#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dip n SER 2 N 0.00 -2.10 -4.25 1.61 3.41 -1.26 -4.86 113.62 106.18 2dip n SER 2 Ca 0.00 -1.11 -0.34 0.00 -0.26 0.00 0.00 58.87 57.16 2dip n SER 2 Cb 0.00 -2.33 0.13 0.00 -0.26 0.00 0.00 64.21 61.75 2dip n SER 2 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2dip n SER 3 N -2.66 -2.64 -3.15 4.04 3.41 -1.26 -5.03 113.62 106.33 2dip n SER 3 Ca 0.00 0.01 0.06 0.00 -0.26 0.00 0.00 58.87 58.68 2dip n SER 3 Cb 0.52 -0.93 -0.01 0.00 -0.26 0.00 0.00 64.21 63.53 2dip n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dip s GLY 4 N -1.70 -0.32 -0.01 5.00 0.00 -1.26 -5.16 107.32 103.87 2dip s GLY 4 Ca 0.52 2.88 -0.05 0.00 0.00 0.00 0.00 44.72 48.07 2dip s GLY 4 CO 0.67 4.01 0.23 -1.35 0.00 0.00 0.00 173.10 176.67 2dip s SER 5 N 2.98 6.44 -0.75 1.64 1.04 -1.26 -4.98 113.70 118.82 2dip s SER 5 Ca 0.02 0.48 -0.26 0.00 0.48 0.00 0.00 55.95 56.67 2dip s SER 5 Cb -0.07 -2.06 -0.16 0.00 0.10 0.00 0.00 66.02 63.84 2dip s SER 5 CO -0.11 0.27 2.48 -1.54 0.98 0.00 0.00 173.24 175.31 2dip n SER 6 N 1.11 1.21 -4.76 7.02 3.41 -1.26 -4.88 113.62 115.47 2dip n SER 6 Ca -0.12 -0.44 -0.34 0.00 -0.26 0.00 0.00 58.87 57.72 2dip n SER 6 Cb 0.53 -1.28 0.05 0.00 -0.26 0.00 0.00 64.21 63.25 2dip n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dip s GLY 7 N 9.80 2.38 0.17 5.00 0.00 -1.26 -4.92 107.32 118.49 2dip s GLY 7 Ca 1.13 0.74 -0.33 0.00 0.00 0.00 0.00 44.72 46.26 2dip s GLY 7 CO 0.34 1.12 1.62 1.04 0.00 0.00 0.00 173.10 177.21 2dip n LEU 8 N -2.12 3.33 -4.80 0.66 4.32 -1.26 -4.96 117.00 112.17 2dip n LEU 8 Ca 0.12 1.08 -0.38 0.00 -0.02 0.00 0.00 56.01 56.81 2dip n LEU 8 Cb 0.51 -1.47 -0.06 0.00 -1.62 0.00 0.00 43.42 40.78 2dip n LEU 8 CO 0.46 -0.17 0.40 -0.70 -1.22 0.00 0.00 177.39 176.16 2dip s GLU 9 N 0.99 4.34 -0.07 3.23 2.56 -1.26 -5.06 118.70 123.43 2dip s GLU 9 Ca 0.78 0.92 -0.14 0.00 0.00 0.00 0.00 54.97 56.53 2dip s GLU 9 Cb -0.63 -3.11 -0.05 0.00 2.00 0.00 0.00 34.13 32.34 2dip s GLU 9 CO 0.36 0.52 0.37 -1.21 -0.56 0.00 0.00 175.26 174.74 2dip s GLU 10 N -1.46 4.01 0.22 4.30 2.02 -1.26 -5.08 118.70 121.44 2dip s GLU 10 Ca 0.37 0.29 -0.00 0.00 0.02 0.00 0.00 54.97 55.64 2dip s GLU 10 Cb -0.20 -3.30 -0.04 0.00 0.10 0.00 0.00 34.13 30.70 2dip s GLU 10 CO 0.22 0.52 0.13 -0.59 0.02 0.00 0.00 175.26 175.56 2dip s PHE 11 N -0.47 1.26 0.45 1.61 -0.12 -1.26 -5.18 117.98 114.28 2dip s PHE 11 Ca 0.22 -1.35 0.07 0.00 -0.05 0.00 0.00 56.93 55.82 2dip s PHE 11 Cb -0.15 -0.64 -0.01 0.00 -0.63 0.00 0.00 43.02 41.59 2dip s PHE 11 CO 0.10 -0.58 0.34 0.15 -0.05 0.00 0.00 175.22 175.18 2dip s LYS 12 N -4.11 2.38 0.32 1.99 3.01 -1.26 -5.15 119.74 116.91 2dip s LYS 12 Ca 0.39 -1.75 0.02 0.00 -1.01 0.00 0.00 55.97 53.62 2dip s LYS 12 Cb 0.07 -2.20 -0.02 0.00 -1.01 0.00 0.00 37.83 34.67 2dip s LYS 12 CO 0.13 -0.30 0.34 -0.80 0.51 0.00 0.00 175.35 175.23 2dip s ASN 13 N -4.12 1.16 0.28 2.83 -0.87 -1.26 -5.18 114.94 107.79 2dip s ASN 13 Ca 0.43 -1.59 0.08 0.00 -1.57 0.00 0.00 52.86 50.21 2dip s ASN 13 Cb -0.01 0.58 -0.04 0.00 -0.02 0.00 0.00 41.25 41.76 2dip s ASN 13 CO 0.25 -1.13 0.18 -0.94 -2.57 0.00 0.00 177.10 172.89 2dip s SER 14 N -3.29 5.23 -0.70 -1.22 1.04 -1.26 -5.01 113.70 108.50 2dip s SER 14 Ca 0.36 -0.42 -0.25 0.00 0.48 0.00 0.00 55.95 56.12 2dip s SER 14 Cb 0.02 -1.15 -0.13 0.00 0.10 0.00 0.00 66.02 64.86 2dip s SER 14 CO 0.22 -0.14 2.42 -0.24 0.98 0.00 0.00 173.24 176.49 2dip n SER 15 N -1.18 1.62 -3.63 7.02 2.88 -1.26 -4.86 113.62 114.22 2dip n SER 15 Ca -0.06 -0.85 -0.27 0.00 -1.33 0.00 0.00 58.87 56.37 2dip n SER 15 Cb 0.59 -1.47 -0.16 0.00 -0.75 0.00 0.00 64.21 62.41 2dip n SER 15 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2dip s LYS 16 N 8.51 0.21 -0.80 -1.46 -2.85 -1.26 -5.08 119.74 117.02 2dip s LYS 16 Ca 1.02 -0.25 -0.05 0.00 -1.00 0.00 0.00 55.97 55.69 2dip s LYS 16 Cb -0.31 -1.77 0.20 0.00 -2.06 0.00 0.00 37.83 33.89 2dip s LYS 16 CO 0.24 -0.74 0.67 -1.17 0.10 0.00 0.00 175.35 174.45 2dip s LEU 17 N 2.06 5.72 0.30 2.77 1.98 -1.26 -5.07 118.68 125.19 2dip s LEU 17 Ca 0.03 -3.19 -0.28 0.00 -2.89 0.00 0.00 54.13 47.80 2dip s LEU 17 Cb -0.16 -1.97 -0.09 0.00 0.66 0.00 0.00 46.19 44.63 2dip s LEU 17 CO -0.14 -0.34 1.03 0.54 -1.89 0.00 0.00 176.35 175.55 2dip s VAL 18 N -0.57 3.77 0.05 1.68 0.11 -1.26 -5.03 120.40 119.15 2dip s VAL 18 Ca 0.22 1.65 -0.28 0.00 -2.93 0.00 0.00 61.98 60.64 2dip s VAL 18 Cb -0.13 -4.00 0.10 0.00 -1.53 0.00 0.00 36.38 30.82 2dip s VAL 18 CO -0.08 0.29 1.14 0.00 -3.33 0.00 0.00 175.10 173.12 2dip s ALA 19 N -1.33 -1.98 0.14 1.54 0.00 -1.26 -5.16 121.76 113.70 2dip s ALA 19 Ca 0.47 0.49 -0.25 0.00 0.00 0.00 0.00 51.96 52.68 2dip s ALA 19 Cb -0.27 0.46 0.08 0.00 0.00 0.00 0.00 23.12 23.39 2dip s ALA 19 CO 0.34 -1.03 1.03 0.00 0.00 0.00 0.00 175.76 176.10 2dip s ALA 20 N -2.79 -1.71 -0.94 0.00 0.00 -1.26 -5.07 121.76 109.99 2dip s ALA 20 Ca 0.13 0.02 -0.25 0.00 0.00 0.00 0.00 51.96 51.87 2dip s ALA 20 Cb 0.02 0.65 -0.10 0.00 0.00 0.00 0.00 23.12 23.69 2dip s ALA 20 CO -0.01 -1.05 2.10 0.00 0.00 0.00 0.00 175.76 176.80 2dip s ALA 21 N -2.77 1.24 -0.15 0.00 0.00 -1.26 -4.89 121.76 113.94 2dip s ALA 21 Ca 0.16 -1.39 0.00 0.00 0.00 0.00 0.00 51.96 50.73 2dip s ALA 21 Cb -0.01 -4.60 0.03 0.00 0.00 0.00 0.00 23.12 18.53 2dip s ALA 21 CO 0.03 -5.48 -0.13 -2.00 0.00 0.00 0.00 175.76 168.18 2dip s GLU 22 N 7.67 2.15 0.58 0.00 2.12 -1.26 -4.99 118.70 124.96 2dip s GLU 22 Ca 0.78 -0.54 0.27 0.00 0.36 0.00 0.00 54.97 55.84 2dip s GLU 22 Cb -0.07 -2.07 1.68 0.00 0.26 0.00 0.00 34.13 33.93 2dip s GLU 22 CO 0.06 -0.26 2.19 1.57 -0.54 0.00 0.00 175.26 178.27 2dip h LYS 23 N 8.06 0.00 -6.26 4.30 -0.00 -2.08 -3.40 116.57 117.19 2dip h LYS 23 Ca -0.36 0.00 -0.57 0.00 -0.00 0.00 0.00 60.65 59.72 2dip h LYS 23 Cb 1.13 0.00 -0.05 0.00 -0.00 0.00 0.00 32.23 33.31 2dip h LYS 23 CO 0.51 0.00 0.91 -1.21 -0.00 0.00 0.00 179.45 179.65 2dip s GLU 24 N -4.71 4.07 -0.35 0.07 2.02 -1.26 -4.93 118.70 113.60 2dip s GLU 24 Ca -0.05 1.32 -0.42 0.00 0.02 0.00 0.00 54.97 55.85 2dip s GLU 24 Cb 0.16 -3.79 -0.17 0.00 0.10 0.00 0.00 34.13 30.43 2dip s GLU 24 CO 0.57 -0.91 1.75 -2.13 0.02 0.00 0.00 175.26 174.56 2dip n ARG 25 N 6.93 0.83 -1.35 1.61 3.00 -1.26 -4.66 116.66 121.76 2dip n ARG 25 Ca 0.14 0.30 -0.53 0.00 -0.00 0.00 0.00 57.85 57.76 2dip n ARG 25 Cb 0.46 -1.96 -0.12 0.00 0.00 0.00 0.00 32.46 30.84 2dip n ARG 25 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2dip n LEU 26 N 5.40 0.82 -1.84 6.15 4.77 -1.26 -4.74 117.00 126.30 2dip n LEU 26 Ca 0.30 0.47 -0.08 0.00 -0.03 0.00 0.00 56.01 56.66 2dip n LEU 26 Cb 0.08 -0.97 -0.10 0.00 -2.33 0.00 0.00 43.42 40.10 2dip n LEU 26 CO 0.83 -0.78 1.40 0.47 -1.33 0.00 0.00 177.39 177.98 2dip n ASP 27 N 8.89 5.33 0.00 -1.43 8.00 -1.26 -4.00 116.55 132.08 2dip n ASP 27 Ca 0.56 -2.48 -0.03 0.00 0.71 0.00 0.00 54.79 53.55 2dip n ASP 27 Cb 0.03 -1.31 -0.01 0.00 -0.02 0.00 0.00 41.12 39.81 2dip n ASP 27 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2dip n LYS 28 N 2.08 0.16 -3.27 -1.24 4.76 -1.26 -4.93 118.16 114.45 2dip n LYS 28 Ca 0.28 0.06 -0.25 0.00 -2.87 0.00 0.00 58.31 55.53 2dip n LYS 28 Cb 0.76 -0.74 -0.07 0.00 -1.84 0.00 0.00 35.03 33.13 2dip n LYS 28 CO 0.00 0.00 0.00 -2.39 -1.37 0.00 0.00 177.40 173.64 2dip n HIS 29 N -3.66 0.88 0.04 2.13 1.44 -1.26 -4.92 115.22 109.87 2dip n HIS 29 Ca -0.04 -3.74 -0.20 0.00 -2.01 0.00 0.00 57.72 51.73 2dip n HIS 29 Cb 0.16 -0.40 -0.12 0.00 0.12 0.00 0.00 29.99 29.75 2dip n HIS 29 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 2dip h LEU 30 N 4.12 0.72 0.00 2.39 3.38 -1.92 -3.41 115.31 120.59 2dip h LEU 30 Ca 0.12 -0.80 0.00 0.00 0.09 0.00 0.00 57.88 57.29 2dip h LEU 30 Cb 0.81 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.34 2dip h LEU 30 CO 0.58 1.43 0.00 0.61 0.09 0.00 0.00 178.44 181.15 2dip n GLY 31 N 1.23 1.35 3.01 0.83 0.00 -1.26 -4.40 105.19 105.96 2dip n GLY 31 Ca -0.12 0.38 -0.12 0.00 0.00 0.00 0.00 46.02 46.16 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 -0.00 0.73 -0.61 1.01 -1.26 -5.15 121.20 115.91 2dip s ILE 32 Ca 0.00 0.01 -0.12 0.00 0.00 0.00 0.00 60.65 60.54 2dip s ILE 32 Cb 0.00 -0.20 0.03 0.00 0.01 0.00 0.00 42.46 42.30 2dip s ILE 32 CO 0.00 0.00 1.10 -2.16 0.00 0.00 0.00 174.94 173.88 2dip s PRO 33 N 0.12 2.47 0.49 2.79 0.04 -1.26 -4.79 135.00 134.86 2dip s PRO 33 Ca -0.00 1.25 -0.23 0.00 0.04 0.00 0.00 61.00 62.06 2dip s PRO 33 Cb -0.01 -1.92 -0.06 0.00 0.04 0.00 0.00 34.50 32.54 2dip s PRO 33 CO -0.00 -1.49 1.26 0.00 0.04 0.00 0.00 177.00 176.81 2dip n ASN 35 N -0.66 1.38 0.00 0.00 5.15 0.20 -3.02 115.26 118.30 2dip n ASN 35 Ca 0.08 -1.10 0.00 0.00 -0.60 0.00 0.00 54.58 52.96 2dip n ASN 35 Cb 0.46 0.31 0.00 0.00 -0.53 0.00 0.00 39.78 40.03 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 -0.49 0.00 0.21 1.20 5.15 -1.26 -4.73 115.26 115.33 2dip n ASN 36 Ca 0.10 0.00 0.11 0.00 -0.60 0.00 0.00 54.58 54.19 2dip n ASN 36 Cb 0.39 -0.32 0.15 0.00 -0.53 0.00 0.00 39.78 39.47 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 -3.12 -5.06 -2.83 0.00 4.76 -1.17 -4.97 118.16 105.77 2dip n LYS 38 Ca 0.04 0.55 -0.42 0.00 -2.87 0.00 0.00 58.31 55.61 2dip n LYS 38 Cb 0.56 -4.74 -0.04 0.00 -1.84 0.00 0.00 35.03 28.97 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 -5.61 4.20 -0.10 1.97 0.74 -1.26 -4.75 119.66 114.84 2dip s GLN 39 Ca 0.29 1.05 -0.05 0.00 0.05 0.00 0.00 55.36 56.70 2dip s GLN 39 Cb -0.13 -3.65 0.05 0.00 1.10 0.00 0.00 33.01 30.39 2dip s GLN 39 CO 0.48 -0.55 0.22 0.12 -0.55 0.00 0.00 175.29 175.01 2dip s PHE 40 N 2.94 -0.30 0.89 1.67 5.36 -1.26 -3.24 117.98 124.04 2dip s PHE 40 Ca 0.37 0.75 -0.11 0.00 -0.96 0.00 0.00 56.93 56.97 2dip s PHE 40 Cb -0.15 -0.01 0.13 0.00 -0.34 0.00 0.00 43.02 42.64 2dip s PHE 40 CO 0.07 -0.24 1.09 -1.25 -1.46 0.00 0.00 175.22 173.43 2dip s PRO 41 N 1.51 1.30 -1.11 10.12 0.04 -1.26 -5.07 135.00 140.53 2dip s PRO 41 Ca -0.07 0.83 -0.14 0.00 0.04 0.00 0.00 61.00 61.66 2dip s PRO 41 Cb -0.11 -1.81 0.18 0.00 0.04 0.00 0.00 34.50 32.79 2dip s PRO 41 CO -0.08 -2.21 1.29 0.42 0.04 0.00 0.00 177.00 176.46 2dip s ILE 42 N -2.93 5.11 0.25 0.56 1.01 -1.23 -4.88 121.20 119.08 2dip s ILE 42 Ca 0.63 -2.48 -0.10 0.00 0.00 0.00 0.00 60.65 58.70 2dip s ILE 42 Cb -0.18 -4.82 0.37 0.00 0.01 0.00 0.00 42.46 37.84 2dip s ILE 42 CO 0.57 -1.51 1.58 -0.33 0.00 0.00 0.00 174.94 175.25 2dip h GLU 43 N 7.52 -0.00 0.00 2.79 3.07 -1.91 -3.41 114.58 122.64 2dip h GLU 43 Ca 0.25 0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 58.92 2dip h GLU 43 Cb 0.92 0.00 0.09 0.00 -0.84 0.00 0.00 28.75 28.92 2dip h GLU 43 CO 1.16 -0.00 0.05 0.41 -1.40 0.00 0.00 179.01 179.23 2dip n GLY 44 N -1.55 -2.61 3.44 -3.84 0.00 -1.26 -5.01 105.19 94.36 2dip n GLY 44 Ca 0.13 -1.47 -0.28 0.00 0.00 0.00 0.00 46.02 44.40 2dip n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dip s LYS 45 N -4.18 -1.38 -0.28 1.61 -0.14 -1.26 -4.76 119.74 109.35 2dip s LYS 45 Ca 0.34 0.79 -0.01 0.00 -1.36 0.00 0.00 55.97 55.73 2dip s LYS 45 Cb -0.03 -1.50 0.04 0.00 -1.68 0.00 0.00 37.83 34.66 2dip s LYS 45 CO 0.26 -4.02 -0.03 0.00 -0.76 0.00 0.00 175.35 170.80 2dip s TYR 47 N 1.27 3.46 -0.07 0.00 1.51 0.13 -2.17 117.35 121.47 2dip s TYR 47 Ca -0.04 0.12 -0.04 0.00 -1.01 0.00 0.00 57.07 56.10 2dip s TYR 47 Cb -0.19 -1.66 0.03 0.00 -0.11 0.00 0.00 41.96 40.03 2dip s TYR 47 CO -0.02 0.52 0.17 0.21 -1.11 0.00 0.00 175.55 175.32 2dip s LYS 48 N -3.13 0.15 -0.13 -0.62 2.20 0.60 -1.11 119.74 117.70 2dip s LYS 48 Ca 0.34 0.35 -0.28 0.00 -0.36 0.00 0.00 55.97 56.02 2dip s LYS 48 Cb -0.11 -0.06 -0.01 0.00 -1.51 0.00 0.00 37.83 36.13 2dip s LYS 48 CO 0.28 -0.11 0.94 0.00 -0.36 0.00 0.00 175.35 176.10 2dip n THR 50 N 4.62 0.55 0.00 0.00 -2.24 -0.10 -3.72 114.28 113.40 2dip n THR 50 Ca 0.07 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 2dip n THR 50 Cb 0.49 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.82 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 0.39 2.63 -1.87 -0.78 1.02 -1.26 -4.95 120.64 115.83 2dip n GLU 51 Ca 0.11 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.15 2dip n GLU 51 Cb 0.33 -0.96 0.04 0.00 -0.02 0.00 0.00 31.44 30.83 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 -0.84 2.39 -1.54 0.00 -1.09 -1.26 -4.67 121.20 114.19 2dip s ILE 53 Ca 0.30 -0.90 -0.14 0.00 -2.23 0.00 0.00 60.65 57.67 2dip s ILE 53 Cb -0.02 -1.95 0.11 0.00 -1.58 0.00 0.00 42.46 39.02 2dip s ILE 53 CO 0.19 0.55 0.80 -0.62 -1.23 0.00 0.00 174.94 174.63 2dip n GLU 54 N 3.51 -4.27 -4.30 2.79 -0.58 -1.26 -4.94 120.64 111.59 2dip n GLU 54 Ca -0.19 0.50 -0.34 0.00 -0.42 0.00 0.00 57.16 56.72 2dip n GLU 54 Cb 0.53 -5.31 -0.11 0.00 -0.57 0.00 0.00 31.44 25.98 2dip n GLU 54 CO 0.00 0.00 0.00 -0.47 -0.48 0.00 0.00 177.13 176.18 2dip s TYR 55 N -3.20 3.09 -0.11 -0.32 6.14 -1.26 -4.96 117.35 116.73 2dip s TYR 55 Ca 0.63 -0.18 -0.06 0.00 0.64 0.00 0.00 57.07 58.10 2dip s TYR 55 Cb -0.33 -1.98 0.04 0.00 0.42 0.00 0.00 41.96 40.11 2dip s TYR 55 CO 0.77 0.04 0.26 -1.01 0.64 0.00 0.00 175.55 176.25 2dip s HIS 56 N 0.31 -0.34 0.36 4.97 3.76 -1.26 -1.84 115.29 121.25 2dip s HIS 56 Ca -0.02 0.80 0.08 0.00 -0.15 0.00 0.00 55.06 55.77 2dip s HIS 56 Cb -0.14 0.08 -0.05 0.00 1.11 0.00 0.00 32.58 33.58 2dip s HIS 56 CO 0.02 -0.22 0.10 -0.51 -0.85 0.00 0.00 174.74 173.28 2dip s LEU 57 N 0.98 3.12 0.06 0.89 1.43 -0.27 0.60 118.68 125.49 2dip s LEU 57 Ca -0.07 -0.93 0.05 0.00 -1.03 0.00 0.00 54.13 52.15 2dip s LEU 57 Cb -0.08 -1.52 -0.04 0.00 0.03 0.00 0.00 46.19 44.58 2dip s LEU 57 CO -0.07 -0.33 -0.06 0.00 0.23 0.00 0.00 176.35 176.13 2dip n GLN 59 N 0.98 -0.01 0.03 0.00 -0.06 -1.20 -0.51 117.38 116.61 2dip n GLN 59 Ca -0.13 0.91 -0.01 0.00 -2.00 0.00 0.00 57.00 55.76 2dip n GLN 59 Cb 0.52 -1.97 -0.01 0.00 -4.06 0.00 0.00 30.24 24.73 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 -0.08 -0.59 3.69 4.81 -1.93 -2.82 114.58 117.65 2dip h GLU 60 Ca 0.73 0.01 0.17 0.00 -0.13 0.00 0.00 59.36 60.13 2dip h GLU 60 Cb 2.73 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 32.10 2dip h GLU 60 CO -0.14 -0.05 0.58 0.00 -0.73 0.00 0.00 179.01 178.67 2dip h PHE 62 N 0.00 0.00 0.00 0.00 3.57 -1.04 -2.75 116.94 116.72 2dip h PHE 62 Ca 0.28 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.77 2dip h PHE 62 Cb 1.44 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.18 2dip h PHE 62 CO 0.00 0.48 -0.03 0.22 -2.23 0.00 0.00 178.31 176.75 2dip h ASP 63 N 0.00 0.00 1.18 0.41 3.58 0.52 0.01 116.42 122.12 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 0.85 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.90 2dip h ASP 63 CO 0.06 0.03 0.00 0.77 -2.88 0.00 0.00 179.24 177.22 2dip h SER 64 N 0.00 0.00 -6.38 2.28 4.64 -1.56 -3.47 113.55 109.07 2dip h SER 64 Ca -0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 2dip h SER 64 Cb 0.06 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.07 2dip h SER 64 CO 0.00 0.00 -0.77 -1.22 -0.87 0.00 0.00 176.83 173.98 2dip n TYR 65 N -2.77 -2.15 -0.06 4.77 4.02 -0.01 -4.85 117.16 116.11 2dip n TYR 65 Ca 0.02 0.86 -0.03 0.00 -0.01 0.00 0.00 57.90 58.75 2dip n TYR 65 Cb 0.34 -3.68 -0.01 0.00 -0.02 0.00 0.00 39.34 35.97 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 -4.38 0.25 -0.06 0.00 -0.00 -1.26 -3.46 115.22 106.32 2dip n HIS 67 Ca -0.04 0.10 0.21 0.00 -0.00 0.00 0.00 57.72 57.98 2dip n HIS 67 Cb 0.16 -0.65 0.39 0.00 -0.00 0.00 0.00 29.99 29.89 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 -1.73 0.27 -0.00 -1.94 0.26 115.31 112.17 2dip h LEU 68 Ca 0.00 0.00 0.26 0.00 -0.00 0.00 0.00 57.88 58.14 2dip h LEU 68 Cb 0.31 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.94 2dip h LEU 68 CO 0.00 0.00 0.83 -1.28 -0.00 0.00 0.00 178.44 177.99 2dip h SER 69 N 0.00 0.00 -3.37 -0.43 0.87 -1.84 -3.39 113.55 105.38 2dip h SER 69 Ca 0.35 0.00 -0.65 0.00 -1.23 0.00 0.00 61.79 60.26 2dip h SER 69 Cb 2.49 0.00 -0.13 0.00 -0.44 0.00 0.00 62.40 64.32 2dip h SER 69 CO -0.00 0.00 -0.68 -1.00 -0.53 0.00 0.00 176.83 174.62 2dip s HIS 70 N -4.67 2.92 -0.52 2.24 3.76 0.90 -5.05 115.29 114.87 2dip s HIS 70 Ca -0.04 -0.06 -0.27 0.00 -0.15 0.00 0.00 55.06 54.54 2dip s HIS 70 Cb 0.18 -1.50 -0.03 0.00 1.11 0.00 0.00 32.58 32.33 2dip s HIS 70 CO 0.62 0.47 2.01 0.99 -0.85 0.00 0.00 174.74 177.98 2dip s THR 71 N -1.31 3.27 0.58 1.30 2.01 -1.26 -4.89 115.64 115.33 2dip s THR 71 Ca 0.25 0.19 0.00 0.00 0.31 0.00 0.00 61.69 62.44 2dip s THR 71 Cb -0.11 -3.61 0.05 0.00 0.01 0.00 0.00 72.50 68.83 2dip s THR 71 CO 0.17 -0.56 0.82 -0.36 -0.69 0.00 0.00 174.62 174.00 2dip s PHE 72 N 9.56 2.71 -0.09 4.92 0.40 -1.26 -0.92 117.98 133.31 2dip s PHE 72 Ca 0.78 -0.01 -0.07 0.00 -0.60 0.00 0.00 56.93 57.03 2dip s PHE 72 Cb -0.16 -2.81 0.03 0.00 0.51 0.00 0.00 43.02 40.58 2dip s PHE 72 CO 0.25 -1.01 0.22 0.95 0.70 0.00 0.00 175.22 176.33 2dip s THR 73 N -2.84 -0.01 0.21 0.64 -4.23 0.60 -4.08 115.64 105.93 2dip s THR 73 Ca 0.59 0.03 0.06 0.00 -1.18 0.00 0.00 61.69 61.19 2dip s THR 73 Cb -0.10 -0.32 -0.04 0.00 1.34 0.00 0.00 72.50 73.38 2dip s THR 73 CO 0.40 0.01 0.20 0.72 -0.54 0.00 0.00 174.62 175.40 2dip s PHE 74 N 0.36 3.18 -0.05 3.99 -0.71 -1.15 -0.29 117.98 123.31 2dip s PHE 74 Ca -0.02 -0.05 0.06 0.00 -1.04 0.00 0.00 56.93 55.88 2dip s PHE 74 Cb -0.03 -1.47 -0.01 0.00 -1.21 0.00 0.00 43.02 40.29 2dip s PHE 74 CO -0.02 0.51 -0.24 -0.98 -1.34 0.00 0.00 175.22 173.16 2dip s ARG 75 N -3.55 2.38 0.71 1.99 1.04 -0.92 -2.40 118.95 118.20 2dip s ARG 75 Ca 0.32 -0.85 -0.10 0.00 -1.04 0.00 0.00 55.73 54.06 2dip s ARG 75 Cb -0.09 -2.04 0.04 0.00 -2.04 0.00 0.00 34.95 30.82 2dip s ARG 75 CO 0.25 0.37 1.07 -1.21 -0.04 0.00 0.00 175.30 175.74 2dip s GLU 76 N -0.16 2.53 1.02 3.89 2.02 -1.25 -4.40 118.70 122.35 2dip s GLU 76 Ca -0.03 0.18 -0.17 0.00 0.02 0.00 0.00 54.97 54.98 2dip s GLU 76 Cb -0.13 -2.07 0.01 0.00 0.10 0.00 0.00 34.13 32.04 2dip s GLU 76 CO 0.03 -1.16 -0.10 0.36 0.02 0.00 0.00 175.26 174.41 2dip n LYS 77 N -3.00 -0.63 -0.98 1.61 2.85 -1.26 -4.61 118.16 112.14 2dip n LYS 77 Ca 0.07 -0.16 -0.33 0.00 -1.05 0.00 0.00 58.31 56.84 2dip n LYS 77 Cb 0.59 -1.59 0.02 0.00 -0.65 0.00 0.00 35.03 33.40 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 -0.75 0.00 -2.60 -1.58 5.12 -1.26 -2.82 116.66 112.77 2dip n ARG 78 Ca 0.03 0.00 -0.14 0.00 -1.93 0.00 0.00 57.85 55.81 2dip n ARG 78 Cb 0.59 -0.88 0.01 0.00 -1.16 0.00 0.00 32.46 31.02 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 2.71 -4.38 -3.93 0.55 2.85 -1.26 -5.01 115.26 106.79 2dip n ASN 79 Ca 0.02 -0.13 -0.12 0.00 -0.11 0.00 0.00 54.58 54.24 2dip n ASN 79 Cb 0.46 -3.34 -0.08 0.00 1.24 0.00 0.00 39.78 38.06 2dip n ASN 79 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 2dip s GLN 80 N -5.09 1.45 0.37 1.20 -1.52 -1.13 -5.12 119.66 109.83 2dip s GLN 80 Ca 0.14 -1.56 0.05 0.00 -1.95 0.00 0.00 55.36 52.03 2dip s GLN 80 Cb -0.06 0.36 -0.07 0.00 -0.22 0.00 0.00 33.01 33.03 2dip s GLN 80 CO 0.17 -0.55 0.04 0.15 -0.25 0.00 0.00 175.29 174.85 2dip s LYS 81 N -3.90 1.82 1.04 2.91 1.02 -1.26 -4.85 119.74 116.52 2dip s LYS 81 Ca 0.33 -2.04 -0.13 0.00 0.02 0.00 0.00 55.97 54.15 2dip s LYS 81 Cb 0.03 -1.20 0.21 0.00 -0.52 0.00 0.00 37.83 36.35 2dip s LYS 81 CO 0.14 -0.16 1.09 -1.58 -0.92 0.00 0.00 175.35 173.92 2dip s TRP 82 N -3.03 1.87 -0.29 3.18 0.52 -1.26 -3.94 118.94 115.99 2dip s TRP 82 Ca 0.34 0.91 -0.25 0.00 0.02 0.00 0.00 56.10 57.11 2dip s TRP 82 Cb 0.09 -3.29 0.17 0.00 -1.15 0.00 0.00 33.47 29.28 2dip s TRP 82 CO 0.16 -3.09 1.32 -0.98 0.02 0.00 0.00 176.95 174.37 2dip s ARG 83 N -5.01 0.20 1.02 4.98 1.70 -1.01 -5.00 118.95 115.83 2dip s ARG 83 Ca 0.66 0.22 -0.18 0.00 -0.47 0.00 0.00 55.73 55.96 2dip s ARG 83 Cb -0.18 0.10 -0.04 0.00 -0.57 0.00 0.00 34.95 34.26 2dip s ARG 83 CO 0.58 -0.03 -0.39 0.43 -1.08 0.00 0.00 175.30 174.81 2dip n SER 84 N 1.70 -3.32 -4.90 -2.89 7.64 -1.26 -2.93 113.62 107.66 2dip n SER 84 Ca -0.10 0.11 -0.20 0.00 1.01 0.00 0.00 58.87 59.68 2dip n SER 84 Cb 0.57 -0.89 -0.02 0.00 -1.01 0.00 0.00 64.21 62.85 2dip n SER 84 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2dip s LEU 85 N 2.90 3.67 -0.17 -3.43 1.43 -1.26 -4.70 118.68 117.12 2dip s LEU 85 Ca 0.48 -0.45 -0.29 0.00 -1.03 0.00 0.00 54.13 52.84 2dip s LEU 85 Cb -0.11 -2.36 -0.02 0.00 0.03 0.00 0.00 46.19 43.72 2dip s LEU 85 CO 0.71 -0.45 1.36 -1.61 0.23 0.00 0.00 176.35 176.59 2dip s GLU 86 N -4.09 4.15 0.23 1.70 8.01 -1.26 -4.96 118.70 122.47 2dip s GLU 86 Ca 0.44 1.70 -0.31 0.00 0.01 0.00 0.00 54.97 56.81 2dip s GLU 86 Cb -0.07 -3.84 -0.12 0.00 -4.31 0.00 0.00 34.13 25.80 2dip s GLU 86 CO 0.28 -0.83 1.68 0.21 0.01 0.00 0.00 175.26 176.61 2dip s LYS 87 N 3.77 4.13 0.23 1.61 2.47 -1.26 -4.99 119.74 125.71 2dip s LYS 87 Ca 0.59 2.59 -0.13 0.00 -1.56 0.00 0.00 55.97 57.46 2dip s LYS 87 Cb -0.23 -3.06 -0.00 0.00 -1.46 0.00 0.00 37.83 33.07 2dip s LYS 87 CO 0.19 -0.71 0.46 0.50 0.16 0.00 0.00 175.35 175.95 2dip s ARG 88 N 0.73 1.48 -0.09 4.03 3.52 -1.26 -5.15 118.95 122.20 2dip s ARG 88 Ca 0.71 -1.18 -0.17 0.00 -0.13 0.00 0.00 55.73 54.96 2dip s ARG 88 Cb -0.49 0.47 -0.05 0.00 -1.56 0.00 0.00 34.95 33.32 2dip s ARG 88 CO 0.36 -0.61 0.44 0.00 -0.81 0.00 0.00 175.30 174.68 2dip s ALA 89 N -3.99 3.55 -0.47 6.12 0.00 -1.26 -4.99 121.76 120.72 2dip s ALA 89 Ca 0.20 -0.22 -0.31 0.00 0.00 0.00 0.00 51.96 51.62 2dip s ALA 89 Cb -0.00 -2.55 -0.11 0.00 0.00 0.00 0.00 23.12 20.46 2dip s ALA 89 CO 0.06 0.15 2.34 -0.25 0.00 0.00 0.00 175.76 178.06 2dip n ASP 90 N 3.11 2.02 -4.43 0.00 9.92 -1.26 -4.92 116.55 120.99 2dip n ASP 90 Ca -0.10 0.09 -0.33 0.00 -0.53 0.00 0.00 54.79 53.92 2dip n ASP 90 Cb 0.52 -1.34 -0.13 0.00 -0.64 0.00 0.00 41.12 39.53 2dip n ASP 90 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2dip s GLU 91 N 7.26 3.54 -0.59 -1.24 2.02 -1.26 -5.01 118.70 123.42 2dip s GLU 91 Ca 1.09 -0.59 -0.02 0.00 0.02 0.00 0.00 54.97 55.47 2dip s GLU 91 Cb -0.67 -2.81 0.36 0.00 0.10 0.00 0.00 34.13 31.11 2dip s GLU 91 CO 0.41 0.20 2.07 1.33 0.02 0.00 0.00 175.26 179.29 2dip n VAL 92 N 3.62 3.41 -5.16 2.63 0.24 -1.26 -4.79 118.33 117.03 2dip n VAL 92 Ca -0.18 -2.78 -0.32 0.00 -2.04 0.00 0.00 64.34 59.03 2dip n VAL 92 Cb 0.52 -1.24 -0.15 0.00 -1.47 0.00 0.00 33.84 31.50 2dip n VAL 92 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2dip s SER 93 N -1.13 3.38 0.00 -1.34 0.01 -1.26 -5.09 113.70 108.26 2dip s SER 93 Ca 0.55 -0.40 0.00 0.00 1.31 0.00 0.00 55.95 57.41 2dip s SER 93 Cb 0.43 -0.67 0.00 0.00 0.21 0.00 0.00 66.02 65.98 2dip s SER 93 CO -0.07 0.30 0.00 0.61 0.41 0.00 0.00 173.24 174.49 2dip n GLY 94 N 2.59 4.18 3.59 3.44 0.00 -1.26 -5.07 105.19 112.66 2dip n GLY 94 Ca -0.17 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.15 -1.38 -0.06 1.61 0.04 -1.26 -5.08 135.00 126.73 2dip s PRO 95 Ca 0.00 -0.12 -0.02 0.00 0.04 0.00 0.00 61.00 60.90 2dip s PRO 95 Cb 0.00 -1.58 0.03 0.00 0.04 0.00 0.00 34.50 32.99 2dip s PRO 95 CO 0.00 -3.81 0.06 -1.54 0.04 0.00 0.00 177.00 171.76 2dip s SER 96 N -3.93 1.33 -0.14 6.66 1.04 -1.26 -5.14 113.70 112.25 2dip s SER 96 Ca 0.71 -0.02 -0.29 0.00 0.48 0.00 0.00 55.95 56.83 2dip s SER 96 Cb -0.09 -0.17 0.10 0.00 0.10 0.00 0.00 66.02 65.97 2dip s SER 96 CO 0.56 -0.26 0.87 -0.44 0.98 0.00 0.00 173.24 174.95 2dip s SER 97 N 2.16 -0.51 0.00 7.02 0.01 -1.26 -5.38 113.70 115.74 2dip s SER 97 Ca 0.05 0.64 0.00 0.00 1.31 0.00 0.00 55.95 57.95 2dip s SER 97 Cb -0.13 0.54 0.00 0.00 0.21 0.00 0.00 66.02 66.64 2dip s SER 97 CO -0.04 -0.41 0.00 0.61 0.41 0.00 0.00 173.24 173.81