N ILE A 42 -14.665 -10.643 -1.591 1.00 3.34 N ATOM 491 CA ILE A 42 -13.833 -9.504 -1.803 1.00 53.51 C ATOM 492 C ILE A 42 -12.475 -9.951 -2.299 1.00 54.15 C ATOM 493 O ILE A 42 -11.903 -10.932 -1.799 1.00 52.10 O ATOM 494 CB ILE A 42 -13.631 -8.724 -0.481 1.00 2.42 C ATOM 495 CG1 ILE A 42 -14.966 -8.454 0.200 1.00 63.22 C ATOM 496 CG2 ILE A 42 -12.940 -7.416 -0.767 1.00 74.40 C ATOM 497 CD1 ILE A 42 -14.854 -7.725 1.529 1.00 50.23 C ATOM 0 H ILE A 42 -14.471 -11.152 -0.729 1.00 3.34 H new ATOM 0 HA ILE A 42 -14.317 -8.861 -2.538 1.00 53.51 H new ATOM 0 HB ILE A 42 -13.018 -9.330 0.186 1.00 2.42 H new ATOM 0 HG12 ILE A 42 -15.591 -7.866 -0.472 1.00 63.22 H new ATOM 0 HG13 ILE A 42 -15.477 -9.403 0.362 1.00 63.22 H new ATOM 0 HG21 ILE A 42 -12.798 -6.868 0.165 1.00 74.40 H new ATOM 0 HG22 ILE A 42 -11.970 -7.609 -1.225 1.00 74.40 H new ATOM 0 HG23 ILE A 42 -13.551 -6.823 -1.448 1.00 74.40 H new ATOM 0 HD11 ILE A 42 -15.850 -7.573 1.946 1.00 50.23 H new ATOM 0 HD12 ILE A 42 -14.258 -8.320 2.221 1.00 50.23 H new ATOM 0 HD13 ILE A 42 -14.374 -6.759 1.375 1.00 50.23 H new ATOM 509 N VAL A 43 -11.975 -9.253 -3.261 1.00 52.10 N ATOM 510 CA VAL A 43 -10.668 -9.511 -3.791 1.00 5.42 C ATOM 511 C VAL A 43 -9.864 -8.220 -3.855 1.00 5.02 C ATOM 512 O VAL A 43 -10.423 -7.156 -4.097 1.00 70.14 O ATOM 513 CB VAL A 43 -10.733 -10.176 -5.198 1.00 71.43 C ATOM 514 CG1 VAL A 43 -11.500 -9.325 -6.187 1.00 71.23 C ATOM 515 CG2 VAL A 43 -9.348 -10.440 -5.714 1.00 2.35 C ATOM 0 H VAL A 43 -12.462 -8.478 -3.710 1.00 52.10 H new ATOM 0 HA VAL A 43 -10.172 -10.212 -3.120 1.00 5.42 H new ATOM 0 HB VAL A 43 -11.265 -11.121 -5.089 1.00 71.43 H new ATOM 0 HG11 VAL A 43 -11.522 -9.824 -7.156 1.00 71.23 H new ATOM 0 HG12 VAL A 43 -12.520 -9.181 -5.829 1.00 71.23 H new ATOM 0 HG13 VAL A 43 -11.011 -8.356 -6.289 1.00 71.23 H new ATOM 0 HG21 VAL A 43 -9.409 -10.905 -6.698 1.00 2.35 H new ATOM 0 HG22 VAL A 43 -8.803 -9.499 -5.790 1.00 2.35 H new ATOM 0 HG23 VAL A 43 -8.826 -11.108 -5.029 1.00 2.35 H new ATOM 525 N SER A 44 -8.584 -8.304 -3.597 1.00 50.14 N ATOM 526 CA SER A 44 -7.720 -7.167 -3.733 1.00 52.22 C ATOM 527 C SER A 44 -7.441 -6.961 -5.224 1.00 42.22 C ATOM 528 O SER A 44 -7.014 -7.902 -5.925 1.00 21.25 O ATOM 529 CB SER A 44 -6.420 -7.413 -2.979 1.00 63.03 C ATOM 530 OG SER A 44 -6.664 -7.676 -1.597 1.00 71.21 O ATOM 0 H SER A 44 -8.117 -9.157 -3.289 1.00 50.14 H new ATOM 0 HA SER A 44 -8.191 -6.277 -3.316 1.00 52.22 H new ATOM 0 HB2 SER A 44 -5.893 -8.257 -3.424 1.00 63.03 H new ATOM 0 HB3 SER A 44 -5.770 -6.543 -3.077 1.00 63.03 H new ATOM 0 HG SER A 44 -5.812 -7.832 -1.138 1.00 71.21 H new ATOM 536 N ALA A 45 -7.699 -5.776 -5.705 1.00 71.31 N ATOM 537 CA ALA A 45 -7.511 -5.467 -7.088 1.00 3.34 C ATOM 538 C ALA A 45 -6.885 -4.107 -7.259 1.00 24.05 C ATOM 539 O ALA A 45 -6.983 -3.241 -6.388 1.00 71.32 O ATOM 540 CB ALA A 45 -8.820 -5.545 -7.832 1.00 73.40 C ATOM 0 H ALA A 45 -8.046 -4.998 -5.144 1.00 71.31 H new ATOM 0 HA ALA A 45 -6.830 -6.207 -7.508 1.00 3.34 H new ATOM 0 HB1 ALA A 45 -8.656 -5.307 -8.883 1.00 73.40 H new ATOM 0 HB2 ALA A 45 -9.227 -6.553 -7.748 1.00 73.40 H new ATOM 0 HB3 ALA A 45 -9.525 -4.832 -7.404 1.00 73.40 H new ATOM 546 N THR A 46 -6.258 -3.928 -8.368 1.00 21.13 N ATOM 547 CA THR A 46 -5.590 -2.707 -8.683 1.00 0.02 C ATOM 548 C THR A 46 -6.264 -2.032 -9.860 1.00 33.51 C ATOM 549 O THR A 46 -6.447 -2.638 -10.901 1.00 13.01 O ATOM 550 CB THR A 46 -4.113 -2.975 -9.029 1.00 43.31 C ATOM 551 OG1 THR A 46 -3.497 -3.650 -7.935 1.00 5.45 O ATOM 552 CG2 THR A 46 -3.371 -1.671 -9.296 1.00 75.34 C ATOM 0 H THR A 46 -6.192 -4.637 -9.098 1.00 21.13 H new ATOM 0 HA THR A 46 -5.641 -2.055 -7.811 1.00 0.02 H new ATOM 0 HB THR A 46 -4.069 -3.588 -9.929 1.00 43.31 H new ATOM 0 HG1 THR A 46 -2.557 -3.826 -8.147 1.00 5.45 H new ATOM 0 HG21 THR A 46 -2.330 -1.887 -9.538 1.00 75.34 H new ATOM 0 HG22 THR A 46 -3.838 -1.152 -10.133 1.00 75.34 H new ATOM 0 HG23 THR A 46 -3.413 -1.040 -8.408 1.00 75.34 H new ATOM 560 N LEU A 47 -6.643 -0.809 -9.673 1.00 42.13 N ATOM 561 CA LEU A 47 -7.235 -0.013 -10.703 1.00 32.00 C ATOM 562 C LEU A 47 -6.194 0.962 -11.263 1.00 43.24 C ATOM 563 O LEU A 47 -5.888 1.972 -10.634 1.00 14.32 O ATOM 564 CB LEU A 47 -8.447 0.743 -10.142 1.00 60.44 C ATOM 565 CG LEU A 47 -9.135 1.718 -11.081 1.00 24.31 C ATOM 566 CD1 LEU A 47 -9.530 1.038 -12.374 1.00 24.22 C ATOM 567 CD2 LEU A 47 -10.353 2.331 -10.409 1.00 73.13 C ATOM 0 H LEU A 47 -6.548 -0.324 -8.781 1.00 42.13 H new ATOM 0 HA LEU A 47 -7.577 -0.657 -11.513 1.00 32.00 H new ATOM 0 HB2 LEU A 47 -9.183 0.010 -9.813 1.00 60.44 H new ATOM 0 HB3 LEU A 47 -8.126 1.292 -9.257 1.00 60.44 H new ATOM 0 HG LEU A 47 -8.430 2.514 -11.319 1.00 24.31 H new ATOM 0 HD11 LEU A 47 -10.021 1.758 -13.029 1.00 24.22 H new ATOM 0 HD12 LEU A 47 -8.639 0.648 -12.867 1.00 24.22 H new ATOM 0 HD13 LEU A 47 -10.215 0.218 -12.159 1.00 24.22 H new ATOM 0 HD21 LEU A 47 -10.835 3.028 -11.095 1.00 73.13 H new ATOM 0 HD22 LEU A 47 -11.055 1.542 -10.140 1.00 73.13 H new ATOM 0 HD23 LEU A 47 -10.043 2.863 -9.510 1.00 73.13 H new ATOM 579 N PRO A 48 -5.596 0.648 -12.419 1.00 51.45 N ATOM 580 CA PRO A 48 -4.595 1.495 -13.032 1.00 73.33 C ATOM 581 C PRO A 48 -5.226 2.608 -13.866 1.00 24.21 C ATOM 582 O PRO A 48 -6.197 2.379 -14.610 1.00 42.42 O ATOM 583 CB PRO A 48 -3.801 0.533 -13.940 1.00 32.42 C ATOM 584 CG PRO A 48 -4.523 -0.790 -13.886 1.00 23.02 C ATOM 585 CD PRO A 48 -5.845 -0.547 -13.224 1.00 21.25 C ATOM 0 HA PRO A 48 -3.977 1.997 -12.288 1.00 73.33 H new ATOM 0 HB2 PRO A 48 -3.756 0.910 -14.962 1.00 32.42 H new ATOM 0 HB3 PRO A 48 -2.773 0.430 -13.593 1.00 32.42 H new ATOM 0 HG2 PRO A 48 -4.663 -1.193 -14.889 1.00 23.02 H new ATOM 0 HG3 PRO A 48 -3.942 -1.523 -13.327 1.00 23.02 H new ATOM 0 HD2 PRO A 48 -6.638 -0.384 -13.954 1.00 21.25 H new ATOM 0 HD3 PRO A 48 -6.149 -1.393 -12.607 1.00 21.25 H new ATOM 593 N GLY A 49 -4.693 3.803 -13.741 1.00 33.11 N ATOM 594 CA GLY A 49 -5.202 4.917 -14.504 1.00 24.20 C ATOM 595 C GLY A 49 -6.170 5.746 -13.703 1.00 2.32 C ATOM 596 O GLY A 49 -6.852 6.620 -14.242 1.00 21.22 O ATOM 0 H GLY A 49 -3.913 4.026 -13.123 1.00 33.11 H new ATOM 0 HA2 GLY A 49 -4.372 5.543 -14.832 1.00 24.20 H new ATOM 0 HA3 GLY A 49 -5.696 4.547 -15.402 1.00 24.20 H new ATOM 600 N PHE A 50 -6.224 5.482 -12.418 1.00 54.11 N ATOM 601 CA PHE A 50 -7.084 6.188 -11.502 1.00 50.03 C ATOM 602 C PHE A 50 -6.359 6.386 -10.217 1.00 61.12 C ATOM 603 O PHE A 50 -5.401 5.687 -9.937 1.00 50.13 O ATOM 604 CB PHE A 50 -8.414 5.453 -11.252 1.00 1.02 C ATOM 605 CG PHE A 50 -9.363 5.444 -12.426 1.00 10.14 C ATOM 606 CD1 PHE A 50 -9.312 4.450 -13.386 1.00 73.20 C ATOM 607 CD2 PHE A 50 -10.309 6.443 -12.561 1.00 1.54 C ATOM 608 CE1 PHE A 50 -10.184 4.457 -14.456 1.00 54.41 C ATOM 609 CE2 PHE A 50 -11.181 6.458 -13.626 1.00 61.02 C ATOM 610 CZ PHE A 50 -11.120 5.465 -14.577 1.00 50.12 C ATOM 0 H PHE A 50 -5.660 4.757 -11.974 1.00 54.11 H new ATOM 0 HA PHE A 50 -7.337 7.148 -11.951 1.00 50.03 H new ATOM 0 HB2 PHE A 50 -8.196 4.423 -10.971 1.00 1.02 H new ATOM 0 HB3 PHE A 50 -8.915 5.916 -10.402 1.00 1.02 H new ATOM 0 HD1 PHE A 50 -8.582 3.659 -13.298 1.00 73.20 H new ATOM 0 HD2 PHE A 50 -10.365 7.225 -11.818 1.00 1.54 H new ATOM 0 HE1 PHE A 50 -10.134 3.674 -15.198 1.00 54.41 H new ATOM 0 HE2 PHE A 50 -11.912 7.248 -13.715 1.00 61.02 H new ATOM 0 HZ PHE A 50 -11.802 5.474 -15.415 1.00 50.12 H new ATOM 620 N GLN A 51 -6.797 7.320 -9.450 1.00 12.13 N ATOM 621 CA GLN A 51 -6.180 7.628 -8.207 1.00 13.21 C ATOM 622 C GLN A 51 -7.231 7.927 -7.179 1.00 13.31 C ATOM 623 O GLN A 51 -8.270 8.524 -7.494 1.00 42.10 O ATOM 624 CB GLN A 51 -5.236 8.802 -8.388 1.00 35.01 C ATOM 625 CG GLN A 51 -4.560 9.292 -7.134 1.00 1.10 C ATOM 626 CD GLN A 51 -3.549 10.363 -7.429 1.00 42.20 C ATOM 627 OE1 GLN A 51 -2.939 10.393 -8.510 1.00 5.22 O ATOM 628 NE2 GLN A 51 -3.349 11.236 -6.498 1.00 55.53 N ATOM 0 H GLN A 51 -7.606 7.901 -9.670 1.00 12.13 H new ATOM 0 HA GLN A 51 -5.601 6.773 -7.858 1.00 13.21 H new ATOM 0 HB2 GLN A 51 -4.467 8.520 -9.107 1.00 35.01 H new ATOM 0 HB3 GLN A 51 -5.794 9.630 -8.826 1.00 35.01 H new ATOM 0 HG2 GLN A 51 -5.310 9.680 -6.444 1.00 1.10 H new ATOM 0 HG3 GLN A 51 -4.070 8.456 -6.635 1.00 1.10 H new ATOM 0 HE21 GLN A 51 -3.870 11.177 -5.623 1.00 55.53 H new ATOM 0 HE22 GLN A 51 -2.670 11.984 -6.638 1.00 55.53 H new ATOM 637 N ARG A 52 -6.988 7.481 -5.977 1.00 74.33 N ATOM 638 CA ARG A 52 -7.882 7.715 -4.898 1.00 34.42 C ATOM 639 C ARG A 52 -7.313 8.811 -4.048 1.00 13.04 C ATOM 640 O ARG A 52 -6.116 8.842 -3.793 1.00 51.32 O ATOM 641 CB ARG A 52 -8.067 6.455 -4.040 1.00 71.23 C ATOM 642 CG ARG A 52 -9.107 6.618 -2.930 1.00 14.44 C ATOM 643 CD ARG A 52 -9.181 5.402 -2.027 1.00 43.33 C ATOM 644 NE ARG A 52 -9.507 4.162 -2.750 1.00 0.14 N ATOM 645 CZ ARG A 52 -9.546 2.943 -2.173 1.00 44.22 C ATOM 646 NH1 ARG A 52 -9.305 2.819 -0.876 1.00 52.01 N ATOM 647 NH2 ARG A 52 -9.840 1.860 -2.898 1.00 62.00 N ATOM 0 H ARG A 52 -6.158 6.944 -5.727 1.00 74.33 H new ATOM 0 HA ARG A 52 -8.856 7.994 -5.300 1.00 34.42 H new ATOM 0 HB2 ARG A 52 -8.362 5.627 -4.684 1.00 71.23 H new ATOM 0 HB3 ARG A 52 -7.110 6.186 -3.593 1.00 71.23 H new ATOM 0 HG2 ARG A 52 -8.863 7.497 -2.333 1.00 14.44 H new ATOM 0 HG3 ARG A 52 -10.086 6.797 -3.376 1.00 14.44 H new ATOM 0 HD2 ARG A 52 -8.226 5.277 -1.517 1.00 43.33 H new ATOM 0 HD3 ARG A 52 -9.933 5.574 -1.257 1.00 43.33 H new ATOM 0 HE ARG A 52 -9.716 4.228 -3.746 1.00 0.14 H new ATOM 0 HH11 ARG A 52 -9.091 3.644 -0.316 1.00 52.01 H new ATOM 0 HH12 ARG A 52 -9.334 1.898 -0.438 1.00 52.01 H new ATOM 0 HH21 ARG A 52 -10.037 1.951 -3.895 1.00 62.00 H new ATOM 0 HH22 ARG A 52 -9.868 0.942 -2.455 1.00 62.00 H new ATOM 661 N PHE A 53 -8.147 9.689 -3.639 1.00 32.33 N ATOM 662 CA PHE A 53 -7.766 10.749 -2.759 1.00 51.04 C ATOM 663 C PHE A 53 -8.378 10.462 -1.412 1.00 41.11 C ATOM 664 O PHE A 53 -9.231 9.582 -1.312 1.00 53.42 O ATOM 665 CB PHE A 53 -8.205 12.096 -3.324 1.00 22.13 C ATOM 666 CG PHE A 53 -7.384 12.556 -4.516 1.00 62.33 C ATOM 667 CD1 PHE A 53 -7.354 11.837 -5.702 1.00 72.50 C ATOM 668 CD2 PHE A 53 -6.630 13.710 -4.433 1.00 72.21 C ATOM 669 CE1 PHE A 53 -6.597 12.267 -6.763 1.00 63.43 C ATOM 670 CE2 PHE A 53 -5.873 14.145 -5.494 1.00 3.31 C ATOM 671 CZ PHE A 53 -5.857 13.423 -6.663 1.00 35.00 C ATOM 0 H PHE A 53 -9.132 9.701 -3.905 1.00 32.33 H new ATOM 0 HA PHE A 53 -6.682 10.804 -2.655 1.00 51.04 H new ATOM 0 HB2 PHE A 53 -9.252 12.032 -3.619 1.00 22.13 H new ATOM 0 HB3 PHE A 53 -8.140 12.848 -2.538 1.00 22.13 H new ATOM 0 HD1 PHE A 53 -7.932 10.929 -5.791 1.00 72.50 H new ATOM 0 HD2 PHE A 53 -6.635 14.282 -3.517 1.00 72.21 H new ATOM 0 HE1 PHE A 53 -6.582 11.696 -7.680 1.00 63.43 H new ATOM 0 HE2 PHE A 53 -5.292 15.052 -5.409 1.00 3.31 H new ATOM 0 HZ PHE A 53 -5.266 13.762 -7.501 1.00 35.00 H new ATOM 681 N ARG A 54 -7.972 11.154 -0.384 1.00 0.54 N ATOM 682 CA ARG A 54 -8.428 10.795 0.941 1.00 50.23 C ATOM 683 C ARG A 54 -8.834 12.014 1.752 1.00 11.41 C ATOM 684 O ARG A 54 -8.198 13.073 1.650 1.00 73.34 O ATOM 685 CB ARG A 54 -7.326 10.009 1.671 1.00 70.10 C ATOM 686 CG ARG A 54 -6.073 10.814 1.973 1.00 23.40 C ATOM 687 CD ARG A 54 -5.025 9.972 2.668 1.00 50.23 C ATOM 688 NE ARG A 54 -5.465 9.431 3.959 1.00 20.45 N ATOM 689 CZ ARG A 54 -4.632 8.995 4.916 1.00 10.42 C ATOM 690 NH1 ARG A 54 -3.319 9.208 4.818 1.00 73.05 N ATOM 691 NH2 ARG A 54 -5.115 8.370 5.980 1.00 53.24 N ATOM 0 H ARG A 54 -7.340 11.954 -0.428 1.00 0.54 H new ATOM 0 HA ARG A 54 -9.314 10.170 0.834 1.00 50.23 H new ATOM 0 HB2 ARG A 54 -7.731 9.625 2.608 1.00 70.10 H new ATOM 0 HB3 ARG A 54 -7.051 9.146 1.065 1.00 70.10 H new ATOM 0 HG2 ARG A 54 -5.663 11.213 1.045 1.00 23.40 H new ATOM 0 HG3 ARG A 54 -6.330 11.667 2.601 1.00 23.40 H new ATOM 0 HD2 ARG A 54 -4.743 9.146 2.015 1.00 50.23 H new ATOM 0 HD3 ARG A 54 -4.131 10.575 2.823 1.00 50.23 H new ATOM 0 HE ARG A 54 -6.468 9.383 4.140 1.00 20.45 H new ATOM 0 HH11 ARG A 54 -2.942 9.705 4.011 1.00 73.05 H new ATOM 0 HH12 ARG A 54 -2.692 8.873 5.550 1.00 73.05 H new ATOM 0 HH21 ARG A 54 -6.120 8.221 6.071 1.00 53.24 H new ATOM 0 HH22 ARG A 54 -4.482 8.038 6.708 1.00 53.24 H new ATOM 705 N LEU A 55 -9.903 11.855 2.531 1.00 21.12 N ATOM 706 CA LEU A 55 -10.423 12.873 3.438 1.00 41.13 C ATOM 707 C LEU A 55 -11.702 12.323 4.061 1.00 4.34 C ATOM 708 O LEU A 55 -12.256 11.341 3.556 1.00 54.15 O ATOM 709 CB LEU A 55 -10.750 14.190 2.685 1.00 4.41 C ATOM 710 CG LEU A 55 -11.163 15.382 3.558 1.00 70.34 C ATOM 711 CD1 LEU A 55 -10.038 15.777 4.500 1.00 62.45 C ATOM 712 CD2 LEU A 55 -11.588 16.560 2.702 1.00 0.43 C ATOM 0 H LEU A 55 -10.445 10.991 2.548 1.00 21.12 H new ATOM 0 HA LEU A 55 -9.672 13.100 4.195 1.00 41.13 H new ATOM 0 HB2 LEU A 55 -9.875 14.478 2.102 1.00 4.41 H new ATOM 0 HB3 LEU A 55 -11.553 13.989 1.976 1.00 4.41 H new ATOM 0 HG LEU A 55 -12.019 15.077 4.160 1.00 70.34 H new ATOM 0 HD11 LEU A 55 -10.354 16.624 5.109 1.00 62.45 H new ATOM 0 HD12 LEU A 55 -9.794 14.935 5.148 1.00 62.45 H new ATOM 0 HD13 LEU A 55 -9.158 16.055 3.920 1.00 62.45 H new ATOM 0 HD21 LEU A 55 -11.876 17.392 3.345 1.00 0.43 H new ATOM 0 HD22 LEU A 55 -10.758 16.865 2.064 1.00 0.43 H new ATOM 0 HD23 LEU A 55 -12.436 16.271 2.081 1.00 0.43 H new ATOM 724 N LYS A 56 -12.140 12.903 5.157 1.00 22.22 N ATOM 725 CA LYS A 56 -13.410 12.543 5.745 1.00 73.32 C ATOM 726 C LYS A 56 -13.997 13.749 6.463 1.00 62.31 C ATOM 727 O LYS A 56 -13.272 14.494 7.144 1.00 23.31 O ATOM 728 CB LYS A 56 -13.290 11.334 6.687 1.00 70.52 C ATOM 729 CG LYS A 56 -14.628 10.858 7.241 1.00 63.43 C ATOM 730 CD LYS A 56 -14.484 9.606 8.079 1.00 23.23 C ATOM 731 CE LYS A 56 -15.837 9.129 8.584 1.00 40.54 C ATOM 732 NZ LYS A 56 -15.733 7.864 9.334 1.00 32.34 N ATOM 0 H LYS A 56 -11.632 13.630 5.661 1.00 22.22 H new ATOM 0 HA LYS A 56 -14.085 12.241 4.944 1.00 73.32 H new ATOM 0 HB2 LYS A 56 -12.815 10.512 6.151 1.00 70.52 H new ATOM 0 HB3 LYS A 56 -12.634 11.595 7.518 1.00 70.52 H new ATOM 0 HG2 LYS A 56 -15.072 11.649 7.845 1.00 63.43 H new ATOM 0 HG3 LYS A 56 -15.313 10.665 6.416 1.00 63.43 H new ATOM 0 HD2 LYS A 56 -14.015 8.820 7.487 1.00 23.23 H new ATOM 0 HD3 LYS A 56 -13.825 9.804 8.925 1.00 23.23 H new ATOM 0 HE2 LYS A 56 -16.275 9.895 9.224 1.00 40.54 H new ATOM 0 HE3 LYS A 56 -16.512 8.995 7.739 1.00 40.54 H new ATOM 0 HZ1 LYS A 56 -16.677 7.575 9.660 1.00 32.34 H new ATOM 0 HZ2 LYS A 56 -15.339 7.126 8.717 1.00 32.34 H new ATOM 0 HZ3 LYS A 56 -15.109 7.998 10.155 1.00 32.34 H new ATOM 746 N GLY A 57 -15.279 13.965 6.277 1.00 35.03 N ATOM 747 CA GLY A 57 -15.948 15.079 6.901 1.00 21.42 C ATOM 748 C GLY A 57 -16.755 15.845 5.892 1.00 4.12 C ATOM 749 O GLY A 57 -17.966 15.686 5.808 1.00 73.44 O ATOM 0 H GLY A 57 -15.880 13.380 5.696 1.00 35.03 H new ATOM 0 HA2 GLY A 57 -16.599 14.719 7.698 1.00 21.42 H new ATOM 0 HA3 GLY A 57 -15.213 15.738 7.363 1.00 21.42 H new ATOM 753 N ARG A 58 -16.084 16.650 5.107 1.00 73.44 N ATOM 754 CA ARG A 58 -16.730 17.411 4.065 1.00 42.32 C ATOM 755 C ARG A 58 -16.707 16.551 2.832 1.00 22.14 C ATOM 756 O ARG A 58 -17.727 16.345 2.184 1.00 63.42 O ATOM 757 CB ARG A 58 -15.966 18.758 3.867 1.00 33.04 C ATOM 758 CG ARG A 58 -16.604 19.870 2.965 1.00 20.23 C ATOM 759 CD ARG A 58 -16.474 19.684 1.428 1.00 74.42 C ATOM 760 NE ARG A 58 -17.303 18.631 0.846 1.00 55.42 N ATOM 761 CZ ARG A 58 -17.502 18.463 -0.468 1.00 73.22 C ATOM 762 NH1 ARG A 58 -17.014 19.342 -1.330 1.00 53.30 N ATOM 763 NH2 ARG A 58 -18.204 17.426 -0.907 1.00 44.04 N ATOM 0 H ARG A 58 -15.077 16.797 5.171 1.00 73.44 H new ATOM 0 HA ARG A 58 -17.761 17.667 4.308 1.00 42.32 H new ATOM 0 HB2 ARG A 58 -15.800 19.190 4.854 1.00 33.04 H new ATOM 0 HB3 ARG A 58 -14.985 18.522 3.454 1.00 33.04 H new ATOM 0 HG2 ARG A 58 -17.664 19.940 3.210 1.00 20.23 H new ATOM 0 HG3 ARG A 58 -16.151 20.825 3.231 1.00 20.23 H new ATOM 0 HD2 ARG A 58 -16.724 20.628 0.944 1.00 74.42 H new ATOM 0 HD3 ARG A 58 -15.431 19.472 1.193 1.00 74.42 H new ATOM 0 HE ARG A 58 -17.761 17.980 1.483 1.00 55.42 H new ATOM 0 HH11 ARG A 58 -16.486 20.147 -0.993 1.00 53.30 H new ATOM 0 HH12 ARG A 58 -17.166 19.214 -2.330 1.00 53.30 H new ATOM 0 HH21 ARG A 58 -18.593 16.756 -0.244 1.00 44.04 H new ATOM 0 HH22 ARG A 58 -18.355 17.299 -1.908 1.00 44.04 H new ATOM 777 N LEU A 59 -15.551 16.027 2.530 1.00 65.41 N ATOM 778 CA LEU A 59 -15.393 15.177 1.397 1.00 64.35 C ATOM 779 C LEU A 59 -14.784 13.859 1.846 1.00 12.51 C ATOM 780 O LEU A 59 -14.285 13.770 2.965 1.00 45.02 O ATOM 781 CB LEU A 59 -14.607 15.866 0.276 1.00 44.40 C ATOM 782 CG LEU A 59 -14.515 15.106 -1.038 1.00 51.02 C ATOM 783 CD1 LEU A 59 -15.900 14.744 -1.523 1.00 31.13 C ATOM 784 CD2 LEU A 59 -13.836 15.954 -2.064 1.00 62.15 C ATOM 0 H LEU A 59 -14.697 16.181 3.066 1.00 65.41 H new ATOM 0 HA LEU A 59 -16.368 14.960 0.961 1.00 64.35 H new ATOM 0 HB2 LEU A 59 -15.065 16.835 0.081 1.00 44.40 H new ATOM 0 HB3 LEU A 59 -13.595 16.058 0.634 1.00 44.40 H new ATOM 0 HG LEU A 59 -13.939 14.194 -0.880 1.00 51.02 H new ATOM 0 HD11 LEU A 59 -15.825 14.200 -2.465 1.00 31.13 H new ATOM 0 HD12 LEU A 59 -16.393 14.117 -0.780 1.00 31.13 H new ATOM 0 HD13 LEU A 59 -16.482 15.653 -1.675 1.00 31.13 H new ATOM 0 HD21 LEU A 59 -13.772 15.406 -3.004 1.00 62.15 H new ATOM 0 HD22 LEU A 59 -14.408 16.869 -2.216 1.00 62.15 H new ATOM 0 HD23 LEU A 59 -12.832 16.206 -1.722 1.00 62.15 H new ATOM 796 N TYR A 60 -14.854 12.861 1.005 1.00 44.40 N ATOM 797 CA TYR A 60 -14.509 11.503 1.358 1.00 32.53 C ATOM 798 C TYR A 60 -13.494 10.977 0.340 1.00 51.30 C ATOM 799 O TYR A 60 -13.195 11.683 -0.622 1.00 74.51 O ATOM 800 CB TYR A 60 -15.805 10.664 1.282 1.00 34.24 C ATOM 801 CG TYR A 60 -16.953 11.225 2.102 1.00 4.20 C ATOM 802 CD1 TYR A 60 -17.773 12.228 1.582 1.00 54.34 C ATOM 803 CD2 TYR A 60 -17.221 10.757 3.378 1.00 4.53 C ATOM 804 CE1 TYR A 60 -18.821 12.742 2.315 1.00 62.11 C ATOM 805 CE2 TYR A 60 -18.269 11.270 4.117 1.00 4.33 C ATOM 806 CZ TYR A 60 -19.067 12.263 3.580 1.00 64.20 C ATOM 807 OH TYR A 60 -20.121 12.780 4.316 1.00 2.53 O ATOM 0 H TYR A 60 -15.158 12.968 0.037 1.00 44.40 H new ATOM 0 HA TYR A 60 -14.077 11.447 2.357 1.00 32.53 H new ATOM 0 HB2 TYR A 60 -16.118 10.591 0.240 1.00 34.24 H new ATOM 0 HB3 TYR A 60 -15.590 9.651 1.622 1.00 34.24 H new ATOM 0 HD1 TYR A 60 -17.583 12.608 0.589 1.00 54.34 H new ATOM 0 HD2 TYR A 60 -16.602 9.980 3.801 1.00 4.53 H new ATOM 0 HE1 TYR A 60 -19.446 13.517 1.898 1.00 62.11 H new ATOM 0 HE2 TYR A 60 -18.464 10.897 5.111 1.00 4.33 H new ATOM 0 HH TYR A 60 -20.161 12.335 5.188 1.00 2.53 H new ATOM 817 N PRO A 61 -12.919 9.751 0.537 1.00 32.30 N ATOM 818 CA PRO A 61 -12.023 9.145 -0.450 1.00 3.23 C ATOM 819 C PRO A 61 -12.731 8.972 -1.792 1.00 32.34 C ATOM 820 O PRO A 61 -13.733 8.260 -1.885 1.00 34.45 O ATOM 821 CB PRO A 61 -11.682 7.774 0.156 1.00 44.13 C ATOM 822 CG PRO A 61 -11.909 7.947 1.614 1.00 32.01 C ATOM 823 CD PRO A 61 -13.071 8.886 1.729 1.00 32.11 C ATOM 0 HA PRO A 61 -11.142 9.756 -0.646 1.00 3.23 H new ATOM 0 HB2 PRO A 61 -12.317 6.989 -0.255 1.00 44.13 H new ATOM 0 HB3 PRO A 61 -10.650 7.492 -0.055 1.00 44.13 H new ATOM 0 HG2 PRO A 61 -12.127 6.993 2.093 1.00 32.01 H new ATOM 0 HG3 PRO A 61 -11.025 8.355 2.103 1.00 32.01 H new ATOM 0 HD2 PRO A 61 -14.022 8.354 1.723 1.00 32.11 H new ATOM 0 HD3 PRO A 61 -13.034 9.462 2.653 1.00 32.11 H new ATOM 831 N CYS A 62 -12.223 9.633 -2.800 1.00 20.20 N ATOM 832 CA CYS A 62 -12.826 9.633 -4.112 1.00 14.03 C ATOM 833 C CYS A 62 -11.896 8.965 -5.136 1.00 4.24 C ATOM 834 O CYS A 62 -10.724 8.710 -4.841 1.00 45.13 O ATOM 835 CB CYS A 62 -13.096 11.078 -4.506 1.00 23.11 C ATOM 836 SG CYS A 62 -11.614 12.101 -4.531 1.00 50.53 S ATOM 0 H CYS A 62 -11.372 10.192 -2.735 1.00 20.20 H new ATOM 0 HA CYS A 62 -13.757 9.066 -4.093 1.00 14.03 H new ATOM 0 HB2 CYS A 62 -13.559 11.097 -5.493 1.00 23.11 H new ATOM 0 HB3 CYS A 62 -13.814 11.509 -3.809 1.00 23.11 H new ATOM 0 HG CYS A 62 -11.712 12.983 -5.481 1.00 50.53 H new ATOM 842 N ILE A 63 -12.419 8.684 -6.330 1.00 52.23 N ATOM 843 CA ILE A 63 -11.644 8.061 -7.410 1.00 71.24 C ATOM 844 C ILE A 63 -11.683 8.951 -8.647 1.00 63.31 C ATOM 845 O ILE A 63 -12.761 9.232 -9.172 1.00 22.14 O ATOM 846 CB ILE A 63 -12.227 6.664 -7.808 1.00 41.04 C ATOM 847 CG1 ILE A 63 -12.207 5.682 -6.632 1.00 10.21 C ATOM 848 CG2 ILE A 63 -11.485 6.072 -9.010 1.00 3.03 C ATOM 849 CD1 ILE A 63 -10.819 5.341 -6.129 1.00 55.00 C ATOM 0 H ILE A 63 -13.389 8.880 -6.578 1.00 52.23 H new ATOM 0 HA ILE A 63 -10.624 7.934 -7.047 1.00 71.24 H new ATOM 0 HB ILE A 63 -13.267 6.825 -8.091 1.00 41.04 H new ATOM 0 HG12 ILE A 63 -12.785 6.105 -5.810 1.00 10.21 H new ATOM 0 HG13 ILE A 63 -12.708 4.762 -6.933 1.00 10.21 H new ATOM 0 HG21 ILE A 63 -11.914 5.102 -9.261 1.00 3.03 H new ATOM 0 HG22 ILE A 63 -11.581 6.743 -9.864 1.00 3.03 H new ATOM 0 HG23 ILE A 63 -10.431 5.949 -8.762 1.00 3.03 H new ATOM 0 HD11 ILE A 63 -10.895 4.641 -5.297 1.00 55.00 H new ATOM 0 HD12 ILE A 63 -10.242 4.886 -6.934 1.00 55.00 H new ATOM 0 HD13 ILE A 63 -10.320 6.250 -5.794 1.00 55.00 H new ATOM 861 N VAL A 64 -10.534 9.395 -9.098 1.00 22.24 N ATOM 862 CA VAL A 64 -10.441 10.193 -10.318 1.00 43.13 C ATOM 863 C VAL A 64 -9.373 9.626 -11.245 1.00 61.33 C ATOM 864 O VAL A 64 -8.383 9.061 -10.780 1.00 5.31 O ATOM 865 CB VAL A 64 -10.157 11.709 -10.056 1.00 64.41 C ATOM 866 CG1 VAL A 64 -11.294 12.358 -9.298 1.00 23.41 C ATOM 867 CG2 VAL A 64 -8.846 11.906 -9.319 1.00 4.25 C ATOM 0 H VAL A 64 -9.639 9.221 -8.641 1.00 22.24 H new ATOM 0 HA VAL A 64 -11.422 10.132 -10.790 1.00 43.13 H new ATOM 0 HB VAL A 64 -10.075 12.195 -11.028 1.00 64.41 H new ATOM 0 HG11 VAL A 64 -11.066 13.411 -9.132 1.00 23.41 H new ATOM 0 HG12 VAL A 64 -12.213 12.273 -9.878 1.00 23.41 H new ATOM 0 HG13 VAL A 64 -11.423 11.859 -8.338 1.00 23.41 H new ATOM 0 HG21 VAL A 64 -8.678 12.970 -9.153 1.00 4.25 H new ATOM 0 HG22 VAL A 64 -8.887 11.391 -8.359 1.00 4.25 H new ATOM 0 HG23 VAL A 64 -8.029 11.499 -9.915 1.00 4.25 H new ATOM 877 N PRO A 65 -9.583 9.719 -12.565 1.00 3.10 N ATOM 878 CA PRO A 65 -8.619 9.243 -13.567 1.00 40.13 C ATOM 879 C PRO A 65 -7.267 9.971 -13.490 1.00 52.31 C ATOM 880 O PRO A 65 -7.179 11.170 -13.749 1.00 34.44 O ATOM 881 CB PRO A 65 -9.313 9.535 -14.906 1.00 72.42 C ATOM 882 CG PRO A 65 -10.350 10.553 -14.586 1.00 64.52 C ATOM 883 CD PRO A 65 -10.794 10.264 -13.192 1.00 2.42 C ATOM 0 HA PRO A 65 -8.376 8.191 -13.418 1.00 40.13 H new ATOM 0 HB2 PRO A 65 -8.605 9.911 -15.644 1.00 72.42 H new ATOM 0 HB3 PRO A 65 -9.760 8.633 -15.324 1.00 72.42 H new ATOM 0 HG2 PRO A 65 -9.944 11.562 -14.665 1.00 64.52 H new ATOM 0 HG3 PRO A 65 -11.186 10.491 -15.283 1.00 64.52 H new ATOM 0 HD2 PRO A 65 -11.141 11.164 -12.684 1.00 2.42 H new ATOM 0 HD3 PRO A 65 -11.616 9.549 -13.171 1.00 2.42 H new ATOM 891 N SER A 66 -6.251 9.249 -13.087 1.00 21.14 N ATOM 892 CA SER A 66 -4.910 9.767 -12.992 1.00 53.52 C ATOM 893 C SER A 66 -3.976 8.851 -13.786 1.00 51.42 C ATOM 894 O SER A 66 -3.821 7.677 -13.443 1.00 61.15 O ATOM 895 CB SER A 66 -4.494 9.841 -11.518 1.00 1.02 C ATOM 896 OG SER A 66 -3.205 10.415 -11.339 1.00 42.33 O ATOM 0 H SER A 66 -6.334 8.270 -12.812 1.00 21.14 H new ATOM 0 HA SER A 66 -4.856 10.773 -13.408 1.00 53.52 H new ATOM 0 HB2 SER A 66 -5.228 10.428 -10.967 1.00 1.02 H new ATOM 0 HB3 SER A 66 -4.503 8.838 -11.092 1.00 1.02 H new ATOM 0 HG SER A 66 -2.998 10.463 -10.382 1.00 42.33 H new ATOM 902 N GLU A 67 -3.367 9.378 -14.830 1.00 73.51 N ATOM 903 CA GLU A 67 -2.484 8.609 -15.715 1.00 64.32 C ATOM 904 C GLU A 67 -1.287 8.041 -14.950 1.00 31.33 C ATOM 905 O GLU A 67 -0.766 6.968 -15.275 1.00 15.53 O ATOM 906 CB GLU A 67 -1.940 9.475 -16.873 1.00 14.12 C ATOM 907 CG GLU A 67 -2.975 10.244 -17.686 1.00 34.52 C ATOM 908 CD GLU A 67 -3.527 11.461 -16.962 1.00 60.54 C ATOM 909 OE1 GLU A 67 -2.901 12.534 -17.044 1.00 33.20 O ATOM 910 OE2 GLU A 67 -4.575 11.353 -16.299 1.00 13.04 O ATOM 0 H GLU A 67 -3.465 10.357 -15.098 1.00 73.51 H new ATOM 0 HA GLU A 67 -3.090 7.797 -16.117 1.00 64.32 H new ATOM 0 HB2 GLU A 67 -1.229 10.191 -16.460 1.00 14.12 H new ATOM 0 HB3 GLU A 67 -1.384 8.828 -17.552 1.00 14.12 H new ATOM 0 HG2 GLU A 67 -2.524 10.563 -18.626 1.00 34.52 H new ATOM 0 HG3 GLU A 67 -3.798 9.576 -17.938 1.00 34.52 H new ATOM 917 N LYS A 68 -0.857 8.763 -13.953 1.00 21.22 N ATOM 918 CA LYS A 68 0.302 8.396 -13.170 1.00 51.33 C ATOM 919 C LYS A 68 -0.080 7.641 -11.905 1.00 62.51 C ATOM 920 O LYS A 68 0.775 7.341 -11.067 1.00 41.45 O ATOM 921 CB LYS A 68 1.067 9.655 -12.817 1.00 52.22 C ATOM 922 CG LYS A 68 1.584 10.386 -14.041 1.00 13.33 C ATOM 923 CD LYS A 68 2.259 11.684 -13.681 1.00 33.34 C ATOM 924 CE LYS A 68 1.278 12.683 -13.073 1.00 23.12 C ATOM 925 NZ LYS A 68 1.925 13.970 -12.770 1.00 74.43 N ATOM 0 H LYS A 68 -1.301 9.631 -13.654 1.00 21.22 H new ATOM 0 HA LYS A 68 0.924 7.727 -13.764 1.00 51.33 H new ATOM 0 HB2 LYS A 68 0.419 10.321 -12.247 1.00 52.22 H new ATOM 0 HB3 LYS A 68 1.906 9.397 -12.171 1.00 52.22 H new ATOM 0 HG2 LYS A 68 2.288 9.747 -14.574 1.00 13.33 H new ATOM 0 HG3 LYS A 68 0.756 10.585 -14.721 1.00 13.33 H new ATOM 0 HD2 LYS A 68 3.066 11.490 -12.974 1.00 33.34 H new ATOM 0 HD3 LYS A 68 2.713 12.117 -14.572 1.00 33.34 H new ATOM 0 HE2 LYS A 68 0.451 12.846 -13.764 1.00 23.12 H new ATOM 0 HE3 LYS A 68 0.854 12.266 -12.160 1.00 23.12 H new ATOM 0 HZ1 LYS A 68 1.226 14.621 -12.359 1.00 74.43 H new ATOM 0 HZ2 LYS A 68 2.699 13.818 -12.092 1.00 74.43 H new ATOM 0 HZ3 LYS A 68 2.308 14.381 -13.645 1.00 74.43 H new ATOM 939 N GLY A 69 -1.344 7.307 -11.774 1.00 11.31 N ATOM 940 CA GLY A 69 -1.783 6.663 -10.576 1.00 72.42 C ATOM 941 C GLY A 69 -2.422 5.313 -10.802 1.00 52.44 C ATOM 942 O GLY A 69 -2.724 4.915 -11.950 1.00 63.41 O ATOM 0 H GLY A 69 -2.068 7.470 -12.473 1.00 11.31 H new ATOM 0 HA2 GLY A 69 -0.931 6.543 -9.907 1.00 72.42 H new ATOM 0 HA3 GLY A 69 -2.497 7.311 -10.068 1.00 72.42 H new ATOM 946 N GLU A 70 -2.593 4.613 -9.717 1.00 70.01 N ATOM 947 CA GLU A 70 -3.253 3.346 -9.651 1.00 14.00 C ATOM 948 C GLU A 70 -3.834 3.198 -8.251 1.00 0.22 C ATOM 949 O GLU A 70 -3.238 3.661 -7.266 1.00 45.14 O ATOM 950 CB GLU A 70 -2.324 2.143 -9.993 1.00 4.30 C ATOM 951 CG GLU A 70 -1.100 1.929 -9.084 1.00 71.02 C ATOM 952 CD GLU A 70 -0.048 3.010 -9.203 1.00 21.01 C ATOM 953 OE1 GLU A 70 0.795 2.918 -10.114 1.00 2.11 O ATOM 954 OE2 GLU A 70 -0.038 3.957 -8.389 1.00 72.24 O ATOM 0 H GLU A 70 -2.257 4.930 -8.808 1.00 70.01 H new ATOM 0 HA GLU A 70 -4.037 3.327 -10.408 1.00 14.00 H new ATOM 0 HB2 GLU A 70 -2.925 1.234 -9.973 1.00 4.30 H new ATOM 0 HB3 GLU A 70 -1.969 2.268 -11.016 1.00 4.30 H new ATOM 0 HG2 GLU A 70 -1.435 1.875 -8.048 1.00 71.02 H new ATOM 0 HG3 GLU A 70 -0.646 0.967 -9.323 1.00 71.02 H new ATOM 961 N VAL A 71 -4.973 2.589 -8.154 1.00 73.02 N ATOM 962 CA VAL A 71 -5.627 2.436 -6.889 1.00 24.44 C ATOM 963 C VAL A 71 -5.651 0.991 -6.515 1.00 54.02 C ATOM 964 O VAL A 71 -6.193 0.172 -7.233 1.00 44.32 O ATOM 965 CB VAL A 71 -7.102 2.941 -6.928 1.00 30.24 C ATOM 966 CG1 VAL A 71 -7.749 2.850 -5.554 1.00 4.21 C ATOM 967 CG2 VAL A 71 -7.185 4.348 -7.453 1.00 64.30 C ATOM 0 H VAL A 71 -5.476 2.185 -8.944 1.00 73.02 H new ATOM 0 HA VAL A 71 -5.070 3.029 -6.164 1.00 24.44 H new ATOM 0 HB VAL A 71 -7.650 2.291 -7.610 1.00 30.24 H new ATOM 0 HG11 VAL A 71 -8.777 3.209 -5.611 1.00 4.21 H new ATOM 0 HG12 VAL A 71 -7.745 1.813 -5.218 1.00 4.21 H new ATOM 0 HG13 VAL A 71 -7.190 3.463 -4.847 1.00 4.21 H new ATOM 0 HG21 VAL A 71 -8.226 4.670 -7.468 1.00 64.30 H new ATOM 0 HG22 VAL A 71 -6.609 5.012 -6.808 1.00 64.30 H new ATOM 0 HG23 VAL A 71 -6.780 4.383 -8.464 1.00 64.30 H new ATOM 977 N HIS A 72 -5.054 0.671 -5.420 1.00 62.24 N ATOM 978 CA HIS A 72 -5.137 -0.667 -4.921 1.00 34.13 C ATOM 979 C HIS A 72 -6.294 -0.701 -3.962 1.00 23.14 C ATOM 980 O HIS A 72 -6.287 -0.004 -2.952 1.00 4.30 O ATOM 981 CB HIS A 72 -3.829 -1.109 -4.236 1.00 62.21 C ATOM 982 CG HIS A 72 -2.643 -1.248 -5.163 1.00 3.21 C ATOM 983 ND1 HIS A 72 -2.031 -2.450 -5.423 1.00 20.53 N ATOM 984 CD2 HIS A 72 -1.938 -0.320 -5.863 1.00 55.22 C ATOM 985 CE1 HIS A 72 -1.011 -2.264 -6.230 1.00 23.34 C ATOM 986 NE2 HIS A 72 -0.929 -0.983 -6.512 1.00 1.41 N ATOM 0 H HIS A 72 -4.503 1.312 -4.850 1.00 62.24 H new ATOM 0 HA HIS A 72 -5.290 -1.368 -5.742 1.00 34.13 H new ATOM 0 HB2 HIS A 72 -3.581 -0.387 -3.458 1.00 62.21 H new ATOM 0 HB3 HIS A 72 -4.000 -2.065 -3.741 1.00 62.21 H new ATOM 0 HD1 HIS A 72 -2.324 -3.351 -5.046 1.00 20.53 H new ATOM 0 HD2 HIS A 72 -2.136 0.741 -5.901 1.00 55.22 H new ATOM 0 HE1 HIS A 72 -0.351 -3.035 -6.600 1.00 23.34 H new ATOM 995 N GLY A 73 -7.288 -1.459 -4.290 1.00 74.10 N ATOM 996 CA GLY A 73 -8.452 -1.518 -3.482 1.00 25.00 C ATOM 997 C GLY A 73 -9.045 -2.873 -3.516 1.00 54.34 C ATOM 998 O GLY A 73 -8.359 -3.839 -3.830 1.00 35.41 O ATOM 0 H GLY A 73 -7.313 -2.050 -5.121 1.00 74.10 H new ATOM 0 HA2 GLY A 73 -8.202 -1.251 -2.455 1.00 25.00 H new ATOM 0 HA3 GLY A 73 -9.181 -0.788 -3.833 1.00 25.00 H new ATOM 1002 N LYS A 74 -10.292 -2.968 -3.208 1.00 54.12 N ATOM 1003 CA LYS A 74 -10.957 -4.236 -3.161 1.00 60.45 C ATOM 1004 C LYS A 74 -12.166 -4.267 -4.044 1.00 13.31 C ATOM 1005 O LYS A 74 -12.818 -3.253 -4.272 1.00 4.14 O ATOM 1006 CB LYS A 74 -11.337 -4.634 -1.726 1.00 0.42 C ATOM 1007 CG LYS A 74 -10.242 -5.326 -0.881 1.00 44.34 C ATOM 1008 CD LYS A 74 -8.987 -4.514 -0.746 1.00 62.14 C ATOM 1009 CE LYS A 74 -8.014 -5.150 0.235 1.00 42.53 C ATOM 1010 NZ LYS A 74 -6.749 -4.390 0.362 1.00 14.45 N ATOM 0 H LYS A 74 -10.886 -2.171 -2.980 1.00 54.12 H new ATOM 0 HA LYS A 74 -10.243 -4.968 -3.537 1.00 60.45 H new ATOM 0 HB2 LYS A 74 -11.657 -3.736 -1.198 1.00 0.42 H new ATOM 0 HB3 LYS A 74 -12.199 -5.299 -1.775 1.00 0.42 H new ATOM 0 HG2 LYS A 74 -10.639 -5.535 0.113 1.00 44.34 H new ATOM 0 HG3 LYS A 74 -9.997 -6.286 -1.335 1.00 44.34 H new ATOM 0 HD2 LYS A 74 -8.510 -4.415 -1.721 1.00 62.14 H new ATOM 0 HD3 LYS A 74 -9.238 -3.508 -0.410 1.00 62.14 H new ATOM 0 HE2 LYS A 74 -8.488 -5.224 1.214 1.00 42.53 H new ATOM 0 HE3 LYS A 74 -7.791 -6.167 -0.089 1.00 42.53 H new ATOM 0 HZ1 LYS A 74 -6.124 -4.868 1.042 1.00 14.45 H new ATOM 0 HZ2 LYS A 74 -6.279 -4.341 -0.565 1.00 14.45 H new ATOM 0 HZ3 LYS A 74 -6.955 -3.427 0.698 1.00 14.45 H new ATOM 1024 N VAL A 75 -12.429 -5.418 -4.548 1.00 22.43 N ATOM 1025 CA VAL A 75 -13.588 -5.684 -5.367 1.00 60.13 C ATOM 1026 C VAL A 75 -14.578 -6.586 -4.648 1.00 13.32 C ATOM 1027 O VAL A 75 -14.200 -7.616 -4.107 1.00 13.14 O ATOM 1028 CB VAL A 75 -13.187 -6.349 -6.712 1.00 62.32 C ATOM 1029 CG1 VAL A 75 -14.407 -6.870 -7.464 1.00 53.32 C ATOM 1030 CG2 VAL A 75 -12.402 -5.382 -7.580 1.00 71.42 C ATOM 0 H VAL A 75 -11.835 -6.235 -4.406 1.00 22.43 H new ATOM 0 HA VAL A 75 -14.059 -4.722 -5.567 1.00 60.13 H new ATOM 0 HB VAL A 75 -12.549 -7.201 -6.478 1.00 62.32 H new ATOM 0 HG11 VAL A 75 -14.089 -7.329 -8.400 1.00 53.32 H new ATOM 0 HG12 VAL A 75 -14.922 -7.612 -6.853 1.00 53.32 H new ATOM 0 HG13 VAL A 75 -15.084 -6.043 -7.677 1.00 53.32 H new ATOM 0 HG21 VAL A 75 -12.132 -5.870 -8.516 1.00 71.42 H new ATOM 0 HG22 VAL A 75 -13.013 -4.504 -7.791 1.00 71.42 H new ATOM 0 HG23 VAL A 75 -11.496 -5.076 -7.056 1.00 71.42 H new ATOM 1040 N LEU A 76 -15.829 -6.178 -4.652 1.00 45.35 N ATOM 1041 CA LEU A 76 -16.917 -6.958 -4.112 1.00 70.10 C ATOM 1042 C LEU A 76 -17.564 -7.695 -5.266 1.00 14.31 C ATOM 1043 O LEU A 76 -18.198 -7.070 -6.119 1.00 24.01 O ATOM 1044 CB LEU A 76 -17.983 -6.050 -3.469 1.00 2.44 C ATOM 1045 CG LEU A 76 -17.539 -5.114 -2.348 1.00 34.13 C ATOM 1046 CD1 LEU A 76 -18.729 -4.342 -1.809 1.00 42.20 C ATOM 1047 CD2 LEU A 76 -16.863 -5.885 -1.242 1.00 22.23 C ATOM 0 H LEU A 76 -16.121 -5.280 -5.037 1.00 45.35 H new ATOM 0 HA LEU A 76 -16.531 -7.638 -3.352 1.00 70.10 H new ATOM 0 HB2 LEU A 76 -18.425 -5.441 -4.258 1.00 2.44 H new ATOM 0 HB3 LEU A 76 -18.775 -6.689 -3.078 1.00 2.44 H new ATOM 0 HG LEU A 76 -16.818 -4.406 -2.755 1.00 34.13 H new ATOM 0 HD11 LEU A 76 -18.400 -3.678 -1.010 1.00 42.20 H new ATOM 0 HD12 LEU A 76 -19.174 -3.753 -2.611 1.00 42.20 H new ATOM 0 HD13 LEU A 76 -19.469 -5.040 -1.419 1.00 42.20 H new ATOM 0 HD21 LEU A 76 -16.555 -5.197 -0.454 1.00 22.23 H new ATOM 0 HD22 LEU A 76 -17.558 -6.618 -0.832 1.00 22.23 H new ATOM 0 HD23 LEU A 76 -15.987 -6.398 -1.639 1.00 22.23 H new ATOM 1059 N MET A 77 -17.386 -8.981 -5.332 1.00 14.43 N ATOM 1060 CA MET A 77 -17.978 -9.752 -6.408 1.00 52.00 C ATOM 1061 C MET A 77 -18.996 -10.733 -5.916 1.00 74.24 C ATOM 1062 O MET A 77 -18.802 -11.400 -4.901 1.00 14.23 O ATOM 1063 CB MET A 77 -16.938 -10.449 -7.277 1.00 13.21 C ATOM 1064 CG MET A 77 -15.984 -11.331 -6.530 1.00 2.32 C ATOM 1065 SD MET A 77 -14.858 -12.220 -7.629 1.00 62.42 S ATOM 1066 CE MET A 77 -14.150 -10.858 -8.558 1.00 34.03 C ATOM 0 H MET A 77 -16.841 -9.524 -4.663 1.00 14.43 H new ATOM 0 HA MET A 77 -18.493 -9.024 -7.035 1.00 52.00 H new ATOM 0 HB2 MET A 77 -17.454 -11.049 -8.027 1.00 13.21 H new ATOM 0 HB3 MET A 77 -16.366 -9.691 -7.813 1.00 13.21 H new ATOM 0 HG2 MET A 77 -15.404 -10.726 -5.833 1.00 2.32 H new ATOM 0 HG3 MET A 77 -16.548 -12.049 -5.935 1.00 2.32 H new ATOM 0 HE1 MET A 77 -13.238 -11.191 -9.054 1.00 34.03 H new ATOM 0 HE2 MET A 77 -14.866 -10.517 -9.306 1.00 34.03 H new ATOM 0 HE3 MET A 77 -13.915 -10.038 -7.879 1.00 34.03 H new ATOM 1076 N GLY A 78 -20.078 -10.805 -6.630 1.00 3.22 N ATOM 1077 CA GLY A 78 -21.132 -11.703 -6.285 1.00 44.13 C ATOM 1078 C GLY A 78 -22.289 -10.980 -5.649 1.00 11.42 C ATOM 1079 O GLY A 78 -23.049 -11.570 -4.890 1.00 4.12 O ATOM 0 H GLY A 78 -20.253 -10.245 -7.464 1.00 3.22 H new ATOM 0 HA2 GLY A 78 -21.475 -12.224 -7.179 1.00 44.13 H new ATOM 0 HA3 GLY A 78 -20.755 -12.462 -5.599 1.00 44.13 H new ATOM 1083 N VAL A 79 -22.422 -9.695 -5.952 1.00 31.52 N ATOM 1084 CA VAL A 79 -23.506 -8.904 -5.395 1.00 3.11 C ATOM 1085 C VAL A 79 -24.746 -8.995 -6.296 1.00 3.23 C ATOM 1086 O VAL A 79 -24.626 -9.045 -7.533 1.00 71.33 O ATOM 1087 CB VAL A 79 -23.091 -7.400 -5.167 1.00 73.13 C ATOM 1088 CG1 VAL A 79 -22.815 -6.669 -6.467 1.00 74.11 C ATOM 1089 CG2 VAL A 79 -24.112 -6.653 -4.321 1.00 14.32 C ATOM 0 H VAL A 79 -21.797 -9.184 -6.575 1.00 31.52 H new ATOM 0 HA VAL A 79 -23.745 -9.319 -4.416 1.00 3.11 H new ATOM 0 HB VAL A 79 -22.154 -7.424 -4.611 1.00 73.13 H new ATOM 0 HG11 VAL A 79 -22.534 -5.638 -6.252 1.00 74.11 H new ATOM 0 HG12 VAL A 79 -22.002 -7.164 -6.997 1.00 74.11 H new ATOM 0 HG13 VAL A 79 -23.711 -6.679 -7.087 1.00 74.11 H new ATOM 0 HG21 VAL A 79 -23.789 -5.621 -4.188 1.00 14.32 H new ATOM 0 HG22 VAL A 79 -25.080 -6.668 -4.822 1.00 14.32 H new ATOM 0 HG23 VAL A 79 -24.200 -7.135 -3.347 1.00 14.32 H new ATOM 1099 N THR A 80 -25.896 -9.043 -5.686 1.00 15.12 N ATOM 1100 CA THR A 80 -27.162 -9.120 -6.367 1.00 61.40 C ATOM 1101 C THR A 80 -27.561 -7.773 -7.025 1.00 60.51 C ATOM 1102 O THR A 80 -27.027 -6.710 -6.674 1.00 63.23 O ATOM 1103 CB THR A 80 -28.223 -9.630 -5.388 1.00 72.01 C ATOM 1104 OG1 THR A 80 -27.938 -9.090 -4.089 1.00 12.41 O ATOM 1105 CG2 THR A 80 -28.213 -11.142 -5.309 1.00 75.42 C ATOM 0 H THR A 80 -25.984 -9.029 -4.670 1.00 15.12 H new ATOM 0 HA THR A 80 -27.077 -9.826 -7.193 1.00 61.40 H new ATOM 0 HB THR A 80 -29.206 -9.313 -5.736 1.00 72.01 H new ATOM 0 HG1 THR A 80 -28.266 -8.168 -4.039 1.00 12.41 H new ATOM 0 HG21 THR A 80 -28.977 -11.475 -4.606 1.00 75.42 H new ATOM 0 HG22 THR A 80 -28.420 -11.559 -6.294 1.00 75.42 H new ATOM 0 HG23 THR A 80 -27.235 -11.482 -4.969 1.00 75.42 H new ATOM 1113 N SER A 81 -28.486 -7.828 -7.973 1.00 23.42 N ATOM 1114 CA SER A 81 -28.853 -6.669 -8.777 1.00 50.14 C ATOM 1115 C SER A 81 -29.595 -5.562 -7.999 1.00 52.12 C ATOM 1116 O SER A 81 -29.378 -4.376 -8.265 1.00 44.12 O ATOM 1117 CB SER A 81 -29.631 -7.107 -10.015 1.00 71.30 C ATOM 1118 OG SER A 81 -28.850 -8.021 -10.792 1.00 61.15 O ATOM 0 H SER A 81 -29.003 -8.676 -8.207 1.00 23.42 H new ATOM 0 HA SER A 81 -27.916 -6.206 -9.087 1.00 50.14 H new ATOM 0 HB2 SER A 81 -30.567 -7.579 -9.717 1.00 71.30 H new ATOM 0 HB3 SER A 81 -29.891 -6.236 -10.617 1.00 71.30 H new ATOM 0 HG SER A 81 -27.897 -7.839 -10.651 1.00 61.15 H new ATOM 1124 N ASP A 82 -30.435 -5.937 -7.034 1.00 31.02 N ATOM 1125 CA ASP A 82 -31.186 -4.929 -6.247 1.00 75.23 C ATOM 1126 C ASP A 82 -30.229 -4.071 -5.463 1.00 32.30 C ATOM 1127 O ASP A 82 -30.359 -2.843 -5.409 1.00 52.24 O ATOM 1128 CB ASP A 82 -32.194 -5.573 -5.282 1.00 55.31 C ATOM 1129 CG ASP A 82 -33.277 -6.358 -5.969 1.00 53.40 C ATOM 1130 OD1 ASP A 82 -34.206 -5.746 -6.532 1.00 31.35 O ATOM 1131 OD2 ASP A 82 -33.229 -7.606 -5.938 1.00 72.55 O ATOM 0 H ASP A 82 -30.618 -6.906 -6.774 1.00 31.02 H new ATOM 0 HA ASP A 82 -31.745 -4.321 -6.958 1.00 75.23 H new ATOM 0 HB2 ASP A 82 -31.658 -6.232 -4.599 1.00 55.31 H new ATOM 0 HB3 ASP A 82 -32.653 -4.792 -4.677 1.00 55.31 H new ATOM 1136 N GLU A 83 -29.270 -4.723 -4.873 1.00 52.01 N ATOM 1137 CA GLU A 83 -28.225 -4.094 -4.100 1.00 31.21 C ATOM 1138 C GLU A 83 -27.296 -3.319 -5.022 1.00 34.34 C ATOM 1139 O GLU A 83 -26.835 -2.264 -4.683 1.00 61.24 O ATOM 1140 CB GLU A 83 -27.445 -5.166 -3.324 1.00 10.24 C ATOM 1141 CG GLU A 83 -28.233 -5.877 -2.200 1.00 55.53 C ATOM 1142 CD GLU A 83 -29.551 -6.477 -2.641 1.00 75.32 C ATOM 1143 OE1 GLU A 83 -29.581 -7.220 -3.633 1.00 25.12 O ATOM 1144 OE2 GLU A 83 -30.579 -6.158 -2.035 1.00 70.30 O ATOM 0 H GLU A 83 -29.186 -5.739 -4.914 1.00 52.01 H new ATOM 0 HA GLU A 83 -28.667 -3.396 -3.388 1.00 31.21 H new ATOM 0 HB2 GLU A 83 -27.094 -5.918 -4.030 1.00 10.24 H new ATOM 0 HB3 GLU A 83 -26.561 -4.702 -2.887 1.00 10.24 H new ATOM 0 HG2 GLU A 83 -27.610 -6.667 -1.781 1.00 55.53 H new ATOM 0 HG3 GLU A 83 -28.423 -5.163 -1.399 1.00 55.53 H new ATOM 1151 N LEU A 84 -27.060 -3.852 -6.202 1.00 25.24 N ATOM 1152 CA LEU A 84 -26.227 -3.197 -7.202 1.00 64.35 C ATOM 1153 C LEU A 84 -26.843 -1.828 -7.581 1.00 71.45 C ATOM 1154 O LEU A 84 -26.137 -0.814 -7.667 1.00 64.11 O ATOM 1155 CB LEU A 84 -26.045 -4.160 -8.414 1.00 1.44 C ATOM 1156 CG LEU A 84 -25.131 -3.751 -9.596 1.00 2.32 C ATOM 1157 CD1 LEU A 84 -25.746 -2.690 -10.464 1.00 74.24 C ATOM 1158 CD2 LEU A 84 -23.765 -3.312 -9.100 1.00 11.43 C ATOM 0 H LEU A 84 -27.438 -4.751 -6.500 1.00 25.24 H new ATOM 0 HA LEU A 84 -25.233 -2.983 -6.810 1.00 64.35 H new ATOM 0 HB2 LEU A 84 -25.667 -5.105 -8.024 1.00 1.44 H new ATOM 0 HB3 LEU A 84 -27.036 -4.357 -8.823 1.00 1.44 H new ATOM 0 HG LEU A 84 -25.010 -4.638 -10.217 1.00 2.32 H new ATOM 0 HD11 LEU A 84 -25.062 -2.442 -11.276 1.00 74.24 H new ATOM 0 HD12 LEU A 84 -26.684 -3.058 -10.879 1.00 74.24 H new ATOM 0 HD13 LEU A 84 -25.939 -1.798 -9.867 1.00 74.24 H new ATOM 0 HD21 LEU A 84 -23.143 -3.030 -9.949 1.00 11.43 H new ATOM 0 HD22 LEU A 84 -23.878 -2.457 -8.433 1.00 11.43 H new ATOM 0 HD23 LEU A 84 -23.293 -4.133 -8.561 1.00 11.43 H new ATOM 1170 N GLU A 85 -28.154 -1.803 -7.772 1.00 64.30 N ATOM 1171 CA GLU A 85 -28.854 -0.554 -8.037 1.00 25.22 C ATOM 1172 C GLU A 85 -28.923 0.303 -6.786 1.00 53.33 C ATOM 1173 O GLU A 85 -28.882 1.522 -6.856 1.00 34.31 O ATOM 1174 CB GLU A 85 -30.243 -0.811 -8.599 1.00 61.04 C ATOM 1175 CG GLU A 85 -30.226 -1.410 -9.987 1.00 71.15 C ATOM 1176 CD GLU A 85 -29.530 -0.502 -10.974 1.00 41.02 C ATOM 1177 OE1 GLU A 85 -30.092 0.553 -11.313 1.00 22.04 O ATOM 1178 OE2 GLU A 85 -28.421 -0.832 -11.428 1.00 32.23 O ATOM 0 H GLU A 85 -28.752 -2.629 -7.749 1.00 64.30 H new ATOM 0 HA GLU A 85 -28.288 -0.007 -8.791 1.00 25.22 H new ATOM 0 HB2 GLU A 85 -30.780 -1.481 -7.928 1.00 61.04 H new ATOM 0 HB3 GLU A 85 -30.797 0.127 -8.623 1.00 61.04 H new ATOM 0 HG2 GLU A 85 -29.721 -2.376 -9.961 1.00 71.15 H new ATOM 0 HG3 GLU A 85 -31.248 -1.593 -10.318 1.00 71.15 H new ATOM 1185 N ASN A 86 -28.999 -0.343 -5.646 1.00 74.40 N ATOM 1186 CA ASN A 86 -29.010 0.345 -4.363 1.00 61.53 C ATOM 1187 C ASN A 86 -27.678 1.054 -4.113 1.00 63.42 C ATOM 1188 O ASN A 86 -27.649 2.163 -3.601 1.00 2.24 O ATOM 1189 CB ASN A 86 -29.417 -0.618 -3.221 1.00 41.01 C ATOM 1190 CG ASN A 86 -28.488 -0.624 -2.024 1.00 1.54 C ATOM 1191 OD1 ASN A 86 -27.558 -1.409 -1.967 1.00 5.13 O ATOM 1192 ND2 ASN A 86 -28.723 0.237 -1.082 1.00 42.24 N ATOM 0 H ASN A 86 -29.055 -1.359 -5.575 1.00 74.40 H new ATOM 0 HA ASN A 86 -29.771 1.125 -4.387 1.00 61.53 H new ATOM 0 HB2 ASN A 86 -30.419 -0.353 -2.883 1.00 41.01 H new ATOM 0 HB3 ASN A 86 -29.474 -1.630 -3.623 1.00 41.01 H new ATOM 0 HD21 ASN A 86 -28.120 0.271 -0.260 1.00 42.24 H new ATOM 0 HD22 ASN A 86 -29.511 0.879 -1.163 1.00 42.24 H new ATOM 1199 N LEU A 87 -26.590 0.417 -4.509 1.00 45.35 N ATOM 1200 CA LEU A 87 -25.263 1.010 -4.428 1.00 51.45 C ATOM 1201 C LEU A 87 -25.216 2.250 -5.306 1.00 42.01 C ATOM 1202 O LEU A 87 -24.686 3.280 -4.917 1.00 12.22 O ATOM 1203 CB LEU A 87 -24.183 0.013 -4.892 1.00 64.45 C ATOM 1204 CG LEU A 87 -24.039 -1.284 -4.091 1.00 34.23 C ATOM 1205 CD1 LEU A 87 -22.987 -2.181 -4.720 1.00 63.22 C ATOM 1206 CD2 LEU A 87 -23.676 -0.990 -2.648 1.00 15.54 C ATOM 0 H LEU A 87 -26.600 -0.527 -4.896 1.00 45.35 H new ATOM 0 HA LEU A 87 -25.063 1.275 -3.390 1.00 51.45 H new ATOM 0 HB2 LEU A 87 -24.390 -0.251 -5.929 1.00 64.45 H new ATOM 0 HB3 LEU A 87 -23.222 0.526 -4.880 1.00 64.45 H new ATOM 0 HG LEU A 87 -24.999 -1.800 -4.107 1.00 34.23 H new ATOM 0 HD11 LEU A 87 -22.897 -3.099 -4.139 1.00 63.22 H new ATOM 0 HD12 LEU A 87 -23.280 -2.425 -5.741 1.00 63.22 H new ATOM 0 HD13 LEU A 87 -22.028 -1.663 -4.732 1.00 63.22 H new ATOM 0 HD21 LEU A 87 -23.579 -1.927 -2.099 1.00 15.54 H new ATOM 0 HD22 LEU A 87 -22.730 -0.450 -2.614 1.00 15.54 H new ATOM 0 HD23 LEU A 87 -24.458 -0.382 -2.193 1.00 15.54 H new ATOM 1218 N ASP A 88 -25.809 2.133 -6.485 1.00 10.23 N ATOM 1219 CA ASP A 88 -25.893 3.238 -7.448 1.00 1.35 C ATOM 1220 C ASP A 88 -26.727 4.377 -6.878 1.00 61.54 C ATOM 1221 O ASP A 88 -26.442 5.548 -7.094 1.00 63.11 O ATOM 1222 CB ASP A 88 -26.500 2.732 -8.765 1.00 23.54 C ATOM 1223 CG ASP A 88 -26.669 3.812 -9.816 1.00 4.34 C ATOM 1224 OD1 ASP A 88 -25.697 4.121 -10.525 1.00 33.54 O ATOM 1225 OD2 ASP A 88 -27.797 4.352 -9.954 1.00 34.14 O ATOM 0 H ASP A 88 -26.248 1.271 -6.808 1.00 10.23 H new ATOM 0 HA ASP A 88 -24.890 3.616 -7.644 1.00 1.35 H new ATOM 0 HB2 ASP A 88 -25.865 1.943 -9.167 1.00 23.54 H new ATOM 0 HB3 ASP A 88 -27.472 2.284 -8.558 1.00 23.54 H new ATOM 1230 N ALA A 89 -27.745 4.018 -6.140 1.00 52.53 N ATOM 1231 CA ALA A 89 -28.605 4.977 -5.481 1.00 42.32 C ATOM 1232 C ALA A 89 -27.856 5.698 -4.356 1.00 42.14 C ATOM 1233 O ALA A 89 -27.928 6.920 -4.229 1.00 40.21 O ATOM 1234 CB ALA A 89 -29.838 4.271 -4.938 1.00 62.53 C ATOM 0 H ALA A 89 -28.006 3.046 -5.976 1.00 52.53 H new ATOM 0 HA ALA A 89 -28.917 5.727 -6.208 1.00 42.32 H new ATOM 0 HB1 ALA A 89 -30.484 4.996 -4.442 1.00 62.53 H new ATOM 0 HB2 ALA A 89 -30.381 3.804 -5.759 1.00 62.53 H new ATOM 0 HB3 ALA A 89 -29.534 3.507 -4.223 1.00 62.53 H new ATOM 1240 N VAL A 90 -27.134 4.931 -3.559 1.00 33.33 N ATOM 1241 CA VAL A 90 -26.379 5.452 -2.417 1.00 71.21 C ATOM 1242 C VAL A 90 -25.160 6.305 -2.855 1.00 73.23 C ATOM 1243 O VAL A 90 -24.999 7.442 -2.408 1.00 1.44 O ATOM 1244 CB VAL A 90 -25.938 4.291 -1.454 1.00 62.13 C ATOM 1245 CG1 VAL A 90 -25.051 4.795 -0.327 1.00 51.12 C ATOM 1246 CG2 VAL A 90 -27.160 3.609 -0.856 1.00 45.22 C ATOM 0 H VAL A 90 -27.050 3.922 -3.681 1.00 33.33 H new ATOM 0 HA VAL A 90 -27.050 6.115 -1.870 1.00 71.21 H new ATOM 0 HB VAL A 90 -25.366 3.580 -2.050 1.00 62.13 H new ATOM 0 HG11 VAL A 90 -24.769 3.961 0.315 1.00 51.12 H new ATOM 0 HG12 VAL A 90 -24.153 5.250 -0.746 1.00 51.12 H new ATOM 0 HG13 VAL A 90 -25.594 5.537 0.259 1.00 51.12 H new ATOM 0 HG21 VAL A 90 -26.840 2.807 -0.191 1.00 45.22 H new ATOM 0 HG22 VAL A 90 -27.743 4.337 -0.292 1.00 45.22 H new ATOM 0 HG23 VAL A 90 -27.773 3.194 -1.656 1.00 45.22 H new ATOM 1256 N GLU A 91 -24.336 5.764 -3.730 1.00 5.35 N ATOM 1257 CA GLU A 91 -23.117 6.454 -4.182 1.00 64.33 C ATOM 1258 C GLU A 91 -23.435 7.551 -5.198 1.00 62.44 C ATOM 1259 O GLU A 91 -22.739 8.570 -5.271 1.00 72.23 O ATOM 1260 CB GLU A 91 -22.161 5.448 -4.817 1.00 34.53 C ATOM 1261 CG GLU A 91 -21.677 4.353 -3.882 1.00 25.41 C ATOM 1262 CD GLU A 91 -20.771 4.865 -2.786 1.00 33.53 C ATOM 1263 OE1 GLU A 91 -21.263 5.290 -1.724 1.00 75.21 O ATOM 1264 OE2 GLU A 91 -19.547 4.840 -2.970 1.00 4.04 O ATOM 0 H GLU A 91 -24.478 4.846 -4.151 1.00 5.35 H new ATOM 0 HA GLU A 91 -22.655 6.917 -3.310 1.00 64.33 H new ATOM 0 HB2 GLU A 91 -22.657 4.985 -5.670 1.00 34.53 H new ATOM 0 HB3 GLU A 91 -21.295 5.985 -5.204 1.00 34.53 H new ATOM 0 HG2 GLU A 91 -22.539 3.861 -3.432 1.00 25.41 H new ATOM 0 HG3 GLU A 91 -21.145 3.598 -4.461 1.00 25.41 H new ATOM 1271 N GLY A 92 -24.514 7.350 -5.947 1.00 20.21 N ATOM 1272 CA GLY A 92 -24.911 8.252 -7.036 1.00 3.01 C ATOM 1273 C GLY A 92 -25.134 9.696 -6.616 1.00 34.13 C ATOM 1274 O GLY A 92 -25.146 10.591 -7.455 1.00 22.40 O ATOM 0 H GLY A 92 -25.143 6.557 -5.820 1.00 20.21 H new ATOM 0 HA2 GLY A 92 -24.142 8.227 -7.808 1.00 3.01 H new ATOM 0 HA3 GLY A 92 -25.828 7.873 -7.487 1.00 3.01 H new ATOM 1278 N ASN A 93 -25.305 9.918 -5.324 1.00 53.32 N ATOM 1279 CA ASN A 93 -25.525 11.263 -4.777 1.00 4.23 C ATOM 1280 C ASN A 93 -24.357 12.190 -5.087 1.00 33.05 C ATOM 1281 O ASN A 93 -24.538 13.395 -5.268 1.00 14.40 O ATOM 1282 CB ASN A 93 -25.741 11.213 -3.257 1.00 30.11 C ATOM 1283 CG ASN A 93 -26.978 10.439 -2.846 1.00 71.31 C ATOM 1284 OD1 ASN A 93 -27.972 10.395 -3.569 1.00 53.12 O ATOM 1285 ND2 ASN A 93 -26.928 9.827 -1.691 1.00 53.42 N ATOM 0 H ASN A 93 -25.297 9.180 -4.620 1.00 53.32 H new ATOM 0 HA ASN A 93 -26.422 11.656 -5.255 1.00 4.23 H new ATOM 0 HB2 ASN A 93 -24.867 10.760 -2.789 1.00 30.11 H new ATOM 0 HB3 ASN A 93 -25.816 12.231 -2.875 1.00 30.11 H new ATOM 0 HD21 ASN A 93 -27.731 9.291 -1.363 1.00 53.42 H new ATOM 0 HD22 ASN A 93 -26.086 9.886 -1.118 1.00 53.42 H new ATOM 1292 N GLU A 94 -23.165 11.634 -5.161 1.00 71.01 N ATOM 1293 CA GLU A 94 -21.972 12.432 -5.401 1.00 71.04 C ATOM 1294 C GLU A 94 -20.971 11.723 -6.316 1.00 1.22 C ATOM 1295 O GLU A 94 -19.873 12.216 -6.557 1.00 2.44 O ATOM 1296 CB GLU A 94 -21.354 12.834 -4.057 1.00 11.34 C ATOM 1297 CG GLU A 94 -21.109 11.669 -3.106 1.00 4.12 C ATOM 1298 CD GLU A 94 -20.671 12.123 -1.740 1.00 20.53 C ATOM 1299 OE1 GLU A 94 -21.528 12.627 -0.983 1.00 41.33 O ATOM 1300 OE2 GLU A 94 -19.489 11.976 -1.393 1.00 22.51 O ATOM 0 H GLU A 94 -22.993 10.634 -5.059 1.00 71.01 H new ATOM 0 HA GLU A 94 -22.259 13.337 -5.937 1.00 71.04 H new ATOM 0 HB2 GLU A 94 -20.407 13.341 -4.243 1.00 11.34 H new ATOM 0 HB3 GLU A 94 -22.011 13.554 -3.569 1.00 11.34 H new ATOM 0 HG2 GLU A 94 -22.022 11.081 -3.014 1.00 4.12 H new ATOM 0 HG3 GLU A 94 -20.348 11.013 -3.529 1.00 4.12 H new ATOM 1307 N TYR A 95 -21.372 10.586 -6.845 1.00 21.15 N ATOM 1308 CA TYR A 95 -20.531 9.794 -7.726 1.00 61.45 C ATOM 1309 C TYR A 95 -21.326 9.258 -8.889 1.00 3.41 C ATOM 1310 O TYR A 95 -22.556 9.346 -8.907 1.00 41.51 O ATOM 1311 CB TYR A 95 -19.877 8.627 -6.990 1.00 22.23 C ATOM 1312 CG TYR A 95 -18.852 9.019 -5.965 1.00 4.15 C ATOM 1313 CD1 TYR A 95 -17.544 9.206 -6.338 1.00 3.13 C ATOM 1314 CD2 TYR A 95 -19.187 9.186 -4.632 1.00 32.33 C ATOM 1315 CE1 TYR A 95 -16.581 9.552 -5.422 1.00 1.02 C ATOM 1316 CE2 TYR A 95 -18.228 9.532 -3.698 1.00 34.25 C ATOM 1317 CZ TYR A 95 -16.926 9.713 -4.102 1.00 10.23 C ATOM 1318 OH TYR A 95 -15.964 10.060 -3.188 1.00 24.51 O ATOM 0 H TYR A 95 -22.293 10.181 -6.677 1.00 21.15 H new ATOM 0 HA TYR A 95 -19.748 10.458 -8.092 1.00 61.45 H new ATOM 0 HB2 TYR A 95 -20.656 8.044 -6.499 1.00 22.23 H new ATOM 0 HB3 TYR A 95 -19.405 7.973 -7.723 1.00 22.23 H new ATOM 0 HD1 TYR A 95 -17.266 9.078 -7.374 1.00 3.13 H new ATOM 0 HD2 TYR A 95 -20.210 9.044 -4.318 1.00 32.33 H new ATOM 0 HE1 TYR A 95 -15.558 9.697 -5.738 1.00 1.02 H new ATOM 0 HE2 TYR A 95 -18.499 9.659 -2.660 1.00 34.25 H new ATOM 0 HH TYR A 95 -16.369 10.135 -2.299 1.00 24.51 H new ATOM 1328 N GLU A 96 -20.624 8.735 -9.865 1.00 2.20 N ATOM 1329 CA GLU A 96 -21.243 8.130 -11.012 1.00 50.25 C ATOM 1330 C GLU A 96 -20.718 6.709 -11.153 1.00 24.43 C ATOM 1331 O GLU A 96 -19.540 6.445 -10.847 1.00 32.15 O ATOM 1332 CB GLU A 96 -20.945 8.949 -12.276 1.00 51.20 C ATOM 1333 CG GLU A 96 -21.625 8.424 -13.527 1.00 24.11 C ATOM 1334 CD GLU A 96 -23.120 8.348 -13.363 1.00 22.03 C ATOM 1335 OE1 GLU A 96 -23.804 9.370 -13.576 1.00 55.01 O ATOM 1336 OE2 GLU A 96 -23.636 7.263 -13.012 1.00 64.00 O ATOM 0 H GLU A 96 -19.604 8.719 -9.883 1.00 2.20 H new ATOM 0 HA GLU A 96 -22.325 8.107 -10.881 1.00 50.25 H new ATOM 0 HB2 GLU A 96 -21.258 9.980 -12.110 1.00 51.20 H new ATOM 0 HB3 GLU A 96 -19.868 8.965 -12.440 1.00 51.20 H new ATOM 0 HG2 GLU A 96 -21.385 9.072 -14.370 1.00 24.11 H new ATOM 0 HG3 GLU A 96 -21.235 7.434 -13.764 1.00 24.11 H new ATOM 1343 N ARG A 97 -21.566 5.805 -11.610 1.00 60.32 N ATOM 1344 CA ARG A 97 -21.190 4.421 -11.738 1.00 44.13 C ATOM 1345 C ARG A 97 -20.553 4.209 -13.093 1.00 44.12 C ATOM 1346 O ARG A 97 -21.203 4.344 -14.130 1.00 2.33 O ATOM 1347 CB ARG A 97 -22.418 3.509 -11.569 1.00 75.51 C ATOM 1348 CG ARG A 97 -22.078 2.026 -11.477 1.00 0.13 C ATOM 1349 CD ARG A 97 -23.318 1.169 -11.213 1.00 21.43 C ATOM 1350 NE ARG A 97 -24.258 1.138 -12.342 1.00 74.23 N ATOM 1351 CZ ARG A 97 -25.512 0.651 -12.277 1.00 62.43 C ATOM 1352 NH1 ARG A 97 -26.053 0.343 -11.111 1.00 53.34 N ATOM 1353 NH2 ARG A 97 -26.231 0.511 -13.375 1.00 23.44 N ATOM 0 H ARG A 97 -22.522 6.012 -11.898 1.00 60.32 H new ATOM 0 HA ARG A 97 -20.475 4.165 -10.956 1.00 44.13 H new ATOM 0 HB2 ARG A 97 -22.957 3.805 -10.669 1.00 75.51 H new ATOM 0 HB3 ARG A 97 -23.093 3.665 -12.410 1.00 75.51 H new ATOM 0 HG2 ARG A 97 -21.606 1.704 -12.405 1.00 0.13 H new ATOM 0 HG3 ARG A 97 -21.352 1.869 -10.679 1.00 0.13 H new ATOM 0 HD2 ARG A 97 -23.004 0.151 -10.983 1.00 21.43 H new ATOM 0 HD3 ARG A 97 -23.833 1.551 -10.331 1.00 21.43 H new ATOM 0 HE ARG A 97 -23.939 1.511 -13.236 1.00 74.23 H new ATOM 0 HH11 ARG A 97 -25.520 0.474 -10.251 1.00 53.34 H new ATOM 0 HH12 ARG A 97 -27.003 -0.025 -11.071 1.00 53.34 H new ATOM 0 HH21 ARG A 97 -25.837 0.772 -14.279 1.00 23.44 H new ATOM 0 HH22 ARG A 97 -27.180 0.142 -13.319 1.00 23.44 H new ATOM 1367 N VAL A 98 -19.293 3.894 -13.088 1.00 41.21 N ATOM 1368 CA VAL A 98 -18.554 3.717 -14.307 1.00 61.31 C ATOM 1369 C VAL A 98 -17.883 2.375 -14.353 1.00 14.32 C ATOM 1370 O VAL A 98 -17.724 1.712 -13.326 1.00 3.14 O ATOM 1371 CB VAL A 98 -17.518 4.836 -14.549 1.00 73.42 C ATOM 1372 CG1 VAL A 98 -18.216 6.181 -14.643 1.00 42.22 C ATOM 1373 CG2 VAL A 98 -16.459 4.848 -13.450 1.00 21.22 C ATOM 0 H VAL A 98 -18.745 3.752 -12.239 1.00 41.21 H new ATOM 0 HA VAL A 98 -19.288 3.773 -15.111 1.00 61.31 H new ATOM 0 HB VAL A 98 -17.011 4.640 -15.494 1.00 73.42 H new ATOM 0 HG11 VAL A 98 -17.477 6.963 -14.814 1.00 42.22 H new ATOM 0 HG12 VAL A 98 -18.926 6.166 -15.470 1.00 42.22 H new ATOM 0 HG13 VAL A 98 -18.748 6.381 -13.713 1.00 42.22 H new ATOM 0 HG21 VAL A 98 -15.742 5.645 -13.645 1.00 21.22 H new ATOM 0 HG22 VAL A 98 -16.938 5.018 -12.485 1.00 21.22 H new ATOM 0 HG23 VAL A 98 -15.940 3.889 -13.434 1.00 21.22 H new ATOM 1383 N THR A 99 -17.516 1.965 -15.527 1.00 20.43 N ATOM 1384 CA THR A 99 -16.858 0.700 -15.704 1.00 32.14 C ATOM 1385 C THR A 99 -15.356 0.928 -15.813 1.00 45.54 C ATOM 1386 O THR A 99 -14.906 1.875 -16.465 1.00 75.45 O ATOM 1387 CB THR A 99 -17.418 -0.093 -16.937 1.00 50.54 C ATOM 1388 OG1 THR A 99 -16.731 -1.352 -17.101 1.00 73.45 O ATOM 1389 CG2 THR A 99 -17.324 0.716 -18.228 1.00 71.51 C ATOM 0 H THR A 99 -17.661 2.492 -16.388 1.00 20.43 H new ATOM 0 HA THR A 99 -17.061 0.077 -14.833 1.00 32.14 H new ATOM 0 HB THR A 99 -18.471 -0.285 -16.732 1.00 50.54 H new ATOM 0 HG1 THR A 99 -17.100 -1.827 -17.875 1.00 73.45 H new ATOM 0 HG21 THR A 99 -17.723 0.129 -19.055 1.00 71.51 H new ATOM 0 HG22 THR A 99 -17.901 1.635 -18.124 1.00 71.51 H new ATOM 0 HG23 THR A 99 -16.281 0.963 -18.428 1.00 71.51 H new ATOM 1397 N VAL A 100 -14.593 0.106 -15.141 1.00 21.41 N ATOM 1398 CA VAL A 100 -13.153 0.235 -15.110 1.00 51.22 C ATOM 1399 C VAL A 100 -12.492 -1.123 -15.216 1.00 31.31 C ATOM 1400 O VAL A 100 -13.151 -2.157 -15.062 1.00 75.23 O ATOM 1401 CB VAL A 100 -12.660 0.926 -13.808 1.00 12.54 C ATOM 1402 CG1 VAL A 100 -13.140 2.367 -13.722 1.00 60.12 C ATOM 1403 CG2 VAL A 100 -13.104 0.140 -12.574 1.00 34.33 C ATOM 0 H VAL A 100 -14.952 -0.678 -14.595 1.00 21.41 H new ATOM 0 HA VAL A 100 -12.876 0.854 -15.963 1.00 51.22 H new ATOM 0 HB VAL A 100 -11.571 0.939 -13.839 1.00 12.54 H new ATOM 0 HG11 VAL A 100 -12.776 2.817 -12.799 1.00 60.12 H new ATOM 0 HG12 VAL A 100 -12.759 2.929 -14.575 1.00 60.12 H new ATOM 0 HG13 VAL A 100 -14.230 2.389 -13.731 1.00 60.12 H new ATOM 0 HG21 VAL A 100 -12.747 0.643 -11.675 1.00 34.33 H new ATOM 0 HG22 VAL A 100 -14.192 0.083 -12.551 1.00 34.33 H new ATOM 0 HG23 VAL A 100 -12.689 -0.867 -12.615 1.00 34.33 H new ATOM 1413 N GLY A 101 -11.218 -1.120 -15.499 1.00 64.42 N ATOM 1414 CA GLY A 101 -10.467 -2.335 -15.567 1.00 50.14 C ATOM 1415 C GLY A 101 -9.557 -2.464 -14.378 1.00 71.15 C ATOM 1416 O GLY A 101 -8.710 -1.610 -14.149 1.00 62.25 O ATOM 0 H GLY A 101 -10.677 -0.276 -15.688 1.00 64.42 H new ATOM 0 HA2 GLY A 101 -11.146 -3.187 -15.605 1.00 50.14 H new ATOM 0 HA3 GLY A 101 -9.879 -2.354 -16.485 1.00 50.14 H new ATOM 1420 N ILE A 102 -9.740 -3.511 -13.619 1.00 24.33 N ATOM 1421 CA ILE A 102 -8.951 -3.753 -12.436 1.00 44.33 C ATOM 1422 C ILE A 102 -8.138 -5.019 -12.585 1.00 71.41 C ATOM 1423 O ILE A 102 -8.515 -5.913 -13.321 1.00 63.24 O ATOM 1424 CB ILE A 102 -9.815 -3.743 -11.113 1.00 12.31 C ATOM 1425 CG1 ILE A 102 -11.003 -4.735 -11.126 1.00 24.22 C ATOM 1426 CG2 ILE A 102 -10.316 -2.358 -10.814 1.00 55.41 C ATOM 1427 CD1 ILE A 102 -10.662 -6.184 -10.900 1.00 5.31 C ATOM 0 H ILE A 102 -10.444 -4.226 -13.803 1.00 24.33 H new ATOM 0 HA ILE A 102 -8.254 -2.921 -12.334 1.00 44.33 H new ATOM 0 HB ILE A 102 -9.140 -4.077 -10.325 1.00 12.31 H new ATOM 0 HG12 ILE A 102 -11.715 -4.427 -10.360 1.00 24.22 H new ATOM 0 HG13 ILE A 102 -11.511 -4.648 -12.086 1.00 24.22 H new ATOM 0 HG21 ILE A 102 -10.908 -2.375 -9.899 1.00 55.41 H new ATOM 0 HG22 ILE A 102 -9.469 -1.684 -10.685 1.00 55.41 H new ATOM 0 HG23 ILE A 102 -10.935 -2.009 -11.640 1.00 55.41 H new ATOM 0 HD11 ILE A 102 -11.573 -6.781 -10.931 1.00 5.31 H new ATOM 0 HD12 ILE A 102 -9.979 -6.523 -11.679 1.00 5.31 H new ATOM 0 HD13 ILE A 102 -10.186 -6.298 -9.926 1.00 5.31 H new ATOM 1439 N VAL A 103 -7.029 -5.082 -11.924 1.00 35.04 N ATOM 1440 CA VAL A 103 -6.160 -6.224 -12.019 1.00 60.22 C ATOM 1441 C VAL A 103 -6.109 -6.952 -10.692 1.00 64.14 C ATOM 1442 O VAL A 103 -5.944 -6.330 -9.648 1.00 62.32 O ATOM 1443 CB VAL A 103 -4.724 -5.811 -12.469 1.00 13.34 C ATOM 1444 CG1 VAL A 103 -3.782 -7.012 -12.543 1.00 23.25 C ATOM 1445 CG2 VAL A 103 -4.763 -5.088 -13.812 1.00 10.11 C ATOM 0 H VAL A 103 -6.694 -4.347 -11.301 1.00 35.04 H new ATOM 0 HA VAL A 103 -6.565 -6.894 -12.777 1.00 60.22 H new ATOM 0 HB VAL A 103 -4.335 -5.130 -11.712 1.00 13.34 H new ATOM 0 HG11 VAL A 103 -2.793 -6.680 -12.860 1.00 23.25 H new ATOM 0 HG12 VAL A 103 -3.710 -7.479 -11.561 1.00 23.25 H new ATOM 0 HG13 VAL A 103 -4.170 -7.735 -13.261 1.00 23.25 H new ATOM 0 HG21 VAL A 103 -3.751 -4.810 -14.105 1.00 10.11 H new ATOM 0 HG22 VAL A 103 -5.191 -5.747 -14.567 1.00 10.11 H new ATOM 0 HG23 VAL A 103 -5.375 -4.190 -13.724 1.00 10.11 H new ATOM 1455 N ARG A 104 -6.287 -8.255 -10.752 1.00 2.02 N ATOM 1456 CA ARG A 104 -6.222 -9.135 -9.594 1.00 11.44 C ATOM 1457 C ARG A 104 -4.866 -9.007 -8.947 1.00 14.32 C ATOM 1458 O ARG A 104 -3.843 -9.221 -9.607 1.00 32.30 O ATOM 1459 CB ARG A 104 -6.380 -10.610 -10.033 1.00 5.24 C ATOM 1460 CG ARG A 104 -7.695 -10.974 -10.703 1.00 74.31 C ATOM 1461 CD ARG A 104 -8.860 -10.903 -9.745 1.00 23.31 C ATOM 1462 NE ARG A 104 -8.736 -11.859 -8.638 1.00 71.35 N ATOM 1463 CZ ARG A 104 -9.681 -12.722 -8.241 1.00 44.31 C ATOM 1464 NH1 ARG A 104 -10.828 -12.822 -8.899 1.00 10.04 N ATOM 1465 NH2 ARG A 104 -9.466 -13.485 -7.176 1.00 54.05 N ATOM 0 H ARG A 104 -6.485 -8.747 -11.623 1.00 2.02 H new ATOM 0 HA ARG A 104 -7.019 -8.855 -8.905 1.00 11.44 H new ATOM 0 HB2 ARG A 104 -5.568 -10.852 -10.718 1.00 5.24 H new ATOM 0 HB3 ARG A 104 -6.256 -11.244 -9.155 1.00 5.24 H new ATOM 0 HG2 ARG A 104 -7.873 -10.300 -11.540 1.00 74.31 H new ATOM 0 HG3 ARG A 104 -7.625 -11.981 -11.114 1.00 74.31 H new ATOM 0 HD2 ARG A 104 -8.934 -9.893 -9.342 1.00 23.31 H new ATOM 0 HD3 ARG A 104 -9.785 -11.098 -10.288 1.00 23.31 H new ATOM 0 HE ARG A 104 -7.854 -11.867 -8.126 1.00 71.35 H new ATOM 0 HH11 ARG A 104 -10.999 -12.238 -9.718 1.00 10.04 H new ATOM 0 HH12 ARG A 104 -11.539 -13.483 -8.587 1.00 10.04 H new ATOM 0 HH21 ARG A 104 -8.586 -13.412 -6.666 1.00 54.05 H new ATOM 0 HH22 ARG A 104 -10.181 -14.144 -6.868 1.00 54.05 H new ATOM 1479 N GLU A 105 -4.843 -8.686 -7.668 1.00 54.32 N ATOM 1480 CA GLU A 105 -3.591 -8.634 -6.934 1.00 11.35 C ATOM 1481 C GLU A 105 -3.203 -10.026 -6.480 1.00 0.43 C ATOM 1482 O GLU A 105 -2.277 -10.219 -5.700 1.00 25.43 O ATOM 1483 CB GLU A 105 -3.664 -7.686 -5.760 1.00 23.11 C ATOM 1484 CG GLU A 105 -3.887 -6.244 -6.158 1.00 52.11 C ATOM 1485 CD GLU A 105 -3.842 -5.304 -4.981 1.00 44.14 C ATOM 1486 OE1 GLU A 105 -2.736 -4.862 -4.596 1.00 34.33 O ATOM 1487 OE2 GLU A 105 -4.874 -5.003 -4.416 1.00 33.23 O ATOM 0 H GLU A 105 -5.671 -8.458 -7.117 1.00 54.32 H new ATOM 0 HA GLU A 105 -2.823 -8.250 -7.605 1.00 11.35 H new ATOM 0 HB2 GLU A 105 -4.472 -8.001 -5.099 1.00 23.11 H new ATOM 0 HB3 GLU A 105 -2.739 -7.757 -5.188 1.00 23.11 H new ATOM 0 HG2 GLU A 105 -3.128 -5.949 -6.883 1.00 52.11 H new ATOM 0 HG3 GLU A 105 -4.853 -6.153 -6.654 1.00 52.11 H new ATOM 1494 N ASP A 106 -3.940 -10.976 -6.966 1.00 71.41 N ATOM 1495 CA ASP A 106 -3.676 -12.368 -6.742 1.00 22.11 C ATOM 1496 C ASP A 106 -2.687 -12.798 -7.792 1.00 13.52 C ATOM 1497 O ASP A 106 -1.530 -13.088 -7.500 1.00 60.24 O ATOM 1498 CB ASP A 106 -4.951 -13.206 -6.939 1.00 53.34 C ATOM 1499 CG ASP A 106 -6.150 -12.630 -6.261 1.00 63.11 C ATOM 1500 OD1 ASP A 106 -6.796 -11.774 -6.876 1.00 14.41 O ATOM 1501 OD2 ASP A 106 -6.468 -13.011 -5.111 1.00 35.32 O ATOM 0 H ASP A 106 -4.763 -10.803 -7.544 1.00 71.41 H new ATOM 0 HA ASP A 106 -3.308 -12.513 -5.726 1.00 22.11 H new ATOM 0 HB2 ASP A 106 -5.155 -13.298 -8.006 1.00 53.34 H new ATOM 0 HB3 ASP A 106 -4.777 -14.213 -6.560 1.00 53.34 H new ATOM 1506 N ASN A 107 -3.139 -12.780 -9.053 1.00 0.54 N ATOM 1507 CA ASN A 107 -2.319 -13.245 -10.143 1.00 51.42 C ATOM 1508 C ASN A 107 -1.693 -12.030 -10.837 1.00 33.13 C ATOM 1509 O ASN A 107 -0.817 -11.360 -10.293 1.00 63.13 O ATOM 1510 CB ASN A 107 -3.159 -14.042 -11.196 1.00 23.20 C ATOM 1511 CG ASN A 107 -4.067 -15.137 -10.662 1.00 15.40 C ATOM 1512 OD1 ASN A 107 -3.656 -16.274 -10.478 1.00 45.53 O ATOM 1513 ND2 ASN A 107 -5.333 -14.804 -10.487 1.00 22.12 N ATOM 0 H ASN A 107 -4.064 -12.448 -9.327 1.00 0.54 H new ATOM 0 HA ASN A 107 -1.555 -13.909 -9.739 1.00 51.42 H new ATOM 0 HB2 ASN A 107 -3.773 -13.331 -11.749 1.00 23.20 H new ATOM 0 HB3 ASN A 107 -2.470 -14.491 -11.911 1.00 23.20 H new ATOM 0 HD21 ASN A 107 -6.009 -15.507 -10.187 1.00 22.12 H new ATOM 0 HD22 ASN A 107 -5.635 -13.844 -10.651 1.00 22.12 H new ATOM 1520 N SER A 108 -2.183 -11.765 -12.025 1.00 34.54 N ATOM 1521 CA SER A 108 -1.850 -10.634 -12.856 1.00 23.53 C ATOM 1522 C SER A 108 -3.008 -10.479 -13.858 1.00 73.52 C ATOM 1523 O SER A 108 -2.886 -9.817 -14.891 1.00 30.55 O ATOM 1524 CB SER A 108 -0.516 -10.879 -13.610 1.00 65.11 C ATOM 1525 OG SER A 108 0.580 -11.075 -12.708 1.00 61.04 O ATOM 0 H SER A 108 -2.871 -12.376 -12.465 1.00 34.54 H new ATOM 0 HA SER A 108 -1.718 -9.734 -12.256 1.00 23.53 H new ATOM 0 HB2 SER A 108 -0.618 -11.753 -14.253 1.00 65.11 H new ATOM 0 HB3 SER A 108 -0.304 -10.029 -14.259 1.00 65.11 H new ATOM 0 HG SER A 108 0.253 -11.047 -11.785 1.00 61.04 H new ATOM 1531 N GLU A 109 -4.156 -11.085 -13.495 1.00 22.54 N ATOM 1532 CA GLU A 109 -5.341 -11.114 -14.344 1.00 53.34 C ATOM 1533 C GLU A 109 -6.058 -9.787 -14.295 1.00 72.03 C ATOM 1534 O GLU A 109 -6.129 -9.161 -13.257 1.00 41.44 O ATOM 1535 CB GLU A 109 -6.313 -12.202 -13.878 1.00 12.40 C ATOM 1536 CG GLU A 109 -5.786 -13.609 -13.901 1.00 55.41 C ATOM 1537 CD GLU A 109 -6.883 -14.599 -13.596 1.00 62.53 C ATOM 1538 OE1 GLU A 109 -7.344 -14.647 -12.452 1.00 44.04 O ATOM 1539 OE2 GLU A 109 -7.319 -15.310 -14.526 1.00 4.15 O ATOM 0 H GLU A 109 -4.277 -11.565 -12.603 1.00 22.54 H new ATOM 0 HA GLU A 109 -5.012 -11.323 -15.362 1.00 53.34 H new ATOM 0 HB2 GLU A 109 -6.627 -11.969 -12.861 1.00 12.40 H new ATOM 0 HB3 GLU A 109 -7.204 -12.158 -14.505 1.00 12.40 H new ATOM 0 HG2 GLU A 109 -5.357 -13.825 -14.879 1.00 55.41 H new ATOM 0 HG3 GLU A 109 -4.983 -13.713 -13.171 1.00 55.41 H new ATOM 1546 N LYS A 110 -6.604 -9.391 -15.395 1.00 23.34 N ATOM 1547 CA LYS A 110 -7.331 -8.136 -15.476 1.00 24.25 C ATOM 1548 C LYS A 110 -8.821 -8.435 -15.594 1.00 35.03 C ATOM 1549 O LYS A 110 -9.206 -9.452 -16.171 1.00 73.52 O ATOM 1550 CB LYS A 110 -6.874 -7.251 -16.673 1.00 54.12 C ATOM 1551 CG LYS A 110 -7.236 -7.760 -18.082 1.00 32.32 C ATOM 1552 CD LYS A 110 -6.547 -9.065 -18.452 1.00 2.22 C ATOM 1553 CE LYS A 110 -6.968 -9.534 -19.826 1.00 22.12 C ATOM 1554 NZ LYS A 110 -6.290 -10.782 -20.211 1.00 63.45 N ATOM 0 H LYS A 110 -6.568 -9.915 -16.270 1.00 23.34 H new ATOM 0 HA LYS A 110 -7.120 -7.571 -14.568 1.00 24.25 H new ATOM 0 HB2 LYS A 110 -7.306 -6.258 -16.548 1.00 54.12 H new ATOM 0 HB3 LYS A 110 -5.791 -7.137 -16.619 1.00 54.12 H new ATOM 0 HG2 LYS A 110 -8.315 -7.898 -18.143 1.00 32.32 H new ATOM 0 HG3 LYS A 110 -6.970 -6.998 -18.814 1.00 32.32 H new ATOM 0 HD2 LYS A 110 -5.466 -8.929 -18.427 1.00 2.22 H new ATOM 0 HD3 LYS A 110 -6.789 -9.829 -17.714 1.00 2.22 H new ATOM 0 HE2 LYS A 110 -8.047 -9.687 -19.843 1.00 22.12 H new ATOM 0 HE3 LYS A 110 -6.745 -8.758 -20.559 1.00 22.12 H new ATOM 0 HZ1 LYS A 110 -6.606 -11.070 -21.159 1.00 63.45 H new ATOM 0 HZ2 LYS A 110 -5.261 -10.630 -20.220 1.00 63.45 H new ATOM 0 HZ3 LYS A 110 -6.523 -11.529 -19.526 1.00 63.45 H new ATOM 1568 N MET A 111 -9.630 -7.586 -15.044 1.00 63.23 N ATOM 1569 CA MET A 111 -11.075 -7.732 -15.049 1.00 30.34 C ATOM 1570 C MET A 111 -11.725 -6.415 -15.248 1.00 4.40 C ATOM 1571 O MET A 111 -11.117 -5.375 -15.035 1.00 23.25 O ATOM 1572 CB MET A 111 -11.586 -8.288 -13.735 1.00 53.25 C ATOM 1573 CG MET A 111 -11.181 -9.691 -13.448 1.00 14.42 C ATOM 1574 SD MET A 111 -11.671 -10.220 -11.803 1.00 22.22 S ATOM 1575 CE MET A 111 -13.446 -9.998 -11.926 1.00 30.22 C ATOM 0 H MET A 111 -9.309 -6.746 -14.563 1.00 63.23 H new ATOM 0 HA MET A 111 -11.317 -8.418 -15.861 1.00 30.34 H new ATOM 0 HB2 MET A 111 -11.232 -7.650 -12.925 1.00 53.25 H new ATOM 0 HB3 MET A 111 -12.675 -8.232 -13.732 1.00 53.25 H new ATOM 0 HG2 MET A 111 -11.628 -10.354 -14.189 1.00 14.42 H new ATOM 0 HG3 MET A 111 -10.100 -9.782 -13.549 1.00 14.42 H new ATOM 0 HE1 MET A 111 -13.951 -10.776 -11.353 1.00 30.22 H new ATOM 0 HE2 MET A 111 -13.719 -9.020 -11.529 1.00 30.22 H new ATOM 0 HE3 MET A 111 -13.749 -10.062 -12.971 1.00 30.22 H new ATOM 1585 N ALA A 112 -12.936 -6.461 -15.641 1.00 62.32 N ATOM 1586 CA ALA A 112 -13.721 -5.265 -15.827 1.00 73.00 C ATOM 1587 C ALA A 112 -14.823 -5.227 -14.800 1.00 64.51 C ATOM 1588 O ALA A 112 -15.656 -6.127 -14.742 1.00 54.25 O ATOM 1589 CB ALA A 112 -14.297 -5.196 -17.226 1.00 73.31 C ATOM 0 H ALA A 112 -13.433 -7.327 -15.850 1.00 62.32 H new ATOM 0 HA ALA A 112 -13.072 -4.399 -15.698 1.00 73.00 H new ATOM 0 HB1 ALA A 112 -14.883 -4.283 -17.334 1.00 73.31 H new ATOM 0 HB2 ALA A 112 -13.486 -5.194 -17.954 1.00 73.31 H new ATOM 0 HB3 ALA A 112 -14.938 -6.061 -17.399 1.00 73.31 H new ATOM 1595 N VAL A 113 -14.827 -4.209 -13.990 1.00 2.01 N ATOM 1596 CA VAL A 113 -15.809 -4.086 -12.932 1.00 25.21 C ATOM 1597 C VAL A 113 -16.392 -2.686 -12.922 1.00 32.45 C ATOM 1598 O VAL A 113 -15.946 -1.813 -13.679 1.00 50.23 O ATOM 1599 CB VAL A 113 -15.207 -4.385 -11.522 1.00 74.51 C ATOM 1600 CG1 VAL A 113 -14.616 -5.784 -11.441 1.00 24.55 C ATOM 1601 CG2 VAL A 113 -14.172 -3.343 -11.135 1.00 12.42 C ATOM 0 H VAL A 113 -14.158 -3.441 -14.036 1.00 2.01 H new ATOM 0 HA VAL A 113 -16.584 -4.825 -13.136 1.00 25.21 H new ATOM 0 HB VAL A 113 -16.029 -4.334 -10.808 1.00 74.51 H new ATOM 0 HG11 VAL A 113 -14.209 -5.950 -10.444 1.00 24.55 H new ATOM 0 HG12 VAL A 113 -15.394 -6.520 -11.642 1.00 24.55 H new ATOM 0 HG13 VAL A 113 -13.821 -5.886 -12.179 1.00 24.55 H new ATOM 0 HG21 VAL A 113 -13.771 -3.577 -10.149 1.00 12.42 H new ATOM 0 HG22 VAL A 113 -13.363 -3.345 -11.866 1.00 12.42 H new ATOM 0 HG23 VAL A 113 -14.638 -2.358 -11.112 1.00 12.42 H new ATOM 1611 N LYS A 114 -17.386 -2.472 -12.100 1.00 61.42 N ATOM 1612 CA LYS A 114 -17.935 -1.147 -11.924 1.00 40.30 C ATOM 1613 C LYS A 114 -17.313 -0.513 -10.710 1.00 15.50 C ATOM 1614 O LYS A 114 -16.834 -1.202 -9.820 1.00 44.52 O ATOM 1615 CB LYS A 114 -19.478 -1.136 -11.757 1.00 25.43 C ATOM 1616 CG LYS A 114 -20.305 -1.506 -12.987 1.00 35.25 C ATOM 1617 CD LYS A 114 -20.135 -2.948 -13.401 1.00 53.54 C ATOM 1618 CE LYS A 114 -20.996 -3.276 -14.604 1.00 12.23 C ATOM 1619 NZ LYS A 114 -20.636 -2.469 -15.787 1.00 20.51 N ATOM 0 H LYS A 114 -17.834 -3.197 -11.540 1.00 61.42 H new ATOM 0 HA LYS A 114 -17.705 -0.588 -12.831 1.00 40.30 H new ATOM 0 HB2 LYS A 114 -19.738 -1.824 -10.953 1.00 25.43 H new ATOM 0 HB3 LYS A 114 -19.778 -0.139 -11.433 1.00 25.43 H new ATOM 0 HG2 LYS A 114 -21.358 -1.315 -12.781 1.00 35.25 H new ATOM 0 HG3 LYS A 114 -20.020 -0.860 -13.817 1.00 35.25 H new ATOM 0 HD2 LYS A 114 -19.088 -3.141 -13.636 1.00 53.54 H new ATOM 0 HD3 LYS A 114 -20.401 -3.602 -12.570 1.00 53.54 H new ATOM 0 HE2 LYS A 114 -20.893 -4.334 -14.844 1.00 12.23 H new ATOM 0 HE3 LYS A 114 -22.044 -3.106 -14.356 1.00 12.23 H new ATOM 0 HZ1 LYS A 114 -21.075 -2.881 -16.635 1.00 20.51 H new ATOM 0 HZ2 LYS A 114 -20.977 -1.495 -15.659 1.00 20.51 H new ATOM 0 HZ3 LYS A 114 -19.602 -2.462 -15.901 1.00 20.51 H new ATOM 1633 N THR A 115 -17.293 0.768 -10.687 1.00 12.30 N ATOM 1634 CA THR A 115 -16.844 1.499 -9.554 1.00 44.40 C ATOM 1635 C THR A 115 -17.508 2.852 -9.626 1.00 11.32 C ATOM 1636 O THR A 115 -18.173 3.169 -10.635 1.00 65.24 O ATOM 1637 CB THR A 115 -15.288 1.649 -9.509 1.00 34.21 C ATOM 1638 OG1 THR A 115 -14.881 2.149 -8.222 1.00 74.22 O ATOM 1639 CG2 THR A 115 -14.807 2.624 -10.571 1.00 41.23 C ATOM 0 H THR A 115 -17.593 1.352 -11.468 1.00 12.30 H new ATOM 0 HA THR A 115 -17.111 0.965 -8.642 1.00 44.40 H new ATOM 0 HB THR A 115 -14.853 0.667 -9.692 1.00 34.21 H new ATOM 0 HG1 THR A 115 -15.023 1.457 -7.543 1.00 74.22 H new ATOM 0 HG21 THR A 115 -13.722 2.712 -10.520 1.00 41.23 H new ATOM 0 HG22 THR A 115 -15.096 2.260 -11.557 1.00 41.23 H new ATOM 0 HG23 THR A 115 -15.258 3.601 -10.399 1.00 41.23 H new ATOM 1647 N TYR A 116 -17.365 3.623 -8.611 1.00 43.33 N ATOM 1648 CA TYR A 116 -17.955 4.908 -8.577 1.00 64.32 C ATOM 1649 C TYR A 116 -16.871 5.943 -8.627 1.00 53.41 C ATOM 1650 O TYR A 116 -15.990 5.991 -7.769 1.00 30.32 O ATOM 1651 CB TYR A 116 -18.884 5.049 -7.379 1.00 44.13 C ATOM 1652 CG TYR A 116 -20.017 4.050 -7.436 1.00 15.12 C ATOM 1653 CD1 TYR A 116 -19.876 2.770 -6.908 1.00 51.51 C ATOM 1654 CD2 TYR A 116 -21.215 4.374 -8.050 1.00 43.00 C ATOM 1655 CE1 TYR A 116 -20.897 1.847 -7.000 1.00 23.54 C ATOM 1656 CE2 TYR A 116 -22.240 3.460 -8.135 1.00 11.12 C ATOM 1657 CZ TYR A 116 -22.077 2.197 -7.613 1.00 5.32 C ATOM 1658 OH TYR A 116 -23.090 1.274 -7.727 1.00 61.40 O ATOM 0 H TYR A 116 -16.832 3.378 -7.776 1.00 43.33 H new ATOM 0 HA TYR A 116 -18.589 5.059 -9.450 1.00 64.32 H new ATOM 0 HB2 TYR A 116 -18.317 4.906 -6.459 1.00 44.13 H new ATOM 0 HB3 TYR A 116 -19.290 6.060 -7.349 1.00 44.13 H new ATOM 0 HD1 TYR A 116 -18.953 2.495 -6.419 1.00 51.51 H new ATOM 0 HD2 TYR A 116 -21.347 5.361 -8.469 1.00 43.00 H new ATOM 0 HE1 TYR A 116 -20.770 0.855 -6.593 1.00 23.54 H new ATOM 0 HE2 TYR A 116 -23.171 3.733 -8.610 1.00 11.12 H new ATOM 0 HH TYR A 116 -22.807 0.427 -7.324 1.00 61.40 H new ATOM 1668 N MET A 117 -16.926 6.744 -9.640 1.00 32.44 N ATOM 1669 CA MET A 117 -15.900 7.702 -9.918 1.00 21.31 C ATOM 1670 C MET A 117 -16.372 9.083 -9.568 1.00 34.54 C ATOM 1671 O MET A 117 -17.565 9.399 -9.706 1.00 74.30 O ATOM 1672 CB MET A 117 -15.523 7.619 -11.407 1.00 32.42 C ATOM 1673 CG MET A 117 -14.510 8.655 -11.884 1.00 1.15 C ATOM 1674 SD MET A 117 -14.073 8.463 -13.627 1.00 51.34 S ATOM 1675 CE MET A 117 -15.692 8.515 -14.383 1.00 44.41 C ATOM 0 H MET A 117 -17.695 6.754 -10.310 1.00 32.44 H new ATOM 0 HA MET A 117 -15.020 7.482 -9.313 1.00 21.31 H new ATOM 0 HB2 MET A 117 -15.123 6.625 -11.608 1.00 32.42 H new ATOM 0 HB3 MET A 117 -16.431 7.723 -12.001 1.00 32.42 H new ATOM 0 HG2 MET A 117 -14.917 9.654 -11.725 1.00 1.15 H new ATOM 0 HG3 MET A 117 -13.607 8.579 -11.278 1.00 1.15 H new ATOM 0 HE1 MET A 117 -15.888 7.570 -14.889 1.00 44.41 H new ATOM 0 HE2 MET A 117 -16.447 8.678 -13.614 1.00 44.41 H new ATOM 0 HE3 MET A 117 -15.730 9.329 -15.107 1.00 44.41 H new ATOM 1685 N TRP A 118 -15.451 9.893 -9.100 1.00 54.22 N ATOM 1686 CA TRP A 118 -15.731 11.241 -8.738 1.00 61.40 C ATOM 1687 C TRP A 118 -15.950 12.029 -10.012 1.00 52.40 C ATOM 1688 O TRP A 118 -15.112 12.022 -10.937 1.00 5.41 O ATOM 1689 CB TRP A 118 -14.588 11.786 -7.888 1.00 55.25 C ATOM 1690 CG TRP A 118 -14.800 13.160 -7.324 1.00 2.13 C ATOM 1691 CD1 TRP A 118 -14.124 14.276 -7.651 1.00 22.31 C ATOM 1692 CD2 TRP A 118 -15.754 13.552 -6.329 1.00 31.54 C ATOM 1693 NE1 TRP A 118 -14.589 15.346 -6.937 1.00 4.31 N ATOM 1694 CE2 TRP A 118 -15.589 14.932 -6.118 1.00 23.41 C ATOM 1695 CE3 TRP A 118 -16.729 12.877 -5.604 1.00 23.43 C ATOM 1696 CZ2 TRP A 118 -16.363 15.646 -5.210 1.00 61.31 C ATOM 1697 CZ3 TRP A 118 -17.494 13.580 -4.706 1.00 2.44 C ATOM 1698 CH2 TRP A 118 -17.310 14.952 -4.516 1.00 72.21 C ATOM 0 H TRP A 118 -14.478 9.620 -8.963 1.00 54.22 H new ATOM 0 HA TRP A 118 -16.633 11.319 -8.132 1.00 61.40 H new ATOM 0 HB2 TRP A 118 -14.412 11.097 -7.062 1.00 55.25 H new ATOM 0 HB3 TRP A 118 -13.682 11.797 -8.493 1.00 55.25 H new ATOM 0 HD1 TRP A 118 -13.325 14.321 -8.376 1.00 22.31 H new ATOM 0 HE1 TRP A 118 -14.240 16.302 -7.009 1.00 4.31 H new ATOM 0 HE3 TRP A 118 -16.882 11.817 -5.745 1.00 23.43 H new ATOM 0 HZ2 TRP A 118 -16.220 16.706 -5.061 1.00 61.31 H new ATOM 0 HZ3 TRP A 118 -18.252 13.063 -4.136 1.00 2.44 H new ATOM 0 HH2 TRP A 118 -17.931 15.474 -3.804 1.00 72.21 H new ATOM 1709 N ILE A 119 -17.074 12.659 -10.072 1.00 61.24 N ATOM 1710 CA ILE A 119 -17.538 13.306 -11.257 1.00 71.33 C ATOM 1711 C ILE A 119 -16.746 14.577 -11.550 1.00 75.31 C ATOM 1712 O ILE A 119 -16.372 14.823 -12.699 1.00 72.02 O ATOM 1713 CB ILE A 119 -19.043 13.609 -11.128 1.00 31.42 C ATOM 1714 CG1 ILE A 119 -19.764 12.315 -10.733 1.00 72.44 C ATOM 1715 CG2 ILE A 119 -19.583 14.117 -12.454 1.00 42.44 C ATOM 1716 CD1 ILE A 119 -21.222 12.482 -10.424 1.00 73.01 C ATOM 0 H ILE A 119 -17.712 12.742 -9.281 1.00 61.24 H new ATOM 0 HA ILE A 119 -17.383 12.633 -12.100 1.00 71.33 H new ATOM 0 HB ILE A 119 -19.207 14.375 -10.370 1.00 31.42 H new ATOM 0 HG12 ILE A 119 -19.658 11.594 -11.543 1.00 72.44 H new ATOM 0 HG13 ILE A 119 -19.268 11.890 -9.861 1.00 72.44 H new ATOM 0 HG21 ILE A 119 -20.648 14.329 -12.356 1.00 42.44 H new ATOM 0 HG22 ILE A 119 -19.056 15.028 -12.736 1.00 42.44 H new ATOM 0 HG23 ILE A 119 -19.434 13.358 -13.222 1.00 42.44 H new ATOM 0 HD11 ILE A 119 -21.650 11.516 -10.155 1.00 73.01 H new ATOM 0 HD12 ILE A 119 -21.340 13.176 -9.592 1.00 73.01 H new ATOM 0 HD13 ILE A 119 -21.737 12.875 -11.300 1.00 73.01 H new ATOM 1728 N ASN A 120 -16.452 15.342 -10.523 1.00 43.33 N ATOM 1729 CA ASN A 120 -15.719 16.597 -10.688 1.00 42.01 C ATOM 1730 C ASN A 120 -14.219 16.315 -10.797 1.00 61.14 C ATOM 1731 O ASN A 120 -13.562 16.051 -9.822 1.00 32.44 O ATOM 1732 CB ASN A 120 -16.008 17.541 -9.515 1.00 20.13 C ATOM 1733 CG ASN A 120 -15.386 18.909 -9.691 1.00 50.13 C ATOM 1734 OD1 ASN A 120 -15.232 19.406 -10.807 1.00 22.42 O ATOM 1735 ND2 ASN A 120 -15.035 19.534 -8.603 1.00 54.24 N ATOM 0 H ASN A 120 -16.706 15.125 -9.559 1.00 43.33 H new ATOM 0 HA ASN A 120 -16.050 17.083 -11.606 1.00 42.01 H new ATOM 0 HB2 ASN A 120 -17.086 17.650 -9.401 1.00 20.13 H new ATOM 0 HB3 ASN A 120 -15.634 17.093 -8.594 1.00 20.13 H new ATOM 0 HD21 ASN A 120 -14.619 20.463 -8.660 1.00 54.24 H new ATOM 0 HD22 ASN A 120 -15.176 19.094 -7.694 1.00 54.24 H new ATOM 1742 N LYS A 121 -13.696 16.363 -11.993 1.00 64.15 N ATOM 1743 CA LYS A 121 -12.307 15.979 -12.236 1.00 11.53 C ATOM 1744 C LYS A 121 -11.322 17.035 -11.755 1.00 11.22 C ATOM 1745 O LYS A 121 -10.175 16.724 -11.420 1.00 21.21 O ATOM 1746 CB LYS A 121 -12.091 15.685 -13.712 1.00 74.42 C ATOM 1747 CG LYS A 121 -13.027 14.630 -14.277 1.00 60.41 C ATOM 1748 CD LYS A 121 -12.902 13.305 -13.548 1.00 24.13 C ATOM 1749 CE LYS A 121 -13.819 12.259 -14.158 1.00 22.43 C ATOM 1750 NZ LYS A 121 -15.239 12.667 -14.121 1.00 33.04 N ATOM 0 H LYS A 121 -14.203 16.664 -12.826 1.00 64.15 H new ATOM 0 HA LYS A 121 -12.116 15.075 -11.657 1.00 11.53 H new ATOM 0 HB2 LYS A 121 -12.217 16.608 -14.278 1.00 74.42 H new ATOM 0 HB3 LYS A 121 -11.061 15.359 -13.860 1.00 74.42 H new ATOM 0 HG2 LYS A 121 -14.055 14.985 -14.209 1.00 60.41 H new ATOM 0 HG3 LYS A 121 -12.810 14.483 -15.335 1.00 60.41 H new ATOM 0 HD2 LYS A 121 -11.870 12.958 -13.591 1.00 24.13 H new ATOM 0 HD3 LYS A 121 -13.149 13.441 -12.495 1.00 24.13 H new ATOM 0 HE2 LYS A 121 -13.522 12.077 -15.191 1.00 22.43 H new ATOM 0 HE3 LYS A 121 -13.700 11.318 -13.622 1.00 22.43 H new ATOM 0 HZ1 LYS A 121 -15.823 11.863 -13.816 1.00 33.04 H new ATOM 0 HZ2 LYS A 121 -15.357 13.454 -13.452 1.00 33.04 H new ATOM 0 HZ3 LYS A 121 -15.538 12.972 -15.070 1.00 33.04 H new ATOM 1764 N ALA A 122 -11.742 18.265 -11.750 1.00 12.31 N ATOM 1765 CA ALA A 122 -10.917 19.331 -11.258 1.00 11.33 C ATOM 1766 C ALA A 122 -11.462 19.786 -9.930 1.00 12.02 C ATOM 1767 O ALA A 122 -12.379 20.601 -9.877 1.00 12.44 O ATOM 1768 CB ALA A 122 -10.851 20.488 -12.250 1.00 41.01 C ATOM 0 H ALA A 122 -12.660 18.558 -12.084 1.00 12.31 H new ATOM 0 HA ALA A 122 -9.897 18.968 -11.131 1.00 11.33 H new ATOM 0 HB1 ALA A 122 -10.218 21.278 -11.846 1.00 41.01 H new ATOM 0 HB2 ALA A 122 -10.434 20.135 -13.193 1.00 41.01 H new ATOM 0 HB3 ALA A 122 -11.854 20.878 -12.421 1.00 41.01 H new ATOM 1774 N ASP A 123 -10.938 19.240 -8.863 1.00 75.14 N ATOM 1775 CA ASP A 123 -11.457 19.535 -7.539 1.00 32.52 C ATOM 1776 C ASP A 123 -10.320 19.732 -6.544 1.00 71.43 C ATOM 1777 O ASP A 123 -9.437 18.876 -6.424 1.00 10.41 O ATOM 1778 CB ASP A 123 -12.372 18.403 -7.068 1.00 3.11 C ATOM 1779 CG ASP A 123 -13.060 18.721 -5.783 1.00 30.32 C ATOM 1780 OD1 ASP A 123 -12.451 18.554 -4.716 1.00 61.12 O ATOM 1781 OD2 ASP A 123 -14.228 19.157 -5.842 1.00 21.15 O ATOM 0 H ASP A 123 -10.153 18.589 -8.878 1.00 75.14 H new ATOM 0 HA ASP A 123 -12.031 20.460 -7.595 1.00 32.52 H new ATOM 0 HB2 ASP A 123 -13.119 18.201 -7.836 1.00 3.11 H new ATOM 0 HB3 ASP A 123 -11.785 17.493 -6.946 1.00 3.11 H new ATOM 1786 N PRO A 124 -10.304 20.865 -5.831 1.00 40.52 N ATOM 1787 CA PRO A 124 -9.260 21.165 -4.862 1.00 51.21 C ATOM 1788 C PRO A 124 -9.544 20.615 -3.451 1.00 13.03 C ATOM 1789 O PRO A 124 -8.657 20.623 -2.596 1.00 73.50 O ATOM 1790 CB PRO A 124 -9.261 22.690 -4.843 1.00 21.13 C ATOM 1791 CG PRO A 124 -10.692 23.061 -5.065 1.00 65.03 C ATOM 1792 CD PRO A 124 -11.290 21.971 -5.931 1.00 62.12 C ATOM 0 HA PRO A 124 -8.311 20.705 -5.138 1.00 51.21 H new ATOM 0 HB2 PRO A 124 -8.893 23.076 -3.893 1.00 21.13 H new ATOM 0 HB3 PRO A 124 -8.619 23.098 -5.623 1.00 21.13 H new ATOM 0 HG2 PRO A 124 -11.224 23.139 -4.117 1.00 65.03 H new ATOM 0 HG3 PRO A 124 -10.770 24.032 -5.555 1.00 65.03 H new ATOM 0 HD2 PRO A 124 -12.272 21.666 -5.570 1.00 62.12 H new ATOM 0 HD3 PRO A 124 -11.418 22.302 -6.962 1.00 62.12 H new ATOM 1800 N ASP A 125 -10.755 20.118 -3.212 1.00 13.33 N ATOM 1801 CA ASP A 125 -11.131 19.652 -1.874 1.00 12.31 C ATOM 1802 C ASP A 125 -10.614 18.276 -1.622 1.00 2.23 C ATOM 1803 O ASP A 125 -10.224 17.942 -0.503 1.00 21.11 O ATOM 1804 CB ASP A 125 -12.653 19.669 -1.634 1.00 44.34 C ATOM 1805 CG ASP A 125 -13.264 21.044 -1.637 1.00 21.02 C ATOM 1806 OD1 ASP A 125 -13.051 21.802 -0.674 1.00 41.22 O ATOM 1807 OD2 ASP A 125 -13.984 21.388 -2.584 1.00 2.12 O ATOM 0 H ASP A 125 -11.487 20.027 -3.916 1.00 13.33 H new ATOM 0 HA ASP A 125 -10.675 20.356 -1.177 1.00 12.31 H new ATOM 0 HB2 ASP A 125 -13.137 19.067 -2.403 1.00 44.34 H new ATOM 0 HB3 ASP A 125 -12.864 19.192 -0.677 1.00 44.34 H new ATOM 1812 N MET A 126 -10.589 17.470 -2.657 1.00 31.32 N ATOM 1813 CA MET A 126 -10.131 16.101 -2.521 1.00 33.11 C ATOM 1814 C MET A 126 -8.611 16.025 -2.453 1.00 64.12 C ATOM 1815 O MET A 126 -8.066 14.991 -2.119 1.00 42.32 O ATOM 1816 CB MET A 126 -10.641 15.260 -3.689 1.00 74.12 C ATOM 1817 CG MET A 126 -10.155 15.746 -5.043 1.00 24.33 C ATOM 1818 SD MET A 126 -10.820 14.813 -6.423 1.00 61.20 S ATOM 1819 CE MET A 126 -10.064 15.706 -7.773 1.00 5.11 C ATOM 0 H MET A 126 -10.878 17.733 -3.599 1.00 31.32 H new ATOM 0 HA MET A 126 -10.530 15.707 -1.587 1.00 33.11 H new ATOM 0 HB2 MET A 126 -10.324 14.227 -3.548 1.00 74.12 H new ATOM 0 HB3 MET A 126 -11.731 15.264 -3.680 1.00 74.12 H new ATOM 0 HG2 MET A 126 -10.425 16.795 -5.161 1.00 24.33 H new ATOM 0 HG3 MET A 126 -9.067 15.692 -5.070 1.00 24.33 H new ATOM 0 HE1 MET A 126 -10.841 16.136 -8.405 1.00 5.11 H new ATOM 0 HE2 MET A 126 -9.437 16.504 -7.375 1.00 5.11 H new ATOM 0 HE3 MET A 126 -9.452 15.024 -8.363 1.00 5.11 H new ATOM 1829 N PHE A 127 -7.943 17.139 -2.751 1.00 2.00 N ATOM 1830 CA PHE A 127 -6.488 17.178 -2.836 1.00 64.40 C ATOM 1831 C PHE A 127 -5.799 16.758 -1.526 1.00 61.35 C ATOM 1832 O PHE A 127 -5.783 17.501 -0.535 1.00 75.33 O ATOM 1833 CB PHE A 127 -5.992 18.557 -3.311 1.00 31.44 C ATOM 1834 CG PHE A 127 -4.495 18.636 -3.504 1.00 44.32 C ATOM 1835 CD1 PHE A 127 -3.908 18.128 -4.654 1.00 73.32 C ATOM 1836 CD2 PHE A 127 -3.679 19.204 -2.536 1.00 3.34 C ATOM 1837 CE1 PHE A 127 -2.539 18.188 -4.837 1.00 64.21 C ATOM 1838 CE2 PHE A 127 -2.310 19.264 -2.713 1.00 22.42 C ATOM 1839 CZ PHE A 127 -1.738 18.756 -3.865 1.00 32.24 C ATOM 0 H PHE A 127 -8.395 18.034 -2.939 1.00 2.00 H new ATOM 0 HA PHE A 127 -6.204 16.438 -3.584 1.00 64.40 H new ATOM 0 HB2 PHE A 127 -6.483 18.805 -4.252 1.00 31.44 H new ATOM 0 HB3 PHE A 127 -6.295 19.311 -2.585 1.00 31.44 H new ATOM 0 HD1 PHE A 127 -4.529 17.680 -5.416 1.00 73.32 H new ATOM 0 HD2 PHE A 127 -4.119 19.604 -1.634 1.00 3.34 H new ATOM 0 HE1 PHE A 127 -2.096 17.791 -5.739 1.00 64.21 H new ATOM 0 HE2 PHE A 127 -1.686 19.708 -1.951 1.00 22.42 H new ATOM 0 HZ PHE A 127 -0.668 18.803 -4.005 1.00 32.24 H new ATOM 1849 N GLY A 128 -5.264 15.565 -1.549 1.00 11.35 N ATOM 1850 CA GLY A 128 -4.516 15.003 -0.461 1.00 40.12 C ATOM 1851 C GLY A 128 -3.803 13.793 -0.966 1.00 31.45 C ATOM 1852 O GLY A 128 -4.316 13.129 -1.875 1.00 53.22 O ATOM 0 H GLY A 128 -5.341 14.940 -2.352 1.00 11.35 H new ATOM 0 HA2 GLY A 128 -3.803 15.731 -0.073 1.00 40.12 H new ATOM 0 HA3 GLY A 128 -5.181 14.738 0.361 1.00 40.12 H new ATOM 1856 N GLU A 129 -2.639 13.503 -0.442 1.00 45.30 N ATOM 1857 CA GLU A 129 -1.890 12.358 -0.893 1.00 60.34 C ATOM 1858 C GLU A 129 -2.374 11.111 -0.197 1.00 43.51 C ATOM 1859 O GLU A 129 -2.473 11.067 1.036 1.00 22.11 O ATOM 1860 CB GLU A 129 -0.345 12.531 -0.749 1.00 43.11 C ATOM 1861 CG GLU A 129 0.184 12.830 0.662 1.00 13.43 C ATOM 1862 CD GLU A 129 -0.131 14.227 1.153 1.00 55.01 C ATOM 1863 OE1 GLU A 129 -1.256 14.475 1.623 1.00 62.45 O ATOM 1864 OE2 GLU A 129 0.751 15.101 1.083 1.00 53.12 O ATOM 0 H GLU A 129 -2.190 14.044 0.297 1.00 45.30 H new ATOM 0 HA GLU A 129 -2.074 12.261 -1.963 1.00 60.34 H new ATOM 0 HB2 GLU A 129 0.135 11.620 -1.107 1.00 43.11 H new ATOM 0 HB3 GLU A 129 -0.029 13.338 -1.410 1.00 43.11 H new ATOM 0 HG2 GLU A 129 -0.240 12.107 1.359 1.00 13.43 H new ATOM 0 HG3 GLU A 129 1.265 12.687 0.672 1.00 13.43 H new ATOM 1871 N TRP A 130 -2.699 10.116 -0.971 1.00 63.12 N ATOM 1872 CA TRP A 130 -3.195 8.895 -0.440 1.00 65.24 C ATOM 1873 C TRP A 130 -2.041 8.063 0.139 1.00 75.14 C ATOM 1874 O TRP A 130 -0.884 8.235 -0.270 1.00 71.14 O ATOM 1875 CB TRP A 130 -3.965 8.130 -1.524 1.00 42.23 C ATOM 1876 CG TRP A 130 -4.776 7.017 -0.986 1.00 4.24 C ATOM 1877 CD1 TRP A 130 -5.449 7.017 0.187 1.00 71.22 C ATOM 1878 CD2 TRP A 130 -5.046 5.766 -1.606 1.00 42.02 C ATOM 1879 NE1 TRP A 130 -6.071 5.849 0.377 1.00 65.10 N ATOM 1880 CE2 TRP A 130 -5.859 5.047 -0.718 1.00 44.15 C ATOM 1881 CE3 TRP A 130 -4.673 5.178 -2.816 1.00 11.34 C ATOM 1882 CZ2 TRP A 130 -6.308 3.765 -0.999 1.00 71.13 C ATOM 1883 CZ3 TRP A 130 -5.123 3.905 -3.099 1.00 41.54 C ATOM 1884 CH2 TRP A 130 -5.934 3.211 -2.196 1.00 15.20 C ATOM 0 H TRP A 130 -2.625 10.136 -1.988 1.00 63.12 H new ATOM 0 HA TRP A 130 -3.888 9.105 0.375 1.00 65.24 H new ATOM 0 HB2 TRP A 130 -4.618 8.823 -2.055 1.00 42.23 H new ATOM 0 HB3 TRP A 130 -3.258 7.736 -2.254 1.00 42.23 H new ATOM 0 HD1 TRP A 130 -5.480 7.848 0.877 1.00 71.22 H new ATOM 0 HE1 TRP A 130 -6.615 5.595 1.202 1.00 65.10 H new ATOM 0 HE3 TRP A 130 -4.045 5.709 -3.516 1.00 11.34 H new ATOM 0 HZ2 TRP A 130 -6.929 3.223 -0.301 1.00 71.13 H new ATOM 0 HZ3 TRP A 130 -4.845 3.438 -4.032 1.00 41.54 H new ATOM 0 HH2 TRP A 130 -6.273 2.217 -2.447 1.00 15.20 H new ATOM 1895 N ASN A 131 -2.366 7.173 1.092 1.00 62.11 N ATOM 1896 CA ASN A 131 -1.384 6.310 1.789 1.00 71.21 C ATOM 1897 C ASN A 131 -0.500 5.619 0.783 1.00 25.25 C ATOM 1898 O ASN A 131 0.719 5.598 0.916 1.00 63.13 O ATOM 1899 CB ASN A 131 -2.074 5.192 2.606 1.00 71.33 C ATOM 1900 CG ASN A 131 -3.161 5.645 3.557 1.00 65.15 C ATOM 1901 OD1 ASN A 131 -3.895 6.589 3.283 1.00 0.11 O ATOM 1902 ND2 ASN A 131 -3.283 4.970 4.670 1.00 1.02 N ATOM 0 H ASN A 131 -3.325 7.027 1.406 1.00 62.11 H new ATOM 0 HA ASN A 131 -0.816 6.962 2.453 1.00 71.21 H new ATOM 0 HB2 ASN A 131 -2.504 4.472 1.910 1.00 71.33 H new ATOM 0 HB3 ASN A 131 -1.312 4.665 3.180 1.00 71.33 H new ATOM 0 HD21 ASN A 131 -4.006 5.223 5.343 1.00 1.02 H new ATOM 0 HD22 ASN A 131 -2.655 4.190 4.865 1.00 1.02 H new ATOM 1909 N PHE A 132 -1.137 5.071 -0.235 1.00 45.01 N ATOM 1910 CA PHE A 132 -0.461 4.335 -1.281 1.00 5.34 C ATOM 1911 C PHE A 132 0.482 5.178 -2.091 1.00 33.45 C ATOM 1912 O PHE A 132 1.467 4.673 -2.559 1.00 22.22 O ATOM 1913 CB PHE A 132 -1.429 3.556 -2.159 1.00 33.32 C ATOM 1914 CG PHE A 132 -2.075 2.408 -1.444 1.00 22.02 C ATOM 1915 CD1 PHE A 132 -3.113 2.622 -0.566 1.00 1.30 C ATOM 1916 CD2 PHE A 132 -1.639 1.112 -1.655 1.00 11.32 C ATOM 1917 CE1 PHE A 132 -3.712 1.568 0.093 1.00 52.01 C ATOM 1918 CE2 PHE A 132 -2.230 0.052 -1.001 1.00 42.24 C ATOM 1919 CZ PHE A 132 -3.269 0.280 -0.126 1.00 41.10 C ATOM 0 H PHE A 132 -2.148 5.126 -0.358 1.00 45.01 H new ATOM 0 HA PHE A 132 0.162 3.604 -0.766 1.00 5.34 H new ATOM 0 HB2 PHE A 132 -2.203 4.231 -2.524 1.00 33.32 H new ATOM 0 HB3 PHE A 132 -0.896 3.179 -3.032 1.00 33.32 H new ATOM 0 HD1 PHE A 132 -3.463 3.628 -0.390 1.00 1.30 H new ATOM 0 HD2 PHE A 132 -0.825 0.928 -2.341 1.00 11.32 H new ATOM 0 HE1 PHE A 132 -4.526 1.751 0.779 1.00 52.01 H new ATOM 0 HE2 PHE A 132 -1.879 -0.955 -1.174 1.00 42.24 H new ATOM 0 HZ PHE A 132 -3.736 -0.548 0.387 1.00 41.10 H new ATOM 1929 N GLU A 133 0.178 6.458 -2.265 1.00 52.14 N ATOM 1930 CA GLU A 133 1.084 7.354 -2.980 1.00 64.04 C ATOM 1931 C GLU A 133 2.350 7.557 -2.175 1.00 21.43 C ATOM 1932 O GLU A 133 3.465 7.485 -2.712 1.00 51.11 O ATOM 1933 CB GLU A 133 0.457 8.713 -3.236 1.00 21.25 C ATOM 1934 CG GLU A 133 -0.748 8.711 -4.138 1.00 15.21 C ATOM 1935 CD GLU A 133 -1.230 10.112 -4.385 1.00 4.40 C ATOM 1936 OE1 GLU A 133 -0.660 10.797 -5.280 1.00 23.34 O ATOM 1937 OE2 GLU A 133 -2.159 10.561 -3.691 1.00 50.12 O ATOM 0 H GLU A 133 -0.678 6.897 -1.926 1.00 52.14 H new ATOM 0 HA GLU A 133 1.305 6.886 -3.939 1.00 64.04 H new ATOM 0 HB2 GLU A 133 0.172 9.148 -2.278 1.00 21.25 H new ATOM 0 HB3 GLU A 133 1.213 9.367 -3.670 1.00 21.25 H new ATOM 0 HG2 GLU A 133 -0.498 8.235 -5.086 1.00 15.21 H new ATOM 0 HG3 GLU A 133 -1.546 8.121 -3.686 1.00 15.21 H new ATOM 1944 N GLU A 134 2.170 7.801 -0.886 1.00 15.52 N ATOM 1945 CA GLU A 134 3.281 8.003 0.024 1.00 5.51 C ATOM 1946 C GLU A 134 4.091 6.714 0.109 1.00 1.51 C ATOM 1947 O GLU A 134 5.314 6.726 0.061 1.00 51.22 O ATOM 1948 CB GLU A 134 2.761 8.384 1.412 1.00 65.31 C ATOM 1949 CG GLU A 134 3.849 8.763 2.413 1.00 44.24 C ATOM 1950 CD GLU A 134 4.552 10.069 2.066 1.00 1.11 C ATOM 1951 OE1 GLU A 134 5.523 10.059 1.283 1.00 0.22 O ATOM 1952 OE2 GLU A 134 4.130 11.136 2.593 1.00 12.22 O ATOM 0 H GLU A 134 1.252 7.864 -0.445 1.00 15.52 H new ATOM 0 HA GLU A 134 3.912 8.811 -0.344 1.00 5.51 H new ATOM 0 HB2 GLU A 134 2.071 9.221 1.310 1.00 65.31 H new ATOM 0 HB3 GLU A 134 2.190 7.547 1.815 1.00 65.31 H new ATOM 0 HG2 GLU A 134 3.407 8.848 3.406 1.00 44.24 H new ATOM 0 HG3 GLU A 134 4.586 7.962 2.460 1.00 44.24 H new ATOM 1959 N TRP A 135 3.392 5.597 0.205 1.00 52.05 N ATOM 1960 CA TRP A 135 4.038 4.314 0.259 1.00 43.24 C ATOM 1961 C TRP A 135 4.729 3.989 -1.061 1.00 35.43 C ATOM 1962 O TRP A 135 5.801 3.454 -1.061 1.00 61.33 O ATOM 1963 CB TRP A 135 3.065 3.199 0.690 1.00 10.23 C ATOM 1964 CG TRP A 135 3.696 1.832 0.723 1.00 52.52 C ATOM 1965 CD1 TRP A 135 3.288 0.723 0.036 1.00 41.21 C ATOM 1966 CD2 TRP A 135 4.876 1.444 1.447 1.00 70.11 C ATOM 1967 NE1 TRP A 135 4.123 -0.332 0.312 1.00 61.50 N ATOM 1968 CE2 TRP A 135 5.107 0.087 1.170 1.00 30.44 C ATOM 1969 CE3 TRP A 135 5.754 2.114 2.311 1.00 24.04 C ATOM 1970 CZ2 TRP A 135 6.176 -0.611 1.717 1.00 73.20 C ATOM 1971 CZ3 TRP A 135 6.815 1.418 2.850 1.00 52.42 C ATOM 1972 CH2 TRP A 135 7.017 0.068 2.553 1.00 62.11 C ATOM 0 H TRP A 135 2.373 5.561 0.247 1.00 52.05 H new ATOM 0 HA TRP A 135 4.810 4.368 1.026 1.00 43.24 H new ATOM 0 HB2 TRP A 135 2.672 3.433 1.679 1.00 10.23 H new ATOM 0 HB3 TRP A 135 2.217 3.183 0.005 1.00 10.23 H new ATOM 0 HD1 TRP A 135 2.435 0.682 -0.626 1.00 41.21 H new ATOM 0 HE1 TRP A 135 4.027 -1.276 -0.062 1.00 61.50 H new ATOM 0 HE3 TRP A 135 5.602 3.156 2.550 1.00 24.04 H new ATOM 0 HZ2 TRP A 135 6.337 -1.654 1.489 1.00 73.20 H new ATOM 0 HZ3 TRP A 135 7.501 1.925 3.513 1.00 52.42 H new ATOM 0 HH2 TRP A 135 7.856 -0.450 2.994 1.00 62.11 H new ATOM 1983 N LYS A 136 4.111 4.363 -2.171 1.00 61.24 N ATOM 1984 CA LYS A 136 4.648 4.145 -3.532 1.00 2.13 C ATOM 1985 C LYS A 136 6.047 4.766 -3.661 1.00 2.12 C ATOM 1986 O LYS A 136 6.919 4.247 -4.370 1.00 71.20 O ATOM 1987 CB LYS A 136 3.669 4.766 -4.540 1.00 62.54 C ATOM 1988 CG LYS A 136 3.998 4.618 -6.005 1.00 22.40 C ATOM 1989 CD LYS A 136 2.865 5.207 -6.833 1.00 62.10 C ATOM 1990 CE LYS A 136 3.114 5.114 -8.323 1.00 65.33 C ATOM 1991 NZ LYS A 136 1.955 5.626 -9.089 1.00 5.01 N ATOM 0 H LYS A 136 3.207 4.835 -2.166 1.00 61.24 H new ATOM 0 HA LYS A 136 4.748 3.078 -3.733 1.00 2.13 H new ATOM 0 HB2 LYS A 136 2.686 4.328 -4.369 1.00 62.54 H new ATOM 0 HB3 LYS A 136 3.587 5.830 -4.319 1.00 62.54 H new ATOM 0 HG2 LYS A 136 4.934 5.127 -6.233 1.00 22.40 H new ATOM 0 HG3 LYS A 136 4.138 3.566 -6.254 1.00 22.40 H new ATOM 0 HD2 LYS A 136 1.938 4.688 -6.592 1.00 62.10 H new ATOM 0 HD3 LYS A 136 2.726 6.252 -6.558 1.00 62.10 H new ATOM 0 HE2 LYS A 136 4.006 5.684 -8.582 1.00 65.33 H new ATOM 0 HE3 LYS A 136 3.307 4.077 -8.599 1.00 65.33 H new ATOM 0 HZ1 LYS A 136 2.068 5.383 -10.094 1.00 5.01 H new ATOM 0 HZ2 LYS A 136 1.081 5.196 -8.725 1.00 5.01 H new ATOM 0 HZ3 LYS A 136 1.901 6.660 -8.987 1.00 5.01 H new ATOM 2005 N ARG A 137 6.244 5.840 -2.938 1.00 72.13 N ATOM 2006 CA ARG A 137 7.507 6.539 -2.863 1.00 62.33 C ATOM 2007 C ARG A 137 8.583 5.675 -2.196 1.00 25.23 C ATOM 2008 O ARG A 137 9.666 5.472 -2.753 1.00 73.31 O ATOM 2009 CB ARG A 137 7.282 7.800 -2.063 1.00 53.30 C ATOM 2010 CG ARG A 137 8.520 8.535 -1.641 1.00 1.12 C ATOM 2011 CD ARG A 137 8.118 9.738 -0.826 1.00 53.14 C ATOM 2012 NE ARG A 137 9.246 10.485 -0.291 1.00 4.21 N ATOM 2013 CZ ARG A 137 9.162 11.236 0.814 1.00 53.42 C ATOM 2014 NH1 ARG A 137 8.020 11.269 1.520 1.00 12.13 N ATOM 2015 NH2 ARG A 137 10.214 11.935 1.228 1.00 33.21 N ATOM 0 H ARG A 137 5.512 6.265 -2.369 1.00 72.13 H new ATOM 0 HA ARG A 137 7.860 6.773 -3.868 1.00 62.33 H new ATOM 0 HB2 ARG A 137 6.664 8.477 -2.653 1.00 53.30 H new ATOM 0 HB3 ARG A 137 6.712 7.544 -1.170 1.00 53.30 H new ATOM 0 HG2 ARG A 137 9.166 7.881 -1.055 1.00 1.12 H new ATOM 0 HG3 ARG A 137 9.091 8.846 -2.516 1.00 1.12 H new ATOM 0 HD2 ARG A 137 7.516 10.401 -1.447 1.00 53.14 H new ATOM 0 HD3 ARG A 137 7.485 9.412 -0.001 1.00 53.14 H new ATOM 0 HE ARG A 137 10.140 10.434 -0.779 1.00 4.21 H new ATOM 0 HH11 ARG A 137 7.216 10.721 1.214 1.00 12.13 H new ATOM 0 HH12 ARG A 137 7.957 11.842 2.362 1.00 12.13 H new ATOM 0 HH21 ARG A 137 11.088 11.900 0.703 1.00 33.21 H new ATOM 0 HH22 ARG A 137 10.147 12.506 2.070 1.00 33.21 H new ATOM 2029 N LEU A 138 8.277 5.147 -1.025 1.00 65.32 N ATOM 2030 CA LEU A 138 9.233 4.320 -0.284 1.00 71.03 C ATOM 2031 C LEU A 138 9.272 2.913 -0.847 1.00 1.53 C ATOM 2032 O LEU A 138 10.229 2.170 -0.653 1.00 74.43 O ATOM 2033 CB LEU A 138 8.927 4.288 1.230 1.00 45.32 C ATOM 2034 CG LEU A 138 9.097 5.597 2.039 1.00 1.42 C ATOM 2035 CD1 LEU A 138 10.485 6.182 1.872 1.00 3.12 C ATOM 2036 CD2 LEU A 138 8.018 6.624 1.730 1.00 1.24 C ATOM 0 H LEU A 138 7.377 5.271 -0.561 1.00 65.32 H new ATOM 0 HA LEU A 138 10.215 4.778 -0.406 1.00 71.03 H new ATOM 0 HB2 LEU A 138 7.898 3.951 1.355 1.00 45.32 H new ATOM 0 HB3 LEU A 138 9.567 3.531 1.683 1.00 45.32 H new ATOM 0 HG LEU A 138 8.975 5.326 3.088 1.00 1.42 H new ATOM 0 HD11 LEU A 138 10.566 7.100 2.455 1.00 3.12 H new ATOM 0 HD12 LEU A 138 11.227 5.464 2.221 1.00 3.12 H new ATOM 0 HD13 LEU A 138 10.662 6.404 0.820 1.00 3.12 H new ATOM 0 HD21 LEU A 138 8.188 7.521 2.326 1.00 1.24 H new ATOM 0 HD22 LEU A 138 8.052 6.880 0.671 1.00 1.24 H new ATOM 0 HD23 LEU A 138 7.040 6.208 1.971 1.00 1.24 H new ATOM 2048 N HIS A 139 8.227 2.569 -1.565 1.00 3.21 N ATOM 2049 CA HIS A 139 8.096 1.274 -2.221 1.00 32.44 C ATOM 2050 C HIS A 139 9.098 1.183 -3.352 1.00 22.42 C ATOM 2051 O HIS A 139 9.508 0.096 -3.737 1.00 72.25 O ATOM 2052 CB HIS A 139 6.644 1.079 -2.722 1.00 54.12 C ATOM 2053 CG HIS A 139 6.346 -0.219 -3.420 1.00 34.34 C ATOM 2054 ND1 HIS A 139 6.197 -0.498 -4.732 1.00 72.33 N flip ATOM 2055 CD2 HIS A 139 6.127 -1.406 -2.758 1.00 22.34 C flip ATOM 2056 CE1 HIS A 139 5.892 -1.827 -4.837 1.00 41.20 C flip ATOM 2057 NE2 HIS A 139 5.857 -2.350 -3.633 1.00 53.43 N flip ATOM 0 H HIS A 139 7.429 3.186 -1.716 1.00 3.21 H new ATOM 0 HA HIS A 139 8.308 0.473 -1.513 1.00 32.44 H new ATOM 0 HB2 HIS A 139 5.973 1.169 -1.868 1.00 54.12 H new ATOM 0 HB3 HIS A 139 6.405 1.896 -3.403 1.00 54.12 H new ATOM 0 HD2 HIS A 139 6.170 -1.541 -1.687 1.00 22.34 H new ATOM 0 HE1 HIS A 139 5.710 -2.359 -5.759 1.00 41.20 H new ATOM 0 HE2 HIS A 139 5.654 -3.325 -3.413 1.00 53.43 H new ATOM 2066 N LYS A 140 9.500 2.347 -3.857 1.00 73.11 N ATOM 2067 CA LYS A 140 10.527 2.440 -4.876 1.00 33.33 C ATOM 2068 C LYS A 140 11.816 1.849 -4.351 1.00 35.42 C ATOM 2069 O LYS A 140 12.488 1.098 -5.045 1.00 2.34 O ATOM 2070 CB LYS A 140 10.759 3.906 -5.268 1.00 4.12 C ATOM 2071 CG LYS A 140 11.905 4.121 -6.263 1.00 75.54 C ATOM 2072 CD LYS A 140 12.111 5.595 -6.663 1.00 31.43 C ATOM 2073 CE LYS A 140 12.642 6.504 -5.529 1.00 35.14 C ATOM 2074 NZ LYS A 140 11.692 6.715 -4.401 1.00 71.34 N ATOM 0 H LYS A 140 9.120 3.248 -3.568 1.00 73.11 H new ATOM 0 HA LYS A 140 10.200 1.886 -5.756 1.00 33.33 H new ATOM 0 HB2 LYS A 140 9.840 4.304 -5.699 1.00 4.12 H new ATOM 0 HB3 LYS A 140 10.964 4.483 -4.366 1.00 4.12 H new ATOM 0 HG2 LYS A 140 12.829 3.740 -5.828 1.00 75.54 H new ATOM 0 HG3 LYS A 140 11.710 3.534 -7.161 1.00 75.54 H new ATOM 0 HD2 LYS A 140 12.808 5.636 -7.500 1.00 31.43 H new ATOM 0 HD3 LYS A 140 11.162 5.997 -7.018 1.00 31.43 H new ATOM 0 HE2 LYS A 140 13.561 6.070 -5.135 1.00 35.14 H new ATOM 0 HE3 LYS A 140 12.903 7.474 -5.952 1.00 35.14 H new ATOM 0 HZ1 LYS A 140 11.775 7.692 -4.055 1.00 71.34 H new ATOM 0 HZ2 LYS A 140 10.720 6.546 -4.730 1.00 71.34 H new ATOM 0 HZ3 LYS A 140 11.917 6.054 -3.630 1.00 71.34 H new ATOM 2088 N LYS A 141 12.122 2.159 -3.089 1.00 53.22 N ATOM 2089 CA LYS A 141 13.342 1.710 -2.436 1.00 15.24 C ATOM 2090 C LYS A 141 13.455 0.192 -2.448 1.00 43.25 C ATOM 2091 O LYS A 141 14.540 -0.350 -2.522 1.00 70.13 O ATOM 2092 CB LYS A 141 13.443 2.260 -1.007 1.00 5.12 C ATOM 2093 CG LYS A 141 14.705 1.830 -0.260 1.00 11.41 C ATOM 2094 CD LYS A 141 14.803 2.465 1.116 1.00 32.34 C ATOM 2095 CE LYS A 141 13.613 2.118 1.992 1.00 43.35 C ATOM 2096 NZ LYS A 141 13.742 2.689 3.344 1.00 61.43 N ATOM 0 H LYS A 141 11.524 2.732 -2.493 1.00 53.22 H new ATOM 0 HA LYS A 141 14.182 2.107 -3.006 1.00 15.24 H new ATOM 0 HB2 LYS A 141 13.410 3.349 -1.045 1.00 5.12 H new ATOM 0 HB3 LYS A 141 12.570 1.934 -0.441 1.00 5.12 H new ATOM 0 HG2 LYS A 141 14.713 0.745 -0.159 1.00 11.41 H new ATOM 0 HG3 LYS A 141 15.583 2.102 -0.847 1.00 11.41 H new ATOM 0 HD2 LYS A 141 15.720 2.133 1.603 1.00 32.34 H new ATOM 0 HD3 LYS A 141 14.872 3.548 1.011 1.00 32.34 H new ATOM 0 HE2 LYS A 141 12.699 2.488 1.527 1.00 43.35 H new ATOM 0 HE3 LYS A 141 13.518 1.034 2.063 1.00 43.35 H new ATOM 0 HZ1 LYS A 141 12.910 2.430 3.911 1.00 61.43 H new ATOM 0 HZ2 LYS A 141 14.600 2.316 3.798 1.00 61.43 H new ATOM 0 HZ3 LYS A 141 13.807 3.725 3.279 1.00 61.43 H new ATOM 2110 N LYS A 142 12.320 -0.483 -2.407 1.00 52.04 N ATOM 2111 CA LYS A 142 12.302 -1.936 -2.432 1.00 2.24 C ATOM 2112 C LYS A 142 12.921 -2.455 -3.734 1.00 52.32 C ATOM 2113 O LYS A 142 13.624 -3.471 -3.737 1.00 2.03 O ATOM 2114 CB LYS A 142 10.877 -2.470 -2.248 1.00 63.11 C ATOM 2115 CG LYS A 142 10.195 -2.013 -0.950 1.00 73.00 C ATOM 2116 CD LYS A 142 11.011 -2.379 0.293 1.00 12.42 C ATOM 2117 CE LYS A 142 11.241 -3.878 0.403 1.00 31.40 C ATOM 2118 NZ LYS A 142 12.050 -4.233 1.586 1.00 14.24 N ATOM 0 H LYS A 142 11.398 -0.049 -2.356 1.00 52.04 H new ATOM 0 HA LYS A 142 12.902 -2.302 -1.599 1.00 2.24 H new ATOM 0 HB2 LYS A 142 10.270 -2.152 -3.095 1.00 63.11 H new ATOM 0 HB3 LYS A 142 10.904 -3.560 -2.267 1.00 63.11 H new ATOM 0 HG2 LYS A 142 10.047 -0.934 -0.980 1.00 73.00 H new ATOM 0 HG3 LYS A 142 9.207 -2.469 -0.881 1.00 73.00 H new ATOM 0 HD2 LYS A 142 11.972 -1.866 0.259 1.00 12.42 H new ATOM 0 HD3 LYS A 142 10.492 -2.026 1.184 1.00 12.42 H new ATOM 0 HE2 LYS A 142 10.279 -4.388 0.456 1.00 31.40 H new ATOM 0 HE3 LYS A 142 11.742 -4.234 -0.497 1.00 31.40 H new ATOM 0 HZ1 LYS A 142 12.181 -5.264 1.620 1.00 14.24 H new ATOM 0 HZ2 LYS A 142 12.978 -3.768 1.524 1.00 14.24 H new ATOM 0 HZ3 LYS A 142 11.561 -3.917 2.448 1.00 14.24 H new ATOM 2132 N PHE A 143 12.660 -1.740 -4.826 1.00 40.03 N ATOM 2133 CA PHE A 143 13.258 -2.042 -6.124 1.00 3.01 C ATOM 2134 C PHE A 143 14.686 -1.555 -6.133 1.00 42.11 C ATOM 2135 O PHE A 143 15.578 -2.204 -6.660 1.00 51.42 O ATOM 2136 CB PHE A 143 12.504 -1.344 -7.264 1.00 45.32 C ATOM 2137 CG PHE A 143 11.074 -1.745 -7.409 1.00 10.24 C ATOM 2138 CD1 PHE A 143 10.089 -1.099 -6.696 1.00 52.03 C ATOM 2139 CD2 PHE A 143 10.717 -2.766 -8.264 1.00 60.34 C ATOM 2140 CE1 PHE A 143 8.770 -1.463 -6.830 1.00 1.22 C ATOM 2141 CE2 PHE A 143 9.399 -3.137 -8.405 1.00 73.10 C ATOM 2142 CZ PHE A 143 8.422 -2.484 -7.686 1.00 73.13 C ATOM 0 H PHE A 143 12.030 -0.938 -4.836 1.00 40.03 H new ATOM 0 HA PHE A 143 13.208 -3.120 -6.277 1.00 3.01 H new ATOM 0 HB2 PHE A 143 12.550 -0.267 -7.104 1.00 45.32 H new ATOM 0 HB3 PHE A 143 13.021 -1.550 -8.201 1.00 45.32 H new ATOM 0 HD1 PHE A 143 10.356 -0.297 -6.024 1.00 52.03 H new ATOM 0 HD2 PHE A 143 11.480 -3.280 -8.829 1.00 60.34 H new ATOM 0 HE1 PHE A 143 8.007 -0.949 -6.264 1.00 1.22 H new ATOM 0 HE2 PHE A 143 9.131 -3.938 -9.078 1.00 73.10 H new ATOM 0 HZ PHE A 143 7.387 -2.772 -7.793 1.00 73.13 H new ATOM 2152 N ILE A 144 14.889 -0.401 -5.532 1.00 13.31 N ATOM 2153 CA ILE A 144 16.192 0.232 -5.474 1.00 1.11 C ATOM 2154 C ILE A 144 17.204 -0.664 -4.758 1.00 14.44 C ATOM 2155 O ILE A 144 18.343 -0.675 -5.115 1.00 74.44 O ATOM 2156 CB ILE A 144 16.130 1.653 -4.821 1.00 30.02 C ATOM 2157 CG1 ILE A 144 15.117 2.544 -5.552 1.00 20.25 C ATOM 2158 CG2 ILE A 144 17.489 2.330 -4.803 1.00 63.33 C ATOM 2159 CD1 ILE A 144 15.374 2.715 -7.038 1.00 12.42 C ATOM 0 H ILE A 144 14.151 0.128 -5.067 1.00 13.31 H new ATOM 0 HA ILE A 144 16.528 0.371 -6.501 1.00 1.11 H new ATOM 0 HB ILE A 144 15.809 1.514 -3.789 1.00 30.02 H new ATOM 0 HG12 ILE A 144 14.121 2.124 -5.416 1.00 20.25 H new ATOM 0 HG13 ILE A 144 15.115 3.528 -5.083 1.00 20.25 H new ATOM 0 HG21 ILE A 144 17.400 3.313 -4.341 1.00 63.33 H new ATOM 0 HG22 ILE A 144 18.190 1.723 -4.231 1.00 63.33 H new ATOM 0 HG23 ILE A 144 17.854 2.440 -5.824 1.00 63.33 H new ATOM 0 HD11 ILE A 144 14.608 3.360 -7.468 1.00 12.42 H new ATOM 0 HD12 ILE A 144 16.354 3.167 -7.188 1.00 12.42 H new ATOM 0 HD13 ILE A 144 15.345 1.741 -7.527 1.00 12.42 H new ATOM 2171 N GLU A 145 16.749 -1.435 -3.775 1.00 13.25 N ATOM 2172 CA GLU A 145 17.607 -2.385 -3.034 1.00 11.41 C ATOM 2173 C GLU A 145 18.409 -3.323 -3.953 1.00 43.51 C ATOM 2174 O GLU A 145 19.585 -3.590 -3.688 1.00 72.55 O ATOM 2175 CB GLU A 145 16.776 -3.203 -2.053 1.00 34.43 C ATOM 2176 CG GLU A 145 16.255 -2.424 -0.851 1.00 72.21 C ATOM 2177 CD GLU A 145 17.360 -1.986 0.092 1.00 20.11 C ATOM 2178 OE1 GLU A 145 18.066 -2.860 0.640 1.00 51.13 O ATOM 2179 OE2 GLU A 145 17.509 -0.775 0.348 1.00 42.32 O ATOM 0 H GLU A 145 15.778 -1.427 -3.462 1.00 13.25 H new ATOM 0 HA GLU A 145 18.332 -1.780 -2.489 1.00 11.41 H new ATOM 0 HB2 GLU A 145 15.927 -3.631 -2.586 1.00 34.43 H new ATOM 0 HB3 GLU A 145 17.380 -4.036 -1.694 1.00 34.43 H new ATOM 0 HG2 GLU A 145 15.713 -1.545 -1.201 1.00 72.21 H new ATOM 0 HG3 GLU A 145 15.542 -3.042 -0.305 1.00 72.21 H new ATOM 2186 N THR A 146 17.800 -3.794 -5.038 1.00 12.44 N ATOM 2187 CA THR A 146 18.516 -4.677 -5.936 1.00 62.12 C ATOM 2188 C THR A 146 19.523 -3.860 -6.765 1.00 53.30 C ATOM 2189 O THR A 146 20.566 -4.366 -7.164 1.00 43.25 O ATOM 2190 CB THR A 146 17.571 -5.511 -6.864 1.00 34.12 C ATOM 2191 OG1 THR A 146 18.322 -6.479 -7.584 1.00 11.30 O ATOM 2192 CG2 THR A 146 16.871 -4.626 -7.866 1.00 61.14 C ATOM 0 H THR A 146 16.839 -3.583 -5.307 1.00 12.44 H new ATOM 0 HA THR A 146 19.048 -5.405 -5.323 1.00 62.12 H new ATOM 0 HB THR A 146 16.832 -5.995 -6.225 1.00 34.12 H new ATOM 0 HG1 THR A 146 17.722 -6.996 -8.160 1.00 11.30 H new ATOM 0 HG21 THR A 146 16.222 -5.233 -8.497 1.00 61.14 H new ATOM 0 HG22 THR A 146 16.273 -3.882 -7.339 1.00 61.14 H new ATOM 0 HG23 THR A 146 17.612 -4.122 -8.487 1.00 61.14 H new ATOM 2200 N PHE A 147 19.196 -2.592 -7.000 1.00 40.20 N ATOM 2201 CA PHE A 147 20.082 -1.683 -7.699 1.00 42.24 C ATOM 2202 C PHE A 147 21.190 -1.211 -6.841 1.00 55.14 C ATOM 2203 O PHE A 147 22.283 -1.035 -7.316 1.00 53.13 O ATOM 2204 CB PHE A 147 19.359 -0.498 -8.318 1.00 23.34 C ATOM 2205 CG PHE A 147 18.803 -0.796 -9.648 1.00 31.53 C ATOM 2206 CD1 PHE A 147 19.665 -0.903 -10.711 1.00 54.12 C ATOM 2207 CD2 PHE A 147 17.449 -0.966 -9.855 1.00 61.33 C ATOM 2208 CE1 PHE A 147 19.218 -1.171 -11.960 1.00 72.13 C ATOM 2209 CE2 PHE A 147 16.972 -1.240 -11.123 1.00 14.30 C ATOM 2210 CZ PHE A 147 17.859 -1.343 -12.181 1.00 72.35 C ATOM 0 H PHE A 147 18.312 -2.173 -6.710 1.00 40.20 H new ATOM 0 HA PHE A 147 20.503 -2.270 -8.515 1.00 42.24 H new ATOM 0 HB2 PHE A 147 18.553 -0.184 -7.655 1.00 23.34 H new ATOM 0 HB3 PHE A 147 20.050 0.341 -8.399 1.00 23.34 H new ATOM 0 HD1 PHE A 147 20.724 -0.770 -10.547 1.00 54.12 H new ATOM 0 HD2 PHE A 147 16.762 -0.885 -9.026 1.00 61.33 H new ATOM 0 HE1 PHE A 147 19.916 -1.251 -12.781 1.00 72.13 H new ATOM 0 HE2 PHE A 147 15.913 -1.373 -11.288 1.00 14.30 H new ATOM 0 HZ PHE A 147 17.494 -1.556 -13.175 1.00 72.35 H new ATOM 2220 N LYS A 148 20.902 -1.028 -5.566 1.00 45.13 N ATOM 2221 CA LYS A 148 21.869 -0.562 -4.602 1.00 24.12 C ATOM 2222 C LYS A 148 23.099 -1.435 -4.564 1.00 64.43 C ATOM 2223 O LYS A 148 24.201 -0.949 -4.281 1.00 43.53 O ATOM 2224 CB LYS A 148 21.247 -0.431 -3.212 1.00 63.43 C ATOM 2225 CG LYS A 148 20.251 0.704 -3.117 1.00 73.53 C ATOM 2226 CD LYS A 148 19.491 0.723 -1.796 1.00 40.11 C ATOM 2227 CE LYS A 148 20.399 0.813 -0.589 1.00 10.20 C ATOM 2228 NZ LYS A 148 19.612 0.803 0.657 1.00 52.13 N ATOM 0 H LYS A 148 19.978 -1.202 -5.171 1.00 45.13 H new ATOM 0 HA LYS A 148 22.187 0.429 -4.926 1.00 24.12 H new ATOM 0 HB2 LYS A 148 20.751 -1.366 -2.952 1.00 63.43 H new ATOM 0 HB3 LYS A 148 22.038 -0.276 -2.479 1.00 63.43 H new ATOM 0 HG2 LYS A 148 20.776 1.651 -3.241 1.00 73.53 H new ATOM 0 HG3 LYS A 148 19.539 0.624 -3.938 1.00 73.53 H new ATOM 0 HD2 LYS A 148 18.805 1.570 -1.791 1.00 40.11 H new ATOM 0 HD3 LYS A 148 18.884 -0.179 -1.720 1.00 40.11 H new ATOM 0 HE2 LYS A 148 21.098 -0.024 -0.590 1.00 10.20 H new ATOM 0 HE3 LYS A 148 20.993 1.725 -0.642 1.00 10.20 H new ATOM 0 HZ1 LYS A 148 20.245 0.644 1.466 1.00 52.13 H new ATOM 0 HZ2 LYS A 148 19.129 1.717 0.770 1.00 52.13 H new ATOM 0 HZ3 LYS A 148 18.905 0.041 0.615 1.00 52.13 H new ATOM 2242 N LYS A 149 22.940 -2.728 -4.840 1.00 40.55 N ATOM 2243 CA LYS A 149 24.108 -3.566 -4.866 1.00 1.10 C ATOM 2244 C LYS A 149 24.904 -3.304 -6.149 1.00 10.33 C ATOM 2245 O LYS A 149 26.110 -3.294 -6.127 1.00 33.22 O ATOM 2246 CB LYS A 149 23.812 -5.068 -4.692 1.00 41.23 C ATOM 2247 CG LYS A 149 23.156 -5.743 -5.880 1.00 74.23 C ATOM 2248 CD LYS A 149 22.956 -7.239 -5.651 1.00 74.00 C ATOM 2249 CE LYS A 149 24.270 -7.980 -5.324 1.00 75.34 C ATOM 2250 NZ LYS A 149 25.330 -7.788 -6.351 1.00 2.32 N ATOM 0 H LYS A 149 22.053 -3.190 -5.039 1.00 40.55 H new ATOM 0 HA LYS A 149 24.706 -3.294 -3.996 1.00 1.10 H new ATOM 0 HB2 LYS A 149 24.748 -5.583 -4.474 1.00 41.23 H new ATOM 0 HB3 LYS A 149 23.168 -5.196 -3.822 1.00 41.23 H new ATOM 0 HG2 LYS A 149 22.192 -5.274 -6.076 1.00 74.23 H new ATOM 0 HG3 LYS A 149 23.770 -5.591 -6.768 1.00 74.23 H new ATOM 0 HD2 LYS A 149 22.250 -7.385 -4.833 1.00 74.00 H new ATOM 0 HD3 LYS A 149 22.508 -7.681 -6.541 1.00 74.00 H new ATOM 0 HE2 LYS A 149 24.642 -7.635 -4.360 1.00 75.34 H new ATOM 0 HE3 LYS A 149 24.062 -9.045 -5.223 1.00 75.34 H new ATOM 0 HZ1 LYS A 149 25.877 -8.666 -6.454 1.00 2.32 H new ATOM 0 HZ2 LYS A 149 24.891 -7.545 -7.262 1.00 2.32 H new ATOM 0 HZ3 LYS A 149 25.964 -7.018 -6.056 1.00 2.32 H new ATOM 2264 N ILE A 150 24.181 -3.016 -7.239 1.00 11.35 N ATOM 2265 CA ILE A 150 24.739 -2.808 -8.590 1.00 32.24 C ATOM 2266 C ILE A 150 25.828 -1.707 -8.629 1.00 4.52 C ATOM 2267 O ILE A 150 26.773 -1.777 -9.442 1.00 24.32 O ATOM 2268 CB ILE A 150 23.599 -2.606 -9.682 1.00 3.35 C ATOM 2269 CG1 ILE A 150 22.735 -3.888 -9.734 1.00 4.50 C ATOM 2270 CG2 ILE A 150 24.178 -2.301 -11.063 1.00 20.10 C ATOM 2271 CD1 ILE A 150 21.598 -3.852 -10.735 1.00 51.24 C ATOM 0 H ILE A 150 23.166 -2.918 -7.210 1.00 11.35 H new ATOM 0 HA ILE A 150 25.256 -3.729 -8.859 1.00 32.24 H new ATOM 0 HB ILE A 150 22.990 -1.748 -9.397 1.00 3.35 H new ATOM 0 HG12 ILE A 150 23.380 -4.734 -9.970 1.00 4.50 H new ATOM 0 HG13 ILE A 150 22.321 -4.070 -8.742 1.00 4.50 H new ATOM 0 HG21 ILE A 150 23.365 -2.170 -11.778 1.00 20.10 H new ATOM 0 HG22 ILE A 150 24.770 -1.387 -11.016 1.00 20.10 H new ATOM 0 HG23 ILE A 150 24.812 -3.128 -11.382 1.00 20.10 H new ATOM 0 HD11 ILE A 150 21.051 -4.794 -10.698 1.00 51.24 H new ATOM 0 HD12 ILE A 150 20.924 -3.031 -10.491 1.00 51.24 H new ATOM 0 HD13 ILE A 150 22.000 -3.705 -11.737 1.00 51.24 H new ATOM 2283 N MET A 151 25.723 -0.714 -7.731 1.00 72.23 N ATOM 2284 CA MET A 151 26.736 0.359 -7.626 1.00 43.51 C ATOM 2285 C MET A 151 28.159 -0.192 -7.422 1.00 62.15 C ATOM 2286 O MET A 151 29.134 0.474 -7.782 1.00 14.33 O ATOM 2287 CB MET A 151 26.433 1.396 -6.513 1.00 54.53 C ATOM 2288 CG MET A 151 25.239 2.317 -6.746 1.00 73.32 C ATOM 2289 SD MET A 151 23.666 1.474 -6.740 1.00 43.43 S ATOM 2290 CE MET A 151 22.547 2.834 -7.034 1.00 5.35 C ATOM 0 H MET A 151 24.952 -0.628 -7.068 1.00 72.23 H new ATOM 0 HA MET A 151 26.681 0.870 -8.587 1.00 43.51 H new ATOM 0 HB2 MET A 151 26.271 0.857 -5.580 1.00 54.53 H new ATOM 0 HB3 MET A 151 27.319 2.015 -6.373 1.00 54.53 H new ATOM 0 HG2 MET A 151 25.231 3.087 -5.975 1.00 73.32 H new ATOM 0 HG3 MET A 151 25.365 2.825 -7.702 1.00 73.32 H new ATOM 0 HE1 MET A 151 21.522 2.463 -7.057 1.00 5.35 H new ATOM 0 HE2 MET A 151 22.649 3.569 -6.235 1.00 5.35 H new ATOM 0 HE3 MET A 151 22.786 3.301 -7.989 1.00 5.35 H new ATOM 2300 N GLU A 152 28.276 -1.400 -6.845 1.00 72.11 N ATOM 2301 CA GLU A 152 29.587 -2.036 -6.603 1.00 62.42 C ATOM 2302 C GLU A 152 30.374 -2.177 -7.907 1.00 12.34 C ATOM 2303 O GLU A 152 31.575 -1.934 -7.951 1.00 12.32 O ATOM 2304 CB GLU A 152 29.425 -3.419 -5.931 1.00 13.45 C ATOM 2305 CG GLU A 152 28.700 -4.471 -6.771 1.00 50.24 C ATOM 2306 CD GLU A 152 28.462 -5.755 -6.030 1.00 22.15 C ATOM 2307 OE1 GLU A 152 29.415 -6.546 -5.870 1.00 40.15 O ATOM 2308 OE2 GLU A 152 27.307 -6.017 -5.616 1.00 11.31 O ATOM 0 H GLU A 152 27.480 -1.958 -6.537 1.00 72.11 H new ATOM 0 HA GLU A 152 30.143 -1.388 -5.926 1.00 62.42 H new ATOM 0 HB2 GLU A 152 30.414 -3.799 -5.676 1.00 13.45 H new ATOM 0 HB3 GLU A 152 28.883 -3.289 -4.994 1.00 13.45 H new ATOM 0 HG2 GLU A 152 27.743 -4.067 -7.102 1.00 50.24 H new ATOM 0 HG3 GLU A 152 29.285 -4.679 -7.667 1.00 50.24 H new ATOM 2315 N CYS A 153 29.672 -2.550 -8.964 1.00 20.02 N ATOM 2316 CA CYS A 153 30.259 -2.741 -10.270 1.00 41.11 C ATOM 2317 C CYS A 153 30.626 -1.397 -10.869 1.00 72.00 C ATOM 2318 O CYS A 153 31.612 -1.262 -11.591 1.00 74.21 O ATOM 2319 CB CYS A 153 29.261 -3.475 -11.179 1.00 62.24 C ATOM 2320 SG CYS A 153 29.862 -3.846 -12.846 1.00 33.02 S ATOM 0 H CYS A 153 28.668 -2.729 -8.934 1.00 20.02 H new ATOM 0 HA CYS A 153 31.164 -3.342 -10.178 1.00 41.11 H new ATOM 0 HB2 CYS A 153 28.975 -4.410 -10.697 1.00 62.24 H new ATOM 0 HB3 CYS A 153 28.358 -2.870 -11.262 1.00 62.24 H new ATOM 0 HG CYS A 153 28.935 -4.466 -13.514 1.00 33.02 H new ATOM 2326 N LYS A 154 29.844 -0.402 -10.523 1.00 0.21 N ATOM 2327 CA LYS A 154 29.995 0.915 -11.076 1.00 4.33 C ATOM 2328 C LYS A 154 31.185 1.635 -10.468 1.00 44.22 C ATOM 2329 O LYS A 154 31.972 2.249 -11.192 1.00 12.43 O ATOM 2330 CB LYS A 154 28.718 1.727 -10.863 1.00 72.41 C ATOM 2331 CG LYS A 154 27.454 1.044 -11.376 1.00 4.03 C ATOM 2332 CD LYS A 154 27.544 0.721 -12.858 1.00 64.31 C ATOM 2333 CE LYS A 154 26.286 0.029 -13.348 1.00 42.43 C ATOM 2334 NZ LYS A 154 25.089 0.875 -13.186 1.00 41.53 N ATOM 0 H LYS A 154 29.084 -0.487 -9.848 1.00 0.21 H new ATOM 0 HA LYS A 154 30.176 0.812 -12.146 1.00 4.33 H new ATOM 0 HB2 LYS A 154 28.602 1.930 -9.798 1.00 72.41 H new ATOM 0 HB3 LYS A 154 28.825 2.691 -11.361 1.00 72.41 H new ATOM 0 HG2 LYS A 154 27.285 0.125 -10.814 1.00 4.03 H new ATOM 0 HG3 LYS A 154 26.595 1.690 -11.197 1.00 4.03 H new ATOM 0 HD2 LYS A 154 27.700 1.639 -13.424 1.00 64.31 H new ATOM 0 HD3 LYS A 154 28.408 0.082 -13.042 1.00 64.31 H new ATOM 0 HE2 LYS A 154 26.404 -0.235 -14.399 1.00 42.43 H new ATOM 0 HE3 LYS A 154 26.148 -0.903 -12.799 1.00 42.43 H new ATOM 0 HZ1 LYS A 154 24.299 0.466 -13.725 1.00 41.53 H new ATOM 0 HZ2 LYS A 154 24.833 0.925 -12.179 1.00 41.53 H new ATOM 0 HZ3 LYS A 154 25.290 1.832 -13.540 1.00 41.53 H new ATOM 2348 N LYS A 155 31.335 1.552 -9.144 1.00 63.23 N ATOM 2349 CA LYS A 155 32.430 2.245 -8.468 1.00 71.53 C ATOM 2350 C LYS A 155 32.454 1.976 -6.967 1.00 33.21 C ATOM 2351 O LYS A 155 33.522 1.753 -6.380 1.00 34.51 O ATOM 2352 CB LYS A 155 32.316 3.770 -8.703 1.00 50.31 C ATOM 2353 CG LYS A 155 33.420 4.596 -8.072 1.00 61.32 C ATOM 2354 CD LYS A 155 33.227 6.067 -8.367 1.00 5.45 C ATOM 2355 CE LYS A 155 34.308 6.905 -7.722 1.00 71.22 C ATOM 2356 NZ LYS A 155 34.133 8.347 -7.986 1.00 31.24 N ATOM 0 H LYS A 155 30.721 1.020 -8.528 1.00 63.23 H new ATOM 0 HA LYS A 155 33.357 1.860 -8.893 1.00 71.53 H new ATOM 0 HB2 LYS A 155 32.309 3.958 -9.777 1.00 50.31 H new ATOM 0 HB3 LYS A 155 31.357 4.113 -8.313 1.00 50.31 H new ATOM 0 HG2 LYS A 155 33.430 4.435 -6.994 1.00 61.32 H new ATOM 0 HG3 LYS A 155 34.388 4.268 -8.452 1.00 61.32 H new ATOM 0 HD2 LYS A 155 33.235 6.228 -9.445 1.00 5.45 H new ATOM 0 HD3 LYS A 155 32.251 6.388 -8.004 1.00 5.45 H new ATOM 0 HE2 LYS A 155 34.305 6.732 -6.646 1.00 71.22 H new ATOM 0 HE3 LYS A 155 35.282 6.586 -8.093 1.00 71.22 H new ATOM 0 HZ1 LYS A 155 34.897 8.880 -7.524 1.00 31.24 H new ATOM 0 HZ2 LYS A 155 34.162 8.518 -9.011 1.00 31.24 H new ATOM 0 HZ3 LYS A 155 33.216 8.660 -7.609 1.00 31.24 H new ATOM 2370 N LYS A 156 31.302 1.980 -6.345 1.00 32.53 N ATOM 2371 CA LYS A 156 31.250 1.923 -4.900 1.00 43.02 C ATOM 2372 C LYS A 156 30.118 1.027 -4.418 1.00 2.51 C ATOM 2373 O LYS A 156 28.954 1.313 -4.677 1.00 44.11 O ATOM 2374 CB LYS A 156 31.059 3.349 -4.386 1.00 24.14 C ATOM 2375 CG LYS A 156 31.033 3.515 -2.883 1.00 21.10 C ATOM 2376 CD LYS A 156 30.834 4.975 -2.548 1.00 43.43 C ATOM 2377 CE LYS A 156 30.819 5.228 -1.058 1.00 53.25 C ATOM 2378 NZ LYS A 156 30.605 6.657 -0.758 1.00 3.52 N ATOM 0 H LYS A 156 30.394 2.022 -6.808 1.00 32.53 H new ATOM 0 HA LYS A 156 32.176 1.496 -4.516 1.00 43.02 H new ATOM 0 HB2 LYS A 156 31.862 3.969 -4.786 1.00 24.14 H new ATOM 0 HB3 LYS A 156 30.124 3.738 -4.791 1.00 24.14 H new ATOM 0 HG2 LYS A 156 30.229 2.918 -2.453 1.00 21.10 H new ATOM 0 HG3 LYS A 156 31.965 3.154 -2.449 1.00 21.10 H new ATOM 0 HD2 LYS A 156 31.631 5.562 -3.005 1.00 43.43 H new ATOM 0 HD3 LYS A 156 29.895 5.320 -2.982 1.00 43.43 H new ATOM 0 HE2 LYS A 156 30.031 4.635 -0.594 1.00 53.25 H new ATOM 0 HE3 LYS A 156 31.763 4.900 -0.622 1.00 53.25 H new ATOM 0 HZ1 LYS A 156 30.600 6.798 0.272 1.00 3.52 H new ATOM 0 HZ2 LYS A 156 31.371 7.219 -1.181 1.00 3.52 H new ATOM 0 HZ3 LYS A 156 29.693 6.962 -1.154 1.00 3.52 H new ATOM 2392 N PRO A 157 30.449 -0.080 -3.730 1.00 60.10 N ATOM 2393 CA PRO A 157 29.448 -0.996 -3.167 1.00 14.44 C ATOM 2394 C PRO A 157 28.620 -0.305 -2.091 1.00 32.23 C ATOM 2395 O PRO A 157 29.170 0.323 -1.177 1.00 15.14 O ATOM 2396 CB PRO A 157 30.291 -2.124 -2.540 1.00 70.30 C ATOM 2397 CG PRO A 157 31.631 -1.999 -3.176 1.00 72.45 C ATOM 2398 CD PRO A 157 31.819 -0.541 -3.452 1.00 52.31 C ATOM 0 HA PRO A 157 28.743 -1.352 -3.918 1.00 14.44 H new ATOM 0 HB2 PRO A 157 30.356 -2.014 -1.457 1.00 70.30 H new ATOM 0 HB3 PRO A 157 29.851 -3.102 -2.735 1.00 70.30 H new ATOM 0 HG2 PRO A 157 32.413 -2.376 -2.517 1.00 72.45 H new ATOM 0 HG3 PRO A 157 31.682 -2.581 -4.096 1.00 72.45 H new ATOM 0 HD2 PRO A 157 32.255 -0.021 -2.599 1.00 52.31 H new ATOM 0 HD3 PRO A 157 32.482 -0.373 -4.301 1.00 52.31 H new ATOM 2406 N GLN A 158 27.315 -0.411 -2.188 1.00 63.34 N ATOM 2407 CA GLN A 158 26.434 0.249 -1.241 1.00 73.30 C ATOM 2408 C GLN A 158 25.403 -0.725 -0.681 1.00 63.40 C ATOM 2409 O GLN A 158 25.378 -0.990 0.530 1.00 41.21 O ATOM 2410 CB GLN A 158 25.719 1.455 -1.890 1.00 54.41 C ATOM 2411 CG GLN A 158 26.611 2.575 -2.486 1.00 40.13 C ATOM 2412 CD GLN A 158 27.406 3.437 -1.474 1.00 61.45 C ATOM 2413 OE1 GLN A 158 27.856 2.880 -0.388 1.00 21.51 O flip ATOM 2414 NE2 GLN A 158 27.643 4.614 -1.723 1.00 72.40 N flip ATOM 0 H GLN A 158 26.836 -0.947 -2.912 1.00 63.34 H new ATOM 0 HA GLN A 158 27.053 0.613 -0.421 1.00 73.30 H new ATOM 0 HB2 GLN A 158 25.075 1.078 -2.685 1.00 54.41 H new ATOM 0 HB3 GLN A 158 25.069 1.905 -1.140 1.00 54.41 H new ATOM 0 HG2 GLN A 158 27.320 2.116 -3.175 1.00 40.13 H new ATOM 0 HG3 GLN A 158 25.978 3.238 -3.076 1.00 40.13 H new ATOM 0 HE21 GLN A 158 27.283 5.037 -2.579 1.00 72.40 H new ATOM 0 HE22 GLN A 158 28.200 5.170 -1.074 1.00 72.40 H new TER 2423 GLN A 158