#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 1.23 0.31 1.61 1.04 -1.26 -5.17 113.70 111.46 2dip s SER 2 Ca 0.00 -1.11 0.09 0.00 0.48 0.00 0.00 55.95 55.42 2dip s SER 2 Cb 0.00 0.10 -0.05 0.00 0.10 0.00 0.00 66.02 66.17 2dip s SER 2 CO 0.00 -0.52 -0.01 -0.94 0.98 0.00 0.00 173.24 172.76 2dip s SER 3 N -3.13 4.26 0.00 7.02 1.04 -1.26 -5.15 113.70 116.48 2dip s SER 3 Ca 0.19 -0.88 0.00 0.00 0.48 0.00 0.00 55.95 55.75 2dip s SER 3 Cb 0.05 -0.61 0.00 0.00 0.10 0.00 0.00 66.02 65.56 2dip s SER 3 CO 0.01 -0.14 0.00 0.61 0.98 0.00 0.00 173.24 174.70 2dip n GLY 4 N -0.91 4.22 3.53 7.32 0.00 -1.26 -5.19 105.19 112.90 2dip n GLY 4 Ca -0.05 -1.67 -0.08 0.00 0.00 0.00 0.00 46.02 44.22 2dip n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dip s SER 5 N -0.74 -0.36 0.30 1.61 0.15 -1.26 -5.19 113.70 108.21 2dip s SER 5 Ca 0.00 -0.06 -0.06 0.00 0.70 0.00 0.00 55.95 56.53 2dip s SER 5 Cb 0.00 0.42 -0.00 0.00 -1.71 0.00 0.00 66.02 64.73 2dip s SER 5 CO 0.00 -0.70 0.45 -0.55 1.20 0.00 0.00 173.24 173.64 2dip s SER 6 N -2.57 0.50 0.47 5.45 0.15 -1.26 -5.18 113.70 111.26 2dip s SER 6 Ca 0.06 -1.29 0.08 0.00 0.70 0.00 0.00 55.95 55.49 2dip s SER 6 Cb -0.01 0.62 0.02 0.00 -1.71 0.00 0.00 66.02 64.93 2dip s SER 6 CO -0.08 -1.21 0.51 -0.83 1.20 0.00 0.00 173.24 172.83 2dip s GLY 7 N -3.16 2.06 0.17 9.45 0.00 -1.26 -5.14 107.32 109.44 2dip s GLY 7 Ca 0.28 -1.78 0.01 0.00 0.00 0.00 0.00 44.72 43.23 2dip s GLY 7 CO 0.16 -1.70 0.02 0.48 0.00 0.00 0.00 173.10 172.06 2dip s LEU 8 N -4.32 2.02 0.56 0.66 0.05 -1.26 -5.16 118.68 111.24 2dip s LEU 8 Ca 0.50 -1.20 -0.12 0.00 0.05 0.00 0.00 54.13 53.36 2dip s LEU 8 Cb -0.05 0.01 -0.05 0.00 -2.05 0.00 0.00 46.19 44.04 2dip s LEU 8 CO 0.30 -0.61 0.98 -0.70 -0.55 0.00 0.00 176.35 175.78 2dip s GLU 9 N -3.95 3.72 -0.01 1.48 2.12 -1.26 -5.09 118.70 115.72 2dip s GLU 9 Ca 0.25 0.76 0.02 0.00 0.36 0.00 0.00 54.97 56.36 2dip s GLU 9 Cb 0.06 -2.14 -0.00 0.00 0.26 0.00 0.00 34.13 32.32 2dip s GLU 9 CO 0.04 -0.42 -0.05 -1.83 -0.54 0.00 0.00 175.26 172.47 2dip s GLU 10 N -4.71 0.42 -0.29 4.30 1.03 -1.26 -5.14 118.70 113.05 2dip s GLU 10 Ca 0.56 -0.18 -0.18 0.00 0.03 0.00 0.00 54.97 55.19 2dip s GLU 10 Cb -0.11 -0.41 0.18 0.00 -0.80 0.00 0.00 34.13 32.99 2dip s GLU 10 CO 0.45 0.10 1.16 -0.59 -1.33 0.00 0.00 175.26 175.05 2dip s PHE 11 N -0.08 -0.29 -0.24 4.83 -0.71 -1.26 -5.18 117.98 115.05 2dip s PHE 11 Ca 0.01 0.60 -0.26 0.00 -1.04 0.00 0.00 56.93 56.25 2dip s PHE 11 Cb -0.02 0.25 0.07 0.00 -1.21 0.00 0.00 43.02 42.11 2dip s PHE 11 CO -0.00 -0.14 0.71 -1.59 -1.34 0.00 0.00 175.22 172.86 2dip s LYS 12 N 0.90 0.86 -0.30 1.99 0.00 -1.26 -5.16 119.74 116.78 2dip s LYS 12 Ca -0.05 0.91 -0.13 0.00 0.00 0.00 0.00 55.97 56.71 2dip s LYS 12 Cb -0.03 0.42 0.16 0.00 0.00 0.00 0.00 37.83 38.37 2dip s LYS 12 CO -0.12 -0.13 0.89 1.21 0.00 0.00 0.00 175.35 177.21 2dip s ASN 13 N 0.20 -0.74 0.42 0.03 2.47 -1.26 -5.17 114.94 110.88 2dip s ASN 13 Ca -0.01 0.94 0.01 0.00 0.42 0.00 0.00 52.86 54.21 2dip s ASN 13 Cb -0.04 1.82 -0.01 0.00 -1.45 0.00 0.00 41.25 41.56 2dip s ASN 13 CO 0.02 -0.14 0.63 -0.94 -3.72 0.00 0.00 177.10 172.95 2dip s SER 14 N 2.61 5.98 0.31 -4.21 1.04 -1.26 -5.09 113.70 113.08 2dip s SER 14 Ca -0.02 0.32 -0.12 0.00 0.48 0.00 0.00 55.95 56.62 2dip s SER 14 Cb -0.08 -1.67 -0.08 0.00 0.10 0.00 0.00 66.02 64.29 2dip s SER 14 CO -0.18 -0.57 0.68 -0.44 0.98 0.00 0.00 173.24 173.71 2dip s SER 15 N -4.16 6.65 -0.33 7.02 0.01 -1.26 -5.06 113.70 116.56 2dip s SER 15 Ca 0.46 1.10 -0.04 0.00 1.31 0.00 0.00 55.95 58.78 2dip s SER 15 Cb -0.10 -2.30 0.06 0.00 0.21 0.00 0.00 66.02 63.89 2dip s SER 15 CO 0.37 -0.21 0.08 -0.54 0.41 0.00 0.00 173.24 173.35 2dip s LYS 16 N -3.17 2.44 -0.10 12.44 -0.14 -1.26 -5.07 119.74 124.88 2dip s LYS 16 Ca 0.51 -1.32 -0.08 0.00 -1.36 0.00 0.00 55.97 53.71 2dip s LYS 16 Cb -0.11 -3.37 0.03 0.00 -1.68 0.00 0.00 37.83 32.71 2dip s LYS 16 CO 0.23 -0.72 0.26 -0.51 -0.76 0.00 0.00 175.35 173.85 2dip s LEU 17 N 1.30 0.84 -0.10 3.17 1.02 -1.26 -5.15 118.68 118.50 2dip s LEU 17 Ca -0.02 0.53 -0.04 0.00 0.02 0.00 0.00 54.13 54.62 2dip s LEU 17 Cb -0.20 0.87 0.05 0.00 0.02 0.00 0.00 46.19 46.92 2dip s LEU 17 CO 0.00 -0.11 0.21 0.54 0.02 0.00 0.00 176.35 177.01 2dip s VAL 18 N 0.43 -0.11 -0.30 -1.59 0.11 -1.26 -5.13 120.40 112.55 2dip s VAL 18 Ca -0.02 0.19 -0.16 0.00 -2.93 0.00 0.00 61.98 59.06 2dip s VAL 18 Cb -0.04 -0.34 0.18 0.00 -1.53 0.00 0.00 36.38 34.64 2dip s VAL 18 CO -0.02 0.08 1.11 0.00 -3.33 0.00 0.00 175.10 172.93 2dip s ALA 19 N 1.47 -3.19 -1.11 1.54 0.00 -1.26 -5.09 121.76 114.12 2dip s ALA 19 Ca -0.07 1.72 -0.17 0.00 0.00 0.00 0.00 51.96 53.44 2dip s ALA 19 Cb -0.11 -2.31 0.12 0.00 0.00 0.00 0.00 23.12 20.83 2dip s ALA 19 CO -0.08 -1.16 1.39 0.00 0.00 0.00 0.00 175.76 175.91 2dip s ALA 20 N 2.54 3.51 0.56 0.00 0.00 -1.26 -5.00 121.76 122.11 2dip s ALA 20 Ca -0.02 -2.95 -0.21 0.00 0.00 0.00 0.00 51.96 48.79 2dip s ALA 20 Cb -0.06 -4.25 -0.05 0.00 0.00 0.00 0.00 23.12 18.76 2dip s ALA 20 CO -0.14 -3.05 1.18 0.00 0.00 0.00 0.00 175.76 173.75 2dip n ALA 21 N 6.85 0.91 -1.15 0.00 0.00 -1.26 -4.93 120.51 120.93 2dip n ALA 21 Ca 0.34 0.09 -0.34 0.00 0.00 0.00 0.00 53.44 53.53 2dip n ALA 21 Cb 0.46 -2.24 0.11 0.00 0.00 0.00 0.00 19.45 17.79 2dip n ALA 21 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2dip n GLU 22 N -0.98 0.22 -3.74 0.00 1.02 -1.26 -5.02 120.64 110.88 2dip n GLU 22 Ca 0.12 0.14 -0.28 0.00 -0.02 0.00 0.00 57.16 57.12 2dip n GLU 22 Cb 0.45 -2.26 -0.16 0.00 -0.02 0.00 0.00 31.44 29.45 2dip n GLU 22 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2dip s LYS 23 N -3.73 0.67 0.41 3.49 -0.14 -1.26 -5.13 119.74 114.05 2dip s LYS 23 Ca 0.71 -0.45 0.04 0.00 -1.36 0.00 0.00 55.97 54.91 2dip s LYS 23 Cb -0.30 -2.12 -0.05 0.00 -1.68 0.00 0.00 37.83 33.67 2dip s LYS 23 CO 0.53 -0.65 0.04 -1.21 -0.76 0.00 0.00 175.35 173.30 2dip s GLU 24 N 1.84 1.92 0.04 1.68 2.02 -1.26 -5.12 118.70 119.82 2dip s GLU 24 Ca -0.01 -2.13 -0.29 0.00 0.02 0.00 0.00 54.97 52.56 2dip s GLU 24 Cb -0.17 -1.27 -0.04 0.00 0.10 0.00 0.00 34.13 32.75 2dip s GLU 24 CO -0.08 -0.21 0.93 1.03 0.02 0.00 0.00 175.26 176.95 2dip s ARG 25 N -3.80 4.60 -0.19 1.61 0.52 -1.26 -4.53 118.95 115.89 2dip s ARG 25 Ca 0.27 1.36 -0.09 0.00 -0.52 0.00 0.00 55.73 56.76 2dip s ARG 25 Cb 0.07 -3.42 -0.05 0.00 0.52 0.00 0.00 34.95 32.07 2dip s ARG 25 CO 0.14 0.09 0.10 -1.17 0.02 0.00 0.00 175.30 174.47 2dip s LEU 26 N 0.52 4.03 0.18 2.53 1.98 -1.26 -4.98 118.68 121.67 2dip s LEU 26 Ca 0.48 0.16 -0.04 0.00 -2.89 0.00 0.00 54.13 51.84 2dip s LEU 26 Cb -0.22 -2.03 0.32 0.00 0.66 0.00 0.00 46.19 44.93 2dip s LEU 26 CO 0.28 0.18 0.96 0.47 -1.89 0.00 0.00 176.35 176.35 2dip n ASP 27 N 3.51 -0.19 -3.94 3.68 9.92 -1.26 -4.41 116.55 123.86 2dip n ASP 27 Ca -0.16 1.06 -0.26 0.00 -0.53 0.00 0.00 54.79 54.89 2dip n ASP 27 Cb 0.52 -0.33 0.11 0.00 -0.64 0.00 0.00 41.12 40.78 2dip n ASP 27 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2dip n LYS 28 N -4.96 -1.23 -1.06 -1.24 5.02 -1.26 -4.61 118.16 108.82 2dip n LYS 28 Ca 0.11 -0.36 -0.41 0.00 -2.02 0.00 0.00 58.31 55.63 2dip n LYS 28 Cb 0.34 -1.37 -0.06 0.00 -0.02 0.00 0.00 35.03 33.92 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 -4.03 0.71 -0.02 2.13 -0.00 -1.26 -4.85 115.22 107.90 2dip n HIS 29 Ca 0.01 0.73 -0.03 0.00 -0.00 0.00 0.00 57.72 58.43 2dip n HIS 29 Cb 0.51 -1.42 -0.01 0.00 -0.00 0.00 0.00 29.99 29.06 2dip n HIS 29 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 2dip n LEU 30 N 1.64 2.37 0.00 0.27 4.77 -1.26 -4.53 117.00 120.25 2dip n LEU 30 Ca 0.16 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 2dip n LEU 30 Cb 0.02 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 2dip n LEU 30 CO 0.48 0.45 0.00 0.61 -1.33 0.00 0.00 177.39 177.60 2dip n GLY 31 N 3.21 0.80 2.95 -0.72 0.00 -1.26 -4.29 105.19 105.88 2dip n GLY 31 Ca -0.06 0.40 -0.13 0.00 0.00 0.00 0.00 46.02 46.24 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 0.93 -0.61 1.01 -1.26 -5.16 121.20 116.10 2dip s ILE 32 Ca 0.00 0.03 -0.12 0.00 0.00 0.00 0.00 60.65 60.56 2dip s ILE 32 Cb 0.00 -0.14 0.15 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 0.21 0.99 0.49 2.79 0.04 -1.26 -4.81 135.00 133.46 2dip s PRO 33 Ca -0.01 0.72 -0.18 0.00 0.04 0.00 0.00 61.00 61.57 2dip s PRO 33 Cb -0.02 -1.79 -0.09 0.00 0.04 0.00 0.00 34.50 32.64 2dip s PRO 33 CO -0.01 -2.40 0.98 0.00 0.04 0.00 0.00 177.00 175.61 2dip n ASN 35 N -1.28 0.29 0.00 0.00 4.13 0.10 -3.36 115.26 115.14 2dip n ASN 35 Ca 0.07 0.13 0.00 0.00 1.68 0.00 0.00 54.58 56.46 2dip n ASN 35 Cb 0.54 0.76 0.00 0.00 -1.54 0.00 0.00 39.78 39.54 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 -2.78 0.00 0.15 6.41 5.15 -1.26 -4.50 115.26 118.43 2dip n ASN 36 Ca -0.24 0.19 0.01 0.00 -0.60 0.00 0.00 54.58 53.94 2dip n ASN 36 Cb 1.05 -0.22 0.22 0.00 -0.53 0.00 0.00 39.78 40.30 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 -3.69 -3.99 -2.78 0.00 4.76 -1.21 -4.98 118.16 106.26 2dip n LYS 38 Ca -0.01 0.43 -0.42 0.00 -2.87 0.00 0.00 58.31 55.44 2dip n LYS 38 Cb 0.58 -4.24 -0.03 0.00 -1.84 0.00 0.00 35.03 29.50 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 -5.50 4.25 -0.12 1.97 0.74 -1.26 -4.73 119.66 115.00 2dip s GLN 39 Ca 0.25 1.17 -0.05 0.00 0.05 0.00 0.00 55.36 56.78 2dip s GLN 39 Cb -0.11 -3.62 0.06 0.00 1.10 0.00 0.00 33.01 30.44 2dip s GLN 39 CO 0.38 -0.52 0.27 0.12 -0.55 0.00 0.00 175.29 174.98 2dip s PHE 40 N 2.81 -0.40 0.98 1.67 5.36 -1.26 -3.27 117.98 123.87 2dip s PHE 40 Ca 0.40 0.93 -0.12 0.00 -0.96 0.00 0.00 56.93 57.18 2dip s PHE 40 Cb -0.16 0.02 0.18 0.00 -0.34 0.00 0.00 43.02 42.72 2dip s PHE 40 CO 0.08 -0.31 1.09 -1.25 -1.46 0.00 0.00 175.22 173.38 2dip s PRO 41 N 1.92 0.57 -0.07 10.12 0.04 -1.26 -4.78 135.00 141.54 2dip s PRO 41 Ca -0.03 0.58 -0.14 0.00 0.04 0.00 0.00 61.00 61.45 2dip s PRO 41 Cb -0.11 -1.75 -0.05 0.00 0.04 0.00 0.00 34.50 32.63 2dip s PRO 41 CO -0.09 -2.65 0.35 0.42 0.04 0.00 0.00 177.00 175.07 2dip s ILE 42 N -2.95 5.18 -0.21 0.56 1.01 -1.24 -5.00 121.20 118.55 2dip s ILE 42 Ca 0.65 0.70 -0.16 0.00 0.00 0.00 0.00 60.65 61.84 2dip s ILE 42 Cb -0.19 -3.67 -0.19 0.00 0.01 0.00 0.00 42.46 38.43 2dip s ILE 42 CO 0.58 0.50 0.08 -0.62 0.00 0.00 0.00 174.94 175.48 2dip n GLU 43 N 2.56 0.61 -0.91 2.79 -0.58 -1.26 -4.95 120.64 118.89 2dip n GLU 43 Ca -0.13 0.43 -0.30 0.00 -0.42 0.00 0.00 57.16 56.74 2dip n GLU 43 Cb 0.52 -1.67 0.25 0.00 -0.57 0.00 0.00 31.44 29.98 2dip n GLU 43 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 2dip s GLY 44 N -5.21 1.55 0.49 0.62 0.00 -1.26 -5.01 107.32 98.49 2dip s GLY 44 Ca -0.30 -0.94 -0.07 0.00 0.00 0.00 0.00 44.72 43.41 2dip s GLY 44 CO 0.60 -0.01 0.23 0.28 0.00 0.00 0.00 173.10 174.20 2dip n LYS 45 N -4.99 -1.13 -3.96 2.90 4.76 -1.26 -4.58 118.16 109.90 2dip n LYS 45 Ca 0.13 -0.39 -0.34 0.00 -2.87 0.00 0.00 58.31 54.84 2dip n LYS 45 Cb 0.60 -0.70 -0.14 0.00 -1.84 0.00 0.00 35.03 32.95 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 1.16 3.00 -0.15 0.00 1.51 -0.17 -2.43 117.35 120.27 2dip s TYR 47 Ca -0.04 0.02 -0.09 0.00 -1.01 0.00 0.00 57.07 55.96 2dip s TYR 47 Cb -0.20 -1.63 0.05 0.00 -0.11 0.00 0.00 41.96 40.07 2dip s TYR 47 CO -0.03 0.43 0.36 -1.59 -1.11 0.00 0.00 175.55 173.61 2dip s LYS 48 N -1.61 0.35 0.05 -0.62 -2.85 -1.10 0.29 119.74 114.25 2dip s LYS 48 Ca 0.19 0.68 -0.31 0.00 -1.00 0.00 0.00 55.97 55.54 2dip s LYS 48 Cb -0.11 -0.01 -0.06 0.00 -2.06 0.00 0.00 37.83 35.59 2dip s LYS 48 CO 0.10 -0.14 1.23 0.00 0.10 0.00 0.00 175.35 176.64 2dip n THR 50 N 4.05 0.15 -0.04 0.00 -2.24 0.16 -3.92 114.28 112.43 2dip n THR 50 Ca 0.10 -0.33 -0.04 0.00 -2.27 0.00 0.00 64.05 61.51 2dip n THR 50 Cb 0.46 0.43 -0.06 0.00 -2.10 0.00 0.00 70.33 69.06 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 0.30 2.42 -1.39 -0.78 1.02 -1.26 -5.00 120.64 115.95 2dip n GLU 51 Ca 0.17 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.19 2dip n GLU 51 Cb 0.34 -1.19 0.07 0.00 -0.02 0.00 0.00 31.44 30.65 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 -1.69 2.85 -1.73 0.00 -1.09 -1.26 -4.67 121.20 113.61 2dip s ILE 53 Ca 0.34 -0.77 -0.15 0.00 -2.23 0.00 0.00 60.65 57.84 2dip s ILE 53 Cb -0.02 -2.14 0.15 0.00 -1.58 0.00 0.00 42.46 38.88 2dip s ILE 53 CO 0.23 0.56 0.50 -1.84 -1.23 0.00 0.00 174.94 173.16 2dip n GLU 54 N 2.93 -1.61 -4.08 2.79 0.28 -1.26 -4.90 120.64 114.78 2dip n GLU 54 Ca -0.18 0.21 -0.35 0.00 -0.16 0.00 0.00 57.16 56.69 2dip n GLU 54 Cb 0.52 -4.55 -0.11 0.00 1.43 0.00 0.00 31.44 28.74 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 -3.57 3.17 -0.10 -1.84 6.14 -1.26 -4.98 117.35 114.91 2dip s TYR 55 Ca 0.56 -0.09 -0.05 0.00 0.64 0.00 0.00 57.07 58.13 2dip s TYR 55 Cb -0.32 -2.07 0.05 0.00 0.42 0.00 0.00 41.96 40.04 2dip s TYR 55 CO 0.99 0.04 0.24 -1.01 0.64 0.00 0.00 175.55 176.44 2dip s HIS 56 N 0.52 -0.32 0.38 4.97 3.76 -1.26 -2.25 115.29 121.09 2dip s HIS 56 Ca 0.01 0.77 0.08 0.00 -0.15 0.00 0.00 55.06 55.78 2dip s HIS 56 Cb -0.13 0.03 -0.06 0.00 1.11 0.00 0.00 32.58 33.52 2dip s HIS 56 CO 0.01 -0.24 0.04 -0.51 -0.85 0.00 0.00 174.74 173.20 2dip s LEU 57 N 1.35 2.96 -0.02 0.89 1.43 0.15 0.02 118.68 125.46 2dip s LEU 57 Ca -0.08 -1.13 0.03 0.00 -1.03 0.00 0.00 54.13 51.92 2dip s LEU 57 Cb -0.11 -1.22 -0.03 0.00 0.03 0.00 0.00 46.19 44.86 2dip s LEU 57 CO -0.08 -0.36 -0.09 0.00 0.23 0.00 0.00 176.35 176.05 2dip n GLN 59 N 1.81 -0.04 0.45 0.00 -0.06 -1.24 0.85 117.38 119.15 2dip n GLN 59 Ca -0.16 0.96 -0.20 0.00 -2.00 0.00 0.00 57.00 55.60 2dip n GLN 59 Cb 0.53 -1.71 -0.10 0.00 -4.06 0.00 0.00 30.24 24.90 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 -1.12 -0.87 3.69 4.57 -1.94 -2.50 114.58 116.42 2dip h GLU 60 Ca 0.58 0.08 0.04 0.00 -1.18 0.00 0.00 59.36 58.88 2dip h GLU 60 Cb 1.52 0.25 -0.05 0.00 -0.16 0.00 0.00 28.75 30.31 2dip h GLU 60 CO -0.54 -0.75 0.55 0.00 -1.18 0.00 0.00 179.01 177.10 2dip h PHE 62 N 1.05 0.29 -0.31 0.00 3.57 -0.92 0.47 116.94 121.09 2dip h PHE 62 Ca 0.36 0.04 0.09 0.00 3.53 0.00 0.00 57.97 61.99 2dip h PHE 62 Cb 0.06 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.77 2dip h PHE 62 CO -0.02 -0.06 0.48 0.22 -2.23 0.00 0.00 178.31 176.70 2dip h ASP 63 N 0.29 0.00 -0.12 0.41 1.82 -0.96 0.25 116.42 118.11 2dip h ASP 63 Ca 0.40 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 57.03 2dip h ASP 63 Cb 0.67 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.67 2dip h ASP 63 CO -0.49 0.00 0.05 0.28 -1.61 0.00 0.00 179.24 177.47 2dip h SER 64 N 0.00 0.21 -4.97 2.28 0.02 -0.14 -3.46 113.55 107.49 2dip h SER 64 Ca 0.15 -0.02 -0.26 0.00 -0.84 0.00 0.00 61.79 60.82 2dip h SER 64 Cb 1.11 -0.05 0.14 0.00 0.14 0.00 0.00 62.40 63.74 2dip h SER 64 CO -0.00 0.21 -0.63 -1.22 -1.14 0.00 0.00 176.83 174.05 2dip n TYR 65 N -4.44 -1.81 -0.02 3.45 4.02 0.88 -4.85 117.16 114.39 2dip n TYR 65 Ca -0.00 0.76 -0.06 0.00 -0.01 0.00 0.00 57.90 58.58 2dip n TYR 65 Cb 0.13 -4.44 -0.02 0.00 -0.02 0.00 0.00 39.34 34.99 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 -3.69 0.54 -0.51 0.00 -0.00 -1.26 -3.94 115.22 106.35 2dip n HIS 67 Ca -0.11 0.16 0.42 0.00 -0.00 0.00 0.00 57.72 58.18 2dip n HIS 67 Cb 0.36 -0.70 0.72 0.00 -0.00 0.00 0.00 29.99 30.37 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 0.14 -0.92 0.27 4.07 -1.90 0.54 115.31 117.51 2dip h LEU 68 Ca 0.00 0.07 0.30 0.00 0.08 0.00 0.00 57.88 58.33 2dip h LEU 68 Cb 0.66 0.07 -0.17 0.00 1.08 0.00 0.00 40.66 42.30 2dip h LEU 68 CO 0.00 -0.09 0.17 -1.20 -1.08 0.00 0.00 178.44 176.23 2dip n SER 69 N -4.38 0.03 -4.89 -0.43 7.64 -1.25 -4.36 113.62 105.96 2dip n SER 69 Ca 0.38 1.55 -0.29 0.00 1.01 0.00 0.00 58.87 61.52 2dip n SER 69 Cb 1.58 -0.62 0.02 0.00 -1.01 0.00 0.00 64.21 64.18 2dip n SER 69 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 2dip s HIS 70 N -5.74 3.45 -0.46 1.43 3.76 0.18 -4.99 115.29 112.91 2dip s HIS 70 Ca -0.11 0.96 -0.28 0.00 -0.15 0.00 0.00 55.06 55.48 2dip s HIS 70 Cb 0.28 -2.71 0.01 0.00 1.11 0.00 0.00 32.58 31.27 2dip s HIS 70 CO 0.72 -0.75 1.42 0.99 -0.85 0.00 0.00 174.74 176.27 2dip s THR 71 N -3.07 3.86 0.26 1.30 2.01 -1.26 -4.96 115.64 113.77 2dip s THR 71 Ca 0.54 0.83 0.07 0.00 0.31 0.00 0.00 61.69 63.44 2dip s THR 71 Cb -0.11 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.10 2dip s THR 71 CO 0.49 -0.88 0.20 -0.36 -0.69 0.00 0.00 174.62 173.38 2dip s PHE 72 N 5.70 3.06 -0.05 4.92 0.40 -1.26 -0.67 117.98 130.09 2dip s PHE 72 Ca 0.59 -0.14 0.00 0.00 -0.60 0.00 0.00 56.93 56.78 2dip s PHE 72 Cb -0.13 -1.45 0.03 0.00 0.51 0.00 0.00 43.02 41.98 2dip s PHE 72 CO 0.30 0.48 -0.02 0.95 0.70 0.00 0.00 175.22 177.63 2dip s THR 73 N -2.17 0.36 -0.02 0.64 -4.23 -0.91 -3.21 115.64 106.10 2dip s THR 73 Ca 0.34 0.02 -0.00 0.00 -1.18 0.00 0.00 61.69 60.87 2dip s THR 73 Cb -0.07 -0.44 -0.04 0.00 1.34 0.00 0.00 72.50 73.28 2dip s THR 73 CO 0.25 0.20 0.06 0.72 -0.54 0.00 0.00 174.62 175.31 2dip s PHE 74 N 1.23 3.24 0.59 3.99 -0.12 -1.13 -2.72 117.98 123.06 2dip s PHE 74 Ca -0.07 0.19 0.09 0.00 -0.05 0.00 0.00 56.93 57.10 2dip s PHE 74 Cb -0.14 -1.74 0.09 0.00 -0.63 0.00 0.00 43.02 40.61 2dip s PHE 74 CO -0.02 0.53 0.77 0.54 -0.05 0.00 0.00 175.22 176.99 2dip n ARG 75 N 1.35 0.61 -4.33 1.99 1.74 -1.02 -0.82 116.66 116.19 2dip n ARG 75 Ca -0.14 -3.22 -0.17 0.00 -0.77 0.00 0.00 57.85 53.55 2dip n ARG 75 Cb 0.53 -0.17 -0.10 0.00 -1.02 0.00 0.00 32.46 31.70 2dip n ARG 75 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2dip s GLU 76 N -4.63 1.37 1.02 5.56 0.41 -1.26 -4.60 118.70 116.57 2dip s GLU 76 Ca 0.58 -1.72 -0.17 0.00 -0.41 0.00 0.00 54.97 53.25 2dip s GLU 76 Cb -0.05 -0.44 -0.01 0.00 -1.78 0.00 0.00 34.13 31.85 2dip s GLU 76 CO 0.37 -0.20 -0.22 0.36 -0.49 0.00 0.00 175.26 175.08 2dip n LYS 77 N -0.44 -0.56 -0.96 1.61 2.85 -1.26 -4.64 118.16 114.75 2dip n LYS 77 Ca -0.03 -0.14 -0.32 0.00 -1.05 0.00 0.00 58.31 56.77 2dip n LYS 77 Cb 0.65 -1.52 0.02 0.00 -0.65 0.00 0.00 35.03 33.53 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 -0.39 0.00 -3.23 -1.58 5.12 -1.26 -3.18 116.66 112.15 2dip n ARG 78 Ca 0.02 0.00 -0.16 0.00 -1.93 0.00 0.00 57.85 55.79 2dip n ARG 78 Cb 0.60 -0.85 0.07 0.00 -1.16 0.00 0.00 32.46 31.11 2dip n ARG 78 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2dip n ASN 79 N 2.57 -3.17 -2.35 0.55 4.05 -1.26 -5.01 115.26 110.63 2dip n ASN 79 Ca 0.03 -0.48 -0.10 0.00 0.45 0.00 0.00 54.58 54.48 2dip n ASN 79 Cb 0.44 -4.20 -0.02 0.00 1.23 0.00 0.00 39.78 37.23 2dip n ASN 79 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2dip n GLN 80 N -3.72 0.52 -3.85 1.20 1.13 -1.19 -5.11 117.38 106.36 2dip n GLN 80 Ca -0.16 -1.87 -0.10 0.00 -1.94 0.00 0.00 57.00 52.93 2dip n GLN 80 Cb 0.61 1.86 -0.08 0.00 0.11 0.00 0.00 30.24 32.73 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 -2.49 0.71 0.99 -1.09 -0.14 -1.26 -4.92 119.74 111.55 2dip s LYS 81 Ca 0.19 -0.68 -0.17 0.00 -1.36 0.00 0.00 55.97 53.94 2dip s LYS 81 Cb -0.01 0.29 -0.10 0.00 -1.68 0.00 0.00 37.83 36.33 2dip s LYS 81 CO 0.14 -0.21 -0.57 0.91 -0.76 0.00 0.00 175.35 174.86 2dip n TRP 82 N 0.57 -3.85 -3.74 3.18 7.02 -1.26 -4.46 117.44 114.90 2dip n TRP 82 Ca -0.18 0.10 -0.16 0.00 -1.02 0.00 0.00 57.50 56.24 2dip n TRP 82 Cb 0.59 -1.51 -0.16 0.00 -2.42 0.00 0.00 31.31 27.81 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 -2.43 -0.02 -0.07 -0.99 0.52 0.00 -4.96 118.95 110.99 2dip s ARG 83 Ca 0.44 0.28 -0.30 0.00 -0.52 0.00 0.00 55.73 55.64 2dip s ARG 83 Cb -0.16 -0.30 -0.06 0.00 0.52 0.00 0.00 34.95 34.96 2dip s ARG 83 CO 0.77 -0.21 1.72 -1.12 0.02 0.00 0.00 175.30 176.48 2dip s SER 84 N 1.42 6.54 0.42 0.23 0.01 -1.26 -2.85 113.70 118.20 2dip s SER 84 Ca -0.05 2.20 -0.24 0.00 1.31 0.00 0.00 55.95 59.17 2dip s SER 84 Cb -0.13 -2.53 -0.09 0.00 0.21 0.00 0.00 66.02 63.49 2dip s SER 84 CO -0.04 -1.04 1.07 -0.76 0.41 0.00 0.00 173.24 172.88 2dip s LEU 85 N 4.46 4.09 0.17 2.44 1.43 -1.20 -5.01 118.68 125.07 2dip s LEU 85 Ca 0.77 2.08 -0.21 0.00 -1.03 0.00 0.00 54.13 55.74 2dip s LEU 85 Cb -0.33 -4.22 -0.08 0.00 0.03 0.00 0.00 46.19 41.59 2dip s LEU 85 CO 0.31 -0.59 0.70 -1.61 0.23 0.00 0.00 176.35 175.39 2dip s GLU 86 N -2.59 4.30 -0.37 1.70 2.02 -1.26 -4.90 118.70 117.60 2dip s GLU 86 Ca 0.59 0.89 -0.28 0.00 0.02 0.00 0.00 54.97 56.20 2dip s GLU 86 Cb -0.23 -3.05 -0.07 0.00 0.10 0.00 0.00 34.13 30.89 2dip s GLU 86 CO 0.28 0.49 2.33 1.17 0.02 0.00 0.00 175.26 179.55 2dip n LYS 87 N 1.14 1.44 -1.49 1.61 4.81 -1.26 -4.89 118.16 119.51 2dip n LYS 87 Ca -0.05 0.26 -0.41 0.00 -0.87 0.00 0.00 58.31 57.24 2dip n LYS 87 Cb 0.50 -3.25 0.02 0.00 0.02 0.00 0.00 35.03 32.32 2dip n LYS 87 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 2dip n ARG 88 N 8.84 0.73 -0.00 1.64 -4.01 -1.26 -4.96 116.66 117.64 2dip n ARG 88 Ca 0.35 0.27 -0.01 0.00 -1.04 0.00 0.00 57.85 57.42 2dip n ARG 88 Cb 0.47 -1.68 -0.00 0.00 -3.04 0.00 0.00 32.46 28.21 2dip n ARG 88 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2dip n ALA 89 N -0.99 1.94 -1.20 2.89 0.00 -1.26 -5.06 120.51 116.83 2dip n ALA 89 Ca 0.11 -0.16 -0.30 0.00 0.00 0.00 0.00 53.44 53.09 2dip n ALA 89 Cb 0.41 0.05 0.14 0.00 0.00 0.00 0.00 19.45 20.05 2dip n ALA 89 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2dip s ASP 90 N -5.01 3.44 -0.18 0.00 2.15 -1.26 -5.02 116.67 110.78 2dip s ASP 90 Ca -0.03 1.48 -0.12 0.00 0.43 0.00 0.00 52.55 54.30 2dip s ASP 90 Cb 0.00 -2.16 -0.05 0.00 -0.30 0.00 0.00 42.92 40.42 2dip s ASP 90 CO 0.05 -2.66 0.24 -0.70 -0.17 0.00 0.00 175.17 171.93 2dip s GLU 91 N -4.93 4.22 0.07 4.34 -6.30 -1.26 -5.02 118.70 109.82 2dip s GLU 91 Ca 0.63 -0.02 -0.22 0.00 -2.50 0.00 0.00 54.97 52.86 2dip s GLU 91 Cb -0.18 -3.44 -0.12 0.00 0.00 0.00 0.00 34.13 30.39 2dip s GLU 91 CO 0.57 0.23 0.51 1.55 0.02 0.00 0.00 175.26 178.14 2dip n VAL 92 N 3.66 0.74 -4.40 3.70 3.14 -1.26 -4.95 118.33 118.96 2dip n VAL 92 Ca -0.13 -0.19 -0.24 0.00 -2.96 0.00 0.00 64.34 60.82 2dip n VAL 92 Cb 0.52 0.00 -0.09 0.00 -1.06 0.00 0.00 33.84 33.21 2dip n VAL 92 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 2dip s SER 93 N -0.37 3.94 -0.80 6.55 0.15 -1.26 -5.02 113.70 116.88 2dip s SER 93 Ca 0.51 -0.86 -0.36 0.00 0.70 0.00 0.00 55.95 55.94 2dip s SER 93 Cb -0.72 -0.51 -0.20 0.00 -1.71 0.00 0.00 66.02 62.88 2dip s SER 93 CO 0.38 0.04 2.49 0.61 1.20 0.00 0.00 173.24 177.95 2dip n GLY 94 N -0.59 -0.34 3.77 9.45 0.00 -1.26 -4.85 105.19 111.37 2dip n GLY 94 Ca -0.06 1.13 -0.38 0.00 0.00 0.00 0.00 46.02 46.70 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 7.87 4.04 -0.17 1.61 0.04 -1.26 -5.03 135.00 142.10 2dip s PRO 95 Ca 1.29 1.89 -0.05 0.00 0.04 0.00 0.00 61.00 64.17 2dip s PRO 95 Cb -1.31 -2.69 -0.03 0.00 0.04 0.00 0.00 34.50 30.51 2dip s PRO 95 CO 0.55 -0.35 0.00 -1.54 0.04 0.00 0.00 177.00 175.70 2dip s SER 96 N -1.07 5.11 0.05 6.66 1.04 -1.26 -5.01 113.70 119.21 2dip s SER 96 Ca 0.57 -0.06 -0.24 0.00 0.48 0.00 0.00 55.95 56.70 2dip s SER 96 Cb -0.32 -1.85 -0.17 0.00 0.10 0.00 0.00 66.02 63.78 2dip s SER 96 CO 0.40 0.16 1.55 -1.28 0.98 0.00 0.00 173.24 175.05 2dip h SER 97 N 6.76 -0.04 0.00 7.02 0.87 -2.04 -3.56 113.55 122.55 2dip h SER 97 Ca -0.34 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 2dip h SER 97 Cb 1.18 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.15 2dip h SER 97 CO 0.65 0.15 0.00 0.61 -0.53 0.00 0.00 176.83 177.71