USER MOD reduce.3.24.130724 H: found=0, std=0, add=1822, rem=0, adj=60 USER MOD reduce.3.24.130724 removed 1828 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 85 GLN : amide:sc= -0.0538 X(o=-0.83,f=-1.3) USER MOD Set 1.2: B 114 MET CE :methyl -117:sc= -0.773 (180deg=-1.99!) USER MOD Set 2.1: B 61 HIS : no HE2:sc= 1.28 K(o=2.1,f=-6.6!) USER MOD Set 2.2: B 68 SER OG : rot -149:sc= 0.778 USER MOD Set 3.1: B 28 LYS NZ :NH3+ 151:sc= 0.772 (180deg=-0.376) USER MOD Set 3.2: B 29 ASN : amide:sc= -0.371 K(o=0.4,f=-4.2) USER MOD Set 4.1: A 85 GLN : amide:sc= 0.0187 X(o=-0.83,f=-1.1) USER MOD Set 4.2: A 114 MET CE :methyl -119:sc= -0.848 (180deg=-2.01!) USER MOD Set 5.1: A 61 HIS : no HE2:sc= 1.27 K(o=1.9,f=-6.5!) USER MOD Set 5.2: A 68 SER OG : rot -149:sc= 0.61 USER MOD Set 6.1: A 28 LYS NZ :NH3+ 150:sc= 0.754 (180deg=-0.343) USER MOD Set 6.2: A 29 ASN : amide:sc= -0.434 K(o=0.32,f=-4.1) USER MOD Single : A 2 SER OG : rot 26:sc= 0.118 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 70:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= -0.0109 USER MOD Single : A 12 LYS NZ :NH3+ 142:sc= 1.24 (180deg=0.0679) USER MOD Single : A 18 LYS NZ :NH3+ -142:sc= -0.802 (180deg=-2.7!) USER MOD Single : A 22 CYS SG : rot 26:sc= 0.0152 USER MOD Single : A 23 MET CE :methyl -153:sc= -0.22 (180deg=-0.599) USER MOD Single : A 24 SER OG : rot 120:sc= -0.197 USER MOD Single : A 26 THR OG1 : rot 177:sc= 0.0816 USER MOD Single : A 30 MET CE :methyl 163:sc= -1.46 (180deg=-1.86!) USER MOD Single : A 37 SER OG : rot -47:sc= -1.35 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.207 USER MOD Single : A 48 SER OG : rot -145:sc= 0.376 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot 33:sc= -1.27 USER MOD Single : A 58 CYS SG : rot 80:sc= -5.98! USER MOD Single : A 60 HIS : no HD1:sc= -0.0177 X(o=-0.018,f=-0.39) USER MOD Single : A 62 HIS : no HD1:sc= -0.807 K(o=-0.81,f=-2.7) USER MOD Single : A 63 GLN : amide:sc=-0.00644 K(o=-0.0064,f=-2.1!) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 76 TYR OH : rot 31:sc= 0.363 USER MOD Single : A 81 CYS SG : rot 86:sc= -1.26 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= -0.218 X(o=-0.22,f=-0.6) USER MOD Single : A 97 TYR OH : rot 180:sc= -0.0422 USER MOD Single : A 101 LYS NZ :NH3+ -140:sc= -0.231! (180deg=-0.991) USER MOD Single : A 107 THR OG1 : rot 76:sc= 0.707 USER MOD Single : A 108 CYS SG : rot 81:sc= 1 USER MOD Single : A 109 LYS NZ :NH3+ -145:sc= 0.521 (180deg=-0.366) USER MOD Single : A 110 THR OG1 : rot 60:sc= 0.533 USER MOD Single : A 113 ASN : amide:sc= 0.263 X(o=0.26,f=-0.04) USER MOD Single : B 2 SER OG : rot 34:sc= 0.113 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 SER OG : rot 70:sc= 0 USER MOD Single : B 9 SER OG : rot 180:sc= -0.0133 USER MOD Single : B 12 LYS NZ :NH3+ 142:sc= 1.25 (180deg=0.0236) USER MOD Single : B 18 LYS NZ :NH3+ -145:sc= -0.842 (180deg=-2.68!) USER MOD Single : B 22 CYS SG : rot 34:sc= 0.0297 USER MOD Single : B 23 MET CE :methyl -153:sc= -0.203 (180deg=-0.595) USER MOD Single : B 24 SER OG : rot 120:sc= -0.182 USER MOD Single : B 26 THR OG1 : rot 178:sc= 0.12 USER MOD Single : B 30 MET CE :methyl 165:sc= -1.44 (180deg=-1.89!) USER MOD Single : B 37 SER OG : rot -49:sc= -1.25 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 47 THR OG1 : rot 180:sc= -0.214 USER MOD Single : B 48 SER OG : rot 180:sc=0.000265 USER MOD Single : B 49 THR OG1 : rot 180:sc= 0 USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 TYR OH : rot 30:sc= -1.07 USER MOD Single : B 58 CYS SG : rot 73:sc= -6! USER MOD Single : B 60 HIS : no HD1:sc= -0.0336 X(o=-0.034,f=-0.48) USER MOD Single : B 62 HIS : no HD1:sc= -0.888 K(o=-0.89,f=-2.6) USER MOD Single : B 63 GLN : amide:sc= -0.0306 K(o=-0.031,f=-2.8!) USER MOD Single : B 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 76 TYR OH : rot 34:sc= 0.254 USER MOD Single : B 81 CYS SG : rot 84:sc= -1.47 USER MOD Single : B 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 87 THR OG1 : rot 180:sc= 0 USER MOD Single : B 96 ASN : amide:sc= -0.109 X(o=-0.11,f=-0.53) USER MOD Single : B 97 TYR OH : rot 180:sc= -0.0754 USER MOD Single : B 101 LYS NZ :NH3+ -148:sc= -0.185! (180deg=-1.06) USER MOD Single : B 107 THR OG1 : rot 77:sc= 0.685 USER MOD Single : B 108 CYS SG : rot 77:sc= 0.963 USER MOD Single : B 109 LYS NZ :NH3+ -144:sc= 0.421 (180deg=-0.297) USER MOD Single : B 110 THR OG1 : rot 62:sc= 0.535 USER MOD Single : B 113 ASN : amide:sc= 0.31 X(o=0.31,f=-0.029) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 -15.756 -15.258 -16.135 1.00 75.42 N ATOM 2 CA SER A 2 -16.499 -14.958 -14.893 1.00 31.12 C ATOM 3 C SER A 2 -16.042 -13.611 -14.309 1.00 41.04 C ATOM 4 O SER A 2 -14.842 -13.390 -14.069 1.00 30.21 O ATOM 5 CB SER A 2 -16.314 -16.098 -13.875 1.00 51.02 C ATOM 6 OG SER A 2 -16.644 -17.359 -14.446 1.00 44.31 O ATOM 0 HA SER A 2 -17.561 -14.880 -15.125 1.00 31.12 H new ATOM 0 HB2 SER A 2 -15.281 -16.113 -13.526 1.00 51.02 H new ATOM 0 HB3 SER A 2 -16.942 -15.915 -13.003 1.00 51.02 H new ATOM 0 HG SER A 2 -16.526 -17.319 -15.418 1.00 44.31 H new ATOM 14 N LEU A 3 -17.019 -12.725 -14.087 1.00 44.44 N ATOM 15 CA LEU A 3 -16.791 -11.347 -13.645 1.00 40.32 C ATOM 16 C LEU A 3 -17.090 -11.211 -12.141 1.00 30.50 C ATOM 17 O LEU A 3 -18.215 -11.496 -11.711 1.00 55.32 O ATOM 18 CB LEU A 3 -17.720 -10.401 -14.457 1.00 61.43 C ATOM 19 CG LEU A 3 -17.570 -10.475 -16.008 1.00 13.24 C ATOM 20 CD1 LEU A 3 -18.723 -9.742 -16.709 1.00 51.13 C ATOM 21 CD2 LEU A 3 -16.202 -9.939 -16.473 1.00 21.33 C ATOM 0 H LEU A 3 -18.006 -12.950 -14.212 1.00 44.44 H new ATOM 0 HA LEU A 3 -15.748 -11.079 -13.813 1.00 40.32 H new ATOM 0 HB2 LEU A 3 -18.754 -10.628 -14.199 1.00 61.43 H new ATOM 0 HB3 LEU A 3 -17.530 -9.375 -14.140 1.00 61.43 H new ATOM 0 HG LEU A 3 -17.619 -11.526 -16.292 1.00 13.24 H new ATOM 0 HD11 LEU A 3 -18.594 -9.809 -17.789 1.00 51.13 H new ATOM 0 HD12 LEU A 3 -19.671 -10.201 -16.428 1.00 51.13 H new ATOM 0 HD13 LEU A 3 -18.724 -8.694 -16.408 1.00 51.13 H new ATOM 0 HD21 LEU A 3 -16.135 -10.007 -17.559 1.00 21.33 H new ATOM 0 HD22 LEU A 3 -16.096 -8.898 -16.167 1.00 21.33 H new ATOM 0 HD23 LEU A 3 -15.406 -10.532 -16.022 1.00 21.33 H new ATOM 33 N VAL A 4 -16.076 -10.822 -11.336 1.00 63.22 N ATOM 34 CA VAL A 4 -16.308 -10.417 -9.935 1.00 64.35 C ATOM 35 C VAL A 4 -17.041 -9.069 -9.934 1.00 55.30 C ATOM 36 O VAL A 4 -16.507 -8.042 -10.375 1.00 50.22 O ATOM 37 CB VAL A 4 -14.992 -10.357 -9.054 1.00 75.40 C ATOM 38 CG1 VAL A 4 -14.520 -11.781 -8.678 1.00 43.23 C ATOM 39 CG2 VAL A 4 -13.867 -9.559 -9.755 1.00 11.22 C ATOM 0 H VAL A 4 -15.100 -10.781 -11.630 1.00 63.22 H new ATOM 0 HA VAL A 4 -16.919 -11.187 -9.465 1.00 64.35 H new ATOM 0 HB VAL A 4 -15.235 -9.825 -8.134 1.00 75.40 H new ATOM 0 HG11 VAL A 4 -13.615 -11.717 -8.073 1.00 43.23 H new ATOM 0 HG12 VAL A 4 -15.301 -12.285 -8.109 1.00 43.23 H new ATOM 0 HG13 VAL A 4 -14.310 -12.346 -9.586 1.00 43.23 H new ATOM 0 HG21 VAL A 4 -12.982 -9.541 -9.118 1.00 11.22 H new ATOM 0 HG22 VAL A 4 -13.621 -10.034 -10.705 1.00 11.22 H new ATOM 0 HG23 VAL A 4 -14.204 -8.538 -9.936 1.00 11.22 H new ATOM 49 N LYS A 5 -18.297 -9.114 -9.503 1.00 1.43 N ATOM 50 CA LYS A 5 -19.202 -7.972 -9.535 1.00 31.13 C ATOM 51 C LYS A 5 -18.934 -7.072 -8.320 1.00 51.14 C ATOM 52 O LYS A 5 -19.588 -7.182 -7.278 1.00 43.25 O ATOM 53 CB LYS A 5 -20.659 -8.492 -9.588 1.00 61.25 C ATOM 54 CG LYS A 5 -20.940 -9.459 -10.760 1.00 62.22 C ATOM 55 CD LYS A 5 -22.414 -9.912 -10.829 1.00 70.42 C ATOM 56 CE LYS A 5 -22.676 -10.834 -12.024 1.00 33.22 C ATOM 57 NZ LYS A 5 -24.106 -11.213 -12.119 1.00 31.22 N ATOM 0 H LYS A 5 -18.721 -9.957 -9.116 1.00 1.43 H new ATOM 0 HA LYS A 5 -19.036 -7.363 -10.424 1.00 31.13 H new ATOM 0 HB2 LYS A 5 -20.887 -8.998 -8.650 1.00 61.25 H new ATOM 0 HB3 LYS A 5 -21.335 -7.640 -9.663 1.00 61.25 H new ATOM 0 HG2 LYS A 5 -20.671 -8.972 -11.698 1.00 62.22 H new ATOM 0 HG3 LYS A 5 -20.300 -10.336 -10.661 1.00 62.22 H new ATOM 0 HD2 LYS A 5 -22.678 -10.430 -9.907 1.00 70.42 H new ATOM 0 HD3 LYS A 5 -23.059 -9.036 -10.898 1.00 70.42 H new ATOM 0 HE2 LYS A 5 -22.370 -10.335 -12.943 1.00 33.22 H new ATOM 0 HE3 LYS A 5 -22.066 -11.733 -11.931 1.00 33.22 H new ATOM 0 HZ1 LYS A 5 -24.246 -11.837 -12.939 1.00 31.22 H new ATOM 0 HZ2 LYS A 5 -24.391 -11.711 -11.252 1.00 31.22 H new ATOM 0 HZ3 LYS A 5 -24.685 -10.357 -12.233 1.00 31.22 H new ATOM 71 N LEU A 6 -17.900 -6.234 -8.464 1.00 52.24 N ATOM 72 CA LEU A 6 -17.417 -5.335 -7.411 1.00 33.03 C ATOM 73 C LEU A 6 -18.312 -4.102 -7.319 1.00 51.44 C ATOM 74 O LEU A 6 -18.058 -3.072 -7.954 1.00 40.10 O ATOM 75 CB LEU A 6 -15.939 -4.948 -7.681 1.00 45.42 C ATOM 76 CG LEU A 6 -14.941 -6.141 -7.772 1.00 23.23 C ATOM 77 CD1 LEU A 6 -13.523 -5.657 -8.120 1.00 73.21 C ATOM 78 CD2 LEU A 6 -14.945 -6.991 -6.480 1.00 62.21 C ATOM 0 H LEU A 6 -17.367 -6.161 -9.331 1.00 52.24 H new ATOM 0 HA LEU A 6 -17.460 -5.848 -6.450 1.00 33.03 H new ATOM 0 HB2 LEU A 6 -15.893 -4.386 -8.614 1.00 45.42 H new ATOM 0 HB3 LEU A 6 -15.606 -4.278 -6.888 1.00 45.42 H new ATOM 0 HG LEU A 6 -15.280 -6.786 -8.583 1.00 23.23 H new ATOM 0 HD11 LEU A 6 -12.850 -6.513 -8.176 1.00 73.21 H new ATOM 0 HD12 LEU A 6 -13.539 -5.144 -9.082 1.00 73.21 H new ATOM 0 HD13 LEU A 6 -13.173 -4.971 -7.349 1.00 73.21 H new ATOM 0 HD21 LEU A 6 -14.236 -7.813 -6.583 1.00 62.21 H new ATOM 0 HD22 LEU A 6 -14.657 -6.368 -5.633 1.00 62.21 H new ATOM 0 HD23 LEU A 6 -15.944 -7.393 -6.312 1.00 62.21 H new ATOM 90 N GLU A 7 -19.400 -4.248 -6.565 1.00 34.14 N ATOM 91 CA GLU A 7 -20.349 -3.169 -6.324 1.00 20.14 C ATOM 92 C GLU A 7 -19.737 -2.180 -5.316 1.00 30.24 C ATOM 93 O GLU A 7 -19.415 -2.569 -4.199 1.00 63.53 O ATOM 94 CB GLU A 7 -21.683 -3.750 -5.793 1.00 14.40 C ATOM 95 CG GLU A 7 -22.772 -2.695 -5.518 1.00 23.03 C ATOM 96 CD GLU A 7 -24.063 -3.304 -4.952 1.00 43.01 C ATOM 97 OE1 GLU A 7 -24.138 -3.510 -3.722 1.00 30.41 O ATOM 98 OE2 GLU A 7 -24.995 -3.594 -5.733 1.00 52.02 O ATOM 0 H GLU A 7 -19.647 -5.123 -6.103 1.00 34.14 H new ATOM 0 HA GLU A 7 -20.559 -2.640 -7.254 1.00 20.14 H new ATOM 0 HB2 GLU A 7 -22.066 -4.469 -6.517 1.00 14.40 H new ATOM 0 HB3 GLU A 7 -21.485 -4.299 -4.872 1.00 14.40 H new ATOM 0 HG2 GLU A 7 -22.386 -1.956 -4.816 1.00 23.03 H new ATOM 0 HG3 GLU A 7 -23.001 -2.166 -6.443 1.00 23.03 H new ATOM 105 N SER A 8 -19.554 -0.922 -5.735 1.00 41.43 N ATOM 106 CA SER A 8 -18.998 0.151 -4.888 1.00 14.44 C ATOM 107 C SER A 8 -19.958 0.526 -3.734 1.00 22.51 C ATOM 108 O SER A 8 -21.079 0.006 -3.641 1.00 21.22 O ATOM 109 CB SER A 8 -18.699 1.377 -5.792 1.00 23.11 C ATOM 110 OG SER A 8 -19.851 1.768 -6.530 1.00 10.54 O ATOM 0 H SER A 8 -19.788 -0.613 -6.679 1.00 41.43 H new ATOM 0 HA SER A 8 -18.078 -0.198 -4.419 1.00 14.44 H new ATOM 0 HB2 SER A 8 -18.358 2.210 -5.177 1.00 23.11 H new ATOM 0 HB3 SER A 8 -17.889 1.136 -6.480 1.00 23.11 H new ATOM 0 HG SER A 8 -20.514 2.155 -5.921 1.00 10.54 H new ATOM 116 N SER A 9 -19.492 1.430 -2.857 1.00 64.03 N ATOM 117 CA SER A 9 -20.321 2.032 -1.789 1.00 61.24 C ATOM 118 C SER A 9 -21.446 2.901 -2.394 1.00 20.54 C ATOM 119 O SER A 9 -22.500 3.100 -1.778 1.00 25.13 O ATOM 120 CB SER A 9 -19.430 2.869 -0.841 1.00 44.53 C ATOM 121 OG SER A 9 -18.725 3.878 -1.546 1.00 52.34 O ATOM 0 H SER A 9 -18.529 1.767 -2.865 1.00 64.03 H new ATOM 0 HA SER A 9 -20.789 1.232 -1.215 1.00 61.24 H new ATOM 0 HB2 SER A 9 -20.048 3.327 -0.069 1.00 44.53 H new ATOM 0 HB3 SER A 9 -18.721 2.215 -0.334 1.00 44.53 H new ATOM 0 HG SER A 9 -18.173 4.390 -0.919 1.00 52.34 H new ATOM 127 N ASP A 10 -21.196 3.393 -3.627 1.00 14.01 N ATOM 128 CA ASP A 10 -22.171 4.165 -4.429 1.00 32.33 C ATOM 129 C ASP A 10 -23.193 3.223 -5.132 1.00 52.14 C ATOM 130 O ASP A 10 -24.080 3.677 -5.861 1.00 3.34 O ATOM 131 CB ASP A 10 -21.396 5.036 -5.455 1.00 3.41 C ATOM 132 CG ASP A 10 -22.299 5.960 -6.304 1.00 72.32 C ATOM 133 OD1 ASP A 10 -22.521 5.672 -7.500 1.00 53.14 O ATOM 134 OD2 ASP A 10 -22.805 6.968 -5.777 1.00 70.31 O ATOM 0 H ASP A 10 -20.301 3.264 -4.099 1.00 14.01 H new ATOM 0 HA ASP A 10 -22.749 4.816 -3.773 1.00 32.33 H new ATOM 0 HB2 ASP A 10 -20.668 5.647 -4.921 1.00 3.41 H new ATOM 0 HB3 ASP A 10 -20.835 4.381 -6.122 1.00 3.41 H new ATOM 139 N GLU A 11 -23.042 1.897 -4.903 1.00 33.14 N ATOM 140 CA GLU A 11 -23.976 0.837 -5.366 1.00 14.15 C ATOM 141 C GLU A 11 -23.884 0.566 -6.891 1.00 73.04 C ATOM 142 O GLU A 11 -24.717 -0.160 -7.447 1.00 50.52 O ATOM 143 CB GLU A 11 -25.448 1.129 -4.937 1.00 13.33 C ATOM 144 CG GLU A 11 -25.668 1.241 -3.414 1.00 42.12 C ATOM 145 CD GLU A 11 -27.138 1.511 -3.034 1.00 35.10 C ATOM 146 OE1 GLU A 11 -27.904 0.543 -2.813 1.00 55.33 O ATOM 147 OE2 GLU A 11 -27.539 2.691 -2.972 1.00 73.34 O ATOM 0 H GLU A 11 -22.250 1.524 -4.380 1.00 33.14 H new ATOM 0 HA GLU A 11 -23.654 -0.077 -4.866 1.00 14.15 H new ATOM 0 HB2 GLU A 11 -25.771 2.059 -5.406 1.00 13.33 H new ATOM 0 HB3 GLU A 11 -26.089 0.337 -5.325 1.00 13.33 H new ATOM 0 HG2 GLU A 11 -25.339 0.318 -2.936 1.00 42.12 H new ATOM 0 HG3 GLU A 11 -25.044 2.043 -3.021 1.00 42.12 H new ATOM 154 N LYS A 12 -22.862 1.125 -7.560 1.00 41.42 N ATOM 155 CA LYS A 12 -22.591 0.821 -8.981 1.00 42.55 C ATOM 156 C LYS A 12 -21.750 -0.459 -9.079 1.00 32.32 C ATOM 157 O LYS A 12 -20.670 -0.543 -8.494 1.00 32.44 O ATOM 158 CB LYS A 12 -21.901 2.012 -9.702 1.00 1.44 C ATOM 159 CG LYS A 12 -22.853 3.198 -9.980 1.00 72.54 C ATOM 160 CD LYS A 12 -22.198 4.315 -10.826 1.00 32.03 C ATOM 161 CE LYS A 12 -23.174 5.450 -11.176 1.00 15.21 C ATOM 162 NZ LYS A 12 -23.767 6.082 -9.969 1.00 14.23 N ATOM 0 H LYS A 12 -22.209 1.789 -7.143 1.00 41.42 H new ATOM 0 HA LYS A 12 -23.541 0.659 -9.490 1.00 42.55 H new ATOM 0 HB2 LYS A 12 -21.066 2.361 -9.094 1.00 1.44 H new ATOM 0 HB3 LYS A 12 -21.483 1.662 -10.646 1.00 1.44 H new ATOM 0 HG2 LYS A 12 -23.740 2.831 -10.497 1.00 72.54 H new ATOM 0 HG3 LYS A 12 -23.188 3.618 -9.031 1.00 72.54 H new ATOM 0 HD2 LYS A 12 -21.350 4.727 -10.280 1.00 32.03 H new ATOM 0 HD3 LYS A 12 -21.805 3.884 -11.747 1.00 32.03 H new ATOM 0 HE2 LYS A 12 -22.651 6.208 -11.759 1.00 15.21 H new ATOM 0 HE3 LYS A 12 -23.972 5.057 -11.806 1.00 15.21 H new ATOM 0 HZ1 LYS A 12 -23.854 7.107 -10.121 1.00 14.23 H new ATOM 0 HZ2 LYS A 12 -24.709 5.677 -9.792 1.00 14.23 H new ATOM 0 HZ3 LYS A 12 -23.154 5.904 -9.148 1.00 14.23 H new ATOM 176 N VAL A 13 -22.272 -1.449 -9.818 1.00 61.01 N ATOM 177 CA VAL A 13 -21.691 -2.796 -9.907 1.00 61.12 C ATOM 178 C VAL A 13 -20.644 -2.856 -11.040 1.00 14.33 C ATOM 179 O VAL A 13 -20.994 -2.778 -12.225 1.00 74.23 O ATOM 180 CB VAL A 13 -22.818 -3.873 -10.146 1.00 61.23 C ATOM 181 CG1 VAL A 13 -22.243 -5.300 -10.124 1.00 23.32 C ATOM 182 CG2 VAL A 13 -23.976 -3.718 -9.127 1.00 55.10 C ATOM 0 H VAL A 13 -23.118 -1.335 -10.376 1.00 61.01 H new ATOM 0 HA VAL A 13 -21.196 -3.019 -8.962 1.00 61.12 H new ATOM 0 HB VAL A 13 -23.230 -3.698 -11.140 1.00 61.23 H new ATOM 0 HG11 VAL A 13 -23.046 -6.018 -10.292 1.00 23.32 H new ATOM 0 HG12 VAL A 13 -21.494 -5.403 -10.909 1.00 23.32 H new ATOM 0 HG13 VAL A 13 -21.781 -5.491 -9.155 1.00 23.32 H new ATOM 0 HG21 VAL A 13 -24.735 -4.476 -9.321 1.00 55.10 H new ATOM 0 HG22 VAL A 13 -23.589 -3.842 -8.115 1.00 55.10 H new ATOM 0 HG23 VAL A 13 -24.419 -2.727 -9.227 1.00 55.10 H new ATOM 192 N PHE A 14 -19.360 -2.956 -10.662 1.00 54.34 N ATOM 193 CA PHE A 14 -18.238 -3.074 -11.610 1.00 40.43 C ATOM 194 C PHE A 14 -17.934 -4.555 -11.862 1.00 50.12 C ATOM 195 O PHE A 14 -17.177 -5.191 -11.119 1.00 35.32 O ATOM 196 CB PHE A 14 -16.991 -2.329 -11.064 1.00 54.12 C ATOM 197 CG PHE A 14 -17.202 -0.822 -10.906 1.00 75.53 C ATOM 198 CD1 PHE A 14 -17.651 -0.278 -9.700 1.00 13.15 C ATOM 199 CD2 PHE A 14 -16.973 0.043 -11.973 1.00 3.12 C ATOM 200 CE1 PHE A 14 -17.861 1.081 -9.573 1.00 75.40 C ATOM 201 CE2 PHE A 14 -17.181 1.402 -11.840 1.00 33.14 C ATOM 202 CZ PHE A 14 -17.626 1.919 -10.641 1.00 65.53 C ATOM 0 H PHE A 14 -19.068 -2.957 -9.685 1.00 54.34 H new ATOM 0 HA PHE A 14 -18.512 -2.611 -12.558 1.00 40.43 H new ATOM 0 HB2 PHE A 14 -16.718 -2.753 -10.098 1.00 54.12 H new ATOM 0 HB3 PHE A 14 -16.151 -2.502 -11.737 1.00 54.12 H new ATOM 0 HD1 PHE A 14 -17.836 -0.928 -8.857 1.00 13.15 H new ATOM 0 HD2 PHE A 14 -16.628 -0.354 -12.917 1.00 3.12 H new ATOM 0 HE1 PHE A 14 -18.210 1.487 -8.635 1.00 75.40 H new ATOM 0 HE2 PHE A 14 -16.995 2.061 -12.676 1.00 33.14 H new ATOM 0 HZ PHE A 14 -17.790 2.982 -10.539 1.00 65.53 H new ATOM 212 N GLU A 15 -18.589 -5.096 -12.889 1.00 41.10 N ATOM 213 CA GLU A 15 -18.408 -6.481 -13.330 1.00 35.20 C ATOM 214 C GLU A 15 -17.098 -6.587 -14.135 1.00 52.50 C ATOM 215 O GLU A 15 -17.083 -6.426 -15.365 1.00 34.21 O ATOM 216 CB GLU A 15 -19.640 -6.921 -14.162 1.00 61.24 C ATOM 217 CG GLU A 15 -20.975 -6.774 -13.410 1.00 64.41 C ATOM 218 CD GLU A 15 -22.203 -7.114 -14.266 1.00 64.42 C ATOM 219 OE1 GLU A 15 -22.518 -8.311 -14.428 1.00 4.04 O ATOM 220 OE2 GLU A 15 -22.865 -6.178 -14.773 1.00 5.25 O ATOM 0 H GLU A 15 -19.269 -4.579 -13.446 1.00 41.10 H new ATOM 0 HA GLU A 15 -18.331 -7.151 -12.474 1.00 35.20 H new ATOM 0 HB2 GLU A 15 -19.681 -6.329 -15.077 1.00 61.24 H new ATOM 0 HB3 GLU A 15 -19.513 -7.962 -14.461 1.00 61.24 H new ATOM 0 HG2 GLU A 15 -20.962 -7.423 -12.534 1.00 64.41 H new ATOM 0 HG3 GLU A 15 -21.067 -5.750 -13.047 1.00 64.41 H new ATOM 227 N ILE A 16 -15.997 -6.791 -13.402 1.00 61.42 N ATOM 228 CA ILE A 16 -14.636 -6.872 -13.961 1.00 34.13 C ATOM 229 C ILE A 16 -14.130 -8.324 -13.833 1.00 61.35 C ATOM 230 O ILE A 16 -14.581 -9.053 -12.943 1.00 63.33 O ATOM 231 CB ILE A 16 -13.676 -5.855 -13.222 1.00 60.45 C ATOM 232 CG1 ILE A 16 -12.272 -5.796 -13.907 1.00 73.40 C ATOM 233 CG2 ILE A 16 -13.557 -6.182 -11.712 1.00 61.05 C ATOM 234 CD1 ILE A 16 -11.329 -4.747 -13.346 1.00 60.31 C ATOM 0 H ILE A 16 -16.023 -6.907 -12.389 1.00 61.42 H new ATOM 0 HA ILE A 16 -14.649 -6.596 -15.015 1.00 34.13 H new ATOM 0 HB ILE A 16 -14.123 -4.864 -13.306 1.00 60.45 H new ATOM 0 HG12 ILE A 16 -11.799 -6.774 -13.817 1.00 73.40 H new ATOM 0 HG13 ILE A 16 -12.411 -5.606 -14.971 1.00 73.40 H new ATOM 0 HG21 ILE A 16 -12.890 -5.464 -11.236 1.00 61.05 H new ATOM 0 HG22 ILE A 16 -14.542 -6.125 -11.249 1.00 61.05 H new ATOM 0 HG23 ILE A 16 -13.155 -7.188 -11.588 1.00 61.05 H new ATOM 0 HD11 ILE A 16 -10.382 -4.783 -13.885 1.00 60.31 H new ATOM 0 HD12 ILE A 16 -11.774 -3.759 -13.461 1.00 60.31 H new ATOM 0 HD13 ILE A 16 -11.152 -4.945 -12.289 1.00 60.31 H new ATOM 246 N GLU A 17 -13.217 -8.746 -14.735 1.00 11.44 N ATOM 247 CA GLU A 17 -12.662 -10.115 -14.736 1.00 21.55 C ATOM 248 C GLU A 17 -11.907 -10.389 -13.419 1.00 34.41 C ATOM 249 O GLU A 17 -11.162 -9.522 -12.935 1.00 24.24 O ATOM 250 CB GLU A 17 -11.699 -10.331 -15.937 1.00 63.41 C ATOM 251 CG GLU A 17 -12.254 -9.966 -17.331 1.00 4.02 C ATOM 252 CD GLU A 17 -11.272 -10.315 -18.469 1.00 43.03 C ATOM 253 OE1 GLU A 17 -10.164 -9.729 -18.510 1.00 31.53 O ATOM 254 OE2 GLU A 17 -11.599 -11.180 -19.317 1.00 33.31 O ATOM 0 H GLU A 17 -12.847 -8.152 -15.477 1.00 11.44 H new ATOM 0 HA GLU A 17 -13.497 -10.810 -14.829 1.00 21.55 H new ATOM 0 HB2 GLU A 17 -10.797 -9.744 -15.763 1.00 63.41 H new ATOM 0 HB3 GLU A 17 -11.399 -11.379 -15.951 1.00 63.41 H new ATOM 0 HG2 GLU A 17 -13.195 -10.493 -17.493 1.00 4.02 H new ATOM 0 HG3 GLU A 17 -12.476 -8.899 -17.362 1.00 4.02 H new ATOM 261 N LYS A 18 -12.108 -11.592 -12.853 1.00 42.30 N ATOM 262 CA LYS A 18 -11.443 -12.006 -11.602 1.00 64.33 C ATOM 263 C LYS A 18 -9.918 -12.130 -11.805 1.00 53.23 C ATOM 264 O LYS A 18 -9.142 -11.863 -10.884 1.00 40.13 O ATOM 265 CB LYS A 18 -12.047 -13.332 -11.063 1.00 4.51 C ATOM 266 CG LYS A 18 -11.497 -13.778 -9.681 1.00 60.34 C ATOM 267 CD LYS A 18 -12.129 -15.093 -9.138 1.00 34.32 C ATOM 268 CE LYS A 18 -11.626 -16.376 -9.836 1.00 23.22 C ATOM 269 NZ LYS A 18 -12.048 -16.483 -11.264 1.00 33.40 N ATOM 0 H LYS A 18 -12.730 -12.300 -13.244 1.00 42.30 H new ATOM 0 HA LYS A 18 -11.619 -11.233 -10.854 1.00 64.33 H new ATOM 0 HB2 LYS A 18 -13.129 -13.220 -10.990 1.00 4.51 H new ATOM 0 HB3 LYS A 18 -11.857 -14.124 -11.788 1.00 4.51 H new ATOM 0 HG2 LYS A 18 -10.418 -13.911 -9.758 1.00 60.34 H new ATOM 0 HG3 LYS A 18 -11.669 -12.980 -8.959 1.00 60.34 H new ATOM 0 HD2 LYS A 18 -11.921 -15.169 -8.071 1.00 34.32 H new ATOM 0 HD3 LYS A 18 -13.212 -15.034 -9.248 1.00 34.32 H new ATOM 0 HE2 LYS A 18 -10.538 -16.405 -9.784 1.00 23.22 H new ATOM 0 HE3 LYS A 18 -11.995 -17.245 -9.291 1.00 23.22 H new ATOM 0 HZ1 LYS A 18 -12.278 -17.473 -11.485 1.00 33.40 H new ATOM 0 HZ2 LYS A 18 -12.886 -15.889 -11.424 1.00 33.40 H new ATOM 0 HZ3 LYS A 18 -11.274 -16.162 -11.880 1.00 33.40 H new ATOM 283 N GLU A 19 -9.506 -12.504 -13.036 1.00 21.53 N ATOM 284 CA GLU A 19 -8.078 -12.592 -13.432 1.00 33.55 C ATOM 285 C GLU A 19 -7.367 -11.214 -13.368 1.00 61.53 C ATOM 286 O GLU A 19 -6.141 -11.144 -13.239 1.00 20.33 O ATOM 287 CB GLU A 19 -7.938 -13.220 -14.851 1.00 4.31 C ATOM 288 CG GLU A 19 -8.743 -12.509 -15.962 1.00 21.23 C ATOM 289 CD GLU A 19 -8.633 -13.203 -17.335 1.00 53.35 C ATOM 290 OE1 GLU A 19 -7.587 -13.052 -18.002 1.00 23.54 O ATOM 291 OE2 GLU A 19 -9.582 -13.913 -17.742 1.00 13.32 O ATOM 0 H GLU A 19 -10.152 -12.754 -13.785 1.00 21.53 H new ATOM 0 HA GLU A 19 -7.583 -13.243 -12.711 1.00 33.55 H new ATOM 0 HB2 GLU A 19 -6.884 -13.220 -15.130 1.00 4.31 H new ATOM 0 HB3 GLU A 19 -8.255 -14.262 -14.804 1.00 4.31 H new ATOM 0 HG2 GLU A 19 -9.792 -12.464 -15.669 1.00 21.23 H new ATOM 0 HG3 GLU A 19 -8.393 -11.481 -16.053 1.00 21.23 H new ATOM 298 N ILE A 20 -8.149 -10.125 -13.473 1.00 15.13 N ATOM 299 CA ILE A 20 -7.653 -8.751 -13.262 1.00 1.24 C ATOM 300 C ILE A 20 -7.576 -8.460 -11.744 1.00 3.44 C ATOM 301 O ILE A 20 -6.572 -7.939 -11.236 1.00 1.14 O ATOM 302 CB ILE A 20 -8.580 -7.691 -13.975 1.00 20.12 C ATOM 303 CG1 ILE A 20 -8.738 -8.017 -15.497 1.00 55.25 C ATOM 304 CG2 ILE A 20 -8.041 -6.263 -13.767 1.00 74.41 C ATOM 305 CD1 ILE A 20 -9.592 -7.037 -16.288 1.00 5.12 C ATOM 0 H ILE A 20 -9.141 -10.171 -13.706 1.00 15.13 H new ATOM 0 HA ILE A 20 -6.659 -8.670 -13.702 1.00 1.24 H new ATOM 0 HB ILE A 20 -9.568 -7.747 -13.519 1.00 20.12 H new ATOM 0 HG12 ILE A 20 -7.746 -8.055 -15.948 1.00 55.25 H new ATOM 0 HG13 ILE A 20 -9.171 -9.012 -15.595 1.00 55.25 H new ATOM 0 HG21 ILE A 20 -8.696 -5.550 -14.267 1.00 74.41 H new ATOM 0 HG22 ILE A 20 -8.007 -6.038 -12.701 1.00 74.41 H new ATOM 0 HG23 ILE A 20 -7.037 -6.188 -14.185 1.00 74.41 H new ATOM 0 HD11 ILE A 20 -9.638 -7.353 -17.330 1.00 5.12 H new ATOM 0 HD12 ILE A 20 -10.599 -7.013 -15.871 1.00 5.12 H new ATOM 0 HD13 ILE A 20 -9.152 -6.042 -16.230 1.00 5.12 H new ATOM 317 N ALA A 21 -8.643 -8.870 -11.026 1.00 53.54 N ATOM 318 CA ALA A 21 -8.797 -8.660 -9.565 1.00 14.55 C ATOM 319 C ALA A 21 -7.954 -9.656 -8.727 1.00 12.42 C ATOM 320 O ALA A 21 -8.112 -9.730 -7.507 1.00 4.42 O ATOM 321 CB ALA A 21 -10.288 -8.747 -9.193 1.00 45.22 C ATOM 0 H ALA A 21 -9.432 -9.362 -11.446 1.00 53.54 H new ATOM 0 HA ALA A 21 -8.417 -7.667 -9.326 1.00 14.55 H new ATOM 0 HB1 ALA A 21 -10.405 -8.593 -8.120 1.00 45.22 H new ATOM 0 HB2 ALA A 21 -10.843 -7.979 -9.732 1.00 45.22 H new ATOM 0 HB3 ALA A 21 -10.674 -9.730 -9.463 1.00 45.22 H new ATOM 327 N CYS A 22 -7.085 -10.439 -9.395 1.00 14.34 N ATOM 328 CA CYS A 22 -6.050 -11.253 -8.725 1.00 71.41 C ATOM 329 C CYS A 22 -4.882 -10.368 -8.234 1.00 30.43 C ATOM 330 O CYS A 22 -4.199 -10.716 -7.260 1.00 24.14 O ATOM 331 CB CYS A 22 -5.541 -12.350 -9.680 1.00 74.10 C ATOM 332 SG CYS A 22 -6.817 -13.510 -10.225 1.00 50.43 S ATOM 0 H CYS A 22 -7.080 -10.526 -10.411 1.00 14.34 H new ATOM 0 HA CYS A 22 -6.496 -11.729 -7.852 1.00 71.41 H new ATOM 0 HB2 CYS A 22 -5.098 -11.876 -10.556 1.00 74.10 H new ATOM 0 HB3 CYS A 22 -4.747 -12.908 -9.184 1.00 74.10 H new ATOM 0 HG CYS A 22 -7.980 -12.932 -10.172 1.00 50.43 H new ATOM 338 N MET A 23 -4.650 -9.223 -8.932 1.00 71.20 N ATOM 339 CA MET A 23 -3.658 -8.201 -8.506 1.00 74.01 C ATOM 340 C MET A 23 -4.120 -7.521 -7.205 1.00 12.41 C ATOM 341 O MET A 23 -3.304 -6.994 -6.437 1.00 31.31 O ATOM 342 CB MET A 23 -3.413 -7.148 -9.623 1.00 33.50 C ATOM 343 CG MET A 23 -2.815 -7.711 -10.925 1.00 71.51 C ATOM 344 SD MET A 23 -2.322 -6.412 -12.084 1.00 10.43 S ATOM 345 CE MET A 23 -3.876 -5.579 -12.397 1.00 71.24 C ATOM 0 H MET A 23 -5.139 -8.986 -9.795 1.00 71.20 H new ATOM 0 HA MET A 23 -2.710 -8.706 -8.319 1.00 74.01 H new ATOM 0 HB2 MET A 23 -4.360 -6.660 -9.856 1.00 33.50 H new ATOM 0 HB3 MET A 23 -2.745 -6.379 -9.236 1.00 33.50 H new ATOM 0 HG2 MET A 23 -1.948 -8.327 -10.686 1.00 71.51 H new ATOM 0 HG3 MET A 23 -3.546 -8.362 -11.404 1.00 71.51 H new ATOM 0 HE1 MET A 23 -3.849 -5.117 -13.384 1.00 71.24 H new ATOM 0 HE2 MET A 23 -4.691 -6.302 -12.357 1.00 71.24 H new ATOM 0 HE3 MET A 23 -4.036 -4.810 -11.641 1.00 71.24 H new ATOM 355 N SER A 24 -5.448 -7.533 -6.989 1.00 61.03 N ATOM 356 CA SER A 24 -6.040 -7.260 -5.687 1.00 43.20 C ATOM 357 C SER A 24 -5.800 -8.464 -4.773 1.00 63.12 C ATOM 358 O SER A 24 -6.476 -9.501 -4.901 1.00 44.04 O ATOM 359 CB SER A 24 -7.549 -7.021 -5.803 1.00 2.34 C ATOM 360 OG SER A 24 -7.860 -5.878 -6.547 1.00 24.45 O ATOM 0 H SER A 24 -6.132 -7.733 -7.719 1.00 61.03 H new ATOM 0 HA SER A 24 -5.577 -6.362 -5.278 1.00 43.20 H new ATOM 0 HB2 SER A 24 -8.015 -7.890 -6.268 1.00 2.34 H new ATOM 0 HB3 SER A 24 -7.975 -6.926 -4.804 1.00 2.34 H new ATOM 0 HG SER A 24 -8.400 -6.131 -7.325 1.00 24.45 H new ATOM 366 N VAL A 25 -4.816 -8.335 -3.882 1.00 21.44 N ATOM 367 CA VAL A 25 -4.514 -9.368 -2.887 1.00 73.35 C ATOM 368 C VAL A 25 -5.669 -9.487 -1.875 1.00 51.51 C ATOM 369 O VAL A 25 -6.007 -10.592 -1.460 1.00 31.14 O ATOM 370 CB VAL A 25 -3.145 -9.091 -2.175 1.00 41.34 C ATOM 371 CG1 VAL A 25 -2.840 -10.113 -1.052 1.00 50.13 C ATOM 372 CG2 VAL A 25 -1.996 -9.042 -3.218 1.00 43.44 C ATOM 0 H VAL A 25 -4.209 -7.517 -3.828 1.00 21.44 H new ATOM 0 HA VAL A 25 -4.416 -10.324 -3.401 1.00 73.35 H new ATOM 0 HB VAL A 25 -3.222 -8.118 -1.690 1.00 41.34 H new ATOM 0 HG11 VAL A 25 -1.881 -9.874 -0.593 1.00 50.13 H new ATOM 0 HG12 VAL A 25 -3.625 -10.069 -0.297 1.00 50.13 H new ATOM 0 HG13 VAL A 25 -2.800 -11.117 -1.475 1.00 50.13 H new ATOM 0 HG21 VAL A 25 -1.051 -8.849 -2.710 1.00 43.44 H new ATOM 0 HG22 VAL A 25 -1.938 -9.997 -3.741 1.00 43.44 H new ATOM 0 HG23 VAL A 25 -2.191 -8.246 -3.937 1.00 43.44 H new ATOM 382 N THR A 26 -6.321 -8.350 -1.545 1.00 64.30 N ATOM 383 CA THR A 26 -7.458 -8.328 -0.599 1.00 12.33 C ATOM 384 C THR A 26 -8.651 -9.133 -1.161 1.00 13.23 C ATOM 385 O THR A 26 -9.207 -9.994 -0.467 1.00 15.10 O ATOM 386 CB THR A 26 -7.908 -6.865 -0.271 1.00 51.51 C ATOM 387 OG1 THR A 26 -6.812 -6.139 0.308 1.00 2.31 O ATOM 388 CG2 THR A 26 -9.125 -6.800 0.674 1.00 75.22 C ATOM 0 H THR A 26 -6.078 -7.434 -1.921 1.00 64.30 H new ATOM 0 HA THR A 26 -7.119 -8.793 0.327 1.00 12.33 H new ATOM 0 HB THR A 26 -8.214 -6.412 -1.214 1.00 51.51 H new ATOM 0 HG1 THR A 26 -7.081 -5.210 0.465 1.00 2.31 H new ATOM 0 HG21 THR A 26 -9.385 -5.758 0.861 1.00 75.22 H new ATOM 0 HG22 THR A 26 -9.972 -7.308 0.213 1.00 75.22 H new ATOM 0 HG23 THR A 26 -8.879 -7.287 1.618 1.00 75.22 H new ATOM 396 N ILE A 27 -8.998 -8.865 -2.442 1.00 24.32 N ATOM 397 CA ILE A 27 -10.143 -9.509 -3.113 1.00 15.25 C ATOM 398 C ILE A 27 -9.925 -11.020 -3.215 1.00 22.12 C ATOM 399 O ILE A 27 -10.808 -11.789 -2.814 1.00 54.32 O ATOM 400 CB ILE A 27 -10.438 -8.890 -4.532 1.00 40.42 C ATOM 401 CG1 ILE A 27 -10.868 -7.397 -4.388 1.00 32.12 C ATOM 402 CG2 ILE A 27 -11.508 -9.703 -5.317 1.00 74.41 C ATOM 403 CD1 ILE A 27 -11.133 -6.684 -5.701 1.00 72.02 C ATOM 0 H ILE A 27 -8.495 -8.202 -3.032 1.00 24.32 H new ATOM 0 HA ILE A 27 -11.022 -9.319 -2.497 1.00 15.25 H new ATOM 0 HB ILE A 27 -9.516 -8.940 -5.112 1.00 40.42 H new ATOM 0 HG12 ILE A 27 -11.769 -7.350 -3.776 1.00 32.12 H new ATOM 0 HG13 ILE A 27 -10.088 -6.859 -3.849 1.00 32.12 H new ATOM 0 HG21 ILE A 27 -11.678 -9.238 -6.288 1.00 74.41 H new ATOM 0 HG22 ILE A 27 -11.156 -10.725 -5.460 1.00 74.41 H new ATOM 0 HG23 ILE A 27 -12.441 -9.716 -4.753 1.00 74.41 H new ATOM 0 HD11 ILE A 27 -11.426 -5.653 -5.503 1.00 72.02 H new ATOM 0 HD12 ILE A 27 -10.229 -6.694 -6.309 1.00 72.02 H new ATOM 0 HD13 ILE A 27 -11.935 -7.192 -6.236 1.00 72.02 H new ATOM 415 N LYS A 28 -8.722 -11.437 -3.686 1.00 61.35 N ATOM 416 CA LYS A 28 -8.412 -12.870 -3.847 1.00 22.45 C ATOM 417 C LYS A 28 -8.514 -13.584 -2.473 1.00 61.21 C ATOM 418 O LYS A 28 -9.161 -14.620 -2.379 1.00 13.41 O ATOM 419 CB LYS A 28 -7.020 -13.126 -4.523 1.00 11.14 C ATOM 420 CG LYS A 28 -5.802 -13.016 -3.591 1.00 31.43 C ATOM 421 CD LYS A 28 -4.455 -13.326 -4.275 1.00 31.12 C ATOM 422 CE LYS A 28 -3.283 -13.227 -3.282 1.00 41.02 C ATOM 423 NZ LYS A 28 -3.489 -14.094 -2.076 1.00 20.11 N ATOM 0 H LYS A 28 -7.966 -10.808 -3.956 1.00 61.35 H new ATOM 0 HA LYS A 28 -9.151 -13.291 -4.528 1.00 22.45 H new ATOM 0 HB2 LYS A 28 -7.028 -14.122 -4.966 1.00 11.14 H new ATOM 0 HB3 LYS A 28 -6.896 -12.415 -5.340 1.00 11.14 H new ATOM 0 HG2 LYS A 28 -5.764 -12.008 -3.178 1.00 31.43 H new ATOM 0 HG3 LYS A 28 -5.937 -13.699 -2.752 1.00 31.43 H new ATOM 0 HD2 LYS A 28 -4.486 -14.327 -4.705 1.00 31.12 H new ATOM 0 HD3 LYS A 28 -4.295 -12.630 -5.099 1.00 31.12 H new ATOM 0 HE2 LYS A 28 -2.359 -13.517 -3.783 1.00 41.02 H new ATOM 0 HE3 LYS A 28 -3.163 -12.191 -2.966 1.00 41.02 H new ATOM 0 HZ1 LYS A 28 -2.567 -14.407 -1.712 1.00 20.11 H new ATOM 0 HZ2 LYS A 28 -3.986 -13.553 -1.340 1.00 20.11 H new ATOM 0 HZ3 LYS A 28 -4.057 -14.925 -2.338 1.00 20.11 H new ATOM 437 N ASN A 29 -7.959 -12.938 -1.400 1.00 35.24 N ATOM 438 CA ASN A 29 -7.922 -13.506 -0.025 1.00 42.14 C ATOM 439 C ASN A 29 -9.330 -13.800 0.485 1.00 50.01 C ATOM 440 O ASN A 29 -9.578 -14.873 1.039 1.00 51.40 O ATOM 441 CB ASN A 29 -7.199 -12.563 0.991 1.00 12.43 C ATOM 442 CG ASN A 29 -5.686 -12.484 0.799 1.00 11.21 C ATOM 443 OD1 ASN A 29 -5.053 -13.416 0.296 1.00 65.12 O ATOM 444 ND2 ASN A 29 -5.088 -11.372 1.217 1.00 72.40 N ATOM 0 H ASN A 29 -7.529 -12.016 -1.470 1.00 35.24 H new ATOM 0 HA ASN A 29 -7.354 -14.434 -0.095 1.00 42.14 H new ATOM 0 HB2 ASN A 29 -7.619 -11.561 0.902 1.00 12.43 H new ATOM 0 HB3 ASN A 29 -7.409 -12.908 2.003 1.00 12.43 H new ATOM 0 HD21 ASN A 29 -4.077 -11.271 1.126 1.00 72.40 H new ATOM 0 HD22 ASN A 29 -5.640 -10.620 1.629 1.00 72.40 H new ATOM 451 N MET A 30 -10.244 -12.834 0.264 1.00 64.21 N ATOM 452 CA MET A 30 -11.657 -12.962 0.660 1.00 64.14 C ATOM 453 C MET A 30 -12.311 -14.162 -0.049 1.00 65.42 C ATOM 454 O MET A 30 -13.003 -14.965 0.587 1.00 74.41 O ATOM 455 CB MET A 30 -12.451 -11.653 0.372 1.00 1.10 C ATOM 456 CG MET A 30 -11.981 -10.430 1.173 1.00 32.15 C ATOM 457 SD MET A 30 -13.059 -8.984 0.960 1.00 63.52 S ATOM 458 CE MET A 30 -12.951 -8.660 -0.806 1.00 12.22 C ATOM 0 H MET A 30 -10.023 -11.949 -0.192 1.00 64.21 H new ATOM 0 HA MET A 30 -11.686 -13.136 1.736 1.00 64.14 H new ATOM 0 HB2 MET A 30 -12.376 -11.425 -0.691 1.00 1.10 H new ATOM 0 HB3 MET A 30 -13.505 -11.828 0.587 1.00 1.10 H new ATOM 0 HG2 MET A 30 -11.937 -10.690 2.230 1.00 32.15 H new ATOM 0 HG3 MET A 30 -10.968 -10.169 0.866 1.00 32.15 H new ATOM 0 HE1 MET A 30 -13.775 -8.014 -1.109 1.00 12.22 H new ATOM 0 HE2 MET A 30 -12.004 -8.168 -1.028 1.00 12.22 H new ATOM 0 HE3 MET A 30 -13.008 -9.601 -1.353 1.00 12.22 H new ATOM 468 N ILE A 31 -12.012 -14.304 -1.357 1.00 64.23 N ATOM 469 CA ILE A 31 -12.513 -15.412 -2.195 1.00 12.43 C ATOM 470 C ILE A 31 -11.918 -16.763 -1.727 1.00 22.10 C ATOM 471 O ILE A 31 -12.588 -17.790 -1.793 1.00 42.30 O ATOM 472 CB ILE A 31 -12.186 -15.163 -3.725 1.00 4.44 C ATOM 473 CG1 ILE A 31 -12.806 -13.807 -4.209 1.00 20.44 C ATOM 474 CG2 ILE A 31 -12.666 -16.338 -4.616 1.00 13.33 C ATOM 475 CD1 ILE A 31 -12.472 -13.431 -5.645 1.00 3.14 C ATOM 0 H ILE A 31 -11.414 -13.651 -1.863 1.00 64.23 H new ATOM 0 HA ILE A 31 -13.596 -15.453 -2.083 1.00 12.43 H new ATOM 0 HB ILE A 31 -11.102 -15.104 -3.823 1.00 4.44 H new ATOM 0 HG12 ILE A 31 -13.890 -13.861 -4.105 1.00 20.44 H new ATOM 0 HG13 ILE A 31 -12.462 -13.010 -3.550 1.00 20.44 H new ATOM 0 HG21 ILE A 31 -12.423 -16.128 -5.658 1.00 13.33 H new ATOM 0 HG22 ILE A 31 -12.169 -17.257 -4.306 1.00 13.33 H new ATOM 0 HG23 ILE A 31 -13.745 -16.456 -4.512 1.00 13.33 H new ATOM 0 HD11 ILE A 31 -12.943 -12.480 -5.891 1.00 3.14 H new ATOM 0 HD12 ILE A 31 -11.391 -13.340 -5.755 1.00 3.14 H new ATOM 0 HD13 ILE A 31 -12.842 -14.204 -6.319 1.00 3.14 H new ATOM 487 N GLU A 32 -10.666 -16.737 -1.222 1.00 31.32 N ATOM 488 CA GLU A 32 -9.949 -17.949 -0.760 1.00 63.34 C ATOM 489 C GLU A 32 -10.472 -18.417 0.617 1.00 51.41 C ATOM 490 O GLU A 32 -10.516 -19.621 0.886 1.00 33.32 O ATOM 491 CB GLU A 32 -8.410 -17.701 -0.717 1.00 62.20 C ATOM 492 CG GLU A 32 -7.796 -17.326 -2.082 1.00 63.01 C ATOM 493 CD GLU A 32 -6.278 -17.100 -2.038 1.00 14.33 C ATOM 494 OE1 GLU A 32 -5.520 -18.049 -2.337 1.00 72.45 O ATOM 495 OE2 GLU A 32 -5.833 -15.977 -1.710 1.00 1.11 O ATOM 0 H GLU A 32 -10.124 -15.879 -1.123 1.00 31.32 H new ATOM 0 HA GLU A 32 -10.144 -18.746 -1.478 1.00 63.34 H new ATOM 0 HB2 GLU A 32 -8.201 -16.903 -0.005 1.00 62.20 H new ATOM 0 HB3 GLU A 32 -7.918 -18.599 -0.343 1.00 62.20 H new ATOM 0 HG2 GLU A 32 -8.015 -18.118 -2.798 1.00 63.01 H new ATOM 0 HG3 GLU A 32 -8.278 -16.420 -2.450 1.00 63.01 H new ATOM 502 N ASP A 33 -10.872 -17.450 1.479 1.00 73.15 N ATOM 503 CA ASP A 33 -11.433 -17.749 2.825 1.00 62.13 C ATOM 504 C ASP A 33 -12.839 -18.346 2.693 1.00 41.42 C ATOM 505 O ASP A 33 -13.189 -19.321 3.374 1.00 51.21 O ATOM 506 CB ASP A 33 -11.503 -16.476 3.721 1.00 4.25 C ATOM 507 CG ASP A 33 -10.133 -15.870 4.058 1.00 12.13 C ATOM 508 OD1 ASP A 33 -9.250 -16.608 4.543 1.00 22.03 O ATOM 509 OD2 ASP A 33 -9.941 -14.644 3.873 1.00 52.32 O ATOM 0 H ASP A 33 -10.817 -16.454 1.268 1.00 73.15 H new ATOM 0 HA ASP A 33 -10.764 -18.467 3.300 1.00 62.13 H new ATOM 0 HB2 ASP A 33 -12.107 -15.722 3.216 1.00 4.25 H new ATOM 0 HB3 ASP A 33 -12.016 -16.726 4.650 1.00 4.25 H new ATOM 514 N ILE A 34 -13.636 -17.729 1.812 1.00 61.42 N ATOM 515 CA ILE A 34 -15.001 -18.180 1.483 1.00 63.31 C ATOM 516 C ILE A 34 -14.937 -19.478 0.652 1.00 53.11 C ATOM 517 O ILE A 34 -15.812 -20.343 0.748 1.00 4.45 O ATOM 518 CB ILE A 34 -15.789 -17.041 0.712 1.00 70.23 C ATOM 519 CG1 ILE A 34 -15.907 -15.760 1.615 1.00 41.22 C ATOM 520 CG2 ILE A 34 -17.184 -17.522 0.224 1.00 4.13 C ATOM 521 CD1 ILE A 34 -16.556 -14.553 0.951 1.00 34.41 C ATOM 0 H ILE A 34 -13.352 -16.894 1.300 1.00 61.42 H new ATOM 0 HA ILE A 34 -15.542 -18.390 2.406 1.00 63.31 H new ATOM 0 HB ILE A 34 -15.220 -16.786 -0.182 1.00 70.23 H new ATOM 0 HG12 ILE A 34 -16.480 -16.015 2.506 1.00 41.22 H new ATOM 0 HG13 ILE A 34 -14.908 -15.477 1.948 1.00 41.22 H new ATOM 0 HG21 ILE A 34 -17.687 -16.708 -0.299 1.00 4.13 H new ATOM 0 HG22 ILE A 34 -17.061 -18.367 -0.453 1.00 4.13 H new ATOM 0 HG23 ILE A 34 -17.784 -17.828 1.081 1.00 4.13 H new ATOM 0 HD11 ILE A 34 -16.589 -13.723 1.657 1.00 34.41 H new ATOM 0 HD12 ILE A 34 -15.974 -14.262 0.077 1.00 34.41 H new ATOM 0 HD13 ILE A 34 -17.570 -14.808 0.643 1.00 34.41 H new ATOM 533 N GLY A 35 -13.854 -19.613 -0.130 1.00 75.43 N ATOM 534 CA GLY A 35 -13.658 -20.745 -1.028 1.00 34.22 C ATOM 535 C GLY A 35 -14.147 -20.416 -2.431 1.00 24.12 C ATOM 536 O GLY A 35 -13.367 -20.414 -3.390 1.00 65.33 O ATOM 0 H GLY A 35 -13.092 -18.935 -0.152 1.00 75.43 H new ATOM 0 HA2 GLY A 35 -12.601 -21.010 -1.060 1.00 34.22 H new ATOM 0 HA3 GLY A 35 -14.194 -21.614 -0.646 1.00 34.22 H new ATOM 540 N GLU A 36 -15.457 -20.099 -2.530 1.00 11.11 N ATOM 541 CA GLU A 36 -16.136 -19.768 -3.798 1.00 53.21 C ATOM 542 C GLU A 36 -17.054 -18.540 -3.586 1.00 4.30 C ATOM 543 O GLU A 36 -18.170 -18.669 -3.062 1.00 73.11 O ATOM 544 CB GLU A 36 -16.966 -20.989 -4.296 1.00 11.20 C ATOM 545 CG GLU A 36 -16.133 -22.256 -4.594 1.00 71.45 C ATOM 546 CD GLU A 36 -16.981 -23.481 -4.973 1.00 11.03 C ATOM 547 OE1 GLU A 36 -17.260 -23.672 -6.178 1.00 24.13 O ATOM 548 OE2 GLU A 36 -17.361 -24.261 -4.069 1.00 4.40 O ATOM 0 H GLU A 36 -16.078 -20.066 -1.721 1.00 11.11 H new ATOM 0 HA GLU A 36 -15.390 -19.528 -4.556 1.00 53.21 H new ATOM 0 HB2 GLU A 36 -17.716 -21.232 -3.544 1.00 11.20 H new ATOM 0 HB3 GLU A 36 -17.503 -20.702 -5.200 1.00 11.20 H new ATOM 0 HG2 GLU A 36 -15.439 -22.041 -5.407 1.00 71.45 H new ATOM 0 HG3 GLU A 36 -15.532 -22.499 -3.718 1.00 71.45 H new ATOM 555 N SER A 37 -16.557 -17.351 -3.959 1.00 44.43 N ATOM 556 CA SER A 37 -17.316 -16.088 -3.882 1.00 74.11 C ATOM 557 C SER A 37 -17.971 -15.782 -5.242 1.00 64.15 C ATOM 558 O SER A 37 -17.577 -14.847 -5.951 1.00 10.50 O ATOM 559 CB SER A 37 -16.377 -14.946 -3.435 1.00 14.15 C ATOM 560 OG SER A 37 -15.774 -15.241 -2.193 1.00 42.34 O ATOM 0 H SER A 37 -15.612 -17.235 -4.325 1.00 44.43 H new ATOM 0 HA SER A 37 -18.113 -16.182 -3.144 1.00 74.11 H new ATOM 0 HB2 SER A 37 -15.606 -14.789 -4.189 1.00 14.15 H new ATOM 0 HB3 SER A 37 -16.941 -14.016 -3.357 1.00 14.15 H new ATOM 0 HG SER A 37 -16.456 -15.560 -1.566 1.00 42.34 H new ATOM 566 N ASP A 38 -18.963 -16.610 -5.605 1.00 13.41 N ATOM 567 CA ASP A 38 -19.713 -16.471 -6.869 1.00 35.41 C ATOM 568 C ASP A 38 -20.674 -15.262 -6.797 1.00 34.33 C ATOM 569 O ASP A 38 -20.993 -14.644 -7.818 1.00 62.14 O ATOM 570 CB ASP A 38 -20.483 -17.789 -7.153 1.00 54.11 C ATOM 571 CG ASP A 38 -21.299 -17.770 -8.464 1.00 11.04 C ATOM 572 OD1 ASP A 38 -20.708 -17.952 -9.551 1.00 60.14 O ATOM 573 OD2 ASP A 38 -22.536 -17.591 -8.417 1.00 72.13 O ATOM 0 H ASP A 38 -19.270 -17.396 -5.032 1.00 13.41 H new ATOM 0 HA ASP A 38 -19.019 -16.288 -7.689 1.00 35.41 H new ATOM 0 HB2 ASP A 38 -19.770 -18.613 -7.193 1.00 54.11 H new ATOM 0 HB3 ASP A 38 -21.157 -17.991 -6.320 1.00 54.11 H new ATOM 578 N SER A 39 -21.119 -14.939 -5.568 1.00 0.41 N ATOM 579 CA SER A 39 -21.983 -13.777 -5.277 1.00 21.33 C ATOM 580 C SER A 39 -21.251 -12.429 -5.558 1.00 41.15 C ATOM 581 O SER A 39 -20.016 -12.366 -5.448 1.00 43.15 O ATOM 582 CB SER A 39 -22.440 -13.844 -3.800 1.00 32.20 C ATOM 583 OG SER A 39 -23.124 -15.063 -3.525 1.00 45.41 O ATOM 0 H SER A 39 -20.886 -15.484 -4.738 1.00 0.41 H new ATOM 0 HA SER A 39 -22.850 -13.816 -5.936 1.00 21.33 H new ATOM 0 HB2 SER A 39 -21.574 -13.755 -3.145 1.00 32.20 H new ATOM 0 HB3 SER A 39 -23.094 -13.000 -3.581 1.00 32.20 H new ATOM 0 HG SER A 39 -23.399 -15.079 -2.585 1.00 45.41 H new ATOM 589 N PRO A 40 -22.003 -11.333 -5.941 1.00 13.24 N ATOM 590 CA PRO A 40 -21.418 -9.979 -6.131 1.00 22.03 C ATOM 591 C PRO A 40 -20.756 -9.465 -4.834 1.00 10.32 C ATOM 592 O PRO A 40 -21.361 -9.533 -3.763 1.00 63.11 O ATOM 593 CB PRO A 40 -22.640 -9.100 -6.548 1.00 33.04 C ATOM 594 CG PRO A 40 -23.850 -9.873 -6.115 1.00 4.31 C ATOM 595 CD PRO A 40 -23.464 -11.332 -6.247 1.00 45.34 C ATOM 0 HA PRO A 40 -20.623 -9.963 -6.877 1.00 22.03 H new ATOM 0 HB2 PRO A 40 -22.604 -8.123 -6.066 1.00 33.04 H new ATOM 0 HB3 PRO A 40 -22.650 -8.925 -7.624 1.00 33.04 H new ATOM 0 HG2 PRO A 40 -24.124 -9.631 -5.088 1.00 4.31 H new ATOM 0 HG3 PRO A 40 -24.711 -9.636 -6.739 1.00 4.31 H new ATOM 0 HD2 PRO A 40 -24.021 -11.959 -5.551 1.00 45.34 H new ATOM 0 HD3 PRO A 40 -23.665 -11.712 -7.249 1.00 45.34 H new ATOM 603 N ILE A 41 -19.506 -8.985 -4.945 1.00 44.44 N ATOM 604 CA ILE A 41 -18.715 -8.517 -3.800 1.00 55.43 C ATOM 605 C ILE A 41 -18.939 -7.000 -3.597 1.00 32.44 C ATOM 606 O ILE A 41 -18.477 -6.196 -4.417 1.00 32.21 O ATOM 607 CB ILE A 41 -17.177 -8.836 -3.992 1.00 42.04 C ATOM 608 CG1 ILE A 41 -16.946 -10.373 -4.192 1.00 61.03 C ATOM 609 CG2 ILE A 41 -16.333 -8.307 -2.804 1.00 4.50 C ATOM 610 CD1 ILE A 41 -17.398 -11.254 -3.024 1.00 1.51 C ATOM 0 H ILE A 41 -19.016 -8.911 -5.836 1.00 44.44 H new ATOM 0 HA ILE A 41 -19.049 -9.050 -2.909 1.00 55.43 H new ATOM 0 HB ILE A 41 -16.845 -8.318 -4.892 1.00 42.04 H new ATOM 0 HG12 ILE A 41 -17.473 -10.690 -5.092 1.00 61.03 H new ATOM 0 HG13 ILE A 41 -15.884 -10.545 -4.368 1.00 61.03 H new ATOM 0 HG21 ILE A 41 -15.282 -8.544 -2.970 1.00 4.50 H new ATOM 0 HG22 ILE A 41 -16.453 -7.227 -2.725 1.00 4.50 H new ATOM 0 HG23 ILE A 41 -16.669 -8.778 -1.880 1.00 4.50 H new ATOM 0 HD11 ILE A 41 -17.196 -12.299 -3.258 1.00 1.51 H new ATOM 0 HD12 ILE A 41 -16.853 -10.972 -2.123 1.00 1.51 H new ATOM 0 HD13 ILE A 41 -18.467 -11.119 -2.859 1.00 1.51 H new ATOM 622 N PRO A 42 -19.683 -6.585 -2.521 1.00 14.35 N ATOM 623 CA PRO A 42 -19.828 -5.165 -2.182 1.00 54.53 C ATOM 624 C PRO A 42 -18.560 -4.632 -1.478 1.00 64.42 C ATOM 625 O PRO A 42 -17.910 -5.344 -0.695 1.00 62.02 O ATOM 626 CB PRO A 42 -21.075 -5.141 -1.266 1.00 22.12 C ATOM 627 CG PRO A 42 -21.085 -6.481 -0.591 1.00 50.42 C ATOM 628 CD PRO A 42 -20.424 -7.454 -1.558 1.00 11.43 C ATOM 0 HA PRO A 42 -19.949 -4.518 -3.051 1.00 54.53 H new ATOM 0 HB2 PRO A 42 -21.014 -4.332 -0.538 1.00 22.12 H new ATOM 0 HB3 PRO A 42 -21.986 -4.983 -1.843 1.00 22.12 H new ATOM 0 HG2 PRO A 42 -20.543 -6.444 0.354 1.00 50.42 H new ATOM 0 HG3 PRO A 42 -22.104 -6.793 -0.362 1.00 50.42 H new ATOM 0 HD2 PRO A 42 -19.749 -8.133 -1.037 1.00 11.43 H new ATOM 0 HD3 PRO A 42 -21.164 -8.070 -2.069 1.00 11.43 H new ATOM 636 N LEU A 43 -18.207 -3.384 -1.797 1.00 4.15 N ATOM 637 CA LEU A 43 -17.041 -2.688 -1.255 1.00 35.31 C ATOM 638 C LEU A 43 -17.559 -1.380 -0.607 1.00 43.10 C ATOM 639 O LEU A 43 -17.596 -0.326 -1.262 1.00 13.35 O ATOM 640 CB LEU A 43 -15.990 -2.424 -2.386 1.00 31.11 C ATOM 641 CG LEU A 43 -15.428 -3.687 -3.129 1.00 24.13 C ATOM 642 CD1 LEU A 43 -14.455 -3.286 -4.261 1.00 4.22 C ATOM 643 CD2 LEU A 43 -14.766 -4.691 -2.149 1.00 25.52 C ATOM 0 H LEU A 43 -18.739 -2.817 -2.457 1.00 4.15 H new ATOM 0 HA LEU A 43 -16.527 -3.287 -0.503 1.00 35.31 H new ATOM 0 HB2 LEU A 43 -16.444 -1.766 -3.127 1.00 31.11 H new ATOM 0 HB3 LEU A 43 -15.150 -1.882 -1.951 1.00 31.11 H new ATOM 0 HG LEU A 43 -16.279 -4.195 -3.583 1.00 24.13 H new ATOM 0 HD11 LEU A 43 -14.083 -4.183 -4.756 1.00 4.22 H new ATOM 0 HD12 LEU A 43 -14.978 -2.662 -4.986 1.00 4.22 H new ATOM 0 HD13 LEU A 43 -13.617 -2.730 -3.841 1.00 4.22 H new ATOM 0 HD21 LEU A 43 -14.391 -5.550 -2.706 1.00 25.52 H new ATOM 0 HD22 LEU A 43 -13.939 -4.204 -1.633 1.00 25.52 H new ATOM 0 HD23 LEU A 43 -15.503 -5.026 -1.419 1.00 25.52 H new ATOM 655 N PRO A 44 -18.022 -1.450 0.688 1.00 63.40 N ATOM 656 CA PRO A 44 -18.729 -0.337 1.367 1.00 13.33 C ATOM 657 C PRO A 44 -17.754 0.704 1.978 1.00 21.44 C ATOM 658 O PRO A 44 -17.875 1.099 3.146 1.00 75.21 O ATOM 659 CB PRO A 44 -19.554 -1.098 2.433 1.00 13.20 C ATOM 660 CG PRO A 44 -18.690 -2.256 2.833 1.00 11.22 C ATOM 661 CD PRO A 44 -17.876 -2.625 1.603 1.00 22.31 C ATOM 0 HA PRO A 44 -19.339 0.272 0.701 1.00 13.33 H new ATOM 0 HB2 PRO A 44 -19.780 -0.460 3.287 1.00 13.20 H new ATOM 0 HB3 PRO A 44 -20.507 -1.437 2.027 1.00 13.20 H new ATOM 0 HG2 PRO A 44 -18.038 -1.986 3.664 1.00 11.22 H new ATOM 0 HG3 PRO A 44 -19.297 -3.098 3.165 1.00 11.22 H new ATOM 0 HD2 PRO A 44 -16.831 -2.802 1.858 1.00 22.31 H new ATOM 0 HD3 PRO A 44 -18.250 -3.538 1.139 1.00 22.31 H new ATOM 669 N ASN A 45 -16.829 1.188 1.135 1.00 61.03 N ATOM 670 CA ASN A 45 -15.779 2.146 1.512 1.00 4.55 C ATOM 671 C ASN A 45 -15.447 3.010 0.292 1.00 54.33 C ATOM 672 O ASN A 45 -15.590 4.237 0.316 1.00 52.44 O ATOM 673 CB ASN A 45 -14.511 1.386 2.011 1.00 33.33 C ATOM 674 CG ASN A 45 -13.310 2.296 2.302 1.00 33.55 C ATOM 675 OD1 ASN A 45 -12.454 2.513 1.442 1.00 52.13 O ATOM 676 ND2 ASN A 45 -13.232 2.828 3.514 1.00 42.55 N ATOM 0 H ASN A 45 -16.789 0.919 0.152 1.00 61.03 H new ATOM 0 HA ASN A 45 -16.129 2.783 2.325 1.00 4.55 H new ATOM 0 HB2 ASN A 45 -14.764 0.835 2.917 1.00 33.33 H new ATOM 0 HB3 ASN A 45 -14.222 0.650 1.260 1.00 33.33 H new ATOM 0 HD21 ASN A 45 -12.448 3.435 3.755 1.00 42.55 H new ATOM 0 HD22 ASN A 45 -13.956 2.630 4.205 1.00 42.55 H new ATOM 683 N VAL A 46 -15.033 2.338 -0.794 1.00 31.44 N ATOM 684 CA VAL A 46 -14.602 3.002 -2.031 1.00 2.32 C ATOM 685 C VAL A 46 -15.819 3.342 -2.921 1.00 23.22 C ATOM 686 O VAL A 46 -16.669 2.487 -3.196 1.00 64.11 O ATOM 687 CB VAL A 46 -13.537 2.139 -2.812 1.00 30.12 C ATOM 688 CG1 VAL A 46 -14.061 0.725 -3.152 1.00 63.30 C ATOM 689 CG2 VAL A 46 -13.028 2.880 -4.069 1.00 63.05 C ATOM 0 H VAL A 46 -14.988 1.320 -0.838 1.00 31.44 H new ATOM 0 HA VAL A 46 -14.115 3.938 -1.757 1.00 2.32 H new ATOM 0 HB VAL A 46 -12.687 2.000 -2.144 1.00 30.12 H new ATOM 0 HG11 VAL A 46 -13.291 0.171 -3.689 1.00 63.30 H new ATOM 0 HG12 VAL A 46 -14.311 0.198 -2.231 1.00 63.30 H new ATOM 0 HG13 VAL A 46 -14.951 0.807 -3.776 1.00 63.30 H new ATOM 0 HG21 VAL A 46 -12.296 2.260 -4.585 1.00 63.05 H new ATOM 0 HG22 VAL A 46 -13.866 3.083 -4.736 1.00 63.05 H new ATOM 0 HG23 VAL A 46 -12.563 3.821 -3.774 1.00 63.05 H new ATOM 699 N THR A 47 -15.886 4.611 -3.353 1.00 34.51 N ATOM 700 CA THR A 47 -16.988 5.154 -4.166 1.00 42.52 C ATOM 701 C THR A 47 -16.853 4.712 -5.634 1.00 53.32 C ATOM 702 O THR A 47 -15.818 4.161 -6.015 1.00 62.22 O ATOM 703 CB THR A 47 -16.989 6.710 -4.069 1.00 54.42 C ATOM 704 OG1 THR A 47 -15.742 7.226 -4.558 1.00 52.13 O ATOM 705 CG2 THR A 47 -17.203 7.194 -2.620 1.00 72.32 C ATOM 0 H THR A 47 -15.164 5.301 -3.144 1.00 34.51 H new ATOM 0 HA THR A 47 -17.932 4.767 -3.782 1.00 42.52 H new ATOM 0 HB THR A 47 -17.816 7.078 -4.676 1.00 54.42 H new ATOM 0 HG1 THR A 47 -15.746 8.204 -4.497 1.00 52.13 H new ATOM 0 HG21 THR A 47 -17.197 8.284 -2.596 1.00 72.32 H new ATOM 0 HG22 THR A 47 -18.162 6.828 -2.252 1.00 72.32 H new ATOM 0 HG23 THR A 47 -16.402 6.813 -1.987 1.00 72.32 H new ATOM 713 N SER A 48 -17.886 4.978 -6.459 1.00 30.54 N ATOM 714 CA SER A 48 -17.924 4.513 -7.863 1.00 70.24 C ATOM 715 C SER A 48 -16.893 5.245 -8.736 1.00 43.55 C ATOM 716 O SER A 48 -16.229 4.618 -9.552 1.00 11.21 O ATOM 717 CB SER A 48 -19.334 4.675 -8.462 1.00 44.32 C ATOM 718 OG SER A 48 -19.749 6.036 -8.470 1.00 40.31 O ATOM 0 H SER A 48 -18.707 5.513 -6.178 1.00 30.54 H new ATOM 0 HA SER A 48 -17.666 3.454 -7.854 1.00 70.24 H new ATOM 0 HB2 SER A 48 -19.344 4.286 -9.480 1.00 44.32 H new ATOM 0 HB3 SER A 48 -20.044 4.081 -7.887 1.00 44.32 H new ATOM 0 HG SER A 48 -20.714 6.085 -8.306 1.00 40.31 H new ATOM 724 N THR A 49 -16.773 6.573 -8.535 1.00 44.14 N ATOM 725 CA THR A 49 -15.824 7.441 -9.271 1.00 33.22 C ATOM 726 C THR A 49 -14.373 6.948 -9.095 1.00 51.35 C ATOM 727 O THR A 49 -13.603 6.856 -10.058 1.00 41.31 O ATOM 728 CB THR A 49 -15.941 8.924 -8.759 1.00 21.12 C ATOM 729 OG1 THR A 49 -17.302 9.371 -8.879 1.00 61.41 O ATOM 730 CG2 THR A 49 -15.012 9.901 -9.514 1.00 62.31 C ATOM 0 H THR A 49 -17.336 7.080 -7.852 1.00 44.14 H new ATOM 0 HA THR A 49 -16.079 7.399 -10.330 1.00 33.22 H new ATOM 0 HB THR A 49 -15.626 8.923 -7.716 1.00 21.12 H new ATOM 0 HG1 THR A 49 -17.373 10.294 -8.558 1.00 61.41 H new ATOM 0 HG21 THR A 49 -15.140 10.907 -9.114 1.00 62.31 H new ATOM 0 HG22 THR A 49 -13.975 9.589 -9.387 1.00 62.31 H new ATOM 0 HG23 THR A 49 -15.265 9.897 -10.574 1.00 62.31 H new ATOM 738 N ILE A 50 -14.040 6.596 -7.850 1.00 43.23 N ATOM 739 CA ILE A 50 -12.678 6.215 -7.454 1.00 51.12 C ATOM 740 C ILE A 50 -12.391 4.759 -7.851 1.00 4.35 C ATOM 741 O ILE A 50 -11.342 4.470 -8.435 1.00 62.40 O ATOM 742 CB ILE A 50 -12.484 6.438 -5.913 1.00 30.10 C ATOM 743 CG1 ILE A 50 -12.775 7.933 -5.551 1.00 10.40 C ATOM 744 CG2 ILE A 50 -11.081 6.011 -5.433 1.00 21.15 C ATOM 745 CD1 ILE A 50 -11.945 8.963 -6.319 1.00 71.23 C ATOM 0 H ILE A 50 -14.711 6.567 -7.082 1.00 43.23 H new ATOM 0 HA ILE A 50 -11.963 6.848 -7.980 1.00 51.12 H new ATOM 0 HB ILE A 50 -13.197 5.801 -5.390 1.00 30.10 H new ATOM 0 HG12 ILE A 50 -13.831 8.135 -5.730 1.00 10.40 H new ATOM 0 HG13 ILE A 50 -12.601 8.072 -4.484 1.00 10.40 H new ATOM 0 HG21 ILE A 50 -10.995 6.184 -4.360 1.00 21.15 H new ATOM 0 HG22 ILE A 50 -10.932 4.952 -5.642 1.00 21.15 H new ATOM 0 HG23 ILE A 50 -10.324 6.595 -5.957 1.00 21.15 H new ATOM 0 HD11 ILE A 50 -12.221 9.967 -5.996 1.00 71.23 H new ATOM 0 HD12 ILE A 50 -10.886 8.797 -6.122 1.00 71.23 H new ATOM 0 HD13 ILE A 50 -12.135 8.860 -7.387 1.00 71.23 H new ATOM 757 N LEU A 51 -13.365 3.863 -7.574 1.00 64.41 N ATOM 758 CA LEU A 51 -13.253 2.418 -7.882 1.00 54.34 C ATOM 759 C LEU A 51 -13.194 2.187 -9.402 1.00 30.23 C ATOM 760 O LEU A 51 -12.555 1.236 -9.867 1.00 14.43 O ATOM 761 CB LEU A 51 -14.440 1.618 -7.262 1.00 22.23 C ATOM 762 CG LEU A 51 -14.325 0.061 -7.319 1.00 44.12 C ATOM 763 CD1 LEU A 51 -13.025 -0.440 -6.641 1.00 73.24 C ATOM 764 CD2 LEU A 51 -15.573 -0.619 -6.712 1.00 13.02 C ATOM 0 H LEU A 51 -14.248 4.119 -7.132 1.00 64.41 H new ATOM 0 HA LEU A 51 -12.326 2.055 -7.438 1.00 54.34 H new ATOM 0 HB2 LEU A 51 -14.547 1.916 -6.219 1.00 22.23 H new ATOM 0 HB3 LEU A 51 -15.356 1.913 -7.773 1.00 22.23 H new ATOM 0 HG LEU A 51 -14.274 -0.222 -8.370 1.00 44.12 H new ATOM 0 HD11 LEU A 51 -12.980 -1.527 -6.700 1.00 73.24 H new ATOM 0 HD12 LEU A 51 -12.161 -0.013 -7.150 1.00 73.24 H new ATOM 0 HD13 LEU A 51 -13.018 -0.133 -5.595 1.00 73.24 H new ATOM 0 HD21 LEU A 51 -15.461 -1.702 -6.767 1.00 13.02 H new ATOM 0 HD22 LEU A 51 -15.681 -0.318 -5.670 1.00 13.02 H new ATOM 0 HD23 LEU A 51 -16.459 -0.317 -7.270 1.00 13.02 H new ATOM 776 N GLU A 52 -13.850 3.094 -10.164 1.00 24.30 N ATOM 777 CA GLU A 52 -13.823 3.087 -11.635 1.00 51.20 C ATOM 778 C GLU A 52 -12.383 3.252 -12.123 1.00 31.23 C ATOM 779 O GLU A 52 -11.915 2.471 -12.945 1.00 64.04 O ATOM 780 CB GLU A 52 -14.699 4.231 -12.220 1.00 72.11 C ATOM 781 CG GLU A 52 -14.788 4.221 -13.758 1.00 51.23 C ATOM 782 CD GLU A 52 -15.557 5.419 -14.325 1.00 65.41 C ATOM 783 OE1 GLU A 52 -16.781 5.303 -14.548 1.00 41.30 O ATOM 784 OE2 GLU A 52 -14.930 6.483 -14.540 1.00 43.20 O ATOM 0 H GLU A 52 -14.411 3.849 -9.770 1.00 24.30 H new ATOM 0 HA GLU A 52 -14.227 2.134 -11.977 1.00 51.20 H new ATOM 0 HB2 GLU A 52 -15.705 4.154 -11.807 1.00 72.11 H new ATOM 0 HB3 GLU A 52 -14.293 5.189 -11.895 1.00 72.11 H new ATOM 0 HG2 GLU A 52 -13.780 4.214 -14.174 1.00 51.23 H new ATOM 0 HG3 GLU A 52 -15.273 3.300 -14.082 1.00 51.23 H new ATOM 791 N LYS A 53 -11.689 4.261 -11.558 1.00 30.52 N ATOM 792 CA LYS A 53 -10.298 4.578 -11.924 1.00 34.30 C ATOM 793 C LYS A 53 -9.359 3.398 -11.614 1.00 61.21 C ATOM 794 O LYS A 53 -8.620 2.937 -12.488 1.00 53.52 O ATOM 795 CB LYS A 53 -9.781 5.827 -11.166 1.00 23.53 C ATOM 796 CG LYS A 53 -10.593 7.122 -11.351 1.00 62.42 C ATOM 797 CD LYS A 53 -9.861 8.340 -10.737 1.00 53.11 C ATOM 798 CE LYS A 53 -10.752 9.568 -10.579 1.00 3.21 C ATOM 799 NZ LYS A 53 -11.319 10.042 -11.872 1.00 44.33 N ATOM 0 H LYS A 53 -12.076 4.874 -10.840 1.00 30.52 H new ATOM 0 HA LYS A 53 -10.297 4.779 -12.995 1.00 34.30 H new ATOM 0 HB2 LYS A 53 -9.749 5.592 -10.102 1.00 23.53 H new ATOM 0 HB3 LYS A 53 -8.755 6.018 -11.481 1.00 23.53 H new ATOM 0 HG2 LYS A 53 -10.765 7.297 -12.413 1.00 62.42 H new ATOM 0 HG3 LYS A 53 -11.571 7.010 -10.883 1.00 62.42 H new ATOM 0 HD2 LYS A 53 -9.464 8.061 -9.761 1.00 53.11 H new ATOM 0 HD3 LYS A 53 -9.009 8.597 -11.366 1.00 53.11 H new ATOM 0 HE2 LYS A 53 -11.567 9.334 -9.895 1.00 3.21 H new ATOM 0 HE3 LYS A 53 -10.175 10.373 -10.124 1.00 3.21 H new ATOM 0 HZ1 LYS A 53 -11.915 10.877 -11.704 1.00 44.33 H new ATOM 0 HZ2 LYS A 53 -10.545 10.294 -12.519 1.00 44.33 H new ATOM 0 HZ3 LYS A 53 -11.894 9.286 -12.297 1.00 44.33 H new ATOM 813 N VAL A 54 -9.436 2.909 -10.362 1.00 71.52 N ATOM 814 CA VAL A 54 -8.515 1.887 -9.845 1.00 62.15 C ATOM 815 C VAL A 54 -8.629 0.583 -10.674 1.00 61.43 C ATOM 816 O VAL A 54 -7.619 0.031 -11.117 1.00 43.11 O ATOM 817 CB VAL A 54 -8.766 1.612 -8.308 1.00 73.42 C ATOM 818 CG1 VAL A 54 -7.755 0.592 -7.753 1.00 4.43 C ATOM 819 CG2 VAL A 54 -8.711 2.922 -7.487 1.00 13.22 C ATOM 0 H VAL A 54 -10.136 3.212 -9.685 1.00 71.52 H new ATOM 0 HA VAL A 54 -7.498 2.266 -9.946 1.00 62.15 H new ATOM 0 HB VAL A 54 -9.767 1.191 -8.213 1.00 73.42 H new ATOM 0 HG11 VAL A 54 -7.952 0.423 -6.694 1.00 4.43 H new ATOM 0 HG12 VAL A 54 -7.853 -0.349 -8.295 1.00 4.43 H new ATOM 0 HG13 VAL A 54 -6.743 0.978 -7.876 1.00 4.43 H new ATOM 0 HG21 VAL A 54 -8.887 2.700 -6.435 1.00 13.22 H new ATOM 0 HG22 VAL A 54 -7.729 3.382 -7.601 1.00 13.22 H new ATOM 0 HG23 VAL A 54 -9.477 3.609 -7.846 1.00 13.22 H new ATOM 829 N LEU A 55 -9.885 0.163 -10.946 1.00 11.04 N ATOM 830 CA LEU A 55 -10.182 -1.064 -11.719 1.00 72.14 C ATOM 831 C LEU A 55 -9.908 -0.889 -13.232 1.00 64.13 C ATOM 832 O LEU A 55 -9.584 -1.867 -13.917 1.00 51.21 O ATOM 833 CB LEU A 55 -11.648 -1.523 -11.485 1.00 33.02 C ATOM 834 CG LEU A 55 -12.005 -1.991 -10.039 1.00 44.41 C ATOM 835 CD1 LEU A 55 -13.471 -2.466 -9.971 1.00 53.32 C ATOM 836 CD2 LEU A 55 -11.023 -3.081 -9.529 1.00 70.43 C ATOM 0 H LEU A 55 -10.719 0.663 -10.637 1.00 11.04 H new ATOM 0 HA LEU A 55 -9.506 -1.837 -11.354 1.00 72.14 H new ATOM 0 HB2 LEU A 55 -12.311 -0.700 -11.751 1.00 33.02 H new ATOM 0 HB3 LEU A 55 -11.864 -2.341 -12.172 1.00 33.02 H new ATOM 0 HG LEU A 55 -11.897 -1.136 -9.372 1.00 44.41 H new ATOM 0 HD11 LEU A 55 -13.702 -2.789 -8.956 1.00 53.32 H new ATOM 0 HD12 LEU A 55 -14.132 -1.646 -10.251 1.00 53.32 H new ATOM 0 HD13 LEU A 55 -13.616 -3.300 -10.658 1.00 53.32 H new ATOM 0 HD21 LEU A 55 -11.304 -3.381 -8.520 1.00 70.43 H new ATOM 0 HD22 LEU A 55 -11.065 -3.947 -10.190 1.00 70.43 H new ATOM 0 HD23 LEU A 55 -10.009 -2.681 -9.519 1.00 70.43 H new ATOM 848 N ASP A 56 -10.043 0.351 -13.747 1.00 24.34 N ATOM 849 CA ASP A 56 -9.784 0.659 -15.180 1.00 41.45 C ATOM 850 C ASP A 56 -8.273 0.621 -15.467 1.00 21.34 C ATOM 851 O ASP A 56 -7.840 0.147 -16.522 1.00 62.51 O ATOM 852 CB ASP A 56 -10.389 2.038 -15.582 1.00 73.04 C ATOM 853 CG ASP A 56 -10.264 2.379 -17.082 1.00 32.23 C ATOM 854 OD1 ASP A 56 -10.393 1.470 -17.925 1.00 64.12 O ATOM 855 OD2 ASP A 56 -10.068 3.567 -17.431 1.00 45.04 O ATOM 0 H ASP A 56 -10.330 1.160 -13.196 1.00 24.34 H new ATOM 0 HA ASP A 56 -10.274 -0.104 -15.785 1.00 41.45 H new ATOM 0 HB2 ASP A 56 -11.443 2.052 -15.306 1.00 73.04 H new ATOM 0 HB3 ASP A 56 -9.897 2.819 -15.003 1.00 73.04 H new ATOM 860 N TYR A 57 -7.476 1.088 -14.492 1.00 21.12 N ATOM 861 CA TYR A 57 -6.006 1.025 -14.566 1.00 45.31 C ATOM 862 C TYR A 57 -5.532 -0.428 -14.400 1.00 62.12 C ATOM 863 O TYR A 57 -4.549 -0.835 -15.023 1.00 1.32 O ATOM 864 CB TYR A 57 -5.344 1.916 -13.487 1.00 75.42 C ATOM 865 CG TYR A 57 -3.808 1.957 -13.584 1.00 4.41 C ATOM 866 CD1 TYR A 57 -3.170 2.791 -14.505 1.00 34.12 C ATOM 867 CD2 TYR A 57 -3.002 1.138 -12.783 1.00 0.53 C ATOM 868 CE1 TYR A 57 -1.794 2.806 -14.620 1.00 51.42 C ATOM 869 CE2 TYR A 57 -1.628 1.157 -12.891 1.00 3.13 C ATOM 870 CZ TYR A 57 -1.028 1.989 -13.813 1.00 24.44 C ATOM 871 OH TYR A 57 0.343 1.987 -13.944 1.00 70.43 O ATOM 0 H TYR A 57 -7.828 1.517 -13.636 1.00 21.12 H new ATOM 0 HA TYR A 57 -5.706 1.399 -15.545 1.00 45.31 H new ATOM 0 HB2 TYR A 57 -5.733 2.930 -13.576 1.00 75.42 H new ATOM 0 HB3 TYR A 57 -5.628 1.550 -12.500 1.00 75.42 H new ATOM 0 HD1 TYR A 57 -3.763 3.435 -15.138 1.00 34.12 H new ATOM 0 HD2 TYR A 57 -3.467 0.478 -12.066 1.00 0.53 H new ATOM 0 HE1 TYR A 57 -1.318 3.456 -15.340 1.00 51.42 H new ATOM 0 HE2 TYR A 57 -1.025 0.524 -12.257 1.00 3.13 H new ATOM 0 HH TYR A 57 0.649 2.882 -14.199 1.00 70.43 H new ATOM 881 N CYS A 58 -6.231 -1.189 -13.532 1.00 42.32 N ATOM 882 CA CYS A 58 -5.980 -2.627 -13.348 1.00 54.10 C ATOM 883 C CYS A 58 -6.226 -3.391 -14.658 1.00 1.22 C ATOM 884 O CYS A 58 -5.467 -4.302 -15.009 1.00 15.41 O ATOM 885 CB CYS A 58 -6.869 -3.200 -12.226 1.00 2.21 C ATOM 886 SG CYS A 58 -6.486 -2.537 -10.609 1.00 23.12 S ATOM 0 H CYS A 58 -6.980 -0.823 -12.944 1.00 42.32 H new ATOM 0 HA CYS A 58 -4.936 -2.752 -13.060 1.00 54.10 H new ATOM 0 HB2 CYS A 58 -7.914 -2.992 -12.458 1.00 2.21 H new ATOM 0 HB3 CYS A 58 -6.758 -4.284 -12.202 1.00 2.21 H new ATOM 0 HG CYS A 58 -7.031 -1.364 -10.481 1.00 23.12 H new ATOM 892 N ARG A 59 -7.302 -2.993 -15.374 1.00 65.24 N ATOM 893 CA ARG A 59 -7.656 -3.558 -16.691 1.00 74.00 C ATOM 894 C ARG A 59 -6.528 -3.288 -17.700 1.00 54.01 C ATOM 895 O ARG A 59 -6.070 -4.205 -18.378 1.00 41.01 O ATOM 896 CB ARG A 59 -9.021 -2.986 -17.190 1.00 2.44 C ATOM 897 CG ARG A 59 -9.416 -3.404 -18.631 1.00 71.23 C ATOM 898 CD ARG A 59 -10.887 -3.102 -18.973 1.00 72.31 C ATOM 899 NE ARG A 59 -11.261 -1.676 -18.805 1.00 21.15 N ATOM 900 CZ ARG A 59 -12.522 -1.194 -18.927 1.00 63.54 C ATOM 901 NH1 ARG A 59 -13.548 -2.009 -19.185 1.00 54.45 N ATOM 902 NH2 ARG A 59 -12.758 0.102 -18.767 1.00 40.34 N ATOM 0 H ARG A 59 -7.947 -2.271 -15.053 1.00 65.24 H new ATOM 0 HA ARG A 59 -7.772 -4.637 -16.593 1.00 74.00 H new ATOM 0 HB2 ARG A 59 -9.806 -3.309 -16.506 1.00 2.44 H new ATOM 0 HB3 ARG A 59 -8.982 -1.898 -17.140 1.00 2.44 H new ATOM 0 HG2 ARG A 59 -8.772 -2.886 -19.341 1.00 71.23 H new ATOM 0 HG3 ARG A 59 -9.233 -4.471 -18.755 1.00 71.23 H new ATOM 0 HD2 ARG A 59 -11.079 -3.399 -20.004 1.00 72.31 H new ATOM 0 HD3 ARG A 59 -11.530 -3.713 -18.340 1.00 72.31 H new ATOM 0 HE ARG A 59 -10.518 -1.013 -18.582 1.00 21.15 H new ATOM 0 HH11 ARG A 59 -13.389 -3.011 -19.293 1.00 54.45 H new ATOM 0 HH12 ARG A 59 -14.491 -1.630 -19.274 1.00 54.45 H new ATOM 0 HH21 ARG A 59 -11.990 0.738 -18.552 1.00 40.34 H new ATOM 0 HH22 ARG A 59 -13.708 0.463 -18.859 1.00 40.34 H new ATOM 916 N HIS A 60 -6.050 -2.029 -17.722 1.00 43.14 N ATOM 917 CA HIS A 60 -4.925 -1.581 -18.576 1.00 73.23 C ATOM 918 C HIS A 60 -3.632 -2.371 -18.285 1.00 41.20 C ATOM 919 O HIS A 60 -2.918 -2.781 -19.207 1.00 1.11 O ATOM 920 CB HIS A 60 -4.686 -0.061 -18.356 1.00 63.22 C ATOM 921 CG HIS A 60 -3.497 0.503 -19.091 1.00 73.03 C ATOM 922 ND1 HIS A 60 -3.515 0.808 -20.432 1.00 25.21 N ATOM 923 CD2 HIS A 60 -2.255 0.826 -18.657 1.00 0.13 C ATOM 924 CE1 HIS A 60 -2.341 1.288 -20.788 1.00 60.42 C ATOM 925 NE2 HIS A 60 -1.557 1.311 -19.728 1.00 4.03 N ATOM 0 H HIS A 60 -6.436 -1.284 -17.142 1.00 43.14 H new ATOM 0 HA HIS A 60 -5.192 -1.769 -19.616 1.00 73.23 H new ATOM 0 HB2 HIS A 60 -5.579 0.482 -18.666 1.00 63.22 H new ATOM 0 HB3 HIS A 60 -4.557 0.122 -17.289 1.00 63.22 H new ATOM 0 HD2 HIS A 60 -1.884 0.720 -17.648 1.00 0.13 H new ATOM 0 HE1 HIS A 60 -2.067 1.609 -21.782 1.00 60.42 H new ATOM 0 HE2 HIS A 60 -0.590 1.636 -19.710 1.00 4.03 H new ATOM 934 N HIS A 61 -3.358 -2.571 -16.989 1.00 54.22 N ATOM 935 CA HIS A 61 -2.155 -3.267 -16.502 1.00 63.20 C ATOM 936 C HIS A 61 -2.273 -4.788 -16.723 1.00 52.13 C ATOM 937 O HIS A 61 -1.270 -5.501 -16.713 1.00 74.32 O ATOM 938 CB HIS A 61 -1.948 -2.957 -14.999 1.00 31.11 C ATOM 939 CG HIS A 61 -0.645 -3.466 -14.439 1.00 72.15 C ATOM 940 ND1 HIS A 61 -0.489 -4.726 -13.895 1.00 13.22 N ATOM 941 CD2 HIS A 61 0.571 -2.882 -14.365 1.00 21.53 C ATOM 942 CE1 HIS A 61 0.758 -4.888 -13.510 1.00 52.43 C ATOM 943 NE2 HIS A 61 1.424 -3.787 -13.788 1.00 15.05 N ATOM 0 H HIS A 61 -3.971 -2.251 -16.239 1.00 54.22 H new ATOM 0 HA HIS A 61 -1.293 -2.911 -17.066 1.00 63.20 H new ATOM 0 HB2 HIS A 61 -1.998 -1.878 -14.851 1.00 31.11 H new ATOM 0 HB3 HIS A 61 -2.770 -3.394 -14.432 1.00 31.11 H new ATOM 0 HD1 HIS A 61 -1.228 -5.424 -13.806 1.00 13.22 H new ATOM 0 HD2 HIS A 61 0.824 -1.887 -14.699 1.00 21.53 H new ATOM 0 HE1 HIS A 61 1.166 -5.773 -13.045 1.00 52.43 H new ATOM 952 N HIS A 62 -3.511 -5.279 -16.879 1.00 65.43 N ATOM 953 CA HIS A 62 -3.767 -6.686 -17.218 1.00 61.23 C ATOM 954 C HIS A 62 -3.581 -6.907 -18.731 1.00 63.23 C ATOM 955 O HIS A 62 -3.085 -7.955 -19.154 1.00 4.20 O ATOM 956 CB HIS A 62 -5.190 -7.100 -16.765 1.00 71.41 C ATOM 957 CG HIS A 62 -5.513 -8.556 -16.975 1.00 71.42 C ATOM 958 ND1 HIS A 62 -5.082 -9.545 -16.115 1.00 2.01 N ATOM 959 CD2 HIS A 62 -6.232 -9.189 -17.933 1.00 51.42 C ATOM 960 CE1 HIS A 62 -5.513 -10.711 -16.540 1.00 15.23 C ATOM 961 NE2 HIS A 62 -6.210 -10.518 -17.637 1.00 13.23 N ATOM 0 H HIS A 62 -4.356 -4.717 -16.775 1.00 65.43 H new ATOM 0 HA HIS A 62 -3.050 -7.315 -16.690 1.00 61.23 H new ATOM 0 HB2 HIS A 62 -5.304 -6.865 -15.707 1.00 71.41 H new ATOM 0 HB3 HIS A 62 -5.920 -6.497 -17.306 1.00 71.41 H new ATOM 0 HD2 HIS A 62 -6.729 -8.727 -18.773 1.00 51.42 H new ATOM 0 HE1 HIS A 62 -5.326 -11.665 -16.069 1.00 15.23 H new ATOM 0 HE2 HIS A 62 -6.664 -11.250 -18.183 1.00 13.23 H new ATOM 970 N GLN A 63 -3.973 -5.894 -19.527 1.00 53.42 N ATOM 971 CA GLN A 63 -3.844 -5.908 -21.001 1.00 21.41 C ATOM 972 C GLN A 63 -2.361 -5.782 -21.410 1.00 54.32 C ATOM 973 O GLN A 63 -1.925 -6.356 -22.416 1.00 73.03 O ATOM 974 CB GLN A 63 -4.680 -4.745 -21.623 1.00 15.23 C ATOM 975 CG GLN A 63 -6.205 -4.850 -21.386 1.00 42.22 C ATOM 976 CD GLN A 63 -6.989 -3.621 -21.874 1.00 61.02 C ATOM 977 OE1 GLN A 63 -7.037 -2.591 -21.194 1.00 50.13 O ATOM 978 NE2 GLN A 63 -7.689 -3.744 -22.992 1.00 33.20 N ATOM 0 H GLN A 63 -4.391 -5.037 -19.166 1.00 53.42 H new ATOM 0 HA GLN A 63 -4.228 -6.856 -21.378 1.00 21.41 H new ATOM 0 HB2 GLN A 63 -4.326 -3.800 -21.211 1.00 15.23 H new ATOM 0 HB3 GLN A 63 -4.494 -4.715 -22.697 1.00 15.23 H new ATOM 0 HG2 GLN A 63 -6.583 -5.737 -21.894 1.00 42.22 H new ATOM 0 HG3 GLN A 63 -6.390 -4.989 -20.321 1.00 42.22 H new ATOM 0 HE21 GLN A 63 -7.633 -4.605 -23.537 1.00 33.20 H new ATOM 0 HE22 GLN A 63 -8.284 -2.978 -23.308 1.00 33.20 H new ATOM 987 N HIS A 64 -1.597 -5.010 -20.611 1.00 34.44 N ATOM 988 CA HIS A 64 -0.148 -4.804 -20.796 1.00 35.31 C ATOM 989 C HIS A 64 0.560 -4.862 -19.420 1.00 65.41 C ATOM 990 O HIS A 64 0.687 -3.826 -18.746 1.00 71.51 O ATOM 991 CB HIS A 64 0.141 -3.445 -21.512 1.00 54.42 C ATOM 992 CG HIS A 64 -0.342 -3.381 -22.935 1.00 64.11 C ATOM 993 ND1 HIS A 64 0.406 -3.836 -23.996 1.00 53.24 N ATOM 994 CD2 HIS A 64 -1.510 -2.943 -23.466 1.00 43.24 C ATOM 995 CE1 HIS A 64 -0.281 -3.685 -25.110 1.00 14.01 C ATOM 996 NE2 HIS A 64 -1.441 -3.148 -24.816 1.00 75.23 N ATOM 0 H HIS A 64 -1.975 -4.506 -19.809 1.00 34.44 H new ATOM 0 HA HIS A 64 0.242 -5.598 -21.433 1.00 35.31 H new ATOM 0 HB2 HIS A 64 -0.329 -2.642 -20.945 1.00 54.42 H new ATOM 0 HB3 HIS A 64 1.215 -3.261 -21.496 1.00 54.42 H new ATOM 0 HD2 HIS A 64 -2.339 -2.513 -22.924 1.00 43.24 H new ATOM 0 HE1 HIS A 64 0.055 -3.958 -26.100 1.00 14.01 H new ATOM 0 HE2 HIS A 64 -2.174 -2.920 -25.487 1.00 75.23 H new ATOM 1005 N PRO A 65 0.932 -6.090 -18.926 1.00 15.42 N ATOM 1006 CA PRO A 65 1.741 -6.242 -17.692 1.00 62.41 C ATOM 1007 C PRO A 65 3.203 -5.786 -17.924 1.00 43.14 C ATOM 1008 O PRO A 65 3.572 -4.673 -17.524 1.00 73.03 O ATOM 1009 CB PRO A 65 1.621 -7.764 -17.345 1.00 10.54 C ATOM 1010 CG PRO A 65 0.518 -8.284 -18.237 1.00 3.43 C ATOM 1011 CD PRO A 65 0.557 -7.418 -19.475 1.00 65.34 C ATOM 0 HA PRO A 65 1.392 -5.619 -16.869 1.00 62.41 H new ATOM 0 HB2 PRO A 65 2.559 -8.286 -17.532 1.00 10.54 H new ATOM 0 HB3 PRO A 65 1.379 -7.911 -16.292 1.00 10.54 H new ATOM 0 HG2 PRO A 65 0.677 -9.333 -18.487 1.00 3.43 H new ATOM 0 HG3 PRO A 65 -0.451 -8.218 -17.742 1.00 3.43 H new ATOM 0 HD2 PRO A 65 1.287 -7.778 -20.200 1.00 65.34 H new ATOM 0 HD3 PRO A 65 -0.408 -7.390 -19.981 1.00 65.34 H new ATOM 1019 N GLY A 66 4.004 -6.654 -18.596 1.00 43.44 N ATOM 1020 CA GLY A 66 5.412 -6.385 -18.928 1.00 55.40 C ATOM 1021 C GLY A 66 6.241 -5.883 -17.745 1.00 4.14 C ATOM 1022 O GLY A 66 6.233 -6.499 -16.667 1.00 13.31 O ATOM 0 H GLY A 66 3.680 -7.565 -18.921 1.00 43.44 H new ATOM 0 HA2 GLY A 66 5.865 -7.298 -19.315 1.00 55.40 H new ATOM 0 HA3 GLY A 66 5.452 -5.645 -19.727 1.00 55.40 H new ATOM 1026 N GLY A 67 6.945 -4.758 -17.955 1.00 74.13 N ATOM 1027 CA GLY A 67 7.613 -4.015 -16.885 1.00 44.12 C ATOM 1028 C GLY A 67 6.785 -2.812 -16.429 1.00 52.04 C ATOM 1029 O GLY A 67 7.207 -2.073 -15.526 1.00 21.23 O ATOM 0 H GLY A 67 7.064 -4.340 -18.878 1.00 74.13 H new ATOM 0 HA2 GLY A 67 7.790 -4.677 -16.038 1.00 44.12 H new ATOM 0 HA3 GLY A 67 8.588 -3.675 -17.232 1.00 44.12 H new ATOM 1033 N SER A 68 5.605 -2.621 -17.077 1.00 0.40 N ATOM 1034 CA SER A 68 4.688 -1.482 -16.852 1.00 0.21 C ATOM 1035 C SER A 68 5.333 -0.157 -17.354 1.00 53.42 C ATOM 1036 O SER A 68 6.144 -0.195 -18.296 1.00 41.44 O ATOM 1037 CB SER A 68 4.242 -1.440 -15.358 1.00 12.43 C ATOM 1038 OG SER A 68 3.736 -2.706 -14.948 1.00 73.04 O ATOM 0 H SER A 68 5.262 -3.271 -17.784 1.00 0.40 H new ATOM 0 HA SER A 68 3.779 -1.613 -17.439 1.00 0.21 H new ATOM 0 HB2 SER A 68 5.087 -1.159 -14.729 1.00 12.43 H new ATOM 0 HB3 SER A 68 3.476 -0.676 -15.223 1.00 12.43 H new ATOM 0 HG SER A 68 3.052 -2.577 -14.259 1.00 73.04 H new ATOM 1044 N GLY A 69 4.967 0.995 -16.741 1.00 64.33 N ATOM 1045 CA GLY A 69 5.453 2.314 -17.175 1.00 44.01 C ATOM 1046 C GLY A 69 6.979 2.480 -17.065 1.00 11.50 C ATOM 1047 O GLY A 69 7.573 3.206 -17.871 1.00 50.43 O ATOM 0 H GLY A 69 4.334 1.030 -15.942 1.00 64.33 H new ATOM 0 HA2 GLY A 69 5.152 2.479 -18.210 1.00 44.01 H new ATOM 0 HA3 GLY A 69 4.969 3.085 -16.575 1.00 44.01 H new ATOM 1051 N LEU A 70 7.601 1.766 -16.079 1.00 15.12 N ATOM 1052 CA LEU A 70 9.061 1.807 -15.781 1.00 34.53 C ATOM 1053 C LEU A 70 9.530 3.248 -15.446 1.00 41.24 C ATOM 1054 O LEU A 70 9.578 3.646 -14.276 1.00 52.23 O ATOM 1055 CB LEU A 70 9.909 1.166 -16.941 1.00 64.20 C ATOM 1056 CG LEU A 70 9.730 -0.370 -17.163 1.00 12.24 C ATOM 1057 CD1 LEU A 70 10.463 -0.836 -18.443 1.00 43.40 C ATOM 1058 CD2 LEU A 70 10.215 -1.161 -15.926 1.00 45.30 C ATOM 0 H LEU A 70 7.090 1.136 -15.460 1.00 15.12 H new ATOM 0 HA LEU A 70 9.231 1.199 -14.892 1.00 34.53 H new ATOM 0 HB2 LEU A 70 9.659 1.677 -17.870 1.00 64.20 H new ATOM 0 HB3 LEU A 70 10.963 1.362 -16.743 1.00 64.20 H new ATOM 0 HG LEU A 70 8.667 -0.571 -17.298 1.00 12.24 H new ATOM 0 HD11 LEU A 70 10.322 -1.909 -18.573 1.00 43.40 H new ATOM 0 HD12 LEU A 70 10.057 -0.309 -19.307 1.00 43.40 H new ATOM 0 HD13 LEU A 70 11.527 -0.619 -18.352 1.00 43.40 H new ATOM 0 HD21 LEU A 70 10.082 -2.228 -16.101 1.00 45.30 H new ATOM 0 HD22 LEU A 70 11.270 -0.951 -15.751 1.00 45.30 H new ATOM 0 HD23 LEU A 70 9.636 -0.862 -15.053 1.00 45.30 H new ATOM 1070 N ASP A 71 9.863 4.009 -16.495 1.00 33.40 N ATOM 1071 CA ASP A 71 10.239 5.439 -16.422 1.00 63.05 C ATOM 1072 C ASP A 71 9.655 6.201 -17.642 1.00 22.40 C ATOM 1073 O ASP A 71 9.557 7.433 -17.632 1.00 70.44 O ATOM 1074 CB ASP A 71 11.785 5.575 -16.358 1.00 50.43 C ATOM 1075 CG ASP A 71 12.265 7.022 -16.148 1.00 2.31 C ATOM 1076 OD1 ASP A 71 11.956 7.607 -15.089 1.00 34.31 O ATOM 1077 OD2 ASP A 71 12.969 7.569 -17.022 1.00 11.23 O ATOM 0 H ASP A 71 9.881 3.644 -17.447 1.00 33.40 H new ATOM 0 HA ASP A 71 9.823 5.881 -15.517 1.00 63.05 H new ATOM 0 HB2 ASP A 71 12.163 4.954 -15.546 1.00 50.43 H new ATOM 0 HB3 ASP A 71 12.215 5.188 -17.282 1.00 50.43 H new ATOM 1082 N ASP A 72 9.249 5.431 -18.681 1.00 60.33 N ATOM 1083 CA ASP A 72 8.624 5.944 -19.917 1.00 31.44 C ATOM 1084 C ASP A 72 7.323 6.694 -19.590 1.00 0.41 C ATOM 1085 O ASP A 72 7.177 7.876 -19.926 1.00 2.32 O ATOM 1086 CB ASP A 72 8.347 4.745 -20.882 1.00 53.24 C ATOM 1087 CG ASP A 72 7.474 5.120 -22.100 1.00 21.21 C ATOM 1088 OD1 ASP A 72 6.236 4.909 -22.062 1.00 23.23 O ATOM 1089 OD2 ASP A 72 8.015 5.640 -23.098 1.00 71.41 O ATOM 0 H ASP A 72 9.351 4.416 -18.680 1.00 60.33 H new ATOM 0 HA ASP A 72 9.299 6.648 -20.403 1.00 31.44 H new ATOM 0 HB2 ASP A 72 9.298 4.347 -21.236 1.00 53.24 H new ATOM 0 HB3 ASP A 72 7.855 3.947 -20.325 1.00 53.24 H new ATOM 1094 N ILE A 73 6.407 5.971 -18.908 1.00 40.30 N ATOM 1095 CA ILE A 73 5.057 6.443 -18.542 1.00 44.34 C ATOM 1096 C ILE A 73 4.240 6.803 -19.816 1.00 72.12 C ATOM 1097 O ILE A 73 4.418 7.894 -20.380 1.00 13.23 O ATOM 1098 CB ILE A 73 5.073 7.648 -17.508 1.00 63.13 C ATOM 1099 CG1 ILE A 73 5.915 7.282 -16.235 1.00 25.11 C ATOM 1100 CG2 ILE A 73 3.633 8.073 -17.114 1.00 72.10 C ATOM 1101 CD1 ILE A 73 5.395 6.090 -15.429 1.00 33.00 C ATOM 0 H ILE A 73 6.593 5.020 -18.590 1.00 40.30 H new ATOM 0 HA ILE A 73 4.565 5.616 -18.030 1.00 44.34 H new ATOM 0 HB ILE A 73 5.548 8.498 -17.998 1.00 63.13 H new ATOM 0 HG12 ILE A 73 6.939 7.072 -16.545 1.00 25.11 H new ATOM 0 HG13 ILE A 73 5.952 8.153 -15.581 1.00 25.11 H new ATOM 0 HG21 ILE A 73 3.679 8.900 -16.405 1.00 72.10 H new ATOM 0 HG22 ILE A 73 3.090 8.388 -18.005 1.00 72.10 H new ATOM 0 HG23 ILE A 73 3.118 7.230 -16.655 1.00 72.10 H new ATOM 0 HD11 ILE A 73 6.046 5.919 -14.571 1.00 33.00 H new ATOM 0 HD12 ILE A 73 4.383 6.299 -15.081 1.00 33.00 H new ATOM 0 HD13 ILE A 73 5.385 5.201 -16.060 1.00 33.00 H new ATOM 1113 N PRO A 74 3.380 5.858 -20.323 1.00 1.41 N ATOM 1114 CA PRO A 74 2.490 6.119 -21.489 1.00 11.44 C ATOM 1115 C PRO A 74 1.520 7.319 -21.247 1.00 23.42 C ATOM 1116 O PRO A 74 1.192 7.611 -20.088 1.00 42.41 O ATOM 1117 CB PRO A 74 1.721 4.775 -21.653 1.00 55.40 C ATOM 1118 CG PRO A 74 2.594 3.745 -20.999 1.00 34.05 C ATOM 1119 CD PRO A 74 3.229 4.455 -19.830 1.00 31.12 C ATOM 0 HA PRO A 74 3.045 6.409 -22.381 1.00 11.44 H new ATOM 0 HB2 PRO A 74 0.741 4.821 -21.178 1.00 55.40 H new ATOM 0 HB3 PRO A 74 1.555 4.541 -22.705 1.00 55.40 H new ATOM 0 HG2 PRO A 74 2.010 2.886 -20.669 1.00 34.05 H new ATOM 0 HG3 PRO A 74 3.349 3.371 -21.691 1.00 34.05 H new ATOM 0 HD2 PRO A 74 2.601 4.406 -18.940 1.00 31.12 H new ATOM 0 HD3 PRO A 74 4.191 4.015 -19.566 1.00 31.12 H new ATOM 1127 N PRO A 75 1.052 8.021 -22.339 1.00 4.54 N ATOM 1128 CA PRO A 75 0.169 9.222 -22.244 1.00 24.21 C ATOM 1129 C PRO A 75 -1.079 8.988 -21.368 1.00 3.11 C ATOM 1130 O PRO A 75 -1.353 9.788 -20.472 1.00 14.24 O ATOM 1131 CB PRO A 75 -0.213 9.525 -23.730 1.00 64.43 C ATOM 1132 CG PRO A 75 0.194 8.301 -24.503 1.00 25.12 C ATOM 1133 CD PRO A 75 1.369 7.722 -23.757 1.00 71.53 C ATOM 0 HA PRO A 75 0.674 10.055 -21.756 1.00 24.21 H new ATOM 0 HB2 PRO A 75 -1.281 9.716 -23.830 1.00 64.43 H new ATOM 0 HB3 PRO A 75 0.305 10.411 -24.096 1.00 64.43 H new ATOM 0 HG2 PRO A 75 -0.625 7.584 -24.561 1.00 25.12 H new ATOM 0 HG3 PRO A 75 0.467 8.557 -25.527 1.00 25.12 H new ATOM 0 HD2 PRO A 75 1.467 6.650 -23.930 1.00 71.53 H new ATOM 0 HD3 PRO A 75 2.308 8.182 -24.065 1.00 71.53 H new ATOM 1141 N TYR A 76 -1.790 7.858 -21.614 1.00 63.04 N ATOM 1142 CA TYR A 76 -2.981 7.462 -20.828 1.00 74.31 C ATOM 1143 C TYR A 76 -2.665 7.413 -19.324 1.00 52.22 C ATOM 1144 O TYR A 76 -3.372 8.020 -18.527 1.00 72.05 O ATOM 1145 CB TYR A 76 -3.540 6.078 -21.297 1.00 21.20 C ATOM 1146 CG TYR A 76 -4.529 5.421 -20.301 1.00 74.53 C ATOM 1147 CD1 TYR A 76 -5.814 5.940 -20.105 1.00 31.42 C ATOM 1148 CD2 TYR A 76 -4.154 4.310 -19.531 1.00 44.24 C ATOM 1149 CE1 TYR A 76 -6.678 5.376 -19.176 1.00 70.45 C ATOM 1150 CE2 TYR A 76 -5.019 3.748 -18.615 1.00 34.12 C ATOM 1151 CZ TYR A 76 -6.272 4.279 -18.439 1.00 24.31 C ATOM 1152 OH TYR A 76 -7.116 3.712 -17.506 1.00 15.31 O ATOM 0 H TYR A 76 -1.554 7.202 -22.358 1.00 63.04 H new ATOM 0 HA TYR A 76 -3.744 8.221 -21.001 1.00 74.31 H new ATOM 0 HB2 TYR A 76 -4.041 6.207 -22.257 1.00 21.20 H new ATOM 0 HB3 TYR A 76 -2.704 5.399 -21.463 1.00 21.20 H new ATOM 0 HD1 TYR A 76 -6.138 6.792 -20.685 1.00 31.42 H new ATOM 0 HD2 TYR A 76 -3.169 3.886 -19.658 1.00 44.24 H new ATOM 0 HE1 TYR A 76 -7.664 5.793 -19.030 1.00 70.45 H new ATOM 0 HE2 TYR A 76 -4.710 2.890 -18.036 1.00 34.12 H new ATOM 0 HH TYR A 76 -8.046 3.827 -17.794 1.00 15.31 H new ATOM 1162 N ASP A 77 -1.583 6.703 -18.978 1.00 62.14 N ATOM 1163 CA ASP A 77 -1.201 6.420 -17.579 1.00 33.03 C ATOM 1164 C ASP A 77 -0.889 7.714 -16.809 1.00 72.01 C ATOM 1165 O ASP A 77 -1.173 7.812 -15.608 1.00 72.11 O ATOM 1166 CB ASP A 77 0.016 5.455 -17.547 1.00 55.32 C ATOM 1167 CG ASP A 77 -0.280 4.083 -18.189 1.00 41.54 C ATOM 1168 OD1 ASP A 77 -0.187 3.041 -17.500 1.00 61.40 O ATOM 1169 OD2 ASP A 77 -0.617 4.042 -19.390 1.00 34.40 O ATOM 0 H ASP A 77 -0.941 6.304 -19.662 1.00 62.14 H new ATOM 0 HA ASP A 77 -2.046 5.942 -17.085 1.00 33.03 H new ATOM 0 HB2 ASP A 77 0.854 5.919 -18.067 1.00 55.32 H new ATOM 0 HB3 ASP A 77 0.326 5.306 -16.513 1.00 55.32 H new ATOM 1174 N ARG A 78 -0.337 8.718 -17.524 1.00 54.23 N ATOM 1175 CA ARG A 78 -0.001 10.018 -16.926 1.00 43.03 C ATOM 1176 C ARG A 78 -1.284 10.843 -16.690 1.00 42.33 C ATOM 1177 O ARG A 78 -1.567 11.227 -15.551 1.00 53.53 O ATOM 1178 CB ARG A 78 1.009 10.798 -17.813 1.00 71.14 C ATOM 1179 CG ARG A 78 1.617 12.029 -17.111 1.00 2.53 C ATOM 1180 CD ARG A 78 2.628 12.786 -17.982 1.00 40.34 C ATOM 1181 NE ARG A 78 2.005 13.458 -19.137 1.00 3.45 N ATOM 1182 CZ ARG A 78 2.665 14.228 -20.026 1.00 42.30 C ATOM 1183 NH1 ARG A 78 3.980 14.427 -19.921 1.00 52.02 N ATOM 1184 NH2 ARG A 78 1.998 14.811 -21.011 1.00 65.21 N ATOM 0 H ARG A 78 -0.116 8.648 -18.517 1.00 54.23 H new ATOM 0 HA ARG A 78 0.478 9.841 -15.963 1.00 43.03 H new ATOM 0 HB2 ARG A 78 1.813 10.126 -18.112 1.00 71.14 H new ATOM 0 HB3 ARG A 78 0.507 11.120 -18.725 1.00 71.14 H new ATOM 0 HG2 ARG A 78 0.814 12.708 -16.824 1.00 2.53 H new ATOM 0 HG3 ARG A 78 2.108 11.709 -16.192 1.00 2.53 H new ATOM 0 HD2 ARG A 78 3.142 13.528 -17.371 1.00 40.34 H new ATOM 0 HD3 ARG A 78 3.385 12.088 -18.340 1.00 40.34 H new ATOM 0 HE ARG A 78 1.002 13.331 -19.274 1.00 3.45 H new ATOM 0 HH11 ARG A 78 4.502 13.994 -19.159 1.00 52.02 H new ATOM 0 HH12 ARG A 78 4.463 15.012 -20.602 1.00 52.02 H new ATOM 0 HH21 ARG A 78 0.990 14.676 -21.094 1.00 65.21 H new ATOM 0 HH22 ARG A 78 2.492 15.394 -21.686 1.00 65.21 H new ATOM 1198 N ASP A 79 -2.081 11.043 -17.772 1.00 50.22 N ATOM 1199 CA ASP A 79 -3.362 11.814 -17.736 1.00 34.30 C ATOM 1200 C ASP A 79 -4.350 11.226 -16.710 1.00 2.30 C ATOM 1201 O ASP A 79 -5.141 11.953 -16.101 1.00 71.34 O ATOM 1202 CB ASP A 79 -4.046 11.846 -19.134 1.00 13.20 C ATOM 1203 CG ASP A 79 -3.354 12.769 -20.154 1.00 41.11 C ATOM 1204 OD1 ASP A 79 -3.697 13.975 -20.217 1.00 15.20 O ATOM 1205 OD2 ASP A 79 -2.483 12.302 -20.903 1.00 62.23 O ATOM 0 H ASP A 79 -1.857 10.676 -18.697 1.00 50.22 H new ATOM 0 HA ASP A 79 -3.102 12.830 -17.439 1.00 34.30 H new ATOM 0 HB2 ASP A 79 -4.072 10.833 -19.536 1.00 13.20 H new ATOM 0 HB3 ASP A 79 -5.080 12.168 -19.013 1.00 13.20 H new ATOM 1210 N PHE A 80 -4.283 9.894 -16.561 1.00 33.14 N ATOM 1211 CA PHE A 80 -5.095 9.121 -15.611 1.00 74.15 C ATOM 1212 C PHE A 80 -4.799 9.569 -14.167 1.00 53.53 C ATOM 1213 O PHE A 80 -5.722 9.875 -13.399 1.00 75.10 O ATOM 1214 CB PHE A 80 -4.801 7.594 -15.797 1.00 41.11 C ATOM 1215 CG PHE A 80 -5.350 6.718 -14.685 1.00 40.14 C ATOM 1216 CD1 PHE A 80 -6.678 6.312 -14.687 1.00 12.24 C ATOM 1217 CD2 PHE A 80 -4.542 6.349 -13.609 1.00 55.31 C ATOM 1218 CE1 PHE A 80 -7.179 5.567 -13.648 1.00 33.24 C ATOM 1219 CE2 PHE A 80 -5.044 5.604 -12.577 1.00 73.40 C ATOM 1220 CZ PHE A 80 -6.362 5.216 -12.590 1.00 30.10 C ATOM 0 H PHE A 80 -3.649 9.313 -17.110 1.00 33.14 H new ATOM 0 HA PHE A 80 -6.152 9.300 -15.806 1.00 74.15 H new ATOM 0 HB2 PHE A 80 -5.225 7.266 -16.746 1.00 41.11 H new ATOM 0 HB3 PHE A 80 -3.723 7.448 -15.862 1.00 41.11 H new ATOM 0 HD1 PHE A 80 -7.321 6.584 -15.511 1.00 12.24 H new ATOM 0 HD2 PHE A 80 -3.507 6.656 -13.590 1.00 55.31 H new ATOM 0 HE1 PHE A 80 -8.213 5.255 -13.658 1.00 33.24 H new ATOM 0 HE2 PHE A 80 -4.405 5.321 -11.753 1.00 73.40 H new ATOM 0 HZ PHE A 80 -6.761 4.635 -11.771 1.00 30.10 H new ATOM 1230 N CYS A 81 -3.502 9.588 -13.824 1.00 25.31 N ATOM 1231 CA CYS A 81 -3.024 9.892 -12.465 1.00 34.14 C ATOM 1232 C CYS A 81 -3.087 11.404 -12.164 1.00 24.11 C ATOM 1233 O CYS A 81 -2.973 11.811 -11.000 1.00 44.24 O ATOM 1234 CB CYS A 81 -1.587 9.351 -12.291 1.00 4.03 C ATOM 1235 SG CYS A 81 -1.442 7.562 -12.515 1.00 11.54 S ATOM 0 H CYS A 81 -2.750 9.392 -14.485 1.00 25.31 H new ATOM 0 HA CYS A 81 -3.681 9.399 -11.749 1.00 34.14 H new ATOM 0 HB2 CYS A 81 -0.933 9.850 -13.006 1.00 4.03 H new ATOM 0 HB3 CYS A 81 -1.230 9.612 -11.295 1.00 4.03 H new ATOM 0 HG CYS A 81 -1.287 7.294 -13.778 1.00 11.54 H new ATOM 1241 N LYS A 82 -3.278 12.237 -13.216 1.00 1.24 N ATOM 1242 CA LYS A 82 -3.520 13.680 -13.045 1.00 53.51 C ATOM 1243 C LYS A 82 -4.962 13.894 -12.556 1.00 22.31 C ATOM 1244 O LYS A 82 -5.890 14.063 -13.355 1.00 25.23 O ATOM 1245 CB LYS A 82 -3.260 14.475 -14.361 1.00 40.43 C ATOM 1246 CG LYS A 82 -1.840 14.339 -14.945 1.00 31.52 C ATOM 1247 CD LYS A 82 -0.717 14.693 -13.954 1.00 65.04 C ATOM 1248 CE LYS A 82 -0.749 16.158 -13.498 1.00 62.52 C ATOM 1249 NZ LYS A 82 0.375 16.457 -12.574 1.00 42.22 N ATOM 0 H LYS A 82 -3.268 11.929 -14.188 1.00 1.24 H new ATOM 0 HA LYS A 82 -2.819 14.062 -12.303 1.00 53.51 H new ATOM 0 HB2 LYS A 82 -3.977 14.145 -15.113 1.00 40.43 H new ATOM 0 HB3 LYS A 82 -3.458 15.530 -14.173 1.00 40.43 H new ATOM 0 HG2 LYS A 82 -1.697 13.315 -15.289 1.00 31.52 H new ATOM 0 HG3 LYS A 82 -1.755 14.984 -15.820 1.00 31.52 H new ATOM 0 HD2 LYS A 82 -0.796 14.046 -13.080 1.00 65.04 H new ATOM 0 HD3 LYS A 82 0.247 14.485 -14.419 1.00 65.04 H new ATOM 0 HE2 LYS A 82 -0.693 16.814 -14.367 1.00 62.52 H new ATOM 0 HE3 LYS A 82 -1.697 16.367 -13.002 1.00 62.52 H new ATOM 0 HZ1 LYS A 82 0.328 17.454 -12.282 1.00 42.22 H new ATOM 0 HZ2 LYS A 82 0.306 15.847 -11.735 1.00 42.22 H new ATOM 0 HZ3 LYS A 82 1.278 16.280 -13.058 1.00 42.22 H new ATOM 1263 N VAL A 83 -5.135 13.790 -11.232 1.00 73.53 N ATOM 1264 CA VAL A 83 -6.415 13.993 -10.538 1.00 40.13 C ATOM 1265 C VAL A 83 -6.237 15.055 -9.438 1.00 10.54 C ATOM 1266 O VAL A 83 -5.104 15.467 -9.138 1.00 21.34 O ATOM 1267 CB VAL A 83 -6.967 12.638 -9.936 1.00 34.12 C ATOM 1268 CG1 VAL A 83 -7.319 11.623 -11.050 1.00 3.35 C ATOM 1269 CG2 VAL A 83 -5.974 12.016 -8.920 1.00 41.24 C ATOM 0 H VAL A 83 -4.371 13.557 -10.598 1.00 73.53 H new ATOM 0 HA VAL A 83 -7.153 14.345 -11.259 1.00 40.13 H new ATOM 0 HB VAL A 83 -7.885 12.880 -9.400 1.00 34.12 H new ATOM 0 HG11 VAL A 83 -7.695 10.704 -10.600 1.00 3.35 H new ATOM 0 HG12 VAL A 83 -8.084 12.047 -11.701 1.00 3.35 H new ATOM 0 HG13 VAL A 83 -6.427 11.401 -11.635 1.00 3.35 H new ATOM 0 HG21 VAL A 83 -6.388 11.087 -8.528 1.00 41.24 H new ATOM 0 HG22 VAL A 83 -5.026 11.810 -9.417 1.00 41.24 H new ATOM 0 HG23 VAL A 83 -5.809 12.714 -8.099 1.00 41.24 H new ATOM 1279 N ASP A 84 -7.360 15.484 -8.838 1.00 53.24 N ATOM 1280 CA ASP A 84 -7.384 16.576 -7.848 1.00 41.14 C ATOM 1281 C ASP A 84 -6.773 16.099 -6.501 1.00 3.34 C ATOM 1282 O ASP A 84 -6.613 14.893 -6.292 1.00 31.30 O ATOM 1283 CB ASP A 84 -8.847 17.088 -7.681 1.00 74.10 C ATOM 1284 CG ASP A 84 -8.918 18.521 -7.119 1.00 14.21 C ATOM 1285 OD1 ASP A 84 -9.146 18.700 -5.912 1.00 73.00 O ATOM 1286 OD2 ASP A 84 -8.706 19.484 -7.888 1.00 35.25 O ATOM 0 H ASP A 84 -8.279 15.083 -9.026 1.00 53.24 H new ATOM 0 HA ASP A 84 -6.772 17.408 -8.198 1.00 41.14 H new ATOM 0 HB2 ASP A 84 -9.351 17.056 -8.647 1.00 74.10 H new ATOM 0 HB3 ASP A 84 -9.389 16.415 -7.017 1.00 74.10 H new ATOM 1291 N GLN A 85 -6.481 17.055 -5.593 1.00 73.25 N ATOM 1292 CA GLN A 85 -5.697 16.809 -4.352 1.00 52.40 C ATOM 1293 C GLN A 85 -6.349 15.744 -3.405 1.00 21.11 C ATOM 1294 O GLN A 85 -5.650 14.798 -3.014 1.00 4.24 O ATOM 1295 CB GLN A 85 -5.407 18.155 -3.602 1.00 10.45 C ATOM 1296 CG GLN A 85 -4.549 18.023 -2.320 1.00 5.10 C ATOM 1297 CD GLN A 85 -3.145 17.459 -2.553 1.00 51.25 C ATOM 1298 OE1 GLN A 85 -2.550 17.616 -3.619 1.00 64.30 O ATOM 1299 NE2 GLN A 85 -2.596 16.813 -1.542 1.00 61.41 N ATOM 0 H GLN A 85 -6.781 18.024 -5.696 1.00 73.25 H new ATOM 0 HA GLN A 85 -4.746 16.377 -4.664 1.00 52.40 H new ATOM 0 HB2 GLN A 85 -4.903 18.834 -4.289 1.00 10.45 H new ATOM 0 HB3 GLN A 85 -6.358 18.617 -3.338 1.00 10.45 H new ATOM 0 HG2 GLN A 85 -4.460 19.005 -1.854 1.00 5.10 H new ATOM 0 HG3 GLN A 85 -5.072 17.381 -1.612 1.00 5.10 H new ATOM 0 HE21 GLN A 85 -3.112 16.698 -0.670 1.00 61.41 H new ATOM 0 HE22 GLN A 85 -1.655 16.429 -1.633 1.00 61.41 H new ATOM 1308 N PRO A 86 -7.682 15.840 -3.018 1.00 2.51 N ATOM 1309 CA PRO A 86 -8.349 14.778 -2.212 1.00 50.40 C ATOM 1310 C PRO A 86 -8.461 13.448 -2.985 1.00 61.14 C ATOM 1311 O PRO A 86 -8.366 12.370 -2.390 1.00 35.40 O ATOM 1312 CB PRO A 86 -9.756 15.358 -1.888 1.00 65.50 C ATOM 1313 CG PRO A 86 -9.629 16.828 -2.155 1.00 23.42 C ATOM 1314 CD PRO A 86 -8.634 16.950 -3.285 1.00 1.10 C ATOM 0 HA PRO A 86 -7.779 14.538 -1.314 1.00 50.40 H new ATOM 0 HB2 PRO A 86 -10.525 14.906 -2.515 1.00 65.50 H new ATOM 0 HB3 PRO A 86 -10.035 15.166 -0.852 1.00 65.50 H new ATOM 0 HG2 PRO A 86 -10.591 17.261 -2.431 1.00 23.42 H new ATOM 0 HG3 PRO A 86 -9.283 17.359 -1.268 1.00 23.42 H new ATOM 0 HD2 PRO A 86 -9.114 16.844 -4.258 1.00 1.10 H new ATOM 0 HD3 PRO A 86 -8.135 17.919 -3.280 1.00 1.10 H new ATOM 1322 N THR A 87 -8.630 13.556 -4.327 1.00 33.13 N ATOM 1323 CA THR A 87 -8.799 12.400 -5.234 1.00 1.01 C ATOM 1324 C THR A 87 -7.513 11.539 -5.290 1.00 50.40 C ATOM 1325 O THR A 87 -7.586 10.313 -5.442 1.00 33.32 O ATOM 1326 CB THR A 87 -9.189 12.876 -6.676 1.00 71.33 C ATOM 1327 OG1 THR A 87 -10.225 13.865 -6.602 1.00 13.02 O ATOM 1328 CG2 THR A 87 -9.666 11.713 -7.566 1.00 11.44 C ATOM 0 H THR A 87 -8.652 14.454 -4.810 1.00 33.13 H new ATOM 0 HA THR A 87 -9.607 11.786 -4.836 1.00 1.01 H new ATOM 0 HB THR A 87 -8.291 13.299 -7.127 1.00 71.33 H new ATOM 0 HG1 THR A 87 -10.462 14.159 -7.506 1.00 13.02 H new ATOM 0 HG21 THR A 87 -9.925 12.093 -8.554 1.00 11.44 H new ATOM 0 HG22 THR A 87 -8.869 10.975 -7.658 1.00 11.44 H new ATOM 0 HG23 THR A 87 -10.542 11.246 -7.116 1.00 11.44 H new ATOM 1336 N LEU A 88 -6.342 12.207 -5.149 1.00 3.33 N ATOM 1337 CA LEU A 88 -5.021 11.545 -5.016 1.00 23.11 C ATOM 1338 C LEU A 88 -5.045 10.572 -3.823 1.00 1.32 C ATOM 1339 O LEU A 88 -4.721 9.389 -3.960 1.00 31.45 O ATOM 1340 CB LEU A 88 -3.898 12.616 -4.829 1.00 63.23 C ATOM 1341 CG LEU A 88 -3.559 13.495 -6.079 1.00 32.32 C ATOM 1342 CD1 LEU A 88 -2.666 14.699 -5.699 1.00 30.43 C ATOM 1343 CD2 LEU A 88 -2.895 12.648 -7.189 1.00 72.03 C ATOM 0 H LEU A 88 -6.287 13.225 -5.124 1.00 3.33 H new ATOM 0 HA LEU A 88 -4.809 10.981 -5.925 1.00 23.11 H new ATOM 0 HB2 LEU A 88 -4.190 13.279 -4.015 1.00 63.23 H new ATOM 0 HB3 LEU A 88 -2.988 12.105 -4.514 1.00 63.23 H new ATOM 0 HG LEU A 88 -4.499 13.888 -6.467 1.00 32.32 H new ATOM 0 HD11 LEU A 88 -2.450 15.288 -6.591 1.00 30.43 H new ATOM 0 HD12 LEU A 88 -3.185 15.321 -4.970 1.00 30.43 H new ATOM 0 HD13 LEU A 88 -1.732 14.338 -5.268 1.00 30.43 H new ATOM 0 HD21 LEU A 88 -2.670 13.283 -8.046 1.00 72.03 H new ATOM 0 HD22 LEU A 88 -1.972 12.210 -6.809 1.00 72.03 H new ATOM 0 HD23 LEU A 88 -3.575 11.853 -7.495 1.00 72.03 H new ATOM 1355 N PHE A 89 -5.520 11.090 -2.672 1.00 12.12 N ATOM 1356 CA PHE A 89 -5.609 10.325 -1.412 1.00 2.15 C ATOM 1357 C PHE A 89 -6.686 9.233 -1.493 1.00 22.25 C ATOM 1358 O PHE A 89 -6.509 8.161 -0.934 1.00 72.15 O ATOM 1359 CB PHE A 89 -5.878 11.264 -0.208 1.00 15.33 C ATOM 1360 CG PHE A 89 -4.775 12.303 0.013 1.00 41.42 C ATOM 1361 CD1 PHE A 89 -3.457 11.902 0.229 1.00 74.45 C ATOM 1362 CD2 PHE A 89 -5.054 13.667 0.005 1.00 14.25 C ATOM 1363 CE1 PHE A 89 -2.455 12.834 0.431 1.00 45.44 C ATOM 1364 CE2 PHE A 89 -4.053 14.597 0.211 1.00 71.52 C ATOM 1365 CZ PHE A 89 -2.753 14.181 0.420 1.00 14.34 C ATOM 0 H PHE A 89 -5.853 12.051 -2.590 1.00 12.12 H new ATOM 0 HA PHE A 89 -4.646 9.837 -1.259 1.00 2.15 H new ATOM 0 HB2 PHE A 89 -6.826 11.779 -0.364 1.00 15.33 H new ATOM 0 HB3 PHE A 89 -5.986 10.663 0.695 1.00 15.33 H new ATOM 0 HD1 PHE A 89 -3.215 10.849 0.239 1.00 74.45 H new ATOM 0 HD2 PHE A 89 -6.066 14.003 -0.164 1.00 14.25 H new ATOM 0 HE1 PHE A 89 -1.439 12.507 0.597 1.00 45.44 H new ATOM 0 HE2 PHE A 89 -4.288 15.651 0.209 1.00 71.52 H new ATOM 0 HZ PHE A 89 -1.971 14.909 0.575 1.00 14.34 H new ATOM 1375 N GLU A 90 -7.781 9.516 -2.222 1.00 65.11 N ATOM 1376 CA GLU A 90 -8.871 8.542 -2.454 1.00 61.42 C ATOM 1377 C GLU A 90 -8.359 7.304 -3.201 1.00 61.25 C ATOM 1378 O GLU A 90 -8.750 6.179 -2.887 1.00 34.23 O ATOM 1379 CB GLU A 90 -10.021 9.187 -3.263 1.00 21.14 C ATOM 1380 CG GLU A 90 -10.842 10.238 -2.511 1.00 55.51 C ATOM 1381 CD GLU A 90 -11.719 9.635 -1.399 1.00 14.23 C ATOM 1382 OE1 GLU A 90 -12.871 9.238 -1.695 1.00 31.23 O ATOM 1383 OE2 GLU A 90 -11.272 9.562 -0.232 1.00 54.23 O ATOM 0 H GLU A 90 -7.938 10.421 -2.666 1.00 65.11 H new ATOM 0 HA GLU A 90 -9.245 8.235 -1.477 1.00 61.42 H new ATOM 0 HB2 GLU A 90 -9.600 9.650 -4.156 1.00 21.14 H new ATOM 0 HB3 GLU A 90 -10.693 8.398 -3.600 1.00 21.14 H new ATOM 0 HG2 GLU A 90 -10.167 10.974 -2.074 1.00 55.51 H new ATOM 0 HG3 GLU A 90 -11.478 10.769 -3.219 1.00 55.51 H new ATOM 1390 N LEU A 91 -7.486 7.539 -4.194 1.00 23.10 N ATOM 1391 CA LEU A 91 -6.880 6.476 -5.015 1.00 63.43 C ATOM 1392 C LEU A 91 -5.809 5.689 -4.221 1.00 2.54 C ATOM 1393 O LEU A 91 -5.639 4.490 -4.441 1.00 30.11 O ATOM 1394 CB LEU A 91 -6.282 7.084 -6.322 1.00 12.31 C ATOM 1395 CG LEU A 91 -7.301 7.647 -7.366 1.00 71.22 C ATOM 1396 CD1 LEU A 91 -6.572 8.263 -8.591 1.00 73.42 C ATOM 1397 CD2 LEU A 91 -8.292 6.554 -7.800 1.00 2.15 C ATOM 0 H LEU A 91 -7.179 8.477 -4.452 1.00 23.10 H new ATOM 0 HA LEU A 91 -7.661 5.767 -5.289 1.00 63.43 H new ATOM 0 HB2 LEU A 91 -5.602 7.889 -6.043 1.00 12.31 H new ATOM 0 HB3 LEU A 91 -5.683 6.316 -6.811 1.00 12.31 H new ATOM 0 HG LEU A 91 -7.866 8.447 -6.887 1.00 71.22 H new ATOM 0 HD11 LEU A 91 -7.308 8.645 -9.298 1.00 73.42 H new ATOM 0 HD12 LEU A 91 -5.929 9.079 -8.260 1.00 73.42 H new ATOM 0 HD13 LEU A 91 -5.966 7.498 -9.076 1.00 73.42 H new ATOM 0 HD21 LEU A 91 -8.993 6.966 -8.526 1.00 2.15 H new ATOM 0 HD22 LEU A 91 -7.746 5.726 -8.252 1.00 2.15 H new ATOM 0 HD23 LEU A 91 -8.841 6.194 -6.930 1.00 2.15 H new ATOM 1409 N ILE A 92 -5.097 6.379 -3.300 1.00 51.14 N ATOM 1410 CA ILE A 92 -4.122 5.743 -2.376 1.00 32.05 C ATOM 1411 C ILE A 92 -4.868 4.817 -1.382 1.00 41.21 C ATOM 1412 O ILE A 92 -4.458 3.670 -1.154 1.00 14.35 O ATOM 1413 CB ILE A 92 -3.262 6.827 -1.593 1.00 61.24 C ATOM 1414 CG1 ILE A 92 -2.396 7.671 -2.585 1.00 13.12 C ATOM 1415 CG2 ILE A 92 -2.369 6.176 -0.502 1.00 52.31 C ATOM 1416 CD1 ILE A 92 -1.626 8.827 -1.954 1.00 24.31 C ATOM 0 H ILE A 92 -5.180 7.388 -3.175 1.00 51.14 H new ATOM 0 HA ILE A 92 -3.429 5.148 -2.971 1.00 32.05 H new ATOM 0 HB ILE A 92 -3.961 7.494 -1.089 1.00 61.24 H new ATOM 0 HG12 ILE A 92 -1.685 7.007 -3.076 1.00 13.12 H new ATOM 0 HG13 ILE A 92 -3.048 8.071 -3.362 1.00 13.12 H new ATOM 0 HG21 ILE A 92 -1.797 6.950 0.010 1.00 52.31 H new ATOM 0 HG22 ILE A 92 -2.998 5.653 0.218 1.00 52.31 H new ATOM 0 HG23 ILE A 92 -1.684 5.467 -0.968 1.00 52.31 H new ATOM 0 HD11 ILE A 92 -1.058 9.349 -2.724 1.00 24.31 H new ATOM 0 HD12 ILE A 92 -2.327 9.520 -1.488 1.00 24.31 H new ATOM 0 HD13 ILE A 92 -0.942 8.440 -1.199 1.00 24.31 H new ATOM 1428 N LEU A 93 -6.003 5.319 -0.842 1.00 51.54 N ATOM 1429 CA LEU A 93 -6.836 4.593 0.144 1.00 40.52 C ATOM 1430 C LEU A 93 -7.544 3.387 -0.514 1.00 54.01 C ATOM 1431 O LEU A 93 -7.623 2.315 0.087 1.00 21.35 O ATOM 1432 CB LEU A 93 -7.879 5.558 0.798 1.00 15.31 C ATOM 1433 CG LEU A 93 -7.298 6.708 1.693 1.00 31.52 C ATOM 1434 CD1 LEU A 93 -8.422 7.636 2.220 1.00 65.12 C ATOM 1435 CD2 LEU A 93 -6.438 6.147 2.848 1.00 51.23 C ATOM 0 H LEU A 93 -6.367 6.242 -1.079 1.00 51.54 H new ATOM 0 HA LEU A 93 -6.181 4.213 0.928 1.00 40.52 H new ATOM 0 HB2 LEU A 93 -8.472 6.010 0.003 1.00 15.31 H new ATOM 0 HB3 LEU A 93 -8.561 4.963 1.406 1.00 15.31 H new ATOM 0 HG LEU A 93 -6.643 7.312 1.065 1.00 31.52 H new ATOM 0 HD11 LEU A 93 -7.986 8.422 2.837 1.00 65.12 H new ATOM 0 HD12 LEU A 93 -8.948 8.085 1.378 1.00 65.12 H new ATOM 0 HD13 LEU A 93 -9.124 7.054 2.817 1.00 65.12 H new ATOM 0 HD21 LEU A 93 -6.052 6.971 3.448 1.00 51.23 H new ATOM 0 HD22 LEU A 93 -7.049 5.498 3.475 1.00 51.23 H new ATOM 0 HD23 LEU A 93 -5.605 5.576 2.437 1.00 51.23 H new ATOM 1447 N ALA A 94 -8.033 3.581 -1.756 1.00 11.33 N ATOM 1448 CA ALA A 94 -8.750 2.542 -2.533 1.00 0.11 C ATOM 1449 C ALA A 94 -7.808 1.417 -2.981 1.00 21.14 C ATOM 1450 O ALA A 94 -8.182 0.234 -2.989 1.00 2.21 O ATOM 1451 CB ALA A 94 -9.415 3.180 -3.758 1.00 33.13 C ATOM 0 H ALA A 94 -7.942 4.467 -2.253 1.00 11.33 H new ATOM 0 HA ALA A 94 -9.509 2.103 -1.885 1.00 0.11 H new ATOM 0 HB1 ALA A 94 -9.941 2.413 -4.327 1.00 33.13 H new ATOM 0 HB2 ALA A 94 -10.124 3.941 -3.432 1.00 33.13 H new ATOM 0 HB3 ALA A 94 -8.653 3.640 -4.387 1.00 33.13 H new ATOM 1457 N ALA A 95 -6.585 1.811 -3.369 1.00 43.52 N ATOM 1458 CA ALA A 95 -5.533 0.872 -3.781 1.00 52.14 C ATOM 1459 C ALA A 95 -5.043 0.039 -2.591 1.00 33.12 C ATOM 1460 O ALA A 95 -4.799 -1.145 -2.737 1.00 24.20 O ATOM 1461 CB ALA A 95 -4.367 1.618 -4.411 1.00 75.31 C ATOM 0 H ALA A 95 -6.299 2.789 -3.406 1.00 43.52 H new ATOM 0 HA ALA A 95 -5.960 0.196 -4.522 1.00 52.14 H new ATOM 0 HB1 ALA A 95 -3.598 0.906 -4.710 1.00 75.31 H new ATOM 0 HB2 ALA A 95 -4.716 2.164 -5.287 1.00 75.31 H new ATOM 0 HB3 ALA A 95 -3.951 2.319 -3.688 1.00 75.31 H new ATOM 1467 N ASN A 96 -4.899 0.689 -1.417 1.00 31.44 N ATOM 1468 CA ASN A 96 -4.499 0.013 -0.156 1.00 72.33 C ATOM 1469 C ASN A 96 -5.647 -0.895 0.358 1.00 40.14 C ATOM 1470 O ASN A 96 -5.408 -1.959 0.942 1.00 14.12 O ATOM 1471 CB ASN A 96 -4.103 1.077 0.917 1.00 33.24 C ATOM 1472 CG ASN A 96 -3.607 0.482 2.250 1.00 10.24 C ATOM 1473 OD1 ASN A 96 -3.032 -0.608 2.295 1.00 15.20 O ATOM 1474 ND2 ASN A 96 -3.803 1.205 3.343 1.00 55.13 N ATOM 0 H ASN A 96 -5.055 1.692 -1.312 1.00 31.44 H new ATOM 0 HA ASN A 96 -3.632 -0.619 -0.350 1.00 72.33 H new ATOM 0 HB2 ASN A 96 -3.322 1.717 0.506 1.00 33.24 H new ATOM 0 HB3 ASN A 96 -4.965 1.714 1.116 1.00 33.24 H new ATOM 0 HD21 ASN A 96 -3.476 0.863 4.246 1.00 55.13 H new ATOM 0 HD22 ASN A 96 -4.281 2.104 3.281 1.00 55.13 H new ATOM 1481 N TYR A 97 -6.889 -0.448 0.091 1.00 4.34 N ATOM 1482 CA TYR A 97 -8.132 -1.162 0.469 1.00 72.42 C ATOM 1483 C TYR A 97 -8.220 -2.534 -0.228 1.00 74.35 C ATOM 1484 O TYR A 97 -8.579 -3.535 0.400 1.00 13.44 O ATOM 1485 CB TYR A 97 -9.366 -0.275 0.115 1.00 30.32 C ATOM 1486 CG TYR A 97 -10.740 -0.910 0.374 1.00 3.11 C ATOM 1487 CD1 TYR A 97 -11.625 -1.177 -0.676 1.00 35.43 C ATOM 1488 CD2 TYR A 97 -11.148 -1.246 1.665 1.00 43.32 C ATOM 1489 CE1 TYR A 97 -12.854 -1.756 -0.445 1.00 32.13 C ATOM 1490 CE2 TYR A 97 -12.381 -1.826 1.897 1.00 33.51 C ATOM 1491 CZ TYR A 97 -13.228 -2.078 0.839 1.00 51.40 C ATOM 1492 OH TYR A 97 -14.459 -2.653 1.071 1.00 72.02 O ATOM 0 H TYR A 97 -7.064 0.429 -0.399 1.00 4.34 H new ATOM 0 HA TYR A 97 -8.121 -1.346 1.543 1.00 72.42 H new ATOM 0 HB2 TYR A 97 -9.301 0.651 0.687 1.00 30.32 H new ATOM 0 HB3 TYR A 97 -9.305 -0.004 -0.939 1.00 30.32 H new ATOM 0 HD1 TYR A 97 -11.340 -0.925 -1.687 1.00 35.43 H new ATOM 0 HD2 TYR A 97 -10.489 -1.050 2.498 1.00 43.32 H new ATOM 0 HE1 TYR A 97 -13.522 -1.956 -1.270 1.00 32.13 H new ATOM 0 HE2 TYR A 97 -12.680 -2.081 2.903 1.00 33.51 H new ATOM 0 HH TYR A 97 -14.567 -2.819 2.031 1.00 72.02 H new ATOM 1502 N LEU A 98 -7.894 -2.571 -1.534 1.00 63.00 N ATOM 1503 CA LEU A 98 -7.922 -3.817 -2.337 1.00 30.20 C ATOM 1504 C LEU A 98 -6.518 -4.443 -2.477 1.00 31.43 C ATOM 1505 O LEU A 98 -6.389 -5.558 -2.994 1.00 23.42 O ATOM 1506 CB LEU A 98 -8.550 -3.541 -3.730 1.00 42.31 C ATOM 1507 CG LEU A 98 -10.025 -3.031 -3.726 1.00 3.34 C ATOM 1508 CD1 LEU A 98 -10.564 -2.847 -5.167 1.00 55.24 C ATOM 1509 CD2 LEU A 98 -10.929 -3.968 -2.893 1.00 41.33 C ATOM 0 H LEU A 98 -7.606 -1.748 -2.062 1.00 63.00 H new ATOM 0 HA LEU A 98 -8.542 -4.542 -1.809 1.00 30.20 H new ATOM 0 HB2 LEU A 98 -7.933 -2.805 -4.245 1.00 42.31 H new ATOM 0 HB3 LEU A 98 -8.506 -4.460 -4.315 1.00 42.31 H new ATOM 0 HG LEU A 98 -10.040 -2.050 -3.252 1.00 3.34 H new ATOM 0 HD11 LEU A 98 -11.593 -2.491 -5.128 1.00 55.24 H new ATOM 0 HD12 LEU A 98 -9.948 -2.119 -5.696 1.00 55.24 H new ATOM 0 HD13 LEU A 98 -10.530 -3.801 -5.693 1.00 55.24 H new ATOM 0 HD21 LEU A 98 -11.952 -3.592 -2.905 1.00 41.33 H new ATOM 0 HD22 LEU A 98 -10.906 -4.970 -3.320 1.00 41.33 H new ATOM 0 HD23 LEU A 98 -10.568 -4.003 -1.865 1.00 41.33 H new ATOM 1521 N ASP A 99 -5.504 -3.737 -1.956 1.00 21.14 N ATOM 1522 CA ASP A 99 -4.064 -4.073 -2.100 1.00 70.43 C ATOM 1523 C ASP A 99 -3.677 -4.300 -3.583 1.00 20.13 C ATOM 1524 O ASP A 99 -3.091 -5.324 -3.962 1.00 62.00 O ATOM 1525 CB ASP A 99 -3.638 -5.254 -1.182 1.00 43.23 C ATOM 1526 CG ASP A 99 -2.103 -5.421 -1.066 1.00 53.34 C ATOM 1527 OD1 ASP A 99 -1.375 -4.405 -1.014 1.00 70.44 O ATOM 1528 OD2 ASP A 99 -1.614 -6.561 -0.978 1.00 63.10 O ATOM 0 H ASP A 99 -5.658 -2.892 -1.406 1.00 21.14 H new ATOM 0 HA ASP A 99 -3.497 -3.208 -1.756 1.00 70.43 H new ATOM 0 HB2 ASP A 99 -4.055 -5.100 -0.187 1.00 43.23 H new ATOM 0 HB3 ASP A 99 -4.068 -6.178 -1.568 1.00 43.23 H new ATOM 1533 N ILE A 100 -4.071 -3.327 -4.418 1.00 31.04 N ATOM 1534 CA ILE A 100 -3.662 -3.229 -5.826 1.00 12.44 C ATOM 1535 C ILE A 100 -2.353 -2.439 -5.890 1.00 41.14 C ATOM 1536 O ILE A 100 -2.355 -1.203 -5.943 1.00 23.21 O ATOM 1537 CB ILE A 100 -4.775 -2.558 -6.716 1.00 33.00 C ATOM 1538 CG1 ILE A 100 -6.094 -3.364 -6.565 1.00 25.03 C ATOM 1539 CG2 ILE A 100 -4.321 -2.451 -8.201 1.00 20.44 C ATOM 1540 CD1 ILE A 100 -7.290 -2.848 -7.333 1.00 62.14 C ATOM 0 H ILE A 100 -4.694 -2.573 -4.128 1.00 31.04 H new ATOM 0 HA ILE A 100 -3.514 -4.231 -6.228 1.00 12.44 H new ATOM 0 HB ILE A 100 -4.949 -1.537 -6.376 1.00 33.00 H new ATOM 0 HG12 ILE A 100 -5.904 -4.391 -6.878 1.00 25.03 H new ATOM 0 HG13 ILE A 100 -6.355 -3.396 -5.507 1.00 25.03 H new ATOM 0 HG21 ILE A 100 -5.110 -1.984 -8.790 1.00 20.44 H new ATOM 0 HG22 ILE A 100 -3.416 -1.846 -8.262 1.00 20.44 H new ATOM 0 HG23 ILE A 100 -4.118 -3.448 -8.592 1.00 20.44 H new ATOM 0 HD11 ILE A 100 -8.148 -3.494 -7.147 1.00 62.14 H new ATOM 0 HD12 ILE A 100 -7.522 -1.834 -7.007 1.00 62.14 H new ATOM 0 HD13 ILE A 100 -7.064 -2.844 -8.399 1.00 62.14 H new ATOM 1552 N LYS A 101 -1.253 -3.192 -5.838 1.00 41.44 N ATOM 1553 CA LYS A 101 0.126 -2.666 -5.827 1.00 31.22 C ATOM 1554 C LYS A 101 0.487 -1.878 -7.121 1.00 15.41 C ATOM 1555 O LYS A 101 1.119 -0.823 -7.005 1.00 64.13 O ATOM 1556 CB LYS A 101 1.134 -3.826 -5.593 1.00 74.33 C ATOM 1557 CG LYS A 101 0.755 -4.726 -4.405 1.00 52.10 C ATOM 1558 CD LYS A 101 1.783 -5.849 -4.137 1.00 21.34 C ATOM 1559 CE LYS A 101 1.342 -6.774 -2.999 1.00 21.00 C ATOM 1560 NZ LYS A 101 1.029 -6.005 -1.777 1.00 21.24 N ATOM 0 H LYS A 101 -1.290 -4.211 -5.801 1.00 41.44 H new ATOM 0 HA LYS A 101 0.191 -1.953 -5.005 1.00 31.22 H new ATOM 0 HB2 LYS A 101 1.195 -4.433 -6.496 1.00 74.33 H new ATOM 0 HB3 LYS A 101 2.126 -3.408 -5.422 1.00 74.33 H new ATOM 0 HG2 LYS A 101 0.656 -4.112 -3.510 1.00 52.10 H new ATOM 0 HG3 LYS A 101 -0.221 -5.174 -4.594 1.00 52.10 H new ATOM 0 HD2 LYS A 101 1.925 -6.435 -5.045 1.00 21.34 H new ATOM 0 HD3 LYS A 101 2.748 -5.406 -3.890 1.00 21.34 H new ATOM 0 HE2 LYS A 101 0.465 -7.343 -3.308 1.00 21.00 H new ATOM 0 HE3 LYS A 101 2.131 -7.495 -2.786 1.00 21.00 H new ATOM 0 HZ1 LYS A 101 1.384 -6.517 -0.944 1.00 21.24 H new ATOM 0 HZ2 LYS A 101 1.483 -5.071 -1.829 1.00 21.24 H new ATOM 0 HZ3 LYS A 101 -0.001 -5.885 -1.696 1.00 21.24 H new ATOM 1574 N PRO A 102 0.114 -2.362 -8.381 1.00 11.52 N ATOM 1575 CA PRO A 102 0.340 -1.581 -9.639 1.00 4.32 C ATOM 1576 C PRO A 102 -0.227 -0.134 -9.580 1.00 14.24 C ATOM 1577 O PRO A 102 0.427 0.803 -10.042 1.00 11.42 O ATOM 1578 CB PRO A 102 -0.363 -2.430 -10.751 1.00 45.12 C ATOM 1579 CG PRO A 102 -1.188 -3.456 -10.021 1.00 53.12 C ATOM 1580 CD PRO A 102 -0.463 -3.710 -8.722 1.00 3.21 C ATOM 0 HA PRO A 102 1.404 -1.434 -9.824 1.00 4.32 H new ATOM 0 HB2 PRO A 102 -0.990 -1.803 -11.385 1.00 45.12 H new ATOM 0 HB3 PRO A 102 0.370 -2.908 -11.401 1.00 45.12 H new ATOM 0 HG2 PRO A 102 -2.199 -3.090 -9.841 1.00 53.12 H new ATOM 0 HG3 PRO A 102 -1.280 -4.372 -10.604 1.00 53.12 H new ATOM 0 HD2 PRO A 102 -1.140 -4.066 -7.946 1.00 3.21 H new ATOM 0 HD3 PRO A 102 0.316 -4.464 -8.836 1.00 3.21 H new ATOM 1588 N LEU A 103 -1.433 0.038 -9.005 1.00 51.21 N ATOM 1589 CA LEU A 103 -2.097 1.361 -8.918 1.00 64.54 C ATOM 1590 C LEU A 103 -1.526 2.163 -7.734 1.00 72.01 C ATOM 1591 O LEU A 103 -1.247 3.362 -7.872 1.00 11.35 O ATOM 1592 CB LEU A 103 -3.651 1.191 -8.814 1.00 2.42 C ATOM 1593 CG LEU A 103 -4.548 2.489 -8.967 1.00 31.13 C ATOM 1594 CD1 LEU A 103 -4.750 3.263 -7.645 1.00 64.34 C ATOM 1595 CD2 LEU A 103 -3.996 3.425 -10.062 1.00 73.24 C ATOM 0 H LEU A 103 -1.972 -0.723 -8.592 1.00 51.21 H new ATOM 0 HA LEU A 103 -1.894 1.924 -9.829 1.00 64.54 H new ATOM 0 HB2 LEU A 103 -3.962 0.477 -9.577 1.00 2.42 H new ATOM 0 HB3 LEU A 103 -3.875 0.741 -7.847 1.00 2.42 H new ATOM 0 HG LEU A 103 -5.532 2.130 -9.268 1.00 31.13 H new ATOM 0 HD11 LEU A 103 -5.373 4.138 -7.827 1.00 64.34 H new ATOM 0 HD12 LEU A 103 -5.237 2.616 -6.915 1.00 64.34 H new ATOM 0 HD13 LEU A 103 -3.782 3.581 -7.258 1.00 64.34 H new ATOM 0 HD21 LEU A 103 -4.633 4.306 -10.143 1.00 73.24 H new ATOM 0 HD22 LEU A 103 -2.983 3.732 -9.801 1.00 73.24 H new ATOM 0 HD23 LEU A 103 -3.981 2.899 -11.017 1.00 73.24 H new ATOM 1607 N LEU A 104 -1.323 1.467 -6.598 1.00 51.33 N ATOM 1608 CA LEU A 104 -0.859 2.074 -5.334 1.00 74.31 C ATOM 1609 C LEU A 104 0.493 2.770 -5.526 1.00 52.33 C ATOM 1610 O LEU A 104 0.654 3.940 -5.161 1.00 13.31 O ATOM 1611 CB LEU A 104 -0.753 0.985 -4.224 1.00 50.54 C ATOM 1612 CG LEU A 104 -0.334 1.472 -2.800 1.00 73.24 C ATOM 1613 CD1 LEU A 104 -1.305 2.549 -2.250 1.00 22.04 C ATOM 1614 CD2 LEU A 104 -0.215 0.271 -1.836 1.00 65.34 C ATOM 0 H LEU A 104 -1.477 0.461 -6.531 1.00 51.33 H new ATOM 0 HA LEU A 104 -1.587 2.825 -5.026 1.00 74.31 H new ATOM 0 HB2 LEU A 104 -1.719 0.487 -4.143 1.00 50.54 H new ATOM 0 HB3 LEU A 104 -0.034 0.234 -4.552 1.00 50.54 H new ATOM 0 HG LEU A 104 0.645 1.945 -2.880 1.00 73.24 H new ATOM 0 HD11 LEU A 104 -0.978 2.861 -1.258 1.00 22.04 H new ATOM 0 HD12 LEU A 104 -1.309 3.410 -2.918 1.00 22.04 H new ATOM 0 HD13 LEU A 104 -2.311 2.134 -2.187 1.00 22.04 H new ATOM 0 HD21 LEU A 104 0.078 0.625 -0.848 1.00 65.34 H new ATOM 0 HD22 LEU A 104 -1.176 -0.238 -1.769 1.00 65.34 H new ATOM 0 HD23 LEU A 104 0.538 -0.423 -2.210 1.00 65.34 H new ATOM 1626 N ASP A 105 1.428 2.037 -6.159 1.00 24.44 N ATOM 1627 CA ASP A 105 2.799 2.503 -6.413 1.00 35.45 C ATOM 1628 C ASP A 105 2.782 3.767 -7.284 1.00 24.54 C ATOM 1629 O ASP A 105 3.358 4.785 -6.917 1.00 14.11 O ATOM 1630 CB ASP A 105 3.631 1.388 -7.104 1.00 15.52 C ATOM 1631 CG ASP A 105 5.106 1.791 -7.314 1.00 71.03 C ATOM 1632 OD1 ASP A 105 5.446 2.363 -8.378 1.00 52.02 O ATOM 1633 OD2 ASP A 105 5.929 1.567 -6.400 1.00 54.44 O ATOM 0 H ASP A 105 1.249 1.096 -6.511 1.00 24.44 H new ATOM 0 HA ASP A 105 3.264 2.744 -5.457 1.00 35.45 H new ATOM 0 HB2 ASP A 105 3.588 0.481 -6.500 1.00 15.52 H new ATOM 0 HB3 ASP A 105 3.182 1.150 -8.069 1.00 15.52 H new ATOM 1638 N VAL A 106 2.064 3.684 -8.416 1.00 5.33 N ATOM 1639 CA VAL A 106 2.001 4.770 -9.412 1.00 62.24 C ATOM 1640 C VAL A 106 1.362 6.054 -8.826 1.00 32.42 C ATOM 1641 O VAL A 106 1.870 7.154 -9.063 1.00 0.33 O ATOM 1642 CB VAL A 106 1.245 4.295 -10.713 1.00 0.33 C ATOM 1643 CG1 VAL A 106 1.033 5.443 -11.731 1.00 74.22 C ATOM 1644 CG2 VAL A 106 2.010 3.121 -11.365 1.00 55.42 C ATOM 0 H VAL A 106 1.511 2.864 -8.668 1.00 5.33 H new ATOM 0 HA VAL A 106 3.025 5.022 -9.688 1.00 62.24 H new ATOM 0 HB VAL A 106 0.253 3.960 -10.411 1.00 0.33 H new ATOM 0 HG11 VAL A 106 0.509 5.061 -12.607 1.00 74.22 H new ATOM 0 HG12 VAL A 106 0.441 6.233 -11.270 1.00 74.22 H new ATOM 0 HG13 VAL A 106 2.000 5.844 -12.034 1.00 74.22 H new ATOM 0 HG21 VAL A 106 1.483 2.797 -12.263 1.00 55.42 H new ATOM 0 HG22 VAL A 106 3.016 3.445 -11.632 1.00 55.42 H new ATOM 0 HG23 VAL A 106 2.071 2.291 -10.661 1.00 55.42 H new ATOM 1654 N THR A 107 0.291 5.899 -8.021 1.00 13.35 N ATOM 1655 CA THR A 107 -0.405 7.048 -7.384 1.00 55.22 C ATOM 1656 C THR A 107 0.476 7.687 -6.277 1.00 65.11 C ATOM 1657 O THR A 107 0.504 8.918 -6.115 1.00 4.33 O ATOM 1658 CB THR A 107 -1.799 6.617 -6.801 1.00 41.42 C ATOM 1659 OG1 THR A 107 -2.565 5.947 -7.817 1.00 33.12 O ATOM 1660 CG2 THR A 107 -2.613 7.824 -6.298 1.00 34.13 C ATOM 0 H THR A 107 -0.115 4.991 -7.793 1.00 13.35 H new ATOM 0 HA THR A 107 -0.580 7.797 -8.157 1.00 55.22 H new ATOM 0 HB THR A 107 -1.604 5.953 -5.959 1.00 41.42 H new ATOM 0 HG1 THR A 107 -2.218 5.039 -7.943 1.00 33.12 H new ATOM 0 HG21 THR A 107 -3.569 7.479 -5.904 1.00 34.13 H new ATOM 0 HG22 THR A 107 -2.058 8.334 -5.510 1.00 34.13 H new ATOM 0 HG23 THR A 107 -2.789 8.514 -7.123 1.00 34.13 H new ATOM 1668 N CYS A 108 1.228 6.833 -5.552 1.00 21.02 N ATOM 1669 CA CYS A 108 2.209 7.278 -4.540 1.00 21.23 C ATOM 1670 C CYS A 108 3.417 7.962 -5.215 1.00 24.00 C ATOM 1671 O CYS A 108 4.059 8.830 -4.623 1.00 13.21 O ATOM 1672 CB CYS A 108 2.669 6.091 -3.665 1.00 73.35 C ATOM 1673 SG CYS A 108 1.332 5.335 -2.714 1.00 15.32 S ATOM 0 H CYS A 108 1.173 5.819 -5.651 1.00 21.02 H new ATOM 0 HA CYS A 108 1.723 8.008 -3.892 1.00 21.23 H new ATOM 0 HB2 CYS A 108 3.123 5.333 -4.304 1.00 73.35 H new ATOM 0 HB3 CYS A 108 3.443 6.434 -2.979 1.00 73.35 H new ATOM 0 HG CYS A 108 0.658 4.528 -3.478 1.00 15.32 H new ATOM 1679 N LYS A 109 3.723 7.545 -6.455 1.00 72.01 N ATOM 1680 CA LYS A 109 4.754 8.188 -7.294 1.00 43.00 C ATOM 1681 C LYS A 109 4.232 9.521 -7.869 1.00 71.35 C ATOM 1682 O LYS A 109 5.012 10.442 -8.066 1.00 2.54 O ATOM 1683 CB LYS A 109 5.267 7.215 -8.417 1.00 10.42 C ATOM 1684 CG LYS A 109 6.542 6.402 -8.045 1.00 0.20 C ATOM 1685 CD LYS A 109 6.425 5.647 -6.695 1.00 3.33 C ATOM 1686 CE LYS A 109 7.676 4.820 -6.359 1.00 54.35 C ATOM 1687 NZ LYS A 109 7.901 3.743 -7.353 1.00 35.24 N ATOM 0 H LYS A 109 3.264 6.753 -6.906 1.00 72.01 H new ATOM 0 HA LYS A 109 5.614 8.419 -6.666 1.00 43.00 H new ATOM 0 HB2 LYS A 109 4.468 6.517 -8.666 1.00 10.42 H new ATOM 0 HB3 LYS A 109 5.473 7.797 -9.315 1.00 10.42 H new ATOM 0 HG2 LYS A 109 6.748 5.683 -8.837 1.00 0.20 H new ATOM 0 HG3 LYS A 109 7.395 7.080 -8.000 1.00 0.20 H new ATOM 0 HD2 LYS A 109 6.247 6.367 -5.896 1.00 3.33 H new ATOM 0 HD3 LYS A 109 5.558 4.987 -6.728 1.00 3.33 H new ATOM 0 HE2 LYS A 109 8.547 5.474 -6.327 1.00 54.35 H new ATOM 0 HE3 LYS A 109 7.568 4.383 -5.366 1.00 54.35 H new ATOM 0 HZ1 LYS A 109 8.294 2.907 -6.876 1.00 35.24 H new ATOM 0 HZ2 LYS A 109 6.998 3.492 -7.803 1.00 35.24 H new ATOM 0 HZ3 LYS A 109 8.569 4.074 -8.078 1.00 35.24 H new ATOM 1701 N THR A 110 2.906 9.611 -8.126 1.00 11.23 N ATOM 1702 CA THR A 110 2.257 10.834 -8.656 1.00 31.42 C ATOM 1703 C THR A 110 2.332 11.987 -7.631 1.00 65.52 C ATOM 1704 O THR A 110 2.682 13.125 -7.981 1.00 22.50 O ATOM 1705 CB THR A 110 0.766 10.554 -9.042 1.00 44.22 C ATOM 1706 OG1 THR A 110 0.706 9.511 -10.025 1.00 43.22 O ATOM 1707 CG2 THR A 110 0.051 11.809 -9.587 1.00 31.13 C ATOM 0 H THR A 110 2.257 8.839 -7.972 1.00 11.23 H new ATOM 0 HA THR A 110 2.798 11.132 -9.554 1.00 31.42 H new ATOM 0 HB THR A 110 0.251 10.249 -8.131 1.00 44.22 H new ATOM 0 HG1 THR A 110 1.106 8.694 -9.660 1.00 43.22 H new ATOM 0 HG21 THR A 110 -0.980 11.560 -9.839 1.00 31.13 H new ATOM 0 HG22 THR A 110 0.060 12.591 -8.828 1.00 31.13 H new ATOM 0 HG23 THR A 110 0.567 12.163 -10.479 1.00 31.13 H new ATOM 1715 N VAL A 111 2.017 11.674 -6.359 1.00 3.11 N ATOM 1716 CA VAL A 111 2.132 12.644 -5.254 1.00 14.23 C ATOM 1717 C VAL A 111 3.623 12.965 -4.972 1.00 44.30 C ATOM 1718 O VAL A 111 3.962 14.094 -4.599 1.00 32.11 O ATOM 1719 CB VAL A 111 1.369 12.168 -3.953 1.00 15.33 C ATOM 1720 CG1 VAL A 111 -0.151 12.012 -4.220 1.00 45.33 C ATOM 1721 CG2 VAL A 111 1.959 10.865 -3.382 1.00 52.42 C ATOM 0 H VAL A 111 1.680 10.755 -6.072 1.00 3.11 H new ATOM 0 HA VAL A 111 1.641 13.565 -5.567 1.00 14.23 H new ATOM 0 HB VAL A 111 1.507 12.945 -3.202 1.00 15.33 H new ATOM 0 HG11 VAL A 111 -0.649 11.684 -3.308 1.00 45.33 H new ATOM 0 HG12 VAL A 111 -0.565 12.970 -4.535 1.00 45.33 H new ATOM 0 HG13 VAL A 111 -0.308 11.273 -5.005 1.00 45.33 H new ATOM 0 HG21 VAL A 111 1.405 10.575 -2.489 1.00 52.42 H new ATOM 0 HG22 VAL A 111 1.884 10.074 -4.128 1.00 52.42 H new ATOM 0 HG23 VAL A 111 3.006 11.022 -3.124 1.00 52.42 H new ATOM 1731 N ALA A 112 4.503 11.960 -5.191 1.00 43.35 N ATOM 1732 CA ALA A 112 5.970 12.134 -5.114 1.00 34.31 C ATOM 1733 C ALA A 112 6.506 12.977 -6.295 1.00 50.54 C ATOM 1734 O ALA A 112 7.558 13.604 -6.179 1.00 24.44 O ATOM 1735 CB ALA A 112 6.675 10.771 -5.055 1.00 32.04 C ATOM 0 H ALA A 112 4.216 11.010 -5.425 1.00 43.35 H new ATOM 0 HA ALA A 112 6.190 12.678 -4.195 1.00 34.31 H new ATOM 0 HB1 ALA A 112 7.753 10.921 -4.999 1.00 32.04 H new ATOM 0 HB2 ALA A 112 6.338 10.225 -4.174 1.00 32.04 H new ATOM 0 HB3 ALA A 112 6.435 10.198 -5.951 1.00 32.04 H new ATOM 1741 N ASN A 113 5.775 12.985 -7.433 1.00 53.02 N ATOM 1742 CA ASN A 113 6.135 13.810 -8.615 1.00 32.55 C ATOM 1743 C ASN A 113 5.972 15.313 -8.311 1.00 14.23 C ATOM 1744 O ASN A 113 6.665 16.146 -8.903 1.00 41.51 O ATOM 1745 CB ASN A 113 5.320 13.416 -9.898 1.00 74.15 C ATOM 1746 CG ASN A 113 6.008 12.337 -10.756 1.00 71.21 C ATOM 1747 OD1 ASN A 113 6.899 12.648 -11.542 1.00 70.10 O ATOM 1748 ND2 ASN A 113 5.570 11.087 -10.669 1.00 23.51 N ATOM 0 H ASN A 113 4.930 12.429 -7.560 1.00 53.02 H new ATOM 0 HA ASN A 113 7.184 13.606 -8.828 1.00 32.55 H new ATOM 0 HB2 ASN A 113 4.336 13.057 -9.597 1.00 74.15 H new ATOM 0 HB3 ASN A 113 5.162 14.307 -10.506 1.00 74.15 H new ATOM 0 HD21 ASN A 113 5.975 10.362 -11.262 1.00 23.51 H new ATOM 0 HD22 ASN A 113 4.829 10.851 -10.009 1.00 23.51 H new ATOM 1755 N MET A 114 5.077 15.645 -7.366 1.00 20.14 N ATOM 1756 CA MET A 114 4.825 17.043 -6.956 1.00 62.32 C ATOM 1757 C MET A 114 6.003 17.600 -6.122 1.00 75.15 C ATOM 1758 O MET A 114 6.269 18.809 -6.137 1.00 42.34 O ATOM 1759 CB MET A 114 3.487 17.144 -6.175 1.00 74.31 C ATOM 1760 CG MET A 114 2.258 16.682 -6.979 1.00 14.43 C ATOM 1761 SD MET A 114 0.683 17.099 -6.187 1.00 63.23 S ATOM 1762 CE MET A 114 0.750 16.142 -4.673 1.00 62.43 C ATOM 0 H MET A 114 4.510 14.960 -6.866 1.00 20.14 H new ATOM 0 HA MET A 114 4.743 17.654 -7.855 1.00 62.32 H new ATOM 0 HB2 MET A 114 3.561 16.545 -5.268 1.00 74.31 H new ATOM 0 HB3 MET A 114 3.337 18.178 -5.863 1.00 74.31 H new ATOM 0 HG2 MET A 114 2.290 17.136 -7.970 1.00 14.43 H new ATOM 0 HG3 MET A 114 2.310 15.603 -7.121 1.00 14.43 H new ATOM 0 HE1 MET A 114 -0.077 15.433 -4.654 1.00 62.43 H new ATOM 0 HE2 MET A 114 1.694 15.599 -4.627 1.00 62.43 H new ATOM 0 HE3 MET A 114 0.674 16.811 -3.816 1.00 62.43 H new ATOM 1772 N ILE A 115 6.706 16.702 -5.401 1.00 33.34 N ATOM 1773 CA ILE A 115 7.913 17.050 -4.612 1.00 3.42 C ATOM 1774 C ILE A 115 9.212 16.635 -5.344 1.00 0.40 C ATOM 1775 O ILE A 115 10.310 16.892 -4.839 1.00 52.50 O ATOM 1776 CB ILE A 115 7.877 16.405 -3.169 1.00 0.33 C ATOM 1777 CG1 ILE A 115 7.793 14.848 -3.238 1.00 4.14 C ATOM 1778 CG2 ILE A 115 6.710 16.989 -2.340 1.00 13.14 C ATOM 1779 CD1 ILE A 115 7.836 14.129 -1.895 1.00 63.33 C ATOM 0 H ILE A 115 6.455 15.715 -5.347 1.00 33.34 H new ATOM 0 HA ILE A 115 7.910 18.134 -4.502 1.00 3.42 H new ATOM 0 HB ILE A 115 8.812 16.657 -2.669 1.00 0.33 H new ATOM 0 HG12 ILE A 115 6.870 14.574 -3.748 1.00 4.14 H new ATOM 0 HG13 ILE A 115 8.617 14.484 -3.852 1.00 4.14 H new ATOM 0 HG21 ILE A 115 6.702 16.532 -1.350 1.00 13.14 H new ATOM 0 HG22 ILE A 115 6.838 18.067 -2.241 1.00 13.14 H new ATOM 0 HG23 ILE A 115 5.766 16.780 -2.843 1.00 13.14 H new ATOM 0 HD11 ILE A 115 7.771 13.053 -2.056 1.00 63.33 H new ATOM 0 HD12 ILE A 115 8.771 14.364 -1.386 1.00 63.33 H new ATOM 0 HD13 ILE A 115 6.997 14.455 -1.281 1.00 63.33 H new ATOM 1791 N ARG A 116 9.068 16.003 -6.530 1.00 14.42 N ATOM 1792 CA ARG A 116 10.196 15.461 -7.329 1.00 2.34 C ATOM 1793 C ARG A 116 11.194 16.572 -7.710 1.00 51.22 C ATOM 1794 O ARG A 116 10.944 17.364 -8.625 1.00 45.01 O ATOM 1795 CB ARG A 116 9.650 14.752 -8.605 1.00 2.32 C ATOM 1796 CG ARG A 116 10.700 14.049 -9.504 1.00 31.32 C ATOM 1797 CD ARG A 116 11.381 12.855 -8.813 1.00 12.54 C ATOM 1798 NE ARG A 116 12.317 12.157 -9.706 1.00 33.10 N ATOM 1799 CZ ARG A 116 13.301 11.332 -9.311 1.00 51.20 C ATOM 1800 NH1 ARG A 116 13.534 11.104 -8.018 1.00 41.41 N ATOM 1801 NH2 ARG A 116 14.070 10.763 -10.224 1.00 52.31 N ATOM 0 H ARG A 116 8.158 15.852 -6.966 1.00 14.42 H new ATOM 0 HA ARG A 116 10.730 14.732 -6.719 1.00 2.34 H new ATOM 0 HB2 ARG A 116 8.914 14.010 -8.295 1.00 2.32 H new ATOM 0 HB3 ARG A 116 9.124 15.492 -9.208 1.00 2.32 H new ATOM 0 HG2 ARG A 116 10.216 13.705 -10.418 1.00 31.32 H new ATOM 0 HG3 ARG A 116 11.460 14.772 -9.799 1.00 31.32 H new ATOM 0 HD2 ARG A 116 11.916 13.205 -7.930 1.00 12.54 H new ATOM 0 HD3 ARG A 116 10.620 12.155 -8.468 1.00 12.54 H new ATOM 0 HE ARG A 116 12.211 12.312 -10.709 1.00 33.10 H new ATOM 0 HH11 ARG A 116 12.960 11.559 -7.308 1.00 41.41 H new ATOM 0 HH12 ARG A 116 14.286 10.474 -7.739 1.00 41.41 H new ATOM 0 HH21 ARG A 116 13.912 10.953 -11.214 1.00 52.31 H new ATOM 0 HH22 ARG A 116 14.821 10.134 -9.938 1.00 52.31 H new ATOM 1815 N GLY A 117 12.291 16.647 -6.957 1.00 53.32 N ATOM 1816 CA GLY A 117 13.380 17.586 -7.230 1.00 32.31 C ATOM 1817 C GLY A 117 14.736 16.889 -7.303 1.00 53.41 C ATOM 1818 O GLY A 117 14.789 15.718 -7.738 1.00 52.04 O ATOM 1819 OXT GLY A 117 15.761 17.504 -6.927 1.00 37.94 O ATOM 0 H GLY A 117 12.450 16.058 -6.140 1.00 53.32 H new ATOM 0 HA2 GLY A 117 13.187 18.101 -8.171 1.00 32.31 H new ATOM 0 HA3 GLY A 117 13.406 18.347 -6.450 1.00 32.31 H new TER 1823 GLY A 117 ATOM 1824 N SER B 2 16.002 -15.129 15.992 1.00 33.21 N ATOM 1825 CA SER B 2 16.743 -14.822 14.750 1.00 2.32 C ATOM 1826 C SER B 2 16.280 -13.478 14.166 1.00 50.43 C ATOM 1827 O SER B 2 15.089 -13.286 13.866 1.00 71.44 O ATOM 1828 CB SER B 2 16.560 -15.949 13.729 1.00 53.33 C ATOM 1829 OG SER B 2 16.922 -17.206 14.284 1.00 54.24 O ATOM 0 HA SER B 2 17.804 -14.743 14.988 1.00 2.32 H new ATOM 0 HB2 SER B 2 15.522 -15.979 13.399 1.00 53.33 H new ATOM 0 HB3 SER B 2 17.169 -15.748 12.848 1.00 53.33 H new ATOM 0 HG SER B 2 16.692 -17.221 15.237 1.00 54.24 H new ATOM 1837 N LEU B 3 17.239 -12.561 14.016 1.00 74.40 N ATOM 1838 CA LEU B 3 16.988 -11.184 13.586 1.00 21.41 C ATOM 1839 C LEU B 3 17.284 -11.030 12.084 1.00 50.20 C ATOM 1840 O LEU B 3 18.419 -11.275 11.657 1.00 13.13 O ATOM 1841 CB LEU B 3 17.901 -10.234 14.411 1.00 50.32 C ATOM 1842 CG LEU B 3 17.738 -10.315 15.960 1.00 31.41 C ATOM 1843 CD1 LEU B 3 18.890 -9.590 16.671 1.00 13.31 C ATOM 1844 CD2 LEU B 3 16.368 -9.769 16.410 1.00 74.34 C ATOM 0 H LEU B 3 18.224 -12.757 14.192 1.00 74.40 H new ATOM 0 HA LEU B 3 15.941 -10.932 13.753 1.00 21.41 H new ATOM 0 HB2 LEU B 3 18.940 -10.451 14.162 1.00 50.32 H new ATOM 0 HB3 LEU B 3 17.705 -9.209 14.097 1.00 50.32 H new ATOM 0 HG LEU B 3 17.778 -11.366 16.245 1.00 31.41 H new ATOM 0 HD11 LEU B 3 18.753 -9.661 17.750 1.00 13.31 H new ATOM 0 HD12 LEU B 3 19.837 -10.053 16.394 1.00 13.31 H new ATOM 0 HD13 LEU B 3 18.898 -8.541 16.374 1.00 13.31 H new ATOM 0 HD21 LEU B 3 16.287 -9.840 17.495 1.00 74.34 H new ATOM 0 HD22 LEU B 3 16.274 -8.726 16.106 1.00 74.34 H new ATOM 0 HD23 LEU B 3 15.573 -10.354 15.948 1.00 74.34 H new ATOM 1856 N VAL B 4 16.265 -10.655 11.280 1.00 13.23 N ATOM 1857 CA VAL B 4 16.490 -10.230 9.884 1.00 44.30 C ATOM 1858 C VAL B 4 17.200 -8.869 9.898 1.00 61.24 C ATOM 1859 O VAL B 4 16.647 -7.854 10.345 1.00 4.02 O ATOM 1860 CB VAL B 4 15.174 -10.184 9.002 1.00 11.33 C ATOM 1861 CG1 VAL B 4 14.726 -11.609 8.603 1.00 73.25 C ATOM 1862 CG2 VAL B 4 14.032 -9.416 9.709 1.00 3.50 C ATOM 0 H VAL B 4 15.288 -10.638 11.572 1.00 13.23 H new ATOM 0 HA VAL B 4 17.115 -10.984 9.406 1.00 44.30 H new ATOM 0 HB VAL B 4 15.412 -9.636 8.091 1.00 11.33 H new ATOM 0 HG11 VAL B 4 13.821 -11.550 7.998 1.00 73.25 H new ATOM 0 HG12 VAL B 4 15.516 -12.091 8.027 1.00 73.25 H new ATOM 0 HG13 VAL B 4 14.525 -12.192 9.502 1.00 73.25 H new ATOM 0 HG21 VAL B 4 13.149 -9.408 9.070 1.00 3.50 H new ATOM 0 HG22 VAL B 4 13.793 -9.907 10.653 1.00 3.50 H new ATOM 0 HG23 VAL B 4 14.348 -8.391 9.903 1.00 3.50 H new ATOM 1872 N LYS B 5 18.461 -8.891 9.473 1.00 44.33 N ATOM 1873 CA LYS B 5 19.344 -7.732 9.514 1.00 15.12 C ATOM 1874 C LYS B 5 19.056 -6.831 8.303 1.00 32.43 C ATOM 1875 O LYS B 5 19.703 -6.930 7.258 1.00 14.31 O ATOM 1876 CB LYS B 5 20.814 -8.219 9.562 1.00 21.41 C ATOM 1877 CG LYS B 5 21.118 -9.202 10.715 1.00 73.13 C ATOM 1878 CD LYS B 5 22.603 -9.621 10.783 1.00 74.45 C ATOM 1879 CE LYS B 5 22.883 -10.554 11.967 1.00 74.04 C ATOM 1880 NZ LYS B 5 24.324 -10.895 12.085 1.00 63.00 N ATOM 0 H LYS B 5 18.902 -9.725 9.086 1.00 44.33 H new ATOM 0 HA LYS B 5 19.167 -7.136 10.409 1.00 15.12 H new ATOM 0 HB2 LYS B 5 21.056 -8.701 8.615 1.00 21.41 H new ATOM 0 HB3 LYS B 5 21.469 -7.353 9.656 1.00 21.41 H new ATOM 0 HG2 LYS B 5 20.834 -8.741 11.661 1.00 73.13 H new ATOM 0 HG3 LYS B 5 20.501 -10.093 10.596 1.00 73.13 H new ATOM 0 HD2 LYS B 5 22.882 -10.120 9.855 1.00 74.45 H new ATOM 0 HD3 LYS B 5 23.227 -8.731 10.867 1.00 74.45 H new ATOM 0 HE2 LYS B 5 22.547 -10.079 12.889 1.00 74.04 H new ATOM 0 HE3 LYS B 5 22.303 -11.470 11.851 1.00 74.04 H new ATOM 0 HZ1 LYS B 5 24.466 -11.527 12.899 1.00 63.00 H new ATOM 0 HZ2 LYS B 5 24.640 -11.372 11.217 1.00 63.00 H new ATOM 0 HZ3 LYS B 5 24.877 -10.025 12.223 1.00 63.00 H new ATOM 1894 N LEU B 6 18.008 -6.010 8.452 1.00 5.13 N ATOM 1895 CA LEU B 6 17.508 -5.114 7.401 1.00 1.45 C ATOM 1896 C LEU B 6 18.378 -3.862 7.318 1.00 64.23 C ATOM 1897 O LEU B 6 18.100 -2.843 7.961 1.00 13.43 O ATOM 1898 CB LEU B 6 16.024 -4.754 7.677 1.00 24.44 C ATOM 1899 CG LEU B 6 15.044 -5.962 7.750 1.00 63.31 C ATOM 1900 CD1 LEU B 6 13.617 -5.504 8.095 1.00 64.23 C ATOM 1901 CD2 LEU B 6 15.069 -6.797 6.450 1.00 5.20 C ATOM 0 H LEU B 6 17.475 -5.949 9.320 1.00 5.13 H new ATOM 0 HA LEU B 6 17.561 -5.621 6.438 1.00 1.45 H new ATOM 0 HB2 LEU B 6 15.970 -4.207 8.618 1.00 24.44 H new ATOM 0 HB3 LEU B 6 15.681 -4.077 6.895 1.00 24.44 H new ATOM 0 HG LEU B 6 15.387 -6.610 8.557 1.00 63.31 H new ATOM 0 HD11 LEU B 6 12.957 -6.371 8.138 1.00 64.23 H new ATOM 0 HD12 LEU B 6 13.620 -5.001 9.062 1.00 64.23 H new ATOM 0 HD13 LEU B 6 13.261 -4.815 7.329 1.00 64.23 H new ATOM 0 HD21 LEU B 6 14.372 -7.631 6.540 1.00 5.20 H new ATOM 0 HD22 LEU B 6 14.777 -6.169 5.608 1.00 5.20 H new ATOM 0 HD23 LEU B 6 16.075 -7.181 6.284 1.00 5.20 H new ATOM 1913 N GLU B 7 19.471 -3.978 6.563 1.00 13.32 N ATOM 1914 CA GLU B 7 20.396 -2.874 6.343 1.00 43.12 C ATOM 1915 C GLU B 7 19.768 -1.887 5.345 1.00 11.34 C ATOM 1916 O GLU B 7 19.463 -2.265 4.223 1.00 45.45 O ATOM 1917 CB GLU B 7 21.751 -3.410 5.814 1.00 50.13 C ATOM 1918 CG GLU B 7 22.812 -2.316 5.577 1.00 1.02 C ATOM 1919 CD GLU B 7 24.131 -2.853 5.004 1.00 41.44 C ATOM 1920 OE1 GLU B 7 24.260 -2.925 3.763 1.00 24.03 O ATOM 1921 OE2 GLU B 7 25.037 -3.211 5.785 1.00 32.15 O ATOM 0 H GLU B 7 19.737 -4.841 6.088 1.00 13.32 H new ATOM 0 HA GLU B 7 20.586 -2.357 7.284 1.00 43.12 H new ATOM 0 HB2 GLU B 7 22.145 -4.135 6.526 1.00 50.13 H new ATOM 0 HB3 GLU B 7 21.579 -3.943 4.879 1.00 50.13 H new ATOM 0 HG2 GLU B 7 22.406 -1.570 4.894 1.00 1.02 H new ATOM 0 HG3 GLU B 7 23.015 -1.808 6.520 1.00 1.02 H new ATOM 1928 N SER B 8 19.558 -0.642 5.778 1.00 45.02 N ATOM 1929 CA SER B 8 18.984 0.433 4.944 1.00 32.44 C ATOM 1930 C SER B 8 19.947 0.847 3.807 1.00 61.33 C ATOM 1931 O SER B 8 21.089 0.376 3.749 1.00 22.30 O ATOM 1932 CB SER B 8 18.667 1.641 5.858 1.00 20.52 C ATOM 1933 OG SER B 8 19.815 2.046 6.595 1.00 3.34 O ATOM 0 H SER B 8 19.782 -0.342 6.727 1.00 45.02 H new ATOM 0 HA SER B 8 18.072 0.071 4.469 1.00 32.44 H new ATOM 0 HB2 SER B 8 18.308 2.474 5.253 1.00 20.52 H new ATOM 0 HB3 SER B 8 17.864 1.378 6.547 1.00 20.52 H new ATOM 0 HG SER B 8 20.468 2.451 5.987 1.00 3.34 H new ATOM 1939 N SER B 9 19.474 1.737 2.919 1.00 3.35 N ATOM 1940 CA SER B 9 20.305 2.357 1.858 1.00 43.11 C ATOM 1941 C SER B 9 21.415 3.238 2.475 1.00 63.25 C ATOM 1942 O SER B 9 22.476 3.437 1.874 1.00 34.24 O ATOM 1943 CB SER B 9 19.401 3.179 0.901 1.00 24.14 C ATOM 1944 OG SER B 9 18.654 4.157 1.603 1.00 14.44 O ATOM 0 H SER B 9 18.504 2.051 2.911 1.00 3.35 H new ATOM 0 HA SER B 9 20.795 1.571 1.284 1.00 43.11 H new ATOM 0 HB2 SER B 9 20.017 3.665 0.144 1.00 24.14 H new ATOM 0 HB3 SER B 9 18.721 2.508 0.376 1.00 24.14 H new ATOM 0 HG SER B 9 18.096 4.658 0.972 1.00 14.44 H new ATOM 1950 N ASP B 10 21.151 3.732 3.701 1.00 54.25 N ATOM 1951 CA ASP B 10 22.111 4.520 4.510 1.00 32.52 C ATOM 1952 C ASP B 10 23.160 3.603 5.202 1.00 65.43 C ATOM 1953 O ASP B 10 24.059 4.084 5.908 1.00 20.50 O ATOM 1954 CB ASP B 10 21.306 5.349 5.545 1.00 10.45 C ATOM 1955 CG ASP B 10 22.161 6.302 6.410 1.00 55.44 C ATOM 1956 OD1 ASP B 10 22.468 5.966 7.573 1.00 75.22 O ATOM 1957 OD2 ASP B 10 22.518 7.396 5.931 1.00 1.31 O ATOM 0 H ASP B 10 20.254 3.595 4.166 1.00 54.25 H new ATOM 0 HA ASP B 10 22.674 5.191 3.862 1.00 32.52 H new ATOM 0 HB2 ASP B 10 20.555 5.935 5.016 1.00 10.45 H new ATOM 0 HB3 ASP B 10 20.771 4.664 6.203 1.00 10.45 H new ATOM 1962 N GLU B 11 23.018 2.273 4.986 1.00 74.43 N ATOM 1963 CA GLU B 11 23.971 1.224 5.433 1.00 4.40 C ATOM 1964 C GLU B 11 23.894 0.940 6.951 1.00 53.32 C ATOM 1965 O GLU B 11 24.760 0.241 7.491 1.00 50.35 O ATOM 1966 CB GLU B 11 25.435 1.534 4.994 1.00 30.32 C ATOM 1967 CG GLU B 11 25.640 1.655 3.470 1.00 34.22 C ATOM 1968 CD GLU B 11 27.093 1.991 3.083 1.00 74.41 C ATOM 1969 OE1 GLU B 11 27.914 1.056 2.939 1.00 54.51 O ATOM 1970 OE2 GLU B 11 27.420 3.188 2.929 1.00 55.03 O ATOM 0 H GLU B 11 22.218 1.889 4.484 1.00 74.43 H new ATOM 0 HA GLU B 11 23.657 0.311 4.927 1.00 4.40 H new ATOM 0 HB2 GLU B 11 25.751 2.465 5.464 1.00 30.32 H new ATOM 0 HB3 GLU B 11 26.088 0.748 5.373 1.00 30.32 H new ATOM 0 HG2 GLU B 11 25.351 0.718 2.994 1.00 34.22 H new ATOM 0 HG3 GLU B 11 24.978 2.428 3.080 1.00 34.22 H new ATOM 1977 N LYS B 12 22.854 1.457 7.629 1.00 43.41 N ATOM 1978 CA LYS B 12 22.586 1.131 9.046 1.00 52.24 C ATOM 1979 C LYS B 12 21.757 -0.160 9.127 1.00 34.02 C ATOM 1980 O LYS B 12 20.679 -0.249 8.537 1.00 65.22 O ATOM 1981 CB LYS B 12 21.871 2.313 9.770 1.00 10.44 C ATOM 1982 CG LYS B 12 22.796 3.516 10.060 1.00 65.25 C ATOM 1983 CD LYS B 12 22.115 4.621 10.902 1.00 61.22 C ATOM 1984 CE LYS B 12 23.072 5.769 11.260 1.00 42.40 C ATOM 1985 NZ LYS B 12 23.635 6.431 10.053 1.00 35.42 N ATOM 0 H LYS B 12 22.182 2.105 7.219 1.00 43.41 H new ATOM 0 HA LYS B 12 23.534 0.971 9.559 1.00 52.24 H new ATOM 0 HB2 LYS B 12 21.034 2.649 9.158 1.00 10.44 H new ATOM 0 HB3 LYS B 12 21.454 1.952 10.710 1.00 10.44 H new ATOM 0 HG2 LYS B 12 23.684 3.164 10.585 1.00 65.25 H new ATOM 0 HG3 LYS B 12 23.132 3.944 9.115 1.00 65.25 H new ATOM 0 HD2 LYS B 12 21.265 5.021 10.349 1.00 61.22 H new ATOM 0 HD3 LYS B 12 21.721 4.183 11.819 1.00 61.22 H new ATOM 0 HE2 LYS B 12 22.542 6.507 11.862 1.00 42.40 H new ATOM 0 HE3 LYS B 12 23.886 5.383 11.873 1.00 42.40 H new ATOM 0 HZ1 LYS B 12 23.703 7.455 10.219 1.00 35.42 H new ATOM 0 HZ2 LYS B 12 24.582 6.048 9.857 1.00 35.42 H new ATOM 0 HZ3 LYS B 12 23.014 6.253 9.238 1.00 35.42 H new ATOM 1999 N VAL B 13 22.287 -1.149 9.862 1.00 54.22 N ATOM 2000 CA VAL B 13 21.734 -2.508 9.933 1.00 20.44 C ATOM 2001 C VAL B 13 20.680 -2.596 11.056 1.00 32.11 C ATOM 2002 O VAL B 13 21.025 -2.521 12.239 1.00 60.21 O ATOM 2003 CB VAL B 13 22.883 -3.560 10.183 1.00 14.23 C ATOM 2004 CG1 VAL B 13 22.340 -5.000 10.139 1.00 33.42 C ATOM 2005 CG2 VAL B 13 24.053 -3.364 9.187 1.00 42.35 C ATOM 0 H VAL B 13 23.124 -1.024 10.432 1.00 54.22 H new ATOM 0 HA VAL B 13 21.255 -2.737 8.981 1.00 20.44 H new ATOM 0 HB VAL B 13 23.276 -3.389 11.185 1.00 14.23 H new ATOM 0 HG11 VAL B 13 23.155 -5.702 10.315 1.00 33.42 H new ATOM 0 HG12 VAL B 13 21.580 -5.126 10.910 1.00 33.42 H new ATOM 0 HG13 VAL B 13 21.900 -5.193 9.161 1.00 33.42 H new ATOM 0 HG21 VAL B 13 24.828 -4.104 9.386 1.00 42.35 H new ATOM 0 HG22 VAL B 13 23.687 -3.486 8.167 1.00 42.35 H new ATOM 0 HG23 VAL B 13 24.468 -2.363 9.306 1.00 42.35 H new ATOM 2015 N PHE B 14 19.400 -2.723 10.673 1.00 74.43 N ATOM 2016 CA PHE B 14 18.280 -2.868 11.621 1.00 70.32 C ATOM 2017 C PHE B 14 18.006 -4.356 11.863 1.00 71.41 C ATOM 2018 O PHE B 14 17.270 -5.003 11.110 1.00 23.25 O ATOM 2019 CB PHE B 14 17.019 -2.146 11.076 1.00 22.04 C ATOM 2020 CG PHE B 14 17.196 -0.635 10.926 1.00 64.32 C ATOM 2021 CD1 PHE B 14 17.642 -0.074 9.728 1.00 33.50 C ATOM 2022 CD2 PHE B 14 16.936 0.221 11.994 1.00 64.33 C ATOM 2023 CE1 PHE B 14 17.820 1.290 9.605 1.00 65.34 C ATOM 2024 CE2 PHE B 14 17.112 1.583 11.868 1.00 63.21 C ATOM 2025 CZ PHE B 14 17.556 2.115 10.673 1.00 44.40 C ATOM 0 H PHE B 14 19.110 -2.728 9.695 1.00 74.43 H new ATOM 0 HA PHE B 14 18.544 -2.405 12.572 1.00 70.32 H new ATOM 0 HB2 PHE B 14 16.758 -2.571 10.107 1.00 22.04 H new ATOM 0 HB3 PHE B 14 16.181 -2.341 11.746 1.00 22.04 H new ATOM 0 HD1 PHE B 14 17.851 -0.716 8.885 1.00 33.50 H new ATOM 0 HD2 PHE B 14 16.592 -0.187 12.933 1.00 64.33 H new ATOM 0 HE1 PHE B 14 18.166 1.708 8.671 1.00 65.34 H new ATOM 0 HE2 PHE B 14 16.903 2.234 12.704 1.00 63.21 H new ATOM 0 HZ PHE B 14 17.696 3.182 10.577 1.00 44.40 H new ATOM 2035 N GLU B 15 18.659 -4.893 12.896 1.00 2.51 N ATOM 2036 CA GLU B 15 18.511 -6.292 13.308 1.00 63.11 C ATOM 2037 C GLU B 15 17.202 -6.459 14.106 1.00 50.43 C ATOM 2038 O GLU B 15 17.186 -6.366 15.340 1.00 63.44 O ATOM 2039 CB GLU B 15 19.751 -6.723 14.136 1.00 30.14 C ATOM 2040 CG GLU B 15 21.083 -6.539 13.384 1.00 31.54 C ATOM 2041 CD GLU B 15 22.315 -6.859 14.238 1.00 72.34 C ATOM 2042 OE1 GLU B 15 22.641 -8.051 14.411 1.00 0.31 O ATOM 2043 OE2 GLU B 15 22.968 -5.915 14.741 1.00 73.42 O ATOM 0 H GLU B 15 19.311 -4.365 13.476 1.00 2.51 H new ATOM 0 HA GLU B 15 18.453 -6.938 12.432 1.00 63.11 H new ATOM 0 HB2 GLU B 15 19.781 -6.145 15.060 1.00 30.14 H new ATOM 0 HB3 GLU B 15 19.644 -7.770 14.419 1.00 30.14 H new ATOM 0 HG2 GLU B 15 21.085 -7.180 12.502 1.00 31.54 H new ATOM 0 HG3 GLU B 15 21.153 -5.510 13.030 1.00 31.54 H new ATOM 2050 N ILE B 16 16.104 -6.656 13.366 1.00 31.44 N ATOM 2051 CA ILE B 16 14.739 -6.762 13.922 1.00 14.43 C ATOM 2052 C ILE B 16 14.253 -8.218 13.780 1.00 73.45 C ATOM 2053 O ILE B 16 14.705 -8.928 12.877 1.00 64.33 O ATOM 2054 CB ILE B 16 13.765 -5.750 13.190 1.00 43.12 C ATOM 2055 CG1 ILE B 16 12.357 -5.725 13.867 1.00 64.40 C ATOM 2056 CG2 ILE B 16 13.661 -6.056 11.677 1.00 2.33 C ATOM 2057 CD1 ILE B 16 11.404 -4.683 13.314 1.00 32.23 C ATOM 0 H ILE B 16 16.133 -6.748 12.351 1.00 31.44 H new ATOM 0 HA ILE B 16 14.746 -6.496 14.979 1.00 14.43 H new ATOM 0 HB ILE B 16 14.194 -4.753 13.290 1.00 43.12 H new ATOM 0 HG12 ILE B 16 11.900 -6.709 13.759 1.00 64.40 H new ATOM 0 HG13 ILE B 16 12.486 -5.549 14.935 1.00 64.40 H new ATOM 0 HG21 ILE B 16 12.985 -5.342 11.207 1.00 2.33 H new ATOM 0 HG22 ILE B 16 14.648 -5.975 11.221 1.00 2.33 H new ATOM 0 HG23 ILE B 16 13.277 -7.066 11.536 1.00 2.33 H new ATOM 0 HD11 ILE B 16 10.454 -4.741 13.845 1.00 32.23 H new ATOM 0 HD12 ILE B 16 11.834 -3.690 13.447 1.00 32.23 H new ATOM 0 HD13 ILE B 16 11.239 -4.868 12.253 1.00 32.23 H new ATOM 2069 N GLU B 17 13.351 -8.660 14.681 1.00 1.42 N ATOM 2070 CA GLU B 17 12.821 -10.040 14.676 1.00 63.43 C ATOM 2071 C GLU B 17 12.071 -10.320 13.358 1.00 40.35 C ATOM 2072 O GLU B 17 11.301 -9.468 12.884 1.00 25.42 O ATOM 2073 CB GLU B 17 11.860 -10.273 15.879 1.00 13.52 C ATOM 2074 CG GLU B 17 12.406 -9.888 17.271 1.00 52.40 C ATOM 2075 CD GLU B 17 11.406 -10.190 18.407 1.00 4.21 C ATOM 2076 OE1 GLU B 17 10.290 -9.625 18.382 1.00 55.20 O ATOM 2077 OE2 GLU B 17 11.729 -10.980 19.325 1.00 13.41 O ATOM 0 H GLU B 17 12.972 -8.076 15.427 1.00 1.42 H new ATOM 0 HA GLU B 17 13.666 -10.723 14.765 1.00 63.43 H new ATOM 0 HB2 GLU B 17 10.945 -9.708 15.701 1.00 13.52 H new ATOM 0 HB3 GLU B 17 11.585 -11.327 15.898 1.00 13.52 H new ATOM 0 HG2 GLU B 17 13.334 -10.430 17.455 1.00 52.40 H new ATOM 0 HG3 GLU B 17 12.650 -8.826 17.280 1.00 52.40 H new ATOM 2084 N LYS B 18 12.304 -11.511 12.781 1.00 32.25 N ATOM 2085 CA LYS B 18 11.654 -11.923 11.525 1.00 63.31 C ATOM 2086 C LYS B 18 10.130 -12.072 11.719 1.00 20.24 C ATOM 2087 O LYS B 18 9.354 -11.821 10.794 1.00 31.31 O ATOM 2088 CB LYS B 18 12.278 -13.237 10.983 1.00 45.10 C ATOM 2089 CG LYS B 18 11.756 -13.667 9.587 1.00 43.24 C ATOM 2090 CD LYS B 18 12.421 -14.958 9.025 1.00 43.01 C ATOM 2091 CE LYS B 18 11.925 -16.261 9.682 1.00 22.42 C ATOM 2092 NZ LYS B 18 12.299 -16.383 11.120 1.00 70.43 N ATOM 0 H LYS B 18 12.941 -12.208 13.167 1.00 32.25 H new ATOM 0 HA LYS B 18 11.824 -11.142 10.784 1.00 63.31 H new ATOM 0 HB2 LYS B 18 13.360 -13.117 10.931 1.00 45.10 H new ATOM 0 HB3 LYS B 18 12.080 -14.039 11.694 1.00 45.10 H new ATOM 0 HG2 LYS B 18 10.679 -13.824 9.647 1.00 43.24 H new ATOM 0 HG3 LYS B 18 11.921 -12.851 8.883 1.00 43.24 H new ATOM 0 HD2 LYS B 18 12.235 -15.012 7.952 1.00 43.01 H new ATOM 0 HD3 LYS B 18 13.500 -14.885 9.158 1.00 43.01 H new ATOM 0 HE2 LYS B 18 10.840 -16.314 9.591 1.00 22.42 H new ATOM 0 HE3 LYS B 18 12.332 -17.112 9.136 1.00 22.42 H new ATOM 0 HZ1 LYS B 18 12.495 -17.379 11.344 1.00 70.43 H new ATOM 0 HZ2 LYS B 18 13.148 -15.812 11.308 1.00 70.43 H new ATOM 0 HZ3 LYS B 18 11.515 -16.043 11.713 1.00 70.43 H new ATOM 2106 N GLU B 19 9.716 -12.454 12.949 1.00 3.11 N ATOM 2107 CA GLU B 19 8.288 -12.575 13.328 1.00 33.02 C ATOM 2108 C GLU B 19 7.549 -11.210 13.279 1.00 42.12 C ATOM 2109 O GLU B 19 6.319 -11.166 13.157 1.00 41.24 O ATOM 2110 CB GLU B 19 8.145 -13.236 14.728 1.00 34.31 C ATOM 2111 CG GLU B 19 8.907 -12.544 15.877 1.00 13.44 C ATOM 2112 CD GLU B 19 8.751 -13.297 17.213 1.00 35.12 C ATOM 2113 OE1 GLU B 19 7.715 -13.127 17.885 1.00 54.31 O ATOM 2114 OE2 GLU B 19 9.638 -14.087 17.575 1.00 62.12 O ATOM 0 H GLU B 19 10.360 -12.687 13.705 1.00 3.11 H new ATOM 0 HA GLU B 19 7.812 -13.220 12.589 1.00 33.02 H new ATOM 0 HB2 GLU B 19 7.087 -13.269 14.987 1.00 34.31 H new ATOM 0 HB3 GLU B 19 8.489 -14.268 14.659 1.00 34.31 H new ATOM 0 HG2 GLU B 19 9.964 -12.476 15.621 1.00 13.44 H new ATOM 0 HG3 GLU B 19 8.541 -11.524 15.992 1.00 13.44 H new ATOM 2121 N ILE B 20 8.310 -10.107 13.389 1.00 72.31 N ATOM 2122 CA ILE B 20 7.792 -8.737 13.182 1.00 0.34 C ATOM 2123 C ILE B 20 7.721 -8.434 11.664 1.00 71.25 C ATOM 2124 O ILE B 20 6.712 -7.919 11.157 1.00 44.42 O ATOM 2125 CB ILE B 20 8.701 -7.668 13.906 1.00 53.02 C ATOM 2126 CG1 ILE B 20 8.858 -7.999 15.427 1.00 73.35 C ATOM 2127 CG2 ILE B 20 8.140 -6.248 13.705 1.00 43.11 C ATOM 2128 CD1 ILE B 20 9.698 -7.012 16.225 1.00 33.23 C ATOM 0 H ILE B 20 9.302 -10.137 13.624 1.00 72.31 H new ATOM 0 HA ILE B 20 6.793 -8.676 13.615 1.00 0.34 H new ATOM 0 HB ILE B 20 9.692 -7.708 13.454 1.00 53.02 H new ATOM 0 HG12 ILE B 20 7.866 -8.051 15.875 1.00 73.35 H new ATOM 0 HG13 ILE B 20 9.303 -8.989 15.522 1.00 73.35 H new ATOM 0 HG21 ILE B 20 8.782 -5.528 14.212 1.00 43.11 H new ATOM 0 HG22 ILE B 20 8.107 -6.017 12.640 1.00 43.11 H new ATOM 0 HG23 ILE B 20 7.134 -6.192 14.120 1.00 43.11 H new ATOM 0 HD11 ILE B 20 9.744 -7.332 17.266 1.00 33.23 H new ATOM 0 HD12 ILE B 20 10.706 -6.974 15.812 1.00 33.23 H new ATOM 0 HD13 ILE B 20 9.246 -6.022 16.170 1.00 33.23 H new ATOM 2140 N ALA B 21 8.796 -8.826 10.946 1.00 1.03 N ATOM 2141 CA ALA B 21 8.953 -8.601 9.491 1.00 40.45 C ATOM 2142 C ALA B 21 8.131 -9.606 8.645 1.00 60.54 C ATOM 2143 O ALA B 21 8.289 -9.670 7.421 1.00 41.34 O ATOM 2144 CB ALA B 21 10.445 -8.657 9.120 1.00 0.32 C ATOM 0 H ALA B 21 9.588 -9.313 11.365 1.00 1.03 H new ATOM 0 HA ALA B 21 8.559 -7.611 9.260 1.00 40.45 H new ATOM 0 HB1 ALA B 21 10.560 -8.491 8.049 1.00 0.32 H new ATOM 0 HB2 ALA B 21 10.985 -7.884 9.667 1.00 0.32 H new ATOM 0 HB3 ALA B 21 10.848 -9.635 9.381 1.00 0.32 H new ATOM 2150 N CYS B 22 7.278 -10.407 9.308 1.00 74.22 N ATOM 2151 CA CYS B 22 6.263 -11.235 8.633 1.00 70.33 C ATOM 2152 C CYS B 22 5.087 -10.365 8.136 1.00 63.42 C ATOM 2153 O CYS B 22 4.455 -10.695 7.124 1.00 33.22 O ATOM 2154 CB CYS B 22 5.774 -12.340 9.587 1.00 61.10 C ATOM 2155 SG CYS B 22 7.073 -13.491 10.088 1.00 73.12 S ATOM 0 H CYS B 22 7.273 -10.498 10.324 1.00 74.22 H new ATOM 0 HA CYS B 22 6.714 -11.706 7.759 1.00 70.33 H new ATOM 0 HB2 CYS B 22 5.347 -11.877 10.477 1.00 61.10 H new ATOM 0 HB3 CYS B 22 4.973 -12.898 9.103 1.00 61.10 H new ATOM 0 HG CYS B 22 8.205 -12.857 10.175 1.00 73.12 H new ATOM 2161 N MET B 23 4.811 -9.246 8.852 1.00 41.43 N ATOM 2162 CA MET B 23 3.803 -8.238 8.424 1.00 1.32 C ATOM 2163 C MET B 23 4.256 -7.543 7.126 1.00 71.41 C ATOM 2164 O MET B 23 3.429 -7.031 6.357 1.00 0.23 O ATOM 2165 CB MET B 23 3.539 -7.192 9.542 1.00 14.31 C ATOM 2166 CG MET B 23 2.944 -7.765 10.841 1.00 32.11 C ATOM 2167 SD MET B 23 2.424 -6.476 11.998 1.00 62.22 S ATOM 2168 CE MET B 23 3.964 -5.628 12.329 1.00 74.25 C ATOM 0 H MET B 23 5.273 -9.017 9.732 1.00 41.43 H new ATOM 0 HA MET B 23 2.866 -8.761 8.232 1.00 1.32 H new ATOM 0 HB2 MET B 23 4.478 -6.692 9.780 1.00 14.31 H new ATOM 0 HB3 MET B 23 2.862 -6.431 9.154 1.00 14.31 H new ATOM 0 HG2 MET B 23 2.089 -8.395 10.597 1.00 32.11 H new ATOM 0 HG3 MET B 23 3.683 -8.404 11.324 1.00 32.11 H new ATOM 0 HE1 MET B 23 3.922 -5.169 13.317 1.00 74.25 H new ATOM 0 HE2 MET B 23 4.787 -6.342 12.296 1.00 74.25 H new ATOM 0 HE3 MET B 23 4.123 -4.856 11.577 1.00 74.25 H new ATOM 2178 N SER B 24 5.585 -7.521 6.915 1.00 10.54 N ATOM 2179 CA SER B 24 6.175 -7.224 5.616 1.00 24.33 C ATOM 2180 C SER B 24 5.959 -8.424 4.688 1.00 25.15 C ATOM 2181 O SER B 24 6.655 -9.448 4.806 1.00 43.34 O ATOM 2182 CB SER B 24 7.677 -6.959 5.740 1.00 42.13 C ATOM 2183 OG SER B 24 7.964 -5.817 6.496 1.00 74.05 O ATOM 0 H SER B 24 6.271 -7.710 7.646 1.00 10.54 H new ATOM 0 HA SER B 24 5.697 -6.331 5.214 1.00 24.33 H new ATOM 0 HB2 SER B 24 8.157 -7.823 6.199 1.00 42.13 H new ATOM 0 HB3 SER B 24 8.105 -6.847 4.744 1.00 42.13 H new ATOM 0 HG SER B 24 8.505 -6.067 7.274 1.00 74.05 H new ATOM 2189 N VAL B 25 4.973 -8.306 3.797 1.00 20.50 N ATOM 2190 CA VAL B 25 4.691 -9.339 2.795 1.00 24.43 C ATOM 2191 C VAL B 25 5.848 -9.422 1.781 1.00 33.41 C ATOM 2192 O VAL B 25 6.203 -10.515 1.350 1.00 72.40 O ATOM 2193 CB VAL B 25 3.313 -9.090 2.082 1.00 64.33 C ATOM 2194 CG1 VAL B 25 3.026 -10.127 0.966 1.00 52.24 C ATOM 2195 CG2 VAL B 25 2.165 -9.057 3.125 1.00 51.54 C ATOM 0 H VAL B 25 4.351 -7.499 3.748 1.00 20.50 H new ATOM 0 HA VAL B 25 4.612 -10.300 3.304 1.00 24.43 H new ATOM 0 HB VAL B 25 3.371 -8.118 1.592 1.00 64.33 H new ATOM 0 HG11 VAL B 25 2.062 -9.909 0.506 1.00 52.24 H new ATOM 0 HG12 VAL B 25 3.809 -10.074 0.210 1.00 52.24 H new ATOM 0 HG13 VAL B 25 3.005 -11.128 1.396 1.00 52.24 H new ATOM 0 HG21 VAL B 25 1.216 -8.884 2.617 1.00 51.54 H new ATOM 0 HG22 VAL B 25 2.125 -10.010 3.653 1.00 51.54 H new ATOM 0 HG23 VAL B 25 2.346 -8.254 3.840 1.00 51.54 H new ATOM 2205 N THR B 26 6.485 -8.271 1.474 1.00 22.41 N ATOM 2206 CA THR B 26 7.623 -8.217 0.532 1.00 45.25 C ATOM 2207 C THR B 26 8.827 -9.009 1.088 1.00 51.20 C ATOM 2208 O THR B 26 9.396 -9.857 0.387 1.00 20.31 O ATOM 2209 CB THR B 26 8.055 -6.744 0.227 1.00 1.10 C ATOM 2210 OG1 THR B 26 6.950 -6.015 -0.332 1.00 41.33 O ATOM 2211 CG2 THR B 26 9.264 -6.653 -0.729 1.00 5.23 C ATOM 0 H THR B 26 6.229 -7.365 1.866 1.00 22.41 H new ATOM 0 HA THR B 26 7.291 -8.673 -0.401 1.00 45.25 H new ATOM 0 HB THR B 26 8.361 -6.306 1.177 1.00 1.10 H new ATOM 0 HG1 THR B 26 7.215 -5.084 -0.482 1.00 41.33 H new ATOM 0 HG21 THR B 26 9.514 -5.606 -0.901 1.00 5.23 H new ATOM 0 HG22 THR B 26 10.119 -7.162 -0.284 1.00 5.23 H new ATOM 0 HG23 THR B 26 9.014 -7.127 -1.678 1.00 5.23 H new ATOM 2219 N ILE B 27 9.169 -8.748 2.371 1.00 30.34 N ATOM 2220 CA ILE B 27 10.326 -9.375 3.039 1.00 13.13 C ATOM 2221 C ILE B 27 10.135 -10.889 3.130 1.00 14.43 C ATOM 2222 O ILE B 27 11.032 -11.641 2.724 1.00 74.12 O ATOM 2223 CB ILE B 27 10.607 -8.761 4.465 1.00 12.32 C ATOM 2224 CG1 ILE B 27 11.009 -7.257 4.333 1.00 70.44 C ATOM 2225 CG2 ILE B 27 11.688 -9.559 5.249 1.00 12.13 C ATOM 2226 CD1 ILE B 27 11.257 -6.548 5.651 1.00 52.34 C ATOM 0 H ILE B 27 8.652 -8.101 2.966 1.00 30.34 H new ATOM 0 HA ILE B 27 11.202 -9.163 2.427 1.00 13.13 H new ATOM 0 HB ILE B 27 9.685 -8.833 5.042 1.00 12.32 H new ATOM 0 HG12 ILE B 27 11.910 -7.188 3.724 1.00 70.44 H new ATOM 0 HG13 ILE B 27 10.220 -6.730 3.796 1.00 70.44 H new ATOM 0 HG21 ILE B 27 11.846 -9.097 6.224 1.00 12.13 H new ATOM 0 HG22 ILE B 27 11.354 -10.588 5.385 1.00 12.13 H new ATOM 0 HG23 ILE B 27 12.623 -9.552 4.689 1.00 12.13 H new ATOM 0 HD11 ILE B 27 11.530 -5.510 5.460 1.00 52.34 H new ATOM 0 HD12 ILE B 27 10.352 -6.579 6.257 1.00 52.34 H new ATOM 0 HD13 ILE B 27 12.068 -7.044 6.184 1.00 52.34 H new ATOM 2238 N LYS B 28 8.939 -11.330 3.595 1.00 14.02 N ATOM 2239 CA LYS B 28 8.656 -12.770 3.744 1.00 73.32 C ATOM 2240 C LYS B 28 8.777 -13.476 2.367 1.00 2.21 C ATOM 2241 O LYS B 28 9.447 -14.496 2.270 1.00 41.22 O ATOM 2242 CB LYS B 28 7.266 -13.052 4.415 1.00 22.43 C ATOM 2243 CG LYS B 28 6.050 -12.962 3.479 1.00 72.42 C ATOM 2244 CD LYS B 28 4.708 -13.311 4.160 1.00 35.32 C ATOM 2245 CE LYS B 28 3.538 -13.247 3.161 1.00 43.21 C ATOM 2246 NZ LYS B 28 3.787 -14.093 1.948 1.00 51.32 N ATOM 0 H LYS B 28 8.171 -10.717 3.868 1.00 14.02 H new ATOM 0 HA LYS B 28 9.402 -13.184 4.423 1.00 73.32 H new ATOM 0 HB2 LYS B 28 7.290 -14.049 4.856 1.00 22.43 H new ATOM 0 HB3 LYS B 28 7.127 -12.345 5.233 1.00 22.43 H new ATOM 0 HG2 LYS B 28 5.989 -11.952 3.075 1.00 72.42 H new ATOM 0 HG3 LYS B 28 6.203 -13.634 2.635 1.00 72.42 H new ATOM 0 HD2 LYS B 28 4.766 -14.310 4.591 1.00 35.32 H new ATOM 0 HD3 LYS B 28 4.525 -12.619 4.982 1.00 35.32 H new ATOM 0 HE2 LYS B 28 2.623 -13.579 3.652 1.00 43.21 H new ATOM 0 HE3 LYS B 28 3.379 -12.213 2.855 1.00 43.21 H new ATOM 0 HZ1 LYS B 28 2.879 -14.425 1.564 1.00 51.32 H new ATOM 0 HZ2 LYS B 28 4.282 -13.530 1.228 1.00 51.32 H new ATOM 0 HZ3 LYS B 28 4.372 -14.912 2.210 1.00 51.32 H new ATOM 2260 N ASN B 29 8.214 -12.838 1.295 1.00 72.32 N ATOM 2261 CA ASN B 29 8.192 -13.404 -0.081 1.00 20.51 C ATOM 2262 C ASN B 29 9.611 -13.656 -0.591 1.00 31.32 C ATOM 2263 O ASN B 29 9.888 -14.720 -1.149 1.00 35.23 O ATOM 2264 CB ASN B 29 7.449 -12.478 -1.094 1.00 34.43 C ATOM 2265 CG ASN B 29 5.934 -12.421 -0.908 1.00 44.31 C ATOM 2266 OD1 ASN B 29 5.300 -13.361 -0.421 1.00 31.23 O ATOM 2267 ND2 ASN B 29 5.340 -11.311 -1.321 1.00 13.21 N ATOM 0 H ASN B 29 7.767 -11.924 1.366 1.00 72.32 H new ATOM 0 HA ASN B 29 7.648 -14.346 -0.013 1.00 20.51 H new ATOM 0 HB2 ASN B 29 7.851 -11.469 -1.006 1.00 34.43 H new ATOM 0 HB3 ASN B 29 7.665 -12.821 -2.106 1.00 34.43 H new ATOM 0 HD21 ASN B 29 4.328 -11.214 -1.241 1.00 13.21 H new ATOM 0 HD22 ASN B 29 5.895 -10.553 -1.719 1.00 13.21 H new ATOM 2274 N MET B 30 10.502 -12.668 -0.365 1.00 0.30 N ATOM 2275 CA MET B 30 11.921 -12.758 -0.761 1.00 24.04 C ATOM 2276 C MET B 30 12.597 -13.950 -0.060 1.00 23.42 C ATOM 2277 O MET B 30 13.317 -14.727 -0.695 1.00 64.13 O ATOM 2278 CB MET B 30 12.681 -11.438 -0.447 1.00 43.43 C ATOM 2279 CG MET B 30 12.183 -10.210 -1.219 1.00 3.31 C ATOM 2280 SD MET B 30 13.235 -8.750 -0.990 1.00 54.55 S ATOM 2281 CE MET B 30 13.131 -8.444 0.777 1.00 34.22 C ATOM 0 H MET B 30 10.259 -11.791 0.095 1.00 0.30 H new ATOM 0 HA MET B 30 11.960 -12.916 -1.839 1.00 24.04 H new ATOM 0 HB2 MET B 30 12.602 -11.235 0.621 1.00 43.43 H new ATOM 0 HB3 MET B 30 13.739 -11.583 -0.666 1.00 43.43 H new ATOM 0 HG2 MET B 30 12.133 -10.451 -2.281 1.00 3.31 H new ATOM 0 HG3 MET B 30 11.169 -9.973 -0.898 1.00 3.31 H new ATOM 0 HE1 MET B 30 13.925 -7.759 1.075 1.00 34.22 H new ATOM 0 HE2 MET B 30 12.163 -8.002 1.013 1.00 34.22 H new ATOM 0 HE3 MET B 30 13.242 -9.385 1.316 1.00 34.22 H new ATOM 2291 N ILE B 31 12.290 -14.113 1.244 1.00 24.33 N ATOM 2292 CA ILE B 31 12.817 -15.216 2.074 1.00 54.32 C ATOM 2293 C ILE B 31 12.254 -16.575 1.597 1.00 43.44 C ATOM 2294 O ILE B 31 12.950 -17.583 1.648 1.00 24.10 O ATOM 2295 CB ILE B 31 12.489 -14.993 3.607 1.00 41.43 C ATOM 2296 CG1 ILE B 31 13.068 -13.630 4.101 1.00 33.42 C ATOM 2297 CG2 ILE B 31 13.017 -16.164 4.481 1.00 43.24 C ATOM 2298 CD1 ILE B 31 12.721 -13.276 5.537 1.00 74.24 C ATOM 0 H ILE B 31 11.669 -13.483 1.751 1.00 24.33 H new ATOM 0 HA ILE B 31 13.901 -15.226 1.960 1.00 54.32 H new ATOM 0 HB ILE B 31 11.404 -14.968 3.712 1.00 41.43 H new ATOM 0 HG12 ILE B 31 14.153 -13.653 3.999 1.00 33.42 H new ATOM 0 HG13 ILE B 31 12.703 -12.838 3.447 1.00 33.42 H new ATOM 0 HG21 ILE B 31 12.774 -15.976 5.527 1.00 43.24 H new ATOM 0 HG22 ILE B 31 12.550 -17.096 4.162 1.00 43.24 H new ATOM 0 HG23 ILE B 31 14.098 -16.243 4.369 1.00 43.24 H new ATOM 0 HD11 ILE B 31 13.165 -12.314 5.792 1.00 74.24 H new ATOM 0 HD12 ILE B 31 11.638 -13.216 5.645 1.00 74.24 H new ATOM 0 HD13 ILE B 31 13.110 -14.044 6.205 1.00 74.24 H new ATOM 2310 N GLU B 32 10.996 -16.572 1.105 1.00 23.10 N ATOM 2311 CA GLU B 32 10.306 -17.795 0.623 1.00 42.24 C ATOM 2312 C GLU B 32 10.855 -18.235 -0.757 1.00 70.42 C ATOM 2313 O GLU B 32 10.937 -19.435 -1.039 1.00 1.40 O ATOM 2314 CB GLU B 32 8.761 -17.580 0.561 1.00 72.53 C ATOM 2315 CG GLU B 32 8.107 -17.234 1.915 1.00 54.14 C ATOM 2316 CD GLU B 32 6.587 -17.022 1.817 1.00 1.11 C ATOM 2317 OE1 GLU B 32 5.824 -17.975 2.083 1.00 13.22 O ATOM 2318 OE2 GLU B 32 6.149 -15.895 1.476 1.00 50.51 O ATOM 0 H GLU B 32 10.430 -15.727 1.030 1.00 23.10 H new ATOM 0 HA GLU B 32 10.507 -18.593 1.337 1.00 42.24 H new ATOM 0 HB2 GLU B 32 8.547 -16.779 -0.147 1.00 72.53 H new ATOM 0 HB3 GLU B 32 8.297 -18.485 0.169 1.00 72.53 H new ATOM 0 HG2 GLU B 32 8.310 -18.036 2.625 1.00 54.14 H new ATOM 0 HG3 GLU B 32 8.568 -16.331 2.314 1.00 54.14 H new ATOM 2325 N ASP B 33 11.244 -17.250 -1.600 1.00 50.21 N ATOM 2326 CA ASP B 33 11.816 -17.510 -2.951 1.00 2.35 C ATOM 2327 C ASP B 33 13.243 -18.067 -2.839 1.00 22.45 C ATOM 2328 O ASP B 33 13.629 -19.002 -3.558 1.00 34.51 O ATOM 2329 CB ASP B 33 11.843 -16.220 -3.820 1.00 11.53 C ATOM 2330 CG ASP B 33 10.450 -15.647 -4.144 1.00 72.01 C ATOM 2331 OD1 ASP B 33 9.577 -16.406 -4.613 1.00 30.42 O ATOM 2332 OD2 ASP B 33 10.230 -14.428 -3.959 1.00 3.04 O ATOM 0 H ASP B 33 11.173 -16.259 -1.370 1.00 50.21 H new ATOM 0 HA ASP B 33 11.171 -18.245 -3.433 1.00 2.35 H new ATOM 0 HB2 ASP B 33 12.425 -15.458 -3.301 1.00 11.53 H new ATOM 0 HB3 ASP B 33 12.361 -16.436 -4.754 1.00 11.53 H new ATOM 2337 N ILE B 34 14.018 -17.458 -1.939 1.00 41.05 N ATOM 2338 CA ILE B 34 15.385 -17.895 -1.611 1.00 42.14 C ATOM 2339 C ILE B 34 15.335 -19.198 -0.780 1.00 1.40 C ATOM 2340 O ILE B 34 16.240 -20.034 -0.844 1.00 34.32 O ATOM 2341 CB ILE B 34 16.146 -16.749 -0.833 1.00 2.10 C ATOM 2342 CG1 ILE B 34 16.252 -15.461 -1.721 1.00 41.01 C ATOM 2343 CG2 ILE B 34 17.543 -17.207 -0.340 1.00 21.02 C ATOM 2344 CD1 ILE B 34 16.884 -14.255 -1.039 1.00 20.31 C ATOM 0 H ILE B 34 13.716 -16.640 -1.410 1.00 41.05 H new ATOM 0 HA ILE B 34 15.932 -18.100 -2.531 1.00 42.14 H new ATOM 0 HB ILE B 34 15.562 -16.510 0.056 1.00 2.10 H new ATOM 0 HG12 ILE B 34 16.832 -15.700 -2.612 1.00 41.01 H new ATOM 0 HG13 ILE B 34 15.252 -15.186 -2.056 1.00 41.01 H new ATOM 0 HG21 ILE B 34 18.029 -16.387 0.189 1.00 21.02 H new ATOM 0 HG22 ILE B 34 17.431 -18.057 0.333 1.00 21.02 H new ATOM 0 HG23 ILE B 34 18.153 -17.499 -1.195 1.00 21.02 H new ATOM 0 HD11 ILE B 34 16.912 -13.416 -1.735 1.00 20.31 H new ATOM 0 HD12 ILE B 34 16.294 -13.981 -0.164 1.00 20.31 H new ATOM 0 HD13 ILE B 34 17.899 -14.503 -0.729 1.00 20.31 H new ATOM 2356 N GLY B 35 14.236 -19.364 -0.022 1.00 63.10 N ATOM 2357 CA GLY B 35 14.053 -20.503 0.877 1.00 13.12 C ATOM 2358 C GLY B 35 14.543 -20.185 2.285 1.00 10.31 C ATOM 2359 O GLY B 35 13.771 -20.228 3.251 1.00 73.24 O ATOM 0 H GLY B 35 13.454 -18.709 -0.020 1.00 63.10 H new ATOM 0 HA2 GLY B 35 12.998 -20.776 0.910 1.00 13.12 H new ATOM 0 HA3 GLY B 35 14.594 -21.366 0.488 1.00 13.12 H new ATOM 2363 N GLU B 36 15.845 -19.845 2.389 1.00 43.15 N ATOM 2364 CA GLU B 36 16.515 -19.526 3.666 1.00 4.45 C ATOM 2365 C GLU B 36 17.400 -18.273 3.483 1.00 32.02 C ATOM 2366 O GLU B 36 18.527 -18.368 2.970 1.00 73.20 O ATOM 2367 CB GLU B 36 17.376 -20.737 4.140 1.00 54.01 C ATOM 2368 CG GLU B 36 16.573 -22.030 4.413 1.00 55.51 C ATOM 2369 CD GLU B 36 17.449 -23.247 4.747 1.00 72.12 C ATOM 2370 OE1 GLU B 36 17.833 -23.412 5.922 1.00 23.14 O ATOM 2371 OE2 GLU B 36 17.760 -24.041 3.834 1.00 22.05 O ATOM 0 H GLU B 36 16.465 -19.784 1.582 1.00 43.15 H new ATOM 0 HA GLU B 36 15.762 -19.323 4.428 1.00 4.45 H new ATOM 0 HB2 GLU B 36 18.132 -20.947 3.383 1.00 54.01 H new ATOM 0 HB3 GLU B 36 17.906 -20.455 5.050 1.00 54.01 H new ATOM 0 HG2 GLU B 36 15.885 -21.851 5.240 1.00 55.51 H new ATOM 0 HG3 GLU B 36 15.966 -22.261 3.538 1.00 55.51 H new ATOM 2378 N SER B 37 16.866 -17.099 3.855 1.00 45.23 N ATOM 2379 CA SER B 37 17.609 -15.827 3.816 1.00 31.12 C ATOM 2380 C SER B 37 18.228 -15.541 5.198 1.00 22.24 C ATOM 2381 O SER B 37 17.734 -14.703 5.964 1.00 21.30 O ATOM 2382 CB SER B 37 16.676 -14.682 3.358 1.00 43.04 C ATOM 2383 OG SER B 37 16.086 -14.977 2.110 1.00 70.42 O ATOM 0 H SER B 37 15.908 -17.004 4.191 1.00 45.23 H new ATOM 0 HA SER B 37 18.422 -15.899 3.094 1.00 31.12 H new ATOM 0 HB2 SER B 37 15.897 -14.523 4.104 1.00 43.04 H new ATOM 0 HB3 SER B 37 17.243 -13.754 3.286 1.00 43.04 H new ATOM 0 HG SER B 37 16.779 -15.267 1.481 1.00 70.42 H new ATOM 2389 N ASP B 38 19.281 -16.309 5.522 1.00 62.25 N ATOM 2390 CA ASP B 38 20.035 -16.169 6.782 1.00 11.51 C ATOM 2391 C ASP B 38 20.967 -14.941 6.716 1.00 65.01 C ATOM 2392 O ASP B 38 21.280 -14.324 7.741 1.00 11.04 O ATOM 2393 CB ASP B 38 20.838 -17.471 7.055 1.00 24.45 C ATOM 2394 CG ASP B 38 21.617 -17.438 8.385 1.00 74.45 C ATOM 2395 OD1 ASP B 38 21.005 -17.677 9.447 1.00 62.32 O ATOM 2396 OD2 ASP B 38 22.838 -17.178 8.381 1.00 13.33 O ATOM 0 H ASP B 38 19.636 -17.048 4.916 1.00 62.25 H new ATOM 0 HA ASP B 38 19.339 -16.013 7.606 1.00 11.51 H new ATOM 0 HB2 ASP B 38 20.152 -18.318 7.065 1.00 24.45 H new ATOM 0 HB3 ASP B 38 21.538 -17.637 6.236 1.00 24.45 H new ATOM 2401 N SER B 39 21.402 -14.606 5.488 1.00 32.21 N ATOM 2402 CA SER B 39 22.249 -13.437 5.206 1.00 31.03 C ATOM 2403 C SER B 39 21.489 -12.104 5.476 1.00 74.11 C ATOM 2404 O SER B 39 20.257 -12.057 5.325 1.00 20.42 O ATOM 2405 CB SER B 39 22.731 -13.499 3.738 1.00 71.51 C ATOM 2406 OG SER B 39 23.442 -14.703 3.475 1.00 11.22 O ATOM 0 H SER B 39 21.171 -15.147 4.655 1.00 32.21 H new ATOM 0 HA SER B 39 23.109 -13.461 5.875 1.00 31.03 H new ATOM 0 HB2 SER B 39 21.874 -13.427 3.069 1.00 71.51 H new ATOM 0 HB3 SER B 39 23.372 -12.643 3.528 1.00 71.51 H new ATOM 0 HG SER B 39 23.732 -14.714 2.539 1.00 11.22 H new ATOM 2412 N PRO B 40 22.211 -11.002 5.887 1.00 71.43 N ATOM 2413 CA PRO B 40 21.597 -9.665 6.092 1.00 35.31 C ATOM 2414 C PRO B 40 20.929 -9.157 4.794 1.00 14.14 C ATOM 2415 O PRO B 40 21.529 -9.234 3.717 1.00 51.45 O ATOM 2416 CB PRO B 40 22.797 -8.765 6.522 1.00 71.32 C ATOM 2417 CG PRO B 40 24.025 -9.513 6.100 1.00 51.41 C ATOM 2418 CD PRO B 40 23.665 -10.977 6.206 1.00 11.52 C ATOM 0 HA PRO B 40 20.801 -9.671 6.837 1.00 35.31 H new ATOM 0 HB2 PRO B 40 22.747 -7.788 6.042 1.00 71.32 H new ATOM 0 HB3 PRO B 40 22.793 -8.592 7.598 1.00 71.32 H new ATOM 0 HG2 PRO B 40 24.312 -9.253 5.081 1.00 51.41 H new ATOM 0 HG3 PRO B 40 24.872 -9.270 6.742 1.00 51.41 H new ATOM 0 HD2 PRO B 40 24.240 -11.583 5.506 1.00 11.52 H new ATOM 0 HD3 PRO B 40 23.864 -11.368 7.204 1.00 11.52 H new ATOM 2426 N ILE B 41 19.674 -8.694 4.904 1.00 5.31 N ATOM 2427 CA ILE B 41 18.881 -8.237 3.758 1.00 75.10 C ATOM 2428 C ILE B 41 19.083 -6.718 3.564 1.00 41.14 C ATOM 2429 O ILE B 41 18.598 -5.925 4.383 1.00 42.24 O ATOM 2430 CB ILE B 41 17.350 -8.583 3.945 1.00 3.10 C ATOM 2431 CG1 ILE B 41 17.152 -10.126 4.137 1.00 11.02 C ATOM 2432 CG2 ILE B 41 16.498 -8.059 2.763 1.00 12.01 C ATOM 2433 CD1 ILE B 41 17.616 -10.989 2.962 1.00 13.34 C ATOM 0 H ILE B 41 19.181 -8.627 5.795 1.00 5.31 H new ATOM 0 HA ILE B 41 19.224 -8.760 2.865 1.00 75.10 H new ATOM 0 HB ILE B 41 17.004 -8.076 4.846 1.00 3.10 H new ATOM 0 HG12 ILE B 41 17.691 -10.438 5.032 1.00 11.02 H new ATOM 0 HG13 ILE B 41 16.095 -10.322 4.317 1.00 11.02 H new ATOM 0 HG21 ILE B 41 15.451 -8.316 2.927 1.00 12.01 H new ATOM 0 HG22 ILE B 41 16.599 -6.976 2.693 1.00 12.01 H new ATOM 0 HG23 ILE B 41 16.843 -8.516 1.835 1.00 12.01 H new ATOM 0 HD11 ILE B 41 17.438 -12.040 3.190 1.00 13.34 H new ATOM 0 HD12 ILE B 41 17.060 -10.713 2.066 1.00 13.34 H new ATOM 0 HD13 ILE B 41 18.681 -10.830 2.792 1.00 13.34 H new ATOM 2445 N PRO B 42 19.828 -6.286 2.497 1.00 63.03 N ATOM 2446 CA PRO B 42 19.958 -4.863 2.172 1.00 13.30 C ATOM 2447 C PRO B 42 18.681 -4.335 1.475 1.00 74.52 C ATOM 2448 O PRO B 42 18.041 -5.051 0.688 1.00 34.34 O ATOM 2449 CB PRO B 42 21.200 -4.824 1.249 1.00 2.10 C ATOM 2450 CG PRO B 42 21.229 -6.157 0.572 1.00 65.13 C ATOM 2451 CD PRO B 42 20.591 -7.140 1.538 1.00 15.33 C ATOM 0 HA PRO B 42 20.076 -4.222 3.046 1.00 13.30 H new ATOM 0 HB2 PRO B 42 21.125 -4.015 0.522 1.00 2.10 H new ATOM 0 HB3 PRO B 42 22.111 -4.654 1.822 1.00 2.10 H new ATOM 0 HG2 PRO B 42 20.681 -6.127 -0.370 1.00 65.13 H new ATOM 0 HG3 PRO B 42 22.252 -6.451 0.337 1.00 65.13 H new ATOM 0 HD2 PRO B 42 19.933 -7.836 1.018 1.00 15.33 H new ATOM 0 HD3 PRO B 42 21.345 -7.737 2.052 1.00 15.33 H new ATOM 2459 N LEU B 43 18.306 -3.097 1.805 1.00 62.11 N ATOM 2460 CA LEU B 43 17.134 -2.413 1.260 1.00 4.31 C ATOM 2461 C LEU B 43 17.635 -1.088 0.632 1.00 73.23 C ATOM 2462 O LEU B 43 17.656 -0.045 1.301 1.00 13.24 O ATOM 2463 CB LEU B 43 16.068 -2.175 2.385 1.00 70.42 C ATOM 2464 CG LEU B 43 15.521 -3.454 3.116 1.00 62.44 C ATOM 2465 CD1 LEU B 43 14.539 -3.081 4.252 1.00 0.41 C ATOM 2466 CD2 LEU B 43 14.878 -4.457 2.127 1.00 32.10 C ATOM 0 H LEU B 43 18.823 -2.529 2.476 1.00 62.11 H new ATOM 0 HA LEU B 43 16.638 -3.014 0.497 1.00 4.31 H new ATOM 0 HB2 LEU B 43 16.505 -1.515 3.134 1.00 70.42 H new ATOM 0 HB3 LEU B 43 15.222 -1.645 1.947 1.00 70.42 H new ATOM 0 HG LEU B 43 16.379 -3.952 3.568 1.00 62.44 H new ATOM 0 HD11 LEU B 43 14.180 -3.990 4.736 1.00 0.41 H new ATOM 0 HD12 LEU B 43 15.051 -2.457 4.985 1.00 0.41 H new ATOM 0 HD13 LEU B 43 13.693 -2.533 3.837 1.00 0.41 H new ATOM 0 HD21 LEU B 43 14.514 -5.326 2.675 1.00 32.10 H new ATOM 0 HD22 LEU B 43 14.045 -3.977 1.612 1.00 32.10 H new ATOM 0 HD23 LEU B 43 15.622 -4.775 1.396 1.00 32.10 H new ATOM 2478 N PRO B 44 18.094 -1.123 -0.666 1.00 72.24 N ATOM 2479 CA PRO B 44 18.789 0.011 -1.323 1.00 24.53 C ATOM 2480 C PRO B 44 17.806 1.054 -1.915 1.00 41.21 C ATOM 2481 O PRO B 44 17.962 1.506 -3.054 1.00 21.01 O ATOM 2482 CB PRO B 44 19.617 -0.722 -2.407 1.00 4.35 C ATOM 2483 CG PRO B 44 18.765 -1.879 -2.828 1.00 72.12 C ATOM 2484 CD PRO B 44 17.952 -2.274 -1.605 1.00 34.01 C ATOM 0 HA PRO B 44 19.393 0.612 -0.643 1.00 24.53 H new ATOM 0 HB2 PRO B 44 19.835 -0.065 -3.249 1.00 4.35 H new ATOM 0 HB3 PRO B 44 20.574 -1.060 -2.011 1.00 4.35 H new ATOM 0 HG2 PRO B 44 18.113 -1.601 -3.656 1.00 72.12 H new ATOM 0 HG3 PRO B 44 19.380 -2.711 -3.172 1.00 72.12 H new ATOM 0 HD2 PRO B 44 16.907 -2.447 -1.863 1.00 34.01 H new ATOM 0 HD3 PRO B 44 18.328 -3.196 -1.161 1.00 34.01 H new ATOM 2492 N ASN B 45 16.840 1.479 -1.085 1.00 30.50 N ATOM 2493 CA ASN B 45 15.769 2.416 -1.460 1.00 64.13 C ATOM 2494 C ASN B 45 15.410 3.271 -0.241 1.00 62.25 C ATOM 2495 O ASN B 45 15.528 4.502 -0.261 1.00 75.43 O ATOM 2496 CB ASN B 45 14.522 1.632 -1.975 1.00 53.01 C ATOM 2497 CG ASN B 45 13.307 2.528 -2.272 1.00 41.41 C ATOM 2498 OD1 ASN B 45 12.437 2.725 -1.417 1.00 11.34 O ATOM 2499 ND2 ASN B 45 13.237 3.077 -3.476 1.00 74.14 N ATOM 0 H ASN B 45 16.781 1.174 -0.113 1.00 30.50 H new ATOM 0 HA ASN B 45 16.111 3.066 -2.266 1.00 64.13 H new ATOM 0 HB2 ASN B 45 14.793 1.091 -2.881 1.00 53.01 H new ATOM 0 HB3 ASN B 45 14.240 0.887 -1.231 1.00 53.01 H new ATOM 0 HD21 ASN B 45 12.450 3.680 -3.717 1.00 74.14 H new ATOM 0 HD22 ASN B 45 13.970 2.897 -4.162 1.00 74.14 H new ATOM 2506 N VAL B 46 14.998 2.586 0.837 1.00 31.34 N ATOM 2507 CA VAL B 46 14.554 3.232 2.076 1.00 70.11 C ATOM 2508 C VAL B 46 15.764 3.588 2.969 1.00 11.14 C ATOM 2509 O VAL B 46 16.627 2.743 3.241 1.00 45.01 O ATOM 2510 CB VAL B 46 13.507 2.339 2.849 1.00 53.23 C ATOM 2511 CG1 VAL B 46 14.059 0.932 3.175 1.00 14.42 C ATOM 2512 CG2 VAL B 46 12.981 3.057 4.112 1.00 51.04 C ATOM 0 H VAL B 46 14.964 1.567 0.871 1.00 31.34 H new ATOM 0 HA VAL B 46 14.049 4.160 1.810 1.00 70.11 H new ATOM 0 HB VAL B 46 12.661 2.189 2.179 1.00 53.23 H new ATOM 0 HG11 VAL B 46 13.300 0.358 3.707 1.00 14.42 H new ATOM 0 HG12 VAL B 46 14.319 0.420 2.249 1.00 14.42 H new ATOM 0 HG13 VAL B 46 14.947 1.025 3.800 1.00 14.42 H new ATOM 0 HG21 VAL B 46 12.262 2.416 4.622 1.00 51.04 H new ATOM 0 HG22 VAL B 46 13.814 3.273 4.781 1.00 51.04 H new ATOM 0 HG23 VAL B 46 12.496 3.990 3.825 1.00 51.04 H new ATOM 2522 N THR B 47 15.814 4.854 3.404 1.00 3.41 N ATOM 2523 CA THR B 47 16.903 5.403 4.227 1.00 11.44 C ATOM 2524 C THR B 47 16.763 4.941 5.689 1.00 14.43 C ATOM 2525 O THR B 47 15.737 4.368 6.059 1.00 64.11 O ATOM 2526 CB THR B 47 16.880 6.959 4.153 1.00 2.13 C ATOM 2527 OG1 THR B 47 15.626 7.438 4.658 1.00 24.22 O ATOM 2528 CG2 THR B 47 17.083 7.470 2.712 1.00 62.10 C ATOM 0 H THR B 47 15.088 5.538 3.191 1.00 3.41 H new ATOM 0 HA THR B 47 17.855 5.037 3.842 1.00 11.44 H new ATOM 0 HB THR B 47 17.704 7.337 4.758 1.00 2.13 H new ATOM 0 HG1 THR B 47 15.608 8.417 4.615 1.00 24.22 H new ATOM 0 HG21 THR B 47 17.060 8.560 2.706 1.00 62.10 H new ATOM 0 HG22 THR B 47 18.046 7.125 2.336 1.00 62.10 H new ATOM 0 HG23 THR B 47 16.286 7.087 2.074 1.00 62.10 H new ATOM 2536 N SER B 48 17.782 5.222 6.518 1.00 54.11 N ATOM 2537 CA SER B 48 17.827 4.751 7.920 1.00 50.12 C ATOM 2538 C SER B 48 16.779 5.457 8.794 1.00 73.23 C ATOM 2539 O SER B 48 16.112 4.808 9.590 1.00 72.23 O ATOM 2540 CB SER B 48 19.228 4.967 8.509 1.00 42.33 C ATOM 2541 OG SER B 48 19.593 6.340 8.451 1.00 13.12 O ATOM 0 H SER B 48 18.593 5.777 6.243 1.00 54.11 H new ATOM 0 HA SER B 48 17.595 3.686 7.914 1.00 50.12 H new ATOM 0 HB2 SER B 48 19.250 4.624 9.543 1.00 42.33 H new ATOM 0 HB3 SER B 48 19.955 4.369 7.959 1.00 42.33 H new ATOM 0 HG SER B 48 20.488 6.457 8.832 1.00 13.12 H new ATOM 2547 N THR B 49 16.652 6.788 8.624 1.00 53.20 N ATOM 2548 CA THR B 49 15.689 7.633 9.369 1.00 22.43 C ATOM 2549 C THR B 49 14.242 7.129 9.183 1.00 11.52 C ATOM 2550 O THR B 49 13.463 7.046 10.139 1.00 34.55 O ATOM 2551 CB THR B 49 15.790 9.124 8.881 1.00 74.40 C ATOM 2552 OG1 THR B 49 17.139 9.602 9.052 1.00 12.33 O ATOM 2553 CG2 THR B 49 14.814 10.076 9.612 1.00 24.33 C ATOM 0 H THR B 49 17.219 7.315 7.960 1.00 53.20 H new ATOM 0 HA THR B 49 15.942 7.574 10.428 1.00 22.43 H new ATOM 0 HB THR B 49 15.509 9.126 7.828 1.00 74.40 H new ATOM 0 HG1 THR B 49 17.198 10.531 8.745 1.00 12.33 H new ATOM 0 HG21 THR B 49 14.936 11.088 9.227 1.00 24.33 H new ATOM 0 HG22 THR B 49 13.789 9.745 9.444 1.00 24.33 H new ATOM 0 HG23 THR B 49 15.028 10.066 10.681 1.00 24.33 H new ATOM 2561 N ILE B 50 13.921 6.770 7.933 1.00 22.43 N ATOM 2562 CA ILE B 50 12.568 6.369 7.530 1.00 44.11 C ATOM 2563 C ILE B 50 12.303 4.904 7.914 1.00 1.30 C ATOM 2564 O ILE B 50 11.257 4.592 8.495 1.00 42.32 O ATOM 2565 CB ILE B 50 12.376 6.601 5.988 1.00 11.31 C ATOM 2566 CG1 ILE B 50 12.643 8.103 5.633 1.00 23.14 C ATOM 2567 CG2 ILE B 50 10.983 6.151 5.499 1.00 14.25 C ATOM 2568 CD1 ILE B 50 11.795 9.120 6.403 1.00 12.43 C ATOM 0 H ILE B 50 14.597 6.750 7.169 1.00 22.43 H new ATOM 0 HA ILE B 50 11.841 6.985 8.059 1.00 44.11 H new ATOM 0 HB ILE B 50 13.104 5.981 5.465 1.00 11.31 H new ATOM 0 HG12 ILE B 50 13.695 8.320 5.815 1.00 23.14 H new ATOM 0 HG13 ILE B 50 12.469 8.243 4.566 1.00 23.14 H new ATOM 0 HG21 ILE B 50 10.898 6.331 4.427 1.00 14.25 H new ATOM 0 HG22 ILE B 50 10.853 5.088 5.700 1.00 14.25 H new ATOM 0 HG23 ILE B 50 10.213 6.716 6.024 1.00 14.25 H new ATOM 0 HD11 ILE B 50 12.057 10.129 6.083 1.00 12.43 H new ATOM 0 HD12 ILE B 50 10.739 8.939 6.203 1.00 12.43 H new ATOM 0 HD13 ILE B 50 11.985 9.017 7.471 1.00 12.43 H new ATOM 2580 N LEU B 51 13.290 4.024 7.630 1.00 24.24 N ATOM 2581 CA LEU B 51 13.200 2.575 7.925 1.00 34.03 C ATOM 2582 C LEU B 51 13.138 2.328 9.445 1.00 55.31 C ATOM 2583 O LEU B 51 12.515 1.362 9.898 1.00 4.41 O ATOM 2584 CB LEU B 51 14.405 1.801 7.303 1.00 60.45 C ATOM 2585 CG LEU B 51 14.317 0.240 7.349 1.00 4.10 C ATOM 2586 CD1 LEU B 51 13.030 -0.277 6.662 1.00 75.34 C ATOM 2587 CD2 LEU B 51 15.581 -0.412 6.743 1.00 63.05 C ATOM 0 H LEU B 51 14.169 4.297 7.191 1.00 24.24 H new ATOM 0 HA LEU B 51 12.281 2.201 7.474 1.00 34.03 H new ATOM 0 HB2 LEU B 51 14.510 2.108 6.262 1.00 60.45 H new ATOM 0 HB3 LEU B 51 15.314 2.109 7.820 1.00 60.45 H new ATOM 0 HG LEU B 51 14.266 -0.054 8.397 1.00 4.10 H new ATOM 0 HD11 LEU B 51 13.002 -1.365 6.713 1.00 75.34 H new ATOM 0 HD12 LEU B 51 12.157 0.132 7.170 1.00 75.34 H new ATOM 0 HD13 LEU B 51 13.023 0.038 5.618 1.00 75.34 H new ATOM 0 HD21 LEU B 51 15.489 -1.497 6.790 1.00 63.05 H new ATOM 0 HD22 LEU B 51 15.688 -0.101 5.704 1.00 63.05 H new ATOM 0 HD23 LEU B 51 16.459 -0.098 7.308 1.00 63.05 H new ATOM 2599 N GLU B 52 13.778 3.236 10.215 1.00 42.45 N ATOM 2600 CA GLU B 52 13.748 3.219 11.688 1.00 3.54 C ATOM 2601 C GLU B 52 12.304 3.353 12.177 1.00 3.43 C ATOM 2602 O GLU B 52 11.850 2.562 13.000 1.00 30.44 O ATOM 2603 CB GLU B 52 14.607 4.370 12.280 1.00 43.54 C ATOM 2604 CG GLU B 52 14.697 4.361 13.818 1.00 24.33 C ATOM 2605 CD GLU B 52 15.491 5.551 14.375 1.00 20.50 C ATOM 2606 OE1 GLU B 52 16.721 5.425 14.579 1.00 24.30 O ATOM 2607 OE2 GLU B 52 14.893 6.629 14.583 1.00 41.30 O ATOM 0 H GLU B 52 14.330 4.001 9.828 1.00 42.45 H new ATOM 0 HA GLU B 52 14.166 2.271 12.026 1.00 3.54 H new ATOM 0 HB2 GLU B 52 15.614 4.307 11.868 1.00 43.54 H new ATOM 0 HB3 GLU B 52 14.190 5.324 11.957 1.00 43.54 H new ATOM 0 HG2 GLU B 52 13.691 4.374 14.236 1.00 24.33 H new ATOM 0 HG3 GLU B 52 15.166 3.433 14.144 1.00 24.33 H new ATOM 2614 N LYS B 53 11.591 4.346 11.608 1.00 20.33 N ATOM 2615 CA LYS B 53 10.194 4.636 11.969 1.00 20.24 C ATOM 2616 C LYS B 53 9.279 3.444 11.651 1.00 21.43 C ATOM 2617 O LYS B 53 8.544 2.966 12.519 1.00 10.52 O ATOM 2618 CB LYS B 53 9.651 5.880 11.217 1.00 72.14 C ATOM 2619 CG LYS B 53 10.439 7.186 11.414 1.00 34.34 C ATOM 2620 CD LYS B 53 9.693 8.406 10.814 1.00 61.05 C ATOM 2621 CE LYS B 53 10.577 9.639 10.656 1.00 41.31 C ATOM 2622 NZ LYS B 53 11.139 10.122 11.946 1.00 54.34 N ATOM 0 H LYS B 53 11.967 4.965 10.890 1.00 20.33 H new ATOM 0 HA LYS B 53 10.190 4.832 13.041 1.00 20.24 H new ATOM 0 HB2 LYS B 53 9.625 5.652 10.151 1.00 72.14 H new ATOM 0 HB3 LYS B 53 8.621 6.049 11.532 1.00 72.14 H new ATOM 0 HG2 LYS B 53 10.608 7.351 12.478 1.00 34.34 H new ATOM 0 HG3 LYS B 53 11.419 7.093 10.946 1.00 34.34 H new ATOM 0 HD2 LYS B 53 9.288 8.132 9.840 1.00 61.05 H new ATOM 0 HD3 LYS B 53 8.846 8.655 11.453 1.00 61.05 H new ATOM 0 HE2 LYS B 53 11.395 9.407 9.974 1.00 41.31 H new ATOM 0 HE3 LYS B 53 9.996 10.439 10.197 1.00 41.31 H new ATOM 0 HZ1 LYS B 53 11.730 10.960 11.775 1.00 54.34 H new ATOM 0 HZ2 LYS B 53 10.362 10.372 12.591 1.00 54.34 H new ATOM 0 HZ3 LYS B 53 11.718 9.372 12.375 1.00 54.34 H new ATOM 2636 N VAL B 54 9.371 2.968 10.397 1.00 43.24 N ATOM 2637 CA VAL B 54 8.471 1.934 9.866 1.00 3.20 C ATOM 2638 C VAL B 54 8.608 0.627 10.683 1.00 62.41 C ATOM 2639 O VAL B 54 7.604 0.048 11.111 1.00 52.45 O ATOM 2640 CB VAL B 54 8.735 1.676 8.328 1.00 1.11 C ATOM 2641 CG1 VAL B 54 7.744 0.642 7.758 1.00 61.21 C ATOM 2642 CG2 VAL B 54 8.660 2.994 7.519 1.00 74.41 C ATOM 0 H VAL B 54 10.069 3.289 9.727 1.00 43.24 H new ATOM 0 HA VAL B 54 7.447 2.293 9.964 1.00 3.20 H new ATOM 0 HB VAL B 54 9.743 1.272 8.234 1.00 1.11 H new ATOM 0 HG11 VAL B 54 7.950 0.486 6.699 1.00 61.21 H new ATOM 0 HG12 VAL B 54 7.855 -0.301 8.293 1.00 61.21 H new ATOM 0 HG13 VAL B 54 6.725 1.010 7.879 1.00 61.21 H new ATOM 0 HG21 VAL B 54 8.846 2.785 6.465 1.00 74.41 H new ATOM 0 HG22 VAL B 54 7.670 3.435 7.633 1.00 74.41 H new ATOM 0 HG23 VAL B 54 9.412 3.691 7.889 1.00 74.41 H new ATOM 2652 N LEU B 55 9.868 0.232 10.963 1.00 35.35 N ATOM 2653 CA LEU B 55 10.185 -1.000 11.721 1.00 62.30 C ATOM 2654 C LEU B 55 9.898 -0.853 13.232 1.00 14.54 C ATOM 2655 O LEU B 55 9.580 -1.845 13.899 1.00 12.25 O ATOM 2656 CB LEU B 55 11.661 -1.426 11.490 1.00 54.44 C ATOM 2657 CG LEU B 55 12.032 -1.876 10.041 1.00 34.40 C ATOM 2658 CD1 LEU B 55 13.506 -2.328 9.976 1.00 45.45 C ATOM 2659 CD2 LEU B 55 11.071 -2.979 9.520 1.00 74.12 C ATOM 0 H LEU B 55 10.693 0.756 10.671 1.00 35.35 H new ATOM 0 HA LEU B 55 9.527 -1.781 11.341 1.00 62.30 H new ATOM 0 HB2 LEU B 55 12.305 -0.591 11.764 1.00 54.44 H new ATOM 0 HB3 LEU B 55 11.892 -2.244 12.172 1.00 54.44 H new ATOM 0 HG LEU B 55 11.913 -1.017 9.380 1.00 34.40 H new ATOM 0 HD11 LEU B 55 13.747 -2.638 8.959 1.00 45.45 H new ATOM 0 HD12 LEU B 55 14.153 -1.501 10.266 1.00 45.45 H new ATOM 0 HD13 LEU B 55 13.660 -3.165 10.657 1.00 45.45 H new ATOM 0 HD21 LEU B 55 11.361 -3.266 8.509 1.00 74.12 H new ATOM 0 HD22 LEU B 55 11.127 -3.849 10.174 1.00 74.12 H new ATOM 0 HD23 LEU B 55 10.050 -2.597 9.510 1.00 74.12 H new ATOM 2671 N ASP B 56 10.010 0.379 13.763 1.00 35.10 N ATOM 2672 CA ASP B 56 9.742 0.659 15.196 1.00 62.53 C ATOM 2673 C ASP B 56 8.228 0.608 15.480 1.00 12.34 C ATOM 2674 O ASP B 56 7.794 0.137 16.543 1.00 42.10 O ATOM 2675 CB ASP B 56 10.336 2.033 15.620 1.00 12.04 C ATOM 2676 CG ASP B 56 10.211 2.338 17.127 1.00 22.42 C ATOM 2677 OD1 ASP B 56 10.366 1.410 17.951 1.00 2.42 O ATOM 2678 OD2 ASP B 56 9.995 3.508 17.505 1.00 72.31 O ATOM 0 H ASP B 56 10.284 1.201 13.225 1.00 35.10 H new ATOM 0 HA ASP B 56 10.232 -0.113 15.789 1.00 62.53 H new ATOM 0 HB2 ASP B 56 11.389 2.063 15.341 1.00 12.04 H new ATOM 0 HB3 ASP B 56 9.835 2.822 15.058 1.00 12.04 H new ATOM 2683 N TYR B 57 7.431 1.078 14.505 1.00 51.30 N ATOM 2684 CA TYR B 57 5.959 0.990 14.567 1.00 20.31 C ATOM 2685 C TYR B 57 5.514 -0.468 14.387 1.00 73.55 C ATOM 2686 O TYR B 57 4.534 -0.900 15.000 1.00 22.21 O ATOM 2687 CB TYR B 57 5.285 1.879 13.490 1.00 22.24 C ATOM 2688 CG TYR B 57 3.744 1.891 13.588 1.00 41.00 C ATOM 2689 CD1 TYR B 57 3.093 2.707 14.518 1.00 60.41 C ATOM 2690 CD2 TYR B 57 2.949 1.062 12.784 1.00 33.30 C ATOM 2691 CE1 TYR B 57 1.718 2.693 14.643 1.00 63.44 C ATOM 2692 CE2 TYR B 57 1.573 1.053 12.901 1.00 62.55 C ATOM 2693 CZ TYR B 57 0.963 1.869 13.833 1.00 21.13 C ATOM 2694 OH TYR B 57 -0.407 1.844 13.972 1.00 71.22 O ATOM 0 H TYR B 57 7.783 1.526 13.659 1.00 51.30 H new ATOM 0 HA TYR B 57 5.646 1.353 15.546 1.00 20.31 H new ATOM 0 HB2 TYR B 57 5.657 2.899 13.586 1.00 22.24 H new ATOM 0 HB3 TYR B 57 5.577 1.525 12.501 1.00 22.24 H new ATOM 0 HD1 TYR B 57 3.676 3.360 15.150 1.00 60.41 H new ATOM 0 HD2 TYR B 57 3.422 0.417 12.058 1.00 33.30 H new ATOM 0 HE1 TYR B 57 1.234 3.325 15.373 1.00 63.44 H new ATOM 0 HE2 TYR B 57 0.978 0.412 12.268 1.00 62.55 H new ATOM 0 HH TYR B 57 -0.720 2.719 14.282 1.00 71.22 H new ATOM 2704 N CYS B 58 6.234 -1.209 13.518 1.00 64.30 N ATOM 2705 CA CYS B 58 6.012 -2.651 13.322 1.00 1.50 C ATOM 2706 C CYS B 58 6.268 -3.422 14.628 1.00 12.52 C ATOM 2707 O CYS B 58 5.525 -4.349 14.966 1.00 61.44 O ATOM 2708 CB CYS B 58 6.912 -3.199 12.196 1.00 22.14 C ATOM 2709 SG CYS B 58 6.517 -2.528 10.585 1.00 63.41 S ATOM 0 H CYS B 58 6.980 -0.825 12.938 1.00 64.30 H new ATOM 0 HA CYS B 58 4.971 -2.793 13.031 1.00 1.50 H new ATOM 0 HB2 CYS B 58 7.953 -2.975 12.430 1.00 22.14 H new ATOM 0 HB3 CYS B 58 6.820 -4.285 12.162 1.00 22.14 H new ATOM 0 HG CYS B 58 6.913 -1.292 10.521 1.00 63.41 H new ATOM 2715 N ARG B 59 7.330 -3.010 15.353 1.00 35.54 N ATOM 2716 CA ARG B 59 7.690 -3.580 16.668 1.00 14.24 C ATOM 2717 C ARG B 59 6.558 -3.337 17.684 1.00 44.25 C ATOM 2718 O ARG B 59 6.136 -4.262 18.378 1.00 45.10 O ATOM 2719 CB ARG B 59 9.043 -2.991 17.179 1.00 63.00 C ATOM 2720 CG ARG B 59 9.436 -3.422 18.614 1.00 25.15 C ATOM 2721 CD ARG B 59 10.905 -3.119 18.963 1.00 61.20 C ATOM 2722 NE ARG B 59 11.272 -1.693 18.828 1.00 21.11 N ATOM 2723 CZ ARG B 59 12.531 -1.213 18.954 1.00 44.14 C ATOM 2724 NH1 ARG B 59 13.559 -2.026 19.200 1.00 1.14 N ATOM 2725 NH2 ARG B 59 12.756 0.082 18.818 1.00 13.34 N ATOM 0 H ARG B 59 7.962 -2.272 15.042 1.00 35.54 H new ATOM 0 HA ARG B 59 7.821 -4.656 16.555 1.00 14.24 H new ATOM 0 HB2 ARG B 59 9.836 -3.291 16.494 1.00 63.00 H new ATOM 0 HB3 ARG B 59 8.986 -1.903 17.144 1.00 63.00 H new ATOM 0 HG2 ARG B 59 8.788 -2.914 19.328 1.00 25.15 H new ATOM 0 HG3 ARG B 59 9.257 -4.491 18.726 1.00 25.15 H new ATOM 0 HD2 ARG B 59 11.098 -3.438 19.987 1.00 61.20 H new ATOM 0 HD3 ARG B 59 11.551 -3.713 18.317 1.00 61.20 H new ATOM 0 HE ARG B 59 10.526 -1.027 18.626 1.00 21.11 H new ATOM 0 HH11 ARG B 59 13.404 -3.029 19.297 1.00 1.14 H new ATOM 0 HH12 ARG B 59 14.500 -1.644 19.292 1.00 1.14 H new ATOM 0 HH21 ARG B 59 11.982 0.716 18.619 1.00 13.34 H new ATOM 0 HH22 ARG B 59 13.704 0.448 18.912 1.00 13.34 H new ATOM 2739 N HIS B 60 6.048 -2.090 17.704 1.00 24.22 N ATOM 2740 CA HIS B 60 4.910 -1.670 18.556 1.00 72.54 C ATOM 2741 C HIS B 60 3.634 -2.483 18.245 1.00 31.02 C ATOM 2742 O HIS B 60 2.919 -2.912 19.157 1.00 10.40 O ATOM 2743 CB HIS B 60 4.642 -0.154 18.350 1.00 14.31 C ATOM 2744 CG HIS B 60 3.429 0.383 19.074 1.00 15.31 C ATOM 2745 ND1 HIS B 60 3.424 0.679 20.418 1.00 3.21 N ATOM 2746 CD2 HIS B 60 2.184 0.677 18.627 1.00 12.53 C ATOM 2747 CE1 HIS B 60 2.232 1.127 20.763 1.00 51.24 C ATOM 2748 NE2 HIS B 60 1.461 1.138 19.694 1.00 53.21 N ATOM 0 H HIS B 60 6.416 -1.336 17.124 1.00 24.22 H new ATOM 0 HA HIS B 60 5.174 -1.860 19.596 1.00 72.54 H new ATOM 0 HB2 HIS B 60 5.519 0.403 18.679 1.00 14.31 H new ATOM 0 HB3 HIS B 60 4.524 0.037 17.283 1.00 14.31 H new ATOM 0 HD2 HIS B 60 1.827 0.568 17.614 1.00 12.53 H new ATOM 0 HE1 HIS B 60 1.937 1.434 21.756 1.00 51.24 H new ATOM 0 HE2 HIS B 60 0.487 1.440 19.666 1.00 53.21 H new ATOM 2757 N HIS B 61 3.380 -2.686 16.947 1.00 43.13 N ATOM 2758 CA HIS B 61 2.188 -3.395 16.448 1.00 33.33 C ATOM 2759 C HIS B 61 2.328 -4.917 16.653 1.00 35.14 C ATOM 2760 O HIS B 61 1.334 -5.645 16.630 1.00 62.34 O ATOM 2761 CB HIS B 61 1.983 -3.071 14.947 1.00 43.40 C ATOM 2762 CG HIS B 61 0.686 -3.585 14.382 1.00 60.02 C ATOM 2763 ND1 HIS B 61 0.539 -4.844 13.830 1.00 21.10 N ATOM 2764 CD2 HIS B 61 -0.531 -3.006 14.300 1.00 5.20 C ATOM 2765 CE1 HIS B 61 -0.704 -5.007 13.434 1.00 23.01 C ATOM 2766 NE2 HIS B 61 -1.376 -3.912 13.711 1.00 15.31 N ATOM 0 H HIS B 61 3.999 -2.361 16.204 1.00 43.13 H new ATOM 0 HA HIS B 61 1.318 -3.058 17.012 1.00 33.33 H new ATOM 0 HB2 HIS B 61 2.024 -1.990 14.810 1.00 43.40 H new ATOM 0 HB3 HIS B 61 2.810 -3.496 14.378 1.00 43.40 H new ATOM 0 HD1 HIS B 61 1.280 -5.539 13.743 1.00 21.10 H new ATOM 0 HD2 HIS B 61 -0.791 -2.013 14.636 1.00 5.20 H new ATOM 0 HE1 HIS B 61 -1.105 -5.891 12.961 1.00 23.01 H new ATOM 2775 N HIS B 62 3.572 -5.393 16.803 1.00 22.34 N ATOM 2776 CA HIS B 62 3.853 -6.803 17.127 1.00 74.24 C ATOM 2777 C HIS B 62 3.668 -7.039 18.640 1.00 3.53 C ATOM 2778 O HIS B 62 3.216 -8.109 19.062 1.00 24.11 O ATOM 2779 CB HIS B 62 5.287 -7.178 16.676 1.00 1.31 C ATOM 2780 CG HIS B 62 5.650 -8.623 16.887 1.00 30.20 C ATOM 2781 ND1 HIS B 62 5.264 -9.619 16.018 1.00 51.25 N ATOM 2782 CD2 HIS B 62 6.361 -9.240 17.863 1.00 73.43 C ATOM 2783 CE1 HIS B 62 5.708 -10.776 16.454 1.00 71.15 C ATOM 2784 NE2 HIS B 62 6.376 -10.569 17.567 1.00 52.11 N ATOM 0 H HIS B 62 4.408 -4.818 16.704 1.00 22.34 H new ATOM 0 HA HIS B 62 3.152 -7.443 16.591 1.00 74.24 H new ATOM 0 HB2 HIS B 62 5.395 -6.940 15.618 1.00 1.31 H new ATOM 0 HB3 HIS B 62 5.999 -6.555 17.217 1.00 1.31 H new ATOM 0 HD2 HIS B 62 6.827 -8.767 18.714 1.00 73.43 H new ATOM 0 HE1 HIS B 62 5.551 -11.733 15.979 1.00 71.15 H new ATOM 0 HE2 HIS B 62 6.834 -11.291 18.122 1.00 52.11 H new ATOM 2793 N GLN B 63 4.024 -6.015 19.433 1.00 73.42 N ATOM 2794 CA GLN B 63 3.881 -6.022 20.903 1.00 43.24 C ATOM 2795 C GLN B 63 2.399 -5.941 21.308 1.00 62.30 C ATOM 2796 O GLN B 63 1.980 -6.548 22.299 1.00 0.25 O ATOM 2797 CB GLN B 63 4.665 -4.828 21.517 1.00 65.25 C ATOM 2798 CG GLN B 63 6.201 -4.968 21.467 1.00 54.02 C ATOM 2799 CD GLN B 63 6.948 -3.705 21.919 1.00 52.42 C ATOM 2800 OE1 GLN B 63 6.594 -2.583 21.537 1.00 32.42 O ATOM 2801 NE2 GLN B 63 7.927 -3.867 22.795 1.00 25.30 N ATOM 0 H GLN B 63 4.423 -5.149 19.070 1.00 73.42 H new ATOM 0 HA GLN B 63 4.291 -6.957 21.285 1.00 43.24 H new ATOM 0 HB2 GLN B 63 4.380 -3.916 20.992 1.00 65.25 H new ATOM 0 HB3 GLN B 63 4.359 -4.707 22.556 1.00 65.25 H new ATOM 0 HG2 GLN B 63 6.502 -5.804 22.099 1.00 54.02 H new ATOM 0 HG3 GLN B 63 6.502 -5.213 20.449 1.00 54.02 H new ATOM 0 HE21 GLN B 63 8.196 -4.805 23.091 1.00 25.30 H new ATOM 0 HE22 GLN B 63 8.412 -3.054 23.174 1.00 25.30 H new ATOM 2810 N HIS B 64 1.626 -5.168 20.534 1.00 63.33 N ATOM 2811 CA HIS B 64 0.177 -4.997 20.722 1.00 11.24 C ATOM 2812 C HIS B 64 -0.519 -5.051 19.342 1.00 2.14 C ATOM 2813 O HIS B 64 -0.665 -4.011 18.677 1.00 71.21 O ATOM 2814 CB HIS B 64 -0.141 -3.657 21.459 1.00 61.20 C ATOM 2815 CG HIS B 64 0.333 -3.607 22.892 1.00 62.43 C ATOM 2816 ND1 HIS B 64 -0.424 -4.068 23.945 1.00 23.34 N ATOM 2817 CD2 HIS B 64 1.493 -3.168 23.435 1.00 4.21 C ATOM 2818 CE1 HIS B 64 0.248 -3.916 25.069 1.00 54.34 C ATOM 2819 NE2 HIS B 64 1.411 -3.373 24.789 1.00 3.34 N ATOM 0 H HIS B 64 1.995 -4.635 19.747 1.00 63.33 H new ATOM 0 HA HIS B 64 -0.202 -5.805 21.349 1.00 11.24 H new ATOM 0 HB2 HIS B 64 0.317 -2.836 20.908 1.00 61.20 H new ATOM 0 HB3 HIS B 64 -1.218 -3.492 21.439 1.00 61.20 H new ATOM 0 HD2 HIS B 64 2.327 -2.737 22.902 1.00 4.21 H new ATOM 0 HE1 HIS B 64 -0.099 -4.191 26.054 1.00 54.34 H new ATOM 0 HE2 HIS B 64 2.136 -3.141 25.468 1.00 3.34 H new ATOM 2828 N PRO B 65 -0.856 -6.282 18.830 1.00 24.05 N ATOM 2829 CA PRO B 65 -1.658 -6.437 17.596 1.00 31.41 C ATOM 2830 C PRO B 65 -3.126 -6.000 17.824 1.00 65.02 C ATOM 2831 O PRO B 65 -3.513 -4.899 17.410 1.00 15.24 O ATOM 2832 CB PRO B 65 -1.522 -7.955 17.243 1.00 54.50 C ATOM 2833 CG PRO B 65 -0.404 -8.464 18.120 1.00 71.05 C ATOM 2834 CD PRO B 65 -0.439 -7.603 19.361 1.00 11.21 C ATOM 0 HA PRO B 65 -1.312 -5.805 16.778 1.00 31.41 H new ATOM 0 HB2 PRO B 65 -2.451 -8.490 17.439 1.00 54.50 H new ATOM 0 HB3 PRO B 65 -1.290 -8.095 16.187 1.00 54.50 H new ATOM 0 HG2 PRO B 65 -0.548 -9.516 18.368 1.00 71.05 H new ATOM 0 HG3 PRO B 65 0.558 -8.384 17.614 1.00 71.05 H new ATOM 0 HD2 PRO B 65 -1.145 -7.984 20.098 1.00 11.21 H new ATOM 0 HD3 PRO B 65 0.535 -7.555 19.848 1.00 11.21 H new ATOM 2842 N GLY B 66 -3.912 -6.874 18.512 1.00 73.12 N ATOM 2843 CA GLY B 66 -5.325 -6.624 18.843 1.00 53.03 C ATOM 2844 C GLY B 66 -6.153 -6.134 17.658 1.00 74.13 C ATOM 2845 O GLY B 66 -6.099 -6.727 16.567 1.00 4.02 O ATOM 0 H GLY B 66 -3.571 -7.774 18.850 1.00 73.12 H new ATOM 0 HA2 GLY B 66 -5.767 -7.542 19.229 1.00 53.03 H new ATOM 0 HA3 GLY B 66 -5.377 -5.885 19.642 1.00 53.03 H new ATOM 2849 N GLY B 67 -6.908 -5.049 17.876 1.00 14.32 N ATOM 2850 CA GLY B 67 -7.574 -4.313 16.802 1.00 11.24 C ATOM 2851 C GLY B 67 -6.761 -3.090 16.368 1.00 42.10 C ATOM 2852 O GLY B 67 -7.190 -2.345 15.473 1.00 64.11 O ATOM 0 H GLY B 67 -7.072 -4.659 18.804 1.00 14.32 H new ATOM 0 HA2 GLY B 67 -7.725 -4.972 15.947 1.00 11.24 H new ATOM 0 HA3 GLY B 67 -8.561 -3.994 17.136 1.00 11.24 H new ATOM 2856 N SER B 68 -5.585 -2.887 17.025 1.00 62.35 N ATOM 2857 CA SER B 68 -4.679 -1.735 16.801 1.00 34.11 C ATOM 2858 C SER B 68 -5.341 -0.418 17.298 1.00 1.53 C ATOM 2859 O SER B 68 -6.150 -0.464 18.239 1.00 12.00 O ATOM 2860 CB SER B 68 -4.231 -1.692 15.306 1.00 5.14 C ATOM 2861 OG SER B 68 -3.723 -2.961 14.898 1.00 4.32 O ATOM 0 H SER B 68 -5.239 -3.532 17.735 1.00 62.35 H new ATOM 0 HA SER B 68 -3.770 -1.853 17.391 1.00 34.11 H new ATOM 0 HB2 SER B 68 -5.075 -1.412 14.676 1.00 5.14 H new ATOM 0 HB3 SER B 68 -3.466 -0.928 15.172 1.00 5.14 H new ATOM 0 HG SER B 68 -3.038 -2.833 14.209 1.00 4.32 H new ATOM 2867 N GLY B 69 -4.984 0.738 16.684 1.00 12.21 N ATOM 2868 CA GLY B 69 -5.492 2.052 17.113 1.00 51.32 C ATOM 2869 C GLY B 69 -7.024 2.200 17.005 1.00 64.14 C ATOM 2870 O GLY B 69 -7.618 2.942 17.798 1.00 10.32 O ATOM 0 H GLY B 69 -4.345 0.780 15.890 1.00 12.21 H new ATOM 0 HA2 GLY B 69 -5.193 2.226 18.147 1.00 51.32 H new ATOM 0 HA3 GLY B 69 -5.019 2.827 16.510 1.00 51.32 H new ATOM 2874 N LEU B 70 -7.646 1.464 16.036 1.00 71.31 N ATOM 2875 CA LEU B 70 -9.110 1.487 15.745 1.00 20.04 C ATOM 2876 C LEU B 70 -9.595 2.924 15.408 1.00 73.25 C ATOM 2877 O LEU B 70 -9.596 3.331 14.237 1.00 1.20 O ATOM 2878 CB LEU B 70 -9.946 0.831 16.904 1.00 34.42 C ATOM 2879 CG LEU B 70 -9.746 -0.704 17.112 1.00 25.23 C ATOM 2880 CD1 LEU B 70 -10.449 -1.183 18.399 1.00 52.14 C ATOM 2881 CD2 LEU B 70 -10.238 -1.508 15.878 1.00 34.23 C ATOM 0 H LEU B 70 -7.133 0.828 15.426 1.00 71.31 H new ATOM 0 HA LEU B 70 -9.280 0.876 14.858 1.00 20.04 H new ATOM 0 HB2 LEU B 70 -9.698 1.339 17.836 1.00 34.42 H new ATOM 0 HB3 LEU B 70 -11.003 1.016 16.712 1.00 34.42 H new ATOM 0 HG LEU B 70 -8.677 -0.887 17.223 1.00 25.23 H new ATOM 0 HD11 LEU B 70 -10.294 -2.255 18.521 1.00 52.14 H new ATOM 0 HD12 LEU B 70 -10.033 -0.657 19.258 1.00 52.14 H new ATOM 0 HD13 LEU B 70 -11.517 -0.976 18.329 1.00 52.14 H new ATOM 0 HD21 LEU B 70 -10.085 -2.573 16.053 1.00 34.23 H new ATOM 0 HD22 LEU B 70 -11.299 -1.315 15.717 1.00 34.23 H new ATOM 0 HD23 LEU B 70 -9.676 -1.201 14.996 1.00 34.23 H new ATOM 2893 N ASP B 71 -9.970 3.673 16.457 1.00 33.31 N ATOM 2894 CA ASP B 71 -10.370 5.100 16.390 1.00 42.54 C ATOM 2895 C ASP B 71 -9.830 5.860 17.638 1.00 55.22 C ATOM 2896 O ASP B 71 -9.794 7.097 17.666 1.00 5.14 O ATOM 2897 CB ASP B 71 -11.916 5.218 16.279 1.00 35.11 C ATOM 2898 CG ASP B 71 -12.402 6.664 16.048 1.00 51.43 C ATOM 2899 OD1 ASP B 71 -12.122 7.231 14.965 1.00 13.14 O ATOM 2900 OD2 ASP B 71 -13.061 7.247 16.941 1.00 31.23 O ATOM 0 H ASP B 71 -10.007 3.298 17.405 1.00 33.31 H new ATOM 0 HA ASP B 71 -9.936 5.557 15.501 1.00 42.54 H new ATOM 0 HB2 ASP B 71 -12.264 4.590 15.459 1.00 35.11 H new ATOM 0 HB3 ASP B 71 -12.370 4.831 17.191 1.00 35.11 H new ATOM 2905 N ASP B 72 -9.398 5.089 18.662 1.00 22.33 N ATOM 2906 CA ASP B 72 -8.787 5.604 19.900 1.00 22.02 C ATOM 2907 C ASP B 72 -7.497 6.387 19.585 1.00 2.34 C ATOM 2908 O ASP B 72 -7.385 7.583 19.909 1.00 61.35 O ATOM 2909 CB ASP B 72 -8.495 4.396 20.848 1.00 11.52 C ATOM 2910 CG ASP B 72 -7.606 4.764 22.056 1.00 4.04 C ATOM 2911 OD1 ASP B 72 -6.374 4.508 22.015 1.00 30.33 O ATOM 2912 OD2 ASP B 72 -8.127 5.320 23.046 1.00 24.14 O ATOM 0 H ASP B 72 -9.468 4.072 18.646 1.00 22.33 H new ATOM 0 HA ASP B 72 -9.472 6.295 20.392 1.00 22.02 H new ATOM 0 HB2 ASP B 72 -9.440 3.993 21.212 1.00 11.52 H new ATOM 0 HB3 ASP B 72 -8.009 3.605 20.277 1.00 11.52 H new ATOM 2917 N ILE B 73 -6.559 5.684 18.916 1.00 54.53 N ATOM 2918 CA ILE B 73 -5.218 6.178 18.556 1.00 40.42 C ATOM 2919 C ILE B 73 -4.403 6.536 19.832 1.00 42.12 C ATOM 2920 O ILE B 73 -4.590 7.624 20.406 1.00 22.31 O ATOM 2921 CB ILE B 73 -5.255 7.391 17.530 1.00 2.44 C ATOM 2922 CG1 ILE B 73 -6.087 7.020 16.253 1.00 35.21 C ATOM 2923 CG2 ILE B 73 -3.820 7.843 17.149 1.00 31.20 C ATOM 2924 CD1 ILE B 73 -5.541 5.849 15.439 1.00 12.21 C ATOM 0 H ILE B 73 -6.722 4.727 18.603 1.00 54.53 H new ATOM 0 HA ILE B 73 -4.712 5.364 18.038 1.00 40.42 H new ATOM 0 HB ILE B 73 -5.749 8.230 18.020 1.00 2.44 H new ATOM 0 HG12 ILE B 73 -7.107 6.785 16.559 1.00 35.21 H new ATOM 0 HG13 ILE B 73 -6.142 7.896 15.607 1.00 35.21 H new ATOM 0 HG21 ILE B 73 -3.875 8.674 16.446 1.00 31.20 H new ATOM 0 HG22 ILE B 73 -3.289 8.161 18.046 1.00 31.20 H new ATOM 0 HG23 ILE B 73 -3.287 7.012 16.687 1.00 31.20 H new ATOM 0 HD11 ILE B 73 -6.186 5.672 14.578 1.00 12.21 H new ATOM 0 HD12 ILE B 73 -4.533 6.083 15.095 1.00 12.21 H new ATOM 0 HD13 ILE B 73 -5.513 4.955 16.062 1.00 12.21 H new ATOM 2936 N PRO B 74 -3.524 5.600 20.325 1.00 52.43 N ATOM 2937 CA PRO B 74 -2.636 5.859 21.491 1.00 72.52 C ATOM 2938 C PRO B 74 -1.686 7.075 21.266 1.00 1.52 C ATOM 2939 O PRO B 74 -1.349 7.380 20.113 1.00 60.32 O ATOM 2940 CB PRO B 74 -1.847 4.527 21.644 1.00 75.24 C ATOM 2941 CG PRO B 74 -2.707 3.491 20.983 1.00 35.14 C ATOM 2942 CD PRO B 74 -3.350 4.204 19.817 1.00 53.31 C ATOM 0 HA PRO B 74 -3.197 6.129 22.386 1.00 72.52 H new ATOM 0 HB2 PRO B 74 -0.869 4.590 21.168 1.00 75.24 H new ATOM 0 HB3 PRO B 74 -1.676 4.287 22.693 1.00 75.24 H new ATOM 0 HG2 PRO B 74 -2.113 2.641 20.647 1.00 35.14 H new ATOM 0 HG3 PRO B 74 -3.458 3.103 21.672 1.00 35.14 H new ATOM 0 HD2 PRO B 74 -2.719 4.174 18.929 1.00 53.31 H new ATOM 0 HD3 PRO B 74 -4.304 3.752 19.545 1.00 53.31 H new ATOM 2950 N PRO B 75 -1.249 7.782 22.369 1.00 13.20 N ATOM 2951 CA PRO B 75 -0.398 9.006 22.291 1.00 31.20 C ATOM 2952 C PRO B 75 0.866 8.811 21.427 1.00 11.24 C ATOM 2953 O PRO B 75 1.144 9.638 20.556 1.00 32.02 O ATOM 2954 CB PRO B 75 -0.035 9.303 23.782 1.00 42.10 C ATOM 2955 CG PRO B 75 -0.417 8.062 24.543 1.00 22.01 C ATOM 2956 CD PRO B 75 -1.575 7.464 23.785 1.00 35.33 C ATOM 0 HA PRO B 75 -0.922 9.829 21.805 1.00 31.20 H new ATOM 0 HB2 PRO B 75 1.028 9.519 23.892 1.00 42.10 H new ATOM 0 HB3 PRO B 75 -0.577 10.173 24.152 1.00 42.10 H new ATOM 0 HG2 PRO B 75 0.418 7.363 24.599 1.00 22.01 H new ATOM 0 HG3 PRO B 75 -0.701 8.302 25.568 1.00 22.01 H new ATOM 0 HD2 PRO B 75 -1.653 6.389 23.949 1.00 35.33 H new ATOM 0 HD3 PRO B 75 -2.526 7.903 24.089 1.00 35.33 H new ATOM 2964 N TYR B 76 1.589 7.688 21.659 1.00 73.24 N ATOM 2965 CA TYR B 76 2.788 7.322 20.874 1.00 32.23 C ATOM 2966 C TYR B 76 2.478 7.281 19.368 1.00 51.11 C ATOM 2967 O TYR B 76 3.178 7.911 18.580 1.00 24.35 O ATOM 2968 CB TYR B 76 3.370 5.943 21.330 1.00 44.40 C ATOM 2969 CG TYR B 76 4.367 5.315 20.327 1.00 32.51 C ATOM 2970 CD1 TYR B 76 5.640 5.857 20.139 1.00 41.24 C ATOM 2971 CD2 TYR B 76 4.010 4.207 19.545 1.00 61.52 C ATOM 2972 CE1 TYR B 76 6.512 5.320 19.205 1.00 15.33 C ATOM 2973 CE2 TYR B 76 4.884 3.671 18.621 1.00 60.15 C ATOM 2974 CZ TYR B 76 6.128 4.226 18.453 1.00 34.03 C ATOM 2975 OH TYR B 76 6.986 3.700 17.508 1.00 41.22 O ATOM 0 H TYR B 76 1.357 7.016 22.391 1.00 73.24 H new ATOM 0 HA TYR B 76 3.536 8.094 21.057 1.00 32.23 H new ATOM 0 HB2 TYR B 76 3.870 6.071 22.290 1.00 44.40 H new ATOM 0 HB3 TYR B 76 2.546 5.248 21.490 1.00 44.40 H new ATOM 0 HD1 TYR B 76 5.950 6.707 20.730 1.00 41.24 H new ATOM 0 HD2 TYR B 76 3.032 3.765 19.668 1.00 61.52 H new ATOM 0 HE1 TYR B 76 7.490 5.756 19.065 1.00 15.33 H new ATOM 0 HE2 TYR B 76 4.589 2.816 18.031 1.00 60.15 H new ATOM 0 HH TYR B 76 7.911 3.797 17.816 1.00 41.22 H new ATOM 2985 N ASP B 77 1.417 6.544 19.008 1.00 30.34 N ATOM 2986 CA ASP B 77 1.050 6.263 17.606 1.00 53.42 C ATOM 2987 C ASP B 77 0.720 7.561 16.843 1.00 22.24 C ATOM 2988 O ASP B 77 1.008 7.674 15.645 1.00 62.44 O ATOM 2989 CB ASP B 77 -0.156 5.281 17.549 1.00 73.52 C ATOM 2990 CG ASP B 77 0.136 3.901 18.174 1.00 53.53 C ATOM 2991 OD1 ASP B 77 -0.001 2.861 17.483 1.00 12.54 O ATOM 2992 OD2 ASP B 77 0.507 3.850 19.367 1.00 53.03 O ATOM 0 H ASP B 77 0.782 6.121 19.685 1.00 30.34 H new ATOM 0 HA ASP B 77 1.908 5.798 17.121 1.00 53.42 H new ATOM 0 HB2 ASP B 77 -1.004 5.731 18.065 1.00 73.52 H new ATOM 0 HB3 ASP B 77 -0.452 5.143 16.509 1.00 73.52 H new ATOM 2997 N ARG B 78 0.138 8.544 17.561 1.00 61.24 N ATOM 2998 CA ARG B 78 -0.223 9.842 16.969 1.00 61.24 C ATOM 2999 C ARG B 78 1.041 10.693 16.742 1.00 31.42 C ATOM 3000 O ARG B 78 1.327 11.086 15.609 1.00 14.22 O ATOM 3001 CB ARG B 78 -1.251 10.595 17.861 1.00 11.30 C ATOM 3002 CG ARG B 78 -1.887 11.821 17.172 1.00 74.25 C ATOM 3003 CD ARG B 78 -2.912 12.549 18.053 1.00 30.32 C ATOM 3004 NE ARG B 78 -2.287 13.211 19.212 1.00 0.23 N ATOM 3005 CZ ARG B 78 -2.938 13.973 20.112 1.00 65.32 C ATOM 3006 NH1 ARG B 78 -4.259 14.169 20.028 1.00 12.52 N ATOM 3007 NH2 ARG B 78 -2.257 14.558 21.089 1.00 1.34 N ATOM 0 H ARG B 78 -0.091 8.460 18.552 1.00 61.24 H new ATOM 0 HA ARG B 78 -0.695 9.662 16.003 1.00 61.24 H new ATOM 0 HB2 ARG B 78 -2.041 9.903 18.154 1.00 11.30 H new ATOM 0 HB3 ARG B 78 -0.756 10.919 18.776 1.00 11.30 H new ATOM 0 HG2 ARG B 78 -1.099 12.520 16.890 1.00 74.25 H new ATOM 0 HG3 ARG B 78 -2.373 11.500 16.251 1.00 74.25 H new ATOM 0 HD2 ARG B 78 -3.439 13.292 17.454 1.00 30.32 H new ATOM 0 HD3 ARG B 78 -3.657 11.835 18.404 1.00 30.32 H new ATOM 0 HE ARG B 78 -1.284 13.082 19.343 1.00 0.23 H new ATOM 0 HH11 ARG B 78 -4.792 13.738 19.272 1.00 12.52 H new ATOM 0 HH12 ARG B 78 -4.733 14.750 20.720 1.00 12.52 H new ATOM 0 HH21 ARG B 78 -1.247 14.429 21.155 1.00 1.34 H new ATOM 0 HH22 ARG B 78 -2.743 15.136 21.774 1.00 1.34 H new ATOM 3021 N ASP B 79 1.825 10.900 17.826 1.00 64.54 N ATOM 3022 CA ASP B 79 3.080 11.702 17.799 1.00 12.41 C ATOM 3023 C ASP B 79 4.101 11.131 16.793 1.00 25.11 C ATOM 3024 O ASP B 79 4.887 11.877 16.195 1.00 24.04 O ATOM 3025 CB ASP B 79 3.724 11.771 19.212 1.00 74.34 C ATOM 3026 CG ASP B 79 2.972 12.706 20.177 1.00 1.54 C ATOM 3027 OD1 ASP B 79 3.285 13.914 20.212 1.00 54.34 O ATOM 3028 OD2 ASP B 79 2.070 12.243 20.898 1.00 34.44 O ATOM 0 H ASP B 79 1.609 10.517 18.746 1.00 64.54 H new ATOM 0 HA ASP B 79 2.808 12.708 17.479 1.00 12.41 H new ATOM 0 HB2 ASP B 79 3.756 10.769 19.639 1.00 74.34 H new ATOM 0 HB3 ASP B 79 4.756 12.110 19.118 1.00 74.34 H new ATOM 3033 N PHE B 80 4.061 9.801 16.635 1.00 53.31 N ATOM 3034 CA PHE B 80 4.890 9.058 15.677 1.00 20.22 C ATOM 3035 C PHE B 80 4.583 9.513 14.238 1.00 13.52 C ATOM 3036 O PHE B 80 5.493 9.856 13.474 1.00 31.43 O ATOM 3037 CB PHE B 80 4.634 7.523 15.847 1.00 31.30 C ATOM 3038 CG PHE B 80 5.205 6.669 14.730 1.00 21.00 C ATOM 3039 CD1 PHE B 80 6.540 6.286 14.737 1.00 10.22 C ATOM 3040 CD2 PHE B 80 4.414 6.302 13.645 1.00 62.44 C ATOM 3041 CE1 PHE B 80 7.057 5.549 13.701 1.00 54.41 C ATOM 3042 CE2 PHE B 80 4.932 5.568 12.613 1.00 35.52 C ATOM 3043 CZ PHE B 80 6.256 5.201 12.632 1.00 2.15 C ATOM 0 H PHE B 80 3.441 9.201 17.179 1.00 53.31 H new ATOM 0 HA PHE B 80 5.943 9.261 15.874 1.00 20.22 H new ATOM 0 HB2 PHE B 80 5.064 7.197 16.794 1.00 31.30 H new ATOM 0 HB3 PHE B 80 3.560 7.350 15.908 1.00 31.30 H new ATOM 0 HD1 PHE B 80 7.175 6.570 15.563 1.00 10.22 H new ATOM 0 HD2 PHE B 80 3.377 6.601 13.617 1.00 62.44 H new ATOM 0 HE1 PHE B 80 8.092 5.241 13.722 1.00 54.41 H new ATOM 0 HE2 PHE B 80 4.302 5.278 11.785 1.00 35.52 H new ATOM 0 HZ PHE B 80 6.671 4.639 11.808 1.00 2.15 H new ATOM 3053 N CYS B 81 3.286 9.510 13.892 1.00 44.51 N ATOM 3054 CA CYS B 81 2.816 9.818 12.534 1.00 53.50 C ATOM 3055 C CYS B 81 2.850 11.333 12.246 1.00 63.33 C ATOM 3056 O CYS B 81 2.725 11.750 11.086 1.00 24.23 O ATOM 3057 CB CYS B 81 1.399 9.237 12.332 1.00 3.24 C ATOM 3058 SG CYS B 81 1.305 7.444 12.536 1.00 54.12 S ATOM 0 H CYS B 81 2.534 9.294 14.547 1.00 44.51 H new ATOM 0 HA CYS B 81 3.494 9.351 11.820 1.00 53.50 H new ATOM 0 HB2 CYS B 81 0.719 9.709 13.041 1.00 3.24 H new ATOM 0 HB3 CYS B 81 1.049 9.498 11.333 1.00 3.24 H new ATOM 0 HG CYS B 81 1.171 7.157 13.797 1.00 54.12 H new ATOM 3064 N LYS B 82 3.024 12.158 13.305 1.00 3.42 N ATOM 3065 CA LYS B 82 3.251 13.603 13.147 1.00 24.24 C ATOM 3066 C LYS B 82 4.694 13.838 12.663 1.00 75.33 C ATOM 3067 O LYS B 82 5.620 13.990 13.470 1.00 62.42 O ATOM 3068 CB LYS B 82 2.971 14.383 14.467 1.00 43.21 C ATOM 3069 CG LYS B 82 1.546 14.221 15.032 1.00 63.14 C ATOM 3070 CD LYS B 82 0.429 14.569 14.029 1.00 4.14 C ATOM 3071 CE LYS B 82 0.432 16.044 13.600 1.00 51.44 C ATOM 3072 NZ LYS B 82 -0.673 16.333 12.645 1.00 62.25 N ATOM 0 H LYS B 82 3.011 11.842 14.275 1.00 3.42 H new ATOM 0 HA LYS B 82 2.551 13.985 12.404 1.00 24.24 H new ATOM 0 HB2 LYS B 82 3.684 14.055 15.223 1.00 43.21 H new ATOM 0 HB3 LYS B 82 3.157 15.442 14.291 1.00 43.21 H new ATOM 0 HG2 LYS B 82 1.413 13.192 15.365 1.00 63.14 H new ATOM 0 HG3 LYS B 82 1.441 14.856 15.912 1.00 63.14 H new ATOM 0 HD2 LYS B 82 0.536 13.941 13.145 1.00 4.14 H new ATOM 0 HD3 LYS B 82 -0.537 14.330 14.475 1.00 4.14 H new ATOM 0 HE2 LYS B 82 0.331 16.681 14.479 1.00 51.44 H new ATOM 0 HE3 LYS B 82 1.388 16.288 13.137 1.00 51.44 H new ATOM 0 HZ1 LYS B 82 -0.644 17.337 12.374 1.00 62.25 H new ATOM 0 HZ2 LYS B 82 -0.562 15.742 11.796 1.00 62.25 H new ATOM 0 HZ3 LYS B 82 -1.586 16.122 13.096 1.00 62.25 H new ATOM 3086 N VAL B 83 4.872 13.765 11.331 1.00 51.02 N ATOM 3087 CA VAL B 83 6.155 13.992 10.641 1.00 10.43 C ATOM 3088 C VAL B 83 5.972 15.053 9.538 1.00 63.42 C ATOM 3089 O VAL B 83 4.835 15.405 9.193 1.00 74.55 O ATOM 3090 CB VAL B 83 6.725 12.651 10.027 1.00 14.52 C ATOM 3091 CG1 VAL B 83 7.086 11.621 11.124 1.00 40.42 C ATOM 3092 CG2 VAL B 83 5.747 12.032 8.998 1.00 44.10 C ATOM 0 H VAL B 83 4.110 13.541 10.690 1.00 51.02 H new ATOM 0 HA VAL B 83 6.878 14.353 11.373 1.00 10.43 H new ATOM 0 HB VAL B 83 7.644 12.914 9.503 1.00 14.52 H new ATOM 0 HG11 VAL B 83 7.474 10.715 10.659 1.00 40.42 H new ATOM 0 HG12 VAL B 83 7.844 12.043 11.784 1.00 40.42 H new ATOM 0 HG13 VAL B 83 6.195 11.379 11.703 1.00 40.42 H new ATOM 0 HG21 VAL B 83 6.174 11.112 8.598 1.00 44.10 H new ATOM 0 HG22 VAL B 83 4.798 11.810 9.486 1.00 44.10 H new ATOM 0 HG23 VAL B 83 5.580 12.738 8.184 1.00 44.10 H new ATOM 3102 N ASP B 84 7.091 15.536 8.982 1.00 74.01 N ATOM 3103 CA ASP B 84 7.092 16.634 7.991 1.00 72.21 C ATOM 3104 C ASP B 84 6.500 16.156 6.637 1.00 34.04 C ATOM 3105 O ASP B 84 6.365 14.948 6.418 1.00 72.40 O ATOM 3106 CB ASP B 84 8.545 17.176 7.835 1.00 63.12 C ATOM 3107 CG ASP B 84 8.603 18.607 7.266 1.00 60.44 C ATOM 3108 OD1 ASP B 84 8.975 18.793 6.092 1.00 21.24 O ATOM 3109 OD2 ASP B 84 8.258 19.556 8.007 1.00 3.45 O ATOM 0 H ASP B 84 8.022 15.181 9.202 1.00 74.01 H new ATOM 0 HA ASP B 84 6.455 17.447 8.340 1.00 72.21 H new ATOM 0 HB2 ASP B 84 9.038 17.158 8.807 1.00 63.12 H new ATOM 0 HB3 ASP B 84 9.106 16.509 7.180 1.00 63.12 H new ATOM 3114 N GLN B 85 6.182 17.116 5.739 1.00 4.04 N ATOM 3115 CA GLN B 85 5.410 16.863 4.490 1.00 32.23 C ATOM 3116 C GLN B 85 6.075 15.811 3.543 1.00 3.14 C ATOM 3117 O GLN B 85 5.393 14.849 3.158 1.00 24.04 O ATOM 3118 CB GLN B 85 5.106 18.205 3.735 1.00 64.04 C ATOM 3119 CG GLN B 85 4.249 18.061 2.453 1.00 10.52 C ATOM 3120 CD GLN B 85 2.880 17.418 2.694 1.00 53.50 C ATOM 3121 OE1 GLN B 85 2.309 17.498 3.783 1.00 4.20 O ATOM 3122 NE2 GLN B 85 2.327 16.806 1.667 1.00 34.11 N ATOM 0 H GLN B 85 6.452 18.093 5.856 1.00 4.04 H new ATOM 0 HA GLN B 85 4.465 16.419 4.803 1.00 32.23 H new ATOM 0 HB2 GLN B 85 4.595 18.881 4.420 1.00 64.04 H new ATOM 0 HB3 GLN B 85 6.052 18.676 3.469 1.00 64.04 H new ATOM 0 HG2 GLN B 85 4.104 19.047 2.011 1.00 10.52 H new ATOM 0 HG3 GLN B 85 4.798 17.463 1.725 1.00 10.52 H new ATOM 0 HE21 GLN B 85 2.822 16.755 0.777 1.00 34.11 H new ATOM 0 HE22 GLN B 85 1.403 16.383 1.762 1.00 34.11 H new ATOM 3131 N PRO B 86 7.398 15.938 3.146 1.00 12.14 N ATOM 3132 CA PRO B 86 8.078 14.897 2.330 1.00 45.23 C ATOM 3133 C PRO B 86 8.225 13.566 3.098 1.00 61.30 C ATOM 3134 O PRO B 86 8.150 12.491 2.500 1.00 61.42 O ATOM 3135 CB PRO B 86 9.463 15.512 1.991 1.00 52.21 C ATOM 3136 CG PRO B 86 9.313 16.975 2.279 1.00 22.53 C ATOM 3137 CD PRO B 86 8.326 17.066 3.416 1.00 14.31 C ATOM 0 HA PRO B 86 7.506 14.645 1.437 1.00 45.23 H new ATOM 0 HB2 PRO B 86 10.252 15.068 2.598 1.00 52.21 H new ATOM 0 HB3 PRO B 86 9.728 15.339 0.948 1.00 52.21 H new ATOM 0 HG2 PRO B 86 10.269 17.420 2.554 1.00 22.53 H new ATOM 0 HG3 PRO B 86 8.951 17.512 1.402 1.00 22.53 H new ATOM 0 HD2 PRO B 86 8.816 16.963 4.384 1.00 14.31 H new ATOM 0 HD3 PRO B 86 7.806 18.024 3.423 1.00 14.31 H new ATOM 3145 N THR B 87 8.394 13.669 4.441 1.00 23.33 N ATOM 3146 CA THR B 87 8.582 12.507 5.338 1.00 5.41 C ATOM 3147 C THR B 87 7.316 11.617 5.376 1.00 43.04 C ATOM 3148 O THR B 87 7.418 10.390 5.510 1.00 73.01 O ATOM 3149 CB THR B 87 8.950 12.971 6.790 1.00 35.50 C ATOM 3150 OG1 THR B 87 9.957 13.985 6.735 1.00 34.13 O ATOM 3151 CG2 THR B 87 9.456 11.810 7.669 1.00 35.21 C ATOM 0 H THR B 87 8.403 14.564 4.930 1.00 23.33 H new ATOM 0 HA THR B 87 9.408 11.919 4.938 1.00 5.41 H new ATOM 0 HB THR B 87 8.037 13.360 7.241 1.00 35.50 H new ATOM 0 HG1 THR B 87 10.182 14.272 7.645 1.00 34.13 H new ATOM 0 HG21 THR B 87 9.697 12.185 8.664 1.00 35.21 H new ATOM 0 HG22 THR B 87 8.681 11.048 7.746 1.00 35.21 H new ATOM 0 HG23 THR B 87 10.349 11.375 7.219 1.00 35.21 H new ATOM 3159 N LEU B 88 6.130 12.262 5.243 1.00 21.11 N ATOM 3160 CA LEU B 88 4.824 11.576 5.103 1.00 60.15 C ATOM 3161 C LEU B 88 4.867 10.610 3.903 1.00 34.32 C ATOM 3162 O LEU B 88 4.560 9.423 4.033 1.00 43.32 O ATOM 3163 CB LEU B 88 3.677 12.626 4.921 1.00 61.32 C ATOM 3164 CG LEU B 88 3.319 13.487 6.179 1.00 55.54 C ATOM 3165 CD1 LEU B 88 2.410 14.677 5.805 1.00 71.10 C ATOM 3166 CD2 LEU B 88 2.664 12.616 7.276 1.00 51.14 C ATOM 0 H LEU B 88 6.054 13.279 5.230 1.00 21.11 H new ATOM 0 HA LEU B 88 4.624 11.003 6.008 1.00 60.15 H new ATOM 0 HB2 LEU B 88 3.956 13.301 4.112 1.00 61.32 H new ATOM 0 HB3 LEU B 88 2.778 12.099 4.600 1.00 61.32 H new ATOM 0 HG LEU B 88 4.249 13.893 6.578 1.00 55.54 H new ATOM 0 HD11 LEU B 88 2.180 15.255 6.700 1.00 71.10 H new ATOM 0 HD12 LEU B 88 2.923 15.314 5.084 1.00 71.10 H new ATOM 0 HD13 LEU B 88 1.485 14.304 5.366 1.00 71.10 H new ATOM 0 HD21 LEU B 88 2.425 13.237 8.139 1.00 51.14 H new ATOM 0 HD22 LEU B 88 1.750 12.168 6.887 1.00 51.14 H new ATOM 0 HD23 LEU B 88 3.355 11.828 7.576 1.00 51.14 H new ATOM 3178 N PHE B 89 5.341 11.141 2.759 1.00 2.43 N ATOM 3179 CA PHE B 89 5.450 10.386 1.496 1.00 42.35 C ATOM 3180 C PHE B 89 6.543 9.313 1.573 1.00 12.15 C ATOM 3181 O PHE B 89 6.379 8.237 1.015 1.00 14.43 O ATOM 3182 CB PHE B 89 5.708 11.339 0.300 1.00 1.11 C ATOM 3183 CG PHE B 89 4.590 12.358 0.086 1.00 45.42 C ATOM 3184 CD1 PHE B 89 3.279 11.935 -0.140 1.00 53.11 C ATOM 3185 CD2 PHE B 89 4.844 13.727 0.114 1.00 42.32 C ATOM 3186 CE1 PHE B 89 2.262 12.851 -0.331 1.00 15.32 C ATOM 3187 CE2 PHE B 89 3.826 14.638 -0.081 1.00 11.24 C ATOM 3188 CZ PHE B 89 2.537 14.200 -0.300 1.00 11.54 C ATOM 0 H PHE B 89 5.660 12.107 2.685 1.00 2.43 H new ATOM 0 HA PHE B 89 4.497 9.881 1.336 1.00 42.35 H new ATOM 0 HB2 PHE B 89 6.647 11.869 0.463 1.00 1.11 H new ATOM 0 HB3 PHE B 89 5.829 10.747 -0.607 1.00 1.11 H new ATOM 0 HD1 PHE B 89 3.057 10.878 -0.166 1.00 53.11 H new ATOM 0 HD2 PHE B 89 5.849 14.080 0.290 1.00 42.32 H new ATOM 0 HE1 PHE B 89 1.252 12.509 -0.504 1.00 15.32 H new ATOM 0 HE2 PHE B 89 4.039 15.697 -0.062 1.00 11.24 H new ATOM 0 HZ PHE B 89 1.742 14.916 -0.447 1.00 11.54 H new ATOM 3198 N GLU B 90 7.633 9.615 2.298 1.00 51.22 N ATOM 3199 CA GLU B 90 8.743 8.665 2.523 1.00 61.01 C ATOM 3200 C GLU B 90 8.252 7.408 3.264 1.00 62.31 C ATOM 3201 O GLU B 90 8.663 6.290 2.944 1.00 22.55 O ATOM 3202 CB GLU B 90 9.876 9.336 3.340 1.00 42.12 C ATOM 3203 CG GLU B 90 10.660 10.434 2.604 1.00 23.25 C ATOM 3204 CD GLU B 90 11.507 9.891 1.440 1.00 60.14 C ATOM 3205 OE1 GLU B 90 12.628 9.389 1.699 1.00 41.54 O ATOM 3206 OE2 GLU B 90 11.075 9.979 0.271 1.00 45.02 O ATOM 0 H GLU B 90 7.772 10.521 2.745 1.00 51.22 H new ATOM 0 HA GLU B 90 9.129 8.370 1.547 1.00 61.01 H new ATOM 0 HB2 GLU B 90 9.443 9.766 4.243 1.00 42.12 H new ATOM 0 HB3 GLU B 90 10.577 8.564 3.658 1.00 42.12 H new ATOM 0 HG2 GLU B 90 9.961 11.177 2.221 1.00 23.25 H new ATOM 0 HG3 GLU B 90 11.312 10.945 3.313 1.00 23.25 H new ATOM 3213 N LEU B 91 7.368 7.621 4.258 1.00 73.34 N ATOM 3214 CA LEU B 91 6.776 6.538 5.066 1.00 40.02 C ATOM 3215 C LEU B 91 5.727 5.736 4.259 1.00 54.03 C ATOM 3216 O LEU B 91 5.587 4.531 4.460 1.00 71.54 O ATOM 3217 CB LEU B 91 6.160 7.123 6.375 1.00 71.41 C ATOM 3218 CG LEU B 91 7.165 7.697 7.427 1.00 43.54 C ATOM 3219 CD1 LEU B 91 6.419 8.288 8.651 1.00 31.51 C ATOM 3220 CD2 LEU B 91 8.174 6.617 7.857 1.00 65.32 C ATOM 0 H LEU B 91 7.044 8.551 4.523 1.00 73.34 H new ATOM 0 HA LEU B 91 7.568 5.841 5.338 1.00 40.02 H new ATOM 0 HB2 LEU B 91 5.465 7.916 6.099 1.00 71.41 H new ATOM 0 HB3 LEU B 91 5.574 6.339 6.856 1.00 71.41 H new ATOM 0 HG LEU B 91 7.719 8.510 6.958 1.00 43.54 H new ATOM 0 HD11 LEU B 91 7.144 8.679 9.365 1.00 31.51 H new ATOM 0 HD12 LEU B 91 5.762 9.093 8.323 1.00 31.51 H new ATOM 0 HD13 LEU B 91 5.826 7.507 9.127 1.00 31.51 H new ATOM 0 HD21 LEU B 91 8.865 7.035 8.589 1.00 65.32 H new ATOM 0 HD22 LEU B 91 7.640 5.776 8.301 1.00 65.32 H new ATOM 0 HD23 LEU B 91 8.732 6.273 6.986 1.00 65.32 H new ATOM 3232 N ILE B 92 5.003 6.422 3.343 1.00 14.10 N ATOM 3233 CA ILE B 92 4.044 5.775 2.408 1.00 74.42 C ATOM 3234 C ILE B 92 4.810 4.870 1.407 1.00 25.43 C ATOM 3235 O ILE B 92 4.423 3.717 1.169 1.00 54.12 O ATOM 3236 CB ILE B 92 3.167 6.849 1.631 1.00 72.41 C ATOM 3237 CG1 ILE B 92 2.284 7.670 2.628 1.00 51.23 C ATOM 3238 CG2 ILE B 92 2.287 6.192 0.533 1.00 63.35 C ATOM 3239 CD1 ILE B 92 1.496 8.816 2.004 1.00 15.42 C ATOM 0 H ILE B 92 5.064 7.434 3.229 1.00 14.10 H new ATOM 0 HA ILE B 92 3.361 5.161 2.996 1.00 74.42 H new ATOM 0 HB ILE B 92 3.856 7.531 1.133 1.00 72.41 H new ATOM 0 HG12 ILE B 92 1.583 6.990 3.113 1.00 51.23 H new ATOM 0 HG13 ILE B 92 2.927 8.075 3.409 1.00 51.23 H new ATOM 0 HG21 ILE B 92 1.704 6.961 0.026 1.00 63.35 H new ATOM 0 HG22 ILE B 92 2.926 5.685 -0.190 1.00 63.35 H new ATOM 0 HG23 ILE B 92 1.613 5.468 0.992 1.00 63.35 H new ATOM 0 HD11 ILE B 92 0.917 9.322 2.776 1.00 15.42 H new ATOM 0 HD12 ILE B 92 2.186 9.524 1.545 1.00 15.42 H new ATOM 0 HD13 ILE B 92 0.821 8.422 1.244 1.00 15.42 H new ATOM 3251 N LEU B 93 5.936 5.399 0.874 1.00 3.35 N ATOM 3252 CA LEU B 93 6.783 4.699 -0.119 1.00 44.12 C ATOM 3253 C LEU B 93 7.515 3.500 0.529 1.00 22.31 C ATOM 3254 O LEU B 93 7.620 2.435 -0.084 1.00 43.32 O ATOM 3255 CB LEU B 93 7.813 5.690 -0.756 1.00 64.40 C ATOM 3256 CG LEU B 93 7.221 6.851 -1.632 1.00 51.22 C ATOM 3257 CD1 LEU B 93 8.334 7.797 -2.146 1.00 51.21 C ATOM 3258 CD2 LEU B 93 6.362 6.304 -2.793 1.00 52.14 C ATOM 0 H LEU B 93 6.283 6.326 1.121 1.00 3.35 H new ATOM 0 HA LEU B 93 6.136 4.316 -0.908 1.00 44.12 H new ATOM 0 HB2 LEU B 93 8.400 6.135 0.048 1.00 64.40 H new ATOM 0 HB3 LEU B 93 8.503 5.115 -1.374 1.00 64.40 H new ATOM 0 HG LEU B 93 6.564 7.439 -0.991 1.00 51.22 H new ATOM 0 HD11 LEU B 93 7.889 8.589 -2.749 1.00 51.21 H new ATOM 0 HD12 LEU B 93 8.858 8.238 -1.298 1.00 51.21 H new ATOM 0 HD13 LEU B 93 9.040 7.232 -2.754 1.00 51.21 H new ATOM 0 HD21 LEU B 93 5.969 7.136 -3.378 1.00 52.14 H new ATOM 0 HD22 LEU B 93 6.976 5.669 -3.432 1.00 52.14 H new ATOM 0 HD23 LEU B 93 5.534 5.721 -2.390 1.00 52.14 H new ATOM 3270 N ALA B 94 7.993 3.694 1.777 1.00 70.11 N ATOM 3271 CA ALA B 94 8.725 2.661 2.551 1.00 45.20 C ATOM 3272 C ALA B 94 7.801 1.516 2.983 1.00 21.34 C ATOM 3273 O ALA B 94 8.197 0.339 2.974 1.00 25.01 O ATOM 3274 CB ALA B 94 9.367 3.300 3.788 1.00 73.53 C ATOM 0 H ALA B 94 7.883 4.574 2.280 1.00 70.11 H new ATOM 0 HA ALA B 94 9.497 2.243 1.905 1.00 45.20 H new ATOM 0 HB1 ALA B 94 9.904 2.538 4.354 1.00 73.53 H new ATOM 0 HB2 ALA B 94 10.064 4.078 3.476 1.00 73.53 H new ATOM 0 HB3 ALA B 94 8.591 3.738 4.415 1.00 73.53 H new ATOM 3280 N ALA B 95 6.571 1.883 3.373 1.00 70.11 N ATOM 3281 CA ALA B 95 5.537 0.920 3.772 1.00 5.11 C ATOM 3282 C ALA B 95 5.066 0.091 2.572 1.00 71.43 C ATOM 3283 O ALA B 95 4.849 -1.100 2.702 1.00 43.44 O ATOM 3284 CB ALA B 95 4.356 1.639 4.407 1.00 43.24 C ATOM 0 H ALA B 95 6.267 2.855 3.420 1.00 70.11 H new ATOM 0 HA ALA B 95 5.974 0.243 4.506 1.00 5.11 H new ATOM 0 HB1 ALA B 95 3.599 0.910 4.697 1.00 43.24 H new ATOM 0 HB2 ALA B 95 4.693 2.183 5.290 1.00 43.24 H new ATOM 0 HB3 ALA B 95 3.929 2.340 3.690 1.00 43.24 H new ATOM 3290 N ASN B 96 4.911 0.751 1.403 1.00 11.12 N ATOM 3291 CA ASN B 96 4.534 0.076 0.133 1.00 23.43 C ATOM 3292 C ASN B 96 5.703 -0.798 -0.383 1.00 64.10 C ATOM 3293 O ASN B 96 5.487 -1.851 -0.992 1.00 61.20 O ATOM 3294 CB ASN B 96 4.107 1.136 -0.935 1.00 72.41 C ATOM 3295 CG ASN B 96 3.621 0.529 -2.269 1.00 62.32 C ATOM 3296 OD1 ASN B 96 3.099 -0.588 -2.319 1.00 51.04 O ATOM 3297 ND2 ASN B 96 3.752 1.272 -3.352 1.00 20.15 N ATOM 0 H ASN B 96 5.042 1.758 1.309 1.00 11.12 H new ATOM 0 HA ASN B 96 3.684 -0.580 0.320 1.00 23.43 H new ATOM 0 HB2 ASN B 96 3.312 1.755 -0.519 1.00 72.41 H new ATOM 0 HB3 ASN B 96 4.952 1.795 -1.135 1.00 72.41 H new ATOM 0 HD21 ASN B 96 3.419 0.925 -4.252 1.00 20.15 H new ATOM 0 HD22 ASN B 96 4.186 2.193 -3.289 1.00 20.15 H new ATOM 3304 N TYR B 97 6.936 -0.336 -0.101 1.00 45.45 N ATOM 3305 CA TYR B 97 8.192 -1.029 -0.477 1.00 13.24 C ATOM 3306 C TYR B 97 8.293 -2.408 0.203 1.00 22.11 C ATOM 3307 O TYR B 97 8.651 -3.398 -0.440 1.00 32.24 O ATOM 3308 CB TYR B 97 9.414 -0.130 -0.115 1.00 74.21 C ATOM 3309 CG TYR B 97 10.800 -0.740 -0.377 1.00 42.13 C ATOM 3310 CD1 TYR B 97 11.685 -1.007 0.671 1.00 13.32 C ATOM 3311 CD2 TYR B 97 11.220 -1.050 -1.674 1.00 34.04 C ATOM 3312 CE1 TYR B 97 12.927 -1.559 0.436 1.00 55.20 C ATOM 3313 CE2 TYR B 97 12.467 -1.603 -1.910 1.00 55.11 C ATOM 3314 CZ TYR B 97 13.312 -1.856 -0.852 1.00 25.42 C ATOM 3315 OH TYR B 97 14.554 -2.406 -1.084 1.00 5.44 O ATOM 0 H TYR B 97 7.094 0.538 0.400 1.00 45.45 H new ATOM 0 HA TYR B 97 8.190 -1.202 -1.553 1.00 13.24 H new ATOM 0 HB2 TYR B 97 9.336 0.800 -0.679 1.00 74.21 H new ATOM 0 HB3 TYR B 97 9.348 0.131 0.941 1.00 74.21 H new ATOM 0 HD1 TYR B 97 11.391 -0.777 1.684 1.00 13.32 H new ATOM 0 HD2 TYR B 97 10.560 -0.855 -2.506 1.00 34.04 H new ATOM 0 HE1 TYR B 97 13.596 -1.758 1.260 1.00 55.20 H new ATOM 0 HE2 TYR B 97 12.776 -1.835 -2.919 1.00 55.11 H new ATOM 0 HH TYR B 97 14.671 -2.557 -2.045 1.00 5.44 H new ATOM 3325 N LEU B 98 7.968 -2.461 1.509 1.00 1.44 N ATOM 3326 CA LEU B 98 8.013 -3.712 2.300 1.00 2.43 C ATOM 3327 C LEU B 98 6.621 -4.364 2.430 1.00 15.11 C ATOM 3328 O LEU B 98 6.507 -5.483 2.939 1.00 22.43 O ATOM 3329 CB LEU B 98 8.629 -3.439 3.699 1.00 50.13 C ATOM 3330 CG LEU B 98 10.095 -2.902 3.706 1.00 51.34 C ATOM 3331 CD1 LEU B 98 10.622 -2.721 5.150 1.00 10.45 C ATOM 3332 CD2 LEU B 98 11.020 -3.815 2.867 1.00 44.42 C ATOM 0 H LEU B 98 7.669 -1.646 2.045 1.00 1.44 H new ATOM 0 HA LEU B 98 8.647 -4.420 1.766 1.00 2.43 H new ATOM 0 HB2 LEU B 98 7.997 -2.719 4.219 1.00 50.13 H new ATOM 0 HB3 LEU B 98 8.599 -4.364 4.275 1.00 50.13 H new ATOM 0 HG LEU B 98 10.096 -1.916 3.240 1.00 51.34 H new ATOM 0 HD11 LEU B 98 11.645 -2.346 5.120 1.00 10.45 H new ATOM 0 HD12 LEU B 98 9.990 -2.009 5.681 1.00 10.45 H new ATOM 0 HD13 LEU B 98 10.602 -3.680 5.667 1.00 10.45 H new ATOM 0 HD21 LEU B 98 12.036 -3.421 2.887 1.00 44.42 H new ATOM 0 HD22 LEU B 98 11.013 -4.822 3.285 1.00 44.42 H new ATOM 0 HD23 LEU B 98 10.663 -3.847 1.838 1.00 44.42 H new ATOM 3344 N ASP B 99 5.596 -3.671 1.912 1.00 22.30 N ATOM 3345 CA ASP B 99 4.165 -4.038 2.044 1.00 34.10 C ATOM 3346 C ASP B 99 3.773 -4.284 3.523 1.00 61.11 C ATOM 3347 O ASP B 99 3.206 -5.325 3.892 1.00 40.31 O ATOM 3348 CB ASP B 99 3.769 -5.223 1.112 1.00 32.02 C ATOM 3349 CG ASP B 99 2.241 -5.419 0.981 1.00 51.23 C ATOM 3350 OD1 ASP B 99 1.493 -4.418 0.932 1.00 52.03 O ATOM 3351 OD2 ASP B 99 1.774 -6.568 0.877 1.00 13.53 O ATOM 0 H ASP B 99 5.736 -2.816 1.374 1.00 22.30 H new ATOM 0 HA ASP B 99 3.582 -3.183 1.703 1.00 34.10 H new ATOM 0 HB2 ASP B 99 4.192 -5.053 0.122 1.00 32.02 H new ATOM 0 HB3 ASP B 99 4.214 -6.141 1.496 1.00 32.02 H new ATOM 3356 N ILE B 100 4.147 -3.309 4.370 1.00 62.14 N ATOM 3357 CA ILE B 100 3.730 -3.234 5.777 1.00 51.23 C ATOM 3358 C ILE B 100 2.408 -2.467 5.844 1.00 35.14 C ATOM 3359 O ILE B 100 2.388 -1.232 5.909 1.00 1.23 O ATOM 3360 CB ILE B 100 4.827 -2.549 6.679 1.00 12.41 C ATOM 3361 CG1 ILE B 100 6.162 -3.329 6.528 1.00 50.12 C ATOM 3362 CG2 ILE B 100 4.362 -2.463 8.163 1.00 64.21 C ATOM 3363 CD1 ILE B 100 7.344 -2.798 7.308 1.00 71.55 C ATOM 0 H ILE B 100 4.757 -2.541 4.090 1.00 62.14 H new ATOM 0 HA ILE B 100 3.598 -4.243 6.167 1.00 51.23 H new ATOM 0 HB ILE B 100 4.984 -1.522 6.349 1.00 12.41 H new ATOM 0 HG12 ILE B 100 5.990 -4.362 6.830 1.00 50.12 H new ATOM 0 HG13 ILE B 100 6.430 -3.346 5.472 1.00 50.12 H new ATOM 0 HG21 ILE B 100 5.139 -1.986 8.761 1.00 64.21 H new ATOM 0 HG22 ILE B 100 3.446 -1.876 8.224 1.00 64.21 H new ATOM 0 HG23 ILE B 100 4.175 -3.467 8.545 1.00 64.21 H new ATOM 0 HD11 ILE B 100 8.215 -3.426 7.121 1.00 71.55 H new ATOM 0 HD12 ILE B 100 7.558 -1.777 6.993 1.00 71.55 H new ATOM 0 HD13 ILE B 100 7.112 -2.808 8.373 1.00 71.55 H new ATOM 3375 N LYS B 101 1.325 -3.240 5.780 1.00 43.50 N ATOM 3376 CA LYS B 101 -0.062 -2.739 5.769 1.00 14.02 C ATOM 3377 C LYS B 101 -0.440 -1.962 7.067 1.00 41.53 C ATOM 3378 O LYS B 101 -1.079 -0.913 6.952 1.00 74.12 O ATOM 3379 CB LYS B 101 -1.049 -3.917 5.525 1.00 1.44 C ATOM 3380 CG LYS B 101 -0.651 -4.802 4.330 1.00 22.05 C ATOM 3381 CD LYS B 101 -1.661 -5.940 4.047 1.00 61.24 C ATOM 3382 CE LYS B 101 -1.205 -6.845 2.896 1.00 1.25 C ATOM 3383 NZ LYS B 101 -0.896 -6.052 1.685 1.00 14.52 N ATOM 0 H LYS B 101 1.381 -4.257 5.733 1.00 43.50 H new ATOM 0 HA LYS B 101 -0.138 -2.022 4.951 1.00 14.02 H new ATOM 0 HB2 LYS B 101 -1.100 -4.532 6.423 1.00 1.44 H new ATOM 0 HB3 LYS B 101 -2.048 -3.516 5.356 1.00 1.44 H new ATOM 0 HG2 LYS B 101 -0.558 -4.179 3.441 1.00 22.05 H new ATOM 0 HG3 LYS B 101 0.331 -5.236 4.519 1.00 22.05 H new ATOM 0 HD2 LYS B 101 -1.793 -6.539 4.948 1.00 61.24 H new ATOM 0 HD3 LYS B 101 -2.633 -5.509 3.806 1.00 61.24 H new ATOM 0 HE2 LYS B 101 -0.323 -7.409 3.200 1.00 1.25 H new ATOM 0 HE3 LYS B 101 -1.985 -7.572 2.669 1.00 1.25 H new ATOM 0 HZ1 LYS B 101 -1.118 -6.612 0.837 1.00 14.52 H new ATOM 0 HZ2 LYS B 101 -1.466 -5.182 1.685 1.00 14.52 H new ATOM 0 HZ3 LYS B 101 0.114 -5.804 1.681 1.00 14.52 H new ATOM 3397 N PRO B 102 -0.069 -2.449 8.327 1.00 4.24 N ATOM 3398 CA PRO B 102 -0.315 -1.678 9.591 1.00 73.44 C ATOM 3399 C PRO B 102 0.231 -0.223 9.544 1.00 44.52 C ATOM 3400 O PRO B 102 -0.436 0.701 10.005 1.00 11.03 O ATOM 3401 CB PRO B 102 0.396 -2.525 10.700 1.00 31.34 C ATOM 3402 CG PRO B 102 1.245 -3.530 9.967 1.00 55.32 C ATOM 3403 CD PRO B 102 0.536 -3.786 8.661 1.00 24.33 C ATOM 0 HA PRO B 102 -1.382 -1.547 9.772 1.00 73.44 H new ATOM 0 HB2 PRO B 102 1.007 -1.892 11.344 1.00 31.34 H new ATOM 0 HB3 PRO B 102 -0.333 -3.022 11.340 1.00 31.34 H new ATOM 0 HG2 PRO B 102 2.250 -3.144 9.798 1.00 55.32 H new ATOM 0 HG3 PRO B 102 1.349 -4.449 10.543 1.00 55.32 H new ATOM 0 HD2 PRO B 102 1.227 -4.119 7.887 1.00 24.33 H new ATOM 0 HD3 PRO B 102 -0.226 -4.558 8.762 1.00 24.33 H new ATOM 3411 N LEU B 103 1.439 -0.031 8.978 1.00 44.12 N ATOM 3412 CA LEU B 103 2.080 1.304 8.903 1.00 5.43 C ATOM 3413 C LEU B 103 1.500 2.104 7.722 1.00 32.44 C ATOM 3414 O LEU B 103 1.205 3.301 7.864 1.00 34.32 O ATOM 3415 CB LEU B 103 3.637 1.166 8.803 1.00 34.42 C ATOM 3416 CG LEU B 103 4.508 2.478 8.968 1.00 70.10 C ATOM 3417 CD1 LEU B 103 4.698 3.267 7.652 1.00 74.30 C ATOM 3418 CD2 LEU B 103 3.936 3.394 10.069 1.00 25.14 C ATOM 0 H LEU B 103 1.993 -0.781 8.565 1.00 44.12 H new ATOM 0 HA LEU B 103 1.863 1.854 9.819 1.00 5.43 H new ATOM 0 HB2 LEU B 103 3.959 0.453 9.562 1.00 34.42 H new ATOM 0 HB3 LEU B 103 3.873 0.728 7.833 1.00 34.42 H new ATOM 0 HG LEU B 103 5.499 2.136 9.268 1.00 70.10 H new ATOM 0 HD11 LEU B 103 5.304 4.152 7.843 1.00 74.30 H new ATOM 0 HD12 LEU B 103 5.199 2.635 6.918 1.00 74.30 H new ATOM 0 HD13 LEU B 103 3.725 3.570 7.266 1.00 74.30 H new ATOM 0 HD21 LEU B 103 4.556 4.286 10.158 1.00 25.14 H new ATOM 0 HD22 LEU B 103 2.918 3.684 9.809 1.00 25.14 H new ATOM 0 HD23 LEU B 103 3.929 2.860 11.019 1.00 25.14 H new ATOM 3430 N LEU B 104 1.308 1.414 6.581 1.00 23.44 N ATOM 3431 CA LEU B 104 0.842 2.024 5.318 1.00 15.31 C ATOM 3432 C LEU B 104 -0.521 2.699 5.509 1.00 44.22 C ATOM 3433 O LEU B 104 -0.701 3.867 5.145 1.00 22.21 O ATOM 3434 CB LEU B 104 0.756 0.942 4.200 1.00 22.31 C ATOM 3435 CG LEU B 104 0.333 1.431 2.777 1.00 13.32 C ATOM 3436 CD1 LEU B 104 1.284 2.531 2.238 1.00 52.24 C ATOM 3437 CD2 LEU B 104 0.239 0.236 1.802 1.00 64.31 C ATOM 0 H LEU B 104 1.473 0.410 6.508 1.00 23.44 H new ATOM 0 HA LEU B 104 1.561 2.786 5.019 1.00 15.31 H new ATOM 0 HB2 LEU B 104 1.730 0.460 4.118 1.00 22.31 H new ATOM 0 HB3 LEU B 104 0.048 0.178 4.521 1.00 22.31 H new ATOM 0 HG LEU B 104 -0.655 1.884 2.859 1.00 13.32 H new ATOM 0 HD11 LEU B 104 0.955 2.843 1.247 1.00 52.24 H new ATOM 0 HD12 LEU B 104 1.268 3.388 2.912 1.00 52.24 H new ATOM 0 HD13 LEU B 104 2.298 2.137 2.176 1.00 52.24 H new ATOM 0 HD21 LEU B 104 -0.057 0.594 0.816 1.00 64.31 H new ATOM 0 HD22 LEU B 104 1.210 -0.255 1.734 1.00 64.31 H new ATOM 0 HD23 LEU B 104 -0.502 -0.474 2.168 1.00 64.31 H new ATOM 3449 N ASP B 105 -1.443 1.948 6.140 1.00 23.31 N ATOM 3450 CA ASP B 105 -2.823 2.384 6.384 1.00 25.42 C ATOM 3451 C ASP B 105 -2.840 3.636 7.271 1.00 14.13 C ATOM 3452 O ASP B 105 -3.430 4.649 6.905 1.00 51.12 O ATOM 3453 CB ASP B 105 -3.648 1.242 7.044 1.00 72.34 C ATOM 3454 CG ASP B 105 -5.133 1.630 7.229 1.00 64.35 C ATOM 3455 OD1 ASP B 105 -5.529 2.072 8.336 1.00 41.04 O ATOM 3456 OD2 ASP B 105 -5.905 1.548 6.245 1.00 1.33 O ATOM 0 H ASP B 105 -1.245 1.013 6.497 1.00 23.31 H new ATOM 0 HA ASP B 105 -3.280 2.631 5.426 1.00 25.42 H new ATOM 0 HB2 ASP B 105 -3.582 0.345 6.428 1.00 72.34 H new ATOM 0 HB3 ASP B 105 -3.215 0.996 8.013 1.00 72.34 H new ATOM 3461 N VAL B 106 -2.132 3.557 8.408 1.00 10.13 N ATOM 3462 CA VAL B 106 -2.089 4.636 9.411 1.00 71.24 C ATOM 3463 C VAL B 106 -1.469 5.936 8.837 1.00 51.44 C ATOM 3464 O VAL B 106 -1.995 7.024 9.082 1.00 12.24 O ATOM 3465 CB VAL B 106 -1.329 4.162 10.710 1.00 42.21 C ATOM 3466 CG1 VAL B 106 -1.140 5.304 11.740 1.00 61.40 C ATOM 3467 CG2 VAL B 106 -2.072 2.964 11.346 1.00 22.21 C ATOM 0 H VAL B 106 -1.572 2.743 8.660 1.00 10.13 H new ATOM 0 HA VAL B 106 -3.118 4.870 9.686 1.00 71.24 H new ATOM 0 HB VAL B 106 -0.329 3.849 10.409 1.00 42.21 H new ATOM 0 HG11 VAL B 106 -0.612 4.922 12.614 1.00 61.40 H new ATOM 0 HG12 VAL B 106 -0.560 6.109 11.288 1.00 61.40 H new ATOM 0 HG13 VAL B 106 -2.115 5.685 12.044 1.00 61.40 H new ATOM 0 HG21 VAL B 106 -1.542 2.642 12.242 1.00 22.21 H new ATOM 0 HG22 VAL B 106 -3.086 3.264 11.612 1.00 22.21 H new ATOM 0 HG23 VAL B 106 -2.113 2.141 10.633 1.00 22.21 H new ATOM 3477 N THR B 107 -0.389 5.809 8.036 1.00 24.01 N ATOM 3478 CA THR B 107 0.286 6.977 7.410 1.00 41.34 C ATOM 3479 C THR B 107 -0.601 7.611 6.306 1.00 53.44 C ATOM 3480 O THR B 107 -0.649 8.842 6.154 1.00 24.31 O ATOM 3481 CB THR B 107 1.691 6.578 6.829 1.00 12.14 C ATOM 3482 OG1 THR B 107 2.468 5.920 7.844 1.00 15.10 O ATOM 3483 CG2 THR B 107 2.485 7.802 6.333 1.00 15.41 C ATOM 0 H THR B 107 0.037 4.912 7.805 1.00 24.01 H new ATOM 0 HA THR B 107 0.442 7.722 8.190 1.00 41.34 H new ATOM 0 HB THR B 107 1.509 5.915 5.983 1.00 12.14 H new ATOM 0 HG1 THR B 107 2.153 4.998 7.951 1.00 15.10 H new ATOM 0 HG21 THR B 107 3.448 7.476 5.941 1.00 15.41 H new ATOM 0 HG22 THR B 107 1.924 8.305 5.545 1.00 15.41 H new ATOM 0 HG23 THR B 107 2.645 8.492 7.162 1.00 15.41 H new ATOM 3491 N CYS B 108 -1.336 6.749 5.574 1.00 33.33 N ATOM 3492 CA CYS B 108 -2.323 7.184 4.562 1.00 63.05 C ATOM 3493 C CYS B 108 -3.545 7.844 5.238 1.00 52.12 C ATOM 3494 O CYS B 108 -4.203 8.702 4.650 1.00 60.15 O ATOM 3495 CB CYS B 108 -2.762 5.998 3.680 1.00 55.04 C ATOM 3496 SG CYS B 108 -1.417 5.266 2.721 1.00 32.24 S ATOM 0 H CYS B 108 -1.263 5.736 5.666 1.00 33.33 H new ATOM 0 HA CYS B 108 -1.847 7.926 3.921 1.00 63.05 H new ATOM 0 HB2 CYS B 108 -3.204 5.229 4.314 1.00 55.04 H new ATOM 0 HB3 CYS B 108 -3.542 6.334 2.997 1.00 55.04 H new ATOM 0 HG CYS B 108 -0.691 4.515 3.495 1.00 32.24 H new ATOM 3502 N LYS B 109 -3.849 7.411 6.475 1.00 5.31 N ATOM 3503 CA LYS B 109 -4.899 8.026 7.313 1.00 4.43 C ATOM 3504 C LYS B 109 -4.407 9.362 7.905 1.00 32.24 C ATOM 3505 O LYS B 109 -5.206 10.266 8.103 1.00 62.10 O ATOM 3506 CB LYS B 109 -5.395 7.036 8.425 1.00 42.33 C ATOM 3507 CG LYS B 109 -6.651 6.200 8.039 1.00 63.50 C ATOM 3508 CD LYS B 109 -6.513 5.464 6.683 1.00 72.24 C ATOM 3509 CE LYS B 109 -7.745 4.617 6.329 1.00 22.03 C ATOM 3510 NZ LYS B 109 -7.968 3.525 7.313 1.00 25.43 N ATOM 0 H LYS B 109 -3.376 6.626 6.923 1.00 5.31 H new ATOM 0 HA LYS B 109 -5.759 8.244 6.680 1.00 4.43 H new ATOM 0 HB2 LYS B 109 -4.583 6.353 8.673 1.00 42.33 H new ATOM 0 HB3 LYS B 109 -5.618 7.606 9.327 1.00 42.33 H new ATOM 0 HG2 LYS B 109 -6.844 5.467 8.823 1.00 63.50 H new ATOM 0 HG3 LYS B 109 -7.518 6.860 7.998 1.00 63.50 H new ATOM 0 HD2 LYS B 109 -6.345 6.197 5.894 1.00 72.24 H new ATOM 0 HD3 LYS B 109 -5.634 4.821 6.713 1.00 72.24 H new ATOM 0 HE2 LYS B 109 -8.627 5.257 6.291 1.00 22.03 H new ATOM 0 HE3 LYS B 109 -7.618 4.189 5.334 1.00 22.03 H new ATOM 0 HZ1 LYS B 109 -8.326 2.682 6.821 1.00 25.43 H new ATOM 0 HZ2 LYS B 109 -7.071 3.295 7.786 1.00 25.43 H new ATOM 0 HZ3 LYS B 109 -8.664 3.833 8.022 1.00 25.43 H new ATOM 3524 N THR B 110 -3.090 9.472 8.171 1.00 40.30 N ATOM 3525 CA THR B 110 -2.467 10.699 8.712 1.00 13.22 C ATOM 3526 C THR B 110 -2.546 11.859 7.693 1.00 74.30 C ATOM 3527 O THR B 110 -2.908 12.989 8.049 1.00 10.02 O ATOM 3528 CB THR B 110 -0.977 10.430 9.108 1.00 54.32 C ATOM 3529 OG1 THR B 110 -0.914 9.394 10.101 1.00 44.21 O ATOM 3530 CG2 THR B 110 -0.279 11.686 9.651 1.00 32.11 C ATOM 0 H THR B 110 -2.427 8.712 8.017 1.00 40.30 H new ATOM 0 HA THR B 110 -3.021 10.990 9.604 1.00 13.22 H new ATOM 0 HB THR B 110 -0.457 10.123 8.201 1.00 54.32 H new ATOM 0 HG1 THR B 110 -1.281 8.564 9.732 1.00 44.21 H new ATOM 0 HG21 THR B 110 0.752 11.446 9.911 1.00 32.11 H new ATOM 0 HG22 THR B 110 -0.289 12.466 8.889 1.00 32.11 H new ATOM 0 HG23 THR B 110 -0.804 12.039 10.539 1.00 32.11 H new ATOM 3538 N VAL B 111 -2.220 11.560 6.424 1.00 50.52 N ATOM 3539 CA VAL B 111 -2.350 12.536 5.324 1.00 41.04 C ATOM 3540 C VAL B 111 -3.844 12.833 5.037 1.00 72.44 C ATOM 3541 O VAL B 111 -4.203 13.956 4.662 1.00 14.10 O ATOM 3542 CB VAL B 111 -1.574 12.082 4.023 1.00 23.42 C ATOM 3543 CG1 VAL B 111 -0.055 11.954 4.294 1.00 40.32 C ATOM 3544 CG2 VAL B 111 -2.137 10.772 3.440 1.00 3.14 C ATOM 0 H VAL B 111 -1.864 10.650 6.133 1.00 50.52 H new ATOM 0 HA VAL B 111 -1.878 13.464 5.646 1.00 41.04 H new ATOM 0 HB VAL B 111 -1.725 12.861 3.276 1.00 23.42 H new ATOM 0 HG11 VAL B 111 0.452 11.640 3.382 1.00 40.32 H new ATOM 0 HG12 VAL B 111 0.340 12.918 4.616 1.00 40.32 H new ATOM 0 HG13 VAL B 111 0.114 11.213 5.076 1.00 40.32 H new ATOM 0 HG21 VAL B 111 -1.573 10.499 2.548 1.00 3.14 H new ATOM 0 HG22 VAL B 111 -2.051 9.977 4.181 1.00 3.14 H new ATOM 0 HG23 VAL B 111 -3.186 10.912 3.178 1.00 3.14 H new ATOM 3554 N ALA B 112 -4.709 11.812 5.250 1.00 51.54 N ATOM 3555 CA ALA B 112 -6.179 11.959 5.167 1.00 64.13 C ATOM 3556 C ALA B 112 -6.735 12.778 6.356 1.00 52.42 C ATOM 3557 O ALA B 112 -7.807 13.372 6.249 1.00 70.30 O ATOM 3558 CB ALA B 112 -6.858 10.585 5.089 1.00 11.45 C ATOM 0 H ALA B 112 -4.406 10.866 5.484 1.00 51.54 H new ATOM 0 HA ALA B 112 -6.405 12.508 4.253 1.00 64.13 H new ATOM 0 HB1 ALA B 112 -7.938 10.716 5.029 1.00 11.45 H new ATOM 0 HB2 ALA B 112 -6.507 10.055 4.204 1.00 11.45 H new ATOM 0 HB3 ALA B 112 -6.612 10.006 5.979 1.00 11.45 H new ATOM 3564 N ASN B 113 -6.005 12.789 7.496 1.00 23.53 N ATOM 3565 CA ASN B 113 -6.376 13.598 8.688 1.00 63.23 C ATOM 3566 C ASN B 113 -6.236 15.106 8.405 1.00 12.33 C ATOM 3567 O ASN B 113 -6.913 15.922 9.040 1.00 10.22 O ATOM 3568 CB ASN B 113 -5.554 13.211 9.968 1.00 44.41 C ATOM 3569 CG ASN B 113 -6.224 12.125 10.827 1.00 0.45 C ATOM 3570 OD1 ASN B 113 -7.109 12.427 11.625 1.00 60.02 O ATOM 3571 ND2 ASN B 113 -5.789 10.881 10.716 1.00 30.50 N ATOM 0 H ASN B 113 -5.151 12.245 7.618 1.00 23.53 H new ATOM 0 HA ASN B 113 -7.422 13.370 8.893 1.00 63.23 H new ATOM 0 HB2 ASN B 113 -4.567 12.864 9.664 1.00 44.41 H new ATOM 0 HB3 ASN B 113 -5.405 14.103 10.577 1.00 44.41 H new ATOM 0 HD21 ASN B 113 -6.189 10.147 11.300 1.00 30.50 H new ATOM 0 HD22 ASN B 113 -5.053 10.656 10.046 1.00 30.50 H new ATOM 3578 N MET B 114 -5.362 15.462 7.454 1.00 60.55 N ATOM 3579 CA MET B 114 -5.135 16.865 7.057 1.00 41.11 C ATOM 3580 C MET B 114 -6.327 17.408 6.237 1.00 31.21 C ATOM 3581 O MET B 114 -6.617 18.612 6.268 1.00 23.34 O ATOM 3582 CB MET B 114 -3.809 16.989 6.261 1.00 70.35 C ATOM 3583 CG MET B 114 -2.565 16.553 7.053 1.00 3.11 C ATOM 3584 SD MET B 114 -1.008 17.017 6.251 1.00 52.42 S ATOM 3585 CE MET B 114 -1.047 16.049 4.742 1.00 22.11 C ATOM 0 H MET B 114 -4.793 14.791 6.938 1.00 60.55 H new ATOM 0 HA MET B 114 -5.053 17.470 7.960 1.00 41.11 H new ATOM 0 HB2 MET B 114 -3.882 16.386 5.356 1.00 70.35 H new ATOM 0 HB3 MET B 114 -3.682 18.024 5.944 1.00 70.35 H new ATOM 0 HG2 MET B 114 -2.601 16.999 8.047 1.00 3.11 H new ATOM 0 HG3 MET B 114 -2.589 15.472 7.187 1.00 3.11 H new ATOM 0 HE1 MET B 114 -0.216 15.343 4.741 1.00 22.11 H new ATOM 0 HE2 MET B 114 -1.988 15.502 4.685 1.00 22.11 H new ATOM 0 HE3 MET B 114 -0.961 16.713 3.882 1.00 22.11 H new ATOM 3595 N ILE B 115 -7.004 16.507 5.498 1.00 53.32 N ATOM 3596 CA ILE B 115 -8.214 16.840 4.698 1.00 54.34 C ATOM 3597 C ILE B 115 -9.512 16.388 5.408 1.00 0.01 C ATOM 3598 O ILE B 115 -10.612 16.610 4.884 1.00 52.53 O ATOM 3599 CB ILE B 115 -8.147 16.210 3.250 1.00 63.31 C ATOM 3600 CG1 ILE B 115 -8.037 14.656 3.310 1.00 4.20 C ATOM 3601 CG2 ILE B 115 -6.978 16.811 2.443 1.00 50.41 C ATOM 3602 CD1 ILE B 115 -8.045 13.952 1.964 1.00 73.22 C ATOM 0 H ILE B 115 -6.733 15.526 5.435 1.00 53.32 H new ATOM 0 HA ILE B 115 -8.233 17.926 4.603 1.00 54.34 H new ATOM 0 HB ILE B 115 -9.078 16.457 2.739 1.00 63.31 H new ATOM 0 HG12 ILE B 115 -7.118 14.393 3.833 1.00 4.20 H new ATOM 0 HG13 ILE B 115 -8.864 14.272 3.907 1.00 4.20 H new ATOM 0 HG21 ILE B 115 -6.952 16.362 1.450 1.00 50.41 H new ATOM 0 HG22 ILE B 115 -7.116 17.888 2.351 1.00 50.41 H new ATOM 0 HG23 ILE B 115 -6.039 16.608 2.957 1.00 50.41 H new ATOM 0 HD11 ILE B 115 -7.964 12.876 2.116 1.00 73.22 H new ATOM 0 HD12 ILE B 115 -8.975 14.176 1.442 1.00 73.22 H new ATOM 0 HD13 ILE B 115 -7.201 14.299 1.367 1.00 73.22 H new ATOM 3614 N ARG B 116 -9.362 15.751 6.592 1.00 4.11 N ATOM 3615 CA ARG B 116 -10.483 15.186 7.386 1.00 42.20 C ATOM 3616 C ARG B 116 -11.500 16.279 7.777 1.00 63.42 C ATOM 3617 O ARG B 116 -11.271 17.054 8.711 1.00 24.10 O ATOM 3618 CB ARG B 116 -9.926 14.474 8.655 1.00 34.55 C ATOM 3619 CG ARG B 116 -10.968 13.758 9.553 1.00 62.52 C ATOM 3620 CD ARG B 116 -11.632 12.559 8.865 1.00 45.03 C ATOM 3621 NE ARG B 116 -12.551 11.834 9.762 1.00 74.20 N ATOM 3622 CZ ARG B 116 -13.539 11.013 9.362 1.00 33.53 C ATOM 3623 NH1 ARG B 116 -13.769 10.798 8.066 1.00 21.53 N ATOM 3624 NH2 ARG B 116 -14.289 10.394 10.268 1.00 33.03 N ATOM 0 H ARG B 116 -8.451 15.612 7.029 1.00 4.11 H new ATOM 0 HA ARG B 116 -11.007 14.456 6.769 1.00 42.20 H new ATOM 0 HB2 ARG B 116 -9.185 13.740 8.338 1.00 34.55 H new ATOM 0 HB3 ARG B 116 -9.403 15.214 9.261 1.00 34.55 H new ATOM 0 HG2 ARG B 116 -10.480 13.420 10.467 1.00 62.52 H new ATOM 0 HG3 ARG B 116 -11.737 14.472 9.847 1.00 62.52 H new ATOM 0 HD2 ARG B 116 -12.181 12.904 7.989 1.00 45.03 H new ATOM 0 HD3 ARG B 116 -10.861 11.875 8.509 1.00 45.03 H new ATOM 0 HE ARG B 116 -12.428 11.965 10.766 1.00 74.20 H new ATOM 0 HH11 ARG B 116 -13.192 11.259 7.362 1.00 21.53 H new ATOM 0 HH12 ARG B 116 -14.522 10.173 7.779 1.00 21.53 H new ATOM 0 HH21 ARG B 116 -14.114 10.542 11.262 1.00 33.03 H new ATOM 0 HH22 ARG B 116 -15.039 9.771 9.969 1.00 33.03 H new ATOM 3638 N GLY B 117 -12.594 16.352 7.016 1.00 62.21 N ATOM 3639 CA GLY B 117 -13.700 17.272 7.295 1.00 32.00 C ATOM 3640 C GLY B 117 -15.048 16.553 7.287 1.00 4.13 C ATOM 3641 O GLY B 117 -15.101 15.361 7.665 1.00 12.22 O ATOM 3642 OXT GLY B 117 -16.068 17.167 6.899 1.00 37.94 O ATOM 0 H GLY B 117 -12.739 15.774 6.188 1.00 62.21 H new ATOM 0 HA2 GLY B 117 -13.545 17.744 8.265 1.00 32.00 H new ATOM 0 HA3 GLY B 117 -13.708 18.068 6.551 1.00 32.00 H new TER 3646 GLY B 117