USER MOD reduce.3.24.130724 H: found=0, std=0, add=1822, rem=0, adj=64 USER MOD reduce.3.24.130724 removed 1828 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: B 85 GLN : amide:sc= -0.402 X(o=-1.5,f=-1.7) USER MOD Set 1.2: B 114 MET CE :methyl 166:sc= -1.11 (180deg=-1.41) USER MOD Set 2.1: B 81 CYS SG : rot -105:sc= 0.983 USER MOD Set 2.2: B 110 THR OG1 : rot 59:sc= 1.77 USER MOD Set 3.1: B 47 THR OG1 : rot 180:sc= -0.0604 USER MOD Set 3.2: B 49 THR OG1 : rot 180:sc=-0.000459 USER MOD Set 4.1: B 28 LYS NZ :NH3+ -118:sc= 1.39 (180deg=-0.116) USER MOD Set 4.2: B 29 ASN : amide:sc= 0.472 K(o=1.9,f=-2.7) USER MOD Set 5.1: A 85 GLN : amide:sc= -0.249 X(o=-1.2,f=-1.6) USER MOD Set 5.2: A 114 MET CE :methyl 166:sc= -0.976 (180deg=-1.31) USER MOD Set 6.1: A 81 CYS SG : rot -110:sc= 1.15 USER MOD Set 6.2: A 110 THR OG1 : rot 59:sc= 1.7 USER MOD Set 7.1: A 47 THR OG1 : rot 180:sc= -0.113 USER MOD Set 7.2: A 49 THR OG1 : rot 180:sc=-0.00533 USER MOD Set 8.1: A 28 LYS NZ :NH3+ -118:sc= 1.26 (180deg=-0.116) USER MOD Set 8.2: A 29 ASN : amide:sc= 0.43 K(o=1.7,f=-2.4) USER MOD Single : A 2 SER OG : rot 30:sc= 0.0629 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 62:sc= 0.0219 USER MOD Single : A 9 SER OG : rot -144:sc= 0.234 USER MOD Single : A 12 LYS NZ :NH3+ -167:sc= 0.876 (180deg=0.688) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 CYS SG : rot 71:sc= 1.19 USER MOD Single : A 23 MET CE :methyl 152:sc= -0.123 (180deg=-0.888) USER MOD Single : A 24 SER OG : rot 160:sc= -0.902 USER MOD Single : A 26 THR OG1 : rot 169:sc= 0.662 USER MOD Single : A 30 MET CE :methyl 163:sc= -2.18 (180deg=-3.03) USER MOD Single : A 37 SER OG : rot 44:sc= 0.177 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 48 SER OG : rot -148:sc= 0.458 USER MOD Single : A 53 LYS NZ :NH3+ 167:sc= -0.0511 (180deg=-0.27) USER MOD Single : A 57 TYR OH : rot 158:sc= -0.495 USER MOD Single : A 58 CYS SG : rot 74:sc= -2.48! USER MOD Single : A 60 HIS : no HD1:sc= -0.0432 K(o=-0.043,f=-0.64) USER MOD Single : A 61 HIS : no HE2:sc= -0.042 K(o=-0.042,f=-1.2) USER MOD Single : A 62 HIS : +bothHN:sc= -0.737 K(o=-0.74,f=-3.1) USER MOD Single : A 63 GLN : amide:sc= -0.247 X(o=-0.25,f=-0.039) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 68 SER OG : rot 50:sc= 0.113 USER MOD Single : A 76 TYR OH : rot -128:sc= 0.483 USER MOD Single : A 82 LYS NZ :NH3+ -177:sc= 0.576 (180deg=0.572) USER MOD Single : A 87 THR OG1 : rot 180:sc= -0.225 USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 97 TYR OH : rot 180:sc= -0.0334 USER MOD Single : A 101 LYS NZ :NH3+ 168:sc= -0.431 (180deg=-0.605) USER MOD Single : A 107 THR OG1 : rot 79:sc= 0.725 USER MOD Single : A 108 CYS SG : rot 81:sc= 0.7 USER MOD Single : A 109 LYS NZ :NH3+ -142:sc= 0.386 (180deg=-0.275) USER MOD Single : A 113 ASN : amide:sc= -0.0523 K(o=-0.052,f=-0.66) USER MOD Single : B 2 SER OG : rot 36:sc= 0.102 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 SER OG : rot 67:sc= 0.046 USER MOD Single : B 9 SER OG : rot -145:sc= 0.143 USER MOD Single : B 12 LYS NZ :NH3+ -165:sc= 0.951 (180deg=0.722) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 CYS SG : rot 59:sc= 1.24 USER MOD Single : B 23 MET CE :methyl 153:sc= -0.167 (180deg=-0.952) USER MOD Single : B 24 SER OG : rot 155:sc= -0.935 USER MOD Single : B 26 THR OG1 : rot 170:sc= 0.691 USER MOD Single : B 30 MET CE :methyl 165:sc= -2.14 (180deg=-3.12) USER MOD Single : B 37 SER OG : rot 36:sc= 0.208 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 45 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : B 48 SER OG : rot -149:sc= 0.384 USER MOD Single : B 53 LYS NZ :NH3+ 167:sc= -0.0643 (180deg=-0.294) USER MOD Single : B 57 TYR OH : rot 161:sc= -0.455 USER MOD Single : B 58 CYS SG : rot 87:sc= -2.5! USER MOD Single : B 60 HIS : no HD1:sc= -0.0375 K(o=-0.038,f=-0.61) USER MOD Single : B 61 HIS : no HE2:sc= -0.0302 K(o=-0.03,f=-1.3) USER MOD Single : B 62 HIS : +bothHN:sc= -0.713 K(o=-0.71,f=-2.7) USER MOD Single : B 63 GLN : amide:sc= -0.226 X(o=-0.23,f=-0.02) USER MOD Single : B 64 HIS : no HD1:sc=-0.00139 X(o=-0.0014,f=-0.0058) USER MOD Single : B 68 SER OG : rot 50:sc= 0.155 USER MOD Single : B 76 TYR OH : rot -123:sc= 0.43 USER MOD Single : B 82 LYS NZ :NH3+ -176:sc= 0.657 (180deg=0.648) USER MOD Single : B 87 THR OG1 : rot 176:sc= -0.162 USER MOD Single : B 96 ASN : amide:sc= -1.32 X(o=-1.3,f=-1.3) USER MOD Single : B 97 TYR OH : rot 180:sc= -0.0828 USER MOD Single : B 101 LYS NZ :NH3+ 177:sc= 0.0216 (180deg=-0.0509) USER MOD Single : B 107 THR OG1 : rot 79:sc= 0.725 USER MOD Single : B 108 CYS SG : rot 79:sc= 0.766 USER MOD Single : B 109 LYS NZ :NH3+ -142:sc= 0.387 (180deg=-0.219) USER MOD Single : B 113 ASN : amide:sc=-0.00516 K(o=-0.0052,f=-0.62) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 -17.479 -15.453 -15.996 1.00 71.22 N ATOM 2 CA SER A 2 -18.506 -14.403 -16.162 1.00 12.21 C ATOM 3 C SER A 2 -17.974 -13.029 -15.699 1.00 45.02 C ATOM 4 O SER A 2 -16.907 -12.938 -15.066 1.00 61.42 O ATOM 5 CB SER A 2 -19.783 -14.792 -15.378 1.00 24.32 C ATOM 6 OG SER A 2 -20.317 -16.020 -15.846 1.00 52.01 O ATOM 0 HA SER A 2 -18.753 -14.320 -17.220 1.00 12.21 H new ATOM 0 HB2 SER A 2 -19.550 -14.874 -14.316 1.00 24.32 H new ATOM 0 HB3 SER A 2 -20.530 -14.005 -15.480 1.00 24.32 H new ATOM 0 HG SER A 2 -19.591 -16.585 -16.183 1.00 52.01 H new ATOM 14 N LEU A 3 -18.717 -11.965 -16.061 1.00 2.14 N ATOM 15 CA LEU A 3 -18.467 -10.600 -15.566 1.00 4.04 C ATOM 16 C LEU A 3 -18.912 -10.484 -14.096 1.00 43.13 C ATOM 17 O LEU A 3 -20.106 -10.612 -13.798 1.00 14.13 O ATOM 18 CB LEU A 3 -19.244 -9.562 -16.433 1.00 14.11 C ATOM 19 CG LEU A 3 -18.828 -9.480 -17.931 1.00 72.22 C ATOM 20 CD1 LEU A 3 -19.767 -8.546 -18.729 1.00 40.42 C ATOM 21 CD2 LEU A 3 -17.364 -9.029 -18.065 1.00 65.42 C ATOM 0 H LEU A 3 -19.506 -12.029 -16.704 1.00 2.14 H new ATOM 0 HA LEU A 3 -17.399 -10.393 -15.636 1.00 4.04 H new ATOM 0 HB2 LEU A 3 -20.307 -9.799 -16.384 1.00 14.11 H new ATOM 0 HB3 LEU A 3 -19.116 -8.576 -15.986 1.00 14.11 H new ATOM 0 HG LEU A 3 -18.920 -10.480 -18.356 1.00 72.22 H new ATOM 0 HD11 LEU A 3 -19.447 -8.512 -19.771 1.00 40.42 H new ATOM 0 HD12 LEU A 3 -20.788 -8.924 -18.675 1.00 40.42 H new ATOM 0 HD13 LEU A 3 -19.728 -7.543 -18.305 1.00 40.42 H new ATOM 0 HD21 LEU A 3 -17.094 -8.978 -19.120 1.00 65.42 H new ATOM 0 HD22 LEU A 3 -17.244 -8.045 -17.612 1.00 65.42 H new ATOM 0 HD23 LEU A 3 -16.715 -9.744 -17.558 1.00 65.42 H new ATOM 33 N VAL A 4 -17.956 -10.235 -13.191 1.00 55.41 N ATOM 34 CA VAL A 4 -18.248 -10.001 -11.768 1.00 54.22 C ATOM 35 C VAL A 4 -18.719 -8.547 -11.573 1.00 61.44 C ATOM 36 O VAL A 4 -18.061 -7.594 -12.017 1.00 42.40 O ATOM 37 CB VAL A 4 -17.022 -10.353 -10.842 1.00 75.42 C ATOM 38 CG1 VAL A 4 -16.733 -11.875 -10.890 1.00 74.41 C ATOM 39 CG2 VAL A 4 -15.761 -9.535 -11.221 1.00 50.41 C ATOM 0 H VAL A 4 -16.963 -10.190 -13.422 1.00 55.41 H new ATOM 0 HA VAL A 4 -19.051 -10.673 -11.465 1.00 54.22 H new ATOM 0 HB VAL A 4 -17.285 -10.080 -9.820 1.00 75.42 H new ATOM 0 HG11 VAL A 4 -15.884 -12.105 -10.246 1.00 74.41 H new ATOM 0 HG12 VAL A 4 -17.609 -12.423 -10.544 1.00 74.41 H new ATOM 0 HG13 VAL A 4 -16.502 -12.169 -11.914 1.00 74.41 H new ATOM 0 HG21 VAL A 4 -14.939 -9.807 -10.559 1.00 50.41 H new ATOM 0 HG22 VAL A 4 -15.484 -9.751 -12.253 1.00 50.41 H new ATOM 0 HG23 VAL A 4 -15.973 -8.471 -11.118 1.00 50.41 H new ATOM 49 N LYS A 5 -19.889 -8.400 -10.952 1.00 23.21 N ATOM 50 CA LYS A 5 -20.549 -7.111 -10.759 1.00 22.52 C ATOM 51 C LYS A 5 -20.153 -6.558 -9.387 1.00 73.52 C ATOM 52 O LYS A 5 -20.500 -7.139 -8.352 1.00 4.20 O ATOM 53 CB LYS A 5 -22.079 -7.300 -10.889 1.00 2.24 C ATOM 54 CG LYS A 5 -22.523 -7.997 -12.197 1.00 62.35 C ATOM 55 CD LYS A 5 -24.055 -8.029 -12.376 1.00 24.44 C ATOM 56 CE LYS A 5 -24.481 -8.789 -13.643 1.00 71.42 C ATOM 57 NZ LYS A 5 -25.953 -8.762 -13.839 1.00 72.24 N ATOM 0 H LYS A 5 -20.412 -9.185 -10.564 1.00 23.21 H new ATOM 0 HA LYS A 5 -20.238 -6.393 -11.518 1.00 22.52 H new ATOM 0 HB2 LYS A 5 -22.435 -7.884 -10.040 1.00 2.24 H new ATOM 0 HB3 LYS A 5 -22.561 -6.324 -10.829 1.00 2.24 H new ATOM 0 HG2 LYS A 5 -22.075 -7.482 -13.046 1.00 62.35 H new ATOM 0 HG3 LYS A 5 -22.141 -9.018 -12.205 1.00 62.35 H new ATOM 0 HD2 LYS A 5 -24.510 -8.498 -11.504 1.00 24.44 H new ATOM 0 HD3 LYS A 5 -24.434 -7.008 -12.423 1.00 24.44 H new ATOM 0 HE2 LYS A 5 -23.991 -8.349 -14.512 1.00 71.42 H new ATOM 0 HE3 LYS A 5 -24.143 -9.823 -13.576 1.00 71.42 H new ATOM 0 HZ1 LYS A 5 -26.198 -9.285 -14.704 1.00 72.24 H new ATOM 0 HZ2 LYS A 5 -26.420 -9.205 -13.022 1.00 72.24 H new ATOM 0 HZ3 LYS A 5 -26.273 -7.777 -13.929 1.00 72.24 H new ATOM 71 N LEU A 6 -19.363 -5.481 -9.395 1.00 31.15 N ATOM 72 CA LEU A 6 -18.797 -4.878 -8.184 1.00 21.42 C ATOM 73 C LEU A 6 -19.450 -3.513 -7.947 1.00 43.44 C ATOM 74 O LEU A 6 -19.113 -2.537 -8.621 1.00 61.11 O ATOM 75 CB LEU A 6 -17.252 -4.751 -8.340 1.00 62.14 C ATOM 76 CG LEU A 6 -16.488 -6.078 -8.669 1.00 33.21 C ATOM 77 CD1 LEU A 6 -14.981 -5.827 -8.890 1.00 32.41 C ATOM 78 CD2 LEU A 6 -16.730 -7.156 -7.581 1.00 63.22 C ATOM 0 H LEU A 6 -19.095 -4.997 -10.252 1.00 31.15 H new ATOM 0 HA LEU A 6 -18.998 -5.509 -7.318 1.00 21.42 H new ATOM 0 HB2 LEU A 6 -17.044 -4.029 -9.130 1.00 62.14 H new ATOM 0 HB3 LEU A 6 -16.845 -4.339 -7.416 1.00 62.14 H new ATOM 0 HG LEU A 6 -16.893 -6.461 -9.606 1.00 33.21 H new ATOM 0 HD11 LEU A 6 -14.484 -6.771 -9.116 1.00 32.41 H new ATOM 0 HD12 LEU A 6 -14.845 -5.137 -9.723 1.00 32.41 H new ATOM 0 HD13 LEU A 6 -14.548 -5.396 -7.987 1.00 32.41 H new ATOM 0 HD21 LEU A 6 -16.185 -8.064 -7.841 1.00 63.22 H new ATOM 0 HD22 LEU A 6 -16.380 -6.786 -6.618 1.00 63.22 H new ATOM 0 HD23 LEU A 6 -17.795 -7.377 -7.519 1.00 63.22 H new ATOM 90 N GLU A 7 -20.416 -3.458 -7.020 1.00 12.51 N ATOM 91 CA GLU A 7 -21.117 -2.209 -6.683 1.00 53.14 C ATOM 92 C GLU A 7 -20.274 -1.400 -5.710 1.00 2.23 C ATOM 93 O GLU A 7 -19.841 -1.923 -4.693 1.00 75.31 O ATOM 94 CB GLU A 7 -22.515 -2.457 -6.055 1.00 44.22 C ATOM 95 CG GLU A 7 -23.528 -3.178 -6.963 1.00 61.33 C ATOM 96 CD GLU A 7 -23.145 -4.633 -7.294 1.00 65.34 C ATOM 97 OE1 GLU A 7 -22.806 -5.392 -6.352 1.00 3.12 O ATOM 98 OE2 GLU A 7 -23.190 -5.024 -8.480 1.00 15.00 O ATOM 0 H GLU A 7 -20.732 -4.268 -6.487 1.00 12.51 H new ATOM 0 HA GLU A 7 -21.266 -1.664 -7.615 1.00 53.14 H new ATOM 0 HB2 GLU A 7 -22.387 -3.043 -5.145 1.00 44.22 H new ATOM 0 HB3 GLU A 7 -22.937 -1.497 -5.759 1.00 44.22 H new ATOM 0 HG2 GLU A 7 -24.504 -3.171 -6.479 1.00 61.33 H new ATOM 0 HG3 GLU A 7 -23.630 -2.619 -7.893 1.00 61.33 H new ATOM 105 N SER A 8 -20.057 -0.133 -6.029 1.00 12.11 N ATOM 106 CA SER A 8 -19.398 0.819 -5.134 1.00 23.31 C ATOM 107 C SER A 8 -20.312 1.187 -3.942 1.00 1.25 C ATOM 108 O SER A 8 -21.440 0.689 -3.830 1.00 54.01 O ATOM 109 CB SER A 8 -19.038 2.053 -5.973 1.00 20.40 C ATOM 110 OG SER A 8 -20.174 2.555 -6.666 1.00 2.42 O ATOM 0 H SER A 8 -20.334 0.271 -6.923 1.00 12.11 H new ATOM 0 HA SER A 8 -18.498 0.382 -4.702 1.00 23.31 H new ATOM 0 HB2 SER A 8 -18.632 2.830 -5.325 1.00 20.40 H new ATOM 0 HB3 SER A 8 -18.258 1.794 -6.689 1.00 20.40 H new ATOM 0 HG SER A 8 -20.854 2.836 -6.019 1.00 2.42 H new ATOM 116 N SER A 9 -19.819 2.064 -3.055 1.00 41.31 N ATOM 117 CA SER A 9 -20.642 2.685 -1.996 1.00 64.44 C ATOM 118 C SER A 9 -21.674 3.664 -2.615 1.00 20.12 C ATOM 119 O SER A 9 -22.660 4.033 -1.976 1.00 72.43 O ATOM 120 CB SER A 9 -19.727 3.409 -0.983 1.00 42.40 C ATOM 121 OG SER A 9 -18.902 4.375 -1.626 1.00 21.30 O ATOM 0 H SER A 9 -18.844 2.364 -3.048 1.00 41.31 H new ATOM 0 HA SER A 9 -21.196 1.907 -1.470 1.00 64.44 H new ATOM 0 HB2 SER A 9 -20.337 3.897 -0.223 1.00 42.40 H new ATOM 0 HB3 SER A 9 -19.102 2.679 -0.469 1.00 42.40 H new ATOM 0 HG SER A 9 -18.026 4.401 -1.187 1.00 21.30 H new ATOM 127 N ASP A 10 -21.411 4.077 -3.876 1.00 51.43 N ATOM 128 CA ASP A 10 -22.327 4.903 -4.689 1.00 34.04 C ATOM 129 C ASP A 10 -23.265 3.997 -5.552 1.00 32.01 C ATOM 130 O ASP A 10 -23.967 4.475 -6.451 1.00 73.24 O ATOM 131 CB ASP A 10 -21.464 5.856 -5.559 1.00 0.05 C ATOM 132 CG ASP A 10 -22.267 6.933 -6.316 1.00 43.11 C ATOM 133 OD1 ASP A 10 -22.784 7.860 -5.662 1.00 4.52 O ATOM 134 OD2 ASP A 10 -22.384 6.855 -7.556 1.00 63.44 O ATOM 0 H ASP A 10 -20.545 3.842 -4.362 1.00 51.43 H new ATOM 0 HA ASP A 10 -22.981 5.498 -4.051 1.00 34.04 H new ATOM 0 HB2 ASP A 10 -20.732 6.349 -4.919 1.00 0.05 H new ATOM 0 HB3 ASP A 10 -20.906 5.262 -6.282 1.00 0.05 H new ATOM 139 N GLU A 11 -23.232 2.671 -5.263 1.00 21.04 N ATOM 140 CA GLU A 11 -24.195 1.653 -5.767 1.00 34.04 C ATOM 141 C GLU A 11 -24.077 1.377 -7.283 1.00 64.31 C ATOM 142 O GLU A 11 -24.907 0.650 -7.845 1.00 30.45 O ATOM 143 CB GLU A 11 -25.657 2.040 -5.376 1.00 52.45 C ATOM 144 CG GLU A 11 -25.879 2.211 -3.850 1.00 63.33 C ATOM 145 CD GLU A 11 -27.294 2.671 -3.433 1.00 42.25 C ATOM 146 OE1 GLU A 11 -27.617 2.576 -2.231 1.00 0.42 O ATOM 147 OE2 GLU A 11 -28.081 3.133 -4.293 1.00 35.22 O ATOM 0 H GLU A 11 -22.517 2.268 -4.657 1.00 21.04 H new ATOM 0 HA GLU A 11 -23.930 0.715 -5.278 1.00 34.04 H new ATOM 0 HB2 GLU A 11 -25.922 2.971 -5.878 1.00 52.45 H new ATOM 0 HB3 GLU A 11 -26.337 1.273 -5.748 1.00 52.45 H new ATOM 0 HG2 GLU A 11 -25.665 1.261 -3.360 1.00 63.33 H new ATOM 0 HG3 GLU A 11 -25.155 2.934 -3.473 1.00 63.33 H new ATOM 154 N LYS A 12 -23.032 1.921 -7.936 1.00 60.11 N ATOM 155 CA LYS A 12 -22.805 1.729 -9.383 1.00 32.14 C ATOM 156 C LYS A 12 -22.244 0.320 -9.650 1.00 44.42 C ATOM 157 O LYS A 12 -21.199 -0.041 -9.106 1.00 25.04 O ATOM 158 CB LYS A 12 -21.848 2.823 -9.938 1.00 35.11 C ATOM 159 CG LYS A 12 -22.413 4.259 -9.882 1.00 51.11 C ATOM 160 CD LYS A 12 -23.663 4.452 -10.769 1.00 32.42 C ATOM 161 CE LYS A 12 -24.197 5.896 -10.727 1.00 44.11 C ATOM 162 NZ LYS A 12 -24.608 6.308 -9.357 1.00 62.45 N ATOM 0 H LYS A 12 -22.327 2.501 -7.481 1.00 60.11 H new ATOM 0 HA LYS A 12 -23.759 1.824 -9.902 1.00 32.14 H new ATOM 0 HB2 LYS A 12 -20.915 2.791 -9.375 1.00 35.11 H new ATOM 0 HB3 LYS A 12 -21.604 2.583 -10.973 1.00 35.11 H new ATOM 0 HG2 LYS A 12 -22.665 4.504 -8.850 1.00 51.11 H new ATOM 0 HG3 LYS A 12 -21.640 4.960 -10.196 1.00 51.11 H new ATOM 0 HD2 LYS A 12 -23.419 4.188 -11.798 1.00 32.42 H new ATOM 0 HD3 LYS A 12 -24.446 3.768 -10.442 1.00 32.42 H new ATOM 0 HE2 LYS A 12 -23.428 6.576 -11.093 1.00 44.11 H new ATOM 0 HE3 LYS A 12 -25.049 5.986 -11.402 1.00 44.11 H new ATOM 0 HZ1 LYS A 12 -25.158 7.189 -9.410 1.00 62.45 H new ATOM 0 HZ2 LYS A 12 -25.192 5.561 -8.930 1.00 62.45 H new ATOM 0 HZ3 LYS A 12 -23.762 6.462 -8.772 1.00 62.45 H new ATOM 176 N VAL A 13 -22.963 -0.442 -10.493 1.00 74.11 N ATOM 177 CA VAL A 13 -22.648 -1.840 -10.833 1.00 31.23 C ATOM 178 C VAL A 13 -21.511 -1.887 -11.875 1.00 34.41 C ATOM 179 O VAL A 13 -21.737 -1.614 -13.064 1.00 74.31 O ATOM 180 CB VAL A 13 -23.935 -2.571 -11.392 1.00 25.44 C ATOM 181 CG1 VAL A 13 -23.652 -4.055 -11.731 1.00 62.23 C ATOM 182 CG2 VAL A 13 -25.125 -2.432 -10.407 1.00 72.35 C ATOM 0 H VAL A 13 -23.797 -0.095 -10.967 1.00 74.11 H new ATOM 0 HA VAL A 13 -22.320 -2.356 -9.931 1.00 31.23 H new ATOM 0 HB VAL A 13 -24.212 -2.078 -12.324 1.00 25.44 H new ATOM 0 HG11 VAL A 13 -24.561 -4.521 -12.112 1.00 62.23 H new ATOM 0 HG12 VAL A 13 -22.870 -4.113 -12.488 1.00 62.23 H new ATOM 0 HG13 VAL A 13 -23.325 -4.578 -10.832 1.00 62.23 H new ATOM 0 HG21 VAL A 13 -25.997 -2.943 -10.815 1.00 72.35 H new ATOM 0 HG22 VAL A 13 -24.858 -2.878 -9.449 1.00 72.35 H new ATOM 0 HG23 VAL A 13 -25.357 -1.377 -10.264 1.00 72.35 H new ATOM 192 N PHE A 14 -20.288 -2.189 -11.418 1.00 61.34 N ATOM 193 CA PHE A 14 -19.109 -2.300 -12.291 1.00 35.12 C ATOM 194 C PHE A 14 -18.919 -3.755 -12.728 1.00 41.44 C ATOM 195 O PHE A 14 -18.257 -4.549 -12.045 1.00 34.11 O ATOM 196 CB PHE A 14 -17.846 -1.745 -11.584 1.00 31.33 C ATOM 197 CG PHE A 14 -17.945 -0.251 -11.283 1.00 35.42 C ATOM 198 CD1 PHE A 14 -17.887 0.678 -12.319 1.00 60.44 C ATOM 199 CD2 PHE A 14 -18.117 0.225 -9.983 1.00 42.15 C ATOM 200 CE1 PHE A 14 -17.997 2.023 -12.064 1.00 15.44 C ATOM 201 CE2 PHE A 14 -18.222 1.576 -9.732 1.00 5.22 C ATOM 202 CZ PHE A 14 -18.164 2.472 -10.773 1.00 31.42 C ATOM 0 H PHE A 14 -20.087 -2.363 -10.433 1.00 61.34 H new ATOM 0 HA PHE A 14 -19.270 -1.696 -13.184 1.00 35.12 H new ATOM 0 HB2 PHE A 14 -17.688 -2.289 -10.653 1.00 31.33 H new ATOM 0 HB3 PHE A 14 -16.974 -1.928 -12.212 1.00 31.33 H new ATOM 0 HD1 PHE A 14 -17.754 0.337 -13.335 1.00 60.44 H new ATOM 0 HD2 PHE A 14 -18.169 -0.475 -9.162 1.00 42.15 H new ATOM 0 HE1 PHE A 14 -17.952 2.731 -12.879 1.00 15.44 H new ATOM 0 HE2 PHE A 14 -18.350 1.930 -8.720 1.00 5.22 H new ATOM 0 HZ PHE A 14 -18.250 3.531 -10.578 1.00 31.42 H new ATOM 212 N GLU A 15 -19.570 -4.102 -13.849 1.00 43.10 N ATOM 213 CA GLU A 15 -19.413 -5.408 -14.498 1.00 70.01 C ATOM 214 C GLU A 15 -18.042 -5.451 -15.181 1.00 60.21 C ATOM 215 O GLU A 15 -17.803 -4.715 -16.148 1.00 22.44 O ATOM 216 CB GLU A 15 -20.541 -5.638 -15.534 1.00 53.30 C ATOM 217 CG GLU A 15 -21.958 -5.428 -14.976 1.00 45.42 C ATOM 218 CD GLU A 15 -23.063 -5.692 -16.003 1.00 21.24 C ATOM 219 OE1 GLU A 15 -23.595 -4.722 -16.590 1.00 62.12 O ATOM 220 OE2 GLU A 15 -23.394 -6.870 -16.245 1.00 71.34 O ATOM 0 H GLU A 15 -20.221 -3.482 -14.330 1.00 43.10 H new ATOM 0 HA GLU A 15 -19.479 -6.200 -13.752 1.00 70.01 H new ATOM 0 HB2 GLU A 15 -20.390 -4.962 -16.376 1.00 53.30 H new ATOM 0 HB3 GLU A 15 -20.462 -6.653 -15.922 1.00 53.30 H new ATOM 0 HG2 GLU A 15 -22.104 -6.086 -14.119 1.00 45.42 H new ATOM 0 HG3 GLU A 15 -22.049 -4.405 -14.611 1.00 45.42 H new ATOM 227 N ILE A 16 -17.146 -6.288 -14.661 1.00 53.53 N ATOM 228 CA ILE A 16 -15.766 -6.390 -15.145 1.00 1.35 C ATOM 229 C ILE A 16 -15.337 -7.866 -15.163 1.00 23.53 C ATOM 230 O ILE A 16 -15.914 -8.688 -14.444 1.00 4.14 O ATOM 231 CB ILE A 16 -14.806 -5.505 -14.253 1.00 1.52 C ATOM 232 CG1 ILE A 16 -13.378 -5.424 -14.877 1.00 72.24 C ATOM 233 CG2 ILE A 16 -14.757 -6.015 -12.784 1.00 10.32 C ATOM 234 CD1 ILE A 16 -12.433 -4.463 -14.190 1.00 33.32 C ATOM 0 H ILE A 16 -17.356 -6.919 -13.888 1.00 53.53 H new ATOM 0 HA ILE A 16 -15.702 -6.008 -16.164 1.00 1.35 H new ATOM 0 HB ILE A 16 -15.216 -4.495 -14.229 1.00 1.52 H new ATOM 0 HG12 ILE A 16 -12.934 -6.419 -14.862 1.00 72.24 H new ATOM 0 HG13 ILE A 16 -13.471 -5.133 -15.923 1.00 72.24 H new ATOM 0 HG21 ILE A 16 -14.087 -5.382 -12.201 1.00 10.32 H new ATOM 0 HG22 ILE A 16 -15.757 -5.979 -12.353 1.00 10.32 H new ATOM 0 HG23 ILE A 16 -14.392 -7.042 -12.767 1.00 10.32 H new ATOM 0 HD11 ILE A 16 -11.468 -4.478 -14.696 1.00 33.32 H new ATOM 0 HD12 ILE A 16 -12.847 -3.456 -14.228 1.00 33.32 H new ATOM 0 HD13 ILE A 16 -12.302 -4.762 -13.150 1.00 33.32 H new ATOM 246 N GLU A 17 -14.348 -8.193 -16.012 1.00 42.22 N ATOM 247 CA GLU A 17 -13.833 -9.559 -16.168 1.00 72.11 C ATOM 248 C GLU A 17 -13.230 -10.056 -14.835 1.00 74.53 C ATOM 249 O GLU A 17 -12.466 -9.329 -14.183 1.00 12.54 O ATOM 250 CB GLU A 17 -12.778 -9.629 -17.310 1.00 1.43 C ATOM 251 CG GLU A 17 -13.291 -9.257 -18.734 1.00 13.31 C ATOM 252 CD GLU A 17 -13.512 -7.745 -18.977 1.00 22.33 C ATOM 253 OE1 GLU A 17 -14.651 -7.257 -18.820 1.00 53.41 O ATOM 254 OE2 GLU A 17 -12.549 -7.040 -19.317 1.00 20.52 O ATOM 0 H GLU A 17 -13.883 -7.511 -16.611 1.00 42.22 H new ATOM 0 HA GLU A 17 -14.663 -10.211 -16.440 1.00 72.11 H new ATOM 0 HB2 GLU A 17 -11.952 -8.964 -17.057 1.00 1.43 H new ATOM 0 HB3 GLU A 17 -12.374 -10.641 -17.343 1.00 1.43 H new ATOM 0 HG2 GLU A 17 -12.576 -9.627 -19.469 1.00 13.31 H new ATOM 0 HG3 GLU A 17 -14.231 -9.779 -18.913 1.00 13.31 H new ATOM 261 N LYS A 18 -13.599 -11.294 -14.455 1.00 35.14 N ATOM 262 CA LYS A 18 -13.197 -11.922 -13.181 1.00 33.54 C ATOM 263 C LYS A 18 -11.662 -12.037 -13.054 1.00 61.21 C ATOM 264 O LYS A 18 -11.122 -11.957 -11.951 1.00 22.30 O ATOM 265 CB LYS A 18 -13.852 -13.316 -13.065 1.00 30.30 C ATOM 266 CG LYS A 18 -13.618 -14.035 -11.711 1.00 14.31 C ATOM 267 CD LYS A 18 -14.086 -15.510 -11.733 1.00 70.44 C ATOM 268 CE LYS A 18 -13.331 -16.347 -12.783 1.00 43.04 C ATOM 269 NZ LYS A 18 -13.822 -17.748 -12.849 1.00 3.11 N ATOM 0 H LYS A 18 -14.191 -11.893 -15.030 1.00 35.14 H new ATOM 0 HA LYS A 18 -13.541 -11.285 -12.366 1.00 33.54 H new ATOM 0 HB2 LYS A 18 -14.925 -13.212 -13.224 1.00 30.30 H new ATOM 0 HB3 LYS A 18 -13.471 -13.949 -13.867 1.00 30.30 H new ATOM 0 HG2 LYS A 18 -12.557 -13.998 -11.462 1.00 14.31 H new ATOM 0 HG3 LYS A 18 -14.149 -13.501 -10.923 1.00 14.31 H new ATOM 0 HD2 LYS A 18 -13.939 -15.950 -10.747 1.00 70.44 H new ATOM 0 HD3 LYS A 18 -15.155 -15.547 -11.943 1.00 70.44 H new ATOM 0 HE2 LYS A 18 -13.439 -15.880 -13.762 1.00 43.04 H new ATOM 0 HE3 LYS A 18 -12.267 -16.348 -12.546 1.00 43.04 H new ATOM 0 HZ1 LYS A 18 -13.284 -18.271 -13.569 1.00 3.11 H new ATOM 0 HZ2 LYS A 18 -13.695 -18.204 -11.923 1.00 3.11 H new ATOM 0 HZ3 LYS A 18 -14.831 -17.751 -13.101 1.00 3.11 H new ATOM 283 N GLU A 19 -10.983 -12.210 -14.209 1.00 24.55 N ATOM 284 CA GLU A 19 -9.499 -12.245 -14.308 1.00 54.14 C ATOM 285 C GLU A 19 -8.845 -10.970 -13.721 1.00 62.43 C ATOM 286 O GLU A 19 -7.761 -11.025 -13.126 1.00 65.34 O ATOM 287 CB GLU A 19 -9.074 -12.390 -15.792 1.00 21.01 C ATOM 288 CG GLU A 19 -9.472 -13.712 -16.475 1.00 75.25 C ATOM 289 CD GLU A 19 -9.116 -13.762 -17.978 1.00 54.43 C ATOM 290 OE1 GLU A 19 -9.995 -14.085 -18.808 1.00 55.21 O ATOM 291 OE2 GLU A 19 -7.961 -13.449 -18.335 1.00 73.11 O ATOM 0 H GLU A 19 -11.449 -12.331 -15.108 1.00 24.55 H new ATOM 0 HA GLU A 19 -9.157 -13.101 -13.727 1.00 54.14 H new ATOM 0 HB2 GLU A 19 -9.508 -11.565 -16.357 1.00 21.01 H new ATOM 0 HB3 GLU A 19 -7.991 -12.283 -15.853 1.00 21.01 H new ATOM 0 HG2 GLU A 19 -8.977 -14.538 -15.965 1.00 75.25 H new ATOM 0 HG3 GLU A 19 -10.545 -13.863 -16.359 1.00 75.25 H new ATOM 298 N ILE A 20 -9.521 -9.835 -13.919 1.00 63.00 N ATOM 299 CA ILE A 20 -9.059 -8.510 -13.465 1.00 15.43 C ATOM 300 C ILE A 20 -9.374 -8.325 -11.968 1.00 63.11 C ATOM 301 O ILE A 20 -8.613 -7.694 -11.227 1.00 41.23 O ATOM 302 CB ILE A 20 -9.739 -7.385 -14.323 1.00 74.04 C ATOM 303 CG1 ILE A 20 -9.586 -7.704 -15.848 1.00 41.13 C ATOM 304 CG2 ILE A 20 -9.158 -5.992 -13.978 1.00 5.05 C ATOM 305 CD1 ILE A 20 -10.381 -6.811 -16.769 1.00 42.01 C ATOM 0 H ILE A 20 -10.417 -9.805 -14.405 1.00 63.00 H new ATOM 0 HA ILE A 20 -7.979 -8.440 -13.598 1.00 15.43 H new ATOM 0 HB ILE A 20 -10.802 -7.361 -14.083 1.00 74.04 H new ATOM 0 HG12 ILE A 20 -8.532 -7.630 -16.115 1.00 41.13 H new ATOM 0 HG13 ILE A 20 -9.887 -8.738 -16.020 1.00 41.13 H new ATOM 0 HG21 ILE A 20 -9.648 -5.232 -14.587 1.00 5.05 H new ATOM 0 HG22 ILE A 20 -9.330 -5.777 -12.923 1.00 5.05 H new ATOM 0 HG23 ILE A 20 -8.087 -5.984 -14.180 1.00 5.05 H new ATOM 0 HD11 ILE A 20 -10.210 -7.110 -17.803 1.00 42.01 H new ATOM 0 HD12 ILE A 20 -11.442 -6.901 -16.536 1.00 42.01 H new ATOM 0 HD13 ILE A 20 -10.066 -5.776 -16.634 1.00 42.01 H new ATOM 317 N ALA A 21 -10.514 -8.893 -11.542 1.00 40.22 N ATOM 318 CA ALA A 21 -10.886 -8.982 -10.115 1.00 35.25 C ATOM 319 C ALA A 21 -9.901 -9.885 -9.331 1.00 14.25 C ATOM 320 O ALA A 21 -9.733 -9.724 -8.120 1.00 5.31 O ATOM 321 CB ALA A 21 -12.324 -9.496 -9.988 1.00 72.13 C ATOM 0 H ALA A 21 -11.203 -9.303 -12.172 1.00 40.22 H new ATOM 0 HA ALA A 21 -10.827 -7.986 -9.677 1.00 35.25 H new ATOM 0 HB1 ALA A 21 -12.596 -9.561 -8.934 1.00 72.13 H new ATOM 0 HB2 ALA A 21 -13.002 -8.810 -10.496 1.00 72.13 H new ATOM 0 HB3 ALA A 21 -12.399 -10.484 -10.443 1.00 72.13 H new ATOM 327 N CYS A 22 -9.272 -10.840 -10.050 1.00 14.35 N ATOM 328 CA CYS A 22 -8.217 -11.714 -9.506 1.00 53.40 C ATOM 329 C CYS A 22 -6.874 -10.955 -9.353 1.00 25.21 C ATOM 330 O CYS A 22 -6.052 -11.316 -8.506 1.00 40.45 O ATOM 331 CB CYS A 22 -8.045 -12.959 -10.401 1.00 52.53 C ATOM 332 SG CYS A 22 -9.539 -13.969 -10.554 1.00 14.12 S ATOM 0 H CYS A 22 -9.485 -11.025 -11.030 1.00 14.35 H new ATOM 0 HA CYS A 22 -8.524 -12.036 -8.511 1.00 53.40 H new ATOM 0 HB2 CYS A 22 -7.732 -12.639 -11.395 1.00 52.53 H new ATOM 0 HB3 CYS A 22 -7.242 -13.576 -9.997 1.00 52.53 H new ATOM 0 HG CYS A 22 -10.416 -13.339 -11.277 1.00 14.12 H new ATOM 338 N MET A 23 -6.658 -9.911 -10.190 1.00 13.44 N ATOM 339 CA MET A 23 -5.477 -9.012 -10.071 1.00 35.23 C ATOM 340 C MET A 23 -5.541 -8.228 -8.752 1.00 5.43 C ATOM 341 O MET A 23 -4.515 -7.971 -8.107 1.00 64.22 O ATOM 342 CB MET A 23 -5.409 -8.013 -11.255 1.00 15.31 C ATOM 343 CG MET A 23 -5.275 -8.653 -12.636 1.00 53.21 C ATOM 344 SD MET A 23 -5.209 -7.425 -13.961 1.00 43.40 S ATOM 345 CE MET A 23 -3.732 -6.487 -13.542 1.00 32.15 C ATOM 0 H MET A 23 -7.285 -9.668 -10.957 1.00 13.44 H new ATOM 0 HA MET A 23 -4.583 -9.635 -10.088 1.00 35.23 H new ATOM 0 HB2 MET A 23 -6.308 -7.397 -11.243 1.00 15.31 H new ATOM 0 HB3 MET A 23 -4.563 -7.344 -11.098 1.00 15.31 H new ATOM 0 HG2 MET A 23 -4.372 -9.263 -12.665 1.00 53.21 H new ATOM 0 HG3 MET A 23 -6.118 -9.323 -12.807 1.00 53.21 H new ATOM 0 HE1 MET A 23 -3.295 -6.071 -14.450 1.00 32.15 H new ATOM 0 HE2 MET A 23 -3.996 -5.677 -12.862 1.00 32.15 H new ATOM 0 HE3 MET A 23 -3.008 -7.144 -13.059 1.00 32.15 H new ATOM 355 N SER A 24 -6.771 -7.841 -8.387 1.00 33.33 N ATOM 356 CA SER A 24 -7.071 -7.260 -7.083 1.00 24.12 C ATOM 357 C SER A 24 -6.948 -8.361 -6.023 1.00 3.35 C ATOM 358 O SER A 24 -7.704 -9.329 -6.065 1.00 0.32 O ATOM 359 CB SER A 24 -8.490 -6.652 -7.088 1.00 55.35 C ATOM 360 OG SER A 24 -8.800 -6.058 -5.836 1.00 10.24 O ATOM 0 H SER A 24 -7.586 -7.925 -8.995 1.00 33.33 H new ATOM 0 HA SER A 24 -6.368 -6.458 -6.855 1.00 24.12 H new ATOM 0 HB2 SER A 24 -8.565 -5.903 -7.877 1.00 55.35 H new ATOM 0 HB3 SER A 24 -9.220 -7.429 -7.315 1.00 55.35 H new ATOM 0 HG SER A 24 -9.535 -5.419 -5.950 1.00 10.24 H new ATOM 366 N VAL A 25 -5.984 -8.207 -5.097 1.00 4.54 N ATOM 367 CA VAL A 25 -5.656 -9.230 -4.087 1.00 64.22 C ATOM 368 C VAL A 25 -6.867 -9.536 -3.183 1.00 42.02 C ATOM 369 O VAL A 25 -7.258 -10.698 -3.044 1.00 21.50 O ATOM 370 CB VAL A 25 -4.414 -8.793 -3.220 1.00 44.34 C ATOM 371 CG1 VAL A 25 -4.130 -9.795 -2.074 1.00 32.40 C ATOM 372 CG2 VAL A 25 -3.159 -8.597 -4.112 1.00 55.44 C ATOM 0 H VAL A 25 -5.409 -7.367 -5.028 1.00 4.54 H new ATOM 0 HA VAL A 25 -5.396 -10.144 -4.621 1.00 64.22 H new ATOM 0 HB VAL A 25 -4.659 -7.836 -2.759 1.00 44.34 H new ATOM 0 HG11 VAL A 25 -3.267 -9.457 -1.501 1.00 32.40 H new ATOM 0 HG12 VAL A 25 -4.999 -9.855 -1.419 1.00 32.40 H new ATOM 0 HG13 VAL A 25 -3.924 -10.779 -2.494 1.00 32.40 H new ATOM 0 HG21 VAL A 25 -2.315 -8.296 -3.491 1.00 55.44 H new ATOM 0 HG22 VAL A 25 -2.922 -9.533 -4.617 1.00 55.44 H new ATOM 0 HG23 VAL A 25 -3.358 -7.824 -4.855 1.00 55.44 H new ATOM 382 N THR A 26 -7.464 -8.477 -2.607 1.00 33.05 N ATOM 383 CA THR A 26 -8.594 -8.599 -1.667 1.00 35.14 C ATOM 384 C THR A 26 -9.852 -9.189 -2.344 1.00 71.33 C ATOM 385 O THR A 26 -10.494 -10.082 -1.773 1.00 31.24 O ATOM 386 CB THR A 26 -8.919 -7.220 -1.008 1.00 3.45 C ATOM 387 OG1 THR A 26 -7.751 -6.751 -0.314 1.00 74.25 O ATOM 388 CG2 THR A 26 -10.103 -7.281 -0.014 1.00 14.12 C ATOM 0 H THR A 26 -7.177 -7.513 -2.780 1.00 33.05 H new ATOM 0 HA THR A 26 -8.289 -9.296 -0.886 1.00 35.14 H new ATOM 0 HB THR A 26 -9.210 -6.541 -1.810 1.00 3.45 H new ATOM 0 HG1 THR A 26 -7.882 -5.817 -0.046 1.00 74.25 H new ATOM 0 HG21 THR A 26 -10.276 -6.291 0.407 1.00 14.12 H new ATOM 0 HG22 THR A 26 -11.000 -7.614 -0.536 1.00 14.12 H new ATOM 0 HG23 THR A 26 -9.869 -7.981 0.788 1.00 14.12 H new ATOM 396 N ILE A 27 -10.182 -8.709 -3.566 1.00 45.25 N ATOM 397 CA ILE A 27 -11.360 -9.205 -4.311 1.00 41.21 C ATOM 398 C ILE A 27 -11.160 -10.690 -4.681 1.00 14.32 C ATOM 399 O ILE A 27 -12.083 -11.493 -4.522 1.00 44.25 O ATOM 400 CB ILE A 27 -11.682 -8.349 -5.595 1.00 14.04 C ATOM 401 CG1 ILE A 27 -11.946 -6.854 -5.213 1.00 33.41 C ATOM 402 CG2 ILE A 27 -12.893 -8.938 -6.370 1.00 70.22 C ATOM 403 CD1 ILE A 27 -12.195 -5.926 -6.394 1.00 33.03 C ATOM 0 H ILE A 27 -9.653 -7.985 -4.052 1.00 45.25 H new ATOM 0 HA ILE A 27 -12.223 -9.105 -3.653 1.00 41.21 H new ATOM 0 HB ILE A 27 -10.812 -8.388 -6.250 1.00 14.04 H new ATOM 0 HG12 ILE A 27 -12.808 -6.811 -4.547 1.00 33.41 H new ATOM 0 HG13 ILE A 27 -11.090 -6.481 -4.651 1.00 33.41 H new ATOM 0 HG21 ILE A 27 -13.093 -8.328 -7.251 1.00 70.22 H new ATOM 0 HG22 ILE A 27 -12.666 -9.958 -6.679 1.00 70.22 H new ATOM 0 HG23 ILE A 27 -13.771 -8.942 -5.724 1.00 70.22 H new ATOM 0 HD11 ILE A 27 -12.368 -4.913 -6.031 1.00 33.03 H new ATOM 0 HD12 ILE A 27 -11.326 -5.932 -7.051 1.00 33.03 H new ATOM 0 HD13 ILE A 27 -13.070 -6.267 -6.947 1.00 33.03 H new ATOM 415 N LYS A 28 -9.933 -11.028 -5.124 1.00 43.21 N ATOM 416 CA LYS A 28 -9.516 -12.414 -5.423 1.00 61.11 C ATOM 417 C LYS A 28 -9.718 -13.315 -4.194 1.00 2.14 C ATOM 418 O LYS A 28 -10.267 -14.408 -4.309 1.00 41.41 O ATOM 419 CB LYS A 28 -8.025 -12.447 -5.842 1.00 44.42 C ATOM 420 CG LYS A 28 -7.471 -13.851 -6.192 1.00 61.42 C ATOM 421 CD LYS A 28 -5.934 -13.861 -6.392 1.00 41.32 C ATOM 422 CE LYS A 28 -5.168 -13.326 -5.168 1.00 71.04 C ATOM 423 NZ LYS A 28 -5.489 -14.082 -3.929 1.00 41.14 N ATOM 0 H LYS A 28 -9.196 -10.341 -5.286 1.00 43.21 H new ATOM 0 HA LYS A 28 -10.131 -12.784 -6.243 1.00 61.11 H new ATOM 0 HB2 LYS A 28 -7.892 -11.795 -6.706 1.00 44.42 H new ATOM 0 HB3 LYS A 28 -7.427 -12.029 -5.032 1.00 44.42 H new ATOM 0 HG2 LYS A 28 -7.733 -14.548 -5.396 1.00 61.42 H new ATOM 0 HG3 LYS A 28 -7.953 -14.210 -7.102 1.00 61.42 H new ATOM 0 HD2 LYS A 28 -5.607 -14.879 -6.603 1.00 41.32 H new ATOM 0 HD3 LYS A 28 -5.682 -13.258 -7.264 1.00 41.32 H new ATOM 0 HE2 LYS A 28 -4.096 -13.383 -5.359 1.00 71.04 H new ATOM 0 HE3 LYS A 28 -5.410 -12.273 -5.022 1.00 71.04 H new ATOM 0 HZ1 LYS A 28 -5.925 -13.442 -3.235 1.00 41.14 H new ATOM 0 HZ2 LYS A 28 -6.151 -14.852 -4.154 1.00 41.14 H new ATOM 0 HZ3 LYS A 28 -4.616 -14.482 -3.530 1.00 41.14 H new ATOM 437 N ASN A 29 -9.297 -12.805 -3.013 1.00 32.05 N ATOM 438 CA ASN A 29 -9.415 -13.530 -1.729 1.00 4.25 C ATOM 439 C ASN A 29 -10.890 -13.775 -1.379 1.00 30.15 C ATOM 440 O ASN A 29 -11.220 -14.807 -0.810 1.00 24.12 O ATOM 441 CB ASN A 29 -8.710 -12.765 -0.566 1.00 35.25 C ATOM 442 CG ASN A 29 -7.181 -12.675 -0.707 1.00 4.41 C ATOM 443 OD1 ASN A 29 -6.543 -13.532 -1.320 1.00 34.31 O ATOM 444 ND2 ASN A 29 -6.580 -11.644 -0.123 1.00 0.25 N ATOM 0 H ASN A 29 -8.868 -11.884 -2.925 1.00 32.05 H new ATOM 0 HA ASN A 29 -8.913 -14.490 -1.852 1.00 4.25 H new ATOM 0 HB2 ASN A 29 -9.119 -11.756 -0.509 1.00 35.25 H new ATOM 0 HB3 ASN A 29 -8.948 -13.259 0.376 1.00 35.25 H new ATOM 0 HD21 ASN A 29 -5.566 -11.548 -0.176 1.00 0.25 H new ATOM 0 HD22 ASN A 29 -7.133 -10.949 0.378 1.00 0.25 H new ATOM 451 N MET A 30 -11.767 -12.820 -1.741 1.00 41.35 N ATOM 452 CA MET A 30 -13.223 -12.936 -1.503 1.00 60.52 C ATOM 453 C MET A 30 -13.861 -13.973 -2.455 1.00 53.32 C ATOM 454 O MET A 30 -14.782 -14.691 -2.063 1.00 25.23 O ATOM 455 CB MET A 30 -13.922 -11.553 -1.628 1.00 1.04 C ATOM 456 CG MET A 30 -13.470 -10.525 -0.578 1.00 22.22 C ATOM 457 SD MET A 30 -14.493 -9.033 -0.551 1.00 21.54 S ATOM 458 CE MET A 30 -14.169 -8.312 -2.161 1.00 33.43 C ATOM 0 H MET A 30 -11.493 -11.953 -2.203 1.00 41.35 H new ATOM 0 HA MET A 30 -13.368 -13.290 -0.482 1.00 60.52 H new ATOM 0 HB2 MET A 30 -13.730 -11.149 -2.622 1.00 1.04 H new ATOM 0 HB3 MET A 30 -15.000 -11.693 -1.543 1.00 1.04 H new ATOM 0 HG2 MET A 30 -13.491 -10.990 0.408 1.00 22.22 H new ATOM 0 HG3 MET A 30 -12.436 -10.244 -0.776 1.00 22.22 H new ATOM 0 HE1 MET A 30 -14.941 -7.579 -2.393 1.00 33.43 H new ATOM 0 HE2 MET A 30 -13.195 -7.823 -2.151 1.00 33.43 H new ATOM 0 HE3 MET A 30 -14.174 -9.096 -2.918 1.00 33.43 H new ATOM 468 N ILE A 31 -13.330 -14.059 -3.691 1.00 14.21 N ATOM 469 CA ILE A 31 -13.753 -15.068 -4.687 1.00 61.31 C ATOM 470 C ILE A 31 -13.300 -16.474 -4.214 1.00 1.22 C ATOM 471 O ILE A 31 -14.030 -17.450 -4.351 1.00 45.54 O ATOM 472 CB ILE A 31 -13.169 -14.746 -6.125 1.00 20.42 C ATOM 473 CG1 ILE A 31 -13.624 -13.327 -6.606 1.00 62.11 C ATOM 474 CG2 ILE A 31 -13.571 -15.830 -7.163 1.00 35.20 C ATOM 475 CD1 ILE A 31 -12.989 -12.849 -7.905 1.00 61.31 C ATOM 0 H ILE A 31 -12.598 -13.434 -4.028 1.00 14.21 H new ATOM 0 HA ILE A 31 -14.840 -15.043 -4.768 1.00 61.31 H new ATOM 0 HB ILE A 31 -12.082 -14.752 -6.044 1.00 20.42 H new ATOM 0 HG12 ILE A 31 -14.707 -13.333 -6.730 1.00 62.11 H new ATOM 0 HG13 ILE A 31 -13.397 -12.605 -5.822 1.00 62.11 H new ATOM 0 HG21 ILE A 31 -13.152 -15.575 -8.136 1.00 35.20 H new ATOM 0 HG22 ILE A 31 -13.186 -16.799 -6.845 1.00 35.20 H new ATOM 0 HG23 ILE A 31 -14.657 -15.878 -7.237 1.00 35.20 H new ATOM 0 HD11 ILE A 31 -13.369 -11.858 -8.152 1.00 61.31 H new ATOM 0 HD12 ILE A 31 -11.906 -12.804 -7.786 1.00 61.31 H new ATOM 0 HD13 ILE A 31 -13.237 -13.543 -8.708 1.00 61.31 H new ATOM 487 N GLU A 32 -12.098 -16.542 -3.617 1.00 22.35 N ATOM 488 CA GLU A 32 -11.528 -17.795 -3.065 1.00 72.21 C ATOM 489 C GLU A 32 -12.217 -18.187 -1.737 1.00 4.54 C ATOM 490 O GLU A 32 -12.255 -19.368 -1.380 1.00 3.04 O ATOM 491 CB GLU A 32 -10.003 -17.633 -2.845 1.00 11.40 C ATOM 492 CG GLU A 32 -9.202 -17.376 -4.139 1.00 22.35 C ATOM 493 CD GLU A 32 -7.734 -17.009 -3.868 1.00 74.42 C ATOM 494 OE1 GLU A 32 -6.825 -17.832 -4.132 1.00 42.24 O ATOM 495 OE2 GLU A 32 -7.486 -15.901 -3.364 1.00 65.23 O ATOM 0 H GLU A 32 -11.489 -15.732 -3.501 1.00 22.35 H new ATOM 0 HA GLU A 32 -11.705 -18.593 -3.786 1.00 72.21 H new ATOM 0 HB2 GLU A 32 -9.832 -16.807 -2.155 1.00 11.40 H new ATOM 0 HB3 GLU A 32 -9.619 -18.533 -2.366 1.00 11.40 H new ATOM 0 HG2 GLU A 32 -9.239 -18.266 -4.767 1.00 22.35 H new ATOM 0 HG3 GLU A 32 -9.676 -16.570 -4.700 1.00 22.35 H new ATOM 502 N ASP A 33 -12.752 -17.182 -1.021 1.00 14.54 N ATOM 503 CA ASP A 33 -13.397 -17.368 0.300 1.00 73.44 C ATOM 504 C ASP A 33 -14.824 -17.928 0.147 1.00 50.52 C ATOM 505 O ASP A 33 -15.214 -18.872 0.838 1.00 12.10 O ATOM 506 CB ASP A 33 -13.441 -16.005 1.050 1.00 70.02 C ATOM 507 CG ASP A 33 -14.067 -16.083 2.455 1.00 22.10 C ATOM 508 OD1 ASP A 33 -15.288 -15.842 2.595 1.00 54.21 O ATOM 509 OD2 ASP A 33 -13.334 -16.380 3.425 1.00 14.41 O ATOM 0 H ASP A 33 -12.751 -16.213 -1.340 1.00 14.54 H new ATOM 0 HA ASP A 33 -12.812 -18.087 0.874 1.00 73.44 H new ATOM 0 HB2 ASP A 33 -12.426 -15.617 1.137 1.00 70.02 H new ATOM 0 HB3 ASP A 33 -14.006 -15.290 0.451 1.00 70.02 H new ATOM 514 N ILE A 34 -15.582 -17.332 -0.783 1.00 63.13 N ATOM 515 CA ILE A 34 -17.008 -17.651 -1.000 1.00 14.43 C ATOM 516 C ILE A 34 -17.144 -18.802 -2.020 1.00 1.45 C ATOM 517 O ILE A 34 -17.966 -19.713 -1.850 1.00 12.22 O ATOM 518 CB ILE A 34 -17.784 -16.368 -1.505 1.00 54.22 C ATOM 519 CG1 ILE A 34 -17.602 -15.184 -0.489 1.00 75.31 C ATOM 520 CG2 ILE A 34 -19.290 -16.668 -1.740 1.00 41.51 C ATOM 521 CD1 ILE A 34 -18.178 -13.850 -0.941 1.00 33.22 C ATOM 0 H ILE A 34 -15.226 -16.611 -1.411 1.00 63.13 H new ATOM 0 HA ILE A 34 -17.447 -17.970 -0.055 1.00 14.43 H new ATOM 0 HB ILE A 34 -17.357 -16.074 -2.464 1.00 54.22 H new ATOM 0 HG12 ILE A 34 -18.069 -15.462 0.456 1.00 75.31 H new ATOM 0 HG13 ILE A 34 -16.538 -15.055 -0.293 1.00 75.31 H new ATOM 0 HG21 ILE A 34 -19.791 -15.764 -2.086 1.00 41.51 H new ATOM 0 HG22 ILE A 34 -19.392 -17.450 -2.492 1.00 41.51 H new ATOM 0 HG23 ILE A 34 -19.745 -17.000 -0.807 1.00 41.51 H new ATOM 0 HD11 ILE A 34 -18.002 -13.098 -0.172 1.00 33.22 H new ATOM 0 HD12 ILE A 34 -17.695 -13.541 -1.868 1.00 33.22 H new ATOM 0 HD13 ILE A 34 -19.250 -13.954 -1.107 1.00 33.22 H new ATOM 533 N GLY A 35 -16.295 -18.756 -3.058 1.00 3.52 N ATOM 534 CA GLY A 35 -16.344 -19.704 -4.174 1.00 44.12 C ATOM 535 C GLY A 35 -16.751 -19.000 -5.456 1.00 14.10 C ATOM 536 O GLY A 35 -16.487 -17.798 -5.619 1.00 2.22 O ATOM 0 H GLY A 35 -15.556 -18.059 -3.144 1.00 3.52 H new ATOM 0 HA2 GLY A 35 -15.368 -20.172 -4.304 1.00 44.12 H new ATOM 0 HA3 GLY A 35 -17.053 -20.501 -3.950 1.00 44.12 H new ATOM 540 N GLU A 36 -17.388 -19.741 -6.373 1.00 20.25 N ATOM 541 CA GLU A 36 -17.883 -19.192 -7.646 1.00 32.54 C ATOM 542 C GLU A 36 -19.229 -18.466 -7.408 1.00 2.30 C ATOM 543 O GLU A 36 -20.308 -18.987 -7.718 1.00 34.50 O ATOM 544 CB GLU A 36 -18.000 -20.329 -8.704 1.00 5.40 C ATOM 545 CG GLU A 36 -16.692 -21.129 -8.890 1.00 25.11 C ATOM 546 CD GLU A 36 -16.734 -22.103 -10.076 1.00 22.01 C ATOM 547 OE1 GLU A 36 -16.365 -21.702 -11.200 1.00 30.10 O ATOM 548 OE2 GLU A 36 -17.130 -23.271 -9.890 1.00 2.32 O ATOM 0 H GLU A 36 -17.575 -20.737 -6.255 1.00 20.25 H new ATOM 0 HA GLU A 36 -17.179 -18.458 -8.039 1.00 32.54 H new ATOM 0 HB2 GLU A 36 -18.796 -21.012 -8.407 1.00 5.40 H new ATOM 0 HB3 GLU A 36 -18.292 -19.896 -9.661 1.00 5.40 H new ATOM 0 HG2 GLU A 36 -15.866 -20.432 -9.031 1.00 25.11 H new ATOM 0 HG3 GLU A 36 -16.485 -21.688 -7.978 1.00 25.11 H new ATOM 555 N SER A 37 -19.137 -17.273 -6.788 1.00 41.05 N ATOM 556 CA SER A 37 -20.301 -16.465 -6.408 1.00 61.24 C ATOM 557 C SER A 37 -20.912 -15.779 -7.643 1.00 34.41 C ATOM 558 O SER A 37 -20.309 -14.861 -8.216 1.00 4.51 O ATOM 559 CB SER A 37 -19.885 -15.427 -5.333 1.00 31.24 C ATOM 560 OG SER A 37 -18.749 -14.681 -5.743 1.00 71.12 O ATOM 0 H SER A 37 -18.246 -16.845 -6.538 1.00 41.05 H new ATOM 0 HA SER A 37 -21.067 -17.115 -5.984 1.00 61.24 H new ATOM 0 HB2 SER A 37 -20.716 -14.749 -5.139 1.00 31.24 H new ATOM 0 HB3 SER A 37 -19.666 -15.939 -4.396 1.00 31.24 H new ATOM 0 HG SER A 37 -18.850 -14.421 -6.682 1.00 71.12 H new ATOM 566 N ASP A 38 -22.103 -16.252 -8.051 1.00 25.11 N ATOM 567 CA ASP A 38 -22.900 -15.627 -9.128 1.00 34.44 C ATOM 568 C ASP A 38 -23.499 -14.306 -8.624 1.00 64.23 C ATOM 569 O ASP A 38 -23.739 -13.386 -9.407 1.00 42.31 O ATOM 570 CB ASP A 38 -24.040 -16.570 -9.595 1.00 55.04 C ATOM 571 CG ASP A 38 -23.522 -17.940 -10.066 1.00 63.25 C ATOM 572 OD1 ASP A 38 -23.271 -18.119 -11.278 1.00 72.33 O ATOM 573 OD2 ASP A 38 -23.336 -18.837 -9.220 1.00 41.24 O ATOM 0 H ASP A 38 -22.542 -17.078 -7.645 1.00 25.11 H new ATOM 0 HA ASP A 38 -22.243 -15.436 -9.976 1.00 34.44 H new ATOM 0 HB2 ASP A 38 -24.745 -16.715 -8.776 1.00 55.04 H new ATOM 0 HB3 ASP A 38 -24.589 -16.095 -10.408 1.00 55.04 H new ATOM 578 N SER A 39 -23.726 -14.249 -7.297 1.00 14.35 N ATOM 579 CA SER A 39 -24.150 -13.033 -6.589 1.00 12.13 C ATOM 580 C SER A 39 -23.094 -11.913 -6.745 1.00 12.13 C ATOM 581 O SER A 39 -21.888 -12.194 -6.652 1.00 62.52 O ATOM 582 CB SER A 39 -24.367 -13.353 -5.088 1.00 34.25 C ATOM 583 OG SER A 39 -25.332 -14.376 -4.925 1.00 41.44 O ATOM 0 H SER A 39 -23.618 -15.057 -6.683 1.00 14.35 H new ATOM 0 HA SER A 39 -25.087 -12.684 -7.024 1.00 12.13 H new ATOM 0 HB2 SER A 39 -23.424 -13.662 -4.638 1.00 34.25 H new ATOM 0 HB3 SER A 39 -24.691 -12.454 -4.563 1.00 34.25 H new ATOM 0 HG SER A 39 -25.452 -14.563 -3.971 1.00 41.44 H new ATOM 589 N PRO A 40 -23.529 -10.641 -7.011 1.00 54.21 N ATOM 590 CA PRO A 40 -22.605 -9.486 -7.131 1.00 63.32 C ATOM 591 C PRO A 40 -21.965 -9.120 -5.772 1.00 64.22 C ATOM 592 O PRO A 40 -22.621 -9.229 -4.726 1.00 22.14 O ATOM 593 CB PRO A 40 -23.532 -8.366 -7.660 1.00 54.34 C ATOM 594 CG PRO A 40 -24.896 -8.726 -7.171 1.00 63.53 C ATOM 595 CD PRO A 40 -24.950 -10.233 -7.216 1.00 71.14 C ATOM 0 HA PRO A 40 -21.753 -9.678 -7.783 1.00 63.32 H new ATOM 0 HB2 PRO A 40 -23.224 -7.390 -7.286 1.00 54.34 H new ATOM 0 HB3 PRO A 40 -23.505 -8.313 -8.748 1.00 54.34 H new ATOM 0 HG2 PRO A 40 -25.061 -8.357 -6.159 1.00 63.53 H new ATOM 0 HG3 PRO A 40 -25.669 -8.286 -7.801 1.00 63.53 H new ATOM 0 HD2 PRO A 40 -25.599 -10.634 -6.437 1.00 71.14 H new ATOM 0 HD3 PRO A 40 -25.337 -10.592 -8.170 1.00 71.14 H new ATOM 603 N ILE A 41 -20.681 -8.711 -5.798 1.00 21.03 N ATOM 604 CA ILE A 41 -19.908 -8.418 -4.577 1.00 21.43 C ATOM 605 C ILE A 41 -19.782 -6.882 -4.401 1.00 11.52 C ATOM 606 O ILE A 41 -18.985 -6.240 -5.099 1.00 24.14 O ATOM 607 CB ILE A 41 -18.479 -9.097 -4.617 1.00 62.42 C ATOM 608 CG1 ILE A 41 -18.591 -10.642 -4.878 1.00 0.42 C ATOM 609 CG2 ILE A 41 -17.684 -8.817 -3.313 1.00 55.33 C ATOM 610 CD1 ILE A 41 -19.366 -11.428 -3.816 1.00 73.12 C ATOM 0 H ILE A 41 -20.154 -8.575 -6.661 1.00 21.03 H new ATOM 0 HA ILE A 41 -20.439 -8.837 -3.722 1.00 21.43 H new ATOM 0 HB ILE A 41 -17.930 -8.653 -5.447 1.00 62.42 H new ATOM 0 HG12 ILE A 41 -19.071 -10.797 -5.844 1.00 0.42 H new ATOM 0 HG13 ILE A 41 -17.585 -11.056 -4.951 1.00 0.42 H new ATOM 0 HG21 ILE A 41 -16.707 -9.297 -3.372 1.00 55.33 H new ATOM 0 HG22 ILE A 41 -17.553 -7.742 -3.190 1.00 55.33 H new ATOM 0 HG23 ILE A 41 -18.233 -9.215 -2.460 1.00 55.33 H new ATOM 0 HD11 ILE A 41 -19.387 -12.483 -4.087 1.00 73.12 H new ATOM 0 HD12 ILE A 41 -18.878 -11.312 -2.849 1.00 73.12 H new ATOM 0 HD13 ILE A 41 -20.386 -11.049 -3.755 1.00 73.12 H new ATOM 622 N PRO A 42 -20.595 -6.263 -3.486 1.00 35.34 N ATOM 623 CA PRO A 42 -20.534 -4.816 -3.226 1.00 71.31 C ATOM 624 C PRO A 42 -19.377 -4.448 -2.265 1.00 15.22 C ATOM 625 O PRO A 42 -19.123 -5.146 -1.270 1.00 43.55 O ATOM 626 CB PRO A 42 -21.915 -4.523 -2.599 1.00 43.12 C ATOM 627 CG PRO A 42 -22.270 -5.780 -1.859 1.00 10.20 C ATOM 628 CD PRO A 42 -21.639 -6.924 -2.640 1.00 51.11 C ATOM 0 HA PRO A 42 -20.335 -4.229 -4.123 1.00 71.31 H new ATOM 0 HB2 PRO A 42 -21.871 -3.666 -1.927 1.00 43.12 H new ATOM 0 HB3 PRO A 42 -22.656 -4.291 -3.364 1.00 43.12 H new ATOM 0 HG2 PRO A 42 -21.891 -5.751 -0.837 1.00 10.20 H new ATOM 0 HG3 PRO A 42 -23.351 -5.902 -1.795 1.00 10.20 H new ATOM 0 HD2 PRO A 42 -21.200 -7.666 -1.973 1.00 51.11 H new ATOM 0 HD3 PRO A 42 -22.377 -7.443 -3.252 1.00 51.11 H new ATOM 636 N LEU A 43 -18.659 -3.374 -2.606 1.00 64.13 N ATOM 637 CA LEU A 43 -17.628 -2.758 -1.760 1.00 62.22 C ATOM 638 C LEU A 43 -18.223 -1.465 -1.130 1.00 50.42 C ATOM 639 O LEU A 43 -18.225 -0.408 -1.774 1.00 52.10 O ATOM 640 CB LEU A 43 -16.370 -2.450 -2.624 1.00 43.20 C ATOM 641 CG LEU A 43 -15.778 -3.659 -3.425 1.00 45.21 C ATOM 642 CD1 LEU A 43 -14.582 -3.227 -4.296 1.00 2.23 C ATOM 643 CD2 LEU A 43 -15.402 -4.829 -2.495 1.00 75.10 C ATOM 0 H LEU A 43 -18.780 -2.896 -3.499 1.00 64.13 H new ATOM 0 HA LEU A 43 -17.323 -3.431 -0.958 1.00 62.22 H new ATOM 0 HB2 LEU A 43 -16.623 -1.660 -3.331 1.00 43.20 H new ATOM 0 HB3 LEU A 43 -15.592 -2.056 -1.970 1.00 43.20 H new ATOM 0 HG LEU A 43 -16.560 -4.016 -4.095 1.00 45.21 H new ATOM 0 HD11 LEU A 43 -14.196 -4.090 -4.838 1.00 2.23 H new ATOM 0 HD12 LEU A 43 -14.906 -2.467 -5.007 1.00 2.23 H new ATOM 0 HD13 LEU A 43 -13.798 -2.818 -3.660 1.00 2.23 H new ATOM 0 HD21 LEU A 43 -14.995 -5.648 -3.087 1.00 75.10 H new ATOM 0 HD22 LEU A 43 -14.655 -4.496 -1.775 1.00 75.10 H new ATOM 0 HD23 LEU A 43 -16.290 -5.171 -1.964 1.00 75.10 H new ATOM 655 N PRO A 44 -18.770 -1.535 0.133 1.00 51.41 N ATOM 656 CA PRO A 44 -19.540 -0.423 0.763 1.00 11.14 C ATOM 657 C PRO A 44 -18.649 0.665 1.429 1.00 44.23 C ATOM 658 O PRO A 44 -18.978 1.184 2.503 1.00 53.54 O ATOM 659 CB PRO A 44 -20.394 -1.196 1.797 1.00 44.30 C ATOM 660 CG PRO A 44 -19.497 -2.297 2.267 1.00 71.54 C ATOM 661 CD PRO A 44 -18.692 -2.718 1.049 1.00 13.23 C ATOM 0 HA PRO A 44 -20.114 0.160 0.043 1.00 11.14 H new ATOM 0 HB2 PRO A 44 -20.699 -0.552 2.622 1.00 44.30 H new ATOM 0 HB3 PRO A 44 -21.305 -1.590 1.346 1.00 44.30 H new ATOM 0 HG2 PRO A 44 -18.843 -1.954 3.069 1.00 71.54 H new ATOM 0 HG3 PRO A 44 -20.076 -3.132 2.662 1.00 71.54 H new ATOM 0 HD2 PRO A 44 -17.660 -2.950 1.314 1.00 13.23 H new ATOM 0 HD3 PRO A 44 -19.110 -3.611 0.584 1.00 13.23 H new ATOM 669 N ASN A 45 -17.554 1.045 0.744 1.00 12.33 N ATOM 670 CA ASN A 45 -16.615 2.089 1.226 1.00 50.44 C ATOM 671 C ASN A 45 -16.112 2.929 0.039 1.00 25.45 C ATOM 672 O ASN A 45 -16.286 4.154 0.012 1.00 72.24 O ATOM 673 CB ASN A 45 -15.408 1.456 1.972 1.00 1.32 C ATOM 674 CG ASN A 45 -14.434 2.491 2.563 1.00 4.33 C ATOM 675 OD1 ASN A 45 -14.830 3.578 2.986 1.00 2.52 O ATOM 676 ND2 ASN A 45 -13.158 2.157 2.604 1.00 3.00 N ATOM 0 H ASN A 45 -17.292 0.642 -0.156 1.00 12.33 H new ATOM 0 HA ASN A 45 -17.150 2.731 1.926 1.00 50.44 H new ATOM 0 HB2 ASN A 45 -15.781 0.821 2.776 1.00 1.32 H new ATOM 0 HB3 ASN A 45 -14.864 0.811 1.282 1.00 1.32 H new ATOM 0 HD21 ASN A 45 -12.473 2.805 2.993 1.00 3.00 H new ATOM 0 HD22 ASN A 45 -12.856 1.250 2.247 1.00 3.00 H new ATOM 683 N VAL A 46 -15.498 2.248 -0.943 1.00 12.04 N ATOM 684 CA VAL A 46 -14.913 2.905 -2.128 1.00 22.14 C ATOM 685 C VAL A 46 -16.036 3.406 -3.067 1.00 13.14 C ATOM 686 O VAL A 46 -16.942 2.648 -3.417 1.00 55.03 O ATOM 687 CB VAL A 46 -13.905 1.949 -2.885 1.00 71.12 C ATOM 688 CG1 VAL A 46 -14.568 0.622 -3.316 1.00 1.53 C ATOM 689 CG2 VAL A 46 -13.236 2.665 -4.088 1.00 23.35 C ATOM 0 H VAL A 46 -15.393 1.233 -0.940 1.00 12.04 H new ATOM 0 HA VAL A 46 -14.337 3.767 -1.792 1.00 22.14 H new ATOM 0 HB VAL A 46 -13.120 1.694 -2.173 1.00 71.12 H new ATOM 0 HG11 VAL A 46 -13.836 0.000 -3.831 1.00 1.53 H new ATOM 0 HG12 VAL A 46 -14.935 0.096 -2.435 1.00 1.53 H new ATOM 0 HG13 VAL A 46 -15.401 0.833 -3.986 1.00 1.53 H new ATOM 0 HG21 VAL A 46 -12.550 1.979 -4.584 1.00 23.35 H new ATOM 0 HG22 VAL A 46 -14.003 2.985 -4.793 1.00 23.35 H new ATOM 0 HG23 VAL A 46 -12.684 3.535 -3.733 1.00 23.35 H new ATOM 699 N THR A 47 -15.979 4.699 -3.440 1.00 4.00 N ATOM 700 CA THR A 47 -17.012 5.356 -4.264 1.00 2.24 C ATOM 701 C THR A 47 -16.912 4.930 -5.738 1.00 20.42 C ATOM 702 O THR A 47 -15.951 4.264 -6.136 1.00 1.24 O ATOM 703 CB THR A 47 -16.892 6.905 -4.148 1.00 41.10 C ATOM 704 OG1 THR A 47 -15.563 7.310 -4.507 1.00 14.01 O ATOM 705 CG2 THR A 47 -17.209 7.392 -2.725 1.00 41.23 C ATOM 0 H THR A 47 -15.213 5.319 -3.178 1.00 4.00 H new ATOM 0 HA THR A 47 -17.985 5.042 -3.887 1.00 2.24 H new ATOM 0 HB THR A 47 -17.618 7.351 -4.827 1.00 41.10 H new ATOM 0 HG1 THR A 47 -15.488 8.284 -4.436 1.00 14.01 H new ATOM 0 HG21 THR A 47 -17.115 8.477 -2.682 1.00 41.23 H new ATOM 0 HG22 THR A 47 -18.227 7.105 -2.461 1.00 41.23 H new ATOM 0 HG23 THR A 47 -16.510 6.939 -2.021 1.00 41.23 H new ATOM 713 N SER A 48 -17.921 5.327 -6.533 1.00 12.23 N ATOM 714 CA SER A 48 -18.049 4.940 -7.948 1.00 71.14 C ATOM 715 C SER A 48 -16.892 5.464 -8.796 1.00 41.22 C ATOM 716 O SER A 48 -16.293 4.709 -9.561 1.00 61.35 O ATOM 717 CB SER A 48 -19.376 5.463 -8.503 1.00 10.35 C ATOM 718 OG SER A 48 -19.514 6.855 -8.262 1.00 31.10 O ATOM 0 H SER A 48 -18.677 5.930 -6.208 1.00 12.23 H new ATOM 0 HA SER A 48 -18.023 3.851 -7.997 1.00 71.14 H new ATOM 0 HB2 SER A 48 -19.428 5.269 -9.574 1.00 10.35 H new ATOM 0 HB3 SER A 48 -20.205 4.926 -8.041 1.00 10.35 H new ATOM 0 HG SER A 48 -20.461 7.072 -8.132 1.00 31.10 H new ATOM 724 N THR A 49 -16.591 6.756 -8.625 1.00 73.25 N ATOM 725 CA THR A 49 -15.537 7.454 -9.366 1.00 2.35 C ATOM 726 C THR A 49 -14.176 6.757 -9.173 1.00 5.24 C ATOM 727 O THR A 49 -13.474 6.467 -10.140 1.00 5.52 O ATOM 728 CB THR A 49 -15.453 8.945 -8.899 1.00 61.14 C ATOM 729 OG1 THR A 49 -15.227 8.984 -7.478 1.00 24.04 O ATOM 730 CG2 THR A 49 -16.746 9.726 -9.219 1.00 22.32 C ATOM 0 H THR A 49 -17.080 7.354 -7.959 1.00 73.25 H new ATOM 0 HA THR A 49 -15.785 7.426 -10.427 1.00 2.35 H new ATOM 0 HB THR A 49 -14.631 9.415 -9.438 1.00 61.14 H new ATOM 0 HG1 THR A 49 -15.172 9.916 -7.181 1.00 24.04 H new ATOM 0 HG21 THR A 49 -16.643 10.756 -8.877 1.00 22.32 H new ATOM 0 HG22 THR A 49 -16.920 9.716 -10.295 1.00 22.32 H new ATOM 0 HG23 THR A 49 -17.589 9.258 -8.711 1.00 22.32 H new ATOM 738 N ILE A 50 -13.866 6.424 -7.913 1.00 30.20 N ATOM 739 CA ILE A 50 -12.570 5.856 -7.527 1.00 25.11 C ATOM 740 C ILE A 50 -12.468 4.383 -7.952 1.00 54.12 C ATOM 741 O ILE A 50 -11.470 3.983 -8.558 1.00 1.24 O ATOM 742 CB ILE A 50 -12.336 6.015 -5.980 1.00 70.01 C ATOM 743 CG1 ILE A 50 -12.471 7.516 -5.571 1.00 22.35 C ATOM 744 CG2 ILE A 50 -10.967 5.441 -5.542 1.00 1.14 C ATOM 745 CD1 ILE A 50 -11.538 8.469 -6.311 1.00 73.11 C ATOM 0 H ILE A 50 -14.510 6.542 -7.131 1.00 30.20 H new ATOM 0 HA ILE A 50 -11.787 6.407 -8.047 1.00 25.11 H new ATOM 0 HB ILE A 50 -13.102 5.438 -5.462 1.00 70.01 H new ATOM 0 HG12 ILE A 50 -13.500 7.833 -5.741 1.00 22.35 H new ATOM 0 HG13 ILE A 50 -12.283 7.604 -4.501 1.00 22.35 H new ATOM 0 HG21 ILE A 50 -10.845 5.571 -4.467 1.00 1.14 H new ATOM 0 HG22 ILE A 50 -10.922 4.380 -5.787 1.00 1.14 H new ATOM 0 HG23 ILE A 50 -10.168 5.968 -6.064 1.00 1.14 H new ATOM 0 HD11 ILE A 50 -11.705 9.487 -5.960 1.00 73.11 H new ATOM 0 HD12 ILE A 50 -10.503 8.185 -6.122 1.00 73.11 H new ATOM 0 HD13 ILE A 50 -11.739 8.417 -7.381 1.00 73.11 H new ATOM 757 N LEU A 51 -13.529 3.602 -7.666 1.00 32.23 N ATOM 758 CA LEU A 51 -13.576 2.158 -7.978 1.00 13.45 C ATOM 759 C LEU A 51 -13.507 1.923 -9.501 1.00 4.31 C ATOM 760 O LEU A 51 -12.857 0.975 -9.947 1.00 50.32 O ATOM 761 CB LEU A 51 -14.849 1.484 -7.379 1.00 22.32 C ATOM 762 CG LEU A 51 -14.937 -0.074 -7.536 1.00 30.02 C ATOM 763 CD1 LEU A 51 -13.697 -0.778 -6.926 1.00 25.34 C ATOM 764 CD2 LEU A 51 -16.251 -0.632 -6.931 1.00 73.01 C ATOM 0 H LEU A 51 -14.374 3.952 -7.214 1.00 32.23 H new ATOM 0 HA LEU A 51 -12.704 1.695 -7.516 1.00 13.45 H new ATOM 0 HB2 LEU A 51 -14.899 1.726 -6.317 1.00 22.32 H new ATOM 0 HB3 LEU A 51 -15.727 1.927 -7.849 1.00 22.32 H new ATOM 0 HG LEU A 51 -14.947 -0.291 -8.604 1.00 30.02 H new ATOM 0 HD11 LEU A 51 -13.792 -1.856 -7.053 1.00 25.34 H new ATOM 0 HD12 LEU A 51 -12.796 -0.431 -7.432 1.00 25.34 H new ATOM 0 HD13 LEU A 51 -13.630 -0.542 -5.864 1.00 25.34 H new ATOM 0 HD21 LEU A 51 -16.279 -1.714 -7.057 1.00 73.01 H new ATOM 0 HD22 LEU A 51 -16.295 -0.389 -5.869 1.00 73.01 H new ATOM 0 HD23 LEU A 51 -17.105 -0.185 -7.441 1.00 73.01 H new ATOM 776 N GLU A 52 -14.154 2.819 -10.280 1.00 75.13 N ATOM 777 CA GLU A 52 -14.129 2.776 -11.758 1.00 75.02 C ATOM 778 C GLU A 52 -12.685 2.879 -12.256 1.00 32.22 C ATOM 779 O GLU A 52 -12.237 2.048 -13.044 1.00 74.41 O ATOM 780 CB GLU A 52 -14.960 3.940 -12.373 1.00 41.44 C ATOM 781 CG GLU A 52 -15.072 3.890 -13.914 1.00 13.54 C ATOM 782 CD GLU A 52 -15.738 5.134 -14.516 1.00 64.12 C ATOM 783 OE1 GLU A 52 -16.978 5.266 -14.429 1.00 72.31 O ATOM 784 OE2 GLU A 52 -15.021 5.997 -15.075 1.00 74.31 O ATOM 0 H GLU A 52 -14.706 3.589 -9.903 1.00 75.13 H new ATOM 0 HA GLU A 52 -14.569 1.829 -12.071 1.00 75.02 H new ATOM 0 HB2 GLU A 52 -15.963 3.922 -11.946 1.00 41.44 H new ATOM 0 HB3 GLU A 52 -14.507 4.888 -12.083 1.00 41.44 H new ATOM 0 HG2 GLU A 52 -14.075 3.778 -14.340 1.00 13.54 H new ATOM 0 HG3 GLU A 52 -15.642 3.007 -14.201 1.00 13.54 H new ATOM 791 N LYS A 53 -11.974 3.888 -11.727 1.00 64.20 N ATOM 792 CA LYS A 53 -10.594 4.212 -12.118 1.00 62.05 C ATOM 793 C LYS A 53 -9.621 3.080 -11.763 1.00 65.20 C ATOM 794 O LYS A 53 -8.788 2.693 -12.587 1.00 31.55 O ATOM 795 CB LYS A 53 -10.131 5.524 -11.440 1.00 30.20 C ATOM 796 CG LYS A 53 -10.890 6.793 -11.878 1.00 32.15 C ATOM 797 CD LYS A 53 -10.247 8.081 -11.319 1.00 0.30 C ATOM 798 CE LYS A 53 -8.821 8.286 -11.855 1.00 50.25 C ATOM 799 NZ LYS A 53 -8.799 8.341 -13.339 1.00 25.11 N ATOM 0 H LYS A 53 -12.346 4.508 -11.008 1.00 64.20 H new ATOM 0 HA LYS A 53 -10.588 4.340 -13.200 1.00 62.05 H new ATOM 0 HB2 LYS A 53 -10.235 5.413 -10.361 1.00 30.20 H new ATOM 0 HB3 LYS A 53 -9.070 5.666 -11.646 1.00 30.20 H new ATOM 0 HG2 LYS A 53 -10.912 6.843 -12.967 1.00 32.15 H new ATOM 0 HG3 LYS A 53 -11.925 6.730 -11.541 1.00 32.15 H new ATOM 0 HD2 LYS A 53 -10.863 8.940 -11.586 1.00 0.30 H new ATOM 0 HD3 LYS A 53 -10.223 8.032 -10.230 1.00 0.30 H new ATOM 0 HE2 LYS A 53 -8.408 9.210 -11.450 1.00 50.25 H new ATOM 0 HE3 LYS A 53 -8.182 7.473 -11.511 1.00 50.25 H new ATOM 0 HZ1 LYS A 53 -7.875 8.695 -13.660 1.00 25.11 H new ATOM 0 HZ2 LYS A 53 -8.957 7.388 -13.724 1.00 25.11 H new ATOM 0 HZ3 LYS A 53 -9.549 8.978 -13.674 1.00 25.11 H new ATOM 813 N VAL A 54 -9.735 2.574 -10.524 1.00 43.41 N ATOM 814 CA VAL A 54 -8.871 1.506 -9.998 1.00 55.35 C ATOM 815 C VAL A 54 -9.024 0.229 -10.855 1.00 51.22 C ATOM 816 O VAL A 54 -8.027 -0.378 -11.265 1.00 21.33 O ATOM 817 CB VAL A 54 -9.189 1.229 -8.471 1.00 4.42 C ATOM 818 CG1 VAL A 54 -8.451 -0.017 -7.935 1.00 64.44 C ATOM 819 CG2 VAL A 54 -8.840 2.470 -7.605 1.00 55.10 C ATOM 0 H VAL A 54 -10.434 2.897 -9.855 1.00 43.41 H new ATOM 0 HA VAL A 54 -7.832 1.828 -10.059 1.00 55.35 H new ATOM 0 HB VAL A 54 -10.259 1.031 -8.401 1.00 4.42 H new ATOM 0 HG11 VAL A 54 -8.702 -0.164 -6.885 1.00 64.44 H new ATOM 0 HG12 VAL A 54 -8.755 -0.894 -8.507 1.00 64.44 H new ATOM 0 HG13 VAL A 54 -7.375 0.126 -8.035 1.00 64.44 H new ATOM 0 HG21 VAL A 54 -9.066 2.259 -6.560 1.00 55.10 H new ATOM 0 HG22 VAL A 54 -7.779 2.699 -7.708 1.00 55.10 H new ATOM 0 HG23 VAL A 54 -9.430 3.324 -7.939 1.00 55.10 H new ATOM 829 N LEU A 55 -10.283 -0.115 -11.172 1.00 14.13 N ATOM 830 CA LEU A 55 -10.617 -1.276 -12.022 1.00 71.54 C ATOM 831 C LEU A 55 -10.206 -1.038 -13.495 1.00 15.31 C ATOM 832 O LEU A 55 -9.848 -1.987 -14.193 1.00 42.41 O ATOM 833 CB LEU A 55 -12.137 -1.601 -11.924 1.00 32.23 C ATOM 834 CG LEU A 55 -12.652 -2.143 -10.549 1.00 63.24 C ATOM 835 CD1 LEU A 55 -14.176 -2.415 -10.594 1.00 32.35 C ATOM 836 CD2 LEU A 55 -11.866 -3.400 -10.096 1.00 75.23 C ATOM 0 H LEU A 55 -11.100 0.402 -10.848 1.00 14.13 H new ATOM 0 HA LEU A 55 -10.050 -2.132 -11.655 1.00 71.54 H new ATOM 0 HB2 LEU A 55 -12.695 -0.696 -12.163 1.00 32.23 H new ATOM 0 HB3 LEU A 55 -12.378 -2.336 -12.692 1.00 32.23 H new ATOM 0 HG LEU A 55 -12.473 -1.368 -9.804 1.00 63.24 H new ATOM 0 HD11 LEU A 55 -14.507 -2.791 -9.626 1.00 32.35 H new ATOM 0 HD12 LEU A 55 -14.704 -1.490 -10.824 1.00 32.35 H new ATOM 0 HD13 LEU A 55 -14.391 -3.156 -11.364 1.00 32.35 H new ATOM 0 HD21 LEU A 55 -12.253 -3.746 -9.138 1.00 75.23 H new ATOM 0 HD22 LEU A 55 -11.981 -4.189 -10.840 1.00 75.23 H new ATOM 0 HD23 LEU A 55 -10.810 -3.151 -9.992 1.00 75.23 H new ATOM 848 N ASP A 56 -10.265 0.234 -13.948 1.00 22.11 N ATOM 849 CA ASP A 56 -9.959 0.620 -15.351 1.00 43.02 C ATOM 850 C ASP A 56 -8.439 0.606 -15.615 1.00 61.24 C ATOM 851 O ASP A 56 -7.999 0.318 -16.736 1.00 33.01 O ATOM 852 CB ASP A 56 -10.572 2.005 -15.710 1.00 70.25 C ATOM 853 CG ASP A 56 -10.526 2.329 -17.224 1.00 52.13 C ATOM 854 OD1 ASP A 56 -11.257 1.674 -17.998 1.00 61.44 O ATOM 855 OD2 ASP A 56 -9.764 3.229 -17.642 1.00 2.01 O ATOM 0 H ASP A 56 -10.525 1.023 -13.356 1.00 22.11 H new ATOM 0 HA ASP A 56 -10.421 -0.124 -16.000 1.00 43.02 H new ATOM 0 HB2 ASP A 56 -11.608 2.033 -15.372 1.00 70.25 H new ATOM 0 HB3 ASP A 56 -10.037 2.782 -15.164 1.00 70.25 H new ATOM 860 N TYR A 57 -7.642 0.931 -14.580 1.00 12.51 N ATOM 861 CA TYR A 57 -6.172 0.859 -14.661 1.00 64.13 C ATOM 862 C TYR A 57 -5.719 -0.603 -14.595 1.00 23.14 C ATOM 863 O TYR A 57 -4.776 -1.001 -15.291 1.00 74.33 O ATOM 864 CB TYR A 57 -5.488 1.687 -13.540 1.00 35.00 C ATOM 865 CG TYR A 57 -3.941 1.622 -13.584 1.00 43.31 C ATOM 866 CD1 TYR A 57 -3.221 0.669 -12.840 1.00 12.50 C ATOM 867 CD2 TYR A 57 -3.210 2.463 -14.424 1.00 3.12 C ATOM 868 CE1 TYR A 57 -1.850 0.563 -12.938 1.00 72.03 C ATOM 869 CE2 TYR A 57 -1.835 2.369 -14.509 1.00 74.51 C ATOM 870 CZ TYR A 57 -1.162 1.415 -13.771 1.00 32.13 C ATOM 871 OH TYR A 57 0.202 1.285 -13.891 1.00 5.11 O ATOM 0 H TYR A 57 -7.993 1.247 -13.676 1.00 12.51 H new ATOM 0 HA TYR A 57 -5.869 1.292 -15.614 1.00 64.13 H new ATOM 0 HB2 TYR A 57 -5.803 2.727 -13.623 1.00 35.00 H new ATOM 0 HB3 TYR A 57 -5.832 1.326 -12.571 1.00 35.00 H new ATOM 0 HD1 TYR A 57 -3.755 0.005 -12.177 1.00 12.50 H new ATOM 0 HD2 TYR A 57 -3.729 3.201 -15.018 1.00 3.12 H new ATOM 0 HE1 TYR A 57 -1.320 -0.183 -12.365 1.00 72.03 H new ATOM 0 HE2 TYR A 57 -1.286 3.041 -15.152 1.00 74.51 H new ATOM 0 HH TYR A 57 0.495 1.682 -14.738 1.00 5.11 H new ATOM 881 N CYS A 58 -6.382 -1.387 -13.727 1.00 74.33 N ATOM 882 CA CYS A 58 -6.119 -2.828 -13.589 1.00 40.11 C ATOM 883 C CYS A 58 -6.481 -3.568 -14.893 1.00 14.13 C ATOM 884 O CYS A 58 -5.770 -4.487 -15.301 1.00 20.31 O ATOM 885 CB CYS A 58 -6.886 -3.414 -12.385 1.00 2.24 C ATOM 886 SG CYS A 58 -6.355 -2.745 -10.795 1.00 24.21 S ATOM 0 H CYS A 58 -7.112 -1.040 -13.104 1.00 74.33 H new ATOM 0 HA CYS A 58 -5.054 -2.968 -13.403 1.00 40.11 H new ATOM 0 HB2 CYS A 58 -7.951 -3.220 -12.514 1.00 2.24 H new ATOM 0 HB3 CYS A 58 -6.758 -4.496 -12.375 1.00 2.24 H new ATOM 0 HG CYS A 58 -6.800 -1.530 -10.665 1.00 24.21 H new ATOM 892 N ARG A 59 -7.578 -3.132 -15.557 1.00 4.12 N ATOM 893 CA ARG A 59 -8.030 -3.725 -16.838 1.00 55.03 C ATOM 894 C ARG A 59 -7.080 -3.315 -17.975 1.00 32.55 C ATOM 895 O ARG A 59 -6.818 -4.104 -18.874 1.00 51.23 O ATOM 896 CB ARG A 59 -9.528 -3.378 -17.140 1.00 53.32 C ATOM 897 CG ARG A 59 -9.822 -2.099 -17.951 1.00 4.22 C ATOM 898 CD ARG A 59 -11.339 -1.816 -18.061 1.00 25.01 C ATOM 899 NE ARG A 59 -12.107 -2.994 -18.519 1.00 44.43 N ATOM 900 CZ ARG A 59 -13.423 -3.201 -18.313 1.00 51.31 C ATOM 901 NH1 ARG A 59 -14.174 -2.301 -17.658 1.00 1.34 N ATOM 902 NH2 ARG A 59 -13.977 -4.337 -18.731 1.00 32.30 N ATOM 0 H ARG A 59 -8.168 -2.369 -15.225 1.00 4.12 H new ATOM 0 HA ARG A 59 -7.990 -4.811 -16.755 1.00 55.03 H new ATOM 0 HB2 ARG A 59 -9.966 -4.221 -17.674 1.00 53.32 H new ATOM 0 HB3 ARG A 59 -10.052 -3.298 -16.187 1.00 53.32 H new ATOM 0 HG2 ARG A 59 -9.328 -1.249 -17.479 1.00 4.22 H new ATOM 0 HG3 ARG A 59 -9.399 -2.199 -18.951 1.00 4.22 H new ATOM 0 HD2 ARG A 59 -11.716 -1.497 -17.090 1.00 25.01 H new ATOM 0 HD3 ARG A 59 -11.501 -0.990 -18.753 1.00 25.01 H new ATOM 0 HE ARG A 59 -11.597 -3.711 -19.035 1.00 44.43 H new ATOM 0 HH11 ARG A 59 -13.750 -1.442 -17.306 1.00 1.34 H new ATOM 0 HH12 ARG A 59 -15.168 -2.476 -17.512 1.00 1.34 H new ATOM 0 HH21 ARG A 59 -13.407 -5.040 -19.202 1.00 32.30 H new ATOM 0 HH22 ARG A 59 -14.972 -4.505 -18.581 1.00 32.30 H new ATOM 916 N HIS A 60 -6.548 -2.079 -17.882 1.00 41.52 N ATOM 917 CA HIS A 60 -5.480 -1.564 -18.771 1.00 21.21 C ATOM 918 C HIS A 60 -4.227 -2.453 -18.680 1.00 21.01 C ATOM 919 O HIS A 60 -3.653 -2.858 -19.700 1.00 12.23 O ATOM 920 CB HIS A 60 -5.155 -0.086 -18.381 1.00 61.42 C ATOM 921 CG HIS A 60 -3.820 0.454 -18.852 1.00 32.23 C ATOM 922 ND1 HIS A 60 -3.610 0.959 -20.110 1.00 65.42 N ATOM 923 CD2 HIS A 60 -2.627 0.569 -18.203 1.00 64.23 C ATOM 924 CE1 HIS A 60 -2.357 1.361 -20.218 1.00 14.51 C ATOM 925 NE2 HIS A 60 -1.742 1.131 -19.078 1.00 24.04 N ATOM 0 H HIS A 60 -6.849 -1.402 -17.181 1.00 41.52 H new ATOM 0 HA HIS A 60 -5.823 -1.587 -19.805 1.00 21.21 H new ATOM 0 HB2 HIS A 60 -5.943 0.554 -18.779 1.00 61.42 H new ATOM 0 HB3 HIS A 60 -5.194 -0.002 -17.295 1.00 61.42 H new ATOM 0 HD2 HIS A 60 -2.420 0.271 -17.186 1.00 64.23 H new ATOM 0 HE1 HIS A 60 -1.911 1.805 -21.096 1.00 14.51 H new ATOM 0 HE2 HIS A 60 -0.763 1.339 -18.880 1.00 24.04 H new ATOM 934 N HIS A 61 -3.840 -2.760 -17.433 1.00 21.05 N ATOM 935 CA HIS A 61 -2.633 -3.545 -17.127 1.00 1.00 C ATOM 936 C HIS A 61 -2.897 -5.050 -17.355 1.00 34.52 C ATOM 937 O HIS A 61 -1.962 -5.844 -17.389 1.00 21.14 O ATOM 938 CB HIS A 61 -2.187 -3.270 -15.660 1.00 44.23 C ATOM 939 CG HIS A 61 -0.745 -3.628 -15.371 1.00 32.00 C ATOM 940 ND1 HIS A 61 -0.279 -4.924 -15.338 1.00 62.23 N ATOM 941 CD2 HIS A 61 0.331 -2.842 -15.117 1.00 45.52 C ATOM 942 CE1 HIS A 61 1.012 -4.923 -15.090 1.00 63.40 C ATOM 943 NE2 HIS A 61 1.406 -3.675 -14.950 1.00 63.43 N ATOM 0 H HIS A 61 -4.358 -2.470 -16.604 1.00 21.05 H new ATOM 0 HA HIS A 61 -1.828 -3.243 -17.797 1.00 1.00 H new ATOM 0 HB2 HIS A 61 -2.339 -2.214 -15.438 1.00 44.23 H new ATOM 0 HB3 HIS A 61 -2.831 -3.833 -14.985 1.00 44.23 H new ATOM 0 HD1 HIS A 61 -0.849 -5.757 -15.484 1.00 62.23 H new ATOM 0 HD2 HIS A 61 0.339 -1.764 -15.058 1.00 45.52 H new ATOM 0 HE1 HIS A 61 1.642 -5.797 -15.014 1.00 63.40 H new ATOM 952 N HIS A 62 -4.180 -5.441 -17.464 1.00 21.15 N ATOM 953 CA HIS A 62 -4.565 -6.832 -17.763 1.00 52.10 C ATOM 954 C HIS A 62 -4.489 -7.098 -19.276 1.00 40.32 C ATOM 955 O HIS A 62 -4.096 -8.189 -19.706 1.00 51.40 O ATOM 956 CB HIS A 62 -5.985 -7.138 -17.231 1.00 1.51 C ATOM 957 CG HIS A 62 -6.327 -8.599 -17.290 1.00 52.12 C ATOM 958 ND1 HIS A 62 -5.765 -9.514 -16.430 1.00 30.32 N ATOM 959 CD2 HIS A 62 -7.108 -9.316 -18.137 1.00 43.22 C ATOM 960 CE1 HIS A 62 -6.173 -10.719 -16.747 1.00 0.41 C ATOM 961 NE2 HIS A 62 -6.989 -10.632 -17.779 1.00 61.21 N ATOM 0 H HIS A 62 -4.972 -4.808 -17.349 1.00 21.15 H new ATOM 0 HA HIS A 62 -3.863 -7.495 -17.258 1.00 52.10 H new ATOM 0 HB2 HIS A 62 -6.064 -6.793 -16.200 1.00 1.51 H new ATOM 0 HB3 HIS A 62 -6.715 -6.575 -17.813 1.00 1.51 H new ATOM 0 HD1 HIS A 62 -5.129 -9.290 -15.664 1.00 30.32 H new ATOM 0 HD2 HIS A 62 -7.710 -8.922 -18.942 1.00 43.22 H new ATOM 0 HE1 HIS A 62 -5.888 -11.632 -16.246 1.00 0.41 H new ATOM 0 HE2 HIS A 62 -7.455 -11.416 -18.236 1.00 61.21 H new ATOM 970 N GLN A 63 -4.905 -6.090 -20.068 1.00 4.44 N ATOM 971 CA GLN A 63 -4.873 -6.150 -21.542 1.00 11.13 C ATOM 972 C GLN A 63 -3.431 -6.008 -22.053 1.00 31.02 C ATOM 973 O GLN A 63 -3.072 -6.550 -23.109 1.00 21.21 O ATOM 974 CB GLN A 63 -5.784 -5.046 -22.156 1.00 62.02 C ATOM 975 CG GLN A 63 -7.283 -5.169 -21.795 1.00 64.02 C ATOM 976 CD GLN A 63 -7.938 -6.488 -22.232 1.00 3.42 C ATOM 977 OE1 GLN A 63 -8.813 -7.012 -21.545 1.00 40.52 O ATOM 978 NE2 GLN A 63 -7.571 -7.006 -23.395 1.00 72.14 N ATOM 0 H GLN A 63 -5.273 -5.211 -19.703 1.00 4.44 H new ATOM 0 HA GLN A 63 -5.256 -7.121 -21.856 1.00 11.13 H new ATOM 0 HB2 GLN A 63 -5.424 -4.072 -21.826 1.00 62.02 H new ATOM 0 HB3 GLN A 63 -5.682 -5.072 -23.241 1.00 62.02 H new ATOM 0 HG2 GLN A 63 -7.394 -5.063 -20.716 1.00 64.02 H new ATOM 0 HG3 GLN A 63 -7.823 -4.341 -22.253 1.00 64.02 H new ATOM 0 HE21 GLN A 63 -6.843 -6.554 -23.948 1.00 72.14 H new ATOM 0 HE22 GLN A 63 -8.017 -7.857 -23.738 1.00 72.14 H new ATOM 987 N HIS A 64 -2.616 -5.256 -21.296 1.00 53.34 N ATOM 988 CA HIS A 64 -1.176 -5.100 -21.546 1.00 24.20 C ATOM 989 C HIS A 64 -0.418 -5.496 -20.257 1.00 3.54 C ATOM 990 O HIS A 64 -0.098 -4.624 -19.433 1.00 63.42 O ATOM 991 CB HIS A 64 -0.844 -3.636 -21.977 1.00 54.23 C ATOM 992 CG HIS A 64 -1.462 -3.215 -23.293 1.00 72.41 C ATOM 993 ND1 HIS A 64 -0.714 -2.912 -24.411 1.00 63.32 N ATOM 994 CD2 HIS A 64 -2.751 -3.004 -23.655 1.00 40.02 C ATOM 995 CE1 HIS A 64 -1.512 -2.553 -25.395 1.00 44.13 C ATOM 996 NE2 HIS A 64 -2.752 -2.601 -24.963 1.00 53.52 N ATOM 0 H HIS A 64 -2.944 -4.733 -20.484 1.00 53.34 H new ATOM 0 HA HIS A 64 -0.864 -5.748 -22.365 1.00 24.20 H new ATOM 0 HB2 HIS A 64 -1.183 -2.955 -21.196 1.00 54.23 H new ATOM 0 HB3 HIS A 64 0.238 -3.528 -22.047 1.00 54.23 H new ATOM 0 HD2 HIS A 64 -3.619 -3.131 -23.026 1.00 40.02 H new ATOM 0 HE1 HIS A 64 -1.200 -2.267 -26.389 1.00 44.13 H new ATOM 0 HE2 HIS A 64 -3.581 -2.375 -25.513 1.00 53.52 H new ATOM 1005 N PRO A 65 -0.197 -6.840 -20.015 1.00 12.14 N ATOM 1006 CA PRO A 65 0.493 -7.332 -18.801 1.00 75.13 C ATOM 1007 C PRO A 65 1.981 -6.944 -18.802 1.00 15.13 C ATOM 1008 O PRO A 65 2.422 -6.163 -17.950 1.00 43.22 O ATOM 1009 CB PRO A 65 0.292 -8.880 -18.846 1.00 71.24 C ATOM 1010 CG PRO A 65 -0.790 -9.095 -19.867 1.00 22.42 C ATOM 1011 CD PRO A 65 -0.619 -7.977 -20.872 1.00 31.12 C ATOM 0 HA PRO A 65 0.092 -6.894 -17.887 1.00 75.13 H new ATOM 0 HB2 PRO A 65 1.212 -9.391 -19.131 1.00 71.24 H new ATOM 0 HB3 PRO A 65 -0.000 -9.270 -17.871 1.00 71.24 H new ATOM 0 HG2 PRO A 65 -0.693 -10.070 -20.344 1.00 22.42 H new ATOM 0 HG3 PRO A 65 -1.777 -9.062 -19.406 1.00 22.42 H new ATOM 0 HD2 PRO A 65 0.131 -8.219 -21.625 1.00 31.12 H new ATOM 0 HD3 PRO A 65 -1.546 -7.763 -21.403 1.00 31.12 H new ATOM 1019 N GLY A 66 2.723 -7.471 -19.808 1.00 3.51 N ATOM 1020 CA GLY A 66 4.160 -7.246 -19.940 1.00 20.13 C ATOM 1021 C GLY A 66 4.965 -7.798 -18.765 1.00 54.23 C ATOM 1022 O GLY A 66 5.447 -8.943 -18.802 1.00 3.44 O ATOM 0 H GLY A 66 2.331 -8.061 -20.542 1.00 3.51 H new ATOM 0 HA2 GLY A 66 4.511 -7.709 -20.862 1.00 20.13 H new ATOM 0 HA3 GLY A 66 4.347 -6.176 -20.030 1.00 20.13 H new ATOM 1026 N GLY A 67 5.075 -6.972 -17.712 1.00 10.04 N ATOM 1027 CA GLY A 67 5.806 -7.311 -16.498 1.00 30.34 C ATOM 1028 C GLY A 67 6.909 -6.306 -16.233 1.00 62.12 C ATOM 1029 O GLY A 67 6.649 -5.216 -15.705 1.00 13.12 O ATOM 0 H GLY A 67 4.652 -6.044 -17.687 1.00 10.04 H new ATOM 0 HA2 GLY A 67 5.120 -7.336 -15.651 1.00 30.34 H new ATOM 0 HA3 GLY A 67 6.233 -8.309 -16.593 1.00 30.34 H new ATOM 1033 N SER A 68 8.139 -6.662 -16.621 1.00 32.53 N ATOM 1034 CA SER A 68 9.309 -5.787 -16.481 1.00 70.32 C ATOM 1035 C SER A 68 9.365 -4.790 -17.664 1.00 61.03 C ATOM 1036 O SER A 68 10.103 -4.980 -18.639 1.00 70.31 O ATOM 1037 CB SER A 68 10.593 -6.651 -16.371 1.00 52.30 C ATOM 1038 OG SER A 68 10.699 -7.585 -17.440 1.00 44.23 O ATOM 0 H SER A 68 8.352 -7.567 -17.042 1.00 32.53 H new ATOM 0 HA SER A 68 9.232 -5.197 -15.567 1.00 70.32 H new ATOM 0 HB2 SER A 68 11.468 -6.001 -16.369 1.00 52.30 H new ATOM 0 HB3 SER A 68 10.590 -7.186 -15.421 1.00 52.30 H new ATOM 0 HG SER A 68 10.562 -7.123 -18.293 1.00 44.23 H new ATOM 1044 N GLY A 69 8.522 -3.749 -17.575 1.00 0.31 N ATOM 1045 CA GLY A 69 8.426 -2.714 -18.610 1.00 41.41 C ATOM 1046 C GLY A 69 8.129 -1.347 -18.020 1.00 64.25 C ATOM 1047 O GLY A 69 7.259 -0.625 -18.515 1.00 13.11 O ATOM 0 H GLY A 69 7.892 -3.604 -16.786 1.00 0.31 H new ATOM 0 HA2 GLY A 69 9.361 -2.672 -19.169 1.00 41.41 H new ATOM 0 HA3 GLY A 69 7.642 -2.981 -19.319 1.00 41.41 H new ATOM 1051 N LEU A 70 8.880 -0.988 -16.959 1.00 5.52 N ATOM 1052 CA LEU A 70 8.798 0.348 -16.315 1.00 51.02 C ATOM 1053 C LEU A 70 9.392 1.446 -17.234 1.00 14.30 C ATOM 1054 O LEU A 70 9.108 2.634 -17.066 1.00 73.54 O ATOM 1055 CB LEU A 70 9.536 0.317 -14.947 1.00 61.10 C ATOM 1056 CG LEU A 70 9.006 -0.724 -13.899 1.00 53.44 C ATOM 1057 CD1 LEU A 70 9.865 -0.716 -12.610 1.00 73.14 C ATOM 1058 CD2 LEU A 70 7.505 -0.499 -13.579 1.00 22.55 C ATOM 0 H LEU A 70 9.560 -1.611 -16.522 1.00 5.52 H new ATOM 0 HA LEU A 70 7.749 0.591 -16.147 1.00 51.02 H new ATOM 0 HB2 LEU A 70 10.591 0.112 -15.131 1.00 61.10 H new ATOM 0 HB3 LEU A 70 9.477 1.311 -14.503 1.00 61.10 H new ATOM 0 HG LEU A 70 9.098 -1.712 -14.349 1.00 53.44 H new ATOM 0 HD11 LEU A 70 9.471 -1.448 -11.905 1.00 73.14 H new ATOM 0 HD12 LEU A 70 10.896 -0.970 -12.858 1.00 73.14 H new ATOM 0 HD13 LEU A 70 9.834 0.275 -12.158 1.00 73.14 H new ATOM 0 HD21 LEU A 70 7.174 -1.238 -12.850 1.00 22.55 H new ATOM 0 HD22 LEU A 70 7.366 0.502 -13.170 1.00 22.55 H new ATOM 0 HD23 LEU A 70 6.919 -0.602 -14.492 1.00 22.55 H new ATOM 1070 N ASP A 71 10.223 1.009 -18.194 1.00 1.11 N ATOM 1071 CA ASP A 71 10.823 1.868 -19.244 1.00 22.31 C ATOM 1072 C ASP A 71 9.764 2.293 -20.287 1.00 23.34 C ATOM 1073 O ASP A 71 9.929 3.309 -20.967 1.00 71.24 O ATOM 1074 CB ASP A 71 12.004 1.118 -19.936 1.00 20.02 C ATOM 1075 CG ASP A 71 11.586 -0.248 -20.528 1.00 24.21 C ATOM 1076 OD1 ASP A 71 11.351 -0.340 -21.753 1.00 72.21 O ATOM 1077 OD2 ASP A 71 11.483 -1.227 -19.753 1.00 22.23 O ATOM 0 H ASP A 71 10.506 0.032 -18.269 1.00 1.11 H new ATOM 0 HA ASP A 71 11.207 2.772 -18.771 1.00 22.31 H new ATOM 0 HB2 ASP A 71 12.409 1.744 -20.731 1.00 20.02 H new ATOM 0 HB3 ASP A 71 12.804 0.965 -19.212 1.00 20.02 H new ATOM 1082 N ASP A 72 8.681 1.502 -20.403 1.00 65.34 N ATOM 1083 CA ASP A 72 7.573 1.770 -21.328 1.00 44.32 C ATOM 1084 C ASP A 72 6.333 2.181 -20.511 1.00 35.33 C ATOM 1085 O ASP A 72 5.616 1.323 -19.981 1.00 33.41 O ATOM 1086 CB ASP A 72 7.292 0.507 -22.194 1.00 64.33 C ATOM 1087 CG ASP A 72 6.251 0.745 -23.308 1.00 22.30 C ATOM 1088 OD1 ASP A 72 5.032 0.648 -23.039 1.00 35.11 O ATOM 1089 OD2 ASP A 72 6.647 1.022 -24.463 1.00 72.51 O ATOM 0 H ASP A 72 8.553 0.654 -19.852 1.00 65.34 H new ATOM 0 HA ASP A 72 7.831 2.584 -22.005 1.00 44.32 H new ATOM 0 HB2 ASP A 72 8.225 0.170 -22.645 1.00 64.33 H new ATOM 0 HB3 ASP A 72 6.943 -0.297 -21.547 1.00 64.33 H new ATOM 1094 N ILE A 73 6.125 3.500 -20.353 1.00 25.42 N ATOM 1095 CA ILE A 73 4.953 4.050 -19.643 1.00 61.45 C ATOM 1096 C ILE A 73 3.947 4.610 -20.671 1.00 0.20 C ATOM 1097 O ILE A 73 4.261 5.593 -21.358 1.00 61.14 O ATOM 1098 CB ILE A 73 5.357 5.185 -18.619 1.00 65.12 C ATOM 1099 CG1 ILE A 73 6.378 4.649 -17.557 1.00 15.45 C ATOM 1100 CG2 ILE A 73 4.101 5.789 -17.926 1.00 1.22 C ATOM 1101 CD1 ILE A 73 5.848 3.541 -16.644 1.00 34.25 C ATOM 0 H ILE A 73 6.760 4.213 -20.711 1.00 25.42 H new ATOM 0 HA ILE A 73 4.498 3.240 -19.072 1.00 61.45 H new ATOM 0 HB ILE A 73 5.844 5.981 -19.182 1.00 65.12 H new ATOM 0 HG12 ILE A 73 7.259 4.277 -18.079 1.00 15.45 H new ATOM 0 HG13 ILE A 73 6.704 5.484 -16.937 1.00 15.45 H new ATOM 0 HG21 ILE A 73 4.410 6.567 -17.227 1.00 1.22 H new ATOM 0 HG22 ILE A 73 3.441 6.219 -18.680 1.00 1.22 H new ATOM 0 HG23 ILE A 73 3.571 5.005 -17.385 1.00 1.22 H new ATOM 0 HD11 ILE A 73 6.629 3.240 -15.946 1.00 34.25 H new ATOM 0 HD12 ILE A 73 4.987 3.909 -16.087 1.00 34.25 H new ATOM 0 HD13 ILE A 73 5.550 2.684 -17.248 1.00 34.25 H new ATOM 1113 N PRO A 74 2.742 3.975 -20.828 1.00 43.45 N ATOM 1114 CA PRO A 74 1.640 4.557 -21.636 1.00 14.32 C ATOM 1115 C PRO A 74 1.168 5.918 -21.051 1.00 54.44 C ATOM 1116 O PRO A 74 1.151 6.076 -19.824 1.00 31.02 O ATOM 1117 CB PRO A 74 0.518 3.479 -21.558 1.00 52.42 C ATOM 1118 CG PRO A 74 1.222 2.213 -21.159 1.00 14.34 C ATOM 1119 CD PRO A 74 2.363 2.645 -20.269 1.00 72.40 C ATOM 0 HA PRO A 74 1.938 4.777 -22.661 1.00 14.32 H new ATOM 0 HB2 PRO A 74 -0.243 3.754 -20.828 1.00 52.42 H new ATOM 0 HB3 PRO A 74 0.013 3.364 -22.517 1.00 52.42 H new ATOM 0 HG2 PRO A 74 0.547 1.539 -20.631 1.00 14.34 H new ATOM 0 HG3 PRO A 74 1.589 1.676 -22.034 1.00 14.34 H new ATOM 0 HD2 PRO A 74 2.055 2.719 -19.226 1.00 72.40 H new ATOM 0 HD3 PRO A 74 3.193 1.940 -20.307 1.00 72.40 H new ATOM 1127 N PRO A 75 0.808 6.930 -21.922 1.00 50.35 N ATOM 1128 CA PRO A 75 0.319 8.262 -21.473 1.00 42.35 C ATOM 1129 C PRO A 75 -0.864 8.174 -20.486 1.00 31.13 C ATOM 1130 O PRO A 75 -0.959 9.009 -19.586 1.00 65.43 O ATOM 1131 CB PRO A 75 -0.078 8.991 -22.796 1.00 11.40 C ATOM 1132 CG PRO A 75 -0.095 7.921 -23.853 1.00 60.24 C ATOM 1133 CD PRO A 75 0.897 6.878 -23.402 1.00 53.45 C ATOM 0 HA PRO A 75 1.084 8.798 -20.911 1.00 42.35 H new ATOM 0 HB2 PRO A 75 -1.054 9.468 -22.704 1.00 11.40 H new ATOM 0 HB3 PRO A 75 0.638 9.775 -23.042 1.00 11.40 H new ATOM 0 HG2 PRO A 75 -1.092 7.492 -23.959 1.00 60.24 H new ATOM 0 HG3 PRO A 75 0.182 8.328 -24.825 1.00 60.24 H new ATOM 0 HD2 PRO A 75 0.642 5.890 -23.785 1.00 53.45 H new ATOM 0 HD3 PRO A 75 1.904 7.105 -23.751 1.00 53.45 H new ATOM 1141 N TYR A 76 -1.722 7.131 -20.650 1.00 3.04 N ATOM 1142 CA TYR A 76 -2.882 6.864 -19.762 1.00 52.14 C ATOM 1143 C TYR A 76 -2.474 6.817 -18.275 1.00 31.51 C ATOM 1144 O TYR A 76 -3.197 7.319 -17.424 1.00 14.12 O ATOM 1145 CB TYR A 76 -3.589 5.524 -20.158 1.00 33.23 C ATOM 1146 CG TYR A 76 -4.607 5.015 -19.112 1.00 44.43 C ATOM 1147 CD1 TYR A 76 -4.273 3.995 -18.212 1.00 61.54 C ATOM 1148 CD2 TYR A 76 -5.868 5.600 -18.979 1.00 30.03 C ATOM 1149 CE1 TYR A 76 -5.151 3.585 -17.232 1.00 61.02 C ATOM 1150 CE2 TYR A 76 -6.754 5.180 -18.003 1.00 21.34 C ATOM 1151 CZ TYR A 76 -6.386 4.178 -17.127 1.00 2.34 C ATOM 1152 OH TYR A 76 -7.247 3.775 -16.130 1.00 32.43 O ATOM 0 H TYR A 76 -1.626 6.451 -21.404 1.00 3.04 H new ATOM 0 HA TYR A 76 -3.578 7.692 -19.895 1.00 52.14 H new ATOM 0 HB2 TYR A 76 -4.101 5.663 -21.110 1.00 33.23 H new ATOM 0 HB3 TYR A 76 -2.830 4.757 -20.314 1.00 33.23 H new ATOM 0 HD1 TYR A 76 -3.306 3.519 -18.288 1.00 61.54 H new ATOM 0 HD2 TYR A 76 -6.157 6.395 -19.650 1.00 30.03 H new ATOM 0 HE1 TYR A 76 -4.869 2.799 -16.548 1.00 61.02 H new ATOM 0 HE2 TYR A 76 -7.731 5.635 -17.926 1.00 21.34 H new ATOM 0 HH TYR A 76 -8.118 3.551 -16.520 1.00 32.43 H new ATOM 1162 N ASP A 77 -1.328 6.185 -17.995 1.00 31.13 N ATOM 1163 CA ASP A 77 -0.810 5.978 -16.621 1.00 32.24 C ATOM 1164 C ASP A 77 -0.493 7.328 -15.955 1.00 73.32 C ATOM 1165 O ASP A 77 -0.711 7.509 -14.746 1.00 64.22 O ATOM 1166 CB ASP A 77 0.461 5.081 -16.667 1.00 0.45 C ATOM 1167 CG ASP A 77 0.212 3.672 -17.256 1.00 1.11 C ATOM 1168 OD1 ASP A 77 0.651 2.661 -16.665 1.00 51.25 O ATOM 1169 OD2 ASP A 77 -0.434 3.574 -18.322 1.00 4.40 O ATOM 0 H ASP A 77 -0.722 5.796 -18.717 1.00 31.13 H new ATOM 0 HA ASP A 77 -1.575 5.477 -16.027 1.00 32.24 H new ATOM 0 HB2 ASP A 77 1.226 5.582 -17.260 1.00 0.45 H new ATOM 0 HB3 ASP A 77 0.857 4.977 -15.657 1.00 0.45 H new ATOM 1174 N ARG A 78 0.015 8.272 -16.769 1.00 1.40 N ATOM 1175 CA ARG A 78 0.310 9.654 -16.334 1.00 31.53 C ATOM 1176 C ARG A 78 -0.988 10.473 -16.220 1.00 22.01 C ATOM 1177 O ARG A 78 -1.116 11.324 -15.336 1.00 11.33 O ATOM 1178 CB ARG A 78 1.304 10.325 -17.324 1.00 75.32 C ATOM 1179 CG ARG A 78 2.638 9.566 -17.477 1.00 65.41 C ATOM 1180 CD ARG A 78 3.384 9.383 -16.132 1.00 54.40 C ATOM 1181 NE ARG A 78 4.694 8.728 -16.291 1.00 24.35 N ATOM 1182 CZ ARG A 78 5.374 8.100 -15.314 1.00 65.35 C ATOM 1183 NH1 ARG A 78 4.886 8.008 -14.081 1.00 21.42 N ATOM 1184 NH2 ARG A 78 6.553 7.570 -15.581 1.00 70.35 N ATOM 0 H ARG A 78 0.234 8.099 -17.750 1.00 1.40 H new ATOM 0 HA ARG A 78 0.774 9.621 -15.348 1.00 31.53 H new ATOM 0 HB2 ARG A 78 0.829 10.407 -18.302 1.00 75.32 H new ATOM 0 HB3 ARG A 78 1.511 11.340 -16.984 1.00 75.32 H new ATOM 0 HG2 ARG A 78 2.445 8.587 -17.916 1.00 65.41 H new ATOM 0 HG3 ARG A 78 3.280 10.106 -18.172 1.00 65.41 H new ATOM 0 HD2 ARG A 78 3.524 10.357 -15.664 1.00 54.40 H new ATOM 0 HD3 ARG A 78 2.766 8.791 -15.457 1.00 54.40 H new ATOM 0 HE ARG A 78 5.120 8.752 -17.217 1.00 24.35 H new ATOM 0 HH11 ARG A 78 3.979 8.418 -13.860 1.00 21.42 H new ATOM 0 HH12 ARG A 78 5.419 7.527 -13.356 1.00 21.42 H new ATOM 0 HH21 ARG A 78 6.942 7.638 -16.522 1.00 70.35 H new ATOM 0 HH22 ARG A 78 7.075 7.092 -14.847 1.00 70.35 H new ATOM 1198 N ASP A 79 -1.951 10.193 -17.122 1.00 40.40 N ATOM 1199 CA ASP A 79 -3.278 10.846 -17.104 1.00 33.45 C ATOM 1200 C ASP A 79 -4.109 10.359 -15.909 1.00 15.52 C ATOM 1201 O ASP A 79 -4.962 11.096 -15.408 1.00 15.50 O ATOM 1202 CB ASP A 79 -4.063 10.628 -18.432 1.00 33.44 C ATOM 1203 CG ASP A 79 -3.528 11.480 -19.595 1.00 61.41 C ATOM 1204 OD1 ASP A 79 -2.825 10.947 -20.471 1.00 21.31 O ATOM 1205 OD2 ASP A 79 -3.790 12.704 -19.620 1.00 25.55 O ATOM 0 H ASP A 79 -1.834 9.516 -17.876 1.00 40.40 H new ATOM 0 HA ASP A 79 -3.102 11.917 -17.002 1.00 33.45 H new ATOM 0 HB2 ASP A 79 -4.013 9.575 -18.708 1.00 33.44 H new ATOM 0 HB3 ASP A 79 -5.114 10.865 -18.269 1.00 33.44 H new ATOM 1210 N PHE A 80 -3.823 9.126 -15.454 1.00 22.52 N ATOM 1211 CA PHE A 80 -4.488 8.489 -14.302 1.00 11.23 C ATOM 1212 C PHE A 80 -4.164 9.263 -13.016 1.00 32.23 C ATOM 1213 O PHE A 80 -5.024 9.451 -12.145 1.00 45.34 O ATOM 1214 CB PHE A 80 -4.035 7.000 -14.178 1.00 3.12 C ATOM 1215 CG PHE A 80 -4.720 6.240 -13.041 1.00 42.24 C ATOM 1216 CD1 PHE A 80 -4.107 6.086 -11.789 1.00 34.35 C ATOM 1217 CD2 PHE A 80 -5.997 5.720 -13.213 1.00 60.52 C ATOM 1218 CE1 PHE A 80 -4.756 5.437 -10.757 1.00 5.51 C ATOM 1219 CE2 PHE A 80 -6.634 5.068 -12.184 1.00 32.11 C ATOM 1220 CZ PHE A 80 -6.023 4.929 -10.956 1.00 14.31 C ATOM 0 H PHE A 80 -3.112 8.534 -15.883 1.00 22.52 H new ATOM 0 HA PHE A 80 -5.567 8.509 -14.456 1.00 11.23 H new ATOM 0 HB2 PHE A 80 -4.238 6.488 -15.119 1.00 3.12 H new ATOM 0 HB3 PHE A 80 -2.956 6.969 -14.025 1.00 3.12 H new ATOM 0 HD1 PHE A 80 -3.114 6.480 -11.630 1.00 34.35 H new ATOM 0 HD2 PHE A 80 -6.494 5.829 -14.165 1.00 60.52 H new ATOM 0 HE1 PHE A 80 -4.273 5.328 -9.797 1.00 5.51 H new ATOM 0 HE2 PHE A 80 -7.622 4.661 -12.339 1.00 32.11 H new ATOM 0 HZ PHE A 80 -6.535 4.423 -10.151 1.00 14.31 H new ATOM 1230 N CYS A 81 -2.901 9.699 -12.937 1.00 64.20 N ATOM 1231 CA CYS A 81 -2.362 10.479 -11.821 1.00 33.20 C ATOM 1232 C CYS A 81 -2.941 11.912 -11.781 1.00 75.22 C ATOM 1233 O CYS A 81 -2.894 12.568 -10.733 1.00 14.51 O ATOM 1234 CB CYS A 81 -0.831 10.505 -11.951 1.00 42.22 C ATOM 1235 SG CYS A 81 -0.081 8.865 -11.972 1.00 43.35 S ATOM 0 H CYS A 81 -2.211 9.514 -13.665 1.00 64.20 H new ATOM 0 HA CYS A 81 -2.652 10.008 -10.882 1.00 33.20 H new ATOM 0 HB2 CYS A 81 -0.561 11.031 -12.867 1.00 42.22 H new ATOM 0 HB3 CYS A 81 -0.414 11.076 -11.121 1.00 42.22 H new ATOM 0 HG CYS A 81 0.569 8.671 -10.863 1.00 43.35 H new ATOM 1241 N LYS A 82 -3.470 12.391 -12.935 1.00 3.45 N ATOM 1242 CA LYS A 82 -4.105 13.721 -13.043 1.00 24.04 C ATOM 1243 C LYS A 82 -5.507 13.674 -12.406 1.00 60.42 C ATOM 1244 O LYS A 82 -6.514 13.441 -13.087 1.00 73.22 O ATOM 1245 CB LYS A 82 -4.187 14.175 -14.529 1.00 13.24 C ATOM 1246 CG LYS A 82 -2.825 14.247 -15.246 1.00 73.11 C ATOM 1247 CD LYS A 82 -2.968 14.628 -16.736 1.00 33.43 C ATOM 1248 CE LYS A 82 -1.634 14.589 -17.500 1.00 32.44 C ATOM 1249 NZ LYS A 82 -1.831 14.875 -18.950 1.00 23.44 N ATOM 0 H LYS A 82 -3.467 11.867 -13.810 1.00 3.45 H new ATOM 0 HA LYS A 82 -3.496 14.450 -12.508 1.00 24.04 H new ATOM 0 HB2 LYS A 82 -4.834 13.486 -15.072 1.00 13.24 H new ATOM 0 HB3 LYS A 82 -4.659 15.157 -14.571 1.00 13.24 H new ATOM 0 HG2 LYS A 82 -2.191 14.979 -14.745 1.00 73.11 H new ATOM 0 HG3 LYS A 82 -2.323 13.283 -15.166 1.00 73.11 H new ATOM 0 HD2 LYS A 82 -3.673 13.947 -17.213 1.00 33.43 H new ATOM 0 HD3 LYS A 82 -3.393 15.629 -16.810 1.00 33.43 H new ATOM 0 HE2 LYS A 82 -0.947 15.320 -17.073 1.00 32.44 H new ATOM 0 HE3 LYS A 82 -1.172 13.609 -17.380 1.00 32.44 H new ATOM 0 HZ1 LYS A 82 -0.921 14.791 -19.447 1.00 23.44 H new ATOM 0 HZ2 LYS A 82 -2.508 14.194 -19.349 1.00 23.44 H new ATOM 0 HZ3 LYS A 82 -2.202 15.840 -19.066 1.00 23.44 H new ATOM 1263 N VAL A 83 -5.540 13.822 -11.080 1.00 13.21 N ATOM 1264 CA VAL A 83 -6.768 13.805 -10.262 1.00 34.30 C ATOM 1265 C VAL A 83 -6.698 14.934 -9.229 1.00 34.34 C ATOM 1266 O VAL A 83 -5.627 15.528 -9.020 1.00 10.53 O ATOM 1267 CB VAL A 83 -6.961 12.417 -9.530 1.00 4.24 C ATOM 1268 CG1 VAL A 83 -7.335 11.296 -10.524 1.00 32.31 C ATOM 1269 CG2 VAL A 83 -5.699 12.034 -8.722 1.00 60.11 C ATOM 0 H VAL A 83 -4.695 13.961 -10.525 1.00 13.21 H new ATOM 0 HA VAL A 83 -7.623 13.951 -10.922 1.00 34.30 H new ATOM 0 HB VAL A 83 -7.791 12.531 -8.833 1.00 4.24 H new ATOM 0 HG11 VAL A 83 -7.459 10.357 -9.984 1.00 32.31 H new ATOM 0 HG12 VAL A 83 -8.268 11.552 -11.027 1.00 32.31 H new ATOM 0 HG13 VAL A 83 -6.542 11.187 -11.264 1.00 32.31 H new ATOM 0 HG21 VAL A 83 -5.860 11.075 -8.229 1.00 60.11 H new ATOM 0 HG22 VAL A 83 -4.845 11.957 -9.395 1.00 60.11 H new ATOM 0 HG23 VAL A 83 -5.501 12.799 -7.971 1.00 60.11 H new ATOM 1279 N ASP A 84 -7.838 15.228 -8.585 1.00 14.13 N ATOM 1280 CA ASP A 84 -7.908 16.255 -7.533 1.00 12.24 C ATOM 1281 C ASP A 84 -7.171 15.744 -6.274 1.00 41.22 C ATOM 1282 O ASP A 84 -7.011 14.533 -6.109 1.00 54.53 O ATOM 1283 CB ASP A 84 -9.391 16.614 -7.238 1.00 60.23 C ATOM 1284 CG ASP A 84 -9.572 17.898 -6.415 1.00 73.51 C ATOM 1285 OD1 ASP A 84 -10.448 17.938 -5.522 1.00 24.15 O ATOM 1286 OD2 ASP A 84 -8.836 18.879 -6.665 1.00 21.31 O ATOM 0 H ASP A 84 -8.728 14.767 -8.775 1.00 14.13 H new ATOM 0 HA ASP A 84 -7.415 17.169 -7.865 1.00 12.24 H new ATOM 0 HB2 ASP A 84 -9.923 16.723 -8.183 1.00 60.23 H new ATOM 0 HB3 ASP A 84 -9.856 15.785 -6.705 1.00 60.23 H new ATOM 1291 N GLN A 85 -6.735 16.673 -5.403 1.00 32.02 N ATOM 1292 CA GLN A 85 -5.860 16.366 -4.243 1.00 43.14 C ATOM 1293 C GLN A 85 -6.474 15.300 -3.274 1.00 24.40 C ATOM 1294 O GLN A 85 -5.790 14.313 -2.970 1.00 32.10 O ATOM 1295 CB GLN A 85 -5.453 17.677 -3.503 1.00 60.30 C ATOM 1296 CG GLN A 85 -4.383 17.503 -2.400 1.00 25.54 C ATOM 1297 CD GLN A 85 -3.053 16.909 -2.890 1.00 60.12 C ATOM 1298 OE1 GLN A 85 -2.658 17.060 -4.048 1.00 45.42 O ATOM 1299 NE2 GLN A 85 -2.331 16.264 -1.996 1.00 60.21 N ATOM 0 H GLN A 85 -6.977 17.661 -5.479 1.00 32.02 H new ATOM 0 HA GLN A 85 -4.954 15.905 -4.636 1.00 43.14 H new ATOM 0 HB2 GLN A 85 -5.081 18.391 -4.238 1.00 60.30 H new ATOM 0 HB3 GLN A 85 -6.345 18.115 -3.056 1.00 60.30 H new ATOM 0 HG2 GLN A 85 -4.187 18.474 -1.945 1.00 25.54 H new ATOM 0 HG3 GLN A 85 -4.787 16.860 -1.618 1.00 25.54 H new ATOM 0 HE21 GLN A 85 -2.679 16.152 -1.044 1.00 60.21 H new ATOM 0 HE22 GLN A 85 -1.424 15.877 -2.256 1.00 60.21 H new ATOM 1308 N PRO A 86 -7.768 15.435 -2.790 1.00 63.24 N ATOM 1309 CA PRO A 86 -8.410 14.366 -1.979 1.00 14.21 C ATOM 1310 C PRO A 86 -8.636 13.067 -2.788 1.00 62.04 C ATOM 1311 O PRO A 86 -8.456 11.971 -2.250 1.00 63.52 O ATOM 1312 CB PRO A 86 -9.758 14.997 -1.535 1.00 34.11 C ATOM 1313 CG PRO A 86 -10.037 16.053 -2.559 1.00 72.53 C ATOM 1314 CD PRO A 86 -8.684 16.606 -2.943 1.00 5.32 C ATOM 0 HA PRO A 86 -7.785 14.060 -1.140 1.00 14.21 H new ATOM 0 HB2 PRO A 86 -10.554 14.253 -1.507 1.00 34.11 H new ATOM 0 HB3 PRO A 86 -9.685 15.424 -0.535 1.00 34.11 H new ATOM 0 HG2 PRO A 86 -10.551 15.635 -3.425 1.00 72.53 H new ATOM 0 HG3 PRO A 86 -10.680 16.834 -2.153 1.00 72.53 H new ATOM 0 HD2 PRO A 86 -8.682 16.986 -3.965 1.00 5.32 H new ATOM 0 HD3 PRO A 86 -8.390 17.432 -2.295 1.00 5.32 H new ATOM 1322 N THR A 87 -8.990 13.222 -4.087 1.00 62.14 N ATOM 1323 CA THR A 87 -9.259 12.105 -5.019 1.00 42.13 C ATOM 1324 C THR A 87 -8.019 11.190 -5.186 1.00 3.41 C ATOM 1325 O THR A 87 -8.150 9.974 -5.365 1.00 31.32 O ATOM 1326 CB THR A 87 -9.694 12.674 -6.411 1.00 34.43 C ATOM 1327 OG1 THR A 87 -10.777 13.604 -6.237 1.00 10.24 O ATOM 1328 CG2 THR A 87 -10.126 11.584 -7.413 1.00 33.40 C ATOM 0 H THR A 87 -9.097 14.139 -4.520 1.00 62.14 H new ATOM 0 HA THR A 87 -10.064 11.501 -4.600 1.00 42.13 H new ATOM 0 HB THR A 87 -8.816 13.166 -6.830 1.00 34.43 H new ATOM 0 HG1 THR A 87 -11.046 13.960 -7.110 1.00 10.24 H new ATOM 0 HG21 THR A 87 -10.414 12.050 -8.355 1.00 33.40 H new ATOM 0 HG22 THR A 87 -9.296 10.899 -7.586 1.00 33.40 H new ATOM 0 HG23 THR A 87 -10.974 11.032 -7.007 1.00 33.40 H new ATOM 1336 N LEU A 88 -6.826 11.807 -5.103 1.00 40.11 N ATOM 1337 CA LEU A 88 -5.529 11.113 -5.194 1.00 4.21 C ATOM 1338 C LEU A 88 -5.377 10.153 -3.998 1.00 52.32 C ATOM 1339 O LEU A 88 -5.046 8.976 -4.171 1.00 41.21 O ATOM 1340 CB LEU A 88 -4.381 12.179 -5.251 1.00 1.41 C ATOM 1341 CG LEU A 88 -3.006 11.727 -5.867 1.00 71.23 C ATOM 1342 CD1 LEU A 88 -2.111 12.948 -6.167 1.00 1.53 C ATOM 1343 CD2 LEU A 88 -2.262 10.712 -4.975 1.00 44.12 C ATOM 0 H LEU A 88 -6.735 12.814 -4.969 1.00 40.11 H new ATOM 0 HA LEU A 88 -5.473 10.514 -6.103 1.00 4.21 H new ATOM 0 HB2 LEU A 88 -4.742 13.033 -5.823 1.00 1.41 H new ATOM 0 HB3 LEU A 88 -4.196 12.530 -4.236 1.00 1.41 H new ATOM 0 HG LEU A 88 -3.233 11.219 -6.804 1.00 71.23 H new ATOM 0 HD11 LEU A 88 -1.166 12.611 -6.592 1.00 1.53 H new ATOM 0 HD12 LEU A 88 -2.615 13.603 -6.878 1.00 1.53 H new ATOM 0 HD13 LEU A 88 -1.919 13.494 -5.243 1.00 1.53 H new ATOM 0 HD21 LEU A 88 -1.320 10.434 -5.448 1.00 44.12 H new ATOM 0 HD22 LEU A 88 -2.061 11.161 -4.002 1.00 44.12 H new ATOM 0 HD23 LEU A 88 -2.878 9.823 -4.844 1.00 44.12 H new ATOM 1355 N PHE A 89 -5.647 10.680 -2.793 1.00 53.15 N ATOM 1356 CA PHE A 89 -5.578 9.902 -1.544 1.00 13.12 C ATOM 1357 C PHE A 89 -6.665 8.818 -1.502 1.00 2.12 C ATOM 1358 O PHE A 89 -6.462 7.772 -0.895 1.00 1.03 O ATOM 1359 CB PHE A 89 -5.656 10.833 -0.313 1.00 62.24 C ATOM 1360 CG PHE A 89 -4.473 11.802 -0.218 1.00 31.13 C ATOM 1361 CD1 PHE A 89 -3.165 11.318 -0.128 1.00 71.13 C ATOM 1362 CD2 PHE A 89 -4.659 13.183 -0.219 1.00 12.43 C ATOM 1363 CE1 PHE A 89 -2.089 12.183 -0.046 1.00 53.31 C ATOM 1364 CE2 PHE A 89 -3.586 14.041 -0.133 1.00 23.14 C ATOM 1365 CZ PHE A 89 -2.299 13.543 -0.046 1.00 4.03 C ATOM 0 H PHE A 89 -5.918 11.654 -2.656 1.00 53.15 H new ATOM 0 HA PHE A 89 -4.614 9.394 -1.515 1.00 13.12 H new ATOM 0 HB2 PHE A 89 -6.584 11.404 -0.355 1.00 62.24 H new ATOM 0 HB3 PHE A 89 -5.695 10.227 0.592 1.00 62.24 H new ATOM 0 HD1 PHE A 89 -2.992 10.252 -0.122 1.00 71.13 H new ATOM 0 HD2 PHE A 89 -5.659 13.586 -0.288 1.00 12.43 H new ATOM 0 HE1 PHE A 89 -1.085 11.791 0.018 1.00 53.31 H new ATOM 0 HE2 PHE A 89 -3.750 15.108 -0.133 1.00 23.14 H new ATOM 0 HZ PHE A 89 -1.460 14.220 0.022 1.00 4.03 H new ATOM 1375 N GLU A 90 -7.810 9.078 -2.161 1.00 73.32 N ATOM 1376 CA GLU A 90 -8.895 8.083 -2.323 1.00 50.54 C ATOM 1377 C GLU A 90 -8.422 6.870 -3.147 1.00 52.24 C ATOM 1378 O GLU A 90 -8.807 5.733 -2.859 1.00 61.31 O ATOM 1379 CB GLU A 90 -10.129 8.725 -3.000 1.00 14.14 C ATOM 1380 CG GLU A 90 -10.869 9.772 -2.154 1.00 25.15 C ATOM 1381 CD GLU A 90 -11.557 9.180 -0.913 1.00 12.34 C ATOM 1382 OE1 GLU A 90 -12.712 8.715 -1.026 1.00 73.41 O ATOM 1383 OE2 GLU A 90 -10.962 9.201 0.187 1.00 35.40 O ATOM 0 H GLU A 90 -8.012 9.979 -2.595 1.00 73.32 H new ATOM 0 HA GLU A 90 -9.174 7.737 -1.328 1.00 50.54 H new ATOM 0 HB2 GLU A 90 -9.810 9.193 -3.931 1.00 14.14 H new ATOM 0 HB3 GLU A 90 -10.830 7.934 -3.265 1.00 14.14 H new ATOM 0 HG2 GLU A 90 -10.161 10.538 -1.837 1.00 25.15 H new ATOM 0 HG3 GLU A 90 -11.617 10.266 -2.774 1.00 25.15 H new ATOM 1390 N LEU A 91 -7.602 7.138 -4.185 1.00 72.23 N ATOM 1391 CA LEU A 91 -6.974 6.088 -5.013 1.00 64.32 C ATOM 1392 C LEU A 91 -5.985 5.248 -4.170 1.00 74.14 C ATOM 1393 O LEU A 91 -5.892 4.035 -4.363 1.00 1.35 O ATOM 1394 CB LEU A 91 -6.239 6.709 -6.238 1.00 25.00 C ATOM 1395 CG LEU A 91 -7.120 7.463 -7.294 1.00 21.31 C ATOM 1396 CD1 LEU A 91 -6.237 8.138 -8.379 1.00 72.21 C ATOM 1397 CD2 LEU A 91 -8.160 6.515 -7.932 1.00 45.41 C ATOM 0 H LEU A 91 -7.357 8.086 -4.472 1.00 72.23 H new ATOM 0 HA LEU A 91 -7.765 5.435 -5.381 1.00 64.32 H new ATOM 0 HB2 LEU A 91 -5.489 7.406 -5.864 1.00 25.00 H new ATOM 0 HB3 LEU A 91 -5.704 5.910 -6.752 1.00 25.00 H new ATOM 0 HG LEU A 91 -7.665 8.249 -6.772 1.00 21.31 H new ATOM 0 HD11 LEU A 91 -6.874 8.653 -9.098 1.00 72.21 H new ATOM 0 HD12 LEU A 91 -5.567 8.857 -7.907 1.00 72.21 H new ATOM 0 HD13 LEU A 91 -5.649 7.378 -8.894 1.00 72.21 H new ATOM 0 HD21 LEU A 91 -8.756 7.066 -8.660 1.00 45.41 H new ATOM 0 HD22 LEU A 91 -7.646 5.694 -8.431 1.00 45.41 H new ATOM 0 HD23 LEU A 91 -8.813 6.116 -7.156 1.00 45.41 H new ATOM 1409 N ILE A 92 -5.262 5.918 -3.243 1.00 40.01 N ATOM 1410 CA ILE A 92 -4.328 5.258 -2.297 1.00 55.02 C ATOM 1411 C ILE A 92 -5.112 4.345 -1.319 1.00 65.12 C ATOM 1412 O ILE A 92 -4.726 3.190 -1.089 1.00 14.43 O ATOM 1413 CB ILE A 92 -3.471 6.320 -1.484 1.00 3.33 C ATOM 1414 CG1 ILE A 92 -2.629 7.217 -2.455 1.00 13.05 C ATOM 1415 CG2 ILE A 92 -2.557 5.639 -0.426 1.00 32.15 C ATOM 1416 CD1 ILE A 92 -1.773 8.284 -1.781 1.00 64.24 C ATOM 0 H ILE A 92 -5.309 6.930 -3.129 1.00 40.01 H new ATOM 0 HA ILE A 92 -3.638 4.650 -2.882 1.00 55.02 H new ATOM 0 HB ILE A 92 -4.171 6.958 -0.945 1.00 3.33 H new ATOM 0 HG12 ILE A 92 -1.978 6.572 -3.046 1.00 13.05 H new ATOM 0 HG13 ILE A 92 -3.309 7.707 -3.152 1.00 13.05 H new ATOM 0 HG21 ILE A 92 -1.988 6.400 0.108 1.00 32.15 H new ATOM 0 HG22 ILE A 92 -3.172 5.083 0.282 1.00 32.15 H new ATOM 0 HG23 ILE A 92 -1.870 4.956 -0.925 1.00 32.15 H new ATOM 0 HD11 ILE A 92 -1.231 8.849 -2.540 1.00 64.24 H new ATOM 0 HD12 ILE A 92 -2.413 8.960 -1.214 1.00 64.24 H new ATOM 0 HD13 ILE A 92 -1.062 7.807 -1.107 1.00 64.24 H new ATOM 1428 N LEU A 93 -6.231 4.876 -0.785 1.00 63.01 N ATOM 1429 CA LEU A 93 -7.089 4.176 0.197 1.00 52.31 C ATOM 1430 C LEU A 93 -7.762 2.939 -0.433 1.00 54.10 C ATOM 1431 O LEU A 93 -7.870 1.894 0.210 1.00 5.30 O ATOM 1432 CB LEU A 93 -8.164 5.151 0.769 1.00 53.23 C ATOM 1433 CG LEU A 93 -7.629 6.329 1.656 1.00 43.14 C ATOM 1434 CD1 LEU A 93 -8.766 7.309 2.036 1.00 2.05 C ATOM 1435 CD2 LEU A 93 -6.899 5.801 2.915 1.00 23.50 C ATOM 0 H LEU A 93 -6.568 5.809 -1.024 1.00 63.01 H new ATOM 0 HA LEU A 93 -6.456 3.832 1.015 1.00 52.31 H new ATOM 0 HB2 LEU A 93 -8.720 5.576 -0.067 1.00 53.23 H new ATOM 0 HB3 LEU A 93 -8.872 4.571 1.361 1.00 53.23 H new ATOM 0 HG LEU A 93 -6.902 6.882 1.062 1.00 43.14 H new ATOM 0 HD11 LEU A 93 -8.362 8.114 2.651 1.00 2.05 H new ATOM 0 HD12 LEU A 93 -9.203 7.729 1.130 1.00 2.05 H new ATOM 0 HD13 LEU A 93 -9.534 6.775 2.596 1.00 2.05 H new ATOM 0 HD21 LEU A 93 -6.541 6.643 3.508 1.00 23.50 H new ATOM 0 HD22 LEU A 93 -7.589 5.204 3.512 1.00 23.50 H new ATOM 0 HD23 LEU A 93 -6.053 5.184 2.613 1.00 23.50 H new ATOM 1447 N ALA A 94 -8.195 3.081 -1.699 1.00 1.32 N ATOM 1448 CA ALA A 94 -8.846 2.000 -2.464 1.00 53.44 C ATOM 1449 C ALA A 94 -7.825 0.930 -2.881 1.00 24.51 C ATOM 1450 O ALA A 94 -8.145 -0.253 -2.932 1.00 22.35 O ATOM 1451 CB ALA A 94 -9.548 2.574 -3.701 1.00 73.33 C ATOM 0 H ALA A 94 -8.103 3.952 -2.223 1.00 1.32 H new ATOM 0 HA ALA A 94 -9.590 1.529 -1.822 1.00 53.44 H new ATOM 0 HB1 ALA A 94 -10.024 1.766 -4.257 1.00 73.33 H new ATOM 0 HB2 ALA A 94 -10.304 3.295 -3.389 1.00 73.33 H new ATOM 0 HB3 ALA A 94 -8.815 3.070 -4.338 1.00 73.33 H new ATOM 1457 N ALA A 95 -6.596 1.377 -3.177 1.00 4.35 N ATOM 1458 CA ALA A 95 -5.483 0.496 -3.575 1.00 43.23 C ATOM 1459 C ALA A 95 -4.927 -0.298 -2.381 1.00 34.15 C ATOM 1460 O ALA A 95 -4.366 -1.367 -2.575 1.00 71.54 O ATOM 1461 CB ALA A 95 -4.379 1.307 -4.242 1.00 24.10 C ATOM 0 H ALA A 95 -6.343 2.365 -3.148 1.00 4.35 H new ATOM 0 HA ALA A 95 -5.873 -0.227 -4.292 1.00 43.23 H new ATOM 0 HB1 ALA A 95 -3.564 0.643 -4.531 1.00 24.10 H new ATOM 0 HB2 ALA A 95 -4.776 1.801 -5.129 1.00 24.10 H new ATOM 0 HB3 ALA A 95 -4.007 2.057 -3.544 1.00 24.10 H new ATOM 1467 N ASN A 96 -5.035 0.277 -1.164 1.00 33.13 N ATOM 1468 CA ASN A 96 -4.666 -0.409 0.101 1.00 24.31 C ATOM 1469 C ASN A 96 -5.794 -1.380 0.525 1.00 51.34 C ATOM 1470 O ASN A 96 -5.532 -2.494 0.993 1.00 1.51 O ATOM 1471 CB ASN A 96 -4.381 0.651 1.216 1.00 32.02 C ATOM 1472 CG ASN A 96 -3.978 0.059 2.585 1.00 45.24 C ATOM 1473 OD1 ASN A 96 -3.392 -1.022 2.672 1.00 60.13 O ATOM 1474 ND2 ASN A 96 -4.269 0.779 3.665 1.00 10.14 N ATOM 0 H ASN A 96 -5.379 1.227 -1.027 1.00 33.13 H new ATOM 0 HA ASN A 96 -3.759 -0.993 -0.053 1.00 24.31 H new ATOM 0 HB2 ASN A 96 -3.585 1.313 0.874 1.00 32.02 H new ATOM 0 HB3 ASN A 96 -5.271 1.266 1.350 1.00 32.02 H new ATOM 0 HD21 ASN A 96 -4.007 0.439 4.590 1.00 10.14 H new ATOM 0 HD22 ASN A 96 -4.755 1.671 3.568 1.00 10.14 H new ATOM 1481 N TYR A 97 -7.052 -0.938 0.322 1.00 35.00 N ATOM 1482 CA TYR A 97 -8.268 -1.734 0.615 1.00 12.11 C ATOM 1483 C TYR A 97 -8.333 -2.994 -0.271 1.00 62.25 C ATOM 1484 O TYR A 97 -8.718 -4.068 0.195 1.00 52.32 O ATOM 1485 CB TYR A 97 -9.544 -0.855 0.426 1.00 4.05 C ATOM 1486 CG TYR A 97 -10.893 -1.608 0.480 1.00 20.52 C ATOM 1487 CD1 TYR A 97 -11.791 -1.575 -0.599 1.00 0.02 C ATOM 1488 CD2 TYR A 97 -11.262 -2.362 1.600 1.00 50.41 C ATOM 1489 CE1 TYR A 97 -12.991 -2.262 -0.560 1.00 71.10 C ATOM 1490 CE2 TYR A 97 -12.463 -3.048 1.638 1.00 60.03 C ATOM 1491 CZ TYR A 97 -13.323 -2.996 0.559 1.00 23.54 C ATOM 1492 OH TYR A 97 -14.520 -3.684 0.593 1.00 4.15 O ATOM 0 H TYR A 97 -7.257 -0.012 -0.053 1.00 35.00 H new ATOM 0 HA TYR A 97 -8.222 -2.063 1.653 1.00 12.11 H new ATOM 0 HB2 TYR A 97 -9.549 -0.084 1.196 1.00 4.05 H new ATOM 0 HB3 TYR A 97 -9.472 -0.345 -0.535 1.00 4.05 H new ATOM 0 HD1 TYR A 97 -11.539 -1.001 -1.478 1.00 0.02 H new ATOM 0 HD2 TYR A 97 -10.597 -2.409 2.450 1.00 50.41 H new ATOM 0 HE1 TYR A 97 -13.665 -2.224 -1.403 1.00 71.10 H new ATOM 0 HE2 TYR A 97 -12.728 -3.624 2.512 1.00 60.03 H new ATOM 0 HH TYR A 97 -14.604 -4.152 1.450 1.00 4.15 H new ATOM 1502 N LEU A 98 -7.978 -2.833 -1.554 1.00 73.01 N ATOM 1503 CA LEU A 98 -7.975 -3.927 -2.544 1.00 54.31 C ATOM 1504 C LEU A 98 -6.580 -4.575 -2.655 1.00 53.11 C ATOM 1505 O LEU A 98 -6.426 -5.615 -3.313 1.00 52.43 O ATOM 1506 CB LEU A 98 -8.463 -3.387 -3.915 1.00 54.35 C ATOM 1507 CG LEU A 98 -9.920 -2.818 -3.948 1.00 22.25 C ATOM 1508 CD1 LEU A 98 -10.322 -2.347 -5.368 1.00 55.53 C ATOM 1509 CD2 LEU A 98 -10.929 -3.841 -3.380 1.00 71.33 C ATOM 0 H LEU A 98 -7.683 -1.936 -1.939 1.00 73.01 H new ATOM 0 HA LEU A 98 -8.661 -4.707 -2.213 1.00 54.31 H new ATOM 0 HB2 LEU A 98 -7.780 -2.601 -4.238 1.00 54.35 H new ATOM 0 HB3 LEU A 98 -8.392 -4.192 -4.647 1.00 54.35 H new ATOM 0 HG LEU A 98 -9.943 -1.938 -3.305 1.00 22.25 H new ATOM 0 HD11 LEU A 98 -11.340 -1.959 -5.348 1.00 55.53 H new ATOM 0 HD12 LEU A 98 -9.641 -1.562 -5.697 1.00 55.53 H new ATOM 0 HD13 LEU A 98 -10.268 -3.188 -6.059 1.00 55.53 H new ATOM 0 HD21 LEU A 98 -11.933 -3.419 -3.415 1.00 71.33 H new ATOM 0 HD22 LEU A 98 -10.897 -4.753 -3.976 1.00 71.33 H new ATOM 0 HD23 LEU A 98 -10.669 -4.074 -2.347 1.00 71.33 H new ATOM 1521 N ASP A 99 -5.586 -3.932 -2.005 1.00 0.34 N ATOM 1522 CA ASP A 99 -4.180 -4.394 -1.906 1.00 41.33 C ATOM 1523 C ASP A 99 -3.534 -4.600 -3.305 1.00 22.33 C ATOM 1524 O ASP A 99 -2.664 -5.453 -3.504 1.00 51.05 O ATOM 1525 CB ASP A 99 -4.091 -5.661 -0.993 1.00 23.22 C ATOM 1526 CG ASP A 99 -2.654 -6.041 -0.579 1.00 23.11 C ATOM 1527 OD1 ASP A 99 -2.320 -7.244 -0.552 1.00 33.55 O ATOM 1528 OD2 ASP A 99 -1.847 -5.138 -0.277 1.00 53.04 O ATOM 0 H ASP A 99 -5.742 -3.049 -1.519 1.00 0.34 H new ATOM 0 HA ASP A 99 -3.590 -3.611 -1.431 1.00 41.33 H new ATOM 0 HB2 ASP A 99 -4.683 -5.490 -0.094 1.00 23.22 H new ATOM 0 HB3 ASP A 99 -4.542 -6.505 -1.516 1.00 23.22 H new ATOM 1533 N ILE A 100 -3.944 -3.751 -4.263 1.00 1.22 N ATOM 1534 CA ILE A 100 -3.437 -3.787 -5.643 1.00 73.30 C ATOM 1535 C ILE A 100 -2.091 -3.048 -5.706 1.00 12.55 C ATOM 1536 O ILE A 100 -2.060 -1.818 -5.643 1.00 1.32 O ATOM 1537 CB ILE A 100 -4.452 -3.141 -6.659 1.00 12.40 C ATOM 1538 CG1 ILE A 100 -5.852 -3.789 -6.500 1.00 62.05 C ATOM 1539 CG2 ILE A 100 -3.945 -3.282 -8.118 1.00 62.44 C ATOM 1540 CD1 ILE A 100 -6.935 -3.234 -7.405 1.00 51.43 C ATOM 0 H ILE A 100 -4.637 -3.020 -4.101 1.00 1.22 H new ATOM 0 HA ILE A 100 -3.308 -4.830 -5.930 1.00 73.30 H new ATOM 0 HB ILE A 100 -4.532 -2.077 -6.436 1.00 12.40 H new ATOM 0 HG12 ILE A 100 -5.761 -4.859 -6.686 1.00 62.05 H new ATOM 0 HG13 ILE A 100 -6.172 -3.671 -5.465 1.00 62.05 H new ATOM 0 HG21 ILE A 100 -4.665 -2.828 -8.799 1.00 62.44 H new ATOM 0 HG22 ILE A 100 -2.983 -2.780 -8.219 1.00 62.44 H new ATOM 0 HG23 ILE A 100 -3.831 -4.338 -8.363 1.00 62.44 H new ATOM 0 HD11 ILE A 100 -7.872 -3.756 -7.213 1.00 51.43 H new ATOM 0 HD12 ILE A 100 -7.065 -2.170 -7.207 1.00 51.43 H new ATOM 0 HD13 ILE A 100 -6.647 -3.377 -8.447 1.00 51.43 H new ATOM 1552 N LYS A 101 -0.992 -3.823 -5.822 1.00 21.44 N ATOM 1553 CA LYS A 101 0.390 -3.291 -5.846 1.00 40.10 C ATOM 1554 C LYS A 101 0.640 -2.324 -7.052 1.00 24.44 C ATOM 1555 O LYS A 101 1.155 -1.232 -6.817 1.00 25.34 O ATOM 1556 CB LYS A 101 1.458 -4.441 -5.829 1.00 32.53 C ATOM 1557 CG LYS A 101 1.594 -5.228 -4.496 1.00 54.13 C ATOM 1558 CD LYS A 101 0.424 -6.205 -4.212 1.00 12.50 C ATOM 1559 CE LYS A 101 0.529 -6.865 -2.823 1.00 31.33 C ATOM 1560 NZ LYS A 101 0.497 -5.851 -1.741 1.00 13.41 N ATOM 0 H LYS A 101 -1.037 -4.839 -5.902 1.00 21.44 H new ATOM 0 HA LYS A 101 0.504 -2.708 -4.932 1.00 40.10 H new ATOM 0 HB2 LYS A 101 1.213 -5.148 -6.622 1.00 32.53 H new ATOM 0 HB3 LYS A 101 2.429 -4.011 -6.074 1.00 32.53 H new ATOM 0 HG2 LYS A 101 2.527 -5.792 -4.513 1.00 54.13 H new ATOM 0 HG3 LYS A 101 1.667 -4.517 -3.673 1.00 54.13 H new ATOM 0 HD2 LYS A 101 -0.521 -5.666 -4.284 1.00 12.50 H new ATOM 0 HD3 LYS A 101 0.408 -6.980 -4.978 1.00 12.50 H new ATOM 0 HE2 LYS A 101 -0.293 -7.569 -2.689 1.00 31.33 H new ATOM 0 HE3 LYS A 101 1.454 -7.439 -2.760 1.00 31.33 H new ATOM 0 HZ1 LYS A 101 0.365 -6.325 -0.825 1.00 13.41 H new ATOM 0 HZ2 LYS A 101 1.394 -5.324 -1.732 1.00 13.41 H new ATOM 0 HZ3 LYS A 101 -0.290 -5.191 -1.906 1.00 13.41 H new ATOM 1574 N PRO A 102 0.292 -2.683 -8.368 1.00 13.41 N ATOM 1575 CA PRO A 102 0.487 -1.750 -9.521 1.00 71.32 C ATOM 1576 C PRO A 102 -0.247 -0.394 -9.350 1.00 21.34 C ATOM 1577 O PRO A 102 0.310 0.650 -9.688 1.00 24.43 O ATOM 1578 CB PRO A 102 -0.056 -2.546 -10.757 1.00 73.23 C ATOM 1579 CG PRO A 102 -0.886 -3.656 -10.180 1.00 31.04 C ATOM 1580 CD PRO A 102 -0.256 -3.992 -8.845 1.00 24.15 C ATOM 0 HA PRO A 102 1.534 -1.466 -9.623 1.00 71.32 H new ATOM 0 HB2 PRO A 102 -0.653 -1.905 -11.406 1.00 73.23 H new ATOM 0 HB3 PRO A 102 0.761 -2.939 -11.361 1.00 73.23 H new ATOM 0 HG2 PRO A 102 -1.923 -3.344 -10.055 1.00 31.04 H new ATOM 0 HG3 PRO A 102 -0.891 -4.524 -10.839 1.00 31.04 H new ATOM 0 HD2 PRO A 102 -0.989 -4.397 -8.147 1.00 24.15 H new ATOM 0 HD3 PRO A 102 0.530 -4.740 -8.951 1.00 24.15 H new ATOM 1588 N LEU A 103 -1.478 -0.418 -8.793 1.00 44.23 N ATOM 1589 CA LEU A 103 -2.289 0.803 -8.582 1.00 44.13 C ATOM 1590 C LEU A 103 -1.628 1.662 -7.491 1.00 21.02 C ATOM 1591 O LEU A 103 -1.337 2.845 -7.702 1.00 54.32 O ATOM 1592 CB LEU A 103 -3.755 0.424 -8.168 1.00 44.21 C ATOM 1593 CG LEU A 103 -4.904 1.466 -8.467 1.00 21.40 C ATOM 1594 CD1 LEU A 103 -4.756 2.816 -7.715 1.00 15.33 C ATOM 1595 CD2 LEU A 103 -5.038 1.689 -9.980 1.00 72.32 C ATOM 0 H LEU A 103 -1.934 -1.275 -8.480 1.00 44.23 H new ATOM 0 HA LEU A 103 -2.338 1.371 -9.511 1.00 44.13 H new ATOM 0 HB2 LEU A 103 -4.012 -0.509 -8.669 1.00 44.21 H new ATOM 0 HB3 LEU A 103 -3.758 0.222 -7.097 1.00 44.21 H new ATOM 0 HG LEU A 103 -5.821 1.023 -8.078 1.00 21.40 H new ATOM 0 HD11 LEU A 103 -5.586 3.472 -7.978 1.00 15.33 H new ATOM 0 HD12 LEU A 103 -4.762 2.636 -6.640 1.00 15.33 H new ATOM 0 HD13 LEU A 103 -3.816 3.289 -7.999 1.00 15.33 H new ATOM 0 HD21 LEU A 103 -5.833 2.409 -10.173 1.00 72.32 H new ATOM 0 HD22 LEU A 103 -4.098 2.072 -10.376 1.00 72.32 H new ATOM 0 HD23 LEU A 103 -5.278 0.744 -10.467 1.00 72.32 H new ATOM 1607 N LEU A 104 -1.363 1.009 -6.349 1.00 30.24 N ATOM 1608 CA LEU A 104 -0.866 1.651 -5.126 1.00 12.43 C ATOM 1609 C LEU A 104 0.494 2.317 -5.360 1.00 42.21 C ATOM 1610 O LEU A 104 0.700 3.462 -4.960 1.00 54.14 O ATOM 1611 CB LEU A 104 -0.775 0.601 -3.985 1.00 23.14 C ATOM 1612 CG LEU A 104 -0.376 1.125 -2.567 1.00 61.51 C ATOM 1613 CD1 LEU A 104 -1.360 2.208 -2.055 1.00 21.33 C ATOM 1614 CD2 LEU A 104 -0.271 -0.054 -1.570 1.00 45.20 C ATOM 0 H LEU A 104 -1.491 0.002 -6.250 1.00 30.24 H new ATOM 0 HA LEU A 104 -1.567 2.434 -4.836 1.00 12.43 H new ATOM 0 HB2 LEU A 104 -1.742 0.105 -3.903 1.00 23.14 H new ATOM 0 HB3 LEU A 104 -0.052 -0.159 -4.281 1.00 23.14 H new ATOM 0 HG LEU A 104 0.602 1.599 -2.647 1.00 61.51 H new ATOM 0 HD11 LEU A 104 -1.047 2.546 -1.067 1.00 21.33 H new ATOM 0 HD12 LEU A 104 -1.362 3.053 -2.744 1.00 21.33 H new ATOM 0 HD13 LEU A 104 -2.364 1.788 -1.994 1.00 21.33 H new ATOM 0 HD21 LEU A 104 0.007 0.325 -0.587 1.00 45.20 H new ATOM 0 HD22 LEU A 104 -1.233 -0.562 -1.504 1.00 45.20 H new ATOM 0 HD23 LEU A 104 0.487 -0.757 -1.916 1.00 45.20 H new ATOM 1626 N ASP A 105 1.383 1.596 -6.063 1.00 51.33 N ATOM 1627 CA ASP A 105 2.765 2.037 -6.308 1.00 64.40 C ATOM 1628 C ASP A 105 2.786 3.278 -7.205 1.00 64.53 C ATOM 1629 O ASP A 105 3.421 4.269 -6.866 1.00 12.10 O ATOM 1630 CB ASP A 105 3.612 0.894 -6.922 1.00 1.05 C ATOM 1631 CG ASP A 105 5.110 1.247 -6.990 1.00 51.42 C ATOM 1632 OD1 ASP A 105 5.796 1.160 -5.944 1.00 70.23 O ATOM 1633 OD2 ASP A 105 5.603 1.671 -8.061 1.00 3.42 O ATOM 0 H ASP A 105 1.163 0.690 -6.477 1.00 51.33 H new ATOM 0 HA ASP A 105 3.210 2.304 -5.350 1.00 64.40 H new ATOM 0 HB2 ASP A 105 3.481 -0.011 -6.329 1.00 1.05 H new ATOM 0 HB3 ASP A 105 3.247 0.673 -7.925 1.00 1.05 H new ATOM 1638 N VAL A 106 2.052 3.216 -8.329 1.00 12.12 N ATOM 1639 CA VAL A 106 1.947 4.330 -9.296 1.00 54.03 C ATOM 1640 C VAL A 106 1.403 5.612 -8.617 1.00 64.44 C ATOM 1641 O VAL A 106 1.953 6.704 -8.807 1.00 1.50 O ATOM 1642 CB VAL A 106 1.047 3.909 -10.528 1.00 3.01 C ATOM 1643 CG1 VAL A 106 0.618 5.110 -11.409 1.00 74.50 C ATOM 1644 CG2 VAL A 106 1.767 2.839 -11.385 1.00 12.54 C ATOM 0 H VAL A 106 1.513 2.392 -8.596 1.00 12.12 H new ATOM 0 HA VAL A 106 2.947 4.556 -9.666 1.00 54.03 H new ATOM 0 HB VAL A 106 0.132 3.486 -10.113 1.00 3.01 H new ATOM 0 HG11 VAL A 106 0.004 4.754 -12.236 1.00 74.50 H new ATOM 0 HG12 VAL A 106 0.044 5.815 -10.808 1.00 74.50 H new ATOM 0 HG13 VAL A 106 1.504 5.607 -11.804 1.00 74.50 H new ATOM 0 HG21 VAL A 106 1.134 2.561 -12.228 1.00 12.54 H new ATOM 0 HG22 VAL A 106 2.709 3.244 -11.756 1.00 12.54 H new ATOM 0 HG23 VAL A 106 1.966 1.958 -10.775 1.00 12.54 H new ATOM 1654 N THR A 107 0.357 5.450 -7.790 1.00 14.51 N ATOM 1655 CA THR A 107 -0.320 6.570 -7.102 1.00 74.11 C ATOM 1656 C THR A 107 0.535 7.134 -5.925 1.00 62.23 C ATOM 1657 O THR A 107 0.478 8.335 -5.619 1.00 63.35 O ATOM 1658 CB THR A 107 -1.734 6.109 -6.613 1.00 51.24 C ATOM 1659 OG1 THR A 107 -2.444 5.519 -7.716 1.00 60.30 O ATOM 1660 CG2 THR A 107 -2.580 7.262 -6.060 1.00 32.22 C ATOM 0 H THR A 107 -0.046 4.538 -7.577 1.00 14.51 H new ATOM 0 HA THR A 107 -0.441 7.387 -7.813 1.00 74.11 H new ATOM 0 HB THR A 107 -1.574 5.394 -5.806 1.00 51.24 H new ATOM 0 HG1 THR A 107 -2.124 4.604 -7.859 1.00 60.30 H new ATOM 0 HG21 THR A 107 -3.549 6.880 -5.737 1.00 32.22 H new ATOM 0 HG22 THR A 107 -2.067 7.715 -5.211 1.00 32.22 H new ATOM 0 HG23 THR A 107 -2.726 8.011 -6.838 1.00 32.22 H new ATOM 1668 N CYS A 108 1.335 6.259 -5.283 1.00 25.45 N ATOM 1669 CA CYS A 108 2.283 6.665 -4.217 1.00 3.54 C ATOM 1670 C CYS A 108 3.522 7.353 -4.829 1.00 65.14 C ATOM 1671 O CYS A 108 4.151 8.205 -4.197 1.00 14.20 O ATOM 1672 CB CYS A 108 2.701 5.446 -3.359 1.00 11.12 C ATOM 1673 SG CYS A 108 1.341 4.711 -2.427 1.00 11.40 S ATOM 0 H CYS A 108 1.345 5.259 -5.484 1.00 25.45 H new ATOM 0 HA CYS A 108 1.780 7.380 -3.566 1.00 3.54 H new ATOM 0 HB2 CYS A 108 3.135 4.687 -4.010 1.00 11.12 H new ATOM 0 HB3 CYS A 108 3.482 5.754 -2.663 1.00 11.12 H new ATOM 0 HG CYS A 108 0.651 3.933 -3.207 1.00 11.40 H new ATOM 1679 N LYS A 109 3.871 6.957 -6.063 1.00 74.35 N ATOM 1680 CA LYS A 109 4.965 7.578 -6.836 1.00 62.33 C ATOM 1681 C LYS A 109 4.521 8.946 -7.378 1.00 21.04 C ATOM 1682 O LYS A 109 5.357 9.821 -7.558 1.00 4.51 O ATOM 1683 CB LYS A 109 5.500 6.625 -7.962 1.00 60.51 C ATOM 1684 CG LYS A 109 6.695 5.712 -7.533 1.00 24.31 C ATOM 1685 CD LYS A 109 6.425 4.906 -6.241 1.00 23.32 C ATOM 1686 CE LYS A 109 7.627 4.066 -5.787 1.00 43.13 C ATOM 1687 NZ LYS A 109 7.994 3.025 -6.780 1.00 61.31 N ATOM 0 H LYS A 109 3.404 6.196 -6.556 1.00 74.35 H new ATOM 0 HA LYS A 109 5.809 7.747 -6.167 1.00 62.33 H new ATOM 0 HB2 LYS A 109 4.681 5.992 -8.302 1.00 60.51 H new ATOM 0 HB3 LYS A 109 5.810 7.230 -8.814 1.00 60.51 H new ATOM 0 HG2 LYS A 109 6.921 5.019 -8.343 1.00 24.31 H new ATOM 0 HG3 LYS A 109 7.580 6.331 -7.387 1.00 24.31 H new ATOM 0 HD2 LYS A 109 6.149 5.595 -5.442 1.00 23.32 H new ATOM 0 HD3 LYS A 109 5.571 4.248 -6.403 1.00 23.32 H new ATOM 0 HE2 LYS A 109 8.482 4.721 -5.618 1.00 43.13 H new ATOM 0 HE3 LYS A 109 7.396 3.590 -4.834 1.00 43.13 H new ATOM 0 HZ1 LYS A 109 8.281 2.157 -6.283 1.00 61.31 H new ATOM 0 HZ2 LYS A 109 7.175 2.821 -7.388 1.00 61.31 H new ATOM 0 HZ3 LYS A 109 8.783 3.366 -7.365 1.00 61.31 H new ATOM 1701 N THR A 110 3.202 9.112 -7.624 1.00 41.00 N ATOM 1702 CA THR A 110 2.610 10.396 -8.042 1.00 10.41 C ATOM 1703 C THR A 110 2.920 11.512 -7.017 1.00 41.53 C ATOM 1704 O THR A 110 3.484 12.555 -7.380 1.00 72.21 O ATOM 1705 CB THR A 110 1.063 10.264 -8.227 1.00 41.31 C ATOM 1706 OG1 THR A 110 0.773 9.243 -9.190 1.00 24.45 O ATOM 1707 CG2 THR A 110 0.404 11.587 -8.665 1.00 71.25 C ATOM 0 H THR A 110 2.521 8.358 -7.537 1.00 41.00 H new ATOM 0 HA THR A 110 3.058 10.666 -8.998 1.00 10.41 H new ATOM 0 HB THR A 110 0.646 9.997 -7.256 1.00 41.31 H new ATOM 0 HG1 THR A 110 1.149 8.390 -8.886 1.00 24.45 H new ATOM 0 HG21 THR A 110 -0.670 11.438 -8.779 1.00 71.25 H new ATOM 0 HG22 THR A 110 0.587 12.352 -7.910 1.00 71.25 H new ATOM 0 HG23 THR A 110 0.829 11.907 -9.616 1.00 71.25 H new ATOM 1715 N VAL A 111 2.588 11.257 -5.729 1.00 22.34 N ATOM 1716 CA VAL A 111 2.865 12.218 -4.636 1.00 13.54 C ATOM 1717 C VAL A 111 4.379 12.372 -4.415 1.00 31.34 C ATOM 1718 O VAL A 111 4.844 13.482 -4.146 1.00 14.00 O ATOM 1719 CB VAL A 111 2.145 11.849 -3.280 1.00 25.23 C ATOM 1720 CG1 VAL A 111 0.618 12.059 -3.373 1.00 0.13 C ATOM 1721 CG2 VAL A 111 2.469 10.409 -2.827 1.00 63.12 C ATOM 0 H VAL A 111 2.130 10.398 -5.423 1.00 22.34 H new ATOM 0 HA VAL A 111 2.448 13.172 -4.959 1.00 13.54 H new ATOM 0 HB VAL A 111 2.536 12.530 -2.524 1.00 25.23 H new ATOM 0 HG11 VAL A 111 0.156 11.795 -2.422 1.00 0.13 H new ATOM 0 HG12 VAL A 111 0.408 13.104 -3.601 1.00 0.13 H new ATOM 0 HG13 VAL A 111 0.211 11.426 -4.162 1.00 0.13 H new ATOM 0 HG21 VAL A 111 1.953 10.197 -1.890 1.00 63.12 H new ATOM 0 HG22 VAL A 111 2.139 9.704 -3.590 1.00 63.12 H new ATOM 0 HG23 VAL A 111 3.544 10.307 -2.680 1.00 63.12 H new ATOM 1731 N ALA A 112 5.126 11.261 -4.587 1.00 31.12 N ATOM 1732 CA ALA A 112 6.595 11.238 -4.446 1.00 43.51 C ATOM 1733 C ALA A 112 7.279 12.161 -5.473 1.00 35.43 C ATOM 1734 O ALA A 112 8.285 12.797 -5.164 1.00 42.13 O ATOM 1735 CB ALA A 112 7.116 9.807 -4.587 1.00 15.44 C ATOM 0 H ALA A 112 4.726 10.354 -4.828 1.00 31.12 H new ATOM 0 HA ALA A 112 6.840 11.612 -3.452 1.00 43.51 H new ATOM 0 HB1 ALA A 112 8.201 9.803 -4.481 1.00 15.44 H new ATOM 0 HB2 ALA A 112 6.673 9.181 -3.812 1.00 15.44 H new ATOM 0 HB3 ALA A 112 6.846 9.416 -5.568 1.00 15.44 H new ATOM 1741 N ASN A 113 6.707 12.223 -6.688 1.00 2.22 N ATOM 1742 CA ASN A 113 7.219 13.072 -7.783 1.00 50.11 C ATOM 1743 C ASN A 113 6.928 14.554 -7.504 1.00 74.01 C ATOM 1744 O ASN A 113 7.798 15.405 -7.710 1.00 14.42 O ATOM 1745 CB ASN A 113 6.593 12.652 -9.149 1.00 14.12 C ATOM 1746 CG ASN A 113 7.038 11.262 -9.631 1.00 34.11 C ATOM 1747 OD1 ASN A 113 8.149 10.812 -9.340 1.00 13.11 O ATOM 1748 ND2 ASN A 113 6.174 10.573 -10.367 1.00 12.20 N ATOM 0 H ASN A 113 5.877 11.687 -6.941 1.00 2.22 H new ATOM 0 HA ASN A 113 8.299 12.933 -7.838 1.00 50.11 H new ATOM 0 HB2 ASN A 113 5.507 12.666 -9.060 1.00 14.12 H new ATOM 0 HB3 ASN A 113 6.860 13.391 -9.904 1.00 14.12 H new ATOM 0 HD21 ASN A 113 6.422 9.644 -10.708 1.00 12.20 H new ATOM 0 HD22 ASN A 113 5.263 10.972 -10.591 1.00 12.20 H new ATOM 1755 N MET A 114 5.700 14.845 -7.024 1.00 71.25 N ATOM 1756 CA MET A 114 5.226 16.228 -6.787 1.00 42.31 C ATOM 1757 C MET A 114 6.049 16.937 -5.693 1.00 12.33 C ATOM 1758 O MET A 114 6.339 18.135 -5.798 1.00 24.12 O ATOM 1759 CB MET A 114 3.714 16.256 -6.411 1.00 74.43 C ATOM 1760 CG MET A 114 2.760 15.767 -7.511 1.00 41.22 C ATOM 1761 SD MET A 114 1.019 16.116 -7.139 1.00 3.22 S ATOM 1762 CE MET A 114 0.767 15.279 -5.567 1.00 1.13 C ATOM 0 H MET A 114 5.010 14.131 -6.790 1.00 71.25 H new ATOM 0 HA MET A 114 5.364 16.768 -7.724 1.00 42.31 H new ATOM 0 HB2 MET A 114 3.565 15.642 -5.523 1.00 74.43 H new ATOM 0 HB3 MET A 114 3.441 17.277 -6.142 1.00 74.43 H new ATOM 0 HG2 MET A 114 3.027 16.242 -8.455 1.00 41.22 H new ATOM 0 HG3 MET A 114 2.889 14.693 -7.647 1.00 41.22 H new ATOM 0 HE1 MET A 114 -0.166 15.620 -5.119 1.00 1.13 H new ATOM 0 HE2 MET A 114 0.719 14.203 -5.732 1.00 1.13 H new ATOM 0 HE3 MET A 114 1.596 15.507 -4.897 1.00 1.13 H new ATOM 1772 N ILE A 115 6.417 16.179 -4.645 1.00 21.13 N ATOM 1773 CA ILE A 115 7.192 16.708 -3.501 1.00 14.11 C ATOM 1774 C ILE A 115 8.700 16.730 -3.812 1.00 60.12 C ATOM 1775 O ILE A 115 9.438 17.562 -3.276 1.00 24.01 O ATOM 1776 CB ILE A 115 6.923 15.877 -2.194 1.00 72.05 C ATOM 1777 CG1 ILE A 115 7.349 14.388 -2.391 1.00 21.14 C ATOM 1778 CG2 ILE A 115 5.438 15.999 -1.785 1.00 0.44 C ATOM 1779 CD1 ILE A 115 7.106 13.477 -1.216 1.00 42.21 C ATOM 0 H ILE A 115 6.189 15.188 -4.564 1.00 21.13 H new ATOM 0 HA ILE A 115 6.858 17.732 -3.332 1.00 14.11 H new ATOM 0 HB ILE A 115 7.528 16.282 -1.383 1.00 72.05 H new ATOM 0 HG12 ILE A 115 6.816 13.988 -3.253 1.00 21.14 H new ATOM 0 HG13 ILE A 115 8.411 14.362 -2.633 1.00 21.14 H new ATOM 0 HG21 ILE A 115 5.262 15.420 -0.879 1.00 0.44 H new ATOM 0 HG22 ILE A 115 5.196 17.046 -1.600 1.00 0.44 H new ATOM 0 HG23 ILE A 115 4.807 15.618 -2.588 1.00 0.44 H new ATOM 0 HD11 ILE A 115 7.438 12.469 -1.463 1.00 42.21 H new ATOM 0 HD12 ILE A 115 7.662 13.841 -0.352 1.00 42.21 H new ATOM 0 HD13 ILE A 115 6.042 13.461 -0.982 1.00 42.21 H new ATOM 1791 N ARG A 116 9.153 15.801 -4.677 1.00 71.11 N ATOM 1792 CA ARG A 116 10.561 15.734 -5.093 1.00 72.34 C ATOM 1793 C ARG A 116 10.805 16.788 -6.186 1.00 31.53 C ATOM 1794 O ARG A 116 10.469 16.575 -7.360 1.00 0.32 O ATOM 1795 CB ARG A 116 10.937 14.315 -5.602 1.00 43.32 C ATOM 1796 CG ARG A 116 12.457 14.115 -5.941 1.00 5.04 C ATOM 1797 CD ARG A 116 12.693 13.441 -7.303 1.00 21.42 C ATOM 1798 NE ARG A 116 12.210 14.282 -8.413 1.00 73.23 N ATOM 1799 CZ ARG A 116 12.358 14.003 -9.716 1.00 10.33 C ATOM 1800 NH1 ARG A 116 12.979 12.892 -10.114 1.00 13.22 N ATOM 1801 NH2 ARG A 116 11.886 14.846 -10.621 1.00 71.12 N ATOM 0 H ARG A 116 8.560 15.087 -5.100 1.00 71.11 H new ATOM 0 HA ARG A 116 11.196 15.942 -4.232 1.00 72.34 H new ATOM 0 HB2 ARG A 116 10.650 13.585 -4.845 1.00 43.32 H new ATOM 0 HB3 ARG A 116 10.349 14.097 -6.494 1.00 43.32 H new ATOM 0 HG2 ARG A 116 12.955 15.085 -5.932 1.00 5.04 H new ATOM 0 HG3 ARG A 116 12.920 13.512 -5.160 1.00 5.04 H new ATOM 0 HD2 ARG A 116 13.757 13.242 -7.432 1.00 21.42 H new ATOM 0 HD3 ARG A 116 12.183 12.478 -7.327 1.00 21.42 H new ATOM 0 HE ARG A 116 11.724 15.145 -8.170 1.00 73.23 H new ATOM 0 HH11 ARG A 116 13.350 12.240 -9.423 1.00 13.22 H new ATOM 0 HH12 ARG A 116 13.083 12.695 -11.109 1.00 13.22 H new ATOM 0 HH21 ARG A 116 11.414 15.700 -10.325 1.00 71.12 H new ATOM 0 HH22 ARG A 116 11.994 14.641 -11.614 1.00 71.12 H new ATOM 1815 N GLY A 117 11.325 17.944 -5.760 1.00 62.45 N ATOM 1816 CA GLY A 117 11.758 19.007 -6.676 1.00 25.34 C ATOM 1817 C GLY A 117 12.940 18.597 -7.576 1.00 43.23 C ATOM 1818 O GLY A 117 13.744 17.724 -7.174 1.00 64.30 O ATOM 1819 OXT GLY A 117 13.077 19.158 -8.685 1.00 37.09 O ATOM 0 H GLY A 117 11.458 18.170 -4.774 1.00 62.45 H new ATOM 0 HA2 GLY A 117 10.917 19.299 -7.305 1.00 25.34 H new ATOM 0 HA3 GLY A 117 12.041 19.884 -6.094 1.00 25.34 H new TER 1823 GLY A 117 ATOM 1824 N SER B 2 17.941 -15.151 15.493 1.00 12.22 N ATOM 1825 CA SER B 2 18.994 -14.119 15.568 1.00 13.21 C ATOM 1826 C SER B 2 18.455 -12.745 15.130 1.00 5.33 C ATOM 1827 O SER B 2 17.377 -12.652 14.514 1.00 0.32 O ATOM 1828 CB SER B 2 20.195 -14.548 14.692 1.00 14.22 C ATOM 1829 OG SER B 2 20.689 -15.820 15.100 1.00 73.12 O ATOM 0 HA SER B 2 19.324 -14.023 16.603 1.00 13.21 H new ATOM 0 HB2 SER B 2 19.892 -14.589 13.646 1.00 14.22 H new ATOM 0 HB3 SER B 2 20.988 -13.804 14.765 1.00 14.22 H new ATOM 0 HG SER B 2 19.940 -16.388 15.378 1.00 73.12 H new ATOM 1837 N LEU B 3 19.211 -11.681 15.474 1.00 2.21 N ATOM 1838 CA LEU B 3 18.946 -10.316 14.993 1.00 51.42 C ATOM 1839 C LEU B 3 19.312 -10.211 13.500 1.00 20.25 C ATOM 1840 O LEU B 3 20.484 -10.384 13.131 1.00 21.32 O ATOM 1841 CB LEU B 3 19.761 -9.274 15.819 1.00 52.12 C ATOM 1842 CG LEU B 3 19.420 -9.204 17.337 1.00 15.24 C ATOM 1843 CD1 LEU B 3 20.403 -8.284 18.093 1.00 51.33 C ATOM 1844 CD2 LEU B 3 17.962 -8.754 17.551 1.00 42.43 C ATOM 0 H LEU B 3 20.020 -11.748 16.092 1.00 2.21 H new ATOM 0 HA LEU B 3 17.885 -10.100 15.120 1.00 51.42 H new ATOM 0 HB2 LEU B 3 20.822 -9.502 15.713 1.00 52.12 H new ATOM 0 HB3 LEU B 3 19.602 -8.287 15.383 1.00 52.12 H new ATOM 0 HG LEU B 3 19.528 -10.207 17.749 1.00 15.24 H new ATOM 0 HD11 LEU B 3 20.137 -8.257 19.150 1.00 51.33 H new ATOM 0 HD12 LEU B 3 21.417 -8.668 17.984 1.00 51.33 H new ATOM 0 HD13 LEU B 3 20.350 -7.277 17.680 1.00 51.33 H new ATOM 0 HD21 LEU B 3 17.747 -8.713 18.619 1.00 42.43 H new ATOM 0 HD22 LEU B 3 17.818 -7.766 17.113 1.00 42.43 H new ATOM 0 HD23 LEU B 3 17.288 -9.465 17.073 1.00 42.43 H new ATOM 1856 N VAL B 4 18.306 -9.941 12.654 1.00 53.34 N ATOM 1857 CA VAL B 4 18.509 -9.697 11.218 1.00 65.21 C ATOM 1858 C VAL B 4 18.947 -8.235 11.003 1.00 31.15 C ATOM 1859 O VAL B 4 18.299 -7.290 11.473 1.00 43.13 O ATOM 1860 CB VAL B 4 17.231 -10.053 10.361 1.00 63.13 C ATOM 1861 CG1 VAL B 4 16.953 -11.577 10.412 1.00 74.34 C ATOM 1862 CG2 VAL B 4 15.986 -9.246 10.810 1.00 64.43 C ATOM 0 H VAL B 4 17.330 -9.886 12.946 1.00 53.34 H new ATOM 0 HA VAL B 4 19.299 -10.361 10.867 1.00 65.21 H new ATOM 0 HB VAL B 4 17.438 -9.770 9.329 1.00 63.13 H new ATOM 0 HG11 VAL B 4 16.069 -11.806 9.816 1.00 74.34 H new ATOM 0 HG12 VAL B 4 17.811 -12.117 10.011 1.00 74.34 H new ATOM 0 HG13 VAL B 4 16.783 -11.882 11.445 1.00 74.34 H new ATOM 0 HG21 VAL B 4 15.131 -9.523 10.193 1.00 64.43 H new ATOM 0 HG22 VAL B 4 15.767 -9.467 11.855 1.00 64.43 H new ATOM 0 HG23 VAL B 4 16.184 -8.180 10.698 1.00 64.43 H new ATOM 1872 N LYS B 5 20.081 -8.074 10.325 1.00 70.34 N ATOM 1873 CA LYS B 5 20.716 -6.778 10.101 1.00 13.12 C ATOM 1874 C LYS B 5 20.239 -6.225 8.752 1.00 13.44 C ATOM 1875 O LYS B 5 20.525 -6.805 7.699 1.00 40.14 O ATOM 1876 CB LYS B 5 22.253 -6.954 10.141 1.00 42.15 C ATOM 1877 CG LYS B 5 22.777 -7.662 11.411 1.00 31.41 C ATOM 1878 CD LYS B 5 24.320 -7.709 11.490 1.00 71.41 C ATOM 1879 CE LYS B 5 24.807 -8.466 12.736 1.00 53.22 C ATOM 1880 NZ LYS B 5 26.282 -8.420 12.888 1.00 52.03 N ATOM 0 H LYS B 5 20.592 -8.853 9.909 1.00 70.34 H new ATOM 0 HA LYS B 5 20.441 -6.066 10.879 1.00 13.12 H new ATOM 0 HB2 LYS B 5 22.565 -7.524 9.266 1.00 42.15 H new ATOM 0 HB3 LYS B 5 22.722 -5.973 10.066 1.00 42.15 H new ATOM 0 HG2 LYS B 5 22.390 -7.148 12.291 1.00 31.41 H new ATOM 0 HG3 LYS B 5 22.387 -8.680 11.439 1.00 31.41 H new ATOM 0 HD2 LYS B 5 24.715 -8.190 10.595 1.00 71.41 H new ATOM 0 HD3 LYS B 5 24.714 -6.693 11.505 1.00 71.41 H new ATOM 0 HE2 LYS B 5 24.340 -8.038 13.623 1.00 53.22 H new ATOM 0 HE3 LYS B 5 24.483 -9.505 12.676 1.00 53.22 H new ATOM 0 HZ1 LYS B 5 26.559 -8.944 13.742 1.00 52.03 H new ATOM 0 HZ2 LYS B 5 26.730 -8.852 12.055 1.00 52.03 H new ATOM 0 HZ3 LYS B 5 26.592 -7.431 12.973 1.00 52.03 H new ATOM 1894 N LEU B 6 19.450 -5.149 8.807 1.00 21.03 N ATOM 1895 CA LEU B 6 18.816 -4.547 7.627 1.00 73.01 C ATOM 1896 C LEU B 6 19.445 -3.178 7.358 1.00 62.51 C ATOM 1897 O LEU B 6 19.129 -2.201 8.044 1.00 54.11 O ATOM 1898 CB LEU B 6 17.277 -4.434 7.866 1.00 52.32 C ATOM 1899 CG LEU B 6 16.546 -5.771 8.232 1.00 13.43 C ATOM 1900 CD1 LEU B 6 15.049 -5.537 8.535 1.00 31.11 C ATOM 1901 CD2 LEU B 6 16.742 -6.841 7.130 1.00 65.13 C ATOM 0 H LEU B 6 19.230 -4.666 9.678 1.00 21.03 H new ATOM 0 HA LEU B 6 18.977 -5.173 6.749 1.00 73.01 H new ATOM 0 HB2 LEU B 6 17.104 -3.716 8.667 1.00 52.32 H new ATOM 0 HB3 LEU B 6 16.817 -4.025 6.966 1.00 52.32 H new ATOM 0 HG LEU B 6 17.004 -6.153 9.145 1.00 13.43 H new ATOM 0 HD11 LEU B 6 14.576 -6.487 8.785 1.00 31.11 H new ATOM 0 HD12 LEU B 6 14.951 -4.851 9.376 1.00 31.11 H new ATOM 0 HD13 LEU B 6 14.563 -5.109 7.658 1.00 31.11 H new ATOM 0 HD21 LEU B 6 16.223 -7.756 7.415 1.00 65.13 H new ATOM 0 HD22 LEU B 6 16.337 -6.472 6.188 1.00 65.13 H new ATOM 0 HD23 LEU B 6 17.805 -7.050 7.010 1.00 65.13 H new ATOM 1913 N GLU B 7 20.371 -3.119 6.390 1.00 21.53 N ATOM 1914 CA GLU B 7 21.037 -1.862 6.014 1.00 43.10 C ATOM 1915 C GLU B 7 20.131 -1.060 5.093 1.00 34.44 C ATOM 1916 O GLU B 7 19.655 -1.579 4.095 1.00 60.33 O ATOM 1917 CB GLU B 7 22.396 -2.099 5.302 1.00 55.22 C ATOM 1918 CG GLU B 7 23.463 -2.812 6.149 1.00 53.21 C ATOM 1919 CD GLU B 7 23.124 -4.279 6.467 1.00 12.45 C ATOM 1920 OE1 GLU B 7 22.748 -5.023 5.527 1.00 63.04 O ATOM 1921 OE2 GLU B 7 23.242 -4.692 7.639 1.00 34.24 O ATOM 0 H GLU B 7 20.677 -3.929 5.851 1.00 21.53 H new ATOM 0 HA GLU B 7 21.234 -1.315 6.936 1.00 43.10 H new ATOM 0 HB2 GLU B 7 22.218 -2.686 4.401 1.00 55.22 H new ATOM 0 HB3 GLU B 7 22.793 -1.136 4.982 1.00 55.22 H new ATOM 0 HG2 GLU B 7 24.416 -2.775 5.622 1.00 53.21 H new ATOM 0 HG3 GLU B 7 23.594 -2.268 7.084 1.00 53.21 H new ATOM 1928 N SER B 8 19.911 0.201 5.439 1.00 1.02 N ATOM 1929 CA SER B 8 19.196 1.152 4.583 1.00 2.32 C ATOM 1930 C SER B 8 20.044 1.536 3.346 1.00 70.03 C ATOM 1931 O SER B 8 21.175 1.065 3.186 1.00 32.52 O ATOM 1932 CB SER B 8 18.874 2.384 5.441 1.00 62.01 C ATOM 1933 OG SER B 8 20.043 2.885 6.079 1.00 61.13 O ATOM 0 H SER B 8 20.223 0.600 6.324 1.00 1.02 H new ATOM 0 HA SER B 8 18.278 0.706 4.201 1.00 2.32 H new ATOM 0 HB2 SER B 8 18.436 3.162 4.816 1.00 62.01 H new ATOM 0 HB3 SER B 8 18.130 2.123 6.193 1.00 62.01 H new ATOM 0 HG SER B 8 20.657 3.242 5.404 1.00 61.13 H new ATOM 1939 N SER B 9 19.490 2.399 2.480 1.00 23.32 N ATOM 1940 CA SER B 9 20.247 3.034 1.378 1.00 1.10 C ATOM 1941 C SER B 9 21.313 4.009 1.945 1.00 42.44 C ATOM 1942 O SER B 9 22.285 4.349 1.267 1.00 41.34 O ATOM 1943 CB SER B 9 19.271 3.773 0.430 1.00 34.41 C ATOM 1944 OG SER B 9 18.468 4.704 1.143 1.00 51.15 O ATOM 0 H SER B 9 18.510 2.678 2.519 1.00 23.32 H new ATOM 0 HA SER B 9 20.766 2.262 0.810 1.00 1.10 H new ATOM 0 HB2 SER B 9 19.835 4.293 -0.344 1.00 34.41 H new ATOM 0 HB3 SER B 9 18.632 3.049 -0.075 1.00 34.41 H new ATOM 0 HG SER B 9 17.572 4.734 0.747 1.00 51.15 H new ATOM 1950 N ASP B 10 21.105 4.439 3.213 1.00 23.52 N ATOM 1951 CA ASP B 10 22.055 5.276 3.976 1.00 22.35 C ATOM 1952 C ASP B 10 23.053 4.384 4.783 1.00 4.44 C ATOM 1953 O ASP B 10 23.813 4.872 5.633 1.00 4.45 O ATOM 1954 CB ASP B 10 21.235 6.216 4.898 1.00 41.32 C ATOM 1955 CG ASP B 10 22.069 7.304 5.607 1.00 73.22 C ATOM 1956 OD1 ASP B 10 22.500 8.262 4.936 1.00 31.51 O ATOM 1957 OD2 ASP B 10 22.282 7.210 6.835 1.00 11.51 O ATOM 0 H ASP B 10 20.261 4.210 3.739 1.00 23.52 H new ATOM 0 HA ASP B 10 22.661 5.880 3.300 1.00 22.35 H new ATOM 0 HB2 ASP B 10 20.459 6.700 4.305 1.00 41.32 H new ATOM 0 HB3 ASP B 10 20.730 5.614 5.653 1.00 41.32 H new ATOM 1962 N GLU B 11 23.006 3.058 4.506 1.00 24.53 N ATOM 1963 CA GLU B 11 24.007 2.051 4.946 1.00 74.40 C ATOM 1964 C GLU B 11 23.992 1.784 6.470 1.00 40.50 C ATOM 1965 O GLU B 11 24.884 1.103 6.985 1.00 43.50 O ATOM 1966 CB GLU B 11 25.439 2.446 4.459 1.00 15.41 C ATOM 1967 CG GLU B 11 25.574 2.596 2.922 1.00 4.40 C ATOM 1968 CD GLU B 11 26.962 3.055 2.420 1.00 41.23 C ATOM 1969 OE1 GLU B 11 27.182 3.024 1.192 1.00 3.31 O ATOM 1970 OE2 GLU B 11 27.833 3.442 3.232 1.00 64.24 O ATOM 0 H GLU B 11 22.252 2.647 3.956 1.00 24.53 H new ATOM 0 HA GLU B 11 23.718 1.110 4.477 1.00 74.40 H new ATOM 0 HB2 GLU B 11 25.723 3.387 4.930 1.00 15.41 H new ATOM 0 HB3 GLU B 11 26.147 1.692 4.802 1.00 15.41 H new ATOM 0 HG2 GLU B 11 25.337 1.638 2.458 1.00 4.40 H new ATOM 0 HG3 GLU B 11 24.827 3.311 2.577 1.00 4.40 H new ATOM 1977 N LYS B 12 22.966 2.288 7.180 1.00 22.21 N ATOM 1978 CA LYS B 12 22.825 2.085 8.637 1.00 34.41 C ATOM 1979 C LYS B 12 22.296 0.670 8.925 1.00 4.21 C ATOM 1980 O LYS B 12 21.231 0.300 8.432 1.00 42.43 O ATOM 1981 CB LYS B 12 21.886 3.159 9.247 1.00 52.10 C ATOM 1982 CG LYS B 12 22.426 4.601 9.156 1.00 41.14 C ATOM 1983 CD LYS B 12 23.723 4.809 9.966 1.00 71.52 C ATOM 1984 CE LYS B 12 24.234 6.255 9.897 1.00 20.42 C ATOM 1985 NZ LYS B 12 24.573 6.660 8.512 1.00 34.51 N ATOM 0 H LYS B 12 22.217 2.843 6.766 1.00 22.21 H new ATOM 0 HA LYS B 12 23.805 2.189 9.102 1.00 34.41 H new ATOM 0 HB2 LYS B 12 20.922 3.112 8.740 1.00 52.10 H new ATOM 0 HB3 LYS B 12 21.708 2.916 10.294 1.00 52.10 H new ATOM 0 HG2 LYS B 12 22.613 4.848 8.111 1.00 41.14 H new ATOM 0 HG3 LYS B 12 21.664 5.292 9.516 1.00 41.14 H new ATOM 0 HD2 LYS B 12 23.545 4.539 11.007 1.00 71.52 H new ATOM 0 HD3 LYS B 12 24.494 4.136 9.590 1.00 71.52 H new ATOM 0 HE2 LYS B 12 23.474 6.927 10.295 1.00 20.42 H new ATOM 0 HE3 LYS B 12 25.115 6.359 10.531 1.00 20.42 H new ATOM 0 HZ1 LYS B 12 25.142 7.530 8.534 1.00 34.51 H new ATOM 0 HZ2 LYS B 12 25.117 5.902 8.052 1.00 34.51 H new ATOM 0 HZ3 LYS B 12 23.698 6.832 7.977 1.00 34.51 H new ATOM 1999 N VAL B 13 23.063 -0.089 9.729 1.00 62.42 N ATOM 2000 CA VAL B 13 22.778 -1.497 10.061 1.00 33.42 C ATOM 2001 C VAL B 13 21.700 -1.570 11.165 1.00 1.53 C ATOM 2002 O VAL B 13 21.995 -1.330 12.340 1.00 75.50 O ATOM 2003 CB VAL B 13 24.100 -2.225 10.540 1.00 54.14 C ATOM 2004 CG1 VAL B 13 23.851 -3.716 10.876 1.00 61.42 C ATOM 2005 CG2 VAL B 13 25.235 -2.063 9.494 1.00 42.50 C ATOM 0 H VAL B 13 23.911 0.264 10.173 1.00 62.42 H new ATOM 0 HA VAL B 13 22.406 -2.001 9.169 1.00 33.42 H new ATOM 0 HB VAL B 13 24.421 -1.741 11.462 1.00 54.14 H new ATOM 0 HG11 VAL B 13 24.784 -4.177 11.200 1.00 61.42 H new ATOM 0 HG12 VAL B 13 23.113 -3.791 11.675 1.00 61.42 H new ATOM 0 HG13 VAL B 13 23.480 -4.232 9.990 1.00 61.42 H new ATOM 0 HG21 VAL B 13 26.131 -2.572 9.848 1.00 42.50 H new ATOM 0 HG22 VAL B 13 24.921 -2.499 8.546 1.00 42.50 H new ATOM 0 HG23 VAL B 13 25.451 -1.004 9.353 1.00 42.50 H new ATOM 2015 N PHE B 14 20.451 -1.863 10.774 1.00 22.43 N ATOM 2016 CA PHE B 14 19.323 -1.981 11.715 1.00 32.31 C ATOM 2017 C PHE B 14 19.165 -3.439 12.157 1.00 34.54 C ATOM 2018 O PHE B 14 18.465 -4.232 11.513 1.00 12.35 O ATOM 2019 CB PHE B 14 18.020 -1.425 11.086 1.00 72.35 C ATOM 2020 CG PHE B 14 18.096 0.074 10.792 1.00 23.33 C ATOM 2021 CD1 PHE B 14 18.099 1.000 11.837 1.00 54.23 C ATOM 2022 CD2 PHE B 14 18.187 0.557 9.488 1.00 35.43 C ATOM 2023 CE1 PHE B 14 18.191 2.350 11.584 1.00 64.42 C ATOM 2024 CE2 PHE B 14 18.274 1.911 9.238 1.00 74.31 C ATOM 2025 CZ PHE B 14 18.277 2.805 10.287 1.00 33.21 C ATOM 0 H PHE B 14 20.193 -2.025 9.800 1.00 22.43 H new ATOM 0 HA PHE B 14 19.532 -1.380 12.600 1.00 32.31 H new ATOM 0 HB2 PHE B 14 17.811 -1.962 10.161 1.00 72.35 H new ATOM 0 HB3 PHE B 14 17.186 -1.616 11.761 1.00 72.35 H new ATOM 0 HD1 PHE B 14 18.028 0.653 12.857 1.00 54.23 H new ATOM 0 HD2 PHE B 14 18.189 -0.138 8.662 1.00 35.43 H new ATOM 0 HE1 PHE B 14 18.196 3.053 12.404 1.00 64.42 H new ATOM 0 HE2 PHE B 14 18.340 2.270 8.222 1.00 74.31 H new ATOM 0 HZ PHE B 14 18.347 3.865 10.091 1.00 33.21 H new ATOM 2035 N GLU B 15 19.884 -3.786 13.238 1.00 71.12 N ATOM 2036 CA GLU B 15 19.782 -5.098 13.885 1.00 43.45 C ATOM 2037 C GLU B 15 18.444 -5.161 14.633 1.00 62.31 C ATOM 2038 O GLU B 15 18.233 -4.409 15.594 1.00 52.15 O ATOM 2039 CB GLU B 15 20.966 -5.320 14.864 1.00 3.22 C ATOM 2040 CG GLU B 15 22.354 -5.092 14.233 1.00 2.43 C ATOM 2041 CD GLU B 15 23.524 -5.346 15.199 1.00 20.31 C ATOM 2042 OE1 GLU B 15 23.972 -4.395 15.873 1.00 33.04 O ATOM 2043 OE2 GLU B 15 24.005 -6.489 15.287 1.00 40.43 O ATOM 0 H GLU B 15 20.553 -3.160 13.686 1.00 71.12 H new ATOM 0 HA GLU B 15 19.826 -5.887 13.134 1.00 43.45 H new ATOM 0 HB2 GLU B 15 20.851 -4.649 15.715 1.00 3.22 H new ATOM 0 HB3 GLU B 15 20.917 -6.338 15.252 1.00 3.22 H new ATOM 0 HG2 GLU B 15 22.461 -5.746 13.367 1.00 2.43 H new ATOM 0 HG3 GLU B 15 22.413 -4.067 13.867 1.00 2.43 H new ATOM 2050 N ILE B 16 17.535 -6.010 14.165 1.00 34.00 N ATOM 2051 CA ILE B 16 16.187 -6.127 14.730 1.00 22.03 C ATOM 2052 C ILE B 16 15.773 -7.605 14.767 1.00 61.13 C ATOM 2053 O ILE B 16 16.327 -8.421 14.025 1.00 53.13 O ATOM 2054 CB ILE B 16 15.169 -5.247 13.902 1.00 44.12 C ATOM 2055 CG1 ILE B 16 13.776 -5.179 14.605 1.00 1.22 C ATOM 2056 CG2 ILE B 16 15.044 -5.749 12.436 1.00 2.33 C ATOM 2057 CD1 ILE B 16 12.785 -4.225 13.972 1.00 63.42 C ATOM 0 H ILE B 16 17.709 -6.640 13.382 1.00 34.00 H new ATOM 0 HA ILE B 16 16.181 -5.750 15.753 1.00 22.03 H new ATOM 0 HB ILE B 16 15.567 -4.233 13.864 1.00 44.12 H new ATOM 0 HG12 ILE B 16 13.341 -6.178 14.613 1.00 1.22 H new ATOM 0 HG13 ILE B 16 13.925 -4.888 15.645 1.00 1.22 H new ATOM 0 HG21 ILE B 16 14.336 -5.121 11.895 1.00 2.33 H new ATOM 0 HG22 ILE B 16 16.018 -5.699 11.950 1.00 2.33 H new ATOM 0 HG23 ILE B 16 14.690 -6.780 12.433 1.00 2.33 H new ATOM 0 HD11 ILE B 16 11.849 -4.249 14.531 1.00 63.42 H new ATOM 0 HD12 ILE B 16 13.192 -3.214 13.988 1.00 63.42 H new ATOM 0 HD13 ILE B 16 12.599 -4.525 12.941 1.00 63.42 H new ATOM 2069 N GLU B 17 14.831 -7.940 15.664 1.00 4.21 N ATOM 2070 CA GLU B 17 14.332 -9.310 15.835 1.00 44.21 C ATOM 2071 C GLU B 17 13.660 -9.800 14.531 1.00 62.32 C ATOM 2072 O GLU B 17 12.869 -9.068 13.916 1.00 25.32 O ATOM 2073 CB GLU B 17 13.345 -9.396 17.032 1.00 54.54 C ATOM 2074 CG GLU B 17 13.937 -9.025 18.425 1.00 32.42 C ATOM 2075 CD GLU B 17 14.141 -7.508 18.665 1.00 2.43 C ATOM 2076 OE1 GLU B 17 15.255 -6.986 18.438 1.00 11.13 O ATOM 2077 OE2 GLU B 17 13.187 -6.827 19.091 1.00 41.12 O ATOM 0 H GLU B 17 14.394 -7.265 16.292 1.00 4.21 H new ATOM 0 HA GLU B 17 15.178 -9.961 16.054 1.00 44.21 H new ATOM 0 HB2 GLU B 17 12.500 -8.738 16.830 1.00 54.54 H new ATOM 0 HB3 GLU B 17 12.953 -10.412 17.083 1.00 54.54 H new ATOM 0 HG2 GLU B 17 13.277 -9.415 19.200 1.00 32.42 H new ATOM 0 HG3 GLU B 17 14.897 -9.529 18.541 1.00 32.42 H new ATOM 2084 N LYS B 18 14.007 -11.038 14.130 1.00 41.22 N ATOM 2085 CA LYS B 18 13.550 -11.663 12.874 1.00 50.43 C ATOM 2086 C LYS B 18 12.011 -11.795 12.830 1.00 43.13 C ATOM 2087 O LYS B 18 11.411 -11.722 11.756 1.00 34.35 O ATOM 2088 CB LYS B 18 14.216 -13.051 12.722 1.00 33.53 C ATOM 2089 CG LYS B 18 13.914 -13.780 11.386 1.00 5.45 C ATOM 2090 CD LYS B 18 14.399 -15.250 11.389 1.00 42.30 C ATOM 2091 CE LYS B 18 13.708 -16.090 12.486 1.00 12.24 C ATOM 2092 NZ LYS B 18 14.196 -17.491 12.509 1.00 22.34 N ATOM 0 H LYS B 18 14.621 -11.641 14.677 1.00 41.22 H new ATOM 0 HA LYS B 18 13.843 -11.022 12.043 1.00 50.43 H new ATOM 0 HB2 LYS B 18 15.295 -12.932 12.818 1.00 33.53 H new ATOM 0 HB3 LYS B 18 13.891 -13.686 13.546 1.00 33.53 H new ATOM 0 HG2 LYS B 18 12.841 -13.755 11.197 1.00 5.45 H new ATOM 0 HG3 LYS B 18 14.394 -13.244 10.567 1.00 5.45 H new ATOM 0 HD2 LYS B 18 14.204 -15.697 10.414 1.00 42.30 H new ATOM 0 HD3 LYS B 18 15.478 -15.275 11.541 1.00 42.30 H new ATOM 0 HE2 LYS B 18 13.884 -15.630 13.458 1.00 12.24 H new ATOM 0 HE3 LYS B 18 12.631 -16.085 12.321 1.00 12.24 H new ATOM 0 HZ1 LYS B 18 13.705 -18.017 13.260 1.00 22.34 H new ATOM 0 HZ2 LYS B 18 14.006 -17.940 11.590 1.00 22.34 H new ATOM 0 HZ3 LYS B 18 15.220 -17.499 12.693 1.00 22.34 H new ATOM 2106 N GLU B 19 11.400 -11.976 14.019 1.00 70.02 N ATOM 2107 CA GLU B 19 9.927 -12.029 14.196 1.00 4.44 C ATOM 2108 C GLU B 19 9.232 -10.752 13.662 1.00 30.11 C ATOM 2109 O GLU B 19 8.129 -10.808 13.108 1.00 71.14 O ATOM 2110 CB GLU B 19 9.585 -12.213 15.697 1.00 1.01 C ATOM 2111 CG GLU B 19 10.020 -13.552 16.319 1.00 64.20 C ATOM 2112 CD GLU B 19 9.676 -13.662 17.817 1.00 5.54 C ATOM 2113 OE1 GLU B 19 10.570 -13.987 18.634 1.00 41.24 O ATOM 2114 OE2 GLU B 19 8.512 -13.400 18.187 1.00 0.22 O ATOM 0 H GLU B 19 11.915 -12.091 14.892 1.00 70.02 H new ATOM 0 HA GLU B 19 9.558 -12.877 13.619 1.00 4.44 H new ATOM 0 HB2 GLU B 19 10.051 -11.404 16.259 1.00 1.01 H new ATOM 0 HB3 GLU B 19 8.507 -12.108 15.821 1.00 1.01 H new ATOM 0 HG2 GLU B 19 9.539 -14.369 15.781 1.00 64.20 H new ATOM 0 HG3 GLU B 19 11.095 -13.674 16.189 1.00 64.20 H new ATOM 2121 N ILE B 20 9.906 -9.614 13.842 1.00 4.22 N ATOM 2122 CA ILE B 20 9.410 -8.291 13.417 1.00 61.24 C ATOM 2123 C ILE B 20 9.641 -8.100 11.905 1.00 74.45 C ATOM 2124 O ILE B 20 8.829 -7.481 11.207 1.00 41.11 O ATOM 2125 CB ILE B 20 10.127 -7.163 14.237 1.00 62.14 C ATOM 2126 CG1 ILE B 20 10.062 -7.489 15.767 1.00 42.14 C ATOM 2127 CG2 ILE B 20 9.513 -5.775 13.931 1.00 63.45 C ATOM 2128 CD1 ILE B 20 10.900 -6.594 16.649 1.00 74.31 C ATOM 0 H ILE B 20 10.821 -9.578 14.291 1.00 4.22 H new ATOM 0 HA ILE B 20 8.339 -8.230 13.610 1.00 61.24 H new ATOM 0 HB ILE B 20 11.174 -7.127 13.937 1.00 62.14 H new ATOM 0 HG12 ILE B 20 9.024 -7.425 16.093 1.00 42.14 H new ATOM 0 HG13 ILE B 20 10.380 -8.521 15.917 1.00 42.14 H new ATOM 0 HG21 ILE B 20 10.030 -5.012 14.513 1.00 63.45 H new ATOM 0 HG22 ILE B 20 9.621 -5.556 12.869 1.00 63.45 H new ATOM 0 HG23 ILE B 20 8.455 -5.779 14.195 1.00 63.45 H new ATOM 0 HD11 ILE B 20 10.788 -6.900 17.689 1.00 74.31 H new ATOM 0 HD12 ILE B 20 11.947 -6.674 16.358 1.00 74.31 H new ATOM 0 HD13 ILE B 20 10.570 -5.561 16.537 1.00 74.31 H new ATOM 2140 N ALA B 21 10.763 -8.652 11.415 1.00 44.03 N ATOM 2141 CA ALA B 21 11.060 -8.729 9.969 1.00 12.21 C ATOM 2142 C ALA B 21 10.041 -9.632 9.232 1.00 73.13 C ATOM 2143 O ALA B 21 9.804 -9.458 8.034 1.00 2.14 O ATOM 2144 CB ALA B 21 12.493 -9.234 9.765 1.00 63.14 C ATOM 0 H ALA B 21 11.490 -9.057 12.005 1.00 44.03 H new ATOM 0 HA ALA B 21 10.972 -7.731 9.541 1.00 12.21 H new ATOM 0 HB1 ALA B 21 12.711 -9.290 8.698 1.00 63.14 H new ATOM 0 HB2 ALA B 21 13.192 -8.547 10.242 1.00 63.14 H new ATOM 0 HB3 ALA B 21 12.597 -10.224 10.209 1.00 63.14 H new ATOM 2150 N CYS B 22 9.459 -10.599 9.974 1.00 53.11 N ATOM 2151 CA CYS B 22 8.383 -11.473 9.477 1.00 20.13 C ATOM 2152 C CYS B 22 7.036 -10.718 9.395 1.00 44.24 C ATOM 2153 O CYS B 22 6.190 -11.052 8.561 1.00 54.44 O ATOM 2154 CB CYS B 22 8.256 -12.722 10.373 1.00 52.43 C ATOM 2155 SG CYS B 22 9.745 -13.742 10.420 1.00 50.31 S ATOM 0 H CYS B 22 9.726 -10.793 10.939 1.00 53.11 H new ATOM 0 HA CYS B 22 8.643 -11.790 8.467 1.00 20.13 H new ATOM 0 HB2 CYS B 22 8.011 -12.406 11.387 1.00 52.43 H new ATOM 0 HB3 CYS B 22 7.423 -13.329 10.018 1.00 52.43 H new ATOM 0 HG CYS B 22 10.745 -13.030 10.848 1.00 50.31 H new ATOM 2161 N MET B 23 6.844 -9.702 10.272 1.00 22.25 N ATOM 2162 CA MET B 23 5.655 -8.808 10.224 1.00 63.12 C ATOM 2163 C MET B 23 5.643 -8.008 8.912 1.00 5.11 C ATOM 2164 O MET B 23 4.578 -7.747 8.330 1.00 61.11 O ATOM 2165 CB MET B 23 5.634 -7.826 11.424 1.00 2.43 C ATOM 2166 CG MET B 23 5.556 -8.488 12.802 1.00 70.04 C ATOM 2167 SD MET B 23 5.532 -7.280 14.146 1.00 23.34 S ATOM 2168 CE MET B 23 4.044 -6.332 13.790 1.00 25.15 C ATOM 0 H MET B 23 7.497 -9.479 11.023 1.00 22.25 H new ATOM 0 HA MET B 23 4.768 -9.439 10.278 1.00 63.12 H new ATOM 0 HB2 MET B 23 6.532 -7.209 11.385 1.00 2.43 H new ATOM 0 HB3 MET B 23 4.782 -7.156 11.311 1.00 2.43 H new ATOM 0 HG2 MET B 23 4.659 -9.105 12.855 1.00 70.04 H new ATOM 0 HG3 MET B 23 6.409 -9.154 12.931 1.00 70.04 H new ATOM 0 HE1 MET B 23 3.648 -5.915 14.716 1.00 25.15 H new ATOM 0 HE2 MET B 23 4.285 -5.522 13.101 1.00 25.15 H new ATOM 0 HE3 MET B 23 3.297 -6.984 13.337 1.00 25.15 H new ATOM 2178 N SER B 24 6.846 -7.616 8.478 1.00 70.12 N ATOM 2179 CA SER B 24 7.068 -7.034 7.160 1.00 74.35 C ATOM 2180 C SER B 24 6.891 -8.136 6.105 1.00 10.03 C ATOM 2181 O SER B 24 7.643 -9.107 6.115 1.00 4.33 O ATOM 2182 CB SER B 24 8.481 -6.416 7.084 1.00 21.52 C ATOM 2183 OG SER B 24 8.714 -5.820 5.819 1.00 14.33 O ATOM 0 H SER B 24 7.694 -7.696 9.038 1.00 70.12 H new ATOM 0 HA SER B 24 6.348 -6.237 6.973 1.00 74.35 H new ATOM 0 HB2 SER B 24 8.596 -5.667 7.868 1.00 21.52 H new ATOM 0 HB3 SER B 24 9.228 -7.188 7.268 1.00 21.52 H new ATOM 0 HG SER B 24 9.394 -5.120 5.907 1.00 14.33 H new ATOM 2189 N VAL B 25 5.884 -7.981 5.224 1.00 71.13 N ATOM 2190 CA VAL B 25 5.507 -9.007 4.233 1.00 34.33 C ATOM 2191 C VAL B 25 6.672 -9.305 3.268 1.00 74.24 C ATOM 2192 O VAL B 25 7.065 -10.463 3.112 1.00 22.00 O ATOM 2193 CB VAL B 25 4.221 -8.580 3.428 1.00 22.12 C ATOM 2194 CG1 VAL B 25 3.877 -9.591 2.300 1.00 25.22 C ATOM 2195 CG2 VAL B 25 3.017 -8.382 4.386 1.00 34.23 C ATOM 0 H VAL B 25 5.309 -7.140 5.179 1.00 71.13 H new ATOM 0 HA VAL B 25 5.276 -9.920 4.782 1.00 34.33 H new ATOM 0 HB VAL B 25 4.439 -7.627 2.946 1.00 22.12 H new ATOM 0 HG11 VAL B 25 2.984 -9.257 1.772 1.00 25.22 H new ATOM 0 HG12 VAL B 25 4.711 -9.653 1.600 1.00 25.22 H new ATOM 0 HG13 VAL B 25 3.695 -10.574 2.735 1.00 25.22 H new ATOM 0 HG21 VAL B 25 2.139 -8.087 3.811 1.00 34.23 H new ATOM 0 HG22 VAL B 25 2.811 -9.316 4.910 1.00 34.23 H new ATOM 0 HG23 VAL B 25 3.253 -7.604 5.111 1.00 34.23 H new ATOM 2205 N THR B 26 7.225 -8.243 2.661 1.00 52.40 N ATOM 2206 CA THR B 26 8.305 -8.351 1.664 1.00 55.35 C ATOM 2207 C THR B 26 9.602 -8.931 2.268 1.00 10.45 C ATOM 2208 O THR B 26 10.217 -9.821 1.663 1.00 51.20 O ATOM 2209 CB THR B 26 8.580 -6.964 0.999 1.00 31.42 C ATOM 2210 OG1 THR B 26 7.373 -6.498 0.381 1.00 55.34 O ATOM 2211 CG2 THR B 26 9.705 -7.006 -0.060 1.00 1.14 C ATOM 0 H THR B 26 6.936 -7.283 2.847 1.00 52.40 H new ATOM 0 HA THR B 26 7.967 -9.049 0.898 1.00 55.35 H new ATOM 0 HB THR B 26 8.911 -6.290 1.789 1.00 31.42 H new ATOM 0 HG1 THR B 26 7.485 -5.563 0.109 1.00 55.34 H new ATOM 0 HG21 THR B 26 9.845 -6.011 -0.482 1.00 1.14 H new ATOM 0 HG22 THR B 26 10.633 -7.335 0.408 1.00 1.14 H new ATOM 0 HG23 THR B 26 9.432 -7.702 -0.853 1.00 1.14 H new ATOM 2219 N ILE B 27 9.996 -8.448 3.468 1.00 10.20 N ATOM 2220 CA ILE B 27 11.215 -8.936 4.148 1.00 42.53 C ATOM 2221 C ILE B 27 11.046 -10.421 4.526 1.00 61.34 C ATOM 2222 O ILE B 27 11.965 -11.217 4.317 1.00 15.53 O ATOM 2223 CB ILE B 27 11.599 -8.082 5.416 1.00 24.53 C ATOM 2224 CG1 ILE B 27 11.832 -6.585 5.026 1.00 4.50 C ATOM 2225 CG2 ILE B 27 12.856 -8.663 6.122 1.00 24.10 C ATOM 2226 CD1 ILE B 27 12.137 -5.659 6.195 1.00 53.34 C ATOM 0 H ILE B 27 9.491 -7.726 3.982 1.00 10.20 H new ATOM 0 HA ILE B 27 12.040 -8.827 3.444 1.00 42.53 H new ATOM 0 HB ILE B 27 10.765 -8.130 6.116 1.00 24.53 H new ATOM 0 HG12 ILE B 27 12.657 -6.534 4.316 1.00 4.50 H new ATOM 0 HG13 ILE B 27 10.945 -6.216 4.511 1.00 4.50 H new ATOM 0 HG21 ILE B 27 13.098 -8.054 6.993 1.00 24.10 H new ATOM 0 HG22 ILE B 27 12.655 -9.686 6.439 1.00 24.10 H new ATOM 0 HG23 ILE B 27 13.698 -8.656 5.430 1.00 24.10 H new ATOM 0 HD11 ILE B 27 12.283 -4.644 5.826 1.00 53.34 H new ATOM 0 HD12 ILE B 27 11.304 -5.674 6.898 1.00 53.34 H new ATOM 0 HD13 ILE B 27 13.043 -5.996 6.699 1.00 53.34 H new ATOM 2238 N LYS B 28 9.846 -10.770 5.030 1.00 14.41 N ATOM 2239 CA LYS B 28 9.457 -12.160 5.346 1.00 21.22 C ATOM 2240 C LYS B 28 9.607 -13.056 4.105 1.00 75.54 C ATOM 2241 O LYS B 28 10.173 -14.142 4.189 1.00 43.32 O ATOM 2242 CB LYS B 28 7.989 -12.209 5.838 1.00 63.41 C ATOM 2243 CG LYS B 28 7.464 -13.616 6.211 1.00 54.42 C ATOM 2244 CD LYS B 28 5.940 -13.642 6.488 1.00 72.12 C ATOM 2245 CE LYS B 28 5.102 -13.125 5.303 1.00 54.41 C ATOM 2246 NZ LYS B 28 5.361 -13.883 4.050 1.00 4.33 N ATOM 0 H LYS B 28 9.113 -10.090 5.231 1.00 14.41 H new ATOM 0 HA LYS B 28 10.115 -12.526 6.134 1.00 21.22 H new ATOM 0 HB2 LYS B 28 7.893 -11.561 6.709 1.00 63.41 H new ATOM 0 HB3 LYS B 28 7.348 -11.794 5.060 1.00 63.41 H new ATOM 0 HG2 LYS B 28 7.692 -14.309 5.401 1.00 54.42 H new ATOM 0 HG3 LYS B 28 7.994 -13.973 7.094 1.00 54.42 H new ATOM 0 HD2 LYS B 28 5.637 -14.662 6.722 1.00 72.12 H new ATOM 0 HD3 LYS B 28 5.726 -13.036 7.368 1.00 72.12 H new ATOM 0 HE2 LYS B 28 4.043 -13.194 5.553 1.00 54.41 H new ATOM 0 HE3 LYS B 28 5.323 -12.070 5.138 1.00 54.41 H new ATOM 0 HZ1 LYS B 28 5.750 -13.241 3.330 1.00 4.33 H new ATOM 0 HZ2 LYS B 28 6.044 -14.644 4.240 1.00 4.33 H new ATOM 0 HZ3 LYS B 28 4.471 -14.294 3.703 1.00 4.33 H new ATOM 2260 N ASN B 29 9.122 -12.546 2.952 1.00 31.33 N ATOM 2261 CA ASN B 29 9.171 -13.266 1.660 1.00 4.35 C ATOM 2262 C ASN B 29 10.623 -13.504 1.225 1.00 64.02 C ATOM 2263 O ASN B 29 10.921 -14.531 0.626 1.00 3.30 O ATOM 2264 CB ASN B 29 8.402 -12.495 0.541 1.00 22.35 C ATOM 2265 CG ASN B 29 6.886 -12.386 0.775 1.00 51.45 C ATOM 2266 OD1 ASN B 29 6.272 -13.225 1.437 1.00 33.30 O ATOM 2267 ND2 ASN B 29 6.268 -11.353 0.217 1.00 44.12 N ATOM 0 H ASN B 29 8.686 -11.626 2.890 1.00 31.33 H new ATOM 0 HA ASN B 29 8.681 -14.228 1.808 1.00 4.35 H new ATOM 0 HB2 ASN B 29 8.818 -11.491 0.456 1.00 22.35 H new ATOM 0 HB3 ASN B 29 8.576 -12.994 -0.413 1.00 22.35 H new ATOM 0 HD21 ASN B 29 5.261 -11.239 0.331 1.00 44.12 H new ATOM 0 HD22 ASN B 29 6.800 -10.673 -0.326 1.00 44.12 H new ATOM 2274 N MET B 30 11.514 -12.545 1.544 1.00 30.44 N ATOM 2275 CA MET B 30 12.955 -12.646 1.228 1.00 54.33 C ATOM 2276 C MET B 30 13.652 -13.677 2.145 1.00 32.44 C ATOM 2277 O MET B 30 14.566 -14.377 1.709 1.00 71.21 O ATOM 2278 CB MET B 30 13.643 -11.256 1.311 1.00 20.04 C ATOM 2279 CG MET B 30 13.119 -10.225 0.292 1.00 3.22 C ATOM 2280 SD MET B 30 14.124 -8.716 0.221 1.00 24.10 S ATOM 2281 CE MET B 30 13.895 -8.010 1.855 1.00 63.13 C ATOM 0 H MET B 30 11.259 -11.683 2.025 1.00 30.44 H new ATOM 0 HA MET B 30 13.051 -13.000 0.201 1.00 54.33 H new ATOM 0 HB2 MET B 30 13.508 -10.857 2.316 1.00 20.04 H new ATOM 0 HB3 MET B 30 14.715 -11.385 1.161 1.00 20.04 H new ATOM 0 HG2 MET B 30 13.092 -10.683 -0.697 1.00 3.22 H new ATOM 0 HG3 MET B 30 12.094 -9.959 0.548 1.00 3.22 H new ATOM 0 HE1 MET B 30 14.652 -7.245 2.030 1.00 63.13 H new ATOM 0 HE2 MET B 30 12.904 -7.562 1.922 1.00 63.13 H new ATOM 0 HE3 MET B 30 13.991 -8.794 2.607 1.00 63.13 H new ATOM 2291 N ILE B 31 13.191 -13.770 3.410 1.00 32.00 N ATOM 2292 CA ILE B 31 13.673 -14.784 4.381 1.00 51.54 C ATOM 2293 C ILE B 31 13.203 -16.194 3.933 1.00 75.43 C ATOM 2294 O ILE B 31 13.933 -17.173 4.051 1.00 61.12 O ATOM 2295 CB ILE B 31 13.164 -14.465 5.850 1.00 44.20 C ATOM 2296 CG1 ILE B 31 13.637 -13.041 6.306 1.00 52.23 C ATOM 2297 CG2 ILE B 31 13.618 -15.551 6.867 1.00 70.14 C ATOM 2298 CD1 ILE B 31 13.066 -12.571 7.639 1.00 71.41 C ATOM 0 H ILE B 31 12.477 -13.148 3.789 1.00 32.00 H new ATOM 0 HA ILE B 31 14.762 -14.756 4.401 1.00 51.54 H new ATOM 0 HB ILE B 31 12.074 -14.476 5.827 1.00 44.20 H new ATOM 0 HG12 ILE B 31 14.725 -13.040 6.373 1.00 52.23 H new ATOM 0 HG13 ILE B 31 13.364 -12.320 5.536 1.00 52.23 H new ATOM 0 HG21 ILE B 31 13.249 -15.296 7.861 1.00 70.14 H new ATOM 0 HG22 ILE B 31 13.216 -16.519 6.569 1.00 70.14 H new ATOM 0 HG23 ILE B 31 14.707 -15.600 6.885 1.00 70.14 H new ATOM 0 HD11 ILE B 31 13.450 -11.577 7.869 1.00 71.41 H new ATOM 0 HD12 ILE B 31 11.978 -12.534 7.576 1.00 71.41 H new ATOM 0 HD13 ILE B 31 13.361 -13.265 8.426 1.00 71.41 H new ATOM 2310 N GLU B 32 11.980 -16.265 3.384 1.00 31.03 N ATOM 2311 CA GLU B 32 11.386 -17.522 2.863 1.00 22.12 C ATOM 2312 C GLU B 32 11.993 -17.909 1.499 1.00 32.34 C ATOM 2313 O GLU B 32 12.007 -19.088 1.135 1.00 14.01 O ATOM 2314 CB GLU B 32 9.847 -17.366 2.738 1.00 54.33 C ATOM 2315 CG GLU B 32 9.123 -17.122 4.082 1.00 44.21 C ATOM 2316 CD GLU B 32 7.647 -16.743 3.910 1.00 31.43 C ATOM 2317 OE1 GLU B 32 6.751 -17.529 4.290 1.00 23.21 O ATOM 2318 OE2 GLU B 32 7.375 -15.653 3.379 1.00 32.11 O ATOM 0 H GLU B 32 11.368 -15.455 3.285 1.00 31.03 H new ATOM 0 HA GLU B 32 11.613 -18.322 3.568 1.00 22.12 H new ATOM 0 HB2 GLU B 32 9.631 -16.536 2.066 1.00 54.33 H new ATOM 0 HB3 GLU B 32 9.438 -18.265 2.276 1.00 54.33 H new ATOM 0 HG2 GLU B 32 9.192 -18.022 4.694 1.00 44.21 H new ATOM 0 HG3 GLU B 32 9.635 -16.327 4.625 1.00 44.21 H new ATOM 2325 N ASP B 33 12.480 -16.899 0.757 1.00 71.00 N ATOM 2326 CA ASP B 33 13.055 -17.075 -0.597 1.00 73.30 C ATOM 2327 C ASP B 33 14.492 -17.615 -0.522 1.00 13.13 C ATOM 2328 O ASP B 33 14.862 -18.552 -1.243 1.00 32.41 O ATOM 2329 CB ASP B 33 13.045 -15.708 -1.338 1.00 11.42 C ATOM 2330 CG ASP B 33 13.618 -15.768 -2.766 1.00 21.12 C ATOM 2331 OD1 ASP B 33 14.831 -15.503 -2.957 1.00 63.21 O ATOM 2332 OD2 ASP B 33 12.858 -16.070 -3.709 1.00 3.34 O ATOM 0 H ASP B 33 12.488 -15.931 1.078 1.00 71.00 H new ATOM 0 HA ASP B 33 12.450 -17.799 -1.142 1.00 73.30 H new ATOM 0 HB2 ASP B 33 12.021 -15.338 -1.383 1.00 11.42 H new ATOM 0 HB3 ASP B 33 13.619 -14.987 -0.757 1.00 11.42 H new ATOM 2337 N ILE B 34 15.288 -17.002 0.365 1.00 70.23 N ATOM 2338 CA ILE B 34 16.720 -17.308 0.518 1.00 31.12 C ATOM 2339 C ILE B 34 16.906 -18.461 1.520 1.00 3.43 C ATOM 2340 O ILE B 34 17.673 -19.400 1.271 1.00 2.33 O ATOM 2341 CB ILE B 34 17.515 -16.015 0.978 1.00 13.14 C ATOM 2342 CG1 ILE B 34 17.275 -14.837 -0.034 1.00 72.45 C ATOM 2343 CG2 ILE B 34 19.034 -16.305 1.135 1.00 43.43 C ATOM 2344 CD1 ILE B 34 17.878 -13.504 0.384 1.00 23.31 C ATOM 0 H ILE B 34 14.956 -16.276 1.000 1.00 70.23 H new ATOM 0 HA ILE B 34 17.123 -17.623 -0.445 1.00 31.12 H new ATOM 0 HB ILE B 34 17.135 -15.719 1.956 1.00 13.14 H new ATOM 0 HG12 ILE B 34 17.688 -15.119 -1.003 1.00 72.45 H new ATOM 0 HG13 ILE B 34 16.201 -14.707 -0.171 1.00 72.45 H new ATOM 0 HG21 ILE B 34 19.547 -15.397 1.451 1.00 43.43 H new ATOM 0 HG22 ILE B 34 19.180 -17.084 1.884 1.00 43.43 H new ATOM 0 HG23 ILE B 34 19.441 -16.638 0.180 1.00 43.43 H new ATOM 0 HD11 ILE B 34 17.661 -12.753 -0.375 1.00 23.31 H new ATOM 0 HD12 ILE B 34 17.448 -13.193 1.336 1.00 23.31 H new ATOM 0 HD13 ILE B 34 18.957 -13.611 0.491 1.00 23.31 H new ATOM 2356 N GLY B 35 16.130 -18.417 2.607 1.00 64.53 N ATOM 2357 CA GLY B 35 16.252 -19.371 3.713 1.00 12.11 C ATOM 2358 C GLY B 35 16.747 -18.678 4.969 1.00 44.23 C ATOM 2359 O GLY B 35 16.503 -17.478 5.154 1.00 52.35 O ATOM 0 H GLY B 35 15.399 -17.719 2.745 1.00 64.53 H new ATOM 0 HA2 GLY B 35 15.286 -19.837 3.906 1.00 12.11 H new ATOM 0 HA3 GLY B 35 16.941 -20.169 3.437 1.00 12.11 H new ATOM 2363 N GLU B 36 17.454 -19.428 5.831 1.00 62.33 N ATOM 2364 CA GLU B 36 18.020 -18.892 7.080 1.00 2.42 C ATOM 2365 C GLU B 36 19.343 -18.155 6.769 1.00 30.31 C ATOM 2366 O GLU B 36 20.443 -18.676 6.995 1.00 13.40 O ATOM 2367 CB GLU B 36 18.207 -20.039 8.119 1.00 12.42 C ATOM 2368 CG GLU B 36 16.919 -20.859 8.362 1.00 63.42 C ATOM 2369 CD GLU B 36 17.041 -21.894 9.488 1.00 74.43 C ATOM 2370 OE1 GLU B 36 16.728 -21.562 10.655 1.00 24.40 O ATOM 2371 OE2 GLU B 36 17.442 -23.045 9.217 1.00 45.32 O ATOM 0 H GLU B 36 17.648 -20.418 5.683 1.00 62.33 H new ATOM 0 HA GLU B 36 17.335 -18.170 7.524 1.00 2.42 H new ATOM 0 HB2 GLU B 36 18.996 -20.708 7.774 1.00 12.42 H new ATOM 0 HB3 GLU B 36 18.542 -19.613 9.065 1.00 12.42 H new ATOM 0 HG2 GLU B 36 16.104 -20.175 8.598 1.00 63.42 H new ATOM 0 HG3 GLU B 36 16.647 -21.372 7.439 1.00 63.42 H new ATOM 2378 N SER B 37 19.200 -16.954 6.174 1.00 15.54 N ATOM 2379 CA SER B 37 20.324 -16.120 5.748 1.00 30.22 C ATOM 2380 C SER B 37 20.967 -15.438 6.970 1.00 2.42 C ATOM 2381 O SER B 37 20.360 -14.557 7.598 1.00 40.31 O ATOM 2382 CB SER B 37 19.840 -15.074 4.710 1.00 43.31 C ATOM 2383 OG SER B 37 18.715 -14.351 5.189 1.00 53.34 O ATOM 0 H SER B 37 18.289 -16.539 5.977 1.00 15.54 H new ATOM 0 HA SER B 37 21.081 -16.745 5.274 1.00 30.22 H new ATOM 0 HB2 SER B 37 20.651 -14.381 4.484 1.00 43.31 H new ATOM 0 HB3 SER B 37 19.582 -15.577 3.778 1.00 43.31 H new ATOM 0 HG SER B 37 18.804 -14.210 6.155 1.00 53.34 H new ATOM 2389 N ASP B 38 22.186 -15.884 7.307 1.00 3.23 N ATOM 2390 CA ASP B 38 23.018 -15.251 8.347 1.00 70.32 C ATOM 2391 C ASP B 38 23.541 -13.909 7.819 1.00 41.20 C ATOM 2392 O ASP B 38 23.729 -12.960 8.588 1.00 24.11 O ATOM 2393 CB ASP B 38 24.204 -16.176 8.731 1.00 41.33 C ATOM 2394 CG ASP B 38 23.744 -17.543 9.266 1.00 44.02 C ATOM 2395 OD1 ASP B 38 23.608 -17.699 10.500 1.00 53.02 O ATOM 2396 OD2 ASP B 38 23.502 -18.464 8.455 1.00 24.10 O ATOM 0 H ASP B 38 22.625 -16.693 6.868 1.00 3.23 H new ATOM 0 HA ASP B 38 22.416 -15.084 9.240 1.00 70.32 H new ATOM 0 HB2 ASP B 38 24.838 -16.327 7.858 1.00 41.33 H new ATOM 0 HB3 ASP B 38 24.815 -15.682 9.487 1.00 41.33 H new ATOM 2401 N SER B 39 23.733 -13.858 6.484 1.00 12.13 N ATOM 2402 CA SER B 39 24.125 -12.646 5.758 1.00 33.25 C ATOM 2403 C SER B 39 23.063 -11.540 5.935 1.00 74.11 C ATOM 2404 O SER B 39 21.857 -11.827 5.858 1.00 41.42 O ATOM 2405 CB SER B 39 24.313 -12.970 4.257 1.00 54.13 C ATOM 2406 OG SER B 39 25.267 -14.008 4.085 1.00 43.24 O ATOM 0 H SER B 39 23.617 -14.671 5.879 1.00 12.13 H new ATOM 0 HA SER B 39 25.069 -12.284 6.166 1.00 33.25 H new ATOM 0 HB2 SER B 39 23.359 -13.269 3.822 1.00 54.13 H new ATOM 0 HB3 SER B 39 24.640 -12.077 3.725 1.00 54.13 H new ATOM 0 HG SER B 39 25.372 -14.201 3.130 1.00 43.24 H new ATOM 2412 N PRO B 40 23.498 -10.270 6.194 1.00 21.33 N ATOM 2413 CA PRO B 40 22.575 -9.124 6.368 1.00 2.01 C ATOM 2414 C PRO B 40 21.855 -8.769 5.045 1.00 74.21 C ATOM 2415 O PRO B 40 22.440 -8.901 3.962 1.00 3.15 O ATOM 2416 CB PRO B 40 23.523 -7.996 6.842 1.00 54.11 C ATOM 2417 CG PRO B 40 24.861 -8.347 6.280 1.00 52.12 C ATOM 2418 CD PRO B 40 24.924 -9.849 6.321 1.00 63.24 C ATOM 0 HA PRO B 40 21.764 -9.319 7.070 1.00 2.01 H new ATOM 0 HB2 PRO B 40 23.188 -7.023 6.483 1.00 54.11 H new ATOM 0 HB3 PRO B 40 23.555 -7.940 7.930 1.00 54.11 H new ATOM 0 HG2 PRO B 40 24.970 -7.976 5.261 1.00 52.12 H new ATOM 0 HG3 PRO B 40 25.664 -7.903 6.868 1.00 52.12 H new ATOM 0 HD2 PRO B 40 25.532 -10.246 5.508 1.00 63.24 H new ATOM 0 HD3 PRO B 40 25.365 -10.205 7.252 1.00 63.24 H new ATOM 2426 N ILE B 41 20.577 -8.360 5.134 1.00 55.53 N ATOM 2427 CA ILE B 41 19.743 -8.069 3.953 1.00 3.05 C ATOM 2428 C ILE B 41 19.598 -6.537 3.784 1.00 51.21 C ATOM 2429 O ILE B 41 18.827 -5.901 4.517 1.00 71.24 O ATOM 2430 CB ILE B 41 18.325 -8.763 4.061 1.00 52.43 C ATOM 2431 CG1 ILE B 41 18.467 -10.310 4.309 1.00 4.14 C ATOM 2432 CG2 ILE B 41 17.463 -8.483 2.800 1.00 72.04 C ATOM 2433 CD1 ILE B 41 19.197 -11.083 3.208 1.00 1.41 C ATOM 0 H ILE B 41 20.094 -8.222 6.022 1.00 55.53 H new ATOM 0 HA ILE B 41 20.235 -8.479 3.071 1.00 3.05 H new ATOM 0 HB ILE B 41 17.812 -8.330 4.920 1.00 52.43 H new ATOM 0 HG12 ILE B 41 18.995 -10.464 5.250 1.00 4.14 H new ATOM 0 HG13 ILE B 41 17.471 -10.735 4.430 1.00 4.14 H new ATOM 0 HG21 ILE B 41 16.495 -8.973 2.905 1.00 72.04 H new ATOM 0 HG22 ILE B 41 17.316 -7.408 2.691 1.00 72.04 H new ATOM 0 HG23 ILE B 41 17.972 -8.871 1.918 1.00 72.04 H new ATOM 0 HD11 ILE B 41 19.242 -12.139 3.474 1.00 1.41 H new ATOM 0 HD12 ILE B 41 18.661 -10.968 2.266 1.00 1.41 H new ATOM 0 HD13 ILE B 41 20.209 -10.693 3.099 1.00 1.41 H new ATOM 2445 N PRO B 42 20.364 -5.908 2.833 1.00 4.23 N ATOM 2446 CA PRO B 42 20.274 -4.461 2.581 1.00 24.24 C ATOM 2447 C PRO B 42 19.065 -4.101 1.684 1.00 14.40 C ATOM 2448 O PRO B 42 18.759 -4.800 0.706 1.00 53.24 O ATOM 2449 CB PRO B 42 21.618 -4.148 1.888 1.00 64.45 C ATOM 2450 CG PRO B 42 21.956 -5.399 1.133 1.00 41.04 C ATOM 2451 CD PRO B 42 21.382 -6.551 1.943 1.00 3.35 C ATOM 0 HA PRO B 42 20.115 -3.880 3.489 1.00 24.24 H new ATOM 0 HB2 PRO B 42 21.529 -3.293 1.218 1.00 64.45 H new ATOM 0 HB3 PRO B 42 22.392 -3.903 2.616 1.00 64.45 H new ATOM 0 HG2 PRO B 42 21.528 -5.377 0.131 1.00 41.04 H new ATOM 0 HG3 PRO B 42 23.035 -5.504 1.017 1.00 41.04 H new ATOM 0 HD2 PRO B 42 20.928 -7.303 1.298 1.00 3.35 H new ATOM 0 HD3 PRO B 42 22.156 -7.054 2.523 1.00 3.35 H new ATOM 2459 N LEU B 43 18.363 -3.028 2.066 1.00 74.03 N ATOM 2460 CA LEU B 43 17.286 -2.416 1.279 1.00 50.30 C ATOM 2461 C LEU B 43 17.837 -1.111 0.631 1.00 74.11 C ATOM 2462 O LEU B 43 17.851 -0.055 1.278 1.00 65.44 O ATOM 2463 CB LEU B 43 16.070 -2.126 2.209 1.00 71.43 C ATOM 2464 CG LEU B 43 15.538 -3.342 3.039 1.00 73.43 C ATOM 2465 CD1 LEU B 43 14.387 -2.923 3.976 1.00 32.03 C ATOM 2466 CD2 LEU B 43 15.122 -4.514 2.125 1.00 50.12 C ATOM 0 H LEU B 43 18.532 -2.550 2.951 1.00 74.03 H new ATOM 0 HA LEU B 43 16.947 -3.085 0.488 1.00 50.30 H new ATOM 0 HB2 LEU B 43 16.349 -1.332 2.902 1.00 71.43 H new ATOM 0 HB3 LEU B 43 15.253 -1.743 1.598 1.00 71.43 H new ATOM 0 HG LEU B 43 16.359 -3.693 3.664 1.00 73.43 H new ATOM 0 HD11 LEU B 43 14.041 -3.791 4.538 1.00 32.03 H new ATOM 0 HD12 LEU B 43 14.741 -2.160 4.669 1.00 32.03 H new ATOM 0 HD13 LEU B 43 13.564 -2.522 3.385 1.00 32.03 H new ATOM 0 HD21 LEU B 43 14.758 -5.340 2.736 1.00 50.12 H new ATOM 0 HD22 LEU B 43 14.332 -4.186 1.450 1.00 50.12 H new ATOM 0 HD23 LEU B 43 15.982 -4.845 1.543 1.00 50.12 H new ATOM 2478 N PRO B 44 18.337 -1.173 -0.653 1.00 30.31 N ATOM 2479 CA PRO B 44 19.056 -0.041 -1.313 1.00 55.45 C ATOM 2480 C PRO B 44 18.116 1.037 -1.933 1.00 1.05 C ATOM 2481 O PRO B 44 18.393 1.566 -3.014 1.00 13.43 O ATOM 2482 CB PRO B 44 19.876 -0.794 -2.393 1.00 30.34 C ATOM 2483 CG PRO B 44 18.972 -1.908 -2.824 1.00 62.41 C ATOM 2484 CD PRO B 44 18.253 -2.358 -1.564 1.00 55.45 C ATOM 0 HA PRO B 44 19.650 0.549 -0.615 1.00 55.45 H new ATOM 0 HB2 PRO B 44 20.131 -0.141 -3.228 1.00 30.34 H new ATOM 0 HB3 PRO B 44 20.814 -1.175 -1.989 1.00 30.34 H new ATOM 0 HG2 PRO B 44 18.264 -1.569 -3.580 1.00 62.41 H new ATOM 0 HG3 PRO B 44 19.541 -2.727 -3.265 1.00 62.41 H new ATOM 0 HD2 PRO B 44 17.218 -2.629 -1.771 1.00 55.45 H new ATOM 0 HD3 PRO B 44 18.730 -3.234 -1.124 1.00 55.45 H new ATOM 2492 N ASN B 45 17.042 1.402 -1.201 1.00 42.34 N ATOM 2493 CA ASN B 45 16.072 2.441 -1.636 1.00 33.11 C ATOM 2494 C ASN B 45 15.611 3.271 -0.419 1.00 50.35 C ATOM 2495 O ASN B 45 15.758 4.498 -0.399 1.00 42.30 O ATOM 2496 CB ASN B 45 14.839 1.801 -2.335 1.00 51.12 C ATOM 2497 CG ASN B 45 13.825 2.832 -2.862 1.00 21.42 C ATOM 2498 OD1 ASN B 45 14.193 3.921 -3.302 1.00 32.53 O ATOM 2499 ND2 ASN B 45 12.547 2.488 -2.833 1.00 75.33 N ATOM 0 H ASN B 45 16.820 0.989 -0.295 1.00 42.34 H new ATOM 0 HA ASN B 45 16.571 3.092 -2.354 1.00 33.11 H new ATOM 0 HB2 ASN B 45 15.182 1.184 -3.166 1.00 51.12 H new ATOM 0 HB3 ASN B 45 14.337 1.137 -1.631 1.00 51.12 H new ATOM 0 HD21 ASN B 45 11.837 3.133 -3.181 1.00 75.33 H new ATOM 0 HD22 ASN B 45 12.272 1.578 -2.462 1.00 75.33 H new ATOM 2506 N VAL B 46 15.060 2.577 0.593 1.00 5.02 N ATOM 2507 CA VAL B 46 14.534 3.221 1.813 1.00 73.14 C ATOM 2508 C VAL B 46 15.704 3.726 2.694 1.00 24.15 C ATOM 2509 O VAL B 46 16.624 2.970 3.008 1.00 21.15 O ATOM 2510 CB VAL B 46 13.579 2.247 2.619 1.00 42.54 C ATOM 2511 CG1 VAL B 46 14.278 0.924 3.009 1.00 15.04 C ATOM 2512 CG2 VAL B 46 12.971 2.949 3.860 1.00 23.35 C ATOM 0 H VAL B 46 14.967 1.561 0.590 1.00 5.02 H new ATOM 0 HA VAL B 46 13.932 4.079 1.516 1.00 73.14 H new ATOM 0 HB VAL B 46 12.761 1.985 1.947 1.00 42.54 H new ATOM 0 HG11 VAL B 46 13.581 0.292 3.559 1.00 15.04 H new ATOM 0 HG12 VAL B 46 14.604 0.405 2.107 1.00 15.04 H new ATOM 0 HG13 VAL B 46 15.143 1.141 3.636 1.00 15.04 H new ATOM 0 HG21 VAL B 46 12.321 2.253 4.390 1.00 23.35 H new ATOM 0 HG22 VAL B 46 13.773 3.274 4.523 1.00 23.35 H new ATOM 0 HG23 VAL B 46 12.391 3.815 3.541 1.00 23.35 H new ATOM 2522 N THR B 47 15.660 5.020 3.064 1.00 13.42 N ATOM 2523 CA THR B 47 16.723 5.689 3.837 1.00 60.40 C ATOM 2524 C THR B 47 16.696 5.257 5.313 1.00 3.31 C ATOM 2525 O THR B 47 15.749 4.599 5.759 1.00 13.13 O ATOM 2526 CB THR B 47 16.576 7.238 3.726 1.00 0.54 C ATOM 2527 OG1 THR B 47 15.246 7.621 4.113 1.00 23.25 O ATOM 2528 CG2 THR B 47 16.853 7.733 2.295 1.00 54.43 C ATOM 0 H THR B 47 14.880 5.635 2.833 1.00 13.42 H new ATOM 0 HA THR B 47 17.683 5.391 3.417 1.00 60.40 H new ATOM 0 HB THR B 47 17.310 7.694 4.390 1.00 0.54 H new ATOM 0 HG1 THR B 47 15.153 8.594 4.045 1.00 23.25 H new ATOM 0 HG21 THR B 47 16.741 8.817 2.257 1.00 54.43 H new ATOM 0 HG22 THR B 47 17.869 7.463 2.007 1.00 54.43 H new ATOM 0 HG23 THR B 47 16.145 7.271 1.607 1.00 54.43 H new ATOM 2536 N SER B 48 17.745 5.642 6.054 1.00 22.11 N ATOM 2537 CA SER B 48 17.950 5.237 7.453 1.00 42.33 C ATOM 2538 C SER B 48 16.843 5.749 8.370 1.00 55.51 C ATOM 2539 O SER B 48 16.293 4.983 9.162 1.00 23.40 O ATOM 2540 CB SER B 48 19.308 5.751 7.933 1.00 4.22 C ATOM 2541 OG SER B 48 19.429 7.139 7.684 1.00 4.15 O ATOM 0 H SER B 48 18.482 6.249 5.696 1.00 22.11 H new ATOM 0 HA SER B 48 17.923 4.148 7.495 1.00 42.33 H new ATOM 0 HB2 SER B 48 19.421 5.556 8.999 1.00 4.22 H new ATOM 0 HB3 SER B 48 20.108 5.213 7.424 1.00 4.22 H new ATOM 0 HG SER B 48 20.368 7.360 7.511 1.00 4.15 H new ATOM 2547 N THR B 49 16.527 7.043 8.233 1.00 10.41 N ATOM 2548 CA THR B 49 15.516 7.723 9.046 1.00 12.21 C ATOM 2549 C THR B 49 14.147 7.025 8.929 1.00 33.22 C ATOM 2550 O THR B 49 13.499 6.738 9.934 1.00 62.23 O ATOM 2551 CB THR B 49 15.394 9.220 8.610 1.00 32.31 C ATOM 2552 OG1 THR B 49 15.074 9.283 7.210 1.00 72.40 O ATOM 2553 CG2 THR B 49 16.700 10.001 8.860 1.00 61.04 C ATOM 0 H THR B 49 16.972 7.652 7.546 1.00 10.41 H new ATOM 0 HA THR B 49 15.832 7.677 10.088 1.00 12.21 H new ATOM 0 HB THR B 49 14.606 9.677 9.208 1.00 32.31 H new ATOM 0 HG1 THR B 49 14.995 10.220 6.934 1.00 72.40 H new ATOM 0 HG21 THR B 49 16.571 11.036 8.543 1.00 61.04 H new ATOM 0 HG22 THR B 49 16.942 9.974 9.922 1.00 61.04 H new ATOM 0 HG23 THR B 49 17.511 9.546 8.291 1.00 61.04 H new ATOM 2561 N ILE B 50 13.771 6.694 7.687 1.00 4.10 N ATOM 2562 CA ILE B 50 12.458 6.122 7.369 1.00 23.33 C ATOM 2563 C ILE B 50 12.391 4.645 7.786 1.00 73.24 C ATOM 2564 O ILE B 50 11.430 4.231 8.439 1.00 62.31 O ATOM 2565 CB ILE B 50 12.144 6.292 5.840 1.00 72.41 C ATOM 2566 CG1 ILE B 50 12.249 7.796 5.435 1.00 22.10 C ATOM 2567 CG2 ILE B 50 10.759 5.709 5.464 1.00 13.24 C ATOM 2568 CD1 ILE B 50 11.348 8.741 6.226 1.00 45.34 C ATOM 0 H ILE B 50 14.372 6.816 6.872 1.00 4.10 H new ATOM 0 HA ILE B 50 11.699 6.662 7.935 1.00 23.33 H new ATOM 0 HB ILE B 50 12.887 5.724 5.281 1.00 72.41 H new ATOM 0 HG12 ILE B 50 13.283 8.118 5.556 1.00 22.10 H new ATOM 0 HG13 ILE B 50 12.008 7.889 4.376 1.00 22.10 H new ATOM 0 HG21 ILE B 50 10.583 5.848 4.397 1.00 13.24 H new ATOM 0 HG22 ILE B 50 10.736 4.645 5.700 1.00 13.24 H new ATOM 0 HG23 ILE B 50 9.982 6.223 6.030 1.00 13.24 H new ATOM 0 HD11 ILE B 50 11.492 9.762 5.872 1.00 45.34 H new ATOM 0 HD12 ILE B 50 10.306 8.452 6.087 1.00 45.34 H new ATOM 0 HD13 ILE B 50 11.602 8.684 7.285 1.00 45.34 H new ATOM 2580 N LEU B 51 13.444 3.876 7.436 1.00 32.31 N ATOM 2581 CA LEU B 51 13.522 2.433 7.736 1.00 62.31 C ATOM 2582 C LEU B 51 13.539 2.192 9.258 1.00 54.11 C ATOM 2583 O LEU B 51 12.924 1.238 9.738 1.00 30.43 O ATOM 2584 CB LEU B 51 14.766 1.776 7.062 1.00 12.32 C ATOM 2585 CG LEU B 51 14.880 0.216 7.207 1.00 54.20 C ATOM 2586 CD1 LEU B 51 13.617 -0.497 6.661 1.00 4.12 C ATOM 2587 CD2 LEU B 51 16.167 -0.326 6.535 1.00 50.23 C ATOM 0 H LEU B 51 14.259 4.237 6.940 1.00 32.31 H new ATOM 0 HA LEU B 51 12.631 1.961 7.321 1.00 62.31 H new ATOM 0 HB2 LEU B 51 14.753 2.023 6.000 1.00 12.32 H new ATOM 0 HB3 LEU B 51 15.664 2.227 7.483 1.00 12.32 H new ATOM 0 HG LEU B 51 14.949 -0.006 8.272 1.00 54.20 H new ATOM 0 HD11 LEU B 51 13.729 -1.575 6.777 1.00 4.12 H new ATOM 0 HD12 LEU B 51 12.741 -0.162 7.216 1.00 4.12 H new ATOM 0 HD13 LEU B 51 13.491 -0.257 5.605 1.00 4.12 H new ATOM 0 HD21 LEU B 51 16.212 -1.408 6.655 1.00 50.23 H new ATOM 0 HD22 LEU B 51 16.155 -0.079 5.473 1.00 50.23 H new ATOM 0 HD23 LEU B 51 17.041 0.128 7.003 1.00 50.23 H new ATOM 2599 N GLU B 52 14.221 3.093 10.004 1.00 54.50 N ATOM 2600 CA GLU B 52 14.275 3.050 11.482 1.00 12.24 C ATOM 2601 C GLU B 52 12.856 3.137 12.058 1.00 32.23 C ATOM 2602 O GLU B 52 12.458 2.310 12.871 1.00 5.45 O ATOM 2603 CB GLU B 52 15.125 4.220 12.058 1.00 51.15 C ATOM 2604 CG GLU B 52 15.315 4.170 13.592 1.00 21.32 C ATOM 2605 CD GLU B 52 16.003 5.424 14.159 1.00 55.12 C ATOM 2606 OE1 GLU B 52 17.249 5.506 14.119 1.00 60.34 O ATOM 2607 OE2 GLU B 52 15.292 6.339 14.636 1.00 23.11 O ATOM 0 H GLU B 52 14.747 3.867 9.598 1.00 54.50 H new ATOM 0 HA GLU B 52 14.743 2.108 11.767 1.00 12.24 H new ATOM 0 HB2 GLU B 52 16.105 4.211 11.581 1.00 51.15 H new ATOM 0 HB3 GLU B 52 14.650 5.164 11.793 1.00 51.15 H new ATOM 0 HG2 GLU B 52 14.342 4.051 14.068 1.00 21.32 H new ATOM 0 HG3 GLU B 52 15.906 3.291 13.850 1.00 21.32 H new ATOM 2614 N LYS B 53 12.106 4.137 11.567 1.00 54.54 N ATOM 2615 CA LYS B 53 10.746 4.445 12.034 1.00 24.22 C ATOM 2616 C LYS B 53 9.763 3.307 11.730 1.00 62.53 C ATOM 2617 O LYS B 53 8.969 2.922 12.594 1.00 32.25 O ATOM 2618 CB LYS B 53 10.232 5.747 11.381 1.00 4.22 C ATOM 2619 CG LYS B 53 10.991 7.021 11.787 1.00 44.33 C ATOM 2620 CD LYS B 53 10.311 8.298 11.248 1.00 14.03 C ATOM 2621 CE LYS B 53 8.914 8.496 11.849 1.00 12.03 C ATOM 2622 NZ LYS B 53 8.959 8.558 13.330 1.00 12.21 N ATOM 0 H LYS B 53 12.431 4.760 10.827 1.00 54.54 H new ATOM 0 HA LYS B 53 10.802 4.570 13.115 1.00 24.22 H new ATOM 0 HB2 LYS B 53 10.287 5.639 10.298 1.00 4.22 H new ATOM 0 HB3 LYS B 53 9.180 5.872 11.635 1.00 4.22 H new ATOM 0 HG2 LYS B 53 11.053 7.075 12.874 1.00 44.33 H new ATOM 0 HG3 LYS B 53 12.013 6.969 11.412 1.00 44.33 H new ATOM 0 HD2 LYS B 53 10.931 9.164 11.477 1.00 14.03 H new ATOM 0 HD3 LYS B 53 10.235 8.239 10.162 1.00 14.03 H new ATOM 0 HE2 LYS B 53 8.477 9.415 11.459 1.00 12.03 H new ATOM 0 HE3 LYS B 53 8.265 7.678 11.538 1.00 12.03 H new ATOM 0 HZ1 LYS B 53 8.048 8.908 13.691 1.00 12.21 H new ATOM 0 HZ2 LYS B 53 9.140 7.608 13.712 1.00 12.21 H new ATOM 0 HZ3 LYS B 53 9.720 9.202 13.628 1.00 12.21 H new ATOM 2636 N VAL B 54 9.820 2.802 10.488 1.00 44.25 N ATOM 2637 CA VAL B 54 8.939 1.728 10.004 1.00 4.54 C ATOM 2638 C VAL B 54 9.150 0.451 10.847 1.00 43.00 C ATOM 2639 O VAL B 54 8.185 -0.166 11.311 1.00 12.23 O ATOM 2640 CB VAL B 54 9.176 1.462 8.462 1.00 1.43 C ATOM 2641 CG1 VAL B 54 8.423 0.211 7.960 1.00 62.40 C ATOM 2642 CG2 VAL B 54 8.769 2.703 7.621 1.00 12.33 C ATOM 0 H VAL B 54 10.484 3.130 9.786 1.00 44.25 H new ATOM 0 HA VAL B 54 7.901 2.038 10.121 1.00 4.54 H new ATOM 0 HB VAL B 54 10.242 1.276 8.334 1.00 1.43 H new ATOM 0 HG11 VAL B 54 8.618 0.071 6.897 1.00 62.40 H new ATOM 0 HG12 VAL B 54 8.766 -0.665 8.510 1.00 62.40 H new ATOM 0 HG13 VAL B 54 7.353 0.343 8.119 1.00 62.40 H new ATOM 0 HG21 VAL B 54 8.940 2.498 6.564 1.00 12.33 H new ATOM 0 HG22 VAL B 54 7.713 2.921 7.782 1.00 12.33 H new ATOM 0 HG23 VAL B 54 9.368 3.561 7.926 1.00 12.33 H new ATOM 2652 N LEU B 55 10.429 0.115 11.089 1.00 43.23 N ATOM 2653 CA LEU B 55 10.821 -1.045 11.917 1.00 52.21 C ATOM 2654 C LEU B 55 10.486 -0.816 13.410 1.00 23.43 C ATOM 2655 O LEU B 55 10.182 -1.770 14.126 1.00 14.22 O ATOM 2656 CB LEU B 55 12.337 -1.351 11.740 1.00 10.51 C ATOM 2657 CG LEU B 55 12.783 -1.885 10.337 1.00 12.41 C ATOM 2658 CD1 LEU B 55 14.310 -2.144 10.300 1.00 73.40 C ATOM 2659 CD2 LEU B 55 11.985 -3.147 9.921 1.00 73.43 C ATOM 0 H LEU B 55 11.222 0.638 10.717 1.00 43.23 H new ATOM 0 HA LEU B 55 10.246 -1.906 11.577 1.00 52.21 H new ATOM 0 HB2 LEU B 55 12.896 -0.439 11.952 1.00 10.51 H new ATOM 0 HB3 LEU B 55 12.627 -2.085 12.492 1.00 10.51 H new ATOM 0 HG LEU B 55 12.558 -1.109 9.606 1.00 12.41 H new ATOM 0 HD11 LEU B 55 14.592 -2.514 9.314 1.00 73.40 H new ATOM 0 HD12 LEU B 55 14.842 -1.215 10.505 1.00 73.40 H new ATOM 0 HD13 LEU B 55 14.572 -2.886 11.055 1.00 73.40 H new ATOM 0 HD21 LEU B 55 12.324 -3.486 8.942 1.00 73.43 H new ATOM 0 HD22 LEU B 55 12.146 -3.937 10.654 1.00 73.43 H new ATOM 0 HD23 LEU B 55 10.923 -2.907 9.873 1.00 73.43 H new ATOM 2671 N ASP B 56 10.551 0.459 13.858 1.00 75.04 N ATOM 2672 CA ASP B 56 10.316 0.843 15.273 1.00 32.45 C ATOM 2673 C ASP B 56 8.816 0.810 15.622 1.00 42.24 C ATOM 2674 O ASP B 56 8.442 0.512 16.761 1.00 51.14 O ATOM 2675 CB ASP B 56 10.931 2.235 15.594 1.00 32.34 C ATOM 2676 CG ASP B 56 10.993 2.532 17.106 1.00 60.42 C ATOM 2677 OD1 ASP B 56 11.892 1.991 17.784 1.00 50.33 O ATOM 2678 OD2 ASP B 56 10.152 3.295 17.623 1.00 23.42 O ATOM 0 H ASP B 56 10.767 1.250 13.252 1.00 75.04 H new ATOM 0 HA ASP B 56 10.820 0.105 15.897 1.00 32.45 H new ATOM 0 HB2 ASP B 56 11.937 2.286 15.178 1.00 32.34 H new ATOM 0 HB3 ASP B 56 10.342 3.009 15.101 1.00 32.34 H new ATOM 2683 N TYR B 57 7.959 1.129 14.635 1.00 53.11 N ATOM 2684 CA TYR B 57 6.498 1.041 14.798 1.00 52.21 C ATOM 2685 C TYR B 57 6.055 -0.427 14.752 1.00 65.04 C ATOM 2686 O TYR B 57 5.152 -0.835 15.492 1.00 52.55 O ATOM 2687 CB TYR B 57 5.746 1.863 13.722 1.00 1.50 C ATOM 2688 CG TYR B 57 4.204 1.785 13.854 1.00 53.45 C ATOM 2689 CD1 TYR B 57 3.447 0.832 13.145 1.00 12.43 C ATOM 2690 CD2 TYR B 57 3.519 2.616 14.738 1.00 54.33 C ATOM 2691 CE1 TYR B 57 2.085 0.721 13.319 1.00 14.32 C ATOM 2692 CE2 TYR B 57 2.152 2.516 14.901 1.00 53.14 C ATOM 2693 CZ TYR B 57 1.441 1.564 14.197 1.00 71.33 C ATOM 2694 OH TYR B 57 0.087 1.434 14.395 1.00 34.54 O ATOM 0 H TYR B 57 8.255 1.451 13.714 1.00 53.11 H new ATOM 0 HA TYR B 57 6.245 1.467 15.769 1.00 52.21 H new ATOM 0 HB2 TYR B 57 6.057 2.906 13.789 1.00 1.50 H new ATOM 0 HB3 TYR B 57 6.037 1.507 12.734 1.00 1.50 H new ATOM 0 HD1 TYR B 57 3.946 0.173 12.449 1.00 12.43 H new ATOM 0 HD2 TYR B 57 4.068 3.352 15.306 1.00 54.33 H new ATOM 0 HE1 TYR B 57 1.526 -0.022 12.770 1.00 14.32 H new ATOM 0 HE2 TYR B 57 1.639 3.182 15.579 1.00 53.14 H new ATOM 0 HH TYR B 57 -0.163 1.866 15.238 1.00 34.54 H new ATOM 2704 N CYS B 58 6.679 -1.202 13.849 1.00 21.25 N ATOM 2705 CA CYS B 58 6.422 -2.643 13.721 1.00 25.22 C ATOM 2706 C CYS B 58 6.862 -3.387 14.999 1.00 30.31 C ATOM 2707 O CYS B 58 6.188 -4.319 15.435 1.00 73.31 O ATOM 2708 CB CYS B 58 7.132 -3.214 12.475 1.00 20.31 C ATOM 2709 SG CYS B 58 6.513 -2.545 10.919 1.00 31.41 S ATOM 0 H CYS B 58 7.373 -0.847 13.191 1.00 21.25 H new ATOM 0 HA CYS B 58 5.350 -2.793 13.595 1.00 25.22 H new ATOM 0 HB2 CYS B 58 8.200 -3.008 12.550 1.00 20.31 H new ATOM 0 HB3 CYS B 58 7.016 -4.298 12.466 1.00 20.31 H new ATOM 0 HG CYS B 58 7.149 -1.447 10.635 1.00 31.41 H new ATOM 2715 N ARG B 59 7.989 -2.942 15.603 1.00 4.14 N ATOM 2716 CA ARG B 59 8.517 -3.535 16.855 1.00 32.44 C ATOM 2717 C ARG B 59 7.630 -3.139 18.048 1.00 61.11 C ATOM 2718 O ARG B 59 7.429 -3.935 18.958 1.00 13.31 O ATOM 2719 CB ARG B 59 10.025 -3.171 17.074 1.00 14.45 C ATOM 2720 CG ARG B 59 10.347 -1.883 17.861 1.00 11.02 C ATOM 2721 CD ARG B 59 11.865 -1.590 17.903 1.00 70.05 C ATOM 2722 NE ARG B 59 12.659 -2.767 18.315 1.00 12.13 N ATOM 2723 CZ ARG B 59 13.958 -2.973 18.033 1.00 51.52 C ATOM 2724 NH1 ARG B 59 14.668 -2.067 17.343 1.00 42.31 N ATOM 2725 NH2 ARG B 59 14.537 -4.104 18.416 1.00 34.24 N ATOM 0 H ARG B 59 8.552 -2.172 15.242 1.00 4.14 H new ATOM 0 HA ARG B 59 8.481 -4.621 16.769 1.00 32.44 H new ATOM 0 HB2 ARG B 59 10.500 -4.006 17.589 1.00 14.45 H new ATOM 0 HB3 ARG B 59 10.496 -3.092 16.094 1.00 14.45 H new ATOM 0 HG2 ARG B 59 9.828 -1.040 17.404 1.00 11.02 H new ATOM 0 HG3 ARG B 59 9.968 -1.976 18.879 1.00 11.02 H new ATOM 0 HD2 ARG B 59 12.195 -1.260 16.918 1.00 70.05 H new ATOM 0 HD3 ARG B 59 12.054 -0.769 18.594 1.00 70.05 H new ATOM 0 HE ARG B 59 12.181 -3.484 18.860 1.00 12.13 H new ATOM 0 HH11 ARG B 59 14.223 -1.206 17.024 1.00 42.31 H new ATOM 0 HH12 ARG B 59 15.652 -2.239 17.138 1.00 42.31 H new ATOM 0 HH21 ARG B 59 13.997 -4.808 18.920 1.00 34.24 H new ATOM 0 HH22 ARG B 59 15.522 -4.269 18.207 1.00 34.24 H new ATOM 2739 N HIS B 60 7.084 -1.909 17.990 1.00 32.25 N ATOM 2740 CA HIS B 60 6.060 -1.406 18.934 1.00 50.13 C ATOM 2741 C HIS B 60 4.810 -2.308 18.903 1.00 3.52 C ATOM 2742 O HIS B 60 4.302 -2.729 19.951 1.00 5.33 O ATOM 2743 CB HIS B 60 5.704 0.069 18.565 1.00 32.14 C ATOM 2744 CG HIS B 60 4.386 0.591 19.090 1.00 22.40 C ATOM 2745 ND1 HIS B 60 4.222 1.104 20.354 1.00 35.11 N ATOM 2746 CD2 HIS B 60 3.170 0.697 18.491 1.00 0.21 C ATOM 2747 CE1 HIS B 60 2.971 1.484 20.510 1.00 61.44 C ATOM 2748 NE2 HIS B 60 2.316 1.251 19.399 1.00 15.12 N ATOM 0 H HIS B 60 7.343 -1.226 17.278 1.00 32.25 H new ATOM 0 HA HIS B 60 6.455 -1.429 19.950 1.00 50.13 H new ATOM 0 HB2 HIS B 60 6.500 0.716 18.934 1.00 32.14 H new ATOM 0 HB3 HIS B 60 5.699 0.158 17.479 1.00 32.14 H new ATOM 0 HD2 HIS B 60 2.925 0.398 17.483 1.00 0.21 H new ATOM 0 HE1 HIS B 60 2.553 1.917 21.407 1.00 61.44 H new ATOM 0 HE2 HIS B 60 1.329 1.451 19.239 1.00 15.12 H new ATOM 2757 N HIS B 61 4.349 -2.606 17.677 1.00 64.11 N ATOM 2758 CA HIS B 61 3.136 -3.405 17.434 1.00 52.51 C ATOM 2759 C HIS B 61 3.428 -4.908 17.642 1.00 11.41 C ATOM 2760 O HIS B 61 2.507 -5.715 17.720 1.00 44.35 O ATOM 2761 CB HIS B 61 2.604 -3.137 15.993 1.00 63.11 C ATOM 2762 CG HIS B 61 1.154 -3.524 15.769 1.00 21.23 C ATOM 2763 ND1 HIS B 61 0.701 -4.828 15.782 1.00 52.20 N ATOM 2764 CD2 HIS B 61 0.055 -2.760 15.553 1.00 14.10 C ATOM 2765 CE1 HIS B 61 -0.603 -4.845 15.587 1.00 23.55 C ATOM 2766 NE2 HIS B 61 -1.020 -3.606 15.447 1.00 13.43 N ATOM 0 H HIS B 61 4.810 -2.297 16.821 1.00 64.11 H new ATOM 0 HA HIS B 61 2.368 -3.109 18.149 1.00 52.51 H new ATOM 0 HB2 HIS B 61 2.721 -2.077 15.769 1.00 63.11 H new ATOM 0 HB3 HIS B 61 3.225 -3.684 15.284 1.00 63.11 H new ATOM 0 HD1 HIS B 61 1.286 -5.652 15.921 1.00 52.20 H new ATOM 0 HD2 HIS B 61 0.030 -1.683 15.478 1.00 14.10 H new ATOM 0 HE1 HIS B 61 -1.224 -5.728 15.549 1.00 23.55 H new ATOM 2775 N HIS B 62 4.718 -5.287 17.675 1.00 45.22 N ATOM 2776 CA HIS B 62 5.131 -6.674 17.947 1.00 51.25 C ATOM 2777 C HIS B 62 5.144 -6.945 19.461 1.00 21.31 C ATOM 2778 O HIS B 62 4.772 -8.035 19.909 1.00 34.11 O ATOM 2779 CB HIS B 62 6.519 -6.965 17.335 1.00 35.55 C ATOM 2780 CG HIS B 62 6.872 -8.426 17.348 1.00 42.54 C ATOM 2781 ND1 HIS B 62 6.250 -9.342 16.534 1.00 64.31 N ATOM 2782 CD2 HIS B 62 7.726 -9.136 18.122 1.00 51.14 C ATOM 2783 CE1 HIS B 62 6.698 -10.544 16.809 1.00 10.44 C ATOM 2784 NE2 HIS B 62 7.597 -10.452 17.768 1.00 24.35 N ATOM 0 H HIS B 62 5.496 -4.647 17.516 1.00 45.22 H new ATOM 0 HA HIS B 62 4.406 -7.342 17.481 1.00 51.25 H new ATOM 0 HB2 HIS B 62 6.541 -6.601 16.308 1.00 35.55 H new ATOM 0 HB3 HIS B 62 7.277 -6.409 17.887 1.00 35.55 H new ATOM 0 HD1 HIS B 62 5.549 -9.122 15.826 1.00 64.31 H new ATOM 0 HD2 HIS B 62 8.386 -8.738 18.878 1.00 51.14 H new ATOM 0 HE1 HIS B 62 6.382 -11.458 16.329 1.00 10.44 H new ATOM 0 HE2 HIS B 62 8.111 -11.232 18.178 1.00 24.35 H new ATOM 2793 N GLN B 63 5.603 -5.942 20.231 1.00 4.42 N ATOM 2794 CA GLN B 63 5.646 -6.007 21.705 1.00 14.34 C ATOM 2795 C GLN B 63 4.231 -5.877 22.288 1.00 63.53 C ATOM 2796 O GLN B 63 3.937 -6.413 23.359 1.00 40.53 O ATOM 2797 CB GLN B 63 6.574 -4.899 22.280 1.00 73.13 C ATOM 2798 CG GLN B 63 8.054 -4.996 21.849 1.00 60.44 C ATOM 2799 CD GLN B 63 8.760 -6.299 22.243 1.00 50.04 C ATOM 2800 OE1 GLN B 63 9.639 -6.766 21.527 1.00 21.23 O ATOM 2801 NE2 GLN B 63 8.429 -6.869 23.396 1.00 21.21 N ATOM 0 H GLN B 63 5.955 -5.064 19.850 1.00 4.42 H new ATOM 0 HA GLN B 63 6.054 -6.976 21.992 1.00 14.34 H new ATOM 0 HB2 GLN B 63 6.186 -3.927 21.975 1.00 73.13 H new ATOM 0 HB3 GLN B 63 6.525 -4.935 23.368 1.00 73.13 H new ATOM 0 HG2 GLN B 63 8.110 -4.883 20.766 1.00 60.44 H new ATOM 0 HG3 GLN B 63 8.599 -4.159 22.285 1.00 60.44 H new ATOM 0 HE21 GLN B 63 7.694 -6.461 23.974 1.00 21.21 H new ATOM 0 HE22 GLN B 63 8.910 -7.714 23.703 1.00 21.21 H new ATOM 2810 N HIS B 64 3.367 -5.125 21.586 1.00 33.02 N ATOM 2811 CA HIS B 64 1.937 -4.992 21.915 1.00 33.32 C ATOM 2812 C HIS B 64 1.117 -5.387 20.670 1.00 33.12 C ATOM 2813 O HIS B 64 0.743 -4.511 19.870 1.00 35.05 O ATOM 2814 CB HIS B 64 1.604 -3.544 22.384 1.00 14.23 C ATOM 2815 CG HIS B 64 2.269 -3.139 23.679 1.00 1.12 C ATOM 2816 ND1 HIS B 64 1.569 -2.822 24.826 1.00 62.54 N ATOM 2817 CD2 HIS B 64 3.577 -2.977 23.997 1.00 40.31 C ATOM 2818 CE1 HIS B 64 2.414 -2.476 25.778 1.00 3.14 C ATOM 2819 NE2 HIS B 64 3.633 -2.566 25.300 1.00 20.02 N ATOM 0 H HIS B 64 3.644 -4.586 20.765 1.00 33.02 H new ATOM 0 HA HIS B 64 1.682 -5.653 22.743 1.00 33.32 H new ATOM 0 HB2 HIS B 64 1.901 -2.845 21.603 1.00 14.23 H new ATOM 0 HB3 HIS B 64 0.524 -3.452 22.500 1.00 14.23 H new ATOM 0 HD2 HIS B 64 4.420 -3.142 23.342 1.00 40.31 H new ATOM 0 HE1 HIS B 64 2.148 -2.171 26.779 1.00 3.14 H new ATOM 0 HE2 HIS B 64 4.487 -2.362 25.819 1.00 20.02 H new ATOM 2828 N PRO B 65 0.902 -6.728 20.432 1.00 62.12 N ATOM 2829 CA PRO B 65 0.151 -7.220 19.258 1.00 21.31 C ATOM 2830 C PRO B 65 -1.341 -6.850 19.345 1.00 31.25 C ATOM 2831 O PRO B 65 -1.843 -6.099 18.500 1.00 11.41 O ATOM 2832 CB PRO B 65 0.378 -8.759 19.277 1.00 13.35 C ATOM 2833 CG PRO B 65 1.509 -8.976 20.243 1.00 62.40 C ATOM 2834 CD PRO B 65 1.388 -7.863 21.258 1.00 74.00 C ATOM 0 HA PRO B 65 0.491 -6.770 18.325 1.00 21.31 H new ATOM 0 HB2 PRO B 65 -0.521 -9.286 19.597 1.00 13.35 H new ATOM 0 HB3 PRO B 65 0.630 -9.133 18.285 1.00 13.35 H new ATOM 0 HG2 PRO B 65 1.436 -9.953 20.721 1.00 62.40 H new ATOM 0 HG3 PRO B 65 2.472 -8.941 19.734 1.00 62.40 H new ATOM 0 HD2 PRO B 65 0.688 -8.114 22.055 1.00 74.00 H new ATOM 0 HD3 PRO B 65 2.344 -7.640 21.732 1.00 74.00 H new ATOM 2842 N GLY B 66 -2.015 -7.361 20.405 1.00 11.43 N ATOM 2843 CA GLY B 66 -3.445 -7.129 20.628 1.00 12.43 C ATOM 2844 C GLY B 66 -4.316 -7.709 19.517 1.00 74.42 C ATOM 2845 O GLY B 66 -4.777 -8.853 19.607 1.00 61.03 O ATOM 0 H GLY B 66 -1.576 -7.941 21.120 1.00 11.43 H new ATOM 0 HA2 GLY B 66 -3.736 -7.571 21.581 1.00 12.43 H new ATOM 0 HA3 GLY B 66 -3.627 -6.057 20.705 1.00 12.43 H new ATOM 2849 N GLY B 67 -4.496 -6.911 18.452 1.00 71.11 N ATOM 2850 CA GLY B 67 -5.287 -7.288 17.282 1.00 65.05 C ATOM 2851 C GLY B 67 -6.404 -6.285 17.044 1.00 15.13 C ATOM 2852 O GLY B 67 -6.170 -5.207 16.483 1.00 0.12 O ATOM 0 H GLY B 67 -4.090 -5.978 18.384 1.00 71.11 H new ATOM 0 HA2 GLY B 67 -4.644 -7.339 16.403 1.00 65.05 H new ATOM 0 HA3 GLY B 67 -5.709 -8.282 17.427 1.00 65.05 H new ATOM 2856 N SER B 68 -7.614 -6.630 17.506 1.00 3.13 N ATOM 2857 CA SER B 68 -8.791 -5.756 17.423 1.00 23.31 C ATOM 2858 C SER B 68 -8.790 -4.757 18.607 1.00 70.22 C ATOM 2859 O SER B 68 -9.508 -4.931 19.601 1.00 25.23 O ATOM 2860 CB SER B 68 -10.085 -6.615 17.376 1.00 71.11 C ATOM 2861 OG SER B 68 -10.154 -7.526 18.466 1.00 72.43 O ATOM 0 H SER B 68 -7.804 -7.528 17.950 1.00 3.13 H new ATOM 0 HA SER B 68 -8.755 -5.171 16.504 1.00 23.31 H new ATOM 0 HB2 SER B 68 -10.957 -5.961 17.393 1.00 71.11 H new ATOM 0 HB3 SER B 68 -10.120 -7.168 16.437 1.00 71.11 H new ATOM 0 HG SER B 68 -9.983 -7.047 19.304 1.00 72.43 H new ATOM 2867 N GLY B 69 -7.934 -3.723 18.490 1.00 42.21 N ATOM 2868 CA GLY B 69 -7.779 -2.695 19.527 1.00 22.53 C ATOM 2869 C GLY B 69 -7.545 -1.314 18.936 1.00 71.11 C ATOM 2870 O GLY B 69 -6.669 -0.579 19.394 1.00 35.34 O ATOM 0 H GLY B 69 -7.335 -3.581 17.677 1.00 42.21 H new ATOM 0 HA2 GLY B 69 -8.672 -2.674 20.152 1.00 22.53 H new ATOM 0 HA3 GLY B 69 -6.943 -2.958 20.175 1.00 22.53 H new ATOM 2874 N LEU B 70 -8.356 -0.963 17.916 1.00 43.15 N ATOM 2875 CA LEU B 70 -8.330 0.376 17.271 1.00 50.00 C ATOM 2876 C LEU B 70 -8.881 1.465 18.224 1.00 53.44 C ATOM 2877 O LEU B 70 -8.604 2.656 18.053 1.00 72.01 O ATOM 2878 CB LEU B 70 -9.152 0.341 15.951 1.00 2.11 C ATOM 2879 CG LEU B 70 -8.673 -0.683 14.863 1.00 33.24 C ATOM 2880 CD1 LEU B 70 -9.606 -0.661 13.630 1.00 62.44 C ATOM 2881 CD2 LEU B 70 -7.195 -0.440 14.457 1.00 51.03 C ATOM 0 H LEU B 70 -9.048 -1.595 17.514 1.00 43.15 H new ATOM 0 HA LEU B 70 -7.295 0.629 17.041 1.00 50.00 H new ATOM 0 HB2 LEU B 70 -10.189 0.117 16.199 1.00 2.11 H new ATOM 0 HB3 LEU B 70 -9.138 1.339 15.512 1.00 2.11 H new ATOM 0 HG LEU B 70 -8.726 -1.678 15.305 1.00 33.24 H new ATOM 0 HD11 LEU B 70 -9.251 -1.380 12.892 1.00 62.44 H new ATOM 0 HD12 LEU B 70 -10.619 -0.925 13.935 1.00 62.44 H new ATOM 0 HD13 LEU B 70 -9.607 0.337 13.193 1.00 62.44 H new ATOM 0 HD21 LEU B 70 -6.901 -1.169 13.702 1.00 51.03 H new ATOM 0 HD22 LEU B 70 -7.090 0.566 14.051 1.00 51.03 H new ATOM 0 HD23 LEU B 70 -6.555 -0.546 15.333 1.00 51.03 H new ATOM 2893 N ASP B 71 -9.675 1.021 19.210 1.00 14.41 N ATOM 2894 CA ASP B 71 -10.224 1.868 20.297 1.00 33.03 C ATOM 2895 C ASP B 71 -9.113 2.316 21.270 1.00 44.31 C ATOM 2896 O ASP B 71 -9.249 3.346 21.947 1.00 72.41 O ATOM 2897 CB ASP B 71 -11.336 1.086 21.067 1.00 31.35 C ATOM 2898 CG ASP B 71 -10.855 -0.280 21.611 1.00 2.14 C ATOM 2899 OD1 ASP B 71 -10.588 -0.402 22.824 1.00 33.20 O ATOM 2900 OD2 ASP B 71 -10.739 -1.236 20.808 1.00 54.20 O ATOM 0 H ASP B 71 -9.963 0.045 19.282 1.00 14.41 H new ATOM 0 HA ASP B 71 -10.657 2.763 19.850 1.00 33.03 H new ATOM 0 HB2 ASP B 71 -11.691 1.696 21.898 1.00 31.35 H new ATOM 0 HB3 ASP B 71 -12.185 0.927 20.403 1.00 31.35 H new ATOM 2905 N ASP B 72 -8.021 1.525 21.335 1.00 15.25 N ATOM 2906 CA ASP B 72 -6.858 1.814 22.179 1.00 14.02 C ATOM 2907 C ASP B 72 -5.671 2.231 21.294 1.00 42.43 C ATOM 2908 O ASP B 72 -4.965 1.378 20.740 1.00 34.13 O ATOM 2909 CB ASP B 72 -6.499 0.578 23.036 1.00 13.55 C ATOM 2910 CG ASP B 72 -5.431 0.886 24.105 1.00 73.45 C ATOM 2911 OD1 ASP B 72 -4.217 0.819 23.806 1.00 1.44 O ATOM 2912 OD2 ASP B 72 -5.810 1.186 25.259 1.00 42.22 O ATOM 0 H ASP B 72 -7.928 0.664 20.797 1.00 15.25 H new ATOM 0 HA ASP B 72 -7.096 2.635 22.855 1.00 14.02 H new ATOM 0 HB2 ASP B 72 -7.399 0.205 23.524 1.00 13.55 H new ATOM 0 HB3 ASP B 72 -6.137 -0.218 22.385 1.00 13.55 H new ATOM 2917 N ILE B 73 -5.484 3.551 21.134 1.00 22.43 N ATOM 2918 CA ILE B 73 -4.353 4.115 20.382 1.00 70.12 C ATOM 2919 C ILE B 73 -3.314 4.670 21.377 1.00 60.25 C ATOM 2920 O ILE B 73 -3.623 5.611 22.123 1.00 34.04 O ATOM 2921 CB ILE B 73 -4.811 5.257 19.388 1.00 30.00 C ATOM 2922 CG1 ILE B 73 -5.886 4.726 18.377 1.00 44.22 C ATOM 2923 CG2 ILE B 73 -3.597 5.867 18.636 1.00 23.01 C ATOM 2924 CD1 ILE B 73 -5.402 3.623 17.433 1.00 34.25 C ATOM 0 H ILE B 73 -6.112 4.255 21.522 1.00 22.43 H new ATOM 0 HA ILE B 73 -3.915 3.319 19.780 1.00 70.12 H new ATOM 0 HB ILE B 73 -5.269 6.049 19.981 1.00 30.00 H new ATOM 0 HG12 ILE B 73 -6.739 4.350 18.942 1.00 44.22 H new ATOM 0 HG13 ILE B 73 -6.244 5.564 17.778 1.00 44.22 H new ATOM 0 HG21 ILE B 73 -3.943 6.649 17.960 1.00 23.01 H new ATOM 0 HG22 ILE B 73 -2.899 6.293 19.357 1.00 23.01 H new ATOM 0 HG23 ILE B 73 -3.095 5.088 18.062 1.00 23.01 H new ATOM 0 HD11 ILE B 73 -6.217 3.324 16.774 1.00 34.25 H new ATOM 0 HD12 ILE B 73 -4.570 3.995 16.835 1.00 34.25 H new ATOM 0 HD13 ILE B 73 -5.073 2.763 18.017 1.00 34.25 H new ATOM 2936 N PRO B 74 -2.088 4.056 21.460 1.00 44.54 N ATOM 2937 CA PRO B 74 -0.952 4.650 22.208 1.00 12.21 C ATOM 2938 C PRO B 74 -0.532 6.018 21.604 1.00 11.31 C ATOM 2939 O PRO B 74 -0.569 6.176 20.379 1.00 4.43 O ATOM 2940 CB PRO B 74 0.178 3.586 22.065 1.00 41.42 C ATOM 2941 CG PRO B 74 -0.534 2.308 21.706 1.00 51.10 C ATOM 2942 CD PRO B 74 -1.724 2.732 20.879 1.00 25.32 C ATOM 0 HA PRO B 74 -1.195 4.864 23.249 1.00 12.21 H new ATOM 0 HB2 PRO B 74 0.892 3.870 21.292 1.00 41.42 H new ATOM 0 HB3 PRO B 74 0.739 3.478 22.994 1.00 41.42 H new ATOM 0 HG2 PRO B 74 0.118 1.640 21.143 1.00 51.10 H new ATOM 0 HG3 PRO B 74 -0.848 1.769 22.600 1.00 51.10 H new ATOM 0 HD2 PRO B 74 -1.472 2.812 19.822 1.00 25.32 H new ATOM 0 HD3 PRO B 74 -2.544 2.018 20.958 1.00 25.32 H new ATOM 2950 N PRO B 75 -0.151 7.036 22.458 1.00 0.32 N ATOM 2951 CA PRO B 75 0.309 8.370 21.984 1.00 45.45 C ATOM 2952 C PRO B 75 1.452 8.292 20.939 1.00 72.14 C ATOM 2953 O PRO B 75 1.506 9.135 20.048 1.00 73.20 O ATOM 2954 CB PRO B 75 0.757 9.105 23.285 1.00 51.41 C ATOM 2955 CG PRO B 75 0.819 8.041 24.348 1.00 74.40 C ATOM 2956 CD PRO B 75 -0.192 6.993 23.943 1.00 73.23 C ATOM 0 HA PRO B 75 -0.484 8.897 21.453 1.00 45.45 H new ATOM 0 HB2 PRO B 75 1.727 9.583 23.151 1.00 51.41 H new ATOM 0 HB3 PRO B 75 0.050 9.889 23.556 1.00 51.41 H new ATOM 0 HG2 PRO B 75 1.819 7.614 24.415 1.00 74.40 H new ATOM 0 HG3 PRO B 75 0.582 8.454 25.329 1.00 74.40 H new ATOM 0 HD2 PRO B 75 0.075 6.008 24.325 1.00 73.23 H new ATOM 0 HD3 PRO B 75 -1.186 7.224 24.325 1.00 73.23 H new ATOM 2964 N TYR B 76 2.323 7.253 21.054 1.00 21.44 N ATOM 2965 CA TYR B 76 3.441 7.002 20.102 1.00 11.31 C ATOM 2966 C TYR B 76 2.957 6.959 18.636 1.00 52.04 C ATOM 2967 O TYR B 76 3.631 7.477 17.751 1.00 1.11 O ATOM 2968 CB TYR B 76 4.196 5.674 20.451 1.00 62.42 C ATOM 2969 CG TYR B 76 5.157 5.190 19.339 1.00 22.12 C ATOM 2970 CD1 TYR B 76 4.789 4.164 18.457 1.00 1.31 C ATOM 2971 CD2 TYR B 76 6.395 5.811 19.122 1.00 44.33 C ATOM 2972 CE1 TYR B 76 5.609 3.783 17.416 1.00 62.45 C ATOM 2973 CE2 TYR B 76 7.223 5.415 18.085 1.00 54.21 C ATOM 2974 CZ TYR B 76 6.819 4.408 17.231 1.00 44.03 C ATOM 2975 OH TYR B 76 7.623 4.028 16.177 1.00 22.33 O ATOM 0 H TYR B 76 2.270 6.567 21.807 1.00 21.44 H new ATOM 0 HA TYR B 76 4.131 7.840 20.206 1.00 11.31 H new ATOM 0 HB2 TYR B 76 4.764 5.821 21.370 1.00 62.42 H new ATOM 0 HB3 TYR B 76 3.463 4.892 20.650 1.00 62.42 H new ATOM 0 HD1 TYR B 76 3.843 3.661 18.596 1.00 1.31 H new ATOM 0 HD2 TYR B 76 6.708 6.612 19.775 1.00 44.33 H new ATOM 0 HE1 TYR B 76 5.301 2.994 16.746 1.00 62.45 H new ATOM 0 HE2 TYR B 76 8.182 5.892 17.945 1.00 54.21 H new ATOM 0 HH TYR B 76 8.502 3.758 16.517 1.00 22.33 H new ATOM 2985 N ASP B 77 1.808 6.309 18.413 1.00 14.52 N ATOM 2986 CA ASP B 77 1.215 6.108 17.067 1.00 30.41 C ATOM 2987 C ASP B 77 0.862 7.456 16.423 1.00 54.31 C ATOM 2988 O ASP B 77 1.017 7.642 15.210 1.00 45.12 O ATOM 2989 CB ASP B 77 -0.059 5.223 17.178 1.00 14.23 C ATOM 2990 CG ASP B 77 0.205 3.807 17.741 1.00 2.22 C ATOM 2991 OD1 ASP B 77 -0.307 2.817 17.177 1.00 41.11 O ATOM 2992 OD2 ASP B 77 0.931 3.680 18.751 1.00 34.32 O ATOM 0 H ASP B 77 1.251 5.900 19.164 1.00 14.52 H new ATOM 0 HA ASP B 77 1.949 5.606 16.436 1.00 30.41 H new ATOM 0 HB2 ASP B 77 -0.784 5.727 17.817 1.00 14.23 H new ATOM 0 HB3 ASP B 77 -0.512 5.132 16.191 1.00 14.23 H new ATOM 2997 N ARG B 78 0.390 8.387 17.265 1.00 61.23 N ATOM 2998 CA ARG B 78 0.051 9.764 16.855 1.00 23.22 C ATOM 2999 C ARG B 78 1.319 10.607 16.666 1.00 71.34 C ATOM 3000 O ARG B 78 1.376 11.469 15.782 1.00 42.21 O ATOM 3001 CB ARG B 78 -0.878 10.409 17.909 1.00 1.05 C ATOM 3002 CG ARG B 78 -2.188 9.631 18.133 1.00 51.32 C ATOM 3003 CD ARG B 78 -3.011 9.456 16.833 1.00 64.32 C ATOM 3004 NE ARG B 78 -4.312 8.803 17.063 1.00 44.22 N ATOM 3005 CZ ARG B 78 -5.049 8.178 16.129 1.00 63.32 C ATOM 3006 NH1 ARG B 78 -4.634 8.092 14.867 1.00 43.12 N ATOM 3007 NH2 ARG B 78 -6.215 7.655 16.476 1.00 20.43 N ATOM 0 H ARG B 78 0.231 8.208 18.256 1.00 61.23 H new ATOM 0 HA ARG B 78 -0.470 9.725 15.898 1.00 23.22 H new ATOM 0 HB2 ARG B 78 -0.343 10.484 18.856 1.00 1.05 H new ATOM 0 HB3 ARG B 78 -1.117 11.426 17.597 1.00 1.05 H new ATOM 0 HG2 ARG B 78 -1.956 8.649 18.546 1.00 51.32 H new ATOM 0 HG3 ARG B 78 -2.794 10.153 18.874 1.00 51.32 H new ATOM 0 HD2 ARG B 78 -3.176 10.433 16.379 1.00 64.32 H new ATOM 0 HD3 ARG B 78 -2.435 8.866 16.120 1.00 64.32 H new ATOM 0 HE ARG B 78 -4.685 8.827 18.012 1.00 44.22 H new ATOM 0 HH11 ARG B 78 -3.742 8.505 14.594 1.00 43.12 H new ATOM 0 HH12 ARG B 78 -5.208 7.613 14.173 1.00 43.12 H new ATOM 0 HH21 ARG B 78 -6.541 7.730 17.440 1.00 20.43 H new ATOM 0 HH22 ARG B 78 -6.787 7.177 15.780 1.00 20.43 H new ATOM 3021 N ASP B 79 2.331 10.342 17.514 1.00 4.41 N ATOM 3022 CA ASP B 79 3.643 11.008 17.432 1.00 22.15 C ATOM 3023 C ASP B 79 4.424 10.524 16.201 1.00 20.42 C ATOM 3024 O ASP B 79 5.259 11.260 15.669 1.00 54.34 O ATOM 3025 CB ASP B 79 4.482 10.804 18.725 1.00 74.30 C ATOM 3026 CG ASP B 79 4.004 11.671 19.903 1.00 64.14 C ATOM 3027 OD1 ASP B 79 3.339 11.157 20.821 1.00 40.22 O ATOM 3028 OD2 ASP B 79 4.295 12.882 19.915 1.00 30.13 O ATOM 0 H ASP B 79 2.262 9.663 18.272 1.00 4.41 H new ATOM 0 HA ASP B 79 3.455 12.077 17.330 1.00 22.15 H new ATOM 0 HB2 ASP B 79 4.440 9.754 19.015 1.00 74.30 H new ATOM 0 HB3 ASP B 79 5.526 11.035 18.513 1.00 74.30 H new ATOM 3033 N PHE B 80 4.122 9.291 15.754 1.00 32.14 N ATOM 3034 CA PHE B 80 4.733 8.666 14.565 1.00 75.11 C ATOM 3035 C PHE B 80 4.336 9.444 13.302 1.00 40.44 C ATOM 3036 O PHE B 80 5.151 9.655 12.395 1.00 33.00 O ATOM 3037 CB PHE B 80 4.289 7.173 14.459 1.00 21.14 C ATOM 3038 CG PHE B 80 4.922 6.426 13.287 1.00 60.31 C ATOM 3039 CD1 PHE B 80 4.245 6.270 12.070 1.00 60.22 C ATOM 3040 CD2 PHE B 80 6.208 5.916 13.393 1.00 1.30 C ATOM 3041 CE1 PHE B 80 4.843 5.630 11.006 1.00 51.34 C ATOM 3042 CE2 PHE B 80 6.797 5.271 12.332 1.00 22.14 C ATOM 3043 CZ PHE B 80 6.123 5.131 11.138 1.00 42.24 C ATOM 0 H PHE B 80 3.437 8.692 16.215 1.00 32.14 H new ATOM 0 HA PHE B 80 5.818 8.696 14.661 1.00 75.11 H new ATOM 0 HB2 PHE B 80 4.545 6.660 15.386 1.00 21.14 H new ATOM 0 HB3 PHE B 80 3.204 7.132 14.361 1.00 21.14 H new ATOM 0 HD1 PHE B 80 3.242 6.656 11.965 1.00 60.22 H new ATOM 0 HD2 PHE B 80 6.752 6.027 14.319 1.00 1.30 H new ATOM 0 HE1 PHE B 80 4.312 5.519 10.072 1.00 51.34 H new ATOM 0 HE2 PHE B 80 7.795 4.871 12.435 1.00 22.14 H new ATOM 0 HZ PHE B 80 6.596 4.631 10.306 1.00 42.24 H new ATOM 3053 N CYS B 81 3.066 9.864 13.291 1.00 70.22 N ATOM 3054 CA CYS B 81 2.457 10.644 12.211 1.00 71.52 C ATOM 3055 C CYS B 81 2.999 12.091 12.156 1.00 45.23 C ATOM 3056 O CYS B 81 2.867 12.760 11.125 1.00 73.40 O ATOM 3057 CB CYS B 81 0.936 10.626 12.424 1.00 4.33 C ATOM 3058 SG CYS B 81 0.250 8.958 12.486 1.00 62.54 S ATOM 0 H CYS B 81 2.418 9.665 14.053 1.00 70.22 H new ATOM 0 HA CYS B 81 2.713 10.196 11.251 1.00 71.52 H new ATOM 0 HB2 CYS B 81 0.699 11.145 13.353 1.00 4.33 H new ATOM 0 HB3 CYS B 81 0.456 11.180 11.618 1.00 4.33 H new ATOM 0 HG CYS B 81 -0.366 8.701 11.371 1.00 62.54 H new ATOM 3064 N LYS B 82 3.606 12.558 13.275 1.00 4.41 N ATOM 3065 CA LYS B 82 4.237 13.891 13.360 1.00 53.23 C ATOM 3066 C LYS B 82 5.606 13.864 12.651 1.00 3.41 C ATOM 3067 O LYS B 82 6.651 13.656 13.280 1.00 64.31 O ATOM 3068 CB LYS B 82 4.396 14.332 14.842 1.00 72.43 C ATOM 3069 CG LYS B 82 3.073 14.395 15.631 1.00 14.20 C ATOM 3070 CD LYS B 82 3.294 14.779 17.110 1.00 1.35 C ATOM 3071 CE LYS B 82 2.005 14.717 17.945 1.00 42.33 C ATOM 3072 NZ LYS B 82 2.276 14.997 19.382 1.00 11.22 N ATOM 0 H LYS B 82 3.670 12.020 14.139 1.00 4.41 H new ATOM 0 HA LYS B 82 3.594 14.617 12.862 1.00 53.23 H new ATOM 0 HB2 LYS B 82 5.072 13.640 15.344 1.00 72.43 H new ATOM 0 HB3 LYS B 82 4.868 15.314 14.868 1.00 72.43 H new ATOM 0 HG2 LYS B 82 2.408 15.121 15.164 1.00 14.20 H new ATOM 0 HG3 LYS B 82 2.575 13.427 15.579 1.00 14.20 H new ATOM 0 HD2 LYS B 82 4.036 14.110 17.546 1.00 1.35 H new ATOM 0 HD3 LYS B 82 3.705 15.787 17.160 1.00 1.35 H new ATOM 0 HE2 LYS B 82 1.286 15.440 17.561 1.00 42.33 H new ATOM 0 HE3 LYS B 82 1.551 13.731 17.844 1.00 42.33 H new ATOM 0 HZ1 LYS B 82 1.399 14.881 19.930 1.00 11.22 H new ATOM 0 HZ2 LYS B 82 2.995 14.334 19.735 1.00 11.22 H new ATOM 0 HZ3 LYS B 82 2.623 15.972 19.486 1.00 11.22 H new ATOM 3086 N VAL B 83 5.564 14.011 11.322 1.00 42.14 N ATOM 3087 CA VAL B 83 6.745 14.014 10.440 1.00 4.54 C ATOM 3088 C VAL B 83 6.608 15.153 9.422 1.00 13.14 C ATOM 3089 O VAL B 83 5.524 15.727 9.271 1.00 40.45 O ATOM 3090 CB VAL B 83 6.903 12.633 9.687 1.00 4.22 C ATOM 3091 CG1 VAL B 83 7.333 11.507 10.653 1.00 23.42 C ATOM 3092 CG2 VAL B 83 5.599 12.245 8.944 1.00 44.54 C ATOM 0 H VAL B 83 4.688 14.134 10.814 1.00 42.14 H new ATOM 0 HA VAL B 83 7.636 14.164 11.050 1.00 4.54 H new ATOM 0 HB VAL B 83 7.692 12.759 8.946 1.00 4.22 H new ATOM 0 HG11 VAL B 83 7.432 10.572 10.101 1.00 23.42 H new ATOM 0 HG12 VAL B 83 8.290 11.763 11.107 1.00 23.42 H new ATOM 0 HG13 VAL B 83 6.581 11.390 11.433 1.00 23.42 H new ATOM 0 HG21 VAL B 83 5.740 11.291 8.436 1.00 44.54 H new ATOM 0 HG22 VAL B 83 4.784 12.157 9.662 1.00 44.54 H new ATOM 0 HG23 VAL B 83 5.356 13.014 8.211 1.00 44.54 H new ATOM 3102 N ASP B 84 7.709 15.470 8.721 1.00 44.51 N ATOM 3103 CA ASP B 84 7.708 16.499 7.666 1.00 62.30 C ATOM 3104 C ASP B 84 6.912 15.979 6.446 1.00 60.24 C ATOM 3105 O ASP B 84 6.761 14.765 6.284 1.00 32.02 O ATOM 3106 CB ASP B 84 9.167 16.882 7.290 1.00 12.31 C ATOM 3107 CG ASP B 84 9.282 18.148 6.425 1.00 52.03 C ATOM 3108 OD1 ASP B 84 10.128 18.183 5.507 1.00 1.23 O ATOM 3109 OD2 ASP B 84 8.523 19.116 6.655 1.00 53.14 O ATOM 0 H ASP B 84 8.616 15.026 8.866 1.00 44.51 H new ATOM 0 HA ASP B 84 7.220 17.404 8.028 1.00 62.30 H new ATOM 0 HB2 ASP B 84 9.740 17.028 8.206 1.00 12.31 H new ATOM 0 HB3 ASP B 84 9.624 16.048 6.757 1.00 12.31 H new ATOM 3114 N GLN B 85 6.416 16.905 5.604 1.00 11.12 N ATOM 3115 CA GLN B 85 5.485 16.595 4.495 1.00 44.25 C ATOM 3116 C GLN B 85 6.058 15.538 3.491 1.00 11.41 C ATOM 3117 O GLN B 85 5.369 14.543 3.221 1.00 4.52 O ATOM 3118 CB GLN B 85 5.026 17.908 3.782 1.00 30.44 C ATOM 3119 CG GLN B 85 3.891 17.726 2.737 1.00 22.31 C ATOM 3120 CD GLN B 85 2.596 17.114 3.300 1.00 12.11 C ATOM 3121 OE1 GLN B 85 2.270 17.251 4.479 1.00 1.35 O ATOM 3122 NE2 GLN B 85 1.832 16.464 2.445 1.00 14.45 N ATOM 0 H GLN B 85 6.649 17.896 5.672 1.00 11.12 H new ATOM 0 HA GLN B 85 4.605 16.124 4.932 1.00 44.25 H new ATOM 0 HB2 GLN B 85 4.692 18.617 4.539 1.00 30.44 H new ATOM 0 HB3 GLN B 85 5.888 18.354 3.286 1.00 30.44 H new ATOM 0 HG2 GLN B 85 3.659 18.697 2.299 1.00 22.31 H new ATOM 0 HG3 GLN B 85 4.256 17.092 1.929 1.00 22.31 H new ATOM 0 HE21 GLN B 85 2.125 16.364 1.473 1.00 14.45 H new ATOM 0 HE22 GLN B 85 0.948 16.061 2.755 1.00 14.45 H new ATOM 3131 N PRO B 86 7.325 15.686 2.943 1.00 65.11 N ATOM 3132 CA PRO B 86 7.935 14.624 2.098 1.00 2.12 C ATOM 3133 C PRO B 86 8.217 13.323 2.880 1.00 63.44 C ATOM 3134 O PRO B 86 8.035 12.228 2.341 1.00 1.24 O ATOM 3135 CB PRO B 86 9.249 15.267 1.576 1.00 13.01 C ATOM 3136 CG PRO B 86 9.571 16.328 2.584 1.00 13.32 C ATOM 3137 CD PRO B 86 8.233 16.867 3.040 1.00 53.53 C ATOM 0 HA PRO B 86 7.264 14.315 1.297 1.00 2.12 H new ATOM 0 HB2 PRO B 86 10.050 14.531 1.504 1.00 13.01 H new ATOM 0 HB3 PRO B 86 9.116 15.692 0.581 1.00 13.01 H new ATOM 0 HG2 PRO B 86 10.135 15.917 3.421 1.00 13.32 H new ATOM 0 HG3 PRO B 86 10.183 17.116 2.144 1.00 13.32 H new ATOM 0 HD2 PRO B 86 8.282 17.252 4.059 1.00 53.53 H new ATOM 0 HD3 PRO B 86 7.894 17.686 2.406 1.00 53.53 H new ATOM 3145 N THR B 87 8.630 13.474 4.158 1.00 11.22 N ATOM 3146 CA THR B 87 8.961 12.358 5.064 1.00 10.22 C ATOM 3147 C THR B 87 7.742 11.431 5.301 1.00 72.11 C ATOM 3148 O THR B 87 7.897 10.218 5.482 1.00 23.12 O ATOM 3149 CB THR B 87 9.477 12.935 6.422 1.00 70.23 C ATOM 3150 OG1 THR B 87 10.535 13.871 6.166 1.00 32.11 O ATOM 3151 CG2 THR B 87 9.983 11.855 7.393 1.00 45.41 C ATOM 0 H THR B 87 8.744 14.390 4.593 1.00 11.22 H new ATOM 0 HA THR B 87 9.740 11.755 4.598 1.00 10.22 H new ATOM 0 HB THR B 87 8.627 13.419 6.902 1.00 70.23 H new ATOM 0 HG1 THR B 87 10.817 14.284 7.009 1.00 32.11 H new ATOM 0 HG21 THR B 87 10.326 12.326 8.314 1.00 45.41 H new ATOM 0 HG22 THR B 87 9.173 11.161 7.619 1.00 45.41 H new ATOM 0 HG23 THR B 87 10.809 11.311 6.934 1.00 45.41 H new ATOM 3159 N LEU B 88 6.541 12.034 5.274 1.00 54.23 N ATOM 3160 CA LEU B 88 5.258 11.325 5.434 1.00 12.54 C ATOM 3161 C LEU B 88 5.053 10.363 4.248 1.00 64.12 C ATOM 3162 O LEU B 88 4.748 9.183 4.436 1.00 33.51 O ATOM 3163 CB LEU B 88 4.104 12.377 5.546 1.00 62.43 C ATOM 3164 CG LEU B 88 2.766 11.910 6.228 1.00 15.12 C ATOM 3165 CD1 LEU B 88 1.877 13.124 6.571 1.00 35.23 C ATOM 3166 CD2 LEU B 88 1.986 10.891 5.372 1.00 73.42 C ATOM 0 H LEU B 88 6.432 13.039 5.139 1.00 54.23 H new ATOM 0 HA LEU B 88 5.258 10.728 6.346 1.00 12.54 H new ATOM 0 HB2 LEU B 88 4.483 13.236 6.100 1.00 62.43 H new ATOM 0 HB3 LEU B 88 3.867 12.726 4.541 1.00 62.43 H new ATOM 0 HG LEU B 88 3.044 11.401 7.151 1.00 15.12 H new ATOM 0 HD11 LEU B 88 0.956 12.779 7.042 1.00 35.23 H new ATOM 0 HD12 LEU B 88 2.410 13.783 7.256 1.00 35.23 H new ATOM 0 HD13 LEU B 88 1.636 13.668 5.658 1.00 35.23 H new ATOM 0 HD21 LEU B 88 1.072 10.604 5.891 1.00 73.42 H new ATOM 0 HD22 LEU B 88 1.732 11.341 4.412 1.00 73.42 H new ATOM 0 HD23 LEU B 88 2.602 10.007 5.207 1.00 73.42 H new ATOM 3178 N PHE B 89 5.246 10.894 3.031 1.00 13.32 N ATOM 3179 CA PHE B 89 5.110 10.119 1.790 1.00 14.14 C ATOM 3180 C PHE B 89 6.208 9.050 1.675 1.00 11.23 C ATOM 3181 O PHE B 89 5.982 8.005 1.075 1.00 3.11 O ATOM 3182 CB PHE B 89 5.093 11.055 0.567 1.00 63.33 C ATOM 3183 CG PHE B 89 3.896 12.014 0.552 1.00 51.54 C ATOM 3184 CD1 PHE B 89 2.592 11.521 0.528 1.00 72.34 C ATOM 3185 CD2 PHE B 89 4.067 13.393 0.559 1.00 23.10 C ATOM 3186 CE1 PHE B 89 1.508 12.376 0.505 1.00 65.22 C ATOM 3187 CE2 PHE B 89 2.984 14.247 0.534 1.00 54.42 C ATOM 3188 CZ PHE B 89 1.703 13.738 0.508 1.00 51.43 C ATOM 0 H PHE B 89 5.500 11.870 2.880 1.00 13.32 H new ATOM 0 HA PHE B 89 4.156 9.592 1.819 1.00 14.14 H new ATOM 0 HB2 PHE B 89 6.015 11.636 0.550 1.00 63.33 H new ATOM 0 HB3 PHE B 89 5.079 10.453 -0.342 1.00 63.33 H new ATOM 0 HD1 PHE B 89 2.427 10.454 0.527 1.00 72.34 H new ATOM 0 HD2 PHE B 89 5.066 13.803 0.584 1.00 23.10 H new ATOM 0 HE1 PHE B 89 0.505 11.975 0.485 1.00 65.22 H new ATOM 0 HE2 PHE B 89 3.140 15.316 0.535 1.00 54.42 H new ATOM 0 HZ PHE B 89 0.855 14.406 0.490 1.00 51.43 H new ATOM 3198 N GLU B 90 7.387 9.324 2.264 1.00 33.43 N ATOM 3199 CA GLU B 90 8.490 8.343 2.368 1.00 14.04 C ATOM 3200 C GLU B 90 8.075 7.121 3.214 1.00 3.34 C ATOM 3201 O GLU B 90 8.453 5.989 2.900 1.00 43.44 O ATOM 3202 CB GLU B 90 9.749 9.004 2.984 1.00 72.25 C ATOM 3203 CG GLU B 90 10.455 10.040 2.088 1.00 54.01 C ATOM 3204 CD GLU B 90 11.108 9.411 0.847 1.00 15.35 C ATOM 3205 OE1 GLU B 90 12.276 8.978 0.931 1.00 22.10 O ATOM 3206 OE2 GLU B 90 10.456 9.330 -0.211 1.00 74.24 O ATOM 0 H GLU B 90 7.604 10.229 2.681 1.00 33.43 H new ATOM 0 HA GLU B 90 8.722 8.000 1.360 1.00 14.04 H new ATOM 0 HB2 GLU B 90 9.464 9.490 3.917 1.00 72.25 H new ATOM 0 HB3 GLU B 90 10.463 8.221 3.237 1.00 72.25 H new ATOM 0 HG2 GLU B 90 9.732 10.791 1.770 1.00 54.01 H new ATOM 0 HG3 GLU B 90 11.217 10.557 2.671 1.00 54.01 H new ATOM 3213 N LEU B 91 7.308 7.377 4.295 1.00 33.42 N ATOM 3214 CA LEU B 91 6.737 6.315 5.151 1.00 13.14 C ATOM 3215 C LEU B 91 5.713 5.468 4.359 1.00 72.43 C ATOM 3216 O LEU B 91 5.644 4.252 4.548 1.00 13.22 O ATOM 3217 CB LEU B 91 6.065 6.925 6.418 1.00 40.44 C ATOM 3218 CG LEU B 91 6.994 7.682 7.424 1.00 62.13 C ATOM 3219 CD1 LEU B 91 6.167 8.346 8.556 1.00 13.34 C ATOM 3220 CD2 LEU B 91 8.078 6.742 8.002 1.00 50.32 C ATOM 0 H LEU B 91 7.068 8.321 4.598 1.00 33.42 H new ATOM 0 HA LEU B 91 7.552 5.667 5.472 1.00 13.14 H new ATOM 0 HB2 LEU B 91 5.288 7.616 6.089 1.00 40.44 H new ATOM 0 HB3 LEU B 91 5.567 6.119 6.958 1.00 40.44 H new ATOM 0 HG LEU B 91 7.503 8.474 6.874 1.00 62.13 H new ATOM 0 HD11 LEU B 91 6.838 8.865 9.240 1.00 13.34 H new ATOM 0 HD12 LEU B 91 5.466 9.060 8.124 1.00 13.34 H new ATOM 0 HD13 LEU B 91 5.615 7.580 9.100 1.00 13.34 H new ATOM 0 HD21 LEU B 91 8.708 7.297 8.697 1.00 50.32 H new ATOM 0 HD22 LEU B 91 7.600 5.914 8.526 1.00 50.32 H new ATOM 0 HD23 LEU B 91 8.691 6.351 7.190 1.00 50.32 H new ATOM 3232 N ILE B 92 4.936 6.134 3.474 1.00 32.43 N ATOM 3233 CA ILE B 92 3.958 5.469 2.577 1.00 73.13 C ATOM 3234 C ILE B 92 4.697 4.566 1.557 1.00 51.32 C ATOM 3235 O ILE B 92 4.309 3.408 1.344 1.00 21.14 O ATOM 3236 CB ILE B 92 3.048 6.526 1.816 1.00 65.12 C ATOM 3237 CG1 ILE B 92 2.251 7.409 2.836 1.00 53.35 C ATOM 3238 CG2 ILE B 92 2.086 5.840 0.807 1.00 3.42 C ATOM 3239 CD1 ILE B 92 1.347 8.466 2.215 1.00 43.10 C ATOM 0 H ILE B 92 4.968 7.147 3.360 1.00 32.43 H new ATOM 0 HA ILE B 92 3.305 4.853 3.195 1.00 73.13 H new ATOM 0 HB ILE B 92 3.710 7.174 1.243 1.00 65.12 H new ATOM 0 HG12 ILE B 92 1.642 6.755 3.459 1.00 53.35 H new ATOM 0 HG13 ILE B 92 2.963 7.905 3.495 1.00 53.35 H new ATOM 0 HG21 ILE B 92 1.482 6.597 0.308 1.00 3.42 H new ATOM 0 HG22 ILE B 92 2.667 5.293 0.065 1.00 3.42 H new ATOM 0 HG23 ILE B 92 1.433 5.148 1.339 1.00 3.42 H new ATOM 0 HD11 ILE B 92 0.841 9.022 3.005 1.00 43.10 H new ATOM 0 HD12 ILE B 92 1.947 9.151 1.616 1.00 43.10 H new ATOM 0 HD13 ILE B 92 0.605 7.982 1.579 1.00 43.10 H new ATOM 3251 N LEU B 93 5.782 5.107 0.968 1.00 23.10 N ATOM 3252 CA LEU B 93 6.598 4.415 -0.056 1.00 10.43 C ATOM 3253 C LEU B 93 7.301 3.179 0.532 1.00 65.40 C ATOM 3254 O LEU B 93 7.372 2.133 -0.117 1.00 3.05 O ATOM 3255 CB LEU B 93 7.646 5.395 -0.665 1.00 21.44 C ATOM 3256 CG LEU B 93 7.071 6.578 -1.507 1.00 54.44 C ATOM 3257 CD1 LEU B 93 8.186 7.553 -1.943 1.00 40.30 C ATOM 3258 CD2 LEU B 93 6.275 6.063 -2.720 1.00 62.34 C ATOM 0 H LEU B 93 6.121 6.043 1.189 1.00 23.10 H new ATOM 0 HA LEU B 93 5.929 4.076 -0.847 1.00 10.43 H new ATOM 0 HB2 LEU B 93 8.241 5.810 0.148 1.00 21.44 H new ATOM 0 HB3 LEU B 93 8.325 4.822 -1.297 1.00 21.44 H new ATOM 0 HG LEU B 93 6.382 7.131 -0.869 1.00 54.44 H new ATOM 0 HD11 LEU B 93 7.752 8.364 -2.527 1.00 40.30 H new ATOM 0 HD12 LEU B 93 8.676 7.963 -1.060 1.00 40.30 H new ATOM 0 HD13 LEU B 93 8.918 7.020 -2.550 1.00 40.30 H new ATOM 0 HD21 LEU B 93 5.887 6.909 -3.287 1.00 62.34 H new ATOM 0 HD22 LEU B 93 6.928 5.468 -3.358 1.00 62.34 H new ATOM 0 HD23 LEU B 93 5.445 5.446 -2.375 1.00 62.34 H new ATOM 3270 N ALA B 94 7.810 3.325 1.767 1.00 11.04 N ATOM 3271 CA ALA B 94 8.508 2.246 2.494 1.00 51.03 C ATOM 3272 C ALA B 94 7.518 1.168 2.962 1.00 75.53 C ATOM 3273 O ALA B 94 7.847 -0.013 2.989 1.00 53.12 O ATOM 3274 CB ALA B 94 9.270 2.825 3.691 1.00 41.31 C ATOM 0 H ALA B 94 7.750 4.197 2.293 1.00 11.04 H new ATOM 0 HA ALA B 94 9.219 1.779 1.813 1.00 51.03 H new ATOM 0 HB1 ALA B 94 9.781 2.021 4.220 1.00 41.31 H new ATOM 0 HB2 ALA B 94 10.003 3.551 3.339 1.00 41.31 H new ATOM 0 HB3 ALA B 94 8.569 3.315 4.366 1.00 41.31 H new ATOM 3280 N ALA B 95 6.303 1.605 3.325 1.00 13.33 N ATOM 3281 CA ALA B 95 5.222 0.714 3.784 1.00 74.13 C ATOM 3282 C ALA B 95 4.612 -0.082 2.622 1.00 33.25 C ATOM 3283 O ALA B 95 4.063 -1.155 2.840 1.00 3.10 O ATOM 3284 CB ALA B 95 4.145 1.515 4.504 1.00 60.10 C ATOM 0 H ALA B 95 6.039 2.590 3.309 1.00 13.33 H new ATOM 0 HA ALA B 95 5.657 -0.002 4.481 1.00 74.13 H new ATOM 0 HB1 ALA B 95 3.354 0.843 4.837 1.00 60.10 H new ATOM 0 HB2 ALA B 95 4.581 2.018 5.367 1.00 60.10 H new ATOM 0 HB3 ALA B 95 3.728 2.258 3.824 1.00 60.10 H new ATOM 3290 N ASN B 96 4.660 0.496 1.405 1.00 41.42 N ATOM 3291 CA ASN B 96 4.228 -0.182 0.160 1.00 3.23 C ATOM 3292 C ASN B 96 5.334 -1.149 -0.325 1.00 72.32 C ATOM 3293 O ASN B 96 5.053 -2.269 -0.766 1.00 23.35 O ATOM 3294 CB ASN B 96 3.888 0.879 -0.934 1.00 2.14 C ATOM 3295 CG ASN B 96 3.440 0.283 -2.282 1.00 1.41 C ATOM 3296 OD1 ASN B 96 2.844 -0.791 -2.349 1.00 23.14 O ATOM 3297 ND2 ASN B 96 3.703 0.989 -3.362 1.00 34.41 N ATOM 0 H ASN B 96 4.999 1.446 1.254 1.00 41.42 H new ATOM 0 HA ASN B 96 3.329 -0.766 0.358 1.00 3.23 H new ATOM 0 HB2 ASN B 96 3.099 1.530 -0.558 1.00 2.14 H new ATOM 0 HB3 ASN B 96 4.765 1.505 -1.101 1.00 2.14 H new ATOM 0 HD21 ASN B 96 3.411 0.648 -4.278 1.00 34.41 H new ATOM 0 HD22 ASN B 96 4.199 1.877 -3.283 1.00 34.41 H new ATOM 3304 N TYR B 97 6.597 -0.696 -0.202 1.00 31.01 N ATOM 3305 CA TYR B 97 7.798 -1.483 -0.566 1.00 31.01 C ATOM 3306 C TYR B 97 7.921 -2.745 0.310 1.00 62.20 C ATOM 3307 O TYR B 97 8.289 -3.815 -0.179 1.00 42.53 O ATOM 3308 CB TYR B 97 9.075 -0.593 -0.444 1.00 2.03 C ATOM 3309 CG TYR B 97 10.425 -1.339 -0.570 1.00 64.51 C ATOM 3310 CD1 TYR B 97 11.386 -1.286 0.452 1.00 55.44 C ATOM 3311 CD2 TYR B 97 10.730 -2.108 -1.698 1.00 32.51 C ATOM 3312 CE1 TYR B 97 12.586 -1.966 0.349 1.00 54.12 C ATOM 3313 CE2 TYR B 97 11.933 -2.789 -1.802 1.00 0.13 C ATOM 3314 CZ TYR B 97 12.854 -2.714 -0.776 1.00 73.22 C ATOM 3315 OH TYR B 97 14.053 -3.394 -0.873 1.00 71.43 O ATOM 0 H TYR B 97 6.817 0.234 0.155 1.00 31.01 H new ATOM 0 HA TYR B 97 7.697 -1.811 -1.601 1.00 31.01 H new ATOM 0 HB2 TYR B 97 9.033 0.178 -1.213 1.00 2.03 H new ATOM 0 HB3 TYR B 97 9.050 -0.084 0.519 1.00 2.03 H new ATOM 0 HD1 TYR B 97 11.184 -0.702 1.338 1.00 55.44 H new ATOM 0 HD2 TYR B 97 10.014 -2.172 -2.504 1.00 32.51 H new ATOM 0 HE1 TYR B 97 13.310 -1.911 1.148 1.00 54.12 H new ATOM 0 HE2 TYR B 97 12.149 -3.376 -2.682 1.00 0.13 H new ATOM 0 HH TYR B 97 14.088 -3.875 -1.726 1.00 71.43 H new ATOM 3325 N LEU B 98 7.631 -2.592 1.610 1.00 32.43 N ATOM 3326 CA LEU B 98 7.691 -3.688 2.594 1.00 13.13 C ATOM 3327 C LEU B 98 6.305 -4.348 2.781 1.00 4.12 C ATOM 3328 O LEU B 98 6.194 -5.385 3.455 1.00 5.33 O ATOM 3329 CB LEU B 98 8.250 -3.148 3.937 1.00 63.25 C ATOM 3330 CG LEU B 98 9.701 -2.563 3.889 1.00 1.22 C ATOM 3331 CD1 LEU B 98 10.176 -2.091 5.286 1.00 53.41 C ATOM 3332 CD2 LEU B 98 10.688 -3.573 3.262 1.00 35.30 C ATOM 0 H LEU B 98 7.346 -1.699 2.013 1.00 32.43 H new ATOM 0 HA LEU B 98 8.363 -4.462 2.223 1.00 13.13 H new ATOM 0 HB2 LEU B 98 7.578 -2.371 4.302 1.00 63.25 H new ATOM 0 HB3 LEU B 98 8.229 -3.956 4.668 1.00 63.25 H new ATOM 0 HG LEU B 98 9.679 -1.682 3.247 1.00 1.22 H new ATOM 0 HD11 LEU B 98 11.187 -1.692 5.211 1.00 53.41 H new ATOM 0 HD12 LEU B 98 9.506 -1.315 5.655 1.00 53.41 H new ATOM 0 HD13 LEU B 98 10.169 -2.934 5.977 1.00 53.41 H new ATOM 0 HD21 LEU B 98 11.688 -3.140 3.242 1.00 35.30 H new ATOM 0 HD22 LEU B 98 10.700 -4.487 3.856 1.00 35.30 H new ATOM 0 HD23 LEU B 98 10.373 -3.806 2.245 1.00 35.30 H new ATOM 3344 N ASP B 99 5.275 -3.718 2.176 1.00 62.22 N ATOM 3345 CA ASP B 99 3.867 -4.189 2.159 1.00 14.04 C ATOM 3346 C ASP B 99 3.306 -4.399 3.596 1.00 33.30 C ATOM 3347 O ASP B 99 2.465 -5.268 3.851 1.00 3.21 O ATOM 3348 CB ASP B 99 3.723 -5.456 1.252 1.00 73.13 C ATOM 3349 CG ASP B 99 2.260 -5.833 0.926 1.00 40.11 C ATOM 3350 OD1 ASP B 99 1.919 -7.038 0.881 1.00 44.33 O ATOM 3351 OD2 ASP B 99 1.433 -4.922 0.711 1.00 41.43 O ATOM 0 H ASP B 99 5.401 -2.841 1.670 1.00 62.22 H new ATOM 0 HA ASP B 99 3.249 -3.407 1.717 1.00 14.04 H new ATOM 0 HB2 ASP B 99 4.260 -5.285 0.319 1.00 73.13 H new ATOM 0 HB3 ASP B 99 4.203 -6.300 1.746 1.00 73.13 H new ATOM 3356 N ILE B 100 3.761 -3.541 4.525 1.00 73.34 N ATOM 3357 CA ILE B 100 3.327 -3.581 5.931 1.00 24.32 C ATOM 3358 C ILE B 100 1.983 -2.850 6.066 1.00 73.13 C ATOM 3359 O ILE B 100 1.940 -1.621 6.003 1.00 21.20 O ATOM 3360 CB ILE B 100 4.393 -2.932 6.894 1.00 50.41 C ATOM 3361 CG1 ILE B 100 5.787 -3.573 6.653 1.00 64.10 C ATOM 3362 CG2 ILE B 100 3.967 -3.085 8.377 1.00 1.14 C ATOM 3363 CD1 ILE B 100 6.915 -3.015 7.501 1.00 53.30 C ATOM 0 H ILE B 100 4.437 -2.804 4.323 1.00 73.34 H new ATOM 0 HA ILE B 100 3.217 -4.625 6.224 1.00 24.32 H new ATOM 0 HB ILE B 100 4.455 -1.866 6.674 1.00 50.41 H new ATOM 0 HG12 ILE B 100 5.712 -4.645 6.838 1.00 64.10 H new ATOM 0 HG13 ILE B 100 6.049 -3.448 5.602 1.00 64.10 H new ATOM 0 HG21 ILE B 100 4.719 -2.629 9.021 1.00 1.14 H new ATOM 0 HG22 ILE B 100 3.008 -2.591 8.533 1.00 1.14 H new ATOM 0 HG23 ILE B 100 3.874 -4.143 8.621 1.00 1.14 H new ATOM 0 HD11 ILE B 100 7.844 -3.530 7.255 1.00 53.30 H new ATOM 0 HD12 ILE B 100 7.027 -1.949 7.302 1.00 53.30 H new ATOM 0 HD13 ILE B 100 6.685 -3.164 8.556 1.00 53.30 H new ATOM 3375 N LYS B 101 0.895 -3.628 6.243 1.00 72.12 N ATOM 3376 CA LYS B 101 -0.486 -3.101 6.337 1.00 71.55 C ATOM 3377 C LYS B 101 -0.682 -2.157 7.567 1.00 32.21 C ATOM 3378 O LYS B 101 -1.229 -1.073 7.378 1.00 24.01 O ATOM 3379 CB LYS B 101 -1.551 -4.247 6.351 1.00 34.25 C ATOM 3380 CG LYS B 101 -1.741 -5.020 5.018 1.00 64.01 C ATOM 3381 CD LYS B 101 -0.594 -6.009 4.695 1.00 33.25 C ATOM 3382 CE LYS B 101 -0.769 -6.681 3.325 1.00 44.23 C ATOM 3383 NZ LYS B 101 -0.805 -5.679 2.235 1.00 61.13 N ATOM 0 H LYS B 101 0.948 -4.643 6.325 1.00 72.12 H new ATOM 0 HA LYS B 101 -0.641 -2.506 5.437 1.00 71.55 H new ATOM 0 HB2 LYS B 101 -1.275 -4.962 7.126 1.00 34.25 H new ATOM 0 HB3 LYS B 101 -2.511 -3.819 6.639 1.00 34.25 H new ATOM 0 HG2 LYS B 101 -2.681 -5.571 5.060 1.00 64.01 H new ATOM 0 HG3 LYS B 101 -1.828 -4.302 4.203 1.00 64.01 H new ATOM 0 HD2 LYS B 101 0.357 -5.478 4.717 1.00 33.25 H new ATOM 0 HD3 LYS B 101 -0.549 -6.775 5.469 1.00 33.25 H new ATOM 0 HE2 LYS B 101 0.050 -7.379 3.153 1.00 44.23 H new ATOM 0 HE3 LYS B 101 -1.691 -7.263 3.318 1.00 44.23 H new ATOM 0 HZ1 LYS B 101 -0.873 -6.166 1.318 1.00 61.13 H new ATOM 0 HZ2 LYS B 101 -1.631 -5.059 2.360 1.00 61.13 H new ATOM 0 HZ3 LYS B 101 0.064 -5.107 2.260 1.00 61.13 H new ATOM 3397 N PRO B 102 -0.258 -2.531 8.852 1.00 13.03 N ATOM 3398 CA PRO B 102 -0.391 -1.615 10.025 1.00 40.53 C ATOM 3399 C PRO B 102 0.321 -0.250 9.829 1.00 34.55 C ATOM 3400 O PRO B 102 -0.215 0.783 10.231 1.00 44.04 O ATOM 3401 CB PRO B 102 0.226 -2.419 11.217 1.00 12.33 C ATOM 3402 CG PRO B 102 1.026 -3.518 10.583 1.00 14.32 C ATOM 3403 CD PRO B 102 0.322 -3.846 9.283 1.00 52.15 C ATOM 0 HA PRO B 102 -1.433 -1.341 10.190 1.00 40.53 H new ATOM 0 HB2 PRO B 102 0.856 -1.781 11.837 1.00 12.33 H new ATOM 0 HB3 PRO B 102 -0.553 -2.823 11.864 1.00 12.33 H new ATOM 0 HG2 PRO B 102 2.053 -3.199 10.402 1.00 14.32 H new ATOM 0 HG3 PRO B 102 1.073 -4.392 11.233 1.00 14.32 H new ATOM 0 HD2 PRO B 102 1.015 -4.241 8.540 1.00 52.15 H new ATOM 0 HD3 PRO B 102 -0.454 -4.598 9.426 1.00 52.15 H new ATOM 3411 N LEU B 103 1.511 -0.256 9.189 1.00 70.33 N ATOM 3412 CA LEU B 103 2.296 0.977 8.938 1.00 62.33 C ATOM 3413 C LEU B 103 1.566 1.834 7.889 1.00 60.10 C ATOM 3414 O LEU B 103 1.276 3.012 8.123 1.00 55.40 O ATOM 3415 CB LEU B 103 3.743 0.615 8.445 1.00 72.50 C ATOM 3416 CG LEU B 103 4.896 1.665 8.687 1.00 72.33 C ATOM 3417 CD1 LEU B 103 4.694 3.018 7.951 1.00 30.41 C ATOM 3418 CD2 LEU B 103 5.110 1.884 10.192 1.00 4.31 C ATOM 0 H LEU B 103 1.952 -1.105 8.835 1.00 70.33 H new ATOM 0 HA LEU B 103 2.389 1.543 9.865 1.00 62.33 H new ATOM 0 HB2 LEU B 103 4.035 -0.318 8.927 1.00 72.50 H new ATOM 0 HB3 LEU B 103 3.691 0.418 7.374 1.00 72.50 H new ATOM 0 HG LEU B 103 5.794 1.231 8.248 1.00 72.33 H new ATOM 0 HD11 LEU B 103 5.531 3.681 8.172 1.00 30.41 H new ATOM 0 HD12 LEU B 103 4.643 2.843 6.876 1.00 30.41 H new ATOM 0 HD13 LEU B 103 3.766 3.481 8.288 1.00 30.41 H new ATOM 0 HD21 LEU B 103 5.908 2.611 10.344 1.00 4.31 H new ATOM 0 HD22 LEU B 103 4.189 2.257 10.640 1.00 4.31 H new ATOM 0 HD23 LEU B 103 5.385 0.940 10.662 1.00 4.31 H new ATOM 3430 N LEU B 104 1.244 1.182 6.758 1.00 52.13 N ATOM 3431 CA LEU B 104 0.676 1.828 5.565 1.00 70.12 C ATOM 3432 C LEU B 104 -0.673 2.482 5.875 1.00 74.41 C ATOM 3433 O LEU B 104 -0.907 3.632 5.503 1.00 62.53 O ATOM 3434 CB LEU B 104 0.522 0.781 4.427 1.00 63.10 C ATOM 3435 CG LEU B 104 0.039 1.307 3.037 1.00 54.25 C ATOM 3436 CD1 LEU B 104 0.988 2.396 2.474 1.00 55.10 C ATOM 3437 CD2 LEU B 104 -0.116 0.130 2.047 1.00 13.43 C ATOM 0 H LEU B 104 1.374 0.176 6.647 1.00 52.13 H new ATOM 0 HA LEU B 104 1.358 2.615 5.242 1.00 70.12 H new ATOM 0 HB2 LEU B 104 1.485 0.289 4.287 1.00 63.10 H new ATOM 0 HB3 LEU B 104 -0.180 0.017 4.762 1.00 63.10 H new ATOM 0 HG LEU B 104 -0.935 1.777 3.172 1.00 54.25 H new ATOM 0 HD11 LEU B 104 0.618 2.736 1.507 1.00 55.10 H new ATOM 0 HD12 LEU B 104 1.026 3.238 3.165 1.00 55.10 H new ATOM 0 HD13 LEU B 104 1.988 1.980 2.354 1.00 55.10 H new ATOM 0 HD21 LEU B 104 -0.453 0.508 1.082 1.00 13.43 H new ATOM 0 HD22 LEU B 104 0.844 -0.372 1.925 1.00 13.43 H new ATOM 0 HD23 LEU B 104 -0.848 -0.578 2.435 1.00 13.43 H new ATOM 3449 N ASP B 105 -1.519 1.739 6.608 1.00 53.14 N ATOM 3450 CA ASP B 105 -2.893 2.157 6.926 1.00 62.20 C ATOM 3451 C ASP B 105 -2.880 3.394 7.839 1.00 61.53 C ATOM 3452 O ASP B 105 -3.549 4.377 7.544 1.00 4.33 O ATOM 3453 CB ASP B 105 -3.688 0.995 7.581 1.00 33.12 C ATOM 3454 CG ASP B 105 -5.186 1.320 7.726 1.00 31.32 C ATOM 3455 OD1 ASP B 105 -5.927 1.196 6.723 1.00 13.23 O ATOM 3456 OD2 ASP B 105 -5.628 1.749 8.818 1.00 1.33 O ATOM 0 H ASP B 105 -1.268 0.830 6.997 1.00 53.14 H new ATOM 0 HA ASP B 105 -3.394 2.422 5.995 1.00 62.20 H new ATOM 0 HB2 ASP B 105 -3.571 0.093 6.980 1.00 33.12 H new ATOM 0 HB3 ASP B 105 -3.269 0.780 8.564 1.00 33.12 H new ATOM 3461 N VAL B 106 -2.076 3.341 8.920 1.00 1.40 N ATOM 3462 CA VAL B 106 -1.932 4.457 9.886 1.00 62.43 C ATOM 3463 C VAL B 106 -1.439 5.747 9.184 1.00 65.20 C ATOM 3464 O VAL B 106 -1.993 6.830 9.404 1.00 22.31 O ATOM 3465 CB VAL B 106 -0.961 4.047 11.070 1.00 73.34 C ATOM 3466 CG1 VAL B 106 -0.499 5.253 11.934 1.00 12.33 C ATOM 3467 CG2 VAL B 106 -1.622 2.966 11.961 1.00 41.12 C ATOM 0 H VAL B 106 -1.508 2.526 9.151 1.00 1.40 H new ATOM 0 HA VAL B 106 -2.915 4.667 10.308 1.00 62.43 H new ATOM 0 HB VAL B 106 -0.063 3.639 10.605 1.00 73.34 H new ATOM 0 HG11 VAL B 106 0.163 4.901 12.725 1.00 12.33 H new ATOM 0 HG12 VAL B 106 0.034 5.967 11.306 1.00 12.33 H new ATOM 0 HG13 VAL B 106 -1.369 5.738 12.377 1.00 12.33 H new ATOM 0 HG21 VAL B 106 -0.943 2.695 12.769 1.00 41.12 H new ATOM 0 HG22 VAL B 106 -2.548 3.358 12.381 1.00 41.12 H new ATOM 0 HG23 VAL B 106 -1.841 2.083 11.360 1.00 41.12 H new ATOM 3477 N THR B 107 -0.432 5.600 8.307 1.00 14.14 N ATOM 3478 CA THR B 107 0.196 6.729 7.587 1.00 54.31 C ATOM 3479 C THR B 107 -0.730 7.288 6.459 1.00 74.23 C ATOM 3480 O THR B 107 -0.699 8.491 6.153 1.00 34.14 O ATOM 3481 CB THR B 107 1.587 6.283 7.022 1.00 31.20 C ATOM 3482 OG1 THR B 107 2.360 5.694 8.085 1.00 0.11 O ATOM 3483 CG2 THR B 107 2.395 7.447 6.435 1.00 53.21 C ATOM 0 H THR B 107 -0.027 4.693 8.074 1.00 14.14 H new ATOM 0 HA THR B 107 0.349 7.546 8.292 1.00 54.31 H new ATOM 0 HB THR B 107 1.390 5.572 6.220 1.00 31.20 H new ATOM 0 HG1 THR B 107 2.054 4.776 8.242 1.00 0.11 H new ATOM 0 HG21 THR B 107 3.348 7.075 6.060 1.00 53.21 H new ATOM 0 HG22 THR B 107 1.836 7.902 5.618 1.00 53.21 H new ATOM 0 HG23 THR B 107 2.576 8.192 7.210 1.00 53.21 H new ATOM 3491 N CYS B 108 -1.560 6.409 5.859 1.00 14.44 N ATOM 3492 CA CYS B 108 -2.573 6.809 4.847 1.00 64.34 C ATOM 3493 C CYS B 108 -3.786 7.481 5.525 1.00 2.13 C ATOM 3494 O CYS B 108 -4.468 8.313 4.922 1.00 61.03 O ATOM 3495 CB CYS B 108 -3.025 5.593 4.006 1.00 4.04 C ATOM 3496 SG CYS B 108 -1.709 4.879 2.994 1.00 4.45 S ATOM 0 H CYS B 108 -1.551 5.408 6.057 1.00 14.44 H new ATOM 0 HA CYS B 108 -2.110 7.532 4.175 1.00 64.34 H new ATOM 0 HB2 CYS B 108 -3.414 4.825 4.674 1.00 4.04 H new ATOM 0 HB3 CYS B 108 -3.846 5.897 3.357 1.00 4.04 H new ATOM 0 HG CYS B 108 -0.951 4.127 3.735 1.00 4.45 H new ATOM 3502 N LYS B 109 -4.058 7.081 6.777 1.00 63.12 N ATOM 3503 CA LYS B 109 -5.112 7.688 7.613 1.00 55.32 C ATOM 3504 C LYS B 109 -4.652 9.055 8.145 1.00 33.45 C ATOM 3505 O LYS B 109 -5.485 9.919 8.382 1.00 43.43 O ATOM 3506 CB LYS B 109 -5.578 6.716 8.754 1.00 41.41 C ATOM 3507 CG LYS B 109 -6.783 5.797 8.374 1.00 22.13 C ATOM 3508 CD LYS B 109 -6.571 5.005 7.058 1.00 11.44 C ATOM 3509 CE LYS B 109 -7.784 4.147 6.667 1.00 25.45 C ATOM 3510 NZ LYS B 109 -8.081 3.102 7.677 1.00 14.33 N ATOM 0 H LYS B 109 -3.553 6.326 7.241 1.00 63.12 H new ATOM 0 HA LYS B 109 -5.991 7.861 6.992 1.00 55.32 H new ATOM 0 HB2 LYS B 109 -4.736 6.087 9.044 1.00 41.41 H new ATOM 0 HB3 LYS B 109 -5.851 7.307 9.628 1.00 41.41 H new ATOM 0 HG2 LYS B 109 -6.962 5.093 9.187 1.00 22.13 H new ATOM 0 HG3 LYS B 109 -7.680 6.409 8.279 1.00 22.13 H new ATOM 0 HD2 LYS B 109 -6.354 5.705 6.251 1.00 11.44 H new ATOM 0 HD3 LYS B 109 -5.698 4.361 7.165 1.00 11.44 H new ATOM 0 HE2 LYS B 109 -8.656 4.789 6.544 1.00 25.45 H new ATOM 0 HE3 LYS B 109 -7.597 3.675 5.703 1.00 25.45 H new ATOM 0 HZ1 LYS B 109 -8.381 2.230 7.196 1.00 14.33 H new ATOM 0 HZ2 LYS B 109 -7.228 2.911 8.240 1.00 14.33 H new ATOM 0 HZ3 LYS B 109 -8.843 3.432 8.304 1.00 14.33 H new ATOM 3524 N THR B 110 -3.323 9.230 8.320 1.00 73.32 N ATOM 3525 CA THR B 110 -2.719 10.516 8.709 1.00 33.21 C ATOM 3526 C THR B 110 -3.091 11.632 7.702 1.00 64.40 C ATOM 3527 O THR B 110 -3.643 12.670 8.097 1.00 20.04 O ATOM 3528 CB THR B 110 -1.164 10.387 8.806 1.00 64.53 C ATOM 3529 OG1 THR B 110 -0.812 9.366 9.751 1.00 61.23 O ATOM 3530 CG2 THR B 110 -0.494 11.710 9.206 1.00 74.01 C ATOM 0 H THR B 110 -2.642 8.481 8.195 1.00 73.32 H new ATOM 0 HA THR B 110 -3.115 10.786 9.688 1.00 33.21 H new ATOM 0 HB THR B 110 -0.801 10.118 7.814 1.00 64.53 H new ATOM 0 HG1 THR B 110 -1.207 8.513 9.474 1.00 61.23 H new ATOM 0 HG21 THR B 110 0.586 11.569 9.260 1.00 74.01 H new ATOM 0 HG22 THR B 110 -0.724 12.473 8.463 1.00 74.01 H new ATOM 0 HG23 THR B 110 -0.868 12.027 10.179 1.00 74.01 H new ATOM 3538 N VAL B 111 -2.821 11.385 6.393 1.00 43.44 N ATOM 3539 CA VAL B 111 -3.164 12.351 5.321 1.00 42.33 C ATOM 3540 C VAL B 111 -4.689 12.490 5.180 1.00 73.43 C ATOM 3541 O VAL B 111 -5.181 13.593 4.938 1.00 53.43 O ATOM 3542 CB VAL B 111 -2.514 12.002 3.919 1.00 41.30 C ATOM 3543 CG1 VAL B 111 -0.986 12.223 3.934 1.00 70.42 C ATOM 3544 CG2 VAL B 111 -2.854 10.564 3.466 1.00 71.02 C ATOM 0 H VAL B 111 -2.371 10.533 6.059 1.00 43.44 H new ATOM 0 HA VAL B 111 -2.737 13.305 5.631 1.00 42.33 H new ATOM 0 HB VAL B 111 -2.949 12.688 3.192 1.00 41.30 H new ATOM 0 HG11 VAL B 111 -0.573 11.974 2.957 1.00 70.42 H new ATOM 0 HG12 VAL B 111 -0.772 13.267 4.163 1.00 70.42 H new ATOM 0 HG13 VAL B 111 -0.533 11.584 4.693 1.00 70.42 H new ATOM 0 HG21 VAL B 111 -2.388 10.367 2.500 1.00 71.02 H new ATOM 0 HG22 VAL B 111 -2.479 9.853 4.202 1.00 71.02 H new ATOM 0 HG23 VAL B 111 -3.935 10.457 3.376 1.00 71.02 H new ATOM 3554 N ALA B 112 -5.416 11.368 5.383 1.00 45.52 N ATOM 3555 CA ALA B 112 -6.889 11.335 5.315 1.00 33.44 C ATOM 3556 C ALA B 112 -7.526 12.246 6.386 1.00 42.25 C ATOM 3557 O ALA B 112 -8.551 12.875 6.135 1.00 23.34 O ATOM 3558 CB ALA B 112 -7.398 9.894 5.457 1.00 11.43 C ATOM 0 H ALA B 112 -4.996 10.464 5.598 1.00 45.52 H new ATOM 0 HA ALA B 112 -7.187 11.718 4.339 1.00 33.44 H new ATOM 0 HB1 ALA B 112 -8.487 9.886 5.405 1.00 11.43 H new ATOM 0 HB2 ALA B 112 -6.992 9.283 4.651 1.00 11.43 H new ATOM 0 HB3 ALA B 112 -7.078 9.488 6.416 1.00 11.43 H new ATOM 3564 N ASN B 113 -6.886 12.312 7.570 1.00 62.33 N ATOM 3565 CA ASN B 113 -7.343 13.161 8.691 1.00 54.01 C ATOM 3566 C ASN B 113 -7.076 14.644 8.391 1.00 3.34 C ATOM 3567 O ASN B 113 -7.946 15.489 8.626 1.00 52.15 O ATOM 3568 CB ASN B 113 -6.643 12.753 10.025 1.00 43.01 C ATOM 3569 CG ASN B 113 -7.079 11.389 10.565 1.00 63.34 C ATOM 3570 OD1 ASN B 113 -8.225 10.978 10.396 1.00 32.02 O ATOM 3571 ND2 ASN B 113 -6.165 10.677 11.221 1.00 51.32 N ATOM 0 H ASN B 113 -6.040 11.781 7.777 1.00 62.33 H new ATOM 0 HA ASN B 113 -8.417 13.012 8.805 1.00 54.01 H new ATOM 0 HB2 ASN B 113 -5.564 12.743 9.869 1.00 43.01 H new ATOM 0 HB3 ASN B 113 -6.849 13.513 10.779 1.00 43.01 H new ATOM 0 HD21 ASN B 113 -6.407 9.762 11.600 1.00 51.32 H new ATOM 0 HD22 ASN B 113 -5.222 11.047 11.344 1.00 51.32 H new ATOM 3578 N MET B 114 -5.874 14.944 7.859 1.00 15.51 N ATOM 3579 CA MET B 114 -5.428 16.336 7.597 1.00 70.01 C ATOM 3580 C MET B 114 -6.323 17.033 6.555 1.00 32.11 C ATOM 3581 O MET B 114 -6.627 18.224 6.683 1.00 14.43 O ATOM 3582 CB MET B 114 -3.943 16.379 7.135 1.00 31.23 C ATOM 3583 CG MET B 114 -2.927 15.886 8.176 1.00 74.42 C ATOM 3584 SD MET B 114 -1.213 16.246 7.717 1.00 23.44 S ATOM 3585 CE MET B 114 -1.047 15.427 6.129 1.00 3.24 C ATOM 0 H MET B 114 -5.186 14.237 7.599 1.00 15.51 H new ATOM 0 HA MET B 114 -5.514 16.877 8.539 1.00 70.01 H new ATOM 0 HB2 MET B 114 -3.840 15.774 6.234 1.00 31.23 H new ATOM 0 HB3 MET B 114 -3.692 17.404 6.861 1.00 31.23 H new ATOM 0 HG2 MET B 114 -3.145 16.351 9.137 1.00 74.42 H new ATOM 0 HG3 MET B 114 -3.044 14.810 8.308 1.00 74.42 H new ATOM 0 HE1 MET B 114 -0.141 15.775 5.633 1.00 3.24 H new ATOM 0 HE2 MET B 114 -0.987 14.349 6.280 1.00 3.24 H new ATOM 0 HE3 MET B 114 -1.912 15.659 5.508 1.00 3.24 H new ATOM 3595 N ILE B 115 -6.734 16.273 5.526 1.00 4.31 N ATOM 3596 CA ILE B 115 -7.571 16.798 4.428 1.00 34.32 C ATOM 3597 C ILE B 115 -9.059 16.812 4.818 1.00 34.23 C ATOM 3598 O ILE B 115 -9.823 17.644 4.320 1.00 61.05 O ATOM 3599 CB ILE B 115 -7.358 15.987 3.096 1.00 32.53 C ATOM 3600 CG1 ILE B 115 -7.777 14.490 3.264 1.00 40.55 C ATOM 3601 CG2 ILE B 115 -5.889 16.109 2.628 1.00 32.12 C ATOM 3602 CD1 ILE B 115 -7.564 13.616 2.040 1.00 45.54 C ATOM 0 H ILE B 115 -6.499 15.285 5.430 1.00 4.31 H new ATOM 0 HA ILE B 115 -7.255 17.825 4.248 1.00 34.32 H new ATOM 0 HB ILE B 115 -8.002 16.415 2.328 1.00 32.53 H new ATOM 0 HG12 ILE B 115 -7.217 14.064 4.096 1.00 40.55 H new ATOM 0 HG13 ILE B 115 -8.831 14.453 3.538 1.00 40.55 H new ATOM 0 HG21 ILE B 115 -5.753 15.544 1.706 1.00 32.12 H new ATOM 0 HG22 ILE B 115 -5.650 17.157 2.450 1.00 32.12 H new ATOM 0 HG23 ILE B 115 -5.228 15.712 3.398 1.00 32.12 H new ATOM 0 HD11 ILE B 115 -7.885 12.598 2.260 1.00 45.54 H new ATOM 0 HD12 ILE B 115 -8.147 14.009 1.207 1.00 45.54 H new ATOM 0 HD13 ILE B 115 -6.507 13.613 1.774 1.00 45.54 H new ATOM 3614 N ARG B 116 -9.463 15.881 5.708 1.00 75.44 N ATOM 3615 CA ARG B 116 -10.849 15.804 6.201 1.00 24.33 C ATOM 3616 C ARG B 116 -11.055 16.848 7.315 1.00 41.41 C ATOM 3617 O ARG B 116 -10.670 16.618 8.470 1.00 50.12 O ATOM 3618 CB ARG B 116 -11.180 14.377 6.727 1.00 4.02 C ATOM 3619 CG ARG B 116 -12.674 14.150 7.146 1.00 22.01 C ATOM 3620 CD ARG B 116 -12.829 13.476 8.524 1.00 10.20 C ATOM 3621 NE ARG B 116 -12.308 14.329 9.607 1.00 42.43 N ATOM 3622 CZ ARG B 116 -12.391 14.061 10.918 1.00 20.50 C ATOM 3623 NH1 ARG B 116 -12.974 12.945 11.362 1.00 4.35 N ATOM 3624 NH2 ARG B 116 -11.893 14.927 11.789 1.00 50.24 N ATOM 0 H ARG B 116 -8.844 15.171 6.099 1.00 75.44 H new ATOM 0 HA ARG B 116 -11.526 16.017 5.374 1.00 24.33 H new ATOM 0 HB2 ARG B 116 -10.922 13.653 5.954 1.00 4.02 H new ATOM 0 HB3 ARG B 116 -10.543 14.167 7.586 1.00 4.02 H new ATOM 0 HG2 ARG B 116 -13.189 15.110 7.160 1.00 22.01 H new ATOM 0 HG3 ARG B 116 -13.165 13.535 6.392 1.00 22.01 H new ATOM 0 HD2 ARG B 116 -13.881 13.257 8.706 1.00 10.20 H new ATOM 0 HD3 ARG B 116 -12.301 12.523 8.525 1.00 10.20 H new ATOM 0 HE ARG B 116 -11.845 15.197 9.336 1.00 42.43 H new ATOM 0 HH11 ARG B 116 -13.367 12.277 10.699 1.00 4.35 H new ATOM 0 HH12 ARG B 116 -13.026 12.761 12.364 1.00 4.35 H new ATOM 0 HH21 ARG B 116 -11.453 15.786 11.459 1.00 50.24 H new ATOM 0 HH22 ARG B 116 -11.950 14.734 12.789 1.00 50.24 H new ATOM 3638 N GLY B 117 -11.607 18.006 6.930 1.00 52.44 N ATOM 3639 CA GLY B 117 -11.985 19.057 7.886 1.00 75.12 C ATOM 3640 C GLY B 117 -13.141 18.653 8.818 1.00 4.20 C ATOM 3641 O GLY B 117 -14.006 17.850 8.404 1.00 65.30 O ATOM 3642 OXT GLY B 117 -13.184 19.144 9.966 1.00 37.09 O ATOM 0 H GLY B 117 -11.803 18.240 5.957 1.00 52.44 H new ATOM 0 HA2 GLY B 117 -11.116 19.317 8.490 1.00 75.12 H new ATOM 0 HA3 GLY B 117 -12.270 19.953 7.335 1.00 75.12 H new TER 3646 GLY B 117