USER MOD reduce.3.24.130724 H: found=0, std=0, add=1411, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1411 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 19 GLN : amide:sc= -0.179 K(o=-0.4,f=-5.6!) USER MOD Set 1.2: A 20 LYS NZ :NH3+ -160:sc= -0.22 (180deg=-0.391) USER MOD Set 2.1: A 5 ASN : amide:sc= 3.03 K(o=0.26,f=-10!) USER MOD Set 2.2: A 135 ASN : amide:sc= -2.78! C(o=0.26!,f=-17!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 157:sc= 1.33 (180deg=1.19) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0966 USER MOD Single : A 3 GLN : amide:sc= -0.0768 K(o=-0.077,f=-0.79) USER MOD Single : A 4 SER OG : rot 26:sc= -0.533 USER MOD Single : A 14 SER OG : rot 180:sc= -0.0484 USER MOD Single : A 15 TYR OH : rot 180:sc= 0.647 USER MOD Single : A 16 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.032) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0.00284 USER MOD Single : A 26 GLN : amide:sc= -1.01 K(o=-1,f=-0.032) USER MOD Single : A 28 SER OG : rot 70:sc= 0.539 USER MOD Single : A 33 ASN : amide:sc= -1.16 K(o=-1.2,f=-1.9) USER MOD Single : A 35 THR OG1 : rot 48:sc= 0.282 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.00667 USER MOD Single : A 43 SER OG : rot -106:sc= -0.116 USER MOD Single : A 47 LYS NZ :NH3+ -121:sc= 0.198 (180deg=-1.32!) USER MOD Single : A 48 GLN : amide:sc= 1.17 K(o=1.2,f=-0.2) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 75:sc= 0.287 USER MOD Single : A 69 THR OG1 : rot -87:sc= 1.26 USER MOD Single : A 70 SER OG : rot 77:sc= 0.0114 USER MOD Single : A 71 GLN : amide:sc= -3.02! K(o=-3!,f=-0.76) USER MOD Single : A 73 HIS : no HD1:sc= -0.199 X(o=-0.2,f=-0.2) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot -150:sc= -0.589 USER MOD Single : A 80 TYR OH : rot -122:sc= 1.2 USER MOD Single : A 81 GLN : amide:sc= -0.184 K(o=-0.18,f=-0.92) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= 0.143 X(o=0.14,f=-0.21) USER MOD Single : A 88 ASN : amide:sc= -0.0149 K(o=-0.015,f=-0.91) USER MOD Single : A 96 ASN : amide:sc= -1.2! K(o=-1.2!,f=-0.044) USER MOD Single : A 105 SER OG : rot 87:sc= 1.23 USER MOD Single : A 111 CYS SG : rot 71:sc= -3.92! USER MOD Single : A 114 SER OG : rot 67:sc= -1.15! USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 MET CE :methyl -137:sc= -4.91! (180deg=-9.62!) USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 130 MET CE :methyl 177:sc= -2.63 (180deg=-2.88!) USER MOD Single : A 132 THR OG1 : rot 72:sc= 1.33 USER MOD Single : A 133 TYR OH : rot 90:sc= -0.321 USER MOD Single : A 137 HIS : no HD1:sc= -0.146 X(o=-0.15,f=-0.002) USER MOD Single : A 143 GLN : amide:sc= -0.224 X(o=-0.22,f=-0.36) USER MOD Single : A 145 ASN : amide:sc= 1.18 K(o=1.2,f=-0.0078) USER MOD Single : A 150 THR OG1 : rot -119:sc= 0.0297 USER MOD Single : A 155 TYR OH : rot -161:sc= 1.22 USER MOD Single : A 157 ASN : amide:sc= -0.71 K(o=-0.71,f=0) USER MOD Single : A 158 ASN : amide:sc= -0.0153 X(o=-0.015,f=0) USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 165 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 GLN : amide:sc= -0.265 X(o=-0.26,f=-0.12) USER MOD Single : A 172 HIS : no HD1:sc= -0.753 K(o=-0.75,f=0.21) USER MOD Single : A 173 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 174 HIS : no HD1:sc= -0.0478 X(o=-0.048,f=0.00087) USER MOD Single : A 175 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 176 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 177 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 180 HIS : no HD1:sc= -0.392 K(o=-0.39,f=-1.1) USER MOD Single : A 181 HIS : no HD1:sc= 0.654 K(o=0.65,f=-4.3!) USER MOD Single : A 182 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 183 HIS : no HD1:sc= 0 X(o=0,f=-0.0034) USER MOD Single : A 184 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 185 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.792 5.791 12.450 1.00 3.19 N ATOM 2 CA MET A 1 4.690 5.334 13.535 1.00 2.85 C ATOM 3 C MET A 1 5.608 4.223 13.027 1.00 2.27 C ATOM 4 O MET A 1 5.199 3.404 12.208 1.00 2.72 O ATOM 5 CB MET A 1 3.875 4.846 14.736 1.00 3.07 C ATOM 6 CG MET A 1 4.728 4.495 15.944 1.00 3.85 C ATOM 7 SD MET A 1 5.772 5.870 16.469 1.00 4.63 S ATOM 8 CE MET A 1 6.673 5.119 17.822 1.00 5.45 C ATOM 0 H1 MET A 1 2.946 6.233 12.863 1.00 3.19 H new ATOM 0 H2 MET A 1 4.290 6.484 11.856 1.00 3.19 H new ATOM 0 H3 MET A 1 3.509 4.977 11.868 1.00 3.19 H new ATOM 0 HA MET A 1 5.304 6.175 13.856 1.00 2.85 H new ATOM 0 HB2 MET A 1 3.160 5.619 15.018 1.00 3.07 H new ATOM 0 HB3 MET A 1 3.298 3.970 14.442 1.00 3.07 H new ATOM 0 HG2 MET A 1 4.081 4.198 16.769 1.00 3.85 H new ATOM 0 HG3 MET A 1 5.355 3.636 15.706 1.00 3.85 H new ATOM 0 HE1 MET A 1 7.361 5.848 18.250 1.00 5.45 H new ATOM 0 HE2 MET A 1 5.971 4.789 18.588 1.00 5.45 H new ATOM 0 HE3 MET A 1 7.236 4.262 17.453 1.00 5.45 H new ATOM 20 N SER A 2 6.832 4.189 13.542 1.00 1.75 N ATOM 21 CA SER A 2 7.886 3.315 13.030 1.00 1.66 C ATOM 22 C SER A 2 7.475 1.839 12.932 1.00 1.36 C ATOM 23 O SER A 2 7.555 1.241 11.855 1.00 1.24 O ATOM 24 CB SER A 2 9.124 3.472 13.911 1.00 2.18 C ATOM 25 OG SER A 2 8.753 3.889 15.217 1.00 2.93 O ATOM 0 H SER A 2 7.124 4.768 14.329 1.00 1.75 H new ATOM 0 HA SER A 2 8.097 3.624 12.006 1.00 1.66 H new ATOM 0 HB2 SER A 2 9.663 2.526 13.964 1.00 2.18 H new ATOM 0 HB3 SER A 2 9.803 4.201 13.469 1.00 2.18 H new ATOM 0 HG SER A 2 9.556 3.984 15.771 1.00 2.93 H new ATOM 31 N GLN A 3 7.029 1.255 14.040 1.00 1.37 N ATOM 32 CA GLN A 3 6.733 -0.176 14.074 1.00 1.24 C ATOM 33 C GLN A 3 5.526 -0.526 13.200 1.00 0.92 C ATOM 34 O GLN A 3 5.544 -1.529 12.484 1.00 0.86 O ATOM 35 CB GLN A 3 6.520 -0.649 15.517 1.00 1.49 C ATOM 36 CG GLN A 3 6.129 -2.113 15.639 1.00 1.69 C ATOM 37 CD GLN A 3 7.107 -3.053 14.950 1.00 2.43 C ATOM 38 OE1 GLN A 3 8.303 -2.767 14.847 1.00 3.10 O ATOM 39 NE2 GLN A 3 6.603 -4.182 14.472 1.00 2.97 N ATOM 0 H GLN A 3 6.865 1.744 14.920 1.00 1.37 H new ATOM 0 HA GLN A 3 7.595 -0.701 13.662 1.00 1.24 H new ATOM 0 HB2 GLN A 3 7.437 -0.481 16.082 1.00 1.49 H new ATOM 0 HB3 GLN A 3 5.744 -0.037 15.978 1.00 1.49 H new ATOM 0 HG2 GLN A 3 6.062 -2.378 16.694 1.00 1.69 H new ATOM 0 HG3 GLN A 3 5.136 -2.254 15.211 1.00 1.69 H new ATOM 0 HE21 GLN A 3 5.608 -4.381 14.578 1.00 2.97 H new ATOM 0 HE22 GLN A 3 7.210 -4.851 13.999 1.00 2.97 H new ATOM 48 N SER A 4 4.498 0.309 13.233 1.00 0.88 N ATOM 49 CA SER A 4 3.298 0.057 12.445 1.00 0.77 C ATOM 50 C SER A 4 3.589 0.202 10.951 1.00 0.62 C ATOM 51 O SER A 4 2.970 -0.466 10.124 1.00 0.64 O ATOM 52 CB SER A 4 2.174 1.000 12.884 1.00 1.02 C ATOM 53 OG SER A 4 2.669 2.310 13.103 1.00 1.34 O ATOM 0 H SER A 4 4.469 1.161 13.792 1.00 0.88 H new ATOM 0 HA SER A 4 2.973 -0.969 12.619 1.00 0.77 H new ATOM 0 HB2 SER A 4 1.395 1.024 12.122 1.00 1.02 H new ATOM 0 HB3 SER A 4 1.714 0.623 13.798 1.00 1.02 H new ATOM 0 HG SER A 4 3.471 2.452 12.558 1.00 1.34 H new ATOM 59 N ASN A 5 4.551 1.057 10.610 1.00 0.59 N ATOM 60 CA ASN A 5 4.948 1.241 9.214 1.00 0.55 C ATOM 61 C ASN A 5 5.642 -0.003 8.672 1.00 0.43 C ATOM 62 O ASN A 5 5.416 -0.399 7.526 1.00 0.44 O ATOM 63 CB ASN A 5 5.874 2.450 9.055 1.00 0.65 C ATOM 64 CG ASN A 5 5.156 3.773 9.244 1.00 0.94 C ATOM 65 OD1 ASN A 5 3.957 3.886 8.998 1.00 1.71 O ATOM 66 ND2 ASN A 5 5.888 4.788 9.677 1.00 0.67 N ATOM 0 H ASN A 5 5.068 1.631 11.276 1.00 0.59 H new ATOM 0 HA ASN A 5 4.037 1.417 8.642 1.00 0.55 H new ATOM 0 HB2 ASN A 5 6.686 2.377 9.778 1.00 0.65 H new ATOM 0 HB3 ASN A 5 6.327 2.427 8.064 1.00 0.65 H new ATOM 0 HD21 ASN A 5 5.459 5.703 9.817 1.00 0.67 H new ATOM 0 HD22 ASN A 5 6.881 4.655 9.870 1.00 0.67 H new ATOM 73 N ARG A 6 6.483 -0.628 9.493 1.00 0.41 N ATOM 74 CA ARG A 6 7.192 -1.830 9.076 1.00 0.41 C ATOM 75 C ARG A 6 6.205 -2.959 8.806 1.00 0.37 C ATOM 76 O ARG A 6 6.415 -3.776 7.907 1.00 0.38 O ATOM 77 CB ARG A 6 8.215 -2.260 10.132 1.00 0.54 C ATOM 78 CG ARG A 6 9.084 -3.426 9.681 1.00 0.65 C ATOM 79 CD ARG A 6 10.147 -3.778 10.710 1.00 0.83 C ATOM 80 NE ARG A 6 10.981 -2.627 11.056 1.00 1.50 N ATOM 81 CZ ARG A 6 12.236 -2.455 10.636 1.00 2.14 C ATOM 82 NH1 ARG A 6 12.799 -3.333 9.810 1.00 2.16 N ATOM 83 NH2 ARG A 6 12.920 -1.390 11.030 1.00 3.18 N ATOM 0 H ARG A 6 6.688 -0.323 10.444 1.00 0.41 H new ATOM 0 HA ARG A 6 7.730 -1.604 8.155 1.00 0.41 H new ATOM 0 HB2 ARG A 6 8.854 -1.412 10.377 1.00 0.54 H new ATOM 0 HB3 ARG A 6 7.690 -2.538 11.046 1.00 0.54 H new ATOM 0 HG2 ARG A 6 8.455 -4.297 9.498 1.00 0.65 H new ATOM 0 HG3 ARG A 6 9.564 -3.175 8.735 1.00 0.65 H new ATOM 0 HD2 ARG A 6 9.667 -4.161 11.610 1.00 0.83 H new ATOM 0 HD3 ARG A 6 10.777 -4.578 10.321 1.00 0.83 H new ATOM 0 HE ARG A 6 10.577 -1.909 11.657 1.00 1.50 H new ATOM 0 HH11 ARG A 6 12.271 -4.146 9.492 1.00 2.16 H new ATOM 0 HH12 ARG A 6 13.759 -3.193 9.494 1.00 2.16 H new ATOM 0 HH21 ARG A 6 12.487 -0.707 11.651 1.00 3.18 H new ATOM 0 HH22 ARG A 6 13.880 -1.254 10.712 1.00 3.18 H new ATOM 97 N GLU A 7 5.117 -2.982 9.576 1.00 0.36 N ATOM 98 CA GLU A 7 4.057 -3.963 9.372 1.00 0.37 C ATOM 99 C GLU A 7 3.491 -3.829 7.973 1.00 0.29 C ATOM 100 O GLU A 7 3.295 -4.815 7.272 1.00 0.29 O ATOM 101 CB GLU A 7 2.920 -3.767 10.379 1.00 0.46 C ATOM 102 CG GLU A 7 3.300 -4.041 11.822 1.00 0.60 C ATOM 103 CD GLU A 7 2.111 -3.924 12.749 1.00 1.39 C ATOM 104 OE1 GLU A 7 1.121 -4.658 12.543 1.00 1.58 O ATOM 105 OE2 GLU A 7 2.153 -3.092 13.679 1.00 2.00 O ATOM 0 H GLU A 7 4.949 -2.333 10.345 1.00 0.36 H new ATOM 0 HA GLU A 7 4.491 -4.953 9.512 1.00 0.37 H new ATOM 0 HB2 GLU A 7 2.556 -2.743 10.301 1.00 0.46 H new ATOM 0 HB3 GLU A 7 2.092 -4.421 10.105 1.00 0.46 H new ATOM 0 HG2 GLU A 7 3.726 -5.041 11.902 1.00 0.60 H new ATOM 0 HG3 GLU A 7 4.074 -3.339 12.133 1.00 0.60 H new ATOM 112 N LEU A 8 3.267 -2.589 7.570 1.00 0.27 N ATOM 113 CA LEU A 8 2.639 -2.288 6.297 1.00 0.28 C ATOM 114 C LEU A 8 3.505 -2.774 5.153 1.00 0.28 C ATOM 115 O LEU A 8 3.005 -3.290 4.161 1.00 0.39 O ATOM 116 CB LEU A 8 2.412 -0.784 6.183 1.00 0.31 C ATOM 117 CG LEU A 8 1.692 -0.167 7.372 1.00 0.33 C ATOM 118 CD1 LEU A 8 1.617 1.340 7.221 1.00 0.36 C ATOM 119 CD2 LEU A 8 0.307 -0.774 7.516 1.00 0.35 C ATOM 0 H LEU A 8 3.516 -1.764 8.117 1.00 0.27 H new ATOM 0 HA LEU A 8 1.679 -2.802 6.244 1.00 0.28 H new ATOM 0 HB2 LEU A 8 3.377 -0.291 6.062 1.00 0.31 H new ATOM 0 HB3 LEU A 8 1.836 -0.583 5.280 1.00 0.31 H new ATOM 0 HG LEU A 8 2.255 -0.385 8.280 1.00 0.33 H new ATOM 0 HD11 LEU A 8 1.099 1.766 8.080 1.00 0.36 H new ATOM 0 HD12 LEU A 8 2.625 1.751 7.165 1.00 0.36 H new ATOM 0 HD13 LEU A 8 1.073 1.588 6.310 1.00 0.36 H new ATOM 0 HD21 LEU A 8 -0.200 -0.325 8.370 1.00 0.35 H new ATOM 0 HD22 LEU A 8 -0.270 -0.584 6.611 1.00 0.35 H new ATOM 0 HD23 LEU A 8 0.395 -1.849 7.670 1.00 0.35 H new ATOM 131 N VAL A 9 4.807 -2.609 5.307 1.00 0.26 N ATOM 132 CA VAL A 9 5.752 -3.075 4.315 1.00 0.28 C ATOM 133 C VAL A 9 5.731 -4.595 4.238 1.00 0.29 C ATOM 134 O VAL A 9 5.309 -5.165 3.235 1.00 0.31 O ATOM 135 CB VAL A 9 7.176 -2.599 4.644 1.00 0.32 C ATOM 136 CG1 VAL A 9 8.167 -3.154 3.638 1.00 0.38 C ATOM 137 CG2 VAL A 9 7.233 -1.083 4.671 1.00 0.31 C ATOM 0 H VAL A 9 5.233 -2.153 6.114 1.00 0.26 H new ATOM 0 HA VAL A 9 5.457 -2.659 3.352 1.00 0.28 H new ATOM 0 HB VAL A 9 7.447 -2.971 5.632 1.00 0.32 H new ATOM 0 HG11 VAL A 9 9.170 -2.807 3.886 1.00 0.38 H new ATOM 0 HG12 VAL A 9 8.143 -4.243 3.666 1.00 0.38 H new ATOM 0 HG13 VAL A 9 7.901 -2.811 2.638 1.00 0.38 H new ATOM 0 HG21 VAL A 9 8.248 -0.761 4.905 1.00 0.31 H new ATOM 0 HG22 VAL A 9 6.944 -0.691 3.696 1.00 0.31 H new ATOM 0 HG23 VAL A 9 6.548 -0.707 5.431 1.00 0.31 H new ATOM 147 N VAL A 10 6.168 -5.238 5.316 1.00 0.30 N ATOM 148 CA VAL A 10 6.296 -6.690 5.359 1.00 0.32 C ATOM 149 C VAL A 10 4.991 -7.382 4.988 1.00 0.35 C ATOM 150 O VAL A 10 4.978 -8.285 4.148 1.00 0.36 O ATOM 151 CB VAL A 10 6.745 -7.163 6.756 1.00 0.37 C ATOM 152 CG1 VAL A 10 6.757 -8.680 6.836 1.00 0.42 C ATOM 153 CG2 VAL A 10 8.120 -6.607 7.084 1.00 0.38 C ATOM 0 H VAL A 10 6.442 -4.770 6.180 1.00 0.30 H new ATOM 0 HA VAL A 10 7.054 -6.962 4.625 1.00 0.32 H new ATOM 0 HB VAL A 10 6.030 -6.789 7.489 1.00 0.37 H new ATOM 0 HG11 VAL A 10 7.077 -8.989 7.831 1.00 0.42 H new ATOM 0 HG12 VAL A 10 5.755 -9.063 6.642 1.00 0.42 H new ATOM 0 HG13 VAL A 10 7.448 -9.078 6.093 1.00 0.42 H new ATOM 0 HG21 VAL A 10 8.424 -6.949 8.073 1.00 0.38 H new ATOM 0 HG22 VAL A 10 8.839 -6.955 6.343 1.00 0.38 H new ATOM 0 HG23 VAL A 10 8.084 -5.518 7.072 1.00 0.38 H new ATOM 163 N ASP A 11 3.897 -6.949 5.600 1.00 0.39 N ATOM 164 CA ASP A 11 2.602 -7.583 5.377 1.00 0.46 C ATOM 165 C ASP A 11 2.181 -7.435 3.921 1.00 0.44 C ATOM 166 O ASP A 11 1.682 -8.382 3.321 1.00 0.50 O ATOM 167 CB ASP A 11 1.528 -6.980 6.290 1.00 0.55 C ATOM 168 CG ASP A 11 0.368 -7.926 6.528 1.00 0.71 C ATOM 169 OD1 ASP A 11 -0.329 -8.286 5.560 1.00 0.84 O ATOM 170 OD2 ASP A 11 0.133 -8.297 7.697 1.00 0.92 O ATOM 0 H ASP A 11 3.879 -6.165 6.252 1.00 0.39 H new ATOM 0 HA ASP A 11 2.704 -8.642 5.615 1.00 0.46 H new ATOM 0 HB2 ASP A 11 1.977 -6.714 7.247 1.00 0.55 H new ATOM 0 HB3 ASP A 11 1.155 -6.057 5.846 1.00 0.55 H new ATOM 175 N PHE A 12 2.414 -6.256 3.344 1.00 0.41 N ATOM 176 CA PHE A 12 2.015 -5.996 1.962 1.00 0.42 C ATOM 177 C PHE A 12 2.891 -6.784 0.995 1.00 0.37 C ATOM 178 O PHE A 12 2.398 -7.338 0.012 1.00 0.41 O ATOM 179 CB PHE A 12 2.088 -4.496 1.632 1.00 0.44 C ATOM 180 CG PHE A 12 1.464 -4.136 0.309 1.00 0.48 C ATOM 181 CD1 PHE A 12 2.210 -4.191 -0.857 1.00 0.46 C ATOM 182 CD2 PHE A 12 0.134 -3.743 0.232 1.00 0.62 C ATOM 183 CE1 PHE A 12 1.645 -3.861 -2.074 1.00 0.51 C ATOM 184 CE2 PHE A 12 -0.434 -3.410 -0.983 1.00 0.68 C ATOM 185 CZ PHE A 12 0.303 -3.475 -2.130 1.00 0.60 C ATOM 0 H PHE A 12 2.873 -5.472 3.808 1.00 0.41 H new ATOM 0 HA PHE A 12 0.980 -6.320 1.851 1.00 0.42 H new ATOM 0 HB2 PHE A 12 1.591 -3.934 2.423 1.00 0.44 H new ATOM 0 HB3 PHE A 12 3.132 -4.184 1.628 1.00 0.44 H new ATOM 0 HD1 PHE A 12 3.245 -4.495 -0.814 1.00 0.46 H new ATOM 0 HD2 PHE A 12 -0.463 -3.697 1.131 1.00 0.62 H new ATOM 0 HE1 PHE A 12 2.237 -3.901 -2.976 1.00 0.51 H new ATOM 0 HE2 PHE A 12 -1.467 -3.097 -1.025 1.00 0.68 H new ATOM 0 HZ PHE A 12 -0.150 -3.229 -3.079 1.00 0.60 H new ATOM 195 N LEU A 13 4.187 -6.842 1.275 1.00 0.33 N ATOM 196 CA LEU A 13 5.099 -7.608 0.440 1.00 0.32 C ATOM 197 C LEU A 13 4.723 -9.081 0.493 1.00 0.33 C ATOM 198 O LEU A 13 4.668 -9.761 -0.532 1.00 0.35 O ATOM 199 CB LEU A 13 6.547 -7.407 0.891 1.00 0.32 C ATOM 200 CG LEU A 13 6.994 -5.946 0.993 1.00 0.34 C ATOM 201 CD1 LEU A 13 8.475 -5.858 1.306 1.00 0.40 C ATOM 202 CD2 LEU A 13 6.674 -5.190 -0.285 1.00 0.38 C ATOM 0 H LEU A 13 4.626 -6.372 2.067 1.00 0.33 H new ATOM 0 HA LEU A 13 5.017 -7.255 -0.588 1.00 0.32 H new ATOM 0 HB2 LEU A 13 6.678 -7.881 1.864 1.00 0.32 H new ATOM 0 HB3 LEU A 13 7.205 -7.925 0.193 1.00 0.32 H new ATOM 0 HG LEU A 13 6.442 -5.482 1.810 1.00 0.34 H new ATOM 0 HD11 LEU A 13 8.771 -4.811 1.374 1.00 0.40 H new ATOM 0 HD12 LEU A 13 8.676 -6.354 2.255 1.00 0.40 H new ATOM 0 HD13 LEU A 13 9.044 -6.345 0.514 1.00 0.40 H new ATOM 0 HD21 LEU A 13 7.001 -4.155 -0.187 1.00 0.38 H new ATOM 0 HD22 LEU A 13 7.192 -5.657 -1.123 1.00 0.38 H new ATOM 0 HD23 LEU A 13 5.599 -5.215 -0.463 1.00 0.38 H new ATOM 214 N SER A 14 4.424 -9.554 1.696 1.00 0.34 N ATOM 215 CA SER A 14 3.964 -10.921 1.892 1.00 0.38 C ATOM 216 C SER A 14 2.603 -11.119 1.228 1.00 0.39 C ATOM 217 O SER A 14 2.301 -12.193 0.716 1.00 0.41 O ATOM 218 CB SER A 14 3.873 -11.241 3.391 1.00 0.45 C ATOM 219 OG SER A 14 3.400 -12.559 3.610 1.00 1.14 O ATOM 0 H SER A 14 4.493 -9.007 2.554 1.00 0.34 H new ATOM 0 HA SER A 14 4.681 -11.601 1.432 1.00 0.38 H new ATOM 0 HB2 SER A 14 4.855 -11.124 3.850 1.00 0.45 H new ATOM 0 HB3 SER A 14 3.207 -10.528 3.877 1.00 0.45 H new ATOM 0 HG SER A 14 3.354 -12.734 4.573 1.00 1.14 H new ATOM 225 N TYR A 15 1.806 -10.059 1.221 1.00 0.42 N ATOM 226 CA TYR A 15 0.453 -10.087 0.675 1.00 0.47 C ATOM 227 C TYR A 15 0.494 -10.304 -0.833 1.00 0.45 C ATOM 228 O TYR A 15 -0.291 -11.074 -1.386 1.00 0.52 O ATOM 229 CB TYR A 15 -0.248 -8.764 1.007 1.00 0.55 C ATOM 230 CG TYR A 15 -1.734 -8.727 0.727 1.00 0.66 C ATOM 231 CD1 TYR A 15 -2.637 -9.379 1.558 1.00 0.79 C ATOM 232 CD2 TYR A 15 -2.229 -8.063 -0.388 1.00 0.78 C ATOM 233 CE1 TYR A 15 -3.990 -9.371 1.285 1.00 0.96 C ATOM 234 CE2 TYR A 15 -3.581 -8.046 -0.663 1.00 0.94 C ATOM 235 CZ TYR A 15 -4.469 -8.617 0.248 1.00 1.02 C ATOM 236 OH TYR A 15 -5.802 -8.699 -0.109 1.00 1.20 O ATOM 0 H TYR A 15 2.080 -9.151 1.595 1.00 0.42 H new ATOM 0 HA TYR A 15 -0.102 -10.913 1.120 1.00 0.47 H new ATOM 0 HB2 TYR A 15 -0.089 -8.544 2.063 1.00 0.55 H new ATOM 0 HB3 TYR A 15 0.231 -7.966 0.439 1.00 0.55 H new ATOM 0 HD1 TYR A 15 -2.274 -9.900 2.432 1.00 0.79 H new ATOM 0 HD2 TYR A 15 -1.545 -7.552 -1.050 1.00 0.78 H new ATOM 0 HE1 TYR A 15 -4.668 -9.957 1.887 1.00 0.96 H new ATOM 0 HE2 TYR A 15 -3.947 -7.596 -1.574 1.00 0.94 H new ATOM 0 HH TYR A 15 -5.976 -8.098 -0.863 1.00 1.20 H new ATOM 246 N LYS A 16 1.436 -9.642 -1.490 1.00 0.40 N ATOM 247 CA LYS A 16 1.552 -9.737 -2.933 1.00 0.41 C ATOM 248 C LYS A 16 2.219 -11.053 -3.320 1.00 0.35 C ATOM 249 O LYS A 16 1.840 -11.685 -4.307 1.00 0.39 O ATOM 250 CB LYS A 16 2.333 -8.542 -3.485 1.00 0.49 C ATOM 251 CG LYS A 16 2.038 -8.244 -4.947 1.00 0.90 C ATOM 252 CD LYS A 16 0.540 -8.127 -5.189 1.00 0.83 C ATOM 253 CE LYS A 16 0.222 -7.634 -6.591 1.00 1.35 C ATOM 254 NZ LYS A 16 0.528 -6.190 -6.760 1.00 1.39 N ATOM 0 H LYS A 16 2.127 -9.037 -1.047 1.00 0.40 H new ATOM 0 HA LYS A 16 0.554 -9.718 -3.371 1.00 0.41 H new ATOM 0 HB2 LYS A 16 2.100 -7.660 -2.889 1.00 0.49 H new ATOM 0 HB3 LYS A 16 3.400 -8.732 -3.370 1.00 0.49 H new ATOM 0 HG2 LYS A 16 2.531 -7.317 -5.239 1.00 0.90 H new ATOM 0 HG3 LYS A 16 2.450 -9.035 -5.573 1.00 0.90 H new ATOM 0 HD2 LYS A 16 0.071 -9.099 -5.032 1.00 0.83 H new ATOM 0 HD3 LYS A 16 0.108 -7.443 -4.458 1.00 0.83 H new ATOM 0 HE2 LYS A 16 0.794 -8.212 -7.316 1.00 1.35 H new ATOM 0 HE3 LYS A 16 -0.833 -7.808 -6.805 1.00 1.35 H new ATOM 0 HZ1 LYS A 16 0.202 -5.873 -7.696 1.00 1.39 H new ATOM 0 HZ2 LYS A 16 0.042 -5.643 -6.021 1.00 1.39 H new ATOM 0 HZ3 LYS A 16 1.554 -6.041 -6.682 1.00 1.39 H new ATOM 268 N LEU A 17 3.200 -11.473 -2.526 1.00 0.30 N ATOM 269 CA LEU A 17 3.840 -12.765 -2.723 1.00 0.27 C ATOM 270 C LEU A 17 2.859 -13.902 -2.459 1.00 0.31 C ATOM 271 O LEU A 17 2.903 -14.934 -3.124 1.00 0.32 O ATOM 272 CB LEU A 17 5.058 -12.899 -1.811 1.00 0.25 C ATOM 273 CG LEU A 17 6.221 -11.976 -2.157 1.00 0.24 C ATOM 274 CD1 LEU A 17 7.277 -12.030 -1.072 1.00 0.29 C ATOM 275 CD2 LEU A 17 6.820 -12.357 -3.500 1.00 0.25 C ATOM 0 H LEU A 17 3.567 -10.936 -1.741 1.00 0.30 H new ATOM 0 HA LEU A 17 4.168 -12.827 -3.761 1.00 0.27 H new ATOM 0 HB2 LEU A 17 4.749 -12.702 -0.784 1.00 0.25 H new ATOM 0 HB3 LEU A 17 5.409 -13.931 -1.846 1.00 0.25 H new ATOM 0 HG LEU A 17 5.845 -10.955 -2.225 1.00 0.24 H new ATOM 0 HD11 LEU A 17 8.101 -11.366 -1.333 1.00 0.29 H new ATOM 0 HD12 LEU A 17 6.842 -11.713 -0.124 1.00 0.29 H new ATOM 0 HD13 LEU A 17 7.649 -13.050 -0.977 1.00 0.29 H new ATOM 0 HD21 LEU A 17 7.649 -11.688 -3.732 1.00 0.25 H new ATOM 0 HD22 LEU A 17 7.183 -13.384 -3.458 1.00 0.25 H new ATOM 0 HD23 LEU A 17 6.058 -12.273 -4.275 1.00 0.25 H new ATOM 287 N SER A 18 1.970 -13.700 -1.494 1.00 0.37 N ATOM 288 CA SER A 18 0.930 -14.679 -1.182 1.00 0.44 C ATOM 289 C SER A 18 -0.002 -14.841 -2.382 1.00 0.47 C ATOM 290 O SER A 18 -0.468 -15.942 -2.681 1.00 0.51 O ATOM 291 CB SER A 18 0.140 -14.241 0.062 1.00 0.54 C ATOM 292 OG SER A 18 -0.847 -15.193 0.417 1.00 1.26 O ATOM 0 H SER A 18 1.947 -12.864 -0.910 1.00 0.37 H new ATOM 0 HA SER A 18 1.397 -15.640 -0.967 1.00 0.44 H new ATOM 0 HB2 SER A 18 0.826 -14.099 0.897 1.00 0.54 H new ATOM 0 HB3 SER A 18 -0.334 -13.278 -0.128 1.00 0.54 H new ATOM 0 HG SER A 18 -1.329 -14.884 1.212 1.00 1.26 H new ATOM 298 N GLN A 19 -0.237 -13.738 -3.087 1.00 0.48 N ATOM 299 CA GLN A 19 -1.046 -13.747 -4.297 1.00 0.53 C ATOM 300 C GLN A 19 -0.313 -14.511 -5.404 1.00 0.48 C ATOM 301 O GLN A 19 -0.928 -15.050 -6.326 1.00 0.55 O ATOM 302 CB GLN A 19 -1.320 -12.304 -4.737 1.00 0.59 C ATOM 303 CG GLN A 19 -2.236 -12.172 -5.943 1.00 0.71 C ATOM 304 CD GLN A 19 -2.175 -10.787 -6.561 1.00 1.06 C ATOM 305 OE1 GLN A 19 -1.369 -10.537 -7.455 1.00 1.72 O ATOM 306 NE2 GLN A 19 -3.002 -9.872 -6.077 1.00 1.65 N ATOM 0 H GLN A 19 0.127 -12.819 -2.836 1.00 0.48 H new ATOM 0 HA GLN A 19 -1.995 -14.245 -4.099 1.00 0.53 H new ATOM 0 HB2 GLN A 19 -1.761 -11.761 -3.901 1.00 0.59 H new ATOM 0 HB3 GLN A 19 -0.370 -11.821 -4.965 1.00 0.59 H new ATOM 0 HG2 GLN A 19 -1.958 -12.914 -6.691 1.00 0.71 H new ATOM 0 HG3 GLN A 19 -3.261 -12.390 -5.644 1.00 0.71 H new ATOM 0 HE21 GLN A 19 -3.657 -10.118 -5.335 1.00 1.65 H new ATOM 0 HE22 GLN A 19 -2.984 -8.922 -6.447 1.00 1.65 H new ATOM 315 N LYS A 20 1.008 -14.555 -5.286 1.00 0.41 N ATOM 316 CA LYS A 20 1.860 -15.251 -6.242 1.00 0.40 C ATOM 317 C LYS A 20 2.117 -16.693 -5.804 1.00 0.44 C ATOM 318 O LYS A 20 2.889 -17.415 -6.433 1.00 0.48 O ATOM 319 CB LYS A 20 3.189 -14.507 -6.377 1.00 0.36 C ATOM 320 CG LYS A 20 3.050 -13.115 -6.971 1.00 0.68 C ATOM 321 CD LYS A 20 2.866 -13.166 -8.478 1.00 0.61 C ATOM 322 CE LYS A 20 2.415 -11.827 -9.037 1.00 1.06 C ATOM 323 NZ LYS A 20 1.054 -11.464 -8.566 1.00 1.87 N ATOM 0 H LYS A 20 1.519 -14.109 -4.524 1.00 0.41 H new ATOM 0 HA LYS A 20 1.350 -15.275 -7.205 1.00 0.40 H new ATOM 0 HB2 LYS A 20 3.653 -14.429 -5.394 1.00 0.36 H new ATOM 0 HB3 LYS A 20 3.862 -15.094 -7.002 1.00 0.36 H new ATOM 0 HG2 LYS A 20 2.198 -12.608 -6.517 1.00 0.68 H new ATOM 0 HG3 LYS A 20 3.936 -12.527 -6.732 1.00 0.68 H new ATOM 0 HD2 LYS A 20 3.804 -13.459 -8.949 1.00 0.61 H new ATOM 0 HD3 LYS A 20 2.131 -13.931 -8.729 1.00 0.61 H new ATOM 0 HE2 LYS A 20 3.122 -11.052 -8.739 1.00 1.06 H new ATOM 0 HE3 LYS A 20 2.425 -11.866 -10.126 1.00 1.06 H new ATOM 0 HZ1 LYS A 20 0.645 -10.751 -9.203 1.00 1.87 H new ATOM 0 HZ2 LYS A 20 0.451 -12.311 -8.562 1.00 1.87 H new ATOM 0 HZ3 LYS A 20 1.112 -11.076 -7.603 1.00 1.87 H new ATOM 337 N GLY A 21 1.471 -17.103 -4.719 1.00 0.48 N ATOM 338 CA GLY A 21 1.615 -18.468 -4.241 1.00 0.54 C ATOM 339 C GLY A 21 2.909 -18.703 -3.480 1.00 0.53 C ATOM 340 O GLY A 21 3.361 -19.842 -3.360 1.00 0.67 O ATOM 0 H GLY A 21 0.850 -16.517 -4.161 1.00 0.48 H new ATOM 0 HA2 GLY A 21 0.772 -18.710 -3.594 1.00 0.54 H new ATOM 0 HA3 GLY A 21 1.572 -19.150 -5.090 1.00 0.54 H new ATOM 344 N TYR A 22 3.519 -17.636 -2.978 1.00 0.43 N ATOM 345 CA TYR A 22 4.739 -17.763 -2.186 1.00 0.42 C ATOM 346 C TYR A 22 4.456 -17.425 -0.726 1.00 0.43 C ATOM 347 O TYR A 22 3.577 -16.615 -0.429 1.00 0.46 O ATOM 348 CB TYR A 22 5.846 -16.838 -2.714 1.00 0.40 C ATOM 349 CG TYR A 22 6.206 -17.037 -4.174 1.00 0.48 C ATOM 350 CD1 TYR A 22 6.219 -18.302 -4.757 1.00 0.65 C ATOM 351 CD2 TYR A 22 6.534 -15.947 -4.971 1.00 0.47 C ATOM 352 CE1 TYR A 22 6.552 -18.468 -6.091 1.00 0.75 C ATOM 353 CE2 TYR A 22 6.865 -16.107 -6.302 1.00 0.57 C ATOM 354 CZ TYR A 22 6.873 -17.366 -6.857 1.00 0.69 C ATOM 355 OH TYR A 22 7.207 -17.522 -8.183 1.00 0.81 O ATOM 0 H TYR A 22 3.192 -16.678 -3.103 1.00 0.43 H new ATOM 0 HA TYR A 22 5.080 -18.795 -2.267 1.00 0.42 H new ATOM 0 HB2 TYR A 22 5.534 -15.804 -2.570 1.00 0.40 H new ATOM 0 HB3 TYR A 22 6.742 -16.987 -2.111 1.00 0.40 H new ATOM 0 HD1 TYR A 22 5.966 -19.166 -4.160 1.00 0.65 H new ATOM 0 HD2 TYR A 22 6.530 -14.956 -4.541 1.00 0.47 H new ATOM 0 HE1 TYR A 22 6.560 -19.455 -6.530 1.00 0.75 H new ATOM 0 HE2 TYR A 22 7.117 -15.247 -6.905 1.00 0.57 H new ATOM 0 HH TYR A 22 7.404 -16.646 -8.576 1.00 0.81 H new ATOM 365 N SER A 23 5.200 -18.047 0.179 1.00 0.45 N ATOM 366 CA SER A 23 5.053 -17.788 1.603 1.00 0.49 C ATOM 367 C SER A 23 6.237 -16.971 2.116 1.00 0.43 C ATOM 368 O SER A 23 7.391 -17.370 1.958 1.00 0.44 O ATOM 369 CB SER A 23 4.950 -19.112 2.368 1.00 0.59 C ATOM 370 OG SER A 23 4.713 -18.904 3.752 1.00 1.41 O ATOM 0 H SER A 23 5.915 -18.738 -0.051 1.00 0.45 H new ATOM 0 HA SER A 23 4.140 -17.216 1.765 1.00 0.49 H new ATOM 0 HB2 SER A 23 4.144 -19.713 1.947 1.00 0.59 H new ATOM 0 HB3 SER A 23 5.872 -19.679 2.238 1.00 0.59 H new ATOM 0 HG SER A 23 4.651 -19.770 4.207 1.00 1.41 H new ATOM 376 N TRP A 24 5.942 -15.831 2.732 1.00 0.43 N ATOM 377 CA TRP A 24 6.972 -14.929 3.247 1.00 0.41 C ATOM 378 C TRP A 24 7.825 -15.622 4.304 1.00 0.47 C ATOM 379 O TRP A 24 9.038 -15.399 4.383 1.00 0.53 O ATOM 380 CB TRP A 24 6.321 -13.671 3.839 1.00 0.44 C ATOM 381 CG TRP A 24 7.294 -12.706 4.453 1.00 0.46 C ATOM 382 CD1 TRP A 24 7.629 -12.607 5.776 1.00 0.55 C ATOM 383 CD2 TRP A 24 8.054 -11.698 3.773 1.00 0.43 C ATOM 384 NE1 TRP A 24 8.550 -11.608 5.955 1.00 0.57 N ATOM 385 CE2 TRP A 24 8.827 -11.034 4.744 1.00 0.50 C ATOM 386 CE3 TRP A 24 8.160 -11.292 2.439 1.00 0.39 C ATOM 387 CZ2 TRP A 24 9.690 -9.989 4.425 1.00 0.51 C ATOM 388 CZ3 TRP A 24 9.017 -10.256 2.123 1.00 0.43 C ATOM 389 CH2 TRP A 24 9.772 -9.614 3.113 1.00 0.48 C ATOM 0 H TRP A 24 4.988 -15.505 2.889 1.00 0.43 H new ATOM 0 HA TRP A 24 7.620 -14.642 2.419 1.00 0.41 H new ATOM 0 HB2 TRP A 24 5.765 -13.159 3.053 1.00 0.44 H new ATOM 0 HB3 TRP A 24 5.598 -13.972 4.597 1.00 0.44 H new ATOM 0 HD1 TRP A 24 7.226 -13.226 6.564 1.00 0.55 H new ATOM 0 HE1 TRP A 24 8.963 -11.336 6.847 1.00 0.57 H new ATOM 0 HE3 TRP A 24 7.581 -11.780 1.669 1.00 0.39 H new ATOM 0 HZ2 TRP A 24 10.273 -9.493 5.186 1.00 0.51 H new ATOM 0 HZ3 TRP A 24 9.107 -9.936 1.096 1.00 0.43 H new ATOM 0 HH2 TRP A 24 10.432 -8.806 2.834 1.00 0.48 H new ATOM 400 N SER A 25 7.188 -16.466 5.104 1.00 0.54 N ATOM 401 CA SER A 25 7.877 -17.203 6.155 1.00 0.63 C ATOM 402 C SER A 25 9.025 -18.037 5.585 1.00 0.63 C ATOM 403 O SER A 25 10.052 -18.218 6.232 1.00 0.75 O ATOM 404 CB SER A 25 6.887 -18.109 6.882 1.00 0.75 C ATOM 405 OG SER A 25 5.719 -17.392 7.252 1.00 1.20 O ATOM 0 H SER A 25 6.188 -16.658 5.044 1.00 0.54 H new ATOM 0 HA SER A 25 8.298 -16.484 6.857 1.00 0.63 H new ATOM 0 HB2 SER A 25 6.616 -18.947 6.240 1.00 0.75 H new ATOM 0 HB3 SER A 25 7.358 -18.529 7.771 1.00 0.75 H new ATOM 0 HG SER A 25 5.099 -17.993 7.715 1.00 1.20 H new ATOM 411 N GLN A 26 8.855 -18.509 4.355 1.00 0.61 N ATOM 412 CA GLN A 26 9.850 -19.357 3.713 1.00 0.73 C ATOM 413 C GLN A 26 11.093 -18.550 3.333 1.00 0.79 C ATOM 414 O GLN A 26 12.178 -19.103 3.163 1.00 0.93 O ATOM 415 CB GLN A 26 9.242 -20.024 2.469 1.00 0.80 C ATOM 416 CG GLN A 26 10.175 -21.006 1.769 1.00 1.25 C ATOM 417 CD GLN A 26 10.570 -22.180 2.651 1.00 1.53 C ATOM 418 OE1 GLN A 26 11.662 -22.731 2.514 1.00 1.91 O ATOM 419 NE2 GLN A 26 9.688 -22.579 3.554 1.00 2.26 N ATOM 0 H GLN A 26 8.034 -18.317 3.781 1.00 0.61 H new ATOM 0 HA GLN A 26 10.155 -20.130 4.419 1.00 0.73 H new ATOM 0 HB2 GLN A 26 8.332 -20.549 2.760 1.00 0.80 H new ATOM 0 HB3 GLN A 26 8.950 -19.249 1.760 1.00 0.80 H new ATOM 0 HG2 GLN A 26 9.689 -21.382 0.869 1.00 1.25 H new ATOM 0 HG3 GLN A 26 11.074 -20.480 1.449 1.00 1.25 H new ATOM 0 HE21 GLN A 26 8.792 -22.098 3.639 1.00 2.26 H new ATOM 0 HE22 GLN A 26 9.904 -23.367 4.164 1.00 2.26 H new ATOM 428 N PHE A 27 10.936 -17.237 3.222 1.00 0.76 N ATOM 429 CA PHE A 27 12.042 -16.376 2.826 1.00 0.92 C ATOM 430 C PHE A 27 12.619 -15.672 4.046 1.00 0.98 C ATOM 431 O PHE A 27 13.554 -14.879 3.942 1.00 1.18 O ATOM 432 CB PHE A 27 11.581 -15.355 1.779 1.00 0.99 C ATOM 433 CG PHE A 27 10.844 -15.983 0.627 1.00 0.97 C ATOM 434 CD1 PHE A 27 11.462 -16.928 -0.177 1.00 1.07 C ATOM 435 CD2 PHE A 27 9.540 -15.615 0.338 1.00 0.93 C ATOM 436 CE1 PHE A 27 10.792 -17.492 -1.246 1.00 1.13 C ATOM 437 CE2 PHE A 27 8.866 -16.178 -0.728 1.00 0.96 C ATOM 438 CZ PHE A 27 9.471 -17.170 -1.479 1.00 1.05 C ATOM 0 H PHE A 27 10.059 -16.748 3.399 1.00 0.76 H new ATOM 0 HA PHE A 27 12.822 -16.992 2.378 1.00 0.92 H new ATOM 0 HB2 PHE A 27 10.935 -14.619 2.258 1.00 0.99 H new ATOM 0 HB3 PHE A 27 12.449 -14.817 1.398 1.00 0.99 H new ATOM 0 HD1 PHE A 27 12.478 -17.227 0.034 1.00 1.07 H new ATOM 0 HD2 PHE A 27 9.044 -14.879 0.954 1.00 0.93 H new ATOM 0 HE1 PHE A 27 11.302 -18.185 -1.899 1.00 1.13 H new ATOM 0 HE2 PHE A 27 7.869 -15.845 -0.975 1.00 0.96 H new ATOM 0 HZ PHE A 27 8.912 -17.689 -2.243 1.00 1.05 H new ATOM 448 N SER A 28 12.048 -15.970 5.204 1.00 0.93 N ATOM 449 CA SER A 28 12.537 -15.432 6.461 1.00 1.07 C ATOM 450 C SER A 28 13.378 -16.487 7.174 1.00 1.04 C ATOM 451 O SER A 28 13.530 -17.606 6.678 1.00 1.02 O ATOM 452 CB SER A 28 11.360 -14.998 7.339 1.00 1.21 C ATOM 453 OG SER A 28 10.494 -14.126 6.631 1.00 1.73 O ATOM 0 H SER A 28 11.240 -16.586 5.297 1.00 0.93 H new ATOM 0 HA SER A 28 13.159 -14.559 6.265 1.00 1.07 H new ATOM 0 HB2 SER A 28 10.806 -15.876 7.671 1.00 1.21 H new ATOM 0 HB3 SER A 28 11.733 -14.499 8.233 1.00 1.21 H new ATOM 0 HG SER A 28 10.018 -14.629 5.938 1.00 1.73 H new ATOM 459 N ASP A 29 13.932 -16.139 8.324 1.00 1.25 N ATOM 460 CA ASP A 29 14.676 -17.105 9.115 1.00 1.33 C ATOM 461 C ASP A 29 13.718 -17.888 10.002 1.00 1.40 C ATOM 462 O ASP A 29 13.302 -17.413 11.058 1.00 1.62 O ATOM 463 CB ASP A 29 15.747 -16.420 9.964 1.00 1.63 C ATOM 464 CG ASP A 29 16.865 -15.826 9.132 1.00 1.96 C ATOM 465 OD1 ASP A 29 16.740 -14.660 8.704 1.00 2.16 O ATOM 466 OD2 ASP A 29 17.882 -16.516 8.910 1.00 2.43 O ATOM 0 H ASP A 29 13.882 -15.204 8.728 1.00 1.25 H new ATOM 0 HA ASP A 29 15.181 -17.791 8.435 1.00 1.33 H new ATOM 0 HB2 ASP A 29 15.284 -15.632 10.558 1.00 1.63 H new ATOM 0 HB3 ASP A 29 16.166 -17.143 10.664 1.00 1.63 H new ATOM 471 N VAL A 30 13.376 -19.086 9.552 1.00 1.40 N ATOM 472 CA VAL A 30 12.368 -19.912 10.203 1.00 1.63 C ATOM 473 C VAL A 30 12.813 -20.341 11.599 1.00 1.66 C ATOM 474 O VAL A 30 12.259 -19.889 12.601 1.00 1.79 O ATOM 475 CB VAL A 30 12.068 -21.165 9.354 1.00 1.89 C ATOM 476 CG1 VAL A 30 10.993 -22.024 10.006 1.00 2.24 C ATOM 477 CG2 VAL A 30 11.651 -20.769 7.946 1.00 1.95 C ATOM 0 H VAL A 30 13.790 -19.514 8.724 1.00 1.40 H new ATOM 0 HA VAL A 30 11.465 -19.310 10.298 1.00 1.63 H new ATOM 0 HB VAL A 30 12.982 -21.756 9.293 1.00 1.89 H new ATOM 0 HG11 VAL A 30 10.802 -22.900 9.386 1.00 2.24 H new ATOM 0 HG12 VAL A 30 11.331 -22.344 10.992 1.00 2.24 H new ATOM 0 HG13 VAL A 30 10.076 -21.444 10.107 1.00 2.24 H new ATOM 0 HG21 VAL A 30 11.444 -21.666 7.362 1.00 1.95 H new ATOM 0 HG22 VAL A 30 10.754 -20.151 7.992 1.00 1.95 H new ATOM 0 HG23 VAL A 30 12.456 -20.206 7.473 1.00 1.95 H new ATOM 487 N GLU A 31 13.811 -21.214 11.654 1.00 1.67 N ATOM 488 CA GLU A 31 14.277 -21.768 12.921 1.00 1.83 C ATOM 489 C GLU A 31 15.160 -20.770 13.660 1.00 1.78 C ATOM 490 O GLU A 31 15.446 -20.936 14.846 1.00 1.99 O ATOM 491 CB GLU A 31 15.072 -23.063 12.702 1.00 2.07 C ATOM 492 CG GLU A 31 14.739 -23.806 11.417 1.00 2.55 C ATOM 493 CD GLU A 31 15.539 -23.304 10.231 1.00 2.93 C ATOM 494 OE1 GLU A 31 15.085 -22.357 9.559 1.00 3.27 O ATOM 495 OE2 GLU A 31 16.627 -23.853 9.969 1.00 3.42 O ATOM 0 H GLU A 31 14.315 -21.555 10.835 1.00 1.67 H new ATOM 0 HA GLU A 31 13.392 -21.985 13.519 1.00 1.83 H new ATOM 0 HB2 GLU A 31 16.136 -22.824 12.702 1.00 2.07 H new ATOM 0 HB3 GLU A 31 14.895 -23.729 13.547 1.00 2.07 H new ATOM 0 HG2 GLU A 31 14.931 -24.870 11.556 1.00 2.55 H new ATOM 0 HG3 GLU A 31 13.675 -23.699 11.205 1.00 2.55 H new ATOM 502 N GLU A 32 15.587 -19.735 12.954 1.00 1.61 N ATOM 503 CA GLU A 32 16.535 -18.781 13.507 1.00 1.65 C ATOM 504 C GLU A 32 15.825 -17.723 14.347 1.00 1.75 C ATOM 505 O GLU A 32 16.169 -17.518 15.512 1.00 2.00 O ATOM 506 CB GLU A 32 17.346 -18.118 12.391 1.00 1.54 C ATOM 507 CG GLU A 32 18.024 -19.109 11.455 1.00 1.79 C ATOM 508 CD GLU A 32 18.961 -20.057 12.176 1.00 2.33 C ATOM 509 OE1 GLU A 32 20.123 -19.677 12.424 1.00 2.57 O ATOM 510 OE2 GLU A 32 18.538 -21.185 12.505 1.00 3.01 O ATOM 0 H GLU A 32 15.293 -19.534 11.998 1.00 1.61 H new ATOM 0 HA GLU A 32 17.218 -19.328 14.157 1.00 1.65 H new ATOM 0 HB2 GLU A 32 16.687 -17.474 11.808 1.00 1.54 H new ATOM 0 HB3 GLU A 32 18.105 -17.476 12.838 1.00 1.54 H new ATOM 0 HG2 GLU A 32 17.262 -19.687 10.933 1.00 1.79 H new ATOM 0 HG3 GLU A 32 18.583 -18.561 10.697 1.00 1.79 H new ATOM 517 N ASN A 33 14.832 -17.058 13.768 1.00 1.77 N ATOM 518 CA ASN A 33 14.108 -16.013 14.484 1.00 2.01 C ATOM 519 C ASN A 33 12.633 -15.974 14.096 1.00 1.89 C ATOM 520 O ASN A 33 12.230 -15.244 13.192 1.00 2.13 O ATOM 521 CB ASN A 33 14.756 -14.628 14.275 1.00 2.35 C ATOM 522 CG ASN A 33 15.122 -14.324 12.827 1.00 3.05 C ATOM 523 OD1 ASN A 33 16.251 -14.570 12.402 1.00 3.61 O ATOM 524 ND2 ASN A 33 14.180 -13.792 12.059 1.00 3.58 N ATOM 0 H ASN A 33 14.511 -17.221 12.814 1.00 1.77 H new ATOM 0 HA ASN A 33 14.169 -16.262 15.543 1.00 2.01 H new ATOM 0 HB2 ASN A 33 14.071 -13.860 14.634 1.00 2.35 H new ATOM 0 HB3 ASN A 33 15.656 -14.564 14.887 1.00 2.35 H new ATOM 0 HD21 ASN A 33 14.381 -13.574 11.083 1.00 3.58 H new ATOM 0 HD22 ASN A 33 13.255 -13.601 12.444 1.00 3.58 H new ATOM 531 N ARG A 34 11.826 -16.777 14.772 1.00 1.88 N ATOM 532 CA ARG A 34 10.383 -16.708 14.603 1.00 1.96 C ATOM 533 C ARG A 34 9.850 -15.492 15.358 1.00 1.98 C ATOM 534 O ARG A 34 9.435 -15.590 16.516 1.00 2.34 O ATOM 535 CB ARG A 34 9.711 -17.993 15.104 1.00 2.42 C ATOM 536 CG ARG A 34 8.225 -18.078 14.781 1.00 2.86 C ATOM 537 CD ARG A 34 7.612 -19.361 15.320 1.00 3.54 C ATOM 538 NE ARG A 34 7.743 -19.457 16.772 1.00 3.97 N ATOM 539 CZ ARG A 34 8.189 -20.535 17.415 1.00 4.63 C ATOM 540 NH1 ARG A 34 8.554 -21.621 16.742 1.00 4.92 N ATOM 541 NH2 ARG A 34 8.270 -20.527 18.737 1.00 5.33 N ATOM 0 H ARG A 34 12.143 -17.480 15.439 1.00 1.88 H new ATOM 0 HA ARG A 34 10.151 -16.607 13.543 1.00 1.96 H new ATOM 0 HB2 ARG A 34 10.218 -18.852 14.664 1.00 2.42 H new ATOM 0 HB3 ARG A 34 9.843 -18.063 16.184 1.00 2.42 H new ATOM 0 HG2 ARG A 34 7.709 -17.219 15.209 1.00 2.86 H new ATOM 0 HG3 ARG A 34 8.083 -18.031 13.701 1.00 2.86 H new ATOM 0 HD2 ARG A 34 6.558 -19.403 15.047 1.00 3.54 H new ATOM 0 HD3 ARG A 34 8.096 -20.219 14.854 1.00 3.54 H new ATOM 0 HE ARG A 34 7.476 -18.646 17.330 1.00 3.97 H new ATOM 0 HH11 ARG A 34 8.494 -21.634 15.724 1.00 4.92 H new ATOM 0 HH12 ARG A 34 8.894 -22.441 17.244 1.00 4.92 H new ATOM 0 HH21 ARG A 34 7.991 -19.697 19.260 1.00 5.33 H new ATOM 0 HH22 ARG A 34 8.611 -21.351 19.232 1.00 5.33 H new ATOM 555 N THR A 35 9.911 -14.336 14.716 1.00 1.80 N ATOM 556 CA THR A 35 9.487 -13.098 15.341 1.00 1.96 C ATOM 557 C THR A 35 8.023 -12.805 15.037 1.00 1.86 C ATOM 558 O THR A 35 7.686 -12.288 13.967 1.00 2.02 O ATOM 559 CB THR A 35 10.364 -11.925 14.863 1.00 2.32 C ATOM 560 OG1 THR A 35 10.465 -11.939 13.433 1.00 2.88 O ATOM 561 CG2 THR A 35 11.756 -12.003 15.473 1.00 2.78 C ATOM 0 H THR A 35 10.251 -14.232 13.760 1.00 1.80 H new ATOM 0 HA THR A 35 9.601 -13.213 16.419 1.00 1.96 H new ATOM 0 HB THR A 35 9.894 -10.996 15.186 1.00 2.32 H new ATOM 0 HG1 THR A 35 9.572 -12.047 13.043 1.00 2.88 H new ATOM 0 HG21 THR A 35 12.356 -11.164 15.120 1.00 2.78 H new ATOM 0 HG22 THR A 35 11.680 -11.963 16.560 1.00 2.78 H new ATOM 0 HG23 THR A 35 12.231 -12.938 15.177 1.00 2.78 H new ATOM 569 N GLU A 36 7.156 -13.151 15.977 1.00 1.87 N ATOM 570 CA GLU A 36 5.728 -12.932 15.818 1.00 1.94 C ATOM 571 C GLU A 36 5.336 -11.561 16.350 1.00 1.78 C ATOM 572 O GLU A 36 5.160 -11.372 17.557 1.00 1.92 O ATOM 573 CB GLU A 36 4.931 -14.028 16.533 1.00 2.27 C ATOM 574 CG GLU A 36 5.166 -15.419 15.969 1.00 2.71 C ATOM 575 CD GLU A 36 4.772 -15.527 14.510 1.00 3.32 C ATOM 576 OE1 GLU A 36 5.619 -15.245 13.634 1.00 3.69 O ATOM 577 OE2 GLU A 36 3.618 -15.895 14.229 1.00 3.86 O ATOM 0 H GLU A 36 7.419 -13.586 16.861 1.00 1.87 H new ATOM 0 HA GLU A 36 5.493 -12.972 14.754 1.00 1.94 H new ATOM 0 HB2 GLU A 36 5.194 -14.025 17.591 1.00 2.27 H new ATOM 0 HB3 GLU A 36 3.868 -13.794 16.468 1.00 2.27 H new ATOM 0 HG2 GLU A 36 6.219 -15.679 16.078 1.00 2.71 H new ATOM 0 HG3 GLU A 36 4.597 -16.144 16.550 1.00 2.71 H new ATOM 584 N ALA A 37 5.230 -10.600 15.445 1.00 1.73 N ATOM 585 CA ALA A 37 4.826 -9.253 15.803 1.00 1.70 C ATOM 586 C ALA A 37 3.304 -9.158 15.850 1.00 1.55 C ATOM 587 O ALA A 37 2.615 -9.883 15.131 1.00 1.78 O ATOM 588 CB ALA A 37 5.396 -8.257 14.806 1.00 2.06 C ATOM 0 H ALA A 37 5.420 -10.732 14.452 1.00 1.73 H new ATOM 0 HA ALA A 37 5.217 -9.014 16.792 1.00 1.70 H new ATOM 0 HB1 ALA A 37 5.088 -7.249 15.082 1.00 2.06 H new ATOM 0 HB2 ALA A 37 6.484 -8.318 14.812 1.00 2.06 H new ATOM 0 HB3 ALA A 37 5.025 -8.489 13.808 1.00 2.06 H new ATOM 594 N PRO A 38 2.752 -8.288 16.705 1.00 1.53 N ATOM 595 CA PRO A 38 1.310 -8.091 16.802 1.00 1.68 C ATOM 596 C PRO A 38 0.793 -7.181 15.697 1.00 1.55 C ATOM 597 O PRO A 38 1.503 -6.279 15.244 1.00 1.51 O ATOM 598 CB PRO A 38 1.115 -7.423 18.172 1.00 2.02 C ATOM 599 CG PRO A 38 2.482 -7.277 18.768 1.00 2.11 C ATOM 600 CD PRO A 38 3.471 -7.430 17.648 1.00 1.77 C ATOM 0 HA PRO A 38 0.764 -9.029 16.698 1.00 1.68 H new ATOM 0 HB2 PRO A 38 0.632 -6.452 18.066 1.00 2.02 H new ATOM 0 HB3 PRO A 38 0.474 -8.029 18.812 1.00 2.02 H new ATOM 0 HG2 PRO A 38 2.591 -6.304 19.248 1.00 2.11 H new ATOM 0 HG3 PRO A 38 2.650 -8.032 19.536 1.00 2.11 H new ATOM 0 HD2 PRO A 38 3.733 -6.470 17.204 1.00 1.77 H new ATOM 0 HD3 PRO A 38 4.400 -7.889 17.987 1.00 1.77 H new ATOM 608 N GLU A 39 -0.430 -7.433 15.256 1.00 1.87 N ATOM 609 CA GLU A 39 -1.068 -6.600 14.247 1.00 1.91 C ATOM 610 C GLU A 39 -1.470 -5.263 14.851 1.00 1.53 C ATOM 611 O GLU A 39 -2.350 -5.200 15.716 1.00 1.78 O ATOM 612 CB GLU A 39 -2.295 -7.300 13.663 1.00 2.57 C ATOM 613 CG GLU A 39 -1.965 -8.553 12.873 1.00 3.24 C ATOM 614 CD GLU A 39 -3.200 -9.210 12.301 1.00 3.67 C ATOM 615 OE1 GLU A 39 -3.833 -8.615 11.401 1.00 4.19 O ATOM 616 OE2 GLU A 39 -3.556 -10.313 12.758 1.00 3.88 O ATOM 0 H GLU A 39 -1.003 -8.211 15.582 1.00 1.87 H new ATOM 0 HA GLU A 39 -0.353 -6.428 13.442 1.00 1.91 H new ATOM 0 HB2 GLU A 39 -2.974 -7.561 14.475 1.00 2.57 H new ATOM 0 HB3 GLU A 39 -2.826 -6.602 13.015 1.00 2.57 H new ATOM 0 HG2 GLU A 39 -1.282 -8.300 12.062 1.00 3.24 H new ATOM 0 HG3 GLU A 39 -1.445 -9.261 13.519 1.00 3.24 H new ATOM 623 N GLY A 40 -0.810 -4.206 14.408 1.00 1.33 N ATOM 624 CA GLY A 40 -1.075 -2.883 14.930 1.00 1.39 C ATOM 625 C GLY A 40 -2.482 -2.399 14.635 1.00 1.23 C ATOM 626 O GLY A 40 -3.052 -2.717 13.589 1.00 1.20 O ATOM 0 H GLY A 40 -0.088 -4.242 13.689 1.00 1.33 H new ATOM 0 HA2 GLY A 40 -0.917 -2.886 16.008 1.00 1.39 H new ATOM 0 HA3 GLY A 40 -0.359 -2.180 14.504 1.00 1.39 H new ATOM 630 N THR A 41 -3.034 -1.625 15.561 1.00 1.33 N ATOM 631 CA THR A 41 -4.380 -1.083 15.423 1.00 1.34 C ATOM 632 C THR A 41 -4.491 -0.232 14.157 1.00 1.09 C ATOM 633 O THR A 41 -5.318 -0.503 13.282 1.00 1.05 O ATOM 634 CB THR A 41 -4.736 -0.224 16.649 1.00 1.62 C ATOM 635 OG1 THR A 41 -4.309 -0.889 17.847 1.00 1.89 O ATOM 636 CG2 THR A 41 -6.235 0.033 16.715 1.00 1.79 C ATOM 0 H THR A 41 -2.564 -1.356 16.425 1.00 1.33 H new ATOM 0 HA THR A 41 -5.077 -1.918 15.351 1.00 1.34 H new ATOM 0 HB THR A 41 -4.224 0.734 16.558 1.00 1.62 H new ATOM 0 HG1 THR A 41 -4.536 -0.338 18.625 1.00 1.89 H new ATOM 0 HG21 THR A 41 -6.462 0.642 17.590 1.00 1.79 H new ATOM 0 HG22 THR A 41 -6.554 0.558 15.815 1.00 1.79 H new ATOM 0 HG23 THR A 41 -6.764 -0.917 16.788 1.00 1.79 H new ATOM 644 N GLU A 42 -3.656 0.800 14.074 1.00 1.02 N ATOM 645 CA GLU A 42 -3.617 1.683 12.914 1.00 0.87 C ATOM 646 C GLU A 42 -3.215 0.914 11.658 1.00 0.73 C ATOM 647 O GLU A 42 -3.738 1.164 10.570 1.00 0.63 O ATOM 648 CB GLU A 42 -2.628 2.827 13.167 1.00 1.05 C ATOM 649 CG GLU A 42 -2.451 3.770 11.990 1.00 1.53 C ATOM 650 CD GLU A 42 -1.455 4.870 12.284 1.00 2.12 C ATOM 651 OE1 GLU A 42 -0.242 4.585 12.344 1.00 2.82 O ATOM 652 OE2 GLU A 42 -1.880 6.026 12.482 1.00 2.42 O ATOM 0 H GLU A 42 -2.990 1.046 14.806 1.00 1.02 H new ATOM 0 HA GLU A 42 -4.615 2.094 12.758 1.00 0.87 H new ATOM 0 HB2 GLU A 42 -2.967 3.401 14.030 1.00 1.05 H new ATOM 0 HB3 GLU A 42 -1.658 2.403 13.427 1.00 1.05 H new ATOM 0 HG2 GLU A 42 -2.118 3.204 11.120 1.00 1.53 H new ATOM 0 HG3 GLU A 42 -3.413 4.213 11.733 1.00 1.53 H new ATOM 659 N SER A 43 -2.302 -0.037 11.829 1.00 0.79 N ATOM 660 CA SER A 43 -1.747 -0.802 10.718 1.00 0.75 C ATOM 661 C SER A 43 -2.839 -1.456 9.871 1.00 0.67 C ATOM 662 O SER A 43 -2.752 -1.464 8.645 1.00 0.62 O ATOM 663 CB SER A 43 -0.793 -1.871 11.253 1.00 0.94 C ATOM 664 OG SER A 43 0.065 -1.330 12.246 1.00 1.14 O ATOM 0 H SER A 43 -1.927 -0.299 12.741 1.00 0.79 H new ATOM 0 HA SER A 43 -1.204 -0.108 10.076 1.00 0.75 H new ATOM 0 HB2 SER A 43 -1.365 -2.699 11.672 1.00 0.94 H new ATOM 0 HB3 SER A 43 -0.199 -2.277 10.434 1.00 0.94 H new ATOM 0 HG SER A 43 0.966 -1.221 11.876 1.00 1.14 H new ATOM 670 N GLU A 44 -3.878 -1.971 10.523 1.00 0.72 N ATOM 671 CA GLU A 44 -4.944 -2.688 9.821 1.00 0.73 C ATOM 672 C GLU A 44 -5.711 -1.780 8.859 1.00 0.61 C ATOM 673 O GLU A 44 -6.255 -2.247 7.859 1.00 0.66 O ATOM 674 CB GLU A 44 -5.924 -3.318 10.813 1.00 0.85 C ATOM 675 CG GLU A 44 -5.330 -4.448 11.639 1.00 1.32 C ATOM 676 CD GLU A 44 -6.374 -5.149 12.479 1.00 1.96 C ATOM 677 OE1 GLU A 44 -6.624 -4.702 13.620 1.00 2.98 O ATOM 678 OE2 GLU A 44 -6.947 -6.155 12.011 1.00 1.90 O ATOM 0 H GLU A 44 -4.006 -1.907 11.533 1.00 0.72 H new ATOM 0 HA GLU A 44 -4.461 -3.472 9.239 1.00 0.73 H new ATOM 0 HB2 GLU A 44 -6.291 -2.544 11.487 1.00 0.85 H new ATOM 0 HB3 GLU A 44 -6.786 -3.697 10.264 1.00 0.85 H new ATOM 0 HG2 GLU A 44 -4.855 -5.170 10.975 1.00 1.32 H new ATOM 0 HG3 GLU A 44 -4.550 -4.050 12.288 1.00 1.32 H new ATOM 685 N ALA A 45 -5.740 -0.487 9.153 1.00 0.53 N ATOM 686 CA ALA A 45 -6.493 0.453 8.337 1.00 0.45 C ATOM 687 C ALA A 45 -5.727 0.794 7.070 1.00 0.39 C ATOM 688 O ALA A 45 -6.257 0.698 5.965 1.00 0.39 O ATOM 689 CB ALA A 45 -6.794 1.713 9.130 1.00 0.48 C ATOM 0 H ALA A 45 -5.254 -0.068 9.946 1.00 0.53 H new ATOM 0 HA ALA A 45 -7.436 -0.014 8.052 1.00 0.45 H new ATOM 0 HB1 ALA A 45 -7.358 2.408 8.508 1.00 0.48 H new ATOM 0 HB2 ALA A 45 -7.381 1.456 10.012 1.00 0.48 H new ATOM 0 HB3 ALA A 45 -5.859 2.180 9.440 1.00 0.48 H new ATOM 695 N VAL A 46 -4.474 1.178 7.236 1.00 0.36 N ATOM 696 CA VAL A 46 -3.621 1.508 6.108 1.00 0.32 C ATOM 697 C VAL A 46 -3.324 0.264 5.269 1.00 0.34 C ATOM 698 O VAL A 46 -3.212 0.341 4.045 1.00 0.35 O ATOM 699 CB VAL A 46 -2.318 2.193 6.572 1.00 0.33 C ATOM 700 CG1 VAL A 46 -1.925 1.734 7.963 1.00 0.34 C ATOM 701 CG2 VAL A 46 -1.197 1.928 5.589 1.00 0.34 C ATOM 0 H VAL A 46 -4.023 1.269 8.146 1.00 0.36 H new ATOM 0 HA VAL A 46 -4.158 2.218 5.479 1.00 0.32 H new ATOM 0 HB VAL A 46 -2.499 3.267 6.610 1.00 0.33 H new ATOM 0 HG11 VAL A 46 -1.004 2.233 8.264 1.00 0.34 H new ATOM 0 HG12 VAL A 46 -2.719 1.984 8.666 1.00 0.34 H new ATOM 0 HG13 VAL A 46 -1.769 0.655 7.960 1.00 0.34 H new ATOM 0 HG21 VAL A 46 -0.287 2.419 5.934 1.00 0.34 H new ATOM 0 HG22 VAL A 46 -1.024 0.854 5.515 1.00 0.34 H new ATOM 0 HG23 VAL A 46 -1.472 2.319 4.610 1.00 0.34 H new ATOM 711 N LYS A 47 -3.216 -0.879 5.930 1.00 0.41 N ATOM 712 CA LYS A 47 -3.081 -2.156 5.234 1.00 0.50 C ATOM 713 C LYS A 47 -4.235 -2.350 4.249 1.00 0.51 C ATOM 714 O LYS A 47 -4.043 -2.838 3.135 1.00 0.59 O ATOM 715 CB LYS A 47 -3.039 -3.312 6.245 1.00 0.63 C ATOM 716 CG LYS A 47 -3.069 -4.694 5.611 1.00 0.84 C ATOM 717 CD LYS A 47 -2.865 -5.782 6.651 1.00 1.45 C ATOM 718 CE LYS A 47 -3.142 -7.161 6.078 1.00 1.93 C ATOM 719 NZ LYS A 47 -2.722 -8.246 7.006 1.00 2.14 N ATOM 0 H LYS A 47 -3.219 -0.951 6.947 1.00 0.41 H new ATOM 0 HA LYS A 47 -2.146 -2.150 4.674 1.00 0.50 H new ATOM 0 HB2 LYS A 47 -2.136 -3.220 6.848 1.00 0.63 H new ATOM 0 HB3 LYS A 47 -3.886 -3.217 6.924 1.00 0.63 H new ATOM 0 HG2 LYS A 47 -4.023 -4.844 5.106 1.00 0.84 H new ATOM 0 HG3 LYS A 47 -2.292 -4.765 4.850 1.00 0.84 H new ATOM 0 HD2 LYS A 47 -1.842 -5.741 7.025 1.00 1.45 H new ATOM 0 HD3 LYS A 47 -3.523 -5.602 7.501 1.00 1.45 H new ATOM 0 HE2 LYS A 47 -4.207 -7.258 5.865 1.00 1.93 H new ATOM 0 HE3 LYS A 47 -2.616 -7.272 5.130 1.00 1.93 H new ATOM 0 HZ1 LYS A 47 -2.018 -8.851 6.537 1.00 2.14 H new ATOM 0 HZ2 LYS A 47 -2.304 -7.828 7.862 1.00 2.14 H new ATOM 0 HZ3 LYS A 47 -3.550 -8.818 7.269 1.00 2.14 H new ATOM 733 N GLN A 48 -5.432 -1.942 4.661 1.00 0.47 N ATOM 734 CA GLN A 48 -6.594 -1.997 3.783 1.00 0.52 C ATOM 735 C GLN A 48 -6.485 -0.918 2.717 1.00 0.48 C ATOM 736 O GLN A 48 -6.801 -1.144 1.547 1.00 0.54 O ATOM 737 CB GLN A 48 -7.889 -1.794 4.573 1.00 0.55 C ATOM 738 CG GLN A 48 -9.130 -1.827 3.696 1.00 0.85 C ATOM 739 CD GLN A 48 -10.345 -1.215 4.363 1.00 1.50 C ATOM 740 OE1 GLN A 48 -10.489 -1.254 5.585 1.00 2.23 O ATOM 741 NE2 GLN A 48 -11.227 -0.637 3.562 1.00 2.02 N ATOM 0 H GLN A 48 -5.621 -1.572 5.592 1.00 0.47 H new ATOM 0 HA GLN A 48 -6.620 -2.981 3.316 1.00 0.52 H new ATOM 0 HB2 GLN A 48 -7.969 -2.569 5.335 1.00 0.55 H new ATOM 0 HB3 GLN A 48 -7.844 -0.838 5.094 1.00 0.55 H new ATOM 0 HG2 GLN A 48 -8.926 -1.294 2.767 1.00 0.85 H new ATOM 0 HG3 GLN A 48 -9.351 -2.860 3.429 1.00 0.85 H new ATOM 0 HE21 GLN A 48 -11.070 -0.626 2.554 1.00 2.02 H new ATOM 0 HE22 GLN A 48 -12.063 -0.203 3.953 1.00 2.02 H new ATOM 750 N ALA A 49 -6.026 0.253 3.143 1.00 0.42 N ATOM 751 CA ALA A 49 -5.865 1.389 2.258 1.00 0.40 C ATOM 752 C ALA A 49 -4.967 1.037 1.080 1.00 0.39 C ATOM 753 O ALA A 49 -5.339 1.249 -0.069 1.00 0.42 O ATOM 754 CB ALA A 49 -5.300 2.572 3.026 1.00 0.36 C ATOM 0 H ALA A 49 -5.757 0.436 4.110 1.00 0.42 H new ATOM 0 HA ALA A 49 -6.844 1.661 1.864 1.00 0.40 H new ATOM 0 HB1 ALA A 49 -5.183 3.421 2.352 1.00 0.36 H new ATOM 0 HB2 ALA A 49 -5.982 2.841 3.833 1.00 0.36 H new ATOM 0 HB3 ALA A 49 -4.330 2.304 3.445 1.00 0.36 H new ATOM 760 N LEU A 50 -3.798 0.474 1.371 1.00 0.38 N ATOM 761 CA LEU A 50 -2.847 0.099 0.323 1.00 0.39 C ATOM 762 C LEU A 50 -3.401 -1.014 -0.560 1.00 0.46 C ATOM 763 O LEU A 50 -3.096 -1.073 -1.749 1.00 0.49 O ATOM 764 CB LEU A 50 -1.496 -0.326 0.915 1.00 0.39 C ATOM 765 CG LEU A 50 -0.474 0.803 1.109 1.00 0.33 C ATOM 766 CD1 LEU A 50 -0.202 1.519 -0.206 1.00 0.31 C ATOM 767 CD2 LEU A 50 -0.947 1.789 2.162 1.00 0.29 C ATOM 0 H LEU A 50 -3.485 0.267 2.319 1.00 0.38 H new ATOM 0 HA LEU A 50 -2.690 0.984 -0.293 1.00 0.39 H new ATOM 0 HB2 LEU A 50 -1.675 -0.800 1.880 1.00 0.39 H new ATOM 0 HB3 LEU A 50 -1.056 -1.083 0.265 1.00 0.39 H new ATOM 0 HG LEU A 50 0.457 0.355 1.455 1.00 0.33 H new ATOM 0 HD11 LEU A 50 0.525 2.315 -0.043 1.00 0.31 H new ATOM 0 HD12 LEU A 50 0.194 0.809 -0.932 1.00 0.31 H new ATOM 0 HD13 LEU A 50 -1.130 1.947 -0.586 1.00 0.31 H new ATOM 0 HD21 LEU A 50 -0.205 2.579 2.280 1.00 0.29 H new ATOM 0 HD22 LEU A 50 -1.896 2.226 1.851 1.00 0.29 H new ATOM 0 HD23 LEU A 50 -1.080 1.271 3.112 1.00 0.29 H new ATOM 779 N ARG A 51 -4.224 -1.884 0.020 1.00 0.52 N ATOM 780 CA ARG A 51 -4.867 -2.951 -0.743 1.00 0.61 C ATOM 781 C ARG A 51 -5.693 -2.361 -1.882 1.00 0.62 C ATOM 782 O ARG A 51 -5.545 -2.747 -3.044 1.00 0.69 O ATOM 783 CB ARG A 51 -5.765 -3.799 0.168 1.00 0.67 C ATOM 784 CG ARG A 51 -6.676 -4.756 -0.590 1.00 0.98 C ATOM 785 CD ARG A 51 -7.695 -5.413 0.330 1.00 1.49 C ATOM 786 NE ARG A 51 -7.097 -6.432 1.191 1.00 2.00 N ATOM 787 CZ ARG A 51 -7.316 -6.529 2.502 1.00 2.89 C ATOM 788 NH1 ARG A 51 -8.104 -5.653 3.118 1.00 3.39 N ATOM 789 NH2 ARG A 51 -6.753 -7.517 3.190 1.00 3.74 N ATOM 0 H ARG A 51 -4.461 -1.872 1.012 1.00 0.52 H new ATOM 0 HA ARG A 51 -4.090 -3.590 -1.161 1.00 0.61 H new ATOM 0 HB2 ARG A 51 -5.137 -4.372 0.850 1.00 0.67 H new ATOM 0 HB3 ARG A 51 -6.377 -3.136 0.779 1.00 0.67 H new ATOM 0 HG2 ARG A 51 -7.196 -4.214 -1.380 1.00 0.98 H new ATOM 0 HG3 ARG A 51 -6.074 -5.525 -1.074 1.00 0.98 H new ATOM 0 HD2 ARG A 51 -8.166 -4.650 0.949 1.00 1.49 H new ATOM 0 HD3 ARG A 51 -8.483 -5.867 -0.271 1.00 1.49 H new ATOM 0 HE ARG A 51 -6.472 -7.113 0.760 1.00 2.00 H new ATOM 0 HH11 ARG A 51 -8.545 -4.902 2.587 1.00 3.39 H new ATOM 0 HH12 ARG A 51 -8.268 -5.732 4.122 1.00 3.39 H new ATOM 0 HH21 ARG A 51 -6.158 -8.195 2.714 1.00 3.74 H new ATOM 0 HH22 ARG A 51 -6.916 -7.597 4.194 1.00 3.74 H new ATOM 803 N GLU A 52 -6.544 -1.404 -1.540 1.00 0.59 N ATOM 804 CA GLU A 52 -7.429 -0.783 -2.515 1.00 0.62 C ATOM 805 C GLU A 52 -6.693 0.280 -3.332 1.00 0.59 C ATOM 806 O GLU A 52 -7.022 0.523 -4.495 1.00 0.65 O ATOM 807 CB GLU A 52 -8.646 -0.180 -1.806 1.00 0.66 C ATOM 808 CG GLU A 52 -9.529 -1.224 -1.133 1.00 0.92 C ATOM 809 CD GLU A 52 -10.694 -0.619 -0.377 1.00 1.23 C ATOM 810 OE1 GLU A 52 -11.571 0.000 -1.019 1.00 1.45 O ATOM 811 OE2 GLU A 52 -10.747 -0.764 0.860 1.00 1.88 O ATOM 0 H GLU A 52 -6.640 -1.040 -0.592 1.00 0.59 H new ATOM 0 HA GLU A 52 -7.771 -1.551 -3.209 1.00 0.62 H new ATOM 0 HB2 GLU A 52 -8.305 0.535 -1.057 1.00 0.66 H new ATOM 0 HB3 GLU A 52 -9.241 0.377 -2.530 1.00 0.66 H new ATOM 0 HG2 GLU A 52 -9.911 -1.910 -1.889 1.00 0.92 H new ATOM 0 HG3 GLU A 52 -8.924 -1.814 -0.444 1.00 0.92 H new ATOM 818 N ALA A 53 -5.690 0.902 -2.724 1.00 0.52 N ATOM 819 CA ALA A 53 -4.904 1.929 -3.394 1.00 0.49 C ATOM 820 C ALA A 53 -4.024 1.332 -4.481 1.00 0.52 C ATOM 821 O ALA A 53 -3.933 1.875 -5.584 1.00 0.53 O ATOM 822 CB ALA A 53 -4.056 2.678 -2.382 1.00 0.43 C ATOM 0 H ALA A 53 -5.402 0.712 -1.764 1.00 0.52 H new ATOM 0 HA ALA A 53 -5.594 2.626 -3.869 1.00 0.49 H new ATOM 0 HB1 ALA A 53 -3.472 3.444 -2.892 1.00 0.43 H new ATOM 0 HB2 ALA A 53 -4.703 3.149 -1.642 1.00 0.43 H new ATOM 0 HB3 ALA A 53 -3.383 1.980 -1.884 1.00 0.43 H new ATOM 828 N GLY A 54 -3.382 0.211 -4.167 1.00 0.57 N ATOM 829 CA GLY A 54 -2.527 -0.461 -5.131 1.00 0.64 C ATOM 830 C GLY A 54 -3.276 -0.833 -6.390 1.00 0.74 C ATOM 831 O GLY A 54 -2.722 -0.801 -7.489 1.00 0.82 O ATOM 0 H GLY A 54 -3.439 -0.247 -3.257 1.00 0.57 H new ATOM 0 HA2 GLY A 54 -1.689 0.187 -5.386 1.00 0.64 H new ATOM 0 HA3 GLY A 54 -2.108 -1.360 -4.679 1.00 0.64 H new ATOM 835 N ASP A 55 -4.552 -1.154 -6.228 1.00 0.79 N ATOM 836 CA ASP A 55 -5.400 -1.506 -7.358 1.00 0.92 C ATOM 837 C ASP A 55 -5.720 -0.271 -8.185 1.00 0.88 C ATOM 838 O ASP A 55 -5.775 -0.330 -9.414 1.00 0.97 O ATOM 839 CB ASP A 55 -6.698 -2.164 -6.878 1.00 1.04 C ATOM 840 CG ASP A 55 -7.683 -2.389 -8.009 1.00 1.12 C ATOM 841 OD1 ASP A 55 -7.523 -3.381 -8.754 1.00 1.34 O ATOM 842 OD2 ASP A 55 -8.614 -1.571 -8.166 1.00 1.29 O ATOM 0 H ASP A 55 -5.023 -1.178 -5.324 1.00 0.79 H new ATOM 0 HA ASP A 55 -4.858 -2.218 -7.980 1.00 0.92 H new ATOM 0 HB2 ASP A 55 -6.466 -3.119 -6.406 1.00 1.04 H new ATOM 0 HB3 ASP A 55 -7.160 -1.536 -6.116 1.00 1.04 H new ATOM 847 N GLU A 56 -5.909 0.854 -7.504 1.00 0.79 N ATOM 848 CA GLU A 56 -6.214 2.107 -8.178 1.00 0.83 C ATOM 849 C GLU A 56 -5.020 2.569 -9.005 1.00 0.78 C ATOM 850 O GLU A 56 -5.172 2.958 -10.163 1.00 0.85 O ATOM 851 CB GLU A 56 -6.617 3.187 -7.167 1.00 0.83 C ATOM 852 CG GLU A 56 -6.946 4.528 -7.805 1.00 0.94 C ATOM 853 CD GLU A 56 -7.470 5.537 -6.808 1.00 1.27 C ATOM 854 OE1 GLU A 56 -8.680 5.491 -6.500 1.00 1.38 O ATOM 855 OE2 GLU A 56 -6.680 6.378 -6.331 1.00 2.06 O ATOM 0 H GLU A 56 -5.856 0.922 -6.488 1.00 0.79 H new ATOM 0 HA GLU A 56 -7.057 1.938 -8.848 1.00 0.83 H new ATOM 0 HB2 GLU A 56 -7.483 2.840 -6.604 1.00 0.83 H new ATOM 0 HB3 GLU A 56 -5.806 3.324 -6.452 1.00 0.83 H new ATOM 0 HG2 GLU A 56 -6.052 4.927 -8.283 1.00 0.94 H new ATOM 0 HG3 GLU A 56 -7.688 4.380 -8.590 1.00 0.94 H new ATOM 862 N PHE A 57 -3.828 2.502 -8.419 1.00 0.72 N ATOM 863 CA PHE A 57 -2.617 2.881 -9.134 1.00 0.76 C ATOM 864 C PHE A 57 -2.399 1.938 -10.313 1.00 0.82 C ATOM 865 O PHE A 57 -1.981 2.357 -11.393 1.00 0.90 O ATOM 866 CB PHE A 57 -1.397 2.860 -8.201 1.00 0.77 C ATOM 867 CG PHE A 57 -0.134 3.345 -8.861 1.00 0.94 C ATOM 868 CD1 PHE A 57 0.138 4.701 -8.966 1.00 1.07 C ATOM 869 CD2 PHE A 57 0.789 2.439 -9.360 1.00 1.05 C ATOM 870 CE1 PHE A 57 1.306 5.143 -9.560 1.00 1.26 C ATOM 871 CE2 PHE A 57 1.957 2.875 -9.956 1.00 1.25 C ATOM 872 CZ PHE A 57 2.182 4.250 -10.105 1.00 1.34 C ATOM 0 H PHE A 57 -3.677 2.191 -7.459 1.00 0.72 H new ATOM 0 HA PHE A 57 -2.738 3.899 -9.505 1.00 0.76 H new ATOM 0 HB2 PHE A 57 -1.604 3.480 -7.329 1.00 0.77 H new ATOM 0 HB3 PHE A 57 -1.242 1.843 -7.839 1.00 0.77 H new ATOM 0 HD1 PHE A 57 -0.570 5.419 -8.580 1.00 1.07 H new ATOM 0 HD2 PHE A 57 0.593 1.380 -9.282 1.00 1.05 H new ATOM 0 HE1 PHE A 57 1.526 6.200 -9.593 1.00 1.26 H new ATOM 0 HE2 PHE A 57 2.690 2.162 -10.304 1.00 1.25 H new ATOM 0 HZ PHE A 57 3.046 4.602 -10.649 1.00 1.34 H new ATOM 882 N GLU A 58 -2.734 0.671 -10.099 1.00 0.83 N ATOM 883 CA GLU A 58 -2.561 -0.366 -11.111 1.00 0.95 C ATOM 884 C GLU A 58 -3.495 -0.131 -12.296 1.00 0.99 C ATOM 885 O GLU A 58 -3.114 -0.314 -13.449 1.00 1.08 O ATOM 886 CB GLU A 58 -2.850 -1.739 -10.487 1.00 1.05 C ATOM 887 CG GLU A 58 -2.576 -2.915 -11.409 1.00 1.35 C ATOM 888 CD GLU A 58 -1.122 -3.009 -11.797 1.00 1.27 C ATOM 889 OE1 GLU A 58 -0.281 -3.222 -10.905 1.00 1.45 O ATOM 890 OE2 GLU A 58 -0.819 -2.850 -12.999 1.00 1.61 O ATOM 0 H GLU A 58 -3.132 0.334 -9.222 1.00 0.83 H new ATOM 0 HA GLU A 58 -1.534 -0.333 -11.473 1.00 0.95 H new ATOM 0 HB2 GLU A 58 -2.246 -1.850 -9.586 1.00 1.05 H new ATOM 0 HB3 GLU A 58 -3.894 -1.771 -10.177 1.00 1.05 H new ATOM 0 HG2 GLU A 58 -2.879 -3.839 -10.916 1.00 1.35 H new ATOM 0 HG3 GLU A 58 -3.185 -2.819 -12.308 1.00 1.35 H new ATOM 897 N LEU A 59 -4.717 0.282 -12.001 1.00 0.98 N ATOM 898 CA LEU A 59 -5.737 0.443 -13.022 1.00 1.10 C ATOM 899 C LEU A 59 -5.578 1.767 -13.765 1.00 1.10 C ATOM 900 O LEU A 59 -5.932 1.879 -14.939 1.00 1.24 O ATOM 901 CB LEU A 59 -7.120 0.360 -12.375 1.00 1.19 C ATOM 902 CG LEU A 59 -8.307 0.416 -13.335 1.00 1.36 C ATOM 903 CD1 LEU A 59 -8.233 -0.720 -14.343 1.00 1.59 C ATOM 904 CD2 LEU A 59 -9.611 0.360 -12.558 1.00 1.56 C ATOM 0 H LEU A 59 -5.027 0.513 -11.057 1.00 0.98 H new ATOM 0 HA LEU A 59 -5.625 -0.359 -13.752 1.00 1.10 H new ATOM 0 HB2 LEU A 59 -7.180 -0.568 -11.807 1.00 1.19 H new ATOM 0 HB3 LEU A 59 -7.216 1.177 -11.660 1.00 1.19 H new ATOM 0 HG LEU A 59 -8.269 1.358 -13.882 1.00 1.36 H new ATOM 0 HD11 LEU A 59 -9.087 -0.664 -15.018 1.00 1.59 H new ATOM 0 HD12 LEU A 59 -7.310 -0.637 -14.917 1.00 1.59 H new ATOM 0 HD13 LEU A 59 -8.249 -1.675 -13.817 1.00 1.59 H new ATOM 0 HD21 LEU A 59 -10.450 0.401 -13.252 1.00 1.56 H new ATOM 0 HD22 LEU A 59 -9.656 -0.568 -11.989 1.00 1.56 H new ATOM 0 HD23 LEU A 59 -9.664 1.208 -11.875 1.00 1.56 H new ATOM 916 N ARG A 60 -5.029 2.761 -13.088 1.00 1.00 N ATOM 917 CA ARG A 60 -4.950 4.102 -13.656 1.00 1.06 C ATOM 918 C ARG A 60 -3.587 4.376 -14.290 1.00 1.00 C ATOM 919 O ARG A 60 -3.513 4.870 -15.417 1.00 1.07 O ATOM 920 CB ARG A 60 -5.262 5.172 -12.599 1.00 1.10 C ATOM 921 CG ARG A 60 -6.718 5.218 -12.131 1.00 1.19 C ATOM 922 CD ARG A 60 -7.680 5.683 -13.224 1.00 1.31 C ATOM 923 NE ARG A 60 -7.853 4.696 -14.291 1.00 1.81 N ATOM 924 CZ ARG A 60 -8.927 3.914 -14.413 1.00 2.26 C ATOM 925 NH1 ARG A 60 -9.905 3.974 -13.519 1.00 2.15 N ATOM 926 NH2 ARG A 60 -9.025 3.067 -15.427 1.00 3.21 N ATOM 0 H ARG A 60 -4.634 2.670 -12.152 1.00 1.00 H new ATOM 0 HA ARG A 60 -5.703 4.154 -14.442 1.00 1.06 H new ATOM 0 HB2 ARG A 60 -4.623 5.001 -11.732 1.00 1.10 H new ATOM 0 HB3 ARG A 60 -4.996 6.148 -13.004 1.00 1.10 H new ATOM 0 HG2 ARG A 60 -7.016 4.227 -11.789 1.00 1.19 H new ATOM 0 HG3 ARG A 60 -6.798 5.888 -11.275 1.00 1.19 H new ATOM 0 HD2 ARG A 60 -8.650 5.901 -12.778 1.00 1.31 H new ATOM 0 HD3 ARG A 60 -7.310 6.614 -13.654 1.00 1.31 H new ATOM 0 HE ARG A 60 -7.109 4.600 -14.982 1.00 1.81 H new ATOM 0 HH11 ARG A 60 -9.838 4.621 -12.733 1.00 2.15 H new ATOM 0 HH12 ARG A 60 -10.724 3.374 -13.618 1.00 2.15 H new ATOM 0 HH21 ARG A 60 -8.277 3.011 -16.119 1.00 3.21 H new ATOM 0 HH22 ARG A 60 -9.848 2.471 -15.516 1.00 3.21 H new ATOM 940 N TYR A 61 -2.511 4.038 -13.591 1.00 0.91 N ATOM 941 CA TYR A 61 -1.173 4.407 -14.042 1.00 0.90 C ATOM 942 C TYR A 61 -0.291 3.176 -14.221 1.00 0.84 C ATOM 943 O TYR A 61 0.872 3.168 -13.814 1.00 0.83 O ATOM 944 CB TYR A 61 -0.517 5.384 -13.056 1.00 0.96 C ATOM 945 CG TYR A 61 -1.263 6.696 -12.892 1.00 1.05 C ATOM 946 CD1 TYR A 61 -1.561 7.497 -13.990 1.00 1.27 C ATOM 947 CD2 TYR A 61 -1.661 7.137 -11.634 1.00 1.04 C ATOM 948 CE1 TYR A 61 -2.235 8.695 -13.838 1.00 1.38 C ATOM 949 CE2 TYR A 61 -2.337 8.333 -11.476 1.00 1.14 C ATOM 950 CZ TYR A 61 -2.621 9.107 -12.581 1.00 1.27 C ATOM 951 OH TYR A 61 -3.292 10.300 -12.429 1.00 1.41 O ATOM 0 H TYR A 61 -2.536 3.513 -12.717 1.00 0.91 H new ATOM 0 HA TYR A 61 -1.276 4.899 -15.009 1.00 0.90 H new ATOM 0 HB2 TYR A 61 -0.436 4.901 -12.082 1.00 0.96 H new ATOM 0 HB3 TYR A 61 0.498 5.595 -13.392 1.00 0.96 H new ATOM 0 HD1 TYR A 61 -1.261 7.178 -14.977 1.00 1.27 H new ATOM 0 HD2 TYR A 61 -1.438 6.535 -10.766 1.00 1.04 H new ATOM 0 HE1 TYR A 61 -2.458 9.305 -14.701 1.00 1.38 H new ATOM 0 HE2 TYR A 61 -2.641 8.659 -10.492 1.00 1.14 H new ATOM 0 HH TYR A 61 -3.493 10.444 -11.481 1.00 1.41 H new ATOM 961 N ARG A 62 -0.839 2.145 -14.855 1.00 0.86 N ATOM 962 CA ARG A 62 -0.081 0.928 -15.130 1.00 0.85 C ATOM 963 C ARG A 62 1.110 1.229 -16.042 1.00 0.87 C ATOM 964 O ARG A 62 2.157 0.590 -15.942 1.00 0.85 O ATOM 965 CB ARG A 62 -0.982 -0.137 -15.763 1.00 0.95 C ATOM 966 CG ARG A 62 -0.267 -1.447 -16.065 1.00 1.04 C ATOM 967 CD ARG A 62 -1.246 -2.535 -16.477 1.00 1.23 C ATOM 968 NE ARG A 62 -2.138 -2.905 -15.381 1.00 1.73 N ATOM 969 CZ ARG A 62 -3.361 -3.408 -15.550 1.00 2.16 C ATOM 970 NH1 ARG A 62 -3.860 -3.559 -16.775 1.00 2.24 N ATOM 971 NH2 ARG A 62 -4.092 -3.747 -14.496 1.00 3.02 N ATOM 0 H ARG A 62 -1.803 2.127 -15.188 1.00 0.86 H new ATOM 0 HA ARG A 62 0.298 0.542 -14.184 1.00 0.85 H new ATOM 0 HB2 ARG A 62 -1.818 -0.337 -15.093 1.00 0.95 H new ATOM 0 HB3 ARG A 62 -1.402 0.259 -16.688 1.00 0.95 H new ATOM 0 HG2 ARG A 62 0.460 -1.290 -16.861 1.00 1.04 H new ATOM 0 HG3 ARG A 62 0.289 -1.771 -15.185 1.00 1.04 H new ATOM 0 HD2 ARG A 62 -1.837 -2.190 -17.326 1.00 1.23 H new ATOM 0 HD3 ARG A 62 -0.694 -3.414 -16.809 1.00 1.23 H new ATOM 0 HE ARG A 62 -1.804 -2.770 -14.427 1.00 1.73 H new ATOM 0 HH11 ARG A 62 -3.306 -3.290 -17.588 1.00 2.24 H new ATOM 0 HH12 ARG A 62 -4.796 -3.944 -16.900 1.00 2.24 H new ATOM 0 HH21 ARG A 62 -3.718 -3.623 -13.555 1.00 3.02 H new ATOM 0 HH22 ARG A 62 -5.028 -4.132 -14.627 1.00 3.02 H new ATOM 985 N ARG A 63 0.951 2.223 -16.914 1.00 0.94 N ATOM 986 CA ARG A 63 2.029 2.637 -17.809 1.00 1.01 C ATOM 987 C ARG A 63 3.231 3.137 -17.013 1.00 0.95 C ATOM 988 O ARG A 63 4.378 2.926 -17.405 1.00 0.99 O ATOM 989 CB ARG A 63 1.534 3.721 -18.776 1.00 1.16 C ATOM 990 CG ARG A 63 0.561 3.198 -19.827 1.00 1.70 C ATOM 991 CD ARG A 63 1.275 2.602 -21.038 1.00 2.14 C ATOM 992 NE ARG A 63 2.391 1.730 -20.670 1.00 2.71 N ATOM 993 CZ ARG A 63 2.424 0.415 -20.888 1.00 3.58 C ATOM 994 NH1 ARG A 63 1.394 -0.196 -21.464 1.00 3.92 N ATOM 995 NH2 ARG A 63 3.492 -0.283 -20.534 1.00 4.52 N ATOM 0 H ARG A 63 0.088 2.756 -17.019 1.00 0.94 H new ATOM 0 HA ARG A 63 2.344 1.771 -18.391 1.00 1.01 H new ATOM 0 HB2 ARG A 63 1.049 4.513 -18.205 1.00 1.16 H new ATOM 0 HB3 ARG A 63 2.392 4.169 -19.277 1.00 1.16 H new ATOM 0 HG2 ARG A 63 -0.081 2.440 -19.378 1.00 1.70 H new ATOM 0 HG3 ARG A 63 -0.087 4.011 -20.155 1.00 1.70 H new ATOM 0 HD2 ARG A 63 0.559 2.035 -21.633 1.00 2.14 H new ATOM 0 HD3 ARG A 63 1.645 3.410 -21.669 1.00 2.14 H new ATOM 0 HE ARG A 63 3.198 2.157 -20.216 1.00 2.71 H new ATOM 0 HH11 ARG A 63 0.573 0.341 -21.742 1.00 3.92 H new ATOM 0 HH12 ARG A 63 1.425 -1.202 -21.628 1.00 3.92 H new ATOM 0 HH21 ARG A 63 4.285 0.185 -20.096 1.00 4.52 H new ATOM 0 HH22 ARG A 63 3.521 -1.289 -20.699 1.00 4.52 H new ATOM 1009 N ALA A 64 2.961 3.778 -15.885 1.00 0.90 N ATOM 1010 CA ALA A 64 4.017 4.240 -15.003 1.00 0.89 C ATOM 1011 C ALA A 64 4.609 3.066 -14.238 1.00 0.75 C ATOM 1012 O ALA A 64 5.823 2.970 -14.064 1.00 0.73 O ATOM 1013 CB ALA A 64 3.483 5.283 -14.038 1.00 0.94 C ATOM 0 H ALA A 64 2.017 3.989 -15.561 1.00 0.90 H new ATOM 0 HA ALA A 64 4.801 4.698 -15.606 1.00 0.89 H new ATOM 0 HB1 ALA A 64 4.287 5.619 -13.384 1.00 0.94 H new ATOM 0 HB2 ALA A 64 3.093 6.132 -14.599 1.00 0.94 H new ATOM 0 HB3 ALA A 64 2.684 4.848 -13.437 1.00 0.94 H new ATOM 1019 N PHE A 65 3.738 2.164 -13.807 1.00 0.69 N ATOM 1020 CA PHE A 65 4.144 0.999 -13.030 1.00 0.61 C ATOM 1021 C PHE A 65 5.116 0.121 -13.823 1.00 0.59 C ATOM 1022 O PHE A 65 6.200 -0.210 -13.339 1.00 0.59 O ATOM 1023 CB PHE A 65 2.913 0.182 -12.616 1.00 0.62 C ATOM 1024 CG PHE A 65 3.205 -0.873 -11.586 1.00 0.59 C ATOM 1025 CD1 PHE A 65 3.323 -0.534 -10.249 1.00 0.60 C ATOM 1026 CD2 PHE A 65 3.360 -2.202 -11.952 1.00 0.64 C ATOM 1027 CE1 PHE A 65 3.592 -1.496 -9.298 1.00 0.64 C ATOM 1028 CE2 PHE A 65 3.629 -3.168 -11.003 1.00 0.68 C ATOM 1029 CZ PHE A 65 3.745 -2.814 -9.674 1.00 0.66 C ATOM 0 H PHE A 65 2.735 2.218 -13.984 1.00 0.69 H new ATOM 0 HA PHE A 65 4.656 1.351 -12.134 1.00 0.61 H new ATOM 0 HB2 PHE A 65 2.154 0.859 -12.224 1.00 0.62 H new ATOM 0 HB3 PHE A 65 2.490 -0.294 -13.501 1.00 0.62 H new ATOM 0 HD1 PHE A 65 3.203 0.496 -9.947 1.00 0.60 H new ATOM 0 HD2 PHE A 65 3.269 -2.484 -12.991 1.00 0.64 H new ATOM 0 HE1 PHE A 65 3.683 -1.217 -8.259 1.00 0.64 H new ATOM 0 HE2 PHE A 65 3.749 -4.199 -11.300 1.00 0.68 H new ATOM 0 HZ PHE A 65 3.955 -3.568 -8.930 1.00 0.66 H new ATOM 1039 N SER A 66 4.729 -0.239 -15.044 1.00 0.64 N ATOM 1040 CA SER A 66 5.551 -1.097 -15.896 1.00 0.68 C ATOM 1041 C SER A 66 6.910 -0.459 -16.187 1.00 0.66 C ATOM 1042 O SER A 66 7.928 -1.146 -16.250 1.00 0.68 O ATOM 1043 CB SER A 66 4.823 -1.390 -17.211 1.00 0.83 C ATOM 1044 OG SER A 66 3.536 -1.938 -16.970 1.00 1.20 O ATOM 0 H SER A 66 3.848 0.051 -15.468 1.00 0.64 H new ATOM 0 HA SER A 66 5.722 -2.031 -15.360 1.00 0.68 H new ATOM 0 HB2 SER A 66 4.728 -0.472 -17.791 1.00 0.83 H new ATOM 0 HB3 SER A 66 5.412 -2.085 -17.809 1.00 0.83 H new ATOM 0 HG SER A 66 2.930 -1.230 -16.668 1.00 1.20 H new ATOM 1050 N ASP A 67 6.922 0.856 -16.343 1.00 0.68 N ATOM 1051 CA ASP A 67 8.150 1.569 -16.676 1.00 0.73 C ATOM 1052 C ASP A 67 9.062 1.720 -15.459 1.00 0.65 C ATOM 1053 O ASP A 67 10.244 1.379 -15.515 1.00 0.66 O ATOM 1054 CB ASP A 67 7.830 2.945 -17.263 1.00 0.89 C ATOM 1055 CG ASP A 67 9.076 3.754 -17.545 1.00 1.36 C ATOM 1056 OD1 ASP A 67 9.746 3.489 -18.563 1.00 1.41 O ATOM 1057 OD2 ASP A 67 9.392 4.662 -16.750 1.00 2.06 O ATOM 0 H ASP A 67 6.099 1.451 -16.245 1.00 0.68 H new ATOM 0 HA ASP A 67 8.679 0.976 -17.422 1.00 0.73 H new ATOM 0 HB2 ASP A 67 7.264 2.821 -18.186 1.00 0.89 H new ATOM 0 HB3 ASP A 67 7.193 3.494 -16.570 1.00 0.89 H new ATOM 1062 N LEU A 68 8.507 2.210 -14.356 1.00 0.63 N ATOM 1063 CA LEU A 68 9.300 2.498 -13.166 1.00 0.66 C ATOM 1064 C LEU A 68 9.862 1.226 -12.535 1.00 0.57 C ATOM 1065 O LEU A 68 10.921 1.259 -11.908 1.00 0.63 O ATOM 1066 CB LEU A 68 8.467 3.279 -12.147 1.00 0.75 C ATOM 1067 CG LEU A 68 8.082 4.698 -12.576 1.00 0.81 C ATOM 1068 CD1 LEU A 68 7.205 5.362 -11.527 1.00 1.64 C ATOM 1069 CD2 LEU A 68 9.327 5.536 -12.827 1.00 1.07 C ATOM 0 H LEU A 68 7.513 2.416 -14.261 1.00 0.63 H new ATOM 0 HA LEU A 68 10.147 3.110 -13.476 1.00 0.66 H new ATOM 0 HB2 LEU A 68 7.555 2.719 -11.940 1.00 0.75 H new ATOM 0 HB3 LEU A 68 9.025 3.337 -11.212 1.00 0.75 H new ATOM 0 HG LEU A 68 7.514 4.628 -13.504 1.00 0.81 H new ATOM 0 HD11 LEU A 68 6.945 6.369 -11.854 1.00 1.64 H new ATOM 0 HD12 LEU A 68 6.295 4.778 -11.391 1.00 1.64 H new ATOM 0 HD13 LEU A 68 7.746 5.416 -10.582 1.00 1.64 H new ATOM 0 HD21 LEU A 68 9.034 6.541 -13.131 1.00 1.07 H new ATOM 0 HD22 LEU A 68 9.919 5.591 -11.913 1.00 1.07 H new ATOM 0 HD23 LEU A 68 9.921 5.077 -13.617 1.00 1.07 H new ATOM 1081 N THR A 69 9.172 0.103 -12.714 1.00 0.49 N ATOM 1082 CA THR A 69 9.654 -1.167 -12.175 1.00 0.49 C ATOM 1083 C THR A 69 10.930 -1.623 -12.877 1.00 0.46 C ATOM 1084 O THR A 69 11.739 -2.345 -12.299 1.00 0.51 O ATOM 1085 CB THR A 69 8.589 -2.280 -12.260 1.00 0.51 C ATOM 1086 OG1 THR A 69 7.914 -2.238 -13.526 1.00 0.71 O ATOM 1087 CG2 THR A 69 7.577 -2.150 -11.132 1.00 0.63 C ATOM 0 H THR A 69 8.289 0.045 -13.221 1.00 0.49 H new ATOM 0 HA THR A 69 9.873 -0.987 -11.123 1.00 0.49 H new ATOM 0 HB THR A 69 9.099 -3.238 -12.162 1.00 0.51 H new ATOM 0 HG1 THR A 69 7.157 -1.618 -13.473 1.00 0.71 H new ATOM 0 HG21 THR A 69 6.837 -2.946 -11.214 1.00 0.63 H new ATOM 0 HG22 THR A 69 8.089 -2.228 -10.173 1.00 0.63 H new ATOM 0 HG23 THR A 69 7.079 -1.183 -11.200 1.00 0.63 H new ATOM 1095 N SER A 70 11.123 -1.181 -14.115 1.00 0.46 N ATOM 1096 CA SER A 70 12.328 -1.523 -14.857 1.00 0.49 C ATOM 1097 C SER A 70 13.507 -0.685 -14.375 1.00 0.48 C ATOM 1098 O SER A 70 14.653 -1.130 -14.408 1.00 0.53 O ATOM 1099 CB SER A 70 12.106 -1.334 -16.358 1.00 0.57 C ATOM 1100 OG SER A 70 11.031 -2.142 -16.813 1.00 1.31 O ATOM 0 H SER A 70 10.465 -0.589 -14.622 1.00 0.46 H new ATOM 0 HA SER A 70 12.559 -2.573 -14.677 1.00 0.49 H new ATOM 0 HB2 SER A 70 11.895 -0.286 -16.570 1.00 0.57 H new ATOM 0 HB3 SER A 70 13.016 -1.592 -16.900 1.00 0.57 H new ATOM 0 HG SER A 70 10.180 -1.728 -16.559 1.00 1.31 H new ATOM 1106 N GLN A 71 13.221 0.523 -13.906 1.00 0.49 N ATOM 1107 CA GLN A 71 14.251 1.383 -13.345 1.00 0.53 C ATOM 1108 C GLN A 71 14.594 0.930 -11.931 1.00 0.46 C ATOM 1109 O GLN A 71 15.739 1.025 -11.488 1.00 0.53 O ATOM 1110 CB GLN A 71 13.789 2.843 -13.334 1.00 0.63 C ATOM 1111 CG GLN A 71 14.800 3.793 -12.714 1.00 0.69 C ATOM 1112 CD GLN A 71 14.299 5.224 -12.639 1.00 0.83 C ATOM 1113 OE1 GLN A 71 14.508 6.013 -13.562 1.00 1.22 O ATOM 1114 NE2 GLN A 71 13.627 5.568 -11.550 1.00 0.82 N ATOM 0 H GLN A 71 12.285 0.928 -13.904 1.00 0.49 H new ATOM 0 HA GLN A 71 15.142 1.309 -13.969 1.00 0.53 H new ATOM 0 HB2 GLN A 71 13.585 3.159 -14.357 1.00 0.63 H new ATOM 0 HB3 GLN A 71 12.850 2.915 -12.785 1.00 0.63 H new ATOM 0 HG2 GLN A 71 15.048 3.447 -11.710 1.00 0.69 H new ATOM 0 HG3 GLN A 71 15.721 3.766 -13.297 1.00 0.69 H new ATOM 0 HE21 GLN A 71 13.475 4.885 -10.808 1.00 0.82 H new ATOM 0 HE22 GLN A 71 13.262 6.516 -11.454 1.00 0.82 H new ATOM 1123 N LEU A 72 13.591 0.411 -11.236 1.00 0.39 N ATOM 1124 CA LEU A 72 13.765 -0.067 -9.870 1.00 0.33 C ATOM 1125 C LEU A 72 14.125 -1.549 -9.872 1.00 0.34 C ATOM 1126 O LEU A 72 13.938 -2.237 -8.874 1.00 0.37 O ATOM 1127 CB LEU A 72 12.479 0.156 -9.058 1.00 0.37 C ATOM 1128 CG LEU A 72 12.663 0.867 -7.714 1.00 0.46 C ATOM 1129 CD1 LEU A 72 11.339 0.959 -6.974 1.00 0.96 C ATOM 1130 CD2 LEU A 72 13.706 0.164 -6.858 1.00 0.92 C ATOM 0 H LEU A 72 12.643 0.310 -11.598 1.00 0.39 H new ATOM 0 HA LEU A 72 14.576 0.495 -9.408 1.00 0.33 H new ATOM 0 HB2 LEU A 72 11.783 0.736 -9.664 1.00 0.37 H new ATOM 0 HB3 LEU A 72 12.012 -0.812 -8.876 1.00 0.37 H new ATOM 0 HG LEU A 72 13.020 1.877 -7.915 1.00 0.46 H new ATOM 0 HD11 LEU A 72 11.489 1.467 -6.021 1.00 0.96 H new ATOM 0 HD12 LEU A 72 10.624 1.520 -7.576 1.00 0.96 H new ATOM 0 HD13 LEU A 72 10.953 -0.044 -6.793 1.00 0.96 H new ATOM 0 HD21 LEU A 72 13.815 0.692 -5.910 1.00 0.92 H new ATOM 0 HD22 LEU A 72 13.390 -0.862 -6.668 1.00 0.92 H new ATOM 0 HD23 LEU A 72 14.662 0.158 -7.381 1.00 0.92 H new ATOM 1142 N HIS A 73 14.639 -2.027 -11.003 1.00 0.41 N ATOM 1143 CA HIS A 73 15.041 -3.426 -11.140 1.00 0.46 C ATOM 1144 C HIS A 73 15.990 -3.823 -10.007 1.00 0.41 C ATOM 1145 O HIS A 73 17.079 -3.259 -9.869 1.00 0.45 O ATOM 1146 CB HIS A 73 15.694 -3.675 -12.514 1.00 0.60 C ATOM 1147 CG HIS A 73 17.001 -2.966 -12.734 1.00 1.34 C ATOM 1148 ND1 HIS A 73 18.204 -3.629 -12.844 1.00 2.07 N ATOM 1149 CD2 HIS A 73 17.292 -1.650 -12.871 1.00 2.33 C ATOM 1150 CE1 HIS A 73 19.171 -2.756 -13.038 1.00 2.86 C ATOM 1151 NE2 HIS A 73 18.645 -1.548 -13.060 1.00 3.01 N ATOM 0 H HIS A 73 14.788 -1.464 -11.841 1.00 0.41 H new ATOM 0 HA HIS A 73 14.148 -4.048 -11.074 1.00 0.46 H new ATOM 0 HB2 HIS A 73 15.854 -4.746 -12.634 1.00 0.60 H new ATOM 0 HB3 HIS A 73 14.996 -3.368 -13.292 1.00 0.60 H new ATOM 0 HD2 HIS A 73 16.587 -0.832 -12.837 1.00 2.33 H new ATOM 0 HE1 HIS A 73 20.218 -2.991 -13.159 1.00 2.86 H new ATOM 0 HE2 HIS A 73 19.161 -0.679 -13.196 1.00 3.01 H new ATOM 1160 N ILE A 74 15.569 -4.772 -9.185 1.00 0.37 N ATOM 1161 CA ILE A 74 16.360 -5.164 -8.036 1.00 0.36 C ATOM 1162 C ILE A 74 17.510 -6.086 -8.452 1.00 0.45 C ATOM 1163 O ILE A 74 17.320 -7.265 -8.747 1.00 0.61 O ATOM 1164 CB ILE A 74 15.488 -5.818 -6.933 1.00 0.31 C ATOM 1165 CG1 ILE A 74 16.360 -6.199 -5.738 1.00 0.31 C ATOM 1166 CG2 ILE A 74 14.725 -7.029 -7.458 1.00 0.35 C ATOM 1167 CD1 ILE A 74 15.578 -6.721 -4.562 1.00 0.34 C ATOM 0 H ILE A 74 14.691 -5.280 -9.293 1.00 0.37 H new ATOM 0 HA ILE A 74 16.790 -4.257 -7.611 1.00 0.36 H new ATOM 0 HB ILE A 74 14.745 -5.088 -6.612 1.00 0.31 H new ATOM 0 HG12 ILE A 74 17.079 -6.956 -6.050 1.00 0.31 H new ATOM 0 HG13 ILE A 74 16.933 -5.326 -5.424 1.00 0.31 H new ATOM 0 HG21 ILE A 74 14.126 -7.458 -6.655 1.00 0.35 H new ATOM 0 HG22 ILE A 74 14.071 -6.721 -8.273 1.00 0.35 H new ATOM 0 HG23 ILE A 74 15.432 -7.775 -7.822 1.00 0.35 H new ATOM 0 HD11 ILE A 74 16.263 -6.971 -3.752 1.00 0.34 H new ATOM 0 HD12 ILE A 74 14.878 -5.958 -4.223 1.00 0.34 H new ATOM 0 HD13 ILE A 74 15.026 -7.613 -4.859 1.00 0.34 H new ATOM 1179 N THR A 75 18.698 -5.509 -8.534 1.00 0.61 N ATOM 1180 CA THR A 75 19.898 -6.253 -8.864 1.00 0.73 C ATOM 1181 C THR A 75 20.499 -6.868 -7.600 1.00 0.58 C ATOM 1182 O THR A 75 20.489 -6.244 -6.538 1.00 0.57 O ATOM 1183 CB THR A 75 20.927 -5.321 -9.537 1.00 1.02 C ATOM 1184 OG1 THR A 75 20.312 -4.658 -10.650 1.00 1.38 O ATOM 1185 CG2 THR A 75 22.149 -6.087 -10.021 1.00 1.56 C ATOM 0 H THR A 75 18.855 -4.514 -8.374 1.00 0.61 H new ATOM 0 HA THR A 75 19.638 -7.054 -9.556 1.00 0.73 H new ATOM 0 HB THR A 75 21.257 -4.594 -8.795 1.00 1.02 H new ATOM 0 HG1 THR A 75 20.964 -4.064 -11.078 1.00 1.38 H new ATOM 0 HG21 THR A 75 22.850 -5.396 -10.489 1.00 1.56 H new ATOM 0 HG22 THR A 75 22.631 -6.575 -9.174 1.00 1.56 H new ATOM 0 HG23 THR A 75 21.842 -6.840 -10.747 1.00 1.56 H new ATOM 1193 N PRO A 76 20.996 -8.111 -7.684 1.00 0.66 N ATOM 1194 CA PRO A 76 21.644 -8.781 -6.554 1.00 0.73 C ATOM 1195 C PRO A 76 22.829 -7.984 -6.015 1.00 0.72 C ATOM 1196 O PRO A 76 23.929 -8.024 -6.572 1.00 0.81 O ATOM 1197 CB PRO A 76 22.113 -10.123 -7.135 1.00 0.93 C ATOM 1198 CG PRO A 76 22.054 -9.955 -8.615 1.00 1.06 C ATOM 1199 CD PRO A 76 20.948 -8.976 -8.872 1.00 0.90 C ATOM 0 HA PRO A 76 20.965 -8.893 -5.708 1.00 0.73 H new ATOM 0 HB2 PRO A 76 23.125 -10.361 -6.807 1.00 0.93 H new ATOM 0 HB3 PRO A 76 21.470 -10.940 -6.806 1.00 0.93 H new ATOM 0 HG2 PRO A 76 23.002 -9.585 -9.004 1.00 1.06 H new ATOM 0 HG3 PRO A 76 21.856 -10.906 -9.109 1.00 1.06 H new ATOM 0 HD2 PRO A 76 21.112 -8.412 -9.790 1.00 0.90 H new ATOM 0 HD3 PRO A 76 19.983 -9.473 -8.972 1.00 0.90 H new ATOM 1207 N GLY A 77 22.592 -7.246 -4.941 1.00 0.86 N ATOM 1208 CA GLY A 77 23.636 -6.439 -4.347 1.00 1.10 C ATOM 1209 C GLY A 77 23.289 -4.964 -4.329 1.00 1.00 C ATOM 1210 O GLY A 77 24.065 -4.149 -3.829 1.00 1.32 O ATOM 0 H GLY A 77 21.690 -7.192 -4.468 1.00 0.86 H new ATOM 0 HA2 GLY A 77 23.818 -6.779 -3.327 1.00 1.10 H new ATOM 0 HA3 GLY A 77 24.563 -6.584 -4.901 1.00 1.10 H new ATOM 1214 N THR A 78 22.133 -4.616 -4.888 1.00 0.85 N ATOM 1215 CA THR A 78 21.624 -3.252 -4.821 1.00 0.82 C ATOM 1216 C THR A 78 21.424 -2.829 -3.366 1.00 0.85 C ATOM 1217 O THR A 78 20.614 -3.409 -2.646 1.00 1.52 O ATOM 1218 CB THR A 78 20.287 -3.123 -5.587 1.00 0.90 C ATOM 1219 OG1 THR A 78 20.499 -3.377 -6.984 1.00 1.52 O ATOM 1220 CG2 THR A 78 19.678 -1.738 -5.413 1.00 1.15 C ATOM 0 H THR A 78 21.530 -5.264 -5.394 1.00 0.85 H new ATOM 0 HA THR A 78 22.359 -2.597 -5.288 1.00 0.82 H new ATOM 0 HB THR A 78 19.594 -3.857 -5.176 1.00 0.90 H new ATOM 0 HG1 THR A 78 19.851 -2.865 -7.512 1.00 1.52 H new ATOM 0 HG21 THR A 78 18.739 -1.681 -5.964 1.00 1.15 H new ATOM 0 HG22 THR A 78 19.489 -1.554 -4.355 1.00 1.15 H new ATOM 0 HG23 THR A 78 20.369 -0.986 -5.795 1.00 1.15 H new ATOM 1228 N ALA A 79 22.204 -1.854 -2.929 1.00 0.68 N ATOM 1229 CA ALA A 79 22.113 -1.345 -1.569 1.00 0.73 C ATOM 1230 C ALA A 79 20.961 -0.351 -1.437 1.00 0.62 C ATOM 1231 O ALA A 79 20.416 0.110 -2.444 1.00 0.56 O ATOM 1232 CB ALA A 79 23.429 -0.691 -1.176 1.00 0.85 C ATOM 0 H ALA A 79 22.913 -1.396 -3.501 1.00 0.68 H new ATOM 0 HA ALA A 79 21.915 -2.179 -0.896 1.00 0.73 H new ATOM 0 HB1 ALA A 79 23.356 -0.311 -0.157 1.00 0.85 H new ATOM 0 HB2 ALA A 79 24.232 -1.426 -1.233 1.00 0.85 H new ATOM 0 HB3 ALA A 79 23.643 0.134 -1.856 1.00 0.85 H new ATOM 1238 N TYR A 80 20.599 -0.017 -0.199 1.00 0.63 N ATOM 1239 CA TYR A 80 19.538 0.959 0.051 1.00 0.58 C ATOM 1240 C TYR A 80 19.881 2.300 -0.586 1.00 0.50 C ATOM 1241 O TYR A 80 18.999 3.011 -1.058 1.00 0.46 O ATOM 1242 CB TYR A 80 19.289 1.145 1.556 1.00 0.67 C ATOM 1243 CG TYR A 80 18.338 2.282 1.876 1.00 0.80 C ATOM 1244 CD1 TYR A 80 16.977 2.168 1.616 1.00 0.89 C ATOM 1245 CD2 TYR A 80 18.797 3.465 2.447 1.00 1.14 C ATOM 1246 CE1 TYR A 80 16.104 3.196 1.914 1.00 1.24 C ATOM 1247 CE2 TYR A 80 17.927 4.496 2.750 1.00 1.55 C ATOM 1248 CZ TYR A 80 16.603 4.382 2.445 1.00 1.58 C ATOM 1249 OH TYR A 80 15.710 5.374 2.787 1.00 2.03 O ATOM 0 H TYR A 80 21.022 -0.406 0.644 1.00 0.63 H new ATOM 0 HA TYR A 80 18.625 0.572 -0.401 1.00 0.58 H new ATOM 0 HB2 TYR A 80 18.887 0.219 1.967 1.00 0.67 H new ATOM 0 HB3 TYR A 80 20.241 1.327 2.054 1.00 0.67 H new ATOM 0 HD1 TYR A 80 16.596 1.260 1.173 1.00 0.89 H new ATOM 0 HD2 TYR A 80 19.850 3.580 2.657 1.00 1.14 H new ATOM 0 HE1 TYR A 80 15.045 3.081 1.737 1.00 1.24 H new ATOM 0 HE2 TYR A 80 18.296 5.391 3.228 1.00 1.55 H new ATOM 0 HH TYR A 80 15.922 6.191 2.289 1.00 2.03 H new ATOM 1259 N GLN A 81 21.165 2.635 -0.602 1.00 0.56 N ATOM 1260 CA GLN A 81 21.626 3.870 -1.219 1.00 0.59 C ATOM 1261 C GLN A 81 21.148 3.954 -2.668 1.00 0.54 C ATOM 1262 O GLN A 81 20.633 4.983 -3.102 1.00 0.63 O ATOM 1263 CB GLN A 81 23.155 3.953 -1.149 1.00 0.72 C ATOM 1264 CG GLN A 81 23.724 5.279 -1.633 1.00 0.84 C ATOM 1265 CD GLN A 81 23.180 6.466 -0.859 1.00 1.40 C ATOM 1266 OE1 GLN A 81 22.827 6.352 0.317 1.00 2.01 O ATOM 1267 NE2 GLN A 81 23.117 7.618 -1.506 1.00 2.18 N ATOM 0 H GLN A 81 21.907 2.066 -0.193 1.00 0.56 H new ATOM 0 HA GLN A 81 21.206 4.714 -0.672 1.00 0.59 H new ATOM 0 HB2 GLN A 81 23.471 3.788 -0.119 1.00 0.72 H new ATOM 0 HB3 GLN A 81 23.580 3.147 -1.746 1.00 0.72 H new ATOM 0 HG2 GLN A 81 24.810 5.258 -1.543 1.00 0.84 H new ATOM 0 HG3 GLN A 81 23.494 5.404 -2.691 1.00 0.84 H new ATOM 0 HE21 GLN A 81 23.418 7.674 -2.479 1.00 2.18 H new ATOM 0 HE22 GLN A 81 22.767 8.451 -1.032 1.00 2.18 H new ATOM 1276 N SER A 82 21.284 2.852 -3.397 1.00 0.48 N ATOM 1277 CA SER A 82 20.854 2.792 -4.787 1.00 0.47 C ATOM 1278 C SER A 82 19.330 2.740 -4.874 1.00 0.40 C ATOM 1279 O SER A 82 18.721 3.412 -5.705 1.00 0.42 O ATOM 1280 CB SER A 82 21.465 1.566 -5.464 1.00 0.55 C ATOM 1281 OG SER A 82 22.859 1.505 -5.221 1.00 1.17 O ATOM 0 H SER A 82 21.691 1.985 -3.046 1.00 0.48 H new ATOM 0 HA SER A 82 21.196 3.691 -5.301 1.00 0.47 H new ATOM 0 HB2 SER A 82 20.985 0.661 -5.091 1.00 0.55 H new ATOM 0 HB3 SER A 82 21.279 1.606 -6.537 1.00 0.55 H new ATOM 0 HG SER A 82 23.233 0.713 -5.660 1.00 1.17 H new ATOM 1287 N PHE A 83 18.725 1.952 -3.989 1.00 0.36 N ATOM 1288 CA PHE A 83 17.271 1.819 -3.934 1.00 0.33 C ATOM 1289 C PHE A 83 16.620 3.182 -3.688 1.00 0.31 C ATOM 1290 O PHE A 83 15.582 3.506 -4.269 1.00 0.32 O ATOM 1291 CB PHE A 83 16.884 0.826 -2.822 1.00 0.35 C ATOM 1292 CG PHE A 83 15.408 0.534 -2.721 1.00 0.33 C ATOM 1293 CD1 PHE A 83 14.825 -0.452 -3.505 1.00 0.38 C ATOM 1294 CD2 PHE A 83 14.601 1.258 -1.856 1.00 0.32 C ATOM 1295 CE1 PHE A 83 13.470 -0.710 -3.425 1.00 0.41 C ATOM 1296 CE2 PHE A 83 13.246 1.001 -1.772 1.00 0.34 C ATOM 1297 CZ PHE A 83 12.691 -0.025 -2.514 1.00 0.38 C ATOM 0 H PHE A 83 19.222 1.393 -3.296 1.00 0.36 H new ATOM 0 HA PHE A 83 16.911 1.438 -4.890 1.00 0.33 H new ATOM 0 HB2 PHE A 83 17.415 -0.111 -2.990 1.00 0.35 H new ATOM 0 HB3 PHE A 83 17.228 1.220 -1.866 1.00 0.35 H new ATOM 0 HD1 PHE A 83 15.438 -1.024 -4.186 1.00 0.38 H new ATOM 0 HD2 PHE A 83 15.037 2.032 -1.241 1.00 0.32 H new ATOM 0 HE1 PHE A 83 13.021 -1.447 -4.074 1.00 0.41 H new ATOM 0 HE2 PHE A 83 12.621 1.601 -1.127 1.00 0.34 H new ATOM 0 HZ PHE A 83 11.652 -0.290 -2.382 1.00 0.38 H new ATOM 1307 N GLU A 84 17.258 3.988 -2.848 1.00 0.34 N ATOM 1308 CA GLU A 84 16.730 5.294 -2.493 1.00 0.39 C ATOM 1309 C GLU A 84 16.874 6.275 -3.649 1.00 0.37 C ATOM 1310 O GLU A 84 16.060 7.178 -3.794 1.00 0.40 O ATOM 1311 CB GLU A 84 17.433 5.838 -1.245 1.00 0.51 C ATOM 1312 CG GLU A 84 16.864 7.161 -0.761 1.00 0.64 C ATOM 1313 CD GLU A 84 17.519 7.645 0.511 1.00 0.90 C ATOM 1314 OE1 GLU A 84 18.658 8.154 0.440 1.00 1.58 O ATOM 1315 OE2 GLU A 84 16.902 7.518 1.588 1.00 0.95 O ATOM 0 H GLU A 84 18.145 3.756 -2.400 1.00 0.34 H new ATOM 0 HA GLU A 84 15.668 5.178 -2.274 1.00 0.39 H new ATOM 0 HB2 GLU A 84 17.356 5.103 -0.444 1.00 0.51 H new ATOM 0 HB3 GLU A 84 18.494 5.964 -1.461 1.00 0.51 H new ATOM 0 HG2 GLU A 84 16.991 7.913 -1.540 1.00 0.64 H new ATOM 0 HG3 GLU A 84 15.792 7.052 -0.595 1.00 0.64 H new ATOM 1322 N GLN A 85 17.890 6.085 -4.487 1.00 0.37 N ATOM 1323 CA GLN A 85 18.101 6.971 -5.633 1.00 0.42 C ATOM 1324 C GLN A 85 16.884 6.942 -6.546 1.00 0.38 C ATOM 1325 O GLN A 85 16.538 7.938 -7.180 1.00 0.46 O ATOM 1326 CB GLN A 85 19.348 6.575 -6.428 1.00 0.50 C ATOM 1327 CG GLN A 85 20.655 6.677 -5.654 1.00 0.61 C ATOM 1328 CD GLN A 85 20.763 7.947 -4.831 1.00 1.44 C ATOM 1329 OE1 GLN A 85 21.197 8.987 -5.324 1.00 1.90 O ATOM 1330 NE2 GLN A 85 20.408 7.856 -3.557 1.00 2.16 N ATOM 0 H GLN A 85 18.575 5.334 -4.398 1.00 0.37 H new ATOM 0 HA GLN A 85 18.249 7.980 -5.249 1.00 0.42 H new ATOM 0 HB2 GLN A 85 19.228 5.550 -6.779 1.00 0.50 H new ATOM 0 HB3 GLN A 85 19.415 7.209 -7.312 1.00 0.50 H new ATOM 0 HG2 GLN A 85 20.747 5.815 -4.994 1.00 0.61 H new ATOM 0 HG3 GLN A 85 21.489 6.633 -6.354 1.00 0.61 H new ATOM 0 HE21 GLN A 85 20.053 6.974 -3.188 1.00 2.16 H new ATOM 0 HE22 GLN A 85 20.490 8.668 -2.945 1.00 2.16 H new ATOM 1339 N VAL A 86 16.229 5.794 -6.586 1.00 0.31 N ATOM 1340 CA VAL A 86 15.036 5.620 -7.389 1.00 0.31 C ATOM 1341 C VAL A 86 13.831 6.211 -6.673 1.00 0.29 C ATOM 1342 O VAL A 86 13.172 7.118 -7.173 1.00 0.32 O ATOM 1343 CB VAL A 86 14.762 4.130 -7.653 1.00 0.33 C ATOM 1344 CG1 VAL A 86 13.561 3.968 -8.567 1.00 0.38 C ATOM 1345 CG2 VAL A 86 15.988 3.444 -8.232 1.00 0.36 C ATOM 0 H VAL A 86 16.509 4.963 -6.065 1.00 0.31 H new ATOM 0 HA VAL A 86 15.199 6.132 -8.338 1.00 0.31 H new ATOM 0 HB VAL A 86 14.535 3.649 -6.702 1.00 0.33 H new ATOM 0 HG11 VAL A 86 13.379 2.908 -8.745 1.00 0.38 H new ATOM 0 HG12 VAL A 86 12.684 4.413 -8.097 1.00 0.38 H new ATOM 0 HG13 VAL A 86 13.756 4.467 -9.516 1.00 0.38 H new ATOM 0 HG21 VAL A 86 15.766 2.392 -8.409 1.00 0.36 H new ATOM 0 HG22 VAL A 86 16.261 3.921 -9.173 1.00 0.36 H new ATOM 0 HG23 VAL A 86 16.817 3.527 -7.529 1.00 0.36 H new ATOM 1355 N VAL A 87 13.564 5.687 -5.486 1.00 0.28 N ATOM 1356 CA VAL A 87 12.373 6.044 -4.733 1.00 0.32 C ATOM 1357 C VAL A 87 12.396 7.499 -4.259 1.00 0.35 C ATOM 1358 O VAL A 87 11.378 8.036 -3.827 1.00 0.37 O ATOM 1359 CB VAL A 87 12.178 5.104 -3.533 1.00 0.38 C ATOM 1360 CG1 VAL A 87 12.209 3.660 -4.001 1.00 0.38 C ATOM 1361 CG2 VAL A 87 13.232 5.349 -2.470 1.00 0.41 C ATOM 0 H VAL A 87 14.164 5.006 -5.020 1.00 0.28 H new ATOM 0 HA VAL A 87 11.530 5.933 -5.415 1.00 0.32 H new ATOM 0 HB VAL A 87 11.206 5.309 -3.085 1.00 0.38 H new ATOM 0 HG11 VAL A 87 12.070 2.998 -3.147 1.00 0.38 H new ATOM 0 HG12 VAL A 87 11.409 3.494 -4.722 1.00 0.38 H new ATOM 0 HG13 VAL A 87 13.170 3.450 -4.470 1.00 0.38 H new ATOM 0 HG21 VAL A 87 13.069 4.670 -1.633 1.00 0.41 H new ATOM 0 HG22 VAL A 87 14.222 5.174 -2.892 1.00 0.41 H new ATOM 0 HG23 VAL A 87 13.163 6.379 -2.120 1.00 0.41 H new ATOM 1371 N ASN A 88 13.557 8.136 -4.348 1.00 0.38 N ATOM 1372 CA ASN A 88 13.673 9.555 -4.012 1.00 0.47 C ATOM 1373 C ASN A 88 12.942 10.391 -5.054 1.00 0.44 C ATOM 1374 O ASN A 88 12.450 11.483 -4.761 1.00 0.45 O ATOM 1375 CB ASN A 88 15.143 9.992 -3.936 1.00 0.61 C ATOM 1376 CG ASN A 88 15.313 11.357 -3.291 1.00 0.78 C ATOM 1377 OD1 ASN A 88 14.559 11.730 -2.391 1.00 0.87 O ATOM 1378 ND2 ASN A 88 16.309 12.109 -3.732 1.00 0.97 N ATOM 0 H ASN A 88 14.428 7.698 -4.648 1.00 0.38 H new ATOM 0 HA ASN A 88 13.222 9.710 -3.032 1.00 0.47 H new ATOM 0 HB2 ASN A 88 15.709 9.253 -3.369 1.00 0.61 H new ATOM 0 HB3 ASN A 88 15.564 10.014 -4.941 1.00 0.61 H new ATOM 0 HD21 ASN A 88 16.472 13.030 -3.325 1.00 0.97 H new ATOM 0 HD22 ASN A 88 16.914 11.768 -4.479 1.00 0.97 H new ATOM 1385 N GLU A 89 12.842 9.855 -6.270 1.00 0.42 N ATOM 1386 CA GLU A 89 12.153 10.549 -7.349 1.00 0.45 C ATOM 1387 C GLU A 89 10.666 10.651 -7.046 1.00 0.38 C ATOM 1388 O GLU A 89 10.005 11.581 -7.490 1.00 0.43 O ATOM 1389 CB GLU A 89 12.363 9.848 -8.694 1.00 0.54 C ATOM 1390 CG GLU A 89 13.809 9.823 -9.160 1.00 0.65 C ATOM 1391 CD GLU A 89 13.949 9.272 -10.562 1.00 1.23 C ATOM 1392 OE1 GLU A 89 13.515 8.128 -10.805 1.00 2.04 O ATOM 1393 OE2 GLU A 89 14.497 9.978 -11.434 1.00 1.28 O ATOM 0 H GLU A 89 13.228 8.947 -6.528 1.00 0.42 H new ATOM 0 HA GLU A 89 12.577 11.551 -7.420 1.00 0.45 H new ATOM 0 HB2 GLU A 89 11.999 8.823 -8.619 1.00 0.54 H new ATOM 0 HB3 GLU A 89 11.757 10.347 -9.450 1.00 0.54 H new ATOM 0 HG2 GLU A 89 14.217 10.833 -9.126 1.00 0.65 H new ATOM 0 HG3 GLU A 89 14.400 9.217 -8.473 1.00 0.65 H new ATOM 1400 N LEU A 90 10.156 9.702 -6.264 1.00 0.31 N ATOM 1401 CA LEU A 90 8.754 9.704 -5.867 1.00 0.27 C ATOM 1402 C LEU A 90 8.446 10.939 -5.039 1.00 0.25 C ATOM 1403 O LEU A 90 7.388 11.553 -5.179 1.00 0.26 O ATOM 1404 CB LEU A 90 8.427 8.454 -5.049 1.00 0.26 C ATOM 1405 CG LEU A 90 8.673 7.122 -5.749 1.00 0.30 C ATOM 1406 CD1 LEU A 90 8.508 5.979 -4.764 1.00 0.31 C ATOM 1407 CD2 LEU A 90 7.723 6.952 -6.921 1.00 0.37 C ATOM 0 H LEU A 90 10.696 8.921 -5.893 1.00 0.31 H new ATOM 0 HA LEU A 90 8.144 9.710 -6.770 1.00 0.27 H new ATOM 0 HB2 LEU A 90 9.018 8.477 -4.133 1.00 0.26 H new ATOM 0 HB3 LEU A 90 7.379 8.500 -4.753 1.00 0.26 H new ATOM 0 HG LEU A 90 9.693 7.112 -6.132 1.00 0.30 H new ATOM 0 HD11 LEU A 90 8.686 5.032 -5.273 1.00 0.31 H new ATOM 0 HD12 LEU A 90 9.224 6.094 -3.950 1.00 0.31 H new ATOM 0 HD13 LEU A 90 7.496 5.990 -4.360 1.00 0.31 H new ATOM 0 HD21 LEU A 90 7.914 5.996 -7.408 1.00 0.37 H new ATOM 0 HD22 LEU A 90 6.694 6.978 -6.562 1.00 0.37 H new ATOM 0 HD23 LEU A 90 7.878 7.760 -7.635 1.00 0.37 H new ATOM 1419 N PHE A 91 9.393 11.303 -4.185 1.00 0.27 N ATOM 1420 CA PHE A 91 9.225 12.439 -3.294 1.00 0.29 C ATOM 1421 C PHE A 91 9.353 13.739 -4.080 1.00 0.33 C ATOM 1422 O PHE A 91 8.527 14.642 -3.946 1.00 0.33 O ATOM 1423 CB PHE A 91 10.269 12.393 -2.169 1.00 0.35 C ATOM 1424 CG PHE A 91 9.882 13.164 -0.935 1.00 0.37 C ATOM 1425 CD1 PHE A 91 10.018 14.543 -0.902 1.00 0.46 C ATOM 1426 CD2 PHE A 91 9.381 12.519 0.186 1.00 0.37 C ATOM 1427 CE1 PHE A 91 9.665 15.263 0.222 1.00 0.53 C ATOM 1428 CE2 PHE A 91 9.028 13.236 1.315 1.00 0.43 C ATOM 1429 CZ PHE A 91 9.161 14.566 1.356 1.00 0.50 C ATOM 0 H PHE A 91 10.289 10.824 -4.092 1.00 0.27 H new ATOM 0 HA PHE A 91 8.232 12.392 -2.847 1.00 0.29 H new ATOM 0 HB2 PHE A 91 10.444 11.353 -1.894 1.00 0.35 H new ATOM 0 HB3 PHE A 91 11.212 12.786 -2.548 1.00 0.35 H new ATOM 0 HD1 PHE A 91 10.405 15.061 -1.767 1.00 0.46 H new ATOM 0 HD2 PHE A 91 9.265 11.445 0.177 1.00 0.37 H new ATOM 0 HE1 PHE A 91 9.770 16.338 0.240 1.00 0.53 H new ATOM 0 HE2 PHE A 91 8.639 12.714 2.177 1.00 0.43 H new ATOM 0 HZ PHE A 91 8.887 15.110 2.248 1.00 0.50 H new ATOM 1439 N ARG A 92 10.369 13.810 -4.934 1.00 0.39 N ATOM 1440 CA ARG A 92 10.667 15.037 -5.656 1.00 0.49 C ATOM 1441 C ARG A 92 9.705 15.239 -6.831 1.00 0.51 C ATOM 1442 O ARG A 92 9.671 16.303 -7.449 1.00 0.62 O ATOM 1443 CB ARG A 92 12.115 15.020 -6.150 1.00 0.56 C ATOM 1444 CG ARG A 92 12.625 16.374 -6.633 1.00 1.24 C ATOM 1445 CD ARG A 92 12.840 17.352 -5.479 1.00 1.54 C ATOM 1446 NE ARG A 92 11.602 17.659 -4.757 1.00 2.30 N ATOM 1447 CZ ARG A 92 11.501 17.689 -3.426 1.00 2.99 C ATOM 1448 NH1 ARG A 92 12.565 17.448 -2.666 1.00 3.13 N ATOM 1449 NH2 ARG A 92 10.330 17.957 -2.862 1.00 3.95 N ATOM 0 H ARG A 92 10.997 13.033 -5.141 1.00 0.39 H new ATOM 0 HA ARG A 92 10.536 15.873 -4.969 1.00 0.49 H new ATOM 0 HB2 ARG A 92 12.758 14.668 -5.344 1.00 0.56 H new ATOM 0 HB3 ARG A 92 12.201 14.300 -6.964 1.00 0.56 H new ATOM 0 HG2 ARG A 92 13.563 16.237 -7.171 1.00 1.24 H new ATOM 0 HG3 ARG A 92 11.912 16.799 -7.339 1.00 1.24 H new ATOM 0 HD2 ARG A 92 13.566 16.932 -4.783 1.00 1.54 H new ATOM 0 HD3 ARG A 92 13.268 18.276 -5.867 1.00 1.54 H new ATOM 0 HE ARG A 92 10.766 17.862 -5.305 1.00 2.30 H new ATOM 0 HH11 ARG A 92 13.464 17.239 -3.099 1.00 3.13 H new ATOM 0 HH12 ARG A 92 12.482 17.472 -1.650 1.00 3.13 H new ATOM 0 HH21 ARG A 92 9.513 18.139 -3.445 1.00 3.95 H new ATOM 0 HH22 ARG A 92 10.247 17.981 -1.846 1.00 3.95 H new ATOM 1463 N ASP A 93 8.914 14.214 -7.122 1.00 0.46 N ATOM 1464 CA ASP A 93 7.932 14.274 -8.206 1.00 0.53 C ATOM 1465 C ASP A 93 6.640 14.926 -7.709 1.00 0.50 C ATOM 1466 O ASP A 93 5.608 14.896 -8.380 1.00 0.60 O ATOM 1467 CB ASP A 93 7.647 12.855 -8.737 1.00 0.62 C ATOM 1468 CG ASP A 93 6.776 12.836 -9.977 1.00 0.90 C ATOM 1469 OD1 ASP A 93 7.258 13.249 -11.052 1.00 1.14 O ATOM 1470 OD2 ASP A 93 5.599 12.430 -9.880 1.00 1.11 O ATOM 0 H ASP A 93 8.931 13.325 -6.622 1.00 0.46 H new ATOM 0 HA ASP A 93 8.336 14.878 -9.019 1.00 0.53 H new ATOM 0 HB2 ASP A 93 8.593 12.363 -8.960 1.00 0.62 H new ATOM 0 HB3 ASP A 93 7.162 12.273 -7.953 1.00 0.62 H new ATOM 1475 N GLY A 94 6.701 15.538 -6.533 1.00 0.45 N ATOM 1476 CA GLY A 94 5.508 16.125 -5.966 1.00 0.47 C ATOM 1477 C GLY A 94 4.761 15.143 -5.095 1.00 0.39 C ATOM 1478 O GLY A 94 3.531 15.149 -5.082 1.00 0.42 O ATOM 0 H GLY A 94 7.545 15.637 -5.969 1.00 0.45 H new ATOM 0 HA2 GLY A 94 5.778 17.001 -5.377 1.00 0.47 H new ATOM 0 HA3 GLY A 94 4.855 16.469 -6.768 1.00 0.47 H new ATOM 1482 N VAL A 95 5.526 14.291 -4.396 1.00 0.32 N ATOM 1483 CA VAL A 95 5.002 13.152 -3.631 1.00 0.26 C ATOM 1484 C VAL A 95 3.591 13.374 -3.085 1.00 0.25 C ATOM 1485 O VAL A 95 3.355 14.182 -2.188 1.00 0.29 O ATOM 1486 CB VAL A 95 5.948 12.767 -2.467 1.00 0.31 C ATOM 1487 CG1 VAL A 95 6.231 13.959 -1.565 1.00 0.40 C ATOM 1488 CG2 VAL A 95 5.370 11.606 -1.667 1.00 0.33 C ATOM 0 H VAL A 95 6.541 14.376 -4.346 1.00 0.32 H new ATOM 0 HA VAL A 95 4.947 12.333 -4.348 1.00 0.26 H new ATOM 0 HB VAL A 95 6.897 12.448 -2.899 1.00 0.31 H new ATOM 0 HG11 VAL A 95 6.898 13.655 -0.758 1.00 0.40 H new ATOM 0 HG12 VAL A 95 6.703 14.751 -2.146 1.00 0.40 H new ATOM 0 HG13 VAL A 95 5.295 14.326 -1.143 1.00 0.40 H new ATOM 0 HG21 VAL A 95 6.049 11.351 -0.854 1.00 0.33 H new ATOM 0 HG22 VAL A 95 4.403 11.894 -1.255 1.00 0.33 H new ATOM 0 HG23 VAL A 95 5.244 10.742 -2.319 1.00 0.33 H new ATOM 1498 N ASN A 96 2.658 12.662 -3.681 1.00 0.24 N ATOM 1499 CA ASN A 96 1.283 12.635 -3.215 1.00 0.29 C ATOM 1500 C ASN A 96 1.010 11.271 -2.600 1.00 0.23 C ATOM 1501 O ASN A 96 1.890 10.408 -2.608 1.00 0.21 O ATOM 1502 CB ASN A 96 0.315 12.917 -4.373 1.00 0.41 C ATOM 1503 CG ASN A 96 0.366 14.361 -4.847 1.00 1.33 C ATOM 1504 OD1 ASN A 96 0.254 14.637 -6.041 1.00 2.13 O ATOM 1505 ND2 ASN A 96 0.513 15.292 -3.916 1.00 2.00 N ATOM 0 H ASN A 96 2.829 12.084 -4.504 1.00 0.24 H new ATOM 0 HA ASN A 96 1.130 13.411 -2.465 1.00 0.29 H new ATOM 0 HB2 ASN A 96 0.552 12.257 -5.207 1.00 0.41 H new ATOM 0 HB3 ASN A 96 -0.701 12.679 -4.057 1.00 0.41 H new ATOM 0 HD21 ASN A 96 0.536 16.277 -4.179 1.00 2.00 H new ATOM 0 HD22 ASN A 96 0.603 15.024 -2.936 1.00 2.00 H new ATOM 1512 N TRP A 97 -0.194 11.060 -2.089 1.00 0.25 N ATOM 1513 CA TRP A 97 -0.528 9.801 -1.429 1.00 0.24 C ATOM 1514 C TRP A 97 -0.396 8.613 -2.389 1.00 0.25 C ATOM 1515 O TRP A 97 -0.099 7.495 -1.966 1.00 0.25 O ATOM 1516 CB TRP A 97 -1.937 9.866 -0.826 1.00 0.27 C ATOM 1517 CG TRP A 97 -2.063 10.916 0.242 1.00 0.28 C ATOM 1518 CD1 TRP A 97 -2.685 12.128 0.135 1.00 0.32 C ATOM 1519 CD2 TRP A 97 -1.539 10.853 1.578 1.00 0.27 C ATOM 1520 NE1 TRP A 97 -2.580 12.819 1.318 1.00 0.34 N ATOM 1521 CE2 TRP A 97 -1.883 12.059 2.215 1.00 0.30 C ATOM 1522 CE3 TRP A 97 -0.816 9.897 2.295 1.00 0.26 C ATOM 1523 CZ2 TRP A 97 -1.526 12.333 3.534 1.00 0.32 C ATOM 1524 CZ3 TRP A 97 -0.464 10.169 3.605 1.00 0.27 C ATOM 1525 CH2 TRP A 97 -0.819 11.379 4.211 1.00 0.30 C ATOM 0 H TRP A 97 -0.955 11.739 -2.117 1.00 0.25 H new ATOM 0 HA TRP A 97 0.185 9.648 -0.619 1.00 0.24 H new ATOM 0 HB2 TRP A 97 -2.658 10.071 -1.618 1.00 0.27 H new ATOM 0 HB3 TRP A 97 -2.193 8.893 -0.406 1.00 0.27 H new ATOM 0 HD1 TRP A 97 -3.186 12.490 -0.751 1.00 0.32 H new ATOM 0 HE1 TRP A 97 -2.960 13.748 1.498 1.00 0.34 H new ATOM 0 HE3 TRP A 97 -0.536 8.961 1.834 1.00 0.26 H new ATOM 0 HZ2 TRP A 97 -1.798 13.266 4.005 1.00 0.32 H new ATOM 0 HZ3 TRP A 97 0.094 9.436 4.169 1.00 0.27 H new ATOM 0 HH2 TRP A 97 -0.528 11.563 5.235 1.00 0.30 H new ATOM 1536 N GLY A 98 -0.573 8.871 -3.682 1.00 0.27 N ATOM 1537 CA GLY A 98 -0.426 7.826 -4.680 1.00 0.29 C ATOM 1538 C GLY A 98 1.020 7.399 -4.865 1.00 0.26 C ATOM 1539 O GLY A 98 1.294 6.319 -5.386 1.00 0.27 O ATOM 0 H GLY A 98 -0.816 9.788 -4.057 1.00 0.27 H new ATOM 0 HA2 GLY A 98 -1.022 6.962 -4.387 1.00 0.29 H new ATOM 0 HA3 GLY A 98 -0.822 8.179 -5.632 1.00 0.29 H new ATOM 1543 N ARG A 99 1.950 8.241 -4.426 1.00 0.26 N ATOM 1544 CA ARG A 99 3.371 7.914 -4.501 1.00 0.25 C ATOM 1545 C ARG A 99 3.722 6.896 -3.432 1.00 0.21 C ATOM 1546 O ARG A 99 4.574 6.035 -3.638 1.00 0.20 O ATOM 1547 CB ARG A 99 4.243 9.165 -4.339 1.00 0.30 C ATOM 1548 CG ARG A 99 4.509 9.929 -5.637 1.00 0.70 C ATOM 1549 CD ARG A 99 3.238 10.466 -6.283 1.00 1.40 C ATOM 1550 NE ARG A 99 3.529 11.131 -7.550 1.00 1.74 N ATOM 1551 CZ ARG A 99 2.668 11.235 -8.560 1.00 2.46 C ATOM 1552 NH1 ARG A 99 1.421 10.795 -8.440 1.00 3.06 N ATOM 1553 NH2 ARG A 99 3.060 11.804 -9.689 1.00 2.98 N ATOM 0 H ARG A 99 1.747 9.152 -4.016 1.00 0.26 H new ATOM 0 HA ARG A 99 3.569 7.492 -5.486 1.00 0.25 H new ATOM 0 HB2 ARG A 99 3.762 9.838 -3.629 1.00 0.30 H new ATOM 0 HB3 ARG A 99 5.198 8.872 -3.903 1.00 0.30 H new ATOM 0 HG2 ARG A 99 5.184 10.760 -5.431 1.00 0.70 H new ATOM 0 HG3 ARG A 99 5.018 9.271 -6.341 1.00 0.70 H new ATOM 0 HD2 ARG A 99 2.539 9.647 -6.452 1.00 1.40 H new ATOM 0 HD3 ARG A 99 2.751 11.167 -5.605 1.00 1.40 H new ATOM 0 HE ARG A 99 4.454 11.544 -7.669 1.00 1.74 H new ATOM 0 HH11 ARG A 99 1.112 10.371 -7.565 1.00 3.06 H new ATOM 0 HH12 ARG A 99 0.772 10.881 -9.222 1.00 3.06 H new ATOM 0 HH21 ARG A 99 4.013 12.157 -9.778 1.00 2.98 H new ATOM 0 HH22 ARG A 99 2.409 11.889 -10.470 1.00 2.98 H new ATOM 1567 N ILE A 100 3.048 6.995 -2.294 1.00 0.22 N ATOM 1568 CA ILE A 100 3.193 6.012 -1.237 1.00 0.21 C ATOM 1569 C ILE A 100 2.644 4.678 -1.720 1.00 0.20 C ATOM 1570 O ILE A 100 3.232 3.622 -1.489 1.00 0.19 O ATOM 1571 CB ILE A 100 2.455 6.457 0.042 1.00 0.24 C ATOM 1572 CG1 ILE A 100 3.105 7.719 0.614 1.00 0.26 C ATOM 1573 CG2 ILE A 100 2.441 5.341 1.072 1.00 0.24 C ATOM 1574 CD1 ILE A 100 2.524 8.155 1.939 1.00 0.30 C ATOM 0 H ILE A 100 2.395 7.749 -2.082 1.00 0.22 H new ATOM 0 HA ILE A 100 4.251 5.912 -0.993 1.00 0.21 H new ATOM 0 HB ILE A 100 1.421 6.687 -0.215 1.00 0.24 H new ATOM 0 HG12 ILE A 100 4.174 7.543 0.736 1.00 0.26 H new ATOM 0 HG13 ILE A 100 2.996 8.531 -0.105 1.00 0.26 H new ATOM 0 HG21 ILE A 100 1.915 5.677 1.966 1.00 0.24 H new ATOM 0 HG22 ILE A 100 1.933 4.470 0.658 1.00 0.24 H new ATOM 0 HG23 ILE A 100 3.465 5.073 1.332 1.00 0.24 H new ATOM 0 HD11 ILE A 100 3.034 9.055 2.282 1.00 0.30 H new ATOM 0 HD12 ILE A 100 1.461 8.364 1.819 1.00 0.30 H new ATOM 0 HD13 ILE A 100 2.657 7.361 2.674 1.00 0.30 H new ATOM 1586 N VAL A 101 1.518 4.752 -2.416 1.00 0.21 N ATOM 1587 CA VAL A 101 0.931 3.590 -3.054 1.00 0.21 C ATOM 1588 C VAL A 101 1.937 2.937 -3.983 1.00 0.20 C ATOM 1589 O VAL A 101 2.229 1.748 -3.867 1.00 0.21 O ATOM 1590 CB VAL A 101 -0.307 3.977 -3.872 1.00 0.25 C ATOM 1591 CG1 VAL A 101 -0.906 2.759 -4.541 1.00 0.29 C ATOM 1592 CG2 VAL A 101 -1.328 4.659 -2.993 1.00 0.26 C ATOM 0 H VAL A 101 0.991 5.615 -2.552 1.00 0.21 H new ATOM 0 HA VAL A 101 0.640 2.895 -2.267 1.00 0.21 H new ATOM 0 HB VAL A 101 -0.001 4.677 -4.650 1.00 0.25 H new ATOM 0 HG11 VAL A 101 -1.783 3.054 -5.116 1.00 0.29 H new ATOM 0 HG12 VAL A 101 -0.169 2.311 -5.207 1.00 0.29 H new ATOM 0 HG13 VAL A 101 -1.198 2.033 -3.782 1.00 0.29 H new ATOM 0 HG21 VAL A 101 -2.200 4.927 -3.589 1.00 0.26 H new ATOM 0 HG22 VAL A 101 -1.629 3.983 -2.193 1.00 0.26 H new ATOM 0 HG23 VAL A 101 -0.893 5.560 -2.561 1.00 0.26 H new ATOM 1602 N ALA A 102 2.461 3.735 -4.905 1.00 0.19 N ATOM 1603 CA ALA A 102 3.441 3.269 -5.868 1.00 0.19 C ATOM 1604 C ALA A 102 4.649 2.663 -5.168 1.00 0.17 C ATOM 1605 O ALA A 102 5.142 1.616 -5.572 1.00 0.19 O ATOM 1606 CB ALA A 102 3.867 4.413 -6.769 1.00 0.21 C ATOM 0 H ALA A 102 2.217 4.720 -5.003 1.00 0.19 H new ATOM 0 HA ALA A 102 2.982 2.490 -6.477 1.00 0.19 H new ATOM 0 HB1 ALA A 102 4.603 4.055 -7.489 1.00 0.21 H new ATOM 0 HB2 ALA A 102 2.998 4.800 -7.301 1.00 0.21 H new ATOM 0 HB3 ALA A 102 4.307 5.207 -6.166 1.00 0.21 H new ATOM 1612 N PHE A 103 5.098 3.315 -4.101 1.00 0.16 N ATOM 1613 CA PHE A 103 6.249 2.849 -3.330 1.00 0.17 C ATOM 1614 C PHE A 103 6.023 1.424 -2.828 1.00 0.17 C ATOM 1615 O PHE A 103 6.900 0.567 -2.934 1.00 0.21 O ATOM 1616 CB PHE A 103 6.511 3.799 -2.152 1.00 0.17 C ATOM 1617 CG PHE A 103 7.703 3.423 -1.311 1.00 0.19 C ATOM 1618 CD1 PHE A 103 8.983 3.427 -1.847 1.00 0.29 C ATOM 1619 CD2 PHE A 103 7.539 3.056 0.013 1.00 0.17 C ATOM 1620 CE1 PHE A 103 10.073 3.073 -1.076 1.00 0.32 C ATOM 1621 CE2 PHE A 103 8.625 2.700 0.789 1.00 0.20 C ATOM 1622 CZ PHE A 103 9.910 2.752 0.239 1.00 0.26 C ATOM 0 H PHE A 103 4.679 4.175 -3.747 1.00 0.16 H new ATOM 0 HA PHE A 103 7.124 2.844 -3.980 1.00 0.17 H new ATOM 0 HB2 PHE A 103 6.656 4.808 -2.538 1.00 0.17 H new ATOM 0 HB3 PHE A 103 5.626 3.825 -1.517 1.00 0.17 H new ATOM 0 HD1 PHE A 103 9.129 3.710 -2.879 1.00 0.29 H new ATOM 0 HD2 PHE A 103 6.549 3.048 0.445 1.00 0.17 H new ATOM 0 HE1 PHE A 103 11.059 3.050 -1.517 1.00 0.32 H new ATOM 0 HE2 PHE A 103 8.483 2.384 1.812 1.00 0.20 H new ATOM 0 HZ PHE A 103 10.771 2.538 0.855 1.00 0.26 H new ATOM 1632 N PHE A 104 4.831 1.174 -2.306 1.00 0.16 N ATOM 1633 CA PHE A 104 4.475 -0.151 -1.814 1.00 0.18 C ATOM 1634 C PHE A 104 4.223 -1.109 -2.973 1.00 0.19 C ATOM 1635 O PHE A 104 4.595 -2.284 -2.918 1.00 0.23 O ATOM 1636 CB PHE A 104 3.237 -0.072 -0.918 1.00 0.19 C ATOM 1637 CG PHE A 104 3.528 0.368 0.491 1.00 0.21 C ATOM 1638 CD1 PHE A 104 3.984 1.651 0.739 1.00 0.24 C ATOM 1639 CD2 PHE A 104 3.354 -0.496 1.564 1.00 0.29 C ATOM 1640 CE1 PHE A 104 4.260 2.067 2.024 1.00 0.27 C ATOM 1641 CE2 PHE A 104 3.630 -0.084 2.851 1.00 0.33 C ATOM 1642 CZ PHE A 104 4.047 1.159 3.102 1.00 0.30 C ATOM 0 H PHE A 104 4.093 1.871 -2.212 1.00 0.16 H new ATOM 0 HA PHE A 104 5.311 -0.532 -1.227 1.00 0.18 H new ATOM 0 HB2 PHE A 104 2.522 0.620 -1.363 1.00 0.19 H new ATOM 0 HB3 PHE A 104 2.758 -1.051 -0.890 1.00 0.19 H new ATOM 0 HD1 PHE A 104 4.125 2.335 -0.085 1.00 0.24 H new ATOM 0 HD2 PHE A 104 2.999 -1.501 1.389 1.00 0.29 H new ATOM 0 HE1 PHE A 104 4.631 3.064 2.211 1.00 0.27 H new ATOM 0 HE2 PHE A 104 3.507 -0.778 3.669 1.00 0.33 H new ATOM 0 HZ PHE A 104 4.223 1.476 4.119 1.00 0.30 H new ATOM 1652 N SER A 105 3.608 -0.592 -4.028 1.00 0.18 N ATOM 1653 CA SER A 105 3.286 -1.390 -5.202 1.00 0.21 C ATOM 1654 C SER A 105 4.556 -1.879 -5.898 1.00 0.21 C ATOM 1655 O SER A 105 4.601 -3.000 -6.412 1.00 0.23 O ATOM 1656 CB SER A 105 2.426 -0.571 -6.167 1.00 0.25 C ATOM 1657 OG SER A 105 1.238 -0.125 -5.529 1.00 1.04 O ATOM 0 H SER A 105 3.320 0.384 -4.094 1.00 0.18 H new ATOM 0 HA SER A 105 2.723 -2.267 -4.881 1.00 0.21 H new ATOM 0 HB2 SER A 105 2.994 0.286 -6.529 1.00 0.25 H new ATOM 0 HB3 SER A 105 2.172 -1.176 -7.038 1.00 0.25 H new ATOM 0 HG SER A 105 1.413 0.721 -5.066 1.00 1.04 H new ATOM 1663 N PHE A 106 5.591 -1.041 -5.906 1.00 0.20 N ATOM 1664 CA PHE A 106 6.868 -1.424 -6.489 1.00 0.21 C ATOM 1665 C PHE A 106 7.501 -2.520 -5.654 1.00 0.22 C ATOM 1666 O PHE A 106 7.909 -3.547 -6.183 1.00 0.24 O ATOM 1667 CB PHE A 106 7.832 -0.232 -6.586 1.00 0.23 C ATOM 1668 CG PHE A 106 7.373 0.873 -7.497 1.00 0.24 C ATOM 1669 CD1 PHE A 106 6.588 0.604 -8.607 1.00 0.30 C ATOM 1670 CD2 PHE A 106 7.733 2.187 -7.240 1.00 0.27 C ATOM 1671 CE1 PHE A 106 6.171 1.624 -9.442 1.00 0.35 C ATOM 1672 CE2 PHE A 106 7.320 3.209 -8.069 1.00 0.30 C ATOM 1673 CZ PHE A 106 6.538 2.927 -9.170 1.00 0.33 C ATOM 0 H PHE A 106 5.568 -0.098 -5.517 1.00 0.20 H new ATOM 0 HA PHE A 106 6.677 -1.784 -7.500 1.00 0.21 H new ATOM 0 HB2 PHE A 106 7.984 0.178 -5.587 1.00 0.23 H new ATOM 0 HB3 PHE A 106 8.800 -0.592 -6.933 1.00 0.23 H new ATOM 0 HD1 PHE A 106 6.299 -0.414 -8.822 1.00 0.30 H new ATOM 0 HD2 PHE A 106 8.345 2.413 -6.379 1.00 0.27 H new ATOM 0 HE1 PHE A 106 5.560 1.402 -10.304 1.00 0.35 H new ATOM 0 HE2 PHE A 106 7.608 4.228 -7.857 1.00 0.30 H new ATOM 0 HZ PHE A 106 6.213 3.726 -9.820 1.00 0.33 H new ATOM 1683 N GLY A 107 7.549 -2.303 -4.339 1.00 0.23 N ATOM 1684 CA GLY A 107 8.146 -3.274 -3.439 1.00 0.27 C ATOM 1685 C GLY A 107 7.532 -4.650 -3.584 1.00 0.32 C ATOM 1686 O GLY A 107 8.244 -5.653 -3.584 1.00 0.37 O ATOM 0 H GLY A 107 7.183 -1.468 -3.882 1.00 0.23 H new ATOM 0 HA2 GLY A 107 9.217 -3.335 -3.633 1.00 0.27 H new ATOM 0 HA3 GLY A 107 8.027 -2.933 -2.411 1.00 0.27 H new ATOM 1690 N GLY A 108 6.212 -4.693 -3.712 1.00 0.33 N ATOM 1691 CA GLY A 108 5.519 -5.953 -3.911 1.00 0.41 C ATOM 1692 C GLY A 108 5.977 -6.670 -5.166 1.00 0.42 C ATOM 1693 O GLY A 108 6.238 -7.872 -5.142 1.00 0.63 O ATOM 0 H GLY A 108 5.605 -3.874 -3.681 1.00 0.33 H new ATOM 0 HA2 GLY A 108 5.684 -6.596 -3.047 1.00 0.41 H new ATOM 0 HA3 GLY A 108 4.446 -5.769 -3.971 1.00 0.41 H new ATOM 1697 N ALA A 109 6.097 -5.923 -6.256 1.00 0.27 N ATOM 1698 CA ALA A 109 6.540 -6.482 -7.525 1.00 0.26 C ATOM 1699 C ALA A 109 8.007 -6.875 -7.450 1.00 0.23 C ATOM 1700 O ALA A 109 8.418 -7.899 -8.002 1.00 0.24 O ATOM 1701 CB ALA A 109 6.320 -5.480 -8.645 1.00 0.29 C ATOM 0 H ALA A 109 5.893 -4.924 -6.286 1.00 0.27 H new ATOM 0 HA ALA A 109 5.953 -7.376 -7.734 1.00 0.26 H new ATOM 0 HB1 ALA A 109 6.655 -5.910 -9.589 1.00 0.29 H new ATOM 0 HB2 ALA A 109 5.260 -5.237 -8.713 1.00 0.29 H new ATOM 0 HB3 ALA A 109 6.887 -4.572 -8.438 1.00 0.29 H new ATOM 1707 N LEU A 110 8.781 -6.052 -6.757 1.00 0.22 N ATOM 1708 CA LEU A 110 10.194 -6.306 -6.547 1.00 0.23 C ATOM 1709 C LEU A 110 10.387 -7.605 -5.793 1.00 0.21 C ATOM 1710 O LEU A 110 11.222 -8.426 -6.157 1.00 0.21 O ATOM 1711 CB LEU A 110 10.822 -5.152 -5.771 1.00 0.25 C ATOM 1712 CG LEU A 110 10.820 -3.816 -6.501 1.00 0.28 C ATOM 1713 CD1 LEU A 110 11.423 -2.736 -5.624 1.00 0.32 C ATOM 1714 CD2 LEU A 110 11.575 -3.935 -7.811 1.00 0.36 C ATOM 0 H LEU A 110 8.445 -5.191 -6.326 1.00 0.22 H new ATOM 0 HA LEU A 110 10.684 -6.389 -7.517 1.00 0.23 H new ATOM 0 HB2 LEU A 110 10.290 -5.035 -4.827 1.00 0.25 H new ATOM 0 HB3 LEU A 110 11.851 -5.415 -5.526 1.00 0.25 H new ATOM 0 HG LEU A 110 9.790 -3.536 -6.724 1.00 0.28 H new ATOM 0 HD11 LEU A 110 11.415 -1.786 -6.159 1.00 0.32 H new ATOM 0 HD12 LEU A 110 10.838 -2.642 -4.709 1.00 0.32 H new ATOM 0 HD13 LEU A 110 12.450 -3.002 -5.373 1.00 0.32 H new ATOM 0 HD21 LEU A 110 11.567 -2.973 -8.324 1.00 0.36 H new ATOM 0 HD22 LEU A 110 12.605 -4.231 -7.612 1.00 0.36 H new ATOM 0 HD23 LEU A 110 11.097 -4.686 -8.440 1.00 0.36 H new ATOM 1726 N CYS A 111 9.603 -7.784 -4.743 1.00 0.21 N ATOM 1727 CA CYS A 111 9.654 -8.998 -3.948 1.00 0.21 C ATOM 1728 C CYS A 111 9.401 -10.226 -4.812 1.00 0.21 C ATOM 1729 O CYS A 111 10.071 -11.250 -4.669 1.00 0.25 O ATOM 1730 CB CYS A 111 8.631 -8.928 -2.822 1.00 0.22 C ATOM 1731 SG CYS A 111 9.003 -7.676 -1.577 1.00 1.34 S ATOM 0 H CYS A 111 8.920 -7.099 -4.420 1.00 0.21 H new ATOM 0 HA CYS A 111 10.652 -9.084 -3.519 1.00 0.21 H new ATOM 0 HB2 CYS A 111 7.649 -8.723 -3.248 1.00 0.22 H new ATOM 0 HB3 CYS A 111 8.571 -9.902 -2.337 1.00 0.22 H new ATOM 0 HG CYS A 111 8.811 -6.493 -2.080 1.00 1.34 H new ATOM 1737 N VAL A 112 8.449 -10.106 -5.725 1.00 0.19 N ATOM 1738 CA VAL A 112 8.101 -11.199 -6.614 1.00 0.20 C ATOM 1739 C VAL A 112 9.263 -11.532 -7.536 1.00 0.22 C ATOM 1740 O VAL A 112 9.719 -12.677 -7.590 1.00 0.25 O ATOM 1741 CB VAL A 112 6.864 -10.846 -7.459 1.00 0.23 C ATOM 1742 CG1 VAL A 112 6.581 -11.938 -8.475 1.00 0.27 C ATOM 1743 CG2 VAL A 112 5.658 -10.625 -6.564 1.00 0.25 C ATOM 0 H VAL A 112 7.902 -9.257 -5.868 1.00 0.19 H new ATOM 0 HA VAL A 112 7.873 -12.068 -5.996 1.00 0.20 H new ATOM 0 HB VAL A 112 7.068 -9.922 -7.999 1.00 0.23 H new ATOM 0 HG11 VAL A 112 5.703 -11.670 -9.062 1.00 0.27 H new ATOM 0 HG12 VAL A 112 7.440 -12.051 -9.137 1.00 0.27 H new ATOM 0 HG13 VAL A 112 6.397 -12.879 -7.956 1.00 0.27 H new ATOM 0 HG21 VAL A 112 4.791 -10.376 -7.176 1.00 0.25 H new ATOM 0 HG22 VAL A 112 5.454 -11.534 -5.998 1.00 0.25 H new ATOM 0 HG23 VAL A 112 5.862 -9.806 -5.874 1.00 0.25 H new ATOM 1753 N GLU A 113 9.740 -10.527 -8.259 1.00 0.22 N ATOM 1754 CA GLU A 113 10.835 -10.730 -9.198 1.00 0.25 C ATOM 1755 C GLU A 113 12.099 -11.174 -8.469 1.00 0.25 C ATOM 1756 O GLU A 113 12.911 -11.901 -9.029 1.00 0.30 O ATOM 1757 CB GLU A 113 11.105 -9.473 -10.029 1.00 0.29 C ATOM 1758 CG GLU A 113 11.569 -8.276 -9.222 1.00 0.30 C ATOM 1759 CD GLU A 113 11.867 -7.078 -10.095 1.00 0.39 C ATOM 1760 OE1 GLU A 113 10.914 -6.369 -10.487 1.00 0.51 O ATOM 1761 OE2 GLU A 113 13.058 -6.831 -10.382 1.00 0.50 O ATOM 0 H GLU A 113 9.389 -9.570 -8.214 1.00 0.22 H new ATOM 0 HA GLU A 113 10.535 -11.522 -9.884 1.00 0.25 H new ATOM 0 HB2 GLU A 113 11.860 -9.704 -10.780 1.00 0.29 H new ATOM 0 HB3 GLU A 113 10.195 -9.204 -10.565 1.00 0.29 H new ATOM 0 HG2 GLU A 113 10.802 -8.011 -8.495 1.00 0.30 H new ATOM 0 HG3 GLU A 113 12.463 -8.544 -8.659 1.00 0.30 H new ATOM 1768 N SER A 114 12.248 -10.761 -7.213 1.00 0.23 N ATOM 1769 CA SER A 114 13.382 -11.182 -6.404 1.00 0.28 C ATOM 1770 C SER A 114 13.389 -12.694 -6.253 1.00 0.27 C ATOM 1771 O SER A 114 14.426 -13.336 -6.387 1.00 0.31 O ATOM 1772 CB SER A 114 13.351 -10.521 -5.024 1.00 0.33 C ATOM 1773 OG SER A 114 13.532 -9.124 -5.128 1.00 0.99 O ATOM 0 H SER A 114 11.597 -10.136 -6.737 1.00 0.23 H new ATOM 0 HA SER A 114 14.293 -10.868 -6.914 1.00 0.28 H new ATOM 0 HB2 SER A 114 12.399 -10.733 -4.537 1.00 0.33 H new ATOM 0 HB3 SER A 114 14.133 -10.947 -4.395 1.00 0.33 H new ATOM 0 HG SER A 114 12.760 -8.727 -5.582 1.00 0.99 H new ATOM 1779 N VAL A 115 12.220 -13.262 -6.007 1.00 0.28 N ATOM 1780 CA VAL A 115 12.096 -14.698 -5.852 1.00 0.33 C ATOM 1781 C VAL A 115 12.373 -15.397 -7.176 1.00 0.37 C ATOM 1782 O VAL A 115 13.132 -16.364 -7.233 1.00 0.42 O ATOM 1783 CB VAL A 115 10.698 -15.077 -5.338 1.00 0.40 C ATOM 1784 CG1 VAL A 115 10.566 -16.585 -5.195 1.00 0.45 C ATOM 1785 CG2 VAL A 115 10.429 -14.385 -4.013 1.00 0.41 C ATOM 0 H VAL A 115 11.344 -12.748 -5.911 1.00 0.28 H new ATOM 0 HA VAL A 115 12.831 -15.024 -5.117 1.00 0.33 H new ATOM 0 HB VAL A 115 9.956 -14.744 -6.064 1.00 0.40 H new ATOM 0 HG11 VAL A 115 9.569 -16.830 -4.830 1.00 0.45 H new ATOM 0 HG12 VAL A 115 10.724 -17.058 -6.164 1.00 0.45 H new ATOM 0 HG13 VAL A 115 11.311 -16.950 -4.488 1.00 0.45 H new ATOM 0 HG21 VAL A 115 9.436 -14.658 -3.655 1.00 0.41 H new ATOM 0 HG22 VAL A 115 11.176 -14.695 -3.283 1.00 0.41 H new ATOM 0 HG23 VAL A 115 10.481 -13.305 -4.150 1.00 0.41 H new ATOM 1795 N ASP A 116 11.774 -14.884 -8.243 1.00 0.38 N ATOM 1796 CA ASP A 116 11.979 -15.439 -9.579 1.00 0.46 C ATOM 1797 C ASP A 116 13.447 -15.350 -10.001 1.00 0.47 C ATOM 1798 O ASP A 116 13.961 -16.239 -10.675 1.00 0.56 O ATOM 1799 CB ASP A 116 11.097 -14.723 -10.605 1.00 0.49 C ATOM 1800 CG ASP A 116 11.400 -15.152 -12.028 1.00 1.08 C ATOM 1801 OD1 ASP A 116 11.011 -16.274 -12.407 1.00 1.23 O ATOM 1802 OD2 ASP A 116 12.027 -14.370 -12.774 1.00 1.89 O ATOM 0 H ASP A 116 11.142 -14.084 -8.212 1.00 0.38 H new ATOM 0 HA ASP A 116 11.697 -16.491 -9.542 1.00 0.46 H new ATOM 0 HB2 ASP A 116 10.049 -14.925 -10.383 1.00 0.49 H new ATOM 0 HB3 ASP A 116 11.240 -13.646 -10.515 1.00 0.49 H new ATOM 1807 N LYS A 117 14.126 -14.286 -9.585 1.00 0.43 N ATOM 1808 CA LYS A 117 15.541 -14.108 -9.906 1.00 0.49 C ATOM 1809 C LYS A 117 16.429 -14.899 -8.946 1.00 0.47 C ATOM 1810 O LYS A 117 17.652 -14.755 -8.966 1.00 0.52 O ATOM 1811 CB LYS A 117 15.931 -12.625 -9.866 1.00 0.53 C ATOM 1812 CG LYS A 117 15.272 -11.774 -10.943 1.00 0.61 C ATOM 1813 CD LYS A 117 15.680 -12.216 -12.341 1.00 1.20 C ATOM 1814 CE LYS A 117 15.053 -11.337 -13.415 1.00 1.32 C ATOM 1815 NZ LYS A 117 15.405 -11.799 -14.783 1.00 1.90 N ATOM 0 H LYS A 117 13.722 -13.534 -9.026 1.00 0.43 H new ATOM 0 HA LYS A 117 15.694 -14.487 -10.917 1.00 0.49 H new ATOM 0 HB2 LYS A 117 15.670 -12.219 -8.889 1.00 0.53 H new ATOM 0 HB3 LYS A 117 17.013 -12.543 -9.967 1.00 0.53 H new ATOM 0 HG2 LYS A 117 14.188 -11.837 -10.844 1.00 0.61 H new ATOM 0 HG3 LYS A 117 15.545 -10.729 -10.798 1.00 0.61 H new ATOM 0 HD2 LYS A 117 16.766 -12.182 -12.431 1.00 1.20 H new ATOM 0 HD3 LYS A 117 15.379 -13.252 -12.497 1.00 1.20 H new ATOM 0 HE2 LYS A 117 13.969 -11.339 -13.299 1.00 1.32 H new ATOM 0 HE3 LYS A 117 15.386 -10.308 -13.282 1.00 1.32 H new ATOM 0 HZ1 LYS A 117 14.959 -11.175 -15.486 1.00 1.90 H new ATOM 0 HZ2 LYS A 117 16.438 -11.773 -14.903 1.00 1.90 H new ATOM 0 HZ3 LYS A 117 15.065 -12.772 -14.919 1.00 1.90 H new ATOM 1829 N GLU A 118 15.802 -15.728 -8.106 1.00 0.45 N ATOM 1830 CA GLU A 118 16.517 -16.587 -7.160 1.00 0.49 C ATOM 1831 C GLU A 118 17.241 -15.757 -6.104 1.00 0.45 C ATOM 1832 O GLU A 118 18.259 -16.170 -5.552 1.00 0.55 O ATOM 1833 CB GLU A 118 17.503 -17.497 -7.896 1.00 0.59 C ATOM 1834 CG GLU A 118 16.830 -18.444 -8.875 1.00 1.07 C ATOM 1835 CD GLU A 118 17.825 -19.234 -9.694 1.00 1.72 C ATOM 1836 OE1 GLU A 118 18.312 -20.275 -9.202 1.00 1.89 O ATOM 1837 OE2 GLU A 118 18.129 -18.821 -10.832 1.00 2.54 O ATOM 0 H GLU A 118 14.787 -15.822 -8.063 1.00 0.45 H new ATOM 0 HA GLU A 118 15.782 -17.212 -6.653 1.00 0.49 H new ATOM 0 HB2 GLU A 118 18.223 -16.881 -8.434 1.00 0.59 H new ATOM 0 HB3 GLU A 118 18.064 -18.079 -7.165 1.00 0.59 H new ATOM 0 HG2 GLU A 118 16.188 -19.133 -8.326 1.00 1.07 H new ATOM 0 HG3 GLU A 118 16.186 -17.873 -9.544 1.00 1.07 H new ATOM 1844 N MET A 119 16.683 -14.597 -5.807 1.00 0.35 N ATOM 1845 CA MET A 119 17.249 -13.700 -4.816 1.00 0.33 C ATOM 1846 C MET A 119 16.344 -13.661 -3.592 1.00 0.31 C ATOM 1847 O MET A 119 15.823 -12.610 -3.214 1.00 0.27 O ATOM 1848 CB MET A 119 17.407 -12.295 -5.400 1.00 0.34 C ATOM 1849 CG MET A 119 18.207 -12.255 -6.691 1.00 0.41 C ATOM 1850 SD MET A 119 18.358 -10.591 -7.363 1.00 0.47 S ATOM 1851 CE MET A 119 16.640 -10.088 -7.424 1.00 0.44 C ATOM 0 H MET A 119 15.829 -14.252 -6.244 1.00 0.35 H new ATOM 0 HA MET A 119 18.234 -14.065 -4.525 1.00 0.33 H new ATOM 0 HB2 MET A 119 16.418 -11.874 -5.583 1.00 0.34 H new ATOM 0 HB3 MET A 119 17.893 -11.657 -4.662 1.00 0.34 H new ATOM 0 HG2 MET A 119 19.202 -12.661 -6.510 1.00 0.41 H new ATOM 0 HG3 MET A 119 17.730 -12.899 -7.430 1.00 0.41 H new ATOM 0 HE1 MET A 119 16.444 -9.577 -8.367 1.00 0.44 H new ATOM 0 HE2 MET A 119 16.000 -10.967 -7.348 1.00 0.44 H new ATOM 0 HE3 MET A 119 16.429 -9.413 -6.595 1.00 0.44 H new ATOM 1861 N GLN A 120 16.167 -14.820 -2.971 1.00 0.36 N ATOM 1862 CA GLN A 120 15.269 -14.961 -1.827 1.00 0.39 C ATOM 1863 C GLN A 120 15.808 -14.233 -0.601 1.00 0.41 C ATOM 1864 O GLN A 120 15.125 -14.115 0.412 1.00 0.47 O ATOM 1865 CB GLN A 120 15.055 -16.438 -1.495 1.00 0.49 C ATOM 1866 CG GLN A 120 14.355 -17.225 -2.596 1.00 0.53 C ATOM 1867 CD GLN A 120 14.242 -18.704 -2.275 1.00 0.65 C ATOM 1868 OE1 GLN A 120 14.172 -19.098 -1.109 1.00 0.71 O ATOM 1869 NE2 GLN A 120 14.214 -19.535 -3.305 1.00 0.70 N ATOM 0 H GLN A 120 16.637 -15.684 -3.242 1.00 0.36 H new ATOM 0 HA GLN A 120 14.316 -14.510 -2.102 1.00 0.39 H new ATOM 0 HB2 GLN A 120 16.022 -16.898 -1.292 1.00 0.49 H new ATOM 0 HB3 GLN A 120 14.468 -16.513 -0.580 1.00 0.49 H new ATOM 0 HG2 GLN A 120 13.358 -16.814 -2.753 1.00 0.53 H new ATOM 0 HG3 GLN A 120 14.902 -17.101 -3.530 1.00 0.53 H new ATOM 0 HE21 GLN A 120 14.274 -19.171 -4.256 1.00 0.70 H new ATOM 0 HE22 GLN A 120 14.132 -20.539 -3.148 1.00 0.70 H new ATOM 1878 N VAL A 121 17.041 -13.765 -0.690 1.00 0.39 N ATOM 1879 CA VAL A 121 17.628 -12.974 0.378 1.00 0.44 C ATOM 1880 C VAL A 121 17.354 -11.487 0.169 1.00 0.38 C ATOM 1881 O VAL A 121 17.322 -10.706 1.119 1.00 0.47 O ATOM 1882 CB VAL A 121 19.144 -13.210 0.481 1.00 0.52 C ATOM 1883 CG1 VAL A 121 19.430 -14.637 0.919 1.00 0.98 C ATOM 1884 CG2 VAL A 121 19.823 -12.913 -0.846 1.00 0.92 C ATOM 0 H VAL A 121 17.655 -13.919 -1.490 1.00 0.39 H new ATOM 0 HA VAL A 121 17.162 -13.294 1.310 1.00 0.44 H new ATOM 0 HB VAL A 121 19.548 -12.531 1.232 1.00 0.52 H new ATOM 0 HG11 VAL A 121 20.507 -14.788 0.987 1.00 0.98 H new ATOM 0 HG12 VAL A 121 18.976 -14.816 1.894 1.00 0.98 H new ATOM 0 HG13 VAL A 121 19.012 -15.332 0.191 1.00 0.98 H new ATOM 0 HG21 VAL A 121 20.895 -13.086 -0.753 1.00 0.92 H new ATOM 0 HG22 VAL A 121 19.416 -13.567 -1.617 1.00 0.92 H new ATOM 0 HG23 VAL A 121 19.646 -11.873 -1.121 1.00 0.92 H new ATOM 1894 N LEU A 122 17.128 -11.103 -1.080 1.00 0.30 N ATOM 1895 CA LEU A 122 16.886 -9.710 -1.412 1.00 0.27 C ATOM 1896 C LEU A 122 15.455 -9.305 -1.108 1.00 0.23 C ATOM 1897 O LEU A 122 15.197 -8.162 -0.750 1.00 0.23 O ATOM 1898 CB LEU A 122 17.211 -9.427 -2.876 1.00 0.28 C ATOM 1899 CG LEU A 122 18.637 -8.950 -3.141 1.00 0.37 C ATOM 1900 CD1 LEU A 122 19.645 -10.010 -2.741 1.00 0.39 C ATOM 1901 CD2 LEU A 122 18.796 -8.585 -4.599 1.00 0.41 C ATOM 0 H LEU A 122 17.108 -11.738 -1.878 1.00 0.30 H new ATOM 0 HA LEU A 122 17.550 -9.113 -0.787 1.00 0.27 H new ATOM 0 HB2 LEU A 122 17.034 -10.334 -3.453 1.00 0.28 H new ATOM 0 HB3 LEU A 122 16.517 -8.673 -3.247 1.00 0.28 H new ATOM 0 HG LEU A 122 18.826 -8.064 -2.534 1.00 0.37 H new ATOM 0 HD11 LEU A 122 20.653 -9.647 -2.939 1.00 0.39 H new ATOM 0 HD12 LEU A 122 19.541 -10.229 -1.678 1.00 0.39 H new ATOM 0 HD13 LEU A 122 19.467 -10.918 -3.317 1.00 0.39 H new ATOM 0 HD21 LEU A 122 19.816 -8.246 -4.780 1.00 0.41 H new ATOM 0 HD22 LEU A 122 18.589 -9.458 -5.217 1.00 0.41 H new ATOM 0 HD23 LEU A 122 18.098 -7.787 -4.853 1.00 0.41 H new ATOM 1913 N VAL A 123 14.530 -10.248 -1.232 1.00 0.23 N ATOM 1914 CA VAL A 123 13.124 -9.971 -0.965 1.00 0.25 C ATOM 1915 C VAL A 123 12.920 -9.483 0.472 1.00 0.27 C ATOM 1916 O VAL A 123 12.123 -8.582 0.727 1.00 0.31 O ATOM 1917 CB VAL A 123 12.238 -11.206 -1.247 1.00 0.28 C ATOM 1918 CG1 VAL A 123 12.704 -12.415 -0.457 1.00 0.31 C ATOM 1919 CG2 VAL A 123 10.784 -10.901 -0.941 1.00 0.31 C ATOM 0 H VAL A 123 14.727 -11.208 -1.515 1.00 0.23 H new ATOM 0 HA VAL A 123 12.818 -9.176 -1.645 1.00 0.25 H new ATOM 0 HB VAL A 123 12.330 -11.444 -2.307 1.00 0.28 H new ATOM 0 HG11 VAL A 123 12.059 -13.265 -0.679 1.00 0.31 H new ATOM 0 HG12 VAL A 123 13.731 -12.656 -0.733 1.00 0.31 H new ATOM 0 HG13 VAL A 123 12.657 -12.193 0.609 1.00 0.31 H new ATOM 0 HG21 VAL A 123 10.176 -11.782 -1.146 1.00 0.31 H new ATOM 0 HG22 VAL A 123 10.683 -10.627 0.109 1.00 0.31 H new ATOM 0 HG23 VAL A 123 10.446 -10.074 -1.566 1.00 0.31 H new ATOM 1929 N SER A 124 13.674 -10.050 1.401 1.00 0.29 N ATOM 1930 CA SER A 124 13.578 -9.648 2.794 1.00 0.35 C ATOM 1931 C SER A 124 14.281 -8.306 3.008 1.00 0.34 C ATOM 1932 O SER A 124 13.927 -7.542 3.911 1.00 0.44 O ATOM 1933 CB SER A 124 14.174 -10.725 3.708 1.00 0.43 C ATOM 1934 OG SER A 124 13.946 -10.422 5.075 1.00 1.32 O ATOM 0 H SER A 124 14.356 -10.786 1.216 1.00 0.29 H new ATOM 0 HA SER A 124 12.525 -9.531 3.050 1.00 0.35 H new ATOM 0 HB2 SER A 124 13.733 -11.693 3.469 1.00 0.43 H new ATOM 0 HB3 SER A 124 15.245 -10.809 3.525 1.00 0.43 H new ATOM 0 HG SER A 124 14.335 -11.126 5.635 1.00 1.32 H new ATOM 1940 N ARG A 125 15.268 -8.014 2.164 1.00 0.28 N ATOM 1941 CA ARG A 125 15.970 -6.739 2.235 1.00 0.31 C ATOM 1942 C ARG A 125 15.099 -5.628 1.665 1.00 0.24 C ATOM 1943 O ARG A 125 15.206 -4.476 2.073 1.00 0.24 O ATOM 1944 CB ARG A 125 17.310 -6.796 1.486 1.00 0.41 C ATOM 1945 CG ARG A 125 18.351 -7.709 2.136 1.00 0.91 C ATOM 1946 CD ARG A 125 19.677 -7.701 1.381 1.00 0.74 C ATOM 1947 NE ARG A 125 20.695 -8.511 2.048 1.00 1.01 N ATOM 1948 CZ ARG A 125 21.995 -8.449 1.764 1.00 1.24 C ATOM 1949 NH1 ARG A 125 22.433 -7.636 0.806 1.00 1.28 N ATOM 1950 NH2 ARG A 125 22.866 -9.197 2.434 1.00 1.84 N ATOM 0 H ARG A 125 15.597 -8.640 1.428 1.00 0.28 H new ATOM 0 HA ARG A 125 16.179 -6.529 3.284 1.00 0.31 H new ATOM 0 HB2 ARG A 125 17.130 -7.137 0.466 1.00 0.41 H new ATOM 0 HB3 ARG A 125 17.719 -5.788 1.418 1.00 0.41 H new ATOM 0 HG2 ARG A 125 18.519 -7.391 3.165 1.00 0.91 H new ATOM 0 HG3 ARG A 125 17.964 -8.727 2.176 1.00 0.91 H new ATOM 0 HD2 ARG A 125 19.520 -8.077 0.370 1.00 0.74 H new ATOM 0 HD3 ARG A 125 20.034 -6.675 1.288 1.00 0.74 H new ATOM 0 HE ARG A 125 20.392 -9.161 2.773 1.00 1.01 H new ATOM 0 HH11 ARG A 125 21.773 -7.058 0.286 1.00 1.28 H new ATOM 0 HH12 ARG A 125 23.429 -7.591 0.591 1.00 1.28 H new ATOM 0 HH21 ARG A 125 22.540 -9.823 3.170 1.00 1.84 H new ATOM 0 HH22 ARG A 125 23.860 -9.145 2.212 1.00 1.84 H new ATOM 1964 N ILE A 126 14.225 -5.986 0.730 1.00 0.21 N ATOM 1965 CA ILE A 126 13.268 -5.043 0.167 1.00 0.19 C ATOM 1966 C ILE A 126 12.418 -4.432 1.273 1.00 0.19 C ATOM 1967 O ILE A 126 12.272 -3.210 1.358 1.00 0.19 O ATOM 1968 CB ILE A 126 12.363 -5.736 -0.871 1.00 0.19 C ATOM 1969 CG1 ILE A 126 13.184 -6.113 -2.099 1.00 0.20 C ATOM 1970 CG2 ILE A 126 11.195 -4.846 -1.263 1.00 0.20 C ATOM 1971 CD1 ILE A 126 12.403 -6.870 -3.142 1.00 0.23 C ATOM 0 H ILE A 126 14.161 -6.928 0.345 1.00 0.21 H new ATOM 0 HA ILE A 126 13.824 -4.251 -0.334 1.00 0.19 H new ATOM 0 HB ILE A 126 11.953 -6.641 -0.423 1.00 0.19 H new ATOM 0 HG12 ILE A 126 13.587 -5.205 -2.548 1.00 0.20 H new ATOM 0 HG13 ILE A 126 14.034 -6.718 -1.785 1.00 0.20 H new ATOM 0 HG21 ILE A 126 10.575 -5.362 -1.996 1.00 0.20 H new ATOM 0 HG22 ILE A 126 10.599 -4.618 -0.379 1.00 0.20 H new ATOM 0 HG23 ILE A 126 11.573 -3.919 -1.695 1.00 0.20 H new ATOM 0 HD11 ILE A 126 13.053 -7.103 -3.985 1.00 0.23 H new ATOM 0 HD12 ILE A 126 12.022 -7.796 -2.711 1.00 0.23 H new ATOM 0 HD13 ILE A 126 11.568 -6.259 -3.486 1.00 0.23 H new ATOM 1983 N ALA A 127 11.874 -5.292 2.125 1.00 0.22 N ATOM 1984 CA ALA A 127 11.104 -4.846 3.276 1.00 0.25 C ATOM 1985 C ALA A 127 11.925 -3.910 4.148 1.00 0.24 C ATOM 1986 O ALA A 127 11.409 -2.924 4.671 1.00 0.26 O ATOM 1987 CB ALA A 127 10.628 -6.036 4.089 1.00 0.30 C ATOM 0 H ALA A 127 11.953 -6.305 2.039 1.00 0.22 H new ATOM 0 HA ALA A 127 10.235 -4.300 2.910 1.00 0.25 H new ATOM 0 HB1 ALA A 127 10.054 -5.685 4.946 1.00 0.30 H new ATOM 0 HB2 ALA A 127 9.999 -6.673 3.467 1.00 0.30 H new ATOM 0 HB3 ALA A 127 11.489 -6.606 4.438 1.00 0.30 H new ATOM 1993 N ALA A 128 13.205 -4.219 4.285 1.00 0.22 N ATOM 1994 CA ALA A 128 14.107 -3.404 5.080 1.00 0.23 C ATOM 1995 C ALA A 128 14.267 -2.021 4.466 1.00 0.19 C ATOM 1996 O ALA A 128 14.136 -1.008 5.155 1.00 0.19 O ATOM 1997 CB ALA A 128 15.456 -4.086 5.213 1.00 0.27 C ATOM 0 H ALA A 128 13.643 -5.033 3.853 1.00 0.22 H new ATOM 0 HA ALA A 128 13.677 -3.287 6.075 1.00 0.23 H new ATOM 0 HB1 ALA A 128 16.121 -3.463 5.811 1.00 0.27 H new ATOM 0 HB2 ALA A 128 15.328 -5.053 5.700 1.00 0.27 H new ATOM 0 HB3 ALA A 128 15.889 -4.232 4.223 1.00 0.27 H new ATOM 2003 N TRP A 129 14.528 -1.982 3.163 1.00 0.17 N ATOM 2004 CA TRP A 129 14.721 -0.716 2.460 1.00 0.17 C ATOM 2005 C TRP A 129 13.448 0.116 2.494 1.00 0.15 C ATOM 2006 O TRP A 129 13.493 1.326 2.729 1.00 0.18 O ATOM 2007 CB TRP A 129 15.143 -0.946 1.006 1.00 0.20 C ATOM 2008 CG TRP A 129 16.370 -1.789 0.862 1.00 0.24 C ATOM 2009 CD1 TRP A 129 17.450 -1.820 1.695 1.00 0.27 C ATOM 2010 CD2 TRP A 129 16.647 -2.720 -0.189 1.00 0.31 C ATOM 2011 NE1 TRP A 129 18.377 -2.718 1.230 1.00 0.33 N ATOM 2012 CE2 TRP A 129 17.907 -3.283 0.074 1.00 0.36 C ATOM 2013 CE3 TRP A 129 15.948 -3.134 -1.327 1.00 0.37 C ATOM 2014 CZ2 TRP A 129 18.483 -4.238 -0.757 1.00 0.45 C ATOM 2015 CZ3 TRP A 129 16.521 -4.080 -2.152 1.00 0.47 C ATOM 2016 CH2 TRP A 129 17.778 -4.624 -1.864 1.00 0.50 C ATOM 0 H TRP A 129 14.611 -2.810 2.573 1.00 0.17 H new ATOM 0 HA TRP A 129 15.518 -0.176 2.972 1.00 0.17 H new ATOM 0 HB2 TRP A 129 14.322 -1.421 0.469 1.00 0.20 H new ATOM 0 HB3 TRP A 129 15.318 0.019 0.531 1.00 0.20 H new ATOM 0 HD1 TRP A 129 17.559 -1.225 2.590 1.00 0.27 H new ATOM 0 HE1 TRP A 129 19.271 -2.930 1.673 1.00 0.33 H new ATOM 0 HE3 TRP A 129 14.977 -2.721 -1.556 1.00 0.37 H new ATOM 0 HZ2 TRP A 129 19.452 -4.660 -0.536 1.00 0.45 H new ATOM 0 HZ3 TRP A 129 15.991 -4.406 -3.035 1.00 0.47 H new ATOM 0 HH2 TRP A 129 18.200 -5.363 -2.529 1.00 0.50 H new ATOM 2027 N MET A 130 12.311 -0.538 2.282 1.00 0.16 N ATOM 2028 CA MET A 130 11.032 0.157 2.279 1.00 0.21 C ATOM 2029 C MET A 130 10.722 0.715 3.657 1.00 0.19 C ATOM 2030 O MET A 130 10.346 1.876 3.787 1.00 0.21 O ATOM 2031 CB MET A 130 9.897 -0.765 1.833 1.00 0.29 C ATOM 2032 CG MET A 130 9.919 -1.114 0.356 1.00 0.33 C ATOM 2033 SD MET A 130 8.523 -2.149 -0.118 1.00 0.71 S ATOM 2034 CE MET A 130 7.161 -1.131 0.441 1.00 0.29 C ATOM 0 H MET A 130 12.250 -1.542 2.111 1.00 0.16 H new ATOM 0 HA MET A 130 11.110 0.979 1.567 1.00 0.21 H new ATOM 0 HB2 MET A 130 9.944 -1.687 2.413 1.00 0.29 H new ATOM 0 HB3 MET A 130 8.945 -0.289 2.068 1.00 0.29 H new ATOM 0 HG2 MET A 130 9.906 -0.197 -0.233 1.00 0.33 H new ATOM 0 HG3 MET A 130 10.849 -1.631 0.120 1.00 0.33 H new ATOM 0 HE1 MET A 130 6.217 -1.607 0.173 1.00 0.29 H new ATOM 0 HE2 MET A 130 7.214 -1.014 1.523 1.00 0.29 H new ATOM 0 HE3 MET A 130 7.221 -0.151 -0.033 1.00 0.29 H new ATOM 2044 N ALA A 131 10.905 -0.111 4.683 1.00 0.18 N ATOM 2045 CA ALA A 131 10.642 0.302 6.055 1.00 0.20 C ATOM 2046 C ALA A 131 11.544 1.461 6.447 1.00 0.21 C ATOM 2047 O ALA A 131 11.131 2.365 7.166 1.00 0.23 O ATOM 2048 CB ALA A 131 10.835 -0.866 7.008 1.00 0.23 C ATOM 0 H ALA A 131 11.235 -1.072 4.588 1.00 0.18 H new ATOM 0 HA ALA A 131 9.606 0.635 6.120 1.00 0.20 H new ATOM 0 HB1 ALA A 131 10.635 -0.540 8.029 1.00 0.23 H new ATOM 0 HB2 ALA A 131 10.148 -1.670 6.742 1.00 0.23 H new ATOM 0 HB3 ALA A 131 11.861 -1.227 6.938 1.00 0.23 H new ATOM 2054 N THR A 132 12.772 1.431 5.959 1.00 0.22 N ATOM 2055 CA THR A 132 13.722 2.498 6.220 1.00 0.25 C ATOM 2056 C THR A 132 13.243 3.807 5.598 1.00 0.24 C ATOM 2057 O THR A 132 13.071 4.801 6.299 1.00 0.25 O ATOM 2058 CB THR A 132 15.119 2.143 5.678 1.00 0.31 C ATOM 2059 OG1 THR A 132 15.557 0.903 6.246 1.00 0.33 O ATOM 2060 CG2 THR A 132 16.121 3.235 6.012 1.00 0.37 C ATOM 0 H THR A 132 13.136 0.676 5.378 1.00 0.22 H new ATOM 0 HA THR A 132 13.792 2.622 7.301 1.00 0.25 H new ATOM 0 HB THR A 132 15.054 2.049 4.594 1.00 0.31 H new ATOM 0 HG1 THR A 132 15.041 0.165 5.858 1.00 0.33 H new ATOM 0 HG21 THR A 132 17.101 2.962 5.619 1.00 0.37 H new ATOM 0 HG22 THR A 132 15.799 4.174 5.563 1.00 0.37 H new ATOM 0 HG23 THR A 132 16.184 3.353 7.094 1.00 0.37 H new ATOM 2068 N TYR A 133 13.010 3.802 4.289 1.00 0.23 N ATOM 2069 CA TYR A 133 12.580 5.009 3.589 1.00 0.24 C ATOM 2070 C TYR A 133 11.247 5.509 4.146 1.00 0.21 C ATOM 2071 O TYR A 133 11.056 6.712 4.348 1.00 0.23 O ATOM 2072 CB TYR A 133 12.455 4.743 2.085 1.00 0.27 C ATOM 2073 CG TYR A 133 12.159 5.985 1.273 1.00 0.33 C ATOM 2074 CD1 TYR A 133 13.190 6.787 0.802 1.00 0.42 C ATOM 2075 CD2 TYR A 133 10.852 6.356 0.980 1.00 0.36 C ATOM 2076 CE1 TYR A 133 12.928 7.924 0.062 1.00 0.50 C ATOM 2077 CE2 TYR A 133 10.582 7.491 0.242 1.00 0.45 C ATOM 2078 CZ TYR A 133 11.624 8.271 -0.215 1.00 0.51 C ATOM 2079 OH TYR A 133 11.362 9.402 -0.954 1.00 0.61 O ATOM 0 H TYR A 133 13.111 2.980 3.693 1.00 0.23 H new ATOM 0 HA TYR A 133 13.334 5.780 3.747 1.00 0.24 H new ATOM 0 HB2 TYR A 133 13.382 4.296 1.725 1.00 0.27 H new ATOM 0 HB3 TYR A 133 11.663 4.013 1.918 1.00 0.27 H new ATOM 0 HD1 TYR A 133 14.213 6.518 1.018 1.00 0.42 H new ATOM 0 HD2 TYR A 133 10.034 5.746 1.335 1.00 0.36 H new ATOM 0 HE1 TYR A 133 13.741 8.537 -0.297 1.00 0.50 H new ATOM 0 HE2 TYR A 133 9.561 7.767 0.024 1.00 0.45 H new ATOM 0 HH TYR A 133 11.329 9.170 -1.906 1.00 0.61 H new ATOM 2089 N LEU A 134 10.342 4.572 4.406 1.00 0.20 N ATOM 2090 CA LEU A 134 9.019 4.885 4.927 1.00 0.20 C ATOM 2091 C LEU A 134 9.104 5.507 6.319 1.00 0.21 C ATOM 2092 O LEU A 134 8.412 6.469 6.610 1.00 0.24 O ATOM 2093 CB LEU A 134 8.164 3.612 4.940 1.00 0.20 C ATOM 2094 CG LEU A 134 6.840 3.680 5.703 1.00 0.22 C ATOM 2095 CD1 LEU A 134 5.957 4.792 5.168 1.00 0.26 C ATOM 2096 CD2 LEU A 134 6.117 2.348 5.610 1.00 0.26 C ATOM 0 H LEU A 134 10.506 3.576 4.261 1.00 0.20 H new ATOM 0 HA LEU A 134 8.549 5.623 4.277 1.00 0.20 H new ATOM 0 HB2 LEU A 134 7.948 3.337 3.908 1.00 0.20 H new ATOM 0 HB3 LEU A 134 8.761 2.806 5.366 1.00 0.20 H new ATOM 0 HG LEU A 134 7.060 3.896 6.748 1.00 0.22 H new ATOM 0 HD11 LEU A 134 5.023 4.817 5.729 1.00 0.26 H new ATOM 0 HD12 LEU A 134 6.470 5.748 5.275 1.00 0.26 H new ATOM 0 HD13 LEU A 134 5.743 4.612 4.115 1.00 0.26 H new ATOM 0 HD21 LEU A 134 5.176 2.406 6.156 1.00 0.26 H new ATOM 0 HD22 LEU A 134 5.916 2.115 4.564 1.00 0.26 H new ATOM 0 HD23 LEU A 134 6.740 1.565 6.043 1.00 0.26 H new ATOM 2108 N ASN A 135 9.975 4.981 7.165 1.00 0.24 N ATOM 2109 CA ASN A 135 10.100 5.487 8.529 1.00 0.29 C ATOM 2110 C ASN A 135 10.960 6.740 8.598 1.00 0.30 C ATOM 2111 O ASN A 135 10.701 7.635 9.403 1.00 0.33 O ATOM 2112 CB ASN A 135 10.679 4.418 9.455 1.00 0.37 C ATOM 2113 CG ASN A 135 9.623 3.451 9.953 1.00 0.92 C ATOM 2114 OD1 ASN A 135 8.461 3.818 10.102 1.00 1.17 O ATOM 2115 ND2 ASN A 135 10.018 2.217 10.230 1.00 1.46 N ATOM 0 H ASN A 135 10.603 4.210 6.937 1.00 0.24 H new ATOM 0 HA ASN A 135 9.095 5.747 8.860 1.00 0.29 H new ATOM 0 HB2 ASN A 135 11.454 3.864 8.926 1.00 0.37 H new ATOM 0 HB3 ASN A 135 11.157 4.900 10.308 1.00 0.37 H new ATOM 0 HD21 ASN A 135 9.347 1.533 10.581 1.00 1.46 H new ATOM 0 HD22 ASN A 135 10.993 1.951 10.093 1.00 1.46 H new ATOM 2122 N ASP A 136 11.979 6.811 7.760 1.00 0.32 N ATOM 2123 CA ASP A 136 12.933 7.911 7.825 1.00 0.37 C ATOM 2124 C ASP A 136 12.440 9.139 7.061 1.00 0.34 C ATOM 2125 O ASP A 136 12.282 10.208 7.643 1.00 0.36 O ATOM 2126 CB ASP A 136 14.304 7.476 7.295 1.00 0.46 C ATOM 2127 CG ASP A 136 15.302 8.612 7.277 1.00 1.19 C ATOM 2128 OD1 ASP A 136 15.777 9.012 8.359 1.00 1.27 O ATOM 2129 OD2 ASP A 136 15.627 9.105 6.180 1.00 2.07 O ATOM 0 H ASP A 136 12.169 6.125 7.029 1.00 0.32 H new ATOM 0 HA ASP A 136 13.031 8.188 8.875 1.00 0.37 H new ATOM 0 HB2 ASP A 136 14.690 6.667 7.915 1.00 0.46 H new ATOM 0 HB3 ASP A 136 14.191 7.079 6.286 1.00 0.46 H new ATOM 2134 N HIS A 137 12.196 8.986 5.766 1.00 0.33 N ATOM 2135 CA HIS A 137 11.832 10.130 4.926 1.00 0.35 C ATOM 2136 C HIS A 137 10.324 10.327 4.836 1.00 0.29 C ATOM 2137 O HIS A 137 9.832 11.455 4.876 1.00 0.32 O ATOM 2138 CB HIS A 137 12.410 9.992 3.508 1.00 0.45 C ATOM 2139 CG HIS A 137 13.876 10.291 3.421 1.00 0.63 C ATOM 2140 ND1 HIS A 137 14.839 9.327 3.203 1.00 1.07 N ATOM 2141 CD2 HIS A 137 14.540 11.465 3.515 1.00 1.53 C ATOM 2142 CE1 HIS A 137 16.028 9.901 3.173 1.00 0.95 C ATOM 2143 NE2 HIS A 137 15.875 11.196 3.359 1.00 1.34 N ATOM 0 H HIS A 137 12.241 8.093 5.274 1.00 0.33 H new ATOM 0 HA HIS A 137 12.264 11.007 5.409 1.00 0.35 H new ATOM 0 HB2 HIS A 137 12.234 8.977 3.151 1.00 0.45 H new ATOM 0 HB3 HIS A 137 11.871 10.663 2.839 1.00 0.45 H new ATOM 0 HD2 HIS A 137 14.099 12.437 3.682 1.00 1.53 H new ATOM 0 HE1 HIS A 137 16.969 9.393 3.021 1.00 0.95 H new ATOM 0 HE2 HIS A 137 16.626 11.885 3.383 1.00 1.34 H new ATOM 2152 N LEU A 138 9.597 9.228 4.720 1.00 0.26 N ATOM 2153 CA LEU A 138 8.181 9.282 4.380 1.00 0.25 C ATOM 2154 C LEU A 138 7.312 9.602 5.602 1.00 0.24 C ATOM 2155 O LEU A 138 6.419 10.438 5.520 1.00 0.25 O ATOM 2156 CB LEU A 138 7.770 7.954 3.744 1.00 0.23 C ATOM 2157 CG LEU A 138 6.453 7.962 2.971 1.00 0.23 C ATOM 2158 CD1 LEU A 138 6.470 9.040 1.898 1.00 0.26 C ATOM 2159 CD2 LEU A 138 6.212 6.599 2.348 1.00 0.22 C ATOM 0 H LEU A 138 9.963 8.286 4.856 1.00 0.26 H new ATOM 0 HA LEU A 138 8.023 10.091 3.667 1.00 0.25 H new ATOM 0 HB2 LEU A 138 8.564 7.637 3.068 1.00 0.23 H new ATOM 0 HB3 LEU A 138 7.702 7.203 4.531 1.00 0.23 H new ATOM 0 HG LEU A 138 5.641 8.183 3.664 1.00 0.23 H new ATOM 0 HD11 LEU A 138 5.523 9.031 1.358 1.00 0.26 H new ATOM 0 HD12 LEU A 138 6.612 10.015 2.364 1.00 0.26 H new ATOM 0 HD13 LEU A 138 7.287 8.848 1.202 1.00 0.26 H new ATOM 0 HD21 LEU A 138 5.271 6.612 1.798 1.00 0.22 H new ATOM 0 HD22 LEU A 138 7.028 6.362 1.665 1.00 0.22 H new ATOM 0 HD23 LEU A 138 6.164 5.844 3.132 1.00 0.22 H new ATOM 2171 N GLU A 139 7.589 8.939 6.722 1.00 0.26 N ATOM 2172 CA GLU A 139 6.848 9.142 7.978 1.00 0.29 C ATOM 2173 C GLU A 139 6.698 10.630 8.343 1.00 0.30 C ATOM 2174 O GLU A 139 5.579 11.079 8.604 1.00 0.30 O ATOM 2175 CB GLU A 139 7.522 8.352 9.116 1.00 0.36 C ATOM 2176 CG GLU A 139 7.017 8.679 10.518 1.00 0.52 C ATOM 2177 CD GLU A 139 5.558 8.324 10.745 1.00 1.00 C ATOM 2178 OE1 GLU A 139 5.210 7.134 10.616 1.00 1.46 O ATOM 2179 OE2 GLU A 139 4.749 9.238 11.006 1.00 1.74 O ATOM 0 H GLU A 139 8.333 8.244 6.791 1.00 0.26 H new ATOM 0 HA GLU A 139 5.837 8.763 7.831 1.00 0.29 H new ATOM 0 HB2 GLU A 139 7.377 7.287 8.934 1.00 0.36 H new ATOM 0 HB3 GLU A 139 8.595 8.538 9.081 1.00 0.36 H new ATOM 0 HG2 GLU A 139 7.628 8.147 11.247 1.00 0.52 H new ATOM 0 HG3 GLU A 139 7.155 9.744 10.704 1.00 0.52 H new ATOM 2186 N PRO A 140 7.795 11.430 8.372 1.00 0.33 N ATOM 2187 CA PRO A 140 7.696 12.869 8.663 1.00 0.36 C ATOM 2188 C PRO A 140 6.723 13.584 7.728 1.00 0.31 C ATOM 2189 O PRO A 140 5.995 14.478 8.150 1.00 0.36 O ATOM 2190 CB PRO A 140 9.121 13.387 8.450 1.00 0.42 C ATOM 2191 CG PRO A 140 9.988 12.197 8.657 1.00 0.42 C ATOM 2192 CD PRO A 140 9.197 11.017 8.157 1.00 0.35 C ATOM 0 HA PRO A 140 7.314 13.050 9.668 1.00 0.36 H new ATOM 0 HB2 PRO A 140 9.247 13.800 7.449 1.00 0.42 H new ATOM 0 HB3 PRO A 140 9.363 14.182 9.156 1.00 0.42 H new ATOM 0 HG2 PRO A 140 10.926 12.298 8.111 1.00 0.42 H new ATOM 0 HG3 PRO A 140 10.243 12.078 9.710 1.00 0.42 H new ATOM 0 HD2 PRO A 140 9.399 10.814 7.105 1.00 0.35 H new ATOM 0 HD3 PRO A 140 9.438 10.109 8.709 1.00 0.35 H new ATOM 2200 N TRP A 141 6.704 13.168 6.464 1.00 0.28 N ATOM 2201 CA TRP A 141 5.808 13.754 5.476 1.00 0.25 C ATOM 2202 C TRP A 141 4.375 13.295 5.732 1.00 0.22 C ATOM 2203 O TRP A 141 3.439 14.097 5.729 1.00 0.22 O ATOM 2204 CB TRP A 141 6.242 13.354 4.055 1.00 0.29 C ATOM 2205 CG TRP A 141 5.383 13.949 2.982 1.00 0.29 C ATOM 2206 CD1 TRP A 141 5.571 15.142 2.349 1.00 0.32 C ATOM 2207 CD2 TRP A 141 4.195 13.378 2.419 1.00 0.30 C ATOM 2208 NE1 TRP A 141 4.570 15.353 1.436 1.00 0.35 N ATOM 2209 CE2 TRP A 141 3.713 14.284 1.460 1.00 0.33 C ATOM 2210 CE3 TRP A 141 3.490 12.189 2.638 1.00 0.31 C ATOM 2211 CZ2 TRP A 141 2.560 14.040 0.721 1.00 0.36 C ATOM 2212 CZ3 TRP A 141 2.347 11.948 1.904 1.00 0.35 C ATOM 2213 CH2 TRP A 141 1.890 12.870 0.955 1.00 0.36 C ATOM 0 H TRP A 141 7.301 12.425 6.101 1.00 0.28 H new ATOM 0 HA TRP A 141 5.855 14.839 5.563 1.00 0.25 H new ATOM 0 HB2 TRP A 141 7.275 13.665 3.897 1.00 0.29 H new ATOM 0 HB3 TRP A 141 6.219 12.268 3.968 1.00 0.29 H new ATOM 0 HD1 TRP A 141 6.389 15.821 2.539 1.00 0.32 H new ATOM 0 HE1 TRP A 141 4.478 16.173 0.836 1.00 0.35 H new ATOM 0 HE3 TRP A 141 3.835 11.473 3.369 1.00 0.31 H new ATOM 0 HZ2 TRP A 141 2.206 14.750 -0.012 1.00 0.36 H new ATOM 0 HZ3 TRP A 141 1.796 11.033 2.064 1.00 0.35 H new ATOM 0 HH2 TRP A 141 0.991 12.654 0.397 1.00 0.36 H new ATOM 2224 N ILE A 142 4.225 11.996 5.960 1.00 0.20 N ATOM 2225 CA ILE A 142 2.926 11.388 6.205 1.00 0.19 C ATOM 2226 C ILE A 142 2.248 12.048 7.401 1.00 0.20 C ATOM 2227 O ILE A 142 1.145 12.586 7.281 1.00 0.20 O ATOM 2228 CB ILE A 142 3.077 9.870 6.458 1.00 0.21 C ATOM 2229 CG1 ILE A 142 3.564 9.162 5.193 1.00 0.21 C ATOM 2230 CG2 ILE A 142 1.766 9.259 6.921 1.00 0.25 C ATOM 2231 CD1 ILE A 142 3.857 7.695 5.405 1.00 0.23 C ATOM 0 H ILE A 142 5.002 11.335 5.980 1.00 0.20 H new ATOM 0 HA ILE A 142 2.307 11.537 5.320 1.00 0.19 H new ATOM 0 HB ILE A 142 3.816 9.736 7.248 1.00 0.21 H new ATOM 0 HG12 ILE A 142 2.809 9.266 4.413 1.00 0.21 H new ATOM 0 HG13 ILE A 142 4.465 9.657 4.832 1.00 0.21 H new ATOM 0 HG21 ILE A 142 1.902 8.191 7.091 1.00 0.25 H new ATOM 0 HG22 ILE A 142 1.449 9.737 7.848 1.00 0.25 H new ATOM 0 HG23 ILE A 142 1.004 9.410 6.156 1.00 0.25 H new ATOM 0 HD11 ILE A 142 4.198 7.253 4.469 1.00 0.23 H new ATOM 0 HD12 ILE A 142 4.633 7.585 6.162 1.00 0.23 H new ATOM 0 HD13 ILE A 142 2.951 7.187 5.737 1.00 0.23 H new ATOM 2243 N GLN A 143 2.927 12.021 8.541 1.00 0.25 N ATOM 2244 CA GLN A 143 2.383 12.555 9.780 1.00 0.30 C ATOM 2245 C GLN A 143 2.124 14.057 9.669 1.00 0.29 C ATOM 2246 O GLN A 143 1.150 14.565 10.223 1.00 0.31 O ATOM 2247 CB GLN A 143 3.339 12.267 10.935 1.00 0.40 C ATOM 2248 CG GLN A 143 2.743 12.524 12.311 1.00 0.51 C ATOM 2249 CD GLN A 143 1.440 11.770 12.532 1.00 0.95 C ATOM 2250 OE1 GLN A 143 0.357 12.294 12.273 1.00 1.51 O ATOM 2251 NE2 GLN A 143 1.536 10.531 12.989 1.00 1.60 N ATOM 0 H GLN A 143 3.865 11.630 8.631 1.00 0.25 H new ATOM 0 HA GLN A 143 1.429 12.064 9.973 1.00 0.30 H new ATOM 0 HB2 GLN A 143 3.659 11.227 10.878 1.00 0.40 H new ATOM 0 HB3 GLN A 143 4.231 12.882 10.816 1.00 0.40 H new ATOM 0 HG2 GLN A 143 3.463 12.231 13.075 1.00 0.51 H new ATOM 0 HG3 GLN A 143 2.566 13.593 12.433 1.00 0.51 H new ATOM 0 HE21 GLN A 143 2.452 10.132 13.192 1.00 1.60 H new ATOM 0 HE22 GLN A 143 0.694 9.976 13.138 1.00 1.60 H new ATOM 2260 N GLU A 144 2.987 14.760 8.941 1.00 0.29 N ATOM 2261 CA GLU A 144 2.828 16.200 8.741 1.00 0.33 C ATOM 2262 C GLU A 144 1.523 16.500 8.002 1.00 0.29 C ATOM 2263 O GLU A 144 0.902 17.542 8.212 1.00 0.35 O ATOM 2264 CB GLU A 144 4.023 16.761 7.963 1.00 0.41 C ATOM 2265 CG GLU A 144 3.993 18.269 7.785 1.00 0.64 C ATOM 2266 CD GLU A 144 3.975 19.012 9.103 1.00 1.09 C ATOM 2267 OE1 GLU A 144 5.033 19.095 9.763 1.00 1.25 O ATOM 2268 OE2 GLU A 144 2.901 19.518 9.491 1.00 1.75 O ATOM 0 H GLU A 144 3.803 14.358 8.480 1.00 0.29 H new ATOM 0 HA GLU A 144 2.788 16.683 9.717 1.00 0.33 H new ATOM 0 HB2 GLU A 144 4.942 16.485 8.480 1.00 0.41 H new ATOM 0 HB3 GLU A 144 4.057 16.290 6.980 1.00 0.41 H new ATOM 0 HG2 GLU A 144 4.864 18.580 7.209 1.00 0.64 H new ATOM 0 HG3 GLU A 144 3.112 18.545 7.205 1.00 0.64 H new ATOM 2275 N ASN A 145 1.103 15.573 7.153 1.00 0.24 N ATOM 2276 CA ASN A 145 -0.143 15.727 6.409 1.00 0.28 C ATOM 2277 C ASN A 145 -1.296 15.018 7.117 1.00 0.30 C ATOM 2278 O ASN A 145 -2.330 14.731 6.512 1.00 0.42 O ATOM 2279 CB ASN A 145 0.006 15.195 4.976 1.00 0.32 C ATOM 2280 CG ASN A 145 0.846 16.109 4.095 1.00 0.34 C ATOM 2281 OD1 ASN A 145 0.320 17.029 3.465 1.00 0.40 O ATOM 2282 ND2 ASN A 145 2.148 15.866 4.030 1.00 0.33 N ATOM 0 H ASN A 145 1.605 14.706 6.961 1.00 0.24 H new ATOM 0 HA ASN A 145 -0.371 16.792 6.362 1.00 0.28 H new ATOM 0 HB2 ASN A 145 0.462 14.206 5.006 1.00 0.32 H new ATOM 0 HB3 ASN A 145 -0.982 15.077 4.532 1.00 0.32 H new ATOM 0 HD21 ASN A 145 2.747 16.449 3.445 1.00 0.33 H new ATOM 0 HD22 ASN A 145 2.550 15.096 4.565 1.00 0.33 H new ATOM 2289 N GLY A 146 -1.117 14.735 8.402 1.00 0.25 N ATOM 2290 CA GLY A 146 -2.192 14.159 9.192 1.00 0.30 C ATOM 2291 C GLY A 146 -1.910 12.732 9.614 1.00 0.30 C ATOM 2292 O GLY A 146 -2.410 12.265 10.638 1.00 0.41 O ATOM 0 H GLY A 146 -0.248 14.893 8.912 1.00 0.25 H new ATOM 0 HA2 GLY A 146 -2.352 14.771 10.080 1.00 0.30 H new ATOM 0 HA3 GLY A 146 -3.116 14.187 8.615 1.00 0.30 H new ATOM 2296 N GLY A 147 -1.110 12.038 8.825 1.00 0.24 N ATOM 2297 CA GLY A 147 -0.794 10.660 9.119 1.00 0.22 C ATOM 2298 C GLY A 147 -1.502 9.720 8.173 1.00 0.19 C ATOM 2299 O GLY A 147 -2.077 10.156 7.172 1.00 0.20 O ATOM 0 H GLY A 147 -0.671 12.407 7.981 1.00 0.24 H new ATOM 0 HA2 GLY A 147 0.283 10.509 9.047 1.00 0.22 H new ATOM 0 HA3 GLY A 147 -1.080 10.430 10.145 1.00 0.22 H new ATOM 2303 N TRP A 148 -1.472 8.432 8.482 1.00 0.20 N ATOM 2304 CA TRP A 148 -2.153 7.440 7.665 1.00 0.21 C ATOM 2305 C TRP A 148 -3.659 7.652 7.686 1.00 0.23 C ATOM 2306 O TRP A 148 -4.353 7.245 6.758 1.00 0.25 O ATOM 2307 CB TRP A 148 -1.823 6.023 8.134 1.00 0.23 C ATOM 2308 CG TRP A 148 -0.425 5.600 7.808 1.00 0.23 C ATOM 2309 CD1 TRP A 148 0.599 5.390 8.684 1.00 0.28 C ATOM 2310 CD2 TRP A 148 0.103 5.337 6.503 1.00 0.22 C ATOM 2311 NE1 TRP A 148 1.724 4.997 8.004 1.00 0.29 N ATOM 2312 CE2 TRP A 148 1.446 4.961 6.667 1.00 0.25 C ATOM 2313 CE3 TRP A 148 -0.432 5.379 5.213 1.00 0.22 C ATOM 2314 CZ2 TRP A 148 2.263 4.629 5.594 1.00 0.26 C ATOM 2315 CZ3 TRP A 148 0.382 5.050 4.145 1.00 0.23 C ATOM 2316 CH2 TRP A 148 1.718 4.677 4.344 1.00 0.24 C ATOM 0 H TRP A 148 -0.984 8.050 9.292 1.00 0.20 H new ATOM 0 HA TRP A 148 -1.798 7.562 6.642 1.00 0.21 H new ATOM 0 HB2 TRP A 148 -1.971 5.961 9.212 1.00 0.23 H new ATOM 0 HB3 TRP A 148 -2.523 5.324 7.675 1.00 0.23 H new ATOM 0 HD1 TRP A 148 0.534 5.515 9.755 1.00 0.28 H new ATOM 0 HE1 TRP A 148 2.623 4.769 8.428 1.00 0.29 H new ATOM 0 HE3 TRP A 148 -1.462 5.663 5.053 1.00 0.22 H new ATOM 0 HZ2 TRP A 148 3.294 4.343 5.744 1.00 0.26 H new ATOM 0 HZ3 TRP A 148 -0.018 5.081 3.142 1.00 0.23 H new ATOM 0 HH2 TRP A 148 2.329 4.422 3.491 1.00 0.24 H new ATOM 2327 N ASP A 149 -4.158 8.291 8.746 1.00 0.26 N ATOM 2328 CA ASP A 149 -5.584 8.606 8.857 1.00 0.31 C ATOM 2329 C ASP A 149 -6.077 9.295 7.593 1.00 0.30 C ATOM 2330 O ASP A 149 -7.136 8.966 7.071 1.00 0.37 O ATOM 2331 CB ASP A 149 -5.859 9.507 10.066 1.00 0.40 C ATOM 2332 CG ASP A 149 -7.340 9.759 10.269 1.00 1.24 C ATOM 2333 OD1 ASP A 149 -7.881 10.716 9.677 1.00 1.96 O ATOM 2334 OD2 ASP A 149 -7.975 8.997 11.030 1.00 1.94 O ATOM 0 H ASP A 149 -3.596 8.600 9.539 1.00 0.26 H new ATOM 0 HA ASP A 149 -6.119 7.666 8.991 1.00 0.31 H new ATOM 0 HB2 ASP A 149 -5.445 9.045 10.962 1.00 0.40 H new ATOM 0 HB3 ASP A 149 -5.346 10.459 9.931 1.00 0.40 H new ATOM 2339 N THR A 150 -5.281 10.230 7.093 1.00 0.27 N ATOM 2340 CA THR A 150 -5.612 10.957 5.882 1.00 0.29 C ATOM 2341 C THR A 150 -5.757 9.995 4.707 1.00 0.28 C ATOM 2342 O THR A 150 -6.786 9.970 4.030 1.00 0.33 O ATOM 2343 CB THR A 150 -4.510 11.978 5.557 1.00 0.33 C ATOM 2344 OG1 THR A 150 -4.145 12.693 6.744 1.00 0.38 O ATOM 2345 CG2 THR A 150 -4.972 12.959 4.490 1.00 0.37 C ATOM 0 H THR A 150 -4.393 10.503 7.515 1.00 0.27 H new ATOM 0 HA THR A 150 -6.556 11.476 6.045 1.00 0.29 H new ATOM 0 HB THR A 150 -3.645 11.436 5.175 1.00 0.33 H new ATOM 0 HG1 THR A 150 -4.323 13.648 6.618 1.00 0.38 H new ATOM 0 HG21 THR A 150 -4.173 13.670 4.279 1.00 0.37 H new ATOM 0 HG22 THR A 150 -5.223 12.415 3.580 1.00 0.37 H new ATOM 0 HG23 THR A 150 -5.851 13.496 4.846 1.00 0.37 H new ATOM 2353 N PHE A 151 -4.722 9.190 4.499 1.00 0.24 N ATOM 2354 CA PHE A 151 -4.658 8.279 3.365 1.00 0.25 C ATOM 2355 C PHE A 151 -5.769 7.231 3.432 1.00 0.26 C ATOM 2356 O PHE A 151 -6.443 6.963 2.436 1.00 0.30 O ATOM 2357 CB PHE A 151 -3.284 7.599 3.330 1.00 0.25 C ATOM 2358 CG PHE A 151 -3.097 6.685 2.158 1.00 0.27 C ATOM 2359 CD1 PHE A 151 -3.116 7.188 0.872 1.00 0.39 C ATOM 2360 CD2 PHE A 151 -2.901 5.327 2.340 1.00 0.26 C ATOM 2361 CE1 PHE A 151 -2.947 6.358 -0.213 1.00 0.43 C ATOM 2362 CE2 PHE A 151 -2.732 4.491 1.258 1.00 0.28 C ATOM 2363 CZ PHE A 151 -2.755 5.004 -0.021 1.00 0.34 C ATOM 0 H PHE A 151 -3.906 9.151 5.110 1.00 0.24 H new ATOM 0 HA PHE A 151 -4.801 8.854 2.450 1.00 0.25 H new ATOM 0 HB2 PHE A 151 -2.509 8.365 3.310 1.00 0.25 H new ATOM 0 HB3 PHE A 151 -3.146 7.030 4.249 1.00 0.25 H new ATOM 0 HD1 PHE A 151 -3.265 8.246 0.716 1.00 0.39 H new ATOM 0 HD2 PHE A 151 -2.880 4.919 3.340 1.00 0.26 H new ATOM 0 HE1 PHE A 151 -2.965 6.765 -1.213 1.00 0.43 H new ATOM 0 HE2 PHE A 151 -2.581 3.433 1.412 1.00 0.28 H new ATOM 0 HZ PHE A 151 -2.623 4.349 -0.870 1.00 0.34 H new ATOM 2373 N VAL A 152 -5.962 6.656 4.611 1.00 0.25 N ATOM 2374 CA VAL A 152 -6.971 5.626 4.805 1.00 0.29 C ATOM 2375 C VAL A 152 -8.372 6.203 4.641 1.00 0.35 C ATOM 2376 O VAL A 152 -9.230 5.592 4.014 1.00 0.45 O ATOM 2377 CB VAL A 152 -6.833 4.968 6.192 1.00 0.29 C ATOM 2378 CG1 VAL A 152 -7.897 3.901 6.395 1.00 0.35 C ATOM 2379 CG2 VAL A 152 -5.445 4.371 6.353 1.00 0.28 C ATOM 0 H VAL A 152 -5.430 6.887 5.450 1.00 0.25 H new ATOM 0 HA VAL A 152 -6.813 4.863 4.043 1.00 0.29 H new ATOM 0 HB VAL A 152 -6.976 5.736 6.952 1.00 0.29 H new ATOM 0 HG11 VAL A 152 -7.778 3.452 7.381 1.00 0.35 H new ATOM 0 HG12 VAL A 152 -8.886 4.354 6.319 1.00 0.35 H new ATOM 0 HG13 VAL A 152 -7.791 3.131 5.630 1.00 0.35 H new ATOM 0 HG21 VAL A 152 -5.359 3.909 7.337 1.00 0.28 H new ATOM 0 HG22 VAL A 152 -5.281 3.617 5.583 1.00 0.28 H new ATOM 0 HG23 VAL A 152 -4.697 5.158 6.255 1.00 0.28 H new ATOM 2389 N GLU A 153 -8.588 7.389 5.194 1.00 0.37 N ATOM 2390 CA GLU A 153 -9.877 8.066 5.095 1.00 0.46 C ATOM 2391 C GLU A 153 -10.224 8.377 3.637 1.00 0.51 C ATOM 2392 O GLU A 153 -11.392 8.329 3.245 1.00 0.62 O ATOM 2393 CB GLU A 153 -9.848 9.353 5.921 1.00 0.52 C ATOM 2394 CG GLU A 153 -11.153 10.123 5.929 1.00 0.70 C ATOM 2395 CD GLU A 153 -11.047 11.405 6.723 1.00 1.35 C ATOM 2396 OE1 GLU A 153 -10.281 12.298 6.313 1.00 2.17 O ATOM 2397 OE2 GLU A 153 -11.727 11.532 7.763 1.00 1.42 O ATOM 0 H GLU A 153 -7.883 7.906 5.719 1.00 0.37 H new ATOM 0 HA GLU A 153 -10.648 7.403 5.488 1.00 0.46 H new ATOM 0 HB2 GLU A 153 -9.581 9.105 6.948 1.00 0.52 H new ATOM 0 HB3 GLU A 153 -9.061 10.000 5.534 1.00 0.52 H new ATOM 0 HG2 GLU A 153 -11.444 10.354 4.904 1.00 0.70 H new ATOM 0 HG3 GLU A 153 -11.940 9.499 6.351 1.00 0.70 H new ATOM 2404 N LEU A 154 -9.203 8.686 2.836 1.00 0.50 N ATOM 2405 CA LEU A 154 -9.404 8.978 1.415 1.00 0.59 C ATOM 2406 C LEU A 154 -9.919 7.750 0.670 1.00 0.68 C ATOM 2407 O LEU A 154 -10.817 7.851 -0.165 1.00 0.74 O ATOM 2408 CB LEU A 154 -8.105 9.472 0.764 1.00 0.65 C ATOM 2409 CG LEU A 154 -7.624 10.851 1.216 1.00 0.64 C ATOM 2410 CD1 LEU A 154 -6.257 11.157 0.622 1.00 0.75 C ATOM 2411 CD2 LEU A 154 -8.628 11.923 0.817 1.00 0.67 C ATOM 0 H LEU A 154 -8.232 8.741 3.145 1.00 0.50 H new ATOM 0 HA LEU A 154 -10.152 9.768 1.348 1.00 0.59 H new ATOM 0 HB2 LEU A 154 -7.318 8.747 0.970 1.00 0.65 H new ATOM 0 HB3 LEU A 154 -8.246 9.492 -0.317 1.00 0.65 H new ATOM 0 HG LEU A 154 -7.537 10.847 2.303 1.00 0.64 H new ATOM 0 HD11 LEU A 154 -5.929 12.142 0.953 1.00 0.75 H new ATOM 0 HD12 LEU A 154 -5.540 10.405 0.953 1.00 0.75 H new ATOM 0 HD13 LEU A 154 -6.322 11.143 -0.466 1.00 0.75 H new ATOM 0 HD21 LEU A 154 -8.269 12.898 1.147 1.00 0.67 H new ATOM 0 HD22 LEU A 154 -8.745 11.927 -0.267 1.00 0.67 H new ATOM 0 HD23 LEU A 154 -9.590 11.713 1.285 1.00 0.67 H new ATOM 2423 N TYR A 155 -9.356 6.588 0.975 1.00 0.75 N ATOM 2424 CA TYR A 155 -9.782 5.348 0.330 1.00 0.90 C ATOM 2425 C TYR A 155 -10.848 4.643 1.158 1.00 0.97 C ATOM 2426 O TYR A 155 -11.290 3.549 0.818 1.00 1.15 O ATOM 2427 CB TYR A 155 -8.590 4.415 0.084 1.00 0.98 C ATOM 2428 CG TYR A 155 -7.687 4.885 -1.032 1.00 0.98 C ATOM 2429 CD1 TYR A 155 -6.630 5.750 -0.776 1.00 0.98 C ATOM 2430 CD2 TYR A 155 -7.882 4.459 -2.338 1.00 1.05 C ATOM 2431 CE1 TYR A 155 -5.796 6.176 -1.789 1.00 1.03 C ATOM 2432 CE2 TYR A 155 -7.049 4.878 -3.356 1.00 1.10 C ATOM 2433 CZ TYR A 155 -6.041 5.763 -3.093 1.00 1.08 C ATOM 2434 OH TYR A 155 -5.179 6.160 -4.091 1.00 1.17 O ATOM 0 H TYR A 155 -8.608 6.476 1.660 1.00 0.75 H new ATOM 0 HA TYR A 155 -10.214 5.609 -0.636 1.00 0.90 H new ATOM 0 HB2 TYR A 155 -8.008 4.330 1.002 1.00 0.98 H new ATOM 0 HB3 TYR A 155 -8.960 3.418 -0.153 1.00 0.98 H new ATOM 0 HD1 TYR A 155 -6.459 6.095 0.233 1.00 0.98 H new ATOM 0 HD2 TYR A 155 -8.699 3.789 -2.562 1.00 1.05 H new ATOM 0 HE1 TYR A 155 -4.960 6.824 -1.571 1.00 1.03 H new ATOM 0 HE2 TYR A 155 -7.194 4.507 -4.360 1.00 1.10 H new ATOM 0 HH TYR A 155 -5.619 6.063 -4.961 1.00 1.17 H new ATOM 2444 N GLY A 156 -11.264 5.285 2.237 1.00 0.89 N ATOM 2445 CA GLY A 156 -12.289 4.727 3.090 1.00 1.02 C ATOM 2446 C GLY A 156 -13.503 5.624 3.155 1.00 1.11 C ATOM 2447 O GLY A 156 -13.978 5.958 4.238 1.00 1.68 O ATOM 0 H GLY A 156 -10.906 6.191 2.539 1.00 0.89 H new ATOM 0 HA2 GLY A 156 -12.580 3.745 2.717 1.00 1.02 H new ATOM 0 HA3 GLY A 156 -11.889 4.581 4.093 1.00 1.02 H new ATOM 2451 N ASN A 157 -14.004 6.011 1.988 1.00 1.62 N ATOM 2452 CA ASN A 157 -15.162 6.896 1.894 1.00 2.05 C ATOM 2453 C ASN A 157 -16.383 6.258 2.542 1.00 2.33 C ATOM 2454 O ASN A 157 -17.197 6.940 3.162 1.00 2.52 O ATOM 2455 CB ASN A 157 -15.473 7.218 0.430 1.00 3.21 C ATOM 2456 CG ASN A 157 -14.364 7.988 -0.266 1.00 3.90 C ATOM 2457 OD1 ASN A 157 -14.103 7.772 -1.450 1.00 4.30 O ATOM 2458 ND2 ASN A 157 -13.718 8.901 0.442 1.00 4.60 N ATOM 0 H ASN A 157 -13.624 5.724 1.086 1.00 1.62 H new ATOM 0 HA ASN A 157 -14.922 7.819 2.422 1.00 2.05 H new ATOM 0 HB2 ASN A 157 -15.653 6.288 -0.109 1.00 3.21 H new ATOM 0 HB3 ASN A 157 -16.394 7.798 0.381 1.00 3.21 H new ATOM 0 HD21 ASN A 157 -12.977 9.452 0.009 1.00 4.60 H new ATOM 0 HD22 ASN A 157 -13.961 9.053 1.421 1.00 4.60 H new ATOM 2465 N ASN A 158 -16.507 4.943 2.394 1.00 2.99 N ATOM 2466 CA ASN A 158 -17.618 4.209 2.993 1.00 4.03 C ATOM 2467 C ASN A 158 -17.362 3.976 4.479 1.00 4.18 C ATOM 2468 O ASN A 158 -18.293 3.946 5.281 1.00 4.81 O ATOM 2469 CB ASN A 158 -17.839 2.873 2.270 1.00 5.08 C ATOM 2470 CG ASN A 158 -18.922 2.026 2.920 1.00 5.98 C ATOM 2471 OD1 ASN A 158 -20.112 2.182 2.632 1.00 6.22 O ATOM 2472 ND2 ASN A 158 -18.516 1.110 3.784 1.00 6.76 N ATOM 0 H ASN A 158 -15.854 4.364 1.866 1.00 2.99 H new ATOM 0 HA ASN A 158 -18.522 4.808 2.886 1.00 4.03 H new ATOM 0 HB2 ASN A 158 -18.109 3.067 1.232 1.00 5.08 H new ATOM 0 HB3 ASN A 158 -16.904 2.313 2.257 1.00 5.08 H new ATOM 0 HD21 ASN A 158 -19.196 0.501 4.239 1.00 6.76 H new ATOM 0 HD22 ASN A 158 -17.523 1.013 3.995 1.00 6.76 H new ATOM 2479 N ALA A 159 -16.094 3.835 4.844 1.00 3.95 N ATOM 2480 CA ALA A 159 -15.720 3.617 6.236 1.00 4.72 C ATOM 2481 C ALA A 159 -15.991 4.863 7.069 1.00 4.66 C ATOM 2482 O ALA A 159 -16.621 4.795 8.120 1.00 5.63 O ATOM 2483 CB ALA A 159 -14.256 3.219 6.334 1.00 4.78 C ATOM 0 H ALA A 159 -15.307 3.868 4.196 1.00 3.95 H new ATOM 0 HA ALA A 159 -16.329 2.804 6.632 1.00 4.72 H new ATOM 0 HB1 ALA A 159 -13.991 3.060 7.379 1.00 4.78 H new ATOM 0 HB2 ALA A 159 -14.091 2.299 5.774 1.00 4.78 H new ATOM 0 HB3 ALA A 159 -13.635 4.013 5.919 1.00 4.78 H new ATOM 2489 N ALA A 160 -15.529 6.007 6.578 1.00 3.75 N ATOM 2490 CA ALA A 160 -15.718 7.275 7.274 1.00 4.08 C ATOM 2491 C ALA A 160 -17.170 7.742 7.199 1.00 4.33 C ATOM 2492 O ALA A 160 -17.583 8.645 7.930 1.00 5.11 O ATOM 2493 CB ALA A 160 -14.796 8.333 6.692 1.00 3.59 C ATOM 0 H ALA A 160 -15.019 6.083 5.698 1.00 3.75 H new ATOM 0 HA ALA A 160 -15.470 7.121 8.324 1.00 4.08 H new ATOM 0 HB1 ALA A 160 -14.945 9.275 7.219 1.00 3.59 H new ATOM 0 HB2 ALA A 160 -13.760 8.014 6.805 1.00 3.59 H new ATOM 0 HB3 ALA A 160 -15.021 8.469 5.634 1.00 3.59 H new ATOM 2499 N ALA A 161 -17.943 7.109 6.323 1.00 3.93 N ATOM 2500 CA ALA A 161 -19.340 7.472 6.116 1.00 4.43 C ATOM 2501 C ALA A 161 -20.194 7.155 7.339 1.00 5.54 C ATOM 2502 O ALA A 161 -21.326 7.628 7.449 1.00 6.11 O ATOM 2503 CB ALA A 161 -19.891 6.761 4.892 1.00 4.39 C ATOM 0 H ALA A 161 -17.622 6.336 5.741 1.00 3.93 H new ATOM 0 HA ALA A 161 -19.381 8.549 5.955 1.00 4.43 H new ATOM 0 HB1 ALA A 161 -20.935 7.040 4.748 1.00 4.39 H new ATOM 0 HB2 ALA A 161 -19.314 7.049 4.013 1.00 4.39 H new ATOM 0 HB3 ALA A 161 -19.820 5.683 5.035 1.00 4.39 H new ATOM 2509 N GLU A 162 -19.647 6.361 8.257 1.00 5.98 N ATOM 2510 CA GLU A 162 -20.356 5.995 9.483 1.00 7.23 C ATOM 2511 C GLU A 162 -20.725 7.236 10.296 1.00 7.80 C ATOM 2512 O GLU A 162 -21.750 7.268 10.971 1.00 8.75 O ATOM 2513 CB GLU A 162 -19.496 5.057 10.336 1.00 7.72 C ATOM 2514 CG GLU A 162 -18.138 5.639 10.697 1.00 7.99 C ATOM 2515 CD GLU A 162 -17.398 4.809 11.721 1.00 8.68 C ATOM 2516 OE1 GLU A 162 -16.708 3.844 11.333 1.00 9.03 O ATOM 2517 OE2 GLU A 162 -17.492 5.131 12.926 1.00 9.09 O ATOM 0 H GLU A 162 -18.714 5.958 8.176 1.00 5.98 H new ATOM 0 HA GLU A 162 -21.274 5.482 9.197 1.00 7.23 H new ATOM 0 HB2 GLU A 162 -20.035 4.816 11.253 1.00 7.72 H new ATOM 0 HB3 GLU A 162 -19.350 4.121 9.797 1.00 7.72 H new ATOM 0 HG2 GLU A 162 -17.531 5.720 9.795 1.00 7.99 H new ATOM 0 HG3 GLU A 162 -18.272 6.649 11.083 1.00 7.99 H new ATOM 2524 N SER A 163 -19.892 8.266 10.212 1.00 7.39 N ATOM 2525 CA SER A 163 -20.111 9.487 10.972 1.00 8.21 C ATOM 2526 C SER A 163 -20.982 10.471 10.190 1.00 8.28 C ATOM 2527 O SER A 163 -21.211 11.599 10.622 1.00 9.15 O ATOM 2528 CB SER A 163 -18.764 10.125 11.313 1.00 8.03 C ATOM 2529 OG SER A 163 -17.877 9.165 11.868 1.00 7.86 O ATOM 0 H SER A 163 -19.058 8.279 9.624 1.00 7.39 H new ATOM 0 HA SER A 163 -20.636 9.235 11.893 1.00 8.21 H new ATOM 0 HB2 SER A 163 -18.323 10.557 10.415 1.00 8.03 H new ATOM 0 HB3 SER A 163 -18.912 10.941 12.020 1.00 8.03 H new ATOM 0 HG SER A 163 -17.021 9.593 12.077 1.00 7.86 H new ATOM 2535 N ARG A 164 -21.459 10.038 9.030 1.00 7.47 N ATOM 2536 CA ARG A 164 -22.311 10.870 8.188 1.00 7.60 C ATOM 2537 C ARG A 164 -23.775 10.457 8.333 1.00 8.33 C ATOM 2538 O ARG A 164 -24.644 10.912 7.585 1.00 8.87 O ATOM 2539 CB ARG A 164 -21.865 10.762 6.729 1.00 6.69 C ATOM 2540 CG ARG A 164 -20.412 11.152 6.516 1.00 6.19 C ATOM 2541 CD ARG A 164 -19.968 10.920 5.083 1.00 5.74 C ATOM 2542 NE ARG A 164 -18.552 11.231 4.900 1.00 5.66 N ATOM 2543 CZ ARG A 164 -17.840 10.887 3.826 1.00 5.62 C ATOM 2544 NH1 ARG A 164 -18.402 10.212 2.833 1.00 5.62 N ATOM 2545 NH2 ARG A 164 -16.561 11.219 3.747 1.00 6.02 N ATOM 0 H ARG A 164 -21.270 9.111 8.649 1.00 7.47 H new ATOM 0 HA ARG A 164 -22.217 11.908 8.509 1.00 7.60 H new ATOM 0 HB2 ARG A 164 -22.014 9.738 6.385 1.00 6.69 H new ATOM 0 HB3 ARG A 164 -22.499 11.400 6.114 1.00 6.69 H new ATOM 0 HG2 ARG A 164 -20.277 12.203 6.772 1.00 6.19 H new ATOM 0 HG3 ARG A 164 -19.779 10.575 7.190 1.00 6.19 H new ATOM 0 HD2 ARG A 164 -20.151 9.881 4.809 1.00 5.74 H new ATOM 0 HD3 ARG A 164 -20.566 11.537 4.412 1.00 5.74 H new ATOM 0 HE ARG A 164 -18.077 11.745 5.642 1.00 5.66 H new ATOM 0 HH11 ARG A 164 -19.387 9.952 2.887 1.00 5.62 H new ATOM 0 HH12 ARG A 164 -17.850 9.953 2.015 1.00 5.62 H new ATOM 0 HH21 ARG A 164 -16.121 11.737 4.507 1.00 6.02 H new ATOM 0 HH22 ARG A 164 -16.016 10.956 2.926 1.00 6.02 H new ATOM 2559 N LYS A 165 -24.040 9.598 9.311 1.00 8.52 N ATOM 2560 CA LYS A 165 -25.382 9.072 9.536 1.00 9.41 C ATOM 2561 C LYS A 165 -26.317 10.145 10.093 1.00 10.47 C ATOM 2562 O LYS A 165 -27.517 10.142 9.805 1.00 11.24 O ATOM 2563 CB LYS A 165 -25.326 7.868 10.482 1.00 9.61 C ATOM 2564 CG LYS A 165 -24.669 8.163 11.819 1.00 9.69 C ATOM 2565 CD LYS A 165 -24.561 6.914 12.675 1.00 10.12 C ATOM 2566 CE LYS A 165 -23.887 7.206 14.004 1.00 10.34 C ATOM 2567 NZ LYS A 165 -23.736 5.980 14.825 1.00 10.42 N ATOM 0 H LYS A 165 -23.339 9.249 9.964 1.00 8.52 H new ATOM 0 HA LYS A 165 -25.782 8.750 8.575 1.00 9.41 H new ATOM 0 HB2 LYS A 165 -26.340 7.510 10.658 1.00 9.61 H new ATOM 0 HB3 LYS A 165 -24.783 7.059 9.993 1.00 9.61 H new ATOM 0 HG2 LYS A 165 -23.675 8.578 11.653 1.00 9.69 H new ATOM 0 HG3 LYS A 165 -25.246 8.920 12.350 1.00 9.69 H new ATOM 0 HD2 LYS A 165 -25.556 6.506 12.853 1.00 10.12 H new ATOM 0 HD3 LYS A 165 -23.995 6.152 12.139 1.00 10.12 H new ATOM 0 HE2 LYS A 165 -22.906 7.647 13.825 1.00 10.34 H new ATOM 0 HE3 LYS A 165 -24.472 7.943 14.555 1.00 10.34 H new ATOM 0 HZ1 LYS A 165 -23.272 6.219 15.724 1.00 10.42 H new ATOM 0 HZ2 LYS A 165 -24.674 5.573 15.017 1.00 10.42 H new ATOM 0 HZ3 LYS A 165 -23.156 5.287 14.310 1.00 10.42 H new ATOM 2581 N GLY A 166 -25.763 11.063 10.880 1.00 10.61 N ATOM 2582 CA GLY A 166 -26.555 12.142 11.434 1.00 11.72 C ATOM 2583 C GLY A 166 -27.099 13.052 10.353 1.00 12.02 C ATOM 2584 O GLY A 166 -28.287 13.377 10.345 1.00 13.02 O ATOM 0 H GLY A 166 -24.778 11.077 11.143 1.00 10.61 H new ATOM 0 HA2 GLY A 166 -27.382 11.727 12.010 1.00 11.72 H new ATOM 0 HA3 GLY A 166 -25.945 12.723 12.125 1.00 11.72 H new ATOM 2588 N GLN A 167 -26.231 13.446 9.428 1.00 11.25 N ATOM 2589 CA GLN A 167 -26.635 14.282 8.304 1.00 11.64 C ATOM 2590 C GLN A 167 -27.601 13.532 7.395 1.00 12.01 C ATOM 2591 O GLN A 167 -28.513 14.126 6.827 1.00 12.84 O ATOM 2592 CB GLN A 167 -25.417 14.740 7.496 1.00 10.86 C ATOM 2593 CG GLN A 167 -24.501 15.697 8.243 1.00 11.50 C ATOM 2594 CD GLN A 167 -25.206 16.970 8.668 1.00 11.89 C ATOM 2595 OE1 GLN A 167 -25.256 17.950 7.923 1.00 11.87 O ATOM 2596 NE2 GLN A 167 -25.753 16.972 9.872 1.00 12.41 N ATOM 0 H GLN A 167 -25.241 13.199 9.435 1.00 11.25 H new ATOM 0 HA GLN A 167 -27.137 15.161 8.709 1.00 11.64 H new ATOM 0 HB2 GLN A 167 -24.843 13.863 7.196 1.00 10.86 H new ATOM 0 HB3 GLN A 167 -25.762 15.223 6.582 1.00 10.86 H new ATOM 0 HG2 GLN A 167 -24.101 15.197 9.125 1.00 11.50 H new ATOM 0 HG3 GLN A 167 -23.652 15.951 7.608 1.00 11.50 H new ATOM 0 HE21 GLN A 167 -25.692 16.142 10.461 1.00 12.41 H new ATOM 0 HE22 GLN A 167 -26.236 17.804 10.211 1.00 12.41 H new ATOM 2605 N GLU A 168 -27.401 12.224 7.278 1.00 11.51 N ATOM 2606 CA GLU A 168 -28.250 11.383 6.440 1.00 11.94 C ATOM 2607 C GLU A 168 -29.719 11.511 6.840 1.00 13.03 C ATOM 2608 O GLU A 168 -30.561 11.907 6.033 1.00 13.73 O ATOM 2609 CB GLU A 168 -27.810 9.920 6.542 1.00 11.38 C ATOM 2610 CG GLU A 168 -28.686 8.961 5.753 1.00 10.85 C ATOM 2611 CD GLU A 168 -28.305 7.513 5.971 1.00 10.80 C ATOM 2612 OE1 GLU A 168 -28.642 6.958 7.038 1.00 10.98 O ATOM 2613 OE2 GLU A 168 -27.658 6.925 5.080 1.00 10.74 O ATOM 0 H GLU A 168 -26.654 11.720 7.756 1.00 11.51 H new ATOM 0 HA GLU A 168 -28.144 11.721 5.409 1.00 11.94 H new ATOM 0 HB2 GLU A 168 -26.783 9.834 6.189 1.00 11.38 H new ATOM 0 HB3 GLU A 168 -27.813 9.621 7.590 1.00 11.38 H new ATOM 0 HG2 GLU A 168 -29.728 9.106 6.040 1.00 10.85 H new ATOM 0 HG3 GLU A 168 -28.612 9.197 4.691 1.00 10.85 H new ATOM 2620 N ARG A 169 -30.018 11.199 8.096 1.00 13.26 N ATOM 2621 CA ARG A 169 -31.394 11.234 8.583 1.00 14.38 C ATOM 2622 C ARG A 169 -31.901 12.669 8.700 1.00 15.16 C ATOM 2623 O ARG A 169 -33.108 12.914 8.723 1.00 16.19 O ATOM 2624 CB ARG A 169 -31.510 10.513 9.930 1.00 14.52 C ATOM 2625 CG ARG A 169 -30.672 11.122 11.042 1.00 14.72 C ATOM 2626 CD ARG A 169 -30.777 10.304 12.317 1.00 14.96 C ATOM 2627 NE ARG A 169 -30.035 10.902 13.427 1.00 14.97 N ATOM 2628 CZ ARG A 169 -29.832 10.298 14.597 1.00 15.22 C ATOM 2629 NH1 ARG A 169 -30.261 9.056 14.795 1.00 15.46 N ATOM 2630 NH2 ARG A 169 -29.188 10.937 15.565 1.00 15.37 N ATOM 0 H ARG A 169 -29.329 10.920 8.794 1.00 13.26 H new ATOM 0 HA ARG A 169 -32.018 10.714 7.856 1.00 14.38 H new ATOM 0 HB2 ARG A 169 -32.555 10.511 10.239 1.00 14.52 H new ATOM 0 HB3 ARG A 169 -31.215 9.472 9.798 1.00 14.52 H new ATOM 0 HG2 ARG A 169 -29.630 11.178 10.727 1.00 14.72 H new ATOM 0 HG3 ARG A 169 -31.003 12.143 11.233 1.00 14.72 H new ATOM 0 HD2 ARG A 169 -31.826 10.205 12.596 1.00 14.96 H new ATOM 0 HD3 ARG A 169 -30.400 9.298 12.132 1.00 14.96 H new ATOM 0 HE ARG A 169 -29.650 11.838 13.297 1.00 14.97 H new ATOM 0 HH11 ARG A 169 -30.749 8.560 14.049 1.00 15.46 H new ATOM 0 HH12 ARG A 169 -30.103 8.599 15.693 1.00 15.46 H new ATOM 0 HH21 ARG A 169 -28.850 11.887 15.412 1.00 15.37 H new ATOM 0 HH22 ARG A 169 -29.031 10.478 16.462 1.00 15.37 H new ATOM 2644 N LEU A 170 -30.974 13.611 8.756 1.00 14.77 N ATOM 2645 CA LEU A 170 -31.321 15.019 8.852 1.00 15.59 C ATOM 2646 C LEU A 170 -31.761 15.552 7.493 1.00 16.06 C ATOM 2647 O LEU A 170 -32.633 16.417 7.403 1.00 17.05 O ATOM 2648 CB LEU A 170 -30.127 15.816 9.377 1.00 15.16 C ATOM 2649 CG LEU A 170 -30.372 17.308 9.584 1.00 15.47 C ATOM 2650 CD1 LEU A 170 -31.502 17.535 10.576 1.00 16.05 C ATOM 2651 CD2 LEU A 170 -29.099 17.981 10.060 1.00 15.45 C ATOM 0 H LEU A 170 -29.971 13.425 8.737 1.00 14.77 H new ATOM 0 HA LEU A 170 -32.151 15.130 9.549 1.00 15.59 H new ATOM 0 HB2 LEU A 170 -29.812 15.382 10.326 1.00 15.16 H new ATOM 0 HB3 LEU A 170 -29.297 15.695 8.680 1.00 15.16 H new ATOM 0 HG LEU A 170 -30.666 17.749 8.632 1.00 15.47 H new ATOM 0 HD11 LEU A 170 -31.660 18.605 10.709 1.00 16.05 H new ATOM 0 HD12 LEU A 170 -32.416 17.078 10.197 1.00 16.05 H new ATOM 0 HD13 LEU A 170 -31.241 17.085 11.534 1.00 16.05 H new ATOM 0 HD21 LEU A 170 -29.283 19.046 10.205 1.00 15.45 H new ATOM 0 HD22 LEU A 170 -28.783 17.535 11.003 1.00 15.45 H new ATOM 0 HD23 LEU A 170 -28.316 17.846 9.314 1.00 15.45 H new ATOM 2663 N GLU A 171 -31.154 15.028 6.436 1.00 15.42 N ATOM 2664 CA GLU A 171 -31.513 15.408 5.076 1.00 15.90 C ATOM 2665 C GLU A 171 -32.868 14.833 4.689 1.00 16.52 C ATOM 2666 O GLU A 171 -33.547 15.357 3.803 1.00 17.29 O ATOM 2667 CB GLU A 171 -30.435 14.953 4.096 1.00 15.17 C ATOM 2668 CG GLU A 171 -29.181 15.805 4.156 1.00 15.22 C ATOM 2669 CD GLU A 171 -29.424 17.214 3.660 1.00 14.93 C ATOM 2670 OE1 GLU A 171 -29.932 18.054 4.435 1.00 15.07 O ATOM 2671 OE2 GLU A 171 -29.115 17.486 2.483 1.00 14.68 O ATOM 0 H GLU A 171 -30.407 14.336 6.495 1.00 15.42 H new ATOM 0 HA GLU A 171 -31.585 16.495 5.033 1.00 15.90 H new ATOM 0 HB2 GLU A 171 -30.174 13.916 4.308 1.00 15.17 H new ATOM 0 HB3 GLU A 171 -30.838 14.980 3.083 1.00 15.17 H new ATOM 0 HG2 GLU A 171 -28.817 15.841 5.183 1.00 15.22 H new ATOM 0 HG3 GLU A 171 -28.399 15.340 3.556 1.00 15.22 H new ATOM 2678 N HIS A 172 -33.257 13.755 5.355 1.00 16.27 N ATOM 2679 CA HIS A 172 -34.588 13.195 5.181 1.00 16.96 C ATOM 2680 C HIS A 172 -35.602 14.057 5.922 1.00 17.80 C ATOM 2681 O HIS A 172 -35.851 13.861 7.114 1.00 18.06 O ATOM 2682 CB HIS A 172 -34.654 11.748 5.681 1.00 16.71 C ATOM 2683 CG HIS A 172 -34.014 10.750 4.762 1.00 16.63 C ATOM 2684 ND1 HIS A 172 -34.704 9.697 4.206 1.00 16.51 N ATOM 2685 CD2 HIS A 172 -32.739 10.635 4.318 1.00 16.83 C ATOM 2686 CE1 HIS A 172 -33.887 8.979 3.460 1.00 16.61 C ATOM 2687 NE2 HIS A 172 -32.689 9.528 3.509 1.00 16.80 N ATOM 0 H HIS A 172 -32.670 13.252 6.020 1.00 16.27 H new ATOM 0 HA HIS A 172 -34.824 13.187 4.117 1.00 16.96 H new ATOM 0 HB2 HIS A 172 -34.170 11.690 6.656 1.00 16.71 H new ATOM 0 HB3 HIS A 172 -35.699 11.473 5.827 1.00 16.71 H new ATOM 0 HD2 HIS A 172 -31.916 11.292 4.556 1.00 16.83 H new ATOM 0 HE1 HIS A 172 -34.154 8.092 2.904 1.00 16.61 H new ATOM 0 HE2 HIS A 172 -31.860 9.185 3.024 1.00 16.80 H new ATOM 2696 N HIS A 173 -36.160 15.032 5.220 1.00 18.31 N ATOM 2697 CA HIS A 173 -37.056 16.004 5.830 1.00 19.22 C ATOM 2698 C HIS A 173 -37.944 16.650 4.772 1.00 19.76 C ATOM 2699 O HIS A 173 -37.468 17.037 3.702 1.00 19.79 O ATOM 2700 CB HIS A 173 -36.236 17.075 6.563 1.00 19.61 C ATOM 2701 CG HIS A 173 -37.056 18.097 7.296 1.00 20.05 C ATOM 2702 ND1 HIS A 173 -36.982 19.449 7.038 1.00 20.25 N ATOM 2703 CD2 HIS A 173 -37.952 17.959 8.302 1.00 20.44 C ATOM 2704 CE1 HIS A 173 -37.793 20.096 7.852 1.00 20.74 C ATOM 2705 NE2 HIS A 173 -38.395 19.216 8.626 1.00 20.87 N ATOM 0 H HIS A 173 -36.007 15.172 4.221 1.00 18.31 H new ATOM 0 HA HIS A 173 -37.697 15.492 6.548 1.00 19.22 H new ATOM 0 HB2 HIS A 173 -35.573 16.583 7.274 1.00 19.61 H new ATOM 0 HB3 HIS A 173 -35.603 17.588 5.839 1.00 19.61 H new ATOM 0 HD2 HIS A 173 -38.260 17.032 8.763 1.00 20.44 H new ATOM 0 HE1 HIS A 173 -37.939 21.166 7.880 1.00 20.74 H new ATOM 0 HE2 HIS A 173 -39.080 19.434 9.350 1.00 20.87 H new ATOM 2714 N HIS A 174 -39.232 16.746 5.066 1.00 20.30 N ATOM 2715 CA HIS A 174 -40.178 17.419 4.183 1.00 20.96 C ATOM 2716 C HIS A 174 -40.170 18.919 4.448 1.00 21.59 C ATOM 2717 O HIS A 174 -39.905 19.361 5.567 1.00 21.97 O ATOM 2718 CB HIS A 174 -41.597 16.872 4.377 1.00 21.33 C ATOM 2719 CG HIS A 174 -41.772 15.449 3.940 1.00 21.43 C ATOM 2720 ND1 HIS A 174 -41.847 14.395 4.825 1.00 21.76 N ATOM 2721 CD2 HIS A 174 -41.906 14.910 2.706 1.00 21.37 C ATOM 2722 CE1 HIS A 174 -42.019 13.273 4.155 1.00 21.89 C ATOM 2723 NE2 HIS A 174 -42.060 13.555 2.867 1.00 21.66 N ATOM 0 H HIS A 174 -39.650 16.364 5.915 1.00 20.30 H new ATOM 0 HA HIS A 174 -39.870 17.230 3.155 1.00 20.96 H new ATOM 0 HB2 HIS A 174 -41.864 16.952 5.431 1.00 21.33 H new ATOM 0 HB3 HIS A 174 -42.295 17.499 3.822 1.00 21.33 H new ATOM 0 HD2 HIS A 174 -41.894 15.446 1.768 1.00 21.37 H new ATOM 0 HE1 HIS A 174 -42.111 12.288 4.588 1.00 21.89 H new ATOM 0 HE2 HIS A 174 -42.185 12.878 2.114 1.00 21.66 H new ATOM 2732 N HIS A 175 -40.449 19.695 3.417 1.00 21.78 N ATOM 2733 CA HIS A 175 -40.504 21.144 3.544 1.00 22.46 C ATOM 2734 C HIS A 175 -41.935 21.589 3.819 1.00 23.08 C ATOM 2735 O HIS A 175 -42.882 21.010 3.289 1.00 23.17 O ATOM 2736 CB HIS A 175 -39.976 21.816 2.272 1.00 22.43 C ATOM 2737 CG HIS A 175 -38.539 21.507 1.980 1.00 22.30 C ATOM 2738 ND1 HIS A 175 -38.138 20.648 0.977 1.00 22.32 N ATOM 2739 CD2 HIS A 175 -37.401 21.953 2.564 1.00 22.27 C ATOM 2740 CE1 HIS A 175 -36.819 20.581 0.959 1.00 22.31 C ATOM 2741 NE2 HIS A 175 -36.350 21.363 1.909 1.00 22.28 N ATOM 0 H HIS A 175 -40.642 19.347 2.478 1.00 21.78 H new ATOM 0 HA HIS A 175 -39.872 21.444 4.380 1.00 22.46 H new ATOM 0 HB2 HIS A 175 -40.586 21.501 1.425 1.00 22.43 H new ATOM 0 HB3 HIS A 175 -40.095 22.895 2.366 1.00 22.43 H new ATOM 0 HD2 HIS A 175 -37.334 22.644 3.391 1.00 22.27 H new ATOM 0 HE1 HIS A 175 -36.226 19.986 0.280 1.00 22.31 H new ATOM 0 HE2 HIS A 175 -35.363 21.507 2.123 1.00 22.28 H new ATOM 2750 N HIS A 176 -42.090 22.607 4.655 1.00 23.60 N ATOM 2751 CA HIS A 176 -43.416 23.090 5.022 1.00 24.32 C ATOM 2752 C HIS A 176 -43.841 24.231 4.112 1.00 24.96 C ATOM 2753 O HIS A 176 -43.001 24.986 3.622 1.00 25.33 O ATOM 2754 CB HIS A 176 -43.444 23.548 6.483 1.00 24.63 C ATOM 2755 CG HIS A 176 -43.110 22.463 7.460 1.00 24.68 C ATOM 2756 ND1 HIS A 176 -43.886 21.337 7.627 1.00 24.97 N ATOM 2757 CD2 HIS A 176 -42.072 22.331 8.318 1.00 24.59 C ATOM 2758 CE1 HIS A 176 -43.342 20.561 8.543 1.00 25.05 C ATOM 2759 NE2 HIS A 176 -42.239 21.139 8.978 1.00 24.83 N ATOM 0 H HIS A 176 -41.319 23.113 5.090 1.00 23.60 H new ATOM 0 HA HIS A 176 -44.118 22.265 4.903 1.00 24.32 H new ATOM 0 HB2 HIS A 176 -42.739 24.369 6.611 1.00 24.63 H new ATOM 0 HB3 HIS A 176 -44.435 23.940 6.713 1.00 24.63 H new ATOM 0 HD2 HIS A 176 -41.263 23.033 8.458 1.00 24.59 H new ATOM 0 HE1 HIS A 176 -43.733 19.612 8.880 1.00 25.05 H new ATOM 0 HE2 HIS A 176 -41.612 20.762 9.689 1.00 24.83 H new ATOM 2768 N HIS A 177 -45.151 24.341 3.884 1.00 25.19 N ATOM 2769 CA HIS A 177 -45.722 25.365 3.005 1.00 25.89 C ATOM 2770 C HIS A 177 -45.223 25.205 1.571 1.00 26.38 C ATOM 2771 O HIS A 177 -45.220 26.158 0.791 1.00 26.64 O ATOM 2772 CB HIS A 177 -45.407 26.775 3.519 1.00 26.07 C ATOM 2773 CG HIS A 177 -46.108 27.127 4.795 1.00 26.41 C ATOM 2774 ND1 HIS A 177 -45.444 27.545 5.926 1.00 26.57 N ATOM 2775 CD2 HIS A 177 -47.424 27.138 5.110 1.00 26.71 C ATOM 2776 CE1 HIS A 177 -46.320 27.796 6.881 1.00 26.95 C ATOM 2777 NE2 HIS A 177 -47.527 27.559 6.412 1.00 27.04 N ATOM 0 H HIS A 177 -45.846 23.723 4.303 1.00 25.19 H new ATOM 0 HA HIS A 177 -46.803 25.229 3.010 1.00 25.89 H new ATOM 0 HB2 HIS A 177 -44.331 26.864 3.671 1.00 26.07 H new ATOM 0 HB3 HIS A 177 -45.682 27.500 2.753 1.00 26.07 H new ATOM 0 HD2 HIS A 177 -48.241 26.866 4.458 1.00 26.71 H new ATOM 0 HE1 HIS A 177 -46.086 28.138 7.878 1.00 26.95 H new ATOM 0 HE2 HIS A 177 -48.397 27.670 6.932 1.00 27.04 H new ATOM 2786 N LEU A 178 -44.826 23.988 1.221 1.00 26.60 N ATOM 2787 CA LEU A 178 -44.331 23.699 -0.114 1.00 27.15 C ATOM 2788 C LEU A 178 -45.202 22.646 -0.786 1.00 27.42 C ATOM 2789 O LEU A 178 -45.765 22.879 -1.856 1.00 27.57 O ATOM 2790 CB LEU A 178 -42.876 23.218 -0.058 1.00 27.23 C ATOM 2791 CG LEU A 178 -42.263 22.838 -1.411 1.00 27.46 C ATOM 2792 CD1 LEU A 178 -42.221 24.040 -2.344 1.00 27.88 C ATOM 2793 CD2 LEU A 178 -40.868 22.262 -1.222 1.00 27.61 C ATOM 0 H LEU A 178 -44.838 23.184 1.848 1.00 26.60 H new ATOM 0 HA LEU A 178 -44.372 24.617 -0.700 1.00 27.15 H new ATOM 0 HB2 LEU A 178 -42.267 24.003 0.391 1.00 27.23 H new ATOM 0 HB3 LEU A 178 -42.821 22.354 0.604 1.00 27.23 H new ATOM 0 HG LEU A 178 -42.894 22.075 -1.867 1.00 27.46 H new ATOM 0 HD11 LEU A 178 -41.782 23.745 -3.297 1.00 27.88 H new ATOM 0 HD12 LEU A 178 -43.234 24.408 -2.509 1.00 27.88 H new ATOM 0 HD13 LEU A 178 -41.617 24.828 -1.895 1.00 27.88 H new ATOM 0 HD21 LEU A 178 -40.449 21.998 -2.193 1.00 27.61 H new ATOM 0 HD22 LEU A 178 -40.230 23.004 -0.741 1.00 27.61 H new ATOM 0 HD23 LEU A 178 -40.924 21.371 -0.597 1.00 27.61 H new ATOM 2805 N GLU A 179 -45.324 21.494 -0.145 1.00 27.58 N ATOM 2806 CA GLU A 179 -46.117 20.404 -0.683 1.00 27.93 C ATOM 2807 C GLU A 179 -47.391 20.217 0.134 1.00 28.01 C ATOM 2808 O GLU A 179 -47.411 19.510 1.141 1.00 27.88 O ATOM 2809 CB GLU A 179 -45.301 19.104 -0.732 1.00 28.15 C ATOM 2810 CG GLU A 179 -44.655 18.717 0.593 1.00 28.46 C ATOM 2811 CD GLU A 179 -44.073 17.320 0.565 1.00 28.92 C ATOM 2812 OE1 GLU A 179 -44.849 16.343 0.563 1.00 29.20 O ATOM 2813 OE2 GLU A 179 -42.827 17.192 0.550 1.00 29.07 O ATOM 0 H GLU A 179 -44.882 21.291 0.751 1.00 27.58 H new ATOM 0 HA GLU A 179 -46.400 20.659 -1.704 1.00 27.93 H new ATOM 0 HB2 GLU A 179 -45.952 18.292 -1.056 1.00 28.15 H new ATOM 0 HB3 GLU A 179 -44.521 19.207 -1.486 1.00 28.15 H new ATOM 0 HG2 GLU A 179 -43.867 19.431 0.832 1.00 28.46 H new ATOM 0 HG3 GLU A 179 -45.397 18.783 1.389 1.00 28.46 H new ATOM 2820 N HIS A 180 -48.455 20.877 -0.286 1.00 28.32 N ATOM 2821 CA HIS A 180 -49.721 20.784 0.421 1.00 28.53 C ATOM 2822 C HIS A 180 -50.514 19.592 -0.086 1.00 28.95 C ATOM 2823 O HIS A 180 -51.024 19.600 -1.207 1.00 29.23 O ATOM 2824 CB HIS A 180 -50.530 22.071 0.273 1.00 28.74 C ATOM 2825 CG HIS A 180 -49.941 23.240 0.997 1.00 28.72 C ATOM 2826 ND1 HIS A 180 -50.103 23.447 2.348 1.00 28.77 N ATOM 2827 CD2 HIS A 180 -49.192 24.274 0.549 1.00 28.77 C ATOM 2828 CE1 HIS A 180 -49.484 24.556 2.700 1.00 28.84 C ATOM 2829 NE2 HIS A 180 -48.920 25.080 1.627 1.00 28.84 N ATOM 0 H HIS A 180 -48.469 21.480 -1.108 1.00 28.32 H new ATOM 0 HA HIS A 180 -49.512 20.643 1.482 1.00 28.53 H new ATOM 0 HB2 HIS A 180 -50.615 22.316 -0.786 1.00 28.74 H new ATOM 0 HB3 HIS A 180 -51.541 21.898 0.642 1.00 28.74 H new ATOM 0 HD2 HIS A 180 -48.868 24.436 -0.468 1.00 28.77 H new ATOM 0 HE1 HIS A 180 -49.445 24.967 3.698 1.00 28.84 H new ATOM 0 HE2 HIS A 180 -48.373 25.941 1.603 1.00 28.84 H new ATOM 2838 N HIS A 181 -50.601 18.567 0.745 1.00 29.09 N ATOM 2839 CA HIS A 181 -51.260 17.328 0.372 1.00 29.57 C ATOM 2840 C HIS A 181 -52.766 17.527 0.319 1.00 29.91 C ATOM 2841 O HIS A 181 -53.366 18.072 1.246 1.00 30.13 O ATOM 2842 CB HIS A 181 -50.906 16.210 1.360 1.00 29.72 C ATOM 2843 CG HIS A 181 -49.466 15.791 1.310 1.00 29.81 C ATOM 2844 ND1 HIS A 181 -49.071 14.491 1.103 1.00 29.72 N ATOM 2845 CD2 HIS A 181 -48.325 16.508 1.449 1.00 30.08 C ATOM 2846 CE1 HIS A 181 -47.753 14.424 1.115 1.00 29.92 C ATOM 2847 NE2 HIS A 181 -47.272 15.635 1.322 1.00 30.14 N ATOM 0 H HIS A 181 -50.219 18.570 1.691 1.00 29.09 H new ATOM 0 HA HIS A 181 -50.910 17.036 -0.618 1.00 29.57 H new ATOM 0 HB2 HIS A 181 -51.143 16.542 2.371 1.00 29.72 H new ATOM 0 HB3 HIS A 181 -51.534 15.343 1.154 1.00 29.72 H new ATOM 0 HD2 HIS A 181 -48.256 17.571 1.627 1.00 30.08 H new ATOM 0 HE1 HIS A 181 -47.166 13.528 0.978 1.00 29.92 H new ATOM 0 HE2 HIS A 181 -46.284 15.882 1.378 1.00 30.14 H new ATOM 2856 N HIS A 182 -53.369 17.086 -0.770 1.00 30.03 N ATOM 2857 CA HIS A 182 -54.799 17.255 -0.976 1.00 30.43 C ATOM 2858 C HIS A 182 -55.540 16.045 -0.432 1.00 30.87 C ATOM 2859 O HIS A 182 -56.642 16.166 0.108 1.00 31.02 O ATOM 2860 CB HIS A 182 -55.118 17.427 -2.467 1.00 30.52 C ATOM 2861 CG HIS A 182 -54.365 18.544 -3.124 1.00 30.37 C ATOM 2862 ND1 HIS A 182 -54.834 19.836 -3.192 1.00 30.34 N ATOM 2863 CD2 HIS A 182 -53.162 18.551 -3.742 1.00 30.33 C ATOM 2864 CE1 HIS A 182 -53.951 20.589 -3.822 1.00 30.28 C ATOM 2865 NE2 HIS A 182 -52.925 19.834 -4.165 1.00 30.28 N ATOM 0 H HIS A 182 -52.889 16.605 -1.531 1.00 30.03 H new ATOM 0 HA HIS A 182 -55.121 18.152 -0.447 1.00 30.43 H new ATOM 0 HB2 HIS A 182 -54.893 16.495 -2.986 1.00 30.52 H new ATOM 0 HB3 HIS A 182 -56.187 17.606 -2.582 1.00 30.52 H new ATOM 0 HD2 HIS A 182 -52.508 17.702 -3.878 1.00 30.33 H new ATOM 0 HE1 HIS A 182 -54.052 21.645 -4.023 1.00 30.28 H new ATOM 0 HE2 HIS A 182 -52.093 20.152 -4.662 1.00 30.28 H new ATOM 2874 N HIS A 183 -54.916 14.884 -0.571 1.00 31.15 N ATOM 2875 CA HIS A 183 -55.499 13.633 -0.120 1.00 31.67 C ATOM 2876 C HIS A 183 -54.398 12.640 0.237 1.00 32.06 C ATOM 2877 O HIS A 183 -53.464 12.438 -0.536 1.00 32.12 O ATOM 2878 CB HIS A 183 -56.401 13.051 -1.212 1.00 31.92 C ATOM 2879 CG HIS A 183 -57.073 11.771 -0.823 1.00 31.89 C ATOM 2880 ND1 HIS A 183 -56.755 10.554 -1.381 1.00 31.92 N ATOM 2881 CD2 HIS A 183 -58.059 11.524 0.070 1.00 31.92 C ATOM 2882 CE1 HIS A 183 -57.517 9.618 -0.851 1.00 31.97 C ATOM 2883 NE2 HIS A 183 -58.317 10.177 0.032 1.00 31.97 N ATOM 0 H HIS A 183 -53.995 14.785 -0.998 1.00 31.15 H new ATOM 0 HA HIS A 183 -56.100 13.824 0.769 1.00 31.67 H new ATOM 0 HB2 HIS A 183 -57.163 13.786 -1.471 1.00 31.92 H new ATOM 0 HB3 HIS A 183 -55.806 12.880 -2.109 1.00 31.92 H new ATOM 0 HD2 HIS A 183 -58.552 12.252 0.697 1.00 31.92 H new ATOM 0 HE1 HIS A 183 -57.489 8.567 -1.100 1.00 31.97 H new ATOM 0 HE2 HIS A 183 -59.014 9.689 0.595 1.00 31.97 H new ATOM 2892 N HIS A 184 -54.506 12.034 1.408 1.00 32.40 N ATOM 2893 CA HIS A 184 -53.523 11.055 1.854 1.00 32.88 C ATOM 2894 C HIS A 184 -53.860 9.671 1.318 1.00 33.44 C ATOM 2895 O HIS A 184 -54.826 9.046 1.756 1.00 33.70 O ATOM 2896 CB HIS A 184 -53.448 11.011 3.386 1.00 33.08 C ATOM 2897 CG HIS A 184 -52.896 12.256 4.014 1.00 32.98 C ATOM 2898 ND1 HIS A 184 -51.606 12.351 4.490 1.00 33.08 N ATOM 2899 CD2 HIS A 184 -53.471 13.456 4.260 1.00 32.87 C ATOM 2900 CE1 HIS A 184 -51.413 13.551 5.001 1.00 33.03 C ATOM 2901 NE2 HIS A 184 -52.528 14.242 4.874 1.00 32.91 N ATOM 0 H HIS A 184 -55.265 12.202 2.069 1.00 32.40 H new ATOM 0 HA HIS A 184 -52.552 11.360 1.464 1.00 32.88 H new ATOM 0 HB2 HIS A 184 -54.448 10.831 3.782 1.00 33.08 H new ATOM 0 HB3 HIS A 184 -52.830 10.164 3.683 1.00 33.08 H new ATOM 0 HD2 HIS A 184 -54.484 13.742 4.018 1.00 32.87 H new ATOM 0 HE1 HIS A 184 -50.497 13.907 5.448 1.00 33.03 H new ATOM 0 HE2 HIS A 184 -52.668 15.204 5.182 1.00 32.91 H new ATOM 2910 N HIS A 185 -53.080 9.208 0.354 1.00 33.68 N ATOM 2911 CA HIS A 185 -53.242 7.861 -0.175 1.00 34.28 C ATOM 2912 C HIS A 185 -52.175 6.950 0.416 1.00 34.40 C ATOM 2913 O HIS A 185 -52.465 6.283 1.428 1.00 34.51 O ATOM 2914 CB HIS A 185 -53.165 7.858 -1.709 1.00 34.66 C ATOM 2915 CG HIS A 185 -53.287 6.492 -2.325 1.00 35.20 C ATOM 2916 ND1 HIS A 185 -54.497 5.876 -2.560 1.00 35.58 N ATOM 2917 CD2 HIS A 185 -52.340 5.629 -2.764 1.00 35.50 C ATOM 2918 CE1 HIS A 185 -54.288 4.697 -3.114 1.00 36.07 C ATOM 2919 NE2 HIS A 185 -52.990 4.524 -3.250 1.00 36.03 N ATOM 2920 OXT HIS A 185 -51.048 6.924 -0.121 1.00 34.44 O ATOM 0 H HIS A 185 -52.328 9.744 -0.079 1.00 33.68 H new ATOM 0 HA HIS A 185 -54.227 7.490 0.108 1.00 34.28 H new ATOM 0 HB2 HIS A 185 -53.957 8.495 -2.103 1.00 34.66 H new ATOM 0 HB3 HIS A 185 -52.217 8.300 -2.016 1.00 34.66 H new ATOM 0 HD2 HIS A 185 -51.271 5.783 -2.736 1.00 35.50 H new ATOM 0 HE1 HIS A 185 -55.053 3.993 -3.407 1.00 36.07 H new ATOM 0 HE2 HIS A 185 -52.541 3.701 -3.652 1.00 36.03 H new TER 2929 HIS A 185