#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 2.10 0.40 1.61 0.15 -1.26 -5.14 113.70 111.56 2dip s SER 2 Ca 0.00 -0.35 0.04 0.00 0.70 0.00 0.00 55.95 56.34 2dip s SER 2 Cb 0.00 -0.94 -0.03 0.00 -1.71 0.00 0.00 66.02 63.34 2dip s SER 2 CO 0.00 0.02 0.12 -0.44 1.20 0.00 0.00 173.24 174.14 2dip s SER 3 N 0.88 2.73 0.00 5.45 0.01 -1.26 -5.16 113.70 116.35 2dip s SER 3 Ca -0.10 -1.65 0.00 0.00 1.31 0.00 0.00 55.95 55.51 2dip s SER 3 Cb -0.15 0.46 0.00 0.00 0.21 0.00 0.00 66.02 66.54 2dip s SER 3 CO 0.01 -0.91 0.00 0.61 0.41 0.00 0.00 173.24 173.36 2dip n GLY 4 N -0.89 3.77 3.60 3.44 0.00 -1.26 -5.20 105.19 108.66 2dip n GLY 4 Ca -0.06 -0.34 -0.12 0.00 0.00 0.00 0.00 46.02 45.50 2dip n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dip s SER 5 N 1.91 0.52 0.15 1.61 1.04 -1.26 -5.19 113.70 112.48 2dip s SER 5 Ca 0.00 -1.31 -0.16 0.00 0.48 0.00 0.00 55.95 54.96 2dip s SER 5 Cb 0.00 0.71 0.03 0.00 0.10 0.00 0.00 66.02 66.86 2dip s SER 5 CO 0.00 -1.40 0.44 -0.94 0.98 0.00 0.00 173.24 172.32 2dip s SER 6 N -3.16 -0.23 0.00 7.02 1.04 -1.26 -5.18 113.70 111.93 2dip s SER 6 Ca 0.25 -0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.28 2dip s SER 6 Cb -0.02 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.61 2dip s SER 6 CO 0.16 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 174.07 2dip n GLY 7 N -0.27 0.67 3.62 7.32 0.00 -1.26 -5.12 105.19 110.15 2dip n GLY 7 Ca -0.13 -1.57 -0.29 0.00 0.00 0.00 0.00 46.02 44.03 2dip n GLY 7 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2dip s LEU 8 N 0.00 2.07 0.33 0.99 0.05 -1.26 -5.17 118.68 115.68 2dip s LEU 8 Ca 0.00 -1.72 0.04 0.00 0.05 0.00 0.00 54.13 52.50 2dip s LEU 8 Cb 0.00 -0.29 -0.07 0.00 -2.05 0.00 0.00 46.19 43.78 2dip s LEU 8 CO 0.00 -0.96 0.05 -1.83 -0.55 0.00 0.00 176.35 173.06 2dip s GLU 9 N -3.74 1.68 0.07 1.48 -1.05 -1.26 -5.15 118.70 110.71 2dip s GLU 9 Ca 0.15 -1.93 -0.00 0.00 -0.15 0.00 0.00 54.97 53.04 2dip s GLU 9 Cb 0.01 -0.94 -0.04 0.00 -0.44 0.00 0.00 34.13 32.72 2dip s GLU 9 CO 0.10 -0.17 0.22 -2.00 0.95 0.00 0.00 175.26 174.36 2dip s GLU 10 N -3.87 3.45 1.21 -4.83 2.12 -1.26 -5.10 118.70 110.42 2dip s GLU 10 Ca 0.36 -0.42 -0.19 0.00 0.36 0.00 0.00 54.97 55.08 2dip s GLU 10 Cb 0.09 -3.03 0.29 0.00 0.26 0.00 0.00 34.13 31.74 2dip s GLU 10 CO 0.16 0.60 1.09 -0.59 -0.54 0.00 0.00 175.26 175.98 2dip s PHE 11 N -1.52 0.47 0.34 5.30 -0.12 -1.26 -5.06 117.98 116.11 2dip s PHE 11 Ca 0.35 0.53 0.07 0.00 -0.05 0.00 0.00 56.93 57.84 2dip s PHE 11 Cb -0.13 -3.39 -0.02 0.00 -0.63 0.00 0.00 43.02 38.85 2dip s PHE 11 CO 0.28 -3.94 0.33 0.15 -0.05 0.00 0.00 175.22 171.99 2dip s LYS 12 N -5.34 2.82 1.22 1.99 -0.14 -1.26 -5.12 119.74 113.91 2dip s LYS 12 Ca 0.70 -1.23 -0.17 0.00 -1.36 0.00 0.00 55.97 53.91 2dip s LYS 12 Cb -0.11 -2.56 0.29 0.00 -1.68 0.00 0.00 37.83 33.78 2dip s LYS 12 CO 0.56 0.09 1.04 -0.80 -0.76 0.00 0.00 175.35 175.48 2dip s ASN 13 N -4.04 0.69 0.51 2.83 0.01 -1.26 -5.07 114.94 108.61 2dip s ASN 13 Ca 0.42 0.97 0.02 0.00 -0.71 0.00 0.00 52.86 53.56 2dip s ASN 13 Cb -0.07 -1.45 -0.01 0.00 0.41 0.00 0.00 41.25 40.13 2dip s ASN 13 CO 0.28 -4.30 0.04 -0.44 -1.51 0.00 0.00 177.10 171.16 2dip s SER 14 N -3.32 4.18 1.24 -1.22 0.01 -1.26 -5.14 113.70 108.20 2dip s SER 14 Ca 0.69 -1.62 -0.17 0.00 1.31 0.00 0.00 55.95 56.16 2dip s SER 14 Cb -0.16 0.51 0.30 0.00 0.21 0.00 0.00 66.02 66.89 2dip s SER 14 CO 0.59 -0.88 1.01 -0.55 0.41 0.00 0.00 173.24 173.82 2dip s SER 15 N -3.92 0.47 0.49 2.44 0.15 -1.26 -5.06 113.70 107.01 2dip s SER 15 Ca 0.08 1.11 0.07 0.00 0.70 0.00 0.00 55.95 57.92 2dip s SER 15 Cb 0.01 -1.68 0.02 0.00 -1.71 0.00 0.00 66.02 62.66 2dip s SER 15 CO 0.05 -4.46 0.46 -0.54 1.20 0.00 0.00 173.24 169.95 2dip s LYS 16 N -4.85 2.40 0.18 5.44 -0.14 -1.26 -5.15 119.74 116.36 2dip s LYS 16 Ca 0.68 -1.72 0.05 0.00 -1.36 0.00 0.00 55.97 53.63 2dip s LYS 16 Cb -0.18 -2.33 -0.05 0.00 -1.68 0.00 0.00 37.83 33.59 2dip s LYS 16 CO 0.60 -0.46 -0.10 -0.48 -0.76 0.00 0.00 175.35 174.15 2dip s LEU 17 N -4.28 2.49 0.03 3.17 2.34 -1.26 -5.16 118.68 116.01 2dip s LEU 17 Ca 0.46 -1.05 0.05 0.00 0.06 0.00 0.00 54.13 53.64 2dip s LEU 17 Cb -0.03 -0.44 -0.02 0.00 -0.56 0.00 0.00 46.19 45.14 2dip s LEU 17 CO 0.28 -0.31 -0.14 -0.69 -1.06 0.00 0.00 176.35 174.43 2dip s VAL 18 N -3.23 1.08 0.36 1.48 1.01 -1.26 -5.16 120.40 114.68 2dip s VAL 18 Ca 0.20 -0.89 0.08 0.00 0.00 0.00 0.00 61.98 61.37 2dip s VAL 18 Cb 0.02 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 2dip s VAL 18 CO 0.04 0.07 0.15 0.00 0.00 0.00 0.00 175.10 175.36 2dip s ALA 19 N -0.72 3.52 0.09 5.51 0.00 -1.26 -5.14 121.76 123.75 2dip s ALA 19 Ca 0.02 -1.89 0.07 0.00 0.00 0.00 0.00 51.96 50.16 2dip s ALA 19 Cb -0.07 -0.66 -0.04 0.00 0.00 0.00 0.00 23.12 22.35 2dip s ALA 19 CO 0.01 -0.01 -0.13 0.00 0.00 0.00 0.00 175.76 175.62 2dip s ALA 20 N -2.47 2.83 0.06 0.00 0.00 -1.26 -5.12 121.76 115.80 2dip s ALA 20 Ca 0.39 -1.24 -0.20 0.00 0.00 0.00 0.00 51.96 50.90 2dip s ALA 20 Cb -0.01 -0.83 -0.06 0.00 0.00 0.00 0.00 23.12 22.22 2dip s ALA 20 CO 0.23 0.62 0.60 0.00 0.00 0.00 0.00 175.76 177.21 2dip s ALA 21 N -1.13 3.53 0.10 0.00 0.00 -1.26 -5.08 121.76 117.93 2dip s ALA 21 Ca 0.19 0.07 0.01 0.00 0.00 0.00 0.00 51.96 52.23 2dip s ALA 21 Cb -0.11 -2.71 -0.04 0.00 0.00 0.00 0.00 23.12 20.26 2dip s ALA 21 CO 0.11 0.30 -0.03 -1.83 0.00 0.00 0.00 175.76 174.31 2dip s GLU 22 N -0.77 0.82 -0.35 0.00 1.03 -1.26 -5.09 118.70 113.08 2dip s GLU 22 Ca 0.31 -1.35 -0.41 0.00 0.03 0.00 0.00 54.97 53.55 2dip s GLU 22 Cb -0.19 -0.03 -0.16 0.00 -0.80 0.00 0.00 34.13 32.95 2dip s GLU 22 CO 0.19 -0.10 1.82 1.63 -1.33 0.00 0.00 175.26 177.48 2dip n LYS 23 N -0.04 0.85 -3.92 -4.83 4.76 -1.26 -4.91 118.16 108.81 2dip n LYS 23 Ca -0.11 0.30 -0.33 0.00 -2.87 0.00 0.00 58.31 55.30 2dip n LYS 23 Cb 0.62 -2.00 -0.14 0.00 -1.84 0.00 0.00 35.03 31.67 2dip n LYS 23 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 2dip s GLU 24 N 4.07 1.70 -0.19 1.97 2.12 -1.26 -5.05 118.70 122.05 2dip s GLU 24 Ca 1.03 -1.88 -0.04 0.00 0.36 0.00 0.00 54.97 54.45 2dip s GLU 24 Cb -1.15 -3.36 0.06 0.00 0.26 0.00 0.00 34.13 29.94 2dip s GLU 24 CO 0.66 -1.00 0.07 1.03 -0.54 0.00 0.00 175.26 175.49 2dip s ARG 25 N 0.96 0.35 0.00 4.30 0.52 -1.26 -3.86 118.95 119.96 2dip s ARG 25 Ca 0.10 -0.30 -0.02 0.00 -0.52 0.00 0.00 55.73 55.00 2dip s ARG 25 Cb -0.21 -1.92 -0.01 0.00 0.52 0.00 0.00 34.95 33.34 2dip s ARG 25 CO -0.06 -0.69 -0.03 -0.11 0.02 0.00 0.00 175.30 174.42 2dip n LEU 26 N 5.16 0.40 -4.74 2.53 0.00 -1.26 -5.04 117.00 114.05 2dip n LEU 26 Ca -0.08 0.06 -0.38 0.00 0.00 0.00 0.00 56.01 55.61 2dip n LEU 26 Cb 0.47 -0.25 0.05 0.00 0.00 0.00 0.00 43.42 43.70 2dip n LEU 26 CO 0.11 -0.53 0.96 0.47 0.00 0.00 0.00 177.39 178.40 2dip n ASP 27 N -2.88 2.49 -1.37 1.96 9.92 -1.26 -4.86 116.55 120.55 2dip n ASP 27 Ca -0.01 0.93 -0.05 0.00 -0.53 0.00 0.00 54.79 55.13 2dip n ASP 27 Cb 0.05 -1.57 0.02 0.00 -0.64 0.00 0.00 41.12 38.98 2dip n ASP 27 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 2dip n LYS 28 N -1.30 1.24 -3.58 -1.24 4.81 -1.26 -4.55 118.16 112.29 2dip n LYS 28 Ca 0.12 -0.53 -0.29 0.00 -0.87 0.00 0.00 58.31 56.74 2dip n LYS 28 Cb 0.46 -1.21 -0.12 0.00 0.02 0.00 0.00 35.03 34.18 2dip n LYS 28 CO 0.00 0.00 0.00 -1.58 1.17 0.00 0.00 177.40 176.99 2dip s HIS 29 N -0.59 1.35 0.14 5.64 2.46 -1.26 -4.98 115.29 118.04 2dip s HIS 29 Ca 0.10 -2.04 -0.12 0.00 0.47 0.00 0.00 55.06 53.47 2dip s HIS 29 Cb 0.08 -1.38 -0.01 0.00 -0.13 0.00 0.00 32.58 31.15 2dip s HIS 29 CO 0.01 -0.80 1.56 -0.07 -2.47 0.00 0.00 174.74 172.96 2dip h LEU 30 N 6.81 0.87 0.00 8.88 -0.00 -1.96 -3.39 115.31 126.51 2dip h LEU 30 Ca 0.04 -0.36 0.00 0.00 -0.00 0.00 0.00 57.88 57.56 2dip h LEU 30 Cb 0.95 -0.24 0.00 0.00 -0.00 0.00 0.00 40.66 41.37 2dip h LEU 30 CO 0.37 1.02 0.00 0.61 -0.00 0.00 0.00 178.44 180.44 2dip n GLY 31 N -0.23 1.34 3.03 0.83 0.00 -1.26 -4.46 105.19 104.45 2dip n GLY 31 Ca -0.00 0.26 -0.13 0.00 0.00 0.00 0.00 46.02 46.15 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 0.71 -0.61 1.01 -1.26 -5.11 121.20 115.92 2dip s ILE 32 Ca 0.00 0.04 -0.13 0.00 0.00 0.00 0.00 60.65 60.56 2dip s ILE 32 Cb 0.00 -0.26 0.03 0.00 0.01 0.00 0.00 42.46 42.24 2dip s ILE 32 CO 0.00 0.02 1.10 -2.16 0.00 0.00 0.00 174.94 173.90 2dip s PRO 33 N 0.35 2.56 0.64 2.79 0.04 -1.26 -4.68 135.00 135.43 2dip s PRO 33 Ca -0.02 1.29 -0.15 0.00 0.04 0.00 0.00 61.00 62.16 2dip s PRO 33 Cb -0.03 -1.93 -0.01 0.00 0.04 0.00 0.00 34.50 32.57 2dip s PRO 33 CO -0.01 -1.43 1.08 0.00 0.04 0.00 0.00 177.00 176.68 2dip n ASN 35 N -2.36 0.39 0.00 0.00 4.13 0.35 -3.32 115.26 114.44 2dip n ASN 35 Ca 0.09 0.17 0.00 0.00 1.68 0.00 0.00 54.58 56.52 2dip n ASN 35 Cb 0.52 0.92 0.00 0.00 -1.54 0.00 0.00 39.78 39.68 2dip n ASN 35 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2dip n ASN 36 N -2.66 0.00 0.17 6.41 5.15 -1.26 -4.57 115.26 118.50 2dip n ASN 36 Ca -0.14 0.14 0.04 0.00 -0.60 0.00 0.00 54.58 54.02 2dip n ASN 36 Cb 0.84 -0.27 0.29 0.00 -0.53 0.00 0.00 39.78 40.11 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 -3.62 -4.45 -2.79 0.00 4.76 -1.21 -4.98 118.16 105.87 2dip n LYS 38 Ca -0.01 0.50 -0.42 0.00 -2.87 0.00 0.00 58.31 55.52 2dip n LYS 38 Cb 0.53 -4.53 -0.03 0.00 -1.84 0.00 0.00 35.03 29.16 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 -5.38 4.30 -0.12 1.97 0.74 -1.26 -4.70 119.66 115.21 2dip s GLN 39 Ca 0.20 1.17 -0.05 0.00 0.05 0.00 0.00 55.36 56.74 2dip s GLN 39 Cb -0.09 -3.59 0.06 0.00 1.10 0.00 0.00 33.01 30.49 2dip s GLN 39 CO 0.44 -0.43 0.26 0.12 -0.55 0.00 0.00 175.29 175.13 2dip s PHE 40 N 2.49 -0.40 0.99 1.67 5.36 -1.26 -3.03 117.98 123.80 2dip s PHE 40 Ca 0.41 0.93 -0.12 0.00 -0.96 0.00 0.00 56.93 57.19 2dip s PHE 40 Cb -0.16 -0.00 0.18 0.00 -0.34 0.00 0.00 43.02 42.70 2dip s PHE 40 CO 0.11 -0.32 1.09 -1.25 -1.46 0.00 0.00 175.22 173.40 2dip s PRO 41 N 2.03 0.50 -0.35 10.12 0.04 -1.25 -4.80 135.00 141.28 2dip s PRO 41 Ca -0.02 0.55 -0.17 0.00 0.04 0.00 0.00 61.00 61.39 2dip s PRO 41 Cb -0.11 -1.74 -0.00 0.00 0.04 0.00 0.00 34.50 32.68 2dip s PRO 41 CO -0.09 -2.69 0.45 0.42 0.04 0.00 0.00 177.00 175.13 2dip s ILE 42 N -2.96 5.08 -0.04 0.56 1.01 -1.24 -4.97 121.20 118.64 2dip s ILE 42 Ca 0.65 0.17 -0.19 0.00 0.00 0.00 0.00 60.65 61.28 2dip s ILE 42 Cb -0.19 -3.92 -0.13 0.00 0.01 0.00 0.00 42.46 38.24 2dip s ILE 42 CO 0.58 -0.19 0.80 -0.33 0.00 0.00 0.00 174.94 175.79 2dip h GLU 43 N 8.49 -0.34 -6.88 2.79 5.08 -1.93 -3.46 114.58 118.33 2dip h GLU 43 Ca -0.28 0.02 -0.37 0.00 -1.00 0.00 0.00 59.36 57.73 2dip h GLU 43 Cb 1.13 0.08 0.21 0.00 0.50 0.00 0.00 28.75 30.67 2dip h GLU 43 CO 0.75 -0.02 -0.17 0.41 -1.00 0.00 0.00 179.01 178.97 2dip n GLY 44 N 0.46 -3.45 2.40 -3.84 0.00 -1.26 -4.96 105.19 94.54 2dip n GLY 44 Ca -0.07 -1.52 -0.12 0.00 0.00 0.00 0.00 46.02 44.30 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 -5.24 -1.14 -3.97 1.61 4.76 -1.26 -4.70 118.16 108.21 2dip n LYS 45 Ca 0.11 -0.59 -0.32 0.00 -2.87 0.00 0.00 58.31 54.64 2dip n LYS 45 Cb 0.57 -1.17 -0.14 0.00 -1.84 0.00 0.00 35.03 32.44 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 0.96 3.48 -0.24 0.00 1.51 -0.58 -2.44 117.35 120.03 2dip s TYR 47 Ca 0.10 0.47 -0.15 0.00 -1.01 0.00 0.00 57.07 56.48 2dip s TYR 47 Cb -0.20 -1.96 0.07 0.00 -0.11 0.00 0.00 41.96 39.76 2dip s TYR 47 CO -0.07 0.30 0.59 0.21 -1.11 0.00 0.00 175.55 175.47 2dip s LYS 48 N -3.39 0.62 -0.30 -0.62 2.20 -0.89 -2.00 119.74 115.35 2dip s LYS 48 Ca 0.41 1.02 -0.29 0.00 -0.36 0.00 0.00 55.97 56.75 2dip s LYS 48 Cb -0.11 0.14 0.01 0.00 -1.51 0.00 0.00 37.83 36.35 2dip s LYS 48 CO 0.29 -0.14 1.23 0.00 -0.36 0.00 0.00 175.35 176.37 2dip n THR 50 N 6.09 0.00 -0.03 0.00 -2.24 0.53 -3.26 114.28 115.38 2dip n THR 50 Ca 0.14 -0.02 -0.01 0.00 -2.27 0.00 0.00 64.05 61.89 2dip n THR 50 Cb 0.47 -0.39 -0.08 0.00 -2.10 0.00 0.00 70.33 68.23 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 -0.87 1.48 -1.74 -0.78 1.02 -1.26 -5.00 120.64 113.49 2dip n GLU 51 Ca 0.22 -0.05 -0.08 0.00 -0.02 0.00 0.00 57.16 57.23 2dip n GLU 51 Cb 0.12 -1.27 0.03 0.00 -0.02 0.00 0.00 31.44 30.31 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 -0.59 2.65 -1.64 0.00 -1.09 -1.26 -4.69 121.20 114.58 2dip s ILE 53 Ca 0.25 -0.93 -0.12 0.00 -2.23 0.00 0.00 60.65 57.63 2dip s ILE 53 Cb -0.02 -2.01 0.12 0.00 -1.58 0.00 0.00 42.46 38.97 2dip s ILE 53 CO 0.16 0.55 0.30 -1.84 -1.23 0.00 0.00 174.94 172.89 2dip n GLU 54 N 2.25 -0.83 -4.56 2.79 0.28 -1.26 -4.90 120.64 114.42 2dip n GLU 54 Ca -0.17 0.11 -0.33 0.00 -0.16 0.00 0.00 57.16 56.61 2dip n GLU 54 Cb 0.52 -3.97 -0.14 0.00 1.43 0.00 0.00 31.44 29.28 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 -3.70 2.88 -0.13 -1.84 6.14 -1.26 -5.03 117.35 114.41 2dip s TYR 55 Ca 0.42 -0.62 -0.10 0.00 0.64 0.00 0.00 57.07 57.41 2dip s TYR 55 Cb -0.25 -1.91 0.04 0.00 0.42 0.00 0.00 41.96 40.27 2dip s TYR 55 CO 0.97 -0.22 0.34 -1.01 0.64 0.00 0.00 175.55 176.26 2dip s HIS 56 N 0.52 -0.42 0.37 4.97 3.76 -1.26 -2.12 115.29 121.10 2dip s HIS 56 Ca -0.07 0.99 0.05 0.00 -0.15 0.00 0.00 55.06 55.87 2dip s HIS 56 Cb -0.15 0.15 -0.06 0.00 1.11 0.00 0.00 32.58 33.62 2dip s HIS 56 CO 0.04 -0.23 0.05 -0.51 -0.85 0.00 0.00 174.74 173.23 2dip s LEU 57 N 0.65 2.38 -0.02 0.89 1.43 -0.85 -0.50 118.68 122.67 2dip s LEU 57 Ca -0.04 -1.41 0.03 0.00 -1.03 0.00 0.00 54.13 51.68 2dip s LEU 57 Cb -0.05 -0.54 -0.03 0.00 0.03 0.00 0.00 46.19 45.60 2dip s LEU 57 CO -0.04 -0.60 -0.07 0.00 0.23 0.00 0.00 176.35 175.87 2dip n GLN 59 N 1.80 -0.04 0.27 0.00 -0.06 -1.25 0.02 117.38 118.11 2dip n GLN 59 Ca -0.16 1.00 -0.11 0.00 -2.00 0.00 0.00 57.00 55.72 2dip n GLN 59 Cb 0.53 -1.85 -0.06 0.00 -4.06 0.00 0.00 30.24 24.80 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 -0.70 -0.70 3.69 4.81 -1.94 -2.47 114.58 117.28 2dip h GLU 60 Ca 0.64 0.05 0.11 0.00 -0.13 0.00 0.00 59.36 60.03 2dip h GLU 60 Cb 1.83 0.16 -0.08 0.00 0.63 0.00 0.00 28.75 31.29 2dip h GLU 60 CO -0.50 -0.46 0.32 0.00 -0.73 0.00 0.00 179.01 177.63 2dip h PHE 62 N 0.53 0.54 -0.45 0.00 3.57 -1.08 0.65 116.94 120.69 2dip h PHE 62 Ca 0.36 0.04 0.13 0.00 3.53 0.00 0.00 57.97 62.03 2dip h PHE 62 Cb 0.44 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 2dip h PHE 62 CO -0.13 -0.07 0.37 0.22 -2.23 0.00 0.00 178.31 176.47 2dip h ASP 63 N 0.36 0.00 0.41 0.41 1.82 -0.75 0.31 116.42 118.97 2dip h ASP 63 Ca 0.52 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.16 2dip h ASP 63 Cb 0.98 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.99 2dip h ASP 63 CO -0.53 0.00 0.00 -1.28 -1.61 0.00 0.00 179.24 175.82 2dip h SER 64 N 0.00 0.00 -5.60 2.28 0.87 0.27 -3.46 113.55 107.91 2dip h SER 64 Ca 0.21 0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.47 2dip h SER 64 Cb 0.95 0.00 0.17 0.00 -0.44 0.00 0.00 62.40 63.08 2dip h SER 64 CO -0.00 0.00 -0.81 -1.22 -0.53 0.00 0.00 176.83 174.27 2dip n TYR 65 N -2.87 -2.27 -0.02 2.24 4.01 0.11 -4.98 117.16 113.38 2dip n TYR 65 Ca -0.01 0.90 -0.02 0.00 -0.16 0.00 0.00 57.90 58.61 2dip n TYR 65 Cb 0.16 -4.70 -0.01 0.00 -0.31 0.00 0.00 39.34 34.48 2dip n TYR 65 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2dip n HIS 67 N -3.00 0.24 0.24 0.00 -0.00 -1.26 -4.14 115.22 107.30 2dip n HIS 67 Ca -0.03 0.07 0.06 0.00 -0.00 0.00 0.00 57.72 57.82 2dip n HIS 67 Cb 0.12 -0.40 0.34 0.00 -0.00 0.00 0.00 29.99 30.05 2dip n HIS 67 CO 0.00 0.00 0.00 1.37 -0.00 0.00 0.00 176.34 177.71 2dip h LEU 68 N 0.00 0.00 -0.74 0.27 -0.00 -1.87 -0.15 115.31 112.82 2dip h LEU 68 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 57.88 58.00 2dip h LEU 68 Cb 0.65 0.00 -0.08 0.00 -0.00 0.00 0.00 40.66 41.23 2dip h LEU 68 CO 0.00 0.00 0.34 0.28 -0.00 0.00 0.00 178.44 179.06 2dip h SER 69 N 0.00 0.40 -4.09 0.17 0.02 -1.86 -3.43 113.55 104.76 2dip h SER 69 Ca 0.00 0.08 -0.45 0.00 -0.84 0.00 0.00 61.79 60.58 2dip h SER 69 Cb 1.07 0.02 0.15 0.00 0.14 0.00 0.00 62.40 63.78 2dip h SER 69 CO 0.00 0.20 0.31 -1.00 -1.14 0.00 0.00 176.83 175.20 2dip s HIS 70 N -6.03 1.98 -0.65 3.45 3.76 -0.07 -4.95 115.29 112.78 2dip s HIS 70 Ca -0.12 0.66 -0.27 0.00 -0.15 0.00 0.00 55.06 55.17 2dip s HIS 70 Cb 0.19 -3.58 0.01 0.00 1.11 0.00 0.00 32.58 30.32 2dip s HIS 70 CO 0.76 -2.65 1.45 0.99 -0.85 0.00 0.00 174.74 174.45 2dip s THR 71 N -3.40 3.66 0.31 1.30 2.01 -1.26 -4.98 115.64 113.28 2dip s THR 71 Ca 0.67 0.46 0.07 0.00 0.31 0.00 0.00 61.69 63.20 2dip s THR 71 Cb -0.11 -4.54 -0.03 0.00 0.01 0.00 0.00 72.50 67.84 2dip s THR 71 CO 0.53 -1.41 0.30 -0.36 -0.69 0.00 0.00 174.62 172.99 2dip s PHE 72 N 6.59 3.02 -0.05 4.92 0.40 -1.26 -0.34 117.98 131.25 2dip s PHE 72 Ca 0.48 -0.22 -0.07 0.00 -0.60 0.00 0.00 56.93 56.52 2dip s PHE 72 Cb -0.10 -1.71 0.01 0.00 0.51 0.00 0.00 43.02 41.74 2dip s PHE 72 CO 0.20 0.26 0.18 0.95 0.70 0.00 0.00 175.22 177.50 2dip s THR 73 N -2.22 0.02 0.18 0.64 -4.23 -0.91 -3.38 115.64 105.73 2dip s THR 73 Ca 0.39 -0.16 0.06 0.00 -1.18 0.00 0.00 61.69 60.80 2dip s THR 73 Cb -0.07 -0.31 -0.04 0.00 1.34 0.00 0.00 72.50 73.42 2dip s THR 73 CO 0.27 -0.09 0.08 0.72 -0.54 0.00 0.00 174.62 175.06 2dip s PHE 74 N -0.26 3.02 0.44 3.99 -0.12 -1.11 -2.10 117.98 121.82 2dip s PHE 74 Ca -0.04 -0.07 0.07 0.00 -0.05 0.00 0.00 56.93 56.84 2dip s PHE 74 Cb -0.03 -1.44 -0.02 0.00 -0.63 0.00 0.00 43.02 40.90 2dip s PHE 74 CO 0.01 0.52 0.32 1.03 -0.05 0.00 0.00 175.22 177.05 2dip s ARG 75 N -3.10 2.38 0.22 1.99 1.81 -1.02 -1.51 118.95 119.71 2dip s ARG 75 Ca 0.30 -1.73 0.02 0.00 -1.72 0.00 0.00 55.73 52.60 2dip s ARG 75 Cb -0.09 -2.20 -0.05 0.00 -0.45 0.00 0.00 34.95 32.16 2dip s ARG 75 CO 0.22 -0.25 0.05 -1.21 -0.68 0.00 0.00 175.30 173.43 2dip s GLU 76 N -4.09 1.29 1.02 3.54 2.02 -1.26 -4.55 118.70 116.67 2dip s GLU 76 Ca 0.43 -1.67 -0.17 0.00 0.02 0.00 0.00 54.97 53.58 2dip s GLU 76 Cb -0.01 -0.29 -0.01 0.00 0.10 0.00 0.00 34.13 33.93 2dip s GLU 76 CO 0.25 -0.22 -0.18 0.36 0.02 0.00 0.00 175.26 175.50 2dip n LYS 77 N -0.38 -0.60 -0.93 1.61 -0.00 -1.26 -4.66 118.16 111.95 2dip n LYS 77 Ca -0.03 -0.15 -0.34 0.00 -0.00 0.00 0.00 58.31 57.79 2dip n LYS 77 Cb 0.65 -1.55 0.04 0.00 -0.00 0.00 0.00 35.03 34.17 2dip n LYS 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2dip n ARG 78 N -0.54 0.00 -3.27 -1.58 3.00 -1.26 -3.04 116.66 109.97 2dip n ARG 78 Ca 0.02 0.00 -0.20 0.00 -0.01 0.00 0.00 57.85 57.66 2dip n ARG 78 Cb 0.59 -0.93 0.06 0.00 0.00 0.00 0.00 32.46 32.18 2dip n ARG 78 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2dip n ASN 79 N 3.26 -5.74 -2.38 0.55 4.13 -1.26 -4.99 115.26 108.82 2dip n ASN 79 Ca -0.02 -0.40 -0.11 0.00 1.68 0.00 0.00 54.58 55.74 2dip n ASN 79 Cb 0.52 -4.43 -0.04 0.00 -1.54 0.00 0.00 39.78 34.30 2dip n ASN 79 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2dip n GLN 80 N -4.15 0.37 -3.74 3.52 1.13 -1.17 -5.13 117.38 108.20 2dip n GLN 80 Ca -0.03 -2.00 -0.10 0.00 -1.94 0.00 0.00 57.00 52.94 2dip n GLN 80 Cb 0.57 1.77 -0.06 0.00 0.11 0.00 0.00 30.24 32.64 2dip n GLN 80 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2dip s LYS 81 N -2.70 0.95 1.03 -1.09 -0.14 -1.26 -4.93 119.74 111.59 2dip s LYS 81 Ca 0.22 -0.80 -0.23 0.00 -1.36 0.00 0.00 55.97 53.80 2dip s LYS 81 Cb 0.00 0.40 -0.06 0.00 -1.68 0.00 0.00 37.83 36.50 2dip s LYS 81 CO 0.16 -0.34 -0.83 0.91 -0.76 0.00 0.00 175.35 174.49 2dip n TRP 82 N -0.08 -1.38 -3.71 3.18 7.02 -1.26 -4.51 117.44 116.70 2dip n TRP 82 Ca -0.16 0.44 -0.11 0.00 -1.02 0.00 0.00 57.50 56.65 2dip n TRP 82 Cb 0.63 -1.45 -0.11 0.00 -2.42 0.00 0.00 31.31 27.96 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 -2.61 0.41 -0.11 -0.99 0.52 -0.57 -4.96 118.95 110.63 2dip s ARG 83 Ca 0.42 0.72 -0.30 0.00 -0.52 0.00 0.00 55.73 56.06 2dip s ARG 83 Cb 0.01 0.04 -0.03 0.00 0.52 0.00 0.00 34.95 35.49 2dip s ARG 83 CO 0.62 -0.13 1.30 -1.54 0.02 0.00 0.00 175.30 175.57 2dip s SER 84 N 1.09 6.94 0.43 0.23 1.04 -1.26 -2.77 113.70 119.40 2dip s SER 84 Ca -0.07 1.82 -0.23 0.00 0.48 0.00 0.00 55.95 57.95 2dip s SER 84 Cb -0.07 -2.55 -0.08 0.00 0.10 0.00 0.00 66.02 63.42 2dip s SER 84 CO -0.09 -0.73 1.08 -0.76 0.98 0.00 0.00 173.24 173.73 2dip s LEU 85 N 3.09 4.06 0.22 2.42 1.43 -1.22 -4.98 118.68 123.70 2dip s LEU 85 Ca 0.58 2.10 -0.30 0.00 -1.03 0.00 0.00 54.13 55.48 2dip s LEU 85 Cb -0.25 -4.26 -0.09 0.00 0.03 0.00 0.00 46.19 41.62 2dip s LEU 85 CO 0.19 -0.66 1.39 -1.61 0.23 0.00 0.00 176.35 175.88 2dip s GLU 86 N -2.66 4.32 -0.30 1.70 8.01 -1.26 -4.87 118.70 123.63 2dip s GLU 86 Ca 0.61 2.19 -0.36 0.00 0.01 0.00 0.00 54.97 57.42 2dip s GLU 86 Cb -0.23 -3.15 -0.12 0.00 -4.31 0.00 0.00 34.13 26.32 2dip s GLU 86 CO 0.29 -0.35 2.08 1.63 0.01 0.00 0.00 175.26 178.92 2dip n LYS 87 N 2.54 1.23 -3.46 1.61 4.76 -1.26 -4.92 118.16 118.66 2dip n LYS 87 Ca 0.07 0.38 -0.16 0.00 -2.87 0.00 0.00 58.31 55.72 2dip n LYS 87 Cb 0.41 -2.43 -0.12 0.00 -1.84 0.00 0.00 35.03 31.06 2dip n LYS 87 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2dip s ARG 88 N 5.53 0.23 -0.11 1.97 0.52 -1.26 -5.05 118.95 120.78 2dip s ARG 88 Ca 1.06 0.30 -0.06 0.00 -0.52 0.00 0.00 55.73 56.51 2dip s ARG 88 Cb -0.87 -0.99 -0.02 0.00 0.52 0.00 0.00 34.95 33.59 2dip s ARG 88 CO 0.52 -0.64 -0.12 0.00 0.02 0.00 0.00 175.30 175.08 2dip h ALA 89 N 8.28 0.00 -6.80 2.13 0.00 -1.92 -3.44 119.26 117.51 2dip h ALA 89 Ca -0.18 -0.36 -0.56 0.00 0.00 0.00 0.00 54.91 53.82 2dip h ALA 89 Cb 1.15 0.33 -0.20 0.00 0.00 0.00 0.00 17.79 19.07 2dip h ALA 89 CO 0.27 0.33 -0.87 -0.25 0.00 0.00 0.00 179.25 178.73 2dip n ASP 90 N -4.29 -2.01 -4.20 0.00 9.92 -1.26 -4.90 116.55 109.81 2dip n ASP 90 Ca -0.05 -1.07 -0.28 0.00 -0.53 0.00 0.00 54.79 52.86 2dip n ASP 90 Cb 0.17 -2.53 -0.16 0.00 -0.64 0.00 0.00 41.12 37.96 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 -6.95 2.04 0.14 -1.24 -1.05 -1.26 -5.03 118.70 105.35 2dip s GLU 91 Ca 0.52 -0.74 -0.08 0.00 -0.15 0.00 0.00 54.97 54.52 2dip s GLU 91 Cb -0.29 -1.78 -0.06 0.00 -0.44 0.00 0.00 34.13 31.56 2dip s GLU 91 CO 0.94 0.33 0.43 0.08 0.95 0.00 0.00 175.26 177.99 2dip s VAL 92 N -0.12 5.07 0.57 1.83 1.01 -1.26 -5.05 120.40 122.44 2dip s VAL 92 Ca -0.02 0.32 -0.20 0.00 0.00 0.00 0.00 61.98 62.08 2dip s VAL 92 Cb -0.12 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 2dip s VAL 92 CO 0.02 0.11 1.07 -0.24 0.00 0.00 0.00 175.10 176.06 2dip n SER 93 N 0.35 1.30 0.00 3.32 2.88 -1.26 -4.88 113.62 115.34 2dip n SER 93 Ca -0.04 0.88 0.00 0.00 -1.33 0.00 0.00 58.87 58.38 2dip n SER 93 Cb 0.52 -1.43 0.00 0.00 -0.75 0.00 0.00 64.21 62.55 2dip n SER 93 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dip n GLY 94 N 1.14 -0.54 3.72 0.46 0.00 -1.26 -5.15 105.19 103.56 2dip n GLY 94 Ca 0.12 -0.56 -0.30 0.00 0.00 0.00 0.00 46.02 45.29 2dip n GLY 94 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dip s PRO 95 N -1.77 1.32 -0.52 1.61 0.04 -1.26 -4.99 135.00 129.43 2dip s PRO 95 Ca 0.00 0.85 -0.18 0.00 0.04 0.00 0.00 61.00 61.70 2dip s PRO 95 Cb 0.00 -1.81 0.07 0.00 0.04 0.00 0.00 34.50 32.80 2dip s PRO 95 CO 0.00 -2.21 0.60 -1.12 0.04 0.00 0.00 177.00 174.32 2dip s SER 96 N -3.42 6.20 0.07 6.66 0.01 -1.26 -4.96 113.70 117.01 2dip s SER 96 Ca 0.63 -1.12 -0.34 0.00 1.31 0.00 0.00 55.95 56.43 2dip s SER 96 Cb -0.18 -2.27 -0.17 0.00 0.21 0.00 0.00 66.02 63.61 2dip s SER 96 CO 0.57 -0.90 1.52 -1.28 0.41 0.00 0.00 173.24 173.56 2dip h SER 97 N 8.99 -1.24 0.00 2.44 0.87 -1.95 -3.56 113.55 119.10 2dip h SER 97 Ca -0.28 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 2dip h SER 97 Cb 1.10 0.39 0.00 0.00 -0.44 0.00 0.00 62.40 63.44 2dip h SER 97 CO 0.98 -0.67 0.00 0.61 -0.53 0.00 0.00 176.83 177.22