#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dip s SER 2 N 0.00 -0.16 0.29 1.61 0.01 -1.26 -5.18 113.70 109.01 2dip s SER 2 Ca 0.00 -0.27 -0.12 0.00 1.31 0.00 0.00 55.95 56.87 2dip s SER 2 Cb 0.00 0.41 0.01 0.00 0.21 0.00 0.00 66.02 66.65 2dip s SER 2 CO 0.00 -0.73 0.55 -0.44 0.41 0.00 0.00 173.24 173.03 2dip s SER 3 N -2.43 0.12 -0.05 2.44 0.01 -1.26 -5.18 113.70 107.34 2dip s SER 3 Ca -0.01 -1.05 -0.14 0.00 1.31 0.00 0.00 55.95 56.06 2dip s SER 3 Cb 0.01 0.66 0.03 0.00 0.21 0.00 0.00 66.02 66.92 2dip s SER 3 CO -0.07 -1.28 0.33 -0.83 0.41 0.00 0.00 173.24 171.80 2dip s GLY 4 N -3.06 -0.20 0.23 3.44 0.00 -1.26 -5.17 107.32 101.30 2dip s GLY 4 Ca 0.22 0.57 -0.20 0.00 0.00 0.00 0.00 44.72 45.31 2dip s GLY 4 CO 0.12 0.38 0.63 -0.56 0.00 0.00 0.00 173.10 173.67 2dip s SER 5 N -0.82 -0.32 0.44 1.64 0.01 -1.26 -5.19 113.70 108.21 2dip s SER 5 Ca -0.09 -0.47 0.06 0.00 1.31 0.00 0.00 55.95 56.76 2dip s SER 5 Cb -0.04 0.66 -0.04 0.00 0.21 0.00 0.00 66.02 66.80 2dip s SER 5 CO 0.03 -1.19 0.15 -0.55 0.41 0.00 0.00 173.24 172.09 2dip s SER 6 N -2.88 4.30 -0.29 2.44 0.15 -1.26 -5.13 113.70 111.02 2dip s SER 6 Ca 0.09 -1.23 -0.03 0.00 0.70 0.00 0.00 55.95 55.48 2dip s SER 6 Cb -0.03 -0.23 0.19 0.00 -1.71 0.00 0.00 66.02 64.24 2dip s SER 6 CO 0.01 -0.63 0.80 -0.83 1.20 0.00 0.00 173.24 173.79 2dip s GLY 7 N -3.91 -1.01 -0.27 9.45 0.00 -1.26 -5.14 107.32 105.18 2dip s GLY 7 Ca 0.34 1.71 -0.10 0.00 0.00 0.00 0.00 44.72 46.67 2dip s GLY 7 CO 0.19 3.81 0.60 -2.27 0.00 0.00 0.00 173.10 175.42 2dip s LEU 8 N 2.89 -0.96 -0.21 0.66 0.20 -1.26 -5.15 118.68 114.86 2dip s LEU 8 Ca 0.16 1.41 -0.09 0.00 0.69 0.00 0.00 54.13 56.30 2dip s LEU 8 Cb -0.08 2.07 0.08 0.00 -0.43 0.00 0.00 46.19 47.83 2dip s LEU 8 CO -0.23 -0.22 0.47 -1.61 -0.29 0.00 0.00 176.35 174.47 2dip s GLU 9 N 2.57 0.43 -0.22 1.98 8.01 -1.26 -5.14 118.70 125.07 2dip s GLU 9 Ca -0.06 0.99 -0.07 0.00 0.01 0.00 0.00 54.97 55.84 2dip s GLU 9 Cb -0.11 0.20 0.10 0.00 -4.31 0.00 0.00 34.13 30.01 2dip s GLU 9 CO -0.18 -0.19 0.46 -1.21 0.01 0.00 0.00 175.26 174.15 2dip s GLU 10 N 1.97 0.37 0.19 1.61 2.02 -1.26 -5.16 118.70 118.44 2dip s GLU 10 Ca -0.07 1.08 -0.06 0.00 0.02 0.00 0.00 54.97 55.95 2dip s GLU 10 Cb -0.09 0.39 -0.02 0.00 0.10 0.00 0.00 34.13 34.51 2dip s GLU 10 CO -0.14 -0.27 0.25 -0.59 0.02 0.00 0.00 175.26 174.53 2dip s PHE 11 N 2.66 0.70 0.05 1.61 -0.12 -1.26 -5.18 117.98 116.44 2dip s PHE 11 Ca -0.01 -1.02 -0.21 0.00 -0.05 0.00 0.00 56.93 55.64 2dip s PHE 11 Cb -0.12 -0.22 0.05 0.00 -0.63 0.00 0.00 43.02 42.09 2dip s PHE 11 CO -0.14 -0.73 0.48 -1.59 -0.05 0.00 0.00 175.22 173.19 2dip s LYS 12 N -4.05 0.99 -0.01 1.99 -2.85 -1.26 -5.18 119.74 109.37 2dip s LYS 12 Ca 0.26 -0.29 -0.07 0.00 -1.00 0.00 0.00 55.97 54.87 2dip s LYS 12 Cb 0.04 0.45 0.01 0.00 -2.06 0.00 0.00 37.83 36.27 2dip s LYS 12 CO 0.06 -0.35 0.15 1.21 0.10 0.00 0.00 175.35 176.52 2dip s ASN 13 N -2.00 -0.03 0.06 0.03 3.84 -1.26 -5.16 114.94 110.43 2dip s ASN 13 Ca -0.05 -0.07 0.03 0.00 0.21 0.00 0.00 52.86 52.98 2dip s ASN 13 Cb -0.01 0.24 -0.04 0.00 -0.55 0.00 0.00 41.25 40.89 2dip s ASN 13 CO -0.02 -0.29 0.03 -0.55 -2.79 0.00 0.00 177.10 173.47 2dip s SER 14 N -1.02 5.22 -0.35 -4.21 0.15 -1.26 -5.09 113.70 107.13 2dip s SER 14 Ca -0.11 -0.08 0.03 0.00 0.70 0.00 0.00 55.95 56.49 2dip s SER 14 Cb -0.06 -1.33 0.10 0.00 -1.71 0.00 0.00 66.02 63.03 2dip s SER 14 CO 0.01 0.20 0.08 -0.44 1.20 0.00 0.00 173.24 174.29 2dip s SER 15 N -2.15 4.58 -0.44 5.45 0.01 -1.26 -5.07 113.70 114.83 2dip s SER 15 Ca 0.25 -2.15 -0.40 0.00 1.31 0.00 0.00 55.95 54.96 2dip s SER 15 Cb -0.12 -1.49 -0.17 0.00 0.21 0.00 0.00 66.02 64.45 2dip s SER 15 CO 0.17 -0.37 1.56 0.29 0.41 0.00 0.00 173.24 175.30 2dip n LYS 16 N 4.25 0.00 -4.32 12.44 5.02 -1.26 -4.92 118.16 129.37 2dip n LYS 16 Ca 0.03 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.15 2dip n LYS 16 Cb 0.41 -1.31 -0.10 0.00 -0.02 0.00 0.00 35.03 34.01 2dip n LYS 16 CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 2dip s LEU 17 N 3.51 2.15 -0.46 -0.35 -0.00 -1.26 -5.12 118.68 117.15 2dip s LEU 17 Ca 0.96 -1.23 0.03 0.00 -0.00 0.00 0.00 54.13 53.89 2dip s LEU 17 Cb -1.31 -0.23 0.13 0.00 -0.00 0.00 0.00 46.19 44.78 2dip s LEU 17 CO 0.67 -0.53 0.24 -0.69 -0.00 0.00 0.00 176.35 176.04 2dip s VAL 18 N -3.46 1.78 -0.00 1.48 1.01 -1.26 -5.09 120.40 114.86 2dip s VAL 18 Ca 0.29 -2.79 0.01 0.00 0.00 0.00 0.00 61.98 59.49 2dip s VAL 18 Cb 0.06 -2.24 -0.00 0.00 0.00 0.00 0.00 36.38 34.19 2dip s VAL 18 CO 0.09 -0.86 -0.04 0.00 0.00 0.00 0.00 175.10 174.28 2dip s ALA 19 N 0.16 0.33 -0.24 5.51 0.00 -1.26 -5.14 121.76 121.12 2dip s ALA 19 Ca 0.17 -0.20 -0.07 0.00 0.00 0.00 0.00 51.96 51.86 2dip s ALA 19 Cb -0.25 -0.07 -0.03 0.00 0.00 0.00 0.00 23.12 22.77 2dip s ALA 19 CO 0.00 0.07 0.05 0.00 0.00 0.00 0.00 175.76 175.89 2dip s ALA 20 N -0.19 3.14 0.23 0.00 0.00 -1.26 -5.09 121.76 118.59 2dip s ALA 20 Ca 0.01 -1.09 0.05 0.00 0.00 0.00 0.00 51.96 50.93 2dip s ALA 20 Cb -0.02 -2.01 -0.05 0.00 0.00 0.00 0.00 23.12 21.04 2dip s ALA 20 CO -0.00 -0.39 -0.05 0.00 0.00 0.00 0.00 175.76 175.32 2dip s ALA 21 N 1.44 1.89 0.06 0.00 0.00 -1.26 -5.16 121.76 118.73 2dip s ALA 21 Ca 0.05 -1.74 0.09 0.00 0.00 0.00 0.00 51.96 50.36 2dip s ALA 21 Cb -0.15 0.29 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 2dip s ALA 21 CO 0.03 -0.15 -0.23 -2.00 0.00 0.00 0.00 175.76 173.41 2dip s GLU 22 N -3.79 1.86 0.69 0.00 2.56 -1.26 -5.14 118.70 113.62 2dip s GLU 22 Ca 0.26 -1.09 -0.07 0.00 0.00 0.00 0.00 54.97 54.07 2dip s GLU 22 Cb 0.04 -2.06 0.05 0.00 2.00 0.00 0.00 34.13 34.16 2dip s GLU 22 CO 0.08 0.51 1.01 0.15 -0.56 0.00 0.00 175.26 176.46 2dip s LYS 23 N -1.44 2.36 0.08 4.30 -0.14 -1.26 -5.01 119.74 118.63 2dip s LYS 23 Ca 0.13 -0.12 -0.34 0.00 -1.36 0.00 0.00 55.97 54.28 2dip s LYS 23 Cb -0.10 -2.16 -0.16 0.00 -1.68 0.00 0.00 37.83 33.73 2dip s LYS 23 CO 0.04 -1.16 1.53 0.93 -0.76 0.00 0.00 175.35 175.94 2dip h GLU 24 N -0.57 -0.92 -6.73 1.68 4.39 -2.00 -3.41 114.58 107.02 2dip h GLU 24 Ca -0.45 0.06 -0.51 0.00 0.34 0.00 0.00 59.36 58.81 2dip h GLU 24 Cb 1.30 0.21 0.01 0.00 -0.10 0.00 0.00 28.75 30.17 2dip h GLU 24 CO 0.61 -0.62 0.46 -0.98 -1.16 0.00 0.00 179.01 177.32 2dip s ARG 25 N -5.72 4.65 -0.31 2.33 3.03 -1.26 -4.93 118.95 116.73 2dip s ARG 25 Ca -0.17 1.72 -0.00 0.00 2.03 0.00 0.00 55.73 59.31 2dip s ARG 25 Cb 0.04 -3.24 0.26 0.00 -1.03 0.00 0.00 34.95 30.98 2dip s ARG 25 CO 0.58 0.19 1.88 1.47 -1.13 0.00 0.00 175.30 178.28 2dip n LEU 26 N 1.79 6.12 -3.64 -1.89 -0.00 -1.26 -4.82 117.00 113.31 2dip n LEU 26 Ca 0.01 -3.16 -0.06 0.00 -0.00 0.00 0.00 56.01 52.80 2dip n LEU 26 Cb 0.46 -0.95 -0.07 0.00 -0.00 0.00 0.00 43.42 42.86 2dip n LEU 26 CO 0.53 1.12 0.97 1.51 -0.00 0.00 0.00 177.39 181.52 2dip s ASP 27 N -0.01 -0.23 -0.03 1.45 1.47 -1.26 -5.03 116.67 113.04 2dip s ASP 27 Ca 0.32 0.42 -0.02 0.00 1.18 0.00 0.00 52.55 54.45 2dip s ASP 27 Cb 0.26 0.41 -0.07 0.00 -0.34 0.00 0.00 42.92 43.18 2dip s ASP 27 CO 0.01 -0.10 2.53 0.29 0.68 0.00 0.00 175.17 178.59 2dip n LYS 28 N 1.66 1.39 -3.37 2.11 5.02 -1.26 -4.45 118.16 119.27 2dip n LYS 28 Ca -0.10 -0.45 -0.26 0.00 -2.02 0.00 0.00 58.31 55.47 2dip n LYS 28 Cb 0.57 -1.38 -0.09 0.00 -0.02 0.00 0.00 35.03 34.12 2dip n LYS 28 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 2dip n HIS 29 N 1.74 0.70 0.07 2.13 -0.00 -1.26 -4.93 115.22 113.67 2dip n HIS 29 Ca 0.16 -3.70 -0.22 0.00 0.46 0.00 0.00 57.72 54.42 2dip n HIS 29 Cb 0.64 -0.27 -0.15 0.00 -0.12 0.00 0.00 29.99 30.09 2dip n HIS 29 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 2dip h LEU 30 N 4.60 0.57 0.00 0.27 3.38 -1.99 -3.41 115.31 118.74 2dip h LEU 30 Ca 0.16 -0.91 0.00 0.00 0.09 0.00 0.00 57.88 57.21 2dip h LEU 30 Cb 0.83 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2dip h LEU 30 CO 0.54 1.64 0.00 0.61 0.09 0.00 0.00 178.44 181.32 2dip n GLY 31 N 1.75 1.07 2.94 0.83 0.00 -1.26 -4.35 105.19 106.16 2dip n GLY 31 Ca -0.21 0.32 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 2dip n GLY 31 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dip s ILE 32 N 0.00 -0.01 0.91 -0.61 1.01 -1.26 -5.16 121.20 116.08 2dip s ILE 32 Ca 0.00 0.02 -0.12 0.00 0.00 0.00 0.00 60.65 60.56 2dip s ILE 32 Cb 0.00 -0.13 0.13 0.00 0.01 0.00 0.00 42.46 42.48 2dip s ILE 32 CO 0.00 0.01 1.09 -2.16 0.00 0.00 0.00 174.94 173.88 2dip s PRO 33 N 0.17 1.18 0.74 2.79 0.04 -1.26 -4.81 135.00 133.85 2dip s PRO 33 Ca -0.01 0.79 -0.14 0.00 0.04 0.00 0.00 61.00 61.68 2dip s PRO 33 Cb -0.02 -1.80 0.05 0.00 0.04 0.00 0.00 34.50 32.77 2dip s PRO 33 CO -0.00 -2.29 1.17 0.00 0.04 0.00 0.00 177.00 175.92 2dip n ASN 35 N -2.94 0.64 0.00 0.00 5.15 0.29 -3.29 115.26 115.12 2dip n ASN 35 Ca 0.12 -0.38 0.00 0.00 -0.60 0.00 0.00 54.58 53.72 2dip n ASN 35 Cb 0.51 0.87 0.00 0.00 -0.53 0.00 0.00 39.78 40.63 2dip n ASN 35 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2dip n ASN 36 N -1.82 0.00 -0.19 1.20 5.15 -1.26 -4.66 115.26 113.67 2dip n ASN 36 Ca 0.02 0.00 0.10 0.00 -0.60 0.00 0.00 54.58 54.10 2dip n ASN 36 Cb 0.41 -0.27 0.50 0.00 -0.53 0.00 0.00 39.78 39.89 2dip n ASN 36 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2dip n LYS 38 N -0.41 -2.68 -1.71 0.00 4.76 -1.21 -4.78 118.16 112.13 2dip n LYS 38 Ca 0.15 0.13 -0.42 0.00 -2.87 0.00 0.00 58.31 55.30 2dip n LYS 38 Cb 0.16 -4.66 -0.03 0.00 -1.84 0.00 0.00 35.03 28.66 2dip n LYS 38 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 2dip s GLN 39 N -5.28 4.02 -0.10 1.97 0.74 -1.26 -4.50 119.66 115.24 2dip s GLN 39 Ca 0.10 2.48 -0.05 0.00 0.05 0.00 0.00 55.36 57.94 2dip s GLN 39 Cb -0.06 -4.17 0.05 0.00 1.10 0.00 0.00 33.01 29.93 2dip s GLN 39 CO 0.13 -1.09 0.24 0.12 -0.55 0.00 0.00 175.29 174.14 2dip s PHE 40 N 4.88 -0.32 1.00 1.67 5.36 -1.26 -2.98 117.98 126.33 2dip s PHE 40 Ca 0.88 0.77 -0.12 0.00 -0.96 0.00 0.00 56.93 57.49 2dip s PHE 40 Cb -0.40 0.04 0.19 0.00 -0.34 0.00 0.00 43.02 42.51 2dip s PHE 40 CO 0.39 -0.23 1.09 -1.25 -1.46 0.00 0.00 175.22 173.77 2dip s PRO 41 N 1.25 0.41 -1.13 10.12 0.04 -1.26 -5.07 135.00 139.36 2dip s PRO 41 Ca -0.09 0.52 -0.08 0.00 0.04 0.00 0.00 61.00 61.38 2dip s PRO 41 Cb -0.10 -1.73 0.27 0.00 0.04 0.00 0.00 34.50 32.97 2dip s PRO 41 CO -0.08 -2.75 1.29 -0.89 0.04 0.00 0.00 177.00 174.61 2dip n ILE 42 N -4.19 4.75 -0.32 0.56 5.41 -1.25 -4.89 119.36 119.44 2dip n ILE 42 Ca 0.05 -5.43 -0.03 0.00 1.00 0.00 0.00 62.75 58.34 2dip n ILE 42 Cb 0.57 -2.42 0.02 0.00 -0.71 0.00 0.00 39.64 37.10 2dip n ILE 42 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2dip h GLU 43 N 6.30 -0.06 0.00 0.38 5.08 -1.91 -3.41 114.58 120.96 2dip h GLU 43 Ca 0.21 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.36 2dip h GLU 43 Cb 0.79 0.01 0.12 0.00 0.50 0.00 0.00 28.75 30.17 2dip h GLU 43 CO 1.16 -0.04 -0.07 0.41 -1.00 0.00 0.00 179.01 179.47 2dip n GLY 44 N -1.45 -3.64 3.41 -3.84 0.00 -1.26 -4.97 105.19 93.44 2dip n GLY 44 Ca 0.08 -1.30 -0.29 0.00 0.00 0.00 0.00 46.02 44.50 2dip n GLY 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dip n LYS 45 N -4.04 -2.42 -4.03 1.61 4.76 -1.26 -4.71 118.16 108.07 2dip n LYS 45 Ca 0.08 -0.68 -0.31 0.00 -2.87 0.00 0.00 58.31 54.53 2dip n LYS 45 Cb 0.34 -2.04 -0.15 0.00 -1.84 0.00 0.00 35.03 31.34 2dip n LYS 45 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2dip s TYR 47 N 0.98 3.49 -0.03 0.00 1.51 -0.52 -2.65 117.35 120.13 2dip s TYR 47 Ca 0.05 0.37 -0.01 0.00 -1.01 0.00 0.00 57.07 56.47 2dip s TYR 47 Cb -0.19 -1.87 0.02 0.00 -0.11 0.00 0.00 41.96 39.81 2dip s TYR 47 CO -0.07 0.44 0.06 0.21 -1.11 0.00 0.00 175.55 175.07 2dip s LYS 48 N -3.00 0.02 -0.03 -0.62 2.20 0.94 -0.59 119.74 118.66 2dip s LYS 48 Ca 0.38 0.19 -0.30 0.00 -0.36 0.00 0.00 55.97 55.89 2dip s LYS 48 Cb -0.12 -0.15 -0.03 0.00 -1.51 0.00 0.00 37.83 36.02 2dip s LYS 48 CO 0.28 -0.12 1.12 0.00 -0.36 0.00 0.00 175.35 176.27 2dip n THR 50 N 4.34 0.38 -0.02 0.00 -2.24 0.71 -3.89 114.28 113.57 2dip n THR 50 Ca 0.09 -0.47 -0.01 0.00 -2.27 0.00 0.00 64.05 61.39 2dip n THR 50 Cb 0.48 0.37 -0.04 0.00 -2.10 0.00 0.00 70.33 69.04 2dip n THR 50 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2dip n GLU 51 N 0.57 2.68 -1.66 -0.78 1.02 -1.26 -4.97 120.64 116.25 2dip n GLU 51 Ca 0.15 -0.01 -0.10 0.00 -0.02 0.00 0.00 57.16 57.18 2dip n GLU 51 Cb 0.35 -1.11 0.05 0.00 -0.02 0.00 0.00 31.44 30.71 2dip n GLU 51 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dip s ILE 53 N -1.06 3.00 -1.69 0.00 -1.09 -1.26 -4.65 121.20 114.44 2dip s ILE 53 Ca 0.30 -0.67 -0.16 0.00 -2.23 0.00 0.00 60.65 57.88 2dip s ILE 53 Cb -0.02 -2.26 0.15 0.00 -1.58 0.00 0.00 42.46 38.74 2dip s ILE 53 CO 0.19 0.52 0.68 -1.84 -1.23 0.00 0.00 174.94 173.26 2dip n GLU 54 N 3.62 -2.70 -4.00 2.79 0.28 -1.26 -4.92 120.64 114.45 2dip n GLU 54 Ca -0.18 0.33 -0.35 0.00 -0.16 0.00 0.00 57.16 56.79 2dip n GLU 54 Cb 0.53 -4.90 -0.11 0.00 1.43 0.00 0.00 31.44 28.38 2dip n GLU 54 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 2dip s TYR 55 N -3.41 3.16 -0.04 -1.84 6.14 -1.26 -5.00 117.35 115.10 2dip s TYR 55 Ca 0.64 -0.14 -0.02 0.00 0.64 0.00 0.00 57.07 58.19 2dip s TYR 55 Cb -0.35 -2.11 0.02 0.00 0.42 0.00 0.00 41.96 39.94 2dip s TYR 55 CO 0.94 -0.04 0.08 -1.01 0.64 0.00 0.00 175.55 176.17 2dip s HIS 56 N 0.76 -0.07 0.45 4.97 3.76 -1.26 -1.51 115.29 122.38 2dip s HIS 56 Ca 0.03 0.26 0.06 0.00 -0.15 0.00 0.00 55.06 55.25 2dip s HIS 56 Cb -0.14 -0.08 -0.04 0.00 1.11 0.00 0.00 32.58 33.43 2dip s HIS 56 CO 0.02 -0.09 0.14 -0.51 -0.85 0.00 0.00 174.74 173.45 2dip s LEU 57 N 0.67 2.87 0.08 0.89 1.43 0.24 0.11 118.68 124.97 2dip s LEU 57 Ca -0.05 -1.26 0.08 0.00 -1.03 0.00 0.00 54.13 51.87 2dip s LEU 57 Cb -0.07 -1.17 -0.04 0.00 0.03 0.00 0.00 46.19 44.94 2dip s LEU 57 CO -0.03 -0.65 -0.18 0.00 0.23 0.00 0.00 176.35 175.72 2dip n GLN 59 N 1.19 -0.03 0.25 0.00 -0.06 -1.15 0.10 117.38 117.68 2dip n GLN 59 Ca -0.16 0.97 -0.10 0.00 -2.00 0.00 0.00 57.00 55.71 2dip n GLN 59 Cb 0.52 -1.93 -0.05 0.00 -4.06 0.00 0.00 30.24 24.72 2dip n GLN 59 CO 0.00 0.00 0.00 1.49 -0.20 0.00 0.00 177.06 178.35 2dip h GLU 60 N 0.00 -0.64 -0.27 3.69 4.81 -1.94 -2.63 114.58 117.60 2dip h GLU 60 Ca 0.69 0.04 0.08 0.00 -0.13 0.00 0.00 59.36 60.04 2dip h GLU 60 Cb 2.27 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 31.79 2dip h GLU 60 CO -0.34 -0.43 0.24 0.00 -0.73 0.00 0.00 179.01 177.76 2dip h PHE 62 N 0.00 0.00 0.00 0.00 3.57 -0.80 -2.58 116.94 117.12 2dip h PHE 62 Ca 0.13 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.60 2dip h PHE 62 Cb 0.60 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.34 2dip h PHE 62 CO 0.00 0.14 -0.11 0.22 -2.23 0.00 0.00 178.31 176.32 2dip h ASP 63 N 0.00 0.00 1.79 0.41 3.58 -0.15 -2.58 116.42 119.46 2dip h ASP 63 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2dip h ASP 63 Cb 0.63 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.68 2dip h ASP 63 CO 0.02 0.11 0.00 -1.28 -2.88 0.00 0.00 179.24 175.21 2dip h SER 64 N 0.00 0.00 -4.72 2.28 0.87 -1.53 -3.47 113.55 106.99 2dip h SER 64 Ca -0.00 0.00 -0.37 0.00 -1.23 0.00 0.00 61.79 60.19 2dip h SER 64 Cb 0.63 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.58 2dip h SER 64 CO 0.01 0.00 -0.54 -1.22 -0.53 0.00 0.00 176.83 174.55 2dip n TYR 65 N -3.07 -1.77 -0.06 2.24 4.02 -0.97 -4.88 117.16 112.68 2dip n TYR 65 Ca 0.03 0.40 -0.17 0.00 -0.01 0.00 0.00 57.90 58.15 2dip n TYR 65 Cb 0.48 -3.57 -0.13 0.00 -0.02 0.00 0.00 39.34 36.10 2dip n TYR 65 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2dip n HIS 67 N -4.47 0.20 0.06 0.00 -0.00 -1.26 -4.02 115.22 105.73 2dip n HIS 67 Ca -0.16 0.06 0.16 0.00 -0.00 0.00 0.00 57.72 57.78 2dip n HIS 67 Cb 0.59 -0.48 0.33 0.00 -0.00 0.00 0.00 29.99 30.43 2dip n HIS 67 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 2dip h LEU 68 N 0.00 0.00 -1.51 0.27 -0.00 -1.94 0.29 115.31 112.42 2dip h LEU 68 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.88 57.91 2dip h LEU 68 Cb 0.57 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.23 2dip h LEU 68 CO 0.00 0.00 0.53 -1.28 -0.00 0.00 0.00 178.44 177.69 2dip h SER 69 N 0.00 0.00 -3.74 -0.43 0.87 -1.83 -3.39 113.55 105.03 2dip h SER 69 Ca 0.24 0.00 -0.68 0.00 -1.23 0.00 0.00 61.79 60.12 2dip h SER 69 Cb 2.24 0.00 -0.19 0.00 -0.44 0.00 0.00 62.40 64.01 2dip h SER 69 CO -0.00 0.00 -0.79 -1.00 -0.53 0.00 0.00 176.83 174.51 2dip s HIS 70 N -4.15 2.57 -0.42 2.24 3.76 0.10 -5.07 115.29 114.33 2dip s HIS 70 Ca -0.03 -0.24 -0.28 0.00 -0.15 0.00 0.00 55.06 54.36 2dip s HIS 70 Cb 0.08 -1.38 -0.02 0.00 1.11 0.00 0.00 32.58 32.37 2dip s HIS 70 CO 0.25 0.37 1.82 0.99 -0.85 0.00 0.00 174.74 177.32 2dip s THR 71 N -1.12 3.45 0.68 1.30 2.01 -1.26 -4.89 115.64 115.82 2dip s THR 71 Ca 0.18 0.41 0.04 0.00 0.31 0.00 0.00 61.69 62.63 2dip s THR 71 Cb -0.11 -3.73 0.12 0.00 0.01 0.00 0.00 72.50 68.80 2dip s THR 71 CO 0.10 -0.55 0.94 -0.36 -0.69 0.00 0.00 174.62 174.06 2dip s PHE 72 N 7.59 1.28 -0.17 4.92 0.40 -1.26 -0.20 117.98 130.53 2dip s PHE 72 Ca 0.76 -0.53 -0.09 0.00 -0.60 0.00 0.00 56.93 56.47 2dip s PHE 72 Cb -0.19 -2.67 0.06 0.00 0.51 0.00 0.00 43.02 40.73 2dip s PHE 72 CO 0.30 -1.60 0.42 0.95 0.70 0.00 0.00 175.22 175.98 2dip s THR 73 N -2.99 -0.08 0.21 0.64 -4.23 0.13 -2.80 115.64 106.52 2dip s THR 73 Ca 0.66 0.10 0.06 0.00 -1.18 0.00 0.00 61.69 61.32 2dip s THR 73 Cb -0.05 -0.62 -0.04 0.00 1.34 0.00 0.00 72.50 73.13 2dip s THR 73 CO 0.43 0.04 0.20 0.72 -0.54 0.00 0.00 174.62 175.47 2dip s PHE 74 N 1.51 3.19 0.46 3.99 -0.71 -0.95 -0.04 117.98 125.43 2dip s PHE 74 Ca -0.09 -0.05 0.08 0.00 -1.04 0.00 0.00 56.93 55.84 2dip s PHE 74 Cb -0.09 -1.48 0.02 0.00 -1.21 0.00 0.00 43.02 40.27 2dip s PHE 74 CO -0.13 0.51 0.59 1.03 -1.34 0.00 0.00 175.22 175.88 2dip s ARG 75 N -3.54 2.66 0.30 1.99 1.81 -1.08 0.14 118.95 121.24 2dip s ARG 75 Ca 0.32 -1.39 0.06 0.00 -1.72 0.00 0.00 55.73 53.00 2dip s ARG 75 Cb -0.09 -2.67 -0.06 0.00 -0.45 0.00 0.00 34.95 31.68 2dip s ARG 75 CO 0.25 -0.39 -0.02 -1.21 -0.68 0.00 0.00 175.30 173.25 2dip s GLU 76 N -4.39 1.62 1.01 3.54 2.02 -1.25 -4.78 118.70 116.47 2dip s GLU 76 Ca 0.55 -1.85 -0.16 0.00 0.02 0.00 0.00 54.97 53.52 2dip s GLU 76 Cb -0.08 -1.12 0.00 0.00 0.10 0.00 0.00 34.13 33.04 2dip s GLU 76 CO 0.33 -0.04 -0.06 0.36 0.02 0.00 0.00 175.26 175.87 2dip n LYS 77 N -0.65 -0.57 -0.94 1.61 2.85 -1.26 -4.60 118.16 114.60 2dip n LYS 77 Ca -0.04 -0.14 -0.32 0.00 -1.05 0.00 0.00 58.31 56.75 2dip n LYS 77 Cb 0.65 -1.60 0.02 0.00 -0.65 0.00 0.00 35.03 33.45 2dip n LYS 77 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2dip n ARG 78 N -0.76 0.00 -2.96 -1.58 5.12 -1.26 -2.58 116.66 112.65 2dip n ARG 78 Ca 0.03 0.00 -0.20 0.00 -1.93 0.00 0.00 57.85 55.75 2dip n ARG 78 Cb 0.58 -0.86 0.03 0.00 -1.16 0.00 0.00 32.46 31.05 2dip n ARG 78 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2dip n ASN 79 N 2.69 -5.64 -4.08 0.55 3.02 -1.26 -4.99 115.26 105.55 2dip n ASN 79 Ca 0.02 -0.27 -0.10 0.00 -0.03 0.00 0.00 54.58 54.20 2dip n ASN 79 Cb 0.45 -4.46 -0.08 0.00 -0.61 0.00 0.00 39.78 35.08 2dip n ASN 79 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2dip s GLN 80 N -5.59 1.26 0.41 3.52 -1.52 -1.06 -5.13 119.66 111.54 2dip s GLN 80 Ca 0.28 -1.39 0.04 0.00 -1.95 0.00 0.00 55.36 52.34 2dip s GLN 80 Cb -0.12 0.35 -0.05 0.00 -0.22 0.00 0.00 33.01 32.97 2dip s GLN 80 CO 0.35 -0.46 0.04 0.15 -0.25 0.00 0.00 175.29 175.12 2dip s LYS 81 N -4.06 1.92 1.09 2.91 -0.14 -1.26 -4.78 119.74 115.42 2dip s LYS 81 Ca 0.27 -2.14 -0.17 0.00 -1.36 0.00 0.00 55.97 52.57 2dip s LYS 81 Cb 0.04 -1.20 0.15 0.00 -1.68 0.00 0.00 37.83 35.14 2dip s LYS 81 CO 0.07 -0.25 0.16 0.91 -0.76 0.00 0.00 175.35 175.48 2dip n TRP 82 N -0.95 -2.01 -3.82 3.18 7.02 -1.26 -3.83 117.44 115.78 2dip n TRP 82 Ca -0.08 0.02 -0.13 0.00 -1.02 0.00 0.00 57.50 56.29 2dip n TRP 82 Cb 0.66 -1.46 -0.15 0.00 -2.42 0.00 0.00 31.31 27.95 2dip n TRP 82 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 2dip s ARG 83 N -3.52 0.02 -0.59 -0.99 1.81 0.37 -4.88 118.95 111.17 2dip s ARG 83 Ca 0.47 0.13 -0.26 0.00 -1.72 0.00 0.00 55.73 54.35 2dip s ARG 83 Cb -0.08 -0.09 0.04 0.00 -0.45 0.00 0.00 34.95 34.36 2dip s ARG 83 CO 0.50 -0.08 1.06 -1.54 -0.68 0.00 0.00 175.30 174.56 2dip s SER 84 N 0.50 6.35 0.73 0.23 1.04 -1.26 -2.25 113.70 119.03 2dip s SER 84 Ca -0.04 -0.25 -0.15 0.00 0.48 0.00 0.00 55.95 55.99 2dip s SER 84 Cb -0.06 -2.49 0.04 0.00 0.10 0.00 0.00 66.02 63.61 2dip s SER 84 CO -0.02 -1.39 1.19 -0.76 0.98 0.00 0.00 173.24 173.24 2dip s LEU 85 N 4.47 3.31 0.19 2.42 1.43 -1.12 -5.03 118.68 124.34 2dip s LEU 85 Ca 0.34 2.29 0.05 0.00 -1.03 0.00 0.00 54.13 55.78 2dip s LEU 85 Cb -0.11 -4.58 -0.04 0.00 0.03 0.00 0.00 46.19 41.50 2dip s LEU 85 CO 0.20 -2.19 0.19 -1.61 0.23 0.00 0.00 176.35 173.17 2dip s GLU 86 N -3.97 3.03 -0.30 1.70 2.02 -1.26 -4.84 118.70 115.07 2dip s GLU 86 Ca 0.73 -0.87 -0.29 0.00 0.02 0.00 0.00 54.97 54.56 2dip s GLU 86 Cb -0.27 -2.69 -0.07 0.00 0.10 0.00 0.00 34.13 31.20 2dip s GLU 86 CO 0.45 0.47 2.26 1.63 0.02 0.00 0.00 175.26 180.09 2dip n LYS 87 N -0.66 1.62 -3.76 1.61 5.02 -1.26 -4.93 118.16 115.80 2dip n LYS 87 Ca -0.08 0.39 -0.26 0.00 -2.02 0.00 0.00 58.31 56.34 2dip n LYS 87 Cb 0.56 -3.12 -0.17 0.00 -0.02 0.00 0.00 35.03 32.27 2dip n LYS 87 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2dip s ARG 88 N 6.73 0.70 -0.19 1.97 6.06 -1.26 -5.12 118.95 127.84 2dip s ARG 88 Ca 1.03 -0.18 0.01 0.00 -2.50 0.00 0.00 55.73 54.09 2dip s ARG 88 Cb -0.41 -1.58 0.03 0.00 0.06 0.00 0.00 34.95 33.06 2dip s ARG 88 CO 0.36 -0.47 -0.15 0.00 -2.50 0.00 0.00 175.30 172.54 2dip s ALA 89 N 1.90 2.19 -0.56 6.12 0.00 -1.26 -5.00 121.76 125.14 2dip s ALA 89 Ca 0.02 -1.23 0.01 0.00 0.00 0.00 0.00 51.96 50.76 2dip s ALA 89 Cb -0.15 -1.24 0.45 0.00 0.00 0.00 0.00 23.12 22.18 2dip s ALA 89 CO -0.07 -0.59 1.75 -0.25 0.00 0.00 0.00 175.76 176.60 2dip n ASP 90 N 4.64 6.77 -4.81 0.00 9.92 -1.26 -4.99 116.55 126.82 2dip n ASP 90 Ca -0.18 -3.78 -0.30 0.00 -0.53 0.00 0.00 54.79 50.01 2dip n ASP 90 Cb 0.48 -0.78 -0.05 0.00 -0.64 0.00 0.00 41.12 40.13 2dip n ASP 90 CO 0.00 0.00 0.00 -1.83 0.13 0.00 0.00 177.20 175.50 2dip s GLU 91 N -3.77 2.21 -0.04 -1.24 4.04 -1.26 -5.13 118.70 113.52 2dip s GLU 91 Ca 0.59 -2.21 -0.01 0.00 0.04 0.00 0.00 54.97 53.39 2dip s GLU 91 Cb 0.47 -1.78 0.03 0.00 0.02 0.00 0.00 34.13 32.87 2dip s GLU 91 CO -0.03 -0.43 0.02 0.14 -1.84 0.00 0.00 175.26 173.13 2dip s VAL 92 N -2.81 0.06 0.02 1.83 -7.23 -1.26 -5.14 120.40 105.87 2dip s VAL 92 Ca 0.20 0.22 -0.11 0.00 -1.81 0.00 0.00 61.98 60.47 2dip s VAL 92 Cb 0.01 -0.23 -0.05 0.00 0.56 0.00 0.00 36.38 36.66 2dip s VAL 92 CO 0.12 0.16 0.37 -0.94 -0.31 0.00 0.00 175.10 174.49 2dip s SER 93 N 1.49 6.68 -0.06 4.85 1.04 -1.26 -5.08 113.70 121.37 2dip s SER 93 Ca -0.03 0.82 -0.18 0.00 0.48 0.00 0.00 55.95 57.04 2dip s SER 93 Cb -0.13 -2.19 -0.05 0.00 0.10 0.00 0.00 66.02 63.75 2dip s SER 93 CO -0.03 0.27 0.49 -0.83 0.98 0.00 0.00 173.24 174.12 2dip s GLY 94 N -1.40 2.47 0.28 7.32 0.00 -1.26 -4.98 107.32 109.76 2dip s GLY 94 Ca 0.27 -0.14 0.07 0.00 0.00 0.00 0.00 44.72 44.92 2dip s GLY 94 CO 0.15 0.62 1.67 -0.56 0.00 0.00 0.00 173.10 174.97 2dip h PRO 95 N 5.96 0.22 -4.91 2.90 0.13 -2.09 -3.44 132.00 130.77 2dip h PRO 95 Ca -0.45 -0.11 -0.39 0.00 -0.87 0.00 0.00 66.00 64.18 2dip h PRO 95 Cb 1.19 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.07 2dip h PRO 95 CO 0.71 0.64 -0.78 -1.54 -0.23 0.00 0.00 178.00 176.80 2dip s SER 96 N -6.88 1.24 -0.57 1.44 1.04 -1.26 -5.11 113.70 103.60 2dip s SER 96 Ca -0.04 -0.34 -0.18 0.00 0.48 0.00 0.00 55.95 55.86 2dip s SER 96 Cb 0.13 -0.08 0.10 0.00 0.10 0.00 0.00 66.02 66.27 2dip s SER 96 CO 0.77 0.02 0.65 -0.44 0.98 0.00 0.00 173.24 175.23 2dip s SER 97 N -0.81 6.19 0.00 7.02 0.01 -1.26 -5.24 113.70 119.61 2dip s SER 97 Ca 0.00 -1.41 0.00 0.00 1.31 0.00 0.00 55.95 55.85 2dip s SER 97 Cb -0.06 -2.28 0.00 0.00 0.21 0.00 0.00 66.02 63.88 2dip s SER 97 CO 0.00 -1.03 0.12 0.61 0.41 0.00 0.00 173.24 173.35