#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wsf h SER 2 N 0.00 0.00 -3.38 3.17 0.02 -1.92 -3.44 113.55 108.00 2wsf h SER 2 Ca 0.00 0.00 -0.66 0.00 -0.84 0.00 0.00 61.79 60.29 2wsf h SER 2 Cb 0.00 0.00 -0.36 0.00 0.14 0.00 0.00 62.40 62.18 2wsf h SER 2 CO 0.00 0.03 -0.83 -1.00 -1.14 0.00 0.00 176.83 173.89 2wsf s HIS 3 N -4.15 2.82 -0.41 3.45 0.09 -1.26 -4.51 115.29 111.31 2wsf s HIS 3 Ca -0.03 -1.81 0.05 0.00 -0.00 0.00 0.00 55.06 53.26 2wsf s HIS 3 Cb 0.13 -1.85 0.19 0.00 -0.00 0.00 0.00 32.58 31.05 2wsf s HIS 3 CO 0.50 -0.81 0.43 -1.13 -0.00 0.00 0.00 174.74 173.73 2wsf n SER 4 N 4.59 -0.59 -4.01 1.40 3.41 -1.18 -5.05 113.62 112.19 2wsf n SER 4 Ca -0.17 -2.52 -0.27 0.00 -0.26 0.00 0.00 58.87 55.65 2wsf n SER 4 Cb 0.47 -0.35 -0.17 0.00 -0.26 0.00 0.00 64.21 63.90 2wsf n SER 4 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2wsf s VAL 5 N -0.19 1.28 -0.30 -3.33 -7.23 -1.26 -4.47 120.40 104.91 2wsf s VAL 5 Ca 0.33 -0.50 -0.19 0.00 -1.81 0.00 0.00 61.98 59.81 2wsf s VAL 5 Cb 0.08 -1.20 -0.01 0.00 0.56 0.00 0.00 36.38 35.80 2wsf s VAL 5 CO -0.17 0.40 0.57 -0.75 -0.31 0.00 0.00 175.10 174.84 2wsf s LYS 6 N 1.12 3.91 -0.01 4.82 2.20 -1.26 -4.72 119.74 125.80 2wsf s LYS 6 Ca -0.05 0.22 0.11 0.00 -0.36 0.00 0.00 55.97 55.89 2wsf s LYS 6 Cb -0.14 -3.71 -0.15 0.00 -1.51 0.00 0.00 37.83 32.31 2wsf s LYS 6 CO -0.03 -0.50 0.28 0.44 -0.36 0.00 0.00 175.35 175.18 2wsf n ILE 7 N 5.31 0.00 -0.21 5.43 -5.35 -1.26 -3.02 119.36 120.26 2wsf n ILE 7 Ca -0.03 -0.25 -0.08 0.00 -0.27 0.00 0.00 62.75 62.13 2wsf n ILE 7 Cb 0.49 0.43 0.01 0.00 -1.74 0.00 0.00 39.64 38.83 2wsf n ILE 7 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2wsf n TYR 8 N -1.72 -1.10 0.00 4.28 9.36 -1.26 -3.66 117.16 123.06 2wsf n TYR 8 Ca -0.01 -0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.21 2wsf n TYR 8 Cb 0.25 -0.30 0.00 0.00 -0.63 0.00 0.00 39.34 38.65 2wsf n TYR 8 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 2wsf n ASP 9 N 0.75 0.00 0.00 2.98 2.03 -1.26 -3.63 116.55 117.41 2wsf n ASP 9 Ca -0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2wsf n ASP 9 Cb 0.12 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.52 2wsf n ASP 9 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 2wsf n THR 10 N 0.00 0.00 -0.01 5.18 5.66 -1.26 -4.96 114.28 118.89 2wsf n THR 10 Ca 0.00 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.79 2wsf n THR 10 Cb 0.00 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 68.64 2wsf n THR 10 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2wsf n ILE 12 N -3.99 0.00 -2.02 0.00 -0.00 -1.26 -4.48 119.36 107.61 2wsf n ILE 12 Ca -0.25 0.00 -0.41 0.00 -0.00 0.00 0.00 62.75 62.09 2wsf n ILE 12 Cb 0.87 -0.04 -0.02 0.00 -0.00 0.00 0.00 39.64 40.45 2wsf n ILE 12 CO 0.00 0.00 0.00 -0.83 -0.00 0.00 0.00 176.55 175.72 2wsf s GLY 13 N -0.54 2.74 -0.46 7.39 0.00 -1.23 -4.22 107.32 111.00 2wsf s GLY 13 Ca 0.00 1.34 0.06 0.00 0.00 0.00 0.00 44.72 46.12 2wsf s GLY 13 CO 0.00 2.11 1.07 0.00 0.00 0.00 0.00 173.10 176.27 2wsf s THR 15 N -5.15 1.54 -1.05 0.00 2.01 -1.26 -4.67 115.64 107.06 2wsf s THR 15 Ca 0.47 -0.67 -0.20 0.00 0.31 0.00 0.00 61.69 61.59 2wsf s THR 15 Cb 0.38 -1.40 0.02 0.00 0.01 0.00 0.00 72.50 71.52 2wsf s THR 15 CO -0.16 0.45 0.66 1.67 -0.69 0.00 0.00 174.62 176.54 2wsf n GLN 16 N 4.13 -0.83 0.00 4.92 0.00 -1.26 -4.89 117.38 119.45 2wsf n GLN 16 Ca -0.19 0.39 0.00 0.00 -0.00 0.00 0.00 57.00 57.20 2wsf n GLN 16 Cb 0.51 -2.59 0.00 0.00 0.00 0.00 0.00 30.24 28.16 2wsf n GLN 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2wsf s VAL 18 N -0.63 0.00 0.00 0.00 0.11 -1.26 -1.41 120.40 117.21 2wsf s VAL 18 Ca 0.00 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 2wsf s VAL 18 Cb 0.00 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.85 2wsf s VAL 18 CO 0.00 0.00 0.00 0.54 -3.33 0.00 0.00 175.10 172.31 2wsf n ARG 19 N 2.88 0.00 -1.12 1.54 1.74 -1.26 -4.89 116.66 115.54 2wsf n ARG 19 Ca -0.15 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.50 2wsf n ARG 19 Cb 0.56 -0.20 -0.05 0.00 -1.02 0.00 0.00 32.46 31.75 2wsf n ARG 19 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wsf n ALA 20 N -2.18 -2.80 0.00 7.54 0.00 -1.26 -4.93 120.51 116.88 2wsf n ALA 20 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2wsf n ALA 20 Cb 0.02 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.16 2wsf n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wsf n PRO 22 N 0.00 0.00 0.00 0.00 -0.02 -1.26 -3.41 135.00 130.31 2wsf n PRO 22 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2wsf n PRO 22 Cb 0.00 -0.99 0.00 0.00 -0.02 0.00 0.00 33.50 32.49 2wsf n PRO 22 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2wsf n THR 23 N 5.35 0.00 -0.28 3.45 -1.04 -1.26 -4.70 114.28 115.80 2wsf n THR 23 Ca 0.63 0.00 0.25 0.00 -2.04 0.00 0.00 64.05 62.89 2wsf n THR 23 Cb 0.11 0.00 0.44 0.00 -1.82 0.00 0.00 70.33 69.07 2wsf n THR 23 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2wsf n ASP 24 N 3.44 0.19 -3.64 8.00 8.00 -1.22 -3.92 116.55 127.41 2wsf n ASP 24 Ca 0.00 1.05 -0.32 0.00 0.71 0.00 0.00 54.79 56.23 2wsf n ASP 24 Cb 0.00 -0.52 -0.05 0.00 -0.02 0.00 0.00 41.12 40.53 2wsf n ASP 24 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2wsf n VAL 25 N -4.31 3.24 -2.44 2.53 0.24 -1.26 -4.38 118.33 111.96 2wsf n VAL 25 Ca 0.27 -5.42 -0.43 0.00 -2.04 0.00 0.00 64.34 56.73 2wsf n VAL 25 Cb 1.01 -2.11 0.00 0.00 -1.47 0.00 0.00 33.84 31.27 2wsf n VAL 25 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 2wsf n LEU 26 N 1.08 5.62 0.00 1.34 0.00 -1.25 -4.91 117.00 118.88 2wsf n LEU 26 Ca 0.28 -4.16 0.00 0.00 0.00 0.00 0.00 56.01 52.13 2wsf n LEU 26 Cb 0.38 -1.67 0.00 0.00 0.00 0.00 0.00 43.42 42.13 2wsf n LEU 26 CO 0.49 0.62 0.00 -0.62 0.00 0.00 0.00 177.39 177.88 2wsf n GLU 27 N 6.83 0.80 -3.02 1.96 1.02 -1.26 -4.37 120.64 122.59 2wsf n GLU 27 Ca 0.46 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.47 2wsf n GLU 27 Cb 0.43 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 31.86 2wsf n GLU 27 CO 0.00 0.00 0.00 -0.12 1.18 0.00 0.00 177.13 178.19 2wsf n MET 28 N 0.00 -2.29 -3.24 3.49 1.56 -1.26 -5.01 117.12 110.37 2wsf n MET 28 Ca 0.00 1.96 -0.24 0.00 -0.27 0.00 0.00 57.70 59.14 2wsf n MET 28 Cb 0.00 -4.25 -0.07 0.00 2.15 0.00 0.00 33.22 31.05 2wsf n MET 28 CO 0.00 0.00 0.00 -0.89 -0.73 0.00 0.00 175.97 174.35 2wsf n ILE 29 N 0.11 0.38 -1.39 1.12 5.41 -1.26 -4.98 119.36 118.75 2wsf n ILE 29 Ca 0.03 -4.48 -0.50 0.00 1.00 0.00 0.00 62.75 58.81 2wsf n ILE 29 Cb 0.42 -1.80 -0.13 0.00 -0.71 0.00 0.00 39.64 37.43 2wsf n ILE 29 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2wsf n PRO 30 N 1.06 0.07 -2.60 0.38 -0.04 -1.25 -4.07 135.00 128.55 2wsf n PRO 30 Ca 0.24 0.01 -0.42 0.00 -0.04 0.00 0.00 63.50 63.30 2wsf n PRO 30 Cb 0.50 -1.59 -0.03 0.00 -0.04 0.00 0.00 33.50 32.34 2wsf n PRO 30 CO 0.00 0.00 0.00 -0.46 -0.04 0.00 0.00 175.50 175.00 2wsf s TRP 31 N 7.71 3.58 0.00 0.54 -0.11 -1.26 -4.84 118.94 124.56 2wsf s TRP 31 Ca 1.27 1.55 0.00 0.00 1.22 0.00 0.00 56.10 60.14 2wsf s TRP 31 Cb -1.32 -3.23 0.00 0.00 -1.50 0.00 0.00 33.47 27.42 2wsf s TRP 31 CO 0.56 -0.49 0.00 0.41 -4.62 0.00 0.00 176.95 172.81 2wsf n GLY 32 N 2.95 0.00 0.00 5.86 0.00 -1.26 -3.44 105.19 109.30 2wsf n GLY 32 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2wsf n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wsf n GLY 33 N 1.28 1.32 2.50 -0.02 0.00 -1.26 -5.11 105.19 103.89 2wsf n GLY 33 Ca 0.00 -0.39 -0.14 0.00 0.00 0.00 0.00 46.02 45.49 2wsf n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wsf n LYS 35 N 0.97 0.00 0.00 0.00 4.81 -1.26 -2.14 118.16 120.54 2wsf n LYS 35 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.58 2wsf n LYS 35 Cb 0.63 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.68 2wsf n LYS 35 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2wsf n ALA 36 N 6.79 2.09 -3.49 3.14 0.00 -1.26 -4.89 120.51 122.88 2wsf n ALA 36 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 2wsf n ALA 36 Cb 0.00 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.44 2wsf n ALA 36 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2wsf n LYS 37 N -0.10 -0.88 -3.97 0.00 -0.00 -0.91 -4.84 118.16 107.47 2wsf n LYS 37 Ca 0.00 -0.18 -0.15 0.00 -0.00 0.00 0.00 58.31 57.97 2wsf n LYS 37 Cb 0.10 -0.54 -0.15 0.00 -0.00 0.00 0.00 35.03 34.45 2wsf n LYS 37 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.40 178.54 2wsf s GLN 38 N -5.13 0.25 0.00 -1.58 0.00 -1.26 -3.96 119.66 107.98 2wsf s GLN 38 Ca 0.08 -0.01 0.00 0.00 -0.00 0.00 0.00 55.36 55.44 2wsf s GLN 38 Cb -0.05 -0.34 0.00 0.00 0.00 0.00 0.00 33.01 32.62 2wsf s GLN 38 CO 0.30 -0.04 0.00 1.51 0.00 0.00 0.00 175.29 177.06 2wsf n ILE 39 N 3.59 0.00 -4.53 3.63 3.06 -1.26 -3.53 119.36 120.32 2wsf n ILE 39 Ca -0.20 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.05 2wsf n ILE 39 Cb 0.55 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.73 2wsf n ILE 39 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2wsf n ALA 40 N -3.00 0.00 -0.01 1.51 0.00 -1.26 -4.51 120.51 113.24 2wsf n ALA 40 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2wsf n ALA 40 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2wsf n ALA 40 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2wsf n SER 41 N -0.41 0.00 -3.50 0.00 7.64 -1.26 -4.62 113.62 111.47 2wsf n SER 41 Ca 0.00 0.00 -0.03 0.00 1.01 0.00 0.00 58.87 59.85 2wsf n SER 41 Cb 0.00 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.21 2wsf n SER 41 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wsf s ALA 42 N 0.00 -1.58 0.00 -0.43 0.00 -1.26 -4.74 121.76 113.74 2wsf s ALA 42 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 51.81 2wsf s ALA 42 Cb 0.00 0.70 0.00 0.00 0.00 0.00 0.00 23.12 23.82 2wsf s ALA 42 CO 0.00 -1.05 0.00 -0.35 0.00 0.00 0.00 175.76 174.36 2wsf n PRO 43 N -0.59 3.97 -1.89 0.00 -0.04 -1.26 -4.80 135.00 130.39 2wsf n PRO 43 Ca -0.05 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.01 2wsf n PRO 43 Cb 0.60 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 34.03 2wsf n PRO 43 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2wsf s ARG 44 N 3.12 2.95 0.00 0.54 1.70 -1.26 -4.86 118.95 121.14 2wsf s ARG 44 Ca 0.00 1.31 0.26 0.00 -0.47 0.00 0.00 55.73 56.83 2wsf s ARG 44 Cb 0.00 -4.32 0.65 0.00 -0.57 0.00 0.00 34.95 30.71 2wsf s ARG 44 CO 0.00 -2.31 1.50 0.25 -1.08 0.00 0.00 175.30 173.66 2wsf n THR 45 N 7.50 0.00 -1.52 4.99 -2.24 -1.26 -4.59 114.28 117.16 2wsf n THR 45 Ca 0.25 -0.11 -0.41 0.00 -2.27 0.00 0.00 64.05 61.52 2wsf n THR 45 Cb 0.49 0.42 -0.04 0.00 -2.10 0.00 0.00 70.33 69.10 2wsf n THR 45 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2wsf n GLU 46 N -0.80 1.98 0.07 -0.78 0.28 -1.26 -3.59 120.64 116.53 2wsf n GLU 46 Ca 0.11 -2.22 0.00 0.00 -0.16 0.00 0.00 57.16 54.88 2wsf n GLU 46 Cb 0.35 -3.16 0.00 0.00 1.43 0.00 0.00 31.44 30.06 2wsf n GLU 46 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2wsf n ASP 47 N 8.10 -1.06 -4.43 -1.84 2.03 -1.26 -5.17 116.55 112.92 2wsf n ASP 47 Ca 0.50 0.26 -0.21 0.00 0.52 0.00 0.00 54.79 55.85 2wsf n ASP 47 Cb 0.41 1.27 -0.10 0.00 -0.72 0.00 0.00 41.12 41.98 2wsf n ASP 47 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2wsf n VAL 49 N -0.60 0.00 -3.62 0.00 3.14 -1.26 -4.92 118.33 111.07 2wsf n VAL 49 Ca -0.05 0.00 -0.27 0.00 -2.96 0.00 0.00 64.34 61.06 2wsf n VAL 49 Cb 0.64 0.00 -0.11 0.00 -1.06 0.00 0.00 33.84 33.31 2wsf n VAL 49 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2wsf n GLY 50 N 0.00 3.05 0.07 7.55 0.00 -1.26 -5.05 105.19 109.54 2wsf n GLY 50 Ca 0.00 -1.92 -0.07 0.00 0.00 0.00 0.00 46.02 44.03 2wsf n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wsf n LYS 52 N -4.66 0.00 0.33 0.00 3.00 -1.26 -4.72 118.16 110.84 2wsf n LYS 52 Ca -0.08 0.00 0.20 0.00 -0.00 0.00 0.00 58.31 58.43 2wsf n LYS 52 Cb 0.25 -4.43 1.04 0.00 0.00 0.00 0.00 35.03 31.89 2wsf n LYS 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2wsf h ARG 53 N 0.09 0.00 -0.48 1.64 3.08 -1.92 -2.69 114.38 114.10 2wsf h ARG 53 Ca 0.00 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.10 2wsf h ARG 53 Cb 0.00 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 29.97 2wsf h ARG 53 CO 0.00 0.00 -0.54 0.00 -1.07 0.00 0.00 179.97 178.36 2wsf n GLU 55 N -5.23 0.00 0.00 0.00 0.00 -1.20 -4.66 120.64 109.54 2wsf n GLU 55 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.13 2wsf n GLU 55 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.75 2wsf n GLU 55 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2wsf n SER 56 N 0.00 0.00 -4.31 4.31 2.88 -1.02 -4.55 113.62 110.94 2wsf n SER 56 Ca 0.00 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.37 2wsf n SER 56 Cb 0.00 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.36 2wsf n SER 56 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wsf s ALA 57 N 0.00 1.79 -0.04 -1.46 0.00 -1.26 -5.01 121.76 115.78 2wsf s ALA 57 Ca 0.00 -1.57 -0.03 0.00 0.00 0.00 0.00 51.96 50.36 2wsf s ALA 57 Cb 0.00 -0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.09 2wsf s ALA 57 CO 0.00 0.02 0.06 0.00 0.00 0.00 0.00 175.76 175.84 2wsf n PRO 59 N 2.19 0.00 0.00 0.00 -0.02 -1.26 -4.76 135.00 131.15 2wsf n PRO 59 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 2wsf n PRO 59 Cb 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.62 2wsf n PRO 59 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 2wsf n THR 60 N 0.00 0.00 -0.72 3.45 5.66 -1.24 -4.36 114.28 117.07 2wsf n THR 60 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2wsf n THR 60 Cb 0.00 0.59 0.00 0.00 -1.55 0.00 0.00 70.33 69.37 2wsf n THR 60 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2wsf n ASP 61 N 0.00 0.00 0.00 1.09 8.00 -1.26 -3.92 116.55 120.46 2wsf n ASP 61 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2wsf n ASP 61 Cb 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 2wsf n ASP 61 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2wsf n PHE 62 N -0.10 0.00 0.00 1.24 3.72 -1.26 -5.01 117.46 116.06 2wsf n PHE 62 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2wsf n PHE 62 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 2wsf n PHE 62 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 176.76 178.18 2wsf n LEU 63 N 0.00 0.00 0.00 4.37 -0.00 -1.25 -5.11 117.00 115.01 2wsf n LEU 63 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2wsf n LEU 63 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2wsf n LEU 63 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 177.39 175.85 2wsf n SER 64 N 0.00 0.00 -0.42 1.45 3.41 -1.17 -4.65 113.62 112.25 2wsf n SER 64 Ca 0.00 -0.04 0.05 0.00 -0.26 0.00 0.00 58.87 58.62 2wsf n SER 64 Cb 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 2wsf n SER 64 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2wsf n VAL 65 N 0.00 -0.15 0.00 -3.33 0.31 -1.24 -4.03 118.33 109.90 2wsf n VAL 65 Ca 0.00 0.21 0.00 0.00 -0.01 0.00 0.00 64.34 64.54 2wsf n VAL 65 Cb 0.01 -0.36 0.00 0.00 -0.91 0.00 0.00 33.84 32.59 2wsf n VAL 65 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 2wsf n ARG 66 N -2.84 0.00 0.01 5.55 1.85 -1.26 -4.58 116.66 115.39 2wsf n ARG 66 Ca -0.02 0.00 -0.09 0.00 -1.00 0.00 0.00 57.85 56.74 2wsf n ARG 66 Cb 0.20 0.00 -0.13 0.00 -1.05 0.00 0.00 32.46 31.47 2wsf n ARG 66 CO 0.00 0.00 0.00 -0.24 -0.01 0.00 0.00 177.63 177.38 2wsf h VAL 67 N 0.00 1.12 -0.42 8.89 3.04 -1.93 -3.37 116.25 123.58 2wsf h VAL 67 Ca 0.00 -2.92 -0.52 0.00 -1.01 0.00 0.00 66.70 62.25 2wsf h VAL 67 Cb 0.00 2.56 -0.06 0.00 -2.01 0.00 0.00 31.29 31.78 2wsf h VAL 67 CO 0.00 0.65 1.68 0.00 -1.01 0.00 0.00 177.57 178.90 2wsf n TYR 68 N -3.16 0.85 0.00 3.17 9.36 -1.26 -4.47 117.16 121.65 2wsf n TYR 68 Ca -0.12 0.34 0.00 0.00 3.32 0.00 0.00 57.90 61.44 2wsf n TYR 68 Cb 1.02 -2.44 0.00 0.00 -0.63 0.00 0.00 39.34 37.29 2wsf n TYR 68 CO 0.00 0.00 0.00 1.47 0.22 0.00 0.00 176.86 178.55 2wsf n LEU 69 N 11.48 0.00 0.00 2.98 -0.00 -1.26 -3.12 117.00 127.08 2wsf n LEU 69 Ca 0.57 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.58 2wsf n LEU 69 Cb 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.57 2wsf n LEU 69 CO 0.87 0.00 0.00 0.79 -0.00 0.00 0.00 177.39 179.05 2wsf n TRP 70 N -0.35 0.00 -1.43 1.47 7.02 -1.26 -4.62 117.44 118.27 2wsf n TRP 70 Ca 0.00 0.00 -0.52 0.00 -1.02 0.00 0.00 57.50 55.96 2wsf n TRP 70 Cb 0.00 0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 28.81 2wsf n TRP 70 CO 0.00 0.00 0.00 0.72 -2.02 0.00 0.00 177.69 176.39 2wsf n HIS 71 N 0.00 1.56 -3.56 -5.99 8.25 -1.26 -4.81 115.22 109.41 2wsf n HIS 71 Ca 0.00 0.35 -0.21 0.00 -0.26 0.00 0.00 57.72 57.60 2wsf n HIS 71 Cb 0.00 -2.50 -0.15 0.00 1.12 0.00 0.00 29.99 28.46 2wsf n HIS 71 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2wsf s GLU 72 N 6.10 0.12 0.00 -0.41 2.12 -1.26 -4.86 118.70 120.51 2wsf s GLU 72 Ca 1.11 0.14 0.00 0.00 0.36 0.00 0.00 54.97 56.58 2wsf s GLU 72 Cb -0.95 -1.32 0.00 0.00 0.26 0.00 0.00 34.13 32.12 2wsf s GLU 72 CO 0.52 -0.62 0.00 0.25 -0.54 0.00 0.00 175.26 174.87 2wsf n THR 73 N 5.31 0.00 0.02 -1.70 -2.24 -1.26 -4.96 114.28 109.45 2wsf n THR 73 Ca -0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 2wsf n THR 73 Cb 0.49 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 2wsf n THR 73 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2wsf n THR 74 N 0.00 0.38 0.24 4.28 5.66 -1.26 -4.23 114.28 119.34 2wsf n THR 74 Ca 0.00 0.13 0.05 0.00 -3.05 0.00 0.00 64.05 61.17 2wsf n THR 74 Cb 0.00 -1.36 0.25 0.00 -1.55 0.00 0.00 70.33 67.66 2wsf n THR 74 CO 0.00 0.00 0.00 0.08 -3.05 0.00 0.00 175.07 172.10 2wsf h ARG 75 N 0.00 0.00 -0.58 1.09 0.11 -1.92 1.76 114.38 114.84 2wsf h ARG 75 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2wsf h ARG 75 Cb 0.53 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.61 2wsf h ARG 75 CO 0.00 0.00 0.00 -1.13 0.10 0.00 0.00 179.97 178.94 2wsf n SER 76 N -2.23 2.41 -1.35 0.08 3.41 -1.26 -4.26 113.62 110.42 2wsf n SER 76 Ca -0.01 -2.21 -0.04 0.00 -0.26 0.00 0.00 58.87 56.35 2wsf n SER 76 Cb 0.63 -0.41 -0.03 0.00 -0.26 0.00 0.00 64.21 64.15 2wsf n SER 76 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 2wsf n MET 77 N 0.35 0.21 0.00 4.33 2.81 0.60 -4.64 117.12 120.78 2wsf n MET 77 Ca 0.11 -1.31 0.00 0.00 -1.81 0.00 0.00 57.70 54.69 2wsf n MET 77 Cb 0.48 0.32 0.00 0.00 -0.71 0.00 0.00 33.22 33.30 2wsf n MET 77 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wsf n GLY 78 N -0.10 0.64 3.32 3.03 0.00 -1.18 -4.63 105.19 106.28 2wsf n GLY 78 Ca -0.19 -0.01 -0.45 0.00 0.00 0.00 0.00 46.02 45.38 2wsf n GLY 78 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wsf s LEU 79 N 0.00 6.33 -0.83 0.99 0.20 -1.26 -4.47 118.68 119.64 2wsf s LEU 79 Ca 0.00 -3.51 -0.01 0.00 0.69 0.00 0.00 54.13 51.30 2wsf s LEU 79 Cb 0.00 -2.19 0.35 0.00 -0.43 0.00 0.00 46.19 43.93 2wsf s LEU 79 CO 0.00 -0.31 1.90 0.00 -0.29 0.00 0.00 176.35 177.65 2wsf n ALA 80 N 2.81 6.31 -1.67 5.97 0.00 -1.26 -4.92 120.51 127.76 2wsf n ALA 80 Ca 0.22 -4.21 0.00 0.00 0.00 0.00 0.00 53.44 49.45 2wsf n ALA 80 Cb 0.40 -1.87 0.00 0.00 0.00 0.00 0.00 19.45 17.98 2wsf n ALA 80 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98