#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wff s SER 2 N 0.00 -0.34 -0.24 1.61 1.04 -1.26 -5.18 113.70 109.33 1wff s SER 2 Ca 0.00 -0.42 -0.28 0.00 0.48 0.00 0.00 55.95 55.73 1wff s SER 2 Cb 0.00 0.68 0.15 0.00 0.10 0.00 0.00 66.02 66.95 1wff s SER 2 CO 0.00 -1.21 1.17 -0.55 0.98 0.00 0.00 173.24 173.62 1wff s SER 3 N -2.87 -0.26 0.06 7.02 0.15 -1.26 -5.19 113.70 111.36 1wff s SER 3 Ca 0.08 0.37 -0.27 0.00 0.70 0.00 0.00 55.95 56.84 1wff s SER 3 Cb -0.04 0.33 0.07 0.00 -1.71 0.00 0.00 66.02 64.67 1wff s SER 3 CO 0.01 -0.17 0.63 -0.83 1.20 0.00 0.00 173.24 174.08 1wff s GLY 4 N -0.59 -0.59 -0.08 9.45 0.00 -1.26 -5.18 107.32 109.07 1wff s GLY 4 Ca 0.03 0.87 -0.30 0.00 0.00 0.00 0.00 44.72 45.32 1wff s GLY 4 CO -0.05 0.53 0.98 -1.35 0.00 0.00 0.00 173.10 173.20 1wff s SER 5 N -2.00 -0.32 -0.00 1.64 1.04 -1.26 -5.19 113.70 107.60 1wff s SER 5 Ca -0.05 0.11 -0.29 0.00 0.48 0.00 0.00 55.95 56.20 1wff s SER 5 Cb -0.01 0.32 0.10 0.00 0.10 0.00 0.00 66.02 66.53 1wff s SER 5 CO -0.02 -0.48 0.94 -0.55 0.98 0.00 0.00 173.24 174.11 1wff s SER 6 N -2.06 -0.31 0.00 7.02 0.15 -1.26 -5.19 113.70 112.06 1wff s SER 6 Ca 0.04 -0.06 0.00 0.00 0.70 0.00 0.00 55.95 56.63 1wff s SER 6 Cb -0.01 0.37 0.00 0.00 -1.71 0.00 0.00 66.02 64.67 1wff s SER 6 CO -0.05 -0.61 0.00 0.61 1.20 0.00 0.00 173.24 174.38 1wff n GLY 7 N -0.27 1.69 3.31 9.45 0.00 -1.26 -5.19 105.19 112.92 1wff n GLY 7 Ca -0.07 -0.20 -0.10 0.00 0.00 0.00 0.00 46.02 45.65 1wff n GLY 7 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1wff s ILE 8 N -1.59 0.04 -0.23 -0.61 -4.36 -1.26 -5.18 121.20 108.01 1wff s ILE 8 Ca 0.00 -1.67 -0.27 0.00 -0.26 0.00 0.00 60.65 58.45 1wff s ILE 8 Cb 0.00 -2.14 0.12 0.00 1.25 0.00 0.00 42.46 41.69 1wff s ILE 8 CO 0.00 -0.18 1.01 -1.00 0.24 0.00 0.00 174.94 175.00 1wff s HIS 9 N -4.05 -0.45 0.30 1.37 3.76 -1.26 -5.19 115.29 109.78 1wff s HIS 9 Ca 0.26 0.99 -0.18 0.00 -0.15 0.00 0.00 55.06 55.97 1wff s HIS 9 Cb 0.04 0.39 0.07 0.00 1.11 0.00 0.00 32.58 34.19 1wff s HIS 9 CO 0.06 -0.28 0.91 -2.39 -0.85 0.00 0.00 174.74 172.19 1wff n HIS 10 N 1.68 -1.91 -3.63 1.40 1.44 -1.26 -5.19 115.22 107.76 1wff n HIS 10 Ca -0.12 -1.60 -0.09 0.00 -2.01 0.00 0.00 57.72 53.90 1wff n HIS 10 Cb 0.57 0.79 -0.06 0.00 0.12 0.00 0.00 29.99 31.40 1wff n HIS 10 CO 0.00 0.00 0.00 -0.48 -2.81 0.00 0.00 176.34 173.05 1wff s LEU 11 N 0.00 -0.37 0.25 2.39 -0.00 -1.26 -5.16 118.68 114.53 1wff s LEU 11 Ca 0.19 0.65 -0.30 0.00 -0.00 0.00 0.00 54.13 54.67 1wff s LEU 11 Cb -0.04 1.76 -0.09 0.00 -0.00 0.00 0.00 46.19 47.82 1wff s LEU 11 CO 0.09 -0.18 1.27 -2.16 -0.00 0.00 0.00 176.35 175.37 1wff s PRO 12 N -0.14 4.42 0.75 1.48 0.04 -1.26 -5.04 135.00 135.25 1wff s PRO 12 Ca 0.03 2.05 -0.13 0.00 0.04 0.00 0.00 61.00 62.99 1wff s PRO 12 Cb -0.04 -3.16 0.19 0.00 0.04 0.00 0.00 34.50 31.52 1wff s PRO 12 CO -0.06 -0.16 0.66 -0.35 0.04 0.00 0.00 177.00 177.14 1wff n PRO 13 N 1.91 -2.32 -4.03 0.56 -0.04 -1.26 -5.09 135.00 124.72 1wff n PRO 13 Ca 0.03 -1.06 -0.09 0.00 -0.04 0.00 0.00 63.50 62.34 1wff n PRO 13 Cb 0.43 -0.99 -0.11 0.00 -0.04 0.00 0.00 33.50 32.79 1wff n PRO 13 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1wff s VAL 14 N -2.20 0.26 0.05 0.52 0.11 -1.26 -5.17 120.40 112.71 1wff s VAL 14 Ca 0.43 -1.22 -0.17 0.00 -2.93 0.00 0.00 61.98 58.09 1wff s VAL 14 Cb -0.04 -0.71 0.03 0.00 -1.53 0.00 0.00 36.38 34.13 1wff s VAL 14 CO 0.33 -0.62 0.40 -1.59 -3.33 0.00 0.00 175.10 170.29 1wff s LYS 15 N -2.21 0.91 -0.07 1.54 -2.85 -1.26 -5.16 119.74 110.64 1wff s LYS 15 Ca -0.08 -0.40 -0.03 0.00 -1.00 0.00 0.00 55.97 54.47 1wff s LYS 15 Cb -0.05 0.41 0.04 0.00 -2.06 0.00 0.00 37.83 36.17 1wff s LYS 15 CO -0.03 -0.31 0.13 0.00 0.10 0.00 0.00 175.35 175.24 1wff s ALA 16 N -2.55 -0.06 1.12 0.59 0.00 -1.26 -5.16 121.76 114.44 1wff s ALA 16 Ca -0.05 0.47 -0.16 0.00 0.00 0.00 0.00 51.96 52.22 1wff s ALA 16 Cb -0.01 -0.74 0.25 0.00 0.00 0.00 0.00 23.12 22.62 1wff s ALA 16 CO -0.03 -0.52 1.10 -1.25 0.00 0.00 0.00 175.76 175.06 1wff s PRO 17 N 2.19 -0.58 0.13 0.00 0.04 -1.26 -5.08 135.00 130.44 1wff s PRO 17 Ca 0.03 0.17 0.07 0.00 0.04 0.00 0.00 61.00 61.31 1wff s PRO 17 Cb -0.12 -1.65 -0.04 0.00 0.04 0.00 0.00 34.50 32.73 1wff s PRO 17 CO -0.05 -3.33 -0.16 -0.51 0.04 0.00 0.00 177.00 172.98 1wff s LEU 18 N -6.76 2.40 -0.90 -3.56 1.43 -1.26 -5.09 118.68 104.95 1wff s LEU 18 Ca 0.69 -0.81 -0.19 0.00 -1.03 0.00 0.00 54.13 52.79 1wff s LEU 18 Cb -0.14 -0.69 0.12 0.00 0.03 0.00 0.00 46.19 45.52 1wff s LEU 18 CO 0.57 -0.08 1.11 0.00 0.23 0.00 0.00 176.35 178.17 1wff s GLN 19 N -2.60 3.54 -0.38 1.70 -2.07 -1.26 -4.93 119.66 113.66 1wff s GLN 19 Ca 0.11 -1.66 0.01 0.00 -1.82 0.00 0.00 55.36 51.99 1wff s GLN 19 Cb -0.06 -4.84 0.13 0.00 -1.09 0.00 0.00 33.01 27.15 1wff s GLN 19 CO 0.04 -1.78 0.20 0.95 -1.32 0.00 0.00 175.29 173.39 1wff s THR 20 N 2.83 0.85 -0.27 3.63 -4.23 -1.26 -5.07 115.64 112.13 1wff s THR 20 Ca 0.31 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.81 1wff s THR 20 Cb -0.06 -1.62 0.08 0.00 1.34 0.00 0.00 72.50 72.24 1wff s THR 20 CO -0.07 -0.88 0.06 -0.75 -0.54 0.00 0.00 174.62 172.44 1wff s LYS 21 N 0.89 0.80 -0.21 3.99 2.20 -1.26 -5.10 119.74 121.04 1wff s LYS 21 Ca 0.16 -0.86 -0.27 0.00 -0.36 0.00 0.00 55.97 54.64 1wff s LYS 21 Cb -0.22 -2.09 0.09 0.00 -1.51 0.00 0.00 37.83 34.09 1wff s LYS 21 CO -0.06 -0.84 0.80 0.21 -0.36 0.00 0.00 175.35 175.11 1wff s LYS 22 N 1.67 0.80 -0.11 4.03 2.20 -1.26 -5.04 119.74 122.03 1wff s LYS 22 Ca 0.05 0.67 -0.05 0.00 -0.36 0.00 0.00 55.97 56.27 1wff s LYS 22 Cb -0.17 0.38 -0.19 0.00 -1.51 0.00 0.00 37.83 36.34 1wff s LYS 22 CO -0.18 -0.15 3.42 0.36 -0.36 0.00 0.00 175.35 178.44 1wff n LYS 23 N 2.00 2.09 -4.51 4.03 2.85 -1.26 -4.82 118.16 118.54 1wff n LYS 23 Ca -0.14 -1.31 -0.28 0.00 -1.05 0.00 0.00 58.31 55.52 1wff n LYS 23 Cb 0.56 -2.03 -0.17 0.00 -0.65 0.00 0.00 35.03 32.74 1wff n LYS 23 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1wff s ILE 24 N 0.24 1.48 0.00 0.58 1.01 -1.26 -4.89 121.20 118.36 1wff s ILE 24 Ca 0.65 -0.64 0.00 0.00 0.00 0.00 0.00 60.65 60.66 1wff s ILE 24 Cb 0.33 -1.35 0.00 0.00 0.01 0.00 0.00 42.46 41.45 1wff s ILE 24 CO -0.05 0.44 0.00 1.15 0.00 0.00 0.00 174.94 176.47 1wff n MET 25 N 4.13 1.08 -2.02 2.79 0.00 -1.26 -5.04 117.12 116.80 1wff n MET 25 Ca -0.19 0.00 -0.32 0.00 0.00 0.00 0.00 57.70 57.19 1wff n MET 25 Cb 0.51 -0.68 0.00 0.00 0.00 0.00 0.00 33.22 33.05 1wff n MET 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 175.97 174.38 1wff s LYS 26 N -1.37 3.57 -0.10 3.17 -2.85 -1.26 -5.01 119.74 115.89 1wff s LYS 26 Ca 0.00 0.91 -0.31 0.00 -1.00 0.00 0.00 55.97 55.58 1wff s LYS 26 Cb 0.00 -2.08 0.12 0.00 -2.06 0.00 0.00 37.83 33.81 1wff s LYS 26 CO 0.00 -0.59 1.00 -3.38 0.10 0.00 0.00 175.35 172.48 1wff s HIS 27 N -2.88 -0.30 0.17 1.78 -3.43 -1.26 -2.95 115.29 106.42 1wff s HIS 27 Ca 0.58 0.30 -0.18 0.00 -0.80 0.00 0.00 55.06 54.96 1wff s HIS 27 Cb -0.12 0.51 -0.11 0.00 -1.43 0.00 0.00 32.58 31.42 1wff s HIS 27 CO 0.44 -0.40 0.28 0.00 -2.00 0.00 0.00 174.74 173.07 1wff n PHE 29 N -0.17 0.52 -0.01 0.00 7.35 -0.36 -2.86 117.46 121.93 1wff n PHE 29 Ca 0.11 0.15 -0.00 0.00 -0.76 0.00 0.00 57.45 56.95 1wff n PHE 29 Cb 0.20 -0.66 -0.00 0.00 0.35 0.00 0.00 39.48 39.36 1wff n PHE 29 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 1wff h LEU 30 N 0.00 0.00 0.03 -2.13 5.85 -1.89 -3.43 115.31 113.74 1wff h LEU 30 Ca 0.00 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 58.43 1wff h LEU 30 Cb 0.86 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.86 1wff h LEU 30 CO 0.00 0.13 -1.58 0.00 -0.34 0.00 0.00 178.44 176.65 1wff n GLY 32 N 1.57 1.85 3.75 0.00 0.00 -1.14 -5.04 105.19 106.19 1wff n GLY 32 Ca -0.34 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 1wff n GLY 32 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1wff s LYS 33 N -0.20 4.64 -0.11 1.61 2.20 -1.26 -4.64 119.74 121.98 1wff s LYS 33 Ca 0.00 1.71 -0.30 0.00 -0.36 0.00 0.00 55.97 57.03 1wff s LYS 33 Cb 0.00 -3.25 -0.08 0.00 -1.51 0.00 0.00 37.83 32.99 1wff s LYS 33 CO 0.00 0.17 2.10 0.36 -0.36 0.00 0.00 175.35 177.61 1wff n LYS 34 N 1.93 2.32 -0.07 4.03 2.85 -1.26 -1.26 118.16 126.71 1wff n LYS 34 Ca 0.01 0.76 -0.10 0.00 -1.05 0.00 0.00 58.31 57.93 1wff n LYS 34 Cb 0.46 -3.07 -0.06 0.00 -0.65 0.00 0.00 35.03 31.71 1wff n LYS 34 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1wff n THR 35 N 6.61 0.80 0.00 0.58 -2.24 -1.24 -4.92 114.28 113.87 1wff n THR 35 Ca 0.26 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 1wff n THR 35 Cb 0.41 -1.03 0.00 0.00 -2.10 0.00 0.00 70.33 67.61 1wff n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wff n GLY 36 N 2.80 3.38 2.07 3.38 0.00 -1.15 -2.51 105.19 113.16 1wff n GLY 36 Ca -0.25 -0.01 -0.20 0.00 0.00 0.00 0.00 46.02 45.57 1wff n GLY 36 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1wff n LEU 37 N 0.00 4.43 0.02 0.99 7.94 -1.26 -4.26 117.00 124.86 1wff n LEU 37 Ca 0.00 -4.50 0.00 0.00 -1.11 0.00 0.00 56.01 50.40 1wff n LEU 37 Cb 0.00 -0.25 0.00 0.00 0.53 0.00 0.00 43.42 43.70 1wff n LEU 37 CO 0.00 1.95 -0.26 0.00 -1.11 0.00 0.00 177.39 177.97 1wff n ALA 38 N -0.70 3.00 0.38 1.96 0.00 -1.04 -4.87 120.51 119.23 1wff n ALA 38 Ca 0.39 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.88 1wff n ALA 38 Cb 0.94 0.29 -0.07 0.00 0.00 0.00 0.00 19.45 20.61 1wff n ALA 38 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1wff n THR 39 N -2.99 0.00 -1.69 0.00 5.66 -1.15 -4.99 114.28 109.13 1wff n THR 39 Ca 0.00 -0.24 -0.51 0.00 -3.05 0.00 0.00 64.05 60.25 1wff n THR 39 Cb 0.26 0.78 -0.05 0.00 -1.55 0.00 0.00 70.33 69.76 1wff n THR 39 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1wff n SER 40 N -1.46 3.08 -4.64 1.09 3.41 -1.22 -4.37 113.62 109.52 1wff n SER 40 Ca 0.01 1.01 -0.28 0.00 -0.26 0.00 0.00 58.87 59.35 1wff n SER 40 Cb 0.22 -1.31 -0.11 0.00 -0.26 0.00 0.00 64.21 62.75 1wff n SER 40 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1wff s PHE 41 N 3.54 2.46 -0.06 7.33 0.08 -1.19 -4.99 117.98 125.16 1wff s PHE 41 Ca 0.93 -0.69 0.06 0.00 0.12 0.00 0.00 56.93 57.34 1wff s PHE 41 Cb -0.80 -1.77 -0.01 0.00 -0.57 0.00 0.00 43.02 39.87 1wff s PHE 41 CO 0.54 0.42 -0.23 -1.83 -0.10 0.00 0.00 175.22 174.02 1wff s GLU 42 N -3.73 2.53 0.31 0.44 -1.05 -1.26 -3.45 118.70 112.49 1wff s GLU 42 Ca 0.33 -0.86 0.08 0.00 -0.15 0.00 0.00 54.97 54.36 1wff s GLU 42 Cb 0.09 -2.21 -0.04 0.00 -0.44 0.00 0.00 34.13 31.53 1wff s GLU 42 CO 0.17 0.43 0.16 0.00 0.95 0.00 0.00 175.26 176.97 1wff h ARG 44 N 1.53 0.48 -0.54 0.00 2.47 -1.94 0.90 114.38 117.28 1wff h ARG 44 Ca -0.45 -0.03 -0.11 0.00 -1.26 0.00 0.00 59.98 58.13 1wff h ARG 44 Cb 1.25 -0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 29.44 1wff h ARG 44 CO 0.61 0.32 -0.11 0.00 0.56 0.00 0.00 179.97 181.35 1wff n GLY 46 N -0.28 1.78 3.39 0.00 0.00 0.31 -5.07 105.19 105.33 1wff n GLY 46 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1wff n GLY 46 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wff s ASN 47 N -2.00 3.87 -0.20 1.61 0.01 -1.26 -4.89 114.94 112.08 1wff s ASN 47 Ca 0.00 -0.31 -0.29 0.00 -0.71 0.00 0.00 52.86 51.55 1wff s ASN 47 Cb 0.00 -1.22 0.00 0.00 0.41 0.00 0.00 41.25 40.45 1wff s ASN 47 CO 0.00 0.24 1.11 0.54 -1.51 0.00 0.00 177.10 177.49 1wff s ASN 48 N -0.13 7.05 0.38 -1.22 4.22 -1.26 -3.54 114.94 120.44 1wff s ASN 48 Ca -0.02 1.49 0.06 0.00 -2.14 0.00 0.00 52.86 52.25 1wff s ASN 48 Cb -0.14 -2.54 -0.07 0.00 1.28 0.00 0.00 41.25 39.78 1wff s ASN 48 CO 0.04 -0.69 0.02 -0.36 -2.04 0.00 0.00 177.10 174.07 1wff s PHE 49 N 3.26 2.35 0.85 1.54 0.08 -1.22 -1.22 117.98 123.61 1wff s PHE 49 Ca 0.48 -0.76 -0.13 0.00 0.12 0.00 0.00 56.93 56.64 1wff s PHE 49 Cb -0.17 -1.62 0.11 0.00 -0.57 0.00 0.00 43.02 40.76 1wff s PHE 49 CO 0.09 0.31 1.20 0.00 -0.10 0.00 0.00 175.22 176.72 1wff h ALA 51 N -1.21 2.14 0.05 0.00 0.00 -1.98 2.05 119.26 120.30 1wff h ALA 51 Ca -0.46 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.21 1wff h ALA 51 Cb 1.32 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1wff h ALA 51 CO 0.61 -0.18 -1.04 1.03 0.00 0.00 0.00 179.25 179.67 1wff h SER 52 N 0.00 0.24 -0.17 0.00 0.87 -1.96 -3.29 113.55 109.24 1wff h SER 52 Ca 0.07 -0.23 -0.05 0.00 -1.23 0.00 0.00 61.79 60.35 1wff h SER 52 Cb 0.28 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 62.14 1wff h SER 52 CO -0.00 1.12 -0.10 1.41 -0.53 0.00 0.00 176.83 178.73 1wff n HIS 53 N -3.53 0.56 0.22 2.24 -0.00 -0.44 -4.63 115.22 109.64 1wff n HIS 53 Ca -0.04 -1.21 0.09 0.00 -0.00 0.00 0.00 57.72 56.56 1wff n HIS 53 Cb 0.92 -0.31 0.47 0.00 -0.00 0.00 0.00 29.99 31.07 1wff n HIS 53 CO 0.00 0.00 0.00 0.07 -0.00 0.00 0.00 176.34 176.41 1wff h ARG 54 N 0.94 0.00 -7.33 -0.41 0.11 0.32 -3.40 114.38 104.62 1wff h ARG 54 Ca 0.06 0.00 -0.51 0.00 0.10 0.00 0.00 59.98 59.63 1wff h ARG 54 Cb 1.31 0.00 0.07 0.00 1.11 0.00 0.00 29.97 32.45 1wff h ARG 54 CO 0.17 0.25 0.40 0.71 0.10 0.00 0.00 179.97 181.60 1wff s TYR 55 N -3.73 3.43 -0.02 4.08 2.02 -1.26 -4.71 117.35 117.15 1wff s TYR 55 Ca -0.00 1.36 -0.22 0.00 -0.37 0.00 0.00 57.07 57.83 1wff s TYR 55 Cb 0.11 -2.79 -0.15 0.00 -0.40 0.00 0.00 41.96 38.73 1wff s TYR 55 CO 0.64 -0.84 1.00 0.00 -1.57 0.00 0.00 175.55 174.78 1wff h ALA 56 N -0.28 -0.41 0.00 3.71 0.00 -1.96 -3.20 119.26 117.12 1wff h ALA 56 Ca -0.44 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.25 1wff h ALA 56 Cb 1.20 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 1wff h ALA 56 CO 0.60 -0.48 -0.13 1.05 0.00 0.00 0.00 179.25 180.29 1wff h GLU 57 N -0.89 0.00 -0.81 0.00 9.09 -1.94 0.39 114.58 120.43 1wff h GLU 57 Ca -0.04 0.00 0.09 0.00 0.05 0.00 0.00 59.36 59.46 1wff h GLU 57 Cb 0.52 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 27.56 1wff h GLU 57 CO 0.07 0.13 0.53 0.00 0.05 0.00 0.00 179.01 179.78 1wff h ALA 58 N 1.87 1.73 -0.52 1.06 0.00 -1.89 -2.24 119.26 119.27 1wff h ALA 58 Ca -0.00 -0.01 -0.37 0.00 0.00 0.00 0.00 54.91 54.53 1wff h ALA 58 Cb 0.24 -0.18 -0.28 0.00 0.00 0.00 0.00 17.79 17.57 1wff h ALA 58 CO 0.02 0.11 -0.61 -2.39 0.00 0.00 0.00 179.25 176.38 1wff n HIS 59 N -4.51 1.88 -4.12 0.00 1.44 -0.87 -4.93 115.22 104.12 1wff n HIS 59 Ca 0.13 -2.01 -0.43 0.00 -2.01 0.00 0.00 57.72 53.41 1wff n HIS 59 Cb 0.31 -0.37 -0.01 0.00 0.12 0.00 0.00 29.99 30.04 1wff n HIS 59 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1wff n GLY 60 N -0.86 -0.67 3.56 -1.39 0.00 -0.84 -4.82 105.19 100.17 1wff n GLY 60 Ca 0.37 0.30 -0.39 0.00 0.00 0.00 0.00 46.02 46.30 1wff n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wff n ASN 62 N 0.01 3.35 -4.72 0.00 2.85 -1.26 -4.94 115.26 110.56 1wff n ASN 62 Ca 0.12 -3.40 -0.30 0.00 -0.11 0.00 0.00 54.58 50.89 1wff n ASN 62 Cb 0.45 -0.40 -0.07 0.00 1.24 0.00 0.00 39.78 40.99 1wff n ASN 62 CO 0.00 0.00 0.00 -0.47 -2.11 0.00 0.00 177.26 174.68 1wff s TYR 63 N -3.29 3.06 -1.09 1.20 6.14 -1.26 -5.03 117.35 117.08 1wff s TYR 63 Ca 0.43 0.01 -0.21 0.00 0.64 0.00 0.00 57.07 57.95 1wff s TYR 63 Cb 0.38 -1.57 0.07 0.00 0.42 0.00 0.00 41.96 41.27 1wff s TYR 63 CO -0.01 0.50 1.48 0.34 0.64 0.00 0.00 175.55 178.49 1wff s ASP 64 N -2.34 6.63 0.20 4.32 -1.08 -1.26 -4.94 116.67 118.20 1wff s ASP 64 Ca 0.27 -1.86 0.00 0.00 -0.52 0.00 0.00 52.55 50.44 1wff s ASP 64 Cb -0.12 -2.54 -0.00 0.00 -1.46 0.00 0.00 42.92 38.80 1wff s ASP 64 CO 0.20 -1.33 0.00 0.00 0.52 0.00 0.00 175.17 174.57 1wff n TYR 65 N 8.29 0.44 -0.83 -5.34 0.18 -1.26 -4.91 117.16 113.73 1wff n TYR 65 Ca 0.36 -1.00 -0.32 0.00 1.88 0.00 0.00 57.90 58.82 1wff n TYR 65 Cb 0.49 -0.12 -0.05 0.00 -0.38 0.00 0.00 39.34 39.28 1wff n TYR 65 CO 0.00 0.00 0.00 1.17 -2.08 0.00 0.00 176.86 175.95 1wff n LYS 66 N -0.49 0.00 -3.15 -3.48 3.00 -1.26 0.36 118.16 113.13 1wff n LYS 66 Ca -0.08 0.00 -0.15 0.00 -0.00 0.00 0.00 58.31 58.08 1wff n LYS 66 Cb 0.25 -0.73 0.06 0.00 0.00 0.00 0.00 35.03 34.62 1wff n LYS 66 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1wff n SER 67 N 1.71 -3.73 -0.12 3.14 2.88 -1.26 -4.96 113.62 111.28 1wff n SER 67 Ca 0.14 -0.41 -0.24 0.00 -1.33 0.00 0.00 58.87 57.04 1wff n SER 67 Cb -0.02 -3.72 -0.11 0.00 -0.75 0.00 0.00 64.21 59.61 1wff n SER 67 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wff n ALA 68 N -3.80 1.26 0.00 -1.46 0.00 0.16 -5.05 120.51 111.62 1wff n ALA 68 Ca -0.09 -1.04 0.00 0.00 0.00 0.00 0.00 53.44 52.31 1wff n ALA 68 Cb 0.58 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1wff n ALA 68 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wff n GLY 69 N 1.74 1.25 3.77 0.00 0.00 -1.26 -4.90 105.19 105.78 1wff n GLY 69 Ca -0.48 -0.41 -0.03 0.00 0.00 0.00 0.00 46.02 45.09 1wff n GLY 69 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1wff s ARG 70 N 0.00 1.21 -0.19 1.61 1.70 -1.26 -5.12 118.95 116.90 1wff s ARG 70 Ca 0.00 -0.68 -0.14 0.00 -0.47 0.00 0.00 55.73 54.44 1wff s ARG 70 Cb 0.00 0.40 -0.04 0.00 -0.57 0.00 0.00 34.95 34.74 1wff s ARG 70 CO 0.00 -0.55 0.32 -0.98 -1.08 0.00 0.00 175.30 173.01 1wff s ARG 71 N -3.16 4.20 -0.24 3.89 1.70 -1.26 -4.97 118.95 119.12 1wff s ARG 71 Ca 0.13 0.10 -0.13 0.00 -0.47 0.00 0.00 55.73 55.37 1wff s ARG 71 Cb -0.01 -3.49 -0.10 0.00 -0.57 0.00 0.00 34.95 30.78 1wff s ARG 71 CO 0.03 0.10 -0.32 0.66 -1.08 0.00 0.00 175.30 174.69 1wff n TYR 72 N 4.03 0.00 -1.49 5.89 4.01 -1.26 -4.95 117.16 123.39 1wff n TYR 72 Ca -0.11 0.00 -0.62 0.00 -0.16 0.00 0.00 57.90 57.01 1wff n TYR 72 Cb 0.52 -0.85 -0.10 0.00 -0.31 0.00 0.00 39.34 38.59 1wff n TYR 72 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1wff n LEU 73 N -4.14 1.18 -4.50 7.72 4.77 -1.26 -4.83 117.00 115.93 1wff n LEU 73 Ca -0.46 0.88 -0.42 0.00 -0.03 0.00 0.00 56.01 55.99 1wff n LEU 73 Cb 0.81 -0.94 -0.03 0.00 -2.33 0.00 0.00 43.42 40.93 1wff n LEU 73 CO 0.04 -0.76 0.98 -0.70 -1.33 0.00 0.00 177.39 175.62 1wff s GLU 74 N 4.69 3.17 -0.30 3.23 2.56 -1.26 -4.93 118.70 125.87 1wff s GLU 74 Ca 1.12 -0.57 -0.09 0.00 0.00 0.00 0.00 54.97 55.42 1wff s GLU 74 Cb -1.41 -4.25 0.15 0.00 2.00 0.00 0.00 34.13 30.62 1wff s GLU 74 CO 0.71 -1.99 0.74 -2.00 -0.56 0.00 0.00 175.26 172.15 1wff s GLU 75 N 4.88 0.49 -0.48 4.30 2.12 -1.26 -5.10 118.70 123.64 1wff s GLU 75 Ca 0.29 1.15 -0.28 0.00 0.36 0.00 0.00 54.97 56.49 1wff s GLU 75 Cb -0.12 0.68 -0.09 0.00 0.26 0.00 0.00 34.13 34.87 1wff s GLU 75 CO 0.12 -0.26 2.39 0.00 -0.54 0.00 0.00 175.26 176.97 1wff n ALA 76 N 5.34 0.95 -1.77 6.30 0.00 -1.26 -4.87 120.51 125.19 1wff n ALA 76 Ca -0.09 -0.64 -0.42 0.00 0.00 0.00 0.00 53.44 52.29 1wff n ALA 76 Cb 0.50 -2.98 -0.03 0.00 0.00 0.00 0.00 19.45 16.95 1wff n ALA 76 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1wff s ASN 77 N 10.61 6.50 -0.96 0.00 -0.87 -1.26 -4.88 114.94 124.07 1wff s ASN 77 Ca 1.04 2.61 -0.24 0.00 -1.57 0.00 0.00 52.86 54.71 1wff s ASN 77 Cb -0.41 -2.55 -0.06 0.00 -0.02 0.00 0.00 41.25 38.22 1wff s ASN 77 CO 0.33 -0.99 1.95 -2.16 -2.57 0.00 0.00 177.10 173.65 1wff s PRO 78 N 3.52 2.54 0.04 -0.60 0.04 -1.26 -4.94 135.00 134.34 1wff s PRO 78 Ca 0.81 -0.48 -0.30 0.00 0.04 0.00 0.00 61.00 61.07 1wff s PRO 78 Cb -0.42 -5.10 -0.08 0.00 0.04 0.00 0.00 34.50 28.94 1wff s PRO 78 CO 0.37 -3.52 1.73 0.54 0.04 0.00 0.00 177.00 176.16 1wff s VAL 79 N 10.32 3.13 -0.17 -0.36 0.11 -1.26 -4.98 120.40 127.18 1wff s VAL 79 Ca 0.70 0.41 -0.21 0.00 -2.93 0.00 0.00 61.98 59.95 1wff s VAL 79 Cb -0.05 -3.27 0.05 0.00 -1.53 0.00 0.00 36.38 31.58 1wff s VAL 79 CO 0.02 -0.02 0.56 -0.94 -3.33 0.00 0.00 175.10 171.39 1wff s SER 80 N 3.07 -0.56 -0.01 3.54 1.04 -1.26 -5.18 113.70 114.34 1wff s SER 80 Ca 0.77 0.97 -0.30 0.00 0.48 0.00 0.00 55.95 57.88 1wff s SER 80 Cb -0.39 0.98 0.11 0.00 0.10 0.00 0.00 66.02 66.82 1wff s SER 80 CO 0.34 -0.28 1.21 -0.83 0.98 0.00 0.00 173.24 174.66 1wff s GLY 81 N -0.08 -0.37 -0.28 7.32 0.00 -1.26 -5.12 107.32 107.53 1wff s GLY 81 Ca -0.03 0.71 -0.29 0.00 0.00 0.00 0.00 44.72 45.12 1wff s GLY 81 CO 0.02 0.16 1.65 2.56 0.00 0.00 0.00 173.10 177.49 1wff s PRO 82 N -2.59 3.62 -0.18 2.90 0.04 -1.26 -4.97 135.00 132.56 1wff s PRO 82 Ca 0.13 1.50 -0.09 0.00 0.04 0.00 0.00 61.00 62.59 1wff s PRO 82 Cb 0.03 -4.08 0.07 0.00 0.04 0.00 0.00 34.50 30.55 1wff s PRO 82 CO -0.03 -1.50 0.42 -1.12 0.04 0.00 0.00 177.00 174.80 1wff s SER 83 N 4.78 -0.45 0.15 6.66 0.01 -1.26 -5.17 113.70 118.43 1wff s SER 83 Ca 0.73 0.93 -0.02 0.00 1.31 0.00 0.00 55.95 58.90 1wff s SER 83 Cb -0.23 0.94 -0.04 0.00 0.21 0.00 0.00 66.02 66.90 1wff s SER 83 CO 0.31 -0.21 0.09 -0.55 0.41 0.00 0.00 173.24 173.30 1wff s SER 84 N 1.74 0.25 0.00 2.44 0.15 -1.26 -5.30 113.70 111.72 1wff s SER 84 Ca -0.07 -1.23 0.00 0.00 0.70 0.00 0.00 55.95 55.34 1wff s SER 84 Cb -0.09 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.55 1wff s SER 84 CO -0.13 -0.77 0.27 0.61 1.20 0.00 0.00 173.24 174.41