#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 -0.12 0.09 1.61 0.15 -1.26 -5.19 113.70 108.99 1wff s SER 2 Ca 0.00 -0.17 -0.27 0.00 0.70 0.00 0.00 55.95 56.21 1wff s SER 2 Cb 0.00 0.25 0.08 0.00 -1.71 0.00 0.00 66.02 64.65 1wff s SER 2 CO 0.00 -0.46 1.06 -0.94 1.20 0.00 0.00 173.24 174.10 1wff s SER 3 N -2.82 -0.15 0.00 5.45 1.04 -1.26 -5.19 113.70 110.78 1wff s SER 3 Ca 0.12 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.24 1wff s SER 3 Cb 0.02 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.53 1wff s SER 3 CO -0.03 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.09 1wff n GLY 4 N -0.47 2.73 3.73 7.32 0.00 -1.26 -5.19 105.19 112.05 1wff n GLY 4 Ca -0.07 -0.63 -0.00 0.00 0.00 0.00 0.00 46.02 45.32 1wff n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wff s SER 5 N 0.00 -0.07 0.31 1.61 0.15 -1.26 -5.19 113.70 109.24 1wff s SER 5 Ca 0.00 -0.28 -0.17 0.00 0.70 0.00 0.00 55.95 56.20 1wff s SER 5 Cb 0.00 0.28 0.06 0.00 -1.71 0.00 0.00 66.02 64.66 1wff s SER 5 CO 0.00 -0.53 0.87 -0.24 1.20 0.00 0.00 173.24 174.54 1wff n SER 6 N -0.64 -2.06 -3.53 5.45 2.88 -1.26 -5.18 113.62 109.28 1wff n SER 6 Ca -0.06 -2.31 0.01 0.00 -1.33 0.00 0.00 58.87 55.18 1wff n SER 6 Cb 0.61 3.40 -0.06 0.00 -0.75 0.00 0.00 64.21 67.42 1wff n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1wff s GLY 7 N -3.19 0.34 -0.02 0.46 0.00 -1.26 -5.17 107.32 98.48 1wff s GLY 7 Ca 0.18 3.57 0.04 0.00 0.00 0.00 0.00 44.72 48.51 1wff s GLY 7 CO 0.09 2.90 -0.13 -0.42 0.00 0.00 0.00 173.10 175.54 1wff s ILE 8 N 1.45 1.02 0.09 0.90 1.01 -1.26 -5.15 121.20 119.26 1wff s ILE 8 Ca -0.06 -0.53 -0.12 0.00 0.00 0.00 0.00 60.65 59.94 1wff s ILE 8 Cb -0.03 -0.87 0.02 0.00 0.01 0.00 0.00 42.46 41.59 1wff s ILE 8 CO -0.13 0.30 0.29 -1.00 0.00 0.00 0.00 174.94 174.40 1wff s HIS 9 N -0.13 -0.03 -0.05 3.97 3.76 -1.26 -5.18 115.29 116.37 1wff s HIS 9 Ca 0.02 -0.28 -0.24 0.00 -0.15 0.00 0.00 55.06 54.41 1wff s HIS 9 Cb -0.07 0.08 0.05 0.00 1.11 0.00 0.00 32.58 33.76 1wff s HIS 9 CO 0.00 -0.58 0.52 -1.58 -0.85 0.00 0.00 174.74 172.25 1wff s HIS 10 N -3.45 -0.46 -0.20 1.40 2.46 -1.26 -5.15 115.29 108.63 1wff s HIS 10 Ca 0.01 0.81 -0.01 0.00 0.47 0.00 0.00 55.06 56.34 1wff s HIS 10 Cb 0.02 0.27 0.06 0.00 -0.13 0.00 0.00 32.58 32.80 1wff s HIS 10 CO -0.09 -0.50 -0.02 -0.51 -2.47 0.00 0.00 174.74 171.15 1wff s LEU 11 N -1.14 1.75 0.23 8.88 1.43 -1.26 -5.12 118.68 123.44 1wff s LEU 11 Ca -0.11 -0.89 -0.30 0.00 -1.03 0.00 0.00 54.13 51.80 1wff s LEU 11 Cb -0.02 -0.87 -0.09 0.00 0.03 0.00 0.00 46.19 45.24 1wff s LEU 11 CO 0.07 -0.25 1.28 -2.16 0.23 0.00 0.00 176.35 175.52 1wff s PRO 12 N 1.65 4.42 0.60 1.29 0.04 -1.26 -5.01 135.00 136.72 1wff s PRO 12 Ca -0.02 2.05 -0.17 0.00 0.04 0.00 0.00 61.00 62.89 1wff s PRO 12 Cb -0.17 -3.17 -0.03 0.00 0.04 0.00 0.00 34.50 31.16 1wff s PRO 12 CO -0.07 -0.18 1.12 -1.25 0.04 0.00 0.00 177.00 176.66 1wff s PRO 13 N -0.56 3.10 -0.02 0.56 0.04 -1.26 -5.06 135.00 131.79 1wff s PRO 13 Ca 0.54 1.51 0.01 0.00 0.04 0.00 0.00 61.00 63.10 1wff s PRO 13 Cb -0.36 -1.98 0.01 0.00 0.04 0.00 0.00 34.50 32.21 1wff s PRO 13 CO 0.41 -1.04 -0.02 0.08 0.04 0.00 0.00 177.00 176.47 1wff s VAL 14 N -2.03 0.28 -0.25 -0.36 1.01 -1.26 -5.14 120.40 112.65 1wff s VAL 14 Ca 0.70 -0.05 -0.29 0.00 0.00 0.00 0.00 61.98 62.35 1wff s VAL 14 Cb -0.22 -0.31 0.17 0.00 0.00 0.00 0.00 36.38 36.02 1wff s VAL 14 CO 0.34 0.13 1.23 -0.75 0.00 0.00 0.00 175.10 176.05 1wff s LYS 15 N 0.53 0.26 -0.20 2.72 2.20 -1.26 -5.17 119.74 118.82 1wff s LYS 15 Ca -0.06 0.11 -0.09 0.00 -0.36 0.00 0.00 55.97 55.57 1wff s LYS 15 Cb -0.09 0.12 0.08 0.00 -1.51 0.00 0.00 37.83 36.44 1wff s LYS 15 CO -0.01 -0.07 0.46 0.00 -0.36 0.00 0.00 175.35 175.37 1wff s ALA 16 N -0.81 -1.25 0.75 3.13 0.00 -1.26 -5.16 121.76 117.15 1wff s ALA 16 Ca 0.05 1.66 -0.12 0.00 0.00 0.00 0.00 51.96 53.55 1wff s ALA 16 Cb -0.02 -1.24 0.04 0.00 0.00 0.00 0.00 23.12 21.91 1wff s ALA 16 CO -0.06 -0.57 1.10 -1.25 0.00 0.00 0.00 175.76 174.98 1wff s PRO 17 N 2.14 2.38 -0.27 0.00 0.04 -1.26 -5.01 135.00 133.02 1wff s PRO 17 Ca -0.05 1.22 -0.12 0.00 0.04 0.00 0.00 61.00 62.08 1wff s PRO 17 Cb -0.10 -1.91 -0.13 0.00 0.04 0.00 0.00 34.50 32.39 1wff s PRO 17 CO -0.14 -1.56 -0.28 1.28 0.04 0.00 0.00 177.00 176.34 1wff n LEU 18 N -3.27 2.10 -4.07 -3.56 7.99 -1.26 -5.00 117.00 109.94 1wff n LEU 18 Ca 0.09 0.28 -0.32 0.00 -0.01 0.00 0.00 56.01 56.05 1wff n LEU 18 Cb 0.53 -0.85 -0.00 0.00 -0.11 0.00 0.00 43.42 42.98 1wff n LEU 18 CO 0.52 0.61 -0.00 0.00 -1.51 0.00 0.00 177.39 177.01 1wff n GLN 19 N -4.12 -4.11 -1.86 3.23 6.02 -1.26 -4.78 117.38 110.50 1wff n GLN 19 Ca -0.52 0.47 -0.21 0.00 -0.01 0.00 0.00 57.00 56.73 1wff n GLN 19 Cb 0.89 -5.18 -0.06 0.00 1.02 0.00 0.00 30.24 26.90 1wff n GLN 19 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1wff s THR 20 N -3.38 3.28 -0.12 5.09 -4.23 -1.26 -4.89 115.64 110.12 1wff s THR 20 Ca 0.61 -0.28 0.00 0.00 -1.18 0.00 0.00 61.69 60.84 1wff s THR 20 Cb -0.32 -3.73 0.02 0.00 1.34 0.00 0.00 72.50 69.81 1wff s THR 20 CO 0.88 -0.57 -0.11 -0.54 -0.54 0.00 0.00 174.62 173.74 1wff s LYS 21 N 7.70 1.91 0.27 3.99 1.02 -1.26 -5.13 119.74 128.24 1wff s LYS 21 Ca 0.78 -0.41 -0.20 0.00 0.02 0.00 0.00 55.97 56.16 1wff s LYS 21 Cb -0.08 -1.82 -0.09 0.00 -0.52 0.00 0.00 37.83 35.32 1wff s LYS 21 CO 0.05 -0.22 0.79 0.15 -0.92 0.00 0.00 175.35 175.19 1wff s LYS 22 N 1.50 4.29 0.16 1.68 3.01 -1.26 -5.07 119.74 124.05 1wff s LYS 22 Ca 0.03 0.96 -0.17 0.00 -1.01 0.00 0.00 55.97 55.78 1wff s LYS 22 Cb -0.13 -2.76 0.03 0.00 -1.01 0.00 0.00 37.83 33.96 1wff s LYS 22 CO -0.08 0.31 0.47 -1.59 0.51 0.00 0.00 175.35 174.97 1wff s LYS 23 N -2.20 1.24 -0.27 1.68 -2.85 -1.26 -5.14 119.74 110.94 1wff s LYS 23 Ca 0.47 -0.78 -0.20 0.00 -1.00 0.00 0.00 55.97 54.46 1wff s LYS 23 Cb -0.16 0.50 -0.02 0.00 -2.06 0.00 0.00 37.83 36.10 1wff s LYS 23 CO 0.21 -0.51 0.60 0.42 0.10 0.00 0.00 175.35 176.17 1wff s ILE 24 N -3.84 4.99 -0.04 3.79 1.01 -1.26 -5.05 121.20 120.80 1wff s ILE 24 Ca 0.06 0.99 0.01 0.00 0.00 0.00 0.00 60.65 61.72 1wff s ILE 24 Cb 0.00 -3.93 0.02 0.00 0.01 0.00 0.00 42.46 38.57 1wff s ILE 24 CO -0.07 -0.01 -0.05 -0.32 0.00 0.00 0.00 174.94 174.49 1wff s MET 25 N 2.49 0.91 0.05 2.79 1.75 -1.26 -5.10 119.30 120.92 1wff s MET 25 Ca 0.25 -0.15 -0.25 0.00 -1.25 0.00 0.00 55.69 54.29 1wff s MET 25 Cb -0.15 -0.88 0.06 0.00 2.84 0.00 0.00 34.83 36.70 1wff s MET 25 CO 0.10 -0.05 0.58 -1.59 -0.65 0.00 0.00 175.02 173.40 1wff s LYS 26 N 0.81 1.10 0.05 4.11 -2.85 -1.26 -5.17 119.74 116.53 1wff s LYS 26 Ca -0.12 -0.16 -0.13 0.00 -1.00 0.00 0.00 55.97 54.57 1wff s LYS 26 Cb -0.14 0.51 0.02 0.00 -2.06 0.00 0.00 37.83 36.15 1wff s LYS 26 CO 0.01 -0.41 0.28 -3.38 0.10 0.00 0.00 175.35 171.95 1wff s HIS 27 N -2.43 -0.06 0.36 1.78 -3.43 -1.26 -3.21 115.29 107.03 1wff s HIS 27 Ca -0.05 -0.11 -0.23 0.00 -0.80 0.00 0.00 55.06 53.87 1wff s HIS 27 Cb -0.01 0.07 -0.16 0.00 -1.43 0.00 0.00 32.58 31.05 1wff s HIS 27 CO -0.01 -0.49 0.23 0.00 -2.00 0.00 0.00 174.74 172.46 1wff n PHE 29 N -0.76 0.54 0.00 0.00 7.35 0.83 -3.05 117.46 122.37 1wff n PHE 29 Ca 0.13 0.16 0.00 0.00 -0.76 0.00 0.00 57.45 56.98 1wff n PHE 29 Cb 0.36 -0.80 0.00 0.00 0.35 0.00 0.00 39.48 39.39 1wff n PHE 29 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1wff n LEU 30 N -2.55 0.05 -0.06 -2.13 7.94 -1.26 -4.65 117.00 114.34 1wff n LEU 30 Ca -0.05 0.62 -0.22 0.00 -1.11 0.00 0.00 56.01 55.25 1wff n LEU 30 Cb 0.63 -0.49 -0.13 0.00 0.53 0.00 0.00 43.42 43.97 1wff n LEU 30 CO 0.43 -0.49 -0.71 0.00 -1.11 0.00 0.00 177.39 175.51 1wff n GLY 32 N 1.69 1.83 3.76 0.00 0.00 -1.17 -5.04 105.19 106.26 1wff n GLY 32 Ca -0.33 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.01 3.49 -0.76 1.61 2.47 -1.26 -4.52 119.74 120.76 1wff s LYS 33 Ca 0.00 2.30 -0.26 0.00 -1.56 0.00 0.00 55.97 56.45 1wff s LYS 33 Cb 0.00 -2.49 0.01 0.00 -1.46 0.00 0.00 37.83 33.89 1wff s LYS 33 CO 0.00 -0.93 1.54 0.15 0.16 0.00 0.00 175.35 176.26 1wff s LYS 34 N -2.63 3.02 -0.25 4.03 -0.14 -1.26 -0.15 119.74 122.36 1wff s LYS 34 Ca 0.65 -0.13 -0.15 0.00 -1.36 0.00 0.00 55.97 54.99 1wff s LYS 34 Cb -0.41 -4.49 -0.04 0.00 -1.68 0.00 0.00 37.83 31.20 1wff s LYS 34 CO 0.51 -2.44 0.36 0.95 -0.76 0.00 0.00 175.35 173.97 1wff s THR 35 N 7.01 5.20 0.00 2.17 -4.23 -1.20 -4.96 115.64 119.63 1wff s THR 35 Ca 0.49 0.57 0.00 0.00 -1.18 0.00 0.00 61.69 61.57 1wff s THR 35 Cb -0.08 -3.69 0.00 0.00 1.34 0.00 0.00 72.50 70.07 1wff s THR 35 CO 0.12 0.20 0.00 0.61 -0.54 0.00 0.00 174.62 175.01 1wff n GLY 36 N 4.43 1.46 0.35 3.99 0.00 -1.26 -4.41 105.19 109.74 1wff n GLY 36 Ca -0.09 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.87 1wff n GLY 36 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wff n LEU 37 N 0.00 1.60 -0.13 0.99 4.32 -1.26 -4.08 117.00 118.44 1wff n LEU 37 Ca 0.00 0.26 -0.12 0.00 -0.02 0.00 0.00 56.01 56.13 1wff n LEU 37 Cb 0.00 -0.61 -0.02 0.00 -1.62 0.00 0.00 43.42 41.17 1wff n LEU 37 CO 0.00 -0.41 0.67 0.00 -1.22 0.00 0.00 177.39 176.43 1wff h ALA 38 N -0.78 0.54 0.00 -1.18 0.00 -2.03 -2.95 119.26 112.87 1wff h ALA 38 Ca 0.00 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 1wff h ALA 38 Cb 0.68 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1wff h ALA 38 CO 0.00 0.47 -0.32 1.15 0.00 0.00 0.00 179.25 180.54 1wff h THR 39 N 0.59 0.97 -3.19 0.00 2.02 -1.94 -3.43 112.91 107.93 1wff h THR 39 Ca 0.09 -1.22 -0.55 0.00 0.77 0.00 0.00 66.41 65.50 1wff h THR 39 Cb 0.71 1.71 -0.02 0.00 -1.74 0.00 0.00 68.15 68.81 1wff h THR 39 CO 0.05 0.32 0.59 -0.94 0.37 0.00 0.00 175.52 175.91 1wff s SER 40 N -6.57 7.15 0.35 4.18 1.04 -1.11 -3.78 113.70 114.95 1wff s SER 40 Ca -0.02 1.78 0.06 0.00 0.48 0.00 0.00 55.95 58.26 1wff s SER 40 Cb 0.13 -2.56 -0.07 0.00 0.10 0.00 0.00 66.02 63.61 1wff s SER 40 CO 0.68 -0.48 -0.01 -0.36 0.98 0.00 0.00 173.24 174.05 1wff s PHE 41 N 1.71 2.24 -0.09 5.02 0.08 -1.24 -4.88 117.98 120.83 1wff s PHE 41 Ca 0.55 -0.72 0.04 0.00 0.12 0.00 0.00 56.93 56.91 1wff s PHE 41 Cb -0.24 -1.45 0.00 0.00 -0.57 0.00 0.00 43.02 40.76 1wff s PHE 41 CO 0.24 0.32 -0.21 -2.00 -0.10 0.00 0.00 175.22 173.47 1wff s GLU 42 N -3.74 2.68 0.30 0.44 2.12 -1.26 -3.97 118.70 115.27 1wff s GLU 42 Ca 0.34 -0.76 0.06 0.00 0.36 0.00 0.00 54.97 54.97 1wff s GLU 42 Cb 0.07 -2.06 -0.02 0.00 0.26 0.00 0.00 34.13 32.38 1wff s GLU 42 CO 0.16 0.15 0.41 0.00 -0.54 0.00 0.00 175.26 175.44 1wff h ARG 44 N 1.04 0.38 -0.02 0.00 3.08 -1.94 0.20 114.38 117.12 1wff h ARG 44 Ca -0.48 -0.02 -0.21 0.00 0.07 0.00 0.00 59.98 59.34 1wff h ARG 44 Cb 1.25 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.21 1wff h ARG 44 CO 0.56 0.25 -0.89 0.00 -1.07 0.00 0.00 179.97 178.82 1wff n GLY 46 N 0.85 2.46 3.54 0.00 0.00 0.71 -5.05 105.19 107.70 1wff n GLY 46 Ca -0.06 -0.84 -0.46 0.00 0.00 0.00 0.00 46.02 44.66 1wff n GLY 46 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1wff n ASN 47 N 0.00 0.71 -4.70 1.61 3.02 -1.26 -4.36 115.26 110.27 1wff n ASN 47 Ca 0.00 1.16 -0.38 0.00 -0.03 0.00 0.00 54.58 55.33 1wff n ASN 47 Cb 0.00 -1.20 -0.06 0.00 -0.61 0.00 0.00 39.78 37.91 1wff n ASN 47 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1wff s ASN 48 N -0.59 6.65 0.38 6.41 2.47 -1.26 -3.63 114.94 125.36 1wff s ASN 48 Ca 0.62 0.77 0.04 0.00 0.42 0.00 0.00 52.86 54.71 1wff s ASN 48 Cb -0.78 -2.29 -0.05 0.00 -1.45 0.00 0.00 41.25 36.68 1wff s ASN 48 CO 0.58 -0.05 0.06 -0.36 -3.72 0.00 0.00 177.10 173.61 1wff s PHE 49 N 0.93 1.99 0.77 0.43 0.08 -1.25 -0.12 117.98 120.81 1wff s PHE 49 Ca 0.25 -0.99 -0.10 0.00 0.12 0.00 0.00 56.93 56.21 1wff s PHE 49 Cb -0.15 -1.36 0.07 0.00 -0.57 0.00 0.00 43.02 41.01 1wff s PHE 49 CO 0.10 0.02 1.12 0.00 -0.10 0.00 0.00 175.22 176.37 1wff h ALA 51 N -0.89 1.71 0.06 0.00 0.00 -1.96 1.87 119.26 120.06 1wff h ALA 51 Ca -0.45 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.17 1wff h ALA 51 Cb 1.32 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 1wff h ALA 51 CO 0.64 -0.31 -1.48 1.03 0.00 0.00 0.00 179.25 179.13 1wff h SER 52 N 0.00 0.21 -0.24 0.00 0.87 -1.93 -3.34 113.55 109.11 1wff h SER 52 Ca 0.08 -0.30 -0.03 0.00 -1.23 0.00 0.00 61.79 60.31 1wff h SER 52 Cb 0.53 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 1wff h SER 52 CO -0.00 1.26 -0.01 1.41 -0.53 0.00 0.00 176.83 178.96 1wff n HIS 53 N -3.33 0.85 0.20 2.24 -0.00 -0.02 -4.60 115.22 110.56 1wff n HIS 53 Ca -0.14 -0.99 0.04 0.00 -0.00 0.00 0.00 57.72 56.63 1wff n HIS 53 Cb 1.02 -0.32 0.41 0.00 -0.00 0.00 0.00 29.99 31.10 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 1.46 0.00 -7.01 -0.41 0.11 0.27 -3.40 114.38 105.39 1wff h ARG 54 Ca 0.03 0.00 -0.47 0.00 0.10 0.00 0.00 59.98 59.64 1wff h ARG 54 Cb 1.42 0.00 0.02 0.00 1.11 0.00 0.00 29.97 32.52 1wff h ARG 54 CO 0.22 0.34 0.39 0.71 0.10 0.00 0.00 179.97 181.73 1wff s TYR 55 N -4.11 3.17 0.07 4.08 1.51 -1.26 -4.68 117.35 116.12 1wff s TYR 55 Ca -0.02 1.62 -0.33 0.00 -1.01 0.00 0.00 57.07 57.32 1wff s TYR 55 Cb 0.14 -3.08 -0.18 0.00 -0.11 0.00 0.00 41.96 38.73 1wff s TYR 55 CO 0.70 -0.66 1.62 0.00 -1.11 0.00 0.00 175.55 176.10 1wff h ALA 56 N 2.09 -0.92 -0.92 3.71 0.00 -1.96 -2.60 119.26 118.65 1wff h ALA 56 Ca -0.49 -0.19 0.18 0.00 0.00 0.00 0.00 54.91 54.41 1wff h ALA 56 Cb 1.21 0.41 -0.08 0.00 0.00 0.00 0.00 17.79 19.34 1wff h ALA 56 CO 0.61 -1.03 0.59 1.05 0.00 0.00 0.00 179.25 180.48 1wff h GLU 57 N -0.92 0.56 -0.95 0.00 4.11 -1.93 0.76 114.58 116.22 1wff h GLU 57 Ca -0.08 -0.03 0.19 0.00 0.07 0.00 0.00 59.36 59.50 1wff h GLU 57 Cb 0.72 -0.13 -0.11 0.00 0.50 0.00 0.00 28.75 29.74 1wff h GLU 57 CO 0.11 0.37 0.54 0.00 0.07 0.00 0.00 179.01 180.10 1wff h ALA 58 N 1.61 1.54 -0.42 1.06 0.00 -1.79 -1.14 119.26 120.12 1wff h ALA 58 Ca 0.49 0.09 -0.28 0.00 0.00 0.00 0.00 54.91 55.21 1wff h ALA 58 Cb 0.96 -0.03 -0.19 0.00 0.00 0.00 0.00 17.79 18.52 1wff h ALA 58 CO -0.23 -0.11 -0.38 -2.39 0.00 0.00 0.00 179.25 176.14 1wff n HIS 59 N -4.84 1.46 -4.13 0.00 1.44 -0.10 -4.98 115.22 104.08 1wff n HIS 59 Ca 0.22 -1.88 -0.41 0.00 -2.01 0.00 0.00 57.72 53.63 1wff n HIS 59 Cb 0.56 -0.44 -0.01 0.00 0.12 0.00 0.00 29.99 30.21 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 -0.97 -0.60 3.10 -1.39 0.00 -0.43 -4.82 105.19 100.07 1wff n GLY 60 Ca 0.35 0.28 -0.36 0.00 0.00 0.00 0.00 46.02 46.29 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 2.26 2.69 -4.54 0.00 6.94 -1.26 -4.98 115.26 116.38 1wff n ASN 62 Ca -0.00 -0.01 -0.58 0.00 -0.02 0.00 0.00 54.58 53.96 1wff n ASN 62 Cb 0.59 -0.19 -0.09 0.00 -2.36 0.00 0.00 39.78 37.74 1wff n ASN 62 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1wff n TYR 63 N -2.94 1.67 -1.88 -2.53 4.19 -1.26 -4.81 117.16 109.61 1wff n TYR 63 Ca -0.18 0.63 -0.43 0.00 3.31 0.00 0.00 57.90 61.23 1wff n TYR 63 Cb 0.68 -2.40 -0.03 0.00 0.49 0.00 0.00 39.34 38.08 1wff n TYR 63 CO 0.00 0.00 0.00 0.34 0.91 0.00 0.00 176.86 178.11 1wff s ASP 64 N 5.02 6.19 -0.91 2.98 -1.08 -1.26 -4.91 116.67 122.69 1wff s ASP 64 Ca 1.08 1.97 -0.00 0.00 -0.52 0.00 0.00 52.55 55.08 1wff s ASP 64 Cb -1.20 -2.53 0.30 0.00 -1.46 0.00 0.00 42.92 38.04 1wff s ASP 64 CO 0.64 -1.36 1.33 0.00 0.52 0.00 0.00 175.17 176.30 1wff n TYR 65 N 8.94 2.87 -1.84 -5.34 0.18 -1.26 -5.05 117.16 115.67 1wff n TYR 65 Ca 0.22 -3.10 -0.34 0.00 1.88 0.00 0.00 57.90 56.56 1wff n TYR 65 Cb 0.44 -0.99 0.04 0.00 -0.38 0.00 0.00 39.34 38.45 1wff n TYR 65 CO 0.00 0.00 0.00 -1.59 -2.08 0.00 0.00 176.86 173.19 1wff s LYS 66 N -3.13 2.87 -0.63 -3.48 0.00 -1.26 -2.97 119.74 111.14 1wff s LYS 66 Ca 0.37 1.47 0.00 0.00 0.00 0.00 0.00 55.97 57.80 1wff s LYS 66 Cb 0.13 -1.95 0.00 0.00 0.00 0.00 0.00 37.83 36.00 1wff s LYS 66 CO 0.00 -1.21 0.00 0.45 0.00 0.00 0.00 175.35 174.59 1wff n SER 67 N -2.20 -2.64 -0.04 0.03 2.88 -1.26 -4.73 113.62 105.65 1wff n SER 67 Ca 0.11 0.31 -0.08 0.00 -1.33 0.00 0.00 58.87 57.88 1wff n SER 67 Cb 0.52 -2.33 -0.03 0.00 -0.75 0.00 0.00 64.21 61.61 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 -2.18 2.42 0.00 -1.46 0.00 -1.16 -5.10 120.51 113.04 1wff n ALA 68 Ca -0.08 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.04 1wff n ALA 68 Cb 0.54 0.39 0.00 0.00 0.00 0.00 0.00 19.45 20.38 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 2.57 1.40 0.08 0.00 0.00 -1.25 -5.05 105.19 102.93 1wff n GLY 69 Ca -0.15 0.44 -0.13 0.00 0.00 0.00 0.00 46.02 46.18 1wff n GLY 69 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1wff h ARG 70 N 0.00 0.10 -3.47 1.61 0.11 -1.99 -3.46 114.38 107.28 1wff h ARG 70 Ca 0.00 -0.04 -0.17 0.00 0.10 0.00 0.00 59.98 59.87 1wff h ARG 70 Cb 0.00 -0.00 -0.24 0.00 1.11 0.00 0.00 29.97 30.84 1wff h ARG 70 CO 0.00 0.50 -0.53 -0.98 0.10 0.00 0.00 179.97 179.06 1wff s ARG 71 N -4.50 0.31 -0.18 0.08 1.70 -1.26 -5.07 118.95 110.04 1wff s ARG 71 Ca -0.15 -0.10 -0.20 0.00 -0.47 0.00 0.00 55.73 54.80 1wff s ARG 71 Cb 0.03 0.14 -0.21 0.00 -0.57 0.00 0.00 34.95 34.33 1wff s ARG 71 CO 0.69 -0.06 0.32 -0.92 -1.08 0.00 0.00 175.30 174.25 1wff h TYR 72 N 5.14 0.09 -3.19 5.89 3.20 -2.02 -3.50 116.97 122.58 1wff h TYR 72 Ca -0.28 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.52 1wff h TYR 72 Cb 1.20 -0.00 -0.05 0.00 1.54 0.00 0.00 36.73 39.42 1wff h TYR 72 CO 0.50 1.48 0.15 -0.48 -1.64 0.00 0.00 178.16 178.17 1wff s LEU 73 N -7.79 0.00 0.36 2.82 2.34 -1.26 -5.16 118.68 109.98 1wff s LEU 73 Ca -0.26 -0.87 -0.17 0.00 0.06 0.00 0.00 54.13 52.89 1wff s LEU 73 Cb 0.05 2.50 -0.10 0.00 -0.56 0.00 0.00 46.19 48.08 1wff s LEU 73 CO 0.64 -1.40 0.81 -0.70 -1.06 0.00 0.00 176.35 174.64 1wff s GLU 74 N -3.45 4.09 0.29 1.48 2.12 -1.26 -5.09 118.70 116.88 1wff s GLU 74 Ca 0.16 0.84 0.04 0.00 0.36 0.00 0.00 54.97 56.36 1wff s GLU 74 Cb -0.04 -2.35 -0.06 0.00 0.26 0.00 0.00 34.13 31.94 1wff s GLU 74 CO 0.09 0.09 0.04 -1.21 -0.54 0.00 0.00 175.26 173.73 1wff s GLU 75 N -3.04 1.53 -0.11 4.30 0.41 -1.26 -5.16 118.70 115.38 1wff s GLU 75 Ca 0.57 -1.82 -0.05 0.00 -0.41 0.00 0.00 54.97 53.26 1wff s GLU 75 Cb -0.10 -0.75 0.05 0.00 -1.78 0.00 0.00 34.13 31.55 1wff s GLU 75 CO 0.16 -0.16 0.24 0.00 -0.49 0.00 0.00 175.26 175.01 1wff s ALA 76 N -3.36 -0.49 0.16 5.21 0.00 -1.26 -5.15 121.76 116.86 1wff s ALA 76 Ca 0.34 0.91 -0.24 0.00 0.00 0.00 0.00 51.96 52.97 1wff s ALA 76 Cb 0.07 -0.78 -0.08 0.00 0.00 0.00 0.00 23.12 22.33 1wff s ALA 76 CO 0.13 -0.40 0.73 1.21 0.00 0.00 0.00 175.76 177.44 1wff s ASN 77 N 1.79 7.30 1.20 0.00 3.84 -1.26 -5.07 114.94 122.74 1wff s ASN 77 Ca -0.04 1.55 -0.19 0.00 0.21 0.00 0.00 52.86 54.39 1wff s ASN 77 Cb -0.11 -2.47 0.29 0.00 -0.55 0.00 0.00 41.25 38.41 1wff s ASN 77 CO -0.08 0.20 1.11 -2.16 -2.79 0.00 0.00 177.10 173.38 1wff s PRO 78 N -1.23 -1.20 0.02 0.43 0.04 -1.26 -5.07 135.00 126.73 1wff s PRO 78 Ca 0.35 -0.06 0.08 0.00 0.04 0.00 0.00 61.00 61.41 1wff s PRO 78 Cb -0.22 -1.60 -0.03 0.00 0.04 0.00 0.00 34.50 32.70 1wff s PRO 78 CO 0.24 -3.70 -0.22 0.54 0.04 0.00 0.00 177.00 173.90 1wff s VAL 79 N -3.00 2.48 0.17 -0.36 0.11 -1.26 -5.14 120.40 113.40 1wff s VAL 79 Ca 0.71 -1.20 -0.01 0.00 -2.93 0.00 0.00 61.98 58.55 1wff s VAL 79 Cb -0.10 -1.98 -0.04 0.00 -1.53 0.00 0.00 36.38 32.73 1wff s VAL 79 CO 0.56 0.41 0.35 -0.55 -3.33 0.00 0.00 175.10 172.54 1wff s SER 80 N -1.17 6.39 -0.08 3.54 0.15 -1.26 -5.11 113.70 116.16 1wff s SER 80 Ca 0.13 0.38 0.03 0.00 0.70 0.00 0.00 55.95 57.19 1wff s SER 80 Cb -0.10 -2.00 0.00 0.00 -1.71 0.00 0.00 66.02 62.21 1wff s SER 80 CO 0.03 0.01 -0.19 -0.83 1.20 0.00 0.00 173.24 173.45 1wff s GLY 81 N -3.01 1.09 0.00 9.45 0.00 -1.26 -5.14 107.32 108.45 1wff s GLY 81 Ca 0.38 -0.74 0.00 0.00 0.00 0.00 0.00 44.72 44.36 1wff s GLY 81 CO 0.28 -0.17 0.00 -1.55 0.00 0.00 0.00 173.10 171.66 1wff n PRO 82 N 3.59 -0.80 -3.64 2.90 -0.04 -1.26 -5.11 135.00 130.64 1wff n PRO 82 Ca -0.20 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.17 1wff n PRO 82 Cb 0.52 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.91 1wff n PRO 82 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wff s SER 83 N -1.52 -0.44 -0.15 3.54 0.15 -1.26 -5.18 113.70 108.84 1wff s SER 83 Ca 0.00 0.84 -0.32 0.00 0.70 0.00 0.00 55.95 57.17 1wff s SER 83 Cb 0.00 0.87 0.13 0.00 -1.71 0.00 0.00 66.02 65.31 1wff s SER 83 CO 0.00 -0.14 1.11 -0.94 1.20 0.00 0.00 173.24 174.47 1wff s SER 84 N 0.28 -0.22 0.00 5.45 1.04 -1.26 -5.38 113.70 113.61 1wff s SER 84 Ca 0.03 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.54 1wff s SER 84 Cb -0.05 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.29 1wff s SER 84 CO -0.07 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.44