#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 0.14 1.61 1.04 -1.26 -5.19 113.70 109.92 1wff s SER 2 Ca 0.00 -0.62 -0.24 0.00 0.48 0.00 0.00 55.95 55.57 1wff s SER 2 Cb 0.00 0.59 0.08 0.00 0.10 0.00 0.00 66.02 66.79 1wff s SER 2 CO 0.00 -1.13 1.06 -0.55 0.98 0.00 0.00 173.24 173.60 1wff s SER 3 N -3.07 -0.05 0.08 7.02 0.15 -1.26 -5.19 113.70 111.37 1wff s SER 3 Ca 0.15 -0.51 -0.27 0.00 0.70 0.00 0.00 55.95 56.02 1wff s SER 3 Cb -0.03 0.44 0.08 0.00 -1.71 0.00 0.00 66.02 64.80 1wff s SER 3 CO 0.05 -0.85 0.93 -0.83 1.20 0.00 0.00 173.24 173.74 1wff s GLY 4 N -3.25 -0.35 0.23 9.45 0.00 -1.26 -5.19 107.32 106.95 1wff s GLY 4 Ca 0.19 0.56 -0.21 0.00 0.00 0.00 0.00 44.72 45.25 1wff s GLY 4 CO 0.03 0.16 0.94 -1.35 0.00 0.00 0.00 173.10 172.88 1wff s SER 5 N -2.72 -0.07 0.23 1.64 1.04 -1.26 -5.19 113.70 107.36 1wff s SER 5 Ca 0.09 -0.70 -0.21 0.00 0.48 0.00 0.00 55.95 55.61 1wff s SER 5 Cb -0.01 0.59 0.07 0.00 0.10 0.00 0.00 66.02 66.77 1wff s SER 5 CO -0.03 -1.15 0.98 -0.55 0.98 0.00 0.00 173.24 173.46 1wff s SER 6 N -3.16 -0.01 -0.30 7.02 0.15 -1.26 -5.17 113.70 110.97 1wff s SER 6 Ca 0.17 -0.76 -0.14 0.00 0.70 0.00 0.00 55.95 55.91 1wff s SER 6 Cb -0.03 0.58 0.16 0.00 -1.71 0.00 0.00 66.02 65.02 1wff s SER 6 CO 0.06 -1.15 0.93 -0.83 1.20 0.00 0.00 173.24 173.45 1wff s GLY 7 N -3.29 -0.26 -0.04 9.45 0.00 -1.26 -5.16 107.32 106.75 1wff s GLY 7 Ca 0.20 2.93 -0.08 0.00 0.00 0.00 0.00 44.72 47.77 1wff s GLY 7 CO 0.06 3.12 0.25 -1.50 0.00 0.00 0.00 173.10 175.04 1wff s ILE 8 N 2.38 5.32 0.15 0.90 1.10 -1.26 -5.10 121.20 124.68 1wff s ILE 8 Ca -0.04 0.32 0.06 0.00 -0.51 0.00 0.00 60.65 60.48 1wff s ILE 8 Cb -0.07 -3.54 -0.04 0.00 0.15 0.00 0.00 42.46 38.96 1wff s ILE 8 CO -0.17 0.49 -0.14 -1.38 -2.11 0.00 0.00 174.94 171.63 1wff s HIS 9 N -1.16 1.50 0.11 3.50 -3.43 -1.26 -5.16 115.29 109.38 1wff s HIS 9 Ca 0.22 -0.58 -0.13 0.00 -0.80 0.00 0.00 55.06 53.77 1wff s HIS 9 Cb -0.13 -0.75 0.02 0.00 -1.43 0.00 0.00 32.58 30.28 1wff s HIS 9 CO 0.11 0.20 0.32 -3.38 -2.00 0.00 0.00 174.74 170.00 1wff s HIS 10 N -2.50 -0.08 -0.12 0.38 -3.43 -1.26 -5.16 115.29 103.13 1wff s HIS 10 Ca 0.14 -0.27 -0.04 0.00 -0.80 0.00 0.00 55.06 54.09 1wff s HIS 10 Cb -0.03 0.14 0.06 0.00 -1.43 0.00 0.00 32.58 31.32 1wff s HIS 10 CO 0.04 -0.63 0.23 -0.51 -2.00 0.00 0.00 174.74 171.87 1wff s LEU 11 N -2.77 -0.24 0.06 5.38 1.43 -1.26 -5.14 118.68 116.14 1wff s LEU 11 Ca 0.03 0.52 -0.31 0.00 -1.03 0.00 0.00 54.13 53.35 1wff s LEU 11 Cb 0.03 0.58 -0.07 0.00 0.03 0.00 0.00 46.19 46.76 1wff s LEU 11 CO -0.11 -0.24 1.40 -2.16 0.23 0.00 0.00 176.35 175.47 1wff s PRO 12 N 2.39 4.30 1.15 1.29 0.04 -1.26 -5.02 135.00 137.89 1wff s PRO 12 Ca 0.02 2.03 -0.18 0.00 0.04 0.00 0.00 61.00 62.91 1wff s PRO 12 Cb -0.12 -3.42 0.26 0.00 0.04 0.00 0.00 34.50 31.26 1wff s PRO 12 CO -0.08 -0.51 1.11 -1.25 0.04 0.00 0.00 177.00 176.31 1wff s PRO 13 N 1.78 -0.84 -0.02 0.56 0.04 -1.26 -5.09 135.00 130.16 1wff s PRO 13 Ca 0.65 0.07 -0.24 0.00 0.04 0.00 0.00 61.00 61.51 1wff s PRO 13 Cb -0.34 -1.63 0.05 0.00 0.04 0.00 0.00 34.50 32.62 1wff s PRO 13 CO 0.29 -3.49 0.54 0.54 0.04 0.00 0.00 177.00 174.92 1wff s VAL 14 N -3.00 0.02 -0.05 -0.36 0.11 -1.26 -5.18 120.40 110.69 1wff s VAL 14 Ca 0.70 -0.20 -0.24 0.00 -2.93 0.00 0.00 61.98 59.31 1wff s VAL 14 Cb -0.12 -0.88 0.05 0.00 -1.53 0.00 0.00 36.38 33.90 1wff s VAL 14 CO 0.56 -0.11 0.54 -0.75 -3.33 0.00 0.00 175.10 172.01 1wff s LYS 15 N -1.51 0.89 -0.00 1.54 2.47 -1.26 -5.18 119.74 116.69 1wff s LYS 15 Ca -0.10 0.13 -0.15 0.00 -1.56 0.00 0.00 55.97 54.29 1wff s LYS 15 Cb -0.02 0.41 0.02 0.00 -1.46 0.00 0.00 37.83 36.79 1wff s LYS 15 CO 0.06 -0.26 0.32 0.00 0.16 0.00 0.00 175.35 175.63 1wff s ALA 16 N -1.14 -0.80 0.36 3.13 0.00 -1.26 -5.15 121.76 116.90 1wff s ALA 16 Ca -0.11 0.29 -0.27 0.00 0.00 0.00 0.00 51.96 51.87 1wff s ALA 16 Cb -0.02 0.13 -0.09 0.00 0.00 0.00 0.00 23.12 23.13 1wff s ALA 16 CO 0.07 -0.30 1.21 -1.25 0.00 0.00 0.00 175.76 175.49 1wff s PRO 17 N -1.59 4.25 -0.27 0.00 0.04 -1.26 -5.02 135.00 131.15 1wff s PRO 17 Ca -0.12 1.97 -0.11 0.00 0.04 0.00 0.00 61.00 62.79 1wff s PRO 17 Cb -0.04 -2.90 -0.05 0.00 0.04 0.00 0.00 34.50 31.55 1wff s PRO 17 CO 0.03 -0.19 0.18 -0.51 0.04 0.00 0.00 177.00 176.54 1wff s LEU 18 N -2.08 4.03 -0.00 -3.56 1.02 -1.26 -5.08 118.68 111.75 1wff s LEU 18 Ca 0.52 0.02 0.03 0.00 0.02 0.00 0.00 54.13 54.72 1wff s LEU 18 Cb -0.34 -2.11 -0.01 0.00 0.02 0.00 0.00 46.19 43.75 1wff s LEU 18 CO 0.44 -0.02 -0.09 0.00 0.02 0.00 0.00 176.35 176.70 1wff s GLN 19 N 1.56 0.73 -0.25 1.70 -2.07 -1.26 -5.13 119.66 114.94 1wff s GLN 19 Ca 0.07 -0.35 -0.02 0.00 -1.82 0.00 0.00 55.36 53.24 1wff s GLN 19 Cb -0.15 -0.70 0.14 0.00 -1.09 0.00 0.00 33.01 31.20 1wff s GLN 19 CO 0.09 0.19 0.38 0.99 -1.32 0.00 0.00 175.29 175.63 1wff s THR 20 N -0.28 -0.61 0.03 3.63 2.01 -1.26 -5.15 115.64 114.02 1wff s THR 20 Ca 0.03 -0.13 -0.29 0.00 0.31 0.00 0.00 61.69 61.62 1wff s THR 20 Cb -0.04 -0.86 0.10 0.00 0.01 0.00 0.00 72.50 71.72 1wff s THR 20 CO -0.00 -0.16 1.20 -1.59 -0.69 0.00 0.00 174.62 173.37 1wff s LYS 21 N 2.54 0.62 -0.19 4.92 0.00 -1.26 -5.15 119.74 121.23 1wff s LYS 21 Ca 0.12 -0.35 -0.16 0.00 0.00 0.00 0.00 55.97 55.58 1wff s LYS 21 Cb -0.15 0.21 -0.04 0.00 0.00 0.00 0.00 37.83 37.85 1wff s LYS 21 CO -0.19 -0.28 0.39 0.15 0.00 0.00 0.00 175.35 175.41 1wff s LYS 22 N -2.59 4.20 -0.48 1.78 1.02 -1.26 -5.04 119.74 117.37 1wff s LYS 22 Ca 0.15 0.20 0.04 0.00 0.02 0.00 0.00 55.97 56.37 1wff s LYS 22 Cb 0.03 -3.51 0.12 0.00 -0.52 0.00 0.00 37.83 33.95 1wff s LYS 22 CO -0.02 0.02 0.22 -1.59 -0.92 0.00 0.00 175.35 173.06 1wff s LYS 23 N 1.13 1.88 -0.15 1.68 -2.85 -1.26 -5.08 119.74 115.10 1wff s LYS 23 Ca 0.19 -2.43 -0.40 0.00 -1.00 0.00 0.00 55.97 52.33 1wff s LYS 23 Cb -0.14 -3.32 -0.19 0.00 -2.06 0.00 0.00 37.83 32.12 1wff s LYS 23 CO 0.07 -1.07 1.17 -0.89 0.10 0.00 0.00 175.35 174.73 1wff n ILE 24 N 3.42 0.00 -2.80 3.79 2.08 -1.26 -4.81 119.36 119.78 1wff n ILE 24 Ca 0.05 0.00 -0.44 0.00 0.56 0.00 0.00 62.75 62.92 1wff n ILE 24 Cb 0.35 -0.15 0.00 0.00 -0.75 0.00 0.00 39.64 39.09 1wff n ILE 24 CO 0.00 0.00 0.00 0.23 0.56 0.00 0.00 176.55 177.34 1wff n MET 25 N 2.15 3.37 -3.67 0.38 2.81 -1.26 -4.91 117.12 116.00 1wff n MET 25 Ca 0.22 -3.72 -0.13 0.00 -1.81 0.00 0.00 57.70 52.26 1wff n MET 25 Cb 0.03 -3.08 -0.08 0.00 -0.71 0.00 0.00 33.22 29.38 1wff n MET 25 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1wff s LYS 26 N 1.74 0.69 -0.29 0.03 1.02 -1.26 -5.16 119.74 116.52 1wff s LYS 26 Ca 0.44 0.85 -0.25 0.00 0.02 0.00 0.00 55.97 57.03 1wff s LYS 26 Cb -0.00 0.32 0.15 0.00 -0.52 0.00 0.00 37.83 37.78 1wff s LYS 26 CO 0.01 -0.09 1.18 -3.38 -0.92 0.00 0.00 175.35 172.15 1wff s HIS 27 N 0.42 -0.32 0.32 3.18 -3.43 -1.26 -3.38 115.29 110.81 1wff s HIS 27 Ca -0.01 0.79 -0.19 0.00 -0.80 0.00 0.00 55.06 54.85 1wff s HIS 27 Cb -0.04 0.41 -0.14 0.00 -1.43 0.00 0.00 32.58 31.38 1wff s HIS 27 CO -0.01 -0.16 0.13 0.00 -2.00 0.00 0.00 174.74 172.71 1wff n PHE 29 N -0.74 0.49 0.03 0.00 7.35 -0.44 -2.98 117.46 121.18 1wff n PHE 29 Ca 0.11 0.16 -0.02 0.00 -0.76 0.00 0.00 57.45 56.94 1wff n PHE 29 Cb 0.32 -0.90 -0.01 0.00 0.35 0.00 0.00 39.48 39.25 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 -0.09 0.02 -2.13 5.85 -1.90 -3.41 115.31 113.65 1wff h LEU 30 Ca -0.19 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.32 1wff h LEU 30 Cb 1.52 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.55 1wff h LEU 30 CO 0.03 0.02 -1.13 0.00 -0.34 0.00 0.00 178.44 177.02 1wff n GLY 32 N 1.54 1.76 3.80 0.00 0.00 -1.16 -5.04 105.19 106.08 1wff n GLY 32 Ca -0.28 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.39 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 -0.13 4.23 -0.02 1.61 2.20 -1.26 -4.64 119.74 121.73 1wff s LYS 33 Ca 0.00 1.32 -0.30 0.00 -0.36 0.00 0.00 55.97 56.63 1wff s LYS 33 Cb 0.00 -2.42 -0.05 0.00 -1.51 0.00 0.00 37.83 33.85 1wff s LYS 33 CO 0.00 -0.05 1.47 -1.59 -0.36 0.00 0.00 175.35 174.82 1wff s LYS 34 N -2.73 4.25 -0.27 4.03 -2.85 -1.26 -0.19 119.74 120.71 1wff s LYS 34 Ca 0.59 2.02 -0.00 0.00 -1.00 0.00 0.00 55.97 57.58 1wff s LYS 34 Cb -0.16 -3.67 0.05 0.00 -2.06 0.00 0.00 37.83 31.98 1wff s LYS 34 CO 0.21 -0.66 -0.06 0.95 0.10 0.00 0.00 175.35 175.89 1wff s THR 35 N 2.85 2.69 0.00 3.79 -4.23 -1.22 -4.89 115.64 114.63 1wff s THR 35 Ca 0.66 -1.35 0.00 0.00 -1.18 0.00 0.00 61.69 59.82 1wff s THR 35 Cb -0.32 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.03 1wff s THR 35 CO 0.27 0.02 0.00 0.61 -0.54 0.00 0.00 174.62 174.97 1wff n GLY 36 N 4.58 -1.58 0.08 3.99 0.00 -1.26 -4.49 105.19 106.52 1wff n GLY 36 Ca -0.15 -0.25 -0.10 0.00 0.00 0.00 0.00 46.02 45.53 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 1.83 0.02 0.99 0.00 -1.26 -4.06 117.00 114.52 1wff n LEU 37 Ca 0.00 0.57 -0.01 0.00 0.00 0.00 0.00 56.01 56.57 1wff n LEU 37 Cb 0.00 -0.90 -0.01 0.00 0.00 0.00 0.00 43.42 42.52 1wff n LEU 37 CO 0.00 -0.25 0.26 0.00 0.00 0.00 0.00 177.39 177.40 1wff h ALA 38 N -0.86 -0.54 -0.73 1.96 0.00 -2.03 -3.28 119.26 113.78 1wff h ALA 38 Ca -0.11 -0.02 0.23 0.00 0.00 0.00 0.00 54.91 55.02 1wff h ALA 38 Cb 0.75 0.03 -0.13 0.00 0.00 0.00 0.00 17.79 18.43 1wff h ALA 38 CO -0.06 -0.53 0.12 2.41 0.00 0.00 0.00 179.25 181.18 1wff n THR 39 N -2.32 -0.31 -1.89 0.00 -1.04 -1.26 -4.07 114.28 103.40 1wff n THR 39 Ca -0.01 1.57 -0.43 0.00 -2.04 0.00 0.00 64.05 63.15 1wff n THR 39 Cb 0.03 -2.36 -0.03 0.00 -1.82 0.00 0.00 70.33 66.15 1wff n THR 39 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1wff s SER 40 N -4.91 6.14 0.34 8.00 1.04 -1.24 -3.53 113.70 119.54 1wff s SER 40 Ca -0.09 1.90 0.09 0.00 0.48 0.00 0.00 55.95 58.34 1wff s SER 40 Cb 0.22 -2.53 -0.05 0.00 0.10 0.00 0.00 66.02 63.76 1wff s SER 40 CO 0.57 -1.41 -0.01 -0.36 0.98 0.00 0.00 173.24 173.01 1wff s PHE 41 N 5.89 2.53 -0.13 5.02 0.08 -1.18 -4.91 117.98 125.28 1wff s PHE 41 Ca 0.83 -0.43 0.01 0.00 0.12 0.00 0.00 56.93 57.45 1wff s PHE 41 Cb -0.31 -1.45 -0.01 0.00 -0.57 0.00 0.00 43.02 40.68 1wff s PHE 41 CO 0.34 0.50 -0.15 -2.00 -0.10 0.00 0.00 175.22 173.80 1wff s GLU 42 N -3.70 3.28 0.27 0.44 2.12 -1.26 -3.54 118.70 116.31 1wff s GLU 42 Ca 0.34 -0.74 0.06 0.00 0.36 0.00 0.00 54.97 55.00 1wff s GLU 42 Cb -0.00 -2.58 -0.03 0.00 0.26 0.00 0.00 34.13 31.78 1wff s GLU 42 CO 0.19 0.14 0.35 0.00 -0.54 0.00 0.00 175.26 175.40 1wff h ARG 44 N 1.17 0.42 -0.18 0.00 2.47 -1.94 0.42 114.38 116.74 1wff h ARG 44 Ca -0.49 -0.03 -0.14 0.00 -1.26 0.00 0.00 59.98 58.06 1wff h ARG 44 Cb 1.24 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 29.46 1wff h ARG 44 CO 0.59 0.28 -0.50 0.00 0.56 0.00 0.00 179.97 180.90 1wff n GLY 46 N 0.12 0.83 3.70 0.00 0.00 0.15 -5.05 105.19 104.94 1wff n GLY 46 Ca -0.02 -0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 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 0.01 2.96 -4.65 1.61 3.02 -1.26 -4.48 115.26 112.46 1wff n ASN 47 Ca 0.00 1.18 -0.40 0.00 -0.03 0.00 0.00 54.58 55.34 1wff n ASN 47 Cb 0.00 -1.49 -0.07 0.00 -0.61 0.00 0.00 39.78 37.61 1wff n ASN 47 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1wff s ASN 48 N -0.03 6.56 0.43 6.41 4.22 -1.26 -3.49 114.94 127.77 1wff s ASN 48 Ca 0.60 0.67 0.06 0.00 -2.14 0.00 0.00 52.86 52.05 1wff s ASN 48 Cb -0.58 -2.31 -0.06 0.00 1.28 0.00 0.00 41.25 39.58 1wff s ASN 48 CO 0.57 -0.25 0.02 -0.36 -2.04 0.00 0.00 177.10 175.04 1wff s PHE 49 N 1.98 2.38 0.84 1.54 0.08 -1.23 -1.33 117.98 122.23 1wff s PHE 49 Ca 0.25 -0.73 -0.13 0.00 0.12 0.00 0.00 56.93 56.44 1wff s PHE 49 Cb -0.16 -1.75 0.10 0.00 -0.57 0.00 0.00 43.02 40.64 1wff s PHE 49 CO 0.09 0.38 1.20 0.00 -0.10 0.00 0.00 175.22 176.80 1wff h ALA 51 N -1.16 1.26 0.03 0.00 0.00 -1.94 1.95 119.26 119.40 1wff h ALA 51 Ca -0.46 -0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.17 1wff h ALA 51 Cb 1.31 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.07 1wff h ALA 51 CO 0.61 -0.06 -1.51 1.03 0.00 0.00 0.00 179.25 179.32 1wff h SER 52 N 0.00 0.10 -0.13 0.00 0.87 -1.92 -3.35 113.55 109.11 1wff h SER 52 Ca 0.01 -0.16 -0.00 0.00 -1.23 0.00 0.00 61.79 60.41 1wff h SER 52 Cb 0.10 -0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 62.03 1wff h SER 52 CO -0.00 1.13 -0.00 1.41 -0.53 0.00 0.00 176.83 178.84 1wff n HIS 53 N -3.22 0.47 0.23 2.24 -0.00 -0.32 -4.65 115.22 109.97 1wff n HIS 53 Ca -0.13 -0.95 0.06 0.00 -0.00 0.00 0.00 57.72 56.70 1wff n HIS 53 Cb 1.02 -0.23 0.53 0.00 -0.00 0.00 0.00 29.99 31.31 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 0.90 0.00 -7.36 -0.41 0.11 0.29 -3.41 114.38 104.50 1wff h ARG 54 Ca 0.00 0.00 -0.50 0.00 0.10 0.00 0.00 59.98 59.58 1wff h ARG 54 Cb 1.22 0.00 0.11 0.00 1.11 0.00 0.00 29.97 32.42 1wff h ARG 54 CO 0.11 0.19 0.33 0.71 0.10 0.00 0.00 179.97 181.41 1wff s TYR 55 N -4.52 2.81 -0.07 4.08 2.02 -1.26 -4.68 117.35 115.72 1wff s TYR 55 Ca -0.04 1.32 -0.21 0.00 -0.37 0.00 0.00 57.07 57.78 1wff s TYR 55 Cb 0.15 -3.03 -0.16 0.00 -0.40 0.00 0.00 41.96 38.52 1wff s TYR 55 CO 0.68 -1.69 0.82 0.00 -1.57 0.00 0.00 175.55 173.79 1wff h ALA 56 N -1.04 -0.16 -0.78 3.71 0.00 -1.96 -3.28 119.26 115.75 1wff h ALA 56 Ca -0.46 -0.25 0.11 0.00 0.00 0.00 0.00 54.91 54.32 1wff h ALA 56 Cb 1.24 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 19.04 1wff h ALA 56 CO 0.56 -0.24 0.51 1.05 0.00 0.00 0.00 179.25 181.14 1wff h GLU 57 N -0.87 0.62 -0.97 0.00 4.11 -1.93 0.17 114.58 115.71 1wff h GLU 57 Ca -0.02 -0.04 0.13 0.00 0.07 0.00 0.00 59.36 59.51 1wff h GLU 57 Cb 0.55 -0.14 -0.09 0.00 0.50 0.00 0.00 28.75 29.57 1wff h GLU 57 CO 0.03 0.41 0.59 0.00 0.07 0.00 0.00 179.01 180.11 1wff h ALA 58 N 1.62 1.48 -0.29 1.06 0.00 -1.89 -1.76 119.26 119.48 1wff h ALA 58 Ca 0.37 0.04 -0.16 0.00 0.00 0.00 0.00 54.91 55.16 1wff h ALA 58 Cb 0.58 -0.17 -0.10 0.00 0.00 0.00 0.00 17.79 18.10 1wff h ALA 58 CO -0.14 0.15 -0.23 -2.39 0.00 0.00 0.00 179.25 176.64 1wff n HIS 59 N -4.67 0.92 -4.04 0.00 1.44 -0.40 -4.98 115.22 103.47 1wff n HIS 59 Ca 0.19 -1.65 -0.43 0.00 -2.01 0.00 0.00 57.72 53.81 1wff n HIS 59 Cb 0.38 -0.44 0.02 0.00 0.12 0.00 0.00 29.99 30.07 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 -1.10 -0.93 3.61 -1.39 0.00 -0.11 -4.75 105.19 100.53 1wff n GLY 60 Ca 0.31 0.38 -0.49 0.00 0.00 0.00 0.00 46.02 46.22 1wff n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wff h ASN 62 N 4.47 0.37 -2.14 0.00 -1.07 -1.91 -3.48 115.58 111.82 1wff h ASN 62 Ca -0.46 -0.87 -0.60 0.00 0.07 0.00 0.00 56.30 54.44 1wff h ASN 62 Cb 1.31 -0.12 0.17 0.00 -2.07 0.00 0.00 38.32 37.61 1wff h ASN 62 CO 0.78 1.75 -0.89 0.00 0.07 0.00 0.00 177.43 179.14 1wff n TYR 63 N -3.73 -2.06 -3.21 4.14 9.36 -1.26 -4.88 117.16 115.53 1wff n TYR 63 Ca -0.30 0.51 -0.45 0.00 3.32 0.00 0.00 57.90 60.98 1wff n TYR 63 Cb 0.97 -1.79 -0.06 0.00 -0.63 0.00 0.00 39.34 37.83 1wff n TYR 63 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1wff s ASP 64 N -1.03 6.19 -0.28 2.98 -1.08 -1.26 -4.88 116.67 117.31 1wff s ASP 64 Ca 0.60 -1.37 0.09 0.00 -0.52 0.00 0.00 52.55 51.35 1wff s ASP 64 Cb -0.53 -2.26 0.46 0.00 -1.46 0.00 0.00 42.92 39.13 1wff s ASP 64 CO 0.62 -0.93 1.33 0.00 0.52 0.00 0.00 175.17 176.71 1wff n TYR 65 N 5.88 1.15 -2.79 -5.34 4.11 -1.26 -4.88 117.16 114.04 1wff n TYR 65 Ca -0.10 -1.78 -0.43 0.00 -0.00 0.00 0.00 57.90 55.59 1wff n TYR 65 Cb 0.43 -0.41 -0.04 0.00 -0.00 0.00 0.00 39.34 39.32 1wff n TYR 65 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.86 177.07 1wff s LYS 66 N -3.36 3.54 -1.65 -3.48 2.20 -1.26 -4.10 119.74 111.62 1wff s LYS 66 Ca 0.44 0.19 -0.14 0.00 -0.36 0.00 0.00 55.97 56.10 1wff s LYS 66 Cb 0.40 -3.93 0.12 0.00 -1.51 0.00 0.00 37.83 32.91 1wff s LYS 66 CO -0.02 -1.27 0.63 0.45 -0.36 0.00 0.00 175.35 174.78 1wff n SER 67 N 7.30 -2.21 -4.73 1.43 2.88 -1.26 -4.84 113.62 112.19 1wff n SER 67 Ca 0.07 -1.06 -0.42 0.00 -1.33 0.00 0.00 58.87 56.13 1wff n SER 67 Cb 0.49 -2.59 -0.03 0.00 -0.75 0.00 0.00 64.21 61.33 1wff n SER 67 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wff s ALA 68 N -3.51 3.70 0.00 -1.46 0.00 -1.26 -4.70 121.76 114.53 1wff s ALA 68 Ca 0.55 1.34 0.00 0.00 0.00 0.00 0.00 51.96 53.85 1wff s ALA 68 Cb -0.30 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.23 1wff s ALA 68 CO 0.94 -0.76 0.00 0.41 0.00 0.00 0.00 175.76 176.35 1wff n GLY 69 N 3.05 -0.02 3.96 0.00 0.00 -1.26 -5.15 105.19 105.77 1wff n GLY 69 Ca 0.11 -0.29 -0.22 0.00 0.00 0.00 0.00 46.02 45.62 1wff n GLY 69 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1wff s ARG 70 N 0.00 2.48 0.74 1.61 3.52 -1.26 -5.06 118.95 120.98 1wff s ARG 70 Ca 0.00 -0.63 -0.15 0.00 -0.13 0.00 0.00 55.73 54.82 1wff s ARG 70 Cb 0.00 -2.41 0.04 0.00 -1.56 0.00 0.00 34.95 31.03 1wff s ARG 70 CO 0.00 -0.83 1.23 0.50 -0.81 0.00 0.00 175.30 175.39 1wff s ARG 71 N -4.88 2.03 0.49 5.12 6.06 -1.26 -4.88 118.95 121.62 1wff s ARG 71 Ca 0.58 1.85 -0.17 0.00 -2.50 0.00 0.00 55.73 55.48 1wff s ARG 71 Cb -0.10 -1.81 -0.14 0.00 0.06 0.00 0.00 34.95 32.95 1wff s ARG 71 CO 0.40 -1.94 -0.13 0.98 -2.50 0.00 0.00 175.30 172.11 1wff n TYR 72 N -2.75 -2.81 -4.00 5.12 9.36 -1.26 -4.99 117.16 115.83 1wff n TYR 72 Ca 0.14 0.43 -0.14 0.00 3.32 0.00 0.00 57.90 61.66 1wff n TYR 72 Cb 0.50 -1.61 -0.02 0.00 -0.63 0.00 0.00 39.34 37.58 1wff n TYR 72 CO 0.00 0.00 0.00 1.47 0.22 0.00 0.00 176.86 178.55 1wff n LEU 73 N 2.41 0.00 -4.77 2.98 -0.00 -1.26 -5.18 117.00 111.18 1wff n LEU 73 Ca 0.07 -2.81 -0.22 0.00 -0.00 0.00 0.00 56.01 53.05 1wff n LEU 73 Cb 0.45 2.82 -0.05 0.00 -0.00 0.00 0.00 43.42 46.64 1wff n LEU 73 CO 0.52 -0.70 -0.17 -0.70 -0.00 0.00 0.00 177.39 176.34 1wff s GLU 74 N -2.65 2.54 -1.08 1.47 2.12 -1.26 -4.67 118.70 115.17 1wff s GLU 74 Ca 0.26 -1.39 -0.04 0.00 0.36 0.00 0.00 54.97 54.16 1wff s GLU 74 Cb -0.02 -2.32 0.00 0.00 0.26 0.00 0.00 34.13 32.06 1wff s GLU 74 CO 0.19 0.17 0.93 0.39 -0.54 0.00 0.00 175.26 176.40 1wff n GLU 75 N -1.20 -6.22 -3.85 4.30 -0.58 -1.26 -4.98 120.64 106.86 1wff n GLU 75 Ca -0.04 0.70 -0.00 0.00 -0.42 0.00 0.00 57.16 57.41 1wff n GLU 75 Cb 0.60 -5.34 0.01 0.00 -0.57 0.00 0.00 31.44 26.14 1wff n GLU 75 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1wff s ALA 76 N -3.28 -2.03 -0.62 0.62 0.00 -1.26 -5.04 121.76 110.14 1wff s ALA 76 Ca 0.28 0.06 -0.01 0.00 0.00 0.00 0.00 51.96 52.28 1wff s ALA 76 Cb -0.12 0.71 -0.01 0.00 0.00 0.00 0.00 23.12 23.69 1wff s ALA 76 CO 0.61 -1.09 0.53 -1.71 0.00 0.00 0.00 175.76 174.10 1wff n ASN 77 N -0.93 -2.99 -3.93 0.00 2.85 -1.26 -5.03 115.26 103.96 1wff n ASN 77 Ca -0.02 -0.36 -0.30 0.00 -0.11 0.00 0.00 54.58 53.79 1wff n ASN 77 Cb 0.60 -3.04 0.23 0.00 1.24 0.00 0.00 39.78 38.81 1wff n ASN 77 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 1wff s PRO 78 N -4.36 -1.02 0.02 1.20 0.04 -1.26 -5.09 135.00 124.53 1wff s PRO 78 Ca 0.10 0.01 -0.08 0.00 0.04 0.00 0.00 61.00 61.07 1wff s PRO 78 Cb -0.01 -1.61 -0.00 0.00 0.04 0.00 0.00 34.50 32.91 1wff s PRO 78 CO 0.40 -3.60 0.14 0.08 0.04 0.00 0.00 177.00 174.07 1wff s VAL 79 N -3.00 0.11 0.47 -0.36 1.01 -1.26 -5.18 120.40 112.18 1wff s VAL 79 Ca 0.70 -0.87 0.05 0.00 0.00 0.00 0.00 61.98 61.86 1wff s VAL 79 Cb -0.11 -0.72 -0.03 0.00 0.00 0.00 0.00 36.38 35.52 1wff s VAL 79 CO 0.56 -0.48 0.14 -0.94 0.00 0.00 0.00 175.10 174.38 1wff s SER 80 N -1.82 4.29 -0.26 3.32 1.04 -1.26 -5.12 113.70 113.88 1wff s SER 80 Ca -0.09 -1.33 -0.05 0.00 0.48 0.00 0.00 55.95 54.96 1wff s SER 80 Cb -0.04 -0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.08 1wff s SER 80 CO -0.02 -0.72 0.02 -0.83 0.98 0.00 0.00 173.24 172.67 1wff s GLY 81 N -3.94 1.71 0.55 7.32 0.00 -1.26 -5.11 107.32 106.60 1wff s GLY 81 Ca 0.28 -1.33 -0.09 0.00 0.00 0.00 0.00 44.72 43.58 1wff s GLY 81 CO 0.16 0.55 0.49 -1.55 0.00 0.00 0.00 173.10 172.75 1wff n PRO 82 N 4.82 -1.98 -4.04 2.90 -0.04 -1.26 -5.09 135.00 130.31 1wff n PRO 82 Ca -0.16 -0.79 -0.10 0.00 -0.04 0.00 0.00 63.50 62.41 1wff n PRO 82 Cb 0.49 -0.74 -0.11 0.00 -0.04 0.00 0.00 33.50 33.10 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 -2.84 0.53 0.38 3.54 0.15 -1.26 -5.17 113.70 109.02 1wff s SER 83 Ca 0.32 -0.64 0.04 0.00 0.70 0.00 0.00 55.95 56.36 1wff s SER 83 Cb -0.03 0.10 -0.04 0.00 -1.71 0.00 0.00 66.02 64.34 1wff s SER 83 CO 0.25 -0.34 0.09 -0.94 1.20 0.00 0.00 173.24 173.49 1wff s SER 84 N -1.88 2.71 0.00 5.45 1.04 -1.26 -5.36 113.70 114.40 1wff s SER 84 Ca -0.08 -1.54 0.00 0.00 0.48 0.00 0.00 55.95 54.81 1wff s SER 84 Cb -0.06 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.30 1wff s SER 84 CO -0.02 -0.78 0.49 0.61 0.98 0.00 0.00 173.24 174.52